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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|
520553 |
2xv9   |
6333 | cing | 1-original | 7 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 HA2 GLY -4 HA2 GLY -4 9.612 10.708 -9.758
2 HA3 GLY -4 HA3 GLY -4 9.258 10.784 -11.477
3 H1 GLY -4 H1 GLY -4 9.344 13.188 -11.354
4 H2 GLY -4 H2 GLY -4 10.789 12.514 -10.796
5 H SER -3 H SER -3 7.270 12.055 -12.065
6 HA SER -3 HA SER -3 5.195 11.640 -10.017
7 HB2 SER -3 HB2 SER -3 5.674 14.055 -10.607
8 HB3 SER -3 HB3 SER -3 5.098 13.700 -12.233
9 HG SER -3 HG SER -3 3.686 13.896 -9.829
No H/Q in entry = 9
In of MODEL 1
1 HA PRO -2 HA PRO -2 3.763 8.839 -13.245
2 HB2 PRO -2 HB2 PRO -2 1.982 7.523 -11.714
3 HB3 PRO -2 HB3 PRO -2 3.719 7.218 -11.609
4 HG2 PRO -2 HG2 PRO -2 1.973 8.869 -9.835
5 HG3 PRO -2 HG3 PRO -2 3.280 7.756 -9.395
6 HD2 PRO -2 HD2 PRO -2 3.566 10.476 -9.505
7 HD3 PRO -2 HD3 PRO -2 4.902 9.335 -9.755
8 H GLU -1 H GLU -1 2.888 10.916 -14.155
9 HA GLU -1 HA GLU -1 0.306 11.845 -13.434
10 HB2 GLU -1 HB2 GLU -1 1.813 12.210 -16.025
11 HB3 GLU -1 HB3 GLU -1 0.396 13.120 -15.533
12 HG2 GLU -1 HG2 GLU -1 1.697 13.941 -13.572
13 HG3 GLU -1 HG3 GLU -1 3.120 13.166 -14.271
14 H PHE 0 H PHE 0 -1.400 10.548 -13.571
15 HA PHE 0 HA PHE 0 -2.485 9.842 -16.072
16 HB2 PHE 0 HB2 PHE 0 -0.679 8.028 -15.704
17 HB3 PHE 0 HB3 PHE 0 -1.747 7.409 -14.450
18 HD1 PHE 0 HD1 PHE 0 -1.473 8.112 -18.059
19 HD2 PHE 0 HD2 PHE 0 -3.639 6.119 -14.992
20 HE1 PHE 0 HE1 PHE 0 -2.722 6.853 -19.766
21 HE2 PHE 0 HE2 PHE 0 -4.894 4.859 -16.689
22 HZ PHE 0 HZ PHE 0 -4.436 5.224 -19.081
23 H HIS 1 H HIS 1 -2.335 9.450 -12.631
24 HA HIS 1 HA HIS 1 -3.850 9.771 -11.000
25 HB2 HIS 1 HB2 HIS 1 -5.543 10.766 -13.282
26 HB3 HIS 1 HB3 HIS 1 -6.096 10.772 -11.611
27 HD1 HIS 1 HD1 HIS 1 -4.974 12.464 -9.992
28 HD2 HIS 1 HD2 HIS 1 -3.635 12.699 -13.920
29 HE1 HIS 1 HE1 HIS 1 -3.665 14.608 -10.135
30 HE2 HIS 1 HE2 HIS 1 -3.040 14.817 -12.566
31 H HIS 2 H HIS 2 -3.635 7.218 -12.460
32 HA HIS 2 HA HIS 2 -6.297 6.113 -11.894
33 HB2 HIS 2 HB2 HIS 2 -5.321 5.584 -14.105
34 HB3 HIS 2 HB3 HIS 2 -3.954 4.818 -13.304
35 HD1 HIS 2 HD1 HIS 2 -4.542 2.560 -14.475
36 HD2 HIS 2 HD2 HIS 2 -7.510 4.003 -11.941
37 HE1 HIS 2 HE1 HIS 2 -6.122 0.636 -14.114
38 HE2 HIS 2 HE2 HIS 2 -7.912 1.527 -12.581
39 H PHE 3 H PHE 3 -2.911 5.924 -11.015
40 HA PHE 3 HA PHE 3 -3.672 4.210 -8.746
41 HB2 PHE 3 HB2 PHE 3 -1.081 4.241 -10.303
42 HB3 PHE 3 HB3 PHE 3 -1.293 3.394 -8.775
43 HD1 PHE 3 HD1 PHE 3 -3.298 1.709 -8.705
44 HD2 PHE 3 HD2 PHE 3 -1.445 3.118 -12.267
45 HE1 PHE 3 HE1 PHE 3 -4.140 -0.256 -9.918
46 HE2 PHE 3 HE2 PHE 3 -2.287 1.156 -13.485
47 HZ PHE 3 HZ PHE 3 -3.654 -0.532 -12.297
48 H THR 4 H THR 4 -3.865 6.989 -8.649
49 HA THR 4 HA THR 4 -1.538 8.026 -7.301
50 HB THR 4 HB THR 4 -3.056 10.018 -6.915
51 HG1 THR 4 HG1 THR 4 -5.027 10.015 -8.042
52 HG21 THR 4 HG21 THR 4 -2.643 9.030 -9.736
53 HG22 THR 4 HG22 THR 4 -3.040 10.695 -9.295
54 HG23 THR 4 HG23 THR 4 -1.511 9.982 -8.774
55 H LEU 5 H LEU 5 -1.683 8.934 -5.143
56 HA LEU 5 HA LEU 5 -2.799 7.100 -3.290
57 HB2 LEU 5 HB2 LEU 5 -1.615 9.829 -2.796
58 HB3 LEU 5 HB3 LEU 5 -1.911 8.602 -1.580
59 HG LEU 5 HG LEU 5 0.052 8.383 -3.863
60 HD11 LEU 5 HD11 LEU 5 0.711 9.964 -2.107
61 HD12 LEU 5 HD12 LEU 5 0.505 8.690 -0.903
62 HD13 LEU 5 HD13 LEU 5 1.746 8.537 -2.147
63 HD21 LEU 5 HD21 LEU 5 -0.536 6.489 -1.589
64 HD22 LEU 5 HD22 LEU 5 -0.884 6.210 -3.296
65 HD23 LEU 5 HD23 LEU 5 0.787 6.327 -2.745
66 H GLU 6 H GLU 6 -3.794 10.242 -4.539
67 HA GLU 6 HA GLU 6 -6.023 10.632 -2.868
68 HB2 GLU 6 HB2 GLU 6 -5.843 11.258 -5.819
69 HB3 GLU 6 HB3 GLU 6 -6.934 11.997 -4.654
70 HG2 GLU 6 HG2 GLU 6 -5.374 13.608 -4.637
71 HG3 GLU 6 HG3 GLU 6 -4.588 12.544 -3.483
72 H SER 7 H SER 7 -5.672 8.699 -5.907
73 HA SER 7 HA SER 7 -8.308 7.908 -6.085
74 HB2 SER 7 HB2 SER 7 -6.510 7.509 -7.789
75 HB3 SER 7 HB3 SER 7 -5.931 6.178 -6.787
76 HG SER 7 HG SER 7 -8.625 6.071 -7.278
77 H SER 8 H SER 8 -6.041 7.020 -3.663
78 HA SER 8 HA SER 8 -7.620 4.670 -2.985
79 HB2 SER 8 HB2 SER 8 -4.951 5.505 -1.869
80 HB3 SER 8 HB3 SER 8 -5.825 4.005 -1.505
81 HG SER 8 HG SER 8 -4.664 4.825 -3.963
82 H LEU 9 H LEU 9 -7.378 7.945 -1.967
83 HA LEU 9 HA LEU 9 -7.071 7.647 0.753
84 HB2 LEU 9 HB2 LEU 9 -8.403 9.832 -0.790
85 HB3 LEU 9 HB3 LEU 9 -7.972 9.939 0.910
86 HG LEU 9 HG LEU 9 -5.980 9.379 -1.273
87 HD11 LEU 9 HD11 LEU 9 -7.088 11.532 -1.566
88 HD12 LEU 9 HD12 LEU 9 -6.594 11.995 0.062
89 HD13 LEU 9 HD13 LEU 9 -5.374 11.686 -1.176
90 HD21 LEU 9 HD21 LEU 9 -5.663 10.211 1.608
91 HD22 LEU 9 HD22 LEU 9 -5.284 8.628 0.928
92 HD23 LEU 9 HD23 LEU 9 -4.351 10.048 0.443
93 H ASP 10 H ASP 10 -10.050 7.470 -0.994
94 HA ASP 10 HA ASP 10 -11.467 7.113 1.544
95 HB2 ASP 10 HB2 ASP 10 -12.455 7.561 -1.263
96 HB3 ASP 10 HB3 ASP 10 -13.523 7.138 0.072
97 H THR 11 H THR 11 -9.773 5.216 -0.417
98 HA THR 11 HA THR 11 -11.562 2.939 0.048
99 HB THR 11 HB THR 11 -10.539 1.860 -1.985
100 HG1 THR 11 HG1 THR 11 -9.924 4.203 -3.219
101 HG21 THR 11 HG21 THR 11 -12.115 4.397 -2.433
102 HG22 THR 11 HG22 THR 11 -11.956 3.071 -3.583
103 HG23 THR 11 HG23 THR 11 -12.787 2.812 -2.049
104 H HIS 12 H HIS 12 -8.450 2.551 -1.408
105 HA HIS 12 HA HIS 12 -7.653 0.622 0.430
106 HB2 HIS 12 HB2 HIS 12 -5.592 2.131 -1.139
107 HB3 HIS 12 HB3 HIS 12 -5.660 0.415 -0.773
108 HD1 HIS 12 HD1 HIS 12 -5.836 2.457 -3.577
109 HD2 HIS 12 HD2 HIS 12 -8.280 -0.592 -2.156
110 HE1 HIS 12 HE1 HIS 12 -7.114 1.621 -5.578
111 HE2 HIS 12 HE2 HIS 12 -8.675 -0.138 -4.673
112 H LEU 13 H LEU 13 -6.988 4.087 0.366
113 HA LEU 13 HA LEU 13 -5.143 3.714 2.635
114 HB2 LEU 13 HB2 LEU 13 -5.152 5.575 0.332
115 HB3 LEU 13 HB3 LEU 13 -4.541 6.178 1.858
116 HG LEU 13 HG LEU 13 -2.684 5.394 0.555
117 HD11 LEU 13 HD11 LEU 13 -2.681 4.934 2.995
118 HD12 LEU 13 HD12 LEU 13 -3.249 3.301 2.643
119 HD13 LEU 13 HD13 LEU 13 -1.674 3.837 2.056
120 HD21 LEU 13 HD21 LEU 13 -4.145 2.767 0.356
121 HD22 LEU 13 HD22 LEU 13 -3.816 3.891 -0.963
122 HD23 LEU 13 HD23 LEU 13 -2.485 3.053 -0.167
123 H LYS 14 H LYS 14 -8.060 3.969 2.693
124 HA LYS 14 HA LYS 14 -8.727 6.595 3.582
125 HB2 LYS 14 HB2 LYS 14 -10.914 5.723 4.067
126 HB3 LYS 14 HB3 LYS 14 -10.371 5.121 2.516
127 HG2 LYS 14 HG2 LYS 14 -9.888 2.966 3.473
128 HG3 LYS 14 HG3 LYS 14 -10.286 3.562 5.088
129 HD2 LYS 14 HD2 LYS 14 -12.577 3.953 4.413
130 HD3 LYS 14 HD3 LYS 14 -12.200 3.475 2.759
131 HE2 LYS 14 HE2 LYS 14 -11.751 1.222 3.459
132 HE3 LYS 14 HE3 LYS 14 -11.935 1.669 5.155
133 HZ1 LYS 14 HZ1 LYS 14 -14.258 2.250 4.665
134 HZ2 LYS 14 HZ2 LYS 14 -14.063 1.689 3.083
135 HZ3 LYS 14 HZ3 LYS 14 -13.930 0.615 4.386
136 H TRP 15 H TRP 15 -7.269 3.980 5.121
137 HA TRP 15 HA TRP 15 -8.213 4.469 7.784
138 HB2 TRP 15 HB2 TRP 15 -6.342 2.927 8.420
139 HB3 TRP 15 HB3 TRP 15 -7.449 2.250 7.225
140 HD1 TRP 15 HD1 TRP 15 -6.544 1.997 4.719
141 HE1 TRP 15 HE1 TRP 15 -4.159 1.846 3.769
142 HE3 TRP 15 HE3 TRP 15 -3.949 3.745 8.764
143 HZ2 TRP 15 HZ2 TRP 15 -1.521 2.392 4.627
144 HZ3 TRP 15 HZ3 TRP 15 -1.498 3.896 8.616
145 HH2 TRP 15 HH2 TRP 15 -0.312 3.233 6.589
146 H LEU 16 H LEU 16 -6.107 6.095 5.750
147 HA LEU 16 HA LEU 16 -4.277 7.095 7.725
148 HB2 LEU 16 HB2 LEU 16 -5.062 8.185 5.014
149 HB3 LEU 16 HB3 LEU 16 -3.765 8.816 6.005
150 HG LEU 16 HG LEU 16 -3.786 5.992 4.942
151 HD11 LEU 16 HD11 LEU 16 -2.527 8.467 3.770
152 HD12 LEU 16 HD12 LEU 16 -2.251 6.818 3.212
153 HD13 LEU 16 HD13 LEU 16 -3.854 7.542 3.073
154 HD21 LEU 16 HD21 LEU 16 -1.570 7.748 6.008
155 HD22 LEU 16 HD22 LEU 16 -2.303 6.380 6.851
156 HD23 LEU 16 HD23 LEU 16 -1.378 6.116 5.371
157 H SER 17 H SER 17 -4.362 9.005 8.774
158 HA SER 17 HA SER 17 -6.978 10.174 9.173
159 HB2 SER 17 HB2 SER 17 -4.325 10.996 10.367
160 HB3 SER 17 HB3 SER 17 -5.928 11.442 10.951
161 HG SER 17 HG SER 17 -5.949 8.839 10.844
162 H GLN 18 H GLN 18 -7.239 12.610 9.035
163 HA GLN 18 HA GLN 18 -6.797 13.359 6.391
164 HB2 GLN 18 HB2 GLN 18 -8.582 14.326 7.803
165 HB3 GLN 18 HB3 GLN 18 -7.368 15.185 8.741
166 HG2 GLN 18 HG2 GLN 18 -8.346 16.720 7.211
167 HG3 GLN 18 HG3 GLN 18 -6.702 16.385 6.673
168 HE21 GLN 18 HE21 GLN 18 -8.943 17.406 5.164
169 HE22 GLN 18 HE22 GLN 18 -9.214 16.300 3.867
170 H GLU 19 H GLU 19 -5.059 14.403 9.306
171 HA GLU 19 HA GLU 19 -3.308 16.172 8.072
172 HB2 GLU 19 HB2 GLU 19 -3.016 14.438 10.524
173 HB3 GLU 19 HB3 GLU 19 -1.861 15.652 10.059
174 HG2 GLU 19 HG2 GLU 19 -3.632 17.365 10.222
175 HG3 GLU 19 HG3 GLU 19 -4.724 16.110 10.810
176 H GLN 20 H GLN 20 -3.187 12.662 8.430
177 HA GLN 20 HA GLN 20 -0.524 12.393 7.454
178 HB2 GLN 20 HB2 GLN 20 -2.784 10.376 7.565
179 HB3 GLN 20 HB3 GLN 20 -1.113 9.986 7.181
180 HG2 GLN 20 HG2 GLN 20 -0.411 10.660 9.393
181 HG3 GLN 20 HG3 GLN 20 -2.052 11.173 9.785
182 HE21 GLN 20 HE21 GLN 20 -0.352 9.183 11.086
183 HE22 GLN 20 HE22 GLN 20 -1.230 7.694 11.036
184 H LYS 21 H LYS 21 -3.752 11.989 5.998
185 HA LYS 21 HA LYS 21 -2.973 11.310 3.407
186 HB2 LYS 21 HB2 LYS 21 -5.336 12.977 4.295
187 HB3 LYS 21 HB3 LYS 21 -5.143 12.303 2.684
188 HG2 LYS 21 HG2 LYS 21 -5.166 10.045 3.640
189 HG3 LYS 21 HG3 LYS 21 -5.404 10.741 5.244
190 HD2 LYS 21 HD2 LYS 21 -7.518 11.697 4.557
191 HD3 LYS 21 HD3 LYS 21 -7.267 11.136 2.904
192 HE2 LYS 21 HE2 LYS 21 -7.321 8.821 3.681
193 HE3 LYS 21 HE3 LYS 21 -7.556 9.378 5.337
194 HZ1 LYS 21 HZ1 LYS 21 -9.423 9.867 3.083
195 HZ2 LYS 21 HZ2 LYS 21 -9.636 8.712 4.294
196 HZ3 LYS 21 HZ3 LYS 21 -9.652 10.355 4.682
197 H ASP 22 H ASP 22 -3.664 14.494 4.759
198 HA ASP 22 HA ASP 22 -2.965 16.047 2.525
199 HB2 ASP 22 HB2 ASP 22 -4.257 16.876 4.454
200 HB3 ASP 22 HB3 ASP 22 -2.833 16.720 5.473
201 H GLU 23 H GLU 23 -0.985 14.674 5.140
202 HA GLU 23 HA GLU 23 1.429 15.935 4.486
203 HB2 GLU 23 HB2 GLU 23 0.597 13.975 6.278
204 HB3 GLU 23 HB3 GLU 23 1.785 13.171 5.251
205 HG2 GLU 23 HG2 GLU 23 3.365 14.928 5.676
206 HG3 GLU 23 HG3 GLU 23 2.178 15.770 6.662
207 H LEU 24 H LEU 24 0.151 12.784 3.281
208 HA LEU 24 HA LEU 24 2.257 12.328 1.507
209 HB2 LEU 24 HB2 LEU 24 -0.633 11.501 1.257
210 HB3 LEU 24 HB3 LEU 24 0.688 10.846 0.315
211 HG LEU 24 HG LEU 24 0.768 9.241 1.835
212 HD11 LEU 24 HD11 LEU 24 2.745 10.467 2.511
213 HD12 LEU 24 HD12 LEU 24 1.785 11.314 3.726
214 HD13 LEU 24 HD13 LEU 24 2.020 9.572 3.845
215 HD21 LEU 24 HD21 LEU 24 -1.445 9.785 2.609
216 HD22 LEU 24 HD22 LEU 24 -0.423 9.233 3.934
217 HD23 LEU 24 HD23 LEU 24 -0.764 10.952 3.741
218 H LEU 25 H LEU 25 -0.948 13.828 0.857
219 HA LEU 25 HA LEU 25 -0.600 14.636 -1.709
220 HB2 LEU 25 HB2 LEU 25 -2.045 15.775 0.634
221 HB3 LEU 25 HB3 LEU 25 -1.966 16.715 -0.847
222 HG LEU 25 HG LEU 25 -2.908 14.759 -2.043
223 HD11 LEU 25 HD11 LEU 25 -2.314 13.012 -0.500
224 HD12 LEU 25 HD12 LEU 25 -3.440 13.675 0.686
225 HD13 LEU 25 HD13 LEU 25 -4.045 13.023 -0.838
226 HD21 LEU 25 HD21 LEU 25 -4.578 15.927 0.159
227 HD22 LEU 25 HD22 LEU 25 -4.308 16.634 -1.436
228 HD23 LEU 25 HD23 LEU 25 -5.208 15.125 -1.280
229 H LYS 26 H LYS 26 0.559 16.318 1.207
230 HA LYS 26 HA LYS 26 1.544 18.601 -0.092
231 HB2 LYS 26 HB2 LYS 26 1.222 18.493 2.331
232 HB3 LYS 26 HB3 LYS 26 2.489 17.282 2.458
233 HG2 LYS 26 HG2 LYS 26 3.671 19.124 3.057
234 HG3 LYS 26 HG3 LYS 26 3.935 19.174 1.317
235 HD2 LYS 26 HD2 LYS 26 1.763 20.701 2.750
236 HD3 LYS 26 HD3 LYS 26 3.337 21.375 2.342
237 HE2 LYS 26 HE2 LYS 26 2.849 20.877 -0.055
238 HE3 LYS 26 HE3 LYS 26 1.224 20.394 0.432
239 HZ1 LYS 26 HZ1 LYS 26 0.859 22.614 1.300
240 HZ2 LYS 26 HZ2 LYS 26 2.413 23.078 0.832
241 HZ3 LYS 26 HZ3 LYS 26 1.265 22.675 -0.339
242 H MET 27 H MET 27 3.243 15.635 0.896
243 HA MET 27 HA MET 27 5.705 16.285 -0.226
244 HB2 MET 27 HB2 MET 27 4.462 13.565 0.149
245 HB3 MET 27 HB3 MET 27 6.149 13.846 -0.255
246 HG2 MET 27 HG2 MET 27 6.046 15.353 1.909
247 HG3 MET 27 HG3 MET 27 4.706 14.273 2.296
248 HE1 MET 27 HE1 MET 27 5.017 11.546 2.111
249 HE2 MET 27 HE2 MET 27 5.903 11.700 0.594
250 HE3 MET 27 HE3 MET 27 6.593 10.776 1.928
251 H LYS 28 H LYS 28 3.052 14.397 -1.724
252 HA LYS 28 HA LYS 28 4.393 13.876 -4.146
253 HB2 LYS 28 HB2 LYS 28 2.327 12.752 -3.256
254 HB3 LYS 28 HB3 LYS 28 1.419 14.174 -3.746
255 HG2 LYS 28 HG2 LYS 28 3.111 12.918 -5.813
256 HG3 LYS 28 HG3 LYS 28 1.706 12.001 -5.277
257 HD2 LYS 28 HD2 LYS 28 1.570 14.870 -6.184
258 HD3 LYS 28 HD3 LYS 28 1.331 13.496 -7.266
259 HE2 LYS 28 HE2 LYS 28 -0.497 12.721 -5.753
260 HE3 LYS 28 HE3 LYS 28 -0.315 14.220 -4.847
261 HZ1 LYS 28 HZ1 LYS 28 -0.912 14.132 -7.746
262 HZ2 LYS 28 HZ2 LYS 28 -2.111 14.219 -6.553
263 HZ3 LYS 28 HZ3 LYS 28 -0.983 15.475 -6.723
264 H LYS 29 H LYS 29 2.297 16.524 -3.117
265 HA LYS 29 HA LYS 29 2.267 17.849 -5.613
266 HB2 LYS 29 HB2 LYS 29 0.599 18.177 -3.794
267 HB3 LYS 29 HB3 LYS 29 1.816 19.050 -2.879
268 HG2 LYS 29 HG2 LYS 29 1.923 20.759 -4.577
269 HG3 LYS 29 HG3 LYS 29 0.791 19.862 -5.590
270 HD2 LYS 29 HD2 LYS 29 -0.917 20.086 -3.823
271 HD3 LYS 29 HD3 LYS 29 0.221 21.049 -2.875
272 HE2 LYS 29 HE2 LYS 29 -0.825 21.742 -5.617
273 HE3 LYS 29 HE3 LYS 29 -1.357 22.464 -4.099
274 HZ1 LYS 29 HZ1 LYS 29 1.395 22.616 -5.200
275 HZ2 LYS 29 HZ2 LYS 29 0.249 23.857 -5.254
276 HZ3 LYS 29 HZ3 LYS 29 0.861 23.336 -3.771
277 H ASP 30 H ASP 30 4.559 17.892 -2.980
278 HA ASP 30 HA ASP 30 5.775 20.343 -3.955
279 HB2 ASP 30 HB2 ASP 30 5.541 19.874 -1.498
280 HB3 ASP 30 HB3 ASP 30 6.692 18.557 -1.681
281 H GLY 31 H GLY 31 5.849 17.269 -4.880
282 HA2 GLY 31 HA2 GLY 31 8.286 17.769 -6.385
283 HA3 GLY 31 HA3 GLY 31 7.064 16.561 -6.746
284 H LYS 32 H LYS 32 7.235 15.807 -3.785
285 HA LYS 32 HA LYS 32 9.778 14.581 -3.494
286 HB2 LYS 32 HB2 LYS 32 7.123 14.011 -2.168
287 HB3 LYS 32 HB3 LYS 32 8.633 13.232 -1.719
288 HG2 LYS 32 HG2 LYS 32 8.117 16.196 -1.588
289 HG3 LYS 32 HG3 LYS 32 8.030 15.085 -0.221
290 HD2 LYS 32 HD2 LYS 32 10.407 14.486 -0.626
291 HD3 LYS 32 HD3 LYS 32 10.464 15.722 -1.883
292 HE2 LYS 32 HE2 LYS 32 9.987 17.448 -0.272
293 HE3 LYS 32 HE3 LYS 32 9.762 16.246 1.000
294 HZ1 LYS 32 HZ1 LYS 32 12.302 16.762 -0.448
295 HZ2 LYS 32 HZ2 LYS 32 11.941 17.293 1.113
296 HZ3 LYS 32 HZ3 LYS 32 12.084 15.639 0.798
297 H ALA 33 H ALA 33 10.248 12.392 -3.688
298 HA ALA 33 HA ALA 33 9.216 11.182 -6.058
299 HB1 ALA 33 HB1 ALA 33 11.571 10.958 -5.375
300 HB2 ALA 33 HB2 ALA 33 10.794 9.390 -5.603
301 HB3 ALA 33 HB3 ALA 33 11.059 10.013 -3.975
302 H LYS 34 H LYS 34 7.993 9.319 -6.270
303 HA LYS 34 HA LYS 34 5.916 8.808 -4.510
304 HB2 LYS 34 HB2 LYS 34 5.507 6.794 -5.766
305 HB3 LYS 34 HB3 LYS 34 5.933 8.114 -6.846
306 HG2 LYS 34 HG2 LYS 34 8.271 7.213 -6.825
307 HG3 LYS 34 HG3 LYS 34 7.630 5.788 -6.011
308 HD2 LYS 34 HD2 LYS 34 6.875 6.822 -8.739
309 HD3 LYS 34 HD3 LYS 34 7.750 5.336 -8.369
310 HE2 LYS 34 HE2 LYS 34 5.693 4.620 -7.070
311 HE3 LYS 34 HE3 LYS 34 4.864 5.988 -7.815
312 HZ1 LYS 34 HZ1 LYS 34 5.486 5.043 -9.998
313 HZ2 LYS 34 HZ2 LYS 34 6.111 3.687 -9.205
314 HZ3 LYS 34 HZ3 LYS 34 4.457 4.041 -9.106
315 H LYS 35 H LYS 35 9.130 7.391 -4.632
316 HA LYS 35 HA LYS 35 8.698 5.289 -2.816
317 HB2 LYS 35 HB2 LYS 35 11.266 6.784 -3.346
318 HB3 LYS 35 HB3 LYS 35 11.128 5.192 -2.610
319 HG2 LYS 35 HG2 LYS 35 10.418 5.944 -5.437
320 HG3 LYS 35 HG3 LYS 35 11.776 4.949 -4.910
321 HD2 LYS 35 HD2 LYS 35 10.223 3.262 -4.068
322 HD3 LYS 35 HD3 LYS 35 8.856 4.267 -4.552
323 HE2 LYS 35 HE2 LYS 35 9.173 2.581 -6.219
324 HE3 LYS 35 HE3 LYS 35 9.663 4.132 -6.898
325 HZ1 LYS 35 HZ1 LYS 35 11.976 3.534 -6.404
326 HZ2 LYS 35 HZ2 LYS 35 11.466 2.020 -5.855
327 HZ3 LYS 35 HZ3 LYS 35 11.252 2.445 -7.477
328 H GLU 36 H GLU 36 8.858 8.663 -2.267
329 HA GLU 36 HA GLU 36 9.674 8.422 0.498
330 HB2 GLU 36 HB2 GLU 36 8.545 10.804 -0.980
331 HB3 GLU 36 HB3 GLU 36 9.330 10.829 0.594
332 HG2 GLU 36 HG2 GLU 36 11.389 9.974 -0.487
333 HG3 GLU 36 HG3 GLU 36 10.584 10.140 -2.039
334 H LEU 37 H LEU 37 6.846 8.612 -1.434
335 HA LEU 37 HA LEU 37 4.965 8.809 0.688
336 HB2 LEU 37 HB2 LEU 37 4.770 7.893 -2.176
337 HB3 LEU 37 HB3 LEU 37 3.388 8.020 -1.109
338 HG LEU 37 HG LEU 37 3.569 9.920 -2.616
339 HD11 LEU 37 HD11 LEU 37 2.510 10.227 -0.454
340 HD12 LEU 37 HD12 LEU 37 4.071 10.649 0.250
341 HD13 LEU 37 HD13 LEU 37 3.339 11.698 -0.964
342 HD21 LEU 37 HD21 LEU 37 5.958 10.071 -2.915
343 HD22 LEU 37 HD22 LEU 37 5.295 11.611 -2.368
344 HD23 LEU 37 HD23 LEU 37 6.146 10.563 -1.233
345 H GLU 38 H GLU 38 6.286 6.178 -1.255
346 HA GLU 38 HA GLU 38 4.991 3.979 -0.177
347 HB2 GLU 38 HB2 GLU 38 6.500 3.801 -2.080
348 HB3 GLU 38 HB3 GLU 38 7.866 4.275 -1.080
349 HG2 GLU 38 HG2 GLU 38 7.164 2.149 0.300
350 HG3 GLU 38 HG3 GLU 38 6.435 1.678 -1.234
351 H ALA 39 H ALA 39 7.364 6.037 1.209
352 HA ALA 39 HA ALA 39 8.167 4.116 3.235
353 HB1 ALA 39 HB1 ALA 39 9.116 6.932 2.755
354 HB2 ALA 39 HB2 ALA 39 9.834 5.754 3.854
355 HB3 ALA 39 HB3 ALA 39 9.863 5.469 2.114
356 H LYS 40 H LYS 40 6.470 7.214 3.081
357 HA LYS 40 HA LYS 40 6.001 7.503 5.825
358 HB2 LYS 40 HB2 LYS 40 4.550 8.395 3.350
359 HB3 LYS 40 HB3 LYS 40 3.872 8.694 4.939
360 HG2 LYS 40 HG2 LYS 40 6.626 9.563 4.173
361 HG3 LYS 40 HG3 LYS 40 5.204 10.564 3.903
362 HD2 LYS 40 HD2 LYS 40 4.715 10.474 6.312
363 HD3 LYS 40 HD3 LYS 40 6.180 9.518 6.560
364 HE2 LYS 40 HE2 LYS 40 7.560 11.329 5.811
365 HE3 LYS 40 HE3 LYS 40 6.149 12.267 5.329
366 HZ1 LYS 40 HZ1 LYS 40 6.767 11.465 8.117
367 HZ2 LYS 40 HZ2 LYS 40 7.096 12.986 7.457
368 HZ3 LYS 40 HZ3 LYS 40 5.490 12.462 7.614
369 H ILE 41 H ILE 41 4.000 6.026 3.274
370 HA ILE 41 HA ILE 41 1.913 5.225 4.948
371 HB ILE 41 HB ILE 41 2.815 4.124 2.292
372 HG12 ILE 41 HG12 ILE 41 0.604 6.064 2.999
373 HG13 ILE 41 HG13 ILE 41 2.188 6.536 2.390
374 HG21 ILE 41 HG21 ILE 41 1.436 2.490 3.460
375 HG22 ILE 41 HG22 ILE 41 0.204 3.717 3.744
376 HG23 ILE 41 HG23 ILE 41 0.561 3.192 2.100
377 HD11 ILE 41 HD11 ILE 41 0.170 4.853 0.939
378 HD12 ILE 41 HD12 ILE 41 0.522 6.556 0.638
379 HD13 ILE 41 HD13 ILE 41 1.756 5.332 0.327
380 H LEU 42 H LEU 42 4.816 3.469 3.874
381 HA LEU 42 HA LEU 42 4.146 1.030 5.121
382 HB2 LEU 42 HB2 LEU 42 6.768 2.233 4.299
383 HB3 LEU 42 HB3 LEU 42 6.690 0.686 5.107
384 HG LEU 42 HG LEU 42 5.588 1.401 2.401
385 HD11 LEU 42 HD11 LEU 42 7.649 -0.586 3.321
386 HD12 LEU 42 HD12 LEU 42 7.074 -0.413 1.665
387 HD13 LEU 42 HD13 LEU 42 7.949 0.911 2.440
388 HD21 LEU 42 HD21 LEU 42 5.134 -1.076 4.053
389 HD22 LEU 42 HD22 LEU 42 3.918 0.004 3.369
390 HD23 LEU 42 HD23 LEU 42 4.895 -1.016 2.309
391 H HIS 43 H HIS 43 5.886 3.876 6.273
392 HA HIS 43 HA HIS 43 6.498 2.918 8.852
393 HB2 HIS 43 HB2 HIS 43 7.479 4.990 8.006
394 HB3 HIS 43 HB3 HIS 43 5.891 5.744 7.940
395 HD1 HIS 43 HD1 HIS 43 8.432 4.495 10.452
396 HD2 HIS 43 HD2 HIS 43 5.041 6.894 10.283
397 HE1 HIS 43 HE1 HIS 43 8.263 5.590 12.708
398 HE2 HIS 43 HE2 HIS 43 6.279 7.133 12.538
399 H TYR 44 H TYR 44 3.666 4.790 7.684
400 HA TYR 44 HA TYR 44 2.269 4.916 10.096
401 HB2 TYR 44 HB2 TYR 44 1.155 4.693 7.286
402 HB3 TYR 44 HB3 TYR 44 0.234 5.190 8.702
403 HD1 TYR 44 HD1 TYR 44 2.326 6.901 10.001
404 HD2 TYR 44 HD2 TYR 44 1.024 6.648 5.964
405 HE1 TYR 44 HE1 TYR 44 3.021 9.212 9.641
406 HE2 TYR 44 HE2 TYR 44 1.728 8.976 5.577
407 HH TYR 44 HH TYR 44 2.122 11.012 6.896
408 H TYR 45 H TYR 45 2.310 2.520 7.565
409 HA TYR 45 HA TYR 45 0.351 0.750 8.360
410 HB2 TYR 45 HB2 TYR 45 1.501 0.748 6.202
411 HB3 TYR 45 HB3 TYR 45 2.998 0.275 6.981
412 HD1 TYR 45 HD1 TYR 45 -0.499 -0.949 6.985
413 HD2 TYR 45 HD2 TYR 45 3.615 -1.884 6.524
414 HE1 TYR 45 HE1 TYR 45 -1.089 -3.299 6.657
415 HE2 TYR 45 HE2 TYR 45 3.046 -4.254 6.180
416 HH TYR 45 HH TYR 45 -0.256 -5.304 5.790
417 H ASP 46 H ASP 46 3.833 0.661 9.164
418 HA ASP 46 HA ASP 46 3.527 -1.726 10.708
419 HB2 ASP 46 HB2 ASP 46 5.647 -1.039 9.516
420 HB3 ASP 46 HB3 ASP 46 5.869 0.196 10.750
421 H GLU 47 H GLU 47 3.061 1.604 11.427
422 HA GLU 47 HA GLU 47 3.552 1.236 14.267
423 HB2 GLU 47 HB2 GLU 47 2.829 3.641 12.604
424 HB3 GLU 47 HB3 GLU 47 2.963 3.686 14.356
425 HG2 GLU 47 HG2 GLU 47 5.189 2.791 12.557
426 HG3 GLU 47 HG3 GLU 47 4.978 4.455 13.089
427 H LEU 48 H LEU 48 1.129 0.312 12.402
428 HA LEU 48 HA LEU 48 -1.140 1.671 13.404
429 HB2 LEU 48 HB2 LEU 48 -0.719 -0.821 11.792
430 HB3 LEU 48 HB3 LEU 48 -2.321 -0.291 12.245
431 HG LEU 48 HG LEU 48 -0.366 1.309 10.615
432 HD11 LEU 48 HD11 LEU 48 -1.270 -0.626 9.421
433 HD12 LEU 48 HD12 LEU 48 -2.906 -0.093 9.813
434 HD13 LEU 48 HD13 LEU 48 -1.882 0.894 8.772
435 HD21 LEU 48 HD21 LEU 48 -3.182 1.852 11.528
436 HD22 LEU 48 HD22 LEU 48 -1.729 2.788 11.883
437 HD23 LEU 48 HD23 LEU 48 -2.370 2.752 10.244
438 H GLU 49 H GLU 49 -2.863 -0.489 13.791
439 HA GLU 49 HA GLU 49 -2.182 -1.285 16.521
440 HB2 GLU 49 HB2 GLU 49 -4.713 0.174 15.722
441 HB3 GLU 49 HB3 GLU 49 -4.393 -0.501 17.315
442 HG2 GLU 49 HG2 GLU 49 -2.579 1.036 17.663
443 HG3 GLU 49 HG3 GLU 49 -2.722 1.637 16.013
444 H GLY 50 H GLY 50 -4.470 -2.501 17.297
445 HA2 GLY 50 HA2 GLY 50 -5.672 -4.447 17.083
446 HA3 GLY 50 HA3 GLY 50 -4.211 -5.023 16.306
447 H ASP 51 H ASP 51 -7.340 -3.487 15.689
448 HA ASP 51 HA ASP 51 -7.621 -5.048 13.277
449 HB2 ASP 51 HB2 ASP 51 -9.847 -4.337 13.212
450 HB3 ASP 51 HB3 ASP 51 -9.497 -4.367 14.935
451 H ALA 52 H ALA 52 -6.497 -1.887 14.084
452 HA ALA 52 HA ALA 52 -7.091 -0.535 11.682
453 HB1 ALA 52 HB1 ALA 52 -4.727 -0.122 13.527
454 HB2 ALA 52 HB2 ALA 52 -5.300 1.017 12.310
455 HB3 ALA 52 HB3 ALA 52 -6.312 0.629 13.700
456 H LYS 53 H LYS 53 -4.272 -2.387 12.707
457 HA LYS 53 HA LYS 53 -2.767 -2.069 10.328
458 HB2 LYS 53 HB2 LYS 53 -2.051 -2.825 12.712
459 HB3 LYS 53 HB3 LYS 53 -2.521 -4.429 12.168
460 HG2 LYS 53 HG2 LYS 53 -0.610 -2.772 10.576
461 HG3 LYS 53 HG3 LYS 53 -0.064 -3.714 11.964
462 HD2 LYS 53 HD2 LYS 53 -0.871 -5.743 10.959
463 HD3 LYS 53 HD3 LYS 53 -1.580 -4.841 9.620
464 HE2 LYS 53 HE2 LYS 53 0.525 -4.242 8.772
465 HE3 LYS 53 HE3 LYS 53 1.347 -4.725 10.254
466 HZ1 LYS 53 HZ1 LYS 53 0.688 -7.037 9.752
467 HZ2 LYS 53 HZ2 LYS 53 0.027 -6.519 8.283
468 HZ3 LYS 53 HZ3 LYS 53 1.690 -6.380 8.561
469 H LYS 54 H LYS 54 -4.755 -4.738 11.566
470 HA LYS 54 HA LYS 54 -4.616 -6.457 9.401
471 HB2 LYS 54 HB2 LYS 54 -5.903 -7.646 10.744
472 HB3 LYS 54 HB3 LYS 54 -6.118 -6.241 11.772
473 HG2 LYS 54 HG2 LYS 54 -8.139 -5.670 10.781
474 HG3 LYS 54 HG3 LYS 54 -7.831 -6.664 9.350
475 HD2 LYS 54 HD2 LYS 54 -7.966 -8.671 10.745
476 HD3 LYS 54 HD3 LYS 54 -8.309 -7.669 12.152
477 HE2 LYS 54 HE2 LYS 54 -10.341 -6.833 11.003
478 HE3 LYS 54 HE3 LYS 54 -10.007 -7.942 9.676
479 HZ1 LYS 54 HZ1 LYS 54 -10.212 -9.793 11.217
480 HZ2 LYS 54 HZ2 LYS 54 -10.540 -8.727 12.491
481 HZ3 LYS 54 HZ3 LYS 54 -11.628 -8.866 11.204
482 H GLU 55 H GLU 55 -6.907 -3.776 9.930
483 HA GLU 55 HA GLU 55 -8.310 -4.166 7.532
484 HB2 GLU 55 HB2 GLU 55 -8.022 -1.963 9.536
485 HB3 GLU 55 HB3 GLU 55 -8.812 -1.599 8.016
486 HG2 GLU 55 HG2 GLU 55 -9.648 -3.844 9.819
487 HG3 GLU 55 HG3 GLU 55 -10.310 -2.218 9.917
488 H ALA 56 H ALA 56 -5.635 -1.943 8.364
489 HA ALA 56 HA ALA 56 -5.573 -0.750 5.849
490 HB1 ALA 56 HB1 ALA 56 -3.305 -0.019 6.398
491 HB2 ALA 56 HB2 ALA 56 -3.245 -1.180 7.724
492 HB3 ALA 56 HB3 ALA 56 -4.377 0.171 7.785
493 H THR 57 H THR 57 -3.667 -3.477 7.116
494 HA THR 57 HA THR 57 -2.172 -4.146 4.933
495 HB THR 57 HB THR 57 -3.628 -6.130 6.694
496 HG1 THR 57 HG1 THR 57 -2.495 -4.803 8.051
497 HG21 THR 57 HG21 THR 57 -2.578 -7.130 4.736
498 HG22 THR 57 HG22 THR 57 -1.049 -6.352 5.145
499 HG23 THR 57 HG23 THR 57 -1.722 -7.587 6.209
500 H GLU 58 H GLU 58 -5.485 -5.131 5.634
501 HA GLU 58 HA GLU 58 -5.939 -6.649 3.295
502 HB2 GLU 58 HB2 GLU 58 -7.675 -5.378 5.376
503 HB3 GLU 58 HB3 GLU 58 -8.416 -6.019 3.914
504 HG2 GLU 58 HG2 GLU 58 -7.324 -8.200 4.410
505 HG3 GLU 58 HG3 GLU 58 -6.783 -7.515 5.945
506 H HIS 59 H HIS 59 -6.134 -3.207 3.923
507 HA HIS 59 HA HIS 59 -7.687 -2.689 1.542
508 HB2 HIS 59 HB2 HIS 59 -6.327 -0.813 3.484
509 HB3 HIS 59 HB3 HIS 59 -7.300 -0.282 2.119
510 HD1 HIS 59 HD1 HIS 59 -9.632 -2.355 2.487
511 HD2 HIS 59 HD2 HIS 59 -7.992 -0.015 5.505
512 HE1 HIS 59 HE1 HIS 59 -11.389 -2.234 4.280
513 HE2 HIS 59 HE2 HIS 59 -10.277 -1.019 6.186
514 H LEU 60 H LEU 60 -4.342 -2.033 2.611
515 HA LEU 60 HA LEU 60 -3.323 -1.166 0.212
516 HB2 LEU 60 HB2 LEU 60 -2.132 -2.627 2.532
517 HB3 LEU 60 HB3 LEU 60 -1.167 -2.274 1.108
518 HG LEU 60 HG LEU 60 -1.810 0.110 1.396
519 HD11 LEU 60 HD11 LEU 60 -3.755 -0.157 2.729
520 HD12 LEU 60 HD12 LEU 60 -2.781 -0.788 4.058
521 HD13 LEU 60 HD13 LEU 60 -2.578 0.886 3.534
522 HD21 LEU 60 HD21 LEU 60 -0.238 -1.164 3.617
523 HD22 LEU 60 HD22 LEU 60 0.391 -0.671 2.044
524 HD23 LEU 60 HD23 LEU 60 -0.183 0.546 3.184
525 H LYS 61 H LYS 61 -4.006 -4.454 1.313
526 HA LYS 61 HA LYS 61 -2.790 -5.867 -0.759
527 HB2 LYS 61 HB2 LYS 61 -5.247 -6.408 0.883
528 HB3 LYS 61 HB3 LYS 61 -4.810 -7.477 -0.440
529 HG2 LYS 61 HG2 LYS 61 -2.639 -7.885 0.614
530 HG3 LYS 61 HG3 LYS 61 -3.100 -6.829 1.951
531 HD2 LYS 61 HD2 LYS 61 -4.971 -8.319 2.479
532 HD3 LYS 61 HD3 LYS 61 -4.511 -9.371 1.138
533 HE2 LYS 61 HE2 LYS 61 -2.382 -9.839 2.207
534 HE3 LYS 61 HE3 LYS 61 -2.776 -8.730 3.519
535 HZ1 LYS 61 HZ1 LYS 61 -4.659 -10.173 4.077
536 HZ2 LYS 61 HZ2 LYS 61 -4.182 -11.260 2.873
537 HZ3 LYS 61 HZ3 LYS 61 -3.175 -10.977 4.204
538 H GLY 62 H GLY 62 -6.173 -4.746 -0.582
539 HA2 GLY 62 HA2 GLY 62 -7.578 -3.964 -2.212
540 HA3 GLY 62 HA3 GLY 62 -6.911 -5.247 -3.207
541 H GLY 63 H GLY 63 -5.351 -2.320 -1.892
542 HA2 GLY 63 HA2 GLY 63 -4.052 -0.742 -2.944
543 HA3 GLY 63 HA3 GLY 63 -5.244 -0.821 -4.232
544 H CYS 64 H CYS 64 -2.762 -3.071 -3.017
545 HA CYS 64 HA CYS 64 -1.143 -2.846 -5.342
546 HB2 CYS 64 HB2 CYS 64 -0.194 -3.537 -3.210
547 HB3 CYS 64 HB3 CYS 64 -1.214 -4.973 -3.195
548 H ARG 65 H ARG 65 -3.835 -4.845 -4.439
549 HA ARG 65 HA ARG 65 -3.708 -6.833 -6.400
550 HB2 ARG 65 HB2 ARG 65 -5.294 -6.876 -4.539
551 HB3 ARG 65 HB3 ARG 65 -6.113 -5.464 -5.183
552 HG2 ARG 65 HG2 ARG 65 -6.611 -6.861 -7.237
553 HG3 ARG 65 HG3 ARG 65 -6.069 -8.251 -6.290
554 HD2 ARG 65 HD2 ARG 65 -8.494 -7.999 -6.155
555 HD3 ARG 65 HD3 ARG 65 -7.742 -7.736 -4.579
556 HE ARG 65 HE ARG 65 -8.279 -5.372 -6.218
557 HH11 ARG 65 HH11 ARG 65 -9.245 -7.395 -3.513
558 HH12 ARG 65 HH12 ARG 65 -10.260 -6.177 -2.811
559 HH21 ARG 65 HH21 ARG 65 -9.607 -3.786 -5.288
560 HH22 ARG 65 HH22 ARG 65 -10.464 -4.125 -3.817
561 H GLU 66 H GLU 66 -5.025 -3.552 -6.498
562 HA GLU 66 HA GLU 66 -6.008 -3.741 -9.157
563 HB2 GLU 66 HB2 GLU 66 -5.234 -1.248 -7.637
564 HB3 GLU 66 HB3 GLU 66 -6.274 -1.331 -9.052
565 HG2 GLU 66 HG2 GLU 66 -6.840 -2.362 -6.289
566 HG3 GLU 66 HG3 GLU 66 -7.667 -1.069 -7.155
567 H ILE 67 H ILE 67 -2.955 -2.747 -7.728
568 HA ILE 67 HA ILE 67 -1.711 -1.895 -10.126
569 HB ILE 67 HB ILE 67 -0.550 -3.024 -7.580
570 HG12 ILE 67 HG12 ILE 67 -0.614 -0.218 -8.709
571 HG13 ILE 67 HG13 ILE 67 -1.692 -0.830 -7.460
572 HG21 ILE 67 HG21 ILE 67 0.982 -3.503 -9.437
573 HG22 ILE 67 HG22 ILE 67 0.941 -1.802 -9.906
574 HG23 ILE 67 HG23 ILE 67 1.643 -2.272 -8.357
575 HD11 ILE 67 HD11 ILE 67 0.233 -1.185 -5.994
576 HD12 ILE 67 HD12 ILE 67 1.292 -0.535 -7.244
577 HD13 ILE 67 HD13 ILE 67 0.075 0.499 -6.493
578 H LEU 68 H LEU 68 -1.870 -5.019 -8.483
579 HA LEU 68 HA LEU 68 -0.336 -6.485 -10.338
580 HB2 LEU 68 HB2 LEU 68 -1.014 -7.166 -8.004
581 HB3 LEU 68 HB3 LEU 68 -2.612 -7.504 -8.640
582 HG LEU 68 HG LEU 68 -1.663 -9.218 -10.118
583 HD11 LEU 68 HD11 LEU 68 0.558 -8.230 -10.405
584 HD12 LEU 68 HD12 LEU 68 0.932 -8.588 -8.718
585 HD13 LEU 68 HD13 LEU 68 0.659 -9.907 -9.859
586 HD21 LEU 68 HD21 LEU 68 -2.487 -9.822 -7.896
587 HD22 LEU 68 HD22 LEU 68 -1.134 -10.841 -8.384
588 HD23 LEU 68 HD23 LEU 68 -0.881 -9.539 -7.225
589 H LYS 69 H LYS 69 -3.677 -5.532 -10.200
590 HA LYS 69 HA LYS 69 -4.625 -7.023 -12.376
591 HB2 LYS 69 HB2 LYS 69 -5.505 -4.540 -10.988
592 HB3 LYS 69 HB3 LYS 69 -6.208 -4.892 -12.559
593 HG2 LYS 69 HG2 LYS 69 -6.239 -6.797 -10.232
594 HG3 LYS 69 HG3 LYS 69 -7.549 -5.686 -10.632
595 HD2 LYS 69 HD2 LYS 69 -7.520 -6.765 -12.949
596 HD3 LYS 69 HD3 LYS 69 -6.531 -8.029 -12.216
597 HE2 LYS 69 HE2 LYS 69 -9.289 -7.199 -11.324
598 HE3 LYS 69 HE3 LYS 69 -8.895 -8.645 -12.252
599 HZ1 LYS 69 HZ1 LYS 69 -7.937 -8.044 -9.507
600 HZ2 LYS 69 HZ2 LYS 69 -9.170 -9.129 -9.903
601 HZ3 LYS 69 HZ3 LYS 69 -7.588 -9.444 -10.392
602 H HIS 70 H HIS 70 -2.343 -4.584 -12.309
603 HA HIS 70 HA HIS 70 -2.931 -3.691 -15.034
604 HB2 HIS 70 HB2 HIS 70 -2.682 -1.875 -13.396
605 HB3 HIS 70 HB3 HIS 70 -1.103 -2.496 -12.934
606 HD1 HIS 70 HD1 HIS 70 -2.773 -0.287 -15.315
607 HD2 HIS 70 HD2 HIS 70 0.891 -2.239 -15.021
608 HE1 HIS 70 HE1 HIS 70 -1.277 0.860 -16.962
609 HE2 HIS 70 HE2 HIS 70 0.845 -0.489 -16.955
610 H VAL 71 H VAL 71 -0.295 -4.589 -12.878
611 HA VAL 71 HA VAL 71 1.655 -4.742 -14.873
612 HB VAL 71 HB VAL 71 2.233 -4.179 -12.630
613 HG11 VAL 71 HG11 VAL 71 1.212 -6.854 -11.862
614 HG12 VAL 71 HG12 VAL 71 2.170 -5.798 -10.816
615 HG13 VAL 71 HG13 VAL 71 0.588 -5.266 -11.408
616 HG21 VAL 71 HG21 VAL 71 3.370 -6.778 -13.529
617 HG22 VAL 71 HG22 VAL 71 4.034 -5.153 -13.717
618 HG23 VAL 71 HG23 VAL 71 3.974 -5.899 -12.125
619 H VAL 72 H VAL 72 -0.127 -7.291 -13.147
620 HA VAL 72 HA VAL 72 1.095 -9.231 -14.959
621 HB VAL 72 HB VAL 72 0.836 -9.402 -12.311
622 HG11 VAL 72 HG11 VAL 72 -1.662 -10.666 -13.364
623 HG12 VAL 72 HG12 VAL 72 -0.959 -11.048 -11.792
624 HG13 VAL 72 HG13 VAL 72 -1.512 -9.409 -12.142
625 HG21 VAL 72 HG21 VAL 72 0.785 -11.634 -14.300
626 HG22 VAL 72 HG22 VAL 72 2.187 -10.876 -13.552
627 HG23 VAL 72 HG23 VAL 72 1.099 -11.861 -12.579
628 H GLY 73 H GLY 73 -1.826 -7.564 -14.446
629 HA2 GLY 73 HA2 GLY 73 -3.009 -8.939 -16.711
630 HA3 GLY 73 HA3 GLY 73 -3.587 -7.455 -15.972
631 H GLU 74 H GLU 74 -5.671 -8.608 -16.300
632 HA GLU 74 HA GLU 74 -6.742 -9.596 -13.926
633 HB2 GLU 74 HB2 GLU 74 -7.722 -9.989 -16.761
634 HB3 GLU 74 HB3 GLU 74 -8.648 -10.414 -15.333
635 HG2 GLU 74 HG2 GLU 74 -9.492 -8.352 -16.032
636 HG3 GLU 74 HG3 GLU 74 -8.459 -7.984 -14.654
637 H GLU 75 H GLU 75 -5.528 -11.265 -16.760
638 HA GLU 75 HA GLU 75 -6.129 -13.894 -16.399
639 HB2 GLU 75 HB2 GLU 75 -4.863 -13.061 -18.284
640 HB3 GLU 75 HB3 GLU 75 -3.497 -12.686 -17.244
641 HG2 GLU 75 HG2 GLU 75 -3.110 -15.012 -16.820
642 HG3 GLU 75 HG3 GLU 75 -4.568 -15.457 -17.713
643 H LYS 76 H LYS 76 -3.105 -12.493 -15.110
644 HA LYS 76 HA LYS 76 -2.600 -14.968 -13.777
645 HB2 LYS 76 HB2 LYS 76 -1.039 -12.391 -13.635
646 HB3 LYS 76 HB3 LYS 76 -0.486 -13.994 -13.199
647 HG2 LYS 76 HG2 LYS 76 -1.227 -13.082 -15.960
648 HG3 LYS 76 HG3 LYS 76 0.404 -13.352 -15.350
649 HD2 LYS 76 HD2 LYS 76 -1.734 -15.463 -15.580
650 HD3 LYS 76 HD3 LYS 76 -0.420 -15.220 -16.728
651 HE2 LYS 76 HE2 LYS 76 1.194 -15.651 -14.915
652 HE3 LYS 76 HE3 LYS 76 -0.150 -15.964 -13.821
653 HZ1 LYS 76 HZ1 LYS 76 0.379 -17.492 -16.306
654 HZ2 LYS 76 HZ2 LYS 76 0.833 -17.995 -14.759
655 HZ3 LYS 76 HZ3 LYS 76 -0.809 -17.830 -15.148
656 H ALA 77 H ALA 77 -3.596 -11.728 -12.827
657 HA ALA 77 HA ALA 77 -3.365 -12.083 -10.036
658 HB1 ALA 77 HB1 ALA 77 -4.873 -10.191 -9.847
659 HB2 ALA 77 HB2 ALA 77 -5.351 -10.367 -11.535
660 HB3 ALA 77 HB3 ALA 77 -3.701 -9.892 -11.129
661 H ALA 78 H ALA 78 -5.646 -13.202 -12.385
662 HA ALA 78 HA ALA 78 -7.705 -13.967 -10.559
663 HB1 ALA 78 HB1 ALA 78 -7.062 -14.783 -13.394
664 HB2 ALA 78 HB2 ALA 78 -8.482 -15.351 -12.509
665 HB3 ALA 78 HB3 ALA 78 -8.285 -13.634 -12.855
666 H GLU 79 H GLU 79 -4.949 -15.523 -12.088
667 HA GLU 79 HA GLU 79 -5.416 -18.124 -11.068
668 HB2 GLU 79 HB2 GLU 79 -2.808 -16.859 -11.933
669 HB3 GLU 79 HB3 GLU 79 -3.106 -18.581 -11.739
670 HG2 GLU 79 HG2 GLU 79 -4.791 -18.452 -13.518
671 HG3 GLU 79 HG3 GLU 79 -4.387 -16.757 -13.748
672 H LEU 80 H LEU 80 -3.668 -15.335 -9.896
673 HA LEU 80 HA LEU 80 -2.518 -16.629 -7.642
674 HB2 LEU 80 HB2 LEU 80 -2.997 -13.747 -8.367
675 HB3 LEU 80 HB3 LEU 80 -2.195 -14.229 -6.881
676 HG LEU 80 HG LEU 80 -1.183 -15.204 -9.530
677 HD11 LEU 80 HD11 LEU 80 -1.328 -12.763 -9.694
678 HD12 LEU 80 HD12 LEU 80 -0.400 -12.619 -8.199
679 HD13 LEU 80 HD13 LEU 80 0.343 -13.331 -9.633
680 HD21 LEU 80 HD21 LEU 80 -0.386 -16.250 -7.492
681 HD22 LEU 80 HD22 LEU 80 0.901 -15.345 -8.289
682 HD23 LEU 80 HD23 LEU 80 0.103 -14.676 -6.866
683 H LYS 81 H LYS 81 -5.449 -14.733 -8.182
684 HA LYS 81 HA LYS 81 -6.261 -14.699 -5.468
685 HB2 LYS 81 HB2 LYS 81 -7.071 -13.190 -7.361
686 HB3 LYS 81 HB3 LYS 81 -8.087 -14.530 -7.866
687 HG2 LYS 81 HG2 LYS 81 -8.233 -13.415 -5.087
688 HG3 LYS 81 HG3 LYS 81 -9.125 -12.692 -6.422
689 HD2 LYS 81 HD2 LYS 81 -9.346 -15.573 -5.543
690 HD3 LYS 81 HD3 LYS 81 -10.478 -14.289 -5.103
691 HE2 LYS 81 HE2 LYS 81 -10.914 -13.926 -7.529
692 HE3 LYS 81 HE3 LYS 81 -9.901 -15.324 -7.877
693 HZ1 LYS 81 HZ1 LYS 81 -11.426 -16.688 -6.571
694 HZ2 LYS 81 HZ2 LYS 81 -12.410 -15.341 -6.293
695 HZ3 LYS 81 HZ3 LYS 81 -12.217 -15.937 -7.860
696 H ASN 82 H ASN 82 -7.001 -16.835 -8.211
697 HA ASN 82 HA ASN 82 -8.789 -18.453 -6.714
698 HB2 ASN 82 HB2 ASN 82 -8.781 -18.398 -9.223
699 HB3 ASN 82 HB3 ASN 82 -7.225 -19.219 -9.202
700 HD21 ASN 82 HD21 ASN 82 -7.878 -21.044 -10.241
701 HD22 ASN 82 HD22 ASN 82 -8.984 -22.185 -9.556
702 H LEU 83 H LEU 83 -5.290 -18.771 -7.471
703 HA LEU 83 HA LEU 83 -4.858 -21.198 -6.280
704 HB2 LEU 83 HB2 LEU 83 -3.314 -18.917 -7.057
705 HB3 LEU 83 HB3 LEU 83 -2.754 -19.487 -5.502
706 HG LEU 83 HG LEU 83 -2.709 -21.803 -6.607
707 HD11 LEU 83 HD11 LEU 83 -2.699 -20.075 -9.058
708 HD12 LEU 83 HD12 LEU 83 -2.294 -21.792 -9.011
709 HD13 LEU 83 HD13 LEU 83 -3.926 -21.258 -8.609
710 HD21 LEU 83 HD21 LEU 83 -0.731 -19.674 -7.391
711 HD22 LEU 83 HD22 LEU 83 -0.705 -20.634 -5.912
712 HD23 LEU 83 HD23 LEU 83 -0.442 -21.412 -7.473
713 H LYS 84 H LYS 84 -4.723 -17.997 -4.728
714 HA LYS 84 HA LYS 84 -4.452 -18.653 -2.100
715 HB2 LYS 84 HB2 LYS 84 -4.597 -16.358 -3.041
716 HB3 LYS 84 HB3 LYS 84 -6.339 -16.555 -3.199
717 HG2 LYS 84 HG2 LYS 84 -5.094 -16.935 -0.521
718 HG3 LYS 84 HG3 LYS 84 -5.279 -15.299 -1.153
719 HD2 LYS 84 HD2 LYS 84 -7.672 -15.663 -1.432
720 HD3 LYS 84 HD3 LYS 84 -7.500 -17.318 -0.849
721 HE2 LYS 84 HE2 LYS 84 -6.793 -16.527 1.316
722 HE3 LYS 84 HE3 LYS 84 -6.800 -14.862 0.747
723 HZ1 LYS 84 HZ1 LYS 84 -9.196 -15.043 0.405
724 HZ2 LYS 84 HZ2 LYS 84 -9.170 -16.629 0.987
725 HZ3 LYS 84 HZ3 LYS 84 -8.783 -15.346 2.016
726 H ASP 85 H ASP 85 -7.614 -18.273 -3.707
727 HA ASP 85 HA ASP 85 -9.183 -19.179 -1.557
728 HB2 ASP 85 HB2 ASP 85 -9.973 -17.873 -3.551
729 HB3 ASP 85 HB3 ASP 85 -9.860 -19.355 -4.494
730 H SER 86 H SER 86 -7.569 -20.964 -4.118
731 HA SER 86 HA SER 86 -8.970 -23.402 -3.504
732 HB2 SER 86 HB2 SER 86 -6.521 -22.952 -5.223
733 HB3 SER 86 HB3 SER 86 -7.486 -24.428 -5.169
734 HG SER 86 HG SER 86 -8.127 -21.906 -6.237
735 H GLY 87 H GLY 87 -6.420 -21.779 -2.064
736 HA2 GLY 87 HA2 GLY 87 -5.875 -24.223 -0.509
737 HA3 GLY 87 HA3 GLY 87 -5.798 -22.589 0.128
738 H ALA 88 H ALA 88 -4.367 -22.077 -2.668
739 HA ALA 88 HA ALA 88 -1.787 -23.109 -2.354
740 HB1 ALA 88 HB1 ALA 88 -2.659 -20.431 -3.432
741 HB2 ALA 88 HB2 ALA 88 -2.376 -21.907 -4.353
742 HB3 ALA 88 HB3 ALA 88 -1.027 -21.082 -3.574
743 H SER 89 H SER 89 -0.372 -22.762 -0.819
744 HA SER 89 HA SER 89 -0.875 -21.137 1.441
745 HB2 SER 89 HB2 SER 89 1.461 -21.867 2.066
746 HB3 SER 89 HB3 SER 89 0.332 -23.177 1.753
747 HG SER 89 HG SER 89 1.523 -23.785 0.139
748 H LYS 90 H LYS 90 1.026 -19.692 2.260
749 HA LYS 90 HA LYS 90 1.180 -17.437 0.628
750 HB2 LYS 90 HB2 LYS 90 2.905 -18.281 2.955
751 HB3 LYS 90 HB3 LYS 90 2.975 -16.691 2.213
752 HG2 LYS 90 HG2 LYS 90 0.642 -16.301 2.808
753 HG3 LYS 90 HG3 LYS 90 0.553 -17.907 3.529
754 HD2 LYS 90 HD2 LYS 90 2.599 -15.922 4.451
755 HD3 LYS 90 HD3 LYS 90 0.946 -15.853 5.058
756 HE2 LYS 90 HE2 LYS 90 2.271 -17.112 6.607
757 HE3 LYS 90 HE3 LYS 90 1.176 -18.220 5.788
758 HZ1 LYS 90 HZ1 LYS 90 4.005 -17.822 4.980
759 HZ2 LYS 90 HZ2 LYS 90 3.502 -19.024 6.058
760 HZ3 LYS 90 HZ3 LYS 90 2.946 -19.042 4.464
761 H GLU 91 H GLU 91 3.093 -20.313 0.639
762 HA GLU 91 HA GLU 91 5.310 -19.034 -0.660
763 HB2 GLU 91 HB2 GLU 91 5.749 -20.842 0.907
764 HB3 GLU 91 HB3 GLU 91 4.784 -21.948 -0.060
765 HG2 GLU 91 HG2 GLU 91 6.358 -21.791 -1.873
766 HG3 GLU 91 HG3 GLU 91 7.309 -20.604 -0.986
767 H GLU 92 H GLU 92 2.746 -21.306 -1.615
768 HA GLU 92 HA GLU 92 3.450 -21.699 -4.268
769 HB2 GLU 92 HB2 GLU 92 0.698 -21.540 -3.058
770 HB3 GLU 92 HB3 GLU 92 1.133 -22.336 -4.556
771 HG2 GLU 92 HG2 GLU 92 2.069 -23.104 -1.822
772 HG3 GLU 92 HG3 GLU 92 0.818 -23.903 -2.755
773 H LEU 93 H LEU 93 1.450 -19.233 -2.705
774 HA LEU 93 HA LEU 93 1.048 -17.701 -5.073
775 HB2 LEU 93 HB2 LEU 93 1.079 -16.837 -2.178
776 HB3 LEU 93 HB3 LEU 93 0.610 -15.794 -3.508
777 HG LEU 93 HG LEU 93 -0.797 -18.299 -2.587
778 HD11 LEU 93 HD11 LEU 93 -1.634 -15.412 -2.681
779 HD12 LEU 93 HD12 LEU 93 -2.674 -16.764 -2.235
780 HD13 LEU 93 HD13 LEU 93 -1.278 -16.358 -1.234
781 HD21 LEU 93 HD21 LEU 93 -1.306 -16.579 -5.005
782 HD22 LEU 93 HD22 LEU 93 -0.868 -18.288 -4.981
783 HD23 LEU 93 HD23 LEU 93 -2.438 -17.772 -4.368
784 H LYS 94 H LYS 94 3.700 -17.787 -2.689
785 HA LYS 94 HA LYS 94 5.038 -15.537 -3.764
786 HB2 LYS 94 HB2 LYS 94 5.599 -16.528 -1.575
787 HB3 LYS 94 HB3 LYS 94 6.252 -17.941 -2.394
788 HG2 LYS 94 HG2 LYS 94 7.877 -16.444 -3.536
789 HG3 LYS 94 HG3 LYS 94 7.286 -15.121 -2.535
790 HD2 LYS 94 HD2 LYS 94 8.432 -17.677 -1.433
791 HD3 LYS 94 HD3 LYS 94 9.383 -16.223 -1.716
792 HE2 LYS 94 HE2 LYS 94 8.849 -16.072 0.536
793 HE3 LYS 94 HE3 LYS 94 7.631 -15.056 -0.227
794 HZ1 LYS 94 HZ1 LYS 94 6.067 -16.900 -0.076
795 HZ2 LYS 94 HZ2 LYS 94 7.242 -17.863 0.665
796 HZ3 LYS 94 HZ3 LYS 94 6.657 -16.482 1.449
797 H ALA 95 H ALA 95 5.134 -18.971 -4.489
798 HA ALA 95 HA ALA 95 7.256 -18.571 -6.394
799 HB1 ALA 95 HB1 ALA 95 7.240 -20.557 -4.910
800 HB2 ALA 95 HB2 ALA 95 7.272 -20.998 -6.618
801 HB3 ALA 95 HB3 ALA 95 5.764 -21.103 -5.709
802 H LYS 96 H LYS 96 3.820 -18.973 -6.446
803 HA LYS 96 HA LYS 96 3.604 -19.010 -9.267
804 HB2 LYS 96 HB2 LYS 96 1.710 -19.353 -7.688
805 HB3 LYS 96 HB3 LYS 96 1.763 -17.641 -7.296
806 HG2 LYS 96 HG2 LYS 96 0.004 -17.924 -8.835
807 HG3 LYS 96 HG3 LYS 96 1.329 -17.179 -9.728
808 HD2 LYS 96 HD2 LYS 96 1.929 -19.320 -10.684
809 HD3 LYS 96 HD3 LYS 96 0.684 -20.125 -9.727
810 HE2 LYS 96 HE2 LYS 96 -1.027 -18.762 -10.866
811 HE3 LYS 96 HE3 LYS 96 0.236 -18.035 -11.856
812 HZ1 LYS 96 HZ1 LYS 96 -0.469 -20.917 -11.808
813 HZ2 LYS 96 HZ2 LYS 96 -0.904 -19.814 -13.018
814 HZ3 LYS 96 HZ3 LYS 96 0.725 -20.210 -12.775
815 H VAL 97 H VAL 97 3.285 -16.284 -7.073
816 HA VAL 97 HA VAL 97 3.014 -14.237 -8.831
817 HB VAL 97 HB VAL 97 2.934 -14.299 -6.249
818 HG11 VAL 97 HG11 VAL 97 5.624 -13.207 -6.850
819 HG12 VAL 97 HG12 VAL 97 4.795 -12.982 -5.311
820 HG13 VAL 97 HG13 VAL 97 5.236 -14.603 -5.854
821 HG21 VAL 97 HG21 VAL 97 2.062 -12.506 -7.647
822 HG22 VAL 97 HG22 VAL 97 2.892 -11.860 -6.231
823 HG23 VAL 97 HG23 VAL 97 3.689 -11.838 -7.801
824 H GLU 98 H GLU 98 6.066 -15.535 -7.729
825 HA GLU 98 HA GLU 98 7.637 -13.488 -8.869
826 HB2 GLU 98 HB2 GLU 98 8.303 -16.300 -8.019
827 HB3 GLU 98 HB3 GLU 98 9.513 -15.149 -8.585
828 HG2 GLU 98 HG2 GLU 98 7.652 -14.620 -6.279
829 HG3 GLU 98 HG3 GLU 98 9.279 -15.297 -6.099
830 H GLU 99 H GLU 99 6.422 -16.521 -10.157
831 HA GLU 99 HA GLU 99 7.959 -16.304 -12.593
832 HB2 GLU 99 HB2 GLU 99 5.585 -18.066 -11.955
833 HB3 GLU 99 HB3 GLU 99 6.666 -18.241 -13.331
834 HG2 GLU 99 HG2 GLU 99 7.435 -18.536 -10.436
835 HG3 GLU 99 HG3 GLU 99 7.167 -19.853 -11.575
836 H ALA 100 H ALA 100 4.668 -15.615 -11.513
837 HA ALA 100 HA ALA 100 3.609 -14.923 -14.038
838 HB1 ALA 100 HB1 ALA 100 2.781 -13.917 -11.316
839 HB2 ALA 100 HB2 ALA 100 2.225 -15.412 -12.066
840 HB3 ALA 100 HB3 ALA 100 1.815 -13.858 -12.792
841 H LEU 101 H LEU 101 5.014 -12.933 -11.443
842 HA LEU 101 HA LEU 101 4.934 -10.547 -13.018
843 HB2 LEU 101 HB2 LEU 101 6.321 -11.195 -10.424
844 HB3 LEU 101 HB3 LEU 101 6.339 -9.608 -11.168
845 HG LEU 101 HG LEU 101 3.864 -11.056 -10.224
846 HD11 LEU 101 HD11 LEU 101 5.295 -10.341 -8.386
847 HD12 LEU 101 HD12 LEU 101 5.336 -8.706 -9.047
848 HD13 LEU 101 HD13 LEU 101 3.817 -9.381 -8.459
849 HD21 LEU 101 HD21 LEU 101 4.253 -8.277 -11.328
850 HD22 LEU 101 HD22 LEU 101 3.389 -9.602 -12.103
851 HD23 LEU 101 HD23 LEU 101 2.761 -8.892 -10.616
852 H HIS 102 H HIS 102 6.925 -13.225 -13.176
853 HA HIS 102 HA HIS 102 9.163 -11.663 -14.147
854 HB2 HIS 102 HB2 HIS 102 9.308 -13.997 -12.994
855 HB3 HIS 102 HB3 HIS 102 8.882 -14.622 -14.583
856 HD1 HIS 102 HD1 HIS 102 10.637 -14.165 -16.525
857 HD2 HIS 102 HD2 HIS 102 11.912 -13.241 -12.679
858 HE1 HIS 102 HE1 HIS 102 13.126 -13.877 -16.691
859 HE2 HIS 102 HE2 HIS 102 13.892 -13.516 -14.321
860 H ALA 103 H ALA 103 6.636 -13.803 -15.337
861 HA ALA 103 HA ALA 103 7.463 -13.888 -18.017
862 HB1 ALA 103 HB1 ALA 103 4.734 -14.421 -16.873
863 HB2 ALA 103 HB2 ALA 103 6.070 -15.572 -16.901
864 HB3 ALA 103 HB3 ALA 103 5.360 -15.004 -18.416
865 H VAL 104 H VAL 104 6.246 -11.199 -16.491
866 HA VAL 104 HA VAL 104 4.480 -10.327 -18.533
867 HB VAL 104 HB VAL 104 3.842 -9.542 -16.488
868 HG11 VAL 104 HG11 VAL 104 5.798 -10.205 -15.260
869 HG12 VAL 104 HG12 VAL 104 6.673 -8.799 -15.860
870 HG13 VAL 104 HG13 VAL 104 5.284 -8.585 -14.800
871 HG21 VAL 104 HG21 VAL 104 3.988 -7.679 -18.131
872 HG22 VAL 104 HG22 VAL 104 4.068 -7.154 -16.447
873 HG23 VAL 104 HG23 VAL 104 5.539 -7.246 -17.415
874 H THR 105 H THR 105 7.381 -8.673 -17.295
875 HA THR 105 HA THR 105 9.191 -7.777 -18.287
876 HB THR 105 HB THR 105 10.120 -8.682 -20.287
877 HG1 THR 105 HG1 THR 105 7.461 -9.338 -20.859
878 HG21 THR 105 HG21 THR 105 10.159 -10.150 -18.332
879 HG22 THR 105 HG22 THR 105 8.618 -10.855 -18.828
880 HG23 THR 105 HG23 THR 105 10.057 -11.081 -19.828
881 H ASP 106 H ASP 106 6.236 -6.836 -19.039
882 HA ASP 106 HA ASP 106 7.002 -4.986 -21.121
883 HB2 ASP 106 HB2 ASP 106 4.491 -5.374 -19.511
884 HB3 ASP 106 HB3 ASP 106 4.702 -3.992 -20.574
885 H GLU 107 H GLU 107 7.443 -2.842 -20.851
886 HA GLU 107 HA GLU 107 9.186 -2.462 -18.727
887 HB2 GLU 107 HB2 GLU 107 8.081 -0.384 -20.611
888 HB3 GLU 107 HB3 GLU 107 9.503 -0.189 -19.599
889 HG2 GLU 107 HG2 GLU 107 10.574 -2.054 -20.789
890 HG3 GLU 107 HG3 GLU 107 9.161 -2.168 -21.835
891 H GLU 108 H GLU 108 6.143 -0.703 -19.320
892 HA GLU 108 HA GLU 108 6.266 0.881 -17.011
893 HB2 GLU 108 HB2 GLU 108 3.827 1.219 -17.371
894 HB3 GLU 108 HB3 GLU 108 4.788 1.476 -18.819
895 HG2 GLU 108 HG2 GLU 108 4.095 -0.572 -19.761
896 HG3 GLU 108 HG3 GLU 108 3.407 -1.122 -18.236
897 H LYS 109 H LYS 109 5.073 -2.360 -17.534
898 HA LYS 109 HA LYS 109 3.700 -2.577 -15.045
899 HB2 LYS 109 HB2 LYS 109 4.648 -4.660 -17.014
900 HB3 LYS 109 HB3 LYS 109 3.617 -4.999 -15.631
901 HG2 LYS 109 HG2 LYS 109 1.905 -3.515 -16.522
902 HG3 LYS 109 HG3 LYS 109 2.937 -3.145 -17.902
903 HD2 LYS 109 HD2 LYS 109 2.874 -5.525 -18.547
904 HD3 LYS 109 HD3 LYS 109 1.793 -5.846 -17.192
905 HE2 LYS 109 HE2 LYS 109 0.137 -4.336 -18.137
906 HE3 LYS 109 HE3 LYS 109 1.224 -3.953 -19.469
907 HZ1 LYS 109 HZ1 LYS 109 0.087 -6.635 -18.892
908 HZ2 LYS 109 HZ2 LYS 109 -0.444 -5.585 -20.105
909 HZ3 LYS 109 HZ3 LYS 109 1.104 -6.253 -20.186
910 H LYS 110 H LYS 110 6.899 -3.555 -16.223
911 HA LYS 110 HA LYS 110 7.739 -4.766 -13.796
912 HB2 LYS 110 HB2 LYS 110 9.348 -3.547 -16.039
913 HB3 LYS 110 HB3 LYS 110 10.059 -4.419 -14.691
914 HG2 LYS 110 HG2 LYS 110 8.588 -6.375 -15.424
915 HG3 LYS 110 HG3 LYS 110 8.364 -5.469 -16.921
916 HD2 LYS 110 HD2 LYS 110 11.057 -6.154 -15.757
917 HD3 LYS 110 HD3 LYS 110 10.245 -7.130 -16.972
918 HE2 LYS 110 HE2 LYS 110 10.270 -5.257 -18.523
919 HE3 LYS 110 HE3 LYS 110 11.012 -4.233 -17.292
920 HZ1 LYS 110 HZ1 LYS 110 12.234 -6.676 -18.460
921 HZ2 LYS 110 HZ2 LYS 110 12.643 -5.085 -18.864
922 HZ3 LYS 110 HZ3 LYS 110 12.947 -5.666 -17.306
923 H GLN 111 H GLN 111 7.349 -1.537 -14.720
924 HA GLN 111 HA GLN 111 9.047 -0.255 -12.872
925 HB2 GLN 111 HB2 GLN 111 7.494 0.719 -14.748
926 HB3 GLN 111 HB3 GLN 111 6.276 0.751 -13.488
927 HG2 GLN 111 HG2 GLN 111 8.938 2.116 -13.222
928 HG3 GLN 111 HG3 GLN 111 7.522 2.897 -13.917
929 HE21 GLN 111 HE21 GLN 111 9.107 1.894 -11.044
930 HE22 GLN 111 HE22 GLN 111 7.969 2.557 -9.914
931 H TYR 112 H TYR 112 5.827 -1.665 -12.557
932 HA TYR 112 HA TYR 112 5.493 -0.828 -9.808
933 HB2 TYR 112 HB2 TYR 112 3.917 -2.785 -11.496
934 HB3 TYR 112 HB3 TYR 112 3.462 -2.252 -9.879
935 HD1 TYR 112 HD1 TYR 112 3.985 0.604 -9.936
936 HD2 TYR 112 HD2 TYR 112 2.369 -1.914 -12.960
937 HE1 TYR 112 HE1 TYR 112 2.783 2.528 -10.899
938 HE2 TYR 112 HE2 TYR 112 1.175 -0.004 -13.928
939 HH TYR 112 HH TYR 112 0.338 2.163 -13.263
940 H ILE 113 H ILE 113 6.549 -3.707 -11.522
941 HA ILE 113 HA ILE 113 6.638 -5.491 -9.381
942 HB ILE 113 HB ILE 113 8.617 -5.259 -11.651
943 HG12 ILE 113 HG12 ILE 113 6.071 -6.868 -11.357
944 HG13 ILE 113 HG13 ILE 113 6.298 -5.476 -12.412
945 HG21 ILE 113 HG21 ILE 113 9.468 -6.632 -9.817
946 HG22 ILE 113 HG22 ILE 113 7.980 -7.581 -9.826
947 HG23 ILE 113 HG23 ILE 113 9.068 -7.632 -11.214
948 HD11 ILE 113 HD11 ILE 113 8.057 -6.763 -13.596
949 HD12 ILE 113 HD12 ILE 113 7.608 -8.159 -12.622
950 HD13 ILE 113 HD13 ILE 113 6.436 -7.444 -13.725
951 H ALA 114 H ALA 114 9.066 -3.177 -10.542
952 HA ALA 114 HA ALA 114 10.902 -3.546 -8.396
953 HB1 ALA 114 HB1 ALA 114 11.664 -2.654 -10.503
954 HB2 ALA 114 HB2 ALA 114 11.906 -1.432 -9.253
955 HB3 ALA 114 HB3 ALA 114 10.550 -1.291 -10.377
956 H ASP 115 H ASP 115 8.227 -1.347 -9.015
957 HA ASP 115 HA ASP 115 8.816 0.491 -6.937
958 HB2 ASP 115 HB2 ASP 115 7.233 0.574 -9.095
959 HB3 ASP 115 HB3 ASP 115 6.021 0.150 -7.891
960 H PHE 116 H PHE 116 6.242 -1.936 -7.238
961 HA PHE 116 HA PHE 116 5.683 -1.512 -4.399
962 HB2 PHE 116 HB2 PHE 116 3.983 -1.712 -6.676
963 HB3 PHE 116 HB3 PHE 116 3.641 -3.084 -5.627
964 HD1 PHE 116 HD1 PHE 116 3.679 0.569 -5.887
965 HD2 PHE 116 HD2 PHE 116 2.601 -2.794 -3.510
966 HE1 PHE 116 HE1 PHE 116 2.311 2.029 -4.433
967 HE2 PHE 116 HE2 PHE 116 1.234 -1.351 -2.062
968 HZ PHE 116 HZ PHE 116 1.086 1.059 -2.522
969 H GLY 117 H GLY 117 6.895 -3.829 -6.585
970 HA2 GLY 117 HA2 GLY 117 7.678 -5.977 -6.216
971 HA3 GLY 117 HA3 GLY 117 6.006 -6.270 -5.783
No H/Q in entry = 971
In of MODEL 1
1 HA PRO 118 HA PRO 118 9.293 -6.958 -2.247
2 HB2 PRO 118 HB2 PRO 118 10.315 -4.516 -1.312
3 HB3 PRO 118 HB3 PRO 118 11.182 -5.727 -2.257
4 HG2 PRO 118 HG2 PRO 118 9.878 -3.211 -3.145
5 HG3 PRO 118 HG3 PRO 118 11.320 -4.017 -3.782
6 HD2 PRO 118 HD2 PRO 118 8.963 -4.092 -5.074
7 HD3 PRO 118 HD3 PRO 118 10.081 -5.473 -5.086
8 H ALA 119 H ALA 119 7.775 -3.724 -1.987
9 HA ALA 119 HA ALA 119 7.134 -4.004 0.770
10 HB1 ALA 119 HB1 ALA 119 5.770 -1.997 0.445
11 HB2 ALA 119 HB2 ALA 119 5.988 -2.137 -1.300
12 HB3 ALA 119 HB3 ALA 119 7.377 -1.823 -0.259
13 H CYS 120 H CYS 120 5.390 -4.662 -2.212
14 HA CYS 120 HA CYS 120 2.844 -5.128 -1.132
15 HB2 CYS 120 HB2 CYS 120 3.340 -4.857 -3.546
16 HB3 CYS 120 HB3 CYS 120 4.145 -6.421 -3.538
17 H LYS 121 H LYS 121 5.736 -7.102 -1.274
18 HA LYS 121 HA LYS 121 4.544 -9.587 -0.732
19 HB2 LYS 121 HB2 LYS 121 7.253 -8.488 -0.688
20 HB3 LYS 121 HB3 LYS 121 7.001 -9.787 0.470
21 HG2 LYS 121 HG2 LYS 121 7.852 -10.542 -1.734
22 HG3 LYS 121 HG3 LYS 121 6.332 -11.294 -1.257
23 HD2 LYS 121 HD2 LYS 121 5.096 -9.813 -2.715
24 HD3 LYS 121 HD3 LYS 121 6.572 -8.938 -3.125
25 HE2 LYS 121 HE2 LYS 121 6.100 -11.863 -3.686
26 HE3 LYS 121 HE3 LYS 121 5.839 -10.571 -4.858
27 HZ1 LYS 121 HZ1 LYS 121 8.191 -9.978 -4.641
28 HZ2 LYS 121 HZ2 LYS 121 8.425 -11.273 -3.577
29 HZ3 LYS 121 HZ3 LYS 121 7.997 -11.569 -5.190
30 H LYS 122 H LYS 122 5.746 -7.091 1.547
31 HA LYS 122 HA LYS 122 5.006 -8.618 3.838
32 HB2 LYS 122 HB2 LYS 122 5.366 -6.684 5.156
33 HB3 LYS 122 HB3 LYS 122 6.564 -6.626 3.878
34 HG2 LYS 122 HG2 LYS 122 5.235 -4.971 2.685
35 HG3 LYS 122 HG3 LYS 122 4.002 -5.048 3.947
36 HD2 LYS 122 HD2 LYS 122 5.357 -3.134 4.387
37 HD3 LYS 122 HD3 LYS 122 5.766 -4.358 5.590
38 HE2 LYS 122 HE2 LYS 122 7.677 -5.023 4.069
39 HE3 LYS 122 HE3 LYS 122 7.333 -3.559 3.150
40 HZ1 LYS 122 HZ1 LYS 122 7.631 -2.316 5.267
41 HZ2 LYS 122 HZ2 LYS 122 8.177 -3.745 5.982
42 HZ3 LYS 122 HZ3 LYS 122 9.035 -3.059 4.696
43 H ILE 123 H ILE 123 3.314 -6.487 1.656
44 HA ILE 123 HA ILE 123 1.081 -5.995 3.336
45 HB ILE 123 HB ILE 123 1.400 -5.709 0.369
46 HG12 ILE 123 HG12 ILE 123 1.421 -3.707 2.635
47 HG13 ILE 123 HG13 ILE 123 2.848 -4.299 1.790
48 HG21 ILE 123 HG21 ILE 123 -0.830 -4.759 2.161
49 HG22 ILE 123 HG22 ILE 123 -0.621 -4.319 0.466
50 HG23 ILE 123 HG23 ILE 123 -0.953 -5.993 0.908
51 HD11 ILE 123 HD11 ILE 123 0.602 -2.782 0.517
52 HD12 ILE 123 HD12 ILE 123 2.129 -2.083 1.045
53 HD13 ILE 123 HD13 ILE 123 2.106 -3.281 -0.250
54 H TYR 124 H TYR 124 1.554 -8.018 0.556
55 HA TYR 124 HA TYR 124 -0.810 -9.599 0.773
56 HB2 TYR 124 HB2 TYR 124 1.617 -9.558 -0.934
57 HB3 TYR 124 HB3 TYR 124 0.778 -11.097 -0.786
58 HD1 TYR 124 HD1 TYR 124 -0.349 -7.550 -1.108
59 HD2 TYR 124 HD2 TYR 124 -0.523 -11.511 -2.655
60 HE1 TYR 124 HE1 TYR 124 -1.954 -6.806 -2.813
61 HE2 TYR 124 HE2 TYR 124 -2.129 -10.772 -4.364
62 HH TYR 124 HH TYR 124 -3.768 -8.955 -4.680
63 H GLY 125 H GLY 125 0.534 -9.651 3.244
64 HA2 GLY 125 HA2 GLY 125 1.833 -10.875 4.766
65 HA3 GLY 125 HA3 GLY 125 3.025 -10.215 3.685
66 H VAL 126 H VAL 126 2.230 -12.120 1.555
67 HA VAL 126 HA VAL 126 2.745 -14.768 2.187
68 HB VAL 126 HB VAL 126 3.694 -14.946 -0.141
69 HG11 VAL 126 HG11 VAL 126 1.055 -13.522 0.158
70 HG12 VAL 126 HG12 VAL 126 1.590 -14.384 -1.283
71 HG13 VAL 126 HG13 VAL 126 1.324 -15.264 0.222
72 HG21 VAL 126 HG21 VAL 126 3.112 -11.983 -0.189
73 HG22 VAL 126 HG22 VAL 126 4.703 -12.739 -0.298
74 HG23 VAL 126 HG23 VAL 126 3.528 -12.970 -1.594
75 H HIS 127 H HIS 127 4.835 -12.177 2.640
76 HA HIS 127 HA HIS 127 7.325 -12.912 1.822
77 HB2 HIS 127 HB2 HIS 127 6.777 -10.799 2.978
78 HB3 HIS 127 HB3 HIS 127 6.645 -11.674 4.496
79 HD1 HIS 127 HD1 HIS 127 9.161 -10.391 2.030
80 HD2 HIS 127 HD2 HIS 127 9.069 -12.310 5.720
81 HE1 HIS 127 HE1 HIS 127 11.509 -10.275 2.913
82 HE2 HIS 127 HE2 HIS 127 11.374 -11.239 5.233
83 H THR 128 H THR 128 6.259 -13.569 5.172
84 HA THR 128 HA THR 128 6.576 -15.330 6.559
85 HB THR 128 HB THR 128 7.274 -16.885 4.061
86 HG1 THR 128 HG1 THR 128 4.940 -15.879 4.965
87 HG21 THR 128 HG21 THR 128 6.462 -17.816 6.818
88 HG22 THR 128 HG22 THR 128 6.646 -18.856 5.406
89 HG23 THR 128 HG23 THR 128 8.047 -18.018 6.074
90 H SER 129 H SER 129 8.180 -15.224 7.922
91 HA SER 129 HA SER 129 10.228 -15.293 8.883
92 HB2 SER 129 HB2 SER 129 11.061 -16.911 6.467
93 HB3 SER 129 HB3 SER 129 11.828 -16.901 8.052
94 HG SER 129 HG SER 129 9.887 -18.463 7.216
95 HA2 GLY -4 HA2 GLY -4 -2.545 24.520 -18.749
96 HA3 GLY -4 HA3 GLY -4 -0.825 24.440 -18.401
97 H1 GLY -4 H1 GLY -4 -1.260 23.655 -20.611
98 H2 GLY -4 H2 GLY -4 -2.364 22.512 -20.040
No H/Q in entry = 98
In of MODEL 2
1 H SER -3 H SER -3 -3.175 21.796 -18.448
2 HA SER -3 HA SER -3 -2.397 21.177 -15.691
3 HB2 SER -3 HB2 SER -3 -5.257 21.199 -16.696
4 HB3 SER -3 HB3 SER -3 -4.728 20.744 -15.075
5 HG SER -3 HG SER -3 -4.069 22.860 -14.723
No H/Q in entry = 5
In of MODEL 2
1 HA PRO -2 HA PRO -2 -2.014 17.400 -18.308
2 HB2 PRO -2 HB2 PRO -2 -0.037 16.741 -16.220
3 HB3 PRO -2 HB3 PRO -2 0.155 16.771 -17.974
4 HG2 PRO -2 HG2 PRO -2 1.284 18.634 -16.415
5 HG3 PRO -2 HG3 PRO -2 0.638 19.030 -18.020
6 HD2 PRO -2 HD2 PRO -2 -0.578 19.497 -15.319
7 HD3 PRO -2 HD3 PRO -2 -0.537 20.567 -16.737
No H/Q in entry = 7
In of MODEL 2
1 H GLU -1 H GLU -1 -4.112 16.765 -17.567
2 HA GLU -1 HA GLU -1 -4.211 15.547 -14.907
3 HB2 GLU -1 HB2 GLU -1 -5.858 17.351 -15.611
4 HB3 GLU -1 HB3 GLU -1 -6.554 16.160 -16.701
5 HG2 GLU -1 HG2 GLU -1 -6.950 14.687 -14.740
6 HG3 GLU -1 HG3 GLU -1 -6.399 16.000 -13.702
No H/Q in entry = 6
In of MODEL 2
1 H PHE 0 H PHE 0 -2.947 13.727 -15.935
2 HA PHE 0 HA PHE 0 -4.459 11.847 -17.498
3 HB2 PHE 0 HB2 PHE 0 -1.990 11.838 -17.512
4 HB3 PHE 0 HB3 PHE 0 -1.980 11.437 -15.799
5 HD1 PHE 0 HD1 PHE 0 -4.014 10.068 -18.600
6 HD2 PHE 0 HD2 PHE 0 -1.067 9.320 -15.624
7 HE1 PHE 0 HE1 PHE 0 -4.053 7.676 -19.169
8 HE2 PHE 0 HE2 PHE 0 -1.097 6.926 -16.192
9 HZ PHE 0 HZ PHE 0 -2.567 6.100 -17.961
No H/Q in entry = 9
In of MODEL 2
1 H HIS 1 H HIS 1 -3.435 12.077 -14.122
2 HA HIS 1 HA HIS 1 -4.389 11.462 -12.171
3 HB2 HIS 1 HB2 HIS 1 -6.125 13.023 -13.402
4 HB3 HIS 1 HB3 HIS 1 -7.097 11.556 -13.423
5 HD1 HIS 1 HD1 HIS 1 -8.548 11.272 -11.432
6 HD2 HIS 1 HD2 HIS 1 -5.227 13.639 -10.617
7 HE1 HIS 1 HE1 HIS 1 -8.827 12.042 -9.050
8 HE2 HIS 1 HE2 HIS 1 -6.832 13.523 -8.589
No H/Q in entry = 8
In of MODEL 2
1 H HIS 2 H HIS 2 -3.410 9.278 -13.087
2 HA HIS 2 HA HIS 2 -5.540 7.274 -12.731
3 HB2 HIS 2 HB2 HIS 2 -4.586 7.236 -15.033
4 HB3 HIS 2 HB3 HIS 2 -3.000 6.925 -14.342
5 HD1 HIS 2 HD1 HIS 2 -2.377 4.528 -14.216
6 HD2 HIS 2 HD2 HIS 2 -6.500 5.055 -14.318
7 HE1 HIS 2 HE1 HIS 2 -3.355 2.215 -14.335
8 HE2 HIS 2 HE2 HIS 2 -5.841 2.564 -14.512
No H/Q in entry = 8
In of MODEL 2
1 H PHE 3 H PHE 3 -5.332 6.118 -10.931
2 HA PHE 3 HA PHE 3 -4.522 5.352 -8.958
3 HB2 PHE 3 HB2 PHE 3 -2.172 4.984 -10.770
4 HB3 PHE 3 HB3 PHE 3 -1.959 4.734 -9.042
5 HD1 PHE 3 HD1 PHE 3 -4.062 3.277 -8.037
6 HD2 PHE 3 HD2 PHE 3 -2.476 3.075 -11.979
7 HE1 PHE 3 HE1 PHE 3 -4.954 0.997 -8.276
8 HE2 PHE 3 HE2 PHE 3 -3.362 0.792 -12.225
9 HZ PHE 3 HZ PHE 3 -4.531 -0.281 -10.330
No H/Q in entry = 9
In of MODEL 2
1 H THR 4 H THR 4 -4.585 8.195 -9.277
2 HA THR 4 HA THR 4 -2.183 9.286 -8.159
3 HB THR 4 HB THR 4 -3.569 11.369 -7.863
4 HG1 THR 4 HG1 THR 4 -5.533 9.680 -9.042
5 HG21 THR 4 HG21 THR 4 -2.218 11.002 -9.863
6 HG22 THR 4 HG22 THR 4 -3.554 10.128 -10.613
7 HG23 THR 4 HG23 THR 4 -3.714 11.848 -10.257
No H/Q in entry = 7
In of MODEL 2
1 H LEU 5 H LEU 5 -2.040 10.322 -6.054
2 HA LEU 5 HA LEU 5 -2.803 8.607 -4.011
3 HB2 LEU 5 HB2 LEU 5 -1.923 11.483 -3.868
4 HB3 LEU 5 HB3 LEU 5 -2.085 10.432 -2.476
5 HG LEU 5 HG LEU 5 -0.175 10.010 -4.775
6 HD11 LEU 5 HD11 LEU 5 0.292 10.906 -1.937
7 HD12 LEU 5 HD12 LEU 5 1.548 10.549 -3.122
8 HD13 LEU 5 HD13 LEU 5 0.447 11.902 -3.383
9 HD21 LEU 5 HD21 LEU 5 -0.547 8.486 -2.197
10 HD22 LEU 5 HD22 LEU 5 -0.888 7.893 -3.822
11 HD23 LEU 5 HD23 LEU 5 0.772 8.245 -3.343
No H/Q in entry = 11
In of MODEL 2
1 H GLU 6 H GLU 6 -4.238 11.746 -4.933
2 HA GLU 6 HA GLU 6 -6.234 12.040 -3.076
3 HB2 GLU 6 HB2 GLU 6 -6.683 12.323 -6.058
4 HB3 GLU 6 HB3 GLU 6 -7.563 13.152 -4.781
5 HG2 GLU 6 HG2 GLU 6 -5.623 14.439 -4.204
6 HG3 GLU 6 HG3 GLU 6 -4.630 13.524 -5.334
No H/Q in entry = 6
In of MODEL 2
1 H SER 7 H SER 7 -6.104 9.663 -5.725
2 HA SER 7 HA SER 7 -8.833 9.142 -5.838
3 HB2 SER 7 HB2 SER 7 -7.267 8.397 -7.554
4 HB3 SER 7 HB3 SER 7 -6.525 7.273 -6.420
5 HG SER 7 HG SER 7 -9.146 7.200 -7.502
No H/Q in entry = 5
In of MODEL 2
1 H SER 8 H SER 8 -6.480 6.905 -4.390
2 HA SER 8 HA SER 8 -8.626 5.415 -3.246
3 HB2 SER 8 HB2 SER 8 -6.693 3.951 -2.421
4 HB3 SER 8 HB3 SER 8 -6.937 4.109 -4.162
5 HG SER 8 HG SER 8 -4.902 4.638 -4.133
No H/Q in entry = 5
In of MODEL 2
1 H LEU 9 H LEU 9 -7.089 8.106 -1.964
2 HA LEU 9 HA LEU 9 -6.665 7.388 0.679
3 HB2 LEU 9 HB2 LEU 9 -7.750 9.959 -0.414
4 HB3 LEU 9 HB3 LEU 9 -7.102 9.738 1.201
5 HG LEU 9 HG LEU 9 -5.466 9.150 -1.236
6 HD11 LEU 9 HD11 LEU 9 -6.345 11.398 -1.392
7 HD12 LEU 9 HD12 LEU 9 -5.688 11.778 0.199
8 HD13 LEU 9 HD13 LEU 9 -4.601 11.381 -1.138
9 HD21 LEU 9 HD21 LEU 9 -4.687 8.286 0.918
10 HD22 LEU 9 HD22 LEU 9 -3.609 9.522 0.272
11 HD23 LEU 9 HD23 LEU 9 -4.722 9.920 1.578
No H/Q in entry = 11
In of MODEL 2
1 H ASP 10 H ASP 10 -9.572 7.600 -1.014
2 HA ASP 10 HA ASP 10 -11.181 7.394 1.427
3 HB2 ASP 10 HB2 ASP 10 -12.035 7.699 -1.458
4 HB3 ASP 10 HB3 ASP 10 -13.115 7.687 -0.068
No H/Q in entry = 4
In of MODEL 2
1 H THR 11 H THR 11 -9.518 5.329 -0.485
2 HA THR 11 HA THR 11 -11.444 3.193 0.105
3 HB THR 11 HB THR 11 -10.675 2.012 -1.985
4 HG1 THR 11 HG1 THR 11 -10.016 3.944 -3.539
5 HG21 THR 11 HG21 THR 11 -12.132 4.637 -2.317
6 HG22 THR 11 HG22 THR 11 -12.147 3.308 -3.475
7 HG23 THR 11 HG23 THR 11 -12.855 3.090 -1.874
No H/Q in entry = 7
In of MODEL 2
1 H HIS 12 H HIS 12 -8.373 2.667 -1.545
2 HA HIS 12 HA HIS 12 -7.579 0.718 0.282
3 HB2 HIS 12 HB2 HIS 12 -5.739 2.280 -1.538
4 HB3 HIS 12 HB3 HIS 12 -5.409 0.706 -0.829
5 HD1 HIS 12 HD1 HIS 12 -7.325 -1.192 -1.655
6 HD2 HIS 12 HD2 HIS 12 -6.620 2.111 -4.066
7 HE1 HIS 12 HE1 HIS 12 -8.138 -1.835 -3.949
8 HE2 HIS 12 HE2 HIS 12 -7.957 0.279 -5.299
No H/Q in entry = 8
In of MODEL 2
1 H LEU 13 H LEU 13 -6.878 4.156 0.135
2 HA LEU 13 HA LEU 13 -4.998 3.847 2.376
3 HB2 LEU 13 HB2 LEU 13 -5.249 5.874 0.187
4 HB3 LEU 13 HB3 LEU 13 -4.416 6.282 1.675
5 HG LEU 13 HG LEU 13 -2.761 5.651 0.096
6 HD11 LEU 13 HD11 LEU 13 -2.437 4.799 2.375
7 HD12 LEU 13 HD12 LEU 13 -3.209 3.284 1.907
8 HD13 LEU 13 HD13 LEU 13 -1.689 3.766 1.157
9 HD21 LEU 13 HD21 LEU 13 -4.200 4.463 -1.480
10 HD22 LEU 13 HD22 LEU 13 -2.754 3.533 -1.093
11 HD23 LEU 13 HD23 LEU 13 -4.299 3.101 -0.362
No H/Q in entry = 11
In of MODEL 2
1 H LYS 14 H LYS 14 -7.952 4.005 2.440
2 HA LYS 14 HA LYS 14 -8.763 6.573 3.304
3 HB2 LYS 14 HB2 LYS 14 -10.877 5.599 3.773
4 HB3 LYS 14 HB3 LYS 14 -10.262 4.831 2.324
5 HG2 LYS 14 HG2 LYS 14 -9.548 2.904 3.703
6 HG3 LYS 14 HG3 LYS 14 -10.296 3.673 5.105
7 HD2 LYS 14 HD2 LYS 14 -11.680 2.768 2.579
8 HD3 LYS 14 HD3 LYS 14 -11.816 2.039 4.179
9 HE2 LYS 14 HE2 LYS 14 -12.785 4.164 5.010
10 HE3 LYS 14 HE3 LYS 14 -12.725 4.797 3.366
11 HZ1 LYS 14 HZ1 LYS 14 -14.213 3.010 2.680
12 HZ2 LYS 14 HZ2 LYS 14 -14.293 2.446 4.271
13 HZ3 LYS 14 HZ3 LYS 14 -14.915 3.967 3.881
No H/Q in entry = 13
In of MODEL 2
1 H TRP 15 H TRP 15 -7.179 4.033 4.913
2 HA TRP 15 HA TRP 15 -8.164 4.585 7.543
3 HB2 TRP 15 HB2 TRP 15 -6.350 3.027 8.260
4 HB3 TRP 15 HB3 TRP 15 -7.418 2.345 7.034
5 HD1 TRP 15 HD1 TRP 15 -6.412 2.082 4.549
6 HE1 TRP 15 HE1 TRP 15 -3.991 1.866 3.717
7 HE3 TRP 15 HE3 TRP 15 -3.975 3.724 8.730
8 HZ2 TRP 15 HZ2 TRP 15 -1.383 2.315 4.712
9 HZ3 TRP 15 HZ3 TRP 15 -1.516 3.791 8.712
10 HH2 TRP 15 HH2 TRP 15 -0.249 3.100 6.742
No H/Q in entry = 10
In of MODEL 2
1 H LEU 16 H LEU 16 -5.988 6.158 5.513
2 HA LEU 16 HA LEU 16 -4.202 7.176 7.526
3 HB2 LEU 16 HB2 LEU 16 -4.876 8.219 4.764
4 HB3 LEU 16 HB3 LEU 16 -3.622 8.877 5.789
5 HG LEU 16 HG LEU 16 -3.611 6.054 4.698
6 HD11 LEU 16 HD11 LEU 16 -3.446 7.818 2.947
7 HD12 LEU 16 HD12 LEU 16 -2.004 8.436 3.768
8 HD13 LEU 16 HD13 LEU 16 -2.009 6.802 3.089
9 HD21 LEU 16 HD21 LEU 16 -1.508 7.698 6.107
10 HD22 LEU 16 HD22 LEU 16 -2.283 6.229 6.707
11 HD23 LEU 16 HD23 LEU 16 -1.206 6.156 5.306
No H/Q in entry = 11
In of MODEL 2
1 H SER 17 H SER 17 -4.294 9.153 8.517
2 HA SER 17 HA SER 17 -6.933 10.268 8.868
3 HB2 SER 17 HB2 SER 17 -5.296 10.023 10.751
4 HB3 SER 17 HB3 SER 17 -4.310 11.265 9.992
5 HG SER 17 HG SER 17 -6.347 11.588 11.635
No H/Q in entry = 5
In of MODEL 2
1 H GLN 18 H GLN 18 -7.296 12.684 8.630
2 HA GLN 18 HA GLN 18 -6.860 13.387 5.958
3 HB2 GLN 18 HB2 GLN 18 -8.540 14.297 7.814
4 HB3 GLN 18 HB3 GLN 18 -7.317 15.547 7.970
5 HG2 GLN 18 HG2 GLN 18 -8.661 14.833 5.376
6 HG3 GLN 18 HG3 GLN 18 -9.222 16.100 6.459
7 HE21 GLN 18 HE21 GLN 18 -6.926 15.204 4.062
8 HE22 GLN 18 HE22 GLN 18 -6.141 16.738 3.933
No H/Q in entry = 8
In of MODEL 2
1 H GLU 19 H GLU 19 -5.220 14.499 8.899
2 HA GLU 19 HA GLU 19 -3.440 16.286 7.732
3 HB2 GLU 19 HB2 GLU 19 -3.761 14.914 10.256
4 HB3 GLU 19 HB3 GLU 19 -2.070 15.007 9.817
5 HG2 GLU 19 HG2 GLU 19 -3.963 17.330 10.002
6 HG3 GLU 19 HG3 GLU 19 -2.764 16.878 11.207
No H/Q in entry = 6
In of MODEL 2
1 H GLN 20 H GLN 20 -3.304 12.771 7.993
2 HA GLN 20 HA GLN 20 -0.626 12.572 7.018
3 HB2 GLN 20 HB2 GLN 20 -2.757 10.426 6.969
4 HB3 GLN 20 HB3 GLN 20 -1.017 10.190 6.886
5 HG2 GLN 20 HG2 GLN 20 -0.815 11.092 9.164
6 HG3 GLN 20 HG3 GLN 20 -2.566 11.228 9.242
7 HE21 GLN 20 HE21 GLN 20 0.140 9.122 9.423
8 HE22 GLN 20 HE22 GLN 20 -0.731 7.692 9.859
No H/Q in entry = 8
In of MODEL 2
1 H LYS 21 H LYS 21 -3.857 12.191 5.566
2 HA LYS 21 HA LYS 21 -3.053 11.536 2.976
3 HB2 LYS 21 HB2 LYS 21 -5.426 13.227 3.789
4 HB3 LYS 21 HB3 LYS 21 -5.231 12.398 2.251
5 HG2 LYS 21 HG2 LYS 21 -5.253 10.245 3.413
6 HG3 LYS 21 HG3 LYS 21 -5.454 11.085 4.950
7 HD2 LYS 21 HD2 LYS 21 -7.582 11.992 4.195
8 HD3 LYS 21 HD3 LYS 21 -7.379 11.202 2.631
9 HE2 LYS 21 HE2 LYS 21 -7.368 9.018 3.755
10 HE3 LYS 21 HE3 LYS 21 -7.606 9.821 5.305
11 HZ1 LYS 21 HZ1 LYS 21 -9.717 10.692 4.448
12 HZ2 LYS 21 HZ2 LYS 21 -9.489 9.837 3.010
13 HZ3 LYS 21 HZ3 LYS 21 -9.689 9.004 4.466
No H/Q in entry = 13
In of MODEL 2
1 H ASP 22 H ASP 22 -3.697 14.711 4.389
2 HA ASP 22 HA ASP 22 -2.913 16.271 2.173
3 HB2 ASP 22 HB2 ASP 22 -4.223 17.105 4.128
4 HB3 ASP 22 HB3 ASP 22 -2.763 17.004 5.103
No H/Q in entry = 4
In of MODEL 2
1 H GLU 23 H GLU 23 -1.043 14.924 4.887
2 HA GLU 23 HA GLU 23 1.408 16.117 4.320
3 HB2 GLU 23 HB2 GLU 23 0.776 14.828 6.359
4 HB3 GLU 23 HB3 GLU 23 0.841 13.358 5.401
5 HG2 GLU 23 HG2 GLU 23 3.170 13.748 4.946
6 HG3 GLU 23 HG3 GLU 23 3.107 15.233 5.886
