Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
582846 | 2mqu RC | 25050 | cing | 1-original | 7 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 1.429 0.732 0.505
2 HA2 GLY 1 HA2 GLY 1 2.401 -1.162 -1.466
3 HA3 GLY 1 HA3 GLY 1 1.577 0.241 -2.130
4 H CYS 2 H CYS 2 4.456 -0.959 -0.668
5 HA CYS 2 HA CYS 2 5.844 1.488 -1.392
6 HB2 CYS 2 HB2 CYS 2 6.955 1.666 0.816
7 HB3 CYS 2 HB3 CYS 2 5.221 1.956 0.908
8 H ILE 3 H ILE 3 8.192 1.237 -1.350
9 HA ILE 3 HA ILE 3 8.937 -1.473 -2.101
10 HB ILE 3 HB ILE 3 10.562 1.069 -2.245
11 HG12 ILE 3 HG12 ILE 3 9.694 -0.127 -4.758
12 HG13 ILE 3 HG13 ILE 3 8.336 0.364 -3.752
13 HG21 ILE 3 HG21 ILE 3 11.034 -1.586 -3.590
14 HG22 ILE 3 HG22 ILE 3 12.066 -0.159 -3.665
15 HG23 ILE 3 HG23 ILE 3 11.876 -1.030 -2.144
16 HD11 ILE 3 HD11 ILE 3 10.217 2.465 -3.702
17 HD12 ILE 3 HD12 ILE 3 10.021 1.963 -5.381
18 HD13 ILE 3 HD13 ILE 3 8.613 2.443 -4.434
19 H ALA 4 H ALA 4 9.850 -2.824 -0.716
20 HA ALA 4 HA ALA 4 10.790 -1.925 1.851
21 HB1 ALA 4 HB1 ALA 4 9.594 -4.176 1.125
22 HB2 ALA 4 HB2 ALA 4 11.265 -4.712 0.949
23 HB3 ALA 4 HB3 ALA 4 10.693 -4.104 2.503
24 H LYS 5 H LYS 5 12.918 -2.818 2.694
25 HA LYS 5 HA LYS 5 15.025 -1.814 1.038
26 HB2 LYS 5 HB2 LYS 5 16.486 -2.521 2.952
27 HB3 LYS 5 HB3 LYS 5 15.184 -1.423 3.391
28 HG2 LYS 5 HG2 LYS 5 14.333 -4.161 3.641
29 HG3 LYS 5 HG3 LYS 5 15.806 -3.869 4.568
30 HD2 LYS 5 HD2 LYS 5 13.824 -1.740 4.831
31 HD3 LYS 5 HD3 LYS 5 13.250 -3.308 5.402
32 HE2 LYS 5 HE2 LYS 5 14.247 -2.528 7.307
33 HE3 LYS 5 HE3 LYS 5 15.609 -3.369 6.569
34 HZ1 LYS 5 HZ1 LYS 5 16.293 -1.212 5.607
35 HZ2 LYS 5 HZ2 LYS 5 16.332 -1.231 7.298
36 HZ3 LYS 5 HZ3 LYS 5 15.066 -0.453 6.490
37 H ASN 6 H ASN 6 14.389 -3.502 -0.669
38 HA ASN 6 HA ASN 6 16.468 -5.340 -0.947
39 HB2 ASN 6 HB2 ASN 6 14.857 -6.389 0.885
40 HB3 ASN 6 HB3 ASN 6 13.957 -6.902 -0.539
41 HD21 ASN 6 HD21 ASN 6 14.404 -9.066 -0.058
42 HD22 ASN 6 HD22 ASN 6 15.958 -9.758 -0.361
43 H LYS 7 H LYS 7 13.273 -4.269 -1.786
44 HA LYS 7 HA LYS 7 13.303 -5.575 -4.374
45 HB2 LYS 7 HB2 LYS 7 11.357 -3.528 -3.295
46 HB3 LYS 7 HB3 LYS 7 11.127 -4.550 -4.708
47 HG2 LYS 7 HG2 LYS 7 11.689 -6.247 -2.516
48 HG3 LYS 7 HG3 LYS 7 10.469 -5.081 -1.998
49 HD2 LYS 7 HD2 LYS 7 9.124 -5.644 -3.986
50 HD3 LYS 7 HD3 LYS 7 10.330 -6.850 -4.440
51 HE2 LYS 7 HE2 LYS 7 9.423 -8.347 -3.070
52 HE3 LYS 7 HE3 LYS 7 9.535 -7.232 -1.709
53 HZ1 LYS 7 HZ1 LYS 7 7.368 -6.976 -3.694
54 HZ2 LYS 7 HZ2 LYS 7 7.416 -6.418 -2.099
55 HZ3 LYS 7 HZ3 LYS 7 7.237 -8.071 -2.411
56 H GLU 8 H GLU 8 13.446 -4.534 -6.366
57 HA GLU 8 HA GLU 8 15.308 -2.498 -6.623
58 HB2 GLU 8 HB2 GLU 8 14.871 -2.532 -8.921
59 HB3 GLU 8 HB3 GLU 8 14.431 -4.149 -8.389
60 HG2 GLU 8 HG2 GLU 8 12.067 -3.431 -8.303
61 HG3 GLU 8 HG3 GLU 8 12.553 -1.869 -8.961
62 H CYS 9 H CYS 9 15.120 -0.303 -7.292
63 HA CYS 9 HA CYS 9 12.537 0.999 -7.033
64 HB2 CYS 9 HB2 CYS 9 13.355 0.922 -4.716
65 HB3 CYS 9 HB3 CYS 9 14.851 1.705 -5.216
66 H ALA 10 H ALA 10 12.421 2.281 -8.742
67 HA ALA 10 HA ALA 10 14.840 3.284 -10.001
68 HB1 ALA 10 HB1 ALA 10 12.337 4.186 -11.165
69 HB2 ALA 10 HB2 ALA 10 13.658 3.271 -11.891
70 HB3 ALA 10 HB3 ALA 10 12.404 2.434 -10.977
71 H TRP 11 H TRP 11 15.303 5.464 -10.356
72 HA TRP 11 HA TRP 11 14.670 7.219 -8.241
73 HB2 TRP 11 HB2 TRP 11 16.147 7.448 -10.823
74 HB3 TRP 11 HB3 TRP 11 15.677 8.935 -10.003
75 HD1 TRP 11 HD1 TRP 11 16.472 6.213 -7.585
76 HE1 TRP 11 HE1 TRP 11 18.795 6.606 -6.546
77 HE3 TRP 11 HE3 TRP 11 18.150 9.890 -10.715
78 HZ2 TRP 11 HZ2 TRP 11 21.040 8.256 -6.995
79 HZ3 TRP 11 HZ3 TRP 11 20.397 10.823 -10.342
80 HH2 TRP 11 HH2 TRP 11 21.810 10.021 -8.519
81 H PHE 12 H PHE 12 12.952 6.398 -11.033
82 HA PHE 12 HA PHE 12 11.147 8.676 -10.611
83 HB2 PHE 12 HB2 PHE 12 12.730 8.685 -12.755
84 HB3 PHE 12 HB3 PHE 12 11.461 7.641 -13.387
85 HD1 PHE 12 HD2 PHE 12 12.079 10.964 -11.868
86 HD2 PHE 12 HD1 PHE 12 9.465 8.540 -14.193
87 HE1 PHE 12 HE2 PHE 12 10.725 12.946 -12.407
88 HE2 PHE 12 HE1 PHE 12 8.107 10.518 -14.737
89 HZ PHE 12 HZ PHE 12 8.736 12.725 -13.842
90 H SER 13 H SER 13 11.237 5.734 -9.901
91 HA SER 13 HA SER 13 9.384 4.278 -11.392
92 HB2 SER 13 HB2 SER 13 9.076 2.924 -9.329
93 HB3 SER 13 HB3 SER 13 10.775 3.215 -9.702
94 HG SER 13 HG SER 13 10.814 3.874 -7.698
95 H GLY 14 H GLY 14 8.925 6.913 -9.221
96 HA2 GLY 14 HA2 GLY 14 6.951 8.181 -9.079
97 HA3 GLY 14 HA3 GLY 14 6.055 6.821 -9.740
98 H GLU 15 H GLU 15 7.533 5.082 -7.699
99 HA GLU 15 HA GLU 15 5.647 5.607 -5.516
100 HB2 GLU 15 HB2 GLU 15 6.331 3.229 -4.835
101 HB3 GLU 15 HB3 GLU 15 5.347 3.412 -6.281
102 HG2 GLU 15 HG2 GLU 15 8.228 3.461 -6.777
103 HG3 GLU 15 HG3 GLU 15 7.628 1.945 -6.109
104 H TRP 16 H TRP 16 6.613 4.590 -3.344
105 HA TRP 16 HA TRP 16 9.348 5.603 -2.980
106 HB2 TRP 16 HB2 TRP 16 7.201 6.093 -0.926
107 HB3 TRP 16 HB3 TRP 16 8.783 6.855 -1.063
108 HD1 TRP 16 HD1 TRP 16 8.815 7.996 -3.908
109 HE1 TRP 16 HE1 TRP 16 7.165 9.824 -4.657
110 HE3 TRP 16 HE3 TRP 16 5.152 7.263 -0.417
111 HZ2 TRP 16 HZ2 TRP 16 4.644 10.824 -3.871
112 HZ3 TRP 16 HZ3 TRP 16 3.154 8.698 -0.485
113 HH2 TRP 16 HH2 TRP 16 2.908 10.441 -2.177
114 H CYS 17 H CYS 17 10.406 4.790 -1.032
115 HA CYS 17 HA CYS 17 9.847 1.994 -0.657
116 HB2 CYS 17 HB2 CYS 17 11.880 3.605 0.877
117 HB3 CYS 17 HB3 CYS 17 11.912 1.886 0.497
118 H CYS 18 H CYS 18 9.748 1.012 1.519
119 HA CYS 18 HA CYS 18 7.638 2.154 3.034
120 HB2 CYS 18 HB2 CYS 18 9.469 -0.123 3.817
121 HB3 CYS 18 HB3 CYS 18 7.880 0.226 4.490
122 H GLY 19 H GLY 19 7.803 2.368 5.476
123 HA2 GLY 19 HA2 GLY 19 8.588 3.613 7.240
124 HA3 GLY 19 HA3 GLY 19 10.147 2.900 6.851
125 H ALA 20 H ALA 20 11.724 4.196 6.141
126 HA ALA 20 HA ALA 20 11.093 6.706 4.822
127 HB1 ALA 20 HB1 ALA 20 12.233 6.535 7.572
128 HB2 ALA 20 HB2 ALA 20 12.754 7.835 6.499
129 HB3 ALA 20 HB3 ALA 20 11.048 7.662 6.912
130 H LEU 21 H LEU 21 12.399 4.269 4.017
131 HA LEU 21 HA LEU 21 15.227 4.959 3.866
132 HB2 LEU 21 HB2 LEU 21 13.907 2.585 2.589
133 HB3 LEU 21 HB3 LEU 21 15.598 2.786 3.044
134 HG LEU 21 HG LEU 21 13.486 2.754 5.160
135 HD11 LEU 21 HD11 LEU 21 14.776 0.188 4.473
136 HD12 LEU 21 HD12 LEU 21 13.485 0.736 3.403
137 HD13 LEU 21 HD13 LEU 21 13.170 0.517 5.125
138 HD21 LEU 21 HD21 LEU 21 15.217 2.554 6.565
139 HD22 LEU 21 HD22 LEU 21 16.195 3.105 5.204
140 HD23 LEU 21 HD23 LEU 21 16.039 1.379 5.538
141 H SER 22 H SER 22 16.346 4.960 1.802
142 HA SER 22 HA SER 22 14.641 6.019 -0.354
143 HB2 SER 22 HB2 SER 22 16.296 7.612 0.648
144 HB3 SER 22 HB3 SER 22 17.588 6.552 0.084
145 HG SER 22 HG SER 22 15.629 7.729 -1.598
146 H CYS 23 H CYS 23 16.148 5.905 -2.516
147 HA CYS 23 HA CYS 23 16.571 3.028 -2.899
148 HB2 CYS 23 HB2 CYS 23 16.416 5.077 -5.098
149 HB3 CYS 23 HB3 CYS 23 16.103 3.347 -5.187
150 H LYS 24 H LYS 24 18.610 2.397 -2.665
151 HA LYS 24 HA LYS 24 20.735 4.090 -3.809
152 HB2 LYS 24 HB2 LYS 24 21.296 2.169 -1.585
153 HB3 LYS 24 HB3 LYS 24 22.154 3.638 -2.031
154 HG2 LYS 24 HG2 LYS 24 21.133 4.391 -0.158
155 HG3 LYS 24 HG3 LYS 24 19.848 4.742 -1.316
156 HD2 LYS 24 HD2 LYS 24 18.701 2.704 -0.736
157 HD3 LYS 24 HD3 LYS 24 20.036 2.205 0.305
158 HE2 LYS 24 HE2 LYS 24 18.515 4.756 0.762
159 HE3 LYS 24 HE3 LYS 24 17.982 3.216 1.433
160 HZ1 LYS 24 HZ1 LYS 24 20.091 4.943 2.300
161 HZ2 LYS 24 HZ2 LYS 24 20.623 3.351 2.091
162 HZ3 LYS 24 HZ3 LYS 24 19.326 3.680 3.126
163 H TYR 25 H TYR 25 22.712 2.849 -4.420
164 HA TYR 25 HA TYR 25 21.942 0.585 -6.028
165 HB2 TYR 25 HB2 TYR 25 23.471 2.251 -6.942
166 HB3 TYR 25 HB3 TYR 25 24.624 1.933 -5.651
167 HD1 TYR 25 HD1 TYR 25 25.931 -0.138 -5.632
168 HD2 TYR 25 HD2 TYR 25 23.248 0.747 -8.814
169 HE1 TYR 25 HE1 TYR 25 26.996 -1.878 -7.006
170 HE2 TYR 25 HE2 TYR 25 24.305 -0.992 -10.196
171 HH TYR 25 HH TYR 25 26.172 -2.311 -10.385
172 H SER 26 H SER 26 22.281 -1.511 -5.619
173 HA SER 26 HA SER 26 23.776 -2.199 -3.177
174 HB2 SER 26 HB2 SER 26 21.289 -3.275 -4.408
175 HB3 SER 26 HB3 SER 26 22.349 -4.425 -3.594
176 HG SER 26 HG SER 26 21.009 -2.184 -2.529
177 H ILE 27 H ILE 27 25.808 -2.536 -3.964
178 HA ILE 27 HA ILE 27 26.541 -3.693 -6.369
179 HB ILE 27 HB ILE 27 28.107 -4.114 -3.833
180 HG12 ILE 27 HG12 ILE 27 29.079 -1.795 -4.989
181 HG13 ILE 27 HG13 ILE 27 27.334 -1.611 -5.132
182 HG21 ILE 27 HG21 ILE 27 29.872 -4.555 -5.159
183 HG22 ILE 27 HG22 ILE 27 28.632 -4.921 -6.357
184 HG23 ILE 27 HG23 ILE 27 29.413 -3.340 -6.352
185 HD11 ILE 27 HD11 ILE 27 27.539 -0.732 -3.080
186 HD12 ILE 27 HD12 ILE 27 27.524 -2.421 -2.573
187 HD13 ILE 27 HD13 ILE 27 29.057 -1.568 -2.755
188 H LYS 28 H LYS 28 26.008 -5.269 -3.231
189 HA LYS 28 HA LYS 28 26.710 -7.865 -3.948
190 HB2 LYS 28 HB2 LYS 28 25.086 -8.537 -2.109
191 HB3 LYS 28 HB3 LYS 28 26.370 -7.426 -1.651
192 HG2 LYS 28 HG2 LYS 28 24.919 -5.867 -1.030
193 HG3 LYS 28 HG3 LYS 28 24.002 -6.017 -2.531
194 HD2 LYS 28 HD2 LYS 28 22.468 -7.377 -1.601
195 HD3 LYS 28 HD3 LYS 28 23.675 -8.257 -0.660
196 HE2 LYS 28 HE2 LYS 28 22.838 -5.462 0.050
197 HE3 LYS 28 HE3 LYS 28 21.943 -6.871 0.618
198 HZ1 LYS 28 HZ1 LYS 28 24.742 -7.161 1.056
199 HZ2 LYS 28 HZ2 LYS 28 23.468 -7.260 2.163
200 HZ3 LYS 28 HZ3 LYS 28 24.153 -5.758 1.795
201 H ARG 29 H ARG 29 23.720 -6.093 -4.455
202 HA ARG 29 HA ARG 29 22.453 -8.450 -5.631
203 HB2 ARG 29 HB2 ARG 29 21.366 -5.681 -5.085
204 HB3 ARG 29 HB3 ARG 29 20.435 -7.016 -5.751
205 HG2 ARG 29 HG2 ARG 29 21.677 -7.912 -3.361
206 HG3 ARG 29 HG3 ARG 29 20.894 -6.364 -3.038
207 HD2 ARG 29 HD2 ARG 29 19.430 -8.346 -2.667
208 HD3 ARG 29 HD3 ARG 29 18.794 -7.185 -3.831
209 HE ARG 29 HE ARG 29 20.287 -9.267 -5.090
210 HH11 ARG 29 HH11 ARG 29 17.192 -8.469 -3.709
211 HH12 ARG 29 HH12 ARG 29 16.324 -9.632 -4.655
212 HH21 ARG 29 HH21 ARG 29 19.156 -10.802 -6.341
213 HH22 ARG 29 HH22 ARG 29 17.442 -10.959 -6.152
214 H ASN 30 H ASN 30 24.593 -6.300 -6.685
215 HA ASN 30 HA ASN 30 25.084 -5.256 -8.667
216 HB2 ASN 30 HB2 ASN 30 24.910 -6.742 -10.605
217 HB3 ASN 30 HB3 ASN 30 25.459 -7.633 -9.188
218 HD21 ASN 30 HD21 ASN 30 22.961 -7.219 -11.515
219 HD22 ASN 30 HD22 ASN 30 21.992 -8.566 -11.035
220 H LEU 31 H LEU 31 22.550 -4.461 -7.556
221 HA LEU 31 HA LEU 31 21.380 -3.337 -9.955
222 HB2 LEU 31 HB2 LEU 31 19.762 -5.009 -8.039
223 HB3 LEU 31 HB3 LEU 31 19.083 -3.983 -9.301
224 HG LEU 31 HG LEU 31 20.923 -6.300 -9.866
225 HD11 LEU 31 HD11 LEU 31 17.998 -6.212 -9.370
226 HD12 LEU 31 HD12 LEU 31 19.169 -7.487 -9.032
227 HD13 LEU 31 HD13 LEU 31 18.587 -7.239 -10.678
228 HD21 LEU 31 HD21 LEU 31 20.759 -5.708 -12.004
229 HD22 LEU 31 HD22 LEU 31 20.056 -4.189 -11.448
230 HD23 LEU 31 HD23 LEU 31 19.007 -5.535 -11.893
231 H LYS 32 H LYS 32 19.144 -2.177 -8.940
232 HA LYS 32 HA LYS 32 20.186 -0.524 -6.733
233 HB2 LYS 32 HB2 LYS 32 18.366 0.305 -9.002
234 HB3 LYS 32 HB3 LYS 32 18.887 1.345 -7.683
235 HG2 LYS 32 HG2 LYS 32 20.353 1.960 -9.323
236 HG3 LYS 32 HG3 LYS 32 21.281 0.696 -8.512
237 HD2 LYS 32 HD2 LYS 32 21.009 -0.797 -10.235
238 HD3 LYS 32 HD3 LYS 32 19.490 -0.071 -10.767
239 HE2 LYS 32 HE2 LYS 32 21.369 1.936 -11.125
240 HE3 LYS 32 HE3 LYS 32 22.211 0.469 -11.619
241 HZ1 LYS 32 HZ1 LYS 32 19.746 0.238 -12.758
242 HZ2 LYS 32 HZ2 LYS 32 21.163 0.716 -13.549
243 HZ3 LYS 32 HZ3 LYS 32 20.102 1.882 -12.936
244 H ILE 33 H ILE 33 19.139 -0.955 -4.911
245 HA ILE 33 HA ILE 33 16.212 -1.195 -5.001
246 HB ILE 33 HB ILE 33 16.144 -3.035 -3.539
247 HG12 ILE 33 HG12 ILE 33 19.094 -2.547 -3.116
248 HG13 ILE 33 HG13 ILE 33 17.803 -2.440 -1.923
249 HG21 ILE 33 HG21 ILE 33 16.909 -3.434 -5.955
250 HG22 ILE 33 HG22 ILE 33 18.489 -3.776 -5.253
251 HG23 ILE 33 HG23 ILE 33 17.094 -4.754 -4.800
252 HD11 ILE 33 HD11 ILE 33 17.535 -5.004 -2.675
253 HD12 ILE 33 HD12 ILE 33 19.267 -4.780 -2.927
254 HD13 ILE 33 HD13 ILE 33 18.559 -4.470 -1.342
255 H CYS 34 H CYS 34 15.330 -1.106 -2.651
256 HA CYS 34 HA CYS 34 16.362 1.334 -1.490
257 HB2 CYS 34 HB2 CYS 34 13.941 -0.375 -0.927
258 HB3 CYS 34 HB3 CYS 34 14.370 1.004 0.080
259 H VAL 35 H VAL 35 16.677 1.539 0.859
260 HA VAL 35 HA VAL 35 17.418 -0.906 2.262
261 HB VAL 35 HB VAL 35 19.401 1.351 1.958
262 HG11 VAL 35 HG11 VAL 35 20.139 0.440 3.876
263 HG12 VAL 35 HG12 VAL 35 19.238 -1.058 3.631
264 HG13 VAL 35 HG13 VAL 35 20.786 -0.815 2.821
265 HG21 VAL 35 HG21 VAL 35 19.133 0.155 -0.157
266 HG22 VAL 35 HG22 VAL 35 20.705 -0.178 0.568
267 HG23 VAL 35 HG23 VAL 35 19.417 -1.378 0.668
Start of MODEL 2
1 H1 GLY 1 H GLY 1 1.811 -0.001 0.854
2 HA2 GLY 1 HA2 GLY 1 2.298 -1.019 -1.519
3 HA3 GLY 1 HA3 GLY 1 1.456 0.440 -2.019
4 H CYS 2 H CYS 2 4.393 -0.893 -0.781
5 HA CYS 2 HA CYS 2 5.802 1.541 -1.469
6 HB2 CYS 2 HB2 CYS 2 6.959 1.684 0.719
7 HB3 CYS 2 HB3 CYS 2 5.233 2.008 0.845
8 H ILE 3 H ILE 3 8.164 1.245 -1.409
9 HA ILE 3 HA ILE 3 8.840 -1.471 -2.217
10 HB ILE 3 HB ILE 3 10.508 1.043 -2.359
11 HG12 ILE 3 HG12 ILE 3 9.629 -0.093 -4.882
12 HG13 ILE 3 HG13 ILE 3 8.261 0.342 -3.863
13 HG21 ILE 3 HG21 ILE 3 11.803 -1.060 -2.284
14 HG22 ILE 3 HG22 ILE 3 10.923 -1.622 -3.704
15 HG23 ILE 3 HG23 ILE 3 11.969 -0.207 -3.818
16 HD11 ILE 3 HD11 ILE 3 10.154 2.460 -3.788
17 HD12 ILE 3 HD12 ILE 3 9.850 2.020 -5.469
18 HD13 ILE 3 HD13 ILE 3 8.507 2.462 -4.416
19 H ALA 4 H ALA 4 9.770 -2.855 -0.875
20 HA ALA 4 HA ALA 4 10.734 -2.014 1.701
21 HB1 ALA 4 HB1 ALA 4 10.014 -4.061 2.175
22 HB2 ALA 4 HB2 ALA 4 9.916 -4.483 0.465
23 HB3 ALA 4 HB3 ALA 4 11.434 -4.690 1.339
24 H LYS 5 H LYS 5 12.865 -2.841 2.523
25 HA LYS 5 HA LYS 5 14.958 -1.854 0.842
26 HB2 LYS 5 HB2 LYS 5 16.433 -2.535 2.758
27 HB3 LYS 5 HB3 LYS 5 15.133 -1.430 3.187
28 HG2 LYS 5 HG2 LYS 5 14.354 -4.210 3.471
29 HG3 LYS 5 HG3 LYS 5 15.759 -3.794 4.455
30 HD2 LYS 5 HD2 LYS 5 13.402 -1.964 4.436
31 HD3 LYS 5 HD3 LYS 5 13.325 -3.454 5.379
32 HE2 LYS 5 HE2 LYS 5 15.727 -1.717 5.652
33 HE3 LYS 5 HE3 LYS 5 14.227 -1.202 6.422
34 HZ1 LYS 5 HZ1 LYS 5 15.916 -3.524 7.011
35 HZ2 LYS 5 HZ2 LYS 5 14.252 -3.652 7.288
36 HZ3 LYS 5 HZ3 LYS 5 15.150 -2.452 8.073
37 H ASN 6 H ASN 6 14.355 -3.547 -0.853
38 HA ASN 6 HA ASN 6 16.432 -5.395 -1.091
39 HB2 ASN 6 HB2 ASN 6 14.788 -6.429 0.719
40 HB3 ASN 6 HB3 ASN 6 13.905 -6.940 -0.717
41 HD21 ASN 6 HD21 ASN 6 14.356 -9.103 -0.102
42 HD22 ASN 6 HD22 ASN 6 15.899 -9.807 -0.427
43 H LYS 7 H LYS 7 13.249 -4.324 -1.983
44 HA LYS 7 HA LYS 7 13.337 -5.626 -4.575
45 HB2 LYS 7 HB2 LYS 7 11.339 -3.582 -3.603
46 HB3 LYS 7 HB3 LYS 7 11.145 -4.721 -4.929
47 HG2 LYS 7 HG2 LYS 7 11.727 -6.197 -2.574
48 HG3 LYS 7 HG3 LYS 7 10.442 -5.042 -2.208
49 HD2 LYS 7 HD2 LYS 7 9.049 -5.904 -3.907
50 HD3 LYS 7 HD3 LYS 7 10.376 -6.806 -4.645
51 HE2 LYS 7 HE2 LYS 7 9.080 -8.405 -3.496
52 HE3 LYS 7 HE3 LYS 7 10.494 -8.122 -2.482
53 HZ1 LYS 7 HZ1 LYS 7 8.949 -7.886 -0.890
54 HZ2 LYS 7 HZ2 LYS 7 7.705 -7.521 -1.976
55 HZ3 LYS 7 HZ3 LYS 7 8.795 -6.317 -1.503
56 H GLU 8 H GLU 8 13.490 -4.569 -6.560
57 HA GLU 8 HA GLU 8 15.327 -2.503 -6.774
58 HB2 GLU 8 HB2 GLU 8 14.921 -2.523 -9.082
59 HB3 GLU 8 HB3 GLU 8 14.523 -4.155 -8.565
60 HG2 GLU 8 HG2 GLU 8 12.138 -3.517 -8.512
61 HG3 GLU 8 HG3 GLU 8 12.581 -1.931 -9.141
62 H CYS 9 H CYS 9 15.112 -0.308 -7.442
63 HA CYS 9 HA CYS 9 12.505 0.950 -7.224
64 HB2 CYS 9 HB2 CYS 9 13.231 0.899 -4.896
65 HB3 CYS 9 HB3 CYS 9 14.769 1.633 -5.337
66 H ALA 10 H ALA 10 12.352 2.465 -8.735
67 HA ALA 10 HA ALA 10 14.786 3.421 -10.034
68 HB1 ALA 10 HB1 ALA 10 13.576 3.663 -11.922
69 HB2 ALA 10 HB2 ALA 10 12.483 2.542 -11.110
70 HB3 ALA 10 HB3 ALA 10 12.160 4.275 -11.066
71 H TRP 11 H TRP 11 15.271 5.605 -10.315
72 HA TRP 11 HA TRP 11 14.664 7.296 -8.143
73 HB2 TRP 11 HB2 TRP 11 16.128 7.592 -10.723
74 HB3 TRP 11 HB3 TRP 11 15.667 9.060 -9.865
75 HD1 TRP 11 HD1 TRP 11 16.465 6.266 -7.527
76 HE1 TRP 11 HE1 TRP 11 18.790 6.627 -6.484
77 HE3 TRP 11 HE3 TRP 11 18.134 10.037 -10.549
78 HZ2 TRP 11 HZ2 TRP 11 21.035 8.290 -6.888
79 HZ3 TRP 11 HZ3 TRP 11 20.381 10.957 -10.154
80 HH2 TRP 11 HH2 TRP 11 21.800 10.101 -8.361
81 H PHE 12 H PHE 12 12.922 6.583 -10.951
82 HA PHE 12 HA PHE 12 11.120 8.839 -10.424
83 HB2 PHE 12 HB2 PHE 12 12.711 8.976 -12.556
84 HB3 PHE 12 HB3 PHE 12 11.453 7.960 -13.252
85 HD1 PHE 12 HD2 PHE 12 12.091 11.218 -11.627
86 HD2 PHE 12 HD1 PHE 12 9.400 8.869 -13.941
87 HE1 PHE 12 HE2 PHE 12 10.726 13.218 -12.063
88 HE2 PHE 12 HE1 PHE 12 8.031 10.865 -14.382
89 HZ PHE 12 HZ PHE 12 8.693 13.043 -13.442
90 H SER 13 H SER 13 11.168 5.907 -9.810
91 HA SER 13 HA SER 13 9.344 4.508 -11.408
92 HB2 SER 13 HB2 SER 13 9.276 2.901 -9.698
93 HB3 SER 13 HB3 SER 13 10.858 3.652 -9.490
94 HG SER 13 HG SER 13 10.200 3.997 -7.527
95 H GLY 14 H GLY 14 8.863 7.089 -9.209
96 HA2 GLY 14 HA2 GLY 14 6.874 8.334 -9.050
97 HA3 GLY 14 HA3 GLY 14 5.988 6.960 -9.696
98 H GLU 15 H GLU 15 7.495 5.233 -7.678
99 HA GLU 15 HA GLU 15 5.666 5.786 -5.448
100 HB2 GLU 15 HB2 GLU 15 6.247 3.382 -4.810
101 HB3 GLU 15 HB3 GLU 15 5.272 3.611 -6.255
102 HG2 GLU 15 HG2 GLU 15 7.109 3.172 -7.677
103 HG3 GLU 15 HG3 GLU 15 8.253 3.262 -6.339
104 H TRP 16 H TRP 16 6.655 4.711 -3.316
105 HA TRP 16 HA TRP 16 9.436 5.612 -3.023
106 HB2 TRP 16 HB2 TRP 16 7.365 6.168 -0.908
107 HB3 TRP 16 HB3 TRP 16 8.976 6.861 -1.074
108 HD1 TRP 16 HD1 TRP 16 8.990 8.030 -3.910
109 HE1 TRP 16 HE1 TRP 16 7.408 9.940 -4.597
110 HE3 TRP 16 HE3 TRP 16 5.388 7.428 -0.332
111 HZ2 TRP 16 HZ2 TRP 16 4.958 11.046 -3.737
112 HZ3 TRP 16 HZ3 TRP 16 3.458 8.954 -0.334
113 HH2 TRP 16 HH2 TRP 16 3.249 10.726 -2.001
114 H CYS 17 H CYS 17 10.498 4.760 -1.077
115 HA CYS 17 HA CYS 17 9.859 1.977 -0.728
116 HB2 CYS 17 HB2 CYS 17 11.965 3.479 0.810
117 HB3 CYS 17 HB3 CYS 17 11.945 1.779 0.353
118 H CYS 18 H CYS 18 9.669 0.954 1.387
119 HA CYS 18 HA CYS 18 7.646 2.125 2.957
120 HB2 CYS 18 HB2 CYS 18 9.477 -0.177 3.664
121 HB3 CYS 18 HB3 CYS 18 7.949 0.206 4.450
122 H GLY 19 H GLY 19 7.800 2.438 5.355
123 HA2 GLY 19 HA2 GLY 19 8.615 3.678 7.107
124 HA3 GLY 19 HA3 GLY 19 10.158 2.921 6.738
125 H ALA 20 H ALA 20 11.769 4.184 6.061
126 HA ALA 20 HA ALA 20 11.199 6.682 4.682
127 HB1 ALA 20 HB1 ALA 20 12.392 8.081 6.209
128 HB2 ALA 20 HB2 ALA 20 11.164 7.203 7.122
129 HB3 ALA 20 HB3 ALA 20 12.852 6.697 7.200
130 H LEU 21 H LEU 21 12.406 4.266 3.813
131 HA LEU 21 HA LEU 21 15.267 4.845 3.693
132 HB2 LEU 21 HB2 LEU 21 13.879 2.524 2.395
133 HB3 LEU 21 HB3 LEU 21 15.569 2.665 2.872
134 HG LEU 21 HG LEU 21 13.401 2.662 4.940
135 HD11 LEU 21 HD11 LEU 21 13.037 0.452 4.835
136 HD12 LEU 21 HD12 LEU 21 14.706 0.092 4.393
137 HD13 LEU 21 HD13 LEU 21 13.563 0.622 3.160
138 HD21 LEU 21 HD21 LEU 21 15.181 2.875 6.251
139 HD22 LEU 21 HD22 LEU 21 16.278 2.676 4.884
140 HD23 LEU 21 HD23 LEU 21 15.680 1.259 5.748
141 H SER 22 H SER 22 16.388 4.863 1.645
142 HA SER 22 HA SER 22 14.716 5.968 -0.513
143 HB2 SER 22 HB2 SER 22 17.434 6.648 0.503
144 HB3 SER 22 HB3 SER 22 17.140 6.827 -1.227
145 HG SER 22 HG SER 22 15.114 7.969 -0.336
146 H CYS 23 H CYS 23 16.186 5.821 -2.681
147 HA CYS 23 HA CYS 23 16.566 2.940 -3.072
148 HB2 CYS 23 HB2 CYS 23 16.417 5.000 -5.263
149 HB3 CYS 23 HB3 CYS 23 16.087 3.273 -5.358
150 H LYS 24 H LYS 24 18.629 2.435 -2.594
151 HA LYS 24 HA LYS 24 20.758 4.045 -3.841
152 HB2 LYS 24 HB2 LYS 24 21.253 2.128 -1.590
153 HB3 LYS 24 HB3 LYS 24 22.185 3.542 -2.066
154 HG2 LYS 24 HG2 LYS 24 21.200 4.466 -0.276
155 HG3 LYS 24 HG3 LYS 24 19.855 4.713 -1.392
156 HD2 LYS 24 HD2 LYS 24 18.970 2.476 -0.645
157 HD3 LYS 24 HD3 LYS 24 20.204 2.495 0.617
158 HE2 LYS 24 HE2 LYS 24 18.193 4.703 0.243
159 HE3 LYS 24 HE3 LYS 24 17.915 3.316 1.295
160 HZ1 LYS 24 HZ1 LYS 24 19.094 4.288 2.876
161 HZ2 LYS 24 HZ2 LYS 24 19.270 5.660 1.904
162 HZ3 LYS 24 HZ3 LYS 24 20.438 4.437 1.859
163 H TYR 25 H TYR 25 22.747 2.763 -4.396
164 HA TYR 25 HA TYR 25 21.968 0.524 -6.035
165 HB2 TYR 25 HB2 TYR 25 23.547 2.155 -6.917
166 HB3 TYR 25 HB3 TYR 25 24.660 1.831 -5.593
167 HD1 TYR 25 HD2 TYR 25 25.961 -0.236 -5.537
168 HD2 TYR 25 HD1 TYR 25 23.336 0.620 -8.775
169 HE1 TYR 25 HE2 TYR 25 27.043 -1.995 -6.872
170 HE2 TYR 25 HE1 TYR 25 24.410 -1.139 -10.118
171 HH TYR 25 HH TYR 25 26.023 -2.659 -10.210
172 H SER 26 H SER 26 22.283 -1.583 -5.648
173 HA SER 26 HA SER 26 23.681 -2.310 -3.160
174 HB2 SER 26 HB2 SER 26 21.237 -3.354 -4.501
175 HB3 SER 26 HB3 SER 26 22.256 -4.520 -3.658
176 HG SER 26 HG SER 26 21.636 -2.148 -2.331
177 H ILE 27 H ILE 27 25.738 -2.671 -3.854
178 HA ILE 27 HA ILE 27 26.550 -3.809 -6.251
179 HB ILE 27 HB ILE 27 28.030 -4.242 -3.666
180 HG12 ILE 27 HG12 ILE 27 29.044 -1.920 -4.775
181 HG13 ILE 27 HG13 ILE 27 27.306 -1.732 -4.979
182 HG21 ILE 27 HG21 ILE 27 28.662 -5.099 -6.111
183 HG22 ILE 27 HG22 ILE 27 29.354 -3.481 -6.200
184 HG23 ILE 27 HG23 ILE 27 29.876 -4.594 -4.937
185 HD11 ILE 27 HD11 ILE 27 27.438 -0.863 -2.917
186 HD12 ILE 27 HD12 ILE 27 27.403 -2.554 -2.419
187 HD13 ILE 27 HD13 ILE 27 28.942 -1.703 -2.542
188 H LYS 28 H LYS 28 25.876 -5.387 -3.144
189 HA LYS 28 HA LYS 28 26.598 -7.989 -3.864
190 HB2 LYS 28 HB2 LYS 28 25.056 -8.694 -2.026
191 HB3 LYS 28 HB3 LYS 28 26.212 -7.454 -1.558
192 HG2 LYS 28 HG2 LYS 28 23.637 -6.434 -2.527
193 HG3 LYS 28 HG3 LYS 28 23.560 -7.367 -1.030
194 HD2 LYS 28 HD2 LYS 28 25.701 -5.805 -0.518
195 HD3 LYS 28 HD3 LYS 28 24.771 -4.731 -1.567
196 HE2 LYS 28 HE2 LYS 28 23.836 -4.171 0.429
197 HE3 LYS 28 HE3 LYS 28 22.795 -5.532 0.016
198 HZ1 LYS 28 HZ1 LYS 28 24.569 -5.240 2.209
199 HZ2 LYS 28 HZ2 LYS 28 24.971 -6.617 1.313
200 HZ3 LYS 28 HZ3 LYS 28 23.406 -6.437 1.929
201 H ARG 29 H ARG 29 23.716 -6.139 -4.530
202 HA ARG 29 HA ARG 29 22.403 -8.492 -5.680
203 HB2 ARG 29 HB2 ARG 29 21.397 -5.720 -5.036
204 HB3 ARG 29 HB3 ARG 29 20.444 -6.909 -5.913
205 HG2 ARG 29 HG2 ARG 29 21.357 -8.223 -3.620
206 HG3 ARG 29 HG3 ARG 29 20.849 -6.619 -3.088
207 HD2 ARG 29 HD2 ARG 29 18.671 -7.006 -3.560
208 HD3 ARG 29 HD3 ARG 29 19.044 -7.989 -4.975
209 HE ARG 29 HE ARG 29 19.700 -9.258 -2.482
210 HH11 ARG 29 HH11 ARG 29 17.190 -8.666 -4.820
211 HH12 ARG 29 HH12 ARG 29 16.273 -10.071 -4.386
212 HH21 ARG 29 HH21 ARG 29 18.502 -11.110 -1.901
213 HH22 ARG 29 HH22 ARG 29 17.020 -11.460 -2.724
214 H ASN 30 H ASN 30 24.597 -6.367 -6.688
215 HA ASN 30 HA ASN 30 25.149 -5.339 -8.661
216 HB2 ASN 30 HB2 ASN 30 25.004 -6.826 -10.597
217 HB3 ASN 30 HB3 ASN 30 25.497 -7.726 -9.166
218 HD21 ASN 30 HD21 ASN 30 23.067 -7.260 -11.557
219 HD22 ASN 30 HD22 ASN 30 22.062 -8.591 -11.106
220 H LEU 31 H LEU 31 22.589 -4.522 -7.605
221 HA LEU 31 HA LEU 31 21.500 -3.366 -10.027
222 HB2 LEU 31 HB2 LEU 31 19.804 -5.038 -8.179
223 HB3 LEU 31 HB3 LEU 31 19.181 -4.004 -9.463
224 HG LEU 31 HG LEU 31 21.017 -6.342 -9.957
225 HD11 LEU 31 HD11 LEU 31 18.074 -6.208 -9.596
226 HD12 LEU 31 HD12 LEU 31 19.207 -7.503 -9.212
227 HD13 LEU 31 HD13 LEU 31 18.705 -7.239 -10.881
228 HD21 LEU 31 HD21 LEU 31 20.320 -4.222 -11.571
229 HD22 LEU 31 HD22 LEU 31 19.187 -5.486 -12.050
230 HD23 LEU 31 HD23 LEU 31 20.924 -5.787 -12.115
231 H LYS 32 H LYS 32 19.247 -2.194 -9.075
232 HA LYS 32 HA LYS 32 20.238 -0.566 -6.827
233 HB2 LYS 32 HB2 LYS 32 18.401 0.311 -9.062
234 HB3 LYS 32 HB3 LYS 32 19.043 1.328 -7.779
235 HG2 LYS 32 HG2 LYS 32 20.492 1.873 -9.435
236 HG3 LYS 32 HG3 LYS 32 21.350 0.484 -8.764
237 HD2 LYS 32 HD2 LYS 32 21.101 -0.695 -10.645
238 HD3 LYS 32 HD3 LYS 32 19.386 -0.291 -10.760
239 HE2 LYS 32 HE2 LYS 32 20.342 2.054 -11.490
240 HE3 LYS 32 HE3 LYS 32 21.754 1.092 -11.922
241 HZ1 LYS 32 HZ1 LYS 32 20.684 0.732 -13.826
242 HZ2 LYS 32 HZ2 LYS 32 19.201 1.272 -13.219
243 HZ3 LYS 32 HZ3 LYS 32 19.689 -0.326 -12.957
244 H ILE 33 H ILE 33 19.156 -0.996 -5.026
245 HA ILE 33 HA ILE 33 16.232 -1.242 -5.172
246 HB ILE 33 HB ILE 33 16.138 -3.091 -3.722
247 HG12 ILE 33 HG12 ILE 33 19.083 -2.615 -3.251
248 HG13 ILE 33 HG13 ILE 33 17.775 -2.502 -2.078
249 HG21 ILE 33 HG21 ILE 33 17.211 -4.821 -4.935
250 HG22 ILE 33 HG22 ILE 33 16.854 -3.542 -6.095
251 HG23 ILE 33 HG23 ILE 33 18.494 -3.739 -5.478
252 HD11 ILE 33 HD11 ILE 33 19.189 -4.875 -3.126
253 HD12 ILE 33 HD12 ILE 33 18.589 -4.530 -1.504
254 HD13 ILE 33 HD13 ILE 33 17.471 -5.048 -2.765
255 H CYS 34 H CYS 34 15.316 -1.183 -2.827
256 HA CYS 34 HA CYS 34 16.315 1.256 -1.636
257 HB2 CYS 34 HB2 CYS 34 13.897 -0.472 -1.130
258 HB3 CYS 34 HB3 CYS 34 14.306 0.889 -0.090
259 H VAL 35 H VAL 35 16.595 1.446 0.720
260 HA VAL 35 HA VAL 35 17.510 -1.032 2.004
261 HB VAL 35 HB VAL 35 19.078 1.551 1.974
262 HG11 VAL 35 HG11 VAL 35 19.378 0.541 4.094
263 HG12 VAL 35 HG12 VAL 35 19.519 -1.069 3.386
264 HG13 VAL 35 HG13 VAL 35 20.799 0.119 3.140
265 HG21 VAL 35 HG21 VAL 35 19.102 0.114 -0.123
266 HG22 VAL 35 HG22 VAL 35 20.667 0.483 0.602
267 HG23 VAL 35 HG23 VAL 35 19.933 -1.102 0.848
Start of MODEL 3
1 H1 GLY 1 H GLY 1 1.566 -1.900 -2.029
2 HA2 GLY 1 HA2 GLY 1 1.447 0.493 -2.102
3 HA3 GLY 1 HA3 GLY 1 1.634 0.076 -0.405
4 H CYS 2 H CYS 2 4.382 -0.751 -0.602
5 HA CYS 2 HA CYS 2 5.794 1.643 -1.492
6 HB2 CYS 2 HB2 CYS 2 6.955 1.835 0.709
7 HB3 CYS 2 HB3 CYS 2 5.238 2.215 0.785
8 H ILE 3 H ILE 3 8.154 1.373 -1.429
9 HA ILE 3 HA ILE 3 8.863 -1.356 -2.147
10 HB ILE 3 HB ILE 3 10.516 1.166 -2.326
11 HG12 ILE 3 HG12 ILE 3 9.667 -0.042 -4.830
12 HG13 ILE 3 HG13 ILE 3 8.291 0.424 -3.837
13 HG21 ILE 3 HG21 ILE 3 11.833 -0.913 -2.188
14 HG22 ILE 3 HG22 ILE 3 10.964 -1.534 -3.591
15 HG23 ILE 3 HG23 ILE 3 11.995 -0.112 -3.751
16 HD11 ILE 3 HD11 ILE 3 9.495 2.076 -5.551
17 HD12 ILE 3 HD12 ILE 3 8.698 2.627 -4.077
18 HD13 ILE 3 HD13 ILE 3 10.448 2.416 -4.107
19 H ALA 4 H ALA 4 9.732 -2.700 -0.727
20 HA ALA 4 HA ALA 4 10.701 -1.773 1.818
21 HB1 ALA 4 HB1 ALA 4 9.795 -3.768 2.274
22 HB2 ALA 4 HB2 ALA 4 9.982 -4.340 0.615
23 HB3 ALA 4 HB3 ALA 4 11.342 -4.424 1.735
24 H LYS 5 H LYS 5 12.811 -2.672 2.678
25 HA LYS 5 HA LYS 5 14.936 -1.756 0.999
26 HB2 LYS 5 HB2 LYS 5 16.387 -2.435 2.917
27 HB3 LYS 5 HB3 LYS 5 15.087 -1.335 3.356
28 HG2 LYS 5 HG2 LYS 5 14.168 -2.806 4.755
29 HG3 LYS 5 HG3 LYS 5 14.348 -4.141 3.614
30 HD2 LYS 5 HD2 LYS 5 16.929 -3.371 4.569
31 HD3 LYS 5 HD3 LYS 5 15.855 -3.620 5.948
32 HE2 LYS 5 HE2 LYS 5 15.722 -5.838 5.599
33 HE3 LYS 5 HE3 LYS 5 15.648 -5.658 3.846
34 HZ1 LYS 5 HZ1 LYS 5 18.141 -5.032 4.143
35 HZ2 LYS 5 HZ2 LYS 5 17.673 -6.657 4.116
36 HZ3 LYS 5 HZ3 LYS 5 17.998 -5.894 5.591
37 H ASN 6 H ASN 6 14.334 -3.419 -0.704
38 HA ASN 6 HA ASN 6 16.347 -5.319 -0.939
39 HB2 ASN 6 HB2 ASN 6 15.419 -6.711 0.705
40 HB3 ASN 6 HB3 ASN 6 13.769 -6.373 0.192
41 HD21 ASN 6 HD21 ASN 6 12.981 -8.291 -0.355
42 HD22 ASN 6 HD22 ASN 6 13.696 -9.380 -1.490
43 H LYS 7 H LYS 7 13.172 -4.202 -1.801
44 HA LYS 7 HA LYS 7 13.200 -5.536 -4.378
45 HB2 LYS 7 HB2 LYS 7 11.261 -3.479 -3.306
46 HB3 LYS 7 HB3 LYS 7 11.033 -4.486 -4.730
47 HG2 LYS 7 HG2 LYS 7 11.574 -6.195 -2.533
48 HG3 LYS 7 HG3 LYS 7 10.338 -5.035 -2.038
49 HD2 LYS 7 HD2 LYS 7 8.884 -5.687 -3.767
50 HD3 LYS 7 HD3 LYS 7 10.167 -6.524 -4.643
51 HE2 LYS 7 HE2 LYS 7 9.245 -8.354 -3.702
52 HE3 LYS 7 HE3 LYS 7 10.221 -7.877 -2.315
53 HZ1 LYS 7 HZ1 LYS 7 8.257 -7.991 -1.261
54 HZ2 LYS 7 HZ2 LYS 7 7.345 -7.791 -2.671
55 HZ3 LYS 7 HZ3 LYS 7 8.015 -6.443 -1.899
56 H GLU 8 H GLU 8 13.378 -4.519 -6.374
57 HA GLU 8 HA GLU 8 15.248 -2.505 -6.652
58 HB2 GLU 8 HB2 GLU 8 14.800 -2.542 -8.943
59 HB3 GLU 8 HB3 GLU 8 14.316 -4.145 -8.407
60 HG2 GLU 8 HG2 GLU 8 11.975 -3.368 -8.316
61 HG3 GLU 8 HG3 GLU 8 12.496 -1.813 -8.961
62 H CYS 9 H CYS 9 15.099 -0.307 -7.301
63 HA CYS 9 HA CYS 9 12.540 1.042 -7.038
64 HB2 CYS 9 HB2 CYS 9 13.385 0.920 -4.719
65 HB3 CYS 9 HB3 CYS 9 14.864 1.730 -5.226
66 H ALA 10 H ALA 10 12.422 2.471 -8.627
67 HA ALA 10 HA ALA 10 14.885 3.422 -9.882
68 HB1 ALA 10 HB1 ALA 10 12.643 2.457 -11.010
69 HB2 ALA 10 HB2 ALA 10 12.282 4.183 -11.036
70 HB3 ALA 10 HB3 ALA 10 13.740 3.575 -11.820
71 H TRP 11 H TRP 11 15.328 5.609 -10.223
72 HA TRP 11 HA TRP 11 14.615 7.355 -8.130
73 HB2 TRP 11 HB2 TRP 11 16.131 7.621 -10.689
74 HB3 TRP 11 HB3 TRP 11 15.633 9.091 -9.855
75 HD1 TRP 11 HD1 TRP 11 16.429 6.345 -7.464
76 HE1 TRP 11 HE1 TRP 11 18.733 6.750 -6.390
77 HE3 TRP 11 HE3 TRP 11 18.104 10.085 -10.521
78 HZ2 TRP 11 HZ2 TRP 11 20.964 8.433 -6.785
79 HZ3 TRP 11 HZ3 TRP 11 20.334 11.039 -10.105
80 HH2 TRP 11 HH2 TRP 11 21.733 10.229 -8.275
81 H PHE 12 H PHE 12 12.985 6.516 -10.976
82 HA PHE 12 HA PHE 12 11.122 8.752 -10.583
83 HB2 PHE 12 HB2 PHE 12 12.759 8.808 -12.685
84 HB3 PHE 12 HB3 PHE 12 11.528 7.744 -13.356
85 HD1 PHE 12 HD1 PHE 12 12.045 11.068 -11.805
86 HD2 PHE 12 HD2 PHE 12 9.530 8.609 -14.201
87 HE1 PHE 12 HE1 PHE 12 10.666 13.028 -12.364
88 HE2 PHE 12 HE2 PHE 12 8.148 10.565 -14.765
89 HZ PHE 12 HZ PHE 12 8.716 12.778 -13.846
90 H SER 13 H SER 13 11.232 5.828 -9.862
91 HA SER 13 HA SER 13 9.454 4.338 -11.419
92 HB2 SER 13 HB2 SER 13 9.113 2.974 -9.361
93 HB3 SER 13 HB3 SER 13 10.814 3.280 -9.709
94 HG SER 13 HG SER 13 10.960 4.245 -7.859
95 H GLY 14 H GLY 14 8.890 6.983 -9.307
96 HA2 GLY 14 HA2 GLY 14 6.880 8.201 -9.225
97 HA3 GLY 14 HA3 GLY 14 6.029 6.798 -9.854
98 H GLU 15 H GLU 15 7.473 5.119 -7.778
99 HA GLU 15 HA GLU 15 5.591 5.699 -5.605
100 HB2 GLU 15 HB2 GLU 15 6.226 3.333 -4.881
101 HB3 GLU 15 HB3 GLU 15 5.284 3.492 -6.357
102 HG2 GLU 15 HG2 GLU 15 8.194 3.486 -6.733
103 HG3 GLU 15 HG3 GLU 15 7.510 1.984 -6.114
104 H TRP 16 H TRP 16 6.562 4.684 -3.422
105 HA TRP 16 HA TRP 16 9.297 5.701 -3.073
106 HB2 TRP 16 HB2 TRP 16 7.159 6.207 -1.014
107 HB3 TRP 16 HB3 TRP 16 8.738 6.971 -1.168
108 HD1 TRP 16 HD1 TRP 16 8.757 8.094 -4.015
109 HE1 TRP 16 HE1 TRP 16 7.097 9.909 -4.774
110 HE3 TRP 16 HE3 TRP 16 5.104 7.368 -0.514
111 HZ2 TRP 16 HZ2 TRP 16 4.574 10.902 -3.992
112 HZ3 TRP 16 HZ3 TRP 16 3.099 8.793 -0.588
113 HH2 TRP 16 HH2 TRP 16 2.842 10.523 -2.292
114 H CYS 17 H CYS 17 10.368 4.897 -1.133
115 HA CYS 17 HA CYS 17 9.819 2.106 -0.736
116 HB2 CYS 17 HB2 CYS 17 11.836 3.773 0.767
117 HB3 CYS 17 HB3 CYS 17 11.868 2.036 0.479
118 H CYS 18 H CYS 18 9.766 1.150 1.474
119 HA CYS 18 HA CYS 18 7.634 2.315 2.972
120 HB2 CYS 18 HB2 CYS 18 9.396 -0.028 3.717
121 HB3 CYS 18 HB3 CYS 18 7.823 0.360 4.404
122 H GLY 19 H GLY 19 7.814 2.458 5.430
123 HA2 GLY 19 HA2 GLY 19 8.630 3.655 7.213
124 HA3 GLY 19 HA3 GLY 19 10.170 2.913 6.805
125 H ALA 20 H ALA 20 11.777 4.193 6.141
126 HA ALA 20 HA ALA 20 11.206 6.737 4.858
127 HB1 ALA 20 HB1 ALA 20 11.210 7.049 7.400
128 HB2 ALA 20 HB2 ALA 20 12.950 6.776 7.299
129 HB3 ALA 20 HB3 ALA 20 12.218 8.130 6.437
130 H LEU 21 H LEU 21 12.435 4.339 3.942
131 HA LEU 21 HA LEU 21 15.289 4.966 3.834
132 HB2 LEU 21 HB2 LEU 21 13.937 2.619 2.542
133 HB3 LEU 21 HB3 LEU 21 15.631 2.795 2.995
134 HG LEU 21 HG LEU 21 13.532 2.783 5.122
135 HD11 LEU 21 HD11 LEU 21 13.031 0.619 4.936
