NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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|
570273 |
2m9u   |
19299 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 HIS 1 1H HIS 1 -9.622 -19.468 9.834
2 H2 HIS 1 2H HIS 1 -10.737 -18.583 8.933
3 H3 HIS 1 3H HIS 1 -9.336 -17.835 9.509
4 HA HIS 1 HA HIS 1 -9.444 -20.015 7.519
5 HB2 HIS 1 2HB HIS 1 -8.764 -17.060 7.167
6 HB3 HIS 1 1HB HIS 1 -8.648 -18.277 5.898
7 HD1 HIS 1 HD1 HIS 1 -11.001 -15.956 7.514
8 HD2 HIS 1 HD2 HIS 1 -11.238 -19.257 5.003
9 HE1 HIS 1 HE1 HIS 1 -13.332 -15.935 6.591
10 HE2 HIS 1 HE2 HIS 1 -13.494 -18.017 5.186
11 H HIS 2 H HIS 2 -7.389 -20.569 6.611
12 HA HIS 2 HA HIS 2 -4.945 -19.622 7.877
13 HB2 HIS 2 2HB HIS 2 -4.174 -21.963 8.416
14 HB3 HIS 2 1HB HIS 2 -5.486 -21.382 9.431
15 HD1 HIS 2 HD1 HIS 2 -4.744 -23.852 6.691
16 HD2 HIS 2 HD2 HIS 2 -7.827 -22.913 9.303
17 HE1 HIS 2 HE1 HIS 2 -6.334 -25.786 6.578
18 HE2 HIS 2 HE2 HIS 2 -8.067 -25.283 8.326
19 H HIS 3 H HIS 3 -5.351 -18.863 5.557
20 HA HIS 3 HA HIS 3 -4.050 -20.689 3.627
21 HB2 HIS 3 2HB HIS 3 -5.504 -18.045 3.166
22 HB3 HIS 3 1HB HIS 3 -4.707 -18.979 1.904
23 HD1 HIS 3 HD1 HIS 3 -7.782 -18.302 1.939
24 HD2 HIS 3 HD2 HIS 3 -6.087 -21.902 3.129
25 HE1 HIS 3 HE1 HIS 3 -9.596 -20.018 1.703
26 HE2 HIS 3 HE2 HIS 3 -8.593 -22.143 2.585
27 H HIS 4 H HIS 4 -1.946 -20.460 3.316
28 HA HIS 4 HA HIS 4 -0.588 -17.895 3.889
29 HB2 HIS 4 2HB HIS 4 1.331 -19.149 4.783
30 HB3 HIS 4 1HB HIS 4 -0.119 -19.549 5.693
31 HD1 HIS 4 HD1 HIS 4 -1.132 -21.958 5.310
32 HD2 HIS 4 HD2 HIS 4 2.563 -21.325 3.512
33 HE1 HIS 4 HE1 HIS 4 -0.262 -24.235 4.718
34 HE2 HIS 4 HE2 HIS 4 1.910 -23.816 3.514
35 H HIS 5 H HIS 5 1.159 -17.402 2.610
36 HA HIS 5 HA HIS 5 2.474 -19.220 0.881
37 HB2 HIS 5 2HB HIS 5 2.016 -18.187 -1.297
38 HB3 HIS 5 1HB HIS 5 0.504 -18.731 -0.592
39 HD1 HIS 5 HD1 HIS 5 1.992 -15.885 -2.201
40 HD2 HIS 5 HD2 HIS 5 -0.995 -16.446 0.623
41 HE1 HIS 5 HE1 HIS 5 0.646 -13.778 -2.220
42 HE2 HIS 5 HE2 HIS 5 -1.281 -14.237 -0.675
43 H HIS 6 H HIS 6 4.215 -17.929 -0.428
44 HA HIS 6 HA HIS 6 5.633 -16.284 1.413
45 HB2 HIS 6 2HB HIS 6 6.197 -16.864 -1.524
46 HB3 HIS 6 1HB HIS 6 7.282 -15.950 -0.480
47 HD1 HIS 6 HD1 HIS 6 7.712 -17.470 1.929
48 HD2 HIS 6 HD2 HIS 6 7.067 -19.453 -1.666
49 HE1 HIS 6 HE1 HIS 6 8.614 -19.783 2.260
50 HE2 HIS 6 HE2 HIS 6 8.193 -20.974 0.089
51 H SER 7 H SER 7 4.349 -14.626 1.926
52 HA SER 7 HA SER 7 3.844 -12.445 -0.001
53 HB2 SER 7 2HB SER 7 1.833 -13.224 1.153
54 HB3 SER 7 1HB SER 7 2.638 -13.141 2.717
55 HG SER 7 HG SER 7 2.298 -11.066 2.802
56 H HIS 8 H HIS 8 3.960 -10.222 1.387
57 HA HIS 8 HA HIS 8 6.575 -10.076 2.706
58 HB2 HIS 8 2HB HIS 8 4.527 -7.921 2.016
59 HB3 HIS 8 1HB HIS 8 6.073 -7.598 2.798
60 HD1 HIS 8 HD1 HIS 8 6.394 -6.040 0.607
61 HD2 HIS 8 HD2 HIS 8 6.450 -10.140 -0.063
62 HE1 HIS 8 HE1 HIS 8 7.392 -6.347 -1.666
63 HE2 HIS 8 HE2 HIS 8 7.511 -8.826 -2.016
64 H MET 9 H MET 9 6.748 -9.112 4.864
65 HA MET 9 HA MET 9 5.271 -10.567 6.750
66 HB2 MET 9 2HB MET 9 6.502 -9.325 8.479
67 HB3 MET 9 1HB MET 9 7.586 -9.792 7.180
68 HG2 MET 9 2HG MET 9 7.492 -7.493 6.278
69 HG3 MET 9 1HG MET 9 6.413 -7.029 7.596
70 HE1 MET 9 3HE MET 9 9.713 -5.190 8.595
71 HE2 MET 9 1HE MET 9 7.972 -5.025 8.343
72 HE3 MET 9 2HE MET 9 9.032 -5.396 6.982
73 H VAL 10 H VAL 10 3.554 -10.071 8.110
74 HA VAL 10 HA VAL 10 1.689 -8.053 7.447
75 HB VAL 10 HB VAL 10 0.525 -8.634 9.595
76 HG11 VAL 10 1HG1 VAL 10 0.077 -10.016 7.617
77 HG12 VAL 10 2HG1 VAL 10 0.015 -10.998 9.080
78 HG13 VAL 10 3HG1 VAL 10 1.429 -11.076 8.027
79 HG21 VAL 10 3HG2 VAL 10 1.376 -10.448 11.056
80 HG22 VAL 10 1HG2 VAL 10 2.446 -9.044 11.067
81 HG23 VAL 10 2HG2 VAL 10 2.881 -10.474 10.132
82 H GLY 11 H GLY 11 2.043 -5.895 7.682
83 HA2 GLY 11 2HA GLY 11 2.524 -4.019 9.181
84 HA3 GLY 11 1HA GLY 11 3.821 -4.963 9.884
85 H ASP 12 H ASP 12 3.604 -5.298 6.456
86 HA ASP 12 HA ASP 12 6.159 -4.141 5.994
87 HB2 ASP 12 2HB ASP 12 5.044 -5.813 4.491
88 HB3 ASP 12 1HB ASP 12 3.933 -4.562 3.965
89 H THR 13 H THR 13 6.644 -2.027 6.205
90 HA THR 13 HA THR 13 4.639 0.023 6.349
91 HB THR 13 HB THR 13 7.677 0.270 6.441
92 HG1 THR 13 HG1 THR 13 5.943 -0.786 8.162
93 HG21 THR 13 3HG2 THR 13 7.259 2.455 7.549
94 HG22 THR 13 1HG2 THR 13 5.522 2.256 7.298
95 HG23 THR 13 2HG2 THR 13 6.600 2.450 5.913
96 H VAL 14 H VAL 14 3.771 0.753 4.581
97 HA VAL 14 HA VAL 14 5.335 1.452 2.179
98 HB VAL 14 HB VAL 14 3.473 0.675 0.745
99 HG11 VAL 14 1HG1 VAL 14 5.284 -0.926 1.173
100 HG12 VAL 14 2HG1 VAL 14 3.748 -1.763 0.966
101 HG13 VAL 14 3HG1 VAL 14 4.426 -1.550 2.584
102 HG21 VAL 14 3HG2 VAL 14 1.585 -0.653 1.655
103 HG22 VAL 14 1HG2 VAL 14 1.595 0.988 2.309
104 HG23 VAL 14 2HG2 VAL 14 2.167 -0.360 3.297
105 H TRP 15 H TRP 15 3.989 2.883 0.763
106 HA TRP 15 HA TRP 15 2.132 4.680 2.186
107 HB2 TRP 15 2HB TRP 15 4.088 5.322 -0.079
108 HB3 TRP 15 1HB TRP 15 2.893 6.453 0.550
109 HD1 TRP 15 HD1 TRP 15 3.632 5.560 3.722
110 HE1 TRP 15 HE1 TRP 15 5.710 6.659 4.746
111 HE3 TRP 15 HE3 TRP 15 6.025 6.995 -0.574
112 HZ2 TRP 15 HZ2 TRP 15 8.030 7.982 3.885
113 HZ3 TRP 15 HZ3 TRP 15 8.179 8.179 -0.380
114 HH2 TRP 15 HH2 TRP 15 9.165 8.660 1.807
115 H VAL 16 H VAL 16 0.337 5.400 0.883
116 HA VAL 16 HA VAL 16 -0.315 3.679 -1.418
117 HB VAL 16 HB VAL 16 -2.154 5.135 0.536
118 HG11 VAL 16 1HG1 VAL 16 -2.971 3.748 -2.055
119 HG12 VAL 16 2HG1 VAL 16 -3.109 5.476 -1.722
120 HG13 VAL 16 3HG1 VAL 16 -4.087 4.323 -0.812
121 HG21 VAL 16 3HG2 VAL 16 -1.904 2.201 -0.235
122 HG22 VAL 16 1HG2 VAL 16 -3.043 2.858 0.945
123 HG23 VAL 16 2HG2 VAL 16 -1.307 2.928 1.258
124 H ARG 17 H ARG 17 0.201 4.562 -3.130
125 HA ARG 17 HA ARG 17 0.520 7.370 -3.716
126 HB2 ARG 17 2HB ARG 17 2.150 5.629 -4.368
127 HB3 ARG 17 1HB ARG 17 0.902 4.748 -5.237
128 HG2 ARG 17 2HG ARG 17 0.788 6.698 -6.854
129 HG3 ARG 17 1HG ARG 17 2.202 7.372 -6.027
130 HD2 ARG 17 2HD ARG 17 3.441 5.254 -6.494
131 HD3 ARG 17 1HD ARG 17 2.040 4.654 -7.383
132 HE ARG 17 HE ARG 17 3.043 7.147 -8.393
133 HH11 ARG 17 1HH1 ARG 17 3.439 3.652 -8.527
134 HH12 ARG 17 2HH1 ARG 17 4.204 3.674 -10.079
135 HH21 ARG 17 1HH2 ARG 17 4.130 7.159 -10.402
136 HH22 ARG 17 2HH2 ARG 17 4.592 5.664 -11.141
137 H ARG 18 H ARG 18 -1.582 8.256 -3.806
138 HA ARG 18 HA ARG 18 -3.418 7.328 -5.896
139 HB2 ARG 18 2HB ARG 18 -4.062 6.049 -3.873
140 HB3 ARG 18 1HB ARG 18 -4.188 7.543 -2.948
141 HG2 ARG 18 2HG ARG 18 -6.050 8.275 -4.414
142 HG3 ARG 18 1HG ARG 18 -5.929 6.762 -5.310
143 HD2 ARG 18 2HD ARG 18 -6.644 5.493 -3.378
144 HD3 ARG 18 1HD ARG 18 -6.545 6.922 -2.344
145 HE ARG 18 HE ARG 18 -8.350 7.184 -4.586
146 HH11 ARG 18 1HH1 ARG 18 -8.119 6.156 -1.232
147 HH12 ARG 18 2HH1 ARG 18 -9.811 6.369 -0.931
148 HH21 ARG 18 1HH2 ARG 18 -10.542 7.504 -4.142
149 HH22 ARG 18 2HH2 ARG 18 -11.178 7.128 -2.579
150 H HIS 19 H HIS 19 -4.904 8.916 -6.584
151 HA HIS 19 HA HIS 19 -5.022 11.521 -5.325
152 HB2 HIS 19 2HB HIS 19 -2.911 11.468 -6.814
153 HB3 HIS 19 1HB HIS 19 -3.991 11.360 -8.196
154 HD1 HIS 19 HD1 HIS 19 -5.283 13.501 -8.830
155 HD2 HIS 19 HD2 HIS 19 -2.778 13.958 -5.567
156 HE1 HIS 19 HE1 HIS 19 -5.196 15.963 -8.388
157 HE2 HIS 19 HE2 HIS 19 -3.768 16.202 -6.332
158 H GLN 20 H GLN 20 -6.985 12.441 -5.714
159 HA GLN 20 HA GLN 20 -9.054 11.196 -7.183
160 HB2 GLN 20 2HB GLN 20 -8.832 14.133 -6.352
161 HB3 GLN 20 1HB GLN 20 -10.315 13.324 -6.851
162 HG2 GLN 20 2HG GLN 20 -8.692 12.730 -4.361
163 HG3 GLN 20 1HG GLN 20 -10.232 13.583 -4.427
164 HE21 GLN 20 1HE2 GLN 20 -11.448 11.720 -6.374
165 HE22 GLN 20 2HE2 GLN 20 -11.759 10.270 -5.498
166 H THR 21 H THR 21 -9.930 11.706 -9.269
167 HA THR 21 HA THR 21 -7.914 12.129 -11.238
168 HB THR 21 HB THR 21 -9.840 11.876 -12.881
169 HG1 THR 21 HG1 THR 21 -11.835 11.993 -12.171
170 HG21 THR 21 3HG2 THR 21 -8.632 9.875 -12.066
171 HG22 THR 21 1HG2 THR 21 -10.346 9.528 -12.312
172 HG23 THR 21 2HG2 THR 21 -9.721 9.774 -10.681
173 H LYS 22 H LYS 22 -7.142 14.209 -10.792
174 HA LYS 22 HA LYS 22 -8.741 16.512 -11.753
175 HB2 LYS 22 2HB LYS 22 -6.304 16.490 -9.914
176 HB3 LYS 22 1HB LYS 22 -7.176 17.933 -10.433
177 HG2 LYS 22 2HG LYS 22 -9.175 17.183 -9.213
178 HG3 LYS 22 1HG LYS 22 -8.337 15.701 -8.722
179 HD2 LYS 22 2HD LYS 22 -6.682 17.060 -7.465
180 HD3 LYS 22 1HD LYS 22 -7.507 18.540 -7.966
181 HE2 LYS 22 2HE LYS 22 -8.724 16.342 -6.254
182 HE3 LYS 22 1HE LYS 22 -8.099 17.877 -5.649
183 HZ1 LYS 22 3HZ LYS 22 -9.776 19.026 -6.972
184 HZ2 LYS 22 1HZ LYS 22 -10.489 17.950 -5.884
185 HZ3 LYS 22 2HZ LYS 22 -10.387 17.555 -7.521
186 H ASN 23 H ASN 23 -6.701 14.357 -12.966
187 HA ASN 23 HA ASN 23 -5.121 14.141 -14.550
188 HB2 ASN 23 2HB ASN 23 -6.517 15.853 -15.791
189 HB3 ASN 23 1HB ASN 23 -5.447 17.107 -15.175
190 HD21 ASN 23 1HD2 ASN 23 -4.791 17.724 -17.258
191 HD22 ASN 23 2HD2 ASN 23 -3.753 16.752 -18.236
192 H LEU 24 H LEU 24 -4.626 15.588 -11.759
193 HA LEU 24 HA LEU 24 -1.874 16.528 -12.122
194 HB2 LEU 24 2HB LEU 24 -3.541 16.406 -9.580
195 HB3 LEU 24 1HB LEU 24 -2.035 17.275 -9.798
196 HG LEU 24 HG LEU 24 -4.688 17.965 -11.132
197 HD11 LEU 24 1HD1 LEU 24 -4.689 19.955 -9.687
198 HD12 LEU 24 2HD1 LEU 24 -3.231 19.373 -8.875
199 HD13 LEU 24 3HD1 LEU 24 -4.738 18.463 -8.751
200 HD21 LEU 24 3HD2 LEU 24 -2.020 19.409 -11.275
201 HD22 LEU 24 1HD2 LEU 24 -3.556 20.022 -11.901
202 HD23 LEU 24 2HD2 LEU 24 -2.843 18.570 -12.595
203 H GLU 25 H GLU 25 -0.203 15.661 -10.583
204 HA GLU 25 HA GLU 25 0.136 12.907 -11.144
205 HB2 GLU 25 2HB GLU 25 1.784 14.660 -9.272
206 HB3 GLU 25 1HB GLU 25 2.307 13.133 -9.981
207 HG2 GLU 25 2HG GLU 25 2.176 14.153 -12.242
208 HG3 GLU 25 1HG GLU 25 1.684 15.681 -11.514
209 HA PRO 26 HA PRO 26 -1.614 10.792 -7.566
210 HB2 PRO 26 2HB PRO 26 0.062 8.577 -7.388
211 HB3 PRO 26 1HB PRO 26 -1.248 8.748 -8.573
212 HG2 PRO 26 2HG PRO 26 1.684 9.274 -8.934
213 HG3 PRO 26 1HG PRO 26 0.551 8.442 -10.024
214 HD2 PRO 26 2HD PRO 26 1.278 10.997 -10.473
215 HD3 PRO 26 1HD PRO 26 -0.379 10.446 -10.811
216 H ARG 27 H ARG 27 -1.437 10.907 -5.367
217 HA ARG 27 HA ARG 27 1.083 12.028 -4.268
218 HB2 ARG 27 2HB ARG 27 -0.829 13.606 -4.326
219 HB3 ARG 27 1HB ARG 27 -1.797 12.484 -3.379
220 HG2 ARG 27 2HG ARG 27 -0.277 12.773 -1.458
221 HG3 ARG 27 1HG ARG 27 0.745 13.846 -2.419
222 HD2 ARG 27 2HD ARG 27 -2.134 14.364 -1.605
223 HD3 ARG 27 1HD ARG 27 -0.701 15.136 -0.919
224 HE ARG 27 HE ARG 27 -1.385 15.442 -3.784
225 HH11 ARG 27 1HH1 ARG 27 -0.719 16.964 -0.674
226 HH12 ARG 27 2HH1 ARG 27 -0.684 18.567 -1.341
227 HH21 ARG 27 1HH2 ARG 27 -1.351 17.531 -4.629
228 HH22 ARG 27 2HH2 ARG 27 -1.044 18.887 -3.590
229 H TRP 28 H TRP 28 2.042 10.978 -2.611
230 HA TRP 28 HA TRP 28 0.987 8.444 -1.698
231 HB2 TRP 28 2HB TRP 28 3.115 8.194 -0.502
232 HB3 TRP 28 1HB TRP 28 3.412 8.717 -2.152
233 HD1 TRP 28 HD1 TRP 28 4.279 11.308 -2.467
234 HE1 TRP 28 HE1 TRP 28 5.621 12.816 -0.877
235 HE3 TRP 28 HE3 TRP 28 3.414 8.847 1.942
236 HZ2 TRP 28 HZ2 TRP 28 6.237 12.958 1.863
237 HZ3 TRP 28 HZ3 TRP 28 4.417 9.739 4.007
238 HH2 TRP 28 HH2 TRP 28 5.805 11.751 3.968
239 H LYS 29 H LYS 29 0.115 7.969 0.264
240 HA LYS 29 HA LYS 29 0.453 9.868 2.533
241 HB2 LYS 29 2HB LYS 29 -1.991 8.110 2.017
242 HB3 LYS 29 1HB LYS 29 -1.733 9.111 3.446
243 HG2 LYS 29 2HG LYS 29 -1.827 11.142 2.010
244 HG3 LYS 29 1HG LYS 29 -2.143 10.116 0.604
245 HD2 LYS 29 2HD LYS 29 -3.916 10.425 3.067
246 HD3 LYS 29 1HD LYS 29 -4.244 11.054 1.450
247 HE2 LYS 29 2HE LYS 29 -4.086 8.112 2.214
248 HE3 LYS 29 1HE LYS 29 -5.558 9.025 1.889
249 HZ1 LYS 29 3HZ LYS 29 -3.395 8.574 -0.093
250 HZ2 LYS 29 1HZ LYS 29 -4.891 9.309 -0.371
251 HZ3 LYS 29 2HZ LYS 29 -4.818 7.670 0.009
252 H GLY 30 H GLY 30 0.749 8.772 4.607
253 HA2 GLY 30 2HA GLY 30 0.740 5.934 4.840
254 HA3 GLY 30 1HA GLY 30 2.362 6.507 4.535
255 HA PRO 31 HA PRO 31 2.947 4.893 5.757
256 HB2 PRO 31 2HB PRO 31 3.992 3.556 7.858
257 HB3 PRO 31 1HB PRO 31 4.670 5.113 7.334
258 HG2 PRO 31 2HG PRO 31 2.976 4.512 9.712
259 HG3 PRO 31 1HG PRO 31 4.237 5.742 9.505
260 HD2 PRO 31 2HD PRO 31 1.404 6.128 9.269
261 HD3 PRO 31 1HD PRO 31 2.675 7.316 8.923
262 H TYR 32 H TYR 32 1.396 3.595 4.901
263 HA TYR 32 HA TYR 32 -0.578 2.141 6.446
264 HB2 TYR 32 2HB TYR 32 0.200 2.090 3.500
265 HB3 TYR 32 1HB TYR 32 -1.041 1.039 4.169
266 HD1 TYR 32 HD2 TYR 32 -0.160 4.621 3.594
267 HD2 TYR 32 HD1 TYR 32 -3.283 1.847 4.513
268 HE1 TYR 32 HE2 TYR 32 -1.829 6.386 3.254
269 HE2 TYR 32 HE1 TYR 32 -4.954 3.616 4.170
270 HH TYR 32 HH TYR 32 -5.014 6.148 4.248
271 H THR 33 H THR 33 -0.689 -0.246 6.453
272 HA THR 33 HA THR 33 1.980 -1.547 6.387
273 HB THR 33 HB THR 33 1.208 -2.857 8.428
274 HG1 THR 33 HG1 THR 33 -0.500 -1.768 9.655
275 HG21 THR 33 3HG2 THR 33 2.798 -0.985 8.692
276 HG22 THR 33 1HG2 THR 33 1.697 -1.073 10.066
277 HG23 THR 33 2HG2 THR 33 1.452 0.153 8.819
278 H VAL 34 H VAL 34 1.930 -3.005 4.803
279 HA VAL 34 HA VAL 34 -0.429 -4.344 3.871
280 HB VAL 34 HB VAL 34 2.492 -4.995 3.247
281 HG11 VAL 34 1HG1 VAL 34 1.016 -6.882 2.702
282 HG12 VAL 34 2HG1 VAL 34 1.624 -6.130 1.226
283 HG13 VAL 34 3HG1 VAL 34 -0.030 -5.815 1.758
284 HG21 VAL 34 3HG2 VAL 34 2.200 -3.690 1.180
285 HG22 VAL 34 1HG2 VAL 34 1.956 -2.684 2.609
286 HG23 VAL 34 2HG2 VAL 34 0.566 -3.245 1.678
287 H LEU 35 H LEU 35 -1.320 -6.066 4.724
288 HA LEU 35 HA LEU 35 0.014 -7.722 6.739
289 HB2 LEU 35 2HB LEU 35 -2.884 -7.668 5.797
290 HB3 LEU 35 1HB LEU 35 -2.269 -8.629 7.137
291 HG LEU 35 HG LEU 35 -2.380 -5.580 7.042
292 HD11 LEU 35 1HD1 LEU 35 -4.031 -7.521 8.687
293 HD12 LEU 35 2HD1 LEU 35 -4.596 -6.578 7.308
294 HD13 LEU 35 3HD1 LEU 35 -4.090 -5.756 8.779
295 HD21 LEU 35 3HD2 LEU 35 -1.662 -5.644 9.395
296 HD22 LEU 35 1HD2 LEU 35 -0.436 -6.321 8.327
297 HD23 LEU 35 2HD2 LEU 35 -1.451 -7.395 9.294
298 H LEU 36 H LEU 36 -1.282 -7.868 3.469
299 HA LEU 36 HA LEU 36 0.000 -10.454 2.991
300 HB2 LEU 36 2HB LEU 36 -2.281 -11.054 3.770
301 HB3 LEU 36 1HB LEU 36 -2.983 -10.015 2.546
302 HG LEU 36 HG LEU 36 -1.970 -11.533 0.773
303 HD11 LEU 36 1HD1 LEU 36 -1.346 -13.346 3.120
304 HD12 LEU 36 2HD1 LEU 36 -0.174 -12.530 2.081
305 HD13 LEU 36 3HD1 LEU 36 -1.222 -13.774 1.409
306 HD21 LEU 36 3HD2 LEU 36 -4.330 -11.713 1.397
307 HD22 LEU 36 1HD2 LEU 36 -3.922 -12.845 2.689
308 HD23 LEU 36 2HD2 LEU 36 -3.661 -13.295 1.001
309 H THR 37 H THR 37 0.561 -10.718 0.873
310 HA THR 37 HA THR 37 -0.067 -8.553 -1.039
311 HB THR 37 HB THR 37 2.001 -9.186 -2.247
312 HG1 THR 37 HG1 THR 37 1.874 -11.371 -0.634
313 HG21 THR 37 3HG2 THR 37 2.188 -7.480 -0.460
314 HG22 THR 37 1HG2 THR 37 3.676 -8.418 -0.614
315 HG23 THR 37 2HG2 THR 37 2.558 -8.749 0.711
316 H THR 38 H THR 38 -0.834 -9.113 -2.995
317 HA THR 38 HA THR 38 -1.244 -11.931 -3.786
318 HB THR 38 HB THR 38 -3.352 -9.694 -3.883
319 HG1 THR 38 HG1 THR 38 -2.947 -11.842 -2.101
320 HG21 THR 38 3HG2 THR 38 -3.673 -11.268 -5.754
321 HG22 THR 38 1HG2 THR 38 -4.973 -11.428 -4.567
322 HG23 THR 38 2HG2 THR 38 -3.672 -12.622 -4.625
323 HA PRO 39 HA PRO 39 0.611 -10.549 -7.739
324 HB2 PRO 39 2HB PRO 39 -1.601 -11.491 -9.397
325 HB3 PRO 39 1HB PRO 39 -0.013 -12.240 -9.160
326 HG2 PRO 39 2HG PRO 39 -2.585 -12.825 -7.800
327 HG3 PRO 39 1HG PRO 39 -1.198 -13.894 -8.093
328 HD2 PRO 39 2HD PRO 39 -1.697 -12.991 -5.630
329 HD3 PRO 39 1HD PRO 39 -0.018 -13.109 -6.207
330 H THR 40 H THR 40 0.585 -8.395 -7.713
331 HA THR 40 HA THR 40 0.210 -6.277 -8.306
332 HB THR 40 HB THR 40 -1.943 -7.291 -10.211
333 HG1 THR 40 HG1 THR 40 -0.401 -8.447 -11.086
334 HG21 THR 40 3HG2 THR 40 0.059 -5.015 -10.464
335 HG22 THR 40 1HG2 THR 40 -1.672 -4.829 -10.166
336 HG23 THR 40 2HG2 THR 40 -1.104 -5.497 -11.698
337 H ALA 41 H ALA 41 -1.321 -7.421 -6.064
338 HA ALA 41 HA ALA 41 -3.113 -5.193 -5.539
339 HB1 ALA 41 3HB ALA 41 -5.106 -6.593 -5.059
340 HB2 ALA 41 1HB ALA 41 -4.250 -8.023 -5.646
341 HB3 ALA 41 2HB ALA 41 -4.641 -6.708 -6.757
342 H LEU 42 H LEU 42 -2.776 -4.695 -3.392
343 HA LEU 42 HA LEU 42 -1.591 -6.757 -1.636
344 HB2 LEU 42 2HB LEU 42 -1.268 -3.740 -1.408
345 HB3 LEU 42 1HB LEU 42 -0.423 -4.965 -0.467
346 HG LEU 42 HG LEU 42 -0.047 -4.355 -3.432
347 HD11 LEU 42 1HD1 LEU 42 1.859 -4.051 -1.099
348 HD12 LEU 42 2HD1 LEU 42 1.042 -2.755 -1.977
349 HD13 LEU 42 3HD1 LEU 42 2.236 -3.750 -2.801
350 HD21 LEU 42 3HD2 LEU 42 0.131 -6.770 -3.143
351 HD22 LEU 42 1HD2 LEU 42 1.277 -6.557 -1.815
352 HD23 LEU 42 2HD2 LEU 42 1.716 -6.073 -3.455
353 H LYS 43 H LYS 43 -2.732 -7.357 0.087
354 HA LYS 43 HA LYS 43 -5.118 -5.920 0.945
355 HB2 LYS 43 2HB LYS 43 -5.012 -8.465 0.852
356 HB3 LYS 43 1HB LYS 43 -3.870 -8.423 2.194
357 HG2 LYS 43 2HG LYS 43 -5.617 -7.274 3.584
358 HG3 LYS 43 1HG LYS 43 -6.741 -7.428 2.239
359 HD2 LYS 43 2HD LYS 43 -7.285 -9.204 3.704
360 HD3 LYS 43 1HD LYS 43 -6.382 -9.957 2.385
361 HE2 LYS 43 2HE LYS 43 -5.660 -10.865 4.540
362 HE3 LYS 43 1HE LYS 43 -4.346 -9.945 3.815
363 HZ1 LYS 43 3HZ LYS 43 -6.149 -9.025 5.985
364 HZ2 LYS 43 1HZ LYS 43 -4.969 -8.064 5.248
365 HZ3 LYS 43 2HZ LYS 43 -4.516 -9.429 6.135
366 H VAL 44 H VAL 44 -4.811 -4.221 2.177
367 HA VAL 44 HA VAL 44 -2.526 -4.014 4.062
368 HB VAL 44 HB VAL 44 -3.961 -1.779 2.540
369 HG11 VAL 44 1HG1 VAL 44 -1.451 -1.620 4.233
370 HG12 VAL 44 2HG1 VAL 44 -3.038 -0.994 4.678
371 HG13 VAL 44 3HG1 VAL 44 -2.163 -0.291 3.316
372 HG21 VAL 44 3HG2 VAL 44 -1.921 -1.568 1.152
373 HG22 VAL 44 1HG2 VAL 44 -2.661 -3.164 0.973
374 HG23 VAL 44 2HG2 VAL 44 -1.220 -2.965 1.971
375 H ASP 45 H ASP 45 -2.979 -3.132 6.133
376 HA ASP 45 HA ASP 45 -5.561 -3.298 7.264
377 HB2 ASP 45 2HB ASP 45 -3.534 -3.430 8.651
378 HB3 ASP 45 1HB ASP 45 -3.075 -1.792 8.196
379 H GLY 46 H GLY 46 -7.203 -1.829 7.392
380 HA2 GLY 46 2HA GLY 46 -8.216 0.296 7.463
381 HA3 GLY 46 1HA GLY 46 -6.812 1.010 6.690
382 H ILE 47 H ILE 47 -7.224 -1.574 4.835
383 HA ILE 47 HA ILE 47 -8.834 -0.134 2.829
384 HB ILE 47 HB ILE 47 -6.897 -2.475 2.558
385 HG12 ILE 47 2HG1 ILE 47 -5.704 -0.420 3.083
386 HG13 ILE 47 1HG1 ILE 47 -5.428 -0.797 1.389
387 HG21 ILE 47 1HG2 ILE 47 -7.049 -2.175 0.102
388 HG22 ILE 47 2HG2 ILE 47 -8.334 -0.988 0.333
389 HG23 ILE 47 3HG2 ILE 47 -8.592 -2.669 0.806
390 HD11 ILE 47 3HD1 ILE 47 -7.284 1.316 2.485
391 HD12 ILE 47 1HD1 ILE 47 -7.094 0.922 0.770
392 HD13 ILE 47 2HD1 ILE 47 -5.732 1.562 1.688
393 H ALA 48 H ALA 48 -10.487 -1.181 1.642
394 HA ALA 48 HA ALA 48 -12.346 -2.718 3.043
395 HB1 ALA 48 3HB ALA 48 -12.910 -1.258 1.136
396 HB2 ALA 48 1HB ALA 48 -13.554 -2.886 0.906
397 HB3 ALA 48 2HB ALA 48 -12.106 -2.375 0.032
398 H ALA 49 H ALA 49 -10.196 -3.792 0.353
399 HA ALA 49 HA ALA 49 -9.811 -6.366 1.653
400 HB1 ALA 49 3HB ALA 49 -10.475 -7.721 -0.287
401 HB2 ALA 49 1HB ALA 49 -10.979 -6.266 -1.155
402 HB3 ALA 49 2HB ALA 49 -11.844 -6.771 0.298
403 H TRP 50 H TRP 50 -9.237 -4.768 -1.525
404 HA TRP 50 HA TRP 50 -6.331 -5.087 -1.185
405 HB2 TRP 50 2HB TRP 50 -7.898 -6.206 -3.554
406 HB3 TRP 50 1HB TRP 50 -6.173 -5.874 -3.641
407 HD1 TRP 50 HD1 TRP 50 -4.558 -7.412 -2.022
408 HE1 TRP 50 HE1 TRP 50 -4.855 -9.825 -1.207
409 HE3 TRP 50 HE3 TRP 50 -9.572 -7.957 -2.883
410 HZ2 TRP 50 HZ2 TRP 50 -6.922 -11.719 -0.951
411 HZ3 TRP 50 HZ3 TRP 50 -10.632 -10.111 -2.331
412 HH2 TRP 50 HH2 TRP 50 -9.334 -11.956 -1.385
413 H ILE 51 H ILE 51 -5.117 -3.567 -2.182
414 HA ILE 51 HA ILE 51 -6.394 -1.597 -3.999
415 HB ILE 51 HB ILE 51 -3.962 -1.291 -2.169
416 HG12 ILE 51 2HG1 ILE 51 -6.119 -0.946 -1.028
417 HG13 ILE 51 1HG1 ILE 51 -5.235 0.567 -1.128
418 HG21 ILE 51 1HG2 ILE 51 -3.386 -0.209 -4.278
419 HG22 ILE 51 2HG2 ILE 51 -3.690 1.021 -3.051
420 HG23 ILE 51 3HG2 ILE 51 -4.913 0.681 -4.278
421 HD11 ILE 51 3HD1 ILE 51 -7.588 0.901 -1.528
422 HD12 ILE 51 1HD1 ILE 51 -7.570 -0.257 -2.857
423 HD13 ILE 51 2HD1 ILE 51 -6.680 1.265 -2.994
424 H HIS 52 H HIS 52 -5.697 -1.695 -6.082
425 HA HIS 52 HA HIS 52 -3.916 -3.570 -7.140
426 HB2 HIS 52 2HB HIS 52 -5.637 -2.268 -8.445
427 HB3 HIS 52 1HB HIS 52 -4.623 -0.841 -8.304
428 HD1 HIS 52 HD1 HIS 52 -2.387 -0.835 -9.720
429 HD2 HIS 52 HD2 HIS 52 -4.946 -4.014 -10.465
430 HE1 HIS 52 HE1 HIS 52 -1.542 -1.902 -11.829
431 HE2 HIS 52 HE2 HIS 52 -3.197 -3.731 -12.325
432 H ALA 53 H ALA 53 -1.710 -3.634 -7.239
433 HA ALA 53 HA ALA 53 -0.304 -2.277 -5.250
434 HB1 ALA 53 3HB ALA 53 0.178 -4.577 -5.975
435 HB2 ALA 53 1HB ALA 53 1.638 -3.582 -5.941
436 HB3 ALA 53 2HB ALA 53 0.860 -3.963 -7.482
437 H ALA 54 H ALA 54 -0.632 -1.320 -8.582
438 HA ALA 54 HA ALA 54 1.616 0.352 -8.866
439 HB1 ALA 54 3HB ALA 54 -1.135 0.662 -10.095
440 HB2 ALA 54 1HB ALA 54 0.184 -0.307 -10.751
441 HB3 ALA 54 2HB ALA 54 0.338 1.450 -10.663
442 H HIS 55 H HIS 55 -1.280 0.758 -7.051
443 HA HIS 55 HA HIS 55 -0.870 3.615 -6.524
444 HB2 HIS 55 2HB HIS 55 -3.147 1.752 -5.696
445 HB3 HIS 55 1HB HIS 55 -3.086 3.486 -5.389
446 HD1 HIS 55 HD1 HIS 55 -3.142 5.038 -7.573
447 HD2 HIS 55 HD2 HIS 55 -4.166 1.052 -8.151
448 HE1 HIS 55 HE1 HIS 55 -4.342 4.965 -9.779
449 HE2 HIS 55 HE2 HIS 55 -5.086 2.573 -10.023
450 H VAL 56 H VAL 56 0.641 1.084 -5.442
451 HA VAL 56 HA VAL 56 0.917 2.158 -2.698
452 HB VAL 56 HB VAL 56 1.178 -0.820 -3.385
453 HG11 VAL 56 1HG1 VAL 56 2.595 -0.128 -1.503
454 HG12 VAL 56 2HG1 VAL 56 1.281 -1.153 -0.929
455 HG13 VAL 56 3HG1 VAL 56 1.203 0.593 -0.691
456 HG21 VAL 56 3HG2 VAL 56 -0.901 -1.223 -2.110
457 HG22 VAL 56 1HG2 VAL 56 -1.200 -0.209 -3.525
458 HG23 VAL 56 2HG2 VAL 56 -1.123 0.518 -1.920
459 H LYS 57 H LYS 57 3.102 2.057 -1.934
460 HA LYS 57 HA LYS 57 5.241 1.056 -3.642
461 HB2 LYS 57 2HB LYS 57 4.798 3.404 -4.443
462 HB3 LYS 57 1HB LYS 57 5.091 3.989 -2.807
463 HG2 LYS 57 2HG LYS 57 7.436 2.965 -3.008
464 HG3 LYS 57 1HG LYS 57 7.085 2.734 -4.722
465 HD2 LYS 57 2HD LYS 57 8.342 4.794 -4.442
466 HD3 LYS 57 1HD LYS 57 6.692 5.199 -4.931
467 HE2 LYS 57 2HE LYS 57 7.522 6.680 -3.117
468 HE3 LYS 57 1HE LYS 57 6.117 5.747 -2.599
469 HZ1 LYS 57 3HZ LYS 57 7.855 5.787 -0.916
470 HZ2 LYS 57 1HZ LYS 57 8.953 5.086 -1.990
471 HZ3 LYS 57 2HZ LYS 57 7.606 4.211 -1.464
472 H ALA 58 H ALA 58 6.875 0.278 -2.320
473 HA ALA 58 HA ALA 58 6.563 0.091 0.471
474 HB1 ALA 58 3HB ALA 58 7.836 -1.549 -0.850
475 HB2 ALA 58 1HB ALA 58 8.806 -0.924 0.486
476 HB3 ALA 58 2HB ALA 58 9.084 -0.344 -1.158
477 H ALA 59 H ALA 59 7.838 0.967 2.186
478 HA ALA 59 HA ALA 59 9.128 3.594 1.696
479 HB1 ALA 59 3HB ALA 59 6.813 3.961 2.485
480 HB2 ALA 59 1HB ALA 59 7.983 4.479 3.702
481 HB3 ALA 59 2HB ALA 59 7.122 2.948 3.895
482 H ASP 60 H ASP 60 10.544 4.256 3.520
483 HA ASP 60 HA ASP 60 11.787 1.974 4.901
484 HB2 ASP 60 2HB ASP 60 13.263 3.606 3.639
485 HB3 ASP 60 1HB ASP 60 12.797 4.863 4.777
486 HA PRO 61 HA PRO 61 9.335 3.468 8.480
487 HB2 PRO 61 2HB PRO 61 9.852 1.321 10.119
488 HB3 PRO 61 1HB PRO 61 8.661 1.253 8.803
489 HG2 PRO 61 2HG PRO 61 11.500 0.268 8.823
490 HG3 PRO 61 1HG PRO 61 10.032 -0.541 8.219
491 HD2 PRO 61 2HD PRO 61 11.753 0.740 6.548
492 HD3 PRO 61 1HD PRO 61 10.011 0.672 6.231
493 H GLY 62 H GLY 62 12.728 2.895 8.150
494 HA2 GLY 62 2HA GLY 62 14.518 3.914 9.197
495 HA3 GLY 62 1HA GLY 62 13.426 4.635 10.373
496 H GLY 63 H GLY 63 12.245 2.734 11.687
497 HA2 GLY 63 2HA GLY 63 13.082 0.245 12.229
498 HA3 GLY 63 1HA GLY 63 14.304 1.204 13.070
499 H GLY 64 H GLY 64 13.338 -0.021 14.891
500 HA2 GLY 64 2HA GLY 64 12.275 -0.001 16.892
501 HA3 GLY 64 1HA GLY 64 12.037 1.712 16.618
502 HA PRO 65 HA PRO 65 7.739 0.053 16.814
503 HB2 PRO 65 2HB PRO 65 6.939 2.648 17.943
504 HB3 PRO 65 1HB PRO 65 7.028 1.078 18.759
505 HG2 PRO 65 2HG PRO 65 8.693 3.150 19.365
506 HG3 PRO 65 1HG PRO 65 9.163 1.444 19.543
507 HD2 PRO 65 2HD PRO 65 9.781 3.333 17.265
508 HD3 PRO 65 1HD PRO 65 10.874 2.223 18.131
509 H SER 66 H SER 66 8.815 1.202 14.320
510 HA SER 66 HA SER 66 6.534 2.818 13.355
511 HB2 SER 66 2HB SER 66 8.829 3.624 12.812
512 HB3 SER 66 1HB SER 66 9.146 2.121 11.944
513 HG SER 66 HG SER 66 6.834 3.420 11.184
514 H SER 67 H SER 67 8.497 0.168 11.943
515 HA SER 67 HA SER 67 6.312 -0.989 10.505
516 HB2 SER 67 2HB SER 67 8.017 -2.868 10.122
517 HB3 SER 67 1HB SER 67 8.521 -1.261 9.597
518 HG SER 67 HG SER 67 10.216 -2.076 10.738
519 H ARG 68 H ARG 68 7.544 -1.306 13.697
520 HA ARG 68 HA ARG 68 6.859 -4.011 14.249
521 HB2 ARG 68 2HB ARG 68 8.676 -2.748 15.357
522 HB3 ARG 68 1HB ARG 68 7.487 -1.698 16.119
523 HG2 ARG 68 2HG ARG 68 6.659 -3.521 17.490
524 HG3 ARG 68 1HG ARG 68 7.645 -4.692 16.606
525 HD2 ARG 68 2HD ARG 68 8.696 -2.424 18.331
526 HD3 ARG 68 1HD ARG 68 8.664 -4.132 18.780
527 HE ARG 68 HE ARG 68 10.119 -4.359 16.626
528 HH11 ARG 68 1HH1 ARG 68 10.364 -1.754 18.978
529 HH12 ARG 68 2HH1 ARG 68 12.037 -1.469 18.667
530 HH21 ARG 68 1HH2 ARG 68 12.307 -3.950 16.207
531 HH22 ARG 68 2HH2 ARG 68 13.152 -2.720 17.083
532 H LEU 69 H LEU 69 5.158 -0.926 14.711
533 HA LEU 69 HA LEU 69 3.114 -2.050 16.439
534 HB2 LEU 69 2HB LEU 69 3.255 0.667 15.074
535 HB3 LEU 69 1HB LEU 69 1.997 0.183 16.201
536 HG LEU 69 HG LEU 69 4.936 0.627 16.825
537 HD11 LEU 69 1HD1 LEU 69 2.462 2.100 17.789
538 HD12 LEU 69 2HD1 LEU 69 3.635 2.686 16.606
539 HD13 LEU 69 3HD1 LEU 69 4.131 2.427 18.274
540 HD21 LEU 69 3HD2 LEU 69 4.397 0.098 19.172
541 HD22 LEU 69 1HD2 LEU 69 4.186 -1.297 18.119
542 HD23 LEU 69 2HD2 LEU 69 2.773 -0.406 18.693
543 H THR 70 H THR 70 2.565 -3.777 14.940
544 HA THR 70 HA THR 70 0.196 -3.115 13.402
545 HB THR 70 HB THR 70 2.313 -4.843 12.036
546 HG1 THR 70 HG1 THR 70 1.885 -2.052 11.863
547 HG21 THR 70 3HG2 THR 70 -0.043 -5.204 11.324
548 HG22 THR 70 1HG2 THR 70 0.917 -4.480 10.032
549 HG23 THR 70 2HG2 THR 70 -0.195 -3.481 10.967
550 H TRP 71 H TRP 71 -1.178 -4.917 13.107
551 HA TRP 71 HA TRP 71 -1.432 -6.901 14.999
552 HB2 TRP 71 2HB TRP 71 -2.325 -7.220 12.097
553 HB3 TRP 71 1HB TRP 71 -3.071 -7.928 13.527
554 HD1 TRP 71 HD1 TRP 71 -3.179 -4.873 11.331
555 HE1 TRP 71 HE1 TRP 71 -4.932 -3.211 12.204
556 HE3 TRP 71 HE3 TRP 71 -4.154 -7.013 15.895
557 HZ2 TRP 71 HZ2 TRP 71 -6.511 -2.835 14.504
558 HZ3 TRP 71 HZ3 TRP 71 -5.806 -5.926 17.374
559 HH2 TRP 71 HH2 TRP 71 -6.959 -3.879 16.689
560 H ARG 72 H ARG 72 -0.261 -8.673 15.421
561 HA ARG 72 HA ARG 72 1.953 -9.449 13.676
562 HB2 ARG 72 2HB ARG 72 2.766 -10.672 15.684
563 HB3 ARG 72 1HB ARG 72 2.424 -8.982 16.036
564 HG2 ARG 72 2HG ARG 72 0.266 -9.633 17.073
565 HG3 ARG 72 1HG ARG 72 0.612 -11.328 16.723
566 HD2 ARG 72 2HD ARG 72 2.606 -11.203 18.200
567 HD3 ARG 72 1HD ARG 72 2.212 -9.523 18.575
568 HE ARG 72 HE ARG 72 -0.026 -10.579 19.354
569 HH11 ARG 72 1HH1 ARG 72 3.132 -12.057 19.796
570 HH12 ARG 72 2HH1 ARG 72 2.666 -12.919 21.224
571 HH21 ARG 72 1HH2 ARG 72 -0.640 -11.715 21.203
572 HH22 ARG 72 2HH2 ARG 72 0.504 -12.721 22.029
573 H VAL 73 H VAL 73 -0.515 -10.200 12.625
574 HA VAL 73 HA VAL 73 -1.697 -12.618 13.269
575 HB VAL 73 HB VAL 73 -1.371 -11.426 10.466
576 HG11 VAL 73 1HG1 VAL 73 -2.185 -13.747 10.331
577 HG12 VAL 73 2HG1 VAL 73 -3.452 -12.614 9.863
578 HG13 VAL 73 3HG1 VAL 73 -3.494 -13.373 11.455
579 HG21 VAL 73 3HG2 VAL 73 -3.526 -10.287 10.850
580 HG22 VAL 73 1HG2 VAL 73 -2.325 -9.790 12.047
581 HG23 VAL 73 2HG2 VAL 73 -3.590 -10.937 12.492
582 H GLN 74 H GLN 74 0.836 -12.076 10.841
583 HA GLN 74 HA GLN 74 1.797 -14.862 11.099
584 HB2 GLN 74 2HB GLN 74 1.279 -13.278 8.542
585 HB3 GLN 74 1HB GLN 74 2.310 -14.702 8.568
586 HG2 GLN 74 2HG GLN 74 -0.631 -14.685 9.323
587 HG3 GLN 74 1HG GLN 74 0.012 -15.150 7.746
588 HE21 GLN 74 1HE2 GLN 74 -0.400 -16.113 11.064
589 HE22 GLN 74 2HE2 GLN 74 0.155 -17.736 10.880
590 H ARG 75 H ARG 75 2.741 -12.399 12.390
591 HA ARG 75 HA ARG 75 5.058 -11.384 11.050
592 HB2 ARG 75 2HB ARG 75 3.901 -10.060 12.784
593 HB3 ARG 75 1HB ARG 75 4.313 -11.259 14.003
594 HG2 ARG 75 2HG ARG 75 5.788 -9.350 14.225
595 HG3 ARG 75 1HG ARG 75 6.723 -10.740 13.679
596 HD2 ARG 75 2HD ARG 75 7.486 -8.827 12.443
597 HD3 ARG 75 1HD ARG 75 6.554 -9.823 11.326
598 HE ARG 75 HE ARG 75 4.720 -8.247 11.548
599 HH11 ARG 75 1HH1 ARG 75 7.837 -7.079 12.719
600 HH12 ARG 75 2HH1 ARG 75 7.390 -5.411 12.585
601 HH21 ARG 75 1HH2 ARG 75 4.160 -6.060 11.401
602 HH22 ARG 75 2HH2 ARG 75 5.296 -4.838 11.835
603 H SER 76 H SER 76 6.277 -13.029 10.387
604 HA SER 76 HA SER 76 8.076 -14.373 12.182
605 HB2 SER 76 2HB SER 76 7.410 -16.690 11.273
606 HB3 SER 76 1HB SER 76 6.283 -15.970 12.421
607 HG SER 76 HG SER 76 5.559 -15.172 10.001
608 H GLN 77 H GLN 77 9.958 -14.272 11.150
609 HA GLN 77 HA GLN 77 10.030 -13.512 8.343
610 HB2 GLN 77 2HB GLN 77 12.321 -13.643 10.352
611 HB3 GLN 77 1HB GLN 77 12.339 -12.845 8.783
612 HG2 GLN 77 2HG GLN 77 10.795 -12.012 11.260
613 HG3 GLN 77 1HG GLN 77 12.120 -11.152 10.483
614 HE21 GLN 77 1HE2 GLN 77 11.687 -10.082 8.462
615 HE22 GLN 77 2HE2 GLN 77 10.080 -9.608 8.047
616 H ASN 78 H ASN 78 9.219 -15.776 7.944
617 HA ASN 78 HA ASN 78 11.355 -17.358 6.853
618 HB2 ASN 78 2HB ASN 78 11.281 -18.347 9.131
619 HB3 ASN 78 1HB ASN 78 9.561 -18.648 8.973
620 HD21 ASN 78 1HD2 ASN 78 12.745 -19.754 8.144
621 HD22 ASN 78 2HD2 ASN 78 12.262 -21.236 7.400
622 HA PRO 79 HA PRO 79 7.152 -18.688 4.842
623 HB2 PRO 79 2HB PRO 79 4.745 -17.775 5.800
624 HB3 PRO 79 1HB PRO 79 5.499 -19.265 6.405
625 HG2 PRO 79 2HG PRO 79 5.525 -16.520 7.624
626 HG3 PRO 79 1HG PRO 79 5.245 -18.094 8.406
627 HD2 PRO 79 2HD PRO 79 7.661 -16.843 8.507
628 HD3 PRO 79 1HD PRO 79 7.514 -18.613 8.487
629 H LEU 80 H LEU 80 7.154 -15.467 6.352
630 HA LEU 80 HA LEU 80 6.316 -14.199 3.815
631 HB2 LEU 80 2HB LEU 80 6.354 -12.988 6.607
632 HB3 LEU 80 1HB LEU 80 5.721 -12.238 5.147
633 HG LEU 80 HG LEU 80 4.536 -14.539 6.738
634 HD11 LEU 80 1HD1 LEU 80 2.564 -13.070 6.853
635 HD12 LEU 80 2HD1 LEU 80 3.444 -11.820 5.969
636 HD13 LEU 80 3HD1 LEU 80 3.996 -12.334 7.566
637 HD21 LEU 80 3HD2 LEU 80 4.324 -15.207 4.412
638 HD22 LEU 80 1HD2 LEU 80 3.659 -13.629 3.979
639 HD23 LEU 80 2HD2 LEU 80 2.751 -14.717 5.033
640 H LYS 81 H LYS 81 7.793 -13.112 2.698
641 HA LYS 81 HA LYS 81 10.373 -12.311 3.914
642 HB2 LYS 81 2HB LYS 81 9.867 -13.291 1.067
643 HB3 LYS 81 1HB LYS 81 11.430 -12.817 1.740
644 HG2 LYS 81 2HG LYS 81 11.347 -14.724 3.298
645 HG3 LYS 81 1HG LYS 81 9.760 -15.181 2.671
646 HD2 LYS 81 2HD LYS 81 11.504 -16.591 1.696
647 HD3 LYS 81 1HD LYS 81 10.752 -15.598 0.448
648 HE2 LYS 81 2HE LYS 81 13.202 -15.732 0.172
649 HE3 LYS 81 1HE LYS 81 12.693 -14.073 0.488
650 HZ1 LYS 81 3HZ LYS 81 13.351 -14.369 2.806
651 HZ2 LYS 81 1HZ LYS 81 14.655 -14.654 1.771
652 HZ3 LYS 81 2HZ LYS 81 13.845 -15.949 2.485
653 H ILE 82 H ILE 82 11.091 -10.291 3.436
654 HA ILE 82 HA ILE 82 9.696 -8.616 1.404
655 HB ILE 82 HB ILE 82 10.479 -6.621 2.721
656 HG12 ILE 82 2HG1 ILE 82 11.248 -8.659 4.874
657 HG13 ILE 82 1HG1 ILE 82 12.386 -7.718 3.916
658 HG21 ILE 82 1HG2 ILE 82 8.177 -7.419 2.995
659 HG22 ILE 82 2HG2 ILE 82 8.785 -6.765 4.517
660 HG23 ILE 82 3HG2 ILE 82 8.686 -8.512 4.285
661 HD11 ILE 82 3HD1 ILE 82 12.160 -6.794 6.124
662 HD12 ILE 82 1HD1 ILE 82 10.418 -6.620 5.923
663 HD13 ILE 82 2HD1 ILE 82 11.525 -5.660 4.936
664 H ARG 83 H ARG 83 11.545 -6.627 1.077
665 HA ARG 83 HA ARG 83 14.154 -7.894 0.492
666 HB2 ARG 83 2HB ARG 83 14.222 -6.780 -1.713
667 HB3 ARG 83 1HB ARG 83 12.904 -7.939 -1.612
668 HG2 ARG 83 2HG ARG 83 11.282 -6.126 -1.332
669 HG3 ARG 83 1HG ARG 83 12.582 -4.928 -1.317
670 HD2 ARG 83 2HD ARG 83 11.426 -5.056 -3.517
671 HD3 ARG 83 1HD ARG 83 13.146 -5.451 -3.634
672 HE ARG 83 HE ARG 83 11.521 -7.788 -3.283
673 HH11 ARG 83 1HH1 ARG 83 12.598 -5.523 -5.760
674 HH12 ARG 83 2HH1 ARG 83 12.399 -6.665 -7.050
675 HH21 ARG 83 1HH2 ARG 83 11.321 -9.271 -4.978
676 HH22 ARG 83 2HH2 ARG 83 11.679 -8.786 -6.606
677 H LEU 84 H LEU 84 15.694 -5.985 -0.331
678 HA LEU 84 HA LEU 84 16.173 -4.325 1.889
679 HB2 LEU 84 2HB LEU 84 17.260 -4.114 -0.945
680 HB3 LEU 84 1HB LEU 84 17.889 -3.203 0.421
681 HG LEU 84 HG LEU 84 18.010 -6.223 0.047
682 HD11 LEU 84 1HD1 LEU 84 20.235 -4.161 0.062
683 HD12 LEU 84 2HD1 LEU 84 19.607 -5.013 -1.352
684 HD13 LEU 84 3HD1 LEU 84 20.431 -5.911 -0.082
685 HD21 LEU 84 3HD2 LEU 84 19.333 -6.288 2.132
686 HD22 LEU 84 1HD2 LEU 84 17.682 -5.744 2.416
687 HD23 LEU 84 2HD2 LEU 84 19.003 -4.572 2.396
688 H THR 85 H THR 85 15.213 -2.471 2.468
689 HA THR 85 HA THR 85 13.385 -0.990 0.850
690 HB THR 85 HB THR 85 13.248 -1.121 3.366
691 HG1 THR 85 HG1 THR 85 12.116 0.645 3.210
692 HG21 THR 85 3HG2 THR 85 15.569 0.853 3.346
693 HG22 THR 85 1HG2 THR 85 15.646 -0.810 3.930
694 HG23 THR 85 2HG2 THR 85 14.635 0.369 4.763
695 H ARG 86 H ARG 86 13.770 1.573 0.824
696 HA ARG 86 HA ARG 86 15.830 2.057 -1.052
697 HB2 ARG 86 2HB ARG 86 13.796 3.767 0.340
698 HB3 ARG 86 1HB ARG 86 15.148 4.588 -0.431
699 HG2 ARG 86 2HG ARG 86 14.538 3.359 -2.567
700 HG3 ARG 86 1HG ARG 86 13.052 2.843 -1.757
701 HD2 ARG 86 2HD ARG 86 12.789 4.912 -3.168
702 HD3 ARG 86 1HD ARG 86 12.341 5.136 -1.473
703 HE ARG 86 HE ARG 86 15.078 5.852 -2.230
704 HH11 ARG 86 1HH1 ARG 86 11.835 7.057 -1.538
705 HH12 ARG 86 2HH1 ARG 86 12.376 8.677 -1.249
706 HH21 ARG 86 1HH2 ARG 86 15.770 7.956 -1.777
707 HH22 ARG 86 2HH2 ARG 86 14.613 9.186 -1.381
708 H GLU 87 H GLU 87 15.718 2.426 2.433
709 HA GLU 87 HA GLU 87 17.063 3.308 4.007
710 HB2 GLU 87 2HB GLU 87 18.853 1.871 3.103
711 HB3 GLU 87 1HB GLU 87 19.233 3.071 1.877
712 HG2 GLU 87 2HG GLU 87 19.842 4.651 3.803
713 HG3 GLU 87 1HG GLU 87 19.735 3.248 4.866
714 H ALA 88 H ALA 88 15.986 5.241 4.167
715 HA ALA 88 HA ALA 88 17.190 7.628 2.942
716 HB1 ALA 88 3HB ALA 88 14.199 7.051 3.027
717 HB2 ALA 88 1HB ALA 88 15.209 7.088 1.579
718 HB3 ALA 88 2HB ALA 88 14.940 8.567 2.502
719 HA PRO 89 HA PRO 89 16.941 8.440 7.418
720 HB2 PRO 89 2HB PRO 89 18.520 10.698 7.472
721 HB3 PRO 89 1HB PRO 89 19.183 9.055 7.347
722 HG2 PRO 89 2HG PRO 89 18.808 11.104 5.199
723 HG3 PRO 89 1HG PRO 89 20.123 9.929 5.418
724 HD2 PRO 89 2HD PRO 89 18.034 9.591 3.628
725 HD3 PRO 89 1HD PRO 89 18.984 8.255 4.309
Start of MODEL 2
1 H1 HIS 1 1H HIS 1 -11.679 -24.929 -0.137
2 H2 HIS 1 2H HIS 1 -12.610 -25.068 -1.534
3 H3 HIS 1 3H HIS 1 -12.345 -23.552 -0.842
4 HA HIS 1 HA HIS 1 -10.233 -25.283 -1.963
5 HB2 HIS 1 2HB HIS 1 -11.820 -24.439 -3.715
6 HB3 HIS 1 1HB HIS 1 -11.529 -22.795 -3.161
7 HD1 HIS 1 HD1 HIS 1 -9.672 -25.680 -4.798
8 HD2 HIS 1 HD2 HIS 1 -9.358 -21.559 -4.346
9 HE1 HIS 1 HE1 HIS 1 -7.771 -24.969 -6.286
10 HE2 HIS 1 HE2 HIS 1 -7.745 -22.469 -6.136
11 H HIS 2 H HIS 2 -8.124 -24.288 -1.963
12 HA HIS 2 HA HIS 2 -7.811 -21.758 -0.500
13 HB2 HIS 2 2HB HIS 2 -6.145 -22.665 1.032
14 HB3 HIS 2 1HB HIS 2 -7.638 -23.582 1.189
15 HD1 HIS 2 HD1 HIS 2 -4.058 -23.917 0.273
16 HD2 HIS 2 HD2 HIS 2 -7.464 -26.296 0.282
17 HE1 HIS 2 HE1 HIS 2 -3.245 -26.268 -0.034
18 HE2 HIS 2 HE2 HIS 2 -5.310 -27.688 0.020
19 H HIS 3 H HIS 3 -5.654 -20.837 -0.713
20 HA HIS 3 HA HIS 3 -4.174 -21.721 -3.134
21 HB2 HIS 3 2HB HIS 3 -5.564 -19.744 -3.686
22 HB3 HIS 3 1HB HIS 3 -4.865 -18.851 -2.337
23 HD1 HIS 3 HD1 HIS 3 -4.014 -20.175 -5.760
24 HD2 HIS 3 HD2 HIS 3 -2.343 -17.682 -2.875
25 HE1 HIS 3 HE1 HIS 3 -2.017 -19.115 -6.842
26 HE2 HIS 3 HE2 HIS 3 -0.945 -17.739 -5.048
27 H HIS 4 H HIS 4 -2.165 -22.263 -2.567
28 HA HIS 4 HA HIS 4 -0.830 -21.377 -0.172
29 HB2 HIS 4 2HB HIS 4 -0.411 -23.617 -1.134
30 HB3 HIS 4 1HB HIS 4 0.230 -22.888 -2.605
31 HD1 HIS 4 HD1 HIS 4 2.591 -21.802 -2.453
32 HD2 HIS 4 HD2 HIS 4 1.390 -23.735 1.021
33 HE1 HIS 4 HE1 HIS 4 4.649 -21.991 -1.045
34 HE2 HIS 4 HE2 HIS 4 3.938 -23.324 0.948
35 H HIS 5 H HIS 5 0.830 -19.820 0.017
36 HA HIS 5 HA HIS 5 1.536 -18.191 -2.329
37 HB2 HIS 5 2HB HIS 5 0.849 -16.088 -1.049
38 HB3 HIS 5 1HB HIS 5 -0.475 -17.086 -1.631
39 HD1 HIS 5 HD1 HIS 5 -1.994 -18.198 0.112
40 HD2 HIS 5 HD2 HIS 5 1.103 -15.985 1.799
41 HE1 HIS 5 HE1 HIS 5 -2.558 -17.990 2.549
42 HE2 HIS 5 HE2 HIS 5 -0.662 -16.690 3.552
43 H HIS 6 H HIS 6 3.460 -17.135 -2.181
44 HA HIS 6 HA HIS 6 4.869 -17.013 0.425
45 HB2 HIS 6 2HB HIS 6 5.998 -17.214 -2.395
46 HB3 HIS 6 1HB HIS 6 6.974 -16.683 -1.027
47 HD1 HIS 6 HD1 HIS 6 7.591 -19.282 -2.655
48 HD2 HIS 6 HD2 HIS 6 5.519 -19.145 0.946
49 HE1 HIS 6 HE1 HIS 6 7.857 -21.563 -1.629
50 HE2 HIS 6 HE2 HIS 6 6.803 -21.350 0.635
51 H SER 7 H SER 7 3.756 -15.180 1.012
52 HA SER 7 HA SER 7 3.821 -12.777 -0.671
53 HB2 SER 7 2HB SER 7 2.348 -13.300 1.943
54 HB3 SER 7 1HB SER 7 2.053 -11.982 0.805
55 HG SER 7 HG SER 7 1.254 -13.438 -0.665
56 H HIS 8 H HIS 8 4.237 -10.651 0.479
57 HA HIS 8 HA HIS 8 6.491 -10.711 2.280
58 HB2 HIS 8 2HB HIS 8 6.079 -8.816 0.627
59 HB3 HIS 8 1HB HIS 8 4.725 -8.295 1.628
60 HD1 HIS 8 HD1 HIS 8 5.614 -7.947 4.326
61 HD2 HIS 8 HD2 HIS 8 8.337 -7.415 1.240
62 HE1 HIS 8 HE1 HIS 8 7.529 -6.696 5.342
63 HE2 HIS 8 HE2 HIS 8 9.047 -6.211 3.403
64 H MET 9 H MET 9 6.420 -10.614 4.467
65 HA MET 9 HA MET 9 4.062 -11.459 5.786
66 HB2 MET 9 2HB MET 9 5.492 -11.428 7.842
67 HB3 MET 9 1HB MET 9 6.226 -12.270 6.489
68 HG2 MET 9 2HG MET 9 7.566 -10.181 6.020
69 HG3 MET 9 1HG MET 9 6.954 -9.543 7.553
70 HE1 MET 9 3HE MET 9 9.538 -13.368 7.223
71 HE2 MET 9 1HE MET 9 8.989 -12.442 5.825
72 HE3 MET 9 2HE MET 9 7.831 -13.358 6.799
73 H VAL 10 H VAL 10 3.293 -10.507 7.797
74 HA VAL 10 HA VAL 10 1.958 -8.109 7.274
75 HB VAL 10 HB VAL 10 1.094 -8.371 9.638
76 HG11 VAL 10 1HG1 VAL 10 1.043 -10.905 7.950
77 HG12 VAL 10 2HG1 VAL 10 -0.015 -9.505 7.756
78 HG13 VAL 10 3HG1 VAL 10 -0.103 -10.475 9.221
79 HG21 VAL 10 3HG2 VAL 10 2.997 -10.758 9.735
80 HG22 VAL 10 1HG2 VAL 10 1.741 -10.402 10.930
81 HG23 VAL 10 2HG2 VAL 10 3.100 -9.299 10.722
82 H GLY 11 H GLY 11 2.185 -6.036 7.925
83 HA2 GLY 11 2HA GLY 11 2.798 -4.362 9.539
84 HA3 GLY 11 1HA GLY 11 4.204 -5.322 9.988
85 H ASP 12 H ASP 12 3.697 -5.234 6.606
86 HA ASP 12 HA ASP 12 6.214 -4.051 6.071
87 HB2 ASP 12 2HB ASP 12 5.021 -5.684 4.570
88 HB3 ASP 12 1HB ASP 12 3.867 -4.430 4.148
89 H THR 13 H THR 13 6.588 -1.948 6.590
90 HA THR 13 HA THR 13 4.539 0.065 6.638
91 HB THR 13 HB THR 13 7.567 0.375 6.883
92 HG1 THR 13 HG1 THR 13 5.944 -0.880 8.476
93 HG21 THR 13 3HG2 THR 13 5.322 2.282 7.690
94 HG22 THR 13 1HG2 THR 13 6.459 2.534 6.366
95 HG23 THR 13 2HG2 THR 13 7.035 2.523 8.034
96 H VAL 14 H VAL 14 3.753 0.887 4.847
97 HA VAL 14 HA VAL 14 5.431 1.572 2.500
98 HB VAL 14 HB VAL 14 3.583 0.792 1.002
99 HG11 VAL 14 1HG1 VAL 14 5.467 -0.731 1.399
100 HG12 VAL 14 2HG1 VAL 14 3.971 -1.637 1.175
101 HG13 VAL 14 3HG1 VAL 14 4.643 -1.427 2.795
102 HG21 VAL 14 3HG2 VAL 14 2.315 -0.376 3.524
103 HG22 VAL 14 1HG2 VAL 14 1.746 -0.629 1.869
104 HG23 VAL 14 2HG2 VAL 14 1.688 0.980 2.585
105 H TRP 15 H TRP 15 3.947 2.879 0.937
106 HA TRP 15 HA TRP 15 2.121 4.737 2.349
107 HB2 TRP 15 2HB TRP 15 4.093 5.357 0.084
108 HB3 TRP 15 1HB TRP 15 2.889 6.485 0.702
109 HD1 TRP 15 HD1 TRP 15 3.564 5.731 3.881
110 HE1 TRP 15 HE1 TRP 15 5.670 6.770 4.908
111 HE3 TRP 15 HE3 TRP 15 6.111 6.877 -0.417
112 HZ2 TRP 15 HZ2 TRP 15 8.070 7.950 4.046
113 HZ3 TRP 15 HZ3 TRP 15 8.306 7.978 -0.219
114 HH2 TRP 15 HH2 TRP 15 9.265 8.504 1.968
115 H VAL 16 H VAL 16 0.291 5.366 1.069
116 HA VAL 16 HA VAL 16 -0.297 3.593 -1.225
117 HB VAL 16 HB VAL 16 -2.242 4.927 0.729
118 HG11 VAL 16 1HG1 VAL 16 -3.203 5.061 -1.551
119 HG12 VAL 16 2HG1 VAL 16 -4.089 3.891 -0.576
120 HG13 VAL 16 3HG1 VAL 16 -2.929 3.332 -1.782
121 HG21 VAL 16 3HG2 VAL 16 -1.166 2.848 1.540
122 HG22 VAL 16 1HG2 VAL 16 -1.718 1.993 0.097
123 HG23 VAL 16 2HG2 VAL 16 -2.890 2.602 1.268
124 H ARG 17 H ARG 17 0.161 4.579 -3.005
125 HA ARG 17 HA ARG 17 0.066 7.403 -3.529
126 HB2 ARG 17 2HB ARG 17 1.740 5.922 -4.522
127 HB3 ARG 17 1HB ARG 17 0.491 4.937 -5.273
128 HG2 ARG 17 2HG ARG 17 -0.154 6.913 -6.666
129 HG3 ARG 17 1HG ARG 17 1.208 7.797 -5.976
130 HD2 ARG 17 2HD ARG 17 1.403 5.218 -7.569
131 HD3 ARG 17 1HD ARG 17 1.757 6.835 -8.183
132 HE ARG 17 HE ARG 17 3.582 6.920 -6.482
133 HH11 ARG 17 1HH1 ARG 17 2.495 3.767 -7.625
134 HH12 ARG 17 2HH1 ARG 17 4.012 3.000 -7.282
135 HH21 ARG 17 1HH2 ARG 17 5.544 5.909 -6.066
136 HH22 ARG 17 2HH2 ARG 17 5.739 4.218 -6.396
137 H ARG 18 H ARG 18 -1.539 8.537 -4.598
138 HA ARG 18 HA ARG 18 -3.842 7.082 -5.783
139 HB2 ARG 18 2HB ARG 18 -4.631 7.743 -3.593
140 HB3 ARG 18 1HB ARG 18 -3.959 9.365 -3.751
141 HG2 ARG 18 2HG ARG 18 -5.591 9.876 -5.535
142 HG3 ARG 18 1HG ARG 18 -6.265 8.251 -5.402
143 HD2 ARG 18 2HD ARG 18 -6.185 10.145 -3.040
144 HD3 ARG 18 1HD ARG 18 -7.505 10.166 -4.206
145 HE ARG 18 HE ARG 18 -6.793 7.789 -2.575
146 HH11 ARG 18 1HH1 ARG 18 -9.232 9.890 -4.009
147 HH12 ARG 18 2HH1 ARG 18 -10.562 8.951 -3.405
148 HH21 ARG 18 1HH2 ARG 18 -8.560 6.562 -1.798
149 HH22 ARG 18 2HH2 ARG 18 -10.180 7.070 -2.158
150 H HIS 19 H HIS 19 -3.747 7.624 -7.874
151 HA HIS 19 HA HIS 19 -2.840 10.163 -8.910
152 HB2 HIS 19 2HB HIS 19 -2.725 7.941 -10.170
153 HB3 HIS 19 1HB HIS 19 -4.473 8.019 -10.368
154 HD1 HIS 19 HD1 HIS 19 -4.495 8.286 -12.883
155 HD2 HIS 19 HD2 HIS 19 -2.048 11.085 -11.018
156 HE1 HIS 19 HE1 HIS 19 -3.802 9.880 -14.691
157 HE2 HIS 19 HE2 HIS 19 -2.500 11.670 -13.491
158 H GLN 20 H GLN 20 -4.017 11.931 -8.494
159 HA GLN 20 HA GLN 20 -6.661 11.874 -7.524
160 HB2 GLN 20 2HB GLN 20 -5.044 14.252 -8.512
161 HB3 GLN 20 1HB GLN 20 -6.502 14.357 -7.532
162 HG2 GLN 20 2HG GLN 20 -3.962 12.960 -6.627
163 HG3 GLN 20 1HG GLN 20 -4.343 14.643 -6.259
164 HE21 GLN 20 1HE2 GLN 20 -4.283 14.202 -4.033
165 HE22 GLN 20 2HE2 GLN 20 -5.538 13.341 -3.221
166 H THR 21 H THR 21 -5.480 13.476 -10.488
167 HA THR 21 HA THR 21 -7.737 12.398 -12.040
168 HB THR 21 HB THR 21 -8.021 14.618 -13.224
169 HG1 THR 21 HG1 THR 21 -7.213 16.373 -11.506
170 HG21 THR 21 3HG2 THR 21 -9.641 13.967 -11.461
171 HG22 THR 21 1HG2 THR 21 -9.410 15.716 -11.544
172 HG23 THR 21 2HG2 THR 21 -8.642 14.786 -10.257
173 H LYS 22 H LYS 22 -7.268 12.967 -14.495
174 HA LYS 22 HA LYS 22 -4.739 11.899 -15.231
175 HB2 LYS 22 2HB LYS 22 -6.833 13.332 -16.918
176 HB3 LYS 22 1HB LYS 22 -5.457 12.456 -17.581
177 HG2 LYS 22 2HG LYS 22 -6.314 10.345 -16.668
178 HG3 LYS 22 1HG LYS 22 -7.661 11.197 -15.904
179 HD2 LYS 22 2HD LYS 22 -8.461 11.903 -18.169
180 HD3 LYS 22 1HD LYS 22 -7.152 10.974 -18.903
181 HE2 LYS 22 2HE LYS 22 -9.365 9.807 -17.180
182 HE3 LYS 22 1HE LYS 22 -9.313 9.764 -18.941
183 HZ1 LYS 22 3HZ LYS 22 -8.543 7.693 -17.998
184 HZ2 LYS 22 1HZ LYS 22 -7.343 8.495 -17.122
185 HZ3 LYS 22 2HZ LYS 22 -7.277 8.465 -18.806
186 H ASN 23 H ASN 23 -5.860 15.125 -14.646
187 HA ASN 23 HA ASN 23 -3.539 16.457 -15.790
188 HB2 ASN 23 2HB ASN 23 -5.698 17.638 -15.752
189 HB3 ASN 23 1HB ASN 23 -5.793 17.497 -13.999
190 HD21 ASN 23 1HD2 ASN 23 -4.182 19.113 -16.678
191 HD22 ASN 23 2HD2 ASN 23 -3.513 20.403 -15.740
192 H LEU 24 H LEU 24 -4.842 15.976 -12.481
193 HA LEU 24 HA LEU 24 -2.469 16.968 -11.199
194 HB2 LEU 24 2HB LEU 24 -4.896 15.534 -10.051
195 HB3 LEU 24 1HB LEU 24 -3.617 16.248 -9.085
196 HG LEU 24 HG LEU 24 -5.545 17.761 -10.885
197 HD11 LEU 24 1HD1 LEU 24 -6.618 16.983 -8.835
198 HD12 LEU 24 2HD1 LEU 24 -6.412 18.730 -8.794
199 HD13 LEU 24 3HD1 LEU 24 -5.332 17.696 -7.855
200 HD21 LEU 24 3HD2 LEU 24 -3.379 18.857 -10.935
201 HD22 LEU 24 1HD2 LEU 24 -3.289 18.842 -9.171
202 HD23 LEU 24 2HD2 LEU 24 -4.514 19.816 -9.991
203 H GLU 25 H GLU 25 -0.678 15.867 -11.104
204 HA GLU 25 HA GLU 25 -0.273 13.157 -11.624
205 HB2 GLU 25 2HB GLU 25 1.523 15.196 -10.239
206 HB3 GLU 25 1HB GLU 25 2.063 13.600 -10.746
207 HG2 GLU 25 2HG GLU 25 1.393 14.234 -13.113
208 HG3 GLU 25 1HG GLU 25 1.130 15.867 -12.514
209 HA PRO 26 HA PRO 26 -1.191 10.770 -8.060
210 HB2 PRO 26 2HB PRO 26 1.083 9.208 -7.599
211 HB3 PRO 26 1HB PRO 26 -0.102 8.910 -8.881
212 HG2 PRO 26 2HG PRO 26 2.527 10.350 -9.064
213 HG3 PRO 26 1HG PRO 26 1.836 9.120 -10.155
214 HD2 PRO 26 2HD PRO 26 1.691 11.693 -10.817
215 HD3 PRO 26 1HD PRO 26 0.300 10.627 -11.103
216 H ARG 27 H ARG 27 -1.487 11.510 -6.081
217 HA ARG 27 HA ARG 27 0.762 12.468 -4.407
218 HB2 ARG 27 2HB ARG 27 -1.035 14.128 -4.817
219 HB3 ARG 27 1HB ARG 27 -2.247 13.002 -4.210
220 HG2 ARG 27 2HG ARG 27 -1.264 13.106 -1.973
221 HG3 ARG 27 1HG ARG 27 0.020 14.168 -2.552
222 HD2 ARG 27 2HD ARG 27 -1.712 15.882 -3.128
223 HD3 ARG 27 1HD ARG 27 -2.953 14.812 -2.466
224 HE ARG 27 HE ARG 27 -1.470 14.999 -0.341
225 HH11 ARG 27 1HH1 ARG 27 -2.196 17.628 -2.575
226 HH12 ARG 27 2HH1 ARG 27 -2.055 18.861 -1.358
227 HH21 ARG 27 1HH2 ARG 27 -1.268 16.615 1.239
228 HH22 ARG 27 2HH2 ARG 27 -1.527 18.274 0.809
229 H TRP 28 H TRP 28 1.286 11.230 -2.662
230 HA TRP 28 HA TRP 28 -0.379 8.874 -1.998
231 HB2 TRP 28 2HB TRP 28 1.730 7.908 -1.017
232 HB3 TRP 28 1HB TRP 28 1.838 8.224 -2.747
233 HD1 TRP 28 HD1 TRP 28 3.619 10.025 -3.557
234 HE1 TRP 28 HE1 TRP 28 5.578 11.206 -2.386
235 HE3 TRP 28 HE3 TRP 28 2.478 8.904 1.305
236 HZ2 TRP 28 HZ2 TRP 28 6.518 11.603 0.222
237 HZ3 TRP 28 HZ3 TRP 28 3.964 9.726 3.083
238 HH2 TRP 28 HH2 TRP 28 5.947 11.052 2.550
239 H LYS 29 H LYS 29 -0.415 8.152 0.222
240 HA LYS 29 HA LYS 29 0.079 10.159 2.351
241 HB2 LYS 29 2HB LYS 29 -2.382 8.346 2.101
242 HB3 LYS 29 1HB LYS 29 -2.014 9.349 3.500
243 HG2 LYS 29 2HG LYS 29 -2.229 11.379 2.103
244 HG3 LYS 29 1HG LYS 29 -2.626 10.370 0.710
245 HD2 LYS 29 2HD LYS 29 -4.652 9.550 1.873
246 HD3 LYS 29 1HD LYS 29 -4.249 10.537 3.282
247 HE2 LYS 29 2HE LYS 29 -4.463 12.578 1.895
248 HE3 LYS 29 1HE LYS 29 -4.897 11.579 0.505
249 HZ1 LYS 29 3HZ LYS 29 -6.845 12.507 1.597
250 HZ2 LYS 29 1HZ LYS 29 -6.429 11.743 3.044
251 HZ3 LYS 29 2HZ LYS 29 -6.855 10.819 1.697
252 H GLY 30 H GLY 30 0.386 9.093 4.508
253 HA2 GLY 30 2HA GLY 30 0.691 6.287 4.815
254 HA3 GLY 30 1HA GLY 30 2.234 6.998 4.426
255 HA PRO 31 HA PRO 31 2.886 5.356 5.779
256 HB2 PRO 31 2HB PRO 31 3.957 4.139 7.949
257 HB3 PRO 31 1HB PRO 31 4.648 5.640 7.298
258 HG2 PRO 31 2HG PRO 31 2.956 5.248 9.723
259 HG3 PRO 31 1HG PRO 31 4.294 6.381 9.449
260 HD2 PRO 31 2HD PRO 31 1.534 6.994 9.258
261 HD3 PRO 31 1HD PRO 31 2.879 8.004 8.682
262 H TYR 32 H TYR 32 1.683 3.692 5.124
263 HA TYR 32 HA TYR 32 -0.338 2.380 6.810
264 HB2 TYR 32 2HB TYR 32 0.365 2.195 3.847
265 HB3 TYR 32 1HB TYR 32 -0.847 1.170 4.607
266 HD1 TYR 32 HD2 TYR 32 -0.015 4.724 3.819
267 HD2 TYR 32 HD1 TYR 32 -3.086 1.977 4.937
268 HE1 TYR 32 HE2 TYR 32 -1.712 6.451 3.396
269 HE2 TYR 32 HE1 TYR 32 -4.786 3.703 4.515
270 HH TYR 32 HH TYR 32 -4.089 6.635 2.888
271 H THR 33 H THR 33 -0.420 -0.127 6.343
272 HA THR 33 HA THR 33 2.244 -1.391 6.302
273 HB THR 33 HB THR 33 1.519 -2.895 8.250
274 HG1 THR 33 HG1 THR 33 -0.691 -1.292 8.101
275 HG21 THR 33 3HG2 THR 33 3.209 -1.142 8.620
276 HG22 THR 33 1HG2 THR 33 2.164 -1.306 10.033
277 HG23 THR 33 2HG2 THR 33 1.939 0.045 8.922
278 H VAL 34 H VAL 34 2.094 -2.808 4.625
279 HA VAL 34 HA VAL 34 -0.310 -4.144 3.839
280 HB VAL 34 HB VAL 34 2.566 -4.912 3.129
281 HG11 VAL 34 1HG1 VAL 34 1.588 -6.038 1.171
282 HG12 VAL 34 2HG1 VAL 34 -0.035 -5.630 1.731
283 HG13 VAL 34 3HG1 VAL 34 0.974 -6.726 2.678
284 HG21 VAL 34 3HG2 VAL 34 2.140 -2.603 2.448
285 HG22 VAL 34 1HG2 VAL 34 0.672 -3.096 1.601
286 HG23 VAL 34 2HG2 VAL 34 2.248 -3.650 1.034
287 H LEU 35 H LEU 35 -1.102 -5.999 4.518
288 HA LEU 35 HA LEU 35 0.202 -7.563 6.638
289 HB2 LEU 35 2HB LEU 35 -2.653 -7.667 5.580
290 HB3 LEU 35 1HB LEU 35 -2.044 -8.538 6.981
291 HG LEU 35 HG LEU 35 -2.324 -5.516 6.740
292 HD11 LEU 35 1HD1 LEU 35 -4.061 -5.729 8.461
293 HD12 LEU 35 2HD1 LEU 35 -3.893 -7.486 8.432
294 HD13 LEU 35 3HD1 LEU 35 -4.483 -6.631 7.005
295 HD21 LEU 35 3HD2 LEU 35 -1.324 -7.137 9.106
296 HD22 LEU 35 1HD2 LEU 35 -1.673 -5.406 9.119
297 HD23 LEU 35 2HD2 LEU 35 -0.370 -6.034 8.112
298 H LEU 36 H LEU 36 -1.219 -7.876 3.386
299 HA LEU 36 HA LEU 36 0.172 -10.455 2.980
300 HB2 LEU 36 2HB LEU 36 -2.154 -10.958 3.785
301 HB3 LEU 36 1HB LEU 36 -2.803 -10.013 2.459
302 HG LEU 36 HG LEU 36 -1.697 -11.690 0.866
303 HD11 LEU 36 1HD1 LEU 36 -0.062 -12.655 2.396
304 HD12 LEU 36 2HD1 LEU 36 -1.121 -13.907 1.757
305 HD13 LEU 36 3HD1 LEU 36 -1.353 -13.312 3.403
306 HD21 LEU 36 3HD2 LEU 36 -3.491 -13.352 1.102
307 HD22 LEU 36 1HD2 LEU 36 -4.111 -11.714 1.309
308 HD23 LEU 36 2HD2 LEU 36 -3.859 -12.747 2.718
309 H THR 37 H THR 37 0.885 -10.707 0.841
310 HA THR 37 HA THR 37 0.060 -8.641 -1.137
311 HB THR 37 HB THR 37 2.206 -9.004 -2.296
312 HG1 THR 37 HG1 THR 37 2.733 -11.096 -1.824
313 HG21 THR 37 3HG2 THR 37 2.666 -8.500 0.658
314 HG22 THR 37 1HG2 THR 37 2.154 -7.289 -0.519
315 HG23 THR 37 2HG2 THR 37 3.751 -8.030 -0.652
316 H THR 38 H THR 38 -1.029 -9.341 -2.869
317 HA THR 38 HA THR 38 -0.945 -12.182 -3.700
318 HB THR 38 HB THR 38 -3.400 -11.934 -4.307
319 HG1 THR 38 HG1 THR 38 -3.203 -9.494 -4.100
320 HG21 THR 38 3HG2 THR 38 -2.831 -13.112 -2.230
321 HG22 THR 38 1HG2 THR 38 -4.305 -12.169 -2.007
322 HG23 THR 38 2HG2 THR 38 -2.778 -11.581 -1.349
323 HA PRO 39 HA PRO 39 -0.100 -11.039 -8.004
324 HB2 PRO 39 2HB PRO 39 -2.906 -12.115 -8.535
325 HB3 PRO 39 1HB PRO 39 -1.417 -12.358 -9.483
326 HG2 PRO 39 2HG PRO 39 -2.197 -14.266 -7.851
327 HG3 PRO 39 1HG PRO 39 -0.476 -13.812 -7.892
328 HD2 PRO 39 2HD PRO 39 -2.537 -13.189 -5.801
329 HD3 PRO 39 1HD PRO 39 -0.793 -13.486 -5.619
330 H THR 40 H THR 40 -0.045 -8.940 -8.351
331 HA THR 40 HA THR 40 -0.421 -6.875 -9.032
332 HB THR 40 HB THR 40 -1.706 -8.166 -10.876
333 HG1 THR 40 HG1 THR 40 -2.173 -6.242 -11.861
334 HG21 THR 40 3HG2 THR 40 -4.117 -6.843 -9.564
335 HG22 THR 40 1HG2 THR 40 -3.865 -8.580 -9.732
336 HG23 THR 40 2HG2 THR 40 -4.095 -7.577 -11.167
337 H ALA 41 H ALA 41 -1.790 -7.872 -6.345
338 HA ALA 41 HA ALA 41 -3.089 -5.313 -5.691
339 HB1 ALA 41 3HB ALA 41 -4.931 -6.684 -6.613
340 HB2 ALA 41 1HB ALA 41 -5.158 -6.389 -4.890
341 HB3 ALA 41 2HB ALA 41 -4.581 -7.960 -5.449
342 H LEU 42 H LEU 42 -2.784 -4.798 -3.559
343 HA LEU 42 HA LEU 42 -1.406 -6.781 -1.826
344 HB2 LEU 42 2HB LEU 42 -1.041 -3.744 -1.823
345 HB3 LEU 42 1HB LEU 42 -0.163 -4.908 -0.844
346 HG LEU 42 HG LEU 42 0.063 -4.492 -3.840
347 HD11 LEU 42 1HD1 LEU 42 2.101 -4.205 -1.614
348 HD12 LEU 42 2HD1 LEU 42 1.329 -2.898 -2.516
349 HD13 LEU 42 3HD1 LEU 42 2.422 -4.003 -3.340
350 HD21 LEU 42 3HD2 LEU 42 0.121 -6.897 -3.451
351 HD22 LEU 42 1HD2 LEU 42 1.356 -6.692 -2.208
352 HD23 LEU 42 2HD2 LEU 42 1.719 -6.308 -3.892
353 H LYS 43 H LYS 43 -2.465 -7.267 -0.041
354 HA LYS 43 HA LYS 43 -4.813 -5.790 0.831
355 HB2 LYS 43 2HB LYS 43 -4.914 -8.219 0.875
356 HB3 LYS 43 1HB LYS 43 -3.435 -8.330 1.825
357 HG2 LYS 43 2HG LYS 43 -4.558 -7.349 3.767
358 HG3 LYS 43 1HG LYS 43 -6.046 -7.125 2.841
359 HD2 LYS 43 2HD LYS 43 -4.734 -9.787 3.514
360 HD3 LYS 43 1HD LYS 43 -6.179 -9.129 4.277
361 HE2 LYS 43 2HE LYS 43 -5.913 -9.948 1.367
362 HE3 LYS 43 1HE LYS 43 -6.790 -10.823 2.623
363 HZ1 LYS 43 3HZ LYS 43 -7.439 -8.047 1.833
364 HZ2 LYS 43 1HZ LYS 43 -8.348 -9.078 2.808
365 HZ3 LYS 43 2HZ LYS 43 -8.184 -9.396 1.156
366 H VAL 44 H VAL 44 -4.406 -3.996 1.890
367 HA VAL 44 HA VAL 44 -2.198 -3.732 3.843
368 HB VAL 44 HB VAL 44 -3.809 -1.524 2.428
369 HG11 VAL 44 1HG1 VAL 44 -2.878 -0.802 4.588
370 HG12 VAL 44 2HG1 VAL 44 -2.067 0.014 3.249
371 HG13 VAL 44 3HG1 VAL 44 -1.268 -1.321 4.082
372 HG21 VAL 44 3HG2 VAL 44 -1.014 -2.523 1.772
373 HG22 VAL 44 1HG2 VAL 44 -1.818 -1.146 1.013
374 HG23 VAL 44 2HG2 VAL 44 -2.456 -2.777 0.791
375 H ASP 45 H ASP 45 -2.737 -2.904 5.940
376 HA ASP 45 HA ASP 45 -5.339 -3.387 6.988
377 HB2 ASP 45 2HB ASP 45 -3.333 -3.613 8.372
378 HB3 ASP 45 1HB ASP 45 -2.922 -1.921 8.122
379 H GLY 46 H GLY 46 -6.963 -1.940 7.542
380 HA2 GLY 46 2HA GLY 46 -8.098 0.100 7.683
381 HA3 GLY 46 1HA GLY 46 -6.721 0.922 6.971
382 H ILE 47 H ILE 47 -7.476 -1.823 5.174
383 HA ILE 47 HA ILE 47 -8.966 -0.242 3.151
384 HB ILE 47 HB ILE 47 -6.869 -2.439 2.738
385 HG12 ILE 47 2HG1 ILE 47 -5.806 -0.352 3.441
386 HG13 ILE 47 1HG1 ILE 47 -5.466 -0.624 1.739
387 HG21 ILE 47 1HG2 ILE 47 -7.025 -1.960 0.316
388 HG22 ILE 47 2HG2 ILE 47 -8.366 -0.855 0.613
389 HG23 ILE 47 3HG2 ILE 47 -8.550 -2.578 0.955
390 HD11 ILE 47 3HD1 ILE 47 -7.470 1.325 2.878
391 HD12 ILE 47 1HD1 ILE 47 -7.203 1.032 1.159
392 HD13 ILE 47 2HD1 ILE 47 -5.911 1.706 2.149
393 H ALA 48 H ALA 48 -10.537 -1.358 1.896
394 HA ALA 48 HA ALA 48 -12.268 -3.055 3.248
395 HB1 ALA 48 3HB ALA 48 -12.952 -1.568 1.415
396 HB2 ALA 48 1HB ALA 48 -13.501 -3.218 1.119
397 HB3 ALA 48 2HB ALA 48 -12.098 -2.579 0.251
398 H ALA 49 H ALA 49 -10.044 -3.900 0.552
399 HA ALA 49 HA ALA 49 -9.763 -6.622 1.577
400 HB1 ALA 49 3HB ALA 49 -11.753 -6.781 0.126
401 HB2 ALA 49 1HB ALA 49 -10.402 -7.707 -0.532
402 HB3 ALA 49 2HB ALA 49 -10.826 -6.142 -1.232
403 H TRP 50 H TRP 50 -9.029 -4.610 -1.324
404 HA TRP 50 HA TRP 50 -6.150 -5.148 -0.994
405 HB2 TRP 50 2HB TRP 50 -7.647 -5.662 -3.597
406 HB3 TRP 50 1HB TRP 50 -5.897 -5.641 -3.440
407 HD1 TRP 50 HD1 TRP 50 -4.830 -7.726 -1.889
408 HE1 TRP 50 HE1 TRP 50 -5.634 -10.164 -1.723
409 HE3 TRP 50 HE3 TRP 50 -9.609 -7.132 -3.620
410 HZ2 TRP 50 HZ2 TRP 50 -7.979 -11.638 -2.247
411 HZ3 TRP 50 HZ3 TRP 50 -11.069 -9.108 -3.764
412 HH2 TRP 50 HH2 TRP 50 -10.267 -11.320 -3.088
413 H ILE 51 H ILE 51 -4.793 -3.682 -2.066
414 HA ILE 51 HA ILE 51 -5.981 -1.399 -3.540
415 HB ILE 51 HB ILE 51 -3.457 -1.444 -1.774
416 HG12 ILE 51 2HG1 ILE 51 -5.581 -1.091 -0.518
417 HG13 ILE 51 1HG1 ILE 51 -4.546 0.329 -0.459
418 HG21 ILE 51 1HG2 ILE 51 -4.405 0.793 -3.609
419 HG22 ILE 51 2HG2 ILE 51 -2.943 -0.179 -3.799
420 HG23 ILE 51 3HG2 ILE 51 -3.098 0.922 -2.431
421 HD11 ILE 51 3HD1 ILE 51 -5.938 1.410 -2.158
422 HD12 ILE 51 1HD1 ILE 51 -6.877 0.931 -0.744
423 HD13 ILE 51 2HD1 ILE 51 -6.968 -0.024 -2.223
424 H HIS 52 H HIS 52 -5.477 -1.602 -5.669
425 HA HIS 52 HA HIS 52 -3.860 -3.615 -6.769
426 HB2 HIS 52 2HB HIS 52 -5.706 -2.272 -7.954
427 HB3 HIS 52 1HB HIS 52 -4.549 -0.955 -8.113
428 HD1 HIS 52 HD1 HIS 52 -2.475 -1.427 -9.718
429 HD2 HIS 52 HD2 HIS 52 -5.516 -4.247 -9.861
430 HE1 HIS 52 HE1 HIS 52 -2.036 -2.786 -11.773
431 HE2 HIS 52 HE2 HIS 52 -4.008 -4.324 -11.951
432 H ALA 53 H ALA 53 -1.659 -3.651 -7.292
433 HA ALA 53 HA ALA 53 -0.090 -2.516 -5.313
434 HB1 ALA 53 3HB ALA 53 1.793 -3.712 -6.294
435 HB2 ALA 53 1HB ALA 53 0.918 -3.904 -7.816
436 HB3 ALA 53 2HB ALA 53 0.340 -4.707 -6.354
437 H ALA 54 H ALA 54 -0.567 -1.175 -8.505
438 HA ALA 54 HA ALA 54 1.760 0.482 -8.592
439 HB1 ALA 54 3HB ALA 54 0.501 -0.114 -10.611
440 HB2 ALA 54 1HB ALA 54 0.624 1.640 -10.449
441 HB3 ALA 54 2HB ALA 54 -0.880 0.812 -10.036
442 H HIS 55 H HIS 55 -1.014 0.667 -6.695
443 HA HIS 55 HA HIS 55 -0.778 3.547 -6.094
444 HB2 HIS 55 2HB HIS 55 -2.910 1.484 -5.370
445 HB3 HIS 55 1HB HIS 55 -2.902 3.130 -4.751
446 HD1 HIS 55 HD1 HIS 55 -2.875 5.003 -6.808
447 HD2 HIS 55 HD2 HIS 55 -4.471 1.246 -7.574
448 HE1 HIS 55 HE1 HIS 55 -4.390 5.308 -8.782
449 HE2 HIS 55 HE2 HIS 55 -5.529 3.089 -9.044
450 H VAL 56 H VAL 56 0.985 1.101 -5.200
451 HA VAL 56 HA VAL 56 1.219 2.005 -2.383
452 HB VAL 56 HB VAL 56 1.592 -0.900 -3.318
453 HG11 VAL 56 1HG1 VAL 56 1.874 0.265 -0.521
454 HG12 VAL 56 2HG1 VAL 56 3.193 -0.314 -1.542
455 HG13 VAL 56 3HG1 VAL 56 1.978 -1.444 -0.949
456 HG21 VAL 56 3HG2 VAL 56 -0.798 -0.332 -3.142
457 HG22 VAL 56 1HG2 VAL 56 -0.555 0.232 -1.488
458 HG23 VAL 56 2HG2 VAL 56 -0.324 -1.473 -1.883
459 H LYS 57 H LYS 57 3.369 2.282 -1.679
460 HA LYS 57 HA LYS 57 5.567 1.269 -3.319
461 HB2 LYS 57 2HB LYS 57 5.021 3.706 -4.029
462 HB3 LYS 57 1HB LYS 57 5.584 4.192 -2.432
463 HG2 LYS 57 2HG LYS 57 7.785 3.013 -2.971
464 HG3 LYS 57 1HG LYS 57 7.185 2.831 -4.622
465 HD2 LYS 57 2HD LYS 57 8.598 4.773 -4.595
466 HD3 LYS 57 1HD LYS 57 6.935 5.359 -4.713
467 HE2 LYS 57 2HE LYS 57 8.255 6.691 -3.106
468 HE3 LYS 57 1HE LYS 57 6.939 5.843 -2.286
469 HZ1 LYS 57 3HZ LYS 57 8.503 4.194 -1.506
470 HZ2 LYS 57 1HZ LYS 57 9.089 5.728 -1.098
471 HZ3 LYS 57 2HZ LYS 57 9.758 4.887 -2.400
472 H ALA 58 H ALA 58 7.228 0.582 -2.031
473 HA ALA 58 HA ALA 58 6.859 0.168 0.722
474 HB1 ALA 58 3HB ALA 58 9.153 -0.761 0.680
475 HB2 ALA 58 1HB ALA 58 9.417 -0.038 -0.910
476 HB3 ALA 58 2HB ALA 58 8.216 -1.313 -0.709
477 H ALA 59 H ALA 59 7.785 1.079 2.552
478 HA ALA 59 HA ALA 59 9.178 3.690 2.295
479 HB1 ALA 59 3HB ALA 59 7.764 4.574 4.112
480 HB2 ALA 59 1HB ALA 59 6.876 3.047 4.188
481 HB3 ALA 59 2HB ALA 59 6.771 4.061 2.747
482 H ASP 60 H ASP 60 10.628 4.182 3.953
483 HA ASP 60 HA ASP 60 11.647 1.983 5.569
484 HB2 ASP 60 2HB ASP 60 13.149 3.577 4.289
485 HB3 ASP 60 1HB ASP 60 12.665 4.855 5.397
486 HA PRO 61 HA PRO 61 9.104 3.404 9.110
487 HB2 PRO 61 2HB PRO 61 10.713 1.412 10.647
488 HB3 PRO 61 1HB PRO 61 8.958 1.511 10.418
489 HG2 PRO 61 2HG PRO 61 10.437 -0.397 9.226
490 HG3 PRO 61 1HG PRO 61 8.988 0.287 8.452
491 HD2 PRO 61 2HD PRO 61 11.889 0.859 7.899
492 HD3 PRO 61 1HD PRO 61 10.517 0.731 6.765
493 H GLY 62 H GLY 62 12.583 3.222 8.843
494 HA2 GLY 62 2HA GLY 62 14.079 4.926 9.452
495 HA3 GLY 62 1HA GLY 62 12.958 5.496 10.684
496 H GLY 63 H GLY 63 12.414 3.149 12.015
497 HA2 GLY 63 2HA GLY 63 14.892 1.810 12.814
498 HA3 GLY 63 1HA GLY 63 14.072 2.780 14.046
499 H GLY 64 H GLY 64 12.687 0.816 11.430
500 HA2 GLY 64 2HA GLY 64 10.789 -0.438 13.233
501 HA3 GLY 64 1HA GLY 64 10.887 -0.644 11.493
502 HA PRO 65 HA PRO 65 12.477 -4.406 13.943
503 HB2 PRO 65 2HB PRO 65 10.673 -6.276 13.114
504 HB3 PRO 65 1HB PRO 65 10.311 -5.143 14.430
505 HG2 PRO 65 2HG PRO 65 9.508 -4.971 11.543
506 HG3 PRO 65 1HG PRO 65 8.512 -4.726 12.999
507 HD2 PRO 65 2HD PRO 65 9.551 -2.630 11.621
508 HD3 PRO 65 1HD PRO 65 9.348 -2.588 13.387
509 H SER 66 H SER 66 13.372 -6.446 13.147
510 HA SER 66 HA SER 66 14.738 -6.253 10.671
511 HB2 SER 66 2HB SER 66 15.630 -7.456 12.668
512 HB3 SER 66 1HB SER 66 14.389 -8.694 12.467
513 HG SER 66 HG SER 66 15.381 -8.829 10.218
514 H SER 67 H SER 67 11.702 -7.663 11.608
515 HA SER 67 HA SER 67 11.091 -8.501 8.880
516 HB2 SER 67 2HB SER 67 10.896 -10.453 11.224
517 HB3 SER 67 1HB SER 67 10.390 -10.776 9.570
518 HG SER 67 HG SER 67 12.878 -10.005 9.387
519 H ARG 68 H ARG 68 9.807 -8.847 12.224
520 HA ARG 68 HA ARG 68 7.617 -7.022 11.786
521 HB2 ARG 68 2HB ARG 68 5.772 -8.489 11.815
522 HB3 ARG 68 1HB ARG 68 6.899 -9.336 10.778
523 HG2 ARG 68 2HG ARG 68 6.288 -9.988 13.674
524 HG3 ARG 68 1HG ARG 68 5.738 -10.879 12.264
525 HD2 ARG 68 2HD ARG 68 8.641 -10.605 13.106
526 HD3 ARG 68 1HD ARG 68 7.612 -11.994 13.456
527 HE ARG 68 HE ARG 68 7.739 -11.438 10.653
528 HH11 ARG 68 1HH1 ARG 68 9.566 -12.964 13.265
529 HH12 ARG 68 2HH1 ARG 68 10.420 -14.023 12.190
530 HH21 ARG 68 1HH2 ARG 68 8.921 -12.814 9.286
531 HH22 ARG 68 2HH2 ARG 68 10.057 -13.942 9.957
532 H LEU 69 H LEU 69 6.347 -6.713 13.821
533 HA LEU 69 HA LEU 69 8.035 -6.922 16.179
534 HB2 LEU 69 2HB LEU 69 5.262 -5.715 15.804
535 HB3 LEU 69 1HB LEU 69 6.140 -5.686 17.324
536 HG LEU 69 HG LEU 69 7.042 -4.323 14.752
537 HD11 LEU 69 1HD1 LEU 69 5.908 -3.103 17.296
538 HD12 LEU 69 2HD1 LEU 69 5.089 -3.215 15.738
539 HD13 LEU 69 3HD1 LEU 69 6.523 -2.211 15.900
540 HD21 LEU 69 3HD2 LEU 69 8.308 -4.261 17.517
541 HD22 LEU 69 1HD2 LEU 69 8.796 -3.272 16.138
542 HD23 LEU 69 2HD2 LEU 69 8.977 -5.020 16.069
543 H THR 70 H THR 70 4.538 -7.593 15.952
544 HA THR 70 HA THR 70 4.660 -10.364 16.501
545 HB THR 70 HB THR 70 5.303 -9.764 18.772
546 HG1 THR 70 HG1 THR 70 4.019 -11.398 19.109
547 HG21 THR 70 3HG2 THR 70 4.517 -7.420 18.896
548 HG22 THR 70 1HG2 THR 70 3.948 -8.356 20.280
549 HG23 THR 70 2HG2 THR 70 2.845 -7.978 18.956
550 H TRP 71 H TRP 71 2.992 -10.972 15.285
551 HA TRP 71 HA TRP 71 0.324 -9.745 15.558
552 HB2 TRP 71 2HB TRP 71 1.719 -10.206 12.873
553 HB3 TRP 71 1HB TRP 71 0.015 -9.808 13.058
554 HD1 TRP 71 HD1 TRP 71 3.490 -8.193 13.044
555 HE1 TRP 71 HE1 TRP 71 3.207 -5.632 13.086
556 HE3 TRP 71 HE3 TRP 71 -1.550 -7.922 13.958
557 HZ2 TRP 71 HZ2 TRP 71 1.140 -3.758 13.455
558 HZ3 TRP 71 HZ3 TRP 71 -2.601 -5.702 14.145
559 HH2 TRP 71 HH2 TRP 71 -1.275 -3.663 13.899
560 H ARG 72 H ARG 72 2.159 -12.162 13.678
561 HA ARG 72 HA ARG 72 1.908 -14.320 13.117
562 HB2 ARG 72 2HB ARG 72 0.274 -14.504 15.683
563 HB3 ARG 72 1HB ARG 72 0.855 -15.880 14.754
564 HG2 ARG 72 2HG ARG 72 3.178 -15.304 15.256
565 HG3 ARG 72 1HG ARG 72 2.653 -13.829 16.079
566 HD2 ARG 72 2HD ARG 72 3.195 -15.595 17.701
567 HD3 ARG 72 1HD ARG 72 1.486 -15.173 17.783
568 HE ARG 72 HE ARG 72 2.621 -17.636 16.601
569 HH11 ARG 72 1HH1 ARG 72 -0.200 -15.927 17.854
570 HH12 ARG 72 2HH1 ARG 72 -1.197 -17.345 17.847
571 HH21 ARG 72 1HH2 ARG 72 1.297 -19.475 16.632
572 HH22 ARG 72 2HH2 ARG 72 -0.352 -19.348 17.151
573 H VAL 73 H VAL 73 0.701 -13.648 11.265
574 HA VAL 73 HA VAL 73 -2.197 -14.294 11.341
575 HB VAL 73 HB VAL 73 -0.616 -12.686 9.271
576 HG11 VAL 73 1HG1 VAL 73 -2.780 -12.252 8.158
577 HG12 VAL 73 2HG1 VAL 73 -3.589 -13.361 9.266
578 HG13 VAL 73 3HG1 VAL 73 -2.385 -13.971 8.129
579 HG21 VAL 73 3HG2 VAL 73 -1.997 -10.786 10.064
580 HG22 VAL 73 1HG2 VAL 73 -1.022 -11.467 11.368
581 HG23 VAL 73 2HG2 VAL 73 -2.748 -11.829 11.273
582 H GLN 74 H GLN 74 0.771 -14.833 9.400
583 HA GLN 74 HA GLN 74 -0.394 -17.286 8.242
584 HB2 GLN 74 2HB GLN 74 0.755 -15.637 6.725
585 HB3 GLN 74 1HB GLN 74 2.260 -15.923 7.589
586 HG2 GLN 74 2HG GLN 74 2.323 -17.212 5.558
587 HG3 GLN 74 1HG GLN 74 2.131 -18.340 6.896
588 HE21 GLN 74 1HE2 GLN 74 1.340 -19.898 5.413
589 HE22 GLN 74 2HE2 GLN 74 -0.278 -19.821 4.824
590 H ARG 75 H ARG 75 -0.296 -18.720 9.951
591 HA ARG 75 HA ARG 75 2.398 -19.528 10.901
592 HB2 ARG 75 2HB ARG 75 -0.280 -20.256 12.183
593 HB3 ARG 75 1HB ARG 75 1.321 -20.666 12.787
594 HG2 ARG 75 2HG ARG 75 0.858 -18.878 14.164
595 HG3 ARG 75 1HG ARG 75 1.618 -18.005 12.832
596 HD2 ARG 75 2HD ARG 75 -0.415 -16.872 13.565
597 HD3 ARG 75 1HD ARG 75 -0.630 -17.478 11.918
598 HE ARG 75 HE ARG 75 -1.734 -19.467 13.157
599 HH11 ARG 75 1HH1 ARG 75 -2.073 -16.101 14.134
600 HH12 ARG 75 2HH1 ARG 75 -3.624 -16.354 14.865
601 HH21 ARG 75 1HH2 ARG 75 -3.770 -19.774 14.082
602 HH22 ARG 75 2HH2 ARG 75 -4.588 -18.440 14.833
603 H SER 76 H SER 76 -0.813 -20.872 10.114
604 HA SER 76 HA SER 76 0.157 -23.479 9.399
605 HB2 SER 76 2HB SER 76 -2.572 -22.154 9.007
606 HB3 SER 76 1HB SER 76 -2.231 -23.874 8.761
607 HG SER 76 HG SER 76 -3.123 -23.337 10.840
608 H GLN 77 H GLN 77 -0.310 -24.458 7.279
609 HA GLN 77 HA GLN 77 -0.074 -24.707 5.061
610 HB2 GLN 77 2HB GLN 77 -2.248 -23.374 5.107
611 HB3 GLN 77 1HB GLN 77 -1.304 -21.925 4.788
612 HG2 GLN 77 2HG GLN 77 -0.511 -23.004 2.647
613 HG3 GLN 77 1HG GLN 77 -1.640 -24.325 2.965
614 HE21 GLN 77 1HE2 GLN 77 -3.875 -23.908 2.849
615 HE22 GLN 77 2HE2 GLN 77 -4.520 -22.518 2.051
616 H ASN 78 H ASN 78 2.237 -24.329 6.002
617 HA ASN 78 HA ASN 78 4.382 -23.756 5.648
618 HB2 ASN 78 2HB ASN 78 4.037 -24.198 3.299
619 HB3 ASN 78 1HB ASN 78 3.254 -22.648 3.053
620 HD21 ASN 78 1HD2 ASN 78 6.330 -23.299 4.778
621 HD22 ASN 78 2HD2 ASN 78 7.290 -22.362 3.695
622 HA PRO 79 HA PRO 79 4.363 -19.542 7.416
623 HB2 PRO 79 2HB PRO 79 6.875 -19.599 8.511
624 HB3 PRO 79 1HB PRO 79 5.506 -20.444 9.262
625 HG2 PRO 79 2HG PRO 79 7.666 -21.566 7.505
626 HG3 PRO 79 1HG PRO 79 7.003 -22.218 9.021
627 HD2 PRO 79 2HD PRO 79 6.215 -23.139 6.579
628 HD3 PRO 79 1HD PRO 79 5.115 -23.094 7.979
629 H LEU 80 H LEU 80 5.201 -17.588 6.667
630 HA LEU 80 HA LEU 80 6.581 -17.573 4.120
631 HB2 LEU 80 2HB LEU 80 5.729 -15.244 5.895
632 HB3 LEU 80 1HB LEU 80 6.293 -15.108 4.233
633 HG LEU 80 HG LEU 80 3.739 -16.470 5.148
634 HD11 LEU 80 1HD1 LEU 80 4.110 -13.896 3.594
635 HD12 LEU 80 2HD1 LEU 80 3.563 -14.048 5.266
636 HD13 LEU 80 3HD1 LEU 80 2.567 -14.675 3.955
637 HD21 LEU 80 3HD2 LEU 80 3.193 -16.764 2.767
638 HD22 LEU 80 1HD2 LEU 80 4.632 -17.673 3.229
639 HD23 LEU 80 2HD2 LEU 80 4.792 -16.167 2.322
640 H LYS 81 H LYS 81 8.424 -15.981 3.803
641 HA LYS 81 HA LYS 81 10.193 -15.320 5.946
642 HB2 LYS 81 2HB LYS 81 10.630 -17.818 5.717
643 HB3 LYS 81 1HB LYS 81 11.104 -17.544 4.052
644 HG2 LYS 81 2HG LYS 81 13.130 -17.764 5.211
645 HG3 LYS 81 1HG LYS 81 12.966 -16.027 4.993
646 HD2 LYS 81 2HD LYS 81 11.968 -17.273 7.559
647 HD3 LYS 81 1HD LYS 81 13.704 -17.073 7.339
648 HE2 LYS 81 2HE LYS 81 11.679 -14.821 7.145
649 HE3 LYS 81 1HE LYS 81 12.633 -15.193 8.577
650 HZ1 LYS 81 3HZ LYS 81 13.751 -14.430 5.938
651 HZ2 LYS 81 1HZ LYS 81 14.635 -14.735 7.345
652 HZ3 LYS 81 2HZ LYS 81 13.597 -13.406 7.273
653 H ILE 82 H ILE 82 10.890 -13.371 5.205
654 HA ILE 82 HA ILE 82 11.462 -13.030 2.305
655 HB ILE 82 HB ILE 82 11.047 -10.648 2.531
656 HG12 ILE 82 2HG1 ILE 82 10.577 -11.073 5.524
657 HG13 ILE 82 1HG1 ILE 82 12.026 -10.366 4.830
658 HG21 ILE 82 1HG2 ILE 82 9.016 -12.025 2.215
659 HG22 ILE 82 2HG2 ILE 82 8.643 -10.571 3.142
660 HG23 ILE 82 3HG2 ILE 82 8.799 -12.126 3.964
661 HD11 ILE 82 3HD1 ILE 82 10.604 -8.660 5.737
662 HD12 ILE 82 1HD1 ILE 82 9.254 -9.196 4.736
663 HD13 ILE 82 2HD1 ILE 82 10.688 -8.491 3.984
664 H ARG 83 H ARG 83 13.161 -11.218 2.009
665 HA ARG 83 HA ARG 83 15.265 -11.004 3.969
666 HB2 ARG 83 2HB ARG 83 17.015 -11.958 2.381
667 HB3 ARG 83 1HB ARG 83 15.942 -13.144 3.108
668 HG2 ARG 83 2HG ARG 83 14.620 -13.237 1.010
669 HG3 ARG 83 1HG ARG 83 15.717 -12.064 0.274
670 HD2 ARG 83 2HD ARG 83 16.327 -14.277 -0.467
671 HD3 ARG 83 1HD ARG 83 17.590 -13.694 0.619
672 HE ARG 83 HE ARG 83 15.598 -15.235 1.986
673 HH11 ARG 83 1HH1 ARG 83 18.530 -15.504 0.056
674 HH12 ARG 83 2HH1 ARG 83 18.937 -17.075 0.671
675 HH21 ARG 83 1HH2 ARG 83 16.070 -17.354 2.705
676 HH22 ARG 83 2HH2 ARG 83 17.534 -18.127 2.185
677 H LEU 84 H LEU 84 14.867 -8.816 3.824
678 HA LEU 84 HA LEU 84 15.483 -7.444 1.267
679 HB2 LEU 84 2HB LEU 84 13.646 -6.534 3.516
680 HB3 LEU 84 1HB LEU 84 14.055 -5.565 2.108
681 HG LEU 84 HG LEU 84 12.503 -8.184 2.070
682 HD11 LEU 84 1HD1 LEU 84 11.547 -5.348 1.591
683 HD12 LEU 84 2HD1 LEU 84 11.180 -6.358 2.991
684 HD13 LEU 84 3HD1 LEU 84 10.580 -6.815 1.401
685 HD21 LEU 84 3HD2 LEU 84 13.206 -6.348 -0.241
686 HD22 LEU 84 1HD2 LEU 84 12.135 -7.751 -0.322
687 HD23 LEU 84 2HD2 LEU 84 13.844 -7.969 0.041
688 H THR 85 H THR 85 17.671 -7.387 1.681
689 HA THR 85 HA THR 85 18.600 -5.627 3.879
690 HB THR 85 HB THR 85 20.849 -6.742 3.567
691 HG1 THR 85 HG1 THR 85 20.571 -7.507 1.433
692 HG21 THR 85 3HG2 THR 85 20.273 -8.909 4.625
693 HG22 THR 85 1HG2 THR 85 18.577 -8.670 4.183
694 HG23 THR 85 2HG2 THR 85 19.353 -7.584 5.336
695 H ARG 86 H ARG 86 18.908 -3.615 3.070
696 HA ARG 86 HA ARG 86 20.104 -3.275 0.372
697 HB2 ARG 86 2HB ARG 86 18.584 -1.215 2.046
698 HB3 ARG 86 1HB ARG 86 19.183 -1.003 0.406
699 HG2 ARG 86 2HG ARG 86 17.622 -2.906 -0.295
700 HG3 ARG 86 1HG ARG 86 16.923 -2.793 1.321
701 HD2 ARG 86 2HD ARG 86 15.557 -1.512 -0.220
702 HD3 ARG 86 1HD ARG 86 16.379 -0.393 0.875
703 HE ARG 86 HE ARG 86 17.617 -0.951 -1.738
704 HH11 ARG 86 1HH1 ARG 86 15.890 1.367 0.293
705 HH12 ARG 86 2HH1 ARG 86 16.264 2.710 -0.744
706 HH21 ARG 86 1HH2 ARG 86 18.079 0.821 -3.087
707 HH22 ARG 86 2HH2 ARG 86 17.500 2.400 -2.651
708 H GLU 87 H GLU 87 22.087 -2.495 0.266
709 HA GLU 87 HA GLU 87 23.456 -1.514 2.700
710 HB2 GLU 87 2HB GLU 87 25.521 -2.623 1.819
711 HB3 GLU 87 1HB GLU 87 24.242 -3.749 2.208
712 HG2 GLU 87 2HG GLU 87 24.917 -2.864 -0.608
713 HG3 GLU 87 1HG GLU 87 25.533 -4.321 0.155
714 H ALA 88 H ALA 88 23.627 0.573 2.474
715 HA ALA 88 HA ALA 88 23.621 2.041 0.049
716 HB1 ALA 88 3HB ALA 88 22.765 2.980 2.154
717 HB2 ALA 88 1HB ALA 88 24.018 4.017 1.477
718 HB3 ALA 88 2HB ALA 88 24.389 2.960 2.843
719 HA PRO 89 HA PRO 89 27.965 1.394 -1.040
720 HB2 PRO 89 2HB PRO 89 27.557 3.686 -2.944
721 HB3 PRO 89 1HB PRO 89 28.042 2.009 -3.281
722 HG2 PRO 89 2HG PRO 89 25.606 2.865 -3.922
723 HG3 PRO 89 1HG PRO 89 25.847 1.219 -3.285
724 HD2 PRO 89 2HD PRO 89 24.881 3.686 -1.821
725 HD3 PRO 89 1HD PRO 89 24.241 2.026 -1.776
Start of MODEL 3
1 H1 HIS 1 1H HIS 1 -16.059 -16.371 7.005
2 H2 HIS 1 2H HIS 1 -15.064 -15.965 8.309
3 H3 HIS 1 3H HIS 1 -14.991 -17.517 7.640
4 HA HIS 1 HA HIS 1 -14.149 -16.671 5.588
5 HB2 HIS 1 2HB HIS 1 -14.412 -13.973 6.975
6 HB3 HIS 1 1HB HIS 1 -13.394 -14.200 5.557
7 HD1 HIS 1 HD1 HIS 1 -14.639 -14.736 3.283
8 HD2 HIS 1 HD2 HIS 1 -17.164 -13.723 6.434
9 HE1 HIS 1 HE1 HIS 1 -16.851 -14.186 2.233
10 HE2 HIS 1 HE2 HIS 1 -18.379 -13.668 4.157
11 H HIS 2 H HIS 2 -12.455 -17.990 6.029
12 HA HIS 2 HA HIS 2 -10.186 -16.919 7.611
13 HB2 HIS 2 2HB HIS 2 -11.290 -19.760 7.658
14 HB3 HIS 2 1HB HIS 2 -9.682 -19.356 8.242
15 HD1 HIS 2 HD1 HIS 2 -11.123 -16.574 9.539
16 HD2 HIS 2 HD2 HIS 2 -11.784 -20.596 10.373
17 HE1 HIS 2 HE1 HIS 2 -12.091 -16.639 11.852
18 HE2 HIS 2 HE2 HIS 2 -12.219 -19.077 12.417
19 H HIS 3 H HIS 3 -8.333 -16.850 6.444
20 HA HIS 3 HA HIS 3 -7.564 -18.839 4.533
21 HB2 HIS 3 2HB HIS 3 -7.374 -17.275 2.546
22 HB3 HIS 3 1HB HIS 3 -9.026 -17.682 2.989
23 HD1 HIS 3 HD1 HIS 3 -6.967 -14.832 2.161
24 HD2 HIS 3 HD2 HIS 3 -10.288 -15.498 4.565
25 HE1 HIS 3 HE1 HIS 3 -7.980 -12.572 2.551
26 HE2 HIS 3 HE2 HIS 3 -9.911 -12.991 4.103
27 H HIS 4 H HIS 4 -5.387 -18.952 4.480
28 HA HIS 4 HA HIS 4 -3.732 -16.612 5.232
29 HB2 HIS 4 2HB HIS 4 -3.427 -19.481 6.238
30 HB3 HIS 4 1HB HIS 4 -2.197 -18.240 6.450
31 HD1 HIS 4 HD1 HIS 4 -2.413 -16.783 8.497
32 HD2 HIS 4 HD2 HIS 4 -5.883 -18.943 7.752
33 HE1 HIS 4 HE1 HIS 4 -3.902 -16.372 10.470
34 HE2 HIS 4 HE2 HIS 4 -5.933 -17.794 10.059
35 H HIS 5 H HIS 5 -2.149 -16.213 3.748
36 HA HIS 5 HA HIS 5 -1.437 -18.320 1.782
37 HB2 HIS 5 2HB HIS 5 -2.324 -15.462 1.225
38 HB3 HIS 5 1HB HIS 5 -1.389 -16.385 0.051
39 HD1 HIS 5 HD1 HIS 5 -4.782 -15.608 0.853
40 HD2 HIS 5 HD2 HIS 5 -2.801 -18.972 -0.573
41 HE1 HIS 5 HE1 HIS 5 -6.559 -17.048 -0.191
42 HE2 HIS 5 HE2 HIS 5 -5.358 -19.148 -0.867
43 H HIS 6 H HIS 6 0.474 -17.699 0.443
44 HA HIS 6 HA HIS 6 2.737 -17.016 2.088
45 HB2 HIS 6 2HB HIS 6 2.700 -17.376 -0.939
46 HB3 HIS 6 1HB HIS 6 4.089 -17.536 0.129
47 HD1 HIS 6 HD1 HIS 6 4.260 -19.755 1.518
48 HD2 HIS 6 HD2 HIS 6 1.065 -19.620 -1.138
49 HE1 HIS 6 HE1 HIS 6 3.392 -22.100 1.370
50 HE2 HIS 6 HE2 HIS 6 1.330 -21.923 -0.028
51 H SER 7 H SER 7 3.273 -14.937 2.524
52 HA SER 7 HA SER 7 2.877 -12.804 0.553
53 HB2 SER 7 2HB SER 7 1.525 -12.864 3.290
54 HB3 SER 7 1HB SER 7 1.584 -11.449 2.233
55 HG SER 7 HG SER 7 0.689 -13.315 0.694
56 H HIS 8 H HIS 8 3.542 -10.637 1.580
57 HA HIS 8 HA HIS 8 6.161 -10.703 2.744
58 HB2 HIS 8 2HB HIS 8 4.176 -8.398 2.413
59 HB3 HIS 8 1HB HIS 8 5.830 -8.195 2.976
60 HD1 HIS 8 HD1 HIS 8 5.858 -6.528 0.858
61 HD2 HIS 8 HD2 HIS 8 5.696 -10.585 -0.026
62 HE1 HIS 8 HE1 HIS 8 6.509 -6.712 -1.553
63 HE2 HIS 8 HE2 HIS 8 6.524 -9.181 -2.025
64 H MET 9 H MET 9 6.670 -9.665 4.852
65 HA MET 9 HA MET 9 5.330 -10.841 7.023
66 HB2 MET 9 2HB MET 9 6.827 -9.542 8.471
67 HB3 MET 9 1HB MET 9 7.736 -10.145 7.099
68 HG2 MET 9 2HG MET 9 7.689 -7.921 6.065
69 HG3 MET 9 1HG MET 9 6.713 -7.318 7.410
70 HE1 MET 9 3HE MET 9 9.279 -5.705 6.707
71 HE2 MET 9 1HE MET 9 10.034 -5.531 8.291
72 HE3 MET 9 2HE MET 9 8.286 -5.373 8.127
73 H VAL 10 H VAL 10 3.688 -10.130 8.347
74 HA VAL 10 HA VAL 10 1.911 -8.163 7.379
75 HB VAL 10 HB VAL 10 0.562 -8.546 9.448
76 HG11 VAL 10 1HG1 VAL 10 1.518 -11.075 8.065
77 HG12 VAL 10 2HG1 VAL 10 0.245 -9.991 7.507
78 HG13 VAL 10 3HG1 VAL 10 0.026 -10.910 8.991
79 HG21 VAL 10 3HG2 VAL 10 1.227 -10.272 11.088
80 HG22 VAL 10 1HG2 VAL 10 2.359 -8.918 11.094
81 HG23 VAL 10 2HG2 VAL 10 2.800 -10.430 10.299
82 H GLY 11 H GLY 11 1.535 -6.106 7.896
83 HA2 GLY 11 2HA GLY 11 1.739 -4.080 9.056
84 HA3 GLY 11 1HA GLY 11 3.055 -4.748 10.010
85 H ASP 12 H ASP 12 3.369 -5.376 6.629
86 HA ASP 12 HA ASP 12 5.877 -4.174 6.391
87 HB2 ASP 12 2HB ASP 12 4.985 -5.990 4.911
88 HB3 ASP 12 1HB ASP 12 3.916 -4.834 4.133
89 H THR 13 H THR 13 6.489 -2.092 6.255
90 HA THR 13 HA THR 13 4.550 0.023 6.211
91 HB THR 13 HB THR 13 7.597 0.245 6.161
92 HG1 THR 13 HG1 THR 13 5.755 0.079 8.322
93 HG21 THR 13 3HG2 THR 13 5.484 2.208 7.111
94 HG22 THR 13 1HG2 THR 13 6.407 2.352 5.606
95 HG23 THR 13 2HG2 THR 13 7.230 2.449 7.163
96 H VAL 14 H VAL 14 3.709 0.748 4.370
97 HA VAL 14 HA VAL 14 5.380 1.275 2.001
98 HB VAL 14 HB VAL 14 3.616 0.491 0.486
99 HG11 VAL 14 1HG1 VAL 14 4.404 -1.700 2.440
100 HG12 VAL 14 2HG1 VAL 14 5.356 -1.131 1.068
101 HG13 VAL 14 3HG1 VAL 14 3.818 -1.946 0.789
102 HG21 VAL 14 3HG2 VAL 14 1.639 0.895 1.889
103 HG22 VAL 14 1HG2 VAL 14 2.094 -0.432 2.962
104 HG23 VAL 14 2HG2 VAL 14 1.634 -0.760 1.288
105 H TRP 15 H TRP 15 3.988 2.623 0.403
106 HA TRP 15 HA TRP 15 2.216 4.557 1.786
107 HB2 TRP 15 2HB TRP 15 4.323 5.083 -0.373
108 HB3 TRP 15 1HB TRP 15 3.094 6.258 0.099
109 HD1 TRP 15 HD1 TRP 15 3.431 5.521 3.322
110 HE1 TRP 15 HE1 TRP 15 5.410 6.568 4.560
111 HE3 TRP 15 HE3 TRP 15 6.426 6.613 -0.679
112 HZ2 TRP 15 HZ2 TRP 15 7.892 7.735 3.961
113 HZ3 TRP 15 HZ3 TRP 15 8.589 7.714 -0.254
114 HH2 TRP 15 HH2 TRP 15 9.308 8.262 2.019
115 H VAL 16 H VAL 16 0.291 4.925 0.763
116 HA VAL 16 HA VAL 16 -0.177 3.532 -1.821
117 HB VAL 16 HB VAL 16 -2.236 4.209 0.345
118 HG11 VAL 16 1HG1 VAL 16 -3.236 4.493 -1.894
119 HG12 VAL 16 2HG1 VAL 16 -3.889 3.056 -1.107
120 HG13 VAL 16 3HG1 VAL 16 -2.665 2.891 -2.367
121 HG21 VAL 16 3HG2 VAL 16 -0.840 2.250 0.891
122 HG22 VAL 16 1HG2 VAL 16 -1.214 1.530 -0.677
123 HG23 VAL 16 2HG2 VAL 16 -2.491 1.745 0.524
124 H ARG 17 H ARG 17 0.119 4.924 -3.329
125 HA ARG 17 HA ARG 17 -0.406 7.737 -3.247
126 HB2 ARG 17 2HB ARG 17 1.467 6.783 -4.522
127 HB3 ARG 17 1HB ARG 17 0.359 5.827 -5.504
128 HG2 ARG 17 2HG ARG 17 -0.602 7.956 -6.401
129 HG3 ARG 17 1HG ARG 17 0.602 8.851 -5.474
130 HD2 ARG 17 2HD ARG 17 1.262 6.798 -7.609
131 HD3 ARG 17 1HD ARG 17 1.187 8.539 -7.886
132 HE ARG 17 HE ARG 17 2.970 8.300 -5.841
133 HH11 ARG 17 1HH1 ARG 17 2.789 6.821 -9.051
134 HH12 ARG 17 2HH1 ARG 17 4.512 6.691 -9.218
135 HH21 ARG 17 1HH2 ARG 17 5.231 8.205 -6.119
136 HH22 ARG 17 2HH2 ARG 17 5.898 7.478 -7.549
137 H ARG 18 H ARG 18 -2.446 8.448 -3.318
138 HA ARG 18 HA ARG 18 -4.508 7.075 -4.957
139 HB2 ARG 18 2HB ARG 18 -4.998 7.291 -2.541
140 HB3 ARG 18 1HB ARG 18 -4.778 9.036 -2.632
141 HG2 ARG 18 2HG ARG 18 -6.765 9.260 -4.036
142 HG3 ARG 18 1HG ARG 18 -6.943 7.503 -4.123
143 HD2 ARG 18 2HD ARG 18 -7.189 9.220 -1.631
144 HD3 ARG 18 1HD ARG 18 -8.517 8.430 -2.490
145 HE ARG 18 HE ARG 18 -6.862 6.366 -1.866
146 HH11 ARG 18 1HH1 ARG 18 -8.398 8.875 0.094
147 HH12 ARG 18 2HH1 ARG 18 -8.451 7.882 1.519
148 HH21 ARG 18 1HH2 ARG 18 -6.869 5.126 0.031
149 HH22 ARG 18 2HH2 ARG 18 -7.583 5.763 1.476
150 H HIS 19 H HIS 19 -5.867 8.388 -6.323
151 HA HIS 19 HA HIS 19 -4.640 10.206 -7.971
152 HB2 HIS 19 2HB HIS 19 -7.616 9.870 -7.404
153 HB3 HIS 19 1HB HIS 19 -7.003 10.920 -8.680
154 HD1 HIS 19 HD1 HIS 19 -5.501 9.642 -10.558
155 HD2 HIS 19 HD2 HIS 19 -7.985 7.286 -8.191
156 HE1 HIS 19 HE1 HIS 19 -5.735 7.455 -11.785
157 HE2 HIS 19 HE2 HIS 19 -7.299 6.091 -10.370
158 H GLN 20 H GLN 20 -6.926 11.057 -5.362
159 HA GLN 20 HA GLN 20 -7.364 12.921 -4.165
160 HB2 GLN 20 2HB GLN 20 -4.512 13.788 -4.844
161 HB3 GLN 20 1HB GLN 20 -5.506 14.428 -3.545
162 HG2 GLN 20 2HG GLN 20 -4.498 11.573 -3.696
163 HG3 GLN 20 1HG GLN 20 -3.720 12.858 -2.789
164 HE21 GLN 20 1HE2 GLN 20 -6.218 14.003 -1.780
165 HE22 GLN 20 2HE2 GLN 20 -6.809 12.885 -0.607
166 H THR 21 H THR 21 -5.168 14.448 -6.484
167 HA THR 21 HA THR 21 -7.090 16.309 -7.553
168 HB THR 21 HB THR 21 -5.149 16.849 -9.117
169 HG1 THR 21 HG1 THR 21 -4.308 14.461 -8.271
170 HG21 THR 21 3HG2 THR 21 -5.396 18.065 -6.970
171 HG22 THR 21 1HG2 THR 21 -3.694 17.835 -7.376
172 HG23 THR 21 2HG2 THR 21 -4.456 16.816 -6.150
173 H LYS 22 H LYS 22 -7.368 16.443 -10.006
174 HA LYS 22 HA LYS 22 -8.548 13.916 -10.862
175 HB2 LYS 22 2HB LYS 22 -8.718 16.692 -12.128
176 HB3 LYS 22 1HB LYS 22 -9.660 15.282 -12.618
177 HG2 LYS 22 2HG LYS 22 -10.682 15.221 -10.346
178 HG3 LYS 22 1HG LYS 22 -9.811 16.704 -9.944
179 HD2 LYS 22 2HD LYS 22 -10.996 17.905 -11.744
180 HD3 LYS 22 1HD LYS 22 -11.839 16.420 -12.198
181 HE2 LYS 22 2HE LYS 22 -12.098 17.871 -9.545
182 HE3 LYS 22 1HE LYS 22 -13.281 17.873 -10.851
183 HZ1 LYS 22 3HZ LYS 22 -13.572 15.499 -10.559
184 HZ2 LYS 22 1HZ LYS 22 -13.872 16.310 -9.106
185 HZ3 LYS 22 2HZ LYS 22 -12.421 15.474 -9.326
186 H ASN 23 H ASN 23 -6.300 16.337 -12.271
187 HA ASN 23 HA ASN 23 -5.372 14.314 -14.247
188 HB2 ASN 23 2HB ASN 23 -5.754 17.318 -14.612
189 HB3 ASN 23 1HB ASN 23 -4.799 16.338 -15.722
190 HD21 ASN 23 1HD2 ASN 23 -5.847 14.775 -17.018
191 HD22 ASN 23 2HD2 ASN 23 -7.549 14.850 -17.315
192 H LEU 24 H LEU 24 -4.411 16.603 -11.807
193 HA LEU 24 HA LEU 24 -1.619 16.657 -12.444
194 HB2 LEU 24 2HB LEU 24 -2.997 17.133 -9.775
195 HB3 LEU 24 1HB LEU 24 -1.297 17.436 -10.086
196 HG LEU 24 HG LEU 24 -3.649 18.933 -11.312
197 HD11 LEU 24 1HD1 LEU 24 -2.782 20.869 -10.085
198 HD12 LEU 24 2HD1 LEU 24 -1.503 19.879 -9.381
199 HD13 LEU 24 3HD1 LEU 24 -3.193 19.554 -8.983
200 HD21 LEU 24 3HD2 LEU 24 -1.987 20.378 -12.412
201 HD22 LEU 24 1HD2 LEU 24 -1.876 18.712 -12.985
202 HD23 LEU 24 2HD2 LEU 24 -0.687 19.331 -11.838
203 H GLU 25 H GLU 25 0.035 15.741 -10.979
204 HA GLU 25 HA GLU 25 0.139 12.975 -11.029
205 HB2 GLU 25 2HB GLU 25 1.694 14.908 -9.252
206 HB3 GLU 25 1HB GLU 25 2.121 13.210 -9.472
207 HG2 GLU 25 2HG GLU 25 2.628 13.556 -11.804
208 HG3 GLU 25 1HG GLU 25 1.965 15.188 -11.763
209 HA PRO 26 HA PRO 26 -2.548 11.877 -7.496
210 HB2 PRO 26 2HB PRO 26 -1.686 9.203 -7.373
211 HB3 PRO 26 1HB PRO 26 -2.966 9.800 -8.445
212 HG2 PRO 26 2HG PRO 26 -0.073 9.329 -9.066
213 HG3 PRO 26 1HG PRO 26 -1.511 8.930 -10.032
214 HD2 PRO 26 2HD PRO 26 -0.064 11.075 -10.645
215 HD3 PRO 26 1HD PRO 26 -1.841 11.152 -10.715
216 H ARG 27 H ARG 27 -2.209 11.776 -5.274
217 HA ARG 27 HA ARG 27 0.567 12.304 -4.429
218 HB2 ARG 27 2HB ARG 27 -1.138 14.089 -4.092
219 HB3 ARG 27 1HB ARG 27 -2.061 13.008 -3.057
220 HG2 ARG 27 2HG ARG 27 -0.287 12.984 -1.399
221 HG3 ARG 27 1HG ARG 27 0.774 13.917 -2.459
222 HD2 ARG 27 2HD ARG 27 -1.757 14.834 -1.076
223 HD3 ARG 27 1HD ARG 27 -0.122 15.444 -0.843
224 HE ARG 27 HE ARG 27 -2.015 16.389 -2.692
225 HH11 ARG 27 1HH1 ARG 27 1.459 15.720 -2.618
226 HH12 ARG 27 2HH1 ARG 27 1.820 16.885 -3.850
227 HH21 ARG 27 1HH2 ARG 27 -1.514 17.885 -4.314
228 HH22 ARG 27 2HH2 ARG 27 0.133 18.109 -4.813
229 H TRP 28 H TRP 28 1.592 11.010 -3.051
230 HA TRP 28 HA TRP 28 0.430 8.554 -2.120
231 HB2 TRP 28 2HB TRP 28 2.659 8.049 -1.194
232 HB3 TRP 28 1HB TRP 28 2.797 8.617 -2.852
233 HD1 TRP 28 HD1 TRP 28 3.984 11.028 -3.227
234 HE1 TRP 28 HE1 TRP 28 5.599 12.372 -1.762
235 HE3 TRP 28 HE3 TRP 28 3.194 8.683 1.268
236 HZ2 TRP 28 HZ2 TRP 28 6.440 12.452 0.916
237 HZ3 TRP 28 HZ3 TRP 28 4.447 9.469 3.238
238 HH2 TRP 28 HH2 TRP 28 6.039 11.318 3.064
239 H LYS 29 H LYS 29 -0.129 7.971 -0.091
240 HA LYS 29 HA LYS 29 0.330 9.839 2.174
241 HB2 LYS 29 2HB LYS 29 -2.100 8.031 1.768
242 HB3 LYS 29 1HB LYS 29 -1.796 9.027 3.188
243 HG2 LYS 29 2HG LYS 29 -1.950 11.064 1.742
244 HG3 LYS 29 1HG LYS 29 -2.370 10.026 0.376
245 HD2 LYS 29 2HD LYS 29 -3.966 10.310 2.956
246 HD3 LYS 29 1HD LYS 29 -4.384 11.028 1.401
247 HE2 LYS 29 2HE LYS 29 -4.200 8.042 1.932
248 HE3 LYS 29 1HE LYS 29 -5.690 8.976 1.910
249 HZ1 LYS 29 3HZ LYS 29 -3.860 8.791 -0.403
250 HZ2 LYS 29 1HZ LYS 29 -5.420 9.443 -0.362
251 HZ3 LYS 29 2HZ LYS 29 -5.193 7.779 -0.168
252 H GLY 30 H GLY 30 0.553 8.707 4.251
253 HA2 GLY 30 2HA GLY 30 0.636 5.992 4.697
254 HA3 GLY 30 1HA GLY 30 2.205 6.375 4.035
255 HA PRO 31 HA PRO 31 3.214 4.990 5.335
256 HB2 PRO 31 2HB PRO 31 4.263 3.698 7.473
257 HB3 PRO 31 1HB PRO 31 5.006 5.182 6.838
258 HG2 PRO 31 2HG PRO 31 3.278 4.826 9.252
259 HG3 PRO 31 1HG PRO 31 4.706 5.860 9.028
260 HD2 PRO 31 2HD PRO 31 2.037 6.732 8.844
261 HD3 PRO 31 1HD PRO 31 3.451 7.599 8.208
262 H TYR 32 H TYR 32 1.635 3.685 4.606
263 HA TYR 32 HA TYR 32 -0.378 2.397 6.226
264 HB2 TYR 32 2HB TYR 32 0.477 2.119 3.315
265 HB3 TYR 32 1HB TYR 32 -0.784 1.116 4.014
266 HD1 TYR 32 HD1 TYR 32 -2.932 2.124 4.754
267 HD2 TYR 32 HD2 TYR 32 0.012 4.468 2.738
268 HE1 TYR 32 HE1 TYR 32 -4.626 3.830 4.279
269 HE2 TYR 32 HE2 TYR 32 -1.691 6.175 2.262
270 HH TYR 32 HH TYR 32 -4.678 6.282 3.781
271 H THR 33 H THR 33 -0.608 -0.034 6.251
272 HA THR 33 HA THR 33 1.996 -1.457 6.424
273 HB THR 33 HB THR 33 1.019 -2.600 8.519
274 HG1 THR 33 HG1 THR 33 -1.158 -1.775 8.147
275 HG21 THR 33 3HG2 THR 33 2.819 -0.940 8.725
276 HG22 THR 33 1HG2 THR 33 1.678 -0.780 10.063
277 HG23 THR 33 2HG2 THR 33 1.635 0.370 8.723
278 H VAL 34 H VAL 34 1.897 -3.047 4.935
279 HA VAL 34 HA VAL 34 -0.553 -4.276 4.042
280 HB VAL 34 HB VAL 34 2.337 -4.996 3.338
281 HG11 VAL 34 1HG1 VAL 34 0.794 -6.834 2.822
282 HG12 VAL 34 2HG1 VAL 34 1.390 -6.085 1.342
283 HG13 VAL 34 3HG1 VAL 34 -0.244 -5.733 1.907
284 HG21 VAL 34 3HG2 VAL 34 2.015 -3.675 1.292
285 HG22 VAL 34 1HG2 VAL 34 1.839 -2.676 2.735
286 HG23 VAL 34 2HG2 VAL 34 0.408 -3.191 1.842
287 H LEU 35 H LEU 35 -1.472 -6.012 4.909
288 HA LEU 35 HA LEU 35 0.020 -7.794 6.726
289 HB2 LEU 35 2HB LEU 35 -2.971 -7.753 6.153
290 HB3 LEU 35 1HB LEU 35 -2.157 -8.689 7.396
291 HG LEU 35 HG LEU 35 -2.532 -5.672 7.330
292 HD11 LEU 35 1HD1 LEU 35 -3.814 -6.022 9.385
293 HD12 LEU 35 2HD1 LEU 35 -3.543 -7.764 9.282
294 HD13 LEU 35 3HD1 LEU 35 -4.500 -6.944 8.046
295 HD21 LEU 35 3HD2 LEU 35 -1.371 -5.571 9.503
296 HD22 LEU 35 1HD2 LEU 35 -0.297 -6.097 8.207
297 HD23 LEU 35 2HD2 LEU 35 -0.936 -7.274 9.353
298 H LEU 36 H LEU 36 -1.555 -7.712 3.574
299 HA LEU 36 HA LEU 36 -0.807 -10.552 3.096
300 HB2 LEU 36 2HB LEU 36 -3.221 -10.415 3.758
301 HB3 LEU 36 1HB LEU 36 -3.509 -9.304 2.439
302 HG LEU 36 HG LEU 36 -2.827 -11.166 0.832
303 HD11 LEU 36 1HD1 LEU 36 -2.849 -13.469 1.647
304 HD12 LEU 36 2HD1 LEU 36 -3.022 -12.899 3.307
305 HD13 LEU 36 3HD1 LEU 36 -1.551 -12.544 2.401
306 HD21 LEU 36 3HD2 LEU 36 -5.257 -11.666 2.582
307 HD22 LEU 36 1HD2 LEU 36 -4.992 -12.328 0.968
308 HD23 LEU 36 2HD2 LEU 36 -5.178 -10.590 1.183
309 H THR 37 H THR 37 -0.074 -10.961 1.020
310 HA THR 37 HA THR 37 -0.327 -8.835 -1.035
311 HB THR 37 HB THR 37 1.964 -9.395 -1.878
312 HG1 THR 37 HG1 THR 37 2.192 -11.449 -0.912
313 HG21 THR 37 3HG2 THR 37 3.251 -8.172 -0.199
314 HG22 THR 37 1HG2 THR 37 1.991 -8.455 1.000
315 HG23 THR 37 2HG2 THR 37 1.660 -7.436 -0.402
316 H THR 38 H THR 38 -1.077 -9.520 -2.890
317 HA THR 38 HA THR 38 -0.897 -12.326 -3.783
318 HB THR 38 HB THR 38 -3.303 -12.053 -4.645
319 HG1 THR 38 HG1 THR 38 -3.208 -9.688 -4.239
320 HG21 THR 38 3HG2 THR 38 -2.898 -13.458 -2.650
321 HG22 THR 38 1HG2 THR 38 -4.424 -12.589 -2.500
322 HG23 THR 38 2HG2 THR 38 -3.002 -12.034 -1.611
323 HA PRO 39 HA PRO 39 0.405 -10.875 -7.824
324 HB2 PRO 39 2HB PRO 39 -2.222 -11.939 -8.930
325 HB3 PRO 39 1HB PRO 39 -0.573 -12.128 -9.575
326 HG2 PRO 39 2HG PRO 39 -1.655 -14.131 -8.240
327 HG3 PRO 39 1HG PRO 39 0.040 -13.689 -7.922
328 HD2 PRO 39 2HD PRO 39 -2.393 -13.144 -6.246
329 HD3 PRO 39 1HD PRO 39 -0.727 -13.515 -5.741
330 H THR 40 H THR 40 0.441 -8.682 -7.860
331 HA THR 40 HA THR 40 0.047 -6.604 -8.653
332 HB THR 40 HB THR 40 -2.430 -7.707 -10.053
333 HG1 THR 40 HG1 THR 40 0.141 -8.411 -10.359
334 HG21 THR 40 3HG2 THR 40 -0.580 -5.408 -10.806
335 HG22 THR 40 1HG2 THR 40 -2.223 -5.239 -10.187
336 HG23 THR 40 2HG2 THR 40 -1.948 -5.985 -11.762
337 H ALA 41 H ALA 41 -1.571 -7.883 -6.228
338 HA ALA 41 HA ALA 41 -3.002 -5.398 -5.559
339 HB1 ALA 41 3HB ALA 41 -4.725 -6.818 -6.611
340 HB2 ALA 41 1HB ALA 41 -5.041 -6.615 -4.891
341 HB3 ALA 41 2HB ALA 41 -4.358 -8.129 -5.486
342 H LEU 42 H LEU 42 -2.420 -4.860 -3.521
343 HA LEU 42 HA LEU 42 -1.417 -6.950 -1.669
344 HB2 LEU 42 2HB LEU 42 -0.465 -4.043 -1.749
345 HB3 LEU 42 1HB LEU 42 0.253 -5.384 -0.873
346 HG LEU 42 HG LEU 42 0.332 -4.918 -3.879
347 HD11 LEU 42 1HD1 LEU 42 1.891 -3.524 -2.645
348 HD12 LEU 42 2HD1 LEU 42 2.755 -4.736 -3.582
349 HD13 LEU 42 3HD1 LEU 42 2.570 -4.940 -1.837
350 HD21 LEU 42 3HD2 LEU 42 1.462 -7.301 -2.386
351 HD22 LEU 42 1HD2 LEU 42 1.747 -6.919 -4.086
352 HD23 LEU 42 2HD2 LEU 42 0.126 -7.323 -3.533
353 H LYS 43 H LYS 43 -2.665 -7.088 0.147
354 HA LYS 43 HA LYS 43 -4.660 -5.062 0.745
355 HB2 LYS 43 2HB LYS 43 -5.369 -7.403 0.901
356 HB3 LYS 43 1HB LYS 43 -4.100 -7.745 2.070
357 HG2 LYS 43 2HG LYS 43 -5.156 -6.171 3.682
358 HG3 LYS 43 1HG LYS 43 -6.453 -5.869 2.522
359 HD2 LYS 43 2HD LYS 43 -7.135 -8.248 2.670
360 HD3 LYS 43 1HD LYS 43 -5.818 -8.555 3.810
361 HE2 LYS 43 2HE LYS 43 -6.821 -6.991 5.422
362 HE3 LYS 43 1HE LYS 43 -8.114 -6.621 4.279
363 HZ1 LYS 43 3HZ LYS 43 -8.895 -8.191 5.884
364 HZ2 LYS 43 1HZ LYS 43 -7.607 -9.243 5.588
365 HZ3 LYS 43 2HZ LYS 43 -8.782 -8.978 4.397