No H/Q in entry = 6
In of MODEL 2
1 H LEU 24 H LEU 24 0.088 12.958 3.295
2 HA LEU 24 HA LEU 24 2.281 12.168 1.731
3 HB2 LEU 24 HB2 LEU 24 -0.626 11.406 1.822
4 HB3 LEU 24 HB3 LEU 24 0.432 10.717 0.613
5 HG LEU 24 HG LEU 24 -0.043 9.375 2.769
6 HD11 LEU 24 HD11 LEU 24 1.637 8.770 1.094
7 HD12 LEU 24 HD12 LEU 24 2.815 9.772 1.940
8 HD13 LEU 24 HD13 LEU 24 2.125 8.358 2.739
9 HD21 LEU 24 HD21 LEU 24 1.815 11.449 3.829
10 HD22 LEU 24 HD22 LEU 24 0.314 10.821 4.517
11 HD23 LEU 24 HD23 LEU 24 1.762 9.818 4.493
No H/Q in entry = 11
In of MODEL 2
1 H LEU 25 H LEU 25 -0.735 13.855 0.890
2 HA LEU 25 HA LEU 25 -0.311 14.051 -1.877
3 HB2 LEU 25 HB2 LEU 25 -1.832 15.813 0.040
4 HB3 LEU 25 HB3 LEU 25 -1.845 16.053 -1.693
5 HG LEU 25 HG LEU 25 -2.821 13.571 -0.281
6 HD11 LEU 25 HD11 LEU 25 -4.349 15.821 -1.582
7 HD12 LEU 25 HD12 LEU 25 -5.049 14.335 -0.941
8 HD13 LEU 25 HD13 LEU 25 -4.267 15.480 0.147
9 HD21 LEU 25 HD21 LEU 25 -2.914 14.393 -3.181
10 HD22 LEU 25 HD22 LEU 25 -1.965 13.078 -2.494
11 HD23 LEU 25 HD23 LEU 25 -3.725 12.986 -2.495
No H/Q in entry = 11
In of MODEL 2
1 H LYS 26 H LYS 26 0.748 16.045 0.800
2 HA LYS 26 HA LYS 26 1.733 18.238 -0.680
3 HB2 LYS 26 HB2 LYS 26 1.272 18.193 1.780
4 HB3 LYS 26 HB3 LYS 26 2.696 17.197 1.988
5 HG2 LYS 26 HG2 LYS 26 2.974 19.831 0.631
6 HG3 LYS 26 HG3 LYS 26 2.774 19.784 2.381
7 HD2 LYS 26 HD2 LYS 26 4.919 18.357 0.807
8 HD3 LYS 26 HD3 LYS 26 5.137 19.840 1.740
9 HE2 LYS 26 HE2 LYS 26 4.378 17.125 2.818
10 HE3 LYS 26 HE3 LYS 26 5.927 17.937 3.012
11 HZ1 LYS 26 HZ1 LYS 26 4.812 19.676 4.276
12 HZ2 LYS 26 HZ2 LYS 26 3.329 18.877 4.108
13 HZ3 LYS 26 HZ3 LYS 26 4.580 18.163 4.992
No H/Q in entry = 13
In of MODEL 2
1 H MET 27 H MET 27 3.304 15.293 0.521
2 HA MET 27 HA MET 27 5.829 15.775 -0.465
3 HB2 MET 27 HB2 MET 27 4.458 13.089 -0.283
4 HB3 MET 27 HB3 MET 27 6.192 13.354 -0.405
5 HG2 MET 27 HG2 MET 27 5.754 14.825 1.747
6 HG3 MET 27 HG3 MET 27 4.361 13.756 1.893
7 HE1 MET 27 HE1 MET 27 5.457 11.156 0.568
8 HE2 MET 27 HE2 MET 27 6.241 10.236 1.855
9 HE3 MET 27 HE3 MET 27 4.661 10.977 2.131
No H/Q in entry = 9
In of MODEL 2
1 H LYS 28 H LYS 28 3.205 14.033 -2.200
2 HA LYS 28 HA LYS 28 4.697 13.552 -4.553
3 HB2 LYS 28 HB2 LYS 28 2.518 12.465 -3.967
4 HB3 LYS 28 HB3 LYS 28 1.719 13.962 -4.444
5 HG2 LYS 28 HG2 LYS 28 2.656 13.771 -6.682
6 HG3 LYS 28 HG3 LYS 28 3.498 12.297 -6.216
7 HD2 LYS 28 HD2 LYS 28 1.283 11.252 -5.766
8 HD3 LYS 28 HD3 LYS 28 0.515 12.708 -6.406
9 HE2 LYS 28 HE2 LYS 28 1.775 12.364 -8.526
10 HE3 LYS 28 HE3 LYS 28 2.369 10.839 -7.879
11 HZ1 LYS 28 HZ1 LYS 28 -0.486 11.505 -8.323
12 HZ2 LYS 28 HZ2 LYS 28 0.459 10.545 -9.343
13 HZ3 LYS 28 HZ3 LYS 28 0.118 10.026 -7.772
No H/Q in entry = 13
In of MODEL 2
1 H LYS 29 H LYS 29 2.650 16.260 -3.581
2 HA LYS 29 HA LYS 29 2.729 17.576 -6.080
3 HB2 LYS 29 HB2 LYS 29 2.070 18.569 -3.315
4 HB3 LYS 29 HB3 LYS 29 1.940 19.575 -4.751
5 HG2 LYS 29 HG2 LYS 29 0.281 18.095 -5.688
6 HG3 LYS 29 HG3 LYS 29 0.470 16.979 -4.334
7 HD2 LYS 29 HD2 LYS 29 -1.522 18.365 -4.055
8 HD3 LYS 29 HD3 LYS 29 -0.332 18.704 -2.797
9 HE2 LYS 29 HE2 LYS 29 0.408 20.682 -4.037
10 HE3 LYS 29 HE3 LYS 29 -0.786 20.343 -5.287
11 HZ1 LYS 29 HZ1 LYS 29 -1.397 20.950 -2.446
12 HZ2 LYS 29 HZ2 LYS 29 -1.559 22.026 -3.740
13 HZ3 LYS 29 HZ3 LYS 29 -2.534 20.650 -3.661
No H/Q in entry = 13
In of MODEL 2
1 H ASP 30 H ASP 30 4.886 17.659 -3.331
2 HA ASP 30 HA ASP 30 6.222 20.024 -4.366
3 HB2 ASP 30 HB2 ASP 30 5.832 19.671 -1.901
4 HB3 ASP 30 HB3 ASP 30 6.989 18.348 -1.962
No H/Q in entry = 4
In of MODEL 2
1 H GLY 31 H GLY 31 6.289 16.806 -4.970
2 HA2 GLY 31 HA2 GLY 31 8.784 17.168 -6.434
3 HA3 GLY 31 HA3 GLY 31 7.533 15.992 -6.791
No H/Q in entry = 3
In of MODEL 2
1 H LYS 32 H LYS 32 7.536 15.302 -3.817
2 HA LYS 32 HA LYS 32 10.013 13.984 -3.398
3 HB2 LYS 32 HB2 LYS 32 7.277 13.572 -2.193
4 HB3 LYS 32 HB3 LYS 32 8.685 12.635 -1.716
5 HG2 LYS 32 HG2 LYS 32 8.252 15.591 -1.383
6 HG3 LYS 32 HG3 LYS 32 8.398 14.369 -0.121
7 HD2 LYS 32 HD2 LYS 32 10.732 13.950 -1.266
8 HD3 LYS 32 HD3 LYS 32 10.504 15.606 -1.827
9 HE2 LYS 32 HE2 LYS 32 11.742 15.672 0.217
10 HE3 LYS 32 HE3 LYS 32 10.121 16.282 0.537
11 HZ1 LYS 32 HZ1 LYS 32 10.958 13.481 1.061
12 HZ2 LYS 32 HZ2 LYS 32 10.985 14.707 2.234
13 HZ3 LYS 32 HZ3 LYS 32 9.518 14.228 1.544
No H/Q in entry = 13
In of MODEL 2
1 H ALA 33 H ALA 33 10.412 11.779 -3.536
2 HA ALA 33 HA ALA 33 9.423 10.548 -5.929
3 HB1 ALA 33 HB1 ALA 33 11.761 10.311 -5.197
4 HB2 ALA 33 HB2 ALA 33 10.971 8.747 -5.394
5 HB3 ALA 33 HB3 ALA 33 11.212 9.414 -3.779
No H/Q in entry = 5
In of MODEL 2
1 H LYS 34 H LYS 34 8.249 8.584 -6.096
2 HA LYS 34 HA LYS 34 6.137 8.153 -4.327
3 HB2 LYS 34 HB2 LYS 34 7.401 6.093 -6.133
4 HB3 LYS 34 HB3 LYS 34 5.788 6.026 -5.440
5 HG2 LYS 34 HG2 LYS 34 5.489 8.309 -6.688
6 HG3 LYS 34 HG3 LYS 34 6.828 7.704 -7.665
7 HD2 LYS 34 HD2 LYS 34 4.151 6.389 -7.220
8 HD3 LYS 34 HD3 LYS 34 4.761 7.085 -8.722
9 HE2 LYS 34 HE2 LYS 34 5.907 4.690 -7.291
10 HE3 LYS 34 HE3 LYS 34 4.886 4.639 -8.726
11 HZ1 LYS 34 HZ1 LYS 34 6.618 5.900 -9.902
12 HZ2 LYS 34 HZ2 LYS 34 7.605 5.815 -8.533
13 HZ3 LYS 34 HZ3 LYS 34 7.170 4.396 -9.348
No H/Q in entry = 13
In of MODEL 2
1 H LYS 35 H LYS 35 9.386 6.835 -4.388
2 HA LYS 35 HA LYS 35 9.113 4.798 -2.503
3 HB2 LYS 35 HB2 LYS 35 11.384 6.470 -3.457
4 HB3 LYS 35 HB3 LYS 35 11.614 5.528 -1.991
5 HG2 LYS 35 HG2 LYS 35 12.417 4.263 -3.844
6 HG3 LYS 35 HG3 LYS 35 10.946 3.499 -3.243
7 HD2 LYS 35 HD2 LYS 35 9.695 4.711 -5.048
8 HD3 LYS 35 HD3 LYS 35 11.255 5.221 -5.696
9 HE2 LYS 35 HE2 LYS 35 10.311 2.381 -5.340
10 HE3 LYS 35 HE3 LYS 35 10.445 3.249 -6.866
11 HZ1 LYS 35 HZ1 LYS 35 12.703 2.574 -5.062
12 HZ2 LYS 35 HZ2 LYS 35 12.322 1.781 -6.505
13 HZ3 LYS 35 HZ3 LYS 35 12.828 3.391 -6.535
No H/Q in entry = 13
In of MODEL 2
1 H GLU 36 H GLU 36 8.949 8.212 -2.037
2 HA GLU 36 HA GLU 36 9.653 8.063 0.772
3 HB2 GLU 36 HB2 GLU 36 8.619 10.411 -0.817
4 HB3 GLU 36 HB3 GLU 36 9.362 10.462 0.779
5 HG2 GLU 36 HG2 GLU 36 11.433 9.534 -0.229
6 HG3 GLU 36 HG3 GLU 36 10.674 9.689 -1.801
No H/Q in entry = 6
In of MODEL 2
1 H LEU 37 H LEU 37 6.902 8.263 -1.308
2 HA LEU 37 HA LEU 37 4.905 8.466 0.669
3 HB2 LEU 37 HB2 LEU 37 4.951 7.312 -2.117
4 HB3 LEU 37 HB3 LEU 37 3.491 7.492 -1.169
5 HG LEU 37 HG LEU 37 3.851 9.234 -2.884
6 HD11 LEU 37 HD11 LEU 37 3.734 10.169 -0.042
7 HD12 LEU 37 HD12 LEU 37 3.231 11.118 -1.439
8 HD13 LEU 37 HD13 LEU 37 2.370 9.635 -1.022
9 HD21 LEU 37 HD21 LEU 37 6.081 10.158 -1.121
10 HD22 LEU 37 HD22 LEU 37 6.222 9.567 -2.774
11 HD23 LEU 37 HD23 LEU 37 5.378 11.082 -2.447
No H/Q in entry = 11
In of MODEL 2
1 H GLU 38 H GLU 38 6.376 5.756 -1.058
2 HA GLU 38 HA GLU 38 5.070 3.585 0.058
3 HB2 GLU 38 HB2 GLU 38 7.990 3.878 -0.647
4 HB3 GLU 38 HB3 GLU 38 7.211 2.346 -0.297
5 HG2 GLU 38 HG2 GLU 38 5.887 2.482 -2.253
6 HG3 GLU 38 HG3 GLU 38 6.373 4.159 -2.539
No H/Q in entry = 6
In of MODEL 2
1 H ALA 39 H ALA 39 7.393 5.716 1.459
2 HA ALA 39 HA ALA 39 8.093 3.851 3.575
3 HB1 ALA 39 HB1 ALA 39 9.090 6.646 3.047
4 HB2 ALA 39 HB2 ALA 39 9.748 5.501 4.215
5 HB3 ALA 39 HB3 ALA 39 9.850 5.157 2.489
No H/Q in entry = 5
In of MODEL 2
1 H LYS 40 H LYS 40 6.486 6.967 3.230
2 HA LYS 40 HA LYS 40 5.862 7.414 5.913
3 HB2 LYS 40 HB2 LYS 40 5.275 8.614 3.479
4 HB3 LYS 40 HB3 LYS 40 3.705 8.075 4.054
5 HG2 LYS 40 HG2 LYS 40 3.950 10.278 4.822
6 HG3 LYS 40 HG3 LYS 40 4.245 9.249 6.227
7 HD2 LYS 40 HD2 LYS 40 6.601 9.537 6.034
8 HD3 LYS 40 HD3 LYS 40 6.420 10.327 4.474
9 HE2 LYS 40 HE2 LYS 40 6.843 12.040 6.043
10 HE3 LYS 40 HE3 LYS 40 5.133 12.132 5.645
11 HZ1 LYS 40 HZ1 LYS 40 4.682 10.857 7.699
12 HZ2 LYS 40 HZ2 LYS 40 6.325 10.966 8.096
13 HZ3 LYS 40 HZ3 LYS 40 5.388 12.370 7.985
No H/Q in entry = 13
In of MODEL 2
1 H ILE 41 H ILE 41 3.906 5.843 3.375
2 HA ILE 41 HA ILE 41 1.755 5.154 5.027
3 HB ILE 41 HB ILE 41 2.669 3.866 2.454
4 HG12 ILE 41 HG12 ILE 41 0.619 6.038 2.915
5 HG13 ILE 41 HG13 ILE 41 2.268 6.329 2.369
6 HG21 ILE 41 HG21 ILE 41 1.098 2.464 3.685
7 HG22 ILE 41 HG22 ILE 41 -0.025 3.816 3.803
8 HG23 ILE 41 HG23 ILE 41 0.358 3.121 2.227
9 HD11 ILE 41 HD11 ILE 41 1.831 5.004 0.372
10 HD12 ILE 41 HD12 ILE 41 0.174 4.740 0.918
11 HD13 ILE 41 HD13 ILE 41 0.721 6.368 0.519
No H/Q in entry = 11
In of MODEL 2
1 H LEU 42 H LEU 42 4.550 3.248 3.938
2 HA LEU 42 HA LEU 42 3.813 0.867 5.241
3 HB2 LEU 42 HB2 LEU 42 6.412 1.949 4.231
4 HB3 LEU 42 HB3 LEU 42 6.350 0.418 5.068
5 HG LEU 42 HG LEU 42 4.961 1.129 2.487
6 HD11 LEU 42 HD11 LEU 42 7.163 -0.817 3.125
7 HD12 LEU 42 HD12 LEU 42 6.382 -0.632 1.555
8 HD13 LEU 42 HD13 LEU 42 7.320 0.696 2.233
9 HD21 LEU 42 HD21 LEU 42 4.761 -1.351 4.178
10 HD22 LEU 42 HD22 LEU 42 3.459 -0.281 3.658
11 HD23 LEU 42 HD23 LEU 42 4.296 -1.287 2.477
No H/Q in entry = 11
In of MODEL 2
1 H HIS 43 H HIS 43 5.612 3.689 6.315
2 HA HIS 43 HA HIS 43 6.381 2.675 8.839
3 HB2 HIS 43 HB2 HIS 43 7.337 4.740 7.901
4 HB3 HIS 43 HB3 HIS 43 5.765 5.523 8.014
5 HD1 HIS 43 HD1 HIS 43 8.048 3.729 10.488
6 HD2 HIS 43 HD2 HIS 43 5.672 7.118 10.164
7 HE1 HIS 43 HE1 HIS 43 8.258 4.909 12.694
8 HE2 HIS 43 HE2 HIS 43 6.694 6.871 12.529
No H/Q in entry = 8
In of MODEL 2
1 H TYR 44 H TYR 44 3.535 4.574 7.816
2 HA TYR 44 HA TYR 44 2.235 4.631 10.306
3 HB2 TYR 44 HB2 TYR 44 1.026 4.683 7.531
4 HB3 TYR 44 HB3 TYR 44 0.189 5.135 9.014
5 HD1 TYR 44 HD1 TYR 44 2.386 6.585 10.377
6 HD2 TYR 44 HD2 TYR 44 1.053 6.729 6.343
7 HE1 TYR 44 HE1 TYR 44 3.269 8.846 10.178
8 HE2 TYR 44 HE2 TYR 44 1.954 9.016 6.118
9 HH TYR 44 HH TYR 44 2.494 10.955 7.749
No H/Q in entry = 9
In of MODEL 2
1 H TYR 45 H TYR 45 2.315 2.296 7.746
2 HA TYR 45 HA TYR 45 0.231 0.607 8.578
3 HB2 TYR 45 HB2 TYR 45 1.124 0.540 6.324
4 HB3 TYR 45 HB3 TYR 45 2.724 0.142 6.933
5 HD1 TYR 45 HD1 TYR 45 -0.743 -1.152 6.931
6 HD2 TYR 45 HD2 TYR 45 3.404 -2.047 6.916
7 HE1 TYR 45 HE1 TYR 45 -1.270 -3.532 6.700
8 HE2 TYR 45 HE2 TYR 45 2.899 -4.436 6.682
9 HH TYR 45 HH TYR 45 1.041 -5.981 7.147
No H/Q in entry = 9
In of MODEL 2
1 H ASP 46 H ASP 46 3.724 0.585 9.222
2 HA ASP 46 HA ASP 46 3.587 -1.889 10.665
3 HB2 ASP 46 HB2 ASP 46 5.602 -1.317 9.413
4 HB3 ASP 46 HB3 ASP 46 5.826 0.133 10.381
No H/Q in entry = 4
In of MODEL 2
1 H GLU 47 H GLU 47 3.114 1.395 11.533
2 HA GLU 47 HA GLU 47 3.674 0.848 14.330
3 HB2 GLU 47 HB2 GLU 47 3.166 3.208 14.706
4 HB3 GLU 47 HB3 GLU 47 4.397 2.996 13.474
5 HG2 GLU 47 HG2 GLU 47 2.752 3.392 11.746
6 HG3 GLU 47 HG3 GLU 47 1.492 3.568 12.964
No H/Q in entry = 6
In of MODEL 2
1 H LEU 48 H LEU 48 1.210 0.169 12.311
2 HA LEU 48 HA LEU 48 -1.023 1.022 13.813
3 HB2 LEU 48 HB2 LEU 48 -0.659 -0.990 11.631
4 HB3 LEU 48 HB3 LEU 48 -2.193 -0.796 12.453
5 HG LEU 48 HG LEU 48 -0.764 1.336 10.862
6 HD11 LEU 48 HD11 LEU 48 -1.705 -0.472 9.526
7 HD12 LEU 48 HD12 LEU 48 -3.256 -0.251 10.339
8 HD13 LEU 48 HD13 LEU 48 -2.609 1.028 9.311
9 HD21 LEU 48 HD21 LEU 48 -3.402 1.333 12.316
10 HD22 LEU 48 HD22 LEU 48 -2.013 2.378 12.629
11 HD23 LEU 48 HD23 LEU 48 -2.927 2.540 11.124
No H/Q in entry = 11
In of MODEL 2
1 H GLU 49 H GLU 49 -2.193 -0.007 15.190
2 HA GLU 49 HA GLU 49 -0.910 -1.671 16.999
3 HB2 GLU 49 HB2 GLU 49 -3.304 -1.963 17.980
4 HB3 GLU 49 HB3 GLU 49 -2.501 -0.405 18.024
5 HG2 GLU 49 HG2 GLU 49 -4.373 0.408 17.169
6 HG3 GLU 49 HG3 GLU 49 -3.858 -0.311 15.648
No H/Q in entry = 6
In of MODEL 2
1 H GLY 50 H GLY 50 -4.019 -2.820 15.637
2 HA2 GLY 50 HA2 GLY 50 -3.861 -5.413 16.229
3 HA3 GLY 50 HA3 GLY 50 -2.729 -5.329 14.888
No H/Q in entry = 3
In of MODEL 2
1 H ASP 51 H ASP 51 -6.037 -4.313 15.715
2 HA ASP 51 HA ASP 51 -7.136 -5.671 13.434
3 HB2 ASP 51 HB2 ASP 51 -8.418 -3.662 15.306
4 HB3 ASP 51 HB3 ASP 51 -9.273 -4.669 14.145
No H/Q in entry = 4
In of MODEL 2
1 H ALA 52 H ALA 52 -6.387 -2.322 14.273
2 HA ALA 52 HA ALA 52 -7.250 -1.110 11.868
3 HB1 ALA 52 HB1 ALA 52 -4.887 -0.376 13.599
4 HB2 ALA 52 HB2 ALA 52 -5.658 0.653 12.388
5 HB3 ALA 52 HB3 ALA 52 -6.547 0.176 13.836
No H/Q in entry = 5
In of MODEL 2
1 H LYS 53 H LYS 53 -4.214 -2.568 12.847
2 HA LYS 53 HA LYS 53 -2.733 -2.198 10.525
3 HB2 LYS 53 HB2 LYS 53 -2.058 -3.114 12.865
4 HB3 LYS 53 HB3 LYS 53 -2.515 -4.679 12.215
5 HG2 LYS 53 HG2 LYS 53 -0.520 -2.929 10.820
6 HG3 LYS 53 HG3 LYS 53 -0.050 -3.999 12.140
7 HD2 LYS 53 HD2 LYS 53 -1.047 -5.892 10.853
8 HD3 LYS 53 HD3 LYS 53 -1.295 -4.776 9.509
9 HE2 LYS 53 HE2 LYS 53 1.098 -4.360 9.376
10 HE3 LYS 53 HE3 LYS 53 1.376 -5.398 10.770
11 HZ1 LYS 53 HZ1 LYS 53 0.432 -7.252 9.456
12 HZ2 LYS 53 HZ2 LYS 53 0.364 -6.231 8.106
13 HZ3 LYS 53 HZ3 LYS 53 1.856 -6.624 8.801
No H/Q in entry = 13
In of MODEL 2
1 H LYS 54 H LYS 54 -4.670 -5.006 11.529
2 HA LYS 54 HA LYS 54 -4.473 -6.527 9.222
3 HB2 LYS 54 HB2 LYS 54 -5.804 -7.885 10.338
4 HB3 LYS 54 HB3 LYS 54 -5.901 -6.664 11.594
5 HG2 LYS 54 HG2 LYS 54 -7.950 -5.858 10.817
6 HG3 LYS 54 HG3 LYS 54 -7.772 -6.658 9.249
7 HD2 LYS 54 HD2 LYS 54 -7.948 -8.826 10.338
8 HD3 LYS 54 HD3 LYS 54 -8.089 -8.040 11.911
9 HE2 LYS 54 HE2 LYS 54 -10.292 -8.617 11.259
10 HE3 LYS 54 HE3 LYS 54 -10.142 -6.880 11.012
11 HZ1 LYS 54 HZ1 LYS 54 -9.717 -7.336 8.638
12 HZ2 LYS 54 HZ2 LYS 54 -9.995 -8.980 8.924
13 HZ3 LYS 54 HZ3 LYS 54 -11.244 -7.866 9.146
No H/Q in entry = 13
In of MODEL 2
1 H GLU 55 H GLU 55 -6.756 -3.853 9.920
2 HA GLU 55 HA GLU 55 -8.324 -4.337 7.642
3 HB2 GLU 55 HB2 GLU 55 -9.515 -3.229 9.238
4 HB3 GLU 55 HB3 GLU 55 -8.078 -2.501 9.933
5 HG2 GLU 55 HG2 GLU 55 -9.086 -0.684 9.207
6 HG3 GLU 55 HG3 GLU 55 -8.175 -1.075 7.760
No H/Q in entry = 6
In of MODEL 2
1 H ALA 56 H ALA 56 -5.782 -1.969 8.474
2 HA ALA 56 HA ALA 56 -5.725 -0.748 5.974
3 HB1 ALA 56 HB1 ALA 56 -3.486 0.031 6.553
4 HB2 ALA 56 HB2 ALA 56 -3.373 -1.178 7.830
5 HB3 ALA 56 HB3 ALA 56 -4.540 0.139 7.966
No H/Q in entry = 5
In of MODEL 2
1 H THR 57 H THR 57 -3.843 -3.492 7.222
2 HA THR 57 HA THR 57 -2.303 -4.200 5.090
3 HB THR 57 HB THR 57 -3.886 -6.062 6.874
4 HG1 THR 57 HG1 THR 57 -2.482 -4.799 8.070
5 HG21 THR 57 HG21 THR 57 -1.484 -6.623 5.135
6 HG22 THR 57 HG22 THR 57 -2.193 -7.745 6.298
7 HG23 THR 57 HG23 THR 57 -3.120 -7.233 4.887
No H/Q in entry = 7
In of MODEL 2
1 H GLU 58 H GLU 58 -5.645 -5.103 5.643
2 HA GLU 58 HA GLU 58 -6.052 -6.620 3.307
3 HB2 GLU 58 HB2 GLU 58 -7.885 -5.224 5.247
4 HB3 GLU 58 HB3 GLU 58 -8.509 -6.118 3.863
5 HG2 GLU 58 HG2 GLU 58 -7.437 -8.141 4.688
6 HG3 GLU 58 HG3 GLU 58 -6.769 -7.237 6.048
No H/Q in entry = 6
In of MODEL 2
1 H HIS 59 H HIS 59 -6.227 -3.157 3.914
2 HA HIS 59 HA HIS 59 -7.593 -2.584 1.444
3 HB2 HIS 59 HB2 HIS 59 -6.202 -0.861 3.483
4 HB3 HIS 59 HB3 HIS 59 -6.796 -0.200 1.968
5 HD1 HIS 59 HD1 HIS 59 -9.544 -1.211 1.674
6 HD2 HIS 59 HD2 HIS 59 -7.968 -0.244 5.393
7 HE1 HIS 59 HE1 HIS 59 -11.526 -0.750 3.146
8 HE2 HIS 59 HE2 HIS 59 -10.549 -0.400 5.447
No H/Q in entry = 8
In of MODEL 2
1 H LEU 60 H LEU 60 -4.279 -2.087 2.661
2 HA LEU 60 HA LEU 60 -3.080 -1.337 0.315
3 HB2 LEU 60 HB2 LEU 60 -2.111 -2.737 2.767
4 HB3 LEU 60 HB3 LEU 60 -1.026 -2.480 1.411
5 HG LEU 60 HG LEU 60 -1.606 -0.065 1.542
6 HD11 LEU 60 HD11 LEU 60 -3.662 -0.212 2.728
7 HD12 LEU 60 HD12 LEU 60 -2.811 -0.795 4.162
8 HD13 LEU 60 HD13 LEU 60 -2.520 0.843 3.566
9 HD21 LEU 60 HD21 LEU 60 -0.266 -1.286 3.937
10 HD22 LEU 60 HD22 LEU 60 0.504 -0.884 2.402
11 HD23 LEU 60 HD23 LEU 60 -0.116 0.400 3.440
No H/Q in entry = 11
In of MODEL 2
1 H LYS 61 H LYS 61 -3.821 -4.609 1.494
2 HA LYS 61 HA LYS 61 -2.510 -6.091 -0.465
3 HB2 LYS 61 HB2 LYS 61 -4.991 -6.549 1.142
4 HB3 LYS 61 HB3 LYS 61 -4.650 -7.627 -0.203
5 HG2 LYS 61 HG2 LYS 61 -2.407 -8.054 0.835
6 HG3 LYS 61 HG3 LYS 61 -2.973 -7.158 2.246
7 HD2 LYS 61 HD2 LYS 61 -4.757 -8.730 2.602
8 HD3 LYS 61 HD3 LYS 61 -4.388 -9.558 1.088
9 HE2 LYS 61 HE2 LYS 61 -2.164 -10.142 2.014
10 HE3 LYS 61 HE3 LYS 61 -2.646 -9.417 3.545
11 HZ1 LYS 61 HZ1 LYS 61 -3.998 -11.715 2.232
12 HZ2 LYS 61 HZ2 LYS 61 -2.939 -11.821 3.544
13 HZ3 LYS 61 HZ3 LYS 61 -4.422 -11.033 3.718
No H/Q in entry = 13
In of MODEL 2
1 H GLY 62 H GLY 62 -5.872 -4.946 -0.477
2 HA2 GLY 62 HA2 GLY 62 -7.239 -4.308 -2.195
3 HA3 GLY 62 HA3 GLY 62 -6.476 -5.591 -3.117
No H/Q in entry = 3
In of MODEL 2
1 H GLY 63 H GLY 63 -4.968 -2.670 -1.785
2 HA2 GLY 63 HA2 GLY 63 -3.612 -1.121 -2.787
3 HA3 GLY 63 HA3 GLY 63 -4.850 -1.087 -4.032
No H/Q in entry = 3
In of MODEL 2
1 H CYS 64 H CYS 64 -2.273 -3.377 -3.043
2 HA CYS 64 HA CYS 64 -0.946 -2.977 -5.558
3 HB2 CYS 64 HB2 CYS 64 0.685 -4.613 -4.764
4 HB3 CYS 64 HB3 CYS 64 0.362 -3.395 -3.537
No H/Q in entry = 4
In of MODEL 2
1 H ARG 65 H ARG 65 -3.261 -5.209 -4.290
2 HA ARG 65 HA ARG 65 -3.029 -7.214 -6.287
3 HB2 ARG 65 HB2 ARG 65 -4.283 -7.365 -4.087
4 HB3 ARG 65 HB3 ARG 65 -5.540 -6.388 -4.825
5 HG2 ARG 65 HG2 ARG 65 -5.940 -8.116 -6.484
6 HG3 ARG 65 HG3 ARG 65 -4.641 -9.094 -5.792
7 HD2 ARG 65 HD2 ARG 65 -5.857 -9.142 -3.650
8 HD3 ARG 65 HD3 ARG 65 -7.166 -8.233 -4.389
9 HE ARG 65 HE ARG 65 -6.395 -10.983 -5.119
10 HH11 ARG 65 HH11 ARG 65 -8.763 -8.406 -4.975
11 HH12 ARG 65 HH12 ARG 65 -10.091 -9.436 -5.405
12 HH21 ARG 65 HH21 ARG 65 -8.142 -12.335 -5.678
13 HH22 ARG 65 HH22 ARG 65 -9.743 -11.670 -5.798
No H/Q in entry = 13
In of MODEL 2
1 H GLU 66 H GLU 66 -4.759 -4.161 -6.065
2 HA GLU 66 HA GLU 66 -6.173 -4.348 -8.500
3 HB2 GLU 66 HB2 GLU 66 -6.635 -2.772 -6.595
4 HB3 GLU 66 HB3 GLU 66 -5.197 -1.875 -7.059
5 HG2 GLU 66 HG2 GLU 66 -7.134 -0.778 -7.920
6 HG3 GLU 66 HG3 GLU 66 -6.199 -1.463 -9.245
No H/Q in entry = 6
In of MODEL 2
1 H ILE 67 H ILE 67 -2.983 -3.209 -7.565
2 HA ILE 67 HA ILE 67 -2.134 -2.321 -10.108
3 HB ILE 67 HB ILE 67 -0.588 -3.408 -7.756
4 HG12 ILE 67 HG12 ILE 67 -0.945 -0.625 -8.886
5 HG13 ILE 67 HG13 ILE 67 -1.697 -1.253 -7.422
6 HG21 ILE 67 HG21 ILE 67 0.677 -3.877 -9.822
7 HG22 ILE 67 HG22 ILE 67 0.542 -2.172 -10.269
8 HG23 ILE 67 HG23 ILE 67 1.456 -2.634 -8.833
9 HD11 ILE 67 HD11 ILE 67 1.251 -0.855 -7.862
10 HD12 ILE 67 HD12 ILE 67 0.188 0.184 -6.915
11 HD13 ILE 67 HD13 ILE 67 0.497 -1.470 -6.391
No H/Q in entry = 11
In of MODEL 2
1 H LEU 68 H LEU 68 -1.887 -5.456 -8.473
2 HA LEU 68 HA LEU 68 -0.633 -6.911 -10.495
3 HB2 LEU 68 HB2 LEU 68 -1.132 -7.656 -8.147
4 HB3 LEU 68 HB3 LEU 68 -2.798 -7.896 -8.633
5 HG LEU 68 HG LEU 68 -2.008 -9.575 -10.302
6 HD11 LEU 68 HD11 LEU 68 0.285 -8.756 -10.533
7 HD12 LEU 68 HD12 LEU 68 0.620 -9.238 -8.871
8 HD13 LEU 68 HD13 LEU 68 0.244 -10.461 -10.083
9 HD21 LEU 68 HD21 LEU 68 -1.288 -10.097 -7.423
10 HD22 LEU 68 HD22 LEU 68 -2.891 -10.261 -8.141
11 HD23 LEU 68 HD23 LEU 68 -1.581 -11.328 -8.651
No H/Q in entry = 11
In of MODEL 2
1 H LYS 69 H LYS 69 -3.992 -6.055 -9.998
2 HA LYS 69 HA LYS 69 -5.112 -7.538 -12.091
3 HB2 LYS 69 HB2 LYS 69 -6.332 -6.416 -10.196
4 HB3 LYS 69 HB3 LYS 69 -6.121 -4.893 -11.051
5 HG2 LYS 69 HG2 LYS 69 -7.394 -5.739 -12.927
6 HG3 LYS 69 HG3 LYS 69 -7.551 -7.301 -12.126
7 HD2 LYS 69 HD2 LYS 69 -8.833 -6.293 -10.337
8 HD3 LYS 69 HD3 LYS 69 -8.606 -4.691 -11.047
9 HE2 LYS 69 HE2 LYS 69 -10.046 -7.004 -12.337
10 HE3 LYS 69 HE3 LYS 69 -10.818 -5.621 -11.559
11 HZ1 LYS 69 HZ1 LYS 69 -9.613 -4.202 -13.206
12 HZ2 LYS 69 HZ2 LYS 69 -9.155 -5.619 -14.021
13 HZ3 LYS 69 HZ3 LYS 69 -10.792 -5.211 -13.877
No H/Q in entry = 13
In of MODEL 2
1 H HIS 70 H HIS 70 -3.098 -4.822 -12.199
2 HA HIS 70 HA HIS 70 -3.956 -4.089 -14.914
3 HB2 HIS 70 HB2 HIS 70 -3.793 -2.182 -13.422
4 HB3 HIS 70 HB3 HIS 70 -2.179 -2.662 -12.916
5 HD1 HIS 70 HD1 HIS 70 -4.004 -0.778 -15.522
6 HD2 HIS 70 HD2 HIS 70 -0.136 -2.183 -14.868
7 HE1 HIS 70 HE1 HIS 70 -2.544 0.465 -17.153
8 HE2 HIS 70 HE2 HIS 70 -0.205 -0.357 -16.708
No H/Q in entry = 8
In of MODEL 2
1 H VAL 71 H VAL 71 -1.288 -5.025 -12.919
2 HA VAL 71 HA VAL 71 0.697 -4.724 -14.920
3 HB VAL 71 HB VAL 71 0.546 -5.416 -12.021
4 HG11 VAL 71 HG11 VAL 71 3.039 -5.543 -13.671
5 HG12 VAL 71 HG12 VAL 71 2.969 -5.486 -11.902
6 HG13 VAL 71 HG13 VAL 71 2.295 -6.874 -12.771
7 HG21 VAL 71 HG21 VAL 71 1.835 -3.289 -13.665
8 HG22 VAL 71 HG22 VAL 71 0.409 -3.139 -12.639
9 HG23 VAL 71 HG23 VAL 71 1.994 -3.431 -11.911
No H/Q in entry = 9
In of MODEL 2
1 H VAL 72 H VAL 72 -0.617 -7.506 -13.102
2 HA VAL 72 HA VAL 72 0.681 -9.210 -15.054
3 HB VAL 72 HB VAL 72 0.399 -9.634 -12.435
4 HG11 VAL 72 HG11 VAL 72 -1.984 -11.009 -13.631
5 HG12 VAL 72 HG12 VAL 72 -1.310 -11.366 -12.039
6 HG13 VAL 72 HG13 VAL 72 -1.986 -9.771 -12.377
7 HG21 VAL 72 HG21 VAL 72 0.433 -11.723 -14.582
8 HG22 VAL 72 HG22 VAL 72 1.819 -10.910 -13.857
9 HG23 VAL 72 HG23 VAL 72 0.841 -12.012 -12.890
No H/Q in entry = 9
In of MODEL 2
1 H GLY 73 H GLY 73 -2.352 -7.837 -14.321
2 HA2 GLY 73 HA2 GLY 73 -3.483 -8.968 -16.750
3 HA3 GLY 73 HA3 GLY 73 -4.104 -7.597 -15.839
No H/Q in entry = 3
In of MODEL 2
1 H GLU 74 H GLU 74 -6.153 -8.837 -16.295
2 HA GLU 74 HA GLU 74 -7.097 -10.139 -14.004
3 HB2 GLU 74 HB2 GLU 74 -8.154 -10.036 -16.822
4 HB3 GLU 74 HB3 GLU 74 -8.989 -10.913 -15.551
5 HG2 GLU 74 HG2 GLU 74 -10.027 -8.803 -15.749
6 HG3 GLU 74 HG3 GLU 74 -9.088 -8.776 -14.260
No H/Q in entry = 6
In of MODEL 2
1 H GLU 75 H GLU 75 -5.396 -11.331 -16.739
2 HA GLU 75 HA GLU 75 -6.136 -14.015 -16.791
3 HB2 GLU 75 HB2 GLU 75 -4.778 -13.113 -18.544
4 HB3 GLU 75 HB3 GLU 75 -3.516 -12.648 -17.413
5 HG2 GLU 75 HG2 GLU 75 -3.042 -15.000 -16.969
6 HG3 GLU 75 HG3 GLU 75 -4.304 -15.467 -18.110
No H/Q in entry = 6
In of MODEL 2
1 H LYS 76 H LYS 76 -3.161 -12.782 -15.236
2 HA LYS 76 HA LYS 76 -2.797 -15.338 -14.030
3 HB2 LYS 76 HB2 LYS 76 -1.229 -12.779 -13.689
4 HB3 LYS 76 HB3 LYS 76 -0.746 -14.362 -13.123
5 HG2 LYS 76 HG2 LYS 76 -1.113 -13.531 -15.986
6 HG3 LYS 76 HG3 LYS 76 0.418 -13.841 -15.164
7 HD2 LYS 76 HD2 LYS 76 -1.758 -15.877 -15.653
8 HD3 LYS 76 HD3 LYS 76 -0.271 -15.728 -16.583
9 HE2 LYS 76 HE2 LYS 76 1.040 -16.246 -14.606
10 HE3 LYS 76 HE3 LYS 76 -0.428 -16.321 -13.632
11 HZ1 LYS 76 HZ1 LYS 76 -1.181 -18.168 -15.049
12 HZ2 LYS 76 HZ2 LYS 76 0.308 -18.139 -15.859
13 HZ3 LYS 76 HZ3 LYS 76 0.252 -18.526 -14.214
No H/Q in entry = 13
In of MODEL 2
1 H ALA 77 H ALA 77 -3.888 -12.179 -12.934
2 HA ALA 77 HA ALA 77 -3.800 -12.694 -10.168
3 HB1 ALA 77 HB1 ALA 77 -5.403 -10.869 -9.948
4 HB2 ALA 77 HB2 ALA 77 -5.758 -10.944 -11.676
5 HB3 ALA 77 HB3 ALA 77 -4.157 -10.448 -11.124
No H/Q in entry = 5
In of MODEL 2
1 H ALA 78 H ALA 78 -6.031 -13.619 -12.684
2 HA ALA 78 HA ALA 78 -8.151 -14.536 -11.058
3 HB1 ALA 78 HB1 ALA 78 -7.252 -15.184 -13.860
4 HB2 ALA 78 HB2 ALA 78 -8.659 -15.962 -13.114
5 HB3 ALA 78 HB3 ALA 78 -8.630 -14.213 -13.338
No H/Q in entry = 5
In of MODEL 2
1 H GLU 79 H GLU 79 -5.214 -16.017 -12.294
2 HA GLU 79 HA GLU 79 -5.853 -18.638 -11.327
3 HB2 GLU 79 HB2 GLU 79 -3.163 -17.569 -12.180
4 HB3 GLU 79 HB3 GLU 79 -3.646 -19.256 -12.075
5 HG2 GLU 79 HG2 GLU 79 -5.424 -18.657 -13.805
6 HG3 GLU 79 HG3 GLU 79 -4.487 -17.187 -14.057
No H/Q in entry = 6
In of MODEL 2
1 H LEU 80 H LEU 80 -4.083 -15.870 -10.152
2 HA LEU 80 HA LEU 80 -2.916 -17.242 -7.933
3 HB2 LEU 80 HB2 LEU 80 -3.291 -14.301 -8.486
4 HB3 LEU 80 HB3 LEU 80 -2.294 -14.969 -7.203
5 HG LEU 80 HG LEU 80 -1.839 -15.567 -10.121
6 HD11 LEU 80 HD11 LEU 80 -0.573 -13.460 -8.392
7 HD12 LEU 80 HD12 LEU 80 0.034 -13.969 -9.971
8 HD13 LEU 80 HD13 LEU 80 -1.560 -13.213 -9.835
9 HD21 LEU 80 HD21 LEU 80 -0.949 -17.195 -8.544
10 HD22 LEU 80 HD22 LEU 80 0.345 -16.308 -9.346
11 HD23 LEU 80 HD23 LEU 80 -0.102 -15.911 -7.688
No H/Q in entry = 11
In of MODEL 2
1 H LYS 81 H LYS 81 -5.829 -15.355 -8.491
2 HA LYS 81 HA LYS 81 -6.730 -15.214 -5.837
3 HB2 LYS 81 HB2 LYS 81 -7.747 -14.034 -7.832
4 HB3 LYS 81 HB3 LYS 81 -8.452 -15.568 -8.308
5 HG2 LYS 81 HG2 LYS 81 -9.020 -14.210 -5.678
6 HG3 LYS 81 HG3 LYS 81 -10.000 -14.003 -7.126
7 HD2 LYS 81 HD2 LYS 81 -10.468 -16.410 -7.148
8 HD3 LYS 81 HD3 LYS 81 -9.483 -16.616 -5.702
9 HE2 LYS 81 HE2 LYS 81 -11.828 -16.565 -5.110
10 HE3 LYS 81 HE3 LYS 81 -11.016 -15.138 -4.472
11 HZ1 LYS 81 HZ1 LYS 81 -12.595 -15.189 -6.981
12 HZ2 LYS 81 HZ2 LYS 81 -13.184 -14.657 -5.491
13 HZ3 LYS 81 HZ3 LYS 81 -11.919 -13.828 -6.244
No H/Q in entry = 13
In of MODEL 2
1 H ASN 82 H ASN 82 -7.367 -17.604 -8.383
2 HA ASN 82 HA ASN 82 -8.861 -19.318 -6.723
3 HB2 ASN 82 HB2 ASN 82 -8.933 -19.372 -9.221
4 HB3 ASN 82 HB3 ASN 82 -7.310 -20.035 -9.224
5 HD21 ASN 82 HD21 ASN 82 -9.938 -20.873 -7.006
6 HD22 ASN 82 HD22 ASN 82 -10.062 -22.521 -7.511
No H/Q in entry = 6
In of MODEL 2
1 H LEU 83 H LEU 83 -5.409 -19.065 -7.394
2 HA LEU 83 HA LEU 83 -4.618 -21.493 -6.262
3 HB2 LEU 83 HB2 LEU 83 -3.402 -18.935 -7.009
4 HB3 LEU 83 HB3 LEU 83 -2.599 -19.739 -5.692
5 HG LEU 83 HG LEU 83 -3.156 -21.062 -8.337
6 HD11 LEU 83 HD11 LEU 83 -0.651 -19.681 -7.388
7 HD12 LEU 83 HD12 LEU 83 -0.784 -20.671 -8.841
8 HD13 LEU 83 HD13 LEU 83 -1.697 -19.169 -8.714
9 HD21 LEU 83 HD21 LEU 83 -2.809 -22.574 -6.429
10 HD22 LEU 83 HD22 LEU 83 -1.499 -22.679 -7.604
11 HD23 LEU 83 HD23 LEU 83 -1.265 -21.788 -6.102
No H/Q in entry = 11
In of MODEL 2
1 H LYS 84 H LYS 84 -5.125 -18.279 -4.881
2 HA LYS 84 HA LYS 84 -4.328 -18.751 -2.248
3 HB2 LYS 84 HB2 LYS 84 -4.770 -16.531 -3.100
4 HB3 LYS 84 HB3 LYS 84 -6.464 -16.931 -3.344
5 HG2 LYS 84 HG2 LYS 84 -6.244 -15.604 -1.385
6 HG3 LYS 84 HG3 LYS 84 -6.711 -17.228 -0.910
7 HD2 LYS 84 HD2 LYS 84 -4.418 -17.714 -0.270
8 HD3 LYS 84 HD3 LYS 84 -3.904 -16.119 -0.825
9 HE2 LYS 84 HE2 LYS 84 -5.398 -15.088 0.842
10 HE3 LYS 84 HE3 LYS 84 -5.838 -16.692 1.418
11 HZ1 LYS 84 HZ1 LYS 84 -3.523 -17.058 2.026
12 HZ2 LYS 84 HZ2 LYS 84 -3.119 -15.509 1.491
13 HZ3 LYS 84 HZ3 LYS 84 -4.151 -15.700 2.816
No H/Q in entry = 13
In of MODEL 2
1 H ASP 85 H ASP 85 -7.621 -18.851 -3.610
2 HA ASP 85 HA ASP 85 -8.781 -19.857 -1.228
3 HB2 ASP 85 HB2 ASP 85 -9.782 -19.534 -4.044
4 HB3 ASP 85 HB3 ASP 85 -10.775 -20.275 -2.793
No H/Q in entry = 4
In of MODEL 2
1 H SER 86 H SER 86 -7.258 -21.481 -3.904
2 HA SER 86 HA SER 86 -8.484 -24.024 -3.294
3 HB2 SER 86 HB2 SER 86 -6.068 -23.388 -5.003
4 HB3 SER 86 HB3 SER 86 -6.853 -24.961 -4.899
5 HG SER 86 HG SER 86 -7.984 -22.538 -5.858
No H/Q in entry = 5
In of MODEL 2
1 H GLY 87 H GLY 87 -6.024 -22.170 -1.929
2 HA2 GLY 87 HA2 GLY 87 -5.256 -24.518 -0.319
3 HA3 GLY 87 HA3 GLY 87 -5.357 -22.877 0.294
No H/Q in entry = 3
In of MODEL 2
1 H ALA 88 H ALA 88 -3.956 -22.157 -2.460
2 HA ALA 88 HA ALA 88 -1.328 -23.051 -2.200
3 HB1 ALA 88 HB1 ALA 88 -2.298 -20.375 -3.198
4 HB2 ALA 88 HB2 ALA 88 -2.080 -21.836 -4.162
5 HB3 ALA 88 HB3 ALA 88 -0.683 -21.035 -3.447
No H/Q in entry = 5
In of MODEL 2
1 H SER 89 H SER 89 0.097 -22.629 -0.692
2 HA SER 89 HA SER 89 -0.411 -21.006 1.568
3 HB2 SER 89 HB2 SER 89 2.134 -22.381 0.682
4 HB3 SER 89 HB3 SER 89 1.793 -21.762 2.286
5 HG SER 89 HG SER 89 1.335 -24.145 1.547
No H/Q in entry = 5
In of MODEL 2
1 H LYS 90 H LYS 90 1.511 -19.466 2.301
2 HA LYS 90 HA LYS 90 1.303 -17.275 0.570
3 HB2 LYS 90 HB2 LYS 90 2.852 -16.115 2.058
4 HB3 LYS 90 HB3 LYS 90 1.622 -16.980 2.962
5 HG2 LYS 90 HG2 LYS 90 3.206 -18.724 3.515
6 HG3 LYS 90 HG3 LYS 90 4.444 -17.939 2.529
7 HD2 LYS 90 HD2 LYS 90 4.358 -15.978 3.979
8 HD3 LYS 90 HD3 LYS 90 3.108 -16.744 4.955
9 HE2 LYS 90 HE2 LYS 90 5.897 -17.815 4.564
10 HE3 LYS 90 HE3 LYS 90 5.365 -16.882 5.959
11 HZ1 LYS 90 HZ1 LYS 90 3.747 -18.620 6.445
12 HZ2 LYS 90 HZ2 LYS 90 4.296 -19.524 5.126
13 HZ3 LYS 90 HZ3 LYS 90 5.323 -19.231 6.436
No H/Q in entry = 13
In of MODEL 2
1 H GLU 91 H GLU 91 3.634 -19.838 0.665
2 HA GLU 91 HA GLU 91 5.657 -18.405 -0.771
3 HB2 GLU 91 HB2 GLU 91 6.248 -20.183 0.780
4 HB3 GLU 91 HB3 GLU 91 5.375 -21.348 -0.205
5 HG2 GLU 91 HG2 GLU 91 6.908 -21.004 -2.028
6 HG3 GLU 91 HG3 GLU 91 7.758 -19.758 -1.118
No H/Q in entry = 6
In of MODEL 2
1 H GLU 92 H GLU 92 3.195 -20.798 -1.671
2 HA GLU 92 HA GLU 92 3.916 -21.175 -4.332
3 HB2 GLU 92 HB2 GLU 92 1.170 -21.206 -3.081
4 HB3 GLU 92 HB3 GLU 92 1.636 -21.975 -4.583
5 HG2 GLU 92 HG2 GLU 92 2.852 -22.666 -1.947
6 HG3 GLU 92 HG3 GLU 92 1.431 -23.464 -2.598
No H/Q in entry = 6
In of MODEL 2
1 H LEU 93 H LEU 93 1.808 -18.850 -2.725
2 HA LEU 93 HA LEU 93 1.365 -17.351 -5.115
3 HB2 LEU 93 HB2 LEU 93 1.180 -16.492 -2.222
4 HB3 LEU 93 HB3 LEU 93 0.614 -15.544 -3.593
5 HG LEU 93 HG LEU 93 -0.446 -18.216 -2.671
6 HD11 LEU 93 HD11 LEU 93 -1.699 -15.494 -2.846
7 HD12 LEU 93 HD12 LEU 93 -2.562 -16.991 -2.472
8 HD13 LEU 93 HD13 LEU 93 -1.307 -16.400 -1.380
9 HD21 LEU 93 HD21 LEU 93 -1.088 -16.651 -5.162
10 HD22 LEU 93 HD22 LEU 93 -0.420 -18.282 -5.059
11 HD23 LEU 93 HD23 LEU 93 -2.075 -17.972 -4.535
No H/Q in entry = 11
In of MODEL 2
1 H LYS 94 H LYS 94 3.860 -17.249 -2.563
2 HA LYS 94 HA LYS 94 4.899 -14.761 -3.332
3 HB2 LYS 94 HB2 LYS 94 5.416 -15.860 -1.196
4 HB3 LYS 94 HB3 LYS 94 6.256 -17.141 -2.042
5 HG2 LYS 94 HG2 LYS 94 7.899 -15.450 -2.840
6 HG3 LYS 94 HG3 LYS 94 7.110 -14.273 -1.783
7 HD2 LYS 94 HD2 LYS 94 7.577 -15.661 0.153
8 HD3 LYS 94 HD3 LYS 94 8.289 -16.900 -0.878
9 HE2 LYS 94 HE2 LYS 94 10.021 -15.284 -1.566
10 HE3 LYS 94 HE3 LYS 94 9.328 -14.102 -0.457
11 HZ1 LYS 94 HZ1 LYS 94 10.410 -16.747 0.344
12 HZ2 LYS 94 HZ2 LYS 94 11.234 -15.279 0.495
13 HZ3 LYS 94 HZ3 LYS 94 9.821 -15.552 1.384
No H/Q in entry = 13
In of MODEL 2
1 H ALA 95 H ALA 95 5.654 -18.019 -4.315
2 HA ALA 95 HA ALA 95 7.879 -17.134 -5.901
3 HB1 ALA 95 HB1 ALA 95 8.106 -19.184 -4.640
4 HB2 ALA 95 HB2 ALA 95 8.186 -19.543 -6.366
5 HB3 ALA 95 HB3 ALA 95 6.706 -19.879 -5.459
No H/Q in entry = 5
In of MODEL 2
1 H LYS 96 H LYS 96 4.747 -18.770 -6.498
2 HA LYS 96 HA LYS 96 5.100 -18.958 -9.291
3 HB2 LYS 96 HB2 LYS 96 2.744 -19.076 -7.478
4 HB3 LYS 96 HB3 LYS 96 2.480 -18.934 -9.201
5 HG2 LYS 96 HG2 LYS 96 2.403 -21.259 -8.410
6 HG3 LYS 96 HG3 LYS 96 3.665 -20.991 -9.611
7 HD2 LYS 96 HD2 LYS 96 5.369 -21.090 -8.000
8 HD3 LYS 96 HD3 LYS 96 4.237 -20.881 -6.668
9 HE2 LYS 96 HE2 LYS 96 3.262 -23.089 -7.189
10 HE3 LYS 96 HE3 LYS 96 4.446 -23.287 -8.478
11 HZ1 LYS 96 HZ1 LYS 96 6.198 -23.115 -6.764
12 HZ2 LYS 96 HZ2 LYS 96 5.004 -23.089 -5.565
13 HZ3 LYS 96 HZ3 LYS 96 5.187 -24.453 -6.546
No H/Q in entry = 13
In of MODEL 2
1 H VAL 97 H VAL 97 4.175 -16.329 -7.271
2 HA VAL 97 HA VAL 97 2.981 -14.636 -9.231
3 HB VAL 97 HB VAL 97 4.214 -14.123 -6.531
4 HG11 VAL 97 HG11 VAL 97 4.745 -12.190 -7.916
5 HG12 VAL 97 HG12 VAL 97 3.052 -12.049 -8.381
6 HG13 VAL 97 HG13 VAL 97 3.530 -11.790 -6.704
7 HG21 VAL 97 HG21 VAL 97 1.950 -15.150 -6.796
8 HG22 VAL 97 HG22 VAL 97 2.015 -13.671 -5.835
9 HG23 VAL 97 HG23 VAL 97 1.417 -13.623 -7.505
No H/Q in entry = 9
In of MODEL 2
1 H GLU 98 H GLU 98 6.264 -15.035 -7.941
2 HA GLU 98 HA GLU 98 7.443 -12.886 -9.287
3 HB2 GLU 98 HB2 GLU 98 8.646 -15.489 -8.349
4 HB3 GLU 98 HB3 GLU 98 9.594 -14.158 -8.996
5 HG2 GLU 98 HG2 GLU 98 8.606 -12.721 -7.182
6 HG3 GLU 98 HG3 GLU 98 7.952 -14.201 -6.480
No H/Q in entry = 6
In of MODEL 2
1 H GLU 99 H GLU 99 6.500 -16.027 -10.423
2 HA GLU 99 HA GLU 99 8.049 -15.913 -12.848
3 HB2 GLU 99 HB2 GLU 99 5.651 -17.589 -12.086
4 HB3 GLU 99 HB3 GLU 99 6.564 -17.780 -13.576
5 HG2 GLU 99 HG2 GLU 99 8.547 -18.367 -12.314
6 HG3 GLU 99 HG3 GLU 99 7.680 -18.105 -10.800
No H/Q in entry = 6
In of MODEL 2
1 H ALA 100 H ALA 100 4.659 -15.257 -11.970
2 HA ALA 100 HA ALA 100 3.865 -14.524 -14.596
3 HB1 ALA 100 HB1 ALA 100 2.654 -13.699 -11.957
4 HB2 ALA 100 HB2 ALA 100 2.290 -15.193 -12.823
5 HB3 ALA 100 HB3 ALA 100 1.873 -13.636 -13.538
No H/Q in entry = 5
In of MODEL 2
1 H LEU 101 H LEU 101 4.971 -12.700 -11.788
2 HA LEU 101 HA LEU 101 4.856 -10.152 -13.048
3 HB2 LEU 101 HB2 LEU 101 6.070 -11.219 -10.522
4 HB3 LEU 101 HB3 LEU 101 6.415 -9.584 -11.044
5 HG LEU 101 HG LEU 101 4.538 -9.983 -9.318
6 HD11 LEU 101 HD11 LEU 101 4.101 -8.292 -11.769
7 HD12 LEU 101 HD12 LEU 101 3.219 -8.117 -10.252
8 HD13 LEU 101 HD13 LEU 101 4.957 -7.829 -10.298
9 HD21 LEU 101 HD21 LEU 101 3.369 -11.753 -10.545
10 HD22 LEU 101 HD22 LEU 101 2.328 -10.368 -10.221
11 HD23 LEU 101 HD23 LEU 101 3.003 -10.602 -11.833
No H/Q in entry = 11
In of MODEL 2
1 H HIS 102 H HIS 102 7.031 -12.743 -13.309
2 HA HIS 102 HA HIS 102 9.242 -11.093 -14.176
3 HB2 HIS 102 HB2 HIS 102 9.471 -13.440 -13.194
4 HB3 HIS 102 HB3 HIS 102 8.857 -14.040 -14.728
5 HD1 HIS 102 HD1 HIS 102 10.413 -13.481 -16.871
6 HD2 HIS 102 HD2 HIS 102 12.128 -12.960 -13.125
7 HE1 HIS 102 HE1 HIS 102 12.892 -13.364 -17.275
8 HE2 HIS 102 HE2 HIS 102 13.892 -12.880 -15.013
No H/Q in entry = 8
In of MODEL 2
1 H ALA 103 H ALA 103 6.733 -13.114 -15.538
2 HA ALA 103 HA ALA 103 7.592 -13.040 -18.208
3 HB1 ALA 103 HB1 ALA 103 4.813 -13.595 -17.202
4 HB2 ALA 103 HB2 ALA 103 6.142 -14.756 -17.124
5 HB3 ALA 103 HB3 ALA 103 5.555 -14.184 -18.691
No H/Q in entry = 5
In of MODEL 2
1 H VAL 104 H VAL 104 5.970 -10.606 -16.435
2 HA VAL 104 HA VAL 104 4.273 -9.659 -18.455
3 HB VAL 104 HB VAL 104 3.595 -9.002 -16.378
4 HG11 VAL 104 HG11 VAL 104 5.643 -9.579 -15.217
5 HG12 VAL 104 HG12 VAL 104 6.352 -8.049 -15.721
6 HG13 VAL 104 HG13 VAL 104 4.958 -8.060 -14.647
7 HG21 VAL 104 HG21 VAL 104 3.594 -7.072 -17.934
8 HG22 VAL 104 HG22 VAL 104 3.697 -6.599 -16.236
9 HG23 VAL 104 HG23 VAL 104 5.138 -6.574 -17.244
No H/Q in entry = 9
In of MODEL 2
1 H THR 105 H THR 105 7.117 -7.944 -17.173
2 HA THR 105 HA THR 105 8.914 -6.998 -18.157
3 HB THR 105 HB THR 105 9.759 -7.745 -20.277
4 HG1 THR 105 HG1 THR 105 7.092 -8.506 -20.714
5 HG21 THR 105 HG21 THR 105 8.412 -10.016 -18.822
6 HG22 THR 105 HG22 THR 105 9.765 -10.174 -19.946
7 HG23 THR 105 HG23 THR 105 9.977 -9.306 -18.424
No H/Q in entry = 7
In of MODEL 2
1 H ASP 106 H ASP 106 5.918 -6.095 -18.824
2 HA ASP 106 HA ASP 106 6.548 -4.071 -20.774
3 HB2 ASP 106 HB2 ASP 106 4.262 -4.906 -20.650
4 HB3 ASP 106 HB3 ASP 106 4.158 -4.446 -18.955
No H/Q in entry = 4
In of MODEL 2
1 H GLU 107 H GLU 107 7.278 -2.078 -20.365
2 HA GLU 107 HA GLU 107 8.933 -1.856 -18.173
3 HB2 GLU 107 HB2 GLU 107 8.010 0.127 -20.213
4 HB3 GLU 107 HB3 GLU 107 9.096 0.606 -18.916
5 HG2 GLU 107 HG2 GLU 107 9.636 -1.625 -20.856
6 HG3 GLU 107 HG3 GLU 107 10.252 0.020 -21.019
No H/Q in entry = 6
In of MODEL 2
1 H GLU 108 H GLU 108 5.904 -0.080 -18.707
2 HA GLU 108 HA GLU 108 6.173 1.355 -16.262
3 HB2 GLU 108 HB2 GLU 108 3.855 2.103 -16.660
4 HB3 GLU 108 HB3 GLU 108 4.904 2.344 -18.049
5 HG2 GLU 108 HG2 GLU 108 3.979 0.249 -19.019
6 HG3 GLU 108 HG3 GLU 108 2.832 0.204 -17.679
No H/Q in entry = 6
In of MODEL 2
1 H LYS 109 H LYS 109 4.614 -1.669 -17.151
2 HA LYS 109 HA LYS 109 3.322 -2.072 -14.656
3 HB2 LYS 109 HB2 LYS 109 4.245 -4.062 -16.726
4 HB3 LYS 109 HB3 LYS 109 3.238 -4.459 -15.340
5 HG2 LYS 109 HG2 LYS 109 1.559 -2.835 -16.159
6 HG3 LYS 109 HG3 LYS 109 2.546 -2.607 -17.600
7 HD2 LYS 109 HD2 LYS 109 2.293 -4.966 -18.159
8 HD3 LYS 109 HD3 LYS 109 1.340 -5.216 -16.694
9 HE2 LYS 109 HE2 LYS 109 -0.307 -3.570 -17.544
10 HE3 LYS 109 HE3 LYS 109 0.623 -3.454 -19.036
11 HZ1 LYS 109 HZ1 LYS 109 -0.630 -5.935 -17.999
12 HZ2 LYS 109 HZ2 LYS 109 -1.265 -4.963 -19.225
13 HZ3 LYS 109 HZ3 LYS 109 0.198 -5.772 -19.463
No H/Q in entry = 13
In of MODEL 2
1 H LYS 110 H LYS 110 6.520 -2.949 -15.903
2 HA LYS 110 HA LYS 110 7.399 -4.241 -13.518
3 HB2 LYS 110 HB2 LYS 110 8.924 -2.954 -15.776
4 HB3 LYS 110 HB3 LYS 110 9.708 -3.766 -14.437
5 HG2 LYS 110 HG2 LYS 110 8.460 -5.840 -15.101
6 HG3 LYS 110 HG3 LYS 110 7.958 -4.972 -16.556
7 HD2 LYS 110 HD2 LYS 110 10.827 -5.343 -15.704
8 HD3 LYS 110 HD3 LYS 110 10.006 -6.373 -16.870
9 HE2 LYS 110 HE2 LYS 110 9.671 -4.508 -18.354
10 HE3 LYS 110 HE3 LYS 110 10.310 -3.390 -17.155
11 HZ1 LYS 110 HZ1 LYS 110 12.456 -4.511 -17.333
12 HZ2 LYS 110 HZ2 LYS 110 11.834 -5.528 -18.535
13 HZ3 LYS 110 HZ3 LYS 110 11.957 -3.860 -18.817
No H/Q in entry = 13
In of MODEL 2
1 H GLN 111 H GLN 111 7.033 -0.989 -14.437
2 HA GLN 111 HA GLN 111 8.696 0.237 -12.519
3 HB2 GLN 111 HB2 GLN 111 7.502 1.418 -14.380
4 HB3 GLN 111 HB3 GLN 111 6.002 1.213 -13.494
5 HG2 GLN 111 HG2 GLN 111 6.923 3.455 -13.236
6 HG3 GLN 111 HG3 GLN 111 6.837 2.600 -11.696
7 HE21 GLN 111 HE21 GLN 111 8.682 2.124 -10.604
8 HE22 GLN 111 HE22 GLN 111 10.248 2.686 -11.087
No H/Q in entry = 8
In of MODEL 2
1 H TYR 112 H TYR 112 5.445 -1.065 -12.375
2 HA TYR 112 HA TYR 112 4.914 -0.329 -9.649
3 HB2 TYR 112 HB2 TYR 112 3.669 -2.335 -11.530
4 HB3 TYR 112 HB3 TYR 112 3.098 -2.098 -9.887
5 HD1 TYR 112 HD1 TYR 112 2.775 0.599 -9.376
6 HD2 TYR 112 HD2 TYR 112 2.420 -1.344 -13.141
7 HE1 TYR 112 HE1 TYR 112 1.316 2.414 -10.166
8 HE2 TYR 112 HE2 TYR 112 0.963 0.471 -13.947
9 HH TYR 112 HH TYR 112 0.621 3.410 -12.331
No H/Q in entry = 9
In of MODEL 2
1 H ILE 113 H ILE 113 6.253 -3.105 -11.321
2 HA ILE 113 HA ILE 113 6.292 -4.923 -9.208
3 HB ILE 113 HB ILE 113 8.236 -4.661 -11.498
4 HG12 ILE 113 HG12 ILE 113 5.707 -6.269 -11.124
5 HG13 ILE 113 HG13 ILE 113 5.935 -4.924 -12.234
6 HG21 ILE 113 HG21 ILE 113 7.713 -6.989 -9.649
7 HG22 ILE 113 HG22 ILE 113 8.740 -7.028 -11.081
8 HG23 ILE 113 HG23 ILE 113 9.181 -6.014 -9.706
9 HD11 ILE 113 HD11 ILE 113 7.623 -6.266 -13.425
10 HD12 ILE 113 HD12 ILE 113 7.252 -7.617 -12.357
11 HD13 ILE 113 HD13 ILE 113 6.015 -6.984 -13.440
No H/Q in entry = 11
In of MODEL 2
1 H ALA 114 H ALA 114 8.649 -2.487 -10.220
2 HA ALA 114 HA ALA 114 10.556 -3.005 -8.138
3 HB1 ALA 114 HB1 ALA 114 11.262 -2.007 -10.227
4 HB2 ALA 114 HB2 ALA 114 11.567 -0.882 -8.903
5 HB3 ALA 114 HB3 ALA 114 10.183 -0.634 -9.970
No H/Q in entry = 5
In of MODEL 2
1 H ASP 115 H ASP 115 7.939 -0.705 -8.624
2 HA ASP 115 HA ASP 115 8.595 0.828 -6.304
3 HB2 ASP 115 HB2 ASP 115 6.136 0.820 -8.049
4 HB3 ASP 115 HB3 ASP 115 6.352 1.915 -6.687
No H/Q in entry = 4
In of MODEL 2
1 H PHE 116 H PHE 116 5.925 -1.428 -6.987
2 HA PHE 116 HA PHE 116 5.190 -1.176 -4.167
3 HB2 PHE 116 HB2 PHE 116 3.620 -1.201 -6.532
4 HB3 PHE 116 HB3 PHE 116 3.235 -2.665 -5.633
5 HD1 PHE 116 HD1 PHE 116 2.415 -2.496 -3.306
6 HD2 PHE 116 HD2 PHE 116 2.907 0.912 -5.807
7 HE1 PHE 116 HE1 PHE 116 0.955 -1.203 -1.809
8 HE2 PHE 116 HE2 PHE 116 1.442 2.221 -4.307
9 HZ PHE 116 HZ PHE 116 0.466 1.155 -2.307
No H/Q in entry = 9
In of MODEL 2
1 H GLY 117 H GLY 117 6.479 -3.400 -6.438
2 HA2 GLY 117 HA2 GLY 117 7.218 -5.574 -6.161
3 HA3 GLY 117 HA3 GLY 117 5.564 -5.863 -5.665
No H/Q in entry = 3
In of MODEL 2
1 HA PRO 118 HA PRO 118 8.852 -6.722 -2.269
2 HB2 PRO 118 HB2 PRO 118 10.106 -4.090 -1.765
3 HB3 PRO 118 HB3 PRO 118 10.857 -5.677 -1.956
4 HG2 PRO 118 HG2 PRO 118 11.041 -3.816 -3.870
5 HG3 PRO 118 HG3 PRO 118 10.883 -5.536 -4.265
6 HD2 PRO 118 HD2 PRO 118 8.813 -3.377 -4.342
7 HD3 PRO 118 HD3 PRO 118 9.083 -4.720 -5.468
No H/Q in entry = 7
In of MODEL 2
1 H ALA 119 H ALA 119 7.316 -3.565 -2.208
2 HA ALA 119 HA ALA 119 6.928 -3.513 0.640
3 HB1 ALA 119 HB1 ALA 119 5.411 -1.626 0.130
4 HB2 ALA 119 HB2 ALA 119 5.651 -1.936 -1.588
5 HB3 ALA 119 HB3 ALA 119 7.013 -1.441 -0.584
No H/Q in entry = 5
In of MODEL 2
1 H CYS 120 H CYS 120 5.057 -4.493 -2.150
2 HA CYS 120 HA CYS 120 2.657 -5.138 -0.819
3 HB2 CYS 120 HB2 CYS 120 2.958 -5.008 -3.308
4 HB3 CYS 120 HB3 CYS 120 3.815 -6.542 -3.235
No H/Q in entry = 4
In of MODEL 2
1 H LYS 121 H LYS 121 5.743 -6.725 -1.035
2 HA LYS 121 HA LYS 121 5.066 -9.312 -0.220
3 HB2 LYS 121 HB2 LYS 121 7.553 -7.722 0.409
4 HB3 LYS 121 HB3 LYS 121 7.387 -9.456 0.647
5 HG2 LYS 121 HG2 LYS 121 7.199 -8.019 -1.993
6 HG3 LYS 121 HG3 LYS 121 8.595 -8.926 -1.406
7 HD2 LYS 121 HD2 LYS 121 7.175 -10.950 -1.304
8 HD3 LYS 121 HD3 LYS 121 5.852 -10.019 -2.001
9 HE2 LYS 121 HE2 LYS 121 7.020 -11.337 -3.701
10 HE3 LYS 121 HE3 LYS 121 7.164 -9.608 -4.002
11 HZ1 LYS 121 HZ1 LYS 121 9.238 -11.306 -2.721
12 HZ2 LYS 121 HZ2 LYS 121 9.266 -10.774 -4.325
13 HZ3 LYS 121 HZ3 LYS 121 9.382 -9.655 -3.066
No H/Q in entry = 13
In of MODEL 2
1 H LYS 122 H LYS 122 6.090 -6.584 1.912
2 HA LYS 122 HA LYS 122 5.414 -7.995 4.287
3 HB2 LYS 122 HB2 LYS 122 5.528 -5.783 5.422
4 HB3 LYS 122 HB3 LYS 122 6.956 -6.177 4.481
5 HG2 LYS 122 HG2 LYS 122 6.211 -4.694 2.702
6 HG3 LYS 122 HG3 LYS 122 4.752 -4.318 3.620
7 HD2 LYS 122 HD2 LYS 122 6.424 -2.560 3.890
8 HD3 LYS 122 HD3 LYS 122 6.121 -3.381 5.420
9 HE2 LYS 122 HE2 LYS 122 8.144 -4.749 5.047
10 HE3 LYS 122 HE3 LYS 122 8.456 -3.847 3.567
11 HZ1 LYS 122 HZ1 LYS 122 8.357 -2.696 6.301
12 HZ2 LYS 122 HZ2 LYS 122 9.761 -3.009 5.419
13 HZ3 LYS 122 HZ3 LYS 122 8.670 -1.832 4.883
No H/Q in entry = 13
In of MODEL 2
1 H ILE 123 H ILE 123 3.594 -6.032 2.052
2 HA ILE 123 HA ILE 123 1.361 -5.549 3.666
3 HB ILE 123 HB ILE 123 1.632 -5.718 0.692
4 HG12 ILE 123 HG12 ILE 123 1.195 -3.430 2.620
5 HG13 ILE 123 HG13 ILE 123 2.747 -3.880 1.922
6 HG21 ILE 123 HG21 ILE 123 -0.802 -4.943 2.297
7 HG22 ILE 123 HG22 ILE 123 -0.611 -4.709 0.560
8 HG23 ILE 123 HG23 ILE 123 -0.653 -6.339 1.230
9 HD11 ILE 123 HD11 ILE 123 0.380 -3.084 0.283
10 HD12 ILE 123 HD12 ILE 123 1.592 -1.943 0.863
11 HD13 ILE 123 HD13 ILE 123 2.054 -3.247 -0.235
No H/Q in entry = 11
In of MODEL 2
1 H TYR 124 H TYR 124 1.937 -8.042 1.309
2 HA TYR 124 HA TYR 124 -0.221 -9.756 2.125
3 HB2 TYR 124 HB2 TYR 124 1.929 -9.856 0.064
4 HB3 TYR 124 HB3 TYR 124 1.212 -11.377 0.587
5 HD1 TYR 124 HD1 TYR 124 0.240 -7.990 -0.641
6 HD2 TYR 124 HD2 TYR 124 -0.731 -12.125 -0.429
7 HE1 TYR 124 HE1 TYR 124 -1.661 -7.618 -2.155
8 HE2 TYR 124 HE2 TYR 124 -2.634 -11.765 -1.942
9 HH TYR 124 HH TYR 124 -3.059 -8.855 -3.685
No H/Q in entry = 9
In of MODEL 2
1 H GLY 125 H GLY 125 1.454 -9.129 4.255
2 HA2 GLY 125 HA2 GLY 125 2.930 -10.025 5.864
3 HA3 GLY 125 HA3 GLY 125 3.940 -9.395 4.597
No H/Q in entry = 3
In of MODEL 2
1 H VAL 126 H VAL 126 3.291 -11.683 2.823
2 HA VAL 126 HA VAL 126 4.232 -14.116 3.482
3 HB VAL 126 HB VAL 126 5.724 -12.621 1.347
4 HG11 VAL 126 HG11 VAL 126 6.274 -14.968 1.853
5 HG12 VAL 126 HG12 VAL 126 4.633 -15.421 1.394
6 HG13 VAL 126 HG13 VAL 126 5.720 -14.713 0.202
7 HG21 VAL 126 HG21 VAL 126 2.853 -13.508 1.186
8 HG22 VAL 126 HG22 VAL 126 3.508 -11.886 0.931
9 HG23 VAL 126 HG23 VAL 126 3.859 -13.171 -0.226
No H/Q in entry = 9
In of MODEL 2
1 H HIS 127 H HIS 127 6.307 -11.301 2.935
2 HA HIS 127 HA HIS 127 8.614 -12.546 4.116
3 HB2 HIS 127 HB2 HIS 127 8.724 -10.863 2.250
4 HB3 HIS 127 HB3 HIS 127 8.178 -9.639 3.386
5 HD1 HIS 127 HD1 HIS 127 9.983 -8.373 4.509
6 HD2 HIS 127 HD2 HIS 127 11.307 -12.060 3.123
7 HE1 HIS 127 HE1 HIS 127 12.463 -8.387 4.899
8 HE2 HIS 127 HE2 HIS 127 13.219 -10.681 4.195
No H/Q in entry = 8
In of MODEL 2
1 H THR 128 H THR 128 7.692 -13.084 6.151
2 HA THR 128 HA THR 128 6.505 -11.097 7.824
3 HB THR 128 HB THR 128 7.513 -13.793 8.726
4 HG1 THR 128 HG1 THR 128 5.568 -13.177 6.879
5 HG21 THR 128 HG21 THR 128 6.664 -12.245 10.451
6 HG22 THR 128 HG22 THR 128 5.140 -12.123 9.575
7 HG23 THR 128 HG23 THR 128 5.636 -13.663 10.274
No H/Q in entry = 7
In of MODEL 2
1 H SER 129 H SER 129 9.725 -12.275 7.332
2 HA SER 129 HA SER 129 10.627 -10.658 9.618
3 HB2 SER 129 HB2 SER 129 12.621 -12.258 9.664
4 HB3 SER 129 HB3 SER 129 11.081 -12.913 10.218
5 HG SER 129 HG SER 129 11.816 -13.160 7.514
No H/Q in entry = 5
In of MODEL 3
1 HA2 GLY -4 HA2 GLY -4 -17.487 15.516 -18.252
2 HA3 GLY -4 HA3 GLY -4 -17.642 17.266 -18.319
3 H1 GLY -4 H1 GLY -4 -17.049 15.499 -20.622
4 H2 GLY -4 H2 GLY -4 -17.192 17.185 -20.684
No H/Q in entry = 4
In of MODEL 3
1 H SER -3 H SER -3 -15.596 14.862 -17.493
2 HA SER -3 HA SER -3 -13.211 16.462 -18.135
3 HB2 SER -3 HB2 SER -3 -13.684 14.944 -15.558
4 HB3 SER -3 HB3 SER -3 -12.319 15.995 -15.933
5 HG SER -3 HG SER -3 -13.675 17.758 -15.907
No H/Q in entry = 5
In of MODEL 3
1 HA PRO -2 HA PRO -2 -12.068 12.426 -19.775
2 HB2 PRO -2 HB2 PRO -2 -9.990 13.260 -21.248
3 HB3 PRO -2 HB3 PRO -2 -11.661 13.573 -21.743
4 HG2 PRO -2 HG2 PRO -2 -9.718 15.392 -20.374
5 HG3 PRO -2 HG3 PRO -2 -10.815 15.741 -21.722
6 HD2 PRO -2 HD2 PRO -2 -11.355 16.401 -19.127
7 HD3 PRO -2 HD3 PRO -2 -12.612 16.066 -20.334
No H/Q in entry = 7
In of MODEL 3
1 H GLU -1 H GLU -1 -11.413 12.841 -17.148
2 HA GLU -1 HA GLU -1 -8.496 12.678 -16.946
3 HB2 GLU -1 HB2 GLU -1 -10.627 13.207 -14.878
4 HB3 GLU -1 HB3 GLU -1 -8.926 13.001 -14.492
5 HG2 GLU -1 HG2 GLU -1 -8.383 14.940 -15.877
6 HG3 GLU -1 HG3 GLU -1 -10.096 15.151 -16.240
No H/Q in entry = 6
In of MODEL 3
1 H PHE 0 H PHE 0 -8.316 10.489 -17.638
2 HA PHE 0 HA PHE 0 -9.341 8.521 -15.731
3 HB2 PHE 0 HB2 PHE 0 -9.461 8.053 -18.208
4 HB3 PHE 0 HB3 PHE 0 -7.701 8.008 -18.224
5 HD1 PHE 0 HD1 PHE 0 -10.734 6.335 -16.988
6 HD2 PHE 0 HD2 PHE 0 -6.506 6.110 -17.410
7 HE1 PHE 0 HE1 PHE 0 -10.803 3.956 -16.362
8 HE2 PHE 0 HE2 PHE 0 -6.567 3.731 -16.787
9 HZ PHE 0 HZ PHE 0 -8.717 2.651 -16.260
No H/Q in entry = 9
In of MODEL 3
1 H HIS 1 H HIS 1 -8.114 9.079 -13.950
2 HA HIS 1 HA HIS 1 -5.241 9.282 -14.162
3 HB2 HIS 1 HB2 HIS 1 -7.092 9.376 -11.770
4 HB3 HIS 1 HB3 HIS 1 -5.349 9.580 -11.670
5 HD1 HIS 1 HD1 HIS 1 -4.362 11.813 -12.553
6 HD2 HIS 1 HD2 HIS 1 -8.507 11.578 -12.748
7 HE1 HIS 1 HE1 HIS 1 -5.149 14.155 -12.991
8 HE2 HIS 1 HE2 HIS 1 -7.668 14.023 -12.951
No H/Q in entry = 8
In of MODEL 3
1 H HIS 2 H HIS 2 -3.748 7.865 -13.307
2 HA HIS 2 HA HIS 2 -4.634 5.111 -13.105
3 HB2 HIS 2 HB2 HIS 2 -2.216 4.566 -12.996
4 HB3 HIS 2 HB3 HIS 2 -2.628 5.528 -14.407
5 HD1 HIS 2 HD1 HIS 2 -0.791 5.740 -11.128
6 HD2 HIS 2 HD2 HIS 2 -1.382 7.997 -14.567
7 HE1 HIS 2 HE1 HIS 2 0.867 7.620 -10.994
8 HE2 HIS 2 HE2 HIS 2 0.588 8.886 -13.155
No H/Q in entry = 8
In of MODEL 3
1 H PHE 3 H PHE 3 -2.809 4.032 -11.317
2 HA PHE 3 HA PHE 3 -4.073 4.522 -8.834
3 HB2 PHE 3 HB2 PHE 3 -1.530 3.013 -9.465
4 HB3 PHE 3 HB3 PHE 3 -2.349 2.987 -7.907
5 HD1 PHE 3 HD1 PHE 3 -4.781 2.186 -7.885
6 HD2 PHE 3 HD2 PHE 3 -2.092 1.479 -11.106
7 HE1 PHE 3 HE1 PHE 3 -6.189 0.320 -8.645
8 HE2 PHE 3 HE2 PHE 3 -3.495 -0.389 -11.874
9 HZ PHE 3 HZ PHE 3 -5.550 -0.969 -10.640
No H/Q in entry = 9
In of MODEL 3
1 H THR 4 H THR 4 -3.609 6.936 -8.964
2 HA THR 4 HA THR 4 -1.045 7.731 -7.937
3 HB THR 4 HB THR 4 -2.071 9.959 -7.666
4 HG1 THR 4 HG1 THR 4 -4.319 10.073 -8.604
5 HG21 THR 4 HG21 THR 4 -1.165 9.332 -9.854
6 HG22 THR 4 HG22 THR 4 -2.730 8.666 -10.315
7 HG23 THR 4 HG23 THR 4 -2.560 10.397 -10.026
No H/Q in entry = 7
In of MODEL 3
1 H LEU 5 H LEU 5 -0.869 8.887 -5.830
2 HA LEU 5 HA LEU 5 -1.836 7.356 -3.696
3 HB2 LEU 5 HB2 LEU 5 0.224 8.748 -3.690
4 HB3 LEU 5 HB3 LEU 5 -0.771 10.185 -3.651
5 HG LEU 5 HG LEU 5 0.299 9.420 -1.462
6 HD11 LEU 5 HD11 LEU 5 -2.672 9.901 -1.582
7 HD12 LEU 5 HD12 LEU 5 -1.678 10.037 -0.130
8 HD13 LEU 5 HD13 LEU 5 -1.404 11.123 -1.492
9 HD21 LEU 5 HD21 LEU 5 -0.219 7.044 -1.666
10 HD22 LEU 5 HD22 LEU 5 -0.909 7.727 -0.193
11 HD23 LEU 5 HD23 LEU 5 -1.943 7.408 -1.586
No H/Q in entry = 11
In of MODEL 3
1 H GLU 6 H GLU 6 -2.976 10.437 -5.037
2 HA GLU 6 HA GLU 6 -5.202 10.821 -3.378
3 HB2 GLU 6 HB2 GLU 6 -5.004 11.356 -6.351
4 HB3 GLU 6 HB3 GLU 6 -6.120 12.123 -5.228
5 HG2 GLU 6 HG2 GLU 6 -4.393 13.317 -4.168
6 HG3 GLU 6 HG3 GLU 6 -3.144 12.339 -4.933
No H/Q in entry = 6
In of MODEL 3
1 H SER 7 H SER 7 -4.874 8.833 -6.374
2 HA SER 7 HA SER 7 -7.512 8.161 -6.674
3 HB2 SER 7 HB2 SER 7 -5.688 7.671 -8.278
4 HB3 SER 7 HB3 SER 7 -5.159 6.354 -7.235
5 HG SER 7 HG SER 7 -7.440 6.562 -8.848
No H/Q in entry = 5
In of MODEL 3
1 H SER 8 H SER 8 -5.480 7.046 -4.087
2 HA SER 8 HA SER 8 -7.276 4.785 -3.655
3 HB2 SER 8 HB2 SER 8 -5.569 4.143 -1.857
4 HB3 SER 8 HB3 SER 8 -5.112 3.966 -3.554
5 HG SER 8 HG SER 8 -3.891 5.818 -3.418
No H/Q in entry = 5
In of MODEL 3
1 H LEU 9 H LEU 9 -6.963 7.965 -2.512
2 HA LEU 9 HA LEU 9 -6.784 7.657 0.202
3 HB2 LEU 9 HB2 LEU 9 -8.041 9.840 -1.397
4 HB3 LEU 9 HB3 LEU 9 -7.700 9.949 0.321
5 HG LEU 9 HG LEU 9 -5.599 9.370 -1.750
6 HD11 LEU 9 HD11 LEU 9 -6.368 11.977 -0.477
7 HD12 LEU 9 HD12 LEU 9 -4.965 11.703 -1.513
8 HD13 LEU 9 HD13 LEU 9 -6.594 11.513 -2.166
9 HD21 LEU 9 HD21 LEU 9 -5.456 10.185 1.152
10 HD22 LEU 9 HD22 LEU 9 -5.030 8.608 0.480
11 HD23 LEU 9 HD23 LEU 9 -4.071 10.034 0.070
No H/Q in entry = 11
In of MODEL 3
1 H ASP 10 H ASP 10 -9.727 7.568 -1.630
2 HA ASP 10 HA ASP 10 -11.256 7.290 0.854
3 HB2 ASP 10 HB2 ASP 10 -12.168 7.612 -2.011
4 HB3 ASP 10 HB3 ASP 10 -13.252 7.442 -0.633
No H/Q in entry = 4
In of MODEL 3
1 H THR 11 H THR 11 -9.566 5.288 -1.033
2 HA THR 11 HA THR 11 -11.448 3.088 -0.553
3 HB THR 11 HB THR 11 -10.451 1.954 -2.576
4 HG1 THR 11 HG1 THR 11 -9.657 4.563 -3.369
5 HG21 THR 11 HG21 THR 11 -11.957 4.534 -3.029
6 HG22 THR 11 HG22 THR 11 -11.828 3.208 -4.184
7 HG23 THR 11 HG23 THR 11 -12.669 2.965 -2.653
No H/Q in entry = 7
In of MODEL 3
1 H HIS 12 H HIS 12 -8.342 2.618 -1.990
2 HA HIS 12 HA HIS 12 -7.594 0.667 -0.167
3 HB2 HIS 12 HB2 HIS 12 -5.809 2.248 -2.014
4 HB3 HIS 12 HB3 HIS 12 -5.363 0.744 -1.226
5 HD1 HIS 12 HD1 HIS 12 -6.863 2.036 -4.286
6 HD2 HIS 12 HD2 HIS 12 -7.015 -1.470 -2.092
7 HE1 HIS 12 HE1 HIS 12 -7.811 0.310 -5.848
8 HE2 HIS 12 HE2 HIS 12 -7.855 -1.836 -4.517
No H/Q in entry = 8
In of MODEL 3
1 H LEU 13 H LEU 13 -6.834 4.126 -0.156
2 HA LEU 13 HA LEU 13 -5.064 3.635 2.149
3 HB2 LEU 13 HB2 LEU 13 -4.933 5.542 -0.101
4 HB3 LEU 13 HB3 LEU 13 -4.392 6.120 1.461
5 HG LEU 13 HG LEU 13 -2.491 5.305 0.222
6 HD11 LEU 13 HD11 LEU 13 -2.584 4.891 2.662
7 HD12 LEU 13 HD12 LEU 13 -3.189 3.270 2.326
8 HD13 LEU 13 HD13 LEU 13 -1.578 3.738 1.789
9 HD21 LEU 13 HD21 LEU 13 -4.003 2.707 -0.001
10 HD22 LEU 13 HD22 LEU 13 -3.569 3.796 -1.319
11 HD23 LEU 13 HD23 LEU 13 -2.309 2.934 -0.438
No H/Q in entry = 11
In of MODEL 3
1 H LYS 14 H LYS 14 -7.979 3.991 2.139
2 HA LYS 14 HA LYS 14 -8.599 6.595 3.095
3 HB2 LYS 14 HB2 LYS 14 -10.805 5.739 3.577
4 HB3 LYS 14 HB3 LYS 14 -10.274 5.185 2.003
5 HG2 LYS 14 HG2 LYS 14 -9.818 2.994 2.873
6 HG3 LYS 14 HG3 LYS 14 -10.176 3.534 4.516
7 HD2 LYS 14 HD2 LYS 14 -12.483 3.962 3.906
8 HD3 LYS 14 HD3 LYS 14 -12.145 3.535 2.226
9 HE2 LYS 14 HE2 LYS 14 -11.678 1.265 2.843
10 HE3 LYS 14 HE3 LYS 14 -11.812 1.655 4.557
11 HZ1 LYS 14 HZ1 LYS 14 -14.158 2.200 4.180
12 HZ2 LYS 14 HZ2 LYS 14 -14.008 1.743 2.558
13 HZ3 LYS 14 HZ3 LYS 14 -13.815 0.594 3.785
No H/Q in entry = 13
In of MODEL 3
1 H TRP 15 H TRP 15 -7.208 3.903 4.590
2 HA TRP 15 HA TRP 15 -8.180 4.370 7.246
3 HB2 TRP 15 HB2 TRP 15 -6.460 2.737 7.922
4 HB3 TRP 15 HB3 TRP 15 -7.444 2.138 6.591
5 HD1 TRP 15 HD1 TRP 15 -6.274 2.029 4.167
6 HE1 TRP 15 HE1 TRP 15 -3.799 1.824 3.485
7 HE3 TRP 15 HE3 TRP 15 -4.106 3.386 8.590
8 HZ2 TRP 15 HZ2 TRP 15 -1.261 2.191 4.677
9 HZ3 TRP 15 HZ3 TRP 15 -1.650 3.431 8.739
10 HH2 TRP 15 HH2 TRP 15 -0.259 2.846 6.821
No H/Q in entry = 10
In of MODEL 3
1 H LEU 16 H LEU 16 -6.034 6.016 5.288
2 HA LEU 16 HA LEU 16 -4.257 6.949 7.348
3 HB2 LEU 16 HB2 LEU 16 -4.910 8.079 4.617
4 HB3 LEU 16 HB3 LEU 16 -3.670 8.714 5.675
5 HG LEU 16 HG LEU 16 -3.634 5.913 4.537
6 HD11 LEU 16 HD11 LEU 16 -3.487 7.601 2.763
7 HD12 LEU 16 HD12 LEU 16 -2.138 8.364 3.611
8 HD13 LEU 16 HD13 LEU 16 -1.969 6.726 2.973
9 HD21 LEU 16 HD21 LEU 16 -1.534 7.559 5.949
10 HD22 LEU 16 HD22 LEU 16 -2.315 6.095 6.556
11 HD23 LEU 16 HD23 LEU 16 -1.237 6.012 5.158
No H/Q in entry = 11
In of MODEL 3
1 H SER 17 H SER 17 -4.371 8.884 8.432
2 HA SER 17 HA SER 17 -7.041 9.927 8.793
3 HB2 SER 17 HB2 SER 17 -4.549 11.006 10.091
4 HB3 SER 17 HB3 SER 17 -6.201 11.061 10.692
5 HG SER 17 HG SER 17 -4.658 9.395 11.569
No H/Q in entry = 5
In of MODEL 3
1 H GLN 18 H GLN 18 -7.392 12.388 8.786
2 HA GLN 18 HA GLN 18 -6.979 13.254 6.168
3 HB2 GLN 18 HB2 GLN 18 -8.782 14.107 7.660
4 HB3 GLN 18 HB3 GLN 18 -7.574 15.009 8.561
5 HG2 GLN 18 HG2 GLN 18 -8.764 16.439 6.999
6 HG3 GLN 18 HG3 GLN 18 -7.054 16.328 6.588
7 HE21 GLN 18 HE21 GLN 18 -6.439 15.270 4.711
8 HE22 GLN 18 HE22 GLN 18 -7.567 14.847 3.470
No H/Q in entry = 8
In of MODEL 3
1 H GLU 19 H GLU 19 -5.269 14.220 9.132
2 HA GLU 19 HA GLU 19 -3.549 16.069 7.982
3 HB2 GLU 19 HB2 GLU 19 -3.234 14.220 10.345
4 HB3 GLU 19 HB3 GLU 19 -2.086 15.466 9.939
5 HG2 GLU 19 HG2 GLU 19 -3.842 17.159 10.181
6 HG3 GLU 19 HG3 GLU 19 -4.960 15.883 10.663
No H/Q in entry = 6
In of MODEL 3
1 H GLN 20 H GLN 20 -3.376 12.555 8.149
2 HA GLN 20 HA GLN 20 -0.687 12.384 7.184
3 HB2 GLN 20 HB2 GLN 20 -2.739 10.192 6.927
4 HB3 GLN 20 HB3 GLN 20 -0.999 10.041 7.125
5 HG2 GLN 20 HG2 GLN 20 -2.961 10.962 9.207
6 HG3 GLN 20 HG3 GLN 20 -2.150 9.406 9.150
7 HE21 GLN 20 HE21 GLN 20 -0.030 9.255 9.783
8 HE22 GLN 20 HE22 GLN 20 0.805 10.533 10.590
No H/Q in entry = 8
In of MODEL 3
1 H LYS 21 H LYS 21 -3.908 11.996 5.724
2 HA LYS 21 HA LYS 21 -3.108 11.426 3.115
3 HB2 LYS 21 HB2 LYS 21 -5.508 12.993 4.078
4 HB3 LYS 21 HB3 LYS 21 -5.294 12.431 2.426
5 HG2 LYS 21 HG2 LYS 21 -5.265 10.118 3.218
6 HG3 LYS 21 HG3 LYS 21 -5.495 10.689 4.873
7 HD2 LYS 21 HD2 LYS 21 -7.641 11.623 4.303
8 HD3 LYS 21 HD3 LYS 21 -7.400 11.227 2.601
9 HE2 LYS 21 HE2 LYS 21 -7.402 8.858 3.128
10 HE3 LYS 21 HE3 LYS 21 -7.568 9.221 4.846
11 HZ1 LYS 21 HZ1 LYS 21 -9.548 9.894 2.739
12 HZ2 LYS 21 HZ2 LYS 21 -9.686 8.625 3.847
13 HZ3 LYS 21 HZ3 LYS 21 -9.713 10.226 4.388
No H/Q in entry = 13
In of MODEL 3
1 H ASP 22 H ASP 22 -3.740 14.554 4.633
2 HA ASP 22 HA ASP 22 -2.989 16.165 2.436
3 HB2 ASP 22 HB2 ASP 22 -4.304 16.932 4.408
4 HB3 ASP 22 HB3 ASP 22 -2.833 16.862 5.368
No H/Q in entry = 4
In of MODEL 3
1 H GLU 23 H GLU 23 -1.096 14.767 5.121
2 HA GLU 23 HA GLU 23 1.361 15.953 4.523
3 HB2 GLU 23 HB2 GLU 23 0.494 14.214 6.401
4 HB3 GLU 23 HB3 GLU 23 1.360 13.111 5.334
5 HG2 GLU 23 HG2 GLU 23 3.325 14.517 5.486
6 HG3 GLU 23 HG3 GLU 23 2.450 15.607 6.551
No H/Q in entry = 6
In of MODEL 3
1 H LEU 24 H LEU 24 -0.008 12.863 3.350
2 HA LEU 24 HA LEU 24 2.122 12.201 1.638
3 HB2 LEU 24 HB2 LEU 24 -0.799 11.478 1.706
4 HB3 LEU 24 HB3 LEU 24 0.255 10.868 0.453
5 HG LEU 24 HG LEU 24 -0.261 9.371 2.474
6 HD11 LEU 24 HD11 LEU 24 1.430 8.819 0.820
7 HD12 LEU 24 HD12 LEU 24 2.610 9.803 1.692
8 HD13 LEU 24 HD13 LEU 24 1.932 8.357 2.447
9 HD21 LEU 24 HD21 LEU 24 1.553 11.366 3.731
10 HD22 LEU 24 HD22 LEU 24 0.098 10.597 4.369
11 HD23 LEU 24 HD23 LEU 24 1.595 9.677 4.235
No H/Q in entry = 11
In of MODEL 3
1 H LEU 25 H LEU 25 -0.887 14.010 1.111
2 HA LEU 25 HA LEU 25 -0.610 14.462 -1.643
3 HB2 LEU 25 HB2 LEU 25 -1.944 16.114 0.498
4 HB3 LEU 25 HB3 LEU 25 -2.075 16.454 -1.212
5 HG LEU 25 HG LEU 25 -3.048 13.955 0.167
6 HD11 LEU 25 HD11 LEU 25 -4.414 15.915 0.658
7 HD12 LEU 25 HD12 LEU 25 -4.557 16.255 -1.065
8 HD13 LEU 25 HD13 LEU 25 -5.272 14.790 -0.393
9 HD21 LEU 25 HD21 LEU 25 -3.182 14.808 -2.720
10 HD22 LEU 25 HD22 LEU 25 -2.310 13.423 -2.060
11 HD23 LEU 25 HD23 LEU 25 -4.072 13.453 -2.028
No H/Q in entry = 11
In of MODEL 3
1 H LYS 26 H LYS 26 0.560 16.275 1.148
2 HA LYS 26 HA LYS 26 1.656 18.460 -0.272
3 HB2 LYS 26 HB2 LYS 26 1.250 18.568 2.131
4 HB3 LYS 26 HB3 LYS 26 2.419 17.286 2.410
5 HG2 LYS 26 HG2 LYS 26 3.354 19.457 2.965
6 HG3 LYS 26 HG3 LYS 26 4.211 18.733 1.604
7 HD2 LYS 26 HD2 LYS 26 2.873 20.119 0.061
8 HD3 LYS 26 HD3 LYS 26 2.089 20.874 1.450
9 HE2 LYS 26 HE2 LYS 26 4.248 21.716 2.216
10 HE3 LYS 26 HE3 LYS 26 5.043 20.943 0.847
11 HZ1 LYS 26 HZ1 LYS 26 3.745 22.352 -0.639
12 HZ2 LYS 26 HZ2 LYS 26 3.019 23.108 0.685
13 HZ3 LYS 26 HZ3 LYS 26 4.680 23.280 0.419
No H/Q in entry = 13
In of MODEL 3
1 H MET 27 H MET 27 3.092 15.428 0.900
2 HA MET 27 HA MET 27 5.621 15.816 -0.088
3 HB2 MET 27 HB2 MET 27 4.070 13.235 0.094
4 HB3 MET 27 HB3 MET 27 5.794 13.325 -0.223
5 HG2 MET 27 HG2 MET 27 5.546 14.829 2.043
6 HG3 MET 27 HG3 MET 27 4.326 13.576 2.279
7 HE1 MET 27 HE1 MET 27 5.666 11.269 0.517
8 HE2 MET 27 HE2 MET 27 6.600 10.349 1.697
9 HE3 MET 27 HE3 MET 27 4.961 10.881 2.086
No H/Q in entry = 9
In of MODEL 3
1 H LYS 28 H LYS 28 2.944 14.153 -1.788
2 HA LYS 28 HA LYS 28 4.300 13.706 -4.192
3 HB2 LYS 28 HB2 LYS 28 2.246 12.565 -3.705
4 HB3 LYS 28 HB3 LYS 28 1.370 14.081 -3.567
5 HG2 LYS 28 HG2 LYS 28 1.655 14.480 -5.946
6 HG3 LYS 28 HG3 LYS 28 2.584 12.990 -6.096
7 HD2 LYS 28 HD2 LYS 28 0.681 11.660 -5.519
8 HD3 LYS 28 HD3 LYS 28 -0.255 13.095 -5.090
9 HE2 LYS 28 HE2 LYS 28 0.816 12.564 -7.854
10 HE3 LYS 28 HE3 LYS 28 -0.795 12.087 -7.327
11 HZ1 LYS 28 HZ1 LYS 28 0.126 14.887 -7.104
12 HZ2 LYS 28 HZ2 LYS 28 -0.558 14.291 -8.532
13 HZ3 LYS 28 HZ3 LYS 28 -1.461 14.286 -7.103
No H/Q in entry = 13
In of MODEL 3
1 H LYS 29 H LYS 29 2.348 16.434 -3.108
2 HA LYS 29 HA LYS 29 2.373 17.916 -5.483
3 HB2 LYS 29 HB2 LYS 29 0.959 18.267 -3.381
4 HB3 LYS 29 HB3 LYS 29 2.344 19.106 -2.710
5 HG2 LYS 29 HG2 LYS 29 1.055 19.930 -5.295
6 HG3 LYS 29 HG3 LYS 29 0.523 20.532 -3.728
7 HD2 LYS 29 HD2 LYS 29 2.748 21.449 -3.318
8 HD3 LYS 29 HD3 LYS 29 3.301 20.818 -4.871
9 HE2 LYS 29 HE2 LYS 29 1.135 22.875 -4.450
10 HE3 LYS 29 HE3 LYS 29 2.771 23.194 -5.023
11 HZ1 LYS 29 HZ1 LYS 29 2.297 21.789 -6.956
12 HZ2 LYS 29 HZ2 LYS 29 0.709 21.575 -6.416
13 HZ3 LYS 29 HZ3 LYS 29 1.247 23.110 -6.864
No H/Q in entry = 13
In of MODEL 3
1 H ASP 30 H ASP 30 4.614 17.917 -2.737
2 HA ASP 30 HA ASP 30 6.077 20.154 -3.814
3 HB2 ASP 30 HB2 ASP 30 5.700 19.739 -1.350
4 HB3 ASP 30 HB3 ASP 30 6.838 18.400 -1.468
No H/Q in entry = 4
In of MODEL 3
1 H GLY 31 H GLY 31 6.017 17.003 -4.593
2 HA2 GLY 31 HA2 GLY 31 8.546 17.329 -6.001
3 HA3 GLY 31 HA3 GLY 31 7.274 16.188 -6.400
No H/Q in entry = 3
In of MODEL 3
1 H LYS 32 H LYS 32 7.237 15.441 -3.437
2 HA LYS 32 HA LYS 32 9.651 14.002 -3.023
3 HB2 LYS 32 HB2 LYS 32 6.863 13.580 -1.929
4 HB3 LYS 32 HB3 LYS 32 8.278 12.686 -1.392
5 HG2 LYS 32 HG2 LYS 32 8.124 15.684 -1.263
6 HG3 LYS 32 HG3 LYS 32 7.540 14.646 0.038
7 HD2 LYS 32 HD2 LYS 32 10.340 14.483 -1.055
8 HD3 LYS 32 HD3 LYS 32 9.895 15.532 0.291
9 HE2 LYS 32 HE2 LYS 32 9.115 13.590 1.551
10 HE3 LYS 32 HE3 LYS 32 9.535 12.539 0.201
11 HZ1 LYS 32 HZ1 LYS 32 11.506 14.233 1.623
12 HZ2 LYS 32 HZ2 LYS 32 11.204 12.618 2.020
13 HZ3 LYS 32 HZ3 LYS 32 11.822 13.009 0.494
No H/Q in entry = 13
In of MODEL 3
1 H ALA 33 H ALA 33 10.149 11.966 -3.602
2 HA ALA 33 HA ALA 33 9.050 11.103 -6.103
3 HB1 ALA 33 HB1 ALA 33 11.463 10.926 -5.492
4 HB2 ALA 33 HB2 ALA 33 11.031 9.634 -4.372
5 HB3 ALA 33 HB3 ALA 33 10.763 9.428 -6.101
No H/Q in entry = 5
In of MODEL 3
1 H LYS 34 H LYS 34 8.085 9.000 -6.543
2 HA LYS 34 HA LYS 34 5.988 8.357 -4.845
3 HB2 LYS 34 HB2 LYS 34 7.330 6.710 -6.983
4 HB3 LYS 34 HB3 LYS 34 5.883 6.177 -6.138
5 HG2 LYS 34 HG2 LYS 34 4.716 8.204 -6.929
6 HG3 LYS 34 HG3 LYS 34 6.159 8.640 -7.848
7 HD2 LYS 34 HD2 LYS 34 5.968 6.621 -9.170
8 HD3 LYS 34 HD3 LYS 34 4.603 6.077 -8.196
9 HE2 LYS 34 HE2 LYS 34 3.831 7.009 -10.304
10 HE3 LYS 34 HE3 LYS 34 3.297 8.006 -8.953
11 HZ1 LYS 34 HZ1 LYS 34 5.639 8.593 -10.684
12 HZ2 LYS 34 HZ2 LYS 34 4.123 9.328 -10.816
13 HZ3 LYS 34 HZ3 LYS 34 5.059 9.565 -9.428
No H/Q in entry = 13
In of MODEL 3
1 H LYS 35 H LYS 35 9.229 6.957 -5.002
2 HA LYS 35 HA LYS 35 8.767 4.877 -3.151
3 HB2 LYS 35 HB2 LYS 35 11.335 6.315 -3.822
4 HB3 LYS 35 HB3 LYS 35 11.234 4.827 -2.890
5 HG2 LYS 35 HG2 LYS 35 10.441 5.207 -5.768
6 HG3 LYS 35 HG3 LYS 35 11.841 4.324 -5.163
7 HD2 LYS 35 HD2 LYS 35 8.963 3.601 -4.612
8 HD3 LYS 35 HD3 LYS 35 9.977 2.845 -5.838
9 HE2 LYS 35 HE2 LYS 35 10.548 2.863 -2.877
10 HE3 LYS 35 HE3 LYS 35 9.838 1.517 -3.767
11 HZ1 LYS 35 HZ1 LYS 35 11.856 1.384 -5.093
12 HZ2 LYS 35 HZ2 LYS 35 12.536 2.665 -4.230
13 HZ3 LYS 35 HZ3 LYS 35 12.202 1.204 -3.449
No H/Q in entry = 13
In of MODEL 3
1 H GLU 36 H GLU 36 8.897 8.240 -2.633
2 HA GLU 36 HA GLU 36 9.717 7.978 0.145
3 HB2 GLU 36 HB2 GLU 36 8.813 10.448 -1.336
4 HB3 GLU 36 HB3 GLU 36 9.615 10.390 0.230
5 HG2 GLU 36 HG2 GLU 36 11.558 9.304 -0.917
6 HG3 GLU 36 HG3 GLU 36 10.760 9.659 -2.437
No H/Q in entry = 6
In of MODEL 3
1 H LEU 37 H LEU 37 6.893 8.412 -1.828
2 HA LEU 37 HA LEU 37 5.015 8.632 0.261
3 HB2 LEU 37 HB2 LEU 37 4.883 7.602 -2.568
4 HB3 LEU 37 HB3 LEU 37 3.474 7.741 -1.540
5 HG LEU 37 HG LEU 37 3.805 9.576 -3.188
6 HD11 LEU 37 HD11 LEU 37 2.371 9.823 -1.229
7 HD12 LEU 37 HD12 LEU 37 3.763 10.385 -0.301
8 HD13 LEU 37 HD13 LEU 37 3.155 11.348 -1.648
9 HD21 LEU 37 HD21 LEU 37 6.062 10.381 -1.398
10 HD22 LEU 37 HD22 LEU 37 6.170 9.922 -3.097
11 HD23 LEU 37 HD23 LEU 37 5.330 11.403 -2.636
No H/Q in entry = 11
In of MODEL 3
1 H GLU 38 H GLU 38 6.349 5.929 -1.558
2 HA GLU 38 HA GLU 38 4.975 3.792 -0.399
3 HB2 GLU 38 HB2 GLU 38 6.357 3.553 -2.393
4 HB3 GLU 38 HB3 GLU 38 7.799 3.962 -1.479
5 HG2 GLU 38 HG2 GLU 38 7.879 1.646 -1.748
6 HG3 GLU 38 HG3 GLU 38 7.333 1.895 -0.090
No H/Q in entry = 6
In of MODEL 3
1 H ALA 39 H ALA 39 7.408 5.837 0.857
2 HA ALA 39 HA ALA 39 8.270 3.957 2.894
3 HB1 ALA 39 HB1 ALA 39 9.160 6.787 2.393
4 HB2 ALA 39 HB2 ALA 39 9.917 5.625 3.480
5 HB3 ALA 39 HB3 ALA 39 9.922 5.338 1.740
No H/Q in entry = 5
In of MODEL 3
1 H LYS 40 H LYS 40 6.626 7.064 2.712
2 HA LYS 40 HA LYS 40 6.289 7.508 5.445
3 HB2 LYS 40 HB2 LYS 40 5.902 9.148 3.589
4 HB3 LYS 40 HB3 LYS 40 4.406 8.303 3.222
5 HG2 LYS 40 HG2 LYS 40 3.955 10.272 4.535
6 HG3 LYS 40 HG3 LYS 40 3.569 8.821 5.462
7 HD2 LYS 40 HD2 LYS 40 4.710 10.335 6.913
8 HD3 LYS 40 HD3 LYS 40 5.807 9.011 6.554
9 HE2 LYS 40 HE2 LYS 40 6.879 10.420 4.824
10 HE3 LYS 40 HE3 LYS 40 5.823 11.751 5.295
11 HZ1 LYS 40 HZ1 LYS 40 6.792 11.672 7.514
12 HZ2 LYS 40 HZ2 LYS 40 7.821 10.415 7.042
13 HZ3 LYS 40 HZ3 LYS 40 7.979 11.945 6.344
No H/Q in entry = 13