136 HD12 LEU 21 HD12 LEU 21 14.700 0.173 4.586
137 HD13 LEU 21 HD13 LEU 21 13.648 0.737 3.288
138 HD21 LEU 21 HD21 LEU 21 16.251 3.063 5.143
139 HD22 LEU 21 HD22 LEU 21 16.053 1.340 5.464
140 HD23 LEU 21 HD23 LEU 21 15.271 2.527 6.509
141 H SER 22 H SER 22 16.404 4.968 1.768
142 HA SER 22 HA SER 22 14.710 6.070 -0.375
143 HB2 SER 22 HB2 SER 22 17.435 6.764 0.616
144 HB3 SER 22 HB3 SER 22 17.115 6.954 -1.108
145 HG SER 22 HG SER 22 16.160 8.740 -0.591
146 H CYS 23 H CYS 23 16.178 5.938 -2.550
147 HA CYS 23 HA CYS 23 16.563 3.060 -2.952
148 HB2 CYS 23 HB2 CYS 23 16.405 5.140 -5.126
149 HB3 CYS 23 HB3 CYS 23 16.102 3.410 -5.246
150 H LYS 24 H LYS 24 18.599 2.421 -2.691
151 HA LYS 24 HA LYS 24 20.736 4.070 -3.875
152 HB2 LYS 24 HB2 LYS 24 21.301 2.174 -1.633
153 HB3 LYS 24 HB3 LYS 24 22.154 3.641 -2.095
154 HG2 LYS 24 HG2 LYS 24 21.143 4.404 -0.221
155 HG3 LYS 24 HG3 LYS 24 19.853 4.749 -1.376
156 HD2 LYS 24 HD2 LYS 24 18.697 2.730 -0.774
157 HD3 LYS 24 HD3 LYS 24 20.042 2.213 0.246
158 HE2 LYS 24 HE2 LYS 24 18.570 4.784 0.740
159 HE3 LYS 24 HE3 LYS 24 18.004 3.249 1.396
160 HZ1 LYS 24 HZ1 LYS 24 19.352 3.705 3.092
161 HZ2 LYS 24 HZ2 LYS 24 20.194 4.902 2.243
162 HZ3 LYS 24 HZ3 LYS 24 20.627 3.277 2.065
163 H TYR 25 H TYR 25 22.705 2.785 -4.456
164 HA TYR 25 HA TYR 25 21.901 0.520 -6.045
165 HB2 TYR 25 HB2 TYR 25 23.463 2.132 -6.981
166 HB3 TYR 25 HB3 TYR 25 24.597 1.840 -5.667
167 HD1 TYR 25 HD2 TYR 25 25.905 -0.223 -5.587
168 HD2 TYR 25 HD1 TYR 25 23.235 0.562 -8.806
169 HE1 TYR 25 HE2 TYR 25 26.976 -2.004 -6.902
170 HE2 TYR 25 HE1 TYR 25 24.297 -1.219 -10.129
171 HH TYR 25 HH TYR 25 26.062 -2.614 -10.257
172 H SER 26 H SER 26 22.144 -1.569 -5.573
173 HA SER 26 HA SER 26 23.607 -2.262 -3.117
174 HB2 SER 26 HB2 SER 26 21.145 -3.326 -4.409
175 HB3 SER 26 HB3 SER 26 22.172 -4.477 -3.555
176 HG SER 26 HG SER 26 21.086 -2.084 -2.478
177 H ILE 27 H ILE 27 25.658 -2.601 -3.871
178 HA ILE 27 HA ILE 27 26.439 -3.786 -6.243
179 HB ILE 27 HB ILE 27 27.938 -4.197 -3.665
180 HG12 ILE 27 HG12 ILE 27 28.960 -1.900 -4.824
181 HG13 ILE 27 HG13 ILE 27 27.221 -1.703 -5.010
182 HG21 ILE 27 HG21 ILE 27 28.997 -5.332 -5.421
183 HG22 ILE 27 HG22 ILE 27 28.690 -4.027 -6.566
184 HG23 ILE 27 HG23 ILE 27 29.877 -3.811 -5.279
185 HD11 ILE 27 HD11 ILE 27 27.379 -0.805 -2.963
186 HD12 ILE 27 HD12 ILE 27 27.350 -2.488 -2.437
187 HD13 ILE 27 HD13 ILE 27 28.888 -1.640 -2.597
188 H LYS 28 H LYS 28 25.870 -5.345 -3.099
189 HA LYS 28 HA LYS 28 26.543 -7.951 -3.822
190 HB2 LYS 28 HB2 LYS 28 25.040 -8.637 -1.944
191 HB3 LYS 28 HB3 LYS 28 26.212 -7.400 -1.511
192 HG2 LYS 28 HG2 LYS 28 23.620 -6.375 -2.426
193 HG3 LYS 28 HG3 LYS 28 23.575 -7.295 -0.921
194 HD2 LYS 28 HD2 LYS 28 25.717 -5.753 -0.437
195 HD3 LYS 28 HD3 LYS 28 24.826 -4.681 -1.520
196 HE2 LYS 28 HE2 LYS 28 22.839 -4.931 -0.077
197 HE3 LYS 28 HE3 LYS 28 23.786 -5.934 1.021
198 HZ1 LYS 28 HZ1 LYS 28 24.656 -4.141 1.964
199 HZ2 LYS 28 HZ2 LYS 28 23.539 -3.206 1.105
200 HZ3 LYS 28 HZ3 LYS 28 25.088 -3.460 0.476
201 H ARG 29 H ARG 29 23.653 -6.096 -4.435
202 HA ARG 29 HA ARG 29 22.298 -8.452 -5.528
203 HB2 ARG 29 HB2 ARG 29 21.295 -5.647 -5.012
204 HB3 ARG 29 HB3 ARG 29 20.325 -6.946 -5.692
205 HG2 ARG 29 HG2 ARG 29 21.512 -7.882 -3.285
206 HG3 ARG 29 HG3 ARG 29 20.763 -6.314 -2.975
207 HD2 ARG 29 HD2 ARG 29 18.666 -7.091 -3.348
208 HD3 ARG 29 HD3 ARG 29 19.194 -8.228 -4.588
209 HE ARG 29 HE ARG 29 20.017 -8.937 -1.924
210 HH11 ARG 29 HH11 ARG 29 17.492 -9.170 -4.309
211 HH12 ARG 29 HH12 ARG 29 16.810 -10.614 -3.636
212 HH21 ARG 29 HH21 ARG 29 19.128 -10.838 -1.028
213 HH22 ARG 29 HH22 ARG 29 17.741 -11.561 -1.769
214 H ASN 30 H ASN 30 24.488 -6.356 -6.612
215 HA ASN 30 HA ASN 30 25.006 -5.362 -8.612
216 HB2 ASN 30 HB2 ASN 30 24.820 -6.883 -10.520
217 HB3 ASN 30 HB3 ASN 30 25.342 -7.756 -9.082
218 HD21 ASN 30 HD21 ASN 30 22.865 -7.334 -11.432
219 HD22 ASN 30 HD22 ASN 30 21.869 -8.656 -10.936
220 H LEU 31 H LEU 31 22.469 -4.518 -7.526
221 HA LEU 31 HA LEU 31 21.338 -3.405 -9.948
222 HB2 LEU 31 HB2 LEU 31 19.674 -5.038 -8.037
223 HB3 LEU 31 HB3 LEU 31 19.028 -4.023 -9.325
224 HG LEU 31 HG LEU 31 20.847 -6.375 -9.818
225 HD11 LEU 31 HD11 LEU 31 18.509 -7.276 -10.678
226 HD12 LEU 31 HD12 LEU 31 17.914 -6.229 -9.391
227 HD13 LEU 31 HD13 LEU 31 19.053 -7.522 -9.018
228 HD21 LEU 31 HD21 LEU 31 20.274 -4.320 -11.465
229 HD22 LEU 31 HD22 LEU 31 18.932 -5.402 -11.836
230 HD23 LEU 31 HD23 LEU 31 20.594 -5.963 -12.020
231 H LYS 32 H LYS 32 19.100 -2.216 -8.968
232 HA LYS 32 HA LYS 32 20.137 -0.550 -6.768
233 HB2 LYS 32 HB2 LYS 32 18.332 0.269 -9.052
234 HB3 LYS 32 HB3 LYS 32 18.859 1.318 -7.742
235 HG2 LYS 32 HG2 LYS 32 20.361 1.912 -9.339
236 HG3 LYS 32 HG3 LYS 32 21.250 0.588 -8.583
237 HD2 LYS 32 HD2 LYS 32 20.960 -0.805 -10.366
238 HD3 LYS 32 HD3 LYS 32 19.406 -0.093 -10.808
239 HE2 LYS 32 HE2 LYS 32 21.152 1.981 -11.220
240 HE3 LYS 32 HE3 LYS 32 22.108 0.579 -11.699
241 HZ1 LYS 32 HZ1 LYS 32 21.054 0.781 -13.637
242 HZ2 LYS 32 HZ2 LYS 32 19.852 1.789 -13.005
243 HZ3 LYS 32 HZ3 LYS 32 19.709 0.110 -12.860
244 H ILE 33 H ILE 33 19.077 -0.956 -4.947
245 HA ILE 33 HA ILE 33 16.149 -1.159 -5.046
246 HB ILE 33 HB ILE 33 16.042 -3.010 -3.604
247 HG12 ILE 33 HG12 ILE 33 18.998 -2.583 -3.156
248 HG13 ILE 33 HG13 ILE 33 17.702 -2.445 -1.973
249 HG21 ILE 33 HG21 ILE 33 18.392 -3.885 -5.212
250 HG22 ILE 33 HG22 ILE 33 16.855 -4.699 -4.928
251 HG23 ILE 33 HG23 ILE 33 16.937 -3.336 -6.043
252 HD11 ILE 33 HD11 ILE 33 19.152 -4.801 -2.916
253 HD12 ILE 33 HD12 ILE 33 18.337 -4.501 -1.381
254 HD13 ILE 33 HD13 ILE 33 17.406 -5.014 -2.788
255 H CYS 34 H CYS 34 15.260 -1.061 -2.703
256 HA CYS 34 HA CYS 34 16.322 1.353 -1.526
257 HB2 CYS 34 HB2 CYS 34 13.896 -0.345 -0.954
258 HB3 CYS 34 HB3 CYS 34 14.340 1.027 0.055
259 H VAL 35 H VAL 35 16.712 1.556 0.793
260 HA VAL 35 HA VAL 35 17.420 -0.901 2.197
261 HB VAL 35 HB VAL 35 19.438 1.321 1.885
262 HG11 VAL 35 HG11 VAL 35 20.602 0.303 3.482
263 HG12 VAL 35 HG12 VAL 35 19.190 -0.712 3.782
264 HG13 VAL 35 HG13 VAL 35 20.451 -1.258 2.675
265 HG21 VAL 35 HG21 VAL 35 19.383 -1.375 0.533
266 HG22 VAL 35 HG22 VAL 35 19.105 0.178 -0.254
267 HG23 VAL 35 HG23 VAL 35 20.687 -0.192 0.433
Start of MODEL 4
1 H1 GLY 1 H GLY 1 1.424 -2.083 -0.371
2 HA2 GLY 1 HA2 GLY 1 1.846 -0.630 -2.135
3 HA3 GLY 1 HA3 GLY 1 1.051 0.486 -1.034
4 H CYS 2 H CYS 2 4.248 -1.015 -0.742
5 HA CYS 2 HA CYS 2 5.605 1.433 -1.437
6 HB2 CYS 2 HB2 CYS 2 6.701 1.726 0.740
7 HB3 CYS 2 HB3 CYS 2 4.956 1.916 0.875
8 H ILE 3 H ILE 3 7.944 1.191 -1.437
9 HA ILE 3 HA ILE 3 8.698 -1.542 -2.092
10 HB ILE 3 HB ILE 3 10.347 0.975 -2.342
11 HG12 ILE 3 HG12 ILE 3 9.454 -0.089 -4.851
12 HG13 ILE 3 HG13 ILE 3 8.058 0.174 -3.811
13 HG21 ILE 3 HG21 ILE 3 11.541 -1.237 -2.277
14 HG22 ILE 3 HG22 ILE 3 10.691 -1.654 -3.764
15 HG23 ILE 3 HG23 ILE 3 11.799 -0.283 -3.738
16 HD11 ILE 3 HD11 ILE 3 8.115 2.319 -4.325
17 HD12 ILE 3 HD12 ILE 3 9.709 2.448 -3.580
18 HD13 ILE 3 HD13 ILE 3 9.565 2.068 -5.296
19 H ALA 4 H ALA 4 9.650 -2.832 -0.675
20 HA ALA 4 HA ALA 4 10.610 -1.835 1.845
21 HB1 ALA 4 HB1 ALA 4 9.786 -4.358 0.777
22 HB2 ALA 4 HB2 ALA 4 11.358 -4.531 1.559
23 HB3 ALA 4 HB3 ALA 4 9.993 -3.875 2.461
24 H LYS 5 H LYS 5 12.759 -2.517 2.701
25 HA LYS 5 HA LYS 5 14.822 -1.608 0.944
26 HB2 LYS 5 HB2 LYS 5 16.320 -2.089 2.889
27 HB3 LYS 5 HB3 LYS 5 14.971 -1.026 3.266
28 HG2 LYS 5 HG2 LYS 5 13.988 -3.547 3.818
29 HG3 LYS 5 HG3 LYS 5 15.664 -3.613 4.370
30 HD2 LYS 5 HD2 LYS 5 15.135 -1.343 5.492
31 HD3 LYS 5 HD3 LYS 5 13.446 -1.805 5.265
32 HE2 LYS 5 HE2 LYS 5 14.113 -2.491 7.456
33 HE3 LYS 5 HE3 LYS 5 13.948 -3.937 6.461
34 HZ1 LYS 5 HZ1 LYS 5 16.555 -3.214 6.149
35 HZ2 LYS 5 HZ2 LYS 5 15.982 -4.444 7.159
36 HZ3 LYS 5 HZ3 LYS 5 16.261 -2.897 7.785
37 H ASN 6 H ASN 6 14.272 -3.421 -0.632
38 HA ASN 6 HA ASN 6 16.389 -5.236 -0.739
39 HB2 ASN 6 HB2 ASN 6 14.756 -6.181 1.130
40 HB3 ASN 6 HB3 ASN 6 13.896 -6.809 -0.273
41 HD21 ASN 6 HD21 ASN 6 14.365 -8.926 0.361
42 HD22 ASN 6 HD22 ASN 6 15.937 -9.610 0.143
43 H LYS 7 H LYS 7 13.199 -4.277 -1.716
44 HA LYS 7 HA LYS 7 13.313 -5.758 -4.209
45 HB2 LYS 7 HB2 LYS 7 11.291 -3.677 -3.370
46 HB3 LYS 7 HB3 LYS 7 11.116 -4.880 -4.641
47 HG2 LYS 7 HG2 LYS 7 11.694 -6.231 -2.209
48 HG3 LYS 7 HG3 LYS 7 10.392 -5.076 -1.916
49 HD2 LYS 7 HD2 LYS 7 9.022 -6.043 -3.571
50 HD3 LYS 7 HD3 LYS 7 10.367 -6.951 -4.266
51 HE2 LYS 7 HE2 LYS 7 10.477 -8.075 -1.930
52 HE3 LYS 7 HE3 LYS 7 8.835 -7.462 -1.746
53 HZ1 LYS 7 HZ1 LYS 7 8.825 -9.708 -2.606
54 HZ2 LYS 7 HZ2 LYS 7 9.790 -9.249 -3.917
55 HZ3 LYS 7 HZ3 LYS 7 8.218 -8.642 -3.772
56 H GLU 8 H GLU 8 13.530 -4.867 -6.252
57 HA GLU 8 HA GLU 8 15.311 -2.762 -6.578
58 HB2 GLU 8 HB2 GLU 8 15.040 -3.035 -8.874
59 HB3 GLU 8 HB3 GLU 8 14.586 -4.610 -8.238
60 HG2 GLU 8 HG2 GLU 8 12.209 -3.922 -8.369
61 HG3 GLU 8 HG3 GLU 8 12.727 -2.424 -9.139
62 H CYS 9 H CYS 9 15.071 -0.631 -7.354
63 HA CYS 9 HA CYS 9 12.416 0.544 -7.416
64 HB2 CYS 9 HB2 CYS 9 12.975 2.278 -5.756
65 HB3 CYS 9 HB3 CYS 9 12.974 0.668 -5.043
66 H ALA 10 H ALA 10 12.394 2.699 -8.286
67 HA ALA 10 HA ALA 10 14.853 3.376 -9.765
68 HB1 ALA 10 HB1 ALA 10 12.476 4.398 -11.031
69 HB2 ALA 10 HB2 ALA 10 13.740 3.357 -11.688
70 HB3 ALA 10 HB3 ALA 10 12.375 2.649 -10.824
71 H TRP 11 H TRP 11 15.349 5.565 -10.036
72 HA TRP 11 HA TRP 11 14.665 7.251 -7.879
73 HB2 TRP 11 HB2 TRP 11 16.229 7.564 -10.403
74 HB3 TRP 11 HB3 TRP 11 15.763 9.016 -9.522
75 HD1 TRP 11 HD1 TRP 11 16.435 6.162 -7.223
76 HE1 TRP 11 HE1 TRP 11 18.734 6.453 -6.102
77 HE3 TRP 11 HE3 TRP 11 18.276 9.953 -10.118
78 HZ2 TRP 11 HZ2 TRP 11 21.024 8.075 -6.404
79 HZ3 TRP 11 HZ3 TRP 11 20.529 10.817 -9.636
80 HH2 TRP 11 HH2 TRP 11 21.873 9.897 -7.817
81 H PHE 12 H PHE 12 13.032 6.547 -10.749
82 HA PHE 12 HA PHE 12 11.225 8.814 -10.299
83 HB2 PHE 12 HB2 PHE 12 12.915 8.957 -12.354
84 HB3 PHE 12 HB3 PHE 12 11.682 7.957 -13.115
85 HD1 PHE 12 HD2 PHE 12 12.270 11.196 -11.435
86 HD2 PHE 12 HD1 PHE 12 9.670 8.886 -13.889
87 HE1 PHE 12 HE2 PHE 12 10.940 13.209 -11.915
88 HE2 PHE 12 HE1 PHE 12 8.336 10.896 -14.374
89 HZ PHE 12 HZ PHE 12 8.970 13.061 -13.386
90 H SER 13 H SER 13 11.200 5.907 -9.665
91 HA SER 13 HA SER 13 9.445 4.528 -11.374
92 HB2 SER 13 HB2 SER 13 9.018 3.073 -9.377
93 HB3 SER 13 HB3 SER 13 10.730 3.315 -9.727
94 HG SER 13 HG SER 13 10.216 5.234 -8.128
95 H GLY 14 H GLY 14 8.901 7.124 -9.243
96 HA2 GLY 14 HA2 GLY 14 6.901 8.360 -9.156
97 HA3 GLY 14 HA3 GLY 14 6.034 6.958 -9.765
98 H GLU 15 H GLU 15 7.457 5.267 -7.702
99 HA GLU 15 HA GLU 15 5.646 5.933 -5.488
100 HB2 GLU 15 HB2 GLU 15 6.151 3.523 -4.797
101 HB3 GLU 15 HB3 GLU 15 5.171 3.758 -6.237
102 HG2 GLU 15 HG2 GLU 15 7.016 3.265 -7.663
103 HG3 GLU 15 HG3 GLU 15 8.136 3.263 -6.301
104 H TRP 16 H TRP 16 6.596 4.868 -3.332
105 HA TRP 16 HA TRP 16 9.405 5.686 -3.054
106 HB2 TRP 16 HB2 TRP 16 7.344 6.336 -0.954
107 HB3 TRP 16 HB3 TRP 16 8.979 6.972 -1.117
108 HD1 TRP 16 HD1 TRP 16 9.037 8.084 -3.985
109 HE1 TRP 16 HE1 TRP 16 7.531 10.045 -4.702
110 HE3 TRP 16 HE3 TRP 16 5.429 7.696 -0.383
111 HZ2 TRP 16 HZ2 TRP 16 5.133 11.267 -3.852
112 HZ3 TRP 16 HZ3 TRP 16 3.563 9.300 -0.405
113 HH2 TRP 16 HH2 TRP 16 3.420 11.048 -2.104
114 H CYS 17 H CYS 17 10.460 4.814 -1.129
115 HA CYS 17 HA CYS 17 9.737 2.062 -0.728
116 HB2 CYS 17 HB2 CYS 17 11.882 3.529 0.792
117 HB3 CYS 17 HB3 CYS 17 11.815 1.824 0.360
118 H CYS 18 H CYS 18 9.549 1.078 1.416
119 HA CYS 18 HA CYS 18 7.531 2.287 2.955
120 HB2 CYS 18 HB2 CYS 18 9.374 0.026 3.757
121 HB3 CYS 18 HB3 CYS 18 7.823 0.414 4.494
122 H GLY 19 H GLY 19 7.723 2.578 5.389
123 HA2 GLY 19 HA2 GLY 19 8.525 3.881 7.103
124 HA3 GLY 19 HA3 GLY 19 10.080 3.159 6.719
125 H ALA 20 H ALA 20 11.645 4.435 5.947
126 HA ALA 20 HA ALA 20 10.993 6.899 4.554
127 HB1 ALA 20 HB1 ALA 20 12.423 8.258 6.081
128 HB2 ALA 20 HB2 ALA 20 10.918 7.692 6.808
129 HB3 ALA 20 HB3 ALA 20 12.441 6.891 7.196
130 H LEU 21 H LEU 21 12.261 4.504 3.719
131 HA LEU 21 HA LEU 21 15.101 5.180 3.553
132 HB2 LEU 21 HB2 LEU 21 13.829 2.763 2.325
133 HB3 LEU 21 HB3 LEU 21 15.493 2.988 2.860
134 HG LEU 21 HG LEU 21 13.300 3.012 4.884
135 HD11 LEU 21 HD11 LEU 21 13.601 0.888 3.105
136 HD12 LEU 21 HD12 LEU 21 12.752 0.875 4.650
137 HD13 LEU 21 HD13 LEU 21 14.445 0.389 4.570
138 HD21 LEU 21 HD21 LEU 21 15.114 3.250 6.152
139 HD22 LEU 21 HD22 LEU 21 16.194 2.868 4.811
140 HD23 LEU 21 HD23 LEU 21 15.488 1.569 5.774
141 H SER 22 H SER 22 16.195 5.204 1.502
142 HA SER 22 HA SER 22 14.445 6.107 -0.688
143 HB2 SER 22 HB2 SER 22 16.052 7.789 0.313
144 HB3 SER 22 HB3 SER 22 17.365 6.802 -0.328
145 HG SER 22 HG SER 22 16.389 8.661 -1.631
146 H CYS 23 H CYS 23 16.207 6.070 -2.773
147 HA CYS 23 HA CYS 23 16.517 3.196 -3.202
148 HB2 CYS 23 HB2 CYS 23 15.345 4.970 -4.792
149 HB3 CYS 23 HB3 CYS 23 16.993 5.189 -5.371
150 H LYS 24 H LYS 24 18.435 2.279 -2.967
151 HA LYS 24 HA LYS 24 20.845 3.872 -3.541
152 HB2 LYS 24 HB2 LYS 24 20.564 1.797 -1.360
153 HB3 LYS 24 HB3 LYS 24 22.003 2.743 -1.717
154 HG2 LYS 24 HG2 LYS 24 21.126 3.867 0.084
155 HG3 LYS 24 HG3 LYS 24 20.457 4.781 -1.271
156 HD2 LYS 24 HD2 LYS 24 18.334 4.017 -0.914
157 HD3 LYS 24 HD3 LYS 24 18.883 2.481 -0.240
158 HE2 LYS 24 HE2 LYS 24 17.858 3.816 1.494
159 HE3 LYS 24 HE3 LYS 24 19.586 3.662 1.805
160 HZ1 LYS 24 HZ1 LYS 24 19.311 5.934 0.280
161 HZ2 LYS 24 HZ2 LYS 24 19.639 5.860 1.937
162 HZ3 LYS 24 HZ3 LYS 24 18.043 6.010 1.397
163 H TYR 25 H TYR 25 22.654 2.712 -4.350
164 HA TYR 25 HA TYR 25 21.904 0.501 -6.038
165 HB2 TYR 25 HB2 TYR 25 23.376 2.218 -6.925
166 HB3 TYR 25 HB3 TYR 25 24.550 1.915 -5.649
167 HD1 TYR 25 HD2 TYR 25 25.932 -0.107 -5.685
168 HD2 TYR 25 HD1 TYR 25 23.193 0.746 -8.828
169 HE1 TYR 25 HE2 TYR 25 27.051 -1.775 -7.105
170 HE2 TYR 25 HE1 TYR 25 24.304 -0.921 -10.256
171 HH TYR 25 HH TYR 25 25.728 -2.767 -10.166
172 H SER 26 H SER 26 22.352 -1.605 -5.766
173 HA SER 26 HA SER 26 23.844 -2.364 -3.344
174 HB2 SER 26 HB2 SER 26 21.434 -3.485 -4.686
175 HB3 SER 26 HB3 SER 26 22.533 -4.625 -3.909
176 HG SER 26 HG SER 26 22.344 -3.023 -2.063
177 H ILE 27 H ILE 27 25.901 -2.636 -4.042
178 HA ILE 27 HA ILE 27 26.705 -3.628 -6.527
179 HB ILE 27 HB ILE 27 28.305 -4.019 -4.009
180 HG12 ILE 27 HG12 ILE 27 29.110 -1.597 -5.070
181 HG13 ILE 27 HG13 ILE 27 27.357 -1.528 -5.217
182 HG21 ILE 27 HG21 ILE 27 29.009 -3.540 -6.898
183 HG22 ILE 27 HG22 ILE 27 30.181 -3.501 -5.583
184 HG23 ILE 27 HG23 ILE 27 29.309 -4.991 -5.941
185 HD11 ILE 27 HD11 ILE 27 27.586 -2.416 -2.691
186 HD12 ILE 27 HD12 ILE 27 29.062 -1.459 -2.828
187 HD13 ILE 27 HD13 ILE 27 27.494 -0.712 -3.134
188 H LYS 28 H LYS 28 26.182 -5.301 -3.448
189 HA LYS 28 HA LYS 28 27.068 -7.840 -4.255
190 HB2 LYS 28 HB2 LYS 28 25.581 -8.661 -2.378
191 HB3 LYS 28 HB3 LYS 28 26.783 -7.457 -1.932
192 HG2 LYS 28 HG2 LYS 28 25.204 -6.142 -1.119
193 HG3 LYS 28 HG3 LYS 28 24.381 -6.120 -2.680
194 HD2 LYS 28 HD2 LYS 28 22.711 -7.113 -1.541
195 HD3 LYS 28 HD3 LYS 28 23.678 -8.573 -1.763
196 HE2 LYS 28 HE2 LYS 28 23.184 -8.559 0.520
197 HE3 LYS 28 HE3 LYS 28 24.823 -7.916 0.433
198 HZ1 LYS 28 HZ1 LYS 28 22.708 -5.941 0.293
199 HZ2 LYS 28 HZ2 LYS 28 24.165 -5.910 1.152
200 HZ3 LYS 28 HZ3 LYS 28 22.834 -6.750 1.774
201 H ARG 29 H ARG 29 23.962 -6.227 -4.583
202 HA ARG 29 HA ARG 29 22.773 -8.610 -5.778
203 HB2 ARG 29 HB2 ARG 29 21.567 -5.902 -5.180
204 HB3 ARG 29 HB3 ARG 29 20.686 -7.297 -5.788
205 HG2 ARG 29 HG2 ARG 29 22.148 -7.972 -3.400
206 HG3 ARG 29 HG3 ARG 29 21.092 -6.584 -3.130
207 HD2 ARG 29 HD2 ARG 29 20.285 -9.267 -4.245
208 HD3 ARG 29 HD3 ARG 29 19.913 -8.645 -2.638
209 HE ARG 29 HE ARG 29 18.838 -6.776 -4.244
210 HH11 ARG 29 HH11 ARG 29 18.601 -10.249 -4.194
211 HH12 ARG 29 HH12 ARG 29 16.997 -10.279 -4.849
212 HH21 ARG 29 HH21 ARG 29 16.727 -6.803 -5.107
213 HH22 ARG 29 HH22 ARG 29 15.932 -8.318 -5.368
214 H ASN 30 H ASN 30 24.773 -6.337 -6.859
215 HA ASN 30 HA ASN 30 25.139 -5.231 -8.836
216 HB2 ASN 30 HB2 ASN 30 24.972 -6.705 -10.800
217 HB3 ASN 30 HB3 ASN 30 25.669 -7.549 -9.420
218 HD21 ASN 30 HD21 ASN 30 24.893 -9.484 -9.026
219 HD22 ASN 30 HD22 ASN 30 23.343 -10.079 -9.504
220 H LEU 31 H LEU 31 22.633 -4.547 -7.660
221 HA LEU 31 HA LEU 31 21.297 -3.540 -10.029
222 HB2 LEU 31 HB2 LEU 31 19.876 -5.231 -7.980
223 HB3 LEU 31 HB3 LEU 31 19.065 -4.251 -9.199
224 HG LEU 31 HG LEU 31 20.967 -6.480 -9.893
225 HD11 LEU 31 HD11 LEU 31 19.350 -7.717 -8.841
226 HD12 LEU 31 HD12 LEU 31 18.672 -7.608 -10.465
227 HD13 LEU 31 HD13 LEU 31 18.073 -6.550 -9.187
228 HD21 LEU 31 HD21 LEU 31 18.797 -5.788 -11.712
229 HD22 LEU 31 HD22 LEU 31 20.520 -5.996 -12.028
230 HD23 LEU 31 HD23 LEU 31 19.914 -4.454 -11.421
231 H LYS 32 H LYS 32 19.072 -2.438 -8.929
232 HA LYS 32 HA LYS 32 20.128 -0.720 -6.779
233 HB2 LYS 32 HB2 LYS 32 18.303 0.107 -9.044
234 HB3 LYS 32 HB3 LYS 32 18.892 1.153 -7.759
235 HG2 LYS 32 HG2 LYS 32 20.344 1.697 -9.430
236 HG3 LYS 32 HG3 LYS 32 21.241 0.391 -8.651
237 HD2 LYS 32 HD2 LYS 32 20.979 -1.011 -10.407
238 HD3 LYS 32 HD3 LYS 32 19.351 -0.427 -10.764
239 HE2 LYS 32 HE2 LYS 32 21.785 1.245 -11.304
240 HE3 LYS 32 HE3 LYS 32 21.204 0.056 -12.469
241 HZ1 LYS 32 HZ1 LYS 32 19.027 1.598 -11.632
242 HZ2 LYS 32 HZ2 LYS 32 19.726 1.524 -13.170
243 HZ3 LYS 32 HZ3 LYS 32 20.276 2.662 -12.046
244 H ILE 33 H ILE 33 19.046 -1.044 -4.958
245 HA ILE 33 HA ILE 33 16.126 -1.332 -5.085
246 HB ILE 33 HB ILE 33 16.059 -3.110 -3.543
247 HG12 ILE 33 HG12 ILE 33 19.003 -2.584 -3.127
248 HG13 ILE 33 HG13 ILE 33 17.708 -2.440 -1.945
249 HG21 ILE 33 HG21 ILE 33 18.406 -4.124 -5.017
250 HG22 ILE 33 HG22 ILE 33 16.779 -4.786 -4.877
251 HG23 ILE 33 HG23 ILE 33 17.097 -3.457 -5.992
252 HD11 ILE 33 HD11 ILE 33 17.409 -4.998 -2.455
253 HD12 ILE 33 HD12 ILE 33 19.093 -4.859 -2.959
254 HD13 ILE 33 HD13 ILE 33 18.626 -4.424 -1.315
255 H CYS 34 H CYS 34 15.210 -1.170 -2.749
256 HA CYS 34 HA CYS 34 16.144 1.343 -1.687
257 HB2 CYS 34 HB2 CYS 34 13.830 -0.467 -1.007
258 HB3 CYS 34 HB3 CYS 34 14.197 0.980 -0.073
259 H VAL 35 H VAL 35 16.659 1.707 0.548
260 HA VAL 35 HA VAL 35 17.447 -0.629 2.112
261 HB VAL 35 HB VAL 35 19.385 1.598 1.467
262 HG11 VAL 35 HG11 VAL 35 19.624 0.749 3.746
263 HG12 VAL 35 HG12 VAL 35 19.743 -0.898 3.124
264 HG13 VAL 35 HG13 VAL 35 20.998 0.283 2.744
265 HG21 VAL 35 HG21 VAL 35 20.657 -0.056 0.252
266 HG22 VAL 35 HG22 VAL 35 19.487 -1.309 0.667
267 HG23 VAL 35 HG23 VAL 35 19.020 0.016 -0.400
Start of MODEL 5
1 H1 GLY 1 H GLY 1 0.501 0.470 0.300
2 HA2 GLY 1 HA2 GLY 1 2.052 -0.832 -1.720
3 HA3 GLY 1 HA3 GLY 1 1.166 0.676 -1.898
4 H CYS 2 H CYS 2 4.154 -0.708 -0.591
5 HA CYS 2 HA CYS 2 5.596 1.657 -1.488
6 HB2 CYS 2 HB2 CYS 2 6.765 1.884 0.696
7 HB3 CYS 2 HB3 CYS 2 5.048 2.262 0.790
8 H ILE 3 H ILE 3 7.943 1.345 -1.458
9 HA ILE 3 HA ILE 3 8.601 -1.412 -2.115
10 HB ILE 3 HB ILE 3 10.336 1.048 -2.355
11 HG12 ILE 3 HG12 ILE 3 9.438 0.016 -4.871
12 HG13 ILE 3 HG13 ILE 3 8.036 0.302 -3.845
13 HG21 ILE 3 HG21 ILE 3 10.604 -1.607 -3.749
14 HG22 ILE 3 HG22 ILE 3 11.746 -0.264 -3.757
15 HG23 ILE 3 HG23 ILE 3 11.475 -1.182 -2.276
16 HD11 ILE 3 HD11 ILE 3 8.140 2.437 -4.397
17 HD12 ILE 3 HD12 ILE 3 9.687 2.549 -3.558
18 HD13 ILE 3 HD13 ILE 3 9.643 2.175 -5.281
19 H ALA 4 H ALA 4 9.533 -2.740 -0.719
20 HA ALA 4 HA ALA 4 10.490 -1.796 1.822
21 HB1 ALA 4 HB1 ALA 4 10.475 -4.562 0.622
22 HB2 ALA 4 HB2 ALA 4 10.907 -4.180 2.289
23 HB3 ALA 4 HB3 ALA 4 9.268 -3.880 1.712
24 H LYS 5 H LYS 5 12.617 -2.474 2.690
25 HA LYS 5 HA LYS 5 14.709 -1.610 0.948
26 HB2 LYS 5 HB2 LYS 5 16.183 -2.096 2.907
27 HB3 LYS 5 HB3 LYS 5 14.838 -1.023 3.273
28 HG2 LYS 5 HG2 LYS 5 13.864 -2.497 4.674
29 HG3 LYS 5 HG3 LYS 5 14.363 -3.899 3.724
30 HD2 LYS 5 HD2 LYS 5 16.182 -4.215 4.982
31 HD3 LYS 5 HD3 LYS 5 16.623 -2.507 4.905
32 HE2 LYS 5 HE2 LYS 5 15.194 -1.979 6.736
33 HE3 LYS 5 HE3 LYS 5 14.460 -3.581 6.705
34 HZ1 LYS 5 HZ1 LYS 5 17.352 -3.400 7.117
35 HZ2 LYS 5 HZ2 LYS 5 16.244 -4.522 7.728
36 HZ3 LYS 5 HZ3 LYS 5 16.343 -2.975 8.406
37 H ASN 6 H ASN 6 14.203 -3.393 -0.645
38 HA ASN 6 HA ASN 6 16.276 -5.243 -0.721
39 HB2 ASN 6 HB2 ASN 6 15.340 -6.550 0.991
40 HB3 ASN 6 HB3 ASN 6 13.697 -6.305 0.404
41 HD21 ASN 6 HD21 ASN 6 12.957 -8.238 -0.117
42 HD22 ASN 6 HD22 ASN 6 13.761 -9.389 -1.125
43 H LYS 7 H LYS 7 13.101 -4.259 -1.722
44 HA LYS 7 HA LYS 7 13.216 -5.751 -4.208
45 HB2 LYS 7 HB2 LYS 7 11.207 -3.648 -3.396
46 HB3 LYS 7 HB3 LYS 7 11.028 -4.863 -4.655
47 HG2 LYS 7 HG2 LYS 7 11.584 -6.186 -2.199
48 HG3 LYS 7 HG3 LYS 7 10.281 -5.024 -1.937
49 HD2 LYS 7 HD2 LYS 7 8.881 -6.054 -3.467
50 HD3 LYS 7 HD3 LYS 7 10.218 -6.824 -4.325
51 HE2 LYS 7 HE2 LYS 7 9.609 -7.554 -1.487
52 HE3 LYS 7 HE3 LYS 7 8.680 -8.259 -2.808
53 HZ1 LYS 7 HZ1 LYS 7 10.666 -9.167 -3.742
54 HZ2 LYS 7 HZ2 LYS 7 10.607 -9.613 -2.111
55 HZ3 LYS 7 HZ3 LYS 7 11.639 -8.370 -2.610
56 H GLU 8 H GLU 8 13.403 -4.852 -6.262
57 HA GLU 8 HA GLU 8 15.232 -2.794 -6.605
58 HB2 GLU 8 HB2 GLU 8 14.918 -3.046 -8.895
59 HB3 GLU 8 HB3 GLU 8 14.414 -4.608 -8.265
60 HG2 GLU 8 HG2 GLU 8 12.068 -3.864 -8.374
61 HG3 GLU 8 HG3 GLU 8 12.608 -2.346 -9.087
62 H CYS 9 H CYS 9 15.054 -0.644 -7.298
63 HA CYS 9 HA CYS 9 12.439 0.612 -7.366
64 HB2 CYS 9 HB2 CYS 9 12.776 2.115 -5.570
65 HB3 CYS 9 HB3 CYS 9 13.215 0.531 -4.937
66 H ALA 10 H ALA 10 12.460 2.710 -8.277
67 HA ALA 10 HA ALA 10 14.995 3.416 -9.608
68 HB1 ALA 10 HB1 ALA 10 12.835 2.548 -10.921
69 HB2 ALA 10 HB2 ALA 10 12.452 4.268 -10.851
70 HB3 ALA 10 HB3 ALA 10 13.957 3.729 -11.596
71 H TRP 11 H TRP 11 15.485 5.615 -9.858
72 HA TRP 11 HA TRP 11 14.700 7.280 -7.716
73 HB2 TRP 11 HB2 TRP 11 16.367 7.629 -10.172
74 HB3 TRP 11 HB3 TRP 11 15.867 9.064 -9.281
75 HD1 TRP 11 HD1 TRP 11 16.464 6.147 -7.032
76 HE1 TRP 11 HE1 TRP 11 18.712 6.422 -5.810
77 HE3 TRP 11 HE3 TRP 11 18.384 10.037 -9.735
78 HZ2 TRP 11 HZ2 TRP 11 20.997 8.072 -5.971
79 HZ3 TRP 11 HZ3 TRP 11 20.607 10.906 -9.137
80 HH2 TRP 11 HH2 TRP 11 21.885 9.942 -7.293
81 H PHE 12 H PHE 12 13.202 6.591 -10.663
82 HA PHE 12 HA PHE 12 11.363 8.842 -10.275
83 HB2 PHE 12 HB2 PHE 12 13.148 9.019 -12.247
84 HB3 PHE 12 HB3 PHE 12 11.957 8.022 -13.077
85 HD1 PHE 12 HD2 PHE 12 12.462 11.248 -11.348
86 HD2 PHE 12 HD1 PHE 12 9.965 8.947 -13.915
87 HE1 PHE 12 HE2 PHE 12 11.146 13.261 -11.866
88 HE2 PHE 12 HE1 PHE 12 8.645 10.957 -14.438
89 HZ PHE 12 HZ PHE 12 9.234 13.117 -13.412
90 H SER 13 H SER 13 11.319 5.935 -9.668
91 HA SER 13 HA SER 13 9.644 4.578 -11.483
92 HB2 SER 13 HB2 SER 13 9.135 3.104 -9.486
93 HB3 SER 13 HB3 SER 13 10.847 3.286 -9.870
94 HG SER 13 HG SER 13 10.802 3.675 -7.750
95 H GLY 14 H GLY 14 9.013 7.133 -9.342
96 HA2 GLY 14 HA2 GLY 14 6.997 8.345 -9.291
97 HA3 GLY 14 HA3 GLY 14 6.162 6.940 -9.935
98 H GLU 15 H GLU 15 7.578 5.262 -7.839
99 HA GLU 15 HA GLU 15 5.683 5.864 -5.678
100 HB2 GLU 15 HB2 GLU 15 6.238 3.468 -4.980
101 HB3 GLU 15 HB3 GLU 15 5.300 3.678 -6.452
102 HG2 GLU 15 HG2 GLU 15 7.205 3.248 -7.817
103 HG3 GLU 15 HG3 GLU 15 8.279 3.275 -6.420
104 H TRP 16 H TRP 16 6.591 4.835 -3.495
105 HA TRP 16 HA TRP 16 9.370 5.719 -3.129
106 HB2 TRP 16 HB2 TRP 16 7.239 6.333 -1.092
107 HB3 TRP 16 HB3 TRP 16 8.857 7.016 -1.227
108 HD1 TRP 16 HD1 TRP 16 8.959 8.123 -4.084
109 HE1 TRP 16 HE1 TRP 16 7.405 10.023 -4.860
110 HE3 TRP 16 HE3 TRP 16 5.250 7.610 -0.604
111 HZ2 TRP 16 HZ2 TRP 16 4.934 11.154 -4.098
112 HZ3 TRP 16 HZ3 TRP 16 3.326 9.141 -0.697
113 HH2 TRP 16 HH2 TRP 16 3.173 10.876 -2.408
114 H CYS 17 H CYS 17 10.380 4.881 -1.165
115 HA CYS 17 HA CYS 17 9.676 2.119 -0.758
116 HB2 CYS 17 HB2 CYS 17 11.799 3.616 0.763
117 HB3 CYS 17 HB3 CYS 17 11.743 1.904 0.357
118 H CYS 18 H CYS 18 9.460 1.158 1.391
119 HA CYS 18 HA CYS 18 7.433 2.394 2.901
120 HB2 CYS 18 HB2 CYS 18 9.243 0.096 3.674
121 HB3 CYS 18 HB3 CYS 18 7.738 0.527 4.478
122 H GLY 19 H GLY 19 7.608 2.682 5.340
123 HA2 GLY 19 HA2 GLY 19 8.408 3.980 7.058
124 HA3 GLY 19 HA3 GLY 19 9.960 3.245 6.687
125 H ALA 20 H ALA 20 11.542 4.510 5.932
126 HA ALA 20 HA ALA 20 10.919 6.978 4.532
127 HB1 ALA 20 HB1 ALA 20 10.883 7.997 6.594
128 HB2 ALA 20 HB2 ALA 20 12.077 6.895 7.280
129 HB3 ALA 20 HB3 ALA 20 12.586 8.159 6.161
130 H LEU 21 H LEU 21 12.216 4.499 3.819
131 HA LEU 21 HA LEU 21 15.047 5.156 3.644
132 HB2 LEU 21 HB2 LEU 21 13.734 2.785 2.368
133 HB3 LEU 21 HB3 LEU 21 15.400 2.965 2.913
134 HG LEU 21 HG LEU 21 13.193 3.006 4.924
135 HD11 LEU 21 HD11 LEU 21 12.613 0.882 4.657
136 HD12 LEU 21 HD12 LEU 21 14.299 0.369 4.591
137 HD13 LEU 21 HD13 LEU 21 13.480 0.898 3.121
138 HD21 LEU 21 HD21 LEU 21 15.365 1.514 5.797
139 HD22 LEU 21 HD22 LEU 21 14.990 3.184 6.223
140 HD23 LEU 21 HD23 LEU 21 16.080 2.840 4.879
141 H SER 22 H SER 22 16.176 5.224 1.625
142 HA SER 22 HA SER 22 14.480 6.177 -0.586
143 HB2 SER 22 HB2 SER 22 16.097 7.816 0.478
144 HB3 SER 22 HB3 SER 22 17.403 6.823 -0.169
145 HG SER 22 HG SER 22 17.139 7.974 -1.902
146 H CYS 23 H CYS 23 16.273 6.146 -2.641
147 HA CYS 23 HA CYS 23 16.524 3.281 -3.130
148 HB2 CYS 23 HB2 CYS 23 16.438 5.718 -4.872
149 HB3 CYS 23 HB3 CYS 23 17.127 4.225 -5.501
150 H LYS 24 H LYS 24 18.398 2.264 -2.947
151 HA LYS 24 HA LYS 24 20.885 3.792 -3.332
152 HB2 LYS 24 HB2 LYS 24 20.407 1.662 -1.239
153 HB3 LYS 24 HB3 LYS 24 21.928 2.498 -1.527
154 HG2 LYS 24 HG2 LYS 24 21.077 3.628 0.290
155 HG3 LYS 24 HG3 LYS 24 20.555 4.643 -1.058
156 HD2 LYS 24 HD2 LYS 24 18.355 4.045 -0.834
157 HD3 LYS 24 HD3 LYS 24 18.742 2.465 -0.148
158 HE2 LYS 24 HE2 LYS 24 17.759 3.845 1.561
159 HE3 LYS 24 HE3 LYS 24 19.464 3.595 1.933
160 HZ1 LYS 24 HZ1 LYS 24 19.718 5.778 1.997
161 HZ2 LYS 24 HZ2 LYS 24 18.094 6.018 1.592
162 HZ3 LYS 24 HZ3 LYS 24 19.260 5.899 0.373
163 H TYR 25 H TYR 25 22.558 2.737 -4.361
164 HA TYR 25 HA TYR 25 21.799 0.504 -6.005
165 HB2 TYR 25 HB2 TYR 25 23.166 2.269 -6.959
166 HB3 TYR 25 HB3 TYR 25 24.414 2.002 -5.747
167 HD1 TYR 25 HD2 TYR 25 25.853 0.020 -5.861
168 HD2 TYR 25 HD1 TYR 25 22.942 0.808 -8.863
169 HE1 TYR 25 HE2 TYR 25 26.953 -1.604 -7.346
170 HE2 TYR 25 HE1 TYR 25 24.034 -0.814 -10.355
171 HH TYR 25 HH TYR 25 25.662 -2.303 -10.582
172 H SER 26 H SER 26 22.153 -1.581 -5.626
173 HA SER 26 HA SER 26 23.873 -2.308 -3.356
174 HB2 SER 26 HB2 SER 26 21.391 -3.465 -4.523
175 HB3 SER 26 HB3 SER 26 22.555 -4.590 -3.822
176 HG SER 26 HG SER 26 22.251 -3.721 -1.870
177 H ILE 27 H ILE 27 25.878 -2.475 -4.266
178 HA ILE 27 HA ILE 27 26.551 -3.462 -6.761
179 HB ILE 27 HB ILE 27 28.262 -3.923 -4.327
180 HG12 ILE 27 HG12 ILE 27 29.050 -1.500 -5.406
181 HG13 ILE 27 HG13 ILE 27 27.293 -1.407 -5.457
182 HG21 ILE 27 HG21 ILE 27 28.784 -4.704 -6.777
183 HG22 ILE 27 HG22 ILE 27 29.250 -3.017 -6.986
184 HG23 ILE 27 HG23 ILE 27 30.048 -4.006 -5.763
185 HD11 ILE 27 HD11 ILE 27 29.125 -1.374 -3.166
186 HD12 ILE 27 HD12 ILE 27 27.540 -0.627 -3.372
187 HD13 ILE 27 HD13 ILE 27 27.663 -2.336 -2.954
188 H LYS 28 H LYS 28 26.303 -5.236 -3.691
189 HA LYS 28 HA LYS 28 27.091 -7.744 -4.607
190 HB2 LYS 28 HB2 LYS 28 25.638 -8.610 -2.707
191 HB3 LYS 28 HB3 LYS 28 26.891 -7.455 -2.271
192 HG2 LYS 28 HG2 LYS 28 25.402 -6.044 -1.433
193 HG3 LYS 28 HG3 LYS 28 24.422 -6.107 -2.900
194 HD2 LYS 28 HD2 LYS 28 23.041 -7.717 -2.072
195 HD3 LYS 28 HD3 LYS 28 24.312 -8.457 -1.095
196 HE2 LYS 28 HE2 LYS 28 23.700 -5.773 -0.202
197 HE3 LYS 28 HE3 LYS 28 22.266 -6.798 -0.203
198 HZ1 LYS 28 HZ1 LYS 28 23.905 -8.459 0.950
199 HZ2 LYS 28 HZ2 LYS 28 23.113 -7.263 1.845
200 HZ3 LYS 28 HZ3 LYS 28 24.723 -7.040 1.374
201 H ARG 29 H ARG 29 23.974 -6.129 -4.789
202 HA ARG 29 HA ARG 29 22.745 -8.481 -6.000
203 HB2 ARG 29 HB2 ARG 29 21.651 -5.810 -5.126
204 HB3 ARG 29 HB3 ARG 29 20.690 -6.985 -6.014
205 HG2 ARG 29 HG2 ARG 29 21.739 -8.469 -3.949
206 HG3 ARG 29 HG3 ARG 29 21.408 -6.904 -3.203
207 HD2 ARG 29 HD2 ARG 29 19.137 -7.030 -3.643
208 HD3 ARG 29 HD3 ARG 29 19.354 -8.196 -4.948
209 HE ARG 29 HE ARG 29 19.001 -8.770 -2.173
210 HH11 ARG 29 HH11 ARG 29 20.482 -9.900 -5.114
211 HH12 ARG 29 HH12 ARG 29 20.493 -11.562 -4.623
212 HH21 ARG 29 HH21 ARG 29 19.011 -10.954 -1.515
213 HH22 ARG 29 HH22 ARG 29 19.656 -12.160 -2.576
214 H ASN 30 H ASN 30 24.703 -6.159 -7.086
215 HA ASN 30 HA ASN 30 25.000 -5.006 -9.048
216 HB2 ASN 30 HB2 ASN 30 24.814 -6.447 -11.035
217 HB3 ASN 30 HB3 ASN 30 25.562 -7.301 -9.688
218 HD21 ASN 30 HD21 ASN 30 24.839 -9.261 -9.320
219 HD22 ASN 30 HD22 ASN 30 23.289 -9.878 -9.769
220 H LEU 31 H LEU 31 22.518 -4.378 -7.805
221 HA LEU 31 HA LEU 31 21.103 -3.367 -10.125
222 HB2 LEU 31 HB2 LEU 31 19.766 -5.108 -8.062
223 HB3 LEU 31 HB3 LEU 31 18.906 -4.124 -9.244
224 HG LEU 31 HG LEU 31 20.820 -6.316 -10.018
225 HD11 LEU 31 HD11 LEU 31 19.231 -7.569 -8.927
226 HD12 LEU 31 HD12 LEU 31 18.549 -7.482 -10.550
227 HD13 LEU 31 HD13 LEU 31 17.933 -6.429 -9.277
228 HD21 LEU 31 HD21 LEU 31 19.763 -6.162 -12.165
229 HD22 LEU 31 HD22 LEU 31 20.288 -4.548 -11.684
230 HD23 LEU 31 HD23 LEU 31 18.587 -4.998 -11.555
231 H LYS 32 H LYS 32 18.892 -2.313 -8.957
232 HA LYS 32 HA LYS 32 19.973 -0.607 -6.809
233 HB2 LYS 32 HB2 LYS 32 18.239 0.153 -9.161
234 HB3 LYS 32 HB3 LYS 32 18.484 1.199 -7.768
235 HG2 LYS 32 HG2 LYS 32 20.083 2.027 -9.150
236 HG3 LYS 32 HG3 LYS 32 21.026 0.774 -8.338
237 HD2 LYS 32 HD2 LYS 32 21.454 0.609 -10.685
238 HD3 LYS 32 HD3 LYS 32 20.450 -0.767 -10.222
239 HE2 LYS 32 HE2 LYS 32 18.605 1.167 -10.888
240 HE3 LYS 32 HE3 LYS 32 19.895 1.424 -12.061
241 HZ1 LYS 32 HZ1 LYS 32 18.143 -0.189 -12.751
242 HZ2 LYS 32 HZ2 LYS 32 18.683 -1.229 -11.532
243 HZ3 LYS 32 HZ3 LYS 32 19.718 -0.804 -12.801
244 H ILE 33 H ILE 33 18.942 -0.995 -4.971
245 HA ILE 33 HA ILE 33 16.022 -1.324 -5.039
246 HB ILE 33 HB ILE 33 16.011 -3.130 -3.551
247 HG12 ILE 33 HG12 ILE 33 18.919 -2.486 -3.058
248 HG13 ILE 33 HG13 ILE 33 17.590 -2.421 -1.906
249 HG21 ILE 33 HG21 ILE 33 16.964 -3.499 -5.957
250 HG22 ILE 33 HG22 ILE 33 18.444 -3.907 -5.091
251 HG23 ILE 33 HG23 ILE 33 16.965 -4.819 -4.788
252 HD11 ILE 33 HD11 ILE 33 19.026 -4.799 -2.998
253 HD12 ILE 33 HD12 ILE 33 18.697 -4.359 -1.322
254 HD13 ILE 33 HD13 ILE 33 17.393 -4.954 -2.350
255 H CYS 34 H CYS 34 15.112 -1.137 -2.733
256 HA CYS 34 HA CYS 34 16.067 1.357 -1.646
257 HB2 CYS 34 HB2 CYS 34 13.733 -0.435 -0.983
258 HB3 CYS 34 HB3 CYS 34 14.107 1.009 -0.049
259 H VAL 35 H VAL 35 16.570 1.699 0.595
260 HA VAL 35 HA VAL 35 17.337 -0.659 2.140
261 HB VAL 35 HB VAL 35 19.284 1.577 1.555
262 HG11 VAL 35 HG11 VAL 35 19.525 0.682 3.805
263 HG12 VAL 35 HG12 VAL 35 19.602 -0.959 3.159
264 HG13 VAL 35 HG13 VAL 35 20.885 0.195 2.795
265 HG21 VAL 35 HG21 VAL 35 20.547 -0.017 0.279