366 H VAL 44 H VAL 44 -3.998 -3.364 1.821
367 HA VAL 44 HA VAL 44 -2.214 -3.435 4.136
368 HB VAL 44 HB VAL 44 -3.820 -1.177 2.829
369 HG11 VAL 44 1HG1 VAL 44 -1.783 -0.962 5.064
370 HG12 VAL 44 2HG1 VAL 44 -3.521 -0.681 5.201
371 HG13 VAL 44 3HG1 VAL 44 -2.527 0.391 4.215
372 HG21 VAL 44 3HG2 VAL 44 -0.837 -1.750 2.713
373 HG22 VAL 44 1HG2 VAL 44 -1.650 -0.359 1.988
374 HG23 VAL 44 2HG2 VAL 44 -1.992 -1.986 1.399
375 H ASP 45 H ASP 45 -2.945 -3.017 6.288
376 HA ASP 45 HA ASP 45 -5.517 -3.892 7.094
377 HB2 ASP 45 2HB ASP 45 -3.507 -4.039 8.534
378 HB3 ASP 45 1HB ASP 45 -3.419 -2.287 8.624
379 H GLY 46 H GLY 46 -7.386 -2.798 7.316
380 HA2 GLY 46 2HA GLY 46 -8.721 -0.880 7.875
381 HA3 GLY 46 1HA GLY 46 -7.456 0.167 7.247
382 H ILE 47 H ILE 47 -7.091 -1.628 4.875
383 HA ILE 47 HA ILE 47 -8.989 -0.379 3.106
384 HB ILE 47 HB ILE 47 -6.882 -2.527 2.576
385 HG12 ILE 47 2HG1 ILE 47 -5.865 -0.456 3.404
386 HG13 ILE 47 1HG1 ILE 47 -5.490 -0.655 1.700
387 HG21 ILE 47 1HG2 ILE 47 -7.049 -1.934 0.184
388 HG22 ILE 47 2HG2 ILE 47 -8.387 -0.842 0.541
389 HG23 ILE 47 3HG2 ILE 47 -8.575 -2.577 0.801
390 HD11 ILE 47 3HD1 ILE 47 -5.962 1.650 2.240
391 HD12 ILE 47 1HD1 ILE 47 -7.555 1.216 2.857
392 HD13 ILE 47 2HD1 ILE 47 -7.190 1.024 1.140
393 H ALA 48 H ALA 48 -10.576 -1.421 1.833
394 HA ALA 48 HA ALA 48 -12.292 -3.147 3.184
395 HB1 ALA 48 3HB ALA 48 -12.280 -2.536 0.207
396 HB2 ALA 48 1HB ALA 48 -13.028 -1.544 1.459
397 HB3 ALA 48 2HB ALA 48 -13.644 -3.164 1.138
398 H ALA 49 H ALA 49 -10.180 -3.905 0.362
399 HA ALA 49 HA ALA 49 -9.926 -6.648 1.344
400 HB1 ALA 49 3HB ALA 49 -11.919 -6.754 -0.091
401 HB2 ALA 49 1HB ALA 49 -10.586 -7.707 -0.746
402 HB3 ALA 49 2HB ALA 49 -10.978 -6.138 -1.449
403 H TRP 50 H TRP 50 -9.055 -4.607 -1.533
404 HA TRP 50 HA TRP 50 -6.214 -5.180 -1.032
405 HB2 TRP 50 2HB TRP 50 -7.605 -5.877 -3.646
406 HB3 TRP 50 1HB TRP 50 -5.861 -5.690 -3.520
407 HD1 TRP 50 HD1 TRP 50 -4.571 -7.554 -1.907
408 HE1 TRP 50 HE1 TRP 50 -5.166 -10.016 -1.472
409 HE3 TRP 50 HE3 TRP 50 -9.459 -7.494 -3.414
410 HZ2 TRP 50 HZ2 TRP 50 -7.409 -11.714 -1.709
411 HZ3 TRP 50 HZ3 TRP 50 -10.763 -9.574 -3.278
412 HH2 TRP 50 HH2 TRP 50 -9.762 -11.643 -2.443
413 H ILE 51 H ILE 51 -4.739 -3.765 -2.021
414 HA ILE 51 HA ILE 51 -5.781 -1.402 -3.487
415 HB ILE 51 HB ILE 51 -3.204 -1.756 -1.862
416 HG12 ILE 51 2HG1 ILE 51 -5.194 -1.252 -0.491
417 HG13 ILE 51 1HG1 ILE 51 -4.094 0.122 -0.486
418 HG21 ILE 51 1HG2 ILE 51 -2.609 -0.488 -3.859
419 HG22 ILE 51 2HG2 ILE 51 -2.615 0.584 -2.461
420 HG23 ILE 51 3HG2 ILE 51 -3.959 0.628 -3.605
421 HD11 ILE 51 3HD1 ILE 51 -5.522 1.245 -2.145
422 HD12 ILE 51 1HD1 ILE 51 -6.389 0.844 -0.664
423 HD13 ILE 51 2HD1 ILE 51 -6.623 -0.136 -2.108
424 H HIS 52 H HIS 52 -5.086 -1.131 -5.575
425 HA HIS 52 HA HIS 52 -3.775 -3.218 -7.005
426 HB2 HIS 52 2HB HIS 52 -5.443 -1.509 -7.938
427 HB3 HIS 52 1HB HIS 52 -4.146 -0.328 -7.895
428 HD1 HIS 52 HD1 HIS 52 -2.111 -0.776 -9.552
429 HD2 HIS 52 HD2 HIS 52 -5.492 -3.093 -10.155
430 HE1 HIS 52 HE1 HIS 52 -1.827 -1.802 -11.815
431 HE2 HIS 52 HE2 HIS 52 -3.983 -3.016 -12.234
432 H ALA 53 H ALA 53 -1.600 -3.490 -7.368
433 HA ALA 53 HA ALA 53 0.132 -2.443 -5.413
434 HB1 ALA 53 3HB ALA 53 1.822 -3.952 -6.318
435 HB2 ALA 53 1HB ALA 53 0.874 -4.184 -7.792
436 HB3 ALA 53 2HB ALA 53 0.261 -4.764 -6.244
437 H ALA 54 H ALA 54 -0.398 -1.327 -8.648
438 HA ALA 54 HA ALA 54 2.040 0.033 -9.120
439 HB1 ALA 54 3HB ALA 54 -0.719 0.692 -10.181
440 HB2 ALA 54 1HB ALA 54 0.406 -0.459 -10.889
441 HB3 ALA 54 2HB ALA 54 0.812 1.259 -10.858
442 H HIS 55 H HIS 55 -0.394 0.692 -6.848
443 HA HIS 55 HA HIS 55 0.264 3.558 -6.601
444 HB2 HIS 55 2HB HIS 55 -1.860 1.858 -5.203
445 HB3 HIS 55 1HB HIS 55 -1.616 3.582 -4.944
446 HD1 HIS 55 HD1 HIS 55 -2.016 5.123 -7.144
447 HD2 HIS 55 HD2 HIS 55 -3.589 1.281 -7.266
448 HE1 HIS 55 HE1 HIS 55 -3.646 5.123 -9.048
449 HE2 HIS 55 HE2 HIS 55 -4.572 2.796 -9.110
450 H VAL 56 H VAL 56 1.360 0.600 -5.398
451 HA VAL 56 HA VAL 56 1.751 1.506 -2.619
452 HB VAL 56 HB VAL 56 2.152 -1.255 -3.875
453 HG11 VAL 56 1HG1 VAL 56 2.232 -0.433 -0.952
454 HG12 VAL 56 2HG1 VAL 56 3.603 -0.984 -1.922
455 HG13 VAL 56 3HG1 VAL 56 2.279 -2.089 -1.552
456 HG21 VAL 56 3HG2 VAL 56 0.079 -1.892 -2.706
457 HG22 VAL 56 1HG2 VAL 56 -0.216 -0.582 -3.852
458 HG23 VAL 56 2HG2 VAL 56 -0.114 -0.236 -2.124
459 H LYS 57 H LYS 57 3.659 2.267 -1.986
460 HA LYS 57 HA LYS 57 6.158 1.673 -3.471
461 HB2 LYS 57 2HB LYS 57 5.395 4.192 -1.897
462 HB3 LYS 57 1HB LYS 57 6.961 3.901 -2.647
463 HG2 LYS 57 2HG LYS 57 5.806 3.820 -4.884
464 HG3 LYS 57 1HG LYS 57 4.309 4.274 -4.063
465 HD2 LYS 57 2HD LYS 57 5.404 6.246 -5.085
466 HD3 LYS 57 1HD LYS 57 5.321 6.396 -3.329
467 HE2 LYS 57 2HE LYS 57 7.677 5.747 -3.130
468 HE3 LYS 57 1HE LYS 57 7.773 5.479 -4.872
469 HZ1 LYS 57 3HZ LYS 57 7.086 8.112 -3.707
470 HZ2 LYS 57 1HZ LYS 57 7.552 7.768 -5.282
471 HZ3 LYS 57 2HZ LYS 57 8.677 7.648 -4.030
472 H ALA 58 H ALA 58 7.491 0.406 -2.262
473 HA ALA 58 HA ALA 58 7.193 -0.284 0.434
474 HB1 ALA 58 3HB ALA 58 9.443 -1.297 0.235
475 HB2 ALA 58 1HB ALA 58 9.712 -0.412 -1.272
476 HB3 ALA 58 2HB ALA 58 8.461 -1.650 -1.187
477 H ALA 59 H ALA 59 7.259 1.144 2.051
478 HA ALA 59 HA ALA 59 9.012 3.508 1.982
479 HB1 ALA 59 3HB ALA 59 7.587 4.323 3.831
480 HB2 ALA 59 1HB ALA 59 6.712 2.789 3.841
481 HB3 ALA 59 2HB ALA 59 6.619 3.848 2.434
482 H ASP 60 H ASP 60 10.590 3.862 3.464
483 HA ASP 60 HA ASP 60 11.271 1.806 5.460
484 HB2 ASP 60 2HB ASP 60 13.005 2.465 3.784
485 HB3 ASP 60 1HB ASP 60 12.967 4.116 4.404
486 HA PRO 61 HA PRO 61 9.650 5.016 8.326
487 HB2 PRO 61 2HB PRO 61 8.879 3.410 10.323
488 HB3 PRO 61 1HB PRO 61 8.023 3.360 8.766
489 HG2 PRO 61 2HG PRO 61 10.104 1.472 9.821
490 HG3 PRO 61 1HG PRO 61 8.575 1.109 8.988
491 HD2 PRO 61 2HD PRO 61 11.068 1.206 7.732
492 HD3 PRO 61 1HD PRO 61 9.506 1.404 6.896
493 H GLY 62 H GLY 62 12.533 3.515 8.246
494 HA2 GLY 62 2HA GLY 62 14.485 3.907 9.492
495 HA3 GLY 62 1HA GLY 62 13.510 4.391 10.880
496 H GLY 63 H GLY 63 13.041 1.523 8.863
497 HA2 GLY 63 2HA GLY 63 13.084 -0.729 9.322
498 HA3 GLY 63 1HA GLY 63 13.998 -0.396 10.788
499 H GLY 64 H GLY 64 12.797 0.459 12.648
500 HA2 GLY 64 2HA GLY 64 11.103 0.544 14.166
501 HA3 GLY 64 1HA GLY 64 9.963 0.513 12.836
502 HA PRO 65 HA PRO 65 10.182 -4.059 14.126
503 HB2 PRO 65 2HB PRO 65 12.474 -5.214 15.089
504 HB3 PRO 65 1HB PRO 65 12.243 -4.836 13.372
505 HG2 PRO 65 2HG PRO 65 14.047 -3.558 15.297
506 HG3 PRO 65 1HG PRO 65 14.053 -3.469 13.526
507 HD2 PRO 65 2HD PRO 65 12.933 -1.549 15.454
508 HD3 PRO 65 1HD PRO 65 13.197 -1.361 13.705
509 H SER 66 H SER 66 8.716 -4.037 15.790
510 HA SER 66 HA SER 66 9.599 -4.565 18.484
511 HB2 SER 66 2HB SER 66 8.259 -2.610 19.469
512 HB3 SER 66 1HB SER 66 9.758 -2.163 18.658
513 HG SER 66 HG SER 66 8.631 -1.351 16.974
514 H SER 67 H SER 67 6.537 -3.143 17.292
515 HA SER 67 HA SER 67 4.893 -5.074 18.618
516 HB2 SER 67 2HB SER 67 4.166 -2.747 18.354
517 HB3 SER 67 1HB SER 67 4.220 -2.886 16.600
518 HG SER 67 HG SER 67 2.564 -4.526 18.209
519 H ARG 68 H ARG 68 6.255 -4.846 15.440
520 HA ARG 68 HA ARG 68 4.448 -6.771 14.225
521 HB2 ARG 68 2HB ARG 68 6.909 -5.326 13.183
522 HB3 ARG 68 1HB ARG 68 5.992 -6.486 12.222
523 HG2 ARG 68 2HG ARG 68 3.985 -5.077 12.395
524 HG3 ARG 68 1HG ARG 68 4.862 -3.922 13.398
525 HD2 ARG 68 2HD ARG 68 5.705 -4.617 10.572
526 HD3 ARG 68 1HD ARG 68 4.580 -3.313 10.948
527 HE ARG 68 HE ARG 68 6.882 -2.896 12.484
528 HH11 ARG 68 1HH1 ARG 68 5.994 -2.941 9.061
529 HH12 ARG 68 2HH1 ARG 68 7.202 -1.779 8.611
530 HH21 ARG 68 1HH2 ARG 68 8.404 -1.301 11.880
531 HH22 ARG 68 2HH2 ARG 68 8.577 -0.847 10.217
532 H LEU 69 H LEU 69 7.059 -7.110 16.285
533 HA LEU 69 HA LEU 69 8.375 -9.355 14.978
534 HB2 LEU 69 2HB LEU 69 8.738 -8.156 17.757
535 HB3 LEU 69 1HB LEU 69 9.751 -9.416 17.073
536 HG LEU 69 HG LEU 69 9.521 -6.559 16.052
537 HD11 LEU 69 1HD1 LEU 69 11.857 -6.340 16.794
538 HD12 LEU 69 2HD1 LEU 69 11.806 -7.975 17.458
539 HD13 LEU 69 3HD1 LEU 69 10.776 -6.712 18.138
540 HD21 LEU 69 3HD2 LEU 69 9.883 -8.070 14.167
541 HD22 LEU 69 1HD2 LEU 69 11.242 -8.828 15.000
542 HD23 LEU 69 2HD2 LEU 69 11.345 -7.141 14.488
543 H THR 70 H THR 70 6.016 -10.272 14.957
544 HA THR 70 HA THR 70 5.780 -12.400 16.931
545 HB THR 70 HB THR 70 3.532 -10.355 16.527
546 HG1 THR 70 HG1 THR 70 5.377 -10.857 18.579
547 HG21 THR 70 3HG2 THR 70 3.482 -12.906 18.194
548 HG22 THR 70 1HG2 THR 70 2.586 -12.640 16.693
549 HG23 THR 70 2HG2 THR 70 2.210 -11.685 18.127
550 H TRP 71 H TRP 71 4.082 -10.668 14.337
551 HA TRP 71 HA TRP 71 3.074 -11.227 12.419
552 HB2 TRP 71 2HB TRP 71 5.258 -13.344 12.298
553 HB3 TRP 71 1HB TRP 71 4.301 -12.788 10.934
554 HD1 TRP 71 HD1 TRP 71 4.724 -10.060 10.229
555 HE1 TRP 71 HE1 TRP 71 6.946 -8.763 10.255
556 HE3 TRP 71 HE3 TRP 71 7.421 -13.056 13.411
557 HZ2 TRP 71 HZ2 TRP 71 9.495 -8.969 11.439
558 HZ3 TRP 71 HZ3 TRP 71 9.746 -12.430 13.934
559 HH2 TRP 71 HH2 TRP 71 10.759 -10.426 12.968
560 H ARG 72 H ARG 72 1.621 -12.106 14.385
561 HA ARG 72 HA ARG 72 1.070 -14.802 14.715
562 HB2 ARG 72 2HB ARG 72 -1.138 -14.042 15.631
563 HB3 ARG 72 1HB ARG 72 0.271 -13.248 16.317
564 HG2 ARG 72 2HG ARG 72 -0.138 -11.273 14.882
565 HG3 ARG 72 1HG ARG 72 -1.572 -12.056 14.221
566 HD2 ARG 72 2HD ARG 72 -2.652 -12.022 16.407
567 HD3 ARG 72 1HD ARG 72 -1.179 -11.398 17.163
568 HE ARG 72 HE ARG 72 -1.993 -9.638 15.110
569 HH11 ARG 72 1HH1 ARG 72 -3.015 -10.627 18.347
570 HH12 ARG 72 2HH1 ARG 72 -3.779 -9.104 18.687
571 HH21 ARG 72 1HH2 ARG 72 -2.983 -7.653 15.588
572 HH22 ARG 72 2HH2 ARG 72 -3.758 -7.425 17.123
573 H VAL 73 H VAL 73 -0.069 -12.669 12.164
574 HA VAL 73 HA VAL 73 -2.078 -14.475 11.130
575 HB VAL 73 HB VAL 73 -0.772 -12.081 9.758
576 HG11 VAL 73 1HG1 VAL 73 -1.988 -13.510 8.173
577 HG12 VAL 73 2HG1 VAL 73 -2.824 -11.971 8.385
578 HG13 VAL 73 3HG1 VAL 73 -3.437 -13.425 9.178
579 HG21 VAL 73 3HG2 VAL 73 -2.661 -10.726 10.590
580 HG22 VAL 73 1HG2 VAL 73 -1.724 -11.408 11.922
581 HG23 VAL 73 2HG2 VAL 73 -3.276 -12.122 11.480
582 H GLN 74 H GLN 74 1.350 -13.830 10.553
583 HA GLN 74 HA GLN 74 1.575 -15.611 8.260
584 HB2 GLN 74 2HB GLN 74 3.726 -14.216 9.900
585 HB3 GLN 74 1HB GLN 74 4.034 -15.134 8.433
586 HG2 GLN 74 2HG GLN 74 2.351 -12.618 8.593
587 HG3 GLN 74 1HG GLN 74 4.035 -12.677 8.086
588 HE21 GLN 74 1HE2 GLN 74 0.737 -13.332 7.162
589 HE22 GLN 74 2HE2 GLN 74 1.053 -13.641 5.494
590 H ARG 75 H ARG 75 1.389 -16.103 11.626
591 HA ARG 75 HA ARG 75 2.980 -18.497 11.839
592 HB2 ARG 75 2HB ARG 75 0.575 -17.613 13.495
593 HB3 ARG 75 1HB ARG 75 1.628 -18.954 13.908
594 HG2 ARG 75 2HG ARG 75 2.533 -16.069 13.749
595 HG3 ARG 75 1HG ARG 75 1.987 -16.857 15.225
596 HD2 ARG 75 2HD ARG 75 4.289 -17.012 15.406
597 HD3 ARG 75 1HD ARG 75 3.889 -18.585 14.718
598 HE ARG 75 HE ARG 75 4.432 -17.168 12.508
599 HH11 ARG 75 1HH1 ARG 75 6.230 -17.389 15.546
600 HH12 ARG 75 2HH1 ARG 75 7.760 -17.108 14.781
601 HH21 ARG 75 1HH2 ARG 75 6.480 -16.830 11.559
602 HH22 ARG 75 2HH2 ARG 75 7.895 -16.793 12.555
603 H SER 76 H SER 76 2.257 -19.367 9.719
604 HA SER 76 HA SER 76 -0.052 -21.167 9.958
605 HB2 SER 76 2HB SER 76 0.274 -19.290 7.566
606 HB3 SER 76 1HB SER 76 -1.002 -20.484 7.791
607 HG SER 76 HG SER 76 -1.348 -19.153 9.863
608 H GLN 77 H GLN 77 1.381 -20.579 6.794
609 HA GLN 77 HA GLN 77 3.021 -22.978 6.899
610 HB2 GLN 77 2HB GLN 77 1.727 -22.313 4.847
611 HB3 GLN 77 1HB GLN 77 2.723 -20.881 4.681
612 HG2 GLN 77 2HG GLN 77 3.970 -23.633 4.651
613 HG3 GLN 77 1HG GLN 77 3.222 -22.980 3.203
614 HE21 GLN 77 1HE2 GLN 77 6.033 -23.671 3.818
615 HE22 GLN 77 2HE2 GLN 77 6.947 -22.257 3.442
616 H ASN 78 H ASN 78 3.335 -19.524 7.157
617 HA ASN 78 HA ASN 78 4.923 -18.103 7.810
618 HB2 ASN 78 2HB ASN 78 5.530 -19.659 9.601
619 HB3 ASN 78 1HB ASN 78 6.578 -20.560 8.505
620 HD21 ASN 78 1HD2 ASN 78 8.565 -19.563 7.820
621 HD22 ASN 78 2HD2 ASN 78 9.264 -18.263 8.720
622 HA PRO 79 HA PRO 79 7.417 -18.127 3.945
623 HB2 PRO 79 2HB PRO 79 6.249 -15.747 2.968
624 HB3 PRO 79 1HB PRO 79 5.722 -17.390 2.566
625 HG2 PRO 79 2HG PRO 79 4.251 -15.446 4.049
626 HG3 PRO 79 1HG PRO 79 3.799 -17.137 3.749
627 HD2 PRO 79 2HD PRO 79 5.083 -15.921 6.166
628 HD3 PRO 79 1HD PRO 79 3.991 -17.323 6.033
629 H LEU 80 H LEU 80 7.575 -16.719 6.764
630 HA LEU 80 HA LEU 80 8.913 -14.225 6.338
631 HB2 LEU 80 2HB LEU 80 8.782 -16.010 8.792
632 HB3 LEU 80 1HB LEU 80 9.347 -14.344 8.785
633 HG LEU 80 HG LEU 80 6.505 -15.242 8.153
634 HD11 LEU 80 1HD1 LEU 80 5.903 -14.327 10.305
635 HD12 LEU 80 2HD1 LEU 80 7.575 -13.875 10.635
636 HD13 LEU 80 3HD1 LEU 80 7.123 -15.578 10.510
637 HD21 LEU 80 3HD2 LEU 80 7.634 -12.438 8.454
638 HD22 LEU 80 1HD2 LEU 80 5.930 -12.853 8.242
639 HD23 LEU 80 2HD2 LEU 80 7.083 -13.186 6.951
640 H LYS 81 H LYS 81 10.862 -14.226 5.360
641 HA LYS 81 HA LYS 81 12.805 -16.381 5.829
642 HB2 LYS 81 2HB LYS 81 12.878 -14.098 3.803
643 HB3 LYS 81 1HB LYS 81 14.008 -15.449 3.881
644 HG2 LYS 81 2HG LYS 81 12.132 -17.023 3.421
645 HG3 LYS 81 1HG LYS 81 11.038 -15.644 3.272
646 HD2 LYS 81 2HD LYS 81 12.415 -14.801 1.363
647 HD3 LYS 81 1HD LYS 81 13.440 -16.233 1.498
648 HE2 LYS 81 2HE LYS 81 11.456 -17.662 1.025
649 HE3 LYS 81 1HE LYS 81 10.477 -16.206 0.833
650 HZ1 LYS 81 3HZ LYS 81 11.225 -17.106 -1.292
651 HZ2 LYS 81 1HZ LYS 81 12.837 -16.915 -0.833
652 HZ3 LYS 81 2HZ LYS 81 11.852 -15.559 -1.043
653 H ILE 82 H ILE 82 14.921 -15.958 6.551
654 HA ILE 82 HA ILE 82 15.271 -13.923 8.488
655 HB ILE 82 HB ILE 82 17.689 -14.725 8.573
656 HG12 ILE 82 2HG1 ILE 82 16.742 -16.746 6.474
657 HG13 ILE 82 1HG1 ILE 82 17.928 -15.476 6.206
658 HG21 ILE 82 1HG2 ILE 82 15.965 -15.659 10.050
659 HG22 ILE 82 2HG2 ILE 82 17.124 -16.905 9.591
660 HG23 ILE 82 3HG2 ILE 82 15.535 -16.855 8.825
661 HD11 ILE 82 3HD1 ILE 82 19.015 -17.614 6.467
662 HD12 ILE 82 1HD1 ILE 82 18.252 -17.851 8.042
663 HD13 ILE 82 2HD1 ILE 82 19.434 -16.560 7.815
664 H ARG 83 H ARG 83 15.467 -11.862 8.013
665 HA ARG 83 HA ARG 83 16.715 -10.925 5.520
666 HB2 ARG 83 2HB ARG 83 15.121 -9.434 7.646
667 HB3 ARG 83 1HB ARG 83 15.709 -8.733 6.138
668 HG2 ARG 83 2HG ARG 83 14.289 -10.302 4.854
669 HG3 ARG 83 1HG ARG 83 13.687 -10.991 6.366
670 HD2 ARG 83 2HD ARG 83 12.097 -9.381 5.394
671 HD3 ARG 83 1HD ARG 83 12.681 -8.829 6.967
672 HE ARG 83 HE ARG 83 14.357 -7.664 5.110
673 HH11 ARG 83 1HH1 ARG 83 10.893 -7.580 5.714
674 HH12 ARG 83 2HH1 ARG 83 10.701 -5.978 5.090
675 HH21 ARG 83 1HH2 ARG 83 14.102 -5.562 4.313
676 HH22 ARG 83 2HH2 ARG 83 12.533 -4.822 4.288
677 H LEU 84 H LEU 84 18.501 -9.595 5.492
678 HA LEU 84 HA LEU 84 20.355 -9.807 7.659
679 HB2 LEU 84 2HB LEU 84 20.567 -8.169 5.101
680 HB3 LEU 84 1HB LEU 84 21.896 -8.566 6.180
681 HG LEU 84 HG LEU 84 20.320 -10.543 4.477
682 HD11 LEU 84 1HD1 LEU 84 21.842 -9.182 3.141
683 HD12 LEU 84 2HD1 LEU 84 22.407 -10.847 3.228
684 HD13 LEU 84 3HD1 LEU 84 23.191 -9.600 4.202
685 HD21 LEU 84 3HD2 LEU 84 20.966 -11.607 6.581
686 HD22 LEU 84 1HD2 LEU 84 22.644 -11.110 6.344
687 HD23 LEU 84 2HD2 LEU 84 21.897 -12.266 5.240
688 H THR 85 H THR 85 19.298 -8.811 9.347
689 HA THR 85 HA THR 85 18.698 -5.932 9.251
690 HB THR 85 HB THR 85 18.002 -7.965 11.426
691 HG1 THR 85 HG1 THR 85 16.905 -8.612 9.637
692 HG21 THR 85 3HG2 THR 85 16.803 -5.211 10.872
693 HG22 THR 85 1HG2 THR 85 17.913 -5.584 12.197
694 HG23 THR 85 2HG2 THR 85 16.313 -6.322 12.150
695 H ARG 86 H ARG 86 19.799 -4.475 10.484
696 HA ARG 86 HA ARG 86 22.321 -5.202 11.666
697 HB2 ARG 86 2HB ARG 86 20.853 -2.543 11.514
698 HB3 ARG 86 1HB ARG 86 22.453 -2.731 12.228
699 HG2 ARG 86 2HG ARG 86 23.352 -3.484 10.072
700 HG3 ARG 86 1HG ARG 86 21.750 -3.352 9.342
701 HD2 ARG 86 2HD ARG 86 21.744 -0.957 9.605
702 HD3 ARG 86 1HD ARG 86 23.204 -0.994 10.594
703 HE ARG 86 HE ARG 86 23.071 -1.537 7.685
704 HH11 ARG 86 1HH1 ARG 86 24.936 -0.595 10.516
705 HH12 ARG 86 2HH1 ARG 86 26.355 -0.186 9.602
706 HH21 ARG 86 1HH2 ARG 86 24.920 -1.000 6.483
707 HH22 ARG 86 2HH2 ARG 86 26.343 -0.419 7.295
708 H GLU 87 H GLU 87 21.828 -6.565 13.342
709 HA GLU 87 HA GLU 87 20.206 -5.690 15.615
710 HB2 GLU 87 2HB GLU 87 21.812 -8.248 15.178
711 HB3 GLU 87 1HB GLU 87 20.714 -7.944 16.523
712 HG2 GLU 87 2HG GLU 87 18.816 -7.827 14.953
713 HG3 GLU 87 1HG GLU 87 19.913 -8.095 13.603
714 H ALA 88 H ALA 88 21.353 -3.997 16.579
715 HA ALA 88 HA ALA 88 23.749 -4.773 18.110
716 HB1 ALA 88 3HB ALA 88 24.610 -3.572 16.121
717 HB2 ALA 88 1HB ALA 88 24.882 -2.644 17.598
718 HB3 ALA 88 2HB ALA 88 23.575 -2.194 16.500
719 HA PRO 89 HA PRO 89 20.473 -2.717 20.750
720 HB2 PRO 89 2HB PRO 89 21.198 -4.937 22.632
721 HB3 PRO 89 1HB PRO 89 19.597 -4.429 22.053
722 HG2 PRO 89 2HG PRO 89 20.678 -6.710 21.206
723 HG3 PRO 89 1HG PRO 89 19.756 -5.676 20.086
724 HD2 PRO 89 2HD PRO 89 22.762 -5.879 20.406
725 HD3 PRO 89 1HD PRO 89 21.781 -5.903 18.919
Start of MODEL 4
1 H1 HIS 1 1H HIS 1 -8.635 -19.678 3.031
2 H2 HIS 1 2H HIS 1 -9.530 -20.232 4.351
3 H3 HIS 1 3H HIS 1 -8.601 -21.312 3.448
4 HA HIS 1 HA HIS 1 -7.538 -19.060 5.039
5 HB2 HIS 1 2HB HIS 1 -7.470 -22.061 5.617
6 HB3 HIS 1 1HB HIS 1 -6.646 -20.838 6.575
7 HD1 HIS 1 HD1 HIS 1 -9.805 -22.652 6.310
8 HD2 HIS 1 HD2 HIS 1 -8.532 -19.051 7.955
9 HE1 HIS 1 HE1 HIS 1 -11.603 -21.969 7.919
10 HE2 HIS 1 HE2 HIS 1 -10.720 -19.896 9.030
11 H HIS 2 H HIS 2 -6.915 -22.014 3.171
12 HA HIS 2 HA HIS 2 -4.106 -21.474 2.752
13 HB2 HIS 2 2HB HIS 2 -4.945 -23.797 2.918
14 HB3 HIS 2 1HB HIS 2 -5.997 -23.540 1.533
15 HD1 HIS 2 HD1 HIS 2 -5.036 -23.937 -0.747
16 HD2 HIS 2 HD2 HIS 2 -2.133 -23.968 2.234
17 HE1 HIS 2 HE1 HIS 2 -2.945 -24.783 -1.841
18 HE2 HIS 2 HE2 HIS 2 -1.300 -25.030 0.039
19 H HIS 3 H HIS 3 -4.138 -19.403 1.760
20 HA HIS 3 HA HIS 3 -5.339 -18.928 -0.839
21 HB2 HIS 3 2HB HIS 3 -3.181 -17.377 0.678
22 HB3 HIS 3 1HB HIS 3 -3.903 -16.846 -0.833
23 HD1 HIS 3 HD1 HIS 3 -6.207 -15.731 -0.730
24 HD2 HIS 3 HD2 HIS 3 -4.900 -17.147 2.954
25 HE1 HIS 3 HE1 HIS 3 -7.770 -14.746 0.971
26 HE2 HIS 3 HE2 HIS 3 -6.829 -15.460 3.195
27 H HIS 4 H HIS 4 -2.324 -20.112 0.430
28 HA HIS 4 HA HIS 4 -0.578 -21.225 -0.380
29 HB2 HIS 4 2HB HIS 4 -1.971 -22.427 -1.980
30 HB3 HIS 4 1HB HIS 4 -1.912 -21.081 -3.109
31 HD1 HIS 4 HD1 HIS 4 0.883 -22.967 -1.300
32 HD2 HIS 4 HD2 HIS 4 -0.269 -21.884 -5.150
33 HE1 HIS 4 HE1 HIS 4 2.750 -23.709 -2.800
34 HE2 HIS 4 HE2 HIS 4 1.976 -23.160 -5.125
35 H HIS 5 H HIS 5 -1.440 -18.218 -1.987
36 HA HIS 5 HA HIS 5 1.103 -17.598 -3.056
37 HB2 HIS 5 2HB HIS 5 -0.972 -16.416 -3.771
38 HB3 HIS 5 1HB HIS 5 -1.102 -15.678 -2.175
39 HD1 HIS 5 HD1 HIS 5 0.139 -13.509 -1.844
40 HD2 HIS 5 HD2 HIS 5 1.397 -15.547 -5.236
41 HE1 HIS 5 HE1 HIS 5 1.741 -11.968 -3.009
42 HE2 HIS 5 HE2 HIS 5 2.660 -13.325 -4.905
43 H HIS 6 H HIS 6 2.868 -17.420 -1.915
44 HA HIS 6 HA HIS 6 3.145 -16.917 0.854
45 HB2 HIS 6 2HB HIS 6 5.169 -16.761 -1.418
46 HB3 HIS 6 1HB HIS 6 5.599 -16.651 0.285
47 HD1 HIS 6 HD1 HIS 6 6.249 -18.791 1.327
48 HD2 HIS 6 HD2 HIS 6 3.820 -19.416 -1.983
49 HE1 HIS 6 HE1 HIS 6 6.098 -21.278 1.062
50 HE2 HIS 6 HE2 HIS 6 4.508 -21.629 -0.849
51 H SER 7 H SER 7 3.337 -15.027 1.953
52 HA SER 7 HA SER 7 2.654 -12.592 0.457
53 HB2 SER 7 2HB SER 7 1.105 -13.393 2.236
54 HB3 SER 7 1HB SER 7 2.386 -13.197 3.432
55 HG SER 7 HG SER 7 1.941 -11.146 3.503
56 H HIS 8 H HIS 8 3.459 -10.503 1.254
57 HA HIS 8 HA HIS 8 6.241 -10.363 2.044
58 HB2 HIS 8 2HB HIS 8 4.075 -8.231 1.738
59 HB3 HIS 8 1HB HIS 8 5.704 -7.852 2.289
60 HD1 HIS 8 HD1 HIS 8 6.419 -6.460 0.332
61 HD2 HIS 8 HD2 HIS 8 4.972 -10.171 -0.844
62 HE1 HIS 8 HE1 HIS 8 6.903 -6.623 -2.119
63 HE2 HIS 8 HE2 HIS 8 6.023 -8.874 -2.812
64 H MET 9 H MET 9 6.910 -9.232 4.030
65 HA MET 9 HA MET 9 6.071 -10.475 6.350
66 HB2 MET 9 2HB MET 9 7.450 -8.795 7.569
67 HB3 MET 9 1HB MET 9 8.286 -9.463 6.178
68 HG2 MET 9 2HG MET 9 7.938 -7.424 4.917
69 HG3 MET 9 1HG MET 9 6.907 -6.764 6.188
70 HE1 MET 9 3HE MET 9 7.807 -5.910 8.560
71 HE2 MET 9 1HE MET 9 9.481 -6.098 9.081
72 HE3 MET 9 2HE MET 9 8.457 -7.520 8.883
73 H VAL 10 H VAL 10 4.568 -10.065 7.935
74 HA VAL 10 HA VAL 10 2.403 -8.308 7.384
75 HB VAL 10 HB VAL 10 1.370 -9.079 9.436
76 HG11 VAL 10 1HG1 VAL 10 2.857 -11.373 8.099
77 HG12 VAL 10 2HG1 VAL 10 1.332 -10.661 7.570
78 HG13 VAL 10 3HG1 VAL 10 1.409 -11.535 9.099
79 HG21 VAL 10 3HG2 VAL 10 2.466 -10.512 11.114
80 HG22 VAL 10 1HG2 VAL 10 3.270 -8.945 11.010
81 HG23 VAL 10 2HG2 VAL 10 4.006 -10.362 10.263
82 H GLY 11 H GLY 11 2.279 -6.189 7.767
83 HA2 GLY 11 2HA GLY 11 2.640 -4.182 8.989
84 HA3 GLY 11 1HA GLY 11 4.039 -4.902 9.766
85 H ASP 12 H ASP 12 3.947 -5.515 6.344
86 HA ASP 12 HA ASP 12 6.388 -4.169 5.789
87 HB2 ASP 12 2HB ASP 12 5.451 -6.032 4.392
88 HB3 ASP 12 1HB ASP 12 4.197 -4.950 3.807
89 H THR 13 H THR 13 6.613 -1.947 6.020
90 HA THR 13 HA THR 13 4.293 -0.257 5.981
91 HB THR 13 HB THR 13 7.199 0.601 6.246
92 HG1 THR 13 HG1 THR 13 5.672 -0.854 7.869
93 HG21 THR 13 3HG2 THR 13 4.604 2.014 7.035
94 HG22 THR 13 1HG2 THR 13 5.674 2.494 5.710
95 HG23 THR 13 2HG2 THR 13 6.230 2.601 7.378
96 H VAL 14 H VAL 14 3.445 0.415 4.239
97 HA VAL 14 HA VAL 14 5.005 1.363 1.921
98 HB VAL 14 HB VAL 14 3.164 0.615 0.443
99 HG11 VAL 14 1HG1 VAL 14 4.232 -1.665 2.147
100 HG12 VAL 14 2HG1 VAL 14 5.045 -0.924 0.768
101 HG13 VAL 14 3HG1 VAL 14 3.547 -1.823 0.525
102 HG21 VAL 14 3HG2 VAL 14 1.278 0.757 2.022
103 HG22 VAL 14 1HG2 VAL 14 1.907 -0.619 2.933
104 HG23 VAL 14 2HG2 VAL 14 1.330 -0.840 1.277
105 H TRP 15 H TRP 15 3.392 2.675 0.548
106 HA TRP 15 HA TRP 15 1.709 4.482 2.154
107 HB2 TRP 15 2HB TRP 15 3.658 5.154 -0.117
108 HB3 TRP 15 1HB TRP 15 2.436 6.279 0.470
109 HD1 TRP 15 HD1 TRP 15 3.052 5.414 3.652
110 HE1 TRP 15 HE1 TRP 15 5.058 6.545 4.772
111 HE3 TRP 15 HE3 TRP 15 5.663 6.826 -0.518
112 HZ2 TRP 15 HZ2 TRP 15 7.414 7.876 4.033
113 HZ3 TRP 15 HZ3 TRP 15 7.797 8.026 -0.220
114 HH2 TRP 15 HH2 TRP 15 8.657 8.541 2.012
115 H VAL 16 H VAL 16 -0.205 5.162 1.039
116 HA VAL 16 HA VAL 16 -0.896 3.535 -1.333
117 HB VAL 16 HB VAL 16 -2.785 4.889 0.666
118 HG11 VAL 16 1HG1 VAL 16 -4.633 3.854 -0.628
119 HG12 VAL 16 2HG1 VAL 16 -3.475 3.259 -1.819
120 HG13 VAL 16 3HG1 VAL 16 -3.728 4.995 -1.627
121 HG21 VAL 16 3HG2 VAL 16 -2.282 1.941 0.072
122 HG22 VAL 16 1HG2 VAL 16 -3.464 2.576 1.223
123 HG23 VAL 16 2HG2 VAL 16 -1.738 2.809 1.510
124 H ARG 17 H ARG 17 -0.414 4.552 -3.007
125 HA ARG 17 HA ARG 17 -0.078 7.397 -3.256
126 HB2 ARG 17 2HB ARG 17 1.531 5.649 -4.087
127 HB3 ARG 17 1HB ARG 17 0.314 5.096 -5.231
128 HG2 ARG 17 2HG ARG 17 0.391 7.311 -6.332
129 HG3 ARG 17 1HG ARG 17 1.660 7.808 -5.213
130 HD2 ARG 17 2HD ARG 17 3.110 5.993 -6.070
131 HD3 ARG 17 1HD ARG 17 1.834 5.509 -7.197
132 HE ARG 17 HE ARG 17 3.022 8.216 -7.282
133 HH11 ARG 17 1HH1 ARG 17 2.262 5.200 -8.917
134 HH12 ARG 17 2HH1 ARG 17 2.740 5.778 -10.480
135 HH21 ARG 17 1HH2 ARG 17 3.710 8.953 -9.321
136 HH22 ARG 17 2HH2 ARG 17 3.569 7.919 -10.710
137 H ARG 18 H ARG 18 -2.109 8.354 -3.292
138 HA ARG 18 HA ARG 18 -4.347 7.169 -4.718
139 HB2 ARG 18 2HB ARG 18 -4.621 8.137 -2.445
140 HB3 ARG 18 1HB ARG 18 -4.181 9.729 -3.062
141 HG2 ARG 18 2HG ARG 18 -6.179 9.707 -4.524
142 HG3 ARG 18 1HG ARG 18 -6.619 8.117 -3.895
143 HD2 ARG 18 2HD ARG 18 -6.852 9.111 -1.620
144 HD3 ARG 18 1HD ARG 18 -6.464 10.701 -2.298
145 HE ARG 18 HE ARG 18 -8.604 9.591 -3.741
146 HH11 ARG 18 1HH1 ARG 18 -8.029 10.922 -0.523
147 HH12 ARG 18 2HH1 ARG 18 -9.674 11.437 -0.324
148 HH21 ARG 18 1HH2 ARG 18 -10.737 10.311 -3.464
149 HH22 ARG 18 2HH2 ARG 18 -11.200 11.092 -1.985
150 H HIS 19 H HIS 19 -4.998 7.720 -6.715
151 HA HIS 19 HA HIS 19 -4.032 10.226 -7.995
152 HB2 HIS 19 2HB HIS 19 -2.980 8.191 -8.953
153 HB3 HIS 19 1HB HIS 19 -4.568 7.512 -9.292
154 HD1 HIS 19 HD1 HIS 19 -5.469 7.987 -11.569
155 HD2 HIS 19 HD2 HIS 19 -2.476 10.669 -10.510
156 HE1 HIS 19 HE1 HIS 19 -5.033 9.356 -13.619
157 HE2 HIS 19 HE2 HIS 19 -3.090 10.838 -13.003
158 H GLN 20 H GLN 20 -5.724 11.590 -8.065
159 HA GLN 20 HA GLN 20 -8.468 10.601 -8.303
160 HB2 GLN 20 2HB GLN 20 -7.371 13.389 -7.744
161 HB3 GLN 20 1HB GLN 20 -9.087 13.010 -7.858
162 HG2 GLN 20 2HG GLN 20 -7.148 11.885 -5.812
163 HG3 GLN 20 1HG GLN 20 -8.361 13.130 -5.518
164 HE21 GLN 20 1HE2 GLN 20 -10.565 12.519 -5.437
165 HE22 GLN 20 2HE2 GLN 20 -11.056 10.873 -5.261
166 H THR 21 H THR 21 -6.468 13.100 -9.944
167 HA THR 21 HA THR 21 -8.059 12.665 -12.416
168 HB THR 21 HB THR 21 -7.540 15.056 -13.001
169 HG1 THR 21 HG1 THR 21 -5.985 15.875 -11.814
170 HG21 THR 21 3HG2 THR 21 -9.067 14.701 -10.392
171 HG22 THR 21 1HG2 THR 21 -9.734 14.471 -12.012
172 HG23 THR 21 2HG2 THR 21 -9.203 16.073 -11.493
173 H LYS 22 H LYS 22 -6.987 12.762 -14.399
174 HA LYS 22 HA LYS 22 -4.558 11.281 -14.410
175 HB2 LYS 22 2HB LYS 22 -6.110 12.505 -16.726
176 HB3 LYS 22 1HB LYS 22 -4.854 11.273 -16.872
177 HG2 LYS 22 2HG LYS 22 -6.235 9.665 -15.645
178 HG3 LYS 22 1HG LYS 22 -7.484 10.894 -15.393
179 HD2 LYS 22 2HD LYS 22 -7.830 11.042 -17.841
180 HD3 LYS 22 1HD LYS 22 -6.571 9.833 -18.098
181 HE2 LYS 22 2HE LYS 22 -7.937 8.169 -16.897
182 HE3 LYS 22 1HE LYS 22 -9.194 9.384 -16.642
183 HZ1 LYS 22 3HZ LYS 22 -9.677 7.944 -18.537
184 HZ2 LYS 22 1HZ LYS 22 -8.245 8.427 -19.295
185 HZ3 LYS 22 2HZ LYS 22 -9.482 9.547 -19.027
186 H ASN 23 H ASN 23 -5.353 14.640 -15.138
187 HA ASN 23 HA ASN 23 -2.929 15.391 -16.395
188 HB2 ASN 23 2HB ASN 23 -3.630 17.713 -16.043
189 HB3 ASN 23 1HB ASN 23 -4.999 16.749 -16.575
190 HD21 ASN 23 1HD2 ASN 23 -4.842 19.310 -15.058
191 HD22 ASN 23 2HD2 ASN 23 -5.778 19.047 -13.628
192 H LEU 24 H LEU 24 -3.810 15.031 -13.047
193 HA LEU 24 HA LEU 24 -1.342 16.327 -12.083
194 HB2 LEU 24 2HB LEU 24 -3.849 15.410 -10.625
195 HB3 LEU 24 1HB LEU 24 -2.439 16.084 -9.815
196 HG LEU 24 HG LEU 24 -4.220 17.544 -11.814
197 HD11 LEU 24 1HD1 LEU 24 -5.300 17.261 -9.644
198 HD12 LEU 24 2HD1 LEU 24 -4.881 18.948 -9.920
199 HD13 LEU 24 3HD1 LEU 24 -3.901 17.965 -8.828
200 HD21 LEU 24 3HD2 LEU 24 -1.924 18.298 -12.073
201 HD22 LEU 24 1HD2 LEU 24 -1.771 18.553 -10.331
202 HD23 LEU 24 2HD2 LEU 24 -2.876 19.551 -11.282
203 H GLU 25 H GLU 25 -0.011 15.291 -10.576
204 HA GLU 25 HA GLU 25 0.530 12.517 -11.126
205 HB2 GLU 25 2HB GLU 25 1.893 14.450 -9.191
206 HB3 GLU 25 1HB GLU 25 2.514 12.868 -9.669
207 HG2 GLU 25 2HG GLU 25 2.722 13.653 -12.009
208 HG3 GLU 25 1HG GLU 25 2.095 15.230 -11.533
209 HA PRO 26 HA PRO 26 -1.733 10.825 -7.625
210 HB2 PRO 26 2HB PRO 26 0.291 8.645 -7.428
211 HB3 PRO 26 1HB PRO 26 -1.423 8.541 -7.871
212 HG2 PRO 26 2HG PRO 26 0.521 8.160 -9.683
213 HG3 PRO 26 1HG PRO 26 -1.016 8.942 -10.113
214 HD2 PRO 26 2HD PRO 26 1.652 10.226 -9.535
215 HD3 PRO 26 1HD PRO 26 0.484 10.582 -10.833
216 H ARG 27 H ARG 27 -1.677 11.371 -5.502
217 HA ARG 27 HA ARG 27 0.867 12.145 -4.240
218 HB2 ARG 27 2HB ARG 27 -0.963 13.813 -4.330
219 HB3 ARG 27 1HB ARG 27 -2.020 12.722 -3.439
220 HG2 ARG 27 2HG ARG 27 -0.522 12.875 -1.471
221 HG3 ARG 27 1HG ARG 27 0.551 13.946 -2.376
222 HD2 ARG 27 2HD ARG 27 -2.331 14.540 -1.622
223 HD3 ARG 27 1HD ARG 27 -0.896 15.208 -0.840
224 HE ARG 27 HE ARG 27 -1.274 15.706 -3.717
225 HH11 ARG 27 1HH1 ARG 27 -1.377 17.035 -0.433
226 HH12 ARG 27 2HH1 ARG 27 -1.396 18.683 -0.979
227 HH21 ARG 27 1HH2 ARG 27 -1.289 17.868 -4.401
228 HH22 ARG 27 2HH2 ARG 27 -1.347 19.154 -3.236
229 H TRP 28 H TRP 28 1.808 10.661 -2.976
230 HA TRP 28 HA TRP 28 0.546 8.325 -1.956
231 HB2 TRP 28 2HB TRP 28 2.712 7.919 -0.764
232 HB3 TRP 28 1HB TRP 28 2.928 8.270 -2.471
233 HD1 TRP 28 HD1 TRP 28 4.185 10.562 -3.110
234 HE1 TRP 28 HE1 TRP 28 5.699 12.132 -1.767
235 HE3 TRP 28 HE3 TRP 28 3.100 8.938 1.632
236 HZ2 TRP 28 HZ2 TRP 28 6.372 12.623 0.894
237 HZ3 TRP 28 HZ3 TRP 28 4.249 10.020 3.522
238 HH2 TRP 28 HH2 TRP 28 5.853 11.824 3.162
239 H LYS 29 H LYS 29 -0.190 7.805 0.048
240 HA LYS 29 HA LYS 29 -0.122 9.824 2.230
241 HB2 LYS 29 2HB LYS 29 -2.294 7.762 1.623
242 HB3 LYS 29 1HB LYS 29 -2.243 8.765 3.071
243 HG2 LYS 29 2HG LYS 29 -2.400 10.792 1.606
244 HG3 LYS 29 1HG LYS 29 -2.603 9.727 0.216
245 HD2 LYS 29 2HD LYS 29 -4.461 9.668 2.624
246 HD3 LYS 29 1HD LYS 29 -4.740 10.718 1.238
247 HE2 LYS 29 2HE LYS 29 -6.101 8.733 1.012
248 HE3 LYS 29 1HE LYS 29 -4.849 8.697 -0.223
249 HZ1 LYS 29 3HZ LYS 29 -5.254 6.539 0.854
250 HZ2 LYS 29 1HZ LYS 29 -4.743 7.178 2.336
251 HZ3 LYS 29 2HZ LYS 29 -3.657 7.055 1.044
252 H GLY 30 H GLY 30 0.362 9.008 4.319
253 HA2 GLY 30 2HA GLY 30 0.772 6.168 4.761
254 HA3 GLY 30 1HA GLY 30 2.250 7.091 4.637
255 HA PRO 31 HA PRO 31 2.661 5.345 6.099
256 HB2 PRO 31 2HB PRO 31 3.297 4.134 8.421
257 HB3 PRO 31 1HB PRO 31 4.024 5.695 7.980
258 HG2 PRO 31 2HG PRO 31 1.840 5.132 9.946
259 HG3 PRO 31 1HG PRO 31 3.148 6.330 10.020
260 HD2 PRO 31 2HD PRO 31 0.478 6.830 9.200
261 HD3 PRO 31 1HD PRO 31 1.865 7.922 8.989
262 H TYR 32 H TYR 32 1.657 3.660 5.149
263 HA TYR 32 HA TYR 32 -0.479 2.118 6.529
264 HB2 TYR 32 2HB TYR 32 0.319 2.337 3.593
265 HB3 TYR 32 1HB TYR 32 -0.823 1.137 4.181
266 HD1 TYR 32 HD2 TYR 32 -0.281 4.787 3.719
267 HD2 TYR 32 HD1 TYR 32 -3.110 1.732 4.684
268 HE1 TYR 32 HE2 TYR 32 -2.108 6.406 3.491
269 HE2 TYR 32 HE1 TYR 32 -4.940 3.358 4.453
270 HH TYR 32 HH TYR 32 -5.259 5.805 4.564
271 H THR 33 H THR 33 -0.363 -0.307 6.180
272 HA THR 33 HA THR 33 2.353 -1.400 5.899
273 HB THR 33 HB THR 33 2.034 -2.699 8.098
274 HG1 THR 33 HG1 THR 33 0.056 -0.693 8.522
275 HG21 THR 33 3HG2 THR 33 2.869 -0.890 9.552
276 HG22 THR 33 1HG2 THR 33 2.356 0.311 8.363
277 HG23 THR 33 2HG2 THR 33 3.644 -0.825 7.971
278 H VAL 34 H VAL 34 2.097 -2.985 4.437
279 HA VAL 34 HA VAL 34 -0.285 -4.432 3.910
280 HB VAL 34 HB VAL 34 2.543 -5.285 3.122
281 HG11 VAL 34 1HG1 VAL 34 0.864 -7.034 2.757
282 HG12 VAL 34 2HG1 VAL 34 1.440 -6.401 1.214
283 HG13 VAL 34 3HG1 VAL 34 -0.139 -5.911 1.832
284 HG21 VAL 34 3HG2 VAL 34 0.699 -3.432 1.576
285 HG22 VAL 34 1HG2 VAL 34 2.260 -4.044 1.028
286 HG23 VAL 34 2HG2 VAL 34 2.176 -2.955 2.414
287 H LEU 35 H LEU 35 -1.021 -6.319 4.692
288 HA LEU 35 HA LEU 35 0.494 -7.759 6.799
289 HB2 LEU 35 2HB LEU 35 -2.507 -7.660 6.288
290 HB3 LEU 35 1HB LEU 35 -1.716 -8.445 7.651
291 HG LEU 35 HG LEU 35 -1.640 -5.442 7.128
292 HD11 LEU 35 1HD1 LEU 35 -3.394 -6.948 9.085
293 HD12 LEU 35 2HD1 LEU 35 -3.926 -6.130 7.615
294 HD13 LEU 35 3HD1 LEU 35 -3.254 -5.192 8.945
295 HD21 LEU 35 3HD2 LEU 35 0.289 -6.209 8.411
296 HD22 LEU 35 1HD2 LEU 35 -0.767 -7.025 9.570
297 HD23 LEU 35 2HD2 LEU 35 -0.791 -5.265 9.430
298 H LEU 36 H LEU 36 -1.590 -8.153 3.933
299 HA LEU 36 HA LEU 36 -0.393 -10.813 3.380
300 HB2 LEU 36 2HB LEU 36 -2.632 -11.214 4.392
301 HB3 LEU 36 1HB LEU 36 -3.371 -10.152 3.209
302 HG LEU 36 HG LEU 36 -2.665 -11.799 1.399
303 HD11 LEU 36 1HD1 LEU 36 -1.951 -13.598 3.726
304 HD12 LEU 36 2HD1 LEU 36 -0.833 -12.915 2.543
305 HD13 LEU 36 3HD1 LEU 36 -2.047 -14.083 2.030
306 HD21 LEU 36 3HD2 LEU 36 -4.962 -11.778 2.242
307 HD22 LEU 36 1HD2 LEU 36 -4.522 -12.901 3.533
308 HD23 LEU 36 2HD2 LEU 36 -4.458 -13.420 1.845
309 H THR 37 H THR 37 -0.283 -11.272 1.076
310 HA THR 37 HA THR 37 -0.824 -8.946 -0.701
311 HB THR 37 HB THR 37 1.211 -9.589 -2.020
312 HG1 THR 37 HG1 THR 37 1.406 -11.492 0.046
313 HG21 THR 37 3HG2 THR 37 1.373 -7.807 -0.299
314 HG22 THR 37 1HG2 THR 37 2.887 -8.696 -0.476
315 HG23 THR 37 2HG2 THR 37 1.829 -9.024 0.896
316 H THR 38 H THR 38 -1.433 -9.383 -2.802
317 HA THR 38 HA THR 38 -1.774 -12.166 -3.745
318 HB THR 38 HB THR 38 -3.829 -9.888 -3.950
319 HG1 THR 38 HG1 THR 38 -3.458 -11.855 -2.100
320 HG21 THR 38 3HG2 THR 38 -5.376 -11.543 -4.935
321 HG22 THR 38 1HG2 THR 38 -4.086 -12.751 -4.946
322 HG23 THR 38 2HG2 THR 38 -3.959 -11.311 -5.959
323 HA PRO 39 HA PRO 39 0.579 -10.737 -7.429
324 HB2 PRO 39 2HB PRO 39 -1.876 -11.794 -8.884
325 HB3 PRO 39 1HB PRO 39 -0.158 -11.959 -9.324
326 HG2 PRO 39 2HG PRO 39 -1.371 -13.976 -8.124
327 HG3 PRO 39 1HG PRO 39 0.275 -13.520 -7.632
328 HD2 PRO 39 2HD PRO 39 -2.299 -13.084 -6.177
329 HD3 PRO 39 1HD PRO 39 -0.661 -13.307 -5.530
330 H THR 40 H THR 40 0.649 -8.570 -7.431
331 HA THR 40 HA THR 40 0.459 -6.481 -8.198
332 HB THR 40 HB THR 40 -1.782 -7.286 -10.097
333 HG1 THR 40 HG1 THR 40 -0.451 -8.589 -11.120
334 HG21 THR 40 3HG2 THR 40 -1.072 -4.894 -10.137
335 HG22 THR 40 1HG2 THR 40 -0.642 -5.718 -11.650
336 HG23 THR 40 2HG2 THR 40 0.590 -5.394 -10.435
337 H ALA 41 H ALA 41 -1.491 -7.634 -6.072
338 HA ALA 41 HA ALA 41 -2.721 -5.067 -5.491
339 HB1 ALA 41 3HB ALA 41 -4.495 -6.133 -6.853
340 HB2 ALA 41 1HB ALA 41 -5.008 -5.936 -5.175
341 HB3 ALA 41 2HB ALA 41 -4.507 -7.522 -5.765
342 H LEU 42 H LEU 42 -2.416 -4.715 -3.351
343 HA LEU 42 HA LEU 42 -1.535 -6.988 -1.678
344 HB2 LEU 42 2HB LEU 42 -0.928 -4.029 -1.276
345 HB3 LEU 42 1HB LEU 42 -0.172 -5.391 -0.461
346 HG LEU 42 HG LEU 42 0.196 -4.533 -3.358
347 HD11 LEU 42 1HD1 LEU 42 1.484 -3.240 -1.762
348 HD12 LEU 42 2HD1 LEU 42 2.549 -4.254 -2.731
349 HD13 LEU 42 3HD1 LEU 42 2.169 -4.713 -1.066
350 HD21 LEU 42 3HD2 LEU 42 1.279 -7.044 -2.051
351 HD22 LEU 42 1HD2 LEU 42 1.760 -6.420 -3.631
352 HD23 LEU 42 2HD2 LEU 42 0.107 -6.959 -3.367
353 H LYS 43 H LYS 43 -2.635 -7.466 0.161
354 HA LYS 43 HA LYS 43 -4.919 -5.860 1.012
355 HB2 LYS 43 2HB LYS 43 -5.092 -8.340 1.015
356 HB3 LYS 43 1HB LYS 43 -3.738 -8.448 2.135
357 HG2 LYS 43 2HG LYS 43 -5.123 -7.165 3.817
358 HG3 LYS 43 1HG LYS 43 -6.488 -7.282 2.698
359 HD2 LYS 43 2HD LYS 43 -6.276 -9.793 2.809
360 HD3 LYS 43 1HD LYS 43 -5.018 -9.590 4.031
361 HE2 LYS 43 2HE LYS 43 -7.139 -10.081 5.117
362 HE3 LYS 43 1HE LYS 43 -6.664 -8.422 5.488
363 HZ1 LYS 43 3HZ LYS 43 -9.033 -8.657 4.912
364 HZ2 LYS 43 1HZ LYS 43 -8.604 -9.179 3.363
365 HZ3 LYS 43 2HZ LYS 43 -8.214 -7.611 3.866
366 H VAL 44 H VAL 44 -4.467 -4.130 2.144
367 HA VAL 44 HA VAL 44 -2.094 -3.950 3.911
368 HB VAL 44 HB VAL 44 -3.623 -1.699 2.508
369 HG11 VAL 44 1HG1 VAL 44 -1.702 -0.265 3.073
370 HG12 VAL 44 2HG1 VAL 44 -0.953 -1.606 3.941
371 HG13 VAL 44 3HG1 VAL 44 -2.471 -0.918 4.522
372 HG21 VAL 44 3HG2 VAL 44 -2.536 -3.105 0.816
373 HG22 VAL 44 1HG2 VAL 44 -0.995 -2.963 1.663
374 HG23 VAL 44 2HG2 VAL 44 -1.728 -1.539 0.924
375 H ASP 45 H ASP 45 -2.354 -2.823 5.905
376 HA ASP 45 HA ASP 45 -4.686 -3.187 7.420
377 HB2 ASP 45 2HB ASP 45 -2.491 -3.005 8.468
378 HB3 ASP 45 1HB ASP 45 -2.263 -1.385 7.822
379 H GLY 46 H GLY 46 -6.502 -2.008 7.632
380 HA2 GLY 46 2HA GLY 46 -7.857 -0.115 7.838
381 HA3 GLY 46 1HA GLY 46 -6.589 0.874 7.137
382 H ILE 47 H ILE 47 -6.742 -1.600 5.044
383 HA ILE 47 HA ILE 47 -8.435 -0.137 3.145
384 HB ILE 47 HB ILE 47 -6.405 -2.391 2.816
385 HG12 ILE 47 2HG1 ILE 47 -5.353 -0.255 3.312
386 HG13 ILE 47 1HG1 ILE 47 -5.061 -0.634 1.621
387 HG21 ILE 47 1HG2 ILE 47 -8.106 -2.725 1.088
388 HG22 ILE 47 2HG2 ILE 47 -6.596 -2.166 0.370
389 HG23 ILE 47 3HG2 ILE 47 -7.944 -1.045 0.571
390 HD11 ILE 47 3HD1 ILE 47 -6.833 0.967 0.992
391 HD12 ILE 47 1HD1 ILE 47 -5.520 1.709 1.906
392 HD13 ILE 47 2HD1 ILE 47 -7.053 1.357 2.699
393 H ALA 48 H ALA 48 -10.046 -1.188 1.870
394 HA ALA 48 HA ALA 48 -11.898 -2.709 3.351
395 HB1 ALA 48 3HB ALA 48 -12.561 -1.109 1.593
396 HB2 ALA 48 1HB ALA 48 -13.269 -2.699 1.304
397 HB3 ALA 48 2HB ALA 48 -11.876 -2.167 0.358
398 H ALA 49 H ALA 49 -9.902 -3.657 0.503
399 HA ALA 49 HA ALA 49 -9.647 -6.360 1.593
400 HB1 ALA 49 3HB ALA 49 -10.408 -7.493 -0.439
401 HB2 ALA 49 1HB ALA 49 -10.810 -5.941 -1.182
402 HB3 ALA 49 2HB ALA 49 -11.703 -6.501 0.233
403 H TRP 50 H TRP 50 -8.959 -4.478 -1.421
404 HA TRP 50 HA TRP 50 -6.088 -5.103 -1.168
405 HB2 TRP 50 2HB TRP 50 -7.717 -5.766 -3.664
406 HB3 TRP 50 1HB TRP 50 -5.959 -5.730 -3.621
407 HD1 TRP 50 HD1 TRP 50 -4.769 -7.664 -1.994
408 HE1 TRP 50 HE1 TRP 50 -5.536 -10.072 -1.530
409 HE3 TRP 50 HE3 TRP 50 -9.674 -7.268 -3.415
410 HZ2 TRP 50 HZ2 TRP 50 -7.885 -11.607 -1.732
411 HZ3 TRP 50 HZ3 TRP 50 -11.113 -9.259 -3.257
412 HH2 TRP 50 HH2 TRP 50 -10.236 -11.387 -2.431
413 H ILE 51 H ILE 51 -4.711 -3.693 -2.227
414 HA ILE 51 HA ILE 51 -5.838 -1.456 -3.817
415 HB ILE 51 HB ILE 51 -3.454 -1.408 -1.895
416 HG12 ILE 51 2HG1 ILE 51 -5.641 -1.017 -0.807
417 HG13 ILE 51 1HG1 ILE 51 -4.655 0.434 -0.761
418 HG21 ILE 51 1HG2 ILE 51 -3.040 0.939 -2.605
419 HG22 ILE 51 2HG2 ILE 51 -4.231 0.749 -3.894
420 HG23 ILE 51 3HG2 ILE 51 -2.756 -0.221 -3.904
421 HD11 ILE 51 3HD1 ILE 51 -6.965 0.956 -1.210
422 HD12 ILE 51 1HD1 ILE 51 -6.969 -0.096 -2.624
423 HD13 ILE 51 2HD1 ILE 51 -5.977 1.368 -2.613
424 H HIS 52 H HIS 52 -5.243 -1.651 -5.890
425 HA HIS 52 HA HIS 52 -3.448 -3.581 -6.905
426 HB2 HIS 52 2HB HIS 52 -5.378 -2.494 -8.165
427 HB3 HIS 52 1HB HIS 52 -4.399 -1.043 -8.316
428 HD1 HIS 52 HD1 HIS 52 -2.242 -1.252 -9.873
429 HD2 HIS 52 HD2 HIS 52 -4.909 -4.427 -10.057
430 HE1 HIS 52 HE1 HIS 52 -1.654 -2.504 -11.960
431 HE2 HIS 52 HE2 HIS 52 -3.429 -4.273 -12.157
432 H ALA 53 H ALA 53 -1.337 -3.315 -7.820
433 HA ALA 53 HA ALA 53 0.367 -2.319 -5.884
434 HB1 ALA 53 3HB ALA 53 1.149 -3.196 -8.682
435 HB2 ALA 53 1HB ALA 53 0.840 -4.269 -7.317
436 HB3 ALA 53 2HB ALA 53 2.196 -3.145 -7.261
437 H ALA 54 H ALA 54 -0.565 -0.645 -8.849
438 HA ALA 54 HA ALA 54 1.585 1.210 -8.985
439 HB1 ALA 54 3HB ALA 54 0.082 0.739 -10.886
440 HB2 ALA 54 1HB ALA 54 0.162 2.468 -10.540
441 HB3 ALA 54 2HB ALA 54 -1.244 1.527 -10.033
442 H HIS 55 H HIS 55 -1.326 1.136 -7.093
443 HA HIS 55 HA HIS 55 -0.987 3.871 -6.053
444 HB2 HIS 55 2HB HIS 55 -3.190 1.814 -5.557
445 HB3 HIS 55 1HB HIS 55 -3.184 3.467 -4.945
446 HD1 HIS 55 HD1 HIS 55 -3.403 5.380 -6.804
447 HD2 HIS 55 HD2 HIS 55 -4.260 1.525 -8.080
448 HE1 HIS 55 HE1 HIS 55 -4.685 5.643 -8.939
449 HE2 HIS 55 HE2 HIS 55 -5.372 3.313 -9.561
450 H VAL 56 H VAL 56 0.796 1.472 -5.483
451 HA VAL 56 HA VAL 56 0.836 1.755 -2.531
452 HB VAL 56 HB VAL 56 1.837 -0.651 -4.150
453 HG11 VAL 56 1HG1 VAL 56 3.192 -0.262 -2.135
454 HG12 VAL 56 2HG1 VAL 56 2.237 -1.732 -1.976
455 HG13 VAL 56 3HG1 VAL 56 1.736 -0.266 -1.136
456 HG21 VAL 56 3HG2 VAL 56 0.021 -1.956 -3.106
457 HG22 VAL 56 1HG2 VAL 56 -0.622 -0.637 -4.088
458 HG23 VAL 56 2HG2 VAL 56 -0.594 -0.497 -2.328
459 H LYS 57 H LYS 57 2.965 2.093 -1.621
460 HA LYS 57 HA LYS 57 5.326 2.044 -3.319
461 HB2 LYS 57 2HB LYS 57 4.527 4.312 -3.784
462 HB3 LYS 57 1HB LYS 57 4.333 4.644 -2.063
463 HG2 LYS 57 2HG LYS 57 6.772 4.439 -1.746
464 HG3 LYS 57 1HG LYS 57 6.971 4.119 -3.472
465 HD2 LYS 57 2HD LYS 57 6.144 6.372 -4.006
466 HD3 LYS 57 1HD LYS 57 5.836 6.688 -2.291
467 HE2 LYS 57 2HE LYS 57 8.254 6.395 -1.829
468 HE3 LYS 57 1HE LYS 57 8.539 6.142 -3.553
469 HZ1 LYS 57 3HZ LYS 57 7.707 8.363 -3.965
470 HZ2 LYS 57 1HZ LYS 57 9.031 8.384 -2.918
471 HZ3 LYS 57 2HZ LYS 57 7.470 8.606 -2.310
472 H ALA 58 H ALA 58 6.641 0.844 -2.058
473 HA ALA 58 HA ALA 58 6.386 0.567 0.768
474 HB1 ALA 58 3HB ALA 58 7.217 -1.246 -0.666
475 HB2 ALA 58 1HB ALA 58 8.385 -0.860 0.597
476 HB3 ALA 58 2HB ALA 58 8.655 -0.305 -1.057
477 H ALA 59 H ALA 59 7.822 1.211 2.422
478 HA ALA 59 HA ALA 59 9.982 3.080 2.098
479 HB1 ALA 59 3HB ALA 59 8.117 4.611 1.592
480 HB2 ALA 59 1HB ALA 59 8.848 5.032 3.143
481 HB3 ALA 59 2HB ALA 59 7.311 4.159 3.095
482 H ASP 60 H ASP 60 11.249 2.412 3.721
483 HA ASP 60 HA ASP 60 10.296 0.908 5.993
484 HB2 ASP 60 2HB ASP 60 12.399 0.447 4.640
485 HB3 ASP 60 1HB ASP 60 13.119 1.884 5.347
486 HA PRO 61 HA PRO 61 10.132 4.621 8.722
487 HB2 PRO 61 2HB PRO 61 9.605 2.749 10.964
488 HB3 PRO 61 1HB PRO 61 8.549 3.998 10.276
489 HG2 PRO 61 2HG PRO 61 8.055 1.350 9.964
490 HG3 PRO 61 1HG PRO 61 7.596 2.567 8.752
491 HD2 PRO 61 2HD PRO 61 9.955 0.690 8.739
492 HD3 PRO 61 1HD PRO 61 8.874 1.154 7.404
493 H GLY 62 H GLY 62 12.112 1.793 9.133
494 HA2 GLY 62 2HA GLY 62 14.543 2.523 9.535
495 HA3 GLY 62 1HA GLY 62 13.931 3.107 11.080
496 H GLY 63 H GLY 63 14.198 0.185 9.054
497 HA2 GLY 63 2HA GLY 63 15.041 -1.913 9.755
498 HA3 GLY 63 1HA GLY 63 14.709 -1.499 11.430
499 H GLY 64 H GLY 64 12.046 -0.591 9.722
500 HA2 GLY 64 2HA GLY 64 10.039 -1.538 9.101
501 HA3 GLY 64 1HA GLY 64 10.670 -3.140 9.460
502 HA PRO 65 HA PRO 65 7.958 -1.577 13.102
503 HB2 PRO 65 2HB PRO 65 5.712 -3.145 11.904
504 HB3 PRO 65 1HB PRO 65 5.698 -1.516 12.613
505 HG2 PRO 65 2HG PRO 65 5.444 -1.855 9.977
506 HG3 PRO 65 1HG PRO 65 6.366 -0.488 10.642
507 HD2 PRO 65 2HD PRO 65 7.421 -3.099 9.530
508 HD3 PRO 65 1HD PRO 65 7.982 -1.437 9.217
509 H SER 66 H SER 66 9.511 -2.951 14.037
510 HA SER 66 HA SER 66 9.522 -5.765 14.023
511 HB2 SER 66 2HB SER 66 11.395 -4.383 14.882
512 HB3 SER 66 1HB SER 66 10.408 -3.865 16.247
513 HG SER 66 HG SER 66 11.360 -6.477 15.656
514 H SER 67 H SER 67 7.656 -3.401 15.837
515 HA SER 67 HA SER 67 6.300 -5.113 17.630
516 HB2 SER 67 2HB SER 67 5.349 -2.502 16.359
517 HB3 SER 67 1HB SER 67 4.668 -3.254 17.807
518 HG SER 67 HG SER 67 6.812 -1.632 17.569
519 H ARG 68 H ARG 68 4.731 -6.583 17.244
520 HA ARG 68 HA ARG 68 3.646 -7.116 14.680
521 HB2 ARG 68 2HB ARG 68 2.146 -8.744 15.937
522 HB3 ARG 68 1HB ARG 68 3.871 -8.972 16.148
523 HG2 ARG 68 2HG ARG 68 3.220 -9.268 18.323
524 HG3 ARG 68 1HG ARG 68 3.459 -7.524 18.356
525 HD2 ARG 68 2HD ARG 68 1.025 -7.187 18.078
526 HD3 ARG 68 1HD ARG 68 0.788 -8.936 17.989
527 HE ARG 68 HE ARG 68 2.109 -8.446 20.374
528 HH11 ARG 68 1HH1 ARG 68 -1.019 -7.571 18.998
529 HH12 ARG 68 2HH1 ARG 68 -1.793 -7.470 20.544
530 HH21 ARG 68 1HH2 ARG 68 1.075 -8.332 22.365
531 HH22 ARG 68 2HH2 ARG 68 -0.606 -7.901 22.455
532 H LEU 69 H LEU 69 2.198 -5.958 13.655
533 HA LEU 69 HA LEU 69 0.332 -4.135 15.013
534 HB2 LEU 69 2HB LEU 69 0.838 -4.518 12.035
535 HB3 LEU 69 1HB LEU 69 -0.020 -3.180 12.792
536 HG LEU 69 HG LEU 69 2.953 -3.779 13.068
537 HD11 LEU 69 1HD1 LEU 69 3.315 -1.731 11.799
538 HD12 LEU 69 2HD1 LEU 69 1.572 -1.525 11.598
539 HD13 LEU 69 3HD1 LEU 69 2.391 -2.910 10.871
540 HD21 LEU 69 3HD2 LEU 69 3.134 -1.644 14.285
541 HD22 LEU 69 1HD2 LEU 69 2.137 -2.813 15.149
542 HD23 LEU 69 2HD2 LEU 69 1.376 -1.480 14.275
543 H THR 70 H THR 70 0.321 -7.241 14.282
544 HA THR 70 HA THR 70 -2.590 -7.508 14.296
545 HB THR 70 HB THR 70 -1.978 -7.853 11.931
546 HG1 THR 70 HG1 THR 70 -3.246 -9.527 11.826
547 HG21 THR 70 3HG2 THR 70 -0.022 -9.967 12.905
548 HG22 THR 70 1HG2 THR 70 0.408 -8.417 12.179
549 HG23 THR 70 2HG2 THR 70 -0.428 -9.640 11.219
550 H TRP 71 H TRP 71 -2.963 -10.061 14.753
551 HA TRP 71 HA TRP 71 -1.634 -10.670 17.204
552 HB2 TRP 71 2HB TRP 71 -3.525 -12.354 15.499
553 HB3 TRP 71 1HB TRP 71 -2.959 -12.818 17.106
554 HD1 TRP 71 HD1 TRP 71 -5.591 -10.701 15.410
555 HE1 TRP 71 HE1 TRP 71 -6.992 -9.475 17.186
556 HE3 TRP 71 HE3 TRP 71 -2.709 -11.650 19.547
557 HZ2 TRP 71 HZ2 TRP 71 -6.899 -8.972 19.961
558 HZ3 TRP 71 HZ3 TRP 71 -3.434 -10.752 21.725
559 HH2 TRP 71 HH2 TRP 71 -5.489 -9.438 21.925
560 H ARG 72 H ARG 72 -1.694 -12.568 14.134
561 HA ARG 72 HA ARG 72 1.209 -12.994 14.362
562 HB2 ARG 72 2HB ARG 72 -0.761 -15.300 13.902
563 HB3 ARG 72 1HB ARG 72 0.982 -15.416 13.726
564 HG2 ARG 72 2HG ARG 72 1.277 -14.978 16.136
565 HG3 ARG 72 1HG ARG 72 -0.468 -14.808 16.322
566 HD2 ARG 72 2HD ARG 72 -0.731 -17.182 15.567
567 HD3 ARG 72 1HD ARG 72 1.029 -17.328 15.531
568 HE ARG 72 HE ARG 72 0.209 -16.417 18.079
569 HH11 ARG 72 1HH1 ARG 72 0.168 -19.360 16.140
570 HH12 ARG 72 2HH1 ARG 72 0.153 -20.414 17.519
571 HH21 ARG 72 1HH2 ARG 72 0.147 -17.812 19.879
572 HH22 ARG 72 2HH2 ARG 72 0.140 -19.533 19.649
573 H VAL 73 H VAL 73 -1.333 -14.348 12.217
574 HA VAL 73 HA VAL 73 -1.522 -14.571 9.997
575 HB VAL 73 HB VAL 73 -0.411 -11.729 9.830
576 HG11 VAL 73 1HG1 VAL 73 -2.234 -13.197 7.878
577 HG12 VAL 73 2HG1 VAL 73 -0.552 -12.747 7.593
578 HG13 VAL 73 3HG1 VAL 73 -1.779 -11.493 7.770
579 HG21 VAL 73 3HG2 VAL 73 -2.268 -11.835 11.436
580 HG22 VAL 73 1HG2 VAL 73 -3.289 -12.635 10.238
581 HG23 VAL 73 2HG2 VAL 73 -2.766 -10.968 9.984
582 H GLN 74 H GLN 74 1.248 -14.969 11.402
583 HA GLN 74 HA GLN 74 3.186 -14.898 9.247
584 HB2 GLN 74 2HB GLN 74 4.746 -15.794 10.939
585 HB3 GLN 74 1HB GLN 74 3.869 -14.399 11.559
586 HG2 GLN 74 2HG GLN 74 2.305 -16.014 12.732
587 HG3 GLN 74 1HG GLN 74 3.388 -17.314 12.241
588 HE21 GLN 74 1HE2 GLN 74 3.852 -17.870 14.393
589 HE22 GLN 74 2HE2 GLN 74 4.829 -16.881 15.419
590 H ARG 75 H ARG 75 0.681 -16.895 9.923
591 HA ARG 75 HA ARG 75 1.836 -19.461 9.153
592 HB2 ARG 75 2HB ARG 75 -1.069 -18.671 9.656
593 HB3 ARG 75 1HB ARG 75 -0.442 -20.313 9.525
594 HG2 ARG 75 2HG ARG 75 0.837 -20.015 11.602
595 HG3 ARG 75 1HG ARG 75 0.298 -18.339 11.718
596 HD2 ARG 75 2HD ARG 75 -0.990 -19.748 13.233
597 HD3 ARG 75 1HD ARG 75 -2.034 -19.113 11.959
598 HE ARG 75 HE ARG 75 -0.916 -21.797 11.595
599 HH11 ARG 75 1HH1 ARG 75 -3.741 -19.884 12.445
600 HH12 ARG 75 2HH1 ARG 75 -4.846 -21.198 12.230
601 HH21 ARG 75 1HH2 ARG 75 -2.373 -23.521 11.358
602 HH22 ARG 75 2HH2 ARG 75 -4.072 -23.261 11.615
603 H SER 76 H SER 76 0.885 -16.719 7.505
604 HA SER 76 HA SER 76 -0.607 -17.918 5.320
605 HB2 SER 76 2HB SER 76 0.452 -15.077 5.663
606 HB3 SER 76 1HB SER 76 -0.713 -15.606 4.448
607 HG SER 76 HG SER 76 -1.067 -15.050 7.122
608 H GLN 77 H GLN 77 1.425 -19.411 5.162
609 HA GLN 77 HA GLN 77 3.086 -20.274 3.895
610 HB2 GLN 77 2HB GLN 77 2.079 -18.157 1.951
611 HB3 GLN 77 1HB GLN 77 3.227 -19.411 1.506
612 HG2 GLN 77 2HG GLN 77 0.461 -20.020 2.582
613 HG3 GLN 77 1HG GLN 77 0.810 -19.824 0.868
614 HE21 GLN 77 1HE2 GLN 77 1.174 -21.901 3.635
615 HE22 GLN 77 2HE2 GLN 77 1.792 -23.272 2.787
616 H ASN 78 H ASN 78 3.957 -18.597 5.834
617 HA ASN 78 HA ASN 78 5.755 -17.514 6.659
618 HB2 ASN 78 2HB ASN 78 7.118 -18.589 4.155
619 HB3 ASN 78 1HB ASN 78 7.966 -17.912 5.544
620 HD21 ASN 78 1HD2 ASN 78 8.076 -19.132 7.467
621 HD22 ASN 78 2HD2 ASN 78 7.669 -20.809 7.514
622 HA PRO 79 HA PRO 79 5.124 -13.625 4.066
623 HB2 PRO 79 2HB PRO 79 4.238 -12.543 6.721
624 HB3 PRO 79 1HB PRO 79 3.456 -12.412 5.130
625 HG2 PRO 79 2HG PRO 79 2.430 -13.993 7.008
626 HG3 PRO 79 1HG PRO 79 2.429 -14.491 5.299
627 HD2 PRO 79 2HD PRO 79 4.323 -15.329 7.500
628 HD3 PRO 79 1HD PRO 79 3.487 -16.333 6.289
629 H LEU 80 H LEU 80 6.168 -13.822 7.474
630 HA LEU 80 HA LEU 80 7.747 -11.482 7.490
631 HB2 LEU 80 2HB LEU 80 7.645 -13.866 9.365
632 HB3 LEU 80 1HB LEU 80 8.645 -12.456 9.685
633 HG LEU 80 HG LEU 80 5.613 -12.367 9.384
634 HD11 LEU 80 1HD1 LEU 80 6.220 -13.637 11.391
635 HD12 LEU 80 2HD1 LEU 80 5.493 -12.089 11.803
636 HD13 LEU 80 3HD1 LEU 80 7.240 -12.303 11.944
637 HD21 LEU 80 3HD2 LEU 80 7.581 -10.236 10.295
638 HD22 LEU 80 1HD2 LEU 80 5.822 -10.096 10.343
639 HD23 LEU 80 2HD2 LEU 80 6.647 -10.242 8.796
640 H LYS 81 H LYS 81 9.303 -11.358 6.024
641 HA LYS 81 HA LYS 81 11.625 -13.169 6.195
642 HB2 LYS 81 2HB LYS 81 10.275 -12.096 3.678
643 HB3 LYS 81 1HB LYS 81 11.931 -12.698 3.673
644 HG2 LYS 81 2HG LYS 81 11.121 -14.921 4.441
645 HG3 LYS 81 1HG LYS 81 9.460 -14.324 4.411
646 HD2 LYS 81 2HD LYS 81 11.298 -14.487 1.987
647 HD3 LYS 81 1HD LYS 81 10.076 -15.688 2.403
648 HE2 LYS 81 2HE LYS 81 9.528 -12.776 1.731
649 HE3 LYS 81 1HE LYS 81 9.279 -14.151 0.656
650 HZ1 LYS 81 3HZ LYS 81 7.855 -13.655 3.216
651 HZ2 LYS 81 1HZ LYS 81 7.666 -15.035 2.253
652 HZ3 LYS 81 2HZ LYS 81 7.212 -13.520 1.657
653 H ILE 82 H ILE 82 13.640 -12.100 5.536
654 HA ILE 82 HA ILE 82 13.760 -9.494 6.842
655 HB ILE 82 HB ILE 82 16.213 -9.862 6.943
656 HG12 ILE 82 2HG1 ILE 82 15.656 -12.482 5.458
657 HG13 ILE 82 1HG1 ILE 82 16.539 -11.105 4.814
658 HG21 ILE 82 1HG2 ILE 82 16.194 -11.774 8.502
659 HG22 ILE 82 2HG2 ILE 82 14.624 -12.279 7.881
660 HG23 ILE 82 3HG2 ILE 82 14.778 -10.747 8.743
661 HD11 ILE 82 3HD1 ILE 82 18.064 -12.863 5.461
662 HD12 ILE 82 1HD1 ILE 82 17.425 -12.866 7.107
663 HD13 ILE 82 2HD1 ILE 82 18.298 -11.458 6.500
664 H ARG 83 H ARG 83 12.981 -10.015 3.844
665 HA ARG 83 HA ARG 83 14.769 -8.224 2.432
666 HB2 ARG 83 2HB ARG 83 12.011 -9.263 1.635
667 HB3 ARG 83 1HB ARG 83 13.123 -8.394 0.579
668 HG2 ARG 83 2HG ARG 83 14.751 -10.266 0.784
669 HG3 ARG 83 1HG ARG 83 13.603 -11.130 1.806
670 HD2 ARG 83 2HD ARG 83 11.975 -11.140 -0.081
671 HD3 ARG 83 1HD ARG 83 13.179 -10.349 -1.102
672 HE ARG 83 HE ARG 83 13.307 -13.096 -0.037
673 HH11 ARG 83 1HH1 ARG 83 14.525 -10.719 -2.336
674 HH12 ARG 83 2HH1 ARG 83 15.429 -11.892 -3.241
675 HH21 ARG 83 1HH2 ARG 83 14.421 -14.624 -1.272
676 HH22 ARG 83 2HH2 ARG 83 15.366 -14.114 -2.636
677 H LEU 84 H LEU 84 14.593 -6.607 4.195
678 HA LEU 84 HA LEU 84 12.221 -4.979 4.435
679 HB2 LEU 84 2HB LEU 84 15.090 -4.407 5.291
680 HB3 LEU 84 1HB LEU 84 13.692 -3.451 5.752
681 HG LEU 84 HG LEU 84 14.227 -6.333 6.589
682 HD11 LEU 84 1HD1 LEU 84 14.577 -5.421 8.842
683 HD12 LEU 84 2HD1 LEU 84 14.388 -3.778 8.222
684 HD13 LEU 84 3HD1 LEU 84 15.747 -4.775 7.694
685 HD21 LEU 84 3HD2 LEU 84 11.950 -4.494 7.390
686 HD22 LEU 84 1HD2 LEU 84 12.294 -6.076 8.095
687 HD23 LEU 84 2HD2 LEU 84 11.831 -5.952 6.400
688 H THR 85 H THR 85 11.643 -3.385 3.050
689 HA THR 85 HA THR 85 13.276 -2.463 0.862
690 HB THR 85 HB THR 85 11.362 -0.872 0.465
691 HG1 THR 85 HG1 THR 85 9.650 -1.953 2.295
692 HG21 THR 85 3HG2 THR 85 10.513 -3.748 1.009
693 HG22 THR 85 1HG2 THR 85 11.236 -3.149 -0.485
694 HG23 THR 85 2HG2 THR 85 9.634 -2.597 0.005
695 H ARG 86 H ARG 86 13.376 0.172 0.639
696 HA ARG 86 HA ARG 86 14.038 1.386 3.250
697 HB2 ARG 86 2HB ARG 86 16.198 0.614 2.342
698 HB3 ARG 86 1HB ARG 86 15.911 1.501 0.846
699 HG2 ARG 86 2HG ARG 86 15.956 3.632 2.086
700 HG3 ARG 86 1HG ARG 86 16.189 2.762 3.598
701 HD2 ARG 86 2HD ARG 86 18.390 1.951 2.763
702 HD3 ARG 86 1HD ARG 86 18.150 2.871 1.273
703 HE ARG 86 HE ARG 86 19.049 3.864 3.792
704 HH11 ARG 86 1HH1 ARG 86 17.161 4.877 0.982
705 HH12 ARG 86 2HH1 ARG 86 17.475 6.564 1.239
706 HH21 ARG 86 1HH2 ARG 86 19.441 6.073 4.100
707 HH22 ARG 86 2HH2 ARG 86 18.765 7.238 3.003
708 H GLU 87 H GLU 87 14.431 2.607 -0.112
709 HA GLU 87 HA GLU 87 12.418 4.660 0.241
710 HB2 GLU 87 2HB GLU 87 14.164 5.518 1.753
711 HB3 GLU 87 1HB GLU 87 15.383 5.362 0.494
712 HG2 GLU 87 2HG GLU 87 14.175 7.112 -0.829
713 HG3 GLU 87 1HG GLU 87 13.037 7.293 0.504
714 H ALA 88 H ALA 88 12.008 5.780 -1.622
715 HA ALA 88 HA ALA 88 13.841 5.968 -3.836
716 HB1 ALA 88 3HB ALA 88 12.833 3.765 -4.342
717 HB2 ALA 88 1HB ALA 88 12.290 4.969 -5.507
718 HB3 ALA 88 2HB ALA 88 11.214 4.454 -4.205
719 HA PRO 89 HA PRO 89 11.346 9.818 -3.858
720 HB2 PRO 89 2HB PRO 89 12.712 10.395 -6.461
721 HB3 PRO 89 1HB PRO 89 12.723 11.333 -4.955
722 HG2 PRO 89 2HG PRO 89 14.904 9.994 -5.747
723 HG3 PRO 89 1HG PRO 89 14.464 10.091 -4.023
724 HD2 PRO 89 2HD PRO 89 13.991 7.813 -5.957
725 HD3 PRO 89 1HD PRO 89 14.614 7.762 -4.288
Start of MODEL 5
1 H1 HIS 1 1H HIS 1 -11.314 -16.771 8.094
2 H2 HIS 1 2H HIS 1 -11.269 -17.738 9.479
3 H3 HIS 1 3H HIS 1 -11.621 -18.416 7.968
4 HA HIS 1 HA HIS 1 -9.065 -17.167 8.749
5 HB2 HIS 1 2HB HIS 1 -9.760 -20.110 8.326
6 HB3 HIS 1 1HB HIS 1 -8.125 -19.499 8.554
7 HD1 HIS 1 HD1 HIS 1 -7.671 -18.357 10.968
8 HD2 HIS 1 HD2 HIS 1 -11.077 -20.722 10.645
9 HE1 HIS 1 HE1 HIS 1 -8.351 -18.908 13.321
10 HE2 HIS 1 HE2 HIS 1 -10.480 -20.221 13.091
11 H HIS 2 H HIS 2 -7.947 -16.434 7.062
12 HA HIS 2 HA HIS 2 -8.602 -17.240 4.310
13 HB2 HIS 2 2HB HIS 2 -8.484 -14.761 4.972
14 HB3 HIS 2 1HB HIS 2 -6.756 -14.976 5.218
15 HD1 HIS 2 HD1 HIS 2 -9.287 -14.334 2.647
16 HD2 HIS 2 HD2 HIS 2 -5.319 -15.557 2.732
17 HE1 HIS 2 HE1 HIS 2 -8.432 -14.021 0.311
18 HE2 HIS 2 HE2 HIS 2 -6.024 -14.718 0.404
19 H HIS 3 H HIS 3 -7.226 -18.475 3.154
20 HA HIS 3 HA HIS 3 -5.150 -19.933 4.413
21 HB2 HIS 3 2HB HIS 3 -5.974 -19.775 1.480
22 HB3 HIS 3 1HB HIS 3 -4.735 -20.877 2.072
23 HD1 HIS 3 HD1 HIS 3 -5.496 -23.008 3.195
24 HD2 HIS 3 HD2 HIS 3 -8.632 -20.397 2.422
25 HE1 HIS 3 HE1 HIS 3 -7.587 -24.314 3.627
26 HE2 HIS 3 HE2 HIS 3 -9.460 -22.768 2.993
27 H HIS 4 H HIS 4 -2.990 -19.779 4.301
28 HA HIS 4 HA HIS 4 -1.902 -17.128 3.641
29 HB2 HIS 4 2HB HIS 4 -0.857 -19.287 5.538
30 HB3 HIS 4 1HB HIS 4 -0.182 -17.669 5.349
31 HD1 HIS 4 HD1 HIS 4 -1.758 -15.653 6.159
32 HD2 HIS 4 HD2 HIS 4 -2.966 -19.460 7.320
33 HE1 HIS 4 HE1 HIS 4 -3.469 -15.305 7.971
34 HE2 HIS 4 HE2 HIS 4 -4.189 -17.616 8.643
35 H HIS 5 H HIS 5 0.042 -16.893 2.537
36 HA HIS 5 HA HIS 5 1.421 -19.145 1.309
37 HB2 HIS 5 2HB HIS 5 0.907 -18.507 -1.020
38 HB3 HIS 5 1HB HIS 5 -0.587 -18.881 -0.170
39 HD1 HIS 5 HD1 HIS 5 1.156 -16.164 -1.986
40 HD2 HIS 5 HD2 HIS 5 -2.201 -16.533 0.445
41 HE1 HIS 5 HE1 HIS 5 -0.163 -14.062 -2.329
42 HE2 HIS 5 HE2 HIS 5 -2.078 -14.227 -0.717
43 H HIS 6 H HIS 6 2.924 -17.997 -0.571
44 HA HIS 6 HA HIS 6 4.737 -16.251 0.705
45 HB2 HIS 6 2HB HIS 6 4.380 -16.844 -2.268
46 HB3 HIS 6 1HB HIS 6 5.719 -15.905 -1.615
47 HD1 HIS 6 HD1 HIS 6 5.351 -19.001 -2.961
48 HD2 HIS 6 HD2 HIS 6 6.823 -17.771 0.720
49 HE1 HIS 6 HE1 HIS 6 6.842 -20.859 -2.175
50 HE2 HIS 6 HE2 HIS 6 7.668 -20.113 0.074
51 H SER 7 H SER 7 4.384 -14.206 1.237
52 HA SER 7 HA SER 7 2.948 -12.328 -0.520
53 HB2 SER 7 2HB SER 7 2.224 -12.751 2.431
54 HB3 SER 7 1HB SER 7 1.492 -11.576 1.339
55 HG SER 7 HG SER 7 1.314 -14.397 1.247
56 H HIS 8 H HIS 8 2.996 -10.057 0.853
57 HA HIS 8 HA HIS 8 5.749 -9.522 1.682
58 HB2 HIS 8 2HB HIS 8 3.282 -7.727 1.545
59 HB3 HIS 8 1HB HIS 8 4.861 -7.173 2.100
60 HD1 HIS 8 HD1 HIS 8 4.849 -5.464 0.155
61 HD2 HIS 8 HD2 HIS 8 4.871 -9.429 -1.074
62 HE1 HIS 8 HE1 HIS 8 5.385 -5.415 -2.297
63 HE2 HIS 8 HE2 HIS 8 5.221 -7.805 -3.039
64 H MET 9 H MET 9 6.281 -8.771 3.815
65 HA MET 9 HA MET 9 5.294 -10.434 5.851
66 HB2 MET 9 2HB MET 9 6.795 -9.206 7.382
67 HB3 MET 9 1HB MET 9 7.615 -9.591 5.881
68 HG2 MET 9 2HG MET 9 7.326 -7.259 5.124
69 HG3 MET 9 1HG MET 9 6.489 -6.877 6.629
70 HE1 MET 9 3HE MET 9 9.342 -7.216 9.296
71 HE2 MET 9 1HE MET 9 8.188 -8.474 8.849
72 HE3 MET 9 2HE MET 9 7.655 -6.797 9.014
73 H VAL 10 H VAL 10 3.912 -10.102 7.521
74 HA VAL 10 HA VAL 10 1.860 -8.190 7.438
75 HB VAL 10 HB VAL 10 1.442 -8.955 9.883
76 HG11 VAL 10 1HG1 VAL 10 0.582 -11.162 9.184
77 HG12 VAL 10 2HG1 VAL 10 1.512 -11.049 7.687
78 HG13 VAL 10 3HG1 VAL 10 0.205 -9.905 8.002
79 HG21 VAL 10 3HG2 VAL 10 3.699 -10.897 9.215
80 HG22 VAL 10 1HG2 VAL 10 2.627 -11.017 10.616
81 HG23 VAL 10 2HG2 VAL 10 3.736 -9.651 10.465
82 H GLY 11 H GLY 11 1.795 -6.127 8.051
83 HA2 GLY 11 2HA GLY 11 2.249 -4.225 9.326
84 HA3 GLY 11 1HA GLY 11 3.631 -5.025 10.053
85 H ASP 12 H ASP 12 3.544 -5.357 6.618
86 HA ASP 12 HA ASP 12 6.057 -4.178 6.206
87 HB2 ASP 12 2HB ASP 12 4.863 -5.830 4.679
88 HB3 ASP 12 1HB ASP 12 3.877 -4.499 4.098
89 H THR 13 H THR 13 6.532 -2.033 6.525
90 HA THR 13 HA THR 13 4.476 -0.041 6.683
91 HB THR 13 HB THR 13 7.504 0.298 6.823
92 HG1 THR 13 HG1 THR 13 5.767 -0.910 8.499
93 HG21 THR 13 3HG2 THR 13 6.353 2.465 6.471
94 HG22 THR 13 1HG2 THR 13 6.997 2.363 8.113
95 HG23 THR 13 2HG2 THR 13 5.272 2.123 7.825
96 H VAL 14 H VAL 14 3.616 0.742 4.876
97 HA VAL 14 HA VAL 14 5.251 1.453 2.516
98 HB VAL 14 HB VAL 14 3.405 0.663 1.050
99 HG11 VAL 14 1HG1 VAL 14 3.776 -1.767 1.298
100 HG12 VAL 14 2HG1 VAL 14 4.464 -1.500 2.901
101 HG13 VAL 14 3HG1 VAL 14 5.276 -0.851 1.474
102 HG21 VAL 14 3HG2 VAL 14 1.509 0.897 2.624
103 HG22 VAL 14 1HG2 VAL 14 2.130 -0.438 3.599
104 HG23 VAL 14 2HG2 VAL 14 1.558 -0.730 1.953
105 H TRP 15 H TRP 15 3.932 2.827 1.008
106 HA TRP 15 HA TRP 15 2.109 4.732 2.337
107 HB2 TRP 15 2HB TRP 15 4.121 5.159 0.071
108 HB3 TRP 15 1HB TRP 15 2.890 6.344 0.500
109 HD1 TRP 15 HD1 TRP 15 3.328 5.951 3.745
110 HE1 TRP 15 HE1 TRP 15 5.350 7.115 4.806
111 HE3 TRP 15 HE3 TRP 15 6.226 6.531 -0.422
112 HZ2 TRP 15 HZ2 TRP 15 7.834 8.155 4.012
113 HZ3 TRP 15 HZ3 TRP 15 8.425 7.619 -0.181
114 HH2 TRP 15 HH2 TRP 15 9.216 8.411 1.993
115 H VAL 16 H VAL 16 0.253 5.310 1.125
116 HA VAL 16 HA VAL 16 -0.392 3.602 -1.195
117 HB VAL 16 HB VAL 16 -2.261 4.989 0.790
118 HG11 VAL 16 1HG1 VAL 16 -4.158 4.046 -0.524
119 HG12 VAL 16 2HG1 VAL 16 -3.023 3.476 -1.747
120 HG13 VAL 16 3HG1 VAL 16 -3.235 5.208 -1.482
121 HG21 VAL 16 3HG2 VAL 16 -3.008 2.674 1.279
122 HG22 VAL 16 1HG2 VAL 16 -1.273 2.853 1.561
123 HG23 VAL 16 2HG2 VAL 16 -1.852 2.050 0.100
124 H ARG 17 H ARG 17 0.047 4.578 -2.973
125 HA ARG 17 HA ARG 17 0.138 7.452 -3.306
126 HB2 ARG 17 2HB ARG 17 1.939 5.845 -4.095
127 HB3 ARG 17 1HB ARG 17 0.795 5.217 -5.277
128 HG2 ARG 17 2HG ARG 17 0.670 7.442 -6.322
129 HG3 ARG 17 1HG ARG 17 1.818 8.068 -5.142
130 HD2 ARG 17 2HD ARG 17 2.987 7.621 -7.208
131 HD3 ARG 17 1HD ARG 17 3.512 6.438 -6.008
132 HE ARG 17 HE ARG 17 1.514 5.133 -7.306
133 HH11 ARG 17 1HH1 ARG 17 4.411 6.778 -8.475
134 HH12 ARG 17 2HH1 ARG 17 4.574 5.752 -9.861
135 HH21 ARG 17 1HH2 ARG 17 1.745 3.807 -9.146
136 HH22 ARG 17 2HH2 ARG 17 3.060 4.067 -10.246
137 H ARG 18 H ARG 18 -1.998 8.070 -3.280
138 HA ARG 18 HA ARG 18 -3.986 6.910 -5.123
139 HB2 ARG 18 2HB ARG 18 -4.665 7.129 -2.785
140 HB3 ARG 18 1HB ARG 18 -4.206 8.828 -2.764
141 HG2 ARG 18 2HG ARG 18 -6.037 9.310 -4.399
142 HG3 ARG 18 1HG ARG 18 -6.520 7.611 -4.325
143 HD2 ARG 18 2HD ARG 18 -7.003 7.844 -1.923
144 HD3 ARG 18 1HD ARG 18 -6.449 9.519 -1.961
145 HE ARG 18 HE ARG 18 -8.748 8.687 -3.605
146 HH11 ARG 18 1HH1 ARG 18 -7.485 10.645 -0.981
147 HH12 ARG 18 2HH1 ARG 18 -8.916 11.603 -0.836
148 HH21 ARG 18 1HH2 ARG 18 -10.647 9.947 -3.388
149 HH22 ARG 18 2HH2 ARG 18 -10.711 11.204 -2.193
150 H HIS 19 H HIS 19 -4.574 7.972 -6.973
151 HA HIS 19 HA HIS 19 -3.230 10.347 -7.780
152 HB2 HIS 19 2HB HIS 19 -4.404 10.204 -9.877
153 HB3 HIS 19 1HB HIS 19 -3.995 8.566 -9.396
154 HD1 HIS 19 HD1 HIS 19 -5.953 6.962 -8.852
155 HD2 HIS 19 HD2 HIS 19 -7.168 10.772 -9.982
156 HE1 HIS 19 HE1 HIS 19 -8.422 6.795 -9.259
157 HE2 HIS 19 HE2 HIS 19 -9.143 9.124 -9.875
158 H GLN 20 H GLN 20 -3.861 12.437 -7.801
159 HA GLN 20 HA GLN 20 -6.259 13.256 -6.349
160 HB2 GLN 20 2HB GLN 20 -4.207 14.990 -7.811
161 HB3 GLN 20 1HB GLN 20 -5.413 15.545 -6.651
162 HG2 GLN 20 2HG GLN 20 -2.998 13.801 -6.085
163 HG3 GLN 20 1HG GLN 20 -3.242 15.472 -5.588
164 HE21 GLN 20 1HE2 GLN 20 -4.078 12.142 -4.970
165 HE22 GLN 20 2HE2 GLN 20 -4.823 12.403 -3.443
166 H THR 21 H THR 21 -4.862 13.560 -9.549
167 HA THR 21 HA THR 21 -7.491 13.421 -10.849
168 HB THR 21 HB THR 21 -5.320 15.436 -11.677
169 HG1 THR 21 HG1 THR 21 -7.124 16.943 -10.889
170 HG21 THR 21 3HG2 THR 21 -8.233 15.242 -12.551
171 HG22 THR 21 1HG2 THR 21 -6.841 14.748 -13.524
172 HG23 THR 21 2HG2 THR 21 -7.058 16.443 -13.090
173 H LYS 22 H LYS 22 -6.988 12.890 -13.322
174 HA LYS 22 HA LYS 22 -4.900 10.934 -13.637
175 HB2 LYS 22 2HB LYS 22 -6.511 12.360 -15.799
176 HB3 LYS 22 1HB LYS 22 -5.576 10.876 -15.999
177 HG2 LYS 22 2HG LYS 22 -7.124 9.748 -14.372
178 HG3 LYS 22 1HG LYS 22 -8.098 11.224 -14.337
179 HD2 LYS 22 2HD LYS 22 -7.543 9.497 -16.784
180 HD3 LYS 22 1HD LYS 22 -9.061 9.560 -15.886
181 HE2 LYS 22 2HE LYS 22 -9.405 11.887 -16.556
182 HE3 LYS 22 1HE LYS 22 -7.829 11.925 -17.351
183 HZ1 LYS 22 3HZ LYS 22 -9.625 11.601 -18.929
184 HZ2 LYS 22 1HZ LYS 22 -10.105 10.188 -18.135
185 HZ3 LYS 22 2HZ LYS 22 -8.598 10.257 -18.902
186 H ASN 23 H ASN 23 -5.376 14.325 -14.445
187 HA ASN 23 HA ASN 23 -2.996 14.822 -15.870
188 HB2 ASN 23 2HB ASN 23 -4.722 16.745 -14.248
189 HB3 ASN 23 1HB ASN 23 -3.416 17.243 -15.320
190 HD21 ASN 23 1HD2 ASN 23 -4.548 18.334 -16.828
191 HD22 ASN 23 2HD2 ASN 23 -5.785 17.648 -17.819
192 H LEU 24 H LEU 24 -3.825 15.650 -12.494
193 HA LEU 24 HA LEU 24 -1.164 16.284 -11.689
194 HB2 LEU 24 2HB LEU 24 -3.591 15.551 -9.989
195 HB3 LEU 24 1HB LEU 24 -2.116 16.297 -9.383
196 HG LEU 24 HG LEU 24 -4.032 17.605 -11.365
197 HD11 LEU 24 1HD1 LEU 24 -5.082 17.374 -9.173
198 HD12 LEU 24 2HD1 LEU 24 -4.716 19.060 -9.525
199 HD13 LEU 24 3HD1 LEU 24 -3.696 18.155 -8.403
200 HD21 LEU 24 3HD2 LEU 24 -1.744 18.403 -11.665
201 HD22 LEU 24 1HD2 LEU 24 -1.603 18.744 -9.936
202 HD23 LEU 24 2HD2 LEU 24 -2.735 19.662 -10.934
203 H GLU 25 H GLU 25 0.388 15.008 -10.724
204 HA GLU 25 HA GLU 25 0.420 12.241 -11.195
205 HB2 GLU 25 2HB GLU 25 2.209 13.937 -9.407
206 HB3 GLU 25 1HB GLU 25 2.502 12.229 -9.738
207 HG2 GLU 25 2HG GLU 25 2.616 12.815 -12.201
208 HG3 GLU 25 1HG GLU 25 2.554 14.515 -11.730
209 HA PRO 26 HA PRO 26 -1.703 10.424 -7.689
210 HB2 PRO 26 2HB PRO 26 0.426 8.299 -7.809
211 HB3 PRO 26 1HB PRO 26 -1.340 8.127 -7.857
212 HG2 PRO 26 2HG PRO 26 0.062 7.816 -10.075
213 HG3 PRO 26 1HG PRO 26 -1.476 8.709 -10.117
214 HD2 PRO 26 2HD PRO 26 1.335 9.808 -10.099
215 HD3 PRO 26 1HD PRO 26 -0.067 10.320 -11.070
216 H ARG 27 H ARG 27 -1.588 11.195 -5.720
217 HA ARG 27 HA ARG 27 0.901 12.013 -4.460
218 HB2 ARG 27 2HB ARG 27 -1.037 13.537 -4.580
219 HB3 ARG 27 1HB ARG 27 -2.022 12.385 -3.685
220 HG2 ARG 27 2HG ARG 27 -0.575 12.704 -1.699
221 HG3 ARG 27 1HG ARG 27 0.403 13.865 -2.605
222 HD2 ARG 27 2HD ARG 27 -1.602 15.306 -2.887
223 HD3 ARG 27 1HD ARG 27 -2.552 14.149 -1.950
224 HE ARG 27 HE ARG 27 -0.700 14.692 -0.181
225 HH11 ARG 27 1HH1 ARG 27 -2.335 16.994 -2.279
226 HH12 ARG 27 2HH1 ARG 27 -2.174 18.301 -1.151
227 HH21 ARG 27 1HH2 ARG 27 -0.493 16.420 1.266
228 HH22 ARG 27 2HH2 ARG 27 -1.138 17.976 0.847
229 H TRP 28 H TRP 28 1.928 10.710 -3.091
230 HA TRP 28 HA TRP 28 0.837 8.303 -1.965
231 HB2 TRP 28 2HB TRP 28 3.073 8.056 -0.921
232 HB3 TRP 28 1HB TRP 28 3.218 8.469 -2.625
233 HD1 TRP 28 HD1 TRP 28 4.159 10.972 -3.204
234 HE1 TRP 28 HE1 TRP 28 5.574 12.608 -1.817
235 HE3 TRP 28 HE3 TRP 28 3.477 8.932 1.432
236 HZ2 TRP 28 HZ2 TRP 28 6.314 12.989 0.873
237 HZ3 TRP 28 HZ3 TRP 28 4.567 9.989 3.368
238 HH2 TRP 28 HH2 TRP 28 5.962 11.978 3.095
239 H LYS 29 H LYS 29 0.370 7.845 0.213
240 HA LYS 29 HA LYS 29 0.608 9.978 2.262
241 HB2 LYS 29 2HB LYS 29 -1.894 8.280 1.802
242 HB3 LYS 29 1HB LYS 29 -1.650 9.370 3.166
243 HG2 LYS 29 2HG LYS 29 -1.545 11.290 1.572
244 HG3 LYS 29 1HG LYS 29 -1.867 10.176 0.241
245 HD2 LYS 29 2HD LYS 29 -3.732 10.719 2.585
246 HD3 LYS 29 1HD LYS 29 -3.907 11.378 0.957
247 HE2 LYS 29 2HE LYS 29 -4.238 9.115 0.056
248 HE3 LYS 29 1HE LYS 29 -4.005 8.422 1.664
249 HZ1 LYS 29 3HZ LYS 29 -6.338 8.616 1.141
250 HZ2 LYS 29 1HZ LYS 29 -6.186 10.273 0.869
251 HZ3 LYS 29 2HZ LYS 29 -5.949 9.648 2.424
252 H GLY 30 H GLY 30 0.798 9.134 4.450
253 HA2 GLY 30 2HA GLY 30 0.723 6.327 5.028
254 HA3 GLY 30 1HA GLY 30 2.360 6.876 4.795
255 HA PRO 31 HA PRO 31 2.825 5.324 6.409
256 HB2 PRO 31 2HB PRO 31 3.101 4.032 8.766
257 HB3 PRO 31 1HB PRO 31 4.071 5.475 8.397
258 HG2 PRO 31 2HG PRO 31 1.611 5.257 10.110
259 HG3 PRO 31 1HG PRO 31 3.108 6.168 10.407
260 HD2 PRO 31 2HD PRO 31 0.769 7.284 9.374
261 HD3 PRO 31 1HD PRO 31 2.390 7.984 9.170
262 H TYR 32 H TYR 32 1.820 3.674 5.480
263 HA TYR 32 HA TYR 32 -0.506 2.310 6.703
264 HB2 TYR 32 2HB TYR 32 0.473 2.479 3.823
265 HB3 TYR 32 1HB TYR 32 -0.727 1.304 4.336
266 HD1 TYR 32 HD2 TYR 32 -0.092 4.939 3.847
267 HD2 TYR 32 HD1 TYR 32 -3.010 1.954 4.777
268 HE1 TYR 32 HE2 TYR 32 -1.890 6.590 3.536
269 HE2 TYR 32 HE1 TYR 32 -4.792 3.597 4.466
270 HH TYR 32 HH TYR 32 -5.152 5.942 4.460
271 H THR 33 H THR 33 -0.492 -0.135 6.192
272 HA THR 33 HA THR 33 2.164 -1.376 6.328
273 HB THR 33 HB THR 33 1.381 -2.654 8.459
274 HG1 THR 33 HG1 THR 33 -0.292 -0.380 8.805
275 HG21 THR 33 3HG2 THR 33 2.128 -0.872 10.021
276 HG22 THR 33 1HG2 THR 33 2.007 0.312 8.718
277 HG23 THR 33 2HG2 THR 33 3.188 -0.995 8.618
278 H VAL 34 H VAL 34 2.021 -2.963 4.838
279 HA VAL 34 HA VAL 34 -0.413 -4.240 4.037
280 HB VAL 34 HB VAL 34 2.484 -4.940 3.372
281 HG11 VAL 34 1HG1 VAL 34 1.614 -6.258 1.483
282 HG12 VAL 34 2HG1 VAL 34 -0.039 -5.941 2.015
283 HG13 VAL 34 3HG1 VAL 34 1.042 -6.904 3.022
284 HG21 VAL 34 3HG2 VAL 34 1.846 -2.701 2.582
285 HG22 VAL 34 1HG2 VAL 34 0.446 -3.379 1.750
286 HG23 VAL 34 2HG2 VAL 34 2.078 -3.802 1.221
287 H LEU 35 H LEU 35 -1.276 -6.131 4.716
288 HA LEU 35 HA LEU 35 0.152 -7.756 6.745
289 HB2 LEU 35 2HB LEU 35 -2.832 -7.681 6.140
290 HB3 LEU 35 1HB LEU 35 -2.054 -8.618 7.410
291 HG LEU 35 HG LEU 35 -2.328 -5.590 7.277
292 HD11 LEU 35 1HD1 LEU 35 -4.349 -6.741 7.994
293 HD12 LEU 35 2HD1 LEU 35 -3.630 -5.853 9.334
294 HD13 LEU 35 3HD1 LEU 35 -3.448 -7.608 9.243
295 HD21 LEU 35 3HD2 LEU 35 -1.157 -5.486 9.442
296 HD22 LEU 35 1HD2 LEU 35 -0.106 -6.096 8.168
297 HD23 LEU 35 2HD2 LEU 35 -0.800 -7.214 9.347
298 H LEU 36 H LEU 36 -1.408 -7.839 3.584
299 HA LEU 36 HA LEU 36 -0.388 -10.555 3.065
300 HB2 LEU 36 2HB LEU 36 -2.643 -10.916 4.060
301 HB3 LEU 36 1HB LEU 36 -3.349 -9.831 2.879
302 HG LEU 36 HG LEU 36 -2.612 -11.504 1.069
303 HD11 LEU 36 1HD1 LEU 36 -2.141 -13.337 3.439
304 HD12 LEU 36 2HD1 LEU 36 -0.911 -12.722 2.329
305 HD13 LEU 36 3HD1 LEU 36 -2.161 -13.815 1.737
306 HD21 LEU 36 3HD2 LEU 36 -4.524 -12.984 1.421
307 HD22 LEU 36 1HD2 LEU 36 -4.935 -11.313 1.808
308 HD23 LEU 36 2HD2 LEU 36 -4.634 -12.472 3.107
309 H THR 37 H THR 37 -0.418 -11.026 0.713
310 HA THR 37 HA THR 37 -1.262 -8.812 -1.044
311 HB THR 37 HB THR 37 0.846 -9.127 -2.445
312 HG1 THR 37 HG1 THR 37 1.543 -11.100 -1.513
313 HG21 THR 37 3HG2 THR 37 1.353 -8.093 0.357
314 HG22 THR 37 1HG2 THR 37 0.583 -7.176 -0.940
315 HG23 THR 37 2HG2 THR 37 2.266 -7.680 -1.095
316 H THR 38 H THR 38 -1.361 -9.388 -3.246
317 HA THR 38 HA THR 38 -1.505 -12.190 -4.084
318 HB THR 38 HB THR 38 -3.687 -11.634 -5.339
319 HG1 THR 38 HG1 THR 38 -3.543 -9.376 -3.639
320 HG21 THR 38 3HG2 THR 38 -3.888 -11.636 -2.310
321 HG22 THR 38 1HG2 THR 38 -3.780 -13.065 -3.339
322 HG23 THR 38 2HG2 THR 38 -5.199 -12.019 -3.428
323 HA PRO 39 HA PRO 39 0.484 -10.816 -7.898
324 HB2 PRO 39 2HB PRO 39 -2.002 -11.700 -9.403
325 HB3 PRO 39 1HB PRO 39 -0.291 -12.030 -9.765
326 HG2 PRO 39 2HG PRO 39 -1.748 -13.920 -8.644
327 HG3 PRO 39 1HG PRO 39 -0.090 -13.629 -8.065
328 HD2 PRO 39 2HD PRO 39 -2.694 -12.852 -6.770
329 HD3 PRO 39 1HD PRO 39 -1.179 -13.397 -6.018
330 H THR 40 H THR 40 0.616 -8.650 -7.819
331 HA THR 40 HA THR 40 0.431 -6.511 -8.410
332 HB THR 40 HB THR 40 -1.749 -7.209 -10.423
333 HG1 THR 40 HG1 THR 40 -0.089 -7.901 -11.819
334 HG21 THR 40 3HG2 THR 40 -0.607 -5.499 -11.808
335 HG22 THR 40 1HG2 THR 40 0.578 -5.244 -10.528
336 HG23 THR 40 2HG2 THR 40 -1.112 -4.809 -10.262
337 H ALA 41 H ALA 41 -1.498 -7.721 -6.357
338 HA ALA 41 HA ALA 41 -2.808 -5.149 -5.809
339 HB1 ALA 41 3HB ALA 41 -4.594 -6.484 -6.885
340 HB2 ALA 41 1HB ALA 41 -4.955 -6.196 -5.179
341 HB3 ALA 41 2HB ALA 41 -4.357 -7.773 -5.704
342 H LEU 42 H LEU 42 -2.310 -4.604 -3.791
343 HA LEU 42 HA LEU 42 -1.104 -6.589 -1.982
344 HB2 LEU 42 2HB LEU 42 -0.752 -3.558 -1.950
345 HB3 LEU 42 1HB LEU 42 0.244 -4.762 -1.138
346 HG LEU 42 HG LEU 42 0.115 -4.206 -4.133
347 HD11 LEU 42 1HD1 LEU 42 1.423 -2.580 -2.902
348 HD12 LEU 42 2HD1 LEU 42 2.446 -3.559 -3.944
349 HD13 LEU 42 3HD1 LEU 42 2.416 -3.861 -2.203
350 HD21 LEU 42 3HD2 LEU 42 1.810 -5.922 -4.490
351 HD22 LEU 42 1HD2 LEU 42 0.353 -6.628 -3.800
352 HD23 LEU 42 2HD2 LEU 42 1.770 -6.361 -2.781
353 H LYS 43 H LYS 43 -2.270 -7.067 -0.160
354 HA LYS 43 HA LYS 43 -4.570 -5.430 0.597
355 HB2 LYS 43 2HB LYS 43 -4.874 -7.866 0.632
356 HB3 LYS 43 1HB LYS 43 -3.533 -8.055 1.759
357 HG2 LYS 43 2HG LYS 43 -4.801 -6.813 3.483
358 HG3 LYS 43 1HG LYS 43 -6.138 -6.604 2.348
359 HD2 LYS 43 2HD LYS 43 -6.286 -9.145 2.229
360 HD3 LYS 43 1HD LYS 43 -5.125 -9.198 3.562
361 HE2 LYS 43 2HE LYS 43 -7.395 -9.417 4.426
362 HE3 LYS 43 1HE LYS 43 -6.714 -7.874 4.950
363 HZ1 LYS 43 3HZ LYS 43 -8.980 -7.619 4.175
364 HZ2 LYS 43 1HZ LYS 43 -8.581 -8.266 2.668
365 HZ3 LYS 43 2HZ LYS 43 -7.925 -6.782 3.153
366 H VAL 44 H VAL 44 -4.055 -3.683 1.642
367 HA VAL 44 HA VAL 44 -2.007 -3.555 3.740
368 HB VAL 44 HB VAL 44 -3.698 -1.326 2.509
369 HG11 VAL 44 1HG1 VAL 44 -1.198 -1.132 4.214
370 HG12 VAL 44 2HG1 VAL 44 -2.839 -0.729 4.722
371 HG13 VAL 44 3HG1 VAL 44 -2.045 0.228 3.470
372 HG21 VAL 44 3HG2 VAL 44 -1.740 -0.726 1.132
373 HG22 VAL 44 1HG2 VAL 44 -2.273 -2.371 0.776
374 HG23 VAL 44 2HG2 VAL 44 -0.846 -2.101 1.780
375 H ASP 45 H ASP 45 -2.585 -2.703 5.847
376 HA ASP 45 HA ASP 45 -5.045 -3.644 6.922
377 HB2 ASP 45 2HB ASP 45 -2.911 -3.591 8.228
378 HB3 ASP 45 1HB ASP 45 -2.957 -1.831 8.207
379 H GLY 46 H GLY 46 -6.873 -2.536 7.388
380 HA2 GLY 46 2HA GLY 46 -8.288 -0.708 7.736
381 HA3 GLY 46 1HA GLY 46 -7.052 0.373 7.111
382 H ILE 47 H ILE 47 -7.100 -2.074 4.940
383 HA ILE 47 HA ILE 47 -8.875 -0.638 3.087
384 HB ILE 47 HB ILE 47 -6.910 -2.925 2.588
385 HG12 ILE 47 2HG1 ILE 47 -5.747 -0.853 3.211
386 HG13 ILE 47 1HG1 ILE 47 -5.486 -1.184 1.505
387 HG21 ILE 47 1HG2 ILE 47 -8.474 -1.296 0.547
388 HG22 ILE 47 2HG2 ILE 47 -8.681 -3.014 0.899
389 HG23 ILE 47 3HG2 ILE 47 -7.185 -2.440 0.162
390 HD11 ILE 47 3HD1 ILE 47 -7.385 0.850 2.656
391 HD12 ILE 47 1HD1 ILE 47 -7.165 0.514 0.936
392 HD13 ILE 47 2HD1 ILE 47 -5.832 1.161 1.890
393 H ALA 48 H ALA 48 -10.588 -1.627 2.001
394 HA ALA 48 HA ALA 48 -12.282 -3.351 3.376
395 HB1 ALA 48 3HB ALA 48 -12.271 -2.761 0.389
396 HB2 ALA 48 1HB ALA 48 -13.053 -1.783 1.631
397 HB3 ALA 48 2HB ALA 48 -13.631 -3.417 1.306
398 H ALA 49 H ALA 49 -10.193 -4.109 0.537
399 HA ALA 49 HA ALA 49 -9.834 -6.829 1.546
400 HB1 ALA 49 3HB ALA 49 -10.945 -6.346 -1.241
401 HB2 ALA 49 1HB ALA 49 -11.847 -7.006 0.128
402 HB3 ALA 49 2HB ALA 49 -10.493 -7.908 -0.554
403 H TRP 50 H TRP 50 -9.160 -4.898 -1.438
404 HA TRP 50 HA TRP 50 -6.268 -5.188 -1.009
405 HB2 TRP 50 2HB TRP 50 -7.671 -6.206 -3.522
406 HB3 TRP 50 1HB TRP 50 -5.950 -5.839 -3.483
407 HD1 TRP 50 HD1 TRP 50 -4.403 -7.462 -1.868
408 HE1 TRP 50 HE1 TRP 50 -4.747 -9.913 -1.180
409 HE3 TRP 50 HE3 TRP 50 -9.362 -7.953 -3.021
410 HZ2 TRP 50 HZ2 TRP 50 -6.828 -11.817 -1.141
411 HZ3 TRP 50 HZ3 TRP 50 -10.457 -10.122 -2.639
412 HH2 TRP 50 HH2 TRP 50 -9.214 -12.014 -1.717
413 H ILE 51 H ILE 51 -4.988 -3.746 -2.205
414 HA ILE 51 HA ILE 51 -6.339 -1.647 -3.816
415 HB ILE 51 HB ILE 51 -3.972 -1.388 -1.898
416 HG12 ILE 51 2HG1 ILE 51 -6.213 -1.099 -0.870
417 HG13 ILE 51 1HG1 ILE 51 -5.303 0.404 -0.834
418 HG21 ILE 51 1HG2 ILE 51 -3.321 -0.226 -3.938
419 HG22 ILE 51 2HG2 ILE 51 -3.686 0.953 -2.676
420 HG23 ILE 51 3HG2 ILE 51 -4.854 0.650 -3.965
421 HD11 ILE 51 3HD1 ILE 51 -7.537 -0.292 -2.742
422 HD12 ILE 51 1HD1 ILE 51 -6.615 1.216 -2.758
423 HD13 ILE 51 2HD1 ILE 51 -7.618 0.807 -1.367
424 H HIS 52 H HIS 52 -5.476 -1.386 -5.873
425 HA HIS 52 HA HIS 52 -3.895 -3.480 -6.975
426 HB2 HIS 52 2HB HIS 52 -5.630 -2.008 -8.204
427 HB3 HIS 52 1HB HIS 52 -4.395 -0.761 -8.275
428 HD1 HIS 52 HD1 HIS 52 -2.212 -1.399 -9.760
429 HD2 HIS 52 HD2 HIS 52 -5.527 -3.864 -10.191
430 HE1 HIS 52 HE1 HIS 52 -1.868 -2.632 -11.914
431 HE2 HIS 52 HE2 HIS 52 -3.953 -3.988 -12.215
432 H ALA 53 H ALA 53 -1.701 -3.346 -7.785
433 HA ALA 53 HA ALA 53 -0.044 -2.730 -5.655
434 HB1 ALA 53 3HB ALA 53 0.814 -3.410 -8.485
435 HB2 ALA 53 1HB ALA 53 0.366 -4.563 -7.228
436 HB3 ALA 53 2HB ALA 53 1.804 -3.562 -7.031
437 H ALA 54 H ALA 54 -0.470 -0.788 -8.615
438 HA ALA 54 HA ALA 54 1.862 0.855 -8.084
439 HB1 ALA 54 3HB ALA 54 -0.296 1.214 -10.186
440 HB2 ALA 54 1HB ALA 54 1.233 0.366 -10.404
441 HB3 ALA 54 2HB ALA 54 1.223 2.105 -10.112
442 H HIS 55 H HIS 55 -1.119 0.825 -6.670
443 HA HIS 55 HA HIS 55 -1.061 3.699 -5.983
444 HB2 HIS 55 2HB HIS 55 -3.068 1.553 -5.181
445 HB3 HIS 55 1HB HIS 55 -3.174 3.254 -4.751
446 HD1 HIS 55 HD1 HIS 55 -3.169 4.842 -7.081
447 HD2 HIS 55 HD2 HIS 55 -4.654 0.968 -7.270
448 HE1 HIS 55 HE1 HIS 55 -4.669 4.779 -9.085
449 HE2 HIS 55 HE2 HIS 55 -5.483 2.413 -9.235
450 H VAL 56 H VAL 56 0.735 1.216 -5.132
451 HA VAL 56 HA VAL 56 1.071 2.154 -2.356
452 HB VAL 56 HB VAL 56 1.074 -0.809 -3.152
453 HG11 VAL 56 1HG1 VAL 56 1.588 0.439 -0.425
454 HG12 VAL 56 2HG1 VAL 56 2.791 -0.351 -1.448
455 HG13 VAL 56 3HG1 VAL 56 1.469 -1.292 -0.756
456 HG21 VAL 56 3HG2 VAL 56 -1.233 0.033 -2.944
457 HG22 VAL 56 1HG2 VAL 56 -0.874 0.660 -1.333
458 HG23 VAL 56 2HG2 VAL 56 -0.860 -1.081 -1.627
459 H LYS 57 H LYS 57 3.219 2.386 -1.799
460 HA LYS 57 HA LYS 57 5.316 1.053 -3.379
461 HB2 LYS 57 2HB LYS 57 5.113 3.420 -4.223
462 HB3 LYS 57 1HB LYS 57 5.430 4.004 -2.592
463 HG2 LYS 57 2HG LYS 57 7.670 2.836 -2.681
464 HG3 LYS 57 1HG LYS 57 7.342 2.429 -4.364
465 HD2 LYS 57 2HD LYS 57 8.795 4.379 -4.271
466 HD3 LYS 57 1HD LYS 57 7.220 4.865 -4.901
467 HE2 LYS 57 2HE LYS 57 6.613 5.780 -2.685
468 HE3 LYS 57 1HE LYS 57 8.168 5.253 -2.036
469 HZ1 LYS 57 3HZ LYS 57 8.181 7.598 -2.613
470 HZ2 LYS 57 1HZ LYS 57 7.805 7.237 -4.220
471 HZ3 LYS 57 2HZ LYS 57 9.280 6.745 -3.563
472 H ALA 58 H ALA 58 7.220 0.654 -2.158
473 HA ALA 58 HA ALA 58 6.966 0.102 0.580
474 HB1 ALA 58 3HB ALA 58 8.571 -1.050 -0.893
475 HB2 ALA 58 1HB ALA 58 9.396 -0.361 0.505
476 HB3 ALA 58 2HB ALA 58 9.503 0.437 -1.066
477 H ALA 59 H ALA 59 7.119 1.412 2.346
478 HA ALA 59 HA ALA 59 8.355 4.101 2.113
479 HB1 ALA 59 3HB ALA 59 6.053 4.042 2.988
480 HB2 ALA 59 1HB ALA 59 7.185 4.609 4.222
481 HB3 ALA 59 2HB ALA 59 6.559 2.955 4.280
482 H ASP 60 H ASP 60 10.076 4.653 3.431
483 HA ASP 60 HA ASP 60 11.710 2.532 4.515
484 HB2 ASP 60 2HB ASP 60 12.636 4.557 3.325
485 HB3 ASP 60 1HB ASP 60 12.102 5.566 4.659
486 HA PRO 61 HA PRO 61 9.680 3.214 8.609
487 HB2 PRO 61 2HB PRO 61 10.180 0.807 9.719
488 HB3 PRO 61 1HB PRO 61 9.013 0.958 8.389
489 HG2 PRO 61 2HG PRO 61 11.859 -0.005 8.289
490 HG3 PRO 61 1HG PRO 61 10.419 -0.661 7.475
491 HD2 PRO 61 2HD PRO 61 12.266 1.049 6.261
492 HD3 PRO 61 1HD PRO 61 10.600 0.805 5.704
493 H GLY 62 H GLY 62 12.926 3.000 7.736
494 HA2 GLY 62 2HA GLY 62 14.881 3.662 8.722
495 HA3 GLY 62 1HA GLY 62 13.979 4.104 10.167
496 H GLY 63 H GLY 63 13.398 0.883 9.148
497 HA2 GLY 63 2HA GLY 63 14.005 -1.158 10.014
498 HA3 GLY 63 1HA GLY 63 15.385 -0.416 10.803
499 H GLY 64 H GLY 64 12.847 1.471 11.713
500 HA2 GLY 64 2HA GLY 64 11.899 -0.174 13.959
501 HA3 GLY 64 1HA GLY 64 12.836 1.269 14.337
502 HA PRO 65 HA PRO 65 8.513 2.592 12.124
503 HB2 PRO 65 2HB PRO 65 6.562 0.627 12.701
504 HB3 PRO 65 1HB PRO 65 7.385 0.808 11.143
505 HG2 PRO 65 2HG PRO 65 8.039 -1.041 13.414
506 HG3 PRO 65 1HG PRO 65 8.011 -1.367 11.664
507 HD2 PRO 65 2HD PRO 65 10.338 -0.993 12.901
508 HD3 PRO 65 1HD PRO 65 10.071 -0.278 11.293
509 H SER 66 H SER 66 9.071 0.941 15.155
510 HA SER 66 HA SER 66 8.646 1.414 17.324
511 HB2 SER 66 2HB SER 66 7.861 4.182 16.300
512 HB3 SER 66 1HB SER 66 8.273 3.776 17.971
513 HG SER 66 HG SER 66 9.994 3.488 15.725
514 H SER 67 H SER 67 6.592 0.183 15.742
515 HA SER 67 HA SER 67 4.168 0.847 17.289
516 HB2 SER 67 2HB SER 67 4.017 2.059 15.111
517 HB3 SER 67 1HB SER 67 4.218 0.535 14.241
518 HG SER 67 HG SER 67 2.217 -0.062 14.803
519 H ARG 68 H ARG 68 2.575 -0.875 17.271
520 HA ARG 68 HA ARG 68 3.642 -3.515 17.427
521 HB2 ARG 68 2HB ARG 68 0.746 -2.552 17.420
522 HB3 ARG 68 1HB ARG 68 1.245 -4.203 17.778
523 HG2 ARG 68 2HG ARG 68 1.979 -1.738 19.393
524 HG3 ARG 68 1HG ARG 68 0.761 -2.942 19.825
525 HD2 ARG 68 2HD ARG 68 2.478 -4.669 20.018
526 HD3 ARG 68 1HD ARG 68 3.725 -3.538 19.478
527 HE ARG 68 HE ARG 68 2.737 -2.286 21.632
528 HH11 ARG 68 1HH1 ARG 68 3.843 -5.600 21.197
529 HH12 ARG 68 2HH1 ARG 68 4.365 -5.763 22.844
530 HH21 ARG 68 1HH2 ARG 68 3.455 -2.504 23.767
531 HH22 ARG 68 2HH2 ARG 68 4.144 -4.003 24.300
532 H LEU 69 H LEU 69 4.392 -4.287 15.537
533 HA LEU 69 HA LEU 69 2.481 -4.807 13.332
534 HB2 LEU 69 2HB LEU 69 5.482 -4.318 13.058
535 HB3 LEU 69 1HB LEU 69 4.373 -4.691 11.746
536 HG LEU 69 HG LEU 69 4.417 -2.118 13.387
537 HD11 LEU 69 1HD1 LEU 69 5.047 -1.039 11.295
538 HD12 LEU 69 2HD1 LEU 69 5.093 -2.607 10.487
539 HD13 LEU 69 3HD1 LEU 69 6.226 -2.249 11.788
540 HD21 LEU 69 3HD2 LEU 69 2.539 -2.887 11.123
541 HD22 LEU 69 1HD2 LEU 69 2.632 -1.304 11.903
542 HD23 LEU 69 2HD2 LEU 69 2.097 -2.705 12.821
543 H THR 70 H THR 70 4.590 -6.045 15.695
544 HA THR 70 HA THR 70 5.273 -8.535 14.406
545 HB THR 70 HB THR 70 5.573 -7.705 17.329
546 HG1 THR 70 HG1 THR 70 6.749 -6.555 15.486
547 HG21 THR 70 3HG2 THR 70 5.656 -10.175 17.058
548 HG22 THR 70 1HG2 THR 70 7.253 -9.530 17.454
549 HG23 THR 70 2HG2 THR 70 6.876 -9.994 15.796
550 H TRP 71 H TRP 71 3.206 -9.248 13.833
551 HA TRP 71 HA TRP 71 1.944 -10.874 15.930
552 HB2 TRP 71 2HB TRP 71 -0.259 -10.556 14.528
553 HB3 TRP 71 1HB TRP 71 0.204 -9.316 15.687
554 HD1 TRP 71 HD1 TRP 71 0.922 -9.846 11.869
555 HE1 TRP 71 HE1 TRP 71 0.561 -7.595 10.686
556 HE3 TRP 71 HE3 TRP 71 -0.359 -7.008 15.902
557 HZ2 TRP 71 HZ2 TRP 71 -0.194 -4.978 11.345
558 HZ3 TRP 71 HZ3 TRP 71 -0.900 -4.638 15.544
559 HH2 TRP 71 HH2 TRP 71 -0.817 -3.642 13.313
560 H ARG 72 H ARG 72 1.334 -12.905 15.243
561 HA ARG 72 HA ARG 72 2.700 -13.852 12.818
562 HB2 ARG 72 2HB ARG 72 2.480 -16.102 13.846
563 HB3 ARG 72 1HB ARG 72 3.328 -14.963 14.880
564 HG2 ARG 72 2HG ARG 72 1.273 -14.693 16.250
565 HG3 ARG 72 1HG ARG 72 0.444 -15.866 15.219
566 HD2 ARG 72 2HD ARG 72 2.135 -17.579 15.869
567 HD3 ARG 72 1HD ARG 72 2.888 -16.396 16.946
568 HE ARG 72 HE ARG 72 0.120 -16.729 17.536
569 HH11 ARG 72 1HH1 ARG 72 3.248 -18.287 17.977
570 HH12 ARG 72 2HH1 ARG 72 2.757 -19.128 19.414
571 HH21 ARG 72 1HH2 ARG 72 -0.490 -17.837 19.413
572 HH22 ARG 72 2HH2 ARG 72 0.645 -18.863 20.222
573 H VAL 73 H VAL 73 0.425 -12.423 12.264
574 HA VAL 73 HA VAL 73 -1.912 -13.932 11.781
575 HB VAL 73 HB VAL 73 -0.784 -11.506 10.297
576 HG11 VAL 73 1HG1 VAL 73 -2.359 -12.669 8.813
577 HG12 VAL 73 2HG1 VAL 73 -3.059 -11.152 9.374
578 HG13 VAL 73 3HG1 VAL 73 -3.584 -12.680 10.084
579 HG21 VAL 73 3HG2 VAL 73 -1.284 -11.062 12.665
580 HG22 VAL 73 1HG2 VAL 73 -2.923 -11.692 12.462
581 HG23 VAL 73 2HG2 VAL 73 -2.435 -10.208 11.634
582 H GLN 74 H GLN 74 0.597 -12.961 9.402
583 HA GLN 74 HA GLN 74 0.096 -15.293 7.744
584 HB2 GLN 74 2HB GLN 74 0.647 -13.168 6.625
585 HB3 GLN 74 1HB GLN 74 2.178 -13.075 7.489
586 HG2 GLN 74 2HG GLN 74 2.548 -13.812 5.204
587 HG3 GLN 74 1HG GLN 74 2.978 -15.089 6.336
588 HE21 GLN 74 1HE2 GLN 74 2.782 -16.738 4.868
589 HE22 GLN 74 2HE2 GLN 74 1.283 -17.231 4.175
590 H ARG 75 H ARG 75 0.503 -16.813 9.422
591 HA ARG 75 HA ARG 75 3.302 -17.691 9.449
592 HB2 ARG 75 2HB ARG 75 2.603 -16.442 11.661
593 HB3 ARG 75 1HB ARG 75 1.672 -17.884 12.018
594 HG2 ARG 75 2HG ARG 75 4.673 -17.885 11.509
595 HG3 ARG 75 1HG ARG 75 3.954 -17.758 13.111
596 HD2 ARG 75 2HD ARG 75 2.951 -19.996 12.853
597 HD3 ARG 75 1HD ARG 75 3.600 -20.114 11.213
598 HE ARG 75 HE ARG 75 5.645 -19.621 13.142
599 HH11 ARG 75 1HH1 ARG 75 3.640 -22.233 11.872
600 HH12 ARG 75 2HH1 ARG 75 4.789 -23.462 12.285
601 HH21 ARG 75 1HH2 ARG 75 7.116 -21.244 13.660
602 HH22 ARG 75 2HH2 ARG 75 6.753 -22.899 13.300
603 H SER 76 H SER 76 2.553 -19.036 7.816
604 HA SER 76 HA SER 76 0.638 -21.171 8.423
605 HB2 SER 76 2HB SER 76 1.212 -21.797 5.997
606 HB3 SER 76 1HB SER 76 0.447 -20.228 6.221
607 HG SER 76 HG SER 76 2.509 -20.497 4.863
608 H GLN 77 H GLN 77 3.996 -20.770 7.386
609 HA GLN 77 HA GLN 77 4.976 -22.918 9.057
610 HB2 GLN 77 2HB GLN 77 6.085 -24.111 7.129
611 HB3 GLN 77 1HB GLN 77 4.332 -24.245 7.115
612 HG2 GLN 77 2HG GLN 77 4.176 -22.571 5.342
613 HG3 GLN 77 1HG GLN 77 5.917 -22.301 5.404
614 HE21 GLN 77 1HE2 GLN 77 6.247 -22.854 3.262
615 HE22 GLN 77 2HE2 GLN 77 6.079 -24.464 2.659
616 H ASN 78 H ASN 78 5.657 -20.583 6.450
617 HA ASN 78 HA ASN 78 8.336 -20.000 7.557
618 HB2 ASN 78 2HB ASN 78 7.162 -19.500 4.784
619 HB3 ASN 78 1HB ASN 78 8.716 -18.859 5.309
620 HD21 ASN 78 1HD2 ASN 78 10.432 -20.339 5.733
621 HD22 ASN 78 2HD2 ASN 78 10.433 -21.919 5.032
622 HA PRO 79 HA PRO 79 6.373 -16.008 8.780
623 HB2 PRO 79 2HB PRO 79 8.377 -15.280 10.525
624 HB3 PRO 79 1HB PRO 79 7.053 -16.371 10.987
625 HG2 PRO 79 2HG PRO 79 9.861 -17.059 10.176
626 HG3 PRO 79 1HG PRO 79 8.870 -17.743 11.484
627 HD2 PRO 79 2HD PRO 79 9.198 -19.006 9.084
628 HD3 PRO 79 1HD PRO 79 7.717 -19.166 10.053
629 H LEU 80 H LEU 80 6.734 -14.115 7.691
630 HA LEU 80 HA LEU 80 8.644 -14.254 5.540
631 HB2 LEU 80 2HB LEU 80 6.544 -12.147 6.135
632 HB3 LEU 80 1HB LEU 80 7.416 -12.335 4.615
633 HG LEU 80 HG LEU 80 5.391 -14.282 5.798
634 HD11 LEU 80 1HD1 LEU 80 4.367 -12.295 4.869
635 HD12 LEU 80 2HD1 LEU 80 4.028 -13.690 3.848
636 HD13 LEU 80 3HD1 LEU 80 5.243 -12.508 3.351
637 HD21 LEU 80 3HD2 LEU 80 5.623 -15.595 3.721
638 HD22 LEU 80 1HD2 LEU 80 7.127 -15.566 4.638
639 HD23 LEU 80 2HD2 LEU 80 6.954 -14.557 3.200
640 H LYS 81 H LYS 81 8.801 -12.756 8.603
641 HA LYS 81 HA LYS 81 10.492 -10.538 7.836
642 HB2 LYS 81 2HB LYS 81 9.201 -10.475 9.984
643 HB3 LYS 81 1HB LYS 81 10.178 -11.809 10.594
644 HG2 LYS 81 2HG LYS 81 12.223 -10.380 10.365
645 HG3 LYS 81 1HG LYS 81 11.199 -9.036 9.847
646 HD2 LYS 81 2HD LYS 81 10.048 -9.070 12.039
647 HD3 LYS 81 1HD LYS 81 11.045 -10.437 12.548
648 HE2 LYS 81 2HE LYS 81 13.069 -8.994 12.305
649 HE3 LYS 81 1HE LYS 81 12.021 -7.631 11.907
650 HZ1 LYS 81 3HZ LYS 81 11.973 -9.151 14.457
651 HZ2 LYS 81 1HZ LYS 81 11.002 -7.821 14.084
652 HZ3 LYS 81 2HZ LYS 81 12.674 -7.632 14.239
653 H ILE 82 H ILE 82 12.106 -11.340 6.610
654 HA ILE 82 HA ILE 82 13.848 -13.530 7.508
655 HB ILE 82 HB ILE 82 14.836 -13.367 5.236
656 HG12 ILE 82 2HG1 ILE 82 12.844 -11.089 4.723
657 HG13 ILE 82 1HG1 ILE 82 14.582 -10.883 4.913
658 HG21 ILE 82 1HG2 ILE 82 12.858 -14.106 3.940
659 HG22 ILE 82 2HG2 ILE 82 11.790 -13.443 5.180
660 HG23 ILE 82 3HG2 ILE 82 12.855 -14.798 5.563
661 HD11 ILE 82 3HD1 ILE 82 13.936 -10.801 2.580
662 HD12 ILE 82 1HD1 ILE 82 13.224 -12.411 2.691
663 HD13 ILE 82 2HD1 ILE 82 14.966 -12.198 2.889
664 H ARG 83 H ARG 83 16.262 -13.033 6.772
665 HA ARG 83 HA ARG 83 17.352 -11.085 8.517
666 HB2 ARG 83 2HB ARG 83 19.538 -11.742 7.592
667 HB3 ARG 83 1HB ARG 83 18.558 -13.164 7.929
668 HG2 ARG 83 2HG ARG 83 18.001 -13.309 5.478
669 HG3 ARG 83 1HG ARG 83 19.084 -11.943 5.188
670 HD2 ARG 83 2HD ARG 83 19.866 -14.661 6.303
671 HD3 ARG 83 1HD ARG 83 20.225 -14.049 4.684
672 HE ARG 83 HE ARG 83 21.324 -12.188 6.331
673 HH11 ARG 83 1HH1 ARG 83 21.740 -15.667 6.069
674 HH12 ARG 83 2HH1 ARG 83 23.374 -15.630 6.649
675 HH21 ARG 83 1HH2 ARG 83 23.438 -12.154 7.117
676 HH22 ARG 83 2HH2 ARG 83 24.339 -13.632 7.246
677 H LEU 84 H LEU 84 18.507 -9.180 8.016
678 HA LEU 84 HA LEU 84 17.413 -7.601 5.853
679 HB2 LEU 84 2HB LEU 84 19.551 -6.841 7.875
680 HB3 LEU 84 1HB LEU 84 18.627 -5.735 6.864
681 HG LEU 84 HG LEU 84 17.504 -7.439 9.129
682 HD11 LEU 84 1HD1 LEU 84 18.874 -5.618 9.963
683 HD12 LEU 84 2HD1 LEU 84 17.175 -5.305 10.305
684 HD13 LEU 84 3HD1 LEU 84 17.981 -4.451 8.984
685 HD21 LEU 84 3HD2 LEU 84 15.820 -7.163 7.369
686 HD22 LEU 84 1HD2 LEU 84 16.061 -5.412 7.381
687 HD23 LEU 84 2HD2 LEU 84 15.386 -6.228 8.795
688 H THR 85 H THR 85 19.275 -5.993 4.901
689 HA THR 85 HA THR 85 20.502 -7.699 2.938
690 HB THR 85 HB THR 85 21.086 -5.488 1.828
691 HG1 THR 85 HG1 THR 85 20.253 -3.599 2.781
692 HG21 THR 85 3HG2 THR 85 18.955 -6.607 1.280
693 HG22 THR 85 1HG2 THR 85 18.735 -4.858 1.313
694 HG23 THR 85 2HG2 THR 85 18.178 -5.841 2.669
695 H ARG 86 H ARG 86 22.069 -8.744 4.367
696 HA ARG 86 HA ARG 86 24.678 -7.372 4.348
697 HB2 ARG 86 2HB ARG 86 23.644 -8.985 6.730
698 HB3 ARG 86 1HB ARG 86 25.291 -8.388 6.550
699 HG2 ARG 86 2HG ARG 86 24.421 -6.053 6.666
700 HG3 ARG 86 1HG ARG 86 22.793 -6.696 6.919
701 HD2 ARG 86 2HD ARG 86 25.205 -7.037 8.741
702 HD3 ARG 86 1HD ARG 86 23.741 -6.112 9.080
703 HE ARG 86 HE ARG 86 22.538 -8.325 8.973
704 HH11 ARG 86 1HH1 ARG 86 25.939 -8.231 9.899
705 HH12 ARG 86 2HH1 ARG 86 25.850 -9.700 10.812
706 HH21 ARG 86 1HH2 ARG 86 22.466 -10.274 10.170
707 HH22 ARG 86 2HH2 ARG 86 23.896 -10.855 10.960
708 H GLU 87 H GLU 87 26.139 -8.661 3.363
709 HA GLU 87 HA GLU 87 25.544 -11.422 2.699
710 HB2 GLU 87 2HB GLU 87 28.058 -9.797 2.100
711 HB3 GLU 87 1HB GLU 87 27.600 -11.332 1.360
712 HG2 GLU 87 2HG GLU 87 25.593 -10.205 0.377
713 HG3 GLU 87 1HG GLU 87 26.161 -8.675 1.045
714 H ALA 88 H ALA 88 25.738 -12.770 4.400
715 HA ALA 88 HA ALA 88 28.328 -13.444 5.463
716 HB1 ALA 88 3HB ALA 88 27.737 -11.584 6.990
717 HB2 ALA 88 1HB ALA 88 27.749 -13.122 7.856
718 HB3 ALA 88 2HB ALA 88 26.213 -12.380 7.391
719 HA PRO 89 HA PRO 89 26.486 -17.555 5.354
720 HB2 PRO 89 2HB PRO 89 27.914 -17.972 7.993
721 HB3 PRO 89 1HB PRO 89 27.909 -18.997 6.539
722 HG2 PRO 89 2HG PRO 89 30.019 -17.481 7.031
723 HG3 PRO 89 1HG PRO 89 29.383 -17.586 5.371
724 HD2 PRO 89 2HD PRO 89 29.063 -15.353 7.372
725 HD3 PRO 89 1HD PRO 89 29.332 -15.267 5.613
Start of MODEL 6
1 H1 HIS 1 1H HIS 1 -3.560 -29.920 10.531