In of MODEL 3
1 H ILE 41 H ILE 41 4.155 5.888 3.092
2 HA ILE 41 HA ILE 41 2.069 5.336 4.891
3 HB ILE 41 HB ILE 41 2.865 3.901 2.357
4 HG12 ILE 41 HG12 ILE 41 0.779 6.040 2.826
5 HG13 ILE 41 HG13 ILE 41 2.378 6.341 2.158
6 HG21 ILE 41 HG21 ILE 41 1.414 2.521 3.743
7 HG22 ILE 41 HG22 ILE 41 0.262 3.849 3.876
8 HG23 ILE 41 HG23 ILE 41 0.558 3.092 2.311
9 HD11 ILE 41 HD11 ILE 41 0.258 4.601 0.934
10 HD12 ILE 41 HD12 ILE 41 0.691 6.233 0.425
11 HD13 ILE 41 HD13 ILE 41 1.857 4.918 0.262
No H/Q in entry = 11
In of MODEL 3
1 H LEU 42 H LEU 42 4.882 3.425 3.878
2 HA LEU 42 HA LEU 42 4.222 1.076 5.264
3 HB2 LEU 42 HB2 LEU 42 6.871 2.211 4.423
4 HB3 LEU 42 HB3 LEU 42 6.730 0.667 5.234
5 HG LEU 42 HG LEU 42 5.652 1.413 2.522
6 HD11 LEU 42 HD11 LEU 42 8.039 0.921 2.637
7 HD12 LEU 42 HD12 LEU 42 7.685 -0.621 3.417
8 HD13 LEU 42 HD13 LEU 42 7.165 -0.335 1.759
9 HD21 LEU 42 HD21 LEU 42 5.237 -1.108 4.131
10 HD22 LEU 42 HD22 LEU 42 3.994 0.009 3.565
11 HD23 LEU 42 HD23 LEU 42 4.905 -0.962 2.406
No H/Q in entry = 11
In of MODEL 3
1 H HIS 43 H HIS 43 5.959 3.973 6.285
2 HA HIS 43 HA HIS 43 6.699 3.029 8.837
3 HB2 HIS 43 HB2 HIS 43 7.501 5.170 7.718
4 HB3 HIS 43 HB3 HIS 43 5.977 5.895 8.220
5 HD1 HIS 43 HD1 HIS 43 5.961 6.910 10.504
6 HD2 HIS 43 HD2 HIS 43 9.036 4.161 10.021
7 HE1 HIS 43 HE1 HIS 43 7.318 7.038 12.616
8 HE2 HIS 43 HE2 HIS 43 9.240 5.452 12.253
No H/Q in entry = 8
In of MODEL 3
1 H TYR 44 H TYR 44 3.794 4.799 7.722
2 HA TYR 44 HA TYR 44 2.415 4.908 10.155
3 HB2 TYR 44 HB2 TYR 44 1.332 4.557 7.353
4 HB3 TYR 44 HB3 TYR 44 0.345 4.932 8.759
5 HD1 TYR 44 HD1 TYR 44 2.511 6.813 9.962
6 HD2 TYR 44 HD2 TYR 44 0.661 6.533 6.150
7 HE1 TYR 44 HE1 TYR 44 2.941 9.195 9.588
8 HE2 TYR 44 HE2 TYR 44 1.088 8.907 5.761
9 HH TYR 44 HH TYR 44 1.529 10.966 7.057
No H/Q in entry = 9
In of MODEL 3
1 H TYR 45 H TYR 45 2.505 2.470 7.638
2 HA TYR 45 HA TYR 45 0.594 0.711 8.583
3 HB2 TYR 45 HB2 TYR 45 1.491 0.583 6.342
4 HB3 TYR 45 HB3 TYR 45 3.101 0.250 6.962
5 HD1 TYR 45 HD1 TYR 45 -0.332 -1.126 7.182
6 HD2 TYR 45 HD2 TYR 45 3.824 -1.920 6.901
7 HE1 TYR 45 HE1 TYR 45 -0.815 -3.523 7.044
8 HE2 TYR 45 HE2 TYR 45 3.367 -4.329 6.762
9 HH TYR 45 HH TYR 45 1.738 -5.924 7.102
No H/Q in entry = 9
In of MODEL 3
1 H ASP 46 H ASP 46 4.078 0.850 9.288
2 HA ASP 46 HA ASP 46 3.959 -1.617 10.742
3 HB2 ASP 46 HB2 ASP 46 5.985 -0.865 9.480
4 HB3 ASP 46 HB3 ASP 46 6.200 0.420 10.661
No H/Q in entry = 4
In of MODEL 3
1 H GLU 47 H GLU 47 3.375 1.662 11.607
2 HA GLU 47 HA GLU 47 3.857 1.091 14.417
3 HB2 GLU 47 HB2 GLU 47 3.276 3.471 14.775
4 HB3 GLU 47 HB3 GLU 47 4.637 3.237 13.690
5 HG2 GLU 47 HG2 GLU 47 3.184 3.616 11.782
6 HG3 GLU 47 HG3 GLU 47 1.811 3.835 12.860
No H/Q in entry = 6
In of MODEL 3
1 H LEU 48 H LEU 48 1.528 0.201 12.458
2 HA LEU 48 HA LEU 48 -0.857 1.179 13.628
3 HB2 LEU 48 HB2 LEU 48 -0.165 -1.110 11.822
4 HB3 LEU 48 HB3 LEU 48 -1.805 -0.847 12.363
5 HG LEU 48 HG LEU 48 -0.161 1.115 10.785
6 HD11 LEU 48 HD11 LEU 48 -0.842 -0.842 9.491
7 HD12 LEU 48 HD12 LEU 48 -2.513 -0.594 9.994
8 HD13 LEU 48 HD13 LEU 48 -1.711 0.604 8.978
9 HD21 LEU 48 HD21 LEU 48 -2.962 1.196 11.881
10 HD22 LEU 48 HD22 LEU 48 -1.640 2.324 12.188
11 HD23 LEU 48 HD23 LEU 48 -2.394 2.264 10.593
No H/Q in entry = 11
In of MODEL 3
1 H GLU 49 H GLU 49 -2.204 -1.344 13.880
2 HA GLU 49 HA GLU 49 -1.308 -2.651 16.198
3 HB2 GLU 49 HB2 GLU 49 -2.892 -1.586 17.823
4 HB3 GLU 49 HB3 GLU 49 -1.534 -0.577 17.348
5 HG2 GLU 49 HG2 GLU 49 -2.989 0.602 15.772
6 HG3 GLU 49 HG3 GLU 49 -4.343 -0.397 16.291
No H/Q in entry = 6
In of MODEL 3
1 H GLY 50 H GLY 50 -2.469 -4.434 16.527
2 HA2 GLY 50 HA2 GLY 50 -5.149 -4.664 16.913
3 HA3 GLY 50 HA3 GLY 50 -4.140 -5.997 16.389
No H/Q in entry = 3
In of MODEL 3
1 H ASP 51 H ASP 51 -6.865 -4.344 15.725
2 HA ASP 51 HA ASP 51 -7.172 -5.695 13.212
3 HB2 ASP 51 HB2 ASP 51 -9.473 -4.866 13.260
4 HB3 ASP 51 HB3 ASP 51 -9.034 -5.590 14.802
No H/Q in entry = 4
In of MODEL 3
1 H ALA 52 H ALA 52 -6.340 -2.483 14.211
2 HA ALA 52 HA ALA 52 -6.969 -1.087 11.829
3 HB1 ALA 52 HB1 ALA 52 -4.658 -0.650 13.739
4 HB2 ALA 52 HB2 ALA 52 -5.190 0.483 12.495
5 HB3 ALA 52 HB3 ALA 52 -6.254 0.097 13.847
No H/Q in entry = 5
In of MODEL 3
1 H LYS 53 H LYS 53 -4.201 -2.937 12.896
2 HA LYS 53 HA LYS 53 -2.544 -2.683 10.667
3 HB2 LYS 53 HB2 LYS 53 -2.556 -4.120 13.091
4 HB3 LYS 53 HB3 LYS 53 -2.385 -5.323 11.827
5 HG2 LYS 53 HG2 LYS 53 -0.614 -2.923 12.216
6 HG3 LYS 53 HG3 LYS 53 -0.228 -4.579 12.674
7 HD2 LYS 53 HD2 LYS 53 -0.319 -5.269 10.347
8 HD3 LYS 53 HD3 LYS 53 -0.788 -3.639 9.863
9 HE2 LYS 53 HE2 LYS 53 1.576 -3.993 9.452
10 HE3 LYS 53 HE3 LYS 53 1.345 -2.782 10.709
11 HZ1 LYS 53 HZ1 LYS 53 2.017 -5.635 11.176
12 HZ2 LYS 53 HZ2 LYS 53 3.104 -4.346 11.265
13 HZ3 LYS 53 HZ3 LYS 53 1.833 -4.453 12.372
No H/Q in entry = 13
In of MODEL 3
1 H LYS 54 H LYS 54 -4.771 -5.322 11.521
2 HA LYS 54 HA LYS 54 -4.556 -6.805 9.181
3 HB2 LYS 54 HB2 LYS 54 -6.061 -8.123 10.130
4 HB3 LYS 54 HB3 LYS 54 -5.989 -7.025 11.497
5 HG2 LYS 54 HG2 LYS 54 -7.969 -5.950 10.881
6 HG3 LYS 54 HG3 LYS 54 -7.910 -6.599 9.234
7 HD2 LYS 54 HD2 LYS 54 -8.284 -8.828 10.086
8 HD3 LYS 54 HD3 LYS 54 -8.292 -8.219 11.741
9 HE2 LYS 54 HE2 LYS 54 -10.282 -6.915 11.295
10 HE3 LYS 54 HE3 LYS 54 -10.245 -7.388 9.597
11 HZ1 LYS 54 HZ1 LYS 54 -10.572 -9.286 11.855
12 HZ2 LYS 54 HZ2 LYS 54 -11.850 -8.662 10.937
13 HZ3 LYS 54 HZ3 LYS 54 -10.683 -9.646 10.206
No H/Q in entry = 13
In of MODEL 3
1 H GLU 55 H GLU 55 -6.781 -4.109 9.894
2 HA GLU 55 HA GLU 55 -8.176 -4.331 7.460
3 HB2 GLU 55 HB2 GLU 55 -7.947 -2.285 9.621
4 HB3 GLU 55 HB3 GLU 55 -8.676 -1.804 8.101
5 HG2 GLU 55 HG2 GLU 55 -10.106 -3.963 8.448
6 HG3 GLU 55 HG3 GLU 55 -9.630 -3.752 10.132
No H/Q in entry = 6
In of MODEL 3
1 H ALA 56 H ALA 56 -5.503 -2.179 8.472
2 HA ALA 56 HA ALA 56 -5.354 -0.877 6.009
3 HB1 ALA 56 HB1 ALA 56 -3.085 -0.215 6.647
4 HB2 ALA 56 HB2 ALA 56 -3.081 -1.430 7.924
5 HB3 ALA 56 HB3 ALA 56 -4.188 -0.060 8.014
No H/Q in entry = 5
In of MODEL 3
1 H THR 57 H THR 57 -3.555 -3.697 7.221
2 HA THR 57 HA THR 57 -1.994 -4.253 5.028
3 HB THR 57 HB THR 57 -3.382 -6.296 6.775
4 HG1 THR 57 HG1 THR 57 -2.239 -5.115 8.185
5 HG21 THR 57 HG21 THR 57 -0.883 -6.442 5.087
6 HG22 THR 57 HG22 THR 57 -1.392 -7.679 6.240
7 HG23 THR 57 HG23 THR 57 -2.392 -7.319 4.832
No H/Q in entry = 7
In of MODEL 3
1 H GLU 58 H GLU 58 -5.314 -5.308 5.654
2 HA GLU 58 HA GLU 58 -5.658 -6.801 3.264
3 HB2 GLU 58 HB2 GLU 58 -7.534 -5.600 5.273
4 HB3 GLU 58 HB3 GLU 58 -8.146 -6.360 3.805
5 HG2 GLU 58 HG2 GLU 58 -6.952 -8.428 4.423
6 HG3 GLU 58 HG3 GLU 58 -6.442 -7.653 5.922
No H/Q in entry = 6
In of MODEL 3
1 H HIS 59 H HIS 59 -5.903 -3.374 3.938
2 HA HIS 59 HA HIS 59 -7.316 -2.827 1.476
3 HB2 HIS 59 HB2 HIS 59 -6.019 -1.054 3.538
4 HB3 HIS 59 HB3 HIS 59 -6.656 -0.411 2.030
5 HD1 HIS 59 HD1 HIS 59 -9.286 -1.956 1.823
6 HD2 HIS 59 HD2 HIS 59 -7.876 -0.248 5.342
7 HE1 HIS 59 HE1 HIS 59 -11.313 -1.612 3.267
8 HE2 HIS 59 HE2 HIS 59 -10.421 -0.712 5.443
No H/Q in entry = 8
In of MODEL 3
1 H LEU 60 H LEU 60 -4.017 -2.292 2.700
2 HA LEU 60 HA LEU 60 -2.831 -1.587 0.326
3 HB2 LEU 60 HB2 LEU 60 -1.886 -2.934 2.819
4 HB3 LEU 60 HB3 LEU 60 -0.791 -2.736 1.461
5 HG LEU 60 HG LEU 60 -1.325 -0.307 1.522
6 HD11 LEU 60 HD11 LEU 60 -3.402 -0.390 2.691
7 HD12 LEU 60 HD12 LEU 60 -2.564 -0.913 4.154
8 HD13 LEU 60 HD13 LEU 60 -2.250 0.691 3.485
9 HD21 LEU 60 HD21 LEU 60 -0.037 -1.479 3.967
10 HD22 LEU 60 HD22 LEU 60 0.760 -1.138 2.431
11 HD23 LEU 60 HD23 LEU 60 0.151 0.189 3.421
No H/Q in entry = 11
In of MODEL 3
1 H LYS 61 H LYS 61 -3.703 -4.799 1.545
2 HA LYS 61 HA LYS 61 -2.356 -6.296 -0.431
3 HB2 LYS 61 HB2 LYS 61 -4.689 -6.856 1.364
4 HB3 LYS 61 HB3 LYS 61 -4.312 -7.974 0.063
5 HG2 LYS 61 HG2 LYS 61 -2.068 -8.288 0.978
6 HG3 LYS 61 HG3 LYS 61 -2.446 -7.162 2.284
7 HD2 LYS 61 HD2 LYS 61 -4.184 -8.635 3.102
8 HD3 LYS 61 HD3 LYS 61 -3.940 -9.728 1.736
9 HE2 LYS 61 HE2 LYS 61 -1.674 -10.197 2.512
10 HE3 LYS 61 HE3 LYS 61 -1.895 -9.086 3.863
11 HZ1 LYS 61 HZ1 LYS 61 -3.449 -11.572 3.397
12 HZ2 LYS 61 HZ2 LYS 61 -2.216 -11.380 4.536
13 HZ3 LYS 61 HZ3 LYS 61 -3.655 -10.513 4.696
No H/Q in entry = 13
In of MODEL 3
1 H GLY 62 H GLY 62 -5.766 -5.250 -0.234
2 HA2 GLY 62 HA2 GLY 62 -7.198 -4.580 -1.898
3 HA3 GLY 62 HA3 GLY 62 -6.546 -5.931 -2.815
No H/Q in entry = 3
In of MODEL 3
1 H GLY 63 H GLY 63 -4.910 -3.001 -1.657
2 HA2 GLY 63 HA2 GLY 63 -3.591 -1.490 -2.772
3 HA3 GLY 63 HA3 GLY 63 -4.767 -1.612 -4.075
No H/Q in entry = 3
In of MODEL 3
1 H CYS 64 H CYS 64 -2.479 -3.953 -2.703
2 HA CYS 64 HA CYS 64 -0.706 -4.014 -4.875
3 HB2 CYS 64 HB2 CYS 64 -0.139 -4.997 -2.713
4 HB3 CYS 64 HB3 CYS 64 -1.416 -6.191 -2.897
No H/Q in entry = 4
In of MODEL 3
1 H ARG 65 H ARG 65 -3.601 -5.873 -4.151
2 HA ARG 65 HA ARG 65 -3.556 -7.628 -6.325
3 HB2 ARG 65 HB2 ARG 65 -5.042 -7.857 -4.379
4 HB3 ARG 65 HB3 ARG 65 -5.929 -6.429 -4.886
5 HG2 ARG 65 HG2 ARG 65 -6.473 -7.667 -7.012
6 HG3 ARG 65 HG3 ARG 65 -5.819 -9.111 -6.230
7 HD2 ARG 65 HD2 ARG 65 -8.242 -8.994 -5.961
8 HD3 ARG 65 HD3 ARG 65 -7.424 -8.849 -4.405
9 HE ARG 65 HE ARG 65 -8.062 -6.333 -5.705
10 HH11 ARG 65 HH11 ARG 65 -9.128 -8.786 -3.427
11 HH12 ARG 65 HH12 ARG 65 -10.216 -7.715 -2.606
12 HH21 ARG 65 HH21 ARG 65 -9.463 -4.938 -4.630
13 HH22 ARG 65 HH22 ARG 65 -10.412 -5.518 -3.291
No H/Q in entry = 13
In of MODEL 3
1 H GLU 66 H GLU 66 -5.043 -4.414 -5.988
2 HA GLU 66 HA GLU 66 -6.093 -4.314 -8.607
3 HB2 GLU 66 HB2 GLU 66 -5.670 -2.365 -6.414
4 HB3 GLU 66 HB3 GLU 66 -5.857 -1.705 -8.030
5 HG2 GLU 66 HG2 GLU 66 -7.991 -1.722 -6.959
6 HG3 GLU 66 HG3 GLU 66 -8.000 -2.927 -8.241
No H/Q in entry = 6
In of MODEL 3
1 H ILE 67 H ILE 67 -2.996 -3.257 -7.253
2 HA ILE 67 HA ILE 67 -2.042 -2.107 -9.669
3 HB ILE 67 HB ILE 67 -0.615 -3.154 -7.231
4 HG12 ILE 67 HG12 ILE 67 -1.014 -0.381 -8.377
5 HG13 ILE 67 HG13 ILE 67 -1.883 -1.063 -7.009
6 HG21 ILE 67 HG21 ILE 67 0.863 -3.536 -9.145
7 HG22 ILE 67 HG22 ILE 67 0.655 -1.857 -9.647
8 HG23 ILE 67 HG23 ILE 67 1.471 -2.227 -8.129
9 HD11 ILE 67 HD11 ILE 67 0.205 -1.177 -5.748
10 HD12 ILE 67 HD12 ILE 67 1.065 -0.480 -7.122
11 HD13 ILE 67 HD13 ILE 67 -0.158 0.466 -6.275
No H/Q in entry = 11
In of MODEL 3
1 H LEU 68 H LEU 68 -1.860 -5.329 -8.267
2 HA LEU 68 HA LEU 68 -0.287 -6.507 -10.297
3 HB2 LEU 68 HB2 LEU 68 -0.931 -7.353 -7.931
4 HB3 LEU 68 HB3 LEU 68 -2.378 -7.964 -8.704
5 HG LEU 68 HG LEU 68 -1.082 -9.446 -10.096
6 HD11 LEU 68 HD11 LEU 68 1.319 -8.127 -8.837
7 HD12 LEU 68 HD12 LEU 68 1.376 -9.595 -9.814
8 HD13 LEU 68 HD13 LEU 68 0.849 -8.076 -10.535
9 HD21 LEU 68 HD21 LEU 68 -0.157 -9.531 -7.227
10 HD22 LEU 68 HD22 LEU 68 -1.651 -10.224 -7.859
11 HD23 LEU 68 HD23 LEU 68 -0.093 -10.872 -8.372
No H/Q in entry = 11
In of MODEL 3
1 H LYS 69 H LYS 69 -3.646 -5.752 -9.966
2 HA LYS 69 HA LYS 69 -4.586 -7.149 -12.222
3 HB2 LYS 69 HB2 LYS 69 -5.609 -4.715 -10.790
4 HB3 LYS 69 HB3 LYS 69 -6.401 -5.325 -12.234
5 HG2 LYS 69 HG2 LYS 69 -6.816 -7.447 -11.150
6 HG3 LYS 69 HG3 LYS 69 -5.947 -6.902 -9.710
7 HD2 LYS 69 HD2 LYS 69 -7.600 -5.112 -9.410
8 HD3 LYS 69 HD3 LYS 69 -8.462 -5.678 -10.839
9 HE2 LYS 69 HE2 LYS 69 -9.055 -7.711 -9.789
10 HE3 LYS 69 HE3 LYS 69 -7.934 -7.430 -8.457
11 HZ1 LYS 69 HZ1 LYS 69 -10.341 -5.786 -9.026
12 HZ2 LYS 69 HZ2 LYS 69 -10.240 -6.987 -7.840
13 HZ3 LYS 69 HZ3 LYS 69 -9.282 -5.596 -7.715
No H/Q in entry = 13
In of MODEL 3
1 H HIS 70 H HIS 70 -2.437 -4.622 -12.006
2 HA HIS 70 HA HIS 70 -3.038 -3.671 -14.709
3 HB2 HIS 70 HB2 HIS 70 -2.884 -1.871 -13.044
4 HB3 HIS 70 HB3 HIS 70 -1.276 -2.425 -12.584
5 HD1 HIS 70 HD1 HIS 70 -3.092 -0.472 -15.158
6 HD2 HIS 70 HD2 HIS 70 0.755 -1.894 -14.478
7 HE1 HIS 70 HE1 HIS 70 -1.629 0.753 -16.789
8 HE2 HIS 70 HE2 HIS 70 0.662 -0.252 -16.494
No H/Q in entry = 8
In of MODEL 3
1 H VAL 71 H VAL 71 -0.350 -4.500 -12.560
2 HA VAL 71 HA VAL 71 1.569 -4.483 -14.595
3 HB VAL 71 HB VAL 71 2.205 -3.921 -12.381
4 HG11 VAL 71 HG11 VAL 71 1.334 -6.636 -11.590
5 HG12 VAL 71 HG12 VAL 71 2.300 -5.554 -10.576
6 HG13 VAL 71 HG13 VAL 71 0.673 -5.079 -11.083
7 HG21 VAL 71 HG21 VAL 71 3.426 -6.431 -13.392
8 HG22 VAL 71 HG22 VAL 71 4.038 -4.778 -13.470
9 HG23 VAL 71 HG23 VAL 71 4.011 -5.634 -11.932
No H/Q in entry = 9
In of MODEL 3
1 H VAL 72 H VAL 72 0.051 -7.227 -12.859
2 HA VAL 72 HA VAL 72 1.228 -8.997 -14.844
3 HB VAL 72 HB VAL 72 0.923 -9.464 -12.258
4 HG11 VAL 72 HG11 VAL 72 -1.681 -10.388 -13.408
5 HG12 VAL 72 HG12 VAL 72 -1.007 -10.997 -11.894
6 HG13 VAL 72 HG13 VAL 72 -1.421 -9.288 -12.059
7 HG21 VAL 72 HG21 VAL 72 0.852 -11.280 -14.588
8 HG22 VAL 72 HG22 VAL 72 2.138 -10.993 -13.414
9 HG23 VAL 72 HG23 VAL 72 0.726 -11.951 -12.968
No H/Q in entry = 9
In of MODEL 3
1 H GLY 73 H GLY 73 -1.546 -7.199 -14.365
2 HA2 GLY 73 HA2 GLY 73 -2.820 -8.403 -16.671
3 HA3 GLY 73 HA3 GLY 73 -3.289 -6.910 -15.873
No H/Q in entry = 3
In of MODEL 3
1 H GLU 74 H GLU 74 -5.484 -7.780 -16.137
2 HA GLU 74 HA GLU 74 -6.455 -8.988 -13.776
3 HB2 GLU 74 HB2 GLU 74 -7.804 -8.710 -16.468
4 HB3 GLU 74 HB3 GLU 74 -8.615 -9.149 -14.972
5 HG2 GLU 74 HG2 GLU 74 -7.920 -6.960 -14.026
6 HG3 GLU 74 HG3 GLU 74 -7.282 -6.530 -15.612
No H/Q in entry = 6
In of MODEL 3
1 H GLU 75 H GLU 75 -5.276 -10.229 -16.747
2 HA GLU 75 HA GLU 75 -6.194 -12.826 -16.916
3 HB2 GLU 75 HB2 GLU 75 -4.653 -11.814 -18.510
4 HB3 GLU 75 HB3 GLU 75 -3.384 -11.795 -17.294
5 HG2 GLU 75 HG2 GLU 75 -2.940 -13.628 -18.697
6 HG3 GLU 75 HG3 GLU 75 -3.588 -14.291 -17.197
No H/Q in entry = 6
In of MODEL 3
1 H LYS 76 H LYS 76 -3.205 -11.912 -15.202
2 HA LYS 76 HA LYS 76 -3.069 -14.567 -14.132
3 HB2 LYS 76 HB2 LYS 76 -1.274 -12.188 -13.649
4 HB3 LYS 76 HB3 LYS 76 -0.932 -13.850 -13.240
5 HG2 LYS 76 HG2 LYS 76 -1.275 -12.758 -16.012
6 HG3 LYS 76 HG3 LYS 76 0.248 -13.207 -15.248
7 HD2 LYS 76 HD2 LYS 76 -2.037 -15.085 -15.847
8 HD3 LYS 76 HD3 LYS 76 -0.556 -14.937 -16.792
9 HE2 LYS 76 HE2 LYS 76 0.750 -15.633 -14.844
10 HE3 LYS 76 HE3 LYS 76 -0.728 -15.783 -13.901
11 HZ1 LYS 76 HZ1 LYS 76 -1.490 -17.474 -15.484
12 HZ2 LYS 76 HZ2 LYS 76 -0.010 -17.367 -16.306
13 HZ3 LYS 76 HZ3 LYS 76 -0.051 -17.929 -14.713
No H/Q in entry = 13
In of MODEL 3
1 H ALA 77 H ALA 77 -3.873 -11.359 -12.983
2 HA ALA 77 HA ALA 77 -3.904 -11.932 -10.224
3 HB1 ALA 77 HB1 ALA 77 -5.313 -9.949 -10.011
4 HB2 ALA 77 HB2 ALA 77 -5.576 -9.939 -11.755
5 HB3 ALA 77 HB3 ALA 77 -3.961 -9.649 -11.105
No H/Q in entry = 5
In of MODEL 3
1 H ALA 78 H ALA 78 -6.171 -12.530 -12.809
2 HA ALA 78 HA ALA 78 -8.405 -13.264 -11.232
3 HB1 ALA 78 HB1 ALA 78 -9.017 -14.571 -13.363
4 HB2 ALA 78 HB2 ALA 78 -8.866 -12.819 -13.485
5 HB3 ALA 78 HB3 ALA 78 -7.556 -13.851 -14.064
No H/Q in entry = 5
In of MODEL 3
1 H GLU 79 H GLU 79 -5.579 -14.957 -12.414
2 HA GLU 79 HA GLU 79 -6.521 -17.553 -11.637
3 HB2 GLU 79 HB2 GLU 79 -3.723 -16.680 -12.369
4 HB3 GLU 79 HB3 GLU 79 -4.316 -18.334 -12.296
5 HG2 GLU 79 HG2 GLU 79 -5.975 -17.668 -14.075
6 HG3 GLU 79 HG3 GLU 79 -5.039 -16.189 -14.256
No H/Q in entry = 6
In of MODEL 3
1 H LEU 80 H LEU 80 -4.564 -15.033 -10.230
2 HA LEU 80 HA LEU 80 -3.613 -16.593 -8.047
3 HB2 LEU 80 HB2 LEU 80 -3.881 -13.604 -8.357
4 HB3 LEU 80 HB3 LEU 80 -2.956 -14.417 -7.107
5 HG LEU 80 HG LEU 80 -2.377 -14.776 -10.040
6 HD11 LEU 80 HD11 LEU 80 -1.203 -12.791 -8.113
7 HD12 LEU 80 HD12 LEU 80 -0.512 -13.196 -9.686
8 HD13 LEU 80 HD13 LEU 80 -2.109 -12.449 -9.586
9 HD21 LEU 80 HD21 LEU 80 -0.791 -15.323 -7.540
10 HD22 LEU 80 HD22 LEU 80 -1.509 -16.518 -8.623
11 HD23 LEU 80 HD23 LEU 80 -0.186 -15.497 -9.188
No H/Q in entry = 11
In of MODEL 3
1 H LYS 81 H LYS 81 -6.416 -14.557 -8.623
2 HA LYS 81 HA LYS 81 -7.380 -14.559 -5.963
3 HB2 LYS 81 HB2 LYS 81 -8.175 -12.965 -7.676
4 HB3 LYS 81 HB3 LYS 81 -8.940 -14.291 -8.541
5 HG2 LYS 81 HG2 LYS 81 -10.621 -13.147 -7.295
6 HG3 LYS 81 HG3 LYS 81 -10.345 -14.713 -6.532
7 HD2 LYS 81 HD2 LYS 81 -8.844 -13.587 -4.898
8 HD3 LYS 81 HD3 LYS 81 -9.284 -12.040 -5.619
9 HE2 LYS 81 HE2 LYS 81 -11.126 -13.987 -4.236
10 HE3 LYS 81 HE3 LYS 81 -10.608 -12.412 -3.635
11 HZ1 LYS 81 HZ1 LYS 81 -11.740 -11.410 -5.572
12 HZ2 LYS 81 HZ2 LYS 81 -12.329 -12.937 -5.995
13 HZ3 LYS 81 HZ3 LYS 81 -12.796 -12.225 -4.534
No H/Q in entry = 13
In of MODEL 3
1 H ASN 82 H ASN 82 -8.140 -16.598 -8.788
2 HA ASN 82 HA ASN 82 -9.910 -18.277 -7.327
3 HB2 ASN 82 HB2 ASN 82 -9.894 -18.062 -9.845
4 HB3 ASN 82 HB3 ASN 82 -8.397 -18.983 -9.857
5 HD21 ASN 82 HD21 ASN 82 -9.203 -20.697 -11.000
6 HD22 ASN 82 HD22 ASN 82 -10.360 -21.806 -10.348
No H/Q in entry = 6
In of MODEL 3
1 H LEU 83 H LEU 83 -6.435 -18.351 -7.986
2 HA LEU 83 HA LEU 83 -5.811 -20.857 -7.006
3 HB2 LEU 83 HB2 LEU 83 -4.505 -18.351 -7.479
4 HB3 LEU 83 HB3 LEU 83 -3.954 -19.010 -5.960
5 HG LEU 83 HG LEU 83 -2.561 -19.566 -7.977
6 HD11 LEU 83 HD11 LEU 83 -3.723 -21.865 -6.418
7 HD12 LEU 83 HD12 LEU 83 -2.227 -21.921 -7.346
8 HD13 LEU 83 HD13 LEU 83 -2.353 -20.864 -5.940
9 HD21 LEU 83 HD21 LEU 83 -4.404 -19.932 -9.548
10 HD22 LEU 83 HD22 LEU 83 -3.314 -21.317 -9.468
11 HD23 LEU 83 HD23 LEU 83 -4.873 -21.375 -8.647
No H/Q in entry = 11
In of MODEL 3
1 H LYS 84 H LYS 84 -5.895 -17.813 -5.203
2 HA LYS 84 HA LYS 84 -5.692 -18.698 -2.620
3 HB2 LYS 84 HB2 LYS 84 -5.754 -16.331 -3.385
4 HB3 LYS 84 HB3 LYS 84 -7.490 -16.475 -3.601
5 HG2 LYS 84 HG2 LYS 84 -7.742 -16.901 -1.199
6 HG3 LYS 84 HG3 LYS 84 -5.998 -16.709 -0.997
7 HD2 LYS 84 HD2 LYS 84 -6.183 -14.416 -1.906
8 HD3 LYS 84 HD3 LYS 84 -7.932 -14.619 -1.998
9 HE2 LYS 84 HE2 LYS 84 -8.002 -14.972 0.430
10 HE3 LYS 84 HE3 LYS 84 -6.256 -14.727 0.506
11 HZ1 LYS 84 HZ1 LYS 84 -6.618 -12.479 -0.398
12 HZ2 LYS 84 HZ2 LYS 84 -8.290 -12.732 -0.329
13 HZ3 LYS 84 HZ3 LYS 84 -7.381 -12.710 1.095
No H/Q in entry = 13
In of MODEL 3
1 H ASP 85 H ASP 85 -8.744 -18.157 -4.366
2 HA ASP 85 HA ASP 85 -10.468 -19.073 -2.335
3 HB2 ASP 85 HB2 ASP 85 -11.218 -17.693 -4.221
4 HB3 ASP 85 HB3 ASP 85 -10.901 -19.031 -5.322
No H/Q in entry = 4
In of MODEL 3
1 H SER 86 H SER 86 -8.848 -20.842 -4.921
2 HA SER 86 HA SER 86 -10.395 -23.212 -4.400
3 HB2 SER 86 HB2 SER 86 -9.526 -22.621 -6.671
4 HB3 SER 86 HB3 SER 86 -7.896 -22.942 -6.089
5 HG SER 86 HG SER 86 -8.332 -24.899 -6.736
No H/Q in entry = 5
In of MODEL 3
1 H GLY 87 H GLY 87 -7.835 -21.766 -2.869
2 HA2 GLY 87 HA2 GLY 87 -7.281 -24.319 -1.486
3 HA3 GLY 87 HA3 GLY 87 -7.331 -22.756 -0.687
No H/Q in entry = 3
In of MODEL 3
1 H ALA 88 H ALA 88 -5.821 -21.334 -2.657
2 HA ALA 88 HA ALA 88 -3.225 -22.568 -2.498
3 HB1 ALA 88 HB1 ALA 88 -3.836 -19.706 -3.204
4 HB2 ALA 88 HB2 ALA 88 -3.776 -21.042 -4.353
5 HB3 ALA 88 HB3 ALA 88 -2.322 -20.572 -3.474
No H/Q in entry = 5
In of MODEL 3
1 H SER 89 H SER 89 -2.091 -22.563 -0.748
2 HA SER 89 HA SER 89 -2.727 -21.000 1.558
3 HB2 SER 89 HB2 SER 89 -1.689 -23.356 1.497
4 HB3 SER 89 HB3 SER 89 -0.164 -22.545 1.153
5 HG SER 89 HG SER 89 -1.191 -22.988 3.498
No H/Q in entry = 5
In of MODEL 3
1 H LYS 90 H LYS 90 -0.645 -19.915 2.668
2 HA LYS 90 HA LYS 90 -0.289 -17.518 1.310
3 HB2 LYS 90 HB2 LYS 90 -0.028 -17.721 3.721
4 HB3 LYS 90 HB3 LYS 90 1.386 -18.740 3.508
5 HG2 LYS 90 HG2 LYS 90 2.669 -16.929 2.666
6 HG3 LYS 90 HG3 LYS 90 1.242 -15.899 2.540
7 HD2 LYS 90 HD2 LYS 90 2.622 -15.332 4.493
8 HD3 LYS 90 HD3 LYS 90 1.009 -15.874 4.954
9 HE2 LYS 90 HE2 LYS 90 2.655 -16.859 6.422
10 HE3 LYS 90 HE3 LYS 90 1.920 -18.111 5.426
11 HZ1 LYS 90 HZ1 LYS 90 4.554 -16.845 4.903
12 HZ2 LYS 90 HZ2 LYS 90 4.327 -18.357 5.621
13 HZ3 LYS 90 HZ3 LYS 90 3.860 -18.108 4.016
No H/Q in entry = 13
In of MODEL 3
1 H GLU 91 H GLU 91 1.723 -20.400 1.359
2 HA GLU 91 HA GLU 91 3.940 -19.163 0.103
3 HB2 GLU 91 HB2 GLU 91 4.283 -21.067 1.534
4 HB3 GLU 91 HB3 GLU 91 3.208 -22.056 0.563
5 HG2 GLU 91 HG2 GLU 91 4.782 -22.012 -1.269
6 HG3 GLU 91 HG3 GLU 91 5.853 -20.955 -0.348
No H/Q in entry = 6
In of MODEL 3
1 H GLU 92 H GLU 92 1.338 -21.236 -1.086
2 HA GLU 92 HA GLU 92 2.043 -21.600 -3.709
3 HB2 GLU 92 HB2 GLU 92 -0.681 -21.173 -2.482
4 HB3 GLU 92 HB3 GLU 92 -0.387 -21.820 -4.089
5 HG2 GLU 92 HG2 GLU 92 0.900 -23.617 -3.074
6 HG3 GLU 92 HG3 GLU 92 0.449 -23.030 -1.487
No H/Q in entry = 6
In of MODEL 3
1 H LEU 93 H LEU 93 0.261 -18.972 -2.188
2 HA LEU 93 HA LEU 93 0.132 -17.425 -4.582
3 HB2 LEU 93 HB2 LEU 93 -0.153 -16.594 -1.702
4 HB3 LEU 93 HB3 LEU 93 -0.348 -15.486 -3.050
5 HG LEU 93 HG LEU 93 -2.097 -17.790 -2.247
6 HD11 LEU 93 HD11 LEU 93 -2.635 -14.928 -2.996
7 HD12 LEU 93 HD12 LEU 93 -3.856 -16.117 -2.539
8 HD13 LEU 93 HD13 LEU 93 -2.641 -15.606 -1.365
9 HD21 LEU 93 HD21 LEU 93 -1.980 -16.502 -4.973
10 HD22 LEU 93 HD22 LEU 93 -1.697 -18.199 -4.582
11 HD23 LEU 93 HD23 LEU 93 -3.306 -17.509 -4.392
No H/Q in entry = 11
In of MODEL 3
1 H LYS 94 H LYS 94 2.548 -17.713 -2.010
2 HA LYS 94 HA LYS 94 4.014 -15.435 -2.807
3 HB2 LYS 94 HB2 LYS 94 4.316 -16.568 -0.626
4 HB3 LYS 94 HB3 LYS 94 5.005 -17.955 -1.450
5 HG2 LYS 94 HG2 LYS 94 6.859 -16.575 -2.239
6 HG3 LYS 94 HG3 LYS 94 6.165 -15.179 -1.408
7 HD2 LYS 94 HD2 LYS 94 6.415 -16.303 0.733
8 HD3 LYS 94 HD3 LYS 94 7.042 -17.739 -0.075
9 HE2 LYS 94 HE2 LYS 94 8.320 -15.006 -0.067
10 HE3 LYS 94 HE3 LYS 94 8.845 -16.396 0.881
11 HZ1 LYS 94 HZ1 LYS 94 9.287 -17.580 -1.191
12 HZ2 LYS 94 HZ2 LYS 94 8.822 -16.224 -2.082
13 HZ3 LYS 94 HZ3 LYS 94 10.190 -16.155 -1.093
No H/Q in entry = 13
In of MODEL 3
1 H ALA 95 H ALA 95 4.087 -18.811 -3.721
2 HA ALA 95 HA ALA 95 6.352 -18.368 -5.438
3 HB1 ALA 95 HB1 ALA 95 6.131 -20.453 -4.083
4 HB2 ALA 95 HB2 ALA 95 4.748 -20.896 -5.084
5 HB3 ALA 95 HB3 ALA 95 6.353 -20.762 -5.806
No H/Q in entry = 5
In of MODEL 3
1 H LYS 96 H LYS 96 2.915 -18.534 -5.742
2 HA LYS 96 HA LYS 96 2.916 -18.535 -8.564
3 HB2 LYS 96 HB2 LYS 96 1.036 -17.471 -6.493
4 HB3 LYS 96 HB3 LYS 96 0.767 -17.137 -8.188
5 HG2 LYS 96 HG2 LYS 96 0.938 -19.862 -6.934
6 HG3 LYS 96 HG3 LYS 96 -0.535 -19.048 -7.456
7 HD2 LYS 96 HD2 LYS 96 0.299 -19.054 -9.768
8 HD3 LYS 96 HD3 LYS 96 1.750 -19.904 -9.230
9 HE2 LYS 96 HE2 LYS 96 0.334 -21.753 -8.425
10 HE3 LYS 96 HE3 LYS 96 -1.084 -20.913 -9.047
11 HZ1 LYS 96 HZ1 LYS 96 -0.117 -21.044 -11.272
12 HZ2 LYS 96 HZ2 LYS 96 1.204 -21.901 -10.655
13 HZ3 LYS 96 HZ3 LYS 96 -0.343 -22.577 -10.601
No H/Q in entry = 13
In of MODEL 3
1 H VAL 97 H VAL 97 2.560 -15.776 -6.396
2 HA VAL 97 HA VAL 97 2.530 -13.758 -8.209
3 HB VAL 97 HB VAL 97 3.710 -13.664 -5.434
4 HG11 VAL 97 HG11 VAL 97 2.706 -11.443 -7.198
5 HG12 VAL 97 HG12 VAL 97 3.181 -11.278 -5.509
6 HG13 VAL 97 HG13 VAL 97 4.380 -11.720 -6.719
7 HG21 VAL 97 HG21 VAL 97 0.931 -13.189 -6.488
8 HG22 VAL 97 HG22 VAL 97 1.463 -14.490 -5.417
9 HG23 VAL 97 HG23 VAL 97 1.456 -12.820 -4.843
No H/Q in entry = 9
In of MODEL 3
1 H GLU 98 H GLU 98 5.489 -15.189 -6.807
2 HA GLU 98 HA GLU 98 7.291 -13.303 -7.820
3 HB2 GLU 98 HB2 GLU 98 7.700 -16.254 -7.331
4 HB3 GLU 98 HB3 GLU 98 8.995 -15.119 -7.689
5 HG2 GLU 98 HG2 GLU 98 7.210 -15.169 -5.273
6 HG3 GLU 98 HG3 GLU 98 8.947 -15.469 -5.340
No H/Q in entry = 6
In of MODEL 3
1 H GLU 99 H GLU 99 5.940 -16.205 -9.310
2 HA GLU 99 HA GLU 99 7.519 -15.980 -11.693
3 HB2 GLU 99 HB2 GLU 99 4.970 -17.533 -11.203
4 HB3 GLU 99 HB3 GLU 99 6.057 -17.740 -12.570
5 HG2 GLU 99 HG2 GLU 99 6.765 -18.235 -9.686
6 HG3 GLU 99 HG3 GLU 99 6.355 -19.475 -10.870
No H/Q in entry = 6
In of MODEL 3
1 H ALA 100 H ALA 100 4.330 -14.955 -10.657
2 HA ALA 100 HA ALA 100 3.383 -14.080 -13.169
3 HB1 ALA 100 HB1 ALA 100 1.809 -14.385 -11.428
4 HB2 ALA 100 HB2 ALA 100 2.701 -13.328 -10.336
5 HB3 ALA 100 HB3 ALA 100 1.863 -12.648 -11.726
No H/Q in entry = 5
In of MODEL 3
1 H LEU 101 H LEU 101 5.156 -12.459 -10.575
2 HA LEU 101 HA LEU 101 5.238 -9.924 -11.867
3 HB2 LEU 101 HB2 LEU 101 6.840 -11.076 -9.597
4 HB3 LEU 101 HB3 LEU 101 7.000 -9.420 -10.152
5 HG LEU 101 HG LEU 101 4.471 -10.634 -9.036
6 HD11 LEU 101 HD11 LEU 101 6.201 -10.386 -7.342
7 HD12 LEU 101 HD12 LEU 101 6.437 -8.703 -7.815
8 HD13 LEU 101 HD13 LEU 101 4.908 -9.213 -7.099
9 HD21 LEU 101 HD21 LEU 101 5.146 -7.803 -9.832
10 HD22 LEU 101 HD22 LEU 101 4.011 -8.875 -10.652
11 HD23 LEU 101 HD23 LEU 101 3.669 -8.313 -9.016
No H/Q in entry = 11
In of MODEL 3
1 H HIS 102 H HIS 102 7.129 -12.795 -12.217
2 HA HIS 102 HA HIS 102 9.272 -11.299 -13.442
3 HB2 HIS 102 HB2 HIS 102 8.824 -14.205 -12.911
4 HB3 HIS 102 HB3 HIS 102 10.000 -13.731 -14.133
5 HD1 HIS 102 HD1 HIS 102 11.804 -11.834 -13.104
6 HD2 HIS 102 HD2 HIS 102 9.934 -14.440 -10.464
7 HE1 HIS 102 HE1 HIS 102 13.226 -11.833 -11.032
8 HE2 HIS 102 HE2 HIS 102 11.972 -13.269 -9.388
No H/Q in entry = 8
In of MODEL 3
1 H ALA 103 H ALA 103 6.656 -13.477 -14.465
2 HA ALA 103 HA ALA 103 7.423 -13.598 -17.155
3 HB1 ALA 103 HB1 ALA 103 4.690 -14.049 -15.971
4 HB2 ALA 103 HB2 ALA 103 5.991 -15.238 -16.013
5 HB3 ALA 103 HB3 ALA 103 5.275 -14.658 -17.520
No H/Q in entry = 5
In of MODEL 3
1 H VAL 104 H VAL 104 6.397 -10.858 -15.662
2 HA VAL 104 HA VAL 104 4.939 -9.830 -17.932
3 HB VAL 104 HB VAL 104 3.993 -9.242 -15.854
4 HG11 VAL 104 HG11 VAL 104 5.895 -9.720 -14.468
5 HG12 VAL 104 HG12 VAL 104 6.692 -8.252 -15.037
6 HG13 VAL 104 HG13 VAL 104 5.211 -8.143 -14.081
7 HG21 VAL 104 HG21 VAL 104 5.578 -6.896 -16.867
8 HG22 VAL 104 HG22 VAL 104 3.996 -7.409 -17.443
9 HG23 VAL 104 HG23 VAL 104 4.178 -6.784 -15.805
No H/Q in entry = 9
In of MODEL 3
1 H THR 105 H THR 105 5.691 -8.058 -19.151
2 HA THR 105 HA THR 105 8.486 -7.282 -18.759
3 HB THR 105 HB THR 105 8.883 -7.687 -21.253
4 HG1 THR 105 HG1 THR 105 7.132 -9.816 -21.186
5 HG21 THR 105 HG21 THR 105 8.585 -10.068 -19.419
6 HG22 THR 105 HG22 THR 105 9.547 -10.024 -20.896
7 HG23 THR 105 HG23 THR 105 9.992 -9.010 -19.526
No H/Q in entry = 7
In of MODEL 3
1 H ASP 106 H ASP 106 5.468 -6.153 -19.257
2 HA ASP 106 HA ASP 106 6.203 -4.060 -21.111
3 HB2 ASP 106 HB2 ASP 106 3.802 -4.967 -20.604
4 HB3 ASP 106 HB3 ASP 106 3.883 -3.889 -19.223
No H/Q in entry = 4
In of MODEL 3
1 H GLU 107 H GLU 107 7.090 -2.162 -20.600
2 HA GLU 107 HA GLU 107 8.710 -2.191 -18.352
3 HB2 GLU 107 HB2 GLU 107 9.347 -1.070 -20.401
4 HB3 GLU 107 HB3 GLU 107 8.072 0.121 -20.175
5 HG2 GLU 107 HG2 GLU 107 9.158 1.073 -18.310
6 HG3 GLU 107 HG3 GLU 107 10.281 -0.280 -18.185
No H/Q in entry = 6
In of MODEL 3
1 H GLU 108 H GLU 108 5.840 -0.182 -18.936
2 HA GLU 108 HA GLU 108 6.131 1.298 -16.552
3 HB2 GLU 108 HB2 GLU 108 3.763 1.976 -16.944
4 HB3 GLU 108 HB3 GLU 108 4.835 2.239 -18.307
5 HG2 GLU 108 HG2 GLU 108 3.153 1.330 -19.466
6 HG3 GLU 108 HG3 GLU 108 3.874 -0.189 -18.936
No H/Q in entry = 6
In of MODEL 3
1 H LYS 109 H LYS 109 4.833 -1.843 -17.177
2 HA LYS 109 HA LYS 109 3.473 -2.120 -14.666
3 HB2 LYS 109 HB2 LYS 109 4.427 -4.155 -16.686
4 HB3 LYS 109 HB3 LYS 109 3.428 -4.534 -15.293
5 HG2 LYS 109 HG2 LYS 109 1.657 -3.134 -16.131
6 HG3 LYS 109 HG3 LYS 109 2.659 -2.628 -17.484
7 HD2 LYS 109 HD2 LYS 109 2.698 -4.973 -18.271
8 HD3 LYS 109 HD3 LYS 109 1.632 -5.408 -16.938
9 HE2 LYS 109 HE2 LYS 109 0.438 -5.046 -19.088
10 HE3 LYS 109 HE3 LYS 109 -0.113 -3.998 -17.784
11 HZ1 LYS 109 HZ1 LYS 109 1.278 -2.215 -18.699
12 HZ2 LYS 109 HZ2 LYS 109 1.735 -3.227 -19.979
13 HZ3 LYS 109 HZ3 LYS 109 0.123 -2.752 -19.819
No H/Q in entry = 13
In of MODEL 3
1 H LYS 110 H LYS 110 6.632 -3.035 -15.973
2 HA LYS 110 HA LYS 110 7.551 -4.337 -13.627
3 HB2 LYS 110 HB2 LYS 110 9.108 -3.078 -15.887
4 HB3 LYS 110 HB3 LYS 110 9.806 -4.108 -14.647
5 HG2 LYS 110 HG2 LYS 110 8.316 -5.944 -15.421
6 HG3 LYS 110 HG3 LYS 110 7.798 -4.895 -16.744
7 HD2 LYS 110 HD2 LYS 110 10.654 -5.709 -16.207
8 HD3 LYS 110 HD3 LYS 110 9.601 -6.470 -17.396
9 HE2 LYS 110 HE2 LYS 110 9.431 -4.404 -18.631
10 HE3 LYS 110 HE3 LYS 110 10.342 -3.548 -17.391
11 HZ1 LYS 110 HZ1 LYS 110 11.408 -5.759 -19.057
12 HZ2 LYS 110 HZ2 LYS 110 11.705 -4.116 -19.322
13 HZ3 LYS 110 HZ3 LYS 110 12.271 -4.863 -17.916
No H/Q in entry = 13
In of MODEL 3
1 H GLN 111 H GLN 111 7.248 -1.059 -14.491
2 HA GLN 111 HA GLN 111 8.979 0.077 -12.582
3 HB2 GLN 111 HB2 GLN 111 6.329 1.093 -13.627
4 HB3 GLN 111 HB3 GLN 111 7.434 2.042 -12.643
5 HG2 GLN 111 HG2 GLN 111 7.981 0.924 -15.385
6 HG3 GLN 111 HG3 GLN 111 7.696 2.612 -14.967
7 HE21 GLN 111 HE21 GLN 111 9.948 -0.025 -14.859
8 HE22 GLN 111 HE22 GLN 111 11.336 0.898 -14.399
No H/Q in entry = 8
In of MODEL 3
1 H TYR 112 H TYR 112 5.709 -1.207 -12.309
2 HA TYR 112 HA TYR 112 5.330 -0.432 -9.567
3 HB2 TYR 112 HB2 TYR 112 3.934 -2.471 -11.304
4 HB3 TYR 112 HB3 TYR 112 3.490 -2.165 -9.627
5 HD1 TYR 112 HD1 TYR 112 3.392 0.591 -9.211
6 HD2 TYR 112 HD2 TYR 112 2.500 -1.512 -12.801
7 HE1 TYR 112 HE1 TYR 112 1.927 2.438 -9.931
8 HE2 TYR 112 HE2 TYR 112 1.047 0.328 -13.532
9 HH TYR 112 HH TYR 112 1.001 3.365 -11.978
No H/Q in entry = 9
In of MODEL 3
1 H ILE 113 H ILE 113 6.633 -3.202 -11.249
2 HA ILE 113 HA ILE 113 6.878 -4.936 -9.067
3 HB ILE 113 HB ILE 113 8.751 -4.686 -11.415
4 HG12 ILE 113 HG12 ILE 113 6.266 -6.362 -11.012
5 HG13 ILE 113 HG13 ILE 113 6.418 -4.980 -12.095
6 HG21 ILE 113 HG21 ILE 113 9.695 -5.996 -9.584
7 HG22 ILE 113 HG22 ILE 113 8.241 -6.993 -9.537
8 HG23 ILE 113 HG23 ILE 113 9.290 -7.027 -10.956
9 HD11 ILE 113 HD11 ILE 113 8.185 -6.224 -13.309
10 HD12 ILE 113 HD12 ILE 113 7.815 -7.620 -12.302
11 HD13 ILE 113 HD13 ILE 113 6.587 -6.959 -13.380
No H/Q in entry = 11
In of MODEL 3
1 H ALA 114 H ALA 114 9.169 -2.522 -10.349
2 HA ALA 114 HA ALA 114 11.179 -3.017 -8.360
3 HB1 ALA 114 HB1 ALA 114 11.818 -2.229 -10.555
4 HB2 ALA 114 HB2 ALA 114 12.283 -1.032 -9.346
5 HB3 ALA 114 HB3 ALA 114 10.853 -0.767 -10.349
No H/Q in entry = 5
In of MODEL 3
1 H ASP 115 H ASP 115 8.724 -0.552 -8.870
2 HA ASP 115 HA ASP 115 9.632 1.014 -6.649
3 HB2 ASP 115 HB2 ASP 115 7.163 1.217 -8.359
4 HB3 ASP 115 HB3 ASP 115 7.482 2.310 -7.017
No H/Q in entry = 4
In of MODEL 3
1 H PHE 116 H PHE 116 6.786 -1.008 -7.177
2 HA PHE 116 HA PHE 116 6.082 -0.559 -4.377
3 HB2 PHE 116 HB2 PHE 116 4.325 0.172 -5.788
4 HB3 PHE 116 HB3 PHE 116 4.439 -1.257 -6.804
5 HD1 PHE 116 HD1 PHE 116 3.586 -0.153 -3.395
6 HD2 PHE 116 HD2 PHE 116 3.009 -3.048 -6.453
7 HE1 PHE 116 HE1 PHE 116 1.779 -1.184 -2.073
8 HE2 PHE 116 HE2 PHE 116 1.210 -4.094 -5.140
9 HZ PHE 116 HZ PHE 116 0.567 -3.203 -3.017
No H/Q in entry = 9
In of MODEL 3
1 H GLY 117 H GLY 117 7.205 -2.979 -6.488
2 HA2 GLY 117 HA2 GLY 117 7.630 -5.218 -6.234
3 HA3 GLY 117 HA3 GLY 117 6.003 -5.306 -5.591
No H/Q in entry = 3
In of MODEL 3
1 HA PRO 118 HA PRO 118 9.752 -6.055 -2.462
2 HB2 PRO 118 HB2 PRO 118 10.241 -3.192 -1.806
3 HB3 PRO 118 HB3 PRO 118 11.382 -4.540 -1.890
4 HG2 PRO 118 HG2 PRO 118 11.275 -2.731 -3.841
5 HG3 PRO 118 HG3 PRO 118 11.533 -4.446 -4.199
6 HD2 PRO 118 HD2 PRO 118 9.088 -2.782 -4.542
7 HD3 PRO 118 HD3 PRO 118 9.683 -4.133 -5.526
No H/Q in entry = 7
In of MODEL 3
1 H ALA 119 H ALA 119 7.750 -3.161 -1.999
2 HA ALA 119 HA ALA 119 7.319 -3.729 0.810
3 HB1 ALA 119 HB1 ALA 119 7.489 -1.434 0.010
4 HB2 ALA 119 HB2 ALA 119 5.940 -1.752 0.790
5 HB3 ALA 119 HB3 ALA 119 6.041 -1.672 -0.968
No H/Q in entry = 5
In of MODEL 3
1 H CYS 120 H CYS 120 5.537 -4.116 -2.210
2 HA CYS 120 HA CYS 120 3.096 -4.980 -1.209
3 HB2 CYS 120 HB2 CYS 120 3.418 -4.695 -3.578
4 HB3 CYS 120 HB3 CYS 120 4.683 -5.917 -3.606
No H/Q in entry = 4
In of MODEL 3
1 H LYS 121 H LYS 121 6.212 -6.578 -1.266
2 HA LYS 121 HA LYS 121 5.376 -9.216 -0.768
3 HB2 LYS 121 HB2 LYS 121 7.918 -7.964 0.278
4 HB3 LYS 121 HB3 LYS 121 7.622 -9.663 -0.037
5 HG2 LYS 121 HG2 LYS 121 7.544 -7.632 -2.235
6 HG3 LYS 121 HG3 LYS 121 9.054 -8.348 -1.690
7 HD2 LYS 121 HD2 LYS 121 8.405 -9.660 -3.514
8 HD3 LYS 121 HD3 LYS 121 7.931 -10.606 -2.108
9 HE2 LYS 121 HE2 LYS 121 5.680 -10.229 -2.448
10 HE3 LYS 121 HE3 LYS 121 5.962 -8.749 -3.369
11 HZ1 LYS 121 HZ1 LYS 121 6.685 -11.462 -4.346
12 HZ2 LYS 121 HZ2 LYS 121 5.226 -10.685 -4.718
13 HZ3 LYS 121 HZ3 LYS 121 6.694 -10.013 -5.223
No H/Q in entry = 13
In of MODEL 3
1 H LYS 122 H LYS 122 6.464 -6.726 1.602
2 HA LYS 122 HA LYS 122 5.731 -8.259 3.869
3 HB2 LYS 122 HB2 LYS 122 5.939 -6.223 5.165
4 HB3 LYS 122 HB3 LYS 122 7.262 -6.326 4.020
5 HG2 LYS 122 HG2 LYS 122 6.009 -4.763 2.544
6 HG3 LYS 122 HG3 LYS 122 4.823 -4.582 3.833
7 HD2 LYS 122 HD2 LYS 122 7.757 -4.019 4.215
8 HD3 LYS 122 HD3 LYS 122 6.611 -2.794 3.683
9 HE2 LYS 122 HE2 LYS 122 6.780 -2.476 5.995
10 HE3 LYS 122 HE3 LYS 122 5.279 -3.369 5.784
11 HZ1 LYS 122 HZ1 LYS 122 7.864 -4.635 6.504
12 HZ2 LYS 122 HZ2 LYS 122 6.699 -4.162 7.631
13 HZ3 LYS 122 HZ3 LYS 122 6.338 -5.361 6.500
No H/Q in entry = 13
In of MODEL 3
1 H ILE 123 H ILE 123 3.931 -6.217 1.704
2 HA ILE 123 HA ILE 123 1.703 -5.753 3.350
3 HB ILE 123 HB ILE 123 2.004 -5.711 0.377
4 HG12 ILE 123 HG12 ILE 123 1.585 -3.562 2.461
5 HG13 ILE 123 HG13 ILE 123 3.131 -3.975 1.725
6 HG21 ILE 123 HG21 ILE 123 -0.438 -5.060 2.019
7 HG22 ILE 123 HG22 ILE 123 -0.224 -4.630 0.320
8 HG23 ILE 123 HG23 ILE 123 -0.289 -6.325 0.799
9 HD11 ILE 123 HD11 ILE 123 0.736 -2.944 0.251
10 HD12 ILE 123 HD12 ILE 123 2.114 -1.976 0.762
11 HD13 ILE 123 HD13 ILE 123 2.331 -3.262 -0.424
No H/Q in entry = 11
In of MODEL 3
1 H TYR 124 H TYR 124 2.228 -8.087 0.822
2 HA TYR 124 HA TYR 124 -0.035 -9.741 1.459
3 HB2 TYR 124 HB2 TYR 124 1.959 -9.593 -0.661
4 HB3 TYR 124 HB3 TYR 124 1.639 -11.250 -0.150
5 HD1 TYR 124 HD1 TYR 124 -0.628 -12.188 -0.329
6 HD2 TYR 124 HD2 TYR 124 0.301 -8.322 -1.838
7 HE1 TYR 124 HE1 TYR 124 -2.705 -12.213 -1.643
8 HE2 TYR 124 HE2 TYR 124 -1.780 -8.333 -3.158
9 HH TYR 124 HH TYR 124 -3.345 -9.985 -4.110
No H/Q in entry = 9
In of MODEL 3
1 H GLY 125 H GLY 125 1.631 -9.385 3.662
2 HA2 GLY 125 HA2 GLY 125 3.121 -10.403 5.183
3 HA3 GLY 125 HA3 GLY 125 4.145 -9.797 3.915
No H/Q in entry = 3
In of MODEL 3
1 H VAL 126 H VAL 126 3.206 -12.040 2.128
2 HA VAL 126 HA VAL 126 4.160 -14.499 2.928
3 HB VAL 126 HB VAL 126 4.903 -14.808 0.553
4 HG11 VAL 126 HG11 VAL 126 2.172 -13.605 0.976
5 HG12 VAL 126 HG12 VAL 126 2.656 -14.540 -0.437
6 HG13 VAL 126 HG13 VAL 126 2.618 -15.303 1.151
7 HG21 VAL 126 HG21 VAL 126 4.043 -11.926 0.287
8 HG22 VAL 126 HG22 VAL 126 5.679 -12.556 0.088
9 HG23 VAL 126 HG23 VAL 126 4.415 -13.009 -1.056
No H/Q in entry = 9
In of MODEL 3
1 H HIS 127 H HIS 127 5.913 -11.559 2.493
2 HA HIS 127 HA HIS 127 8.514 -12.558 2.080
3 HB2 HIS 127 HB2 HIS 127 7.886 -10.201 1.724
4 HB3 HIS 127 HB3 HIS 127 7.647 -10.001 3.452
5 HD1 HIS 127 HD1 HIS 127 9.623 -9.238 4.762
6 HD2 HIS 127 HD2 HIS 127 10.688 -10.723 1.027
7 HE1 HIS 127 HE1 HIS 127 12.084 -8.785 4.527
8 HE2 HIS 127 HE2 HIS 127 12.691 -9.619 2.231
No H/Q in entry = 8
In of MODEL 3
1 H THR 128 H THR 128 6.481 -12.646 4.778
2 HA THR 128 HA THR 128 6.698 -13.386 6.909
3 HB THR 128 HB THR 128 9.515 -14.279 6.343
4 HG1 THR 128 HG1 THR 128 7.216 -15.042 5.026
5 HG21 THR 128 HG21 THR 128 8.584 -14.605 8.596
6 HG22 THR 128 HG22 THR 128 7.243 -15.516 7.902
7 HG23 THR 128 HG23 THR 128 8.887 -16.143 7.788
No H/Q in entry = 7
In of MODEL 3
1 H SER 129 H SER 129 7.069 -10.761 6.573
2 HA SER 129 HA SER 129 9.553 -9.829 7.665
3 HB2 SER 129 HB2 SER 129 6.952 -8.346 7.212
4 HB3 SER 129 HB3 SER 129 8.525 -7.614 7.521
5 HG SER 129 HG SER 129 8.546 -7.595 5.397
No H/Q in entry = 5
In of MODEL 4
1 HA2 GLY -4 HA2 GLY -4 -14.504 17.933 -14.523
2 HA3 GLY -4 HA3 GLY -4 -13.563 18.324 -15.955
3 H1 GLY -4 H1 GLY -4 -15.758 17.569 -16.553
4 H2 GLY -4 H2 GLY -4 -15.530 16.119 -15.714
No H/Q in entry = 4
In of MODEL 4
1 H SER -3 H SER -3 -11.587 18.005 -14.945
2 HA SER -3 HA SER -3 -9.718 16.844 -14.398
3 HB2 SER -3 HB2 SER -3 -11.651 14.926 -13.067
4 HB3 SER -3 HB3 SER -3 -9.929 15.081 -12.722
5 HG SER -3 HG SER -3 -11.947 16.434 -11.651
No H/Q in entry = 5
In of MODEL 4
1 HA PRO -2 HA PRO -2 -10.502 13.913 -17.893
2 HB2 PRO -2 HB2 PRO -2 -8.743 14.934 -19.638
3 HB3 PRO -2 HB3 PRO -2 -10.347 15.641 -19.405
4 HG2 PRO -2 HG2 PRO -2 -7.711 16.526 -18.319
5 HG3 PRO -2 HG3 PRO -2 -9.034 17.502 -18.977
6 HD2 PRO -2 HD2 PRO -2 -8.578 17.137 -16.296
7 HD3 PRO -2 HD3 PRO -2 -10.167 17.517 -16.990
No H/Q in entry = 7
In of MODEL 4
1 H GLU -1 H GLU -1 -9.170 12.277 -18.790
2 HA GLU -1 HA GLU -1 -7.654 10.616 -18.652
3 HB2 GLU -1 HB2 GLU -1 -5.862 13.016 -18.359
4 HB3 GLU -1 HB3 GLU -1 -5.232 11.378 -18.459
5 HG2 GLU -1 HG2 GLU -1 -6.911 12.767 -20.538
6 HG3 GLU -1 HG3 GLU -1 -5.177 12.456 -20.627
No H/Q in entry = 6
In of MODEL 4
1 H PHE 0 H PHE 0 -8.809 10.057 -16.648
2 HA PHE 0 HA PHE 0 -7.581 10.536 -14.128
3 HB2 PHE 0 HB2 PHE 0 -9.926 9.895 -14.232
4 HB3 PHE 0 HB3 PHE 0 -9.509 8.377 -15.018
5 HD1 PHE 0 HD1 PHE 0 -8.631 10.266 -11.916
6 HD2 PHE 0 HD2 PHE 0 -9.487 6.499 -13.702
7 HE1 PHE 0 HE1 PHE 0 -8.457 9.186 -9.714
8 HE2 PHE 0 HE2 PHE 0 -9.318 5.413 -11.501
9 HZ PHE 0 HZ PHE 0 -8.783 6.745 -9.510
No H/Q in entry = 9
In of MODEL 4
1 H HIS 1 H HIS 1 -5.530 9.963 -13.887
2 HA HIS 1 HA HIS 1 -4.419 7.595 -15.056
3 HB2 HIS 1 HB2 HIS 1 -3.318 9.527 -13.004
4 HB3 HIS 1 HB3 HIS 1 -2.399 8.201 -13.707
5 HD1 HIS 1 HD1 HIS 1 -3.566 11.645 -14.383
6 HD2 HIS 1 HD2 HIS 1 -1.783 8.528 -16.476
7 HE1 HIS 1 HE1 HIS 1 -2.716 12.661 -16.519
8 HE2 HIS 1 HE2 HIS 1 -1.561 10.778 -17.729
No H/Q in entry = 8
In of MODEL 4
1 H HIS 2 H HIS 2 -3.961 5.667 -14.082
2 HA HIS 2 HA HIS 2 -5.619 5.113 -11.761
3 HB2 HIS 2 HB2 HIS 2 -4.065 3.247 -13.564
4 HB3 HIS 2 HB3 HIS 2 -5.141 2.738 -12.269
5 HD1 HIS 2 HD1 HIS 2 -5.371 2.284 -15.503
6 HD2 HIS 2 HD2 HIS 2 -7.654 4.773 -13.077
7 HE1 HIS 2 HE1 HIS 2 -7.530 2.642 -16.740
8 HE2 HIS 2 HE2 HIS 2 -8.959 3.984 -15.164
No H/Q in entry = 8
In of MODEL 4
1 H PHE 3 H PHE 3 -4.868 3.945 -9.947
2 HA PHE 3 HA PHE 3 -3.492 3.517 -8.199
3 HB2 PHE 3 HB2 PHE 3 -1.205 3.285 -10.148
4 HB3 PHE 3 HB3 PHE 3 -1.457 2.405 -8.645
5 HD1 PHE 3 HD1 PHE 3 -4.168 1.388 -8.903
6 HD2 PHE 3 HD2 PHE 3 -1.108 1.741 -11.837
7 HE1 PHE 3 HE1 PHE 3 -5.185 -0.451 -10.182
8 HE2 PHE 3 HE2 PHE 3 -2.117 -0.097 -13.118
9 HZ PHE 3 HZ PHE 3 -4.158 -1.195 -12.295
No H/Q in entry = 9
In of MODEL 4
1 H THR 4 H THR 4 -3.911 5.963 -7.957
2 HA THR 4 HA THR 4 -1.331 7.370 -8.027
3 HB THR 4 HB THR 4 -2.561 9.502 -8.224
4 HG1 THR 4 HG1 THR 4 -4.722 7.819 -7.881
5 HG21 THR 4 HG21 THR 4 -1.735 8.396 -10.238
6 HG22 THR 4 HG22 THR 4 -3.255 7.514 -10.385
7 HG23 THR 4 HG23 THR 4 -3.232 9.271 -10.558
No H/Q in entry = 7
In of MODEL 4
1 H LEU 5 H LEU 5 -2.997 9.546 -6.447
2 HA LEU 5 HA LEU 5 -2.109 8.312 -3.947
3 HB2 LEU 5 HB2 LEU 5 -1.899 11.184 -4.796
4 HB3 LEU 5 HB3 LEU 5 -1.777 10.685 -3.122
5 HG LEU 5 HG LEU 5 0.099 10.027 -5.383
6 HD11 LEU 5 HD11 LEU 5 0.387 12.183 -4.275
7 HD12 LEU 5 HD12 LEU 5 0.499 11.367 -2.717
8 HD13 LEU 5 HD13 LEU 5 1.737 11.094 -3.945
9 HD21 LEU 5 HD21 LEU 5 0.009 8.838 -2.609
10 HD22 LEU 5 HD22 LEU 5 -0.186 7.978 -4.137
11 HD23 LEU 5 HD23 LEU 5 1.368 8.696 -3.723
No H/Q in entry = 11
In of MODEL 4
1 H GLU 6 H GLU 6 -3.944 11.170 -4.794
2 HA GLU 6 HA GLU 6 -5.964 11.095 -2.939
3 HB2 GLU 6 HB2 GLU 6 -6.197 11.908 -5.842
4 HB3 GLU 6 HB3 GLU 6 -7.304 12.374 -4.559
5 HG2 GLU 6 HG2 GLU 6 -5.617 13.662 -3.471
6 HG3 GLU 6 HG3 GLU 6 -4.374 13.047 -4.559
No H/Q in entry = 6
In of MODEL 4
1 H SER 7 H SER 7 -5.724 9.188 -5.939
2 HA SER 7 HA SER 7 -8.358 8.329 -6.092
3 HB2 SER 7 HB2 SER 7 -7.467 6.374 -7.345
4 HB3 SER 7 HB3 SER 7 -6.807 7.914 -7.896
5 HG SER 7 HG SER 7 -5.568 5.805 -6.552
No H/Q in entry = 5
In of MODEL 4
1 H SER 8 H SER 8 -6.006 7.492 -3.713
2 HA SER 8 HA SER 8 -7.493 5.101 -2.999
3 HB2 SER 8 HB2 SER 8 -4.937 6.091 -1.763
4 HB3 SER 8 HB3 SER 8 -5.678 4.491 -1.593
5 HG SER 8 HG SER 8 -4.385 5.641 -3.831
No H/Q in entry = 5
In of MODEL 4
1 H LEU 9 H LEU 9 -7.430 8.394 -1.974
2 HA LEU 9 HA LEU 9 -7.075 8.041 0.759
3 HB2 LEU 9 HB2 LEU 9 -8.463 10.253 -0.704
4 HB3 LEU 9 HB3 LEU 9 -7.887 10.327 0.953
5 HG LEU 9 HG LEU 9 -6.094 9.798 -1.405
6 HD11 LEU 9 HD11 LEU 9 -6.674 12.378 0.020
7 HD12 LEU 9 HD12 LEU 9 -5.424 12.128 -1.201
8 HD13 LEU 9 HD13 LEU 9 -7.126 11.952 -1.630
9 HD21 LEU 9 HD21 LEU 9 -5.505 10.577 1.451
10 HD22 LEU 9 HD22 LEU 9 -5.231 8.990 0.725
11 HD23 LEU 9 HD23 LEU 9 -4.313 10.391 0.168
No H/Q in entry = 11
In of MODEL 4
1 H ASP 10 H ASP 10 -10.034 7.942 -1.032
2 HA ASP 10 HA ASP 10 -11.563 7.579 1.437
3 HB2 ASP 10 HB2 ASP 10 -12.294 8.975 -0.651
4 HB3 ASP 10 HB3 ASP 10 -12.705 7.415 -1.339
No H/Q in entry = 4
In of MODEL 4
1 H THR 11 H THR 11 -9.736 5.695 -0.491
2 HA THR 11 HA THR 11 -11.561 3.425 -0.251
3 HB THR 11 HB THR 11 -10.644 2.564 -2.404
4 HG1 THR 11 HG1 THR 11 -9.835 4.965 -3.366
5 HG21 THR 11 HG21 THR 11 -12.014 5.258 -2.454
6 HG22 THR 11 HG22 THR 11 -11.919 4.151 -3.829
7 HG23 THR 11 HG23 THR 11 -12.795 3.675 -2.374
No H/Q in entry = 7
In of MODEL 4
1 H HIS 12 H HIS 12 -8.434 3.074 -1.733
2 HA HIS 12 HA HIS 12 -7.704 1.023 0.011
3 HB2 HIS 12 HB2 HIS 12 -5.834 2.615 -1.748
4 HB3 HIS 12 HB3 HIS 12 -5.517 1.025 -1.082
5 HD1 HIS 12 HD1 HIS 12 -5.434 1.520 -4.130
6 HD2 HIS 12 HD2 HIS 12 -8.777 0.210 -2.061
7 HE1 HIS 12 HE1 HIS 12 -6.833 0.289 -5.822
8 HE2 HIS 12 HE2 HIS 12 -8.748 -0.676 -4.493
No H/Q in entry = 8
In of MODEL 4
1 H LEU 13 H LEU 13 -6.895 4.469 0.124
2 HA LEU 13 HA LEU 13 -5.121 3.882 2.405
3 HB2 LEU 13 HB2 LEU 13 -5.001 5.902 0.250
4 HB3 LEU 13 HB3 LEU 13 -4.429 6.383 1.834
5 HG LEU 13 HG LEU 13 -2.544 5.638 0.561
6 HD11 LEU 13 HD11 LEU 13 -2.661 4.989 2.956
7 HD12 LEU 13 HD12 LEU 13 -3.266 3.412 2.457
8 HD13 LEU 13 HD13 LEU 13 -1.653 3.929 1.974
9 HD21 LEU 13 HD21 LEU 13 -4.076 3.086 0.090
10 HD22 LEU 13 HD22 LEU 13 -3.655 4.300 -1.116
11 HD23 LEU 13 HD23 LEU 13 -2.388 3.354 -0.338
No H/Q in entry = 11
In of MODEL 4
1 H LYS 14 H LYS 14 -8.025 4.238 2.404
2 HA LYS 14 HA LYS 14 -8.769 6.783 3.355
3 HB2 LYS 14 HB2 LYS 14 -10.886 5.795 3.880
4 HB3 LYS 14 HB3 LYS 14 -10.319 5.107 2.370
5 HG2 LYS 14 HG2 LYS 14 -9.493 3.140 3.700
6 HG3 LYS 14 HG3 LYS 14 -10.348 3.818 5.084
7 HD2 LYS 14 HD2 LYS 14 -11.573 2.991 2.454
8 HD3 LYS 14 HD3 LYS 14 -11.713 2.132 3.988
9 HE2 LYS 14 HE2 LYS 14 -12.742 4.910 3.425
10 HE3 LYS 14 HE3 LYS 14 -13.718 3.446 3.474
11 HZ1 LYS 14 HZ1 LYS 14 -13.056 3.169 5.807
12 HZ2 LYS 14 HZ2 LYS 14 -12.220 4.638 5.742
13 HZ3 LYS 14 HZ3 LYS 14 -13.895 4.612 5.548
No H/Q in entry = 13
In of MODEL 4
1 H TRP 15 H TRP 15 -7.292 4.121 4.947
2 HA TRP 15 HA TRP 15 -8.238 4.706 7.573
3 HB2 TRP 15 HB2 TRP 15 -6.479 3.095 8.294
4 HB3 TRP 15 HB3 TRP 15 -7.541 2.451 7.049
5 HD1 TRP 15 HD1 TRP 15 -6.505 2.130 4.599
6 HE1 TRP 15 HE1 TRP 15 -4.076 1.863 3.796
7 HE3 TRP 15 HE3 TRP 15 -4.081 3.825 8.768
8 HZ2 TRP 15 HZ2 TRP 15 -1.473 2.313 4.803
9 HZ3 TRP 15 HZ3 TRP 15 -1.622 3.872 8.768
10 HH2 TRP 15 HH2 TRP 15 -0.346 3.132 6.825
No H/Q in entry = 10
In of MODEL 4
1 H LEU 16 H LEU 16 -6.084 6.280 5.565
2 HA LEU 16 HA LEU 16 -4.239 7.212 7.561
3 HB2 LEU 16 HB2 LEU 16 -4.943 8.298 4.826
4 HB3 LEU 16 HB3 LEU 16 -3.681 8.954 5.847
5 HG LEU 16 HG LEU 16 -3.672 6.134 4.754
6 HD11 LEU 16 HD11 LEU 16 -3.536 7.840 2.979
7 HD12 LEU 16 HD12 LEU 16 -2.142 8.550 3.797
8 HD13 LEU 16 HD13 LEU 16 -2.048 6.910 3.150
9 HD21 LEU 16 HD21 LEU 16 -1.552 7.785 6.133
10 HD22 LEU 16 HD22 LEU 16 -2.336 6.333 6.760
11 HD23 LEU 16 HD23 LEU 16 -1.269 6.225 5.358
No H/Q in entry = 11
In of MODEL 4
1 H SER 17 H SER 17 -4.306 9.076 8.685
2 HA SER 17 HA SER 17 -6.884 10.192 9.222
3 HB2 SER 17 HB2 SER 17 -4.199 11.262 10.095
4 HB3 SER 17 HB3 SER 17 -5.761 11.558 10.859
5 HG SER 17 HG SER 17 -4.314 9.860 11.785
No H/Q in entry = 5
In of MODEL 4
1 H GLN 18 H GLN 18 -7.343 12.624 9.056
2 HA GLN 18 HA GLN 18 -6.974 13.484 6.410
3 HB2 GLN 18 HB2 GLN 18 -7.711 15.052 8.885
4 HB3 GLN 18 HB3 GLN 18 -7.672 15.765 7.279
5 HG2 GLN 18 HG2 GLN 18 -9.419 13.491 8.185
6 HG3 GLN 18 HG3 GLN 18 -9.929 15.148 7.863
7 HE21 GLN 18 HE21 GLN 18 -10.040 15.872 5.729
8 HE22 GLN 18 HE22 GLN 18 -10.070 14.776 4.391
No H/Q in entry = 8
In of MODEL 4
1 H GLU 19 H GLU 19 -5.283 14.392 9.369
2 HA GLU 19 HA GLU 19 -3.494 16.202 8.255
3 HB2 GLU 19 HB2 GLU 19 -3.380 14.380 10.645
4 HB3 GLU 19 HB3 GLU 19 -2.070 15.461 10.244
5 HG2 GLU 19 HG2 GLU 19 -4.893 16.243 10.871
6 HG3 GLU 19 HG3 GLU 19 -3.480 16.483 11.898
No H/Q in entry = 6
In of MODEL 4
1 H GLN 20 H GLN 20 -3.491 12.686 8.320
2 HA GLN 20 HA GLN 20 -0.830 12.443 7.301
3 HB2 GLN 20 HB2 GLN 20 -3.112 10.473 7.442
4 HB3 GLN 20 HB3 GLN 20 -1.521 10.069 6.813
5 HG2 GLN 20 HG2 GLN 20 -0.532 10.635 8.979
6 HG3 GLN 20 HG3 GLN 20 -2.136 11.007 9.606
7 HE21 GLN 20 HE21 GLN 20 -0.188 9.013 10.482
8 HE22 GLN 20 HE22 GLN 20 -0.992 7.483 10.386
No H/Q in entry = 8
In of MODEL 4
1 H LYS 21 H LYS 21 -4.092 12.289 5.846
2 HA LYS 21 HA LYS 21 -3.304 11.824 3.209
3 HB2 LYS 21 HB2 LYS 21 -5.592 13.560 4.168
4 HB3 LYS 21 HB3 LYS 21 -5.409 12.931 2.538
5 HG2 LYS 21 HG2 LYS 21 -5.505 10.621 3.537
6 HG3 LYS 21 HG3 LYS 21 -5.965 11.389 5.059
7 HD2 LYS 21 HD2 LYS 21 -7.896 12.415 3.962
8 HD3 LYS 21 HD3 LYS 21 -7.431 11.670 2.435
9 HE2 LYS 21 HE2 LYS 21 -9.137 10.305 3.304
10 HE3 LYS 21 HE3 LYS 21 -7.636 9.439 3.623
11 HZ1 LYS 21 HZ1 LYS 21 -8.947 11.179 5.633
12 HZ2 LYS 21 HZ2 LYS 21 -9.273 9.526 5.503
13 HZ3 LYS 21 HZ3 LYS 21 -7.710 10.048 5.887
No H/Q in entry = 13
In of MODEL 4
1 H ASP 22 H ASP 22 -3.784 14.891 4.899
2 HA ASP 22 HA ASP 22 -2.879 16.602 2.852
3 HB2 ASP 22 HB2 ASP 22 -4.172 17.405 4.763
4 HB3 ASP 22 HB3 ASP 22 -2.870 16.959 5.856
No H/Q in entry = 4
In of MODEL 4
1 H GLU 23 H GLU 23 -1.111 14.833 5.388
2 HA GLU 23 HA GLU 23 1.420 15.956 4.937
3 HB2 GLU 23 HB2 GLU 23 0.704 14.492 6.834
4 HB3 GLU 23 HB3 GLU 23 0.700 13.134 5.724
5 HG2 GLU 23 HG2 GLU 23 2.712 13.083 6.944
6 HG3 GLU 23 HG3 GLU 23 3.079 13.556 5.290
No H/Q in entry = 6
In of MODEL 4
1 H LEU 24 H LEU 24 -0.102 13.014 3.580
2 HA LEU 24 HA LEU 24 2.080 12.298 1.946
3 HB2 LEU 24 HB2 LEU 24 -0.832 11.576 1.997
4 HB3 LEU 24 HB3 LEU 24 0.223 10.956 0.747
5 HG LEU 24 HG LEU 24 -0.255 9.477 2.787
6 HD11 LEU 24 HD11 LEU 24 2.572 9.997 1.914
7 HD12 LEU 24 HD12 LEU 24 2.029 8.579 2.817
8 HD13 LEU 24 HD13 LEU 24 1.424 8.871 1.186
9 HD21 LEU 24 HD21 LEU 24 1.483 11.544 4.012
10 HD22 LEU 24 HD22 LEU 24 0.076 10.710 4.674
11 HD23 LEU 24 HD23 LEU 24 1.617 9.865 4.523
No H/Q in entry = 11
In of MODEL 4
1 H LEU 25 H LEU 25 -0.904 14.113 1.250
2 HA LEU 25 HA LEU 25 -0.450 14.447 -1.509
3 HB2 LEU 25 HB2 LEU 25 -1.978 16.164 0.447
4 HB3 LEU 25 HB3 LEU 25 -2.028 16.363 -1.291
5 HG LEU 25 HG LEU 25 -2.937 13.904 0.207
6 HD11 LEU 25 HD11 LEU 25 -4.412 15.821 0.560
7 HD12 LEU 25 HD12 LEU 25 -4.537 16.042 -1.187
8 HD13 LEU 25 HD13 LEU 25 -5.182 14.585 -0.435
9 HD21 LEU 25 HD21 LEU 25 -3.055 14.605 -2.722
10 HD22 LEU 25 HD22 LEU 25 -2.087 13.329 -1.984
11 HD23 LEU 25 HD23 LEU 25 -3.846 13.217 -1.976
No H/Q in entry = 11
In of MODEL 4
1 H LYS 26 H LYS 26 0.615 16.214 1.303
2 HA LYS 26 HA LYS 26 1.682 18.510 0.065
3 HB2 LYS 26 HB2 LYS 26 1.263 17.947 2.558
4 HB3 LYS 26 HB3 LYS 26 2.851 17.198 2.499
5 HG2 LYS 26 HG2 LYS 26 3.797 19.358 1.771
6 HG3 LYS 26 HG3 LYS 26 2.200 20.084 1.972
7 HD2 LYS 26 HD2 LYS 26 3.941 18.845 4.093
8 HD3 LYS 26 HD3 LYS 26 3.448 20.533 3.959
9 HE2 LYS 26 HE2 LYS 26 1.653 18.176 4.531
10 HE3 LYS 26 HE3 LYS 26 2.171 19.396 5.689
11 HZ1 LYS 26 HZ1 LYS 26 0.530 19.946 3.276
12 HZ2 LYS 26 HZ2 LYS 26 -0.085 19.769 4.842
13 HZ3 LYS 26 HZ3 LYS 26 0.956 21.055 4.480
No H/Q in entry = 13
In of MODEL 4
1 H MET 27 H MET 27 3.113 15.431 0.997
2 HA MET 27 HA MET 27 5.665 15.698 0.156
3 HB2 MET 27 HB2 MET 27 3.888 13.282 -0.162
4 HB3 MET 27 HB3 MET 27 5.643 13.253 -0.249
5 HG2 MET 27 HG2 MET 27 4.300 14.364 2.165
6 HG3 MET 27 HG3 MET 27 4.431 12.624 1.946
7 HE1 MET 27 HE1 MET 27 6.573 11.266 1.977
8 HE2 MET 27 HE2 MET 27 7.182 12.144 0.574
9 HE3 MET 27 HE3 MET 27 8.203 11.940 1.997
No H/Q in entry = 9
In of MODEL 4
1 H LYS 28 H LYS 28 3.005 14.485 -1.879
2 HA LYS 28 HA LYS 28 4.475 14.198 -4.258
3 HB2 LYS 28 HB2 LYS 28 2.147 13.306 -3.651
4 HB3 LYS 28 HB3 LYS 28 1.550 14.873 -4.176
5 HG2 LYS 28 HG2 LYS 28 3.274 13.194 -5.964
6 HG3 LYS 28 HG3 LYS 28 1.536 12.927 -5.851
7 HD2 LYS 28 HD2 LYS 28 1.080 15.148 -6.625
8 HD3 LYS 28 HD3 LYS 28 2.789 15.581 -6.536
9 HE2 LYS 28 HE2 LYS 28 1.633 13.463 -8.347
10 HE3 LYS 28 HE3 LYS 28 2.016 15.111 -8.842
11 HZ1 LYS 28 HZ1 LYS 28 3.973 13.149 -7.774
12 HZ2 LYS 28 HZ2 LYS 28 3.781 13.541 -9.407
13 HZ3 LYS 28 HZ3 LYS 28 4.327 14.712 -8.316
No H/Q in entry = 13
In of MODEL 4
1 H LYS 29 H LYS 29 2.610 16.927 -2.997
2 HA LYS 29 HA LYS 29 2.883 18.475 -5.371
3 HB2 LYS 29 HB2 LYS 29 2.061 19.288 -2.584
4 HB3 LYS 29 HB3 LYS 29 1.963 20.333 -3.995
5 HG2 LYS 29 HG2 LYS 29 0.487 17.733 -3.615
6 HG3 LYS 29 HG3 LYS 29 -0.199 19.351 -3.463
7 HD2 LYS 29 HD2 LYS 29 0.310 19.781 -5.823
8 HD3 LYS 29 HD3 LYS 29 0.991 18.160 -5.970
9 HE2 LYS 29 HE2 LYS 29 -1.188 17.197 -5.407
10 HE3 LYS 29 HE3 LYS 29 -1.867 18.818 -5.263
11 HZ1 LYS 29 HZ1 LYS 29 -1.372 19.185 -7.603
12 HZ2 LYS 29 HZ2 LYS 29 -0.734 17.627 -7.737
13 HZ3 LYS 29 HZ3 LYS 29 -2.376 17.841 -7.406
No H/Q in entry = 13
In of MODEL 4
1 H ASP 30 H ASP 30 4.936 17.986 -2.657
2 HA ASP 30 HA ASP 30 6.435 20.410 -3.265
3 HB2 ASP 30 HB2 ASP 30 6.136 20.002 -0.905
4 HB3 ASP 30 HB3 ASP 30 6.710 18.347 -1.064
No H/Q in entry = 4
In of MODEL 4
1 H GLY 31 H GLY 31 6.305 17.280 -4.262
2 HA2 GLY 31 HA2 GLY 31 8.823 17.661 -5.675
3 HA3 GLY 31 HA3 GLY 31 7.548 16.535 -6.109
No H/Q in entry = 3
In of MODEL 4
1 H LYS 32 H LYS 32 7.533 15.690 -3.166
2 HA LYS 32 HA LYS 32 9.943 14.250 -2.785
3 HB2 LYS 32 HB2 LYS 32 7.153 13.581 -1.810
4 HB3 LYS 32 HB3 LYS 32 8.647 12.887 -1.205
5 HG2 LYS 32 HG2 LYS 32 7.860 15.785 -0.983
6 HG3 LYS 32 HG3 LYS 32 7.724 14.581 0.298
7 HD2 LYS 32 HD2 LYS 32 10.242 14.231 -0.033
8 HD3 LYS 32 HD3 LYS 32 10.200 15.750 -0.929
9 HE2 LYS 32 HE2 LYS 32 9.350 15.327 1.933
10 HE3 LYS 32 HE3 LYS 32 10.804 16.157 1.388
11 HZ1 LYS 32 HZ1 LYS 32 9.358 17.817 0.306
12 HZ2 LYS 32 HZ2 LYS 32 8.003 17.031 0.945
13 HZ3 LYS 32 HZ3 LYS 32 9.123 17.747 1.983
No H/Q in entry = 13
In of MODEL 4
1 H ALA 33 H ALA 33 10.375 12.126 -3.302
2 HA ALA 33 HA ALA 33 9.323 11.255 -5.825
3 HB1 ALA 33 HB1 ALA 33 11.698 10.979 -5.274
4 HB2 ALA 33 HB2 ALA 33 11.261 9.866 -3.975
5 HB3 ALA 33 HB3 ALA 33 10.937 9.433 -5.654
No H/Q in entry = 5
In of MODEL 4
1 H LYS 34 H LYS 34 8.306 9.178 -6.241
2 HA LYS 34 HA LYS 34 6.205 8.541 -4.527
3 HB2 LYS 34 HB2 LYS 34 7.528 6.625 -6.465
4 HB3 LYS 34 HB3 LYS 34 5.882 6.526 -5.856
5 HG2 LYS 34 HG2 LYS 34 5.298 8.562 -7.034
6 HG3 LYS 34 HG3 LYS 34 6.960 8.725 -7.603
7 HD2 LYS 34 HD2 LYS 34 6.696 6.484 -8.706
8 HD3 LYS 34 HD3 LYS 34 4.980 6.562 -8.298
9 HE2 LYS 34 HE2 LYS 34 5.345 7.313 -10.578
10 HE3 LYS 34 HE3 LYS 34 4.783 8.646 -9.572
11 HZ1 LYS 34 HZ1 LYS 34 7.610 8.145 -10.332
12 HZ2 LYS 34 HZ2 LYS 34 6.602 9.315 -11.021
13 HZ3 LYS 34 HZ3 LYS 34 7.052 9.440 -9.395
No H/Q in entry = 13
In of MODEL 4
1 H LYS 35 H LYS 35 9.456 7.271 -4.716
2 HA LYS 35 HA LYS 35 9.294 5.092 -3.001
3 HB2 LYS 35 HB2 LYS 35 11.488 7.027 -3.666
4 HB3 LYS 35 HB3 LYS 35 11.740 5.804 -2.435
5 HG2 LYS 35 HG2 LYS 35 12.634 5.079 -4.559
6 HG3 LYS 35 HG3 LYS 35 11.287 4.052 -4.077
7 HD2 LYS 35 HD2 LYS 35 9.822 5.146 -5.639
8 HD3 LYS 35 HD3 LYS 35 11.055 6.350 -6.020
9 HE2 LYS 35 HE2 LYS 35 12.430 4.724 -7.080
10 HE3 LYS 35 HE3 LYS 35 11.436 3.399 -6.483
11 HZ1 LYS 35 HZ1 LYS 35 10.472 5.471 -8.374
12 HZ2 LYS 35 HZ2 LYS 35 11.058 3.958 -8.849
13 HZ3 LYS 35 HZ3 LYS 35 9.655 4.061 -7.899
No H/Q in entry = 13
In of MODEL 4
1 H GLU 36 H GLU 36 9.080 8.485 -2.278
2 HA GLU 36 HA GLU 36 9.795 8.133 0.513
3 HB2 GLU 36 HB2 GLU 36 8.854 10.624 -0.909
4 HB3 GLU 36 HB3 GLU 36 9.621 10.536 0.670
5 HG2 GLU 36 HG2 GLU 36 11.633 9.583 -0.454
6 HG3 GLU 36 HG3 GLU 36 10.853 9.911 -1.989
No H/Q in entry = 6
In of MODEL 4
1 H LEU 37 H LEU 37 7.027 8.643 -1.531
2 HA LEU 37 HA LEU 37 5.068 8.842 0.477
3 HB2 LEU 37 HB2 LEU 37 5.066 7.899 -2.385
4 HB3 LEU 37 HB3 LEU 37 3.604 7.996 -1.427
5 HG LEU 37 HG LEU 37 4.052 9.891 -3.002
6 HD11 LEU 37 HD11 LEU 37 2.445 10.029 -1.182
7 HD12 LEU 37 HD12 LEU 37 3.734 10.540 -0.093
8 HD13 LEU 37 HD13 LEU 37 3.247 11.580 -1.432
9 HD21 LEU 37 HD21 LEU 37 6.104 10.676 -0.966
10 HD22 LEU 37 HD22 LEU 37 6.411 10.241 -2.648
11 HD23 LEU 37 HD23 LEU 37 5.500 11.702 -2.267
No H/Q in entry = 11
In of MODEL 4
1 H GLU 38 H GLU 38 6.375 6.175 -1.401
2 HA GLU 38 HA GLU 38 4.920 4.033 -0.370
3 HB2 GLU 38 HB2 GLU 38 6.376 3.913 -2.339
4 HB3 GLU 38 HB3 GLU 38 7.787 4.162 -1.325
5 HG2 GLU 38 HG2 GLU 38 7.042 2.010 -0.132
6 HG3 GLU 38 HG3 GLU 38 6.042 1.750 -1.562
No H/Q in entry = 6
In of MODEL 4
1 H ALA 39 H ALA 39 7.433 5.924 1.001
2 HA ALA 39 HA ALA 39 8.123 3.954 3.023
3 HB1 ALA 39 HB1 ALA 39 9.196 6.739 2.609
4 HB2 ALA 39 HB2 ALA 39 9.853 5.508 3.687
5 HB3 ALA 39 HB3 ALA 39 9.891 5.261 1.942
No H/Q in entry = 5
In of MODEL 4
1 H LYS 40 H LYS 40 6.693 7.168 2.837
2 HA LYS 40 HA LYS 40 6.228 7.645 5.524
3 HB2 LYS 40 HB2 LYS 40 5.919 9.252 3.637
4 HB3 LYS 40 HB3 LYS 40 4.439 8.407 3.208
5 HG2 LYS 40 HG2 LYS 40 3.868 10.358 4.454
6 HG3 LYS 40 HG3 LYS 40 3.544 8.943 5.456
7 HD2 LYS 40 HD2 LYS 40 4.596 10.515 6.866
8 HD3 LYS 40 HD3 LYS 40 5.819 9.309 6.489
9 HE2 LYS 40 HE2 LYS 40 6.741 10.788 4.766
10 HE3 LYS 40 HE3 LYS 40 5.522 11.999 5.160
11 HZ1 LYS 40 HZ1 LYS 40 6.456 12.088 7.418
12 HZ2 LYS 40 HZ2 LYS 40 7.670 11.008 6.953
13 HZ3 LYS 40 HZ3 LYS 40 7.579 12.536 6.239
No H/Q in entry = 13
In of MODEL 4
1 H ILE 41 H ILE 41 4.055 6.059 3.154
2 HA ILE 41 HA ILE 41 1.978 5.554 4.991
3 HB ILE 41 HB ILE 41 2.680 4.132 2.421
4 HG12 ILE 41 HG12 ILE 41 0.643 6.303 2.949
5 HG13 ILE 41 HG13 ILE 41 2.241 6.590 2.268
6 HG21 ILE 41 HG21 ILE 41 1.231 2.770 3.825
7 HG22 ILE 41 HG22 ILE 41 0.112 4.120 3.995
8 HG23 ILE 41 HG23 ILE 41 0.359 3.371 2.418
9 HD11 ILE 41 HD11 ILE 41 0.091 4.893 1.040
10 HD12 ILE 41 HD12 ILE 41 0.535 6.529 0.550
11 HD13 ILE 41 HD13 ILE 41 1.688 5.206 0.355
No H/Q in entry = 11
In of MODEL 4
1 H LEU 42 H LEU 42 4.648 3.541 3.808
2 HA LEU 42 HA LEU 42 4.028 1.220 5.229
3 HB2 LEU 42 HB2 LEU 42 6.570 2.349 4.134
4 HB3 LEU 42 HB3 LEU 42 6.602 0.878 5.075
5 HG LEU 42 HG LEU 42 5.202 1.330 2.445
6 HD11 LEU 42 HD11 LEU 42 7.440 -0.499 3.275
7 HD12 LEU 42 HD12 LEU 42 6.700 -0.440 1.677
8 HD13 LEU 42 HD13 LEU 42 7.589 0.956 2.288
9 HD21 LEU 42 HD21 LEU 42 5.043 -0.993 4.346
10 HD22 LEU 42 HD22 LEU 42 3.719 -0.046 3.662
11 HD23 LEU 42 HD23 LEU 42 4.661 -1.127 2.627
No H/Q in entry = 11
In of MODEL 4
1 H HIS 43 H HIS 43 5.795 4.100 6.184
2 HA HIS 43 HA HIS 43 6.693 3.188 8.701
3 HB2 HIS 43 HB2 HIS 43 7.380 5.321 7.483
4 HB3 HIS 43 HB3 HIS 43 5.870 6.026 8.045
5 HD1 HIS 43 HD1 HIS 43 6.018 7.219 10.228
6 HD2 HIS 43 HD2 HIS 43 9.049 4.421 9.760
7 HE1 HIS 43 HE1 HIS 43 7.511 7.501 12.225
8 HE2 HIS 43 HE2 HIS 43 9.412 5.892 11.853
No H/Q in entry = 8
In of MODEL 4
1 H TYR 44 H TYR 44 3.781 5.099 7.833
2 HA TYR 44 HA TYR 44 2.551 5.130 10.331
3 HB2 TYR 44 HB2 TYR 44 1.331 5.028 7.565
4 HB3 TYR 44 HB3 TYR 44 0.411 5.350 9.025
5 HD1 TYR 44 HD1 TYR 44 2.513 7.057 10.401
6 HD2 TYR 44 HD2 TYR 44 0.967 7.070 6.446
7 HE1 TYR 44 HE1 TYR 44 3.039 9.438 10.216
8 HE2 TYR 44 HE2 TYR 44 1.489 9.456 6.242
9 HH TYR 44 HH TYR 44 3.492 11.092 8.444
No H/Q in entry = 9
In of MODEL 4
1 H TYR 45 H TYR 45 2.341 2.812 7.715
2 HA TYR 45 HA TYR 45 0.403 1.087 8.613
3 HB2 TYR 45 HB2 TYR 45 1.329 1.011 6.382
4 HB3 TYR 45 HB3 TYR 45 2.916 0.602 7.010
5 HD1 TYR 45 HD1 TYR 45 -0.566 -0.720 6.970
6 HD2 TYR 45 HD2 TYR 45 3.599 -1.547 6.992
7 HE1 TYR 45 HE1 TYR 45 -1.046 -3.115 6.675
8 HE2 TYR 45 HE2 TYR 45 3.141 -3.933 6.701
9 HH TYR 45 HH TYR 45 0.027 -5.128 5.901
No H/Q in entry = 9
In of MODEL 4
1 H ASP 46 H ASP 46 3.900 1.002 9.307
2 HA ASP 46 HA ASP 46 3.646 -1.446 10.765
3 HB2 ASP 46 HB2 ASP 46 5.744 -0.711 9.562
4 HB3 ASP 46 HB3 ASP 46 5.982 0.484 10.832
No H/Q in entry = 4
In of MODEL 4
1 H GLU 47 H GLU 47 3.184 1.857 11.593
2 HA GLU 47 HA GLU 47 3.661 1.405 14.424
3 HB2 GLU 47 HB2 GLU 47 2.643 3.857 12.980
4 HB3 GLU 47 HB3 GLU 47 3.118 3.777 14.666
5 HG2 GLU 47 HG2 GLU 47 5.414 3.288 13.999
6 HG3 GLU 47 HG3 GLU 47 4.930 3.372 12.304
No H/Q in entry = 6
In of MODEL 4
1 H LEU 48 H LEU 48 1.334 0.305 12.591
2 HA LEU 48 HA LEU 48 -1.016 1.458 13.715
3 HB2 LEU 48 HB2 LEU 48 -0.480 -0.936 11.991
4 HB3 LEU 48 HB3 LEU 48 -2.093 -0.509 12.512
5 HG LEU 48 HG LEU 48 -0.282 1.226 10.859
6 HD11 LEU 48 HD11 LEU 48 -1.198 -0.680 9.644
7 HD12 LEU 48 HD12 LEU 48 -2.821 -0.235 10.172
8 HD13 LEU 48 HD13 LEU 48 -1.915 0.837 9.104
9 HD21 LEU 48 HD21 LEU 48 -3.015 1.644 12.029
10 HD22 LEU 48 HD22 LEU 48 -1.576 2.651 12.214
11 HD23 LEU 48 HD23 LEU 48 -2.407 2.582 10.660
No H/Q in entry = 11
In of MODEL 4
1 H GLU 49 H GLU 49 -2.468 -0.966 14.039
2 HA GLU 49 HA GLU 49 -1.636 -1.744 16.731
3 HB2 GLU 49 HB2 GLU 49 -4.191 -0.334 15.979
4 HB3 GLU 49 HB3 GLU 49 -4.077 -1.313 17.434
5 HG2 GLU 49 HG2 GLU 49 -2.267 0.999 16.811
6 HG3 GLU 49 HG3 GLU 49 -3.727 1.117 17.792
No H/Q in entry = 6
In of MODEL 4
1 H GLY 50 H GLY 50 -4.246 -2.960 17.298
2 HA2 GLY 50 HA2 GLY 50 -5.171 -5.051 17.095
3 HA3 GLY 50 HA3 GLY 50 -3.744 -5.506 16.180
No H/Q in entry = 3
In of MODEL 4
1 H ASP 51 H ASP 51 -6.982 -4.176 15.971
2 HA ASP 51 HA ASP 51 -7.491 -5.418 13.455
3 HB2 ASP 51 HB2 ASP 51 -9.013 -3.324 15.025
4 HB3 ASP 51 HB3 ASP 51 -9.592 -3.997 13.508
No H/Q in entry = 4
In of MODEL 4
1 H ALA 52 H ALA 52 -6.319 -2.268 14.402
2 HA ALA 52 HA ALA 52 -6.935 -0.833 12.054
3 HB1 ALA 52 HB1 ALA 52 -4.533 -0.475 13.856
4 HB2 ALA 52 HB2 ALA 52 -5.183 0.713 12.727
5 HB3 ALA 52 HB3 ALA 52 -6.127 0.225 14.135
No H/Q in entry = 5
In of MODEL 4
1 H LYS 53 H LYS 53 -4.107 -2.780 12.913
2 HA LYS 53 HA LYS 53 -2.659 -2.294 10.535
3 HB2 LYS 53 HB2 LYS 53 -2.017 -3.380 12.892
4 HB3 LYS 53 HB3 LYS 53 -2.338 -4.862 12.009
5 HG2 LYS 53 HG2 LYS 53 -0.499 -2.826 10.844
6 HG3 LYS 53 HG3 LYS 53 0.066 -3.889 12.131
7 HD2 LYS 53 HD2 LYS 53 -0.676 -5.832 10.750
8 HD3 LYS 53 HD3 LYS 53 -1.027 -4.697 9.446
9 HE2 LYS 53 HE2 LYS 53 1.303 -3.994 9.402
10 HE3 LYS 53 HE3 LYS 53 1.668 -5.059 10.755
11 HZ1 LYS 53 HZ1 LYS 53 1.011 -6.949 9.334
12 HZ2 LYS 53 HZ2 LYS 53 0.814 -5.882 8.032
13 HZ3 LYS 53 HZ3 LYS 53 2.340 -6.101 8.726
No H/Q in entry = 13
In of MODEL 4
1 H LYS 54 H LYS 54 -4.746 -4.960 11.601
2 HA LYS 54 HA LYS 54 -4.644 -6.530 9.308
3 HB2 LYS 54 HB2 LYS 54 -5.976 -7.813 10.522
4 HB3 LYS 54 HB3 LYS 54 -6.074 -6.530 11.716
5 HG2 LYS 54 HG2 LYS 54 -8.126 -5.815 10.977
6 HG3 LYS 54 HG3 LYS 54 -7.894 -6.478 9.354
7 HD2 LYS 54 HD2 LYS 54 -8.011 -8.747 10.322
8 HD3 LYS 54 HD3 LYS 54 -8.368 -8.024 11.893
9 HE2 LYS 54 HE2 LYS 54 -10.389 -8.800 10.690
10 HE3 LYS 54 HE3 LYS 54 -10.408 -7.078 11.057
11 HZ1 LYS 54 HZ1 LYS 54 -9.419 -7.986 8.434
12 HZ2 LYS 54 HZ2 LYS 54 -11.088 -7.897 8.722
13 HZ3 LYS 54 HZ3 LYS 54 -10.134 -6.509 8.869
No H/Q in entry = 13
In of MODEL 4
1 H GLU 55 H GLU 55 -6.862 -3.855 10.077
2 HA GLU 55 HA GLU 55 -8.356 -4.069 7.710
3 HB2 GLU 55 HB2 GLU 55 -7.945 -1.925 9.781
4 HB3 GLU 55 HB3 GLU 55 -8.981 -1.648 8.403
5 HG2 GLU 55 HG2 GLU 55 -9.310 -3.821 10.451
6 HG3 GLU 55 HG3 GLU 55 -10.234 -2.330 10.365
No H/Q in entry = 6
In of MODEL 4
1 H ALA 56 H ALA 56 -5.655 -1.915 8.638
2 HA ALA 56 HA ALA 56 -5.575 -0.576 6.198
3 HB1 ALA 56 HB1 ALA 56 -3.287 0.056 6.764
4 HB2 ALA 56 HB2 ALA 56 -3.243 -1.187 8.015
5 HB3 ALA 56 HB3 ALA 56 -4.338 0.187 8.174
No H/Q in entry = 5
In of MODEL 4
1 H THR 57 H THR 57 -3.806 -3.464 7.270
2 HA THR 57 HA THR 57 -2.274 -3.914 5.021
3 HB THR 57 HB THR 57 -3.570 -6.018 6.765
4 HG1 THR 57 HG1 THR 57 -2.360 -4.757 8.092
5 HG21 THR 57 HG21 THR 57 -1.155 -6.118 4.960
6 HG22 THR 57 HG22 THR 57 -1.618 -7.386 6.096
7 HG23 THR 57 HG23 THR 57 -2.673 -6.984 4.742
No H/Q in entry = 7
In of MODEL 4
1 H GLU 58 H GLU 58 -5.563 -5.013 5.706
2 HA GLU 58 HA GLU 58 -5.950 -6.392 3.247
3 HB2 GLU 58 HB2 GLU 58 -7.795 -5.391 5.397
4 HB3 GLU 58 HB3 GLU 58 -8.410 -6.156 3.932
5 HG2 GLU 58 HG2 GLU 58 -7.094 -8.153 4.426
6 HG3 GLU 58 HG3 GLU 58 -6.475 -7.383 5.885
No H/Q in entry = 6
In of MODEL 4
1 H HIS 59 H HIS 59 -6.205 -3.018 4.122
2 HA HIS 59 HA HIS 59 -7.729 -2.324 1.776
3 HB2 HIS 59 HB2 HIS 59 -6.269 -0.728 3.859
4 HB3 HIS 59 HB3 HIS 59 -6.805 0.042 2.371
5 HD1 HIS 59 HD1 HIS 59 -9.562 -0.721 1.930
6 HD2 HIS 59 HD2 HIS 59 -8.081 -0.280 5.789
7 HE1 HIS 59 HE1 HIS 59 -11.575 -0.347 3.388
8 HE2 HIS 59 HE2 HIS 59 -10.666 -0.282 5.733
No H/Q in entry = 8
In of MODEL 4
1 H LEU 60 H LEU 60 -4.341 -1.908 2.792
2 HA LEU 60 HA LEU 60 -3.271 -1.167 0.384
3 HB2 LEU 60 HB2 LEU 60 -2.212 -2.660 2.744
4 HB3 LEU 60 HB3 LEU 60 -1.208 -2.438 1.320
5 HG LEU 60 HG LEU 60 -1.664 0.005 1.523
6 HD11 LEU 60 HD11 LEU 60 -3.626 -0.085 2.870
7 HD12 LEU 60 HD12 LEU 60 -2.677 -0.709 4.225
8 HD13 LEU 60 HD13 LEU 60 -2.378 0.921 3.612
9 HD21 LEU 60 HD21 LEU 60 0.465 -0.945 2.201
10 HD22 LEU 60 HD22 LEU 60 0.001 0.366 3.286
11 HD23 LEU 60 HD23 LEU 60 -0.201 -1.311 3.794
No H/Q in entry = 11
In of MODEL 4
1 H LYS 61 H LYS 61 -4.217 -4.398 1.503
2 HA LYS 61 HA LYS 61 -3.008 -5.861 -0.567
3 HB2 LYS 61 HB2 LYS 61 -5.396 -6.372 1.185
4 HB3 LYS 61 HB3 LYS 61 -4.994 -7.473 -0.124