266 HG22 VAL 35 HG22 VAL 35 19.419 -1.309 0.689
267 HG23 VAL 35 HG23 VAL 35 18.900 0.019 -0.349
Start of MODEL 6
1 H1 GLY 1 H GLY 1 1.565 0.246 1.027
2 HA2 GLY 1 HA2 GLY 1 2.291 -1.579 -0.841
3 HA3 GLY 1 HA3 GLY 1 1.367 -0.414 -1.777
4 H CYS 2 H CYS 2 4.401 -1.224 -0.662
5 HA CYS 2 HA CYS 2 5.546 1.186 -1.731
6 HB2 CYS 2 HB2 CYS 2 6.857 1.687 0.359
7 HB3 CYS 2 HB3 CYS 2 5.137 2.047 0.463
8 H ILE 3 H ILE 3 7.994 1.103 -1.567
9 HA ILE 3 HA ILE 3 8.832 -1.613 -2.193
10 HB ILE 3 HB ILE 3 10.412 0.950 -2.419
11 HG12 ILE 3 HG12 ILE 3 9.602 -0.212 -4.930
12 HG13 ILE 3 HG13 ILE 3 8.188 0.101 -3.928
13 HG21 ILE 3 HG21 ILE 3 11.581 -1.343 -2.306
14 HG22 ILE 3 HG22 ILE 3 10.921 -1.590 -3.921
15 HG23 ILE 3 HG23 ILE 3 12.014 -0.242 -3.613
16 HD11 ILE 3 HD11 ILE 3 9.763 1.927 -5.444
17 HD12 ILE 3 HD12 ILE 3 8.270 2.217 -4.551
18 HD13 ILE 3 HD13 ILE 3 9.828 2.375 -3.740
19 H ALA 4 H ALA 4 9.724 -2.869 -0.709
20 HA ALA 4 HA ALA 4 10.640 -1.814 1.805
21 HB1 ALA 4 HB1 ALA 4 10.810 -4.039 2.528
22 HB2 ALA 4 HB2 ALA 4 9.421 -4.021 1.440
23 HB3 ALA 4 HB3 ALA 4 10.970 -4.652 0.881
24 H LYS 5 H LYS 5 12.773 -2.633 2.709
25 HA LYS 5 HA LYS 5 14.879 -1.690 1.018
26 HB2 LYS 5 HB2 LYS 5 16.338 -2.270 2.968
27 HB3 LYS 5 HB3 LYS 5 15.005 -1.190 3.359
28 HG2 LYS 5 HG2 LYS 5 13.949 -3.694 3.817
29 HG3 LYS 5 HG3 LYS 5 15.618 -3.838 4.375
30 HD2 LYS 5 HD2 LYS 5 15.352 -1.990 5.867
31 HD3 LYS 5 HD3 LYS 5 13.773 -1.595 5.184
32 HE2 LYS 5 HE2 LYS 5 12.751 -3.443 6.171
33 HE3 LYS 5 HE3 LYS 5 14.285 -4.273 6.427
34 HZ1 LYS 5 HZ1 LYS 5 14.835 -2.800 8.177
35 HZ2 LYS 5 HZ2 LYS 5 13.248 -3.309 8.464
36 HZ3 LYS 5 HZ3 LYS 5 13.540 -1.769 7.828
37 H ASN 6 H ASN 6 14.378 -3.407 -0.647
38 HA ASN 6 HA ASN 6 16.445 -5.257 -0.788
39 HB2 ASN 6 HB2 ASN 6 15.496 -6.616 0.882
40 HB3 ASN 6 HB3 ASN 6 13.860 -6.366 0.280
41 HD21 ASN 6 HD21 ASN 6 13.089 -8.200 -0.454
42 HD22 ASN 6 HD22 ASN 6 13.937 -9.345 -1.432
43 H LYS 7 H LYS 7 13.245 -4.279 -1.744
44 HA LYS 7 HA LYS 7 13.393 -5.653 -4.295
45 HB2 LYS 7 HB2 LYS 7 11.337 -3.636 -3.387
46 HB3 LYS 7 HB3 LYS 7 11.186 -4.793 -4.702
47 HG2 LYS 7 HG2 LYS 7 11.773 -6.218 -2.311
48 HG3 LYS 7 HG3 LYS 7 10.443 -5.102 -1.996
49 HD2 LYS 7 HD2 LYS 7 9.066 -6.094 -3.569
50 HD3 LYS 7 HD3 LYS 7 10.419 -6.782 -4.470
51 HE2 LYS 7 HE2 LYS 7 10.831 -8.211 -2.385
52 HE3 LYS 7 HE3 LYS 7 9.217 -7.715 -1.881
53 HZ1 LYS 7 HZ1 LYS 7 8.232 -8.930 -3.508
54 HZ2 LYS 7 HZ2 LYS 7 9.615 -9.879 -3.291
55 HZ3 LYS 7 HZ3 LYS 7 9.531 -8.789 -4.582
56 H GLU 8 H GLU 8 13.586 -4.668 -6.302
57 HA GLU 8 HA GLU 8 15.272 -2.405 -6.432
58 HB2 GLU 8 HB2 GLU 8 15.318 -2.737 -8.735
59 HB3 GLU 8 HB3 GLU 8 14.976 -4.347 -8.119
60 HG2 GLU 8 HG2 GLU 8 12.579 -3.971 -8.564
61 HG3 GLU 8 HG3 GLU 8 12.984 -2.407 -9.269
62 H CYS 9 H CYS 9 14.878 -0.324 -7.259
63 HA CYS 9 HA CYS 9 12.135 0.521 -7.696
64 HB2 CYS 9 HB2 CYS 9 12.328 2.356 -6.008
65 HB3 CYS 9 HB3 CYS 9 12.257 0.745 -5.301
66 H ALA 10 H ALA 10 11.967 2.345 -8.943
67 HA ALA 10 HA ALA 10 14.482 3.327 -10.081
68 HB1 ALA 10 HB1 ALA 10 12.431 2.398 -11.425
69 HB2 ALA 10 HB2 ALA 10 11.823 4.041 -11.219
70 HB3 ALA 10 HB3 ALA 10 13.363 3.767 -12.034
71 H TRP 11 H TRP 11 14.939 5.529 -10.275
72 HA TRP 11 HA TRP 11 14.188 7.149 -8.106
73 HB2 TRP 11 HB2 TRP 11 15.698 7.595 -10.647
74 HB3 TRP 11 HB3 TRP 11 15.203 8.996 -9.701
75 HD1 TRP 11 HD1 TRP 11 16.016 6.081 -7.528
76 HE1 TRP 11 HE1 TRP 11 18.327 6.405 -6.442
77 HE3 TRP 11 HE3 TRP 11 17.672 10.037 -10.310
78 HZ2 TRP 11 HZ2 TRP 11 20.557 8.113 -6.727
79 HZ3 TRP 11 HZ3 TRP 11 19.905 10.957 -9.840
80 HH2 TRP 11 HH2 TRP 11 21.316 10.014 -8.085
81 H PHE 12 H PHE 12 12.601 6.493 -11.037
82 HA PHE 12 HA PHE 12 10.702 8.670 -10.500
83 HB2 PHE 12 HB2 PHE 12 12.359 8.890 -12.576
84 HB3 PHE 12 HB3 PHE 12 11.145 7.863 -13.333
85 HD1 PHE 12 HD1 PHE 12 11.611 11.075 -11.547
86 HD2 PHE 12 HD2 PHE 12 9.146 8.764 -14.135
87 HE1 PHE 12 HE1 PHE 12 10.215 13.055 -11.980
88 HE2 PHE 12 HE2 PHE 12 7.748 10.740 -14.574
89 HZ PHE 12 HZ PHE 12 8.282 12.890 -13.496
90 H SER 13 H SER 13 10.752 5.778 -9.873
91 HA SER 13 HA SER 13 8.995 4.385 -11.596
92 HB2 SER 13 HB2 SER 13 8.751 2.796 -9.720
93 HB3 SER 13 HB3 SER 13 10.441 3.214 -10.004
94 HG SER 13 HG SER 13 10.421 4.505 -8.216
95 H GLY 14 H GLY 14 8.456 6.934 -9.452
96 HA2 GLY 14 HA2 GLY 14 6.405 8.074 -9.257
97 HA3 GLY 14 HA3 GLY 14 5.570 6.615 -9.768
98 H GLU 15 H GLU 15 7.136 4.997 -7.804
99 HA GLU 15 HA GLU 15 5.524 5.700 -5.452
100 HB2 GLU 15 HB2 GLU 15 6.042 3.295 -4.779
101 HB3 GLU 15 HB3 GLU 15 4.967 3.522 -6.152
102 HG2 GLU 15 HG2 GLU 15 6.689 2.974 -7.695
103 HG3 GLU 15 HG3 GLU 15 7.914 3.004 -6.428
104 H TRP 16 H TRP 16 6.584 4.820 -3.341
105 HA TRP 16 HA TRP 16 9.439 5.540 -3.327
106 HB2 TRP 16 HB2 TRP 16 7.318 6.411 -1.355
107 HB3 TRP 16 HB3 TRP 16 9.049 6.632 -1.111
108 HD1 TRP 16 HD1 TRP 16 6.644 7.479 -4.057
109 HE1 TRP 16 HE1 TRP 16 7.145 9.890 -4.805
110 HE3 TRP 16 HE3 TRP 16 10.358 8.606 -0.729
111 HZ2 TRP 16 HZ2 TRP 16 8.885 11.992 -4.080
112 HZ3 TRP 16 HZ3 TRP 16 11.389 10.839 -0.823
113 HH2 TRP 16 HH2 TRP 16 10.666 12.495 -2.465
114 H CYS 17 H CYS 17 10.460 4.886 -1.152
115 HA CYS 17 HA CYS 17 9.940 2.073 -0.794
116 HB2 CYS 17 HB2 CYS 17 11.909 3.722 0.782
117 HB3 CYS 17 HB3 CYS 17 11.971 2.000 0.423
118 H CYS 18 H CYS 18 9.802 1.113 1.396
119 HA CYS 18 HA CYS 18 7.642 2.271 2.844
120 HB2 CYS 18 HB2 CYS 18 9.421 -0.077 3.534
121 HB3 CYS 18 HB3 CYS 18 7.926 0.339 4.365
122 H GLY 19 H GLY 19 7.735 2.494 5.280
123 HA2 GLY 19 HA2 GLY 19 8.493 3.718 7.070
124 HA3 GLY 19 HA3 GLY 19 10.045 2.966 6.733
125 H ALA 20 H ALA 20 11.672 4.276 6.240
126 HA ALA 20 HA ALA 20 11.139 6.799 4.869
127 HB1 ALA 20 HB1 ALA 20 12.002 8.196 6.472
128 HB2 ALA 20 HB2 ALA 20 11.196 6.995 7.482
129 HB3 ALA 20 HB3 ALA 20 12.941 6.915 7.240
130 H LEU 21 H LEU 21 12.333 4.431 3.907
131 HA LEU 21 HA LEU 21 15.200 5.020 3.838
132 HB2 LEU 21 HB2 LEU 21 13.860 2.685 2.517
133 HB3 LEU 21 HB3 LEU 21 15.539 2.847 3.028
134 HG LEU 21 HG LEU 21 13.357 2.832 5.074
135 HD11 LEU 21 HD11 LEU 21 12.838 0.690 4.803
136 HD12 LEU 21 HD12 LEU 21 14.534 0.227 4.661
137 HD13 LEU 21 HD13 LEU 21 13.645 0.768 3.237
138 HD21 LEU 21 HD21 LEU 21 16.250 2.717 4.999
139 HD22 LEU 21 HD22 LEU 21 15.561 1.377 5.916
140 HD23 LEU 21 HD23 LEU 21 15.167 3.040 6.353
141 H SER 22 H SER 22 16.324 5.005 1.773
142 HA SER 22 HA SER 22 14.649 6.122 -0.377
143 HB2 SER 22 HB2 SER 22 17.372 6.801 0.631
144 HB3 SER 22 HB3 SER 22 17.065 6.990 -1.095
145 HG SER 22 HG SER 22 16.515 8.738 0.669
146 H CYS 23 H CYS 23 16.125 5.981 -2.544
147 HA CYS 23 HA CYS 23 16.508 3.101 -2.938
148 HB2 CYS 23 HB2 CYS 23 15.961 5.362 -4.862
149 HB3 CYS 23 HB3 CYS 23 16.393 3.740 -5.394
150 H LYS 24 H LYS 24 18.567 2.563 -2.522
151 HA LYS 24 HA LYS 24 20.691 4.194 -3.753
152 HB2 LYS 24 HB2 LYS 24 21.193 2.269 -1.508
153 HB3 LYS 24 HB3 LYS 24 22.129 3.679 -1.987
154 HG2 LYS 24 HG2 LYS 24 21.157 4.608 -0.192
155 HG3 LYS 24 HG3 LYS 24 19.808 4.861 -1.301
156 HD2 LYS 24 HD2 LYS 24 18.931 2.614 -0.550
157 HD3 LYS 24 HD3 LYS 24 20.158 2.653 0.718
158 HE2 LYS 24 HE2 LYS 24 18.166 4.871 0.319
159 HE3 LYS 24 HE3 LYS 24 17.835 3.475 1.342
160 HZ1 LYS 24 HZ1 LYS 24 19.398 5.783 1.904
161 HZ2 LYS 24 HZ2 LYS 24 20.309 4.375 2.123
162 HZ3 LYS 24 HZ3 LYS 24 18.852 4.577 2.958
163 H TYR 25 H TYR 25 22.646 2.955 -4.398
164 HA TYR 25 HA TYR 25 21.859 0.685 -5.987
165 HB2 TYR 25 HB2 TYR 25 23.366 2.325 -6.951
166 HB3 TYR 25 HB3 TYR 25 24.526 2.071 -5.652
167 HD1 TYR 25 HD2 TYR 25 25.914 0.070 -5.596
168 HD2 TYR 25 HD1 TYR 25 23.140 0.721 -8.755
169 HE1 TYR 25 HE2 TYR 25 27.019 -1.684 -6.920
170 HE2 TYR 25 HE1 TYR 25 24.235 -1.032 -10.088
171 HH TYR 25 HH TYR 25 25.644 -2.960 -9.791
172 H SER 26 H SER 26 22.218 -1.410 -5.586
173 HA SER 26 HA SER 26 23.711 -2.089 -3.142
174 HB2 SER 26 HB2 SER 26 21.265 -3.206 -4.418
175 HB3 SER 26 HB3 SER 26 22.337 -4.341 -3.597
176 HG SER 26 HG SER 26 22.117 -3.120 -1.715
177 H ILE 27 H ILE 27 25.761 -2.391 -3.889
178 HA ILE 27 HA ILE 27 26.556 -3.506 -6.296
179 HB ILE 27 HB ILE 27 28.085 -3.924 -3.738
180 HG12 ILE 27 HG12 ILE 27 29.036 -1.577 -4.854
181 HG13 ILE 27 HG13 ILE 27 27.291 -1.423 -5.025
182 HG21 ILE 27 HG21 ILE 27 29.016 -3.379 -6.553
183 HG22 ILE 27 HG22 ILE 27 30.027 -3.762 -5.160
184 HG23 ILE 27 HG23 ILE 27 28.926 -4.976 -5.810
185 HD11 ILE 27 HD11 ILE 27 28.970 -1.363 -2.621
186 HD12 ILE 27 HD12 ILE 27 27.432 -0.568 -2.961
187 HD13 ILE 27 HD13 ILE 27 27.460 -2.262 -2.470
188 H LYS 28 H LYS 28 26.007 -5.125 -3.183
189 HA LYS 28 HA LYS 28 26.767 -7.699 -3.912
190 HB2 LYS 28 HB2 LYS 28 25.164 -8.436 -2.105
191 HB3 LYS 28 HB3 LYS 28 26.361 -7.245 -1.614
192 HG2 LYS 28 HG2 LYS 28 24.741 -5.938 -0.874
193 HG3 LYS 28 HG3 LYS 28 24.089 -5.826 -2.511
194 HD2 LYS 28 HD2 LYS 28 22.271 -6.701 -1.443
195 HD3 LYS 28 HD3 LYS 28 23.094 -8.199 -1.882
196 HE2 LYS 28 HE2 LYS 28 23.532 -8.720 0.255
197 HE3 LYS 28 HE3 LYS 28 23.974 -7.063 0.666
198 HZ1 LYS 28 HZ1 LYS 28 21.151 -7.817 0.253
199 HZ2 LYS 28 HZ2 LYS 28 21.783 -6.507 1.116
200 HZ3 LYS 28 HZ3 LYS 28 21.904 -8.072 1.747
201 H ARG 29 H ARG 29 23.726 -6.000 -4.417
202 HA ARG 29 HA ARG 29 22.542 -8.361 -5.659
203 HB2 ARG 29 HB2 ARG 29 21.378 -5.624 -5.116
204 HB3 ARG 29 HB3 ARG 29 20.492 -6.987 -5.786
205 HG2 ARG 29 HG2 ARG 29 21.722 -7.861 -3.392
206 HG3 ARG 29 HG3 ARG 29 20.934 -6.316 -3.066
207 HD2 ARG 29 HD2 ARG 29 19.449 -8.252 -2.685
208 HD3 ARG 29 HD3 ARG 29 18.841 -7.153 -3.922
209 HE ARG 29 HE ARG 29 19.004 -8.850 -5.440
210 HH11 ARG 29 HH11 ARG 29 20.975 -9.624 -2.677
211 HH12 ARG 29 HH12 ARG 29 21.352 -11.222 -3.231
212 HH21 ARG 29 HH21 ARG 29 19.493 -10.951 -6.180
213 HH22 ARG 29 HH22 ARG 29 20.509 -11.976 -5.223
214 H ASN 30 H ASN 30 24.648 -6.145 -6.649
215 HA ASN 30 HA ASN 30 25.144 -5.063 -8.609
216 HB2 ASN 30 HB2 ASN 30 25.050 -6.531 -10.566
217 HB3 ASN 30 HB3 ASN 30 25.599 -7.421 -9.149
218 HD21 ASN 30 HD21 ASN 30 23.144 -7.064 -11.526
219 HD22 ASN 30 HD22 ASN 30 22.202 -8.441 -11.075
220 H LEU 31 H LEU 31 22.579 -4.338 -7.541
221 HA LEU 31 HA LEU 31 21.413 -3.241 -9.956
222 HB2 LEU 31 HB2 LEU 31 19.818 -4.952 -8.057
223 HB3 LEU 31 HB3 LEU 31 19.123 -3.937 -9.318
224 HG LEU 31 HG LEU 31 21.023 -6.203 -9.889
225 HD11 LEU 31 HD11 LEU 31 19.276 -7.399 -9.008
226 HD12 LEU 31 HD12 LEU 31 18.764 -7.253 -10.689
227 HD13 LEU 31 HD13 LEU 31 18.074 -6.191 -9.462
228 HD21 LEU 31 HD21 LEU 31 20.550 -4.248 -11.527
229 HD22 LEU 31 HD22 LEU 31 18.991 -5.042 -11.751
230 HD23 LEU 31 HD23 LEU 31 20.483 -5.908 -12.118
231 H LYS 32 H LYS 32 19.141 -2.129 -8.970
232 HA LYS 32 HA LYS 32 20.123 -0.444 -6.760
233 HB2 LYS 32 HB2 LYS 32 18.190 0.390 -8.926
234 HB3 LYS 32 HB3 LYS 32 18.941 1.422 -7.716
235 HG2 LYS 32 HG2 LYS 32 20.257 1.903 -9.505
236 HG3 LYS 32 HG3 LYS 32 21.158 0.541 -8.837
237 HD2 LYS 32 HD2 LYS 32 20.935 -0.525 -10.774
238 HD3 LYS 32 HD3 LYS 32 19.184 -0.532 -10.549
239 HE2 LYS 32 HE2 LYS 32 19.013 1.629 -11.645
240 HE3 LYS 32 HE3 LYS 32 20.767 1.707 -11.808
241 HZ1 LYS 32 HZ1 LYS 32 18.981 0.633 -13.608
242 HZ2 LYS 32 HZ2 LYS 32 19.754 -0.702 -12.914
243 HZ3 LYS 32 HZ3 LYS 32 20.668 0.512 -13.656
244 H ILE 33 H ILE 33 19.069 -0.843 -4.938
245 HA ILE 33 HA ILE 33 16.154 -1.178 -5.041
246 HB ILE 33 HB ILE 33 16.120 -3.017 -3.583
247 HG12 ILE 33 HG12 ILE 33 19.040 -2.422 -3.109
248 HG13 ILE 33 HG13 ILE 33 17.727 -2.400 -1.937
249 HG21 ILE 33 HG21 ILE 33 18.507 -3.691 -5.271
250 HG22 ILE 33 HG22 ILE 33 17.146 -4.716 -4.818
251 HG23 ILE 33 HG23 ILE 33 16.918 -3.412 -5.983
252 HD11 ILE 33 HD11 ILE 33 18.879 -4.358 -1.466
253 HD12 ILE 33 HD12 ILE 33 17.511 -4.903 -2.438
254 HD13 ILE 33 HD13 ILE 33 19.107 -4.748 -3.171
255 H CYS 34 H CYS 34 15.254 -1.092 -2.703
256 HA CYS 34 HA CYS 34 16.240 1.366 -1.537
257 HB2 CYS 34 HB2 CYS 34 13.835 -0.369 -0.979
258 HB3 CYS 34 HB3 CYS 34 14.231 1.044 -0.006
259 H VAL 35 H VAL 35 16.550 1.586 0.801
260 HA VAL 35 HA VAL 35 17.467 -0.880 2.111
261 HB VAL 35 HB VAL 35 19.009 1.719 2.065
262 HG11 VAL 35 HG11 VAL 35 19.207 0.622 4.212
263 HG12 VAL 35 HG12 VAL 35 19.600 -0.908 3.425
264 HG13 VAL 35 HG13 VAL 35 20.716 0.454 3.316
265 HG21 VAL 35 HG21 VAL 35 19.052 0.255 -0.016
266 HG22 VAL 35 HG22 VAL 35 20.611 0.656 0.706
267 HG23 VAL 35 HG23 VAL 35 19.900 -0.936 0.972
Start of MODEL 7
1 H1 GLY 1 H GLY 1 1.852 -1.057 -3.770
2 HA2 GLY 1 HA2 GLY 1 1.313 0.495 -2.108
3 HA3 GLY 1 HA3 GLY 1 1.945 -0.614 -0.900
4 H CYS 2 H CYS 2 4.266 -0.763 -0.648
5 HA CYS 2 HA CYS 2 5.725 1.577 -1.670
6 HB2 CYS 2 HB2 CYS 2 6.790 1.846 0.543
7 HB3 CYS 2 HB3 CYS 2 5.049 2.095 0.612
8 H ILE 3 H ILE 3 8.080 1.345 -1.558
9 HA ILE 3 HA ILE 3 8.855 -1.378 -2.233
10 HB ILE 3 HB ILE 3 10.530 1.130 -2.367
11 HG12 ILE 3 HG12 ILE 3 9.747 0.204 -4.942
12 HG13 ILE 3 HG13 ILE 3 8.293 0.340 -3.960
13 HG21 ILE 3 HG21 ILE 3 12.019 -0.104 -3.731
14 HG22 ILE 3 HG22 ILE 3 11.677 -1.117 -2.329
15 HG23 ILE 3 HG23 ILE 3 10.889 -1.450 -3.871
16 HD11 ILE 3 HD11 ILE 3 10.008 2.639 -3.637
17 HD12 ILE 3 HD12 ILE 3 9.570 2.374 -5.325
18 HD13 ILE 3 HD13 ILE 3 8.310 2.549 -4.104
19 H ALA 4 H ALA 4 9.641 -2.686 -0.733
20 HA ALA 4 HA ALA 4 10.577 -1.704 1.800
21 HB1 ALA 4 HB1 ALA 4 9.306 -3.923 1.212
22 HB2 ALA 4 HB2 ALA 4 10.940 -4.543 0.973
23 HB3 ALA 4 HB3 ALA 4 10.472 -3.874 2.535
24 H LYS 5 H LYS 5 12.664 -2.598 2.721
25 HA LYS 5 HA LYS 5 14.826 -1.731 1.064
26 HB2 LYS 5 HB2 LYS 5 16.234 -2.401 3.030
27 HB3 LYS 5 HB3 LYS 5 14.956 -1.251 3.403
28 HG2 LYS 5 HG2 LYS 5 13.966 -3.908 3.755
29 HG3 LYS 5 HG3 LYS 5 15.484 -3.720 4.636
30 HD2 LYS 5 HD2 LYS 5 13.416 -1.580 4.839
31 HD3 LYS 5 HD3 LYS 5 13.192 -3.077 5.747
32 HE2 LYS 5 HE2 LYS 5 15.682 -1.383 5.865
33 HE3 LYS 5 HE3 LYS 5 14.347 -1.252 7.008
34 HZ1 LYS 5 HZ1 LYS 5 16.235 -3.485 6.626
35 HZ2 LYS 5 HZ2 LYS 5 14.727 -3.749 7.345
36 HZ3 LYS 5 HZ3 LYS 5 15.824 -2.673 8.053
37 H ASN 6 H ASN 6 14.233 -3.436 -0.609
38 HA ASN 6 HA ASN 6 16.243 -5.343 -0.777
39 HB2 ASN 6 HB2 ASN 6 15.297 -6.684 0.903
40 HB3 ASN 6 HB3 ASN 6 13.653 -6.373 0.353
41 HD21 ASN 6 HD21 ASN 6 12.853 -8.268 -0.216
42 HD22 ASN 6 HD22 ASN 6 13.606 -9.403 -1.279
43 H LYS 7 H LYS 7 13.091 -4.226 -1.698
44 HA LYS 7 HA LYS 7 13.114 -5.643 -4.228
45 HB2 LYS 7 HB2 LYS 7 11.206 -3.534 -3.202
46 HB3 LYS 7 HB3 LYS 7 10.973 -4.525 -4.636
47 HG2 LYS 7 HG2 LYS 7 11.456 -6.245 -2.423
48 HG3 LYS 7 HG3 LYS 7 10.211 -5.077 -1.973
49 HD2 LYS 7 HD2 LYS 7 8.773 -5.771 -3.659
50 HD3 LYS 7 HD3 LYS 7 10.075 -6.490 -4.609
51 HE2 LYS 7 HE2 LYS 7 10.024 -7.815 -2.113
52 HE3 LYS 7 HE3 LYS 7 8.359 -7.719 -2.684
53 HZ1 LYS 7 HZ1 LYS 7 10.682 -8.965 -4.028
54 HZ2 LYS 7 HZ2 LYS 7 9.262 -8.587 -4.865
55 HZ3 LYS 7 HZ3 LYS 7 9.219 -9.686 -3.580
56 H GLU 8 H GLU 8 13.260 -4.671 -6.266
57 HA GLU 8 HA GLU 8 15.190 -2.707 -6.596
58 HB2 GLU 8 HB2 GLU 8 14.728 -2.788 -8.895
59 HB3 GLU 8 HB3 GLU 8 14.279 -4.383 -8.306
60 HG2 GLU 8 HG2 GLU 8 11.917 -3.604 -8.199
61 HG3 GLU 8 HG3 GLU 8 12.432 -2.105 -8.972
62 H CYS 9 H CYS 9 15.046 -0.537 -7.405
63 HA CYS 9 HA CYS 9 12.510 0.851 -7.132
64 HB2 CYS 9 HB2 CYS 9 13.407 2.506 -5.541
65 HB3 CYS 9 HB3 CYS 9 13.359 0.890 -4.843
66 H ALA 10 H ALA 10 12.404 2.731 -8.306
67 HA ALA 10 HA ALA 10 14.813 3.404 -9.868
68 HB1 ALA 10 HB1 ALA 10 12.377 4.341 -11.081
69 HB2 ALA 10 HB2 ALA 10 13.617 3.270 -11.735
70 HB3 ALA 10 HB3 ALA 10 12.295 2.606 -10.775
71 H TRP 11 H TRP 11 15.369 5.542 -10.143
72 HA TRP 11 HA TRP 11 14.697 7.338 -8.090
73 HB2 TRP 11 HB2 TRP 11 16.216 7.544 -10.657
74 HB3 TRP 11 HB3 TRP 11 15.789 9.025 -9.803
75 HD1 TRP 11 HD1 TRP 11 16.484 6.216 -7.452
76 HE1 TRP 11 HE1 TRP 11 18.811 6.508 -6.391
77 HE3 TRP 11 HE3 TRP 11 18.294 9.921 -10.474
78 HZ2 TRP 11 HZ2 TRP 11 21.109 8.099 -6.783
79 HZ3 TRP 11 HZ3 TRP 11 20.566 10.773 -10.064
80 HH2 TRP 11 HH2 TRP 11 21.942 9.880 -8.256
81 H PHE 12 H PHE 12 13.072 6.549 -10.964
82 HA PHE 12 HA PHE 12 11.294 8.862 -10.603
83 HB2 PHE 12 HB2 PHE 12 12.921 8.776 -12.714
84 HB3 PHE 12 HB3 PHE 12 11.635 7.754 -13.346
85 HD1 PHE 12 HD1 PHE 12 12.297 11.088 -11.863
86 HD2 PHE 12 HD2 PHE 12 9.702 8.696 -14.241
87 HE1 PHE 12 HE1 PHE 12 11.012 13.095 -12.473
88 HE2 PHE 12 HE2 PHE 12 8.413 10.699 -14.856
89 HZ PHE 12 HZ PHE 12 9.068 12.903 -13.973
90 H SER 13 H SER 13 11.303 5.926 -9.837
91 HA SER 13 HA SER 13 9.437 4.491 -11.329
92 HB2 SER 13 HB2 SER 13 9.354 2.987 -9.545
93 HB3 SER 13 HB3 SER 13 10.922 3.760 -9.314
94 HG SER 13 HG SER 13 9.744 5.234 -7.866
95 H GLY 14 H GLY 14 9.010 7.187 -9.236
96 HA2 GLY 14 HA2 GLY 14 7.062 8.503 -9.161
97 HA3 GLY 14 HA3 GLY 14 6.143 7.140 -9.783
98 H GLU 15 H GLU 15 7.539 5.424 -7.684
99 HA GLU 15 HA GLU 15 5.690 6.115 -5.509
100 HB2 GLU 15 HB2 GLU 15 6.153 3.714 -4.788
101 HB3 GLU 15 HB3 GLU 15 5.231 3.933 -6.268
102 HG2 GLU 15 HG2 GLU 15 7.088 3.375 -7.620
103 HG3 GLU 15 HG3 GLU 15 8.197 3.467 -6.252
104 H TRP 16 H TRP 16 6.630 4.984 -3.345
105 HA TRP 16 HA TRP 16 9.419 5.846 -3.016
106 HB2 TRP 16 HB2 TRP 16 7.382 6.429 -0.885
107 HB3 TRP 16 HB3 TRP 16 8.968 7.156 -1.131
108 HD1 TRP 16 HD1 TRP 16 8.904 8.347 -3.911
109 HE1 TRP 16 HE1 TRP 16 7.225 10.170 -4.606
110 HE3 TRP 16 HE3 TRP 16 5.311 7.535 -0.366
111 HZ2 TRP 16 HZ2 TRP 16 4.711 11.136 -3.762
112 HZ3 TRP 16 HZ3 TRP 16 3.300 8.952 -0.378
113 HH2 TRP 16 HH2 TRP 16 3.008 10.715 -2.042
114 H CYS 17 H CYS 17 10.498 4.917 -1.166
115 HA CYS 17 HA CYS 17 9.831 2.168 -0.802
116 HB2 CYS 17 HB2 CYS 17 11.855 3.732 0.799
117 HB3 CYS 17 HB3 CYS 17 11.847 2.005 0.457
118 H CYS 18 H CYS 18 9.714 1.156 1.388
119 HA CYS 18 HA CYS 18 7.559 2.305 2.854
120 HB2 CYS 18 HB2 CYS 18 9.311 -0.048 3.594
121 HB3 CYS 18 HB3 CYS 18 7.738 0.336 4.284
122 H GLY 19 H GLY 19 7.700 2.363 5.340
123 HA2 GLY 19 HA2 GLY 19 8.463 3.549 7.155
124 HA3 GLY 19 HA3 GLY 19 10.019 2.835 6.760
125 H ALA 20 H ALA 20 11.617 4.188 6.287
126 HA ALA 20 HA ALA 20 11.033 6.743 5.006
127 HB1 ALA 20 HB1 ALA 20 12.242 8.045 6.642
128 HB2 ALA 20 HB2 ALA 20 10.927 7.176 7.434
129 HB3 ALA 20 HB3 ALA 20 12.585 6.596 7.587
130 H LEU 21 H LEU 21 12.328 4.340 4.102
131 HA LEU 21 HA LEU 21 15.162 5.050 4.011
132 HB2 LEU 21 HB2 LEU 21 13.916 2.668 2.685
133 HB3 LEU 21 HB3 LEU 21 15.581 2.888 3.217
134 HG LEU 21 HG LEU 21 13.515 2.911 5.332
135 HD11 LEU 21 HD11 LEU 21 13.243 0.966 3.441
136 HD12 LEU 21 HD12 LEU 21 12.770 0.811 5.133
137 HD13 LEU 21 HD13 LEU 21 14.336 0.203 4.596
138 HD21 LEU 21 HD21 LEU 21 15.769 1.123 5.615
139 HD22 LEU 21 HD22 LEU 21 15.289 2.498 6.609
140 HD23 LEU 21 HD23 LEU 21 16.283 2.751 5.173
141 H SER 22 H SER 22 16.293 5.079 1.954
142 HA SER 22 HA SER 22 14.588 6.137 -0.202
143 HB2 SER 22 HB2 SER 22 17.267 6.912 0.833
144 HB3 SER 22 HB3 SER 22 17.011 7.046 -0.907
145 HG SER 22 HG SER 22 14.942 8.157 -0.123
146 H CYS 23 H CYS 23 16.193 6.062 -2.339
147 HA CYS 23 HA CYS 23 16.521 3.187 -2.788
148 HB2 CYS 23 HB2 CYS 23 15.041 4.473 -4.313
149 HB3 CYS 23 HB3 CYS 23 16.428 5.441 -4.803
150 H LYS 24 H LYS 24 18.474 2.313 -2.839
151 HA LYS 24 HA LYS 24 20.758 3.982 -3.645
152 HB2 LYS 24 HB2 LYS 24 21.013 1.908 -1.485
153 HB3 LYS 24 HB3 LYS 24 22.099 3.238 -1.867
154 HG2 LYS 24 HG2 LYS 24 21.119 4.066 0.008
155 HG3 LYS 24 HG3 LYS 24 19.998 4.688 -1.205
156 HD2 LYS 24 HD2 LYS 24 18.372 3.106 -0.693
157 HD3 LYS 24 HD3 LYS 24 19.534 2.016 0.067
158 HE2 LYS 24 HE2 LYS 24 17.942 3.306 1.596
159 HE3 LYS 24 HE3 LYS 24 19.655 3.312 2.009
160 HZ1 LYS 24 HZ1 LYS 24 19.888 5.496 1.403
161 HZ2 LYS 24 HZ2 LYS 24 18.310 5.514 2.011
162 HZ3 LYS 24 HZ3 LYS 24 18.572 5.475 0.340
163 H TYR 25 H TYR 25 22.617 2.752 -4.411
164 HA TYR 25 HA TYR 25 21.773 0.543 -6.062
165 HB2 TYR 25 HB2 TYR 25 23.262 2.228 -6.997
166 HB3 TYR 25 HB3 TYR 25 24.465 1.891 -5.757
167 HD1 TYR 25 HD2 TYR 25 25.805 -0.147 -5.844
168 HD2 TYR 25 HD1 TYR 25 22.956 0.736 -8.878
169 HE1 TYR 25 HE2 TYR 25 26.830 -1.849 -7.293
170 HE2 TYR 25 HE1 TYR 25 23.973 -0.965 -10.336
171 HH TYR 25 HH TYR 25 26.527 -3.087 -9.178
172 H SER 26 H SER 26 22.229 -1.571 -5.809
173 HA SER 26 HA SER 26 23.766 -2.333 -3.414
174 HB2 SER 26 HB2 SER 26 21.272 -3.401 -4.637
175 HB3 SER 26 HB3 SER 26 22.370 -4.566 -3.896
176 HG SER 26 HG SER 26 22.293 -3.197 -1.998
177 H ILE 27 H ILE 27 25.786 -2.650 -4.210
178 HA ILE 27 HA ILE 27 26.470 -3.696 -6.699
179 HB ILE 27 HB ILE 27 28.139 -4.130 -4.234
180 HG12 ILE 27 HG12 ILE 27 28.991 -1.744 -5.340
181 HG13 ILE 27 HG13 ILE 27 27.238 -1.615 -5.425
182 HG21 ILE 27 HG21 ILE 27 28.715 -5.015 -6.596
183 HG22 ILE 27 HG22 ILE 27 29.106 -3.333 -6.949
184 HG23 ILE 27 HG23 ILE 27 29.962 -4.186 -5.665
185 HD11 ILE 27 HD11 ILE 27 29.028 -1.606 -3.094
186 HD12 ILE 27 HD12 ILE 27 27.487 -0.788 -3.354
187 HD13 ILE 27 HD13 ILE 27 27.515 -2.492 -2.904
188 H LYS 28 H LYS 28 26.004 -5.341 -3.595
189 HA LYS 28 HA LYS 28 26.782 -7.908 -4.397
190 HB2 LYS 28 HB2 LYS 28 24.613 -7.315 -2.386
191 HB3 LYS 28 HB3 LYS 28 25.683 -8.710 -2.435
192 HG2 LYS 28 HG2 LYS 28 26.881 -7.612 -0.911
193 HG3 LYS 28 HG3 LYS 28 27.454 -6.637 -2.266
194 HD2 LYS 28 HD2 LYS 28 26.603 -4.853 -1.243
195 HD3 LYS 28 HD3 LYS 28 24.996 -5.522 -1.537
196 HE2 LYS 28 HE2 LYS 28 26.501 -6.562 0.796
197 HE3 LYS 28 HE3 LYS 28 25.883 -4.914 0.904
198 HZ1 LYS 28 HZ1 LYS 28 24.480 -7.206 1.403
199 HZ2 LYS 28 HZ2 LYS 28 23.929 -6.725 -0.121
200 HZ3 LYS 28 HZ3 LYS 28 23.825 -5.661 1.190
201 H ARG 29 H ARG 29 23.675 -6.249 -4.614
202 HA ARG 29 HA ARG 29 22.419 -8.589 -5.805
203 HB2 ARG 29 HB2 ARG 29 21.351 -5.848 -5.118
204 HB3 ARG 29 HB3 ARG 29 20.389 -7.118 -5.862
205 HG2 ARG 29 HG2 ARG 29 21.616 -8.247 -3.590
206 HG3 ARG 29 HG3 ARG 29 20.964 -6.679 -3.107
207 HD2 ARG 29 HD2 ARG 29 19.060 -7.853 -2.831
208 HD3 ARG 29 HD3 ARG 29 18.908 -7.622 -4.572
209 HE ARG 29 HE ARG 29 19.233 -9.866 -4.854
210 HH11 ARG 29 HH11 ARG 29 20.301 -8.963 -1.666
211 HH12 ARG 29 HH12 ARG 29 20.578 -10.595 -1.154
212 HH21 ARG 29 HH21 ARG 29 19.593 -12.019 -4.192
213 HH22 ARG 29 HH22 ARG 29 20.175 -12.333 -2.592
214 H ASN 30 H ASN 30 24.481 -6.415 -6.948
215 HA ASN 30 HA ASN 30 24.865 -5.354 -8.943
216 HB2 ASN 30 HB2 ASN 30 24.612 -6.828 -10.881
217 HB3 ASN 30 HB3 ASN 30 25.236 -7.723 -9.499
218 HD21 ASN 30 HD21 ASN 30 22.632 -7.324 -11.706
219 HD22 ASN 30 HD22 ASN 30 21.697 -8.680 -11.187
220 H LEU 31 H LEU 31 22.388 -4.580 -7.707
221 HA LEU 31 HA LEU 31 21.088 -3.461 -10.042
222 HB2 LEU 31 HB2 LEU 31 19.585 -5.145 -8.045
223 HB3 LEU 31 HB3 LEU 31 18.832 -4.121 -9.265
224 HG LEU 31 HG LEU 31 20.655 -6.423 -9.939
225 HD11 LEU 31 HD11 LEU 31 18.317 -7.414 -10.609
226 HD12 LEU 31 HD12 LEU 31 17.745 -6.356 -9.320
227 HD13 LEU 31 HD13 LEU 31 18.948 -7.598 -8.972
228 HD21 LEU 31 HD21 LEU 31 18.630 -5.694 -11.860
229 HD22 LEU 31 HD22 LEU 31 20.379 -5.807 -12.057
230 HD23 LEU 31 HD23 LEU 31 19.652 -4.314 -11.459
231 H LYS 32 H LYS 32 18.898 -2.320 -8.905
232 HA LYS 32 HA LYS 32 20.029 -0.683 -6.730
233 HB2 LYS 32 HB2 LYS 32 18.326 0.129 -9.082
234 HB3 LYS 32 HB3 LYS 32 18.536 1.154 -7.669
235 HG2 LYS 32 HG2 LYS 32 20.173 2.002 -8.992
236 HG3 LYS 32 HG3 LYS 32 21.093 0.730 -8.185
237 HD2 LYS 32 HD2 LYS 32 21.627 0.471 -10.446
238 HD3 LYS 32 HD3 LYS 32 20.392 -0.756 -10.156
239 HE2 LYS 32 HE2 LYS 32 18.706 0.608 -11.164
240 HE3 LYS 32 HE3 LYS 32 19.803 1.984 -11.263
241 HZ1 LYS 32 HZ1 LYS 32 19.555 0.865 -13.397
242 HZ2 LYS 32 HZ2 LYS 32 20.131 -0.578 -12.729
243 HZ3 LYS 32 HZ3 LYS 32 21.150 0.767 -12.843
244 H ILE 33 H ILE 33 19.009 -1.073 -4.885
245 HA ILE 33 HA ILE 33 16.081 -1.309 -4.921
246 HB ILE 33 HB ILE 33 16.027 -3.143 -3.470
247 HG12 ILE 33 HG12 ILE 33 18.966 -2.623 -3.006
248 HG13 ILE 33 HG13 ILE 33 17.656 -2.505 -1.836
249 HG21 ILE 33 HG21 ILE 33 18.408 -3.868 -5.144
250 HG22 ILE 33 HG22 ILE 33 17.029 -4.868 -4.689
251 HG23 ILE 33 HG23 ILE 33 16.827 -3.569 -5.865
252 HD11 ILE 33 HD11 ILE 33 17.367 -5.055 -2.425
253 HD12 ILE 33 HD12 ILE 33 19.064 -4.895 -2.876
254 HD13 ILE 33 HD13 ILE 33 18.547 -4.505 -1.236
255 H CYS 34 H CYS 34 15.186 -1.105 -2.627
256 HA CYS 34 HA CYS 34 16.280 1.310 -1.484
257 HB2 CYS 34 HB2 CYS 34 13.837 -0.347 -0.847
258 HB3 CYS 34 HB3 CYS 34 14.285 1.089 0.068
259 H VAL 35 H VAL 35 16.674 1.557 0.824
260 HA VAL 35 HA VAL 35 17.282 -0.862 2.321
261 HB VAL 35 HB VAL 35 19.435 1.205 1.864
262 HG11 VAL 35 HG11 VAL 35 19.532 0.045 4.020
263 HG12 VAL 35 HG12 VAL 35 19.520 -1.508 3.182
264 HG13 VAL 35 HG13 VAL 35 20.882 -0.406 2.979
265 HG21 VAL 35 HG21 VAL 35 20.567 -0.524 0.523
266 HG22 VAL 35 HG22 VAL 35 19.132 -1.541 0.648
267 HG23 VAL 35 HG23 VAL 35 19.049 0.000 -0.205
Start of MODEL 8
1 H1 GLY 1 H GLY 1 0.106 -0.890 -0.392
2 HA2 GLY 1 HA2 GLY 1 2.286 -1.883 -0.801
3 HA3 GLY 1 HA3 GLY 1 1.653 -1.308 -2.336
4 H CYS 2 H CYS 2 4.337 -1.368 -0.485
5 HA CYS 2 HA CYS 2 5.434 0.989 -1.839
6 HB2 CYS 2 HB2 CYS 2 6.737 1.523 0.240
7 HB3 CYS 2 HB3 CYS 2 5.003 1.794 0.379
8 H ILE 3 H ILE 3 7.902 0.994 -1.630
9 HA ILE 3 HA ILE 3 8.828 -1.671 -2.350
10 HB ILE 3 HB ILE 3 10.332 0.945 -2.469
11 HG12 ILE 3 HG12 ILE 3 9.650 -0.040 -5.047
12 HG13 ILE 3 HG13 ILE 3 8.178 -0.027 -4.081
13 HG21 ILE 3 HG21 ILE 3 11.658 -1.192 -2.409
14 HG22 ILE 3 HG22 ILE 3 10.895 -1.619 -3.940
15 HG23 ILE 3 HG23 ILE 3 11.914 -0.183 -3.833
16 HD11 ILE 3 HD11 ILE 3 9.062 2.080 -5.471
17 HD12 ILE 3 HD12 ILE 3 8.096 2.219 -4.002
18 HD13 ILE 3 HD13 ILE 3 9.849 2.392 -3.925
19 H ALA 4 H ALA 4 9.688 -2.950 -0.865
20 HA ALA 4 HA ALA 4 10.587 -1.941 1.672
21 HB1 ALA 4 HB1 ALA 4 11.209 -4.732 0.986
22 HB2 ALA 4 HB2 ALA 4 10.398 -4.061 2.402
23 HB3 ALA 4 HB3 ALA 4 9.503 -4.293 0.900
24 H LYS 5 H LYS 5 12.723 -2.738 2.572
25 HA LYS 5 HA LYS 5 14.828 -1.751 0.909
26 HB2 LYS 5 HB2 LYS 5 16.282 -2.288 2.844
27 HB3 LYS 5 HB3 LYS 5 14.884 -1.318 3.288
28 HG2 LYS 5 HG2 LYS 5 13.852 -3.711 3.774
29 HG3 LYS 5 HG3 LYS 5 15.557 -4.117 3.987
30 HD2 LYS 5 HD2 LYS 5 15.589 -3.141 5.985
31 HD3 LYS 5 HD3 LYS 5 14.962 -1.637 5.307
32 HE2 LYS 5 HE2 LYS 5 12.887 -2.041 6.046
33 HE3 LYS 5 HE3 LYS 5 12.946 -3.733 5.555
34 HZ1 LYS 5 HZ1 LYS 5 12.739 -3.311 8.005
35 HZ2 LYS 5 HZ2 LYS 5 14.323 -2.719 7.974
36 HZ3 LYS 5 HZ3 LYS 5 14.013 -4.328 7.554
37 H ASN 6 H ASN 6 14.286 -3.480 -0.768
38 HA ASN 6 HA ASN 6 16.395 -5.291 -0.952
39 HB2 ASN 6 HB2 ASN 6 15.327 -6.572 0.801
40 HB3 ASN 6 HB3 ASN 6 13.790 -6.541 -0.058
41 HD21 ASN 6 HD21 ASN 6 13.791 -8.831 0.063
42 HD22 ASN 6 HD22 ASN 6 14.736 -9.770 -1.037
43 H LYS 7 H LYS 7 13.184 -4.328 -1.877
44 HA LYS 7 HA LYS 7 13.320 -5.678 -4.441
45 HB2 LYS 7 HB2 LYS 7 11.264 -3.682 -3.485
46 HB3 LYS 7 HB3 LYS 7 11.107 -4.806 -4.828
47 HG2 LYS 7 HG2 LYS 7 11.712 -6.290 -2.478
48 HG3 LYS 7 HG3 LYS 7 10.382 -5.183 -2.126
49 HD2 LYS 7 HD2 LYS 7 9.016 -6.111 -3.772
50 HD3 LYS 7 HD3 LYS 7 10.376 -6.853 -4.616
51 HE2 LYS 7 HE2 LYS 7 9.788 -8.737 -3.567
52 HE3 LYS 7 HE3 LYS 7 10.500 -8.009 -2.128
53 HZ1 LYS 7 HZ1 LYS 7 8.513 -7.818 -1.183
54 HZ2 LYS 7 HZ2 LYS 7 7.915 -8.827 -2.402
55 HZ3 LYS 7 HZ3 LYS 7 7.809 -7.147 -2.568
56 H GLU 8 H GLU 8 13.514 -4.682 -6.437
57 HA GLU 8 HA GLU 8 15.274 -2.567 -6.691
58 HB2 GLU 8 HB2 GLU 8 14.859 -2.627 -9.005
59 HB3 GLU 8 HB3 GLU 8 14.544 -4.267 -8.454
60 HG2 GLU 8 HG2 GLU 8 12.123 -3.710 -8.381
61 HG3 GLU 8 HG3 GLU 8 12.510 -2.150 -9.106
62 H CYS 9 H CYS 9 14.979 -0.402 -7.499
63 HA CYS 9 HA CYS 9 12.342 0.788 -7.222
64 HB2 CYS 9 HB2 CYS 9 13.178 2.531 -5.651
65 HB3 CYS 9 HB3 CYS 9 13.137 0.919 -4.943
66 H ALA 10 H ALA 10 12.092 2.667 -8.380
67 HA ALA 10 HA ALA 10 14.422 3.493 -9.985
68 HB1 ALA 10 HB1 ALA 10 12.104 4.417 -11.250
69 HB2 ALA 10 HB2 ALA 10 13.146 3.086 -11.755
70 HB3 ALA 10 HB3 ALA 10 11.744 2.769 -10.734
71 H TRP 11 H TRP 11 14.873 5.658 -10.243
72 HA TRP 11 HA TRP 11 14.177 7.390 -8.138
73 HB2 TRP 11 HB2 TRP 11 15.632 7.702 -10.732
74 HB3 TRP 11 HB3 TRP 11 15.169 9.147 -9.838
75 HD1 TRP 11 HD1 TRP 11 16.022 6.320 -7.563
76 HE1 TRP 11 HE1 TRP 11 18.359 6.679 -6.547
77 HE3 TRP 11 HE3 TRP 11 17.623 10.152 -10.544
78 HZ2 TRP 11 HZ2 TRP 11 20.587 8.365 -6.955
79 HZ3 TRP 11 HZ3 TRP 11 19.869 11.082 -10.166
80 HH2 TRP 11 HH2 TRP 11 21.319 10.206 -8.407
81 H PHE 12 H PHE 12 12.515 6.568 -10.974
82 HA PHE 12 HA PHE 12 10.641 8.786 -10.531
83 HB2 PHE 12 HB2 PHE 12 12.250 8.871 -12.656
84 HB3 PHE 12 HB3 PHE 12 11.013 7.808 -13.320
85 HD1 PHE 12 HD1 PHE 12 11.556 11.125 -11.768
86 HD2 PHE 12 HD2 PHE 12 8.982 8.666 -14.102
87 HE1 PHE 12 HE1 PHE 12 10.161 13.084 -12.287
88 HE2 PHE 12 HE2 PHE 12 7.583 10.621 -14.625
89 HZ PHE 12 HZ PHE 12 8.172 12.834 -13.718
90 H SER 13 H SER 13 10.702 5.930 -9.741
91 HA SER 13 HA SER 13 8.897 4.448 -11.331
92 HB2 SER 13 HB2 SER 13 9.043 2.814 -9.708
93 HB3 SER 13 HB3 SER 13 10.507 3.730 -9.354
94 HG SER 13 HG SER 13 9.081 4.938 -7.843
95 H GLY 14 H GLY 14 8.422 7.111 -9.303
96 HA2 GLY 14 HA2 GLY 14 6.384 8.278 -9.125
97 HA3 GLY 14 HA3 GLY 14 5.529 6.804 -9.553
98 H GLU 15 H GLU 15 6.994 5.195 -7.581
99 HA GLU 15 HA GLU 15 5.540 6.111 -5.197
100 HB2 GLU 15 HB2 GLU 15 5.811 3.694 -4.468
101 HB3 GLU 15 HB3 GLU 15 4.747 3.978 -5.838
102 HG2 GLU 15 HG2 GLU 15 6.290 3.119 -7.366
103 HG3 GLU 15 HG3 GLU 15 7.624 3.240 -6.220
104 H TRP 16 H TRP 16 6.620 5.048 -3.124
105 HA TRP 16 HA TRP 16 9.512 5.590 -3.231
106 HB2 TRP 16 HB2 TRP 16 7.535 6.533 -1.147
107 HB3 TRP 16 HB3 TRP 16 9.283 6.613 -0.949
108 HD1 TRP 16 HD1 TRP 16 6.878 7.744 -3.797
109 HE1 TRP 16 HE1 TRP 16 7.538 10.139 -4.471
110 HE3 TRP 16 HE3 TRP 16 10.739 8.474 -0.526
111 HZ2 TRP 16 HZ2 TRP 16 9.443 12.080 -3.717
112 HZ3 TRP 16 HZ3 TRP 16 11.928 10.627 -0.567
113 HH2 TRP 16 HH2 TRP 16 11.293 12.391 -2.130
114 H CYS 17 H CYS 17 10.545 4.844 -1.052
115 HA CYS 17 HA CYS 17 9.941 2.037 -0.805
116 HB2 CYS 17 HB2 CYS 17 11.951 3.548 0.853
117 HB3 CYS 17 HB3 CYS 17 11.972 1.850 0.386
118 H CYS 18 H CYS 18 9.708 0.975 1.303
119 HA CYS 18 HA CYS 18 7.587 2.101 2.796
120 HB2 CYS 18 HB2 CYS 18 9.380 -0.241 3.473
121 HB3 CYS 18 HB3 CYS 18 7.853 0.137 4.263
122 H GLY 19 H GLY 19 7.670 2.251 5.245
123 HA2 GLY 19 HA2 GLY 19 8.409 3.430 7.072
124 HA3 GLY 19 HA3 GLY 19 9.977 2.725 6.707
125 H ALA 20 H ALA 20 11.576 4.035 6.069
126 HA ALA 20 HA ALA 20 10.985 6.590 4.821
127 HB1 ALA 20 HB1 ALA 20 10.843 7.185 7.152
128 HB2 ALA 20 HB2 ALA 20 12.396 6.414 7.479
129 HB3 ALA 20 HB3 ALA 20 12.324 7.858 6.469
130 H LEU 21 H LEU 21 12.244 4.289 3.814
131 HA LEU 21 HA LEU 21 15.100 4.926 3.805
132 HB2 LEU 21 HB2 LEU 21 13.807 2.622 2.385
133 HB3 LEU 21 HB3 LEU 21 15.481 2.790 2.910
134 HG LEU 21 HG LEU 21 13.345 2.714 4.984
135 HD11 LEU 21 HD11 LEU 21 12.601 0.708 4.412
136 HD12 LEU 21 HD12 LEU 21 14.235 0.074 4.606