2 H2 HIS 1 2H HIS 1 -5.060 -30.324 11.196
3 H3 HIS 1 3H HIS 1 -3.688 -30.253 12.185
4 HA HIS 1 HA HIS 1 -5.137 -28.328 12.460
5 HB2 HIS 1 2HB HIS 1 -3.379 -26.612 12.331
6 HB3 HIS 1 1HB HIS 1 -2.691 -28.131 12.891
7 HD1 HIS 1 HD1 HIS 1 -1.968 -25.440 10.677
8 HD2 HIS 1 HD2 HIS 1 -1.328 -29.552 10.577
9 HE1 HIS 1 HE1 HIS 1 -0.169 -25.802 8.968
10 HE2 HIS 1 HE2 HIS 1 0.149 -28.293 8.864
11 H HIS 2 H HIS 2 -6.397 -26.743 11.582
12 HA HIS 2 HA HIS 2 -6.141 -26.181 8.685
13 HB2 HIS 2 2HB HIS 2 -8.619 -26.285 10.434
14 HB3 HIS 2 1HB HIS 2 -8.600 -25.316 8.964
15 HD1 HIS 2 HD1 HIS 2 -9.008 -26.521 6.792
16 HD2 HIS 2 HD2 HIS 2 -8.309 -29.146 9.942
17 HE1 HIS 2 HE1 HIS 2 -9.473 -28.813 5.879
18 HE2 HIS 2 HE2 HIS 2 -9.017 -30.388 7.788
19 H HIS 3 H HIS 3 -4.370 -24.891 9.583
20 HA HIS 3 HA HIS 3 -5.099 -22.161 9.398
21 HB2 HIS 3 2HB HIS 3 -5.487 -22.640 11.911
22 HB3 HIS 3 1HB HIS 3 -3.744 -22.846 12.050
23 HD1 HIS 3 HD1 HIS 3 -2.551 -20.746 12.698
24 HD2 HIS 3 HD2 HIS 3 -6.119 -19.935 10.726
25 HE1 HIS 3 HE1 HIS 3 -2.784 -18.253 12.728
26 HE2 HIS 3 HE2 HIS 3 -4.885 -17.784 11.441
27 H HIS 4 H HIS 4 -3.732 -22.125 7.672
28 HA HIS 4 HA HIS 4 -0.915 -21.803 8.199
29 HB2 HIS 4 2HB HIS 4 -0.881 -24.227 7.915
30 HB3 HIS 4 1HB HIS 4 -1.847 -24.122 6.449
31 HD1 HIS 4 HD1 HIS 4 -0.512 -24.352 4.378
32 HD2 HIS 4 HD2 HIS 4 1.760 -22.740 7.462
33 HE1 HIS 4 HE1 HIS 4 1.784 -24.032 3.423
34 HE2 HIS 4 HE2 HIS 4 3.185 -23.334 5.387
35 H HIS 5 H HIS 5 -0.016 -20.413 6.795
36 HA HIS 5 HA HIS 5 -0.677 -20.108 4.063
37 HB2 HIS 5 2HB HIS 5 -1.642 -17.825 4.080
38 HB3 HIS 5 1HB HIS 5 -2.706 -18.958 4.903
39 HD1 HIS 5 HD1 HIS 5 -1.899 -15.653 5.209
40 HD2 HIS 5 HD2 HIS 5 -1.791 -18.768 7.959
41 HE1 HIS 5 HE1 HIS 5 -2.034 -14.565 7.458
42 HE2 HIS 5 HE2 HIS 5 -2.221 -16.477 9.080
43 H HIS 6 H HIS 6 0.774 -18.729 3.003
44 HA HIS 6 HA HIS 6 2.786 -17.272 4.624
45 HB2 HIS 6 2HB HIS 6 3.238 -19.099 2.244
46 HB3 HIS 6 1HB HIS 6 4.355 -17.776 2.551
47 HD1 HIS 6 HD1 HIS 6 6.041 -18.068 4.399
48 HD2 HIS 6 HD2 HIS 6 3.287 -21.176 4.232
49 HE1 HIS 6 HE1 HIS 6 6.962 -19.864 5.876
50 HE2 HIS 6 HE2 HIS 6 5.413 -21.807 5.557
51 H SER 7 H SER 7 3.515 -15.357 3.730
52 HA SER 7 HA SER 7 2.846 -14.416 1.120
53 HB2 SER 7 2HB SER 7 0.643 -14.145 2.456
54 HB3 SER 7 1HB SER 7 1.482 -12.923 3.409
55 HG SER 7 HG SER 7 0.869 -12.923 0.657
56 H HIS 8 H HIS 8 3.390 -11.770 1.261
57 HA HIS 8 HA HIS 8 6.057 -11.526 2.277
58 HB2 HIS 8 2HB HIS 8 5.158 -10.123 0.378
59 HB3 HIS 8 1HB HIS 8 4.154 -9.254 1.534
60 HD1 HIS 8 HD1 HIS 8 5.463 -7.758 3.331
61 HD2 HIS 8 HD2 HIS 8 7.782 -9.240 0.216
62 HE1 HIS 8 HE1 HIS 8 7.605 -6.456 3.400
63 HE2 HIS 8 HE2 HIS 8 8.843 -7.172 1.336
64 H MET 9 H MET 9 6.765 -10.507 4.156
65 HA MET 9 HA MET 9 5.454 -11.154 6.463
66 HB2 MET 9 2HB MET 9 7.157 -9.795 7.665
67 HB3 MET 9 1HB MET 9 7.866 -10.775 6.394
68 HG2 MET 9 2HG MET 9 7.946 -8.770 4.928
69 HG3 MET 9 1HG MET 9 7.323 -7.805 6.269
70 HE1 MET 9 3HE MET 9 10.002 -7.118 4.672
71 HE2 MET 9 1HE MET 9 11.099 -6.702 5.993
72 HE3 MET 9 2HE MET 9 9.432 -6.137 6.026
73 H VAL 10 H VAL 10 4.004 -10.290 7.787
74 HA VAL 10 HA VAL 10 2.352 -8.104 7.156
75 HB VAL 10 HB VAL 10 1.399 -8.384 9.439
76 HG11 VAL 10 1HG1 VAL 10 0.597 -9.876 7.675
77 HG12 VAL 10 2HG1 VAL 10 0.613 -10.709 9.229
78 HG13 VAL 10 3HG1 VAL 10 1.878 -11.037 8.039
79 HG21 VAL 10 3HG2 VAL 10 3.691 -10.332 9.879
80 HG22 VAL 10 1HG2 VAL 10 2.311 -10.131 10.960
81 HG23 VAL 10 2HG2 VAL 10 3.434 -8.799 10.714
82 H GLY 11 H GLY 11 2.138 -6.053 8.158
83 HA2 GLY 11 2HA GLY 11 2.792 -4.226 9.456
84 HA3 GLY 11 1HA GLY 11 4.221 -5.107 9.985
85 H ASP 12 H ASP 12 3.702 -5.191 6.564
86 HA ASP 12 HA ASP 12 6.231 -3.977 6.021
87 HB2 ASP 12 2HB ASP 12 5.110 -5.634 4.499
88 HB3 ASP 12 1HB ASP 12 3.912 -4.422 4.077
89 H THR 13 H THR 13 6.680 -1.846 6.232
90 HA THR 13 HA THR 13 4.633 0.135 6.552
91 HB THR 13 HB THR 13 7.663 0.453 6.330
92 HG1 THR 13 HG1 THR 13 6.250 -0.642 8.219
93 HG21 THR 13 3HG2 THR 13 6.552 2.597 5.827
94 HG22 THR 13 1HG2 THR 13 7.315 2.669 7.416
95 HG23 THR 13 2HG2 THR 13 5.569 2.453 7.287
96 H VAL 14 H VAL 14 3.564 0.979 4.887
97 HA VAL 14 HA VAL 14 4.928 1.568 2.335
98 HB VAL 14 HB VAL 14 3.023 0.684 1.026
99 HG11 VAL 14 1HG1 VAL 14 4.972 -0.770 1.349
100 HG12 VAL 14 2HG1 VAL 14 3.492 -1.718 1.235
101 HG13 VAL 14 3HG1 VAL 14 4.249 -1.451 2.808
102 HG21 VAL 14 3HG2 VAL 14 1.232 0.883 2.696
103 HG22 VAL 14 1HG2 VAL 14 1.956 -0.406 3.662
104 HG23 VAL 14 2HG2 VAL 14 1.299 -0.759 2.061
105 H TRP 15 H TRP 15 3.683 2.984 0.949
106 HA TRP 15 HA TRP 15 1.712 4.716 2.315
107 HB2 TRP 15 2HB TRP 15 3.871 5.508 0.296
108 HB3 TRP 15 1HB TRP 15 2.605 6.585 0.881
109 HD1 TRP 15 HD1 TRP 15 3.042 5.470 4.043
110 HE1 TRP 15 HE1 TRP 15 4.990 6.513 5.351
111 HE3 TRP 15 HE3 TRP 15 5.817 7.218 0.120
112 HZ2 TRP 15 HZ2 TRP 15 7.381 7.896 4.809
113 HZ3 TRP 15 HZ3 TRP 15 7.919 8.399 0.603
114 HH2 TRP 15 HH2 TRP 15 8.688 8.732 2.898
115 H VAL 16 H VAL 16 -0.053 5.360 1.028
116 HA VAL 16 HA VAL 16 -0.512 3.705 -1.386
117 HB VAL 16 HB VAL 16 -2.595 4.956 0.482
118 HG11 VAL 16 1HG1 VAL 16 -2.993 3.062 -1.869
119 HG12 VAL 16 2HG1 VAL 16 -3.430 4.771 -1.826
120 HG13 VAL 16 3HG1 VAL 16 -4.261 3.625 -0.775
121 HG21 VAL 16 3HG2 VAL 16 -3.055 2.650 1.245
122 HG22 VAL 16 1HG2 VAL 16 -1.384 3.113 1.581
123 HG23 VAL 16 2HG2 VAL 16 -1.747 2.043 0.224
124 H ARG 17 H ARG 17 0.030 4.899 -3.063
125 HA ARG 17 HA ARG 17 -0.509 7.752 -3.332
126 HB2 ARG 17 2HB ARG 17 1.651 6.980 -4.044
127 HB3 ARG 17 1HB ARG 17 0.960 5.666 -4.989
128 HG2 ARG 17 2HG ARG 17 0.097 7.239 -6.629
129 HG3 ARG 17 1HG ARG 17 0.650 8.608 -5.661
130 HD2 ARG 17 2HD ARG 17 2.492 6.488 -6.816
131 HD3 ARG 17 1HD ARG 17 2.143 8.036 -7.598
132 HE ARG 17 HE ARG 17 2.969 8.861 -5.206
133 HH11 ARG 17 1HH1 ARG 17 4.445 6.470 -7.356
134 HH12 ARG 17 2HH1 ARG 17 6.052 6.812 -6.804
135 HH21 ARG 17 1HH2 ARG 17 5.079 9.327 -4.546
136 HH22 ARG 17 2HH2 ARG 17 6.409 8.436 -5.213
137 H ARG 18 H ARG 18 -2.058 8.633 -4.674
138 HA ARG 18 HA ARG 18 -3.573 6.959 -6.535
139 HB2 ARG 18 2HB ARG 18 -4.678 6.723 -4.283
140 HB3 ARG 18 1HB ARG 18 -4.937 8.464 -4.261
141 HG2 ARG 18 2HG ARG 18 -6.356 8.277 -6.275
142 HG3 ARG 18 1HG ARG 18 -6.111 6.527 -6.283
143 HD2 ARG 18 2HD ARG 18 -7.185 6.377 -4.057
144 HD3 ARG 18 1HD ARG 18 -7.443 8.128 -4.072
145 HE ARG 18 HE ARG 18 -8.695 7.453 -6.308
146 HH11 ARG 18 1HH1 ARG 18 -8.857 5.930 -3.130
147 HH12 ARG 18 2HH1 ARG 18 -10.491 5.383 -3.347
148 HH21 ARG 18 1HH2 ARG 18 -10.844 6.733 -6.575
149 HH22 ARG 18 2HH2 ARG 18 -11.616 5.839 -5.304
150 H HIS 19 H HIS 19 -4.343 8.118 -8.254
151 HA HIS 19 HA HIS 19 -3.484 10.736 -8.805
152 HB2 HIS 19 2HB HIS 19 -5.694 9.098 -10.114
153 HB3 HIS 19 1HB HIS 19 -5.098 10.627 -10.754
154 HD1 HIS 19 HD1 HIS 19 -4.760 7.228 -11.457
155 HD2 HIS 19 HD2 HIS 19 -1.993 10.293 -11.013
156 HE1 HIS 19 HE1 HIS 19 -2.698 6.448 -12.659
157 HE2 HIS 19 HE2 HIS 19 -1.122 8.404 -12.549
158 H GLN 20 H GLN 20 -4.192 12.591 -7.902
159 HA GLN 20 HA GLN 20 -6.649 13.043 -6.581
160 HB2 GLN 20 2HB GLN 20 -4.872 15.080 -8.010
161 HB3 GLN 20 1HB GLN 20 -6.105 15.459 -6.811
162 HG2 GLN 20 2HG GLN 20 -3.526 13.945 -6.336
163 HG3 GLN 20 1HG GLN 20 -3.898 15.588 -5.816
164 HE21 GLN 20 1HE2 GLN 20 -5.511 15.863 -4.161
165 HE22 GLN 20 2HE2 GLN 20 -5.831 14.605 -3.024
166 H THR 21 H THR 21 -5.543 13.836 -9.822
167 HA THR 21 HA THR 21 -8.132 13.215 -11.030
168 HB THR 21 HB THR 21 -6.660 15.845 -11.610
169 HG1 THR 21 HG1 THR 21 -8.749 15.224 -9.877
170 HG21 THR 21 3HG2 THR 21 -8.633 16.434 -12.975
171 HG22 THR 21 1HG2 THR 21 -9.333 14.845 -12.663
172 HG23 THR 21 2HG2 THR 21 -7.843 14.985 -13.600
173 H LYS 22 H LYS 22 -7.787 12.633 -13.372
174 HA LYS 22 HA LYS 22 -5.234 11.465 -13.941
175 HB2 LYS 22 2HB LYS 22 -7.596 11.987 -15.787
176 HB3 LYS 22 1HB LYS 22 -6.177 11.049 -16.241
177 HG2 LYS 22 2HG LYS 22 -6.717 9.418 -14.412
178 HG3 LYS 22 1HG LYS 22 -8.185 10.343 -14.072
179 HD2 LYS 22 2HD LYS 22 -8.759 8.444 -15.496
180 HD3 LYS 22 1HD LYS 22 -8.955 9.940 -16.414
181 HE2 LYS 22 2HE LYS 22 -6.598 9.513 -17.331
182 HE3 LYS 22 1HE LYS 22 -6.723 7.902 -16.625
183 HZ1 LYS 22 3HZ LYS 22 -8.698 7.522 -17.986
184 HZ2 LYS 22 1HZ LYS 22 -7.352 7.881 -18.943
185 HZ3 LYS 22 2HZ LYS 22 -8.541 9.054 -18.677
186 H ASN 23 H ASN 23 -6.702 14.533 -14.685
187 HA ASN 23 HA ASN 23 -4.762 15.523 -16.532
188 HB2 ASN 23 2HB ASN 23 -6.961 16.549 -16.422
189 HB3 ASN 23 1HB ASN 23 -6.764 16.930 -14.717
190 HD21 ASN 23 1HD2 ASN 23 -5.671 17.752 -17.969
191 HD22 ASN 23 2HD2 ASN 23 -5.116 19.338 -17.576
192 H LEU 24 H LEU 24 -5.035 15.533 -13.019
193 HA LEU 24 HA LEU 24 -2.594 17.109 -12.638
194 HB2 LEU 24 2HB LEU 24 -4.470 15.840 -10.596
195 HB3 LEU 24 1HB LEU 24 -3.135 16.918 -10.218
196 HG LEU 24 HG LEU 24 -5.650 17.675 -11.752
197 HD11 LEU 24 1HD1 LEU 24 -4.788 18.436 -8.941
198 HD12 LEU 24 2HD1 LEU 24 -6.091 17.325 -9.369
199 HD13 LEU 24 3HD1 LEU 24 -6.222 19.031 -9.786
200 HD21 LEU 24 3HD2 LEU 24 -3.304 19.423 -10.940
201 HD22 LEU 24 1HD2 LEU 24 -4.823 19.998 -11.634
202 HD23 LEU 24 2HD2 LEU 24 -3.758 18.968 -12.583
203 H GLU 25 H GLU 25 -1.076 16.200 -10.888
204 HA GLU 25 HA GLU 25 -0.244 13.489 -11.573
205 HB2 GLU 25 2HB GLU 25 1.013 15.516 -9.663
206 HB3 GLU 25 1HB GLU 25 1.742 13.998 -10.180
207 HG2 GLU 25 2HG GLU 25 1.691 14.890 -12.553
208 HG3 GLU 25 1HG GLU 25 1.179 16.436 -11.881
209 HA PRO 26 HA PRO 26 -2.026 11.538 -7.926
210 HB2 PRO 26 2HB PRO 26 -0.226 9.558 -7.355
211 HB3 PRO 26 1HB PRO 26 -1.248 9.518 -8.805
212 HG2 PRO 26 2HG PRO 26 1.608 10.414 -8.552
213 HG3 PRO 26 1HG PRO 26 0.872 9.329 -9.756
214 HD2 PRO 26 2HD PRO 26 1.325 11.937 -10.306
215 HD3 PRO 26 1HD PRO 26 -0.091 11.077 -10.956
216 H ARG 27 H ARG 27 -1.694 11.058 -5.639
217 HA ARG 27 HA ARG 27 0.544 12.352 -4.263
218 HB2 ARG 27 2HB ARG 27 -1.204 14.091 -4.521
219 HB3 ARG 27 1HB ARG 27 -2.389 13.031 -3.766
220 HG2 ARG 27 2HG ARG 27 -1.263 13.179 -1.634
221 HG3 ARG 27 1HG ARG 27 0.101 14.042 -2.356
222 HD2 ARG 27 2HD ARG 27 -2.756 15.068 -2.178
223 HD3 ARG 27 1HD ARG 27 -1.406 15.589 -1.163
224 HE ARG 27 HE ARG 27 -0.345 16.311 -3.359
225 HH11 ARG 27 1HH1 ARG 27 -3.848 16.395 -2.900
226 HH12 ARG 27 2HH1 ARG 27 -4.068 17.662 -4.066
227 HH21 ARG 27 1HH2 ARG 27 -0.672 17.932 -4.879
228 HH22 ARG 27 2HH2 ARG 27 -2.272 18.529 -5.183
229 H TRP 28 H TRP 28 1.055 11.307 -2.383
230 HA TRP 28 HA TRP 28 -0.305 8.751 -1.881
231 HB2 TRP 28 2HB TRP 28 1.783 8.110 -0.690
232 HB3 TRP 28 1HB TRP 28 2.092 8.600 -2.353
233 HD1 TRP 28 HD1 TRP 28 3.419 10.948 -2.716
234 HE1 TRP 28 HE1 TRP 28 4.980 12.274 -1.165
235 HE3 TRP 28 HE3 TRP 28 2.212 8.757 1.751
236 HZ2 TRP 28 HZ2 TRP 28 5.626 12.380 1.572
237 HZ3 TRP 28 HZ3 TRP 28 3.353 9.529 3.790
238 HH2 TRP 28 HH2 TRP 28 5.028 11.306 3.701
239 H LYS 29 H LYS 29 -0.519 7.971 0.316
240 HA LYS 29 HA LYS 29 -0.508 9.975 2.501
241 HB2 LYS 29 2HB LYS 29 -2.750 7.993 1.876
242 HB3 LYS 29 1HB LYS 29 -2.593 8.816 3.426
243 HG2 LYS 29 2HG LYS 29 -2.822 11.003 2.259
244 HG3 LYS 29 1HG LYS 29 -3.059 10.136 0.739
245 HD2 LYS 29 2HD LYS 29 -5.111 9.138 1.550
246 HD3 LYS 29 1HD LYS 29 -4.848 9.787 3.173
247 HE2 LYS 29 2HE LYS 29 -5.346 11.416 0.660
248 HE3 LYS 29 1HE LYS 29 -6.516 11.109 1.943
249 HZ1 LYS 29 3HZ LYS 29 -5.611 13.256 2.286
250 HZ2 LYS 29 1HZ LYS 29 -4.020 12.706 2.126
251 HZ3 LYS 29 2HZ LYS 29 -4.938 12.268 3.479
252 H GLY 30 H GLY 30 0.028 9.062 4.562
253 HA2 GLY 30 2HA GLY 30 0.275 6.289 5.064
254 HA3 GLY 30 1HA GLY 30 1.818 6.915 4.546
255 HA PRO 31 HA PRO 31 2.521 5.405 5.983
256 HB2 PRO 31 2HB PRO 31 3.496 4.230 8.218
257 HB3 PRO 31 1HB PRO 31 4.243 5.675 7.515
258 HG2 PRO 31 2HG PRO 31 2.581 5.426 9.957
259 HG3 PRO 31 1HG PRO 31 3.870 6.582 9.576
260 HD2 PRO 31 2HD PRO 31 1.044 7.014 9.369
261 HD3 PRO 31 1HD PRO 31 2.343 8.120 8.877
262 H TYR 32 H TYR 32 1.895 3.318 5.688
263 HA TYR 32 HA TYR 32 -0.390 2.186 7.207
264 HB2 TYR 32 2HB TYR 32 0.250 2.034 4.228
265 HB3 TYR 32 1HB TYR 32 -0.908 0.968 5.003
266 HD1 TYR 32 HD2 TYR 32 -0.236 4.543 4.164
267 HD2 TYR 32 HD1 TYR 32 -3.166 1.675 5.353
268 HE1 TYR 32 HE2 TYR 32 -2.018 6.189 3.758
269 HE2 TYR 32 HE1 TYR 32 -4.949 3.315 4.945
270 HH TYR 32 HH TYR 32 -4.406 6.257 3.286
271 H THR 33 H THR 33 -0.457 -0.340 6.714
272 HA THR 33 HA THR 33 2.220 -1.546 6.550
273 HB THR 33 HB THR 33 1.496 -3.054 8.571
274 HG1 THR 33 HG1 THR 33 0.185 -0.928 9.715
275 HG21 THR 33 3HG2 THR 33 2.322 -0.170 9.074
276 HG22 THR 33 1HG2 THR 33 3.409 -1.512 8.706
277 HG23 THR 33 2HG2 THR 33 2.497 -1.504 10.214
278 H VAL 34 H VAL 34 2.087 -3.058 4.958
279 HA VAL 34 HA VAL 34 -0.367 -4.330 4.179
280 HB VAL 34 HB VAL 34 2.446 -5.226 3.392
281 HG11 VAL 34 1HG1 VAL 34 0.703 -6.861 2.843
282 HG12 VAL 34 2HG1 VAL 34 1.368 -6.145 1.377
283 HG13 VAL 34 3HG1 VAL 34 -0.212 -5.628 1.970
284 HG21 VAL 34 3HG2 VAL 34 0.728 -3.154 1.998
285 HG22 VAL 34 1HG2 VAL 34 2.241 -3.819 1.383
286 HG23 VAL 34 2HG2 VAL 34 2.234 -2.858 2.862
287 H LEU 35 H LEU 35 -1.083 -6.346 4.593
288 HA LEU 35 HA LEU 35 0.241 -7.960 6.701
289 HB2 LEU 35 2HB LEU 35 -2.716 -7.776 5.990
290 HB3 LEU 35 1HB LEU 35 -2.032 -8.737 7.293
291 HG LEU 35 HG LEU 35 -1.986 -5.701 7.150
292 HD11 LEU 35 1HD1 LEU 35 -3.623 -5.745 8.966
293 HD12 LEU 35 2HD1 LEU 35 -3.677 -7.508 8.905
294 HD13 LEU 35 3HD1 LEU 35 -4.254 -6.558 7.534
295 HD21 LEU 35 3HD2 LEU 35 -1.071 -7.553 9.374
296 HD22 LEU 35 1HD2 LEU 35 -1.135 -5.790 9.451
297 HD23 LEU 35 2HD2 LEU 35 -0.031 -6.577 8.332
298 H LEU 36 H LEU 36 -1.694 -8.069 3.717
299 HA LEU 36 HA LEU 36 -0.666 -10.793 3.118
300 HB2 LEU 36 2HB LEU 36 -3.002 -11.032 3.848
301 HB3 LEU 36 1HB LEU 36 -3.512 -9.760 2.758
302 HG LEU 36 HG LEU 36 -2.886 -11.239 0.813
303 HD11 LEU 36 1HD1 LEU 36 -2.484 -13.364 2.932
304 HD12 LEU 36 2HD1 LEU 36 -1.249 -12.682 1.873
305 HD13 LEU 36 3HD1 LEU 36 -2.554 -13.647 1.190
306 HD21 LEU 36 3HD2 LEU 36 -5.214 -11.067 1.528
307 HD22 LEU 36 1HD2 LEU 36 -4.976 -12.360 2.707
308 HD23 LEU 36 2HD2 LEU 36 -4.864 -12.705 0.979
309 H THR 37 H THR 37 -0.189 -11.154 0.963
310 HA THR 37 HA THR 37 -0.535 -8.953 -0.980
311 HB THR 37 HB THR 37 1.720 -9.499 -1.943
312 HG1 THR 37 HG1 THR 37 1.624 -11.632 -0.482
313 HG21 THR 37 3HG2 THR 37 3.101 -8.410 -0.222
314 HG22 THR 37 1HG2 THR 37 1.840 -8.694 0.981
315 HG23 THR 37 2HG2 THR 37 1.540 -7.607 -0.374
316 H THR 38 H THR 38 -1.482 -9.621 -2.789
317 HA THR 38 HA THR 38 -1.316 -12.435 -3.699
318 HB THR 38 HB THR 38 -3.672 -12.094 -4.628
319 HG1 THR 38 HG1 THR 38 -3.468 -9.682 -4.317
320 HG21 THR 38 3HG2 THR 38 -4.877 -12.415 -2.489
321 HG22 THR 38 1HG2 THR 38 -3.467 -11.861 -1.595
322 HG23 THR 38 2HG2 THR 38 -3.390 -13.368 -2.520
323 HA PRO 39 HA PRO 39 0.225 -11.049 -7.680
324 HB2 PRO 39 2HB PRO 39 -2.354 -12.069 -8.905
325 HB3 PRO 39 1HB PRO 39 -0.680 -12.312 -9.451
326 HG2 PRO 39 2HG PRO 39 -1.908 -14.254 -8.158
327 HG3 PRO 39 1HG PRO 39 -0.209 -13.880 -7.776
328 HD2 PRO 39 2HD PRO 39 -2.684 -13.241 -6.201
329 HD3 PRO 39 1HD PRO 39 -1.049 -13.651 -5.628
330 H THR 40 H THR 40 0.340 -8.955 -8.055
331 HA THR 40 HA THR 40 0.013 -6.842 -8.668
332 HB THR 40 HB THR 40 -1.610 -6.253 -10.402
333 HG1 THR 40 HG1 THR 40 -3.187 -8.020 -9.332
334 HG21 THR 40 3HG2 THR 40 0.403 -7.511 -11.115
335 HG22 THR 40 1HG2 THR 40 -0.987 -7.873 -12.141
336 HG23 THR 40 2HG2 THR 40 -0.475 -9.029 -10.911
337 H ALA 41 H ALA 41 -1.595 -7.975 -6.200
338 HA ALA 41 HA ALA 41 -3.000 -5.460 -5.618
339 HB1 ALA 41 3HB ALA 41 -4.740 -6.828 -6.701
340 HB2 ALA 41 1HB ALA 41 -5.108 -6.606 -4.989
341 HB3 ALA 41 2HB ALA 41 -4.447 -8.141 -5.562
342 H LEU 42 H LEU 42 -2.506 -4.900 -3.566
343 HA LEU 42 HA LEU 42 -1.440 -6.956 -1.729
344 HB2 LEU 42 2HB LEU 42 -0.843 -3.966 -1.685
345 HB3 LEU 42 1HB LEU 42 -0.047 -5.223 -0.753
346 HG LEU 42 HG LEU 42 0.176 -4.762 -3.750
347 HD11 LEU 42 1HD1 LEU 42 2.539 -4.298 -3.300
348 HD12 LEU 42 2HD1 LEU 42 2.268 -4.529 -1.569
349 HD13 LEU 42 3HD1 LEU 42 1.487 -3.194 -2.418
350 HD21 LEU 42 3HD2 LEU 42 1.781 -6.621 -3.826
351 HD22 LEU 42 1HD2 LEU 42 0.175 -7.170 -3.354
352 HD23 LEU 42 2HD2 LEU 42 1.440 -6.994 -2.136
353 H LYS 43 H LYS 43 -2.663 -7.352 0.024
354 HA LYS 43 HA LYS 43 -4.838 -5.569 0.783
355 HB2 LYS 43 2HB LYS 43 -5.296 -7.972 0.823
356 HB3 LYS 43 1HB LYS 43 -3.943 -8.252 1.916
357 HG2 LYS 43 2HG LYS 43 -5.065 -7.043 3.706
358 HG3 LYS 43 1HG LYS 43 -6.391 -6.596 2.627
359 HD2 LYS 43 2HD LYS 43 -6.983 -9.005 2.399
360 HD3 LYS 43 1HD LYS 43 -5.670 -9.419 3.505
361 HE2 LYS 43 2HE LYS 43 -6.758 -8.124 5.295
362 HE3 LYS 43 1HE LYS 43 -8.060 -7.677 4.188
363 HZ1 LYS 43 3HZ LYS 43 -7.408 -10.427 5.113
364 HZ2 LYS 43 1HZ LYS 43 -8.603 -10.045 3.976
365 HZ3 LYS 43 2HZ LYS 43 -8.743 -9.500 5.570
366 H VAL 44 H VAL 44 -4.327 -3.885 1.911
367 HA VAL 44 HA VAL 44 -2.111 -3.860 3.877
368 HB VAL 44 HB VAL 44 -3.420 -1.451 2.519
369 HG11 VAL 44 1HG1 VAL 44 -2.207 -0.947 4.583
370 HG12 VAL 44 2HG1 VAL 44 -1.389 -0.248 3.185
371 HG13 VAL 44 3HG1 VAL 44 -0.753 -1.714 3.936
372 HG21 VAL 44 3HG2 VAL 44 -2.487 -2.823 0.730
373 HG22 VAL 44 1HG2 VAL 44 -0.939 -2.913 1.566
374 HG23 VAL 44 2HG2 VAL 44 -1.512 -1.367 0.942
375 H ASP 45 H ASP 45 -2.588 -3.021 5.983
376 HA ASP 45 HA ASP 45 -5.285 -3.046 6.898
377 HB2 ASP 45 2HB ASP 45 -3.343 -3.586 8.362
378 HB3 ASP 45 1HB ASP 45 -2.822 -1.905 8.287
379 H GLY 46 H GLY 46 -6.721 -1.386 7.179
380 HA2 GLY 46 2HA GLY 46 -7.405 0.888 7.317
381 HA3 GLY 46 1HA GLY 46 -5.905 1.388 6.546
382 H ILE 47 H ILE 47 -6.716 -1.182 4.776
383 HA ILE 47 HA ILE 47 -8.170 0.396 2.740
384 HB ILE 47 HB ILE 47 -6.340 -2.031 2.499
385 HG12 ILE 47 2HG1 ILE 47 -5.067 -0.012 2.928
386 HG13 ILE 47 1HG1 ILE 47 -4.848 -0.439 1.238
387 HG21 ILE 47 1HG2 ILE 47 -8.098 -2.220 0.799
388 HG22 ILE 47 2HG2 ILE 47 -6.538 -1.866 0.063
389 HG23 ILE 47 3HG2 ILE 47 -7.740 -0.587 0.227
390 HD11 ILE 47 3HD1 ILE 47 -5.078 1.943 1.477
391 HD12 ILE 47 1HD1 ILE 47 -6.614 1.755 2.325
392 HD13 ILE 47 2HD1 ILE 47 -6.485 1.310 0.622
393 H ALA 48 H ALA 48 -9.899 -0.573 1.575
394 HA ALA 48 HA ALA 48 -11.807 -1.926 3.087
395 HB1 ALA 48 3HB ALA 48 -11.688 -1.632 0.069
396 HB2 ALA 48 1HB ALA 48 -12.370 -0.467 1.201
397 HB3 ALA 48 2HB ALA 48 -13.127 -2.047 1.006
398 H ALA 49 H ALA 49 -9.874 -3.225 0.336
399 HA ALA 49 HA ALA 49 -9.730 -5.820 1.678
400 HB1 ALA 49 3HB ALA 49 -10.877 -5.585 -1.121
401 HB2 ALA 49 1HB ALA 49 -11.790 -5.987 0.334
402 HB3 ALA 49 2HB ALA 49 -10.543 -7.088 -0.255
403 H TRP 50 H TRP 50 -8.977 -4.249 -1.498
404 HA TRP 50 HA TRP 50 -6.130 -4.928 -1.141
405 HB2 TRP 50 2HB TRP 50 -7.776 -5.780 -3.561
406 HB3 TRP 50 1HB TRP 50 -6.016 -5.723 -3.571
407 HD1 TRP 50 HD1 TRP 50 -4.745 -7.532 -1.903
408 HE1 TRP 50 HE1 TRP 50 -5.473 -9.891 -1.190
409 HE3 TRP 50 HE3 TRP 50 -9.726 -7.224 -3.019
410 HZ2 TRP 50 HZ2 TRP 50 -7.835 -11.421 -1.100
411 HZ3 TRP 50 HZ3 TRP 50 -11.155 -9.181 -2.593
412 HH2 TRP 50 HH2 TRP 50 -10.229 -11.241 -1.652
413 H ILE 51 H ILE 51 -4.703 -3.551 -2.189
414 HA ILE 51 HA ILE 51 -5.772 -1.466 -4.018
415 HB ILE 51 HB ILE 51 -3.463 -1.279 -2.017
416 HG12 ILE 51 2HG1 ILE 51 -5.702 -0.733 -1.108
417 HG13 ILE 51 1HG1 ILE 51 -4.649 0.671 -1.116
418 HG21 ILE 51 1HG2 ILE 51 -2.959 0.966 -2.930
419 HG22 ILE 51 2HG2 ILE 51 -4.110 0.686 -4.240
420 HG23 ILE 51 3HG2 ILE 51 -2.664 -0.317 -4.103
421 HD11 ILE 51 3HD1 ILE 51 -6.911 1.250 -1.752
422 HD12 ILE 51 1HD1 ILE 51 -6.859 0.099 -3.087
423 HD13 ILE 51 2HD1 ILE 51 -5.808 1.517 -3.100
424 H HIS 52 H HIS 52 -4.944 -1.602 -6.058
425 HA HIS 52 HA HIS 52 -3.318 -3.726 -6.909
426 HB2 HIS 52 2HB HIS 52 -4.942 -2.432 -8.345
427 HB3 HIS 52 1HB HIS 52 -3.798 -1.099 -8.378
428 HD1 HIS 52 HD1 HIS 52 -1.525 -1.560 -9.700
429 HD2 HIS 52 HD2 HIS 52 -4.489 -4.429 -10.206
430 HE1 HIS 52 HE1 HIS 52 -0.815 -2.915 -11.686
431 HE2 HIS 52 HE2 HIS 52 -2.698 -4.531 -12.076
432 H ALA 53 H ALA 53 -1.143 -3.847 -7.452
433 HA ALA 53 HA ALA 53 0.488 -2.950 -5.426
434 HB1 ALA 53 3HB ALA 53 1.405 -4.100 -8.081
435 HB2 ALA 53 1HB ALA 53 0.840 -5.034 -6.693
436 HB3 ALA 53 2HB ALA 53 2.322 -4.089 -6.573
437 H ALA 54 H ALA 54 0.182 -1.458 -8.622
438 HA ALA 54 HA ALA 54 2.604 0.021 -8.575
439 HB1 ALA 54 3HB ALA 54 1.705 1.263 -10.480
440 HB2 ALA 54 1HB ALA 54 0.092 0.623 -10.157
441 HB3 ALA 54 2HB ALA 54 1.388 -0.465 -10.652
442 H HIS 55 H HIS 55 -0.565 0.688 -7.217
443 HA HIS 55 HA HIS 55 -0.193 3.469 -6.628
444 HB2 HIS 55 2HB HIS 55 -1.934 1.388 -5.257
445 HB3 HIS 55 1HB HIS 55 -1.985 3.101 -4.883
446 HD1 HIS 55 HD1 HIS 55 -2.867 4.675 -6.873
447 HD2 HIS 55 HD2 HIS 55 -3.635 0.607 -7.244
448 HE1 HIS 55 HE1 HIS 55 -4.765 4.492 -8.507
449 HE2 HIS 55 HE2 HIS 55 -5.348 2.051 -8.545
450 H VAL 56 H VAL 56 1.091 0.578 -5.206
451 HA VAL 56 HA VAL 56 1.377 1.772 -2.527
452 HB VAL 56 HB VAL 56 1.903 -1.096 -3.446
453 HG11 VAL 56 1HG1 VAL 56 1.921 -1.676 -1.054
454 HG12 VAL 56 2HG1 VAL 56 1.746 0.025 -0.624
455 HG13 VAL 56 3HG1 VAL 56 3.204 -0.532 -1.447
456 HG21 VAL 56 3HG2 VAL 56 -0.222 -1.700 -2.382
457 HG22 VAL 56 1HG2 VAL 56 -0.478 -0.519 -3.668
458 HG23 VAL 56 2HG2 VAL 56 -0.524 -0.008 -1.978
459 H LYS 57 H LYS 57 3.248 2.676 -1.970
460 HA LYS 57 HA LYS 57 5.811 1.797 -3.175
461 HB2 LYS 57 2HB LYS 57 5.532 4.191 -3.375
462 HB3 LYS 57 1HB LYS 57 4.997 4.347 -1.703
463 HG2 LYS 57 2HG LYS 57 7.269 3.683 -0.932
464 HG3 LYS 57 1HG LYS 57 7.800 3.586 -2.609
465 HD2 LYS 57 2HD LYS 57 6.784 6.113 -1.256
466 HD3 LYS 57 1HD LYS 57 8.485 5.693 -1.457
467 HE2 LYS 57 2HE LYS 57 7.973 5.575 -3.982
468 HE3 LYS 57 1HE LYS 57 6.465 6.403 -3.590
469 HZ1 LYS 57 3HZ LYS 57 9.191 7.402 -2.955
470 HZ2 LYS 57 1HZ LYS 57 7.745 8.214 -2.642
471 HZ3 LYS 57 2HZ LYS 57 8.235 7.940 -4.237
472 H ALA 58 H ALA 58 7.036 0.454 -1.920
473 HA ALA 58 HA ALA 58 6.488 0.035 0.883
474 HB1 ALA 58 3HB ALA 58 8.801 -0.960 -0.818
475 HB2 ALA 58 1HB ALA 58 7.290 -1.818 -0.514
476 HB3 ALA 58 2HB ALA 58 8.407 -1.507 0.814
477 H ALA 59 H ALA 59 6.957 1.643 2.222
478 HA ALA 59 HA ALA 59 9.302 3.375 1.907
479 HB1 ALA 59 3HB ALA 59 7.016 3.419 3.924
480 HB2 ALA 59 1HB ALA 59 7.139 4.406 2.466
481 HB3 ALA 59 2HB ALA 59 8.284 4.643 3.788
482 H ASP 60 H ASP 60 11.183 2.706 2.797
483 HA ASP 60 HA ASP 60 11.623 0.580 4.541
484 HB2 ASP 60 2HB ASP 60 13.358 1.692 3.121
485 HB3 ASP 60 1HB ASP 60 13.341 3.076 4.201
486 HA PRO 61 HA PRO 61 9.727 2.241 8.375
487 HB2 PRO 61 2HB PRO 61 11.436 0.026 9.539
488 HB3 PRO 61 1HB PRO 61 9.724 0.406 9.839
489 HG2 PRO 61 2HG PRO 61 10.387 -1.628 8.275
490 HG3 PRO 61 1HG PRO 61 9.008 -0.582 7.865
491 HD2 PRO 61 2HD PRO 61 11.743 -0.667 6.637
492 HD3 PRO 61 1HD PRO 61 10.172 -0.339 5.876
493 H GLY 62 H GLY 62 13.174 1.307 8.238
494 HA2 GLY 62 2HA GLY 62 15.104 2.322 8.954
495 HA3 GLY 62 1HA GLY 62 14.189 3.814 9.107
496 H GLY 63 H GLY 63 13.031 4.192 11.048
497 HA2 GLY 63 2HA GLY 63 13.362 2.503 13.389
498 HA3 GLY 63 1HA GLY 63 14.203 4.051 13.461
499 H GLY 64 H GLY 64 11.911 3.077 15.076
500 HA2 GLY 64 2HA GLY 64 10.181 4.316 16.083
501 HA3 GLY 64 1HA GLY 64 10.060 5.328 14.658
502 HA PRO 65 HA PRO 65 7.385 1.321 14.061
503 HB2 PRO 65 2HB PRO 65 6.109 0.871 16.654
504 HB3 PRO 65 1HB PRO 65 7.244 -0.180 15.792
505 HG2 PRO 65 2HG PRO 65 7.848 1.064 18.150
506 HG3 PRO 65 1HG PRO 65 9.071 0.604 16.942
507 HD2 PRO 65 2HD PRO 65 7.779 3.302 17.381
508 HD3 PRO 65 1HD PRO 65 9.497 2.902 17.125
509 H SER 66 H SER 66 6.789 4.246 14.176
510 HA SER 66 HA SER 66 4.045 4.643 14.926
511 HB2 SER 66 2HB SER 66 5.874 6.394 13.225
512 HB3 SER 66 1HB SER 66 4.385 6.905 14.004
513 HG SER 66 HG SER 66 5.621 6.046 15.999
514 H SER 67 H SER 67 5.182 2.832 12.477
515 HA SER 67 HA SER 67 3.670 3.655 10.208
516 HB2 SER 67 2HB SER 67 4.849 0.919 10.830
517 HB3 SER 67 1HB SER 67 4.473 1.573 9.235
518 HG SER 67 HG SER 67 6.641 1.876 9.535
519 H ARG 68 H ARG 68 2.549 2.541 13.076
520 HA ARG 68 HA ARG 68 0.690 1.624 13.922
521 HB2 ARG 68 2HB ARG 68 -0.320 1.405 11.058
522 HB3 ARG 68 1HB ARG 68 -1.274 1.031 12.486
523 HG2 ARG 68 2HG ARG 68 -0.999 3.418 13.221
524 HG3 ARG 68 1HG ARG 68 -0.193 3.743 11.680
525 HD2 ARG 68 2HD ARG 68 -2.597 4.366 11.645
526 HD3 ARG 68 1HD ARG 68 -2.210 3.119 10.451
527 HE ARG 68 HE ARG 68 -3.079 1.484 12.158
528 HH11 ARG 68 1HH1 ARG 68 -4.313 4.787 12.097
529 HH12 ARG 68 2HH1 ARG 68 -5.833 4.350 12.812
530 HH21 ARG 68 1HH2 ARG 68 -5.067 0.932 13.111
531 HH22 ARG 68 2HH2 ARG 68 -6.260 2.163 13.389
532 H LEU 69 H LEU 69 1.922 -0.100 14.731
533 HA LEU 69 HA LEU 69 2.529 -2.461 13.254
534 HB2 LEU 69 2HB LEU 69 2.307 -2.097 16.268
535 HB3 LEU 69 1HB LEU 69 3.009 -3.494 15.469
536 HG LEU 69 HG LEU 69 4.142 -0.666 15.453
537 HD11 LEU 69 1HD1 LEU 69 4.399 -1.805 17.614
538 HD12 LEU 69 2HD1 LEU 69 5.959 -1.628 16.814
539 HD13 LEU 69 3HD1 LEU 69 5.144 -3.194 16.816
540 HD21 LEU 69 3HD2 LEU 69 5.246 -3.181 14.146
541 HD22 LEU 69 1HD2 LEU 69 6.097 -1.638 14.285
542 HD23 LEU 69 2HD2 LEU 69 4.630 -1.750 13.315
543 H THR 70 H THR 70 0.623 -3.160 12.238
544 HA THR 70 HA THR 70 -1.721 -3.911 13.739
545 HB THR 70 HB THR 70 -1.006 -4.884 10.937
546 HG1 THR 70 HG1 THR 70 -1.364 -2.928 10.195
547 HG21 THR 70 3HG2 THR 70 -3.688 -4.297 12.264
548 HG22 THR 70 1HG2 THR 70 -3.017 -5.908 11.989
549 HG23 THR 70 2HG2 THR 70 -3.454 -4.886 10.617
550 H TRP 71 H TRP 71 -2.402 -6.114 14.109
551 HA TRP 71 HA TRP 71 -0.365 -7.628 15.348
552 HB2 TRP 71 2HB TRP 71 -3.182 -8.585 14.731
553 HB3 TRP 71 1HB TRP 71 -2.116 -9.167 16.007
554 HD1 TRP 71 HD1 TRP 71 -5.037 -7.106 15.703
555 HE1 TRP 71 HE1 TRP 71 -5.272 -5.408 17.603
556 HE3 TRP 71 HE3 TRP 71 -0.268 -7.280 17.570
557 HZ2 TRP 71 HZ2 TRP 71 -3.684 -4.278 19.617
558 HZ3 TRP 71 HZ3 TRP 71 0.289 -5.846 19.490
559 HH2 TRP 71 HH2 TRP 71 -1.384 -4.373 20.494
560 H ARG 72 H ARG 72 0.489 -9.663 14.878
561 HA ARG 72 HA ARG 72 1.125 -10.096 12.151
562 HB2 ARG 72 2HB ARG 72 1.743 -11.764 14.619
563 HB3 ARG 72 1HB ARG 72 2.403 -12.094 13.019
564 HG2 ARG 72 2HG ARG 72 3.447 -9.814 13.036
565 HG3 ARG 72 1HG ARG 72 2.874 -9.605 14.690
566 HD2 ARG 72 2HD ARG 72 4.277 -11.409 15.472
567 HD3 ARG 72 1HD ARG 72 4.719 -11.852 13.821
568 HE ARG 72 HE ARG 72 5.439 -9.204 14.926
569 HH11 ARG 72 1HH1 ARG 72 6.452 -12.285 13.522
570 HH12 ARG 72 2HH1 ARG 72 8.102 -11.782 13.322
571 HH21 ARG 72 1HH2 ARG 72 7.606 -8.573 14.680
572 HH22 ARG 72 2HH2 ARG 72 8.757 -9.668 13.981
573 H VAL 73 H VAL 73 -0.689 -10.523 11.014
574 HA VAL 73 HA VAL 73 -2.705 -12.387 11.595
575 HB VAL 73 HB VAL 73 -1.826 -11.360 8.852
576 HG11 VAL 73 1HG1 VAL 73 -4.490 -12.569 9.686
577 HG12 VAL 73 2HG1 VAL 73 -3.292 -13.314 8.625
578 HG13 VAL 73 3HG1 VAL 73 -4.134 -11.853 8.112
579 HG21 VAL 73 3HG2 VAL 73 -2.329 -9.502 10.378
580 HG22 VAL 73 1HG2 VAL 73 -3.898 -10.214 10.765
581 HG23 VAL 73 2HG2 VAL 73 -3.571 -9.625 9.133
582 H GLN 74 H GLN 74 0.368 -12.711 9.888
583 HA GLN 74 HA GLN 74 -0.122 -15.424 9.024
584 HB2 GLN 74 2HB GLN 74 2.454 -13.818 8.971
585 HB3 GLN 74 1HB GLN 74 2.214 -15.389 8.209
586 HG2 GLN 74 2HG GLN 74 0.467 -14.413 6.755
587 HG3 GLN 74 1HG GLN 74 0.732 -12.839 7.503
588 HE21 GLN 74 1HE2 GLN 74 1.415 -11.782 5.659
589 HE22 GLN 74 2HE2 GLN 74 2.888 -12.157 4.845
590 H ARG 75 H ARG 75 -0.715 -16.163 11.166
591 HA ARG 75 HA ARG 75 1.636 -17.321 12.538
592 HB2 ARG 75 2HB ARG 75 -1.260 -17.172 13.491
593 HB3 ARG 75 1HB ARG 75 0.058 -17.926 14.375
594 HG2 ARG 75 2HG ARG 75 -0.204 -14.973 13.741
595 HG3 ARG 75 1HG ARG 75 -0.501 -15.733 15.303
596 HD2 ARG 75 2HD ARG 75 1.901 -16.441 15.363
597 HD3 ARG 75 1HD ARG 75 2.163 -15.544 13.860
598 HE ARG 75 HE ARG 75 1.085 -13.668 15.459
599 HH11 ARG 75 1HH1 ARG 75 3.819 -15.851 15.963
600 HH12 ARG 75 2HH1 ARG 75 4.631 -14.759 17.037
601 HH21 ARG 75 1HH2 ARG 75 2.145 -12.292 16.907
602 HH22 ARG 75 2HH2 ARG 75 3.683 -12.744 17.571
603 H SER 76 H SER 76 1.724 -19.530 12.744
604 HA SER 76 HA SER 76 -0.229 -21.434 12.083
605 HB2 SER 76 2HB SER 76 0.212 -20.811 9.718
606 HB3 SER 76 1HB SER 76 1.943 -21.045 9.956
607 HG SER 76 HG SER 76 0.084 -23.134 10.420
608 H GLN 77 H GLN 77 3.271 -21.130 11.517
609 HA GLN 77 HA GLN 77 3.947 -22.417 14.043
610 HB2 GLN 77 2HB GLN 77 4.827 -23.525 11.336
611 HB3 GLN 77 1HB GLN 77 5.639 -23.921 12.844
612 HG2 GLN 77 2HG GLN 77 3.553 -24.940 13.698
613 HG3 GLN 77 1HG GLN 77 2.753 -24.547 12.173
614 HE21 GLN 77 1HE2 GLN 77 3.304 -25.721 10.307
615 HE22 GLN 77 2HE2 GLN 77 4.144 -27.228 10.384
616 H ASN 78 H ASN 78 5.396 -21.370 10.938
617 HA ASN 78 HA ASN 78 6.642 -19.047 12.123
618 HB2 ASN 78 2HB ASN 78 8.981 -19.661 11.449
619 HB3 ASN 78 1HB ASN 78 8.352 -20.701 12.721
620 HD21 ASN 78 1HD2 ASN 78 10.492 -21.109 10.677
621 HD22 ASN 78 2HD2 ASN 78 10.105 -22.609 9.920
622 HA PRO 79 HA PRO 79 5.342 -18.984 7.561
623 HB2 PRO 79 2HB PRO 79 3.442 -16.813 8.276
624 HB3 PRO 79 1HB PRO 79 3.123 -18.386 7.518
625 HG2 PRO 79 2HG PRO 79 2.325 -17.863 10.022
626 HG3 PRO 79 1HG PRO 79 2.872 -19.484 9.535
627 HD2 PRO 79 2HD PRO 79 4.439 -17.332 10.982
628 HD3 PRO 79 1HD PRO 79 4.270 -19.064 11.376
629 H LEU 80 H LEU 80 6.013 -16.359 9.767
630 HA LEU 80 HA LEU 80 6.771 -14.447 7.731
631 HB2 LEU 80 2HB LEU 80 6.933 -14.376 10.766
632 HB3 LEU 80 1HB LEU 80 7.365 -13.024 9.729
633 HG LEU 80 HG LEU 80 4.591 -14.263 9.913
634 HD11 LEU 80 1HD1 LEU 80 3.930 -12.234 11.109
635 HD12 LEU 80 2HD1 LEU 80 5.600 -11.657 11.090
636 HD13 LEU 80 3HD1 LEU 80 5.175 -13.114 11.987
637 HD21 LEU 80 3HD2 LEU 80 4.987 -13.288 7.715
638 HD22 LEU 80 1HD2 LEU 80 5.521 -11.772 8.452
639 HD23 LEU 80 2HD2 LEU 80 3.848 -12.304 8.628
640 H LYS 81 H LYS 81 8.740 -14.210 6.938
641 HA LYS 81 HA LYS 81 10.969 -15.859 7.856
642 HB2 LYS 81 2HB LYS 81 10.781 -13.945 5.485
643 HB3 LYS 81 1HB LYS 81 12.066 -15.115 5.776
644 HG2 LYS 81 2HG LYS 81 10.425 -16.958 5.525
645 HG3 LYS 81 1HG LYS 81 9.162 -15.777 5.196
646 HD2 LYS 81 2HD LYS 81 11.650 -16.167 3.488
647 HD3 LYS 81 1HD LYS 81 10.081 -16.882 3.145
648 HE2 LYS 81 2HE LYS 81 10.246 -14.980 1.737
649 HE3 LYS 81 1HE LYS 81 9.160 -14.500 3.038
650 HZ1 LYS 81 3HZ LYS 81 10.827 -12.794 2.441
651 HZ2 LYS 81 1HZ LYS 81 12.063 -13.836 2.928
652 HZ3 LYS 81 2HZ LYS 81 10.947 -13.259 4.058
653 H ILE 82 H ILE 82 13.025 -14.969 8.396
654 HA ILE 82 HA ILE 82 12.898 -12.375 9.760
655 HB ILE 82 HB ILE 82 15.041 -13.025 10.822
656 HG12 ILE 82 2HG1 ILE 82 14.786 -15.617 9.215
657 HG13 ILE 82 1HG1 ILE 82 16.023 -14.387 8.989
658 HG21 ILE 82 1HG2 ILE 82 14.166 -14.848 12.230
659 HG22 ILE 82 2HG2 ILE 82 12.919 -15.189 11.030
660 HG23 ILE 82 3HG2 ILE 82 12.914 -13.650 11.892
661 HD11 ILE 82 3HD1 ILE 82 16.926 -16.278 10.176
662 HD12 ILE 82 1HD1 ILE 82 15.676 -16.149 11.413
663 HD13 ILE 82 2HD1 ILE 82 16.889 -14.877 11.244
664 H ARG 83 H ARG 83 14.829 -10.957 9.649
665 HA ARG 83 HA ARG 83 16.365 -11.048 7.147
666 HB2 ARG 83 2HB ARG 83 14.450 -9.538 6.703
667 HB3 ARG 83 1HB ARG 83 14.859 -8.577 8.121
668 HG2 ARG 83 2HG ARG 83 17.004 -7.937 7.081
669 HG3 ARG 83 1HG ARG 83 16.623 -8.921 5.669
670 HD2 ARG 83 2HD ARG 83 14.754 -7.455 5.102
671 HD3 ARG 83 1HD ARG 83 14.994 -6.521 6.585
672 HE ARG 83 HE ARG 83 17.238 -6.676 4.721
673 HH11 ARG 83 1HH1 ARG 83 14.532 -4.755 5.890
674 HH12 ARG 83 2HH1 ARG 83 15.163 -3.274 5.258
675 HH21 ARG 83 1HH2 ARG 83 18.083 -4.699 3.941
676 HH22 ARG 83 2HH2 ARG 83 17.163 -3.242 4.160
677 H LEU 84 H LEU 84 18.257 -11.457 8.057
678 HA LEU 84 HA LEU 84 19.215 -9.955 10.408
679 HB2 LEU 84 2HB LEU 84 20.509 -12.340 9.026
680 HB3 LEU 84 1HB LEU 84 20.916 -11.683 10.604
681 HG LEU 84 HG LEU 84 18.333 -13.128 9.891
682 HD11 LEU 84 1HD1 LEU 84 20.246 -14.651 9.997
683 HD12 LEU 84 2HD1 LEU 84 19.143 -14.931 11.340
684 HD13 LEU 84 3HD1 LEU 84 20.654 -14.059 11.612
685 HD21 LEU 84 3HD2 LEU 84 17.778 -13.024 12.281
686 HD22 LEU 84 1HD2 LEU 84 17.909 -11.410 11.583
687 HD23 LEU 84 2HD2 LEU 84 19.216 -12.046 12.584
688 H THR 85 H THR 85 20.821 -8.471 10.214
689 HA THR 85 HA THR 85 22.347 -7.046 9.396
690 HB THR 85 HB THR 85 22.906 -9.166 7.270
691 HG1 THR 85 HG1 THR 85 23.789 -10.144 8.927
692 HG21 THR 85 3HG2 THR 85 25.087 -8.049 6.968
693 HG22 THR 85 1HG2 THR 85 24.617 -6.793 8.110
694 HG23 THR 85 2HG2 THR 85 23.768 -6.946 6.569
695 H ARG 86 H ARG 86 21.043 -5.364 8.854
696 HA ARG 86 HA ARG 86 19.834 -5.021 6.240
697 HB2 ARG 86 2HB ARG 86 18.915 -3.941 8.300
698 HB3 ARG 86 1HB ARG 86 20.406 -3.031 8.485
699 HG2 ARG 86 2HG ARG 86 19.892 -1.960 6.231
700 HG3 ARG 86 1HG ARG 86 18.306 -2.725 6.323
701 HD2 ARG 86 2HD ARG 86 17.780 -1.480 8.356
702 HD3 ARG 86 1HD ARG 86 19.411 -0.801 8.403
703 HE ARG 86 HE ARG 86 17.785 -0.274 6.024
704 HH11 ARG 86 1HH1 ARG 86 19.070 1.016 9.045
705 HH12 ARG 86 2HH1 ARG 86 18.768 2.664 8.602
706 HH21 ARG 86 1HH2 ARG 86 17.378 1.877 5.477
707 HH22 ARG 86 2HH2 ARG 86 17.806 3.153 6.575
708 H GLU 87 H GLU 87 20.547 -3.196 4.816
709 HA GLU 87 HA GLU 87 23.275 -3.173 4.121
710 HB2 GLU 87 2HB GLU 87 21.137 -1.121 3.381
711 HB3 GLU 87 1HB GLU 87 22.700 -1.295 2.594
712 HG2 GLU 87 2HG GLU 87 21.142 -2.298 1.137
713 HG3 GLU 87 1HG GLU 87 21.970 -3.643 1.922
714 H ALA 88 H ALA 88 24.452 -2.664 6.022
715 HA ALA 88 HA ALA 88 24.229 0.074 7.117
716 HB1 ALA 88 3HB ALA 88 25.719 -2.341 8.186
717 HB2 ALA 88 1HB ALA 88 24.153 -1.758 8.751
718 HB3 ALA 88 2HB ALA 88 25.597 -0.769 8.983
719 HA PRO 89 HA PRO 89 27.853 1.113 4.562
720 HB2 PRO 89 2HB PRO 89 28.454 3.530 5.832
721 HB3 PRO 89 1HB PRO 89 27.233 3.336 4.562
722 HG2 PRO 89 2HG PRO 89 26.861 3.438 7.529
723 HG3 PRO 89 1HG PRO 89 25.886 4.184 6.240
724 HD2 PRO 89 2HD PRO 89 25.081 1.930 7.479
725 HD3 PRO 89 1HD PRO 89 24.769 2.197 5.748
Start of MODEL 7
1 H1 HIS 1 1H HIS 1 -4.009 -20.704 13.016
2 H2 HIS 1 2H HIS 1 -5.015 -21.417 14.173
3 H3 HIS 1 3H HIS 1 -5.586 -20.133 13.233
4 HA HIS 1 HA HIS 1 -4.795 -22.788 12.215
5 HB2 HIS 1 2HB HIS 1 -7.196 -23.231 11.855
6 HB3 HIS 1 1HB HIS 1 -6.870 -22.913 13.551
7 HD1 HIS 1 HD1 HIS 1 -8.730 -21.625 10.603
8 HD2 HIS 1 HD2 HIS 1 -8.072 -20.520 14.553
9 HE1 HIS 1 HE1 HIS 1 -10.469 -19.893 11.122
10 HE2 HIS 1 HE2 HIS 1 -10.117 -19.331 13.549
11 H HIS 2 H HIS 2 -4.124 -19.918 11.358
12 HA HIS 2 HA HIS 2 -4.516 -20.526 8.532
13 HB2 HIS 2 2HB HIS 2 -5.281 -18.345 7.874
14 HB3 HIS 2 1HB HIS 2 -6.337 -18.875 9.170
15 HD1 HIS 2 HD1 HIS 2 -6.008 -17.675 11.511
16 HD2 HIS 2 HD2 HIS 2 -3.971 -15.921 8.349
17 HE1 HIS 2 HE1 HIS 2 -5.337 -15.408 12.318
18 HE2 HIS 2 HE2 HIS 2 -3.966 -14.449 10.457
19 H HIS 3 H HIS 3 -2.679 -20.439 7.554
20 HA HIS 3 HA HIS 3 -0.699 -18.383 7.915
21 HB2 HIS 3 2HB HIS 3 1.187 -19.958 8.350
22 HB3 HIS 3 1HB HIS 3 0.042 -19.936 9.681
23 HD1 HIS 3 HD1 HIS 3 -1.259 -22.105 10.163
24 HD2 HIS 3 HD2 HIS 3 1.376 -22.421 6.969
25 HE1 HIS 3 HE1 HIS 3 -1.057 -24.556 9.691
26 HE2 HIS 3 HE2 HIS 3 0.690 -24.726 7.900
27 H HIS 4 H HIS 4 -2.590 -19.369 5.966
28 HA HIS 4 HA HIS 4 -1.058 -20.611 3.816
29 HB2 HIS 4 2HB HIS 4 -3.446 -21.272 4.360
30 HB3 HIS 4 1HB HIS 4 -3.970 -19.663 3.884
31 HD1 HIS 4 HD1 HIS 4 -5.214 -20.035 1.755
32 HD2 HIS 4 HD2 HIS 4 -1.679 -22.213 1.855
33 HE1 HIS 4 HE1 HIS 4 -5.017 -21.123 -0.500
34 HE2 HIS 4 HE2 HIS 4 -2.948 -22.539 -0.351
35 H HIS 5 H HIS 5 -1.084 -19.539 1.656
36 HA HIS 5 HA HIS 5 -0.661 -17.887 0.190
37 HB2 HIS 5 2HB HIS 5 -1.955 -15.933 2.158
38 HB3 HIS 5 1HB HIS 5 -1.568 -15.583 0.481
39 HD1 HIS 5 HD1 HIS 5 -3.120 -16.611 -1.335
40 HD2 HIS 5 HD2 HIS 5 -4.325 -17.401 2.560
41 HE1 HIS 5 HE1 HIS 5 -5.475 -17.438 -1.510
42 HE2 HIS 5 HE2 HIS 5 -6.247 -17.666 0.865
43 H HIS 6 H HIS 6 1.523 -18.071 0.289
44 HA HIS 6 HA HIS 6 3.195 -16.987 2.328
45 HB2 HIS 6 2HB HIS 6 3.861 -17.902 -0.507
46 HB3 HIS 6 1HB HIS 6 5.068 -17.469 0.698
47 HD1 HIS 6 HD1 HIS 6 5.811 -19.318 2.259
48 HD2 HIS 6 HD2 HIS 6 2.321 -20.290 0.238
49 HE1 HIS 6 HE1 HIS 6 5.349 -21.714 2.822
50 HE2 HIS 6 HE2 HIS 6 3.123 -22.193 1.765
51 H SER 7 H SER 7 4.100 -14.980 2.466
52 HA SER 7 HA SER 7 3.456 -12.890 0.500
53 HB2 SER 7 2HB SER 7 1.388 -13.168 1.813
54 HB3 SER 7 1HB SER 7 2.284 -13.064 3.326
55 HG SER 7 HG SER 7 2.387 -10.961 3.138
56 H HIS 8 H HIS 8 4.111 -10.684 1.469
57 HA HIS 8 HA HIS 8 6.684 -10.615 2.729
58 HB2 HIS 8 2HB HIS 8 4.573 -8.431 2.344
59 HB3 HIS 8 1HB HIS 8 6.191 -8.132 2.971
60 HD1 HIS 8 HD1 HIS 8 6.098 -6.453 0.831
61 HD2 HIS 8 HD2 HIS 8 6.421 -10.504 -0.010
62 HE1 HIS 8 HE1 HIS 8 6.911 -6.588 -1.527
63 HE2 HIS 8 HE2 HIS 8 6.891 -9.038 -2.071
64 H MET 9 H MET 9 7.050 -9.604 4.852
65 HA MET 9 HA MET 9 5.707 -10.891 6.944
66 HB2 MET 9 2HB MET 9 7.076 -9.483 8.450
67 HB3 MET 9 1HB MET 9 8.038 -10.163 7.148
68 HG2 MET 9 2HG MET 9 7.959 -7.989 5.962
69 HG3 MET 9 1HG MET 9 7.028 -7.307 7.296
70 HE1 MET 9 3HE MET 9 9.676 -7.468 10.230
71 HE2 MET 9 1HE MET 9 8.511 -8.735 9.842
72 HE3 MET 9 2HE MET 9 8.022 -7.038 9.798
73 H VAL 10 H VAL 10 4.051 -10.325 8.277
74 HA VAL 10 HA VAL 10 2.236 -8.241 7.681
75 HB VAL 10 HB VAL 10 1.151 -8.834 9.879
76 HG11 VAL 10 1HG1 VAL 10 0.542 -11.160 9.274
77 HG12 VAL 10 2HG1 VAL 10 1.895 -11.220 8.145
78 HG13 VAL 10 3HG1 VAL 10 0.558 -10.105 7.858
79 HG21 VAL 10 3HG2 VAL 10 3.126 -9.359 11.237
80 HG22 VAL 10 1HG2 VAL 10 3.509 -10.734 10.197
81 HG23 VAL 10 2HG2 VAL 10 2.055 -10.760 11.194
82 H GLY 11 H GLY 11 2.229 -6.137 8.271
83 HA2 GLY 11 2HA GLY 11 2.733 -4.302 9.751
84 HA3 GLY 11 1HA GLY 11 4.185 -5.143 10.272
85 H ASP 12 H ASP 12 3.622 -5.370 6.871
86 HA ASP 12 HA ASP 12 6.135 -4.106 6.313
87 HB2 ASP 12 2HB ASP 12 5.198 -6.030 4.983
88 HB3 ASP 12 1HB ASP 12 3.965 -4.956 4.343
89 H THR 13 H THR 13 6.450 -1.959 6.202
90 HA THR 13 HA THR 13 4.238 -0.108 6.163
91 HB THR 13 HB THR 13 7.235 0.343 6.319
92 HG1 THR 13 HG1 THR 13 5.788 -0.756 8.060
93 HG21 THR 13 3HG2 THR 13 6.121 2.391 5.476
94 HG22 THR 13 1HG2 THR 13 6.685 2.618 7.134
95 HG23 THR 13 2HG2 THR 13 4.976 2.323 6.817
96 H VAL 14 H VAL 14 3.442 0.902 4.417
97 HA VAL 14 HA VAL 14 5.126 1.490 2.071
98 HB VAL 14 HB VAL 14 3.368 0.865 0.474
99 HG11 VAL 14 1HG1 VAL 14 3.490 -1.586 0.594
100 HG12 VAL 14 2HG1 VAL 14 4.020 -1.490 2.275
101 HG13 VAL 14 3HG1 VAL 14 5.046 -0.848 0.991
102 HG21 VAL 14 3HG2 VAL 14 1.324 -0.373 1.145
103 HG22 VAL 14 1HG2 VAL 14 1.370 1.243 1.854
104 HG23 VAL 14 2HG2 VAL 14 1.756 -0.166 2.844
105 H TRP 15 H TRP 15 3.712 2.876 0.559
106 HA TRP 15 HA TRP 15 2.007 4.797 2.010
107 HB2 TRP 15 2HB TRP 15 3.741 5.236 -0.478
108 HB3 TRP 15 1HB TRP 15 2.641 6.432 0.203
109 HD1 TRP 15 HD1 TRP 15 3.618 5.851 3.322
110 HE1 TRP 15 HE1 TRP 15 5.847 6.884 4.062
111 HE3 TRP 15 HE3 TRP 15 5.724 6.624 -1.257
112 HZ2 TRP 15 HZ2 TRP 15 8.189 7.889 2.880
113 HZ3 TRP 15 HZ3 TRP 15 7.968 7.625 -1.374
114 HH2 TRP 15 HH2 TRP 15 9.178 8.248 0.655
115 H VAL 16 H VAL 16 0.170 5.541 0.801
116 HA VAL 16 HA VAL 16 -0.807 3.722 -1.304
117 HB VAL 16 HB VAL 16 -2.372 5.644 0.508
118 HG11 VAL 16 1HG1 VAL 16 -4.422 4.694 -0.539
119 HG12 VAL 16 2HG1 VAL 16 -3.419 3.763 -1.652
120 HG13 VAL 16 3HG1 VAL 16 -3.420 5.526 -1.731
121 HG21 VAL 16 3HG2 VAL 16 -2.347 2.597 0.438
122 HG22 VAL 16 1HG2 VAL 16 -3.360 3.595 1.488
123 HG23 VAL 16 2HG2 VAL 16 -1.606 3.600 1.687
124 H ARG 17 H ARG 17 -0.100 4.513 -3.111
125 HA ARG 17 HA ARG 17 0.315 7.293 -3.727
126 HB2 ARG 17 2HB ARG 17 1.843 5.485 -4.483
127 HB3 ARG 17 1HB ARG 17 0.538 4.751 -5.404
128 HG2 ARG 17 2HG ARG 17 0.477 6.846 -6.828
129 HG3 ARG 17 1HG ARG 17 1.922 7.396 -5.966
130 HD2 ARG 17 2HD ARG 17 3.112 5.333 -6.692
131 HD3 ARG 17 1HD ARG 17 1.668 4.829 -7.572
132 HE ARG 17 HE ARG 17 2.892 7.387 -8.280
133 HH11 ARG 17 1HH1 ARG 17 2.320 4.028 -9.152
134 HH12 ARG 17 2HH1 ARG 17 2.804 4.252 -10.800
135 HH21 ARG 17 1HH2 ARG 17 3.618 7.636 -10.427
136 HH22 ARG 17 2HH2 ARG 17 3.540 6.295 -11.523
137 H ARG 18 H ARG 18 -1.675 8.287 -3.717
138 HA ARG 18 HA ARG 18 -3.847 7.225 -5.417
139 HB2 ARG 18 2HB ARG 18 -4.249 7.060 -2.951
140 HB3 ARG 18 1HB ARG 18 -4.094 8.811 -2.823
141 HG2 ARG 18 2HG ARG 18 -6.080 9.111 -4.255
142 HG3 ARG 18 1HG ARG 18 -6.208 7.361 -4.460
143 HD2 ARG 18 2HD ARG 18 -6.628 7.111 -2.038
144 HD3 ARG 18 1HD ARG 18 -6.485 8.859 -1.831
145 HE ARG 18 HE ARG 18 -8.614 7.484 -3.361
146 HH11 ARG 18 1HH1 ARG 18 -7.575 10.266 -1.470
147 HH12 ARG 18 2HH1 ARG 18 -9.145 11.004 -1.482
148 HH21 ARG 18 1HH2 ARG 18 -10.653 8.440 -3.347
149 HH22 ARG 18 2HH2 ARG 18 -10.897 9.963 -2.550
150 H HIS 19 H HIS 19 -5.017 8.579 -6.638
151 HA HIS 19 HA HIS 19 -5.322 11.347 -6.386
152 HB2 HIS 19 2HB HIS 19 -4.203 12.208 -8.403
153 HB3 HIS 19 1HB HIS 19 -3.002 11.449 -7.372
154 HD1 HIS 19 HD1 HIS 19 -3.322 11.868 -10.699
155 HD2 HIS 19 HD2 HIS 19 -3.072 8.377 -8.454
156 HE1 HIS 19 HE1 HIS 19 -2.511 10.099 -12.276
157 HE2 HIS 19 HE2 HIS 19 -2.251 8.039 -10.868
158 H GLN 20 H GLN 20 -7.045 12.040 -7.806
159 HA GLN 20 HA GLN 20 -8.590 9.842 -8.946
160 HB2 GLN 20 2HB GLN 20 -9.271 12.813 -8.882
161 HB3 GLN 20 1HB GLN 20 -10.369 11.495 -9.282
162 HG2 GLN 20 2HG GLN 20 -9.176 12.154 -6.583
163 HG3 GLN 20 1HG GLN 20 -10.868 12.209 -7.053
164 HE21 GLN 20 1HE2 GLN 20 -8.273 10.212 -5.965
165 HE22 GLN 20 2HE2 GLN 20 -9.193 8.769 -5.736
166 H THR 21 H THR 21 -7.698 13.064 -10.197
167 HA THR 21 HA THR 21 -7.892 12.214 -12.959
168 HB THR 21 HB THR 21 -7.156 14.663 -13.370
169 HG1 THR 21 HG1 THR 21 -7.148 16.019 -11.586
170 HG21 THR 21 3HG2 THR 21 -9.538 14.003 -13.468
171 HG22 THR 21 1HG2 THR 21 -9.353 15.604 -12.752
172 HG23 THR 21 2HG2 THR 21 -9.674 14.211 -11.720
173 H LYS 22 H LYS 22 -6.262 11.964 -14.380
174 HA LYS 22 HA LYS 22 -3.616 11.291 -13.461
175 HB2 LYS 22 2HB LYS 22 -4.719 11.469 -16.302
176 HB3 LYS 22 1HB LYS 22 -3.210 10.683 -15.831
177 HG2 LYS 22 2HG LYS 22 -4.434 8.987 -14.568
178 HG3 LYS 22 1HG LYS 22 -5.968 9.809 -14.885
179 HD2 LYS 22 2HD LYS 22 -5.609 9.407 -17.344
180 HD3 LYS 22 1HD LYS 22 -4.162 8.473 -16.950
181 HE2 LYS 22 2HE LYS 22 -6.073 6.984 -17.358
182 HE3 LYS 22 1HE LYS 22 -5.565 6.875 -15.673
183 HZ1 LYS 22 3HZ LYS 22 -7.382 8.292 -15.034
184 HZ2 LYS 22 1HZ LYS 22 -7.985 7.002 -15.945
185 HZ3 LYS 22 2HZ LYS 22 -7.831 8.532 -16.645
186 H ASN 23 H ASN 23 -5.141 14.110 -14.800
187 HA ASN 23 HA ASN 23 -2.884 15.527 -15.774
188 HB2 ASN 23 2HB ASN 23 -5.566 16.503 -14.693
189 HB3 ASN 23 1HB ASN 23 -4.333 17.615 -15.280
190 HD21 ASN 23 1HD2 ASN 23 -5.570 18.382 -16.964
191 HD22 ASN 23 2HD2 ASN 23 -5.983 17.429 -18.348
192 H LEU 24 H LEU 24 -4.286 15.197 -12.529
193 HA LEU 24 HA LEU 24 -2.164 16.802 -11.307
194 HB2 LEU 24 2HB LEU 24 -4.386 15.144 -10.038
195 HB3 LEU 24 1HB LEU 24 -3.268 16.181 -9.160
196 HG LEU 24 HG LEU 24 -5.421 17.080 -11.122
197 HD11 LEU 24 1HD1 LEU 24 -5.136 17.547 -8.141
198 HD12 LEU 24 2HD1 LEU 24 -6.309 16.500 -8.944
199 HD13 LEU 24 3HD1 LEU 24 -6.386 18.243 -9.180
200 HD21 LEU 24 3HD2 LEU 24 -3.457 18.496 -11.445
201 HD22 LEU 24 1HD2 LEU 24 -3.358 18.807 -9.709
202 HD23 LEU 24 2HD2 LEU 24 -4.736 19.399 -10.644
203 H GLU 25 H GLU 25 -0.540 15.967 -10.033
204 HA GLU 25 HA GLU 25 0.741 13.632 -10.910
205 HB2 GLU 25 2HB GLU 25 1.253 15.239 -8.363
206 HB3 GLU 25 1HB GLU 25 2.378 14.086 -9.086
207 HG2 GLU 25 2HG GLU 25 2.612 15.513 -11.074
208 HG3 GLU 25 1HG GLU 25 1.420 16.639 -10.428
209 HA PRO 26 HA PRO 26 -0.927 10.460 -8.062
210 HB2 PRO 26 2HB PRO 26 1.744 9.124 -8.275
211 HB3 PRO 26 1HB PRO 26 0.139 8.505 -8.717
212 HG2 PRO 26 2HG PRO 26 1.937 9.173 -10.594
213 HG3 PRO 26 1HG PRO 26 0.192 9.439 -10.835
214 HD2 PRO 26 2HD PRO 26 2.314 11.443 -10.074
215 HD3 PRO 26 1HD PRO 26 0.958 11.614 -11.215
216 H ARG 27 H ARG 27 -1.086 11.407 -6.080
217 HA ARG 27 HA ARG 27 1.251 12.265 -4.537
218 HB2 ARG 27 2HB ARG 27 -0.889 13.600 -4.613
219 HB3 ARG 27 1HB ARG 27 -1.727 12.274 -3.818
220 HG2 ARG 27 2HG ARG 27 -0.395 12.598 -1.792
221 HG3 ARG 27 1HG ARG 27 0.587 13.824 -2.596
222 HD2 ARG 27 2HD ARG 27 -1.389 15.282 -2.796
223 HD3 ARG 27 1HD ARG 27 -2.381 14.056 -1.999
224 HE ARG 27 HE ARG 27 -0.708 14.352 -0.084
225 HH11 ARG 27 1HH1 ARG 27 -1.718 17.014 -2.151
226 HH12 ARG 27 2HH1 ARG 27 -1.464 18.217 -0.933
227 HH21 ARG 27 1HH2 ARG 27 -0.363 15.914 1.495
228 HH22 ARG 27 2HH2 ARG 27 -0.689 17.582 1.152
229 H TRP 28 H TRP 28 1.465 11.397 -2.220
230 HA TRP 28 HA TRP 28 0.322 8.686 -1.895
231 HB2 TRP 28 2HB TRP 28 2.458 7.891 -0.874
232 HB3 TRP 28 1HB TRP 28 2.630 8.306 -2.572
233 HD1 TRP 28 HD1 TRP 28 4.414 10.121 -3.184
234 HE1 TRP 28 HE1 TRP 28 6.148 11.468 -1.860
235 HE3 TRP 28 HE3 TRP 28 2.825 9.069 1.568
236 HZ2 TRP 28 HZ2 TRP 28 6.780 11.996 0.817
237 HZ3 TRP 28 HZ3 TRP 28 4.058 10.038 3.464
238 HH2 TRP 28 HH2 TRP 28 6.001 11.475 3.090
239 H LYS 29 H LYS 29 -0.090 8.028 0.197
240 HA LYS 29 HA LYS 29 0.401 9.960 2.416
241 HB2 LYS 29 2HB LYS 29 -1.996 8.093 2.091
242 HB3 LYS 29 1HB LYS 29 -1.674 9.106 3.498
243 HG2 LYS 29 2HG LYS 29 -1.865 11.123 1.982
244 HG3 LYS 29 1HG LYS 29 -2.399 10.034 0.696
245 HD2 LYS 29 2HD LYS 29 -3.786 10.429 3.384
246 HD3 LYS 29 1HD LYS 29 -4.315 11.109 1.845
247 HE2 LYS 29 2HE LYS 29 -4.794 8.890 0.964
248 HE3 LYS 29 1HE LYS 29 -4.094 8.124 2.395
249 HZ1 LYS 29 3HZ LYS 29 -6.485 9.880 2.414
250 HZ2 LYS 29 1HZ LYS 29 -5.834 9.057 3.734
251 HZ3 LYS 29 2HZ LYS 29 -6.515 8.192 2.458
252 H GLY 30 H GLY 30 1.065 8.979 4.396
253 HA2 GLY 30 2HA GLY 30 1.141 6.126 4.757
254 HA3 GLY 30 1HA GLY 30 2.708 6.778 4.356
255 HA PRO 31 HA PRO 31 3.278 5.097 5.684
256 HB2 PRO 31 2HB PRO 31 4.464 3.945 7.807
257 HB3 PRO 31 1HB PRO 31 5.099 5.459 7.128
258 HG2 PRO 31 2HG PRO 31 3.506 5.044 9.628
259 HG3 PRO 31 1HG PRO 31 4.809 6.205 9.301
260 HD2 PRO 31 2HD PRO 31 2.008 6.740 9.172
261 HD3 PRO 31 1HD PRO 31 3.312 7.807 8.606
262 H TYR 32 H TYR 32 1.766 3.616 5.074
263 HA TYR 32 HA TYR 32 -0.243 2.549 6.890
264 HB2 TYR 32 2HB TYR 32 0.199 2.271 3.895
265 HB3 TYR 32 1HB TYR 32 -1.041 1.354 4.742
266 HD1 TYR 32 HD2 TYR 32 0.079 4.834 3.997
267 HD2 TYR 32 HD1 TYR 32 -3.156 2.357 5.251
268 HE1 TYR 32 HE2 TYR 32 -1.450 6.738 3.833
269 HE2 TYR 32 HE1 TYR 32 -4.680 4.272 5.084
270 HH TYR 32 HH TYR 32 -4.548 6.746 5.154
271 H THR 33 H THR 33 -0.681 0.321 7.133
272 HA THR 33 HA THR 33 1.739 -1.358 7.335
273 HB THR 33 HB THR 33 -0.873 -1.360 8.915
274 HG1 THR 33 HG1 THR 33 1.292 0.109 9.183
275 HG21 THR 33 3HG2 THR 33 1.574 -3.105 9.335
276 HG22 THR 33 1HG2 THR 33 0.002 -3.669 8.765
277 HG23 THR 33 2HG2 THR 33 0.173 -3.031 10.402
278 H VAL 34 H VAL 34 1.823 -2.945 5.837
279 HA VAL 34 HA VAL 34 -0.591 -4.059 4.584
280 HB VAL 34 HB VAL 34 2.338 -4.611 3.895
281 HG11 VAL 34 1HG1 VAL 34 0.835 -6.420 3.150
282 HG12 VAL 34 2HG1 VAL 34 1.475 -5.527 1.769
283 HG13 VAL 34 3HG1 VAL 34 -0.181 -5.244 2.310
284 HG21 VAL 34 3HG2 VAL 34 2.025 -3.108 1.964
285 HG22 VAL 34 1HG2 VAL 34 1.842 -2.252 3.495
286 HG23 VAL 34 2HG2 VAL 34 0.417 -2.688 2.552
287 H LEU 35 H LEU 35 -1.223 -6.138 4.882
288 HA LEU 35 HA LEU 35 0.157 -7.743 6.967
289 HB2 LEU 35 2HB LEU 35 -2.791 -7.683 6.210
290 HB3 LEU 35 1HB LEU 35 -2.080 -8.673 7.478
291 HG LEU 35 HG LEU 35 -2.214 -5.623 7.482
292 HD11 LEU 35 1HD1 LEU 35 -3.753 -7.634 9.149
293 HD12 LEU 35 2HD1 LEU 35 -4.403 -6.634 7.845
294 HD13 LEU 35 3HD1 LEU 35 -3.809 -5.874 9.318
295 HD21 LEU 35 3HD2 LEU 35 -1.345 -5.759 9.784
296 HD22 LEU 35 1HD2 LEU 35 -0.188 -6.387 8.615
297 HD23 LEU 35 2HD2 LEU 35 -1.127 -7.503 9.610
298 H LEU 36 H LEU 36 -1.191 -7.727 3.713
299 HA LEU 36 HA LEU 36 -0.035 -10.394 3.191
300 HB2 LEU 36 2HB LEU 36 -2.367 -10.832 3.904
301 HB3 LEU 36 1HB LEU 36 -2.965 -9.725 2.689
302 HG LEU 36 HG LEU 36 -1.978 -11.303 0.911
303 HD11 LEU 36 1HD1 LEU 36 -1.506 -13.609 1.555
304 HD12 LEU 36 2HD1 LEU 36 -1.715 -13.198 3.258
305 HD13 LEU 36 3HD1 LEU 36 -0.389 -12.492 2.333
306 HD21 LEU 36 3HD2 LEU 36 -4.173 -12.427 2.677
307 HD22 LEU 36 1HD2 LEU 36 -3.850 -12.879 0.999
308 HD23 LEU 36 2HD2 LEU 36 -4.381 -11.242 1.383
309 H THR 37 H THR 37 0.557 -10.674 1.033
310 HA THR 37 HA THR 37 0.072 -8.469 -0.891
311 HB THR 37 HB THR 37 2.485 -8.751 -1.675
312 HG1 THR 37 HG1 THR 37 2.460 -10.753 0.055
313 HG21 THR 37 3HG2 THR 37 1.869 -6.817 -0.256
314 HG22 THR 37 1HG2 THR 37 3.511 -7.366 0.091
315 HG23 THR 37 2HG2 THR 37 2.192 -7.775 1.190
316 H THR 38 H THR 38 -0.663 -9.231 -2.785
317 HA THR 38 HA THR 38 0.228 -11.859 -3.803
318 HB THR 38 HB THR 38 -2.103 -12.184 -4.780
319 HG1 THR 38 HG1 THR 38 -2.624 -9.839 -4.282
320 HG21 THR 38 3HG2 THR 38 -3.186 -13.016 -2.713
321 HG22 THR 38 1HG2 THR 38 -2.013 -12.121 -1.738
322 HG23 THR 38 2HG2 THR 38 -1.477 -13.457 -2.759
323 HA PRO 39 HA PRO 39 1.227 -9.870 -7.744
324 HB2 PRO 39 2HB PRO 39 -0.735 -11.839 -8.976
325 HB3 PRO 39 1HB PRO 39 0.913 -11.412 -9.500
326 HG2 PRO 39 2HG PRO 39 0.530 -13.679 -8.198
327 HG3 PRO 39 1HG PRO 39 1.935 -12.660 -7.804
328 HD2 PRO 39 2HD PRO 39 -0.614 -13.023 -6.245
329 HD3 PRO 39 1HD PRO 39 1.047 -12.790 -5.659
330 H THR 40 H THR 40 0.484 -7.933 -8.279
331 HA THR 40 HA THR 40 -0.704 -6.277 -9.215
332 HB THR 40 HB THR 40 -2.935 -8.311 -9.690
333 HG1 THR 40 HG1 THR 40 -0.732 -8.638 -10.643
334 HG21 THR 40 3HG2 THR 40 -3.662 -6.819 -11.527
335 HG22 THR 40 1HG2 THR 40 -2.449 -5.637 -11.064
336 HG23 THR 40 2HG2 THR 40 -3.780 -6.010 -9.960
337 H ALA 41 H ALA 41 -1.689 -7.862 -6.333
338 HA ALA 41 HA ALA 41 -3.401 -5.584 -5.529
339 HB1 ALA 41 3HB ALA 41 -4.338 -8.484 -5.398
340 HB2 ALA 41 1HB ALA 41 -4.953 -7.243 -6.492
341 HB3 ALA 41 2HB ALA 41 -5.206 -7.085 -4.756
342 H LEU 42 H LEU 42 -2.726 -4.946 -3.552
343 HA LEU 42 HA LEU 42 -1.375 -6.878 -1.751
344 HB2 LEU 42 2HB LEU 42 -0.956 -3.857 -1.854
345 HB3 LEU 42 1HB LEU 42 -0.058 -5.012 -0.881
346 HG LEU 42 HG LEU 42 0.084 -4.631 -3.900
347 HD11 LEU 42 1HD1 LEU 42 2.431 -4.133 -3.507
348 HD12 LEU 42 2HD1 LEU 42 2.221 -4.378 -1.769
349 HD13 LEU 42 3HD1 LEU 42 1.395 -3.049 -2.585
350 HD21 LEU 42 3HD2 LEU 42 1.407 -6.832 -2.284
351 HD22 LEU 42 1HD2 LEU 42 1.715 -6.463 -3.981
352 HD23 LEU 42 2HD2 LEU 42 0.129 -7.038 -3.485
353 H LYS 43 H LYS 43 -2.440 -7.279 0.095
354 HA LYS 43 HA LYS 43 -4.772 -5.722 0.863
355 HB2 LYS 43 2HB LYS 43 -4.976 -8.132 1.005
356 HB3 LYS 43 1HB LYS 43 -3.521 -8.255 1.984
357 HG2 LYS 43 2HG LYS 43 -4.657 -7.087 3.846
358 HG3 LYS 43 1HG LYS 43 -6.116 -6.934 2.860
359 HD2 LYS 43 2HD LYS 43 -6.343 -9.389 2.794
360 HD3 LYS 43 1HD LYS 43 -4.856 -9.565 3.736
361 HE2 LYS 43 2HE LYS 43 -6.910 -9.815 5.123
362 HE3 LYS 43 1HE LYS 43 -5.901 -8.467 5.652
363 HZ1 LYS 43 3HZ LYS 43 -8.268 -7.934 5.582
364 HZ2 LYS 43 1HZ LYS 43 -8.298 -8.206 3.916
365 HZ3 LYS 43 2HZ LYS 43 -7.373 -6.939 4.555
366 H VAL 44 H VAL 44 -4.320 -3.898 1.798
367 HA VAL 44 HA VAL 44 -2.300 -3.602 3.925
368 HB VAL 44 HB VAL 44 -3.950 -1.435 2.528
369 HG11 VAL 44 1HG1 VAL 44 -3.061 -0.732 4.705
370 HG12 VAL 44 2HG1 VAL 44 -2.259 0.140 3.397
371 HG13 VAL 44 3HG1 VAL 44 -1.431 -1.193 4.205
372 HG21 VAL 44 3HG2 VAL 44 -2.573 -2.562 0.828
373 HG22 VAL 44 1HG2 VAL 44 -1.132 -2.334 1.819
374 HG23 VAL 44 2HG2 VAL 44 -1.957 -0.937 1.131
375 H ASP 45 H ASP 45 -2.985 -3.082 6.019
376 HA ASP 45 HA ASP 45 -5.548 -3.701 6.969
377 HB2 ASP 45 2HB ASP 45 -3.527 -3.712 8.401
378 HB3 ASP 45 1HB ASP 45 -3.385 -1.966 8.239
379 H GLY 46 H GLY 46 -7.366 -2.487 7.334
380 HA2 GLY 46 2HA GLY 46 -8.632 -0.524 7.658
381 HA3 GLY 46 1HA GLY 46 -7.372 0.431 6.892
382 H ILE 47 H ILE 47 -7.303 -1.740 4.714
383 HA ILE 47 HA ILE 47 -9.103 -0.326 2.919
384 HB ILE 47 HB ILE 47 -7.105 -2.579 2.392
385 HG12 ILE 47 2HG1 ILE 47 -5.976 -0.568 3.227
386 HG13 ILE 47 1HG1 ILE 47 -5.622 -0.763 1.517
387 HG21 ILE 47 1HG2 ILE 47 -7.220 -1.943 0.001
388 HG22 ILE 47 2HG2 ILE 47 -8.509 -0.796 0.364
389 HG23 ILE 47 3HG2 ILE 47 -8.778 -2.525 0.595
390 HD11 ILE 47 3HD1 ILE 47 -5.991 1.547 2.044
391 HD12 ILE 47 1HD1 ILE 47 -7.569 1.190 2.738
392 HD13 ILE 47 2HD1 ILE 47 -7.296 0.980 1.004
393 H ALA 48 H ALA 48 -10.650 -1.356 1.543
394 HA ALA 48 HA ALA 48 -12.582 -2.949 2.692
395 HB1 ALA 48 3HB ALA 48 -12.949 -1.503 0.723
396 HB2 ALA 48 1HB ALA 48 -13.550 -3.138 0.428
397 HB3 ALA 48 2HB ALA 48 -12.018 -2.615 -0.279
398 H ALA 49 H ALA 49 -10.191 -4.006 0.223
399 HA ALA 49 HA ALA 49 -9.747 -6.450 1.734
400 HB1 ALA 49 3HB ALA 49 -11.579 -7.119 0.217
401 HB2 ALA 49 1HB ALA 49 -10.079 -7.960 -0.178
402 HB3 ALA 49 2HB ALA 49 -10.626 -6.610 -1.179
403 H TRP 50 H TRP 50 -8.987 -4.853 -1.409
404 HA TRP 50 HA TRP 50 -6.096 -5.079 -0.841
405 HB2 TRP 50 2HB TRP 50 -7.249 -5.896 -3.551
406 HB3 TRP 50 1HB TRP 50 -5.570 -6.000 -3.037
407 HD1 TRP 50 HD1 TRP 50 -5.030 -7.988 -1.134
408 HE1 TRP 50 HE1 TRP 50 -6.152 -10.290 -0.841
409 HE3 TRP 50 HE3 TRP 50 -9.322 -7.176 -3.819
410 HZ2 TRP 50 HZ2 TRP 50 -8.518 -11.595 -1.647
411 HZ3 TRP 50 HZ3 TRP 50 -10.956 -9.009 -4.020
412 HH2 TRP 50 HH2 TRP 50 -10.558 -11.175 -2.956
413 H ILE 51 H ILE 51 -4.799 -3.626 -2.005
414 HA ILE 51 HA ILE 51 -6.102 -1.529 -3.641
415 HB ILE 51 HB ILE 51 -3.509 -1.439 -2.003
416 HG12 ILE 51 2HG1 ILE 51 -5.604 -1.023 -0.710
417 HG13 ILE 51 1HG1 ILE 51 -4.588 0.410 -0.773
418 HG21 ILE 51 1HG2 ILE 51 -3.185 0.894 -2.815
419 HG22 ILE 51 2HG2 ILE 51 -4.527 0.681 -3.941
420 HG23 ILE 51 3HG2 ILE 51 -3.062 -0.284 -4.122
421 HD11 ILE 51 3HD1 ILE 51 -6.917 0.967 -1.034
422 HD12 ILE 51 1HD1 ILE 51 -7.057 -0.088 -2.438
423 HD13 ILE 51 2HD1 ILE 51 -6.038 1.357 -2.511
424 H HIS 52 H HIS 52 -5.567 -1.538 -5.775
425 HA HIS 52 HA HIS 52 -3.972 -3.469 -7.048
426 HB2 HIS 52 2HB HIS 52 -5.774 -2.085 -8.151
427 HB3 HIS 52 1HB HIS 52 -4.714 -0.688 -8.069
428 HD1 HIS 52 HD1 HIS 52 -2.640 -0.685 -9.703
429 HD2 HIS 52 HD2 HIS 52 -5.334 -3.791 -10.285
430 HE1 HIS 52 HE1 HIS 52 -2.058 -1.675 -11.934
431 HE2 HIS 52 HE2 HIS 52 -3.635 -3.607 -12.217
432 H ALA 53 H ALA 53 -1.776 -3.527 -7.534
433 HA ALA 53 HA ALA 53 -0.142 -2.437 -5.551
434 HB1 ALA 53 3HB ALA 53 1.688 -3.669 -6.589
435 HB2 ALA 53 1HB ALA 53 0.755 -3.854 -8.080
436 HB3 ALA 53 2HB ALA 53 0.215 -4.641 -6.596
437 H ALA 54 H ALA 54 -0.776 -1.147 -8.726
438 HA ALA 54 HA ALA 54 1.551 0.512 -8.954
439 HB1 ALA 54 3HB ALA 54 0.289 -0.161 -10.928
440 HB2 ALA 54 1HB ALA 54 0.290 1.599 -10.799
441 HB3 ALA 54 2HB ALA 54 -1.140 0.681 -10.334
442 H HIS 55 H HIS 55 -1.313 0.779 -7.119
443 HA HIS 55 HA HIS 55 -0.937 3.631 -6.482
444 HB2 HIS 55 2HB HIS 55 -3.188 1.691 -5.742
445 HB3 HIS 55 1HB HIS 55 -3.100 3.364 -5.194
446 HD1 HIS 55 HD1 HIS 55 -3.195 5.210 -7.169
447 HD2 HIS 55 HD2 HIS 55 -4.439 1.375 -8.156
448 HE1 HIS 55 HE1 HIS 55 -4.509 5.454 -9.292
449 HE2 HIS 55 HE2 HIS 55 -5.201 3.109 -9.898
450 H VAL 56 H VAL 56 0.759 1.212 -5.645
451 HA VAL 56 HA VAL 56 0.895 1.912 -2.765
452 HB VAL 56 HB VAL 56 1.637 -0.786 -4.014
453 HG11 VAL 56 1HG1 VAL 56 1.992 -1.537 -1.674
454 HG12 VAL 56 2HG1 VAL 56 1.687 0.102 -1.106
455 HG13 VAL 56 3HG1 VAL 56 3.097 -0.233 -2.116
456 HG21 VAL 56 3HG2 VAL 56 -0.259 -1.743 -2.745
457 HG22 VAL 56 1HG2 VAL 56 -0.815 -0.539 -3.913
458 HG23 VAL 56 2HG2 VAL 56 -0.713 -0.128 -2.197
459 H LYS 57 H LYS 57 2.844 2.693 -2.133
460 HA LYS 57 HA LYS 57 5.233 2.277 -3.844
461 HB2 LYS 57 2HB LYS 57 4.315 4.556 -4.227
462 HB3 LYS 57 1HB LYS 57 4.385 4.889 -2.498
463 HG2 LYS 57 2HG LYS 57 6.845 4.705 -2.550
464 HG3 LYS 57 1HG LYS 57 6.794 4.309 -4.267
465 HD2 LYS 57 2HD LYS 57 5.866 6.944 -3.056
466 HD3 LYS 57 1HD LYS 57 7.430 6.681 -3.824
467 HE2 LYS 57 2HE LYS 57 6.247 6.133 -5.955
468 HE3 LYS 57 1HE LYS 57 4.710 6.506 -5.164
469 HZ1 LYS 57 3HZ LYS 57 5.337 8.751 -4.914
470 HZ2 LYS 57 1HZ LYS 57 5.716 8.334 -6.506
471 HZ3 LYS 57 2HZ LYS 57 6.941 8.449 -5.347
472 H ALA 58 H ALA 58 6.587 1.066 -2.619
473 HA ALA 58 HA ALA 58 6.192 0.407 0.065
474 HB1 ALA 58 3HB ALA 58 7.375 -1.041 -1.545
475 HB2 ALA 58 1HB ALA 58 8.347 -0.786 -0.092
476 HB3 ALA 58 2HB ALA 58 8.729 0.088 -1.578
477 H ALA 59 H ALA 59 6.903 1.198 1.980
478 HA ALA 59 HA ALA 59 8.782 3.513 2.000
479 HB1 ALA 59 3HB ALA 59 6.366 3.039 3.784
480 HB2 ALA 59 1HB ALA 59 6.474 4.213 2.471
481 HB3 ALA 59 2HB ALA 59 7.491 4.400 3.901
482 H ASP 60 H ASP 60 10.317 3.540 3.629
483 HA ASP 60 HA ASP 60 10.872 1.014 4.964
484 HB2 ASP 60 2HB ASP 60 12.636 2.358 3.764
485 HB3 ASP 60 1HB ASP 60 12.477 3.610 4.984
486 HA PRO 61 HA PRO 61 8.586 2.539 8.639
487 HB2 PRO 61 2HB PRO 61 9.297 0.429 10.340
488 HB3 PRO 61 1HB PRO 61 7.968 0.365 9.166
489 HG2 PRO 61 2HG PRO 61 10.760 -0.697 8.896
490 HG3 PRO 61 1HG PRO 61 9.219 -1.437 8.405
491 HD2 PRO 61 2HD PRO 61 10.843 -0.240 6.599
492 HD3 PRO 61 1HD PRO 61 9.076 -0.171 6.439
493 H GLY 62 H GLY 62 11.973 1.736 8.460
494 HA2 GLY 62 2HA GLY 62 13.801 2.764 9.359
495 HA3 GLY 62 1HA GLY 62 12.746 3.881 10.215
496 H GLY 63 H GLY 63 13.844 0.507 10.191
497 HA2 GLY 63 2HA GLY 63 14.443 -0.904 11.911
498 HA3 GLY 63 1HA GLY 63 14.098 0.365 13.078
499 H GLY 64 H GLY 64 13.360 -2.398 13.303
500 HA2 GLY 64 2HA GLY 64 10.495 -2.616 13.038
501 HA3 GLY 64 1HA GLY 64 11.556 -3.679 13.954
502 HA PRO 65 HA PRO 65 9.978 0.246 16.581
503 HB2 PRO 65 2HB PRO 65 7.079 -0.537 16.312
504 HB3 PRO 65 1HB PRO 65 7.822 1.079 16.314
505 HG2 PRO 65 2HG PRO 65 6.921 0.043 14.044
506 HG3 PRO 65 1HG PRO 65 8.450 0.950 14.067
507 HD2 PRO 65 2HD PRO 65 8.045 -2.044 14.039
508 HD3 PRO 65 1HD PRO 65 9.176 -1.054 13.084
509 H SER 66 H SER 66 9.903 -0.032 18.752
510 HA SER 66 HA SER 66 9.728 -2.593 19.972
511 HB2 SER 66 2HB SER 66 9.589 0.153 21.306
512 HB3 SER 66 1HB SER 66 9.982 -1.377 22.096
513 HG SER 66 HG SER 66 11.735 -1.392 20.353
514 H SER 67 H SER 67 7.414 -0.096 19.274
515 HA SER 67 HA SER 67 5.306 -0.951 21.031
516 HB2 SER 67 2HB SER 67 5.246 0.879 18.584
517 HB3 SER 67 1HB SER 67 3.943 0.699 19.763
518 HG SER 67 HG SER 67 6.534 1.402 20.623
519 H ARG 68 H ARG 68 3.557 -2.200 20.575
520 HA ARG 68 HA ARG 68 3.682 -4.126 18.455
521 HB2 ARG 68 2HB ARG 68 2.823 -4.701 20.705
522 HB3 ARG 68 1HB ARG 68 1.500 -3.557 20.516
523 HG2 ARG 68 2HG ARG 68 0.704 -5.837 20.166
524 HG3 ARG 68 1HG ARG 68 0.590 -4.922 18.660
525 HD2 ARG 68 2HD ARG 68 1.434 -7.171 18.216
526 HD3 ARG 68 1HD ARG 68 2.691 -5.980 17.870
527 HE ARG 68 HE ARG 68 2.883 -6.990 20.540
528 HH11 ARG 68 1HH1 ARG 68 3.676 -7.819 17.211
529 HH12 ARG 68 2HH1 ARG 68 4.968 -8.877 17.657
530 HH21 ARG 68 1HH2 ARG 68 4.583 -8.377 21.115
531 HH22 ARG 68 2HH2 ARG 68 5.485 -9.197 19.879
532 H LEU 69 H LEU 69 3.417 -3.221 16.474
533 HA LEU 69 HA LEU 69 1.696 -1.085 15.779
534 HB2 LEU 69 2HB LEU 69 2.876 -3.248 13.989
535 HB3 LEU 69 1HB LEU 69 2.171 -1.740 13.422
536 HG LEU 69 HG LEU 69 4.721 -2.034 15.059
537 HD11 LEU 69 1HD1 LEU 69 5.850 -1.207 13.045
538 HD12 LEU 69 2HD1 LEU 69 4.316 -1.191 12.173
539 HD13 LEU 69 3HD1 LEU 69 5.003 -2.718 12.738
540 HD21 LEU 69 3HD2 LEU 69 3.401 0.508 14.039
541 HD22 LEU 69 1HD2 LEU 69 5.003 0.400 14.776
542 HD23 LEU 69 2HD2 LEU 69 3.574 0.016 15.726
543 H THR 70 H THR 70 1.392 -4.592 15.246
544 HA THR 70 HA THR 70 -1.506 -4.568 15.253
545 HB THR 70 HB THR 70 -1.003 -3.804 12.921
546 HG1 THR 70 HG1 THR 70 -2.731 -4.894 12.484
547 HG21 THR 70 3HG2 THR 70 0.439 -6.461 12.588
548 HG22 THR 70 1HG2 THR 70 1.212 -4.873 12.616
549 HG23 THR 70 2HG2 THR 70 0.110 -5.297 11.303
550 H TRP 71 H TRP 71 -2.191 -6.961 14.480
551 HA TRP 71 HA TRP 71 -0.778 -8.872 16.146
552 HB2 TRP 71 2HB TRP 71 -3.180 -9.234 14.279
553 HB3 TRP 71 1HB TRP 71 -2.604 -10.436 15.430
554 HD1 TRP 71 HD1 TRP 71 -4.216 -6.891 15.433
555 HE1 TRP 71 HE1 TRP 71 -5.578 -6.631 17.597
556 HE3 TRP 71 HE3 TRP 71 -2.945 -11.294 17.729
557 HZ2 TRP 71 HZ2 TRP 71 -6.061 -8.094 19.963
558 HZ3 TRP 71 HZ3 TRP 71 -3.905 -11.790 19.944
559 HH2 TRP 71 HH2 TRP 71 -5.433 -10.219 21.042
560 H ARG 72 H ARG 72 0.226 -10.802 15.374
561 HA ARG 72 HA ARG 72 1.314 -10.815 12.687
562 HB2 ARG 72 2HB ARG 72 1.434 -13.008 14.803
563 HB3 ARG 72 1HB ARG 72 2.371 -12.949 13.310
564 HG2 ARG 72 2HG ARG 72 3.430 -10.802 14.196
565 HG3 ARG 72 1HG ARG 72 2.638 -11.146 15.740
566 HD2 ARG 72 2HD ARG 72 4.919 -11.982 15.828
567 HD3 ARG 72 1HD ARG 72 3.820 -13.366 15.782
568 HE ARG 72 HE ARG 72 4.941 -12.425 13.236
569 HH11 ARG 72 1HH1 ARG 72 5.070 -14.860 15.776
570 HH12 ARG 72 2HH1 ARG 72 5.975 -15.984 14.813
571 HH21 ARG 72 1HH2 ARG 72 6.126 -13.882 11.997
572 HH22 ARG 72 2HH2 ARG 72 6.574 -15.421 12.659
573 H VAL 73 H VAL 73 -0.216 -11.122 11.161
574 HA VAL 73 HA VAL 73 -2.604 -12.621 11.554
575 HB VAL 73 HB VAL 73 -1.503 -11.707 8.859
576 HG11 VAL 73 1HG1 VAL 73 -4.364 -12.210 9.782
577 HG12 VAL 73 2HG1 VAL 73 -3.430 -13.230 8.685
578 HG13 VAL 73 3HG1 VAL 73 -3.890 -11.600 8.193
579 HG21 VAL 73 3HG2 VAL 73 -2.757 -9.588 9.184
580 HG22 VAL 73 1HG2 VAL 73 -1.482 -9.781 10.392
581 HG23 VAL 73 2HG2 VAL 73 -3.166 -10.080 10.830
582 H GLN 74 H GLN 74 -0.112 -13.270 8.974
583 HA GLN 74 HA GLN 74 -0.557 -16.136 9.163
584 HB2 GLN 74 2HB GLN 74 1.640 -14.633 7.658
585 HB3 GLN 74 1HB GLN 74 1.362 -16.363 7.562
586 HG2 GLN 74 2HG GLN 74 0.418 -15.525 5.585
587 HG3 GLN 74 1HG GLN 74 -0.972 -15.777 6.633
588 HE21 GLN 74 1HE2 GLN 74 1.112 -13.372 5.176
589 HE22 GLN 74 2HE2 GLN 74 0.054 -12.026 5.407
590 H ARG 75 H ARG 75 -0.171 -16.176 11.507
591 HA ARG 75 HA ARG 75 2.380 -15.539 12.639
592 HB2 ARG 75 2HB ARG 75 0.123 -15.483 13.829
593 HB3 ARG 75 1HB ARG 75 0.175 -17.238 13.893
594 HG2 ARG 75 2HG ARG 75 2.355 -15.517 15.132
595 HG3 ARG 75 1HG ARG 75 0.877 -15.918 15.999
596 HD2 ARG 75 2HD ARG 75 3.037 -17.822 15.037
597 HD3 ARG 75 1HD ARG 75 2.553 -17.488 16.707
598 HE ARG 75 HE ARG 75 0.277 -18.446 15.522
599 HH11 ARG 75 1HH1 ARG 75 3.509 -19.775 15.944
600 HH12 ARG 75 2HH1 ARG 75 2.954 -21.414 15.928
601 HH21 ARG 75 1HH2 ARG 75 -0.405 -20.605 15.417
602 HH22 ARG 75 2HH2 ARG 75 0.743 -21.887 15.629
603 H SER 76 H SER 76 3.878 -16.627 11.491
604 HA SER 76 HA SER 76 4.844 -19.110 12.229
605 HB2 SER 76 2HB SER 76 4.437 -20.367 9.990
606 HB3 SER 76 1HB SER 76 3.056 -20.246 11.081
607 HG SER 76 HG SER 76 2.908 -18.108 9.633
608 H GLN 77 H GLN 77 6.969 -19.201 11.566
609 HA GLN 77 HA GLN 77 7.961 -17.140 9.733
610 HB2 GLN 77 2HB GLN 77 9.492 -19.060 11.537
611 HB3 GLN 77 1HB GLN 77 10.233 -17.838 10.513
612 HG2 GLN 77 2HG GLN 77 10.234 -16.885 12.677
613 HG3 GLN 77 1HG GLN 77 8.900 -16.096 11.847
614 HE21 GLN 77 1HE2 GLN 77 9.768 -18.409 14.323
615 HE22 GLN 77 2HE2 GLN 77 8.234 -18.448 15.116
616 H ASN 78 H ASN 78 6.872 -18.228 7.965
617 HA ASN 78 HA ASN 78 8.575 -19.925 6.409
618 HB2 ASN 78 2HB ASN 78 7.599 -21.777 7.604
619 HB3 ASN 78 1HB ASN 78 5.984 -21.094 7.520
620 HD21 ASN 78 1HD2 ASN 78 8.486 -22.714 5.708
621 HD22 ASN 78 2HD2 ASN 78 7.478 -23.267 4.422
622 HA PRO 79 HA PRO 79 4.965 -18.228 3.645
623 HB2 PRO 79 2HB PRO 79 3.065 -16.733 5.370
624 HB3 PRO 79 1HB PRO 79 2.730 -18.031 4.205
625 HG2 PRO 79 2HG PRO 79 2.475 -18.418 6.857
626 HG3 PRO 79 1HG PRO 79 3.027 -19.714 5.766
627 HD2 PRO 79 2HD PRO 79 4.690 -17.903 7.524
628 HD3 PRO 79 1HD PRO 79 4.773 -19.667 7.323
629 H LEU 80 H LEU 80 5.517 -16.233 6.536
630 HA LEU 80 HA LEU 80 5.556 -13.728 5.154
631 HB2 LEU 80 2HB LEU 80 6.496 -14.462 7.954
632 HB3 LEU 80 1HB LEU 80 6.357 -12.816 7.346
633 HG LEU 80 HG LEU 80 4.078 -14.773 7.834
634 HD11 LEU 80 1HD1 LEU 80 4.986 -13.808 9.882
635 HD12 LEU 80 2HD1 LEU 80 3.366 -13.199 9.557
636 HD13 LEU 80 3HD1 LEU 80 4.770 -12.176 9.236
637 HD21 LEU 80 3HD2 LEU 80 3.933 -11.953 6.714
638 HD22 LEU 80 1HD2 LEU 80 2.554 -12.940 7.210
639 HD23 LEU 80 2HD2 LEU 80 3.554 -13.450 5.855
640 H LYS 81 H LYS 81 7.181 -12.855 4.070
641 HA LYS 81 HA LYS 81 9.983 -13.633 4.582
642 HB2 LYS 81 2HB LYS 81 8.675 -12.313 2.164
643 HB3 LYS 81 1HB LYS 81 10.422 -12.448 2.359
644 HG2 LYS 81 2HG LYS 81 8.471 -14.770 2.192
645 HG3 LYS 81 1HG LYS 81 9.538 -14.213 0.899
646 HD2 LYS 81 2HD LYS 81 11.518 -14.775 2.305
647 HD3 LYS 81 1HD LYS 81 10.436 -15.349 3.581
648 HE2 LYS 81 2HE LYS 81 11.320 -17.235 2.275
649 HE3 LYS 81 1HE LYS 81 9.575 -17.096 2.078
650 HZ1 LYS 81 3HZ LYS 81 10.704 -17.539 -0.015
651 HZ2 LYS 81 1HZ LYS 81 11.593 -16.107 0.138
652 HZ3 LYS 81 2HZ LYS 81 9.915 -16.042 -0.050
653 H ILE 82 H ILE 82 11.098 -12.309 5.784
654 HA ILE 82 HA ILE 82 10.175 -9.777 6.683
655 HB ILE 82 HB ILE 82 12.411 -9.568 7.796
656 HG12 ILE 82 2HG1 ILE 82 13.061 -12.237 6.443
657 HG13 ILE 82 1HG1 ILE 82 13.782 -10.690 6.017
658 HG21 ILE 82 1HG2 ILE 82 12.149 -11.497 9.329
659 HG22 ILE 82 2HG2 ILE 82 11.083 -12.281 8.162
660 HG23 ILE 82 3HG2 ILE 82 10.591 -10.768 8.930
661 HD11 ILE 82 3HD1 ILE 82 14.799 -10.562 8.246
662 HD12 ILE 82 1HD1 ILE 82 15.294 -11.994 7.348
663 HD13 ILE 82 2HD1 ILE 82 14.107 -12.141 8.641
664 H ARG 83 H ARG 83 10.875 -7.735 6.174
665 HA ARG 83 HA ARG 83 12.355 -7.362 3.643
666 HB2 ARG 83 2HB ARG 83 10.028 -6.584 3.543
667 HB3 ARG 83 1HB ARG 83 10.247 -5.629 5.007
668 HG2 ARG 83 2HG ARG 83 11.851 -4.169 3.831
669 HG3 ARG 83 1HG ARG 83 11.664 -5.133 2.363
670 HD2 ARG 83 2HD ARG 83 9.364 -4.448 2.123
671 HD3 ARG 83 1HD ARG 83 9.368 -3.700 3.725
672 HE ARG 83 HE ARG 83 11.282 -2.618 1.820
673 HH11 ARG 83 1HH1 ARG 83 8.076 -2.307 3.197
674 HH12 ARG 83 2HH1 ARG 83 7.916 -0.643 2.773
675 HH21 ARG 83 1HH2 ARG 83 11.097 -0.414 1.297
676 HH22 ARG 83 2HH2 ARG 83 9.639 0.439 1.687
677 H LEU 84 H LEU 84 14.129 -6.080 3.613
678 HA LEU 84 HA LEU 84 15.551 -5.527 6.000
679 HB2 LEU 84 2HB LEU 84 16.094 -4.449 3.202
680 HB3 LEU 84 1HB LEU 84 17.239 -4.509 4.535
681 HG LEU 84 HG LEU 84 16.088 -6.915 3.053
682 HD11 LEU 84 1HD1 LEU 84 18.373 -7.256 2.239
683 HD12 LEU 84 2HD1 LEU 84 18.897 -5.776 3.048
684 HD13 LEU 84 3HD1 LEU 84 17.728 -5.698 1.726
685 HD21 LEU 84 3HD2 LEU 84 18.085 -6.879 5.346
686 HD22 LEU 84 1HD2 LEU 84 17.637 -8.297 4.389
687 HD23 LEU 84 2HD2 LEU 84 16.435 -7.504 5.401
688 H THR 85 H THR 85 15.301 -3.868 7.317
689 HA THR 85 HA THR 85 14.068 -1.319 6.408
690 HB THR 85 HB THR 85 12.649 -2.601 7.988
691 HG1 THR 85 HG1 THR 85 12.621 -0.333 8.091
692 HG21 THR 85 3HG2 THR 85 14.938 -2.335 9.975
693 HG22 THR 85 1HG2 THR 85 14.391 -3.845 9.239
694 HG23 THR 85 2HG2 THR 85 13.330 -2.960 10.338
695 H ARG 86 H ARG 86 14.741 0.536 8.096
696 HA ARG 86 HA ARG 86 17.526 0.938 7.928
697 HB2 ARG 86 2HB ARG 86 15.402 2.375 9.529
698 HB3 ARG 86 1HB ARG 86 17.094 2.812 9.700
699 HG2 ARG 86 2HG ARG 86 17.180 3.321 7.273
700 HG3 ARG 86 1HG ARG 86 15.451 2.964 7.164
701 HD2 ARG 86 2HD ARG 86 16.002 5.420 7.363
702 HD3 ARG 86 1HD ARG 86 14.894 4.823 8.596
703 HE ARG 86 HE ARG 86 16.411 5.415 10.182
704 HH11 ARG 86 1HH1 ARG 86 18.239 5.166 7.168
705 HH12 ARG 86 2HH1 ARG 86 19.700 5.762 7.886
706 HH21 ARG 86 1HH2 ARG 86 18.340 6.177 11.059
707 HH22 ARG 86 2HH2 ARG 86 19.751 6.332 10.073
708 H GLU 87 H GLU 87 18.782 -0.594 8.907
709 HA GLU 87 HA GLU 87 18.734 -1.238 11.678
710 HB2 GLU 87 2HB GLU 87 21.000 -1.114 9.642
711 HB3 GLU 87 1HB GLU 87 21.243 -1.641 11.304
712 HG2 GLU 87 2HG GLU 87 19.428 -2.981 9.266
713 HG3 GLU 87 1HG GLU 87 21.011 -3.563 9.786
714 H ALA 88 H ALA 88 19.125 0.055 13.362
715 HA ALA 88 HA ALA 88 19.384 1.870 14.636
716 HB1 ALA 88 3HB ALA 88 21.222 3.461 14.246
717 HB2 ALA 88 1HB ALA 88 21.463 2.800 12.625
718 HB3 ALA 88 2HB ALA 88 21.774 1.795 14.040
719 HA PRO 89 HA PRO 89 15.947 4.002 12.231
720 HB2 PRO 89 2HB PRO 89 15.461 4.496 15.187
721 HB3 PRO 89 1HB PRO 89 14.289 4.174 13.890
722 HG2 PRO 89 2HG PRO 89 14.976 2.228 15.566
723 HG3 PRO 89 1HG PRO 89 14.756 1.890 13.834
724 HD2 PRO 89 2HD PRO 89 17.296 2.086 15.404
725 HD3 PRO 89 1HD PRO 89 16.927 1.091 13.977
Start of MODEL 8
1 H1 HIS 1 1H HIS 1 6.357 -22.672 -5.834
2 H2 HIS 1 2H HIS 1 4.952 -22.118 -5.083
3 H3 HIS 1 3H HIS 1 5.144 -21.928 -6.748
4 HA HIS 1 HA HIS 1 3.630 -23.715 -6.322
5 HB2 HIS 1 2HB HIS 1 6.332 -24.833 -7.219
6 HB3 HIS 1 1HB HIS 1 4.753 -25.514 -7.606
7 HD1 HIS 1 HD1 HIS 1 3.271 -24.129 -9.317
8 HD2 HIS 1 HD2 HIS 1 7.193 -22.811 -8.911
9 HE1 HIS 1 HE1 HIS 1 3.681 -22.584 -11.250
10 HE2 HIS 1 HE2 HIS 1 6.093 -21.919 -11.057
11 H HIS 2 H HIS 2 6.669 -23.958 -4.606
12 HA HIS 2 HA HIS 2 6.099 -26.338 -3.107
13 HB2 HIS 2 2HB HIS 2 8.432 -25.710 -3.552
14 HB3 HIS 2 1HB HIS 2 8.203 -24.133 -2.805
15 HD1 HIS 2 HD1 HIS 2 8.193 -27.812 -1.810
16 HD2 HIS 2 HD2 HIS 2 8.974 -24.075 -0.179
17 HE1 HIS 2 HE1 HIS 2 8.971 -28.242 0.529
18 HE2 HIS 2 HE2 HIS 2 9.356 -25.963 1.519
19 H HIS 3 H HIS 3 5.536 -26.478 -0.923
20 HA HIS 3 HA HIS 3 3.680 -24.771 0.266
21 HB2 HIS 3 2HB HIS 3 3.840 -27.086 0.944
22 HB3 HIS 3 1HB HIS 3 5.525 -26.907 1.409
23 HD1 HIS 3 HD1 HIS 3 6.024 -25.955 3.755
24 HD2 HIS 3 HD2 HIS 3 1.970 -26.161 2.881
25 HE1 HIS 3 HE1 HIS 3 4.847 -25.637 5.944
26 HE2 HIS 3 HE2 HIS 3 2.401 -25.603 5.357
27 H HIS 4 H HIS 4 4.023 -22.711 0.884
28 HA HIS 4 HA HIS 4 6.611 -21.690 1.705
29 HB2 HIS 4 2HB HIS 4 3.862 -20.361 1.537
30 HB3 HIS 4 1HB HIS 4 5.307 -19.516 2.072
31 HD1 HIS 4 HD1 HIS 4 6.834 -18.581 0.303
32 HD2 HIS 4 HD2 HIS 4 3.966 -21.155 -1.254
33 HE1 HIS 4 HE1 HIS 4 6.977 -18.331 -2.188
34 HE2 HIS 4 HE2 HIS 4 5.432 -20.090 -3.077
35 H HIS 5 H HIS 5 6.970 -20.620 3.728
36 HA HIS 5 HA HIS 5 5.046 -21.020 5.908
37 HB2 HIS 5 2HB HIS 5 6.791 -22.879 6.011
38 HB3 HIS 5 1HB HIS 5 8.025 -21.646 6.243
39 HD1 HIS 5 HD1 HIS 5 8.614 -21.343 8.642
40 HD2 HIS 5 HD2 HIS 5 4.655 -22.522 8.175
41 HE1 HIS 5 HE1 HIS 5 7.680 -21.549 10.961
42 HE2 HIS 5 HE2 HIS 5 5.321 -22.346 10.653
43 H HIS 6 H HIS 6 6.594 -18.935 4.037
44 HA HIS 6 HA HIS 6 6.504 -16.740 5.917
45 HB2 HIS 6 2HB HIS 6 8.795 -17.542 6.319
46 HB3 HIS 6 1HB HIS 6 9.143 -17.554 4.592
47 HD1 HIS 6 HD1 HIS 6 8.666 -15.210 7.503
48 HD2 HIS 6 HD2 HIS 6 9.875 -15.072 3.534
49 HE1 HIS 6 HE1 HIS 6 9.617 -12.917 7.160
50 HE2 HIS 6 HE2 HIS 6 10.322 -12.857 4.748
51 H SER 7 H SER 7 5.104 -15.611 4.697
52 HA SER 7 HA SER 7 5.679 -14.881 1.908
53 HB2 SER 7 2HB SER 7 3.405 -14.038 3.777
54 HB3 SER 7 1HB SER 7 3.507 -13.675 2.054
55 HG SER 7 HG SER 7 2.172 -15.483 2.597
56 H HIS 8 H HIS 8 5.132 -12.216 1.724
57 HA HIS 8 HA HIS 8 7.041 -10.638 3.035
58 HB2 HIS 8 2HB HIS 8 4.333 -9.975 1.828
59 HB3 HIS 8 1HB HIS 8 5.235 -8.728 2.678
60 HD1 HIS 8 HD1 HIS 8 6.421 -7.279 1.115
61 HD2 HIS 8 HD2 HIS 8 6.269 -11.193 -0.292
62 HE1 HIS 8 HE1 HIS 8 7.582 -7.253 -1.103
63 HE2 HIS 8 HE2 HIS 8 7.393 -9.598 -1.986
64 H MET 9 H MET 9 7.213 -9.924 5.104
65 HA MET 9 HA MET 9 5.672 -10.997 7.179
66 HB2 MET 9 2HB MET 9 6.960 -9.561 8.713
67 HB3 MET 9 1HB MET 9 8.012 -10.317 7.529
68 HG2 MET 9 2HG MET 9 8.099 -8.184 6.267
69 HG3 MET 9 1HG MET 9 7.069 -7.437 7.486
70 HE1 MET 9 3HE MET 9 11.399 -8.875 8.291
71 HE2 MET 9 1HE MET 9 10.612 -8.965 6.718
72 HE3 MET 9 2HE MET 9 10.080 -10.018 8.031
73 H VAL 10 H VAL 10 3.965 -10.317 8.281
74 HA VAL 10 HA VAL 10 2.090 -8.523 7.175
75 HB VAL 10 HB VAL 10 0.731 -9.042 9.217
76 HG11 VAL 10 1HG1 VAL 10 0.582 -11.499 8.880
77 HG12 VAL 10 2HG1 VAL 10 2.112 -11.472 8.005
78 HG13 VAL 10 3HG1 VAL 10 0.704 -10.639 7.344
79 HG21 VAL 10 3HG2 VAL 10 3.210 -10.522 10.204
80 HG22 VAL 10 1HG2 VAL 10 1.617 -10.577 10.966
81 HG23 VAL 10 2HG2 VAL 10 2.526 -9.064 10.924
82 H GLY 11 H GLY 11 1.515 -6.408 7.764
83 HA2 GLY 11 2HA GLY 11 1.727 -4.380 8.917
84 HA3 GLY 11 1HA GLY 11 3.062 -5.032 9.841
85 H ASP 12 H ASP 12 3.295 -5.632 6.472
86 HA ASP 12 HA ASP 12 5.776 -4.452 6.095
87 HB2 ASP 12 2HB ASP 12 4.693 -6.195 4.647
88 HB3 ASP 12 1HB ASP 12 3.658 -4.949 3.974
89 H THR 13 H THR 13 6.393 -2.353 6.087
90 HA THR 13 HA THR 13 4.458 -0.261 6.309
91 HB THR 13 HB THR 13 7.497 -0.010 6.181
92 HG1 THR 13 HG1 THR 13 5.918 -1.178 8.042
93 HG21 THR 13 3HG2 THR 13 6.320 2.160 5.945
94 HG22 THR 13 1HG2 THR 13 7.144 2.057 7.502
95 HG23 THR 13 2HG2 THR 13 5.397 1.825 7.412
96 H VAL 14 H VAL 14 3.479 0.489 4.515
97 HA VAL 14 HA VAL 14 5.045 1.255 2.128
98 HB VAL 14 HB VAL 14 3.241 0.511 0.633
99 HG11 VAL 14 1HG1 VAL 14 5.079 -1.059 1.057
100 HG12 VAL 14 2HG1 VAL 14 3.570 -1.926 0.768
101 HG13 VAL 14 3HG1 VAL 14 4.191 -1.760 2.413
102 HG21 VAL 14 3HG2 VAL 14 1.349 -0.875 1.434
103 HG22 VAL 14 1HG2 VAL 14 1.311 0.742 2.142
104 HG23 VAL 14 2HG2 VAL 14 1.871 -0.629 3.103
105 H TRP 15 H TRP 15 3.447 2.532 0.636
106 HA TRP 15 HA TRP 15 1.791 4.476 2.121
107 HB2 TRP 15 2HB TRP 15 3.868 5.053 -0.059
108 HB3 TRP 15 1HB TRP 15 2.695 6.240 0.507
109 HD1 TRP 15 HD1 TRP 15 3.091 5.477 3.689
110 HE1 TRP 15 HE1 TRP 15 5.177 6.372 4.872
111 HE3 TRP 15 HE3 TRP 15 6.049 6.353 -0.386
112 HZ2 TRP 15 HZ2 TRP 15 7.721 7.325 4.209
113 HZ3 TRP 15 HZ3 TRP 15 8.314 7.257 -0.016
114 HH2 TRP 15 HH2 TRP 15 9.134 7.733 2.237
115 H VAL 16 H VAL 16 0.060 5.384 0.789
116 HA VAL 16 HA VAL 16 -0.623 3.710 -1.571
117 HB VAL 16 HB VAL 16 -2.533 5.174 0.313
118 HG11 VAL 16 1HG1 VAL 16 -4.373 4.174 -1.066
119 HG12 VAL 16 2HG1 VAL 16 -3.166 3.581 -2.209
120 HG13 VAL 16 3HG1 VAL 16 -3.400 5.317 -1.998
121 HG21 VAL 16 3HG2 VAL 16 -3.358 2.895 0.853
122 HG22 VAL 16 1HG2 VAL 16 -1.641 3.057 1.240
123 HG23 VAL 16 2HG2 VAL 16 -2.143 2.201 -0.219
124 H ARG 17 H ARG 17 0.036 4.724 -3.248
125 HA ARG 17 HA ARG 17 0.128 7.582 -3.664
126 HB2 ARG 17 2HB ARG 17 1.939 6.065 -4.416
127 HB3 ARG 17 1HB ARG 17 0.797 5.151 -5.391
128 HG2 ARG 17 2HG ARG 17 0.434 7.226 -6.764
129 HG3 ARG 17 1HG ARG 17 1.751 7.984 -5.865
130 HD2 ARG 17 2HD ARG 17 3.298 6.239 -6.679
131 HD3 ARG 17 1HD ARG 17 1.970 5.456 -7.540
132 HE ARG 17 HE ARG 17 2.602 8.240 -8.210
133 HH11 ARG 17 1HH1 ARG 17 2.773 4.859 -9.174
134 HH12 ARG 17 2HH1 ARG 17 3.125 5.229 -10.832
135 HH21 ARG 17 1HH2 ARG 17 3.062 8.705 -10.395
136 HH22 ARG 17 2HH2 ARG 17 3.287 7.402 -11.517
137 H ARG 18 H ARG 18 -1.871 8.568 -4.119
138 HA ARG 18 HA ARG 18 -3.734 7.191 -5.980
139 HB2 ARG 18 2HB ARG 18 -4.514 6.871 -3.678
140 HB3 ARG 18 1HB ARG 18 -4.461 8.611 -3.390
141 HG2 ARG 18 2HG ARG 18 -6.248 8.942 -5.089
142 HG3 ARG 18 1HG ARG 18 -6.283 7.203 -5.389
143 HD2 ARG 18 2HD ARG 18 -6.923 8.511 -2.726
144 HD3 ARG 18 1HD ARG 18 -8.128 7.999 -3.909
145 HE ARG 18 HE ARG 18 -7.338 5.698 -3.580
146 HH11 ARG 18 1HH1 ARG 18 -6.527 8.009 -1.049
147 HH12 ARG 18 2HH1 ARG 18 -6.350 6.786 0.171
148 HH21 ARG 18 1HH2 ARG 18 -7.135 4.123 -1.970
149 HH22 ARG 18 2HH2 ARG 18 -6.696 4.583 -0.357
150 H HIS 19 H HIS 19 -4.562 8.379 -7.554
151 HA HIS 19 HA HIS 19 -4.467 11.344 -7.496
152 HB2 HIS 19 2HB HIS 19 -4.164 11.206 -10.026
153 HB3 HIS 19 1HB HIS 19 -2.784 10.656 -9.096
154 HD1 HIS 19 HD1 HIS 19 -5.241 9.523 -11.605
155 HD2 HIS 19 HD2 HIS 19 -2.375 7.795 -9.157
156 HE1 HIS 19 HE1 HIS 19 -4.845 7.239 -12.540
157 HE2 HIS 19 HE2 HIS 19 -2.949 6.309 -11.186
158 H GLN 20 H GLN 20 -6.321 12.372 -8.210
159 HA GLN 20 HA GLN 20 -8.795 10.961 -8.201
160 HB2 GLN 20 2HB GLN 20 -8.194 13.808 -9.114
161 HB3 GLN 20 1HB GLN 20 -9.802 13.159 -8.818
162 HG2 GLN 20 2HG GLN 20 -7.617 13.479 -6.742
163 HG3 GLN 20 1HG GLN 20 -8.996 14.552 -6.946
164 HE21 GLN 20 1HE2 GLN 20 -11.077 13.821 -6.325
165 HE22 GLN 20 2HE2 GLN 20 -11.272 12.473 -5.259
166 H THR 21 H THR 21 -6.901 12.490 -10.783
167 HA THR 21 HA THR 21 -8.004 10.590 -12.730
168 HB THR 21 HB THR 21 -9.240 12.774 -13.029
169 HG1 THR 21 HG1 THR 21 -9.297 11.984 -14.974
170 HG21 THR 21 3HG2 THR 21 -7.433 14.361 -12.423
171 HG22 THR 21 1HG2 THR 21 -8.076 14.706 -14.031
172 HG23 THR 21 2HG2 THR 21 -6.526 13.879 -13.859
173 H LYS 22 H LYS 22 -6.621 10.799 -14.832
174 HA LYS 22 HA LYS 22 -4.102 9.750 -14.254
175 HB2 LYS 22 2HB LYS 22 -4.984 10.997 -16.889
176 HB3 LYS 22 1HB LYS 22 -3.706 9.802 -16.678
177 HG2 LYS 22 2HG LYS 22 -5.311 8.079 -16.120
178 HG3 LYS 22 1HG LYS 22 -6.629 9.254 -16.051
179 HD2 LYS 22 2HD LYS 22 -5.046 8.537 -18.559
180 HD3 LYS 22 1HD LYS 22 -6.656 7.923 -18.167
181 HE2 LYS 22 2HE LYS 22 -7.567 10.219 -18.267
182 HE3 LYS 22 1HE LYS 22 -5.956 10.858 -18.598
183 HZ1 LYS 22 3HZ LYS 22 -5.932 9.568 -20.647
184 HZ2 LYS 22 1HZ LYS 22 -7.210 10.677 -20.613
185 HZ3 LYS 22 2HZ LYS 22 -7.505 9.034 -20.345
186 H ASN 23 H ASN 23 -5.050 12.990 -15.308
187 HA ASN 23 HA ASN 23 -2.391 13.959 -15.804
188 HB2 ASN 23 2HB ASN 23 -4.391 14.687 -17.097
189 HB3 ASN 23 1HB ASN 23 -5.046 15.454 -15.659
190 HD21 ASN 23 1HD2 ASN 23 -4.297 17.486 -15.082
191 HD22 ASN 23 2HD2 ASN 23 -3.176 18.389 -16.039
192 H LEU 24 H LEU 24 -4.590 14.053 -13.046
193 HA LEU 24 HA LEU 24 -3.106 16.039 -11.568
194 HB2 LEU 24 2HB LEU 24 -5.229 14.043 -10.702
195 HB3 LEU 24 1HB LEU 24 -4.451 15.139 -9.570
196 HG LEU 24 HG LEU 24 -6.168 15.976 -11.947
197 HD11 LEU 24 1HD1 LEU 24 -7.783 16.753 -10.288
198 HD12 LEU 24 2HD1 LEU 24 -6.769 16.130 -8.982
199 HD13 LEU 24 3HD1 LEU 24 -7.503 15.019 -10.139
200 HD21 LEU 24 3HD2 LEU 24 -5.975 18.267 -11.061
201 HD22 LEU 24 1HD2 LEU 24 -4.413 17.625 -11.554
202 HD23 LEU 24 2HD2 LEU 24 -4.827 17.707 -9.840
203 H GLU 25 H GLU 25 -1.768 15.739 -9.803
204 HA GLU 25 HA GLU 25 0.223 13.773 -9.996
205 HB2 GLU 25 2HB GLU 25 -0.441 15.682 -7.715
206 HB3 GLU 25 1HB GLU 25 1.062 14.763 -7.836
207 HG2 GLU 25 2HG GLU 25 1.724 15.964 -9.831
208 HG3 GLU 25 1HG GLU 25 0.144 16.738 -9.951
209 HA PRO 26 HA PRO 26 -1.754 10.505 -7.527
210 HB2 PRO 26 2HB PRO 26 0.811 9.052 -7.761
211 HB3 PRO 26 1HB PRO 26 -0.772 8.629 -8.435
212 HG2 PRO 26 2HG PRO 26 1.264 9.396 -10.015
213 HG3 PRO 26 1HG PRO 26 -0.424 9.829 -10.384
214 HD2 PRO 26 2HD PRO 26 1.685 11.527 -9.034
215 HD3 PRO 26 1HD PRO 26 0.585 11.960 -10.365
216 H ARG 27 H ARG 27 -1.819 11.811 -5.690
217 HA ARG 27 HA ARG 27 0.455 12.452 -4.071
218 HB2 ARG 27 2HB ARG 27 -1.626 13.868 -4.309
219 HB3 ARG 27 1HB ARG 27 -2.503 12.660 -3.375
220 HG2 ARG 27 2HG ARG 27 -1.061 13.104 -1.424
221 HG3 ARG 27 1HG ARG 27 -0.129 14.261 -2.375
222 HD2 ARG 27 2HD ARG 27 -3.024 14.502 -1.528
223 HD3 ARG 27 1HD ARG 27 -1.666 15.478 -0.963
224 HE ARG 27 HE ARG 27 -2.555 15.527 -3.789
225 HH11 ARG 27 1HH1 ARG 27 -1.838 17.308 -0.837
226 HH12 ARG 27 2HH1 ARG 27 -2.026 18.855 -1.594
227 HH21 ARG 27 1HH2 ARG 27 -2.832 17.534 -4.737
228 HH22 ARG 27 2HH2 ARG 27 -2.598 18.983 -3.818
229 H TRP 28 H TRP 28 1.426 11.051 -2.732
230 HA TRP 28 HA TRP 28 0.166 8.576 -1.918
231 HB2 TRP 28 2HB TRP 28 2.360 7.969 -0.980
232 HB3 TRP 28 1HB TRP 28 2.540 8.551 -2.627
233 HD1 TRP 28 HD1 TRP 28 3.814 10.948 -2.954
234 HE1 TRP 28 HE1 TRP 28 5.473 12.199 -1.431
235 HE3 TRP 28 HE3 TRP 28 2.886 8.533 1.470
236 HZ2 TRP 28 HZ2 TRP 28 6.270 12.183 1.263
237 HZ3 TRP 28 HZ3 TRP 28 4.133 9.222 3.476
238 HH2 TRP 28 HH2 TRP 28 5.793 11.014 3.376
239 H LYS 29 H LYS 29 -0.490 8.032 0.081
240 HA LYS 29 HA LYS 29 -0.223 9.941 2.335
241 HB2 LYS 29 2HB LYS 29 -2.301 7.748 1.896
242 HB3 LYS 29 1HB LYS 29 -2.188 8.769 3.331
243 HG2 LYS 29 2HG LYS 29 -2.649 10.762 1.906
244 HG3 LYS 29 1HG LYS 29 -2.848 9.685 0.513
245 HD2 LYS 29 2HD LYS 29 -4.738 8.560 1.650
246 HD3 LYS 29 1HD LYS 29 -4.520 9.598 3.063
247 HE2 LYS 29 2HE LYS 29 -5.298 10.519 0.280
248 HE3 LYS 29 1HE LYS 29 -6.383 10.372 1.664
249 HZ1 LYS 29 3HZ LYS 29 -4.081 12.231 1.424
250 HZ2 LYS 29 1HZ LYS 29 -5.039 12.053 2.807
251 HZ3 LYS 29 2HZ LYS 29 -5.718 12.637 1.376
252 H GLY 30 H GLY 30 0.163 8.931 4.441
253 HA2 GLY 30 2HA GLY 30 0.856 6.205 4.725
254 HA3 GLY 30 1HA GLY 30 2.298 7.138 4.417
255 HA PRO 31 HA PRO 31 2.761 5.232 5.809
256 HB2 PRO 31 2HB PRO 31 3.338 3.766 8.000
257 HB3 PRO 31 1HB PRO 31 4.253 5.247 7.636
258 HG2 PRO 31 2HG PRO 31 2.014 4.865 9.610
259 HG3 PRO 31 1HG PRO 31 3.538 5.762 9.802
260 HD2 PRO 31 2HD PRO 31 1.104 6.953 9.154
261 HD3 PRO 31 1HD PRO 31 2.689 7.668 8.797
262 H TYR 32 H TYR 32 2.174 3.033 5.528
263 HA TYR 32 HA TYR 32 -0.406 2.069 6.591
264 HB2 TYR 32 2HB TYR 32 0.533 2.039 3.696
265 HB3 TYR 32 1HB TYR 32 -0.741 0.981 4.278
266 HD1 TYR 32 HD2 TYR 32 0.129 4.478 3.463
267 HD2 TYR 32 HD1 TYR 32 -2.962 1.872 4.851
268 HE1 TYR 32 HE2 TYR 32 -1.535 6.225 3.065
269 HE2 TYR 32 HE1 TYR 32 -4.626 3.635 4.445
270 HH TYR 32 HH TYR 32 -4.653 6.143 4.289
271 H THR 33 H THR 33 -0.613 -0.328 6.286
272 HA THR 33 HA THR 33 1.954 -1.762 6.555
273 HB THR 33 HB THR 33 1.038 -2.940 8.595
274 HG1 THR 33 HG1 THR 33 -1.179 -2.498 8.311
275 HG21 THR 33 3HG2 THR 33 1.283 0.068 8.943
276 HG22 THR 33 1HG2 THR 33 2.619 -1.086 8.923
277 HG23 THR 33 2HG2 THR 33 1.431 -1.137 10.228
278 H VAL 34 H VAL 34 1.849 -3.304 5.008
279 HA VAL 34 HA VAL 34 -0.613 -4.434 4.024
280 HB VAL 34 HB VAL 34 2.245 -5.278 3.372
281 HG11 VAL 34 1HG1 VAL 34 1.283 -6.257 1.309
282 HG12 VAL 34 2HG1 VAL 34 -0.334 -5.826 1.872
283 HG13 VAL 34 3HG1 VAL 34 0.625 -7.008 2.765
284 HG21 VAL 34 3HG2 VAL 34 2.097 -3.878 1.366
285 HG22 VAL 34 1HG2 VAL 34 1.887 -2.899 2.818
286 HG23 VAL 34 2HG2 VAL 34 0.488 -3.340 1.840
287 H LEU 35 H LEU 35 -1.618 -6.082 4.973
288 HA LEU 35 HA LEU 35 -0.283 -7.803 6.934
289 HB2 LEU 35 2HB LEU 35 -3.213 -7.677 6.129
290 HB3 LEU 35 1HB LEU 35 -2.550 -8.576 7.491
291 HG LEU 35 HG LEU 35 -2.600 -5.538 7.211
292 HD11 LEU 35 1HD1 LEU 35 -4.200 -5.579 9.051
293 HD12 LEU 35 2HD1 LEU 35 -4.178 -7.346 9.059
294 HD13 LEU 35 3HD1 LEU 35 -4.805 -6.470 7.657
295 HD21 LEU 35 3HD2 LEU 35 -1.743 -5.476 9.529
296 HD22 LEU 35 1HD2 LEU 35 -0.589 -6.219 8.425
297 HD23 LEU 35 2HD2 LEU 35 -1.549 -7.231 9.510
298 H LEU 36 H LEU 36 -1.401 -7.900 3.634
299 HA LEU 36 HA LEU 36 -0.233 -10.554 3.298
300 HB2 LEU 36 2HB LEU 36 -2.511 -11.161 3.912
301 HB3 LEU 36 1HB LEU 36 -3.181 -10.021 2.755
302 HG LEU 36 HG LEU 36 -2.228 -11.417 0.880
303 HD11 LEU 36 1HD1 LEU 36 -1.439 -13.702 1.336
304 HD12 LEU 36 2HD1 LEU 36 -1.471 -13.366 3.069
305 HD13 LEU 36 3HD1 LEU 36 -0.371 -12.475 2.015
306 HD21 LEU 36 3HD2 LEU 36 -4.557 -11.684 1.558
307 HD22 LEU 36 1HD2 LEU 36 -4.091 -12.915 2.736
308 HD23 LEU 36 2HD2 LEU 36 -3.873 -13.212 1.009
309 H THR 37 H THR 37 0.600 -10.815 1.281
310 HA THR 37 HA THR 37 0.099 -8.738 -0.766
311 HB THR 37 HB THR 37 2.291 -9.553 -1.756
312 HG1 THR 37 HG1 THR 37 2.074 -11.641 -0.433
313 HG21 THR 37 3HG2 THR 37 2.200 -7.559 -0.256
314 HG22 THR 37 1HG2 THR 37 3.730 -8.429 -0.127
315 HG23 THR 37 2HG2 THR 37 2.503 -8.612 1.123
316 H THR 38 H THR 38 -0.900 -9.306 -2.589
317 HA THR 38 HA THR 38 -1.218 -12.144 -3.364
318 HB THR 38 HB THR 38 -3.547 -11.489 -4.183
319 HG1 THR 38 HG1 THR 38 -2.956 -9.126 -3.976
320 HG21 THR 38 3HG2 THR 38 -3.121 -11.223 -1.178
321 HG22 THR 38 1HG2 THR 38 -3.338 -12.733 -2.072
322 HG23 THR 38 2HG2 THR 38 -4.662 -11.573 -1.965
323 HA PRO 39 HA PRO 39 0.165 -11.223 -7.534
324 HB2 PRO 39 2HB PRO 39 -2.128 -11.798 -9.139
325 HB3 PRO 39 1HB PRO 39 -0.880 -12.960 -8.644
326 HG2 PRO 39 2HG PRO 39 -3.544 -12.413 -7.386
327 HG3 PRO 39 1HG PRO 39 -2.718 -13.970 -7.633
328 HD2 PRO 39 2HD PRO 39 -2.733 -12.874 -5.221
329 HD3 PRO 39 1HD PRO 39 -1.235 -13.618 -5.821
330 H THR 40 H THR 40 0.554 -9.176 -7.983
331 HA THR 40 HA THR 40 0.503 -7.025 -8.496
332 HB THR 40 HB THR 40 -0.378 -8.040 -10.643
333 HG1 THR 40 HG1 THR 40 0.314 -5.895 -10.593
334 HG21 THR 40 3HG2 THR 40 -2.683 -7.511 -11.374
335 HG22 THR 40 1HG2 THR 40 -3.052 -6.876 -9.768
336 HG23 THR 40 2HG2 THR 40 -2.706 -8.592 -9.979
337 H ALA 41 H ALA 41 -1.189 -7.838 -6.075
338 HA ALA 41 HA ALA 41 -2.372 -5.189 -5.587
339 HB1 ALA 41 3HB ALA 41 -4.250 -6.513 -6.515
340 HB2 ALA 41 1HB ALA 41 -4.524 -6.111 -4.819
341 HB3 ALA 41 2HB ALA 41 -4.007 -7.739 -5.271
342 H LEU 42 H LEU 42 -2.266 -4.616 -3.422
343 HA LEU 42 HA LEU 42 -1.096 -6.597 -1.555
344 HB2 LEU 42 2HB LEU 42 -0.726 -3.579 -1.510
345 HB3 LEU 42 1HB LEU 42 0.014 -4.733 -0.410
346 HG LEU 42 HG LEU 42 0.651 -4.310 -3.360
347 HD11 LEU 42 1HD1 LEU 42 2.912 -3.833 -2.550
348 HD12 LEU 42 2HD1 LEU 42 2.370 -4.046 -0.881
349 HD13 LEU 42 3HD1 LEU 42 1.720 -2.732 -1.866
350 HD21 LEU 42 3HD2 LEU 42 1.673 -6.543 -1.578
351 HD22 LEU 42 1HD2 LEU 42 2.307 -6.133 -3.173
352 HD23 LEU 42 2HD2 LEU 42 0.656 -6.717 -3.006
353 H LYS 43 H LYS 43 -2.369 -7.139 0.064
354 HA LYS 43 HA LYS 43 -4.776 -5.649 0.731
355 HB2 LYS 43 2HB LYS 43 -4.855 -8.127 0.606
356 HB3 LYS 43 1HB LYS 43 -3.657 -8.242 1.891
357 HG2 LYS 43 2HG LYS 43 -5.217 -7.248 3.489
358 HG3 LYS 43 1HG LYS 43 -6.406 -6.990 2.206
359 HD2 LYS 43 2HD LYS 43 -6.583 -9.438 1.887
360 HD3 LYS 43 1HD LYS 43 -5.392 -9.693 3.166
361 HE2 LYS 43 2HE LYS 43 -6.935 -8.611 4.776
362 HE3 LYS 43 1HE LYS 43 -8.132 -8.425 3.493
363 HZ1 LYS 43 3HZ LYS 43 -8.212 -10.821 3.279
364 HZ2 LYS 43 1HZ LYS 43 -8.564 -10.361 4.871
365 HZ3 LYS 43 2HZ LYS 43 -7.045 -10.999 4.488
366 H VAL 44 H VAL 44 -4.556 -3.981 1.995
367 HA VAL 44 HA VAL 44 -2.395 -3.788 4.008
368 HB VAL 44 HB VAL 44 -3.892 -1.554 2.563
369 HG11 VAL 44 1HG1 VAL 44 -3.056 -0.833 4.755
370 HG12 VAL 44 2HG1 VAL 44 -2.164 -0.035 3.459
371 HG13 VAL 44 3HG1 VAL 44 -1.433 -1.384 4.334