5 HG2 LYS 61 HG2 LYS 61 -2.770 -7.808 0.868
6 HG3 LYS 61 HG3 LYS 61 -3.229 -6.752 2.205
7 HD2 LYS 61 HD2 LYS 61 -5.012 -8.279 2.829
8 HD3 LYS 61 HD3 LYS 61 -4.637 -9.310 1.445
9 HE2 LYS 61 HE2 LYS 61 -2.405 -9.726 2.380
10 HE3 LYS 61 HE3 LYS 61 -2.806 -8.723 3.770
11 HZ1 LYS 61 HZ1 LYS 61 -4.204 -11.223 2.994
12 HZ2 LYS 61 HZ2 LYS 61 -3.076 -11.075 4.249
13 HZ3 LYS 61 HZ3 LYS 61 -4.559 -10.268 4.344
No H/Q in entry = 13
In of MODEL 4
1 H GLY 62 H GLY 62 -6.380 -4.711 -0.272
2 HA2 GLY 62 HA2 GLY 62 -7.835 -3.952 -1.881
3 HA3 GLY 62 HA3 GLY 62 -7.215 -5.273 -2.861
No H/Q in entry = 3
In of MODEL 4
1 H GLY 63 H GLY 63 -5.488 -2.432 -1.637
2 HA2 GLY 63 HA2 GLY 63 -4.132 -0.936 -2.718
3 HA3 GLY 63 HA3 GLY 63 -5.368 -0.923 -3.967
No H/Q in entry = 3
In of MODEL 4
1 H CYS 64 H CYS 64 -2.994 -3.321 -2.843
2 HA CYS 64 HA CYS 64 -1.455 -3.193 -5.231
3 HB2 CYS 64 HB2 CYS 64 -0.497 -3.924 -3.099
4 HB3 CYS 64 HB3 CYS 64 -1.561 -5.327 -3.091
No H/Q in entry = 4
In of MODEL 4
1 H ARG 65 H ARG 65 -4.212 -5.048 -4.199
2 HA ARG 65 HA ARG 65 -4.121 -7.024 -6.213
3 HB2 ARG 65 HB2 ARG 65 -5.489 -7.204 -4.142
4 HB3 ARG 65 HB3 ARG 65 -6.555 -5.956 -4.770
5 HG2 ARG 65 HG2 ARG 65 -7.549 -8.118 -5.128
6 HG3 ARG 65 HG3 ARG 65 -7.096 -7.416 -6.682
7 HD2 ARG 65 HD2 ARG 65 -4.963 -8.765 -6.528
8 HD3 ARG 65 HD3 ARG 65 -5.690 -9.597 -5.154
9 HE ARG 65 HE ARG 65 -7.470 -9.679 -7.327
10 HH11 ARG 65 HH11 ARG 65 -4.444 -11.083 -6.246
11 HH12 ARG 65 HH12 ARG 65 -4.597 -12.490 -7.247
12 HH21 ARG 65 HH21 ARG 65 -7.673 -11.536 -8.646
13 HH22 ARG 65 HH22 ARG 65 -6.426 -12.747 -8.622
No H/Q in entry = 13
In of MODEL 4
1 H GLU 66 H GLU 66 -4.928 -3.693 -6.309
2 HA GLU 66 HA GLU 66 -6.262 -4.012 -8.873
3 HB2 GLU 66 HB2 GLU 66 -5.668 -1.594 -7.176
4 HB3 GLU 66 HB3 GLU 66 -6.294 -1.466 -8.817
5 HG2 GLU 66 HG2 GLU 66 -7.617 -2.847 -6.494
6 HG3 GLU 66 HG3 GLU 66 -8.102 -1.320 -7.232
No H/Q in entry = 6
In of MODEL 4
1 H ILE 67 H ILE 67 -3.230 -2.831 -7.520
2 HA ILE 67 HA ILE 67 -2.176 -1.972 -10.024
3 HB ILE 67 HB ILE 67 -0.771 -2.605 -7.430
4 HG12 ILE 67 HG12 ILE 67 -1.476 0.032 -8.737
5 HG13 ILE 67 HG13 ILE 67 -2.316 -0.684 -7.368
6 HG21 ILE 67 HG21 ILE 67 0.743 -2.906 -9.364
7 HG22 ILE 67 HG22 ILE 67 0.364 -1.261 -9.887
8 HG23 ILE 67 HG23 ILE 67 1.202 -1.526 -8.357
9 HD11 ILE 67 HD11 ILE 67 0.552 0.216 -7.400
10 HD12 ILE 67 HD12 ILE 67 -0.801 1.072 -6.662
11 HD13 ILE 67 HD13 ILE 67 -0.296 -0.492 -6.025
No H/Q in entry = 11
In of MODEL 4
1 H LEU 68 H LEU 68 -1.060 -4.595 -7.910
2 HA LEU 68 HA LEU 68 0.732 -5.612 -9.818
3 HB2 LEU 68 HB2 LEU 68 0.782 -5.895 -7.296
4 HB3 LEU 68 HB3 LEU 68 -0.446 -7.130 -7.495
5 HG LEU 68 HG LEU 68 1.192 -8.331 -9.022
6 HD11 LEU 68 HD11 LEU 68 3.097 -6.355 -7.770
7 HD12 LEU 68 HD12 LEU 68 3.556 -7.766 -8.719
8 HD13 LEU 68 HD13 LEU 68 2.667 -6.447 -9.476
9 HD21 LEU 68 HD21 LEU 68 1.931 -7.940 -6.123
10 HD22 LEU 68 HD22 LEU 68 0.723 -9.062 -6.745
11 HD23 LEU 68 HD23 LEU 68 2.425 -9.291 -7.141
No H/Q in entry = 11
In of MODEL 4
1 H LYS 69 H LYS 69 -2.511 -6.622 -8.815
2 HA LYS 69 HA LYS 69 -2.697 -9.009 -10.187
3 HB2 LYS 69 HB2 LYS 69 -4.484 -8.381 -8.755
4 HB3 LYS 69 HB3 LYS 69 -4.713 -6.852 -9.581
5 HG2 LYS 69 HG2 LYS 69 -5.356 -8.350 -11.601
6 HG3 LYS 69 HG3 LYS 69 -5.608 -9.585 -10.371
7 HD2 LYS 69 HD2 LYS 69 -7.716 -8.547 -10.696
8 HD3 LYS 69 HD3 LYS 69 -7.086 -7.907 -9.174
9 HE2 LYS 69 HE2 LYS 69 -6.283 -5.908 -10.388
10 HE3 LYS 69 HE3 LYS 69 -6.997 -6.543 -11.866
11 HZ1 LYS 69 HZ1 LYS 69 -9.163 -6.535 -10.592
12 HZ2 LYS 69 HZ2 LYS 69 -8.385 -5.587 -9.426
13 HZ3 LYS 69 HZ3 LYS 69 -8.539 -5.026 -11.016
No H/Q in entry = 13
In of MODEL 4
1 H HIS 70 H HIS 70 -4.630 -6.403 -11.608
2 HA HIS 70 HA HIS 70 -4.382 -6.543 -14.167
3 HB2 HIS 70 HB2 HIS 70 -5.414 -4.600 -13.644
4 HB3 HIS 70 HB3 HIS 70 -4.319 -4.254 -12.317
5 HD1 HIS 70 HD1 HIS 70 -5.160 -3.209 -15.708
6 HD2 HIS 70 HD2 HIS 70 -1.806 -2.977 -13.239
7 HE1 HIS 70 HE1 HIS 70 -3.702 -1.420 -16.696
8 HE2 HIS 70 HE2 HIS 70 -1.766 -1.198 -15.111
No H/Q in entry = 8
In of MODEL 4
1 H VAL 71 H VAL 71 -1.492 -5.696 -12.261
2 HA VAL 71 HA VAL 71 -0.093 -4.707 -14.521
3 HB VAL 71 HB VAL 71 0.232 -4.416 -11.867
4 HG11 VAL 71 HG11 VAL 71 1.315 -6.590 -11.594
5 HG12 VAL 71 HG12 VAL 71 2.584 -6.064 -12.700
6 HG13 VAL 71 HG13 VAL 71 2.344 -5.217 -11.168
7 HG21 VAL 71 HG21 VAL 71 2.178 -3.941 -14.070
8 HG22 VAL 71 HG22 VAL 71 0.931 -2.853 -13.456
9 HG23 VAL 71 HG23 VAL 71 2.324 -3.269 -12.451
No H/Q in entry = 9
In of MODEL 4
1 H VAL 72 H VAL 72 0.169 -7.860 -12.799
2 HA VAL 72 HA VAL 72 1.595 -8.975 -15.052
3 HB VAL 72 HB VAL 72 1.657 -9.993 -12.712
4 HG11 VAL 72 HG11 VAL 72 -1.091 -10.887 -13.489
5 HG12 VAL 72 HG12 VAL 72 -0.130 -11.665 -12.233
6 HG13 VAL 72 HG13 VAL 72 -0.608 -9.976 -12.061
7 HG21 VAL 72 HG21 VAL 72 2.429 -11.055 -14.827
8 HG22 VAL 72 HG22 VAL 72 2.009 -12.162 -13.524
9 HG23 VAL 72 HG23 VAL 72 0.892 -11.913 -14.869
No H/Q in entry = 9
In of MODEL 4
1 H GLY 73 H GLY 73 -1.716 -8.423 -14.146
2 HA2 GLY 73 HA2 GLY 73 -2.514 -9.588 -16.744
3 HA3 GLY 73 HA3 GLY 73 -3.198 -8.106 -16.092
No H/Q in entry = 3
In of MODEL 4
1 H GLU 74 H GLU 74 -5.291 -9.009 -16.274
2 HA GLU 74 HA GLU 74 -6.285 -10.182 -13.942
3 HB2 GLU 74 HB2 GLU 74 -7.730 -8.926 -15.433
4 HB3 GLU 74 HB3 GLU 74 -7.495 -10.109 -16.712
5 HG2 GLU 74 HG2 GLU 74 -8.599 -11.805 -15.332
6 HG3 GLU 74 HG3 GLU 74 -8.858 -10.598 -14.074
No H/Q in entry = 6
In of MODEL 4
1 H GLU 75 H GLU 75 -5.483 -11.602 -17.073
2 HA GLU 75 HA GLU 75 -6.121 -14.235 -16.866
3 HB2 GLU 75 HB2 GLU 75 -4.937 -13.342 -18.773
4 HB3 GLU 75 HB3 GLU 75 -3.509 -13.039 -17.795
5 HG2 GLU 75 HG2 GLU 75 -3.068 -15.351 -17.560
6 HG3 GLU 75 HG3 GLU 75 -4.642 -15.785 -18.228
No H/Q in entry = 6
In of MODEL 4
1 H LYS 76 H LYS 76 -3.017 -12.987 -15.723
2 HA LYS 76 HA LYS 76 -2.280 -15.444 -14.544
3 HB2 LYS 76 HB2 LYS 76 -0.651 -13.889 -15.424
4 HB3 LYS 76 HB3 LYS 76 -1.136 -12.670 -14.262
5 HG2 LYS 76 HG2 LYS 76 0.981 -13.868 -13.749
6 HG3 LYS 76 HG3 LYS 76 -0.218 -13.873 -12.465
7 HD2 LYS 76 HD2 LYS 76 0.593 -16.078 -12.511
8 HD3 LYS 76 HD3 LYS 76 -0.932 -16.163 -13.384
9 HE2 LYS 76 HE2 LYS 76 1.760 -15.900 -14.703
10 HE3 LYS 76 HE3 LYS 76 0.952 -17.433 -14.418
11 HZ1 LYS 76 HZ1 LYS 76 -0.880 -16.664 -15.825
12 HZ2 LYS 76 HZ2 LYS 76 -0.040 -15.221 -16.132
13 HZ3 LYS 76 HZ3 LYS 76 0.591 -16.693 -16.662
No H/Q in entry = 13
In of MODEL 4
1 H ALA 77 H ALA 77 -3.455 -12.384 -13.184
2 HA ALA 77 HA ALA 77 -3.081 -13.170 -10.487
3 HB1 ALA 77 HB1 ALA 77 -3.215 -10.836 -11.168
4 HB2 ALA 77 HB2 ALA 77 -4.414 -11.218 -9.933
5 HB3 ALA 77 HB3 ALA 77 -4.904 -11.064 -11.621
No H/Q in entry = 5
In of MODEL 4
1 H ALA 78 H ALA 78 -5.599 -13.704 -12.809
2 HA ALA 78 HA ALA 78 -7.616 -14.537 -10.977
3 HB1 ALA 78 HB1 ALA 78 -7.184 -15.034 -13.921
4 HB2 ALA 78 HB2 ALA 78 -8.591 -15.629 -13.033
5 HB3 ALA 78 HB3 ALA 78 -8.298 -13.894 -13.167
No H/Q in entry = 5
In of MODEL 4
1 H GLU 79 H GLU 79 -4.958 -16.072 -12.667
2 HA GLU 79 HA GLU 79 -5.607 -18.754 -12.010
3 HB2 GLU 79 HB2 GLU 79 -2.851 -17.608 -12.487
4 HB3 GLU 79 HB3 GLU 79 -3.336 -19.289 -12.641
5 HG2 GLU 79 HG2 GLU 79 -4.850 -18.592 -14.487
6 HG3 GLU 79 HG3 GLU 79 -4.131 -16.989 -14.382
No H/Q in entry = 6
In of MODEL 4
1 H LEU 80 H LEU 80 -3.747 -16.227 -10.455
2 HA LEU 80 HA LEU 80 -2.827 -17.852 -8.298
3 HB2 LEU 80 HB2 LEU 80 -3.042 -14.849 -8.521
4 HB3 LEU 80 HB3 LEU 80 -2.075 -15.734 -7.351
5 HG LEU 80 HG LEU 80 -1.643 -15.951 -10.324
6 HD11 LEU 80 HD11 LEU 80 -0.340 -14.103 -8.346
7 HD12 LEU 80 HD12 LEU 80 0.296 -14.453 -9.954
8 HD13 LEU 80 HD13 LEU 80 -1.274 -13.669 -9.777
9 HD21 LEU 80 HD21 LEU 80 -0.789 -17.799 -8.991
10 HD22 LEU 80 HD22 LEU 80 0.529 -16.836 -9.662
11 HD23 LEU 80 HD23 LEU 80 0.086 -16.664 -7.963
No H/Q in entry = 11
In of MODEL 4
1 H LYS 81 H LYS 81 -5.600 -15.803 -8.899
2 HA LYS 81 HA LYS 81 -6.633 -15.731 -6.277
3 HB2 LYS 81 HB2 LYS 81 -7.510 -14.227 -7.944
4 HB3 LYS 81 HB3 LYS 81 -8.000 -15.567 -8.970
5 HG2 LYS 81 HG2 LYS 81 -9.945 -14.675 -7.918
6 HG3 LYS 81 HG3 LYS 81 -9.612 -16.253 -7.209
7 HD2 LYS 81 HD2 LYS 81 -10.153 -14.862 -5.391
8 HD3 LYS 81 HD3 LYS 81 -8.396 -14.993 -5.363
9 HE2 LYS 81 HE2 LYS 81 -9.119 -12.694 -4.970
10 HE3 LYS 81 HE3 LYS 81 -8.202 -12.830 -6.471
11 HZ1 LYS 81 HZ1 LYS 81 -11.169 -12.794 -6.327
12 HZ2 LYS 81 HZ2 LYS 81 -10.217 -11.437 -6.653
13 HZ3 LYS 81 HZ3 LYS 81 -10.221 -12.743 -7.728
No H/Q in entry = 13
In of MODEL 4
1 H ASN 82 H ASN 82 -7.411 -17.849 -9.037
2 HA ASN 82 HA ASN 82 -9.084 -19.572 -7.539
3 HB2 ASN 82 HB2 ASN 82 -8.984 -19.354 -10.094
4 HB3 ASN 82 HB3 ASN 82 -7.538 -20.349 -10.022
5 HD21 ASN 82 HD21 ASN 82 -7.709 -22.525 -9.519
6 HD22 ASN 82 HD22 ASN 82 -9.228 -23.355 -9.511
No H/Q in entry = 6
In of MODEL 4
1 H LEU 83 H LEU 83 -5.623 -19.521 -8.189
2 HA LEU 83 HA LEU 83 -5.002 -22.103 -7.304
3 HB2 LEU 83 HB2 LEU 83 -3.611 -19.691 -7.990
4 HB3 LEU 83 HB3 LEU 83 -2.934 -20.351 -6.521
5 HG LEU 83 HG LEU 83 -3.269 -21.946 -9.058
6 HD11 LEU 83 HD11 LEU 83 -0.849 -20.471 -8.033
7 HD12 LEU 83 HD12 LEU 83 -0.851 -21.616 -9.374
8 HD13 LEU 83 HD13 LEU 83 -1.760 -20.108 -9.500
9 HD21 LEU 83 HD21 LEU 83 -3.123 -23.262 -6.995
10 HD22 LEU 83 HD22 LEU 83 -1.695 -23.474 -8.005
11 HD23 LEU 83 HD23 LEU 83 -1.619 -22.440 -6.580
No H/Q in entry = 11
In of MODEL 4
1 H LYS 84 H LYS 84 -5.308 -19.027 -5.611
2 HA LYS 84 HA LYS 84 -4.481 -19.802 -3.068
3 HB2 LYS 84 HB2 LYS 84 -4.894 -17.472 -3.748
4 HB3 LYS 84 HB3 LYS 84 -6.619 -17.803 -3.822
5 HG2 LYS 84 HG2 LYS 84 -6.667 -18.234 -1.438
6 HG3 LYS 84 HG3 LYS 84 -4.924 -17.979 -1.343
7 HD2 LYS 84 HD2 LYS 84 -5.258 -15.664 -2.147
8 HD3 LYS 84 HD3 LYS 84 -7.003 -15.938 -2.125
9 HE2 LYS 84 HE2 LYS 84 -6.263 -14.773 -0.111
10 HE3 LYS 84 HE3 LYS 84 -6.914 -16.367 0.271
11 HZ1 LYS 84 HZ1 LYS 84 -4.647 -17.210 0.411
12 HZ2 LYS 84 HZ2 LYS 84 -4.036 -15.672 0.068
13 HZ3 LYS 84 HZ3 LYS 84 -4.891 -15.943 1.500
No H/Q in entry = 13
In of MODEL 4
1 H ASP 85 H ASP 85 -7.816 -19.669 -4.352
2 HA ASP 85 HA ASP 85 -8.938 -20.866 -2.029
3 HB2 ASP 85 HB2 ASP 85 -10.077 -20.407 -4.784
4 HB3 ASP 85 HB3 ASP 85 -11.010 -21.051 -3.436
No H/Q in entry = 4
In of MODEL 4
1 H SER 86 H SER 86 -7.523 -22.156 -4.896
2 HA SER 86 HA SER 86 -8.723 -24.761 -4.693
3 HB2 SER 86 HB2 SER 86 -7.878 -23.881 -6.848
4 HB3 SER 86 HB3 SER 86 -6.244 -23.859 -6.191
5 HG SER 86 HG SER 86 -7.825 -26.211 -6.354
No H/Q in entry = 5
In of MODEL 4
1 H GLY 87 H GLY 87 -6.218 -23.084 -3.141
2 HA2 GLY 87 HA2 GLY 87 -5.366 -25.601 -1.859
3 HA3 GLY 87 HA3 GLY 87 -5.598 -24.099 -0.980
No H/Q in entry = 3
In of MODEL 4
1 H ALA 88 H ALA 88 -4.313 -22.369 -2.880
2 HA ALA 88 HA ALA 88 -1.632 -23.364 -3.094
3 HB1 ALA 88 HB1 ALA 88 -2.700 -20.583 -3.564
4 HB2 ALA 88 HB2 ALA 88 -2.476 -21.832 -4.787
5 HB3 ALA 88 HB3 ALA 88 -1.078 -21.138 -3.965
No H/Q in entry = 5
In of MODEL 4
1 H SER 89 H SER 89 -0.215 -23.173 -1.546
2 HA SER 89 HA SER 89 -0.754 -22.008 0.979
3 HB2 SER 89 HB2 SER 89 1.567 -22.731 1.485
4 HB3 SER 89 HB3 SER 89 0.598 -24.023 0.796
5 HG SER 89 HG SER 89 2.272 -24.164 -0.494
No H/Q in entry = 5
In of MODEL 4
1 H LYS 90 H LYS 90 1.198 -20.644 1.952
2 HA LYS 90 HA LYS 90 1.245 -18.142 0.689
3 HB2 LYS 90 HB2 LYS 90 3.292 -19.221 2.640
4 HB3 LYS 90 HB3 LYS 90 2.955 -17.530 2.302
5 HG2 LYS 90 HG2 LYS 90 0.804 -17.679 3.318
6 HG3 LYS 90 HG3 LYS 90 0.940 -19.432 3.473
7 HD2 LYS 90 HD2 LYS 90 1.396 -18.567 5.615
8 HD3 LYS 90 HD3 LYS 90 2.964 -19.002 4.936
9 HE2 LYS 90 HE2 LYS 90 3.201 -16.881 5.994
10 HE3 LYS 90 HE3 LYS 90 3.236 -16.613 4.253
11 HZ1 LYS 90 HZ1 LYS 90 0.823 -16.259 5.944
12 HZ2 LYS 90 HZ2 LYS 90 1.852 -15.000 5.483
13 HZ3 LYS 90 HZ3 LYS 90 0.983 -15.856 4.313
No H/Q in entry = 13
In of MODEL 4
1 H GLU 91 H GLU 91 3.086 -21.003 0.196
2 HA GLU 91 HA GLU 91 5.317 -19.640 -1.026
3 HB2 GLU 91 HB2 GLU 91 4.750 -22.549 -0.551
4 HB3 GLU 91 HB3 GLU 91 6.203 -21.950 -1.343
5 HG2 GLU 91 HG2 GLU 91 5.316 -21.438 1.478
6 HG3 GLU 91 HG3 GLU 91 6.716 -22.343 0.928
No H/Q in entry = 6
In of MODEL 4
1 H GLU 92 H GLU 92 2.711 -21.808 -2.115
2 HA GLU 92 HA GLU 92 3.440 -22.029 -4.790
3 HB2 GLU 92 HB2 GLU 92 0.665 -21.957 -3.595
4 HB3 GLU 92 HB3 GLU 92 1.118 -22.648 -5.139
5 HG2 GLU 92 HG2 GLU 92 2.193 -23.623 -2.531
6 HG3 GLU 92 HG3 GLU 92 0.742 -24.261 -3.288
No H/Q in entry = 6
In of MODEL 4
1 H LEU 93 H LEU 93 1.451 -19.680 -3.054
2 HA LEU 93 HA LEU 93 1.151 -18.038 -5.372
3 HB2 LEU 93 HB2 LEU 93 0.841 -17.372 -2.444
4 HB3 LEU 93 HB3 LEU 93 0.480 -16.250 -3.749
5 HG LEU 93 HG LEU 93 -0.896 -18.874 -3.168
6 HD11 LEU 93 HD11 LEU 93 -1.873 -16.036 -3.226
7 HD12 LEU 93 HD12 LEU 93 -2.905 -17.459 -3.078
8 HD13 LEU 93 HD13 LEU 93 -1.725 -17.091 -1.816
9 HD21 LEU 93 HD21 LEU 93 -1.156 -17.081 -5.571
10 HD22 LEU 93 HD22 LEU 93 -0.655 -18.771 -5.541
11 HD23 LEU 93 HD23 LEU 93 -2.314 -18.337 -5.138
No H/Q in entry = 11
In of MODEL 4
1 H LYS 94 H LYS 94 3.614 -18.183 -2.772
2 HA LYS 94 HA LYS 94 4.680 -15.660 -3.491
3 HB2 LYS 94 HB2 LYS 94 5.064 -16.708 -1.299
4 HB3 LYS 94 HB3 LYS 94 6.023 -17.962 -2.063
5 HG2 LYS 94 HG2 LYS 94 7.603 -16.194 -2.824
6 HG3 LYS 94 HG3 LYS 94 6.681 -15.036 -1.860
7 HD2 LYS 94 HD2 LYS 94 7.981 -17.533 -0.785
8 HD3 LYS 94 HD3 LYS 94 8.666 -15.912 -0.676
9 HE2 LYS 94 HE2 LYS 94 6.888 -15.169 0.718
10 HE3 LYS 94 HE3 LYS 94 5.962 -16.640 0.425
11 HZ1 LYS 94 HZ1 LYS 94 8.604 -16.676 1.753
12 HZ2 LYS 94 HZ2 LYS 94 7.157 -16.494 2.611
13 HZ3 LYS 94 HZ3 LYS 94 7.433 -17.904 1.710
No H/Q in entry = 13
In of MODEL 4
1 H ALA 95 H ALA 95 5.497 -18.950 -4.337
2 HA ALA 95 HA ALA 95 7.790 -18.152 -5.816
3 HB1 ALA 95 HB1 ALA 95 6.350 -20.809 -5.692
4 HB2 ALA 95 HB2 ALA 95 7.724 -20.316 -4.699
5 HB3 ALA 95 HB3 ALA 95 7.932 -20.534 -6.434
No H/Q in entry = 5
In of MODEL 4
1 H LYS 96 H LYS 96 4.583 -19.472 -6.697
2 HA LYS 96 HA LYS 96 5.062 -19.429 -9.486
3 HB2 LYS 96 HB2 LYS 96 2.746 -19.791 -7.737
4 HB3 LYS 96 HB3 LYS 96 2.361 -19.105 -9.302
5 HG2 LYS 96 HG2 LYS 96 2.207 -21.580 -9.199
6 HG3 LYS 96 HG3 LYS 96 3.304 -20.973 -10.441
7 HD2 LYS 96 HD2 LYS 96 5.201 -21.376 -8.927
8 HD3 LYS 96 HD3 LYS 96 4.087 -22.028 -7.729
9 HE2 LYS 96 HE2 LYS 96 4.520 -23.126 -10.503
10 HE3 LYS 96 HE3 LYS 96 5.212 -23.784 -9.021
11 HZ1 LYS 96 HZ1 LYS 96 2.960 -24.202 -8.218
12 HZ2 LYS 96 HZ2 LYS 96 2.319 -23.604 -9.665
13 HZ3 LYS 96 HZ3 LYS 96 3.254 -25.013 -9.670
No H/Q in entry = 13
In of MODEL 4
1 H VAL 97 H VAL 97 4.319 -16.896 -7.306
2 HA VAL 97 HA VAL 97 3.265 -15.031 -9.211
3 HB VAL 97 HB VAL 97 4.288 -14.767 -6.393
4 HG11 VAL 97 HG11 VAL 97 3.418 -12.507 -8.182
5 HG12 VAL 97 HG12 VAL 97 3.714 -12.391 -6.448
6 HG13 VAL 97 HG13 VAL 97 5.041 -12.769 -7.545
7 HG21 VAL 97 HG21 VAL 97 2.034 -15.648 -6.783
8 HG22 VAL 97 HG22 VAL 97 2.017 -14.105 -5.924
9 HG23 VAL 97 HG23 VAL 97 1.615 -14.160 -7.643
No H/Q in entry = 9
In of MODEL 4
1 H GLU 98 H GLU 98 6.456 -15.849 -7.955
2 HA GLU 98 HA GLU 98 7.794 -13.591 -9.033
3 HB2 GLU 98 HB2 GLU 98 8.893 -16.305 -8.282
4 HB3 GLU 98 HB3 GLU 98 9.866 -14.882 -8.641
5 HG2 GLU 98 HG2 GLU 98 8.712 -13.722 -6.753
6 HG3 GLU 98 HG3 GLU 98 7.962 -15.263 -6.346
No H/Q in entry = 6
In of MODEL 4
1 H GLU 99 H GLU 99 6.772 -16.619 -10.371
2 HA GLU 99 HA GLU 99 8.326 -16.291 -12.800
3 HB2 GLU 99 HB2 GLU 99 5.956 -18.106 -12.297
4 HB3 GLU 99 HB3 GLU 99 7.100 -18.220 -13.626
5 HG2 GLU 99 HG2 GLU 99 7.679 -18.695 -10.713
6 HG3 GLU 99 HG3 GLU 99 7.561 -19.914 -11.979
No H/Q in entry = 6
In of MODEL 4
1 H ALA 100 H ALA 100 5.105 -15.677 -11.616
2 HA ALA 100 HA ALA 100 3.859 -14.876 -13.995
3 HB1 ALA 100 HB1 ALA 100 3.404 -14.029 -11.135
4 HB2 ALA 100 HB2 ALA 100 2.611 -15.356 -11.982
5 HB3 ALA 100 HB3 ALA 100 2.304 -13.689 -12.465
No H/Q in entry = 5
In of MODEL 4
1 H LEU 101 H LEU 101 5.302 -12.896 -11.421
2 HA LEU 101 HA LEU 101 5.152 -10.473 -12.888
3 HB2 LEU 101 HB2 LEU 101 6.836 -11.157 -10.479
4 HB3 LEU 101 HB3 LEU 101 6.509 -9.540 -11.073
5 HG LEU 101 HG LEU 101 4.491 -11.454 -9.909
6 HD11 LEU 101 HD11 LEU 101 5.969 -10.460 -8.258
7 HD12 LEU 101 HD12 LEU 101 5.606 -8.852 -8.885
8 HD13 LEU 101 HD13 LEU 101 4.338 -9.809 -8.118
9 HD21 LEU 101 HD21 LEU 101 4.126 -8.654 -10.966
10 HD22 LEU 101 HD22 LEU 101 3.488 -10.131 -11.689
11 HD23 LEU 101 HD23 LEU 101 2.904 -9.597 -10.111
No H/Q in entry = 11
In of MODEL 4
1 H HIS 102 H HIS 102 7.221 -13.090 -13.176
2 HA HIS 102 HA HIS 102 9.430 -11.529 -14.183
3 HB2 HIS 102 HB2 HIS 102 9.575 -13.867 -13.097
4 HB3 HIS 102 HB3 HIS 102 9.023 -14.474 -14.652
5 HD1 HIS 102 HD1 HIS 102 10.677 -14.195 -16.679
6 HD2 HIS 102 HD2 HIS 102 12.203 -13.116 -12.965
7 HE1 HIS 102 HE1 HIS 102 13.164 -14.007 -17.001
8 HE2 HIS 102 HE2 HIS 102 14.068 -13.300 -14.755
No H/Q in entry = 8
In of MODEL 4
1 H ALA 103 H ALA 103 6.798 -13.545 -15.389
2 HA ALA 103 HA ALA 103 7.622 -13.600 -18.066
3 HB1 ALA 103 HB1 ALA 103 4.903 -14.119 -16.879
4 HB2 ALA 103 HB2 ALA 103 6.211 -15.292 -17.016
5 HB3 ALA 103 HB3 ALA 103 5.456 -14.641 -18.473
No H/Q in entry = 5
In of MODEL 4
1 H VAL 104 H VAL 104 6.271 -11.000 -16.399
2 HA VAL 104 HA VAL 104 4.409 -10.139 -18.331
3 HB VAL 104 HB VAL 104 3.915 -9.384 -16.235
4 HG11 VAL 104 HG11 VAL 104 6.786 -8.620 -15.883
5 HG12 VAL 104 HG12 VAL 104 5.510 -8.301 -14.716
6 HG13 VAL 104 HG13 VAL 104 5.931 -9.961 -15.127
7 HG21 VAL 104 HG21 VAL 104 3.812 -7.518 -17.849
8 HG22 VAL 104 HG22 VAL 104 4.088 -6.980 -16.191
9 HG23 VAL 104 HG23 VAL 104 5.424 -7.036 -17.337
No H/Q in entry = 9
In of MODEL 4
1 H THR 105 H THR 105 7.346 -8.412 -17.326
2 HA THR 105 HA THR 105 9.074 -7.508 -18.438
3 HB THR 105 HB THR 105 9.820 -8.327 -20.547
4 HG1 THR 105 HG1 THR 105 7.126 -9.054 -20.897
5 HG21 THR 105 HG21 THR 105 10.051 -9.862 -18.669
6 HG22 THR 105 HG22 THR 105 8.469 -10.555 -19.028
7 HG23 THR 105 HG23 THR 105 9.797 -10.745 -20.175
No H/Q in entry = 7
In of MODEL 4
1 H ASP 106 H ASP 106 5.998 -6.644 -19.015
2 HA ASP 106 HA ASP 106 6.616 -4.592 -20.932
3 HB2 ASP 106 HB2 ASP 106 4.320 -5.518 -20.699
4 HB3 ASP 106 HB3 ASP 106 4.235 -4.843 -19.076
No H/Q in entry = 4
In of MODEL 4
1 H GLU 107 H GLU 107 7.244 -2.551 -20.518
2 HA GLU 107 HA GLU 107 8.969 -2.368 -18.352
3 HB2 GLU 107 HB2 GLU 107 7.991 -0.143 -20.136
4 HB3 GLU 107 HB3 GLU 107 9.405 -0.073 -19.098
5 HG2 GLU 107 HG2 GLU 107 10.375 -1.958 -20.377
6 HG3 GLU 107 HG3 GLU 107 8.996 -1.870 -21.472
No H/Q in entry = 6
In of MODEL 4
1 H GLU 108 H GLU 108 6.038 -0.421 -18.913
2 HA GLU 108 HA GLU 108 6.141 1.030 -16.531
3 HB2 GLU 108 HB2 GLU 108 3.776 0.222 -18.233
4 HB3 GLU 108 HB3 GLU 108 3.661 1.338 -16.885
5 HG2 GLU 108 HG2 GLU 108 3.755 2.563 -18.948
6 HG3 GLU 108 HG3 GLU 108 5.227 2.851 -18.025
No H/Q in entry = 6
In of MODEL 4
1 H LYS 109 H LYS 109 4.677 -2.074 -17.282
2 HA LYS 109 HA LYS 109 3.332 -2.519 -14.870
3 HB2 LYS 109 HB2 LYS 109 4.396 -4.276 -17.033
4 HB3 LYS 109 HB3 LYS 109 3.796 -5.004 -15.551
5 HG2 LYS 109 HG2 LYS 109 2.186 -4.803 -17.501
6 HG3 LYS 109 HG3 LYS 109 1.615 -4.268 -15.929
7 HD2 LYS 109 HD2 LYS 109 1.847 -1.992 -16.518
8 HD3 LYS 109 HD3 LYS 109 2.790 -2.386 -17.959
9 HE2 LYS 109 HE2 LYS 109 -0.086 -3.182 -17.548
10 HE3 LYS 109 HE3 LYS 109 0.420 -1.728 -18.406
11 HZ1 LYS 109 HZ1 LYS 109 1.680 -3.175 -19.934
12 HZ2 LYS 109 HZ2 LYS 109 1.039 -4.533 -19.156
13 HZ3 LYS 109 HZ3 LYS 109 0.010 -3.471 -19.977
No H/Q in entry = 13
In of MODEL 4
1 H LYS 110 H LYS 110 6.631 -3.364 -15.878
2 HA LYS 110 HA LYS 110 7.244 -4.638 -13.394
3 HB2 LYS 110 HB2 LYS 110 9.104 -3.662 -15.556
4 HB3 LYS 110 HB3 LYS 110 9.567 -4.686 -14.209
5 HG2 LYS 110 HG2 LYS 110 7.798 -6.309 -15.117
6 HG3 LYS 110 HG3 LYS 110 7.892 -5.342 -16.590
7 HD2 LYS 110 HD2 LYS 110 10.262 -6.626 -15.237
8 HD3 LYS 110 HD3 LYS 110 9.383 -7.346 -16.581
9 HE2 LYS 110 HE2 LYS 110 11.174 -6.324 -17.636
10 HE3 LYS 110 HE3 LYS 110 9.901 -5.118 -17.800
11 HZ1 LYS 110 HZ1 LYS 110 12.054 -5.098 -15.750
12 HZ2 LYS 110 HZ2 LYS 110 11.998 -4.123 -17.129
13 HZ3 LYS 110 HZ3 LYS 110 10.843 -3.928 -15.912
No H/Q in entry = 13
In of MODEL 4
1 H GLN 111 H GLN 111 7.190 -1.409 -14.445
2 HA GLN 111 HA GLN 111 8.952 -0.285 -12.529
3 HB2 GLN 111 HB2 GLN 111 6.486 0.806 -13.881
4 HB3 GLN 111 HB3 GLN 111 7.427 1.755 -12.744
5 HG2 GLN 111 HG2 GLN 111 8.407 0.581 -15.336
6 HG3 GLN 111 HG3 GLN 111 8.037 2.274 -15.029
7 HE21 GLN 111 HE21 GLN 111 9.235 2.281 -12.367
8 HE22 GLN 111 HE22 GLN 111 10.942 2.229 -12.609
No H/Q in entry = 8
In of MODEL 4
1 H TYR 112 H TYR 112 5.577 -1.287 -12.413
2 HA TYR 112 HA TYR 112 5.210 -0.441 -9.677
3 HB2 TYR 112 HB2 TYR 112 3.590 -2.344 -11.376
4 HB3 TYR 112 HB3 TYR 112 3.109 -1.745 -9.797
5 HD1 TYR 112 HD1 TYR 112 3.393 1.021 -9.745
6 HD2 TYR 112 HD2 TYR 112 2.453 -1.398 -13.108
7 HE1 TYR 112 HE1 TYR 112 2.309 2.950 -10.819
8 HE2 TYR 112 HE2 TYR 112 1.358 0.512 -14.191
9 HH TYR 112 HH TYR 112 1.685 3.725 -13.009
No H/Q in entry = 9
In of MODEL 4
1 H ILE 113 H ILE 113 6.284 -3.308 -11.361
2 HA ILE 113 HA ILE 113 6.134 -5.057 -9.157
3 HB ILE 113 HB ILE 113 7.876 -5.153 -11.611
4 HG12 ILE 113 HG12 ILE 113 5.335 -6.593 -10.821
5 HG13 ILE 113 HG13 ILE 113 5.451 -5.280 -11.987
6 HG21 ILE 113 HG21 ILE 113 7.432 -7.269 -9.506
7 HG22 ILE 113 HG22 ILE 113 8.237 -7.528 -11.052
8 HG23 ILE 113 HG23 ILE 113 8.949 -6.442 -9.858
9 HD11 ILE 113 HD11 ILE 113 6.795 -7.947 -12.274
10 HD12 ILE 113 HD12 ILE 113 5.261 -7.496 -13.018
11 HD13 ILE 113 HD13 ILE 113 6.738 -6.651 -13.465
No H/Q in entry = 11
In of MODEL 4
1 H ALA 114 H ALA 114 8.734 -2.952 -10.363
2 HA ALA 114 HA ALA 114 10.601 -3.604 -8.286
3 HB1 ALA 114 HB1 ALA 114 11.343 -2.686 -10.420
4 HB2 ALA 114 HB2 ALA 114 11.833 -1.642 -9.086
5 HB3 ALA 114 HB3 ALA 114 10.461 -1.194 -10.099
No H/Q in entry = 5
In of MODEL 4
1 H ASP 115 H ASP 115 8.216 -1.046 -8.783
2 HA ASP 115 HA ASP 115 8.988 0.355 -6.412
3 HB2 ASP 115 HB2 ASP 115 6.848 0.694 -8.445
4 HB3 ASP 115 HB3 ASP 115 6.601 1.453 -6.874
No H/Q in entry = 4
In of MODEL 4
1 H PHE 116 H PHE 116 6.134 -1.596 -7.210
2 HA PHE 116 HA PHE 116 5.310 -1.287 -4.423
3 HB2 PHE 116 HB2 PHE 116 3.868 -1.096 -6.815
4 HB3 PHE 116 HB3 PHE 116 3.386 -2.647 -6.138
5 HD1 PHE 116 HD1 PHE 116 2.295 -2.769 -3.972
6 HD2 PHE 116 HD2 PHE 116 3.217 0.957 -5.804
7 HE1 PHE 116 HE1 PHE 116 0.726 -1.626 -2.442
8 HE2 PHE 116 HE2 PHE 116 1.661 2.106 -4.285
9 HZ PHE 116 HZ PHE 116 0.403 0.836 -2.626
No H/Q in entry = 9
In of MODEL 4
1 H GLY 117 H GLY 117 6.504 -3.612 -6.638
2 HA2 GLY 117 HA2 GLY 117 7.003 -5.848 -6.399
3 HA3 GLY 117 HA3 GLY 117 5.354 -5.989 -5.820
No H/Q in entry = 3
In of MODEL 4
1 HA PRO 118 HA PRO 118 8.882 -6.884 -2.564
2 HB2 PRO 118 HB2 PRO 118 9.791 -4.095 -2.065
3 HB3 PRO 118 HB3 PRO 118 10.726 -5.594 -2.100
4 HG2 PRO 118 HG2 PRO 118 10.862 -3.897 -4.130
5 HG3 PRO 118 HG3 PRO 118 10.810 -5.645 -4.423
6 HD2 PRO 118 HD2 PRO 118 8.642 -3.605 -4.715
7 HD3 PRO 118 HD3 PRO 118 9.011 -5.014 -5.730
No H/Q in entry = 7
In of MODEL 4
1 H ALA 119 H ALA 119 7.548 -3.607 -2.133
2 HA ALA 119 HA ALA 119 6.964 -3.902 0.632
3 HB1 ALA 119 HB1 ALA 119 5.697 -1.845 0.372
4 HB2 ALA 119 HB2 ALA 119 5.778 -1.997 -1.383
5 HB3 ALA 119 HB3 ALA 119 7.253 -1.727 -0.451
No H/Q in entry = 5
In of MODEL 4
1 H CYS 120 H CYS 120 5.134 -4.497 -2.296
2 HA CYS 120 HA CYS 120 2.626 -5.045 -1.161
3 HB2 CYS 120 HB2 CYS 120 2.934 -4.802 -3.570
4 HB3 CYS 120 HB3 CYS 120 3.934 -6.250 -3.609
No H/Q in entry = 4
In of MODEL 4
1 H LYS 121 H LYS 121 5.566 -6.927 -1.329
2 HA LYS 121 HA LYS 121 4.469 -9.445 -0.758
3 HB2 LYS 121 HB2 LYS 121 7.146 -8.248 -0.703
4 HB3 LYS 121 HB3 LYS 121 6.929 -9.593 0.402
5 HG2 LYS 121 HG2 LYS 121 7.800 -10.223 -1.843
6 HG3 LYS 121 HG3 LYS 121 6.322 -11.063 -1.367
7 HD2 LYS 121 HD2 LYS 121 5.008 -9.508 -2.721
8 HD3 LYS 121 HD3 LYS 121 6.485 -8.671 -3.200
9 HE2 LYS 121 HE2 LYS 121 5.789 -11.544 -3.774
10 HE3 LYS 121 HE3 LYS 121 5.742 -10.218 -4.932
11 HZ1 LYS 121 HZ1 LYS 121 8.133 -9.945 -4.655
12 HZ2 LYS 121 HZ2 LYS 121 8.173 -11.228 -3.557
13 HZ3 LYS 121 HZ3 LYS 121 7.762 -11.511 -5.168
No H/Q in entry = 13
In of MODEL 4
1 H LYS 122 H LYS 122 5.699 -6.954 1.516
2 HA LYS 122 HA LYS 122 4.891 -8.467 3.801
3 HB2 LYS 122 HB2 LYS 122 5.314 -6.522 5.120
4 HB3 LYS 122 HB3 LYS 122 6.580 -6.643 3.913
5 HG2 LYS 122 HG2 LYS 122 5.393 -4.925 2.574
6 HG3 LYS 122 HG3 LYS 122 4.251 -4.743 3.910
7 HD2 LYS 122 HD2 LYS 122 7.236 -4.313 4.063
8 HD3 LYS 122 HD3 LYS 122 6.013 -3.044 4.009
9 HE2 LYS 122 HE2 LYS 122 5.157 -3.659 6.133
10 HE3 LYS 122 HE3 LYS 122 6.083 -5.157 6.150
11 HZ1 LYS 122 HZ1 LYS 122 7.282 -2.450 6.204
12 HZ2 LYS 122 HZ2 LYS 122 7.022 -3.410 7.570
13 HZ3 LYS 122 HZ3 LYS 122 8.099 -3.920 6.369
No H/Q in entry = 13
In of MODEL 4
1 H ILE 123 H ILE 123 3.298 -6.250 1.632
2 HA ILE 123 HA ILE 123 1.030 -5.712 3.193
3 HB ILE 123 HB ILE 123 1.374 -5.744 0.213
4 HG12 ILE 123 HG12 ILE 123 1.206 -3.530 2.267
5 HG13 ILE 123 HG13 ILE 123 2.669 -4.067 1.447
6 HG21 ILE 123 HG21 ILE 123 -0.978 -4.800 1.843
7 HG22 ILE 123 HG22 ILE 123 -0.751 -4.500 0.120
8 HG23 ILE 123 HG23 ILE 123 -0.965 -6.148 0.709
9 HD11 ILE 123 HD11 ILE 123 0.278 -2.863 0.101
10 HD12 ILE 123 HD12 ILE 123 1.754 -1.999 0.519
11 HD13 ILE 123 HD13 ILE 123 1.802 -3.307 -0.664
No H/Q in entry = 11
In of MODEL 4
1 H TYR 124 H TYR 124 1.619 -8.050 0.720
2 HA TYR 124 HA TYR 124 -0.700 -9.683 1.135
3 HB2 TYR 124 HB2 TYR 124 1.734 -9.788 -0.602
4 HB3 TYR 124 HB3 TYR 124 0.793 -11.258 -0.366
5 HD1 TYR 124 HD1 TYR 124 -0.659 -7.881 -0.481
6 HD2 TYR 124 HD2 TYR 124 0.031 -11.479 -2.638
7 HE1 TYR 124 HE1 TYR 124 -2.213 -7.126 -2.226
8 HE2 TYR 124 HE2 TYR 124 -1.521 -10.733 -4.391
9 HH TYR 124 HH TYR 124 -2.589 -7.550 -4.638
No H/Q in entry = 9
In of MODEL 4
1 H GLY 125 H GLY 125 0.805 -9.362 3.521
2 HA2 GLY 125 HA2 GLY 125 2.070 -10.528 5.142
3 HA3 GLY 125 HA3 GLY 125 3.224 -9.845 4.035
No H/Q in entry = 3
In of MODEL 4
1 H VAL 126 H VAL 126 2.528 -11.944 2.000
2 HA VAL 126 HA VAL 126 3.514 -14.422 2.794
3 HB VAL 126 HB VAL 126 4.472 -14.604 0.482
4 HG11 VAL 126 HG11 VAL 126 1.643 -13.582 0.666
5 HG12 VAL 126 HG12 VAL 126 2.315 -14.506 -0.678
6 HG13 VAL 126 HG13 VAL 126 2.170 -15.245 0.919
7 HG21 VAL 126 HG21 VAL 126 3.428 -11.784 0.204
8 HG22 VAL 126 HG22 VAL 126 5.120 -12.282 0.153
9 HG23 VAL 126 HG23 VAL 126 4.012 -12.794 -1.118
No H/Q in entry = 9
In of MODEL 4
1 H HIS 127 H HIS 127 5.110 -11.361 2.581
2 HA HIS 127 HA HIS 127 7.800 -12.191 2.469
3 HB2 HIS 127 HB2 HIS 127 6.908 -9.821 2.253
4 HB3 HIS 127 HB3 HIS 127 6.727 -9.810 3.998
5 HD1 HIS 127 HD1 HIS 127 8.763 -9.252 5.363
6 HD2 HIS 127 HD2 HIS 127 9.648 -9.941 1.362
7 HE1 HIS 127 HE1 HIS 127 11.174 -8.589 5.079
8 HE2 HIS 127 HE2 HIS 127 11.609 -8.809 2.607
No H/Q in entry = 8
In of MODEL 4
1 H THR 128 H THR 128 8.973 -13.302 3.917
2 HA THR 128 HA THR 128 7.829 -14.095 6.405
3 HB THR 128 HB THR 128 10.215 -15.073 6.735
4 HG1 THR 128 HG1 THR 128 11.439 -14.104 5.225
5 HG21 THR 128 HG21 THR 128 8.446 -15.975 4.462
6 HG22 THR 128 HG22 THR 128 9.673 -16.960 5.257
7 HG23 THR 128 HG23 THR 128 8.261 -16.412 6.160
No H/Q in entry = 7
In of MODEL 4
1 H SER 129 H SER 129 7.526 -12.316 7.682
2 HA SER 129 HA SER 129 9.677 -10.496 8.258
3 HB2 SER 129 HB2 SER 129 7.162 -9.942 8.210
4 HB3 SER 129 HB3 SER 129 7.080 -10.732 9.782
5 HG SER 129 HG SER 129 8.112 -9.104 10.680
No H/Q in entry = 5
In of MODEL 5
1 HA2 GLY -4 HA2 GLY -4 7.634 6.361 -13.488
2 HA3 GLY -4 HA3 GLY -4 8.888 7.568 -13.234
3 H1 GLY -4 H1 GLY -4 9.564 5.433 -12.375
4 H2 GLY -4 H2 GLY -4 8.207 5.362 -11.373
No H/Q in entry = 4
In of MODEL 5
1 H SER -3 H SER -3 6.806 8.868 -13.636
2 HA SER -3 HA SER -3 5.694 9.548 -11.003
3 HB2 SER -3 HB2 SER -3 7.016 11.309 -12.210
4 HB3 SER -3 HB3 SER -3 5.811 11.271 -13.494
5 HG SER -3 HG SER -3 5.742 12.553 -11.114
No H/Q in entry = 5
In of MODEL 5
1 HA PRO -2 HA PRO -2 1.765 8.125 -12.507
2 HB2 PRO -2 HB2 PRO -2 0.163 9.178 -10.618
3 HB3 PRO -2 HB3 PRO -2 1.255 7.828 -10.280
4 HG2 PRO -2 HG2 PRO -2 1.607 10.740 -9.702
5 HG3 PRO -2 HG3 PRO -2 1.964 9.345 -8.670
6 HD2 PRO -2 HD2 PRO -2 3.866 10.679 -10.098
7 HD3 PRO -2 HD3 PRO -2 3.985 8.956 -9.689
No H/Q in entry = 7
In of MODEL 5
1 H GLU -1 H GLU -1 2.647 10.186 -14.057
2 HA GLU -1 HA GLU -1 1.130 12.549 -14.045
3 HB2 GLU -1 HB2 GLU -1 3.195 12.187 -15.385
4 HB3 GLU -1 HB3 GLU -1 2.293 11.106 -16.439
5 HG2 GLU -1 HG2 GLU -1 0.750 13.059 -16.890
6 HG3 GLU -1 HG3 GLU -1 1.952 14.066 -16.087
No H/Q in entry = 6
In of MODEL 5
1 H PHE 0 H PHE 0 0.595 9.432 -15.598
2 HA PHE 0 HA PHE 0 -1.864 10.289 -16.817
3 HB2 PHE 0 HB2 PHE 0 -1.976 7.764 -17.389
4 HB3 PHE 0 HB3 PHE 0 -0.761 8.771 -18.169
5 HD1 PHE 0 HD1 PHE 0 1.590 8.580 -17.549
6 HD2 PHE 0 HD2 PHE 0 -1.384 6.091 -15.823
7 HE1 PHE 0 HE1 PHE 0 3.348 7.062 -16.727
8 HE2 PHE 0 HE2 PHE 0 0.363 4.563 -14.988
9 HZ PHE 0 HZ PHE 0 2.781 5.081 -15.489
No H/Q in entry = 9
In of MODEL 5
1 H HIS 1 H HIS 1 -1.348 9.976 -13.783
2 HA HIS 1 HA HIS 1 -2.497 9.420 -11.920
3 HB2 HIS 1 HB2 HIS 1 -4.724 9.713 -13.921
4 HB3 HIS 1 HB3 HIS 1 -5.053 9.308 -12.242
5 HD1 HIS 1 HD1 HIS 1 -6.315 11.567 -11.982
6 HD2 HIS 1 HD2 HIS 1 -2.271 11.944 -12.872
7 HE1 HIS 1 HE1 HIS 1 -5.733 13.962 -11.488
8 HE2 HIS 1 HE2 HIS 1 -3.298 14.184 -12.080
No H/Q in entry = 8
In of MODEL 5
1 H HIS 2 H HIS 2 -5.175 7.762 -12.852
2 HA HIS 2 HA HIS 2 -5.865 5.614 -12.736
3 HB2 HIS 2 HB2 HIS 2 -4.110 5.269 -14.534
4 HB3 HIS 2 HB3 HIS 2 -3.017 4.749 -13.260
5 HD1 HIS 2 HD1 HIS 2 -3.306 2.628 -15.147
6 HD2 HIS 2 HD2 HIS 2 -6.256 3.230 -12.276
7 HE1 HIS 2 HE1 HIS 2 -4.553 0.451 -14.991
8 HE2 HIS 2 HE2 HIS 2 -6.211 0.786 -13.127
No H/Q in entry = 8
In of MODEL 5
1 H PHE 3 H PHE 3 -2.617 5.787 -11.280
2 HA PHE 3 HA PHE 3 -3.808 4.793 -8.776
3 HB2 PHE 3 HB2 PHE 3 -1.009 4.246 -9.793
4 HB3 PHE 3 HB3 PHE 3 -1.664 3.707 -8.253
5 HD1 PHE 3 HD1 PHE 3 -4.090 2.467 -8.659
6 HD2 PHE 3 HD2 PHE 3 -0.801 2.590 -11.360
7 HE1 PHE 3 HE1 PHE 3 -4.901 0.409 -9.737
8 HE2 PHE 3 HE2 PHE 3 -1.611 0.531 -12.441
9 HZ PHE 3 HZ PHE 3 -3.603 -0.602 -11.597
No H/Q in entry = 9
In of MODEL 5
1 H THR 4 H THR 4 -4.054 6.708 -7.735
2 HA THR 4 HA THR 4 -1.605 8.208 -7.152
3 HB THR 4 HB THR 4 -3.030 10.317 -7.115
4 HG1 THR 4 HG1 THR 4 -4.922 10.256 -8.394
5 HG21 THR 4 HG21 THR 4 -2.564 8.969 -9.774
6 HG22 THR 4 HG22 THR 4 -2.837 10.696 -9.540
7 HG23 THR 4 HG23 THR 4 -1.395 9.933 -8.872
No H/Q in entry = 7
In of MODEL 5
1 H LEU 5 H LEU 5 -1.695 9.374 -5.127
2 HA LEU 5 HA LEU 5 -2.932 7.815 -3.110
3 HB2 LEU 5 HB2 LEU 5 -1.276 10.301 -3.097
4 HB3 LEU 5 HB3 LEU 5 -2.088 9.787 -1.633
5 HG LEU 5 HG LEU 5 -0.895 7.580 -1.859
6 HD11 LEU 5 HD11 LEU 5 0.676 9.097 -3.938
7 HD12 LEU 5 HD12 LEU 5 1.129 7.541 -3.240
8 HD13 LEU 5 HD13 LEU 5 -0.334 7.678 -4.217
9 HD21 LEU 5 HD21 LEU 5 -0.212 9.360 -0.315
10 HD22 LEU 5 HD22 LEU 5 1.160 8.430 -0.914
11 HD23 LEU 5 HD23 LEU 5 0.827 10.033 -1.568
No H/Q in entry = 11
In of MODEL 5
1 H GLU 6 H GLU 6 -3.701 10.965 -4.534
2 HA GLU 6 HA GLU 6 -5.949 11.527 -2.923
3 HB2 GLU 6 HB2 GLU 6 -5.508 12.041 -5.876
4 HB3 GLU 6 HB3 GLU 6 -6.826 12.724 -4.938
5 HG2 GLU 6 HG2 GLU 6 -5.235 13.917 -3.541
6 HG3 GLU 6 HG3 GLU 6 -3.898 13.204 -4.443
No H/Q in entry = 6
In of MODEL 5
1 H SER 7 H SER 7 -5.674 9.545 -5.933
2 HA SER 7 HA SER 7 -8.339 8.825 -6.071
3 HB2 SER 7 HB2 SER 7 -6.612 8.378 -7.815
4 HB3 SER 7 HB3 SER 7 -5.995 7.067 -6.813
5 HG SER 7 HG SER 7 -8.727 7.071 -7.417
No H/Q in entry = 5
In of MODEL 5
1 H SER 8 H SER 8 -6.039 7.848 -3.692
2 HA SER 8 HA SER 8 -7.679 5.550 -2.994
3 HB2 SER 8 HB2 SER 8 -4.988 6.332 -1.902
4 HB3 SER 8 HB3 SER 8 -5.894 4.861 -1.513
5 HG SER 8 HG SER 8 -4.973 5.609 -4.105
No H/Q in entry = 5
In of MODEL 5
1 H LEU 9 H LEU 9 -7.264 8.808 -1.899
2 HA LEU 9 HA LEU 9 -7.114 8.510 0.806
3 HB2 LEU 9 HB2 LEU 9 -8.458 10.667 -0.764
4 HB3 LEU 9 HB3 LEU 9 -8.058 10.777 0.943
5 HG LEU 9 HG LEU 9 -6.019 10.274 -1.209
6 HD11 LEU 9 HD11 LEU 9 -7.085 12.394 -1.565
7 HD12 LEU 9 HD12 LEU 9 -6.791 12.854 0.111
8 HD13 LEU 9 HD13 LEU 9 -5.432 12.613 -0.990
9 HD21 LEU 9 HD21 LEU 9 -5.756 11.089 1.683
10 HD22 LEU 9 HD22 LEU 9 -5.359 9.506 1.004
11 HD23 LEU 9 HD23 LEU 9 -4.425 10.933 0.538
No H/Q in entry = 11
In of MODEL 5
1 H ASP 10 H ASP 10 -10.025 8.505 -1.059
2 HA ASP 10 HA ASP 10 -11.751 8.231 1.265
3 HB2 ASP 10 HB2 ASP 10 -12.475 9.532 -0.710
4 HB3 ASP 10 HB3 ASP 10 -12.333 8.103 -1.707
No H/Q in entry = 4
In of MODEL 5
1 H THR 11 H THR 11 -9.847 6.182 -0.550
2 HA THR 11 HA THR 11 -11.699 3.967 -0.107
3 HB THR 11 HB THR 11 -10.899 2.937 -2.208
4 HG1 THR 11 HG1 THR 11 -9.891 4.826 -3.598
5 HG21 THR 11 HG21 THR 11 -12.053 5.727 -2.422
6 HG22 THR 11 HG22 THR 11 -12.045 4.541 -3.738
7 HG23 THR 11 HG23 THR 11 -12.948 4.212 -2.258
No H/Q in entry = 7
In of MODEL 5
1 H HIS 12 H HIS 12 -8.619 3.491 -1.596
2 HA HIS 12 HA HIS 12 -7.897 1.464 0.167
3 HB2 HIS 12 HB2 HIS 12 -5.785 2.964 -1.358
4 HB3 HIS 12 HB3 HIS 12 -5.885 1.247 -1.026
5 HD1 HIS 12 HD1 HIS 12 -6.007 3.319 -3.810
6 HD2 HIS 12 HD2 HIS 12 -8.530 0.336 -2.401
7 HE1 HIS 12 HE1 HIS 12 -7.318 2.530 -5.814
8 HE2 HIS 12 HE2 HIS 12 -8.908 0.790 -4.922
No H/Q in entry = 8
In of MODEL 5
1 H LEU 13 H LEU 13 -7.086 4.914 0.281
2 HA LEU 13 HA LEU 13 -5.243 4.318 2.500
3 HB2 LEU 13 HB2 LEU 13 -5.354 6.656 0.616
4 HB3 LEU 13 HB3 LEU 13 -4.326 6.602 2.034
5 HG LEU 13 HG LEU 13 -4.168 4.751 -0.346
6 HD11 LEU 13 HD11 LEU 13 -3.340 7.006 -0.782
7 HD12 LEU 13 HD12 LEU 13 -2.293 6.898 0.632
8 HD13 LEU 13 HD13 LEU 13 -2.026 5.832 -0.745
9 HD21 LEU 13 HD21 LEU 13 -2.517 4.848 2.176
10 HD22 LEU 13 HD22 LEU 13 -3.589 3.543 1.668
11 HD23 LEU 13 HD23 LEU 13 -2.129 3.894 0.745
No H/Q in entry = 11
In of MODEL 5
1 H LYS 14 H LYS 14 -8.175 4.663 2.583
2 HA LYS 14 HA LYS 14 -8.825 7.212 3.628
3 HB2 LYS 14 HB2 LYS 14 -11.000 6.329 4.012
4 HB3 LYS 14 HB3 LYS 14 -10.415 5.633 2.514
5 HG2 LYS 14 HG2 LYS 14 -9.773 3.593 3.826
6 HG3 LYS 14 HG3 LYS 14 -10.622 4.298 5.201
7 HD2 LYS 14 HD2 LYS 14 -11.789 3.520 2.530
8 HD3 LYS 14 HD3 LYS 14 -12.111 2.777 4.094
9 HE2 LYS 14 HE2 LYS 14 -13.094 4.929 4.853
10 HE3 LYS 14 HE3 LYS 14 -12.860 5.566 3.224
11 HZ1 LYS 14 HZ1 LYS 14 -14.307 3.789 2.396
12 HZ2 LYS 14 HZ2 LYS 14 -14.582 3.264 3.978
13 HZ3 LYS 14 HZ3 LYS 14 -15.108 4.796 3.490
No H/Q in entry = 13
In of MODEL 5
1 H TRP 15 H TRP 15 -7.402 4.467 5.033
2 HA TRP 15 HA TRP 15 -8.278 4.905 7.727
3 HB2 TRP 15 HB2 TRP 15 -6.516 3.226 8.288
4 HB3 TRP 15 HB3 TRP 15 -7.650 2.666 7.061
5 HD1 TRP 15 HD1 TRP 15 -6.740 2.460 4.556
6 HE1 TRP 15 HE1 TRP 15 -4.362 2.211 3.612
7 HE3 TRP 15 HE3 TRP 15 -4.083 3.898 8.675
8 HZ2 TRP 15 HZ2 TRP 15 -1.701 2.578 4.501
9 HZ3 TRP 15 HZ3 TRP 15 -1.627 3.921 8.546
10 HH2 TRP 15 HH2 TRP 15 -0.462 3.274 6.502
No H/Q in entry = 10
In of MODEL 5
1 H LEU 16 H LEU 16 -6.095 6.493 5.726
2 HA LEU 16 HA LEU 16 -4.206 7.307 7.729
3 HB2 LEU 16 HB2 LEU 16 -4.929 8.532 5.057
4 HB3 LEU 16 HB3 LEU 16 -3.629 9.104 6.079
5 HG LEU 16 HG LEU 16 -3.721 6.323 4.889
6 HD11 LEU 16 HD11 LEU 16 -3.615 8.120 3.169
7 HD12 LEU 16 HD12 LEU 16 -2.134 8.704 3.935
8 HD13 LEU 16 HD13 LEU 16 -2.184 7.090 3.220
9 HD21 LEU 16 HD21 LEU 16 -1.515 7.902 6.220
10 HD22 LEU 16 HD22 LEU 16 -2.308 6.455 6.852
11 HD23 LEU 16 HD23 LEU 16 -1.299 6.354 5.405
No H/Q in entry = 11
In of MODEL 5
1 H SER 17 H SER 17 -4.265 9.084 9.004
2 HA SER 17 HA SER 17 -6.842 10.239 9.505
3 HB2 SER 17 HB2 SER 17 -4.207 11.192 10.621
4 HB3 SER 17 HB3 SER 17 -5.805 11.423 11.312
5 HG SER 17 HG SER 17 -5.882 9.067 11.465
No H/Q in entry = 5
In of MODEL 5
1 H GLN 18 H GLN 18 -7.229 12.661 9.476
2 HA GLN 18 HA GLN 18 -6.848 13.615 6.893
3 HB2 GLN 18 HB2 GLN 18 -7.458 15.176 9.411
4 HB3 GLN 18 HB3 GLN 18 -7.555 15.849 7.789
5 HG2 GLN 18 HG2 GLN 18 -9.190 13.571 8.883
6 HG3 GLN 18 HG3 GLN 18 -9.749 15.212 8.568
7 HE21 GLN 18 HE21 GLN 18 -10.032 15.894 6.437
8 HE22 GLN 18 HE22 GLN 18 -10.144 14.770 5.127
No H/Q in entry = 8
In of MODEL 5
1 H GLU 19 H GLU 19 -5.039 14.477 9.834
2 HA GLU 19 HA GLU 19 -3.311 16.300 8.650
3 HB2 GLU 19 HB2 GLU 19 -1.903 15.912 10.579
4 HB3 GLU 19 HB3 GLU 19 -3.569 16.026 11.068
5 HG2 GLU 19 HG2 GLU 19 -3.688 13.627 11.313
6 HG3 GLU 19 HG3 GLU 19 -2.032 13.461 10.727
No H/Q in entry = 6
In of MODEL 5
1 H GLN 20 H GLN 20 -3.271 12.787 8.713
2 HA GLN 20 HA GLN 20 -0.611 12.538 7.692
3 HB2 GLN 20 HB2 GLN 20 -2.828 10.486 7.548
4 HB3 GLN 20 HB3 GLN 20 -1.096 10.189 7.459
5 HG2 GLN 20 HG2 GLN 20 -2.553 11.261 9.859
6 HG3 GLN 20 HG3 GLN 20 -2.051 9.590 9.640
7 HE21 GLN 20 HE21 GLN 20 0.042 9.034 10.023
8 HE22 GLN 20 HE22 GLN 20 1.227 10.138 10.640
No H/Q in entry = 8
In of MODEL 5
1 H LYS 21 H LYS 21 -3.866 12.401 6.258
2 HA LYS 21 HA LYS 21 -3.130 11.894 3.606
3 HB2 LYS 21 HB2 LYS 21 -5.385 13.624 4.642
4 HB3 LYS 21 HB3 LYS 21 -5.233 13.076 2.982
5 HG2 LYS 21 HG2 LYS 21 -5.432 10.757 3.731
6 HG3 LYS 21 HG3 LYS 21 -5.593 11.316 5.397
7 HD2 LYS 21 HD2 LYS 21 -7.618 12.531 4.818
8 HD3 LYS 21 HD3 LYS 21 -7.444 12.050 3.131
9 HE2 LYS 21 HE2 LYS 21 -7.752 9.725 3.731
10 HE3 LYS 21 HE3 LYS 21 -7.827 10.153 5.441
11 HZ1 LYS 21 HZ1 LYS 21 -9.825 11.442 4.991
12 HZ2 LYS 21 HZ2 LYS 21 -9.754 11.017 3.355
13 HZ3 LYS 21 HZ3 LYS 21 -10.033 9.829 4.523
No H/Q in entry = 13
In of MODEL 5
1 H ASP 22 H ASP 22 -3.529 14.960 5.298
2 HA ASP 22 HA ASP 22 -2.740 16.674 3.200
3 HB2 ASP 22 HB2 ASP 22 -3.982 17.418 5.190
4 HB3 ASP 22 HB3 ASP 22 -2.585 17.067 6.197
No H/Q in entry = 4
In of MODEL 5
1 H GLU 23 H GLU 23 -0.860 14.988 5.715
2 HA GLU 23 HA GLU 23 1.653 16.089 5.160
3 HB2 GLU 23 HB2 GLU 23 1.081 14.641 7.078
4 HB3 GLU 23 HB3 GLU 23 0.907 13.285 5.979
5 HG2 GLU 23 HG2 GLU 23 3.024 13.172 7.049
6 HG3 GLU 23 HG3 GLU 23 3.235 13.531 5.338
No H/Q in entry = 6
In of MODEL 5
1 H LEU 24 H LEU 24 0.088 13.153 3.835
2 HA LEU 24 HA LEU 24 2.201 12.457 2.113
3 HB2 LEU 24 HB2 LEU 24 -0.732 11.808 2.183
4 HB3 LEU 24 HB3 LEU 24 0.295 11.198 0.905
5 HG LEU 24 HG LEU 24 -0.202 9.654 2.874
6 HD11 LEU 24 HD11 LEU 24 2.651 10.170 2.089
7 HD12 LEU 24 HD12 LEU 24 2.062 8.719 2.905
8 HD13 LEU 24 HD13 LEU 24 1.503 9.105 1.274
9 HD21 LEU 24 HD21 LEU 24 1.579 11.622 4.215
10 HD22 LEU 24 HD22 LEU 24 0.107 10.844 4.806
11 HD23 LEU 24 HD23 LEU 24 1.606 9.924 4.672
No H/Q in entry = 11
In of MODEL 5
1 H LEU 25 H LEU 25 -0.768 14.332 1.544
2 HA LEU 25 HA LEU 25 -0.428 14.747 -1.207
3 HB2 LEU 25 HB2 LEU 25 -1.808 16.443 0.869
4 HB3 LEU 25 HB3 LEU 25 -1.913 16.731 -0.855
5 HG LEU 25 HG LEU 25 -2.891 14.265 0.585
6 HD11 LEU 25 HD11 LEU 25 -4.391 16.514 -0.747
7 HD12 LEU 25 HD12 LEU 25 -5.110 15.060 -0.059
8 HD13 LEU 25 HD13 LEU 25 -4.288 16.217 0.989
9 HD21 LEU 25 HD21 LEU 25 -2.981 15.014 -2.335
10 HD22 LEU 25 HD22 LEU 25 -2.095 13.672 -1.613
11 HD23 LEU 25 HD23 LEU 25 -3.856 13.667 -1.608
No H/Q in entry = 11
In of MODEL 5
1 H LYS 26 H LYS 26 0.812 16.510 1.567
2 HA LYS 26 HA LYS 26 1.834 18.755 0.175
3 HB2 LYS 26 HB2 LYS 26 1.509 18.668 2.632
4 HB3 LYS 26 HB3 LYS 26 2.833 17.518 2.746
5 HG2 LYS 26 HG2 LYS 26 3.564 19.755 3.343
6 HG3 LYS 26 HG3 LYS 26 4.376 19.201 1.877
7 HD2 LYS 26 HD2 LYS 26 2.831 20.508 0.515
8 HD3 LYS 26 HD3 LYS 26 1.983 21.039 1.967
9 HE2 LYS 26 HE2 LYS 26 4.000 22.160 2.748
10 HE3 LYS 26 HE3 LYS 26 4.877 21.597 1.327
11 HZ1 LYS 26 HZ1 LYS 26 2.516 23.400 1.272
12 HZ2 LYS 26 HZ2 LYS 26 4.125 23.891 1.093
13 HZ3 LYS 26 HZ3 LYS 26 3.411 22.891 -0.067
No H/Q in entry = 13
In of MODEL 5
1 H MET 27 H MET 27 3.326 15.683 1.138
2 HA MET 27 HA MET 27 5.835 16.178 0.052
3 HB2 MET 27 HB2 MET 27 4.427 13.518 0.264
4 HB3 MET 27 HB3 MET 27 6.153 13.752 0.021
5 HG2 MET 27 HG2 MET 27 5.864 15.190 2.238
6 HG3 MET 27 HG3 MET 27 4.513 14.082 2.458
7 HE1 MET 27 HE1 MET 27 5.856 11.557 0.808
8 HE2 MET 27 HE2 MET 27 6.487 10.616 2.157
9 HE3 MET 27 HE3 MET 27 4.884 11.346 2.264
No H/Q in entry = 9
In of MODEL 5
1 H LYS 28 H LYS 28 3.057 14.550 -1.538
2 HA LYS 28 HA LYS 28 4.331 14.029 -3.967
3 HB2 LYS 28 HB2 LYS 28 2.064 13.212 -3.075
4 HB3 LYS 28 HB3 LYS 28 1.409 14.723 -3.679
5 HG2 LYS 28 HG2 LYS 28 2.909 12.816 -5.449
6 HG3 LYS 28 HG3 LYS 28 1.177 12.669 -5.154
7 HD2 LYS 28 HD2 LYS 28 0.828 14.919 -6.040
8 HD3 LYS 28 HD3 LYS 28 2.565 15.090 -6.305
9 HE2 LYS 28 HE2 LYS 28 2.499 13.198 -7.868
10 HE3 LYS 28 HE3 LYS 28 0.759 13.059 -7.617
11 HZ1 LYS 28 HZ1 LYS 28 2.146 15.437 -8.733
12 HZ2 LYS 28 HZ2 LYS 28 1.300 14.283 -9.636
13 HZ3 LYS 28 HZ3 LYS 28 0.474 15.263 -8.537
No H/Q in entry = 13
In of MODEL 5
1 H LYS 29 H LYS 29 2.509 16.866 -2.875
2 HA LYS 29 HA LYS 29 2.710 18.225 -5.356
3 HB2 LYS 29 HB2 LYS 29 0.936 18.669 -3.701
4 HB3 LYS 29 HB3 LYS 29 2.135 19.386 -2.630
5 HG2 LYS 29 HG2 LYS 29 2.597 21.115 -4.288
6 HG3 LYS 29 HG3 LYS 29 1.410 20.393 -5.375
7 HD2 LYS 29 HD2 LYS 29 0.797 21.467 -2.629
8 HD3 LYS 29 HD3 LYS 29 0.542 22.351 -4.133
9 HE2 LYS 29 HE2 LYS 29 -1.008 20.609 -4.882
10 HE3 LYS 29 HE3 LYS 29 -0.752 19.735 -3.371
11 HZ1 LYS 29 HZ1 LYS 29 -1.904 22.456 -3.611
12 HZ2 LYS 29 HZ2 LYS 29 -2.779 21.045 -3.308
13 HZ3 LYS 29 HZ3 LYS 29 -1.666 21.614 -2.168
No H/Q in entry = 13
In of MODEL 5
1 H ASP 30 H ASP 30 4.775 18.158 -2.521
2 HA ASP 30 HA ASP 30 6.201 20.524 -3.332
3 HB2 ASP 30 HB2 ASP 30 5.894 19.823 -0.925
4 HB3 ASP 30 HB3 ASP 30 7.008 18.495 -1.228
No H/Q in entry = 4
In of MODEL 5
1 H GLY 31 H GLY 31 6.093 17.545 -4.513
2 HA2 GLY 31 HA2 GLY 31 8.574 18.002 -5.956
3 HA3 GLY 31 HA3 GLY 31 7.293 16.884 -6.406
No H/Q in entry = 3
In of MODEL 5
1 H LYS 32 H LYS 32 7.413 15.997 -3.456
2 HA LYS 32 HA LYS 32 9.870 14.591 -3.234
3 HB2 LYS 32 HB2 LYS 32 7.186 14.091 -1.926
4 HB3 LYS 32 HB3 LYS 32 8.673 13.257 -1.500
5 HG2 LYS 32 HG2 LYS 32 8.151 16.211 -1.220
6 HG3 LYS 32 HG3 LYS 32 8.189 15.026 0.087
7 HD2 LYS 32 HD2 LYS 32 10.552 14.540 -0.494
8 HD3 LYS 32 HD3 LYS 32 10.488 15.834 -1.691
9 HE2 LYS 32 HE2 LYS 32 9.941 17.430 0.103
10 HE3 LYS 32 HE3 LYS 32 10.086 16.127 1.281
11 HZ1 LYS 32 HZ1 LYS 32 12.405 15.843 0.594
12 HZ2 LYS 32 HZ2 LYS 32 12.253 17.147 -0.474
13 HZ3 LYS 32 HZ3 LYS 32 12.115 17.398 1.194
No H/Q in entry = 13
In of MODEL 5
1 H ALA 33 H ALA 33 10.183 12.382 -3.556
2 HA ALA 33 HA ALA 33 9.076 11.429 -6.004
3 HB1 ALA 33 HB1 ALA 33 11.390 10.946 -5.391
4 HB2 ALA 33 HB2 ALA 33 10.481 9.459 -5.655
5 HB3 ALA 33 HB3 ALA 33 10.833 9.996 -4.014
No H/Q in entry = 5
In of MODEL 5
1 H LYS 34 H LYS 34 7.822 9.573 -6.348
2 HA LYS 34 HA LYS 34 5.706 9.066 -4.593
3 HB2 LYS 34 HB2 LYS 34 6.025 8.508 -7.119
4 HB3 LYS 34 HB3 LYS 34 6.661 6.988 -6.513
5 HG2 LYS 34 HG2 LYS 34 4.576 6.569 -5.326
6 HG3 LYS 34 HG3 LYS 34 3.938 8.111 -5.892
7 HD2 LYS 34 HD2 LYS 34 3.028 6.446 -7.311
8 HD3 LYS 34 HD3 LYS 34 4.288 7.258 -8.242
9 HE2 LYS 34 HE2 LYS 34 4.442 4.874 -8.578
10 HE3 LYS 34 HE3 LYS 34 5.844 5.433 -7.668
11 HZ1 LYS 34 HZ1 LYS 34 4.690 4.710 -5.620
12 HZ2 LYS 34 HZ2 LYS 34 3.460 4.054 -6.573
13 HZ3 LYS 34 HZ3 LYS 34 5.030 3.428 -6.680
No H/Q in entry = 13
In of MODEL 5
1 H LYS 35 H LYS 35 8.870 7.586 -4.953
2 HA LYS 35 HA LYS 35 8.648 5.374 -3.286
3 HB2 LYS 35 HB2 LYS 35 10.962 7.221 -3.844
4 HB3 LYS 35 HB3 LYS 35 11.127 5.803 -2.822
5 HG2 LYS 35 HG2 LYS 35 10.311 5.815 -5.722
6 HG3 LYS 35 HG3 LYS 35 11.891 5.362 -5.084
7 HD2 LYS 35 HD2 LYS 35 9.274 3.956 -4.557
8 HD3 LYS 35 HD3 LYS 35 10.583 3.376 -5.581
9 HE2 LYS 35 HE2 LYS 35 12.048 3.214 -3.651
10 HE3 LYS 35 HE3 LYS 35 10.785 3.877 -2.614
11 HZ1 LYS 35 HZ1 LYS 35 9.409 1.940 -3.177
12 HZ2 LYS 35 HZ2 LYS 35 10.688 1.294 -4.070
13 HZ3 LYS 35 HZ3 LYS 35 10.844 1.501 -2.402
No H/Q in entry = 13
In of MODEL 5
1 H GLU 36 H GLU 36 8.592 8.725 -2.459
2 HA GLU 36 HA GLU 36 9.390 8.272 0.281
3 HB2 GLU 36 HB2 GLU 36 8.351 10.774 -1.050
4 HB3 GLU 36 HB3 GLU 36 9.073 10.676 0.553
5 HG2 GLU 36 HG2 GLU 36 11.132 9.761 -0.557
6 HG3 GLU 36 HG3 GLU 36 10.395 10.197 -2.089
No H/Q in entry = 6
In of MODEL 5
1 H LEU 37 H LEU 37 6.600 8.517 -1.637
2 HA LEU 37 HA LEU 37 4.719 8.779 0.504
3 HB2 LEU 37 HB2 LEU 37 4.314 7.868 -2.344
4 HB3 LEU 37 HB3 LEU 37 3.051 8.359 -1.230
5 HG LEU 37 HG LEU 37 5.270 10.199 -2.111
6 HD11 LEU 37 HD11 LEU 37 3.958 9.492 -4.037
7 HD12 LEU 37 HD12 LEU 37 2.480 9.980 -3.211
8 HD13 LEU 37 HD13 LEU 37 3.686 11.191 -3.649
9 HD21 LEU 37 HD21 LEU 37 4.171 10.795 -0.010
10 HD22 LEU 37 HD22 LEU 37 3.787 11.948 -1.287
11 HD23 LEU 37 HD23 LEU 37 2.602 10.733 -0.811
No H/Q in entry = 11
In of MODEL 5
1 H GLU 38 H GLU 38 5.865 6.073 -1.510
2 HA GLU 38 HA GLU 38 4.342 4.086 -0.189
3 HB2 GLU 38 HB2 GLU 38 6.839 3.957 -1.843
4 HB3 GLU 38 HB3 GLU 38 6.239 2.530 -1.013
5 HG2 GLU 38 HG2 GLU 38 5.235 2.250 -3.018
6 HG3 GLU 38 HG3 GLU 38 3.994 3.201 -2.208
No H/Q in entry = 6
In of MODEL 5
1 H ALA 39 H ALA 39 7.015 5.888 0.788
2 HA ALA 39 HA ALA 39 7.961 3.899 2.691
3 HB1 ALA 39 HB1 ALA 39 8.887 6.736 2.254
4 HB2 ALA 39 HB2 ALA 39 9.688 5.503 3.228
5 HB3 ALA 39 HB3 ALA 39 9.571 5.305 1.480
No H/Q in entry = 5
In of MODEL 5
1 H LYS 40 H LYS 40 6.400 7.045 2.702
2 HA LYS 40 HA LYS 40 6.156 7.317 5.484
3 HB2 LYS 40 HB2 LYS 40 5.847 9.098 3.714
4 HB3 LYS 40 HB3 LYS 40 4.269 8.396 3.390
5 HG2 LYS 40 HG2 LYS 40 3.981 10.271 4.828
6 HG3 LYS 40 HG3 LYS 40 3.660 8.806 5.756
7 HD2 LYS 40 HD2 LYS 40 4.975 10.206 7.142
8 HD3 LYS 40 HD3 LYS 40 6.045 8.936 6.565
9 HE2 LYS 40 HE2 LYS 40 6.974 10.419 4.899
10 HE3 LYS 40 HE3 LYS 40 5.835 11.686 5.350
11 HZ1 LYS 40 HZ1 LYS 40 6.857 11.750 7.549
12 HZ2 LYS 40 HZ2 LYS 40 7.965 10.561 7.084
13 HZ3 LYS 40 HZ3 LYS 40 7.991 12.076 6.339
No H/Q in entry = 13
In of MODEL 5
1 H ILE 41 H ILE 41 3.937 5.970 3.022
2 HA ILE 41 HA ILE 41 1.852 5.410 4.853
3 HB ILE 41 HB ILE 41 2.432 4.268 2.119
4 HG12 ILE 41 HG12 ILE 41 0.449 6.384 2.965
5 HG13 ILE 41 HG13 ILE 41 2.040 6.739 2.301
6 HG21 ILE 41 HG21 ILE 41 0.995 2.769 3.384
7 HG22 ILE 41 HG22 ILE 41 -0.083 4.108 3.770
8 HG23 ILE 41 HG23 ILE 41 0.089 3.569 2.099
9 HD11 ILE 41 HD11 ILE 41 -0.150 5.233 0.903
10 HD12 ILE 41 HD12 ILE 41 0.305 6.913 0.618
11 HD13 ILE 41 HD13 ILE 41 1.440 5.614 0.241
No H/Q in entry = 11
In of MODEL 5
1 H LEU 42 H LEU 42 4.433 3.426 3.436
2 HA LEU 42 HA LEU 42 3.727 1.007 4.640
3 HB2 LEU 42 HB2 LEU 42 6.267 2.129 3.560
4 HB3 LEU 42 HB3 LEU 42 6.311 0.616 4.434
5 HG LEU 42 HG LEU 42 4.793 1.211 1.897
6 HD11 LEU 42 HD11 LEU 42 7.196 0.816 1.643
7 HD12 LEU 42 HD12 LEU 42 7.019 -0.732 2.472
8 HD13 LEU 42 HD13 LEU 42 6.229 -0.465 0.917
9 HD21 LEU 42 HD21 LEU 42 4.698 -1.178 3.710
10 HD22 LEU 42 HD22 LEU 42 3.358 -0.198 3.115
11 HD23 LEU 42 HD23 LEU 42 4.241 -1.259 2.008
No H/Q in entry = 11
In of MODEL 5
1 H HIS 43 H HIS 43 5.678 3.695 5.827
2 HA HIS 43 HA HIS 43 6.463 2.453 8.242
3 HB2 HIS 43 HB2 HIS 43 7.425 4.601 7.293
4 HB3 HIS 43 HB3 HIS 43 5.984 5.414 7.895
5 HD1 HIS 43 HD1 HIS 43 6.076 6.201 10.269
6 HD2 HIS 43 HD2 HIS 43 8.956 3.321 9.444
7 HE1 HIS 43 HE1 HIS 43 7.489 6.045 12.340
8 HE2 HIS 43 HE2 HIS 43 9.283 4.365 11.788
No H/Q in entry = 8
In of MODEL 5
1 H TYR 44 H TYR 44 3.720 4.642 7.491
2 HA TYR 44 HA TYR 44 2.517 4.635 10.011
3 HB2 TYR 44 HB2 TYR 44 1.247 4.779 7.272
4 HB3 TYR 44 HB3 TYR 44 0.380 5.074 8.773
5 HD1 TYR 44 HD1 TYR 44 2.896 6.476 10.041
6 HD2 TYR 44 HD2 TYR 44 0.721 6.995 6.427
7 HE1 TYR 44 HE1 TYR 44 3.592 8.826 9.968
8 HE2 TYR 44 HE2 TYR 44 1.411 9.335 6.335
9 HH TYR 44 HH TYR 44 3.893 10.599 8.212
No H/Q in entry = 9
In of MODEL 5
1 H TYR 45 H TYR 45 2.209 2.442 7.307
2 HA TYR 45 HA TYR 45 0.194 0.772 8.232
3 HB2 TYR 45 HB2 TYR 45 0.955 0.749 5.933
4 HB3 TYR 45 HB3 TYR 45 2.569 0.270 6.433
5 HD1 TYR 45 HD1 TYR 45 -0.932 -0.901 6.694
6 HD2 TYR 45 HD2 TYR 45 3.153 -1.935 6.213
7 HE1 TYR 45 HE1 TYR 45 -1.572 -3.248 6.411
8 HE2 TYR 45 HE2 TYR 45 2.529 -4.295 5.921
9 HH TYR 45 HH TYR 45 0.685 -5.795 6.474
No H/Q in entry = 9
In of MODEL 5
1 H ASP 46 H ASP 46 3.711 0.587 8.683
2 HA ASP 46 HA ASP 46 3.513 -1.975 9.966
3 HB2 ASP 46 HB2 ASP 46 5.479 -0.932 8.553
4 HB3 ASP 46 HB3 ASP 46 5.975 -0.263 10.103
No H/Q in entry = 4
In of MODEL 5
1 H GLU 47 H GLU 47 3.231 1.250 11.044
2 HA GLU 47 HA GLU 47 3.868 0.508 13.794
3 HB2 GLU 47 HB2 GLU 47 3.613 2.908 14.281
4 HB3 GLU 47 HB3 GLU 47 4.836 2.585 13.063
5 HG2 GLU 47 HG2 GLU 47 3.421 3.312 11.330
6 HG3 GLU 47 HG3 GLU 47 2.021 3.364 12.395
No H/Q in entry = 6
In of MODEL 5
1 H LEU 48 H LEU 48 1.308 -0.051 12.005
2 HA LEU 48 HA LEU 48 -0.811 1.356 13.207
3 HB2 LEU 48 HB2 LEU 48 -0.628 -1.104 11.511
4 HB3 LEU 48 HB3 LEU 48 -2.167 -0.526 12.097
5 HG LEU 48 HG LEU 48 -0.277 1.029 10.355
6 HD11 LEU 48 HD11 LEU 48 -1.390 -0.823 9.202
7 HD12 LEU 48 HD12 LEU 48 -2.952 -0.215 9.752
8 HD13 LEU 48 HD13 LEU 48 -1.973 0.745 8.644
9 HD21 LEU 48 HD21 LEU 48 -2.960 1.689 11.545
10 HD22 LEU 48 HD22 LEU 48 -1.434 2.546 11.767
11 HD23 LEU 48 HD23 LEU 48 -2.242 2.579 10.199
No H/Q in entry = 11
In of MODEL 5
1 H GLU 49 H GLU 49 -2.583 -0.805 13.641
2 HA GLU 49 HA GLU 49 -1.826 -1.392 16.415
3 HB2 GLU 49 HB2 GLU 49 -4.530 -0.488 15.393
4 HB3 GLU 49 HB3 GLU 49 -4.192 -0.981 17.046
5 HG2 GLU 49 HG2 GLU 49 -2.968 1.376 15.631
6 HG3 GLU 49 HG3 GLU 49 -4.263 1.442 16.825
No H/Q in entry = 6
In of MODEL 5
1 H GLY 50 H GLY 50 -4.552 -2.642 16.738
2 HA2 GLY 50 HA2 GLY 50 -5.250 -4.848 16.726
3 HA3 GLY 50 HA3 GLY 50 -3.832 -5.259 15.776
No H/Q in entry = 3
In of MODEL 5
1 H ASP 51 H ASP 51 -7.105 -3.977 15.635
2 HA ASP 51 HA ASP 51 -7.534 -5.318 13.136
3 HB2 ASP 51 HB2 ASP 51 -9.806 -4.735 13.332
4 HB3 ASP 51 HB3 ASP 51 -9.270 -4.998 14.985
No H/Q in entry = 4
In of MODEL 5
1 H ALA 52 H ALA 52 -6.609 -2.125 14.080
2 HA ALA 52 HA ALA 52 -7.326 -0.690 11.747
3 HB1 ALA 52 HB1 ALA 52 -4.847 -0.315 13.442
4 HB2 ALA 52 HB2 ALA 52 -5.570 0.869 12.355
5 HB3 ALA 52 HB3 ALA 52 -6.430 0.366 13.812
No H/Q in entry = 5
In of MODEL 5
1 H LYS 53 H LYS 53 -4.498 -2.606 12.584
2 HA LYS 53 HA LYS 53 -3.069 -2.190 10.196
3 HB2 LYS 53 HB2 LYS 53 -2.385 -3.218 12.534
4 HB3 LYS 53 HB3 LYS 53 -2.823 -4.729 11.757
5 HG2 LYS 53 HG2 LYS 53 -0.902 -2.853 10.445
6 HG3 LYS 53 HG3 LYS 53 -0.366 -3.942 11.723
7 HD2 LYS 53 HD2 LYS 53 -1.258 -5.840 10.409
8 HD3 LYS 53 HD3 LYS 53 -1.657 -4.714 9.112
9 HE2 LYS 53 HE2 LYS 53 0.671 -4.131 8.848
10 HE3 LYS 53 HE3 LYS 53 1.113 -5.130 10.227
11 HZ1 LYS 53 HZ1 LYS 53 0.230 -7.057 8.957
12 HZ2 LYS 53 HZ2 LYS 53 0.067 -6.045 7.610
13 HZ3 LYS 53 HZ3 LYS 53 1.596 -6.342 8.273
No H/Q in entry = 13
In of MODEL 5
1 H LYS 54 H LYS 54 -5.173 -4.848 11.283
2 HA LYS 54 HA LYS 54 -5.149 -6.390 8.979
3 HB2 LYS 54 HB2 LYS 54 -6.626 -7.630 10.072
4 HB3 LYS 54 HB3 LYS 54 -6.495 -6.463 11.376
5 HG2 LYS 54 HG2 LYS 54 -8.457 -5.367 10.748
6 HG3 LYS 54 HG3 LYS 54 -8.464 -6.114 9.141
7 HD2 LYS 54 HD2 LYS 54 -8.892 -8.274 10.138
8 HD3 LYS 54 HD3 LYS 54 -8.832 -7.567 11.753
9 HE2 LYS 54 HE2 LYS 54 -10.767 -6.182 11.240
10 HE3 LYS 54 HE3 LYS 54 -10.811 -6.825 9.600
11 HZ1 LYS 54 HZ1 LYS 54 -11.200 -8.412 12.075
12 HZ2 LYS 54 HZ2 LYS 54 -12.430 -7.898 11.038
13 HZ3 LYS 54 HZ3 LYS 54 -11.279 -9.008 10.495
No H/Q in entry = 13
In of MODEL 5
1 H GLU 55 H GLU 55 -7.236 -3.602 9.749
2 HA GLU 55 HA GLU 55 -8.767 -3.773 7.394
3 HB2 GLU 55 HB2 GLU 55 -8.252 -1.604 9.425
4 HB3 GLU 55 HB3 GLU 55 -9.330 -1.352 8.076
5 HG2 GLU 55 HG2 GLU 55 -9.631 -3.486 10.164
6 HG3 GLU 55 HG3 GLU 55 -10.499 -1.959 10.128
No H/Q in entry = 6
In of MODEL 5
1 H ALA 56 H ALA 56 -6.002 -1.704 8.309
2 HA ALA 56 HA ALA 56 -5.902 -0.371 5.864
3 HB1 ALA 56 HB1 ALA 56 -3.598 0.218 6.430
4 HB2 ALA 56 HB2 ALA 56 -3.584 -1.019 7.688
5 HB3 ALA 56 HB3 ALA 56 -4.649 0.380 7.836
No H/Q in entry = 5
In of MODEL 5
1 H THR 57 H THR 57 -4.175 -3.277 6.958
2 HA THR 57 HA THR 57 -2.703 -3.897 4.738
3 HB THR 57 HB THR 57 -4.250 -5.830 6.482
4 HG1 THR 57 HG1 THR 57 -2.869 -4.729 7.781
5 HG21 THR 57 HG21 THR 57 -1.899 -6.270 4.644
6 HG22 THR 57 HG22 THR 57 -2.489 -7.446 5.819
7 HG23 THR 57 HG23 THR 57 -3.519 -6.946 4.478
No H/Q in entry = 7
In of MODEL 5
1 H GLU 58 H GLU 58 -6.080 -4.739 5.358
2 HA GLU 58 HA GLU 58 -6.526 -6.057 2.881
3 HB2 GLU 58 HB2 GLU 58 -8.198 -5.123 5.145
4 HB3 GLU 58 HB3 GLU 58 -9.007 -5.399 3.602
5 HG2 GLU 58 HG2 GLU 58 -8.030 -7.670 3.551
6 HG3 GLU 58 HG3 GLU 58 -7.354 -7.373 5.150
No H/Q in entry = 6
In of MODEL 5
1 H HIS 59 H HIS 59 -6.560 -2.690 3.782
2 HA HIS 59 HA HIS 59 -8.043 -1.907 1.430
3 HB2 HIS 59 HB2 HIS 59 -6.631 -0.371 3.591
4 HB3 HIS 59 HB3 HIS 59 -7.182 0.433 2.125
5 HD1 HIS 59 HD1 HIS 59 -9.920 -0.580 1.669
6 HD2 HIS 59 HD2 HIS 59 -8.464 0.128 5.502
7 HE1 HIS 59 HE1 HIS 59 -11.948 -0.276 3.118
8 HE2 HIS 59 HE2 HIS 59 -11.047 -0.012 5.454
No H/Q in entry = 8
In of MODEL 5
1 H LEU 60 H LEU 60 -4.649 -1.595 2.518
2 HA LEU 60 HA LEU 60 -3.592 -0.800 0.101
3 HB2 LEU 60 HB2 LEU 60 -2.458 -2.377 2.383
4 HB3 LEU 60 HB3 LEU 60 -1.507 -2.034 0.946
5 HG LEU 60 HG LEU 60 -1.983 0.371 1.318
6 HD11 LEU 60 HD11 LEU 60 -3.936 0.179 2.665
7 HD12 LEU 60 HD12 LEU 60 -2.977 -0.519 3.976
8 HD13 LEU 60 HD13 LEU 60 -2.698 1.150 3.466
9 HD21 LEU 60 HD21 LEU 60 -0.491 -1.056 3.500
10 HD22 LEU 60 HD22 LEU 60 0.161 -0.586 1.930
11 HD23 LEU 60 HD23 LEU 60 -0.314 0.652 3.091
No H/Q in entry = 11
In of MODEL 5
1 H LYS 61 H LYS 61 -4.514 -4.024 1.239
2 HA LYS 61 HA LYS 61 -3.457 -5.512 -0.877
3 HB2 LYS 61 HB2 LYS 61 -5.787 -5.906 0.966
4 HB3 LYS 61 HB3 LYS 61 -5.596 -6.976 -0.415
5 HG2 LYS 61 HG2 LYS 61 -3.416 -7.667 0.376
6 HG3 LYS 61 HG3 LYS 61 -3.516 -6.525 1.719
7 HD2 LYS 61 HD2 LYS 61 -5.401 -7.735 2.648
8 HD3 LYS 61 HD3 LYS 61 -5.419 -8.825 1.264
9 HE2 LYS 61 HE2 LYS 61 -3.269 -9.716 1.873
10 HE3 LYS 61 HE3 LYS 61 -3.095 -8.527 3.161
11 HZ1 LYS 61 HZ1 LYS 61 -5.176 -10.646 3.068
12 HZ2 LYS 61 HZ2 LYS 61 -3.763 -10.710 3.992
13 HZ3 LYS 61 HZ3 LYS 61 -4.936 -9.540 4.322
No H/Q in entry = 13
In of MODEL 5
1 H GLY 62 H GLY 62 -6.771 -4.201 -0.530
2 HA2 GLY 62 HA2 GLY 62 -8.212 -3.364 -2.105
3 HA3 GLY 62 HA3 GLY 62 -7.661 -4.692 -3.112
No H/Q in entry = 3
In of MODEL 5
1 H GLY 63 H GLY 63 -5.831 -1.884 -1.908
2 HA2 GLY 63 HA2 GLY 63 -4.503 -0.385 -3.033
3 HA3 GLY 63 HA3 GLY 63 -5.731 -0.425 -4.293
No H/Q in entry = 3
In of MODEL 5
1 H CYS 64 H CYS 64 -3.415 -2.817 -3.064
2 HA CYS 64 HA CYS 64 -1.796 -2.770 -5.404
3 HB2 CYS 64 HB2 CYS 64 -0.977 -3.421 -3.159
4 HB3 CYS 64 HB3 CYS 64 -1.975 -4.872 -3.238
No H/Q in entry = 4
In of MODEL 5
1 H ARG 65 H ARG 65 -4.642 -4.453 -4.458
2 HA ARG 65 HA ARG 65 -4.669 -6.578 -6.290
3 HB2 ARG 65 HB2 ARG 65 -6.210 -6.211 -4.337
4 HB3 ARG 65 HB3 ARG 65 -7.019 -4.970 -5.276
5 HG2 ARG 65 HG2 ARG 65 -7.610 -6.695 -6.955
6 HG3 ARG 65 HG3 ARG 65 -6.903 -7.913 -5.884
7 HD2 ARG 65 HD2 ARG 65 -8.446 -7.086 -4.086
8 HD3 ARG 65 HD3 ARG 65 -9.236 -6.096 -5.311
9 HE ARG 65 HE ARG 65 -9.281 -8.652 -6.312
10 HH11 ARG 65 HH11 ARG 65 -10.459 -7.013 -3.453
11 HH12 ARG 65 HH12 ARG 65 -11.765 -8.130 -3.194
12 HH21 ARG 65 HH21 ARG 65 -11.027 -10.117 -5.984
13 HH22 ARG 65 HH22 ARG 65 -12.087 -9.883 -4.630
No H/Q in entry = 13
In of MODEL 5
1 H GLU 66 H GLU 66 -5.257 -3.171 -6.638
2 HA GLU 66 HA GLU 66 -6.288 -3.507 -9.333
3 HB2 GLU 66 HB2 GLU 66 -5.718 -0.966 -7.797
4 HB3 GLU 66 HB3 GLU 66 -6.570 -1.084 -9.332
5 HG2 GLU 66 HG2 GLU 66 -7.477 -2.028 -6.631
6 HG3 GLU 66 HG3 GLU 66 -8.213 -0.806 -7.667
No H/Q in entry = 6
In of MODEL 5
1 H ILE 67 H ILE 67 -3.365 -2.651 -7.626
2 HA ILE 67 HA ILE 67 -2.077 -1.699 -10.029
3 HB ILE 67 HB ILE 67 -0.926 -2.228 -7.290
4 HG12 ILE 67 HG12 ILE 67 -1.560 0.374 -8.701
5 HG13 ILE 67 HG13 ILE 67 -2.539 -0.352 -7.432
6 HG21 ILE 67 HG21 ILE 67 0.745 -2.507 -9.117
7 HG22 ILE 67 HG22 ILE 67 0.390 -0.853 -9.636
8 HG23 ILE 67 HG23 ILE 67 1.096 -1.139 -8.047
9 HD11 ILE 67 HD11 ILE 67 0.297 0.604 -7.130
10 HD12 ILE 67 HD12 ILE 67 -1.150 1.450 -6.579
11 HD13 ILE 67 HD13 ILE 67 -0.704 -0.097 -5.858
No H/Q in entry = 11
In of MODEL 5
1 H LEU 68 H LEU 68 -1.062 -4.208 -7.709
2 HA LEU 68 HA LEU 68 0.811 -5.209 -9.602
3 HB2 LEU 68 HB2 LEU 68 1.215 -5.222 -7.165
4 HB3 LEU 68 HB3 LEU 68 -0.066 -6.403 -6.976
5 HG LEU 68 HG LEU 68 1.297 -7.923 -8.506
6 HD11 LEU 68 HD11 LEU 68 3.414 -5.875 -7.862
7 HD12 LEU 68 HD12 LEU 68 3.708 -7.458 -8.582
8 HD13 LEU 68 HD13 LEU 68 2.766 -6.253 -9.459
9 HD21 LEU 68 HD21 LEU 68 2.439 -7.138 -5.825
10 HD22 LEU 68 HD22 LEU 68 1.126 -8.281 -6.104
11 HD23 LEU 68 HD23 LEU 68 2.752 -8.651 -6.676
No H/Q in entry = 11
In of MODEL 5
1 H LYS 69 H LYS 69 -2.190 -6.452 -8.193
2 HA LYS 69 HA LYS 69 -2.229 -8.947 -9.360
3 HB2 LYS 69 HB2 LYS 69 -3.869 -7.980 -7.712
4 HB3 LYS 69 HB3 LYS 69 -4.604 -7.098 -9.034
5 HG2 LYS 69 HG2 LYS 69 -4.378 -10.075 -9.064
6 HG3 LYS 69 HG3 LYS 69 -5.709 -9.262 -8.256
7 HD2 LYS 69 HD2 LYS 69 -5.011 -8.802 -11.151
8 HD3 LYS 69 HD3 LYS 69 -6.144 -10.047 -10.624
9 HE2 LYS 69 HE2 LYS 69 -6.426 -7.115 -9.977
10 HE3 LYS 69 HE3 LYS 69 -7.213 -7.904 -11.340
11 HZ1 LYS 69 HZ1 LYS 69 -7.596 -8.662 -8.495
12 HZ2 LYS 69 HZ2 LYS 69 -8.662 -7.714 -9.397
13 HZ3 LYS 69 HZ3 LYS 69 -8.397 -9.323 -9.825
No H/Q in entry = 13
In of MODEL 5
1 H HIS 70 H HIS 70 -4.493 -6.569 -10.803
2 HA HIS 70 HA HIS 70 -4.459 -6.939 -13.334
3 HB2 HIS 70 HB2 HIS 70 -5.573 -5.049 -12.681
4 HB3 HIS 70 HB3 HIS 70 -4.219 -4.436 -11.749
5 HD1 HIS 70 HD1 HIS 70 -5.944 -4.068 -14.944
6 HD2 HIS 70 HD2 HIS 70 -2.179 -3.158 -13.404
7 HE1 HIS 70 HE1 HIS 70 -4.963 -2.363 -16.513
8 HE2 HIS 70 HE2 HIS 70 -2.658 -1.890 -15.612
No H/Q in entry = 8
In of MODEL 5
1 H VAL 71 H VAL 71 -1.426 -5.807 -11.818
2 HA VAL 71 HA VAL 71 -0.384 -4.968 -14.327
3 HB VAL 71 HB VAL 71 0.138 -4.148 -11.891
4 HG11 VAL 71 HG11 VAL 71 1.242 -6.287 -11.277
5 HG12 VAL 71 HG12 VAL 71 2.527 -5.860 -12.412
6 HG13 VAL 71 HG13 VAL 71 2.194 -4.820 -11.019
7 HG21 VAL 71 HG21 VAL 71 1.939 -4.175 -14.250
8 HG22 VAL 71 HG22 VAL 71 0.764 -2.952 -13.778
9 HG23 VAL 71 HG23 VAL 71 2.233 -3.184 -12.827
No H/Q in entry = 9
In of MODEL 5
1 H VAL 72 H VAL 72 0.249 -7.889 -12.323
2 HA VAL 72 HA VAL 72 1.644 -9.097 -14.570
3 HB VAL 72 HB VAL 72 1.918 -9.910 -12.170
4 HG11 VAL 72 HG11 VAL 72 -0.797 -11.087 -12.667
5 HG12 VAL 72 HG12 VAL 72 0.287 -11.585 -11.369
6 HG13 VAL 72 HG13 VAL 72 -0.342 -9.937 -11.406
7 HG21 VAL 72 HG21 VAL 72 2.720 -11.158 -14.088
8 HG22 VAL 72 HG22 VAL 72 2.168 -12.222 -12.796
9 HG23 VAL 72 HG23 VAL 72 1.154 -11.957 -14.214
No H/Q in entry = 9
In of MODEL 5
1 H GLY 73 H GLY 73 -1.569 -8.470 -13.578
2 HA2 GLY 73 HA2 GLY 73 -2.490 -9.851 -16.003
3 HA3 GLY 73 HA3 GLY 73 -3.260 -8.446 -15.279
No H/Q in entry = 3
In of MODEL 5
1 H GLU 74 H GLU 74 -5.209 -9.665 -15.416
2 HA GLU 74 HA GLU 74 -5.814 -10.988 -12.973
3 HB2 GLU 74 HB2 GLU 74 -7.379 -9.546 -14.289
4 HB3 GLU 74 HB3 GLU 74 -7.493 -10.836 -15.479
5 HG2 GLU 74 HG2 GLU 74 -8.448 -12.313 -13.803
6 HG3 GLU 74 HG3 GLU 74 -8.293 -11.047 -12.584
No H/Q in entry = 6
In of MODEL 5
1 H GLU 75 H GLU 75 -4.360 -12.047 -15.789
2 HA GLU 75 HA GLU 75 -5.237 -14.745 -15.853
3 HB2 GLU 75 HB2 GLU 75 -4.055 -13.906 -17.751
4 HB3 GLU 75 HB3 GLU 75 -2.698 -13.387 -16.765
5 HG2 GLU 75 HG2 GLU 75 -2.055 -15.660 -16.352
6 HG3 GLU 75 HG3 GLU 75 -3.494 -16.261 -17.184
No H/Q in entry = 6
In of MODEL 5
1 H LYS 76 H LYS 76 -2.133 -13.466 -14.676
2 HA LYS 76 HA LYS 76 -1.453 -15.945 -13.531
3 HB2 LYS 76 HB2 LYS 76 -0.169 -13.230 -13.130
4 HB3 LYS 76 HB3 LYS 76 0.535 -14.794 -12.756
5 HG2 LYS 76 HG2 LYS 76 -0.201 -13.799 -15.487
6 HG3 LYS 76 HG3 LYS 76 1.427 -13.985 -14.836
7 HD2 LYS 76 HD2 LYS 76 -0.541 -16.240 -15.242
8 HD3 LYS 76 HD3 LYS 76 0.764 -15.833 -16.352
9 HE2 LYS 76 HE2 LYS 76 2.395 -16.281 -14.584
10 HE3 LYS 76 HE3 LYS 76 1.083 -16.687 -13.480
11 HZ1 LYS 76 HZ1 LYS 76 0.460 -18.506 -14.943
12 HZ2 LYS 76 HZ2 LYS 76 1.732 -18.120 -15.997
13 HZ3 LYS 76 HZ3 LYS 76 2.070 -18.666 -14.432
No H/Q in entry = 13
In of MODEL 5
1 H ALA 77 H ALA 77 -2.582 -12.902 -12.162
2 HA ALA 77 HA ALA 77 -2.229 -13.595 -9.467
3 HB1 ALA 77 HB1 ALA 77 -4.271 -11.743 -10.688
4 HB2 ALA 77 HB2 ALA 77 -3.800 -11.801 -8.988
5 HB3 ALA 77 HB3 ALA 77 -2.628 -11.308 -10.210
No H/Q in entry = 5
In of MODEL 5
1 H ALA 78 H ALA 78 -4.756 -14.302 -11.779
2 HA ALA 78 HA ALA 78 -6.712 -15.271 -9.991
3 HB1 ALA 78 HB1 ALA 78 -7.397 -14.779 -12.202
4 HB2 ALA 78 HB2 ALA 78 -7.506 -16.534 -12.051
5 HB3 ALA 78 HB3 ALA 78 -6.141 -15.799 -12.903
No H/Q in entry = 5
In of MODEL 5
1 H GLU 79 H GLU 79 -4.033 -16.781 -11.719
2 HA GLU 79 HA GLU 79 -4.586 -19.434 -10.888
3 HB2 GLU 79 HB2 GLU 79 -1.869 -18.364 -11.644
4 HB3 GLU 79 HB3 GLU 79 -2.463 -20.010 -11.804
5 HG2 GLU 79 HG2 GLU 79 -4.159 -19.074 -13.440
6 HG3 GLU 79 HG3 GLU 79 -3.191 -17.600 -13.420
No H/Q in entry = 6
In of MODEL 5
1 H LEU 80 H LEU 80 -2.726 -16.798 -9.537
2 HA LEU 80 HA LEU 80 -1.455 -18.347 -7.507
3 HB2 LEU 80 HB2 LEU 80 -1.910 -15.371 -7.712
4 HB3 LEU 80 HB3 LEU 80 -0.798 -16.163 -6.607
5 HG LEU 80 HG LEU 80 -0.566 -16.422 -9.598
6 HD11 LEU 80 HD11 LEU 80 0.698 -14.399 -7.767
7 HD12 LEU 80 HD12 LEU 80 1.243 -14.737 -9.410
8 HD13 LEU 80 HD13 LEU 80 -0.374 -14.096 -9.130
9 HD21 LEU 80 HD21 LEU 80 0.540 -18.138 -8.271
10 HD22 LEU 80 HD22 LEU 80 1.717 -17.095 -9.070
11 HD23 LEU 80 HD23 LEU 80 1.383 -16.893 -7.349
No H/Q in entry = 11
In of MODEL 5