137 HD13 LEU 21 HD13 LEU 21 13.697 0.656 3.031
138 HD21 LEU 21 HD21 LEU 21 16.064 2.882 5.050
139 HD22 LEU 21 HD22 LEU 21 15.805 1.149 5.253
140 HD23 LEU 21 HD23 LEU 21 15.054 2.290 6.370
141 H SER 22 H SER 22 16.258 5.031 1.770
142 HA SER 22 HA SER 22 14.596 6.184 -0.371
143 HB2 SER 22 HB2 SER 22 17.031 7.116 -0.993
144 HB3 SER 22 HB3 SER 22 15.962 7.950 0.134
145 HG SER 22 HG SER 22 17.879 7.768 1.179
146 H CYS 23 H CYS 23 15.993 6.130 -2.540
147 HA CYS 23 HA CYS 23 16.457 3.290 -3.042
148 HB2 CYS 23 HB2 CYS 23 14.898 4.665 -4.478
149 HB3 CYS 23 HB3 CYS 23 16.315 5.528 -5.066
150 H LYS 24 H LYS 24 18.454 2.525 -3.003
151 HA LYS 24 HA LYS 24 20.642 4.212 -4.002
152 HB2 LYS 24 HB2 LYS 24 21.198 2.364 -1.732
153 HB3 LYS 24 HB3 LYS 24 21.989 3.873 -2.168
154 HG2 LYS 24 HG2 LYS 24 20.896 4.556 -0.302
155 HG3 LYS 24 HG3 LYS 24 19.637 4.878 -1.497
156 HD2 LYS 24 HD2 LYS 24 18.473 2.890 -0.939
157 HD3 LYS 24 HD3 LYS 24 19.833 2.276 0.005
158 HE2 LYS 24 HE2 LYS 24 18.390 4.814 0.723
159 HE3 LYS 24 HE3 LYS 24 17.856 3.235 1.296
160 HZ1 LYS 24 HZ1 LYS 24 19.316 3.433 2.929
161 HZ2 LYS 24 HZ2 LYS 24 19.941 4.866 2.282
162 HZ3 LYS 24 HZ3 LYS 24 20.573 3.373 1.798
163 H TYR 25 H TYR 25 22.614 2.919 -4.523
164 HA TYR 25 HA TYR 25 21.841 0.607 -6.061
165 HB2 TYR 25 HB2 TYR 25 23.402 2.207 -7.024
166 HB3 TYR 25 HB3 TYR 25 24.525 1.954 -5.692
167 HD1 TYR 25 HD2 TYR 25 25.843 -0.098 -5.548
168 HD2 TYR 25 HD1 TYR 25 23.198 0.588 -8.809
169 HE1 TYR 25 HE2 TYR 25 26.935 -1.907 -6.807
170 HE2 TYR 25 HE1 TYR 25 24.282 -1.220 -10.077
171 HH TYR 25 HH TYR 25 26.883 -2.307 -9.871
172 H SER 26 H SER 26 22.171 -1.479 -5.583
173 HA SER 26 HA SER 26 23.595 -2.088 -3.079
174 HB2 SER 26 HB2 SER 26 21.145 -3.207 -4.349
175 HB3 SER 26 HB3 SER 26 22.176 -4.322 -3.453
176 HG SER 26 HG SER 26 20.886 -1.986 -2.509
177 H ILE 27 H ILE 27 25.648 -2.464 -3.786
178 HA ILE 27 HA ILE 27 26.445 -3.700 -6.133
179 HB ILE 27 HB ILE 27 27.941 -4.046 -3.545
180 HG12 ILE 27 HG12 ILE 27 28.944 -1.755 -4.726
181 HG13 ILE 27 HG13 ILE 27 27.204 -1.577 -4.929
182 HG21 ILE 27 HG21 ILE 27 29.878 -3.662 -5.161
183 HG22 ILE 27 HG22 ILE 27 29.013 -5.193 -5.284
184 HG23 ILE 27 HG23 ILE 27 28.696 -3.906 -6.447
185 HD11 ILE 27 HD11 ILE 27 28.848 -1.501 -2.491
186 HD12 ILE 27 HD12 ILE 27 27.367 -0.634 -2.897
187 HD13 ILE 27 HD13 ILE 27 27.288 -2.310 -2.353
188 H LYS 28 H LYS 28 25.708 -5.152 -2.988
189 HA LYS 28 HA LYS 28 26.481 -7.767 -3.493
190 HB2 LYS 28 HB2 LYS 28 24.035 -6.974 -1.910
191 HB3 LYS 28 HB3 LYS 28 25.015 -8.421 -1.707
192 HG2 LYS 28 HG2 LYS 28 26.025 -7.293 -0.075
193 HG3 LYS 28 HG3 LYS 28 26.853 -6.424 -1.370
194 HD2 LYS 28 HD2 LYS 28 26.011 -4.649 -0.208
195 HD3 LYS 28 HD3 LYS 28 24.651 -4.953 -1.291
196 HE2 LYS 28 HE2 LYS 28 23.642 -6.372 0.495
197 HE3 LYS 28 HE3 LYS 28 24.945 -5.864 1.569
198 HZ1 LYS 28 HZ1 LYS 28 24.105 -3.775 1.755
199 HZ2 LYS 28 HZ2 LYS 28 22.656 -4.611 1.505
200 HZ3 LYS 28 HZ3 LYS 28 23.388 -3.785 0.223
201 H ARG 29 H ARG 29 23.425 -6.148 -4.252
202 HA ARG 29 HA ARG 29 22.439 -8.552 -5.581
203 HB2 ARG 29 HB2 ARG 29 21.165 -5.891 -4.947
204 HB3 ARG 29 HB3 ARG 29 20.373 -7.121 -5.923
205 HG2 ARG 29 HG2 ARG 29 21.184 -8.485 -3.655
206 HG3 ARG 29 HG3 ARG 29 20.636 -6.920 -3.052
207 HD2 ARG 29 HD2 ARG 29 18.797 -8.506 -3.098
208 HD3 ARG 29 HD3 ARG 29 18.521 -7.207 -4.257
209 HE ARG 29 HE ARG 29 18.563 -8.756 -5.933
210 HH11 ARG 29 HH11 ARG 29 20.051 -10.126 -3.099
211 HH12 ARG 29 HH12 ARG 29 20.209 -11.708 -3.787
212 HH21 ARG 29 HH21 ARG 29 18.765 -10.835 -6.849
213 HH22 ARG 29 HH22 ARG 29 19.478 -12.111 -5.920
214 H ASN 30 H ASN 30 24.550 -6.334 -6.445
215 HA ASN 30 HA ASN 30 25.145 -5.223 -8.362
216 HB2 ASN 30 HB2 ASN 30 25.128 -6.676 -10.349
217 HB3 ASN 30 HB3 ASN 30 25.658 -7.553 -8.917
218 HD21 ASN 30 HD21 ASN 30 24.786 -9.464 -8.620
219 HD22 ASN 30 HD22 ASN 30 23.274 -10.006 -9.258
220 H LEU 31 H LEU 31 22.553 -4.474 -7.433
221 HA LEU 31 HA LEU 31 21.495 -3.398 -9.908
222 HB2 LEU 31 HB2 LEU 31 19.822 -5.076 -8.046
223 HB3 LEU 31 HB3 LEU 31 19.170 -4.056 -9.326
224 HG LEU 31 HG LEU 31 21.066 -6.336 -9.850
225 HD11 LEU 31 HD11 LEU 31 18.801 -7.361 -10.699
226 HD12 LEU 31 HD12 LEU 31 18.116 -6.313 -9.456
227 HD13 LEU 31 HD13 LEU 31 19.307 -7.538 -9.018
228 HD21 LEU 31 HD21 LEU 31 20.832 -4.534 -11.559
229 HD22 LEU 31 HD22 LEU 31 19.117 -4.931 -11.670
230 HD23 LEU 31 HD23 LEU 31 20.331 -6.131 -12.118
231 H LYS 32 H LYS 32 19.197 -2.251 -9.021
232 HA LYS 32 HA LYS 32 20.129 -0.520 -6.825
233 HB2 LYS 32 HB2 LYS 32 18.273 0.214 -9.096
234 HB3 LYS 32 HB3 LYS 32 18.868 1.298 -7.844
235 HG2 LYS 32 HG2 LYS 32 20.350 1.847 -9.447
236 HG3 LYS 32 HG3 LYS 32 21.207 0.438 -8.816
237 HD2 LYS 32 HD2 LYS 32 21.026 -0.599 -10.775
238 HD3 LYS 32 HD3 LYS 32 19.272 -0.401 -10.756
239 HE2 LYS 32 HE2 LYS 32 19.419 1.718 -11.824
240 HE3 LYS 32 HE3 LYS 32 21.167 1.780 -11.604
241 HZ1 LYS 32 HZ1 LYS 32 20.370 1.172 -13.889
242 HZ2 LYS 32 HZ2 LYS 32 19.831 -0.295 -13.244
243 HZ3 LYS 32 HZ3 LYS 32 21.477 0.094 -13.200
244 H ILE 33 H ILE 33 19.059 -0.915 -5.009
245 HA ILE 33 HA ILE 33 16.144 -1.227 -5.136
246 HB ILE 33 HB ILE 33 16.079 -3.063 -3.673
247 HG12 ILE 33 HG12 ILE 33 19.015 -2.534 -3.201
248 HG13 ILE 33 HG13 ILE 33 17.703 -2.437 -2.032
249 HG21 ILE 33 HG21 ILE 33 16.959 -3.416 -6.091
250 HG22 ILE 33 HG22 ILE 33 18.470 -3.839 -5.289
251 HG23 ILE 33 HG23 ILE 33 17.004 -4.757 -4.946
252 HD11 ILE 33 HD11 ILE 33 19.156 -4.794 -3.066
253 HD12 ILE 33 HD12 ILE 33 18.562 -4.443 -1.443
254 HD13 ILE 33 HD13 ILE 33 17.444 -4.991 -2.692
255 H CYS 34 H CYS 34 15.223 -1.125 -2.809
256 HA CYS 34 HA CYS 34 16.190 1.335 -1.650
257 HB2 CYS 34 HB2 CYS 34 13.831 -0.451 -1.059
258 HB3 CYS 34 HB3 CYS 34 14.214 0.961 -0.079
259 H VAL 35 H VAL 35 16.664 1.604 0.612
260 HA VAL 35 HA VAL 35 17.376 -0.797 2.106
261 HB VAL 35 HB VAL 35 19.416 1.386 1.698
262 HG11 VAL 35 HG11 VAL 35 20.330 -1.253 2.501
263 HG12 VAL 35 HG12 VAL 35 20.660 0.326 3.217
264 HG13 VAL 35 HG13 VAL 35 19.192 -0.551 3.651
265 HG21 VAL 35 HG21 VAL 35 20.610 -0.161 0.232
266 HG22 VAL 35 HG22 VAL 35 19.284 -1.317 0.361
267 HG23 VAL 35 HG23 VAL 35 19.023 0.239 -0.427
Start of MODEL 9
1 H1 GLY 1 H GLY 1 2.197 0.116 0.536
2 HA2 GLY 1 HA2 GLY 1 2.396 -0.746 -2.084
3 HA3 GLY 1 HA3 GLY 1 1.536 0.784 -2.152
4 H CYS 2 H CYS 2 4.364 -0.530 -0.416
5 HA CYS 2 HA CYS 2 5.910 1.777 -1.380
6 HB2 CYS 2 HB2 CYS 2 7.001 1.942 0.833
7 HB3 CYS 2 HB3 CYS 2 5.274 2.273 0.915
8 H ILE 3 H ILE 3 8.242 1.444 -1.332
9 HA ILE 3 HA ILE 3 8.900 -1.300 -2.043
10 HB ILE 3 HB ILE 3 10.601 1.189 -2.221
11 HG12 ILE 3 HG12 ILE 3 9.715 -0.032 -4.716
12 HG13 ILE 3 HG13 ILE 3 8.366 0.520 -3.728
13 HG21 ILE 3 HG21 ILE 3 11.002 -1.528 -3.465
14 HG22 ILE 3 HG22 ILE 3 12.053 -0.125 -3.650
15 HG23 ILE 3 HG23 ILE 3 11.888 -0.902 -2.075
16 HD11 ILE 3 HD11 ILE 3 10.092 2.034 -5.386
17 HD12 ILE 3 HD12 ILE 3 8.713 2.582 -4.432
18 HD13 ILE 3 HD13 ILE 3 10.326 2.558 -3.719
19 H ALA 4 H ALA 4 9.809 -2.663 -0.665
20 HA ALA 4 HA ALA 4 10.735 -1.774 1.910
21 HB1 ALA 4 HB1 ALA 4 9.475 -3.862 1.660
22 HB2 ALA 4 HB2 ALA 4 10.790 -4.534 0.695
23 HB3 ALA 4 HB3 ALA 4 11.057 -4.135 2.392
24 H LYS 5 H LYS 5 12.846 -2.662 2.776
25 HA LYS 5 HA LYS 5 14.977 -1.695 1.128
26 HB2 LYS 5 HB2 LYS 5 16.414 -2.392 3.064
27 HB3 LYS 5 HB3 LYS 5 15.118 -1.278 3.478
28 HG2 LYS 5 HG2 LYS 5 14.332 -4.065 3.740
29 HG3 LYS 5 HG3 LYS 5 15.706 -3.634 4.762
30 HD2 LYS 5 HD2 LYS 5 14.474 -1.878 5.805
31 HD3 LYS 5 HD3 LYS 5 13.156 -2.031 4.641
32 HE2 LYS 5 HE2 LYS 5 12.227 -3.237 6.317
33 HE3 LYS 5 HE3 LYS 5 13.183 -4.531 5.596
34 HZ1 LYS 5 HZ1 LYS 5 13.646 -4.623 7.867
35 HZ2 LYS 5 HZ2 LYS 5 13.780 -2.944 8.018
36 HZ3 LYS 5 HZ3 LYS 5 14.984 -3.819 7.213
37 H ASN 6 H ASN 6 14.379 -3.377 -0.579
38 HA ASN 6 HA ASN 6 16.433 -5.229 -0.829
39 HB2 ASN 6 HB2 ASN 6 15.556 -6.640 0.826
40 HB3 ASN 6 HB3 ASN 6 13.893 -6.343 0.330
41 HD21 ASN 6 HD21 ASN 6 13.155 -8.291 -0.190
42 HD22 ASN 6 HD22 ASN 6 13.881 -9.361 -1.336
43 H LYS 7 H LYS 7 13.245 -4.158 -1.671
44 HA LYS 7 HA LYS 7 13.247 -5.518 -4.232
45 HB2 LYS 7 HB2 LYS 7 11.325 -3.469 -3.112
46 HB3 LYS 7 HB3 LYS 7 11.085 -4.409 -4.579
47 HG2 LYS 7 HG2 LYS 7 11.618 -6.231 -2.484
48 HG3 LYS 7 HG3 LYS 7 10.416 -5.078 -1.900
49 HD2 LYS 7 HD2 LYS 7 9.011 -5.528 -3.829
50 HD3 LYS 7 HD3 LYS 7 10.232 -6.619 -4.489
51 HE2 LYS 7 HE2 LYS 7 8.938 -7.033 -1.803
52 HE3 LYS 7 HE3 LYS 7 8.287 -7.710 -3.295
53 HZ1 LYS 7 HZ1 LYS 7 11.104 -8.189 -2.616
54 HZ2 LYS 7 HZ2 LYS 7 10.040 -9.147 -3.516
55 HZ3 LYS 7 HZ3 LYS 7 9.907 -9.091 -1.831
56 H GLU 8 H GLU 8 13.353 -4.505 -6.249
57 HA GLU 8 HA GLU 8 15.245 -2.512 -6.578
58 HB2 GLU 8 HB2 GLU 8 14.757 -2.570 -8.859
59 HB3 GLU 8 HB3 GLU 8 14.261 -4.161 -8.300
60 HG2 GLU 8 HG2 GLU 8 11.932 -3.349 -8.175
61 HG3 GLU 8 HG3 GLU 8 12.466 -1.809 -8.847
62 H CYS 9 H CYS 9 15.106 -0.317 -7.219
63 HA CYS 9 HA CYS 9 12.562 1.054 -6.944
64 HB2 CYS 9 HB2 CYS 9 13.452 0.905 -4.626
65 HB3 CYS 9 HB3 CYS 9 14.895 1.764 -5.154
66 H ALA 10 H ALA 10 12.513 2.234 -8.735
67 HA ALA 10 HA ALA 10 14.960 3.243 -9.924
68 HB1 ALA 10 HB1 ALA 10 12.428 4.065 -11.139
69 HB2 ALA 10 HB2 ALA 10 13.832 3.276 -11.859
70 HB3 ALA 10 HB3 ALA 10 12.629 2.319 -10.995
71 H TRP 11 H TRP 11 15.392 5.430 -10.342
72 HA TRP 11 HA TRP 11 14.707 7.217 -8.267
73 HB2 TRP 11 HB2 TRP 11 16.229 7.413 -10.825
74 HB3 TRP 11 HB3 TRP 11 15.728 8.909 -10.042
75 HD1 TRP 11 HD1 TRP 11 16.510 6.237 -7.563
76 HE1 TRP 11 HE1 TRP 11 18.808 6.676 -6.488
77 HE3 TRP 11 HE3 TRP 11 18.201 9.885 -10.721
78 HZ2 TRP 11 HZ2 TRP 11 21.041 8.348 -6.922
79 HZ3 TRP 11 HZ3 TRP 11 20.428 10.852 -10.322
80 HH2 TRP 11 HH2 TRP 11 21.816 10.098 -8.460
81 H PHE 12 H PHE 12 13.046 6.319 -11.067
82 HA PHE 12 HA PHE 12 11.207 8.582 -10.723
83 HB2 PHE 12 HB2 PHE 12 12.834 8.582 -12.833
84 HB3 PHE 12 HB3 PHE 12 11.595 7.509 -13.475
85 HD1 PHE 12 HD1 PHE 12 12.125 10.863 -11.991
86 HD2 PHE 12 HD2 PHE 12 9.605 8.365 -14.341
87 HE1 PHE 12 HE1 PHE 12 10.753 12.816 -12.589
88 HE2 PHE 12 HE2 PHE 12 8.229 10.313 -14.944
89 HZ PHE 12 HZ PHE 12 8.803 12.543 -14.068
90 H SER 13 H SER 13 11.316 5.657 -9.959
91 HA SER 13 HA SER 13 9.507 4.160 -11.471
92 HB2 SER 13 HB2 SER 13 9.191 2.817 -9.403
93 HB3 SER 13 HB3 SER 13 10.891 3.130 -9.754
94 HG SER 13 HG SER 13 10.519 5.028 -8.269
95 H GLY 14 H GLY 14 8.987 6.823 -9.360
96 HA2 GLY 14 HA2 GLY 14 6.991 8.062 -9.261
97 HA3 GLY 14 HA3 GLY 14 6.122 6.670 -9.892
98 H GLU 15 H GLU 15 7.604 4.998 -7.807
99 HA GLU 15 HA GLU 15 5.697 5.543 -5.648
100 HB2 GLU 15 HB2 GLU 15 6.430 3.201 -4.900
101 HB3 GLU 15 HB3 GLU 15 5.456 3.322 -6.358
102 HG2 GLU 15 HG2 GLU 15 8.351 3.415 -6.805
103 HG3 GLU 15 HG3 GLU 15 7.747 1.898 -6.142
104 H TRP 16 H TRP 16 6.666 4.610 -3.442
105 HA TRP 16 HA TRP 16 9.377 5.683 -3.083
106 HB2 TRP 16 HB2 TRP 16 7.222 6.208 -1.052
107 HB3 TRP 16 HB3 TRP 16 8.778 7.011 -1.240
108 HD1 TRP 16 HD1 TRP 16 8.772 8.066 -4.098
109 HE1 TRP 16 HE1 TRP 16 7.050 9.793 -4.921
110 HE3 TRP 16 HE3 TRP 16 5.110 7.282 -0.618
111 HZ2 TRP 16 HZ2 TRP 16 4.480 10.703 -4.191
112 HZ3 TRP 16 HZ3 TRP 16 3.051 8.623 -0.750
113 HH2 TRP 16 HH2 TRP 16 2.745 10.298 -2.500
114 H CYS 17 H CYS 17 10.440 4.940 -1.119
115 HA CYS 17 HA CYS 17 9.920 2.156 -0.650
116 HB2 CYS 17 HB2 CYS 17 11.896 3.875 0.847
117 HB3 CYS 17 HB3 CYS 17 11.961 2.137 0.569
118 H CYS 18 H CYS 18 9.835 1.252 1.574
119 HA CYS 18 HA CYS 18 7.679 2.433 3.020
120 HB2 CYS 18 HB2 CYS 18 9.460 0.130 3.844
121 HB3 CYS 18 HB3 CYS 18 7.875 0.518 4.506
122 H GLY 19 H GLY 19 7.795 2.718 5.441
123 HA2 GLY 19 HA2 GLY 19 8.580 3.967 7.201
124 HA3 GLY 19 HA3 GLY 19 10.125 3.203 6.861
125 H ALA 20 H ALA 20 11.754 4.438 6.156
126 HA ALA 20 HA ALA 20 11.220 6.943 4.783
127 HB1 ALA 20 HB1 ALA 20 11.742 8.365 6.420
128 HB2 ALA 20 HB2 ALA 20 11.508 7.006 7.521
129 HB3 ALA 20 HB3 ALA 20 13.124 7.397 6.933
130 H LEU 21 H LEU 21 12.448 4.479 3.997
131 HA LEU 21 HA LEU 21 15.305 5.053 3.906
132 HB2 LEU 21 HB2 LEU 21 13.899 2.738 2.609
133 HB3 LEU 21 HB3 LEU 21 15.597 2.869 3.062
134 HG LEU 21 HG LEU 21 13.481 2.914 5.176
135 HD11 LEU 21 HD11 LEU 21 14.666 0.297 4.595
136 HD12 LEU 21 HD12 LEU 21 13.519 0.872 3.386
137 HD13 LEU 21 HD13 LEU 21 13.023 0.723 5.072
138 HD21 LEU 21 HD21 LEU 21 15.952 1.442 5.611
139 HD22 LEU 21 HD22 LEU 21 15.208 2.719 6.575
140 HD23 LEU 21 HD23 LEU 21 16.227 3.133 5.195
141 H SER 22 H SER 22 16.467 5.069 1.884
142 HA SER 22 HA SER 22 14.846 6.179 -0.309
143 HB2 SER 22 HB2 SER 22 17.799 6.601 -0.191
144 HB3 SER 22 HB3 SER 22 16.535 7.668 -0.803
145 HG SER 22 HG SER 22 17.475 7.321 1.799
146 H CYS 23 H CYS 23 16.081 5.944 -2.497
147 HA CYS 23 HA CYS 23 16.561 3.085 -2.843
148 HB2 CYS 23 HB2 CYS 23 16.363 5.132 -5.045
149 HB3 CYS 23 HB3 CYS 23 16.074 3.398 -5.138
150 H LYS 24 H LYS 24 18.608 2.478 -2.564
151 HA LYS 24 HA LYS 24 20.727 4.133 -3.773
152 HB2 LYS 24 HB2 LYS 24 21.295 2.175 -1.581
153 HB3 LYS 24 HB3 LYS 24 22.172 3.633 -2.027
154 HG2 LYS 24 HG2 LYS 24 21.198 4.403 -0.142
155 HG3 LYS 24 HG3 LYS 24 19.881 4.757 -1.263
156 HD2 LYS 24 HD2 LYS 24 18.750 2.717 -0.651
157 HD3 LYS 24 HD3 LYS 24 20.111 2.223 0.359
158 HE2 LYS 24 HE2 LYS 24 18.654 4.797 0.857
159 HE3 LYS 24 HE3 LYS 24 18.050 3.269 1.495
160 HZ1 LYS 24 HZ1 LYS 24 20.806 3.514 2.047
161 HZ2 LYS 24 HZ2 LYS 24 19.516 3.374 3.132
162 HZ3 LYS 24 HZ3 LYS 24 20.003 4.901 2.591
163 H TYR 25 H TYR 25 22.649 2.910 -4.497
164 HA TYR 25 HA TYR 25 21.824 0.644 -6.073
165 HB2 TYR 25 HB2 TYR 25 23.289 2.308 -7.070
166 HB3 TYR 25 HB3 TYR 25 24.497 2.038 -5.819
167 HD1 TYR 25 HD2 TYR 25 25.875 0.023 -5.833
168 HD2 TYR 25 HD1 TYR 25 23.008 0.741 -8.893
169 HE1 TYR 25 HE2 TYR 25 26.930 -1.712 -7.220
170 HE2 TYR 25 HE1 TYR 25 24.054 -0.994 -10.289
171 HH TYR 25 HH TYR 25 26.929 -2.071 -10.035
172 H SER 26 H SER 26 22.130 -1.441 -5.628
173 HA SER 26 HA SER 26 23.749 -2.123 -3.270
174 HB2 SER 26 HB2 SER 26 21.244 -3.231 -4.433
175 HB3 SER 26 HB3 SER 26 22.345 -4.370 -3.659
176 HG SER 26 HG SER 26 22.305 -2.746 -1.863
177 H ILE 27 H ILE 27 25.762 -2.398 -4.145
178 HA ILE 27 HA ILE 27 26.449 -3.528 -6.566
179 HB ILE 27 HB ILE 27 28.076 -3.965 -4.070
180 HG12 ILE 27 HG12 ILE 27 29.007 -1.631 -5.229
181 HG13 ILE 27 HG13 ILE 27 27.258 -1.459 -5.332
182 HG21 ILE 27 HG21 ILE 27 28.629 -4.886 -6.457
183 HG22 ILE 27 HG22 ILE 27 29.160 -3.230 -6.748
184 HG23 ILE 27 HG23 ILE 27 29.897 -4.178 -5.456
185 HD11 ILE 27 HD11 ILE 27 27.523 -2.295 -2.782
186 HD12 ILE 27 HD12 ILE 27 29.029 -1.402 -2.998
187 HD13 ILE 27 HD13 ILE 27 27.482 -0.603 -3.277
188 H LYS 28 H LYS 28 26.050 -5.165 -3.436
189 HA LYS 28 HA LYS 28 26.746 -7.739 -4.220
190 HB2 LYS 28 HB2 LYS 28 25.207 -8.468 -2.342
191 HB3 LYS 28 HB3 LYS 28 26.466 -7.320 -1.904
192 HG2 LYS 28 HG2 LYS 28 24.945 -5.935 -1.098
193 HG3 LYS 28 HG3 LYS 28 24.155 -5.857 -2.675
194 HD2 LYS 28 HD2 LYS 28 22.422 -6.692 -1.458
195 HD3 LYS 28 HD3 LYS 28 23.211 -8.214 -1.879
196 HE2 LYS 28 HE2 LYS 28 24.467 -7.240 0.455
197 HE3 LYS 28 HE3 LYS 28 22.728 -7.086 0.702
198 HZ1 LYS 28 HZ1 LYS 28 22.412 -9.338 0.535
199 HZ2 LYS 28 HZ2 LYS 28 23.926 -9.291 1.288
200 HZ3 LYS 28 HZ3 LYS 28 23.817 -9.596 -0.372
201 H ARG 29 H ARG 29 23.697 -6.014 -4.559
202 HA ARG 29 HA ARG 29 22.424 -8.357 -5.743
203 HB2 ARG 29 HB2 ARG 29 21.315 -5.598 -5.194
204 HB3 ARG 29 HB3 ARG 29 20.388 -6.980 -5.762
205 HG2 ARG 29 HG2 ARG 29 21.775 -7.750 -3.406
206 HG3 ARG 29 HG3 ARG 29 20.964 -6.213 -3.102
207 HD2 ARG 29 HD2 ARG 29 19.501 -8.070 -2.545
208 HD3 ARG 29 HD3 ARG 29 18.861 -7.172 -3.921
209 HE ARG 29 HE ARG 29 19.068 -9.062 -5.180
210 HH11 ARG 29 HH11 ARG 29 21.114 -9.360 -2.380
211 HH12 ARG 29 HH12 ARG 29 21.559 -11.000 -2.717
212 HH21 ARG 29 HH21 ARG 29 19.645 -11.221 -5.635
213 HH22 ARG 29 HH22 ARG 29 20.723 -12.058 -4.570
214 H ASN 30 H ASN 30 24.517 -6.182 -6.842
215 HA ASN 30 HA ASN 30 24.942 -5.120 -8.830
216 HB2 ASN 30 HB2 ASN 30 24.725 -6.594 -10.773
217 HB3 ASN 30 HB3 ASN 30 25.323 -7.490 -9.379
218 HD21 ASN 30 HD21 ASN 30 22.761 -7.088 -11.635
219 HD22 ASN 30 HD22 ASN 30 21.816 -8.445 -11.135
220 H LEU 31 H LEU 31 22.439 -4.348 -7.642
221 HA LEU 31 HA LEU 31 21.187 -3.225 -10.000
222 HB2 LEU 31 HB2 LEU 31 19.644 -4.916 -8.041
223 HB3 LEU 31 HB3 LEU 31 18.916 -3.888 -9.273
224 HG LEU 31 HG LEU 31 20.753 -6.187 -9.916
225 HD11 LEU 31 HD11 LEU 31 19.027 -7.372 -9.000
226 HD12 LEU 31 HD12 LEU 31 18.422 -7.167 -10.644
227 HD13 LEU 31 HD13 LEU 31 17.833 -6.122 -9.351
228 HD21 LEU 31 HD21 LEU 31 18.772 -5.454 -11.879
229 HD22 LEU 31 HD22 LEU 31 20.526 -5.561 -12.036
230 HD23 LEU 31 HD23 LEU 31 19.782 -4.072 -11.450
231 H LYS 32 H LYS 32 18.976 -2.084 -8.912
232 HA LYS 32 HA LYS 32 20.071 -0.435 -6.727
233 HB2 LYS 32 HB2 LYS 32 18.312 0.349 -9.052
234 HB3 LYS 32 HB3 LYS 32 18.588 1.387 -7.660
235 HG2 LYS 32 HG2 LYS 32 20.185 2.207 -9.043
236 HG3 LYS 32 HG3 LYS 32 21.121 0.919 -8.281
237 HD2 LYS 32 HD2 LYS 32 21.533 0.700 -10.587
238 HD3 LYS 32 HD3 LYS 32 20.356 -0.560 -10.208
239 HE2 LYS 32 HE2 LYS 32 18.784 1.617 -10.833
240 HE3 LYS 32 HE3 LYS 32 20.127 1.751 -11.967
241 HZ1 LYS 32 HZ1 LYS 32 17.943 0.153 -12.257
242 HZ2 LYS 32 HZ2 LYS 32 19.140 -0.926 -11.744
243 HZ3 LYS 32 HZ3 LYS 32 19.389 0.019 -13.125
244 H ILE 33 H ILE 33 19.072 -0.884 -4.883
245 HA ILE 33 HA ILE 33 16.144 -1.141 -4.906
246 HB ILE 33 HB ILE 33 16.121 -2.981 -3.454
247 HG12 ILE 33 HG12 ILE 33 19.067 -2.454 -3.046
248 HG13 ILE 33 HG13 ILE 33 17.781 -2.339 -1.849
249 HG21 ILE 33 HG21 ILE 33 18.470 -3.665 -5.193
250 HG22 ILE 33 HG22 ILE 33 17.130 -4.695 -4.695
251 HG23 ILE 33 HG23 ILE 33 16.859 -3.399 -5.860
252 HD11 ILE 33 HD11 ILE 33 19.277 -4.672 -2.799
253 HD12 ILE 33 HD12 ILE 33 18.514 -4.362 -1.239
254 HD13 ILE 33 HD13 ILE 33 17.543 -4.922 -2.600
255 H CYS 34 H CYS 34 15.289 -1.014 -2.566
256 HA CYS 34 HA CYS 34 16.356 1.420 -1.421
257 HB2 CYS 34 HB2 CYS 34 13.920 -0.256 -0.821
258 HB3 CYS 34 HB3 CYS 34 14.367 1.143 0.148
259 H VAL 35 H VAL 35 16.705 1.635 0.915
260 HA VAL 35 HA VAL 35 17.398 -0.812 2.339
261 HB VAL 35 HB VAL 35 19.436 1.391 2.002
262 HG11 VAL 35 HG11 VAL 35 20.884 -0.590 2.904
263 HG12 VAL 35 HG12 VAL 35 19.943 0.402 4.018
264 HG13 VAL 35 HG13 VAL 35 19.339 -1.178 3.518
265 HG21 VAL 35 HG21 VAL 35 19.366 -1.337 0.714
266 HG22 VAL 35 HG22 VAL 35 19.114 0.201 -0.111
267 HG23 VAL 35 HG23 VAL 35 20.685 -0.171 0.599
Start of MODEL 10
1 H1 GLY 1 H GLY 1 1.509 1.111 -2.844
2 HA2 GLY 1 HA2 GLY 1 1.526 0.158 -0.244
3 HA3 GLY 1 HA3 GLY 1 2.343 -1.063 -1.209
4 H CYS 2 H CYS 2 4.451 -0.874 -0.828
5 HA CYS 2 HA CYS 2 5.816 1.543 -1.572
6 HB2 CYS 2 HB2 CYS 2 6.969 1.839 0.601
7 HB3 CYS 2 HB3 CYS 2 5.238 2.144 0.709
8 H ILE 3 H ILE 3 8.184 1.283 -1.486
9 HA ILE 3 HA ILE 3 8.897 -1.456 -2.158
10 HB ILE 3 HB ILE 3 10.584 1.041 -2.346
11 HG12 ILE 3 HG12 ILE 3 9.724 -0.074 -4.868
12 HG13 ILE 3 HG13 ILE 3 8.331 0.313 -3.863
13 HG21 ILE 3 HG21 ILE 3 11.695 -1.260 -2.248
14 HG22 ILE 3 HG22 ILE 3 10.987 -1.529 -3.840
15 HG23 ILE 3 HG23 ILE 3 12.124 -0.204 -3.593
16 HD11 ILE 3 HD11 ILE 3 10.007 2.055 -5.375
17 HD12 ILE 3 HD12 ILE 3 8.525 2.420 -4.491
18 HD13 ILE 3 HD13 ILE 3 10.083 2.498 -3.669
19 H ALA 4 H ALA 4 9.766 -2.782 -0.720
20 HA ALA 4 HA ALA 4 10.704 -1.829 1.825
21 HB1 ALA 4 HB1 ALA 4 10.800 -4.626 0.703
22 HB2 ALA 4 HB2 ALA 4 10.981 -4.157 2.394
23 HB3 ALA 4 HB3 ALA 4 9.434 -3.934 1.579
24 H LYS 5 H LYS 5 12.814 -2.737 2.707
25 HA LYS 5 HA LYS 5 14.948 -1.795 1.047
26 HB2 LYS 5 HB2 LYS 5 16.383 -2.481 2.990
27 HB3 LYS 5 HB3 LYS 5 15.096 -1.352 3.391
28 HG2 LYS 5 HG2 LYS 5 14.188 -4.063 3.700
29 HG3 LYS 5 HG3 LYS 5 15.667 -3.789 4.623
30 HD2 LYS 5 HD2 LYS 5 14.577 -1.720 5.552
31 HD3 LYS 5 HD3 LYS 5 13.078 -2.255 4.790
32 HE2 LYS 5 HE2 LYS 5 13.288 -4.393 6.065
33 HE3 LYS 5 HE3 LYS 5 14.661 -3.690 6.917
34 HZ1 LYS 5 HZ1 LYS 5 12.056 -2.307 6.868
35 HZ2 LYS 5 HZ2 LYS 5 13.317 -2.157 7.985
36 HZ3 LYS 5 HZ3 LYS 5 12.350 -3.545 7.983
37 H ASN 6 H ASN 6 14.335 -3.495 -0.639
38 HA ASN 6 HA ASN 6 16.381 -5.383 -0.831
39 HB2 ASN 6 HB2 ASN 6 14.695 -6.368 0.967
40 HB3 ASN 6 HB3 ASN 6 13.824 -6.879 -0.475
41 HD21 ASN 6 HD21 ASN 6 14.741 -8.762 1.207
42 HD22 ASN 6 HD22 ASN 6 16.079 -9.604 0.510
43 H LYS 7 H LYS 7 13.207 -4.301 -1.767
44 HA LYS 7 HA LYS 7 13.322 -5.615 -4.349
45 HB2 LYS 7 HB2 LYS 7 11.326 -3.553 -3.409
46 HB3 LYS 7 HB3 LYS 7 11.141 -4.690 -4.738
47 HG2 LYS 7 HG2 LYS 7 11.685 -6.139 -2.340
48 HG3 LYS 7 HG3 LYS 7 10.362 -5.006 -2.054
49 HD2 LYS 7 HD2 LYS 7 8.968 -6.055 -3.515
50 HD3 LYS 7 HD3 LYS 7 10.285 -6.563 -4.575
51 HE2 LYS 7 HE2 LYS 7 9.748 -8.588 -3.689
52 HE3 LYS 7 HE3 LYS 7 10.893 -8.052 -2.460
53 HZ1 LYS 7 HZ1 LYS 7 8.045 -7.401 -2.148
54 HZ2 LYS 7 HZ2 LYS 7 9.229 -7.631 -0.963
55 HZ3 LYS 7 HZ3 LYS 7 8.577 -8.963 -1.775
56 H GLU 8 H GLU 8 13.560 -4.595 -6.331
57 HA GLU 8 HA GLU 8 15.306 -2.374 -6.402
58 HB2 GLU 8 HB2 GLU 8 15.366 -2.662 -8.711
59 HB3 GLU 8 HB3 GLU 8 14.987 -4.276 -8.126
60 HG2 GLU 8 HG2 GLU 8 12.604 -3.852 -8.589
61 HG3 GLU 8 HG3 GLU 8 13.038 -2.278 -9.253
62 H CYS 9 H CYS 9 14.968 -0.273 -7.220
63 HA CYS 9 HA CYS 9 12.247 0.644 -7.649
64 HB2 CYS 9 HB2 CYS 9 12.475 2.452 -5.943
65 HB3 CYS 9 HB3 CYS 9 12.382 0.837 -5.249
66 H ALA 10 H ALA 10 12.135 2.410 -8.953
67 HA ALA 10 HA ALA 10 14.667 3.358 -10.063
68 HB1 ALA 10 HB1 ALA 10 13.608 3.531 -12.021
69 HB2 ALA 10 HB2 ALA 10 12.308 2.615 -11.257
70 HB3 ALA 10 HB3 ALA 10 12.236 4.377 -11.304
71 H TRP 11 H TRP 11 15.183 5.551 -10.256
72 HA TRP 11 HA TRP 11 14.505 7.175 -8.065
73 HB2 TRP 11 HB2 TRP 11 16.011 7.584 -10.611
74 HB3 TRP 11 HB3 TRP 11 15.556 9.001 -9.669
75 HD1 TRP 11 HD1 TRP 11 16.298 6.077 -7.484
76 HE1 TRP 11 HE1 TRP 11 18.620 6.345 -6.407
77 HE3 TRP 11 HE3 TRP 11 18.051 9.972 -10.293
78 HZ2 TRP 11 HZ2 TRP 11 20.894 7.991 -6.708
79 HZ3 TRP 11 HZ3 TRP 11 20.309 10.835 -9.835
80 HH2 TRP 11 HH2 TRP 11 21.700 9.863 -8.079
81 H PHE 12 H PHE 12 12.869 6.589 -10.982
82 HA PHE 12 HA PHE 12 11.044 8.820 -10.413
83 HB2 PHE 12 HB2 PHE 12 12.683 9.000 -12.506
84 HB3 PHE 12 HB3 PHE 12 11.432 8.013 -13.254
85 HD1 PHE 12 HD2 PHE 12 12.005 11.201 -11.453
86 HD2 PHE 12 HD1 PHE 12 9.459 8.978 -14.040
87 HE1 PHE 12 HE2 PHE 12 10.665 13.222 -11.865
88 HE2 PHE 12 HE1 PHE 12 8.115 10.996 -14.457
89 HZ PHE 12 HZ PHE 12 8.716 13.122 -13.368
90 H SER 13 H SER 13 11.071 5.870 -9.878
91 HA SER 13 HA SER 13 9.249 4.550 -11.557
92 HB2 SER 13 HB2 SER 13 8.912 3.017 -9.608
93 HB3 SER 13 HB3 SER 13 10.608 3.291 -10.003
94 HG SER 13 HG SER 13 10.172 5.131 -8.319
95 H GLY 14 H GLY 14 8.785 7.054 -9.293
96 HA2 GLY 14 HA2 GLY 14 6.792 8.281 -9.070
97 HA3 GLY 14 HA3 GLY 14 5.902 6.913 -9.722
98 H GLU 15 H GLU 15 7.473 5.170 -7.760
99 HA GLU 15 HA GLU 15 5.652 5.628 -5.507
100 HB2 GLU 15 HB2 GLU 15 6.406 3.253 -4.888
101 HB3 GLU 15 HB3 GLU 15 5.364 3.441 -6.291
102 HG2 GLU 15 HG2 GLU 15 8.231 3.542 -6.880
103 HG3 GLU 15 HG3 GLU 15 7.660 2.002 -6.241
104 H TRP 16 H TRP 16 6.656 4.700 -3.361
105 HA TRP 16 HA TRP 16 9.418 5.660 -3.078
106 HB2 TRP 16 HB2 TRP 16 7.385 6.252 -0.950
107 HB3 TRP 16 HB3 TRP 16 8.932 7.037 -1.256
108 HD1 TRP 16 HD1 TRP 16 8.777 8.119 -4.070
109 HE1 TRP 16 HE1 TRP 16 7.004 9.829 -4.814
110 HE3 TRP 16 HE3 TRP 16 5.263 7.267 -0.456
111 HZ2 TRP 16 HZ2 TRP 16 4.452 10.702 -3.978
112 HZ3 TRP 16 HZ3 TRP 16 3.184 8.582 -0.499
113 HH2 TRP 16 HH2 TRP 16 2.789 10.264 -2.225
114 H CYS 17 H CYS 17 10.557 4.807 -1.248
115 HA CYS 17 HA CYS 17 9.949 2.066 -0.753
116 HB2 CYS 17 HB2 CYS 17 11.985 3.723 0.733
117 HB3 CYS 17 HB3 CYS 17 12.002 1.985 0.449
118 H CYS 18 H CYS 18 9.859 1.128 1.452
119 HA CYS 18 HA CYS 18 7.753 2.335 2.944
120 HB2 CYS 18 HB2 CYS 18 9.497 -0.025 3.678
121 HB3 CYS 18 HB3 CYS 18 7.960 0.400 4.423
122 H GLY 19 H GLY 19 7.920 2.545 5.384
123 HA2 GLY 19 HA2 GLY 19 8.748 3.764 7.147
124 HA3 GLY 19 HA3 GLY 19 10.273 2.977 6.772
125 H ALA 20 H ALA 20 11.914 4.259 6.264
126 HA ALA 20 HA ALA 20 11.406 6.785 4.885
127 HB1 ALA 20 HB1 ALA 20 11.376 7.323 7.281
128 HB2 ALA 20 HB2 ALA 20 12.992 6.636 7.446
129 HB3 ALA 20 HB3 ALA 20 12.742 8.070 6.451
130 H LEU 21 H LEU 21 12.565 4.318 4.002
131 HA LEU 21 HA LEU 21 15.429 4.856 3.851
132 HB2 LEU 21 HB2 LEU 21 13.988 2.573 2.543
133 HB3 LEU 21 HB3 LEU 21 15.686 2.679 3.006
134 HG LEU 21 HG LEU 21 13.561 2.717 5.112
135 HD11 LEU 21 HD11 LEU 21 12.958 0.604 4.814
136 HD12 LEU 21 HD12 LEU 21 14.638 0.083 4.694
137 HD13 LEU 21 HD13 LEU 21 13.784 0.643 3.256
138 HD21 LEU 21 HD21 LEU 21 16.269 2.968 5.197
139 HD22 LEU 21 HD22 LEU 21 16.067 1.236 5.463
140 HD23 LEU 21 HD23 LEU 21 15.268 2.393 6.530
141 H SER 22 H SER 22 16.536 4.898 1.803
142 HA SER 22 HA SER 22 14.860 6.024 -0.341
143 HB2 SER 22 HB2 SER 22 17.582 6.700 0.673
144 HB3 SER 22 HB3 SER 22 17.273 6.904 -1.051
145 HG SER 22 HG SER 22 16.557 8.498 0.953
146 H CYS 23 H CYS 23 16.344 5.905 -2.507
147 HA CYS 23 HA CYS 23 16.701 3.029 -2.938
148 HB2 CYS 23 HB2 CYS 23 16.280 5.326 -4.856
149 HB3 CYS 23 HB3 CYS 23 16.626 3.680 -5.375
150 H LYS 24 H LYS 24 18.712 2.316 -2.723
151 HA LYS 24 HA LYS 24 20.902 3.956 -3.819
152 HB2 LYS 24 HB2 LYS 24 21.395 2.017 -1.597
153 HB3 LYS 24 HB3 LYS 24 22.285 3.472 -2.026
154 HG2 LYS 24 HG2 LYS 24 21.261 4.233 -0.159
155 HG3 LYS 24 HG3 LYS 24 19.993 4.615 -1.325
156 HD2 LYS 24 HD2 LYS 24 18.817 2.577 -0.771
157 HD3 LYS 24 HD3 LYS 24 20.126 2.077 0.302
158 HE2 LYS 24 HE2 LYS 24 18.595 4.634 0.700
159 HE3 LYS 24 HE3 LYS 24 18.068 3.101 1.392
160 HZ1 LYS 24 HZ1 LYS 24 20.233 4.835 2.189
161 HZ2 LYS 24 HZ2 LYS 24 20.649 3.197 2.131
162 HZ3 LYS 24 HZ3 LYS 24 19.358 3.707 3.098
163 H TYR 25 H TYR 25 22.810 2.698 -4.496
164 HA TYR 25 HA TYR 25 21.985 0.419 -6.052
165 HB2 TYR 25 HB2 TYR 25 23.495 2.041 -7.046
166 HB3 TYR 25 HB3 TYR 25 24.670 1.780 -5.762
167 HD1 TYR 25 HD1 TYR 25 26.008 -0.268 -5.696
168 HD2 TYR 25 HD2 TYR 25 23.255 0.462 -8.857
169 HE1 TYR 25 HE1 TYR 25 27.073 -2.042 -7.024
170 HE2 TYR 25 HE2 TYR 25 24.312 -1.311 -10.194
171 HH TYR 25 HH TYR 25 25.823 -2.944 -10.221
172 H SER 26 H SER 26 22.285 -1.669 -5.602
173 HA SER 26 HA SER 26 23.828 -2.341 -3.188
174 HB2 SER 26 HB2 SER 26 21.339 -3.438 -4.399
175 HB3 SER 26 HB3 SER 26 22.407 -4.573 -3.574
176 HG SER 26 HG SER 26 21.043 -2.339 -2.534
177 H ILE 27 H ILE 27 25.856 -2.687 -3.976
178 HA ILE 27 HA ILE 27 26.582 -3.848 -6.381
179 HB ILE 27 HB ILE 27 28.154 -4.268 -3.849
180 HG12 ILE 27 HG12 ILE 27 29.125 -1.950 -5.007
181 HG13 ILE 27 HG13 ILE 27 27.380 -1.765 -5.146
182 HG21 ILE 27 HG21 ILE 27 28.873 -5.327 -6.011
183 HG22 ILE 27 HG22 ILE 27 29.107 -3.699 -6.647
184 HG23 ILE 27 HG23 ILE 27 30.060 -4.254 -5.270
185 HD11 ILE 27 HD11 ILE 27 27.607 -0.876 -3.097
186 HD12 ILE 27 HD12 ILE 27 27.557 -2.565 -2.592
187 HD13 ILE 27 HD13 ILE 27 29.107 -1.742 -2.768
188 H LYS 28 H LYS 28 26.046 -5.418 -3.242
189 HA LYS 28 HA LYS 28 26.746 -8.017 -3.959
190 HB2 LYS 28 HB2 LYS 28 25.218 -8.712 -2.095
191 HB3 LYS 28 HB3 LYS 28 26.399 -7.486 -1.653
192 HG2 LYS 28 HG2 LYS 28 23.821 -6.434 -2.576
193 HG3 LYS 28 HG3 LYS 28 23.758 -7.363 -1.076
194 HD2 LYS 28 HD2 LYS 28 25.918 -5.839 -0.583
195 HD3 LYS 28 HD3 LYS 28 25.021 -4.753 -1.648
196 HE2 LYS 28 HE2 LYS 28 23.011 -5.210 -0.158
197 HE3 LYS 28 HE3 LYS 28 24.148 -5.942 0.973
198 HZ1 LYS 28 HZ1 LYS 28 25.035 -3.379 0.097
199 HZ2 LYS 28 HZ2 LYS 28 24.794 -3.951 1.671
200 HZ3 LYS 28 HZ3 LYS 28 23.501 -3.287 0.805
201 H ARG 29 H ARG 29 23.809 -6.208 -4.538
202 HA ARG 29 HA ARG 29 22.520 -8.574 -5.688
203 HB2 ARG 29 HB2 ARG 29 21.375 -5.815 -5.220
204 HB3 ARG 29 HB3 ARG 29 20.480 -7.245 -5.717
205 HG2 ARG 29 HG2 ARG 29 21.949 -7.734 -3.283
206 HG3 ARG 29 HG3 ARG 29 20.886 -6.334 -3.125
207 HD2 ARG 29 HD2 ARG 29 20.103 -9.110 -4.007
208 HD3 ARG 29 HD3 ARG 29 19.704 -8.340 -2.472
209 HE ARG 29 HE ARG 29 18.642 -6.642 -4.269
210 HH11 ARG 29 HH11 ARG 29 18.419 -10.093 -3.872
211 HH12 ARG 29 HH12 ARG 29 16.824 -10.198 -4.539
212 HH21 ARG 29 HH21 ARG 29 16.541 -6.767 -5.148
213 HH22 ARG 29 HH22 ARG 29 15.756 -8.306 -5.265
214 H ASN 30 H ASN 30 24.644 -6.398 -6.727
215 HA ASN 30 HA ASN 30 25.117 -5.327 -8.699
216 HB2 ASN 30 HB2 ASN 30 24.961 -6.798 -10.650
217 HB3 ASN 30 HB3 ASN 30 25.522 -7.695 -9.241
218 HD21 ASN 30 HD21 ASN 30 23.029 -7.302 -11.573
219 HD22 ASN 30 HD22 ASN 30 22.072 -8.661 -11.100
220 H LEU 31 H LEU 31 22.588 -4.556 -7.582
221 HA LEU 31 HA LEU 31 21.388 -3.452 -9.979
222 HB2 LEU 31 HB2 LEU 31 19.809 -5.121 -8.027
223 HB3 LEU 31 HB3 LEU 31 19.100 -4.100 -9.276
224 HG LEU 31 HG LEU 31 20.946 -6.400 -9.886
225 HD11 LEU 31 HD11 LEU 31 18.012 -6.343 -9.370
226 HD12 LEU 31 HD12 LEU 31 19.209 -7.566 -8.945
227 HD13 LEU 31 HD13 LEU 31 18.649 -7.422 -10.611
228 HD21 LEU 31 HD21 LEU 31 20.466 -6.041 -12.083
229 HD22 LEU 31 HD22 LEU 31 20.329 -4.385 -11.492
230 HD23 LEU 31 HD23 LEU 31 18.877 -5.356 -11.742
231 H LYS 32 H LYS 32 19.158 -2.294 -8.943
232 HA LYS 32 HA LYS 32 20.213 -0.627 -6.753
233 HB2 LYS 32 HB2 LYS 32 18.306 0.273 -8.915
234 HB3 LYS 32 HB3 LYS 32 19.097 1.279 -7.708
235 HG2 LYS 32 HG2 LYS 32 20.423 1.712 -9.502
236 HG3 LYS 32 HG3 LYS 32 21.277 0.318 -8.836
237 HD2 LYS 32 HD2 LYS 32 20.918 -0.857 -10.692
238 HD3 LYS 32 HD3 LYS 32 19.182 -0.547 -10.607
239 HE2 LYS 32 HE2 LYS 32 19.572 1.655 -11.672
240 HE3 LYS 32 HE3 LYS 32 21.277 1.239 -11.840
241 HZ1 LYS 32 HZ1 LYS 32 19.380 0.746 -13.686
242 HZ2 LYS 32 HZ2 LYS 32 19.472 -0.745 -12.894
243 HZ3 LYS 32 HZ3 LYS 32 20.860 -0.068 -13.586
244 H ILE 33 H ILE 33 19.155 -1.025 -4.931
245 HA ILE 33 HA ILE 33 16.228 -1.238 -5.026
246 HB ILE 33 HB ILE 33 16.126 -3.089 -3.589
247 HG12 ILE 33 HG12 ILE 33 19.069 -2.618 -3.109
248 HG13 ILE 33 HG13 ILE 33 17.757 -2.534 -1.938
249 HG21 ILE 33 HG21 ILE 33 16.831 -3.555 -5.960
250 HG22 ILE 33 HG22 ILE 33 18.473 -3.754 -5.350
251 HG23 ILE 33 HG23 ILE 33 17.190 -4.831 -4.797
252 HD11 ILE 33 HD11 ILE 33 18.766 -4.546 -1.445
253 HD12 ILE 33 HD12 ILE 33 17.432 -5.036 -2.491
254 HD13 ILE 33 HD13 ILE 33 19.068 -4.929 -3.140
255 H CYS 34 H CYS 34 15.344 -1.144 -2.679
256 HA CYS 34 HA CYS 34 16.420 1.270 -1.501
257 HB2 CYS 34 HB2 CYS 34 13.972 -0.396 -0.908
258 HB3 CYS 34 HB3 CYS 34 14.417 1.023 0.035
259 H VAL 35 H VAL 35 16.807 1.471 0.811
260 HA VAL 35 HA VAL 35 17.449 -0.998 2.229
261 HB VAL 35 HB VAL 35 19.511 1.187 1.944
262 HG11 VAL 35 HG11 VAL 35 20.281 0.193 3.797
263 HG12 VAL 35 HG12 VAL 35 19.249 -1.222 3.579
264 HG13 VAL 35 HG13 VAL 35 20.784 -1.108 2.717
265 HG21 VAL 35 HG21 VAL 35 20.744 -0.331 0.490
266 HG22 VAL 35 HG22 VAL 35 19.427 -1.501 0.574