372 HG21 VAL 44 3HG2 VAL 44 -1.852 -1.174 1.227
373 HG22 VAL 44 1HG2 VAL 44 -2.483 -2.803 0.961
374 HG23 VAL 44 2HG2 VAL 44 -1.080 -2.558 2.001
375 H ASP 45 H ASP 45 -2.921 -3.176 6.079
376 HA ASP 45 HA ASP 45 -5.482 -3.469 7.204
377 HB2 ASP 45 2HB ASP 45 -3.330 -3.746 8.457
378 HB3 ASP 45 1HB ASP 45 -3.029 -2.023 8.315
379 H GLY 46 H GLY 46 -7.101 -1.994 7.604
380 HA2 GLY 46 2HA GLY 46 -8.143 0.066 7.935
381 HA3 GLY 46 1HA GLY 46 -6.705 0.899 7.363
382 H ILE 47 H ILE 47 -6.726 -1.027 4.988
383 HA ILE 47 HA ILE 47 -8.387 0.534 3.188
384 HB ILE 47 HB ILE 47 -6.419 -1.760 2.760
385 HG12 ILE 47 2HG1 ILE 47 -5.334 0.330 3.429
386 HG13 ILE 47 1HG1 ILE 47 -4.969 0.006 1.741
387 HG21 ILE 47 1HG2 ILE 47 -8.083 -1.907 0.965
388 HG22 ILE 47 2HG2 ILE 47 -6.534 -1.355 0.323
389 HG23 ILE 47 3HG2 ILE 47 -7.844 -0.202 0.582
390 HD11 ILE 47 3HD1 ILE 47 -6.657 1.676 1.079
391 HD12 ILE 47 1HD1 ILE 47 -5.378 2.344 2.092
392 HD13 ILE 47 2HD1 ILE 47 -6.963 2.014 2.788
393 H ALA 48 H ALA 48 -9.983 -0.434 1.763
394 HA ALA 48 HA ALA 48 -11.912 -2.003 3.064
395 HB1 ALA 48 3HB ALA 48 -13.098 -2.030 0.906
396 HB2 ALA 48 1HB ALA 48 -11.646 -1.461 0.080
397 HB3 ALA 48 2HB ALA 48 -12.460 -0.423 1.253
398 H ALA 49 H ALA 49 -9.705 -2.980 0.347
399 HA ALA 49 HA ALA 49 -9.530 -5.668 1.490
400 HB1 ALA 49 3HB ALA 49 -11.517 -5.832 0.030
401 HB2 ALA 49 1HB ALA 49 -10.192 -6.824 -0.583
402 HB3 ALA 49 2HB ALA 49 -10.564 -5.275 -1.346
403 H TRP 50 H TRP 50 -8.712 -3.931 -1.567
404 HA TRP 50 HA TRP 50 -5.866 -4.577 -1.181
405 HB2 TRP 50 2HB TRP 50 -7.458 -5.417 -3.650
406 HB3 TRP 50 1HB TRP 50 -5.702 -5.338 -3.620
407 HD1 TRP 50 HD1 TRP 50 -4.460 -7.110 -1.870
408 HE1 TRP 50 HE1 TRP 50 -5.140 -9.500 -1.242
409 HE3 TRP 50 HE3 TRP 50 -9.367 -6.992 -3.329
410 HZ2 TRP 50 HZ2 TRP 50 -7.427 -11.144 -1.345
411 HZ3 TRP 50 HZ3 TRP 50 -10.729 -9.023 -3.045
412 HH2 TRP 50 HH2 TRP 50 -9.781 -11.062 -2.072
413 H ILE 51 H ILE 51 -4.575 -3.007 -1.818
414 HA ILE 51 HA ILE 51 -5.468 -0.941 -3.732
415 HB ILE 51 HB ILE 51 -2.995 -1.004 -1.918
416 HG12 ILE 51 2HG1 ILE 51 -5.115 -0.637 -0.642
417 HG13 ILE 51 1HG1 ILE 51 -4.074 0.779 -0.601
418 HG21 ILE 51 1HG2 ILE 51 -2.630 1.355 -2.622
419 HG22 ILE 51 2HG2 ILE 51 -3.967 1.211 -3.766
420 HG23 ILE 51 3HG2 ILE 51 -2.514 0.233 -3.980
421 HD11 ILE 51 3HD1 ILE 51 -6.404 1.370 -0.860
422 HD12 ILE 51 1HD1 ILE 51 -6.510 0.430 -2.346
423 HD13 ILE 51 2HD1 ILE 51 -5.478 1.865 -2.276
424 H HIS 52 H HIS 52 -4.940 -1.410 -5.813
425 HA HIS 52 HA HIS 52 -3.256 -3.499 -6.678
426 HB2 HIS 52 2HB HIS 52 -5.058 -2.460 -8.106
427 HB3 HIS 52 1HB HIS 52 -4.071 -1.012 -8.269
428 HD1 HIS 52 HD1 HIS 52 -1.887 -1.243 -9.750
429 HD2 HIS 52 HD2 HIS 52 -4.418 -4.524 -9.855
430 HE1 HIS 52 HE1 HIS 52 -1.071 -2.664 -11.648
431 HE2 HIS 52 HE2 HIS 52 -2.496 -4.725 -11.551
432 H ALA 53 H ALA 53 -1.146 -3.440 -7.627
433 HA ALA 53 HA ALA 53 0.759 -2.361 -5.945
434 HB1 ALA 53 3HB ALA 53 1.075 -4.393 -7.307
435 HB2 ALA 53 1HB ALA 53 2.433 -3.278 -7.478
436 HB3 ALA 53 2HB ALA 53 1.224 -3.404 -8.761
437 H ALA 54 H ALA 54 -0.341 -1.023 -9.028
438 HA ALA 54 HA ALA 54 1.592 0.917 -9.554
439 HB1 ALA 54 3HB ALA 54 -0.184 0.252 -11.139
440 HB2 ALA 54 1HB ALA 54 -0.127 2.006 -10.935
441 HB3 ALA 54 2HB ALA 54 -1.388 1.062 -10.138
442 H HIS 55 H HIS 55 -0.832 0.891 -7.120
443 HA HIS 55 HA HIS 55 -0.666 3.791 -6.584
444 HB2 HIS 55 2HB HIS 55 -2.807 1.780 -5.730
445 HB3 HIS 55 1HB HIS 55 -2.839 3.516 -5.422
446 HD1 HIS 55 HD1 HIS 55 -2.905 5.033 -7.666
447 HD2 HIS 55 HD2 HIS 55 -4.007 1.052 -8.078
448 HE1 HIS 55 HE1 HIS 55 -4.158 4.898 -9.832
449 HE2 HIS 55 HE2 HIS 55 -4.652 2.455 -10.141
450 H VAL 56 H VAL 56 1.237 1.589 -5.739
451 HA VAL 56 HA VAL 56 1.179 2.177 -2.831
452 HB VAL 56 HB VAL 56 2.221 -0.439 -4.018
453 HG11 VAL 56 1HG1 VAL 56 2.271 -1.199 -1.646
454 HG12 VAL 56 2HG1 VAL 56 1.751 0.405 -1.137
455 HG13 VAL 56 3HG1 VAL 56 3.317 0.195 -1.920
456 HG21 VAL 56 3HG2 VAL 56 -0.424 -0.010 -2.581
457 HG22 VAL 56 1HG2 VAL 56 0.240 -1.575 -3.054
458 HG23 VAL 56 2HG2 VAL 56 -0.232 -0.405 -4.290
459 H LYS 57 H LYS 57 3.196 2.675 -1.918
460 HA LYS 57 HA LYS 57 5.630 2.210 -3.519
461 HB2 LYS 57 2HB LYS 57 5.212 4.629 -3.650
462 HB3 LYS 57 1HB LYS 57 5.037 4.721 -1.896
463 HG2 LYS 57 2HG LYS 57 7.390 4.136 -1.576
464 HG3 LYS 57 1HG LYS 57 7.591 3.855 -3.306
465 HD2 LYS 57 2HD LYS 57 6.943 6.541 -2.039
466 HD3 LYS 57 1HD LYS 57 8.555 6.023 -2.535
467 HE2 LYS 57 2HE LYS 57 7.773 5.869 -4.883
468 HE3 LYS 57 1HE LYS 57 6.166 6.400 -4.380
469 HZ1 LYS 57 3HZ LYS 57 7.137 8.479 -3.625
470 HZ2 LYS 57 1HZ LYS 57 7.449 8.225 -5.266
471 HZ3 LYS 57 2HZ LYS 57 8.670 7.978 -4.127
472 H ALA 58 H ALA 58 6.926 0.877 -2.423
473 HA ALA 58 HA ALA 58 6.530 -0.034 0.224
474 HB1 ALA 58 3HB ALA 58 9.028 -0.180 -1.519
475 HB2 ALA 58 1HB ALA 58 7.724 -1.369 -1.476
476 HB3 ALA 58 2HB ALA 58 8.748 -1.129 -0.057
477 H ALA 59 H ALA 59 6.792 1.229 1.989
478 HA ALA 59 HA ALA 59 8.451 3.631 1.986
479 HB1 ALA 59 3HB ALA 59 6.595 2.507 4.109
480 HB2 ALA 59 1HB ALA 59 6.157 3.703 2.888
481 HB3 ALA 59 2HB ALA 59 7.345 4.110 4.126
482 H ASP 60 H ASP 60 10.236 3.944 3.246
483 HA ASP 60 HA ASP 60 11.731 1.702 4.201
484 HB2 ASP 60 2HB ASP 60 12.739 3.834 3.204
485 HB3 ASP 60 1HB ASP 60 12.283 4.682 4.674
486 HA PRO 61 HA PRO 61 9.706 1.892 8.321
487 HB2 PRO 61 2HB PRO 61 11.358 -0.482 8.974
488 HB3 PRO 61 1HB PRO 61 9.593 -0.353 8.857
489 HG2 PRO 61 2HG PRO 61 11.025 -1.753 7.041
490 HG3 PRO 61 1HG PRO 61 9.557 -0.853 6.597
491 HD2 PRO 61 2HD PRO 61 12.438 -0.020 6.254
492 HD3 PRO 61 1HD PRO 61 11.098 0.066 5.083
493 H GLY 62 H GLY 62 12.928 2.409 7.473
494 HA2 GLY 62 2HA GLY 62 14.587 3.635 8.513
495 HA3 GLY 62 1HA GLY 62 13.632 3.663 9.992
496 H GLY 63 H GLY 63 14.008 0.558 8.615
497 HA2 GLY 63 2HA GLY 63 16.354 -0.550 9.285
498 HA3 GLY 63 1HA GLY 63 15.614 -0.360 10.876
499 H GLY 64 H GLY 64 13.454 -1.289 11.186
500 HA2 GLY 64 2HA GLY 64 12.150 -3.021 9.418
501 HA3 GLY 64 1HA GLY 64 13.270 -3.991 10.367
502 HA PRO 65 HA PRO 65 9.577 -2.520 13.131
503 HB2 PRO 65 2HB PRO 65 7.164 -3.074 12.049
504 HB3 PRO 65 1HB PRO 65 8.053 -1.623 11.548
505 HG2 PRO 65 2HG PRO 65 7.770 -4.248 10.115
506 HG3 PRO 65 1HG PRO 65 7.746 -2.596 9.452
507 HD2 PRO 65 2HD PRO 65 9.993 -4.283 9.457
508 HD3 PRO 65 1HD PRO 65 10.043 -2.524 9.259
509 H SER 66 H SER 66 10.697 -5.290 11.907
510 HA SER 66 HA SER 66 9.017 -7.414 12.164
511 HB2 SER 66 2HB SER 66 11.157 -8.746 12.519
512 HB3 SER 66 1HB SER 66 11.181 -7.638 11.147
513 HG SER 66 HG SER 66 13.061 -7.660 12.668
514 H SER 67 H SER 67 11.095 -6.115 14.766
515 HA SER 67 HA SER 67 10.479 -8.077 16.700
516 HB2 SER 67 2HB SER 67 12.540 -6.685 16.761
517 HB3 SER 67 1HB SER 67 11.571 -5.256 17.115
518 HG SER 67 HG SER 67 11.466 -7.557 18.745
519 H ARG 68 H ARG 68 8.701 -5.348 15.643
520 HA ARG 68 HA ARG 68 7.003 -5.284 18.065
521 HB2 ARG 68 2HB ARG 68 7.436 -3.146 15.941
522 HB3 ARG 68 1HB ARG 68 6.328 -3.012 17.306
523 HG2 ARG 68 2HG ARG 68 8.340 -3.272 18.831
524 HG3 ARG 68 1HG ARG 68 9.360 -3.115 17.395
525 HD2 ARG 68 2HD ARG 68 9.100 -0.954 18.583
526 HD3 ARG 68 1HD ARG 68 8.424 -0.892 16.951
527 HE ARG 68 HE ARG 68 6.305 -1.581 18.552
528 HH11 ARG 68 1HH1 ARG 68 8.521 1.153 18.508
529 HH12 ARG 68 2HH1 ARG 68 7.351 2.246 19.174
530 HH21 ARG 68 1HH2 ARG 68 4.807 -0.155 19.397
531 HH22 ARG 68 2HH2 ARG 68 5.240 1.501 19.680
532 H LEU 69 H LEU 69 6.939 -6.555 14.940
533 HA LEU 69 HA LEU 69 4.268 -5.887 14.133
534 HB2 LEU 69 2HB LEU 69 6.027 -8.238 13.321
535 HB3 LEU 69 1HB LEU 69 4.509 -7.815 12.544
536 HG LEU 69 HG LEU 69 6.998 -6.072 12.584
537 HD11 LEU 69 1HD1 LEU 69 7.190 -6.558 10.194
538 HD12 LEU 69 2HD1 LEU 69 5.844 -7.697 10.310
539 HD13 LEU 69 3HD1 LEU 69 7.348 -8.011 11.179
540 HD21 LEU 69 3HD2 LEU 69 5.804 -4.645 10.970
541 HD22 LEU 69 1HD2 LEU 69 4.995 -4.694 12.532
542 HD23 LEU 69 2HD2 LEU 69 4.348 -5.624 11.177
543 H THR 70 H THR 70 2.927 -6.218 15.894
544 HA THR 70 HA THR 70 2.753 -8.734 17.321
545 HB THR 70 HB THR 70 0.847 -7.642 18.518
546 HG1 THR 70 HG1 THR 70 1.385 -5.293 17.025
547 HG21 THR 70 3HG2 THR 70 3.170 -7.227 19.315
548 HG22 THR 70 1HG2 THR 70 2.110 -5.845 19.612
549 HG23 THR 70 2HG2 THR 70 3.259 -5.803 18.273
550 H TRP 71 H TRP 71 1.358 -7.422 14.462
551 HA TRP 71 HA TRP 71 -1.074 -8.816 14.274
552 HB2 TRP 71 2HB TRP 71 0.886 -8.057 12.063
553 HB3 TRP 71 1HB TRP 71 -0.761 -8.616 11.784
554 HD1 TRP 71 HD1 TRP 71 -2.749 -6.938 12.868
555 HE1 TRP 71 HE1 TRP 71 -2.800 -4.373 12.914
556 HE3 TRP 71 HE3 TRP 71 2.241 -6.011 12.207
557 HZ2 TRP 71 HZ2 TRP 71 -0.981 -2.238 12.699
558 HZ3 TRP 71 HZ3 TRP 71 3.002 -3.665 12.140
559 HH2 TRP 71 HH2 TRP 71 1.422 -1.819 12.380
560 H ARG 72 H ARG 72 -1.530 -10.910 13.976
561 HA ARG 72 HA ARG 72 0.587 -12.797 13.138
562 HB2 ARG 72 2HB ARG 72 -0.482 -14.491 14.714
563 HB3 ARG 72 1HB ARG 72 0.397 -13.182 15.485
564 HG2 ARG 72 2HG ARG 72 -1.707 -12.056 16.058
565 HG3 ARG 72 1HG ARG 72 -2.621 -13.303 15.209
566 HD2 ARG 72 2HD ARG 72 -2.699 -13.712 17.617
567 HD3 ARG 72 1HD ARG 72 -1.783 -14.997 16.821
568 HE ARG 72 HE ARG 72 -0.286 -12.753 17.967
569 HH11 ARG 72 1HH1 ARG 72 -1.266 -16.118 18.335
570 HH12 ARG 72 2HH1 ARG 72 -0.045 -16.459 19.517
571 HH21 ARG 72 1HH2 ARG 72 1.302 -13.235 19.496
572 HH22 ARG 72 2HH2 ARG 72 1.408 -14.828 20.179
573 H VAL 73 H VAL 73 -0.256 -12.413 11.058
574 HA VAL 73 HA VAL 73 -2.818 -13.749 10.397
575 HB VAL 73 HB VAL 73 -1.143 -11.938 8.598
576 HG11 VAL 73 1HG1 VAL 73 -4.042 -12.801 8.340
577 HG12 VAL 73 2HG1 VAL 73 -2.695 -13.400 7.374
578 HG13 VAL 73 3HG1 VAL 73 -3.189 -11.711 7.239
579 HG21 VAL 73 3HG2 VAL 73 -1.847 -10.611 10.552
580 HG22 VAL 73 1HG2 VAL 73 -3.525 -11.094 10.292
581 HG23 VAL 73 2HG2 VAL 73 -2.702 -10.085 9.100
582 H GLN 74 H GLN 74 -2.796 -15.305 8.680
583 HA GLN 74 HA GLN 74 -2.166 -17.134 7.556
584 HB2 GLN 74 2HB GLN 74 -0.813 -15.415 6.277
585 HB3 GLN 74 1HB GLN 74 0.572 -15.835 7.271
586 HG2 GLN 74 2HG GLN 74 0.593 -18.100 6.363
587 HG3 GLN 74 1HG GLN 74 -0.884 -17.789 5.452
588 HE21 GLN 74 1HE2 GLN 74 1.820 -18.611 4.546
589 HE22 GLN 74 2HE2 GLN 74 2.295 -17.436 3.371
590 H ARG 75 H ARG 75 -2.181 -17.384 10.281
591 HA ARG 75 HA ARG 75 0.291 -18.774 11.110
592 HB2 ARG 75 2HB ARG 75 -2.028 -17.722 12.773
593 HB3 ARG 75 1HB ARG 75 -0.591 -18.503 13.427
594 HG2 ARG 75 2HG ARG 75 -0.651 -15.874 11.904
595 HG3 ARG 75 1HG ARG 75 -0.481 -16.063 13.652
596 HD2 ARG 75 2HD ARG 75 1.490 -16.984 11.531
597 HD3 ARG 75 1HD ARG 75 1.694 -15.630 12.646
598 HE ARG 75 HE ARG 75 1.338 -18.323 13.769
599 HH11 ARG 75 1HH1 ARG 75 3.549 -15.655 13.129
600 HH12 ARG 75 2HH1 ARG 75 4.753 -16.253 14.221
601 HH21 ARG 75 1HH2 ARG 75 2.923 -19.083 15.163
602 HH22 ARG 75 2HH2 ARG 75 4.401 -18.203 15.374
603 H SER 76 H SER 76 -0.647 -20.405 9.510
604 HA SER 76 HA SER 76 -1.255 -22.760 10.923
605 HB2 SER 76 2HB SER 76 -3.481 -23.292 9.800
606 HB3 SER 76 1HB SER 76 -3.569 -22.031 11.027
607 HG SER 76 HG SER 76 -3.560 -20.492 9.379
608 H GLN 77 H GLN 77 -2.195 -24.401 8.839
609 HA GLN 77 HA GLN 77 0.174 -24.571 7.202
610 HB2 GLN 77 2HB GLN 77 -1.007 -26.577 8.128
611 HB3 GLN 77 1HB GLN 77 -2.366 -26.238 7.060
612 HG2 GLN 77 2HG GLN 77 -0.894 -26.579 5.090
613 HG3 GLN 77 1HG GLN 77 0.454 -26.923 6.172
614 HE21 GLN 77 1HE2 GLN 77 -2.556 -28.126 4.880
615 HE22 GLN 77 2HE2 GLN 77 -2.353 -29.755 5.415
616 H ASN 78 H ASN 78 -0.036 -22.511 6.182
617 HA ASN 78 HA ASN 78 -0.395 -21.056 4.508
618 HB2 ASN 78 2HB ASN 78 -0.716 -23.653 2.950
619 HB3 ASN 78 1HB ASN 78 -0.530 -22.081 2.187
620 HD21 ASN 78 1HD2 ASN 78 1.234 -23.271 5.065
621 HD22 ASN 78 2HD2 ASN 78 2.774 -23.238 4.314
622 HA PRO 79 HA PRO 79 -5.124 -21.305 4.681
623 HB2 PRO 79 2HB PRO 79 -5.586 -19.063 6.173
624 HB3 PRO 79 1HB PRO 79 -5.155 -20.612 6.930
625 HG2 PRO 79 2HG PRO 79 -3.358 -18.273 6.317
626 HG3 PRO 79 1HG PRO 79 -3.498 -19.217 7.819
627 HD2 PRO 79 2HD PRO 79 -1.531 -19.704 5.997
628 HD3 PRO 79 1HD PRO 79 -2.246 -21.004 6.981
629 H LEU 80 H LEU 80 -2.754 -18.916 3.855
630 HA LEU 80 HA LEU 80 -4.594 -17.478 2.032
631 HB2 LEU 80 2HB LEU 80 -2.004 -16.502 3.318
632 HB3 LEU 80 1HB LEU 80 -3.056 -15.555 2.267
633 HG LEU 80 HG LEU 80 -3.814 -16.602 5.035
634 HD11 LEU 80 1HD1 LEU 80 -3.182 -13.770 4.176
635 HD12 LEU 80 2HD1 LEU 80 -2.158 -14.813 5.166
636 HD13 LEU 80 3HD1 LEU 80 -3.725 -14.289 5.776
637 HD21 LEU 80 3HD2 LEU 80 -5.389 -14.821 3.137
638 HD22 LEU 80 1HD2 LEU 80 -5.844 -15.214 4.799
639 HD23 LEU 80 2HD2 LEU 80 -5.778 -16.485 3.585
640 H LYS 81 H LYS 81 -4.350 -18.614 0.180
641 HA LYS 81 HA LYS 81 -1.842 -19.684 -0.738
642 HB2 LYS 81 2HB LYS 81 -4.544 -19.423 -2.135
643 HB3 LYS 81 1HB LYS 81 -3.152 -20.262 -2.817
644 HG2 LYS 81 2HG LYS 81 -4.637 -21.040 -0.274
645 HG3 LYS 81 1HG LYS 81 -4.744 -21.851 -1.842
646 HD2 LYS 81 2HD LYS 81 -2.254 -22.335 -1.658
647 HD3 LYS 81 1HD LYS 81 -2.316 -21.700 -0.011
648 HE2 LYS 81 2HE LYS 81 -3.832 -24.114 -1.067
649 HE3 LYS 81 1HE LYS 81 -2.437 -24.143 0.014
650 HZ1 LYS 81 3HZ LYS 81 -3.808 -22.929 1.654
651 HZ2 LYS 81 1HZ LYS 81 -4.426 -24.451 1.273
652 HZ3 LYS 81 2HZ LYS 81 -5.139 -23.068 0.628
653 H ILE 82 H ILE 82 -0.447 -17.957 -0.886
654 HA ILE 82 HA ILE 82 -0.952 -15.587 -2.416
655 HB ILE 82 HB ILE 82 1.545 -15.186 -2.155
656 HG12 ILE 82 2HG1 ILE 82 1.523 -17.696 -0.397
657 HG13 ILE 82 1HG1 ILE 82 2.202 -17.658 -2.018
658 HG21 ILE 82 1HG2 ILE 82 -0.068 -14.296 -0.533
659 HG22 ILE 82 2HG2 ILE 82 1.416 -14.775 0.292
660 HG23 ILE 82 3HG2 ILE 82 -0.015 -15.803 0.383
661 HD11 ILE 82 3HD1 ILE 82 3.924 -17.472 -0.332
662 HD12 ILE 82 1HD1 ILE 82 3.164 -16.023 0.322
663 HD13 ILE 82 2HD1 ILE 82 3.843 -16.005 -1.308
664 H ARG 83 H ARG 83 -1.661 -16.284 -4.455
665 HA ARG 83 HA ARG 83 -0.154 -18.062 -6.127
666 HB2 ARG 83 2HB ARG 83 -2.589 -17.853 -6.377
667 HB3 ARG 83 1HB ARG 83 -2.423 -16.152 -6.796
668 HG2 ARG 83 2HG ARG 83 -1.124 -16.846 -8.844
669 HG3 ARG 83 1HG ARG 83 -1.485 -18.528 -8.447
670 HD2 ARG 83 2HD ARG 83 -3.017 -17.624 -10.156
671 HD3 ARG 83 1HD ARG 83 -3.875 -18.096 -8.687
672 HE ARG 83 HE ARG 83 -3.629 -15.566 -8.133
673 HH11 ARG 83 1HH1 ARG 83 -4.293 -16.857 -11.331
674 HH12 ARG 83 2HH1 ARG 83 -5.140 -15.440 -11.849
675 HH21 ARG 83 1HH2 ARG 83 -4.745 -13.728 -8.840
676 HH22 ARG 83 2HH2 ARG 83 -5.397 -13.679 -10.443
677 H LEU 84 H LEU 84 1.911 -17.242 -6.308
678 HA LEU 84 HA LEU 84 2.462 -14.580 -7.328
679 HB2 LEU 84 2HB LEU 84 4.329 -16.947 -6.911
680 HB3 LEU 84 1HB LEU 84 4.815 -15.278 -7.179
681 HG LEU 84 HG LEU 84 3.328 -16.304 -4.718
682 HD11 LEU 84 1HD1 LEU 84 5.631 -17.101 -4.762
683 HD12 LEU 84 2HD1 LEU 84 5.411 -15.898 -3.493
684 HD13 LEU 84 3HD1 LEU 84 6.224 -15.454 -4.998
685 HD21 LEU 84 3HD2 LEU 84 3.729 -14.064 -3.763
686 HD22 LEU 84 1HD2 LEU 84 2.710 -13.990 -5.199
687 HD23 LEU 84 2HD2 LEU 84 4.411 -13.525 -5.302
688 H THR 85 H THR 85 3.642 -14.223 -9.342
689 HA THR 85 HA THR 85 2.354 -15.231 -11.592
690 HB THR 85 HB THR 85 5.066 -13.833 -11.490
691 HG1 THR 85 HG1 THR 85 2.398 -12.887 -11.378
692 HG21 THR 85 3HG2 THR 85 4.498 -13.013 -13.760
693 HG22 THR 85 1HG2 THR 85 3.031 -13.985 -13.754
694 HG23 THR 85 2HG2 THR 85 4.613 -14.775 -13.733
695 H ARG 86 H ARG 86 2.657 -16.973 -12.843
696 HA ARG 86 HA ARG 86 4.481 -19.069 -12.186
697 HB2 ARG 86 2HB ARG 86 2.147 -19.356 -13.166
698 HB3 ARG 86 1HB ARG 86 2.775 -18.753 -14.698
699 HG2 ARG 86 2HG ARG 86 4.450 -20.706 -14.606
700 HG3 ARG 86 1HG ARG 86 3.484 -21.345 -13.275
701 HD2 ARG 86 2HD ARG 86 2.761 -22.438 -15.283
702 HD3 ARG 86 1HD ARG 86 1.490 -21.298 -14.827
703 HE ARG 86 HE ARG 86 3.536 -20.596 -16.860
704 HH11 ARG 86 1HH1 ARG 86 0.142 -20.885 -15.985
705 HH12 ARG 86 2HH1 ARG 86 -0.419 -20.159 -17.455
706 HH21 ARG 86 1HH2 ARG 86 2.775 -19.696 -18.795
707 HH22 ARG 86 2HH2 ARG 86 1.073 -19.487 -19.048
708 H GLU 87 H GLU 87 6.401 -19.637 -13.214
709 HA GLU 87 HA GLU 87 7.732 -17.912 -15.103
710 HB2 GLU 87 2HB GLU 87 9.514 -19.577 -15.140
711 HB3 GLU 87 1HB GLU 87 8.991 -19.350 -13.480
712 HG2 GLU 87 2HG GLU 87 8.090 -21.691 -15.205
713 HG3 GLU 87 1HG GLU 87 9.516 -21.737 -14.174
714 H ALA 88 H ALA 88 8.370 -18.577 -17.277
715 HA ALA 88 HA ALA 88 7.743 -18.840 -19.421
716 HB1 ALA 88 3HB ALA 88 6.728 -21.543 -18.488
717 HB2 ALA 88 1HB ALA 88 8.386 -21.178 -18.967
718 HB3 ALA 88 2HB ALA 88 7.084 -21.094 -20.157
719 HA PRO 89 HA PRO 89 3.303 -17.480 -18.681
720 HB2 PRO 89 2HB PRO 89 4.220 -15.053 -20.173
721 HB3 PRO 89 1HB PRO 89 3.376 -15.158 -18.615
722 HG2 PRO 89 2HG PRO 89 5.945 -14.439 -18.705
723 HG3 PRO 89 1HG PRO 89 5.339 -15.494 -17.406
724 HD2 PRO 89 2HD PRO 89 6.828 -16.294 -19.918
725 HD3 PRO 89 1HD PRO 89 7.120 -16.791 -18.233
Start of MODEL 9
1 H1 HIS 1 1H HIS 1 -3.772 -25.545 14.591
2 H2 HIS 1 2H HIS 1 -3.902 -24.947 13.015
3 H3 HIS 1 3H HIS 1 -4.940 -24.383 14.224
4 HA HIS 1 HA HIS 1 -3.242 -22.784 13.713
5 HB2 HIS 1 2HB HIS 1 -4.213 -23.041 16.046
6 HB3 HIS 1 1HB HIS 1 -2.814 -24.018 16.468
7 HD1 HIS 1 HD1 HIS 1 -4.000 -20.556 16.235
8 HD2 HIS 1 HD2 HIS 1 -0.322 -22.480 16.518
9 HE1 HIS 1 HE1 HIS 1 -2.351 -18.788 16.907
10 HE2 HIS 1 HE2 HIS 1 -0.140 -19.968 17.047
11 H HIS 2 H HIS 2 -1.691 -23.324 12.188
12 HA HIS 2 HA HIS 2 0.948 -23.844 13.241
13 HB2 HIS 2 2HB HIS 2 1.551 -25.719 11.817
14 HB3 HIS 2 1HB HIS 2 0.125 -26.175 12.738
15 HD1 HIS 2 HD1 HIS 2 1.383 -25.674 9.282
16 HD2 HIS 2 HD2 HIS 2 -2.261 -26.439 11.129
17 HE1 HIS 2 HE1 HIS 2 -0.174 -26.397 7.458
18 HE2 HIS 2 HE2 HIS 2 -2.311 -26.999 8.615
19 H HIS 3 H HIS 3 2.599 -23.138 11.784
20 HA HIS 3 HA HIS 3 1.681 -20.977 10.048
21 HB2 HIS 3 2HB HIS 3 4.453 -21.737 11.069
22 HB3 HIS 3 1HB HIS 3 4.154 -20.359 10.014
23 HD1 HIS 3 HD1 HIS 3 5.355 -20.058 12.860
24 HD2 HIS 3 HD2 HIS 3 1.335 -19.634 11.933
25 HE1 HIS 3 HE1 HIS 3 4.395 -18.611 14.667
26 HE2 HIS 3 HE2 HIS 3 1.923 -18.604 14.216
27 H HIS 4 H HIS 4 3.368 -20.589 8.146
28 HA HIS 4 HA HIS 4 3.860 -22.962 6.514
29 HB2 HIS 4 2HB HIS 4 1.761 -20.870 5.842
30 HB3 HIS 4 1HB HIS 4 2.598 -21.713 4.546
31 HD1 HIS 4 HD1 HIS 4 -0.507 -21.866 5.893
32 HD2 HIS 4 HD2 HIS 4 2.427 -24.775 5.489
33 HE1 HIS 4 HE1 HIS 4 -1.719 -24.055 5.933
34 HE2 HIS 4 HE2 HIS 4 0.056 -25.777 5.495
35 H HIS 5 H HIS 5 4.250 -21.543 4.084
36 HA HIS 5 HA HIS 5 6.896 -20.684 4.224
37 HB2 HIS 5 2HB HIS 5 5.714 -21.549 2.176
38 HB3 HIS 5 1HB HIS 5 4.803 -20.045 2.083
39 HD1 HIS 5 HD1 HIS 5 8.118 -21.563 1.307
40 HD2 HIS 5 HD2 HIS 5 6.330 -17.816 1.125
41 HE1 HIS 5 HE1 HIS 5 9.585 -20.178 -0.175
42 HE2 HIS 5 HE2 HIS 5 8.376 -17.995 -0.419
43 H HIS 6 H HIS 6 7.863 -18.731 4.524
44 HA HIS 6 HA HIS 6 6.571 -16.551 5.744
45 HB2 HIS 6 2HB HIS 6 8.960 -16.951 6.104
46 HB3 HIS 6 1HB HIS 6 9.303 -16.734 4.390
47 HD1 HIS 6 HD1 HIS 6 8.433 -14.786 7.499
48 HD2 HIS 6 HD2 HIS 6 9.601 -14.043 3.586
49 HE1 HIS 6 HE1 HIS 6 8.961 -12.338 7.398
50 HE2 HIS 6 HE2 HIS 6 9.541 -11.894 4.996
51 H SER 7 H SER 7 5.208 -15.195 4.824
52 HA SER 7 HA SER 7 5.413 -14.344 2.005
53 HB2 SER 7 2HB SER 7 3.098 -13.391 2.520
54 HB3 SER 7 1HB SER 7 3.208 -15.144 2.673
55 HG SER 7 HG SER 7 2.454 -14.820 4.601
56 H HIS 8 H HIS 8 4.517 -11.792 1.970
57 HA HIS 8 HA HIS 8 6.363 -10.095 3.287
58 HB2 HIS 8 2HB HIS 8 3.687 -9.541 1.956
59 HB3 HIS 8 1HB HIS 8 4.502 -8.259 2.839
60 HD1 HIS 8 HD1 HIS 8 6.294 -7.011 1.656
61 HD2 HIS 8 HD2 HIS 8 5.191 -10.450 -0.379
62 HE1 HIS 8 HE1 HIS 8 7.406 -6.847 -0.577
63 HE2 HIS 8 HE2 HIS 8 6.486 -8.793 -1.873
64 H MET 9 H MET 9 6.337 -9.153 5.267
65 HA MET 9 HA MET 9 4.896 -10.404 7.350
66 HB2 MET 9 2HB MET 9 5.999 -8.782 8.868
67 HB3 MET 9 1HB MET 9 7.151 -9.483 7.744
68 HG2 MET 9 2HG MET 9 7.119 -7.423 6.405
69 HG3 MET 9 1HG MET 9 5.923 -6.726 7.501
70 HE1 MET 9 3HE MET 9 9.170 -4.668 8.357
71 HE2 MET 9 1HE MET 9 7.466 -4.558 7.908
72 HE3 MET 9 2HE MET 9 8.640 -5.223 6.770
73 H VAL 10 H VAL 10 2.971 -9.919 8.261
74 HA VAL 10 HA VAL 10 1.233 -7.830 7.508
75 HB VAL 10 HB VAL 10 0.068 -8.348 9.759
76 HG11 VAL 10 1HG1 VAL 10 -0.735 -10.580 9.066
77 HG12 VAL 10 2HG1 VAL 10 0.595 -10.703 7.912
78 HG13 VAL 10 3HG1 VAL 10 -0.648 -9.468 7.697
79 HG21 VAL 10 3HG2 VAL 10 2.011 -9.086 11.049
80 HG22 VAL 10 1HG2 VAL 10 2.266 -10.440 9.943
81 HG23 VAL 10 2HG2 VAL 10 0.828 -10.391 10.963
82 H GLY 11 H GLY 11 1.721 -5.693 7.751
83 HA2 GLY 11 2HA GLY 11 2.160 -3.838 9.308
84 HA3 GLY 11 1HA GLY 11 3.343 -4.856 10.109
85 H ASP 12 H ASP 12 3.410 -5.245 6.694
86 HA ASP 12 HA ASP 12 6.047 -4.271 6.376
87 HB2 ASP 12 2HB ASP 12 4.920 -5.946 4.875
88 HB3 ASP 12 1HB ASP 12 3.938 -4.653 4.213
89 H THR 13 H THR 13 6.728 -2.172 6.378
90 HA THR 13 HA THR 13 4.812 -0.027 6.530
91 HB THR 13 HB THR 13 7.859 0.058 6.515
92 HG1 THR 13 HG1 THR 13 6.324 -0.975 8.297
93 HG21 THR 13 3HG2 THR 13 6.905 2.272 5.917
94 HG22 THR 13 1HG2 THR 13 7.609 2.316 7.537
95 HG23 THR 13 2HG2 THR 13 5.858 2.217 7.338
96 H VAL 14 H VAL 14 3.959 0.864 4.801
97 HA VAL 14 HA VAL 14 5.464 1.392 2.322
98 HB VAL 14 HB VAL 14 3.537 0.634 0.943
99 HG11 VAL 14 1HG1 VAL 14 3.849 -1.799 1.123
100 HG12 VAL 14 2HG1 VAL 14 4.579 -1.603 2.717
101 HG13 VAL 14 3HG1 VAL 14 5.388 -0.948 1.292
102 HG21 VAL 14 3HG2 VAL 14 2.336 -0.419 3.546
103 HG22 VAL 14 1HG2 VAL 14 1.686 -0.698 1.927
104 HG23 VAL 14 2HG2 VAL 14 1.721 0.933 2.592
105 H TRP 15 H TRP 15 3.997 2.750 0.859
106 HA TRP 15 HA TRP 15 2.192 4.600 2.289
107 HB2 TRP 15 2HB TRP 15 4.097 5.260 -0.018
108 HB3 TRP 15 1HB TRP 15 2.946 6.382 0.701
109 HD1 TRP 15 HD1 TRP 15 3.975 5.285 3.797
110 HE1 TRP 15 HE1 TRP 15 6.094 6.416 4.699
111 HE3 TRP 15 HE3 TRP 15 5.838 7.147 -0.582
112 HZ2 TRP 15 HZ2 TRP 15 8.253 7.927 3.709
113 HZ3 TRP 15 HZ3 TRP 15 7.930 8.441 -0.518
114 HH2 TRP 15 HH2 TRP 15 9.114 8.824 1.584
115 H VAL 16 H VAL 16 0.317 5.130 1.049
116 HA VAL 16 HA VAL 16 -0.191 3.474 -1.347
117 HB VAL 16 HB VAL 16 -2.233 4.751 0.539
118 HG11 VAL 16 1HG1 VAL 16 -3.092 4.628 -1.781
119 HG12 VAL 16 2HG1 VAL 16 -3.947 3.485 -0.743
120 HG13 VAL 16 3HG1 VAL 16 -2.696 2.908 -1.845
121 HG21 VAL 16 3HG2 VAL 16 -1.480 1.824 0.211
122 HG22 VAL 16 1HG2 VAL 16 -2.753 2.446 1.264
123 HG23 VAL 16 2HG2 VAL 16 -1.062 2.843 1.590
124 H ARG 17 H ARG 17 0.412 4.669 -3.013
125 HA ARG 17 HA ARG 17 0.083 7.473 -3.394
126 HB2 ARG 17 2HB ARG 17 1.815 6.156 -4.566
127 HB3 ARG 17 1HB ARG 17 0.573 5.195 -5.361
128 HG2 ARG 17 2HG ARG 17 -0.223 7.291 -6.502
129 HG3 ARG 17 1HG ARG 17 1.160 8.140 -5.809
130 HD2 ARG 17 2HD ARG 17 1.343 5.727 -7.646
131 HD3 ARG 17 1HD ARG 17 1.517 7.401 -8.167
132 HE ARG 17 HE ARG 17 3.488 7.521 -6.655
133 HH11 ARG 17 1HH1 ARG 17 2.494 4.381 -7.900
134 HH12 ARG 17 2HH1 ARG 17 4.080 3.692 -7.755
135 HH21 ARG 17 1HH2 ARG 17 5.545 6.635 -6.511
136 HH22 ARG 17 2HH2 ARG 17 5.823 4.980 -6.964
137 H ARG 18 H ARG 18 -2.049 8.081 -3.086
138 HA ARG 18 HA ARG 18 -4.243 6.644 -4.367
139 HB2 ARG 18 2HB ARG 18 -4.460 7.448 -2.006
140 HB3 ARG 18 1HB ARG 18 -4.320 9.112 -2.570
141 HG2 ARG 18 2HG ARG 18 -6.400 8.910 -3.823
142 HG3 ARG 18 1HG ARG 18 -6.518 7.197 -3.423
143 HD2 ARG 18 2HD ARG 18 -6.794 7.777 -1.033
144 HD3 ARG 18 1HD ARG 18 -6.670 9.494 -1.438
145 HE ARG 18 HE ARG 18 -8.707 8.995 -2.931
146 HH11 ARG 18 1HH1 ARG 18 -8.174 7.445 0.184
147 HH12 ARG 18 2HH1 ARG 18 -9.862 7.188 0.473
148 HH21 ARG 18 1HH2 ARG 18 -10.908 8.607 -2.539
149 HH22 ARG 18 2HH2 ARG 18 -11.405 7.845 -1.066
150 H HIS 19 H HIS 19 -4.919 7.149 -6.338
151 HA HIS 19 HA HIS 19 -4.213 9.716 -7.618
152 HB2 HIS 19 2HB HIS 19 -3.628 7.480 -8.696
153 HB3 HIS 19 1HB HIS 19 -5.349 7.202 -8.928
154 HD1 HIS 19 HD1 HIS 19 -5.538 7.384 -11.418
155 HD2 HIS 19 HD2 HIS 19 -3.375 10.535 -9.802
156 HE1 HIS 19 HE1 HIS 19 -5.001 8.893 -13.338
157 HE2 HIS 19 HE2 HIS 19 -3.903 10.896 -12.292
158 H GLN 20 H GLN 20 -5.740 11.221 -7.288
159 HA GLN 20 HA GLN 20 -8.505 10.638 -6.828
160 HB2 GLN 20 2HB GLN 20 -7.090 13.292 -7.306
161 HB3 GLN 20 1HB GLN 20 -8.778 13.139 -6.829
162 HG2 GLN 20 2HG GLN 20 -6.386 12.220 -5.195
163 HG3 GLN 20 1HG GLN 20 -7.338 13.673 -4.902
164 HE21 GLN 20 1HE2 GLN 20 -9.444 13.450 -4.048
165 HE22 GLN 20 2HE2 GLN 20 -9.972 11.995 -3.284
166 H THR 21 H THR 21 -7.119 12.767 -9.375
167 HA THR 21 HA THR 21 -9.149 11.744 -11.298
168 HB THR 21 HB THR 21 -8.980 13.983 -12.420
169 HG1 THR 21 HG1 THR 21 -7.972 15.513 -10.551
170 HG21 THR 21 3HG2 THR 21 -9.736 14.162 -9.475
171 HG22 THR 21 1HG2 THR 21 -10.799 13.630 -10.783
172 HG23 THR 21 2HG2 THR 21 -10.226 15.297 -10.733
173 H LYS 22 H LYS 22 -8.479 11.628 -13.496
174 HA LYS 22 HA LYS 22 -5.849 10.587 -13.939
175 HB2 LYS 22 2HB LYS 22 -8.004 11.293 -15.978
176 HB3 LYS 22 1HB LYS 22 -6.609 10.250 -16.257
177 HG2 LYS 22 2HG LYS 22 -7.477 8.582 -14.707
178 HG3 LYS 22 1HG LYS 22 -8.813 9.643 -14.257
179 HD2 LYS 22 2HD LYS 22 -8.364 8.460 -17.027
180 HD3 LYS 22 1HD LYS 22 -9.530 7.869 -15.843
181 HE2 LYS 22 2HE LYS 22 -10.721 10.050 -15.941
182 HE3 LYS 22 1HE LYS 22 -9.562 10.622 -17.144
183 HZ1 LYS 22 3HZ LYS 22 -11.576 9.850 -18.195
184 HZ2 LYS 22 1HZ LYS 22 -11.427 8.335 -17.466
185 HZ3 LYS 22 2HZ LYS 22 -10.289 8.835 -18.613
186 H ASN 23 H ASN 23 -7.383 13.699 -14.410
187 HA ASN 23 HA ASN 23 -5.465 14.818 -16.223
188 HB2 ASN 23 2HB ASN 23 -7.505 16.199 -14.418
189 HB3 ASN 23 1HB ASN 23 -6.540 17.022 -15.641
190 HD21 ASN 23 1HD2 ASN 23 -6.924 16.516 -17.870
191 HD22 ASN 23 2HD2 ASN 23 -8.436 15.856 -18.378
192 H LEU 24 H LEU 24 -5.763 14.715 -12.705
193 HA LEU 24 HA LEU 24 -3.341 16.370 -12.352
194 HB2 LEU 24 2HB LEU 24 -5.337 15.372 -10.283
195 HB3 LEU 24 1HB LEU 24 -3.959 16.409 -9.946
196 HG LEU 24 HG LEU 24 -6.399 17.161 -11.610
197 HD11 LEU 24 1HD1 LEU 24 -6.872 17.072 -9.217
198 HD12 LEU 24 2HD1 LEU 24 -6.887 18.736 -9.794
199 HD13 LEU 24 3HD1 LEU 24 -5.500 18.134 -8.881
200 HD21 LEU 24 3HD2 LEU 24 -3.952 18.839 -10.942
201 HD22 LEU 24 1HD2 LEU 24 -5.424 19.430 -11.716
202 HD23 LEU 24 2HD2 LEU 24 -4.415 18.246 -12.540
203 H GLU 25 H GLU 25 -1.767 15.659 -10.766
204 HA GLU 25 HA GLU 25 -0.850 12.986 -11.231
205 HB2 GLU 25 2HB GLU 25 0.233 15.127 -9.346
206 HB3 GLU 25 1HB GLU 25 1.080 13.654 -9.816
207 HG2 GLU 25 2HG GLU 25 1.095 14.437 -12.180
208 HG3 GLU 25 1HG GLU 25 0.305 15.931 -11.669
209 HA PRO 26 HA PRO 26 -2.498 11.167 -7.396
210 HB2 PRO 26 2HB PRO 26 -0.907 8.978 -7.124
211 HB3 PRO 26 1HB PRO 26 -2.081 9.111 -8.448
212 HG2 PRO 26 2HG PRO 26 0.879 9.596 -8.520
213 HG3 PRO 26 1HG PRO 26 -0.145 8.724 -9.684
214 HD2 PRO 26 2HD PRO 26 0.657 11.332 -10.040
215 HD3 PRO 26 1HD PRO 26 -0.835 10.664 -10.736
216 H ARG 27 H ARG 27 -2.082 11.232 -5.188
217 HA ARG 27 HA ARG 27 0.581 12.175 -4.293
218 HB2 ARG 27 2HB ARG 27 -1.042 13.980 -4.027
219 HB3 ARG 27 1HB ARG 27 -2.163 12.910 -3.191
220 HG2 ARG 27 2HG ARG 27 -0.709 12.759 -1.264
221 HG3 ARG 27 1HG ARG 27 0.597 13.585 -2.113
222 HD2 ARG 27 2HD ARG 27 -2.066 14.846 -1.391
223 HD3 ARG 27 1HD ARG 27 -0.576 15.039 -0.467
224 HE ARG 27 HE ARG 27 -1.232 16.246 -3.042
225 HH11 ARG 27 1HH1 ARG 27 1.286 15.676 -0.646
226 HH12 ARG 27 2HH1 ARG 27 2.301 16.955 -1.232
227 HH21 ARG 27 1HH2 ARG 27 0.129 17.898 -3.815
228 HH22 ARG 27 2HH2 ARG 27 1.644 18.208 -3.028
229 H TRP 28 H TRP 28 1.573 10.934 -2.824
230 HA TRP 28 HA TRP 28 0.364 8.472 -1.944
231 HB2 TRP 28 2HB TRP 28 2.526 7.924 -0.949
232 HB3 TRP 28 1HB TRP 28 2.782 8.560 -2.565
233 HD1 TRP 28 HD1 TRP 28 4.201 10.834 -2.777
234 HE1 TRP 28 HE1 TRP 28 5.675 12.125 -1.112
235 HE3 TRP 28 HE3 TRP 28 2.684 8.622 1.588
236 HZ2 TRP 28 HZ2 TRP 28 6.147 12.199 1.662
237 HZ3 TRP 28 HZ3 TRP 28 3.691 9.362 3.707
238 HH2 TRP 28 HH2 TRP 28 5.392 11.119 3.742
239 H LYS 29 H LYS 29 -0.111 7.879 0.122
240 HA LYS 29 HA LYS 29 -0.013 9.850 2.322
241 HB2 LYS 29 2HB LYS 29 -2.197 7.811 1.696
242 HB3 LYS 29 1HB LYS 29 -2.092 8.702 3.210
243 HG2 LYS 29 2HG LYS 29 -2.417 10.830 1.991
244 HG3 LYS 29 1HG LYS 29 -2.497 9.947 0.465
245 HD2 LYS 29 2HD LYS 29 -4.745 10.595 1.373
246 HD3 LYS 29 1HD LYS 29 -4.559 8.859 1.123
247 HE2 LYS 29 2HE LYS 29 -5.714 9.417 3.260
248 HE3 LYS 29 1HE LYS 29 -4.228 8.506 3.514
249 HZ1 LYS 29 3HZ LYS 29 -3.109 10.540 4.122
250 HZ2 LYS 29 1HZ LYS 29 -4.487 10.340 5.077
251 HZ3 LYS 29 2HZ LYS 29 -4.498 11.450 3.803
252 H GLY 30 H GLY 30 0.760 8.975 4.292
253 HA2 GLY 30 2HA GLY 30 1.037 6.226 4.865
254 HA3 GLY 30 1HA GLY 30 2.508 6.763 4.092
255 HA PRO 31 HA PRO 31 3.370 5.237 5.550
256 HB2 PRO 31 2HB PRO 31 4.488 4.083 7.738
257 HB3 PRO 31 1HB PRO 31 5.255 5.451 6.908
258 HG2 PRO 31 2HG PRO 31 3.828 5.415 9.513
259 HG3 PRO 31 1HG PRO 31 5.125 6.486 8.950
260 HD2 PRO 31 2HD PRO 31 2.298 7.047 8.984
261 HD3 PRO 31 1HD PRO 31 3.595 8.075 8.340
262 H TYR 32 H TYR 32 1.844 3.836 5.008
263 HA TYR 32 HA TYR 32 -0.024 2.578 6.862
264 HB2 TYR 32 2HB TYR 32 0.372 2.409 3.853
265 HB3 TYR 32 1HB TYR 32 -0.751 1.364 4.710
266 HD1 TYR 32 HD2 TYR 32 -0.113 4.830 3.620
267 HD2 TYR 32 HD1 TYR 32 -2.843 2.236 5.619
268 HE1 TYR 32 HE2 TYR 32 -1.861 6.527 3.454
269 HE2 TYR 32 HE1 TYR 32 -4.599 3.944 5.444
270 HH TYR 32 HH TYR 32 -4.738 6.423 5.162
271 H THR 33 H THR 33 -0.340 0.092 6.260
272 HA THR 33 HA THR 33 2.235 -1.352 6.332
273 HB THR 33 HB THR 33 1.320 -2.742 8.254
274 HG1 THR 33 HG1 THR 33 -0.854 -2.262 8.148
275 HG21 THR 33 3HG2 THR 33 1.819 -1.127 10.057
276 HG22 THR 33 1HG2 THR 33 1.711 0.201 8.903
277 HG23 THR 33 2HG2 THR 33 2.991 -1.003 8.742
278 H VAL 34 H VAL 34 2.071 -2.722 4.575
279 HA VAL 34 HA VAL 34 -0.316 -3.991 3.675
280 HB VAL 34 HB VAL 34 2.610 -4.708 3.174
281 HG11 VAL 34 1HG1 VAL 34 1.846 -6.161 1.312
282 HG12 VAL 34 2HG1 VAL 34 0.171 -5.891 1.798
283 HG13 VAL 34 3HG1 VAL 34 1.270 -6.753 2.875
284 HG21 VAL 34 3HG2 VAL 34 2.225 -3.737 0.932
285 HG22 VAL 34 1HG2 VAL 34 1.952 -2.558 2.217
286 HG23 VAL 34 2HG2 VAL 34 0.578 -3.312 1.407
287 H LEU 35 H LEU 35 -1.387 -5.556 4.613
288 HA LEU 35 HA LEU 35 -0.215 -7.315 6.648
289 HB2 LEU 35 2HB LEU 35 -3.110 -7.116 5.719
290 HB3 LEU 35 1HB LEU 35 -2.523 -8.014 7.109
291 HG LEU 35 HG LEU 35 -2.590 -4.984 6.818
292 HD11 LEU 35 1HD1 LEU 35 -4.210 -5.055 8.658
293 HD12 LEU 35 2HD1 LEU 35 -4.145 -6.820 8.667
294 HD13 LEU 35 3HD1 LEU 35 -4.782 -5.966 7.260
295 HD21 LEU 35 3HD2 LEU 35 -1.760 -4.867 9.140
296 HD22 LEU 35 1HD2 LEU 35 -0.574 -5.599 8.060
297 HD23 LEU 35 2HD2 LEU 35 -1.521 -6.616 9.149
298 H LEU 36 H LEU 36 -1.246 -7.357 3.306
299 HA LEU 36 HA LEU 36 -0.437 -10.151 3.020
300 HB2 LEU 36 2HB LEU 36 -2.769 -10.383 3.676
301 HB3 LEU 36 1HB LEU 36 -3.278 -9.217 2.477
302 HG LEU 36 HG LEU 36 -2.572 -10.823 0.664
303 HD11 LEU 36 1HD1 LEU 36 -0.889 -12.083 1.894
304 HD12 LEU 36 2HD1 LEU 36 -2.114 -13.159 1.224
305 HD13 LEU 36 3HD1 LEU 36 -2.134 -12.764 2.944
306 HD21 LEU 36 3HD2 LEU 36 -4.915 -10.696 1.331
307 HD22 LEU 36 1HD2 LEU 36 -4.645 -11.883 2.609
308 HD23 LEU 36 2HD2 LEU 36 -4.482 -12.352 0.917
309 H THR 37 H THR 37 0.228 -10.662 1.004
310 HA THR 37 HA THR 37 0.092 -8.629 -1.142
311 HB THR 37 HB THR 37 2.134 -10.840 -0.632
312 HG1 THR 37 HG1 THR 37 1.970 -8.134 -0.050
313 HG21 THR 37 3HG2 THR 37 3.434 -9.874 -2.517
314 HG22 THR 37 1HG2 THR 37 2.098 -8.784 -2.877
315 HG23 THR 37 2HG2 THR 37 1.891 -10.527 -3.075
316 H THR 38 H THR 38 -0.500 -9.311 -3.199
317 HA THR 38 HA THR 38 -1.419 -12.036 -3.732
318 HB THR 38 HB THR 38 -3.660 -11.006 -4.636
319 HG1 THR 38 HG1 THR 38 -2.553 -8.869 -3.278
320 HG21 THR 38 3HG2 THR 38 -4.829 -11.228 -2.477
321 HG22 THR 38 1HG2 THR 38 -3.280 -11.149 -1.617
322 HG23 THR 38 2HG2 THR 38 -3.642 -12.514 -2.674
323 HA PRO 39 HA PRO 39 0.018 -11.224 -7.894
324 HB2 PRO 39 2HB PRO 39 -2.243 -11.918 -9.482
325 HB3 PRO 39 1HB PRO 39 -0.970 -13.022 -8.934
326 HG2 PRO 39 2HG PRO 39 -3.666 -12.535 -7.748
327 HG3 PRO 39 1HG PRO 39 -2.752 -14.054 -7.881
328 HD2 PRO 39 2HD PRO 39 -2.900 -12.775 -5.536
329 HD3 PRO 39 1HD PRO 39 -1.386 -13.559 -6.037
330 H THR 40 H THR 40 0.374 -9.148 -8.182
331 HA THR 40 HA THR 40 0.311 -7.040 -8.934
332 HB THR 40 HB THR 40 -2.385 -7.498 -10.275
333 HG1 THR 40 HG1 THR 40 0.055 -8.239 -11.501
334 HG21 THR 40 3HG2 THR 40 -1.401 -6.099 -12.072
335 HG22 THR 40 1HG2 THR 40 0.095 -5.967 -11.151
336 HG23 THR 40 2HG2 THR 40 -1.389 -5.238 -10.528
337 H ALA 41 H ALA 41 -1.011 -7.777 -6.346
338 HA ALA 41 HA ALA 41 -2.277 -5.206 -5.785
339 HB1 ALA 41 3HB ALA 41 -4.196 -6.551 -6.558
340 HB2 ALA 41 1HB ALA 41 -4.339 -6.174 -4.839
341 HB3 ALA 41 2HB ALA 41 -3.834 -7.787 -5.354
342 H LEU 42 H LEU 42 -2.591 -4.860 -3.510
343 HA LEU 42 HA LEU 42 -1.187 -6.619 -1.617
344 HB2 LEU 42 2HB LEU 42 -0.715 -3.612 -1.933
345 HB3 LEU 42 1HB LEU 42 -0.125 -4.569 -0.583
346 HG LEU 42 HG LEU 42 0.753 -4.877 -3.485
347 HD11 LEU 42 1HD1 LEU 42 1.617 -2.829 -2.506
348 HD12 LEU 42 2HD1 LEU 42 2.914 -4.002 -2.716
349 HD13 LEU 42 3HD1 LEU 42 2.238 -3.715 -1.110
350 HD21 LEU 42 3HD2 LEU 42 2.452 -6.427 -2.621
351 HD22 LEU 42 1HD2 LEU 42 0.821 -7.025 -2.334
352 HD23 LEU 42 2HD2 LEU 42 1.745 -6.319 -1.005
353 H LYS 43 H LYS 43 -2.609 -6.979 0.003
354 HA LYS 43 HA LYS 43 -4.746 -5.128 0.635
355 HB2 LYS 43 2HB LYS 43 -5.222 -7.525 0.865
356 HB3 LYS 43 1HB LYS 43 -3.883 -7.710 1.992
357 HG2 LYS 43 2HG LYS 43 -5.009 -6.316 3.651
358 HG3 LYS 43 1HG LYS 43 -6.311 -5.959 2.513
359 HD2 LYS 43 2HD LYS 43 -6.906 -8.397 2.511
360 HD3 LYS 43 1HD LYS 43 -5.669 -8.662 3.748
361 HE2 LYS 43 2HE LYS 43 -7.931 -8.455 4.737
362 HE3 LYS 43 1HE LYS 43 -6.862 -7.164 5.286
363 HZ1 LYS 43 3HZ LYS 43 -8.865 -6.897 3.103
364 HZ2 LYS 43 1HZ LYS 43 -7.899 -5.661 3.731
365 HZ3 LYS 43 2HZ LYS 43 -9.085 -6.376 4.696
366 H VAL 44 H VAL 44 -4.104 -3.353 1.578
367 HA VAL 44 HA VAL 44 -2.078 -3.258 3.692
368 HB VAL 44 HB VAL 44 -3.725 -1.048 2.367
369 HG11 VAL 44 1HG1 VAL 44 -1.339 -0.779 4.214
370 HG12 VAL 44 2HG1 VAL 44 -3.011 -0.383 4.613
371 HG13 VAL 44 3HG1 VAL 44 -2.152 0.549 3.384
372 HG21 VAL 44 3HG2 VAL 44 -2.196 -2.110 0.752
373 HG22 VAL 44 1HG2 VAL 44 -0.834 -1.840 1.845
374 HG23 VAL 44 2HG2 VAL 44 -1.670 -0.465 1.118
375 H ASP 45 H ASP 45 -2.645 -2.373 5.790
376 HA ASP 45 HA ASP 45 -4.955 -3.314 7.056
377 HB2 ASP 45 2HB ASP 45 -2.780 -2.759 8.178
378 HB3 ASP 45 1HB ASP 45 -3.090 -1.049 7.914
379 H GLY 46 H GLY 46 -6.957 -2.434 7.352
380 HA2 GLY 46 2HA GLY 46 -8.622 -0.828 7.565
381 HA3 GLY 46 1HA GLY 46 -7.507 0.412 7.012
382 H ILE 47 H ILE 47 -7.110 -1.884 4.724
383 HA ILE 47 HA ILE 47 -8.916 -0.549 2.849
384 HB ILE 47 HB ILE 47 -6.758 -2.665 2.396
385 HG12 ILE 47 2HG1 ILE 47 -5.858 -0.474 3.098
386 HG13 ILE 47 1HG1 ILE 47 -5.428 -0.814 1.429
387 HG21 ILE 47 1HG2 ILE 47 -8.442 -2.904 0.628
388 HG22 ILE 47 2HG2 ILE 47 -6.972 -2.195 -0.038
389 HG23 ILE 47 3HG2 ILE 47 -8.371 -1.172 0.288
390 HD11 ILE 47 3HD1 ILE 47 -6.005 1.500 1.702
391 HD12 ILE 47 1HD1 ILE 47 -7.576 1.075 2.374
392 HD13 ILE 47 2HD1 ILE 47 -7.213 0.715 0.685
393 H ALA 48 H ALA 48 -10.502 -1.570 1.643
394 HA ALA 48 HA ALA 48 -12.230 -3.313 2.938
395 HB1 ALA 48 3HB ALA 48 -12.946 -1.711 1.202
396 HB2 ALA 48 1HB ALA 48 -13.524 -3.338 0.836
397 HB3 ALA 48 2HB ALA 48 -12.140 -2.673 -0.035
398 H ALA 49 H ALA 49 -10.111 -4.040 0.109
399 HA ALA 49 HA ALA 49 -9.706 -6.734 1.169
400 HB1 ALA 49 3HB ALA 49 -11.654 -7.030 -0.310
401 HB2 ALA 49 1HB ALA 49 -10.236 -7.872 -0.940
402 HB3 ALA 49 2HB ALA 49 -10.747 -6.342 -1.659
403 H TRP 50 H TRP 50 -8.977 -4.741 -1.765
404 HA TRP 50 HA TRP 50 -6.100 -5.158 -1.315
405 HB2 TRP 50 2HB TRP 50 -7.367 -5.828 -4.008
406 HB3 TRP 50 1HB TRP 50 -5.651 -5.891 -3.623
407 HD1 TRP 50 HD1 TRP 50 -4.961 -7.875 -1.732
408 HE1 TRP 50 HE1 TRP 50 -5.943 -10.235 -1.481
409 HE3 TRP 50 HE3 TRP 50 -9.351 -7.247 -4.294
410 HZ2 TRP 50 HZ2 TRP 50 -8.226 -11.670 -2.274
411 HZ3 TRP 50 HZ3 TRP 50 -10.876 -9.168 -4.507
412 HH2 TRP 50 HH2 TRP 50 -10.325 -11.337 -3.517
413 H ILE 51 H ILE 51 -4.754 -3.741 -2.407
414 HA ILE 51 HA ILE 51 -5.914 -1.551 -4.036
415 HB ILE 51 HB ILE 51 -3.463 -1.467 -2.193
416 HG12 ILE 51 2HG1 ILE 51 -5.603 -1.164 -0.978
417 HG13 ILE 51 1HG1 ILE 51 -4.663 0.322 -0.963
418 HG21 ILE 51 1HG2 ILE 51 -4.416 0.694 -4.113
419 HG22 ILE 51 2HG2 ILE 51 -2.920 -0.234 -4.235
420 HG23 ILE 51 3HG2 ILE 51 -3.146 0.898 -2.901
421 HD11 ILE 51 3HD1 ILE 51 -6.100 1.239 -2.726
422 HD12 ILE 51 1HD1 ILE 51 -7.016 0.758 -1.298
423 HD13 ILE 51 2HD1 ILE 51 -7.035 -0.261 -2.736
424 H HIS 52 H HIS 52 -5.144 -1.558 -6.118
425 HA HIS 52 HA HIS 52 -3.530 -3.579 -7.213
426 HB2 HIS 52 2HB HIS 52 -5.089 -2.005 -8.492
427 HB3 HIS 52 1HB HIS 52 -3.861 -0.752 -8.337
428 HD1 HIS 52 HD1 HIS 52 -1.607 -1.159 -9.697
429 HD2 HIS 52 HD2 HIS 52 -4.707 -3.781 -10.558
430 HE1 HIS 52 HE1 HIS 52 -0.956 -2.294 -11.835
431 HE2 HIS 52 HE2 HIS 52 -2.851 -3.861 -12.340
432 H ALA 53 H ALA 53 -1.310 -3.794 -7.402
433 HA ALA 53 HA ALA 53 0.205 -2.865 -5.292
434 HB1 ALA 53 3HB ALA 53 1.293 -4.102 -7.852
435 HB2 ALA 53 1HB ALA 53 0.628 -4.988 -6.479
436 HB3 ALA 53 2HB ALA 53 2.107 -4.048 -6.283
437 H ALA 54 H ALA 54 0.203 -1.586 -8.611
438 HA ALA 54 HA ALA 54 2.520 0.050 -8.312
439 HB1 ALA 54 3HB ALA 54 1.763 -0.723 -10.505
440 HB2 ALA 54 1HB ALA 54 1.890 1.036 -10.469
441 HB3 ALA 54 2HB ALA 54 0.309 0.257 -10.366
442 H HIS 55 H HIS 55 -0.511 0.475 -6.951
443 HA HIS 55 HA HIS 55 -0.261 3.403 -6.631
444 HB2 HIS 55 2HB HIS 55 -2.450 1.412 -5.856
445 HB3 HIS 55 1HB HIS 55 -2.441 3.067 -5.258
446 HD1 HIS 55 HD1 HIS 55 -2.762 4.967 -7.065
447 HD2 HIS 55 HD2 HIS 55 -3.499 1.105 -8.386
448 HE1 HIS 55 HE1 HIS 55 -4.095 5.220 -9.175
449 HE2 HIS 55 HE2 HIS 55 -4.360 2.879 -10.046
450 H VAL 56 H VAL 56 1.463 1.081 -5.395
451 HA VAL 56 HA VAL 56 1.428 2.127 -2.615
452 HB VAL 56 HB VAL 56 1.844 -0.814 -3.359
453 HG11 VAL 56 1HG1 VAL 56 1.870 -1.221 -0.913
454 HG12 VAL 56 2HG1 VAL 56 1.782 0.517 -0.632
455 HG13 VAL 56 3HG1 VAL 56 3.199 -0.176 -1.423
456 HG21 VAL 56 3HG2 VAL 56 -0.275 -1.295 -2.200
457 HG22 VAL 56 1HG2 VAL 56 -0.541 -0.207 -3.566
458 HG23 VAL 56 2HG2 VAL 56 -0.527 0.427 -1.919
459 H LYS 57 H LYS 57 3.408 2.799 -1.973
460 HA LYS 57 HA LYS 57 5.837 1.948 -3.439
461 HB2 LYS 57 2HB LYS 57 5.395 4.364 -3.622
462 HB3 LYS 57 1HB LYS 57 5.269 4.499 -1.869
463 HG2 LYS 57 2HG LYS 57 7.675 3.846 -1.668
464 HG3 LYS 57 1HG LYS 57 7.790 3.782 -3.427
465 HD2 LYS 57 2HD LYS 57 7.114 6.262 -1.799
466 HD3 LYS 57 1HD LYS 57 8.701 5.894 -2.471
467 HE2 LYS 57 2HE LYS 57 6.178 6.323 -4.110
468 HE3 LYS 57 1HE LYS 57 7.443 7.525 -3.847
469 HZ1 LYS 57 3HZ LYS 57 9.020 6.018 -4.911
470 HZ2 LYS 57 1HZ LYS 57 7.765 6.438 -5.948
471 HZ3 LYS 57 2HZ LYS 57 7.777 4.915 -5.214
472 H ALA 58 H ALA 58 7.130 0.592 -2.266
473 HA ALA 58 HA ALA 58 6.731 -0.029 0.486
474 HB1 ALA 58 3HB ALA 58 8.820 -1.346 0.294
475 HB2 ALA 58 1HB ALA 58 9.146 -0.598 -1.275
476 HB3 ALA 58 2HB ALA 58 7.742 -1.645 -1.069
477 H ALA 59 H ALA 59 7.482 0.997 2.267
478 HA ALA 59 HA ALA 59 9.508 3.160 2.019
479 HB1 ALA 59 3HB ALA 59 8.387 4.204 3.964
480 HB2 ALA 59 1HB ALA 59 7.223 2.875 4.012
481 HB3 ALA 59 2HB ALA 59 7.257 3.971 2.629
482 H ASP 60 H ASP 60 11.166 3.231 3.511
483 HA ASP 60 HA ASP 60 11.796 0.787 4.985
484 HB2 ASP 60 2HB ASP 60 13.482 1.899 3.503
485 HB3 ASP 60 1HB ASP 60 13.464 3.311 4.544
486 HA PRO 61 HA PRO 61 10.102 2.958 8.677
487 HB2 PRO 61 2HB PRO 61 10.123 0.823 10.395
488 HB3 PRO 61 1HB PRO 61 8.915 0.980 9.102
489 HG2 PRO 61 2HG PRO 61 11.431 -0.664 9.125
490 HG3 PRO 61 1HG PRO 61 9.796 -1.117 8.584
491 HD2 PRO 61 2HD PRO 61 11.760 -0.355 6.838
492 HD3 PRO 61 1HD PRO 61 10.036 -0.065 6.528
493 H GLY 62 H GLY 62 13.209 1.666 8.160
494 HA2 GLY 62 2HA GLY 62 15.117 2.877 9.106
495 HA3 GLY 62 1HA GLY 62 14.308 2.826 10.668
496 H GLY 63 H GLY 63 14.359 0.126 8.403
497 HA2 GLY 63 2HA GLY 63 16.078 -1.640 8.520
498 HA3 GLY 63 1HA GLY 63 16.081 -1.448 10.272
499 H GLY 64 H GLY 64 13.455 -1.306 10.932
500 HA2 GLY 64 2HA GLY 64 11.500 -2.865 9.845
501 HA3 GLY 64 1HA GLY 64 12.549 -4.054 10.612
502 HA PRO 65 HA PRO 65 10.428 -3.049 14.474
503 HB2 PRO 65 2HB PRO 65 11.998 -4.333 16.265
504 HB3 PRO 65 1HB PRO 65 11.125 -5.243 15.015
505 HG2 PRO 65 2HG PRO 65 14.016 -4.402 15.045
506 HG3 PRO 65 1HG PRO 65 13.312 -5.981 14.626
507 HD2 PRO 65 2HD PRO 65 14.027 -4.104 12.738
508 HD3 PRO 65 1HD PRO 65 12.757 -5.321 12.480
509 H SER 66 H SER 66 12.423 -1.036 13.402
510 HA SER 66 HA SER 66 13.771 0.161 15.635
511 HB2 SER 66 2HB SER 66 13.928 2.126 13.987
512 HB3 SER 66 1HB SER 66 14.619 0.603 13.433
513 HG SER 66 HG SER 66 12.525 2.034 12.427
514 H SER 67 H SER 67 10.572 0.346 14.239
515 HA SER 67 HA SER 67 9.699 2.511 16.003
516 HB2 SER 67 2HB SER 67 8.835 2.526 13.695
517 HB3 SER 67 1HB SER 67 8.191 0.896 13.891
518 HG SER 67 HG SER 67 6.497 2.195 14.272
519 H ARG 68 H ARG 68 8.169 -0.635 15.219
520 HA ARG 68 HA ARG 68 8.104 -1.492 18.010
521 HB2 ARG 68 2HB ARG 68 5.582 -0.776 16.441
522 HB3 ARG 68 1HB ARG 68 5.539 -1.923 17.770
523 HG2 ARG 68 2HG ARG 68 6.388 -0.124 19.297
524 HG3 ARG 68 1HG ARG 68 6.287 1.013 17.953
525 HD2 ARG 68 2HD ARG 68 3.855 0.642 17.807
526 HD3 ARG 68 1HD ARG 68 3.943 -0.538 19.118
527 HE ARG 68 HE ARG 68 4.952 2.086 19.808
528 HH11 ARG 68 1HH1 ARG 68 2.089 0.043 19.737
529 HH12 ARG 68 2HH1 ARG 68 1.252 0.967 20.944
530 HH21 ARG 68 1HH2 ARG 68 3.829 3.292 21.390
531 HH22 ARG 68 2HH2 ARG 68 2.237 2.799 21.878
532 H LEU 69 H LEU 69 6.966 -3.697 18.144
533 HA LEU 69 HA LEU 69 7.764 -5.443 15.975
534 HB2 LEU 69 2HB LEU 69 6.354 -6.022 18.608
535 HB3 LEU 69 1HB LEU 69 6.856 -7.260 17.465
536 HG LEU 69 HG LEU 69 8.721 -5.385 18.977
537 HD11 LEU 69 1HD1 LEU 69 9.451 -7.374 20.202
538 HD12 LEU 69 2HD1 LEU 69 8.263 -8.362 19.349
539 HD13 LEU 69 3HD1 LEU 69 7.729 -7.082 20.443
540 HD21 LEU 69 3HD2 LEU 69 9.399 -7.632 17.046
541 HD22 LEU 69 1HD2 LEU 69 10.559 -6.737 18.033
542 HD23 LEU 69 2HD2 LEU 69 9.648 -5.904 16.778
543 H THR 70 H THR 70 6.424 -6.417 14.538
544 HA THR 70 HA THR 70 3.868 -5.181 14.023
545 HB THR 70 HB THR 70 3.929 -6.606 11.951
546 HG1 THR 70 HG1 THR 70 5.509 -8.057 11.632
547 HG21 THR 70 3HG2 THR 70 4.978 -4.367 11.917
548 HG22 THR 70 1HG2 THR 70 5.866 -5.496 10.892
549 HG23 THR 70 2HG2 THR 70 6.500 -5.064 12.481
550 H TRP 71 H TRP 71 1.901 -5.986 14.571
551 HA TRP 71 HA TRP 71 1.583 -8.398 16.116
552 HB2 TRP 71 2HB TRP 71 -0.508 -6.520 14.913
553 HB3 TRP 71 1HB TRP 71 -0.842 -7.788 16.093
554 HD1 TRP 71 HD1 TRP 71 0.986 -4.372 15.837
555 HE1 TRP 71 HE1 TRP 71 1.173 -3.376 18.197
556 HE3 TRP 71 HE3 TRP 71 -0.871 -8.305 18.557
557 HZ2 TRP 71 HZ2 TRP 71 0.616 -4.132 20.851
558 HZ3 TRP 71 HZ3 TRP 71 -1.000 -8.087 21.007
559 HH2 TRP 71 HH2 TRP 71 -0.269 -6.039 22.131
560 H ARG 72 H ARG 72 1.062 -10.386 15.397
561 HA ARG 72 HA ARG 72 1.232 -10.926 12.559
562 HB2 ARG 72 2HB ARG 72 1.419 -13.313 13.262
563 HB3 ARG 72 1HB ARG 72 2.586 -12.273 14.071
564 HG2 ARG 72 2HG ARG 72 1.236 -12.279 16.109
565 HG3 ARG 72 1HG ARG 72 -0.017 -13.225 15.304
566 HD2 ARG 72 2HD ARG 72 1.576 -15.105 15.059
567 HD3 ARG 72 1HD ARG 72 2.819 -14.157 15.888
568 HE ARG 72 HE ARG 72 0.344 -15.239 17.074
569 HH11 ARG 72 1HH1 ARG 72 3.504 -13.760 17.530
570 HH12 ARG 72 2HH1 ARG 72 3.503 -14.030 19.243
571 HH21 ARG 72 1HH2 ARG 72 0.368 -15.576 19.295
572 HH22 ARG 72 2HH2 ARG 72 1.726 -15.059 20.239
573 H VAL 73 H VAL 73 -0.974 -9.732 12.423
574 HA VAL 73 HA VAL 73 -3.368 -10.829 13.411
575 HB VAL 73 HB VAL 73 -4.545 -9.281 11.897
576 HG11 VAL 73 1HG1 VAL 73 -3.610 -8.365 13.967
577 HG12 VAL 73 2HG1 VAL 73 -3.544 -7.155 12.685
578 HG13 VAL 73 3HG1 VAL 73 -2.078 -8.020 13.158
579 HG21 VAL 73 3HG2 VAL 73 -3.328 -7.851 10.276
580 HG22 VAL 73 1HG2 VAL 73 -3.218 -9.560 9.843
581 HG23 VAL 73 2HG2 VAL 73 -1.843 -8.751 10.594
582 H GLN 74 H GLN 74 -1.602 -11.583 10.473
583 HA GLN 74 HA GLN 74 -3.537 -13.744 9.855
584 HB2 GLN 74 2HB GLN 74 -2.190 -11.890 7.830
585 HB3 GLN 74 1HB GLN 74 -3.069 -13.353 7.398
586 HG2 GLN 74 2HG GLN 74 -4.265 -10.944 8.796
587 HG3 GLN 74 1HG GLN 74 -4.425 -11.312 7.078
588 HE21 GLN 74 1HE2 GLN 74 -6.380 -11.118 9.389
589 HE22 GLN 74 2HE2 GLN 74 -7.301 -12.576 9.301
590 H ARG 75 H ARG 75 -0.790 -13.502 11.242
591 HA ARG 75 HA ARG 75 0.627 -15.569 9.643
592 HB2 ARG 75 2HB ARG 75 1.930 -13.405 11.353
593 HB3 ARG 75 1HB ARG 75 2.781 -14.673 10.479
594 HG2 ARG 75 2HG ARG 75 1.161 -12.430 9.242
595 HG3 ARG 75 1HG ARG 75 2.920 -12.528 9.303
596 HD2 ARG 75 2HD ARG 75 2.890 -14.473 7.824
597 HD3 ARG 75 1HD ARG 75 1.124 -14.501 7.858
598 HE ARG 75 HE ARG 75 2.837 -12.553 6.462
599 HH11 ARG 75 1HH1 ARG 75 -0.399 -13.810 7.054
600 HH12 ARG 75 2HH1 ARG 75 -1.104 -12.927 5.740
601 HH21 ARG 75 1HH2 ARG 75 1.889 -11.406 4.763
602 HH22 ARG 75 2HH2 ARG 75 0.192 -11.563 4.445
603 H SER 76 H SER 76 -1.186 -15.221 12.331
604 HA SER 76 HA SER 76 0.322 -16.648 14.306
605 HB2 SER 76 2HB SER 76 -2.693 -16.270 14.066
606 HB3 SER 76 1HB SER 76 -1.841 -16.849 15.504
607 HG SER 76 HG SER 76 -2.207 -14.665 15.709
608 H GLN 77 H GLN 77 -1.804 -17.573 11.677
609 HA GLN 77 HA GLN 77 -0.996 -20.319 11.732
610 HB2 GLN 77 2HB GLN 77 -3.235 -21.308 12.154
611 HB3 GLN 77 1HB GLN 77 -2.672 -20.402 13.551
612 HG2 GLN 77 2HG GLN 77 -4.120 -18.471 12.785
613 HG3 GLN 77 1HG GLN 77 -4.801 -19.539 11.558
614 HE21 GLN 77 1HE2 GLN 77 -6.187 -18.206 13.684
615 HE22 GLN 77 2HE2 GLN 77 -6.907 -19.437 14.661
616 H ASN 78 H ASN 78 -1.154 -21.131 9.738
617 HA ASN 78 HA ASN 78 -1.256 -21.181 7.482
618 HB2 ASN 78 2HB ASN 78 -4.160 -20.895 8.310
619 HB3 ASN 78 1HB ASN 78 -3.701 -21.215 6.638
620 HD21 ASN 78 1HD2 ASN 78 -4.987 -23.162 6.975
621 HD22 ASN 78 2HD2 ASN 78 -4.229 -24.551 7.667
622 HA PRO 79 HA PRO 79 -1.193 -16.484 6.893
623 HB2 PRO 79 2HB PRO 79 1.385 -17.321 5.567
624 HB3 PRO 79 1HB PRO 79 1.061 -15.939 6.636
625 HG2 PRO 79 2HG PRO 79 2.383 -18.027 7.588
626 HG3 PRO 79 1HG PRO 79 1.133 -17.241 8.585
627 HD2 PRO 79 2HD PRO 79 0.936 -19.790 6.983
628 HD3 PRO 79 1HD PRO 79 0.354 -19.450 8.630
629 H LEU 80 H LEU 80 -2.430 -15.890 5.251
630 HA LEU 80 HA LEU 80 -3.202 -17.390 3.060
631 HB2 LEU 80 2HB LEU 80 -3.171 -14.352 3.243
632 HB3 LEU 80 1HB LEU 80 -4.203 -15.316 2.194
633 HG LEU 80 HG LEU 80 -4.327 -15.270 5.239
634 HD11 LEU 80 1HD1 LEU 80 -6.247 -14.061 3.224
635 HD12 LEU 80 2HD1 LEU 80 -5.140 -13.176 4.279
636 HD13 LEU 80 3HD1 LEU 80 -6.464 -14.102 4.978
637 HD21 LEU 80 3HD2 LEU 80 -4.975 -17.462 4.407
638 HD22 LEU 80 1HD2 LEU 80 -6.101 -16.738 3.255
639 HD23 LEU 80 2HD2 LEU 80 -6.398 -16.606 4.991
640 H LYS 81 H LYS 81 -2.318 -17.805 1.103
641 HA LYS 81 HA LYS 81 0.491 -17.328 0.858
642 HB2 LYS 81 2HB LYS 81 -1.378 -18.848 -1.003
643 HB3 LYS 81 1HB LYS 81 0.381 -18.892 -1.062
644 HG2 LYS 81 2HG LYS 81 -1.394 -19.959 1.159
645 HG3 LYS 81 1HG LYS 81 -0.447 -20.906 0.013
646 HD2 LYS 81 2HD LYS 81 0.650 -19.096 2.201
647 HD3 LYS 81 1HD LYS 81 0.651 -20.857 2.206
648 HE2 LYS 81 2HE LYS 81 2.213 -19.072 0.303
649 HE3 LYS 81 1HE LYS 81 2.875 -20.011 1.641
650 HZ1 LYS 81 3HZ LYS 81 3.157 -21.070 -0.540
651 HZ2 LYS 81 1HZ LYS 81 1.484 -21.188 -0.695
652 HZ3 LYS 81 2HZ LYS 81 2.276 -22.024 0.541
653 H ILE 82 H ILE 82 1.600 -16.294 -0.772
654 HA ILE 82 HA ILE 82 0.073 -14.089 -2.057
655 HB ILE 82 HB ILE 82 1.998 -12.652 -1.735
656 HG12 ILE 82 2HG1 ILE 82 3.529 -15.006 -0.499
657 HG13 ILE 82 1HG1 ILE 82 3.803 -14.384 -2.121
658 HG21 ILE 82 1HG2 ILE 82 0.498 -12.856 0.203
659 HG22 ILE 82 2HG2 ILE 82 2.151 -12.575 0.745
660 HG23 ILE 82 3HG2 ILE 82 1.456 -14.196 0.837
661 HD11 ILE 82 3HD1 ILE 82 5.475 -13.568 -0.593
662 HD12 ILE 82 1HD1 ILE 82 4.237 -12.857 0.442
663 HD13 ILE 82 2HD1 ILE 82 4.492 -12.232 -1.189
664 H ARG 83 H ARG 83 0.709 -13.379 -4.125
665 HA ARG 83 HA ARG 83 2.929 -14.728 -5.515
666 HB2 ARG 83 2HB ARG 83 0.099 -14.438 -6.612
667 HB3 ARG 83 1HB ARG 83 1.492 -14.628 -7.670
668 HG2 ARG 83 2HG ARG 83 2.001 -16.798 -6.462
669 HG3 ARG 83 1HG ARG 83 0.448 -16.623 -5.640
670 HD2 ARG 83 2HD ARG 83 0.257 -18.125 -7.573
671 HD3 ARG 83 1HD ARG 83 -0.710 -16.667 -7.819
672 HE ARG 83 HE ARG 83 1.894 -16.365 -8.933
673 HH11 ARG 83 1HH1 ARG 83 -1.180 -17.930 -9.601
674 HH12 ARG 83 2HH1 ARG 83 -0.936 -17.942 -11.317
675 HH21 ARG 83 1HH2 ARG 83 2.203 -16.389 -11.191
676 HH22 ARG 83 2HH2 ARG 83 0.985 -17.068 -12.222
677 H LEU 84 H LEU 84 3.543 -13.541 -7.510
678 HA LEU 84 HA LEU 84 4.670 -11.778 -8.306
679 HB2 LEU 84 2HB LEU 84 2.000 -10.377 -7.928
680 HB3 LEU 84 1HB LEU 84 3.304 -9.824 -8.970
681 HG LEU 84 HG LEU 84 1.592 -12.320 -9.349
682 HD11 LEU 84 1HD1 LEU 84 0.897 -11.280 -11.437
683 HD12 LEU 84 2HD1 LEU 84 1.913 -9.874 -11.103
684 HD13 LEU 84 3HD1 LEU 84 0.534 -10.238 -10.063
685 HD21 LEU 84 3HD2 LEU 84 2.877 -12.808 -11.381
686 HD22 LEU 84 1HD2 LEU 84 3.903 -12.883 -9.951
687 HD23 LEU 84 2HD2 LEU 84 3.984 -11.482 -11.020
688 H THR 85 H THR 85 5.700 -12.089 -6.165
689 HA THR 85 HA THR 85 5.438 -10.122 -4.111
690 HB THR 85 HB THR 85 7.633 -12.177 -4.637
691 HG1 THR 85 HG1 THR 85 5.204 -12.659 -4.100
692 HG21 THR 85 3HG2 THR 85 8.178 -11.945 -2.221
693 HG22 THR 85 1HG2 THR 85 7.013 -10.620 -2.095
694 HG23 THR 85 2HG2 THR 85 8.458 -10.433 -3.087
695 H ARG 86 H ARG 86 5.578 -8.218 -5.376
696 HA ARG 86 HA ARG 86 8.022 -7.480 -6.754
697 HB2 ARG 86 2HB ARG 86 5.468 -5.911 -6.191
698 HB3 ARG 86 1HB ARG 86 6.795 -5.340 -7.201
699 HG2 ARG 86 2HG ARG 86 6.422 -7.221 -8.759
700 HG3 ARG 86 1HG ARG 86 5.092 -7.797 -7.753
701 HD2 ARG 86 2HD ARG 86 3.831 -5.724 -8.227
702 HD3 ARG 86 1HD ARG 86 5.179 -5.120 -9.207
703 HE ARG 86 HE ARG 86 4.120 -7.705 -9.996
704 HH11 ARG 86 1HH1 ARG 86 3.937 -4.244 -10.571
705 HH12 ARG 86 2HH1 ARG 86 3.236 -4.430 -12.146
706 HH21 ARG 86 1HH2 ARG 86 3.243 -7.929 -12.066
707 HH22 ARG 86 2HH2 ARG 86 2.841 -6.512 -12.993
708 H GLU 87 H GLU 87 9.635 -7.367 -5.253
709 HA GLU 87 HA GLU 87 9.606 -5.979 -2.784
710 HB2 GLU 87 2HB GLU 87 11.411 -7.573 -3.438
711 HB3 GLU 87 1HB GLU 87 11.950 -6.448 -4.682
712 HG2 GLU 87 2HG GLU 87 12.385 -4.760 -2.817
713 HG3 GLU 87 1HG GLU 87 12.062 -6.060 -1.671
714 H ALA 88 H ALA 88 9.105 -3.842 -2.614
715 HA ALA 88 HA ALA 88 8.545 -1.722 -3.144
716 HB1 ALA 88 3HB ALA 88 10.978 -1.328 -3.222
717 HB2 ALA 88 1HB ALA 88 10.128 -0.324 -4.395
718 HB3 ALA 88 2HB ALA 88 10.999 -1.765 -4.930
719 HA PRO 89 HA PRO 89 5.985 -3.336 -6.661
720 HB2 PRO 89 2HB PRO 89 4.259 -1.076 -5.660
721 HB3 PRO 89 1HB PRO 89 3.812 -2.747 -6.063
722 HG2 PRO 89 2HG PRO 89 4.013 -2.005 -3.523
723 HG3 PRO 89 1HG PRO 89 4.600 -3.600 -4.045
724 HD2 PRO 89 2HD PRO 89 6.187 -1.130 -3.398
725 HD3 PRO 89 1HD PRO 89 6.558 -2.836 -3.055
Start of MODEL 10
1 H1 HIS 1 1H HIS 1 -2.696 -22.513 18.131
2 H2 HIS 1 2H HIS 1 -3.772 -23.805 17.996
3 H3 HIS 1 3H HIS 1 -4.238 -22.261 17.490
4 HA HIS 1 HA HIS 1 -2.069 -23.879 16.308
5 HB2 HIS 1 2HB HIS 1 -4.901 -23.347 15.287
6 HB3 HIS 1 1HB HIS 1 -3.616 -24.013 14.286
7 HD1 HIS 1 HD1 HIS 1 -3.417 -26.510 14.277
8 HD2 HIS 1 HD2 HIS 1 -5.483 -25.173 17.633
9 HE1 HIS 1 HE1 HIS 1 -4.254 -28.572 15.434
10 HE2 HIS 1 HE2 HIS 1 -5.341 -27.746 17.535
11 H HIS 2 H HIS 2 -0.590 -22.205 16.303
12 HA HIS 2 HA HIS 2 -1.120 -19.989 14.418
13 HB2 HIS 2 2HB HIS 2 0.108 -19.758 17.195
14 HB3 HIS 2 1HB HIS 2 0.365 -18.535 15.958
15 HD1 HIS 2 HD1 HIS 2 -1.890 -17.309 15.086
16 HD2 HIS 2 HD2 HIS 2 -2.200 -19.400 18.662
17 HE1 HIS 2 HE1 HIS 2 -3.979 -16.465 16.191
18 HE2 HIS 2 HE2 HIS 2 -4.180 -17.796 18.306
19 H HIS 3 H HIS 3 0.529 -19.574 13.039
20 HA HIS 3 HA HIS 3 3.137 -20.903 13.350
21 HB2 HIS 3 2HB HIS 3 1.296 -21.268 10.935
22 HB3 HIS 3 1HB HIS 3 2.988 -21.751 10.976
23 HD1 HIS 3 HD1 HIS 3 -0.311 -23.093 11.476
24 HD2 HIS 3 HD2 HIS 3 3.453 -23.822 13.066
25 HE1 HIS 3 HE1 HIS 3 -0.442 -25.372 12.512
26 HE2 HIS 3 HE2 HIS 3 1.779 -25.687 13.633
27 H HIS 4 H HIS 4 4.785 -19.976 12.022
28 HA HIS 4 HA HIS 4 4.303 -17.237 11.100
29 HB2 HIS 4 2HB HIS 4 6.294 -17.680 12.490
30 HB3 HIS 4 1HB HIS 4 6.873 -18.868 11.331
31 HD1 HIS 4 HD1 HIS 4 5.995 -15.139 11.274
32 HD2 HIS 4 HD2 HIS 4 8.775 -17.787 9.682
33 HE1 HIS 4 HE1 HIS 4 7.543 -13.751 9.876
34 HE2 HIS 4 HE2 HIS 4 9.348 -15.335 9.182
35 H HIS 5 H HIS 5 5.172 -16.541 8.968
36 HA HIS 5 HA HIS 5 5.106 -18.614 6.862
37 HB2 HIS 5 2HB HIS 5 2.897 -17.397 7.134
38 HB3 HIS 5 1HB HIS 5 3.716 -15.907 6.691
39 HD1 HIS 5 HD1 HIS 5 3.101 -15.345 4.362
40 HD2 HIS 5 HD2 HIS 5 3.517 -19.452 4.853
41 HE1 HIS 5 HE1 HIS 5 2.564 -16.350 2.140
42 HE2 HIS 5 HE2 HIS 5 2.972 -18.804 2.419
43 H HIS 6 H HIS 6 6.789 -18.439 5.484
44 HA HIS 6 HA HIS 6 8.645 -16.195 5.690
45 HB2 HIS 6 2HB HIS 6 8.827 -18.692 3.950
46 HB3 HIS 6 1HB HIS 6 10.112 -17.516 4.206
47 HD1 HIS 6 HD1 HIS 6 11.120 -17.427 6.693
48 HD2 HIS 6 HD2 HIS 6 8.715 -20.711 5.844
49 HE1 HIS 6 HE1 HIS 6 11.539 -19.068 8.538
50 HE2 HIS 6 HE2 HIS 6 10.014 -20.995 8.056
51 H SER 7 H SER 7 7.660 -14.441 4.760
52 HA SER 7 HA SER 7 7.566 -14.188 1.905
53 HB2 SER 7 2HB SER 7 5.122 -13.745 1.700
54 HB3 SER 7 1HB SER 7 5.399 -15.390 2.268
55 HG SER 7 HG SER 7 4.149 -13.295 3.500
56 H HIS 8 H HIS 8 6.374 -11.947 1.388
57 HA HIS 8 HA HIS 8 7.277 -9.765 2.893
58 HB2 HIS 8 2HB HIS 8 6.395 -9.716 0.513
59 HB3 HIS 8 1HB HIS 8 4.774 -9.917 1.145
60 HD1 HIS 8 HD1 HIS 8 6.655 -7.416 -0.285
61 HD2 HIS 8 HD2 HIS 8 4.438 -7.529 3.226
62 HE1 HIS 8 HE1 HIS 8 5.962 -5.047 0.156
63 HE2 HIS 8 HE2 HIS 8 4.934 -5.128 2.436
64 H MET 9 H MET 9 6.799 -9.572 5.001
65 HA MET 9 HA MET 9 4.735 -11.122 6.243
66 HB2 MET 9 2HB MET 9 5.771 -10.326 8.366
67 HB3 MET 9 1HB MET 9 6.954 -10.981 7.244
68 HG2 MET 9 2HG MET 9 7.600 -8.672 6.599
69 HG3 MET 9 1HG MET 9 6.447 -8.039 7.773
70 HE1 MET 9 3HE MET 9 8.821 -11.254 8.260
71 HE2 MET 9 1HE MET 9 10.223 -10.453 8.954
72 HE3 MET 9 2HE MET 9 9.768 -10.132 7.279
73 H VAL 10 H VAL 10 3.485 -10.182 8.107
74 HA VAL 10 HA VAL 10 1.726 -8.101 7.251
75 HB VAL 10 HB VAL 10 0.564 -8.422 9.409
76 HG11 VAL 10 1HG1 VAL 10 0.075 -10.014 7.592
77 HG12 VAL 10 2HG1 VAL 10 -0.064 -10.795 9.168
78 HG13 VAL 10 3HG1 VAL 10 1.359 -11.082 8.166
79 HG21 VAL 10 3HG2 VAL 10 2.853 -10.286 10.177
80 HG22 VAL 10 1HG2 VAL 10 1.367 -10.052 11.103
81 HG23 VAL 10 2HG2 VAL 10 2.507 -8.719 10.910
82 H GLY 11 H GLY 11 1.556 -5.985 7.963
83 HA2 GLY 11 2HA GLY 11 1.956 -4.094 9.247
84 HA3 GLY 11 1HA GLY 11 3.148 -4.976 10.183
85 H ASP 12 H ASP 12 3.678 -5.237 6.765
86 HA ASP 12 HA ASP 12 6.224 -3.940 7.026
87 HB2 ASP 12 2HB ASP 12 5.712 -5.803 5.372
88 HB3 ASP 12 1HB ASP 12 4.851 -4.630 4.394
89 H THR 13 H THR 13 6.807 -1.833 6.665
90 HA THR 13 HA THR 13 4.689 0.099 6.691
91 HB THR 13 HB THR 13 7.710 0.539 6.577
92 HG1 THR 13 HG1 THR 13 5.992 -0.339 8.559
93 HG21 THR 13 3HG2 THR 13 7.203 2.706 7.665
94 HG22 THR 13 1HG2 THR 13 5.477 2.362 7.569
95 HG23 THR 13 2HG2 THR 13 6.413 2.605 6.090
96 H VAL 14 H VAL 14 3.730 0.803 4.901
97 HA VAL 14 HA VAL 14 5.246 1.485 2.470
98 HB VAL 14 HB VAL 14 3.412 0.616 1.031
99 HG11 VAL 14 1HG1 VAL 14 4.619 -1.543 2.790
100 HG12 VAL 14 2HG1 VAL 14 5.388 -0.788 1.391
101 HG13 VAL 14 3HG1 VAL 14 3.942 -1.774 1.173
102 HG21 VAL 14 3HG2 VAL 14 1.540 0.699 2.632
103 HG22 VAL 14 1HG2 VAL 14 2.262 -0.607 3.578
104 HG23 VAL 14 2HG2 VAL 14 1.684 -0.914 1.937
105 H TRP 15 H TRP 15 3.651 2.649 0.934
106 HA TRP 15 HA TRP 15 1.812 4.485 2.335
107 HB2 TRP 15 2HB TRP 15 3.806 5.130 0.104
108 HB3 TRP 15 1HB TRP 15 2.530 6.230 0.623
109 HD1 TRP 15 HD1 TRP 15 3.073 5.607 3.846
110 HE1 TRP 15 HE1 TRP 15 5.071 6.789 4.935
111 HE3 TRP 15 HE3 TRP 15 5.778 6.744 -0.342
112 HZ2 TRP 15 HZ2 TRP 15 7.447 8.061 4.163
113 HZ3 TRP 15 HZ3 TRP 15 7.906 7.962 -0.081
114 HH2 TRP 15 HH2 TRP 15 8.723 8.604 2.133
115 H VAL 16 H VAL 16 -0.026 5.094 1.057
116 HA VAL 16 HA VAL 16 -0.537 3.440 -1.348
117 HB VAL 16 HB VAL 16 -2.546 4.820 0.503
118 HG11 VAL 16 1HG1 VAL 16 -3.373 4.811 -1.830
119 HG12 VAL 16 2HG1 VAL 16 -4.304 3.685 -0.839
120 HG13 VAL 16 3HG1 VAL 16 -3.068 3.074 -1.940
121 HG21 VAL 16 3HG2 VAL 16 -3.236 2.524 1.130
122 HG22 VAL 16 1HG2 VAL 16 -1.537 2.809 1.525
123 HG23 VAL 16 2HG2 VAL 16 -1.966 1.860 0.100
124 H ARG 17 H ARG 17 0.124 4.579 -3.004
125 HA ARG 17 HA ARG 17 0.030 7.451 -3.186
126 HB2 ARG 17 2HB ARG 17 1.921 5.987 -4.025
127 HB3 ARG 17 1HB ARG 17 0.843 5.381 -5.276
128 HG2 ARG 17 2HG ARG 17 0.662 7.642 -6.220
129 HG3 ARG 17 1HG ARG 17 1.703 8.268 -4.943
130 HD2 ARG 17 2HD ARG 17 3.564 6.874 -5.768
131 HD3 ARG 17 1HD ARG 17 2.516 6.214 -7.030
132 HE ARG 17 HE ARG 17 2.574 9.043 -7.200
133 HH11 ARG 17 1HH1 ARG 17 4.647 6.276 -7.842
134 HH12 ARG 17 2HH1 ARG 17 5.538 7.086 -9.086
135 HH21 ARG 17 1HH2 ARG 17 3.722 10.080 -8.846
136 HH22 ARG 17 2HH2 ARG 17 5.015 9.258 -9.667
137 H ARG 18 H ARG 18 -2.097 8.065 -3.221
138 HA ARG 18 HA ARG 18 -4.079 6.813 -4.925
139 HB2 ARG 18 2HB ARG 18 -4.727 7.547 -2.682
140 HB3 ARG 18 1HB ARG 18 -4.231 9.197 -3.040
141 HG2 ARG 18 2HG ARG 18 -6.036 9.413 -4.693
142 HG3 ARG 18 1HG ARG 18 -6.507 7.734 -4.428
143 HD2 ARG 18 2HD ARG 18 -7.174 8.235 -2.142
144 HD3 ARG 18 1HD ARG 18 -6.551 9.877 -2.281
145 HE ARG 18 HE ARG 18 -8.344 10.031 -4.165
146 HH11 ARG 18 1HH1 ARG 18 -8.765 8.322 -1.100
147 HH12 ARG 18 2HH1 ARG 18 -10.482 8.573 -1.061
148 HH21 ARG 18 1HH2 ARG 18 -10.600 10.388 -4.064
149 HH22 ARG 18 2HH2 ARG 18 -11.522 9.742 -2.742
150 H HIS 19 H HIS 19 -4.313 7.342 -6.968
151 HA HIS 19 HA HIS 19 -3.350 9.830 -8.134
152 HB2 HIS 19 2HB HIS 19 -3.090 7.626 -9.283
153 HB3 HIS 19 1HB HIS 19 -4.841 7.481 -9.396
154 HD1 HIS 19 HD1 HIS 19 -2.050 9.745 -10.581
155 HD2 HIS 19 HD2 HIS 19 -5.843 8.536 -11.728
156 HE1 HIS 19 HE1 HIS 19 -2.393 10.703 -12.862
157 HE2 HIS 19 HE2 HIS 19 -4.568 9.722 -13.616
158 H GLN 20 H GLN 20 -4.564 11.581 -7.803
159 HA GLN 20 HA GLN 20 -7.305 11.594 -7.099
160 HB2 GLN 20 2HB GLN 20 -5.507 13.864 -8.055
161 HB3 GLN 20 1HB GLN 20 -7.123 14.093 -7.399
162 HG2 GLN 20 2HG GLN 20 -4.720 12.987 -5.908
163 HG3 GLN 20 1HG GLN 20 -5.440 14.582 -5.706
164 HE21 GLN 20 1HE2 GLN 20 -7.539 14.719 -4.773
165 HE22 GLN 20 2HE2 GLN 20 -8.141 13.468 -3.749
166 H THR 21 H THR 21 -5.884 13.188 -9.946
167 HA THR 21 HA THR 21 -8.200 12.406 -11.619
168 HB THR 21 HB THR 21 -6.829 15.134 -11.509
169 HG1 THR 21 HG1 THR 21 -9.336 14.214 -10.553
170 HG21 THR 21 3HG2 THR 21 -8.581 15.925 -13.045
171 HG22 THR 21 1HG2 THR 21 -9.241 14.300 -13.159
172 HG23 THR 21 2HG2 THR 21 -7.627 14.642 -13.797
173 H LYS 22 H LYS 22 -7.664 12.269 -13.911
174 HA LYS 22 HA LYS 22 -5.295 10.864 -14.456
175 HB2 LYS 22 2HB LYS 22 -7.172 12.177 -16.460
176 HB3 LYS 22 1HB LYS 22 -6.028 10.883 -16.808
177 HG2 LYS 22 2HG LYS 22 -7.312 9.383 -15.273
178 HG3 LYS 22 1HG LYS 22 -8.485 10.679 -15.026
179 HD2 LYS 22 2HD LYS 22 -7.860 9.288 -17.663
180 HD3 LYS 22 1HD LYS 22 -9.310 9.065 -16.683
181 HE2 LYS 22 2HE LYS 22 -8.495 11.634 -18.097
182 HE3 LYS 22 1HE LYS 22 -9.768 10.526 -18.603
183 HZ1 LYS 22 3HZ LYS 22 -9.744 12.116 -16.096
184 HZ2 LYS 22 1HZ LYS 22 -10.948 11.016 -16.547
185 HZ3 LYS 22 2HZ LYS 22 -10.690 12.410 -17.467
186 H ASN 23 H ASN 23 -6.165 14.243 -15.061
187 HA ASN 23 HA ASN 23 -3.617 14.855 -16.343
188 HB2 ASN 23 2HB ASN 23 -6.051 16.558 -15.695
189 HB3 ASN 23 1HB ASN 23 -4.594 17.213 -16.435
190 HD21 ASN 23 1HD2 ASN 23 -4.044 16.518 -18.579
191 HD22 ASN 23 2HD2 ASN 23 -5.254 15.880 -19.636
192 H LEU 24 H LEU 24 -4.181 14.238 -13.269
193 HA LEU 24 HA LEU 24 -2.327 16.311 -12.224
194 HB2 LEU 24 2HB LEU 24 -4.600 14.903 -10.751
195 HB3 LEU 24 1HB LEU 24 -3.381 15.898 -9.964
196 HG LEU 24 HG LEU 24 -5.444 16.880 -11.982
197 HD11 LEU 24 1HD1 LEU 24 -6.430 16.366 -9.815
198 HD12 LEU 24 2HD1 LEU 24 -6.404 18.105 -10.086
199 HD13 LEU 24 3HD1 LEU 24 -5.225 17.365 -8.997
200 HD21 LEU 24 3HD2 LEU 24 -4.609 19.152 -11.469
201 HD22 LEU 24 1HD2 LEU 24 -3.366 18.153 -12.221
202 HD23 LEU 24 2HD2 LEU 24 -3.318 18.456 -10.483
203 H GLU 25 H GLU 25 -1.157 15.472 -10.240
204 HA GLU 25 HA GLU 25 0.254 13.068 -11.000
205 HB2 GLU 25 2HB GLU 25 0.692 14.910 -8.608
206 HB3 GLU 25 1HB GLU 25 1.814 13.678 -9.185
207 HG2 GLU 25 2HG GLU 25 1.981 14.962 -11.357
208 HG3 GLU 25 1HG GLU 25 1.015 16.237 -10.616
209 HA PRO 26 HA PRO 26 -1.651 10.405 -7.797
210 HB2 PRO 26 2HB PRO 26 0.678 8.616 -7.898
211 HB3 PRO 26 1HB PRO 26 -0.949 8.341 -8.542
212 HG2 PRO 26 2HG PRO 26 1.270 8.674 -10.123
213 HG3 PRO 26 1HG PRO 26 -0.389 9.038 -10.651
214 HD2 PRO 26 2HD PRO 26 1.750 10.933 -9.709
215 HD3 PRO 26 1HD PRO 26 0.559 11.131 -11.017
216 H ARG 27 H ARG 27 -1.592 11.305 -5.785
217 HA ARG 27 HA ARG 27 0.946 12.048 -4.510
218 HB2 ARG 27 2HB ARG 27 -0.923 13.686 -4.536
219 HB3 ARG 27 1HB ARG 27 -1.929 12.560 -3.628
220 HG2 ARG 27 2HG ARG 27 -0.361 12.700 -1.715
221 HG3 ARG 27 1HG ARG 27 0.656 13.810 -2.634
222 HD2 ARG 27 2HD ARG 27 -1.263 15.418 -2.717
223 HD3 ARG 27 1HD ARG 27 -2.181 14.317 -1.684
224 HE ARG 27 HE ARG 27 -0.141 14.636 -0.110
225 HH11 ARG 27 1HH1 ARG 27 -1.520 17.177 -2.113
226 HH12 ARG 27 2HH1 ARG 27 -1.047 18.453 -1.032
227 HH21 ARG 27 1HH2 ARG 27 0.461 16.317 1.302
228 HH22 ARG 27 2HH2 ARG 27 0.071 17.961 0.896
229 H TRP 28 H TRP 28 1.878 10.840 -2.968
230 HA TRP 28 HA TRP 28 0.739 8.364 -2.068
231 HB2 TRP 28 2HB TRP 28 2.830 8.025 -0.846
232 HB3 TRP 28 1HB TRP 28 3.188 8.619 -2.460
233 HD1 TRP 28 HD1 TRP 28 4.354 11.027 -2.649
234 HE1 TRP 28 HE1 TRP 28 5.529 12.522 -0.923
235 HE3 TRP 28 HE3 TRP 28 2.751 8.752 1.646
236 HZ2 TRP 28 HZ2 TRP 28 5.765 12.710 1.879
237 HZ3 TRP 28 HZ3 TRP 28 3.497 9.644 3.814
238 HH2 TRP 28 HH2 TRP 28 4.979 11.589 3.930
239 H LYS 29 H LYS 29 0.149 7.765 0.009
240 HA LYS 29 HA LYS 29 -0.161 9.855 2.095
241 HB2 LYS 29 2HB LYS 29 -2.252 7.758 1.294
242 HB3 LYS 29 1HB LYS 29 -2.387 8.827 2.691
243 HG2 LYS 29 2HG LYS 29 -2.536 10.781 1.253
244 HG3 LYS 29 1HG LYS 29 -2.206 9.803 -0.179
245 HD2 LYS 29 2HD LYS 29 -4.348 8.619 0.121
246 HD3 LYS 29 1HD LYS 29 -4.676 9.555 1.585
247 HE2 LYS 29 2HE LYS 29 -4.353 10.704 -1.210
248 HE3 LYS 29 1HE LYS 29 -5.889 10.462 -0.376
249 HZ1 LYS 29 3HZ LYS 29 -3.704 12.305 0.448
250 HZ2 LYS 29 1HZ LYS 29 -5.121 12.027 1.338
251 HZ3 LYS 29 2HZ LYS 29 -5.208 12.736 -0.187
252 H GLY 30 H GLY 30 0.205 9.101 4.192
253 HA2 GLY 30 2HA GLY 30 0.637 6.263 4.737
254 HA3 GLY 30 1HA GLY 30 2.055 7.281 4.826
255 HA PRO 31 HA PRO 31 2.463 5.686 6.442
256 HB2 PRO 31 2HB PRO 31 2.822 4.623 8.912
257 HB3 PRO 31 1HB PRO 31 3.520 6.199 8.480
258 HG2 PRO 31 2HG PRO 31 1.075 5.619 10.117
259 HG3 PRO 31 1HG PRO 31 2.317 6.866 10.354
260 HD2 PRO 31 2HD PRO 31 -0.176 7.304 9.139
261 HD3 PRO 31 1HD PRO 31 1.241 8.361 8.963
262 H TYR 32 H TYR 32 1.653 3.929 5.400
263 HA TYR 32 HA TYR 32 -0.553 2.335 6.599
264 HB2 TYR 32 2HB TYR 32 0.297 2.734 3.707
265 HB3 TYR 32 1HB TYR 32 -0.801 1.450 4.190
266 HD1 TYR 32 HD1 TYR 32 -3.083 2.002 5.075
267 HD2 TYR 32 HD2 TYR 32 -0.462 5.057 3.631
268 HE1 TYR 32 HE1 TYR 32 -4.966 3.584 4.996
269 HE2 TYR 32 HE2 TYR 32 -2.344 6.634 3.550
270 HH TYR 32 HH TYR 32 -4.748 6.652 3.465
271 H THR 33 H THR 33 -0.405 -0.080 5.831
272 HA THR 33 HA THR 33 2.314 -1.165 6.052
273 HB THR 33 HB THR 33 1.552 -2.551 8.127
274 HG1 THR 33 HG1 THR 33 -0.643 -2.024 8.059
275 HG21 THR 33 3HG2 THR 33 2.156 -0.837 9.786
276 HG22 THR 33 1HG2 THR 33 1.940 0.429 8.571
277 HG23 THR 33 2HG2 THR 33 3.233 -0.755 8.390
278 H VAL 34 H VAL 34 2.296 -2.799 4.522
279 HA VAL 34 HA VAL 34 -0.013 -4.201 3.648
280 HB VAL 34 HB VAL 34 2.923 -4.982 3.328
281 HG11 VAL 34 1HG1 VAL 34 1.487 -6.954 2.975
282 HG12 VAL 34 2HG1 VAL 34 2.194 -6.420 1.450
283 HG13 VAL 34 3HG1 VAL 34 0.507 -6.050 1.819
284 HG21 VAL 34 3HG2 VAL 34 2.407 -2.815 2.298
285 HG22 VAL 34 1HG2 VAL 34 1.083 -3.546 1.390
286 HG23 VAL 34 2HG2 VAL 34 2.751 -4.033 1.070
287 H LEU 35 H LEU 35 -1.055 -5.851 4.531
288 HA LEU 35 HA LEU 35 0.076 -7.535 6.655
289 HB2 LEU 35 2HB LEU 35 -2.745 -7.432 5.509
290 HB3 LEU 35 1HB LEU 35 -2.240 -8.344 6.927
291 HG LEU 35 HG LEU 35 -2.237 -5.300 6.708
292 HD11 LEU 35 1HD1 LEU 35 -4.122 -7.122 8.229
293 HD12 LEU 35 2HD1 LEU 35 -4.505 -6.192 6.777
294 HD13 LEU 35 3HD1 LEU 35 -4.116 -5.355 8.277
295 HD21 LEU 35 3HD2 LEU 35 -1.755 -5.301 9.129
296 HD22 LEU 35 1HD2 LEU 35 -0.463 -6.079 8.213
297 HD23 LEU 35 2HD2 LEU 35 -1.621 -7.064 9.110
298 H LEU 36 H LEU 36 -1.163 -7.719 3.324
299 HA LEU 36 HA LEU 36 0.125 -10.341 2.916
300 HB2 LEU 36 2HB LEU 36 -2.118 -11.043 3.489
301 HB3 LEU 36 1HB LEU 36 -2.838 -9.807 2.475
302 HG LEU 36 HG LEU 36 -1.871 -11.047 0.443
303 HD11 LEU 36 1HD1 LEU 36 -1.334 -13.236 2.462
304 HD12 LEU 36 2HD1 LEU 36 -0.126 -12.325 1.554
305 HD13 LEU 36 3HD1 LEU 36 -1.234 -13.401 0.705
306 HD21 LEU 36 3HD2 LEU 36 -3.900 -12.534 2.125
307 HD22 LEU 36 1HD2 LEU 36 -3.629 -12.755 0.391
308 HD23 LEU 36 2HD2 LEU 36 -4.229 -11.213 0.999
309 H THR 37 H THR 37 0.730 -10.695 0.770
310 HA THR 37 HA THR 37 0.173 -8.567 -1.222
311 HB THR 37 HB THR 37 2.247 -9.442 -2.400
312 HG1 THR 37 HG1 THR 37 2.082 -11.477 -0.920
313 HG21 THR 37 3HG2 THR 37 2.684 -8.423 0.427
314 HG22 THR 37 1HG2 THR 37 2.333 -7.421 -0.990
315 HG23 THR 37 2HG2 THR 37 3.844 -8.326 -0.899
316 H THR 38 H THR 38 -1.013 -9.155 -2.942
317 HA THR 38 HA THR 38 -1.246 -12.004 -3.746
318 HB THR 38 HB THR 38 -3.446 -9.869 -3.702
319 HG1 THR 38 HG1 THR 38 -2.745 -11.919 -1.921
320 HG21 THR 38 3HG2 THR 38 -3.719 -12.815 -4.409
321 HG22 THR 38 1HG2 THR 38 -3.821 -11.473 -5.548
322 HG23 THR 38 2HG2 THR 38 -5.041 -11.647 -4.282
323 HA PRO 39 HA PRO 39 0.136 -10.560 -7.861
324 HB2 PRO 39 2HB PRO 39 -1.863 -11.938 -9.407
325 HB3 PRO 39 1HB PRO 39 -0.224 -12.502 -9.031
326 HG2 PRO 39 2HG PRO 39 -2.797 -13.142 -7.650
327 HG3 PRO 39 1HG PRO 39 -1.383 -14.181 -7.927
328 HD2 PRO 39 2HD PRO 39 -1.831 -13.171 -5.500
329 HD3 PRO 39 1HD PRO 39 -0.167 -13.224 -6.135
330 H THR 40 H THR 40 -0.191 -8.514 -8.342
331 HA THR 40 HA THR 40 -0.993 -6.642 -9.320
332 HB THR 40 HB THR 40 -3.641 -8.078 -9.821
333 HG1 THR 40 HG1 THR 40 -1.123 -8.292 -11.078
334 HG21 THR 40 3HG2 THR 40 -3.699 -5.635 -10.320
335 HG22 THR 40 1HG2 THR 40 -3.834 -6.605 -11.792
336 HG23 THR 40 2HG2 THR 40 -2.304 -5.824 -11.382
337 H ALA 41 H ALA 41 -2.047 -7.823 -6.426
338 HA ALA 41 HA ALA 41 -3.445 -5.345 -5.688
339 HB1 ALA 41 3HB ALA 41 -5.239 -6.822 -6.535
340 HB2 ALA 41 1HB ALA 41 -5.406 -6.551 -4.800
341 HB3 ALA 41 2HB ALA 41 -4.761 -8.080 -5.395
342 H LEU 42 H LEU 42 -2.583 -4.722 -3.754
343 HA LEU 42 HA LEU 42 -1.361 -6.752 -1.983
344 HB2 LEU 42 2HB LEU 42 -0.751 -3.768 -2.099
345 HB3 LEU 42 1HB LEU 42 0.096 -4.978 -1.142
346 HG LEU 42 HG LEU 42 0.128 -4.681 -4.171
347 HD11 LEU 42 1HD1 LEU 42 2.354 -4.424 -2.138
348 HD12 LEU 42 2HD1 LEU 42 1.588 -3.119 -3.047
349 HD13 LEU 42 3HD1 LEU 42 2.540 -4.334 -3.893
350 HD21 LEU 42 3HD2 LEU 42 1.671 -6.606 -4.257
351 HD22 LEU 42 1HD2 LEU 42 0.064 -7.065 -3.704
352 HD23 LEU 42 2HD2 LEU 42 1.383 -6.913 -2.543
353 H LYS 43 H LYS 43 -2.284 -7.107 -0.093
354 HA LYS 43 HA LYS 43 -4.585 -5.586 0.812
355 HB2 LYS 43 2HB LYS 43 -4.656 -8.025 0.906
356 HB3 LYS 43 1HB LYS 43 -3.200 -8.075 1.895
357 HG2 LYS 43 2HG LYS 43 -4.402 -7.012 3.766
358 HG3 LYS 43 1HG LYS 43 -5.855 -6.863 2.770
359 HD2 LYS 43 2HD LYS 43 -4.542 -9.461 3.653
360 HD3 LYS 43 1HD LYS 43 -6.031 -8.773 4.306
361 HE2 LYS 43 2HE LYS 43 -5.617 -9.773 1.458
362 HE3 LYS 43 1HE LYS 43 -6.562 -10.561 2.724
363 HZ1 LYS 43 3HZ LYS 43 -7.152 -7.898 1.559
364 HZ2 LYS 43 1HZ LYS 43 -8.055 -8.687 2.753
365 HZ3 LYS 43 2HZ LYS 43 -7.963 -9.337 1.195
366 H VAL 44 H VAL 44 -4.222 -3.810 1.913
367 HA VAL 44 HA VAL 44 -1.929 -3.520 3.768
368 HB VAL 44 HB VAL 44 -3.469 -1.392 2.195
369 HG11 VAL 44 1HG1 VAL 44 -2.669 -0.500 4.337
370 HG12 VAL 44 2HG1 VAL 44 -1.760 0.204 2.996
371 HG13 VAL 44 3HG1 VAL 44 -1.040 -1.072 3.981
372 HG21 VAL 44 3HG2 VAL 44 -1.384 -1.097 0.877
373 HG22 VAL 44 1HG2 VAL 44 -2.014 -2.742 0.720
374 HG23 VAL 44 2HG2 VAL 44 -0.633 -2.422 1.774
375 H ASP 45 H ASP 45 -2.374 -2.676 5.835
376 HA ASP 45 HA ASP 45 -4.942 -3.033 6.984
377 HB2 ASP 45 2HB ASP 45 -2.760 -3.391 8.187
378 HB3 ASP 45 1HB ASP 45 -2.484 -1.658 8.160
379 H GLY 46 H GLY 46 -6.533 -1.578 7.262
380 HA2 GLY 46 2HA GLY 46 -7.494 0.580 7.551
381 HA3 GLY 46 1HA GLY 46 -6.106 1.298 6.749
382 H ILE 47 H ILE 47 -6.867 -1.393 5.003
383 HA ILE 47 HA ILE 47 -8.542 0.125 3.080
384 HB ILE 47 HB ILE 47 -6.511 -2.097 2.543
385 HG12 ILE 47 2HG1 ILE 47 -5.337 -0.043 3.176
386 HG13 ILE 47 1HG1 ILE 47 -5.128 -0.312 1.453
387 HG21 ILE 47 1HG2 ILE 47 -8.110 -0.456 0.548
388 HG22 ILE 47 2HG2 ILE 47 -8.302 -2.178 0.878
389 HG23 ILE 47 3HG2 ILE 47 -6.817 -1.584 0.134
390 HD11 ILE 47 3HD1 ILE 47 -6.993 1.685 2.736
391 HD12 ILE 47 1HD1 ILE 47 -6.825 1.413 0.996
392 HD13 ILE 47 2HD1 ILE 47 -5.461 2.023 1.932
393 H ALA 48 H ALA 48 -10.210 -1.045 1.991
394 HA ALA 48 HA ALA 48 -11.787 -2.670 3.614
395 HB1 ALA 48 3HB ALA 48 -12.679 -1.209 1.858
396 HB2 ALA 48 1HB ALA 48 -13.275 -2.860 1.665
397 HB3 ALA 48 2HB ALA 48 -11.988 -2.254 0.615
398 H ALA 49 H ALA 49 -9.848 -3.633 0.731
399 HA ALA 49 HA ALA 49 -9.389 -6.244 1.974
400 HB1 ALA 49 3HB ALA 49 -11.423 -6.617 0.616
401 HB2 ALA 49 1HB ALA 49 -10.048 -7.537 -0.000
402 HB3 ALA 49 2HB ALA 49 -10.568 -6.062 -0.822
403 H TRP 50 H TRP 50 -8.864 -4.485 -1.125
404 HA TRP 50 HA TRP 50 -5.952 -4.857 -0.871
405 HB2 TRP 50 2HB TRP 50 -7.583 -5.808 -3.269
406 HB3 TRP 50 1HB TRP 50 -5.844 -5.566 -3.326
407 HD1 TRP 50 HD1 TRP 50 -4.351 -7.260 -1.704
408 HE1 TRP 50 HE1 TRP 50 -4.765 -9.725 -1.122
409 HE3 TRP 50 HE3 TRP 50 -9.320 -7.550 -2.877
410 HZ2 TRP 50 HZ2 TRP 50 -6.896 -11.558 -1.147
411 HZ3 TRP 50 HZ3 TRP 50 -10.473 -9.703 -2.584
412 HH2 TRP 50 HH2 TRP 50 -9.288 -11.669 -1.736
413 H ILE 51 H ILE 51 -4.757 -3.221 -1.795
414 HA ILE 51 HA ILE 51 -6.056 -1.209 -3.531
415 HB ILE 51 HB ILE 51 -3.356 -1.194 -2.086
416 HG12 ILE 51 2HG1 ILE 51 -5.317 -0.627 -0.676
417 HG13 ILE 51 1HG1 ILE 51 -4.259 0.763 -0.876
418 HG21 ILE 51 1HG2 ILE 51 -4.366 0.903 -4.051
419 HG22 ILE 51 2HG2 ILE 51 -2.961 -0.147 -4.264
420 HG23 ILE 51 3HG2 ILE 51 -2.956 1.086 -3.004
421 HD11 ILE 51 3HD1 ILE 51 -6.587 1.401 -0.985
422 HD12 ILE 51 1HD1 ILE 51 -6.867 0.294 -2.327
423 HD13 ILE 51 2HD1 ILE 51 -5.810 1.696 -2.538
424 H HIS 52 H HIS 52 -5.503 -1.077 -5.678
425 HA HIS 52 HA HIS 52 -4.313 -3.214 -7.075
426 HB2 HIS 52 2HB HIS 52 -5.915 -1.398 -7.970
427 HB3 HIS 52 1HB HIS 52 -4.530 -0.320 -8.035
428 HD1 HIS 52 HD1 HIS 52 -2.575 -1.128 -9.761
429 HD2 HIS 52 HD2 HIS 52 -6.301 -2.900 -10.194
430 HE1 HIS 52 HE1 HIS 52 -2.580 -2.173 -12.035
431 HE2 HIS 52 HE2 HIS 52 -4.893 -3.058 -12.335
432 H ALA 53 H ALA 53 -2.137 -3.683 -7.345
433 HA ALA 53 HA ALA 53 -0.322 -2.730 -5.483
434 HB1 ALA 53 3HB ALA 53 0.337 -4.348 -7.961
435 HB2 ALA 53 1HB ALA 53 -0.273 -4.999 -6.439
436 HB3 ALA 53 2HB ALA 53 1.317 -4.234 -6.494
437 H ALA 54 H ALA 54 -0.728 -1.621 -8.763
438 HA ALA 54 HA ALA 54 1.725 -0.211 -9.033
439 HB1 ALA 54 3HB ALA 54 0.670 0.813 -10.999
440 HB2 ALA 54 1HB ALA 54 -0.906 0.206 -10.476
441 HB3 ALA 54 2HB ALA 54 0.362 -0.922 -10.946
442 H HIS 55 H HIS 55 -0.748 0.444 -6.922
443 HA HIS 55 HA HIS 55 -0.189 3.352 -6.770
444 HB2 HIS 55 2HB HIS 55 -2.659 1.773 -5.890
445 HB3 HIS 55 1HB HIS 55 -2.387 3.464 -5.490
446 HD1 HIS 55 HD1 HIS 55 -2.253 5.115 -7.628
447 HD2 HIS 55 HD2 HIS 55 -3.955 1.382 -8.251
448 HE1 HIS 55 HE1 HIS 55 -3.577 5.319 -9.754
449 HE2 HIS 55 HE2 HIS 55 -4.457 3.009 -10.180
450 H VAL 56 H VAL 56 1.126 0.775 -5.531
451 HA VAL 56 HA VAL 56 1.116 1.760 -2.717
452 HB VAL 56 HB VAL 56 1.821 -1.072 -3.633
453 HG11 VAL 56 1HG1 VAL 56 1.451 0.061 -0.832
454 HG12 VAL 56 2HG1 VAL 56 2.985 -0.418 -1.559
455 HG13 VAL 56 3HG1 VAL 56 1.754 -1.635 -1.216
456 HG21 VAL 56 3HG2 VAL 56 -0.308 -1.802 -2.602
457 HG22 VAL 56 1HG2 VAL 56 -0.591 -0.694 -3.949
458 HG23 VAL 56 2HG2 VAL 56 -0.730 -0.118 -2.286
459 H LYS 57 H LYS 57 3.030 2.410 -1.905
460 HA LYS 57 HA LYS 57 5.523 1.987 -3.451
461 HB2 LYS 57 2HB LYS 57 4.750 4.326 -3.635
462 HB3 LYS 57 1HB LYS 57 4.628 4.446 -1.882
463 HG2 LYS 57 2HG LYS 57 7.063 4.201 -1.668
464 HG3 LYS 57 1HG LYS 57 7.220 4.004 -3.414
465 HD2 LYS 57 2HD LYS 57 6.413 6.319 -3.751
466 HD3 LYS 57 1HD LYS 57 6.198 6.506 -2.009
467 HE2 LYS 57 2HE LYS 57 8.289 7.576 -2.716
468 HE3 LYS 57 1HE LYS 57 8.646 6.185 -1.691
469 HZ1 LYS 57 3HZ LYS 57 9.122 4.892 -3.674
470 HZ2 LYS 57 1HZ LYS 57 10.100 6.271 -3.607
471 HZ3 LYS 57 2HZ LYS 57 8.780 6.222 -4.660
472 H ALA 58 H ALA 58 6.965 0.813 -2.311
473 HA ALA 58 HA ALA 58 6.662 0.025 0.390
474 HB1 ALA 58 3HB ALA 58 9.112 -0.112 -1.401
475 HB2 ALA 58 1HB ALA 58 7.850 -1.338 -1.273
476 HB3 ALA 58 2HB ALA 58 8.895 -1.001 0.109
477 H ALA 59 H ALA 59 7.046 1.221 2.180
478 HA ALA 59 HA ALA 59 8.843 3.581 2.080
479 HB1 ALA 59 3HB ALA 59 7.664 4.325 4.110
480 HB2 ALA 59 1HB ALA 59 6.708 2.839 4.112
481 HB3 ALA 59 2HB ALA 59 6.527 4.005 2.799
482 H ASP 60 H ASP 60 10.072 3.981 4.169
483 HA ASP 60 HA ASP 60 11.781 1.741 4.686
484 HB2 ASP 60 2HB ASP 60 12.545 4.147 4.475
485 HB3 ASP 60 1HB ASP 60 11.801 4.484 6.031
486 HA PRO 61 HA PRO 61 9.338 0.310 8.309
487 HB2 PRO 61 2HB PRO 61 11.485 -1.766 8.470
488 HB3 PRO 61 1HB PRO 61 9.723 -1.966 8.325
489 HG2 PRO 61 2HG PRO 61 11.305 -2.499 6.238
490 HG3 PRO 61 1HG PRO 61 9.734 -1.694 6.000
491 HD2 PRO 61 2HD PRO 61 12.489 -0.443 6.091
492 HD3 PRO 61 1HD PRO 61 11.170 -0.181 4.924
493 H GLY 62 H GLY 62 12.329 1.797 8.247
494 HA2 GLY 62 2HA GLY 62 13.330 1.628 10.852
495 HA3 GLY 62 1HA GLY 62 13.450 3.025 9.795
496 H GLY 63 H GLY 63 11.790 1.587 12.418
497 HA2 GLY 63 2HA GLY 63 10.590 2.980 14.057
498 HA3 GLY 63 1HA GLY 63 9.829 3.810 12.700
499 H GLY 64 H GLY 64 8.775 2.221 11.076
500 HA2 GLY 64 2HA GLY 64 7.425 0.454 10.499
501 HA3 GLY 64 1HA GLY 64 7.922 -0.373 11.967
502 HA PRO 65 HA PRO 65 3.473 0.891 12.647
503 HB2 PRO 65 2HB PRO 65 2.432 -1.565 13.186
504 HB3 PRO 65 1HB PRO 65 2.648 -0.986 11.518
505 HG2 PRO 65 2HG PRO 65 4.378 -2.876 13.090
506 HG3 PRO 65 1HG PRO 65 3.867 -2.971 11.390
507 HD2 PRO 65 2HD PRO 65 6.345 -2.026 12.175
508 HD3 PRO 65 1HD PRO 65 5.543 -1.541 10.665
509 H SER 66 H SER 66 3.681 1.930 14.569
510 HA SER 66 HA SER 66 4.663 0.829 17.020
511 HB2 SER 66 2HB SER 66 2.897 3.269 16.525
512 HB3 SER 66 1HB SER 66 3.744 2.914 18.032
513 HG SER 66 HG SER 66 5.716 2.994 16.768
514 H SER 67 H SER 67 1.672 0.645 15.354
515 HA SER 67 HA SER 67 0.061 -0.184 17.650
516 HB2 SER 67 2HB SER 67 -0.653 0.014 14.685
517 HB3 SER 67 1HB SER 67 -1.783 -0.197 16.027
518 HG SER 67 HG SER 67 -0.363 2.071 15.215
519 H ARG 68 H ARG 68 -0.281 -2.307 18.172
520 HA ARG 68 HA ARG 68 0.834 -4.499 16.676
521 HB2 ARG 68 2HB ARG 68 -1.032 -4.422 19.088
522 HB3 ARG 68 1HB ARG 68 -0.473 -5.924 18.355
523 HG2 ARG 68 2HG ARG 68 1.873 -5.293 18.860
524 HG3 ARG 68 1HG ARG 68 1.303 -3.805 19.624
525 HD2 ARG 68 2HD ARG 68 1.800 -5.522 21.314
526 HD3 ARG 68 1HD ARG 68 0.081 -5.130 21.305
527 HE ARG 68 HE ARG 68 1.025 -7.494 19.808
528 HH11 ARG 68 1HH1 ARG 68 -0.852 -6.247 22.518
529 HH12 ARG 68 2HH1 ARG 68 -1.632 -7.762 22.828
530 HH21 ARG 68 1HH2 ARG 68 0.028 -9.472 20.247
531 HH22 ARG 68 2HH2 ARG 68 -1.124 -9.599 21.531
532 H LEU 69 H LEU 69 -0.026 -4.881 14.738
533 HA LEU 69 HA LEU 69 -2.834 -4.457 14.078
534 HB2 LEU 69 2HB LEU 69 -0.560 -5.527 12.356
535 HB3 LEU 69 1HB LEU 69 -2.112 -4.929 11.779
536 HG LEU 69 HG LEU 69 0.056 -3.255 13.115
537 HD11 LEU 69 1HD1 LEU 69 0.333 -2.207 10.933
538 HD12 LEU 69 2HD1 LEU 69 -0.867 -3.300 10.236
539 HD13 LEU 69 3HD1 LEU 69 0.658 -3.938 10.857
540 HD21 LEU 69 3HD2 LEU 69 -2.619 -2.363 11.982
541 HD22 LEU 69 1HD2 LEU 69 -1.327 -1.294 12.548
542 HD23 LEU 69 2HD2 LEU 69 -2.145 -2.362 13.684
543 H THR 70 H THR 70 -3.513 -6.371 12.291
544 HA THR 70 HA THR 70 -4.088 -8.738 13.739
545 HB THR 70 HB THR 70 -4.724 -9.620 11.377
546 HG1 THR 70 HG1 THR 70 -3.326 -8.195 10.212
547 HG21 THR 70 3HG2 THR 70 -5.964 -7.003 12.309
548 HG22 THR 70 1HG2 THR 70 -6.397 -8.610 12.894
549 HG23 THR 70 2HG2 THR 70 -6.714 -8.168 11.215
550 H TRP 71 H TRP 71 -2.419 -9.904 14.495
551 HA TRP 71 HA TRP 71 0.130 -10.030 13.210
552 HB2 TRP 71 2HB TRP 71 -0.142 -9.979 15.696
553 HB3 TRP 71 1HB TRP 71 -0.859 -11.585 15.636
554 HD1 TRP 71 HD1 TRP 71 0.854 -13.490 16.147
555 HE1 TRP 71 HE1 TRP 71 3.404 -13.769 15.953
556 HE3 TRP 71 HE3 TRP 71 2.033 -8.942 14.118
557 HZ2 TRP 71 HZ2 TRP 71 5.621 -12.269 15.067
558 HZ3 TRP 71 HZ3 TRP 71 4.390 -8.434 13.636
559 HH2 TRP 71 HH2 TRP 71 6.153 -10.064 14.103
560 H ARG 72 H ARG 72 0.575 -11.283 11.607
561 HA ARG 72 HA ARG 72 0.664 -12.873 10.054
562 HB2 ARG 72 2HB ARG 72 0.141 -14.794 12.350
563 HB3 ARG 72 1HB ARG 72 0.845 -15.209 10.788
564 HG2 ARG 72 2HG ARG 72 2.789 -13.709 11.319
565 HG3 ARG 72 1HG ARG 72 2.089 -13.419 12.914
566 HD2 ARG 72 2HD ARG 72 2.179 -15.946 13.259
567 HD3 ARG 72 1HD ARG 72 3.151 -16.027 11.793
568 HE ARG 72 HE ARG 72 4.521 -14.238 13.269
569 HH11 ARG 72 1HH1 ARG 72 3.254 -17.429 14.063
570 HH12 ARG 72 2HH1 ARG 72 4.492 -17.773 15.232
571 HH21 ARG 72 1HH2 ARG 72 6.121 -14.666 14.813
572 HH22 ARG 72 2HH2 ARG 72 6.147 -16.178 15.663
573 H VAL 73 H VAL 73 -1.319 -11.911 9.218
574 HA VAL 73 HA VAL 73 -3.809 -13.277 9.216
575 HB VAL 73 HB VAL 73 -2.506 -11.709 6.929
576 HG11 VAL 73 1HG1 VAL 73 -4.816 -11.303 6.136
577 HG12 VAL 73 2HG1 VAL 73 -5.443 -12.325 7.431
578 HG13 VAL 73 3HG1 VAL 73 -4.440 -13.028 6.161
579 HG21 VAL 73 3HG2 VAL 73 -3.750 -9.739 7.763
580 HG22 VAL 73 1HG2 VAL 73 -2.593 -10.328 8.961
581 HG23 VAL 73 2HG2 VAL 73 -4.314 -10.677 9.147
582 H GLN 74 H GLN 74 -0.860 -13.538 7.328
583 HA GLN 74 HA GLN 74 -1.644 -16.107 6.137
584 HB2 GLN 74 2HB GLN 74 0.520 -15.759 4.796
585 HB3 GLN 74 1HB GLN 74 -0.793 -14.638 4.467
586 HG2 GLN 74 2HG GLN 74 0.330 -12.968 5.994
587 HG3 GLN 74 1HG GLN 74 1.690 -14.078 6.133
588 HE21 GLN 74 1HE2 GLN 74 1.563 -11.329 5.061
589 HE22 GLN 74 2HE2 GLN 74 2.187 -11.431 3.455
590 H ARG 75 H ARG 75 -1.108 -17.859 7.285
591 HA ARG 75 HA ARG 75 1.375 -17.946 8.923
592 HB2 ARG 75 2HB ARG 75 -1.089 -19.754 9.005
593 HB3 ARG 75 1HB ARG 75 0.356 -20.005 9.970
594 HG2 ARG 75 2HG ARG 75 -1.212 -19.049 11.439
595 HG3 ARG 75 1HG ARG 75 -0.123 -17.724 11.030
596 HD2 ARG 75 2HD ARG 75 -2.452 -16.976 11.047
597 HD3 ARG 75 1HD ARG 75 -1.782 -16.861 9.419
598 HE ARG 75 HE ARG 75 -2.957 -19.227 9.240
599 HH11 ARG 75 1HH1 ARG 75 -4.231 -16.297 10.723
600 HH12 ARG 75 2HH1 ARG 75 -5.881 -16.705 10.394
601 HH21 ARG 75 1HH2 ARG 75 -5.128 -19.751 8.827
602 HH22 ARG 75 2HH2 ARG 75 -6.394 -18.669 9.315
603 H SER 76 H SER 76 2.042 -20.540 8.951
604 HA SER 76 HA SER 76 3.065 -21.189 6.375
605 HB2 SER 76 2HB SER 76 4.106 -21.861 8.576
606 HB3 SER 76 1HB SER 76 2.790 -23.010 8.810
607 HG SER 76 HG SER 76 4.462 -24.114 7.922
608 H GLN 77 H GLN 77 2.671 -23.674 5.590
609 HA GLN 77 HA GLN 77 1.344 -25.064 4.369
610 HB2 GLN 77 2HB GLN 77 0.447 -25.480 6.795
611 HB3 GLN 77 1HB GLN 77 -0.930 -24.508 6.326
612 HG2 GLN 77 2HG GLN 77 -0.085 -27.155 5.108
613 HG3 GLN 77 1HG GLN 77 -1.420 -26.905 6.215
614 HE21 GLN 77 1HE2 GLN 77 -3.260 -25.667 5.419
615 HE22 GLN 77 2HE2 GLN 77 -3.628 -25.701 3.734
616 H ASN 78 H ASN 78 1.335 -23.715 2.574
617 HA ASN 78 HA ASN 78 0.706 -21.179 2.179
618 HB2 ASN 78 2HB ASN 78 1.820 -22.526 0.471
619 HB3 ASN 78 1HB ASN 78 0.320 -23.384 0.117
620 HD21 ASN 78 1HD2 ASN 78 1.971 -20.287 -0.184
621 HD22 ASN 78 2HD2 ASN 78 0.966 -19.681 -1.454
622 HA PRO 79 HA PRO 79 -3.903 -21.260 2.506
623 HB2 PRO 79 2HB PRO 79 -4.255 -19.230 4.209
624 HB3 PRO 79 1HB PRO 79 -3.505 -20.736 4.787
625 HG2 PRO 79 2HG PRO 79 -2.163 -18.138 4.057
626 HG3 PRO 79 1HG PRO 79 -1.851 -19.213 5.440
627 HD2 PRO 79 2HD PRO 79 -0.395 -19.226 3.035
628 HD3 PRO 79 1HD PRO 79 -0.424 -20.556 4.215
629 H LEU 80 H LEU 80 -1.709 -18.861 1.340
630 HA LEU 80 HA LEU 80 -3.766 -17.290 -0.054
631 HB2 LEU 80 2HB LEU 80 -1.663 -16.159 1.853
632 HB3 LEU 80 1HB LEU 80 -2.640 -15.171 0.779
633 HG LEU 80 HG LEU 80 -3.790 -16.894 3.019
634 HD11 LEU 80 1HD1 LEU 80 -2.477 -15.153 4.033
635 HD12 LEU 80 2HD1 LEU 80 -4.189 -14.819 4.262
636 HD13 LEU 80 3HD1 LEU 80 -3.268 -13.923 3.051
637 HD21 LEU 80 3HD2 LEU 80 -5.380 -16.485 1.194
638 HD22 LEU 80 1HD2 LEU 80 -5.094 -14.746 1.317
639 HD23 LEU 80 2HD2 LEU 80 -5.862 -15.617 2.649
640 H LYS 81 H LYS 81 -2.954 -16.337 -1.964
641 HA LYS 81 HA LYS 81 -0.422 -17.461 -2.941
642 HB2 LYS 81 2HB LYS 81 -1.230 -16.698 -5.203
643 HB3 LYS 81 1HB LYS 81 -2.282 -17.858 -4.412
644 HG2 LYS 81 2HG LYS 81 -3.815 -16.018 -3.765
645 HG3 LYS 81 1HG LYS 81 -2.769 -14.866 -4.592
646 HD2 LYS 81 2HD LYS 81 -4.671 -15.378 -6.009
647 HD3 LYS 81 1HD LYS 81 -3.219 -16.044 -6.748
648 HE2 LYS 81 2HE LYS 81 -5.092 -17.741 -5.057
649 HE3 LYS 81 1HE LYS 81 -5.342 -17.503 -6.784
650 HZ1 LYS 81 3HZ LYS 81 -4.169 -19.531 -6.447
651 HZ2 LYS 81 1HZ LYS 81 -2.990 -18.784 -5.501
652 HZ3 LYS 81 2HZ LYS 81 -3.100 -18.430 -7.147
653 H ILE 82 H ILE 82 1.357 -16.300 -2.845
654 HA ILE 82 HA ILE 82 1.272 -13.350 -2.685
655 HB ILE 82 HB ILE 82 3.566 -13.482 -1.748
656 HG12 ILE 82 2HG1 ILE 82 3.235 -16.526 -1.836
657 HG13 ILE 82 1HG1 ILE 82 4.309 -15.601 -2.873
658 HG21 ILE 82 1HG2 ILE 82 1.572 -15.242 -0.271
659 HG22 ILE 82 2HG2 ILE 82 1.656 -13.479 -0.200
660 HG23 ILE 82 3HG2 ILE 82 2.974 -14.451 0.457
661 HD11 ILE 82 3HD1 ILE 82 5.544 -16.672 -1.108
662 HD12 ILE 82 1HD1 ILE 82 4.546 -15.896 0.122
663 HD13 ILE 82 2HD1 ILE 82 5.608 -14.923 -0.901
664 H ARG 83 H ARG 83 2.094 -12.140 -4.279
665 HA ARG 83 HA ARG 83 4.231 -12.872 -5.999
666 HB2 ARG 83 2HB ARG 83 2.463 -14.284 -7.056
667 HB3 ARG 83 1HB ARG 83 1.447 -12.866 -7.271
668 HG2 ARG 83 2HG ARG 83 3.066 -11.918 -8.862
669 HG3 ARG 83 1HG ARG 83 4.145 -13.291 -8.603
670 HD2 ARG 83 2HD ARG 83 2.497 -14.815 -9.586
671 HD3 ARG 83 1HD ARG 83 1.334 -13.492 -9.747
672 HE ARG 83 HE ARG 83 3.719 -12.840 -11.121
673 HH11 ARG 83 1HH1 ARG 83 0.959 -15.002 -11.444
674 HH12 ARG 83 2HH1 ARG 83 1.049 -15.061 -13.176
675 HH21 ARG 83 1HH2 ARG 83 3.816 -12.890 -13.384
676 HH22 ARG 83 2HH2 ARG 83 2.684 -13.850 -14.282
677 H LEU 84 H LEU 84 5.176 -10.920 -5.803
678 HA LEU 84 HA LEU 84 3.756 -8.407 -6.126
679 HB2 LEU 84 2HB LEU 84 6.720 -9.058 -5.854
680 HB3 LEU 84 1HB LEU 84 6.104 -7.424 -6.042
681 HG LEU 84 HG LEU 84 5.492 -9.266 -3.690
682 HD11 LEU 84 1HD1 LEU 84 7.825 -8.489 -3.683
683 HD12 LEU 84 2HD1 LEU 84 6.902 -7.763 -2.369
684 HD13 LEU 84 3HD1 LEU 84 7.278 -6.814 -3.812
685 HD21 LEU 84 3HD2 LEU 84 4.719 -6.363 -4.141
686 HD22 LEU 84 1HD2 LEU 84 4.451 -7.286 -2.658
687 HD23 LEU 84 2HD2 LEU 84 3.623 -7.747 -4.142
688 H THR 85 H THR 85 2.889 -8.441 -8.155
689 HA THR 85 HA THR 85 4.379 -9.069 -10.542
690 HB THR 85 HB THR 85 2.264 -8.170 -11.693
691 HG1 THR 85 HG1 THR 85 1.742 -6.854 -9.724
692 HG21 THR 85 3HG2 THR 85 2.484 -10.582 -11.253
693 HG22 THR 85 1HG2 THR 85 0.816 -10.063 -11.000
694 HG23 THR 85 2HG2 THR 85 1.870 -10.356 -9.613
695 H ARG 86 H ARG 86 6.145 -7.524 -9.970
696 HA ARG 86 HA ARG 86 5.679 -4.683 -10.480
697 HB2 ARG 86 2HB ARG 86 7.349 -5.374 -8.763
698 HB3 ARG 86 1HB ARG 86 8.277 -6.216 -10.000
699 HG2 ARG 86 2HG ARG 86 8.662 -4.026 -11.152
700 HG3 ARG 86 1HG ARG 86 7.800 -3.217 -9.841
701 HD2 ARG 86 2HD ARG 86 10.165 -2.992 -9.448
702 HD3 ARG 86 1HD ARG 86 9.510 -4.099 -8.242
703 HE ARG 86 HE ARG 86 10.376 -5.813 -10.121
704 HH11 ARG 86 1HH1 ARG 86 12.018 -3.078 -8.606
705 HH12 ARG 86 2HH1 ARG 86 13.597 -3.775 -8.782
706 HH21 ARG 86 1HH2 ARG 86 12.441 -6.701 -10.369
707 HH22 ARG 86 2HH2 ARG 86 13.841 -5.848 -9.792
708 H GLU 87 H GLU 87 5.111 -4.416 -12.564
709 HA GLU 87 HA GLU 87 6.463 -5.818 -14.758
710 HB2 GLU 87 2HB GLU 87 4.023 -3.990 -14.764
711 HB3 GLU 87 1HB GLU 87 4.626 -4.899 -16.153
712 HG2 GLU 87 2HG GLU 87 4.144 -7.026 -14.978
713 HG3 GLU 87 1HG GLU 87 3.577 -6.127 -13.573
714 H ALA 88 H ALA 88 7.445 -4.730 -16.469
715 HA ALA 88 HA ALA 88 8.984 -2.435 -15.842
716 HB1 ALA 88 3HB ALA 88 9.778 -4.193 -17.373
717 HB2 ALA 88 1HB ALA 88 9.801 -2.622 -18.174
718 HB3 ALA 88 2HB ALA 88 8.516 -3.781 -18.536
719 HA PRO 89 HA PRO 89 5.717 0.629 -16.710
720 HB2 PRO 89 2HB PRO 89 8.058 2.524 -16.694
721 HB3 PRO 89 1HB PRO 89 6.538 2.610 -15.780
722 HG2 PRO 89 2HG PRO 89 8.787 1.915 -14.556
723 HG3 PRO 89 1HG PRO 89 7.266 1.075 -14.171
724 HD2 PRO 89 2HD PRO 89 9.548 0.133 -15.908
725 HD3 PRO 89 1HD PRO 89 8.580 -0.778 -14.723
Start of MODEL 11
1 H1 HIS 1 1H HIS 1 -13.628 -17.897 11.693
2 H2 HIS 1 2H HIS 1 -12.529 -16.645 11.413
3 H3 HIS 1 3H HIS 1 -12.131 -17.894 12.475