1 H LYS 81 H LYS 81 -4.336 -16.306 -7.669
2 HA LYS 81 HA LYS 81 -4.975 -16.473 -4.915
3 HB2 LYS 81 HB2 LYS 81 -5.886 -14.907 -6.841
4 HB3 LYS 81 HB3 LYS 81 -7.097 -16.168 -7.008
5 HG2 LYS 81 HG2 LYS 81 -6.525 -14.816 -4.387
6 HG3 LYS 81 HG3 LYS 81 -7.695 -14.192 -5.545
7 HD2 LYS 81 HD2 LYS 81 -7.796 -16.982 -4.409
8 HD3 LYS 81 HD3 LYS 81 -8.652 -15.610 -3.704
9 HE2 LYS 81 HE2 LYS 81 -9.811 -15.281 -5.870
10 HE3 LYS 81 HE3 LYS 81 -9.016 -16.731 -6.482
11 HZ1 LYS 81 HZ1 LYS 81 -10.834 -16.654 -4.135
12 HZ2 LYS 81 HZ2 LYS 81 -11.272 -17.163 -5.688
13 HZ3 LYS 81 HZ3 LYS 81 -10.124 -18.031 -4.806
No H/Q in entry = 13
In of MODEL 5
1 H ASN 82 H ASN 82 -5.926 -18.360 -7.763
2 HA ASN 82 HA ASN 82 -7.588 -20.155 -6.310
3 HB2 ASN 82 HB2 ASN 82 -7.638 -19.778 -8.832
4 HB3 ASN 82 HB3 ASN 82 -6.169 -20.737 -8.923
5 HD21 ASN 82 HD21 ASN 82 -9.576 -20.763 -8.472
6 HD22 ASN 82 HD22 ASN 82 -9.788 -22.476 -8.499
No H/Q in entry = 6
In of MODEL 5
1 H LEU 83 H LEU 83 -4.145 -20.006 -6.990
2 HA LEU 83 HA LEU 83 -3.506 -22.626 -6.217
3 HB2 LEU 83 HB2 LEU 83 -2.100 -20.056 -6.555
4 HB3 LEU 83 HB3 LEU 83 -1.348 -21.181 -5.459
5 HG LEU 83 HG LEU 83 -2.086 -21.873 -8.298
6 HD11 LEU 83 HD11 LEU 83 0.560 -20.961 -7.176
7 HD12 LEU 83 HD12 LEU 83 0.315 -21.632 -8.790
8 HD13 LEU 83 HD13 LEU 83 -0.443 -20.103 -8.347
9 HD21 LEU 83 HD21 LEU 83 -1.883 -23.786 -6.791
10 HD22 LEU 83 HD22 LEU 83 -0.563 -23.752 -7.960
11 HD23 LEU 83 HD23 LEU 83 -0.283 -23.232 -6.298
No H/Q in entry = 11
In of MODEL 5
1 H LYS 84 H LYS 84 -3.506 -19.573 -4.418
2 HA LYS 84 HA LYS 84 -2.921 -20.525 -1.887
3 HB2 LYS 84 HB2 LYS 84 -3.054 -18.147 -2.495
4 HB3 LYS 84 HB3 LYS 84 -4.798 -18.279 -2.648
5 HG2 LYS 84 HG2 LYS 84 -5.043 -18.655 -0.301
6 HG3 LYS 84 HG3 LYS 84 -3.294 -18.776 -0.089
7 HD2 LYS 84 HD2 LYS 84 -3.032 -16.449 -0.745
8 HD3 LYS 84 HD3 LYS 84 -4.765 -16.316 -1.041
9 HE2 LYS 84 HE2 LYS 84 -3.562 -17.007 1.633
10 HE3 LYS 84 HE3 LYS 84 -3.998 -15.369 1.144
11 HZ1 LYS 84 HZ1 LYS 84 -5.869 -17.666 1.340
12 HZ2 LYS 84 HZ2 LYS 84 -5.744 -16.401 2.451
13 HZ3 LYS 84 HZ3 LYS 84 -6.283 -16.093 0.880
No H/Q in entry = 13
In of MODEL 5
1 H ASP 85 H ASP 85 -6.152 -20.074 -3.327
2 HA ASP 85 HA ASP 85 -7.610 -21.095 -1.143
3 HB2 ASP 85 HB2 ASP 85 -8.510 -19.671 -3.006
4 HB3 ASP 85 HB3 ASP 85 -8.454 -21.097 -4.040
No H/Q in entry = 4
In of MODEL 5
1 H SER 86 H SER 86 -6.093 -22.760 -3.859
2 HA SER 86 HA SER 86 -7.527 -25.198 -3.278
3 HB2 SER 86 HB2 SER 86 -6.025 -26.212 -5.004
4 HB3 SER 86 HB3 SER 86 -6.933 -24.818 -5.584
5 HG SER 86 HG SER 86 -5.135 -23.633 -5.636
No H/Q in entry = 5
In of MODEL 5
1 H GLY 87 H GLY 87 -4.937 -23.624 -1.922
2 HA2 GLY 87 HA2 GLY 87 -4.151 -26.121 -0.560
3 HA3 GLY 87 HA3 GLY 87 -4.165 -24.535 0.196
No H/Q in entry = 3
In of MODEL 5
1 H ALA 88 H ALA 88 -2.878 -23.118 -1.930
2 HA ALA 88 HA ALA 88 -0.275 -24.337 -2.120
3 HB1 ALA 88 HB1 ALA 88 -1.204 -21.583 -2.920
4 HB2 ALA 88 HB2 ALA 88 -1.014 -22.983 -3.974
5 HB3 ALA 88 HB3 ALA 88 0.401 -22.238 -3.234
No H/Q in entry = 5
In of MODEL 5
1 H SER 89 H SER 89 1.374 -23.867 -0.882
2 HA SER 89 HA SER 89 1.175 -22.406 1.565
3 HB2 SER 89 HB2 SER 89 2.616 -24.374 1.429
4 HB3 SER 89 HB3 SER 89 3.537 -23.647 0.115
5 HG SER 89 HG SER 89 4.675 -23.387 2.024
No H/Q in entry = 5
In of MODEL 5
1 H LYS 90 H LYS 90 2.480 -20.523 2.086
2 HA LYS 90 HA LYS 90 2.385 -18.519 0.113
3 HB2 LYS 90 HB2 LYS 90 3.540 -17.094 1.718
4 HB3 LYS 90 HB3 LYS 90 2.253 -18.001 2.499
5 HG2 LYS 90 HG2 LYS 90 3.884 -19.554 3.408
6 HG3 LYS 90 HG3 LYS 90 5.184 -18.675 2.598
7 HD2 LYS 90 HD2 LYS 90 4.626 -16.673 3.895
8 HD3 LYS 90 HD3 LYS 90 3.327 -17.554 4.699
9 HE2 LYS 90 HE2 LYS 90 6.266 -18.217 4.836
10 HE3 LYS 90 HE3 LYS 90 5.326 -17.425 6.100
11 HZ1 LYS 90 HZ1 LYS 90 3.940 -19.436 6.216
12 HZ2 LYS 90 HZ2 LYS 90 4.947 -20.190 5.088
13 HZ3 LYS 90 HZ3 LYS 90 5.554 -19.744 6.597
No H/Q in entry = 13
In of MODEL 5
1 H GLU 91 H GLU 91 4.568 -21.007 0.552
2 HA GLU 91 HA GLU 91 6.884 -19.743 -0.581
3 HB2 GLU 91 HB2 GLU 91 6.228 -22.685 -0.436
4 HB3 GLU 91 HB3 GLU 91 7.822 -21.964 -0.612
5 HG2 GLU 91 HG2 GLU 91 7.800 -21.148 1.601
6 HG3 GLU 91 HG3 GLU 91 6.082 -21.500 1.789
No H/Q in entry = 6
In of MODEL 5
1 H GLU 92 H GLU 92 4.292 -21.839 -1.737
2 HA GLU 92 HA GLU 92 5.084 -22.063 -4.418
3 HB2 GLU 92 HB2 GLU 92 2.345 -22.222 -3.159
4 HB3 GLU 92 HB3 GLU 92 2.786 -22.825 -4.744
5 HG2 GLU 92 HG2 GLU 92 4.064 -23.780 -2.218
6 HG3 GLU 92 HG3 GLU 92 2.635 -24.518 -2.927
No H/Q in entry = 6
In of MODEL 5
1 H LEU 93 H LEU 93 3.074 -19.848 -2.605
2 HA LEU 93 HA LEU 93 2.589 -18.141 -4.846
3 HB2 LEU 93 HB2 LEU 93 2.634 -17.405 -1.912
4 HB3 LEU 93 HB3 LEU 93 1.884 -16.483 -3.209
5 HG LEU 93 HG LEU 93 1.016 -19.137 -2.083
6 HD11 LEU 93 HD11 LEU 93 -0.430 -16.540 -2.483
7 HD12 LEU 93 HD12 LEU 93 -1.117 -18.024 -1.819
8 HD13 LEU 93 HD13 LEU 93 0.167 -17.183 -0.951
9 HD21 LEU 93 HD21 LEU 93 0.090 -17.847 -4.645
10 HD22 LEU 93 HD22 LEU 93 0.936 -19.387 -4.484
11 HD23 LEU 93 HD23 LEU 93 -0.699 -19.209 -3.849
No H/Q in entry = 11
In of MODEL 5
1 H LYS 94 H LYS 94 5.204 -18.324 -2.381
2 HA LYS 94 HA LYS 94 6.241 -15.802 -3.113
3 HB2 LYS 94 HB2 LYS 94 6.774 -16.935 -0.980
4 HB3 LYS 94 HB3 LYS 94 7.686 -18.150 -1.856
5 HG2 LYS 94 HG2 LYS 94 9.180 -16.314 -2.671
6 HG3 LYS 94 HG3 LYS 94 8.344 -15.234 -1.552
7 HD2 LYS 94 HD2 LYS 94 8.996 -16.622 0.326
8 HD3 LYS 94 HD3 LYS 94 9.758 -17.779 -0.768
9 HE2 LYS 94 HE2 LYS 94 11.289 -15.965 -1.514
10 HE3 LYS 94 HE3 LYS 94 10.588 -14.924 -0.278
11 HZ1 LYS 94 HZ1 LYS 94 11.289 -16.584 1.393
12 HZ2 LYS 94 HZ2 LYS 94 12.071 -17.450 0.166
13 HZ3 LYS 94 HZ3 LYS 94 12.590 -15.890 0.555
No H/Q in entry = 13
In of MODEL 5
1 H ALA 95 H ALA 95 6.831 -19.029 -4.230
2 HA ALA 95 HA ALA 95 9.048 -18.176 -5.870
3 HB1 ALA 95 HB1 ALA 95 9.192 -20.301 -4.697
4 HB2 ALA 95 HB2 ALA 95 9.269 -20.539 -6.444
5 HB3 ALA 95 HB3 ALA 95 7.776 -20.890 -5.571
No H/Q in entry = 5
In of MODEL 5
1 H LYS 96 H LYS 96 5.819 -19.645 -6.424
2 HA LYS 96 HA LYS 96 6.132 -19.698 -9.241
3 HB2 LYS 96 HB2 LYS 96 3.856 -20.059 -7.374
4 HB3 LYS 96 HB3 LYS 96 3.503 -19.771 -9.064
5 HG2 LYS 96 HG2 LYS 96 3.549 -22.152 -8.534
6 HG3 LYS 96 HG3 LYS 96 4.809 -21.725 -9.691
7 HD2 LYS 96 HD2 LYS 96 6.500 -21.889 -8.071
8 HD3 LYS 96 HD3 LYS 96 5.342 -21.868 -6.746
9 HE2 LYS 96 HE2 LYS 96 4.477 -24.058 -7.529
10 HE3 LYS 96 HE3 LYS 96 5.730 -24.072 -8.768
11 HZ1 LYS 96 HZ1 LYS 96 7.371 -23.922 -6.909
12 HZ2 LYS 96 HZ2 LYS 96 6.096 -24.196 -5.823
13 HZ3 LYS 96 HZ3 LYS 96 6.504 -25.369 -6.977
No H/Q in entry = 13
In of MODEL 5
1 H VAL 97 H VAL 97 5.279 -17.196 -7.066
2 HA VAL 97 HA VAL 97 3.862 -15.466 -8.806
3 HB VAL 97 HB VAL 97 5.428 -15.058 -6.277
4 HG11 VAL 97 HG11 VAL 97 5.907 -13.102 -7.684
5 HG12 VAL 97 HG12 VAL 97 4.176 -12.835 -7.880
6 HG13 VAL 97 HG13 VAL 97 4.914 -12.694 -6.286
7 HG21 VAL 97 HG21 VAL 97 3.127 -15.951 -6.261
8 HG22 VAL 97 HG22 VAL 97 3.312 -14.436 -5.375
9 HG23 VAL 97 HG23 VAL 97 2.572 -14.436 -6.984
No H/Q in entry = 9
In of MODEL 5
1 H GLU 98 H GLU 98 7.309 -15.909 -8.088
2 HA GLU 98 HA GLU 98 8.166 -13.665 -9.569
3 HB2 GLU 98 HB2 GLU 98 9.679 -16.153 -8.776
4 HB3 GLU 98 HB3 GLU 98 10.416 -14.737 -9.519
5 HG2 GLU 98 HG2 GLU 98 9.275 -13.484 -7.518
6 HG3 GLU 98 HG3 GLU 98 9.301 -15.084 -6.777
No H/Q in entry = 6
In of MODEL 5
1 H GLU 99 H GLU 99 7.265 -16.883 -10.498
2 HA GLU 99 HA GLU 99 8.435 -16.836 -13.092
3 HB2 GLU 99 HB2 GLU 99 6.035 -18.324 -12.019
4 HB3 GLU 99 HB3 GLU 99 6.702 -18.571 -13.628
5 HG2 GLU 99 HG2 GLU 99 8.121 -19.045 -11.021
6 HG3 GLU 99 HG3 GLU 99 7.477 -20.279 -12.103
No H/Q in entry = 6
In of MODEL 5
1 H ALA 100 H ALA 100 5.353 -15.800 -11.765
2 HA ALA 100 HA ALA 100 4.220 -15.053 -14.271
3 HB1 ALA 100 HB1 ALA 100 3.464 -14.095 -11.517
4 HB2 ALA 100 HB2 ALA 100 2.921 -15.617 -12.227
5 HB3 ALA 100 HB3 ALA 100 2.458 -14.086 -12.964
No H/Q in entry = 5
In of MODEL 5
1 H LEU 101 H LEU 101 5.682 -13.235 -11.604
2 HA LEU 101 HA LEU 101 5.470 -10.719 -12.892
3 HB2 LEU 101 HB2 LEU 101 6.919 -11.713 -10.454
4 HB3 LEU 101 HB3 LEU 101 7.059 -10.054 -10.994
5 HG LEU 101 HG LEU 101 5.421 -10.411 -9.149
6 HD11 LEU 101 HD11 LEU 101 4.304 -9.343 -11.727
7 HD12 LEU 101 HD12 LEU 101 3.649 -9.026 -10.121
8 HD13 LEU 101 HD13 LEU 101 5.260 -8.449 -10.545
9 HD21 LEU 101 HD21 LEU 101 4.505 -12.565 -9.871
10 HD22 LEU 101 HD22 LEU 101 3.247 -11.357 -9.611
11 HD23 LEU 101 HD23 LEU 101 3.752 -11.767 -11.250
No H/Q in entry = 11
In of MODEL 5
1 H HIS 102 H HIS 102 7.634 -13.274 -13.354
2 HA HIS 102 HA HIS 102 9.680 -11.554 -14.533
3 HB2 HIS 102 HB2 HIS 102 9.406 -14.524 -14.229
4 HB3 HIS 102 HB3 HIS 102 10.560 -13.833 -15.364
5 HD1 HIS 102 HD1 HIS 102 12.074 -15.290 -13.475
6 HD2 HIS 102 HD2 HIS 102 10.595 -11.554 -12.416
7 HE1 HIS 102 HE1 HIS 102 13.456 -14.547 -11.513
8 HE2 HIS 102 HE2 HIS 102 12.661 -12.212 -11.010
No H/Q in entry = 8
In of MODEL 5
1 H ALA 103 H ALA 103 7.064 -13.742 -15.517
2 HA ALA 103 HA ALA 103 7.734 -13.841 -18.222
3 HB1 ALA 103 HB1 ALA 103 5.011 -14.200 -16.972
4 HB2 ALA 103 HB2 ALA 103 6.262 -15.443 -17.052
5 HB3 ALA 103 HB3 ALA 103 5.536 -14.821 -18.537
No H/Q in entry = 5
In of MODEL 5
1 H VAL 104 H VAL 104 6.459 -11.267 -16.473
2 HA VAL 104 HA VAL 104 4.799 -10.137 -18.500
3 HB VAL 104 HB VAL 104 4.218 -9.690 -16.253
4 HG11 VAL 104 HG11 VAL 104 7.034 -8.719 -15.942
5 HG12 VAL 104 HG12 VAL 104 5.770 -8.538 -14.726
6 HG13 VAL 104 HG13 VAL 104 6.301 -10.145 -15.207
7 HG21 VAL 104 HG21 VAL 104 5.495 -7.235 -17.437
8 HG22 VAL 104 HG22 VAL 104 3.851 -7.796 -17.718
9 HG23 VAL 104 HG23 VAL 104 4.326 -7.224 -16.119
No H/Q in entry = 9
In of MODEL 5
1 H THR 105 H THR 105 5.306 -8.418 -19.856
2 HA THR 105 HA THR 105 8.095 -7.504 -19.830
3 HB THR 105 HB THR 105 8.136 -7.787 -22.356
4 HG1 THR 105 HG1 THR 105 6.483 -9.950 -22.292
5 HG21 THR 105 HG21 THR 105 8.093 -10.264 -20.632
6 HG22 THR 105 HG22 THR 105 8.842 -10.136 -22.225
7 HG23 THR 105 HG23 THR 105 9.470 -9.189 -20.876
No H/Q in entry = 7
In of MODEL 5
1 H ASP 106 H ASP 106 4.912 -6.563 -19.949
2 HA ASP 106 HA ASP 106 5.339 -4.252 -21.585
3 HB2 ASP 106 HB2 ASP 106 3.080 -5.153 -21.229
4 HB3 ASP 106 HB3 ASP 106 3.228 -4.834 -19.509
No H/Q in entry = 4
In of MODEL 5
1 H GLU 107 H GLU 107 6.336 -2.476 -21.034
2 HA GLU 107 HA GLU 107 8.076 -2.562 -18.884
3 HB2 GLU 107 HB2 GLU 107 7.300 -0.188 -20.567
4 HB3 GLU 107 HB3 GLU 107 8.708 -0.271 -19.520
5 HG2 GLU 107 HG2 GLU 107 8.174 -1.939 -21.964
6 HG3 GLU 107 HG3 GLU 107 9.376 -0.663 -21.786
No H/Q in entry = 6
In of MODEL 5
1 H GLU 108 H GLU 108 5.200 -0.541 -19.286
2 HA GLU 108 HA GLU 108 5.388 0.921 -16.926
3 HB2 GLU 108 HB2 GLU 108 2.871 -0.078 -18.274
4 HB3 GLU 108 HB3 GLU 108 2.963 1.240 -17.115
5 HG2 GLU 108 HG2 GLU 108 4.378 2.492 -18.688
6 HG3 GLU 108 HG3 GLU 108 4.210 1.181 -19.854
No H/Q in entry = 6
In of MODEL 5
1 H LYS 109 H LYS 109 4.043 -2.282 -17.535
2 HA LYS 109 HA LYS 109 2.953 -2.716 -14.990
3 HB2 LYS 109 HB2 LYS 109 3.888 -4.628 -17.125
4 HB3 LYS 109 HB3 LYS 109 3.074 -5.149 -15.652
5 HG2 LYS 109 HG2 LYS 109 1.148 -3.721 -16.270
6 HG3 LYS 109 HG3 LYS 109 1.967 -3.335 -17.780
7 HD2 LYS 109 HD2 LYS 109 1.965 -5.728 -18.366
8 HD3 LYS 109 HD3 LYS 109 1.099 -6.077 -16.869
9 HE2 LYS 109 HE2 LYS 109 -0.505 -5.993 -18.629
10 HE3 LYS 109 HE3 LYS 109 -0.709 -4.541 -17.652
11 HZ1 LYS 109 HZ1 LYS 109 0.689 -3.372 -19.328
12 HZ2 LYS 109 HZ2 LYS 109 0.608 -4.759 -20.297
13 HZ3 LYS 109 HZ3 LYS 109 -0.801 -3.909 -19.917
No H/Q in entry = 13
In of MODEL 5
1 H LYS 110 H LYS 110 6.156 -3.461 -16.309
2 HA LYS 110 HA LYS 110 6.990 -4.876 -13.962
3 HB2 LYS 110 HB2 LYS 110 8.674 -3.678 -16.157
4 HB3 LYS 110 HB3 LYS 110 9.222 -4.841 -14.964
5 HG2 LYS 110 HG2 LYS 110 7.684 -6.507 -15.894
6 HG3 LYS 110 HG3 LYS 110 7.162 -5.332 -17.105
7 HD2 LYS 110 HD2 LYS 110 9.970 -6.390 -16.754
8 HD3 LYS 110 HD3 LYS 110 8.841 -6.857 -18.026
9 HE2 LYS 110 HE2 LYS 110 8.842 -4.608 -18.907
10 HE3 LYS 110 HE3 LYS 110 9.852 -4.056 -17.578
11 HZ1 LYS 110 HZ1 LYS 110 10.660 -6.012 -19.655
12 HZ2 LYS 110 HZ2 LYS 110 11.134 -4.389 -19.584
13 HZ3 LYS 110 HZ3 LYS 110 11.631 -5.470 -18.381
No H/Q in entry = 13
In of MODEL 5
1 H GLN 111 H GLN 111 6.886 -1.605 -14.910
2 HA GLN 111 HA GLN 111 8.762 -0.523 -13.092
3 HB2 GLN 111 HB2 GLN 111 7.094 0.489 -15.038
4 HB3 GLN 111 HB3 GLN 111 6.357 1.097 -13.563
5 HG2 GLN 111 HG2 GLN 111 9.242 1.478 -14.325
6 HG3 GLN 111 HG3 GLN 111 7.963 2.662 -14.581
7 HE21 GLN 111 HE21 GLN 111 9.993 1.088 -12.253
8 HE22 GLN 111 HE22 GLN 111 9.647 2.148 -10.932
No H/Q in entry = 8
In of MODEL 5
1 H TYR 112 H TYR 112 5.362 -1.468 -12.749
2 HA TYR 112 HA TYR 112 5.221 -0.487 -10.019
3 HB2 TYR 112 HB2 TYR 112 3.316 -2.262 -11.555
4 HB3 TYR 112 HB3 TYR 112 3.007 -1.578 -9.967
5 HD1 TYR 112 HD1 TYR 112 4.231 1.185 -10.578
6 HD2 TYR 112 HD2 TYR 112 1.479 -1.276 -12.682
7 HE1 TYR 112 HE1 TYR 112 3.263 3.182 -11.639
8 HE2 TYR 112 HE2 TYR 112 0.503 0.705 -13.751
9 HH TYR 112 HH TYR 112 1.985 3.760 -13.656
No H/Q in entry = 9
In of MODEL 5
1 H ILE 113 H ILE 113 6.033 -3.420 -11.667
2 HA ILE 113 HA ILE 113 5.816 -5.182 -9.478
3 HB ILE 113 HB ILE 113 7.613 -5.315 -11.891
4 HG12 ILE 113 HG12 ILE 113 4.927 -6.544 -11.252
5 HG13 ILE 113 HG13 ILE 113 5.227 -5.244 -12.399
6 HG21 ILE 113 HG21 ILE 113 6.925 -7.446 -9.867
7 HG22 ILE 113 HG22 ILE 113 7.772 -7.728 -11.388
8 HG23 ILE 113 HG23 ILE 113 8.511 -6.727 -10.138
9 HD11 ILE 113 HD11 ILE 113 6.555 -6.768 -13.759
10 HD12 ILE 113 HD12 ILE 113 6.221 -8.066 -12.615
11 HD13 ILE 113 HD13 ILE 113 4.903 -7.341 -13.531
No H/Q in entry = 11
In of MODEL 5
1 H ALA 114 H ALA 114 8.480 -3.208 -10.706
2 HA ALA 114 HA ALA 114 10.330 -3.854 -8.621
3 HB1 ALA 114 HB1 ALA 114 11.129 -2.993 -10.727
4 HB2 ALA 114 HB2 ALA 114 11.531 -1.842 -9.452
5 HB3 ALA 114 HB3 ALA 114 10.172 -1.523 -10.535
No H/Q in entry = 5
In of MODEL 5
1 H ASP 115 H ASP 115 7.879 -1.403 -9.126
2 HA ASP 115 HA ASP 115 8.706 0.279 -6.979
3 HB2 ASP 115 HB2 ASP 115 7.425 0.956 -9.058
4 HB3 ASP 115 HB3 ASP 115 6.005 0.229 -8.316
No H/Q in entry = 4
In of MODEL 5
1 H PHE 116 H PHE 116 5.863 -1.800 -7.425
2 HA PHE 116 HA PHE 116 5.247 -1.421 -4.590
3 HB2 PHE 116 HB2 PHE 116 3.631 -1.391 -6.930
4 HB3 PHE 116 HB3 PHE 116 3.149 -2.798 -5.988
5 HD1 PHE 116 HD1 PHE 116 2.208 -2.544 -3.770
6 HD2 PHE 116 HD2 PHE 116 3.228 0.826 -6.160
7 HE1 PHE 116 HE1 PHE 116 0.836 -1.118 -2.316
8 HE2 PHE 116 HE2 PHE 116 1.853 2.271 -4.697
9 HZ PHE 116 HZ PHE 116 0.651 1.285 -2.776
No H/Q in entry = 9
In of MODEL 5
1 H GLY 117 H GLY 117 6.290 -3.775 -6.836
2 HA2 GLY 117 HA2 GLY 117 6.824 -6.010 -6.575
3 HA3 GLY 117 HA3 GLY 117 5.161 -6.144 -6.042
No H/Q in entry = 3
In of MODEL 5
1 HA PRO 118 HA PRO 118 8.503 -7.199 -2.709
2 HB2 PRO 118 HB2 PRO 118 9.980 -5.060 -1.781
3 HB3 PRO 118 HB3 PRO 118 10.531 -6.213 -3.001
4 HG2 PRO 118 HG2 PRO 118 9.360 -3.487 -3.359
5 HG3 PRO 118 HG3 PRO 118 10.700 -4.256 -4.231
6 HD2 PRO 118 HD2 PRO 118 8.254 -4.068 -5.310
7 HD3 PRO 118 HD3 PRO 118 9.274 -5.495 -5.577
No H/Q in entry = 7
In of MODEL 5
1 H ALA 119 H ALA 119 6.894 -4.091 -2.613
2 HA ALA 119 HA ALA 119 6.607 -4.103 0.273
3 HB1 ALA 119 HB1 ALA 119 5.323 -2.046 -0.083
4 HB2 ALA 119 HB2 ALA 119 5.421 -2.287 -1.826
5 HB3 ALA 119 HB3 ALA 119 6.888 -1.987 -0.893
No H/Q in entry = 5
In of MODEL 5
1 H CYS 120 H CYS 120 4.636 -4.709 -2.577
2 HA CYS 120 HA CYS 120 2.192 -5.294 -1.394
3 HB2 CYS 120 HB2 CYS 120 3.570 -6.549 -3.768
4 HB3 CYS 120 HB3 CYS 120 1.922 -6.946 -3.299
No H/Q in entry = 4
In of MODEL 5
1 H LYS 121 H LYS 121 5.163 -7.171 -1.504
2 HA LYS 121 HA LYS 121 4.225 -9.648 -0.690
3 HB2 LYS 121 HB2 LYS 121 6.806 -8.297 0.107
4 HB3 LYS 121 HB3 LYS 121 6.457 -10.005 0.331
5 HG2 LYS 121 HG2 LYS 121 6.520 -8.601 -2.331
6 HG3 LYS 121 HG3 LYS 121 7.846 -9.544 -1.653
7 HD2 LYS 121 HD2 LYS 121 5.089 -10.660 -2.156
8 HD3 LYS 121 HD3 LYS 121 6.411 -10.759 -3.319
9 HE2 LYS 121 HE2 LYS 121 6.482 -11.868 -0.513
10 HE3 LYS 121 HE3 LYS 121 6.154 -12.811 -1.964
11 HZ1 LYS 121 HZ1 LYS 121 8.664 -11.320 -1.415
12 HZ2 LYS 121 HZ2 LYS 121 8.465 -12.992 -1.274
13 HZ3 LYS 121 HZ3 LYS 121 8.349 -12.251 -2.791
No H/Q in entry = 13
In of MODEL 5
1 H LYS 122 H LYS 122 5.300 -6.993 1.499
2 HA LYS 122 HA LYS 122 4.411 -8.390 3.813
3 HB2 LYS 122 HB2 LYS 122 4.768 -6.365 5.060
4 HB3 LYS 122 HB3 LYS 122 6.104 -6.602 3.951
5 HG2 LYS 122 HG2 LYS 122 5.095 -4.932 2.438
6 HG3 LYS 122 HG3 LYS 122 3.834 -4.652 3.641
7 HD2 LYS 122 HD2 LYS 122 6.798 -4.263 4.068
8 HD3 LYS 122 HD3 LYS 122 5.619 -2.978 3.808
9 HE2 LYS 122 HE2 LYS 122 4.504 -3.512 5.868
10 HE3 LYS 122 HE3 LYS 122 5.506 -4.940 6.095
11 HZ1 LYS 122 HZ1 LYS 122 7.434 -3.492 6.311
12 HZ2 LYS 122 HZ2 LYS 122 6.454 -2.129 6.131
13 HZ3 LYS 122 HZ3 LYS 122 6.267 -3.134 7.485
No H/Q in entry = 13
In of MODEL 5
1 H ILE 123 H ILE 123 2.849 -6.306 1.506
2 HA ILE 123 HA ILE 123 0.584 -5.645 3.039
3 HB ILE 123 HB ILE 123 0.914 -5.831 0.065
4 HG12 ILE 123 HG12 ILE 123 0.865 -3.524 2.021
5 HG13 ILE 123 HG13 ILE 123 2.284 -4.142 1.179
6 HG21 ILE 123 HG21 ILE 123 -1.395 -4.748 1.676
7 HG22 ILE 123 HG22 ILE 123 -1.167 -4.501 -0.057
8 HG23 ILE 123 HG23 ILE 123 -1.430 -6.126 0.574
9 HD11 ILE 123 HD11 ILE 123 -0.108 -2.926 -0.153
10 HD12 ILE 123 HD12 ILE 123 1.393 -2.077 0.208
11 HD13 ILE 123 HD13 ILE 123 1.392 -3.427 -0.928
No H/Q in entry = 11
In of MODEL 5
1 H TYR 124 H TYR 124 1.187 -8.172 0.747
2 HA TYR 124 HA TYR 124 -1.200 -9.691 1.310
3 HB2 TYR 124 HB2 TYR 124 1.203 -10.188 -0.451
4 HB3 TYR 124 HB3 TYR 124 -0.113 -11.340 -0.268
5 HD1 TYR 124 HD1 TYR 124 -2.530 -10.270 -0.675
6 HD2 TYR 124 HD2 TYR 124 1.116 -8.738 -2.244
7 HE1 TYR 124 HE1 TYR 124 -3.782 -9.117 -2.447
8 HE2 TYR 124 HE2 TYR 124 -0.128 -7.579 -4.021
9 HH TYR 124 HH TYR 124 -3.537 -7.260 -3.962
No H/Q in entry = 9
In of MODEL 5
1 H GLY 125 H GLY 125 0.438 -9.251 3.553
2 HA2 GLY 125 HA2 GLY 125 1.733 -10.283 5.214
3 HA3 GLY 125 HA3 GLY 125 2.864 -9.797 3.986
No H/Q in entry = 3
In of MODEL 5
1 H VAL 126 H VAL 126 1.957 -12.111 2.262
2 HA VAL 126 HA VAL 126 3.032 -14.450 3.448
3 HB VAL 126 HB VAL 126 3.563 -15.111 1.049
4 HG11 VAL 126 HG11 VAL 126 1.484 -15.752 2.143
5 HG12 VAL 126 HG12 VAL 126 0.747 -14.222 1.661
6 HG13 VAL 126 HG13 VAL 126 1.216 -15.402 0.436
7 HG21 VAL 126 HG21 VAL 126 3.862 -12.816 0.171
8 HG22 VAL 126 HG22 VAL 126 2.674 -13.744 -0.747
9 HG23 VAL 126 HG23 VAL 126 2.137 -12.525 0.405
No H/Q in entry = 9
In of MODEL 5
1 H HIS 127 H HIS 127 4.774 -13.010 4.607
2 HA HIS 127 HA HIS 127 7.246 -13.226 3.048
3 HB2 HIS 127 HB2 HIS 127 8.028 -11.039 3.657
4 HB3 HIS 127 HB3 HIS 127 6.437 -10.857 2.932
5 HD1 HIS 127 HD1 HIS 127 8.091 -9.037 5.154
6 HD2 HIS 127 HD2 HIS 127 4.624 -11.275 5.659
7 HE1 HIS 127 HE1 HIS 127 6.923 -8.039 7.143
8 HE2 HIS 127 HE2 HIS 127 4.752 -9.302 7.322
No H/Q in entry = 8
In of MODEL 5
1 H THR 128 H THR 128 9.117 -12.445 4.718
2 HA THR 128 HA THR 128 10.359 -12.969 6.531
3 HB THR 128 HB THR 128 7.798 -13.613 8.008
4 HG1 THR 128 HG1 THR 128 9.082 -11.100 7.554
5 HG21 THR 128 HG21 THR 128 10.482 -12.576 8.944
6 HG22 THR 128 HG22 THR 128 9.078 -12.868 9.968
7 HG23 THR 128 HG23 THR 128 9.880 -14.218 9.166
No H/Q in entry = 7
In of MODEL 5
1 H SER 129 H SER 129 10.053 -14.818 4.580
2 HA SER 129 HA SER 129 10.877 -17.171 5.991
3 HB2 SER 129 HB2 SER 129 8.438 -17.278 4.197
4 HB3 SER 129 HB3 SER 129 9.346 -18.699 4.710
5 HG SER 129 HG SER 129 8.615 -17.015 6.764
No H/Q in entry = 5
In of MODEL 6
1 HA2 GLY -4 HA2 GLY -4 -0.391 20.522 -14.418
2 HA3 GLY -4 HA3 GLY -4 0.810 21.488 -13.572
3 H1 GLY -4 H1 GLY -4 1.358 19.563 -15.756
4 H2 GLY -4 H2 GLY -4 2.526 20.460 -14.927
No H/Q in entry = 4
In of MODEL 6
1 H SER -3 H SER -3 -0.511 20.190 -11.851
2 HA SER -3 HA SER -3 1.318 18.201 -10.863
3 HB2 SER -3 HB2 SER -3 0.232 19.929 -9.402
4 HB3 SER -3 HB3 SER -3 -1.305 19.104 -9.653
5 HG SER -3 HG SER -3 -0.736 17.615 -8.273
No H/Q in entry = 5
In of MODEL 6
1 HA PRO -2 HA PRO -2 -1.096 14.825 -12.560
2 HB2 PRO -2 HB2 PRO -2 0.643 12.981 -11.189
3 HB3 PRO -2 HB3 PRO -2 0.584 13.355 -12.910
4 HG2 PRO -2 HG2 PRO -2 2.667 14.014 -11.239
5 HG3 PRO -2 HG3 PRO -2 2.305 14.828 -12.766
6 HD2 PRO -2 HD2 PRO -2 1.724 15.690 -9.974
7 HD3 PRO -2 HD3 PRO -2 2.163 16.660 -11.395
No H/Q in entry = 7
In of MODEL 6
1 H GLU -1 H GLU -1 -2.716 15.653 -10.880
2 HA GLU -1 HA GLU -1 -2.808 14.434 -8.318
3 HB2 GLU -1 HB2 GLU -1 -5.054 15.676 -9.914
4 HB3 GLU -1 HB3 GLU -1 -5.081 15.332 -8.192
5 HG2 GLU -1 HG2 GLU -1 -3.211 17.261 -9.550
6 HG3 GLU -1 HG3 GLU -1 -4.676 17.700 -8.674
No H/Q in entry = 6
In of MODEL 6
1 H PHE 0 H PHE 0 -3.961 13.515 -11.478
2 HA PHE 0 HA PHE 0 -4.453 10.848 -10.431
3 HB2 PHE 0 HB2 PHE 0 -6.668 12.025 -10.410
4 HB3 PHE 0 HB3 PHE 0 -6.525 12.229 -12.151
5 HD1 PHE 0 HD1 PHE 0 -6.704 9.677 -9.474
6 HD2 PHE 0 HD2 PHE 0 -7.185 10.521 -13.617
7 HE1 PHE 0 HE1 PHE 0 -7.714 7.458 -9.805
8 HE2 PHE 0 HE2 PHE 0 -8.195 8.303 -13.954
9 HZ PHE 0 HZ PHE 0 -8.460 6.768 -12.049
No H/Q in entry = 9
In of MODEL 6
1 H HIS 1 H HIS 1 -2.457 10.509 -11.565
2 HA HIS 1 HA HIS 1 -2.426 10.735 -14.430
3 HB2 HIS 1 HB2 HIS 1 -0.361 10.875 -12.986
4 HB3 HIS 1 HB3 HIS 1 -0.527 9.151 -12.690
5 HD1 HIS 1 HD1 HIS 1 0.930 7.796 -14.167
6 HD2 HIS 1 HD2 HIS 1 -0.276 11.325 -15.999
7 HE1 HIS 1 HE1 HIS 1 2.044 7.802 -16.418
8 HE2 HIS 1 HE2 HIS 1 1.416 10.011 -17.448
No H/Q in entry = 8
In of MODEL 6
1 H HIS 2 H HIS 2 -2.528 8.035 -12.117
2 HA HIS 2 HA HIS 2 -4.613 6.749 -13.542
3 HB2 HIS 2 HB2 HIS 2 -2.556 6.161 -14.947
4 HB3 HIS 2 HB3 HIS 2 -2.011 5.215 -13.567
5 HD1 HIS 2 HD1 HIS 2 -2.270 3.404 -15.725
6 HD2 HIS 2 HD2 HIS 2 -5.698 4.656 -13.727
7 HE1 HIS 2 HE1 HIS 2 -4.033 1.696 -16.265
8 HE2 HIS 2 HE2 HIS 2 -6.122 2.524 -15.129
No H/Q in entry = 8
In of MODEL 6
1 H PHE 3 H PHE 3 -1.823 5.810 -11.542
2 HA PHE 3 HA PHE 3 -3.716 4.814 -9.514
3 HB2 PHE 3 HB2 PHE 3 -0.924 3.875 -10.197
4 HB3 PHE 3 HB3 PHE 3 -1.778 3.384 -8.740
5 HD1 PHE 3 HD1 PHE 3 -3.806 1.993 -8.911
6 HD2 PHE 3 HD2 PHE 3 -1.407 2.909 -12.304
7 HE1 PHE 3 HE1 PHE 3 -4.838 0.128 -10.140
8 HE2 PHE 3 HE2 PHE 3 -2.437 1.050 -13.539
9 HZ PHE 3 HZ PHE 3 -4.153 -0.343 -12.456
No H/Q in entry = 9
In of MODEL 6
1 H THR 4 H THR 4 -3.544 7.304 -9.096
2 HA THR 4 HA THR 4 -1.158 8.064 -7.651
3 HB THR 4 HB THR 4 -2.484 10.215 -7.272
4 HG1 THR 4 HG1 THR 4 -4.360 10.471 -8.391
5 HG21 THR 4 HG21 THR 4 -1.923 9.311 -10.100
6 HG22 THR 4 HG22 THR 4 -2.100 10.987 -9.575
7 HG23 THR 4 HG23 THR 4 -0.754 10.014 -8.981
No H/Q in entry = 7
In of MODEL 6
1 H LEU 5 H LEU 5 -1.385 9.073 -5.487
2 HA LEU 5 HA LEU 5 -2.517 7.199 -3.688
3 HB2 LEU 5 HB2 LEU 5 -1.412 9.944 -3.104
4 HB3 LEU 5 HB3 LEU 5 -1.671 8.663 -1.936
5 HG LEU 5 HG LEU 5 0.302 8.558 -4.217
6 HD11 LEU 5 HD11 LEU 5 0.906 10.192 -2.497
7 HD12 LEU 5 HD12 LEU 5 0.745 8.944 -1.261
8 HD13 LEU 5 HD13 LEU 5 1.995 8.805 -2.496
9 HD21 LEU 5 HD21 LEU 5 -0.178 6.667 -1.913
10 HD22 LEU 5 HD22 LEU 5 -0.534 6.351 -3.611
11 HD23 LEU 5 HD23 LEU 5 1.137 6.551 -3.082
No H/Q in entry = 11
In of MODEL 6
1 H GLU 6 H GLU 6 -3.542 10.351 -4.860
2 HA GLU 6 HA GLU 6 -5.761 10.737 -3.191
3 HB2 GLU 6 HB2 GLU 6 -5.503 11.326 -6.147
4 HB3 GLU 6 HB3 GLU 6 -6.715 12.009 -5.072
5 HG2 GLU 6 HG2 GLU 6 -5.239 13.712 -5.053
6 HG3 GLU 6 HG3 GLU 6 -4.570 12.771 -3.731
No H/Q in entry = 6
In of MODEL 6
1 H SER 7 H SER 7 -5.411 8.768 -6.186
2 HA SER 7 HA SER 7 -8.046 8.009 -6.424
3 HB2 SER 7 HB2 SER 7 -6.269 7.587 -8.098
4 HB3 SER 7 HB3 SER 7 -5.628 6.312 -7.063
5 HG SER 7 HG SER 7 -8.106 5.685 -7.282
No H/Q in entry = 5
In of MODEL 6
1 H SER 8 H SER 8 -5.865 7.045 -3.924
2 HA SER 8 HA SER 8 -7.530 4.727 -3.326
3 HB2 SER 8 HB2 SER 8 -5.774 4.126 -1.658
4 HB3 SER 8 HB3 SER 8 -5.239 4.160 -3.344
5 HG SER 8 HG SER 8 -4.904 6.593 -2.223
No H/Q in entry = 5
In of MODEL 6
1 H LEU 9 H LEU 9 -7.324 7.982 -2.254
2 HA LEU 9 HA LEU 9 -7.004 7.640 0.471
3 HB2 LEU 9 HB2 LEU 9 -8.334 9.861 -1.025
4 HB3 LEU 9 HB3 LEU 9 -7.854 9.935 0.662
5 HG LEU 9 HG LEU 9 -5.923 9.386 -1.577
6 HD11 LEU 9 HD11 LEU 9 -6.978 11.524 -1.895
7 HD12 LEU 9 HD12 LEU 9 -6.596 11.988 -0.233
8 HD13 LEU 9 HD13 LEU 9 -5.299 11.722 -1.400
9 HD21 LEU 9 HD21 LEU 9 -5.528 10.220 1.299
10 HD22 LEU 9 HD22 LEU 9 -5.180 8.630 0.615
11 HD23 LEU 9 HD23 LEU 9 -4.247 10.041 0.100
No H/Q in entry = 11
In of MODEL 6
1 H ASP 10 H ASP 10 -9.990 7.511 -1.273
2 HA ASP 10 HA ASP 10 -11.428 7.195 1.263
3 HB2 ASP 10 HB2 ASP 10 -12.355 7.711 -1.553
4 HB3 ASP 10 HB3 ASP 10 -13.468 7.251 -0.268
No H/Q in entry = 4
In of MODEL 6
1 H THR 11 H THR 11 -9.785 5.251 -0.704
2 HA THR 11 HA THR 11 -11.634 3.030 -0.209
3 HB THR 11 HB THR 11 -10.597 1.909 -2.234
4 HG1 THR 11 HG1 THR 11 -9.953 4.531 -3.092
5 HG21 THR 11 HG21 THR 11 -12.864 2.829 -2.261
6 HG22 THR 11 HG22 THR 11 -12.224 4.413 -2.695
7 HG23 THR 11 HG23 THR 11 -12.068 3.062 -3.817
No H/Q in entry = 7
In of MODEL 6
1 H HIS 12 H HIS 12 -8.518 2.601 -1.657
2 HA HIS 12 HA HIS 12 -7.775 0.662 0.198
3 HB2 HIS 12 HB2 HIS 12 -5.954 2.146 -1.683
4 HB3 HIS 12 HB3 HIS 12 -5.610 0.601 -0.915
5 HD1 HIS 12 HD1 HIS 12 -7.799 -1.190 -1.482
6 HD2 HIS 12 HD2 HIS 12 -6.761 1.760 -4.219
7 HE1 HIS 12 HE1 HIS 12 -8.755 -1.941 -3.683
8 HE2 HIS 12 HE2 HIS 12 -8.257 -0.062 -5.280
No H/Q in entry = 8
In of MODEL 6
1 H LEU 13 H LEU 13 -7.032 4.109 0.133
2 HA LEU 13 HA LEU 13 -5.224 3.655 2.417
3 HB2 LEU 13 HB2 LEU 13 -5.142 5.554 0.151
4 HB3 LEU 13 HB3 LEU 13 -4.553 6.121 1.700
5 HG LEU 13 HG LEU 13 -2.686 5.303 0.422
6 HD11 LEU 13 HD11 LEU 13 -2.756 4.824 2.865
7 HD12 LEU 13 HD12 LEU 13 -3.343 3.207 2.480
8 HD13 LEU 13 HD13 LEU 13 -1.746 3.717 1.937
9 HD21 LEU 13 HD21 LEU 13 -4.215 2.716 0.181
10 HD22 LEU 13 HD22 LEU 13 -3.818 3.833 -1.126
11 HD23 LEU 13 HD23 LEU 13 -2.534 2.953 -0.297
No H/Q in entry = 11
In of MODEL 6
1 H LYS 14 H LYS 14 -8.136 3.973 2.444
2 HA LYS 14 HA LYS 14 -8.747 6.583 3.420
3 HB2 LYS 14 HB2 LYS 14 -10.961 5.725 3.877
4 HB3 LYS 14 HB3 LYS 14 -10.428 5.209 2.290
5 HG2 LYS 14 HG2 LYS 14 -9.858 3.003 3.251
6 HG3 LYS 14 HG3 LYS 14 -10.527 3.543 4.794
7 HD2 LYS 14 HD2 LYS 14 -12.705 3.837 3.802
8 HD3 LYS 14 HD3 LYS 14 -12.064 3.475 2.198
9 HE2 LYS 14 HE2 LYS 14 -11.493 1.207 2.969
10 HE3 LYS 14 HE3 LYS 14 -12.204 1.580 4.539
11 HZ1 LYS 14 HZ1 LYS 14 -14.330 1.939 3.435
12 HZ2 LYS 14 HZ2 LYS 14 -13.644 1.548 1.940
13 HZ3 LYS 14 HZ3 LYS 14 -13.754 0.374 3.153
No H/Q in entry = 13
In of MODEL 6
1 H TRP 15 H TRP 15 -7.350 3.878 4.855
2 HA TRP 15 HA TRP 15 -8.302 4.303 7.525
3 HB2 TRP 15 HB2 TRP 15 -6.518 2.683 8.151
4 HB3 TRP 15 HB3 TRP 15 -7.585 2.080 6.886
5 HD1 TRP 15 HD1 TRP 15 -6.573 1.859 4.431
6 HE1 TRP 15 HE1 TRP 15 -4.151 1.677 3.577
7 HE3 TRP 15 HE3 TRP 15 -4.120 3.457 8.616
8 HZ2 TRP 15 HZ2 TRP 15 -1.545 2.145 4.556
9 HZ3 TRP 15 HZ3 TRP 15 -1.662 3.561 8.577
10 HH2 TRP 15 HH2 TRP 15 -0.403 2.917 6.589
No H/Q in entry = 10
In of MODEL 6
1 H LEU 16 H LEU 16 -6.114 5.899 5.536
2 HA LEU 16 HA LEU 16 -4.277 6.810 7.551
3 HB2 LEU 16 HB2 LEU 16 -5.009 8.027 4.878
4 HB3 LEU 16 HB3 LEU 16 -3.677 8.542 5.888
5 HG LEU 16 HG LEU 16 -3.882 5.814 4.603
6 HD11 LEU 16 HD11 LEU 16 -2.319 8.259 3.781
7 HD12 LEU 16 HD12 LEU 16 -2.168 6.658 3.060
8 HD13 LEU 16 HD13 LEU 16 -3.682 7.550 2.917
9 HD21 LEU 16 HD21 LEU 16 -1.622 7.210 6.038
10 HD22 LEU 16 HD22 LEU 16 -2.490 5.776 6.585
11 HD23 LEU 16 HD23 LEU 16 -1.470 5.696 5.145
No H/Q in entry = 11
In of MODEL 6
1 H SER 17 H SER 17 -4.336 8.708 8.662
2 HA SER 17 HA SER 17 -6.919 9.890 9.097
3 HB2 SER 17 HB2 SER 17 -4.256 10.830 10.170
4 HB3 SER 17 HB3 SER 17 -5.852 11.164 10.838
5 HG SER 17 HG SER 17 -4.228 9.048 11.267
No H/Q in entry = 5
In of MODEL 6
1 H GLN 18 H GLN 18 -7.288 12.280 8.880
2 HA GLN 18 HA GLN 18 -6.815 13.110 6.272
3 HB2 GLN 18 HB2 GLN 18 -8.612 14.041 7.687
4 HB3 GLN 18 HB3 GLN 18 -7.410 14.858 8.676
5 HG2 GLN 18 HG2 GLN 18 -8.466 16.399 7.130
6 HG3 GLN 18 HG3 GLN 18 -6.750 16.225 6.772
7 HE21 GLN 18 HE21 GLN 18 -6.116 15.230 4.874
8 HE22 GLN 18 HE22 GLN 18 -7.215 14.905 3.578
No H/Q in entry = 8
In of MODEL 6
1 H GLU 19 H GLU 19 -5.108 14.053 9.234
2 HA GLU 19 HA GLU 19 -3.315 15.821 8.105
3 HB2 GLU 19 HB2 GLU 19 -1.966 15.385 10.079
4 HB3 GLU 19 HB3 GLU 19 -3.643 15.563 10.508
5 HG2 GLU 19 HG2 GLU 19 -3.860 13.159 10.720
6 HG3 GLU 19 HG3 GLU 19 -2.182 12.953 10.225
No H/Q in entry = 6
In of MODEL 6
1 H GLN 20 H GLN 20 -3.204 12.292 8.306
2 HA GLN 20 HA GLN 20 -0.526 12.053 7.347
3 HB2 GLN 20 HB2 GLN 20 -2.761 10.013 7.374
4 HB3 GLN 20 HB3 GLN 20 -1.056 9.665 7.104
5 HG2 GLN 20 HG2 GLN 20 -0.498 10.315 9.329
6 HG3 GLN 20 HG3 GLN 20 -2.126 10.924 9.613
7 HE21 GLN 20 HE21 GLN 20 -1.444 7.940 7.925
8 HE22 GLN 20 HE22 GLN 20 -2.069 6.887 9.148
No H/Q in entry = 8
In of MODEL 6
1 H LYS 21 H LYS 21 -3.737 11.927 5.835
2 HA LYS 21 HA LYS 21 -2.866 11.261 3.240
3 HB2 LYS 21 HB2 LYS 21 -5.247 12.923 4.098
4 HB3 LYS 21 HB3 LYS 21 -5.006 12.271 2.484
5 HG2 LYS 21 HG2 LYS 21 -5.102 10.003 3.378
6 HG3 LYS 21 HG3 LYS 21 -5.326 10.653 5.003
7 HD2 LYS 21 HD2 LYS 21 -7.424 11.674 4.335
8 HD3 LYS 21 HD3 LYS 21 -7.186 11.131 2.673
9 HE2 LYS 21 HE2 LYS 21 -7.298 8.814 3.396
10 HE3 LYS 21 HE3 LYS 21 -7.471 9.326 5.073
11 HZ1 LYS 21 HZ1 LYS 21 -9.393 9.912 2.888
12 HZ2 LYS 21 HZ2 LYS 21 -9.599 8.740 4.088
13 HZ3 LYS 21 HZ3 LYS 21 -9.565 10.375 4.506
No H/Q in entry = 13
In of MODEL 6
1 H ASP 22 H ASP 22 -3.431 14.368 4.804
2 HA ASP 22 HA ASP 22 -2.660 16.021 2.651
3 HB2 ASP 22 HB2 ASP 22 -3.971 16.752 4.631
4 HB3 ASP 22 HB3 ASP 22 -2.515 16.616 5.609
No H/Q in entry = 4
In of MODEL 6
1 H GLU 23 H GLU 23 -0.731 14.438 5.210
2 HA GLU 23 HA GLU 23 1.728 15.627 4.633
3 HB2 GLU 23 HB2 GLU 23 0.949 12.878 5.564
4 HB3 GLU 23 HB3 GLU 23 2.605 13.406 5.413
5 HG2 GLU 23 HG2 GLU 23 0.536 14.686 7.133
6 HG3 GLU 23 HG3 GLU 23 1.787 13.585 7.697
No H/Q in entry = 6
In of MODEL 6
1 H LEU 24 H LEU 24 0.309 12.617 3.289
2 HA LEU 24 HA LEU 24 2.404 12.124 1.499
3 HB2 LEU 24 HB2 LEU 24 -0.426 11.243 1.791
4 HB3 LEU 24 HB3 LEU 24 0.416 10.870 0.299
5 HG LEU 24 HG LEU 24 2.113 9.662 1.553
6 HD11 LEU 24 HD11 LEU 24 1.829 11.058 3.636
7 HD12 LEU 24 HD12 LEU 24 0.536 9.928 4.037
8 HD13 LEU 24 HD13 LEU 24 2.188 9.338 3.798
9 HD21 LEU 24 HD21 LEU 24 -0.691 8.835 2.211
10 HD22 LEU 24 HD22 LEU 24 0.197 8.442 0.738
11 HD23 LEU 24 HD23 LEU 24 0.724 7.790 2.287
No H/Q in entry = 11
In of MODEL 6
1 H LEU 25 H LEU 25 -0.688 13.825 1.073
2 HA LEU 25 HA LEU 25 -0.403 14.362 -1.662
3 HB2 LEU 25 HB2 LEU 25 -1.824 15.989 0.448
4 HB3 LEU 25 HB3 LEU 25 -2.048 16.149 -1.282
5 HG LEU 25 HG LEU 25 -2.753 13.744 0.395
6 HD11 LEU 25 HD11 LEU 25 -4.471 15.718 -1.095
7 HD12 LEU 25 HD12 LEU 25 -5.048 14.270 -0.270
8 HD13 LEU 25 HD13 LEU 25 -4.312 15.579 0.656
9 HD21 LEU 25 HD21 LEU 25 -3.017 14.168 -2.577
10 HD22 LEU 25 HD22 LEU 25 -1.947 13.022 -1.774
11 HD23 LEU 25 HD23 LEU 25 -3.694 12.817 -1.673
No H/Q in entry = 11
In of MODEL 6
1 H LYS 26 H LYS 26 0.681 16.122 1.193
2 HA LYS 26 HA LYS 26 1.781 18.365 -0.078
3 HB2 LYS 26 HB2 LYS 26 1.499 18.438 2.272
4 HB3 LYS 26 HB3 LYS 26 2.396 16.946 2.500
5 HG2 LYS 26 HG2 LYS 26 4.458 18.078 1.842
6 HG3 LYS 26 HG3 LYS 26 3.558 19.575 1.604
7 HD2 LYS 26 HD2 LYS 26 4.748 19.461 3.782
8 HD3 LYS 26 HD3 LYS 26 3.006 19.684 3.939
9 HE2 LYS 26 HE2 LYS 26 2.720 17.326 4.444
10 HE3 LYS 26 HE3 LYS 26 4.443 17.043 4.193
11 HZ1 LYS 26 HZ1 LYS 26 3.359 18.878 6.253
12 HZ2 LYS 26 HZ2 LYS 26 3.755 17.262 6.557
13 HZ3 LYS 26 HZ3 LYS 26 4.959 18.358 6.090
No H/Q in entry = 13
In of MODEL 6
1 H MET 27 H MET 27 3.315 15.340 0.954
2 HA MET 27 HA MET 27 5.826 15.800 -0.095
3 HB2 MET 27 HB2 MET 27 4.388 13.157 0.145
4 HB3 MET 27 HB3 MET 27 6.125 13.364 -0.039
5 HG2 MET 27 HG2 MET 27 6.247 14.497 2.094
6 HG3 MET 27 HG3 MET 27 4.498 14.392 2.269
7 HE1 MET 27 HE1 MET 27 7.837 12.429 2.046
8 HE2 MET 27 HE2 MET 27 7.326 10.762 2.320
9 HE3 MET 27 HE3 MET 27 6.875 11.589 0.829
No H/Q in entry = 9
In of MODEL 6
1 H LYS 28 H LYS 28 3.126 14.047 -1.653
2 HA LYS 28 HA LYS 28 4.422 13.430 -4.036
3 HB2 LYS 28 HB2 LYS 28 2.385 12.353 -3.361
4 HB3 LYS 28 HB3 LYS 28 1.519 13.879 -3.350
5 HG2 LYS 28 HG2 LYS 28 1.656 14.016 -5.756
6 HG3 LYS 28 HG3 LYS 28 2.638 12.551 -5.807
7 HD2 LYS 28 HD2 LYS 28 0.823 11.226 -4.970
8 HD3 LYS 28 HD3 LYS 28 -0.149 12.666 -4.666
9 HE2 LYS 28 HE2 LYS 28 0.795 11.836 -7.397
10 HE3 LYS 28 HE3 LYS 28 -0.764 11.374 -6.724
11 HZ1 LYS 28 HZ1 LYS 28 0.108 14.190 -7.010
12 HZ2 LYS 28 HZ2 LYS 28 -0.794 13.373 -8.185
13 HZ3 LYS 28 HZ3 LYS 28 -1.446 13.621 -6.637
No H/Q in entry = 13
In of MODEL 6
1 H LYS 29 H LYS 29 2.468 16.269 -3.172
2 HA LYS 29 HA LYS 29 2.692 17.412 -5.760
3 HB2 LYS 29 HB2 LYS 29 0.829 17.834 -4.156
4 HB3 LYS 29 HB3 LYS 29 1.927 18.830 -3.214
5 HG2 LYS 29 HG2 LYS 29 2.039 20.479 -4.856
6 HG3 LYS 29 HG3 LYS 29 1.448 19.396 -6.116
7 HD2 LYS 29 HD2 LYS 29 -0.203 20.340 -3.774
8 HD3 LYS 29 HD3 LYS 29 -0.222 21.093 -5.369
9 HE2 LYS 29 HE2 LYS 29 -0.930 18.945 -6.345
10 HE3 LYS 29 HE3 LYS 29 -0.965 18.239 -4.732
11 HZ1 LYS 29 HZ1 LYS 29 -2.641 20.522 -5.620
12 HZ2 LYS 29 HZ2 LYS 29 -3.165 18.918 -5.507
13 HZ3 LYS 29 HZ3 LYS 29 -2.707 19.761 -4.113
No H/Q in entry = 13
In of MODEL 6
1 H ASP 30 H ASP 30 4.729 17.641 -2.930
2 HA ASP 30 HA ASP 30 6.073 19.972 -3.999
3 HB2 ASP 30 HB2 ASP 30 6.359 18.388 -1.484
4 HB3 ASP 30 HB3 ASP 30 7.722 19.365 -2.020
No H/Q in entry = 4
In of MODEL 6
1 H GLY 31 H GLY 31 6.043 17.007 -5.021
2 HA2 GLY 31 HA2 GLY 31 8.511 17.513 -6.438
3 HA3 GLY 31 HA3 GLY 31 7.306 16.297 -6.834
No H/Q in entry = 3
In of MODEL 6
1 H LYS 32 H LYS 32 7.467 15.541 -3.854
2 HA LYS 32 HA LYS 32 10.020 14.312 -3.593
3 HB2 LYS 32 HB2 LYS 32 7.420 13.576 -2.221
4 HB3 LYS 32 HB3 LYS 32 9.036 13.112 -1.707
5 HG2 LYS 32 HG2 LYS 32 7.991 15.936 -1.812
6 HG3 LYS 32 HG3 LYS 32 8.108 14.943 -0.361
7 HD2 LYS 32 HD2 LYS 32 10.528 15.462 -2.051
8 HD3 LYS 32 HD3 LYS 32 9.977 16.660 -0.881
9 HE2 LYS 32 HE2 LYS 32 10.500 13.784 -0.166
10 HE3 LYS 32 HE3 LYS 32 11.735 15.040 -0.065
11 HZ1 LYS 32 HZ1 LYS 32 9.133 15.139 1.361
12 HZ2 LYS 32 HZ2 LYS 32 10.582 14.612 2.054
13 HZ3 LYS 32 HZ3 LYS 32 10.428 16.213 1.533
No H/Q in entry = 13
In of MODEL 6
1 H ALA 33 H ALA 33 10.482 12.133 -3.841
2 HA ALA 33 HA ALA 33 9.442 11.038 -6.269
3 HB1 ALA 33 HB1 ALA 33 11.815 10.838 -5.624
4 HB2 ALA 33 HB2 ALA 33 11.073 9.270 -5.949
5 HB3 ALA 33 HB3 ALA 33 11.339 9.789 -4.285
No H/Q in entry = 5
In of MODEL 6
1 H LYS 34 H LYS 34 8.342 9.047 -6.550
2 HA LYS 34 HA LYS 34 6.291 8.445 -4.764
3 HB2 LYS 34 HB2 LYS 34 7.581 6.569 -6.756
4 HB3 LYS 34 HB3 LYS 34 5.988 6.376 -6.035
5 HG2 LYS 34 HG2 LYS 34 6.834 8.626 -7.851
6 HG3 LYS 34 HG3 LYS 34 5.847 7.238 -8.312
7 HD2 LYS 34 HD2 LYS 34 4.107 7.927 -6.771
8 HD3 LYS 34 HD3 LYS 34 5.107 9.263 -6.200
9 HE2 LYS 34 HE2 LYS 34 4.118 8.929 -9.029
10 HE3 LYS 34 HE3 LYS 34 3.371 9.966 -7.815
11 HZ1 LYS 34 HZ1 LYS 34 5.479 11.193 -7.677
12 HZ2 LYS 34 HZ2 LYS 34 6.114 10.242 -8.920
13 HZ3 LYS 34 HZ3 LYS 34 4.800 11.261 -9.221
No H/Q in entry = 13
In of MODEL 6
1 H LYS 35 H LYS 35 9.554 7.242 -4.993
2 HA LYS 35 HA LYS 35 9.480 5.068 -3.256
3 HB2 LYS 35 HB2 LYS 35 11.759 7.038 -3.422
4 HB3 LYS 35 HB3 LYS 35 11.847 5.326 -3.035
5 HG2 LYS 35 HG2 LYS 35 11.225 6.565 -5.705
6 HG3 LYS 35 HG3 LYS 35 12.661 5.647 -5.255
7 HD2 LYS 35 HD2 LYS 35 9.867 4.522 -5.260
8 HD3 LYS 35 HD3 LYS 35 10.997 4.369 -6.604
9 HE2 LYS 35 HE2 LYS 35 12.513 3.090 -5.277
10 HE3 LYS 35 HE3 LYS 35 11.590 3.416 -3.809
11 HZ1 LYS 35 HZ1 LYS 35 10.515 1.933 -6.142
12 HZ2 LYS 35 HZ2 LYS 35 11.204 1.186 -4.778
13 HZ3 LYS 35 HZ3 LYS 35 9.792 2.118 -4.615
No H/Q in entry = 13
In of MODEL 6
1 H GLU 36 H GLU 36 9.160 8.440 -2.551
2 HA GLU 36 HA GLU 36 9.906 8.094 0.235
3 HB2 GLU 36 HB2 GLU 36 8.918 10.584 -1.150
4 HB3 GLU 36 HB3 GLU 36 9.734 10.486 0.407
5 HG2 GLU 36 HG2 GLU 36 11.724 9.576 -0.764
6 HG3 GLU 36 HG3 GLU 36 10.899 9.860 -2.285
No H/Q in entry = 6
In of MODEL 6
1 H LEU 37 H LEU 37 7.155 8.441 -1.795
2 HA LEU 37 HA LEU 37 5.221 8.780 0.262
3 HB2 LEU 37 HB2 LEU 37 5.087 7.983 -2.632
4 HB3 LEU 37 HB3 LEU 37 3.659 8.098 -1.625
5 HG LEU 37 HG LEU 37 3.957 10.086 -2.966
6 HD11 LEU 37 HD11 LEU 37 2.913 10.267 -0.751
7 HD12 LEU 37 HD12 LEU 37 4.494 10.651 -0.068
8 HD13 LEU 37 HD13 LEU 37 3.743 11.750 -1.223
9 HD21 LEU 37 HD21 LEU 37 6.354 10.113 -3.227
10 HD22 LEU 37 HD22 LEU 37 5.777 11.652 -2.590
11 HD23 LEU 37 HD23 LEU 37 6.543 10.484 -1.515
No H/Q in entry = 11
In of MODEL 6
1 H GLU 38 H GLU 38 6.373 5.976 -1.609
2 HA GLU 38 HA GLU 38 4.699 4.051 -0.421
3 HB2 GLU 38 HB2 GLU 38 6.269 2.391 -1.207
4 HB3 GLU 38 HB3 GLU 38 6.133 3.646 -2.433
5 HG2 GLU 38 HG2 GLU 38 8.214 4.626 -1.704
6 HG3 GLU 38 HG3 GLU 38 8.336 3.458 -0.396
No H/Q in entry = 6
In of MODEL 6
1 H ALA 39 H ALA 39 7.223 5.889 0.806
2 HA ALA 39 HA ALA 39 8.019 3.998 2.851
3 HB1 ALA 39 HB1 ALA 39 8.986 6.800 2.322
4 HB2 ALA 39 HB2 ALA 39 9.702 5.638 3.437
5 HB3 ALA 39 HB3 ALA 39 9.718 5.321 1.701
No H/Q in entry = 5
In of MODEL 6
1 H LYS 40 H LYS 40 6.360 7.105 2.617
2 HA LYS 40 HA LYS 40 6.084 7.589 5.352
3 HB2 LYS 40 HB2 LYS 40 5.612 9.033 3.203
4 HB3 LYS 40 HB3 LYS 40 3.993 8.371 3.360
5 HG2 LYS 40 HG2 LYS 40 4.193 10.564 4.400
6 HG3 LYS 40 HG3 LYS 40 3.794 9.314 5.581
7 HD2 LYS 40 HD2 LYS 40 5.861 9.409 6.582
8 HD3 LYS 40 HD3 LYS 40 6.655 9.995 5.122
9 HE2 LYS 40 HE2 LYS 40 5.676 12.174 5.405
10 HE3 LYS 40 HE3 LYS 40 4.721 11.605 6.775
11 HZ1 LYS 40 HZ1 LYS 40 7.687 11.735 6.688
12 HZ2 LYS 40 HZ2 LYS 40 6.687 12.851 7.466
13 HZ3 LYS 40 HZ3 LYS 40 6.750 11.254 8.012
No H/Q in entry = 13
In of MODEL 6
1 H ILE 41 H ILE 41 3.918 5.998 3.007
2 HA ILE 41 HA ILE 41 1.878 5.306 4.779
3 HB ILE 41 HB ILE 41 2.800 3.860 2.296
4 HG12 ILE 41 HG12 ILE 41 0.620 5.914 2.687
5 HG13 ILE 41 HG13 ILE 41 2.201 6.249 1.987
6 HG21 ILE 41 HG21 ILE 41 0.191 3.704 3.795
7 HG22 ILE 41 HG22 ILE 41 0.516 2.951 2.233
8 HG23 ILE 41 HG23 ILE 41 1.402 2.430 3.666
9 HD11 ILE 41 HD11 ILE 41 1.712 4.711 0.166
10 HD12 ILE 41 HD12 ILE 41 0.122 4.395 0.868
11 HD13 ILE 41 HD13 ILE 41 0.521 6.009 0.273
No H/Q in entry = 11
In of MODEL 6
1 H LEU 42 H LEU 42 4.735 3.439 3.755
2 HA LEU 42 HA LEU 42 4.103 1.121 5.209
3 HB2 LEU 42 HB2 LEU 42 6.745 2.196 4.261
4 HB3 LEU 42 HB3 LEU 42 6.564 0.629 5.023
5 HG LEU 42 HG LEU 42 5.346 1.505 2.409
6 HD11 LEU 42 HD11 LEU 42 7.515 -0.461 3.093
7 HD12 LEU 42 HD12 LEU 42 6.772 -0.304 1.502
8 HD13 LEU 42 HD13 LEU 42 7.679 1.044 2.186
9 HD21 LEU 42 HD21 LEU 42 5.006 -1.020 4.005
10 HD22 LEU 42 HD22 LEU 42 3.755 0.065 3.403
11 HD23 LEU 42 HD23 LEU 42 4.676 -0.931 2.273
No H/Q in entry = 11
In of MODEL 6
1 H HIS 43 H HIS 43 5.815 4.047 6.097
2 HA HIS 43 HA HIS 43 6.650 3.245 8.673
3 HB2 HIS 43 HB2 HIS 43 7.498 5.287 7.616
4 HB3 HIS 43 HB3 HIS 43 5.888 5.995 7.642
5 HD1 HIS 43 HD1 HIS 43 8.593 4.861 10.050
6 HD2 HIS 43 HD2 HIS 43 5.308 7.403 9.898
7 HE1 HIS 43 HE1 HIS 43 8.628 6.145 12.208
8 HE2 HIS 43 HE2 HIS 43 6.522 7.518 12.177
No H/Q in entry = 8
In of MODEL 6
1 H TYR 44 H TYR 44 3.701 5.004 7.622
2 HA TYR 44 HA TYR 44 2.421 5.124 10.106
3 HB2 TYR 44 HB2 TYR 44 1.191 4.827 7.350
4 HB3 TYR 44 HB3 TYR 44 0.313 5.304 8.797
5 HD1 TYR 44 HD1 TYR 44 2.305 7.139 10.014
6 HD2 TYR 44 HD2 TYR 44 1.016 6.725 5.988
7 HE1 TYR 44 HE1 TYR 44 2.888 9.470 9.599
8 HE2 TYR 44 HE2 TYR 44 1.606 9.075 5.545
9 HH TYR 44 HH TYR 44 1.905 11.154 6.797
No H/Q in entry = 9
In of MODEL 6
1 H TYR 45 H TYR 45 2.449 2.691 7.616
2 HA TYR 45 HA TYR 45 0.492 0.935 8.499
3 HB2 TYR 45 HB2 TYR 45 1.469 0.973 6.259
4 HB3 TYR 45 HB3 TYR 45 3.018 0.469 6.909
5 HD1 TYR 45 HD1 TYR 45 -0.482 -0.627 6.543
6 HD2 TYR 45 HD2 TYR 45 3.576 -1.783 6.978
7 HE1 TYR 45 HE1 TYR 45 -1.131 -2.962 6.214
8 HE2 TYR 45 HE2 TYR 45 2.950 -4.138 6.633
9 HH TYR 45 HH TYR 45 0.723 -5.511 7.024
No H/Q in entry = 9
In of MODEL 6
1 H ASP 46 H ASP 46 3.996 0.950 9.180
2 HA ASP 46 HA ASP 46 3.816 -1.549 10.578
3 HB2 ASP 46 HB2 ASP 46 5.862 -0.738 9.308
4 HB3 ASP 46 HB3 ASP 46 6.133 0.402 10.617
No H/Q in entry = 4
In of MODEL 6
1 H GLU 47 H GLU 47 3.261 1.693 11.471
2 HA GLU 47 HA GLU 47 3.785 1.166 14.289
3 HB2 GLU 47 HB2 GLU 47 2.862 3.677 12.894
4 HB3 GLU 47 HB3 GLU 47 3.235 3.545 14.603
5 HG2 GLU 47 HG2 GLU 47 5.553 2.944 14.012
6 HG3 GLU 47 HG3 GLU 47 5.151 3.201 12.313
No H/Q in entry = 6
In of MODEL 6
1 H LEU 48 H LEU 48 1.381 0.323 12.328
2 HA LEU 48 HA LEU 48 -0.944 1.522 13.316
3 HB2 LEU 48 HB2 LEU 48 -0.317 -0.933 11.741
4 HB3 LEU 48 HB3 LEU 48 -1.965 -0.597 12.207
5 HG LEU 48 HG LEU 48 -0.222 1.203 10.541
6 HD11 LEU 48 HD11 LEU 48 -0.902 -0.830 9.371
7 HD12 LEU 48 HD12 LEU 48 -2.584 -0.515 9.797
8 HD13 LEU 48 HD13 LEU 48 -1.725 0.590 8.724
9 HD21 LEU 48 HD21 LEU 48 -3.098 1.428 11.408
10 HD22 LEU 48 HD22 LEU 48 -1.769 2.500 11.849
11 HD23 LEU 48 HD23 LEU 48 -2.337 2.440 10.181
No H/Q in entry = 11
In of MODEL 6
1 H GLU 49 H GLU 49 -2.593 -0.668 13.727
2 HA GLU 49 HA GLU 49 -1.930 -1.403 16.483
3 HB2 GLU 49 HB2 GLU 49 -4.496 -0.140 15.503
4 HB3 GLU 49 HB3 GLU 49 -4.322 -0.893 17.081
5 HG2 GLU 49 HG2 GLU 49 -2.720 1.455 16.096
6 HG3 GLU 49 HG3 GLU 49 -4.121 1.551 17.161
No H/Q in entry = 6
In of MODEL 6
1 H GLY 50 H GLY 50 -4.184 -2.801 17.151
2 HA2 GLY 50 HA2 GLY 50 -5.163 -4.861 16.928
3 HA3 GLY 50 HA3 GLY 50 -3.721 -5.293 16.027
No H/Q in entry = 3
In of MODEL 6
1 H ASP 51 H ASP 51 -6.974 -3.984 15.750
2 HA ASP 51 HA ASP 51 -7.490 -5.356 13.304
3 HB2 ASP 51 HB2 ASP 51 -9.258 -4.786 14.936
4 HB3 ASP 51 HB3 ASP 51 -9.007 -3.075 14.608
No H/Q in entry = 4
In of MODEL 6
1 H ALA 52 H ALA 52 -6.236 -2.180 14.063
2 HA ALA 52 HA ALA 52 -6.852 -0.901 11.616
3 HB1 ALA 52 HB1 ALA 52 -4.461 -0.415 13.407
4 HB2 ALA 52 HB2 ALA 52 -5.085 0.681 12.176
5 HB3 ALA 52 HB3 ALA 52 -6.052 0.317 13.605
No H/Q in entry = 5
In of MODEL 6
1 H LYS 53 H LYS 53 -4.058 -2.808 12.657
2 HA LYS 53 HA LYS 53 -2.539 -2.595 10.300
3 HB2 LYS 53 HB2 LYS 53 -2.374 -3.989 12.762
4 HB3 LYS 53 HB3 LYS 53 -2.268 -5.197 11.496
5 HG2 LYS 53 HG2 LYS 53 -0.511 -2.771 11.721
6 HG3 LYS 53 HG3 LYS 53 -0.078 -4.395 12.238
7 HD2 LYS 53 HD2 LYS 53 -0.360 -5.178 9.916
8 HD3 LYS 53 HD3 LYS 53 -0.712 -3.520 9.423
9 HE2 LYS 53 HE2 LYS 53 1.615 -4.071 8.967
10 HE3 LYS 53 HE3 LYS 53 1.505 -2.824 10.204
11 HZ1 LYS 53 HZ1 LYS 53 1.971 -5.711 10.705
12 HZ2 LYS 53 HZ2 LYS 53 3.142 -4.497 10.778
13 HZ3 LYS 53 HZ3 LYS 53 1.871 -4.510 11.891
No H/Q in entry = 13
In of MODEL 6
1 H LYS 54 H LYS 54 -4.695 -5.158 11.451
2 HA LYS 54 HA LYS 54 -4.673 -6.805 9.257
3 HB2 LYS 54 HB2 LYS 54 -6.048 -7.959 10.554
4 HB3 LYS 54 HB3 LYS 54 -6.141 -6.584 11.640
5 HG2 LYS 54 HG2 LYS 54 -8.133 -5.839 10.732
6 HG3 LYS 54 HG3 LYS 54 -7.916 -6.755 9.243
7 HD2 LYS 54 HD2 LYS 54 -8.040 -8.828 10.696
8 HD3 LYS 54 HD3 LYS 54 -8.631 -7.767 11.974
9 HE2 LYS 54 HE2 LYS 54 -9.898 -8.300 9.294
10 HE3 LYS 54 HE3 LYS 54 -10.524 -8.744 10.879
11 HZ1 LYS 54 HZ1 LYS 54 -10.533 -6.242 11.320
12 HZ2 LYS 54 HZ2 LYS 54 -10.370 -6.065 9.640
13 HZ3 LYS 54 HZ3 LYS 54 -11.721 -6.863 10.281
No H/Q in entry = 13
In of MODEL 6
1 H GLU 55 H GLU 55 -6.825 -4.025 9.855
2 HA GLU 55 HA GLU 55 -8.280 -4.314 7.467
3 HB2 GLU 55 HB2 GLU 55 -7.867 -2.052 9.420
4 HB3 GLU 55 HB3 GLU 55 -8.930 -1.893 8.042
5 HG2 GLU 55 HG2 GLU 55 -9.192 -3.920 10.239
6 HG3 GLU 55 HG3 GLU 55 -10.135 -2.445 10.073
No H/Q in entry = 6
In of MODEL 6
1 H ALA 56 H ALA 56 -5.581 -2.142 8.367
2 HA ALA 56 HA ALA 56 -5.494 -0.872 5.892
3 HB1 ALA 56 HB1 ALA 56 -3.205 -0.204 6.467
4 HB2 ALA 56 HB2 ALA 56 -3.177 -1.401 7.759
5 HB3 ALA 56 HB3 ALA 56 -4.279 -0.030 7.852
No H/Q in entry = 5
In of MODEL 6
1 H THR 57 H THR 57 -3.616 -3.655 7.068
2 HA THR 57 HA THR 57 -2.124 -4.214 4.840
3 HB THR 57 HB THR 57 -3.438 -6.215 6.692
4 HG1 THR 57 HG1 THR 57 -0.762 -5.263 6.833
5 HG21 THR 57 HG21 THR 57 -1.079 -6.473 4.828
6 HG22 THR 57 HG22 THR 57 -1.535 -7.668 6.046
7 HG23 THR 57 HG23 THR 57 -2.625 -7.311 4.705
No H/Q in entry = 7
In of MODEL 6
1 H GLU 58 H GLU 58 -5.423 -5.271 5.551
2 HA GLU 58 HA GLU 58 -5.764 -6.736 3.123
3 HB2 GLU 58 HB2 GLU 58 -7.672 -5.773 5.239
4 HB3 GLU 58 HB3 GLU 58 -8.211 -6.641 3.801
5 HG2 GLU 58 HG2 GLU 58 -6.480 -8.411 4.475
6 HG3 GLU 58 HG3 GLU 58 -6.469 -7.596 6.039
No H/Q in entry = 6
In of MODEL 6
1 H HIS 59 H HIS 59 -6.198 -3.353 3.942
2 HA HIS 59 HA HIS 59 -7.795 -2.827 1.600
3 HB2 HIS 59 HB2 HIS 59 -6.353 -1.000 3.526
4 HB3 HIS 59 HB3 HIS 59 -7.218 -0.400 2.118
5 HD1 HIS 59 HD1 HIS 59 -9.770 -2.119 2.284
6 HD2 HIS 59 HD2 HIS 59 -8.004 -0.254 5.556
7 HE1 HIS 59 HE1 HIS 59 -11.598 -1.868 3.990
8 HE2 HIS 59 HE2 HIS 59 -10.496 -0.788 5.987
No H/Q in entry = 8
In of MODEL 6
1 H LEU 60 H LEU 60 -4.428 -2.211 2.563
2 HA LEU 60 HA LEU 60 -3.426 -1.460 0.127
3 HB2 LEU 60 HB2 LEU 60 -2.276 -2.854 2.504
4 HB3 LEU 60 HB3 LEU 60 -1.296 -2.627 1.064
5 HG LEU 60 HG LEU 60 -1.852 -0.196 1.215
6 HD11 LEU 60 HD11 LEU 60 -3.788 -0.319 2.581
7 HD12 LEU 60 HD12 LEU 60 -2.821 -0.907 3.935
8 HD13 LEU 60 HD13 LEU 60 -2.565 0.725 3.312
9 HD21 LEU 60 HD21 LEU 60 -0.308 -1.398 3.496
10 HD22 LEU 60 HD22 LEU 60 0.323 -1.042 1.889
11 HD23 LEU 60 HD23 LEU 60 -0.184 0.273 2.948
No H/Q in entry = 11
In of MODEL 6
1 H LYS 61 H LYS 61 -4.284 -4.692 1.279
2 HA LYS 61 HA LYS 61 -2.997 -6.172 -0.731
3 HB2 LYS 61 HB2 LYS 61 -5.430 -6.694 0.951
4 HB3 LYS 61 HB3 LYS 61 -4.991 -7.800 -0.342
5 HG2 LYS 61 HG2 LYS 61 -2.797 -8.133 0.705
6 HG3 LYS 61 HG3 LYS 61 -3.275 -7.056 2.018
7 HD2 LYS 61 HD2 LYS 61 -5.087 -8.564 2.620
8 HD3 LYS 61 HD3 LYS 61 -4.677 -9.620 1.269
9 HE2 LYS 61 HE2 LYS 61 -2.492 -10.055 2.263
10 HE3 LYS 61 HE3 LYS 61 -2.883 -8.984 3.606
11 HZ1 LYS 61 HZ1 LYS 61 -4.318 -11.492 2.926
12 HZ2 LYS 61 HZ2 LYS 61 -3.212 -11.301 4.189
13 HZ3 LYS 61 HZ3 LYS 61 -4.683 -10.468 4.222
No H/Q in entry = 13
In of MODEL 6
1 H GLY 62 H GLY 62 -6.371 -5.008 -0.593
2 HA2 GLY 62 HA2 GLY 62 -7.771 -4.319 -2.273
3 HA3 GLY 62 HA3 GLY 62 -7.086 -5.637 -3.214
No H/Q in entry = 3
In of MODEL 6
1 H GLY 63 H GLY 63 -5.477 -2.741 -1.935
2 HA2 GLY 63 HA2 GLY 63 -4.168 -1.174 -2.990
3 HA3 GLY 63 HA3 GLY 63 -5.296 -1.301 -4.331
No H/Q in entry = 3
In of MODEL 6
1 H CYS 64 H CYS 64 -3.066 -3.663 -2.929
2 HA CYS 64 HA CYS 64 -1.185 -3.668 -5.003
3 HB2 CYS 64 HB2 CYS 64 -0.699 -4.740 -2.882
4 HB3 CYS 64 HB3 CYS 64 -2.021 -5.877 -3.115
No H/Q in entry = 4
In of MODEL 6
1 H ARG 65 H ARG 65 -4.148 -5.485 -4.510
2 HA ARG 65 HA ARG 65 -3.970 -7.186 -6.718
3 HB2 ARG 65 HB2 ARG 65 -5.587 -7.443 -4.863
4 HB3 ARG 65 HB3 ARG 65 -6.454 -6.026 -5.439
5 HG2 ARG 65 HG2 ARG 65 -7.047 -7.166 -7.479
6 HG3 ARG 65 HG3 ARG 65 -6.077 -8.564 -7.012
7 HD2 ARG 65 HD2 ARG 65 -8.440 -7.522 -5.460
8 HD3 ARG 65 HD3 ARG 65 -8.512 -8.853 -6.609
9 HE ARG 65 HE ARG 65 -6.525 -9.457 -4.749
10 HH11 ARG 65 HH11 ARG 65 -9.985 -8.953 -4.784
11 HH12 ARG 65 HH12 ARG 65 -10.291 -10.054 -3.480
12 HH21 ARG 65 HH21 ARG 65 -6.927 -10.924 -3.019
13 HH22 ARG 65 HH22 ARG 65 -8.555 -11.174 -2.477
No H/Q in entry = 13
In of MODEL 6
1 H GLU 66 H GLU 66 -5.278 -3.903 -6.414
2 HA GLU 66 HA GLU 66 -6.258 -3.679 -9.048
3 HB2 GLU 66 HB2 GLU 66 -5.357 -1.627 -7.039
4 HB3 GLU 66 HB3 GLU 66 -5.973 -1.177 -8.623
5 HG2 GLU 66 HG2 GLU 66 -7.458 -2.745 -6.527
6 HG3 GLU 66 HG3 GLU 66 -7.710 -1.048 -6.935
No H/Q in entry = 6
In of MODEL 6
1 H ILE 67 H ILE 67 -3.094 -2.906 -7.651
2 HA ILE 67 HA ILE 67 -1.988 -1.924 -10.082
3 HB ILE 67 HB ILE 67 -0.718 -2.899 -7.532
4 HG12 ILE 67 HG12 ILE 67 -0.956 -0.172 -8.822
5 HG13 ILE 67 HG13 ILE 67 -1.909 -0.753 -7.461
6 HG21 ILE 67 HG21 ILE 67 0.826 -3.433 -9.346
7 HG22 ILE 67 HG22 ILE 67 0.698 -1.782 -9.955
8 HG23 ILE 67 HG23 ILE 67 1.436 -2.087 -8.383
9 HD11 ILE 67 HD11 ILE 67 1.066 -0.300 -7.472
10 HD12 ILE 67 HD12 ILE 67 -0.148 0.748 -6.736
11 HD13 ILE 67 HD13 ILE 67 0.115 -0.878 -6.104
No H/Q in entry = 11
In of MODEL 6
1 H LEU 68 H LEU 68 -2.003 -5.074 -8.493
2 HA LEU 68 HA LEU 68 -0.366 -6.417 -10.366
3 HB2 LEU 68 HB2 LEU 68 -1.080 -7.148 -8.029
4 HB3 LEU 68 HB3 LEU 68 -2.595 -7.645 -8.756
5 HG LEU 68 HG LEU 68 -1.452 -9.279 -10.130
6 HD11 LEU 68 HD11 LEU 68 1.069 -8.254 -8.827
7 HD12 LEU 68 HD12 LEU 68 0.957 -9.675 -9.866
8 HD13 LEU 68 HD13 LEU 68 0.627 -8.072 -10.524
9 HD21 LEU 68 HD21 LEU 68 -0.652 -9.362 -7.227
10 HD22 LEU 68 HD22 LEU 68 -2.137 -9.997 -7.935
11 HD23 LEU 68 HD23 LEU 68 -0.585 -10.735 -8.331
No H/Q in entry = 11
In of MODEL 6
1 H LYS 69 H LYS 69 -3.697 -5.538 -10.256
2 HA LYS 69 HA LYS 69 -4.538 -7.036 -12.492
3 HB2 LYS 69 HB2 LYS 69 -5.656 -4.652 -11.064
4 HB3 LYS 69 HB3 LYS 69 -6.361 -5.169 -12.591
5 HG2 LYS 69 HG2 LYS 69 -6.975 -7.274 -11.706
6 HG3 LYS 69 HG3 LYS 69 -5.991 -7.033 -10.263
7 HD2 LYS 69 HD2 LYS 69 -8.337 -6.722 -9.740
8 HD3 LYS 69 HD3 LYS 69 -7.474 -5.196 -9.580
9 HE2 LYS 69 HE2 LYS 69 -8.278 -4.529 -11.802
10 HE3 LYS 69 HE3 LYS 69 -9.167 -6.047 -11.922
11 HZ1 LYS 69 HZ1 LYS 69 -9.605 -4.088 -9.737
12 HZ2 LYS 69 HZ2 LYS 69 -10.495 -4.078 -11.183
13 HZ3 LYS 69 HZ3 LYS 69 -10.572 -5.416 -10.154
No H/Q in entry = 13
In of MODEL 6
1 H HIS 70 H HIS 70 -2.384 -4.534 -12.291
2 HA HIS 70 HA HIS 70 -2.907 -3.628 -15.026
3 HB2 HIS 70 HB2 HIS 70 -2.748 -1.778 -13.428
4 HB3 HIS 70 HB3 HIS 70 -1.188 -2.374 -12.870
5 HD1 HIS 70 HD1 HIS 70 -2.798 -0.423 -15.583
6 HD2 HIS 70 HD2 HIS 70 0.959 -1.978 -14.691
7 HE1 HIS 70 HE1 HIS 70 -1.205 0.715 -17.157
8 HE2 HIS 70 HE2 HIS 70 1.021 -0.363 -16.721
No H/Q in entry = 8
In of MODEL 6
1 H VAL 71 H VAL 71 -0.328 -4.509 -12.775
2 HA VAL 71 HA VAL 71 1.683 -4.546 -14.721
3 HB VAL 71 HB VAL 71 2.238 -3.982 -12.486
4 HG11 VAL 71 HG11 VAL 71 1.298 -6.681 -11.689
5 HG12 VAL 71 HG12 VAL 71 2.192 -5.562 -10.653
6 HG13 VAL 71 HG13 VAL 71 0.597 -5.115 -11.274
7 HG21 VAL 71 HG21 VAL 71 3.436 -6.542 -13.402
8 HG22 VAL 71 HG22 VAL 71 4.092 -4.908 -13.500
9 HG23 VAL 71 HG23 VAL 71 3.982 -5.722 -11.943
No H/Q in entry = 9
In of MODEL 6
1 H VAL 72 H VAL 72 0.076 -7.255 -13.005
2 HA VAL 72 HA VAL 72 1.322 -9.009 -14.959
3 HB VAL 72 HB VAL 72 1.035 -9.494 -12.378
4 HG11 VAL 72 HG11 VAL 72 -1.554 -10.471 -13.515
5 HG12 VAL 72 HG12 VAL 72 -0.861 -11.054 -12.002
6 HG13 VAL 72 HG13 VAL 72 -1.314 -9.356 -12.174
7 HG21 VAL 72 HG21 VAL 72 2.187 -10.820 -14.058
8 HG22 VAL 72 HG22 VAL 72 1.354 -11.788 -12.856
9 HG23 VAL 72 HG23 VAL 72 0.658 -11.600 -14.461
No H/Q in entry = 9
In of MODEL 6
1 H GLY 73 H GLY 73 -1.761 -7.639 -14.131
2 HA2 GLY 73 HA2 GLY 73 -2.844 -8.791 -16.612
3 HA3 GLY 73 HA3 GLY 73 -3.383 -7.292 -15.867
No H/Q in entry = 3
In of MODEL 6
1 H GLU 74 H GLU 74 -5.507 -8.346 -16.228
2 HA GLU 74 HA GLU 74 -6.552 -9.273 -13.788
3 HB2 GLU 74 HB2 GLU 74 -7.866 -8.036 -15.459
4 HB3 GLU 74 HB3 GLU 74 -7.757 -9.405 -16.557
5 HG2 GLU 74 HG2 GLU 74 -9.125 -10.743 -15.178
6 HG3 GLU 74 HG3 GLU 74 -9.017 -9.598 -13.841
No H/Q in entry = 6
In of MODEL 6
1 H GLU 75 H GLU 75 -5.545 -10.924 -16.701
2 HA GLU 75 HA GLU 75 -6.361 -13.529 -16.425
3 HB2 GLU 75 HB2 GLU 75 -4.969 -12.679 -18.250
4 HB3 GLU 75 HB3 GLU 75 -3.601 -12.553 -17.154
5 HG2 GLU 75 HG2 GLU 75 -3.762 -15.014 -16.794
6 HG3 GLU 75 HG3 GLU 75 -4.986 -15.061 -18.063
No H/Q in entry = 6
In of MODEL 6
1 H LYS 76 H LYS 76 -3.307 -12.319 -15.046
2 HA LYS 76 HA LYS 76 -2.922 -14.830 -13.721
3 HB2 LYS 76 HB2 LYS 76 -1.015 -13.762 -14.683
4 HB3 LYS 76 HB3 LYS 76 -1.331 -12.279 -13.810
5 HG2 LYS 76 HG2 LYS 76 0.561 -13.497 -12.896
6 HG3 LYS 76 HG3 LYS 76 -0.738 -13.331 -11.723
7 HD2 LYS 76 HD2 LYS 76 0.253 -15.576 -11.669
8 HD3 LYS 76 HD3 LYS 76 -1.437 -15.634 -12.170
9 HE2 LYS 76 HE2 LYS 76 -0.041 -17.116 -13.518
10 HE3 LYS 76 HE3 LYS 76 -0.764 -15.845 -14.495
11 HZ1 LYS 76 HZ1 LYS 76 1.400 -14.643 -14.268
12 HZ2 LYS 76 HZ2 LYS 76 2.048 -16.045 -13.565
13 HZ3 LYS 76 HZ3 LYS 76 1.477 -16.077 -15.156
No H/Q in entry = 13
In of MODEL 6
1 H ALA 77 H ALA 77 -3.786 -11.553 -12.737
2 HA ALA 77 HA ALA 77 -3.621 -11.961 -9.953
3 HB1 ALA 77 HB1 ALA 77 -5.090 -10.014 -9.761
4 HB2 ALA 77 HB2 ALA 77 -5.457 -10.113 -11.483
5 HB3 ALA 77 HB3 ALA 77 -3.819 -9.732 -10.952
No H/Q in entry = 5
In of MODEL 6
1 H ALA 78 H ALA 78 -6.022 -12.786 -12.351
2 HA ALA 78 HA ALA 78 -8.148 -13.459 -10.624
3 HB1 ALA 78 HB1 ALA 78 -7.399 -14.364 -13.402
4 HB2 ALA 78 HB2 ALA 78 -8.870 -14.898 -12.582
5 HB3 ALA 78 HB3 ALA 78 -8.627 -13.187 -12.932
No H/Q in entry = 5
In of MODEL 6
1 H GLU 79 H GLU 79 -5.335 -15.177 -11.790
2 HA GLU 79 HA GLU 79 -6.166 -17.727 -10.758
3 HB2 GLU 79 HB2 GLU 79 -3.405 -16.896 -11.651
4 HB3 GLU 79 HB3 GLU 79 -4.039 -18.531 -11.535
5 HG2 GLU 79 HG2 GLU 79 -5.698 -17.922 -13.287
6 HG3 GLU 79 HG3 GLU 79 -4.849 -16.393 -13.478
No H/Q in entry = 6
In of MODEL 6
1 H LEU 80 H LEU 80 -4.217 -15.055 -9.671
2 HA LEU 80 HA LEU 80 -3.082 -16.405 -7.441
3 HB2 LEU 80 HB2 LEU 80 -3.380 -13.512 -8.199
4 HB3 LEU 80 HB3 LEU 80 -2.600 -14.019 -6.707
5 HG LEU 80 HG LEU 80 -1.691 -15.065 -9.376
6 HD11 LEU 80 HD11 LEU 80 -0.745 -12.579 -7.975
7 HD12 LEU 80 HD12 LEU 80 0.058 -13.348 -9.348
8 HD13 LEU 80 HD13 LEU 80 -1.561 -12.663 -9.540
9 HD21 LEU 80 HD21 LEU 80 -0.430 -14.799 -6.663
10 HD22 LEU 80 HD22 LEU 80 -0.946 -16.283 -7.464
11 HD23 LEU 80 HD23 LEU 80 0.410 -15.357 -8.112
No H/Q in entry = 11
In of MODEL 6
1 H LYS 81 H LYS 81 -6.042 -14.621 -7.989
2 HA LYS 81 HA LYS 81 -6.804 -14.430 -5.268
3 HB2 LYS 81 HB2 LYS 81 -8.439 -14.447 -7.799
4 HB3 LYS 81 HB3 LYS 81 -9.137 -14.210 -6.202
5 HG2 LYS 81 HG2 LYS 81 -7.596 -12.257 -5.920
6 HG3 LYS 81 HG3 LYS 81 -7.161 -12.443 -7.619
7 HD2 LYS 81 HD2 LYS 81 -9.954 -11.983 -6.579
8 HD3 LYS 81 HD3 LYS 81 -8.904 -10.743 -7.254
9 HE2 LYS 81 HE2 LYS 81 -8.887 -11.858 -9.395
10 HE3 LYS 81 HE3 LYS 81 -9.813 -13.203 -8.736
11 HZ1 LYS 81 HZ1 LYS 81 -10.795 -10.408 -8.907
12 HZ2 LYS 81 HZ2 LYS 81 -11.177 -11.629 -10.011
13 HZ3 LYS 81 HZ3 LYS 81 -11.682 -11.755 -8.404
No H/Q in entry = 13
In of MODEL 6
1 H ASN 82 H ASN 82 -7.754 -16.715 -7.830
2 HA ASN 82 HA ASN 82 -9.218 -18.441 -6.169
3 HB2 ASN 82 HB2 ASN 82 -9.346 -18.458 -8.663
4 HB3 ASN 82 HB3 ASN 82 -7.726 -19.128 -8.716
5 HD21 ASN 82 HD21 ASN 82 -10.228 -20.062 -6.399
6 HD22 ASN 82 HD22 ASN 82 -10.398 -21.680 -6.981
No H/Q in entry = 6
In of MODEL 6
1 H LEU 83 H LEU 83 -5.801 -18.379 -7.073
2 HA LEU 83 HA LEU 83 -4.828 -20.711 -6.127
3 HB2 LEU 83 HB2 LEU 83 -3.848 -18.207 -6.828
4 HB3 LEU 83 HB3 LEU 83 -3.275 -18.443 -5.182
5 HG LEU 83 HG LEU 83 -2.532 -20.762 -6.109
6 HD11 LEU 83 HD11 LEU 83 -2.645 -19.142 -8.629
7 HD12 LEU 83 HD12 LEU 83 -1.812 -20.685 -8.444
8 HD13 LEU 83 HD13 LEU 83 -3.564 -20.604 -8.272
9 HD21 LEU 83 HD21 LEU 83 -1.087 -18.203 -6.740
10 HD22 LEU 83 HD22 LEU 83 -0.997 -19.120 -5.240
11 HD23 LEU 83 HD23 LEU 83 -0.346 -19.803 -6.727
No H/Q in entry = 11
In of MODEL 6
1 H LYS 84 H LYS 84 -5.211 -17.757 -4.207
2 HA LYS 84 HA LYS 84 -4.254 -19.081 -1.854
3 HB2 LYS 84 HB2 LYS 84 -3.610 -16.843 -2.044
4 HB3 LYS 84 HB3 LYS 84 -5.233 -16.313 -2.451
5 HG2 LYS 84 HG2 LYS 84 -5.958 -16.701 -0.177
6 HG3 LYS 84 HG3 LYS 84 -4.388 -17.385 0.235
7 HD2 LYS 84 HD2 LYS 84 -3.363 -15.181 -0.333
8 HD3 LYS 84 HD3 LYS 84 -4.994 -14.534 -0.530
9 HE2 LYS 84 HE2 LYS 84 -4.147 -14.023 1.687
10 HE3 LYS 84 HE3 LYS 84 -5.502 -15.147 1.790
11 HZ1 LYS 84 HZ1 LYS 84 -3.868 -16.965 1.985
12 HZ2 LYS 84 HZ2 LYS 84 -2.622 -15.822 2.018
13 HZ3 LYS 84 HZ3 LYS 84 -3.771 -15.860 3.258
No H/Q in entry = 13
In of MODEL 6
1 H ASP 85 H ASP 85 -7.402 -17.817 -2.921
2 HA ASP 85 HA ASP 85 -8.741 -18.389 -0.523
3 HB2 ASP 85 HB2 ASP 85 -9.637 -17.842 -3.321
4 HB3 ASP 85 HB3 ASP 85 -10.809 -18.401 -2.132
No H/Q in entry = 4
In of MODEL 6
1 H SER 86 H SER 86 -7.727 -20.717 -3.010
2 HA SER 86 HA SER 86 -9.423 -22.476 -1.353
3 HB2 SER 86 HB2 SER 86 -9.450 -24.032 -3.351
4 HB3 SER 86 HB3 SER 86 -10.334 -22.515 -3.519
5 HG SER 86 HG SER 86 -8.672 -21.691 -4.754
No H/Q in entry = 5
In of MODEL 6
1 H GLY 87 H GLY 87 -6.528 -22.882 -3.447
2 HA2 GLY 87 HA2 GLY 87 -5.515 -25.089 -3.400
3 HA3 GLY 87 HA3 GLY 87 -5.910 -25.174 -1.698
No H/Q in entry = 3
In of MODEL 6
1 H ALA 88 H ALA 88 -4.561 -22.209 -2.850
2 HA ALA 88 HA ALA 88 -1.904 -23.256 -2.642
3 HB1 ALA 88 HB1 ALA 88 -2.903 -20.543 -3.432
4 HB2 ALA 88 HB2 ALA 88 -1.197 -20.977 -3.382
5 HB3 ALA 88 HB3 ALA 88 -2.290 -21.827 -4.472
No H/Q in entry = 5
In of MODEL 6
1 H SER 89 H SER 89 -0.719 -23.144 -0.883
2 HA SER 89 HA SER 89 -1.314 -21.611 1.446
3 HB2 SER 89 HB2 SER 89 0.009 -23.688 1.571
4 HB3 SER 89 HB3 SER 89 1.291 -22.932 0.626
5 HG SER 89 HG SER 89 0.625 -22.627 3.290
No H/Q in entry = 5
In of MODEL 6
1 H LYS 90 H LYS 90 0.272 -19.905 2.339
2 HA LYS 90 HA LYS 90 0.391 -17.764 0.536
3 HB2 LYS 90 HB2 LYS 90 1.881 -18.146 3.134
4 HB3 LYS 90 HB3 LYS 90 1.858 -16.641 2.229
5 HG2 LYS 90 HG2 LYS 90 -0.662 -16.707 2.434
6 HG3 LYS 90 HG3 LYS 90 -0.436 -18.014 3.594
7 HD2 LYS 90 HD2 LYS 90 0.727 -15.240 3.834
8 HD3 LYS 90 HD3 LYS 90 -0.697 -15.827 4.691
9 HE2 LYS 90 HE2 LYS 90 0.733 -17.592 5.714
10 HE3 LYS 90 HE3 LYS 90 2.133 -16.829 4.964
11 HZ1 LYS 90 HZ1 LYS 90 1.638 -14.806 6.206
12 HZ2 LYS 90 HZ2 LYS 90 0.306 -15.555 6.930
13 HZ3 LYS 90 HZ3 LYS 90 1.864 -16.118 7.251
No H/Q in entry = 13
In of MODEL 6
1 H GLU 91 H GLU 91 2.632 -20.323 1.127
2 HA GLU 91 HA GLU 91 4.918 -19.120 0.012
3 HB2 GLU 91 HB2 GLU 91 4.105 -21.992 0.335
4 HB3 GLU 91 HB3 GLU 91 5.650 -21.521 -0.360
5 HG2 GLU 91 HG2 GLU 91 4.646 -20.931 2.409
6 HG3 GLU 91 HG3 GLU 91 5.960 -22.000 1.942
No H/Q in entry = 6
In of MODEL 6
1 H GLU 92 H GLU 92 2.235 -20.847 -1.369
2 HA GLU 92 HA GLU 92 3.332 -21.288 -3.965
3 HB2 GLU 92 HB2 GLU 92 0.499 -21.349 -2.938
4 HB3 GLU 92 HB3 GLU 92 1.034 -21.977 -4.481
5 HG2 GLU 92 HG2 GLU 92 2.148 -22.964 -1.894
6 HG3 GLU 92 HG3 GLU 92 0.672 -23.613 -2.597
No H/Q in entry = 6
In of MODEL 6
1 H LEU 93 H LEU 93 1.296 -18.988 -2.325
2 HA LEU 93 HA LEU 93 0.862 -17.207 -4.483
3 HB2 LEU 93 HB2 LEU 93 1.054 -16.864 -1.499
4 HB3 LEU 93 HB3 LEU 93 0.862 -15.475 -2.549
5 HG LEU 93 HG LEU 93 -1.233 -16.366 -1.495
6 HD11 LEU 93 HD11 LEU 93 -1.095 -16.245 -4.506
7 HD12 LEU 93 HD12 LEU 93 -2.573 -16.113 -3.556
8 HD13 LEU 93 HD13 LEU 93 -1.320 -14.880 -3.412
9 HD21 LEU 93 HD21 LEU 93 -0.710 -18.636 -3.378
10 HD22 LEU 93 HD22 LEU 93 -0.947 -18.707 -1.633
11 HD23 LEU 93 HD23 LEU 93 -2.296 -18.288 -2.691
No H/Q in entry = 11
In of MODEL 6
1 H LYS 94 H LYS 94 3.528 -17.473 -2.082
2 HA LYS 94 HA LYS 94 4.913 -15.229 -3.046
3 HB2 LYS 94 HB2 LYS 94 5.444 -16.232 -0.882
4 HB3 LYS 94 HB3 LYS 94 5.988 -17.704 -1.674
5 HG2 LYS 94 HG2 LYS 94 7.786 -16.423 -2.764
6 HG3 LYS 94 HG3 LYS 94 7.263 -14.984 -1.885
7 HD2 LYS 94 HD2 LYS 94 7.714 -16.115 0.235
8 HD3 LYS 94 HD3 LYS 94 8.221 -17.561 -0.638
9 HE2 LYS 94 HE2 LYS 94 9.524 -14.850 -0.831
10 HE3 LYS 94 HE3 LYS 94 10.127 -16.206 0.118
11 HZ1 LYS 94 HZ1 LYS 94 9.758 -16.255 -2.837
12 HZ2 LYS 94 HZ2 LYS 94 11.228 -15.963 -2.052
13 HZ3 LYS 94 HZ3 LYS 94 10.465 -17.459 -1.877
No H/Q in entry = 13
In of MODEL 6
1 H ALA 95 H ALA 95 5.016 -18.631 -3.953
2 HA ALA 95 HA ALA 95 7.216 -18.122 -5.733
3 HB1 ALA 95 HB1 ALA 95 7.154 -20.206 -4.410
4 HB2 ALA 95 HB2 ALA 95 7.214 -20.536 -6.143
5 HB3 ALA 95 HB3 ALA 95 5.687 -20.682 -5.269
No H/Q in entry = 5
In of MODEL 6
1 H LYS 96 H LYS 96 3.785 -18.403 -5.955
2 HA LYS 96 HA LYS 96 3.779 -18.422 -8.803
3 HB2 LYS 96 HB2 LYS 96 1.798 -18.870 -7.255
4 HB3 LYS 96 HB3 LYS 96 1.669 -17.127 -7.077
5 HG2 LYS 96 HG2 LYS 96 0.108 -17.801 -8.736
6 HG3 LYS 96 HG3 LYS 96 1.426 -16.965 -9.557
7 HD2 LYS 96 HD2 LYS 96 2.388 -19.059 -10.254
8 HD3 LYS 96 HD3 LYS 96 1.208 -19.961 -9.300
9 HE2 LYS 96 HE2 LYS 96 -0.596 -19.051 -10.704
10 HE3 LYS 96 HE3 LYS 96 0.609 -18.200 -11.674
11 HZ1 LYS 96 HZ1 LYS 96 0.548 -21.149 -11.332
12 HZ2 LYS 96 HZ2 LYS 96 -0.130 -20.338 -12.650
13 HZ3 LYS 96 HZ3 LYS 96 1.536 -20.268 -12.382
No H/Q in entry = 13
In of MODEL 6
1 H VAL 97 H VAL 97 3.393 -15.794 -6.482
2 HA VAL 97 HA VAL 97 3.215 -13.667 -8.197
3 HB VAL 97 HB VAL 97 4.484 -13.807 -5.460
4 HG11 VAL 97 HG11 VAL 97 5.353 -11.863 -6.650
5 HG12 VAL 97 HG12 VAL 97 3.708 -11.366 -7.046
6 HG13 VAL 97 HG13 VAL 97 4.244 -11.381 -5.366
7 HG21 VAL 97 HG21 VAL 97 1.785 -12.905 -6.446
8 HG22 VAL 97 HG22 VAL 97 2.137 -14.390 -5.559
9 HG23 VAL 97 HG23 VAL 97 2.341 -12.821 -4.772
No H/Q in entry = 9
In of MODEL 6
1 H GLU 98 H GLU 98 6.161 -15.284 -7.052
2 HA GLU 98 HA GLU 98 7.973 -13.524 -8.287
3 HB2 GLU 98 HB2 GLU 98 8.208 -16.434 -7.545
4 HB3 GLU 98 HB3 GLU 98 9.542 -15.512 -8.228
5 HG2 GLU 98 HG2 GLU 98 9.434 -13.956 -6.348
6 HG3 GLU 98 HG3 GLU 98 8.090 -14.871 -5.666
No H/Q in entry = 6
In of MODEL 6
1 H GLU 99 H GLU 99 6.476 -16.532 -9.497
2 HA GLU 99 HA GLU 99 7.792 -16.461 -12.002
3 HB2 GLU 99 HB2 GLU 99 6.465 -18.299 -12.618
4 HB3 GLU 99 HB3 GLU 99 6.675 -18.445 -10.880
5 HG2 GLU 99 HG2 GLU 99 4.492 -18.836 -10.914
6 HG3 GLU 99 HG3 GLU 99 4.442 -17.076 -10.894
No H/Q in entry = 6
In of MODEL 6
1 H ALA 100 H ALA 100 4.790 -15.174 -10.810
2 HA ALA 100 HA ALA 100 3.780 -14.347 -13.342
3 HB1 ALA 100 HB1 ALA 100 2.197 -14.670 -11.653