267 HG23 VAL 35 HG23 VAL 35 19.171 0.060 -0.206
Start of MODEL 11
1 H1 GLY 1 H GLY 1 1.704 0.820 0.673
2 HA2 GLY 1 HA2 GLY 1 2.319 -1.035 -1.296
3 HA3 GLY 1 HA3 GLY 1 1.455 0.266 -2.102
4 H CYS 2 H CYS 2 4.384 -0.675 -0.491
5 HA CYS 2 HA CYS 2 5.725 1.648 -1.643
6 HB2 CYS 2 HB2 CYS 2 6.981 2.008 0.501
7 HB3 CYS 2 HB3 CYS 2 5.275 2.434 0.578
8 H ILE 3 H ILE 3 8.135 1.423 -1.495
9 HA ILE 3 HA ILE 3 8.849 -1.325 -2.134
10 HB ILE 3 HB ILE 3 10.542 1.168 -2.335
11 HG12 ILE 3 HG12 ILE 3 9.723 0.059 -4.860
12 HG13 ILE 3 HG13 ILE 3 8.303 0.394 -3.875
13 HG21 ILE 3 HG21 ILE 3 12.052 -0.108 -3.633
14 HG22 ILE 3 HG22 ILE 3 11.700 -1.071 -2.199
15 HG23 ILE 3 HG23 ILE 3 10.930 -1.465 -3.736
16 HD11 ILE 3 HD11 ILE 3 10.012 2.622 -3.646
17 HD12 ILE 3 HD12 ILE 3 9.921 2.199 -5.356
18 HD13 ILE 3 HD13 ILE 3 8.445 2.520 -4.446
19 H ALA 4 H ALA 4 9.687 -2.634 -0.665
20 HA ALA 4 HA ALA 4 10.619 -1.650 1.871
21 HB1 ALA 4 HB1 ALA 4 10.728 -3.900 2.551
22 HB2 ALA 4 HB2 ALA 4 9.328 -3.801 1.483
23 HB3 ALA 4 HB3 ALA 4 10.843 -4.482 0.890
24 H LYS 5 H LYS 5 12.716 -2.506 2.786
25 HA LYS 5 HA LYS 5 14.866 -1.635 1.115
26 HB2 LYS 5 HB2 LYS 5 16.284 -2.289 3.085
27 HB3 LYS 5 HB3 LYS 5 15.009 -1.132 3.444
28 HG2 LYS 5 HG2 LYS 5 13.701 -2.753 4.537
29 HG3 LYS 5 HG3 LYS 5 14.670 -4.080 3.892
30 HD2 LYS 5 HD2 LYS 5 16.580 -2.712 5.198
31 HD3 LYS 5 HD3 LYS 5 15.181 -2.291 6.188
32 HE2 LYS 5 HE2 LYS 5 14.764 -4.919 5.968
33 HE3 LYS 5 HE3 LYS 5 16.518 -4.905 5.786
34 HZ1 LYS 5 HZ1 LYS 5 16.753 -3.837 7.883
35 HZ2 LYS 5 HZ2 LYS 5 15.731 -5.165 8.110
36 HZ3 LYS 5 HZ3 LYS 5 15.084 -3.604 8.035
37 H ASN 6 H ASN 6 14.300 -3.348 -0.548
38 HA ASN 6 HA ASN 6 16.321 -5.249 -0.691
39 HB2 ASN 6 HB2 ASN 6 15.334 -6.563 1.004
40 HB3 ASN 6 HB3 ASN 6 13.709 -6.300 0.378
41 HD21 ASN 6 HD21 ASN 6 12.972 -8.213 -0.211
42 HD22 ASN 6 HD22 ASN 6 13.801 -9.350 -1.215
43 H LYS 7 H LYS 7 13.161 -4.166 -1.642
44 HA LYS 7 HA LYS 7 13.226 -5.580 -4.173
45 HB2 LYS 7 HB2 LYS 7 11.288 -3.469 -3.211
46 HB3 LYS 7 HB3 LYS 7 11.075 -4.529 -4.598
47 HG2 LYS 7 HG2 LYS 7 11.565 -6.149 -2.321
48 HG3 LYS 7 HG3 LYS 7 10.323 -4.966 -1.904
49 HD2 LYS 7 HD2 LYS 7 8.906 -5.686 -3.639
50 HD3 LYS 7 HD3 LYS 7 10.206 -6.567 -4.446
51 HE2 LYS 7 HE2 LYS 7 10.284 -8.142 -2.562
52 HE3 LYS 7 HE3 LYS 7 8.962 -7.270 -1.788
53 HZ1 LYS 7 HZ1 LYS 7 7.457 -7.974 -3.384
54 HZ2 LYS 7 HZ2 LYS 7 8.414 -9.348 -3.147
55 HZ3 LYS 7 HZ3 LYS 7 8.658 -8.373 -4.508
56 H GLU 8 H GLU 8 13.457 -4.638 -6.198
57 HA GLU 8 HA GLU 8 15.253 -2.458 -6.363
58 HB2 GLU 8 HB2 GLU 8 15.302 -2.844 -8.658
59 HB3 GLU 8 HB3 GLU 8 14.891 -4.424 -8.006
60 HG2 GLU 8 HG2 GLU 8 12.516 -3.970 -8.481
61 HG3 GLU 8 HG3 GLU 8 12.982 -2.436 -9.212
62 H CYS 9 H CYS 9 14.951 -0.385 -7.260
63 HA CYS 9 HA CYS 9 12.248 0.562 -7.730
64 HB2 CYS 9 HB2 CYS 9 12.515 2.434 -6.090
65 HB3 CYS 9 HB3 CYS 9 12.362 0.847 -5.344
66 H ALA 10 H ALA 10 12.160 2.530 -8.852
67 HA ALA 10 HA ALA 10 14.722 3.324 -10.057
68 HB1 ALA 10 HB1 ALA 10 12.316 2.609 -11.238
69 HB2 ALA 10 HB2 ALA 10 12.377 4.365 -11.393
70 HB3 ALA 10 HB3 ALA 10 13.693 3.377 -12.028
71 H TRP 11 H TRP 11 15.246 5.513 -10.308
72 HA TRP 11 HA TRP 11 14.535 7.193 -8.163
73 HB2 TRP 11 HB2 TRP 11 16.121 7.518 -10.672
74 HB3 TRP 11 HB3 TRP 11 15.649 8.966 -9.788
75 HD1 TRP 11 HD1 TRP 11 16.305 6.088 -7.509
76 HE1 TRP 11 HE1 TRP 11 18.591 6.376 -6.361
77 HE3 TRP 11 HE3 TRP 11 18.158 9.921 -10.340
78 HZ2 TRP 11 HZ2 TRP 11 20.877 8.012 -6.621
79 HZ3 TRP 11 HZ3 TRP 11 20.401 10.790 -9.825
80 HH2 TRP 11 HH2 TRP 11 21.731 9.854 -8.003
81 H PHE 12 H PHE 12 12.952 6.531 -11.082
82 HA PHE 12 HA PHE 12 11.164 8.822 -10.646
83 HB2 PHE 12 HB2 PHE 12 12.833 8.858 -12.724
84 HB3 PHE 12 HB3 PHE 12 11.568 7.864 -13.438
85 HD1 PHE 12 HD1 PHE 12 12.184 11.120 -11.777
86 HD2 PHE 12 HD2 PHE 12 9.638 8.837 -14.311
87 HE1 PHE 12 HE1 PHE 12 10.897 13.149 -12.307
88 HE2 PHE 12 HE2 PHE 12 8.348 10.862 -14.846
89 HZ PHE 12 HZ PHE 12 8.977 13.022 -13.844
90 H SER 13 H SER 13 11.188 5.836 -10.058
91 HA SER 13 HA SER 13 9.323 4.513 -11.669
92 HB2 SER 13 HB2 SER 13 8.958 3.052 -9.665
93 HB3 SER 13 HB3 SER 13 10.657 3.274 -10.082
94 HG SER 13 HG SER 13 10.945 4.106 -8.185
95 H GLY 14 H GLY 14 8.908 7.058 -9.418
96 HA2 GLY 14 HA2 GLY 14 6.945 8.337 -9.216
97 HA3 GLY 14 HA3 GLY 14 6.028 6.996 -9.886
98 H GLU 15 H GLU 15 7.603 5.258 -7.870
99 HA GLU 15 HA GLU 15 5.714 5.705 -5.671
100 HB2 GLU 15 HB2 GLU 15 6.453 3.348 -5.012
101 HB3 GLU 15 HB3 GLU 15 5.486 3.507 -6.472
102 HG2 GLU 15 HG2 GLU 15 7.406 3.242 -7.860
103 HG3 GLU 15 HG3 GLU 15 8.487 3.324 -6.470
104 H TRP 16 H TRP 16 6.685 4.785 -3.497
105 HA TRP 16 HA TRP 16 9.422 5.794 -3.150
106 HB2 TRP 16 HB2 TRP 16 7.325 6.365 -1.078
107 HB3 TRP 16 HB3 TRP 16 8.871 7.167 -1.343
108 HD1 TRP 16 HD1 TRP 16 8.783 8.242 -4.162
109 HE1 TRP 16 HE1 TRP 16 7.010 9.928 -4.961
110 HE3 TRP 16 HE3 TRP 16 5.177 7.353 -0.649
111 HZ2 TRP 16 HZ2 TRP 16 4.425 10.770 -4.202
112 HZ3 TRP 16 HZ3 TRP 16 3.083 8.642 -0.756
113 HH2 TRP 16 HH2 TRP 16 2.717 10.315 -2.496
114 H CYS 17 H CYS 17 10.513 4.985 -1.259
115 HA CYS 17 HA CYS 17 9.928 2.230 -0.770
116 HB2 CYS 17 HB2 CYS 17 11.929 3.924 0.725
117 HB3 CYS 17 HB3 CYS 17 11.960 2.181 0.476
118 H CYS 18 H CYS 18 9.843 1.322 1.460
119 HA CYS 18 HA CYS 18 7.697 2.533 2.905
120 HB2 CYS 18 HB2 CYS 18 9.426 0.154 3.616
121 HB3 CYS 18 HB3 CYS 18 7.929 0.604 4.425
122 H GLY 19 H GLY 19 7.833 2.744 5.350
123 HA2 GLY 19 HA2 GLY 19 8.634 3.982 7.112
124 HA3 GLY 19 HA3 GLY 19 10.157 3.172 6.777
125 H ALA 20 H ALA 20 11.818 4.457 6.362
126 HA ALA 20 HA ALA 20 11.369 6.972 4.933
127 HB1 ALA 20 HB1 ALA 20 13.206 7.064 7.270
128 HB2 ALA 20 HB2 ALA 20 12.252 8.349 6.529
129 HB3 ALA 20 HB3 ALA 20 11.469 7.152 7.560
130 H LEU 21 H LEU 21 12.474 4.559 3.978
131 HA LEU 21 HA LEU 21 15.359 5.047 3.888
132 HB2 LEU 21 HB2 LEU 21 13.938 2.752 2.585
133 HB3 LEU 21 HB3 LEU 21 15.620 2.858 3.099
134 HG LEU 21 HG LEU 21 13.423 2.920 5.130
135 HD11 LEU 21 HD11 LEU 21 12.863 0.788 4.869
136 HD12 LEU 21 HD12 LEU 21 14.551 0.289 4.762
137 HD13 LEU 21 HD13 LEU 21 13.699 0.830 3.316
138 HD21 LEU 21 HD21 LEU 21 16.313 2.753 5.089
139 HD22 LEU 21 HD22 LEU 21 15.592 1.431 6.008
140 HD23 LEU 21 HD23 LEU 21 15.221 3.104 6.429
141 H SER 22 H SER 22 16.474 5.016 1.831
142 HA SER 22 HA SER 22 14.821 6.155 -0.325
143 HB2 SER 22 HB2 SER 22 17.554 6.782 0.683
144 HB3 SER 22 HB3 SER 22 17.264 6.955 -1.048
145 HG SER 22 HG SER 22 16.825 8.832 0.411
146 H CYS 23 H CYS 23 16.302 5.970 -2.491
147 HA CYS 23 HA CYS 23 16.607 3.079 -2.874
148 HB2 CYS 23 HB2 CYS 23 16.105 5.351 -4.793
149 HB3 CYS 23 HB3 CYS 23 16.534 3.733 -5.338
150 H LYS 24 H LYS 24 18.645 2.463 -2.486
151 HA LYS 24 HA LYS 24 20.822 4.055 -3.675
152 HB2 LYS 24 HB2 LYS 24 21.234 2.054 -1.474
153 HB3 LYS 24 HB3 LYS 24 22.247 3.418 -1.929
154 HG2 LYS 24 HG2 LYS 24 21.327 4.385 -0.132
155 HG3 LYS 24 HG3 LYS 24 19.976 4.701 -1.224
156 HD2 LYS 24 HD2 LYS 24 19.035 2.467 -0.478
157 HD3 LYS 24 HD3 LYS 24 20.260 2.483 0.792
158 HE2 LYS 24 HE2 LYS 24 18.321 4.744 0.373
159 HE3 LYS 24 HE3 LYS 24 17.964 3.367 1.414
160 HZ1 LYS 24 HZ1 LYS 24 20.519 4.635 1.896
161 HZ2 LYS 24 HZ2 LYS 24 19.351 4.099 2.995
162 HZ3 LYS 24 HZ3 LYS 24 19.175 5.603 2.241
163 H TYR 25 H TYR 25 22.673 2.845 -4.485
164 HA TYR 25 HA TYR 25 21.818 0.578 -6.041
165 HB2 TYR 25 HB2 TYR 25 23.244 2.218 -7.096
166 HB3 TYR 25 HB3 TYR 25 24.472 2.013 -5.852
167 HD1 TYR 25 HD2 TYR 25 25.888 0.017 -5.819
168 HD2 TYR 25 HD1 TYR 25 23.003 0.618 -8.888
169 HE1 TYR 25 HE2 TYR 25 26.975 -1.725 -7.174
170 HE2 TYR 25 HE1 TYR 25 24.081 -1.123 -10.251
171 HH TYR 25 HH TYR 25 27.051 -2.185 -9.863
172 H SER 26 H SER 26 22.077 -1.496 -5.552
173 HA SER 26 HA SER 26 23.752 -2.184 -3.241
174 HB2 SER 26 HB2 SER 26 21.262 -3.318 -4.413
175 HB3 SER 26 HB3 SER 26 22.380 -4.447 -3.647
176 HG SER 26 HG SER 26 21.604 -2.074 -2.341
177 H ILE 27 H ILE 27 25.769 -2.458 -4.084
178 HA ILE 27 HA ILE 27 26.471 -3.546 -6.528
179 HB ILE 27 HB ILE 27 28.104 -3.983 -4.037
180 HG12 ILE 27 HG12 ILE 27 29.002 -1.624 -5.169
181 HG13 ILE 27 HG13 ILE 27 27.251 -1.475 -5.275
182 HG21 ILE 27 HG21 ILE 27 29.325 -3.139 -6.579
183 HG22 ILE 27 HG22 ILE 27 29.854 -4.346 -5.409
184 HG23 ILE 27 HG23 ILE 27 28.595 -4.744 -6.577
185 HD11 ILE 27 HD11 ILE 27 29.016 -1.424 -2.934
186 HD12 ILE 27 HD12 ILE 27 27.463 -0.635 -3.211
187 HD13 ILE 27 HD13 ILE 27 27.517 -2.332 -2.734
188 H LYS 28 H LYS 28 26.043 -5.204 -3.417
189 HA LYS 28 HA LYS 28 26.797 -7.764 -4.190
190 HB2 LYS 28 HB2 LYS 28 25.225 -8.525 -2.356
191 HB3 LYS 28 HB3 LYS 28 26.446 -7.352 -1.881
192 HG2 LYS 28 HG2 LYS 28 24.868 -6.016 -1.103
193 HG3 LYS 28 HG3 LYS 28 24.141 -5.924 -2.709
194 HD2 LYS 28 HD2 LYS 28 22.376 -6.792 -1.550
195 HD3 LYS 28 HD3 LYS 28 23.184 -8.293 -2.008
196 HE2 LYS 28 HE2 LYS 28 23.053 -8.758 0.187
197 HE3 LYS 28 HE3 LYS 28 24.460 -7.704 0.310
198 HZ1 LYS 28 HZ1 LYS 28 23.264 -6.065 1.264
199 HZ2 LYS 28 HZ2 LYS 28 22.271 -7.348 1.743
200 HZ3 LYS 28 HZ3 LYS 28 21.853 -6.412 0.397
201 H ARG 29 H ARG 29 23.728 -6.089 -4.599
202 HA ARG 29 HA ARG 29 22.551 -8.447 -5.860
203 HB2 ARG 29 HB2 ARG 29 21.330 -5.752 -5.231
204 HB3 ARG 29 HB3 ARG 29 20.464 -7.144 -5.868
205 HG2 ARG 29 HG2 ARG 29 21.820 -7.983 -3.531
206 HG3 ARG 29 HG3 ARG 29 21.001 -6.463 -3.165
207 HD2 ARG 29 HD2 ARG 29 19.605 -8.465 -2.735
208 HD3 ARG 29 HD3 ARG 29 18.898 -7.356 -3.909
209 HE ARG 29 HE ARG 29 19.061 -8.993 -5.499
210 HH11 ARG 29 HH11 ARG 29 21.067 -9.839 -2.783
211 HH12 ARG 29 HH12 ARG 29 21.426 -11.427 -3.375
212 HH21 ARG 29 HH21 ARG 29 19.526 -11.081 -6.290
213 HH22 ARG 29 HH22 ARG 29 20.550 -12.132 -5.371
214 H ASN 30 H ASN 30 24.584 -6.175 -6.853
215 HA ASN 30 HA ASN 30 24.995 -5.021 -8.794
216 HB2 ASN 30 HB2 ASN 30 24.835 -6.440 -10.799
217 HB3 ASN 30 HB3 ASN 30 25.499 -7.331 -9.433
218 HD21 ASN 30 HD21 ASN 30 24.688 -9.264 -9.099
219 HD22 ASN 30 HD22 ASN 30 23.137 -9.822 -9.617
220 H LEU 31 H LEU 31 22.486 -4.326 -7.636
221 HA LEU 31 HA LEU 31 21.198 -3.239 -9.995
222 HB2 LEU 31 HB2 LEU 31 19.722 -4.964 -8.013
223 HB3 LEU 31 HB3 LEU 31 18.943 -3.938 -9.217
224 HG LEU 31 HG LEU 31 20.820 -6.179 -9.942
225 HD11 LEU 31 HD11 LEU 31 18.537 -7.268 -10.579
226 HD12 LEU 31 HD12 LEU 31 17.903 -6.213 -9.317
227 HD13 LEU 31 HD13 LEU 31 19.152 -7.397 -8.931
228 HD21 LEU 31 HD21 LEU 31 20.464 -5.577 -12.055
229 HD22 LEU 31 HD22 LEU 31 19.767 -4.085 -11.421
230 HD23 LEU 31 HD23 LEU 31 18.722 -5.454 -11.804
231 H LYS 32 H LYS 32 18.974 -2.132 -8.899
232 HA LYS 32 HA LYS 32 20.048 -0.453 -6.727
233 HB2 LYS 32 HB2 LYS 32 18.247 0.317 -9.029
234 HB3 LYS 32 HB3 LYS 32 18.602 1.367 -7.664
235 HG2 LYS 32 HG2 LYS 32 20.159 2.136 -9.117
236 HG3 LYS 32 HG3 LYS 32 21.096 0.833 -8.382
237 HD2 LYS 32 HD2 LYS 32 21.362 0.686 -10.755
238 HD3 LYS 32 HD3 LYS 32 20.339 -0.657 -10.239
239 HE2 LYS 32 HE2 LYS 32 18.555 1.400 -10.767
240 HE3 LYS 32 HE3 LYS 32 19.760 1.537 -12.047
241 HZ1 LYS 32 HZ1 LYS 32 19.023 -1.173 -11.625
242 HZ2 LYS 32 HZ2 LYS 32 18.944 -0.252 -13.041
243 HZ3 LYS 32 HZ3 LYS 32 17.656 -0.230 -11.945
244 H ILE 33 H ILE 33 19.045 -0.900 -4.884
245 HA ILE 33 HA ILE 33 16.120 -1.185 -4.916
246 HB ILE 33 HB ILE 33 16.103 -3.029 -3.477
247 HG12 ILE 33 HG12 ILE 33 19.018 -2.420 -3.001
248 HG13 ILE 33 HG13 ILE 33 17.705 -2.414 -1.830
249 HG21 ILE 33 HG21 ILE 33 18.493 -3.718 -5.148
250 HG22 ILE 33 HG22 ILE 33 17.110 -4.724 -4.721
251 HG23 ILE 33 HG23 ILE 33 16.920 -3.411 -5.883
252 HD11 ILE 33 HD11 ILE 33 19.112 -4.743 -3.065
253 HD12 ILE 33 HD12 ILE 33 18.858 -4.366 -1.360
254 HD13 ILE 33 HD13 ILE 33 17.508 -4.918 -2.353
255 H CYS 34 H CYS 34 15.246 -1.044 -2.594
256 HA CYS 34 HA CYS 34 16.317 1.382 -1.434
257 HB2 CYS 34 HB2 CYS 34 13.862 -0.270 -0.826
258 HB3 CYS 34 HB3 CYS 34 14.301 1.176 0.078
259 H VAL 35 H VAL 35 16.604 1.588 0.919
260 HA VAL 35 HA VAL 35 17.427 -0.904 2.236
261 HB VAL 35 HB VAL 35 19.101 1.610 2.163
262 HG11 VAL 35 HG11 VAL 35 19.239 0.494 4.316
263 HG12 VAL 35 HG12 VAL 35 19.586 -1.042 3.518
264 HG13 VAL 35 HG13 VAL 35 20.744 0.285 3.420
265 HG21 VAL 35 HG21 VAL 35 19.053 0.134 0.089
266 HG22 VAL 35 HG22 VAL 35 20.635 0.463 0.796
267 HG23 VAL 35 HG23 VAL 35 19.849 -1.091 1.078
Start of MODEL 12
1 H1 GLY 1 H GLY 1 0.107 -0.242 -2.459
2 HA2 GLY 1 HA2 GLY 1 1.625 -0.760 -0.758
3 HA3 GLY 1 HA3 GLY 1 2.367 -1.588 -2.119
4 H CYS 2 H CYS 2 4.446 -1.328 -1.266
5 HA CYS 2 HA CYS 2 5.689 1.175 -1.956
6 HB2 CYS 2 HB2 CYS 2 6.689 1.575 0.258
7 HB3 CYS 2 HB3 CYS 2 4.934 1.696 0.310
8 H ILE 3 H ILE 3 8.065 1.070 -1.733
9 HA ILE 3 HA ILE 3 8.988 -1.614 -2.377
10 HB ILE 3 HB ILE 3 10.561 0.961 -2.448
11 HG12 ILE 3 HG12 ILE 3 9.886 0.016 -5.050
12 HG13 ILE 3 HG13 ILE 3 8.402 0.111 -4.109
13 HG21 ILE 3 HG21 ILE 3 11.811 -1.214 -2.385
14 HG22 ILE 3 HG22 ILE 3 11.055 -1.613 -3.927
15 HG23 ILE 3 HG23 ILE 3 12.122 -0.214 -3.803
16 HD11 ILE 3 HD11 ILE 3 9.182 2.159 -5.467
17 HD12 ILE 3 HD12 ILE 3 8.579 2.394 -3.826
18 HD13 ILE 3 HD13 ILE 3 10.315 2.402 -4.138
19 H ALA 4 H ALA 4 9.766 -2.885 -0.840
20 HA ALA 4 HA ALA 4 10.579 -1.852 1.717
21 HB1 ALA 4 HB1 ALA 4 10.976 -4.688 0.839
22 HB2 ALA 4 HB2 ALA 4 10.632 -4.058 2.451
23 HB3 ALA 4 HB3 ALA 4 9.368 -4.070 1.221
24 H LYS 5 H LYS 5 12.663 -2.738 2.708
25 HA LYS 5 HA LYS 5 14.853 -1.775 1.144
26 HB2 LYS 5 HB2 LYS 5 16.219 -2.401 3.127
27 HB3 LYS 5 HB3 LYS 5 14.847 -1.374 3.521
28 HG2 LYS 5 HG2 LYS 5 13.962 -2.902 4.873
29 HG3 LYS 5 HG3 LYS 5 14.205 -4.200 3.702
30 HD2 LYS 5 HD2 LYS 5 15.809 -4.979 5.036
31 HD3 LYS 5 HD3 LYS 5 16.763 -3.558 4.603
32 HE2 LYS 5 HE2 LYS 5 15.206 -2.488 6.505
33 HE3 LYS 5 HE3 LYS 5 15.245 -4.157 7.070
34 HZ1 LYS 5 HZ1 LYS 5 17.028 -2.861 8.045
35 HZ2 LYS 5 HZ2 LYS 5 17.619 -2.462 6.511
36 HZ3 LYS 5 HZ3 LYS 5 17.663 -4.067 7.042
37 H ASN 6 H ASN 6 14.280 -3.495 -0.565
38 HA ASN 6 HA ASN 6 16.370 -5.307 -0.774
39 HB2 ASN 6 HB2 ASN 6 15.522 -6.710 0.901
40 HB3 ASN 6 HB3 ASN 6 13.853 -6.459 0.399
41 HD21 ASN 6 HD21 ASN 6 13.005 -8.208 -0.438
42 HD22 ASN 6 HD22 ASN 6 13.816 -9.366 -1.431
43 H LYS 7 H LYS 7 13.195 -4.269 -1.659
44 HA LYS 7 HA LYS 7 13.189 -5.708 -4.175
45 HB2 LYS 7 HB2 LYS 7 11.292 -3.535 -3.285
46 HB3 LYS 7 HB3 LYS 7 11.028 -4.733 -4.545
47 HG2 LYS 7 HG2 LYS 7 11.594 -6.110 -2.130
48 HG3 LYS 7 HG3 LYS 7 10.372 -4.881 -1.795
49 HD2 LYS 7 HD2 LYS 7 10.190 -6.813 -4.099
50 HD3 LYS 7 HD3 LYS 7 9.486 -7.129 -2.511
51 HE2 LYS 7 HE2 LYS 7 8.340 -4.836 -2.821
52 HE3 LYS 7 HE3 LYS 7 8.748 -5.035 -4.525
53 HZ1 LYS 7 HZ1 LYS 7 7.558 -7.390 -3.459
54 HZ2 LYS 7 HZ2 LYS 7 7.086 -6.459 -4.789
55 HZ3 LYS 7 HZ3 LYS 7 6.548 -6.050 -3.238
56 H GLU 8 H GLU 8 13.300 -4.757 -6.227
57 HA GLU 8 HA GLU 8 15.241 -2.835 -6.636
58 HB2 GLU 8 HB2 GLU 8 14.668 -2.880 -8.915
59 HB3 GLU 8 HB3 GLU 8 14.223 -4.471 -8.315
60 HG2 GLU 8 HG2 GLU 8 11.880 -3.630 -8.075
61 HG3 GLU 8 HG3 GLU 8 12.392 -2.163 -8.908
62 H CYS 9 H CYS 9 15.114 -0.660 -7.455
63 HA CYS 9 HA CYS 9 12.637 0.798 -7.041
64 HB2 CYS 9 HB2 CYS 9 13.604 2.400 -5.482
65 HB3 CYS 9 HB3 CYS 9 13.690 0.776 -4.807
66 H ALA 10 H ALA 10 12.524 2.701 -8.191
67 HA ALA 10 HA ALA 10 14.868 3.331 -9.866
68 HB1 ALA 10 HB1 ALA 10 12.165 4.039 -10.846
69 HB2 ALA 10 HB2 ALA 10 13.589 3.494 -11.733
70 HB3 ALA 10 HB3 ALA 10 12.601 2.330 -10.850
71 H TRP 11 H TRP 11 15.373 5.477 -10.221
72 HA TRP 11 HA TRP 11 14.744 7.301 -8.173
73 HB2 TRP 11 HB2 TRP 11 16.194 7.468 -10.781
74 HB3 TRP 11 HB3 TRP 11 15.761 8.965 -9.960
75 HD1 TRP 11 HD1 TRP 11 16.549 6.255 -7.532
76 HE1 TRP 11 HE1 TRP 11 18.898 6.610 -6.540
77 HE3 TRP 11 HE3 TRP 11 18.246 9.861 -10.734
78 HZ2 TRP 11 HZ2 TRP 11 21.168 8.208 -7.048
79 HZ3 TRP 11 HZ3 TRP 11 20.517 10.750 -10.412
80 HH2 TRP 11 HH2 TRP 11 21.947 9.940 -8.606
81 H PHE 12 H PHE 12 13.033 6.425 -10.964
82 HA PHE 12 HA PHE 12 11.220 8.703 -10.580
83 HB2 PHE 12 HB2 PHE 12 12.818 8.693 -12.713
84 HB3 PHE 12 HB3 PHE 12 11.556 7.639 -13.342
85 HD1 PHE 12 HD1 PHE 12 12.171 10.984 -11.877
86 HD2 PHE 12 HD2 PHE 12 9.545 8.520 -14.147
87 HE1 PHE 12 HE1 PHE 12 10.817 12.957 -12.445
88 HE2 PHE 12 HE2 PHE 12 8.187 10.490 -14.719
89 HZ PHE 12 HZ PHE 12 8.822 12.712 -13.869
90 H SER 13 H SER 13 11.249 5.835 -9.751
91 HA SER 13 HA SER 13 9.449 4.313 -11.257
92 HB2 SER 13 HB2 SER 13 9.306 2.869 -9.390
93 HB3 SER 13 HB3 SER 13 10.919 3.574 -9.287
94 HG SER 13 HG SER 13 10.381 4.390 -7.438
95 H GLY 14 H GLY 14 8.934 7.069 -9.294
96 HA2 GLY 14 HA2 GLY 14 6.939 8.320 -9.282
97 HA3 GLY 14 HA3 GLY 14 6.065 6.889 -9.806
98 H GLU 15 H GLU 15 7.382 5.254 -7.689
99 HA GLU 15 HA GLU 15 5.657 6.131 -5.479
100 HB2 GLU 15 HB2 GLU 15 5.986 3.721 -4.702
101 HB3 GLU 15 HB3 GLU 15 5.014 3.968 -6.145
102 HG2 GLU 15 HG2 GLU 15 6.655 3.136 -7.552
103 HG3 GLU 15 HG3 GLU 15 7.936 3.388 -6.368
104 H TRP 16 H TRP 16 6.597 4.981 -3.318
105 HA TRP 16 HA TRP 16 9.438 5.712 -3.107
106 HB2 TRP 16 HB2 TRP 16 7.435 6.366 -0.950
107 HB3 TRP 16 HB3 TRP 16 9.089 6.949 -1.116
108 HD1 TRP 16 HD1 TRP 16 9.145 8.124 -3.965
109 HE1 TRP 16 HE1 TRP 16 7.706 10.159 -4.607
110 HE3 TRP 16 HE3 TRP 16 5.590 7.791 -0.306
111 HZ2 TRP 16 HZ2 TRP 16 5.372 11.452 -3.685
112 HZ3 TRP 16 HZ3 TRP 16 3.788 9.466 -0.256
113 HH2 TRP 16 HH2 TRP 16 3.684 11.259 -1.911
114 H CYS 17 H CYS 17 10.494 4.813 -1.165
115 HA CYS 17 HA CYS 17 9.831 2.047 -0.868
116 HB2 CYS 17 HB2 CYS 17 11.837 3.561 0.796
117 HB3 CYS 17 HB3 CYS 17 11.843 1.852 0.372
118 H CYS 18 H CYS 18 9.626 0.987 1.265
119 HA CYS 18 HA CYS 18 7.477 2.108 2.734
120 HB2 CYS 18 HB2 CYS 18 9.250 -0.215 3.515
121 HB3 CYS 18 HB3 CYS 18 7.640 0.132 4.137
122 H GLY 19 H GLY 19 7.566 2.196 5.206
123 HA2 GLY 19 HA2 GLY 19 8.294 3.365 7.044
124 HA3 GLY 19 HA3 GLY 19 9.868 2.682 6.664
125 H ALA 20 H ALA 20 11.451 4.024 6.062
126 HA ALA 20 HA ALA 20 10.833 6.584 4.836
127 HB1 ALA 20 HB1 ALA 20 11.901 6.304 7.608
128 HB2 ALA 20 HB2 ALA 20 12.428 7.658 6.607
129 HB3 ALA 20 HB3 ALA 20 10.715 7.442 6.967
130 H LEU 21 H LEU 21 12.196 4.182 3.986
131 HA LEU 21 HA LEU 21 15.016 4.923 3.935
132 HB2 LEU 21 HB2 LEU 21 13.784 2.568 2.543
133 HB3 LEU 21 HB3 LEU 21 15.451 2.782 3.075
134 HG LEU 21 HG LEU 21 13.299 2.689 5.134
135 HD11 LEU 21 HD11 LEU 21 12.629 0.641 4.624
136 HD12 LEU 21 HD12 LEU 21 14.288 0.067 4.784
137 HD13 LEU 21 HD13 LEU 21 13.694 0.619 3.218
138 HD21 LEU 21 HD21 LEU 21 16.001 2.950 5.239
139 HD22 LEU 21 HD22 LEU 21 15.814 1.207 5.435
140 HD23 LEU 21 HD23 LEU 21 15.003 2.312 6.546
141 H SER 22 H SER 22 16.188 4.968 1.889
142 HA SER 22 HA SER 22 14.528 6.095 -0.267
143 HB2 SER 22 HB2 SER 22 16.177 7.646 0.818
144 HB3 SER 22 HB3 SER 22 17.470 6.600 0.232
145 HG SER 22 HG SER 22 16.599 8.558 -1.068
146 H CYS 23 H CYS 23 16.104 6.043 -2.396
147 HA CYS 23 HA CYS 23 16.465 3.178 -2.884
148 HB2 CYS 23 HB2 CYS 23 14.963 4.384 -4.404
149 HB3 CYS 23 HB3 CYS 23 16.268 5.489 -4.828
150 H LYS 24 H LYS 24 18.436 2.351 -2.863
151 HA LYS 24 HA LYS 24 20.690 4.022 -3.744
152 HB2 LYS 24 HB2 LYS 24 21.040 2.046 -1.518
153 HB3 LYS 24 HB3 LYS 24 22.030 3.441 -1.928
154 HG2 LYS 24 HG2 LYS 24 20.995 4.253 -0.080
155 HG3 LYS 24 HG3 LYS 24 19.815 4.742 -1.299
156 HD2 LYS 24 HD2 LYS 24 18.376 2.949 -0.768
157 HD3 LYS 24 HD3 LYS 24 19.627 2.117 0.159
158 HE2 LYS 24 HE2 LYS 24 18.507 4.803 0.931
159 HE3 LYS 24 HE3 LYS 24 17.840 3.278 1.511
160 HZ1 LYS 24 HZ1 LYS 24 19.347 3.352 3.115
161 HZ2 LYS 24 HZ2 LYS 24 20.116 4.694 2.432
162 HZ3 LYS 24 HZ3 LYS 24 20.558 3.133 1.954
163 H TYR 25 H TYR 25 22.575 2.783 -4.443
164 HA TYR 25 HA TYR 25 21.767 0.499 -6.006
165 HB2 TYR 25 HB2 TYR 25 23.250 2.157 -6.996
166 HB3 TYR 25 HB3 TYR 25 24.444 1.882 -5.732
167 HD1 TYR 25 HD2 TYR 25 25.811 -0.137 -5.729
168 HD2 TYR 25 HD1 TYR 25 22.966 0.578 -8.811
169 HE1 TYR 25 HE2 TYR 25 26.863 -1.888 -7.099
170 HE2 TYR 25 HE1 TYR 25 24.010 -1.172 -10.189
171 HH TYR 25 HH TYR 25 26.032 -2.370 -10.422
172 H SER 26 H SER 26 22.158 -1.592 -5.605
173 HA SER 26 HA SER 26 23.714 -2.243 -3.192
174 HB2 SER 26 HB2 SER 26 21.225 -3.371 -4.372
175 HB3 SER 26 HB3 SER 26 22.320 -4.496 -3.570
176 HG SER 26 HG SER 26 22.112 -3.342 -1.688
177 H ILE 27 H ILE 27 25.737 -2.542 -4.023
178 HA ILE 27 HA ILE 27 26.437 -3.705 -6.436
179 HB ILE 27 HB ILE 27 28.076 -4.069 -3.938
180 HG12 ILE 27 HG12 ILE 27 28.962 -1.733 -5.125
181 HG13 ILE 27 HG13 ILE 27 27.210 -1.592 -5.229
182 HG21 ILE 27 HG21 ILE 27 28.684 -3.834 -6.871
183 HG22 ILE 27 HG22 ILE 27 29.920 -3.625 -5.631
184 HG23 ILE 27 HG23 ILE 27 29.064 -5.160 -5.772
185 HD11 ILE 27 HD11 ILE 27 27.456 -0.689 -3.189
186 HD12 ILE 27 HD12 ILE 27 27.460 -2.376 -2.675
187 HD13 ILE 27 HD13 ILE 27 28.984 -1.515 -2.886
188 H LYS 28 H LYS 28 25.947 -5.251 -3.283
189 HA LYS 28 HA LYS 28 26.731 -7.835 -3.926
190 HB2 LYS 28 HB2 LYS 28 24.412 -7.142 -2.121
191 HB3 LYS 28 HB3 LYS 28 25.439 -8.568 -2.041
192 HG2 LYS 28 HG2 LYS 28 26.598 -7.474 -0.495
193 HG3 LYS 28 HG3 LYS 28 27.230 -6.488 -1.816
194 HD2 LYS 28 HD2 LYS 28 24.877 -5.243 -1.355
195 HD3 LYS 28 HD3 LYS 28 25.251 -5.830 0.267
196 HE2 LYS 28 HE2 LYS 28 27.657 -4.834 -0.505
197 HE3 LYS 28 HE3 LYS 28 26.554 -3.744 -1.342
198 HZ1 LYS 28 HZ1 LYS 28 25.403 -3.559 0.913
199 HZ2 LYS 28 HZ2 LYS 28 26.878 -2.755 0.717
200 HZ3 LYS 28 HZ3 LYS 28 26.819 -4.220 1.559
201 H ARG 29 H ARG 29 23.567 -6.287 -4.332
202 HA ARG 29 HA ARG 29 22.503 -8.666 -5.624
203 HB2 ARG 29 HB2 ARG 29 21.253 -5.985 -5.000
204 HB3 ARG 29 HB3 ARG 29 20.404 -7.321 -5.767
205 HG2 ARG 29 HG2 ARG 29 21.662 -8.230 -3.360
206 HG3 ARG 29 HG3 ARG 29 20.680 -6.801 -3.029
207 HD2 ARG 29 HD2 ARG 29 19.784 -9.346 -4.375
208 HD3 ARG 29 HD3 ARG 29 19.333 -8.786 -2.765
209 HE ARG 29 HE ARG 29 18.502 -6.770 -4.348
210 HH11 ARG 29 HH11 ARG 29 18.027 -10.217 -4.463
211 HH12 ARG 29 HH12 ARG 29 16.472 -10.109 -5.219
212 HH21 ARG 29 HH21 ARG 29 16.455 -6.615 -5.343
213 HH22 ARG 29 HH22 ARG 29 15.579 -8.059 -5.720
214 H ASN 30 H ASN 30 24.541 -6.437 -6.644
215 HA ASN 30 HA ASN 30 24.990 -5.330 -8.603
216 HB2 ASN 30 HB2 ASN 30 24.842 -6.790 -10.578
217 HB3 ASN 30 HB3 ASN 30 25.478 -7.659 -9.184
218 HD21 ASN 30 HD21 ASN 30 24.642 -9.575 -8.819
219 HD22 ASN 30 HD22 ASN 30 23.093 -10.129 -9.346
220 H LEU 31 H LEU 31 22.469 -4.591 -7.493
221 HA LEU 31 HA LEU 31 21.226 -3.537 -9.892
222 HB2 LEU 31 HB2 LEU 31 19.706 -5.212 -7.901
223 HB3 LEU 31 HB3 LEU 31 18.954 -4.202 -9.134
224 HG LEU 31 HG LEU 31 20.819 -6.473 -9.790
225 HD11 LEU 31 HD11 LEU 31 19.152 -7.708 -8.850
226 HD12 LEU 31 HD12 LEU 31 18.474 -7.489 -10.463
227 HD13 LEU 31 HD13 LEU 31 17.924 -6.473 -9.130
228 HD21 LEU 31 HD21 LEU 31 20.608 -5.738 -11.870
229 HD22 LEU 31 HD22 LEU 31 19.611 -4.397 -11.303
230 HD23 LEU 31 HD23 LEU 31 18.857 -5.924 -11.765
231 H LYS 32 H LYS 32 18.994 -2.393 -8.847
232 HA LYS 32 HA LYS 32 20.056 -0.674 -6.701
233 HB2 LYS 32 HB2 LYS 32 18.360 0.015 -9.096
234 HB3 LYS 32 HB3 LYS 32 18.510 1.087 -7.710
235 HG2 LYS 32 HG2 LYS 32 20.139 1.952 -9.033
236 HG3 LYS 32 HG3 LYS 32 21.088 0.740 -8.168
237 HD2 LYS 32 HD2 LYS 32 21.686 0.388 -10.386
238 HD3 LYS 32 HD3 LYS 32 20.433 -0.826 -10.118
239 HE2 LYS 32 HE2 LYS 32 18.778 0.693 -11.122
240 HE3 LYS 32 HE3 LYS 32 20.058 1.866 -11.427
241 HZ1 LYS 32 HZ1 LYS 32 20.702 0.771 -13.236
242 HZ2 LYS 32 HZ2 LYS 32 19.257 -0.102 -13.127
243 HZ3 LYS 32 HZ3 LYS 32 20.678 -0.731 -12.458
244 H ILE 33 H ILE 33 19.041 -1.073 -4.853
245 HA ILE 33 HA ILE 33 16.117 -1.353 -4.894
246 HB ILE 33 HB ILE 33 16.091 -3.162 -3.401
247 HG12 ILE 33 HG12 ILE 33 19.034 -2.620 -2.993
248 HG13 ILE 33 HG13 ILE 33 17.743 -2.482 -1.804
249 HG21 ILE 33 HG21 ILE 33 17.037 -4.886 -4.635
250 HG22 ILE 33 HG22 ILE 33 16.898 -3.584 -5.815
251 HG23 ILE 33 HG23 ILE 33 18.456 -3.931 -5.066
252 HD11 ILE 33 HD11 ILE 33 18.390 -4.504 -1.143
253 HD12 ILE 33 HD12 ILE 33 17.558 -5.098 -2.580
254 HD13 ILE 33 HD13 ILE 33 19.295 -4.800 -2.627
255 H CYS 34 H CYS 34 15.228 -1.156 -2.585
256 HA CYS 34 HA CYS 34 16.285 1.295 -1.475
257 HB2 CYS 34 HB2 CYS 34 13.854 -0.374 -0.822
258 HB3 CYS 34 HB3 CYS 34 14.282 1.089 0.059
259 H VAL 35 H VAL 35 16.675 1.573 0.826
260 HA VAL 35 HA VAL 35 17.304 -0.833 2.344
261 HB VAL 35 HB VAL 35 19.407 1.292 1.926
262 HG11 VAL 35 HG11 VAL 35 19.551 -1.432 3.215
263 HG12 VAL 35 HG12 VAL 35 20.881 -0.283 3.051
264 HG13 VAL 35 HG13 VAL 35 19.497 0.108 4.073
265 HG21 VAL 35 HG21 VAL 35 19.248 -1.465 0.709
266 HG22 VAL 35 HG22 VAL 35 19.029 0.058 -0.155
267 HG23 VAL 35 HG23 VAL 35 20.596 -0.338 0.552
Start of MODEL 13
1 H1 GLY 1 H GLY 1 0.103 0.089 -0.208
2 HA2 GLY 1 HA2 GLY 1 2.107 -1.424 -1.433
3 HA3 GLY 1 HA3 GLY 1 1.211 -0.124 -2.205
4 H CYS 2 H CYS 2 4.183 -1.082 -0.773
5 HA CYS 2 HA CYS 2 5.448 1.337 -1.755
6 HB2 CYS 2 HB2 CYS 2 6.651 1.695 0.419
7 HB3 CYS 2 HB3 CYS 2 4.930 2.061 0.472
8 H ILE 3 H ILE 3 7.861 1.187 -1.564
9 HA ILE 3 HA ILE 3 8.676 -1.528 -2.232
10 HB ILE 3 HB ILE 3 10.233 1.054 -2.411
11 HG12 ILE 3 HG12 ILE 3 9.483 -0.308 -4.889
12 HG13 ILE 3 HG13 ILE 3 8.094 0.245 -3.960
13 HG21 ILE 3 HG21 ILE 3 11.804 -0.204 -3.778
14 HG22 ILE 3 HG22 ILE 3 11.662 -0.920 -2.173
15 HG23 ILE 3 HG23 ILE 3 10.850 -1.670 -3.547
16 HD11 ILE 3 HD11 ILE 3 8.763 2.482 -4.091
17 HD12 ILE 3 HD12 ILE 3 10.396 2.052 -4.602
18 HD13 ILE 3 HD13 ILE 3 9.037 1.824 -5.704
19 H ALA 4 H ALA 4 9.519 -2.822 -0.752
20 HA ALA 4 HA ALA 4 10.401 -1.826 1.796
21 HB1 ALA 4 HB1 ALA 4 9.268 -4.145 1.040
22 HB2 ALA 4 HB2 ALA 4 10.962 -4.633 1.095
23 HB3 ALA 4 HB3 ALA 4 10.194 -3.949 2.528
24 H LYS 5 H LYS 5 12.508 -2.607 2.732
25 HA LYS 5 HA LYS 5 14.652 -1.691 1.082
26 HB2 LYS 5 HB2 LYS 5 16.069 -2.253 3.056
27 HB3 LYS 5 HB3 LYS 5 14.714 -1.198 3.434
28 HG2 LYS 5 HG2 LYS 5 13.986 -2.619 4.963
29 HG3 LYS 5 HG3 LYS 5 13.907 -3.917 3.770
30 HD2 LYS 5 HD2 LYS 5 16.534 -3.921 4.171
31 HD3 LYS 5 HD3 LYS 5 16.040 -3.254 5.729
32 HE2 LYS 5 HE2 LYS 5 14.402 -5.513 4.954
33 HE3 LYS 5 HE3 LYS 5 16.112 -5.937 5.006
34 HZ1 LYS 5 HZ1 LYS 5 14.957 -6.258 7.142
35 HZ2 LYS 5 HZ2 LYS 5 14.650 -4.596 7.214
36 HZ3 LYS 5 HZ3 LYS 5 16.243 -5.164 7.255
37 H ASN 6 H ASN 6 14.129 -3.432 -0.578
38 HA ASN 6 HA ASN 6 16.205 -5.276 -0.700
39 HB2 ASN 6 HB2 ASN 6 15.251 -6.619 0.984
40 HB3 ASN 6 HB3 ASN 6 13.618 -6.385 0.366
41 HD21 ASN 6 HD21 ASN 6 12.855 -8.215 -0.384
42 HD22 ASN 6 HD22 ASN 6 13.721 -9.372 -1.331
43 H LYS 7 H LYS 7 13.022 -4.284 -1.678
44 HA LYS 7 HA LYS 7 13.167 -5.692 -4.213
45 HB2 LYS 7 HB2 LYS 7 11.116 -3.653 -3.348
46 HB3 LYS 7 HB3 LYS 7 10.963 -4.847 -4.631
47 HG2 LYS 7 HG2 LYS 7 11.544 -6.196 -2.190
48 HG3 LYS 7 HG3 LYS 7 10.205 -5.076 -1.925
49 HD2 LYS 7 HD2 LYS 7 8.853 -6.123 -3.491
50 HD3 LYS 7 HD3 LYS 7 10.222 -6.851 -4.334
51 HE2 LYS 7 HE2 LYS 7 9.430 -7.610 -1.532
52 HE3 LYS 7 HE3 LYS 7 8.787 -8.420 -2.960
53 HZ1 LYS 7 HZ1 LYS 7 10.770 -9.402 -3.412
54 HZ2 LYS 7 HZ2 LYS 7 10.920 -9.293 -1.731
55 HZ3 LYS 7 HZ3 LYS 7 11.692 -8.161 -2.724
56 H GLU 8 H GLU 8 13.255 -4.685 -6.246
57 HA GLU 8 HA GLU 8 15.109 -2.688 -6.601
58 HB2 GLU 8 HB2 GLU 8 14.544 -2.689 -8.868
59 HB3 GLU 8 HB3 GLU 8 14.060 -4.289 -8.325
60 HG2 GLU 8 HG2 GLU 8 11.742 -3.496 -8.122
61 HG3 GLU 8 HG3 GLU 8 12.247 -1.923 -8.737
62 H CYS 9 H CYS 9 14.986 -0.479 -7.180
63 HA CYS 9 HA CYS 9 12.468 0.920 -6.813
64 HB2 CYS 9 HB2 CYS 9 13.412 0.707 -4.522
65 HB3 CYS 9 HB3 CYS 9 14.855 1.556 -5.067
66 H ALA 10 H ALA 10 12.432 2.029 -8.661
67 HA ALA 10 HA ALA 10 14.854 3.075 -9.846
68 HB1 ALA 10 HB1 ALA 10 12.501 2.176 -10.892
69 HB2 ALA 10 HB2 ALA 10 12.311 3.925 -11.017
70 HB3 ALA 10 HB3 ALA 10 13.699 3.133 -11.764
71 H TRP 11 H TRP 11 15.368 5.234 -10.146
72 HA TRP 11 HA TRP 11 14.660 7.007 -8.075
73 HB2 TRP 11 HB2 TRP 11 16.236 7.218 -10.601
74 HB3 TRP 11 HB3 TRP 11 15.753 8.708 -9.794
75 HD1 TRP 11 HD1 TRP 11 16.432 5.966 -7.361
76 HE1 TRP 11 HE1 TRP 11 18.718 6.331 -6.236
77 HE3 TRP 11 HE3 TRP 11 18.258 9.644 -10.407
78 HZ2 TRP 11 HZ2 TRP 11 20.994 7.963 -6.593
79 HZ3 TRP 11 HZ3 TRP 11 20.497 10.554 -9.946
80 HH2 TRP 11 HH2 TRP 11 21.835 9.729 -8.078
81 H PHE 12 H PHE 12 13.056 6.196 -10.941
82 HA PHE 12 HA PHE 12 11.247 8.482 -10.592
83 HB2 PHE 12 HB2 PHE 12 12.924 8.493 -12.662
84 HB3 PHE 12 HB3 PHE 12 11.682 7.455 -13.355
85 HD1 PHE 12 HD2 PHE 12 12.299 10.787 -11.880
86 HD2 PHE 12 HD1 PHE 12 9.666 8.347 -14.167
87 HE1 PHE 12 HE2 PHE 12 10.977 12.775 -12.474
88 HE2 PHE 12 HE1 PHE 12 8.340 10.331 -14.764
89 HZ PHE 12 HZ PHE 12 8.994 12.549 -13.916
90 H SER 13 H SER 13 11.190 5.637 -9.766
91 HA SER 13 HA SER 13 9.424 4.160 -11.383
92 HB2 SER 13 HB2 SER 13 8.980 2.857 -9.273
93 HB3 SER 13 HB3 SER 13 10.687 3.023 -9.684
94 HG SER 13 HG SER 13 9.569 4.967 -8.031
95 H GLY 14 H GLY 14 8.907 6.899 -9.439
96 HA2 GLY 14 HA2 GLY 14 6.911 8.148 -9.434
97 HA3 GLY 14 HA3 GLY 14 6.033 6.706 -9.922
98 H GLU 15 H GLU 15 7.284 5.067 -7.820
99 HA GLU 15 HA GLU 15 5.624 6.017 -5.593
100 HB2 GLU 15 HB2 GLU 15 5.886 3.618 -4.789
101 HB3 GLU 15 HB3 GLU 15 4.939 3.856 -6.251
102 HG2 GLU 15 HG2 GLU 15 7.724 3.434 -6.869
103 HG3 GLU 15 HG3 GLU 15 7.073 2.117 -5.896
104 H TRP 16 H TRP 16 6.523 5.006 -3.405
105 HA TRP 16 HA TRP 16 9.395 5.639 -3.240
106 HB2 TRP 16 HB2 TRP 16 7.208 6.507 -1.339
107 HB3 TRP 16 HB3 TRP 16 8.931 6.681 -1.016
108 HD1 TRP 16 HD1 TRP 16 6.684 7.659 -4.045
109 HE1 TRP 16 HE1 TRP 16 7.266 10.079 -4.699
110 HE3 TRP 16 HE3 TRP 16 10.253 8.620 -0.512
111 HZ2 TRP 16 HZ2 TRP 16 9.008 12.125 -3.833
112 HZ3 TRP 16 HZ3 TRP 16 11.328 10.832 -0.494
113 HH2 TRP 16 HH2 TRP 16 10.718 12.547 -2.121
114 H CYS 17 H CYS 17 10.318 4.882 -1.069
115 HA CYS 17 HA CYS 17 9.674 2.082 -0.797
116 HB2 CYS 17 HB2 CYS 17 11.667 3.557 0.905
117 HB3 CYS 17 HB3 CYS 17 11.689 1.873 0.390
118 H CYS 18 H CYS 18 9.438 1.076 1.359
119 HA CYS 18 HA CYS 18 7.278 2.230 2.773
120 HB2 CYS 18 HB2 CYS 18 9.081 -0.068 3.563
121 HB3 CYS 18 HB3 CYS 18 7.535 0.321 4.311
122 H GLY 19 H GLY 19 7.319 2.456 5.221
123 HA2 GLY 19 HA2 GLY 19 8.011 3.713 7.015
124 HA3 GLY 19 HA3 GLY 19 9.589 3.004 6.709
125 H ALA 20 H ALA 20 11.195 4.295 6.051
126 HA ALA 20 HA ALA 20 10.622 6.799 4.697
127 HB1 ALA 20 HB1 ALA 20 10.740 6.898 7.409
128 HB2 ALA 20 HB2 ALA 20 12.420 7.216 6.975
129 HB3 ALA 20 HB3 ALA 20 11.136 8.241 6.337
130 H LEU 21 H LEU 21 11.911 4.485 3.790
131 HA LEU 21 HA LEU 21 14.762 5.175 3.806
132 HB2 LEU 21 HB2 LEU 21 13.565 2.729 2.552
133 HB3 LEU 21 HB3 LEU 21 15.220 2.988 3.099
134 HG LEU 21 HG LEU 21 13.139 3.086 5.191
135 HD11 LEU 21 HD11 LEU 21 12.462 0.932 5.144
136 HD12 LEU 21 HD12 LEU 21 13.968 0.357 4.431
137 HD13 LEU 21 HD13 LEU 21 12.746 1.121 3.414