4 HA HIS 1 HA HIS 1 -12.089 -19.475 10.730
5 HB2 HIS 1 2HB HIS 1 -12.364 -18.715 8.339
6 HB3 HIS 1 1HB HIS 1 -13.838 -18.605 9.283
7 HD1 HIS 1 HD1 HIS 1 -14.974 -16.338 9.412
8 HD2 HIS 1 HD2 HIS 1 -11.188 -16.146 7.704
9 HE1 HIS 1 HE1 HIS 1 -14.776 -14.034 8.438
10 HE2 HIS 1 HE2 HIS 1 -12.492 -13.949 7.400
11 H HIS 2 H HIS 2 -10.042 -19.982 10.155
12 HA HIS 2 HA HIS 2 -7.987 -17.862 9.974
13 HB2 HIS 2 2HB HIS 2 -7.907 -18.795 12.270
14 HB3 HIS 2 1HB HIS 2 -7.820 -20.433 11.633
15 HD1 HIS 2 HD1 HIS 2 -5.774 -17.247 11.829
16 HD2 HIS 2 HD2 HIS 2 -5.230 -21.296 11.051
17 HE1 HIS 2 HE1 HIS 2 -3.294 -17.585 11.698
18 HE2 HIS 2 HE2 HIS 2 -2.992 -20.064 11.397
19 H HIS 3 H HIS 3 -6.473 -18.195 8.450
20 HA HIS 3 HA HIS 3 -6.209 -20.813 7.117
21 HB2 HIS 3 2HB HIS 3 -6.560 -18.140 5.681
22 HB3 HIS 3 1HB HIS 3 -6.078 -19.644 4.894
23 HD1 HIS 3 HD1 HIS 3 -8.995 -17.689 5.445
24 HD2 HIS 3 HD2 HIS 3 -8.192 -21.758 5.465
25 HE1 HIS 3 HE1 HIS 3 -11.221 -18.820 5.235
26 HE2 HIS 3 HE2 HIS 3 -10.716 -21.276 5.431
27 H HIS 4 H HIS 4 -4.192 -21.104 6.027
28 HA HIS 4 HA HIS 4 -1.853 -19.865 7.109
29 HB2 HIS 4 2HB HIS 4 -2.101 -21.481 4.517
30 HB3 HIS 4 1HB HIS 4 -0.610 -21.155 5.392
31 HD1 HIS 4 HD1 HIS 4 -3.061 -23.697 4.918
32 HD2 HIS 4 HD2 HIS 4 -0.707 -22.438 8.100
33 HE1 HIS 4 HE1 HIS 4 -2.969 -25.643 6.499
34 HE2 HIS 4 HE2 HIS 4 -1.621 -24.823 8.461
35 H HIS 5 H HIS 5 -0.245 -18.672 5.739
36 HA HIS 5 HA HIS 5 -1.388 -17.201 3.451
37 HB2 HIS 5 2HB HIS 5 0.115 -15.928 5.785
38 HB3 HIS 5 1HB HIS 5 -0.175 -15.104 4.252
39 HD1 HIS 5 HD1 HIS 5 -1.688 -15.642 7.515
40 HD2 HIS 5 HD2 HIS 5 -3.097 -14.837 3.700
41 HE1 HIS 5 HE1 HIS 5 -4.052 -14.867 7.819
42 HE2 HIS 5 HE2 HIS 5 -4.786 -14.179 5.522
43 H HIS 6 H HIS 6 1.683 -17.616 5.259
44 HA HIS 6 HA HIS 6 3.843 -17.881 4.608
45 HB2 HIS 6 2HB HIS 6 2.914 -20.063 3.798
46 HB3 HIS 6 1HB HIS 6 2.610 -19.347 2.223
47 HD1 HIS 6 HD1 HIS 6 4.407 -19.655 0.546
48 HD2 HIS 6 HD2 HIS 6 5.816 -20.181 4.420
49 HE1 HIS 6 HE1 HIS 6 6.785 -20.422 0.303
50 HE2 HIS 6 HE2 HIS 6 7.645 -20.595 2.656
51 H SER 7 H SER 7 2.547 -15.500 3.987
52 HA SER 7 HA SER 7 3.365 -14.621 1.297
53 HB2 SER 7 2HB SER 7 0.975 -14.367 2.087
54 HB3 SER 7 1HB SER 7 1.541 -13.281 3.354
55 HG SER 7 HG SER 7 1.332 -12.876 0.588
56 H HIS 8 H HIS 8 3.918 -12.099 1.425
57 HA HIS 8 HA HIS 8 6.391 -11.826 2.799
58 HB2 HIS 8 2HB HIS 8 5.724 -10.669 0.617
59 HB3 HIS 8 1HB HIS 8 4.758 -9.553 1.575
60 HD1 HIS 8 HD1 HIS 8 5.994 -7.415 2.033
61 HD2 HIS 8 HD2 HIS 8 8.580 -10.650 1.641
62 HE1 HIS 8 HE1 HIS 8 8.312 -6.480 2.295
63 HE2 HIS 8 HE2 HIS 8 9.853 -8.442 1.997
64 H MET 9 H MET 9 6.883 -10.074 4.375
65 HA MET 9 HA MET 9 5.753 -10.618 6.798
66 HB2 MET 9 2HB MET 9 7.048 -8.707 7.689
67 HB3 MET 9 1HB MET 9 7.993 -9.633 6.539
68 HG2 MET 9 2HG MET 9 7.633 -7.919 4.823
69 HG3 MET 9 1HG MET 9 6.610 -7.005 5.933
70 HE1 MET 9 3HE MET 9 9.698 -4.664 5.852
71 HE2 MET 9 1HE MET 9 7.941 -4.774 5.748
72 HE3 MET 9 2HE MET 9 8.948 -5.514 4.500
73 H VAL 10 H VAL 10 4.039 -9.947 7.977
74 HA VAL 10 HA VAL 10 2.151 -7.999 7.023
75 HB VAL 10 HB VAL 10 0.847 -8.434 9.018
76 HG11 VAL 10 1HG1 VAL 10 0.762 -10.147 7.278
77 HG12 VAL 10 2HG1 VAL 10 0.533 -10.866 8.870
78 HG13 VAL 10 3HG1 VAL 10 2.085 -11.028 8.047
79 HG21 VAL 10 3HG2 VAL 10 3.224 -9.938 10.193
80 HG22 VAL 10 1HG2 VAL 10 1.604 -9.875 10.897
81 HG23 VAL 10 2HG2 VAL 10 2.569 -8.403 10.771
82 H GLY 11 H GLY 11 1.879 -5.879 7.733
83 HA2 GLY 11 2HA GLY 11 2.452 -3.918 8.885
84 HA3 GLY 11 1HA GLY 11 3.775 -4.759 9.673
85 H ASP 12 H ASP 12 3.633 -5.355 6.295
86 HA ASP 12 HA ASP 12 6.157 -4.239 5.701
87 HB2 ASP 12 2HB ASP 12 5.051 -6.045 4.351
88 HB3 ASP 12 1HB ASP 12 3.855 -4.888 3.792
89 H THR 13 H THR 13 6.488 -2.061 6.059
90 HA THR 13 HA THR 13 4.322 -0.194 6.009
91 HB THR 13 HB THR 13 7.299 0.342 6.341
92 HG1 THR 13 HG1 THR 13 5.564 -0.954 7.925
93 HG21 THR 13 3HG2 THR 13 6.525 2.417 7.518
94 HG22 THR 13 1HG2 THR 13 4.862 2.040 7.062
95 HG23 THR 13 2HG2 THR 13 6.058 2.414 5.816
96 H VAL 14 H VAL 14 3.635 0.810 4.319
97 HA VAL 14 HA VAL 14 5.269 1.442 1.966
98 HB VAL 14 HB VAL 14 3.364 0.739 0.506
99 HG11 VAL 14 1HG1 VAL 14 5.216 -0.826 0.812
100 HG12 VAL 14 2HG1 VAL 14 3.696 -1.700 0.627
101 HG13 VAL 14 3HG1 VAL 14 4.426 -1.526 2.226
102 HG21 VAL 14 3HG2 VAL 14 1.528 -0.659 1.406
103 HG22 VAL 14 1HG2 VAL 14 1.527 0.950 2.133
104 HG23 VAL 14 2HG2 VAL 14 2.148 -0.430 3.044
105 H TRP 15 H TRP 15 4.057 2.945 0.542
106 HA TRP 15 HA TRP 15 2.159 4.741 1.904
107 HB2 TRP 15 2HB TRP 15 4.246 5.375 -0.238
108 HB3 TRP 15 1HB TRP 15 3.019 6.514 0.315
109 HD1 TRP 15 HD1 TRP 15 3.601 5.422 3.510
110 HE1 TRP 15 HE1 TRP 15 5.576 6.541 4.703
111 HE3 TRP 15 HE3 TRP 15 6.097 7.269 -0.556
112 HZ2 TRP 15 HZ2 TRP 15 7.860 8.022 4.041
113 HZ3 TRP 15 HZ3 TRP 15 8.168 8.544 -0.181
114 HH2 TRP 15 HH2 TRP 15 9.033 8.912 2.075
115 H VAL 16 H VAL 16 0.322 5.226 0.784
116 HA VAL 16 HA VAL 16 -0.236 3.747 -1.717
117 HB VAL 16 HB VAL 16 -2.205 4.797 0.387
118 HG11 VAL 16 1HG1 VAL 16 -3.190 4.923 -1.881
119 HG12 VAL 16 2HG1 VAL 16 -3.970 3.658 -0.930
120 HG13 VAL 16 3HG1 VAL 16 -2.780 3.226 -2.160
121 HG21 VAL 16 3HG2 VAL 16 -0.955 2.797 1.130
122 HG22 VAL 16 1HG2 VAL 16 -1.437 1.943 -0.338
123 HG23 VAL 16 2HG2 VAL 16 -2.655 2.409 0.852
124 H ARG 17 H ARG 17 -0.013 4.977 -3.384
125 HA ARG 17 HA ARG 17 0.039 7.883 -3.223
126 HB2 ARG 17 2HB ARG 17 1.925 6.489 -4.166
127 HB3 ARG 17 1HB ARG 17 0.861 6.006 -5.482
128 HG2 ARG 17 2HG ARG 17 0.717 8.368 -6.200
129 HG3 ARG 17 1HG ARG 17 1.808 8.823 -4.890
130 HD2 ARG 17 2HD ARG 17 3.584 7.425 -5.864
131 HD3 ARG 17 1HD ARG 17 2.491 6.907 -7.150
132 HE ARG 17 HE ARG 17 3.075 9.772 -6.869
133 HH11 ARG 17 1HH1 ARG 17 3.538 6.784 -8.699
134 HH12 ARG 17 2HH1 ARG 17 4.148 7.600 -10.101
135 HH21 ARG 17 1HH2 ARG 17 3.897 10.817 -8.734
136 HH22 ARG 17 2HH2 ARG 17 4.354 9.882 -10.121
137 H ARG 18 H ARG 18 -1.937 8.735 -3.405
138 HA ARG 18 HA ARG 18 -3.992 7.585 -5.173
139 HB2 ARG 18 2HB ARG 18 -4.610 7.799 -2.821
140 HB3 ARG 18 1HB ARG 18 -4.114 9.486 -2.793
141 HG2 ARG 18 2HG ARG 18 -5.962 10.056 -4.328
142 HG3 ARG 18 1HG ARG 18 -6.462 8.364 -4.360
143 HD2 ARG 18 2HD ARG 18 -7.032 8.437 -1.996
144 HD3 ARG 18 1HD ARG 18 -6.361 10.063 -1.844
145 HE ARG 18 HE ARG 18 -8.273 10.378 -3.742
146 HH11 ARG 18 1HH1 ARG 18 -8.401 8.975 -0.504
147 HH12 ARG 18 2HH1 ARG 18 -10.059 9.421 -0.255
148 HH21 ARG 18 1HH2 ARG 18 -10.436 10.993 -3.355
149 HH22 ARG 18 2HH2 ARG 18 -11.202 10.560 -1.858
150 H HIS 19 H HIS 19 -4.984 8.766 -6.783
151 HA HIS 19 HA HIS 19 -4.747 11.662 -6.929
152 HB2 HIS 19 2HB HIS 19 -4.013 11.707 -9.310
153 HB3 HIS 19 1HB HIS 19 -2.788 11.062 -8.242
154 HD1 HIS 19 HD1 HIS 19 -3.856 10.536 -11.460
155 HD2 HIS 19 HD2 HIS 19 -3.196 7.921 -8.307
156 HE1 HIS 19 HE1 HIS 19 -3.509 8.292 -12.517
157 HE2 HIS 19 HE2 HIS 19 -3.143 6.725 -10.585
158 H GLN 20 H GLN 20 -6.507 12.609 -7.833
159 HA GLN 20 HA GLN 20 -8.874 11.045 -8.197
160 HB2 GLN 20 2HB GLN 20 -8.364 14.017 -8.692
161 HB3 GLN 20 1HB GLN 20 -9.957 13.260 -8.716
162 HG2 GLN 20 2HG GLN 20 -8.102 13.409 -6.318
163 HG3 GLN 20 1HG GLN 20 -9.523 14.413 -6.586
164 HE21 GLN 20 1HE2 GLN 20 -11.250 12.265 -7.557
165 HE22 GLN 20 2HE2 GLN 20 -11.606 11.274 -6.187
166 H THR 21 H THR 21 -6.938 13.044 -10.412
167 HA THR 21 HA THR 21 -7.751 11.320 -12.695
168 HB THR 21 HB THR 21 -7.405 13.333 -14.182
169 HG1 THR 21 HG1 THR 21 -7.695 15.393 -12.729
170 HG21 THR 21 3HG2 THR 21 -9.715 12.717 -13.499
171 HG22 THR 21 1HG2 THR 21 -9.535 14.460 -13.705
172 HG23 THR 21 2HG2 THR 21 -9.566 13.765 -12.083
173 H LYS 22 H LYS 22 -6.071 11.264 -14.407
174 HA LYS 22 HA LYS 22 -3.411 10.924 -13.386
175 HB2 LYS 22 2HB LYS 22 -4.302 10.991 -16.301
176 HB3 LYS 22 1HB LYS 22 -2.768 10.373 -15.686
177 HG2 LYS 22 2HG LYS 22 -4.020 8.594 -14.453
178 HG3 LYS 22 1HG LYS 22 -5.517 9.180 -15.185
179 HD2 LYS 22 2HD LYS 22 -3.111 8.033 -16.666
180 HD3 LYS 22 1HD LYS 22 -4.668 7.237 -16.434
181 HE2 LYS 22 2HE LYS 22 -5.781 8.882 -17.847
182 HE3 LYS 22 1HE LYS 22 -4.302 9.839 -17.972
183 HZ1 LYS 22 3HZ LYS 22 -3.259 7.978 -19.134
184 HZ2 LYS 22 1HZ LYS 22 -4.635 8.521 -19.952
185 HZ3 LYS 22 2HZ LYS 22 -4.696 7.096 -19.047
186 H ASN 23 H ASN 23 -5.133 13.521 -14.976
187 HA ASN 23 HA ASN 23 -2.956 15.177 -15.706
188 HB2 ASN 23 2HB ASN 23 -5.850 15.847 -14.993
189 HB3 ASN 23 1HB ASN 23 -4.693 17.067 -15.527
190 HD21 ASN 23 1HD2 ASN 23 -5.915 17.538 -17.373
191 HD22 ASN 23 2HD2 ASN 23 -5.996 16.467 -18.728
192 H LEU 24 H LEU 24 -4.729 14.812 -12.645
193 HA LEU 24 HA LEU 24 -3.058 16.713 -11.231
194 HB2 LEU 24 2HB LEU 24 -5.027 14.627 -10.215
195 HB3 LEU 24 1HB LEU 24 -4.171 15.759 -9.176
196 HG LEU 24 HG LEU 24 -6.259 16.451 -11.283
197 HD11 LEU 24 1HD1 LEU 24 -7.212 15.544 -9.234
198 HD12 LEU 24 2HD1 LEU 24 -7.577 17.260 -9.378
199 HD13 LEU 24 3HD1 LEU 24 -6.318 16.719 -8.263
200 HD21 LEU 24 3HD2 LEU 24 -4.617 18.332 -9.557
201 HD22 LEU 24 1HD2 LEU 24 -6.005 18.795 -10.546
202 HD23 LEU 24 2HD2 LEU 24 -4.549 18.175 -11.316
203 H GLU 25 H GLU 25 -1.177 16.316 -10.258
204 HA GLU 25 HA GLU 25 0.275 13.920 -10.706
205 HB2 GLU 25 2HB GLU 25 0.947 16.204 -8.796
206 HB3 GLU 25 1HB GLU 25 2.077 15.008 -9.430
207 HG2 GLU 25 2HG GLU 25 1.725 15.892 -11.721
208 HG3 GLU 25 1HG GLU 25 0.598 17.089 -11.080
209 HA PRO 26 HA PRO 26 -1.424 11.602 -7.317
210 HB2 PRO 26 2HB PRO 26 0.799 9.661 -7.527
211 HB3 PRO 26 1HB PRO 26 -0.899 9.466 -7.998
212 HG2 PRO 26 2HG PRO 26 1.089 9.603 -9.819
213 HG3 PRO 26 1HG PRO 26 -0.547 10.220 -10.137
214 HD2 PRO 26 2HD PRO 26 1.917 11.767 -9.336
215 HD3 PRO 26 1HD PRO 26 0.711 12.138 -10.593
216 H ARG 27 H ARG 27 -1.329 12.059 -5.230
217 HA ARG 27 HA ARG 27 1.249 12.614 -3.899
218 HB2 ARG 27 2HB ARG 27 -0.508 14.380 -3.738
219 HB3 ARG 27 1HB ARG 27 -1.605 13.221 -2.996
220 HG2 ARG 27 2HG ARG 27 -0.053 13.003 -1.068
221 HG3 ARG 27 1HG ARG 27 1.017 14.192 -1.810
222 HD2 ARG 27 2HD ARG 27 -0.755 15.909 -1.618
223 HD3 ARG 27 1HD ARG 27 -1.838 14.708 -0.895
224 HE ARG 27 HE ARG 27 0.504 14.750 0.615
225 HH11 ARG 27 1HH1 ARG 27 -2.170 16.950 -0.071
226 HH12 ARG 27 2HH1 ARG 27 -2.036 17.773 1.450
227 HH21 ARG 27 1HH2 ARG 27 0.644 15.823 2.610
228 HH22 ARG 27 2HH2 ARG 27 -0.438 17.129 2.971
229 H TRP 28 H TRP 28 2.073 11.107 -2.594
230 HA TRP 28 HA TRP 28 0.751 8.657 -1.934
231 HB2 TRP 28 2HB TRP 28 2.816 8.128 -0.666
232 HB3 TRP 28 1HB TRP 28 3.196 8.735 -2.270
233 HD1 TRP 28 HD1 TRP 28 4.435 11.128 -2.418
234 HE1 TRP 28 HE1 TRP 28 5.771 12.485 -0.700
235 HE3 TRP 28 HE3 TRP 28 2.896 8.787 1.870
236 HZ2 TRP 28 HZ2 TRP 28 6.135 12.565 2.085
237 HZ3 TRP 28 HZ3 TRP 28 3.781 9.571 4.026
238 HH2 TRP 28 HH2 TRP 28 5.373 11.429 4.132
239 H LYS 29 H LYS 29 0.240 7.865 0.170
240 HA LYS 29 HA LYS 29 0.255 9.786 2.436
241 HB2 LYS 29 2HB LYS 29 -1.968 7.777 1.841
242 HB3 LYS 29 1HB LYS 29 -1.859 8.787 3.281
243 HG2 LYS 29 2HG LYS 29 -2.103 10.812 1.829
244 HG3 LYS 29 1HG LYS 29 -2.316 9.746 0.434
245 HD2 LYS 29 2HD LYS 29 -4.102 9.795 2.901
246 HD3 LYS 29 1HD LYS 29 -4.493 10.540 1.350
247 HE2 LYS 29 2HE LYS 29 -4.652 8.407 0.262
248 HE3 LYS 29 1HE LYS 29 -3.933 7.570 1.642
249 HZ1 LYS 29 3HZ LYS 29 -5.870 8.136 2.960
250 HZ2 LYS 29 1HZ LYS 29 -6.329 7.272 1.583
251 HZ3 LYS 29 2HZ LYS 29 -6.567 8.944 1.651
252 H GLY 30 H GLY 30 0.658 8.792 4.475
253 HA2 GLY 30 2HA GLY 30 1.106 5.969 4.769
254 HA3 GLY 30 1HA GLY 30 2.601 6.854 4.573
255 HA PRO 31 HA PRO 31 3.122 5.130 5.920
256 HB2 PRO 31 2HB PRO 31 3.986 3.876 8.167
257 HB3 PRO 31 1HB PRO 31 4.675 5.427 7.645
258 HG2 PRO 31 2HG PRO 31 2.861 4.873 9.919
259 HG3 PRO 31 1HG PRO 31 4.007 6.207 9.691
260 HD2 PRO 31 2HD PRO 31 1.145 6.226 9.217
261 HD3 PRO 31 1HD PRO 31 2.292 7.569 9.020
262 H TYR 32 H TYR 32 1.540 3.893 4.916
263 HA TYR 32 HA TYR 32 -0.419 2.290 6.355
264 HB2 TYR 32 2HB TYR 32 0.408 2.440 3.425
265 HB3 TYR 32 1HB TYR 32 -0.756 1.259 4.003
266 HD1 TYR 32 HD2 TYR 32 -0.148 4.948 3.869
267 HD2 TYR 32 HD1 TYR 32 -3.050 1.829 4.124
268 HE1 TYR 32 HE2 TYR 32 -1.940 6.594 3.625
269 HE2 TYR 32 HE1 TYR 32 -4.851 3.482 3.871
270 HH TYR 32 HH TYR 32 -5.192 5.911 4.242
271 H THR 33 H THR 33 -0.420 -0.139 6.096
272 HA THR 33 HA THR 33 2.277 -1.334 5.968
273 HB THR 33 HB THR 33 1.859 -2.546 8.142
274 HG1 THR 33 HG1 THR 33 -0.326 -2.396 8.417
275 HG21 THR 33 3HG2 THR 33 2.349 -0.669 9.673
276 HG22 THR 33 1HG2 THR 33 1.899 0.473 8.402
277 HG23 THR 33 2HG2 THR 33 3.304 -0.573 8.192
278 H VAL 34 H VAL 34 2.043 -2.884 4.467
279 HA VAL 34 HA VAL 34 -0.397 -4.146 3.787
280 HB VAL 34 HB VAL 34 2.394 -5.128 3.038
281 HG11 VAL 34 1HG1 VAL 34 1.277 -6.097 1.056
282 HG12 VAL 34 2HG1 VAL 34 -0.282 -5.559 1.681
283 HG13 VAL 34 3HG1 VAL 34 0.648 -6.772 2.562
284 HG21 VAL 34 3HG2 VAL 34 2.190 -3.794 0.971
285 HG22 VAL 34 1HG2 VAL 34 2.181 -2.765 2.407
286 HG23 VAL 34 2HG2 VAL 34 0.672 -3.109 1.559
287 H LEU 35 H LEU 35 -1.356 -5.812 4.676
288 HA LEU 35 HA LEU 35 -0.079 -7.402 6.802
289 HB2 LEU 35 2HB LEU 35 -3.026 -7.175 6.062
290 HB3 LEU 35 1HB LEU 35 -2.358 -7.878 7.531
291 HG LEU 35 HG LEU 35 -2.302 -4.932 6.758
292 HD11 LEU 35 1HD1 LEU 35 -4.510 -5.677 7.476
293 HD12 LEU 35 2HD1 LEU 35 -3.798 -4.574 8.649
294 HD13 LEU 35 3HD1 LEU 35 -3.833 -6.309 8.978
295 HD21 LEU 35 3HD2 LEU 35 -1.318 -4.509 8.979
296 HD22 LEU 35 1HD2 LEU 35 -0.254 -5.463 7.946
297 HD23 LEU 35 2HD2 LEU 35 -1.162 -6.250 9.241
298 H LEU 36 H LEU 36 -1.306 -7.649 3.569
299 HA LEU 36 HA LEU 36 -0.332 -10.390 3.342
300 HB2 LEU 36 2HB LEU 36 -2.661 -10.803 3.953
301 HB3 LEU 36 1HB LEU 36 -3.228 -9.626 2.791
302 HG LEU 36 HG LEU 36 -2.392 -11.146 0.935
303 HD11 LEU 36 1HD1 LEU 36 -1.954 -13.506 1.461
304 HD12 LEU 36 2HD1 LEU 36 -1.967 -13.115 3.183
305 HD13 LEU 36 3HD1 LEU 36 -0.736 -12.420 2.129
306 HD21 LEU 36 3HD2 LEU 36 -4.266 -12.732 1.075
307 HD22 LEU 36 1HD2 LEU 36 -4.756 -11.094 1.512
308 HD23 LEU 36 2HD2 LEU 36 -4.505 -12.306 2.773
309 H THR 37 H THR 37 0.528 -10.726 1.346
310 HA THR 37 HA THR 37 0.100 -8.709 -0.787
311 HB THR 37 HB THR 37 2.361 -9.473 -1.683
312 HG1 THR 37 HG1 THR 37 2.544 -10.754 0.848
313 HG21 THR 37 3HG2 THR 37 3.752 -8.231 -0.069
314 HG22 THR 37 1HG2 THR 37 2.442 -8.300 1.111
315 HG23 THR 37 2HG2 THR 37 2.237 -7.385 -0.378
316 H THR 38 H THR 38 -0.801 -9.442 -2.654
317 HA THR 38 HA THR 38 -0.851 -12.324 -3.317
318 HB THR 38 HB THR 38 -3.294 -12.060 -4.053
319 HG1 THR 38 HG1 THR 38 -2.986 -9.584 -2.730
320 HG21 THR 38 3HG2 THR 38 -4.295 -12.292 -1.812
321 HG22 THR 38 1HG2 THR 38 -2.815 -11.645 -1.080
322 HG23 THR 38 2HG2 THR 38 -2.785 -13.196 -1.918
323 HA PRO 39 HA PRO 39 0.199 -11.368 -7.594
324 HB2 PRO 39 2HB PRO 39 -2.189 -12.156 -8.994
325 HB3 PRO 39 1HB PRO 39 -0.764 -13.159 -8.670
326 HG2 PRO 39 2HG PRO 39 -3.325 -12.982 -7.135
327 HG3 PRO 39 1HG PRO 39 -2.312 -14.405 -7.474
328 HD2 PRO 39 2HD PRO 39 -2.238 -13.336 -5.063
329 HD3 PRO 39 1HD PRO 39 -0.709 -13.819 -5.833
330 H THR 40 H THR 40 0.379 -9.217 -7.824
331 HA THR 40 HA THR 40 0.079 -7.074 -8.400
332 HB THR 40 HB THR 40 -1.373 -6.539 -10.306
333 HG1 THR 40 HG1 THR 40 -2.994 -8.352 -9.353
334 HG21 THR 40 3HG2 THR 40 0.727 -7.787 -10.784
335 HG22 THR 40 1HG2 THR 40 -0.538 -8.179 -11.949
336 HG23 THR 40 2HG2 THR 40 -0.154 -9.310 -10.651
337 H ALA 41 H ALA 41 -1.486 -8.081 -6.032
338 HA ALA 41 HA ALA 41 -3.172 -5.713 -5.591
339 HB1 ALA 41 3HB ALA 41 -5.144 -7.056 -4.910
340 HB2 ALA 41 1HB ALA 41 -4.318 -8.538 -5.404
341 HB3 ALA 41 2HB ALA 41 -4.756 -7.325 -6.608
342 H LEU 42 H LEU 42 -3.222 -5.197 -3.380
343 HA LEU 42 HA LEU 42 -1.775 -7.002 -1.526
344 HB2 LEU 42 2HB LEU 42 -1.448 -3.970 -1.674
345 HB3 LEU 42 1HB LEU 42 -0.621 -5.047 -0.560
346 HG LEU 42 HG LEU 42 -0.185 -4.845 -3.566
347 HD11 LEU 42 1HD1 LEU 42 0.848 -3.036 -2.312
348 HD12 LEU 42 2HD1 LEU 42 2.076 -4.113 -2.970
349 HD13 LEU 42 3HD1 LEU 42 1.663 -4.190 -1.253
350 HD21 LEU 42 3HD2 LEU 42 1.110 -6.778 -1.624
351 HD22 LEU 42 1HD2 LEU 42 1.610 -6.513 -3.297
352 HD23 LEU 42 2HD2 LEU 42 0.022 -7.184 -2.949
353 H LYS 43 H LYS 43 -2.955 -7.401 0.275
354 HA LYS 43 HA LYS 43 -5.135 -5.637 1.083
355 HB2 LYS 43 2HB LYS 43 -5.386 -8.113 1.346
356 HB3 LYS 43 1HB LYS 43 -4.036 -8.122 2.479
357 HG2 LYS 43 2HG LYS 43 -5.275 -6.757 4.064
358 HG3 LYS 43 1HG LYS 43 -6.589 -6.531 2.904
359 HD2 LYS 43 2HD LYS 43 -7.018 -9.009 3.010
360 HD3 LYS 43 1HD LYS 43 -5.793 -9.126 4.276
361 HE2 LYS 43 2HE LYS 43 -8.118 -9.024 5.174
362 HE3 LYS 43 1HE LYS 43 -7.105 -7.696 5.738
363 HZ1 LYS 43 3HZ LYS 43 -8.139 -6.229 4.164
364 HZ2 LYS 43 1HZ LYS 43 -9.338 -6.981 5.080
365 HZ3 LYS 43 2HZ LYS 43 -9.050 -7.489 3.496
366 H VAL 44 H VAL 44 -4.489 -3.817 1.958
367 HA VAL 44 HA VAL 44 -2.117 -3.682 3.718
368 HB VAL 44 HB VAL 44 -3.587 -1.371 2.362
369 HG11 VAL 44 1HG1 VAL 44 -2.222 -0.700 4.288
370 HG12 VAL 44 2HG1 VAL 44 -1.556 -0.067 2.782
371 HG13 VAL 44 3HG1 VAL 44 -0.806 -1.464 3.561
372 HG21 VAL 44 3HG2 VAL 44 -2.712 -2.849 0.592
373 HG22 VAL 44 1HG2 VAL 44 -1.105 -2.797 1.323
374 HG23 VAL 44 2HG2 VAL 44 -1.810 -1.332 0.636
375 H ASP 45 H ASP 45 -2.337 -2.302 5.641
376 HA ASP 45 HA ASP 45 -4.627 -2.828 7.224
377 HB2 ASP 45 2HB ASP 45 -2.246 -2.467 8.033
378 HB3 ASP 45 1HB ASP 45 -2.438 -0.754 7.692
379 H GLY 46 H GLY 46 -6.464 -1.665 7.468
380 HA2 GLY 46 2HA GLY 46 -7.936 0.129 7.466
381 HA3 GLY 46 1HA GLY 46 -6.709 1.153 6.739
382 H ILE 47 H ILE 47 -6.657 -1.531 4.886
383 HA ILE 47 HA ILE 47 -8.492 -0.439 2.858
384 HB ILE 47 HB ILE 47 -6.192 -2.436 2.718
385 HG12 ILE 47 2HG1 ILE 47 -5.416 -0.156 2.864
386 HG13 ILE 47 1HG1 ILE 47 -5.181 -0.683 1.205
387 HG21 ILE 47 1HG2 ILE 47 -7.982 -1.651 0.400
388 HG22 ILE 47 2HG2 ILE 47 -7.866 -3.249 1.139
389 HG23 ILE 47 3HG2 ILE 47 -6.484 -2.576 0.277
390 HD11 ILE 47 3HD1 ILE 47 -5.945 1.585 1.254
391 HD12 ILE 47 1HD1 ILE 47 -7.345 1.151 2.231
392 HD13 ILE 47 2HD1 ILE 47 -7.218 0.580 0.563
393 H ALA 48 H ALA 48 -10.210 -1.560 2.066
394 HA ALA 48 HA ALA 48 -11.618 -3.230 3.811
395 HB1 ALA 48 3HB ALA 48 -12.697 -1.741 2.165
396 HB2 ALA 48 1HB ALA 48 -13.299 -3.395 2.025
397 HB3 ALA 48 2HB ALA 48 -12.135 -2.774 0.850
398 H ALA 49 H ALA 49 -10.065 -4.093 0.670
399 HA ALA 49 HA ALA 49 -9.366 -6.710 1.763
400 HB1 ALA 49 3HB ALA 49 -11.590 -7.099 0.789
401 HB2 ALA 49 1HB ALA 49 -10.337 -7.991 -0.077
402 HB3 ALA 49 2HB ALA 49 -11.015 -6.516 -0.774
403 H TRP 50 H TRP 50 -9.287 -4.804 -1.336
404 HA TRP 50 HA TRP 50 -6.421 -5.501 -1.597
405 HB2 TRP 50 2HB TRP 50 -8.481 -6.079 -3.772
406 HB3 TRP 50 1HB TRP 50 -6.743 -6.120 -4.032
407 HD1 TRP 50 HD1 TRP 50 -5.386 -8.119 -2.582
408 HE1 TRP 50 HE1 TRP 50 -6.169 -10.510 -2.041
409 HE3 TRP 50 HE3 TRP 50 -10.431 -7.534 -3.297
410 HZ2 TRP 50 HZ2 TRP 50 -8.585 -11.962 -1.930
411 HZ3 TRP 50 HZ3 TRP 50 -11.903 -9.477 -2.957
412 HH2 TRP 50 HH2 TRP 50 -11.000 -11.649 -2.287
413 H ILE 51 H ILE 51 -5.220 -3.897 -2.341
414 HA ILE 51 HA ILE 51 -6.343 -1.884 -4.206
415 HB ILE 51 HB ILE 51 -4.008 -1.542 -2.253
416 HG12 ILE 51 2HG1 ILE 51 -6.209 -1.220 -1.186
417 HG13 ILE 51 1HG1 ILE 51 -5.343 0.305 -1.269
418 HG21 ILE 51 1HG2 ILE 51 -3.393 -0.474 -4.372
419 HG22 ILE 51 2HG2 ILE 51 -3.724 0.758 -3.154
420 HG23 ILE 51 3HG2 ILE 51 -4.922 0.413 -4.402
421 HD11 ILE 51 3HD1 ILE 51 -7.684 0.598 -1.744
422 HD12 ILE 51 1HD1 ILE 51 -7.606 -0.573 -3.058
423 HD13 ILE 51 2HD1 ILE 51 -6.737 0.961 -3.188
424 H HIS 52 H HIS 52 -5.522 -2.063 -6.228
425 HA HIS 52 HA HIS 52 -3.759 -4.066 -7.053
426 HB2 HIS 52 2HB HIS 52 -5.377 -2.790 -8.541
427 HB3 HIS 52 1HB HIS 52 -4.263 -1.430 -8.506
428 HD1 HIS 52 HD1 HIS 52 -1.958 -1.763 -9.754
429 HD2 HIS 52 HD2 HIS 52 -4.737 -4.781 -10.345
430 HE1 HIS 52 HE1 HIS 52 -1.068 -3.134 -11.658
431 HE2 HIS 52 HE2 HIS 52 -2.887 -4.803 -12.128
432 H ALA 53 H ALA 53 -1.601 -4.222 -7.018
433 HA ALA 53 HA ALA 53 -0.126 -2.854 -5.131
434 HB1 ALA 53 3HB ALA 53 0.289 -5.188 -5.832
435 HB2 ALA 53 1HB ALA 53 1.776 -4.233 -5.818
436 HB3 ALA 53 2HB ALA 53 0.983 -4.613 -7.349
437 H ALA 54 H ALA 54 -0.484 -1.949 -8.435
438 HA ALA 54 HA ALA 54 1.977 -0.623 -8.895
439 HB1 ALA 54 3HB ALA 54 0.533 -1.404 -10.705
440 HB2 ALA 54 1HB ALA 54 0.856 0.322 -10.871
441 HB3 ALA 54 2HB ALA 54 -0.702 -0.233 -10.250
442 H HIS 55 H HIS 55 -0.879 0.393 -7.190
443 HA HIS 55 HA HIS 55 -0.174 3.242 -7.212
444 HB2 HIS 55 2HB HIS 55 -2.398 1.775 -5.711
445 HB3 HIS 55 1HB HIS 55 -2.181 3.525 -5.763
446 HD1 HIS 55 HD1 HIS 55 -1.935 4.299 -8.541
447 HD2 HIS 55 HD2 HIS 55 -4.350 1.095 -7.472
448 HE1 HIS 55 HE1 HIS 55 -3.506 3.974 -10.461
449 HE2 HIS 55 HE2 HIS 55 -4.891 1.972 -9.838
450 H VAL 56 H VAL 56 0.745 0.512 -5.489
451 HA VAL 56 HA VAL 56 1.253 1.918 -2.948
452 HB VAL 56 HB VAL 56 1.362 -1.076 -3.565
453 HG11 VAL 56 1HG1 VAL 56 1.482 0.385 -0.909
454 HG12 VAL 56 2HG1 VAL 56 2.816 -0.467 -1.690
455 HG13 VAL 56 3HG1 VAL 56 1.412 -1.366 -1.110
456 HG21 VAL 56 3HG2 VAL 56 -0.827 0.487 -2.138
457 HG22 VAL 56 1HG2 VAL 56 -0.776 -1.267 -2.346
458 HG23 VAL 56 2HG2 VAL 56 -0.951 -0.215 -3.754
459 H LYS 57 H LYS 57 3.326 2.137 -2.158
460 HA LYS 57 HA LYS 57 5.620 1.126 -3.712
461 HB2 LYS 57 2HB LYS 57 6.644 3.431 -3.667
462 HB3 LYS 57 1HB LYS 57 5.210 3.304 -4.681
463 HG2 LYS 57 2HG LYS 57 3.875 4.300 -2.753
464 HG3 LYS 57 1HG LYS 57 5.410 4.615 -1.943
465 HD2 LYS 57 2HD LYS 57 4.432 5.782 -4.571
466 HD3 LYS 57 1HD LYS 57 4.674 6.636 -3.047
467 HE2 LYS 57 2HE LYS 57 6.874 5.404 -4.747
468 HE3 LYS 57 1HE LYS 57 6.474 7.116 -4.650
469 HZ1 LYS 57 3HZ LYS 57 7.041 7.062 -2.287
470 HZ2 LYS 57 1HZ LYS 57 8.355 6.621 -3.262
471 HZ3 LYS 57 2HZ LYS 57 7.488 5.435 -2.420
472 H ALA 58 H ALA 58 7.285 0.461 -2.391
473 HA ALA 58 HA ALA 58 6.699 0.043 0.358
474 HB1 ALA 58 3HB ALA 58 7.952 -1.573 -1.000
475 HB2 ALA 58 1HB ALA 58 8.840 -1.131 0.458
476 HB3 ALA 58 2HB ALA 58 9.307 -0.449 -1.102
477 H ALA 59 H ALA 59 7.186 1.188 2.104
478 HA ALA 59 HA ALA 59 9.022 3.515 1.972
479 HB1 ALA 59 3HB ALA 59 7.655 4.453 3.805
480 HB2 ALA 59 1HB ALA 59 6.636 3.007 3.790
481 HB3 ALA 59 2HB ALA 59 6.664 4.085 2.392
482 H ASP 60 H ASP 60 10.247 4.001 3.884
483 HA ASP 60 HA ASP 60 11.067 1.706 5.534
484 HB2 ASP 60 2HB ASP 60 12.787 3.060 4.310
485 HB3 ASP 60 1HB ASP 60 12.319 4.481 5.227
486 HA PRO 61 HA PRO 61 8.238 3.534 8.617
487 HB2 PRO 61 2HB PRO 61 8.527 1.659 10.589
488 HB3 PRO 61 1HB PRO 61 7.610 1.330 9.103
489 HG2 PRO 61 2HG PRO 61 10.452 0.589 9.758
490 HG3 PRO 61 1HG PRO 61 9.163 -0.422 9.058
491 HD2 PRO 61 2HD PRO 61 11.066 0.729 7.505
492 HD3 PRO 61 1HD PRO 61 9.402 0.504 6.928
493 H GLY 62 H GLY 62 11.661 2.849 9.186
494 HA2 GLY 62 2HA GLY 62 13.174 3.544 10.782
495 HA3 GLY 62 1HA GLY 62 12.009 4.763 11.307
496 H GLY 63 H GLY 63 10.245 4.062 12.692
497 HA2 GLY 63 2HA GLY 63 10.695 1.563 14.241
498 HA3 GLY 63 1HA GLY 63 9.938 3.020 14.883
499 H GLY 64 H GLY 64 7.853 3.660 14.022
500 HA2 GLY 64 2HA GLY 64 5.750 3.414 13.202
501 HA3 GLY 64 1HA GLY 64 6.448 2.396 11.962
502 HA PRO 65 HA PRO 65 3.461 -0.427 13.821
503 HB2 PRO 65 2HB PRO 65 3.568 -2.454 12.009
504 HB3 PRO 65 1HB PRO 65 2.913 -0.854 11.586
505 HG2 PRO 65 2HG PRO 65 5.653 -1.967 11.020
506 HG3 PRO 65 1HG PRO 65 4.546 -1.092 9.935
507 HD2 PRO 65 2HD PRO 65 6.621 0.140 11.236
508 HD3 PRO 65 1HD PRO 65 5.124 0.983 10.786
509 H SER 66 H SER 66 4.498 -0.923 15.765
510 HA SER 66 HA SER 66 5.986 -3.487 15.837
511 HB2 SER 66 2HB SER 66 7.274 -1.570 16.790
512 HB3 SER 66 1HB SER 66 5.966 -1.257 17.934
513 HG SER 66 HG SER 66 6.446 -3.105 19.005
514 H SER 67 H SER 67 3.913 -1.595 18.066
515 HA SER 67 HA SER 67 2.845 -3.988 19.300
516 HB2 SER 67 2HB SER 67 3.586 -1.957 20.601
517 HB3 SER 67 1HB SER 67 2.238 -1.053 19.905
518 HG SER 67 HG SER 67 1.980 -3.458 21.380
519 H ARG 68 H ARG 68 1.832 -4.621 17.228
520 HA ARG 68 HA ARG 68 -0.963 -4.136 17.050
521 HB2 ARG 68 2HB ARG 68 -0.439 -2.061 15.943
522 HB3 ARG 68 1HB ARG 68 0.835 -2.797 14.977
523 HG2 ARG 68 2HG ARG 68 -0.771 -3.943 13.593
524 HG3 ARG 68 1HG ARG 68 -2.099 -3.498 14.662
525 HD2 ARG 68 2HD ARG 68 -0.456 -1.477 13.104
526 HD3 ARG 68 1HD ARG 68 -1.959 -2.190 12.507
527 HE ARG 68 HE ARG 68 -1.867 -0.693 15.059
528 HH11 ARG 68 1HH1 ARG 68 -3.284 -1.103 11.849
529 HH12 ARG 68 2HH1 ARG 68 -4.535 0.064 12.131
530 HH21 ARG 68 1HH2 ARG 68 -3.541 0.817 15.394
531 HH22 ARG 68 2HH2 ARG 68 -4.680 1.140 14.123
532 H LEU 69 H LEU 69 2.022 -5.405 15.720
533 HA LEU 69 HA LEU 69 0.771 -7.149 13.767
534 HB2 LEU 69 2HB LEU 69 3.672 -6.872 14.623
535 HB3 LEU 69 1HB LEU 69 3.108 -7.788 13.229
536 HG LEU 69 HG LEU 69 2.974 -4.766 13.589
537 HD11 LEU 69 1HD1 LEU 69 4.603 -6.448 11.662
538 HD12 LEU 69 2HD1 LEU 69 5.213 -5.543 13.052
539 HD13 LEU 69 3HD1 LEU 69 4.519 -4.682 11.682
540 HD21 LEU 69 3HD2 LEU 69 2.045 -4.667 11.307
541 HD22 LEU 69 1HD2 LEU 69 0.964 -5.505 12.417
542 HD23 LEU 69 2HD2 LEU 69 1.936 -6.429 11.269
543 H THR 70 H THR 70 0.696 -7.476 16.900
544 HA THR 70 HA THR 70 1.724 -9.915 17.713
545 HB THR 70 HB THR 70 0.750 -8.267 19.256
546 HG1 THR 70 HG1 THR 70 0.833 -10.268 20.146
547 HG21 THR 70 3HG2 THR 70 -1.970 -9.078 18.158
548 HG22 THR 70 1HG2 THR 70 -1.179 -7.522 17.893
549 HG23 THR 70 2HG2 THR 70 -1.679 -7.992 19.519
550 H TRP 71 H TRP 71 -0.936 -9.322 15.566
551 HA TRP 71 HA TRP 71 -2.387 -11.734 15.846
552 HB2 TRP 71 2HB TRP 71 -3.270 -11.095 13.501
553 HB3 TRP 71 1HB TRP 71 -3.546 -9.949 14.800
554 HD1 TRP 71 HD1 TRP 71 -0.381 -10.216 12.481
555 HE1 TRP 71 HE1 TRP 71 -0.033 -7.920 11.376
556 HE3 TRP 71 HE3 TRP 71 -4.507 -7.796 14.301
557 HZ2 TRP 71 HZ2 TRP 71 -1.353 -5.432 11.249
558 HZ3 TRP 71 HZ3 TRP 71 -4.897 -5.465 13.628
559 HH2 TRP 71 HH2 TRP 71 -3.352 -4.302 12.135
560 H ARG 72 H ARG 72 -2.434 -13.571 14.578
561 HA ARG 72 HA ARG 72 0.116 -14.364 13.351
562 HB2 ARG 72 2HB ARG 72 -0.804 -16.703 13.570
563 HB3 ARG 72 1HB ARG 72 -0.539 -15.853 15.083
564 HG2 ARG 72 2HG ARG 72 -2.960 -15.405 15.265
565 HG3 ARG 72 1HG ARG 72 -3.234 -16.261 13.743
566 HD2 ARG 72 2HD ARG 72 -3.745 -17.712 15.647
567 HD3 ARG 72 1HD ARG 72 -2.349 -18.333 14.762
568 HE ARG 72 HE ARG 72 -1.376 -16.718 16.821
569 HH11 ARG 72 1HH1 ARG 72 -3.159 -19.757 16.580
570 HH12 ARG 72 2HH1 ARG 72 -2.535 -20.377 18.073
571 HH21 ARG 72 1HH2 ARG 72 -0.560 -17.565 18.766
572 HH22 ARG 72 2HH2 ARG 72 -1.062 -19.132 19.309
573 H VAL 73 H VAL 73 -0.904 -12.711 11.755
574 HA VAL 73 HA VAL 73 -2.255 -14.059 9.516
575 HB VAL 73 HB VAL 73 -1.258 -11.175 9.786
576 HG11 VAL 73 1HG1 VAL 73 -3.107 -12.359 7.686
577 HG12 VAL 73 2HG1 VAL 73 -1.447 -11.819 7.426
578 HG13 VAL 73 3HG1 VAL 73 -2.698 -10.649 7.852
579 HG21 VAL 73 3HG2 VAL 73 -3.029 -11.652 11.426
580 HG22 VAL 73 1HG2 VAL 73 -4.083 -12.248 10.138
581 HG23 VAL 73 2HG2 VAL 73 -3.612 -10.547 10.182
582 H GLN 74 H GLN 74 0.847 -13.444 10.758
583 HA GLN 74 HA GLN 74 2.323 -13.520 8.233
584 HB2 GLN 74 2HB GLN 74 4.344 -13.369 9.877
585 HB3 GLN 74 1HB GLN 74 3.265 -11.989 9.771
586 HG2 GLN 74 2HG GLN 74 3.871 -12.336 12.075
587 HG3 GLN 74 1HG GLN 74 2.165 -12.673 11.870
588 HE21 GLN 74 1HE2 GLN 74 5.316 -14.122 12.349
589 HE22 GLN 74 2HE2 GLN 74 4.758 -15.614 13.018
590 H ARG 75 H ARG 75 0.741 -15.913 9.024
591 HA ARG 75 HA ARG 75 2.296 -17.922 10.246
592 HB2 ARG 75 2HB ARG 75 -0.162 -18.148 8.466
593 HB3 ARG 75 1HB ARG 75 0.568 -19.530 9.276
594 HG2 ARG 75 2HG ARG 75 -0.758 -17.133 10.568
595 HG3 ARG 75 1HG ARG 75 -1.318 -18.806 10.574
596 HD2 ARG 75 2HD ARG 75 1.085 -17.653 12.024
597 HD3 ARG 75 1HD ARG 75 -0.380 -18.331 12.735
598 HE ARG 75 HE ARG 75 0.777 -20.351 11.209
599 HH11 ARG 75 1HH1 ARG 75 1.629 -18.494 14.106
600 HH12 ARG 75 2HH1 ARG 75 2.605 -19.769 14.764
601 HH21 ARG 75 1HH2 ARG 75 2.129 -21.987 12.091
602 HH22 ARG 75 2HH2 ARG 75 2.889 -21.730 13.633
603 H SER 76 H SER 76 4.230 -18.197 9.432
604 HA SER 76 HA SER 76 4.696 -19.755 7.065
605 HB2 SER 76 2HB SER 76 4.556 -17.431 6.114
606 HB3 SER 76 1HB SER 76 5.832 -16.917 7.213
607 HG SER 76 HG SER 76 6.822 -17.379 5.322
608 H GLN 77 H GLN 77 7.412 -19.547 6.865
609 HA GLN 77 HA GLN 77 8.432 -20.869 9.136
610 HB2 GLN 77 2HB GLN 77 10.035 -19.475 6.944
611 HB3 GLN 77 1HB GLN 77 10.600 -20.772 7.992
612 HG2 GLN 77 2HG GLN 77 8.483 -20.977 5.826
613 HG3 GLN 77 1HG GLN 77 10.108 -21.653 5.771
614 HE21 GLN 77 1HE2 GLN 77 10.564 -23.503 7.082
615 HE22 GLN 77 2HE2 GLN 77 9.297 -24.499 7.701
616 H ASN 78 H ASN 78 9.523 -17.677 7.879
617 HA ASN 78 HA ASN 78 8.971 -16.247 10.271
618 HB2 ASN 78 2HB ASN 78 11.049 -17.418 11.064
619 HB3 ASN 78 1HB ASN 78 11.947 -16.713 9.723
620 HD21 ASN 78 1HD2 ASN 78 13.376 -15.572 11.019
621 HD22 ASN 78 2HD2 ASN 78 12.908 -14.228 11.997
622 HA PRO 79 HA PRO 79 9.302 -13.744 6.329
623 HB2 PRO 79 2HB PRO 79 6.841 -12.561 6.439
624 HB3 PRO 79 1HB PRO 79 7.055 -14.220 5.836
625 HG2 PRO 79 2HG PRO 79 6.162 -13.314 8.558
626 HG3 PRO 79 1HG PRO 79 5.487 -14.594 7.523
627 HD2 PRO 79 2HD PRO 79 7.191 -15.129 9.592
628 HD3 PRO 79 1HD PRO 79 7.112 -16.138 8.134
629 H LEU 80 H LEU 80 8.453 -12.893 9.642
630 HA LEU 80 HA LEU 80 8.798 -10.031 9.317
631 HB2 LEU 80 2HB LEU 80 8.443 -11.772 11.786
632 HB3 LEU 80 1HB LEU 80 8.601 -10.023 11.858
633 HG LEU 80 HG LEU 80 6.323 -11.578 10.564
634 HD11 LEU 80 1HD1 LEU 80 6.238 -11.583 13.009
635 HD12 LEU 80 2HD1 LEU 80 4.935 -10.611 12.331
636 HD13 LEU 80 3HD1 LEU 80 6.349 -9.820 13.035
637 HD21 LEU 80 3HD2 LEU 80 6.743 -9.551 9.276
638 HD22 LEU 80 1HD2 LEU 80 6.696 -8.573 10.745
639 HD23 LEU 80 2HD2 LEU 80 5.242 -9.405 10.183
640 H LYS 81 H LYS 81 10.225 -8.937 11.007
641 HA LYS 81 HA LYS 81 12.834 -10.107 11.499
642 HB2 LYS 81 2HB LYS 81 13.119 -9.316 9.193
643 HB3 LYS 81 1HB LYS 81 12.405 -7.758 9.588
644 HG2 LYS 81 2HG LYS 81 14.341 -7.177 10.974
645 HG3 LYS 81 1HG LYS 81 15.049 -8.769 10.704
646 HD2 LYS 81 2HD LYS 81 14.500 -6.725 8.519
647 HD3 LYS 81 1HD LYS 81 16.067 -6.961 9.298
648 HE2 LYS 81 2HE LYS 81 14.574 -9.078 7.701
649 HE3 LYS 81 1HE LYS 81 15.927 -8.113 7.112
650 HZ1 LYS 81 3HZ LYS 81 17.343 -9.091 8.792
651 HZ2 LYS 81 1HZ LYS 81 16.637 -10.306 7.860
652 HZ3 LYS 81 2HZ LYS 81 16.054 -9.991 9.414
653 H ILE 82 H ILE 82 13.784 -9.129 13.297
654 HA ILE 82 HA ILE 82 12.328 -7.294 14.912
655 HB ILE 82 HB ILE 82 14.424 -7.081 16.288
656 HG12 ILE 82 2HG1 ILE 82 15.663 -8.965 14.218
657 HG13 ILE 82 1HG1 ILE 82 16.091 -7.274 14.443
658 HG21 ILE 82 1HG2 ILE 82 13.649 -9.937 15.626
659 HG22 ILE 82 2HG2 ILE 82 12.811 -8.866 16.749
660 HG23 ILE 82 3HG2 ILE 82 14.455 -9.399 17.102
661 HD11 ILE 82 3HD1 ILE 82 16.905 -7.803 16.709
662 HD12 ILE 82 1HD1 ILE 82 17.753 -8.686 15.442
663 HD13 ILE 82 2HD1 ILE 82 16.544 -9.507 16.425
664 H ARG 83 H ARG 83 12.740 -5.115 15.361
665 HA ARG 83 HA ARG 83 14.211 -3.571 13.286
666 HB2 ARG 83 2HB ARG 83 11.620 -3.677 13.193
667 HB3 ARG 83 1HB ARG 83 11.633 -2.708 14.662
668 HG2 ARG 83 2HG ARG 83 12.712 -0.862 13.481
669 HG3 ARG 83 1HG ARG 83 12.896 -1.856 12.032
670 HD2 ARG 83 2HD ARG 83 10.252 -0.991 13.258
671 HD3 ARG 83 1HD ARG 83 10.994 -0.291 11.817
672 HE ARG 83 HE ARG 83 10.827 -2.751 10.969
673 HH11 ARG 83 1HH1 ARG 83 8.374 -1.136 12.905
674 HH12 ARG 83 2HH1 ARG 83 7.075 -2.076 12.250
675 HH21 ARG 83 1HH2 ARG 83 9.114 -3.940 10.097
676 HH22 ARG 83 2HH2 ARG 83 7.493 -3.669 10.652
677 H LEU 84 H LEU 84 14.543 -4.541 16.275
678 HA LEU 84 HA LEU 84 15.514 -3.916 18.209
679 HB2 LEU 84 2HB LEU 84 16.622 -1.641 16.525
680 HB3 LEU 84 1HB LEU 84 17.205 -2.069 18.126
681 HG LEU 84 HG LEU 84 17.420 -3.799 15.625
682 HD11 LEU 84 1HD1 LEU 84 18.948 -1.887 15.600
683 HD12 LEU 84 2HD1 LEU 84 19.828 -3.402 15.790
684 HD13 LEU 84 3HD1 LEU 84 19.581 -2.346 17.186
685 HD21 LEU 84 3HD2 LEU 84 18.437 -4.387 18.431
686 HD22 LEU 84 1HD2 LEU 84 18.761 -5.347 16.983
687 HD23 LEU 84 2HD2 LEU 84 17.118 -5.221 17.602
688 H THR 85 H THR 85 12.849 -2.767 17.462
689 HA THR 85 HA THR 85 12.716 -0.165 18.758
690 HB THR 85 HB THR 85 11.334 -0.481 16.760
691 HG1 THR 85 HG1 THR 85 10.531 0.825 18.533
692 HG21 THR 85 3HG2 THR 85 9.380 -2.003 16.713
693 HG22 THR 85 1HG2 THR 85 9.877 -2.683 18.266
694 HG23 THR 85 2HG2 THR 85 10.895 -2.899 16.840
695 H ARG 86 H ARG 86 11.681 0.247 20.682
696 HA ARG 86 HA ARG 86 11.752 -1.806 22.691
697 HB2 ARG 86 2HB ARG 86 12.450 0.576 23.071
698 HB3 ARG 86 1HB ARG 86 10.783 1.090 22.840
699 HG2 ARG 86 2HG ARG 86 10.127 -0.215 24.855
700 HG3 ARG 86 1HG ARG 86 11.815 -0.674 25.089
701 HD2 ARG 86 2HD ARG 86 12.425 1.704 25.373
702 HD3 ARG 86 1HD ARG 86 10.741 2.168 25.114
703 HE ARG 86 HE ARG 86 10.773 0.370 27.248
704 HH11 ARG 86 1HH1 ARG 86 12.020 3.603 26.566
705 HH12 ARG 86 2HH1 ARG 86 11.954 4.107 28.222
706 HH21 ARG 86 1HH2 ARG 86 10.714 1.075 29.429
707 HH22 ARG 86 2HH2 ARG 86 11.222 2.687 29.829
708 H GLU 87 H GLU 87 10.165 -3.319 22.243
709 HA GLU 87 HA GLU 87 7.364 -2.631 21.877
710 HB2 GLU 87 2HB GLU 87 8.205 -4.572 20.685
711 HB3 GLU 87 1HB GLU 87 8.840 -5.285 22.157
712 HG2 GLU 87 2HG GLU 87 6.824 -6.458 21.400
713 HG3 GLU 87 1HG GLU 87 6.576 -5.720 22.978
714 H ALA 88 H ALA 88 9.207 -4.489 24.345
715 HA ALA 88 HA ALA 88 7.147 -4.295 26.346
716 HB1 ALA 88 3HB ALA 88 8.743 -6.176 26.313
717 HB2 ALA 88 1HB ALA 88 8.851 -5.301 27.840
718 HB3 ALA 88 2HB ALA 88 10.086 -5.066 26.600
719 HA PRO 89 HA PRO 89 8.393 -0.184 27.853
720 HB2 PRO 89 2HB PRO 89 7.053 -0.135 30.250
721 HB3 PRO 89 1HB PRO 89 6.239 0.038 28.684
722 HG2 PRO 89 2HG PRO 89 6.403 -2.361 30.460
723 HG3 PRO 89 1HG PRO 89 5.048 -1.786 29.470
724 HD2 PRO 89 2HD PRO 89 6.743 -3.848 28.731
725 HD3 PRO 89 1HD PRO 89 5.800 -2.871 27.584
Start of MODEL 12
1 H1 HIS 1 1H HIS 1 -2.668 -25.266 14.041
2 H2 HIS 1 2H HIS 1 -2.465 -23.639 14.446
3 H3 HIS 1 3H HIS 1 -1.131 -24.666 14.385
4 HA HIS 1 HA HIS 1 -1.292 -24.942 12.092
5 HB2 HIS 1 2HB HIS 1 -3.819 -23.265 12.311
6 HB3 HIS 1 1HB HIS 1 -3.029 -23.628 10.779
7 HD1 HIS 1 HD1 HIS 1 -5.930 -24.619 12.128
8 HD2 HIS 1 HD2 HIS 1 -2.552 -26.845 11.191
9 HE1 HIS 1 HE1 HIS 1 -6.727 -26.979 11.853
10 HE2 HIS 1 HE2 HIS 1 -4.715 -28.231 11.049
11 H HIS 2 H HIS 2 0.365 -23.866 11.308
12 HA HIS 2 HA HIS 2 0.511 -21.006 11.080
13 HB2 HIS 2 2HB HIS 2 2.635 -20.738 12.343
14 HB3 HIS 2 1HB HIS 2 1.306 -21.200 13.389
15 HD1 HIS 2 HD1 HIS 2 1.673 -23.180 14.872
16 HD2 HIS 2 HD2 HIS 2 4.556 -22.932 11.890
17 HE1 HIS 2 HE1 HIS 2 3.401 -24.900 15.452
18 HE2 HIS 2 HE2 HIS 2 5.136 -24.715 13.655
19 H HIS 3 H HIS 3 2.211 -20.368 9.587
20 HA HIS 3 HA HIS 3 3.888 -22.348 8.325
21 HB2 HIS 3 2HB HIS 3 1.453 -22.763 7.449
22 HB3 HIS 3 1HB HIS 3 1.662 -21.269 6.545
23 HD1 HIS 3 HD1 HIS 3 3.977 -21.355 4.957
24 HD2 HIS 3 HD2 HIS 3 2.205 -24.947 6.022
25 HE1 HIS 3 HE1 HIS 3 4.851 -23.048 3.338
26 HE2 HIS 3 HE2 HIS 3 3.845 -25.224 4.063
27 H HIS 4 H HIS 4 5.448 -21.431 6.991
28 HA HIS 4 HA HIS 4 5.892 -18.570 7.247
29 HB2 HIS 4 2HB HIS 4 7.518 -20.758 5.878
30 HB3 HIS 4 1HB HIS 4 8.046 -19.086 5.997
31 HD1 HIS 4 HD1 HIS 4 9.539 -18.617 7.918
32 HD2 HIS 4 HD2 HIS 4 7.187 -21.968 8.595
33 HE1 HIS 4 HE1 HIS 4 10.400 -19.637 10.034
34 HE2 HIS 4 HE2 HIS 4 9.100 -21.757 10.295
35 H HIS 5 H HIS 5 6.534 -17.205 5.420
36 HA HIS 5 HA HIS 5 6.115 -18.121 2.702
37 HB2 HIS 5 2HB HIS 5 4.543 -16.442 2.003
38 HB3 HIS 5 1HB HIS 5 3.852 -17.222 3.401
39 HD1 HIS 5 HD1 HIS 5 4.884 -15.635 5.732
40 HD2 HIS 5 HD2 HIS 5 3.761 -13.839 2.153
41 HE1 HIS 5 HE1 HIS 5 4.391 -13.240 6.287
42 HE2 HIS 5 HE2 HIS 5 3.755 -12.170 4.113
43 H HIS 6 H HIS 6 7.842 -17.417 1.570
44 HA HIS 6 HA HIS 6 9.612 -15.397 2.690
45 HB2 HIS 6 2HB HIS 6 11.197 -16.001 0.900
46 HB3 HIS 6 1HB HIS 6 10.645 -17.411 1.776
47 HD1 HIS 6 HD1 HIS 6 11.963 -17.687 -0.993
48 HD2 HIS 6 HD2 HIS 6 7.848 -17.481 -0.417
49 HE1 HIS 6 HE1 HIS 6 10.927 -18.782 -3.004
50 HE2 HIS 6 HE2 HIS 6 8.451 -18.642 -2.623
51 H SER 7 H SER 7 8.101 -13.693 2.566
52 HA SER 7 HA SER 7 8.125 -12.065 0.195
53 HB2 SER 7 2HB SER 7 6.315 -13.740 -0.355
54 HB3 SER 7 1HB SER 7 5.444 -13.241 1.088
55 HG SER 7 HG SER 7 5.577 -12.075 -1.366
56 H HIS 8 H HIS 8 6.101 -10.310 0.759
57 HA HIS 8 HA HIS 8 7.107 -8.823 2.976
58 HB2 HIS 8 2HB HIS 8 4.575 -8.379 1.328
59 HB3 HIS 8 1HB HIS 8 5.287 -7.204 2.426
60 HD1 HIS 8 HD1 HIS 8 6.419 -5.427 1.093
61 HD2 HIS 8 HD2 HIS 8 6.834 -9.144 -0.703
62 HE1 HIS 8 HE1 HIS 8 7.744 -5.029 -0.989
63 HE2 HIS 8 HE2 HIS 8 8.174 -7.315 -1.923
64 H MET 9 H MET 9 6.462 -8.846 5.065
65 HA MET 9 HA MET 9 4.356 -10.738 5.884
66 HB2 MET 9 2HB MET 9 5.366 -10.584 8.138
67 HB3 MET 9 1HB MET 9 6.560 -11.015 6.921
68 HG2 MET 9 2HG MET 9 7.407 -8.707 6.921
69 HG3 MET 9 1HG MET 9 6.183 -8.256 8.109
70 HE1 MET 9 3HE MET 9 9.357 -10.553 7.469
71 HE2 MET 9 1HE MET 9 8.173 -11.696 8.108
72 HE3 MET 9 2HE MET 9 9.582 -11.253 9.070
73 H VAL 10 H VAL 10 3.221 -10.073 8.002
74 HA VAL 10 HA VAL 10 1.523 -7.859 7.506
75 HB VAL 10 HB VAL 10 0.485 -8.414 9.712
76 HG11 VAL 10 1HG1 VAL 10 -0.254 -9.684 7.735
77 HG12 VAL 10 2HG1 VAL 10 -0.284 -10.707 9.172
78 HG13 VAL 10 3HG1 VAL 10 1.025 -10.874 7.998
79 HG21 VAL 10 3HG2 VAL 10 2.522 -9.037 10.950
80 HG22 VAL 10 1HG2 VAL 10 2.695 -10.487 9.958
81 HG23 VAL 10 2HG2 VAL 10 1.312 -10.317 11.043
82 H GLY 11 H GLY 11 1.544 -5.793 8.282
83 HA2 GLY 11 2HA GLY 11 2.033 -4.032 9.785
84 HA3 GLY 11 1HA GLY 11 3.301 -5.002 10.517
85 H ASP 12 H ASP 12 3.397 -5.105 7.099
86 HA ASP 12 HA ASP 12 5.995 -3.948 6.954
87 HB2 ASP 12 2HB ASP 12 5.151 -5.736 5.420
88 HB3 ASP 12 1HB ASP 12 4.051 -4.580 4.689
89 H THR 13 H THR 13 6.512 -1.838 6.901
90 HA THR 13 HA THR 13 4.478 0.184 6.874
91 HB THR 13 HB THR 13 7.511 0.466 6.990
92 HG1 THR 13 HG1 THR 13 5.853 -0.641 8.715
93 HG21 THR 13 3HG2 THR 13 7.055 2.653 8.059
94 HG22 THR 13 1HG2 THR 13 5.320 2.417 7.830
95 HG23 THR 13 2HG2 THR 13 6.379 2.615 6.430
96 H VAL 14 H VAL 14 3.651 0.948 5.064
97 HA VAL 14 HA VAL 14 5.230 1.427 2.632
98 HB VAL 14 HB VAL 14 3.415 0.489 1.217
99 HG11 VAL 14 1HG1 VAL 14 4.512 -1.556 3.176
100 HG12 VAL 14 2HG1 VAL 14 5.343 -0.936 1.750
101 HG13 VAL 14 3HG1 VAL 14 3.877 -1.898 1.563
102 HG21 VAL 14 3HG2 VAL 14 1.520 0.765 2.764
103 HG22 VAL 14 1HG2 VAL 14 2.177 -0.484 3.826
104 HG23 VAL 14 2HG2 VAL 14 1.620 -0.902 2.204
105 H TRP 15 H TRP 15 3.512 2.445 0.976
106 HA TRP 15 HA TRP 15 1.855 4.526 2.247
107 HB2 TRP 15 2HB TRP 15 3.789 4.902 -0.100
108 HB3 TRP 15 1HB TRP 15 2.653 6.120 0.468
109 HD1 TRP 15 HD1 TRP 15 3.420 5.662 3.668
110 HE1 TRP 15 HE1 TRP 15 5.602 6.734 4.497
111 HE3 TRP 15 HE3 TRP 15 5.829 6.198 -0.816
112 HZ2 TRP 15 HZ2 TRP 15 8.014 7.685 3.413
113 HZ3 TRP 15 HZ3 TRP 15 8.079 7.196 -0.830
114 HH2 TRP 15 HH2 TRP 15 9.152 7.925 1.244
115 H VAL 16 H VAL 16 0.083 5.198 0.794
116 HA VAL 16 HA VAL 16 -0.450 3.373 -1.473
117 HB VAL 16 HB VAL 16 -2.466 4.986 0.168
118 HG11 VAL 16 1HG1 VAL 16 -2.961 3.044 -2.134
119 HG12 VAL 16 2HG1 VAL 16 -3.206 4.792 -2.182
120 HG13 VAL 16 3HG1 VAL 16 -4.216 3.792 -1.138
121 HG21 VAL 16 3HG2 VAL 16 -1.579 3.047 1.416
122 HG22 VAL 16 1HG2 VAL 16 -1.985 1.978 0.072
123 HG23 VAL 16 2HG2 VAL 16 -3.269 2.784 0.980
124 H ARG 17 H ARG 17 0.326 4.343 -3.214
125 HA ARG 17 HA ARG 17 0.452 7.194 -3.627
126 HB2 ARG 17 2HB ARG 17 2.258 5.658 -4.349
127 HB3 ARG 17 1HB ARG 17 1.146 4.834 -5.438
128 HG2 ARG 17 2HG ARG 17 0.940 6.897 -6.783
129 HG3 ARG 17 1HG ARG 17 2.034 7.726 -5.675
130 HD2 ARG 17 2HD ARG 17 3.788 5.994 -6.264
131 HD3 ARG 17 1HD ARG 17 2.685 5.404 -7.516
132 HE ARG 17 HE ARG 17 3.195 8.235 -7.660
133 HH11 ARG 17 1HH1 ARG 17 4.433 5.099 -8.681
134 HH12 ARG 17 2HH1 ARG 17 5.306 5.755 -10.029
135 HH21 ARG 17 1HH2 ARG 17 4.366 9.084 -9.417
136 HH22 ARG 17 2HH2 ARG 17 5.267 8.009 -10.446
137 H ARG 18 H ARG 18 -1.594 8.083 -3.910
138 HA ARG 18 HA ARG 18 -3.555 6.723 -5.643
139 HB2 ARG 18 2HB ARG 18 -4.205 7.343 -3.349
140 HB3 ARG 18 1HB ARG 18 -3.926 9.044 -3.722
141 HG2 ARG 18 2HG ARG 18 -5.754 9.000 -5.370
142 HG3 ARG 18 1HG ARG 18 -5.983 7.267 -5.092
143 HD2 ARG 18 2HD ARG 18 -6.416 9.500 -3.088
144 HD3 ARG 18 1HD ARG 18 -7.667 8.527 -3.864
145 HE ARG 18 HE ARG 18 -5.709 7.551 -1.868
146 HH11 ARG 18 1HH1 ARG 18 -8.844 7.205 -3.437
147 HH12 ARG 18 2HH1 ARG 18 -9.350 5.911 -2.399
148 HH21 ARG 18 1HH2 ARG 18 -6.343 5.808 -0.585
149 HH22 ARG 18 2HH2 ARG 18 -7.918 5.115 -0.775
150 H HIS 19 H HIS 19 -3.748 7.350 -7.671
151 HA HIS 19 HA HIS 19 -3.166 10.138 -8.518
152 HB2 HIS 19 2HB HIS 19 -1.800 8.384 -9.625
153 HB3 HIS 19 1HB HIS 19 -3.257 7.541 -10.132
154 HD1 HIS 19 HD1 HIS 19 -1.337 10.743 -10.798
155 HD2 HIS 19 HD2 HIS 19 -4.294 8.404 -12.550
156 HE1 HIS 19 HE1 HIS 19 -1.663 11.658 -13.109
157 HE2 HIS 19 HE2 HIS 19 -3.424 10.224 -14.142
158 H GLN 20 H GLN 20 -5.102 11.131 -8.103
159 HA GLN 20 HA GLN 20 -7.647 9.966 -8.116
160 HB2 GLN 20 2HB GLN 20 -6.893 12.906 -8.401
161 HB3 GLN 20 1HB GLN 20 -8.511 12.326 -8.020
162 HG2 GLN 20 2HG GLN 20 -6.106 11.740 -6.269
163 HG3 GLN 20 1HG GLN 20 -7.107 13.176 -6.073
164 HE21 GLN 20 1HE2 GLN 20 -7.691 12.550 -3.975
165 HE22 GLN 20 2HE2 GLN 20 -8.795 11.260 -3.661
166 H THR 21 H THR 21 -6.663 12.542 -10.406
167 HA THR 21 HA THR 21 -8.202 11.233 -12.578
168 HB THR 21 HB THR 21 -8.616 13.457 -13.526
169 HG1 THR 21 HG1 THR 21 -7.972 15.319 -12.234
170 HG21 THR 21 3HG2 THR 21 -9.340 13.441 -10.566
171 HG22 THR 21 1HG2 THR 21 -10.276 12.691 -11.867
172 HG23 THR 21 2HG2 THR 21 -10.094 14.445 -11.809
173 H LYS 22 H LYS 22 -7.331 12.111 -14.774
174 HA LYS 22 HA LYS 22 -4.636 11.212 -15.054
175 HB2 LYS 22 2HB LYS 22 -6.450 12.536 -17.117
176 HB3 LYS 22 1HB LYS 22 -4.985 11.610 -17.466
177 HG2 LYS 22 2HG LYS 22 -6.047 9.579 -16.525
178 HG3 LYS 22 1HG LYS 22 -7.503 10.514 -16.164
179 HD2 LYS 22 2HD LYS 22 -7.673 10.999 -18.652
180 HD3 LYS 22 1HD LYS 22 -6.378 9.820 -18.902
181 HE2 LYS 22 2HE LYS 22 -8.629 8.821 -19.237
182 HE3 LYS 22 1HE LYS 22 -7.772 8.058 -17.896
183 HZ1 LYS 22 3HZ LYS 22 -9.761 10.235 -17.538
184 HZ2 LYS 22 1HZ LYS 22 -9.073 9.272 -16.337
185 HZ3 LYS 22 2HZ LYS 22 -10.150 8.595 -17.449
186 H ASN 23 H ASN 23 -6.044 14.359 -14.594
187 HA ASN 23 HA ASN 23 -3.642 15.779 -15.521
188 HB2 ASN 23 2HB ASN 23 -4.888 17.846 -15.122
189 HB3 ASN 23 1HB ASN 23 -5.856 16.743 -16.086
190 HD21 ASN 23 1HD2 ASN 23 -5.521 18.293 -12.974
191 HD22 ASN 23 2HD2 ASN 23 -7.102 17.910 -12.392
192 H LEU 24 H LEU 24 -5.253 14.847 -12.511
193 HA LEU 24 HA LEU 24 -3.568 16.455 -10.796
194 HB2 LEU 24 2HB LEU 24 -5.443 14.137 -10.177
195 HB3 LEU 24 1HB LEU 24 -4.553 15.016 -8.943
196 HG LEU 24 HG LEU 24 -6.701 16.183 -10.763
197 HD11 LEU 24 1HD1 LEU 24 -6.757 15.635 -7.782
198 HD12 LEU 24 2HD1 LEU 24 -7.633 14.744 -9.029
199 HD13 LEU 24 3HD1 LEU 24 -8.027 16.431 -8.720
200 HD21 LEU 24 3HD2 LEU 24 -6.486 18.244 -9.423
201 HD22 LEU 24 1HD2 LEU 24 -5.016 17.877 -10.321
202 HD23 LEU 24 2HD2 LEU 24 -5.091 17.552 -8.587
203 H GLU 25 H GLU 25 -2.228 15.411 -9.068
204 HA GLU 25 HA GLU 25 -0.188 13.794 -10.376
205 HB2 GLU 25 2HB GLU 25 -0.218 15.199 -7.664
206 HB3 GLU 25 1HB GLU 25 1.192 14.439 -8.405
207 HG2 GLU 25 2HG GLU 25 0.973 16.079 -10.323
208 HG3 GLU 25 1HG GLU 25 -0.301 16.892 -9.411
209 HA PRO 26 HA PRO 26 -1.082 10.096 -7.884
210 HB2 PRO 26 2HB PRO 26 1.654 9.116 -7.958
211 HB3 PRO 26 1HB PRO 26 0.297 8.631 -8.990
212 HG2 PRO 26 2HG PRO 26 2.523 10.004 -9.899
213 HG3 PRO 26 1HG PRO 26 0.943 9.981 -10.711
214 HD2 PRO 26 2HD PRO 26 2.105 12.105 -8.915
215 HD3 PRO 26 1HD PRO 26 1.153 12.282 -10.412
216 H ARG 27 H ARG 27 -1.437 11.551 -6.056
217 HA ARG 27 HA ARG 27 0.702 12.241 -4.240
218 HB2 ARG 27 2HB ARG 27 -1.230 13.755 -4.538
219 HB3 ARG 27 1HB ARG 27 -2.326 12.508 -3.950
220 HG2 ARG 27 2HG ARG 27 -1.235 12.590 -1.730
221 HG3 ARG 27 1HG ARG 27 -0.120 13.820 -2.327
222 HD2 ARG 27 2HD ARG 27 -2.081 15.322 -2.752
223 HD3 ARG 27 1HD ARG 27 -3.125 14.101 -2.013
224 HE ARG 27 HE ARG 27 -2.102 14.501 0.078
225 HH11 ARG 27 1HH1 ARG 27 -0.975 16.743 -2.383
226 HH12 ARG 27 2HH1 ARG 27 -0.362 17.887 -1.231
227 HH21 ARG 27 1HH2 ARG 27 -1.288 15.986 1.585
228 HH22 ARG 27 2HH2 ARG 27 -0.541 17.452 1.031
229 H TRP 28 H TRP 28 1.552 10.792 -2.847
230 HA TRP 28 HA TRP 28 0.104 8.401 -2.085
231 HB2 TRP 28 2HB TRP 28 2.133 7.713 -0.899
232 HB3 TRP 28 1HB TRP 28 2.522 8.225 -2.534
233 HD1 TRP 28 HD1 TRP 28 4.071 10.405 -2.795
234 HE1 TRP 28 HE1 TRP 28 5.643 11.591 -1.153
235 HE3 TRP 28 HE3 TRP 28 2.329 8.446 1.595
236 HZ2 TRP 28 HZ2 TRP 28 6.087 11.701 1.603
237 HZ3 TRP 28 HZ3 TRP 28 3.380 9.155 3.702
238 HH2 TRP 28 HH2 TRP 28 5.227 10.756 3.702
239 H LYS 29 H LYS 29 -0.444 7.813 -0.012
240 HA LYS 29 HA LYS 29 -0.313 9.815 2.168
241 HB2 LYS 29 2HB LYS 29 -2.590 7.873 1.551
242 HB3 LYS 29 1HB LYS 29 -2.458 8.812 3.036
243 HG2 LYS 29 2HG LYS 29 -2.610 10.906 1.718
244 HG3 LYS 29 1HG LYS 29 -2.767 9.955 0.241
245 HD2 LYS 29 2HD LYS 29 -4.971 10.686 0.880
246 HD3 LYS 29 1HD LYS 29 -4.880 8.952 1.181
247 HE2 LYS 29 2HE LYS 29 -4.482 11.042 3.350
248 HE3 LYS 29 1HE LYS 29 -6.045 10.339 2.965
249 HZ1 LYS 29 3HZ LYS 29 -3.671 8.881 3.993
250 HZ2 LYS 29 1HZ LYS 29 -5.112 8.143 3.519
251 HZ3 LYS 29 2HZ LYS 29 -5.097 9.210 4.827
252 H GLY 30 H GLY 30 0.479 8.974 4.094
253 HA2 GLY 30 2HA GLY 30 0.583 6.163 4.647
254 HA3 GLY 30 1HA GLY 30 2.124 6.784 4.113
255 HA PRO 31 HA PRO 31 2.801 5.238 5.486
256 HB2 PRO 31 2HB PRO 31 3.887 4.040 7.644
257 HB3 PRO 31 1HB PRO 31 4.611 5.508 6.950
258 HG2 PRO 31 2HG PRO 31 2.924 5.238 9.414
259 HG3 PRO 31 1HG PRO 31 4.330 6.283 9.121
260 HD2 PRO 31 2HD PRO 31 1.624 7.086 8.932
261 HD3 PRO 31 1HD PRO 31 3.015 7.979 8.283
262 H TYR 32 H TYR 32 1.313 3.766 4.868
263 HA TYR 32 HA TYR 32 -0.568 2.482 6.695
264 HB2 TYR 32 2HB TYR 32 -0.036 2.188 3.709
265 HB3 TYR 32 1HB TYR 32 -1.179 1.166 4.573
266 HD1 TYR 32 HD2 TYR 32 -0.437 4.787 3.923
267 HD2 TYR 32 HD1 TYR 32 -3.434 1.861 4.750
268 HE1 TYR 32 HE2 TYR 32 -2.175 6.487 3.645
269 HE2 TYR 32 HE1 TYR 32 -5.182 3.571 4.466
270 HH TYR 32 HH TYR 32 -5.391 6.035 4.591
271 H THR 33 H THR 33 -0.692 -0.084 6.240
272 HA THR 33 HA THR 33 2.005 -1.274 6.400
273 HB THR 33 HB THR 33 1.162 -2.724 8.354
274 HG1 THR 33 HG1 THR 33 -1.092 -2.100 8.026
275 HG21 THR 33 3HG2 THR 33 1.416 0.255 8.919
276 HG22 THR 33 1HG2 THR 33 2.757 -0.893 8.801
277 HG23 THR 33 2HG2 THR 33 1.583 -1.031 10.116
278 H VAL 34 H VAL 34 2.018 -2.706 4.679
279 HA VAL 34 HA VAL 34 -0.213 -4.198 3.766
280 HB VAL 34 HB VAL 34 2.771 -4.797 3.441
281 HG11 VAL 34 1HG1 VAL 34 1.509 -6.895 3.145
282 HG12 VAL 34 2HG1 VAL 34 2.148 -6.340 1.597
283 HG13 VAL 34 3HG1 VAL 34 0.439 -6.107 1.981
284 HG21 VAL 34 3HG2 VAL 34 2.485 -3.909 1.149
285 HG22 VAL 34 1HG2 VAL 34 2.074 -2.701 2.365
286 HG23 VAL 34 2HG2 VAL 34 0.792 -3.545 1.500
287 H LEU 35 H LEU 35 -1.053 -6.073 4.409
288 HA LEU 35 HA LEU 35 0.114 -7.549 6.681
289 HB2 LEU 35 2HB LEU 35 -2.714 -7.682 5.565
290 HB3 LEU 35 1HB LEU 35 -2.123 -8.492 7.011
291 HG LEU 35 HG LEU 35 -2.498 -5.490 6.635
292 HD11 LEU 35 1HD1 LEU 35 -3.934 -7.454 8.441
293 HD12 LEU 35 2HD1 LEU 35 -4.584 -6.679 6.992
294 HD13 LEU 35 3HD1 LEU 35 -4.183 -5.703 8.402
295 HD21 LEU 35 3HD2 LEU 35 -1.810 -5.244 8.998
296 HD22 LEU 35 1HD2 LEU 35 -0.500 -5.833 7.978
297 HD23 LEU 35 2HD2 LEU 35 -1.358 -6.953 9.041
298 H LEU 36 H LEU 36 -1.259 -7.872 3.419
299 HA LEU 36 HA LEU 36 0.080 -10.474 3.051
300 HB2 LEU 36 2HB LEU 36 -2.207 -10.927 3.931
301 HB3 LEU 36 1HB LEU 36 -2.903 -10.010 2.607
302 HG LEU 36 HG LEU 36 -2.059 -11.720 0.988
303 HD11 LEU 36 1HD1 LEU 36 -0.091 -12.510 2.180
304 HD12 LEU 36 2HD1 LEU 36 -1.151 -13.860 1.785
305 HD13 LEU 36 3HD1 LEU 36 -1.103 -13.231 3.437
306 HD21 LEU 36 3HD2 LEU 36 -3.732 -12.871 3.241
307 HD22 LEU 36 1HD2 LEU 36 -3.627 -13.508 1.594
308 HD23 LEU 36 2HD2 LEU 36 -4.323 -11.913 1.878
309 H THR 37 H THR 37 0.563 -10.917 0.899
310 HA THR 37 HA THR 37 0.160 -8.755 -1.081
311 HB THR 37 HB THR 37 2.049 -9.956 -2.320
312 HG1 THR 37 HG1 THR 37 1.785 -11.995 -1.202
313 HG21 THR 37 3HG2 THR 37 3.853 -9.122 -0.865
314 HG22 THR 37 1HG2 THR 37 2.723 -9.016 0.490
315 HG23 THR 37 2HG2 THR 37 2.515 -7.972 -0.915
316 H THR 38 H THR 38 -0.818 -9.219 -3.059
317 HA THR 38 HA THR 38 -1.608 -11.990 -3.741
318 HB THR 38 HB THR 38 -3.450 -9.539 -3.697
319 HG1 THR 38 HG1 THR 38 -2.978 -11.569 -1.888
320 HG21 THR 38 3HG2 THR 38 -4.172 -12.387 -4.471
321 HG22 THR 38 1HG2 THR 38 -4.109 -10.999 -5.563
322 HG23 THR 38 2HG2 THR 38 -5.310 -11.052 -4.270
323 HA PRO 39 HA PRO 39 -0.157 -10.921 -8.013
324 HB2 PRO 39 2HB PRO 39 -2.964 -11.935 -8.613
325 HB3 PRO 39 1HB PRO 39 -1.458 -12.209 -9.525
326 HG2 PRO 39 2HG PRO 39 -2.340 -14.090 -7.870
327 HG3 PRO 39 1HG PRO 39 -0.605 -13.712 -7.946
328 HD2 PRO 39 2HD PRO 39 -2.558 -13.080 -5.773
329 HD3 PRO 39 1HD PRO 39 -0.794 -13.295 -5.681
330 H THR 40 H THR 40 -0.068 -8.874 -8.681
331 HA THR 40 HA THR 40 -0.418 -6.717 -9.138
332 HB THR 40 HB THR 40 -1.489 -7.780 -11.127
333 HG1 THR 40 HG1 THR 40 -2.999 -5.469 -10.826
334 HG21 THR 40 3HG2 THR 40 -3.519 -8.782 -10.112
335 HG22 THR 40 1HG2 THR 40 -3.944 -7.695 -11.444
336 HG23 THR 40 2HG2 THR 40 -4.150 -7.173 -9.773
337 H ALA 41 H ALA 41 -1.656 -7.665 -6.461
338 HA ALA 41 HA ALA 41 -3.000 -5.171 -5.783
339 HB1 ALA 41 3HB ALA 41 -4.874 -6.525 -6.664
340 HB2 ALA 41 1HB ALA 41 -5.049 -6.269 -4.926
341 HB3 ALA 41 2HB ALA 41 -4.481 -7.826 -5.536
342 H LEU 42 H LEU 42 -2.259 -4.604 -3.807
343 HA LEU 42 HA LEU 42 -1.147 -6.657 -2.000
344 HB2 LEU 42 2HB LEU 42 -0.680 -3.648 -2.035
345 HB3 LEU 42 1HB LEU 42 0.074 -4.784 -0.918
346 HG LEU 42 HG LEU 42 0.493 -4.692 -3.939
347 HD11 LEU 42 1HD1 LEU 42 2.785 -4.024 -3.424
348 HD12 LEU 42 2HD1 LEU 42 2.396 -3.973 -1.701
349 HD13 LEU 42 3HD1 LEU 42 1.607 -2.861 -2.824
350 HD21 LEU 42 3HD2 LEU 42 0.602 -7.002 -3.178
351 HD22 LEU 42 1HD2 LEU 42 1.756 -6.568 -1.911
352 HD23 LEU 42 2HD2 LEU 42 2.207 -6.425 -3.615
353 H LYS 43 H LYS 43 -2.202 -7.150 -0.206
354 HA LYS 43 HA LYS 43 -4.635 -5.734 0.529
355 HB2 LYS 43 2HB LYS 43 -4.538 -8.247 0.382
356 HB3 LYS 43 1HB LYS 43 -3.431 -8.262 1.752
357 HG2 LYS 43 2HG LYS 43 -5.113 -7.403 3.238
358 HG3 LYS 43 1HG LYS 43 -6.186 -7.021 1.895
359 HD2 LYS 43 2HD LYS 43 -6.196 -9.563 1.419
360 HD3 LYS 43 1HD LYS 43 -5.512 -9.730 3.041
361 HE2 LYS 43 2HE LYS 43 -8.167 -8.434 2.309
362 HE3 LYS 43 1HE LYS 43 -7.945 -9.980 3.127
363 HZ1 LYS 43 3HZ LYS 43 -7.213 -7.308 4.217
364 HZ2 LYS 43 1HZ LYS 43 -6.946 -8.781 5.001
365 HZ3 LYS 43 2HZ LYS 43 -8.520 -8.257 4.700
366 H VAL 44 H VAL 44 -4.473 -4.064 1.809
367 HA VAL 44 HA VAL 44 -2.216 -3.782 3.708
368 HB VAL 44 HB VAL 44 -3.653 -1.594 2.119
369 HG11 VAL 44 1HG1 VAL 44 -1.897 -0.074 2.954
370 HG12 VAL 44 2HG1 VAL 44 -1.219 -1.385 3.919
371 HG13 VAL 44 3HG1 VAL 44 -2.833 -0.769 4.284
372 HG21 VAL 44 3HG2 VAL 44 -1.560 -1.341 0.820
373 HG22 VAL 44 1HG2 VAL 44 -2.240 -2.960 0.620
374 HG23 VAL 44 2HG2 VAL 44 -0.852 -2.710 1.684
375 H ASP 45 H ASP 45 -2.723 -3.083 5.764
376 HA ASP 45 HA ASP 45 -5.338 -3.285 6.800
377 HB2 ASP 45 2HB ASP 45 -3.358 -3.730 8.171
378 HB3 ASP 45 1HB ASP 45 -2.817 -2.066 7.989
379 H GLY 46 H GLY 46 -6.840 -1.756 7.345
380 HA2 GLY 46 2HA GLY 46 -7.763 0.410 7.593
381 HA3 GLY 46 1HA GLY 46 -6.409 1.090 6.699
382 H ILE 47 H ILE 47 -6.663 -1.102 4.660
383 HA ILE 47 HA ILE 47 -8.581 0.227 2.915
384 HB ILE 47 HB ILE 47 -6.592 -2.031 2.377
385 HG12 ILE 47 2HG1 ILE 47 -5.407 0.010 3.009
386 HG13 ILE 47 1HG1 ILE 47 -5.194 -0.259 1.286
387 HG21 ILE 47 1HG2 ILE 47 -6.892 -1.545 -0.027
388 HG22 ILE 47 2HG2 ILE 47 -8.161 -0.383 0.364
389 HG23 ILE 47 3HG2 ILE 47 -8.394 -2.097 0.716
390 HD11 ILE 47 3HD1 ILE 47 -5.509 2.076 1.782
391 HD12 ILE 47 1HD1 ILE 47 -7.051 1.748 2.565
392 HD13 ILE 47 2HD1 ILE 47 -6.867 1.484 0.825
393 H ALA 48 H ALA 48 -10.319 -0.835 1.884
394 HA ALA 48 HA ALA 48 -11.957 -2.465 3.404
395 HB1 ALA 48 3HB ALA 48 -12.771 -1.027 1.571
396 HB2 ALA 48 1HB ALA 48 -13.377 -2.678 1.408
397 HB3 ALA 48 2HB ALA 48 -12.051 -2.115 0.385
398 H ALA 49 H ALA 49 -10.036 -3.465 0.512
399 HA ALA 49 HA ALA 49 -9.302 -5.892 1.965
400 HB1 ALA 49 3HB ALA 49 -9.904 -7.427 0.148
401 HB2 ALA 49 1HB ALA 49 -10.614 -6.094 -0.766
402 HB3 ALA 49 2HB ALA 49 -11.334 -6.596 0.763
403 H TRP 50 H TRP 50 -9.010 -4.399 -1.327
404 HA TRP 50 HA TRP 50 -6.074 -4.780 -1.157
405 HB2 TRP 50 2HB TRP 50 -7.848 -5.723 -3.449
406 HB3 TRP 50 1HB TRP 50 -6.118 -5.491 -3.631
407 HD1 TRP 50 HD1 TRP 50 -4.514 -7.123 -2.094
408 HE1 TRP 50 HE1 TRP 50 -4.885 -9.552 -1.373
409 HE3 TRP 50 HE3 TRP 50 -9.566 -7.466 -2.838
410 HZ2 TRP 50 HZ2 TRP 50 -6.986 -11.389 -1.160
411 HZ3 TRP 50 HZ3 TRP 50 -10.681 -9.611 -2.363
412 HH2 TRP 50 HH2 TRP 50 -9.415 -11.536 -1.540
413 H ILE 51 H ILE 51 -4.861 -3.253 -2.062
414 HA ILE 51 HA ILE 51 -6.062 -1.238 -3.889
415 HB ILE 51 HB ILE 51 -3.508 -1.112 -2.194
416 HG12 ILE 51 2HG1 ILE 51 -5.591 -0.610 -0.939
417 HG13 ILE 51 1HG1 ILE 51 -4.575 0.817 -1.071
418 HG21 ILE 51 1HG2 ILE 51 -4.467 0.918 -4.250
419 HG22 ILE 51 2HG2 ILE 51 -3.009 -0.073 -4.351
420 HG23 ILE 51 3HG2 ILE 51 -3.139 1.173 -3.110
421 HD11 ILE 51 3HD1 ILE 51 -6.038 1.674 -2.847
422 HD12 ILE 51 1HD1 ILE 51 -6.904 1.363 -1.344
423 HD13 ILE 51 2HD1 ILE 51 -7.053 0.235 -2.690
424 H HIS 52 H HIS 52 -5.312 -1.235 -5.990
425 HA HIS 52 HA HIS 52 -3.853 -3.328 -7.124
426 HB2 HIS 52 2HB HIS 52 -5.350 -1.717 -8.349
427 HB3 HIS 52 1HB HIS 52 -4.118 -0.477 -8.174
428 HD1 HIS 52 HD1 HIS 52 -1.924 -0.792 -9.629
429 HD2 HIS 52 HD2 HIS 52 -4.999 -3.448 -10.470
430 HE1 HIS 52 HE1 HIS 52 -1.338 -1.841 -11.830
431 HE2 HIS 52 HE2 HIS 52 -3.313 -3.273 -12.394
432 H ALA 53 H ALA 53 -1.629 -3.670 -7.449
433 HA ALA 53 HA ALA 53 -0.060 -2.847 -5.301
434 HB1 ALA 53 3HB ALA 53 0.157 -5.022 -6.411
435 HB2 ALA 53 1HB ALA 53 1.717 -4.214 -6.244
436 HB3 ALA 53 2HB ALA 53 0.901 -4.245 -7.812
437 H ALA 54 H ALA 54 -0.070 -1.571 -8.601
438 HA ALA 54 HA ALA 54 2.357 -0.082 -8.457
439 HB1 ALA 54 3HB ALA 54 1.549 1.027 -10.509
440 HB2 ALA 54 1HB ALA 54 -0.058 0.345 -10.252
441 HB3 ALA 54 2HB ALA 54 1.306 -0.720 -10.591
442 H HIS 55 H HIS 55 -0.634 0.450 -6.976
443 HA HIS 55 HA HIS 55 -0.167 3.307 -6.453
444 HB2 HIS 55 2HB HIS 55 -2.615 1.551 -5.949
445 HB3 HIS 55 1HB HIS 55 -2.480 3.218 -5.409
446 HD1 HIS 55 HD1 HIS 55 -1.676 4.810 -7.706
447 HD2 HIS 55 HD2 HIS 55 -4.194 1.536 -8.163
448 HE1 HIS 55 HE1 HIS 55 -2.932 5.218 -9.834
449 HE2 HIS 55 HE2 HIS 55 -4.443 3.233 -10.089
450 H VAL 56 H VAL 56 1.307 0.881 -5.234
451 HA VAL 56 HA VAL 56 1.162 1.885 -2.451
452 HB VAL 56 HB VAL 56 1.502 -1.079 -3.150
453 HG11 VAL 56 1HG1 VAL 56 1.434 -1.457 -0.692
454 HG12 VAL 56 2HG1 VAL 56 1.384 0.287 -0.429
455 HG13 VAL 56 3HG1 VAL 56 2.810 -0.454 -1.162
456 HG21 VAL 56 3HG2 VAL 56 -0.662 -1.467 -2.016
457 HG22 VAL 56 1HG2 VAL 56 -0.856 -0.425 -3.429
458 HG23 VAL 56 2HG2 VAL 56 -0.869 0.273 -1.807
459 H LYS 57 H LYS 57 3.131 2.573 -1.801
460 HA LYS 57 HA LYS 57 5.590 1.596 -3.159
461 HB2 LYS 57 2HB LYS 57 5.093 4.280 -1.792
462 HB3 LYS 57 1HB LYS 57 6.612 3.765 -2.528
463 HG2 LYS 57 2HG LYS 57 5.389 3.619 -4.740
464 HG3 LYS 57 1HG LYS 57 3.991 4.356 -3.949
465 HD2 LYS 57 2HD LYS 57 5.287 6.069 -5.141
466 HD3 LYS 57 1HD LYS 57 5.376 6.358 -3.401
467 HE2 LYS 57 2HE LYS 57 7.624 5.308 -3.351
468 HE3 LYS 57 1HE LYS 57 7.518 5.003 -5.088
469 HZ1 LYS 57 3HZ LYS 57 7.405 7.392 -5.445
470 HZ2 LYS 57 1HZ LYS 57 8.818 6.964 -4.625
471 HZ3 LYS 57 2HZ LYS 57 7.533 7.664 -3.789
472 H ALA 58 H ALA 58 7.063 0.561 -1.849
473 HA ALA 58 HA ALA 58 6.546 0.068 0.916
474 HB1 ALA 58 3HB ALA 58 8.695 -1.132 0.913
475 HB2 ALA 58 1HB ALA 58 9.086 -0.451 -0.668
476 HB3 ALA 58 2HB ALA 58 7.730 -1.567 -0.498
477 H ALA 59 H ALA 59 7.005 1.379 2.599
478 HA ALA 59 HA ALA 59 8.642 3.781 2.261
479 HB1 ALA 59 3HB ALA 59 6.991 2.845 4.630
480 HB2 ALA 59 1HB ALA 59 6.473 3.986 3.387
481 HB3 ALA 59 2HB ALA 59 7.786 4.418 4.485
482 H ASP 60 H ASP 60 10.305 4.340 3.819
483 HA ASP 60 HA ASP 60 12.143 2.188 4.340
484 HB2 ASP 60 2HB ASP 60 12.826 4.473 3.514
485 HB3 ASP 60 1HB ASP 60 12.389 5.143 5.079
486 HA PRO 61 HA PRO 61 10.573 1.473 8.623
487 HB2 PRO 61 2HB PRO 61 13.068 -0.222 8.657
488 HB3 PRO 61 1HB PRO 61 11.404 -0.641 9.131
489 HG2 PRO 61 2HG PRO 61 12.370 -1.572 6.840
490 HG3 PRO 61 1HG PRO 61 10.699 -0.958 6.912
491 HD2 PRO 61 2HD PRO 61 13.165 0.426 5.849
492 HD3 PRO 61 1HD PRO 61 11.535 0.328 5.141
493 H GLY 62 H GLY 62 13.640 2.712 7.572
494 HA2 GLY 62 2HA GLY 62 14.928 3.233 10.021
495 HA3 GLY 62 1HA GLY 62 15.220 4.051 8.500
496 H GLY 63 H GLY 63 13.322 4.050 11.429
497 HA2 GLY 63 2HA GLY 63 13.398 6.629 12.170
498 HA3 GLY 63 1HA GLY 63 12.087 6.651 10.996
499 H GLY 64 H GLY 64 11.701 3.673 12.041
500 HA2 GLY 64 2HA GLY 64 10.622 4.030 14.700
501 HA3 GLY 64 1HA GLY 64 9.380 3.938 13.456
502 HA PRO 65 HA PRO 65 9.518 -0.544 13.406
503 HB2 PRO 65 2HB PRO 65 10.019 -0.504 10.430
504 HB3 PRO 65 1HB PRO 65 8.706 -1.278 11.343
505 HG2 PRO 65 2HG PRO 65 8.217 0.930 9.951
506 HG3 PRO 65 1HG PRO 65 7.486 0.702 11.557
507 HD2 PRO 65 2HD PRO 65 9.865 2.394 10.798
508 HD3 PRO 65 1HD PRO 65 8.515 2.771 11.894
509 H SER 66 H SER 66 11.290 -1.440 14.342
510 HA SER 66 HA SER 66 13.988 -1.055 13.572
511 HB2 SER 66 2HB SER 66 13.297 -1.699 15.878
512 HB3 SER 66 1HB SER 66 12.776 -3.279 15.291
513 HG SER 66 HG SER 66 14.839 -3.419 16.156
514 H SER 67 H SER 67 11.823 -3.887 13.176
515 HA SER 67 HA SER 67 12.813 -4.364 10.488
516 HB2 SER 67 2HB SER 67 12.884 -6.603 12.573
517 HB3 SER 67 1HB SER 67 13.249 -6.782 10.855
518 HG SER 67 HG SER 67 14.932 -5.082 11.363
519 H ARG 68 H ARG 68 10.875 -6.129 12.944
520 HA ARG 68 HA ARG 68 8.554 -6.160 11.091
521 HB2 ARG 68 2HB ARG 68 7.988 -8.388 11.990
522 HB3 ARG 68 1HB ARG 68 9.597 -8.385 11.276
523 HG2 ARG 68 2HG ARG 68 10.546 -8.150 13.603
524 HG3 ARG 68 1HG ARG 68 8.911 -8.370 14.234
525 HD2 ARG 68 2HD ARG 68 9.979 -10.496 14.358
526 HD3 ARG 68 1HD ARG 68 8.860 -10.598 12.997
527 HE ARG 68 HE ARG 68 11.429 -9.810 12.074
528 HH11 ARG 68 1HH1 ARG 68 9.775 -12.668 13.294
529 HH12 ARG 68 2HH1 ARG 68 10.830 -13.775 12.478
530 HH21 ARG 68 1HH2 ARG 68 12.856 -11.285 11.079
531 HH22 ARG 68 2HH2 ARG 68 12.575 -12.992 11.226
532 H LEU 69 H LEU 69 6.645 -5.459 11.900
533 HA LEU 69 HA LEU 69 6.579 -4.417 14.649
534 HB2 LEU 69 2HB LEU 69 4.751 -3.927 12.264
535 HB3 LEU 69 1HB LEU 69 4.526 -3.201 13.849
536 HG LEU 69 HG LEU 69 6.882 -2.710 11.977
537 HD11 LEU 69 1HD1 LEU 69 4.830 -1.630 11.205
538 HD12 LEU 69 2HD1 LEU 69 5.999 -0.436 11.759
539 HD13 LEU 69 3HD1 LEU 69 4.615 -0.855 12.777
540 HD21 LEU 69 3HD2 LEU 69 7.606 -1.007 13.614
541 HD22 LEU 69 1HD2 LEU 69 7.647 -2.633 14.288
542 HD23 LEU 69 2HD2 LEU 69 6.338 -1.531 14.725
543 H THR 70 H THR 70 4.122 -5.878 12.513
544 HA THR 70 HA THR 70 2.751 -7.055 14.790
545 HB THR 70 HB THR 70 1.993 -7.242 11.841
546 HG1 THR 70 HG1 THR 70 1.661 -5.133 13.698
547 HG21 THR 70 3HG2 THR 70 0.305 -7.345 14.370
548 HG22 THR 70 1HG2 THR 70 0.706 -8.723 13.338
549 HG23 THR 70 2HG2 THR 70 -0.309 -7.420 12.719
550 H TRP 71 H TRP 71 2.393 -9.289 15.020
551 HA TRP 71 HA TRP 71 4.480 -11.049 13.992
552 HB2 TRP 71 2HB TRP 71 2.229 -11.650 15.967
553 HB3 TRP 71 1HB TRP 71 3.626 -12.672 15.643
554 HD1 TRP 71 HD1 TRP 71 5.850 -12.113 16.940
555 HE1 TRP 71 HE1 TRP 71 6.458 -10.436 18.785
556 HE3 TRP 71 HE3 TRP 71 1.656 -9.178 16.827
557 HZ2 TRP 71 HZ2 TRP 71 5.345 -8.174 20.027
558 HZ3 TRP 71 HZ3 TRP 71 1.507 -7.266 18.379
559 HH2 TRP 71 HH2 TRP 71 3.319 -6.777 19.948
560 H ARG 72 H ARG 72 0.929 -11.329 14.367
561 HA ARG 72 HA ARG 72 0.500 -12.231 11.625
562 HB2 ARG 72 2HB ARG 72 -0.127 -14.002 14.040
563 HB3 ARG 72 1HB ARG 72 -0.794 -14.271 12.434
564 HG2 ARG 72 2HG ARG 72 1.389 -14.749 11.515
565 HG3 ARG 72 1HG ARG 72 2.191 -14.256 13.003
566 HD2 ARG 72 2HD ARG 72 2.204 -16.642 12.907
567 HD3 ARG 72 1HD ARG 72 1.070 -16.152 14.168
568 HE ARG 72 HE ARG 72 -0.355 -16.510 11.765
569 HH11 ARG 72 1HH1 ARG 72 1.366 -18.401 14.161
570 HH12 ARG 72 2HH1 ARG 72 0.439 -19.830 13.874
571 HH21 ARG 72 1HH2 ARG 72 -1.487 -18.445 11.341
572 HH22 ARG 72 2HH2 ARG 72 -1.174 -19.862 12.291
573 H VAL 73 H VAL 73 -1.766 -12.074 11.010
574 HA VAL 73 HA VAL 73 -3.395 -10.414 12.879
575 HB VAL 73 HB VAL 73 -4.295 -9.159 10.939
576 HG11 VAL 73 1HG1 VAL 73 -1.260 -9.058 11.055
577 HG12 VAL 73 2HG1 VAL 73 -2.372 -8.218 12.138
578 HG13 VAL 73 3HG1 VAL 73 -2.319 -7.788 10.428
579 HG21 VAL 73 3HG2 VAL 73 -3.256 -9.350 8.690
580 HG22 VAL 73 1HG2 VAL 73 -4.045 -10.853 9.178
581 HG23 VAL 73 2HG2 VAL 73 -2.287 -10.715 9.259
582 H GLN 74 H GLN 74 -3.378 -13.398 11.276
583 HA GLN 74 HA GLN 74 -6.030 -13.401 10.240
584 HB2 GLN 74 2HB GLN 74 -5.827 -15.693 9.775
585 HB3 GLN 74 1HB GLN 74 -4.214 -15.030 9.553
586 HG2 GLN 74 2HG GLN 74 -3.461 -15.995 11.643
587 HG3 GLN 74 1HG GLN 74 -5.102 -16.496 12.060
588 HE21 GLN 74 1HE2 GLN 74 -5.807 -17.489 9.435
589 HE22 GLN 74 2HE2 GLN 74 -4.897 -18.930 9.190
590 H ARG 75 H ARG 75 -4.793 -13.969 13.435
591 HA ARG 75 HA ARG 75 -6.943 -15.453 14.538
592 HB2 ARG 75 2HB ARG 75 -5.019 -13.560 15.953
593 HB3 ARG 75 1HB ARG 75 -5.992 -14.814 16.722
594 HG2 ARG 75 2HG ARG 75 -3.714 -15.265 14.755
595 HG3 ARG 75 1HG ARG 75 -3.650 -15.514 16.503
596 HD2 ARG 75 2HD ARG 75 -5.375 -17.299 16.293
597 HD3 ARG 75 1HD ARG 75 -5.397 -17.055 14.540
598 HE ARG 75 HE ARG 75 -2.800 -17.666 15.683
599 HH11 ARG 75 1HH1 ARG 75 -5.676 -19.031 14.152
600 HH12 ARG 75 2HH1 ARG 75 -4.865 -20.487 13.671
601 HH21 ARG 75 1HH2 ARG 75 -1.767 -19.567 15.054
602 HH22 ARG 75 2HH2 ARG 75 -2.639 -20.789 14.183
603 H SER 76 H SER 76 -6.597 -12.134 13.670
604 HA SER 76 HA SER 76 -8.680 -11.094 15.415
605 HB2 SER 76 2HB SER 76 -6.621 -9.774 14.970
606 HB3 SER 76 1HB SER 76 -7.016 -9.728 13.254
607 HG SER 76 HG SER 76 -9.097 -8.845 14.772
608 H GLN 77 H GLN 77 -8.373 -12.190 12.045
609 HA GLN 77 HA GLN 77 -11.194 -11.862 11.516
610 HB2 GLN 77 2HB GLN 77 -10.511 -9.532 11.183
611 HB3 GLN 77 1HB GLN 77 -9.238 -10.015 10.068
612 HG2 GLN 77 2HG GLN 77 -11.147 -9.068 8.860
613 HG3 GLN 77 1HG GLN 77 -10.930 -10.766 8.443
614 HE21 GLN 77 1HE2 GLN 77 -13.042 -11.047 7.771
615 HE22 GLN 77 2HE2 GLN 77 -14.396 -11.039 8.839
616 H ASN 78 H ASN 78 -7.986 -12.605 10.303
617 HA ASN 78 HA ASN 78 -7.141 -14.159 8.937
618 HB2 ASN 78 2HB ASN 78 -8.779 -15.798 9.815
619 HB3 ASN 78 1HB ASN 78 -9.941 -15.285 8.601
620 HD21 ASN 78 1HD2 ASN 78 -9.609 -15.908 6.416
621 HD22 ASN 78 2HD2 ASN 78 -8.497 -17.158 5.980
622 HA PRO 79 HA PRO 79 -8.003 -11.921 5.008
623 HB2 PRO 79 2HB PRO 79 -5.454 -11.184 4.489
624 HB3 PRO 79 1HB PRO 79 -6.419 -10.303 5.696
625 HG2 PRO 79 2HG PRO 79 -4.338 -12.433 6.152
626 HG3 PRO 79 1HG PRO 79 -4.548 -10.872 6.983
627 HD2 PRO 79 2HD PRO 79 -5.500 -13.253 8.002
628 HD3 PRO 79 1HD PRO 79 -6.227 -11.677 8.368
629 H LEU 80 H LEU 80 -6.619 -14.743 6.050
630 HA LEU 80 HA LEU 80 -5.145 -15.540 3.688
631 HB2 LEU 80 2HB LEU 80 -5.801 -17.027 6.259
632 HB3 LEU 80 1HB LEU 80 -4.688 -17.582 5.022
633 HG LEU 80 HG LEU 80 -4.321 -15.245 6.928
634 HD11 LEU 80 1HD1 LEU 80 -2.359 -16.500 7.668
635 HD12 LEU 80 2HD1 LEU 80 -2.696 -17.766 6.484
636 HD13 LEU 80 3HD1 LEU 80 -3.821 -17.471 7.812
637 HD21 LEU 80 3HD2 LEU 80 -2.154 -14.780 5.819
638 HD22 LEU 80 1HD2 LEU 80 -3.516 -14.483 4.741
639 HD23 LEU 80 2HD2 LEU 80 -2.549 -15.949 4.553
640 H LYS 81 H LYS 81 -8.301 -15.282 3.926
641 HA LYS 81 HA LYS 81 -9.345 -17.882 3.408
642 HB2 LYS 81 2HB LYS 81 -11.419 -16.633 2.697
643 HB3 LYS 81 1HB LYS 81 -10.832 -16.243 4.312
644 HG2 LYS 81 2HG LYS 81 -9.796 -14.161 3.406
645 HG3 LYS 81 1HG LYS 81 -10.472 -14.538 1.816
646 HD2 LYS 81 2HD LYS 81 -12.107 -14.085 4.351
647 HD3 LYS 81 1HD LYS 81 -11.824 -12.873 3.098
648 HE2 LYS 81 2HE LYS 81 -13.254 -15.523 2.642
649 HE3 LYS 81 1HE LYS 81 -14.051 -13.972 2.895
650 HZ1 LYS 81 3HZ LYS 81 -13.913 -14.524 0.553
651 HZ2 LYS 81 1HZ LYS 81 -12.227 -14.609 0.641
652 HZ3 LYS 81 2HZ LYS 81 -13.011 -13.138 0.889
653 H ILE 82 H ILE 82 -7.575 -15.765 1.408
654 HA ILE 82 HA ILE 82 -8.494 -16.921 -1.114
655 HB ILE 82 HB ILE 82 -6.693 -15.609 -2.179
656 HG12 ILE 82 2HG1 ILE 82 -5.906 -14.657 0.626
657 HG13 ILE 82 1HG1 ILE 82 -4.990 -15.815 -0.331
658 HG21 ILE 82 1HG2 ILE 82 -8.843 -14.502 -1.756
659 HG22 ILE 82 2HG2 ILE 82 -7.516 -13.345 -1.655
660 HG23 ILE 82 3HG2 ILE 82 -8.268 -13.952 -0.178
661 HD11 ILE 82 3HD1 ILE 82 -3.972 -13.647 -0.465
662 HD12 ILE 82 1HD1 ILE 82 -5.476 -12.921 -1.031
663 HD13 ILE 82 2HD1 ILE 82 -4.621 -14.090 -2.043
664 H ARG 83 H ARG 83 -6.282 -17.553 -2.524
665 HA ARG 83 HA ARG 83 -5.556 -20.130 -1.688
666 HB2 ARG 83 2HB ARG 83 -5.531 -19.355 -4.057
667 HB3 ARG 83 1HB ARG 83 -4.134 -18.343 -3.705
668 HG2 ARG 83 2HG ARG 83 -2.806 -20.371 -3.177
669 HG3 ARG 83 1HG ARG 83 -4.207 -21.379 -3.544
670 HD2 ARG 83 2HD ARG 83 -4.163 -20.479 -5.885
671 HD3 ARG 83 1HD ARG 83 -2.688 -19.597 -5.474
672 HE ARG 83 HE ARG 83 -2.481 -22.414 -4.929
673 HH11 ARG 83 1HH1 ARG 83 -2.223 -20.029 -7.488
674 HH12 ARG 83 2HH1 ARG 83 -1.169 -20.996 -8.464
675 HH21 ARG 83 1HH2 ARG 83 -1.129 -23.714 -6.226
676 HH22 ARG 83 2HH2 ARG 83 -0.549 -23.106 -7.742
677 H LEU 84 H LEU 84 -3.891 -17.032 -1.330
678 HA LEU 84 HA LEU 84 -1.469 -18.208 -0.237
679 HB2 LEU 84 2HB LEU 84 -2.286 -15.278 -0.430
680 HB3 LEU 84 1HB LEU 84 -0.680 -15.883 -0.039
681 HG LEU 84 HG LEU 84 -2.108 -16.199 -2.718
682 HD11 LEU 84 1HD1 LEU 84 0.307 -14.524 -1.994
683 HD12 LEU 84 2HD1 LEU 84 -1.310 -13.935 -2.394
684 HD13 LEU 84 3HD1 LEU 84 -0.347 -14.754 -3.621
685 HD21 LEU 84 3HD2 LEU 84 0.640 -17.192 -1.893
686 HD22 LEU 84 1HD2 LEU 84 -0.002 -17.200 -3.541
687 HD23 LEU 84 2HD2 LEU 84 -0.768 -18.178 -2.296
688 H THR 85 H THR 85 -2.187 -19.297 1.529
689 HA THR 85 HA THR 85 -3.315 -17.808 3.808
690 HB THR 85 HB THR 85 -4.910 -19.443 2.979
691 HG1 THR 85 HG1 THR 85 -5.260 -19.568 5.039
692 HG21 THR 85 3HG2 THR 85 -2.803 -21.603 3.365
693 HG22 THR 85 1HG2 THR 85 -3.400 -21.011 1.810
694 HG23 THR 85 2HG2 THR 85 -4.487 -21.867 2.907
695 H ARG 86 H ARG 86 -0.958 -17.225 3.978
696 HA ARG 86 HA ARG 86 0.494 -18.998 5.821
697 HB2 ARG 86 2HB ARG 86 1.632 -18.010 3.166
698 HB3 ARG 86 1HB ARG 86 2.643 -18.616 4.471
699 HG2 ARG 86 2HG ARG 86 1.750 -20.837 4.251
700 HG3 ARG 86 1HG ARG 86 0.486 -20.289 3.144
701 HD2 ARG 86 2HD ARG 86 3.466 -20.172 2.562
702 HD3 ARG 86 1HD ARG 86 2.376 -21.444 1.988
703 HE ARG 86 HE ARG 86 1.118 -19.322 1.031
704 HH11 ARG 86 1HH1 ARG 86 4.564 -20.019 0.921
705 HH12 ARG 86 2HH1 ARG 86 4.823 -19.137 -0.547
706 HH21 ARG 86 1HH2 ARG 86 1.459 -18.201 -0.909
707 HH22 ARG 86 2HH2 ARG 86 3.047 -18.103 -1.588
708 H GLU 87 H GLU 87 1.445 -17.826 7.422
709 HA GLU 87 HA GLU 87 2.177 -14.995 6.973
710 HB2 GLU 87 2HB GLU 87 0.861 -16.121 9.484
711 HB3 GLU 87 1HB GLU 87 1.495 -14.487 9.322
712 HG2 GLU 87 2HG GLU 87 -0.203 -13.966 7.631
713 HG3 GLU 87 1HG GLU 87 -0.799 -15.624 7.691
714 H ALA 88 H ALA 88 2.483 -17.198 9.796
715 HA ALA 88 HA ALA 88 5.329 -17.537 9.644
716 HB1 ALA 88 3HB ALA 88 5.262 -15.108 10.180
717 HB2 ALA 88 1HB ALA 88 5.931 -16.025 11.532
718 HB3 ALA 88 2HB ALA 88 4.266 -15.438 11.599
719 HA PRO 89 HA PRO 89 4.275 -20.414 13.089
720 HB2 PRO 89 2HB PRO 89 6.889 -19.815 14.402
721 HB3 PRO 89 1HB PRO 89 6.268 -21.357 13.775
722 HG2 PRO 89 2HG PRO 89 8.236 -20.054 12.524
723 HG3 PRO 89 1HG PRO 89 6.986 -20.931 11.612
724 HD2 PRO 89 2HD PRO 89 7.186 -17.962 12.144
725 HD3 PRO 89 1HD PRO 89 6.807 -18.814 10.627
Start of MODEL 13
1 H1 HIS 1 1H HIS 1 -13.696 -18.829 5.248
2 H2 HIS 1 2H HIS 1 -14.845 -17.617 4.985
3 H3 HIS 1 3H HIS 1 -13.873 -17.580 6.372
4 HA HIS 1 HA HIS 1 -12.931 -17.298 3.586
5 HB2 HIS 1 2HB HIS 1 -13.044 -15.194 5.798
6 HB3 HIS 1 1HB HIS 1 -12.455 -14.939 4.161
7 HD1 HIS 1 HD1 HIS 1 -14.307 -14.964 2.236
8 HD2 HIS 1 HD2 HIS 1 -15.794 -14.860 6.124
9 HE1 HIS 1 HE1 HIS 1 -16.717 -14.280 2.029
10 HE2 HIS 1 HE2 HIS 1 -17.602 -14.270 4.380
11 H HIS 2 H HIS 2 -11.325 -18.849 3.810
12 HA HIS 2 HA HIS 2 -8.981 -18.163 5.453
13 HB2 HIS 2 2HB HIS 2 -10.474 -20.829 5.598
14 HB3 HIS 2 1HB HIS 2 -8.794 -20.669 6.092
15 HD1 HIS 2 HD1 HIS 2 -12.101 -20.586 7.483
16 HD2 HIS 2 HD2 HIS 2 -8.547 -18.565 8.242
17 HE1 HIS 2 HE1 HIS 2 -12.337 -19.649 9.806
18 HE2 HIS 2 HE2 HIS 2 -10.090 -18.639 10.305
19 H HIS 3 H HIS 3 -7.398 -18.001 3.969
20 HA HIS 3 HA HIS 3 -6.714 -20.232 2.265
21 HB2 HIS 3 2HB HIS 3 -6.694 -18.922 0.128
22 HB3 HIS 3 1HB HIS 3 -8.316 -19.176 0.757
23 HD1 HIS 3 HD1 HIS 3 -9.665 -17.090 1.439
24 HD2 HIS 3 HD2 HIS 3 -5.811 -16.206 0.168
25 HE1 HIS 3 HE1 HIS 3 -9.584 -14.596 1.158
26 HE2 HIS 3 HE2 HIS 3 -7.309 -14.127 0.232
27 H HIS 4 H HIS 4 -5.295 -19.453 4.332
28 HA HIS 4 HA HIS 4 -3.279 -17.470 3.860
29 HB2 HIS 4 2HB HIS 4 -3.490 -19.753 5.862
30 HB3 HIS 4 1HB HIS 4 -2.067 -18.724 5.785
31 HD1 HIS 4 HD1 HIS 4 -2.148 -17.170 7.701
32 HD2 HIS 4 HD2 HIS 4 -5.932 -17.745 6.068
33 HE1 HIS 4 HE1 HIS 4 -3.691 -15.697 9.032
34 HE2 HIS 4 HE2 HIS 4 -5.983 -16.181 8.120
35 H HIS 5 H HIS 5 -2.602 -18.032 1.688
36 HA HIS 5 HA HIS 5 -1.253 -20.520 1.108
37 HB2 HIS 5 2HB HIS 5 -1.464 -17.919 -0.479
38 HB3 HIS 5 1HB HIS 5 -0.630 -19.350 -1.067
39 HD1 HIS 5 HD1 HIS 5 -2.483 -18.818 -3.013
40 HD2 HIS 5 HD2 HIS 5 -3.877 -20.506 0.520
41 HE1 HIS 5 HE1 HIS 5 -4.698 -19.851 -3.585
42 HE2 HIS 5 HE2 HIS 5 -5.372 -21.078 -1.503
43 H HIS 6 H HIS 6 0.185 -17.307 0.475
44 HA HIS 6 HA HIS 6 2.072 -17.372 2.603
45 HB2 HIS 6 2HB HIS 6 3.001 -19.126 0.909
46 HB3 HIS 6 1HB HIS 6 3.364 -17.760 -0.140
47 HD1 HIS 6 HD1 HIS 6 5.648 -16.777 0.217
48 HD2 HIS 6 HD2 HIS 6 4.278 -18.815 3.569
49 HE1 HIS 6 HE1 HIS 6 7.549 -16.746 1.851
50 HE2 HIS 6 HE2 HIS 6 6.784 -18.225 3.736
51 H SER 7 H SER 7 3.103 -15.384 2.827
52 HA SER 7 HA SER 7 2.893 -13.330 0.755
53 HB2 SER 7 2HB SER 7 1.484 -13.106 3.459
54 HB3 SER 7 1HB SER 7 1.753 -11.742 2.373
55 HG SER 7 HG SER 7 0.655 -13.459 0.833
56 H HIS 8 H HIS 8 3.660 -11.144 1.941
57 HA HIS 8 HA HIS 8 6.278 -11.598 3.152
58 HB2 HIS 8 2HB HIS 8 5.897 -9.864 1.353
59 HB3 HIS 8 1HB HIS 8 4.852 -8.977 2.452
60 HD1 HIS 8 HD1 HIS 8 6.033 -7.048 3.452
61 HD2 HIS 8 HD2 HIS 8 8.652 -10.179 2.677
62 HE1 HIS 8 HE1 HIS 8 8.294 -6.230 4.160
63 HE2 HIS 8 HE2 HIS 8 9.848 -8.161 3.743
64 H MET 9 H MET 9 6.845 -10.425 5.190
65 HA MET 9 HA MET 9 5.254 -11.034 7.360
66 HB2 MET 9 2HB MET 9 6.765 -9.612 8.723
67 HB3 MET 9 1HB MET 9 7.660 -10.620 7.599
68 HG2 MET 9 2HG MET 9 7.976 -8.682 6.107
69 HG3 MET 9 1HG MET 9 7.082 -7.673 7.247
70 HE1 MET 9 3HE MET 9 10.008 -6.931 6.183
71 HE2 MET 9 1HE MET 9 10.794 -6.422 7.678
72 HE3 MET 9 2HE MET 9 9.134 -5.929 7.343
73 H VAL 10 H VAL 10 3.623 -10.079 8.472
74 HA VAL 10 HA VAL 10 2.160 -7.950 7.259
75 HB VAL 10 HB VAL 10 0.522 -8.166 9.050
76 HG11 VAL 10 1HG1 VAL 10 0.434 -9.841 7.271
77 HG12 VAL 10 2HG1 VAL 10 -0.112 -10.527 8.799
78 HG13 VAL 10 3HG1 VAL 10 1.499 -10.908 8.191
79 HG21 VAL 10 3HG2 VAL 10 2.443 -10.027 10.500
80 HG22 VAL 10 1HG2 VAL 10 0.779 -9.679 10.979
81 HG23 VAL 10 2HG2 VAL 10 1.993 -8.401 11.013
82 H GLY 11 H GLY 11 1.896 -5.838 7.897
83 HA2 GLY 11 2HA GLY 11 2.305 -3.932 9.264
84 HA3 GLY 11 1HA GLY 11 3.644 -4.766 10.037
85 H ASP 12 H ASP 12 3.608 -5.177 6.633
86 HA ASP 12 HA ASP 12 6.140 -4.013 6.237
87 HB2 ASP 12 2HB ASP 12 5.097 -5.757 4.755
88 HB3 ASP 12 1HB ASP 12 3.992 -4.544 4.128
89 H THR 13 H THR 13 6.620 -1.865 6.390
90 HA THR 13 HA THR 13 4.575 0.139 6.372
91 HB THR 13 HB THR 13 7.606 0.463 6.488
92 HG1 THR 13 HG1 THR 13 5.593 0.130 8.466
93 HG21 THR 13 3HG2 THR 13 6.491 2.582 5.853
94 HG22 THR 13 1HG2 THR 13 7.136 2.670 7.495
95 HG23 THR 13 2HG2 THR 13 5.407 2.427 7.238
96 H VAL 14 H VAL 14 3.711 0.831 4.563
97 HA VAL 14 HA VAL 14 5.345 1.541 2.204
98 HB VAL 14 HB VAL 14 3.557 0.744 0.701
99 HG11 VAL 14 1HG1 VAL 14 4.502 -1.477 2.547
100 HG12 VAL 14 2HG1 VAL 14 5.390 -0.813 1.174
101 HG13 VAL 14 3HG1 VAL 14 3.883 -1.689 0.903
102 HG21 VAL 14 3HG2 VAL 14 2.172 -0.344 3.188
103 HG22 VAL 14 1HG2 VAL 14 1.658 -0.619 1.517
104 HG23 VAL 14 2HG2 VAL 14 1.617 1.008 2.197
105 H TRP 15 H TRP 15 3.648 2.729 0.657
106 HA TRP 15 HA TRP 15 2.021 4.707 2.145
107 HB2 TRP 15 2HB TRP 15 3.742 5.137 -0.359
108 HB3 TRP 15 1HB TRP 15 2.625 6.327 0.304
109 HD1 TRP 15 HD1 TRP 15 3.586 5.875 3.428
110 HE1 TRP 15 HE1 TRP 15 5.810 6.935 4.144
111 HE3 TRP 15 HE3 TRP 15 5.756 6.427 -1.170
112 HZ2 TRP 15 HZ2 TRP 15 8.166 7.881 2.947
113 HZ3 TRP 15 HZ3 TRP 15 8.004 7.422 -1.295
114 HH2 TRP 15 HH2 TRP 15 9.183 8.134 0.725
115 H VAL 16 H VAL 16 0.121 5.376 0.961
116 HA VAL 16 HA VAL 16 -0.636 3.640 -1.319
117 HB VAL 16 HB VAL 16 -2.442 5.066 0.697
118 HG11 VAL 16 1HG1 VAL 16 -4.392 4.229 -0.605
119 HG12 VAL 16 2HG1 VAL 16 -3.301 3.648 -1.864
120 HG13 VAL 16 3HG1 VAL 16 -3.436 5.378 -1.547
121 HG21 VAL 16 3HG2 VAL 16 -3.286 2.784 1.145
122 HG22 VAL 16 1HG2 VAL 16 -1.543 2.877 1.411
123 HG23 VAL 16 2HG2 VAL 16 -2.173 2.128 -0.058
124 H ARG 17 H ARG 17 -0.298 4.604 -3.171
125 HA ARG 17 HA ARG 17 -0.174 7.445 -3.589
126 HB2 ARG 17 2HB ARG 17 1.263 5.989 -4.905
127 HB3 ARG 17 1HB ARG 17 -0.107 5.046 -5.476
128 HG2 ARG 17 2HG ARG 17 -0.927 7.088 -6.698
129 HG3 ARG 17 1HG ARG 17 0.549 7.921 -6.217
130 HD2 ARG 17 2HD ARG 17 0.448 5.381 -7.880
131 HD3 ARG 17 1HD ARG 17 0.623 7.010 -8.538
132 HE ARG 17 HE ARG 17 2.733 7.114 -7.137
133 HH11 ARG 17 1HH1 ARG 17 1.565 4.072 -8.479
134 HH12 ARG 17 2HH1 ARG 17 3.145 3.356 -8.547
135 HH21 ARG 17 1HH2 ARG 17 4.784 6.175 -7.251
136 HH22 ARG 17 2HH2 ARG 17 4.979 4.555 -7.844
137 H ARG 18 H ARG 18 -1.940 8.695 -3.839
138 HA ARG 18 HA ARG 18 -4.055 7.814 -5.692
139 HB2 ARG 18 2HB ARG 18 -4.978 7.630 -3.377
140 HB3 ARG 18 1HB ARG 18 -4.621 9.332 -3.093
141 HG2 ARG 18 2HG ARG 18 -6.256 10.026 -4.750
142 HG3 ARG 18 1HG ARG 18 -6.474 8.365 -5.311
143 HD2 ARG 18 2HD ARG 18 -7.266 9.454 -2.586
144 HD3 ARG 18 1HD ARG 18 -8.367 9.043 -3.910
145 HE ARG 18 HE ARG 18 -6.884 6.766 -3.417
146 HH11 ARG 18 1HH1 ARG 18 -9.141 8.706 -1.529
147 HH12 ARG 18 2HH1 ARG 18 -9.653 7.360 -0.554
148 HH21 ARG 18 1HH2 ARG 18 -7.540 5.022 -2.120
149 HH22 ARG 18 2HH2 ARG 18 -8.744 5.276 -0.893
150 H HIS 19 H HIS 19 -4.719 9.386 -7.088
151 HA HIS 19 HA HIS 19 -2.946 11.447 -7.760
152 HB2 HIS 19 2HB HIS 19 -5.795 10.842 -8.626
153 HB3 HIS 19 1HB HIS 19 -4.951 12.254 -9.250
154 HD1 HIS 19 HD1 HIS 19 -4.467 11.632 -11.608
155 HD2 HIS 19 HD2 HIS 19 -3.490 8.568 -8.969
156 HE1 HIS 19 HE1 HIS 19 -3.343 9.863 -12.996
157 HE2 HIS 19 HE2 HIS 19 -2.684 8.070 -11.362
158 H GLN 20 H GLN 20 -6.012 11.567 -5.972
159 HA GLN 20 HA GLN 20 -7.167 13.139 -4.841
160 HB2 GLN 20 2HB GLN 20 -4.496 14.613 -4.701
161 HB3 GLN 20 1HB GLN 20 -5.938 15.099 -3.819
162 HG2 GLN 20 2HG GLN 20 -4.492 12.455 -3.461
163 HG3 GLN 20 1HG GLN 20 -4.311 13.858 -2.416
164 HE21 GLN 20 1HE2 GLN 20 -7.156 14.569 -2.423
165 HE22 GLN 20 2HE2 GLN 20 -7.946 13.371 -1.462
166 H THR 21 H THR 21 -4.942 15.254 -6.624
167 HA THR 21 HA THR 21 -7.014 16.674 -8.056
168 HB THR 21 HB THR 21 -4.965 17.744 -9.178
169 HG1 THR 21 HG1 THR 21 -2.974 17.179 -7.808
170 HG21 THR 21 3HG2 THR 21 -5.960 18.796 -7.155
171 HG22 THR 21 1HG2 THR 21 -4.206 18.983 -7.181
172 HG23 THR 21 2HG2 THR 21 -4.946 17.776 -6.129
173 H LYS 22 H LYS 22 -7.512 16.397 -10.249
174 HA LYS 22 HA LYS 22 -7.644 13.715 -11.106
175 HB2 LYS 22 2HB LYS 22 -8.238 16.241 -12.712
176 HB3 LYS 22 1HB LYS 22 -8.816 14.620 -13.097
177 HG2 LYS 22 2HG LYS 22 -10.201 14.581 -11.086
178 HG3 LYS 22 1HG LYS 22 -9.550 16.141 -10.568
179 HD2 LYS 22 2HD LYS 22 -10.517 17.165 -12.663
180 HD3 LYS 22 1HD LYS 22 -11.277 15.613 -13.025
181 HE2 LYS 22 2HE LYS 22 -11.806 17.278 -10.536
182 HE3 LYS 22 1HE LYS 22 -12.833 17.232 -11.968
183 HZ1 LYS 22 3HZ LYS 22 -13.283 14.929 -11.582
184 HZ2 LYS 22 1HZ LYS 22 -13.617 15.790 -10.164
185 HZ3 LYS 22 2HZ LYS 22 -12.200 14.871 -10.290
186 H ASN 23 H ASN 23 -5.820 16.453 -12.465
187 HA ASN 23 HA ASN 23 -4.556 14.696 -14.491
188 HB2 ASN 23 2HB ASN 23 -5.181 17.682 -14.540
189 HB3 ASN 23 1HB ASN 23 -4.194 16.876 -15.763
190 HD21 ASN 23 1HD2 ASN 23 -5.195 15.518 -17.267
191 HD22 ASN 23 2HD2 ASN 23 -6.911 15.445 -17.458
192 H LEU 24 H LEU 24 -3.836 16.562 -11.703
193 HA LEU 24 HA LEU 24 -1.076 17.146 -12.429
194 HB2 LEU 24 2HB LEU 24 -2.402 17.342 -9.704
195 HB3 LEU 24 1HB LEU 24 -0.838 18.001 -10.144
196 HG LEU 24 HG LEU 24 -3.551 18.952 -11.135
197 HD11 LEU 24 1HD1 LEU 24 -3.024 21.031 -9.960
198 HD12 LEU 24 2HD1 LEU 24 -1.496 20.350 -9.397
199 HD13 LEU 24 3HD1 LEU 24 -3.025 19.657 -8.852
200 HD21 LEU 24 3HD2 LEU 24 -2.355 20.721 -12.363
201 HD22 LEU 24 1HD2 LEU 24 -1.961 19.114 -12.977
202 HD23 LEU 24 2HD2 LEU 24 -0.809 19.971 -11.950
203 H GLU 25 H GLU 25 0.614 16.487 -10.650
204 HA GLU 25 HA GLU 25 1.246 13.819 -11.155
205 HB2 GLU 25 2HB GLU 25 2.308 15.608 -8.930
206 HB3 GLU 25 1HB GLU 25 3.082 14.131 -9.501
207 HG2 GLU 25 2HG GLU 25 3.546 15.127 -11.661
208 HG3 GLU 25 1HG GLU 25 2.592 16.555 -11.258
209 HA PRO 26 HA PRO 26 -1.307 11.567 -8.112
210 HB2 PRO 26 2HB PRO 26 0.814 9.459 -8.525
211 HB3 PRO 26 1HB PRO 26 -0.955 9.314 -8.624
212 HG2 PRO 26 2HG PRO 26 0.491 9.358 -10.848
213 HG3 PRO 26 1HG PRO 26 -1.054 10.232 -10.771
214 HD2 PRO 26 2HD PRO 26 1.743 11.328 -10.594
215 HD3 PRO 26 1HD PRO 26 0.319 11.988 -11.435
216 H ARG 27 H ARG 27 -1.230 11.786 -5.993
217 HA ARG 27 HA ARG 27 1.302 12.347 -4.597
218 HB2 ARG 27 2HB ARG 27 -0.687 13.928 -4.597
219 HB3 ARG 27 1HB ARG 27 -1.596 12.722 -3.700
220 HG2 ARG 27 2HG ARG 27 -0.165 12.986 -1.767
221 HG3 ARG 27 1HG ARG 27 0.960 14.003 -2.675
222 HD2 ARG 27 2HD ARG 27 -1.917 14.700 -1.994
223 HD3 ARG 27 1HD ARG 27 -0.475 15.385 -1.238
224 HE ARG 27 HE ARG 27 -1.263 15.776 -4.073
225 HH11 ARG 27 1HH1 ARG 27 0.362 17.018 -1.183
226 HH12 ARG 27 2HH1 ARG 27 0.754 18.536 -1.936
227 HH21 ARG 27 1HH2 ARG 27 -0.699 17.737 -5.036
228 HH22 ARG 27 2HH2 ARG 27 0.153 18.935 -4.110
229 H TRP 28 H TRP 28 1.084 11.513 -2.111
230 HA TRP 28 HA TRP 28 -0.204 8.894 -1.862
231 HB2 TRP 28 2HB TRP 28 1.935 7.873 -0.933
232 HB3 TRP 28 1HB TRP 28 1.977 8.191 -2.664
233 HD1 TRP 28 HD1 TRP 28 3.784 9.873 -3.558
234 HE1 TRP 28 HE1 TRP 28 5.796 11.061 -2.498
235 HE3 TRP 28 HE3 TRP 28 2.735 9.024 1.378
236 HZ2 TRP 28 HZ2 TRP 28 6.802 11.589 0.072
237 HZ3 TRP 28 HZ3 TRP 28 4.272 9.915 3.083
238 HH2 TRP 28 HH2 TRP 28 6.267 11.173 2.437
239 H LYS 29 H LYS 29 -0.258 8.129 0.360
240 HA LYS 29 HA LYS 29 0.491 10.076 2.471
241 HB2 LYS 29 2HB LYS 29 -2.011 8.329 2.602
242 HB3 LYS 29 1HB LYS 29 -1.500 9.540 3.771
243 HG2 LYS 29 2HG LYS 29 -1.850 11.282 1.948
244 HG3 LYS 29 1HG LYS 29 -2.597 10.009 0.984
245 HD2 LYS 29 2HD LYS 29 -3.574 11.221 3.587
246 HD3 LYS 29 1HD LYS 29 -4.394 11.176 2.028
247 HE2 LYS 29 2HE LYS 29 -3.921 8.822 3.894
248 HE3 LYS 29 1HE LYS 29 -5.456 9.613 3.556
249 HZ1 LYS 29 3HZ LYS 29 -5.160 7.505 2.364
250 HZ2 LYS 29 1HZ LYS 29 -3.848 8.163 1.525
251 HZ3 LYS 29 2HZ LYS 29 -5.391 8.812 1.323
252 H GLY 30 H GLY 30 0.871 8.997 4.587
253 HA2 GLY 30 2HA GLY 30 1.040 6.168 4.873
254 HA3 GLY 30 1HA GLY 30 2.611 6.829 4.480
255 HA PRO 31 HA PRO 31 3.240 5.182 5.866
256 HB2 PRO 31 2HB PRO 31 4.136 3.880 8.080
257 HB3 PRO 31 1HB PRO 31 4.950 5.321 7.437
258 HG2 PRO 31 2HG PRO 31 3.220 5.063 9.842
259 HG3 PRO 31 1HG PRO 31 4.583 6.158 9.537
260 HD2 PRO 31 2HD PRO 31 1.815 6.800 9.309
261 HD3 PRO 31 1HD PRO 31 3.183 7.805 8.793
262 H TYR 32 H TYR 32 1.736 3.868 5.039
263 HA TYR 32 HA TYR 32 -0.260 2.426 6.580
264 HB2 TYR 32 2HB TYR 32 0.587 2.389 3.657
265 HB3 TYR 32 1HB TYR 32 -0.613 1.271 4.291
266 HD1 TYR 32 HD2 TYR 32 0.049 4.824 3.454
267 HD2 TYR 32 HD1 TYR 32 -2.844 2.034 4.907
268 HE1 TYR 32 HE2 TYR 32 -1.736 6.479 3.105
269 HE2 TYR 32 HE1 TYR 32 -4.621 3.684 4.561
270 HH TYR 32 HH TYR 32 -4.898 6.068 4.352
271 H THR 33 H THR 33 -0.370 -0.057 6.206
272 HA THR 33 HA THR 33 2.273 -1.368 6.375
273 HB THR 33 HB THR 33 1.378 -2.657 8.427
274 HG1 THR 33 HG1 THR 33 -0.416 -0.451 8.599
275 HG21 THR 33 3HG2 THR 33 3.113 -0.917 8.718
276 HG22 THR 33 1HG2 THR 33 1.990 -0.932 10.082
277 HG23 THR 33 2HG2 THR 33 1.858 0.317 8.842
278 H VAL 34 H VAL 34 2.122 -2.850 4.715
279 HA VAL 34 HA VAL 34 -0.308 -4.127 3.910
280 HB VAL 34 HB VAL 34 2.567 -4.868 3.157
281 HG11 VAL 34 1HG1 VAL 34 -0.045 -5.700 1.832
282 HG12 VAL 34 2HG1 VAL 34 1.041 -6.749 2.746
283 HG13 VAL 34 3HG1 VAL 34 1.575 -6.046 1.220
284 HG21 VAL 34 3HG2 VAL 34 2.164 -3.635 1.063
285 HG22 VAL 34 1HG2 VAL 34 2.019 -2.578 2.469
286 HG23 VAL 34 2HG2 VAL 34 0.568 -3.151 1.643
287 H LEU 35 H LEU 35 -1.187 -5.914 4.666
288 HA LEU 35 HA LEU 35 0.220 -7.658 6.571
289 HB2 LEU 35 2HB LEU 35 -2.722 -7.704 5.782
290 HB3 LEU 35 1HB LEU 35 -1.977 -8.540 7.135
291 HG LEU 35 HG LEU 35 -2.434 -5.545 6.860
292 HD11 LEU 35 1HD1 LEU 35 -3.895 -5.808 8.811
293 HD12 LEU 35 2HD1 LEU 35 -3.592 -7.548 8.823
294 HD13 LEU 35 3HD1 LEU 35 -4.434 -6.806 7.461
295 HD21 LEU 35 3HD2 LEU 35 -1.471 -5.267 9.100
296 HD22 LEU 35 1HD2 LEU 35 -0.274 -5.865 7.951
297 HD23 LEU 35 2HD2 LEU 35 -0.998 -6.969 9.123
298 H LEU 36 H LEU 36 -1.787 -7.848 3.599
299 HA LEU 36 HA LEU 36 -0.799 -10.620 3.094
300 HB2 LEU 36 2HB LEU 36 -3.271 -10.346 3.507
301 HB3 LEU 36 1HB LEU 36 -3.358 -9.280 2.123
302 HG LEU 36 HG LEU 36 -2.549 -11.275 0.699
303 HD11 LEU 36 1HD1 LEU 36 -2.922 -13.521 1.577
304 HD12 LEU 36 2HD1 LEU 36 -3.295 -12.859 3.169
305 HD13 LEU 36 3HD1 LEU 36 -1.674 -12.678 2.498
306 HD21 LEU 36 3HD2 LEU 36 -5.270 -11.476 2.028
307 HD22 LEU 36 1HD2 LEU 36 -4.802 -12.231 0.500
308 HD23 LEU 36 2HD2 LEU 36 -4.860 -10.476 0.633
309 H THR 37 H THR 37 0.110 -11.074 1.098
310 HA THR 37 HA THR 37 0.247 -8.932 -0.950
311 HB THR 37 HB THR 37 2.585 -9.534 -1.482
312 HG1 THR 37 HG1 THR 37 2.567 -11.698 -0.745
313 HG21 THR 37 3HG2 THR 37 2.299 -8.907 1.475
314 HG22 THR 37 1HG2 THR 37 2.264 -7.724 0.162
315 HG23 THR 37 2HG2 THR 37 3.740 -8.632 0.494
316 H THR 38 H THR 38 -0.301 -9.597 -2.914
317 HA THR 38 HA THR 38 -0.132 -12.378 -3.820
318 HB THR 38 HB THR 38 -2.563 -12.159 -4.727
319 HG1 THR 38 HG1 THR 38 -2.438 -9.945 -2.996
320 HG21 THR 38 3HG2 THR 38 -2.083 -13.715 -2.872
321 HG22 THR 38 1HG2 THR 38 -3.646 -12.933 -2.642
322 HG23 THR 38 2HG2 THR 38 -2.248 -12.397 -1.708
323 HA PRO 39 HA PRO 39 1.036 -10.714 -7.888
324 HB2 PRO 39 2HB PRO 39 -1.534 -12.001 -8.878
325 HB3 PRO 39 1HB PRO 39 0.079 -12.007 -9.629
326 HG2 PRO 39 2HG PRO 39 -0.723 -14.132 -8.283
327 HG3 PRO 39 1HG PRO 39 0.944 -13.543 -8.088
328 HD2 PRO 39 2HD PRO 39 -1.356 -13.328 -6.183
329 HD3 PRO 39 1HD PRO 39 0.384 -13.455 -5.846
330 H THR 40 H THR 40 0.860 -8.524 -7.859
331 HA THR 40 HA THR 40 0.229 -6.442 -8.441
332 HB THR 40 HB THR 40 -2.111 -7.679 -9.967
333 HG1 THR 40 HG1 THR 40 0.126 -7.195 -11.455
334 HG21 THR 40 3HG2 THR 40 -2.107 -5.174 -9.913
335 HG22 THR 40 1HG2 THR 40 -1.791 -5.799 -11.534
336 HG23 THR 40 2HG2 THR 40 -0.463 -5.178 -10.555
337 H ALA 41 H ALA 41 -1.161 -7.990 -6.092
338 HA ALA 41 HA ALA 41 -3.028 -5.821 -5.355
339 HB1 ALA 41 3HB ALA 41 -3.719 -8.788 -5.145
340 HB2 ALA 41 1HB ALA 41 -4.451 -7.623 -6.256
341 HB3 ALA 41 2HB ALA 41 -4.695 -7.455 -4.519
342 H LEU 42 H LEU 42 -2.385 -5.050 -3.443
343 HA LEU 42 HA LEU 42 -1.204 -6.849 -1.403
344 HB2 LEU 42 2HB LEU 42 -0.582 -3.880 -1.811
345 HB3 LEU 42 1HB LEU 42 0.121 -4.926 -0.588
346 HG LEU 42 HG LEU 42 0.615 -5.033 -3.592
347 HD11 LEU 42 1HD1 LEU 42 2.942 -4.512 -3.012
348 HD12 LEU 42 2HD1 LEU 42 2.505 -4.404 -1.305
349 HD13 LEU 42 3HD1 LEU 42 1.838 -3.253 -2.463
350 HD21 LEU 42 3HD2 LEU 42 1.687 -6.930 -1.484
351 HD22 LEU 42 1HD2 LEU 42 2.198 -6.869 -3.175
352 HD23 LEU 42 2HD2 LEU 42 0.546 -7.326 -2.771
353 H LYS 43 H LYS 43 -2.524 -7.024 0.311
354 HA LYS 43 HA LYS 43 -4.625 -5.035 0.789
355 HB2 LYS 43 2HB LYS 43 -5.278 -7.430 0.802
356 HB3 LYS 43 1HB LYS 43 -4.158 -7.732 2.126
357 HG2 LYS 43 2HG LYS 43 -5.448 -6.249 3.603
358 HG3 LYS 43 1HG LYS 43 -6.550 -5.861 2.278
359 HD2 LYS 43 2HD LYS 43 -7.128 -8.340 2.177
360 HD3 LYS 43 1HD LYS 43 -6.197 -8.544 3.664
361 HE2 LYS 43 2HE LYS 43 -7.702 -7.077 4.871
362 HE3 LYS 43 1HE LYS 43 -8.564 -6.664 3.384
363 HZ1 LYS 43 3HZ LYS 43 -9.810 -8.284 4.579
364 HZ2 LYS 43 1HZ LYS 43 -8.483 -9.321 4.704
365 HZ3 LYS 43 2HZ LYS 43 -9.189 -9.029 3.197
366 H VAL 44 H VAL 44 -3.987 -3.377 1.938
367 HA VAL 44 HA VAL 44 -2.044 -3.505 4.110
368 HB VAL 44 HB VAL 44 -3.694 -1.203 2.943