4 HB2 ALA 100 HB2 ALA 100 3.104 -13.687 -10.495
5 HB3 ALA 100 HB3 ALA 100 2.281 -12.921 -11.847
No H/Q in entry = 5
In of MODEL 6
1 H LEU 101 H LEU 101 5.269 -12.516 -10.665
2 HA LEU 101 HA LEU 101 5.353 -10.061 -12.067
3 HB2 LEU 101 HB2 LEU 101 6.613 -11.110 -9.566
4 HB3 LEU 101 HB3 LEU 101 7.105 -9.557 -10.206
5 HG LEU 101 HG LEU 101 5.331 -9.574 -8.374
6 HD11 LEU 101 HD11 LEU 101 4.811 -8.140 -10.969
7 HD12 LEU 101 HD12 LEU 101 4.094 -7.713 -9.417
8 HD13 LEU 101 HD13 LEU 101 5.836 -7.591 -9.645
9 HD21 LEU 101 HD21 LEU 101 3.923 -11.357 -9.265
10 HD22 LEU 101 HD22 LEU 101 3.021 -9.854 -9.077
11 HD23 LEU 101 HD23 LEU 101 3.560 -10.366 -10.676
No H/Q in entry = 11
In of MODEL 6
1 H HIS 102 H HIS 102 7.317 -12.837 -12.345
2 HA HIS 102 HA HIS 102 9.502 -11.314 -13.471
3 HB2 HIS 102 HB2 HIS 102 9.018 -14.202 -12.951
4 HB3 HIS 102 HB3 HIS 102 10.136 -13.787 -14.243
5 HD1 HIS 102 HD1 HIS 102 12.386 -14.205 -13.298
6 HD2 HIS 102 HD2 HIS 102 9.923 -12.192 -10.619
7 HE1 HIS 102 HE1 HIS 102 13.835 -13.674 -11.315
8 HE2 HIS 102 HE2 HIS 102 12.313 -12.520 -9.679
No H/Q in entry = 8
In of MODEL 6
1 H ALA 103 H ALA 103 6.885 -13.434 -14.583
2 HA ALA 103 HA ALA 103 7.681 -13.509 -17.272
3 HB1 ALA 103 HB1 ALA 103 4.913 -13.977 -16.185
4 HB2 ALA 103 HB2 ALA 103 6.217 -15.164 -16.137
5 HB3 ALA 103 HB3 ALA 103 5.588 -14.604 -17.689
No H/Q in entry = 5
In of MODEL 6
1 H VAL 104 H VAL 104 6.597 -10.836 -15.699
2 HA VAL 104 HA VAL 104 5.190 -9.729 -17.959
3 HB VAL 104 HB VAL 104 4.158 -9.228 -15.929
4 HG11 VAL 104 HG11 VAL 104 5.934 -9.849 -14.458
5 HG12 VAL 104 HG12 VAL 104 6.832 -8.397 -14.892
6 HG13 VAL 104 HG13 VAL 104 5.304 -8.263 -14.017
7 HG21 VAL 104 HG21 VAL 104 5.842 -6.841 -16.654
8 HG22 VAL 104 HG22 VAL 104 4.301 -7.274 -17.382
9 HG23 VAL 104 HG23 VAL 104 4.370 -6.788 -15.690
No H/Q in entry = 9
In of MODEL 6
1 H THR 105 H THR 105 5.945 -7.895 -19.077
2 HA THR 105 HA THR 105 8.738 -7.153 -18.620
3 HB THR 105 HB THR 105 9.210 -7.521 -21.090
4 HG1 THR 105 HG1 THR 105 7.507 -8.148 -22.181
5 HG21 THR 105 HG21 THR 105 10.165 -8.959 -19.351
6 HG22 THR 105 HG22 THR 105 8.719 -9.967 -19.391
7 HG23 THR 105 HG23 THR 105 9.774 -9.882 -20.801
No H/Q in entry = 7
In of MODEL 6
1 H ASP 106 H ASP 106 5.756 -5.969 -19.092
2 HA ASP 106 HA ASP 106 6.472 -3.867 -20.947
3 HB2 ASP 106 HB2 ASP 106 4.122 -4.569 -20.779
4 HB3 ASP 106 HB3 ASP 106 4.103 -4.099 -19.091
No H/Q in entry = 4
In of MODEL 6
1 H GLU 107 H GLU 107 7.202 -1.904 -20.494
2 HA GLU 107 HA GLU 107 8.940 -1.667 -18.380
3 HB2 GLU 107 HB2 GLU 107 7.743 0.455 -20.154
4 HB3 GLU 107 HB3 GLU 107 9.018 0.794 -18.996
5 HG2 GLU 107 HG2 GLU 107 9.946 0.512 -21.200
6 HG3 GLU 107 HG3 GLU 107 10.479 -0.799 -20.151
No H/Q in entry = 6
In of MODEL 6
1 H GLU 108 H GLU 108 5.885 0.085 -18.747
2 HA GLU 108 HA GLU 108 5.940 1.453 -16.313
3 HB2 GLU 108 HB2 GLU 108 4.386 2.088 -18.043
4 HB3 GLU 108 HB3 GLU 108 3.601 0.515 -17.979
5 HG2 GLU 108 HG2 GLU 108 2.816 0.987 -15.724
6 HG3 GLU 108 HG3 GLU 108 3.621 2.554 -15.768
No H/Q in entry = 6
In of MODEL 6
1 H LYS 109 H LYS 109 4.571 -1.721 -17.125
2 HA LYS 109 HA LYS 109 3.437 -2.308 -14.637
3 HB2 LYS 109 HB2 LYS 109 4.668 -4.158 -16.690
4 HB3 LYS 109 HB3 LYS 109 3.626 -4.672 -15.374
5 HG2 LYS 109 HG2 LYS 109 1.817 -3.287 -16.313
6 HG3 LYS 109 HG3 LYS 109 2.867 -2.892 -17.672
7 HD2 LYS 109 HD2 LYS 109 3.041 -5.327 -18.161
8 HD3 LYS 109 HD3 LYS 109 1.870 -5.625 -16.880
9 HE2 LYS 109 HE2 LYS 109 0.233 -4.240 -18.066
10 HE3 LYS 109 HE3 LYS 109 1.405 -3.976 -19.356
11 HZ1 LYS 109 HZ1 LYS 109 0.316 -6.618 -18.550
12 HZ2 LYS 109 HZ2 LYS 109 -0.176 -5.730 -19.900
13 HZ3 LYS 109 HZ3 LYS 109 1.397 -6.337 -19.816
No H/Q in entry = 13
In of MODEL 6
1 H LYS 110 H LYS 110 6.694 -2.878 -15.896
2 HA LYS 110 HA LYS 110 7.649 -4.272 -13.611
3 HB2 LYS 110 HB2 LYS 110 9.212 -2.786 -15.724
4 HB3 LYS 110 HB3 LYS 110 9.863 -3.978 -14.610
5 HG2 LYS 110 HG2 LYS 110 8.742 -5.743 -15.678
6 HG3 LYS 110 HG3 LYS 110 7.690 -4.639 -16.568
7 HD2 LYS 110 HD2 LYS 110 9.426 -5.543 -18.024
8 HD3 LYS 110 HD3 LYS 110 9.623 -3.806 -17.818
9 HE2 LYS 110 HE2 LYS 110 11.339 -4.235 -16.103
10 HE3 LYS 110 HE3 LYS 110 11.175 -5.967 -16.403
11 HZ1 LYS 110 HZ1 LYS 110 11.863 -5.579 -18.696
12 HZ2 LYS 110 HZ2 LYS 110 12.056 -3.931 -18.374
13 HZ3 LYS 110 HZ3 LYS 110 13.046 -5.063 -17.605
No H/Q in entry = 13
In of MODEL 6
1 H GLN 111 H GLN 111 7.266 -0.969 -14.349
2 HA GLN 111 HA GLN 111 8.983 0.144 -12.405
3 HB2 GLN 111 HB2 GLN 111 7.667 1.368 -14.230
4 HB3 GLN 111 HB3 GLN 111 6.285 1.277 -13.152
5 HG2 GLN 111 HG2 GLN 111 7.412 3.437 -13.016
6 HG3 GLN 111 HG3 GLN 111 7.465 2.572 -11.479
7 HE21 GLN 111 HE21 GLN 111 9.405 1.932 -10.654
8 HE22 GLN 111 HE22 GLN 111 10.932 2.357 -11.354
No H/Q in entry = 8
In of MODEL 6
1 H TYR 112 H TYR 112 5.719 -1.141 -12.234
2 HA TYR 112 HA TYR 112 5.285 -0.473 -9.465
3 HB2 TYR 112 HB2 TYR 112 3.884 -2.480 -11.241
4 HB3 TYR 112 HB3 TYR 112 3.353 -2.001 -9.632
5 HD1 TYR 112 HD1 TYR 112 3.620 0.855 -9.583
6 HD2 TYR 112 HD2 TYR 112 2.382 -1.652 -12.792
7 HE1 TYR 112 HE1 TYR 112 2.376 2.736 -10.560
8 HE2 TYR 112 HE2 TYR 112 1.144 0.231 -13.782
9 HH TYR 112 HH TYR 112 1.565 3.429 -12.802
No H/Q in entry = 9
In of MODEL 6
1 H ILE 113 H ILE 113 6.630 -3.155 -11.247
2 HA ILE 113 HA ILE 113 6.733 -5.028 -9.164
3 HB ILE 113 HB ILE 113 8.723 -4.657 -11.400
4 HG12 ILE 113 HG12 ILE 113 6.209 -6.327 -11.215
5 HG13 ILE 113 HG13 ILE 113 6.436 -4.900 -12.221
6 HG21 ILE 113 HG21 ILE 113 8.127 -7.050 -9.659
7 HG22 ILE 113 HG22 ILE 113 9.204 -7.045 -11.055
8 HG23 ILE 113 HG23 ILE 113 9.597 -6.078 -9.633
9 HD11 ILE 113 HD11 ILE 113 8.267 -6.123 -13.384
10 HD12 ILE 113 HD12 ILE 113 7.788 -7.557 -12.480
11 HD13 ILE 113 HD13 ILE 113 6.655 -6.801 -13.600
No H/Q in entry = 11
In of MODEL 6
1 H ALA 114 H ALA 114 9.174 -2.674 -10.263
2 HA ALA 114 HA ALA 114 11.079 -3.208 -8.220
3 HB1 ALA 114 HB1 ALA 114 11.757 -2.245 -10.321
4 HB2 ALA 114 HB2 ALA 114 12.129 -1.110 -9.026
5 HB3 ALA 114 HB3 ALA 114 10.720 -0.840 -10.057
No H/Q in entry = 5
In of MODEL 6
1 H ASP 115 H ASP 115 8.591 -0.762 -8.607
2 HA ASP 115 HA ASP 115 9.427 0.601 -6.211
3 HB2 ASP 115 HB2 ASP 115 7.108 1.041 -8.078
4 HB3 ASP 115 HB3 ASP 115 7.324 1.985 -6.608
No H/Q in entry = 4
In of MODEL 6
1 H PHE 116 H PHE 116 6.583 -1.258 -7.119
2 HA PHE 116 HA PHE 116 5.661 -0.943 -4.374
3 HB2 PHE 116 HB2 PHE 116 4.124 -0.070 -6.009
4 HB3 PHE 116 HB3 PHE 116 4.186 -1.561 -6.937
5 HD1 PHE 116 HD1 PHE 116 3.247 -0.219 -3.643
6 HD2 PHE 116 HD2 PHE 116 2.585 -3.182 -6.608
7 HE1 PHE 116 HE1 PHE 116 1.282 -1.027 -2.391
8 HE2 PHE 116 HE2 PHE 116 0.627 -4.011 -5.369
9 HZ PHE 116 HZ PHE 116 -0.040 -2.971 -3.307
No H/Q in entry = 9
In of MODEL 6
1 H GLY 117 H GLY 117 6.791 -3.307 -6.592
2 HA2 GLY 117 HA2 GLY 117 7.153 -5.561 -6.394
3 HA3 GLY 117 HA3 GLY 117 5.477 -5.612 -5.891
No H/Q in entry = 3
In of MODEL 6
1 HA PRO 118 HA PRO 118 8.640 -6.912 -2.526
2 HB2 PRO 118 HB2 PRO 118 10.212 -4.927 -1.440
3 HB3 PRO 118 HB3 PRO 118 10.729 -6.008 -2.738
4 HG2 PRO 118 HG2 PRO 118 9.701 -3.206 -2.900
5 HG3 PRO 118 HG3 PRO 118 11.020 -3.971 -3.805
6 HD2 PRO 118 HD2 PRO 118 8.589 -3.574 -4.888
7 HD3 PRO 118 HD3 PRO 118 9.575 -4.996 -5.288
No H/Q in entry = 7
In of MODEL 6
1 H ALA 119 H ALA 119 7.308 -3.655 -2.292
2 HA ALA 119 HA ALA 119 6.769 -3.821 0.515
3 HB1 ALA 119 HB1 ALA 119 5.402 -1.811 0.143
4 HB2 ALA 119 HB2 ALA 119 5.629 -1.991 -1.596
5 HB3 ALA 119 HB3 ALA 119 7.013 -1.657 -0.554
No H/Q in entry = 5
In of MODEL 6
1 H CYS 120 H CYS 120 4.969 -4.441 -2.447
2 HA CYS 120 HA CYS 120 2.492 -5.134 -1.363
3 HB2 CYS 120 HB2 CYS 120 2.769 -4.906 -3.743
4 HB3 CYS 120 HB3 CYS 120 3.973 -6.189 -3.776
No H/Q in entry = 4
In of MODEL 6
1 H LYS 121 H LYS 121 5.535 -6.870 -1.436
2 HA LYS 121 HA LYS 121 4.601 -9.444 -0.855
3 HB2 LYS 121 HB2 LYS 121 7.188 -8.164 0.030
4 HB3 LYS 121 HB3 LYS 121 6.846 -9.885 0.059
5 HG2 LYS 121 HG2 LYS 121 6.963 -8.151 -2.400
6 HG3 LYS 121 HG3 LYS 121 8.197 -9.294 -1.869
7 HD2 LYS 121 HD2 LYS 121 6.555 -11.115 -2.069
8 HD3 LYS 121 HD3 LYS 121 5.371 -9.954 -2.663
9 HE2 LYS 121 HE2 LYS 121 6.425 -11.223 -4.475
10 HE3 LYS 121 HE3 LYS 121 6.736 -9.491 -4.598
11 HZ1 LYS 121 HZ1 LYS 121 8.922 -9.864 -3.608
12 HZ2 LYS 121 HZ2 LYS 121 8.623 -11.527 -3.539
13 HZ3 LYS 121 HZ3 LYS 121 8.738 -10.750 -5.035
No H/Q in entry = 13
In of MODEL 6
1 H LYS 122 H LYS 122 5.670 -6.913 1.473
2 HA LYS 122 HA LYS 122 4.853 -8.398 3.744
3 HB2 LYS 122 HB2 LYS 122 5.002 -6.358 5.022
4 HB3 LYS 122 HB3 LYS 122 6.363 -6.448 3.920
5 HG2 LYS 122 HG2 LYS 122 5.387 -4.823 2.471
6 HG3 LYS 122 HG3 LYS 122 3.878 -4.849 3.383
7 HD2 LYS 122 HD2 LYS 122 4.965 -2.910 4.104
8 HD3 LYS 122 HD3 LYS 122 5.266 -4.082 5.380
9 HE2 LYS 122 HE2 LYS 122 7.206 -3.491 3.151
10 HE3 LYS 122 HE3 LYS 122 7.242 -2.684 4.714
11 HZ1 LYS 122 HZ1 LYS 122 7.460 -4.961 5.708
12 HZ2 LYS 122 HZ2 LYS 122 7.717 -5.550 4.147
13 HZ3 LYS 122 HZ3 LYS 122 8.792 -4.431 4.818
No H/Q in entry = 13
In of MODEL 6
1 H ILE 123 H ILE 123 3.160 -6.408 1.458
2 HA ILE 123 HA ILE 123 0.873 -5.886 3.014
3 HB ILE 123 HB ILE 123 1.273 -5.894 0.049
4 HG12 ILE 123 HG12 ILE 123 0.957 -3.693 2.102
5 HG13 ILE 123 HG13 ILE 123 2.478 -4.191 1.363
6 HG21 ILE 123 HG21 ILE 123 -1.153 -5.111 1.652
7 HG22 ILE 123 HG22 ILE 123 -0.896 -4.681 -0.041
8 HG23 ILE 123 HG23 ILE 123 -1.047 -6.375 0.427
9 HD11 ILE 123 HD11 ILE 123 0.133 -3.104 -0.153
10 HD12 ILE 123 HD12 ILE 123 1.497 -2.142 0.404
11 HD13 ILE 123 HD13 ILE 123 1.748 -3.427 -0.773
No H/Q in entry = 11
In of MODEL 6
1 H TYR 124 H TYR 124 1.450 -8.203 0.483
2 HA TYR 124 HA TYR 124 -0.877 -9.810 0.944
3 HB2 TYR 124 HB2 TYR 124 1.322 -9.725 -0.990
4 HB3 TYR 124 HB3 TYR 124 0.812 -11.358 -0.571
5 HD1 TYR 124 HD1 TYR 124 -0.339 -8.124 -1.931
6 HD2 TYR 124 HD2 TYR 124 -1.251 -12.236 -1.362
7 HE1 TYR 124 HE1 TYR 124 -2.235 -7.908 -3.485
8 HE2 TYR 124 HE2 TYR 124 -3.152 -12.034 -2.913
9 HH TYR 124 HH TYR 124 -4.661 -10.211 -3.739
No H/Q in entry = 9
In of MODEL 6
1 H GLY 125 H GLY 125 0.619 -9.566 3.297
2 HA2 GLY 125 HA2 GLY 125 1.919 -10.725 4.895
3 HA3 GLY 125 HA3 GLY 125 3.073 -10.074 3.766
No H/Q in entry = 3
In of MODEL 6
1 H VAL 126 H VAL 126 2.384 -12.066 1.730
2 HA VAL 126 HA VAL 126 2.822 -14.668 2.161
3 HB VAL 126 HB VAL 126 4.367 -14.646 0.145
4 HG11 VAL 126 HG11 VAL 126 1.727 -13.201 -0.028
5 HG12 VAL 126 HG12 VAL 126 2.603 -13.870 -1.406
6 HG13 VAL 126 HG13 VAL 126 1.991 -14.942 -0.144
7 HG21 VAL 126 HG21 VAL 126 3.803 -11.682 0.289
8 HG22 VAL 126 HG22 VAL 126 5.378 -12.457 0.491
9 HG23 VAL 126 HG23 VAL 126 4.559 -12.517 -1.071
No H/Q in entry = 9
In of MODEL 6
1 H HIS 127 H HIS 127 5.218 -12.173 2.803
2 HA HIS 127 HA HIS 127 7.530 -13.713 2.880
3 HB2 HIS 127 HB2 HIS 127 8.542 -11.978 4.194
4 HB3 HIS 127 HB3 HIS 127 7.457 -11.219 3.040
5 HD1 HIS 127 HD1 HIS 127 8.202 -11.458 6.634
6 HD2 HIS 127 HD2 HIS 127 5.015 -10.231 4.255
7 HE1 HIS 127 HE1 HIS 127 6.745 -10.042 8.118
8 HE2 HIS 127 HE2 HIS 127 4.734 -9.480 6.713
No H/Q in entry = 8
In of MODEL 6
1 H THR 128 H THR 128 4.933 -13.513 5.210
2 HA THR 128 HA THR 128 4.520 -14.635 7.153
3 HB THR 128 HB THR 128 6.327 -16.767 5.998
4 HG1 THR 128 HG1 THR 128 4.856 -16.063 4.389
5 HG21 THR 128 HG21 THR 128 3.835 -16.922 7.704
6 HG22 THR 128 HG22 THR 128 4.747 -18.298 7.087
7 HG23 THR 128 HG23 THR 128 5.486 -17.206 8.256
No H/Q in entry = 7
In of MODEL 6
1 H SER 129 H SER 129 5.866 -12.953 8.199
2 HA SER 129 HA SER 129 7.473 -12.191 9.594
3 HB2 SER 129 HB2 SER 129 7.819 -15.146 10.156
4 HB3 SER 129 HB3 SER 129 8.525 -13.851 11.121
5 HG SER 129 HG SER 129 5.814 -14.559 10.799
No H/Q in entry = 5
In of MODEL 7
1 HA2 GLY -4 HA2 GLY -4 -12.266 19.797 -20.370
2 HA3 GLY -4 HA3 GLY -4 -13.479 19.032 -19.354
3 H1 GLY -4 H1 GLY -4 -13.957 21.364 -19.662
4 H2 GLY -4 H2 GLY -4 -12.447 21.794 -19.043
No H/Q in entry = 4
In of MODEL 7
1 H SER -3 H SER -3 -12.040 17.380 -18.755
2 HA SER -3 HA SER -3 -9.859 18.251 -16.979
3 HB2 SER -3 HB2 SER -3 -11.801 15.976 -16.514
4 HB3 SER -3 HB3 SER -3 -10.405 16.338 -15.501
5 HG SER -3 HG SER -3 -11.491 17.878 -14.576
No H/Q in entry = 5
In of MODEL 7
1 HA PRO -2 HA PRO -2 -7.911 15.317 -19.830
2 HB2 PRO -2 HB2 PRO -2 -5.734 16.739 -20.356
3 HB3 PRO -2 HB3 PRO -2 -7.288 17.175 -21.075
4 HG2 PRO -2 HG2 PRO -2 -5.844 18.414 -18.784
5 HG3 PRO -2 HG3 PRO -2 -6.802 19.186 -20.058
6 HD2 PRO -2 HD2 PRO -2 -7.686 18.579 -17.471
7 HD3 PRO -2 HD3 PRO -2 -8.718 18.986 -18.855
No H/Q in entry = 7
In of MODEL 7
1 H GLU -1 H GLU -1 -5.367 14.765 -19.805
2 HA GLU -1 HA GLU -1 -3.682 13.706 -18.723
3 HB2 GLU -1 HB2 GLU -1 -4.179 15.842 -16.643
4 HB3 GLU -1 HB3 GLU -1 -2.731 14.852 -16.760
5 HG2 GLU -1 HG2 GLU -1 -2.238 15.828 -18.942
6 HG3 GLU -1 HG3 GLU -1 -3.697 16.810 -18.832
No H/Q in entry = 6
In of MODEL 7
1 H PHE 0 H PHE 0 -5.318 11.952 -18.508
2 HA PHE 0 HA PHE 0 -6.668 11.493 -16.080
3 HB2 PHE 0 HB2 PHE 0 -7.007 9.211 -16.893
4 HB3 PHE 0 HB3 PHE 0 -7.346 10.396 -18.147
5 HD1 PHE 0 HD1 PHE 0 -5.598 10.814 -19.895
6 HD2 PHE 0 HD2 PHE 0 -5.461 7.531 -17.219
7 HE1 PHE 0 HE1 PHE 0 -4.035 9.659 -21.410
8 HE2 PHE 0 HE2 PHE 0 -3.892 6.359 -18.718
9 HZ PHE 0 HZ PHE 0 -3.196 7.421 -20.835
No H/Q in entry = 9
In of MODEL 7
1 H HIS 1 H HIS 1 -6.237 9.834 -14.493
2 HA HIS 1 HA HIS 1 -3.342 9.579 -13.993
3 HB2 HIS 1 HB2 HIS 1 -5.598 9.721 -11.978
4 HB3 HIS 1 HB3 HIS 1 -3.884 9.588 -11.597
5 HD1 HIS 1 HD1 HIS 1 -6.515 12.025 -12.172
6 HD2 HIS 1 HD2 HIS 1 -2.370 11.962 -12.455
7 HE1 HIS 1 HE1 HIS 1 -5.805 14.432 -12.224
8 HE2 HIS 1 HE2 HIS 1 -3.310 14.373 -12.522
No H/Q in entry = 8
In of MODEL 7
1 H HIS 2 H HIS 2 -2.644 7.633 -12.874
2 HA HIS 2 HA HIS 2 -4.301 5.353 -13.711
3 HB2 HIS 2 HB2 HIS 2 -1.328 5.450 -13.163
4 HB3 HIS 2 HB3 HIS 2 -2.222 4.030 -13.694
5 HD1 HIS 2 HD1 HIS 2 -2.946 3.939 -16.183
6 HD2 HIS 2 HD2 HIS 2 -0.788 7.343 -15.145
7 HE1 HIS 2 HE1 HIS 2 -2.289 5.021 -18.357
8 HE2 HIS 2 HE2 HIS 2 -0.925 7.037 -17.709
No H/Q in entry = 8
In of MODEL 7
1 H PHE 3 H PHE 3 -1.757 5.708 -11.243
2 HA PHE 3 HA PHE 3 -3.652 4.707 -9.241
3 HB2 PHE 3 HB2 PHE 3 -0.885 3.611 -9.777
4 HB3 PHE 3 HB3 PHE 3 -1.787 3.284 -8.302
5 HD1 PHE 3 HD1 PHE 3 -4.001 2.091 -8.482
6 HD2 PHE 3 HD2 PHE 3 -1.254 2.360 -11.722
7 HE1 PHE 3 HE1 PHE 3 -5.113 0.192 -9.580
8 HE2 PHE 3 HE2 PHE 3 -2.362 0.462 -12.825
9 HZ PHE 3 HZ PHE 3 -4.295 -0.624 -11.754
No H/Q in entry = 9
In of MODEL 7
1 H THR 4 H THR 4 -3.549 7.107 -8.924
2 HA THR 4 HA THR 4 -1.204 8.140 -7.604
3 HB THR 4 HB THR 4 -2.720 10.146 -7.234
4 HG1 THR 4 HG1 THR 4 -4.656 10.079 -8.577
5 HG21 THR 4 HG21 THR 4 -2.358 9.160 -10.068
6 HG22 THR 4 HG22 THR 4 -2.652 10.832 -9.590
7 HG23 THR 4 HG23 THR 4 -1.157 10.027 -9.112
No H/Q in entry = 7
In of MODEL 7
1 H LEU 5 H LEU 5 -1.378 9.152 -5.444
2 HA LEU 5 HA LEU 5 -2.470 7.357 -3.538
3 HB2 LEU 5 HB2 LEU 5 -1.218 10.079 -3.248
4 HB3 LEU 5 HB3 LEU 5 -1.799 9.157 -1.881
5 HG LEU 5 HG LEU 5 -0.194 7.317 -2.616
6 HD11 LEU 5 HD11 LEU 5 0.221 8.123 -4.883
7 HD12 LEU 5 HD12 LEU 5 0.971 9.581 -4.231
8 HD13 LEU 5 HD13 LEU 5 1.717 8.006 -3.956
9 HD21 LEU 5 HD21 LEU 5 0.896 9.974 -1.699
10 HD22 LEU 5 HD22 LEU 5 0.197 8.719 -0.677
11 HD23 LEU 5 HD23 LEU 5 1.710 8.419 -1.533
No H/Q in entry = 11
In of MODEL 7
1 H GLU 6 H GLU 6 -3.538 10.443 -4.871
2 HA GLU 6 HA GLU 6 -5.832 10.804 -3.281
3 HB2 GLU 6 HB2 GLU 6 -5.478 11.328 -6.250
4 HB3 GLU 6 HB3 GLU 6 -6.776 11.972 -5.253
5 HG2 GLU 6 HG2 GLU 6 -5.211 13.270 -3.970
6 HG3 GLU 6 HG3 GLU 6 -3.854 12.544 -4.830
No H/Q in entry = 6
In of MODEL 7
1 H SER 7 H SER 7 -5.337 8.814 -6.256
2 HA SER 7 HA SER 7 -7.930 7.910 -6.492
3 HB2 SER 7 HB2 SER 7 -6.095 7.563 -8.144
4 HB3 SER 7 HB3 SER 7 -5.436 6.310 -7.098
5 HG SER 7 HG SER 7 -7.518 5.238 -7.325
No H/Q in entry = 5
In of MODEL 7
1 H SER 8 H SER 8 -5.717 7.117 -3.969
2 HA SER 8 HA SER 8 -7.223 4.702 -3.346
3 HB2 SER 8 HB2 SER 8 -4.636 5.652 -2.141
4 HB3 SER 8 HB3 SER 8 -5.453 4.117 -1.802
5 HG SER 8 HG SER 8 -4.249 4.985 -4.222
No H/Q in entry = 5
In of MODEL 7
1 H LEU 9 H LEU 9 -7.208 7.974 -2.283
2 HA LEU 9 HA LEU 9 -6.912 7.647 0.449
3 HB2 LEU 9 HB2 LEU 9 -8.344 9.802 -1.053
4 HB3 LEU 9 HB3 LEU 9 -7.882 9.892 0.639
5 HG LEU 9 HG LEU 9 -5.901 9.446 -1.579
6 HD11 LEU 9 HD11 LEU 9 -7.055 11.518 -1.937
7 HD12 LEU 9 HD12 LEU 9 -6.736 12.016 -0.276
8 HD13 LEU 9 HD13 LEU 9 -5.397 11.812 -1.407
9 HD21 LEU 9 HD21 LEU 9 -5.590 10.309 1.298
10 HD22 LEU 9 HD22 LEU 9 -5.130 8.747 0.616
11 HD23 LEU 9 HD23 LEU 9 -4.284 10.217 0.116
No H/Q in entry = 11
In of MODEL 7
1 H ASP 10 H ASP 10 -9.843 7.364 -1.354
2 HA ASP 10 HA ASP 10 -11.358 6.975 1.120
3 HB2 ASP 10 HB2 ASP 10 -12.178 7.319 -1.758
4 HB3 ASP 10 HB3 ASP 10 -13.314 6.771 -0.530
No H/Q in entry = 4
In of MODEL 7
1 H THR 11 H THR 11 -9.487 5.125 -0.784
2 HA THR 11 HA THR 11 -11.182 2.775 -0.334
3 HB THR 11 HB THR 11 -10.058 1.757 -2.368
4 HG1 THR 11 HG1 THR 11 -9.574 4.438 -3.158
5 HG21 THR 11 HG21 THR 11 -12.381 2.529 -2.399
6 HG22 THR 11 HG22 THR 11 -11.839 4.157 -2.804
7 HG23 THR 11 HG23 THR 11 -11.590 2.837 -3.944
No H/Q in entry = 7
In of MODEL 7
1 H HIS 12 H HIS 12 -8.044 2.543 -1.776
2 HA HIS 12 HA HIS 12 -7.191 0.607 0.023
3 HB2 HIS 12 HB2 HIS 12 -5.190 2.244 -1.501
4 HB3 HIS 12 HB3 HIS 12 -5.165 0.526 -1.152
5 HD1 HIS 12 HD1 HIS 12 -5.214 2.373 -3.992
6 HD2 HIS 12 HD2 HIS 12 -7.932 -0.413 -2.524
7 HE1 HIS 12 HE1 HIS 12 -6.434 1.478 -6.009
8 HE2 HIS 12 HE2 HIS 12 -8.048 -0.229 -5.103
No H/Q in entry = 8
In of MODEL 7
1 H LEU 13 H LEU 13 -6.633 4.095 0.042
2 HA LEU 13 HA LEU 13 -4.842 3.708 2.351
3 HB2 LEU 13 HB2 LEU 13 -4.868 5.675 0.137
4 HB3 LEU 13 HB3 LEU 13 -4.313 6.220 1.707
5 HG LEU 13 HG LEU 13 -2.388 5.568 0.456
6 HD11 LEU 13 HD11 LEU 13 -2.511 4.874 2.856
7 HD12 LEU 13 HD12 LEU 13 -2.948 3.259 2.300
8 HD13 LEU 13 HD13 LEU 13 -1.386 3.949 1.868
9 HD21 LEU 13 HD21 LEU 13 -3.772 2.939 -0.036
10 HD22 LEU 13 HD22 LEU 13 -3.419 4.184 -1.234
11 HD23 LEU 13 HD23 LEU 13 -2.099 3.306 -0.459
No H/Q in entry = 11
In of MODEL 7
1 H LYS 14 H LYS 14 -7.747 3.801 2.363
2 HA LYS 14 HA LYS 14 -8.694 6.321 3.240
3 HB2 LYS 14 HB2 LYS 14 -10.757 5.208 3.690
4 HB3 LYS 14 HB3 LYS 14 -10.092 4.517 2.223
5 HG2 LYS 14 HG2 LYS 14 -9.214 2.631 3.614
6 HG3 LYS 14 HG3 LYS 14 -10.117 3.298 4.974
7 HD2 LYS 14 HD2 LYS 14 -11.271 2.350 2.349
8 HD3 LYS 14 HD3 LYS 14 -11.375 1.511 3.897
9 HE2 LYS 14 HE2 LYS 14 -12.564 4.210 3.265
10 HE3 LYS 14 HE3 LYS 14 -13.449 2.690 3.358
11 HZ1 LYS 14 HZ1 LYS 14 -12.841 2.520 5.692
12 HZ2 LYS 14 HZ2 LYS 14 -11.991 3.979 5.604
13 HZ3 LYS 14 HZ3 LYS 14 -13.667 3.965 5.395
No H/Q in entry = 13
In of MODEL 7
1 H TRP 15 H TRP 15 -7.053 3.796 4.858
2 HA TRP 15 HA TRP 15 -8.089 4.291 7.487
3 HB2 TRP 15 HB2 TRP 15 -6.215 2.783 8.191
4 HB3 TRP 15 HB3 TRP 15 -7.281 2.082 6.975
5 HD1 TRP 15 HD1 TRP 15 -6.307 1.791 4.510
6 HE1 TRP 15 HE1 TRP 15 -3.905 1.678 3.617
7 HE3 TRP 15 HE3 TRP 15 -3.852 3.684 8.571
8 HZ2 TRP 15 HZ2 TRP 15 -1.296 2.308 4.520
9 HZ3 TRP 15 HZ3 TRP 15 -1.403 3.895 8.478
10 HH2 TRP 15 HH2 TRP 15 -0.153 3.219 6.492
No H/Q in entry = 10
In of MODEL 7
1 H LEU 16 H LEU 16 -5.930 5.928 5.510
2 HA LEU 16 HA LEU 16 -4.165 6.939 7.544
3 HB2 LEU 16 HB2 LEU 16 -4.861 8.040 4.810
4 HB3 LEU 16 HB3 LEU 16 -3.593 8.660 5.844
5 HG LEU 16 HG LEU 16 -3.610 5.865 4.698
6 HD11 LEU 16 HD11 LEU 16 -3.485 7.532 2.921
7 HD12 LEU 16 HD12 LEU 16 -2.154 8.330 3.756
8 HD13 LEU 16 HD13 LEU 16 -1.944 6.699 3.121
9 HD21 LEU 16 HD21 LEU 16 -1.473 7.489 6.077
10 HD22 LEU 16 HD22 LEU 16 -2.256 6.035 6.696
11 HD23 LEU 16 HD23 LEU 16 -1.206 5.938 5.278
No H/Q in entry = 11
In of MODEL 7
1 H SER 17 H SER 17 -4.272 8.937 8.511
2 HA SER 17 HA SER 17 -6.955 9.975 8.874
3 HB2 SER 17 HB2 SER 17 -5.168 9.622 10.717
4 HB3 SER 17 HB3 SER 17 -4.471 11.126 10.122
5 HG SER 17 HG SER 17 -6.514 10.798 11.782
No H/Q in entry = 5
In of MODEL 7
1 H GLN 18 H GLN 18 -7.336 12.397 8.727
2 HA GLN 18 HA GLN 18 -6.795 13.273 6.148
3 HB2 GLN 18 HB2 GLN 18 -7.648 14.782 8.613
4 HB3 GLN 18 HB3 GLN 18 -7.420 15.597 7.076
5 HG2 GLN 18 HG2 GLN 18 -9.326 13.325 7.575
6 HG3 GLN 18 HG3 GLN 18 -9.760 15.031 7.509
7 HE21 GLN 18 HE21 GLN 18 -8.873 12.232 5.694
8 HE22 GLN 18 HE22 GLN 18 -9.190 12.888 4.124
No H/Q in entry = 8
In of MODEL 7
1 H GLU 19 H GLU 19 -5.174 14.235 9.160
2 HA GLU 19 HA GLU 19 -3.391 16.038 8.042
3 HB2 GLU 19 HB2 GLU 19 -3.405 14.322 10.495
4 HB3 GLU 19 HB3 GLU 19 -1.988 15.256 10.090
5 HG2 GLU 19 HG2 GLU 19 -4.733 16.411 10.427
6 HG3 GLU 19 HG3 GLU 19 -3.501 16.381 11.687
No H/Q in entry = 6
In of MODEL 7
1 H GLN 20 H GLN 20 -3.237 12.520 8.262
2 HA GLN 20 HA GLN 20 -0.549 12.354 7.308
3 HB2 GLN 20 HB2 GLN 20 -2.726 10.248 7.341
4 HB3 GLN 20 HB3 GLN 20 -1.020 9.944 7.039
5 HG2 GLN 20 HG2 GLN 20 -0.457 10.638 9.276
6 HG3 GLN 20 HG3 GLN 20 -2.132 11.084 9.592
7 HE21 GLN 20 HE21 GLN 20 -0.408 9.176 10.965
8 HE22 GLN 20 HE22 GLN 20 -1.232 7.656 10.896
No H/Q in entry = 8
In of MODEL 7
1 H LYS 21 H LYS 21 -3.758 12.018 5.814
2 HA LYS 21 HA LYS 21 -2.888 11.409 3.214
3 HB2 LYS 21 HB2 LYS 21 -5.358 12.888 4.138
4 HB3 LYS 21 HB3 LYS 21 -5.103 12.314 2.496
5 HG2 LYS 21 HG2 LYS 21 -5.042 10.020 3.283
6 HG3 LYS 21 HG3 LYS 21 -5.219 10.571 4.949
7 HD2 LYS 21 HD2 LYS 21 -7.409 11.482 4.450
8 HD3 LYS 21 HD3 LYS 21 -7.227 11.046 2.748
9 HE2 LYS 21 HE2 LYS 21 -7.214 8.706 3.296
10 HE3 LYS 21 HE3 LYS 21 -7.209 9.067 5.023
11 HZ1 LYS 21 HZ1 LYS 21 -9.399 9.717 3.127
12 HZ2 LYS 21 HZ2 LYS 21 -9.410 8.457 4.254
13 HZ3 LYS 21 HZ3 LYS 21 -9.397 10.061 4.783
No H/Q in entry = 13
In of MODEL 7
1 H ASP 22 H ASP 22 -3.683 14.500 4.718
2 HA ASP 22 HA ASP 22 -3.008 16.166 2.546
3 HB2 ASP 22 HB2 ASP 22 -4.367 16.850 4.514
4 HB3 ASP 22 HB3 ASP 22 -2.919 16.781 5.508
No H/Q in entry = 4
In of MODEL 7
1 H GLU 23 H GLU 23 -1.055 14.848 5.227
2 HA GLU 23 HA GLU 23 1.354 16.135 4.632
3 HB2 GLU 23 HB2 GLU 23 0.504 14.114 6.356
4 HB3 GLU 23 HB3 GLU 23 1.723 13.349 5.338
5 HG2 GLU 23 HG2 GLU 23 3.291 15.090 5.864
6 HG3 GLU 23 HG3 GLU 23 2.069 15.917 6.825
No H/Q in entry = 6
In of MODEL 7
1 H LEU 24 H LEU 24 0.197 12.973 3.420
2 HA LEU 24 HA LEU 24 2.382 12.590 1.699
3 HB2 LEU 24 HB2 LEU 24 -0.301 11.368 2.110
4 HB3 LEU 24 HB3 LEU 24 0.589 10.961 0.657
5 HG LEU 24 HG LEU 24 2.386 10.050 1.935
6 HD11 LEU 24 HD11 LEU 24 2.247 11.703 3.804
7 HD12 LEU 24 HD12 LEU 24 0.983 10.679 4.490
8 HD13 LEU 24 HD13 LEU 24 2.613 10.037 4.249
9 HD21 LEU 24 HD21 LEU 24 -0.260 9.119 2.994
10 HD22 LEU 24 HD22 LEU 24 0.531 8.567 1.520
11 HD23 LEU 24 HD23 LEU 24 1.249 8.212 3.089
No H/Q in entry = 11
In of MODEL 7
1 H LEU 25 H LEU 25 -0.846 13.980 1.191
2 HA LEU 25 HA LEU 25 -0.661 14.313 -1.593
3 HB2 LEU 25 HB2 LEU 25 -2.152 15.884 0.501
4 HB3 LEU 25 HB3 LEU 25 -2.306 16.195 -1.214
5 HG LEU 25 HG LEU 25 -3.032 13.623 0.182
6 HD11 LEU 25 HD11 LEU 25 -4.747 15.765 -1.065
7 HD12 LEU 25 HD12 LEU 25 -5.326 14.225 -0.429
8 HD13 LEU 25 HD13 LEU 25 -4.601 15.411 0.656
9 HD21 LEU 25 HD21 LEU 25 -3.227 14.425 -2.716
10 HD22 LEU 25 HD22 LEU 25 -2.223 13.146 -2.035
11 HD23 LEU 25 HD23 LEU 25 -3.978 12.995 -2.016
No H/Q in entry = 11
In of MODEL 7
1 H LYS 26 H LYS 26 0.379 16.339 1.088
2 HA LYS 26 HA LYS 26 1.273 18.541 -0.477
3 HB2 LYS 26 HB2 LYS 26 0.873 18.345 2.103
4 HB3 LYS 26 HB3 LYS 26 2.543 17.796 2.129
5 HG2 LYS 26 HG2 LYS 26 3.046 19.935 0.794
6 HG3 LYS 26 HG3 LYS 26 1.454 20.467 1.334
7 HD2 LYS 26 HD2 LYS 26 2.973 21.316 2.921
8 HD3 LYS 26 HD3 LYS 26 2.237 19.906 3.686
9 HE2 LYS 26 HE2 LYS 26 4.592 19.832 4.099
10 HE3 LYS 26 HE3 LYS 26 4.195 18.563 2.942
11 HZ1 LYS 26 HZ1 LYS 26 4.895 20.146 1.159
12 HZ2 LYS 26 HZ2 LYS 26 5.465 21.179 2.371
13 HZ3 LYS 26 HZ3 LYS 26 6.146 19.643 2.184
No H/Q in entry = 13
In of MODEL 7
1 H MET 27 H MET 27 2.885 15.687 0.852
2 HA MET 27 HA MET 27 5.406 16.151 -0.108
3 HB2 MET 27 HB2 MET 27 3.944 13.525 0.173
4 HB3 MET 27 HB3 MET 27 5.670 13.654 -0.130
5 HG2 MET 27 HG2 MET 27 5.967 14.839 1.969
6 HG3 MET 27 HG3 MET 27 4.232 14.755 2.270
7 HE1 MET 27 HE1 MET 27 7.546 12.701 1.864
8 HE2 MET 27 HE2 MET 27 6.973 11.051 2.100
9 HE3 MET 27 HE3 MET 27 6.481 11.960 0.670
No H/Q in entry = 9
In of MODEL 7
1 H LYS 28 H LYS 28 2.848 14.286 -1.796
2 HA LYS 28 HA LYS 28 4.268 13.872 -4.177
3 HB2 LYS 28 HB2 LYS 28 2.160 12.722 -3.515
4 HB3 LYS 28 HB3 LYS 28 1.285 14.210 -3.845
5 HG2 LYS 28 HG2 LYS 28 1.060 12.682 -5.699
6 HG3 LYS 28 HG3 LYS 28 1.996 14.093 -6.193
7 HD2 LYS 28 HD2 LYS 28 4.058 12.846 -5.979
8 HD3 LYS 28 HD3 LYS 28 3.184 11.447 -5.353
9 HE2 LYS 28 HE2 LYS 28 3.716 11.093 -7.681
10 HE3 LYS 28 HE3 LYS 28 1.975 11.285 -7.495
11 HZ1 LYS 28 HZ1 LYS 28 2.247 13.623 -8.190
12 HZ2 LYS 28 HZ2 LYS 28 3.888 13.329 -8.485
13 HZ3 LYS 28 HZ3 LYS 28 2.707 12.522 -9.386
No H/Q in entry = 13
In of MODEL 7
1 H LYS 29 H LYS 29 2.162 16.502 -3.141
2 HA LYS 29 HA LYS 29 2.091 17.981 -5.498
3 HB2 LYS 29 HB2 LYS 29 0.656 18.416 -3.547
4 HB3 LYS 29 HB3 LYS 29 2.051 18.993 -2.651
5 HG2 LYS 29 HG2 LYS 29 2.325 20.775 -4.377
6 HG3 LYS 29 HG3 LYS 29 0.789 20.253 -5.072
7 HD2 LYS 29 HD2 LYS 29 1.217 21.261 -2.260
8 HD3 LYS 29 HD3 LYS 29 0.479 22.163 -3.584
9 HE2 LYS 29 HE2 LYS 29 -1.301 20.461 -3.707
10 HE3 LYS 29 HE3 LYS 29 -0.578 19.632 -2.329
11 HZ1 LYS 29 HZ1 LYS 29 -1.622 22.411 -2.298
12 HZ2 LYS 29 HZ2 LYS 29 -2.425 21.061 -1.678
13 HZ3 LYS 29 HZ3 LYS 29 -0.979 21.579 -0.976
No H/Q in entry = 13
In of MODEL 7
1 H ASP 30 H ASP 30 4.376 18.203 -2.775
2 HA ASP 30 HA ASP 30 5.768 20.388 -4.032
3 HB2 ASP 30 HB2 ASP 30 6.210 18.879 -1.462
4 HB3 ASP 30 HB3 ASP 30 7.350 20.093 -2.033
No H/Q in entry = 4
In of MODEL 7
1 H GLY 31 H GLY 31 5.826 17.215 -4.658
2 HA2 GLY 31 HA2 GLY 31 8.334 17.606 -6.081
3 HA3 GLY 31 HA3 GLY 31 7.113 16.397 -6.436
No H/Q in entry = 3
In of MODEL 7
1 H LYS 32 H LYS 32 7.099 15.717 -3.466
2 HA LYS 32 HA LYS 32 9.583 14.428 -2.994
3 HB2 LYS 32 HB2 LYS 32 6.807 13.866 -1.926
4 HB3 LYS 32 HB3 LYS 32 8.266 13.075 -1.347
5 HG2 LYS 32 HG2 LYS 32 7.933 16.058 -1.302
6 HG3 LYS 32 HG3 LYS 32 7.393 15.024 0.018
7 HD2 LYS 32 HD2 LYS 32 10.208 14.956 -1.034
8 HD3 LYS 32 HD3 LYS 32 9.701 16.059 0.246
9 HE2 LYS 32 HE2 LYS 32 9.014 14.182 1.621
10 HE3 LYS 32 HE3 LYS 32 9.434 13.056 0.332
11 HZ1 LYS 32 HZ1 LYS 32 11.393 14.872 1.618
12 HZ2 LYS 32 HZ2 LYS 32 11.127 13.281 2.117
13 HZ3 LYS 32 HZ3 LYS 32 11.717 13.588 0.563
No H/Q in entry = 13
In of MODEL 7
1 H ALA 33 H ALA 33 10.165 12.353 -3.415
2 HA ALA 33 HA ALA 33 9.134 11.252 -5.864
3 HB1 ALA 33 HB1 ALA 33 11.540 11.234 -5.318
4 HB2 ALA 33 HB2 ALA 33 10.916 9.620 -5.666
5 HB3 ALA 33 HB3 ALA 33 11.207 10.109 -3.996
No H/Q in entry = 5
In of MODEL 7
1 H LYS 34 H LYS 34 8.214 9.122 -6.144
2 HA LYS 34 HA LYS 34 6.226 8.430 -4.336
3 HB2 LYS 34 HB2 LYS 34 7.578 6.776 -6.451
4 HB3 LYS 34 HB3 LYS 34 6.246 6.163 -5.480
5 HG2 LYS 34 HG2 LYS 34 5.129 8.438 -6.295
6 HG3 LYS 34 HG3 LYS 34 6.251 8.190 -7.636
7 HD2 LYS 34 HD2 LYS 34 4.303 6.110 -6.646
8 HD3 LYS 34 HD3 LYS 34 3.981 7.205 -7.989
9 HE2 LYS 34 HE2 LYS 34 5.792 6.274 -9.257
10 HE3 LYS 34 HE3 LYS 34 6.318 5.306 -7.880
11 HZ1 LYS 34 HZ1 LYS 34 3.618 4.984 -9.025
12 HZ2 LYS 34 HZ2 LYS 34 4.942 4.172 -9.681
13 HZ3 LYS 34 HZ3 LYS 34 4.499 3.893 -8.070
No H/Q in entry = 13
In of MODEL 7
1 H LYS 35 H LYS 35 9.556 7.287 -4.495
2 HA LYS 35 HA LYS 35 9.336 5.202 -2.629
3 HB2 LYS 35 HB2 LYS 35 11.604 6.854 -3.647
4 HB3 LYS 35 HB3 LYS 35 11.866 5.840 -2.234
5 HG2 LYS 35 HG2 LYS 35 12.556 4.572 -4.089
6 HG3 LYS 35 HG3 LYS 35 11.000 3.909 -3.597
7 HD2 LYS 35 HD2 LYS 35 10.928 4.029 -5.949
8 HD3 LYS 35 HD3 LYS 35 9.968 5.394 -5.378
9 HE2 LYS 35 HE2 LYS 35 11.826 6.899 -5.762
10 HE3 LYS 35 HE3 LYS 35 12.857 5.549 -6.233
11 HZ1 LYS 35 HZ1 LYS 35 11.391 5.150 -8.120
12 HZ2 LYS 35 HZ2 LYS 35 10.422 6.459 -7.669
13 HZ3 LYS 35 HZ3 LYS 35 12.020 6.721 -8.159
No H/Q in entry = 13
In of MODEL 7
1 H GLU 36 H GLU 36 9.196 8.602 -2.151
2 HA GLU 36 HA GLU 36 10.008 8.428 0.635
3 HB2 GLU 36 HB2 GLU 36 8.985 10.833 -0.879
4 HB3 GLU 36 HB3 GLU 36 9.830 10.828 0.666
5 HG2 GLU 36 HG2 GLU 36 11.803 9.854 -0.494
6 HG3 GLU 36 HG3 GLU 36 10.945 10.061 -2.008
No H/Q in entry = 6
In of MODEL 7
1 H LEU 37 H LEU 37 7.187 8.681 -1.362
2 HA LEU 37 HA LEU 37 5.307 8.904 0.754
3 HB2 LEU 37 HB2 LEU 37 5.126 7.964 -2.100
4 HB3 LEU 37 HB3 LEU 37 3.736 8.029 -1.038
5 HG LEU 37 HG LEU 37 3.833 9.946 -2.507
6 HD11 LEU 37 HD11 LEU 37 2.814 10.205 -0.316
7 HD12 LEU 37 HD12 LEU 37 4.377 10.676 0.352
8 HD13 LEU 37 HD13 LEU 37 3.580 11.704 -0.838
9 HD21 LEU 37 HD21 LEU 37 6.424 10.636 -1.179
10 HD22 LEU 37 HD22 LEU 37 6.203 10.163 -2.863
11 HD23 LEU 37 HD23 LEU 37 5.523 11.681 -2.277
No H/Q in entry = 11
In of MODEL 7
1 H GLU 38 H GLU 38 6.669 6.255 -1.093
2 HA GLU 38 HA GLU 38 5.421 4.032 -0.043
3 HB2 GLU 38 HB2 GLU 38 6.930 3.687 -1.802
4 HB3 GLU 38 HB3 GLU 38 8.201 4.610 -1.019
5 HG2 GLU 38 HG2 GLU 38 9.013 2.508 -0.768
6 HG3 GLU 38 HG3 GLU 38 8.102 2.667 0.731
No H/Q in entry = 6
In of MODEL 7
1 H ALA 39 H ALA 39 7.642 6.197 1.434
2 HA ALA 39 HA ALA 39 8.406 4.334 3.523
3 HB1 ALA 39 HB1 ALA 39 9.264 7.188 3.079
4 HB2 ALA 39 HB2 ALA 39 9.978 6.032 4.203
5 HB3 ALA 39 HB3 ALA 39 10.096 5.758 2.465
No H/Q in entry = 5
In of MODEL 7
1 H LYS 40 H LYS 40 6.570 7.379 3.262
2 HA LYS 40 HA LYS 40 5.992 7.628 5.984
3 HB2 LYS 40 HB2 LYS 40 4.499 8.448 3.499
4 HB3 LYS 40 HB3 LYS 40 3.934 8.828 5.114
5 HG2 LYS 40 HG2 LYS 40 6.551 9.691 3.932
6 HG3 LYS 40 HG3 LYS 40 5.117 10.699 4.111
7 HD2 LYS 40 HD2 LYS 40 5.234 10.330 6.565
8 HD3 LYS 40 HD3 LYS 40 6.750 9.457 6.321
9 HE2 LYS 40 HE2 LYS 40 7.718 11.481 5.302
10 HE3 LYS 40 HE3 LYS 40 6.213 12.343 5.629
11 HZ1 LYS 40 HZ1 LYS 40 6.550 11.956 7.990
12 HZ2 LYS 40 HZ2 LYS 40 8.000 11.144 7.674
13 HZ3 LYS 40 HZ3 LYS 40 7.859 12.791 7.326
No H/Q in entry = 13
In of MODEL 7
1 H ILE 41 H ILE 41 4.137 6.070 3.351
2 HA ILE 41 HA ILE 41 1.995 5.249 4.943
3 HB ILE 41 HB ILE 41 3.050 4.051 2.385
4 HG12 ILE 41 HG12 ILE 41 0.842 6.056 2.876
5 HG13 ILE 41 HG13 ILE 41 2.457 6.460 2.305
6 HG21 ILE 41 HG21 ILE 41 0.362 3.740 3.714
7 HG22 ILE 41 HG22 ILE 41 0.791 3.135 2.115
8 HG23 ILE 41 HG23 ILE 41 1.591 2.489 3.546
9 HD11 ILE 41 HD11 ILE 41 2.065 5.100 0.313
10 HD12 ILE 41 HD12 ILE 41 0.426 4.775 0.883
11 HD13 ILE 41 HD13 ILE 41 0.908 6.422 0.477
No H/Q in entry = 11
In of MODEL 7
1 H LEU 42 H LEU 42 4.905 3.502 3.920
2 HA LEU 42 HA LEU 42 4.288 1.106 5.255
3 HB2 LEU 42 HB2 LEU 42 6.801 2.327 4.199
4 HB3 LEU 42 HB3 LEU 42 6.882 0.854 5.133
5 HG LEU 42 HG LEU 42 5.532 1.295 2.478
6 HD11 LEU 42 HD11 LEU 42 7.707 -0.566 3.398
7 HD12 LEU 42 HD12 LEU 42 7.002 -0.544 1.781
8 HD13 LEU 42 HD13 LEU 42 7.897 0.857 2.375
9 HD21 LEU 42 HD21 LEU 42 5.236 -1.011 4.385
10 HD22 LEU 42 HD22 LEU 42 3.964 -0.028 3.651
11 HD23 LEU 42 HD23 LEU 42 4.908 -1.144 2.657
No H/Q in entry = 11
In of MODEL 7
1 H HIS 43 H HIS 43 5.943 4.031 6.303
2 HA HIS 43 HA HIS 43 6.708 3.091 8.860
3 HB2 HIS 43 HB2 HIS 43 7.482 5.234 7.762
4 HB3 HIS 43 HB3 HIS 43 5.919 5.928 8.174
5 HD1 HIS 43 HD1 HIS 43 9.234 5.126 9.571
6 HD2 HIS 43 HD2 HIS 43 5.511 6.302 10.996
7 HE1 HIS 43 HE1 HIS 43 9.625 5.880 11.934
8 HE2 HIS 43 HE2 HIS 43 7.391 6.738 12.721
No H/Q in entry = 8
In of MODEL 7
1 H TYR 44 H TYR 44 3.806 4.889 7.770
2 HA TYR 44 HA TYR 44 2.464 4.998 10.223
3 HB2 TYR 44 HB2 TYR 44 1.237 4.728 7.464
4 HB3 TYR 44 HB3 TYR 44 0.397 5.275 8.910
5 HD1 TYR 44 HD1 TYR 44 2.550 7.050 10.042
6 HD2 TYR 44 HD2 TYR 44 1.061 6.591 6.090
7 HE1 TYR 44 HE1 TYR 44 3.185 9.377 9.547
8 HE2 TYR 44 HE2 TYR 44 1.688 8.887 5.576
9 HH TYR 44 HH TYR 44 3.666 10.783 7.679
No H/Q in entry = 9
In of MODEL 7
1 H TYR 45 H TYR 45 2.423 2.618 7.657
2 HA TYR 45 HA TYR 45 0.475 0.876 8.557
3 HB2 TYR 45 HB2 TYR 45 1.395 0.826 6.311
4 HB3 TYR 45 HB3 TYR 45 2.978 0.394 6.937
5 HD1 TYR 45 HD1 TYR 45 -0.510 -0.854 7.153
6 HD2 TYR 45 HD2 TYR 45 3.602 -1.782 6.683
7 HE1 TYR 45 HE1 TYR 45 -1.087 -3.222 6.918
8 HE2 TYR 45 HE2 TYR 45 3.050 -4.163 6.434
9 HH TYR 45 HH TYR 45 -0.189 -5.257 6.003
No H/Q in entry = 9
In of MODEL 7
1 H ASP 46 H ASP 46 3.949 0.945 9.275
2 HA ASP 46 HA ASP 46 3.819 -1.546 10.690
3 HB2 ASP 46 HB2 ASP 46 5.858 -0.760 9.455
4 HB3 ASP 46 HB3 ASP 46 6.065 0.489 10.676
No H/Q in entry = 4
In of MODEL 7
1 H GLU 47 H GLU 47 3.207 1.711 11.541
2 HA GLU 47 HA GLU 47 3.668 1.295 14.372
3 HB2 GLU 47 HB2 GLU 47 2.314 3.567 12.904
4 HB3 GLU 47 HB3 GLU 47 2.715 3.556 14.611
5 HG2 GLU 47 HG2 GLU 47 4.689 3.441 12.346
6 HG3 GLU 47 HG3 GLU 47 4.301 4.863 13.308
No H/Q in entry = 6
In of MODEL 7
1 H LEU 48 H LEU 48 1.336 0.375 12.194
2 HA LEU 48 HA LEU 48 -0.981 0.840 13.789
3 HB2 LEU 48 HB2 LEU 48 -0.495 -0.701 11.264
4 HB3 LEU 48 HB3 LEU 48 -2.047 -0.684 12.074
5 HG LEU 48 HG LEU 48 -0.638 1.735 10.945
6 HD11 LEU 48 HD11 LEU 48 -3.011 0.140 10.030
7 HD12 LEU 48 HD12 LEU 48 -2.453 1.646 9.303
8 HD13 LEU 48 HD13 LEU 48 -1.434 0.209 9.244
9 HD21 LEU 48 HD21 LEU 48 -3.378 1.397 12.161
10 HD22 LEU 48 HD22 LEU 48 -2.029 2.289 12.873
11 HD23 LEU 48 HD23 LEU 48 -2.774 2.855 11.376
No H/Q in entry = 11
In of MODEL 7
1 H GLU 49 H GLU 49 -2.228 -0.653 14.667
2 HA GLU 49 HA GLU 49 -1.198 -3.357 15.131
3 HB2 GLU 49 HB2 GLU 49 -1.697 -3.063 17.567
4 HB3 GLU 49 HB3 GLU 49 -0.346 -2.099 16.981
5 HG2 GLU 49 HG2 GLU 49 -1.796 -0.151 16.818
6 HG3 GLU 49 HG3 GLU 49 -3.153 -1.113 17.401
No H/Q in entry = 6
In of MODEL 7
1 H GLY 50 H GLY 50 -2.820 -4.700 16.358
2 HA2 GLY 50 HA2 GLY 50 -5.442 -3.920 16.852
3 HA3 GLY 50 HA3 GLY 50 -4.903 -5.577 16.662
No H/Q in entry = 3
In of MODEL 7
1 H ASP 51 H ASP 51 -7.349 -4.127 15.840
2 HA ASP 51 HA ASP 51 -7.754 -5.405 13.347
3 HB2 ASP 51 HB2 ASP 51 -9.634 -5.072 14.815
4 HB3 ASP 51 HB3 ASP 51 -9.373 -3.333 14.846
No H/Q in entry = 4
In of MODEL 7
1 H ALA 52 H ALA 52 -6.723 -2.177 14.248
2 HA ALA 52 HA ALA 52 -7.334 -0.871 11.825
3 HB1 ALA 52 HB1 ALA 52 -5.019 -0.295 13.668
4 HB2 ALA 52 HB2 ALA 52 -5.689 0.783 12.443
5 HB3 ALA 52 HB3 ALA 52 -6.657 0.337 13.848
No H/Q in entry = 5
In of MODEL 7
1 H LYS 53 H LYS 53 -4.428 -2.522 12.939
2 HA LYS 53 HA LYS 53 -2.865 -2.330 10.644
3 HB2 LYS 53 HB2 LYS 53 -2.109 -3.205 12.850
4 HB3 LYS 53 HB3 LYS 53 -3.024 -4.675 12.539
5 HG2 LYS 53 HG2 LYS 53 -0.757 -5.110 12.019
6 HG3 LYS 53 HG3 LYS 53 -1.630 -5.014 10.496
7 HD2 LYS 53 HD2 LYS 53 -0.827 -2.762 10.138
8 HD3 LYS 53 HD3 LYS 53 -0.042 -2.762 11.718
9 HE2 LYS 53 HE2 LYS 53 0.655 -4.483 9.344
10 HE3 LYS 53 HE3 LYS 53 1.603 -3.153 10.001
11 HZ1 LYS 53 HZ1 LYS 53 1.860 -4.433 12.055
12 HZ2 LYS 53 HZ2 LYS 53 1.012 -5.721 11.367
13 HZ3 LYS 53 HZ3 LYS 53 2.502 -5.249 10.722
No H/Q in entry = 13
In of MODEL 7
1 H LYS 54 H LYS 54 -4.981 -4.982 11.668
2 HA LYS 54 HA LYS 54 -4.804 -6.619 9.466
3 HB2 LYS 54 HB2 LYS 54 -7.266 -6.072 11.122
4 HB3 LYS 54 HB3 LYS 54 -7.033 -7.458 10.067
5 HG2 LYS 54 HG2 LYS 54 -5.048 -8.055 11.472
6 HG3 LYS 54 HG3 LYS 54 -5.565 -6.806 12.601
7 HD2 LYS 54 HD2 LYS 54 -7.706 -7.922 12.873
8 HD3 LYS 54 HD3 LYS 54 -7.226 -9.151 11.704
9 HE2 LYS 54 HE2 LYS 54 -5.871 -8.612 14.344
10 HE3 LYS 54 HE3 LYS 54 -6.987 -9.936 14.018
11 HZ1 LYS 54 HZ1 LYS 54 -5.429 -10.755 12.339
12 HZ2 LYS 54 HZ2 LYS 54 -4.348 -9.518 12.730
13 HZ3 LYS 54 HZ3 LYS 54 -4.725 -10.700 13.875
No H/Q in entry = 13
In of MODEL 7
1 H GLU 55 H GLU 55 -7.125 -3.959 9.990
2 HA GLU 55 HA GLU 55 -8.400 -4.205 7.517
3 HB2 GLU 55 HB2 GLU 55 -8.200 -2.129 9.671
4 HB3 GLU 55 HB3 GLU 55 -8.859 -1.637 8.114
5 HG2 GLU 55 HG2 GLU 55 -9.898 -3.983 9.665
6 HG3 GLU 55 HG3 GLU 55 -10.526 -2.347 9.833
No H/Q in entry = 6
In of MODEL 7
1 H ALA 56 H ALA 56 -5.778 -2.014 8.557
2 HA ALA 56 HA ALA 56 -5.638 -0.702 6.115
3 HB1 ALA 56 HB1 ALA 56 -3.416 0.064 6.796
4 HB2 ALA 56 HB2 ALA 56 -3.354 -1.182 8.041
5 HB3 ALA 56 HB3 ALA 56 -4.528 0.128 8.165
No H/Q in entry = 5
In of MODEL 7
1 H THR 57 H THR 57 -3.695 -3.427 7.320
2 HA THR 57 HA THR 57 -2.129 -3.979 5.156
3 HB THR 57 HB THR 57 -3.571 -5.986 6.902
4 HG1 THR 57 HG1 THR 57 -0.869 -5.213 7.162
5 HG21 THR 57 HG21 THR 57 -1.149 -6.305 5.128
6 HG22 THR 57 HG22 THR 57 -1.735 -7.512 6.276
7 HG23 THR 57 HG23 THR 57 -2.730 -7.049 4.895
No H/Q in entry = 7
In of MODEL 7
1 H GLU 58 H GLU 58 -5.470 -5.030 5.676
2 HA GLU 58 HA GLU 58 -5.699 -6.487 3.235
3 HB2 GLU 58 HB2 GLU 58 -7.779 -5.357 5.096
4 HB3 GLU 58 HB3 GLU 58 -8.168 -6.327 3.679
5 HG2 GLU 58 HG2 GLU 58 -6.601 -8.078 4.699
6 HG3 GLU 58 HG3 GLU 58 -6.748 -7.141 6.183
No H/Q in entry = 6
In of MODEL 7
1 H HIS 59 H HIS 59 -6.018 -3.103 4.000
2 HA HIS 59 HA HIS 59 -7.452 -2.513 1.566
3 HB2 HIS 59 HB2 HIS 59 -6.173 -0.740 3.644
4 HB3 HIS 59 HB3 HIS 59 -6.904 -0.105 2.175
5 HD1 HIS 59 HD1 HIS 59 -9.529 -1.367 1.934
6 HD2 HIS 59 HD2 HIS 59 -7.923 -0.450 5.657
7 HE1 HIS 59 HE1 HIS 59 -11.485 -1.284 3.510
8 HE2 HIS 59 HE2 HIS 59 -10.463 -0.936 5.791
No H/Q in entry = 8
In of MODEL 7
1 H LEU 60 H LEU 60 -4.119 -2.052 2.774
2 HA LEU 60 HA LEU 60 -2.977 -1.274 0.396
3 HB2 LEU 60 HB2 LEU 60 -1.935 -2.855 2.716
4 HB3 LEU 60 HB3 LEU 60 -0.934 -2.536 1.306
5 HG LEU 60 HG LEU 60 -1.381 -0.124 1.648
6 HD11 LEU 60 HD11 LEU 60 -3.384 -0.297 2.933
7 HD12 LEU 60 HD12 LEU 60 -2.466 -0.970 4.282
8 HD13 LEU 60 HD13 LEU 60 -2.164 0.686 3.749
9 HD21 LEU 60 HD21 LEU 60 0.725 -1.117 2.344
10 HD22 LEU 60 HD22 LEU 60 0.229 0.143 3.476
11 HD23 LEU 60 HD23 LEU 60 0.007 -1.556 3.894
No H/Q in entry = 11
In of MODEL 7
1 H LYS 61 H LYS 61 -3.783 -4.548 1.569
2 HA LYS 61 HA LYS 61 -2.730 -6.030 -0.522
3 HB2 LYS 61 HB2 LYS 61 -5.190 -6.433 1.161
4 HB3 LYS 61 HB3 LYS 61 -4.759 -7.567 -0.108
5 HG2 LYS 61 HG2 LYS 61 -2.603 -7.964 0.995
6 HG3 LYS 61 HG3 LYS 61 -3.072 -6.850 2.282
7 HD2 LYS 61 HD2 LYS 61 -4.966 -8.288 2.844
8 HD3 LYS 61 HD3 LYS 61 -4.525 -9.392 1.542
9 HE2 LYS 61 HE2 LYS 61 -2.418 -9.880 2.639
10 HE3 LYS 61 HE3 LYS 61 -2.786 -8.720 3.912
11 HZ1 LYS 61 HZ1 LYS 61 -4.712 -10.088 4.508
12 HZ2 LYS 61 HZ2 LYS 61 -4.273 -11.223 3.335
13 HZ3 LYS 61 HZ3 LYS 61 -3.258 -10.940 4.658
No H/Q in entry = 13
In of MODEL 7
1 H GLY 62 H GLY 62 -6.133 -4.944 -0.280
2 HA2 GLY 62 HA2 GLY 62 -7.563 -4.155 -1.898
3 HA3 GLY 62 HA3 GLY 62 -6.909 -5.456 -2.881
No H/Q in entry = 3
In of MODEL 7
1 H GLY 63 H GLY 63 -5.343 -2.522 -1.628
2 HA2 GLY 63 HA2 GLY 63 -4.023 -0.976 -2.678
3 HA3 GLY 63 HA3 GLY 63 -5.231 -1.025 -3.954
No H/Q in entry = 3
In of MODEL 7
1 H CYS 64 H CYS 64 -2.721 -3.256 -2.774
2 HA CYS 64 HA CYS 64 -1.158 -3.003 -5.137
3 HB2 CYS 64 HB2 CYS 64 -0.106 -3.615 -3.044
4 HB3 CYS 64 HB3 CYS 64 -1.102 -5.062 -2.926
No H/Q in entry = 4
In of MODEL 7
1 H ARG 65 H ARG 65 -3.745 -5.109 -4.142
2 HA ARG 65 HA ARG 65 -3.391 -7.055 -6.191
3 HB2 ARG 65 HB2 ARG 65 -4.643 -7.544 -4.153
4 HB3 ARG 65 HB3 ARG 65 -5.829 -6.317 -4.564
5 HG2 ARG 65 HG2 ARG 65 -6.580 -7.599 -6.452
6 HG3 ARG 65 HG3 ARG 65 -5.293 -8.784 -6.207
7 HD2 ARG 65 HD2 ARG 65 -7.508 -9.510 -5.346
8 HD3 ARG 65 HD3 ARG 65 -6.241 -9.475 -4.122
9 HE ARG 65 HE ARG 65 -8.058 -7.184 -4.374
10 HH11 ARG 65 HH11 ARG 65 -6.944 -9.962 -2.559
11 HH12 ARG 65 HH12 ARG 65 -7.684 -9.459 -1.076
12 HH21 ARG 65 HH21 ARG 65 -9.047 -6.514 -2.424
13 HH22 ARG 65 HH22 ARG 65 -8.886 -7.491 -0.999
No H/Q in entry = 13
In of MODEL 7
1 H GLU 66 H GLU 66 -4.975 -3.962 -5.992
2 HA GLU 66 HA GLU 66 -6.345 -4.178 -8.491
3 HB2 GLU 66 HB2 GLU 66 -6.879 -2.568 -6.589
4 HB3 GLU 66 HB3 GLU 66 -5.480 -1.637 -7.104
5 HG2 GLU 66 HG2 GLU 66 -6.486 -1.279 -9.275
6 HG3 GLU 66 HG3 GLU 66 -7.871 -2.265 -8.810
No H/Q in entry = 6
In of MODEL 7
1 H ILE 67 H ILE 67 -3.211 -3.077 -7.383
2 HA ILE 67 HA ILE 67 -2.293 -2.148 -9.911
3 HB ILE 67 HB ILE 67 -0.801 -3.032 -7.443
4 HG12 ILE 67 HG12 ILE 67 -1.279 -0.308 -8.668
5 HG13 ILE 67 HG13 ILE 67 -2.144 -0.965 -7.281
6 HG21 ILE 67 HG21 ILE 67 0.322 -1.800 -9.959
7 HG22 ILE 67 HG22 ILE 67 1.213 -2.059 -8.460
8 HG23 ILE 67 HG23 ILE 67 0.619 -3.441 -9.385
9 HD11 ILE 67 HD11 ILE 67 0.799 -0.366 -7.404
10 HD12 ILE 67 HD12 ILE 67 -0.431 0.607 -6.599
11 HD13 ILE 67 HD13 ILE 67 -0.067 -1.017 -6.012
No H/Q in entry = 11
In of MODEL 7
1 H LEU 68 H LEU 68 -1.975 -5.217 -8.149
2 HA LEU 68 HA LEU 68 -0.525 -6.606 -10.116
3 HB2 LEU 68 HB2 LEU 68 -0.963 -7.338 -7.737
4 HB3 LEU 68 HB3 LEU 68 -2.568 -7.809 -8.258
5 HG LEU 68 HG LEU 68 -1.603 -9.431 -9.819
6 HD11 LEU 68 HD11 LEU 68 0.473 -8.251 -10.316
7 HD12 LEU 68 HD12 LEU 68 1.045 -8.549 -8.673
8 HD13 LEU 68 HD13 LEU 68 0.795 -9.901 -9.779
9 HD21 LEU 68 HD21 LEU 68 -0.541 -9.681 -7.006
10 HD22 LEU 68 HD22 LEU 68 -2.145 -10.157 -7.559
11 HD23 LEU 68 HD23 LEU 68 -0.720 -11.003 -8.159
No H/Q in entry = 11
In of MODEL 7
1 H LYS 69 H LYS 69 -3.913 -5.959 -9.665
2 HA LYS 69 HA LYS 69 -4.943 -7.526 -11.726
3 HB2 LYS 69 HB2 LYS 69 -6.208 -6.234 -9.938
4 HB3 LYS 69 HB3 LYS 69 -5.984 -4.810 -10.945
5 HG2 LYS 69 HG2 LYS 69 -7.115 -6.111 -12.797
6 HG3 LYS 69 HG3 LYS 69 -7.554 -7.287 -11.556
7 HD2 LYS 69 HD2 LYS 69 -8.643 -5.450 -10.286
8 HD3 LYS 69 HD3 LYS 69 -8.303 -4.368 -11.635
9 HE2 LYS 69 HE2 LYS 69 -9.590 -5.917 -13.105
10 HE3 LYS 69 HE3 LYS 69 -10.043 -6.827 -11.663
11 HZ1 LYS 69 HZ1 LYS 69 -11.068 -4.804 -10.783
12 HZ2 LYS 69 HZ2 LYS 69 -10.676 -3.982 -12.205
13 HZ3 LYS 69 HZ3 LYS 69 -11.768 -5.271 -12.249
No H/Q in entry = 13
In of MODEL 7
1 H HIS 70 H HIS 70 -2.894 -4.862 -11.860
2 HA HIS 70 HA HIS 70 -3.696 -4.155 -14.585
3 HB2 HIS 70 HB2 HIS 70 -3.568 -2.247 -13.052
4 HB3 HIS 70 HB3 HIS 70 -1.916 -2.677 -12.630
5 HD1 HIS 70 HD1 HIS 70 -3.824 -0.604 -14.901
6 HD2 HIS 70 HD2 HIS 70 -0.102 -2.471 -14.934
7 HE1 HIS 70 HE1 HIS 70 -2.518 0.530 -16.720
8 HE2 HIS 70 HE2 HIS 70 -0.347 -0.740 -16.862
No H/Q in entry = 8
In of MODEL 7
1 H VAL 71 H VAL 71 -0.822 -4.662 -12.586
2 HA VAL 71 HA VAL 71 0.999 -4.640 -14.682
3 HB VAL 71 HB VAL 71 1.688 -4.067 -12.479
4 HG11 VAL 71 HG11 VAL 71 1.001 -6.850 -11.696
5 HG12 VAL 71 HG12 VAL 71 1.861 -5.675 -10.687
6 HG13 VAL 71 HG13 VAL 71 0.203 -5.350 -11.202
7 HG21 VAL 71 HG21 VAL 71 2.956 -6.552 -13.513
8 HG22 VAL 71 HG22 VAL 71 3.471 -4.878 -13.717
9 HG23 VAL 71 HG23 VAL 71 3.594 -5.652 -12.140
No H/Q in entry = 9
In of MODEL 7
1 H VAL 72 H VAL 72 -0.404 -7.361 -12.897
2 HA VAL 72 HA VAL 72 0.909 -9.200 -14.723
3 HB VAL 72 HB VAL 72 0.500 -9.398 -12.088
4 HG11 VAL 72 HG11 VAL 72 -1.916 -10.640 -13.309
5 HG12 VAL 72 HG12 VAL 72 -1.248 -11.219 -11.781
6 HG13 VAL 72 HG13 VAL 72 -1.799 -9.550 -11.933
7 HG21 VAL 72 HG21 VAL 72 0.708 -11.569 -14.113
8 HG22 VAL 72 HG22 VAL 72 1.995 -10.799 -13.187
9 HG23 VAL 72 HG23 VAL 72 0.839 -11.860 -12.380
No H/Q in entry = 9
In of MODEL 7
1 H GLY 73 H GLY 73 -1.920 -7.481 -14.464
2 HA2 GLY 73 HA2 GLY 73 -3.074 -8.848 -16.719
3 HA3 GLY 73 HA3 GLY 73 -3.667 -7.373 -15.968
No H/Q in entry = 3
In of MODEL 7
1 H GLU 74 H GLU 74 -5.749 -8.458 -16.336
2 HA GLU 74 HA GLU 74 -6.719 -9.663 -13.955
3 HB2 GLU 74 HB2 GLU 74 -7.992 -9.394 -16.687
4 HB3 GLU 74 HB3 GLU 74 -8.838 -9.903 -15.232
5 HG2 GLU 74 HG2 GLU 74 -8.370 -7.752 -14.193
6 HG3 GLU 74 HG3 GLU 74 -7.489 -7.243 -15.633
No H/Q in entry = 6
In of MODEL 7
1 H GLU 75 H GLU 75 -5.374 -10.816 -16.870
2 HA GLU 75 HA GLU 75 -6.120 -13.494 -16.991
3 HB2 GLU 75 HB2 GLU 75 -4.783 -12.447 -18.697
4 HB3 GLU 75 HB3 GLU 75 -3.488 -12.131 -17.553
5 HG2 GLU 75 HG2 GLU 75 -2.989 -14.463 -17.375
6 HG3 GLU 75 HG3 GLU 75 -4.397 -14.883 -18.353
No H/Q in entry = 6
In of MODEL 7
1 H LYS 76 H LYS 76 -3.166 -12.267 -15.405
2 HA LYS 76 HA LYS 76 -2.713 -14.848 -14.273
3 HB2 LYS 76 HB2 LYS 76 -1.235 -12.257 -13.830
4 HB3 LYS 76 HB3 LYS 76 -0.680 -13.865 -13.417
5 HG2 LYS 76 HG2 LYS 76 -1.242 -12.895 -16.205
6 HG3 LYS 76 HG3 LYS 76 0.353 -13.043 -15.470
7 HD2 LYS 76 HD2 LYS 76 -1.571 -15.324 -15.907
8 HD3 LYS 76 HD3 LYS 76 -0.199 -14.941 -16.949
9 HE2 LYS 76 HE2 LYS 76 1.291 -15.239 -14.992
10 HE3 LYS 76 HE3 LYS 76 -0.103 -15.744 -14.046
11 HZ1 LYS 76 HZ1 LYS 76 0.755 -17.110 -16.533
12 HZ2 LYS 76 HZ2 LYS 76 1.242 -17.592 -14.987
13 HZ3 LYS 76 HZ3 LYS 76 -0.397 -17.638 -15.406
No H/Q in entry = 13
In of MODEL 7
1 H ALA 77 H ALA 77 -3.838 -11.724 -13.088
2 HA ALA 77 HA ALA 77 -3.794 -12.308 -10.341
3 HB1 ALA 77 HB1 ALA 77 -5.415 -10.503 -10.100
4 HB2 ALA 77 HB2 ALA 77 -5.722 -10.530 -11.837
5 HB3 ALA 77 HB3 ALA 77 -4.139 -10.045 -11.229
No H/Q in entry = 5
In of MODEL 7
1 H ALA 78 H ALA 78 -5.891 -13.301 -12.902
2 HA ALA 78 HA ALA 78 -8.056 -14.251 -11.326
3 HB1 ALA 78 HB1 ALA 78 -8.501 -15.654 -13.407
4 HB2 ALA 78 HB2 ALA 78 -8.483 -13.905 -13.623
5 HB3 ALA 78 HB3 ALA 78 -7.087 -14.860 -14.116
No H/Q in entry = 5
In of MODEL 7
1 H GLU 79 H GLU 79 -4.956 -15.512 -12.292
2 HA GLU 79 HA GLU 79 -5.552 -18.223 -11.540
3 HB2 GLU 79 HB2 GLU 79 -2.848 -16.999 -12.065
4 HB3 GLU 79 HB3 GLU 79 -3.258 -18.708 -12.075
5 HG2 GLU 79 HG2 GLU 79 -4.810 -18.173 -14.000
6 HG3 GLU 79 HG3 GLU 79 -4.016 -16.600 -14.062
No H/Q in entry = 6
In of MODEL 7
1 H LEU 80 H LEU 80 -3.746 -15.496 -10.145
2 HA LEU 80 HA LEU 80 -3.012 -16.638 -7.737
3 HB2 LEU 80 HB2 LEU 80 -3.825 -13.894 -8.625
4 HB3 LEU 80 HB3 LEU 80 -3.481 -14.200 -6.936
5 HG LEU 80 HG LEU 80 -1.600 -13.215 -8.183
6 HD11 LEU 80 HD11 LEU 80 -1.147 -15.979 -7.103
7 HD12 LEU 80 HD12 LEU 80 0.109 -14.759 -7.327
8 HD13 LEU 80 HD13 LEU 80 -1.195 -14.484 -6.167
9 HD21 LEU 80 HD21 LEU 80 -1.531 -15.830 -9.652
10 HD22 LEU 80 HD22 LEU 80 -1.827 -14.237 -10.345
11 HD23 LEU 80 HD23 LEU 80 -0.241 -14.620 -9.665
No H/Q in entry = 11
In of MODEL 7
1 H LYS 81 H LYS 81 -6.046 -15.106 -8.713
2 HA LYS 81 HA LYS 81 -7.376 -15.218 -6.256
3 HB2 LYS 81 HB2 LYS 81 -8.174 -13.810 -8.042
4 HB3 LYS 81 HB3 LYS 81 -8.420 -15.198 -9.090
5 HG2 LYS 81 HG2 LYS 81 -10.521 -14.308 -8.194
6 HG3 LYS 81 HG3 LYS 81 -10.239 -15.976 -7.700
7 HD2 LYS 81 HD2 LYS 81 -9.620 -15.308 -5.504
8 HD3 LYS 81 HD3 LYS 81 -9.537 -13.609 -5.972
9 HE2 LYS 81 HE2 LYS 81 -11.572 -14.096 -4.701
10 HE3 LYS 81 HE3 LYS 81 -11.943 -13.576 -6.344
11 HZ1 LYS 81 HZ1 LYS 81 -12.261 -15.903 -6.951
12 HZ2 LYS 81 HZ2 LYS 81 -11.938 -16.378 -5.363
13 HZ3 LYS 81 HZ3 LYS 81 -13.305 -15.445 -5.705
No H/Q in entry = 13
In of MODEL 7
1 H ASN 82 H ASN 82 -7.644 -17.451 -9.045
2 HA ASN 82 HA ASN 82 -9.304 -19.233 -7.584
3 HB2 ASN 82 HB2 ASN 82 -7.931 -19.319 -10.255
4 HB3 ASN 82 HB3 ASN 82 -8.751 -20.724 -9.620
5 HD21 ASN 82 HD21 ASN 82 -9.105 -17.534 -10.885
6 HD22 ASN 82 HD22 ASN 82 -10.822 -17.587 -11.111
No H/Q in entry = 6
In of MODEL 7
1 H LEU 83 H LEU 83 -5.936 -18.735 -7.619
2 HA LEU 83 HA LEU 83 -5.244 -21.378 -6.882
3 HB2 LEU 83 HB2 LEU 83 -3.952 -18.766 -7.028
4 HB3 LEU 83 HB3 LEU 83 -3.406 -19.721 -5.672
5 HG LEU 83 HG LEU 83 -3.340 -20.594 -8.562
6 HD11 LEU 83 HD11 LEU 83 -1.125 -19.725 -6.715
7 HD12 LEU 83 HD12 LEU 83 -0.919 -20.364 -8.347
8 HD13 LEU 83 HD13 LEU 83 -1.743 -18.824 -8.100
9 HD21 LEU 83 HD21 LEU 83 -2.247 -21.927 -6.087
10 HD22 LEU 83 HD22 LEU 83 -3.623 -22.482 -7.040
11 HD23 LEU 83 HD23 LEU 83 -2.008 -22.472 -7.744
No H/Q in entry = 11
In of MODEL 7
1 H LYS 84 H LYS 84 -5.593 -18.393 -4.989
2 HA LYS 84 HA LYS 84 -5.390 -19.504 -2.460
3 HB2 LYS 84 HB2 LYS 84 -5.464 -17.050 -3.026
4 HB3 LYS 84 HB3 LYS 84 -7.211 -17.198 -3.161
5 HG2 LYS 84 HG2 LYS 84 -7.285 -17.970 -0.808
6 HG3 LYS 84 HG3 LYS 84 -5.550 -17.677 -0.695
7 HD2 LYS 84 HD2 LYS 84 -6.650 -15.779 0.229
8 HD3 LYS 84 HD3 LYS 84 -6.004 -15.295 -1.341
9 HE2 LYS 84 HE2 LYS 84 -8.214 -15.627 -2.344
10 HE3 LYS 84 HE3 LYS 84 -8.854 -16.099 -0.773
11 HZ1 LYS 84 HZ1 LYS 84 -7.695 -13.447 -1.431
12 HZ2 LYS 84 HZ2 LYS 84 -9.346 -13.791 -1.285
13 HZ3 LYS 84 HZ3 LYS 84 -8.334 -13.903 0.068
No H/Q in entry = 13
In of MODEL 7
1 H ASP 85 H ASP 85 -8.302 -18.984 -4.389
2 HA ASP 85 HA ASP 85 -10.175 -19.948 -2.543
3 HB2 ASP 85 HB2 ASP 85 -10.722 -18.654 -4.589
4 HB3 ASP 85 HB3 ASP 85 -10.321 -20.070 -5.560
No H/Q in entry = 4
In of MODEL 7
1 H SER 86 H SER 86 -8.303 -21.661 -5.030
2 HA SER 86 HA SER 86 -9.647 -24.141 -4.470
3 HB2 SER 86 HB2 SER 86 -8.778 -23.540 -6.734
4 HB3 SER 86 HB3 SER 86 -7.140 -23.698 -6.104
5 HG SER 86 HG SER 86 -7.896 -25.914 -5.467
No H/Q in entry = 5
In of MODEL 7
1 H GLY 87 H GLY 87 -7.205 -22.463 -2.939
2 HA2 GLY 87 HA2 GLY 87 -6.471 -24.949 -1.514
3 HA3 GLY 87 HA3 GLY 87 -6.641 -23.382 -0.736
No H/Q in entry = 3
In of MODEL 7
1 H ALA 88 H ALA 88 -5.242 -21.869 -2.693
2 HA ALA 88 HA ALA 88 -2.554 -22.878 -2.573
3 HB1 ALA 88 HB1 ALA 88 -3.525 -20.118 -3.291
4 HB2 ALA 88 HB2 ALA 88 -3.207 -21.433 -4.419
5 HB3 ALA 88 HB3 ALA 88 -1.882 -20.719 -3.502
No H/Q in entry = 5
In of MODEL 7
1 H SER 89 H SER 89 -1.294 -22.667 -0.901
2 HA SER 89 HA SER 89 -1.960 -21.191 1.436
3 HB2 SER 89 HB2 SER 89 0.315 -21.962 2.168
4 HB3 SER 89 HB3 SER 89 -0.752 -23.265 1.666
5 HG SER 89 HG SER 89 0.735 -23.772 0.285
No H/Q in entry = 5
In of MODEL 7
1 H LYS 90 H LYS 90 0.050 -19.830 2.376
2 HA LYS 90 HA LYS 90 0.170 -17.509 0.814
3 HB2 LYS 90 HB2 LYS 90 1.795 -16.673 2.431
4 HB3 LYS 90 HB3 LYS 90 0.457 -17.465 3.244
5 HG2 LYS 90 HG2 LYS 90 1.816 -19.430 3.633
6 HG3 LYS 90 HG3 LYS 90 3.156 -18.699 2.745
7 HD2 LYS 90 HD2 LYS 90 3.209 -16.866 4.400
8 HD3 LYS 90 HD3 LYS 90 1.924 -17.672 5.302
9 HE2 LYS 90 HE2 LYS 90 3.366 -19.605 5.649
10 HE3 LYS 90 HE3 LYS 90 4.645 -18.831 4.715
11 HZ1 LYS 90 HZ1 LYS 90 4.595 -17.012 6.397
12 HZ2 LYS 90 HZ2 LYS 90 3.555 -17.964 7.332
13 HZ3 LYS 90 HZ3 LYS 90 5.125 -18.505 6.997
No H/Q in entry = 13
In of MODEL 7
1 H GLU 91 H GLU 91 2.190 -20.352 0.855
2 HA GLU 91 HA GLU 91 4.390 -19.025 -0.383
3 HB2 GLU 91 HB2 GLU 91 4.850 -20.895 1.080
4 HB3 GLU 91 HB3 GLU 91 3.848 -21.959 0.102
5 HG2 GLU 91 HG2 GLU 91 5.418 -21.698 -1.760
6 HG3 GLU 91 HG3 GLU 91 6.439 -20.683 -0.743
No H/Q in entry = 6
In of MODEL 7
1 H GLU 92 H GLU 92 1.911 -21.287 -1.503
2 HA GLU 92 HA GLU 92 2.577 -21.605 -4.147
3 HB2 GLU 92 HB2 GLU 92 -0.159 -21.269 -2.921
4 HB3 GLU 92 HB3 GLU 92 0.186 -21.999 -4.474
5 HG2 GLU 92 HG2 GLU 92 1.204 -23.053 -1.866
6 HG3 GLU 92 HG3 GLU 92 -0.271 -23.596 -2.655
No H/Q in entry = 6
In of MODEL 7
1 H LEU 93 H LEU 93 0.669 -19.057 -2.576
2 HA LEU 93 HA LEU 93 0.432 -17.478 -4.941
3 HB2 LEU 93 HB2 LEU 93 0.233 -16.670 -2.040
4 HB3 LEU 93 HB3 LEU 93 -0.176 -15.629 -3.393
5 HG LEU 93 HG LEU 93 -1.567 -18.186 -2.587
6 HD11 LEU 93 HD11 LEU 93 -2.498 -15.328 -2.706
7 HD12 LEU 93 HD12 LEU 93 -3.507 -16.723 -2.326
8 HD13 LEU 93 HD13 LEU 93 -2.186 -16.272 -1.247
9 HD21 LEU 93 HD21 LEU 93 -2.012 -16.440 -5.005
10 HD22 LEU 93 HD22 LEU 93 -1.469 -18.119 -4.996
11 HD23 LEU 93 HD23 LEU 93 -3.102 -17.715 -4.462
No H/Q in entry = 11
In of MODEL 7
1 H LYS 94 H LYS 94 2.869 -17.641 -2.357
2 HA LYS 94 HA LYS 94 4.237 -15.290 -3.100
3 HB2 LYS 94 HB2 LYS 94 4.566 -16.414 -0.945
4 HB3 LYS 94 HB3 LYS 94 5.252 -17.805 -1.760
5 HG2 LYS 94 HG2 LYS 94 7.141 -16.461 -2.500
6 HG3 LYS 94 HG3 LYS 94 6.450 -15.044 -1.701
7 HD2 LYS 94 HD2 LYS 94 6.616 -16.153 0.456
8 HD3 LYS 94 HD3 LYS 94 7.230 -17.613 -0.320
9 HE2 LYS 94 HE2 LYS 94 8.591 -14.927 -0.413
10 HE3 LYS 94 HE3 LYS 94 8.983 -16.201 0.739
11 HZ1 LYS 94 HZ1 LYS 94 9.188 -16.440 -2.212
12 HZ2 LYS 94 HZ2 LYS 94 10.483 -16.192 -1.160
13 HZ3 LYS 94 HZ3 LYS 94 9.605 -17.633 -1.089
No H/Q in entry = 13
In of MODEL 7
1 H ALA 95 H ALA 95 4.505 -18.632 -4.054
2 HA ALA 95 HA ALA 95 6.766 -18.051 -5.737
3 HB1 ALA 95 HB1 ALA 95 6.763 -20.109 -4.382
4 HB2 ALA 95 HB2 ALA 95 6.865 -20.480 -6.105
5 HB3 ALA 95 HB3 ALA 95 5.328 -20.662 -5.252
No H/Q in entry = 5
In of MODEL 7
1 H LYS 96 H LYS 96 3.356 -18.485 -6.032
2 HA LYS 96 HA LYS 96 3.307 -18.578 -8.856
3 HB2 LYS 96 HB2 LYS 96 1.296 -18.858 -7.458
4 HB3 LYS 96 HB3 LYS 96 1.369 -17.158 -7.021
5 HG2 LYS 96 HG2 LYS 96 -0.297 -17.474 -8.716
6 HG3 LYS 96 HG3 LYS 96 1.050 -16.560 -9.389
7 HD2 LYS 96 HD2 LYS 96 1.891 -18.539 -10.496
8 HD3 LYS 96 HD3 LYS 96 0.646 -19.531 -9.734
9 HE2 LYS 96 HE2 LYS 96 -1.085 -18.283 -10.911
10 HE3 LYS 96 HE3 LYS 96 0.140 -17.252 -11.644
11 HZ1 LYS 96 HZ1 LYS 96 1.046 -19.198 -12.764
12 HZ2 LYS 96 HZ2 LYS 96 -0.150 -20.175 -12.076
13 HZ3 LYS 96 HZ3 LYS 96 -0.581 -18.959 -13.176
No H/Q in entry = 13
In of MODEL 7
1 H VAL 97 H VAL 97 2.851 -15.755 -6.803
2 HA VAL 97 HA VAL 97 2.832 -13.752 -8.607
3 HB VAL 97 HB VAL 97 4.104 -13.701 -5.868
4 HG11 VAL 97 HG11 VAL 97 4.842 -11.799 -7.212
5 HG12 VAL 97 HG12 VAL 97 3.165 -11.411 -7.581
6 HG13 VAL 97 HG13 VAL 97 3.752 -11.294 -5.924
7 HG21 VAL 97 HG21 VAL 97 1.348 -13.026 -6.861
8 HG22 VAL 97 HG22 VAL 97 1.803 -14.408 -5.863
9 HG23 VAL 97 HG23 VAL 97 1.924 -12.771 -5.211
No H/Q in entry = 9
In of MODEL 7
1 H GLU 98 H GLU 98 5.784 -15.154 -7.171
2 HA GLU 98 HA GLU 98 7.606 -13.419 -8.380
3 HB2 GLU 98 HB2 GLU 98 7.882 -16.287 -7.516
4 HB3 GLU 98 HB3 GLU 98 9.221 -15.376 -8.210
5 HG2 GLU 98 HG2 GLU 98 7.705 -14.727 -5.692
6 HG3 GLU 98 HG3 GLU 98 9.356 -15.331 -5.808
No H/Q in entry = 6
In of MODEL 7
1 H GLU 99 H GLU 99 6.353 -16.545 -9.552
2 HA GLU 99 HA GLU 99 7.819 -16.619 -11.933
3 HB2 GLU 99 HB2 GLU 99 5.039 -17.697 -11.424
4 HB3 GLU 99 HB3 GLU 99 6.064 -18.129 -12.785
5 HG2 GLU 99 HG2 GLU 99 7.743 -18.969 -11.133
6 HG3 GLU 99 HG3 GLU 99 6.531 -18.724 -9.879
No H/Q in entry = 6
In of MODEL 7
1 H ALA 100 H ALA 100 4.711 -15.102 -11.163
2 HA ALA 100 HA ALA 100 4.131 -14.270 -13.810
3 HB1 ALA 100 HB1 ALA 100 2.467 -14.427 -12.012
4 HB2 ALA 100 HB2 ALA 100 2.475 -12.841 -12.784
5 HB3 ALA 100 HB3 ALA 100 3.229 -13.056 -11.205
No H/Q in entry = 5
In of MODEL 7
1 H LEU 101 H LEU 101 5.316 -12.355 -11.043
2 HA LEU 101 HA LEU 101 5.994 -10.084 -12.481
3 HB2 LEU 101 HB2 LEU 101 6.606 -11.189 -9.793
4 HB3 LEU 101 HB3 LEU 101 7.524 -9.803 -10.354
5 HG LEU 101 HG LEU 101 5.482 -8.536 -10.639
6 HD11 LEU 101 HD11 LEU 101 3.961 -10.352 -11.203
7 HD12 LEU 101 HD12 LEU 101 4.000 -10.883 -9.521
8 HD13 LEU 101 HD13 LEU 101 3.327 -9.303 -9.934
9 HD21 LEU 101 HD21 LEU 101 5.695 -9.820 -7.939
10 HD22 LEU 101 HD22 LEU 101 6.605 -8.419 -8.504
11 HD23 LEU 101 HD23 LEU 101 4.858 -8.307 -8.283
No H/Q in entry = 11
In of MODEL 7
1 H HIS 102 H HIS 102 7.648 -13.094 -12.461
2 HA HIS 102 HA HIS 102 10.046 -11.734 -13.334
3 HB2 HIS 102 HB2 HIS 102 9.425 -14.702 -13.186
4 HB3 HIS 102 HB3 HIS 102 10.964 -14.059 -13.744
5 HD1 HIS 102 HD1 HIS 102 10.954 -15.933 -11.374
6 HD2 HIS 102 HD2 HIS 102 10.611 -11.811 -10.998
7 HE1 HIS 102 HE1 HIS 102 11.653 -15.411 -9.018
8 HE2 HIS 102 HE2 HIS 102 11.184 -12.951 -8.749
No H/Q in entry = 8
In of MODEL 7
1 H ALA 103 H ALA 103 7.602 -13.956 -14.621
2 HA ALA 103 HA ALA 103 8.511 -13.949 -17.290
3 HB1 ALA 103 HB1 ALA 103 5.749 -14.582 -16.281
4 HB2 ALA 103 HB2 ALA 103 7.108 -15.704 -16.286
5 HB3 ALA 103 HB3 ALA 103 6.464 -15.095 -17.811
No H/Q in entry = 5
In of MODEL 7
1 H VAL 104 H VAL 104 7.273 -11.357 -15.713
2 HA VAL 104 HA VAL 104 5.600 -10.302 -17.779
3 HB VAL 104 HB VAL 104 5.212 -9.721 -15.448
4 HG11 VAL 104 HG11 VAL 104 8.002 -8.642 -15.647
5 HG12 VAL 104 HG12 VAL 104 6.890 -8.245 -14.333
6 HG13 VAL 104 HG13 VAL 104 7.395 -9.914 -14.577
7 HG21 VAL 104 HG21 VAL 104 6.181 -7.382 -17.079
8 HG22 VAL 104 HG22 VAL 104 4.560 -8.068 -17.093
9 HG23 VAL 104 HG23 VAL 104 5.163 -7.265 -15.644
No H/Q in entry = 9
In of MODEL 7
1 H THR 105 H THR 105 6.160 -8.712 -19.253
2 HA THR 105 HA THR 105 8.928 -7.778 -19.219
3 HB THR 105 HB THR 105 9.007 -8.259 -21.750
4 HG1 THR 105 HG1 THR 105 6.962 -8.979 -22.169
5 HG21 THR 105 HG21 THR 105 9.182 -10.521 -19.762
6 HG22 THR 105 HG22 THR 105 9.895 -10.524 -21.375
7 HG23 THR 105 HG23 THR 105 10.466 -9.380 -20.162
No H/Q in entry = 7
In of MODEL 7
1 H ASP 106 H ASP 106 5.733 -6.912 -19.563
2 HA ASP 106 HA ASP 106 6.242 -4.810 -21.469
3 HB2 ASP 106 HB2 ASP 106 3.991 -5.983 -21.065
4 HB3 ASP 106 HB3 ASP 106 3.863 -4.973 -19.633
No H/Q in entry = 4
In of MODEL 7
1 H GLU 107 H GLU 107 6.801 -2.790 -21.055
2 HA GLU 107 HA GLU 107 8.526 -2.440 -18.927
3 HB2 GLU 107 HB2 GLU 107 7.311 -0.302 -20.677
4 HB3 GLU 107 HB3 GLU 107 8.746 -0.111 -19.687
5 HG2 GLU 107 HG2 GLU 107 9.443 -0.435 -21.928
6 HG3 GLU 107 HG3 GLU 107 9.831 -1.900 -21.032
No H/Q in entry = 6
In of MODEL 7
1 H GLU 108 H GLU 108 5.463 -0.764 -19.443
2 HA GLU 108 HA GLU 108 5.386 0.846 -17.210
3 HB2 GLU 108 HB2 GLU 108 3.781 1.119 -18.944
4 HB3 GLU 108 HB3 GLU 108 3.220 -0.538 -18.782
5 HG2 GLU 108 HG2 GLU 108 2.482 0.151 -16.430
6 HG3 GLU 108 HG3 GLU 108 2.691 1.807 -17.004
No H/Q in entry = 6
In of MODEL 7
1 H LYS 109 H LYS 109 4.480 -2.513 -17.567
2 HA LYS 109 HA LYS 109 3.187 -2.835 -15.086
3 HB2 LYS 109 HB2 LYS 109 4.369 -4.729 -17.100
4 HB3 LYS 109 HB3 LYS 109 3.615 -5.303 -15.624
5 HG2 LYS 109 HG2 LYS 109 2.051 -5.397 -17.454
6 HG3 LYS 109 HG3 LYS 109 1.518 -4.212 -16.284
7 HD2 LYS 109 HD2 LYS 109 2.265 -2.408 -17.652
8 HD3 LYS 109 HD3 LYS 109 3.035 -3.515 -18.781
9 HE2 LYS 109 HE2 LYS 109 0.856 -4.417 -19.399
10 HE3 LYS 109 HE3 LYS 109 0.073 -3.343 -18.237
11 HZ1 LYS 109 HZ1 LYS 109 1.714 -2.416 -20.532
12 HZ2 LYS 109 HZ2 LYS 109 0.021 -2.520 -20.553
13 HZ3 LYS 109 HZ3 LYS 109 0.785 -1.451 -19.483
No H/Q in entry = 13
In of MODEL 7
1 H LYS 110 H LYS 110 6.502 -3.390 -16.184
2 HA LYS 110 HA LYS 110 7.325 -4.603 -13.723
3 HB2 LYS 110 HB2 LYS 110 8.996 -3.422 -15.945
4 HB3 LYS 110 HB3 LYS 110 9.597 -4.453 -14.654
5 HG2 LYS 110 HG2 LYS 110 8.128 -6.264 -15.492
6 HG3 LYS 110 HG3 LYS 110 7.684 -5.222 -16.841
7 HD2 LYS 110 HD2 LYS 110 10.488 -6.134 -16.190
8 HD3 LYS 110 HD3 LYS 110 9.456 -6.836 -17.432
9 HE2 LYS 110 HE2 LYS 110 10.756 -5.398 -18.674
10 HE3 LYS 110 HE3 LYS 110 9.350 -4.392 -18.337
11 HZ1 LYS 110 HZ1 LYS 110 10.595 -3.369 -16.509
12 HZ2 LYS 110 HZ2 LYS 110 11.940 -4.322 -16.879
13 HZ3 LYS 110 HZ3 LYS 110 11.388 -3.169 -17.985
No H/Q in entry = 13
In of MODEL 7
1 H GLN 111 H GLN 111 6.938 -1.407 -14.810
2 HA GLN 111 HA GLN 111 8.628 -0.094 -12.969
3 HB2 GLN 111 HB2 GLN 111 7.536 1.036 -14.886
4 HB3 GLN 111 HB3 GLN 111 5.984 0.865 -14.079
5 HG2 GLN 111 HG2 GLN 111 6.900 3.110 -13.819
6 HG3 GLN 111 HG3 GLN 111 6.737 2.288 -12.267
7 HE21 GLN 111 HE21 GLN 111 8.577 1.674 -11.144
8 HE22 GLN 111 HE22 GLN 111 10.146 2.289 -11.535
No H/Q in entry = 8
In of MODEL 7
1 H TYR 112 H TYR 112 5.365 -1.412 -12.688
2 HA TYR 112 HA TYR 112 4.924 -0.428 -10.007
3 HB2 TYR 112 HB2 TYR 112 3.564 -2.684 -11.508
4 HB3 TYR 112 HB3 TYR 112 3.020 -2.000 -9.983
5 HD1 TYR 112 HD1 TYR 112 3.068 0.794 -10.248
6 HD2 TYR 112 HD2 TYR 112 2.184 -2.090 -13.249
7 HE1 TYR 112 HE1 TYR 112 1.739 2.470 -11.467
8 HE2 TYR 112 HE2 TYR 112 0.862 -0.420 -14.478
9 HH TYR 112 HH TYR 112 -0.322 1.651 -14.067
No H/Q in entry = 9
In of MODEL 7
1 H ILE 113 H ILE 113 6.221 -3.323 -11.495
2 HA ILE 113 HA ILE 113 6.337 -4.898 -9.167
3 HB ILE 113 HB ILE 113 7.976 -4.974 -11.686
4 HG12 ILE 113 HG12 ILE 113 5.712 -6.672 -10.636
5 HG13 ILE 113 HG13 ILE 113 5.550 -5.412 -11.847
6 HG21 ILE 113 HG21 ILE 113 7.906 -6.984 -9.433
7 HG22 ILE 113 HG22 ILE 113 8.685 -7.224 -10.998
8 HG23 ILE 113 HG23 ILE 113 9.285 -5.987 -9.893
9 HD11 ILE 113 HD11 ILE 113 7.160 -7.922 -12.123
10 HD12 ILE 113 HD12 ILE 113 5.591 -7.597 -12.860
11 HD13 ILE 113 HD13 ILE 113 7.002 -6.653 -13.336
No H/Q in entry = 11
In of MODEL 7
1 H ALA 114 H ALA 114 8.658 -2.601 -10.577
2 HA ALA 114 HA ALA 114 10.611 -2.929 -8.505
3 HB1 ALA 114 HB1 ALA 114 11.229 -2.053 -10.696
4 HB2 ALA 114 HB2 ALA 114 11.612 -0.886 -9.432
5 HB3 ALA 114 HB3 ALA 114 10.186 -0.653 -10.445
No H/Q in entry = 5
In of MODEL 7
1 H ASP 115 H ASP 115 7.918 -0.747 -9.094
2 HA ASP 115 HA ASP 115 8.530 1.028 -6.955
3 HB2 ASP 115 HB2 ASP 115 7.213 1.680 -8.941
4 HB3 ASP 115 HB3 ASP 115 5.907 0.630 -8.404
No H/Q in entry = 4
In of MODEL 7
1 H PHE 116 H PHE 116 5.976 -1.426 -7.307
2 HA PHE 116 HA PHE 116 5.388 -1.087 -4.458
3 HB2 PHE 116 HB2 PHE 116 3.700 -1.297 -6.738
4 HB3 PHE 116 HB3 PHE 116 3.439 -2.735 -5.752
5 HD1 PHE 116 HD1 PHE 116 2.582 -2.551 -3.488
6 HD2 PHE 116 HD2 PHE 116 3.068 0.861 -5.988
7 HE1 PHE 116 HE1 PHE 116 1.136 -1.259 -1.978
8 HE2 PHE 116 HE2 PHE 116 1.617 2.172 -4.469
9 HZ PHE 116 HZ PHE 116 0.649 1.099 -2.461
No H/Q in entry = 9
In of MODEL 7
1 H GLY 117 H GLY 117 6.695 -3.291 -6.702
2 HA2 GLY 117 HA2 GLY 117 7.557 -5.420 -6.432
3 HA3 GLY 117 HA3 GLY 117 5.919 -5.788 -5.936
No H/Q in entry = 3
In of MODEL 7
1 HA PRO 118 HA PRO 118 9.394 -6.414 -2.570
2 HB2 PRO 118 HB2 PRO 118 9.975 -3.567 -1.936
3 HB3 PRO 118 HB3 PRO 118 11.066 -4.955 -1.984
4 HG2 PRO 118 HG2 PRO 118 11.082 -3.159 -3.947
5 HG3 PRO 118 HG3 PRO 118 11.274 -4.885 -4.294
6 HD2 PRO 118 HD2 PRO 118 8.894 -3.130 -4.678
7 HD3 PRO 118 HD3 PRO 118 9.470 -4.484 -5.669
No H/Q in entry = 7
In of MODEL 7
1 H ALA 119 H ALA 119 7.667 -3.329 -2.093
2 HA ALA 119 HA ALA 119 7.074 -3.811 0.658
3 HB1 ALA 119 HB1 ALA 119 7.178 -1.567 -0.279
4 HB2 ALA 119 HB2 ALA 119 5.611 -1.882 0.463
5 HB3 ALA 119 HB3 ALA 119 5.777 -1.917 -1.292
No H/Q in entry = 5
In of MODEL 7
1 H CYS 120 H CYS 120 5.383 -4.444 -2.359
2 HA CYS 120 HA CYS 120 2.890 -5.194 -1.355
3 HB2 CYS 120 HB2 CYS 120 3.439 -4.892 -3.754
4 HB3 CYS 120 HB3 CYS 120 4.401 -6.363 -3.702