138 HD21 LEU 21 HD21 LEU 21 14.903 2.703 6.490
139 HD22 LEU 21 HD22 LEU 21 15.906 2.902 5.052
140 HD23 LEU 21 HD23 LEU 21 15.380 1.292 5.545
141 H SER 22 H SER 22 15.943 5.105 1.767
142 HA SER 22 HA SER 22 14.282 6.067 -0.468
143 HB2 SER 22 HB2 SER 22 16.929 6.911 0.596
144 HB3 SER 22 HB3 SER 22 16.706 6.979 -1.152
145 HG SER 22 HG SER 22 16.058 8.863 0.314
146 H CYS 23 H CYS 23 15.928 5.921 -2.562
147 HA CYS 23 HA CYS 23 16.290 3.035 -2.890
148 HB2 CYS 23 HB2 CYS 23 16.392 5.125 -5.063
149 HB3 CYS 23 HB3 CYS 23 16.121 3.395 -5.237
150 H LYS 24 H LYS 24 18.262 2.289 -2.503
151 HA LYS 24 HA LYS 24 20.572 3.937 -3.299
152 HB2 LYS 24 HB2 LYS 24 20.496 1.780 -1.183
153 HB3 LYS 24 HB3 LYS 24 21.857 2.828 -1.562
154 HG2 LYS 24 HG2 LYS 24 20.984 3.816 0.325
155 HG3 LYS 24 HG3 LYS 24 20.224 4.749 -0.966
156 HD2 LYS 24 HD2 LYS 24 18.157 3.799 -0.618
157 HD3 LYS 24 HD3 LYS 24 18.834 2.324 0.077
158 HE2 LYS 24 HE2 LYS 24 17.713 3.661 1.780
159 HE3 LYS 24 HE3 LYS 24 19.444 3.555 2.098
160 HZ1 LYS 24 HZ1 LYS 24 18.077 5.836 2.124
161 HZ2 LYS 24 HZ2 LYS 24 18.590 5.831 0.512
162 HZ3 LYS 24 HZ3 LYS 24 19.727 5.746 1.761
163 H TYR 25 H TYR 25 22.415 2.840 -4.170
164 HA TYR 25 HA TYR 25 21.670 0.681 -5.927
165 HB2 TYR 25 HB2 TYR 25 23.087 2.483 -6.763
166 HB3 TYR 25 HB3 TYR 25 24.308 2.114 -5.549
167 HD1 TYR 25 HD2 TYR 25 25.677 0.083 -5.742
168 HD2 TYR 25 HD1 TYR 25 22.864 1.148 -8.752
169 HE1 TYR 25 HE2 TYR 25 26.752 -1.492 -7.296
170 HE2 TYR 25 HE1 TYR 25 23.931 -0.425 -10.313
171 HH TYR 25 HH TYR 25 25.490 -1.984 -10.579
172 H SER 26 H SER 26 22.193 -1.423 -5.763
173 HA SER 26 HA SER 26 23.775 -2.236 -3.416
174 HB2 SER 26 HB2 SER 26 21.321 -3.347 -4.684
175 HB3 SER 26 HB3 SER 26 22.466 -4.496 -3.992
176 HG SER 26 HG SER 26 22.330 -3.250 -2.032
177 H ILE 27 H ILE 27 25.802 -2.463 -4.211
178 HA ILE 27 HA ILE 27 26.501 -3.372 -6.761
179 HB ILE 27 HB ILE 27 28.227 -3.801 -4.335
180 HG12 ILE 27 HG12 ILE 27 28.941 -1.338 -5.361
181 HG13 ILE 27 HG13 ILE 27 27.182 -1.295 -5.427
182 HG21 ILE 27 HG21 ILE 27 29.270 -4.687 -6.223
183 HG22 ILE 27 HG22 ILE 27 28.705 -3.381 -7.263
184 HG23 ILE 27 HG23 ILE 27 29.971 -3.075 -6.075
185 HD11 ILE 27 HD11 ILE 27 27.537 -2.247 -2.940
186 HD12 ILE 27 HD12 ILE 27 28.993 -1.267 -3.115
187 HD13 ILE 27 HD13 ILE 27 27.404 -0.532 -3.330
188 H LYS 28 H LYS 28 26.123 -5.129 -3.711
189 HA LYS 28 HA LYS 28 27.025 -7.631 -4.603
190 HB2 LYS 28 HB2 LYS 28 24.866 -7.206 -2.539
191 HB3 LYS 28 HB3 LYS 28 26.002 -8.544 -2.649
192 HG2 LYS 28 HG2 LYS 28 27.206 -7.448 -1.137
193 HG3 LYS 28 HG3 LYS 28 27.651 -6.356 -2.450
194 HD2 LYS 28 HD2 LYS 28 26.832 -4.788 -1.040
195 HD3 LYS 28 HD3 LYS 28 25.289 -5.283 -1.740
196 HE2 LYS 28 HE2 LYS 28 25.158 -6.985 0.143
197 HE3 LYS 28 HE3 LYS 28 26.501 -6.116 0.883
198 HZ1 LYS 28 HZ1 LYS 28 25.212 -4.239 1.214
199 HZ2 LYS 28 HZ2 LYS 28 24.123 -5.490 1.547
200 HZ3 LYS 28 HZ3 LYS 28 24.057 -4.685 0.060
201 H ARG 29 H ARG 29 23.834 -6.123 -4.702
202 HA ARG 29 HA ARG 29 22.675 -8.480 -5.957
203 HB2 ARG 29 HB2 ARG 29 21.495 -5.828 -5.123
204 HB3 ARG 29 HB3 ARG 29 20.575 -7.089 -5.934
205 HG2 ARG 29 HG2 ARG 29 21.850 -8.324 -3.759
206 HG3 ARG 29 HG3 ARG 29 21.195 -6.799 -3.159
207 HD2 ARG 29 HD2 ARG 29 19.051 -7.454 -3.447
208 HD3 ARG 29 HD3 ARG 29 19.416 -8.361 -4.913
209 HE ARG 29 HE ARG 29 20.479 -9.616 -2.583
210 HH11 ARG 29 HH11 ARG 29 17.572 -9.156 -4.443
211 HH12 ARG 29 HH12 ARG 29 16.842 -10.635 -3.910
212 HH21 ARG 29 HH21 ARG 29 19.529 -11.565 -1.875
213 HH22 ARG 29 HH22 ARG 29 17.956 -12.003 -2.449
214 H ASN 30 H ASN 30 24.604 -6.172 -7.059
215 HA ASN 30 HA ASN 30 24.888 -5.013 -9.019
216 HB2 ASN 30 HB2 ASN 30 24.646 -6.437 -11.012
217 HB3 ASN 30 HB3 ASN 30 25.400 -7.314 -9.684
218 HD21 ASN 30 HD21 ASN 30 24.647 -9.262 -9.310
219 HD22 ASN 30 HD22 ASN 30 23.081 -9.850 -9.741
220 H LEU 31 H LEU 31 22.430 -4.368 -7.727
221 HA LEU 31 HA LEU 31 20.998 -3.304 -10.013
222 HB2 LEU 31 HB2 LEU 31 19.663 -5.059 -7.960
223 HB3 LEU 31 HB3 LEU 31 18.802 -4.049 -9.119
224 HG LEU 31 HG LEU 31 20.682 -6.251 -9.945
225 HD11 LEU 31 HD11 LEU 31 18.406 -7.399 -10.459
226 HD12 LEU 31 HD12 LEU 31 17.795 -6.343 -9.186
227 HD13 LEU 31 HD13 LEU 31 19.087 -7.491 -8.835
228 HD21 LEU 31 HD21 LEU 31 19.570 -6.064 -12.074
229 HD22 LEU 31 HD22 LEU 31 20.166 -4.475 -11.592
230 HD23 LEU 31 HD23 LEU 31 18.453 -4.862 -11.427
231 H LYS 32 H LYS 32 18.811 -2.248 -8.793
232 HA LYS 32 HA LYS 32 19.931 -0.603 -6.620
233 HB2 LYS 32 HB2 LYS 32 18.115 0.306 -8.861
234 HB3 LYS 32 HB3 LYS 32 18.652 1.306 -7.517
235 HG2 LYS 32 HG2 LYS 32 20.237 1.956 -8.960
236 HG3 LYS 32 HG3 LYS 32 21.028 0.454 -8.477
237 HD2 LYS 32 HD2 LYS 32 20.695 -0.503 -10.483
238 HD3 LYS 32 HD3 LYS 32 19.058 0.143 -10.625
239 HE2 LYS 32 HE2 LYS 32 20.443 2.410 -10.931
240 HE3 LYS 32 HE3 LYS 32 21.640 1.269 -11.541
241 HZ1 LYS 32 HZ1 LYS 32 20.495 1.661 -13.440
242 HZ2 LYS 32 HZ2 LYS 32 19.040 2.005 -12.648
243 HZ3 LYS 32 HZ3 LYS 32 19.537 0.399 -12.847
244 H ILE 33 H ILE 33 18.881 -1.024 -4.798
245 HA ILE 33 HA ILE 33 15.954 -1.289 -4.896
246 HB ILE 33 HB ILE 33 15.911 -3.096 -3.399
247 HG12 ILE 33 HG12 ILE 33 18.846 -2.543 -2.945
248 HG13 ILE 33 HG13 ILE 33 17.536 -2.405 -1.777
249 HG21 ILE 33 HG21 ILE 33 16.689 -3.566 -5.777
250 HG22 ILE 33 HG22 ILE 33 18.296 -3.787 -5.087
251 HG23 ILE 33 HG23 ILE 33 16.968 -4.830 -4.580
252 HD11 ILE 33 HD11 ILE 33 19.057 -4.755 -2.646
253 HD12 ILE 33 HD12 ILE 33 18.269 -4.409 -1.106
254 HD13 ILE 33 HD13 ILE 33 17.321 -5.006 -2.468
255 H CYS 34 H CYS 34 15.039 -1.131 -2.577
256 HA CYS 34 HA CYS 34 16.009 1.352 -1.470
257 HB2 CYS 34 HB2 CYS 34 13.626 -0.403 -0.927
258 HB3 CYS 34 HB3 CYS 34 14.028 0.939 0.139
259 H VAL 35 H VAL 35 16.399 1.652 0.830
260 HA VAL 35 HA VAL 35 17.129 -0.714 2.359
261 HB VAL 35 HB VAL 35 19.165 1.454 1.834
262 HG11 VAL 35 HG11 VAL 35 19.841 0.677 3.853
263 HG12 VAL 35 HG12 VAL 35 19.020 -0.872 3.656
264 HG13 VAL 35 HG13 VAL 35 20.565 -0.583 2.855
265 HG21 VAL 35 HG21 VAL 35 19.017 -1.361 0.760
266 HG22 VAL 35 HG22 VAL 35 18.856 0.128 -0.171
267 HG23 VAL 35 HG23 VAL 35 20.397 -0.278 0.583
Start of MODEL 14
1 H1 GLY 1 H GLY 1 1.905 -0.863 -3.219
2 HA2 GLY 1 HA2 GLY 1 1.255 0.651 -1.531
3 HA3 GLY 1 HA3 GLY 1 1.903 -0.452 -0.325
4 H CYS 2 H CYS 2 4.422 -0.818 -0.787
5 HA CYS 2 HA CYS 2 5.786 1.594 -1.598
6 HB2 CYS 2 HB2 CYS 2 6.903 1.910 0.603
7 HB3 CYS 2 HB3 CYS 2 5.174 2.242 0.651
8 H ILE 3 H ILE 3 8.150 1.359 -1.480
9 HA ILE 3 HA ILE 3 8.904 -1.385 -2.084
10 HB ILE 3 HB ILE 3 10.582 1.117 -2.288
11 HG12 ILE 3 HG12 ILE 3 9.754 0.001 -4.811
12 HG13 ILE 3 HG13 ILE 3 8.342 0.359 -3.824
13 HG21 ILE 3 HG21 ILE 3 11.552 -1.335 -2.212
14 HG22 ILE 3 HG22 ILE 3 11.054 -1.332 -3.903
15 HG23 ILE 3 HG23 ILE 3 12.199 -0.124 -3.319
16 HD11 ILE 3 HD11 ILE 3 10.033 2.578 -3.588
17 HD12 ILE 3 HD12 ILE 3 10.021 2.138 -5.297
18 HD13 ILE 3 HD13 ILE 3 8.504 2.466 -4.460
19 H ALA 4 H ALA 4 9.755 -2.671 -0.600
20 HA ALA 4 HA ALA 4 10.649 -1.654 1.936
21 HB1 ALA 4 HB1 ALA 4 10.587 -4.443 0.798
22 HB2 ALA 4 HB2 ALA 4 11.086 -4.053 2.444
23 HB3 ALA 4 HB3 ALA 4 9.436 -3.719 1.920
24 H LYS 5 H LYS 5 12.752 -2.554 2.866
25 HA LYS 5 HA LYS 5 14.905 -1.626 1.219
26 HB2 LYS 5 HB2 LYS 5 16.317 -2.245 3.192
27 HB3 LYS 5 HB3 LYS 5 15.002 -1.137 3.562
28 HG2 LYS 5 HG2 LYS 5 13.907 -3.648 3.978
29 HG3 LYS 5 HG3 LYS 5 15.551 -3.775 4.609
30 HD2 LYS 5 HD2 LYS 5 14.695 -1.319 5.535
31 HD3 LYS 5 HD3 LYS 5 13.253 -2.330 5.661
32 HE2 LYS 5 HE2 LYS 5 14.938 -4.045 6.713
33 HE3 LYS 5 HE3 LYS 5 15.892 -2.596 7.027
34 HZ1 LYS 5 HZ1 LYS 5 14.175 -3.433 8.766
35 HZ2 LYS 5 HZ2 LYS 5 13.053 -2.635 7.783
36 HZ3 LYS 5 HZ3 LYS 5 14.336 -1.775 8.473
37 H ASN 6 H ASN 6 14.307 -3.376 -0.432
38 HA ASN 6 HA ASN 6 16.372 -5.244 -0.573
39 HB2 ASN 6 HB2 ASN 6 14.700 -6.201 1.254
40 HB3 ASN 6 HB3 ASN 6 13.834 -6.763 -0.173
41 HD21 ASN 6 HD21 ASN 6 14.248 -8.908 0.435
42 HD22 ASN 6 HD22 ASN 6 15.800 -9.628 0.195
43 H LYS 7 H LYS 7 13.192 -4.214 -1.538
44 HA LYS 7 HA LYS 7 13.304 -5.609 -4.076
45 HB2 LYS 7 HB2 LYS 7 11.316 -3.514 -3.194
46 HB3 LYS 7 HB3 LYS 7 11.127 -4.680 -4.497
47 HG2 LYS 7 HG2 LYS 7 11.664 -6.090 -2.081
48 HG3 LYS 7 HG3 LYS 7 10.363 -4.932 -1.794
49 HD2 LYS 7 HD2 LYS 7 9.015 -5.867 -3.479
50 HD3 LYS 7 HD3 LYS 7 10.369 -6.754 -4.185
51 HE2 LYS 7 HE2 LYS 7 10.422 -7.868 -1.789
52 HE3 LYS 7 HE3 LYS 7 8.731 -7.371 -1.777
53 HZ1 LYS 7 HZ1 LYS 7 9.957 -9.534 -3.155
54 HZ2 LYS 7 HZ2 LYS 7 9.133 -8.529 -4.237
55 HZ3 LYS 7 HZ3 LYS 7 8.313 -9.208 -2.922
56 H GLU 8 H GLU 8 13.547 -4.659 -6.091
57 HA GLU 8 HA GLU 8 15.315 -2.472 -6.256
58 HB2 GLU 8 HB2 GLU 8 15.317 -2.815 -8.556
59 HB3 GLU 8 HB3 GLU 8 14.897 -4.404 -7.932
60 HG2 GLU 8 HG2 GLU 8 12.520 -3.909 -8.354
61 HG3 GLU 8 HG3 GLU 8 12.993 -2.364 -9.058
62 H CYS 9 H CYS 9 15.012 -0.374 -7.068
63 HA CYS 9 HA CYS 9 12.312 0.603 -7.491
64 HB2 CYS 9 HB2 CYS 9 12.509 2.370 -5.784
65 HB3 CYS 9 HB3 CYS 9 12.527 0.764 -5.064
66 H ALA 10 H ALA 10 12.239 2.360 -8.808
67 HA ALA 10 HA ALA 10 14.796 3.258 -9.908
68 HB1 ALA 10 HB1 ALA 10 12.536 4.370 -11.269
69 HB2 ALA 10 HB2 ALA 10 13.750 3.237 -11.864
70 HB3 ALA 10 HB3 ALA 10 12.305 2.635 -11.052
71 H TRP 11 H TRP 11 15.342 5.441 -10.114
72 HA TRP 11 HA TRP 11 14.651 7.097 -7.950
73 HB2 TRP 11 HB2 TRP 11 16.213 7.447 -10.469
74 HB3 TRP 11 HB3 TRP 11 15.748 8.889 -9.571
75 HD1 TRP 11 HD1 TRP 11 16.419 6.003 -7.310
76 HE1 TRP 11 HE1 TRP 11 18.715 6.281 -6.181
77 HE3 TRP 11 HE3 TRP 11 18.258 9.839 -10.145
78 HZ2 TRP 11 HZ2 TRP 11 21.003 7.911 -6.456
79 HZ3 TRP 11 HZ3 TRP 11 20.508 10.700 -9.647
80 HH2 TRP 11 HH2 TRP 11 21.851 9.755 -7.840
81 H PHE 12 H PHE 12 13.054 6.499 -10.885
82 HA PHE 12 HA PHE 12 11.235 8.743 -10.358
83 HB2 PHE 12 HB2 PHE 12 12.932 8.943 -12.402
84 HB3 PHE 12 HB3 PHE 12 11.702 7.965 -13.196
85 HD1 PHE 12 HD1 PHE 12 12.270 11.150 -11.404
86 HD2 PHE 12 HD2 PHE 12 9.707 8.923 -13.970
87 HE1 PHE 12 HE1 PHE 12 10.944 13.177 -11.833
88 HE2 PHE 12 HE2 PHE 12 8.377 10.946 -14.404
89 HZ PHE 12 HZ PHE 12 8.995 13.077 -13.336
90 H SER 13 H SER 13 11.211 5.810 -9.822
91 HA SER 13 HA SER 13 9.451 4.493 -11.572
92 HB2 SER 13 HB2 SER 13 8.985 3.022 -9.551
93 HB3 SER 13 HB3 SER 13 10.679 3.166 -10.018
94 HG SER 13 HG SER 13 10.505 3.446 -7.800
95 H GLY 14 H GLY 14 8.913 7.017 -9.353
96 HA2 GLY 14 HA2 GLY 14 6.916 8.254 -9.219
97 HA3 GLY 14 HA3 GLY 14 6.046 6.879 -9.885
98 H GLU 15 H GLU 15 7.557 5.170 -7.836
99 HA GLU 15 HA GLU 15 5.647 5.653 -5.663
100 HB2 GLU 15 HB2 GLU 15 6.375 3.291 -4.978
101 HB3 GLU 15 HB3 GLU 15 5.402 3.452 -6.433
102 HG2 GLU 15 HG2 GLU 15 8.287 3.562 -6.899
103 HG3 GLU 15 HG3 GLU 15 7.711 2.033 -6.238
104 H TRP 16 H TRP 16 6.593 4.718 -3.474
105 HA TRP 16 HA TRP 16 9.324 5.737 -3.099
106 HB2 TRP 16 HB2 TRP 16 7.196 6.273 -1.047
107 HB3 TRP 16 HB3 TRP 16 8.747 7.078 -1.271
108 HD1 TRP 16 HD1 TRP 16 8.704 8.177 -4.089
109 HE1 TRP 16 HE1 TRP 16 6.951 9.881 -4.892
110 HE3 TRP 16 HE3 TRP 16 5.054 7.279 -0.625
111 HZ2 TRP 16 HZ2 TRP 16 4.363 10.733 -4.154
112 HZ3 TRP 16 HZ3 TRP 16 2.970 8.582 -0.743
113 HH2 TRP 16 HH2 TRP 16 2.634 10.274 -2.471
114 H CYS 17 H CYS 17 10.398 4.929 -1.189
115 HA CYS 17 HA CYS 17 9.814 2.162 -0.728
116 HB2 CYS 17 HB2 CYS 17 11.831 3.807 0.791
117 HB3 CYS 17 HB3 CYS 17 11.866 2.079 0.454
118 H CYS 18 H CYS 18 9.667 1.222 1.455
119 HA CYS 18 HA CYS 18 7.546 2.394 2.922
120 HB2 CYS 18 HB2 CYS 18 9.384 0.104 3.654
121 HB3 CYS 18 HB3 CYS 18 7.896 0.517 4.501
122 H GLY 19 H GLY 19 7.687 2.652 5.369
123 HA2 GLY 19 HA2 GLY 19 8.436 3.962 7.101
124 HA3 GLY 19 HA3 GLY 19 9.998 3.230 6.765
125 H ALA 20 H ALA 20 11.596 4.505 6.073
126 HA ALA 20 HA ALA 20 11.012 6.969 4.649
127 HB1 ALA 20 HB1 ALA 20 12.062 8.443 6.178
128 HB2 ALA 20 HB2 ALA 20 10.902 7.495 7.109
129 HB3 ALA 20 HB3 ALA 20 12.620 7.108 7.188
130 H LEU 21 H LEU 21 12.295 4.581 3.848
131 HA LEU 21 HA LEU 21 15.145 5.240 3.802
132 HB2 LEU 21 HB2 LEU 21 13.862 2.822 2.571
133 HB3 LEU 21 HB3 LEU 21 15.540 3.042 3.060
134 HG LEU 21 HG LEU 21 13.433 3.124 5.162
135 HD11 LEU 21 HD11 LEU 21 12.870 0.962 5.077
136 HD12 LEU 21 HD12 LEU 21 14.502 0.454 4.643
137 HD13 LEU 21 HD13 LEU 21 13.401 1.041 3.397
138 HD21 LEU 21 HD21 LEU 21 15.189 2.951 6.515
139 HD22 LEU 21 HD22 LEU 21 16.209 3.194 5.097
140 HD23 LEU 21 HD23 LEU 21 15.818 1.559 5.634
141 H SER 22 H SER 22 16.317 5.175 1.768
142 HA SER 22 HA SER 22 14.669 6.165 -0.463
143 HB2 SER 22 HB2 SER 22 17.331 6.960 0.599
144 HB3 SER 22 HB3 SER 22 17.110 7.032 -1.149
145 HG SER 22 HG SER 22 16.370 8.953 -0.542
146 H CYS 23 H CYS 23 16.329 5.998 -2.555
147 HA CYS 23 HA CYS 23 16.642 3.105 -2.886
148 HB2 CYS 23 HB2 CYS 23 16.424 5.360 -4.885
149 HB3 CYS 23 HB3 CYS 23 16.765 3.693 -5.338
150 H LYS 24 H LYS 24 18.598 2.261 -2.710
151 HA LYS 24 HA LYS 24 20.918 3.900 -3.499
152 HB2 LYS 24 HB2 LYS 24 20.955 1.773 -1.360
153 HB3 LYS 24 HB3 LYS 24 22.215 2.941 -1.735
154 HG2 LYS 24 HG2 LYS 24 21.306 3.897 0.123
155 HG3 LYS 24 HG3 LYS 24 20.342 4.678 -1.133
156 HD2 LYS 24 HD2 LYS 24 18.475 3.362 -0.689
157 HD3 LYS 24 HD3 LYS 24 19.426 2.117 0.124
158 HE2 LYS 24 HE2 LYS 24 18.022 3.554 1.633
159 HE3 LYS 24 HE3 LYS 24 19.736 3.486 2.039
160 HZ1 LYS 24 HZ1 LYS 24 20.057 5.641 1.455
161 HZ2 LYS 24 HZ2 LYS 24 18.434 5.752 1.916
162 HZ3 LYS 24 HZ3 LYS 24 18.841 5.642 0.278
163 H TYR 25 H TYR 25 22.713 2.772 -4.403
164 HA TYR 25 HA TYR 25 21.909 0.554 -6.056
165 HB2 TYR 25 HB2 TYR 25 23.305 2.315 -7.001
166 HB3 TYR 25 HB3 TYR 25 24.559 1.993 -5.809
167 HD1 TYR 25 HD2 TYR 25 25.880 -0.095 -5.937
168 HD2 TYR 25 HD1 TYR 25 23.067 0.952 -8.953
169 HE1 TYR 25 HE2 TYR 25 26.911 -1.730 -7.458
170 HE2 TYR 25 HE1 TYR 25 24.090 -0.681 -10.482
171 HH TYR 25 HH TYR 25 27.009 -1.913 -10.171
172 H SER 26 H SER 26 22.334 -1.542 -5.757
173 HA SER 26 HA SER 26 24.028 -2.279 -3.465
174 HB2 SER 26 HB2 SER 26 21.508 -3.402 -4.583
175 HB3 SER 26 HB3 SER 26 22.664 -4.542 -3.895
176 HG SER 26 HG SER 26 22.631 -3.214 -1.983
177 H ILE 27 H ILE 27 26.018 -2.568 -4.332
178 HA ILE 27 HA ILE 27 26.615 -3.582 -6.861
179 HB ILE 27 HB ILE 27 28.400 -3.987 -4.474
180 HG12 ILE 27 HG12 ILE 27 29.148 -1.577 -5.603
181 HG13 ILE 27 HG13 ILE 27 27.390 -1.488 -5.612
182 HG21 ILE 27 HG21 ILE 27 30.108 -4.181 -5.956
183 HG22 ILE 27 HG22 ILE 27 28.799 -4.740 -6.996
184 HG23 ILE 27 HG23 ILE 27 29.373 -3.077 -7.119
185 HD11 ILE 27 HD11 ILE 27 29.280 -1.433 -3.365
186 HD12 ILE 27 HD12 ILE 27 27.699 -0.672 -3.547
187 HD13 ILE 27 HD13 ILE 27 27.812 -2.376 -3.108
188 H LYS 28 H LYS 28 26.325 -5.246 -3.746
189 HA LYS 28 HA LYS 28 27.131 -7.790 -4.575
190 HB2 LYS 28 HB2 LYS 28 25.770 -8.608 -2.633
191 HB3 LYS 28 HB3 LYS 28 26.912 -7.331 -2.237
192 HG2 LYS 28 HG2 LYS 28 25.242 -6.234 -1.288
193 HG3 LYS 28 HG3 LYS 28 24.544 -6.013 -2.894
194 HD2 LYS 28 HD2 LYS 28 22.850 -6.985 -1.547
195 HD3 LYS 28 HD3 LYS 28 23.451 -8.268 -2.601
196 HE2 LYS 28 HE2 LYS 28 23.717 -9.484 -0.751
197 HE3 LYS 28 HE3 LYS 28 25.081 -8.431 -0.376
198 HZ1 LYS 28 HZ1 LYS 28 22.713 -7.159 0.425
199 HZ2 LYS 28 HZ2 LYS 28 23.994 -7.696 1.389
200 HZ3 LYS 28 HZ3 LYS 28 22.701 -8.732 1.048
201 H ARG 29 H ARG 29 24.000 -6.187 -4.757
202 HA ARG 29 HA ARG 29 22.782 -8.567 -5.928
203 HB2 ARG 29 HB2 ARG 29 21.659 -5.899 -5.075
204 HB3 ARG 29 HB3 ARG 29 20.705 -7.113 -5.918
205 HG2 ARG 29 HG2 ARG 29 21.835 -8.523 -3.836
206 HG3 ARG 29 HG3 ARG 29 21.464 -6.951 -3.124
207 HD2 ARG 29 HD2 ARG 29 19.457 -7.977 -2.800
208 HD3 ARG 29 HD3 ARG 29 19.180 -7.325 -4.414
209 HE ARG 29 HE ARG 29 20.295 -9.878 -4.671
210 HH11 ARG 29 HH11 ARG 29 17.364 -8.361 -3.563
211 HH12 ARG 29 HH12 ARG 29 16.361 -9.722 -3.942
212 HH21 ARG 29 HH21 ARG 29 18.986 -11.677 -5.174
213 HH22 ARG 29 HH22 ARG 29 17.286 -11.608 -4.857
214 H ASN 30 H ASN 30 24.726 -6.299 -7.082
215 HA ASN 30 HA ASN 30 25.002 -5.168 -9.060
216 HB2 ASN 30 HB2 ASN 30 24.715 -6.612 -11.032
217 HB3 ASN 30 HB3 ASN 30 25.473 -7.484 -9.703
218 HD21 ASN 30 HD21 ASN 30 24.696 -9.415 -9.293
219 HD22 ASN 30 HD22 ASN 30 23.117 -9.987 -9.699
220 H LEU 31 H LEU 31 22.572 -4.469 -7.747
221 HA LEU 31 HA LEU 31 21.124 -3.417 -10.028
222 HB2 LEU 31 HB2 LEU 31 19.792 -5.121 -7.930
223 HB3 LEU 31 HB3 LEU 31 18.930 -4.114 -9.092
224 HG LEU 31 HG LEU 31 20.766 -6.354 -9.916
225 HD11 LEU 31 HD11 LEU 31 18.462 -7.476 -10.374
226 HD12 LEU 31 HD12 LEU 31 17.896 -6.400 -9.097
227 HD13 LEU 31 HD13 LEU 31 19.180 -7.563 -8.766
228 HD21 LEU 31 HD21 LEU 31 18.544 -5.686 -11.641
229 HD22 LEU 31 HD22 LEU 31 20.268 -5.767 -12.003
230 HD23 LEU 31 HD23 LEU 31 19.574 -4.287 -11.339
231 H LYS 32 H LYS 32 18.972 -2.308 -8.796
232 HA LYS 32 HA LYS 32 20.144 -0.653 -6.658
233 HB2 LYS 32 HB2 LYS 32 18.274 0.292 -8.838
234 HB3 LYS 32 HB3 LYS 32 18.973 1.284 -7.565
235 HG2 LYS 32 HG2 LYS 32 20.448 1.800 -9.183
236 HG3 LYS 32 HG3 LYS 32 21.221 0.307 -8.646
237 HD2 LYS 32 HD2 LYS 32 20.821 -0.704 -10.596
238 HD3 LYS 32 HD3 LYS 32 19.134 -0.186 -10.601
239 HE2 LYS 32 HE2 LYS 32 21.316 1.757 -11.247
240 HE3 LYS 32 HE3 LYS 32 20.735 0.633 -12.475
241 HZ1 LYS 32 HZ1 LYS 32 19.576 2.758 -12.568
242 HZ2 LYS 32 HZ2 LYS 32 19.045 2.561 -10.974
243 HZ3 LYS 32 HZ3 LYS 32 18.509 1.503 -12.181
244 H ILE 33 H ILE 33 19.108 -1.057 -4.824
245 HA ILE 33 HA ILE 33 16.174 -1.262 -4.891
246 HB ILE 33 HB ILE 33 16.114 -3.047 -3.370
247 HG12 ILE 33 HG12 ILE 33 19.043 -2.480 -2.921
248 HG13 ILE 33 HG13 ILE 33 17.733 -2.402 -1.749
249 HG21 ILE 33 HG21 ILE 33 18.488 -3.843 -5.018
250 HG22 ILE 33 HG22 ILE 33 17.085 -4.804 -4.554
251 HG23 ILE 33 HG23 ILE 33 16.920 -3.530 -5.762
252 HD11 ILE 33 HD11 ILE 33 17.487 -4.926 -2.199
253 HD12 ILE 33 HD12 ILE 33 19.107 -4.796 -2.883
254 HD13 ILE 33 HD13 ILE 33 18.824 -4.360 -1.198
255 H CYS 34 H CYS 34 15.300 -1.082 -2.543
256 HA CYS 34 HA CYS 34 16.360 1.394 -1.471
257 HB2 CYS 34 HB2 CYS 34 13.872 -0.220 -0.960
258 HB3 CYS 34 HB3 CYS 34 14.326 1.114 0.096
259 H VAL 35 H VAL 35 16.678 1.686 0.855
260 HA VAL 35 HA VAL 35 17.267 -0.709 2.399
261 HB VAL 35 HB VAL 35 19.407 1.375 1.957
262 HG11 VAL 35 HG11 VAL 35 20.294 -1.156 2.987
263 HG12 VAL 35 HG12 VAL 35 20.470 0.458 3.679
264 HG13 VAL 35 HG13 VAL 35 19.021 -0.492 4.011
265 HG21 VAL 35 HG21 VAL 35 19.168 -1.409 0.820
266 HG22 VAL 35 HG22 VAL 35 19.099 0.104 -0.083
267 HG23 VAL 35 HG23 VAL 35 20.599 -0.384 0.705
Start of MODEL 15
1 H1 GLY 1 H GLY 1 1.978 -1.892 -0.902
2 HA2 GLY 1 HA2 GLY 1 1.982 -0.434 -2.690
3 HA3 GLY 1 HA3 GLY 1 1.205 0.757 -1.658
4 H CYS 2 H CYS 2 4.154 -0.668 -0.569
5 HA CYS 2 HA CYS 2 5.680 1.673 -1.477
6 HB2 CYS 2 HB2 CYS 2 6.725 1.858 0.747
7 HB3 CYS 2 HB3 CYS 2 4.986 2.124 0.821
8 H ILE 3 H ILE 3 8.007 1.368 -1.428
9 HA ILE 3 HA ILE 3 8.710 -1.367 -2.126
10 HB ILE 3 HB ILE 3 10.384 1.142 -2.295
11 HG12 ILE 3 HG12 ILE 3 9.449 -0.127 -4.772
12 HG13 ILE 3 HG13 ILE 3 8.155 0.542 -3.785
13 HG21 ILE 3 HG21 ILE 3 11.875 -0.136 -3.684
14 HG22 ILE 3 HG22 ILE 3 11.657 -0.979 -2.151
15 HG23 ILE 3 HG23 ILE 3 10.815 -1.543 -3.595
16 HD11 ILE 3 HD11 ILE 3 10.238 2.454 -3.891
17 HD12 ILE 3 HD12 ILE 3 9.928 1.886 -5.532
18 HD13 ILE 3 HD13 ILE 3 8.612 2.553 -4.566
19 H ALA 4 H ALA 4 9.576 -2.711 -0.704
20 HA ALA 4 HA ALA 4 10.512 -1.786 1.854
21 HB1 ALA 4 HB1 ALA 4 10.989 -4.592 1.068
22 HB2 ALA 4 HB2 ALA 4 10.291 -3.926 2.545
23 HB3 ALA 4 HB3 ALA 4 9.309 -4.057 1.087
24 H LYS 5 H LYS 5 12.615 -2.666 2.737
25 HA LYS 5 HA LYS 5 14.755 -1.749 1.077
26 HB2 LYS 5 HB2 LYS 5 16.187 -2.409 3.017
27 HB3 LYS 5 HB3 LYS 5 14.877 -1.313 3.433
28 HG2 LYS 5 HG2 LYS 5 13.773 -3.813 3.814
29 HG3 LYS 5 HG3 LYS 5 15.434 -3.993 4.385
30 HD2 LYS 5 HD2 LYS 5 14.711 -1.576 5.449
31 HD3 LYS 5 HD3 LYS 5 13.200 -2.485 5.529
32 HE2 LYS 5 HE2 LYS 5 14.253 -2.963 7.556
33 HE3 LYS 5 HE3 LYS 5 14.615 -4.365 6.550
34 HZ1 LYS 5 HZ1 LYS 5 16.468 -2.070 6.827
35 HZ2 LYS 5 HZ2 LYS 5 16.798 -3.598 6.181
36 HZ3 LYS 5 HZ3 LYS 5 16.529 -3.422 7.842
37 H ASN 6 H ASN 6 14.114 -3.462 -0.599
38 HA ASN 6 HA ASN 6 16.161 -5.351 -0.796
39 HB2 ASN 6 HB2 ASN 6 14.820 -6.466 1.014
40 HB3 ASN 6 HB3 ASN 6 13.500 -6.630 -0.140
41 HD21 ASN 6 HD21 ASN 6 13.983 -8.922 0.622
42 HD22 ASN 6 HD22 ASN 6 15.078 -9.830 -0.359
43 H LYS 7 H LYS 7 13.006 -4.230 -1.727
44 HA LYS 7 HA LYS 7 13.079 -5.576 -4.295
45 HB2 LYS 7 HB2 LYS 7 11.131 -3.495 -3.289
46 HB3 LYS 7 HB3 LYS 7 10.923 -4.531 -4.694
47 HG2 LYS 7 HG2 LYS 7 11.416 -6.198 -2.457
48 HG3 LYS 7 HG3 LYS 7 10.183 -5.019 -2.001
49 HD2 LYS 7 HD2 LYS 7 8.771 -5.671 -3.790
50 HD3 LYS 7 HD3 LYS 7 10.057 -6.609 -4.555
51 HE2 LYS 7 HE2 LYS 7 10.012 -8.217 -2.761
52 HE3 LYS 7 HE3 LYS 7 8.855 -7.238 -1.861
53 HZ1 LYS 7 HZ1 LYS 7 7.182 -8.142 -2.975
54 HZ2 LYS 7 HZ2 LYS 7 8.276 -9.245 -3.646
55 HZ3 LYS 7 HZ3 LYS 7 7.897 -7.819 -4.474
56 H GLU 8 H GLU 8 13.221 -4.539 -6.305
57 HA GLU 8 HA GLU 8 15.147 -2.577 -6.586
58 HB2 GLU 8 HB2 GLU 8 14.674 -2.582 -8.871
59 HB3 GLU 8 HB3 GLU 8 14.138 -4.171 -8.345
60 HG2 GLU 8 HG2 GLU 8 11.827 -3.310 -8.220
61 HG3 GLU 8 HG3 GLU 8 12.399 -1.771 -8.859
62 H CYS 9 H CYS 9 15.063 -0.368 -7.182
63 HA CYS 9 HA CYS 9 12.549 1.056 -6.903
64 HB2 CYS 9 HB2 CYS 9 13.334 0.885 -4.583
65 HB3 CYS 9 HB3 CYS 9 14.879 1.590 -5.048
66 H ALA 10 H ALA 10 12.575 2.189 -8.732
67 HA ALA 10 HA ALA 10 15.040 3.177 -9.869
68 HB1 ALA 10 HB1 ALA 10 12.820 2.297 -11.034
69 HB2 ALA 10 HB2 ALA 10 12.420 4.014 -10.975
70 HB3 ALA 10 HB3 ALA 10 13.882 3.477 -11.802
71 H TRP 11 H TRP 11 15.616 5.328 -10.160
72 HA TRP 11 HA TRP 11 14.961 7.099 -8.070
73 HB2 TRP 11 HB2 TRP 11 16.533 7.299 -10.601
74 HB3 TRP 11 HB3 TRP 11 16.105 8.787 -9.761
75 HD1 TRP 11 HD1 TRP 11 16.697 5.996 -7.371
76 HE1 TRP 11 HE1 TRP 11 19.005 6.254 -6.262
77 HE3 TRP 11 HE3 TRP 11 18.650 9.624 -10.397
78 HZ2 TRP 11 HZ2 TRP 11 21.344 7.793 -6.622
79 HZ3 TRP 11 HZ3 TRP 11 20.929 10.435 -9.946
80 HH2 TRP 11 HH2 TRP 11 22.246 9.537 -8.097
81 H PHE 12 H PHE 12 13.334 6.367 -10.946
82 HA PHE 12 HA PHE 12 11.589 8.698 -10.568
83 HB2 PHE 12 HB2 PHE 12 13.268 8.687 -12.638
84 HB3 PHE 12 HB3 PHE 12 11.995 7.696 -13.344
85 HD1 PHE 12 HD2 PHE 12 12.661 10.975 -11.755
86 HD2 PHE 12 HD1 PHE 12 10.058 8.671 -14.211
87 HE1 PHE 12 HE2 PHE 12 11.399 13.010 -12.320
88 HE2 PHE 12 HE1 PHE 12 8.792 10.703 -14.781
89 HZ PHE 12 HZ PHE 12 9.461 12.876 -13.834
90 H SER 13 H SER 13 11.528 5.767 -9.874
91 HA SER 13 HA SER 13 9.709 4.383 -11.478
92 HB2 SER 13 HB2 SER 13 9.211 3.076 -9.379
93 HB3 SER 13 HB3 SER 13 10.924 3.196 -9.782
94 HG SER 13 HG SER 13 10.995 3.810 -7.747
95 H GLY 14 H GLY 14 9.233 7.016 -9.311
96 HA2 GLY 14 HA2 GLY 14 7.299 8.351 -9.253
97 HA3 GLY 14 HA3 GLY 14 6.391 7.028 -9.970
98 H GLU 15 H GLU 15 7.748 5.252 -7.851
99 HA GLU 15 HA GLU 15 5.750 5.800 -5.775
100 HB2 GLU 15 HB2 GLU 15 6.362 3.410 -5.064
101 HB3 GLU 15 HB3 GLU 15 5.455 3.611 -6.556
102 HG2 GLU 15 HG2 GLU 15 7.395 3.240 -7.880
103 HG3 GLU 15 HG3 GLU 15 8.443 3.303 -6.464
104 H TRP 16 H TRP 16 6.570 4.787 -3.552
105 HA TRP 16 HA TRP 16 9.293 5.772 -3.039
106 HB2 TRP 16 HB2 TRP 16 7.054 6.221 -1.078
107 HB3 TRP 16 HB3 TRP 16 8.631 7.002 -1.145
108 HD1 TRP 16 HD1 TRP 16 8.785 8.214 -3.936
109 HE1 TRP 16 HE1 TRP 16 7.136 10.017 -4.743
110 HE3 TRP 16 HE3 TRP 16 4.941 7.311 -0.688
111 HZ2 TRP 16 HZ2 TRP 16 4.548 10.936 -4.089
112 HZ3 TRP 16 HZ3 TRP 16 2.915 8.698 -0.845
113 HH2 TRP 16 HH2 TRP 16 2.724 10.473 -2.511
114 H CYS 17 H CYS 17 10.258 4.927 -1.059
115 HA CYS 17 HA CYS 17 9.656 2.127 -0.743
116 HB2 CYS 17 HB2 CYS 17 11.687 3.730 0.811
117 HB3 CYS 17 HB3 CYS 17 11.680 1.994 0.515
118 H CYS 18 H CYS 18 9.645 1.178 1.514
119 HA CYS 18 HA CYS 18 7.469 2.336 2.967
120 HB2 CYS 18 HB2 CYS 18 9.225 -0.008 3.725
121 HB3 CYS 18 HB3 CYS 18 7.653 0.385 4.414
122 H GLY 19 H GLY 19 7.629 2.452 5.439
123 HA2 GLY 19 HA2 GLY 19 8.421 3.645 7.235
124 HA3 GLY 19 HA3 GLY 19 9.975 2.933 6.825
125 H ALA 20 H ALA 20 11.560 4.239 6.151
126 HA ALA 20 HA ALA 20 10.943 6.791 4.907
127 HB1 ALA 20 HB1 ALA 20 11.286 8.078 6.679
128 HB2 ALA 20 HB2 ALA 20 11.460 6.636 7.679
129 HB3 ALA 20 HB3 ALA 20 12.878 7.359 6.920
130 H LEU 21 H LEU 21 12.297 4.269 4.187
131 HA LEU 21 HA LEU 21 15.099 5.020 3.967
132 HB2 LEU 21 HB2 LEU 21 13.844 2.609 2.706
133 HB3 LEU 21 HB3 LEU 21 15.510 2.840 3.232
134 HG LEU 21 HG LEU 21 13.459 2.917 5.355
135 HD11 LEU 21 HD11 LEU 21 14.258 0.194 4.569
136 HD12 LEU 21 HD12 LEU 21 13.061 0.974 3.536
137 HD13 LEU 21 HD13 LEU 21 12.746 0.782 5.260
138 HD21 LEU 21 HD21 LEU 21 15.684 1.103 5.663
139 HD22 LEU 21 HD22 LEU 21 15.243 2.517 6.620
140 HD23 LEU 21 HD23 LEU 21 16.227 2.706 5.168
141 H SER 22 H SER 22 16.201 4.997 1.893
142 HA SER 22 HA SER 22 14.461 5.985 -0.270
143 HB2 SER 22 HB2 SER 22 16.134 7.600 0.743
144 HB3 SER 22 HB3 SER 22 17.405 6.583 0.065
145 HG SER 22 HG SER 22 17.100 7.895 -1.578
146 H CYS 23 H CYS 23 16.180 5.915 -2.378
147 HA CYS 23 HA CYS 23 16.472 3.030 -2.800
148 HB2 CYS 23 HB2 CYS 23 16.607 5.184 -4.908
149 HB3 CYS 23 HB3 CYS 23 16.313 3.463 -5.136
150 H LYS 24 H LYS 24 18.422 2.175 -2.612
151 HA LYS 24 HA LYS 24 20.760 3.823 -3.323
152 HB2 LYS 24 HB2 LYS 24 20.694 1.639 -1.237
153 HB3 LYS 24 HB3 LYS 24 22.038 2.713 -1.599
154 HG2 LYS 24 HG2 LYS 24 21.175 3.675 0.295
155 HG3 LYS 24 HG3 LYS 24 20.350 4.592 -0.968
156 HD2 LYS 24 HD2 LYS 24 18.328 3.561 -0.582
157 HD3 LYS 24 HD3 LYS 24 19.076 2.110 0.089
158 HE2 LYS 24 HE2 LYS 24 17.947 3.392 1.827
159 HE3 LYS 24 HE3 LYS 24 19.688 3.356 2.102
160 HZ1 LYS 24 HZ1 LYS 24 19.101 5.594 0.534
161 HZ2 LYS 24 HZ2 LYS 24 19.688 5.555 2.120
162 HZ3 LYS 24 HZ3 LYS 24 18.020 5.590 1.835
163 H TYR 25 H TYR 25 22.556 2.723 -4.255
164 HA TYR 25 HA TYR 25 21.758 0.572 -5.998
165 HB2 TYR 25 HB2 TYR 25 23.172 2.363 -6.860
166 HB3 TYR 25 HB3 TYR 25 24.413 1.986 -5.671
167 HD1 TYR 25 HD2 TYR 25 25.753 -0.069 -5.885
168 HD2 TYR 25 HD1 TYR 25 22.914 1.046 -8.852
169 HE1 TYR 25 HE2 TYR 25 26.788 -1.649 -7.461
170 HE2 TYR 25 HE1 TYR 25 23.941 -0.532 -10.435
171 HH TYR 25 HH TYR 25 25.319 -2.476 -10.464
172 H SER 26 H SER 26 22.215 -1.536 -5.811
173 HA SER 26 HA SER 26 23.864 -2.369 -3.517
174 HB2 SER 26 HB2 SER 26 21.359 -3.443 -4.715
175 HB3 SER 26 HB3 SER 26 22.507 -4.611 -4.060
176 HG SER 26 HG SER 26 21.747 -4.100 -2.182
177 H ILE 27 H ILE 27 25.865 -2.613 -4.375
178 HA ILE 27 HA ILE 27 26.493 -3.526 -6.935
179 HB ILE 27 HB ILE 27 28.254 -4.019 -4.546
180 HG12 ILE 27 HG12 ILE 27 29.006 -1.564 -5.571
181 HG13 ILE 27 HG13 ILE 27 27.248 -1.480 -5.595
182 HG21 ILE 27 HG21 ILE 27 28.844 -3.328 -7.421
183 HG22 ILE 27 HG22 ILE 27 30.047 -3.576 -6.157
184 HG23 ILE 27 HG23 ILE 27 29.022 -4.915 -6.673
185 HD11 ILE 27 HD11 ILE 27 29.113 -1.518 -3.325
186 HD12 ILE 27 HD12 ILE 27 27.540 -0.740 -3.498
187 HD13 ILE 27 HD13 ILE 27 27.636 -2.461 -3.125
188 H LYS 28 H LYS 28 26.165 -5.310 -3.891
189 HA LYS 28 HA LYS 28 26.983 -7.820 -4.830
190 HB2 LYS 28 HB2 LYS 28 24.877 -7.364 -2.717
191 HB3 LYS 28 HB3 LYS 28 25.970 -8.733 -2.868
192 HG2 LYS 28 HG2 LYS 28 27.211 -7.682 -1.347
193 HG3 LYS 28 HG3 LYS 28 27.705 -6.628 -2.674
194 HD2 LYS 28 HD2 LYS 28 26.946 -4.975 -1.354
195 HD3 LYS 28 HD3 LYS 28 25.353 -5.483 -1.919
196 HE2 LYS 28 HE2 LYS 28 25.201 -7.004 0.033
197 HE3 LYS 28 HE3 LYS 28 26.740 -6.366 0.610
198 HZ1 LYS 28 HZ1 LYS 28 24.613 -4.451 0.015
199 HZ2 LYS 28 HZ2 LYS 28 25.808 -4.400 1.210
200 HZ3 LYS 28 HZ3 LYS 28 24.450 -5.388 1.414
201 H ARG 29 H ARG 29 23.840 -6.223 -4.887
202 HA ARG 29 HA ARG 29 22.601 -8.548 -6.133
203 HB2 ARG 29 HB2 ARG 29 21.489 -5.880 -5.255
204 HB3 ARG 29 HB3 ARG 29 20.531 -7.123 -6.050
205 HG2 ARG 29 HG2 ARG 29 21.776 -8.440 -3.944
206 HG3 ARG 29 HG3 ARG 29 21.298 -6.876 -3.282
207 HD2 ARG 29 HD2 ARG 29 19.016 -7.229 -4.016
208 HD3 ARG 29 HD3 ARG 29 19.474 -8.749 -4.784
209 HE ARG 29 HE ARG 29 20.062 -8.649 -1.972
210 HH11 ARG 29 HH11 ARG 29 17.639 -9.358 -4.369
211 HH12 ARG 29 HH12 ARG 29 16.747 -10.429 -3.340
212 HH21 ARG 29 HH21 ARG 29 18.896 -10.056 -0.607
213 HH22 ARG 29 HH22 ARG 29 17.462 -10.824 -1.199
214 H ASN 30 H ASN 30 24.555 -6.259 -7.239
215 HA ASN 30 HA ASN 30 24.828 -5.082 -9.189
216 HB2 ASN 30 HB2 ASN 30 24.527 -6.476 -11.195
217 HB3 ASN 30 HB3 ASN 30 25.287 -7.383 -9.891
218 HD21 ASN 30 HD21 ASN 30 24.505 -9.322 -9.528
219 HD22 ASN 30 HD22 ASN 30 22.921 -9.876 -9.940
220 H LEU 31 H LEU 31 22.403 -4.411 -7.847
221 HA LEU 31 HA LEU 31 20.952 -3.293 -10.095
222 HB2 LEU 31 HB2 LEU 31 19.621 -5.050 -8.041
223 HB3 LEU 31 HB3 LEU 31 18.758 -4.009 -9.171
224 HG LEU 31 HG LEU 31 20.584 -6.231 -10.063
225 HD11 LEU 31 HD11 LEU 31 18.995 -7.461 -8.936
226 HD12 LEU 31 HD12 LEU 31 18.281 -7.338 -10.543
227 HD13 LEU 31 HD13 LEU 31 17.713 -6.289 -9.244
228 HD21 LEU 31 HD21 LEU 31 19.471 -4.128 -11.441
229 HD22 LEU 31 HD22 LEU 31 18.330 -5.441 -11.729
230 HD23 LEU 31 HD23 LEU 31 20.033 -5.644 -12.145
231 H LYS 32 H LYS 32 18.805 -2.215 -8.823
232 HA LYS 32 HA LYS 32 19.989 -0.621 -6.646
233 HB2 LYS 32 HB2 LYS 32 18.292 0.301 -8.966
234 HB3 LYS 32 HB3 LYS 32 18.570 1.283 -7.533
235 HG2 LYS 32 HG2 LYS 32 20.212 2.098 -8.871
236 HG3 LYS 32 HG3 LYS 32 21.097 0.773 -8.110
237 HD2 LYS 32 HD2 LYS 32 21.532 0.679 -10.455
238 HD3 LYS 32 HD3 LYS 32 20.452 -0.661 -10.061
239 HE2 LYS 32 HE2 LYS 32 18.618 0.365 -11.060
240 HE3 LYS 32 HE3 LYS 32 19.352 1.967 -10.987
241 HZ1 LYS 32 HZ1 LYS 32 19.250 0.707 -13.226
242 HZ2 LYS 32 HZ2 LYS 32 20.592 -0.134 -12.633
243 HZ3 LYS 32 HZ3 LYS 32 20.660 1.547 -12.814
244 H ILE 33 H ILE 33 18.956 -1.071 -4.821
245 HA ILE 33 HA ILE 33 16.021 -1.257 -4.882
246 HB ILE 33 HB ILE 33 15.951 -3.094 -3.430
247 HG12 ILE 33 HG12 ILE 33 18.890 -2.585 -2.967
248 HG13 ILE 33 HG13 ILE 33 17.582 -2.494 -1.793
249 HG21 ILE 33 HG21 ILE 33 18.307 -3.768 -5.172
250 HG22 ILE 33 HG22 ILE 33 17.011 -4.833 -4.630
251 HG23 ILE 33 HG23 ILE 33 16.674 -3.563 -5.805
252 HD11 ILE 33 HD11 ILE 33 18.995 -4.862 -2.884
253 HD12 ILE 33 HD12 ILE 33 18.491 -4.501 -1.233
254 HD13 ILE 33 HD13 ILE 33 17.302 -5.033 -2.421
255 H CYS 34 H CYS 34 15.139 -1.119 -2.551
256 HA CYS 34 HA CYS 34 16.193 1.314 -1.406
257 HB2 CYS 34 HB2 CYS 34 13.778 -0.388 -0.806
258 HB3 CYS 34 HB3 CYS 34 14.217 1.001 0.183
259 H VAL 35 H VAL 35 16.620 1.557 0.892
260 HA VAL 35 HA VAL 35 17.272 -0.857 2.377
261 HB VAL 35 HB VAL 35 19.392 1.226 1.837
262 HG11 VAL 35 HG11 VAL 35 20.685 -0.920 2.841
263 HG12 VAL 35 HG12 VAL 35 20.114 0.432 3.820
264 HG13 VAL 35 HG13 VAL 35 19.151 -1.041 3.702
265 HG21 VAL 35 HG21 VAL 35 20.535 -0.540 0.566
266 HG22 VAL 35 HG22 VAL 35 19.134 -1.590 0.780