369 HG11 VAL 44 1HG1 VAL 44 -1.465 -0.995 4.986
370 HG12 VAL 44 2HG1 VAL 44 -3.179 -0.707 5.290
371 HG13 VAL 44 3HG1 VAL 44 -2.285 0.357 4.202
372 HG21 VAL 44 3HG2 VAL 44 -0.744 -1.842 2.595
373 HG22 VAL 44 1HG2 VAL 44 -1.587 -0.448 1.915
374 HG23 VAL 44 2HG2 VAL 44 -2.001 -2.078 1.380
375 H ASP 45 H ASP 45 -2.603 -2.874 6.291
376 HA ASP 45 HA ASP 45 -4.940 -3.885 7.446
377 HB2 ASP 45 2HB ASP 45 -2.825 -3.575 8.675
378 HB3 ASP 45 1HB ASP 45 -2.950 -1.831 8.499
379 H GLY 46 H GLY 46 -6.958 -3.099 7.265
380 HA2 GLY 46 2HA GLY 46 -8.562 -1.399 7.877
381 HA3 GLY 46 1HA GLY 46 -7.459 -0.172 7.277
382 H ILE 47 H ILE 47 -7.055 -2.313 4.949
383 HA ILE 47 HA ILE 47 -8.821 -0.948 3.118
384 HB ILE 47 HB ILE 47 -6.751 -3.158 2.710
385 HG12 ILE 47 2HG1 ILE 47 -5.743 -1.045 3.360
386 HG13 ILE 47 1HG1 ILE 47 -5.422 -1.299 1.653
387 HG21 ILE 47 1HG2 ILE 47 -8.272 -1.675 0.531
388 HG22 ILE 47 2HG2 ILE 47 -8.413 -3.392 0.921
389 HG23 ILE 47 3HG2 ILE 47 -6.901 -2.755 0.276
390 HD11 ILE 47 3HD1 ILE 47 -7.210 0.311 1.103
391 HD12 ILE 47 1HD1 ILE 47 -5.932 1.011 2.096
392 HD13 ILE 47 2HD1 ILE 47 -7.474 0.576 2.829
393 H ALA 48 H ALA 48 -10.475 -1.786 1.899
394 HA ALA 48 HA ALA 48 -12.330 -3.431 3.135
395 HB1 ALA 48 3HB ALA 48 -12.193 -2.679 0.193
396 HB2 ALA 48 1HB ALA 48 -12.913 -1.708 1.475
397 HB3 ALA 48 2HB ALA 48 -13.631 -3.260 1.044
398 H ALA 49 H ALA 49 -10.280 -4.225 0.282
399 HA ALA 49 HA ALA 49 -10.172 -7.020 1.141
400 HB1 ALA 49 3HB ALA 49 -10.899 -7.933 -1.017
401 HB2 ALA 49 1HB ALA 49 -11.231 -6.304 -1.617
402 HB3 ALA 49 2HB ALA 49 -12.180 -6.968 -0.285
403 H TRP 50 H TRP 50 -9.288 -4.943 -1.695
404 HA TRP 50 HA TRP 50 -6.471 -5.756 -1.400
405 HB2 TRP 50 2HB TRP 50 -7.932 -6.048 -4.069
406 HB3 TRP 50 1HB TRP 50 -6.220 -6.349 -3.789
407 HD1 TRP 50 HD1 TRP 50 -5.671 -8.555 -2.146
408 HE1 TRP 50 HE1 TRP 50 -6.921 -10.795 -1.984
409 HE3 TRP 50 HE3 TRP 50 -10.145 -7.178 -4.243
410 HZ2 TRP 50 HZ2 TRP 50 -9.445 -11.853 -2.642
411 HZ3 TRP 50 HZ3 TRP 50 -11.921 -8.873 -4.443
412 HH2 TRP 50 HH2 TRP 50 -11.578 -11.164 -3.660
413 H ILE 51 H ILE 51 -4.981 -4.261 -2.188
414 HA ILE 51 HA ILE 51 -6.007 -1.891 -3.661
415 HB ILE 51 HB ILE 51 -3.512 -2.196 -1.909
416 HG12 ILE 51 2HG1 ILE 51 -5.591 -1.749 -0.652
417 HG13 ILE 51 1HG1 ILE 51 -4.517 -0.362 -0.564
418 HG21 ILE 51 1HG2 ILE 51 -2.949 0.153 -2.451
419 HG22 ILE 51 2HG2 ILE 51 -4.238 0.180 -3.657
420 HG23 ILE 51 3HG2 ILE 51 -2.857 -0.897 -3.866
421 HD11 ILE 51 3HD1 ILE 51 -6.814 0.325 -0.844
422 HD12 ILE 51 1HD1 ILE 51 -6.956 -0.624 -2.322
423 HD13 ILE 51 2HD1 ILE 51 -5.880 0.775 -2.269
424 H HIS 52 H HIS 52 -5.570 -1.930 -5.768
425 HA HIS 52 HA HIS 52 -3.868 -3.772 -7.089
426 HB2 HIS 52 2HB HIS 52 -5.851 -2.488 -8.094
427 HB3 HIS 52 1HB HIS 52 -4.821 -1.065 -8.148
428 HD1 HIS 52 HD1 HIS 52 -2.797 -1.163 -9.898
429 HD2 HIS 52 HD2 HIS 52 -5.566 -4.243 -10.182
430 HE1 HIS 52 HE1 HIS 52 -2.418 -2.208 -12.147
431 HE2 HIS 52 HE2 HIS 52 -4.170 -3.999 -12.332
432 H ALA 53 H ALA 53 -1.661 -3.608 -7.505
433 HA ALA 53 HA ALA 53 -0.218 -2.407 -5.462
434 HB1 ALA 53 3HB ALA 53 0.926 -3.625 -7.992
435 HB2 ALA 53 1HB ALA 53 0.402 -4.523 -6.569
436 HB3 ALA 53 2HB ALA 53 1.768 -3.411 -6.454
437 H ALA 54 H ALA 54 -0.912 -0.982 -8.533
438 HA ALA 54 HA ALA 54 1.239 0.907 -8.623
439 HB1 ALA 54 3HB ALA 54 0.003 0.243 -10.636
440 HB2 ALA 54 1HB ALA 54 -0.064 1.990 -10.410
441 HB3 ALA 54 2HB ALA 54 -1.461 0.988 -10.001
442 H HIS 55 H HIS 55 -1.396 0.716 -6.547
443 HA HIS 55 HA HIS 55 -1.249 3.572 -5.786
444 HB2 HIS 55 2HB HIS 55 -3.147 1.401 -4.777
445 HB3 HIS 55 1HB HIS 55 -3.178 3.085 -4.292
446 HD1 HIS 55 HD1 HIS 55 -3.726 4.791 -6.368
447 HD2 HIS 55 HD2 HIS 55 -4.889 0.821 -6.768
448 HE1 HIS 55 HE1 HIS 55 -5.497 4.780 -8.142
449 HE2 HIS 55 HE2 HIS 55 -6.050 2.362 -8.487
450 H VAL 56 H VAL 56 0.745 1.187 -5.305
451 HA VAL 56 HA VAL 56 1.101 1.701 -2.399
452 HB VAL 56 HB VAL 56 1.878 -0.900 -3.823
453 HG11 VAL 56 1HG1 VAL 56 2.048 -0.149 -0.878
454 HG12 VAL 56 2HG1 VAL 56 3.409 -0.352 -1.982
455 HG13 VAL 56 3HG1 VAL 56 2.408 -1.735 -1.555
456 HG21 VAL 56 3HG2 VAL 56 0.104 -2.003 -2.507
457 HG22 VAL 56 1HG2 VAL 56 -0.570 -0.771 -3.578
458 HG23 VAL 56 2HG2 VAL 56 -0.397 -0.443 -1.853
459 H LYS 57 H LYS 57 3.061 2.430 -1.787
460 HA LYS 57 HA LYS 57 5.399 2.232 -3.592
461 HB2 LYS 57 2HB LYS 57 4.627 4.705 -1.962
462 HB3 LYS 57 1HB LYS 57 6.057 4.532 -2.974
463 HG2 LYS 57 2HG LYS 57 4.605 4.398 -4.988
464 HG3 LYS 57 1HG LYS 57 3.185 4.585 -3.955
465 HD2 LYS 57 2HD LYS 57 3.767 6.728 -5.001
466 HD3 LYS 57 1HD LYS 57 3.985 6.825 -3.252
467 HE2 LYS 57 2HE LYS 57 6.415 6.524 -3.531
468 HE3 LYS 57 1HE LYS 57 6.205 6.369 -5.277
469 HZ1 LYS 57 3HZ LYS 57 5.258 8.656 -5.241
470 HZ2 LYS 57 1HZ LYS 57 6.894 8.567 -4.814
471 HZ3 LYS 57 2HZ LYS 57 5.723 8.779 -3.620
472 H ALA 58 H ALA 58 6.920 1.078 -2.480
473 HA ALA 58 HA ALA 58 6.685 0.281 0.212
474 HB1 ALA 58 3HB ALA 58 9.127 0.176 -1.598
475 HB2 ALA 58 1HB ALA 58 7.862 -1.049 -1.493
476 HB3 ALA 58 2HB ALA 58 8.911 -0.748 -0.108
477 H ALA 59 H ALA 59 7.210 1.309 2.071
478 HA ALA 59 HA ALA 59 8.847 3.788 1.975
479 HB1 ALA 59 3HB ALA 59 6.687 2.976 3.963
480 HB2 ALA 59 1HB ALA 59 6.489 4.122 2.635
481 HB3 ALA 59 2HB ALA 59 7.579 4.499 3.970
482 H ASP 60 H ASP 60 10.223 4.236 3.741
483 HA ASP 60 HA ASP 60 11.406 1.901 5.100
484 HB2 ASP 60 2HB ASP 60 12.871 3.348 3.669
485 HB3 ASP 60 1HB ASP 60 12.525 4.716 4.718
486 HA PRO 61 HA PRO 61 9.333 3.717 8.785
487 HB2 PRO 61 2HB PRO 61 9.511 1.548 10.416
488 HB3 PRO 61 1HB PRO 61 8.365 1.593 9.058
489 HG2 PRO 61 2HG PRO 61 11.059 0.270 9.197
490 HG3 PRO 61 1HG PRO 61 9.529 -0.365 8.550
491 HD2 PRO 61 2HD PRO 61 11.498 0.710 6.960
492 HD3 PRO 61 1HD PRO 61 9.770 0.751 6.527
493 H GLY 62 H GLY 62 12.590 2.651 8.356
494 HA2 GLY 62 2HA GLY 62 14.557 3.164 9.462
495 HA3 GLY 62 1HA GLY 62 13.641 4.038 10.691
496 H GLY 63 H GLY 63 12.168 2.546 11.990
497 HA2 GLY 63 2HA GLY 63 12.862 -0.253 12.242
498 HA3 GLY 63 1HA GLY 63 13.363 0.739 13.621
499 H GLY 64 H GLY 64 11.897 0.866 15.210
500 HA2 GLY 64 2HA GLY 64 9.945 0.820 16.397
501 HA3 GLY 64 1HA GLY 64 9.231 1.630 15.011
502 HA PRO 65 HA PRO 65 8.174 -2.979 14.275
503 HB2 PRO 65 2HB PRO 65 9.443 -5.006 15.511
504 HB3 PRO 65 1HB PRO 65 10.268 -4.061 14.257
505 HG2 PRO 65 2HG PRO 65 10.590 -3.921 17.230
506 HG3 PRO 65 1HG PRO 65 11.814 -3.764 15.952
507 HD2 PRO 65 2HD PRO 65 10.542 -1.621 17.293
508 HD3 PRO 65 1HD PRO 65 11.505 -1.499 15.804
509 H SER 66 H SER 66 7.940 -1.544 17.223
510 HA SER 66 HA SER 66 7.390 -3.382 19.178
511 HB2 SER 66 2HB SER 66 6.168 -1.440 20.301
512 HB3 SER 66 1HB SER 66 7.799 -1.082 19.726
513 HG SER 66 HG SER 66 5.795 0.346 19.187
514 H SER 67 H SER 67 4.847 -1.579 17.403
515 HA SER 67 HA SER 67 2.709 -3.181 18.490
516 HB2 SER 67 2HB SER 67 2.461 -0.749 18.012
517 HB3 SER 67 1HB SER 67 2.652 -1.064 16.289
518 HG SER 67 HG SER 67 0.625 -2.258 17.869
519 H ARG 68 H ARG 68 4.824 -3.547 15.853
520 HA ARG 68 HA ARG 68 3.007 -5.250 14.268
521 HB2 ARG 68 2HB ARG 68 5.785 -4.138 13.645
522 HB3 ARG 68 1HB ARG 68 4.839 -5.144 12.547
523 HG2 ARG 68 2HG ARG 68 3.096 -3.412 12.408
524 HG3 ARG 68 1HG ARG 68 3.968 -2.423 13.579
525 HD2 ARG 68 2HD ARG 68 4.998 -3.210 10.842
526 HD3 ARG 68 1HD ARG 68 4.296 -1.645 11.252
527 HE ARG 68 HE ARG 68 6.305 -1.786 13.011
528 HH11 ARG 68 1HH1 ARG 68 6.315 -2.397 9.533
529 HH12 ARG 68 2HH1 ARG 68 7.963 -1.902 9.344
530 HH21 ARG 68 1HH2 ARG 68 8.448 -1.112 12.710
531 HH22 ARG 68 2HH2 ARG 68 9.171 -1.177 11.140
532 H LEU 69 H LEU 69 5.010 -5.703 16.851
533 HA LEU 69 HA LEU 69 6.432 -8.092 16.162
534 HB2 LEU 69 2HB LEU 69 5.650 -6.880 18.836
535 HB3 LEU 69 1HB LEU 69 6.563 -8.374 18.728
536 HG LEU 69 HG LEU 69 7.522 -5.671 17.691
537 HD11 LEU 69 1HD1 LEU 69 8.394 -7.186 20.174
538 HD12 LEU 69 2HD1 LEU 69 7.421 -5.713 20.145
539 HD13 LEU 69 3HD1 LEU 69 9.087 -5.675 19.572
540 HD21 LEU 69 3HD2 LEU 69 8.456 -7.500 16.387
541 HD22 LEU 69 1HD2 LEU 69 8.978 -8.325 17.858
542 HD23 LEU 69 2HD2 LEU 69 9.701 -6.778 17.401
543 H THR 70 H THR 70 3.152 -7.660 16.387
544 HA THR 70 HA THR 70 2.228 -9.855 17.880
545 HB THR 70 HB THR 70 0.791 -8.522 15.537
546 HG1 THR 70 HG1 THR 70 1.044 -7.684 18.256
547 HG21 THR 70 3HG2 THR 70 -0.295 -9.819 18.065
548 HG22 THR 70 1HG2 THR 70 -0.349 -10.529 16.448
549 HG23 THR 70 2HG2 THR 70 -1.255 -9.056 16.798
550 H TRP 71 H TRP 71 2.267 -9.474 14.301
551 HA TRP 71 HA TRP 71 2.256 -10.909 12.559
552 HB2 TRP 71 2HB TRP 71 4.327 -12.249 14.333
553 HB3 TRP 71 1HB TRP 71 4.075 -12.678 12.642
554 HD1 TRP 71 HD1 TRP 71 4.015 -10.004 11.138
555 HE1 TRP 71 HE1 TRP 71 6.015 -8.405 11.082
556 HE3 TRP 71 HE3 TRP 71 6.479 -11.640 15.313
557 HZ2 TRP 71 HZ2 TRP 71 8.338 -7.898 12.583
558 HZ3 TRP 71 HZ3 TRP 71 8.595 -10.543 15.930
559 HH2 TRP 71 HH2 TRP 71 9.506 -8.711 14.590
560 H ARG 72 H ARG 72 0.114 -11.395 14.258
561 HA ARG 72 HA ARG 72 -0.300 -14.145 14.867
562 HB2 ARG 72 2HB ARG 72 -2.627 -13.498 15.321
563 HB3 ARG 72 1HB ARG 72 -1.498 -12.353 16.038
564 HG2 ARG 72 2HG ARG 72 -1.914 -10.764 14.193
565 HG3 ARG 72 1HG ARG 72 -3.037 -11.907 13.455
566 HD2 ARG 72 2HD ARG 72 -4.501 -11.743 15.448
567 HD3 ARG 72 1HD ARG 72 -3.370 -10.591 16.174
568 HE ARG 72 HE ARG 72 -4.204 -9.702 13.604
569 HH11 ARG 72 1HH1 ARG 72 -5.386 -9.959 16.915
570 HH12 ARG 72 2HH1 ARG 72 -6.490 -8.629 16.750
571 HH21 ARG 72 1HH2 ARG 72 -5.633 -7.949 13.408
572 HH22 ARG 72 2HH2 ARG 72 -6.628 -7.488 14.753
573 H VAL 73 H VAL 73 -0.868 -12.240 11.982
574 HA VAL 73 HA VAL 73 -2.606 -14.127 10.643
575 HB VAL 73 HB VAL 73 -1.033 -11.785 9.466
576 HG11 VAL 73 1HG1 VAL 73 -2.714 -11.770 7.656
577 HG12 VAL 73 2HG1 VAL 73 -3.490 -13.192 8.357
578 HG13 VAL 73 3HG1 VAL 73 -1.851 -13.309 7.720
579 HG21 VAL 73 3HG2 VAL 73 -2.471 -11.022 11.315
580 HG22 VAL 73 1HG2 VAL 73 -3.874 -11.774 10.551
581 HG23 VAL 73 2HG2 VAL 73 -3.060 -10.416 9.767
582 H GLN 74 H GLN 74 0.784 -13.762 11.097
583 HA GLN 74 HA GLN 74 1.707 -15.179 8.740
584 HB2 GLN 74 2HB GLN 74 3.151 -14.207 11.240
585 HB3 GLN 74 1HB GLN 74 3.961 -14.893 9.837
586 HG2 GLN 74 2HG GLN 74 2.264 -12.378 9.748
587 HG3 GLN 74 1HG GLN 74 4.012 -12.382 9.969
588 HE21 GLN 74 1HE2 GLN 74 1.417 -12.872 7.678
589 HE22 GLN 74 2HE2 GLN 74 2.418 -12.925 6.272
590 H ARG 75 H ARG 75 0.130 -16.337 11.357
591 HA ARG 75 HA ARG 75 1.799 -18.610 12.031
592 HB2 ARG 75 2HB ARG 75 -1.101 -18.068 12.790
593 HB3 ARG 75 1HB ARG 75 -0.055 -19.282 13.512
594 HG2 ARG 75 2HG ARG 75 0.240 -16.268 13.739
595 HG3 ARG 75 1HG ARG 75 -0.307 -17.367 15.001
596 HD2 ARG 75 2HD ARG 75 1.938 -16.853 15.540
597 HD3 ARG 75 1HD ARG 75 1.996 -18.474 14.848
598 HE ARG 75 HE ARG 75 2.518 -16.234 13.035
599 HH11 ARG 75 1HH1 ARG 75 3.956 -18.711 15.090
600 HH12 ARG 75 2HH1 ARG 75 5.497 -18.643 14.295
601 HH21 ARG 75 1HH2 ARG 75 4.532 -16.247 11.940
602 HH22 ARG 75 2HH2 ARG 75 5.820 -17.255 12.514
603 H SER 76 H SER 76 2.053 -19.311 9.863
604 HA SER 76 HA SER 76 0.178 -21.336 8.928
605 HB2 SER 76 2HB SER 76 1.006 -18.984 7.126
606 HB3 SER 76 1HB SER 76 0.009 -20.356 6.638
607 HG SER 76 HG SER 76 -1.352 -19.505 8.554
608 H GLN 77 H GLN 77 1.789 -21.356 6.284
609 HA GLN 77 HA GLN 77 4.338 -22.391 6.982
610 HB2 GLN 77 2HB GLN 77 3.082 -22.505 4.673
611 HB3 GLN 77 1HB GLN 77 3.752 -20.916 4.360
612 HG2 GLN 77 2HG GLN 77 5.389 -23.420 4.890
613 HG3 GLN 77 1HG GLN 77 5.015 -22.794 3.293
614 HE21 GLN 77 1HE2 GLN 77 7.620 -23.281 4.502
615 HE22 GLN 77 2HE2 GLN 77 8.462 -21.773 4.470
616 H ASN 78 H ASN 78 5.882 -21.211 8.056
617 HA ASN 78 HA ASN 78 5.440 -18.550 8.818
618 HB2 ASN 78 2HB ASN 78 6.618 -20.100 10.290
619 HB3 ASN 78 1HB ASN 78 7.930 -20.279 9.126
620 HD21 ASN 78 1HD2 ASN 78 9.531 -18.693 9.034
621 HD22 ASN 78 2HD2 ASN 78 9.638 -17.387 10.160
622 HA PRO 79 HA PRO 79 7.658 -16.615 5.290
623 HB2 PRO 79 2HB PRO 79 5.971 -14.267 5.586
624 HB3 PRO 79 1HB PRO 79 5.834 -15.553 4.373
625 HG2 PRO 79 2HG PRO 79 3.938 -15.096 6.317
626 HG3 PRO 79 1HG PRO 79 4.184 -16.671 5.524
627 HD2 PRO 79 2HD PRO 79 5.276 -15.711 8.182
628 HD3 PRO 79 1HD PRO 79 4.477 -17.259 7.785
629 H LEU 80 H LEU 80 7.612 -15.956 8.563
630 HA LEU 80 HA LEU 80 8.883 -13.377 8.633
631 HB2 LEU 80 2HB LEU 80 8.583 -15.524 10.773
632 HB3 LEU 80 1HB LEU 80 9.177 -13.894 11.064
633 HG LEU 80 HG LEU 80 6.370 -14.618 10.127
634 HD11 LEU 80 1HD1 LEU 80 5.630 -13.905 12.339
635 HD12 LEU 80 2HD1 LEU 80 7.299 -13.607 12.832
636 HD13 LEU 80 3HD1 LEU 80 6.767 -15.249 12.460
637 HD21 LEU 80 3HD2 LEU 80 5.833 -12.235 10.453
638 HD22 LEU 80 1HD2 LEU 80 7.058 -12.460 9.204
639 HD23 LEU 80 2HD2 LEU 80 7.529 -11.891 10.807
640 H LYS 81 H LYS 81 10.698 -13.512 7.363
641 HA LYS 81 HA LYS 81 12.741 -15.559 7.906
642 HB2 LYS 81 2HB LYS 81 12.508 -13.576 5.593
643 HB3 LYS 81 1HB LYS 81 13.699 -14.874 5.729
644 HG2 LYS 81 2HG LYS 81 11.880 -16.548 5.686
645 HG3 LYS 81 1HG LYS 81 10.689 -15.255 5.548
646 HD2 LYS 81 2HD LYS 81 11.735 -14.612 3.347
647 HD3 LYS 81 1HD LYS 81 12.804 -16.015 3.491
648 HE2 LYS 81 2HE LYS 81 10.793 -17.492 3.582
649 HE3 LYS 81 1HE LYS 81 9.768 -16.075 3.352
650 HZ1 LYS 81 3HZ LYS 81 10.137 -17.289 1.298
651 HZ2 LYS 81 1HZ LYS 81 11.804 -17.048 1.423
652 HZ3 LYS 81 2HZ LYS 81 10.771 -15.730 1.195
653 H ILE 82 H ILE 82 14.006 -14.958 9.537
654 HA ILE 82 HA ILE 82 14.410 -12.223 10.305
655 HB ILE 82 HB ILE 82 15.824 -13.173 12.164
656 HG12 ILE 82 2HG1 ILE 82 15.030 -15.914 11.043
657 HG13 ILE 82 1HG1 ILE 82 16.653 -15.240 10.988
658 HG21 ILE 82 1HG2 ILE 82 13.411 -12.788 12.462
659 HG22 ILE 82 2HG2 ILE 82 13.928 -14.203 13.377
660 HG23 ILE 82 3HG2 ILE 82 13.058 -14.408 11.855
661 HD11 ILE 82 3HD1 ILE 82 16.440 -16.881 12.762
662 HD12 ILE 82 1HD1 ILE 82 15.133 -15.954 13.501
663 HD13 ILE 82 2HD1 ILE 82 16.764 -15.286 13.433
664 H ARG 83 H ARG 83 15.575 -11.056 8.950
665 HA ARG 83 HA ARG 83 18.096 -11.949 7.756
666 HB2 ARG 83 2HB ARG 83 16.729 -9.231 7.517
667 HB3 ARG 83 1HB ARG 83 17.968 -9.897 6.456
668 HG2 ARG 83 2HG ARG 83 16.322 -11.679 5.758
669 HG3 ARG 83 1HG ARG 83 15.093 -10.851 6.714
670 HD2 ARG 83 2HD ARG 83 14.836 -10.202 4.398
671 HD3 ARG 83 1HD ARG 83 15.448 -8.808 5.298
672 HE ARG 83 HE ARG 83 17.384 -10.528 3.915
673 HH11 ARG 83 1HH1 ARG 83 15.684 -7.423 3.963
674 HH12 ARG 83 2HH1 ARG 83 16.758 -6.695 2.808
675 HH21 ARG 83 1HH2 ARG 83 18.758 -9.557 2.394
676 HH22 ARG 83 2HH2 ARG 83 18.501 -7.908 1.916
677 H LEU 84 H LEU 84 19.775 -9.910 7.709
678 HA LEU 84 HA LEU 84 20.660 -9.612 10.469
679 HB2 LEU 84 2HB LEU 84 21.955 -8.816 7.833
680 HB3 LEU 84 1HB LEU 84 22.711 -8.586 9.403
681 HG LEU 84 HG LEU 84 21.985 -11.276 8.168
682 HD11 LEU 84 1HD1 LEU 84 23.882 -10.203 7.035
683 HD12 LEU 84 2HD1 LEU 84 24.383 -11.639 7.921
684 HD13 LEU 84 3HD1 LEU 84 24.724 -10.035 8.579
685 HD21 LEU 84 3HD2 LEU 84 23.185 -12.290 10.057
686 HD22 LEU 84 1HD2 LEU 84 21.794 -11.357 10.609
687 HD23 LEU 84 2HD2 LEU 84 23.422 -10.697 10.782
688 H THR 85 H THR 85 18.706 -8.279 10.916
689 HA THR 85 HA THR 85 18.833 -5.467 10.165
690 HB THR 85 HB THR 85 17.004 -6.938 12.126
691 HG1 THR 85 HG1 THR 85 16.567 -5.990 9.468
692 HG21 THR 85 3HG2 THR 85 17.147 -4.528 12.719
693 HG22 THR 85 1HG2 THR 85 15.560 -4.931 12.059
694 HG23 THR 85 2HG2 THR 85 16.746 -4.095 11.056
695 H ARG 86 H ARG 86 19.770 -3.899 11.379
696 HA ARG 86 HA ARG 86 21.404 -4.470 13.662
697 HB2 ARG 86 2HB ARG 86 20.588 -1.836 12.351
698 HB3 ARG 86 1HB ARG 86 21.729 -1.948 13.689
699 HG2 ARG 86 2HG ARG 86 23.207 -3.369 12.261
700 HG3 ARG 86 1HG ARG 86 22.084 -3.140 10.920
701 HD2 ARG 86 2HD ARG 86 22.520 -0.740 10.909
702 HD3 ARG 86 1HD ARG 86 23.530 -0.882 12.351
703 HE ARG 86 HE ARG 86 24.290 -2.322 9.891
704 HH11 ARG 86 1HH1 ARG 86 25.003 0.232 12.227
705 HH12 ARG 86 2HH1 ARG 86 26.617 0.492 11.641
706 HH21 ARG 86 1HH2 ARG 86 26.402 -1.948 9.118
707 HH22 ARG 86 2HH2 ARG 86 27.408 -0.751 9.875
708 H GLU 87 H GLU 87 20.079 -5.291 15.234
709 HA GLU 87 HA GLU 87 17.741 -3.842 16.245
710 HB2 GLU 87 2HB GLU 87 18.975 -6.489 17.131
711 HB3 GLU 87 1HB GLU 87 17.421 -5.848 17.662
712 HG2 GLU 87 2HG GLU 87 16.504 -6.088 15.407
713 HG3 GLU 87 1HG GLU 87 18.077 -6.598 14.796
714 H ALA 88 H ALA 88 17.643 -2.847 18.237
715 HA ALA 88 HA ALA 88 20.122 -2.612 19.844
716 HB1 ALA 88 3HB ALA 88 19.278 -0.481 18.916
717 HB2 ALA 88 1HB ALA 88 19.188 -0.496 20.678
718 HB3 ALA 88 2HB ALA 88 17.726 -0.736 19.718
719 HA PRO 89 HA PRO 89 17.682 -5.374 22.689
720 HB2 PRO 89 2HB PRO 89 20.328 -5.107 24.140
721 HB3 PRO 89 1HB PRO 89 19.356 -6.564 23.829
722 HG2 PRO 89 2HG PRO 89 21.542 -6.135 22.407
723 HG3 PRO 89 1HG PRO 89 20.071 -6.732 21.598
724 HD2 PRO 89 2HD PRO 89 21.194 -3.931 21.640
725 HD3 PRO 89 1HD PRO 89 20.484 -4.841 20.288
Start of MODEL 14
1 H1 HIS 1 1H HIS 1 -12.368 -18.927 10.221
2 H2 HIS 1 2H HIS 1 -11.827 -17.595 9.335
3 H3 HIS 1 3H HIS 1 -11.111 -17.965 10.817
4 HA HIS 1 HA HIS 1 -10.205 -19.967 9.983
5 HB2 HIS 1 2HB HIS 1 -12.106 -20.433 8.377
6 HB3 HIS 1 1HB HIS 1 -11.462 -19.205 7.298
7 HD1 HIS 1 HD1 HIS 1 -9.743 -20.002 5.612
8 HD2 HIS 1 HD2 HIS 1 -10.307 -22.735 8.688
9 HE1 HIS 1 HE1 HIS 1 -8.439 -22.045 4.955
10 HE2 HIS 1 HE2 HIS 1 -8.977 -23.736 6.732
11 H HIS 2 H HIS 2 -8.051 -19.607 9.694
12 HA HIS 2 HA HIS 2 -7.064 -17.064 8.655
13 HB2 HIS 2 2HB HIS 2 -5.585 -19.497 9.774
14 HB3 HIS 2 1HB HIS 2 -4.793 -18.017 9.248
15 HD1 HIS 2 HD1 HIS 2 -6.114 -19.599 12.204
16 HD2 HIS 2 HD2 HIS 2 -5.708 -15.676 10.875
17 HE1 HIS 2 HE1 HIS 2 -6.224 -18.163 14.262
18 HE2 HIS 2 HE2 HIS 2 -5.925 -15.810 13.436
19 H HIS 3 H HIS 3 -5.824 -16.811 6.819
20 HA HIS 3 HA HIS 3 -4.912 -19.009 5.186
21 HB2 HIS 3 2HB HIS 3 -6.140 -18.504 3.158
22 HB3 HIS 3 1HB HIS 3 -7.318 -18.729 4.436
23 HD1 HIS 3 HD1 HIS 3 -6.817 -16.650 1.658
24 HD2 HIS 3 HD2 HIS 3 -7.959 -15.916 5.579
25 HE1 HIS 3 HE1 HIS 3 -7.995 -14.439 1.613
26 HE2 HIS 3 HE2 HIS 3 -8.912 -14.185 3.934
27 H HIS 4 H HIS 4 -3.344 -18.341 3.646
28 HA HIS 4 HA HIS 4 -2.648 -15.549 3.319
29 HB2 HIS 4 2HB HIS 4 -0.395 -15.684 4.285
30 HB3 HIS 4 1HB HIS 4 -1.584 -16.089 5.518
31 HD1 HIS 4 HD1 HIS 4 1.236 -17.534 3.549
32 HD2 HIS 4 HD2 HIS 4 -1.529 -18.801 6.384
33 HE1 HIS 4 HE1 HIS 4 2.039 -19.782 4.327
34 HE2 HIS 4 HE2 HIS 4 0.450 -20.437 6.155
35 H HIS 5 H HIS 5 -0.462 -15.421 2.134
36 HA HIS 5 HA HIS 5 -0.057 -17.616 0.194
37 HB2 HIS 5 2HB HIS 5 -0.126 -14.623 -0.453
38 HB3 HIS 5 1HB HIS 5 0.262 -15.902 -1.598
39 HD1 HIS 5 HD1 HIS 5 -1.685 -16.988 -2.798
40 HD2 HIS 5 HD2 HIS 5 -2.908 -14.591 0.359
41 HE1 HIS 5 HE1 HIS 5 -4.182 -16.832 -2.988
42 HE2 HIS 5 HE2 HIS 5 -4.891 -15.605 -0.920
43 H HIS 6 H HIS 6 2.145 -16.961 -1.051
44 HA HIS 6 HA HIS 6 4.247 -16.507 0.916
45 HB2 HIS 6 2HB HIS 6 4.405 -16.943 -2.108
46 HB3 HIS 6 1HB HIS 6 5.797 -16.860 -1.028
47 HD1 HIS 6 HD1 HIS 6 3.278 -19.178 -2.343
48 HD2 HIS 6 HD2 HIS 6 5.909 -19.065 0.873
49 HE1 HIS 6 HE1 HIS 6 3.393 -21.528 -1.479
50 HE2 HIS 6 HE2 HIS 6 5.117 -21.462 0.343
51 H SER 7 H SER 7 3.750 -14.456 1.610
52 HA SER 7 HA SER 7 3.366 -12.262 -0.341
53 HB2 SER 7 2HB SER 7 2.308 -12.634 2.499
54 HB3 SER 7 1HB SER 7 1.913 -11.291 1.422
55 HG SER 7 HG SER 7 1.228 -13.112 -0.058
56 H HIS 8 H HIS 8 3.643 -10.024 0.843
57 HA HIS 8 HA HIS 8 6.173 -9.649 2.167
58 HB2 HIS 8 2HB HIS 8 3.700 -7.855 1.909
59 HB3 HIS 8 1HB HIS 8 5.198 -7.332 2.672
60 HD1 HIS 8 HD1 HIS 8 6.909 -6.317 1.175
61 HD2 HIS 8 HD2 HIS 8 4.018 -8.393 -0.964
62 HE1 HIS 8 HE1 HIS 8 7.423 -5.900 -1.245
63 HE2 HIS 8 HE2 HIS 8 5.545 -7.008 -2.498
64 H MET 9 H MET 9 6.522 -9.466 4.444
65 HA MET 9 HA MET 9 4.775 -10.977 6.119
66 HB2 MET 9 2HB MET 9 6.322 -10.611 7.934
67 HB3 MET 9 1HB MET 9 7.267 -10.880 6.485
68 HG2 MET 9 2HG MET 9 7.777 -8.489 6.350
69 HG3 MET 9 1HG MET 9 6.755 -8.179 7.762
70 HE1 MET 9 3HE MET 9 9.769 -7.158 7.804
71 HE2 MET 9 1HE MET 9 10.281 -7.706 9.396
72 HE3 MET 9 2HE MET 9 8.673 -7.018 9.179
73 H VAL 10 H VAL 10 3.622 -10.252 8.000
74 HA VAL 10 HA VAL 10 1.822 -8.183 7.477
75 HB VAL 10 HB VAL 10 0.901 -8.569 9.750
76 HG11 VAL 10 1HG1 VAL 10 0.325 -10.962 9.501
77 HG12 VAL 10 2HG1 VAL 10 1.627 -11.159 8.326
78 HG13 VAL 10 3HG1 VAL 10 0.253 -10.113 7.954
79 HG21 VAL 10 3HG2 VAL 10 3.293 -10.400 10.241
80 HG22 VAL 10 1HG2 VAL 10 1.902 -10.208 11.315
81 HG23 VAL 10 2HG2 VAL 10 2.999 -8.854 11.041
82 H GLY 11 H GLY 11 1.694 -6.055 8.051
83 HA2 GLY 11 2HA GLY 11 2.132 -4.151 9.355
84 HA3 GLY 11 1HA GLY 11 3.498 -4.956 10.098
85 H ASP 12 H ASP 12 3.456 -5.260 6.673
86 HA ASP 12 HA ASP 12 5.968 -4.090 6.268
87 HB2 ASP 12 2HB ASP 12 4.884 -5.706 4.728
88 HB3 ASP 12 1HB ASP 12 3.735 -4.471 4.243
89 H THR 13 H THR 13 6.594 -1.979 6.353
90 HA THR 13 HA THR 13 4.656 0.156 6.511
91 HB THR 13 HB THR 13 7.675 0.530 6.328
92 HG1 THR 13 HG1 THR 13 6.526 -1.018 8.081
93 HG21 THR 13 3HG2 THR 13 7.238 2.482 7.773
94 HG22 THR 13 1HG2 THR 13 5.523 2.084 7.828
95 HG23 THR 13 2HG2 THR 13 6.266 2.582 6.305
96 H VAL 14 H VAL 14 3.742 0.832 4.638
97 HA VAL 14 HA VAL 14 5.416 1.426 2.275
98 HB VAL 14 HB VAL 14 3.657 0.557 0.760
99 HG11 VAL 14 1HG1 VAL 14 4.722 -1.566 2.647
100 HG12 VAL 14 2HG1 VAL 14 5.569 -0.880 1.258
101 HG13 VAL 14 3HG1 VAL 14 4.111 -1.845 1.013
102 HG21 VAL 14 3HG2 VAL 14 1.840 -0.893 1.606
103 HG22 VAL 14 1HG2 VAL 14 1.706 0.741 2.260
104 HG23 VAL 14 2HG2 VAL 14 2.338 -0.564 3.269
105 H TRP 15 H TRP 15 4.334 2.858 0.733
106 HA TRP 15 HA TRP 15 2.254 4.636 1.867
107 HB2 TRP 15 2HB TRP 15 4.523 5.263 -0.088
108 HB3 TRP 15 1HB TRP 15 3.211 6.383 0.269
109 HD1 TRP 15 HD1 TRP 15 3.279 5.799 3.522
110 HE1 TRP 15 HE1 TRP 15 5.152 6.906 4.886
111 HE3 TRP 15 HE3 TRP 15 6.623 6.696 -0.244
112 HZ2 TRP 15 HZ2 TRP 15 7.702 8.013 4.445
113 HZ3 TRP 15 HZ3 TRP 15 8.764 7.780 0.311
114 HH2 TRP 15 HH2 TRP 15 9.293 8.427 2.611
115 H VAL 16 H VAL 16 0.394 4.715 0.737
116 HA VAL 16 HA VAL 16 0.176 3.375 -1.890
117 HB VAL 16 HB VAL 16 -2.048 3.994 0.133
118 HG11 VAL 16 1HG1 VAL 16 -3.472 2.547 -1.300
119 HG12 VAL 16 2HG1 VAL 16 -2.140 2.377 -2.446
120 HG13 VAL 16 3HG1 VAL 16 -2.882 3.956 -2.187
121 HG21 VAL 16 3HG2 VAL 16 -0.709 1.327 -0.489
122 HG22 VAL 16 1HG2 VAL 16 -2.104 1.547 0.574
123 HG23 VAL 16 2HG2 VAL 16 -0.541 2.245 1.007
124 H ARG 17 H ARG 17 0.228 4.804 -3.491
125 HA ARG 17 HA ARG 17 -0.302 7.622 -3.074
126 HB2 ARG 17 2HB ARG 17 1.742 6.847 -4.263
127 HB3 ARG 17 1HB ARG 17 0.740 6.166 -5.540
128 HG2 ARG 17 2HG ARG 17 -0.052 8.396 -6.158
129 HG3 ARG 17 1HG ARG 17 0.823 9.113 -4.804
130 HD2 ARG 17 2HD ARG 17 2.015 9.471 -6.911
131 HD3 ARG 17 1HD ARG 17 2.959 8.455 -5.818
132 HE ARG 17 HE ARG 17 1.432 6.834 -7.571
133 HH11 ARG 17 1HH1 ARG 17 4.280 8.924 -7.597
134 HH12 ARG 17 2HH1 ARG 17 5.027 8.087 -8.922
135 HH21 ARG 17 1HH2 ARG 17 2.429 5.761 -9.315
136 HH22 ARG 17 2HH2 ARG 17 3.975 6.290 -9.897
137 H ARG 18 H ARG 18 -2.331 8.225 -3.160
138 HA ARG 18 HA ARG 18 -4.344 6.943 -4.853
139 HB2 ARG 18 2HB ARG 18 -4.803 7.333 -2.451
140 HB3 ARG 18 1HB ARG 18 -4.578 9.065 -2.674
141 HG2 ARG 18 2HG ARG 18 -6.553 9.139 -4.153
142 HG3 ARG 18 1HG ARG 18 -6.766 7.393 -3.975
143 HD2 ARG 18 2HD ARG 18 -6.936 9.449 -1.745
144 HD3 ARG 18 1HD ARG 18 -8.314 8.660 -2.525
145 HE ARG 18 HE ARG 18 -6.616 6.671 -1.529
146 HH11 ARG 18 1HH1 ARG 18 -8.692 9.208 -0.198
147 HH12 ARG 18 2HH1 ARG 18 -8.993 8.334 1.272
148 HH21 ARG 18 1HH2 ARG 18 -7.042 5.569 0.394
149 HH22 ARG 18 2HH2 ARG 18 -8.060 6.285 1.599
150 H HIS 19 H HIS 19 -5.322 7.917 -6.573
151 HA HIS 19 HA HIS 19 -4.433 10.419 -7.686
152 HB2 HIS 19 2HB HIS 19 -6.936 8.813 -8.415
153 HB3 HIS 19 1HB HIS 19 -6.225 10.107 -9.371
154 HD1 HIS 19 HD1 HIS 19 -6.761 7.073 -10.216
155 HD2 HIS 19 HD2 HIS 19 -3.098 8.770 -9.271
156 HE1 HIS 19 HE1 HIS 19 -5.052 5.702 -11.419
157 HE2 HIS 19 HE2 HIS 19 -2.869 6.871 -10.998
158 H GLN 20 H GLN 20 -4.840 12.014 -6.063
159 HA GLN 20 HA GLN 20 -7.435 12.610 -5.016
160 HB2 GLN 20 2HB GLN 20 -5.083 14.513 -5.489
161 HB3 GLN 20 1HB GLN 20 -6.484 14.840 -4.467
162 HG2 GLN 20 2HG GLN 20 -4.402 12.681 -3.988
163 HG3 GLN 20 1HG GLN 20 -4.490 14.229 -3.150
164 HE21 GLN 20 1HE2 GLN 20 -6.164 14.548 -1.619
165 HE22 GLN 20 2HE2 GLN 20 -7.028 13.219 -0.932
166 H THR 21 H THR 21 -5.623 13.574 -7.865
167 HA THR 21 HA THR 21 -8.117 13.956 -9.369
168 HB THR 21 HB THR 21 -5.684 15.801 -9.670
169 HG1 THR 21 HG1 THR 21 -6.631 17.118 -8.322
170 HG21 THR 21 3HG2 THR 21 -8.447 15.982 -10.948
171 HG22 THR 21 1HG2 THR 21 -6.969 15.471 -11.778
172 HG23 THR 21 2HG2 THR 21 -7.116 17.121 -11.171
173 H LYS 22 H LYS 22 -7.880 13.237 -11.578
174 HA LYS 22 HA LYS 22 -5.940 11.127 -11.941
175 HB2 LYS 22 2HB LYS 22 -8.100 12.178 -13.825
176 HB3 LYS 22 1HB LYS 22 -7.146 10.719 -14.095
177 HG2 LYS 22 2HG LYS 22 -8.108 9.696 -12.071
178 HG3 LYS 22 1HG LYS 22 -9.059 11.152 -11.769
179 HD2 LYS 22 2HD LYS 22 -9.307 9.372 -14.229
180 HD3 LYS 22 1HD LYS 22 -10.367 9.297 -12.820
181 HE2 LYS 22 2HE LYS 22 -10.065 11.685 -14.691
182 HE3 LYS 22 1HE LYS 22 -11.416 10.552 -14.658
183 HZ1 LYS 22 3HZ LYS 22 -12.034 12.501 -13.465
184 HZ2 LYS 22 1HZ LYS 22 -10.641 12.449 -12.508
185 HZ3 LYS 22 2HZ LYS 22 -11.828 11.259 -12.340
186 H ASN 23 H ASN 23 -6.632 14.251 -13.577
187 HA ASN 23 HA ASN 23 -4.457 13.959 -15.467
188 HB2 ASN 23 2HB ASN 23 -6.309 16.309 -14.896
189 HB3 ASN 23 1HB ASN 23 -5.096 16.310 -16.173
190 HD21 ASN 23 1HD2 ASN 23 -5.335 14.832 -17.935
191 HD22 ASN 23 2HD2 ASN 23 -6.892 14.202 -18.346
192 H LEU 24 H LEU 24 -4.749 15.318 -12.306
193 HA LEU 24 HA LEU 24 -2.128 16.660 -12.485
194 HB2 LEU 24 2HB LEU 24 -4.037 16.510 -10.115
195 HB3 LEU 24 1HB LEU 24 -2.564 17.464 -10.201
196 HG LEU 24 HG LEU 24 -5.175 17.941 -11.685
197 HD11 LEU 24 1HD1 LEU 24 -5.118 18.765 -9.395
198 HD12 LEU 24 2HD1 LEU 24 -5.153 20.104 -10.539
199 HD13 LEU 24 3HD1 LEU 24 -3.642 19.677 -9.728
200 HD21 LEU 24 3HD2 LEU 24 -4.109 19.877 -12.793
201 HD22 LEU 24 1HD2 LEU 24 -3.409 18.345 -13.306
202 HD23 LEU 24 2HD2 LEU 24 -2.537 19.372 -12.164
203 H GLU 25 H GLU 25 -0.517 16.163 -10.750
204 HA GLU 25 HA GLU 25 0.108 13.393 -10.790
205 HB2 GLU 25 2HB GLU 25 1.414 15.667 -9.239
206 HB3 GLU 25 1HB GLU 25 2.081 14.038 -9.387
207 HG2 GLU 25 2HG GLU 25 2.100 14.395 -11.908
208 HG3 GLU 25 1HG GLU 25 1.688 16.086 -11.591
209 HA PRO 26 HA PRO 26 -2.282 12.188 -7.248
210 HB2 PRO 26 2HB PRO 26 -0.834 9.625 -7.107
211 HB3 PRO 26 1HB PRO 26 -2.463 9.946 -7.723
212 HG2 PRO 26 2HG PRO 26 -0.410 9.206 -9.347
213 HG3 PRO 26 1HG PRO 26 -1.746 10.246 -9.891
214 HD2 PRO 26 2HD PRO 26 1.020 11.052 -9.003
215 HD3 PRO 26 1HD PRO 26 0.080 11.610 -10.409
216 H ARG 27 H ARG 27 -2.211 11.739 -4.997
217 HA ARG 27 HA ARG 27 0.240 12.664 -3.632
218 HB2 ARG 27 2HB ARG 27 -1.774 13.976 -3.206
219 HB3 ARG 27 1HB ARG 27 -2.670 12.530 -2.757
220 HG2 ARG 27 2HG ARG 27 -1.138 12.271 -0.771
221 HG3 ARG 27 1HG ARG 27 -0.384 13.806 -1.212
222 HD2 ARG 27 2HD ARG 27 -3.284 13.367 -0.420
223 HD3 ARG 27 1HD ARG 27 -2.041 14.171 0.546
224 HE ARG 27 HE ARG 27 -2.092 15.634 -1.752
225 HH11 ARG 27 1HH1 ARG 27 -4.662 14.736 0.506
226 HH12 ARG 27 2HH1 ARG 27 -5.594 16.161 0.176
227 HH21 ARG 27 1HH2 ARG 27 -3.336 17.476 -2.151
228 HH22 ARG 27 2HH2 ARG 27 -4.847 17.710 -1.328
229 H TRP 28 H TRP 28 1.466 11.165 -2.606
230 HA TRP 28 HA TRP 28 0.532 8.503 -2.048
231 HB2 TRP 28 2HB TRP 28 2.757 8.124 -1.023
232 HB3 TRP 28 1HB TRP 28 2.907 8.860 -2.613
233 HD1 TRP 28 HD1 TRP 28 3.957 11.329 -2.730
234 HE1 TRP 28 HE1 TRP 28 5.238 12.747 -1.016
235 HE3 TRP 28 HE3 TRP 28 2.906 8.668 1.522
236 HZ2 TRP 28 HZ2 TRP 28 5.748 12.747 1.739
237 HZ3 TRP 28 HZ3 TRP 28 3.831 9.455 3.663
238 HH2 TRP 28 HH2 TRP 28 5.225 11.460 3.763
239 H LYS 29 H LYS 29 -0.020 7.621 -0.110
240 HA LYS 29 HA LYS 29 -0.394 9.391 2.244
241 HB2 LYS 29 2HB LYS 29 -2.256 7.151 1.301
242 HB3 LYS 29 1HB LYS 29 -2.485 8.156 2.731
243 HG2 LYS 29 2HG LYS 29 -2.806 10.143 1.279
244 HG3 LYS 29 1HG LYS 29 -2.557 9.134 -0.150
245 HD2 LYS 29 2HD LYS 29 -4.959 9.549 0.256
246 HD3 LYS 29 1HD LYS 29 -4.573 7.832 0.378
247 HE2 LYS 29 2HE LYS 29 -6.142 8.560 2.146
248 HE3 LYS 29 1HE LYS 29 -4.627 7.979 2.838
249 HZ1 LYS 29 3HZ LYS 29 -5.376 9.999 3.920
250 HZ2 LYS 29 1HZ LYS 29 -5.384 10.833 2.447
251 HZ3 LYS 29 2HZ LYS 29 -3.924 10.288 3.105
252 H GLY 30 H GLY 30 0.161 8.413 4.256
253 HA2 GLY 30 2HA GLY 30 0.288 5.717 4.828
254 HA3 GLY 30 1HA GLY 30 1.848 6.084 4.142
255 HA PRO 31 HA PRO 31 2.874 4.766 5.432
256 HB2 PRO 31 2HB PRO 31 4.030 3.547 7.542
257 HB3 PRO 31 1HB PRO 31 4.688 5.067 6.892
258 HG2 PRO 31 2HG PRO 31 3.080 4.626 9.377
259 HG3 PRO 31 1HG PRO 31 4.391 5.785 9.069
260 HD2 PRO 31 2HD PRO 31 1.595 6.333 8.941
261 HD3 PRO 31 1HD PRO 31 2.905 7.400 8.395
262 H TYR 32 H TYR 32 1.321 3.409 4.751
263 HA TYR 32 HA TYR 32 -0.556 2.010 6.430
264 HB2 TYR 32 2HB TYR 32 0.179 1.806 3.487
265 HB3 TYR 32 1HB TYR 32 -0.989 0.732 4.236
266 HD1 TYR 32 HD1 TYR 32 -3.189 1.539 4.935
267 HD2 TYR 32 HD2 TYR 32 -0.382 4.199 3.124
268 HE1 TYR 32 HE1 TYR 32 -4.978 3.190 4.602
269 HE2 TYR 32 HE2 TYR 32 -2.167 5.840 2.796
270 HH TYR 32 HH TYR 32 -5.197 5.624 4.296
271 H THR 33 H THR 33 -0.682 -0.443 6.316
272 HA THR 33 HA THR 33 1.992 -1.716 6.461
273 HB THR 33 HB THR 33 1.180 -3.008 8.457
274 HG1 THR 33 HG1 THR 33 -1.002 -2.884 8.344
275 HG21 THR 33 3HG2 THR 33 1.395 -1.214 10.128
276 HG22 THR 33 1HG2 THR 33 1.108 0.001 8.881
277 HG23 THR 33 2HG2 THR 33 2.566 -0.993 8.824
278 H VAL 34 H VAL 34 2.007 -3.181 4.797
279 HA VAL 34 HA VAL 34 -0.345 -4.543 3.851
280 HB VAL 34 HB VAL 34 2.555 -5.351 3.305
281 HG11 VAL 34 1HG1 VAL 34 1.688 -6.429 1.263
282 HG12 VAL 34 2HG1 VAL 34 0.042 -5.975 1.714
283 HG13 VAL 34 3HG1 VAL 34 0.946 -7.115 2.711
284 HG21 VAL 34 3HG2 VAL 34 0.829 -3.440 1.688
285 HG22 VAL 34 1HG2 VAL 34 2.430 -4.023 1.225
286 HG23 VAL 34 2HG2 VAL 34 2.240 -3.003 2.650
287 H LEU 35 H LEU 35 -1.216 -6.380 4.550
288 HA LEU 35 HA LEU 35 0.082 -7.915 6.729
289 HB2 LEU 35 2HB LEU 35 -2.857 -7.794 5.936
290 HB3 LEU 35 1HB LEU 35 -2.195 -8.645 7.327
291 HG LEU 35 HG LEU 35 -2.266 -5.616 6.943
292 HD11 LEU 35 1HD1 LEU 35 -4.470 -6.551 7.423
293 HD12 LEU 35 2HD1 LEU 35 -3.878 -5.606 8.786
294 HD13 LEU 35 3HD1 LEU 35 -3.840 -7.371 8.857
295 HD21 LEU 35 3HD2 LEU 35 -0.257 -6.238 8.180
296 HD22 LEU 35 1HD2 LEU 35 -1.209 -7.208 9.308
297 HD23 LEU 35 2HD2 LEU 35 -1.415 -5.454 9.249
298 H LEU 36 H LEU 36 -1.399 -8.089 3.552
299 HA LEU 36 HA LEU 36 -0.409 -10.814 3.119
300 HB2 LEU 36 2HB LEU 36 -2.744 -11.020 4.027
301 HB3 LEU 36 1HB LEU 36 -3.330 -10.041 2.698
302 HG LEU 36 HG LEU 36 -2.632 -11.820 1.085
303 HD11 LEU 36 1HD1 LEU 36 -0.779 -12.778 2.327
304 HD12 LEU 36 2HD1 LEU 36 -1.945 -14.023 1.891
305 HD13 LEU 36 3HD1 LEU 36 -1.890 -13.412 3.547
306 HD21 LEU 36 3HD2 LEU 36 -4.472 -12.828 3.284
307 HD22 LEU 36 1HD2 LEU 36 -4.380 -13.458 1.634
308 HD23 LEU 36 2HD2 LEU 36 -4.939 -11.812 1.917
309 H THR 37 H THR 37 -0.215 -11.340 0.907
310 HA THR 37 HA THR 37 -0.605 -9.187 -1.083
311 HB THR 37 HB THR 37 1.906 -10.889 -0.743
312 HG1 THR 37 HG1 THR 37 1.211 -8.347 0.055
313 HG21 THR 37 3HG2 THR 37 2.857 -9.532 -2.629
314 HG22 THR 37 1HG2 THR 37 1.248 -8.876 -2.925
315 HG23 THR 37 2HG2 THR 37 1.548 -10.599 -3.136
316 H THR 38 H THR 38 -1.639 -9.891 -2.772
317 HA THR 38 HA THR 38 -1.726 -12.737 -3.577
318 HB THR 38 HB THR 38 -4.081 -12.215 -4.386
319 HG1 THR 38 HG1 THR 38 -3.518 -9.784 -4.145
320 HG21 THR 38 3HG2 THR 38 -3.856 -13.380 -2.240
321 HG22 THR 38 1HG2 THR 38 -5.196 -12.233 -2.150
322 HG23 THR 38 2HG2 THR 38 -3.648 -11.848 -1.390
323 HA PRO 39 HA PRO 39 -0.315 -11.610 -7.754
324 HB2 PRO 39 2HB PRO 39 -3.061 -12.443 -8.742
325 HB3 PRO 39 1HB PRO 39 -1.460 -12.854 -9.398
326 HG2 PRO 39 2HG PRO 39 -2.772 -14.636 -7.936
327 HG3 PRO 39 1HG PRO 39 -1.019 -14.426 -7.725
328 HD2 PRO 39 2HD PRO 39 -3.246 -13.537 -5.924
329 HD3 PRO 39 1HD PRO 39 -1.590 -14.046 -5.513
330 H THR 40 H THR 40 -0.108 -9.420 -7.784
331 HA THR 40 HA THR 40 -0.271 -7.370 -8.672
332 HB THR 40 HB THR 40 -3.002 -8.089 -9.829
333 HG1 THR 40 HG1 THR 40 -0.491 -9.064 -10.403
334 HG21 THR 40 3HG2 THR 40 -2.368 -6.511 -11.642
335 HG22 THR 40 1HG2 THR 40 -0.863 -6.147 -10.806
336 HG23 THR 40 2HG2 THR 40 -2.406 -5.692 -10.076
337 H ALA 41 H ALA 41 -2.035 -8.430 -6.154
338 HA ALA 41 HA ALA 41 -3.288 -5.817 -5.544
339 HB1 ALA 41 3HB ALA 41 -5.273 -6.999 -4.648
340 HB2 ALA 41 1HB ALA 41 -4.594 -8.543 -5.180
341 HB3 ALA 41 2HB ALA 41 -5.055 -7.322 -6.367
342 H LEU 42 H LEU 42 -2.532 -5.106 -3.614
343 HA LEU 42 HA LEU 42 -1.407 -6.966 -1.636
344 HB2 LEU 42 2HB LEU 42 -1.269 -3.921 -1.728
345 HB3 LEU 42 1HB LEU 42 -0.426 -4.958 -0.581
346 HG LEU 42 HG LEU 42 0.093 -4.743 -3.571
347 HD11 LEU 42 1HD1 LEU 42 1.004 -2.884 -2.296
348 HD12 LEU 42 2HD1 LEU 42 2.283 -3.904 -2.942
349 HD13 LEU 42 3HD1 LEU 42 1.859 -4.000 -1.229
350 HD21 LEU 42 3HD2 LEU 42 1.922 -6.325 -3.258
351 HD22 LEU 42 1HD2 LEU 42 0.370 -7.064 -2.888
352 HD23 LEU 42 2HD2 LEU 42 1.448 -6.576 -1.575
353 H LYS 43 H LYS 43 -2.731 -7.588 -0.016
354 HA LYS 43 HA LYS 43 -5.043 -5.991 0.770
355 HB2 LYS 43 2HB LYS 43 -5.236 -8.478 0.769
356 HB3 LYS 43 1HB LYS 43 -3.958 -8.580 1.977
357 HG2 LYS 43 2HG LYS 43 -5.373 -7.329 3.577
358 HG3 LYS 43 1HG LYS 43 -6.658 -7.241 2.366
359 HD2 LYS 43 2HD LYS 43 -6.845 -9.716 2.397
360 HD3 LYS 43 1HD LYS 43 -5.546 -9.801 3.595
361 HE2 LYS 43 2HE LYS 43 -6.954 -8.460 5.151
362 HE3 LYS 43 1HE LYS 43 -8.261 -8.495 3.966
363 HZ1 LYS 43 3HZ LYS 43 -7.040 -10.851 5.289
364 HZ2 LYS 43 1HZ LYS 43 -8.288 -10.906 4.148
365 HZ3 LYS 43 2HZ LYS 43 -8.547 -10.180 5.656
366 H VAL 44 H VAL 44 -4.677 -4.305 1.964
367 HA VAL 44 HA VAL 44 -2.387 -4.156 3.845
368 HB VAL 44 HB VAL 44 -3.635 -1.907 2.188
369 HG11 VAL 44 1HG1 VAL 44 -2.679 -1.091 4.293
370 HG12 VAL 44 2HG1 VAL 44 -1.737 -0.530 2.913
371 HG13 VAL 44 3HG1 VAL 44 -1.140 -1.861 3.905
372 HG21 VAL 44 3HG2 VAL 44 -1.570 -1.901 0.826
373 HG22 VAL 44 1HG2 VAL 44 -2.412 -3.449 0.704
374 HG23 VAL 44 2HG2 VAL 44 -0.975 -3.304 1.716
375 H ASP 45 H ASP 45 -2.790 -3.198 5.848
376 HA ASP 45 HA ASP 45 -5.444 -3.039 6.889
377 HB2 ASP 45 2HB ASP 45 -3.483 -3.698 8.278
378 HB3 ASP 45 1HB ASP 45 -2.797 -2.092 8.073
379 H GLY 46 H GLY 46 -6.695 -1.225 7.288
380 HA2 GLY 46 2HA GLY 46 -7.354 1.019 7.250
381 HA3 GLY 46 1HA GLY 46 -5.771 1.481 6.637
382 H ILE 47 H ILE 47 -6.923 -1.106 4.869
383 HA ILE 47 HA ILE 47 -8.029 0.598 2.696
384 HB ILE 47 HB ILE 47 -6.286 -1.907 2.546
385 HG12 ILE 47 2HG1 ILE 47 -4.975 0.106 2.985
386 HG13 ILE 47 1HG1 ILE 47 -4.666 -0.433 1.341
387 HG21 ILE 47 1HG2 ILE 47 -6.372 -1.769 0.086
388 HG22 ILE 47 2HG2 ILE 47 -7.554 -0.464 0.196
389 HG23 ILE 47 3HG2 ILE 47 -7.968 -2.078 0.774
390 HD11 ILE 47 3HD1 ILE 47 -4.806 1.954 1.448
391 HD12 ILE 47 1HD1 ILE 47 -6.406 1.878 2.180
392 HD13 ILE 47 2HD1 ILE 47 -6.169 1.337 0.513
393 H ALA 48 H ALA 48 -9.790 -0.286 1.499
394 HA ALA 48 HA ALA 48 -11.808 -1.534 2.939
395 HB1 ALA 48 3HB ALA 48 -11.561 -1.379 -0.085
396 HB2 ALA 48 1HB ALA 48 -12.203 -0.112 0.961
397 HB3 ALA 48 2HB ALA 48 -13.050 -1.651 0.821
398 H ALA 49 H ALA 49 -9.824 -3.005 0.317
399 HA ALA 49 HA ALA 49 -9.829 -5.565 1.726
400 HB1 ALA 49 3HB ALA 49 -10.631 -6.869 -0.198
401 HB2 ALA 49 1HB ALA 49 -10.892 -5.385 -1.124
402 HB3 ALA 49 2HB ALA 49 -11.858 -5.712 0.317
403 H TRP 50 H TRP 50 -8.942 -4.112 -1.452
404 HA TRP 50 HA TRP 50 -6.129 -4.920 -1.092
405 HB2 TRP 50 2HB TRP 50 -7.753 -5.604 -3.587
406 HB3 TRP 50 1HB TRP 50 -6.012 -5.805 -3.436
407 HD1 TRP 50 HD1 TRP 50 -5.204 -7.741 -1.570
408 HE1 TRP 50 HE1 TRP 50 -6.328 -9.977 -0.993
409 HE3 TRP 50 HE3 TRP 50 -9.890 -6.827 -3.433
410 HZ2 TRP 50 HZ2 TRP 50 -8.847 -11.214 -1.291
411 HZ3 TRP 50 HZ3 TRP 50 -11.597 -8.597 -3.260
412 HH2 TRP 50 HH2 TRP 50 -11.085 -10.748 -2.212
413 H ILE 51 H ILE 51 -4.649 -3.770 -2.414
414 HA ILE 51 HA ILE 51 -5.670 -1.524 -4.067
415 HB ILE 51 HB ILE 51 -3.104 -1.595 -2.393
416 HG12 ILE 51 2HG1 ILE 51 -5.165 -0.979 -1.116
417 HG13 ILE 51 1HG1 ILE 51 -4.012 0.345 -1.185
418 HG21 ILE 51 1HG2 ILE 51 -2.608 0.685 -3.275
419 HG22 ILE 51 2HG2 ILE 51 -3.958 0.527 -4.401
420 HG23 ILE 51 3HG2 ILE 51 -2.566 -0.550 -4.536
421 HD11 ILE 51 3HD1 ILE 51 -6.287 1.113 -1.446
422 HD12 ILE 51 1HD1 ILE 51 -6.510 0.081 -2.858
423 HD13 ILE 51 2HD1 ILE 51 -5.363 1.427 -2.914
424 H HIS 52 H HIS 52 -4.993 -1.592 -6.176
425 HA HIS 52 HA HIS 52 -3.422 -3.656 -7.308
426 HB2 HIS 52 2HB HIS 52 -5.083 -2.163 -8.533
427 HB3 HIS 52 1HB HIS 52 -3.916 -0.853 -8.424
428 HD1 HIS 52 HD1 HIS 52 -1.717 -1.122 -9.892
429 HD2 HIS 52 HD2 HIS 52 -4.713 -3.895 -10.639
430 HE1 HIS 52 HE1 HIS 52 -1.150 -2.145 -12.111
431 HE2 HIS 52 HE2 HIS 52 -2.976 -3.819 -12.534
432 H ALA 53 H ALA 53 -1.271 -3.948 -7.093
433 HA ALA 53 HA ALA 53 0.172 -2.611 -5.143
434 HB1 ALA 53 3HB ALA 53 2.028 -4.101 -5.680
435 HB2 ALA 53 1HB ALA 53 1.312 -4.468 -7.254
436 HB3 ALA 53 2HB ALA 53 0.499 -4.980 -5.773
437 H ALA 54 H ALA 54 0.113 -1.788 -8.520
438 HA ALA 54 HA ALA 54 2.548 -0.451 -8.854
439 HB1 ALA 54 3HB ALA 54 1.024 -0.995 -10.706
440 HB2 ALA 54 1HB ALA 54 1.458 0.715 -10.722
441 HB3 ALA 54 2HB ALA 54 -0.128 0.208 -10.126
442 H HIS 55 H HIS 55 -0.388 0.626 -7.243
443 HA HIS 55 HA HIS 55 0.278 3.403 -7.007
444 HB2 HIS 55 2HB HIS 55 -1.674 1.653 -5.456
445 HB3 HIS 55 1HB HIS 55 -1.504 3.382 -5.172
446 HD1 HIS 55 HD1 HIS 55 -2.010 4.921 -7.313
447 HD2 HIS 55 HD2 HIS 55 -3.508 1.050 -7.422
448 HE1 HIS 55 HE1 HIS 55 -3.726 4.915 -9.133
449 HE2 HIS 55 HE2 HIS 55 -4.561 2.556 -9.238
450 H VAL 56 H VAL 56 1.298 0.573 -5.353
451 HA VAL 56 HA VAL 56 1.949 1.966 -2.847
452 HB VAL 56 HB VAL 56 2.003 -1.005 -3.558
453 HG11 VAL 56 1HG1 VAL 56 3.616 -0.525 -1.771
454 HG12 VAL 56 2HG1 VAL 56 2.229 -1.402 -1.117
455 HG13 VAL 56 3HG1 VAL 56 2.376 0.337 -0.857
456 HG21 VAL 56 3HG2 VAL 56 -0.037 -1.191 -2.179
457 HG22 VAL 56 1HG2 VAL 56 -0.294 -0.086 -3.533
458 HG23 VAL 56 2HG2 VAL 56 -0.027 0.553 -1.908
459 H LYS 57 H LYS 57 3.963 2.289 -2.176
460 HA LYS 57 HA LYS 57 6.299 1.112 -3.546
461 HB2 LYS 57 2HB LYS 57 5.934 3.443 -4.388
462 HB3 LYS 57 1HB LYS 57 5.957 4.039 -2.732
463 HG2 LYS 57 2HG LYS 57 8.350 3.174 -2.572
464 HG3 LYS 57 1HG LYS 57 8.272 2.856 -4.307
465 HD2 LYS 57 2HD LYS 57 9.361 5.022 -3.908
466 HD3 LYS 57 1HD LYS 57 7.809 5.278 -4.714
467 HE2 LYS 57 2HE LYS 57 6.780 5.880 -2.544
468 HE3 LYS 57 1HE LYS 57 8.319 5.579 -1.731
469 HZ1 LYS 57 3HZ LYS 57 9.304 7.365 -3.040
470 HZ2 LYS 57 1HZ LYS 57 8.012 7.920 -2.108
471 HZ3 LYS 57 2HZ LYS 57 7.810 7.683 -3.767
472 H ALA 58 H ALA 58 7.988 0.627 -2.089
473 HA ALA 58 HA ALA 58 7.345 0.112 0.610
474 HB1 ALA 58 3HB ALA 58 9.020 -1.185 -0.645
475 HB2 ALA 58 1HB ALA 58 9.718 -0.539 0.842
476 HB3 ALA 58 2HB ALA 58 10.081 0.222 -0.710
477 H ALA 59 H ALA 59 7.254 1.482 2.278
478 HA ALA 59 HA ALA 59 8.400 4.179 2.187
479 HB1 ALA 59 3HB ALA 59 6.098 3.893 3.026
480 HB2 ALA 59 1HB ALA 59 7.151 4.536 4.290
481 HB3 ALA 59 2HB ALA 59 6.685 2.833 4.305
482 H ASP 60 H ASP 60 9.978 4.901 3.589
483 HA ASP 60 HA ASP 60 11.555 2.892 5.068
484 HB2 ASP 60 2HB ASP 60 12.701 4.326 3.336
485 HB3 ASP 60 1HB ASP 60 12.293 5.756 4.265
486 HA PRO 61 HA PRO 61 9.793 5.102 8.726
487 HB2 PRO 61 2HB PRO 61 9.454 3.006 10.351
488 HB3 PRO 61 1HB PRO 61 8.412 3.175 8.916
489 HG2 PRO 61 2HG PRO 61 10.829 1.407 9.282
490 HG3 PRO 61 1HG PRO 61 9.246 1.018 8.565
491 HD2 PRO 61 2HD PRO 61 11.493 1.757 7.076
492 HD3 PRO 61 1HD PRO 61 9.820 1.880 6.508
493 H GLY 62 H GLY 62 12.749 3.671 8.051
494 HA2 GLY 62 2HA GLY 62 14.718 4.417 9.398
495 HA3 GLY 62 1HA GLY 62 13.850 3.825 10.813
496 H GLY 63 H GLY 63 12.706 1.509 9.708
497 HA2 GLY 63 2HA GLY 63 13.875 -0.238 8.095
498 HA3 GLY 63 1HA GLY 63 15.007 -0.302 9.441
499 H GLY 64 H GLY 64 13.095 -2.337 8.305
500 HA2 GLY 64 2HA GLY 64 12.093 -4.192 9.258
501 HA3 GLY 64 1HA GLY 64 12.159 -3.416 10.832
502 HA PRO 65 HA PRO 65 7.707 -3.496 9.266
503 HB2 PRO 65 2HB PRO 65 6.522 -4.799 11.331
504 HB3 PRO 65 1HB PRO 65 7.490 -5.689 10.129
505 HG2 PRO 65 2HG PRO 65 8.312 -4.739 12.872
506 HG3 PRO 65 1HG PRO 65 8.555 -6.334 12.121
507 HD2 PRO 65 2HD PRO 65 10.507 -4.402 12.163
508 HD3 PRO 65 1HD PRO 65 10.387 -5.621 10.875
509 H SER 66 H SER 66 5.908 -2.218 9.881
510 HA SER 66 HA SER 66 6.376 -0.076 11.789
511 HB2 SER 66 2HB SER 66 5.334 0.347 9.538
512 HB3 SER 66 1HB SER 66 3.932 -0.593 10.041
513 HG SER 66 HG SER 66 4.889 1.823 11.201
514 H SER 67 H SER 67 4.027 -2.714 11.304
515 HA SER 67 HA SER 67 2.763 -2.377 13.905
516 HB2 SER 67 2HB SER 67 2.423 -4.631 11.874
517 HB3 SER 67 1HB SER 67 1.346 -4.261 13.226
518 HG SER 67 HG SER 67 1.326 -2.067 12.035
519 H ARG 68 H ARG 68 2.556 -4.298 15.373
520 HA ARG 68 HA ARG 68 5.097 -5.640 15.869
521 HB2 ARG 68 2HB ARG 68 2.462 -6.006 17.366
522 HB3 ARG 68 1HB ARG 68 4.071 -6.452 17.931
523 HG2 ARG 68 2HG ARG 68 2.954 -3.646 17.567
524 HG3 ARG 68 1HG ARG 68 3.330 -4.453 19.092
525 HD2 ARG 68 2HD ARG 68 5.357 -3.652 16.972
526 HD3 ARG 68 1HD ARG 68 5.022 -2.759 18.454
527 HE ARG 68 HE ARG 68 5.709 -5.135 19.454
528 HH11 ARG 68 1HH1 ARG 68 7.325 -3.216 16.969
529 HH12 ARG 68 2HH1 ARG 68 8.900 -3.819 17.371
530 HH21 ARG 68 1HH2 ARG 68 7.802 -5.882 19.968
531 HH22 ARG 68 2HH2 ARG 68 9.169 -5.313 19.057
532 H LEU 69 H LEU 69 5.481 -7.817 15.563
533 HA LEU 69 HA LEU 69 3.939 -9.064 13.434
534 HB2 LEU 69 2HB LEU 69 6.573 -9.886 14.730
535 HB3 LEU 69 1HB LEU 69 5.898 -10.585 13.268
536 HG LEU 69 HG LEU 69 6.925 -7.734 13.594
537 HD11 LEU 69 1HD1 LEU 69 8.665 -8.380 11.990
538 HD12 LEU 69 2HD1 LEU 69 8.047 -10.035 11.962
539 HD13 LEU 69 3HD1 LEU 69 8.734 -9.371 13.448
540 HD21 LEU 69 3HD2 LEU 69 6.508 -7.490 11.165
541 HD22 LEU 69 1HD2 LEU 69 5.025 -7.703 12.093
542 HD23 LEU 69 2HD2 LEU 69 5.681 -9.050 11.159
543 H THR 70 H THR 70 2.747 -9.098 16.126
544 HA THR 70 HA THR 70 2.995 -11.689 17.321
545 HB THR 70 HB THR 70 1.097 -10.949 18.761
546 HG1 THR 70 HG1 THR 70 1.073 -8.453 17.409
547 HG21 THR 70 3HG2 THR 70 2.156 -8.963 19.794
548 HG22 THR 70 1HG2 THR 70 3.167 -8.749 18.361
549 HG23 THR 70 2HG2 THR 70 3.370 -10.177 19.380
550 H TRP 71 H TRP 71 0.802 -10.174 15.014
551 HA TRP 71 HA TRP 71 -1.244 -12.144 14.966
552 HB2 TRP 71 2HB TRP 71 -0.454 -9.955 13.001
553 HB3 TRP 71 1HB TRP 71 -1.825 -11.021 12.710
554 HD1 TRP 71 HD1 TRP 71 -0.785 -8.009 14.818
555 HE1 TRP 71 HE1 TRP 71 -2.846 -7.126 16.084
556 HE3 TRP 71 HE3 TRP 71 -4.091 -11.781 13.761
557 HZ2 TRP 71 HZ2 TRP 71 -5.504 -7.914 16.580
558 HZ3 TRP 71 HZ3 TRP 71 -6.377 -11.641 14.678
559 HH2 TRP 71 HH2 TRP 71 -7.066 -9.743 16.060
560 H ARG 72 H ARG 72 -0.875 -14.203 14.424
561 HA ARG 72 HA ARG 72 1.023 -15.023 12.379
562 HB2 ARG 72 2HB ARG 72 -0.872 -16.639 14.139
563 HB3 ARG 72 1HB ARG 72 0.195 -17.353 12.945
564 HG2 ARG 72 2HG ARG 72 2.152 -16.386 14.193
565 HG3 ARG 72 1HG ARG 72 1.027 -15.856 15.449
566 HD2 ARG 72 2HD ARG 72 0.351 -18.224 15.811
567 HD3 ARG 72 1HD ARG 72 1.507 -18.737 14.577
568 HE ARG 72 HE ARG 72 2.963 -17.283 16.427
569 HH11 ARG 72 1HH1 ARG 72 1.008 -20.216 16.555
570 HH12 ARG 72 2HH1 ARG 72 1.924 -20.910 17.854
571 HH21 ARG 72 1HH2 ARG 72 4.161 -18.222 18.118
572 HH22 ARG 72 2HH2 ARG 72 3.711 -19.778 18.738
573 H VAL 73 H VAL 73 -0.525 -13.469 11.035
574 HA VAL 73 HA VAL 73 -2.609 -14.879 9.585
575 HB VAL 73 HB VAL 73 -1.053 -12.345 8.845
576 HG11 VAL 73 1HG1 VAL 73 -3.650 -13.404 7.666
577 HG12 VAL 73 2HG1 VAL 73 -2.084 -13.352 6.855
578 HG13 VAL 73 3HG1 VAL 73 -2.908 -11.850 7.276
579 HG21 VAL 73 3HG2 VAL 73 -2.273 -12.044 10.963
580 HG22 VAL 73 1HG2 VAL 73 -3.771 -12.584 10.197
581 HG23 VAL 73 2HG2 VAL 73 -3.009 -11.075 9.684
582 H GLN 74 H GLN 74 0.798 -14.094 9.284
583 HA GLN 74 HA GLN 74 1.195 -15.389 6.717
584 HB2 GLN 74 2HB GLN 74 3.560 -14.613 7.006
585 HB3 GLN 74 1HB GLN 74 2.377 -13.319 7.097
586 HG2 GLN 74 2HG GLN 74 2.647 -13.104 9.475
587 HG3 GLN 74 1HG GLN 74 3.570 -14.604 9.577
588 HE21 GLN 74 1HE2 GLN 74 4.261 -11.788 10.357
589 HE22 GLN 74 2HE2 GLN 74 5.760 -11.468 9.565
590 H ARG 75 H ARG 75 0.648 -16.918 9.456
591 HA ARG 75 HA ARG 75 2.985 -18.231 10.289
592 HB2 ARG 75 2HB ARG 75 1.487 -19.803 11.484
593 HB3 ARG 75 1HB ARG 75 1.001 -18.131 11.699
594 HG2 ARG 75 2HG ARG 75 -0.787 -18.490 9.957
595 HG3 ARG 75 1HG ARG 75 -0.346 -20.196 9.934
596 HD2 ARG 75 2HD ARG 75 -1.476 -18.635 12.286
597 HD3 ARG 75 1HD ARG 75 -2.294 -19.893 11.352
598 HE ARG 75 HE ARG 75 0.101 -20.898 12.522
599 HH11 ARG 75 1HH1 ARG 75 -3.237 -20.115 13.366
600 HH12 ARG 75 2HH1 ARG 75 -3.274 -21.213 14.703
601 HH21 ARG 75 1HH2 ARG 75 0.039 -22.286 14.317
602 HH22 ARG 75 2HH2 ARG 75 -1.419 -22.440 15.240
603 H SER 76 H SER 76 4.191 -19.809 9.413
604 HA SER 76 HA SER 76 3.211 -21.781 7.529
605 HB2 SER 76 2HB SER 76 3.475 -19.596 6.187
606 HB3 SER 76 1HB SER 76 5.202 -19.697 6.508
607 HG SER 76 HG SER 76 3.628 -21.645 5.144
608 H GLN 77 H GLN 77 5.565 -22.649 6.405
609 HA GLN 77 HA GLN 77 7.094 -23.832 8.496
610 HB2 GLN 77 2HB GLN 77 6.839 -24.879 6.259
611 HB3 GLN 77 1HB GLN 77 7.710 -23.546 5.514
612 HG2 GLN 77 2HG GLN 77 9.158 -25.505 5.704
613 HG3 GLN 77 1HG GLN 77 9.764 -24.197 6.724
614 HE21 GLN 77 1HE2 GLN 77 10.929 -25.638 8.049
615 HE22 GLN 77 2HE2 GLN 77 10.155 -26.710 9.165
616 H ASN 78 H ASN 78 7.662 -21.102 6.313
617 HA ASN 78 HA ASN 78 9.891 -20.105 8.001
618 HB2 ASN 78 2HB ASN 78 9.533 -19.904 4.967
619 HB3 ASN 78 1HB ASN 78 10.763 -19.018 5.867
620 HD21 ASN 78 1HD2 ASN 78 11.098 -20.988 3.748
621 HD22 ASN 78 2HD2 ASN 78 12.081 -22.249 4.410
622 HA PRO 79 HA PRO 79 7.306 -16.330 8.205
623 HB2 PRO 79 2HB PRO 79 9.791 -14.822 8.869
624 HB3 PRO 79 1HB PRO 79 8.347 -15.085 9.869
625 HG2 PRO 79 2HG PRO 79 10.697 -16.274 10.456
626 HG3 PRO 79 1HG PRO 79 9.136 -17.080 10.755
627 HD2 PRO 79 2HD PRO 79 11.049 -17.482 8.445
628 HD3 PRO 79 1HD PRO 79 10.192 -18.703 9.417
629 H LEU 80 H LEU 80 6.938 -14.557 6.862
630 HA LEU 80 HA LEU 80 8.241 -14.540 4.270
631 HB2 LEU 80 2HB LEU 80 6.099 -12.690 5.395
632 HB3 LEU 80 1HB LEU 80 6.520 -12.877 3.696
633 HG LEU 80 HG LEU 80 5.300 -15.077 5.426
634 HD11 LEU 80 1HD1 LEU 80 3.212 -14.697 4.220
635 HD12 LEU 80 2HD1 LEU 80 3.932 -13.326 3.374
636 HD13 LEU 80 3HD1 LEU 80 3.705 -13.266 5.122
637 HD21 LEU 80 3HD2 LEU 80 4.928 -16.271 3.317
638 HD22 LEU 80 1HD2 LEU 80 6.643 -15.980 3.589
639 HD23 LEU 80 2HD2 LEU 80 5.756 -14.992 2.423
640 H LYS 81 H LYS 81 8.750 -12.174 3.346
641 HA LYS 81 HA LYS 81 10.373 -10.673 5.308
642 HB2 LYS 81 2HB LYS 81 11.792 -12.473 4.242
643 HB3 LYS 81 1HB LYS 81 11.486 -11.746 2.673
644 HG2 LYS 81 2HG LYS 81 13.670 -11.040 3.386
645 HG3 LYS 81 1HG LYS 81 12.605 -9.637 3.490
646 HD2 LYS 81 2HD LYS 81 14.074 -9.729 5.445
647 HD3 LYS 81 1HD LYS 81 12.401 -9.983 5.951
648 HE2 LYS 81 2HE LYS 81 12.800 -12.401 6.133
649 HE3 LYS 81 1HE LYS 81 14.436 -12.204 5.502
650 HZ1 LYS 81 3HZ LYS 81 15.009 -10.917 7.440
651 HZ2 LYS 81 1HZ LYS 81 14.419 -12.431 7.899
652 HZ3 LYS 81 2HZ LYS 81 13.442 -11.062 8.055
653 H ILE 82 H ILE 82 10.581 -8.537 4.891
654 HA ILE 82 HA ILE 82 9.766 -7.422 2.264
655 HB ILE 82 HB ILE 82 8.962 -5.384 3.365
656 HG12 ILE 82 2HG1 ILE 82 9.689 -6.704 6.032
657 HG13 ILE 82 1HG1 ILE 82 10.520 -5.337 5.306
658 HG21 ILE 82 1HG2 ILE 82 7.324 -7.169 3.075
659 HG22 ILE 82 2HG2 ILE 82 6.975 -6.275 4.554
660 HG23 ILE 82 3HG2 ILE 82 7.747 -7.860 4.644
661 HD11 ILE 82 3HD1 ILE 82 8.483 -3.980 5.563
662 HD12 ILE 82 1HD1 ILE 82 9.104 -4.595 7.093
663 HD13 ILE 82 2HD1 ILE 82 7.690 -5.345 6.356
664 H ARG 83 H ARG 83 11.011 -5.580 1.579
665 HA ARG 83 HA ARG 83 13.548 -5.041 3.013
666 HB2 ARG 83 2HB ARG 83 13.290 -5.416 -0.009
667 HB3 ARG 83 1HB ARG 83 14.753 -4.930 0.848
668 HG2 ARG 83 2HG ARG 83 14.836 -7.144 1.951
669 HG3 ARG 83 1HG ARG 83 13.356 -7.622 1.111
670 HD2 ARG 83 2HD ARG 83 16.070 -7.019 -0.122
671 HD3 ARG 83 1HD ARG 83 15.227 -8.573 -0.081
672 HE ARG 83 HE ARG 83 13.488 -6.936 -1.386
673 HH11 ARG 83 1HH1 ARG 83 16.851 -7.776 -1.977
674 HH12 ARG 83 2HH1 ARG 83 16.727 -7.538 -3.691
675 HH21 ARG 83 1HH2 ARG 83 13.346 -6.602 -3.614
676 HH22 ARG 83 2HH2 ARG 83 14.738 -6.869 -4.617
677 H LEU 84 H LEU 84 12.807 -3.125 3.792
678 HA LEU 84 HA LEU 84 11.596 -1.098 2.073
679 HB2 LEU 84 2HB LEU 84 12.372 -0.988 5.023
680 HB3 LEU 84 1HB LEU 84 11.403 0.209 4.166
681 HG LEU 84 HG LEU 84 10.595 -2.688 4.665
682 HD11 LEU 84 1HD1 LEU 84 10.552 -1.392 6.722
683 HD12 LEU 84 2HD1 LEU 84 8.924 -1.809 6.196
684 HD13 LEU 84 3HD1 LEU 84 9.532 -0.168 5.957
685 HD21 LEU 84 3HD2 LEU 84 9.652 -1.900 2.568
686 HD22 LEU 84 1HD2 LEU 84 9.037 -0.438 3.348
687 HD23 LEU 84 2HD2 LEU 84 8.387 -2.020 3.788
688 H THR 85 H THR 85 13.140 -0.478 0.646
689 HA THR 85 HA THR 85 15.903 -0.131 1.276
690 HB THR 85 HB THR 85 15.142 -0.843 -0.978
691 HG1 THR 85 HG1 THR 85 17.058 -0.053 -1.351
692 HG21 THR 85 3HG2 THR 85 14.167 0.740 -2.591
693 HG22 THR 85 1HG2 THR 85 14.117 2.000 -1.356
694 HG23 THR 85 2HG2 THR 85 13.102 0.564 -1.191
695 H ARG 86 H ARG 86 17.096 1.790 1.511
696 HA ARG 86 HA ARG 86 15.695 3.931 2.826
697 HB2 ARG 86 2HB ARG 86 17.892 3.198 3.671
698 HB3 ARG 86 1HB ARG 86 18.657 3.649 2.149
699 HG2 ARG 86 2HG ARG 86 18.064 6.030 2.576
700 HG3 ARG 86 1HG ARG 86 17.342 5.568 4.119
701 HD2 ARG 86 2HD ARG 86 19.533 4.843 4.945
702 HD3 ARG 86 1HD ARG 86 20.272 5.200 3.377
703 HE ARG 86 HE ARG 86 19.011 7.533 4.302
704 HH11 ARG 86 1HH1 ARG 86 21.769 5.546 5.237
705 HH12 ARG 86 2HH1 ARG 86 22.625 6.872 5.957
706 HH21 ARG 86 1HH2 ARG 86 20.165 9.255 5.226
707 HH22 ARG 86 2HH2 ARG 86 21.717 8.968 5.950
708 H GLU 87 H GLU 87 14.428 4.973 1.328
709 HA GLU 87 HA GLU 87 15.477 6.148 -1.099
710 HB2 GLU 87 2HB GLU 87 13.094 5.419 -0.866
711 HB3 GLU 87 1HB GLU 87 12.842 6.676 0.341
712 HG2 GLU 87 2HG GLU 87 13.265 8.417 -1.322
713 HG3 GLU 87 1HG GLU 87 13.656 7.200 -2.540
714 H ALA 88 H ALA 88 16.059 8.293 -1.433
715 HA ALA 88 HA ALA 88 17.077 9.852 0.696
716 HB1 ALA 88 3HB ALA 88 17.971 9.996 -1.595
717 HB2 ALA 88 1HB ALA 88 17.451 11.592 -1.044
718 HB3 ALA 88 2HB ALA 88 16.448 10.672 -2.169
719 HA PRO 89 HA PRO 89 13.069 11.483 2.012
720 HB2 PRO 89 2HB PRO 89 14.498 13.376 3.793
721 HB3 PRO 89 1HB PRO 89 13.498 11.975 4.228
722 HG2 PRO 89 2HG PRO 89 16.188 12.006 4.586
723 HG3 PRO 89 1HG PRO 89 15.282 10.518 4.230
724 HD2 PRO 89 2HD PRO 89 16.916 12.221 2.351
725 HD3 PRO 89 1HD PRO 89 16.825 10.449 2.478
Start of MODEL 15
1 H1 HIS 1 1H HIS 1 -13.104 -17.920 6.828
2 H2 HIS 1 2H HIS 1 -14.069 -16.722 6.129
3 H3 HIS 1 3H HIS 1 -12.658 -16.302 6.959
4 HA HIS 1 HA HIS 1 -12.759 -17.918 4.492
5 HB2 HIS 1 2HB HIS 1 -12.112 -14.974 4.904
6 HB3 HIS 1 1HB HIS 1 -11.641 -15.848 3.448
7 HD1 HIS 1 HD1 HIS 1 -13.694 -16.908 2.062
8 HD2 HIS 1 HD2 HIS 1 -14.679 -13.947 4.812
9 HE1 HIS 1 HE1 HIS 1 -15.988 -16.132 1.430
10 HE2 HIS 1 HE2 HIS 1 -16.494 -14.248 3.010
11 H HIS 2 H HIS 2 -11.372 -19.467 5.339
12 HA HIS 2 HA HIS 2 -8.758 -18.755 6.401
13 HB2 HIS 2 2HB HIS 2 -9.868 -21.480 5.573
14 HB3 HIS 2 1HB HIS 2 -8.331 -21.220 6.393
15 HD1 HIS 2 HD1 HIS 2 -8.426 -20.565 8.926
16 HD2 HIS 2 HD2 HIS 2 -12.139 -21.358 7.232
17 HE1 HIS 2 HE1 HIS 2 -10.010 -20.856 10.857
18 HE2 HIS 2 HE2 HIS 2 -12.202 -21.483 9.803
19 H HIS 3 H HIS 3 -7.777 -17.541 4.764
20 HA HIS 3 HA HIS 3 -6.536 -19.120 2.655
21 HB2 HIS 3 2HB HIS 3 -7.176 -17.739 0.790
22 HB3 HIS 3 1HB HIS 3 -8.661 -18.175 1.626
23 HD1 HIS 3 HD1 HIS 3 -6.783 -15.319 0.378
24 HD2 HIS 3 HD2 HIS 3 -9.746 -15.934 3.217
25 HE1 HIS 3 HE1 HIS 3 -7.719 -13.050 0.871
26 HE2 HIS 3 HE2 HIS 3 -9.624 -13.475 2.454
27 H HIS 4 H HIS 4 -4.469 -18.575 2.500
28 HA HIS 4 HA HIS 4 -3.480 -15.886 3.172
29 HB2 HIS 4 2HB HIS 4 -2.448 -18.484 4.413
30 HB3 HIS 4 1HB HIS 4 -1.564 -16.964 4.478
31 HD1 HIS 4 HD1 HIS 4 -2.192 -15.346 6.301
32 HD2 HIS 4 HD2 HIS 4 -4.869 -18.504 6.020
33 HE1 HIS 4 HE1 HIS 4 -3.732 -15.102 8.264
34 HE2 HIS 4 HE2 HIS 4 -5.305 -17.045 8.102
35 H HIS 5 H HIS 5 -1.023 -15.824 2.598
36 HA HIS 5 HA HIS 5 -0.223 -17.599 0.419
37 HB2 HIS 5 2HB HIS 5 -0.651 -14.609 0.034
38 HB3 HIS 5 1HB HIS 5 0.460 -15.517 -0.982
39 HD1 HIS 5 HD1 HIS 5 -1.097 -17.972 -1.725
40 HD2 HIS 5 HD2 HIS 5 -2.819 -14.197 -1.519
41 HE1 HIS 5 HE1 HIS 5 -3.101 -18.057 -3.236
42 HE2 HIS 5 HE2 HIS 5 -4.218 -15.828 -2.931
43 H HIS 6 H HIS 6 1.999 -17.089 -0.327
44 HA HIS 6 HA HIS 6 3.851 -16.577 1.820
45 HB2 HIS 6 2HB HIS 6 4.314 -16.954 -1.178
46 HB3 HIS 6 1HB HIS 6 5.596 -16.856 0.026
47 HD1 HIS 6 HD1 HIS 6 6.447 -19.067 0.701
48 HD2 HIS 6 HD2 HIS 6 2.454 -19.267 -0.444
49 HE1 HIS 6 HE1 HIS 6 5.810 -21.486 0.853
50 HE2 HIS 6 HE2 HIS 6 3.366 -21.555 0.290
51 H SER 7 H SER 7 3.689 -14.484 2.535
52 HA SER 7 HA SER 7 3.576 -12.268 0.561
53 HB2 SER 7 2HB SER 7 2.422 -12.346 3.388
54 HB3 SER 7 1HB SER 7 2.196 -11.068 2.190
55 HG SER 7 HG SER 7 1.345 -13.763 1.919
56 H HIS 8 H HIS 8 4.112 -10.140 1.803
57 HA HIS 8 HA HIS 8 6.789 -10.190 2.899
58 HB2 HIS 8 2HB HIS 8 4.785 -7.899 2.587
59 HB3 HIS 8 1HB HIS 8 6.463 -7.701 3.075
60 HD1 HIS 8 HD1 HIS 8 7.009 -6.200 1.063
61 HD2 HIS 8 HD2 HIS 8 5.562 -9.930 -0.055
62 HE1 HIS 8 HE1 HIS 8 7.395 -6.360 -1.407
63 HE2 HIS 8 HE2 HIS 8 6.566 -8.642 -2.057
64 H MET 9 H MET 9 7.240 -9.190 5.038
65 HA MET 9 HA MET 9 5.996 -10.236 7.262
66 HB2 MET 9 2HB MET 9 7.171 -8.463 8.577
67 HB3 MET 9 1HB MET 9 8.222 -9.174 7.364
68 HG2 MET 9 2HG MET 9 7.870 -7.212 5.904
69 HG3 MET 9 1HG MET 9 6.819 -6.500 7.130
70 HE1 MET 9 3HE MET 9 9.269 -4.932 5.877
71 HE2 MET 9 1HE MET 9 10.010 -4.228 7.316
72 HE3 MET 9 2HE MET 9 8.256 -4.246 7.149
73 H VAL 10 H VAL 10 4.248 -9.637 8.604
74 HA VAL 10 HA VAL 10 2.197 -8.073 7.411
75 HB VAL 10 HB VAL 10 0.772 -8.544 9.218
76 HG11 VAL 10 1HG1 VAL 10 0.978 -10.947 9.636
77 HG12 VAL 10 2HG1 VAL 10 2.656 -10.912 9.091
78 HG13 VAL 10 3HG1 VAL 10 1.352 -10.554 7.955
79 HG21 VAL 10 3HG2 VAL 10 3.152 -9.097 11.030
80 HG22 VAL 10 1HG2 VAL 10 1.455 -9.311 11.476
81 HG23 VAL 10 2HG2 VAL 10 2.073 -7.702 11.102
82 H GLY 11 H GLY 11 1.477 -6.029 7.872
83 HA2 GLY 11 2HA GLY 11 1.508 -3.900 8.719
84 HA3 GLY 11 1HA GLY 11 2.759 -4.369 9.853
85 H ASP 12 H ASP 12 3.443 -5.241 6.575
86 HA ASP 12 HA ASP 12 5.893 -3.936 6.460
87 HB2 ASP 12 2HB ASP 12 5.106 -5.768 4.894
88 HB3 ASP 12 1HB ASP 12 4.191 -4.552 4.014
89 H THR 13 H THR 13 6.496 -1.868 6.190
90 HA THR 13 HA THR 13 4.464 0.163 6.266
91 HB THR 13 HB THR 13 7.499 0.476 6.225
92 HG1 THR 13 HG1 THR 13 5.628 -0.090 8.259
93 HG21 THR 13 3HG2 THR 13 5.340 2.387 7.215
94 HG22 THR 13 1HG2 THR 13 6.277 2.592 5.722
95 HG23 THR 13 2HG2 THR 13 7.080 2.655 7.287
96 H VAL 14 H VAL 14 3.547 0.813 4.442
97 HA VAL 14 HA VAL 14 5.165 1.424 2.050
98 HB VAL 14 HB VAL 14 3.368 0.583 0.569
99 HG11 VAL 14 1HG1 VAL 14 5.247 -0.906 1.057
100 HG12 VAL 14 2HG1 VAL 14 3.765 -1.839 0.840
101 HG13 VAL 14 3HG1 VAL 14 4.400 -1.557 2.465
102 HG21 VAL 14 3HG2 VAL 14 1.434 0.808 2.064
103 HG22 VAL 14 1HG2 VAL 14 2.047 -0.492 3.092
104 HG23 VAL 14 2HG2 VAL 14 1.533 -0.836 1.438
105 H TRP 15 H TRP 15 4.302 3.094 0.743
106 HA TRP 15 HA TRP 15 2.219 4.828 1.896
107 HB2 TRP 15 2HB TRP 15 4.210 5.262 -0.379
108 HB3 TRP 15 1HB TRP 15 3.011 6.451 0.130
109 HD1 TRP 15 HD1 TRP 15 3.571 5.995 3.351
110 HE1 TRP 15 HE1 TRP 15 5.695 7.051 4.338
111 HE3 TRP 15 HE3 TRP 15 6.287 6.568 -0.955
112 HZ2 TRP 15 HZ2 TRP 15 8.185 8.010 3.428
113 HZ3 TRP 15 HZ3 TRP 15 8.537 7.566 -0.806
114 HH2 TRP 15 HH2 TRP 15 9.466 8.273 1.343
115 H VAL 16 H VAL 16 0.290 5.138 0.782
116 HA VAL 16 HA VAL 16 -0.088 3.663 -1.746
117 HB VAL 16 HB VAL 16 -2.218 4.510 0.272
118 HG11 VAL 16 1HG1 VAL 16 -3.845 3.372 -1.228
119 HG12 VAL 16 2HG1 VAL 16 -2.565 3.119 -2.416
120 HG13 VAL 16 3HG1 VAL 16 -3.093 4.758 -2.028
121 HG21 VAL 16 3HG2 VAL 16 -0.918 2.510 0.940
122 HG22 VAL 16 1HG2 VAL 16 -1.276 1.752 -0.613
123 HG23 VAL 16 2HG2 VAL 16 -2.580 2.070 0.536
124 H ARG 17 H ARG 17 0.199 4.883 -3.359
125 HA ARG 17 HA ARG 17 0.001 7.665 -3.646
126 HB2 ARG 17 2HB ARG 17 1.441 6.326 -5.056
127 HB3 ARG 17 1HB ARG 17 0.091 5.344 -5.613
128 HG2 ARG 17 2HG ARG 17 -0.826 7.295 -6.815
129 HG3 ARG 17 1HG ARG 17 0.526 8.277 -6.249
130 HD2 ARG 17 2HD ARG 17 0.835 5.781 -7.948
131 HD3 ARG 17 1HD ARG 17 0.748 7.413 -8.610
132 HE ARG 17 HE ARG 17 2.788 7.750 -6.997
133 HH11 ARG 17 1HH1 ARG 17 2.155 4.914 -9.005
134 HH12 ARG 17 2HH1 ARG 17 3.836 4.535 -9.200
135 HH21 ARG 17 1HH2 ARG 17 4.989 7.291 -7.342
136 HH22 ARG 17 2HH2 ARG 17 5.446 5.886 -8.258
137 H ARG 18 H ARG 18 -1.882 8.718 -3.411
138 HA ARG 18 HA ARG 18 -4.353 7.750 -4.736
139 HB2 ARG 18 2HB ARG 18 -4.533 7.719 -2.265
140 HB3 ARG 18 1HB ARG 18 -4.081 9.420 -2.195
141 HG2 ARG 18 2HG ARG 18 -6.148 10.028 -3.406
142 HG3 ARG 18 1HG ARG 18 -6.589 8.321 -3.514
143 HD2 ARG 18 2HD ARG 18 -6.276 9.917 -0.951
144 HD3 ARG 18 1HD ARG 18 -7.808 9.468 -1.707
145 HE ARG 18 HE ARG 18 -6.076 7.234 -1.087
146 HH11 ARG 18 1HH1 ARG 18 -8.666 9.286 0.166
147 HH12 ARG 18 2HH1 ARG 18 -9.163 8.113 1.344
148 HH21 ARG 18 1HH2 ARG 18 -6.718 5.761 0.461
149 HH22 ARG 18 2HH2 ARG 18 -8.052 6.114 1.509
150 H HIS 19 H HIS 19 -5.544 9.249 -5.932
151 HA HIS 19 HA HIS 19 -4.041 11.487 -6.995
152 HB2 HIS 19 2HB HIS 19 -6.191 9.808 -7.935
153 HB3 HIS 19 1HB HIS 19 -6.777 11.455 -7.988
154 HD1 HIS 19 HD1 HIS 19 -5.371 13.136 -9.510
155 HD2 HIS 19 HD2 HIS 19 -4.493 9.112 -9.995
156 HE1 HIS 19 HE1 HIS 19 -4.162 12.971 -11.692
157 HE2 HIS 19 HE2 HIS 19 -3.768 10.515 -12.029
158 H GLN 20 H GLN 20 -7.493 11.413 -5.922
159 HA GLN 20 HA GLN 20 -8.901 13.056 -5.271
160 HB2 GLN 20 2HB GLN 20 -6.537 13.857 -3.531
161 HB3 GLN 20 1HB GLN 20 -8.169 14.490 -3.334
162 HG2 GLN 20 2HG GLN 20 -7.340 11.595 -3.034
163 HG3 GLN 20 1HG GLN 20 -7.702 12.714 -1.723
164 HE21 GLN 20 1HE2 GLN 20 -10.036 13.921 -3.008
165 HE22 GLN 20 2HE2 GLN 20 -11.279 12.723 -2.958
166 H THR 21 H THR 21 -7.229 13.558 -7.578
167 HA THR 21 HA THR 21 -7.438 16.459 -7.898
168 HB THR 21 HB THR 21 -5.101 16.462 -8.961
169 HG1 THR 21 HG1 THR 21 -3.704 14.739 -8.238
170 HG21 THR 21 3HG2 THR 21 -5.167 15.860 -5.979
171 HG22 THR 21 1HG2 THR 21 -5.403 17.447 -6.716
172 HG23 THR 21 2HG2 THR 21 -3.838 16.638 -6.843
173 H LYS 22 H LYS 22 -7.807 17.012 -10.071
174 HA LYS 22 HA LYS 22 -8.791 14.835 -11.732
175 HB2 LYS 22 2HB LYS 22 -8.991 17.856 -12.051
176 HB3 LYS 22 1HB LYS 22 -9.721 16.691 -13.159
177 HG2 LYS 22 2HG LYS 22 -11.066 15.775 -11.269
178 HG3 LYS 22 1HG LYS 22 -10.390 17.022 -10.213
179 HD2 LYS 22 2HD LYS 22 -11.413 18.778 -11.608
180 HD3 LYS 22 1HD LYS 22 -12.033 17.557 -12.723
181 HE2 LYS 22 2HE LYS 22 -12.823 17.831 -9.799
182 HE3 LYS 22 1HE LYS 22 -13.783 18.374 -11.176
183 HZ1 LYS 22 3HZ LYS 22 -13.953 16.091 -11.927
184 HZ2 LYS 22 1HZ LYS 22 -14.531 16.229 -10.348
185 HZ3 LYS 22 2HZ LYS 22 -13.008 15.557 -10.633
186 H ASN 23 H ASN 23 -6.182 17.237 -11.847
187 HA ASN 23 HA ASN 23 -5.066 15.891 -14.248
188 HB2 ASN 23 2HB ASN 23 -5.214 18.908 -13.799
189 HB3 ASN 23 1HB ASN 23 -4.208 18.148 -15.030
190 HD21 ASN 23 1HD2 ASN 23 -5.194 17.222 -16.860
191 HD22 ASN 23 2HD2 ASN 23 -6.841 17.560 -17.263
192 H LEU 24 H LEU 24 -4.472 17.559 -11.195
193 HA LEU 24 HA LEU 24 -1.633 17.669 -11.370
194 HB2 LEU 24 2HB LEU 24 -3.365 17.517 -8.873
195 HB3 LEU 24 1HB LEU 24 -1.656 17.915 -8.890
196 HG LEU 24 HG LEU 24 -3.935 19.587 -10.009
197 HD11 LEU 24 1HD1 LEU 24 -3.258 21.229 -8.325
198 HD12 LEU 24 2HD1 LEU 24 -2.008 20.132 -7.730
199 HD13 LEU 24 3HD1 LEU 24 -3.714 19.699 -7.579
200 HD21 LEU 24 3HD2 LEU 24 -2.250 21.278 -10.613
201 HD22 LEU 24 1HD2 LEU 24 -2.049 19.786 -11.533
202 HD23 LEU 24 2HD2 LEU 24 -0.961 20.147 -10.190
203 H GLU 25 H GLU 25 -0.128 16.398 -10.065
204 HA GLU 25 HA GLU 25 -0.187 13.713 -10.915
205 HB2 GLU 25 2HB GLU 25 1.661 15.122 -8.938
206 HB3 GLU 25 1HB GLU 25 1.980 13.541 -9.649
207 HG2 GLU 25 2HG GLU 25 2.088 14.539 -11.899
208 HG3 GLU 25 1HG GLU 25 1.683 16.121 -11.233
209 HA PRO 26 HA PRO 26 -2.160 11.622 -7.431
210 HB2 PRO 26 2HB PRO 26 -1.165 9.077 -7.764
211 HB3 PRO 26 1HB PRO 26 -2.397 9.778 -8.829
212 HG2 PRO 26 2HG PRO 26 0.559 9.547 -9.284
213 HG3 PRO 26 1HG PRO 26 -0.777 9.223 -10.411
214 HD2 PRO 26 2HD PRO 26 0.624 11.552 -10.469
215 HD3 PRO 26 1HD PRO 26 -1.099 11.476 -10.898
216 H ARG 27 H ARG 27 -1.574 12.021 -5.432
217 HA ARG 27 HA ARG 27 1.233 12.160 -4.593
218 HB2 ARG 27 2HB ARG 27 -0.185 14.145 -4.363
219 HB3 ARG 27 1HB ARG 27 -1.381 13.230 -3.455
220 HG2 ARG 27 2HG ARG 27 0.308 12.950 -1.614
221 HG3 ARG 27 1HG ARG 27 1.412 13.986 -2.526
222 HD2 ARG 27 2HD ARG 27 -1.340 14.795 -1.517
223 HD3 ARG 27 1HD ARG 27 0.195 15.251 -0.777
224 HE ARG 27 HE ARG 27 0.707 16.468 -2.878
225 HH11 ARG 27 1HH1 ARG 27 -2.678 15.807 -2.174
226 HH12 ARG 27 2HH1 ARG 27 -3.256 17.137 -3.125
227 HH21 ARG 27 1HH2 ARG 27 -0.059 18.192 -4.123
228 HH22 ARG 27 2HH2 ARG 27 -1.764 18.498 -4.237
229 H TRP 28 H TRP 28 2.074 10.675 -3.193
230 HA TRP 28 HA TRP 28 0.489 8.518 -2.111
231 HB2 TRP 28 2HB TRP 28 2.668 7.772 -1.060
232 HB3 TRP 28 1HB TRP 28 2.746 7.968 -2.806
233 HD1 TRP 28 HD1 TRP 28 4.486 9.695 -3.757
234 HE1 TRP 28 HE1 TRP 28 6.325 11.141 -2.721
235 HE3 TRP 28 HE3 TRP 28 3.292 9.170 1.207
236 HZ2 TRP 28 HZ2 TRP 28 7.181 11.954 -0.193
237 HZ3 TRP 28 HZ3 TRP 28 4.692 10.324 2.874
238 HH2 TRP 28 HH2 TRP 28 6.602 11.688 2.181
239 H LYS 29 H LYS 29 -0.042 8.124 0.073
240 HA LYS 29 HA LYS 29 1.305 9.766 2.118
241 HB2 LYS 29 2HB LYS 29 -1.720 9.344 2.090
242 HB3 LYS 29 1HB LYS 29 -0.827 9.802 3.539
243 HG2 LYS 29 2HG LYS 29 0.000 11.837 2.223
244 HG3 LYS 29 1HG LYS 29 -1.203 11.423 1.002
245 HD2 LYS 29 2HD LYS 29 -1.745 12.124 3.912
246 HD3 LYS 29 1HD LYS 29 -2.046 13.154 2.514
247 HE2 LYS 29 2HE LYS 29 -3.440 10.520 3.098
248 HE3 LYS 29 1HE LYS 29 -4.119 12.129 3.339
249 HZ1 LYS 29 3HZ LYS 29 -3.831 12.494 0.922
250 HZ2 LYS 29 1HZ LYS 29 -4.931 11.274 1.299
251 HZ3 LYS 29 2HZ LYS 29 -3.382 10.873 0.760
252 H GLY 30 H GLY 30 1.141 8.776 4.285
253 HA2 GLY 30 2HA GLY 30 0.446 6.035 4.638
254 HA3 GLY 30 1HA GLY 30 2.166 6.224 4.363
255 HA PRO 31 HA PRO 31 2.911 4.900 5.724
256 HB2 PRO 31 2HB PRO 31 3.670 3.579 7.953
257 HB3 PRO 31 1HB PRO 31 4.484 5.078 7.456
258 HG2 PRO 31 2HG PRO 31 2.426 4.681 9.596
259 HG3 PRO 31 1HG PRO 31 3.877 5.704 9.607
260 HD2 PRO 31 2HD PRO 31 1.280 6.610 9.066
261 HD3 PRO 31 1HD PRO 31 2.772 7.472 8.630
262 H TYR 32 H TYR 32 1.366 3.669 4.767
263 HA TYR 32 HA TYR 32 -0.661 2.173 6.177
264 HB2 TYR 32 2HB TYR 32 0.327 2.124 3.299
265 HB3 TYR 32 1HB TYR 32 -0.904 1.015 3.884
266 HD1 TYR 32 HD2 TYR 32 -0.178 4.616 3.226
267 HD2 TYR 32 HD1 TYR 32 -3.189 1.725 4.151
268 HE1 TYR 32 HE2 TYR 32 -1.926 6.278 2.743
269 HE2 TYR 32 HE1 TYR 32 -4.934 3.381 3.669
270 HH TYR 32 HH TYR 32 -5.174 5.864 3.599
271 H THR 33 H THR 33 -0.723 -0.287 5.752
272 HA THR 33 HA THR 33 1.875 -1.526 6.424
273 HB THR 33 HB THR 33 0.618 -2.618 8.423
274 HG1 THR 33 HG1 THR 33 -1.478 -1.735 7.613
275 HG21 THR 33 3HG2 THR 33 2.349 -0.938 8.844
276 HG22 THR 33 1HG2 THR 33 1.001 -0.704 9.959
277 HG23 THR 33 2HG2 THR 33 1.192 0.365 8.564
278 H VAL 34 H VAL 34 2.026 -3.239 4.997
279 HA VAL 34 HA VAL 34 -0.353 -4.545 3.928
280 HB VAL 34 HB VAL 34 2.586 -5.165 3.358
281 HG11 VAL 34 1HG1 VAL 34 1.155 -7.089 2.831
282 HG12 VAL 34 2HG1 VAL 34 1.754 -6.349 1.344
283 HG13 VAL 34 3HG1 VAL 34 0.092 -6.062 1.866
284 HG21 VAL 34 3HG2 VAL 34 2.274 -3.905 1.258
285 HG22 VAL 34 1HG2 VAL 34 2.036 -2.879 2.675
286 HG23 VAL 34 2HG2 VAL 34 0.642 -3.464 1.763
287 H LEU 35 H LEU 35 -1.231 -6.326 4.735
288 HA LEU 35 HA LEU 35 0.155 -7.941 6.785
289 HB2 LEU 35 2HB LEU 35 -2.769 -7.945 5.930
290 HB3 LEU 35 1HB LEU 35 -2.092 -8.826 7.292
291 HG LEU 35 HG LEU 35 -2.294 -5.798 7.058
292 HD11 LEU 35 1HD1 LEU 35 -3.955 -5.977 8.853
293 HD12 LEU 35 2HD1 LEU 35 -3.837 -7.738 8.808
294 HD13 LEU 35 3HD1 LEU 35 -4.465 -6.857 7.413
295 HD21 LEU 35 3HD2 LEU 35 -1.533 -5.737 9.401
296 HD22 LEU 35 1HD2 LEU 35 -0.302 -6.399 8.325
297 HD23 LEU 35 2HD2 LEU 35 -1.243 -7.480 9.358
298 H LEU 36 H LEU 36 -1.584 -8.202 3.694
299 HA LEU 36 HA LEU 36 -0.520 -10.941 3.249
300 HB2 LEU 36 2HB LEU 36 -2.876 -11.059 4.110
301 HB3 LEU 36 1HB LEU 36 -3.407 -10.052 2.775
302 HG LEU 36 HG LEU 36 -2.706 -11.889 1.178
303 HD11 LEU 36 1HD1 LEU 36 -2.257 -14.133 2.042
304 HD12 LEU 36 2HD1 LEU 36 -2.269 -13.516 3.695
305 HD13 LEU 36 3HD1 LEU 36 -1.020 -12.988 2.563
306 HD21 LEU 36 3HD2 LEU 36 -4.612 -13.369 1.640
307 HD22 LEU 36 1HD2 LEU 36 -5.047 -11.675 1.865
308 HD23 LEU 36 2HD2 LEU 36 -4.750 -12.703 3.270
309 H THR 37 H THR 37 -0.305 -11.496 1.006
310 HA THR 37 HA THR 37 -0.574 -9.255 -0.934
311 HB THR 37 HB THR 37 1.464 -10.006 -2.093
312 HG1 THR 37 HG1 THR 37 1.331 -12.091 -0.224
313 HG21 THR 37 3HG2 THR 37 3.196 -9.428 -0.417
314 HG22 THR 37 1HG2 THR 37 2.008 -9.624 0.871
315 HG23 THR 37 2HG2 THR 37 1.814 -8.332 -0.314
316 H THR 38 H THR 38 -1.191 -9.825 -3.016
317 HA THR 38 HA THR 38 -1.717 -12.613 -3.774
318 HB THR 38 HB THR 38 -3.969 -11.909 -4.754
319 HG1 THR 38 HG1 THR 38 -3.423 -9.571 -3.262
320 HG21 THR 38 3HG2 THR 38 -3.990 -13.178 -2.655
321 HG22 THR 38 1HG2 THR 38 -5.262 -11.956 -2.632
322 HG23 THR 38 2HG2 THR 38 -3.768 -11.692 -1.729
323 HA PRO 39 HA PRO 39 0.036 -11.518 -7.751
324 HB2 PRO 39 2HB PRO 39 -2.070 -11.961 -9.619
325 HB3 PRO 39 1HB PRO 39 -0.910 -13.170 -9.049
326 HG2 PRO 39 2HG PRO 39 -3.689 -12.633 -8.078
327 HG3 PRO 39 1HG PRO 39 -2.859 -14.189 -8.303
328 HD2 PRO 39 2HD PRO 39 -3.138 -13.196 -5.852
329 HD3 PRO 39 1HD PRO 39 -1.596 -13.955 -6.320
330 H THR 40 H THR 40 0.451 -9.396 -7.732
331 HA THR 40 HA THR 40 0.518 -7.250 -8.364
332 HB THR 40 HB THR 40 -1.878 -7.652 -10.194
333 HG1 THR 40 HG1 THR 40 -0.799 -9.151 -11.227
334 HG21 THR 40 3HG2 THR 40 0.724 -6.112 -10.561
335 HG22 THR 40 1HG2 THR 40 -0.831 -5.383 -10.156
336 HG23 THR 40 2HG2 THR 40 -0.604 -6.174 -11.720
337 H ALA 41 H ALA 41 -1.353 -8.173 -6.155
338 HA ALA 41 HA ALA 41 -2.534 -5.547 -5.606
339 HB1 ALA 41 3HB ALA 41 -4.255 -8.069 -5.626
340 HB2 ALA 41 1HB ALA 41 -4.380 -6.718 -6.758
341 HB3 ALA 41 2HB ALA 41 -4.766 -6.476 -5.057
342 H LEU 42 H LEU 42 -2.225 -5.086 -3.457
343 HA LEU 42 HA LEU 42 -1.357 -7.290 -1.669
344 HB2 LEU 42 2HB LEU 42 -0.631 -4.342 -1.406
345 HB3 LEU 42 1HB LEU 42 0.047 -5.690 -0.502
346 HG LEU 42 HG LEU 42 0.505 -5.036 -3.438
347 HD11 LEU 42 1HD1 LEU 42 1.779 -3.661 -1.882
348 HD12 LEU 42 2HD1 LEU 42 2.831 -4.741 -2.787
349 HD13 LEU 42 3HD1 LEU 42 2.435 -5.104 -1.103
350 HD21 LEU 42 3HD2 LEU 42 2.015 -6.966 -3.538
351 HD22 LEU 42 1HD2 LEU 42 0.353 -7.460 -3.225
352 HD23 LEU 42 2HD2 LEU 42 1.528 -7.446 -1.910
353 H LYS 43 H LYS 43 -2.560 -7.639 0.151
354 HA LYS 43 HA LYS 43 -4.774 -5.852 0.764
355 HB2 LYS 43 2HB LYS 43 -5.200 -8.275 0.929
356 HB3 LYS 43 1HB LYS 43 -3.927 -8.442 2.140
357 HG2 LYS 43 2HG LYS 43 -5.181 -7.016 3.702
358 HG3 LYS 43 1HG LYS 43 -6.438 -6.759 2.487
359 HD2 LYS 43 2HD LYS 43 -6.913 -9.229 2.548
360 HD3 LYS 43 1HD LYS 43 -5.739 -9.383 3.862
361 HE2 LYS 43 2HE LYS 43 -7.076 -7.886 5.264
362 HE3 LYS 43 1HE LYS 43 -8.221 -7.630 3.944
363 HZ1 LYS 43 3HZ LYS 43 -7.710 -10.209 5.327
364 HZ2 LYS 43 1HZ LYS 43 -8.794 -9.983 4.055
365 HZ3 LYS 43 2HZ LYS 43 -9.059 -9.214 5.537
366 H VAL 44 H VAL 44 -4.266 -4.100 1.764
367 HA VAL 44 HA VAL 44 -2.266 -3.930 3.907
368 HB VAL 44 HB VAL 44 -3.845 -1.772 2.428
369 HG11 VAL 44 1HG1 VAL 44 -2.341 -0.126 3.442
370 HG12 VAL 44 2HG1 VAL 44 -1.549 -1.402 4.366
371 HG13 VAL 44 3HG1 VAL 44 -3.240 -1.009 4.681
372 HG21 VAL 44 3HG2 VAL 44 -0.934 -2.567 2.094
373 HG22 VAL 44 1HG2 VAL 44 -1.746 -1.237 1.262
374 HG23 VAL 44 2HG2 VAL 44 -2.236 -2.904 0.950
375 H ASP 45 H ASP 45 -2.860 -3.186 5.979
376 HA ASP 45 HA ASP 45 -5.374 -3.937 7.039
377 HB2 ASP 45 2HB ASP 45 -3.265 -4.019 8.324
378 HB3 ASP 45 1HB ASP 45 -3.119 -2.269 8.223
379 H GLY 46 H GLY 46 -7.200 -2.794 7.313
380 HA2 GLY 46 2HA GLY 46 -8.546 -0.914 7.784
381 HA3 GLY 46 1HA GLY 46 -7.242 0.144 7.272
382 H ILE 47 H ILE 47 -7.260 -2.081 4.929
383 HA ILE 47 HA ILE 47 -8.843 -0.428 3.102
384 HB ILE 47 HB ILE 47 -6.916 -2.746 2.601
385 HG12 ILE 47 2HG1 ILE 47 -5.780 -0.759 3.465
386 HG13 ILE 47 1HG1 ILE 47 -5.370 -0.982 1.770
387 HG21 ILE 47 1HG2 ILE 47 -8.530 -2.682 0.762
388 HG22 ILE 47 2HG2 ILE 47 -6.953 -2.116 0.206
389 HG23 ILE 47 3HG2 ILE 47 -8.240 -0.954 0.533
390 HD11 ILE 47 3HD1 ILE 47 -5.694 1.339 2.280
391 HD12 ILE 47 1HD1 ILE 47 -7.317 1.027 2.890
392 HD13 ILE 47 2HD1 ILE 47 -6.956 0.799 1.174
393 H ALA 48 H ALA 48 -10.472 -1.293 1.738
394 HA ALA 48 HA ALA 48 -12.378 -2.936 2.938
395 HB1 ALA 48 3HB ALA 48 -13.598 -2.820 0.805
396 HB2 ALA 48 1HB ALA 48 -12.137 -2.243 -0.009
397 HB3 ALA 48 2HB ALA 48 -12.913 -1.249 1.222
398 H ALA 49 H ALA 49 -10.104 -3.740 0.275
399 HA ALA 49 HA ALA 49 -10.019 -6.507 1.208
400 HB1 ALA 49 3HB ALA 49 -10.535 -7.492 -0.976
401 HB2 ALA 49 1HB ALA 49 -10.830 -5.887 -1.658
402 HB3 ALA 49 2HB ALA 49 -11.892 -6.524 -0.401
403 H TRP 50 H TRP 50 -8.935 -4.468 -1.580
404 HA TRP 50 HA TRP 50 -6.133 -5.200 -1.038
405 HB2 TRP 50 2HB TRP 50 -7.473 -5.658 -3.742
406 HB3 TRP 50 1HB TRP 50 -5.733 -5.710 -3.483
407 HD1 TRP 50 HD1 TRP 50 -4.846 -7.782 -1.833
408 HE1 TRP 50 HE1 TRP 50 -5.749 -10.178 -1.648
409 HE3 TRP 50 HE3 TRP 50 -9.502 -7.098 -3.871
410 HZ2 TRP 50 HZ2 TRP 50 -8.091 -11.611 -2.274
411 HZ3 TRP 50 HZ3 TRP 50 -11.008 -9.039 -4.048
412 HH2 TRP 50 HH2 TRP 50 -10.314 -11.250 -3.265
413 H ILE 51 H ILE 51 -4.599 -3.824 -1.939
414 HA ILE 51 HA ILE 51 -5.477 -1.475 -3.510
415 HB ILE 51 HB ILE 51 -3.127 -1.690 -1.550
416 HG12 ILE 51 2HG1 ILE 51 -5.316 -1.222 -0.457
417 HG13 ILE 51 1HG1 ILE 51 -4.222 0.147 -0.313
418 HG21 ILE 51 1HG2 ILE 51 -2.575 0.659 -2.148
419 HG22 ILE 51 2HG2 ILE 51 -3.786 0.609 -3.432
420 HG23 ILE 51 3HG2 ILE 51 -2.372 -0.445 -3.510
421 HD11 ILE 51 3HD1 ILE 51 -5.422 1.294 -2.108
422 HD12 ILE 51 1HD1 ILE 51 -6.482 0.856 -0.770
423 HD13 ILE 51 2HD1 ILE 51 -6.513 -0.089 -2.258
424 H HIS 52 H HIS 52 -4.789 -1.633 -5.560
425 HA HIS 52 HA HIS 52 -3.325 -3.893 -6.489
426 HB2 HIS 52 2HB HIS 52 -5.253 -2.638 -7.660
427 HB3 HIS 52 1HB HIS 52 -4.075 -1.408 -8.095
428 HD1 HIS 52 HD1 HIS 52 -2.178 -2.200 -9.844
429 HD2 HIS 52 HD2 HIS 52 -5.364 -4.798 -9.290
430 HE1 HIS 52 HE1 HIS 52 -2.136 -3.763 -11.804
431 HE2 HIS 52 HE2 HIS 52 -4.198 -5.165 -11.544
432 H ALA 53 H ALA 53 -1.330 -3.739 -7.846
433 HA ALA 53 HA ALA 53 0.695 -3.162 -6.085
434 HB1 ALA 53 3HB ALA 53 0.797 -4.887 -7.837
435 HB2 ALA 53 1HB ALA 53 2.251 -3.888 -7.814
436 HB3 ALA 53 2HB ALA 53 1.026 -3.636 -9.061
437 H ALA 54 H ALA 54 -0.160 -1.142 -8.916
438 HA ALA 54 HA ALA 54 2.211 0.480 -8.760
439 HB1 ALA 54 3HB ALA 54 -0.347 0.949 -10.307
440 HB2 ALA 54 1HB ALA 54 1.079 0.100 -10.891
441 HB3 ALA 54 2HB ALA 54 1.166 1.830 -10.539
442 H HIS 55 H HIS 55 -0.888 0.634 -7.215
443 HA HIS 55 HA HIS 55 -0.638 3.389 -6.317
444 HB2 HIS 55 2HB HIS 55 -2.485 1.117 -5.465
445 HB3 HIS 55 1HB HIS 55 -2.507 2.698 -4.692
446 HD1 HIS 55 HD1 HIS 55 -3.353 4.713 -6.147
447 HD2 HIS 55 HD2 HIS 55 -3.851 0.979 -7.878
448 HE1 HIS 55 HE1 HIS 55 -4.923 5.068 -8.060
449 HE2 HIS 55 HE2 HIS 55 -5.089 2.826 -9.178
450 H VAL 56 H VAL 56 0.777 0.404 -5.416
451 HA VAL 56 HA VAL 56 1.333 1.280 -2.647
452 HB VAL 56 HB VAL 56 2.072 -1.382 -3.961
453 HG11 VAL 56 1HG1 VAL 56 2.406 -2.165 -1.640
454 HG12 VAL 56 2HG1 VAL 56 2.032 -0.554 -1.034
455 HG13 VAL 56 3HG1 VAL 56 3.474 -0.814 -2.019
456 HG21 VAL 56 3HG2 VAL 56 0.164 -2.376 -2.761
457 HG22 VAL 56 1HG2 VAL 56 -0.376 -1.145 -3.908
458 HG23 VAL 56 2HG2 VAL 56 -0.313 -0.779 -2.183
459 H LYS 57 H LYS 57 3.307 1.981 -2.060
460 HA LYS 57 HA LYS 57 5.720 1.273 -3.613
461 HB2 LYS 57 2HB LYS 57 5.128 4.017 -2.403
462 HB3 LYS 57 1HB LYS 57 6.670 3.523 -3.098
463 HG2 LYS 57 2HG LYS 57 5.521 3.233 -5.310
464 HG3 LYS 57 1HG LYS 57 4.044 3.873 -4.576
465 HD2 LYS 57 2HD LYS 57 5.250 5.642 -5.804
466 HD3 LYS 57 1HD LYS 57 5.202 6.001 -4.076
467 HE2 LYS 57 2HE LYS 57 7.521 5.130 -3.855
468 HE3 LYS 57 1HE LYS 57 7.554 4.812 -5.590
469 HZ1 LYS 57 3HZ LYS 57 8.643 6.904 -4.972
470 HZ2 LYS 57 1HZ LYS 57 7.174 7.499 -4.381
471 HZ3 LYS 57 2HZ LYS 57 7.346 7.145 -6.021
472 H ALA 58 H ALA 58 7.356 0.558 -2.274
473 HA ALA 58 HA ALA 58 6.953 0.035 0.470
474 HB1 ALA 58 3HB ALA 58 9.552 0.094 -1.104
475 HB2 ALA 58 1HB ALA 58 8.491 -1.300 -0.895
476 HB3 ALA 58 2HB ALA 58 9.339 -0.623 0.494
477 H ALA 59 H ALA 59 7.586 1.109 2.301
478 HA ALA 59 HA ALA 59 8.647 3.871 2.047
479 HB1 ALA 59 3HB ALA 59 7.100 4.556 3.830
480 HB2 ALA 59 1HB ALA 59 6.439 2.919 3.907
481 HB3 ALA 59 2HB ALA 59 6.215 3.896 2.454
482 H ASP 60 H ASP 60 9.651 4.696 3.978
483 HA ASP 60 HA ASP 60 11.322 2.707 5.322
484 HB2 ASP 60 2HB ASP 60 12.331 4.632 4.081
485 HB3 ASP 60 1HB ASP 60 11.581 5.742 5.219
486 HA PRO 61 HA PRO 61 8.802 3.645 9.060
487 HB2 PRO 61 2HB PRO 61 9.258 1.353 10.419
488 HB3 PRO 61 1HB PRO 61 8.191 1.381 8.997
489 HG2 PRO 61 2HG PRO 61 11.048 0.473 9.185
490 HG3 PRO 61 1HG PRO 61 9.681 -0.283 8.335
491 HD2 PRO 61 2HD PRO 61 11.579 1.328 7.100
492 HD3 PRO 61 1HD PRO 61 9.935 1.060 6.475
493 H GLY 62 H GLY 62 12.205 3.166 8.687
494 HA2 GLY 62 2HA GLY 62 14.063 3.634 9.939
495 HA3 GLY 62 1HA GLY 62 13.054 4.696 10.910
496 H GLY 63 H GLY 63 12.754 1.194 10.417
497 HA2 GLY 63 2HA GLY 63 13.278 -0.544 11.956
498 HA3 GLY 63 1HA GLY 63 13.353 0.634 13.262
499 H GLY 64 H GLY 64 11.623 0.733 14.564
500 HA2 GLY 64 2HA GLY 64 9.501 0.655 15.392
501 HA3 GLY 64 1HA GLY 64 8.918 0.796 13.747
502 HA PRO 65 HA PRO 65 8.724 -3.914 14.684
503 HB2 PRO 65 2HB PRO 65 10.445 -5.132 16.348
504 HB3 PRO 65 1HB PRO 65 11.042 -4.426 14.832
505 HG2 PRO 65 2HG PRO 65 11.347 -3.410 17.620
506 HG3 PRO 65 1HG PRO 65 12.449 -3.263 16.235
507 HD2 PRO 65 2HD PRO 65 10.533 -1.311 17.140
508 HD3 PRO 65 1HD PRO 65 11.578 -1.221 15.705
509 H SER 66 H SER 66 7.482 -1.844 16.489
510 HA SER 66 HA SER 66 7.451 -2.638 19.193
511 HB2 SER 66 2HB SER 66 5.589 -0.987 19.419
512 HB3 SER 66 1HB SER 66 6.962 -0.339 18.523
513 HG SER 66 HG SER 66 4.416 -0.572 17.736
514 H SER 67 H SER 67 5.450 -3.684 16.494
515 HA SER 67 HA SER 67 3.842 -5.428 18.219
516 HB2 SER 67 2HB SER 67 2.600 -3.310 18.273
517 HB3 SER 67 1HB SER 67 2.604 -3.221 16.514
518 HG SER 67 HG SER 67 1.546 -5.575 17.469
519 H ARG 68 H ARG 68 5.097 -4.582 15.095
520 HA ARG 68 HA ARG 68 3.488 -6.297 13.482
521 HB2 ARG 68 2HB ARG 68 6.185 -5.001 12.928
522 HB3 ARG 68 1HB ARG 68 5.234 -5.864 11.717
523 HG2 ARG 68 2HG ARG 68 3.378 -4.247 12.062
524 HG3 ARG 68 1HG ARG 68 4.387 -3.357 13.200
525 HD2 ARG 68 2HD ARG 68 5.039 -3.829 10.281
526 HD3 ARG 68 1HD ARG 68 4.332 -2.353 10.935
527 HE ARG 68 HE ARG 68 6.621 -2.563 12.353
528 HH11 ARG 68 1HH1 ARG 68 5.969 -2.708 8.885
529 HH12 ARG 68 2HH1 ARG 68 7.513 -2.049 8.448
530 HH21 ARG 68 1HH2 ARG 68 8.628 -1.646 11.758
531 HH22 ARG 68 2HH2 ARG 68 9.026 -1.445 10.083
532 H LEU 69 H LEU 69 5.927 -7.063 15.677
533 HA LEU 69 HA LEU 69 7.178 -9.271 14.353
534 HB2 LEU 69 2HB LEU 69 7.031 -8.645 17.327
535 HB3 LEU 69 1HB LEU 69 8.151 -9.767 16.562
536 HG LEU 69 HG LEU 69 8.113 -6.744 16.229
537 HD11 LEU 69 1HD1 LEU 69 10.301 -6.819 17.352
538 HD12 LEU 69 2HD1 LEU 69 10.120 -8.561 17.592
539 HD13 LEU 69 3HD1 LEU 69 9.007 -7.436 18.378
540 HD21 LEU 69 3HD2 LEU 69 8.754 -7.754 14.110
541 HD22 LEU 69 1HD2 LEU 69 9.960 -8.762 14.918
542 HD23 LEU 69 2HD2 LEU 69 10.153 -7.007 14.874
543 H THR 70 H THR 70 4.073 -8.937 15.597
544 HA THR 70 HA THR 70 3.535 -11.509 16.626
545 HB THR 70 HB THR 70 1.626 -9.672 15.104
546 HG1 THR 70 HG1 THR 70 2.884 -9.274 17.418
547 HG21 THR 70 3HG2 THR 70 1.036 -11.838 17.169
548 HG22 THR 70 1HG2 THR 70 0.707 -11.961 15.434
549 HG23 THR 70 2HG2 THR 70 -0.159 -10.781 16.417
550 H TRP 71 H TRP 71 3.386 -10.174 13.327
551 HA TRP 71 HA TRP 71 3.127 -11.058 11.264
552 HB2 TRP 71 2HB TRP 71 4.932 -13.136 12.525
553 HB3 TRP 71 1HB TRP 71 4.619 -13.048 10.795
554 HD1 TRP 71 HD1 TRP 71 5.037 -10.072 10.078
555 HE1 TRP 71 HE1 TRP 71 7.331 -8.938 10.346
556 HE3 TRP 71 HE3 TRP 71 7.149 -13.232 13.521
557 HZ2 TRP 71 HZ2 TRP 71 9.724 -9.329 11.787
558 HZ3 TRP 71 HZ3 TRP 71 9.446 -12.787 14.287
559 HH2 TRP 71 HH2 TRP 71 10.710 -10.871 13.436
560 H ARG 72 H ARG 72 0.895 -11.525 12.709
561 HA ARG 72 HA ARG 72 0.152 -14.169 13.225
562 HB2 ARG 72 2HB ARG 72 -2.102 -13.341 13.574
563 HB3 ARG 72 1HB ARG 72 -0.949 -12.183 14.229
564 HG2 ARG 72 2HG ARG 72 -1.243 -10.735 12.254
565 HG3 ARG 72 1HG ARG 72 -2.353 -11.914 11.551
566 HD2 ARG 72 2HD ARG 72 -3.796 -11.564 13.666
567 HD3 ARG 72 1HD ARG 72 -2.779 -10.154 13.981
568 HE ARG 72 HE ARG 72 -4.731 -10.499 11.834
569 HH11 ARG 72 1HH1 ARG 72 -2.208 -8.437 13.187
570 HH12 ARG 72 2HH1 ARG 72 -2.727 -7.038 12.306
571 HH21 ARG 72 1HH2 ARG 72 -5.389 -8.651 10.711
572 HH22 ARG 72 2HH2 ARG 72 -4.521 -7.161 10.910
573 H VAL 73 H VAL 73 -0.223 -12.274 10.267
574 HA VAL 73 HA VAL 73 -1.934 -14.154 8.908
575 HB VAL 73 HB VAL 73 -0.277 -11.873 7.736
576 HG11 VAL 73 1HG1 VAL 73 -1.876 -11.908 5.854
577 HG12 VAL 73 2HG1 VAL 73 -2.695 -13.295 6.578
578 HG13 VAL 73 3HG1 VAL 73 -1.032 -13.454 6.012
579 HG21 VAL 73 3HG2 VAL 73 -2.334 -10.500 7.879
580 HG22 VAL 73 1HG2 VAL 73 -1.778 -11.012 9.476
581 HG23 VAL 73 2HG2 VAL 73 -3.152 -11.822 8.717
582 H GLN 74 H GLN 74 1.509 -13.574 9.219
583 HA GLN 74 HA GLN 74 2.264 -15.465 7.135
584 HB2 GLN 74 2HB GLN 74 4.000 -13.863 9.070
585 HB3 GLN 74 1HB GLN 74 4.607 -14.847 7.740
586 HG2 GLN 74 2HG GLN 74 3.002 -12.286 7.571
587 HG3 GLN 74 1HG GLN 74 4.648 -12.567 7.019
588 HE21 GLN 74 1HE2 GLN 74 1.292 -12.856 6.255
589 HE22 GLN 74 2HE2 GLN 74 1.483 -13.417 4.639
590 H ARG 75 H ARG 75 1.266 -15.799 10.315
591 HA ARG 75 HA ARG 75 3.011 -17.828 11.277
592 HB2 ARG 75 2HB ARG 75 0.121 -17.160 11.941
593 HB3 ARG 75 1HB ARG 75 0.991 -18.449 12.763
594 HG2 ARG 75 2HG ARG 75 1.897 -15.555 12.752
595 HG3 ARG 75 1HG ARG 75 0.873 -16.258 14.001
596 HD2 ARG 75 2HD ARG 75 3.135 -16.230 14.815
597 HD3 ARG 75 1HD ARG 75 2.700 -17.908 14.492
598 HE ARG 75 HE ARG 75 4.313 -16.293 12.600
599 HH11 ARG 75 1HH1 ARG 75 3.962 -19.235 14.521
600 HH12 ARG 75 2HH1 ARG 75 5.366 -19.981 13.829
601 HH21 ARG 75 1HH2 ARG 75 6.106 -17.322 11.677
602 HH22 ARG 75 2HH2 ARG 75 6.571 -18.899 12.227
603 H SER 76 H SER 76 0.484 -17.866 8.941
604 HA SER 76 HA SER 76 -0.341 -20.590 9.129
605 HB2 SER 76 2HB SER 76 -0.638 -18.633 6.820
606 HB3 SER 76 1HB SER 76 -1.597 -20.092 7.086
607 HG SER 76 HG SER 76 -2.269 -19.106 9.093
608 H GLN 77 H GLN 77 2.564 -19.353 7.945
609 HA GLN 77 HA GLN 77 3.271 -21.826 6.594
610 HB2 GLN 77 2HB GLN 77 2.120 -20.211 4.865
611 HB3 GLN 77 1HB GLN 77 3.587 -19.262 4.977
612 HG2 GLN 77 2HG GLN 77 3.375 -22.126 4.001
613 HG3 GLN 77 1HG GLN 77 3.583 -20.700 2.998
614 HE21 GLN 77 1HE2 GLN 77 5.152 -23.042 4.966
615 HE22 GLN 77 2HE2 GLN 77 6.772 -22.527 4.668
616 H ASN 78 H ASN 78 4.148 -18.460 7.170
617 HA ASN 78 HA ASN 78 5.953 -17.344 7.831
618 HB2 ASN 78 2HB ASN 78 6.035 -18.958 9.739
619 HB3 ASN 78 1HB ASN 78 7.109 -19.990 8.802
620 HD21 ASN 78 1HD2 ASN 78 9.281 -19.324 8.498
621 HD22 ASN 78 2HD2 ASN 78 9.993 -18.053 9.431
622 HA PRO 79 HA PRO 79 8.492 -18.226 4.064
623 HB2 PRO 79 2HB PRO 79 7.481 -16.413 2.368
624 HB3 PRO 79 1HB PRO 79 6.571 -17.904 2.699
625 HG2 PRO 79 2HG PRO 79 6.104 -15.141 3.774
626 HG3 PRO 79 1HG PRO 79 4.925 -16.358 3.243
627 HD2 PRO 79 2HD PRO 79 5.696 -15.893 5.914
628 HD3 PRO 79 1HD PRO 79 4.838 -17.329 5.314
629 H LEU 80 H LEU 80 8.586 -16.449 6.557
630 HA LEU 80 HA LEU 80 9.489 -13.848 5.785
631 HB2 LEU 80 2HB LEU 80 9.418 -15.300 8.450
632 HB3 LEU 80 1HB LEU 80 9.870 -13.607 8.273
633 HG LEU 80 HG LEU 80 7.155 -14.766 7.507
634 HD11 LEU 80 1HD1 LEU 80 6.291 -13.670 9.500
635 HD12 LEU 80 2HD1 LEU 80 7.919 -13.171 9.962
636 HD13 LEU 80 3HD1 LEU 80 7.495 -14.886 9.914
637 HD21 LEU 80 3HD2 LEU 80 8.082 -11.878 7.673
638 HD22 LEU 80 1HD2 LEU 80 6.435 -12.419 7.339
639 HD23 LEU 80 2HD2 LEU 80 7.725 -12.776 6.194
640 H LYS 81 H LYS 81 11.309 -13.844 4.691
641 HA LYS 81 HA LYS 81 13.578 -15.534 5.101
642 HB2 LYS 81 2HB LYS 81 13.360 -12.928 3.521
643 HB3 LYS 81 1HB LYS 81 14.577 -14.188 3.298
644 HG2 LYS 81 2HG LYS 81 12.954 -15.726 2.417
645 HG3 LYS 81 1HG LYS 81 11.607 -14.695 2.908
646 HD2 LYS 81 2HD LYS 81 12.416 -12.973 1.244
647 HD3 LYS 81 1HD LYS 81 13.619 -14.143 0.690
648 HE2 LYS 81 2HE LYS 81 11.828 -15.701 0.036
649 HE3 LYS 81 1HE LYS 81 10.609 -14.580 0.646
650 HZ1 LYS 81 3HZ LYS 81 11.319 -12.973 -1.026
651 HZ2 LYS 81 1HZ LYS 81 10.818 -14.421 -1.740
652 HZ3 LYS 81 2HZ LYS 81 12.464 -14.067 -1.615
653 H ILE 82 H ILE 82 15.203 -15.234 6.547
654 HA ILE 82 HA ILE 82 15.264 -12.977 8.321
655 HB ILE 82 HB ILE 82 17.332 -14.100 9.293
656 HG12 ILE 82 2HG1 ILE 82 16.671 -16.361 7.334
657 HG13 ILE 82 1HG1 ILE 82 18.063 -15.296 7.193
658 HG21 ILE 82 1HG2 ILE 82 14.814 -15.798 9.077
659 HG22 ILE 82 2HG2 ILE 82 15.097 -14.490 10.231
660 HG23 ILE 82 3HG2 ILE 82 16.060 -15.964 10.317
661 HD11 ILE 82 3HD1 ILE 82 18.958 -16.169 9.292
662 HD12 ILE 82 1HD1 ILE 82 18.685 -17.454 8.117
663 HD13 ILE 82 2HD1 ILE 82 17.559 -17.234 9.455
664 H ARG 83 H ARG 83 15.516 -11.284 6.836
665 HA ARG 83 HA ARG 83 17.785 -10.995 5.104
666 HB2 ARG 83 2HB ARG 83 15.666 -9.009 6.011
667 HB3 ARG 83 1HB ARG 83 16.900 -8.655 4.805
668 HG2 ARG 83 2HG ARG 83 15.999 -10.502 3.381
669 HG3 ARG 83 1HG ARG 83 14.709 -10.751 4.564
670 HD2 ARG 83 2HD ARG 83 13.932 -9.380 2.667
671 HD3 ARG 83 1HD ARG 83 13.900 -8.456 4.172
672 HE ARG 83 HE ARG 83 16.336 -8.131 2.647
673 HH11 ARG 83 1HH1 ARG 83 13.053 -6.899 3.059
674 HH12 ARG 83 2HH1 ARG 83 13.426 -5.345 2.373
675 HH21 ARG 83 1HH2 ARG 83 16.809 -6.072 1.770
676 HH22 ARG 83 2HH2 ARG 83 15.556 -4.878 1.645
677 H LEU 84 H LEU 84 19.097 -8.886 5.234
678 HA LEU 84 HA LEU 84 20.516 -8.859 7.771
679 HB2 LEU 84 2HB LEU 84 21.068 -7.365 5.180
680 HB3 LEU 84 1HB LEU 84 22.138 -7.388 6.574
681 HG LEU 84 HG LEU 84 21.426 -9.773 4.814
682 HD11 LEU 84 1HD1 LEU 84 22.951 -8.204 3.728
683 HD12 LEU 84 2HD1 LEU 84 23.767 -9.713 4.123
684 HD13 LEU 84 3HD1 LEU 84 24.047 -8.277 5.112
685 HD21 LEU 84 3HD2 LEU 84 21.717 -10.530 7.121
686 HD22 LEU 84 1HD2 LEU 84 23.266 -9.688 7.232
687 HD23 LEU 84 2HD2 LEU 84 23.074 -11.053 6.127
688 H THR 85 H THR 85 18.405 -8.022 8.675
689 HA THR 85 HA THR 85 18.347 -5.076 8.734
690 HB THR 85 HB THR 85 16.174 -7.024 9.649
691 HG1 THR 85 HG1 THR 85 16.204 -5.397 7.307
692 HG21 THR 85 3HG2 THR 85 16.070 -4.824 10.805
693 HG22 THR 85 1HG2 THR 85 14.710 -5.036 9.701
694 HG23 THR 85 2HG2 THR 85 16.067 -4.007 9.239
695 H ARG 86 H ARG 86 19.931 -4.675 10.190
696 HA ARG 86 HA ARG 86 20.601 -6.254 12.436
697 HB2 ARG 86 2HB ARG 86 21.326 -3.362 11.791
698 HB3 ARG 86 1HB ARG 86 22.069 -4.316 13.074
699 HG2 ARG 86 2HG ARG 86 22.923 -5.911 11.388
700 HG3 ARG 86 1HG ARG 86 22.194 -4.947 10.103
701 HD2 ARG 86 2HD ARG 86 23.658 -3.047 10.706
702 HD3 ARG 86 1HD ARG 86 24.386 -4.013 11.998
703 HE ARG 86 HE ARG 86 24.647 -5.464 9.636
704 HH11 ARG 86 1HH1 ARG 86 25.859 -2.400 10.888
705 HH12 ARG 86 2HH1 ARG 86 27.315 -2.453 9.941
706 HH21 ARG 86 1HH2 ARG 86 26.567 -5.539 8.419
707 HH22 ARG 86 2HH2 ARG 86 27.715 -4.241 8.539
708 H GLU 87 H GLU 87 19.215 -6.567 14.025
709 HA GLU 87 HA GLU 87 17.254 -4.756 15.001
710 HB2 GLU 87 2HB GLU 87 18.440 -7.271 16.241
711 HB3 GLU 87 1HB GLU 87 17.032 -6.421 16.877
712 HG2 GLU 87 2HG GLU 87 15.822 -6.875 14.759
713 HG3 GLU 87 1HG GLU 87 17.229 -7.749 14.157
714 H ALA 88 H ALA 88 17.264 -3.414 16.762
715 HA ALA 88 HA ALA 88 19.713 -3.205 18.422
716 HB1 ALA 88 3HB ALA 88 19.480 -1.219 16.982
717 HB2 ALA 88 1HB ALA 88 19.246 -0.803 18.682
718 HB3 ALA 88 2HB ALA 88 17.854 -0.945 17.607
719 HA PRO 89 HA PRO 89 16.191 -4.353 21.199
720 HB2 PRO 89 2HB PRO 89 17.913 -6.248 22.572
721 HB3 PRO 89 1HB PRO 89 16.601 -6.609 21.436
722 HG2 PRO 89 2HG PRO 89 19.271 -7.109 20.919
723 HG3 PRO 89 1HG PRO 89 18.030 -6.901 19.664
724 HD2 PRO 89 2HD PRO 89 20.008 -4.876 20.710
725 HD3 PRO 89 1HD PRO 89 19.502 -5.201 19.034
Start of MODEL 16
1 H1 HIS 1 1H HIS 1 -13.069 -15.420 5.390
2 H2 HIS 1 2H HIS 1 -14.097 -14.826 4.185
3 H3 HIS 1 3H HIS 1 -12.958 -13.807 4.915
4 HA HIS 1 HA HIS 1 -12.336 -16.174 3.255