No H/Q in entry = 4
In of MODEL 7
1 H LYS 121 H LYS 121 5.960 -6.907 -1.461
2 HA LYS 121 HA LYS 121 5.054 -9.499 -0.923
3 HB2 LYS 121 HB2 LYS 121 7.617 -8.272 0.100
4 HB3 LYS 121 HB3 LYS 121 7.287 -9.983 -0.112
5 HG2 LYS 121 HG2 LYS 121 7.388 -7.967 -2.348
6 HG3 LYS 121 HG3 LYS 121 8.723 -9.012 -1.874
7 HD2 LYS 121 HD2 LYS 121 6.026 -10.008 -2.787
8 HD3 LYS 121 HD3 LYS 121 7.430 -9.831 -3.839
9 HE2 LYS 121 HE2 LYS 121 8.661 -11.362 -2.256
10 HE3 LYS 121 HE3 LYS 121 7.109 -11.672 -1.476
11 HZ1 LYS 121 HZ1 LYS 121 6.266 -12.486 -3.604
12 HZ2 LYS 121 HZ2 LYS 121 7.776 -12.218 -4.328
13 HZ3 LYS 121 HZ3 LYS 121 7.613 -13.371 -3.098
No H/Q in entry = 13
In of MODEL 7
1 H LYS 122 H LYS 122 6.007 -6.940 1.418
2 HA LYS 122 HA LYS 122 5.282 -8.499 3.688
3 HB2 LYS 122 HB2 LYS 122 5.500 -6.489 5.002
4 HB3 LYS 122 HB3 LYS 122 6.806 -6.551 3.834
5 HG2 LYS 122 HG2 LYS 122 5.592 -4.948 2.423
6 HG3 LYS 122 HG3 LYS 122 4.334 -4.851 3.657
7 HD2 LYS 122 HD2 LYS 122 5.876 -2.986 3.880
8 HD3 LYS 122 HD3 LYS 122 6.013 -4.058 5.276
9 HE2 LYS 122 HE2 LYS 122 7.994 -5.096 4.259
10 HE3 LYS 122 HE3 LYS 122 7.861 -3.994 2.892
11 HZ1 LYS 122 HZ1 LYS 122 8.323 -3.193 5.713
12 HZ2 LYS 122 HZ2 LYS 122 9.502 -3.251 4.503
13 HZ3 LYS 122 HZ3 LYS 122 8.232 -2.144 4.390
No H/Q in entry = 13
In of MODEL 7
1 H ILE 123 H ILE 123 3.515 -6.444 1.500
2 HA ILE 123 HA ILE 123 1.257 -6.027 3.145
3 HB ILE 123 HB ILE 123 1.550 -5.870 0.167
4 HG12 ILE 123 HG12 ILE 123 1.370 -3.754 2.321
5 HG13 ILE 123 HG13 ILE 123 2.858 -4.272 1.536
6 HG21 ILE 123 HG21 ILE 123 -0.769 -5.122 1.942
7 HG22 ILE 123 HG22 ILE 123 -0.587 -4.593 0.265
8 HG23 ILE 123 HG23 ILE 123 -0.761 -6.310 0.635
9 HD11 ILE 123 HD11 ILE 123 0.520 -3.041 0.128
10 HD12 ILE 123 HD12 ILE 123 1.961 -2.170 0.648
11 HD13 ILE 123 HD13 ILE 123 2.087 -3.437 -0.569
No H/Q in entry = 11
In of MODEL 7
1 H TYR 124 H TYR 124 1.889 -8.209 0.527
2 HA TYR 124 HA TYR 124 -0.376 -9.917 0.857
3 HB2 TYR 124 HB2 TYR 124 2.154 -10.029 -0.752
4 HB3 TYR 124 HB3 TYR 124 1.125 -11.449 -0.622
5 HD1 TYR 124 HD1 TYR 124 0.072 -7.898 -0.858
6 HD2 TYR 124 HD2 TYR 124 0.295 -11.667 -2.818
7 HE1 TYR 124 HE1 TYR 124 -1.338 -7.032 -2.675
8 HE2 TYR 124 HE2 TYR 124 -1.114 -10.807 -4.637
9 HH TYR 124 HH TYR 124 -2.842 -8.989 -4.916
No H/Q in entry = 9
In of MODEL 7
1 H GLY 125 H GLY 125 0.990 -9.625 3.310
2 HA2 GLY 125 HA2 GLY 125 2.303 -10.663 4.954
3 HA3 GLY 125 HA3 GLY 125 3.469 -10.031 3.827
No H/Q in entry = 3
In of MODEL 7
1 H VAL 126 H VAL 126 2.744 -12.229 1.899
2 HA VAL 126 HA VAL 126 3.703 -14.678 2.786
3 HB VAL 126 HB VAL 126 4.573 -14.985 0.475
4 HG11 VAL 126 HG11 VAL 126 1.827 -13.755 0.674
5 HG12 VAL 126 HG12 VAL 126 2.411 -14.725 -0.677
6 HG13 VAL 126 HG13 VAL 126 2.240 -15.451 0.921
7 HG21 VAL 126 HG21 VAL 126 3.742 -12.102 0.126
8 HG22 VAL 126 HG22 VAL 126 5.388 -12.734 0.058
9 HG23 VAL 126 HG23 VAL 126 4.217 -13.195 -1.177
No H/Q in entry = 9
In of MODEL 7
1 H HIS 127 H HIS 127 5.294 -11.661 2.604
2 HA HIS 127 HA HIS 127 7.969 -12.301 2.250
3 HB2 HIS 127 HB2 HIS 127 7.129 -10.000 2.392
4 HB3 HIS 127 HB3 HIS 127 6.749 -10.233 4.091
5 HD1 HIS 127 HD1 HIS 127 8.507 -9.546 5.699
6 HD2 HIS 127 HD2 HIS 127 10.026 -10.149 1.877
7 HE1 HIS 127 HE1 HIS 127 10.910 -8.814 5.805
8 HE2 HIS 127 HE2 HIS 127 11.839 -9.320 3.520
No H/Q in entry = 8
In of MODEL 7
1 H THR 128 H THR 128 5.975 -12.465 5.164
2 HA THR 128 HA THR 128 8.096 -13.691 6.701
3 HB THR 128 HB THR 128 5.143 -13.509 7.355
4 HG1 THR 128 HG1 THR 128 7.271 -11.685 7.579
5 HG21 THR 128 HG21 THR 128 6.369 -15.167 8.687
6 HG22 THR 128 HG22 THR 128 7.558 -13.941 9.124
7 HG23 THR 128 HG23 THR 128 5.889 -13.788 9.676
No H/Q in entry = 7
In of MODEL 7
1 H SER 129 H SER 129 8.657 -15.507 5.533
2 HA SER 129 HA SER 129 6.586 -17.368 4.697
3 HB2 SER 129 HB2 SER 129 9.576 -17.552 4.270
4 HB3 SER 129 HB3 SER 129 8.314 -18.414 3.388
5 HG SER 129 HG SER 129 7.670 -15.933 3.094
No H/Q in entry = 5
In of MODEL 8
1 HA2 GLY -4 HA2 GLY -4 0.580 7.162 -23.087
2 HA3 GLY -4 HA3 GLY -4 2.293 7.252 -22.710
3 H1 GLY -4 H1 GLY -4 2.157 5.035 -21.763
4 H2 GLY -4 H2 GLY -4 1.669 5.035 -23.380
No H/Q in entry = 4
In of MODEL 8
1 H SER -3 H SER -3 1.111 9.249 -21.661
2 HA SER -3 HA SER -3 0.144 8.587 -18.989
3 HB2 SER -3 HB2 SER -3 2.609 8.755 -18.806
4 HB3 SER -3 HB3 SER -3 2.538 10.379 -19.484
5 HG SER -3 HG SER -3 2.474 10.824 -17.399
No H/Q in entry = 5
In of MODEL 8
1 HA PRO -2 HA PRO -2 -2.212 12.159 -20.483
2 HB2 PRO -2 HB2 PRO -2 -4.508 11.559 -19.263
3 HB3 PRO -2 HB3 PRO -2 -3.977 10.672 -20.696
4 HG2 PRO -2 HG2 PRO -2 -3.813 9.890 -17.819
5 HG3 PRO -2 HG3 PRO -2 -4.247 8.903 -19.225
6 HD2 PRO -2 HD2 PRO -2 -1.755 8.933 -18.041
7 HD3 PRO -2 HD3 PRO -2 -2.064 8.448 -19.719
No H/Q in entry = 7
In of MODEL 8
1 H GLU -1 H GLU -1 -0.333 12.583 -18.521
2 HA GLU -1 HA GLU -1 0.218 13.965 -16.819
3 HB2 GLU -1 HB2 GLU -1 -2.629 14.835 -17.196
4 HB3 GLU -1 HB3 GLU -1 -1.666 15.465 -15.869
5 HG2 GLU -1 HG2 GLU -1 -1.582 17.019 -17.665
6 HG3 GLU -1 HG3 GLU -1 0.000 16.255 -17.522
No H/Q in entry = 6
In of MODEL 8
1 H PHE 0 H PHE 0 -3.079 12.905 -16.004
2 HA PHE 0 HA PHE 0 -2.444 12.532 -13.253
3 HB2 PHE 0 HB2 PHE 0 -4.706 13.109 -13.957
4 HB3 PHE 0 HB3 PHE 0 -4.822 11.623 -14.890
5 HD1 PHE 0 HD1 PHE 0 -4.381 12.887 -11.426
6 HD2 PHE 0 HD2 PHE 0 -5.678 9.694 -13.923
7 HE1 PHE 0 HE1 PHE 0 -5.305 11.732 -9.462
8 HE2 PHE 0 HE2 PHE 0 -6.604 8.533 -11.960
9 HZ PHE 0 HZ PHE 0 -6.437 9.554 -9.735
No H/Q in entry = 9
In of MODEL 8
1 H HIS 1 H HIS 1 -1.245 10.933 -12.491
2 HA HIS 1 HA HIS 1 -0.879 8.483 -13.960
3 HB2 HIS 1 HB2 HIS 1 0.186 9.518 -11.343
4 HB3 HIS 1 HB3 HIS 1 0.431 7.843 -11.824
5 HD1 HIS 1 HD1 HIS 1 2.380 7.384 -13.311
6 HD2 HIS 1 HD2 HIS 1 1.382 11.418 -13.215
7 HE1 HIS 1 HE1 HIS 1 4.208 8.563 -14.569
8 HE2 HIS 1 HE2 HIS 1 3.660 11.012 -14.367
No H/Q in entry = 8
In of MODEL 8
1 H HIS 2 H HIS 2 -1.634 6.487 -13.454
2 HA HIS 2 HA HIS 2 -4.072 6.466 -11.901
3 HB2 HIS 2 HB2 HIS 2 -2.751 4.286 -13.529
4 HB3 HIS 2 HB3 HIS 2 -4.347 4.178 -12.792
5 HD1 HIS 2 HD1 HIS 2 -2.840 4.859 -15.929
6 HD2 HIS 2 HD2 HIS 2 -6.032 6.496 -13.827
7 HE1 HIS 2 HE1 HIS 2 -4.230 6.065 -17.639
8 HE2 HIS 2 HE2 HIS 2 -6.228 6.921 -16.369
No H/Q in entry = 8
In of MODEL 8
1 H PHE 3 H PHE 3 -4.515 4.825 -10.314
2 HA PHE 3 HA PHE 3 -4.124 3.780 -8.346
3 HB2 PHE 3 HB2 PHE 3 -1.446 3.063 -9.570
4 HB3 PHE 3 HB3 PHE 3 -2.182 2.295 -8.166
5 HD1 PHE 3 HD1 PHE 3 -4.444 1.139 -8.517
6 HD2 PHE 3 HD2 PHE 3 -1.855 2.255 -11.704
7 HE1 PHE 3 HE1 PHE 3 -5.579 -0.463 -9.998
8 HE2 PHE 3 HE2 PHE 3 -2.985 0.655 -13.190
9 HZ PHE 3 HZ PHE 3 -4.851 -0.708 -12.337
No H/Q in entry = 9
In of MODEL 8
1 H THR 4 H THR 4 -3.737 6.473 -8.346
2 HA THR 4 HA THR 4 -1.261 6.994 -6.912
3 HB THR 4 HB THR 4 -2.354 9.378 -6.842
4 HG1 THR 4 HG1 THR 4 -3.533 8.859 -9.247
5 HG21 THR 4 HG21 THR 4 -0.337 8.799 -8.099
6 HG22 THR 4 HG22 THR 4 -1.330 8.155 -9.406
7 HG23 THR 4 HG23 THR 4 -1.375 9.879 -9.028
No H/Q in entry = 7
In of MODEL 8
1 H LEU 5 H LEU 5 -1.594 8.616 -4.989
2 HA LEU 5 HA LEU 5 -2.953 7.053 -3.022
3 HB2 LEU 5 HB2 LEU 5 -1.560 9.709 -2.737
4 HB3 LEU 5 HB3 LEU 5 -2.063 8.668 -1.420
5 HG LEU 5 HG LEU 5 0.064 8.058 -3.470
6 HD11 LEU 5 HD11 LEU 5 0.188 8.600 -0.509
7 HD12 LEU 5 HD12 LEU 5 1.546 8.110 -1.519
8 HD13 LEU 5 HD13 LEU 5 0.759 9.662 -1.796
9 HD21 LEU 5 HD21 LEU 5 -0.972 6.386 -1.180
10 HD22 LEU 5 HD22 LEU 5 -1.136 6.027 -2.899
11 HD23 LEU 5 HD23 LEU 5 0.458 6.021 -2.148
No H/Q in entry = 11
In of MODEL 8
1 H GLU 6 H GLU 6 -3.585 10.171 -4.591
2 HA GLU 6 HA GLU 6 -5.897 10.794 -3.064
3 HB2 GLU 6 HB2 GLU 6 -5.246 11.431 -5.953
4 HB3 GLU 6 HB3 GLU 6 -6.572 12.144 -5.042
5 HG2 GLU 6 HG2 GLU 6 -4.915 13.064 -3.446
6 HG3 GLU 6 HG3 GLU 6 -3.631 12.440 -4.481
No H/Q in entry = 6
In of MODEL 8
1 H SER 7 H SER 7 -5.484 8.863 -6.127
2 HA SER 7 HA SER 7 -8.123 8.110 -6.366
3 HB2 SER 7 HB2 SER 7 -5.642 6.488 -6.940
4 HB3 SER 7 HB3 SER 7 -7.261 6.072 -7.501
5 HG SER 7 HG SER 7 -6.954 8.546 -8.202
No H/Q in entry = 5
In of MODEL 8
1 H SER 8 H SER 8 -5.964 7.250 -3.829
2 HA SER 8 HA SER 8 -7.544 4.898 -3.163
3 HB2 SER 8 HB2 SER 8 -4.959 5.806 -1.917
4 HB3 SER 8 HB3 SER 8 -5.780 4.254 -1.663
5 HG SER 8 HG SER 8 -4.737 5.233 -4.133
No H/Q in entry = 5
In of MODEL 8
1 H LEU 9 H LEU 9 -7.353 8.187 -2.132
2 HA LEU 9 HA LEU 9 -7.174 7.952 0.588
3 HB2 LEU 9 HB2 LEU 9 -8.547 10.052 -1.034
4 HB3 LEU 9 HB3 LEU 9 -8.151 10.208 0.670
5 HG LEU 9 HG LEU 9 -6.113 9.668 -1.473
6 HD11 LEU 9 HD11 LEU 9 -7.228 11.775 -1.843
7 HD12 LEU 9 HD12 LEU 9 -6.872 12.270 -0.186
8 HD13 LEU 9 HD13 LEU 9 -5.558 12.010 -1.334
9 HD21 LEU 9 HD21 LEU 9 -5.874 10.488 1.418
10 HD22 LEU 9 HD22 LEU 9 -5.396 8.940 0.708
11 HD23 LEU 9 HD23 LEU 9 -4.529 10.423 0.276
No H/Q in entry = 11
In of MODEL 8
1 H ASP 10 H ASP 10 -10.125 7.757 -1.240
2 HA ASP 10 HA ASP 10 -11.625 7.380 1.240
3 HB2 ASP 10 HB2 ASP 10 -12.498 7.742 -1.627
4 HB3 ASP 10 HB3 ASP 10 -13.618 7.305 -0.341
No H/Q in entry = 4
In of MODEL 8
1 H THR 11 H THR 11 -9.844 5.476 -0.700
2 HA THR 11 HA THR 11 -11.626 3.190 -0.280
3 HB THR 11 HB THR 11 -10.445 2.153 -2.292
4 HG1 THR 11 HG1 THR 11 -9.997 4.841 -3.068
5 HG21 THR 11 HG21 THR 11 -12.266 4.524 -2.709
6 HG22 THR 11 HG22 THR 11 -11.966 3.247 -3.888
7 HG23 THR 11 HG23 THR 11 -12.773 2.872 -2.365
No H/Q in entry = 7
In of MODEL 8
1 H HIS 12 H HIS 12 -8.499 2.791 -1.660
2 HA HIS 12 HA HIS 12 -7.789 0.849 0.209
3 HB2 HIS 12 HB2 HIS 12 -5.951 2.313 -1.674
4 HB3 HIS 12 HB3 HIS 12 -5.597 0.790 -0.867
5 HD1 HIS 12 HD1 HIS 12 -7.915 -0.946 -1.392
6 HD2 HIS 12 HD2 HIS 12 -6.560 1.769 -4.237
7 HE1 HIS 12 HE1 HIS 12 -8.797 -1.775 -3.595
8 HE2 HIS 12 HE2 HIS 12 -7.908 -0.163 -5.319
No H/Q in entry = 8
In of MODEL 8
1 H LEU 13 H LEU 13 -6.961 4.295 0.149
2 HA LEU 13 HA LEU 13 -5.127 3.794 2.403
3 HB2 LEU 13 HB2 LEU 13 -5.087 5.756 0.175
4 HB3 LEU 13 HB3 LEU 13 -4.430 6.251 1.719
5 HG LEU 13 HG LEU 13 -2.627 5.459 0.348
6 HD11 LEU 13 HD11 LEU 13 -2.634 4.870 2.776
7 HD12 LEU 13 HD12 LEU 13 -3.231 3.275 2.324
8 HD13 LEU 13 HD13 LEU 13 -1.653 3.814 1.764
9 HD21 LEU 13 HD21 LEU 13 -4.217 2.920 0.037
10 HD22 LEU 13 HD22 LEU 13 -3.805 4.078 -1.227
11 HD23 LEU 13 HD23 LEU 13 -2.538 3.127 -0.457
No H/Q in entry = 11
In of MODEL 8
1 H LYS 14 H LYS 14 -8.035 4.150 2.466
2 HA LYS 14 HA LYS 14 -8.591 6.758 3.487
3 HB2 LYS 14 HB2 LYS 14 -10.820 5.989 3.860
4 HB3 LYS 14 HB3 LYS 14 -10.270 5.357 2.323
5 HG2 LYS 14 HG2 LYS 14 -9.793 3.198 3.451
6 HG3 LYS 14 HG3 LYS 14 -10.524 3.858 4.917
7 HD2 LYS 14 HD2 LYS 14 -12.607 4.266 3.645
8 HD3 LYS 14 HD3 LYS 14 -11.867 3.498 2.241
9 HE2 LYS 14 HE2 LYS 14 -13.254 1.889 3.331
10 HE3 LYS 14 HE3 LYS 14 -11.571 1.441 3.600
11 HZ1 LYS 14 HZ1 LYS 14 -13.283 2.891 5.546
12 HZ2 LYS 14 HZ2 LYS 14 -12.914 1.245 5.613
13 HZ3 LYS 14 HZ3 LYS 14 -11.688 2.395 5.805
No H/Q in entry = 13
In of MODEL 8
1 H TRP 15 H TRP 15 -7.205 4.029 4.861
2 HA TRP 15 HA TRP 15 -8.124 4.407 7.548
3 HB2 TRP 15 HB2 TRP 15 -6.329 2.784 8.131
4 HB3 TRP 15 HB3 TRP 15 -7.409 2.198 6.869
5 HD1 TRP 15 HD1 TRP 15 -6.422 1.982 4.409
6 HE1 TRP 15 HE1 TRP 15 -4.008 1.836 3.525
7 HE3 TRP 15 HE3 TRP 15 -3.934 3.595 8.575
8 HZ2 TRP 15 HZ2 TRP 15 -1.393 2.325 4.477
9 HZ3 TRP 15 HZ3 TRP 15 -1.477 3.723 8.506
10 HH2 TRP 15 HH2 TRP 15 -0.235 3.101 6.499
No H/Q in entry = 10
In of MODEL 8
1 H LEU 16 H LEU 16 -5.972 6.055 5.565
2 HA LEU 16 HA LEU 16 -4.128 6.948 7.584
3 HB2 LEU 16 HB2 LEU 16 -4.875 8.201 4.932
4 HB3 LEU 16 HB3 LEU 16 -3.528 8.686 5.938
5 HG LEU 16 HG LEU 16 -3.723 5.925 4.745
6 HD11 LEU 16 HD11 LEU 16 -3.824 7.581 2.954
7 HD12 LEU 16 HD12 LEU 16 -2.385 8.367 3.600
8 HD13 LEU 16 HD13 LEU 16 -2.281 6.731 2.956
9 HD21 LEU 16 HD21 LEU 16 -2.130 6.199 6.593
10 HD22 LEU 16 HD22 LEU 16 -1.296 5.929 5.060
11 HD23 LEU 16 HD23 LEU 16 -1.379 7.552 5.743
No H/Q in entry = 11
In of MODEL 8
1 H SER 17 H SER 17 -4.160 8.905 8.633
2 HA SER 17 HA SER 17 -6.738 10.033 9.186
3 HB2 SER 17 HB2 SER 17 -4.046 11.099 10.038
4 HB3 SER 17 HB3 SER 17 -5.601 11.377 10.815
5 HG SER 17 HG SER 17 -4.179 9.733 11.785
No H/Q in entry = 5
In of MODEL 8
1 H GLN 18 H GLN 18 -7.193 12.414 8.941
2 HA GLN 18 HA GLN 18 -6.845 13.227 6.295
3 HB2 GLN 18 HB2 GLN 18 -8.640 14.106 7.730
4 HB3 GLN 18 HB3 GLN 18 -7.454 14.961 8.704
5 HG2 GLN 18 HG2 GLN 18 -8.636 16.420 7.116
6 HG3 GLN 18 HG3 GLN 18 -6.892 16.396 6.864
7 HE21 GLN 18 HE21 GLN 18 -7.102 17.099 4.748
8 HE22 GLN 18 HE22 GLN 18 -7.675 16.068 3.485
No H/Q in entry = 8
In of MODEL 8
1 H GLU 19 H GLU 19 -5.087 14.221 9.209
2 HA GLU 19 HA GLU 19 -3.390 16.068 7.998
3 HB2 GLU 19 HB2 GLU 19 -3.044 14.282 10.406
4 HB3 GLU 19 HB3 GLU 19 -1.897 15.513 9.951
5 HG2 GLU 19 HG2 GLU 19 -3.689 17.203 10.135
6 HG3 GLU 19 HG3 GLU 19 -4.755 15.932 10.732
No H/Q in entry = 6
In of MODEL 8
1 H GLN 20 H GLN 20 -3.247 12.550 8.155
2 HA GLN 20 HA GLN 20 -0.575 12.403 7.124
3 HB2 GLN 20 HB2 GLN 20 -2.747 10.301 7.274
4 HB3 GLN 20 HB3 GLN 20 -1.086 9.994 6.782
5 HG2 GLN 20 HG2 GLN 20 -0.286 10.667 8.968
6 HG3 GLN 20 HG3 GLN 20 -1.928 11.064 9.466
7 HE21 GLN 20 HE21 GLN 20 -1.118 8.258 7.535
8 HE22 GLN 20 HE22 GLN 20 -1.474 7.089 8.754
No H/Q in entry = 8
In of MODEL 8
1 H LYS 21 H LYS 21 -3.844 12.128 5.755
2 HA LYS 21 HA LYS 21 -3.117 11.595 3.107
3 HB2 LYS 21 HB2 LYS 21 -5.457 13.210 4.143
4 HB3 LYS 21 HB3 LYS 21 -5.306 12.592 2.504
5 HG2 LYS 21 HG2 LYS 21 -5.315 10.304 3.368
6 HG3 LYS 21 HG3 LYS 21 -5.473 10.930 5.010
7 HD2 LYS 21 HD2 LYS 21 -7.609 11.936 4.447
8 HD3 LYS 21 HD3 LYS 21 -7.444 11.402 2.774
9 HE2 LYS 21 HE2 LYS 21 -7.517 9.087 3.472
10 HE3 LYS 21 HE3 LYS 21 -7.574 9.571 5.165
11 HZ1 LYS 21 HZ1 LYS 21 -9.703 10.641 4.743
12 HZ2 LYS 21 HZ2 LYS 21 -9.648 10.159 3.123
13 HZ3 LYS 21 HZ3 LYS 21 -9.766 9.000 4.346
No H/Q in entry = 13
In of MODEL 8
1 H ASP 22 H ASP 22 -3.822 14.724 4.639
2 HA ASP 22 HA ASP 22 -3.145 16.352 2.438
3 HB2 ASP 22 HB2 ASP 22 -4.421 17.080 4.475
4 HB3 ASP 22 HB3 ASP 22 -2.915 17.033 5.379
No H/Q in entry = 4
In of MODEL 8
1 H GLU 23 H GLU 23 -1.158 14.859 4.961
2 HA GLU 23 HA GLU 23 1.185 16.327 4.304
3 HB2 GLU 23 HB2 GLU 23 1.490 15.451 6.355
4 HB3 GLU 23 HB3 GLU 23 0.426 14.088 6.047
5 HG2 GLU 23 HG2 GLU 23 2.117 12.873 5.004
6 HG3 GLU 23 HG3 GLU 23 3.177 14.277 4.899
No H/Q in entry = 6
In of MODEL 8
1 H LEU 24 H LEU 24 -0.101 13.151 3.248
2 HA LEU 24 HA LEU 24 2.151 12.563 1.623
3 HB2 LEU 24 HB2 LEU 24 -0.697 11.591 1.344
4 HB3 LEU 24 HB3 LEU 24 0.707 10.884 0.568
5 HG LEU 24 HG LEU 24 0.160 10.943 3.539
6 HD11 LEU 24 HD11 LEU 24 -1.214 9.359 2.277
7 HD12 LEU 24 HD12 LEU 24 0.248 8.643 1.603
8 HD13 LEU 24 HD13 LEU 24 -0.057 8.550 3.337
9 HD21 LEU 24 HD21 LEU 24 2.482 9.787 2.008
10 HD22 LEU 24 HD22 LEU 24 2.534 11.133 3.149
11 HD23 LEU 24 HD23 LEU 24 2.142 9.508 3.719
No H/Q in entry = 11
In of MODEL 8
1 H LEU 25 H LEU 25 -1.072 13.912 0.800
2 HA LEU 25 HA LEU 25 -0.655 14.680 -1.774
3 HB2 LEU 25 HB2 LEU 25 -2.164 15.857 0.514
4 HB3 LEU 25 HB3 LEU 25 -2.094 16.727 -1.007
5 HG LEU 25 HG LEU 25 -3.054 14.809 -2.140
6 HD11 LEU 25 HD11 LEU 25 -2.240 13.021 -0.748
7 HD12 LEU 25 HD12 LEU 25 -3.321 13.538 0.546
8 HD13 LEU 25 HD13 LEU 25 -3.983 12.926 -0.968
9 HD21 LEU 25 HD21 LEU 25 -4.533 16.547 -1.324
10 HD22 LEU 25 HD22 LEU 25 -5.320 14.972 -1.242
11 HD23 LEU 25 HD23 LEU 25 -4.668 15.708 0.223
No H/Q in entry = 11
In of MODEL 8
1 H LYS 26 H LYS 26 0.440 16.364 1.156
2 HA LYS 26 HA LYS 26 1.525 18.624 -0.141
3 HB2 LYS 26 HB2 LYS 26 1.052 18.455 2.298
4 HB3 LYS 26 HB3 LYS 26 2.416 17.357 2.448
5 HG2 LYS 26 HG2 LYS 26 3.926 19.119 1.702
6 HG3 LYS 26 HG3 LYS 26 2.558 20.222 1.532
7 HD2 LYS 26 HD2 LYS 26 3.741 20.601 3.636
8 HD3 LYS 26 HD3 LYS 26 2.098 20.024 3.925
9 HE2 LYS 26 HE2 LYS 26 2.898 17.805 4.376
10 HE3 LYS 26 HE3 LYS 26 4.538 18.257 3.920
11 HZ1 LYS 26 HZ1 LYS 26 3.044 19.409 6.214
12 HZ2 LYS 26 HZ2 LYS 26 4.204 18.189 6.335
13 HZ3 LYS 26 HZ3 LYS 26 4.654 19.725 5.805
No H/Q in entry = 13
In of MODEL 8
1 H MET 27 H MET 27 2.994 15.609 0.979
2 HA MET 27 HA MET 27 5.531 15.939 0.061
3 HB2 MET 27 HB2 MET 27 3.846 13.437 0.091
4 HB3 MET 27 HB3 MET 27 5.583 13.439 -0.175
5 HG2 MET 27 HG2 MET 27 4.515 14.774 2.253
6 HG3 MET 27 HG3 MET 27 4.546 13.018 2.196
7 HE1 MET 27 HE1 MET 27 6.638 11.568 2.010
8 HE2 MET 27 HE2 MET 27 7.145 12.362 0.519
9 HE3 MET 27 HE3 MET 27 8.289 12.176 1.850
No H/Q in entry = 9
In of MODEL 8
1 H LYS 28 H LYS 28 2.844 14.453 -1.753
2 HA LYS 28 HA LYS 28 4.195 13.996 -4.141
3 HB2 LYS 28 HB2 LYS 28 1.405 14.112 -3.207
4 HB3 LYS 28 HB3 LYS 28 1.609 14.425 -4.918
5 HG2 LYS 28 HG2 LYS 28 2.835 12.024 -3.613
6 HG3 LYS 28 HG3 LYS 28 1.162 12.021 -4.174
7 HD2 LYS 28 HD2 LYS 28 3.543 12.685 -5.905
8 HD3 LYS 28 HD3 LYS 28 2.776 11.097 -5.828
9 HE2 LYS 28 HE2 LYS 28 0.682 12.041 -6.619
10 HE3 LYS 28 HE3 LYS 28 1.384 13.656 -6.620
11 HZ1 LYS 28 HZ1 LYS 28 2.963 12.910 -8.309
12 HZ2 LYS 28 HZ2 LYS 28 2.232 11.386 -8.334
13 HZ3 LYS 28 HZ3 LYS 28 1.365 12.749 -8.835
No H/Q in entry = 13
In of MODEL 8
1 H LYS 29 H LYS 29 2.329 16.826 -3.087
2 HA LYS 29 HA LYS 29 2.621 18.196 -5.559
3 HB2 LYS 29 HB2 LYS 29 1.868 19.213 -2.821
4 HB3 LYS 29 HB3 LYS 29 1.823 20.193 -4.278
5 HG2 LYS 29 HG2 LYS 29 0.194 17.718 -3.736
6 HG3 LYS 29 HG3 LYS 29 -0.389 19.382 -3.738
7 HD2 LYS 29 HD2 LYS 29 0.710 17.867 -6.109
8 HD3 LYS 29 HD3 LYS 29 -0.984 18.255 -5.813
9 HE2 LYS 29 HE2 LYS 29 -0.445 20.647 -5.933
10 HE3 LYS 29 HE3 LYS 29 1.239 20.244 -6.256
11 HZ1 LYS 29 HZ1 LYS 29 0.505 19.094 -8.278
12 HZ2 LYS 29 HZ2 LYS 29 -1.083 19.589 -7.981
13 HZ3 LYS 29 HZ3 LYS 29 0.115 20.738 -8.300
No H/Q in entry = 13
In of MODEL 8
1 H ASP 30 H ASP 30 4.618 18.045 -2.691
2 HA ASP 30 HA ASP 30 6.114 20.379 -3.510
3 HB2 ASP 30 HB2 ASP 30 5.739 19.888 -1.099
4 HB3 ASP 30 HB3 ASP 30 6.702 18.424 -1.267
No H/Q in entry = 4
In of MODEL 8
1 H GLY 31 H GLY 31 6.021 17.281 -4.489
2 HA2 GLY 31 HA2 GLY 31 8.532 17.688 -5.901
3 HA3 GLY 31 HA3 GLY 31 7.278 16.531 -6.318
No H/Q in entry = 3
In of MODEL 8
1 H LYS 32 H LYS 32 7.301 15.764 -3.354
2 HA LYS 32 HA LYS 32 9.740 14.370 -2.975
3 HB2 LYS 32 HB2 LYS 32 6.988 13.762 -1.873
4 HB3 LYS 32 HB3 LYS 32 8.492 13.059 -1.302
5 HG2 LYS 32 HG2 LYS 32 7.709 15.961 -1.137
6 HG3 LYS 32 HG3 LYS 32 7.730 14.803 0.193
7 HD2 LYS 32 HD2 LYS 32 10.206 14.504 -0.318
8 HD3 LYS 32 HD3 LYS 32 10.058 15.942 -1.332
9 HE2 LYS 32 HE2 LYS 32 9.499 15.741 1.624
10 HE3 LYS 32 HE3 LYS 32 10.849 16.575 0.858
11 HZ1 LYS 32 HZ1 LYS 32 7.986 17.303 0.582
12 HZ2 LYS 32 HZ2 LYS 32 9.123 18.113 1.532
13 HZ3 LYS 32 HZ3 LYS 32 9.278 18.115 -0.153
No H/Q in entry = 13
In of MODEL 8
1 H ALA 33 H ALA 33 10.210 12.270 -3.462
2 HA ALA 33 HA ALA 33 9.092 11.289 -5.910
3 HB1 ALA 33 HB1 ALA 33 11.481 11.027 -5.332
4 HB2 ALA 33 HB2 ALA 33 10.708 9.491 -5.719
5 HB3 ALA 33 HB3 ALA 33 11.023 9.918 -4.037
No H/Q in entry = 5
In of MODEL 8
1 H LYS 34 H LYS 34 7.895 9.340 -6.229
2 HA LYS 34 HA LYS 34 5.846 8.782 -4.458
3 HB2 LYS 34 HB2 LYS 34 5.825 8.076 -6.796
4 HB3 LYS 34 HB3 LYS 34 7.093 6.904 -6.465
5 HG2 LYS 34 HG2 LYS 34 5.620 5.662 -5.012
6 HG3 LYS 34 HG3 LYS 34 4.356 6.876 -5.208
7 HD2 LYS 34 HD2 LYS 34 4.035 4.833 -6.603
8 HD3 LYS 34 HD3 LYS 34 4.103 6.334 -7.527
9 HE2 LYS 34 HE2 LYS 34 6.246 5.876 -8.335
10 HE3 LYS 34 HE3 LYS 34 6.557 4.669 -7.088
11 HZ1 LYS 34 HZ1 LYS 34 4.517 4.332 -9.210
12 HZ2 LYS 34 HZ2 LYS 34 6.101 3.747 -9.335
13 HZ3 LYS 34 HZ3 LYS 34 5.076 3.162 -8.115
No H/Q in entry = 13
In of MODEL 8
1 H LYS 35 H LYS 35 9.057 7.367 -4.642
2 HA LYS 35 HA LYS 35 8.748 5.232 -2.867
3 HB2 LYS 35 HB2 LYS 35 10.709 5.780 -4.388
4 HB3 LYS 35 HB3 LYS 35 11.234 6.918 -3.160
5 HG2 LYS 35 HG2 LYS 35 10.758 4.051 -2.461
6 HG3 LYS 35 HG3 LYS 35 12.258 4.544 -3.240
7 HD2 LYS 35 HD2 LYS 35 11.183 5.656 -0.648
8 HD3 LYS 35 HD3 LYS 35 12.457 4.444 -0.786
9 HE2 LYS 35 HE2 LYS 35 13.763 6.109 -2.130
10 HE3 LYS 35 HE3 LYS 35 12.533 7.306 -1.733
11 HZ1 LYS 35 HZ1 LYS 35 13.023 6.946 0.620
12 HZ2 LYS 35 HZ2 LYS 35 14.240 5.848 0.208
13 HZ3 LYS 35 HZ3 LYS 35 14.387 7.475 -0.227
No H/Q in entry = 13
In of MODEL 8
1 H GLU 36 H GLU 36 8.871 8.651 -2.247
2 HA GLU 36 HA GLU 36 9.651 8.332 0.529
3 HB2 GLU 36 HB2 GLU 36 8.761 10.828 -0.921
4 HB3 GLU 36 HB3 GLU 36 9.591 10.746 0.626
5 HG2 GLU 36 HG2 GLU 36 11.527 9.722 -0.528
6 HG3 GLU 36 HG3 GLU 36 10.694 9.964 -2.053
No H/Q in entry = 6
In of MODEL 8
1 H LEU 37 H LEU 37 6.856 8.862 -1.443
2 HA LEU 37 HA LEU 37 4.961 9.185 0.608
3 HB2 LEU 37 HB2 LEU 37 4.847 8.150 -2.216
4 HB3 LEU 37 HB3 LEU 37 3.421 8.335 -1.220
5 HG LEU 37 HG LEU 37 3.835 10.162 -2.841
6 HD11 LEU 37 HD11 LEU 37 2.415 10.444 -0.873
7 HD12 LEU 37 HD12 LEU 37 3.828 10.962 0.046
8 HD13 LEU 37 HD13 LEU 37 3.244 11.941 -1.298
9 HD21 LEU 37 HD21 LEU 37 6.235 10.377 -2.704
10 HD22 LEU 37 HD22 LEU 37 5.440 11.906 -2.329
11 HD23 LEU 37 HD23 LEU 37 6.095 10.910 -1.028
No H/Q in entry = 11
In of MODEL 8
1 H GLU 38 H GLU 38 6.159 6.398 -1.180
2 HA GLU 38 HA GLU 38 4.621 4.413 0.113
3 HB2 GLU 38 HB2 GLU 38 5.572 3.878 -1.971
4 HB3 GLU 38 HB3 GLU 38 7.178 4.393 -1.473
5 HG2 GLU 38 HG2 GLU 38 7.291 2.076 -1.528
6 HG3 GLU 38 HG3 GLU 38 7.104 2.463 0.177
No H/Q in entry = 6
In of MODEL 8
1 H ALA 39 H ALA 39 7.221 6.288 1.113
2 HA ALA 39 HA ALA 39 8.185 4.367 3.067
3 HB1 ALA 39 HB1 ALA 39 9.062 7.217 2.595
4 HB2 ALA 39 HB2 ALA 39 9.876 6.012 3.594
5 HB3 ALA 39 HB3 ALA 39 9.781 5.790 1.847
No H/Q in entry = 5
In of MODEL 8
1 H LYS 40 H LYS 40 6.558 7.511 3.036
2 HA LYS 40 HA LYS 40 6.075 7.777 5.758
3 HB2 LYS 40 HB2 LYS 40 4.468 8.544 3.323
4 HB3 LYS 40 HB3 LYS 40 3.968 8.963 4.948
5 HG2 LYS 40 HG2 LYS 40 6.648 9.738 3.885
6 HG3 LYS 40 HG3 LYS 40 5.214 10.720 3.599
7 HD2 LYS 40 HD2 LYS 40 4.867 10.859 6.040
8 HD3 LYS 40 HD3 LYS 40 6.359 9.948 6.281
9 HE2 LYS 40 HE2 LYS 40 7.655 11.694 5.272
10 HE3 LYS 40 HE3 LYS 40 6.200 12.567 4.798
11 HZ1 LYS 40 HZ1 LYS 40 6.994 12.036 7.609
12 HZ2 LYS 40 HZ2 LYS 40 7.290 13.484 6.790
13 HZ3 LYS 40 HZ3 LYS 40 5.696 12.990 7.087
No H/Q in entry = 13
In of MODEL 8
1 H ILE 41 H ILE 41 4.068 6.256 3.242
2 HA ILE 41 HA ILE 41 1.989 5.412 4.886
3 HB ILE 41 HB ILE 41 2.992 4.177 2.320
4 HG12 ILE 41 HG12 ILE 41 0.756 6.161 2.761
5 HG13 ILE 41 HG13 ILE 41 2.381 6.616 2.263
6 HG21 ILE 41 HG21 ILE 41 1.534 2.654 3.543
7 HG22 ILE 41 HG22 ILE 41 0.318 3.922 3.689
8 HG23 ILE 41 HG23 ILE 41 0.727 3.272 2.102
9 HD11 ILE 41 HD11 ILE 41 2.130 5.274 0.241
10 HD12 ILE 41 HD12 ILE 41 0.494 4.841 0.746
11 HD13 ILE 41 HD13 ILE 41 0.883 6.518 0.372
No H/Q in entry = 11
In of MODEL 8
1 H LEU 42 H LEU 42 4.828 3.553 3.747
2 HA LEU 42 HA LEU 42 4.198 1.191 5.107
3 HB2 LEU 42 HB2 LEU 42 6.825 2.334 4.208
4 HB3 LEU 42 HB3 LEU 42 6.718 0.783 5.008
5 HG LEU 42 HG LEU 42 5.598 1.562 2.330
6 HD11 LEU 42 HD11 LEU 42 7.586 -0.513 3.223
7 HD12 LEU 42 HD12 LEU 42 6.982 -0.338 1.576
8 HD13 LEU 42 HD13 LEU 42 7.924 0.962 2.313
9 HD21 LEU 42 HD21 LEU 42 5.074 -0.944 3.931
10 HD22 LEU 42 HD22 LEU 42 3.881 0.241 3.393
11 HD23 LEU 42 HD23 LEU 42 4.725 -0.767 2.213
No H/Q in entry = 11
In of MODEL 8
1 H HIS 43 H HIS 43 5.938 4.053 6.155
2 HA HIS 43 HA HIS 43 6.775 3.087 8.672
3 HB2 HIS 43 HB2 HIS 43 7.555 5.201 7.530
4 HB3 HIS 43 HB3 HIS 43 6.022 5.936 7.977
5 HD1 HIS 43 HD1 HIS 43 9.360 5.055 9.294
6 HD2 HIS 43 HD2 HIS 43 5.728 6.435 10.774
7 HE1 HIS 43 HE1 HIS 43 9.855 5.921 11.598
8 HE2 HIS 43 HE2 HIS 43 7.622 6.614 12.527
No H/Q in entry = 8
In of MODEL 8
1 H TYR 44 H TYR 44 3.810 4.788 7.636
2 HA TYR 44 HA TYR 44 2.623 4.884 10.211
3 HB2 TYR 44 HB2 TYR 44 1.321 4.946 7.474
4 HB3 TYR 44 HB3 TYR 44 0.542 5.414 8.982
5 HD1 TYR 44 HD1 TYR 44 2.890 6.879 10.235
6 HD2 TYR 44 HD2 TYR 44 1.242 6.963 6.315
7 HE1 TYR 44 HE1 TYR 44 3.688 9.196 9.961
8 HE2 TYR 44 HE2 TYR 44 2.023 9.252 6.021
9 HH TYR 44 HH TYR 44 4.278 10.722 7.952
No H/Q in entry = 9
In of MODEL 8
1 H TYR 45 H TYR 45 2.430 2.667 7.517
2 HA TYR 45 HA TYR 45 0.442 0.933 8.398
3 HB2 TYR 45 HB2 TYR 45 1.261 0.933 6.113
4 HB3 TYR 45 HB3 TYR 45 2.873 0.497 6.658
5 HD1 TYR 45 HD1 TYR 45 -0.597 -0.771 6.415
6 HD2 TYR 45 HD2 TYR 45 3.520 -1.692 6.885
7 HE1 TYR 45 HE1 TYR 45 -1.100 -3.157 6.094
8 HE2 TYR 45 HE2 TYR 45 3.035 -4.071 6.572
9 HH TYR 45 HH TYR 45 0.073 -5.205 5.386
No H/Q in entry = 9
In of MODEL 8
1 H ASP 46 H ASP 46 3.933 0.922 8.970
2 HA ASP 46 HA ASP 46 3.797 -1.665 10.225
3 HB2 ASP 46 HB2 ASP 46 5.731 -0.546 8.808
4 HB3 ASP 46 HB3 ASP 46 6.229 0.080 10.374
No H/Q in entry = 4
In of MODEL 8
1 H GLU 47 H GLU 47 3.358 1.529 11.270
2 HA GLU 47 HA GLU 47 3.951 0.853 14.048
3 HB2 GLU 47 HB2 GLU 47 3.107 3.429 12.733
4 HB3 GLU 47 HB3 GLU 47 3.263 3.234 14.468
5 HG2 GLU 47 HG2 GLU 47 5.659 2.562 14.047
6 HG3 GLU 47 HG3 GLU 47 5.422 3.126 12.393
No H/Q in entry = 6
In of MODEL 8
1 H LEU 48 H LEU 48 1.559 0.032 12.136
2 HA LEU 48 HA LEU 48 -0.755 1.074 13.388
3 HB2 LEU 48 HB2 LEU 48 -0.211 -1.152 11.470
4 HB3 LEU 48 HB3 LEU 48 -1.820 -0.890 12.101
5 HG LEU 48 HG LEU 48 -0.216 1.130 10.549
6 HD11 LEU 48 HD11 LEU 48 -1.006 -0.781 9.212
7 HD12 LEU 48 HD12 LEU 48 -2.651 -0.453 9.760
8 HD13 LEU 48 HD13 LEU 48 -1.798 0.734 8.774
9 HD21 LEU 48 HD21 LEU 48 -2.966 1.188 11.762
10 HD22 LEU 48 HD22 LEU 48 -1.621 2.286 12.065
11 HD23 LEU 48 HD23 LEU 48 -2.442 2.310 10.503
No H/Q in entry = 11
In of MODEL 8
1 H GLU 49 H GLU 49 -2.194 -1.407 13.624
2 HA GLU 49 HA GLU 49 -1.330 -2.676 15.969
3 HB2 GLU 49 HB2 GLU 49 -2.932 -1.415 17.529
4 HB3 GLU 49 HB3 GLU 49 -1.391 -0.663 17.141
5 HG2 GLU 49 HG2 GLU 49 -2.528 0.694 15.426
6 HG3 GLU 49 HG3 GLU 49 -4.064 -0.017 15.920
No H/Q in entry = 6
In of MODEL 8
1 H GLY 50 H GLY 50 -2.362 -4.515 15.752
2 HA2 GLY 50 HA2 GLY 50 -4.980 -4.849 16.531
3 HA3 GLY 50 HA3 GLY 50 -4.051 -6.056 15.663
No H/Q in entry = 3
In of MODEL 8
1 H ASP 51 H ASP 51 -6.775 -4.184 15.615
2 HA ASP 51 HA ASP 51 -7.636 -5.228 13.115
3 HB2 ASP 51 HB2 ASP 51 -9.182 -4.787 14.978
4 HB3 ASP 51 HB3 ASP 51 -8.869 -3.060 14.834
No H/Q in entry = 4
In of MODEL 8
1 H ALA 52 H ALA 52 -6.362 -2.093 14.139
2 HA ALA 52 HA ALA 52 -6.934 -0.658 11.776
3 HB1 ALA 52 HB1 ALA 52 -4.590 -0.361 13.667
4 HB2 ALA 52 HB2 ALA 52 -5.062 0.809 12.431
5 HB3 ALA 52 HB3 ALA 52 -6.142 0.471 13.783
No H/Q in entry = 5
In of MODEL 8
1 H LYS 53 H LYS 53 -4.269 -2.693 12.757
2 HA LYS 53 HA LYS 53 -2.659 -2.347 10.453
3 HB2 LYS 53 HB2 LYS 53 -2.176 -3.362 12.866
4 HB3 LYS 53 HB3 LYS 53 -2.578 -4.869 12.059
5 HG2 LYS 53 HG2 LYS 53 -0.481 -2.988 11.021
6 HG3 LYS 53 HG3 LYS 53 -0.130 -4.259 12.186
7 HD2 LYS 53 HD2 LYS 53 -0.938 -5.933 10.596
8 HD3 LYS 53 HD3 LYS 53 -1.301 -4.654 9.436
9 HE2 LYS 53 HE2 LYS 53 1.051 -4.049 9.331
10 HE3 LYS 53 HE3 LYS 53 1.437 -5.259 10.547
11 HZ1 LYS 53 HZ1 LYS 53 0.614 -6.963 9.000
12 HZ2 LYS 53 HZ2 LYS 53 0.387 -5.772 7.820
13 HZ3 LYS 53 HZ3 LYS 53 1.944 -6.119 8.392
No H/Q in entry = 13
In of MODEL 8
1 H LYS 54 H LYS 54 -4.777 -4.981 11.523
2 HA LYS 54 HA LYS 54 -4.722 -6.586 9.287
3 HB2 LYS 54 HB2 LYS 54 -6.052 -7.752 10.605
4 HB3 LYS 54 HB3 LYS 54 -6.271 -6.353 11.643
5 HG2 LYS 54 HG2 LYS 54 -8.211 -5.682 10.493
6 HG3 LYS 54 HG3 LYS 54 -7.907 -6.812 9.169
7 HD2 LYS 54 HD2 LYS 54 -8.144 -8.668 10.787
8 HD3 LYS 54 HD3 LYS 54 -8.601 -7.491 12.017
9 HE2 LYS 54 HE2 LYS 54 -10.067 -8.144 9.466
10 HE3 LYS 54 HE3 LYS 54 -10.607 -8.446 11.115
11 HZ1 LYS 54 HZ1 LYS 54 -10.543 -5.970 11.427
12 HZ2 LYS 54 HZ2 LYS 54 -10.321 -5.832 9.755
13 HZ3 LYS 54 HZ3 LYS 54 -11.734 -6.536 10.364
No H/Q in entry = 13
In of MODEL 8
1 H GLU 55 H GLU 55 -6.920 -3.823 9.898
2 HA GLU 55 HA GLU 55 -8.307 -4.074 7.474
3 HB2 GLU 55 HB2 GLU 55 -8.063 -2.044 9.613
4 HB3 GLU 55 HB3 GLU 55 -8.511 -1.404 8.042
5 HG2 GLU 55 HG2 GLU 55 -10.222 -3.456 8.205
6 HG3 GLU 55 HG3 GLU 55 -10.032 -3.079 9.914
No H/Q in entry = 6
In of MODEL 8
1 H ALA 56 H ALA 56 -5.560 -1.951 8.353
2 HA ALA 56 HA ALA 56 -5.460 -0.746 5.836
3 HB1 ALA 56 HB1 ALA 56 -3.171 -0.089 6.386
4 HB2 ALA 56 HB2 ALA 56 -3.147 -1.254 7.710
5 HB3 ALA 56 HB3 ALA 56 -4.235 0.132 7.775
No H/Q in entry = 5
In of MODEL 8
1 H THR 57 H THR 57 -3.681 -3.550 7.110
2 HA THR 57 HA THR 57 -2.182 -4.249 4.930
3 HB THR 57 HB THR 57 -3.637 -6.125 6.804
4 HG1 THR 57 HG1 THR 57 -2.379 -4.808 8.038
5 HG21 THR 57 HG21 THR 57 -1.194 -6.526 5.081
6 HG22 THR 57 HG22 THR 57 -1.768 -7.661 6.307
7 HG23 THR 57 HG23 THR 57 -2.761 -7.312 4.893
No H/Q in entry = 7
In of MODEL 8
1 H GLU 58 H GLU 58 -5.519 -5.203 5.636
2 HA GLU 58 HA GLU 58 -5.934 -6.710 3.272
3 HB2 GLU 58 HB2 GLU 58 -7.781 -5.447 5.277
4 HB3 GLU 58 HB3 GLU 58 -8.396 -6.275 3.849
5 HG2 GLU 58 HG2 GLU 58 -7.035 -8.268 4.587
6 HG3 GLU 58 HG3 GLU 58 -6.788 -7.415 6.109
No H/Q in entry = 6
In of MODEL 8
1 H HIS 59 H HIS 59 -6.184 -3.260 3.917
2 HA HIS 59 HA HIS 59 -7.712 -2.781 1.522
3 HB2 HIS 59 HB2 HIS 59 -6.316 -0.883 3.420
4 HB3 HIS 59 HB3 HIS 59 -7.234 -0.356 2.014
5 HD1 HIS 59 HD1 HIS 59 -9.646 -2.319 2.343
6 HD2 HIS 59 HD2 HIS 59 -8.006 -0.020 5.393
7 HE1 HIS 59 HE1 HIS 59 -11.459 -2.091 4.067
8 HE2 HIS 59 HE2 HIS 59 -10.361 -0.911 6.005
No H/Q in entry = 8
In of MODEL 8
1 H LEU 60 H LEU 60 -4.350 -2.193 2.552
2 HA LEU 60 HA LEU 60 -3.333 -1.466 0.104
3 HB2 LEU 60 HB2 LEU 60 -2.172 -2.787 2.515
4 HB3 LEU 60 HB3 LEU 60 -1.195 -2.563 1.075
5 HG LEU 60 HG LEU 60 -1.815 -0.145 1.183
6 HD11 LEU 60 HD11 LEU 60 -3.741 -0.295 2.561
7 HD12 LEU 60 HD12 LEU 60 -2.751 -0.836 3.918
8 HD13 LEU 60 HD13 LEU 60 -2.543 0.795 3.269
9 HD21 LEU 60 HD21 LEU 60 -0.226 -1.268 3.471
10 HD22 LEU 60 HD22 LEU 60 0.386 -0.913 1.856
11 HD23 LEU 60 HD23 LEU 60 -0.152 0.400 2.904
No H/Q in entry = 11
In of MODEL 8
1 H LYS 61 H LYS 61 -4.132 -4.678 1.354
2 HA LYS 61 HA LYS 61 -2.866 -6.223 -0.614
3 HB2 LYS 61 HB2 LYS 61 -5.310 -6.637 1.077
4 HB3 LYS 61 HB3 LYS 61 -4.940 -7.774 -0.207
5 HG2 LYS 61 HG2 LYS 61 -2.768 -8.230 0.829
6 HG3 LYS 61 HG3 LYS 61 -3.159 -7.099 2.129
7 HD2 LYS 61 HD2 LYS 61 -5.053 -8.467 2.787
8 HD3 LYS 61 HD3 LYS 61 -4.760 -9.564 1.439
9 HE2 LYS 61 HE2 LYS 61 -2.599 -10.175 2.398
10 HE3 LYS 61 HE3 LYS 61 -2.873 -9.060 3.738
11 HZ1 LYS 61 HZ1 LYS 61 -4.613 -11.381 3.112
12 HZ2 LYS 61 HZ2 LYS 61 -3.392 -11.399 4.276
13 HZ3 LYS 61 HZ3 LYS 61 -4.723 -10.377 4.465
No H/Q in entry = 13
In of MODEL 8
1 H GLY 62 H GLY 62 -6.220 -5.038 -0.483
2 HA2 GLY 62 HA2 GLY 62 -7.692 -4.471 -2.142
3 HA3 GLY 62 HA3 GLY 62 -6.939 -5.737 -3.098
No H/Q in entry = 3
In of MODEL 8
1 H GLY 63 H GLY 63 -5.461 -2.763 -1.840
2 HA2 GLY 63 HA2 GLY 63 -4.225 -1.159 -2.914
3 HA3 GLY 63 HA3 GLY 63 -5.464 -1.237 -4.156
No H/Q in entry = 3
In of MODEL 8
1 H CYS 64 H CYS 64 -2.844 -3.375 -3.044
2 HA CYS 64 HA CYS 64 -1.388 -3.136 -5.473
3 HB2 CYS 64 HB2 CYS 64 -0.361 -3.721 -3.291
4 HB3 CYS 64 HB3 CYS 64 -1.181 -5.281 -3.350
No H/Q in entry = 4
In of MODEL 8
1 H ARG 65 H ARG 65 -3.964 -5.170 -4.396
2 HA ARG 65 HA ARG 65 -3.788 -7.247 -6.280
3 HB2 ARG 65 HB2 ARG 65 -5.264 -7.234 -4.274
4 HB3 ARG 65 HB3 ARG 65 -6.269 -6.022 -5.049
5 HG2 ARG 65 HG2 ARG 65 -5.815 -8.672 -6.356
6 HG3 ARG 65 HG3 ARG 65 -7.006 -8.491 -5.070
7 HD2 ARG 65 HD2 ARG 65 -8.032 -6.634 -6.394
8 HD3 ARG 65 HD3 ARG 65 -6.930 -7.038 -7.708
9 HE ARG 65 HE ARG 65 -9.218 -8.593 -6.786
10 HH11 ARG 65 HH11 ARG 65 -6.415 -8.399 -8.873
11 HH12 ARG 65 HH12 ARG 65 -6.999 -9.601 -9.980
12 HH21 ARG 65 HH21 ARG 65 -9.999 -10.156 -8.247
13 HH22 ARG 65 HH22 ARG 65 -9.043 -10.603 -9.623
No H/Q in entry = 13
In of MODEL 8
1 H GLU 66 H GLU 66 -5.234 -4.020 -6.431
2 HA GLU 66 HA GLU 66 -6.193 -4.375 -9.112
3 HB2 GLU 66 HB2 GLU 66 -5.763 -1.835 -7.528
4 HB3 GLU 66 HB3 GLU 66 -6.586 -1.936 -9.077
5 HG2 GLU 66 HG2 GLU 66 -8.187 -3.551 -7.950
6 HG3 GLU 66 HG3 GLU 66 -7.469 -3.026 -6.427
No H/Q in entry = 6
In of MODEL 8
1 H ILE 67 H ILE 67 -3.233 -3.281 -7.618
2 HA ILE 67 HA ILE 67 -2.043 -2.203 -9.955
3 HB ILE 67 HB ILE 67 -0.762 -3.425 -7.507
4 HG12 ILE 67 HG12 ILE 67 -1.163 -0.550 -8.373
5 HG13 ILE 67 HG13 ILE 67 -2.062 -1.378 -7.106
6 HG21 ILE 67 HG21 ILE 67 0.766 -3.589 -9.418
7 HG22 ILE 67 HG22 ILE 67 0.548 -1.868 -9.742
8 HG23 ILE 67 HG23 ILE 67 1.331 -2.391 -8.252
9 HD11 ILE 67 HD11 ILE 67 -0.011 -1.611 -5.807
10 HD12 ILE 67 HD12 ILE 67 0.884 -0.776 -7.077
11 HD13 ILE 67 HD13 ILE 67 -0.367 0.077 -6.175
No H/Q in entry = 11
In of MODEL 8
1 H LEU 68 H LEU 68 -2.088 -5.455 -8.543
2 HA LEU 68 HA LEU 68 -0.460 -6.682 -10.489
3 HB2 LEU 68 HB2 LEU 68 -1.161 -7.650 -8.272
4 HB3 LEU 68 HB3 LEU 68 -2.736 -7.967 -8.979
5 HG LEU 68 HG LEU 68 -1.734 -9.480 -10.604
6 HD11 LEU 68 HD11 LEU 68 0.419 -8.335 -10.836
7 HD12 LEU 68 HD12 LEU 68 0.869 -8.865 -9.214
8 HD13 LEU 68 HD13 LEU 68 0.625 -10.053 -10.495
9 HD21 LEU 68 HD21 LEU 68 -0.858 -10.048 -7.774
10 HD22 LEU 68 HD22 LEU 68 -2.446 -10.397 -8.461
11 HD23 LEU 68 HD23 LEU 68 -1.017 -11.244 -9.061
No H/Q in entry = 11
In of MODEL 8
1 H LYS 69 H LYS 69 -3.762 -5.690 -10.459
2 HA LYS 69 HA LYS 69 -4.565 -7.056 -12.813
3 HB2 LYS 69 HB2 LYS 69 -5.661 -4.561 -11.505
4 HB3 LYS 69 HB3 LYS 69 -6.379 -5.300 -12.927
5 HG2 LYS 69 HG2 LYS 69 -6.688 -7.387 -11.624
6 HG3 LYS 69 HG3 LYS 69 -6.094 -6.537 -10.196
7 HD2 LYS 69 HD2 LYS 69 -8.440 -6.426 -10.048
8 HD3 LYS 69 HD3 LYS 69 -7.944 -4.839 -10.639
9 HE2 LYS 69 HE2 LYS 69 -9.787 -5.436 -11.971
10 HE3 LYS 69 HE3 LYS 69 -8.375 -5.750 -12.977
11 HZ1 LYS 69 HZ1 LYS 69 -8.543 -8.119 -12.203
12 HZ2 LYS 69 HZ2 LYS 69 -10.045 -7.732 -11.536
13 HZ3 LYS 69 HZ3 LYS 69 -9.799 -7.605 -13.209
No H/Q in entry = 13
In of MODEL 8
1 H HIS 70 H HIS 70 -2.317 -4.662 -12.341
2 HA HIS 70 HA HIS 70 -2.712 -3.429 -14.969
3 HB2 HIS 70 HB2 HIS 70 -2.556 -1.842 -13.062
4 HB3 HIS 70 HB3 HIS 70 -0.973 -2.498 -12.668
5 HD1 HIS 70 HD1 HIS 70 -2.730 -0.282 -15.110
6 HD2 HIS 70 HD2 HIS 70 1.122 -1.650 -14.333
7 HE1 HIS 70 HE1 HIS 70 -1.207 1.178 -16.473
8 HE2 HIS 70 HE2 HIS 70 1.117 0.460 -15.842
No H/Q in entry = 8
In of MODEL 8
1 H VAL 71 H VAL 71 -0.241 -4.690 -12.757
2 HA VAL 71 HA VAL 71 1.882 -4.762 -14.566
3 HB VAL 71 HB VAL 71 1.762 -6.842 -12.438
4 HG11 VAL 71 HG11 VAL 71 3.749 -6.497 -13.785
5 HG12 VAL 71 HG12 VAL 71 3.822 -4.824 -13.223
6 HG13 VAL 71 HG13 VAL 71 4.038 -6.149 -12.079
7 HG21 VAL 71 HG21 VAL 71 1.788 -3.896 -11.857
8 HG22 VAL 71 HG22 VAL 71 0.748 -5.147 -11.169
9 HG23 VAL 71 HG23 VAL 71 2.464 -5.099 -10.752
No H/Q in entry = 9
In of MODEL 8
1 H VAL 72 H VAL 72 -0.057 -7.468 -13.337
2 HA VAL 72 HA VAL 72 1.038 -9.135 -15.448
3 HB VAL 72 HB VAL 72 0.691 -9.663 -12.849
4 HG11 VAL 72 HG11 VAL 72 -1.724 -9.570 -12.893
5 HG12 VAL 72 HG12 VAL 72 -1.764 -10.820 -14.138
6 HG13 VAL 72 HG13 VAL 72 -1.169 -11.202 -12.521
7 HG21 VAL 72 HG21 VAL 72 1.993 -10.947 -14.416
8 HG22 VAL 72 HG22 VAL 72 1.002 -11.999 -13.410
9 HG23 VAL 72 HG23 VAL 72 0.523 -11.665 -15.074
No H/Q in entry = 9
In of MODEL 8
1 H GLY 73 H GLY 73 -1.803 -7.422 -14.727
2 HA2 GLY 73 HA2 GLY 73 -3.068 -8.495 -17.108
3 HA3 GLY 73 HA3 GLY 73 -3.504 -7.009 -16.275
No H/Q in entry = 3
In of MODEL 8
1 H GLU 74 H GLU 74 -5.159 -9.198 -17.143
2 HA GLU 74 HA GLU 74 -6.584 -9.623 -14.643
3 HB2 GLU 74 HB2 GLU 74 -7.681 -8.786 -16.763
4 HB3 GLU 74 HB3 GLU 74 -7.440 -10.390 -17.436
5 HG2 GLU 74 HG2 GLU 74 -9.692 -10.170 -16.627
6 HG3 GLU 74 HG3 GLU 74 -8.814 -11.329 -15.627
No H/Q in entry = 6
In of MODEL 8
1 H GLU 75 H GLU 75 -5.266 -11.473 -17.323
2 HA GLU 75 HA GLU 75 -5.980 -14.045 -16.936
3 HB2 GLU 75 HB2 GLU 75 -4.525 -13.338 -18.723
4 HB3 GLU 75 HB3 GLU 75 -3.234 -12.988 -17.583
5 HG2 GLU 75 HG2 GLU 75 -2.677 -15.033 -18.589
6 HG3 GLU 75 HG3 GLU 75 -3.267 -15.430 -16.975
No H/Q in entry = 6
In of MODEL 8
1 H LYS 76 H LYS 76 -2.979 -12.806 -15.447
2 HA LYS 76 HA LYS 76 -2.665 -15.287 -14.084
3 HB2 LYS 76 HB2 LYS 76 -1.086 -12.728 -13.891
4 HB3 LYS 76 HB3 LYS 76 -0.612 -14.278 -13.233
5 HG2 LYS 76 HG2 LYS 76 -1.036 -13.698 -16.149
6 HG3 LYS 76 HG3 LYS 76 0.526 -13.803 -15.338
7 HD2 LYS 76 HD2 LYS 76 -1.492 -16.038 -15.563
8 HD3 LYS 76 HD3 LYS 76 -0.026 -15.876 -16.532
9 HE2 LYS 76 HE2 LYS 76 1.301 -15.964 -14.443
10 HE3 LYS 76 HE3 LYS 76 -0.186 -16.248 -13.545
11 HZ1 LYS 76 HZ1 LYS 76 -0.522 -18.264 -14.870
12 HZ2 LYS 76 HZ2 LYS 76 0.972 -18.012 -15.631
13 HZ3 LYS 76 HZ3 LYS 76 0.910 -18.316 -13.968
No H/Q in entry = 13
In of MODEL 8
1 H ALA 77 H ALA 77 -3.532 -12.002 -13.146
2 HA ALA 77 HA ALA 77 -3.534 -12.401 -10.363
3 HB1 ALA 77 HB1 ALA 77 -4.990 -10.415 -10.282
4 HB2 ALA 77 HB2 ALA 77 -5.234 -10.520 -12.027
5 HB3 ALA 77 HB3 ALA 77 -3.632 -10.166 -11.380
No H/Q in entry = 5
In of MODEL 8
1 H ALA 78 H ALA 78 -5.838 -13.129 -12.888
2 HA ALA 78 HA ALA 78 -8.045 -13.758 -11.230
3 HB1 ALA 78 HB1 ALA 78 -8.872 -14.946 -13.276
4 HB2 ALA 78 HB2 ALA 78 -8.420 -13.261 -13.532
5 HB3 ALA 78 HB3 ALA 78 -7.332 -14.549 -14.053
No H/Q in entry = 5
In of MODEL 8
1 H GLU 79 H GLU 79 -5.435 -15.705 -12.647
2 HA GLU 79 HA GLU 79 -6.518 -18.153 -11.670
3 HB2 GLU 79 HB2 GLU 79 -4.716 -19.238 -12.642
4 HB3 GLU 79 HB3 GLU 79 -5.026 -17.861 -13.689
5 HG2 GLU 79 HG2 GLU 79 -3.231 -16.657 -12.712
6 HG3 GLU 79 HG3 GLU 79 -2.962 -17.947 -11.548
No H/Q in entry = 6
In of MODEL 8
1 H LEU 80 H LEU 80 -4.422 -15.752 -10.402
2 HA LEU 80 HA LEU 80 -3.427 -17.323 -8.251
3 HB2 LEU 80 HB2 LEU 80 -3.576 -14.350 -8.694
4 HB3 LEU 80 HB3 LEU 80 -2.769 -15.094 -7.324
5 HG LEU 80 HG LEU 80 -2.038 -15.728 -10.173
6 HD11 LEU 80 HD11 LEU 80 -0.879 -13.644 -8.343
7 HD12 LEU 80 HD12 LEU 80 -0.119 -14.212 -9.832
8 HD13 LEU 80 HD13 LEU 80 -1.678 -13.387 -9.898
9 HD21 LEU 80 HD21 LEU 80 -1.430 -17.339 -8.406
10 HD22 LEU 80 HD22 LEU 80 -0.028 -16.618 -9.200
11 HD23 LEU 80 HD23 LEU 80 -0.521 -16.063 -7.598
No H/Q in entry = 11
In of MODEL 8
1 H LYS 81 H LYS 81 -6.273 -15.360 -8.753
2 HA LYS 81 HA LYS 81 -7.128 -15.287 -6.057
3 HB2 LYS 81 HB2 LYS 81 -8.680 -15.166 -8.647
4 HB3 LYS 81 HB3 LYS 81 -9.424 -14.956 -7.069
5 HG2 LYS 81 HG2 LYS 81 -7.222 -13.227 -8.183
6 HG3 LYS 81 HG3 LYS 81 -8.938 -12.827 -8.212
7 HD2 LYS 81 HD2 LYS 81 -7.362 -13.356 -5.696
8 HD3 LYS 81 HD3 LYS 81 -7.670 -11.748 -6.354
9 HE2 LYS 81 HE2 LYS 81 -10.058 -12.075 -6.112
10 HE3 LYS 81 HE3 LYS 81 -9.802 -13.727 -5.553
11 HZ1 LYS 81 HZ1 LYS 81 -8.643 -12.850 -3.620
12 HZ2 LYS 81 HZ2 LYS 81 -8.893 -11.268 -4.157
13 HZ3 LYS 81 HZ3 LYS 81 -10.210 -12.227 -3.712
No H/Q in entry = 13
In of MODEL 8
1 H ASN 82 H ASN 82 -7.818 -17.507 -8.732
2 HA ASN 82 HA ASN 82 -9.384 -19.280 -7.142
3 HB2 ASN 82 HB2 ASN 82 -9.547 -19.139 -9.631
4 HB3 ASN 82 HB3 ASN 82 -7.948 -19.862 -9.741
5 HD21 ASN 82 HD21 ASN 82 -8.546 -21.698 -10.781
6 HD22 ASN 82 HD22 ASN 82 -9.544 -22.920 -10.072
No H/Q in entry = 6
In of MODEL 8
1 H LEU 83 H LEU 83 -5.989 -18.972 -7.888
2 HA LEU 83 HA LEU 83 -5.083 -21.505 -7.169
3 HB2 LEU 83 HB2 LEU 83 -3.942 -19.117 -7.928
4 HB3 LEU 83 HB3 LEU 83 -3.374 -19.296 -6.278
5 HG LEU 83 HG LEU 83 -3.002 -21.334 -8.485
6 HD11 LEU 83 HD11 LEU 83 -1.070 -19.358 -7.286
7 HD12 LEU 83 HD12 LEU 83 -0.637 -20.660 -8.395
8 HD13 LEU 83 HD13 LEU 83 -1.697 -19.358 -8.934
9 HD21 LEU 83 HD21 LEU 83 -3.099 -22.303 -6.220
10 HD22 LEU 83 HD22 LEU 83 -1.510 -22.463 -6.964
11 HD23 LEU 83 HD23 LEU 83 -1.785 -21.235 -5.730
No H/Q in entry = 11
In of MODEL 8
1 H LYS 84 H LYS 84 -5.738 -18.646 -5.233
2 HA LYS 84 HA LYS 84 -4.810 -19.739 -2.771
3 HB2 LYS 84 HB2 LYS 84 -5.144 -17.274 -3.424
4 HB3 LYS 84 HB3 LYS 84 -6.837 -17.537 -3.041
5 HG2 LYS 84 HG2 LYS 84 -6.197 -18.225 -0.764
6 HG3 LYS 84 HG3 LYS 84 -4.517 -17.866 -1.150
7 HD2 LYS 84 HD2 LYS 84 -5.410 -15.994 0.033
8 HD3 LYS 84 HD3 LYS 84 -5.218 -15.519 -1.654
9 HE2 LYS 84 HE2 LYS 84 -7.333 -14.708 -0.865
10 HE3 LYS 84 HE3 LYS 84 -7.621 -16.010 -2.014
11 HZ1 LYS 84 HZ1 LYS 84 -7.702 -16.272 0.944
12 HZ2 LYS 84 HZ2 LYS 84 -9.053 -16.200 -0.075
13 HZ3 LYS 84 HZ3 LYS 84 -7.994 -17.516 -0.161
No H/Q in entry = 13
In of MODEL 8
1 H ASP 85 H ASP 85 -8.002 -19.136 -4.142
2 HA ASP 85 HA ASP 85 -9.569 -20.202 -2.093
3 HB2 ASP 85 HB2 ASP 85 -10.453 -18.847 -3.956
4 HB3 ASP 85 HB3 ASP 85 -10.168 -20.198 -5.050
No H/Q in entry = 4
In of MODEL 8
1 H SER 86 H SER 86 -7.935 -21.882 -4.739
2 HA SER 86 HA SER 86 -9.311 -24.338 -4.148
3 HB2 SER 86 HB2 SER 86 -7.663 -25.330 -5.786
4 HB3 SER 86 HB3 SER 86 -8.667 -24.031 -6.428
5 HG SER 86 HG SER 86 -6.971 -22.713 -6.499
No H/Q in entry = 5
In of MODEL 8
1 H GLY 87 H GLY 87 -6.776 -22.676 -2.748
2 HA2 GLY 87 HA2 GLY 87 -5.932 -25.143 -1.364
3 HA3 GLY 87 HA3 GLY 87 -6.230 -23.630 -0.529
No H/Q in entry = 3
In of MODEL 8
1 H ALA 88 H ALA 88 -4.864 -21.894 -2.379
2 HA ALA 88 HA ALA 88 -2.173 -22.903 -2.441
3 HB1 ALA 88 HB1 ALA 88 -2.960 -20.035 -2.868
4 HB2 ALA 88 HB2 ALA 88 -3.068 -21.267 -4.127
5 HB3 ALA 88 HB3 ALA 88 -1.505 -20.854 -3.420
No H/Q in entry = 5
In of MODEL 8
1 H SER 89 H SER 89 -0.853 -22.789 -0.822
2 HA SER 89 HA SER 89 -1.445 -21.239 1.545
3 HB2 SER 89 HB2 SER 89 -0.571 -23.596 1.649
4 HB3 SER 89 HB3 SER 89 0.957 -22.998 1.006
5 HG SER 89 HG SER 89 -0.134 -22.744 3.540
No H/Q in entry = 5
In of MODEL 8
1 H LYS 90 H LYS 90 0.798 -20.347 2.525
2 HA LYS 90 HA LYS 90 1.177 -17.886 1.395
3 HB2 LYS 90 HB2 LYS 90 1.833 -18.506 3.681
4 HB3 LYS 90 HB3 LYS 90 3.163 -19.457 3.040
5 HG2 LYS 90 HG2 LYS 90 4.093 -17.365 2.056
6 HG3 LYS 90 HG3 LYS 90 2.830 -16.473 2.905
7 HD2 LYS 90 HD2 LYS 90 4.817 -16.390 4.237
8 HD3 LYS 90 HD3 LYS 90 3.668 -17.464 5.039
9 HE2 LYS 90 HE2 LYS 90 4.837 -19.398 4.027
10 HE3 LYS 90 HE3 LYS 90 6.019 -18.288 3.338
11 HZ1 LYS 90 HZ1 LYS 90 6.576 -17.587 5.599
12 HZ2 LYS 90 HZ2 LYS 90 5.494 -18.722 6.223
13 HZ3 LYS 90 HZ3 LYS 90 6.855 -19.236 5.365
No H/Q in entry = 13
In of MODEL 8
1 H GLU 91 H GLU 91 3.189 -20.775 0.888
2 HA GLU 91 HA GLU 91 5.160 -19.317 -0.560
3 HB2 GLU 91 HB2 GLU 91 4.755 -22.271 -0.175
4 HB3 GLU 91 HB3 GLU 91 6.131 -21.569 -1.018
5 HG2 GLU 91 HG2 GLU 91 6.724 -20.337 1.028
6 HG3 GLU 91 HG3 GLU 91 5.387 -21.126 1.864
No H/Q in entry = 6
In of MODEL 8
1 H GLU 92 H GLU 92 2.608 -21.544 -1.571
2 HA GLU 92 HA GLU 92 3.042 -21.734 -4.257
3 HB2 GLU 92 HB2 GLU 92 0.384 -21.414 -2.865
4 HB3 GLU 92 HB3 GLU 92 0.665 -22.174 -4.416
5 HG2 GLU 92 HG2 GLU 92 1.859 -23.191 -1.869
6 HG3 GLU 92 HG3 GLU 92 0.296 -23.711 -2.482
No H/Q in entry = 6
In of MODEL 8
1 H LEU 93 H LEU 93 1.217 -19.224 -2.491
2 HA LEU 93 HA LEU 93 0.992 -17.652 -4.887
3 HB2 LEU 93 HB2 LEU 93 0.481 -16.926 -2.005
4 HB3 LEU 93 HB3 LEU 93 0.213 -15.825 -3.351
5 HG LEU 93 HG LEU 93 -1.206 -18.432 -2.806
6 HD11 LEU 93 HD11 LEU 93 -2.175 -15.601 -3.048
7 HD12 LEU 93 HD12 LEU 93 -3.213 -17.021 -2.907
8 HD13 LEU 93 HD13 LEU 93 -2.123 -16.589 -1.585
9 HD21 LEU 93 HD21 LEU 93 -1.274 -16.723 -5.283
10 HD22 LEU 93 HD22 LEU 93 -0.787 -18.415 -5.158
11 HD23 LEU 93 HD23 LEU 93 -2.471 -17.959 -4.897
No H/Q in entry = 11
In of MODEL 8
1 H LYS 94 H LYS 94 3.384 -17.907 -2.315
2 HA LYS 94 HA LYS 94 4.527 -15.362 -2.785
3 HB2 LYS 94 HB2 LYS 94 4.946 -16.553 -0.711
4 HB3 LYS 94 HB3 LYS 94 5.713 -17.864 -1.586
5 HG2 LYS 94 HG2 LYS 94 7.499 -16.341 -2.293
6 HG3 LYS 94 HG3 LYS 94 6.745 -15.054 -1.346
7 HD2 LYS 94 HD2 LYS 94 7.206 -16.116 0.687
8 HD3 LYS 94 HD3 LYS 94 7.500 -17.674 -0.091
9 HE2 LYS 94 HE2 LYS 94 9.586 -16.663 0.656
10 HE3 LYS 94 HE3 LYS 94 9.540 -16.792 -1.099
11 HZ1 LYS 94 HZ1 LYS 94 8.947 -14.324 0.436
12 HZ2 LYS 94 HZ2 LYS 94 10.414 -14.661 -0.328
13 HZ3 LYS 94 HZ3 LYS 94 9.011 -14.463 -1.249
No H/Q in entry = 13
In of MODEL 8
1 H ALA 95 H ALA 95 5.182 -18.566 -4.016
2 HA ALA 95 HA ALA 95 7.461 -17.577 -5.512
3 HB1 ALA 95 HB1 ALA 95 6.316 -20.359 -5.355
4 HB2 ALA 95 HB2 ALA 95 7.625 -19.725 -4.355
5 HB3 ALA 95 HB3 ALA 95 7.852 -19.901 -6.095
No H/Q in entry = 5
In of MODEL 8
1 H LYS 96 H LYS 96 4.348 -19.194 -6.212
2 HA LYS 96 HA LYS 96 4.696 -19.111 -9.020
3 HB2 LYS 96 HB2 LYS 96 2.256 -19.372 -7.295
4 HB3 LYS 96 HB3 LYS 96 2.174 -19.382 -9.041
5 HG2 LYS 96 HG2 LYS 96 3.687 -21.328 -7.318
6 HG3 LYS 96 HG3 LYS 96 2.183 -21.644 -8.187
7 HD2 LYS 96 HD2 LYS 96 3.356 -21.226 -10.315
8 HD3 LYS 96 HD3 LYS 96 4.857 -20.978 -9.420
9 HE2 LYS 96 HE2 LYS 96 4.690 -23.272 -8.547
10 HE3 LYS 96 HE3 LYS 96 3.227 -23.512 -9.501
11 HZ1 LYS 96 HZ1 LYS 96 4.538 -23.099 -11.505
12 HZ2 LYS 96 HZ2 LYS 96 5.938 -22.937 -10.567
13 HZ3 LYS 96 HZ3 LYS 96 5.132 -24.421 -10.633
No H/Q in entry = 13
In of MODEL 8
1 H VAL 97 H VAL 97 3.716 -16.672 -6.793
2 HA VAL 97 HA VAL 97 2.427 -14.916 -8.603
3 HB VAL 97 HB VAL 97 2.781 -14.877 -5.921
4 HG11 VAL 97 HG11 VAL 97 4.628 -12.904 -7.147
5 HG12 VAL 97 HG12 VAL 97 4.024 -12.760 -5.492
6 HG13 VAL 97 HG13 VAL 97 5.002 -14.153 -5.969
7 HG21 VAL 97 HG21 VAL 97 2.116 -12.541 -7.694
8 HG22 VAL 97 HG22 VAL 97 0.991 -13.780 -7.144
9 HG23 VAL 97 HG23 VAL 97 1.727 -12.677 -5.980
No H/Q in entry = 9
In of MODEL 8
1 H GLU 98 H GLU 98 5.759 -15.509 -7.765
2 HA GLU 98 HA GLU 98 6.679 -13.118 -9.054
3 HB2 GLU 98 HB2 GLU 98 8.160 -15.454 -7.865
4 HB3 GLU 98 HB3 GLU 98 8.934 -14.008 -8.502
5 HG2 GLU 98 HG2 GLU 98 7.675 -12.650 -6.884
6 HG3 GLU 98 HG3 GLU 98 6.975 -14.122 -6.210
No H/Q in entry = 6
In of MODEL 8
1 H GLU 99 H GLU 99 6.026 -16.307 -10.034
2 HA GLU 99 HA GLU 99 7.569 -16.279 -12.449
3 HB2 GLU 99 HB2 GLU 99 5.005 -17.747 -11.775
4 HB3 GLU 99 HB3 GLU 99 6.013 -18.059 -13.182
5 HG2 GLU 99 HG2 GLU 99 6.819 -18.434 -10.308
6 HG3 GLU 99 HG3 GLU 99 6.392 -19.709 -11.447
No H/Q in entry = 6
In of MODEL 8
1 H ALA 100 H ALA 100 4.226 -15.503 -11.614
2 HA ALA 100 HA ALA 100 3.425 -14.602 -14.151
3 HB1 ALA 100 HB1 ALA 100 2.359 -13.576 -11.530
4 HB2 ALA 100 HB2 ALA 100 1.961 -15.171 -12.165
5 HB3 ALA 100 HB3 ALA 100 1.512 -13.728 -13.069
No H/Q in entry = 5
In of MODEL 8
1 H LEU 101 H LEU 101 4.647 -12.851 -11.314
2 HA LEU 101 HA LEU 101 4.812 -10.329 -12.571
3 HB2 LEU 101 HB2 LEU 101 5.983 -11.535 -10.095
4 HB3 LEU 101 HB3 LEU 101 6.489 -9.946 -10.619
5 HG LEU 101 HG LEU 101 4.706 -10.013 -8.850
6 HD11 LEU 101 HD11 LEU 101 4.088 -8.595 -11.430
7 HD12 LEU 101 HD12 LEU 101 3.382 -8.203 -9.861
8 HD13 LEU 101 HD13 LEU 101 5.114 -8.008 -10.123
9 HD21 LEU 101 HD21 LEU 101 3.380 -11.860 -9.738
10 HD22 LEU 101 HD22 LEU 101 2.412 -10.403 -9.514
11 HD23 LEU 101 HD23 LEU 101 2.944 -10.867 -11.130
No H/Q in entry = 11
In of MODEL 8
1 H HIS 102 H HIS 102 6.651 -13.098 -13.080
2 HA HIS 102 HA HIS 102 9.006 -11.592 -13.864
3 HB2 HIS 102 HB2 HIS 102 9.051 -13.965 -12.857
4 HB3 HIS 102 HB3 HIS 102 8.504 -14.515 -14.433
5 HD1 HIS 102 HD1 HIS 102 10.222 -14.320 -16.411
6 HD2 HIS 102 HD2 HIS 102 11.698 -13.305 -12.665
7 HE1 HIS 102 HE1 HIS 102 12.720 -14.242 -16.671
8 HE2 HIS 102 HE2 HIS 102 13.593 -13.832 -14.345
No H/Q in entry = 8
In of MODEL 8
1 H ALA 103 H ALA 103 6.433 -13.534 -15.229
2 HA ALA 103 HA ALA 103 7.295 -13.517 -17.899
3 HB1 ALA 103 HB1 ALA 103 4.511 -13.968 -16.869
4 HB2 ALA 103 HB2 ALA 103 5.804 -15.166 -16.785
5 HB3 ALA 103 HB3 ALA 103 5.221 -14.601 -18.356
No H/Q in entry = 5
In of MODEL 8
1 H VAL 104 H VAL 104 6.218 -10.840 -16.284
2 HA VAL 104 HA VAL 104 4.509 -9.807 -18.301
3 HB VAL 104 HB VAL 104 3.892 -9.079 -16.234
4 HG11 VAL 104 HG11 VAL 104 5.783 -9.908 -15.014
5 HG12 VAL 104 HG12 VAL 104 6.753 -8.539 -15.545
6 HG13 VAL 104 HG13 VAL 104 5.367 -8.281 -14.489
7 HG21 VAL 104 HG21 VAL 104 4.109 -7.145 -17.745
8 HG22 VAL 104 HG22 VAL 104 4.301 -6.704 -16.050
9 HG23 VAL 104 HG23 VAL 104 5.717 -6.852 -17.087
No H/Q in entry = 9
In of MODEL 8
1 H THR 105 H THR 105 7.446 -8.312 -16.974
2 HA THR 105 HA THR 105 9.331 -7.497 -17.898
3 HB THR 105 HB THR 105 10.245 -8.369 -19.922
4 HG1 THR 105 HG1 THR 105 7.559 -8.943 -20.536
5 HG21 THR 105 HG21 THR 105 10.214 -9.900 -18.030
6 HG22 THR 105 HG22 THR 105 8.630 -10.500 -18.529
7 HG23 THR 105 HG23 THR 105 10.043 -10.782 -19.550
No H/Q in entry = 7
In of MODEL 8
1 H ASP 106 H ASP 106 6.444 -6.382 -18.689
2 HA ASP 106 HA ASP 106 7.357 -4.467 -20.666
3 HB2 ASP 106 HB2 ASP 106 4.772 -4.960 -19.242
4 HB3 ASP 106 HB3 ASP 106 5.048 -3.412 -20.026
No H/Q in entry = 4
In of MODEL 8
1 H GLU 107 H GLU 107 7.819 -2.318 -20.258
2 HA GLU 107 HA GLU 107 9.496 -2.148 -18.049
3 HB2 GLU 107 HB2 GLU 107 9.968 -1.002 -20.129
4 HB3 GLU 107 HB3 GLU 107 8.594 0.067 -19.879
5 HG2 GLU 107 HG2 GLU 107 9.644 0.992 -17.897
6 HG3 GLU 107 HG3 GLU 107 11.003 -0.114 -18.083
No H/Q in entry = 6
In of MODEL 8
1 H GLU 108 H GLU 108 6.548 -0.198 -18.619
2 HA GLU 108 HA GLU 108 6.763 1.176 -16.156
3 HB2 GLU 108 HB2 GLU 108 4.519 0.805 -18.115
4 HB3 GLU 108 HB3 GLU 108 4.267 1.653 -16.598
5 HG2 GLU 108 HG2 GLU 108 6.324 2.406 -18.655
6 HG3 GLU 108 HG3 GLU 108 4.730 3.144 -18.504
No H/Q in entry = 6
In of MODEL 8
1 H LYS 109 H LYS 109 5.138 -1.793 -17.092
2 HA LYS 109 HA LYS 109 3.760 -2.198 -14.663
3 HB2 LYS 109 HB2 LYS 109 4.749 -4.106 -16.774
4 HB3 LYS 109 HB3 LYS 109 3.773 -4.611 -15.401
5 HG2 LYS 109 HG2 LYS 109 1.936 -3.256 -16.115
6 HG3 LYS 109 HG3 LYS 109 2.916 -2.510 -17.376
7 HD2 LYS 109 HD2 LYS 109 3.076 -4.627 -18.543
8 HD3 LYS 109 HD3 LYS 109 2.192 -5.435 -17.249
9 HE2 LYS 109 HE2 LYS 109 0.736 -4.974 -19.145
10 HE3 LYS 109 HE3 LYS 109 0.233 -4.057 -17.727
11 HZ1 LYS 109 HZ1 LYS 109 1.434 -2.131 -18.672
12 HZ2 LYS 109 HZ2 LYS 109 1.736 -3.028 -20.074
13 HZ3 LYS 109 HZ3 LYS 109 0.150 -2.650 -19.633
No H/Q in entry = 13
In of MODEL 8
1 H LYS 110 H LYS 110 7.011 -3.125 -15.752
2 HA LYS 110 HA LYS 110 7.705 -4.437 -13.313
3 HB2 LYS 110 HB2 LYS 110 9.433 -3.293 -15.505
4 HB3 LYS 110 HB3 LYS 110 10.060 -4.200 -14.139
5 HG2 LYS 110 HG2 LYS 110 8.511 -6.083 -14.921
6 HG3 LYS 110 HG3 LYS 110 8.386 -5.165 -16.424
7 HD2 LYS 110 HD2 LYS 110 10.998 -5.986 -15.170
8 HD3 LYS 110 HD3 LYS 110 10.178 -6.920 -16.414
9 HE2 LYS 110 HE2 LYS 110 10.371 -5.106 -17.979
10 HE3 LYS 110 HE3 LYS 110 11.011 -4.044 -16.729
11 HZ1 LYS 110 HZ1 LYS 110 12.950 -5.485 -16.562
12 HZ2 LYS 110 HZ2 LYS 110 12.337 -6.482 -17.779
13 HZ3 LYS 110 HZ3 LYS 110 12.773 -4.887 -18.132
No H/Q in entry = 13
In of MODEL 8
1 H GLN 111 H GLN 111 7.485 -1.173 -14.227
2 HA GLN 111 HA GLN 111 9.195 -0.005 -12.299
3 HB2 GLN 111 HB2 GLN 111 7.732 1.076 -14.222
4 HB3 GLN 111 HB3 GLN 111 6.520 1.198 -12.961
5 HG2 GLN 111 HG2 GLN 111 9.256 2.458 -12.945
6 HG3 GLN 111 HG3 GLN 111 7.724 3.278 -13.210
7 HE21 GLN 111 HE21 GLN 111 9.899 1.945 -10.898
8 HE22 GLN 111 HE22 GLN 111 9.077 2.503 -9.483
No H/Q in entry = 8
In of MODEL 8
1 H TYR 112 H TYR 112 5.883 -1.194 -12.206
2 HA TYR 112 HA TYR 112 5.424 -0.500 -9.459
3 HB2 TYR 112 HB2 TYR 112 3.966 -2.289 -11.402
4 HB3 TYR 112 HB3 TYR 112 3.464 -2.122 -9.723
5 HD1 TYR 112 HD1 TYR 112 2.621 0.038 -8.893
6 HD2 TYR 112 HD2 TYR 112 3.542 -0.552 -13.003
7 HE1 TYR 112 HE1 TYR 112 1.324 2.047 -9.464
8 HE2 TYR 112 HE2 TYR 112 2.248 1.455 -13.586
9 HH TYR 112 HH TYR 112 1.134 3.681 -11.224
No H/Q in entry = 9
In of MODEL 8
1 H ILE 113 H ILE 113 6.600 -3.332 -11.187
2 HA ILE 113 HA ILE 113 6.578 -5.156 -9.072
3 HB ILE 113 HB ILE 113 8.591 -4.922 -11.307
4 HG12 ILE 113 HG12 ILE 113 6.057 -6.536 -10.991
5 HG13 ILE 113 HG13 ILE 113 6.322 -5.210 -12.116
6 HG21 ILE 113 HG21 ILE 113 8.018 -7.230 -9.449
7 HG22 ILE 113 HG22 ILE 113 9.085 -7.284 -10.851
8 HG23 ILE 113 HG23 ILE 113 9.487 -6.253 -9.477
9 HD11 ILE 113 HD11 ILE 113 8.109 -6.591 -13.168
10 HD12 ILE 113 HD12 ILE 113 7.584 -7.926 -12.152
11 HD13 ILE 113 HD13 ILE 113 6.477 -7.229 -13.333
No H/Q in entry = 11
In of MODEL 8
1 H ALA 114 H ALA 114 9.112 -2.880 -10.104
2 HA ALA 114 HA ALA 114 10.885 -3.400 -7.937
3 HB1 ALA 114 HB1 ALA 114 11.714 -2.455 -9.995
4 HB2 ALA 114 HB2 ALA 114 11.992 -1.306 -8.685
5 HB3 ALA 114 HB3 ALA 114 10.662 -1.049 -9.819
No H/Q in entry = 5
In of MODEL 8
1 H ASP 115 H ASP 115 8.322 -1.064 -8.497
2 HA ASP 115 HA ASP 115 8.990 0.574 -6.259
3 HB2 ASP 115 HB2 ASP 115 7.903 1.503 -8.211
4 HB3 ASP 115 HB3 ASP 115 6.525 0.433 -7.995
No H/Q in entry = 4
In of MODEL 8
1 H PHE 116 H PHE 116 6.242 -1.602 -6.889
2 HA PHE 116 HA PHE 116 5.501 -1.284 -4.075
3 HB2 PHE 116 HB2 PHE 116 3.978 -1.288 -6.467
4 HB3 PHE 116 HB3 PHE 116 3.541 -2.750 -5.595
5 HD1 PHE 116 HD1 PHE 116 2.587 -2.589 -3.328
6 HD2 PHE 116 HD2 PHE 116 3.310 0.844 -5.735
7 HE1 PHE 116 HE1 PHE 116 1.061 -1.285 -1.908
8 HE2 PHE 116 HE2 PHE 116 1.784 2.161 -4.312
9 HZ PHE 116 HZ PHE 116 0.657 1.087 -2.401
No H/Q in entry = 9
In of MODEL 8
1 H GLY 117 H GLY 117 6.713 -3.584 -6.314
2 HA2 GLY 117 HA2 GLY 117 7.326 -5.794 -6.064
3 HA3 GLY 117 HA3 GLY 117 5.668 -5.998 -5.536
No H/Q in entry = 3
In of MODEL 8
1 HA PRO 118 HA PRO 118 9.070 -6.805 -2.170
2 HB2 PRO 118 HB2 PRO 118 10.275 -4.563 -1.136
3 HB3 PRO 118 HB3 PRO 118 10.968 -5.559 -2.419
4 HG2 PRO 118 HG2 PRO 118 9.409 -3.010 -2.634
5 HG3 PRO 118 HG3 PRO 118 10.886 -3.492 -3.492
6 HD2 PRO 118 HD2 PRO 118 8.506 -3.638 -4.688
7 HD3 PRO 118 HD3 PRO 118 9.729 -4.904 -4.941
No H/Q in entry = 7
In of MODEL 8
1 H ALA 119 H ALA 119 7.278 -3.771 -1.980
2 HA ALA 119 HA ALA 119 6.849 -3.967 0.860
3 HB1 ALA 119 HB1 ALA 119 5.407 -2.013 0.541
4 HB2 ALA 119 HB2 ALA 119 5.612 -2.160 -1.204
5 HB3 ALA 119 HB3 ALA 119 7.000 -1.795 -0.180
No H/Q in entry = 5
In of MODEL 8
1 H CYS 120 H CYS 120 4.986 -4.598 -2.080
2 HA CYS 120 HA CYS 120 2.572 -5.416 -1.009
3 HB2 CYS 120 HB2 CYS 120 4.137 -6.555 -3.327
4 HB3 CYS 120 HB3 CYS 120 2.488 -7.034 -2.943
No H/Q in entry = 4
In of MODEL 8
1 H LYS 121 H LYS 121 5.680 -7.076 -1.033
2 HA LYS 121 HA LYS 121 4.868 -9.618 -0.257
3 HB2 LYS 121 HB2 LYS 121 7.352 -8.069 -0.060
4 HB3 LYS 121 HB3 LYS 121 7.195 -9.343 1.139
5 HG2 LYS 121 HG2 LYS 121 8.371 -10.106 -0.858
6 HG3 LYS 121 HG3 LYS 121 6.867 -10.989 -0.608
7 HD2 LYS 121 HD2 LYS 121 5.766 -9.563 -2.271
8 HD3 LYS 121 HD3 LYS 121 7.283 -8.699 -2.530
9 HE2 LYS 121 HE2 LYS 121 6.821 -11.639 -3.012
10 HE3 LYS 121 HE3 LYS 121 6.882 -10.392 -4.258
11 HZ1 LYS 121 HZ1 LYS 121 9.176 -9.927 -3.612
12 HZ2 LYS 121 HZ2 LYS 121 9.113 -11.154 -2.451
13 HZ3 LYS 121 HZ3 LYS 121 8.991 -11.543 -4.095
No H/Q in entry = 13
In of MODEL 8
1 H LYS 122 H LYS 122 5.849 -6.976 1.998
2 HA LYS 122 HA LYS 122 4.970 -8.425 4.274
3 HB2 LYS 122 HB2 LYS 122 5.172 -6.346 5.528
4 HB3 LYS 122 HB3 LYS 122 6.577 -6.608 4.512
5 HG2 LYS 122 HG2 LYS 122 5.604 -5.005 2.873
6 HG3 LYS 122 HG3 LYS 122 4.327 -4.666 4.046
7 HD2 LYS 122 HD2 LYS 122 7.291 -4.278 4.487
8 HD3 LYS 122 HD3 LYS 122 6.116 -2.999 4.179
9 HE2 LYS 122 HE2 LYS 122 4.987 -3.471 6.253
10 HE3 LYS 122 HE3 LYS 122 6.007 -4.880 6.535
11 HZ1 LYS 122 HZ1 LYS 122 7.917 -3.416 6.726
12 HZ2 LYS 122 HZ2 LYS 122 6.941 -2.060 6.459
13 HZ3 LYS 122 HZ3 LYS 122 6.727 -2.996 7.855
No H/Q in entry = 13
In of MODEL 8
1 H ILE 123 H ILE 123 3.337 -6.424 1.963
2 HA ILE 123 HA ILE 123 1.030 -5.851 3.479
3 HB ILE 123 HB ILE 123 1.459 -5.949 0.517
4 HG12 ILE 123 HG12 ILE 123 1.095 -3.664 2.463
5 HG13 ILE 123 HG13 ILE 123 2.645 -4.210 1.829
6 HG21 ILE 123 HG21 ILE 123 -0.980 -5.056 2.046
7 HG22 ILE 123 HG22 ILE 123 -0.701 -4.767 0.328
8 HG23 ILE 123 HG23 ILE 123 -0.880 -6.415 0.927
9 HD11 ILE 123 HD11 ILE 123 0.393 -3.178 0.146
10 HD12 ILE 123 HD12 ILE 123 1.753 -2.211 0.709
11 HD13 ILE 123 HD13 ILE 123 2.027 -3.566 -0.382
No H/Q in entry = 11
In of MODEL 8
1 H TYR 124 H TYR 124 1.676 -8.251 1.056
2 HA TYR 124 HA TYR 124 -0.625 -9.886 1.572
3 HB2 TYR 124 HB2 TYR 124 1.800 -10.203 -0.191
4 HB3 TYR 124 HB3 TYR 124 0.580 -11.459 -0.027
5 HD1 TYR 124 HD1 TYR 124 -1.898 -10.650 -0.432
6 HD2 TYR 124 HD2 TYR 124 1.556 -8.637 -1.885
7 HE1 TYR 124 HE1 TYR 124 -3.272 -9.543 -2.145
8 HE2 TYR 124 HE2 TYR 124 0.194 -7.524 -3.601
9 HH TYR 124 HH TYR 124 -3.149 -7.425 -3.511
No H/Q in entry = 9
In of MODEL 8
1 H GLY 125 H GLY 125 0.909 -9.463 3.856
2 HA2 GLY 125 HA2 GLY 125 2.171 -10.499 5.543
3 HA3 GLY 125 HA3 GLY 125 3.332 -9.908 4.391
No H/Q in entry = 3
In of MODEL 8
1 H VAL 126 H VAL 126 2.618 -12.169 2.524
2 HA VAL 126 HA VAL 126 3.558 -14.590 3.350
3 HB VAL 126 HB VAL 126 4.809 -14.746 1.187
4 HG11 VAL 126 HG11 VAL 126 2.034 -13.584 1.021
5 HG12 VAL 126 HG12 VAL 126 2.855 -14.438 -0.287
6 HG13 VAL 126 HG13 VAL 126 2.454 -15.286 1.208
7 HG21 VAL 126 HG21 VAL 126 3.974 -11.858 0.889
8 HG22 VAL 126 HG22 VAL 126 5.624 -12.469 1.022
9 HG23 VAL 126 HG23 VAL 126 4.653 -12.859 -0.397
No H/Q in entry = 9
In of MODEL 8
1 H HIS 127 H HIS 127 5.376 -11.594 3.035
2 HA HIS 127 HA HIS 127 7.842 -12.820 3.929
3 HB2 HIS 127 HB2 HIS 127 7.887 -10.956 2.293
4 HB3 HIS 127 HB3 HIS 127 7.166 -9.897 3.497
5 HD1 HIS 127 HD1 HIS 127 8.719 -8.844 5.214
6 HD2 HIS 127 HD2 HIS 127 10.602 -11.690 2.834
7 HE1 HIS 127 HE1 HIS 127 11.175 -8.611 5.693
8 HE2 HIS 127 HE2 HIS 127 12.293 -10.367 4.276
No H/Q in entry = 8
In of MODEL 8
1 H THR 128 H THR 128 7.273 -13.628 5.934
2 HA THR 128 HA THR 128 5.958 -12.220 7.963
3 HB THR 128 HB THR 128 7.181 -13.900 9.483
4 HG1 THR 128 HG1 THR 128 8.706 -15.023 8.553
5 HG21 THR 128 HG21 THR 128 5.494 -14.897 7.185
6 HG22 THR 128 HG22 THR 128 5.777 -15.759 8.698
7 HG23 THR 128 HG23 THR 128 4.893 -14.232 8.704
No H/Q in entry = 7
In of MODEL 8
1 H SER 129 H SER 129 6.697 -11.054 9.721
2 HA SER 129 HA SER 129 9.312 -9.819 9.329
3 HB2 SER 129 HB2 SER 129 7.061 -9.029 11.197
4 HB3 SER 129 HB3 SER 129 8.508 -8.083 10.851
5 HG SER 129 HG SER 129 6.490 -8.818 8.980
No H/Q in entry = 5
In of MODEL 9
1 HA2 GLY -4 HA2 GLY -4 -6.928 18.193 -18.450
2 HA3 GLY -4 HA3 GLY -4 -5.641 18.335 -19.638
3 H1 GLY -4 H1 GLY -4 -7.628 17.386 -20.606
4 H2 GLY -4 H2 GLY -4 -7.609 16.124 -19.480
No H/Q in entry = 4
In of MODEL 9
1 H SER -3 H SER -3 -5.889 17.868 -16.579
2 HA SER -3 HA SER -3 -3.616 16.074 -16.433
3 HB2 SER -3 HB2 SER -3 -5.045 17.626 -14.262
4 HB3 SER -3 HB3 SER -3 -3.521 16.759 -14.072
5 HG SER -3 HG SER -3 -3.139 18.322 -16.117
No H/Q in entry = 5
In of MODEL 9
1 HA PRO -2 HA PRO -2 -6.411 12.702 -15.409
2 HB2 PRO -2 HB2 PRO -2 -4.524 10.765 -15.376
3 HB3 PRO -2 HB3 PRO -2 -5.208 11.405 -16.873
4 HG2 PRO -2 HG2 PRO -2 -2.613 12.053 -15.546
5 HG3 PRO -2 HG3 PRO -2 -2.964 11.817 -17.267
6 HD2 PRO -2 HD2 PRO -2 -2.704 14.272 -16.117
7 HD3 PRO -2 HD3 PRO -2 -3.725 13.964 -17.533
No H/Q in entry = 7
In of MODEL 9
1 H GLU -1 H GLU -1 -7.094 12.751 -13.364
2 HA GLU -1 HA GLU -1 -5.469 13.023 -11.073
3 HB2 GLU -1 HB2 GLU -1 -8.234 11.808 -11.280
4 HB3 GLU -1 HB3 GLU -1 -7.469 12.390 -9.810
5 HG2 GLU -1 HG2 GLU -1 -8.241 14.074 -12.181
6 HG3 GLU -1 HG3 GLU -1 -9.110 13.972 -10.651
No H/Q in entry = 6
In of MODEL 9
1 H PHE 0 H PHE 0 -6.831 10.263 -12.769
2 HA PHE 0 HA PHE 0 -5.425 8.381 -11.062
3 HB2 PHE 0 HB2 PHE 0 -7.724 7.929 -12.020
4 HB3 PHE 0 HB3 PHE 0 -6.970 7.818 -13.605
5 HD1 PHE 0 HD1 PHE 0 -6.458 6.421 -10.180
6 HD2 PHE 0 HD2 PHE 0 -6.534 5.705 -14.371
7 HE1 PHE 0 HE1 PHE 0 -5.998 4.040 -9.775
8 HE2 PHE 0 HE2 PHE 0 -6.076 3.322 -13.978
9 HZ PHE 0 HZ PHE 0 -5.809 2.485 -11.677
No H/Q in entry = 9
In of MODEL 9
1 H HIS 1 H HIS 1 -3.437 9.644 -11.714
2 HA HIS 1 HA HIS 1 -2.346 9.215 -14.334
3 HB2 HIS 1 HB2 HIS 1 -1.823 11.185 -12.861
4 HB3 HIS 1 HB3 HIS 1 -0.935 10.099 -11.804
5 HD1 HIS 1 HD1 HIS 1 -0.748 11.765 -15.157
6 HD2 HIS 1 HD2 HIS 1 1.613 9.408 -12.683
7 HE1 HIS 1 HE1 HIS 1 1.556 11.846 -16.149
8 HE2 HIS 1 HE2 HIS 1 3.004 10.625 -14.493
No H/Q in entry = 8
In of MODEL 9
1 H HIS 2 H HIS 2 -2.449 6.963 -14.574
2 HA HIS 2 HA HIS 2 -1.820 4.790 -14.451
3 HB2 HIS 2 HB2 HIS 2 0.524 5.910 -12.907
4 HB3 HIS 2 HB3 HIS 2 0.356 4.207 -13.312
5 HD1 HIS 2 HD1 HIS 2 1.225 3.497 -15.532
6 HD2 HIS 2 HD2 HIS 2 0.760 7.619 -15.260
7 HE1 HIS 2 HE1 HIS 2 2.241 4.437 -17.639
8 HE2 HIS 2 HE2 HIS 2 1.826 6.920 -17.509
No H/Q in entry = 8
In of MODEL 9
1 H PHE 3 H PHE 3 -0.554 5.719 -11.312
2 HA PHE 3 HA PHE 3 -3.000 4.942 -9.958
3 HB2 PHE 3 HB2 PHE 3 -0.323 3.613 -9.456
4 HB3 PHE 3 HB3 PHE 3 -1.617 3.617 -8.265
5 HD1 PHE 3 HD1 PHE 3 -3.838 2.559 -8.918
6 HD2 PHE 3 HD2 PHE 3 -0.251 2.012 -11.140
7 HE1 PHE 3 HE1 PHE 3 -4.797 0.551 -9.964
8 HE2 PHE 3 HE2 PHE 3 -1.204 0.002 -12.191
9 HZ PHE 3 HZ PHE 3 -3.490 -0.736 -11.583
No H/Q in entry = 9
In of MODEL 9
1 H THR 4 H THR 4 -3.294 6.219 -8.148
2 HA THR 4 HA THR 4 -1.074 7.937 -7.321
3 HB THR 4 HB THR 4 -2.691 9.883 -7.289
4 HG1 THR 4 HG1 THR 4 -4.417 9.514 -8.996
5 HG21 THR 4 HG21 THR 4 -1.998 8.690 -9.977
6 HG22 THR 4 HG22 THR 4 -2.454 10.371 -9.696
7 HG23 THR 4 HG23 THR 4 -0.967 9.733 -8.996
No H/Q in entry = 7
In of MODEL 9
1 H LEU 5 H LEU 5 -1.398 8.932 -5.268
2 HA LEU 5 HA LEU 5 -2.593 7.155 -3.405
3 HB2 LEU 5 HB2 LEU 5 -1.455 9.911 -2.951
4 HB3 LEU 5 HB3 LEU 5 -1.807 8.727 -1.707
5 HG LEU 5 HG LEU 5 0.292 8.465 -3.860
6 HD11 LEU 5 HD11 LEU 5 0.837 10.087 -2.107
7 HD12 LEU 5 HD12 LEU 5 0.542 8.852 -0.883
8 HD13 LEU 5 HD13 LEU 5 1.867 8.658 -2.028
9 HD21 LEU 5 HD21 LEU 5 -0.431 6.611 -1.591
10 HD22 LEU 5 HD22 LEU 5 -0.660 6.295 -3.311
11 HD23 LEU 5 HD23 LEU 5 0.968 6.439 -2.652
No H/Q in entry = 11
In of MODEL 9
1 H GLU 6 H GLU 6 -3.600 10.234 -4.799
2 HA GLU 6 HA GLU 6 -5.872 10.636 -3.179
3 HB2 GLU 6 HB2 GLU 6 -5.500 11.225 -6.128
4 HB3 GLU 6 HB3 GLU 6 -6.807 11.854 -5.131
5 HG2 GLU 6 HG2 GLU 6 -5.152 13.011 -3.731
6 HG3 GLU 6 HG3 GLU 6 -3.871 12.420 -4.791