267 HG23 VAL 35 HG23 VAL 35 18.987 -0.104 -0.158
Start of MODEL 16
1 H1 GLY 1 H GLY 1 1.598 0.105 -3.704
2 HA2 GLY 1 HA2 GLY 1 1.773 -0.624 -1.046
3 HA3 GLY 1 HA3 GLY 1 2.658 -1.858 -1.929
4 H CYS 2 H CYS 2 4.584 -1.204 -0.868
5 HA CYS 2 HA CYS 2 5.803 1.157 -2.113
6 HB2 CYS 2 HB2 CYS 2 6.940 1.659 0.062
7 HB3 CYS 2 HB3 CYS 2 5.198 1.918 0.086
8 H ILE 3 H ILE 3 8.228 1.138 -1.822
9 HA ILE 3 HA ILE 3 9.189 -1.539 -2.436
10 HB ILE 3 HB ILE 3 10.774 1.025 -2.500
11 HG12 ILE 3 HG12 ILE 3 10.088 0.250 -5.118
12 HG13 ILE 3 HG13 ILE 3 8.594 0.175 -4.190
13 HG21 ILE 3 HG21 ILE 3 12.300 -0.142 -3.876
14 HG22 ILE 3 HG22 ILE 3 11.947 -1.212 -2.520
15 HG23 ILE 3 HG23 ILE 3 11.188 -1.495 -4.087
16 HD11 ILE 3 HD11 ILE 3 9.296 2.375 -5.380
17 HD12 ILE 3 HD12 ILE 3 8.594 2.430 -3.763
18 HD13 ILE 3 HD13 ILE 3 10.338 2.580 -3.972
19 H ALA 4 H ALA 4 9.859 -2.775 -0.816
20 HA ALA 4 HA ALA 4 10.732 -1.670 1.692
21 HB1 ALA 4 HB1 ALA 4 9.631 -4.087 0.876
22 HB2 ALA 4 HB2 ALA 4 11.271 -4.492 1.385
23 HB3 ALA 4 HB3 ALA 4 10.181 -3.668 2.499
24 H LYS 5 H LYS 5 12.768 -2.834 2.683
25 HA LYS 5 HA LYS 5 15.009 -1.920 1.152
26 HB2 LYS 5 HB2 LYS 5 14.958 -1.668 3.583
27 HB3 LYS 5 HB3 LYS 5 14.890 -3.414 3.779
28 HG2 LYS 5 HG2 LYS 5 17.150 -2.751 2.170
29 HG3 LYS 5 HG3 LYS 5 17.165 -1.762 3.632
30 HD2 LYS 5 HD2 LYS 5 16.554 -4.651 3.933
31 HD3 LYS 5 HD3 LYS 5 18.219 -4.204 3.554
32 HE2 LYS 5 HE2 LYS 5 18.444 -2.946 5.518
33 HE3 LYS 5 HE3 LYS 5 16.702 -2.876 5.777
34 HZ1 LYS 5 HZ1 LYS 5 17.915 -4.438 7.263
35 HZ2 LYS 5 HZ2 LYS 5 18.278 -5.385 5.910
36 HZ3 LYS 5 HZ3 LYS 5 16.668 -5.159 6.376
37 H ASN 6 H ASN 6 14.360 -3.500 -0.640
38 HA ASN 6 HA ASN 6 16.319 -5.431 -0.944
39 HB2 ASN 6 HB2 ASN 6 15.401 -6.864 0.664
40 HB3 ASN 6 HB3 ASN 6 13.746 -6.480 0.199
41 HD21 ASN 6 HD21 ASN 6 12.911 -8.365 -0.390
42 HD22 ASN 6 HD22 ASN 6 13.581 -9.430 -1.574
43 H LYS 7 H LYS 7 13.175 -4.213 -1.745
44 HA LYS 7 HA LYS 7 13.110 -5.502 -4.340
45 HB2 LYS 7 HB2 LYS 7 11.291 -3.364 -3.220
46 HB3 LYS 7 HB3 LYS 7 10.994 -4.343 -4.650
47 HG2 LYS 7 HG2 LYS 7 11.483 -6.083 -2.454
48 HG3 LYS 7 HG3 LYS 7 10.282 -4.882 -1.972
49 HD2 LYS 7 HD2 LYS 7 9.134 -5.420 -4.201
50 HD3 LYS 7 HD3 LYS 7 10.170 -6.848 -4.241
51 HE2 LYS 7 HE2 LYS 7 9.284 -7.482 -2.009
52 HE3 LYS 7 HE3 LYS 7 8.172 -6.117 -2.102
53 HZ1 LYS 7 HZ1 LYS 7 7.844 -8.686 -3.152
54 HZ2 LYS 7 HZ2 LYS 7 7.940 -7.615 -4.457
55 HZ3 LYS 7 HZ3 LYS 7 6.780 -7.373 -3.250
56 H GLU 8 H GLU 8 13.318 -4.474 -6.326
57 HA GLU 8 HA GLU 8 15.278 -2.540 -6.594
58 HB2 GLU 8 HB2 GLU 8 14.763 -2.481 -8.898
59 HB3 GLU 8 HB3 GLU 8 14.363 -4.110 -8.372
60 HG2 GLU 8 HG2 GLU 8 11.990 -3.405 -8.187
61 HG3 GLU 8 HG3 GLU 8 12.445 -1.849 -8.879
62 H CYS 9 H CYS 9 15.133 -0.344 -7.435
63 HA CYS 9 HA CYS 9 12.646 1.086 -6.983
64 HB2 CYS 9 HB2 CYS 9 13.617 2.679 -5.412
65 HB3 CYS 9 HB3 CYS 9 13.710 1.048 -4.756
66 H ALA 10 H ALA 10 12.456 2.874 -8.237
67 HA ALA 10 HA ALA 10 14.810 3.617 -9.850
68 HB1 ALA 10 HB1 ALA 10 12.116 2.897 -10.617
69 HB2 ALA 10 HB2 ALA 10 12.572 4.482 -11.244
70 HB3 ALA 10 HB3 ALA 10 13.564 3.070 -11.610
71 H TRP 11 H TRP 11 15.264 5.769 -10.172
72 HA TRP 11 HA TRP 11 14.522 7.581 -8.159
73 HB2 TRP 11 HB2 TRP 11 15.976 7.824 -10.767
74 HB3 TRP 11 HB3 TRP 11 15.519 9.284 -9.894
75 HD1 TRP 11 HD1 TRP 11 16.386 6.495 -7.577
76 HE1 TRP 11 HE1 TRP 11 18.730 6.871 -6.582
77 HE3 TRP 11 HE3 TRP 11 17.968 10.278 -10.632
78 HZ2 TRP 11 HZ2 TRP 11 20.954 8.550 -7.032
79 HZ3 TRP 11 HZ3 TRP 11 20.217 11.213 -10.282
80 HH2 TRP 11 HH2 TRP 11 21.677 10.366 -8.519
81 H PHE 12 H PHE 12 12.914 6.649 -11.005
82 HA PHE 12 HA PHE 12 11.012 8.864 -10.659
83 HB2 PHE 12 HB2 PHE 12 12.634 8.852 -12.778
84 HB3 PHE 12 HB3 PHE 12 11.401 7.758 -13.396
85 HD1 PHE 12 HD2 PHE 12 11.898 11.135 -11.950
86 HD2 PHE 12 HD1 PHE 12 9.408 8.584 -14.276
87 HE1 PHE 12 HE2 PHE 12 10.502 13.065 -12.567
88 HE2 PHE 12 HE1 PHE 12 8.009 10.510 -14.897
89 HZ PHE 12 HZ PHE 12 8.554 12.754 -14.041
90 H SER 13 H SER 13 11.152 5.980 -9.816
91 HA SER 13 HA SER 13 9.386 4.405 -11.303
92 HB2 SER 13 HB2 SER 13 9.368 2.935 -9.484
93 HB3 SER 13 HB3 SER 13 10.902 3.780 -9.285
94 HG SER 13 HG SER 13 10.183 4.664 -7.510
95 H GLY 14 H GLY 14 8.801 7.132 -9.308
96 HA2 GLY 14 HA2 GLY 14 6.775 8.329 -9.275
97 HA3 GLY 14 HA3 GLY 14 5.938 6.883 -9.823
98 H GLU 15 H GLU 15 7.348 5.281 -7.711
99 HA GLU 15 HA GLU 15 5.566 6.046 -5.504
100 HB2 GLU 15 HB2 GLU 15 6.015 3.651 -4.744
101 HB3 GLU 15 HB3 GLU 15 5.043 3.858 -6.194
102 HG2 GLU 15 HG2 GLU 15 6.724 3.107 -7.590
103 HG3 GLU 15 HG3 GLU 15 7.992 3.446 -6.412
104 H TRP 16 H TRP 16 6.560 4.919 -3.350
105 HA TRP 16 HA TRP 16 9.357 5.798 -3.118
106 HB2 TRP 16 HB2 TRP 16 7.344 6.323 -0.941
107 HB3 TRP 16 HB3 TRP 16 8.944 7.029 -1.149
108 HD1 TRP 16 HD1 TRP 16 8.873 8.239 -3.960
109 HE1 TRP 16 HE1 TRP 16 7.254 10.140 -4.583
110 HE3 TRP 16 HE3 TRP 16 5.363 7.546 -0.308
111 HZ2 TRP 16 HZ2 TRP 16 4.812 11.206 -3.650
112 HZ3 TRP 16 HZ3 TRP 16 3.416 9.049 -0.244
113 HH2 TRP 16 HH2 TRP 16 3.148 10.841 -1.881
114 H CYS 17 H CYS 17 10.485 4.902 -1.247
115 HA CYS 17 HA CYS 17 9.939 2.119 -0.948
116 HB2 CYS 17 HB2 CYS 17 11.887 3.725 0.702
117 HB3 CYS 17 HB3 CYS 17 11.960 2.012 0.302
118 H CYS 18 H CYS 18 9.837 1.046 1.203
119 HA CYS 18 HA CYS 18 7.653 2.102 2.705
120 HB2 CYS 18 HB2 CYS 18 9.436 -0.271 3.293
121 HB3 CYS 18 HB3 CYS 18 7.902 0.080 4.082
122 H GLY 19 H GLY 19 7.812 2.019 5.204
123 HA2 GLY 19 HA2 GLY 19 8.571 3.102 7.082
124 HA3 GLY 19 HA3 GLY 19 10.152 2.500 6.606
125 H ALA 20 H ALA 20 11.664 3.927 6.012
126 HA ALA 20 HA ALA 20 10.919 6.527 4.961
127 HB1 ALA 20 HB1 ALA 20 11.550 6.167 7.730
128 HB2 ALA 20 HB2 ALA 20 12.790 7.159 6.961
129 HB3 ALA 20 HB3 ALA 20 11.095 7.639 6.872
130 H LEU 21 H LEU 21 12.393 4.153 4.051
131 HA LEU 21 HA LEU 21 15.156 5.063 3.908
132 HB2 LEU 21 HB2 LEU 21 14.013 2.663 2.518
133 HB3 LEU 21 HB3 LEU 21 15.681 2.962 3.000
134 HG LEU 21 HG LEU 21 13.611 2.724 5.129
135 HD11 LEU 21 HD11 LEU 21 13.491 0.416 5.073
136 HD12 LEU 21 HD12 LEU 21 14.908 0.262 4.035
137 HD13 LEU 21 HD13 LEU 21 13.383 0.842 3.365
138 HD21 LEU 21 HD21 LEU 21 16.323 3.087 5.107
139 HD22 LEU 21 HD22 LEU 21 16.178 1.347 5.357
140 HD23 LEU 21 HD23 LEU 21 15.386 2.467 6.466
141 H SER 22 H SER 22 16.257 5.153 1.806
142 HA SER 22 HA SER 22 14.473 6.246 -0.267
143 HB2 SER 22 HB2 SER 22 16.145 7.814 0.822
144 HB3 SER 22 HB3 SER 22 17.414 6.860 0.055
145 HG SER 22 HG SER 22 15.365 8.363 -1.197
146 H CYS 23 H CYS 23 16.179 6.331 -2.395
147 HA CYS 23 HA CYS 23 16.502 3.479 -2.994
148 HB2 CYS 23 HB2 CYS 23 15.039 4.871 -4.464
149 HB3 CYS 23 HB3 CYS 23 16.454 5.820 -4.909
150 H LYS 24 H LYS 24 18.452 2.602 -3.162
151 HA LYS 24 HA LYS 24 20.730 4.261 -3.944
152 HB2 LYS 24 HB2 LYS 24 21.043 2.378 -1.630
153 HB3 LYS 24 HB3 LYS 24 22.059 3.735 -2.097
154 HG2 LYS 24 HG2 LYS 24 21.021 4.629 -0.283
155 HG3 LYS 24 HG3 LYS 24 19.885 5.115 -1.544
156 HD2 LYS 24 HD2 LYS 24 18.328 3.502 -0.938
157 HD3 LYS 24 HD3 LYS 24 19.532 2.508 -0.114
158 HE2 LYS 24 HE2 LYS 24 18.601 5.216 0.832
159 HE3 LYS 24 HE3 LYS 24 17.975 3.679 1.427
160 HZ1 LYS 24 HZ1 LYS 24 19.682 3.512 2.807
161 HZ2 LYS 24 HZ2 LYS 24 20.189 5.058 2.346
162 HZ3 LYS 24 HZ3 LYS 24 20.800 3.696 1.550
163 H TYR 25 H TYR 25 22.629 2.974 -4.547
164 HA TYR 25 HA TYR 25 21.825 0.645 -6.044
165 HB2 TYR 25 HB2 TYR 25 23.353 2.264 -7.048
166 HB3 TYR 25 HB3 TYR 25 24.522 1.987 -5.762
167 HD1 TYR 25 HD2 TYR 25 25.800 -0.104 -5.674
168 HD2 TYR 25 HD1 TYR 25 23.094 0.694 -8.858
169 HE1 TYR 25 HE2 TYR 25 26.828 -1.909 -6.991
170 HE2 TYR 25 HE1 TYR 25 24.113 -1.109 -10.185
171 HH TYR 25 HH TYR 25 26.810 -3.035 -8.899
172 H SER 26 H SER 26 22.282 -1.446 -5.629
173 HA SER 26 HA SER 26 23.766 -2.025 -3.150
174 HB2 SER 26 HB2 SER 26 21.255 -3.146 -4.287
175 HB3 SER 26 HB3 SER 26 22.328 -4.264 -3.444
176 HG SER 26 HG SER 26 22.296 -2.511 -1.747
177 H ILE 27 H ILE 27 25.781 -2.457 -3.898
178 HA ILE 27 HA ILE 27 26.461 -3.714 -6.287
179 HB ILE 27 HB ILE 27 28.093 -4.003 -3.776
180 HG12 ILE 27 HG12 ILE 27 29.022 -1.731 -5.048
181 HG13 ILE 27 HG13 ILE 27 27.274 -1.563 -5.167
182 HG21 ILE 27 HG21 ILE 27 29.040 -3.492 -6.579
183 HG22 ILE 27 HG22 ILE 27 29.949 -4.122 -5.206
184 HG23 ILE 27 HG23 ILE 27 28.717 -5.119 -5.980
185 HD11 ILE 27 HD11 ILE 27 27.496 -2.250 -2.583
186 HD12 ILE 27 HD12 ILE 27 29.036 -1.422 -2.820
187 HD13 ILE 27 HD13 ILE 27 27.522 -0.585 -3.163
188 H LYS 28 H LYS 28 25.904 -5.101 -3.075
189 HA LYS 28 HA LYS 28 26.639 -7.735 -3.625
190 HB2 LYS 28 HB2 LYS 28 25.075 -8.325 -1.748
191 HB3 LYS 28 HB3 LYS 28 26.258 -7.083 -1.359
192 HG2 LYS 28 HG2 LYS 28 24.603 -5.790 -0.670
193 HG3 LYS 28 HG3 LYS 28 24.002 -5.728 -2.329
194 HD2 LYS 28 HD2 LYS 28 22.204 -6.468 -0.952
195 HD3 LYS 28 HD3 LYS 28 22.777 -7.869 -1.860
196 HE2 LYS 28 HE2 LYS 28 23.544 -8.920 -0.010
197 HE3 LYS 28 HE3 LYS 28 24.050 -7.418 0.763
198 HZ1 LYS 28 HZ1 LYS 28 22.270 -8.236 2.031
199 HZ2 LYS 28 HZ2 LYS 28 21.333 -8.590 0.669
200 HZ3 LYS 28 HZ3 LYS 28 21.607 -6.981 1.111
201 H ARG 29 H ARG 29 23.619 -6.027 -4.215
202 HA ARG 29 HA ARG 29 22.396 -8.451 -5.293
203 HB2 ARG 29 HB2 ARG 29 21.325 -5.698 -4.692
204 HB3 ARG 29 HB3 ARG 29 20.391 -6.901 -5.571
205 HG2 ARG 29 HG2 ARG 29 21.321 -8.208 -3.284
206 HG3 ARG 29 HG3 ARG 29 20.800 -6.611 -2.744
207 HD2 ARG 29 HD2 ARG 29 18.616 -6.967 -3.356
208 HD3 ARG 29 HD3 ARG 29 19.046 -8.137 -4.604
209 HE ARG 29 HE ARG 29 18.538 -8.672 -1.821
210 HH11 ARG 29 HH11 ARG 29 20.070 -9.800 -4.736
211 HH12 ARG 29 HH12 ARG 29 20.073 -11.462 -4.246
212 HH21 ARG 29 HH21 ARG 29 18.535 -10.857 -1.165
213 HH22 ARG 29 HH22 ARG 29 19.199 -12.062 -2.216
214 H ASN 30 H ASN 30 24.517 -6.356 -6.448
215 HA ASN 30 HA ASN 30 25.002 -5.397 -8.474
216 HB2 ASN 30 HB2 ASN 30 24.812 -6.958 -10.348
217 HB3 ASN 30 HB3 ASN 30 25.357 -7.798 -8.899
218 HD21 ASN 30 HD21 ASN 30 22.853 -7.448 -11.231
219 HD22 ASN 30 HD22 ASN 30 21.874 -8.769 -10.697
220 H LEU 31 H LEU 31 22.476 -4.547 -7.378
221 HA LEU 31 HA LEU 31 21.301 -3.508 -9.814
222 HB2 LEU 31 HB2 LEU 31 19.682 -5.096 -7.828
223 HB3 LEU 31 HB3 LEU 31 19.004 -4.118 -9.129
224 HG LEU 31 HG LEU 31 20.832 -6.465 -9.606
225 HD11 LEU 31 HD11 LEU 31 19.072 -7.603 -8.712
226 HD12 LEU 31 HD12 LEU 31 18.495 -7.431 -10.369
227 HD13 LEU 31 HD13 LEU 31 17.906 -6.343 -9.113
228 HD21 LEU 31 HD21 LEU 31 20.188 -4.463 -11.289
229 HD22 LEU 31 HD22 LEU 31 18.845 -5.566 -11.589
230 HD23 LEU 31 HD23 LEU 31 20.506 -6.117 -11.810
231 H LYS 32 H LYS 32 19.075 -2.299 -8.834
232 HA LYS 32 HA LYS 32 20.134 -0.571 -6.693
233 HB2 LYS 32 HB2 LYS 32 18.461 0.116 -9.108
234 HB3 LYS 32 HB3 LYS 32 18.654 1.209 -7.743
235 HG2 LYS 32 HG2 LYS 32 20.304 1.998 -9.086
236 HG3 LYS 32 HG3 LYS 32 21.218 0.766 -8.212
237 HD2 LYS 32 HD2 LYS 32 21.777 0.395 -10.448
238 HD3 LYS 32 HD3 LYS 32 20.528 -0.810 -10.122
239 HE2 LYS 32 HE2 LYS 32 19.162 1.482 -10.959
240 HE3 LYS 32 HE3 LYS 32 20.549 1.344 -12.038
241 HZ1 LYS 32 HZ1 LYS 32 18.175 -0.099 -12.125
242 HZ2 LYS 32 HZ2 LYS 32 19.384 -1.194 -11.678
243 HZ3 LYS 32 HZ3 LYS 32 19.542 -0.296 -13.103
244 H ILE 33 H ILE 33 19.092 -0.942 -4.854
245 HA ILE 33 HA ILE 33 16.163 -1.163 -4.928
246 HB ILE 33 HB ILE 33 16.085 -2.951 -3.410
247 HG12 ILE 33 HG12 ILE 33 18.989 -2.334 -2.929
248 HG13 ILE 33 HG13 ILE 33 17.673 -2.416 -1.763
249 HG21 ILE 33 HG21 ILE 33 17.045 -4.718 -4.597
250 HG22 ILE 33 HG22 ILE 33 16.864 -3.443 -5.801
251 HG23 ILE 33 HG23 ILE 33 18.442 -3.756 -5.080
252 HD11 ILE 33 HD11 ILE 33 17.589 -4.919 -2.416
253 HD12 ILE 33 HD12 ILE 33 19.218 -4.629 -3.029
254 HD13 ILE 33 HD13 ILE 33 18.851 -4.342 -1.328
255 H CYS 34 H CYS 34 15.284 -0.976 -2.586
256 HA CYS 34 HA CYS 34 16.285 1.513 -1.533
257 HB2 CYS 34 HB2 CYS 34 13.962 -0.260 -0.775
258 HB3 CYS 34 HB3 CYS 34 14.360 1.217 0.097
259 H VAL 35 H VAL 35 16.940 1.877 0.634
260 HA VAL 35 HA VAL 35 17.651 -0.463 2.231
261 HB VAL 35 HB VAL 35 19.715 1.654 1.639
262 HG11 VAL 35 HG11 VAL 35 20.359 0.677 3.614
263 HG12 VAL 35 HG12 VAL 35 19.641 -0.882 3.205
264 HG13 VAL 35 HG13 VAL 35 21.155 -0.382 2.450
265 HG21 VAL 35 HG21 VAL 35 19.219 0.473 -0.431
266 HG22 VAL 35 HG22 VAL 35 20.807 0.009 0.180
267 HG23 VAL 35 HG23 VAL 35 19.432 -1.076 0.384
Start of MODEL 17
1 H1 GLY 1 H GLY 1 2.000 -2.717 -3.027
2 HA2 GLY 1 HA2 GLY 1 1.147 -0.508 -1.393
3 HA3 GLY 1 HA3 GLY 1 2.203 -1.824 -0.902
4 H CYS 2 H CYS 2 4.282 -1.368 -0.585
5 HA CYS 2 HA CYS 2 5.430 0.984 -1.922
6 HB2 CYS 2 HB2 CYS 2 6.639 1.504 0.218
7 HB3 CYS 2 HB3 CYS 2 4.899 1.762 0.282
8 H ILE 3 H ILE 3 7.859 1.009 -1.728
9 HA ILE 3 HA ILE 3 8.848 -1.656 -2.349
10 HB ILE 3 HB ILE 3 10.312 0.978 -2.524
11 HG12 ILE 3 HG12 ILE 3 9.633 -0.108 -5.077
12 HG13 ILE 3 HG13 ILE 3 8.167 -0.017 -4.108
13 HG21 ILE 3 HG21 ILE 3 11.665 -1.138 -2.408
14 HG22 ILE 3 HG22 ILE 3 10.913 -1.613 -3.930
15 HG23 ILE 3 HG23 ILE 3 11.914 -0.163 -3.856
16 HD11 ILE 3 HD11 ILE 3 9.945 2.353 -4.156
17 HD12 ILE 3 HD12 ILE 3 8.986 1.996 -5.592
18 HD13 ILE 3 HD13 ILE 3 8.189 2.252 -4.040
19 H ALA 4 H ALA 4 9.632 -2.867 -0.764
20 HA ALA 4 HA ALA 4 10.537 -1.742 1.720
21 HB1 ALA 4 HB1 ALA 4 9.319 -3.849 1.689
22 HB2 ALA 4 HB2 ALA 4 10.603 -4.591 0.733
23 HB3 ALA 4 HB3 ALA 4 10.925 -4.065 2.385
24 H LYS 5 H LYS 5 12.655 -2.570 2.672
25 HA LYS 5 HA LYS 5 14.788 -1.668 0.998
26 HB2 LYS 5 HB2 LYS 5 16.221 -2.234 2.962
27 HB3 LYS 5 HB3 LYS 5 14.878 -1.166 3.347
28 HG2 LYS 5 HG2 LYS 5 13.831 -2.713 4.635
29 HG3 LYS 5 HG3 LYS 5 14.437 -4.074 3.688
30 HD2 LYS 5 HD2 LYS 5 15.705 -4.357 5.558
31 HD3 LYS 5 HD3 LYS 5 16.753 -3.232 4.690
32 HE2 LYS 5 HE2 LYS 5 16.565 -1.745 6.328
33 HE3 LYS 5 HE3 LYS 5 14.809 -1.752 6.172
34 HZ1 LYS 5 HZ1 LYS 5 15.445 -2.364 8.397
35 HZ2 LYS 5 HZ2 LYS 5 16.432 -3.612 7.823
36 HZ3 LYS 5 HZ3 LYS 5 14.754 -3.704 7.630
37 H ASN 6 H ASN 6 14.207 -3.431 -0.637
38 HA ASN 6 HA ASN 6 16.284 -5.284 -0.772
39 HB2 ASN 6 HB2 ASN 6 15.056 -6.422 1.052
40 HB3 ASN 6 HB3 ASN 6 13.645 -6.545 0.005
41 HD21 ASN 6 HD21 ASN 6 14.042 -8.852 0.648
42 HD22 ASN 6 HD22 ASN 6 15.060 -9.787 -0.388
43 H LYS 7 H LYS 7 13.101 -4.274 -1.735
44 HA LYS 7 HA LYS 7 13.212 -5.691 -4.263
45 HB2 LYS 7 HB2 LYS 7 11.211 -3.655 -3.266
46 HB3 LYS 7 HB3 LYS 7 11.035 -4.659 -4.699
47 HG2 LYS 7 HG2 LYS 7 11.553 -6.370 -2.501
48 HG3 LYS 7 HG3 LYS 7 10.288 -5.234 -2.026
49 HD2 LYS 7 HD2 LYS 7 8.875 -5.906 -3.772
50 HD3 LYS 7 HD3 LYS 7 10.190 -6.689 -4.652
51 HE2 LYS 7 HE2 LYS 7 10.263 -8.098 -2.364
52 HE3 LYS 7 HE3 LYS 7 8.552 -7.675 -2.398
53 HZ1 LYS 7 HZ1 LYS 7 9.106 -9.808 -3.508
54 HZ2 LYS 7 HZ2 LYS 7 9.980 -8.943 -4.668
55 HZ3 LYS 7 HZ3 LYS 7 8.313 -8.703 -4.515
56 H GLU 8 H GLU 8 13.337 -4.712 -6.301
57 HA GLU 8 HA GLU 8 15.205 -2.698 -6.630
58 HB2 GLU 8 HB2 GLU 8 14.725 -2.766 -8.926
59 HB3 GLU 8 HB3 GLU 8 14.314 -4.375 -8.350
60 HG2 GLU 8 HG2 GLU 8 11.939 -3.656 -8.221
61 HG3 GLU 8 HG3 GLU 8 12.411 -2.130 -8.967
62 H CYS 9 H CYS 9 15.012 -0.523 -7.410
63 HA CYS 9 HA CYS 9 12.450 0.810 -7.106
64 HB2 CYS 9 HB2 CYS 9 13.291 2.449 -5.491
65 HB3 CYS 9 HB3 CYS 9 13.352 0.823 -4.821
66 H ALA 10 H ALA 10 12.285 2.662 -8.299
67 HA ALA 10 HA ALA 10 14.682 3.439 -9.830
68 HB1 ALA 10 HB1 ALA 10 12.018 4.081 -10.933
69 HB2 ALA 10 HB2 ALA 10 13.488 3.543 -11.747
70 HB3 ALA 10 HB3 ALA 10 12.468 2.376 -10.904
71 H TRP 11 H TRP 11 15.125 5.605 -10.122
72 HA TRP 11 HA TRP 11 14.332 7.374 -8.084
73 HB2 TRP 11 HB2 TRP 11 15.874 7.655 -10.634
74 HB3 TRP 11 HB3 TRP 11 15.375 9.107 -9.771
75 HD1 TRP 11 HD1 TRP 11 16.177 6.298 -7.450
76 HE1 TRP 11 HE1 TRP 11 18.475 6.687 -6.358
77 HE3 TRP 11 HE3 TRP 11 17.834 10.136 -10.393
78 HZ2 TRP 11 HZ2 TRP 11 20.697 8.395 -6.700
79 HZ3 TRP 11 HZ3 TRP 11 20.056 11.091 -9.944
80 HH2 TRP 11 HH2 TRP 11 21.456 10.238 -8.135
81 H PHE 12 H PHE 12 12.794 6.484 -10.975
82 HA PHE 12 HA PHE 12 10.896 8.706 -10.659
83 HB2 PHE 12 HB2 PHE 12 12.567 8.702 -12.738
84 HB3 PHE 12 HB3 PHE 12 11.347 7.616 -13.393
85 HD1 PHE 12 HD1 PHE 12 11.825 10.984 -11.922
86 HD2 PHE 12 HD2 PHE 12 9.371 8.453 -14.307
87 HE1 PHE 12 HE1 PHE 12 10.450 12.923 -12.559
88 HE2 PHE 12 HE2 PHE 12 7.993 10.387 -14.949
89 HZ PHE 12 HZ PHE 12 8.532 12.626 -14.075
90 H SER 13 H SER 13 10.977 5.840 -9.802
91 HA SER 13 HA SER 13 9.218 4.299 -11.362
92 HB2 SER 13 HB2 SER 13 8.868 2.998 -9.233
93 HB3 SER 13 HB3 SER 13 10.558 3.215 -9.688
94 HG SER 13 HG SER 13 10.238 3.654 -7.479
95 H GLY 14 H GLY 14 8.657 7.028 -9.411
96 HA2 GLY 14 HA2 GLY 14 6.622 8.212 -9.364
97 HA3 GLY 14 HA3 GLY 14 5.781 6.742 -9.831
98 H GLU 15 H GLU 15 7.102 5.132 -7.765
99 HA GLU 15 HA GLU 15 5.494 6.060 -5.490
100 HB2 GLU 15 HB2 GLU 15 5.803 3.647 -4.713
101 HB3 GLU 15 HB3 GLU 15 4.780 3.908 -6.119
102 HG2 GLU 15 HG2 GLU 15 7.547 3.481 -6.856
103 HG3 GLU 15 HG3 GLU 15 6.893 2.142 -5.915
104 H TRP 16 H TRP 16 6.457 5.030 -3.336
105 HA TRP 16 HA TRP 16 9.326 5.692 -3.247
106 HB2 TRP 16 HB2 TRP 16 7.179 6.469 -1.264
107 HB3 TRP 16 HB3 TRP 16 8.907 6.653 -0.973
108 HD1 TRP 16 HD1 TRP 16 6.622 7.682 -3.954
109 HE1 TRP 16 HE1 TRP 16 7.148 10.135 -4.531
110 HE3 TRP 16 HE3 TRP 16 10.165 8.613 -0.388
111 HZ2 TRP 16 HZ2 TRP 16 8.841 12.192 -3.598
112 HZ3 TRP 16 HZ3 TRP 16 11.189 10.848 -0.299
113 HH2 TRP 16 HH2 TRP 16 10.540 12.599 -1.872
114 H CYS 17 H CYS 17 10.309 4.909 -1.096
115 HA CYS 17 HA CYS 17 9.772 2.083 -0.912
116 HB2 CYS 17 HB2 CYS 17 11.726 3.675 0.750
117 HB3 CYS 17 HB3 CYS 17 11.765 1.950 0.400
118 H CYS 18 H CYS 18 9.673 1.023 1.269
119 HA CYS 18 HA CYS 18 7.454 2.079 2.721
120 HB2 CYS 18 HB2 CYS 18 9.245 -0.268 3.385
121 HB3 CYS 18 HB3 CYS 18 7.681 0.075 4.116
122 H GLY 19 H GLY 19 7.578 2.020 5.225
123 HA2 GLY 19 HA2 GLY 19 8.288 3.159 7.091
124 HA3 GLY 19 HA3 GLY 19 9.874 2.525 6.673
125 H ALA 20 H ALA 20 11.421 3.931 6.140
126 HA ALA 20 HA ALA 20 10.746 6.509 4.985
127 HB1 ALA 20 HB1 ALA 20 11.809 6.178 7.755
128 HB2 ALA 20 HB2 ALA 20 12.285 7.580 6.797
129 HB3 ALA 20 HB3 ALA 20 10.581 7.289 7.147
130 H LEU 21 H LEU 21 12.146 4.230 3.997
131 HA LEU 21 HA LEU 21 14.951 5.071 3.993
132 HB2 LEU 21 HB2 LEU 21 13.854 2.639 2.625
133 HB3 LEU 21 HB3 LEU 21 15.500 2.945 3.174
134 HG LEU 21 HG LEU 21 13.444 2.847 5.287
135 HD11 LEU 21 HD11 LEU 21 13.387 0.861 3.320
136 HD12 LEU 21 HD12 LEU 21 12.643 0.813 4.918
137 HD13 LEU 21 HD13 LEU 21 14.264 0.162 4.681
138 HD21 LEU 21 HD21 LEU 21 16.185 2.835 5.159
139 HD22 LEU 21 HD22 LEU 21 15.802 1.137 5.443
140 HD23 LEU 21 HD23 LEU 21 15.218 2.372 6.560
141 H SER 22 H SER 22 16.110 5.112 1.924
142 HA SER 22 HA SER 22 14.387 6.159 -0.223
143 HB2 SER 22 HB2 SER 22 17.044 6.982 0.829
144 HB3 SER 22 HB3 SER 22 16.795 7.124 -0.911
145 HG SER 22 HG SER 22 16.066 8.851 0.841
146 H CYS 23 H CYS 23 16.003 6.142 -2.355
147 HA CYS 23 HA CYS 23 16.390 3.279 -2.834
148 HB2 CYS 23 HB2 CYS 23 14.890 4.579 -4.346
149 HB3 CYS 23 HB3 CYS 23 16.280 5.541 -4.839
150 H LYS 24 H LYS 24 18.354 2.430 -2.965
151 HA LYS 24 HA LYS 24 20.606 4.145 -3.747
152 HB2 LYS 24 HB2 LYS 24 20.916 2.116 -1.553
153 HB3 LYS 24 HB3 LYS 24 21.961 3.472 -1.955
154 HG2 LYS 24 HG2 LYS 24 20.956 4.294 -0.089
155 HG3 LYS 24 HG3 LYS 24 19.822 4.871 -1.313
156 HD2 LYS 24 HD2 LYS 24 18.224 3.292 -0.763
157 HD3 LYS 24 HD3 LYS 24 19.408 2.193 -0.050
158 HE2 LYS 24 HE2 LYS 24 17.841 3.434 1.541
159 HE3 LYS 24 HE3 LYS 24 19.564 3.456 1.915
160 HZ1 LYS 24 HZ1 LYS 24 18.450 5.634 0.299
161 HZ2 LYS 24 HZ2 LYS 24 19.747 5.655 1.385
162 HZ3 LYS 24 HZ3 LYS 24 18.158 5.638 1.965
163 H TYR 25 H TYR 25 22.497 2.934 -4.477
164 HA TYR 25 HA TYR 25 21.700 0.684 -6.096
165 HB2 TYR 25 HB2 TYR 25 23.160 2.374 -7.058
166 HB3 TYR 25 HB3 TYR 25 24.361 2.092 -5.803
167 HD1 TYR 25 HD1 TYR 25 25.748 0.082 -5.836
168 HD2 TYR 25 HD2 TYR 25 22.904 0.838 -8.909
169 HE1 TYR 25 HE1 TYR 25 26.820 -1.628 -7.241
170 HE2 TYR 25 HE2 TYR 25 23.967 -0.872 -10.322
171 HH TYR 25 HH TYR 25 27.006 -2.289 -9.518
172 H SER 26 H SER 26 22.196 -1.417 -5.808
173 HA SER 26 HA SER 26 23.730 -2.111 -3.391
174 HB2 SER 26 HB2 SER 26 21.270 -3.251 -4.619
175 HB3 SER 26 HB3 SER 26 22.386 -4.379 -3.849
176 HG SER 26 HG SER 26 21.239 -2.077 -2.643
177 H ILE 27 H ILE 27 25.762 -2.418 -4.147
178 HA ILE 27 HA ILE 27 26.489 -3.482 -6.621
179 HB ILE 27 HB ILE 27 28.146 -3.841 -4.136
180 HG12 ILE 27 HG12 ILE 27 28.957 -1.455 -5.272
181 HG13 ILE 27 HG13 ILE 27 27.203 -1.365 -5.374
182 HG21 ILE 27 HG21 ILE 27 28.845 -3.345 -7.027
183 HG22 ILE 27 HG22 ILE 27 30.005 -3.480 -5.706
184 HG23 ILE 27 HG23 ILE 27 29.012 -4.867 -6.153
185 HD11 ILE 27 HD11 ILE 27 28.972 -1.278 -3.030
186 HD12 ILE 27 HD12 ILE 27 27.414 -0.502 -3.314
187 HD13 ILE 27 HD13 ILE 27 27.481 -2.198 -2.837
188 H LYS 28 H LYS 28 26.031 -5.084 -3.493
189 HA LYS 28 HA LYS 28 26.866 -7.648 -4.251
190 HB2 LYS 28 HB2 LYS 28 25.413 -8.417 -2.341
191 HB3 LYS 28 HB3 LYS 28 26.593 -7.179 -1.932
192 HG2 LYS 28 HG2 LYS 28 24.971 -5.936 -1.093
193 HG3 LYS 28 HG3 LYS 28 24.226 -5.845 -2.691
194 HD2 LYS 28 HD2 LYS 28 22.509 -6.759 -1.467
195 HD3 LYS 28 HD3 LYS 28 23.308 -8.220 -2.054
196 HE2 LYS 28 HE2 LYS 28 24.628 -7.547 0.316
197 HE3 LYS 28 HE3 LYS 28 22.916 -7.298 0.650
198 HZ1 LYS 28 HZ1 LYS 28 23.941 -9.778 -0.599
199 HZ2 LYS 28 HZ2 LYS 28 22.430 -9.517 0.114
200 HZ3 LYS 28 HZ3 LYS 28 23.817 -9.595 1.078
201 H ARG 29 H ARG 29 23.774 -6.011 -4.595
202 HA ARG 29 HA ARG 29 22.552 -8.409 -5.724
203 HB2 ARG 29 HB2 ARG 29 21.398 -5.675 -5.145
204 HB3 ARG 29 HB3 ARG 29 20.484 -7.037 -5.779
205 HG2 ARG 29 HG2 ARG 29 21.825 -7.914 -3.445
206 HG3 ARG 29 HG3 ARG 29 21.045 -6.374 -3.080
207 HD2 ARG 29 HD2 ARG 29 18.939 -7.200 -3.437
208 HD3 ARG 29 HD3 ARG 29 19.496 -8.418 -4.584
209 HE ARG 29 HE ARG 29 19.661 -9.880 -2.847
210 HH11 ARG 29 HH11 ARG 29 19.772 -6.641 -1.575
211 HH12 ARG 29 HH12 ARG 29 19.783 -7.151 0.080
212 HH21 ARG 29 HH21 ARG 29 19.675 -10.565 -0.671
213 HH22 ARG 29 HH22 ARG 29 19.729 -9.383 0.594
214 H ASN 30 H ASN 30 24.580 -6.211 -6.881
215 HA ASN 30 HA ASN 30 24.958 -5.168 -8.888
216 HB2 ASN 30 HB2 ASN 30 24.748 -6.673 -10.807
217 HB3 ASN 30 HB3 ASN 30 25.380 -7.537 -9.408
218 HD21 ASN 30 HD21 ASN 30 22.781 -7.214 -11.635
219 HD22 ASN 30 HD22 ASN 30 21.870 -8.584 -11.106
220 H LEU 31 H LEU 31 22.453 -4.433 -7.679
221 HA LEU 31 HA LEU 31 21.151 -3.365 -10.037
222 HB2 LEU 31 HB2 LEU 31 19.665 -5.063 -8.039
223 HB3 LEU 31 HB3 LEU 31 18.902 -4.068 -9.277
224 HG LEU 31 HG LEU 31 20.781 -6.337 -9.907
225 HD11 LEU 31 HD11 LEU 31 18.465 -7.373 -10.601
226 HD12 LEU 31 HD12 LEU 31 17.865 -6.322 -9.319
227 HD13 LEU 31 HD13 LEU 31 19.086 -7.542 -8.959
228 HD21 LEU 31 HD21 LEU 31 18.704 -5.504 -11.801
229 HD22 LEU 31 HD22 LEU 31 20.405 -5.885 -12.072
230 HD23 LEU 31 HD23 LEU 31 19.940 -4.287 -11.484
231 H LYS 32 H LYS 32 18.926 -2.261 -8.934
232 HA LYS 32 HA LYS 32 20.001 -0.578 -6.765
233 HB2 LYS 32 HB2 LYS 32 18.248 0.184 -9.103
234 HB3 LYS 32 HB3 LYS 32 18.523 1.232 -7.719
235 HG2 LYS 32 HG2 LYS 32 20.055 2.006 -9.261
236 HG3 LYS 32 HG3 LYS 32 21.026 0.916 -8.268
237 HD2 LYS 32 HD2 LYS 32 21.289 -0.590 -9.943
238 HD3 LYS 32 HD3 LYS 32 19.685 -0.284 -10.614
239 HE2 LYS 32 HE2 LYS 32 20.517 1.868 -11.508
240 HE3 LYS 32 HE3 LYS 32 22.126 1.465 -10.909
241 HZ1 LYS 32 HZ1 LYS 32 20.947 -0.593 -12.539
242 HZ2 LYS 32 HZ2 LYS 32 22.491 0.094 -12.613
243 HZ3 LYS 32 HZ3 LYS 32 21.186 0.863 -13.367
244 H ILE 33 H ILE 33 18.979 -0.973 -4.923
245 HA ILE 33 HA ILE 33 16.057 -1.272 -4.972
246 HB ILE 33 HB ILE 33 16.033 -3.099 -3.509
247 HG12 ILE 33 HG12 ILE 33 18.957 -2.511 -3.045
248 HG13 ILE 33 HG13 ILE 33 17.645 -2.444 -1.874
249 HG21 ILE 33 HG21 ILE 33 16.993 -4.798 -4.756
250 HG22 ILE 33 HG22 ILE 33 16.895 -3.478 -5.921
251 HG23 ILE 33 HG23 ILE 33 18.430 -3.848 -5.134
252 HD11 ILE 33 HD11 ILE 33 19.148 -4.770 -2.913
253 HD12 ILE 33 HD12 ILE 33 18.564 -4.426 -1.285
254 HD13 ILE 33 HD13 ILE 33 17.445 -5.003 -2.519
255 H CYS 34 H CYS 34 15.158 -1.092 -2.670
256 HA CYS 34 HA CYS 34 16.174 1.359 -1.543
257 HB2 CYS 34 HB2 CYS 34 13.805 -0.387 -0.867
258 HB3 CYS 34 HB3 CYS 34 14.205 1.076 0.028
259 H VAL 35 H VAL 35 16.637 1.644 0.730
260 HA VAL 35 HA VAL 35 17.316 -0.738 2.257
261 HB VAL 35 HB VAL 35 19.422 1.360 1.740
262 HG11 VAL 35 HG11 VAL 35 20.498 0.423 3.439
263 HG12 VAL 35 HG12 VAL 35 19.135 -0.666 3.703
264 HG13 VAL 35 HG13 VAL 35 20.447 -1.139 2.622
265 HG21 VAL 35 HG21 VAL 35 19.114 -1.379 0.517
266 HG22 VAL 35 HG22 VAL 35 19.034 0.168 -0.325
267 HG23 VAL 35 HG23 VAL 35 20.555 -0.372 0.384
Start of MODEL 18
1 H1 GLY 1 H GLY 1 1.024 1.953 -2.270
2 HA2 GLY 1 HA2 GLY 1 1.655 -0.026 -0.499
3 HA3 GLY 1 HA3 GLY 1 2.159 -0.679 -2.051
4 H CYS 2 H CYS 2 4.260 -0.634 -0.812
5 HA CYS 2 HA CYS 2 5.723 1.738 -1.623
6 HB2 CYS 2 HB2 CYS 2 6.802 1.994 0.596
7 HB3 CYS 2 HB3 CYS 2 5.077 2.345 0.635
8 H ILE 3 H ILE 3 8.064 1.428 -1.517
9 HA ILE 3 HA ILE 3 8.749 -1.334 -2.122
10 HB ILE 3 HB ILE 3 10.493 1.122 -2.324
11 HG12 ILE 3 HG12 ILE 3 9.630 0.039 -4.850
12 HG13 ILE 3 HG13 ILE 3 8.229 0.431 -3.859
13 HG21 ILE 3 HG21 ILE 3 10.886 -1.344 -3.941
14 HG22 ILE 3 HG22 ILE 3 12.066 -0.162 -3.377
15 HG23 ILE 3 HG23 ILE 3 11.402 -1.349 -2.254
16 HD11 ILE 3 HD11 ILE 3 9.967 2.605 -3.610
17 HD12 ILE 3 HD12 ILE 3 9.966 2.171 -5.320
18 HD13 ILE 3 HD13 ILE 3 8.447 2.532 -4.500
19 H ALA 4 H ALA 4 9.580 -2.642 -0.647
20 HA ALA 4 HA ALA 4 10.487 -1.654 1.895
21 HB1 ALA 4 HB1 ALA 4 11.140 -4.367 1.713
22 HB2 ALA 4 HB2 ALA 4 9.724 -3.654 2.486
23 HB3 ALA 4 HB3 ALA 4 9.641 -4.176 0.803
24 H LYS 5 H LYS 5 12.573 -2.555 2.830
25 HA LYS 5 HA LYS 5 14.743 -1.670 1.187
26 HB2 LYS 5 HB2 LYS 5 16.143 -2.291 3.158
27 HB3 LYS 5 HB3 LYS 5 14.823 -1.193 3.540
28 HG2 LYS 5 HG2 LYS 5 13.984 -2.609 5.022
29 HG3 LYS 5 HG3 LYS 5 13.988 -3.930 3.851
30 HD2 LYS 5 HD2 LYS 5 16.624 -3.770 4.417
31 HD3 LYS 5 HD3 LYS 5 15.937 -3.252 5.958
32 HE2 LYS 5 HE2 LYS 5 15.582 -5.386 6.461
33 HE3 LYS 5 HE3 LYS 5 14.424 -5.468 5.134
34 HZ1 LYS 5 HZ1 LYS 5 16.473 -5.880 3.690
35 HZ2 LYS 5 HZ2 LYS 5 15.932 -7.148 4.670
36 HZ3 LYS 5 HZ3 LYS 5 17.275 -6.232 5.138
37 H ASN 6 H ASN 6 14.124 -3.409 -0.468
38 HA ASN 6 HA ASN 6 16.162 -5.310 -0.602
39 HB2 ASN 6 HB2 ASN 6 14.462 -6.243 1.212
40 HB3 ASN 6 HB3 ASN 6 13.595 -6.785 -0.222
41 HD21 ASN 6 HD21 ASN 6 15.101 -8.200 1.946
42 HD22 ASN 6 HD22 ASN 6 16.203 -9.232 1.106
43 H LYS 7 H LYS 7 13.009 -4.219 -1.586
44 HA LYS 7 HA LYS 7 13.114 -5.609 -4.128
45 HB2 LYS 7 HB2 LYS 7 11.154 -3.489 -3.242
46 HB3 LYS 7 HB3 LYS 7 10.957 -4.634 -4.562
47 HG2 LYS 7 HG2 LYS 7 11.448 -6.103 -2.182
48 HG3 LYS 7 HG3 LYS 7 10.189 -4.911 -1.854
49 HD2 LYS 7 HD2 LYS 7 8.823 -5.740 -3.607
50 HD3 LYS 7 HD3 LYS 7 10.137 -6.724 -4.257
51 HE2 LYS 7 HE2 LYS 7 9.912 -7.604 -1.655
52 HE3 LYS 7 HE3 LYS 7 8.239 -7.305 -2.124
53 HZ1 LYS 7 HZ1 LYS 7 10.188 -9.155 -3.350
54 HZ2 LYS 7 HZ2 LYS 7 8.823 -8.634 -4.200
55 HZ3 LYS 7 HZ3 LYS 7 8.641 -9.493 -2.754
56 H GLU 8 H GLU 8 13.362 -4.646 -6.142
57 HA GLU 8 HA GLU 8 15.179 -2.497 -6.292
58 HB2 GLU 8 HB2 GLU 8 15.174 -2.825 -8.593
59 HB3 GLU 8 HB3 GLU 8 14.715 -4.408 -7.982
60 HG2 GLU 8 HG2 GLU 8 12.347 -3.835 -8.393
61 HG3 GLU 8 HG3 GLU 8 12.873 -2.312 -9.107
62 H CYS 9 H CYS 9 14.921 -0.385 -7.070
63 HA CYS 9 HA CYS 9 12.246 0.653 -7.497
64 HB2 CYS 9 HB2 CYS 9 12.451 2.385 -5.764
65 HB3 CYS 9 HB3 CYS 9 12.464 0.771 -5.061
66 H ALA 10 H ALA 10 12.220 2.414 -8.805
67 HA ALA 10 HA ALA 10 14.802 3.281 -9.869
68 HB1 ALA 10 HB1 ALA 10 13.739 3.806 -11.832
69 HB2 ALA 10 HB2 ALA 10 12.717 2.491 -11.250
70 HB3 ALA 10 HB3 ALA 10 12.207 4.165 -11.035
71 H TRP 11 H TRP 11 15.396 5.452 -10.037
72 HA TRP 11 HA TRP 11 14.714 7.098 -7.865
73 HB2 TRP 11 HB2 TRP 11 16.301 7.451 -10.369
74 HB3 TRP 11 HB3 TRP 11 15.860 8.888 -9.451
75 HD1 TRP 11 HD1 TRP 11 16.450 5.964 -7.222
76 HE1 TRP 11 HE1 TRP 11 18.748 6.172 -6.080
77 HE3 TRP 11 HE3 TRP 11 18.401 9.779 -10.011
78 HZ2 TRP 11 HZ2 TRP 11 21.078 7.745 -6.328
79 HZ3 TRP 11 HZ3 TRP 11 20.670 10.577 -9.493
80 HH2 TRP 11 HH2 TRP 11 21.979 9.580 -7.690
81 H PHE 12 H PHE 12 13.132 6.562 -10.821
82 HA PHE 12 HA PHE 12 11.347 8.830 -10.283
83 HB2 PHE 12 HB2 PHE 12 13.070 9.031 -12.305
84 HB3 PHE 12 HB3 PHE 12 11.833 8.087 -13.127
85 HD1 PHE 12 HD1 PHE 12 12.428 11.231 -11.269
86 HD2 PHE 12 HD2 PHE 12 9.871 9.094 -13.918
87 HE1 PHE 12 HE1 PHE 12 11.141 13.287 -11.681
88 HE2 PHE 12 HE2 PHE 12 8.581 11.147 -14.335
89 HZ PHE 12 HZ PHE 12 9.216 13.247 -13.216
90 H SER 13 H SER 13 11.263 5.894 -9.785
91 HA SER 13 HA SER 13 9.504 4.631 -11.577
92 HB2 SER 13 HB2 SER 13 8.987 3.143 -9.576
93 HB3 SER 13 HB3 SER 13 10.686 3.255 -10.036
94 HG SER 13 HG SER 13 9.721 5.077 -8.156
95 H GLY 14 H GLY 14 8.982 7.133 -9.331
96 HA2 GLY 14 HA2 GLY 14 7.004 8.400 -9.205
97 HA3 GLY 14 HA3 GLY 14 6.119 7.045 -9.891
98 H GLU 15 H GLU 15 7.580 5.290 -7.848
99 HA GLU 15 HA GLU 15 5.663 5.784 -5.685
100 HB2 GLU 15 HB2 GLU 15 6.356 3.404 -5.018
101 HB3 GLU 15 HB3 GLU 15 5.385 3.595 -6.471
102 HG2 GLU 15 HG2 GLU 15 8.272 3.665 -6.936
103 HG3 GLU 15 HG3 GLU 15 7.670 2.138 -6.293
104 H TRP 16 H TRP 16 6.565 4.836 -3.493
105 HA TRP 16 HA TRP 16 9.313 5.797 -3.088
106 HB2 TRP 16 HB2 TRP 16 7.180 6.356 -1.048
107 HB3 TRP 16 HB3 TRP 16 8.743 7.140 -1.260
108 HD1 TRP 16 HD1 TRP 16 8.720 8.235 -4.089
109 HE1 TRP 16 HE1 TRP 16 6.999 9.975 -4.886
110 HE3 TRP 16 HE3 TRP 16 5.064 7.414 -0.610
111 HZ2 TRP 16 HZ2 TRP 16 4.432 10.881 -4.138
112 HZ3 TRP 16 HZ3 TRP 16 3.007 8.760 -0.721
113 HH2 TRP 16 HH2 TRP 16 2.700 10.458 -2.449
114 H CYS 17 H CYS 17 10.368 4.943 -1.198
115 HA CYS 17 HA CYS 17 9.729 2.189 -0.755
116 HB2 CYS 17 HB2 CYS 17 11.757 3.794 0.794
117 HB3 CYS 17 HB3 CYS 17 11.765 2.067 0.455
118 H CYS 18 H CYS 18 9.564 1.238 1.430
119 HA CYS 18 HA CYS 18 7.441 2.432 2.882
120 HB2 CYS 18 HB2 CYS 18 9.228 0.108 3.632
121 HB3 CYS 18 HB3 CYS 18 7.718 0.532 4.433
122 H GLY 19 H GLY 19 7.551 2.691 5.320
123 HA2 GLY 19 HA2 GLY 19 8.313 3.957 7.079
124 HA3 GLY 19 HA3 GLY 19 9.866 3.204 6.747
125 H ALA 20 H ALA 20 11.489 4.460 6.078
126 HA ALA 20 HA ALA 20 10.955 6.947 4.675
127 HB1 ALA 20 HB1 ALA 20 11.491 8.407 6.288
128 HB2 ALA 20 HB2 ALA 20 11.113 7.084 7.392
129 HB3 ALA 20 HB3 ALA 20 12.785 7.386 6.918
130 H LEU 21 H LEU 21 12.206 4.553 3.854
131 HA LEU 21 HA LEU 21 15.066 5.173 3.837
132 HB2 LEU 21 HB2 LEU 21 13.769 2.776 2.581
133 HB3 LEU 21 HB3 LEU 21 15.442 2.974 3.097
134 HG LEU 21 HG LEU 21 13.322 3.084 5.179
135 HD11 LEU 21 HD11 LEU 21 13.223 1.023 3.394
136 HD12 LEU 21 HD12 LEU 21 12.687 0.943 5.072
137 HD13 LEU 21 HD13 LEU 21 14.302 0.385 4.634
138 HD21 LEU 21 HD21 LEU 21 15.658 1.435 5.632