5 HB2 HIS 1 2HB HIS 1 -12.275 -13.203 2.607
6 HB3 HIS 1 1HB HIS 1 -11.384 -14.386 1.654
7 HD1 HIS 1 HD1 HIS 1 -12.782 -16.082 0.256
8 HD2 HIS 1 HD2 HIS 1 -15.045 -13.114 2.088
9 HE1 HIS 1 HE1 HIS 1 -15.023 -16.147 -0.871
10 HE2 HIS 1 HE2 HIS 1 -16.422 -14.516 0.422
11 H HIS 2 H HIS 2 -11.060 -16.778 5.197
12 HA HIS 2 HA HIS 2 -8.539 -15.354 5.587
13 HB2 HIS 2 2HB HIS 2 -9.620 -16.448 7.547
14 HB3 HIS 2 1HB HIS 2 -9.502 -18.014 6.752
15 HD1 HIS 2 HD1 HIS 2 -7.301 -15.309 8.240
16 HD2 HIS 2 HD2 HIS 2 -7.048 -19.304 7.111
17 HE1 HIS 2 HE1 HIS 2 -5.045 -16.095 9.011
18 HE2 HIS 2 HE2 HIS 2 -4.990 -18.540 8.461
19 H HIS 3 H HIS 3 -7.316 -15.492 3.795
20 HA HIS 3 HA HIS 3 -6.433 -18.158 2.875
21 HB2 HIS 3 2HB HIS 3 -6.454 -17.417 0.520
22 HB3 HIS 3 1HB HIS 3 -8.070 -17.354 1.204
23 HD1 HIS 3 HD1 HIS 3 -5.589 -15.306 -0.547
24 HD2 HIS 3 HD2 HIS 3 -8.966 -14.618 1.782
25 HE1 HIS 3 HE1 HIS 3 -6.268 -12.937 -1.023
26 HE2 HIS 3 HE2 HIS 3 -8.392 -12.608 0.274
27 H HIS 4 H HIS 4 -4.379 -18.122 1.821
28 HA HIS 4 HA HIS 4 -2.622 -15.840 2.102
29 HB2 HIS 4 2HB HIS 4 -0.972 -17.032 3.523
30 HB3 HIS 4 1HB HIS 4 -2.497 -16.825 4.363
31 HD1 HIS 4 HD1 HIS 4 -3.462 -18.880 5.408
32 HD2 HIS 4 HD2 HIS 4 -0.574 -19.791 2.564
33 HE1 HIS 4 HE1 HIS 4 -3.127 -21.360 5.539
34 HE2 HIS 4 HE2 HIS 4 -1.447 -21.889 3.763
35 H HIS 5 H HIS 5 -0.616 -16.130 0.986
36 HA HIS 5 HA HIS 5 0.042 -18.543 -0.439
37 HB2 HIS 5 2HB HIS 5 -1.834 -17.548 -1.849
38 HB3 HIS 5 1HB HIS 5 -0.829 -16.128 -2.113
39 HD1 HIS 5 HD1 HIS 5 -0.647 -19.889 -2.712
40 HD2 HIS 5 HD2 HIS 5 0.687 -16.332 -4.386
41 HE1 HIS 5 HE1 HIS 5 0.548 -20.541 -4.820
42 HE2 HIS 5 HE2 HIS 5 1.540 -18.402 -5.663
43 H HIS 6 H HIS 6 1.381 -17.244 1.451
44 HA HIS 6 HA HIS 6 3.250 -16.207 2.133
45 HB2 HIS 6 2HB HIS 6 4.506 -17.496 0.478
46 HB3 HIS 6 1HB HIS 6 4.060 -16.379 -0.803
47 HD1 HIS 6 HD1 HIS 6 5.628 -14.449 -1.216
48 HD2 HIS 6 HD2 HIS 6 6.332 -16.294 2.441
49 HE1 HIS 6 HE1 HIS 6 7.689 -13.349 -0.284
50 HE2 HIS 6 HE2 HIS 6 8.143 -14.560 1.868
51 H SER 7 H SER 7 4.187 -14.089 2.365
52 HA SER 7 HA SER 7 3.427 -11.923 0.625
53 HB2 SER 7 2HB SER 7 2.225 -10.646 2.425
54 HB3 SER 7 1HB SER 7 1.368 -12.111 1.944
55 HG SER 7 HG SER 7 2.413 -11.418 4.360
56 H HIS 8 H HIS 8 4.152 -9.784 1.595
57 HA HIS 8 HA HIS 8 6.671 -9.737 2.970
58 HB2 HIS 8 2HB HIS 8 4.531 -7.584 2.548
59 HB3 HIS 8 1HB HIS 8 6.098 -7.269 3.291
60 HD1 HIS 8 HD1 HIS 8 7.419 -6.007 1.668
61 HD2 HIS 8 HD2 HIS 8 5.240 -9.003 -0.199
62 HE1 HIS 8 HE1 HIS 8 8.053 -5.890 -0.756
63 HE2 HIS 8 HE2 HIS 8 6.833 -7.808 -1.829
64 H MET 9 H MET 9 6.870 -8.749 5.255
65 HA MET 9 HA MET 9 5.513 -10.327 7.108
66 HB2 MET 9 2HB MET 9 6.476 -9.023 8.897
67 HB3 MET 9 1HB MET 9 7.675 -9.109 7.618
68 HG2 MET 9 2HG MET 9 7.291 -6.811 7.001
69 HG3 MET 9 1HG MET 9 5.863 -6.716 8.034
70 HE1 MET 9 3HE MET 9 7.736 -4.366 8.459
71 HE2 MET 9 1HE MET 9 8.027 -4.393 10.197
72 HE3 MET 9 2HE MET 9 6.411 -4.724 9.571
73 H VAL 10 H VAL 10 3.589 -10.174 8.096
74 HA VAL 10 HA VAL 10 1.586 -8.327 7.360
75 HB VAL 10 HB VAL 10 0.354 -9.349 9.430
76 HG11 VAL 10 1HG1 VAL 10 -0.070 -10.150 7.146
77 HG12 VAL 10 2HG1 VAL 10 -0.038 -11.512 8.263
78 HG13 VAL 10 3HG1 VAL 10 1.350 -11.197 7.220
79 HG21 VAL 10 3HG2 VAL 10 1.337 -11.442 10.328
80 HG22 VAL 10 1HG2 VAL 10 2.352 -10.047 10.699
81 HG23 VAL 10 2HG2 VAL 10 2.812 -11.151 9.401
82 H GLY 11 H GLY 11 1.649 -6.215 7.826
83 HA2 GLY 11 2HA GLY 11 1.645 -4.415 9.498
84 HA3 GLY 11 1HA GLY 11 2.918 -5.276 10.343
85 H ASP 12 H ASP 12 3.304 -5.395 6.917
86 HA ASP 12 HA ASP 12 5.849 -4.160 7.026
87 HB2 ASP 12 2HB ASP 12 5.127 -5.863 5.292
88 HB3 ASP 12 1HB ASP 12 4.183 -4.606 4.502
89 H THR 13 H THR 13 6.552 -2.109 6.581
90 HA THR 13 HA THR 13 4.581 0.019 6.753
91 HB THR 13 HB THR 13 7.625 0.199 6.731
92 HG1 THR 13 HG1 THR 13 5.893 -0.865 8.523
93 HG21 THR 13 3HG2 THR 13 6.485 2.392 6.382
94 HG22 THR 13 1HG2 THR 13 7.258 2.321 7.967
95 HG23 THR 13 2HG2 THR 13 5.511 2.115 7.829
96 H VAL 14 H VAL 14 3.667 0.550 4.870
97 HA VAL 14 HA VAL 14 5.316 1.401 2.573
98 HB VAL 14 HB VAL 14 3.668 0.579 0.967
99 HG11 VAL 14 1HG1 VAL 14 4.440 -1.676 2.849
100 HG12 VAL 14 2HG1 VAL 14 5.458 -0.989 1.583
101 HG13 VAL 14 3HG1 VAL 14 3.977 -1.849 1.152
102 HG21 VAL 14 3HG2 VAL 14 1.708 -0.792 1.623
103 HG22 VAL 14 1HG2 VAL 14 1.617 0.835 2.303
104 HG23 VAL 14 2HG2 VAL 14 2.086 -0.522 3.327
105 H TRP 15 H TRP 15 3.691 2.605 1.034
106 HA TRP 15 HA TRP 15 1.862 4.411 2.470
107 HB2 TRP 15 2HB TRP 15 3.859 5.118 0.253
108 HB3 TRP 15 1HB TRP 15 2.602 6.205 0.831
109 HD1 TRP 15 HD1 TRP 15 3.154 5.596 4.024
110 HE1 TRP 15 HE1 TRP 15 5.212 6.690 5.101
111 HE3 TRP 15 HE3 TRP 15 5.884 6.524 -0.181
112 HZ2 TRP 15 HZ2 TRP 15 7.662 7.815 4.283
113 HZ3 TRP 15 HZ3 TRP 15 8.078 7.613 0.037
114 HH2 TRP 15 HH2 TRP 15 8.952 8.248 2.230
115 H VAL 16 H VAL 16 0.044 5.034 1.168
116 HA VAL 16 HA VAL 16 -0.360 3.500 -1.329
117 HB VAL 16 HB VAL 16 -2.473 4.693 0.537
118 HG11 VAL 16 1HG1 VAL 16 -3.202 4.979 -1.808
119 HG12 VAL 16 2HG1 VAL 16 -4.163 3.724 -1.023
120 HG13 VAL 16 3HG1 VAL 16 -2.869 3.276 -2.139
121 HG21 VAL 16 3HG2 VAL 16 -1.863 1.804 -0.219
122 HG22 VAL 16 1HG2 VAL 16 -3.176 2.333 0.839
123 HG23 VAL 16 2HG2 VAL 16 -1.497 2.563 1.332
124 H ARG 17 H ARG 17 0.285 4.677 -2.928
125 HA ARG 17 HA ARG 17 0.161 7.549 -3.058
126 HB2 ARG 17 2HB ARG 17 2.093 6.186 -3.910
127 HB3 ARG 17 1HB ARG 17 1.037 5.513 -5.150
128 HG2 ARG 17 2HG ARG 17 0.738 7.761 -6.117
129 HG3 ARG 17 1HG ARG 17 1.777 8.443 -4.859
130 HD2 ARG 17 2HD ARG 17 3.012 8.130 -6.959
131 HD3 ARG 17 1HD ARG 17 3.669 7.105 -5.678
132 HE ARG 17 HE ARG 17 1.806 5.565 -7.056
133 HH11 ARG 17 1HH1 ARG 17 4.856 7.158 -7.829
134 HH12 ARG 17 2HH1 ARG 17 5.278 6.012 -9.060
135 HH21 ARG 17 1HH2 ARG 17 2.371 4.079 -8.657
136 HH22 ARG 17 2HH2 ARG 17 3.854 4.255 -9.529
137 H ARG 18 H ARG 18 -1.973 8.147 -3.133
138 HA ARG 18 HA ARG 18 -3.916 6.855 -4.840
139 HB2 ARG 18 2HB ARG 18 -4.565 7.871 -2.651
140 HB3 ARG 18 1HB ARG 18 -4.135 9.465 -3.264
141 HG2 ARG 18 2HG ARG 18 -5.903 9.211 -5.027
142 HG3 ARG 18 1HG ARG 18 -6.361 7.671 -4.302
143 HD2 ARG 18 2HD ARG 18 -6.924 8.878 -2.193
144 HD3 ARG 18 1HD ARG 18 -6.526 10.404 -2.990
145 HE ARG 18 HE ARG 18 -8.537 8.785 -4.330
146 HH11 ARG 18 1HH1 ARG 18 -8.009 11.422 -2.043
147 HH12 ARG 18 2HH1 ARG 18 -9.617 12.054 -2.223
148 HH21 ARG 18 1HH2 ARG 18 -10.675 9.602 -4.490
149 HH22 ARG 18 2HH2 ARG 18 -11.110 11.026 -3.599
150 H HIS 19 H HIS 19 -3.786 7.149 -6.999
151 HA HIS 19 HA HIS 19 -2.784 9.565 -8.217
152 HB2 HIS 19 2HB HIS 19 -2.483 7.397 -9.378
153 HB3 HIS 19 1HB HIS 19 -4.229 7.212 -9.512
154 HD1 HIS 19 HD1 HIS 19 -4.795 7.570 -11.915
155 HD2 HIS 19 HD2 HIS 19 -1.949 10.305 -10.609
156 HE1 HIS 19 HE1 HIS 19 -4.386 9.104 -13.862
157 HE2 HIS 19 HE2 HIS 19 -2.784 10.842 -12.991
158 H GLN 20 H GLN 20 -3.930 11.332 -8.726
159 HA GLN 20 HA GLN 20 -6.791 11.497 -8.297
160 HB2 GLN 20 2HB GLN 20 -4.860 13.565 -9.442
161 HB3 GLN 20 1HB GLN 20 -6.496 13.876 -8.867
162 HG2 GLN 20 2HG GLN 20 -4.119 13.013 -7.192
163 HG3 GLN 20 1HG GLN 20 -4.871 14.606 -7.211
164 HE21 GLN 20 1HE2 GLN 20 -4.450 12.802 -4.958
165 HE22 GLN 20 2HE2 GLN 20 -6.009 12.507 -4.274
166 H THR 21 H THR 21 -7.274 13.339 -10.615
167 HA THR 21 HA THR 21 -8.301 11.346 -12.362
168 HB THR 21 HB THR 21 -8.215 14.310 -13.046
169 HG1 THR 21 HG1 THR 21 -9.399 13.084 -10.858
170 HG21 THR 21 3HG2 THR 21 -9.297 12.770 -14.696
171 HG22 THR 21 1HG2 THR 21 -10.460 13.886 -13.973
172 HG23 THR 21 2HG2 THR 21 -10.393 12.209 -13.430
173 H LYS 22 H LYS 22 -7.990 11.770 -14.937
174 HA LYS 22 HA LYS 22 -5.594 10.603 -15.651
175 HB2 LYS 22 2HB LYS 22 -7.313 12.331 -17.474
176 HB3 LYS 22 1HB LYS 22 -6.199 11.067 -17.986
177 HG2 LYS 22 2HG LYS 22 -7.616 9.350 -16.973
178 HG3 LYS 22 1HG LYS 22 -8.695 10.583 -16.315
179 HD2 LYS 22 2HD LYS 22 -8.229 9.998 -19.275
180 HD3 LYS 22 1HD LYS 22 -9.660 9.552 -18.342
181 HE2 LYS 22 2HE LYS 22 -10.188 11.933 -17.990
182 HE3 LYS 22 1HE LYS 22 -8.737 12.400 -18.881
183 HZ1 LYS 22 3HZ LYS 22 -11.090 10.959 -19.978
184 HZ2 LYS 22 1HZ LYS 22 -9.672 11.281 -20.832
185 HZ3 LYS 22 2HZ LYS 22 -10.634 12.556 -20.301
186 H ASN 23 H ASN 23 -6.469 14.049 -16.028
187 HA ASN 23 HA ASN 23 -3.874 14.785 -17.103
188 HB2 ASN 23 2HB ASN 23 -6.173 16.620 -16.287
189 HB3 ASN 23 1HB ASN 23 -4.802 17.046 -17.308
190 HD21 ASN 23 1HD2 ASN 23 -7.618 17.268 -17.922
191 HD22 ASN 23 2HD2 ASN 23 -7.916 16.294 -19.319
192 H LEU 24 H LEU 24 -4.759 14.076 -14.064
193 HA LEU 24 HA LEU 24 -3.066 16.119 -12.752
194 HB2 LEU 24 2HB LEU 24 -5.256 14.381 -11.527
195 HB3 LEU 24 1HB LEU 24 -4.283 15.568 -10.665
196 HG LEU 24 HG LEU 24 -6.322 16.179 -12.846
197 HD11 LEU 24 1HD1 LEU 24 -6.438 16.709 -9.861
198 HD12 LEU 24 2HD1 LEU 24 -7.379 15.509 -10.754
199 HD13 LEU 24 3HD1 LEU 24 -7.634 17.225 -11.059
200 HD21 LEU 24 3HD2 LEU 24 -5.937 18.558 -12.329
201 HD22 LEU 24 1HD2 LEU 24 -4.479 17.790 -12.950
202 HD23 LEU 24 2HD2 LEU 24 -4.634 18.120 -11.220
203 H GLU 25 H GLU 25 -1.761 15.365 -10.997
204 HA GLU 25 HA GLU 25 -0.406 12.828 -11.586
205 HB2 GLU 25 2HB GLU 25 0.425 15.264 -9.939
206 HB3 GLU 25 1HB GLU 25 1.443 13.851 -10.214
207 HG2 GLU 25 2HG GLU 25 1.427 14.315 -12.648
208 HG3 GLU 25 1HG GLU 25 0.416 15.733 -12.368
209 HA PRO 26 HA PRO 26 -1.713 11.048 -7.634
210 HB2 PRO 26 2HB PRO 26 0.200 9.213 -7.110
211 HB3 PRO 26 1HB PRO 26 -0.819 9.082 -8.559
212 HG2 PRO 26 2HG PRO 26 1.993 10.109 -8.328
213 HG3 PRO 26 1HG PRO 26 1.287 9.025 -9.550
214 HD2 PRO 26 2HD PRO 26 1.631 11.750 -9.921
215 HD3 PRO 26 1HD PRO 26 0.432 10.772 -10.791
216 H ARG 27 H ARG 27 -1.050 10.593 -5.350
217 HA ARG 27 HA ARG 27 1.251 11.964 -4.218
218 HB2 ARG 27 2HB ARG 27 -0.467 13.783 -4.360
219 HB3 ARG 27 1HB ARG 27 -1.590 12.793 -3.432
220 HG2 ARG 27 2HG ARG 27 -0.108 12.907 -1.463
221 HG3 ARG 27 1HG ARG 27 1.087 13.814 -2.395
222 HD2 ARG 27 2HD ARG 27 -1.716 14.743 -1.679
223 HD3 ARG 27 1HD ARG 27 -0.209 15.324 -0.961
224 HE ARG 27 HE ARG 27 0.059 15.753 -3.669
225 HH11 ARG 27 1HH1 ARG 27 -2.209 16.880 -1.205
226 HH12 ARG 27 2HH1 ARG 27 -2.526 18.374 -2.027
227 HH21 ARG 27 1HH2 ARG 27 -0.383 17.702 -4.720
228 HH22 ARG 27 2HH2 ARG 27 -1.491 18.834 -4.017
229 H TRP 28 H TRP 28 1.963 10.768 -2.511
230 HA TRP 28 HA TRP 28 0.393 8.461 -1.658
231 HB2 TRP 28 2HB TRP 28 2.482 7.714 -0.516
232 HB3 TRP 28 1HB TRP 28 2.716 8.018 -2.229
233 HD1 TRP 28 HD1 TRP 28 4.541 9.818 -2.902
234 HE1 TRP 28 HE1 TRP 28 6.260 11.180 -1.565
235 HE3 TRP 28 HE3 TRP 28 2.779 8.981 1.842
236 HZ2 TRP 28 HZ2 TRP 28 6.804 11.826 1.119
237 HZ3 TRP 28 HZ3 TRP 28 3.953 10.016 3.734
238 HH2 TRP 28 HH2 TRP 28 5.929 11.412 3.381
239 H LYS 29 H LYS 29 -0.149 7.957 0.438
240 HA LYS 29 HA LYS 29 0.518 9.798 2.654
241 HB2 LYS 29 2HB LYS 29 -2.226 8.504 2.240
242 HB3 LYS 29 1HB LYS 29 -1.734 9.403 3.675
243 HG2 LYS 29 2HG LYS 29 -1.474 11.441 2.231
244 HG3 LYS 29 1HG LYS 29 -2.118 10.515 0.874
245 HD2 LYS 29 2HD LYS 29 -3.625 11.020 3.478
246 HD3 LYS 29 1HD LYS 29 -3.795 12.012 2.031
247 HE2 LYS 29 2HE LYS 29 -5.646 10.517 2.021
248 HE3 LYS 29 1HE LYS 29 -4.533 9.885 0.814
249 HZ1 LYS 29 3HZ LYS 29 -3.829 8.199 2.364
250 HZ2 LYS 29 1HZ LYS 29 -5.511 8.169 2.241
251 HZ3 LYS 29 2HZ LYS 29 -4.780 8.861 3.591
252 H GLY 30 H GLY 30 0.336 8.608 4.788
253 HA2 GLY 30 2HA GLY 30 -0.025 5.905 5.154
254 HA3 GLY 30 1HA GLY 30 1.624 6.048 4.603
255 HA PRO 31 HA PRO 31 2.662 4.737 5.741
256 HB2 PRO 31 2HB PRO 31 3.698 3.284 7.788
257 HB3 PRO 31 1HB PRO 31 4.479 4.767 7.203
258 HG2 PRO 31 2HG PRO 31 2.812 4.362 9.654
259 HG3 PRO 31 1HG PRO 31 4.250 5.379 9.421
260 HD2 PRO 31 2HD PRO 31 1.597 6.300 9.367
261 HD3 PRO 31 1HD PRO 31 2.998 7.174 8.711
262 H TYR 32 H TYR 32 1.201 3.381 4.942
263 HA TYR 32 HA TYR 32 -0.825 1.994 6.498
264 HB2 TYR 32 2HB TYR 32 -0.059 1.968 3.548
265 HB3 TYR 32 1HB TYR 32 -1.315 0.937 4.211
266 HD1 TYR 32 HD1 TYR 32 -3.467 1.874 4.946
267 HD2 TYR 32 HD2 TYR 32 -0.439 4.410 3.308
268 HE1 TYR 32 HE1 TYR 32 -5.120 3.671 4.661
269 HE2 TYR 32 HE2 TYR 32 -2.094 6.200 3.022
270 HH TYR 32 HH TYR 32 -5.098 6.188 4.496
271 H THR 33 H THR 33 -0.951 -0.372 6.581
272 HA THR 33 HA THR 33 1.724 -1.653 6.614
273 HB THR 33 HB THR 33 0.772 -3.112 8.463
274 HG1 THR 33 HG1 THR 33 -1.437 -2.805 8.121
275 HG21 THR 33 3HG2 THR 33 0.951 -1.417 10.253
276 HG22 THR 33 1HG2 THR 33 0.795 -0.127 9.055
277 HG23 THR 33 2HG2 THR 33 2.209 -1.186 9.038
278 H VAL 34 H VAL 34 1.895 -2.959 4.824
279 HA VAL 34 HA VAL 34 -0.262 -4.450 3.679
280 HB VAL 34 HB VAL 34 2.757 -4.846 3.334
281 HG11 VAL 34 1HG1 VAL 34 1.593 -6.967 2.825
282 HG12 VAL 34 2HG1 VAL 34 2.212 -6.239 1.344
283 HG13 VAL 34 3HG1 VAL 34 0.492 -6.123 1.732
284 HG21 VAL 34 3HG2 VAL 34 1.945 -2.695 2.471
285 HG22 VAL 34 1HG2 VAL 34 0.717 -3.518 1.509
286 HG23 VAL 34 2HG2 VAL 34 2.431 -3.750 1.145
287 H LEU 35 H LEU 35 -1.040 -6.347 4.227
288 HA LEU 35 HA LEU 35 0.203 -7.970 6.352
289 HB2 LEU 35 2HB LEU 35 -2.630 -8.112 5.243
290 HB3 LEU 35 1HB LEU 35 -2.011 -8.948 6.664
291 HG LEU 35 HG LEU 35 -2.393 -5.937 6.395
292 HD11 LEU 35 1HD1 LEU 35 -4.183 -6.231 8.050
293 HD12 LEU 35 2HD1 LEU 35 -3.963 -7.981 7.981
294 HD13 LEU 35 3HD1 LEU 35 -4.513 -7.100 6.552
295 HD21 LEU 35 3HD2 LEU 35 -1.850 -5.822 8.800
296 HD22 LEU 35 1HD2 LEU 35 -0.486 -6.406 7.849
297 HD23 LEU 35 2HD2 LEU 35 -1.449 -7.542 8.799
298 H LEU 36 H LEU 36 -1.586 -8.300 3.278
299 HA LEU 36 HA LEU 36 -0.214 -10.878 2.726
300 HB2 LEU 36 2HB LEU 36 -2.514 -11.238 3.538
301 HB3 LEU 36 1HB LEU 36 -3.136 -10.168 2.300
302 HG LEU 36 HG LEU 36 -2.393 -11.804 0.546
303 HD11 LEU 36 1HD1 LEU 36 -0.550 -12.887 1.738
304 HD12 LEU 36 2HD1 LEU 36 -1.725 -14.078 1.184
305 HD13 LEU 36 3HD1 LEU 36 -1.688 -13.604 2.885
306 HD21 LEU 36 3HD2 LEU 36 -4.257 -12.918 2.663
307 HD22 LEU 36 1HD2 LEU 36 -4.160 -13.459 0.984
308 HD23 LEU 36 2HD2 LEU 36 -4.693 -11.821 1.350
309 H THR 37 H THR 37 -0.010 -11.390 0.450
310 HA THR 37 HA THR 37 -0.162 -9.075 -1.401
311 HB THR 37 HB THR 37 1.960 -9.876 -2.450
312 HG1 THR 37 HG1 THR 37 1.543 -12.070 -1.065
313 HG21 THR 37 3HG2 THR 37 3.535 -9.151 -0.691
314 HG22 THR 37 1HG2 THR 37 2.269 -9.336 0.526
315 HG23 THR 37 2HG2 THR 37 2.113 -8.108 -0.732
316 H THR 38 H THR 38 -1.157 -9.509 -3.306
317 HA THR 38 HA THR 38 -1.597 -12.264 -4.262
318 HB THR 38 HB THR 38 -4.055 -11.573 -4.740
319 HG1 THR 38 HG1 THR 38 -3.405 -9.285 -4.006
320 HG21 THR 38 3HG2 THR 38 -3.560 -13.237 -2.971
321 HG22 THR 38 1HG2 THR 38 -4.886 -12.184 -2.484
322 HG23 THR 38 2HG2 THR 38 -3.268 -11.933 -1.816
323 HA PRO 39 HA PRO 39 0.709 -9.915 -7.461
324 HB2 PRO 39 2HB PRO 39 -0.772 -11.973 -9.133
325 HB3 PRO 39 1HB PRO 39 0.908 -11.402 -9.285
326 HG2 PRO 39 2HG PRO 39 0.289 -13.700 -8.005
327 HG3 PRO 39 1HG PRO 39 1.656 -12.678 -7.519
328 HD2 PRO 39 2HD PRO 39 -0.829 -13.197 -6.045
329 HD3 PRO 39 1HD PRO 39 0.641 -12.380 -5.484
330 H THR 40 H THR 40 0.280 -8.067 -8.436
331 HA THR 40 HA THR 40 -0.627 -6.391 -9.642
332 HB THR 40 HB THR 40 -3.151 -8.070 -10.037
333 HG1 THR 40 HG1 THR 40 -0.750 -8.378 -11.070
334 HG21 THR 40 3HG2 THR 40 -3.618 -5.656 -10.397
335 HG22 THR 40 1HG2 THR 40 -3.665 -6.549 -11.922
336 HG23 THR 40 2HG2 THR 40 -2.260 -5.558 -11.515
337 H ALA 41 H ALA 41 -1.910 -7.712 -6.766
338 HA ALA 41 HA ALA 41 -2.547 -5.022 -5.823
339 HB1 ALA 41 3HB ALA 41 -4.599 -7.261 -5.615
340 HB2 ALA 41 1HB ALA 41 -4.733 -5.834 -6.642
341 HB3 ALA 41 2HB ALA 41 -4.741 -5.658 -4.887
342 H LEU 42 H LEU 42 -2.344 -4.820 -3.549
343 HA LEU 42 HA LEU 42 -1.378 -7.193 -2.051
344 HB2 LEU 42 2HB LEU 42 -0.564 -4.293 -1.546
345 HB3 LEU 42 1HB LEU 42 0.073 -5.723 -0.745
346 HG LEU 42 HG LEU 42 0.571 -4.845 -3.622
347 HD11 LEU 42 1HD1 LEU 42 2.482 -5.187 -1.292
348 HD12 LEU 42 2HD1 LEU 42 1.900 -3.660 -1.960
349 HD13 LEU 42 3HD1 LEU 42 2.913 -4.711 -2.942
350 HD21 LEU 42 3HD2 LEU 42 0.333 -7.273 -3.633
351 HD22 LEU 42 1HD2 LEU 42 1.490 -7.422 -2.312
352 HD23 LEU 42 2HD2 LEU 42 2.012 -6.821 -3.886
353 H LYS 43 H LYS 43 -2.455 -7.621 -0.161
354 HA LYS 43 HA LYS 43 -4.800 -6.054 0.518
355 HB2 LYS 43 2HB LYS 43 -4.875 -8.555 0.572
356 HB3 LYS 43 1HB LYS 43 -3.658 -8.559 1.842
357 HG2 LYS 43 2HG LYS 43 -5.224 -7.315 3.326
358 HG3 LYS 43 1HG LYS 43 -6.447 -7.375 2.055
359 HD2 LYS 43 2HD LYS 43 -6.385 -9.882 2.191
360 HD3 LYS 43 1HD LYS 43 -5.248 -9.741 3.542
361 HE2 LYS 43 2HE LYS 43 -8.117 -8.733 3.466
362 HE3 LYS 43 1HE LYS 43 -7.498 -10.088 4.411
363 HZ1 LYS 43 3HZ LYS 43 -7.769 -8.171 5.801
364 HZ2 LYS 43 1HZ LYS 43 -6.805 -7.218 4.794
365 HZ3 LYS 43 2HZ LYS 43 -6.122 -8.502 5.656
366 H VAL 44 H VAL 44 -4.494 -4.292 1.648
367 HA VAL 44 HA VAL 44 -2.354 -4.045 3.682
368 HB VAL 44 HB VAL 44 -3.840 -1.871 2.122
369 HG11 VAL 44 1HG1 VAL 44 -1.466 -1.618 3.995
370 HG12 VAL 44 2HG1 VAL 44 -3.113 -1.075 4.321
371 HG13 VAL 44 3HG1 VAL 44 -2.172 -0.310 3.042
372 HG21 VAL 44 3HG2 VAL 44 -1.738 -1.510 0.874
373 HG22 VAL 44 1HG2 VAL 44 -2.345 -3.150 0.628
374 HG23 VAL 44 2HG2 VAL 44 -0.990 -2.865 1.721
375 H ASP 45 H ASP 45 -2.946 -3.630 5.764
376 HA ASP 45 HA ASP 45 -5.618 -3.752 6.698
377 HB2 ASP 45 2HB ASP 45 -3.583 -4.452 8.006
378 HB3 ASP 45 1HB ASP 45 -3.136 -2.759 8.163
379 H GLY 46 H GLY 46 -6.954 -2.109 7.542
380 HA2 GLY 46 2HA GLY 46 -7.695 0.077 7.940
381 HA3 GLY 46 1HA GLY 46 -6.236 0.718 7.195
382 H ILE 47 H ILE 47 -6.809 -1.312 4.932
383 HA ILE 47 HA ILE 47 -8.474 0.461 3.292
384 HB ILE 47 HB ILE 47 -6.647 -1.881 2.572
385 HG12 ILE 47 2HG1 ILE 47 -5.382 0.043 3.442
386 HG13 ILE 47 1HG1 ILE 47 -5.081 -0.139 1.721
387 HG21 ILE 47 1HG2 ILE 47 -6.820 -1.179 0.217
388 HG22 ILE 47 2HG2 ILE 47 -8.010 0.046 0.660
389 HG23 ILE 47 3HG2 ILE 47 -8.392 -1.665 0.857
390 HD11 ILE 47 3HD1 ILE 47 -6.632 1.720 1.269
391 HD12 ILE 47 1HD1 ILE 47 -5.289 2.181 2.315
392 HD13 ILE 47 2HD1 ILE 47 -6.887 1.909 3.010
393 H ALA 48 H ALA 48 -10.114 -0.489 1.853
394 HA ALA 48 HA ALA 48 -12.084 -1.978 3.099
395 HB1 ALA 48 3HB ALA 48 -12.491 -0.521 1.149
396 HB2 ALA 48 1HB ALA 48 -13.166 -2.130 0.885
397 HB3 ALA 48 2HB ALA 48 -11.653 -1.667 0.102
398 H ALA 49 H ALA 49 -9.869 -3.174 0.501
399 HA ALA 49 HA ALA 49 -9.477 -5.637 1.994
400 HB1 ALA 49 3HB ALA 49 -11.473 -6.188 0.656
401 HB2 ALA 49 1HB ALA 49 -10.079 -7.150 0.157
402 HB3 ALA 49 2HB ALA 49 -10.604 -5.778 -0.823
403 H TRP 50 H TRP 50 -8.832 -4.170 -1.251
404 HA TRP 50 HA TRP 50 -5.963 -4.865 -0.975
405 HB2 TRP 50 2HB TRP 50 -7.712 -5.516 -3.397
406 HB3 TRP 50 1HB TRP 50 -5.957 -5.571 -3.418
407 HD1 TRP 50 HD1 TRP 50 -4.799 -7.503 -1.800
408 HE1 TRP 50 HE1 TRP 50 -5.636 -9.865 -1.259
409 HE3 TRP 50 HE3 TRP 50 -9.731 -6.932 -3.028
410 HZ2 TRP 50 HZ2 TRP 50 -8.051 -11.318 -1.342
411 HZ3 TRP 50 HZ3 TRP 50 -11.241 -8.863 -2.779
412 HH2 TRP 50 HH2 TRP 50 -10.419 -11.012 -1.953
413 H ILE 51 H ILE 51 -4.647 -3.254 -1.558
414 HA ILE 51 HA ILE 51 -5.524 -1.044 -3.287
415 HB ILE 51 HB ILE 51 -2.960 -1.499 -1.676
416 HG12 ILE 51 2HG1 ILE 51 -4.960 -0.794 -0.355
417 HG13 ILE 51 1HG1 ILE 51 -3.695 0.426 -0.332
418 HG21 ILE 51 1HG2 ILE 51 -3.576 0.858 -3.503
419 HG22 ILE 51 2HG2 ILE 51 -2.307 -0.348 -3.731
420 HG23 ILE 51 3HG2 ILE 51 -2.221 0.769 -2.371
421 HD11 ILE 51 3HD1 ILE 51 -4.934 1.732 -1.996
422 HD12 ILE 51 1HD1 ILE 51 -5.887 1.418 -0.549
423 HD13 ILE 51 2HD1 ILE 51 -6.198 0.499 -2.017
424 H HIS 52 H HIS 52 -5.098 -1.112 -5.418
425 HA HIS 52 HA HIS 52 -3.839 -3.285 -6.741
426 HB2 HIS 52 2HB HIS 52 -5.664 -1.696 -7.656
427 HB3 HIS 52 1HB HIS 52 -4.386 -0.517 -7.911
428 HD1 HIS 52 HD1 HIS 52 -2.562 -1.182 -9.781
429 HD2 HIS 52 HD2 HIS 52 -5.982 -3.535 -9.627
430 HE1 HIS 52 HE1 HIS 52 -2.668 -2.376 -11.986
431 HE2 HIS 52 HE2 HIS 52 -4.761 -3.758 -11.877
432 H ALA 53 H ALA 53 -1.721 -3.347 -7.705
433 HA ALA 53 HA ALA 53 0.157 -2.657 -5.766
434 HB1 ALA 53 3HB ALA 53 0.730 -3.728 -8.547
435 HB2 ALA 53 1HB ALA 53 0.273 -4.697 -7.144
436 HB3 ALA 53 2HB ALA 53 1.804 -3.817 -7.148
437 H ALA 54 H ALA 54 -0.544 -0.971 -8.768
438 HA ALA 54 HA ALA 54 1.862 0.591 -8.849
439 HB1 ALA 54 3HB ALA 54 -0.779 1.095 -10.254
440 HB2 ALA 54 1HB ALA 54 0.547 0.119 -10.881
441 HB3 ALA 54 2HB ALA 54 0.762 1.854 -10.642
442 H HIS 55 H HIS 55 -0.694 0.742 -6.733
443 HA HIS 55 HA HIS 55 -0.249 3.586 -6.073
444 HB2 HIS 55 2HB HIS 55 -2.521 1.778 -5.116
445 HB3 HIS 55 1HB HIS 55 -2.331 3.489 -4.750
446 HD1 HIS 55 HD1 HIS 55 -2.236 4.997 -7.139
447 HD2 HIS 55 HD2 HIS 55 -4.296 1.391 -7.115
448 HE1 HIS 55 HE1 HIS 55 -3.806 5.102 -9.100
449 HE2 HIS 55 HE2 HIS 55 -5.149 2.982 -8.953
450 H VAL 56 H VAL 56 1.138 0.751 -5.344
451 HA VAL 56 HA VAL 56 1.349 1.305 -2.437
452 HB VAL 56 HB VAL 56 2.338 -1.199 -3.885
453 HG11 VAL 56 1HG1 VAL 56 3.540 -0.738 -1.786
454 HG12 VAL 56 2HG1 VAL 56 2.500 -2.147 -1.590
455 HG13 VAL 56 3HG1 VAL 56 2.010 -0.594 -0.914
456 HG21 VAL 56 3HG2 VAL 56 -0.123 -1.078 -4.034
457 HG22 VAL 56 1HG2 VAL 56 -0.228 -0.854 -2.284
458 HG23 VAL 56 2HG2 VAL 56 0.382 -2.374 -2.946
459 H LYS 57 H LYS 57 3.120 2.289 -1.736
460 HA LYS 57 HA LYS 57 5.666 2.124 -3.247
461 HB2 LYS 57 2HB LYS 57 4.763 4.356 -3.568
462 HB3 LYS 57 1HB LYS 57 4.400 4.521 -1.852
463 HG2 LYS 57 2HG LYS 57 6.739 4.694 -1.282
464 HG3 LYS 57 1HG LYS 57 7.237 4.256 -2.919
465 HD2 LYS 57 2HD LYS 57 5.679 6.780 -2.218
466 HD3 LYS 57 1HD LYS 57 7.436 6.709 -2.384
467 HE2 LYS 57 2HE LYS 57 5.421 6.094 -4.577
468 HE3 LYS 57 1HE LYS 57 6.401 7.557 -4.435
469 HZ1 LYS 57 3HZ LYS 57 7.447 4.800 -4.813
470 HZ2 LYS 57 1HZ LYS 57 8.394 6.192 -4.646
471 HZ3 LYS 57 2HZ LYS 57 7.386 6.013 -5.985
472 H ALA 58 H ALA 58 6.944 0.857 -2.047
473 HA ALA 58 HA ALA 58 6.645 0.187 0.652
474 HB1 ALA 58 3HB ALA 58 7.892 -1.205 -0.949
475 HB2 ALA 58 1HB ALA 58 8.907 -0.818 0.444
476 HB3 ALA 58 2HB ALA 58 9.140 0.034 -1.085
477 H ALA 59 H ALA 59 7.036 1.402 2.457
478 HA ALA 59 HA ALA 59 8.299 4.022 2.205
479 HB1 ALA 59 3HB ALA 59 7.510 4.376 4.516
480 HB2 ALA 59 1HB ALA 59 6.992 2.687 4.607
481 HB3 ALA 59 2HB ALA 59 6.202 3.796 3.483
482 H ASP 60 H ASP 60 10.034 4.708 3.539
483 HA ASP 60 HA ASP 60 11.924 2.584 4.356
484 HB2 ASP 60 2HB ASP 60 12.656 4.247 2.599
485 HB3 ASP 60 1HB ASP 60 12.478 5.535 3.781
486 HA PRO 61 HA PRO 61 10.876 4.273 8.513
487 HB2 PRO 61 2HB PRO 61 10.626 1.955 9.849
488 HB3 PRO 61 1HB PRO 61 9.375 2.447 8.683
489 HG2 PRO 61 2HG PRO 61 11.574 0.428 8.349
490 HG3 PRO 61 1HG PRO 61 9.878 0.351 7.814
491 HD2 PRO 61 2HD PRO 61 12.048 1.125 6.195
492 HD3 PRO 61 1HD PRO 61 10.335 1.438 5.845
493 H GLY 62 H GLY 62 13.607 2.856 7.162
494 HA2 GLY 62 2HA GLY 62 15.783 2.541 7.816
495 HA3 GLY 62 1HA GLY 62 15.411 3.320 9.347
496 H GLY 63 H GLY 63 14.276 2.026 10.985
497 HA2 GLY 63 2HA GLY 63 14.674 -0.919 10.782
498 HA3 GLY 63 1HA GLY 63 14.623 0.006 12.283
499 H GLY 64 H GLY 64 12.621 0.965 12.939
500 HA2 GLY 64 2HA GLY 64 10.203 1.283 12.291
501 HA3 GLY 64 1HA GLY 64 10.207 -0.434 11.916
502 HA PRO 65 HA PRO 65 8.897 -0.441 16.358
503 HB2 PRO 65 2HB PRO 65 7.571 -2.845 16.305
504 HB3 PRO 65 1HB PRO 65 6.831 -1.346 15.702
505 HG2 PRO 65 2HG PRO 65 8.144 -3.556 14.138
506 HG3 PRO 65 1HG PRO 65 6.628 -2.688 13.800
507 HD2 PRO 65 2HD PRO 65 8.984 -2.068 12.552
508 HD3 PRO 65 1HD PRO 65 7.725 -0.854 12.875
509 H SER 66 H SER 66 10.762 -0.799 17.523
510 HA SER 66 HA SER 66 12.648 -2.872 17.076
511 HB2 SER 66 2HB SER 66 13.600 -2.129 19.302
512 HB3 SER 66 1HB SER 66 13.330 -0.805 18.164
513 HG SER 66 HG SER 66 12.031 -1.400 20.543
514 H SER 67 H SER 67 9.762 -2.683 19.031
515 HA SER 67 HA SER 67 10.173 -5.186 20.433
516 HB2 SER 67 2HB SER 67 7.644 -3.497 20.174
517 HB3 SER 67 1HB SER 67 7.919 -4.790 21.344
518 HG SER 67 HG SER 67 9.791 -3.407 22.013
519 H ARG 68 H ARG 68 9.727 -4.677 17.275
520 HA ARG 68 HA ARG 68 9.007 -5.786 15.467
521 HB2 ARG 68 2HB ARG 68 9.584 -8.123 15.398
522 HB3 ARG 68 1HB ARG 68 10.734 -7.292 16.430
523 HG2 ARG 68 2HG ARG 68 9.194 -8.191 18.391
524 HG3 ARG 68 1HG ARG 68 8.627 -9.327 17.167
525 HD2 ARG 68 2HD ARG 68 10.415 -10.345 18.456
526 HD3 ARG 68 1HD ARG 68 10.994 -10.054 16.810
527 HE ARG 68 HE ARG 68 11.687 -7.809 18.273
528 HH11 ARG 68 1HH1 ARG 68 12.475 -11.247 18.500
529 HH12 ARG 68 2HH1 ARG 68 14.026 -10.959 19.215
530 HH21 ARG 68 1HH2 ARG 68 13.682 -7.456 19.255
531 HH22 ARG 68 2HH2 ARG 68 14.706 -8.793 19.648
532 H LEU 69 H LEU 69 6.905 -4.724 16.710
533 HA LEU 69 HA LEU 69 4.775 -6.529 17.315
534 HB2 LEU 69 2HB LEU 69 4.664 -3.563 16.657
535 HB3 LEU 69 1HB LEU 69 3.368 -4.495 17.394
536 HG LEU 69 HG LEU 69 6.070 -3.867 18.673
537 HD11 LEU 69 1HD1 LEU 69 4.635 -1.899 18.572
538 HD12 LEU 69 2HD1 LEU 69 4.797 -2.465 20.232
539 HD13 LEU 69 3HD1 LEU 69 3.311 -2.788 19.333
540 HD21 LEU 69 3HD2 LEU 69 5.264 -6.065 19.407
541 HD22 LEU 69 1HD2 LEU 69 3.711 -5.361 19.869
542 HD23 LEU 69 2HD2 LEU 69 5.189 -4.893 20.719
543 H THR 70 H THR 70 4.781 -7.876 15.478
544 HA THR 70 HA THR 70 3.469 -6.844 13.031
545 HB THR 70 HB THR 70 4.264 -9.060 12.023
546 HG1 THR 70 HG1 THR 70 6.144 -9.253 14.114
547 HG21 THR 70 3HG2 THR 70 5.529 -6.970 11.575
548 HG22 THR 70 1HG2 THR 70 6.613 -8.356 11.692
549 HG23 THR 70 2HG2 THR 70 6.480 -7.228 13.043
550 H TRP 71 H TRP 71 1.673 -8.093 12.229
551 HA TRP 71 HA TRP 71 -0.193 -8.809 14.259
552 HB2 TRP 71 2HB TRP 71 -0.354 -9.110 11.226
553 HB3 TRP 71 1HB TRP 71 -1.710 -9.341 12.322
554 HD1 TRP 71 HD1 TRP 71 0.735 -6.449 11.334
555 HE1 TRP 71 HE1 TRP 71 -0.580 -4.240 11.451
556 HE3 TRP 71 HE3 TRP 71 -3.725 -8.240 13.098
557 HZ2 TRP 71 HZ2 TRP 71 -3.158 -3.370 12.191
558 HZ3 TRP 71 HZ3 TRP 71 -5.565 -6.655 13.490
559 HH2 TRP 71 HH2 TRP 71 -5.286 -4.267 13.045
560 H ARG 72 H ARG 72 2.121 -10.650 12.530
561 HA ARG 72 HA ARG 72 2.704 -12.800 12.256
562 HB2 ARG 72 2HB ARG 72 1.365 -13.122 14.965
563 HB3 ARG 72 1HB ARG 72 2.530 -14.246 14.268
564 HG2 ARG 72 2HG ARG 72 4.260 -12.459 14.300
565 HG3 ARG 72 1HG ARG 72 3.088 -11.349 15.012
566 HD2 ARG 72 2HD ARG 72 2.903 -12.936 16.972
567 HD3 ARG 72 1HD ARG 72 4.240 -13.861 16.277
568 HE ARG 72 HE ARG 72 5.161 -11.279 16.423
569 HH11 ARG 72 1HH1 ARG 72 3.928 -13.581 18.803
570 HH12 ARG 72 2HH1 ARG 72 4.869 -12.923 20.098
571 HH21 ARG 72 1HH2 ARG 72 6.391 -10.450 18.141
572 HH22 ARG 72 2HH2 ARG 72 6.268 -11.146 19.721
573 H VAL 73 H VAL 73 0.080 -12.099 11.141
574 HA VAL 73 HA VAL 73 -1.644 -14.365 11.232
575 HB VAL 73 HB VAL 73 -1.385 -12.271 9.017
576 HG11 VAL 73 1HG1 VAL 73 -3.713 -12.887 8.412
577 HG12 VAL 73 2HG1 VAL 73 -3.682 -14.176 9.620
578 HG13 VAL 73 3HG1 VAL 73 -2.605 -14.249 8.222
579 HG21 VAL 73 3HG2 VAL 73 -1.854 -11.212 11.188
580 HG22 VAL 73 1HG2 VAL 73 -3.232 -12.286 11.438
581 HG23 VAL 73 2HG2 VAL 73 -3.262 -11.095 10.132
582 H GLN 74 H GLN 74 0.831 -13.300 8.842
583 HA GLN 74 HA GLN 74 0.704 -15.858 7.437
584 HB2 GLN 74 2HB GLN 74 0.981 -13.616 6.231
585 HB3 GLN 74 1HB GLN 74 2.614 -13.555 6.878
586 HG2 GLN 74 2HG GLN 74 2.946 -14.423 4.725
587 HG3 GLN 74 1HG GLN 74 2.951 -15.873 5.728
588 HE21 GLN 74 1HE2 GLN 74 0.175 -13.966 4.636
589 HE22 GLN 74 2HE2 GLN 74 -0.540 -15.216 3.695
590 H ARG 75 H ARG 75 1.398 -17.116 9.275
591 HA ARG 75 HA ARG 75 4.361 -17.350 9.455
592 HB2 ARG 75 2HB ARG 75 2.169 -18.397 11.302
593 HB3 ARG 75 1HB ARG 75 3.871 -18.831 11.461
594 HG2 ARG 75 2HG ARG 75 4.466 -16.537 12.006
595 HG3 ARG 75 1HG ARG 75 2.823 -15.981 11.673
596 HD2 ARG 75 2HD ARG 75 3.583 -17.943 13.875
597 HD3 ARG 75 1HD ARG 75 3.314 -16.212 14.116
598 HE ARG 75 HE ARG 75 1.009 -16.943 12.969
599 HH11 ARG 75 1HH1 ARG 75 2.720 -18.399 15.695
600 HH12 ARG 75 2HH1 ARG 75 1.266 -18.987 16.434
601 HH21 ARG 75 1HH2 ARG 75 -0.864 -17.753 13.941
602 HH22 ARG 75 2HH2 ARG 75 -0.763 -18.618 15.438
603 H SER 76 H SER 76 1.858 -18.382 7.685
604 HA SER 76 HA SER 76 1.907 -21.212 7.787
605 HB2 SER 76 2HB SER 76 0.957 -19.415 5.511
606 HB3 SER 76 1HB SER 76 0.453 -21.079 5.832
607 HG SER 76 HG SER 76 -0.400 -20.269 7.855
608 H GLN 77 H GLN 77 2.889 -19.119 5.004
609 HA GLN 77 HA GLN 77 4.905 -21.062 4.178
610 HB2 GLN 77 2HB GLN 77 3.522 -19.932 2.431
611 HB3 GLN 77 1HB GLN 77 4.182 -18.377 2.924
612 HG2 GLN 77 2HG GLN 77 5.351 -19.080 0.933
613 HG3 GLN 77 1HG GLN 77 6.475 -19.180 2.284
614 HE21 GLN 77 1HE2 GLN 77 7.101 -21.275 3.037
615 HE22 GLN 77 2HE2 GLN 77 6.901 -22.676 2.049
616 H ASN 78 H ASN 78 6.123 -20.916 6.075
617 HA ASN 78 HA ASN 78 7.884 -20.421 7.347
618 HB2 ASN 78 2HB ASN 78 8.585 -18.357 5.226
619 HB3 ASN 78 1HB ASN 78 9.665 -18.881 6.512
620 HD21 ASN 78 1HD2 ASN 78 10.604 -20.955 6.379
621 HD22 ASN 78 2HD2 ASN 78 10.586 -21.876 4.919
622 HA PRO 79 HA PRO 79 6.602 -16.841 9.913
623 HB2 PRO 79 2HB PRO 79 9.214 -17.301 11.311
624 HB3 PRO 79 1HB PRO 79 7.570 -17.261 11.975
625 HG2 PRO 79 2HG PRO 79 8.881 -19.584 11.763
626 HG3 PRO 79 1HG PRO 79 7.134 -19.487 11.438
627 HD2 PRO 79 2HD PRO 79 9.412 -19.575 9.454
628 HD3 PRO 79 1HD PRO 79 7.859 -20.449 9.426
629 H LEU 80 H LEU 80 6.806 -15.009 8.775
630 HA LEU 80 HA LEU 80 8.998 -14.367 7.102
631 HB2 LEU 80 2HB LEU 80 6.716 -12.581 8.024
632 HB3 LEU 80 1HB LEU 80 7.745 -12.301 6.622
633 HG LEU 80 HG LEU 80 5.809 -14.632 6.953
634 HD11 LEU 80 1HD1 LEU 80 4.499 -13.472 5.187
635 HD12 LEU 80 2HD1 LEU 80 5.600 -12.097 5.282
636 HD13 LEU 80 3HD1 LEU 80 4.610 -12.540 6.676
637 HD21 LEU 80 3HD2 LEU 80 7.708 -15.268 5.540
638 HD22 LEU 80 1HD2 LEU 80 7.486 -13.831 4.538
639 HD23 LEU 80 2HD2 LEU 80 6.253 -15.095 4.566
640 H LYS 81 H LYS 81 10.528 -12.786 7.234
641 HA LYS 81 HA LYS 81 11.702 -12.154 9.702
642 HB2 LYS 81 2HB LYS 81 13.216 -10.689 8.347
643 HB3 LYS 81 1HB LYS 81 13.041 -12.307 7.676
644 HG2 LYS 81 2HG LYS 81 11.394 -11.390 6.012
645 HG3 LYS 81 1HG LYS 81 11.706 -9.769 6.644
646 HD2 LYS 81 2HD LYS 81 13.809 -11.600 5.401
647 HD3 LYS 81 1HD LYS 81 12.993 -10.286 4.553
648 HE2 LYS 81 2HE LYS 81 14.025 -8.633 6.001
649 HE3 LYS 81 1HE LYS 81 14.701 -9.891 7.039
650 HZ1 LYS 81 3HZ LYS 81 16.109 -10.622 5.251
651 HZ2 LYS 81 1HZ LYS 81 16.334 -8.959 5.478
652 HZ3 LYS 81 2HZ LYS 81 15.413 -9.511 4.179
653 H ILE 82 H ILE 82 11.779 -10.260 10.890
654 HA ILE 82 HA ILE 82 9.320 -8.721 10.937
655 HB ILE 82 HB ILE 82 10.222 -7.839 13.110
656 HG12 ILE 82 2HG1 ILE 82 12.667 -9.574 12.458
657 HG13 ILE 82 1HG1 ILE 82 12.647 -7.816 12.550
658 HG21 ILE 82 1HG2 ILE 82 10.387 -10.875 12.839
659 HG22 ILE 82 2HG2 ILE 82 8.909 -9.937 13.069
660 HG23 ILE 82 3HG2 ILE 82 10.127 -9.983 14.343
661 HD11 ILE 82 3HD1 ILE 82 13.660 -8.770 14.525
662 HD12 ILE 82 1HD1 ILE 82 12.212 -9.720 14.858
663 HD13 ILE 82 2HD1 ILE 82 12.157 -7.957 14.952
664 H ARG 83 H ARG 83 11.974 -8.289 9.131
665 HA ARG 83 HA ARG 83 12.547 -6.705 7.653
666 HB2 ARG 83 2HB ARG 83 10.043 -6.030 7.901
667 HB3 ARG 83 1HB ARG 83 10.630 -4.715 8.910
668 HG2 ARG 83 2HG ARG 83 12.064 -3.989 6.915
669 HG3 ARG 83 1HG ARG 83 11.173 -5.175 5.955
670 HD2 ARG 83 2HD ARG 83 9.032 -3.974 6.703
671 HD3 ARG 83 1HD ARG 83 10.071 -2.706 7.352
672 HE ARG 83 HE ARG 83 9.292 -3.102 4.645
673 HH11 ARG 83 1HH1 ARG 83 12.015 -1.860 6.523
674 HH12 ARG 83 2HH1 ARG 83 12.561 -0.834 5.237
675 HH21 ARG 83 1HH2 ARG 83 10.033 -1.741 3.008
676 HH22 ARG 83 2HH2 ARG 83 11.444 -0.765 3.259
677 H LEU 84 H LEU 84 13.146 -6.500 10.899
678 HA LEU 84 HA LEU 84 14.289 -3.854 11.074
679 HB2 LEU 84 2HB LEU 84 14.510 -6.198 13.013
680 HB3 LEU 84 1HB LEU 84 14.976 -4.536 13.352
681 HG LEU 84 HG LEU 84 12.145 -5.578 12.924
682 HD11 LEU 84 1HD1 LEU 84 13.107 -6.135 15.110
683 HD12 LEU 84 2HD1 LEU 84 11.795 -4.971 15.265
684 HD13 LEU 84 3HD1 LEU 84 13.472 -4.432 15.403
685 HD21 LEU 84 3HD2 LEU 84 11.362 -3.296 13.442
686 HD22 LEU 84 1HD2 LEU 84 12.303 -3.342 11.952
687 HD23 LEU 84 2HD2 LEU 84 13.030 -2.715 13.434
688 H THR 85 H THR 85 16.470 -3.407 11.482
689 HA THR 85 HA THR 85 18.497 -4.935 10.105
690 HB THR 85 HB THR 85 18.470 -2.463 10.088
691 HG1 THR 85 HG1 THR 85 20.622 -2.183 10.361
692 HG21 THR 85 3HG2 THR 85 19.041 -1.132 12.087
693 HG22 THR 85 1HG2 THR 85 19.026 -2.589 13.076
694 HG23 THR 85 2HG2 THR 85 17.530 -2.018 12.324
695 H ARG 86 H ARG 86 20.745 -4.616 11.971
696 HA ARG 86 HA ARG 86 20.540 -6.950 13.532
697 HB2 ARG 86 2HB ARG 86 22.683 -6.340 14.574
698 HB3 ARG 86 1HB ARG 86 22.744 -6.088 12.831
699 HG2 ARG 86 2HG ARG 86 22.658 -3.710 13.063
700 HG3 ARG 86 1HG ARG 86 22.207 -3.814 14.768
701 HD2 ARG 86 2HD ARG 86 24.883 -4.681 13.611
702 HD3 ARG 86 1HD ARG 86 24.573 -3.158 14.455
703 HE ARG 86 HE ARG 86 23.863 -5.522 15.974
704 HH11 ARG 86 1HH1 ARG 86 26.500 -3.282 15.266
705 HH12 ARG 86 2HH1 ARG 86 27.352 -3.642 16.733
706 HH21 ARG 86 1HH2 ARG 86 24.974 -5.944 17.901
707 HH22 ARG 86 2HH2 ARG 86 26.483 -5.155 18.226
708 H GLU 87 H GLU 87 20.053 -7.320 15.648
709 HA GLU 87 HA GLU 87 18.766 -5.157 17.196
710 HB2 GLU 87 2HB GLU 87 17.723 -7.560 16.531
711 HB3 GLU 87 1HB GLU 87 18.556 -8.080 17.982
712 HG2 GLU 87 2HG GLU 87 16.514 -5.826 17.905
713 HG3 GLU 87 1HG GLU 87 16.107 -7.503 18.253
714 H ALA 88 H ALA 88 19.353 -4.810 19.385
715 HA ALA 88 HA ALA 88 20.724 -4.474 21.133
716 HB1 ALA 88 3HB ALA 88 21.974 -7.154 20.444
717 HB2 ALA 88 1HB ALA 88 20.606 -6.898 21.528
718 HB3 ALA 88 2HB ALA 88 22.199 -6.266 21.954
719 HA PRO 89 HA PRO 89 23.900 -2.573 18.376
720 HB2 PRO 89 2HB PRO 89 23.722 -0.257 20.237
721 HB3 PRO 89 1HB PRO 89 23.367 -0.327 18.499
722 HG2 PRO 89 2HG PRO 89 21.413 -0.017 20.333
723 HG3 PRO 89 1HG PRO 89 21.154 -0.921 18.823
724 HD2 PRO 89 2HD PRO 89 21.727 -2.000 21.588
725 HD3 PRO 89 1HD PRO 89 20.519 -2.540 20.395
Start of MODEL 17
1 H1 HIS 1 1H HIS 1 -13.771 -18.501 8.185
2 H2 HIS 1 2H HIS 1 -15.061 -17.701 7.453
3 H3 HIS 1 3H HIS 1 -13.857 -16.814 8.242
4 HA HIS 1 HA HIS 1 -13.456 -18.492 5.842
5 HB2 HIS 1 2HB HIS 1 -13.637 -15.452 6.101
6 HB3 HIS 1 1HB HIS 1 -13.120 -16.289 4.640
7 HD1 HIS 1 HD1 HIS 1 -15.010 -17.663 3.336
8 HD2 HIS 1 HD2 HIS 1 -16.416 -15.323 6.478
9 HE1 HIS 1 HE1 HIS 1 -17.496 -17.519 3.023
10 HE2 HIS 1 HE2 HIS 1 -18.306 -16.016 4.861
11 H HIS 2 H HIS 2 -11.420 -19.215 5.759
12 HA HIS 2 HA HIS 2 -9.174 -17.611 6.824
13 HB2 HIS 2 2HB HIS 2 -9.684 -20.563 7.447
14 HB3 HIS 2 1HB HIS 2 -8.173 -19.722 7.786
15 HD1 HIS 2 HD1 HIS 2 -8.381 -17.711 9.613
16 HD2 HIS 2 HD2 HIS 2 -11.558 -20.396 9.479
17 HE1 HIS 2 HE1 HIS 2 -9.648 -17.372 11.752
18 HE2 HIS 2 HE2 HIS 2 -11.597 -18.943 11.617
19 H HIS 3 H HIS 3 -7.806 -17.323 5.158
20 HA HIS 3 HA HIS 3 -7.049 -19.507 3.396
21 HB2 HIS 3 2HB HIS 3 -7.513 -18.113 1.307
22 HB3 HIS 3 1HB HIS 3 -8.945 -18.750 2.116
23 HD1 HIS 3 HD1 HIS 3 -10.318 -16.970 3.573
24 HD2 HIS 3 HD2 HIS 3 -7.516 -15.361 0.947
25 HE1 HIS 3 HE1 HIS 3 -10.861 -14.518 3.420
26 HE2 HIS 3 HE2 HIS 3 -9.272 -13.621 1.699
27 H HIS 4 H HIS 4 -5.103 -19.218 4.511
28 HA HIS 4 HA HIS 4 -3.603 -16.701 4.301
29 HB2 HIS 4 2HB HIS 4 -2.887 -19.367 5.604
30 HB3 HIS 4 1HB HIS 4 -1.907 -17.907 5.701
31 HD1 HIS 4 HD1 HIS 4 -2.362 -16.439 7.678
32 HD2 HIS 4 HD2 HIS 4 -5.521 -19.014 6.924
33 HE1 HIS 4 HE1 HIS 4 -3.964 -16.114 9.579
34 HE2 HIS 4 HE2 HIS 4 -5.768 -17.815 9.193
35 H HIS 5 H HIS 5 -1.704 -16.452 3.087
36 HA HIS 5 HA HIS 5 -0.893 -18.611 1.230
37 HB2 HIS 5 2HB HIS 5 -1.721 -15.773 0.427
38 HB3 HIS 5 1HB HIS 5 -0.884 -16.891 -0.649
39 HD1 HIS 5 HD1 HIS 5 -4.221 -16.335 1.015
40 HD2 HIS 5 HD2 HIS 5 -2.522 -18.879 -1.800
41 HE1 HIS 5 HE1 HIS 5 -6.136 -17.631 0.046
42 HE2 HIS 5 HE2 HIS 5 -5.077 -19.248 -1.554
43 H HIS 6 H HIS 6 1.087 -17.757 -0.103
44 HA HIS 6 HA HIS 6 3.196 -16.959 1.678
45 HB2 HIS 6 2HB HIS 6 3.145 -17.275 -1.357
46 HB3 HIS 6 1HB HIS 6 4.600 -16.894 -0.444
47 HD1 HIS 6 HD1 HIS 6 5.985 -18.935 -0.411
48 HD2 HIS 6 HD2 HIS 6 1.977 -19.844 0.157
49 HE1 HIS 6 HE1 HIS 6 5.892 -21.421 -0.110
50 HE2 HIS 6 HE2 HIS 6 3.478 -21.924 0.315
51 H SER 7 H SER 7 2.745 -14.963 2.507
52 HA SER 7 HA SER 7 2.338 -12.669 0.674
53 HB2 SER 7 2HB SER 7 1.158 -13.166 3.444
54 HB3 SER 7 1HB SER 7 0.942 -11.685 2.506
55 HG SER 7 HG SER 7 0.246 -13.527 0.855
56 H HIS 8 H HIS 8 2.865 -10.529 1.857
57 HA HIS 8 HA HIS 8 5.569 -10.561 2.857
58 HB2 HIS 8 2HB HIS 8 3.547 -8.281 2.653
59 HB3 HIS 8 1HB HIS 8 5.226 -8.065 3.132
60 HD1 HIS 8 HD1 HIS 8 4.784 -6.380 0.911
61 HD2 HIS 8 HD2 HIS 8 5.331 -10.446 0.248
62 HE1 HIS 8 HE1 HIS 8 5.407 -6.594 -1.518
63 HE2 HIS 8 HE2 HIS 8 5.722 -9.062 -1.887
64 H MET 9 H MET 9 6.205 -9.661 4.924
65 HA MET 9 HA MET 9 5.001 -10.697 7.213
66 HB2 MET 9 2HB MET 9 6.530 -9.147 8.480
67 HB3 MET 9 1HB MET 9 7.366 -10.040 7.220
68 HG2 MET 9 2HG MET 9 7.337 -8.051 5.767
69 HG3 MET 9 1HG MET 9 6.464 -7.156 7.013
70 HE1 MET 9 3HE MET 9 9.196 -6.140 5.639
71 HE2 MET 9 1HE MET 9 10.066 -5.538 7.050
72 HE3 MET 9 2HE MET 9 8.343 -5.214 6.878
73 H VAL 10 H VAL 10 3.410 -9.952 8.581
74 HA VAL 10 HA VAL 10 1.565 -8.020 7.667
75 HB VAL 10 HB VAL 10 0.341 -8.342 9.790
76 HG11 VAL 10 1HG1 VAL 10 0.018 -9.975 8.003
77 HG12 VAL 10 2HG1 VAL 10 -0.113 -10.754 9.579
78 HG13 VAL 10 3HG1 VAL 10 1.354 -10.954 8.618
79 HG21 VAL 10 3HG2 VAL 10 2.684 -10.054 10.717
80 HG22 VAL 10 1HG2 VAL 10 1.144 -9.862 11.562
81 HG23 VAL 10 2HG2 VAL 10 2.229 -8.484 11.382
82 H GLY 11 H GLY 11 1.336 -5.898 8.062
83 HA2 GLY 11 2HA GLY 11 1.669 -3.835 9.121
84 HA3 GLY 11 1HA GLY 11 2.930 -4.537 10.124
85 H ASP 12 H ASP 12 3.225 -5.295 6.773
86 HA ASP 12 HA ASP 12 5.777 -4.285 6.419
87 HB2 ASP 12 2HB ASP 12 4.614 -5.976 4.963
88 HB3 ASP 12 1HB ASP 12 3.695 -4.673 4.228
89 H THR 13 H THR 13 6.512 -2.236 6.398
90 HA THR 13 HA THR 13 4.732 0.022 6.371
91 HB THR 13 HB THR 13 7.772 -0.128 6.521
92 HG1 THR 13 HG1 THR 13 5.665 -0.293 8.344
93 HG21 THR 13 3HG2 THR 13 7.678 2.195 7.394
94 HG22 THR 13 1HG2 THR 13 5.939 2.241 7.079
95 HG23 THR 13 2HG2 THR 13 7.077 2.121 5.738
96 H VAL 14 H VAL 14 4.029 0.968 4.597
97 HA VAL 14 HA VAL 14 5.668 1.301 2.179
98 HB VAL 14 HB VAL 14 3.789 0.623 0.711
99 HG11 VAL 14 1HG1 VAL 14 5.486 -1.070 1.196
100 HG12 VAL 14 2HG1 VAL 14 3.904 -1.820 0.983
101 HG13 VAL 14 3HG1 VAL 14 4.574 -1.617 2.604
102 HG21 VAL 14 3HG2 VAL 14 1.897 1.083 2.214
103 HG22 VAL 14 1HG2 VAL 14 2.361 -0.269 3.251
104 HG23 VAL 14 2HG2 VAL 14 1.802 -0.568 1.602
105 H TRP 15 H TRP 15 4.629 2.876 0.667
106 HA TRP 15 HA TRP 15 2.786 4.826 1.938
107 HB2 TRP 15 2HB TRP 15 4.813 5.182 -0.325
108 HB3 TRP 15 1HB TRP 15 3.624 6.403 0.126
109 HD1 TRP 15 HD1 TRP 15 4.293 5.610 3.412
110 HE1 TRP 15 HE1 TRP 15 6.308 6.831 4.420
111 HE3 TRP 15 HE3 TRP 15 6.647 7.037 -0.908
112 HZ2 TRP 15 HZ2 TRP 15 8.583 8.234 3.531
113 HZ3 TRP 15 HZ3 TRP 15 8.733 8.333 -0.737
114 HH2 TRP 15 HH2 TRP 15 9.682 8.920 1.437
115 H VAL 16 H VAL 16 0.801 5.020 1.022
116 HA VAL 16 HA VAL 16 0.303 3.635 -1.550
117 HB VAL 16 HB VAL 16 -1.665 4.048 0.753
118 HG11 VAL 16 1HG1 VAL 16 -3.336 2.869 -0.647
119 HG12 VAL 16 2HG1 VAL 16 -2.198 2.870 -1.997
120 HG13 VAL 16 3HG1 VAL 16 -2.836 4.394 -1.384
121 HG21 VAL 16 3HG2 VAL 16 -0.100 2.166 1.075
122 HG22 VAL 16 1HG2 VAL 16 -0.549 1.509 -0.498
123 HG23 VAL 16 2HG2 VAL 16 -1.738 1.571 0.804
124 H ARG 17 H ARG 17 0.167 4.967 -3.117
125 HA ARG 17 HA ARG 17 -0.648 7.742 -2.932
126 HB2 ARG 17 2HB ARG 17 1.336 7.062 -4.237
127 HB3 ARG 17 1HB ARG 17 0.345 6.006 -5.243
128 HG2 ARG 17 2HG ARG 17 -0.826 7.928 -6.181
129 HG3 ARG 17 1HG ARG 17 0.033 9.023 -5.098
130 HD2 ARG 17 2HD ARG 17 1.336 7.315 -7.241
131 HD3 ARG 17 1HD ARG 17 0.958 9.031 -7.398
132 HE ARG 17 HE ARG 17 2.492 9.355 -5.439
133 HH11 ARG 17 1HH1 ARG 17 3.010 6.658 -7.656
134 HH12 ARG 17 2HH1 ARG 17 4.714 6.580 -7.337
135 HH21 ARG 17 1HH2 ARG 17 4.695 9.252 -5.066
136 HH22 ARG 17 2HH2 ARG 17 5.663 8.057 -5.863
137 H ARG 18 H ARG 18 -2.713 8.329 -3.231
138 HA ARG 18 HA ARG 18 -4.488 6.770 -5.029
139 HB2 ARG 18 2HB ARG 18 -5.087 6.707 -2.559
140 HB3 ARG 18 1HB ARG 18 -5.332 8.449 -2.618
141 HG2 ARG 18 2HG ARG 18 -7.207 8.195 -4.140
142 HG3 ARG 18 1HG ARG 18 -6.874 6.471 -4.335
143 HD2 ARG 18 2HD ARG 18 -7.815 7.853 -1.794
144 HD3 ARG 18 1HD ARG 18 -8.764 6.770 -2.816
145 HE ARG 18 HE ARG 18 -6.688 5.206 -2.143
146 HH11 ARG 18 1HH1 ARG 18 -8.778 7.170 -0.085
147 HH12 ARG 18 2HH1 ARG 18 -8.595 6.123 1.287
148 HH21 ARG 18 1HH2 ARG 18 -6.436 3.867 -0.354
149 HH22 ARG 18 2HH2 ARG 18 -7.259 4.234 1.139
150 H HIS 19 H HIS 19 -5.926 8.117 -6.362
151 HA HIS 19 HA HIS 19 -4.408 10.120 -7.615
152 HB2 HIS 19 2HB HIS 19 -6.072 8.614 -8.787
153 HB3 HIS 19 1HB HIS 19 -7.363 9.605 -8.118
154 HD1 HIS 19 HD1 HIS 19 -8.226 10.771 -10.188
155 HD2 HIS 19 HD2 HIS 19 -4.086 10.941 -9.918
156 HE1 HIS 19 HE1 HIS 19 -7.488 12.248 -12.071
157 HE2 HIS 19 HE2 HIS 19 -5.014 12.510 -11.744
158 H GLN 20 H GLN 20 -7.519 10.398 -5.889
159 HA GLN 20 HA GLN 20 -8.477 12.028 -4.648
160 HB2 GLN 20 2HB GLN 20 -5.585 12.932 -4.300
161 HB3 GLN 20 1HB GLN 20 -6.925 13.615 -3.397
162 HG2 GLN 20 2HG GLN 20 -6.017 10.730 -3.289
163 HG3 GLN 20 1HG GLN 20 -5.687 11.963 -2.075
164 HE21 GLN 20 1HE2 GLN 20 -8.484 13.085 -2.262
165 HE22 GLN 20 2HE2 GLN 20 -9.470 11.934 -1.437
166 H THR 21 H THR 21 -7.858 12.581 -7.623
167 HA THR 21 HA THR 21 -8.526 15.433 -7.752
168 HB THR 21 HB THR 21 -6.647 15.807 -9.481
169 HG1 THR 21 HG1 THR 21 -5.086 13.820 -8.374
170 HG21 THR 21 3HG2 THR 21 -5.688 15.235 -6.646
171 HG22 THR 21 1HG2 THR 21 -6.402 16.753 -7.201
172 HG23 THR 21 2HG2 THR 21 -4.848 16.221 -7.844
173 H LYS 22 H LYS 22 -8.625 16.038 -10.234
174 HA LYS 22 HA LYS 22 -9.988 13.894 -11.749
175 HB2 LYS 22 2HB LYS 22 -10.100 16.926 -12.130
176 HB3 LYS 22 1HB LYS 22 -11.009 15.738 -13.062
177 HG2 LYS 22 2HG LYS 22 -12.228 15.060 -11.025
178 HG3 LYS 22 1HG LYS 22 -11.330 16.259 -10.090
179 HD2 LYS 22 2HD LYS 22 -12.322 18.078 -11.434
180 HD3 LYS 22 1HD LYS 22 -13.176 16.897 -12.432
181 HE2 LYS 22 2HE LYS 22 -13.624 17.407 -9.468
182 HE3 LYS 22 1HE LYS 22 -14.694 17.878 -10.786
183 HZ1 LYS 22 3HZ LYS 22 -15.043 15.540 -11.297
184 HZ2 LYS 22 1HZ LYS 22 -15.476 15.877 -9.695
185 HZ3 LYS 22 2HZ LYS 22 -14.021 15.087 -10.031
186 H ASN 23 H ASN 23 -7.728 16.661 -12.179
187 HA ASN 23 HA ASN 23 -6.473 15.354 -14.527
188 HB2 ASN 23 2HB ASN 23 -7.400 18.261 -14.392
189 HB3 ASN 23 1HB ASN 23 -6.421 17.587 -15.687
190 HD21 ASN 23 1HD2 ASN 23 -7.858 15.075 -15.917
191 HD22 ASN 23 2HD2 ASN 23 -9.393 15.455 -16.608
192 H LEU 24 H LEU 24 -5.804 16.118 -11.541
193 HA LEU 24 HA LEU 24 -3.099 17.193 -12.134
194 HB2 LEU 24 2HB LEU 24 -4.650 17.254 -9.516
195 HB3 LEU 24 1HB LEU 24 -2.987 17.781 -9.693
196 HG LEU 24 HG LEU 24 -5.426 19.085 -10.970
197 HD11 LEU 24 1HD1 LEU 24 -4.930 20.992 -9.503
198 HD12 LEU 24 2HD1 LEU 24 -3.603 20.093 -8.764
199 HD13 LEU 24 3HD1 LEU 24 -5.264 19.532 -8.575
200 HD21 LEU 24 3HD2 LEU 24 -3.891 20.836 -11.786
201 HD22 LEU 24 1HD2 LEU 24 -3.522 19.262 -12.489
202 HD23 LEU 24 2HD2 LEU 24 -2.513 19.904 -11.194
203 H GLU 25 H GLU 25 -1.586 16.381 -10.167
204 HA GLU 25 HA GLU 25 -1.083 13.651 -10.848
205 HB2 GLU 25 2HB GLU 25 0.292 15.519 -8.875
206 HB3 GLU 25 1HB GLU 25 0.912 13.934 -9.336
207 HG2 GLU 25 2HG GLU 25 1.105 14.683 -11.685
208 HG3 GLU 25 1HG GLU 25 0.475 16.264 -11.235
209 HA PRO 26 HA PRO 26 -3.028 11.607 -7.342
210 HB2 PRO 26 2HB PRO 26 -1.099 9.364 -7.591
211 HB3 PRO 26 1HB PRO 26 -2.825 9.395 -7.995
212 HG2 PRO 26 2HG PRO 26 -0.927 9.216 -9.900
213 HG3 PRO 26 1HG PRO 26 -2.455 10.082 -10.172
214 HD2 PRO 26 2HD PRO 26 0.245 11.225 -9.439
215 HD3 PRO 26 1HD PRO 26 -0.899 11.752 -10.701
216 H ARG 27 H ARG 27 -2.761 11.798 -5.161
217 HA ARG 27 HA ARG 27 -0.125 12.663 -4.148
218 HB2 ARG 27 2HB ARG 27 -2.051 14.155 -3.732
219 HB3 ARG 27 1HB ARG 27 -2.926 12.850 -2.936
220 HG2 ARG 27 2HG ARG 27 -1.278 12.813 -1.116
221 HG3 ARG 27 1HG ARG 27 -0.325 14.058 -1.922
222 HD2 ARG 27 2HD ARG 27 -3.153 14.401 -0.868
223 HD3 ARG 27 1HD ARG 27 -1.691 14.994 -0.082
224 HE ARG 27 HE ARG 27 -3.035 16.116 -2.410
225 HH11 ARG 27 1HH1 ARG 27 -0.096 16.208 -0.450
226 HH12 ARG 27 2HH1 ARG 27 0.366 17.782 -1.025
227 HH21 ARG 27 1HH2 ARG 27 -2.405 18.166 -3.135
228 HH22 ARG 27 2HH2 ARG 27 -0.937 18.888 -2.545
229 H TRP 28 H TRP 28 1.039 11.418 -2.718
230 HA TRP 28 HA TRP 28 -0.094 8.830 -1.848
231 HB2 TRP 28 2HB TRP 28 2.227 8.126 -1.353
232 HB3 TRP 28 1HB TRP 28 2.074 8.667 -3.020
233 HD1 TRP 28 HD1 TRP 28 3.506 10.783 -3.759
234 HE1 TRP 28 HE1 TRP 28 5.409 12.095 -2.639
235 HE3 TRP 28 HE3 TRP 28 3.133 8.919 1.000
236 HZ2 TRP 28 HZ2 TRP 28 6.606 12.312 -0.107
237 HZ3 TRP 28 HZ3 TRP 28 4.701 9.729 2.716
238 HH2 TRP 28 HH2 TRP 28 6.408 11.396 2.170
239 H LYS 29 H LYS 29 0.073 8.112 0.313
240 HA LYS 29 HA LYS 29 1.098 9.983 2.362
241 HB2 LYS 29 2HB LYS 29 -1.523 8.443 2.648
242 HB3 LYS 29 1HB LYS 29 -0.737 9.336 3.940
243 HG2 LYS 29 2HG LYS 29 -1.086 11.443 2.654
244 HG3 LYS 29 1HG LYS 29 -1.951 10.519 1.427
245 HD2 LYS 29 2HD LYS 29 -2.774 10.999 4.315
246 HD3 LYS 29 1HD LYS 29 -3.611 11.522 2.854
247 HE2 LYS 29 2HE LYS 29 -3.379 8.693 3.933
248 HE3 LYS 29 1HE LYS 29 -4.840 9.661 3.763
249 HZ1 LYS 29 3HZ LYS 29 -4.598 9.559 1.371
250 HZ2 LYS 29 1HZ LYS 29 -4.666 8.004 2.026
251 HZ3 LYS 29 2HZ LYS 29 -3.187 8.641 1.515
252 H GLY 30 H GLY 30 1.337 8.778 4.491
253 HA2 GLY 30 2HA GLY 30 1.410 5.987 4.703
254 HA3 GLY 30 1HA GLY 30 3.001 6.530 4.223
255 HA PRO 31 HA PRO 31 3.690 4.905 5.534
256 HB2 PRO 31 2HB PRO 31 4.718 3.566 7.640
257 HB3 PRO 31 1HB PRO 31 5.474 5.060 7.049
258 HG2 PRO 31 2HG PRO 31 3.784 4.639 9.466
259 HG3 PRO 31 1HG PRO 31 5.163 5.732 9.226
260 HD2 PRO 31 2HD PRO 31 2.411 6.437 9.063
261 HD3 PRO 31 1HD PRO 31 3.789 7.440 8.560
262 H TYR 32 H TYR 32 1.888 3.877 4.774
263 HA TYR 32 HA TYR 32 -0.122 2.529 6.287
264 HB2 TYR 32 2HB TYR 32 0.824 2.267 3.411
265 HB3 TYR 32 1HB TYR 32 -0.453 1.253 4.049
266 HD1 TYR 32 HD2 TYR 32 0.435 4.841 3.382
267 HD2 TYR 32 HD1 TYR 32 -2.694 2.016 4.084
268 HE1 TYR 32 HE2 TYR 32 -1.240 6.526 2.760
269 HE2 TYR 32 HE1 TYR 32 -4.363 3.702 3.462
270 HH TYR 32 HH TYR 32 -4.576 6.119 3.339
271 H THR 33 H THR 33 -0.435 0.123 6.227
272 HA THR 33 HA THR 33 2.094 -1.397 6.538
273 HB THR 33 HB THR 33 0.950 -2.430 8.644
274 HG1 THR 33 HG1 THR 33 -1.085 -1.177 8.048
275 HG21 THR 33 3HG2 THR 33 2.918 -0.940 8.831
276 HG22 THR 33 1HG2 THR 33 1.786 -0.669 10.155
277 HG23 THR 33 2HG2 THR 33 1.858 0.472 8.812
278 H VAL 34 H VAL 34 1.949 -3.038 5.081
279 HA VAL 34 HA VAL 34 -0.598 -4.077 4.159
280 HB VAL 34 HB VAL 34 2.177 -5.100 3.401
281 HG11 VAL 34 1HG1 VAL 34 -0.474 -5.320 1.942
282 HG12 VAL 34 2HG1 VAL 34 0.370 -6.626 2.776
283 HG13 VAL 34 3HG1 VAL 34 1.081 -5.890 1.338
284 HG21 VAL 34 3HG2 VAL 34 2.103 -3.620 1.434
285 HG22 VAL 34 1HG2 VAL 34 2.097 -2.698 2.939
286 HG23 VAL 34 2HG2 VAL 34 0.605 -2.902 2.026
287 H LEU 35 H LEU 35 -1.560 -5.922 4.809
288 HA LEU 35 HA LEU 35 -0.261 -7.541 6.936
289 HB2 LEU 35 2HB LEU 35 -3.213 -7.277 6.224
290 HB3 LEU 35 1HB LEU 35 -2.562 -8.205 7.567
291 HG LEU 35 HG LEU 35 -2.451 -5.179 7.283
292 HD11 LEU 35 1HD1 LEU 35 -4.022 -5.138 9.174
293 HD12 LEU 35 2HD1 LEU 35 -4.097 -6.902 9.162
294 HD13 LEU 35 3HD1 LEU 35 -4.707 -5.981 7.786
295 HD21 LEU 35 3HD2 LEU 35 -1.565 -5.167 9.596
296 HD22 LEU 35 1HD2 LEU 35 -0.466 -5.949 8.460
297 HD23 LEU 35 2HD2 LEU 35 -1.448 -6.929 9.551
298 H LEU 36 H LEU 36 -1.730 -7.686 3.756
299 HA LEU 36 HA LEU 36 -1.104 -10.568 3.483
300 HB2 LEU 36 2HB LEU 36 -3.480 -10.327 4.312
301 HB3 LEU 36 1HB LEU 36 -3.850 -9.350 2.906
302 HG LEU 36 HG LEU 36 -3.331 -11.370 1.460
303 HD11 LEU 36 1HD1 LEU 36 -3.300 -13.594 2.503
304 HD12 LEU 36 2HD1 LEU 36 -3.272 -12.853 4.105
305 HD13 LEU 36 3HD1 LEU 36 -1.912 -12.627 3.002
306 HD21 LEU 36 3HD2 LEU 36 -5.584 -11.712 3.470
307 HD22 LEU 36 1HD2 LEU 36 -5.484 -12.476 1.880
308 HD23 LEU 36 2HD2 LEU 36 -5.646 -10.725 2.008
309 H THR 37 H THR 37 -0.581 -11.125 1.299
310 HA THR 37 HA THR 37 -0.995 -9.073 -0.784
311 HB THR 37 HB THR 37 1.297 -9.437 -1.722
312 HG1 THR 37 HG1 THR 37 1.879 -11.379 -0.817
313 HG21 THR 37 3HG2 THR 37 2.548 -8.054 -0.153
314 HG22 THR 37 1HG2 THR 37 1.390 -8.427 1.129
315 HG23 THR 37 2HG2 THR 37 0.885 -7.476 -0.269
316 H THR 38 H THR 38 -1.733 -9.849 -2.566
317 HA THR 38 HA THR 38 -1.399 -12.666 -3.410
318 HB THR 38 HB THR 38 -3.535 -12.245 -4.731
319 HG1 THR 38 HG1 THR 38 -3.131 -9.787 -4.316
320 HG21 THR 38 3HG2 THR 38 -3.693 -13.412 -2.554
321 HG22 THR 38 1HG2 THR 38 -5.108 -12.395 -2.828
322 HG23 THR 38 2HG2 THR 38 -3.842 -11.863 -1.720
323 HA PRO 39 HA PRO 39 0.806 -11.396 -7.186
324 HB2 PRO 39 2HB PRO 39 -1.007 -12.214 -9.247
325 HB3 PRO 39 1HB PRO 39 0.285 -13.185 -8.533
326 HG2 PRO 39 2HG PRO 39 -2.620 -13.143 -7.840
327 HG3 PRO 39 1HG PRO 39 -1.500 -14.525 -7.924
328 HD2 PRO 39 2HD PRO 39 -2.196 -13.560 -5.550
329 HD3 PRO 39 1HD PRO 39 -0.498 -13.998 -5.849
330 H THR 40 H THR 40 0.957 -9.262 -7.341
331 HA THR 40 HA THR 40 0.787 -7.146 -8.062
332 HB THR 40 HB THR 40 -1.418 -7.911 -10.012
333 HG1 THR 40 HG1 THR 40 0.952 -9.110 -9.801
334 HG21 THR 40 3HG2 THR 40 -0.748 -5.515 -9.989
335 HG22 THR 40 1HG2 THR 40 -0.271 -6.288 -11.503
336 HG23 THR 40 2HG2 THR 40 0.932 -5.981 -10.251
337 H ALA 41 H ALA 41 -1.290 -8.349 -6.039
338 HA ALA 41 HA ALA 41 -2.794 -5.803 -5.709
339 HB1 ALA 41 3HB ALA 41 -4.365 -7.430 -6.721
340 HB2 ALA 41 1HB ALA 41 -4.821 -7.068 -5.057
341 HB3 ALA 41 2HB ALA 41 -4.017 -8.590 -5.438
342 H LEU 42 H LEU 42 -2.299 -5.016 -3.736
343 HA LEU 42 HA LEU 42 -1.209 -6.844 -1.672
344 HB2 LEU 42 2HB LEU 42 -0.675 -3.846 -1.940
345 HB3 LEU 42 1HB LEU 42 0.165 -4.988 -0.907
346 HG LEU 42 HG LEU 42 0.366 -4.772 -3.935
347 HD11 LEU 42 1HD1 LEU 42 1.656 -3.084 -2.761
348 HD12 LEU 42 2HD1 LEU 42 2.733 -4.242 -3.531
349 HD13 LEU 42 3HD1 LEU 42 2.457 -4.321 -1.789
350 HD21 LEU 42 3HD2 LEU 42 0.433 -7.149 -3.365
351 HD22 LEU 42 1HD2 LEU 42 1.718 -6.851 -2.191
352 HD23 LEU 42 2HD2 LEU 42 2.011 -6.587 -3.910
353 H LYS 43 H LYS 43 -2.613 -7.135 -0.025
354 HA LYS 43 HA LYS 43 -4.752 -5.226 0.523
355 HB2 LYS 43 2HB LYS 43 -5.307 -7.614 0.635
356 HB3 LYS 43 1HB LYS 43 -4.065 -7.885 1.856
357 HG2 LYS 43 2HG LYS 43 -5.269 -6.578 3.489
358 HG3 LYS 43 1HG LYS 43 -6.427 -6.022 2.279
359 HD2 LYS 43 2HD LYS 43 -7.148 -8.451 2.007
360 HD3 LYS 43 1HD LYS 43 -6.131 -8.832 3.401
361 HE2 LYS 43 2HE LYS 43 -7.444 -7.297 4.794
362 HE3 LYS 43 1HE LYS 43 -8.440 -6.869 3.400
363 HZ1 LYS 43 3HZ LYS 43 -9.135 -9.208 3.279
364 HZ2 LYS 43 1HZ LYS 43 -9.574 -8.477 4.737
365 HZ3 LYS 43 2HZ LYS 43 -8.264 -9.536 4.695
366 H VAL 44 H VAL 44 -4.098 -3.490 1.505
367 HA VAL 44 HA VAL 44 -2.159 -3.465 3.686
368 HB VAL 44 HB VAL 44 -3.697 -1.134 2.452
369 HG11 VAL 44 1HG1 VAL 44 -1.942 0.295 3.401
370 HG12 VAL 44 2HG1 VAL 44 -1.168 -1.118 4.118
371 HG13 VAL 44 3HG1 VAL 44 -2.772 -0.625 4.661
372 HG21 VAL 44 3HG2 VAL 44 -1.716 -0.642 1.079
373 HG22 VAL 44 1HG2 VAL 44 -2.374 -2.233 0.690
374 HG23 VAL 44 2HG2 VAL 44 -0.922 -2.096 1.683
375 H ASP 45 H ASP 45 -2.733 -2.598 5.763
376 HA ASP 45 HA ASP 45 -5.167 -3.337 6.910
377 HB2 ASP 45 2HB ASP 45 -3.177 -3.141 8.266
378 HB3 ASP 45 1HB ASP 45 -2.980 -1.443 7.845
379 H GLY 46 H GLY 46 -7.103 -2.425 6.803
380 HA2 GLY 46 2HA GLY 46 -8.668 -0.715 7.159
381 HA3 GLY 46 1HA GLY 46 -7.440 0.492 6.820
382 H ILE 47 H ILE 47 -7.232 -1.834 4.434
383 HA ILE 47 HA ILE 47 -8.688 -0.193 2.499
384 HB ILE 47 HB ILE 47 -6.749 -2.530 2.225
385 HG12 ILE 47 2HG1 ILE 47 -5.677 -0.423 2.803
386 HG13 ILE 47 1HG1 ILE 47 -5.287 -0.813 1.134
387 HG21 ILE 47 1HG2 ILE 47 -6.786 -2.260 -0.229
388 HG22 ILE 47 2HG2 ILE 47 -8.129 -1.126 -0.088
389 HG23 ILE 47 3HG2 ILE 47 -8.344 -2.809 0.395
390 HD11 ILE 47 3HD1 ILE 47 -5.701 1.547 1.386
391 HD12 ILE 47 1HD1 ILE 47 -7.294 1.238 2.078
392 HD13 ILE 47 2HD1 ILE 47 -6.969 0.836 0.389
393 H ALA 48 H ALA 48 -10.271 -1.030 1.072
394 HA ALA 48 HA ALA 48 -12.386 -2.420 2.172
395 HB1 ALA 48 3HB ALA 48 -13.349 -2.444 -0.101
396 HB2 ALA 48 1HB ALA 48 -11.764 -2.054 -0.782
397 HB3 ALA 48 2HB ALA 48 -12.591 -0.895 0.255
398 H ALA 49 H ALA 49 -10.118 -3.680 -0.315
399 HA ALA 49 HA ALA 49 -10.043 -6.255 1.038
400 HB1 ALA 49 3HB ALA 49 -10.599 -7.591 -0.942
401 HB2 ALA 49 1HB ALA 49 -10.924 -6.118 -1.862
402 HB3 ALA 49 2HB ALA 49 -11.946 -6.546 -0.491
403 H TRP 50 H TRP 50 -9.031 -4.711 -2.065
404 HA TRP 50 HA TRP 50 -6.204 -5.150 -1.368
405 HB2 TRP 50 2HB TRP 50 -7.479 -6.225 -3.922
406 HB3 TRP 50 1HB TRP 50 -5.740 -6.016 -3.738
407 HD1 TRP 50 HD1 TRP 50 -4.536 -7.640 -1.847
408 HE1 TRP 50 HE1 TRP 50 -5.148 -10.007 -1.071
409 HE3 TRP 50 HE3 TRP 50 -9.364 -7.835 -3.536
410 HZ2 TRP 50 HZ2 TRP 50 -7.364 -11.740 -1.159
411 HZ3 TRP 50 HZ3 TRP 50 -10.660 -9.889 -3.162
412 HH2 TRP 50 HH2 TRP 50 -9.681 -11.801 -1.998
413 H ILE 51 H ILE 51 -4.722 -3.828 -2.532
414 HA ILE 51 HA ILE 51 -5.838 -1.709 -4.300
415 HB ILE 51 HB ILE 51 -3.393 -1.578 -2.456
416 HG12 ILE 51 2HG1 ILE 51 -5.483 -1.230 -1.230
417 HG13 ILE 51 1HG1 ILE 51 -4.617 0.295 -1.335
418 HG21 ILE 51 1HG2 ILE 51 -3.056 0.751 -3.226
419 HG22 ILE 51 2HG2 ILE 51 -4.327 0.536 -4.431
420 HG23 ILE 51 3HG2 ILE 51 -2.844 -0.414 -4.534
421 HD11 ILE 51 3HD1 ILE 51 -6.991 0.623 -1.658
422 HD12 ILE 51 1HD1 ILE 51 -7.002 -0.521 -3.000
423 HD13 ILE 51 2HD1 ILE 51 -6.129 1.006 -3.147
424 H HIS 52 H HIS 52 -4.962 -1.600 -6.361
425 HA HIS 52 HA HIS 52 -3.314 -3.687 -7.364
426 HB2 HIS 52 2HB HIS 52 -4.935 -2.293 -8.752
427 HB3 HIS 52 1HB HIS 52 -3.792 -0.954 -8.654
428 HD1 HIS 52 HD1 HIS 52 -1.523 -1.272 -9.990
429 HD2 HIS 52 HD2 HIS 52 -4.368 -4.213 -10.667
430 HE1 HIS 52 HE1 HIS 52 -0.708 -2.554 -11.978
431 HE2 HIS 52 HE2 HIS 52 -2.554 -4.166 -12.490
432 H ALA 53 H ALA 53 -1.126 -3.812 -7.559
433 HA ALA 53 HA ALA 53 0.337 -2.734 -5.479
434 HB1 ALA 53 3HB ALA 53 2.254 -3.989 -6.341
435 HB2 ALA 53 1HB ALA 53 1.474 -4.146 -7.919
436 HB3 ALA 53 2HB ALA 53 0.780 -4.940 -6.506
437 H ALA 54 H ALA 54 0.068 -1.404 -8.679
438 HA ALA 54 HA ALA 54 2.431 0.097 -8.885
439 HB1 ALA 54 3HB ALA 54 0.888 -0.244 -10.757
440 HB2 ALA 54 1HB ALA 54 1.227 1.472 -10.528
441 HB3 ALA 54 2HB ALA 54 -0.310 0.789 -9.981
442 H HIS 55 H HIS 55 -0.617 0.839 -7.254
443 HA HIS 55 HA HIS 55 0.077 3.564 -6.535
444 HB2 HIS 55 2HB HIS 55 -2.215 1.731 -5.714
445 HB3 HIS 55 1HB HIS 55 -2.028 3.359 -5.071
446 HD1 HIS 55 HD1 HIS 55 -2.175 5.334 -6.856
447 HD2 HIS 55 HD2 HIS 55 -3.495 1.616 -8.153
448 HE1 HIS 55 HE1 HIS 55 -3.492 5.781 -8.938
449 HE2 HIS 55 HE2 HIS 55 -4.430 3.547 -9.598
450 H VAL 56 H VAL 56 1.352 0.758 -5.391
451 HA VAL 56 HA VAL 56 1.703 1.832 -2.642
452 HB VAL 56 HB VAL 56 1.771 -1.110 -3.496
453 HG11 VAL 56 1HG1 VAL 56 1.964 0.109 -0.723
454 HG12 VAL 56 2HG1 VAL 56 3.278 -0.664 -1.616
455 HG13 VAL 56 3HG1 VAL 56 1.890 -1.615 -1.092
456 HG21 VAL 56 3HG2 VAL 56 -0.372 0.328 -1.890
457 HG22 VAL 56 1HG2 VAL 56 -0.329 -1.400 -2.246
458 HG23 VAL 56 2HG2 VAL 56 -0.537 -0.232 -3.554
459 H LYS 57 H LYS 57 3.807 2.165 -1.997
460 HA LYS 57 HA LYS 57 6.051 1.008 -3.566
461 HB2 LYS 57 2HB LYS 57 5.923 3.794 -2.313
462 HB3 LYS 57 1HB LYS 57 7.363 3.075 -3.016
463 HG2 LYS 57 2HG LYS 57 6.100 2.984 -5.232
464 HG3 LYS 57 1HG LYS 57 4.851 3.960 -4.450
465 HD2 LYS 57 2HD LYS 57 6.383 5.418 -5.711
466 HD3 LYS 57 1HD LYS 57 6.535 5.733 -3.983
467 HE2 LYS 57 2HE LYS 57 8.563 4.273 -3.931
468 HE3 LYS 57 1HE LYS 57 8.419 4.059 -5.673
469 HZ1 LYS 57 3HZ LYS 57 10.049 5.777 -4.971
470 HZ2 LYS 57 1HZ LYS 57 8.770 6.709 -4.378
471 HZ3 LYS 57 2HZ LYS 57 8.864 6.348 -6.027
472 H ALA 58 H ALA 58 7.734 0.192 -2.298
473 HA ALA 58 HA ALA 58 7.335 -0.444 0.440
474 HB1 ALA 58 3HB ALA 58 9.897 -0.495 -1.208
475 HB2 ALA 58 1HB ALA 58 8.742 -1.817 -1.038
476 HB3 ALA 58 2HB ALA 58 9.671 -1.281 0.358
477 H ALA 59 H ALA 59 7.582 0.870 2.186
478 HA ALA 59 HA ALA 59 9.399 3.222 2.057
479 HB1 ALA 59 3HB ALA 59 8.021 4.181 3.866
480 HB2 ALA 59 1HB ALA 59 7.012 2.732 3.888
481 HB3 ALA 59 2HB ALA 59 7.027 3.777 2.468
482 H ASP 60 H ASP 60 10.586 3.719 3.977
483 HA ASP 60 HA ASP 60 11.725 1.364 5.307
484 HB2 ASP 60 2HB ASP 60 13.187 2.977 4.059
485 HB3 ASP 60 1HB ASP 60 12.736 4.253 5.185
486 HA PRO 61 HA PRO 61 9.540 2.841 9.089
487 HB2 PRO 61 2HB PRO 61 9.599 0.536 10.493
488 HB3 PRO 61 1HB PRO 61 8.553 0.707 9.068
489 HG2 PRO 61 2HG PRO 61 11.227 -0.633 9.275
490 HG3 PRO 61 1HG PRO 61 9.745 -1.203 8.473
491 HD2 PRO 61 2HD PRO 61 11.836 0.027 7.144
492 HD3 PRO 61 1HD PRO 61 10.153 0.037 6.565
493 H GLY 62 H GLY 62 12.798 1.923 8.624
494 HA2 GLY 62 2HA GLY 62 14.732 2.268 9.833
495 HA3 GLY 62 1HA GLY 62 13.779 2.995 11.125
496 H GLY 63 H GLY 63 12.392 1.394 12.343
497 HA2 GLY 63 2HA GLY 63 13.174 -1.416 12.307
498 HA3 GLY 63 1HA GLY 63 13.552 -0.524 13.786
499 H GLY 64 H GLY 64 11.991 -0.291 15.266
500 HA2 GLY 64 2HA GLY 64 9.968 -0.191 16.312
501 HA3 GLY 64 1HA GLY 64 9.254 0.201 14.762
502 HA PRO 65 HA PRO 65 8.469 -4.478 15.251
503 HB2 PRO 65 2HB PRO 65 10.058 -5.906 17.126
504 HB3 PRO 65 1HB PRO 65 10.319 -5.848 15.376
505 HG2 PRO 65 2HG PRO 65 12.024 -4.763 17.366
506 HG3 PRO 65 1HG PRO 65 12.162 -4.545 15.612
507 HD2 PRO 65 2HD PRO 65 11.008 -2.698 17.657
508 HD3 PRO 65 1HD PRO 65 11.793 -2.329 16.102
509 H SER 66 H SER 66 6.516 -4.107 16.219
510 HA SER 66 HA SER 66 6.240 -4.400 19.107
511 HB2 SER 66 2HB SER 66 4.890 -2.249 19.258
512 HB3 SER 66 1HB SER 66 6.616 -2.020 18.976
513 HG SER 66 HG SER 66 5.009 -0.781 17.643
514 H SER 67 H SER 67 3.918 -2.999 16.772
515 HA SER 67 HA SER 67 1.839 -4.808 17.549
516 HB2 SER 67 2HB SER 67 1.375 -2.492 16.835
517 HB3 SER 67 1HB SER 67 1.953 -2.842 15.214
518 HG SER 67 HG SER 67 0.195 -4.033 14.803
519 H ARG 68 H ARG 68 4.272 -4.818 15.085
520 HA ARG 68 HA ARG 68 3.107 -6.707 13.279
521 HB2 ARG 68 2HB ARG 68 5.947 -5.665 13.630
522 HB3 ARG 68 1HB ARG 68 5.489 -6.802 12.358
523 HG2 ARG 68 2HG ARG 68 3.830 -5.165 11.506
524 HG3 ARG 68 1HG ARG 68 4.353 -4.015 12.731
525 HD2 ARG 68 2HD ARG 68 6.379 -5.163 10.820
526 HD3 ARG 68 1HD ARG 68 5.309 -3.867 10.290
527 HE ARG 68 HE ARG 68 6.775 -3.390 12.770
528 HH11 ARG 68 1HH1 ARG 68 6.635 -2.889 9.284
529 HH12 ARG 68 2HH1 ARG 68 7.707 -1.524 9.310
530 HH21 ARG 68 1HH2 ARG 68 8.139 -1.577 12.799
531 HH22 ARG 68 2HH2 ARG 68 8.565 -0.782 11.321
532 H LEU 69 H LEU 69 4.885 -7.028 16.259
533 HA LEU 69 HA LEU 69 6.089 -9.560 15.899
534 HB2 LEU 69 2HB LEU 69 5.116 -8.235 18.455
535 HB3 LEU 69 1HB LEU 69 6.166 -9.639 18.407
536 HG LEU 69 HG LEU 69 6.890 -6.872 17.357
537 HD11 LEU 69 1HD1 LEU 69 7.849 -8.301 19.858
538 HD12 LEU 69 2HD1 LEU 69 6.758 -6.916 19.802
539 HD13 LEU 69 3HD1 LEU 69 8.425 -6.738 19.266
540 HD21 LEU 69 3HD2 LEU 69 8.028 -8.595 16.062
541 HD22 LEU 69 1HD2 LEU 69 8.593 -9.378 17.541
542 HD23 LEU 69 2HD2 LEU 69 9.178 -7.770 17.109
543 H THR 70 H THR 70 2.793 -8.737 16.379
544 HA THR 70 HA THR 70 1.644 -10.949 17.585
545 HB THR 70 HB THR 70 0.493 -9.232 15.328
546 HG1 THR 70 HG1 THR 70 0.491 -7.723 16.794
547 HG21 THR 70 3HG2 THR 70 -0.946 -10.869 17.445
548 HG22 THR 70 1HG2 THR 70 -0.898 -11.231 15.717
549 HG23 THR 70 2HG2 THR 70 -1.716 -9.778 16.294
550 H TRP 71 H TRP 71 2.149 -10.384 14.078
551 HA TRP 71 HA TRP 71 2.250 -11.700 12.248
552 HB2 TRP 71 2HB TRP 71 3.882 -13.270 14.262
553 HB3 TRP 71 1HB TRP 71 3.797 -13.759 12.572
554 HD1 TRP 71 HD1 TRP 71 4.150 -10.986 11.101
555 HE1 TRP 71 HE1 TRP 71 6.388 -9.732 11.213
556 HE3 TRP 71 HE3 TRP 71 6.102 -13.142 15.323
557 HZ2 TRP 71 HZ2 TRP 71 8.685 -9.668 12.839
558 HZ3 TRP 71 HZ3 TRP 71 8.337 -12.434 16.078
559 HH2 TRP 71 HH2 TRP 71 9.601 -10.731 14.860
560 H ARG 72 H ARG 72 -0.224 -12.230 13.761
561 HA ARG 72 HA ARG 72 -0.740 -14.991 14.002
562 HB2 ARG 72 2HB ARG 72 -3.137 -14.346 14.177
563 HB3 ARG 72 1HB ARG 72 -2.077 -13.413 15.223
564 HG2 ARG 72 2HG ARG 72 -2.139 -11.541 13.574
565 HG3 ARG 72 1HG ARG 72 -3.278 -12.469 12.605
566 HD2 ARG 72 2HD ARG 72 -4.955 -12.370 14.355
567 HD3 ARG 72 1HD ARG 72 -3.808 -11.642 15.483
568 HE ARG 72 HE ARG 72 -4.862 -10.313 13.057
569 HH11 ARG 72 1HH1 ARG 72 -3.633 -10.093 16.349
570 HH12 ARG 72 2HH1 ARG 72 -3.868 -8.377 16.440
571 HH21 ARG 72 1HH2 ARG 72 -5.137 -8.056 13.198
572 HH22 ARG 72 2HH2 ARG 72 -4.716 -7.233 14.666
573 H VAL 73 H VAL 73 -1.033 -12.910 11.169
574 HA VAL 73 HA VAL 73 -2.445 -14.862 9.544
575 HB VAL 73 HB VAL 73 -0.851 -12.446 8.577
576 HG11 VAL 73 1HG1 VAL 73 -2.336 -12.498 6.601
577 HG12 VAL 73 2HG1 VAL 73 -3.120 -13.950 7.232
578 HG13 VAL 73 3HG1 VAL 73 -1.420 -13.999 6.769
579 HG21 VAL 73 3HG2 VAL 73 -2.929 -11.141 8.646
580 HG22 VAL 73 1HG2 VAL 73 -2.497 -11.721 10.255
581 HG23 VAL 73 2HG2 VAL 73 -3.785 -12.516 9.348
582 H GLN 74 H GLN 74 0.862 -14.072 10.326
583 HA GLN 74 HA GLN 74 2.099 -15.718 8.277
584 HB2 GLN 74 2HB GLN 74 3.391 -14.516 10.768
585 HB3 GLN 74 1HB GLN 74 4.211 -15.065 9.317
586 HG2 GLN 74 2HG GLN 74 2.367 -12.671 9.486
587 HG3 GLN 74 1HG GLN 74 4.125 -12.603 9.490
588 HE21 GLN 74 1HE2 GLN 74 1.274 -12.980 7.530
589 HE22 GLN 74 2HE2 GLN 74 2.074 -12.920 6.002
590 H ARG 75 H ARG 75 0.632 -16.289 11.339
591 HA ARG 75 HA ARG 75 2.141 -18.677 12.043
592 HB2 ARG 75 2HB ARG 75 -0.508 -17.658 13.161
593 HB3 ARG 75 1HB ARG 75 0.429 -18.979 13.834
594 HG2 ARG 75 2HG ARG 75 1.271 -16.072 13.747
595 HG3 ARG 75 1HG ARG 75 0.639 -16.914 15.153
596 HD2 ARG 75 2HD ARG 75 2.981 -16.801 15.462
597 HD3 ARG 75 1HD ARG 75 2.660 -18.465 14.969
598 HE ARG 75 HE ARG 75 3.263 -17.047 12.664
599 HH11 ARG 75 1HH1 ARG 75 4.982 -17.823 15.654
600 HH12 ARG 75 2HH1 ARG 75 6.539 -17.802 14.880
601 HH21 ARG 75 1HH2 ARG 75 5.304 -17.142 11.689
602 HH22 ARG 75 2HH2 ARG 75 6.713 -17.421 12.659
603 H SER 76 H SER 76 1.758 -19.444 9.744
604 HA SER 76 HA SER 76 -0.256 -21.520 9.683
605 HB2 SER 76 2HB SER 76 -0.354 -19.273 7.602
606 HB3 SER 76 1HB SER 76 -1.222 -20.801 7.451
607 HG SER 76 HG SER 76 -2.047 -20.075 9.689
608 H GLN 77 H GLN 77 1.483 -19.816 7.051
609 HA GLN 77 HA GLN 77 2.939 -22.269 6.335
610 HB2 GLN 77 2HB GLN 77 1.617 -21.140 4.583
611 HB3 GLN 77 1HB GLN 77 2.496 -19.645 4.829
612 HG2 GLN 77 2HG GLN 77 4.056 -22.087 4.017
613 HG3 GLN 77 1HG GLN 77 3.057 -21.301 2.804
614 HE21 GLN 77 1HE2 GLN 77 6.009 -21.561 3.007
615 HE22 GLN 77 2HE2 GLN 77 6.614 -19.945 2.914
616 H ASN 78 H ASN 78 3.368 -19.153 7.742
617 HA ASN 78 HA ASN 78 5.036 -17.864 8.449
618 HB2 ASN 78 2HB ASN 78 5.648 -19.801 9.847
619 HB3 ASN 78 1HB ASN 78 6.659 -20.439 8.554
620 HD21 ASN 78 1HD2 ASN 78 8.666 -19.414 8.142
621 HD22 ASN 78 2HD2 ASN 78 9.374 -18.293 9.251
622 HA PRO 79 HA PRO 79 7.246 -17.118 4.463
623 HB2 PRO 79 2HB PRO 79 5.992 -14.446 4.529
624 HB3 PRO 79 1HB PRO 79 5.846 -15.710 3.295
625 HG2 PRO 79 2HG PRO 79 3.765 -14.977 4.892
626 HG3 PRO 79 1HG PRO 79 3.943 -16.621 4.231
627 HD2 PRO 79 2HD PRO 79 4.667 -15.601 6.985
628 HD3 PRO 79 1HD PRO 79 3.816 -17.100 6.521
629 H LEU 80 H LEU 80 7.321 -16.260 7.651
630 HA LEU 80 HA LEU 80 9.105 -14.020 7.658
631 HB2 LEU 80 2HB LEU 80 8.529 -16.014 9.875
632 HB3 LEU 80 1HB LEU 80 9.300 -14.450 10.074
633 HG LEU 80 HG LEU 80 6.412 -14.865 9.208
634 HD11 LEU 80 1HD1 LEU 80 5.803 -14.099 11.447
635 HD12 LEU 80 2HD1 LEU 80 7.505 -14.003 11.903
636 HD13 LEU 80 3HD1 LEU 80 6.775 -15.568 11.528
637 HD21 LEU 80 3HD2 LEU 80 7.887 -12.299 9.907
638 HD22 LEU 80 1HD2 LEU 80 6.160 -12.440 9.569
639 HD23 LEU 80 2HD2 LEU 80 7.333 -12.780 8.301
640 H LYS 81 H LYS 81 10.706 -14.750 6.193
641 HA LYS 81 HA LYS 81 12.429 -16.986 6.885
642 HB2 LYS 81 2HB LYS 81 12.683 -14.878 4.703
643 HB3 LYS 81 1HB LYS 81 13.668 -16.335 4.838
644 HG2 LYS 81 2HG LYS 81 11.680 -17.740 4.510
645 HG3 LYS 81 1HG LYS 81 10.657 -16.304 4.421
646 HD2 LYS 81 2HD LYS 81 11.892 -15.579 2.381
647 HD3 LYS 81 1HD LYS 81 12.867 -17.050 2.463
648 HE2 LYS 81 2HE LYS 81 10.795 -18.405 2.211
649 HE3 LYS 81 1HE LYS 81 9.860 -16.914 2.061
650 HZ1 LYS 81 3HZ LYS 81 10.352 -17.841 -0.099
651 HZ2 LYS 81 1HZ LYS 81 12.011 -17.815 0.219
652 HZ3 LYS 81 2HZ LYS 81 11.156 -16.364 0.074
653 H ILE 82 H ILE 82 14.173 -16.814 8.152
654 HA ILE 82 HA ILE 82 14.684 -14.556 9.717
655 HB ILE 82 HB ILE 82 16.738 -15.773 10.522
656 HG12 ILE 82 2HG1 ILE 82 15.917 -17.942 8.526
657 HG13 ILE 82 1HG1 ILE 82 17.345 -16.926 8.382
658 HG21 ILE 82 1HG2 ILE 82 14.552 -16.137 11.585
659 HG22 ILE 82 2HG2 ILE 82 15.519 -17.613 11.619
660 HG23 ILE 82 3HG2 ILE 82 14.207 -17.445 10.452
661 HD11 ILE 82 3HD1 ILE 82 17.950 -19.117 9.177
662 HD12 ILE 82 1HD1 ILE 82 16.829 -18.982 10.534
663 HD13 ILE 82 2HD1 ILE 82 18.241 -17.928 10.444
664 H ARG 83 H ARG 83 15.710 -12.785 9.283
665 HA ARG 83 HA ARG 83 17.874 -12.632 7.259
666 HB2 ARG 83 2HB ARG 83 15.853 -10.527 8.159
667 HB3 ARG 83 1HB ARG 83 17.237 -10.193 7.120
668 HG2 ARG 83 2HG ARG 83 16.329 -11.746 5.415
669 HG3 ARG 83 1HG ARG 83 14.916 -12.026 6.439
670 HD2 ARG 83 2HD ARG 83 14.546 -10.342 4.617
671 HD3 ARG 83 1HD ARG 83 14.236 -9.709 6.240
672 HE ARG 83 HE ARG 83 16.923 -9.204 5.471
673 HH11 ARG 83 1HH1 ARG 83 13.659 -8.020 4.813
674 HH12 ARG 83 2HH1 ARG 83 14.210 -6.432 4.386
675 HH21 ARG 83 1HH2 ARG 83 17.608 -7.122 4.988
676 HH22 ARG 83 2HH2 ARG 83 16.458 -5.923 4.486
677 H LEU 84 H LEU 84 19.793 -11.835 7.949
678 HA LEU 84 HA LEU 84 20.282 -11.401 10.745
679 HB2 LEU 84 2HB LEU 84 22.141 -10.918 8.372
680 HB3 LEU 84 1HB LEU 84 22.620 -10.981 10.059
681 HG LEU 84 HG LEU 84 21.539 -13.320 8.435
682 HD11 LEU 84 1HD1 LEU 84 23.831 -12.711 7.803
683 HD12 LEU 84 2HD1 LEU 84 23.787 -14.274 8.614
684 HD13 LEU 84 3HD1 LEU 84 24.347 -12.844 9.487
685 HD21 LEU 84 3HD2 LEU 84 20.810 -13.521 10.762
686 HD22 LEU 84 1HD2 LEU 84 22.470 -13.302 11.328
687 HD23 LEU 84 2HD2 LEU 84 22.032 -14.734 10.390
688 H THR 85 H THR 85 18.784 -9.783 11.108
689 HA THR 85 HA THR 85 19.172 -7.082 10.098
690 HB THR 85 HB THR 85 17.277 -8.204 12.230
691 HG1 THR 85 HG1 THR 85 16.217 -8.882 10.559
692 HG21 THR 85 3HG2 THR 85 17.175 -5.502 10.838
693 HG22 THR 85 1HG2 THR 85 17.590 -5.769 12.535
694 HG23 THR 85 2HG2 THR 85 15.968 -6.142 11.951
695 H ARG 86 H ARG 86 20.182 -5.444 11.292
696 HA ARG 86 HA ARG 86 22.083 -6.217 13.282
697 HB2 ARG 86 2HB ARG 86 21.244 -3.429 12.385
698 HB3 ARG 86 1HB ARG 86 22.607 -3.772 13.443
699 HG2 ARG 86 2HG ARG 86 23.642 -5.106 11.587
700 HG3 ARG 86 1HG ARG 86 22.314 -4.598 10.544
701 HD2 ARG 86 2HD ARG 86 22.965 -2.243 10.835
702 HD3 ARG 86 1HD ARG 86 24.276 -2.721 11.914
703 HE ARG 86 HE ARG 86 24.187 -3.605 9.095
704 HH11 ARG 86 1HH1 ARG 86 25.921 -1.997 11.715
705 HH12 ARG 86 2HH1 ARG 86 27.391 -1.834 10.806
706 HH21 ARG 86 1HH2 ARG 86 26.130 -3.397 7.908
707 HH22 ARG 86 2HH2 ARG 86 27.510 -2.629 8.638
708 H GLU 87 H GLU 87 20.763 -7.172 14.878
709 HA GLU 87 HA GLU 87 18.956 -5.609 16.508
710 HB2 GLU 87 2HB GLU 87 20.233 -8.330 17.036
711 HB3 GLU 87 1HB GLU 87 18.949 -7.603 17.991
712 HG2 GLU 87 2HG GLU 87 17.447 -7.684 16.009
713 HG3 GLU 87 1HG GLU 87 18.735 -8.471 15.098
714 H ALA 88 H ALA 88 19.829 -3.979 17.662
715 HA ALA 88 HA ALA 88 22.359 -4.403 19.164
716 HB1 ALA 88 3HB ALA 88 22.632 -2.785 17.320
717 HB2 ALA 88 1HB ALA 88 22.784 -1.990 18.891
718 HB3 ALA 88 2HB ALA 88 21.298 -1.822 17.955
719 HA PRO 89 HA PRO 89 18.784 -3.862 22.152
720 HB2 PRO 89 2HB PRO 89 20.484 -5.665 23.849
721 HB3 PRO 89 1HB PRO 89 18.767 -5.818 23.414
722 HG2 PRO 89 2HG PRO 89 20.563 -7.447 22.326
723 HG3 PRO 89 1HG PRO 89 19.232 -6.795 21.336
724 HD2 PRO 89 2HD PRO 89 22.098 -5.838 21.499
725 HD3 PRO 89 1HD PRO 89 21.100 -6.155 20.061
Start of MODEL 18
1 H1 HIS 1 1H HIS 1 2.550 -21.208 16.490
2 H2 HIS 1 2H HIS 1 1.465 -21.503 15.229
3 H3 HIS 1 3H HIS 1 1.242 -20.165 16.239
4 HA HIS 1 HA HIS 1 2.151 -19.515 14.092
5 HB2 HIS 1 2HB HIS 1 4.026 -19.162 16.479
6 HB3 HIS 1 1HB HIS 1 4.193 -18.264 14.975
7 HD1 HIS 1 HD1 HIS 1 1.972 -18.534 18.025
8 HD2 HIS 1 HD2 HIS 1 2.466 -16.098 14.685
9 HE1 HIS 1 HE1 HIS 1 0.589 -16.481 18.462
10 HE2 HIS 1 HE2 HIS 1 1.129 -14.939 16.560
11 H HIS 2 H HIS 2 3.520 -19.931 12.413
12 HA HIS 2 HA HIS 2 5.782 -21.812 12.755
13 HB2 HIS 2 2HB HIS 2 4.142 -21.091 10.276
14 HB3 HIS 2 1HB HIS 2 5.678 -21.947 10.183
15 HD1 HIS 2 HD1 HIS 2 2.368 -22.777 9.855
16 HD2 HIS 2 HD2 HIS 2 5.360 -24.287 12.303
17 HE1 HIS 2 HE1 HIS 2 1.613 -25.081 10.490
18 HE2 HIS 2 HE2 HIS 2 3.551 -26.045 11.764
19 H HIS 3 H HIS 3 7.490 -20.595 13.279
20 HA HIS 3 HA HIS 3 7.690 -17.798 12.608
21 HB2 HIS 3 2HB HIS 3 8.301 -18.727 14.849
22 HB3 HIS 3 1HB HIS 3 9.620 -19.627 14.118
23 HD1 HIS 3 HD1 HIS 3 11.733 -18.565 14.751
24 HD2 HIS 3 HD2 HIS 3 8.777 -15.718 14.075
25 HE1 HIS 3 HE1 HIS 3 12.842 -16.350 15.123
26 HE2 HIS 3 HE2 HIS 3 11.007 -14.651 14.849
27 H HIS 4 H HIS 4 7.727 -18.263 10.264
28 HA HIS 4 HA HIS 4 10.397 -18.156 9.120
29 HB2 HIS 4 2HB HIS 4 8.432 -20.386 8.371
30 HB3 HIS 4 1HB HIS 4 9.769 -19.906 7.327
31 HD1 HIS 4 HD1 HIS 4 8.950 -22.165 10.073
32 HD2 HIS 4 HD2 HIS 4 12.403 -20.356 8.613
33 HE1 HIS 4 HE1 HIS 4 10.865 -23.432 11.093
34 HE2 HIS 4 HE2 HIS 4 12.934 -22.331 10.190
35 H HIS 5 H HIS 5 10.403 -16.796 7.418
36 HA HIS 5 HA HIS 5 8.349 -16.222 5.601
37 HB2 HIS 5 2HB HIS 5 7.664 -13.924 6.318
38 HB3 HIS 5 1HB HIS 5 7.171 -15.139 7.502
39 HD1 HIS 5 HD1 HIS 5 8.924 -11.969 7.214
40 HD2 HIS 5 HD2 HIS 5 9.010 -15.179 9.847
41 HE1 HIS 5 HE1 HIS 5 10.257 -11.190 9.190
42 HE2 HIS 5 HE2 HIS 5 10.475 -13.210 10.654
43 H HIS 6 H HIS 6 10.223 -16.512 4.303
44 HA HIS 6 HA HIS 6 12.383 -14.536 4.398
45 HB2 HIS 6 2HB HIS 6 12.744 -17.025 3.843
46 HB3 HIS 6 1HB HIS 6 11.982 -16.717 2.283
47 HD1 HIS 6 HD1 HIS 6 13.749 -16.446 0.536
48 HD2 HIS 6 HD2 HIS 6 14.984 -14.899 4.188
49 HE1 HIS 6 HE1 HIS 6 16.071 -15.557 0.148
50 HE2 HIS 6 HE2 HIS 6 16.854 -14.824 2.415
51 H SER 7 H SER 7 9.499 -15.270 2.604
52 HA SER 7 HA SER 7 9.627 -13.010 0.812
53 HB2 SER 7 2HB SER 7 7.267 -14.715 1.728
54 HB3 SER 7 1HB SER 7 7.254 -13.581 0.372
55 HG SER 7 HG SER 7 8.974 -14.873 -0.526
56 H HIS 8 H HIS 8 7.290 -11.691 1.096
57 HA HIS 8 HA HIS 8 7.693 -9.919 3.275
58 HB2 HIS 8 2HB HIS 8 5.375 -10.158 1.309
59 HB3 HIS 8 1HB HIS 8 5.542 -8.848 2.476
60 HD1 HIS 8 HD1 HIS 8 6.242 -6.821 1.246
61 HD2 HIS 8 HD2 HIS 8 8.143 -10.211 -0.232
62 HE1 HIS 8 HE1 HIS 8 7.776 -6.004 -0.557
63 HE2 HIS 8 HE2 HIS 8 9.076 -8.037 -1.258
64 H MET 9 H MET 9 6.161 -9.372 4.926
65 HA MET 9 HA MET 9 4.294 -11.479 5.816
66 HB2 MET 9 2HB MET 9 5.120 -11.313 8.124
67 HB3 MET 9 1HB MET 9 6.446 -11.773 7.066
68 HG2 MET 9 2HG MET 9 7.394 -9.563 7.166
69 HG3 MET 9 1HG MET 9 5.972 -8.933 8.000
70 HE1 MET 9 3HE MET 9 9.022 -8.519 9.004
71 HE2 MET 9 1HE MET 9 8.785 -8.743 10.736
72 HE3 MET 9 2HE MET 9 7.603 -7.829 9.796
73 H VAL 10 H VAL 10 3.047 -10.514 7.824
74 HA VAL 10 HA VAL 10 1.745 -8.107 6.965
75 HB VAL 10 HB VAL 10 0.093 -8.524 8.520
76 HG11 VAL 10 1HG1 VAL 10 -0.282 -10.951 8.811
77 HG12 VAL 10 2HG1 VAL 10 1.391 -11.262 8.343
78 HG13 VAL 10 3HG1 VAL 10 0.270 -10.548 7.183
79 HG21 VAL 10 3HG2 VAL 10 1.373 -8.142 10.568
80 HG22 VAL 10 1HG2 VAL 10 2.051 -9.770 10.483
81 HG23 VAL 10 2HG2 VAL 10 0.321 -9.545 10.747
82 H GLY 11 H GLY 11 1.817 -6.051 7.970
83 HA2 GLY 11 2HA GLY 11 2.615 -4.473 9.573
84 HA3 GLY 11 1HA GLY 11 3.908 -5.575 10.012
85 H ASP 12 H ASP 12 3.483 -5.373 6.634
86 HA ASP 12 HA ASP 12 6.135 -4.343 6.232
87 HB2 ASP 12 2HB ASP 12 5.100 -6.025 4.738
88 HB3 ASP 12 1HB ASP 12 3.859 -4.882 4.265
89 H THR 13 H THR 13 6.636 -2.207 6.474
90 HA THR 13 HA THR 13 4.655 -0.137 6.542
91 HB THR 13 HB THR 13 7.701 0.070 6.561
92 HG1 THR 13 HG1 THR 13 6.166 -0.986 8.345
93 HG21 THR 13 3HG2 THR 13 5.619 2.154 7.361
94 HG22 THR 13 1HG2 THR 13 6.683 2.247 5.953
95 HG23 THR 13 2HG2 THR 13 7.361 2.315 7.580
96 H VAL 14 H VAL 14 3.808 0.800 4.833
97 HA VAL 14 HA VAL 14 5.356 1.450 2.409
98 HB VAL 14 HB VAL 14 3.483 0.728 0.943
99 HG11 VAL 14 1HG1 VAL 14 4.529 -1.576 2.625
100 HG12 VAL 14 2HG1 VAL 14 5.355 -0.824 1.260
101 HG13 VAL 14 3HG1 VAL 14 3.846 -1.695 0.997
102 HG21 VAL 14 3HG2 VAL 14 1.618 0.902 2.533
103 HG22 VAL 14 1HG2 VAL 14 2.232 -0.479 3.447
104 HG23 VAL 14 2HG2 VAL 14 1.647 -0.697 1.795
105 H TRP 15 H TRP 15 3.644 2.729 0.924
106 HA TRP 15 HA TRP 15 1.995 4.611 2.512
107 HB2 TRP 15 2HB TRP 15 3.776 5.263 0.106
108 HB3 TRP 15 1HB TRP 15 2.674 6.396 0.882
109 HD1 TRP 15 HD1 TRP 15 3.612 5.600 3.959
110 HE1 TRP 15 HE1 TRP 15 5.870 6.502 4.789
111 HE3 TRP 15 HE3 TRP 15 5.812 6.599 -0.545
112 HZ2 TRP 15 HZ2 TRP 15 8.257 7.512 3.700
113 HZ3 TRP 15 HZ3 TRP 15 8.086 7.534 -0.568
114 HH2 TRP 15 HH2 TRP 15 9.287 7.986 1.514
115 H VAL 16 H VAL 16 0.074 5.339 1.349
116 HA VAL 16 HA VAL 16 -0.637 3.616 -0.979
117 HB VAL 16 HB VAL 16 -2.539 4.826 1.100
118 HG11 VAL 16 1HG1 VAL 16 -3.254 3.263 -1.416
119 HG12 VAL 16 2HG1 VAL 16 -3.588 4.971 -1.130
120 HG13 VAL 16 3HG1 VAL 16 -4.389 3.742 -0.151
121 HG21 VAL 16 3HG2 VAL 16 -3.102 2.472 1.609
122 HG22 VAL 16 1HG2 VAL 16 -1.376 2.767 1.839
123 HG23 VAL 16 2HG2 VAL 16 -1.942 1.922 0.397
124 H ARG 17 H ARG 17 -0.186 4.732 -2.690
125 HA ARG 17 HA ARG 17 -0.496 7.608 -2.920
126 HB2 ARG 17 2HB ARG 17 1.553 6.413 -3.708
127 HB3 ARG 17 1HB ARG 17 0.579 5.545 -4.893
128 HG2 ARG 17 2HG ARG 17 0.025 7.693 -5.991
129 HG3 ARG 17 1HG ARG 17 1.020 8.549 -4.809
130 HD2 ARG 17 2HD ARG 17 2.186 8.190 -6.968
131 HD3 ARG 17 1HD ARG 17 3.020 7.420 -5.616
132 HE ARG 17 HE ARG 17 1.215 5.850 -7.356
133 HH11 ARG 17 1HH1 ARG 17 4.448 6.433 -6.096
134 HH12 ARG 17 2HH1 ARG 17 5.098 4.945 -6.706
135 HH21 ARG 17 1HH2 ARG 17 2.087 3.896 -8.157
136 HH22 ARG 17 2HH2 ARG 17 3.757 3.503 -7.879
137 H ARG 18 H ARG 18 -2.660 8.070 -3.073
138 HA ARG 18 HA ARG 18 -4.406 6.446 -4.800
139 HB2 ARG 18 2HB ARG 18 -5.055 6.965 -2.411
140 HB3 ARG 18 1HB ARG 18 -5.197 8.663 -2.857
141 HG2 ARG 18 2HG ARG 18 -6.970 8.059 -4.501
142 HG3 ARG 18 1HG ARG 18 -6.841 6.372 -4.000
143 HD2 ARG 18 2HD ARG 18 -7.754 8.710 -2.293
144 HD3 ARG 18 1HD ARG 18 -8.753 7.398 -2.916
145 HE ARG 18 HE ARG 18 -6.555 6.613 -1.164
146 HH11 ARG 18 1HH1 ARG 18 -10.008 7.369 -1.350
147 HH12 ARG 18 2HH1 ARG 18 -10.378 6.564 0.141
148 HH21 ARG 18 1HH2 ARG 18 -7.060 5.614 0.807
149 HH22 ARG 18 2HH2 ARG 18 -8.705 5.572 1.363
150 H HIS 19 H HIS 19 -5.080 7.134 -6.713
151 HA HIS 19 HA HIS 19 -4.396 9.797 -7.738
152 HB2 HIS 19 2HB HIS 19 -3.931 7.613 -9.004
153 HB3 HIS 19 1HB HIS 19 -5.667 7.449 -9.232
154 HD1 HIS 19 HD1 HIS 19 -5.832 7.805 -11.722
155 HD2 HIS 19 HD2 HIS 19 -3.560 10.750 -9.859
156 HE1 HIS 19 HE1 HIS 19 -5.237 9.450 -13.523
157 HE2 HIS 19 HE2 HIS 19 -3.986 11.280 -12.345
158 H GLN 20 H GLN 20 -5.857 11.366 -7.438
159 HA GLN 20 HA GLN 20 -8.666 10.838 -6.958
160 HB2 GLN 20 2HB GLN 20 -7.078 13.439 -7.075
161 HB3 GLN 20 1HB GLN 20 -8.796 13.358 -6.694
162 HG2 GLN 20 2HG GLN 20 -6.578 12.047 -5.084
163 HG3 GLN 20 1HG GLN 20 -7.408 13.544 -4.661
164 HE21 GLN 20 1HE2 GLN 20 -7.223 10.850 -3.314
165 HE22 GLN 20 2HE2 GLN 20 -8.864 10.426 -2.981
166 H THR 21 H THR 21 -7.131 13.182 -9.200
167 HA THR 21 HA THR 21 -9.247 12.621 -11.215
168 HB THR 21 HB THR 21 -8.788 14.920 -12.090
169 HG1 THR 21 HG1 THR 21 -7.498 16.121 -10.192
170 HG21 THR 21 3HG2 THR 21 -9.762 16.222 -10.232
171 HG22 THR 21 1HG2 THR 21 -9.388 14.917 -9.106
172 HG23 THR 21 2HG2 THR 21 -10.575 14.663 -10.389
173 H LYS 22 H LYS 22 -8.602 12.554 -13.445
174 HA LYS 22 HA LYS 22 -6.151 11.235 -14.032
175 HB2 LYS 22 2HB LYS 22 -8.188 12.501 -15.915
176 HB3 LYS 22 1HB LYS 22 -6.893 11.421 -16.419
177 HG2 LYS 22 2HG LYS 22 -7.906 9.584 -15.126
178 HG3 LYS 22 1HG LYS 22 -9.201 10.667 -14.596
179 HD2 LYS 22 2HD LYS 22 -9.915 10.969 -16.946
180 HD3 LYS 22 1HD LYS 22 -8.617 9.902 -17.486
181 HE2 LYS 22 2HE LYS 22 -10.940 9.101 -15.705
182 HE3 LYS 22 1HE LYS 22 -10.788 8.743 -17.424
183 HZ1 LYS 22 3HZ LYS 22 -8.974 7.765 -15.285
184 HZ2 LYS 22 1HZ LYS 22 -8.814 7.429 -16.939
185 HZ3 LYS 22 2HZ LYS 22 -10.153 6.850 -16.081
186 H ASN 23 H ASN 23 -7.148 14.559 -14.060
187 HA ASN 23 HA ASN 23 -5.132 15.701 -15.704
188 HB2 ASN 23 2HB ASN 23 -7.137 16.986 -15.197
189 HB3 ASN 23 1HB ASN 23 -6.830 16.906 -13.465
190 HD21 ASN 23 1HD2 ASN 23 -5.361 18.354 -12.564
191 HD22 ASN 23 2HD2 ASN 23 -4.649 19.661 -13.435
192 H LEU 24 H LEU 24 -5.411 15.374 -12.161
193 HA LEU 24 HA LEU 24 -2.697 16.298 -11.676
194 HB2 LEU 24 2HB LEU 24 -4.755 15.087 -9.781
195 HB3 LEU 24 1HB LEU 24 -3.237 15.819 -9.288
196 HG LEU 24 HG LEU 24 -5.546 17.288 -10.613
197 HD11 LEU 24 1HD1 LEU 24 -5.896 18.355 -8.437
198 HD12 LEU 24 2HD1 LEU 24 -4.628 17.359 -7.723
199 HD13 LEU 24 3HD1 LEU 24 -6.104 16.609 -8.333
200 HD21 LEU 24 3HD2 LEU 24 -3.433 18.314 -11.219
201 HD22 LEU 24 1HD2 LEU 24 -2.928 18.363 -9.527
202 HD23 LEU 24 2HD2 LEU 24 -4.291 19.344 -10.076
203 H GLU 25 H GLU 25 -1.092 15.010 -10.580
204 HA GLU 25 HA GLU 25 -0.912 12.217 -11.369
205 HB2 GLU 25 2HB GLU 25 0.937 13.981 -9.684
206 HB3 GLU 25 1HB GLU 25 1.317 12.336 -10.183
207 HG2 GLU 25 2HG GLU 25 1.233 13.048 -12.559
208 HG3 GLU 25 1HG GLU 25 0.892 14.698 -12.037
209 HA PRO 26 HA PRO 26 -2.576 10.400 -7.610
210 HB2 PRO 26 2HB PRO 26 -0.928 8.212 -7.206
211 HB3 PRO 26 1HB PRO 26 -2.157 8.288 -8.480
212 HG2 PRO 26 2HG PRO 26 0.790 8.821 -8.699
213 HG3 PRO 26 1HG PRO 26 -0.260 7.853 -9.759
214 HD2 PRO 26 2HD PRO 26 0.427 10.354 -10.436
215 HD3 PRO 26 1HD PRO 26 -1.200 9.724 -10.783
216 H ARG 27 H ARG 27 -2.445 11.079 -5.547
217 HA ARG 27 HA ARG 27 0.126 12.084 -4.483
218 HB2 ARG 27 2HB ARG 27 -1.821 13.665 -4.668
219 HB3 ARG 27 1HB ARG 27 -2.730 12.651 -3.556
220 HG2 ARG 27 2HG ARG 27 -0.981 13.104 -1.805
221 HG3 ARG 27 1HG ARG 27 -0.199 14.209 -2.935
222 HD2 ARG 27 2HD ARG 27 -2.989 14.501 -1.776
223 HD3 ARG 27 1HD ARG 27 -1.568 15.449 -1.341
224 HE ARG 27 HE ARG 27 -1.885 15.812 -4.056
225 HH11 ARG 27 1HH1 ARG 27 -3.878 16.455 -1.210
226 HH12 ARG 27 2HH1 ARG 27 -4.689 17.808 -1.938
227 HH21 ARG 27 1HH2 ARG 27 -2.932 17.605 -4.974
228 HH22 ARG 27 2HH2 ARG 27 -4.150 18.457 -4.075
229 H TRP 28 H TRP 28 1.062 11.070 -2.739
230 HA TRP 28 HA TRP 28 -0.302 8.707 -1.659
231 HB2 TRP 28 2HB TRP 28 1.886 7.981 -0.793
232 HB3 TRP 28 1HB TRP 28 1.932 8.267 -2.523
233 HD1 TRP 28 HD1 TRP 28 3.429 10.356 -3.378
234 HE1 TRP 28 HE1 TRP 28 5.429 11.545 -2.295
235 HE3 TRP 28 HE3 TRP 28 2.818 8.777 1.448
236 HZ2 TRP 28 HZ2 TRP 28 6.609 11.778 0.245
237 HZ3 TRP 28 HZ3 TRP 28 4.433 9.524 3.147
238 HH2 TRP 28 HH2 TRP 28 6.293 10.998 2.557
239 H LYS 29 H LYS 29 -0.715 8.324 0.392
240 HA LYS 29 HA LYS 29 -0.005 10.313 2.471
241 HB2 LYS 29 2HB LYS 29 -2.272 8.265 2.377
242 HB3 LYS 29 1HB LYS 29 -1.829 9.148 3.833
243 HG2 LYS 29 2HG LYS 29 -2.402 11.274 2.720
244 HG3 LYS 29 1HG LYS 29 -2.859 10.382 1.265
245 HD2 LYS 29 2HD LYS 29 -4.668 9.267 2.444
246 HD3 LYS 29 1HD LYS 29 -4.151 9.958 3.986
247 HE2 LYS 29 2HE LYS 29 -6.131 11.106 3.026
248 HE3 LYS 29 1HE LYS 29 -4.760 12.192 3.239
249 HZ1 LYS 29 3HZ LYS 29 -5.950 12.460 1.112
250 HZ2 LYS 29 1HZ LYS 29 -5.482 10.898 0.665
251 HZ3 LYS 29 2HZ LYS 29 -4.312 12.095 0.911
252 H GLY 30 H GLY 30 0.711 9.441 4.474
253 HA2 GLY 30 2HA GLY 30 1.317 6.627 4.779
254 HA3 GLY 30 1HA GLY 30 2.715 7.664 4.617
255 HA PRO 31 HA PRO 31 3.087 5.725 6.119
256 HB2 PRO 31 2HB PRO 31 3.472 4.345 8.411
257 HB3 PRO 31 1HB PRO 31 4.405 5.818 8.072
258 HG2 PRO 31 2HG PRO 31 1.998 5.483 9.830
259 HG3 PRO 31 1HG PRO 31 3.498 6.384 10.137
260 HD2 PRO 31 2HD PRO 31 1.155 7.562 9.258
261 HD3 PRO 31 1HD PRO 31 2.773 8.241 8.974
262 H TYR 32 H TYR 32 2.531 3.493 5.876
263 HA TYR 32 HA TYR 32 -0.073 2.523 6.844
264 HB2 TYR 32 2HB TYR 32 0.804 2.678 3.936
265 HB3 TYR 32 1HB TYR 32 -0.408 1.525 4.468
266 HD1 TYR 32 HD1 TYR 32 -2.576 2.365 5.462
267 HD2 TYR 32 HD2 TYR 32 0.205 4.997 3.572
268 HE1 TYR 32 HE1 TYR 32 -4.336 4.059 5.237
269 HE2 TYR 32 HE2 TYR 32 -1.562 6.682 3.347
270 HH TYR 32 HH TYR 32 -4.511 6.514 4.990
271 H THR 33 H THR 33 -0.271 0.108 5.979
272 HA THR 33 HA THR 33 2.214 -1.349 6.300
273 HB THR 33 HB THR 33 1.816 -0.809 8.611
274 HG1 THR 33 HG1 THR 33 2.433 -2.784 8.825
275 HG21 THR 33 3HG2 THR 33 -0.226 -1.338 9.854
276 HG22 THR 33 1HG2 THR 33 -0.986 -1.962 8.393
277 HG23 THR 33 2HG2 THR 33 -0.601 -0.245 8.518
278 H VAL 34 H VAL 34 2.010 -2.754 4.679
279 HA VAL 34 HA VAL 34 -0.351 -4.021 3.770
280 HB VAL 34 HB VAL 34 2.556 -4.894 3.389
281 HG11 VAL 34 1HG1 VAL 34 1.788 -6.226 1.478
282 HG12 VAL 34 2HG1 VAL 34 0.112 -5.809 1.842
283 HG13 VAL 34 3HG1 VAL 34 1.047 -6.783 2.980
284 HG21 VAL 34 3HG2 VAL 34 2.152 -2.672 2.450
285 HG22 VAL 34 1HG2 VAL 34 0.785 -3.291 1.523
286 HG23 VAL 34 2HG2 VAL 34 2.421 -3.851 1.167
287 H LEU 35 H LEU 35 -1.441 -5.593 4.682
288 HA LEU 35 HA LEU 35 -0.234 -7.341 6.729
289 HB2 LEU 35 2HB LEU 35 -3.176 -6.783 6.198
290 HB3 LEU 35 1HB LEU 35 -2.524 -7.736 7.522
291 HG LEU 35 HG LEU 35 -2.254 -4.733 7.125
292 HD11 LEU 35 1HD1 LEU 35 -3.479 -4.545 9.240
293 HD12 LEU 35 2HD1 LEU 35 -3.633 -6.302 9.321
294 HD13 LEU 35 3HD1 LEU 35 -4.419 -5.404 8.022
295 HD21 LEU 35 3HD2 LEU 35 -0.944 -6.431 9.265
296 HD22 LEU 35 1HD2 LEU 35 -1.000 -4.665 9.249
297 HD23 LEU 35 2HD2 LEU 35 -0.134 -5.527 7.981
298 H LEU 36 H LEU 36 -1.549 -7.325 3.508
299 HA LEU 36 HA LEU 36 -0.812 -10.172 3.254
300 HB2 LEU 36 2HB LEU 36 -3.232 -10.279 3.556
301 HB3 LEU 36 1HB LEU 36 -3.479 -9.021 2.369
302 HG LEU 36 HG LEU 36 -2.528 -10.653 0.617
303 HD11 LEU 36 1HD1 LEU 36 -2.968 -12.684 2.810
304 HD12 LEU 36 2HD1 LEU 36 -1.423 -12.235 2.086
305 HD13 LEU 36 3HD1 LEU 36 -2.646 -13.048 1.112
306 HD21 LEU 36 3HD2 LEU 36 -5.140 -11.363 1.966
307 HD22 LEU 36 1HD2 LEU 36 -4.664 -11.827 0.331
308 HD23 LEU 36 2HD2 LEU 36 -4.897 -10.127 0.730
309 H THR 37 H THR 37 0.182 -10.590 1.389
310 HA THR 37 HA THR 37 0.398 -8.529 -0.704
311 HB THR 37 HB THR 37 2.508 -9.642 -1.373
312 HG1 THR 37 HG1 THR 37 1.606 -11.676 0.120
313 HG21 THR 37 3HG2 THR 37 3.888 -9.028 0.544
314 HG22 THR 37 1HG2 THR 37 2.473 -9.050 1.600
315 HG23 THR 37 2HG2 THR 37 2.605 -7.842 0.319
316 H THR 38 H THR 38 -0.170 -9.061 -2.769
317 HA THR 38 HA THR 38 -1.096 -11.777 -3.435
318 HB THR 38 HB THR 38 -2.782 -9.218 -3.543
319 HG1 THR 38 HG1 THR 38 -2.612 -11.313 -1.799
320 HG21 THR 38 3HG2 THR 38 -3.571 -11.953 -4.606
321 HG22 THR 38 1HG2 THR 38 -3.269 -10.517 -5.584
322 HG23 THR 38 2HG2 THR 38 -4.637 -10.555 -4.468
323 HA PRO 39 HA PRO 39 0.862 -10.813 -7.472
324 HB2 PRO 39 2HB PRO 39 -1.298 -11.867 -9.062
325 HB3 PRO 39 1HB PRO 39 0.203 -12.688 -8.616
326 HG2 PRO 39 2HG PRO 39 -2.478 -12.858 -7.332
327 HG3 PRO 39 1HG PRO 39 -1.224 -14.107 -7.496
328 HD2 PRO 39 2HD PRO 39 -1.641 -12.925 -5.138
329 HD3 PRO 39 1HD PRO 39 0.018 -13.283 -5.676
330 H THR 40 H THR 40 0.888 -8.674 -7.697
331 HA THR 40 HA THR 40 0.554 -6.664 -8.654
332 HB THR 40 HB THR 40 -1.907 -7.804 -10.043
333 HG1 THR 40 HG1 THR 40 -0.552 -8.755 -11.457
334 HG21 THR 40 3HG2 THR 40 -1.302 -6.252 -11.878
335 HG22 THR 40 1HG2 THR 40 0.048 -5.638 -10.922
336 HG23 THR 40 2HG2 THR 40 -1.610 -5.355 -10.390
337 H ALA 41 H ALA 41 -0.825 -7.555 -6.086
338 HA ALA 41 HA ALA 41 -2.357 -5.114 -5.608
339 HB1 ALA 41 3HB ALA 41 -4.079 -6.624 -6.533
340 HB2 ALA 41 1HB ALA 41 -4.380 -6.284 -4.831
341 HB3 ALA 41 2HB ALA 41 -3.690 -7.833 -5.311
342 H LEU 42 H LEU 42 -2.427 -4.579 -3.402
343 HA LEU 42 HA LEU 42 -1.241 -6.449 -1.446
344 HB2 LEU 42 2HB LEU 42 -0.542 -3.486 -1.763
345 HB3 LEU 42 1HB LEU 42 -0.020 -4.493 -0.422
346 HG LEU 42 HG LEU 42 0.799 -4.848 -3.333
347 HD11 LEU 42 1HD1 LEU 42 3.044 -4.179 -2.612
348 HD12 LEU 42 2HD1 LEU 42 2.442 -3.876 -0.979
349 HD13 LEU 42 3HD1 LEU 42 1.862 -2.900 -2.330
350 HD21 LEU 42 3HD2 LEU 42 2.364 -6.560 -2.532
351 HD22 LEU 42 1HD2 LEU 42 0.690 -7.015 -2.231
352 HD23 LEU 42 2HD2 LEU 42 1.692 -6.425 -0.905
353 H LYS 43 H LYS 43 -2.698 -6.767 0.125
354 HA LYS 43 HA LYS 43 -4.804 -4.831 0.672
355 HB2 LYS 43 2HB LYS 43 -5.328 -7.264 0.749
356 HB3 LYS 43 1HB LYS 43 -4.178 -7.468 2.066
357 HG2 LYS 43 2HG LYS 43 -5.534 -6.010 3.518
358 HG3 LYS 43 1HG LYS 43 -6.662 -5.724 2.191
359 HD2 LYS 43 2HD LYS 43 -7.634 -7.351 3.685
360 HD3 LYS 43 1HD LYS 43 -7.204 -8.170 2.182
361 HE2 LYS 43 2HE LYS 43 -6.636 -9.494 4.209
362 HE3 LYS 43 1HE LYS 43 -5.210 -9.112 3.242
363 HZ1 LYS 43 3HZ LYS 43 -6.103 -7.717 5.710
364 HZ2 LYS 43 1HZ LYS 43 -4.766 -7.253 4.786
365 HZ3 LYS 43 2HZ LYS 43 -4.771 -8.749 5.582
366 H VAL 44 H VAL 44 -4.240 -3.147 1.772
367 HA VAL 44 HA VAL 44 -2.217 -3.186 3.923
368 HB VAL 44 HB VAL 44 -3.419 -0.871 2.315
369 HG11 VAL 44 1HG1 VAL 44 -2.729 -0.113 4.534
370 HG12 VAL 44 2HG1 VAL 44 -1.678 0.551 3.283