139 HD22 LEU 21 HD22 LEU 21 15.063 2.824 6.542
140 HD23 LEU 21 HD23 LEU 21 16.095 3.068 5.132
141 H SER 22 H SER 22 16.250 5.103 1.811
142 HA SER 22 HA SER 22 14.628 6.122 -0.426
143 HB2 SER 22 HB2 SER 22 17.296 6.877 0.654
144 HB3 SER 22 HB3 SER 22 17.083 6.962 -1.095
145 HG SER 22 HG SER 22 15.099 8.198 -0.539
146 H CYS 23 H CYS 23 16.302 5.944 -2.508
147 HA CYS 23 HA CYS 23 16.561 3.049 -2.861
148 HB2 CYS 23 HB2 CYS 23 16.423 5.335 -4.831
149 HB3 CYS 23 HB3 CYS 23 16.758 3.673 -5.306
150 H LYS 24 H LYS 24 18.493 2.157 -2.649
151 HA LYS 24 HA LYS 24 20.868 3.752 -3.357
152 HB2 LYS 24 HB2 LYS 24 20.747 1.577 -1.264
153 HB3 LYS 24 HB3 LYS 24 22.109 2.634 -1.615
154 HG2 LYS 24 HG2 LYS 24 21.249 3.625 0.259
155 HG3 LYS 24 HG3 LYS 24 20.418 4.530 -1.009
156 HD2 LYS 24 HD2 LYS 24 18.404 3.427 -0.649
157 HD3 LYS 24 HD3 LYS 24 19.183 2.060 0.151
158 HE2 LYS 24 HE2 LYS 24 17.930 3.539 1.701
159 HE3 LYS 24 HE3 LYS 24 19.640 3.388 2.098
160 HZ1 LYS 24 HZ1 LYS 24 18.421 5.713 1.998
161 HZ2 LYS 24 HZ2 LYS 24 18.861 5.606 0.368
162 HZ3 LYS 24 HZ3 LYS 24 20.049 5.538 1.571
163 H TYR 25 H TYR 25 22.624 2.640 -4.315
164 HA TYR 25 HA TYR 25 21.800 0.467 -6.018
165 HB2 TYR 25 HB2 TYR 25 23.206 2.248 -6.918
166 HB3 TYR 25 HB3 TYR 25 24.464 1.875 -5.745
167 HD1 TYR 25 HD2 TYR 25 25.748 -0.236 -5.940
168 HD2 TYR 25 HD1 TYR 25 22.951 0.960 -8.915
169 HE1 TYR 25 HE2 TYR 25 26.749 -1.836 -7.516
170 HE2 TYR 25 HE1 TYR 25 23.944 -0.638 -10.499
171 HH TYR 25 HH TYR 25 26.552 -1.763 -10.586
172 H SER 26 H SER 26 22.215 -1.638 -5.774
173 HA SER 26 HA SER 26 23.909 -2.443 -3.505
174 HB2 SER 26 HB2 SER 26 21.402 -3.563 -4.677
175 HB3 SER 26 HB3 SER 26 22.547 -4.681 -3.939
176 HG SER 26 HG SER 26 21.503 -2.369 -2.666
177 H ILE 27 H ILE 27 25.896 -2.733 -4.371
178 HA ILE 27 HA ILE 27 26.471 -3.698 -6.933
179 HB ILE 27 HB ILE 27 28.286 -4.116 -4.571
180 HG12 ILE 27 HG12 ILE 27 29.005 -1.689 -5.681
181 HG13 ILE 27 HG13 ILE 27 27.246 -1.612 -5.668
182 HG21 ILE 27 HG21 ILE 27 28.604 -3.886 -7.525
183 HG22 ILE 27 HG22 ILE 27 29.923 -3.371 -6.475
184 HG23 ILE 27 HG23 ILE 27 29.332 -5.030 -6.399
185 HD11 ILE 27 HD11 ILE 27 27.703 -2.524 -3.179
186 HD12 ILE 27 HD12 ILE 27 29.161 -1.566 -3.444
187 HD13 ILE 27 HD13 ILE 27 27.572 -0.817 -3.599
188 H LYS 28 H LYS 28 26.251 -5.397 -3.829
189 HA LYS 28 HA LYS 28 27.043 -7.929 -4.720
190 HB2 LYS 28 HB2 LYS 28 25.779 -8.779 -2.736
191 HB3 LYS 28 HB3 LYS 28 26.912 -7.485 -2.367
192 HG2 LYS 28 HG2 LYS 28 24.186 -6.593 -2.981
193 HG3 LYS 28 HG3 LYS 28 24.343 -7.574 -1.522
194 HD2 LYS 28 HD2 LYS 28 26.445 -5.897 -1.225
195 HD3 LYS 28 HD3 LYS 28 25.319 -4.853 -2.095
196 HE2 LYS 28 HE2 LYS 28 24.597 -6.409 0.383
197 HE3 LYS 28 HE3 LYS 28 25.159 -4.738 0.405
198 HZ1 LYS 28 HZ1 LYS 28 22.579 -5.525 0.176
199 HZ2 LYS 28 HZ2 LYS 28 22.994 -5.188 -1.429
200 HZ3 LYS 28 HZ3 LYS 28 23.174 -3.997 -0.241
201 H ARG 29 H ARG 29 23.994 -6.247 -4.960
202 HA ARG 29 HA ARG 29 22.697 -8.644 -6.040
203 HB2 ARG 29 HB2 ARG 29 21.611 -5.978 -5.135
204 HB3 ARG 29 HB3 ARG 29 20.629 -7.180 -5.961
205 HG2 ARG 29 HG2 ARG 29 21.813 -8.608 -3.919
206 HG3 ARG 29 HG3 ARG 29 21.457 -7.042 -3.188
207 HD2 ARG 29 HD2 ARG 29 19.139 -7.384 -4.386
208 HD3 ARG 29 HD3 ARG 29 19.604 -9.084 -4.318
209 HE ARG 29 HE ARG 29 18.738 -7.451 -2.140
210 HH11 ARG 29 HH11 ARG 29 20.748 -10.160 -3.002
211 HH12 ARG 29 HH12 ARG 29 20.674 -10.882 -1.429
212 HH21 ARG 29 HH21 ARG 29 18.633 -8.392 -0.065
213 HH22 ARG 29 HH22 ARG 29 19.470 -9.876 0.241
214 H ASN 30 H ASN 30 24.621 -6.374 -7.226
215 HA ASN 30 HA ASN 30 24.846 -5.226 -9.200
216 HB2 ASN 30 HB2 ASN 30 24.509 -6.653 -11.176
217 HB3 ASN 30 HB3 ASN 30 25.299 -7.537 -9.872
218 HD21 ASN 30 HD21 ASN 30 24.532 -9.473 -9.467
219 HD22 ASN 30 HD22 ASN 30 22.941 -10.037 -9.836
220 H LEU 31 H LEU 31 22.450 -4.537 -7.819
221 HA LEU 31 HA LEU 31 20.946 -3.466 -10.056
222 HB2 LEU 31 HB2 LEU 31 19.668 -5.183 -7.935
223 HB3 LEU 31 HB3 LEU 31 18.776 -4.167 -9.066
224 HG LEU 31 HG LEU 31 20.588 -6.398 -9.961
225 HD11 LEU 31 HD11 LEU 31 18.279 -7.530 -10.351
226 HD12 LEU 31 HD12 LEU 31 17.743 -6.460 -9.056
227 HD13 LEU 31 HD13 LEU 31 19.042 -7.616 -8.763
228 HD21 LEU 31 HD21 LEU 31 18.291 -5.685 -11.589
229 HD22 LEU 31 HD22 LEU 31 19.991 -5.834 -12.034
230 HD23 LEU 31 HD23 LEU 31 19.390 -4.327 -11.341
231 H LYS 32 H LYS 32 18.826 -2.365 -8.757
232 HA LYS 32 HA LYS 32 20.040 -0.748 -6.615
233 HB2 LYS 32 HB2 LYS 32 18.205 0.269 -8.792
234 HB3 LYS 32 HB3 LYS 32 18.911 1.227 -7.497
235 HG2 LYS 32 HG2 LYS 32 20.411 1.740 -9.094
236 HG3 LYS 32 HG3 LYS 32 21.151 0.225 -8.571
237 HD2 LYS 32 HD2 LYS 32 20.733 -0.766 -10.531
238 HD3 LYS 32 HD3 LYS 32 19.069 -0.178 -10.562
239 HE2 LYS 32 HE2 LYS 32 19.586 1.592 -11.857
240 HE3 LYS 32 HE3 LYS 32 21.123 1.869 -11.040
241 HZ1 LYS 32 HZ1 LYS 32 20.783 0.793 -13.529
242 HZ2 LYS 32 HZ2 LYS 32 21.139 -0.547 -12.560
243 HZ3 LYS 32 HZ3 LYS 32 22.206 0.764 -12.615
244 H ILE 33 H ILE 33 18.987 -1.153 -4.791
245 HA ILE 33 HA ILE 33 16.049 -1.304 -4.875
246 HB ILE 33 HB ILE 33 15.955 -3.092 -3.359
247 HG12 ILE 33 HG12 ILE 33 18.892 -2.578 -2.902
248 HG13 ILE 33 HG13 ILE 33 17.580 -2.479 -1.732
249 HG21 ILE 33 HG21 ILE 33 16.748 -3.584 -5.748
250 HG22 ILE 33 HG22 ILE 33 18.317 -3.911 -5.013
251 HG23 ILE 33 HG23 ILE 33 16.908 -4.862 -4.544
252 HD11 ILE 33 HD11 ILE 33 18.934 -4.887 -2.855
253 HD12 ILE 33 HD12 ILE 33 18.608 -4.461 -1.175
254 HD13 ILE 33 HD13 ILE 33 17.294 -5.004 -2.219
255 H CYS 34 H CYS 34 15.167 -1.125 -2.528
256 HA CYS 34 HA CYS 34 16.242 1.338 -1.446
257 HB2 CYS 34 HB2 CYS 34 13.757 -0.276 -0.904
258 HB3 CYS 34 HB3 CYS 34 14.215 1.084 0.117
259 H VAL 35 H VAL 35 16.579 1.623 0.874
260 HA VAL 35 HA VAL 35 17.166 -0.780 2.410
261 HB VAL 35 HB VAL 35 19.307 1.304 1.973
262 HG11 VAL 35 HG11 VAL 35 19.462 0.269 4.138
263 HG12 VAL 35 HG12 VAL 35 19.297 -1.338 3.427
264 HG13 VAL 35 HG13 VAL 35 20.740 -0.374 3.107
265 HG21 VAL 35 HG21 VAL 35 20.492 -0.438 0.699
266 HG22 VAL 35 HG22 VAL 35 19.069 -1.473 0.816
267 HG23 VAL 35 HG23 VAL 35 18.983 0.046 -0.076
Start of MODEL 19
1 H1 GLY 1 H GLY 1 2.521 -2.520 -1.551
2 HA2 GLY 1 HA2 GLY 1 1.502 0.129 -1.713
3 HA3 GLY 1 HA3 GLY 1 1.998 -0.700 -0.245
4 H CYS 2 H CYS 2 4.646 -1.140 -0.625
5 HA CYS 2 HA CYS 2 5.906 1.352 -1.430
6 HB2 CYS 2 HB2 CYS 2 7.027 1.653 0.749
7 HB3 CYS 2 HB3 CYS 2 5.279 1.820 0.879
8 H ILE 3 H ILE 3 8.279 1.215 -1.363
9 HA ILE 3 HA ILE 3 9.139 -1.467 -2.103
10 HB ILE 3 HB ILE 3 10.629 1.155 -2.283
11 HG12 ILE 3 HG12 ILE 3 9.840 -0.166 -4.767
12 HG13 ILE 3 HG13 ILE 3 8.460 0.309 -3.782
13 HG21 ILE 3 HG21 ILE 3 12.127 -0.762 -2.136
14 HG22 ILE 3 HG22 ILE 3 11.266 -1.548 -3.459
15 HG23 ILE 3 HG23 ILE 3 12.164 -0.058 -3.752
16 HD11 ILE 3 HD11 ILE 3 10.598 2.314 -4.189
17 HD12 ILE 3 HD12 ILE 3 9.560 1.927 -5.561
18 HD13 ILE 3 HD13 ILE 3 8.852 2.522 -4.060
19 H ALA 4 H ALA 4 10.105 -2.765 -0.703
20 HA ALA 4 HA ALA 4 11.025 -1.793 1.846
21 HB1 ALA 4 HB1 ALA 4 10.326 -4.348 0.686
22 HB2 ALA 4 HB2 ALA 4 11.817 -4.445 1.624
23 HB3 ALA 4 HB3 ALA 4 10.341 -3.843 2.376
24 H LYS 5 H LYS 5 13.187 -2.635 2.684
25 HA LYS 5 HA LYS 5 15.252 -1.572 1.011
26 HB2 LYS 5 HB2 LYS 5 16.748 -2.174 2.905
27 HB3 LYS 5 HB3 LYS 5 15.371 -1.193 3.388
28 HG2 LYS 5 HG2 LYS 5 14.230 -3.341 4.057
29 HG3 LYS 5 HG3 LYS 5 15.788 -4.137 3.823
30 HD2 LYS 5 HD2 LYS 5 16.075 -1.751 5.422
31 HD3 LYS 5 HD3 LYS 5 14.879 -2.843 6.125
32 HE2 LYS 5 HE2 LYS 5 17.540 -3.859 5.194
33 HE3 LYS 5 HE3 LYS 5 17.360 -3.120 6.784
34 HZ1 LYS 5 HZ1 LYS 5 15.307 -5.008 6.380
35 HZ2 LYS 5 HZ2 LYS 5 16.522 -5.002 7.556
36 HZ3 LYS 5 HZ3 LYS 5 16.798 -5.739 6.059
37 H ASN 6 H ASN 6 14.600 -3.315 -0.667
38 HA ASN 6 HA ASN 6 16.745 -5.066 -0.996
39 HB2 ASN 6 HB2 ASN 6 15.249 -6.156 0.909
40 HB3 ASN 6 HB3 ASN 6 14.323 -6.730 -0.475
41 HD21 ASN 6 HD21 ASN 6 14.848 -8.711 -1.003
42 HD22 ASN 6 HD22 ASN 6 16.433 -9.398 -0.955
43 H LYS 7 H LYS 7 13.489 -4.127 -1.736
44 HA LYS 7 HA LYS 7 13.466 -5.482 -4.298
45 HB2 LYS 7 HB2 LYS 7 11.505 -3.497 -3.132
46 HB3 LYS 7 HB3 LYS 7 11.254 -4.468 -4.577
47 HG2 LYS 7 HG2 LYS 7 11.930 -6.210 -2.435
48 HG3 LYS 7 HG3 LYS 7 10.653 -5.117 -1.894
49 HD2 LYS 7 HD2 LYS 7 9.251 -5.747 -3.735
50 HD3 LYS 7 HD3 LYS 7 10.555 -6.683 -4.470
51 HE2 LYS 7 HE2 LYS 7 9.785 -7.397 -1.703
52 HE3 LYS 7 HE3 LYS 7 8.628 -7.783 -2.975
53 HZ1 LYS 7 HZ1 LYS 7 10.599 -8.843 -4.148
54 HZ2 LYS 7 HZ2 LYS 7 9.974 -9.659 -2.805
55 HZ3 LYS 7 HZ3 LYS 7 11.399 -8.759 -2.660
56 H GLU 8 H GLU 8 13.478 -4.469 -6.316
57 HA GLU 8 HA GLU 8 15.294 -2.442 -6.734
58 HB2 GLU 8 HB2 GLU 8 14.658 -2.462 -8.981
59 HB3 GLU 8 HB3 GLU 8 14.219 -4.069 -8.419
60 HG2 GLU 8 HG2 GLU 8 11.894 -3.287 -8.125
61 HG3 GLU 8 HG3 GLU 8 12.364 -1.733 -8.811
62 H CYS 9 H CYS 9 15.095 -0.238 -7.345
63 HA CYS 9 HA CYS 9 12.566 1.107 -6.871
64 HB2 CYS 9 HB2 CYS 9 13.640 0.934 -4.627
65 HB3 CYS 9 HB3 CYS 9 15.017 1.833 -5.254
66 H ALA 10 H ALA 10 12.411 2.206 -8.717
67 HA ALA 10 HA ALA 10 14.751 3.293 -10.028
68 HB1 ALA 10 HB1 ALA 10 12.181 4.097 -11.129
69 HB2 ALA 10 HB2 ALA 10 13.517 3.230 -11.886
70 HB3 ALA 10 HB3 ALA 10 12.326 2.351 -10.927
71 H TRP 11 H TRP 11 15.172 5.468 -10.400
72 HA TRP 11 HA TRP 11 14.542 7.246 -8.312
73 HB2 TRP 11 HB2 TRP 11 15.935 7.473 -10.941
74 HB3 TRP 11 HB3 TRP 11 15.453 8.958 -10.127
75 HD1 TRP 11 HD1 TRP 11 16.383 6.303 -7.688
76 HE1 TRP 11 HE1 TRP 11 18.728 6.762 -6.731
77 HE3 TRP 11 HE3 TRP 11 17.888 9.949 -10.941
78 HZ2 TRP 11 HZ2 TRP 11 20.924 8.448 -7.281
79 HZ3 TRP 11 HZ3 TRP 11 20.125 10.933 -10.656
80 HH2 TRP 11 HH2 TRP 11 21.610 10.197 -8.863
81 H PHE 12 H PHE 12 12.787 6.352 -11.069
82 HA PHE 12 HA PHE 12 10.915 8.567 -10.608
83 HB2 PHE 12 HB2 PHE 12 12.458 8.640 -12.779
84 HB3 PHE 12 HB3 PHE 12 11.218 7.552 -13.393
85 HD1 PHE 12 HD2 PHE 12 11.745 10.894 -11.884
86 HD2 PHE 12 HD1 PHE 12 9.169 8.376 -14.152
87 HE1 PHE 12 HE2 PHE 12 10.310 12.826 -12.393
88 HE2 PHE 12 HE1 PHE 12 7.730 10.305 -14.666
89 HZ PHE 12 HZ PHE 12 8.299 12.534 -13.785
90 H SER 13 H SER 13 11.085 5.660 -9.865
91 HA SER 13 HA SER 13 9.292 4.112 -11.334
92 HB2 SER 13 HB2 SER 13 9.006 2.803 -9.230
93 HB3 SER 13 HB3 SER 13 10.696 3.117 -9.625
94 HG SER 13 HG SER 13 10.238 5.085 -8.174
95 H GLY 14 H GLY 14 8.729 6.791 -9.254
96 HA2 GLY 14 HA2 GLY 14 6.707 7.989 -9.162
97 HA3 GLY 14 HA3 GLY 14 5.864 6.569 -9.763
98 H GLU 15 H GLU 15 7.361 4.937 -7.682
99 HA GLU 15 HA GLU 15 5.490 5.512 -5.498
100 HB2 GLU 15 HB2 GLU 15 6.175 3.173 -4.743
101 HB3 GLU 15 HB3 GLU 15 5.230 3.286 -6.221
102 HG2 GLU 15 HG2 GLU 15 8.132 3.347 -6.617
103 HG3 GLU 15 HG3 GLU 15 7.505 1.845 -5.942
104 H TRP 16 H TRP 16 6.521 4.520 -3.316
105 HA TRP 16 HA TRP 16 9.222 5.636 -3.005
106 HB2 TRP 16 HB2 TRP 16 7.086 6.061 -0.924
107 HB3 TRP 16 HB3 TRP 16 8.641 6.873 -1.080
108 HD1 TRP 16 HD1 TRP 16 8.597 7.988 -3.943
109 HE1 TRP 16 HE1 TRP 16 6.886 9.765 -4.676
110 HE3 TRP 16 HE3 TRP 16 5.020 7.189 -0.379
111 HZ2 TRP 16 HZ2 TRP 16 4.355 10.705 -3.852
112 HZ3 TRP 16 HZ3 TRP 16 2.984 8.570 -0.421
113 HH2 TRP 16 HH2 TRP 16 2.661 10.291 -2.122
114 H CYS 17 H CYS 17 10.354 4.868 -1.088
115 HA CYS 17 HA CYS 17 9.904 2.059 -0.681
116 HB2 CYS 17 HB2 CYS 17 11.898 3.756 0.811
117 HB3 CYS 17 HB3 CYS 17 11.991 2.038 0.438
118 H CYS 18 H CYS 18 9.904 1.095 1.515
119 HA CYS 18 HA CYS 18 7.776 2.183 3.062
120 HB2 CYS 18 HB2 CYS 18 9.660 -0.062 3.810
121 HB3 CYS 18 HB3 CYS 18 8.069 0.251 4.494
122 H GLY 19 H GLY 19 7.987 2.383 5.503
123 HA2 GLY 19 HA2 GLY 19 8.784 3.634 7.257
124 HA3 GLY 19 HA3 GLY 19 10.347 2.950 6.834
125 H ALA 20 H ALA 20 11.888 4.285 6.125
126 HA ALA 20 HA ALA 20 11.191 6.785 4.818
127 HB1 ALA 20 HB1 ALA 20 11.966 8.249 6.387
128 HB2 ALA 20 HB2 ALA 20 11.335 6.989 7.448
129 HB3 ALA 20 HB3 ALA 20 13.063 7.070 7.108
130 H LEU 21 H LEU 21 12.486 4.457 3.873
131 HA LEU 21 HA LEU 21 15.315 5.196 3.718
132 HB2 LEU 21 HB2 LEU 21 14.056 2.766 2.488
133 HB3 LEU 21 HB3 LEU 21 15.744 3.027 2.922
134 HG LEU 21 HG LEU 21 13.669 2.959 5.071
135 HD11 LEU 21 HD11 LEU 21 14.960 0.397 4.507
136 HD12 LEU 21 HD12 LEU 21 13.795 0.902 3.284
137 HD13 LEU 21 HD13 LEU 21 13.296 0.756 4.969
138 HD21 LEU 21 HD21 LEU 21 16.208 1.608 5.472
139 HD22 LEU 21 HD22 LEU 21 15.438 2.878 6.424
140 HD23 LEU 21 HD23 LEU 21 16.409 3.299 5.013
141 H SER 22 H SER 22 16.389 5.227 1.635
142 HA SER 22 HA SER 22 14.601 6.185 -0.501
143 HB2 SER 22 HB2 SER 22 16.210 7.855 0.467
144 HB3 SER 22 HB3 SER 22 17.530 6.854 -0.138
145 HG SER 22 HG SER 22 17.263 7.843 -1.960
146 H CYS 23 H CYS 23 16.133 6.130 -2.674
147 HA CYS 23 HA CYS 23 16.616 3.265 -3.060
148 HB2 CYS 23 HB2 CYS 23 16.461 5.336 -5.242
149 HB3 CYS 23 HB3 CYS 23 16.201 3.599 -5.363
150 H LYS 24 H LYS 24 18.649 2.615 -2.885
151 HA LYS 24 HA LYS 24 20.771 4.333 -3.989
152 HB2 LYS 24 HB2 LYS 24 21.298 2.504 -1.674
153 HB3 LYS 24 HB3 LYS 24 22.185 3.936 -2.181
154 HG2 LYS 24 HG2 LYS 24 21.147 4.790 -0.360
155 HG3 LYS 24 HG3 LYS 24 19.891 5.113 -1.558
156 HD2 LYS 24 HD2 LYS 24 18.651 3.192 -0.889
157 HD3 LYS 24 HD3 LYS 24 19.979 2.611 0.119
158 HE2 LYS 24 HE2 LYS 24 18.596 5.237 0.608
159 HE3 LYS 24 HE3 LYS 24 18.035 3.724 1.317
160 HZ1 LYS 24 HZ1 LYS 24 19.777 3.632 2.729
161 HZ2 LYS 24 HZ2 LYS 24 19.763 5.310 2.522
162 HZ3 LYS 24 HZ3 LYS 24 20.859 4.360 1.651
163 H TYR 25 H TYR 25 22.852 2.993 -4.306
164 HA TYR 25 HA TYR 25 22.165 0.785 -6.021
165 HB2 TYR 25 HB2 TYR 25 23.904 2.395 -6.670
166 HB3 TYR 25 HB3 TYR 25 24.871 1.919 -5.278
167 HD1 TYR 25 HD1 TYR 25 25.803 -0.409 -5.178
168 HD2 TYR 25 HD2 TYR 25 23.962 1.150 -8.683
169 HE1 TYR 25 HE1 TYR 25 26.870 -2.175 -6.517
170 HE2 TYR 25 HE2 TYR 25 25.023 -0.611 -10.031
171 HH TYR 25 HH TYR 25 26.811 -2.142 -9.981
172 H SER 26 H SER 26 22.455 -1.347 -5.670
173 HA SER 26 HA SER 26 23.603 -2.143 -3.074
174 HB2 SER 26 HB2 SER 26 21.111 -2.979 -4.467
175 HB3 SER 26 HB3 SER 26 22.003 -4.229 -3.599
176 HG SER 26 HG SER 26 21.475 -3.335 -1.756
177 H ILE 27 H ILE 27 25.608 -2.816 -3.585
178 HA ILE 27 HA ILE 27 26.402 -4.012 -5.986
179 HB ILE 27 HB ILE 27 27.752 -4.563 -3.355
180 HG12 ILE 27 HG12 ILE 27 29.001 -2.334 -4.404
181 HG13 ILE 27 HG13 ILE 27 27.296 -1.993 -4.680
182 HG21 ILE 27 HG21 ILE 27 29.345 -3.879 -5.703
183 HG22 ILE 27 HG22 ILE 27 29.501 -5.228 -4.579
184 HG23 ILE 27 HG23 ILE 27 28.355 -5.323 -5.916
185 HD11 ILE 27 HD11 ILE 27 28.822 -2.124 -2.173
186 HD12 ILE 27 HD12 ILE 27 27.422 -1.142 -2.609
187 HD13 ILE 27 HD13 ILE 27 27.204 -2.824 -2.126
188 H LYS 28 H LYS 28 25.375 -5.448 -2.918
189 HA LYS 28 HA LYS 28 25.916 -8.124 -3.518
190 HB2 LYS 28 HB2 LYS 28 24.111 -8.616 -1.825
191 HB3 LYS 28 HB3 LYS 28 25.393 -7.548 -1.269
192 HG2 LYS 28 HG2 LYS 28 23.865 -6.067 -0.675
193 HG3 LYS 28 HG3 LYS 28 23.389 -5.902 -2.367
194 HD2 LYS 28 HD2 LYS 28 21.393 -6.512 -1.392
195 HD3 LYS 28 HD3 LYS 28 22.026 -8.083 -1.889
196 HE2 LYS 28 HE2 LYS 28 22.593 -8.681 0.277
197 HE3 LYS 28 HE3 LYS 28 22.640 -7.009 0.834
198 HZ1 LYS 28 HZ1 LYS 28 20.062 -7.935 -0.113
199 HZ2 LYS 28 HZ2 LYS 28 20.445 -6.992 1.238
200 HZ3 LYS 28 HZ3 LYS 28 20.614 -8.674 1.306
201 H ARG 29 H ARG 29 23.136 -6.101 -4.283
202 HA ARG 29 HA ARG 29 21.799 -8.347 -5.590
203 HB2 ARG 29 HB2 ARG 29 20.923 -5.522 -4.987
204 HB3 ARG 29 HB3 ARG 29 19.959 -6.647 -5.935
205 HG2 ARG 29 HG2 ARG 29 20.603 -8.054 -3.629
206 HG3 ARG 29 HG3 ARG 29 20.243 -6.417 -3.075
207 HD2 ARG 29 HD2 ARG 29 18.099 -7.046 -3.150
208 HD3 ARG 29 HD3 ARG 29 18.251 -6.879 -4.898
209 HE ARG 29 HE ARG 29 19.023 -9.464 -3.893
210 HH11 ARG 29 HH11 ARG 29 16.392 -7.488 -5.031
211 HH12 ARG 29 HH12 ARG 29 15.412 -8.836 -5.505
212 HH21 ARG 29 HH21 ARG 29 17.742 -11.247 -4.513
213 HH22 ARG 29 HH22 ARG 29 16.181 -10.974 -5.208
214 H ASN 30 H ASN 30 24.158 -6.295 -6.418
215 HA ASN 30 HA ASN 30 24.886 -5.281 -8.342
216 HB2 ASN 30 HB2 ASN 30 24.845 -6.765 -10.287
217 HB3 ASN 30 HB3 ASN 30 25.210 -7.674 -8.824
218 HD21 ASN 30 HD21 ASN 30 22.975 -7.157 -11.387
219 HD22 ASN 30 HD22 ASN 30 21.907 -8.461 -11.009
220 H LEU 31 H LEU 31 22.287 -4.381 -7.485
221 HA LEU 31 HA LEU 31 21.411 -3.210 -9.985
222 HB2 LEU 31 HB2 LEU 31 19.539 -4.817 -8.254
223 HB3 LEU 31 HB3 LEU 31 19.037 -3.769 -9.579
224 HG LEU 31 HG LEU 31 20.832 -6.161 -9.947
225 HD11 LEU 31 HD11 LEU 31 18.474 -6.892 -11.039
226 HD12 LEU 31 HD12 LEU 31 17.914 -5.977 -9.640
227 HD13 LEU 31 HD13 LEU 31 18.999 -7.349 -9.419
228 HD21 LEU 31 HD21 LEU 31 20.800 -4.281 -11.647
229 HD22 LEU 31 HD22 LEU 31 19.125 -4.731 -11.968
230 HD23 LEU 31 HD23 LEU 31 20.421 -5.893 -12.254
231 H LYS 32 H LYS 32 19.143 -1.951 -9.213
232 HA LYS 32 HA LYS 32 20.089 -0.243 -7.014
233 HB2 LYS 32 HB2 LYS 32 17.943 0.576 -8.938
234 HB3 LYS 32 HB3 LYS 32 19.069 1.583 -8.037
235 HG2 LYS 32 HG2 LYS 32 19.733 -0.158 -10.403
236 HG3 LYS 32 HG3 LYS 32 19.610 1.603 -10.393
237 HD2 LYS 32 HD2 LYS 32 21.445 1.615 -8.672
238 HD3 LYS 32 HD3 LYS 32 21.644 -0.112 -8.977
239 HE2 LYS 32 HE2 LYS 32 21.619 1.608 -11.368
240 HE3 LYS 32 HE3 LYS 32 22.993 1.834 -10.287
241 HZ1 LYS 32 HZ1 LYS 32 23.800 0.151 -11.537
242 HZ2 LYS 32 HZ2 LYS 32 22.275 -0.470 -11.922
243 HZ3 LYS 32 HZ3 LYS 32 22.964 -0.797 -10.412
244 H ILE 33 H ILE 33 19.129 -0.644 -5.138
245 HA ILE 33 HA ILE 33 16.218 -1.014 -5.104
246 HB ILE 33 HB ILE 33 16.268 -2.833 -3.623
247 HG12 ILE 33 HG12 ILE 33 19.210 -2.234 -3.296
248 HG13 ILE 33 HG13 ILE 33 17.953 -2.141 -2.068
249 HG21 ILE 33 HG21 ILE 33 18.584 -3.486 -5.418
250 HG22 ILE 33 HG22 ILE 33 17.285 -4.542 -4.867
251 HG23 ILE 33 HG23 ILE 33 16.949 -3.269 -6.040
252 HD11 ILE 33 HD11 ILE 33 18.739 -4.142 -1.459
253 HD12 ILE 33 HD12 ILE 33 17.771 -4.739 -2.807
254 HD13 ILE 33 HD13 ILE 33 19.494 -4.436 -3.025
255 H CYS 34 H CYS 34 15.441 -0.924 -2.711
256 HA CYS 34 HA CYS 34 16.459 1.564 -1.627
257 HB2 CYS 34 HB2 CYS 34 14.061 -0.155 -1.029
258 HB3 CYS 34 HB3 CYS 34 14.512 1.187 0.017
259 H VAL 35 H VAL 35 16.827 1.804 0.713
260 HA VAL 35 HA VAL 35 17.650 -0.617 2.116
261 HB VAL 35 HB VAL 35 19.564 1.695 1.797
262 HG11 VAL 35 HG11 VAL 35 20.933 0.643 3.239
263 HG12 VAL 35 HG12 VAL 35 19.449 -0.140 3.785
264 HG13 VAL 35 HG13 VAL 35 20.509 -0.958 2.636
265 HG21 VAL 35 HG21 VAL 35 20.881 0.211 0.355
266 HG22 VAL 35 HG22 VAL 35 19.596 -0.995 0.428
267 HG23 VAL 35 HG23 VAL 35 19.301 0.563 -0.344
Start of MODEL 20
1 H1 GLY 1 H GLY 1 1.112 1.038 -2.948
2 HA2 GLY 1 HA2 GLY 1 1.657 0.027 -0.728
3 HA3 GLY 1 HA3 GLY 1 2.479 -1.232 -1.638
4 H CYS 2 H CYS 2 4.440 -0.813 -0.574
5 HA CYS 2 HA CYS 2 5.859 1.518 -1.641
6 HB2 CYS 2 HB2 CYS 2 6.950 1.873 0.565
7 HB3 CYS 2 HB3 CYS 2 5.219 2.191 0.593
8 H ILE 3 H ILE 3 8.224 1.296 -1.488
9 HA ILE 3 HA ILE 3 8.997 -1.455 -2.040
10 HB ILE 3 HB ILE 3 10.664 1.051 -2.285
11 HG12 ILE 3 HG12 ILE 3 9.856 -0.104 -4.794
12 HG13 ILE 3 HG13 ILE 3 8.433 0.247 -3.819
13 HG21 ILE 3 HG21 ILE 3 11.128 -1.465 -3.817
14 HG22 ILE 3 HG22 ILE 3 12.269 -0.206 -3.347
15 HG23 ILE 3 HG23 ILE 3 11.681 -1.355 -2.145
16 HD11 ILE 3 HD11 ILE 3 8.574 2.355 -4.456
17 HD12 ILE 3 HD12 ILE 3 10.118 2.485 -3.613
18 HD13 ILE 3 HD13 ILE 3 10.078 2.028 -5.315
19 H ALA 4 H ALA 4 9.836 -2.703 -0.518
20 HA ALA 4 HA ALA 4 10.716 -1.626 1.998
21 HB1 ALA 4 HB1 ALA 4 11.037 -4.481 1.128
22 HB2 ALA 4 HB2 ALA 4 10.824 -3.839 2.758
23 HB3 ALA 4 HB3 ALA 4 9.475 -3.826 1.621
24 H LYS 5 H LYS 5 12.816 -2.506 2.958
25 HA LYS 5 HA LYS 5 14.976 -1.600 1.310
26 HB2 LYS 5 HB2 LYS 5 16.376 -2.227 3.307
27 HB3 LYS 5 HB3 LYS 5 15.090 -1.071 3.632
28 HG2 LYS 5 HG2 LYS 5 14.253 -3.829 4.023
29 HG3 LYS 5 HG3 LYS 5 15.608 -3.362 5.054
30 HD2 LYS 5 HD2 LYS 5 14.371 -1.506 5.939
31 HD3 LYS 5 HD3 LYS 5 13.062 -1.768 4.785
32 HE2 LYS 5 HE2 LYS 5 13.383 -4.209 6.099
33 HE3 LYS 5 HE3 LYS 5 13.521 -2.987 7.362
34 HZ1 LYS 5 HZ1 LYS 5 11.354 -2.587 5.482
35 HZ2 LYS 5 HZ2 LYS 5 11.373 -2.420 7.164
36 HZ3 LYS 5 HZ3 LYS 5 11.200 -3.952 6.469
37 H ASN 6 H ASN 6 14.399 -3.365 -0.326
38 HA ASN 6 HA ASN 6 16.465 -5.236 -0.426
39 HB2 ASN 6 HB2 ASN 6 14.770 -6.173 1.390
40 HB3 ASN 6 HB3 ASN 6 13.922 -6.749 -0.042
41 HD21 ASN 6 HD21 ASN 6 14.348 -8.880 0.705
42 HD22 ASN 6 HD22 ASN 6 15.895 -9.606 0.448
43 H LYS 7 H LYS 7 13.294 -4.218 -1.436
44 HA LYS 7 HA LYS 7 13.442 -5.632 -3.962
45 HB2 LYS 7 HB2 LYS 7 11.432 -3.552 -3.089
46 HB3 LYS 7 HB3 LYS 7 11.267 -4.690 -4.420
47 HG2 LYS 7 HG2 LYS 7 11.773 -6.171 -2.052
48 HG3 LYS 7 HG3 LYS 7 10.492 -5.005 -1.716
49 HD2 LYS 7 HD2 LYS 7 9.109 -5.869 -3.398
50 HD3 LYS 7 HD3 LYS 7 10.444 -6.716 -4.183
51 HE2 LYS 7 HE2 LYS 7 9.501 -8.489 -3.126
52 HE3 LYS 7 HE3 LYS 7 10.532 -7.927 -1.811
53 HZ1 LYS 7 HZ1 LYS 7 7.698 -7.116 -2.143
54 HZ2 LYS 7 HZ2 LYS 7 8.698 -6.819 -0.811
55 HZ3 LYS 7 HZ3 LYS 7 8.199 -8.398 -1.159
56 H GLU 8 H GLU 8 13.685 -4.688 -5.984
57 HA GLU 8 HA GLU 8 15.442 -2.483 -6.136
58 HB2 GLU 8 HB2 GLU 8 15.497 -2.854 -8.430
59 HB3 GLU 8 HB3 GLU 8 15.083 -4.441 -7.797
60 HG2 GLU 8 HG2 GLU 8 12.709 -3.978 -8.272
61 HG3 GLU 8 HG3 GLU 8 13.181 -2.438 -8.989
62 H CYS 9 H CYS 9 15.124 -0.400 -6.984
63 HA CYS 9 HA CYS 9 12.418 0.531 -7.466
64 HB2 CYS 9 HB2 CYS 9 12.586 2.340 -5.784
65 HB3 CYS 9 HB3 CYS 9 12.562 0.740 -5.049
66 H ALA 10 H ALA 10 12.342 2.270 -8.807
67 HA ALA 10 HA ALA 10 14.904 3.192 -9.876
68 HB1 ALA 10 HB1 ALA 10 12.477 4.146 -11.196
69 HB2 ALA 10 HB2 ALA 10 13.899 3.348 -11.869
70 HB3 ALA 10 HB3 ALA 10 12.615 2.389 -11.134
71 H TRP 11 H TRP 11 15.439 5.369 -10.072
72 HA TRP 11 HA TRP 11 14.681 7.046 -7.956
73 HB2 TRP 11 HB2 TRP 11 16.254 7.411 -10.471
74 HB3 TRP 11 HB3 TRP 11 15.777 8.840 -9.559
75 HD1 TRP 11 HD1 TRP 11 16.469 5.940 -7.323
76 HE1 TRP 11 HE1 TRP 11 18.763 6.224 -6.193
77 HE3 TRP 11 HE3 TRP 11 18.282 9.810 -10.128
78 HZ2 TRP 11 HZ2 TRP 11 21.041 7.871 -6.454
79 HZ3 TRP 11 HZ3 TRP 11 20.527 10.682 -9.623
80 HH2 TRP 11 HH2 TRP 11 21.876 9.731 -7.823
81 H PHE 12 H PHE 12 13.151 6.400 -10.924
82 HA PHE 12 HA PHE 12 11.297 8.632 -10.456
83 HB2 PHE 12 HB2 PHE 12 13.001 8.770 -12.501
84 HB3 PHE 12 HB3 PHE 12 11.775 7.763 -13.265
85 HD1 PHE 12 HD1 PHE 12 12.286 10.990 -11.516
86 HD2 PHE 12 HD2 PHE 12 9.827 8.707 -14.134
87 HE1 PHE 12 HE1 PHE 12 10.956 12.999 -12.013
88 HE2 PHE 12 HE2 PHE 12 8.493 10.713 -14.636
89 HZ PHE 12 HZ PHE 12 9.057 12.863 -13.576
90 H SER 13 H SER 13 11.307 5.702 -9.844
91 HA SER 13 HA SER 13 9.551 4.328 -11.551
92 HB2 SER 13 HB2 SER 13 9.151 2.843 -9.586
93 HB3 SER 13 HB3 SER 13 10.863 3.133 -9.898
94 HG SER 13 HG SER 13 10.366 4.993 -8.287
95 H GLY 14 H GLY 14 8.997 6.895 -9.378
96 HA2 GLY 14 HA2 GLY 14 6.994 8.123 -9.270
97 HA3 GLY 14 HA3 GLY 14 6.133 6.733 -9.913
98 H GLU 15 H GLU 15 7.624 5.050 -7.845
99 HA GLU 15 HA GLU 15 5.720 5.570 -5.677
100 HB2 GLU 15 HB2 GLU 15 6.452 3.218 -4.958
101 HB3 GLU 15 HB3 GLU 15 5.471 3.359 -6.410
102 HG2 GLU 15 HG2 GLU 15 8.365 3.450 -6.867
103 HG3 GLU 15 HG3 GLU 15 7.758 1.926 -6.222
104 H TRP 16 H TRP 16 6.653 4.689 -3.470
105 HA TRP 16 HA TRP 16 9.388 5.705 -3.110
106 HB2 TRP 16 HB2 TRP 16 7.273 6.269 -1.056
107 HB3 TRP 16 HB3 TRP 16 8.811 7.086 -1.319
108 HD1 TRP 16 HD1 TRP 16 8.732 8.151 -4.136
109 HE1 TRP 16 HE1 TRP 16 6.942 9.807 -4.959
110 HE3 TRP 16 HE3 TRP 16 5.103 7.220 -0.657
111 HZ2 TRP 16 HZ2 TRP 16 4.336 10.613 -4.230
112 HZ3 TRP 16 HZ3 TRP 16 2.992 8.477 -0.790
113 HH2 TRP 16 HH2 TRP 16 2.618 10.138 -2.540
114 H CYS 17 H CYS 17 10.484 4.898 -1.232
115 HA CYS 17 HA CYS 17 9.924 2.147 -0.729
116 HB2 CYS 17 HB2 CYS 17 11.872 3.865 0.805
117 HB3 CYS 17 HB3 CYS 17 11.938 2.126 0.537
118 H CYS 18 H CYS 18 9.801 1.235 1.491
119 HA CYS 18 HA CYS 18 7.610 2.395 2.896
120 HB2 CYS 18 HB2 CYS 18 9.410 0.094 3.686
121 HB3 CYS 18 HB3 CYS 18 7.868 0.494 4.436
122 H GLY 19 H GLY 19 7.720 2.585 5.365
123 HA2 GLY 19 HA2 GLY 19 8.446 3.859 7.134
124 HA3 GLY 19 HA3 GLY 19 10.017 3.148 6.792
125 H ALA 20 H ALA 20 11.608 4.458 6.155
126 HA ALA 20 HA ALA 20 11.014 6.946 4.778
127 HB1 ALA 20 HB1 ALA 20 12.387 6.910 7.462
128 HB2 ALA 20 HB2 ALA 20 12.297 8.307 6.389
129 HB3 ALA 20 HB3 ALA 20 10.823 7.634 7.084
130 H LEU 21 H LEU 21 12.342 4.561 3.977
131 HA LEU 21 HA LEU 21 15.178 5.281 3.944
132 HB2 LEU 21 HB2 LEU 21 13.965 2.834 2.703
133 HB3 LEU 21 HB3 LEU 21 15.629 3.091 3.226
134 HG LEU 21 HG LEU 21 13.522 3.162 5.313
135 HD11 LEU 21 HD11 LEU 21 12.907 1.011 5.224
136 HD12 LEU 21 HD12 LEU 21 14.511 0.468 4.734
137 HD13 LEU 21 HD13 LEU 21 13.392 1.109 3.532
138 HD21 LEU 21 HD21 LEU 21 15.857 1.519 5.755
139 HD22 LEU 21 HD22 LEU 21 15.283 2.926 6.650
140 HD23 LEU 21 HD23 LEU 21 16.300 3.141 5.225
141 H SER 22 H SER 22 16.359 5.199 1.903
142 HA SER 22 HA SER 22 14.704 6.180 -0.327
143 HB2 SER 22 HB2 SER 22 17.372 6.975 0.723
144 HB3 SER 22 HB3 SER 22 17.141 7.046 -1.024
145 HG SER 22 HG SER 22 16.454 8.986 -0.332
146 H CYS 23 H CYS 23 16.336 6.003 -2.430
147 HA CYS 23 HA CYS 23 16.661 3.109 -2.748
148 HB2 CYS 23 HB2 CYS 23 16.387 5.360 -4.742
149 HB3 CYS 23 HB3 CYS 23 16.780 3.709 -5.210
150 H LYS 24 H LYS 24 18.620 2.260 -2.631
151 HA LYS 24 HA LYS 24 20.927 3.918 -3.414
152 HB2 LYS 24 HB2 LYS 24 20.980 1.758 -1.306
153 HB3 LYS 24 HB3 LYS 24 22.246 2.919 -1.683
154 HG2 LYS 24 HG2 LYS 24 21.368 3.860 0.198
155 HG3 LYS 24 HG3 LYS 24 20.397 4.666 -1.037
156 HD2 LYS 24 HD2 LYS 24 18.526 3.340 -0.599
157 HD3 LYS 24 HD3 LYS 24 19.480 2.102 0.221
158 HE2 LYS 24 HE2 LYS 24 18.085 3.540 1.729
159 HE3 LYS 24 HE3 LYS 24 19.803 3.496 2.121
160 HZ1 LYS 24 HZ1 LYS 24 20.105 5.645 1.465
161 HZ2 LYS 24 HZ2 LYS 24 18.511 5.746 2.020
162 HZ3 LYS 24 HZ3 LYS 24 18.823 5.626 0.362
163 H TYR 25 H TYR 25 22.701 2.824 -4.379
164 HA TYR 25 HA TYR 25 21.887 0.618 -6.044
165 HB2 TYR 25 HB2 TYR 25 23.249 2.416 -6.983
166 HB3 TYR 25 HB3 TYR 25 24.534 2.070 -5.832
167 HD1 TYR 25 HD2 TYR 25 25.851 -0.015 -6.040
168 HD2 TYR 25 HD1 TYR 25 22.967 1.102 -8.961
169 HE1 TYR 25 HE2 TYR 25 26.845 -1.613 -7.623
170 HE2 TYR 25 HE1 TYR 25 23.952 -0.494 -10.553
171 HH TYR 25 HH TYR 25 26.960 -1.903 -10.119
172 H SER 26 H SER 26 22.315 -1.476 -5.760
173 HA SER 26 HA SER 26 24.092 -2.224 -3.535
174 HB2 SER 26 HB2 SER 26 21.527 -3.337 -4.555
175 HB3 SER 26 HB3 SER 26 22.707 -4.482 -3.916
176 HG SER 26 HG SER 26 22.607 -3.504 -1.956
177 H ILE 27 H ILE 27 26.043 -2.478 -4.514
178 HA ILE 27 HA ILE 27 26.549 -3.477 -7.055
179 HB ILE 27 HB ILE 27 28.398 -3.952 -4.728
180 HG12 ILE 27 HG12 ILE 27 29.149 -1.537 -5.851
181 HG13 ILE 27 HG13 ILE 27 27.394 -1.422 -5.795
182 HG21 ILE 27 HG21 ILE 27 28.907 -3.317 -7.632
183 HG22 ILE 27 HG22 ILE 27 30.136 -3.617 -6.404
184 HG23 ILE 27 HG23 ILE 27 29.038 -4.909 -6.886
185 HD11 ILE 27 HD11 ILE 27 27.797 -0.635 -3.733
186 HD12 ILE 27 HD12 ILE 27 27.885 -2.348 -3.321
187 HD13 ILE 27 HD13 ILE 27 29.364 -1.435 -3.616
188 H LYS 28 H LYS 28 26.391 -5.209 -3.961
189 HA LYS 28 HA LYS 28 27.118 -7.740 -4.860
190 HB2 LYS 28 HB2 LYS 28 25.790 -8.583 -2.907
191 HB3 LYS 28 HB3 LYS 28 26.953 -7.325 -2.509
192 HG2 LYS 28 HG2 LYS 28 25.311 -6.237 -1.500
193 HG3 LYS 28 HG3 LYS 28 24.590 -5.966 -3.089
194 HD2 LYS 28 HD2 LYS 28 22.893 -6.951 -1.778
195 HD3 LYS 28 HD3 LYS 28 23.497 -8.240 -2.822
196 HE2 LYS 28 HE2 LYS 28 24.509 -9.352 -1.090
197 HE3 LYS 28 HE3 LYS 28 24.734 -7.886 -0.138
198 HZ1 LYS 28 HZ1 LYS 28 22.014 -8.885 -0.635
199 HZ2 LYS 28 HZ2 LYS 28 22.598 -7.968 0.661
200 HZ3 LYS 28 HZ3 LYS 28 22.960 -9.618 0.561
201 H ARG 29 H ARG 29 23.996 -6.109 -4.937
202 HA ARG 29 HA ARG 29 22.738 -8.452 -6.140
203 HB2 ARG 29 HB2 ARG 29 21.648 -5.803 -5.188
204 HB3 ARG 29 HB3 ARG 29 20.669 -6.990 -6.040
205 HG2 ARG 29 HG2 ARG 29 21.854 -8.450 -4.017
206 HG3 ARG 29 HG3 ARG 29 21.479 -6.899 -3.262
207 HD2 ARG 29 HD2 ARG 29 19.448 -7.814 -2.954
208 HD3 ARG 29 HD3 ARG 29 19.195 -7.358 -4.638
209 HE ARG 29 HE ARG 29 20.298 -9.836 -4.796
210 HH11 ARG 29 HH11 ARG 29 17.557 -8.502 -3.114
211 HH12 ARG 29 HH12 ARG 29 16.647 -9.976 -3.160
212 HH21 ARG 29 HH21 ARG 29 19.110 -11.782 -4.862
213 HH22 ARG 29 HH22 ARG 29 17.532 -11.841 -4.153
214 H ASN 30 H ASN 30 24.666 -6.163 -7.278
215 HA ASN 30 HA ASN 30 24.900 -4.979 -9.229
216 HB2 ASN 30 HB2 ASN 30 24.564 -6.367 -11.233
217 HB3 ASN 30 HB3 ASN 30 25.345 -7.279 -9.945
218 HD21 ASN 30 HD21 ASN 30 24.567 -9.219 -9.578
219 HD22 ASN 30 HD22 ASN 30 22.975 -9.769 -9.963
220 H LEU 31 H LEU 31 22.500 -4.313 -7.839
221 HA LEU 31 HA LEU 31 21.006 -3.191 -10.058
222 HB2 LEU 31 HB2 LEU 31 19.716 -4.947 -7.976
223 HB3 LEU 31 HB3 LEU 31 18.831 -3.907 -9.090
224 HG LEU 31 HG LEU 31 20.640 -6.128 -10.018
225 HD11 LEU 31 HD11 LEU 31 19.081 -7.365 -8.862
226 HD12 LEU 31 HD12 LEU 31 18.322 -7.234 -10.448
227 HD13 LEU 31 HD13 LEU 31 17.791 -6.192 -9.128
228 HD21 LEU 31 HD21 LEU 31 20.142 -5.407 -12.056
229 HD22 LEU 31 HD22 LEU 31 19.324 -4.021 -11.334
230 HD23 LEU 31 HD23 LEU 31 18.416 -5.488 -11.706
231 H LYS 32 H LYS 32 18.886 -2.112 -8.742
232 HA LYS 32 HA LYS 32 20.119 -0.512 -6.596
233 HB2 LYS 32 HB2 LYS 32 18.329 0.404 -8.849
234 HB3 LYS 32 HB3 LYS 32 18.693 1.391 -7.440
235 HG2 LYS 32 HG2 LYS 32 20.274 2.182 -8.860
236 HG3 LYS 32 HG3 LYS 32 21.182 0.844 -8.151
237 HD2 LYS 32 HD2 LYS 32 21.478 0.761 -10.523
238 HD3 LYS 32 HD3 LYS 32 20.425 -0.579 -10.062
239 HE2 LYS 32 HE2 LYS 32 18.536 0.435 -10.955
240 HE3 LYS 32 HE3 LYS 32 19.257 2.043 -10.910
241 HZ1 LYS 32 HZ1 LYS 32 20.884 1.064 -12.621
242 HZ2 LYS 32 HZ2 LYS 32 19.331 1.493 -13.137
243 HZ3 LYS 32 HZ3 LYS 32 19.709 -0.131 -12.848
244 H ILE 33 H ILE 33 19.151 -1.039 -4.751
245 HA ILE 33 HA ILE 33 16.214 -1.260 -4.736
246 HB ILE 33 HB ILE 33 16.231 -3.060 -3.248
247 HG12 ILE 33 HG12 ILE 33 19.125 -2.363 -2.777
248 HG13 ILE 33 HG13 ILE 33 17.807 -2.386 -1.610
249 HG21 ILE 33 HG21 ILE 33 18.635 -3.748 -4.903
250 HG22 ILE 33 HG22 ILE 33 17.287 -4.779 -4.425
251 HG23 ILE 33 HG23 ILE 33 17.046 -3.517 -5.633
252 HD11 ILE 33 HD11 ILE 33 19.008 -4.290 -1.097
253 HD12 ILE 33 HD12 ILE 33 17.711 -4.910 -2.119
254 HD13 ILE 33 HD13 ILE 33 19.324 -4.671 -2.790
255 H CYS 34 H CYS 34 15.364 -1.061 -2.405
256 HA CYS 34 HA CYS 34 16.425 1.414 -1.332
257 HB2 CYS 34 HB2 CYS 34 13.964 -0.219 -0.716
258 HB3 CYS 34 HB3 CYS 34 14.408 1.213 0.207
259 H VAL 35 H VAL 35 16.760 1.702 0.990
260 HA VAL 35 HA VAL 35 17.357 -0.691 2.532
261 HB VAL 35 HB VAL 35 19.502 1.381 2.060
262 HG11 VAL 35 HG11 VAL 35 19.336 -1.123 3.698
263 HG12 VAL 35 HG12 VAL 35 20.889 -0.500 3.136
264 HG13 VAL 35 HG13 VAL 35 19.867 0.488 4.181
265 HG21 VAL 35 HG21 VAL 35 19.245 -1.412 0.949
266 HG22 VAL 35 HG22 VAL 35 19.169 0.093 0.033
267 HG23 VAL 35 HG23 VAL 35 20.676 -0.391 0.810