371 HG13 VAL 44 3HG1 VAL 44 -1.119 -0.792 4.282
372 HG21 VAL 44 3HG2 VAL 44 -1.251 -0.728 1.154
373 HG22 VAL 44 1HG2 VAL 44 -1.995 -2.312 0.913
374 HG23 VAL 44 2HG2 VAL 44 -0.663 -2.127 2.057
375 H ASP 45 H ASP 45 -2.768 -2.070 5.940
376 HA ASP 45 HA ASP 45 -5.318 -2.547 7.008
377 HB2 ASP 45 2HB ASP 45 -3.345 -2.405 8.423
378 HB3 ASP 45 1HB ASP 45 -3.069 -0.735 7.954
379 H GLY 46 H GLY 46 -7.173 -1.496 6.739
380 HA2 GLY 46 2HA GLY 46 -8.503 0.506 6.967
381 HA3 GLY 46 1HA GLY 46 -7.233 1.417 6.169
382 H ILE 47 H ILE 47 -6.987 -0.968 4.251
383 HA ILE 47 HA ILE 47 -8.629 0.182 2.178
384 HB ILE 47 HB ILE 47 -6.781 -2.247 2.142
385 HG12 ILE 47 2HG1 ILE 47 -5.462 -0.328 2.724
386 HG13 ILE 47 1HG1 ILE 47 -5.148 -0.646 1.027
387 HG21 ILE 47 1HG2 ILE 47 -7.920 -0.727 -0.224
388 HG22 ILE 47 2HG2 ILE 47 -8.349 -2.366 0.269
389 HG23 ILE 47 3HG2 ILE 47 -6.718 -2.014 -0.304
390 HD11 ILE 47 3HD1 ILE 47 -5.290 1.712 1.419
391 HD12 ILE 47 1HD1 ILE 47 -6.879 1.546 2.169
392 HD13 ILE 47 2HD1 ILE 47 -6.677 1.218 0.445
393 H ALA 48 H ALA 48 -10.301 -0.862 0.996
394 HA ALA 48 HA ALA 48 -12.167 -2.330 2.475
395 HB1 ALA 48 3HB ALA 48 -13.460 -2.492 0.382
396 HB2 ALA 48 1HB ALA 48 -12.037 -1.987 -0.542
397 HB3 ALA 48 2HB ALA 48 -12.794 -0.874 0.595
398 H ALA 49 H ALA 49 -10.040 -3.454 -0.204
399 HA ALA 49 HA ALA 49 -9.925 -6.110 1.013
400 HB1 ALA 49 3HB ALA 49 -10.914 -5.772 -1.837
401 HB2 ALA 49 1HB ALA 49 -11.893 -6.265 -0.456
402 HB3 ALA 49 2HB ALA 49 -10.587 -7.306 -1.027
403 H TRP 50 H TRP 50 -8.950 -4.454 -2.076
404 HA TRP 50 HA TRP 50 -6.124 -4.918 -1.429
405 HB2 TRP 50 2HB TRP 50 -7.453 -6.103 -3.897
406 HB3 TRP 50 1HB TRP 50 -5.724 -5.793 -3.833
407 HD1 TRP 50 HD1 TRP 50 -4.281 -7.277 -2.055
408 HE1 TRP 50 HE1 TRP 50 -4.692 -9.618 -1.105
409 HE3 TRP 50 HE3 TRP 50 -9.253 -7.772 -3.163
410 HZ2 TRP 50 HZ2 TRP 50 -6.813 -11.444 -0.828
411 HZ3 TRP 50 HZ3 TRP 50 -10.400 -9.853 -2.524
412 HH2 TRP 50 HH2 TRP 50 -9.205 -11.654 -1.379
413 H ILE 51 H ILE 51 -4.709 -3.433 -2.286
414 HA ILE 51 HA ILE 51 -5.736 -1.375 -4.160
415 HB ILE 51 HB ILE 51 -3.377 -1.316 -2.212
416 HG12 ILE 51 2HG1 ILE 51 -5.556 -0.773 -1.205
417 HG13 ILE 51 1HG1 ILE 51 -4.523 0.646 -1.231
418 HG21 ILE 51 1HG2 ILE 51 -2.832 0.962 -3.019
419 HG22 ILE 51 2HG2 ILE 51 -3.994 0.768 -4.336
420 HG23 ILE 51 3HG2 ILE 51 -2.569 -0.269 -4.257
421 HD11 ILE 51 3HD1 ILE 51 -6.817 1.199 -1.764
422 HD12 ILE 51 1HD1 ILE 51 -6.804 0.076 -3.123
423 HD13 ILE 51 2HD1 ILE 51 -5.774 1.510 -3.150
424 H HIS 52 H HIS 52 -5.089 -1.528 -6.215
425 HA HIS 52 HA HIS 52 -3.365 -3.458 -7.306
426 HB2 HIS 52 2HB HIS 52 -5.160 -2.162 -8.528
427 HB3 HIS 52 1HB HIS 52 -4.140 -0.737 -8.462
428 HD1 HIS 52 HD1 HIS 52 -2.001 -0.755 -10.046
429 HD2 HIS 52 HD2 HIS 52 -4.654 -3.905 -10.585
430 HE1 HIS 52 HE1 HIS 52 -1.402 -1.774 -12.263
431 HE2 HIS 52 HE2 HIS 52 -3.123 -3.566 -12.636
432 H ALA 53 H ALA 53 -1.156 -3.521 -7.454
433 HA ALA 53 HA ALA 53 0.282 -2.214 -5.454
434 HB1 ALA 53 3HB ALA 53 0.784 -4.476 -6.309
435 HB2 ALA 53 1HB ALA 53 2.225 -3.461 -6.238
436 HB3 ALA 53 2HB ALA 53 1.438 -3.769 -7.786
437 H ALA 54 H ALA 54 -0.087 -1.167 -8.723
438 HA ALA 54 HA ALA 54 2.114 0.679 -8.796
439 HB1 ALA 54 3HB ALA 54 1.128 -0.225 -10.844
440 HB2 ALA 54 1HB ALA 54 1.029 1.534 -10.842
441 HB3 ALA 54 2HB ALA 54 -0.403 0.561 -10.481
442 H HIS 55 H HIS 55 -0.357 0.754 -6.709
443 HA HIS 55 HA HIS 55 -0.313 3.709 -6.454
444 HB2 HIS 55 2HB HIS 55 -2.519 1.763 -5.609
445 HB3 HIS 55 1HB HIS 55 -2.484 3.465 -5.182
446 HD1 HIS 55 HD1 HIS 55 -2.484 5.099 -7.429
447 HD2 HIS 55 HD2 HIS 55 -4.046 1.260 -7.781
448 HE1 HIS 55 HE1 HIS 55 -3.986 5.163 -9.443
449 HE2 HIS 55 HE2 HIS 55 -4.860 2.821 -9.679
450 H VAL 56 H VAL 56 1.442 1.357 -5.385
451 HA VAL 56 HA VAL 56 1.293 2.096 -2.514
452 HB VAL 56 HB VAL 56 2.086 -0.683 -3.546
453 HG11 VAL 56 1HG1 VAL 56 1.751 0.351 -0.706
454 HG12 VAL 56 2HG1 VAL 56 3.270 -0.080 -1.495
455 HG13 VAL 56 3HG1 VAL 56 2.070 -1.324 -1.158
456 HG21 VAL 56 3HG2 VAL 56 0.005 -1.533 -2.549
457 HG22 VAL 56 1HG2 VAL 56 -0.339 -0.350 -3.814
458 HG23 VAL 56 2HG2 VAL 56 -0.478 0.109 -2.116
459 H LYS 57 H LYS 57 3.124 3.003 -1.789
460 HA LYS 57 HA LYS 57 5.669 2.650 -3.277
461 HB2 LYS 57 2HB LYS 57 4.934 4.853 -1.298
462 HB3 LYS 57 1HB LYS 57 6.365 4.790 -2.319
463 HG2 LYS 57 2HG LYS 57 4.916 5.055 -4.327
464 HG3 LYS 57 1HG LYS 57 3.508 5.128 -3.269
465 HD2 LYS 57 2HD LYS 57 3.936 7.382 -3.727
466 HD3 LYS 57 1HD LYS 57 4.677 7.156 -2.147
467 HE2 LYS 57 2HE LYS 57 6.102 7.265 -4.824
468 HE3 LYS 57 1HE LYS 57 6.085 8.522 -3.590
469 HZ1 LYS 57 3HZ LYS 57 8.142 7.391 -3.442
470 HZ2 LYS 57 1HZ LYS 57 7.412 5.866 -3.443
471 HZ3 LYS 57 2HZ LYS 57 7.241 6.887 -2.105
472 H ALA 58 H ALA 58 6.903 1.118 -2.281
473 HA ALA 58 HA ALA 58 6.559 0.225 0.402
474 HB1 ALA 58 3HB ALA 58 7.350 -1.244 -1.402
475 HB2 ALA 58 1HB ALA 58 8.509 -1.216 -0.072
476 HB3 ALA 58 2HB ALA 58 8.835 -0.303 -1.547
477 H ALA 59 H ALA 59 7.325 1.100 2.253
478 HA ALA 59 HA ALA 59 9.516 3.115 2.161
479 HB1 ALA 59 3HB ALA 59 7.319 4.015 2.826
480 HB2 ALA 59 1HB ALA 59 8.460 4.094 4.171
481 HB3 ALA 59 2HB ALA 59 7.218 2.837 4.136
482 H ASP 60 H ASP 60 11.265 2.876 3.551
483 HA ASP 60 HA ASP 60 11.613 0.262 4.851
484 HB2 ASP 60 2HB ASP 60 13.289 1.177 3.196
485 HB3 ASP 60 1HB ASP 60 13.686 2.448 4.341
486 HA PRO 61 HA PRO 61 11.033 2.516 8.823
487 HB2 PRO 61 2HB PRO 61 10.102 0.485 10.292
488 HB3 PRO 61 1HB PRO 61 9.139 1.087 8.924
489 HG2 PRO 61 2HG PRO 61 10.919 -1.330 9.040
490 HG3 PRO 61 1HG PRO 61 9.272 -1.184 8.383
491 HD2 PRO 61 2HD PRO 61 11.587 -1.038 6.845
492 HD3 PRO 61 1HD PRO 61 10.020 -0.347 6.371
493 H GLY 62 H GLY 62 13.477 0.443 7.901
494 HA2 GLY 62 2HA GLY 62 15.464 -0.261 8.812
495 HA3 GLY 62 1HA GLY 62 15.098 0.665 10.259
496 H GLY 63 H GLY 63 14.435 -0.413 12.058
497 HA2 GLY 63 2HA GLY 63 14.152 -3.324 12.024
498 HA3 GLY 63 1HA GLY 63 14.157 -2.278 13.438
499 H GLY 64 H GLY 64 12.196 -3.746 10.951
500 HA2 GLY 64 2HA GLY 64 9.705 -2.402 11.618
501 HA3 GLY 64 1HA GLY 64 9.926 -3.719 10.479
502 HA PRO 65 HA PRO 65 7.254 -5.328 13.960
503 HB2 PRO 65 2HB PRO 65 6.682 -7.408 11.855
504 HB3 PRO 65 1HB PRO 65 5.559 -6.497 12.893
505 HG2 PRO 65 2HG PRO 65 5.794 -5.831 10.348
506 HG3 PRO 65 1HG PRO 65 5.692 -4.561 11.591
507 HD2 PRO 65 2HD PRO 65 8.127 -5.594 10.141
508 HD3 PRO 65 1HD PRO 65 7.659 -3.913 10.499
509 H SER 66 H SER 66 9.608 -7.129 12.037
510 HA SER 66 HA SER 66 11.139 -8.721 12.521
511 HB2 SER 66 2HB SER 66 10.591 -7.978 15.434
512 HB3 SER 66 1HB SER 66 11.991 -8.879 14.850
513 HG SER 66 HG SER 66 11.298 -6.225 14.108
514 H SER 67 H SER 67 8.274 -9.488 12.363
515 HA SER 67 HA SER 67 6.898 -11.253 12.474
516 HB2 SER 67 2HB SER 67 8.976 -12.559 11.829
517 HB3 SER 67 1HB SER 67 9.201 -12.945 13.529
518 HG SER 67 HG SER 67 6.850 -13.731 13.258
519 H ARG 68 H ARG 68 7.679 -9.568 14.954
520 HA ARG 68 HA ARG 68 6.785 -11.199 17.187
521 HB2 ARG 68 2HB ARG 68 8.554 -9.315 17.309
522 HB3 ARG 68 1HB ARG 68 7.228 -8.170 17.149
523 HG2 ARG 68 2HG ARG 68 7.851 -8.394 19.491
524 HG3 ARG 68 1HG ARG 68 6.236 -9.063 19.249
525 HD2 ARG 68 2HD ARG 68 7.164 -11.340 19.240
526 HD3 ARG 68 1HD ARG 68 8.797 -10.695 19.417
527 HE ARG 68 HE ARG 68 7.403 -9.701 21.568
528 HH11 ARG 68 1HH1 ARG 68 8.098 -12.947 20.354
529 HH12 ARG 68 2HH1 ARG 68 8.081 -13.676 21.928
530 HH21 ARG 68 1HH2 ARG 68 7.444 -10.653 23.627
531 HH22 ARG 68 2HH2 ARG 68 7.708 -12.360 23.800
532 H LEU 69 H LEU 69 5.608 -8.539 15.169
533 HA LEU 69 HA LEU 69 2.958 -8.521 16.429
534 HB2 LEU 69 2HB LEU 69 4.030 -6.775 14.174
535 HB3 LEU 69 1HB LEU 69 2.563 -6.504 15.099
536 HG LEU 69 HG LEU 69 5.421 -6.242 16.108
537 HD11 LEU 69 1HD1 LEU 69 3.276 -4.131 15.705
538 HD12 LEU 69 2HD1 LEU 69 4.709 -4.375 14.702
539 HD13 LEU 69 3HD1 LEU 69 4.889 -3.863 16.377
540 HD21 LEU 69 3HD2 LEU 69 2.853 -5.894 17.684
541 HD22 LEU 69 1HD2 LEU 69 4.472 -5.473 18.251
542 HD23 LEU 69 2HD2 LEU 69 4.067 -7.154 17.911
543 H THR 70 H THR 70 4.037 -10.745 14.576
544 HA THR 70 HA THR 70 1.987 -10.656 12.443
545 HB THR 70 HB THR 70 3.306 -12.425 11.297
546 HG1 THR 70 HG1 THR 70 4.489 -12.733 13.632
547 HG21 THR 70 3HG2 THR 70 4.966 -9.976 11.995
548 HG22 THR 70 1HG2 THR 70 3.762 -10.079 10.705
549 HG23 THR 70 2HG2 THR 70 5.239 -11.037 10.613
550 H TRP 71 H TRP 71 0.169 -11.566 13.193
551 HA TRP 71 HA TRP 71 0.187 -13.845 15.006
552 HB2 TRP 71 2HB TRP 71 -1.384 -11.958 15.349
553 HB3 TRP 71 1HB TRP 71 -2.124 -12.281 13.789
554 HD1 TRP 71 HD1 TRP 71 -4.127 -13.970 13.786
555 HE1 TRP 71 HE1 TRP 71 -5.235 -15.472 15.553
556 HE3 TRP 71 HE3 TRP 71 -0.704 -13.465 17.555
557 HZ2 TRP 71 HZ2 TRP 71 -4.739 -16.328 18.185
558 HZ3 TRP 71 HZ3 TRP 71 -1.097 -14.662 19.666
559 HH2 TRP 71 HH2 TRP 71 -3.072 -16.065 19.976
560 H ARG 72 H ARG 72 -1.873 -13.336 12.104
561 HA ARG 72 HA ARG 72 -0.997 -15.666 10.673
562 HB2 ARG 72 2HB ARG 72 -2.148 -16.837 12.505
563 HB3 ARG 72 1HB ARG 72 -3.583 -15.846 12.288
564 HG2 ARG 72 2HG ARG 72 -3.822 -16.883 9.972
565 HG3 ARG 72 1HG ARG 72 -2.531 -17.995 10.423
566 HD2 ARG 72 2HD ARG 72 -5.184 -17.707 11.878
567 HD3 ARG 72 1HD ARG 72 -4.785 -18.985 10.727
568 HE ARG 72 HE ARG 72 -2.845 -19.342 12.466
569 HH11 ARG 72 1HH1 ARG 72 -6.253 -18.757 13.170
570 HH12 ARG 72 2HH1 ARG 72 -6.218 -19.654 14.656
571 HH21 ARG 72 1HH2 ARG 72 -2.829 -20.545 14.393
572 HH22 ARG 72 2HH2 ARG 72 -4.274 -20.669 15.346
573 H VAL 73 H VAL 73 -1.120 -14.563 8.708
574 HA VAL 73 HA VAL 73 -3.841 -14.071 7.672
575 HB VAL 73 HB VAL 73 -1.503 -12.193 7.028
576 HG11 VAL 73 1HG1 VAL 73 -4.377 -12.133 6.012
577 HG12 VAL 73 2HG1 VAL 73 -2.941 -12.534 5.064
578 HG13 VAL 73 3HG1 VAL 73 -3.149 -10.902 5.697
579 HG21 VAL 73 3HG2 VAL 73 -2.790 -10.408 8.127
580 HG22 VAL 73 1HG2 VAL 73 -2.438 -11.713 9.263
581 HG23 VAL 73 2HG2 VAL 73 -4.052 -11.563 8.566
582 H GLN 74 H GLN 74 -0.424 -14.022 6.533
583 HA GLN 74 HA GLN 74 -1.102 -16.020 4.437
584 HB2 GLN 74 2HB GLN 74 0.562 -14.894 2.976
585 HB3 GLN 74 1HB GLN 74 -0.770 -13.834 3.402
586 HG2 GLN 74 2HG GLN 74 0.629 -12.624 4.996
587 HG3 GLN 74 1HG GLN 74 1.961 -13.758 4.723
588 HE21 GLN 74 1HE2 GLN 74 3.359 -12.089 3.986
589 HE22 GLN 74 2HE2 GLN 74 3.147 -11.343 2.446
590 H ARG 75 H ARG 75 -0.272 -16.766 6.977
591 HA ARG 75 HA ARG 75 2.565 -17.502 6.837
592 HB2 ARG 75 2HB ARG 75 0.485 -18.243 8.941
593 HB3 ARG 75 1HB ARG 75 2.229 -18.380 9.093
594 HG2 ARG 75 2HG ARG 75 0.628 -15.809 8.949
595 HG3 ARG 75 1HG ARG 75 1.423 -16.473 10.376
596 HD2 ARG 75 2HD ARG 75 2.793 -15.460 7.867
597 HD3 ARG 75 1HD ARG 75 2.716 -14.625 9.413
598 HE ARG 75 HE ARG 75 4.176 -17.179 8.969
599 HH11 ARG 75 1HH1 ARG 75 3.944 -14.028 10.548
600 HH12 ARG 75 2HH1 ARG 75 5.442 -14.203 11.399
601 HH21 ARG 75 1HH2 ARG 75 6.171 -17.358 10.084
602 HH22 ARG 75 2HH2 ARG 75 6.698 -16.079 11.139
603 H SER 76 H SER 76 1.822 -18.527 4.732
604 HA SER 76 HA SER 76 0.206 -20.947 4.855
605 HB2 SER 76 2HB SER 76 1.441 -19.464 2.488
606 HB3 SER 76 1HB SER 76 0.220 -20.738 2.398
607 HG SER 76 HG SER 76 -0.652 -18.600 2.271
608 H GLN 77 H GLN 77 0.997 -22.715 3.223
609 HA GLN 77 HA GLN 77 3.465 -23.844 4.126
610 HB2 GLN 77 2HB GLN 77 1.810 -24.698 1.708
611 HB3 GLN 77 1HB GLN 77 2.971 -25.680 2.586
612 HG2 GLN 77 2HG GLN 77 0.243 -24.765 3.532
613 HG3 GLN 77 1HG GLN 77 0.777 -26.414 3.201
614 HE21 GLN 77 1HE2 GLN 77 2.205 -27.421 4.704
615 HE22 GLN 77 2HE2 GLN 77 2.342 -26.857 6.331
616 H ASN 78 H ASN 78 2.433 -22.075 1.267
617 HA ASN 78 HA ASN 78 5.251 -21.788 0.391
618 HB2 ASN 78 2HB ASN 78 3.759 -22.723 -1.363
619 HB3 ASN 78 1HB ASN 78 2.680 -21.336 -1.207
620 HD21 ASN 78 1HD2 ASN 78 3.470 -19.262 -1.921
621 HD22 ASN 78 2HD2 ASN 78 4.753 -19.156 -3.074
622 HA PRO 79 HA PRO 79 4.535 -17.528 2.033
623 HB2 PRO 79 2HB PRO 79 7.461 -17.217 1.531
624 HB3 PRO 79 1HB PRO 79 6.562 -17.064 3.055
625 HG2 PRO 79 2HG PRO 79 8.196 -19.144 2.626
626 HG3 PRO 79 1HG PRO 79 6.672 -19.346 3.525
627 HD2 PRO 79 2HD PRO 79 7.251 -19.970 0.619
628 HD3 PRO 79 1HD PRO 79 6.432 -20.974 1.844
629 H LEU 80 H LEU 80 4.163 -15.649 0.899
630 HA LEU 80 HA LEU 80 3.971 -16.011 -1.954
631 HB2 LEU 80 2HB LEU 80 2.976 -13.748 -0.182
632 HB3 LEU 80 1HB LEU 80 2.502 -14.020 -1.852
633 HG LEU 80 HG LEU 80 1.908 -15.898 0.471
634 HD11 LEU 80 1HD1 LEU 80 -0.428 -15.225 0.234
635 HD12 LEU 80 2HD1 LEU 80 0.015 -14.059 -1.015
636 HD13 LEU 80 3HD1 LEU 80 0.596 -13.849 0.637
637 HD21 LEU 80 3HD2 LEU 80 0.469 -17.120 -1.105
638 HD22 LEU 80 1HD2 LEU 80 2.164 -17.158 -1.588
639 HD23 LEU 80 2HD2 LEU 80 1.034 -16.090 -2.424
640 H LYS 81 H LYS 81 5.913 -15.699 -2.969
641 HA LYS 81 HA LYS 81 7.532 -13.320 -2.566
642 HB2 LYS 81 2HB LYS 81 7.724 -15.513 -4.676
643 HB3 LYS 81 1HB LYS 81 8.848 -14.166 -4.540
644 HG2 LYS 81 2HG LYS 81 9.323 -15.001 -2.159
645 HG3 LYS 81 1HG LYS 81 8.451 -16.463 -2.621
646 HD2 LYS 81 2HD LYS 81 10.866 -16.785 -2.898
647 HD3 LYS 81 1HD LYS 81 10.063 -16.846 -4.466
648 HE2 LYS 81 2HE LYS 81 10.784 -14.566 -4.955
649 HE3 LYS 81 1HE LYS 81 11.496 -14.411 -3.350
650 HZ1 LYS 81 3HZ LYS 81 12.384 -16.349 -5.424
651 HZ2 LYS 81 1HZ LYS 81 13.084 -16.119 -3.906
652 HZ3 LYS 81 2HZ LYS 81 13.158 -14.888 -5.063
653 H ILE 82 H ILE 82 6.009 -11.649 -3.041
654 HA ILE 82 HA ILE 82 5.046 -11.285 -5.725
655 HB ILE 82 HB ILE 82 4.582 -8.924 -5.044
656 HG12 ILE 82 2HG1 ILE 82 5.648 -9.702 -2.288
657 HG13 ILE 82 1HG1 ILE 82 6.513 -8.684 -3.432
658 HG21 ILE 82 1HG2 ILE 82 3.549 -11.008 -3.093
659 HG22 ILE 82 2HG2 ILE 82 2.889 -10.662 -4.692
660 HG23 ILE 82 3HG2 ILE 82 2.797 -9.443 -3.420
661 HD11 ILE 82 3HD1 ILE 82 5.449 -7.345 -1.732
662 HD12 ILE 82 1HD1 ILE 82 3.872 -8.030 -2.128
663 HD13 ILE 82 2HD1 ILE 82 4.718 -7.019 -3.302
664 H ARG 83 H ARG 83 5.996 -10.190 -7.383
665 HA ARG 83 HA ARG 83 8.792 -9.231 -7.082
666 HB2 ARG 83 2HB ARG 83 8.955 -9.637 -9.563
667 HB3 ARG 83 1HB ARG 83 8.638 -11.099 -8.641
668 HG2 ARG 83 2HG ARG 83 6.289 -11.073 -9.314
669 HG3 ARG 83 1HG ARG 83 6.517 -9.527 -10.133
670 HD2 ARG 83 2HD ARG 83 7.949 -12.094 -10.913
671 HD3 ARG 83 1HD ARG 83 6.473 -11.497 -11.681
672 HE ARG 83 HE ARG 83 8.124 -9.384 -11.899
673 HH11 ARG 83 1HH1 ARG 83 8.601 -12.780 -12.798
674 HH12 ARG 83 2HH1 ARG 83 9.688 -12.396 -14.100
675 HH21 ARG 83 1HH2 ARG 83 9.530 -8.901 -13.619
676 HH22 ARG 83 2HH2 ARG 83 10.211 -10.196 -14.560
677 H LEU 84 H LEU 84 6.547 -7.660 -6.303
678 HA LEU 84 HA LEU 84 5.728 -5.877 -8.441
679 HB2 LEU 84 2HB LEU 84 5.091 -5.837 -5.457
680 HB3 LEU 84 1HB LEU 84 4.277 -4.876 -6.682
681 HG LEU 84 HG LEU 84 4.210 -7.919 -6.504
682 HD11 LEU 84 1HD1 LEU 84 2.926 -6.945 -4.682
683 HD12 LEU 84 2HD1 LEU 84 1.848 -7.691 -5.858
684 HD13 LEU 84 3HD1 LEU 84 2.026 -5.936 -5.813
685 HD21 LEU 84 3HD2 LEU 84 2.748 -6.073 -8.405
686 HD22 LEU 84 1HD2 LEU 84 2.494 -7.814 -8.263
687 HD23 LEU 84 2HD2 LEU 84 4.048 -7.194 -8.813
688 H THR 85 H THR 85 8.053 -5.317 -8.785
689 HA THR 85 HA THR 85 8.996 -3.064 -7.114
690 HB THR 85 HB THR 85 11.280 -3.585 -8.093
691 HG1 THR 85 HG1 THR 85 11.495 -5.717 -9.049
692 HG21 THR 85 3HG2 THR 85 10.719 -4.455 -5.852
693 HG22 THR 85 1HG2 THR 85 11.751 -5.583 -6.733
694 HG23 THR 85 2HG2 THR 85 10.022 -5.905 -6.580
695 H ARG 86 H ARG 86 7.476 -1.715 -8.343
696 HA ARG 86 HA ARG 86 7.846 -1.486 -11.248
697 HB2 ARG 86 2HB ARG 86 5.534 -1.557 -10.264
698 HB3 ARG 86 1HB ARG 86 5.858 -0.041 -9.427
699 HG2 ARG 86 2HG ARG 86 6.286 1.000 -11.718
700 HG3 ARG 86 1HG ARG 86 5.675 -0.496 -12.419
701 HD2 ARG 86 2HD ARG 86 3.517 -0.128 -11.222
702 HD3 ARG 86 1HD ARG 86 4.144 1.410 -10.622
703 HE ARG 86 HE ARG 86 3.501 0.751 -13.424
704 HH11 ARG 86 1HH1 ARG 86 4.288 3.199 -11.031
705 HH12 ARG 86 2HH1 ARG 86 3.895 4.515 -12.089
706 HH21 ARG 86 1HH2 ARG 86 3.027 2.468 -14.806
707 HH22 ARG 86 2HH2 ARG 86 3.178 4.104 -14.235
708 H GLU 87 H GLU 87 8.316 0.388 -8.296
709 HA GLU 87 HA GLU 87 8.638 2.937 -9.630
710 HB2 GLU 87 2HB GLU 87 7.460 2.704 -7.462
711 HB3 GLU 87 1HB GLU 87 8.945 2.168 -6.690
712 HG2 GLU 87 2HG GLU 87 9.951 4.352 -6.948
713 HG3 GLU 87 1HG GLU 87 8.621 4.902 -7.969
714 H ALA 88 H ALA 88 10.417 2.028 -10.914
715 HA ALA 88 HA ALA 88 12.736 3.486 -10.417
716 HB1 ALA 88 3HB ALA 88 13.403 1.642 -8.887
717 HB2 ALA 88 1HB ALA 88 14.457 1.687 -10.303
718 HB3 ALA 88 2HB ALA 88 13.183 0.472 -10.185
719 HA PRO 89 HA PRO 89 11.304 1.960 -14.697
720 HB2 PRO 89 2HB PRO 89 10.792 4.833 -15.344
721 HB3 PRO 89 1HB PRO 89 9.700 3.440 -15.474
722 HG2 PRO 89 2HG PRO 89 9.328 5.316 -13.601
723 HG3 PRO 89 1HG PRO 89 8.997 3.597 -13.263
724 HD2 PRO 89 2HD PRO 89 11.459 5.213 -12.550
725 HD3 PRO 89 1HD PRO 89 10.493 4.127 -11.520
Start of MODEL 19
1 H1 HIS 1 1H HIS 1 12.748 -21.970 -7.302
2 H2 HIS 1 2H HIS 1 11.718 -23.259 -6.954
3 H3 HIS 1 3H HIS 1 11.270 -21.687 -6.539
4 HA HIS 1 HA HIS 1 11.665 -22.675 -9.296
5 HB2 HIS 1 2HB HIS 1 9.656 -23.625 -8.088
6 HB3 HIS 1 1HB HIS 1 9.079 -21.988 -7.829
7 HD1 HIS 1 HD1 HIS 1 8.847 -24.771 -10.142
8 HD2 HIS 1 HD2 HIS 1 8.324 -20.660 -10.378
9 HE1 HIS 1 HE1 HIS 1 7.398 -24.388 -12.152
10 HE2 HIS 1 HE2 HIS 1 7.186 -21.893 -12.336
11 H HIS 2 H HIS 2 11.476 -21.069 -10.875
12 HA HIS 2 HA HIS 2 12.310 -18.452 -10.131
13 HB2 HIS 2 2HB HIS 2 11.409 -19.562 -12.825
14 HB3 HIS 2 1HB HIS 2 12.037 -17.927 -12.617
15 HD1 HIS 2 HD1 HIS 2 14.566 -17.673 -12.160
16 HD2 HIS 2 HD2 HIS 2 13.355 -21.602 -12.756
17 HE1 HIS 2 HE1 HIS 2 16.676 -18.994 -12.460
18 HE2 HIS 2 HE2 HIS 2 15.904 -21.314 -13.024
19 H HIS 3 H HIS 3 11.279 -16.477 -10.241
20 HA HIS 3 HA HIS 3 9.667 -14.899 -10.057
21 HB2 HIS 3 2HB HIS 3 8.018 -16.794 -11.776
22 HB3 HIS 3 1HB HIS 3 7.539 -15.147 -11.386
23 HD1 HIS 3 HD1 HIS 3 8.190 -13.441 -13.097
24 HD2 HIS 3 HD2 HIS 3 10.605 -16.822 -13.320
25 HE1 HIS 3 HE1 HIS 3 9.654 -13.107 -15.110
26 HE2 HIS 3 HE2 HIS 3 11.227 -15.055 -15.094
27 H HIS 4 H HIS 4 9.819 -17.304 -8.181
28 HA HIS 4 HA HIS 4 7.401 -16.693 -6.616
29 HB2 HIS 4 2HB HIS 4 8.285 -19.511 -7.426
30 HB3 HIS 4 1HB HIS 4 7.172 -19.197 -6.097
31 HD1 HIS 4 HD1 HIS 4 7.379 -19.214 -9.834
32 HD2 HIS 4 HD2 HIS 4 4.562 -18.468 -6.875
33 HE1 HIS 4 HE1 HIS 4 5.175 -19.121 -11.017
34 HE2 HIS 4 HE2 HIS 4 3.543 -18.420 -9.247
35 H HIS 5 H HIS 5 10.050 -15.774 -6.300
36 HA HIS 5 HA HIS 5 11.616 -17.399 -4.556
37 HB2 HIS 5 2HB HIS 5 12.615 -15.675 -6.005
38 HB3 HIS 5 1HB HIS 5 11.763 -14.416 -5.126
39 HD1 HIS 5 HD1 HIS 5 14.742 -16.676 -4.915
40 HD2 HIS 5 HD2 HIS 5 12.960 -13.691 -2.634
41 HE1 HIS 5 HE1 HIS 5 16.439 -16.038 -3.179
42 HE2 HIS 5 HE2 HIS 5 15.290 -14.337 -1.735
43 H HIS 6 H HIS 6 9.907 -14.291 -3.817
44 HA HIS 6 HA HIS 6 9.029 -15.227 -1.220
45 HB2 HIS 6 2HB HIS 6 11.420 -14.794 -0.747
46 HB3 HIS 6 1HB HIS 6 11.261 -13.155 -1.365
47 HD1 HIS 6 HD1 HIS 6 11.167 -11.514 0.485
48 HD2 HIS 6 HD2 HIS 6 9.391 -15.112 1.564
49 HE1 HIS 6 HE1 HIS 6 10.446 -11.218 2.868
50 HE2 HIS 6 HE2 HIS 6 9.568 -13.468 3.546
51 H SER 7 H SER 7 7.120 -14.284 -0.931
52 HA SER 7 HA SER 7 6.316 -11.775 -2.138
53 HB2 SER 7 2HB SER 7 4.843 -13.535 -0.120
54 HB3 SER 7 1HB SER 7 4.124 -12.279 -1.133
55 HG SER 7 HG SER 7 5.117 -13.684 -2.920
56 H HIS 8 H HIS 8 4.966 -10.277 -0.442
57 HA HIS 8 HA HIS 8 6.923 -9.258 1.471
58 HB2 HIS 8 2HB HIS 8 4.103 -8.209 0.942
59 HB3 HIS 8 1HB HIS 8 5.384 -7.369 1.803
60 HD1 HIS 8 HD1 HIS 8 5.677 -5.384 0.328
61 HD2 HIS 8 HD2 HIS 8 5.718 -8.916 -1.853
62 HE1 HIS 8 HE1 HIS 8 6.160 -4.715 -2.034
63 HE2 HIS 8 HE2 HIS 8 6.417 -6.880 -3.277
64 H MET 9 H MET 9 6.547 -9.079 3.750
65 HA MET 9 HA MET 9 4.780 -11.150 4.865
66 HB2 MET 9 2HB MET 9 6.044 -10.880 6.927
67 HB3 MET 9 1HB MET 9 7.157 -11.079 5.584
68 HG2 MET 9 2HG MET 9 7.746 -8.751 5.616
69 HG3 MET 9 1HG MET 9 6.454 -8.380 6.760
70 HE1 MET 9 3HE MET 9 6.658 -10.785 8.886
71 HE2 MET 9 1HE MET 9 6.458 -9.080 9.308
72 HE3 MET 9 2HE MET 9 7.735 -10.033 10.059
73 H VAL 10 H VAL 10 3.796 -10.547 7.091
74 HA VAL 10 HA VAL 10 1.936 -8.426 6.836
75 HB VAL 10 HB VAL 10 1.241 -8.926 9.144
76 HG11 VAL 10 1HG1 VAL 10 1.840 -11.451 7.572
77 HG12 VAL 10 2HG1 VAL 10 0.419 -10.419 7.410
78 HG13 VAL 10 3HG1 VAL 10 0.682 -11.323 8.898
79 HG21 VAL 10 3HG2 VAL 10 3.685 -10.736 9.338
80 HG22 VAL 10 1HG2 VAL 10 2.400 -10.608 10.542
81 HG23 VAL 10 2HG2 VAL 10 3.443 -9.224 10.215
82 H GLY 11 H GLY 11 1.995 -6.312 7.523
83 HA2 GLY 11 2HA GLY 11 2.595 -4.470 8.831
84 HA3 GLY 11 1HA GLY 11 3.857 -5.421 9.597
85 H ASP 12 H ASP 12 3.991 -5.646 6.184
86 HA ASP 12 HA ASP 12 6.524 -4.333 6.026
87 HB2 ASP 12 2HB ASP 12 5.752 -6.215 4.514
88 HB3 ASP 12 1HB ASP 12 4.650 -5.090 3.727
89 H THR 13 H THR 13 6.734 -2.129 6.212
90 HA THR 13 HA THR 13 4.413 -0.448 6.116
91 HB THR 13 HB THR 13 7.332 0.350 6.511
92 HG1 THR 13 HG1 THR 13 5.855 -1.137 8.045
93 HG21 THR 13 3HG2 THR 13 5.943 2.311 5.910
94 HG22 THR 13 1HG2 THR 13 6.379 2.382 7.619
95 HG23 THR 13 2HG2 THR 13 4.759 1.873 7.143
96 H VAL 14 H VAL 14 3.658 0.670 4.491
97 HA VAL 14 HA VAL 14 5.291 1.511 2.195
98 HB VAL 14 HB VAL 14 3.524 0.725 0.616
99 HG11 VAL 14 1HG1 VAL 14 4.680 -1.550 2.274
100 HG12 VAL 14 2HG1 VAL 14 5.479 -0.720 0.938
101 HG13 VAL 14 3HG1 VAL 14 4.038 -1.685 0.631
102 HG21 VAL 14 3HG2 VAL 14 1.595 0.704 2.152
103 HG22 VAL 14 1HG2 VAL 14 2.278 -0.665 3.032
104 HG23 VAL 14 2HG2 VAL 14 1.763 -0.855 1.354
105 H TRP 15 H TRP 15 3.696 2.816 0.691
106 HA TRP 15 HA TRP 15 1.722 4.412 2.216
107 HB2 TRP 15 2HB TRP 15 3.545 5.296 -0.075
108 HB3 TRP 15 1HB TRP 15 2.213 6.260 0.558
109 HD1 TRP 15 HD1 TRP 15 3.024 5.613 3.734
110 HE1 TRP 15 HE1 TRP 15 4.985 6.968 4.704
111 HE3 TRP 15 HE3 TRP 15 5.291 7.023 -0.625
112 HZ2 TRP 15 HZ2 TRP 15 7.188 8.439 3.756
113 HZ3 TRP 15 HZ3 TRP 15 7.317 8.411 -0.510
114 HH2 TRP 15 HH2 TRP 15 8.248 9.106 1.637
115 H VAL 16 H VAL 16 -0.160 5.032 0.937
116 HA VAL 16 HA VAL 16 -0.491 3.465 -1.567
117 HB VAL 16 HB VAL 16 -2.748 4.632 0.137
118 HG11 VAL 16 1HG1 VAL 16 -2.819 2.823 -2.319
119 HG12 VAL 16 2HG1 VAL 16 -3.330 4.510 -2.257
120 HG13 VAL 16 3HG1 VAL 16 -4.225 3.284 -1.358
121 HG21 VAL 16 3HG2 VAL 16 -3.267 2.278 0.733
122 HG22 VAL 16 1HG2 VAL 16 -1.666 2.754 1.309
123 HG23 VAL 16 2HG2 VAL 16 -1.823 1.744 -0.129
124 H ARG 17 H ARG 17 0.350 4.756 -3.018
125 HA ARG 17 HA ARG 17 -0.135 7.545 -3.367
126 HB2 ARG 17 2HB ARG 17 1.896 6.459 -4.198
127 HB3 ARG 17 1HB ARG 17 0.956 5.379 -5.221
128 HG2 ARG 17 2HG ARG 17 0.264 7.281 -6.617
129 HG3 ARG 17 1HG ARG 17 1.147 8.391 -5.565
130 HD2 ARG 17 2HD ARG 17 2.421 7.878 -7.607
131 HD3 ARG 17 1HD ARG 17 3.266 7.318 -6.165
132 HE ARG 17 HE ARG 17 1.738 5.197 -7.219
133 HH11 ARG 17 1HH1 ARG 17 4.615 7.060 -8.041
134 HH12 ARG 17 2HH1 ARG 17 5.344 5.770 -8.947
135 HH21 ARG 17 1HH2 ARG 17 2.704 3.508 -8.408
136 HH22 ARG 17 2HH2 ARG 17 4.252 3.747 -9.156
137 H ARG 18 H ARG 18 -2.313 7.872 -3.360
138 HA ARG 18 HA ARG 18 -4.061 6.655 -5.398
139 HB2 ARG 18 2HB ARG 18 -4.855 6.738 -3.066
140 HB3 ARG 18 1HB ARG 18 -4.622 8.480 -3.003
141 HG2 ARG 18 2HG ARG 18 -6.457 8.859 -4.514
142 HG3 ARG 18 1HG ARG 18 -6.584 7.143 -4.899
143 HD2 ARG 18 2HD ARG 18 -7.068 8.252 -2.117
144 HD3 ARG 18 1HD ARG 18 -8.346 8.065 -3.315
145 HE ARG 18 HE ARG 18 -7.084 5.983 -1.759
146 HH11 ARG 18 1HH1 ARG 18 -8.933 6.611 -4.699
147 HH12 ARG 18 2HH1 ARG 18 -9.535 4.982 -4.796
148 HH21 ARG 18 1HH2 ARG 18 -7.887 3.867 -1.921
149 HH22 ARG 18 2HH2 ARG 18 -8.942 3.440 -3.230
150 H HIS 19 H HIS 19 -5.588 8.297 -6.472
151 HA HIS 19 HA HIS 19 -6.134 10.080 -7.713
152 HB2 HIS 19 2HB HIS 19 -5.259 11.598 -5.950
153 HB3 HIS 19 1HB HIS 19 -3.653 11.496 -6.651
154 HD1 HIS 19 HD1 HIS 19 -3.144 13.631 -7.811
155 HD2 HIS 19 HD2 HIS 19 -7.128 12.575 -8.285
156 HE1 HIS 19 HE1 HIS 19 -4.153 15.451 -9.211
157 HE2 HIS 19 HE2 HIS 19 -6.603 14.897 -9.290
158 H GLN 20 H GLN 20 -6.019 9.811 -9.821
159 HA GLN 20 HA GLN 20 -3.820 8.363 -10.950
160 HB2 GLN 20 2HB GLN 20 -6.292 9.428 -12.363
161 HB3 GLN 20 1HB GLN 20 -5.187 8.204 -12.976
162 HG2 GLN 20 2HG GLN 20 -7.057 7.930 -10.606
163 HG3 GLN 20 1HG GLN 20 -7.203 7.132 -12.173
164 HE21 GLN 20 1HE2 GLN 20 -5.868 5.334 -12.606
165 HE22 GLN 20 2HE2 GLN 20 -4.949 4.547 -11.376
166 H THR 21 H THR 21 -2.044 9.277 -11.678
167 HA THR 21 HA THR 21 -1.826 12.099 -12.199
168 HB THR 21 HB THR 21 -0.022 11.099 -10.990
169 HG1 THR 21 HG1 THR 21 0.760 12.688 -12.287
170 HG21 THR 21 3HG2 THR 21 1.457 9.342 -11.856
171 HG22 THR 21 1HG2 THR 21 0.493 9.227 -13.329
172 HG23 THR 21 2HG2 THR 21 -0.205 8.752 -11.778
173 H LYS 22 H LYS 22 -2.988 12.575 -14.027
174 HA LYS 22 HA LYS 22 -2.133 11.401 -16.620
175 HB2 LYS 22 2HB LYS 22 -4.653 12.981 -15.939
176 HB3 LYS 22 1HB LYS 22 -4.263 12.301 -17.520
177 HG2 LYS 22 2HG LYS 22 -4.312 10.015 -16.518
178 HG3 LYS 22 1HG LYS 22 -4.800 10.730 -14.977
179 HD2 LYS 22 2HD LYS 22 -6.863 11.607 -16.027
180 HD3 LYS 22 1HD LYS 22 -6.364 10.935 -17.584
181 HE2 LYS 22 2HE LYS 22 -6.431 8.652 -16.567
182 HE3 LYS 22 1HE LYS 22 -7.052 9.367 -15.076
183 HZ1 LYS 22 3HZ LYS 22 -8.975 10.163 -16.295
184 HZ2 LYS 22 1HZ LYS 22 -8.824 8.491 -16.477
185 HZ3 LYS 22 2HZ LYS 22 -8.375 9.521 -17.735
186 H ASN 23 H ASN 23 -3.138 14.509 -15.191
187 HA ASN 23 HA ASN 23 -1.020 15.956 -16.694
188 HB2 ASN 23 2HB ASN 23 -3.874 16.944 -16.180
189 HB3 ASN 23 1HB ASN 23 -2.587 17.907 -16.896
190 HD21 ASN 23 1HD2 ASN 23 -1.901 17.430 -19.030
191 HD22 ASN 23 2HD2 ASN 23 -2.888 16.510 -20.114
192 H LEU 24 H LEU 24 -2.101 14.957 -13.787
193 HA LEU 24 HA LEU 24 -1.175 17.308 -12.245
194 HB2 LEU 24 2HB LEU 24 -3.511 15.473 -11.535
195 HB3 LEU 24 1HB LEU 24 -2.933 16.822 -10.573
196 HG LEU 24 HG LEU 24 -4.248 17.045 -13.309
197 HD11 LEU 24 1HD1 LEU 24 -5.346 17.739 -10.566
198 HD12 LEU 24 2HD1 LEU 24 -5.857 16.398 -11.593
199 HD13 LEU 24 3HD1 LEU 24 -6.144 18.057 -12.110
200 HD21 LEU 24 3HD2 LEU 24 -2.619 18.835 -13.013
201 HD22 LEU 24 1HD2 LEU 24 -3.308 19.246 -11.441
202 HD23 LEU 24 2HD2 LEU 24 -4.252 19.489 -12.913
203 H GLU 25 H GLU 25 -0.504 16.683 -10.003
204 HA GLU 25 HA GLU 25 1.322 14.443 -10.077
205 HB2 GLU 25 2HB GLU 25 0.664 16.388 -7.812
206 HB3 GLU 25 1HB GLU 25 2.034 15.280 -7.846
207 HG2 GLU 25 2HG GLU 25 3.012 16.489 -9.736
208 HG3 GLU 25 1HG GLU 25 1.608 17.556 -9.806
209 HA PRO 26 HA PRO 26 -1.431 11.678 -7.711
210 HB2 PRO 26 2HB PRO 26 0.202 9.554 -7.393
211 HB3 PRO 26 1HB PRO 26 -0.339 10.036 -9.013
212 HG2 PRO 26 2HG PRO 26 2.303 10.539 -7.693
213 HG3 PRO 26 1HG PRO 26 1.957 10.072 -9.373
214 HD2 PRO 26 2HD PRO 26 2.451 12.695 -8.521
215 HD3 PRO 26 1HD PRO 26 1.634 12.254 -10.036
216 H ARG 27 H ARG 27 -1.905 11.429 -5.542
217 HA ARG 27 HA ARG 27 0.013 12.561 -3.605
218 HB2 ARG 27 2HB ARG 27 -2.251 13.594 -3.751
219 HB3 ARG 27 1HB ARG 27 -2.975 12.058 -3.289
220 HG2 ARG 27 2HG ARG 27 -1.853 12.162 -1.096
221 HG3 ARG 27 1HG ARG 27 -1.066 13.671 -1.556
222 HD2 ARG 27 2HD ARG 27 -3.342 14.732 -1.751
223 HD3 ARG 27 1HD ARG 27 -4.047 13.227 -1.156
224 HE ARG 27 HE ARG 27 -2.782 13.581 0.928
225 HH11 ARG 27 1HH1 ARG 27 -3.379 16.394 -1.089
226 HH12 ARG 27 2HH1 ARG 27 -3.227 17.521 0.220
227 HH21 ARG 27 1HH2 ARG 27 -2.563 15.054 2.631
228 HH22 ARG 27 2HH2 ARG 27 -2.762 16.754 2.340
229 H TRP 28 H TRP 28 1.305 10.959 -2.848
230 HA TRP 28 HA TRP 28 0.336 8.401 -1.972
231 HB2 TRP 28 2HB TRP 28 2.549 8.161 -0.835
232 HB3 TRP 28 1HB TRP 28 2.700 8.585 -2.536
233 HD1 TRP 28 HD1 TRP 28 3.808 10.936 -3.120
234 HE1 TRP 28 HE1 TRP 28 5.185 12.608 -1.751
235 HE3 TRP 28 HE3 TRP 28 2.790 9.199 1.596
236 HZ2 TRP 28 HZ2 TRP 28 5.792 13.126 0.939
237 HZ3 TRP 28 HZ3 TRP 28 3.820 10.344 3.518
238 HH2 TRP 28 HH2 TRP 28 5.294 12.269 3.194
239 H LYS 29 H LYS 29 -0.372 7.805 0.017
240 HA LYS 29 HA LYS 29 -0.458 9.805 2.219
241 HB2 LYS 29 2HB LYS 29 -2.502 7.662 1.472
242 HB3 LYS 29 1HB LYS 29 -2.537 8.559 2.986
243 HG2 LYS 29 2HG LYS 29 -2.869 10.671 1.763
244 HG3 LYS 29 1HG LYS 29 -2.777 9.802 0.227
245 HD2 LYS 29 2HD LYS 29 -5.127 10.273 0.845
246 HD3 LYS 29 1HD LYS 29 -4.818 8.536 0.796
247 HE2 LYS 29 2HE LYS 29 -4.593 8.534 3.280
248 HE3 LYS 29 1HE LYS 29 -4.962 10.258 3.296
249 HZ1 LYS 29 3HZ LYS 29 -6.905 8.915 3.800
250 HZ2 LYS 29 1HZ LYS 29 -6.783 8.131 2.306
251 HZ3 LYS 29 2HZ LYS 29 -7.126 9.781 2.370
252 H GLY 30 H GLY 30 0.001 9.009 4.301
253 HA2 GLY 30 2HA GLY 30 0.570 6.211 4.773
254 HA3 GLY 30 1HA GLY 30 1.997 7.217 4.688
255 HA PRO 31 HA PRO 31 2.482 5.522 6.233
256 HB2 PRO 31 2HB PRO 31 2.917 4.243 8.574
257 HB3 PRO 31 1HB PRO 31 3.663 5.818 8.239
258 HG2 PRO 31 2HG PRO 31 1.267 5.203 9.928
259 HG3 PRO 31 1HG PRO 31 2.594 6.343 10.230
260 HD2 PRO 31 2HD PRO 31 0.101 7.069 9.202
261 HD3 PRO 31 1HD PRO 31 1.588 8.025 9.028
262 H TYR 32 H TYR 32 1.955 3.557 5.452
263 HA TYR 32 HA TYR 32 -0.372 2.045 6.507
264 HB2 TYR 32 2HB TYR 32 0.581 2.436 3.644
265 HB3 TYR 32 1HB TYR 32 -0.519 1.146 4.093
266 HD1 TYR 32 HD2 TYR 32 -0.193 4.807 3.677
267 HD2 TYR 32 HD1 TYR 32 -2.852 1.615 4.622
268 HE1 TYR 32 HE2 TYR 32 -2.112 6.316 3.429
269 HE2 TYR 32 HE1 TYR 32 -4.769 3.122 4.376
270 HH TYR 32 HH TYR 32 -4.492 6.224 2.982
271 H THR 33 H THR 33 -0.175 -0.354 5.838
272 HA THR 33 HA THR 33 2.556 -1.410 5.706
273 HB THR 33 HB THR 33 1.978 -2.961 7.750
274 HG1 THR 33 HG1 THR 33 -0.131 -2.436 8.114
275 HG21 THR 33 3HG2 THR 33 2.565 -0.048 8.348
276 HG22 THR 33 1HG2 THR 33 3.765 -1.276 7.945
277 HG23 THR 33 2HG2 THR 33 2.841 -1.402 9.444
278 H VAL 34 H VAL 34 2.291 -2.849 3.995
279 HA VAL 34 HA VAL 34 -0.008 -4.324 3.357
280 HB VAL 34 HB VAL 34 2.895 -5.150 2.848
281 HG11 VAL 34 1HG1 VAL 34 0.358 -6.083 1.447
282 HG12 VAL 34 2HG1 VAL 34 1.362 -7.050 2.530
283 HG13 VAL 34 3HG1 VAL 34 2.009 -6.509 0.980
284 HG21 VAL 34 3HG2 VAL 34 2.440 -2.935 1.912
285 HG22 VAL 34 1HG2 VAL 34 1.014 -3.555 1.075
286 HG23 VAL 34 2HG2 VAL 34 2.623 -4.122 0.619
287 H LEU 35 H LEU 35 -0.998 -5.852 4.470
288 HA LEU 35 HA LEU 35 0.376 -7.428 6.556
289 HB2 LEU 35 2HB LEU 35 -2.589 -7.133 5.917
290 HB3 LEU 35 1HB LEU 35 -1.925 -8.044 7.267
291 HG LEU 35 HG LEU 35 -1.659 -5.032 6.910
292 HD11 LEU 35 1HD1 LEU 35 -3.257 -4.835 8.760
293 HD12 LEU 35 2HD1 LEU 35 -3.461 -6.589 8.789
294 HD13 LEU 35 3HD1 LEU 35 -3.975 -5.661 7.378
295 HD21 LEU 35 3HD2 LEU 35 -0.865 -6.786 9.258
296 HD22 LEU 35 1HD2 LEU 35 -0.800 -5.022 9.215
297 HD23 LEU 35 2HD2 LEU 35 0.235 -5.965 8.149
298 H LEU 36 H LEU 36 -1.492 -7.739 3.566
299 HA LEU 36 HA LEU 36 -0.712 -10.584 3.318
300 HB2 LEU 36 2HB LEU 36 -2.995 -10.660 4.061
301 HB3 LEU 36 1HB LEU 36 -3.471 -9.385 2.975
302 HG LEU 36 HG LEU 36 -3.066 -10.953 1.028
303 HD11 LEU 36 1HD1 LEU 36 -2.738 -13.042 3.194
304 HD12 LEU 36 2HD1 LEU 36 -1.486 -12.475 2.083
305 HD13 LEU 36 3HD1 LEU 36 -2.880 -13.354 1.462
306 HD21 LEU 36 3HD2 LEU 36 -5.329 -10.572 1.882
307 HD22 LEU 36 1HD2 LEU 36 -5.127 -11.874 3.057
308 HD23 LEU 36 2HD2 LEU 36 -5.138 -12.232 1.327
309 H THR 37 H THR 37 -0.248 -11.252 1.283
310 HA THR 37 HA THR 37 -0.320 -9.307 -0.952
311 HB THR 37 HB THR 37 1.577 -10.677 -1.914
312 HG1 THR 37 HG1 THR 37 1.005 -12.531 -0.421
313 HG21 THR 37 3HG2 THR 37 3.333 -9.810 -0.447
314 HG22 THR 37 1HG2 THR 37 2.155 -9.549 0.841
315 HG23 THR 37 2HG2 THR 37 2.060 -8.607 -0.644
316 H THR 38 H THR 38 -1.390 -9.918 -2.754
317 HA THR 38 HA THR 38 -1.648 -12.759 -3.476
318 HB THR 38 HB THR 38 -3.939 -12.282 -4.487
319 HG1 THR 38 HG1 THR 38 -3.635 -9.883 -3.011
320 HG21 THR 38 3HG2 THR 38 -3.873 -13.513 -2.361
321 HG22 THR 38 1HG2 THR 38 -5.262 -12.424 -2.395
322 HG23 THR 38 2HG2 THR 38 -3.825 -11.992 -1.464
323 HA PRO 39 HA PRO 39 0.128 -11.525 -7.390
324 HB2 PRO 39 2HB PRO 39 -2.339 -12.667 -8.742
325 HB3 PRO 39 1HB PRO 39 -0.625 -12.938 -9.128
326 HG2 PRO 39 2HG PRO 39 -1.930 -14.810 -7.815
327 HG3 PRO 39 1HG PRO 39 -0.293 -14.362 -7.275
328 HD2 PRO 39 2HD PRO 39 -2.949 -13.593 -6.069
329 HD3 PRO 39 1HD PRO 39 -1.428 -14.041 -5.260
330 H THR 40 H THR 40 0.175 -9.364 -7.549
331 HA THR 40 HA THR 40 -0.077 -7.343 -8.500
332 HB THR 40 HB THR 40 -2.619 -8.255 -9.905
333 HG1 THR 40 HG1 THR 40 -1.410 -9.647 -10.925
334 HG21 THR 40 3HG2 THR 40 -0.438 -6.299 -10.753
335 HG22 THR 40 1HG2 THR 40 -2.035 -5.841 -10.153
336 HG23 THR 40 2HG2 THR 40 -1.882 -6.707 -11.682
337 H ALA 41 H ALA 41 -1.899 -8.459 -6.101
338 HA ALA 41 HA ALA 41 -3.177 -5.848 -5.563
339 HB1 ALA 41 3HB ALA 41 -4.958 -7.277 -6.505
340 HB2 ALA 41 1HB ALA 41 -5.253 -6.946 -4.797
341 HB3 ALA 41 2HB ALA 41 -4.623 -8.519 -5.295
342 H LEU 42 H LEU 42 -2.612 -5.185 -3.549
343 HA LEU 42 HA LEU 42 -1.596 -7.167 -1.593
344 HB2 LEU 42 2HB LEU 42 -0.825 -4.214 -1.827
345 HB3 LEU 42 1HB LEU 42 -0.159 -5.377 -0.690
346 HG LEU 42 HG LEU 42 0.247 -5.364 -3.707
347 HD11 LEU 42 1HD1 LEU 42 2.227 -4.912 -1.455
348 HD12 LEU 42 2HD1 LEU 42 1.588 -3.689 -2.554
349 HD13 LEU 42 3HD1 LEU 42 2.614 -4.976 -3.179
350 HD21 LEU 42 3HD2 LEU 42 0.091 -7.682 -2.982
351 HD22 LEU 42 1HD2 LEU 42 1.265 -7.394 -1.697
352 HD23 LEU 42 2HD2 LEU 42 1.759 -7.294 -3.390
353 H LYS 43 H LYS 43 -2.816 -7.382 0.186
354 HA LYS 43 HA LYS 43 -4.917 -5.485 0.868
355 HB2 LYS 43 2HB LYS 43 -5.373 -7.884 1.124
356 HB3 LYS 43 1HB LYS 43 -3.986 -8.061 2.180
357 HG2 LYS 43 2HG LYS 43 -5.073 -6.699 3.910
358 HG3 LYS 43 1HG LYS 43 -6.455 -6.422 2.845
359 HD2 LYS 43 2HD LYS 43 -6.899 -8.890 2.857
360 HD3 LYS 43 1HD LYS 43 -5.575 -9.096 4.007
361 HE2 LYS 43 2HE LYS 43 -8.090 -7.465 4.469
362 HE3 LYS 43 1HE LYS 43 -7.764 -9.062 5.137
363 HZ1 LYS 43 3HZ LYS 43 -5.881 -8.088 6.354
364 HZ2 LYS 43 1HZ LYS 43 -7.344 -7.344 6.756
365 HZ3 LYS 43 2HZ LYS 43 -6.260 -6.565 5.727
366 H VAL 44 H VAL 44 -4.309 -3.702 1.857
367 HA VAL 44 HA VAL 44 -1.906 -3.625 3.585
368 HB VAL 44 HB VAL 44 -3.281 -1.335 2.082
369 HG11 VAL 44 1HG1 VAL 44 -0.582 -1.442 3.453
370 HG12 VAL 44 2HG1 VAL 44 -2.010 -0.579 4.031
371 HG13 VAL 44 3HG1 VAL 44 -1.218 -0.076 2.536
372 HG21 VAL 44 3HG2 VAL 44 -1.422 -1.435 0.450
373 HG22 VAL 44 1HG2 VAL 44 -2.347 -2.940 0.457
374 HG23 VAL 44 2HG2 VAL 44 -0.779 -2.866 1.263
375 H ASP 45 H ASP 45 -2.079 -2.577 5.622
376 HA ASP 45 HA ASP 45 -4.574 -2.673 6.966
377 HB2 ASP 45 2HB ASP 45 -2.461 -3.075 8.150
378 HB3 ASP 45 1HB ASP 45 -1.922 -1.436 7.816
379 H GLY 46 H GLY 46 -5.923 -1.015 7.663
380 HA2 GLY 46 2HA GLY 46 -6.783 1.198 7.700
381 HA3 GLY 46 1HA GLY 46 -5.572 1.687 6.515
382 H ILE 47 H ILE 47 -5.915 -0.486 4.724
383 HA ILE 47 HA ILE 47 -8.189 0.439 3.203
384 HB ILE 47 HB ILE 47 -6.202 -1.793 2.579
385 HG12 ILE 47 2HG1 ILE 47 -4.964 0.290 2.920
386 HG13 ILE 47 1HG1 ILE 47 -4.980 -0.095 1.208
387 HG21 ILE 47 1HG2 ILE 47 -8.242 -1.928 1.198
388 HG22 ILE 47 2HG2 ILE 47 -6.836 -1.497 0.230
389 HG23 ILE 47 3HG2 ILE 47 -8.007 -0.256 0.674
390 HD11 ILE 47 3HD1 ILE 47 -5.258 2.273 1.574
391 HD12 ILE 47 1HD1 ILE 47 -6.681 1.987 2.575
392 HD13 ILE 47 2HD1 ILE 47 -6.719 1.599 0.853
393 H ALA 48 H ALA 48 -9.885 -0.936 2.426
394 HA ALA 48 HA ALA 48 -11.097 -2.492 4.437
395 HB1 ALA 48 3HB ALA 48 -12.359 -1.145 2.823
396 HB2 ALA 48 1HB ALA 48 -12.909 -2.819 2.825
397 HB3 ALA 48 2HB ALA 48 -11.876 -2.228 1.519
398 H ALA 49 H ALA 49 -9.694 -3.507 1.259
399 HA ALA 49 HA ALA 49 -9.279 -6.208 2.301
400 HB1 ALA 49 3HB ALA 49 -11.046 -5.775 -0.119
401 HB2 ALA 49 1HB ALA 49 -11.604 -6.266 1.481
402 HB3 ALA 49 2HB ALA 49 -10.547 -7.330 0.547
403 H TRP 50 H TRP 50 -9.053 -4.246 -0.777
404 HA TRP 50 HA TRP 50 -6.272 -5.204 -1.055
405 HB2 TRP 50 2HB TRP 50 -8.325 -5.537 -3.287
406 HB3 TRP 50 1HB TRP 50 -6.592 -5.661 -3.535
407 HD1 TRP 50 HD1 TRP 50 -5.355 -7.825 -2.315
408 HE1 TRP 50 HE1 TRP 50 -6.273 -10.184 -1.867
409 HE3 TRP 50 HE3 TRP 50 -10.366 -6.833 -2.667
410 HZ2 TRP 50 HZ2 TRP 50 -8.779 -11.462 -1.668
411 HZ3 TRP 50 HZ3 TRP 50 -11.959 -8.677 -2.334
412 HH2 TRP 50 HH2 TRP 50 -11.182 -10.943 -1.843
413 H ILE 51 H ILE 51 -4.905 -3.922 -2.260
414 HA ILE 51 HA ILE 51 -5.957 -1.623 -3.803
415 HB ILE 51 HB ILE 51 -3.438 -1.734 -2.061
416 HG12 ILE 51 2HG1 ILE 51 -5.508 -1.033 -0.886
417 HG13 ILE 51 1HG1 ILE 51 -4.331 0.267 -0.948
418 HG21 ILE 51 1HG2 ILE 51 -2.751 -0.746 -4.178
419 HG22 ILE 51 2HG2 ILE 51 -2.802 0.498 -2.933
420 HG23 ILE 51 3HG2 ILE 51 -4.100 0.397 -4.126
421 HD11 ILE 51 3HD1 ILE 51 -6.587 1.079 -1.306
422 HD12 ILE 51 1HD1 ILE 51 -6.782 0.008 -2.693
423 HD13 ILE 51 2HD1 ILE 51 -5.611 1.329 -2.754
424 H HIS 52 H HIS 52 -5.298 -1.749 -5.956
425 HA HIS 52 HA HIS 52 -3.731 -3.852 -7.023
426 HB2 HIS 52 2HB HIS 52 -5.376 -2.328 -8.273
427 HB3 HIS 52 1HB HIS 52 -4.130 -1.088 -8.258
428 HD1 HIS 52 HD1 HIS 52 -1.928 -1.659 -9.700
429 HD2 HIS 52 HD2 HIS 52 -5.222 -4.100 -10.341
430 HE1 HIS 52 HE1 HIS 52 -1.462 -2.867 -11.845
431 HE2 HIS 52 HE2 HIS 52 -3.569 -4.142 -12.319
432 H ALA 53 H ALA 53 -1.506 -4.066 -7.160
433 HA ALA 53 HA ALA 53 -0.006 -2.808 -5.177
434 HB1 ALA 53 3HB ALA 53 0.376 -5.118 -5.971
435 HB2 ALA 53 1HB ALA 53 1.871 -4.181 -5.910
436 HB3 ALA 53 2HB ALA 53 1.084 -4.490 -7.458
437 H ALA 54 H ALA 54 -0.359 -1.723 -8.442
438 HA ALA 54 HA ALA 54 2.057 -0.227 -8.688
439 HB1 ALA 54 3HB ALA 54 0.731 -0.928 -10.620
440 HB2 ALA 54 1HB ALA 54 0.970 0.820 -10.624
441 HB3 ALA 54 2HB ALA 54 -0.577 0.134 -10.118
442 H HIS 55 H HIS 55 -0.763 0.358 -6.848
443 HA HIS 55 HA HIS 55 -0.244 3.240 -6.490
444 HB2 HIS 55 2HB HIS 55 -2.375 1.428 -5.274
445 HB3 HIS 55 1HB HIS 55 -2.246 3.158 -4.990
446 HD1 HIS 55 HD1 HIS 55 -2.786 4.723 -7.029
447 HD2 HIS 55 HD2 HIS 55 -3.695 0.713 -7.596
448 HE1 HIS 55 HE1 HIS 55 -4.259 4.643 -9.046
449 HE2 HIS 55 HE2 HIS 55 -4.934 2.239 -9.266
450 H VAL 56 H VAL 56 0.991 0.403 -5.287
451 HA VAL 56 HA VAL 56 1.289 1.354 -2.508
452 HB VAL 56 HB VAL 56 1.991 -1.343 -3.781
453 HG11 VAL 56 1HG1 VAL 56 3.484 -0.853 -1.891
454 HG12 VAL 56 2HG1 VAL 56 2.363 -2.151 -1.487
455 HG13 VAL 56 3HG1 VAL 56 2.089 -0.528 -0.857
456 HG21 VAL 56 3HG2 VAL 56 0.066 -2.242 -2.535
457 HG22 VAL 56 1HG2 VAL 56 -0.448 -0.967 -3.644
458 HG23 VAL 56 2HG2 VAL 56 -0.309 -0.633 -1.916
459 H LYS 57 H LYS 57 3.156 2.254 -1.857
460 HA LYS 57 HA LYS 57 5.628 1.906 -3.470
461 HB2 LYS 57 2HB LYS 57 4.695 4.183 -3.784
462 HB3 LYS 57 1HB LYS 57 4.658 4.432 -2.041
463 HG2 LYS 57 2HG LYS 57 7.168 4.161 -2.015
464 HG3 LYS 57 1HG LYS 57 7.133 4.103 -3.779
465 HD2 LYS 57 2HD LYS 57 6.215 6.396 -3.844
466 HD3 LYS 57 1HD LYS 57 6.173 6.439 -2.080
467 HE2 LYS 57 2HE LYS 57 8.689 6.104 -2.108
468 HE3 LYS 57 1HE LYS 57 8.630 6.326 -3.857
469 HZ1 LYS 57 3HZ LYS 57 9.186 8.387 -2.824
470 HZ2 LYS 57 1HZ LYS 57 7.854 8.311 -1.790
471 HZ3 LYS 57 2HZ LYS 57 7.624 8.530 -3.441
472 H ALA 58 H ALA 58 7.191 0.940 -2.306
473 HA ALA 58 HA ALA 58 7.028 0.228 0.408
474 HB1 ALA 58 3HB ALA 58 8.406 -1.003 -1.222
475 HB2 ALA 58 1HB ALA 58 9.373 -0.513 0.171
476 HB3 ALA 58 2HB ALA 58 9.507 0.369 -1.354
477 H ALA 59 H ALA 59 7.445 1.328 2.247
478 HA ALA 59 HA ALA 59 8.956 3.893 2.144
479 HB1 ALA 59 3HB ALA 59 7.262 4.882 3.634
480 HB2 ALA 59 1HB ALA 59 6.332 3.378 3.603
481 HB3 ALA 59 2HB ALA 59 6.523 4.329 2.130
482 H ASP 60 H ASP 60 10.285 4.284 3.838
483 HA ASP 60 HA ASP 60 10.774 2.155 5.788
484 HB2 ASP 60 2HB ASP 60 12.625 3.056 4.387
485 HB3 ASP 60 1HB ASP 60 12.406 4.645 5.110
486 HA PRO 61 HA PRO 61 8.660 4.857 8.810
487 HB2 PRO 61 2HB PRO 61 8.117 3.015 10.689
488 HB3 PRO 61 1HB PRO 61 7.317 2.942 9.104
489 HG2 PRO 61 2HG PRO 61 9.637 1.333 10.112
490 HG3 PRO 61 1HG PRO 61 8.224 0.803 9.171
491 HD2 PRO 61 2HD PRO 61 10.724 1.391 8.073
492 HD3 PRO 61 1HD PRO 61 9.190 1.390 7.167
493 H GLY 62 H GLY 62 11.750 3.539 9.015
494 HA2 GLY 62 2HA GLY 62 13.576 4.018 10.340
495 HA3 GLY 62 1HA GLY 62 12.576 5.078 11.323
496 H GLY 63 H GLY 63 11.349 1.912 10.824
497 HA2 GLY 63 2HA GLY 63 12.640 0.387 12.783
498 HA3 GLY 63 1HA GLY 63 11.300 1.229 13.561
499 H GLY 64 H GLY 64 9.135 0.790 12.868
500 HA2 GLY 64 2HA GLY 64 8.334 -0.987 10.862
501 HA3 GLY 64 1HA GLY 64 8.619 -1.948 12.313
502 HA PRO 65 HA PRO 65 4.138 -0.426 12.473
503 HB2 PRO 65 2HB PRO 65 3.809 -3.224 13.529
504 HB3 PRO 65 1HB PRO 65 2.843 -2.356 12.317
505 HG2 PRO 65 2HG PRO 65 4.508 -4.307 11.578
506 HG3 PRO 65 1HG PRO 65 4.321 -2.849 10.575
507 HD2 PRO 65 2HD PRO 65 6.547 -3.554 12.486
508 HD3 PRO 65 1HD PRO 65 6.633 -2.814 10.868
509 H SER 66 H SER 66 4.242 0.919 14.180
510 HA SER 66 HA SER 66 5.269 0.161 16.786
511 HB2 SER 66 2HB SER 66 3.998 2.772 15.856
512 HB3 SER 66 1HB SER 66 4.919 2.533 17.344
513 HG SER 66 HG SER 66 6.111 1.857 14.887
514 H SER 67 H SER 67 2.358 -0.442 15.352
515 HA SER 67 HA SER 67 0.921 -0.457 17.943
516 HB2 SER 67 2HB SER 67 -0.018 1.214 16.311
517 HB3 SER 67 1HB SER 67 -0.351 -0.110 15.195
518 HG SER 67 HG SER 67 -2.178 -0.156 16.235
519 H ARG 68 H ARG 68 -0.793 -2.139 18.036
520 HA ARG 68 HA ARG 68 0.305 -4.715 17.180
521 HB2 ARG 68 2HB ARG 68 -2.021 -4.070 19.067
522 HB3 ARG 68 1HB ARG 68 -1.436 -5.689 18.718
523 HG2 ARG 68 2HG ARG 68 -0.581 -5.052 20.870
524 HG3 ARG 68 1HG ARG 68 0.769 -5.062 19.738
525 HD2 ARG 68 2HD ARG 68 0.686 -2.607 19.588
526 HD3 ARG 68 1HD ARG 68 -0.721 -2.573 20.653
527 HE ARG 68 HE ARG 68 1.357 -3.880 21.991
528 HH11 ARG 68 1HH1 ARG 68 0.613 -0.641 20.822
529 HH12 ARG 68 2HH1 ARG 68 1.564 0.146 22.049
530 HH21 ARG 68 1HH2 ARG 68 2.577 -2.831 23.612
531 HH22 ARG 68 2HH2 ARG 68 2.668 -1.095 23.620
532 H LEU 69 H LEU 69 -0.201 -4.831 14.992
533 HA LEU 69 HA LEU 69 -2.831 -4.113 13.961
534 HB2 LEU 69 2HB LEU 69 -0.472 -5.369 12.489
535 HB3 LEU 69 1HB LEU 69 -1.874 -4.603 11.755
536 HG LEU 69 HG LEU 69 0.301 -3.194 13.350
537 HD11 LEU 69 1HD1 LEU 69 -0.326 -3.086 10.381
538 HD12 LEU 69 2HD1 LEU 69 1.058 -3.887 11.131
539 HD13 LEU 69 3HD1 LEU 69 0.904 -2.135 11.222
540 HD21 LEU 69 3HD2 LEU 69 -1.837 -2.087 13.737
541 HD22 LEU 69 1HD2 LEU 69 -2.131 -1.987 11.998
542 HD23 LEU 69 2HD2 LEU 69 -0.798 -1.086 12.727
543 H THR 70 H THR 70 -3.545 -5.848 12.085
544 HA THR 70 HA THR 70 -4.181 -8.338 13.449
545 HB THR 70 HB THR 70 -5.588 -8.813 11.439
546 HG1 THR 70 HG1 THR 70 -4.244 -7.683 9.907
547 HG21 THR 70 3HG2 THR 70 -6.553 -7.465 13.286
548 HG22 THR 70 1HG2 THR 70 -7.223 -6.989 11.725
549 HG23 THR 70 2HG2 THR 70 -5.992 -5.988 12.499
550 H TRP 71 H TRP 71 -1.849 -8.808 13.594
551 HA TRP 71 HA TRP 71 -0.133 -9.202 11.393
552 HB2 TRP 71 2HB TRP 71 1.351 -10.380 13.092
553 HB3 TRP 71 1HB TRP 71 0.850 -8.758 13.544
554 HD1 TRP 71 HD1 TRP 71 -0.456 -12.387 14.259
555 HE1 TRP 71 HE1 TRP 71 -1.234 -12.481 16.696
556 HE3 TRP 71 HE3 TRP 71 0.519 -7.550 15.614
557 HZ2 TRP 71 HZ2 TRP 71 -1.402 -10.765 18.910
558 HZ3 TRP 71 HZ3 TRP 71 0.033 -6.869 17.921
559 HH2 TRP 71 HH2 TRP 71 -0.911 -8.435 19.540
560 H ARG 72 H ARG 72 -2.538 -11.272 12.738
561 HA ARG 72 HA ARG 72 -1.333 -13.783 12.141
562 HB2 ARG 72 2HB ARG 72 -3.564 -14.750 12.660
563 HB3 ARG 72 1HB ARG 72 -2.955 -13.690 13.920
564 HG2 ARG 72 2HG ARG 72 -4.460 -11.890 13.129
565 HG3 ARG 72 1HG ARG 72 -5.102 -12.980 11.897
566 HD2 ARG 72 2HD ARG 72 -5.819 -14.530 13.755
567 HD3 ARG 72 1HD ARG 72 -5.310 -13.287 14.906
568 HE ARG 72 HE ARG 72 -7.126 -12.197 13.021
569 HH11 ARG 72 1HH1 ARG 72 -7.127 -14.343 15.812
570 HH12 ARG 72 2HH1 ARG 72 -8.775 -13.992 16.228
571 HH21 ARG 72 1HH2 ARG 72 -9.264 -11.728 13.574
572 HH22 ARG 72 2HH2 ARG 72 -9.997 -12.498 14.949
573 H VAL 73 H VAL 73 -3.995 -11.957 10.549
574 HA VAL 73 HA VAL 73 -4.851 -11.913 8.515
575 HB VAL 73 HB VAL 73 -2.138 -12.921 7.603
576 HG11 VAL 73 1HG1 VAL 73 -2.716 -12.022 5.367
577 HG12 VAL 73 2HG1 VAL 73 -4.361 -11.690 5.912
578 HG13 VAL 73 3HG1 VAL 73 -3.776 -13.354 5.820
579 HG21 VAL 73 3HG2 VAL 73 -1.714 -10.531 7.082
580 HG22 VAL 73 1HG2 VAL 73 -2.020 -10.788 8.800
581 HG23 VAL 73 2HG2 VAL 73 -3.282 -10.100 7.773
582 H GLN 74 H GLN 74 -3.034 -15.003 8.417
583 HA GLN 74 HA GLN 74 -4.738 -16.624 7.012
584 HB2 GLN 74 2HB GLN 74 -2.471 -17.258 7.707
585 HB3 GLN 74 1HB GLN 74 -2.952 -17.297 9.393
586 HG2 GLN 74 2HG GLN 74 -2.657 -19.552 8.367
587 HG3 GLN 74 1HG GLN 74 -4.261 -19.290 9.051
588 HE21 GLN 74 1HE2 GLN 74 -6.040 -19.358 7.696
589 HE22 GLN 74 2HE2 GLN 74 -5.945 -19.808 6.033
590 H ARG 75 H ARG 75 -6.867 -16.102 7.435
591 HA ARG 75 HA ARG 75 -8.189 -17.343 9.744
592 HB2 ARG 75 2HB ARG 75 -8.265 -14.355 9.147
593 HB3 ARG 75 1HB ARG 75 -9.562 -15.129 10.041
594 HG2 ARG 75 2HG ARG 75 -6.667 -15.177 10.941
595 HG3 ARG 75 1HG ARG 75 -7.818 -13.936 11.433
596 HD2 ARG 75 2HD ARG 75 -7.681 -15.595 13.183
597 HD3 ARG 75 1HD ARG 75 -9.266 -15.720 12.416
598 HE ARG 75 HE ARG 75 -7.246 -17.535 11.388
599 HH11 ARG 75 1HH1 ARG 75 -9.821 -17.145 13.773
600 HH12 ARG 75 2HH1 ARG 75 -10.065 -18.854 13.966
601 HH21 ARG 75 1HH2 ARG 75 -7.594 -19.770 11.633
602 HH22 ARG 75 2HH2 ARG 75 -8.793 -20.349 12.743
603 H SER 76 H SER 76 -8.101 -16.810 6.450
604 HA SER 76 HA SER 76 -10.873 -17.556 6.045
605 HB2 SER 76 2HB SER 76 -11.051 -15.093 6.308
606 HB3 SER 76 1HB SER 76 -9.889 -14.856 5.002
607 HG SER 76 HG SER 76 -12.498 -15.954 4.875
608 H GLN 77 H GLN 77 -10.170 -19.358 4.960
609 HA GLN 77 HA GLN 77 -9.942 -20.610 3.106
610 HB2 GLN 77 2HB GLN 77 -10.216 -17.955 1.620
611 HB3 GLN 77 1HB GLN 77 -10.343 -19.554 0.887
612 HG2 GLN 77 2HG GLN 77 -12.295 -20.026 2.389
613 HG3 GLN 77 1HG GLN 77 -12.218 -18.355 2.943
614 HE21 GLN 77 1HE2 GLN 77 -12.984 -20.445 0.274
615 HE22 GLN 77 2HE2 GLN 77 -13.826 -19.270 -0.674
616 H ASN 78 H ASN 78 -7.607 -19.670 4.442
617 HA ASN 78 HA ASN 78 -5.362 -19.709 4.370
618 HB2 ASN 78 2HB ASN 78 -5.796 -21.274 1.791
619 HB3 ASN 78 1HB ASN 78 -4.271 -21.179 2.668
620 HD21 ASN 78 1HD2 ASN 78 -5.758 -23.577 2.059
621 HD22 ASN 78 2HD2 ASN 78 -6.199 -24.302 3.564
622 HA PRO 79 HA PRO 79 -5.058 -16.134 1.401
623 HB2 PRO 79 2HB PRO 79 -4.670 -14.128 3.198
624 HB3 PRO 79 1HB PRO 79 -6.291 -14.742 2.819
625 HG2 PRO 79 2HG PRO 79 -4.557 -15.346 5.183
626 HG3 PRO 79 1HG PRO 79 -6.310 -15.054 5.119
627 HD2 PRO 79 2HD PRO 79 -5.178 -17.570 5.240
628 HD3 PRO 79 1HD PRO 79 -6.782 -17.235 4.561
629 H LEU 80 H LEU 80 -3.067 -16.905 4.268
630 HA LEU 80 HA LEU 80 -0.621 -15.819 3.102
631 HB2 LEU 80 2HB LEU 80 -1.179 -17.307 5.691
632 HB3 LEU 80 1HB LEU 80 0.431 -16.803 5.204
633 HG LEU 80 HG LEU 80 -1.906 -14.979 5.888
634 HD11 LEU 80 1HD1 LEU 80 -0.794 -15.966 7.841
635 HD12 LEU 80 2HD1 LEU 80 -0.485 -14.235 7.743
636 HD13 LEU 80 3HD1 LEU 80 0.772 -15.381 7.267
637 HD21 LEU 80 3HD2 LEU 80 0.858 -14.188 4.908
638 HD22 LEU 80 1HD2 LEU 80 -0.373 -13.081 5.523
639 HD23 LEU 80 2HD2 LEU 80 -0.661 -13.976 4.034
640 H LYS 81 H LYS 81 1.367 -17.292 3.316
641 HA LYS 81 HA LYS 81 2.644 -19.053 2.708
642 HB2 LYS 81 2HB LYS 81 1.195 -20.165 4.501
643 HB3 LYS 81 1HB LYS 81 0.191 -20.805 3.210
644 HG2 LYS 81 2HG LYS 81 2.015 -22.181 2.387
645 HG3 LYS 81 1HG LYS 81 3.157 -21.406 3.486
646 HD2 LYS 81 2HD LYS 81 2.507 -23.655 4.285
647 HD3 LYS 81 1HD LYS 81 2.024 -22.394 5.421
648 HE2 LYS 81 2HE LYS 81 0.284 -24.139 5.129
649 HE3 LYS 81 1HE LYS 81 -0.283 -22.538 4.656
650 HZ1 LYS 81 3HZ LYS 81 0.675 -24.627 2.763
651 HZ2 LYS 81 1HZ LYS 81 0.019 -23.120 2.352
652 HZ3 LYS 81 2HZ LYS 81 -0.946 -24.286 3.091
653 H ILE 82 H ILE 82 1.224 -17.515 0.734
654 HA ILE 82 HA ILE 82 0.322 -19.245 -1.410
655 HB ILE 82 HB ILE 82 0.121 -17.187 -2.771
656 HG12 ILE 82 2HG1 ILE 82 1.122 -15.584 -0.365
657 HG13 ILE 82 1HG1 ILE 82 2.174 -16.036 -1.697
658 HG21 ILE 82 1HG2 ILE 82 -1.051 -16.877 0.012
659 HG22 ILE 82 2HG2 ILE 82 -1.753 -17.805 -1.318
660 HG23 ILE 82 3HG2 ILE 82 -1.614 -16.051 -1.442
661 HD11 ILE 82 3HD1 ILE 82 0.755 -14.771 -3.244
662 HD12 ILE 82 1HD1 ILE 82 1.408 -13.765 -1.951
663 HD13 ILE 82 2HD1 ILE 82 -0.274 -14.289 -1.895
664 H ARG 83 H ARG 83 3.336 -18.821 -0.301
665 HA ARG 83 HA ARG 83 4.906 -18.438 -2.669
666 HB2 ARG 83 2HB ARG 83 5.495 -19.518 0.123
667 HB3 ARG 83 1HB ARG 83 6.736 -19.357 -1.113
668 HG2 ARG 83 2HG ARG 83 6.573 -16.982 -1.126
669 HG3 ARG 83 1HG ARG 83 5.074 -16.989 -0.198
670 HD2 ARG 83 2HD ARG 83 7.661 -18.066 0.980
671 HD3 ARG 83 1HD ARG 83 7.270 -16.345 1.036
672 HE ARG 83 HE ARG 83 5.181 -17.013 2.229
673 HH11 ARG 83 1HH1 ARG 83 7.986 -19.159 2.466
674 HH12 ARG 83 2HH1 ARG 83 7.467 -19.830 3.982
675 HH21 ARG 83 1HH2 ARG 83 4.534 -17.930 4.184
676 HH22 ARG 83 2HH2 ARG 83 5.518 -19.137 4.949
677 H LEU 84 H LEU 84 3.448 -19.954 -3.872
678 HA LEU 84 HA LEU 84 3.772 -22.818 -3.499
679 HB2 LEU 84 2HB LEU 84 2.268 -21.170 -5.579
680 HB3 LEU 84 1HB LEU 84 2.286 -22.927 -5.553
681 HG LEU 84 HG LEU 84 1.081 -21.120 -3.415
682 HD11 LEU 84 1HD1 LEU 84 -1.078 -22.036 -4.141
683 HD12 LEU 84 2HD1 LEU 84 -0.275 -22.966 -5.409
684 HD13 LEU 84 3HD1 LEU 84 -0.264 -21.202 -5.464
685 HD21 LEU 84 3HD2 LEU 84 2.013 -23.112 -2.365
686 HD22 LEU 84 1HD2 LEU 84 1.185 -24.152 -3.527
687 HD23 LEU 84 2HD2 LEU 84 0.256 -23.203 -2.365
688 H THR 85 H THR 85 5.512 -23.787 -4.267
689 HA THR 85 HA THR 85 7.380 -22.521 -6.008
690 HB THR 85 HB THR 85 8.621 -24.694 -5.910
691 HG1 THR 85 HG1 THR 85 7.430 -26.406 -5.587
692 HG21 THR 85 3HG2 THR 85 9.062 -24.720 -3.483
693 HG22 THR 85 1HG2 THR 85 7.585 -23.798 -3.197
694 HG23 THR 85 2HG2 THR 85 8.928 -23.059 -4.073
695 H ARG 86 H ARG 86 5.442 -25.524 -6.407
696 HA ARG 86 HA ARG 86 4.575 -26.635 -8.161
697 HB2 ARG 86 2HB ARG 86 5.006 -24.091 -9.774
698 HB3 ARG 86 1HB ARG 86 4.145 -25.504 -10.366
699 HG2 ARG 86 2HG ARG 86 2.383 -25.160 -8.683
700 HG3 ARG 86 1HG ARG 86 3.269 -23.780 -8.025
701 HD2 ARG 86 2HD ARG 86 3.004 -22.549 -10.120
702 HD3 ARG 86 1HD ARG 86 2.257 -23.951 -10.893
703 HE ARG 86 HE ARG 86 0.773 -23.129 -8.592
704 HH11 ARG 86 1HH1 ARG 86 1.342 -22.300 -11.982
705 HH12 ARG 86 2HH1 ARG 86 -0.200 -21.528 -12.181
706 HH21 ARG 86 1HH2 ARG 86 -1.246 -22.112 -8.861
707 HH22 ARG 86 2HH2 ARG 86 -1.675 -21.422 -10.398
708 H GLU 87 H GLU 87 5.146 -27.555 -10.351
709 HA GLU 87 HA GLU 87 8.019 -27.351 -11.050
710 HB2 GLU 87 2HB GLU 87 8.089 -29.770 -11.488
711 HB3 GLU 87 1HB GLU 87 7.662 -29.463 -9.809
712 HG2 GLU 87 2HG GLU 87 5.328 -30.003 -10.234
713 HG3 GLU 87 1HG GLU 87 5.626 -30.121 -11.968
714 H ALA 88 H ALA 88 8.492 -27.876 -13.276
715 HA ALA 88 HA ALA 88 6.401 -28.362 -15.165
716 HB1 ALA 88 3HB ALA 88 5.979 -25.960 -14.808
717 HB2 ALA 88 1HB ALA 88 6.523 -26.275 -16.455
718 HB3 ALA 88 2HB ALA 88 7.638 -25.583 -15.274
719 HA PRO 89 HA PRO 89 10.655 -28.823 -17.243
720 HB2 PRO 89 2HB PRO 89 12.959 -27.834 -16.168
721 HB3 PRO 89 1HB PRO 89 11.921 -26.852 -17.221
722 HG2 PRO 89 2HG PRO 89 12.199 -26.788 -14.251
723 HG3 PRO 89 1HG PRO 89 11.931 -25.447 -15.384
724 HD2 PRO 89 2HD PRO 89 9.941 -26.669 -13.833
725 HD3 PRO 89 1HD PRO 89 9.642 -25.683 -15.278
Start of MODEL 20
1 H1 HIS 1 1H HIS 1 -1.624 -24.517 17.028
2 H2 HIS 1 2H HIS 1 -2.855 -23.448 16.596
3 H3 HIS 1 3H HIS 1 -1.240 -22.991 16.423
4 HA HIS 1 HA HIS 1 -2.519 -25.210 14.949
5 HB2 HIS 1 2HB HIS 1 -1.723 -22.446 13.915
6 HB3 HIS 1 1HB HIS 1 -2.470 -23.732 12.971
7 HD1 HIS 1 HD1 HIS 1 -5.031 -24.254 13.538
8 HD2 HIS 1 HD2 HIS 1 -3.494 -20.808 15.294
9 HE1 HIS 1 HE1 HIS 1 -7.021 -22.956 14.354
10 HE2 HIS 1 HE2 HIS 1 -6.060 -20.946 15.516
11 H HIS 2 H HIS 2 -1.071 -26.165 13.355
12 HA HIS 2 HA HIS 2 1.799 -25.521 13.737
13 HB2 HIS 2 2HB HIS 2 0.567 -28.305 13.665
14 HB3 HIS 2 1HB HIS 2 2.296 -27.998 13.491
15 HD1 HIS 2 HD1 HIS 2 -0.180 -28.720 16.006
16 HD2 HIS 2 HD2 HIS 2 3.359 -26.538 15.894
17 HE1 HIS 2 HE1 HIS 2 0.518 -28.433 18.404
18 HE2 HIS 2 HE2 HIS 2 2.692 -27.177 18.307
19 H HIS 3 H HIS 3 1.649 -24.246 11.883
20 HA HIS 3 HA HIS 3 2.784 -25.668 9.701
21 HB2 HIS 3 2HB HIS 3 1.363 -24.747 7.871
22 HB3 HIS 3 1HB HIS 3 0.519 -25.914 8.867
23 HD1 HIS 3 HD1 HIS 3 -1.033 -24.071 7.056
24 HD2 HIS 3 HD2 HIS 3 -0.244 -23.171 11.041
25 HE1 HIS 3 HE1 HIS 3 -2.879 -22.541 7.780
26 HE2 HIS 3 HE2 HIS 3 -2.527 -22.249 10.242
27 H HIS 4 H HIS 4 4.135 -24.360 8.457
28 HA HIS 4 HA HIS 4 4.447 -21.526 9.042
29 HB2 HIS 4 2HB HIS 4 5.508 -22.393 11.037
30 HB3 HIS 4 1HB HIS 4 6.331 -23.660 10.143
31 HD1 HIS 4 HD1 HIS 4 6.514 -19.927 10.780
32 HD2 HIS 4 HD2 HIS 4 8.846 -22.977 9.179
33 HE1 HIS 4 HE1 HIS 4 8.803 -18.947 10.477
34 HE2 HIS 4 HE2 HIS 4 10.163 -20.767 9.396
35 H HIS 5 H HIS 5 5.474 -20.517 7.349
36 HA HIS 5 HA HIS 5 7.644 -21.746 5.914
37 HB2 HIS 5 2HB HIS 5 6.749 -21.627 3.654
38 HB3 HIS 5 1HB HIS 5 5.705 -22.659 4.615
39 HD1 HIS 5 HD1 HIS 5 3.400 -21.474 5.425
40 HD2 HIS 5 HD2 HIS 5 5.430 -19.629 2.301
41 HE1 HIS 5 HE1 HIS 5 1.707 -20.005 4.295
42 HE2 HIS 5 HE2 HIS 5 2.904 -19.086 2.283
43 H HIS 6 H HIS 6 8.819 -20.210 4.608
44 HA HIS 6 HA HIS 6 8.772 -17.550 5.670
45 HB2 HIS 6 2HB HIS 6 10.887 -18.694 5.004
46 HB3 HIS 6 1HB HIS 6 10.376 -18.659 3.323
47 HD1 HIS 6 HD1 HIS 6 11.850 -16.527 6.012
48 HD2 HIS 6 HD2 HIS 6 10.563 -16.104 2.079
49 HE1 HIS 6 HE1 HIS 6 12.737 -14.304 5.241
50 HE2 HIS 6 HE2 HIS 6 12.030 -14.121 2.836
51 H SER 7 H SER 7 7.577 -15.907 5.005
52 HA SER 7 HA SER 7 6.788 -15.550 2.199
53 HB2 SER 7 2HB SER 7 4.916 -16.819 3.425
54 HB3 SER 7 1HB SER 7 4.729 -15.406 4.464
55 HG SER 7 HG SER 7 4.124 -15.742 1.748
56 H HIS 8 H HIS 8 5.332 -13.298 2.373
57 HA HIS 8 HA HIS 8 7.011 -11.175 3.164
58 HB2 HIS 8 2HB HIS 8 5.017 -9.728 2.747
59 HB3 HIS 8 1HB HIS 8 5.249 -10.894 1.452
60 HD1 HIS 8 HD1 HIS 8 3.534 -12.919 1.367
61 HD2 HIS 8 HD2 HIS 8 2.567 -9.901 4.064
62 HE1 HIS 8 HE1 HIS 8 1.161 -13.351 2.043
63 HE2 HIS 8 HE2 HIS 8 0.675 -11.639 3.823
64 H MET 9 H MET 9 7.117 -9.959 5.056
65 HA MET 9 HA MET 9 5.756 -10.911 7.435
66 HB2 MET 9 2HB MET 9 6.982 -9.160 8.645
67 HB3 MET 9 1HB MET 9 8.073 -10.072 7.618
68 HG2 MET 9 2HG MET 9 8.101 -8.234 5.992
69 HG3 MET 9 1HG MET 9 6.970 -7.326 6.997
70 HE1 MET 9 3HE MET 9 11.324 -8.301 8.261
71 HE2 MET 9 1HE MET 9 10.606 -8.826 6.739
72 HE3 MET 9 2HE MET 9 10.071 -9.537 8.265
73 H VAL 10 H VAL 10 3.955 -10.108 8.305
74 HA VAL 10 HA VAL 10 2.329 -8.167 6.922
75 HB VAL 10 HB VAL 10 0.625 -8.651 8.572
76 HG11 VAL 10 1HG1 VAL 10 2.142 -11.220 7.956
77 HG12 VAL 10 2HG1 VAL 10 0.996 -10.412 6.889
78 HG13 VAL 10 3HG1 VAL 10 0.438 -11.109 8.405
79 HG21 VAL 10 3HG2 VAL 10 1.936 -8.526 10.633
80 HG22 VAL 10 1HG2 VAL 10 2.775 -10.026 10.230
81 HG23 VAL 10 2HG2 VAL 10 1.047 -10.047 10.587
82 H GLY 11 H GLY 11 1.663 -6.101 7.785
83 HA2 GLY 11 2HA GLY 11 1.926 -4.156 9.062
84 HA3 GLY 11 1HA GLY 11 3.170 -4.945 10.019
85 H ASP 12 H ASP 12 3.597 -5.309 6.631
86 HA ASP 12 HA ASP 12 6.158 -4.092 6.629
87 HB2 ASP 12 2HB ASP 12 5.393 -5.945 5.077
88 HB3 ASP 12 1HB ASP 12 4.421 -4.772 4.201
89 H THR 13 H THR 13 6.652 -1.936 6.524
90 HA THR 13 HA THR 13 4.497 -0.037 6.421
91 HB THR 13 HB THR 13 7.475 0.569 6.566
92 HG1 THR 13 HG1 THR 13 5.840 -0.718 8.317
93 HG21 THR 13 3HG2 THR 13 5.055 2.133 7.574
94 HG22 THR 13 1HG2 THR 13 6.018 2.552 6.154
95 HG23 THR 13 2HG2 THR 13 6.745 2.607 7.762
96 H VAL 14 H VAL 14 3.698 0.710 4.607
97 HA VAL 14 HA VAL 14 5.380 1.420 2.285
98 HB VAL 14 HB VAL 14 3.563 0.638 0.765
99 HG11 VAL 14 1HG1 VAL 14 4.608 -1.588 2.550
100 HG12 VAL 14 2HG1 VAL 14 5.460 -0.865 1.185
101 HG13 VAL 14 3HG1 VAL 14 3.978 -1.781 0.909
102 HG21 VAL 14 3HG2 VAL 14 1.641 0.812 2.298
103 HG22 VAL 14 1HG2 VAL 14 2.262 -0.527 3.268
104 HG23 VAL 14 2HG2 VAL 14 1.726 -0.808 1.610
105 H TRP 15 H TRP 15 3.794 2.675 0.710
106 HA TRP 15 HA TRP 15 2.037 4.565 2.153
107 HB2 TRP 15 2HB TRP 15 3.879 5.128 -0.229
108 HB3 TRP 15 1HB TRP 15 2.729 6.280 0.449
109 HD1 TRP 15 HD1 TRP 15 3.599 5.606 3.596
110 HE1 TRP 15 HE1 TRP 15 5.786 6.653 4.445
111 HE3 TRP 15 HE3 TRP 15 5.876 6.545 -0.894
112 HZ2 TRP 15 HZ2 TRP 15 8.143 7.745 3.383
113 HZ3 TRP 15 HZ3 TRP 15 8.103 7.598 -0.885
114 HH2 TRP 15 HH2 TRP 15 9.216 8.185 1.212
115 H VAL 16 H VAL 16 0.062 4.921 1.132
116 HA VAL 16 HA VAL 16 -0.518 3.358 -1.320
117 HB VAL 16 HB VAL 16 -2.454 4.319 0.851
118 HG11 VAL 16 1HG1 VAL 16 -3.068 2.745 -1.687
119 HG12 VAL 16 2HG1 VAL 16 -3.534 4.417 -1.370
120 HG13 VAL 16 3HG1 VAL 16 -4.220 3.113 -0.398
121 HG21 VAL 16 3HG2 VAL 16 -1.572 1.502 0.083
122 HG22 VAL 16 1HG2 VAL 16 -2.776 1.904 1.312
123 HG23 VAL 16 2HG2 VAL 16 -1.091 2.376 1.539
124 H ARG 17 H ARG 17 -0.321 4.592 -2.997
125 HA ARG 17 HA ARG 17 -0.508 7.475 -2.872
126 HB2 ARG 17 2HB ARG 17 1.401 6.282 -3.944
127 HB3 ARG 17 1HB ARG 17 0.306 5.634 -5.162
128 HG2 ARG 17 2HG ARG 17 -0.091 7.812 -6.078
129 HG3 ARG 17 1HG ARG 17 0.720 8.603 -4.723
130 HD2 ARG 17 2HD ARG 17 2.149 8.621 -6.684
131 HD3 ARG 17 1HD ARG 17 2.864 7.604 -5.433
132 HE ARG 17 HE ARG 17 1.449 5.886 -7.064
133 HH11 ARG 17 1HH1 ARG 17 4.094 8.176 -7.524
134 HH12 ARG 17 2HH1 ARG 17 4.799 7.286 -8.834
135 HH21 ARG 17 1HH2 ARG 17 2.401 4.721 -8.777
136 HH22 ARG 17 2HH2 ARG 17 3.839 5.335 -9.539
137 H ARG 18 H ARG 18 -2.586 8.063 -2.753
138 HA ARG 18 HA ARG 18 -4.751 6.838 -4.261
139 HB2 ARG 18 2HB ARG 18 -5.054 7.551 -1.906
140 HB3 ARG 18 1HB ARG 18 -4.641 9.206 -2.331
141 HG2 ARG 18 2HG ARG 18 -6.690 9.332 -3.734
142 HG3 ARG 18 1HG ARG 18 -7.119 7.693 -3.231
143 HD2 ARG 18 2HD ARG 18 -8.347 9.378 -1.926
144 HD3 ARG 18 1HD ARG 18 -7.264 8.449 -0.883
145 HE ARG 18 HE ARG 18 -5.882 10.733 -1.708
146 HH11 ARG 18 1HH1 ARG 18 -8.716 10.010 0.267
147 HH12 ARG 18 2HH1 ARG 18 -8.531 11.424 1.254
148 HH21 ARG 18 1HH2 ARG 18 -5.634 12.556 -0.390
149 HH22 ARG 18 2HH2 ARG 18 -6.775 12.871 0.879
150 H HIS 19 H HIS 19 -6.120 8.040 -5.755
151 HA HIS 19 HA HIS 19 -4.854 10.415 -7.009
152 HB2 HIS 19 2HB HIS 19 -5.626 9.542 -9.248
153 HB3 HIS 19 1HB HIS 19 -4.373 8.566 -8.491
154 HD1 HIS 19 HD1 HIS 19 -7.885 8.418 -9.699
155 HD2 HIS 19 HD2 HIS 19 -5.243 5.983 -7.608
156 HE1 HIS 19 HE1 HIS 19 -8.906 6.123 -9.736
157 HE2 HIS 19 HE2 HIS 19 -7.277 4.661 -8.498
158 H GLN 20 H GLN 20 -6.135 12.133 -7.059
159 HA GLN 20 HA GLN 20 -9.042 11.945 -6.696
160 HB2 GLN 20 2HB GLN 20 -7.317 14.439 -7.080
161 HB3 GLN 20 1HB GLN 20 -8.996 14.401 -6.550
162 HG2 GLN 20 2HG GLN 20 -6.589 13.392 -5.015
163 HG3 GLN 20 1HG GLN 20 -7.519 14.847 -4.672
164 HE21 GLN 20 1HE2 GLN 20 -6.931 12.485 -2.999
165 HE22 GLN 20 2HE2 GLN 20 -8.469 11.900 -2.469
166 H THR 21 H THR 21 -6.674 13.145 -9.029
167 HA THR 21 HA THR 21 -8.555 12.668 -11.261
168 HB THR 21 HB THR 21 -6.354 14.794 -11.186
169 HG1 THR 21 HG1 THR 21 -8.301 16.225 -11.180
170 HG21 THR 21 3HG2 THR 21 -6.914 13.971 -13.475
171 HG22 THR 21 1HG2 THR 21 -7.392 15.658 -13.238
172 HG23 THR 21 2HG2 THR 21 -8.609 14.383 -13.196
173 H LYS 22 H LYS 22 -7.811 11.100 -12.573
174 HA LYS 22 HA LYS 22 -5.282 9.825 -12.222
175 HB2 LYS 22 2HB LYS 22 -7.336 9.454 -14.443
176 HB3 LYS 22 1HB LYS 22 -5.988 8.369 -14.100
177 HG2 LYS 22 2HG LYS 22 -6.977 7.968 -11.821
178 HG3 LYS 22 1HG LYS 22 -8.379 8.914 -12.311
179 HD2 LYS 22 2HD LYS 22 -7.450 6.404 -13.762
180 HD3 LYS 22 1HD LYS 22 -8.636 6.386 -12.460
181 HE2 LYS 22 2HE LYS 22 -9.843 6.306 -14.526
182 HE3 LYS 22 1HE LYS 22 -10.078 7.921 -13.867
183 HZ1 LYS 22 3HZ LYS 22 -8.470 8.774 -15.435
184 HZ2 LYS 22 1HZ LYS 22 -9.649 7.896 -16.270
185 HZ3 LYS 22 2HZ LYS 22 -8.125 7.220 -15.998
186 H ASN 23 H ASN 23 -6.428 12.340 -14.342
187 HA ASN 23 HA ASN 23 -4.240 12.331 -16.201
188 HB2 ASN 23 2HB ASN 23 -6.295 14.471 -15.495
189 HB3 ASN 23 1HB ASN 23 -5.093 14.663 -16.770
190 HD21 ASN 23 1HD2 ASN 23 -6.703 14.874 -18.345
191 HD22 ASN 23 2HD2 ASN 23 -7.645 13.535 -18.899
192 H LEU 24 H LEU 24 -4.749 13.724 -13.034
193 HA LEU 24 HA LEU 24 -2.263 15.297 -13.121
194 HB2 LEU 24 2HB LEU 24 -4.443 15.036 -11.022
195 HB3 LEU 24 1HB LEU 24 -2.967 15.953 -10.764
196 HG LEU 24 HG LEU 24 -5.106 16.568 -12.838
197 HD11 LEU 24 1HD1 LEU 24 -5.534 18.588 -11.500
198 HD12 LEU 24 2HD1 LEU 24 -4.358 18.055 -10.296
199 HD13 LEU 24 3HD1 LEU 24 -5.830 17.118 -10.572
200 HD21 LEU 24 3HD2 LEU 24 -2.528 18.062 -12.250
201 HD22 LEU 24 1HD2 LEU 24 -3.813 18.607 -13.332
202 HD23 LEU 24 2HD2 LEU 24 -2.901 17.152 -13.716
203 H GLU 25 H GLU 25 -0.939 15.127 -11.017
204 HA GLU 25 HA GLU 25 0.163 12.504 -10.828
205 HB2 GLU 25 2HB GLU 25 0.699 14.999 -9.151
206 HB3 GLU 25 1HB GLU 25 1.657 13.520 -9.069
207 HG2 GLU 25 2HG GLU 25 2.301 13.805 -11.441
208 HG3 GLU 25 1HG GLU 25 1.339 15.283 -11.518
209 HA PRO 26 HA PRO 26 -2.573 11.123 -7.461
210 HB2 PRO 26 2HB PRO 26 -1.454 8.654 -7.048
211 HB3 PRO 26 1HB PRO 26 -2.476 8.998 -8.459
212 HG2 PRO 26 2HG PRO 26 0.514 8.900 -8.282
213 HG3 PRO 26 1HG PRO 26 -0.561 8.250 -9.539
214 HD2 PRO 26 2HD PRO 26 0.765 10.626 -9.824
215 HD3 PRO 26 1HD PRO 26 -0.797 10.295 -10.597
216 H ARG 27 H ARG 27 -2.400 11.451 -5.302
217 HA ARG 27 HA ARG 27 0.202 12.303 -4.221
218 HB2 ARG 27 2HB ARG 27 -1.789 13.836 -4.207
219 HB3 ARG 27 1HB ARG 27 -2.630 12.707 -3.154
220 HG2 ARG 27 2HG ARG 27 -0.925 13.099 -1.394
221 HG3 ARG 27 1HG ARG 27 -0.102 14.237 -2.465
222 HD2 ARG 27 2HD ARG 27 -2.914 14.526 -1.352
223 HD3 ARG 27 1HD ARG 27 -1.492 15.451 -0.862
224 HE ARG 27 HE ARG 27 -1.741 15.881 -3.576
225 HH11 ARG 27 1HH1 ARG 27 -3.787 16.504 -0.767
226 HH12 ARG 27 2HH1 ARG 27 -4.568 17.869 -1.503
227 HH21 ARG 27 1HH2 ARG 27 -2.811 17.647 -4.525
228 HH22 ARG 27 2HH2 ARG 27 -4.017 18.513 -3.627
229 H TRP 28 H TRP 28 1.239 11.118 -2.649
230 HA TRP 28 HA TRP 28 0.122 8.545 -1.920
231 HB2 TRP 28 2HB TRP 28 2.293 7.976 -0.979
232 HB3 TRP 28 1HB TRP 28 2.522 8.701 -2.563
233 HD1 TRP 28 HD1 TRP 28 3.920 10.977 -2.669
234 HE1 TRP 28 HE1 TRP 28 5.405 12.196 -0.965
235 HE3 TRP 28 HE3 TRP 28 2.507 8.516 1.599
236 HZ2 TRP 28 HZ2 TRP 28 5.932 12.127 1.789
237 HZ3 TRP 28 HZ3 TRP 28 3.561 9.150 3.730
238 HH2 TRP 28 HH2 TRP 28 5.244 10.921 3.823
239 H LYS 29 H LYS 29 -0.341 7.805 0.090
240 HA LYS 29 HA LYS 29 -0.492 9.728 2.351
241 HB2 LYS 29 2HB LYS 29 -2.322 7.330 1.799
242 HB3 LYS 29 1HB LYS 29 -2.468 8.454 3.144
243 HG2 LYS 29 2HG LYS 29 -2.964 10.276 1.487
244 HG3 LYS 29 1HG LYS 29 -2.921 9.061 0.212
245 HD2 LYS 29 2HD LYS 29 -5.221 9.347 0.676
246 HD3 LYS 29 1HD LYS 29 -4.796 7.850 1.504
247 HE2 LYS 29 2HE LYS 29 -4.980 10.560 2.869
248 HE3 LYS 29 1HE LYS 29 -6.296 9.398 2.804
249 HZ1 LYS 29 3HZ LYS 29 -4.955 7.839 4.049
250 HZ2 LYS 29 1HZ LYS 29 -5.095 9.290 4.900
251 HZ3 LYS 29 2HZ LYS 29 -3.659 8.915 4.090
252 H GLY 30 H GLY 30 0.329 8.942 4.329
253 HA2 GLY 30 2HA GLY 30 1.064 6.192 4.743
254 HA3 GLY 30 1HA GLY 30 2.446 7.190 4.356
255 HA PRO 31 HA PRO 31 2.938 5.330 5.962
256 HB2 PRO 31 2HB PRO 31 3.500 4.061 8.277
257 HB3 PRO 31 1HB PRO 31 4.382 5.529 7.803
258 HG2 PRO 31 2HG PRO 31 2.180 5.225 9.807
259 HG3 PRO 31 1HG PRO 31 3.638 6.236 9.875
260 HD2 PRO 31 2HD PRO 31 1.077 7.128 9.122
261 HD3 PRO 31 1HD PRO 31 2.603 7.981 8.806
262 H TYR 32 H TYR 32 1.953 3.573 5.207
263 HA TYR 32 HA TYR 32 -0.299 2.293 6.639
264 HB2 TYR 32 2HB TYR 32 0.378 2.430 3.678
265 HB3 TYR 32 1HB TYR 32 -0.741 1.238 4.319
266 HD1 TYR 32 HD2 TYR 32 -0.186 4.931 4.078
267 HD2 TYR 32 HD1 TYR 32 -3.022 1.797 4.679
268 HE1 TYR 32 HE2 TYR 32 -2.014 6.555 3.960
269 HE2 TYR 32 HE1 TYR 32 -4.854 3.430 4.562
270 HH TYR 32 HH TYR 32 -5.162 5.880 4.907
271 H THR 33 H THR 33 -0.409 -0.142 5.914
272 HA THR 33 HA THR 33 2.222 -1.437 6.211
273 HB THR 33 HB THR 33 1.202 -2.815 8.144
274 HG1 THR 33 HG1 THR 33 -0.987 -2.017 7.694
275 HG21 THR 33 3HG2 THR 33 1.650 -1.135 9.910
276 HG22 THR 33 1HG2 THR 33 1.637 0.146 8.695
277 HG23 THR 33 2HG2 THR 33 2.888 -1.098 8.653
278 H VAL 34 H VAL 34 2.163 -2.837 4.460
279 HA VAL 34 HA VAL 34 -0.142 -4.219 3.536
280 HB VAL 34 HB VAL 34 2.804 -4.958 3.150
281 HG11 VAL 34 1HG1 VAL 34 0.369 -6.020 1.655
282 HG12 VAL 34 2HG1 VAL 34 1.381 -6.932 2.778
283 HG13 VAL 34 3HG1 VAL 34 2.054 -6.361 1.252
284 HG21 VAL 34 3HG2 VAL 34 2.564 -3.938 0.915
285 HG22 VAL 34 1HG2 VAL 34 2.259 -2.767 2.198
286 HG23 VAL 34 2HG2 VAL 34 0.907 -3.462 1.302
287 H LEU 35 H LEU 35 -1.186 -5.757 4.516
288 HA LEU 35 HA LEU 35 0.024 -7.486 6.547
289 HB2 LEU 35 2HB LEU 35 -2.854 -7.225 5.582
290 HB3 LEU 35 1HB LEU 35 -2.319 -8.291 6.873
291 HG LEU 35 HG LEU 35 -2.354 -5.253 6.905
292 HD11 LEU 35 1HD1 LEU 35 -4.524 -6.305 7.307
293 HD12 LEU 35 2HD1 LEU 35 -3.926 -5.529 8.771
294 HD13 LEU 35 3HD1 LEU 35 -3.837 -7.287 8.606
295 HD21 LEU 35 3HD2 LEU 35 -1.193 -7.110 9.014
296 HD22 LEU 35 1HD2 LEU 35 -1.455 -5.372 9.207
297 HD23 LEU 35 2HD2 LEU 35 -0.300 -5.960 8.016
298 H LEU 36 H LEU 36 -1.459 -7.659 3.293
299 HA LEU 36 HA LEU 36 -0.413 -10.419 3.023
300 HB2 LEU 36 2HB LEU 36 -2.904 -10.391 3.577
301 HB3 LEU 36 1HB LEU 36 -3.159 -9.590 2.043
302 HG LEU 36 HG LEU 36 -2.037 -11.618 0.934
303 HD11 LEU 36 1HD1 LEU 36 -0.926 -12.523 2.905
304 HD12 LEU 36 2HD1 LEU 36 -2.022 -13.712 2.210
305 HD13 LEU 36 3HD1 LEU 36 -2.485 -12.841 3.672
306 HD21 LEU 36 3HD2 LEU 36 -4.088 -12.947 0.934
307 HD22 LEU 36 1HD2 LEU 36 -4.460 -11.227 0.827
308 HD23 LEU 36 2HD2 LEU 36 -4.680 -12.083 2.355
309 H THR 37 H THR 37 0.237 -11.006 0.978
310 HA THR 37 HA THR 37 0.430 -8.887 -1.081
311 HB THR 37 HB THR 37 2.471 -11.059 -0.420
312 HG1 THR 37 HG1 THR 37 2.863 -8.270 -0.078
313 HG21 THR 37 3HG2 THR 37 3.981 -9.869 -1.986
314 HG22 THR 37 1HG2 THR 37 2.677 -8.757 -2.405
315 HG23 THR 37 2HG2 THR 37 2.548 -10.466 -2.819
316 H THR 38 H THR 38 -0.417 -9.413 -3.001
317 HA THR 38 HA THR 38 -0.506 -12.189 -3.962
318 HB THR 38 HB THR 38 -2.888 -11.726 -4.876
319 HG1 THR 38 HG1 THR 38 -2.479 -9.413 -3.514
320 HG21 THR 38 3HG2 THR 38 -2.584 -13.318 -3.028
321 HG22 THR 38 1HG2 THR 38 -4.049 -12.369 -2.770
322 HG23 THR 38 2HG2 THR 38 -2.587 -11.998 -1.856
323 HA PRO 39 HA PRO 39 0.995 -10.666 -7.923
324 HB2 PRO 39 2HB PRO 39 -1.585 -11.775 -9.094
325 HB3 PRO 39 1HB PRO 39 0.079 -11.934 -9.703
326 HG2 PRO 39 2HG PRO 39 -0.979 -13.958 -8.402
327 HG3 PRO 39 1HG PRO 39 0.690 -13.467 -8.024
328 HD2 PRO 39 2HD PRO 39 -1.821 -12.975 -6.440
329 HD3 PRO 39 1HD PRO 39 -0.173 -13.331 -5.865
330 H THR 40 H THR 40 0.997 -8.481 -7.941
331 HA THR 40 HA THR 40 0.571 -6.344 -8.489
332 HB THR 40 HB THR 40 -1.736 -7.229 -10.268
333 HG1 THR 40 HG1 THR 40 -0.221 -7.866 -11.795
334 HG21 THR 40 3HG2 THR 40 -1.266 -4.779 -10.199
335 HG22 THR 40 1HG2 THR 40 -0.878 -5.461 -11.782
336 HG23 THR 40 2HG2 THR 40 0.414 -5.091 -10.640
337 H ALA 41 H ALA 41 -1.072 -7.720 -6.293
338 HA ALA 41 HA ALA 41 -2.808 -5.421 -5.695
339 HB1 ALA 41 3HB ALA 41 -4.333 -7.085 -6.710
340 HB2 ALA 41 1HB ALA 41 -4.678 -6.891 -4.989
341 HB3 ALA 41 2HB ALA 41 -3.790 -8.307 -5.559
342 H LEU 42 H LEU 42 -2.656 -4.862 -3.556
343 HA LEU 42 HA LEU 42 -1.324 -6.719 -1.668
344 HB2 LEU 42 2HB LEU 42 -0.865 -3.718 -1.985
345 HB3 LEU 42 1HB LEU 42 -0.244 -4.667 -0.640
346 HG LEU 42 HG LEU 42 0.513 -5.076 -3.564
347 HD11 LEU 42 1HD1 LEU 42 1.414 -2.978 -2.728
348 HD12 LEU 42 2HD1 LEU 42 2.704 -4.154 -2.968
349 HD13 LEU 42 3HD1 LEU 42 2.123 -3.803 -1.337
350 HD21 LEU 42 3HD2 LEU 42 1.608 -6.411 -1.067
351 HD22 LEU 42 1HD2 LEU 42 2.263 -6.591 -2.700
352 HD23 LEU 42 2HD2 LEU 42 0.642 -7.171 -2.335
353 H LYS 43 H LYS 43 -2.597 -7.155 0.017
354 HA LYS 43 HA LYS 43 -4.850 -5.460 0.729
355 HB2 LYS 43 2HB LYS 43 -5.132 -7.899 0.941
356 HB3 LYS 43 1HB LYS 43 -3.744 -7.991 2.017
357 HG2 LYS 43 2HG LYS 43 -4.947 -6.654 3.708
358 HG3 LYS 43 1HG LYS 43 -6.346 -6.556 2.636
359 HD2 LYS 43 2HD LYS 43 -6.515 -9.068 2.735
360 HD3 LYS 43 1HD LYS 43 -5.196 -9.065 3.913
361 HE2 LYS 43 2HE LYS 43 -7.410 -9.212 5.008
362 HE3 LYS 43 1HE LYS 43 -6.556 -7.736 5.464
363 HZ1 LYS 43 3HZ LYS 43 -8.602 -7.847 3.317
364 HZ2 LYS 43 1HZ LYS 43 -7.900 -6.469 3.992
365 HZ3 LYS 43 2HZ LYS 43 -8.947 -7.419 4.916
366 H VAL 44 H VAL 44 -4.396 -3.694 1.765
367 HA VAL 44 HA VAL 44 -2.143 -3.518 3.671
368 HB VAL 44 HB VAL 44 -3.531 -1.306 2.067
369 HG11 VAL 44 1HG1 VAL 44 -1.701 0.148 2.834
370 HG12 VAL 44 2HG1 VAL 44 -1.058 -1.170 3.816
371 HG13 VAL 44 3HG1 VAL 44 -2.641 -0.482 4.189
372 HG21 VAL 44 3HG2 VAL 44 -2.225 -2.767 0.573
373 HG22 VAL 44 1HG2 VAL 44 -0.795 -2.559 1.590
374 HG23 VAL 44 2HG2 VAL 44 -1.463 -1.181 0.710
375 H ASP 45 H ASP 45 -2.651 -3.001 5.761
376 HA ASP 45 HA ASP 45 -5.299 -2.851 6.754
377 HB2 ASP 45 2HB ASP 45 -3.337 -3.609 8.098
378 HB3 ASP 45 1HB ASP 45 -2.688 -1.974 8.075
379 H GLY 46 H GLY 46 -6.529 -1.073 7.372
380 HA2 GLY 46 2HA GLY 46 -7.122 1.200 7.531
381 HA3 GLY 46 1HA GLY 46 -5.624 1.655 6.726
382 H ILE 47 H ILE 47 -6.389 -0.669 4.763
383 HA ILE 47 HA ILE 47 -8.084 0.931 2.955
384 HB ILE 47 HB ILE 47 -6.195 -1.411 2.435
385 HG12 ILE 47 2HG1 ILE 47 -4.971 0.658 2.906
386 HG13 ILE 47 1HG1 ILE 47 -4.813 0.270 1.199
387 HG21 ILE 47 1HG2 ILE 47 -6.585 -1.126 0.047
388 HG22 ILE 47 2HG2 ILE 47 -7.772 0.137 0.358
389 HG23 ILE 47 3HG2 ILE 47 -8.093 -1.520 0.868
390 HD11 ILE 47 3HD1 ILE 47 -6.501 1.983 0.674
391 HD12 ILE 47 1HD1 ILE 47 -5.104 2.642 1.525
392 HD13 ILE 47 2HD1 ILE 47 -6.615 2.376 2.393
393 H ALA 48 H ALA 48 -9.888 -0.049 1.923
394 HA ALA 48 HA ALA 48 -11.626 -1.466 3.533
395 HB1 ALA 48 3HB ALA 48 -11.740 -1.215 0.508
396 HB2 ALA 48 1HB ALA 48 -12.344 -0.031 1.667
397 HB3 ALA 48 2HB ALA 48 -13.099 -1.621 1.561
398 H ALA 49 H ALA 49 -9.795 -2.757 0.710
399 HA ALA 49 HA ALA 49 -9.628 -5.367 2.026
400 HB1 ALA 49 3HB ALA 49 -10.866 -5.105 -0.733
401 HB2 ALA 49 1HB ALA 49 -11.742 -5.487 0.752
402 HB3 ALA 49 2HB ALA 49 -10.536 -6.613 0.125
403 H TRP 50 H TRP 50 -8.949 -3.824 -1.193
404 HA TRP 50 HA TRP 50 -6.101 -4.562 -0.965
405 HB2 TRP 50 2HB TRP 50 -7.863 -5.428 -3.308
406 HB3 TRP 50 1HB TRP 50 -6.104 -5.415 -3.379
407 HD1 TRP 50 HD1 TRP 50 -4.814 -7.269 -1.793
408 HE1 TRP 50 HE1 TRP 50 -5.586 -9.578 -0.967
409 HE3 TRP 50 HE3 TRP 50 -9.846 -6.794 -2.607
410 HZ2 TRP 50 HZ2 TRP 50 -7.998 -11.018 -0.696
411 HZ3 TRP 50 HZ3 TRP 50 -11.317 -8.686 -2.048
412 HH2 TRP 50 HH2 TRP 50 -10.413 -10.757 -1.113
413 H ILE 51 H ILE 51 -4.698 -3.355 -2.344
414 HA ILE 51 HA ILE 51 -5.883 -1.266 -4.086
415 HB ILE 51 HB ILE 51 -3.337 -1.009 -2.390
416 HG12 ILE 51 2HG1 ILE 51 -5.451 -0.523 -1.163
417 HG13 ILE 51 1HG1 ILE 51 -4.424 0.895 -1.300
418 HG21 ILE 51 1HG2 ILE 51 -3.052 1.261 -3.376
419 HG22 ILE 51 2HG2 ILE 51 -4.361 0.916 -4.513
420 HG23 ILE 51 3HG2 ILE 51 -2.871 -0.029 -4.567
421 HD11 ILE 51 3HD1 ILE 51 -6.762 1.454 -1.610
422 HD12 ILE 51 1HD1 ILE 51 -6.885 0.320 -2.953
423 HD13 ILE 51 2HD1 ILE 51 -5.862 1.753 -3.096
424 H HIS 52 H HIS 52 -5.054 -1.202 -6.131
425 HA HIS 52 HA HIS 52 -3.516 -3.316 -7.233
426 HB2 HIS 52 2HB HIS 52 -5.188 -1.863 -8.473
427 HB3 HIS 52 1HB HIS 52 -4.036 -0.537 -8.391
428 HD1 HIS 52 HD1 HIS 52 -1.869 -0.769 -9.882
429 HD2 HIS 52 HD2 HIS 52 -4.764 -3.677 -10.502
430 HE1 HIS 52 HE1 HIS 52 -1.209 -1.928 -11.999
431 HE2 HIS 52 HE2 HIS 52 -2.992 -3.663 -12.378
432 H ALA 53 H ALA 53 -1.309 -3.355 -7.837
433 HA ALA 53 HA ALA 53 0.438 -2.364 -5.878
434 HB1 ALA 53 3HB ALA 53 2.229 -3.486 -7.120
435 HB2 ALA 53 1HB ALA 53 1.186 -3.613 -8.544
436 HB3 ALA 53 2HB ALA 53 0.784 -4.495 -7.071
437 H ALA 54 H ALA 54 -0.372 -0.909 -8.935
438 HA ALA 54 HA ALA 54 1.902 0.793 -9.208
439 HB1 ALA 54 3HB ALA 54 -0.861 1.129 -10.388
440 HB2 ALA 54 1HB ALA 54 0.462 0.226 -11.114
441 HB3 ALA 54 2HB ALA 54 0.593 1.978 -10.914
442 H HIS 55 H HIS 55 -0.789 0.944 -7.115
443 HA HIS 55 HA HIS 55 -0.230 3.765 -6.387
444 HB2 HIS 55 2HB HIS 55 -2.837 2.200 -6.152
445 HB3 HIS 55 1HB HIS 55 -2.574 3.789 -5.437
446 HD1 HIS 55 HD1 HIS 55 -1.867 5.697 -7.291
447 HD2 HIS 55 HD2 HIS 55 -3.860 2.332 -8.680
448 HE1 HIS 55 HE1 HIS 55 -2.735 6.322 -9.561
449 HE2 HIS 55 HE2 HIS 55 -3.766 4.215 -10.450
450 H VAL 56 H VAL 56 0.943 1.049 -5.485
451 HA VAL 56 HA VAL 56 1.114 1.973 -2.673
452 HB VAL 56 HB VAL 56 1.522 -0.947 -3.533
453 HG11 VAL 56 1HG1 VAL 56 1.677 -1.409 -1.107
454 HG12 VAL 56 2HG1 VAL 56 1.520 0.313 -0.760
455 HG13 VAL 56 3HG1 VAL 56 2.934 -0.287 -1.632
456 HG21 VAL 56 3HG2 VAL 56 -0.875 -0.427 -3.620
457 HG22 VAL 56 1HG2 VAL 56 -0.818 0.209 -1.974
458 HG23 VAL 56 2HG2 VAL 56 -0.522 -1.507 -2.271
459 H LYS 57 H LYS 57 3.204 2.404 -2.032
460 HA LYS 57 HA LYS 57 5.480 1.428 -3.631
461 HB2 LYS 57 2HB LYS 57 5.130 4.335 -2.740
462 HB3 LYS 57 1HB LYS 57 6.571 3.660 -3.495
463 HG2 LYS 57 2HG LYS 57 5.112 3.105 -5.516
464 HG3 LYS 57 1HG LYS 57 3.842 4.062 -4.750
465 HD2 LYS 57 2HD LYS 57 5.040 5.402 -6.413
466 HD3 LYS 57 1HD LYS 57 5.316 6.055 -4.794
467 HE2 LYS 57 2HE LYS 57 7.535 5.157 -4.716
468 HE3 LYS 57 1HE LYS 57 7.258 4.152 -6.141
469 HZ1 LYS 57 3HZ LYS 57 7.111 6.146 -7.491
470 HZ2 LYS 57 1HZ LYS 57 8.586 6.095 -6.664
471 HZ3 LYS 57 2HZ LYS 57 7.356 7.122 -6.130
472 H ALA 58 H ALA 58 7.244 0.893 -2.381
473 HA ALA 58 HA ALA 58 6.732 0.230 0.332
474 HB1 ALA 58 3HB ALA 58 9.012 -0.724 0.296
475 HB2 ALA 58 1HB ALA 58 9.321 0.067 -1.252
476 HB3 ALA 58 2HB ALA 58 8.092 -1.192 -1.132
477 H ALA 59 H ALA 59 7.381 1.119 2.196
478 HA ALA 59 HA ALA 59 9.134 3.524 2.247
479 HB1 ALA 59 3HB ALA 59 7.896 4.204 4.277
480 HB2 ALA 59 1HB ALA 59 6.870 2.771 4.144
481 HB3 ALA 59 2HB ALA 59 6.800 4.027 2.906
482 H ASP 60 H ASP 60 10.311 3.698 4.419
483 HA ASP 60 HA ASP 60 11.872 1.471 5.092
484 HB2 ASP 60 2HB ASP 60 12.462 3.856 5.634
485 HB3 ASP 60 1HB ASP 60 11.222 3.863 6.882
486 HA PRO 61 HA PRO 61 8.681 -0.967 7.413
487 HB2 PRO 61 2HB PRO 61 11.186 -2.559 8.005
488 HB3 PRO 61 1HB PRO 61 9.585 -3.129 7.472
489 HG2 PRO 61 2HG PRO 61 11.546 -3.030 5.723
490 HG3 PRO 61 1HG PRO 61 9.930 -2.447 5.250
491 HD2 PRO 61 2HD PRO 61 12.360 -0.837 6.045
492 HD3 PRO 61 1HD PRO 61 11.212 -0.562 4.713
493 H GLY 62 H GLY 62 11.618 0.443 8.671
494 HA2 GLY 62 2HA GLY 62 11.109 0.064 11.473
495 HA3 GLY 62 1HA GLY 62 12.228 1.205 10.750
496 H GLY 63 H GLY 63 9.532 1.972 9.195
497 HA2 GLY 63 2HA GLY 63 8.822 4.231 10.868
498 HA3 GLY 63 1HA GLY 63 8.210 3.867 9.262
499 H GLY 64 H GLY 64 7.476 1.093 10.033
500 HA2 GLY 64 2HA GLY 64 4.930 1.641 11.455
501 HA3 GLY 64 1HA GLY 64 5.263 0.280 10.391
502 HA PRO 65 HA PRO 65 5.629 -1.173 14.830
503 HB2 PRO 65 2HB PRO 65 4.245 -3.540 14.519
504 HB3 PRO 65 1HB PRO 65 3.451 -1.987 14.854
505 HG2 PRO 65 2HG PRO 65 3.747 -3.425 12.243
506 HG3 PRO 65 1HG PRO 65 2.348 -2.543 12.893
507 HD2 PRO 65 2HD PRO 65 4.047 -1.465 11.036
508 HD3 PRO 65 1HD PRO 65 3.161 -0.483 12.222
509 H SER 66 H SER 66 7.885 -1.355 14.417
510 HA SER 66 HA SER 66 9.078 -3.604 13.088
511 HB2 SER 66 2HB SER 66 10.242 -1.433 13.290
512 HB3 SER 66 1HB SER 66 10.286 -1.597 15.044
513 HG SER 66 HG SER 66 12.071 -2.437 13.330
514 H SER 67 H SER 67 7.889 -2.982 16.301
515 HA SER 67 HA SER 67 9.046 -5.220 17.639
516 HB2 SER 67 2HB SER 67 6.458 -3.727 18.268
517 HB3 SER 67 1HB SER 67 7.334 -4.796 19.373
518 HG SER 67 HG SER 67 8.632 -3.195 19.835
519 H ARG 68 H ARG 68 6.547 -4.874 15.317
520 HA ARG 68 HA ARG 68 5.221 -6.253 14.153
521 HB2 ARG 68 2HB ARG 68 6.811 -8.533 15.399
522 HB3 ARG 68 1HB ARG 68 5.821 -8.630 13.948
523 HG2 ARG 68 2HG ARG 68 7.386 -7.209 12.726
524 HG3 ARG 68 1HG ARG 68 8.319 -6.915 14.197
525 HD2 ARG 68 2HD ARG 68 8.822 -9.364 14.318
526 HD3 ARG 68 1HD ARG 68 7.993 -9.582 12.773
527 HE ARG 68 HE ARG 68 9.988 -7.624 12.454
528 HH11 ARG 68 1HH1 ARG 68 9.751 -11.097 13.018
529 HH12 ARG 68 2HH1 ARG 68 11.274 -11.449 12.259
530 HH21 ARG 68 1HH2 ARG 68 11.996 -8.085 11.490
531 HH22 ARG 68 2HH2 ARG 68 12.552 -9.728 11.390
532 H LEU 69 H LEU 69 3.299 -5.716 15.245
533 HA LEU 69 HA LEU 69 2.473 -6.878 17.713
534 HB2 LEU 69 2HB LEU 69 0.771 -5.571 15.556
535 HB3 LEU 69 1HB LEU 69 0.249 -5.906 17.200
536 HG LEU 69 HG LEU 69 2.355 -3.885 16.335
537 HD11 LEU 69 1HD1 LEU 69 -0.372 -3.484 17.608
538 HD12 LEU 69 2HD1 LEU 69 0.069 -3.140 15.932
539 HD13 LEU 69 3HD1 LEU 69 0.797 -2.211 17.237
540 HD21 LEU 69 3HD2 LEU 69 2.562 -3.242 18.706
541 HD22 LEU 69 1HD2 LEU 69 3.085 -4.905 18.440
542 HD23 LEU 69 2HD2 LEU 69 1.512 -4.583 19.171
543 H THR 70 H THR 70 1.383 -7.411 14.369
544 HA THR 70 HA THR 70 0.224 -10.035 15.013
545 HB THR 70 HB THR 70 0.315 -8.514 12.356
546 HG1 THR 70 HG1 THR 70 -0.903 -7.662 14.391
547 HG21 THR 70 3HG2 THR 70 -0.172 -10.949 12.102
548 HG22 THR 70 1HG2 THR 70 -1.561 -9.946 11.677
549 HG23 THR 70 2HG2 THR 70 -1.522 -10.785 13.228
550 H TRP 71 H TRP 71 1.130 -11.969 14.235
551 HA TRP 71 HA TRP 71 3.870 -11.956 13.196
552 HB2 TRP 71 2HB TRP 71 2.091 -14.407 13.595
553 HB3 TRP 71 1HB TRP 71 3.849 -14.357 13.513
554 HD1 TRP 71 HD1 TRP 71 5.090 -13.186 15.750
555 HE1 TRP 71 HE1 TRP 71 4.365 -13.290 18.215
556 HE3 TRP 71 HE3 TRP 71 0.190 -14.525 15.106
557 HZ2 TRP 71 HZ2 TRP 71 2.041 -13.877 19.694
558 HZ3 TRP 71 HZ3 TRP 71 -1.220 -14.842 17.101
559 HH2 TRP 71 HH2 TRP 71 -0.310 -14.524 19.350
560 H ARG 72 H ARG 72 0.725 -13.282 12.290
561 HA ARG 72 HA ARG 72 1.155 -12.954 9.415
562 HB2 ARG 72 2HB ARG 72 0.611 -15.648 10.753
563 HB3 ARG 72 1HB ARG 72 0.429 -15.361 9.029
564 HG2 ARG 72 2HG ARG 72 2.845 -14.936 8.834
565 HG3 ARG 72 1HG ARG 72 3.028 -15.176 10.573
566 HD2 ARG 72 2HD ARG 72 2.054 -17.278 8.606
567 HD3 ARG 72 1HD ARG 72 3.680 -17.181 9.288
568 HE ARG 72 HE ARG 72 2.008 -17.256 11.462
569 HH11 ARG 72 1HH1 ARG 72 2.557 -19.404 8.722
570 HH12 ARG 72 2HH1 ARG 72 2.138 -20.827 9.615
571 HH21 ARG 72 1HH2 ARG 72 1.501 -19.128 12.619
572 HH22 ARG 72 2HH2 ARG 72 1.539 -20.674 11.824
573 H VAL 73 H VAL 73 -0.714 -11.876 8.867
574 HA VAL 73 HA VAL 73 -3.140 -11.919 10.340
575 HB VAL 73 HB VAL 73 -2.530 -9.975 8.943
576 HG11 VAL 73 1HG1 VAL 73 -1.441 -11.039 7.063
577 HG12 VAL 73 2HG1 VAL 73 -2.758 -10.029 6.462
578 HG13 VAL 73 3HG1 VAL 73 -2.955 -11.781 6.545
579 HG21 VAL 73 3HG2 VAL 73 -4.912 -10.288 9.493
580 HG22 VAL 73 1HG2 VAL 73 -5.151 -11.218 8.013
581 HG23 VAL 73 2HG2 VAL 73 -4.730 -9.505 7.923
582 H GLN 74 H GLN 74 -2.185 -13.457 7.290
583 HA GLN 74 HA GLN 74 -4.337 -15.463 7.506
584 HB2 GLN 74 2HB GLN 74 -2.605 -14.484 5.213
585 HB3 GLN 74 1HB GLN 74 -3.238 -16.121 5.153
586 HG2 GLN 74 2HG GLN 74 -4.635 -14.558 3.884
587 HG3 GLN 74 1HG GLN 74 -5.531 -15.289 5.212
588 HE21 GLN 74 1HE2 GLN 74 -6.204 -13.983 6.922
589 HE22 GLN 74 2HE2 GLN 74 -6.188 -12.259 6.840
590 H ARG 75 H ARG 75 -3.750 -17.645 7.626
591 HA ARG 75 HA ARG 75 -0.947 -18.241 8.412
592 HB2 ARG 75 2HB ARG 75 -3.513 -19.725 9.144
593 HB3 ARG 75 1HB ARG 75 -1.889 -20.120 9.711
594 HG2 ARG 75 2HG ARG 75 -1.765 -18.026 10.963
595 HG3 ARG 75 1HG ARG 75 -3.323 -17.512 10.309
596 HD2 ARG 75 2HD ARG 75 -2.863 -19.897 12.136
597 HD3 ARG 75 1HD ARG 75 -3.565 -18.346 12.606
598 HE ARG 75 HE ARG 75 -4.893 -19.896 10.485
599 HH11 ARG 75 1HH1 ARG 75 -5.007 -18.740 13.816
600 HH12 ARG 75 2HH1 ARG 75 -6.683 -19.136 14.010
601 HH21 ARG 75 1HH2 ARG 75 -7.071 -20.452 10.787
602 HH22 ARG 75 2HH2 ARG 75 -7.851 -20.102 12.301
603 H SER 76 H SER 76 -3.557 -18.995 6.236
604 HA SER 76 HA SER 76 -2.823 -21.567 5.353
605 HB2 SER 76 2HB SER 76 -4.408 -19.401 3.916
606 HB3 SER 76 1HB SER 76 -4.347 -21.097 3.437
607 HG SER 76 HG SER 76 -6.152 -20.878 4.668
608 H GLN 77 H GLN 77 -2.002 -22.193 3.281
609 HA GLN 77 HA GLN 77 0.574 -21.019 2.824
610 HB2 GLN 77 2HB GLN 77 -0.792 -23.304 1.345
611 HB3 GLN 77 1HB GLN 77 0.931 -22.937 1.324
612 HG2 GLN 77 2HG GLN 77 1.116 -23.501 3.697
613 HG3 GLN 77 1HG GLN 77 -0.624 -23.767 3.793
614 HE21 GLN 77 1HE2 GLN 77 -1.514 -25.620 2.780
615 HE22 GLN 77 2HE2 GLN 77 -0.537 -26.984 2.368
616 H ASN 78 H ASN 78 -2.477 -21.041 1.070
617 HA ASN 78 HA ASN 78 -1.466 -20.333 -1.496
618 HB2 ASN 78 2HB ASN 78 -4.315 -20.162 -0.425
619 HB3 ASN 78 1HB ASN 78 -3.868 -19.949 -2.116
620 HD21 ASN 78 1HD2 ASN 78 -5.625 -21.928 -0.889
621 HD22 ASN 78 2HD2 ASN 78 -4.994 -23.471 -1.343
622 HA PRO 79 HA PRO 79 -2.933 -15.772 -0.630
623 HB2 PRO 79 2HB PRO 79 -3.509 -14.941 1.921
624 HB3 PRO 79 1HB PRO 79 -4.730 -15.677 0.860
625 HG2 PRO 79 2HG PRO 79 -3.119 -16.968 3.043
626 HG3 PRO 79 1HG PRO 79 -4.863 -17.093 2.709
627 HD2 PRO 79 2HD PRO 79 -3.121 -19.011 1.922
628 HD3 PRO 79 1HD PRO 79 -4.560 -18.599 0.961
629 H LEU 80 H LEU 80 -1.042 -17.275 2.001
630 HA LEU 80 HA LEU 80 0.796 -15.070 2.268
631 HB2 LEU 80 2HB LEU 80 0.922 -17.929 3.273
632 HB3 LEU 80 1HB LEU 80 2.200 -16.762 3.564
633 HG LEU 80 HG LEU 80 -0.645 -16.651 4.633
634 HD11 LEU 80 1HD1 LEU 80 2.007 -17.070 6.057
635 HD12 LEU 80 2HD1 LEU 80 0.787 -18.306 5.738
636 HD13 LEU 80 3HD1 LEU 80 0.418 -16.969 6.820
637 HD21 LEU 80 3HD2 LEU 80 0.022 -14.647 5.891
638 HD22 LEU 80 1HD2 LEU 80 0.116 -14.362 4.153
639 HD23 LEU 80 2HD2 LEU 80 1.593 -14.639 5.079
640 H LYS 81 H LYS 81 1.338 -14.783 0.062
641 HA LYS 81 HA LYS 81 3.815 -16.187 -0.572
642 HB2 LYS 81 2HB LYS 81 3.240 -16.390 -2.983
643 HB3 LYS 81 1HB LYS 81 2.234 -17.407 -1.960
644 HG2 LYS 81 2HG LYS 81 0.351 -15.867 -2.187
645 HG3 LYS 81 1HG LYS 81 1.358 -14.724 -3.086
646 HD2 LYS 81 2HD LYS 81 -0.141 -16.084 -4.569
647 HD3 LYS 81 1HD LYS 81 1.572 -16.277 -4.948
648 HE2 LYS 81 2HE LYS 81 1.604 -18.416 -3.708
649 HE3 LYS 81 1HE LYS 81 -0.107 -18.221 -3.325
650 HZ1 LYS 81 3HZ LYS 81 -0.672 -18.445 -5.595
651 HZ2 LYS 81 1HZ LYS 81 0.383 -19.713 -5.234
652 HZ3 LYS 81 2HZ LYS 81 0.933 -18.365 -6.098
653 H ILE 82 H ILE 82 4.809 -15.033 -2.562
654 HA ILE 82 HA ILE 82 4.372 -12.115 -2.503
655 HB ILE 82 HB ILE 82 6.857 -11.759 -2.580
656 HG12 ILE 82 2HG1 ILE 82 7.081 -14.730 -1.862
657 HG13 ILE 82 1HG1 ILE 82 7.493 -14.036 -3.424
658 HG21 ILE 82 1HG2 ILE 82 5.710 -11.463 -0.445
659 HG22 ILE 82 2HG2 ILE 82 7.331 -12.111 -0.187
660 HG23 ILE 82 3HG2 ILE 82 5.926 -13.172 -0.061
661 HD11 ILE 82 3HD1 ILE 82 9.480 -14.480 -2.127
662 HD12 ILE 82 1HD1 ILE 82 8.888 -13.465 -0.811
663 HD13 ILE 82 2HD1 ILE 82 9.292 -12.743 -2.370
664 H ARG 83 H ARG 83 5.520 -11.073 -4.335
665 HA ARG 83 HA ARG 83 6.809 -12.703 -6.328
666 HB2 ARG 83 2HB ARG 83 4.363 -12.642 -7.092
667 HB3 ARG 83 1HB ARG 83 4.513 -10.896 -7.258
668 HG2 ARG 83 2HG ARG 83 6.177 -11.138 -9.006
669 HG3 ARG 83 1HG ARG 83 6.276 -12.881 -8.746
670 HD2 ARG 83 2HD ARG 83 4.987 -12.493 -10.738
671 HD3 ARG 83 1HD ARG 83 3.876 -13.057 -9.486
672 HE ARG 83 HE ARG 83 3.979 -10.207 -9.582
673 HH11 ARG 83 1HH1 ARG 83 2.610 -12.970 -11.296
674 HH12 ARG 83 2HH1 ARG 83 1.277 -12.067 -11.938
675 HH21 ARG 83 1HH2 ARG 83 2.206 -9.042 -10.437
676 HH22 ARG 83 2HH2 ARG 83 1.055 -9.840 -11.445
677 H LEU 84 H LEU 84 8.243 -11.401 -7.606
678 HA LEU 84 HA LEU 84 9.265 -9.122 -6.229
679 HB2 LEU 84 2HB LEU 84 9.992 -10.277 -8.948
680 HB3 LEU 84 1HB LEU 84 10.892 -8.997 -8.147
681 HG LEU 84 HG LEU 84 10.581 -11.860 -7.155
682 HD11 LEU 84 1HD1 LEU 84 13.028 -10.442 -8.253
683 HD12 LEU 84 2HD1 LEU 84 12.088 -11.694 -9.072
684 HD13 LEU 84 3HD1 LEU 84 12.976 -12.083 -7.601
685 HD21 LEU 84 3HD2 LEU 84 10.682 -10.336 -5.249
686 HD22 LEU 84 1HD2 LEU 84 12.138 -9.576 -5.899
687 HD23 LEU 84 2HD2 LEU 84 12.175 -11.262 -5.377
688 H THR 85 H THR 85 7.435 -7.792 -6.195
689 HA THR 85 HA THR 85 6.252 -6.561 -8.482
690 HB THR 85 HB THR 85 5.379 -4.907 -6.751
691 HG1 THR 85 HG1 THR 85 7.262 -5.131 -5.341
692 HG21 THR 85 3HG2 THR 85 4.054 -6.941 -7.161
693 HG22 THR 85 1HG2 THR 85 3.999 -6.515 -5.448
694 HG23 THR 85 2HG2 THR 85 5.029 -7.841 -5.996
695 H ARG 86 H ARG 86 6.669 -4.426 -9.269
696 HA ARG 86 HA ARG 86 9.322 -3.290 -8.614
697 HB2 ARG 86 2HB ARG 86 8.823 -3.855 -11.026
698 HB3 ARG 86 1HB ARG 86 7.505 -2.688 -10.995
699 HG2 ARG 86 2HG ARG 86 9.219 -0.910 -10.421
700 HG3 ARG 86 1HG ARG 86 10.476 -2.117 -10.717
701 HD2 ARG 86 2HD ARG 86 10.151 -0.705 -12.689
702 HD3 ARG 86 1HD ARG 86 9.665 -2.366 -13.049
703 HE ARG 86 HE ARG 86 7.336 -1.197 -12.282
704 HH11 ARG 86 1HH1 ARG 86 9.720 -0.293 -14.726
705 HH12 ARG 86 2HH1 ARG 86 8.550 0.488 -15.742
706 HH21 ARG 86 1HH2 ARG 86 5.826 -0.171 -13.612
707 HH22 ARG 86 2HH2 ARG 86 6.333 0.556 -15.105
708 H GLU 87 H GLU 87 9.486 -1.190 -7.885
709 HA GLU 87 HA GLU 87 7.346 0.211 -6.703
710 HB2 GLU 87 2HB GLU 87 10.109 1.119 -7.610
711 HB3 GLU 87 1HB GLU 87 8.996 2.163 -6.734
712 HG2 GLU 87 2HG GLU 87 10.090 -0.459 -5.684
713 HG3 GLU 87 1HG GLU 87 10.735 1.134 -5.297
714 H ALA 88 H ALA 88 5.834 1.449 -7.596
715 HA ALA 88 HA ALA 88 5.632 1.841 -10.426
716 HB1 ALA 88 3HB ALA 88 3.523 2.974 -9.877
717 HB2 ALA 88 1HB ALA 88 3.956 2.970 -8.168
718 HB3 ALA 88 2HB ALA 88 3.666 1.443 -9.006
719 HA PRO 89 HA PRO 89 8.174 5.581 -10.744
720 HB2 PRO 89 2HB PRO 89 6.267 6.166 -13.029
721 HB3 PRO 89 1HB PRO 89 8.046 6.222 -12.998
722 HG2 PRO 89 2HG PRO 89 6.853 4.162 -14.139
723 HG3 PRO 89 1HG PRO 89 8.265 3.890 -13.090
724 HD2 PRO 89 2HD PRO 89 5.347 3.457 -12.466
725 HD3 PRO 89 1HD PRO 89 6.755 2.458 -12.034
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