No H/Q in entry = 6
In of MODEL 9
1 H SER 7 H SER 7 -5.428 8.663 -6.167
2 HA SER 7 HA SER 7 -8.011 7.769 -6.416
3 HB2 SER 7 HB2 SER 7 -6.211 7.307 -8.037
4 HB3 SER 7 HB3 SER 7 -5.495 6.161 -6.906
5 HG SER 7 HG SER 7 -7.293 4.852 -7.120
No H/Q in entry = 5
In of MODEL 9
1 H SER 8 H SER 8 -5.813 7.015 -3.859
2 HA SER 8 HA SER 8 -7.352 4.652 -3.140
3 HB2 SER 8 HB2 SER 8 -4.760 5.645 -1.986
4 HB3 SER 8 HB3 SER 8 -5.594 4.145 -1.536
5 HG SER 8 HG SER 8 -5.184 4.449 -4.250
No H/Q in entry = 5
In of MODEL 9
1 H LEU 9 H LEU 9 -7.131 7.965 -2.159
2 HA LEU 9 HA LEU 9 -6.962 7.721 0.564
3 HB2 LEU 9 HB2 LEU 9 -8.253 9.866 -1.067
4 HB3 LEU 9 HB3 LEU 9 -7.865 10.011 0.640
5 HG LEU 9 HG LEU 9 -5.816 9.406 -1.475
6 HD11 LEU 9 HD11 LEU 9 -6.895 11.541 -1.874
7 HD12 LEU 9 HD12 LEU 9 -6.507 12.047 -0.232
8 HD13 LEU 9 HD13 LEU 9 -5.211 11.727 -1.384
9 HD21 LEU 9 HD21 LEU 9 -5.624 10.239 1.414
10 HD22 LEU 9 HD22 LEU 9 -5.110 8.706 0.710
11 HD23 LEU 9 HD23 LEU 9 -4.256 10.201 0.305
No H/Q in entry = 11
In of MODEL 9
1 H ASP 10 H ASP 10 -9.874 7.600 -1.299
2 HA ASP 10 HA ASP 10 -11.471 7.334 1.139
3 HB2 ASP 10 HB2 ASP 10 -12.322 7.501 -1.761
4 HB3 ASP 10 HB3 ASP 10 -13.415 7.449 -0.384
No H/Q in entry = 4
In of MODEL 9
1 H THR 11 H THR 11 -9.686 5.346 -0.698
2 HA THR 11 HA THR 11 -11.514 3.107 -0.207
3 HB THR 11 HB THR 11 -10.488 1.966 -2.196
4 HG1 THR 11 HG1 THR 11 -9.704 3.987 -3.640
5 HG21 THR 11 HG21 THR 11 -11.957 4.553 -2.710
6 HG22 THR 11 HG22 THR 11 -11.789 3.234 -3.867
7 HG23 THR 11 HG23 THR 11 -12.686 2.984 -2.370
No H/Q in entry = 7
In of MODEL 9
1 H HIS 12 H HIS 12 -8.360 2.684 -1.572
2 HA HIS 12 HA HIS 12 -7.650 0.758 0.315
3 HB2 HIS 12 HB2 HIS 12 -5.661 2.226 -1.396
4 HB3 HIS 12 HB3 HIS 12 -5.552 0.581 -0.788
5 HD1 HIS 12 HD1 HIS 12 -7.956 -0.809 -1.682
6 HD2 HIS 12 HD2 HIS 12 -6.201 2.138 -4.028
7 HE1 HIS 12 HE1 HIS 12 -8.785 -1.219 -4.020
8 HE2 HIS 12 HE2 HIS 12 -7.591 0.478 -5.447
No H/Q in entry = 8
In of MODEL 9
1 H LEU 13 H LEU 13 -6.931 4.207 0.241
2 HA LEU 13 HA LEU 13 -5.130 3.805 2.538
3 HB2 LEU 13 HB2 LEU 13 -5.098 5.700 0.269
4 HB3 LEU 13 HB3 LEU 13 -4.555 6.304 1.821
5 HG LEU 13 HG LEU 13 -2.633 5.565 0.594
6 HD11 LEU 13 HD11 LEU 13 -2.740 5.057 3.030
7 HD12 LEU 13 HD12 LEU 13 -3.244 3.421 2.614
8 HD13 LEU 13 HD13 LEU 13 -1.660 4.006 2.115
9 HD21 LEU 13 HD21 LEU 13 -4.070 2.936 0.273
10 HD22 LEU 13 HD22 LEU 13 -3.635 4.074 -1.002
11 HD23 LEU 13 HD23 LEU 13 -2.373 3.212 -0.123
No H/Q in entry = 11
In of MODEL 9
1 H LYS 14 H LYS 14 -8.034 4.010 2.515
2 HA LYS 14 HA LYS 14 -8.945 6.527 3.402
3 HB2 LYS 14 HB2 LYS 14 -10.988 5.403 3.945
4 HB3 LYS 14 HB3 LYS 14 -10.361 4.683 2.474
5 HG2 LYS 14 HG2 LYS 14 -9.390 2.857 3.901
6 HG3 LYS 14 HG3 LYS 14 -10.290 3.540 5.255
7 HD2 LYS 14 HD2 LYS 14 -11.426 2.417 2.696
8 HD3 LYS 14 HD3 LYS 14 -11.544 1.713 4.308
9 HE2 LYS 14 HE2 LYS 14 -12.769 3.815 4.994
10 HE3 LYS 14 HE3 LYS 14 -12.831 4.229 3.278
11 HZ1 LYS 14 HZ1 LYS 14 -13.994 2.123 2.885
12 HZ2 LYS 14 HZ2 LYS 14 -14.002 1.811 4.547
13 HZ3 LYS 14 HZ3 LYS 14 -14.853 3.135 3.929
No H/Q in entry = 13
In of MODEL 9
1 H TRP 15 H TRP 15 -7.264 4.018 5.010
2 HA TRP 15 HA TRP 15 -8.245 4.550 7.645
3 HB2 TRP 15 HB2 TRP 15 -6.377 3.016 8.335
4 HB3 TRP 15 HB3 TRP 15 -7.499 2.325 7.165
5 HD1 TRP 15 HD1 TRP 15 -6.600 1.970 4.666
6 HE1 TRP 15 HE1 TRP 15 -4.220 1.759 3.719
7 HE3 TRP 15 HE3 TRP 15 -3.981 3.810 8.648
8 HZ2 TRP 15 HZ2 TRP 15 -1.575 2.285 4.557
9 HZ3 TRP 15 HZ3 TRP 15 -1.528 3.917 8.497
10 HH2 TRP 15 HH2 TRP 15 -0.350 3.170 6.493
No H/Q in entry = 10
In of MODEL 9
1 H LEU 16 H LEU 16 -6.129 6.182 5.627
2 HA LEU 16 HA LEU 16 -4.303 7.153 7.628
3 HB2 LEU 16 HB2 LEU 16 -5.037 8.316 4.931
4 HB3 LEU 16 HB3 LEU 16 -3.704 8.847 5.933
5 HG LEU 16 HG LEU 16 -3.906 6.090 4.711
6 HD11 LEU 16 HD11 LEU 16 -2.382 8.526 3.799
7 HD12 LEU 16 HD12 LEU 16 -2.207 6.903 3.132
8 HD13 LEU 16 HD13 LEU 16 -3.738 7.765 2.970
9 HD21 LEU 16 HD21 LEU 16 -1.636 7.539 6.078
10 HD22 LEU 16 HD22 LEU 16 -2.492 6.120 6.678
11 HD23 LEU 16 HD23 LEU 16 -1.490 6.000 5.227
No H/Q in entry = 11
In of MODEL 9
1 H SER 17 H SER 17 -4.411 9.034 8.732
2 HA SER 17 HA SER 17 -7.014 10.246 9.038
3 HB2 SER 17 HB2 SER 17 -5.808 11.625 10.781
4 HB3 SER 17 HB3 SER 17 -5.758 9.883 11.059
5 HG SER 17 HG SER 17 -3.700 10.803 11.332
No H/Q in entry = 5
In of MODEL 9
1 H GLN 18 H GLN 18 -7.226 12.671 8.927
2 HA GLN 18 HA GLN 18 -6.599 13.515 6.366
3 HB2 GLN 18 HB2 GLN 18 -7.353 15.105 8.815
4 HB3 GLN 18 HB3 GLN 18 -7.145 15.851 7.237
5 HG2 GLN 18 HG2 GLN 18 -9.091 13.639 7.844
6 HG3 GLN 18 HG3 GLN 18 -9.494 15.355 7.787
7 HE21 GLN 18 HE21 GLN 18 -10.475 13.121 6.172
8 HE22 GLN 18 HE22 GLN 18 -10.152 13.548 4.528
No H/Q in entry = 8
In of MODEL 9
1 H GLU 19 H GLU 19 -4.934 14.345 9.384
2 HA GLU 19 HA GLU 19 -3.068 16.070 8.275
3 HB2 GLU 19 HB2 GLU 19 -2.902 14.246 10.673
4 HB3 GLU 19 HB3 GLU 19 -1.765 15.519 10.314
5 HG2 GLU 19 HG2 GLU 19 -4.688 15.885 10.863
6 HG3 GLU 19 HG3 GLU 19 -3.368 16.248 11.973
No H/Q in entry = 6
In of MODEL 9
1 H GLN 20 H GLN 20 -3.018 12.518 8.510
2 HA GLN 20 HA GLN 20 -0.321 12.329 7.552
3 HB2 GLN 20 HB2 GLN 20 -2.503 10.232 7.659
4 HB3 GLN 20 HB3 GLN 20 -0.820 9.910 7.270
5 HG2 GLN 20 HG2 GLN 20 -0.182 10.731 9.504
6 HG3 GLN 20 HG3 GLN 20 -1.889 10.947 9.884
7 HE21 GLN 20 HE21 GLN 20 -2.558 8.511 8.308
8 HE22 GLN 20 HE22 GLN 20 -2.139 7.189 9.333
No H/Q in entry = 8
In of MODEL 9
1 H LYS 21 H LYS 21 -3.541 12.018 6.005
2 HA LYS 21 HA LYS 21 -2.386 11.241 3.516
3 HB2 LYS 21 HB2 LYS 21 -4.606 11.583 2.547
4 HB3 LYS 21 HB3 LYS 21 -4.676 10.625 4.014
5 HG2 LYS 21 HG2 LYS 21 -5.123 13.100 5.003
6 HG3 LYS 21 HG3 LYS 21 -5.846 13.242 3.399
7 HD2 LYS 21 HD2 LYS 21 -6.483 11.142 5.478
8 HD3 LYS 21 HD3 LYS 21 -7.507 12.499 5.015
9 HE2 LYS 21 HE2 LYS 21 -6.653 10.303 3.137
10 HE3 LYS 21 HE3 LYS 21 -8.175 10.314 4.020
11 HZ1 LYS 21 HZ1 LYS 21 -8.711 12.428 2.916
12 HZ2 LYS 21 HZ2 LYS 21 -7.298 12.308 2.001
13 HZ3 LYS 21 HZ3 LYS 21 -8.522 11.159 1.820
No H/Q in entry = 13
In of MODEL 9
1 H ASP 22 H ASP 22 -3.406 14.304 4.875
2 HA ASP 22 HA ASP 22 -2.767 15.939 2.652
3 HB2 ASP 22 HB2 ASP 22 -4.090 16.641 4.675
4 HB3 ASP 22 HB3 ASP 22 -2.584 16.679 5.577
No H/Q in entry = 4
In of MODEL 9
1 H GLU 23 H GLU 23 -0.759 14.558 5.257
2 HA GLU 23 HA GLU 23 1.631 15.857 4.611
3 HB2 GLU 23 HB2 GLU 23 0.927 13.991 6.436
4 HB3 GLU 23 HB3 GLU 23 1.786 12.983 5.270
5 HG2 GLU 23 HG2 GLU 23 3.676 14.516 5.383
6 HG3 GLU 23 HG3 GLU 23 2.806 15.457 6.584
No H/Q in entry = 6
In of MODEL 9
1 H LEU 24 H LEU 24 0.359 12.751 3.343
2 HA LEU 24 HA LEU 24 2.484 12.311 1.574
3 HB2 LEU 24 HB2 LEU 24 -0.294 11.271 1.920
4 HB3 LEU 24 HB3 LEU 24 0.623 10.821 0.497
5 HG LEU 24 HG LEU 24 2.262 9.716 1.812
6 HD11 LEU 24 HD11 LEU 24 2.297 11.366 3.675
7 HD12 LEU 24 HD12 LEU 24 0.907 10.507 4.341
8 HD13 LEU 24 HD13 LEU 24 2.449 9.666 4.128
9 HD21 LEU 24 HD21 LEU 24 -0.484 9.086 2.823
10 HD22 LEU 24 HD22 LEU 24 0.277 8.434 1.374
11 HD23 LEU 24 HD23 LEU 24 0.916 8.023 2.966
No H/Q in entry = 11
In of MODEL 9
1 H LEU 25 H LEU 25 -0.646 13.929 1.173
2 HA LEU 25 HA LEU 25 -0.540 14.277 -1.612
3 HB2 LEU 25 HB2 LEU 25 -1.851 15.915 0.549
4 HB3 LEU 25 HB3 LEU 25 -2.064 16.234 -1.160
5 HG LEU 25 HG LEU 25 -2.864 13.704 0.271
6 HD11 LEU 25 HD11 LEU 25 -4.488 15.975 -0.861
7 HD12 LEU 25 HD12 LEU 25 -5.149 14.458 -0.259
8 HD13 LEU 25 HD13 LEU 25 -4.310 15.550 0.842
9 HD21 LEU 25 HD21 LEU 25 -3.149 14.536 -2.615
10 HD22 LEU 25 HD22 LEU 25 -2.199 13.190 -1.984
11 HD23 LEU 25 HD23 LEU 25 -3.956 13.151 -1.884
No H/Q in entry = 11
In of MODEL 9
1 H LYS 26 H LYS 26 0.643 16.261 1.037
2 HA LYS 26 HA LYS 26 1.616 18.390 -0.581
3 HB2 LYS 26 HB2 LYS 26 1.136 18.545 1.875
4 HB3 LYS 26 HB3 LYS 26 2.560 17.561 2.170
5 HG2 LYS 26 HG2 LYS 26 2.841 20.072 0.588
6 HG3 LYS 26 HG3 LYS 26 2.668 20.168 2.340
7 HD2 LYS 26 HD2 LYS 26 4.618 18.804 2.662
8 HD3 LYS 26 HD3 LYS 26 4.737 18.486 0.931
9 HE2 LYS 26 HE2 LYS 26 5.250 20.795 0.491
10 HE3 LYS 26 HE3 LYS 26 4.962 21.224 2.176
11 HZ1 LYS 26 HZ1 LYS 26 7.088 19.366 1.265
12 HZ2 LYS 26 HZ2 LYS 26 7.336 21.002 1.607
13 HZ3 LYS 26 HZ3 LYS 26 6.855 19.947 2.836
No H/Q in entry = 13
In of MODEL 9
1 H MET 27 H MET 27 3.117 15.480 0.787
2 HA MET 27 HA MET 27 5.656 15.860 -0.170
3 HB2 MET 27 HB2 MET 27 4.117 13.268 0.052
4 HB3 MET 27 HB3 MET 27 5.851 13.361 -0.216
5 HG2 MET 27 HG2 MET 27 6.124 14.500 1.920
6 HG3 MET 27 HG3 MET 27 4.384 14.425 2.183
7 HE1 MET 27 HE1 MET 27 7.654 12.350 1.695
8 HE2 MET 27 HE2 MET 27 7.099 10.700 1.978
9 HE3 MET 27 HE3 MET 27 6.571 11.575 0.540
No H/Q in entry = 9
In of MODEL 9
1 H LYS 28 H LYS 28 3.029 14.097 -1.868
2 HA LYS 28 HA LYS 28 4.427 13.609 -4.246
3 HB2 LYS 28 HB2 LYS 28 2.303 12.523 -3.612
4 HB3 LYS 28 HB3 LYS 28 1.462 14.046 -3.854
5 HG2 LYS 28 HG2 LYS 28 2.058 13.999 -6.227
6 HG3 LYS 28 HG3 LYS 28 2.907 12.473 -5.982
7 HD2 LYS 28 HD2 LYS 28 0.749 11.973 -6.884
8 HD3 LYS 28 HD3 LYS 28 0.751 11.488 -5.188
9 HE2 LYS 28 HE2 LYS 28 -1.320 12.589 -5.621
10 HE3 LYS 28 HE3 LYS 28 -0.337 13.676 -4.646
11 HZ1 LYS 28 HZ1 LYS 28 0.284 14.832 -6.717
12 HZ2 LYS 28 HZ2 LYS 28 -0.786 13.840 -7.576
13 HZ3 LYS 28 HZ3 LYS 28 -1.373 14.905 -6.399
No H/Q in entry = 13
In of MODEL 9
1 H LYS 29 H LYS 29 2.416 16.324 -3.252
2 HA LYS 29 HA LYS 29 2.419 17.719 -5.677
3 HB2 LYS 29 HB2 LYS 29 0.913 18.145 -3.727
4 HB3 LYS 29 HB3 LYS 29 2.265 18.912 -2.908
5 HG2 LYS 29 HG2 LYS 29 0.847 20.593 -3.866
6 HG3 LYS 29 HG3 LYS 29 2.386 20.573 -4.729
7 HD2 LYS 29 HD2 LYS 29 1.388 19.307 -6.540
8 HD3 LYS 29 HD3 LYS 29 -0.138 19.201 -5.658
9 HE2 LYS 29 HE2 LYS 29 1.162 21.739 -6.640
10 HE3 LYS 29 HE3 LYS 29 -0.212 20.929 -7.389
11 HZ1 LYS 29 HZ1 LYS 29 -1.483 21.300 -5.367
12 HZ2 LYS 29 HZ2 LYS 29 -0.164 22.084 -4.654
13 HZ3 LYS 29 HZ3 LYS 29 -0.924 22.765 -5.998
No H/Q in entry = 13
In of MODEL 9
1 H ASP 30 H ASP 30 4.628 17.961 -2.900
2 HA ASP 30 HA ASP 30 5.996 20.198 -4.065
3 HB2 ASP 30 HB2 ASP 30 5.761 19.997 -1.627
4 HB3 ASP 30 HB3 ASP 30 6.714 18.517 -1.647
No H/Q in entry = 4
In of MODEL 9
1 H GLY 31 H GLY 31 6.126 16.959 -4.660
2 HA2 GLY 31 HA2 GLY 31 8.629 17.362 -6.104
3 HA3 GLY 31 HA3 GLY 31 7.415 16.147 -6.459
No H/Q in entry = 3
In of MODEL 9
1 H LYS 32 H LYS 32 7.424 15.525 -3.442
2 HA LYS 32 HA LYS 32 9.922 14.247 -3.015
3 HB2 LYS 32 HB2 LYS 32 7.223 13.567 -1.819
4 HB3 LYS 32 HB3 LYS 32 8.784 13.025 -1.220
5 HG2 LYS 32 HG2 LYS 32 7.761 15.859 -1.264
6 HG3 LYS 32 HG3 LYS 32 7.947 14.825 0.153
7 HD2 LYS 32 HD2 LYS 32 10.233 15.666 -1.625
8 HD3 LYS 32 HD3 LYS 32 9.758 16.530 -0.164
9 HE2 LYS 32 HE2 LYS 32 10.522 13.617 -0.213
10 HE3 LYS 32 HE3 LYS 32 11.660 14.920 0.119
11 HZ1 LYS 32 HZ1 LYS 32 10.285 15.563 2.011
12 HZ2 LYS 32 HZ2 LYS 32 9.235 14.275 1.709
13 HZ3 LYS 32 HZ3 LYS 32 10.837 13.974 2.161
No H/Q in entry = 13
In of MODEL 9
1 H ALA 33 H ALA 33 10.395 12.055 -3.279
2 HA ALA 33 HA ALA 33 9.420 11.039 -5.771
3 HB1 ALA 33 HB1 ALA 33 11.782 10.852 -5.061
4 HB2 ALA 33 HB2 ALA 33 11.075 9.308 -5.534
5 HB3 ALA 33 HB3 ALA 33 11.290 9.693 -3.828
No H/Q in entry = 5
In of MODEL 9
1 H LYS 34 H LYS 34 8.492 8.939 -6.153
2 HA LYS 34 HA LYS 34 6.298 8.328 -4.526
3 HB2 LYS 34 HB2 LYS 34 7.709 6.571 -6.535
4 HB3 LYS 34 HB3 LYS 34 6.142 6.217 -5.825
5 HG2 LYS 34 HG2 LYS 34 5.200 8.201 -6.850
6 HG3 LYS 34 HG3 LYS 34 6.779 8.618 -7.519
7 HD2 LYS 34 HD2 LYS 34 6.781 6.505 -8.775
8 HD3 LYS 34 HD3 LYS 34 5.176 6.141 -8.142
9 HE2 LYS 34 HE2 LYS 34 4.276 8.112 -9.238
10 HE3 LYS 34 HE3 LYS 34 5.885 8.544 -9.817
11 HZ1 LYS 34 HZ1 LYS 34 4.400 6.081 -10.547
12 HZ2 LYS 34 HZ2 LYS 34 4.582 7.444 -11.527
13 HZ3 LYS 34 HZ3 LYS 34 5.934 6.516 -11.114
No H/Q in entry = 13
In of MODEL 9
1 H LYS 35 H LYS 35 9.538 6.932 -4.637
2 HA LYS 35 HA LYS 35 9.084 4.842 -2.821
3 HB2 LYS 35 HB2 LYS 35 11.450 6.228 -3.914
4 HB3 LYS 35 HB3 LYS 35 11.696 5.403 -2.381
5 HG2 LYS 35 HG2 LYS 35 12.253 4.023 -4.357
6 HG3 LYS 35 HG3 LYS 35 11.013 3.308 -3.325
7 HD2 LYS 35 HD2 LYS 35 9.281 4.105 -4.863
8 HD3 LYS 35 HD3 LYS 35 10.522 4.822 -5.889
9 HE2 LYS 35 HE2 LYS 35 9.728 2.652 -6.743
10 HE3 LYS 35 HE3 LYS 35 11.448 2.643 -6.362
11 HZ1 LYS 35 HZ1 LYS 35 9.387 1.654 -4.466
12 HZ2 LYS 35 HZ2 LYS 35 10.141 0.652 -5.608
13 HZ3 LYS 35 HZ3 LYS 35 11.061 1.411 -4.410
No H/Q in entry = 13
In of MODEL 9
1 H GLU 36 H GLU 36 9.113 8.205 -2.239
2 HA GLU 36 HA GLU 36 9.825 7.896 0.564
3 HB2 GLU 36 HB2 GLU 36 8.932 10.375 -0.905
4 HB3 GLU 36 HB3 GLU 36 9.647 10.302 0.701
5 HG2 GLU 36 HG2 GLU 36 11.675 9.300 -0.355
6 HG3 GLU 36 HG3 GLU 36 10.955 9.661 -1.912
No H/Q in entry = 6
In of MODEL 9
1 H LEU 37 H LEU 37 7.138 8.273 -1.511
2 HA LEU 37 HA LEU 37 5.156 8.587 0.540
3 HB2 LEU 37 HB2 LEU 37 4.873 7.652 -2.317
4 HB3 LEU 37 HB3 LEU 37 3.565 8.167 -1.270
5 HG LEU 37 HG LEU 37 5.836 9.992 -2.035
6 HD11 LEU 37 HD11 LEU 37 4.686 9.227 -4.051
7 HD12 LEU 37 HD12 LEU 37 3.147 9.741 -3.364
8 HD13 LEU 37 HD13 LEU 37 4.393 10.934 -3.731
9 HD21 LEU 37 HD21 LEU 37 3.074 10.482 -0.930
10 HD22 LEU 37 HD22 LEU 37 4.598 10.656 -0.061
11 HD23 LEU 37 HD23 LEU 37 4.222 11.736 -1.403
No H/Q in entry = 11
In of MODEL 9
1 H GLU 38 H GLU 38 6.374 5.960 -1.444
2 HA GLU 38 HA GLU 38 5.002 3.780 -0.396
3 HB2 GLU 38 HB2 GLU 38 6.503 3.671 -2.339
4 HB3 GLU 38 HB3 GLU 38 7.882 4.015 -1.310
5 HG2 GLU 38 HG2 GLU 38 7.135 1.848 -0.071
6 HG3 GLU 38 HG3 GLU 38 6.308 1.507 -1.591
No H/Q in entry = 6
In of MODEL 9
1 H ALA 39 H ALA 39 7.380 5.814 0.975
2 HA ALA 39 HA ALA 39 8.185 3.907 3.010
3 HB1 ALA 39 HB1 ALA 39 9.103 6.742 2.619
4 HB2 ALA 39 HB2 ALA 39 9.858 5.498 3.612
5 HB3 ALA 39 HB3 ALA 39 9.839 5.333 1.858
No H/Q in entry = 5
In of MODEL 9
1 H LYS 40 H LYS 40 6.386 6.952 2.808
2 HA LYS 40 HA LYS 40 6.210 7.287 5.616
3 HB2 LYS 40 HB2 LYS 40 5.930 9.032 3.743
4 HB3 LYS 40 HB3 LYS 40 4.292 8.414 3.588
5 HG2 LYS 40 HG2 LYS 40 4.308 10.378 4.972
6 HG3 LYS 40 HG3 LYS 40 3.867 8.968 5.932
7 HD2 LYS 40 HD2 LYS 40 5.369 10.286 7.230
8 HD3 LYS 40 HD3 LYS 40 6.247 8.856 6.706
9 HE2 LYS 40 HE2 LYS 40 6.399 11.337 5.056
10 HE3 LYS 40 HE3 LYS 40 7.324 11.251 6.552
11 HZ1 LYS 40 HZ1 LYS 40 8.379 9.229 5.729
12 HZ2 LYS 40 HZ2 LYS 40 7.518 9.347 4.281
13 HZ3 LYS 40 HZ3 LYS 40 8.654 10.529 4.688
No H/Q in entry = 13
In of MODEL 9
1 H ILE 41 H ILE 41 4.063 5.930 3.121
2 HA ILE 41 HA ILE 41 1.932 5.268 4.811
3 HB ILE 41 HB ILE 41 2.849 3.981 2.243
4 HG12 ILE 41 HG12 ILE 41 0.678 6.005 2.808
5 HG13 ILE 41 HG13 ILE 41 2.259 6.384 2.131
6 HG21 ILE 41 HG21 ILE 41 0.225 3.705 3.703
7 HG22 ILE 41 HG22 ILE 41 0.576 3.072 2.094
8 HG23 ILE 41 HG23 ILE 41 1.440 2.445 3.497
9 HD11 ILE 41 HD11 ILE 41 1.749 4.999 0.197
10 HD12 ILE 41 HD12 ILE 41 0.156 4.651 0.877
11 HD13 ILE 41 HD13 ILE 41 0.575 6.299 0.412
No H/Q in entry = 11
In of MODEL 9
1 H LEU 42 H LEU 42 4.773 3.371 3.801
2 HA LEU 42 HA LEU 42 4.015 1.011 5.139
3 HB2 LEU 42 HB2 LEU 42 6.715 2.040 4.309
4 HB3 LEU 42 HB3 LEU 42 6.490 0.476 5.059
5 HG LEU 42 HG LEU 42 5.521 1.394 2.367
6 HD11 LEU 42 HD11 LEU 42 7.817 0.620 2.481
7 HD12 LEU 42 HD12 LEU 42 7.287 -0.876 3.248
8 HD13 LEU 42 HD13 LEU 42 6.817 -0.525 1.587
9 HD21 LEU 42 HD21 LEU 42 4.724 -1.056 3.927
10 HD22 LEU 42 HD22 LEU 42 3.668 0.184 3.252
11 HD23 LEU 42 HD23 LEU 42 4.541 -0.916 2.178
No H/Q in entry = 11
In of MODEL 9
1 H HIS 43 H HIS 43 5.753 3.867 6.200
2 HA HIS 43 HA HIS 43 6.462 2.898 8.760
3 HB2 HIS 43 HB2 HIS 43 7.342 5.010 7.702
4 HB3 HIS 43 HB3 HIS 43 5.784 5.760 8.034
5 HD1 HIS 43 HD1 HIS 43 9.063 5.259 9.478
6 HD2 HIS 43 HD2 HIS 43 5.214 5.818 10.950
7 HE1 HIS 43 HE1 HIS 43 9.350 5.981 11.866
8 HE2 HIS 43 HE2 HIS 43 7.013 6.391 12.718
No H/Q in entry = 8
In of MODEL 9
1 H TYR 44 H TYR 44 3.594 4.766 7.648
2 HA TYR 44 HA TYR 44 2.207 4.819 10.075
3 HB2 TYR 44 HB2 TYR 44 1.093 4.591 7.268
4 HB3 TYR 44 HB3 TYR 44 0.154 5.019 8.693
5 HD1 TYR 44 HD1 TYR 44 2.137 6.809 10.019
6 HD2 TYR 44 HD2 TYR 44 0.884 6.541 5.971
7 HE1 TYR 44 HE1 TYR 44 2.699 9.160 9.704
8 HE2 TYR 44 HE2 TYR 44 1.448 8.912 5.620
9 HH TYR 44 HH TYR 44 1.735 10.940 6.948
No H/Q in entry = 9
In of MODEL 9
1 H TYR 45 H TYR 45 2.221 2.489 7.471
2 HA TYR 45 HA TYR 45 0.263 0.730 8.326
3 HB2 TYR 45 HB2 TYR 45 1.143 0.753 6.074
4 HB3 TYR 45 HB3 TYR 45 2.743 0.321 6.656
5 HD1 TYR 45 HD1 TYR 45 -0.743 -0.991 6.661
6 HD2 TYR 45 HD2 TYR 45 3.417 -1.827 6.537
7 HE1 TYR 45 HE1 TYR 45 -1.239 -3.370 6.305
8 HE2 TYR 45 HE2 TYR 45 2.945 -4.199 6.179
9 HH TYR 45 HH TYR 45 -0.099 -5.361 5.318
No H/Q in entry = 9
In of MODEL 9
1 H ASP 46 H ASP 46 3.760 0.705 8.971
2 HA ASP 46 HA ASP 46 3.602 -1.805 10.346
3 HB2 ASP 46 HB2 ASP 46 5.657 -1.133 9.137
4 HB3 ASP 46 HB3 ASP 46 5.866 0.210 10.255
No H/Q in entry = 4
In of MODEL 9
1 H GLU 47 H GLU 47 3.118 1.460 11.264
2 HA GLU 47 HA GLU 47 3.568 0.944 14.076
3 HB2 GLU 47 HB2 GLU 47 2.444 3.328 12.600
4 HB3 GLU 47 HB3 GLU 47 2.674 3.262 14.344
5 HG2 GLU 47 HG2 GLU 47 4.833 3.023 12.265
6 HG3 GLU 47 HG3 GLU 47 4.491 4.439 13.252
No H/Q in entry = 6
In of MODEL 9
1 H LEU 48 H LEU 48 1.194 0.156 11.925
2 HA LEU 48 HA LEU 48 -1.077 0.632 13.589
3 HB2 LEU 48 HB2 LEU 48 -0.667 -0.887 11.032
4 HB3 LEU 48 HB3 LEU 48 -2.198 -0.863 11.882
5 HG LEU 48 HG LEU 48 -0.804 1.572 10.776
6 HD11 LEU 48 HD11 LEU 48 -1.583 0.047 9.047
7 HD12 LEU 48 HD12 LEU 48 -3.176 0.007 9.803
8 HD13 LEU 48 HD13 LEU 48 -2.570 1.508 9.100
9 HD21 LEU 48 HD21 LEU 48 -3.537 1.175 11.985
10 HD22 LEU 48 HD22 LEU 48 -2.204 2.085 12.699
11 HD23 LEU 48 HD23 LEU 48 -2.967 2.655 11.213
No H/Q in entry = 11
In of MODEL 9
1 H GLU 49 H GLU 49 -2.290 -0.886 14.509
2 HA GLU 49 HA GLU 49 -1.215 -3.592 14.839
3 HB2 GLU 49 HB2 GLU 49 -1.545 -3.385 17.320
4 HB3 GLU 49 HB3 GLU 49 -0.223 -2.433 16.659
5 HG2 GLU 49 HG2 GLU 49 -1.867 -0.504 16.577
6 HG3 GLU 49 HG3 GLU 49 -2.904 -1.492 17.600
No H/Q in entry = 6
In of MODEL 9
1 H GLY 50 H GLY 50 -2.683 -5.103 15.824
2 HA2 GLY 50 HA2 GLY 50 -5.301 -4.545 16.616
3 HA3 GLY 50 HA3 GLY 50 -4.710 -6.117 16.111
No H/Q in entry = 3
In of MODEL 9
1 H ASP 51 H ASP 51 -7.222 -4.457 15.651
2 HA ASP 51 HA ASP 51 -7.896 -5.475 13.124
3 HB2 ASP 51 HB2 ASP 51 -9.143 -3.340 14.851
4 HB3 ASP 51 HB3 ASP 51 -9.829 -3.795 13.295
No H/Q in entry = 4
In of MODEL 9
1 H ALA 52 H ALA 52 -6.616 -2.311 14.069
2 HA ALA 52 HA ALA 52 -7.243 -0.988 11.658
3 HB1 ALA 52 HB1 ALA 52 -4.896 -0.441 13.463
4 HB2 ALA 52 HB2 ALA 52 -5.603 0.654 12.274
5 HB3 ALA 52 HB3 ALA 52 -6.529 0.183 13.696
No H/Q in entry = 5
In of MODEL 9
1 H LYS 53 H LYS 53 -4.339 -2.698 12.704
2 HA LYS 53 HA LYS 53 -2.810 -2.334 10.391
3 HB2 LYS 53 HB2 LYS 53 -2.245 -3.380 12.759
4 HB3 LYS 53 HB3 LYS 53 -2.628 -4.887 11.943
5 HG2 LYS 53 HG2 LYS 53 -0.628 -2.958 10.815
6 HG3 LYS 53 HG3 LYS 53 -0.184 -4.147 12.034
7 HD2 LYS 53 HD2 LYS 53 -0.914 -5.946 10.553
8 HD3 LYS 53 HD3 LYS 53 -1.398 -4.758 9.340
9 HE2 LYS 53 HE2 LYS 53 0.878 -4.024 9.073
10 HE3 LYS 53 HE3 LYS 53 1.409 -5.047 10.400
11 HZ1 LYS 53 HZ1 LYS 53 0.685 -6.981 9.058
12 HZ2 LYS 53 HZ2 LYS 53 0.388 -5.936 7.761
13 HZ3 LYS 53 HZ3 LYS 53 1.958 -6.112 8.366
No H/Q in entry = 13
In of MODEL 9
1 H LYS 54 H LYS 54 -4.842 -5.092 11.360
2 HA LYS 54 HA LYS 54 -4.632 -6.597 9.042
3 HB2 LYS 54 HB2 LYS 54 -6.002 -7.952 10.139
4 HB3 LYS 54 HB3 LYS 54 -6.109 -6.734 11.399
5 HG2 LYS 54 HG2 LYS 54 -8.142 -5.936 10.636
6 HG3 LYS 54 HG3 LYS 54 -7.915 -6.614 9.022
7 HD2 LYS 54 HD2 LYS 54 -8.077 -8.869 9.993
8 HD3 LYS 54 HD3 LYS 54 -8.425 -8.139 11.562
9 HE2 LYS 54 HE2 LYS 54 -10.494 -8.807 10.497
10 HE3 LYS 54 HE3 LYS 54 -10.409 -7.050 10.595
11 HZ1 LYS 54 HZ1 LYS 54 -9.737 -8.632 8.176
12 HZ2 LYS 54 HZ2 LYS 54 -11.218 -7.861 8.436
13 HZ3 LYS 54 HZ3 LYS 54 -9.801 -6.947 8.281
No H/Q in entry = 13
In of MODEL 9
1 H GLU 55 H GLU 55 -6.939 -3.973 9.781
2 HA GLU 55 HA GLU 55 -8.392 -4.235 7.400
3 HB2 GLU 55 HB2 GLU 55 -8.083 -2.067 9.484
4 HB3 GLU 55 HB3 GLU 55 -9.065 -1.805 8.051
5 HG2 GLU 55 HG2 GLU 55 -10.413 -3.787 8.662
6 HG3 GLU 55 HG3 GLU 55 -9.473 -3.916 10.146
No H/Q in entry = 6
In of MODEL 9
1 H ALA 56 H ALA 56 -5.797 -1.956 8.332
2 HA ALA 56 HA ALA 56 -5.744 -0.674 5.867
3 HB1 ALA 56 HB1 ALA 56 -3.495 0.068 6.447
4 HB2 ALA 56 HB2 ALA 56 -3.385 -1.179 7.689
5 HB3 ALA 56 HB3 ALA 56 -4.537 0.144 7.870
No H/Q in entry = 5
In of MODEL 9
1 H THR 57 H THR 57 -3.860 -3.440 7.028
2 HA THR 57 HA THR 57 -2.336 -4.054 4.855
3 HB THR 57 HB THR 57 -3.821 -6.014 6.614
4 HG1 THR 57 HG1 THR 57 -2.519 -4.796 7.908
5 HG21 THR 57 HG21 THR 57 -1.461 -6.359 4.772
6 HG22 THR 57 HG22 THR 57 -1.909 -7.525 6.020
7 HG23 THR 57 HG23 THR 57 -3.022 -7.176 4.695
No H/Q in entry = 7
In of MODEL 9
1 H GLU 58 H GLU 58 -5.675 -5.110 5.416
2 HA GLU 58 HA GLU 58 -5.893 -6.532 2.947
3 HB2 GLU 58 HB2 GLU 58 -8.114 -6.963 3.525
4 HB3 GLU 58 HB3 GLU 58 -7.207 -6.992 5.030
5 HG2 GLU 58 HG2 GLU 58 -7.952 -4.734 5.508
6 HG3 GLU 58 HG3 GLU 58 -8.886 -4.739 4.015
No H/Q in entry = 6
In of MODEL 9
1 H HIS 59 H HIS 59 -6.301 -3.215 3.820
2 HA HIS 59 HA HIS 59 -7.846 -2.559 1.477
3 HB2 HIS 59 HB2 HIS 59 -6.399 -0.873 3.516
4 HB3 HIS 59 HB3 HIS 59 -7.138 -0.170 2.084
5 HD1 HIS 59 HD1 HIS 59 -9.800 -1.709 2.029
6 HD2 HIS 59 HD2 HIS 59 -8.113 -0.085 5.465
7 HE1 HIS 59 HE1 HIS 59 -11.702 -1.409 3.644
8 HE2 HIS 59 HE2 HIS 59 -10.680 -0.298 5.659
No H/Q in entry = 8
In of MODEL 9
1 H LEU 60 H LEU 60 -4.469 -2.027 2.502
2 HA LEU 60 HA LEU 60 -3.474 -1.232 0.062
3 HB2 LEU 60 HB2 LEU 60 -2.255 -2.622 2.413
4 HB3 LEU 60 HB3 LEU 60 -1.309 -2.309 0.966
5 HG LEU 60 HG LEU 60 -1.966 0.084 1.193
6 HD11 LEU 60 HD11 LEU 60 -3.876 -0.165 2.583
7 HD12 LEU 60 HD12 LEU 60 -2.854 -0.734 3.910
8 HD13 LEU 60 HD13 LEU 60 -2.692 0.923 3.316
9 HD21 LEU 60 HD21 LEU 60 -0.331 -1.117 3.410
10 HD22 LEU 60 HD22 LEU 60 0.254 -0.672 1.807
11 HD23 LEU 60 HD23 LEU 60 -0.296 0.578 2.923
No H/Q in entry = 11
In of MODEL 9
1 H LYS 61 H LYS 61 -4.208 -4.475 1.265
2 HA LYS 61 HA LYS 61 -2.950 -5.949 -0.758
3 HB2 LYS 61 HB2 LYS 61 -5.335 -6.475 0.987
4 HB3 LYS 61 HB3 LYS 61 -4.927 -7.590 -0.306
5 HG2 LYS 61 HG2 LYS 61 -2.744 -7.976 0.674
6 HG3 LYS 61 HG3 LYS 61 -3.087 -6.800 1.943
7 HD2 LYS 61 HD2 LYS 61 -4.877 -8.174 2.795
8 HD3 LYS 61 HD3 LYS 61 -4.697 -9.301 1.452
9 HE2 LYS 61 HE2 LYS 61 -2.521 -9.963 2.235
10 HE3 LYS 61 HE3 LYS 61 -2.553 -8.727 3.491
11 HZ1 LYS 61 HZ1 LYS 61 -4.400 -11.045 3.313
12 HZ2 LYS 61 HZ2 LYS 61 -3.080 -10.922 4.364
13 HZ3 LYS 61 HZ3 LYS 61 -4.397 -9.873 4.532
No H/Q in entry = 13
In of MODEL 9
1 H GLY 62 H GLY 62 -6.366 -4.923 -0.547
2 HA2 GLY 62 HA2 GLY 62 -7.832 -4.290 -2.190
3 HA3 GLY 62 HA3 GLY 62 -7.092 -5.548 -3.167
No H/Q in entry = 3
In of MODEL 9
1 H GLY 63 H GLY 63 -5.614 -2.582 -1.883
2 HA2 GLY 63 HA2 GLY 63 -4.372 -0.968 -2.934
3 HA3 GLY 63 HA3 GLY 63 -5.569 -1.073 -4.216
No H/Q in entry = 3
In of MODEL 9
1 H CYS 64 H CYS 64 -2.980 -3.192 -2.998
2 HA CYS 64 HA CYS 64 -1.426 -2.976 -5.361
3 HB2 CYS 64 HB2 CYS 64 -0.446 -3.621 -3.202
4 HB3 CYS 64 HB3 CYS 64 -1.375 -5.119 -3.224
No H/Q in entry = 4
In of MODEL 9
1 H ARG 65 H ARG 65 -4.081 -4.984 -4.397
2 HA ARG 65 HA ARG 65 -3.895 -6.988 -6.338
3 HB2 ARG 65 HB2 ARG 65 -5.510 -7.059 -4.486
4 HB3 ARG 65 HB3 ARG 65 -6.374 -5.699 -5.184
5 HG2 ARG 65 HG2 ARG 65 -6.910 -7.052 -7.150
6 HG3 ARG 65 HG3 ARG 65 -6.060 -8.420 -6.429
7 HD2 ARG 65 HD2 ARG 65 -8.451 -7.015 -5.252
8 HD3 ARG 65 HD3 ARG 65 -8.483 -8.565 -6.087
9 HE ARG 65 HE ARG 65 -6.643 -8.726 -3.989
10 HH11 ARG 65 HH11 ARG 65 -10.092 -8.395 -4.465
11 HH12 ARG 65 HH12 ARG 65 -10.505 -9.195 -2.982
12 HH21 ARG 65 HH21 ARG 65 -7.186 -9.782 -2.028
13 HH22 ARG 65 HH22 ARG 65 -8.853 -9.977 -1.597
No H/Q in entry = 13
In of MODEL 9
1 H GLU 66 H GLU 66 -5.355 -3.744 -6.457
2 HA GLU 66 HA GLU 66 -6.180 -3.927 -9.161
3 HB2 GLU 66 HB2 GLU 66 -5.464 -1.468 -7.551
4 HB3 GLU 66 HB3 GLU 66 -6.287 -1.457 -9.105
5 HG2 GLU 66 HG2 GLU 66 -8.084 -2.864 -8.013
6 HG3 GLU 66 HG3 GLU 66 -7.307 -2.485 -6.477
No H/Q in entry = 6
In of MODEL 9
1 H ILE 67 H ILE 67 -3.170 -3.022 -7.604
2 HA ILE 67 HA ILE 67 -1.745 -2.137 -9.858
3 HB ILE 67 HB ILE 67 -0.629 -3.758 -7.559
4 HG12 ILE 67 HG12 ILE 67 -1.849 -1.769 -6.755
5 HG13 ILE 67 HG13 ILE 67 -0.118 -1.644 -6.464
6 HG21 ILE 67 HG21 ILE 67 0.716 -1.859 -9.474
7 HG22 ILE 67 HG22 ILE 67 1.488 -2.638 -8.093
8 HG23 ILE 67 HG23 ILE 67 0.898 -3.614 -9.438
9 HD11 ILE 67 HD11 ILE 67 0.085 -0.173 -8.398
10 HD12 ILE 67 HD12 ILE 67 -1.655 -0.289 -8.659
11 HD13 ILE 67 HD13 ILE 67 -1.033 0.458 -7.188
No H/Q in entry = 11
In of MODEL 9
1 H LEU 68 H LEU 68 -1.953 -5.370 -8.402
2 HA LEU 68 HA LEU 68 -0.445 -6.676 -10.407
3 HB2 LEU 68 HB2 LEU 68 -0.939 -7.425 -8.017
4 HB3 LEU 68 HB3 LEU 68 -2.492 -7.969 -8.620
5 HG LEU 68 HG LEU 68 -1.374 -9.521 -10.145
6 HD11 LEU 68 HD11 LEU 68 0.662 -8.226 -10.534
7 HD12 LEU 68 HD12 LEU 68 1.168 -8.520 -8.868
8 HD13 LEU 68 HD13 LEU 68 1.038 -9.866 -10.000
9 HD21 LEU 68 HD21 LEU 68 -0.432 -9.734 -7.286
10 HD22 LEU 68 HD22 LEU 68 -1.981 -10.296 -7.918
11 HD23 LEU 68 HD23 LEU 68 -0.483 -11.056 -8.452
No H/Q in entry = 11
In of MODEL 9
1 H LYS 69 H LYS 69 -3.854 -6.043 -9.973
2 HA LYS 69 HA LYS 69 -4.766 -7.584 -12.142
3 HB2 LYS 69 HB2 LYS 69 -5.924 -5.167 -10.782
4 HB3 LYS 69 HB3 LYS 69 -6.703 -5.892 -12.181
5 HG2 LYS 69 HG2 LYS 69 -6.711 -8.066 -10.919
6 HG3 LYS 69 HG3 LYS 69 -6.187 -7.156 -9.504
7 HD2 LYS 69 HD2 LYS 69 -8.598 -7.466 -9.467
8 HD3 LYS 69 HD3 LYS 69 -8.205 -5.757 -9.676
9 HE2 LYS 69 HE2 LYS 69 -8.682 -5.873 -12.019
10 HE3 LYS 69 HE3 LYS 69 -8.862 -7.624 -11.950
11 HZ1 LYS 69 HZ1 LYS 69 -10.617 -5.701 -10.529
12 HZ2 LYS 69 HZ2 LYS 69 -10.986 -6.415 -12.016
13 HZ3 LYS 69 HZ3 LYS 69 -10.825 -7.377 -10.635
No H/Q in entry = 13
In of MODEL 9
1 H HIS 70 H HIS 70 -2.785 -4.927 -12.102
2 HA HIS 70 HA HIS 70 -3.514 -4.143 -14.824
3 HB2 HIS 70 HB2 HIS 70 -3.416 -2.279 -13.218
4 HB3 HIS 70 HB3 HIS 70 -1.754 -2.706 -12.823
5 HD1 HIS 70 HD1 HIS 70 -3.715 -0.624 -15.044
6 HD2 HIS 70 HD2 HIS 70 0.034 -2.437 -15.131
7 HE1 HIS 70 HE1 HIS 70 -2.446 0.558 -16.856
8 HE2 HIS 70 HE2 HIS 70 -0.177 -0.531 -16.905
No H/Q in entry = 8
In of MODEL 9
1 H VAL 71 H VAL 71 -0.697 -4.715 -12.746
2 HA VAL 71 HA VAL 71 1.156 -4.654 -14.826
3 HB VAL 71 HB VAL 71 1.833 -4.034 -12.646
4 HG11 VAL 71 HG11 VAL 71 1.150 -6.787 -11.790
5 HG12 VAL 71 HG12 VAL 71 2.063 -5.618 -10.826
6 HG13 VAL 71 HG13 VAL 71 0.396 -5.269 -11.304
7 HG21 VAL 71 HG21 VAL 71 3.143 -6.534 -13.592
8 HG22 VAL 71 HG22 VAL 71 3.616 -4.862 -13.892
9 HG23 VAL 71 HG23 VAL 71 3.775 -5.545 -12.277
No H/Q in entry = 9
In of MODEL 9
1 H VAL 72 H VAL 72 -0.161 -7.423 -13.016
2 HA VAL 72 HA VAL 72 1.163 -9.207 -14.901
3 HB VAL 72 HB VAL 72 0.838 -9.501 -12.267
4 HG11 VAL 72 HG11 VAL 72 -1.591 -10.804 -13.429
5 HG12 VAL 72 HG12 VAL 72 -0.907 -11.229 -11.859
6 HG13 VAL 72 HG13 VAL 72 -1.512 -9.597 -12.149
7 HG21 VAL 72 HG21 VAL 72 0.880 -11.661 -14.327
8 HG22 VAL 72 HG22 VAL 72 2.257 -10.873 -13.560
9 HG23 VAL 72 HG23 VAL 72 1.198 -11.918 -12.612
No H/Q in entry = 9
In of MODEL 9
1 H GLY 73 H GLY 73 -1.883 -7.779 -14.265
2 HA2 GLY 73 HA2 GLY 73 -3.017 -9.185 -16.558
3 HA3 GLY 73 HA3 GLY 73 -3.607 -7.676 -15.873
No H/Q in entry = 3
In of MODEL 9
1 H GLU 74 H GLU 74 -5.606 -9.086 -16.244
2 HA GLU 74 HA GLU 74 -6.603 -9.893 -13.724
3 HB2 GLU 74 HB2 GLU 74 -8.030 -8.974 -15.521
4 HB3 GLU 74 HB3 GLU 74 -7.727 -10.412 -16.486
5 HG2 GLU 74 HG2 GLU 74 -8.823 -11.783 -14.789
6 HG3 GLU 74 HG3 GLU 74 -9.130 -10.338 -13.828
No H/Q in entry = 6
In of MODEL 9
1 H GLU 75 H GLU 75 -5.350 -11.591 -16.510
2 HA GLU 75 HA GLU 75 -5.943 -14.222 -16.142
3 HB2 GLU 75 HB2 GLU 75 -4.596 -13.499 -17.984
4 HB3 GLU 75 HB3 GLU 75 -3.309 -12.972 -16.908
5 HG2 GLU 75 HG2 GLU 75 -3.112 -15.382 -16.179
6 HG3 GLU 75 HG3 GLU 75 -4.160 -15.779 -17.542
No H/Q in entry = 6
In of MODEL 9
1 H LYS 76 H LYS 76 -2.960 -12.812 -14.777
2 HA LYS 76 HA LYS 76 -2.439 -15.243 -13.420
3 HB2 LYS 76 HB2 LYS 76 -1.067 -12.583 -13.497
4 HB3 LYS 76 HB3 LYS 76 -0.531 -13.867 -12.440
5 HG2 LYS 76 HG2 LYS 76 -0.905 -14.511 -15.305
6 HG3 LYS 76 HG3 LYS 76 0.488 -13.537 -14.841
7 HD2 LYS 76 HD2 LYS 76 1.377 -15.636 -14.658
8 HD3 LYS 76 HD3 LYS 76 0.784 -15.408 -13.021
9 HE2 LYS 76 HE2 LYS 76 0.202 -17.596 -13.752
10 HE3 LYS 76 HE3 LYS 76 -1.260 -16.634 -13.649
11 HZ1 LYS 76 HZ1 LYS 76 -0.932 -16.233 -16.126
12 HZ2 LYS 76 HZ2 LYS 76 0.183 -17.509 -16.069
13 HZ3 LYS 76 HZ3 LYS 76 -1.438 -17.781 -15.652
No H/Q in entry = 13
In of MODEL 9
1 H ALA 77 H ALA 77 -3.524 -12.045 -12.408
2 HA ALA 77 HA ALA 77 -3.388 -12.521 -9.638
3 HB1 ALA 77 HB1 ALA 77 -4.892 -10.609 -9.413
4 HB2 ALA 77 HB2 ALA 77 -5.261 -10.682 -11.136
5 HB3 ALA 77 HB3 ALA 77 -3.630 -10.276 -10.600
No H/Q in entry = 5
In of MODEL 9
1 H ALA 78 H ALA 78 -5.688 -13.418 -12.087
2 HA ALA 78 HA ALA 78 -7.779 -14.243 -10.332
3 HB1 ALA 78 HB1 ALA 78 -7.130 -14.892 -13.207
4 HB2 ALA 78 HB2 ALA 78 -8.345 -13.765 -12.595
5 HB3 ALA 78 HB3 ALA 78 -8.563 -15.502 -12.371
No H/Q in entry = 5
In of MODEL 9
1 H GLU 79 H GLU 79 -4.980 -15.787 -11.807
2 HA GLU 79 HA GLU 79 -5.653 -18.411 -10.883
3 HB2 GLU 79 HB2 GLU 79 -2.970 -17.375 -11.834
4 HB3 GLU 79 HB3 GLU 79 -3.445 -19.065 -11.680
5 HG2 GLU 79 HG2 GLU 79 -5.371 -18.334 -13.300
6 HG3 GLU 79 HG3 GLU 79 -4.245 -17.042 -13.697
No H/Q in entry = 6
In of MODEL 9
1 H LEU 80 H LEU 80 -3.887 -15.698 -9.633
2 HA LEU 80 HA LEU 80 -2.730 -17.141 -7.439
3 HB2 LEU 80 HB2 LEU 80 -3.062 -14.177 -7.894
4 HB3 LEU 80 HB3 LEU 80 -2.030 -14.923 -6.682
5 HG LEU 80 HG LEU 80 -1.696 -15.388 -9.640
6 HD11 LEU 80 HD11 LEU 80 -0.346 -13.381 -7.858
7 HD12 LEU 80 HD12 LEU 80 0.232 -13.845 -9.461
8 HD13 LEU 80 HD13 LEU 80 -1.342 -13.067 -9.282
9 HD21 LEU 80 HD21 LEU 80 -0.805 -17.098 -8.115
10 HD22 LEU 80 HD22 LEU 80 0.457 -16.263 -9.026
11 HD23 LEU 80 HD23 LEU 80 0.173 -15.858 -7.331
No H/Q in entry = 11
In of MODEL 9
1 H LYS 81 H LYS 81 -5.542 -15.059 -7.943
2 HA LYS 81 HA LYS 81 -6.538 -15.034 -5.334
3 HB2 LYS 81 HB2 LYS 81 -7.710 -13.628 -6.753
4 HB3 LYS 81 HB3 LYS 81 -7.741 -14.797 -8.060
5 HG2 LYS 81 HG2 LYS 81 -9.967 -14.473 -7.245
6 HG3 LYS 81 HG3 LYS 81 -9.434 -16.094 -6.812
7 HD2 LYS 81 HD2 LYS 81 -10.540 -15.249 -4.911
8 HD3 LYS 81 HD3 LYS 81 -8.820 -15.144 -4.545
9 HE2 LYS 81 HE2 LYS 81 -8.801 -12.799 -4.975
10 HE3 LYS 81 HE3 LYS 81 -10.438 -12.848 -5.627
11 HZ1 LYS 81 HZ1 LYS 81 -9.685 -13.406 -2.811
12 HZ2 LYS 81 HZ2 LYS 81 -10.412 -11.989 -3.374
13 HZ3 LYS 81 HZ3 LYS 81 -11.256 -13.450 -3.440
No H/Q in entry = 13
In of MODEL 9
1 H ASN 82 H ASN 82 -7.210 -17.307 -7.989
2 HA ASN 82 HA ASN 82 -8.777 -19.047 -6.400
3 HB2 ASN 82 HB2 ASN 82 -8.799 -18.940 -8.917
4 HB3 ASN 82 HB3 ASN 82 -7.235 -19.740 -8.914
5 HD21 ASN 82 HD21 ASN 82 -10.631 -20.095 -8.399
6 HD22 ASN 82 HD22 ASN 82 -10.649 -21.821 -8.326
No H/Q in entry = 6
In of MODEL 9
1 H LEU 83 H LEU 83 -5.327 -18.773 -6.967
2 HA LEU 83 HA LEU 83 -4.580 -21.300 -5.994
3 HB2 LEU 83 HB2 LEU 83 -3.308 -18.765 -6.656
4 HB3 LEU 83 HB3 LEU 83 -2.564 -19.542 -5.286
5 HG LEU 83 HG LEU 83 -3.004 -20.948 -7.910
6 HD11 LEU 83 HD11 LEU 83 -0.574 -19.442 -6.955
7 HD12 LEU 83 HD12 LEU 83 -0.619 -20.513 -8.356
8 HD13 LEU 83 HD13 LEU 83 -1.590 -19.042 -8.343
9 HD21 LEU 83 HD21 LEU 83 -2.663 -22.363 -5.919
10 HD22 LEU 83 HD22 LEU 83 -1.348 -22.500 -7.087
11 HD23 LEU 83 HD23 LEU 83 -1.131 -21.538 -5.624
No H/Q in entry = 11
In of MODEL 9
1 H LYS 84 H LYS 84 -5.115 -18.172 -4.458
2 HA LYS 84 HA LYS 84 -4.288 -18.809 -1.864
3 HB2 LYS 84 HB2 LYS 84 -4.681 -16.524 -2.530
4 HB3 LYS 84 HB3 LYS 84 -6.373 -16.862 -2.855
5 HG2 LYS 84 HG2 LYS 84 -6.762 -17.255 -0.481
6 HG3 LYS 84 HG3 LYS 84 -5.059 -16.944 -0.147
7 HD2 LYS 84 HD2 LYS 84 -5.267 -14.668 -0.879
8 HD3 LYS 84 HD3 LYS 84 -6.914 -14.954 -1.446
9 HE2 LYS 84 HE2 LYS 84 -6.906 -13.774 0.691
10 HE3 LYS 84 HE3 LYS 84 -7.640 -15.368 0.844
11 HZ1 LYS 84 HZ1 LYS 84 -4.837 -14.734 1.582
12 HZ2 LYS 84 HZ2 LYS 84 -6.120 -14.820 2.676
13 HZ3 LYS 84 HZ3 LYS 84 -5.636 -16.200 1.832
No H/Q in entry = 13
In of MODEL 9
1 H ASP 85 H ASP 85 -7.612 -18.820 -3.200
2 HA ASP 85 HA ASP 85 -8.758 -19.948 -0.871
3 HB2 ASP 85 HB2 ASP 85 -9.747 -19.580 -3.683
4 HB3 ASP 85 HB3 ASP 85 -10.709 -20.449 -2.491
No H/Q in entry = 4
In of MODEL 9
1 H SER 86 H SER 86 -7.187 -21.402 -3.610
2 HA SER 86 HA SER 86 -8.342 -24.003 -3.145
3 HB2 SER 86 HB2 SER 86 -7.522 -23.202 -5.399
4 HB3 SER 86 HB3 SER 86 -5.880 -23.369 -4.781
5 HG SER 86 HG SER 86 -6.642 -25.625 -4.244
No H/Q in entry = 5
In of MODEL 9
1 H GLY 87 H GLY 87 -5.916 -22.164 -1.725
2 HA2 GLY 87 HA2 GLY 87 -5.040 -24.562 -0.253
3 HA3 GLY 87 HA3 GLY 87 -5.124 -22.946 0.425
No H/Q in entry = 3
In of MODEL 9
1 H ALA 88 H ALA 88 -3.859 -21.735 -1.984
2 HA ALA 88 HA ALA 88 -1.191 -22.742 -1.968
3 HB1 ALA 88 HB1 ALA 88 -2.188 -19.996 -2.729
4 HB2 ALA 88 HB2 ALA 88 -2.015 -21.372 -3.819
5 HB3 ALA 88 HB3 ALA 88 -0.588 -20.651 -3.077
No H/Q in entry = 5
In of MODEL 9
1 H SER 89 H SER 89 0.181 -22.483 -0.418
2 HA SER 89 HA SER 89 -0.353 -21.072 1.972
3 HB2 SER 89 HB2 SER 89 2.248 -22.309 1.055
4 HB3 SER 89 HB3 SER 89 1.736 -21.994 2.706
5 HG SER 89 HG SER 89 -0.129 -23.444 2.061
No H/Q in entry = 5
In of MODEL 9
1 H LYS 90 H LYS 90 1.593 -19.685 2.878
2 HA LYS 90 HA LYS 90 1.512 -17.271 1.503
3 HB2 LYS 90 HB2 LYS 90 3.608 -18.142 3.500
4 HB3 LYS 90 HB3 LYS 90 3.205 -16.485 3.071
5 HG2 LYS 90 HG2 LYS 90 1.353 -18.444 4.418
6 HG3 LYS 90 HG3 LYS 90 2.237 -17.147 5.221
7 HD2 LYS 90 HD2 LYS 90 1.017 -15.483 3.975
8 HD3 LYS 90 HD3 LYS 90 0.226 -16.727 3.010
9 HE2 LYS 90 HE2 LYS 90 -0.874 -17.582 5.018
10 HE3 LYS 90 HE3 LYS 90 -0.072 -16.350 5.989
11 HZ1 LYS 90 HZ1 LYS 90 -1.915 -15.754 3.742
12 HZ2 LYS 90 HZ2 LYS 90 -2.383 -15.789 5.366
13 HZ3 LYS 90 HZ3 LYS 90 -1.253 -14.648 4.837
No H/Q in entry = 13
In of MODEL 9
1 H GLU 91 H GLU 91 3.909 -19.843 1.419
2 HA GLU 91 HA GLU 91 5.836 -18.357 -0.058
3 HB2 GLU 91 HB2 GLU 91 5.546 -21.311 0.439
4 HB3 GLU 91 HB3 GLU 91 6.907 -20.589 -0.409
5 HG2 GLU 91 HG2 GLU 91 7.374 -19.235 1.618
6 HG3 GLU 91 HG3 GLU 91 6.098 -20.121 2.451
No H/Q in entry = 6
In of MODEL 9
1 H GLU 92 H GLU 92 3.390 -20.737 -1.043
2 HA GLU 92 HA GLU 92 3.928 -20.973 -3.723
3 HB2 GLU 92 HB2 GLU 92 1.237 -20.813 -2.373
4 HB3 GLU 92 HB3 GLU 92 1.568 -21.516 -3.946
5 HG2 GLU 92 HG2 GLU 92 2.645 -22.499 -1.332
6 HG3 GLU 92 HG3 GLU 92 1.307 -23.198 -2.234
No H/Q in entry = 6
In of MODEL 9
1 H LEU 93 H LEU 93 1.940 -18.568 -2.033
2 HA LEU 93 HA LEU 93 1.569 -17.044 -4.430
3 HB2 LEU 93 HB2 LEU 93 1.196 -16.256 -1.535
4 HB3 LEU 93 HB3 LEU 93 0.726 -15.258 -2.906
5 HG LEU 93 HG LEU 93 -0.379 -17.980 -2.199
6 HD11 LEU 93 HD11 LEU 93 -1.619 -15.247 -2.217
7 HD12 LEU 93 HD12 LEU 93 -2.518 -16.757 -2.054
8 HD13 LEU 93 HD13 LEU 93 -1.340 -16.293 -0.820
9 HD21 LEU 93 HD21 LEU 93 -0.900 -16.240 -4.600
10 HD22 LEU 93 HD22 LEU 93 -0.231 -17.871 -4.578
11 HD23 LEU 93 HD23 LEU 93 -1.910 -17.605 -4.119
No H/Q in entry = 11
In of MODEL 9
1 H LYS 94 H LYS 94 4.046 -17.040 -1.875
2 HA LYS 94 HA LYS 94 5.038 -14.488 -2.604
3 HB2 LYS 94 HB2 LYS 94 5.481 -15.584 -0.418
4 HB3 LYS 94 HB3 LYS 94 6.523 -16.735 -1.236
5 HG2 LYS 94 HG2 LYS 94 8.018 -14.947 -1.911
6 HG3 LYS 94 HG3 LYS 94 6.957 -13.758 -1.155
7 HD2 LYS 94 HD2 LYS 94 8.811 -14.232 0.321
8 HD3 LYS 94 HD3 LYS 94 7.320 -14.864 1.024
9 HE2 LYS 94 HE2 LYS 94 7.889 -17.102 0.262
10 HE3 LYS 94 HE3 LYS 94 9.352 -16.488 -0.505
11 HZ1 LYS 94 HZ1 LYS 94 10.168 -15.827 1.669
12 HZ2 LYS 94 HZ2 LYS 94 8.766 -16.418 2.405
13 HZ3 LYS 94 HZ3 LYS 94 9.833 -17.482 1.640
No H/Q in entry = 13
In of MODEL 9
1 H ALA 95 H ALA 95 5.799 -17.747 -3.579
2 HA ALA 95 HA ALA 95 8.035 -16.824 -5.170
3 HB1 ALA 95 HB1 ALA 95 8.244 -18.876 -3.840
4 HB2 ALA 95 HB2 ALA 95 8.504 -19.166 -5.560
5 HB3 ALA 95 HB3 ALA 95 6.974 -19.619 -4.811
No H/Q in entry = 5
In of MODEL 9
1 H LYS 96 H LYS 96 4.972 -18.606 -5.744
2 HA LYS 96 HA LYS 96 5.272 -18.691 -8.547
3 HB2 LYS 96 HB2 LYS 96 2.850 -18.829 -6.775
4 HB3 LYS 96 HB3 LYS 96 2.747 -18.970 -8.513
5 HG2 LYS 96 HG2 LYS 96 4.310 -20.781 -6.692
6 HG3 LYS 96 HG3 LYS 96 2.759 -21.155 -7.447
7 HD2 LYS 96 HD2 LYS 96 3.765 -21.016 -9.647
8 HD3 LYS 96 HD3 LYS 96 5.308 -20.535 -8.938
9 HE2 LYS 96 HE2 LYS 96 5.322 -22.711 -7.711
10 HE3 LYS 96 HE3 LYS 96 3.902 -23.179 -8.646
11 HZ1 LYS 96 HZ1 LYS 96 6.477 -22.359 -9.871
12 HZ2 LYS 96 HZ2 LYS 96 6.056 -23.972 -9.558
13 HZ3 LYS 96 HZ3 LYS 96 5.143 -23.058 -10.647
No H/Q in entry = 13
In of MODEL 9
1 H VAL 97 H VAL 97 4.250 -16.145 -6.454
2 HA VAL 97 HA VAL 97 2.978 -14.478 -8.354
3 HB VAL 97 HB VAL 97 3.292 -14.270 -5.706
4 HG11 VAL 97 HG11 VAL 97 5.284 -12.475 -6.973
5 HG12 VAL 97 HG12 VAL 97 4.663 -12.229 -5.338
6 HG13 VAL 97 HG13 VAL 97 5.568 -13.693 -5.741
7 HG21 VAL 97 HG21 VAL 97 1.614 -13.126 -7.039
8 HG22 VAL 97 HG22 VAL 97 2.382 -12.016 -5.906
9 HG23 VAL 97 HG23 VAL 97 2.837 -11.989 -7.608
No H/Q in entry = 9
In of MODEL 9
1 H GLU 98 H GLU 98 6.296 -15.047 -7.491
2 HA GLU 98 HA GLU 98 7.309 -12.810 -8.941
3 HB2 GLU 98 HB2 GLU 98 8.636 -15.206 -7.698
4 HB3 GLU 98 HB3 GLU 98 9.528 -13.926 -8.516
5 HG2 GLU 98 HG2 GLU 98 7.656 -13.436 -6.204
6 HG3 GLU 98 HG3 GLU 98 9.394 -13.722 -6.022
No H/Q in entry = 6
In of MODEL 9
1 H GLU 99 H GLU 99 6.627 -16.139 -9.711
2 HA GLU 99 HA GLU 99 8.126 -16.210 -12.126
3 HB2 GLU 99 HB2 GLU 99 5.689 -17.769 -11.260
4 HB3 GLU 99 HB3 GLU 99 6.566 -18.078 -12.752
5 HG2 GLU 99 HG2 GLU 99 8.615 -18.449 -11.365
6 HG3 GLU 99 HG3 GLU 99 7.580 -18.354 -9.942
No H/Q in entry = 6
In of MODEL 9
1 H ALA 100 H ALA 100 4.888 -15.185 -11.286
2 HA ALA 100 HA ALA 100 4.126 -14.534 -13.960
3 HB1 ALA 100 HB1 ALA 100 2.977 -13.503 -11.371
4 HB2 ALA 100 HB2 ALA 100 2.529 -15.032 -12.132
5 HB3 ALA 100 HB3 ALA 100 2.198 -13.509 -12.955
No H/Q in entry = 5
In of MODEL 9
1 H LEU 101 H LEU 101 5.289 -12.657 -11.185
2 HA LEU 101 HA LEU 101 5.327 -10.142 -12.442
3 HB2 LEU 101 HB2 LEU 101 6.593 -11.321 -10.013
4 HB3 LEU 101 HB3 LEU 101 7.112 -9.742 -10.556
5 HG LEU 101 HG LEU 101 5.304 -9.883 -8.735
6 HD11 LEU 101 HD11 LEU 101 4.856 -8.197 -11.190
7 HD12 LEU 101 HD12 LEU 101 4.189 -7.880 -9.589
8 HD13 LEU 101 HD13 LEU 101 5.932 -7.816 -9.843
9 HD21 LEU 101 HD21 LEU 101 3.865 -11.521 -9.856
10 HD22 LEU 101 HD22 LEU 101 3.013 -10.019 -9.502
11 HD23 LEU 101 HD23 LEU 101 3.560 -10.356 -11.143
No H/Q in entry = 11
In of MODEL 9
1 H HIS 102 H HIS 102 7.560 -12.797 -12.637
2 HA HIS 102 HA HIS 102 9.616 -11.136 -13.812
3 HB2 HIS 102 HB2 HIS 102 9.335 -14.125 -13.530
4 HB3 HIS 102 HB3 HIS 102 10.658 -13.378 -14.417
5 HD1 HIS 102 HD1 HIS 102 11.423 -15.065 -12.075
6 HD2 HIS 102 HD2 HIS 102 10.538 -11.023 -11.695
7 HE1 HIS 102 HE1 HIS 102 12.511 -14.333 -9.931
8 HE2 HIS 102 HE2 HIS 102 11.838 -11.925 -9.647
No H/Q in entry = 8
In of MODEL 9
1 H ALA 103 H ALA 103 7.125 -13.411 -14.899
2 HA ALA 103 HA ALA 103 7.985 -13.615 -17.551
3 HB1 ALA 103 HB1 ALA 103 5.200 -14.027 -16.482
4 HB2 ALA 103 HB2 ALA 103 6.501 -15.214 -16.390
5 HB3 ALA 103 HB3 ALA 103 5.872 -14.707 -17.963
No H/Q in entry = 5
In of MODEL 9
1 H VAL 104 H VAL 104 6.682 -10.924 -16.097
2 HA VAL 104 HA VAL 104 5.183 -10.003 -18.374
3 HB VAL 104 HB VAL 104 4.192 -9.503 -16.296
4 HG11 VAL 104 HG11 VAL 104 6.155 -9.780 -14.919
5 HG12 VAL 104 HG12 VAL 104 6.766 -8.223 -15.480
6 HG13 VAL 104 HG13 VAL 104 5.282 -8.299 -14.527
7 HG21 VAL 104 HG21 VAL 104 5.540 -7.017 -17.315
8 HG22 VAL 104 HG22 VAL 104 4.021 -7.689 -17.900
9 HG23 VAL 104 HG23 VAL 104 4.129 -7.048 -16.261
No H/Q in entry = 9
In of MODEL 9
1 H THR 105 H THR 105 5.769 -8.186 -19.595
2 HA THR 105 HA THR 105 8.536 -7.270 -19.310
3 HB THR 105 HB THR 105 8.820 -7.677 -21.828
4 HG1 THR 105 HG1 THR 105 7.551 -9.751 -22.304
5 HG21 THR 105 HG21 THR 105 8.769 -10.014 -19.919
6 HG22 THR 105 HG22 THR 105 9.614 -9.982 -21.467
7 HG23 THR 105 HG23 THR 105 10.109 -8.894 -20.169
No H/Q in entry = 7
In of MODEL 9
1 H ASP 106 H ASP 106 5.428 -6.326 -19.740
2 HA ASP 106 HA ASP 106 5.981 -4.195 -21.598
3 HB2 ASP 106 HB2 ASP 106 3.684 -5.263 -21.148
4 HB3 ASP 106 HB3 ASP 106 3.672 -4.332 -19.663
No H/Q in entry = 4
In of MODEL 9
1 H GLU 107 H GLU 107 6.798 -2.267 -21.122
2 HA GLU 107 HA GLU 107 8.479 -2.120 -18.941
3 HB2 GLU 107 HB2 GLU 107 8.687 -0.905 -21.136
4 HB3 GLU 107 HB3 GLU 107 7.524 0.261 -20.524
5 HG2 GLU 107 HG2 GLU 107 9.739 1.127 -20.245
6 HG3 GLU 107 HG3 GLU 107 9.055 0.765 -18.661
No H/Q in entry = 6
In of MODEL 9
1 H GLU 108 H GLU 108 5.509 -0.283 -19.463
2 HA GLU 108 HA GLU 108 5.427 1.230 -17.153
3 HB2 GLU 108 HB2 GLU 108 3.879 1.609 -18.940
4 HB3 GLU 108 HB3 GLU 108 3.235 -0.020 -18.809
5 HG2 GLU 108 HG2 GLU 108 2.511 0.680 -16.446
6 HG3 GLU 108 HG3 GLU 108 2.790 2.329 -17.014
No H/Q in entry = 6
In of MODEL 9
1 H LYS 109 H LYS 109 4.313 -2.061 -17.710
2 HA LYS 109 HA LYS 109 3.042 -2.518 -15.255
3 HB2 LYS 109 HB2 LYS 109 4.333 -4.322 -17.295
4 HB3 LYS 109 HB3 LYS 109 3.551 -4.960 -15.865
5 HG2 LYS 109 HG2 LYS 109 2.156 -5.009 -17.922
6 HG3 LYS 109 HG3 LYS 109 1.422 -4.164 -16.579
7 HD2 LYS 109 HD2 LYS 109 1.985 -2.030 -17.555
8 HD3 LYS 109 HD3 LYS 109 2.839 -2.832 -18.872
9 HE2 LYS 109 HE2 LYS 109 0.749 -3.872 -19.596
10 HE3 LYS 109 HE3 LYS 109 -0.103 -3.088 -18.269
11 HZ1 LYS 109 HZ1 LYS 109 0.488 -0.932 -19.230
12 HZ2 LYS 109 HZ2 LYS 109 1.256 -1.714 -20.523
13 HZ3 LYS 109 HZ3 LYS 109 -0.414 -1.872 -20.314
No H/Q in entry = 13
In of MODEL 9
1 H LYS 110 H LYS 110 6.363 -3.112 -16.337
2 HA LYS 110 HA LYS 110 7.182 -4.346 -13.899
3 HB2 LYS 110 HB2 LYS 110 8.858 -3.143 -16.097
4 HB3 LYS 110 HB3 LYS 110 9.456 -4.186 -14.818
5 HG2 LYS 110 HG2 LYS 110 8.028 -5.998 -15.668
6 HG3 LYS 110 HG3 LYS 110 7.507 -4.942 -16.982
7 HD2 LYS 110 HD2 LYS 110 10.341 -5.836 -16.446
8 HD3 LYS 110 HD3 LYS 110 9.283 -6.465 -17.706
9 HE2 LYS 110 HE2 LYS 110 10.538 -4.937 -18.886
10 HE3 LYS 110 HE3 LYS 110 9.140 -3.967 -18.443
11 HZ1 LYS 110 HZ1 LYS 110 10.526 -3.252 -16.454
12 HZ2 LYS 110 HZ2 LYS 110 11.853 -3.913 -17.265
13 HZ3 LYS 110 HZ3 LYS 110 10.983 -2.635 -17.959
No H/Q in entry = 13
In of MODEL 9
1 H GLN 111 H GLN 111 6.833 -1.121 -14.892
2 HA GLN 111 HA GLN 111 8.508 0.150 -13.009
3 HB2 GLN 111 HB2 GLN 111 5.895 0.994 -14.261
4 HB3 GLN 111 HB3 GLN 111 6.810 2.033 -13.178
5 HG2 GLN 111 HG2 GLN 111 7.941 0.861 -15.703
6 HG3 GLN 111 HG3 GLN 111 7.174 2.447 -15.613
7 HE21 GLN 111 HE21 GLN 111 9.912 0.525 -14.622
8 HE22 GLN 111 HE22 GLN 111 10.916 1.851 -14.148
No H/Q in entry = 8
In of MODEL 9
1 H TYR 112 H TYR 112 5.255 -1.181 -12.770
2 HA TYR 112 HA TYR 112 4.791 -0.289 -10.079
3 HB2 TYR 112 HB2 TYR 112 3.458 -2.556 -11.583
4 HB3 TYR 112 HB3 TYR 112 2.844 -1.756 -10.141
5 HD1 TYR 112 HD1 TYR 112 3.158 1.044 -10.676
6 HD2 TYR 112 HD2 TYR 112 2.052 -2.069 -13.351
7 HE1 TYR 112 HE1 TYR 112 1.943 2.669 -12.060
8 HE2 TYR 112 HE2 TYR 112 0.836 -0.450 -14.749
9 HH TYR 112 HH TYR 112 1.263 2.790 -14.590
No H/Q in entry = 9
In of MODEL 9
1 H ILE 113 H ILE 113 6.096 -3.149 -11.630
2 HA ILE 113 HA ILE 113 6.315 -4.845 -9.434
3 HB ILE 113 HB ILE 113 8.290 -4.496 -11.684
4 HG12 ILE 113 HG12 ILE 113 5.906 -6.321 -11.350
5 HG13 ILE 113 HG13 ILE 113 6.045 -4.982 -12.483
6 HG21 ILE 113 HG21 ILE 113 7.893 -6.790 -9.762
7 HG22 ILE 113 HG22 ILE 113 8.964 -6.803 -11.163
8 HG23 ILE 113 HG23 ILE 113 9.280 -5.703 -9.823
9 HD11 ILE 113 HD11 ILE 113 7.953 -6.181 -13.535
10 HD12 ILE 113 HD12 ILE 113 7.576 -7.555 -12.495
11 HD13 ILE 113 HD13 ILE 113 6.396 -6.991 -13.674
No H/Q in entry = 11
In of MODEL 9
1 H ALA 114 H ALA 114 8.501 -2.279 -10.544
2 HA ALA 114 HA ALA 114 10.382 -2.625 -8.423
3 HB1 ALA 114 HB1 ALA 114 11.118 -1.685 -10.516
4 HB2 ALA 114 HB2 ALA 114 11.319 -0.473 -9.252
5 HB3 ALA 114 HB3 ALA 114 9.961 -0.360 -10.376
No H/Q in entry = 5
In of MODEL 9
1 H ASP 115 H ASP 115 7.671 -0.420 -9.021
2 HA ASP 115 HA ASP 115 8.146 1.201 -6.753
3 HB2 ASP 115 HB2 ASP 115 5.728 0.781 -8.493
4 HB3 ASP 115 HB3 ASP 115 5.713 1.877 -7.125
No H/Q in entry = 4
In of MODEL 9
1 H PHE 116 H PHE 116 5.664 -1.307 -7.304
2 HA PHE 116 HA PHE 116 5.017 -1.075 -4.460
3 HB2 PHE 116 HB2 PHE 116 3.405 -1.344 -6.826
4 HB3 PHE 116 HB3 PHE 116 3.108 -2.719 -5.770
5 HD1 PHE 116 HD1 PHE 116 2.361 -2.314 -3.428
6 HD2 PHE 116 HD2 PHE 116 2.523 0.771 -6.356
7 HE1 PHE 116 HE1 PHE 116 0.825 -0.958 -2.067
8 HE2 PHE 116 HE2 PHE 116 0.984 2.141 -4.992
9 HZ PHE 116 HZ PHE 116 0.134 1.267 -2.845
No H/Q in entry = 9
In of MODEL 9
1 H GLY 117 H GLY 117 6.349 -3.260 -6.762
2 HA2 GLY 117 HA2 GLY 117 7.171 -5.410 -6.520
3 HA3 GLY 117 HA3 GLY 117 5.532 -5.749 -6.006
No H/Q in entry = 3
In of MODEL 9
1 HA PRO 118 HA PRO 118 8.958 -6.553 -2.695
2 HB2 PRO 118 HB2 PRO 118 9.917 -3.826 -2.055
3 HB3 PRO 118 HB3 PRO 118 10.835 -5.319 -2.274
4 HG2 PRO 118 HG2 PRO 118 10.869 -3.402 -4.128
5 HG3 PRO 118 HG3 PRO 118 10.873 -5.116 -4.579
6 HD2 PRO 118 HD2 PRO 118 8.623 -3.146 -4.627
7 HD3 PRO 118 HD3 PRO 118 9.022 -4.430 -5.785
No H/Q in entry = 7
In of MODEL 9
1 H ALA 119 H ALA 119 7.141 -3.566 -2.480
2 HA ALA 119 HA ALA 119 6.760 -3.734 0.383
3 HB1 ALA 119 HB1 ALA 119 5.373 -1.762 0.091
4 HB2 ALA 119 HB2 ALA 119 5.455 -1.944 -1.660
5 HB3 ALA 119 HB3 ALA 119 6.915 -1.568 -0.745
No H/Q in entry = 5
In of MODEL 9
1 H CYS 120 H CYS 120 4.936 -4.486 -2.529
2 HA CYS 120 HA CYS 120 2.503 -5.238 -1.419
3 HB2 CYS 120 HB2 CYS 120 4.053 -6.447 -3.711
4 HB3 CYS 120 HB3 CYS 120 2.403 -6.907 -3.307
No H/Q in entry = 4
In of MODEL 9
1 H LYS 121 H LYS 121 5.603 -6.886 -1.438
2 HA LYS 121 HA LYS 121 4.811 -9.416 -0.609
3 HB2 LYS 121 HB2 LYS 121 7.273 -7.893 -0.644
4 HB3 LYS 121 HB3 LYS 121 7.197 -8.962 0.751
5 HG2 LYS 121 HG2 LYS 121 8.274 -9.990 -1.213
6 HG3 LYS 121 HG3 LYS 121 6.858 -10.877 -0.655
7 HD2 LYS 121 HD2 LYS 121 5.541 -9.651 -2.430
8 HD3 LYS 121 HD3 LYS 121 7.085 -9.073 -3.059
9 HE2 LYS 121 HE2 LYS 121 6.388 -11.983 -2.687
10 HE3 LYS 121 HE3 LYS 121 6.190 -11.108 -4.204
11 HZ1 LYS 121 HZ1 LYS 121 8.797 -11.280 -2.811
12 HZ2 LYS 121 HZ2 LYS 121 8.294 -12.435 -3.937
13 HZ3 LYS 121 HZ3 LYS 121 8.493 -10.826 -4.414
No H/Q in entry = 13
In of MODEL 9
1 H LYS 122 H LYS 122 5.791 -6.735 1.613
2 HA LYS 122 HA LYS 122 4.908 -8.129 3.918
3 HB2 LYS 122 HB2 LYS 122 4.899 -5.895 5.047
4 HB3 LYS 122 HB3 LYS 122 6.416 -6.322 4.276
5 HG2 LYS 122 HG2 LYS 122 6.026 -4.810 2.489
6 HG3 LYS 122 HG3 LYS 122 4.360 -4.542 3.000
7 HD2 LYS 122 HD2 LYS 122 5.877 -2.683 3.610
8 HD3 LYS 122 HD3 LYS 122 5.102 -3.430 5.007
9 HE2 LYS 122 HE2 LYS 122 7.445 -2.986 5.464
10 HE3 LYS 122 HE3 LYS 122 7.139 -4.719 5.437
11 HZ1 LYS 122 HZ1 LYS 122 8.304 -3.151 3.203
12 HZ2 LYS 122 HZ2 LYS 122 9.172 -4.134 4.267
13 HZ3 LYS 122 HZ3 LYS 122 8.046 -4.819 3.212
No H/Q in entry = 13
In of MODEL 9
1 H ILE 123 H ILE 123 3.249 -6.178 1.559
2 HA ILE 123 HA ILE 123 0.952 -5.612 3.092
3 HB ILE 123 HB ILE 123 1.339 -5.695 0.124
4 HG12 ILE 123 HG12 ILE 123 1.050 -3.435 2.114
5 HG13 ILE 123 HG13 ILE 123 2.564 -3.968 1.390
6 HG21 ILE 123 HG21 ILE 123 -1.070 -4.871 1.732
7 HG22 ILE 123 HG22 ILE 123 -0.823 -4.452 0.035
8 HG23 ILE 123 HG23 ILE 123 -0.982 -6.143 0.513
9 HD11 ILE 123 HD11 ILE 123 0.223 -2.866 -0.118
10 HD12 ILE 123 HD12 ILE 123 1.661 -1.957 0.343
11 HD13 ILE 123 HD13 ILE 123 1.793 -3.304 -0.785
No H/Q in entry = 11
In of MODEL 9
1 H TYR 124 H TYR 124 1.574 -8.027 0.652
2 HA TYR 124 HA TYR 124 -0.742 -9.632 1.172
3 HB2 TYR 124 HB2 TYR 124 1.744 -10.043 -0.484
4 HB3 TYR 124 HB3 TYR 124 0.522 -11.293 -0.299
5 HD1 TYR 124 HD1 TYR 124 -1.931 -10.554 -0.878
6 HD2 TYR 124 HD2 TYR 124 1.563 -8.541 -2.231
7 HE1 TYR 124 HE1 TYR 124 -3.223 -9.560 -2.717
8 HE2 TYR 124 HE2 TYR 124 0.280 -7.539 -4.074
9 HH TYR 124 HH TYR 124 -3.153 -7.711 -4.228
No H/Q in entry = 9
In of MODEL 9
1 H GLY 125 H GLY 125 0.810 -9.106 3.446
2 HA2 GLY 125 HA2 GLY 125 1.997 -10.046 5.231
3 HA3 GLY 125 HA3 GLY 125 3.220 -9.725 4.038
No H/Q in entry = 3
In of MODEL 9
1 H VAL 126 H VAL 126 2.344 -12.019 2.405
2 HA VAL 126 HA VAL 126 2.602 -14.491 3.459
3 HB VAL 126 HB VAL 126 3.963 -15.090 1.412
4 HG11 VAL 126 HG11 VAL 126 1.466 -13.446 0.998
5 HG12 VAL 126 HG12 VAL 126 2.146 -14.589 -0.158
6 HG13 VAL 126 HG13 VAL 126 1.529 -15.163 1.391
7 HG21 VAL 126 HG21 VAL 126 3.677 -12.130 0.883
8 HG22 VAL 126 HG22 VAL 126 5.184 -13.010 1.150
9 HG23 VAL 126 HG23 VAL 126 4.222 -13.328 -0.294
No H/Q in entry = 9
In of MODEL 9
1 H HIS 127 H HIS 127 5.155 -12.086 3.360
2 HA HIS 127 HA HIS 127 7.376 -13.713 3.884
3 HB2 HIS 127 HB2 HIS 127 7.439 -11.271 3.297
4 HB3 HIS 127 HB3 HIS 127 6.904 -10.911 4.931
5 HD1 HIS 127 HD1 HIS 127 9.892 -11.468 2.937
6 HD2 HIS 127 HD2 HIS 127 8.874 -11.715 6.958
7 HE1 HIS 127 HE1 HIS 127 12.070 -11.439 4.188
8 HE2 HIS 127 HE2 HIS 127 11.432 -11.786 6.598
No H/Q in entry = 8
In of MODEL 9
1 H THR 128 H THR 128 4.859 -12.459 5.941
2 HA THR 128 HA THR 128 6.013 -13.886 8.243
3 HB THR 128 HB THR 128 4.463 -12.363 9.589
4 HG1 THR 128 HG1 THR 128 3.432 -11.695 7.429
5 HG21 THR 128 HG21 THR 128 6.894 -12.055 9.511
6 HG22 THR 128 HG22 THR 128 6.726 -11.086 8.048
7 HG23 THR 128 HG23 THR 128 6.058 -10.505 9.574
No H/Q in entry = 7
In of MODEL 9
1 H SER 129 H SER 129 5.040 -15.822 8.355
2 HA SER 129 HA SER 129 2.283 -16.106 7.461
3 HB2 SER 129 HB2 SER 129 4.217 -18.242 8.387
4 HB3 SER 129 HB3 SER 129 2.709 -18.488 7.503
5 HG SER 129 HG SER 129 4.234 -16.756 6.155
No H/Q in entry = 5
In of MODEL 10
1 HA2 GLY -4 HA2 GLY -4 -13.003 14.124 -17.956
2 HA3 GLY -4 HA3 GLY -4 -11.364 13.605 -17.587
3 H1 GLY -4 H1 GLY -4 -12.234 12.647 -19.648
4 H2 GLY -4 H2 GLY -4 -13.450 11.864 -18.772
No H/Q in entry = 4
In of MODEL 10
1 H SER -3 H SER -3 -11.660 11.171 -16.469
2 HA SER -3 HA SER -3 -13.653 11.456 -14.349
3 HB2 SER -3 HB2 SER -3 -12.924 9.078 -13.804
4 HB3 SER -3 HB3 SER -3 -13.728 9.302 -15.357
5 HG SER -3 HG SER -3 -10.919 9.144 -14.926
No H/Q in entry = 5
In of MODEL 10
1 HA PRO -2 HA PRO -2 -10.253 13.116 -11.854
2 HB2 PRO -2 HB2 PRO -2 -12.442 13.155 -9.855
3 HB3 PRO -2 HB3 PRO -2 -11.366 14.459 -10.366
4 HG2 PRO -2 HG2 PRO -2 -13.922 14.426 -11.120
5 HG3 PRO -2 HG3 PRO -2 -12.647 14.966 -12.230
6 HD2 PRO -2 HD2 PRO -2 -14.093 12.346 -12.131
7 HD3 PRO -2 HD3 PRO -2 -13.619 13.318 -13.540
No H/Q in entry = 7
In of MODEL 10
1 H GLU -1 H GLU -1 -9.015 12.248 -10.230
2 HA GLU -1 HA GLU -1 -8.159 10.744 -8.777
3 HB2 GLU -1 HB2 GLU -1 -10.986 9.697 -8.597
4 HB3 GLU -1 HB3 GLU -1 -9.654 9.159 -7.583
5 HG2 GLU -1 HG2 GLU -1 -9.438 11.331 -6.605
6 HG3 GLU -1 HG3 GLU -1 -10.616 12.004 -7.732
No H/Q in entry = 6
In of MODEL 10
1 H PHE 0 H PHE 0 -10.356 9.313 -11.171
2 HA PHE 0 HA PHE 0 -8.719 6.926 -11.317
3 HB2 PHE 0 HB2 PHE 0 -11.179 6.773 -11.550
4 HB3 PHE 0 HB3 PHE 0 -11.084 7.729 -13.025
5 HD1 PHE 0 HD1 PHE 0 -9.619 4.636 -11.540
6 HD2 PHE 0 HD2 PHE 0 -11.029 6.611 -15.034
7 HE1 PHE 0 HE1 PHE 0 -9.264 2.579 -12.841
8 HE2 PHE 0 HE2 PHE 0 -10.677 4.558 -16.342
9 HZ PHE 0 HZ PHE 0 -9.793 2.538 -15.246
No H/Q in entry = 9
In of MODEL 10
1 H HIS 1 H HIS 1 -6.775 8.024 -11.906
2 HA HIS 1 HA HIS 1 -6.628 8.435 -14.819
3 HB2 HIS 1 HB2 HIS 1 -5.035 9.841 -12.665
4 HB3 HIS 1 HB3 HIS 1 -4.668 9.938 -14.382
5 HD1 HIS 1 HD1 HIS 1 -5.855 12.115 -12.102
6 HD2 HIS 1 HD2 HIS 1 -7.590 10.639 -15.578
7 HE1 HIS 1 HE1 HIS 1 -7.580 13.814 -12.770
8 HE2 HIS 1 HE2 HIS 1 -8.475 12.992 -14.972
No H/Q in entry = 8
In of MODEL 10
1 H HIS 2 H HIS 2 -4.149 8.173 -12.305
2 HA HIS 2 HA HIS 2 -3.521 5.462 -13.258
3 HB2 HIS 2 HB2 HIS 2 -1.536 7.632 -12.532
4 HB3 HIS 2 HB3 HIS 2 -1.109 5.939 -12.740
5 HD1 HIS 2 HD1 HIS 2 -0.793 5.092 -15.108
6 HD2 HIS 2 HD2 HIS 2 -2.263 8.976 -14.937
7 HE1 HIS 2 HE1 HIS 2 -0.685 5.960 -17.460
8 HE2 HIS 2 HE2 HIS 2 -1.753 8.238 -17.358
No H/Q in entry = 8
In of MODEL 10
1 H PHE 3 H PHE 3 -1.638 4.794 -11.380
2 HA PHE 3 HA PHE 3 -3.242 4.538 -9.016
3 HB2 PHE 3 HB2 PHE 3 -0.370 3.706 -9.499
4 HB3 PHE 3 HB3 PHE 3 -1.380 3.199 -8.148
5 HD1 PHE 3 HD1 PHE 3 -3.659 2.071 -8.852
6 HD2 PHE 3 HD2 PHE 3 -0.200 2.314 -11.320
7 HE1 PHE 3 HE1 PHE 3 -4.472 0.167 -10.178
8 HE2 PHE 3 HE2 PHE 3 -1.010 0.408 -12.651
9 HZ PHE 3 HZ PHE 3 -3.151 -0.666 -12.079
No H/Q in entry = 9
In of MODEL 10
1 H THR 4 H THR 4 -3.452 6.241 -7.730
2 HA THR 4 HA THR 4 -1.053 7.669 -6.864
3 HB THR 4 HB THR 4 -2.135 9.849 -7.024
4 HG1 THR 4 HG1 THR 4 -4.313 8.351 -8.096
5 HG21 THR 4 HG21 THR 4 -0.818 9.125 -8.948
6 HG22 THR 4 HG22 THR 4 -2.251 8.385 -9.659
7 HG23 THR 4 HG23 THR 4 -2.170 10.134 -9.455
No H/Q in entry = 7
In of MODEL 10
1 H LEU 5 H LEU 5 -1.488 8.940 -4.875
2 HA LEU 5 HA LEU 5 -2.941 7.284 -3.052
3 HB2 LEU 5 HB2 LEU 5 -1.536 9.906 -2.577
4 HB3 LEU 5 HB3 LEU 5 -2.138 8.831 -1.330
5 HG LEU 5 HG LEU 5 0.107 8.264 -3.259
6 HD11 LEU 5 HD11 LEU 5 0.009 8.737 -0.289
7 HD12 LEU 5 HD12 LEU 5 1.434 8.206 -1.179
8 HD13 LEU 5 HD13 LEU 5 0.729 9.789 -1.508
9 HD21 LEU 5 HD21 LEU 5 -1.086 6.516 -1.108
10 HD22 LEU 5 HD22 LEU 5 -1.146 6.224 -2.846
11 HD23 LEU 5 HD23 LEU 5 0.398 6.175 -1.995
No H/Q in entry = 11
In of MODEL 10
1 H GLU 6 H GLU 6 -3.608 10.306 -4.685
2 HA GLU 6 HA GLU 6 -5.922 11.016 -3.214
3 HB2 GLU 6 HB2 GLU 6 -5.469 11.236 -6.208
4 HB3 GLU 6 HB3 GLU 6 -6.667 12.125 -5.276
5 HG2 GLU 6 HG2 GLU 6 -4.927 13.324 -4.109
6 HG3 GLU 6 HG3 GLU 6 -3.687 12.369 -4.921
No H/Q in entry = 6
In of MODEL 10
1 H SER 7 H SER 7 -5.519 8.840 -6.078
2 HA SER 7 HA SER 7 -8.089 7.970 -6.330
3 HB2 SER 7 HB2 SER 7 -5.694 6.140 -6.527
4 HB3 SER 7 HB3 SER 7 -7.219 6.015 -7.406
5 HG SER 7 HG SER 7 -6.681 7.753 -8.626
No H/Q in entry = 5
In of MODEL 10
1 H SER 8 H SER 8 -5.950 7.224 -3.670
2 HA SER 8 HA SER 8 -7.585 4.926 -2.941
3 HB2 SER 8 HB2 SER 8 -4.952 5.817 -1.785
4 HB3 SER 8 HB3 SER 8 -5.817 4.321 -1.390
5 HG SER 8 HG SER 8 -4.964 5.023 -4.013
No H/Q in entry = 5
In of MODEL 10
1 H LEU 9 H LEU 9 -7.335 8.227 -2.013
2 HA LEU 9 HA LEU 9 -7.199 8.164 0.695
3 HB2 LEU 9 HB2 LEU 9 -8.733 10.044 -1.046
4 HB3 LEU 9 HB3 LEU 9 -8.349 10.334 0.644
5 HG LEU 9 HG LEU 9 -6.296 9.828 -1.495
6 HD11 LEU 9 HD11 LEU 9 -7.256 12.405 -0.302
7 HD12 LEU 9 HD12 LEU 9 -5.831 12.222 -1.327
8 HD13 LEU 9 HD13 LEU 9 -7.428 11.853 -1.972
9 HD21 LEU 9 HD21 LEU 9 -6.053 10.723 1.374
10 HD22 LEU 9 HD22 LEU 9 -5.518 9.182 0.693
11 HD23 LEU 9 HD23 LEU 9 -4.725 10.689 0.210
No H/Q in entry = 11
In of MODEL 10
1 H ASP 10 H ASP 10 -10.164 7.737 -1.107
2 HA ASP 10 HA ASP 10 -11.594 7.403 1.419
3 HB2 ASP 10 HB2 ASP 10 -12.561 7.662 -1.425
4 HB3 ASP 10 HB3 ASP 10 -13.627 7.327 -0.066
No H/Q in entry = 4
In of MODEL 10
1 H THR 11 H THR 11 -9.839 5.458 -0.500
2 HA THR 11 HA THR 11 -11.622 3.194 0.010
3 HB THR 11 HB THR 11 -10.577 2.072 -1.994
4 HG1 THR 11 HG1 THR 11 -9.920 3.999 -3.525
5 HG21 THR 11 HG21 THR 11 -12.196 4.570 -2.502
6 HG22 THR 11 HG22 THR 11 -12.017 3.217 -3.617
7 HG23 THR 11 HG23 THR 11 -12.839 2.985 -2.076
No H/Q in entry = 7
In of MODEL 10
1 H HIS 12 H HIS 12 -8.512 2.790 -1.430
2 HA HIS 12 HA HIS 12 -7.742 0.913 0.472
3 HB2 HIS 12 HB2 HIS 12 -5.856 2.367 -1.376
4 HB3 HIS 12 HB3 HIS 12 -5.623 0.775 -0.663
5 HD1 HIS 12 HD1 HIS 12 -7.942 -0.834 -1.370
6 HD2 HIS 12 HD2 HIS 12 -6.526 2.093 -3.961
7 HE1 HIS 12 HE1 HIS 12 -8.838 -1.446 -3.635
8 HE2 HIS 12 HE2 HIS 12 -7.849 0.255 -5.215
No H/Q in entry = 8
In of MODEL 10
1 H LEU 13 H LEU 13 -6.969 4.386 0.326
2 HA LEU 13 HA LEU 13 -5.155 3.944 2.604
3 HB2 LEU 13 HB2 LEU 13 -5.103 5.874 0.356
4 HB3 LEU 13 HB3 LEU 13 -4.502 6.417 1.909
5 HG LEU 13 HG LEU 13 -2.643 5.634 0.605
6 HD11 LEU 13 HD11 LEU 13 -2.664 5.131 3.028
7 HD12 LEU 13 HD12 LEU 13 -3.285 3.525 2.652
8 HD13 LEU 13 HD13 LEU 13 -1.691 4.007 2.081
9 HD21 LEU 13 HD21 LEU 13 -4.163 3.050 0.324
10 HD22 LEU 13 HD22 LEU 13 -3.761 4.187 -0.963
11 HD23 LEU 13 HD23 LEU 13 -2.481 3.291 -0.144
No H/Q in entry = 11
In of MODEL 10
1 H LYS 14 H LYS 14 -8.058 4.239 2.653
2 HA LYS 14 HA LYS 14 -8.778 6.823 3.563
3 HB2 LYS 14 HB2 LYS 14 -10.927 5.898 3.998
4 HB3 LYS 14 HB3 LYS 14 -10.325 5.157 2.527
5 HG2 LYS 14 HG2 LYS 14 -9.578 3.216 3.974
6 HG3 LYS 14 HG3 LYS 14 -10.544 3.944 5.261
7 HD2 LYS 14 HD2 LYS 14 -11.517 2.986 2.571
8 HD3 LYS 14 HD3 LYS 14 -11.862 2.270 4.143
9 HE2 LYS 14 HE2 LYS 14 -13.060 4.303 4.797
10 HE3 LYS 14 HE3 LYS 14 -12.714 5.011 3.221
11 HZ1 LYS 14 HZ1 LYS 14 -14.293 2.537 3.662
12 HZ2 LYS 14 HZ2 LYS 14 -14.948 4.064 3.357
13 HZ3 LYS 14 HZ3 LYS 14 -14.011 3.295 2.176
No H/Q in entry = 13
In of MODEL 10
1 H TRP 15 H TRP 15 -7.313 4.162 5.087
2 HA TRP 15 HA TRP 15 -8.235 4.646 7.753
3 HB2 TRP 15 HB2 TRP 15 -6.467 3.010 8.379
4 HB3 TRP 15 HB3 TRP 15 -7.544 2.409 7.123
5 HD1 TRP 15 HD1 TRP 15 -6.545 2.162 4.659
6 HE1 TRP 15 HE1 TRP 15 -4.127 1.965 3.796
7 HE3 TRP 15 HE3 TRP 15 -4.066 3.778 8.825
8 HZ2 TRP 15 HZ2 TRP 15 -1.511 2.435 4.762
9 HZ3 TRP 15 HZ3 TRP 15 -1.610 3.874 8.775
10 HH2 TRP 15 HH2 TRP 15 -0.358 3.216 6.786
No H/Q in entry = 10
In of MODEL 10
1 H LEU 16 H LEU 16 -6.088 6.243 5.746
2 HA LEU 16 HA LEU 16 -4.267 7.168 7.767
3 HB2 LEU 16 HB2 LEU 16 -4.975 8.305 5.051
4 HB3 LEU 16 HB3 LEU 16 -3.707 8.929 6.084
5 HG LEU 16 HG LEU 16 -3.714 6.131 4.936
6 HD11 LEU 16 HD11 LEU 16 -2.282 8.607 3.979
7 HD12 LEU 16 HD12 LEU 16 -2.050 6.975 3.355
8 HD13 LEU 16 HD13 LEU 16 -3.603 7.783 3.150
9 HD21 LEU 16 HD21 LEU 16 -1.566 7.759 6.296
10 HD22 LEU 16 HD22 LEU 16 -2.342 6.306 6.925
11 HD23 LEU 16 HD23 LEU 16 -1.303 6.207 5.499
No H/Q in entry = 11
In of MODEL 10
1 H SER 17 H SER 17 -4.385 9.021 8.928
2 HA SER 17 HA SER 17 -6.979 10.121 9.390
3 HB2 SER 17 HB2 SER 17 -5.212 9.937 11.155
4 HB3 SER 17 HB3 SER 17 -4.323 11.211 10.329
5 HG SER 17 HG SER 17 -6.778 11.354 11.699
No H/Q in entry = 5
In of MODEL 10
1 H GLN 18 H GLN 18 -7.495 12.507 9.128
2 HA GLN 18 HA GLN 18 -7.144 13.295 6.483
3 HB2 GLN 18 HB2 GLN 18 -7.791 14.997 8.897
4 HB3 GLN 18 HB3 GLN 18 -7.883 15.576 7.240
5 HG2 GLN 18 HG2 GLN 18 -9.485 13.326 8.431
6 HG3 GLN 18 HG3 GLN 18 -10.072 14.944 8.044
7 HE21 GLN 18 HE21 GLN 18 -10.378 15.523 5.891
8 HE22 GLN 18 HE22 GLN 18 -10.458 14.343 4.625
No H/Q in entry = 8
In of MODEL 10
1 H GLU 19 H GLU 19 -5.385 14.401 9.354
2 HA GLU 19 HA GLU 19 -3.659 16.167 8.095
3 HB2 GLU 19 HB2 GLU 19 -3.382 14.445 10.553
4 HB3 GLU 19 HB3 GLU 19 -2.187 15.624 10.080
5 HG2 GLU 19 HG2 GLU 19 -3.775 17.414 10.289
6 HG3 GLU 19 HG3 GLU 19 -5.064 16.258 10.622
No H/Q in entry = 6
In of MODEL 10
1 H GLN 20 H GLN 20 -3.545 12.659 8.387
2 HA GLN 20 HA GLN 20 -0.885 12.427 7.337
3 HB2 GLN 20 HB2 GLN 20 -3.091 10.356 7.517
4 HB3 GLN 20 HB3 GLN 20 -1.407 10.020 7.139
5 HG2 GLN 20 HG2 GLN 20 -0.744 10.806 9.343
6 HG3 GLN 20 HG3 GLN 20 -2.423 11.180 9.724
7 HE21 GLN 20 HE21 GLN 20 -0.074 8.691 9.307
8 HE22 GLN 20 HE22 GLN 20 -1.015 7.398 9.962
No H/Q in entry = 8
In of MODEL 10
1 H LYS 21 H LYS 21 -4.170 11.999 5.981
2 HA LYS 21 HA LYS 21 -3.478 11.372 3.359
3 HB2 LYS 21 HB2 LYS 21 -5.748 13.136 4.311
4 HB3 LYS 21 HB3 LYS 21 -5.604 12.493 2.684
5 HG2 LYS 21 HG2 LYS 21 -5.656 10.190 3.714
6 HG3 LYS 21 HG3 LYS 21 -6.104 10.978 5.231
7 HD2 LYS 21 HD2 LYS 21 -8.043 11.992 4.124
8 HD3 LYS 21 HD3 LYS 21 -7.598 11.201 2.617
9 HE2 LYS 21 HE2 LYS 21 -9.282 9.854 3.515
10 HE3 LYS 21 HE3 LYS 21 -7.787 9.010 3.908
11 HZ1 LYS 21 HZ1 LYS 21 -9.158 10.834 5.802
12 HZ2 LYS 21 HZ2 LYS 21 -9.460 9.170 5.743
13 HZ3 LYS 21 HZ3 LYS 21 -7.914 9.733 6.140
No H/Q in entry = 13
In of MODEL 10
1 H ASP 22 H ASP 22 -3.954 14.524 4.843
2 HA ASP 22 HA ASP 22 -3.189 16.134 2.662
3 HB2 ASP 22 HB2 ASP 22 -4.444 17.038 4.520
4 HB3 ASP 22 HB3 ASP 22 -3.162 16.618 5.644
No H/Q in entry = 4
In of MODEL 10
1 H GLU 23 H GLU 23 -1.266 14.790 5.381
2 HA GLU 23 HA GLU 23 1.182 15.935 4.700
3 HB2 GLU 23 HB2 GLU 23 0.376 14.355 6.691
4 HB3 GLU 23 HB3 GLU 23 1.107 13.125 5.661
5 HG2 GLU 23 HG2 GLU 23 3.176 14.290 5.649
6 HG3 GLU 23 HG3 GLU 23 2.453 15.641 6.510
No H/Q in entry = 6
In of MODEL 10
1 H LEU 24 H LEU 24 -0.233 12.838 3.596
2 HA LEU 24 HA LEU 24 1.923 12.152 1.912
3 HB2 LEU 24 HB2 LEU 24 -0.975 11.356 2.021
4 HB3 LEU 24 HB3 LEU 24 0.091 10.732 0.782
5 HG LEU 24 HG LEU 24 -0.348 9.291 2.859
6 HD11 LEU 24 HD11 LEU 24 2.470 9.850 1.977
7 HD12 LEU 24 HD12 LEU 24 1.946 8.431 2.889
8 HD13 LEU 24 HD13 LEU 24 1.342 8.703 1.252
9 HD21 LEU 24 HD21 LEU 24 1.491 11.339 4.025
10 HD22 LEU 24 HD22 LEU 24 -0.034 10.732 4.665
11 HD23 LEU 24 HD23 LEU 24 1.393 9.696 4.647
No H/Q in entry = 11
In of MODEL 10
1 H LEU 25 H LEU 25 -1.058 13.969 1.373
2 HA LEU 25 HA LEU 25 -0.803 14.333 -1.398
3 HB2 LEU 25 HB2 LEU 25 -2.129 16.032 0.708
4 HB3 LEU 25 HB3 LEU 25 -2.252 16.351 -1.010
5 HG LEU 25 HG LEU 25 -3.209 13.844 0.371
6 HD11 LEU 25 HD11 LEU 25 -4.721 16.202 -0.737
7 HD12 LEU 25 HD12 LEU 25 -5.453 14.697 -0.178
8 HD13 LEU 25 HD13 LEU 25 -4.590 15.734 0.958
9 HD21 LEU 25 HD21 LEU 25 -3.448 14.749 -2.494
10 HD22 LEU 25 HD22 LEU 25 -2.505 13.385 -1.898
11 HD23 LEU 25 HD23 LEU 25 -4.263 13.351 -1.797
No H/Q in entry = 11
In of MODEL 10
1 H LYS 26 H LYS 26 0.411 16.244 1.325
2 HA LYS 26 HA LYS 26 1.550 18.322 -0.232
3 HB2 LYS 26 HB2 LYS 26 2.242 17.309 2.528
4 HB3 LYS 26 HB3 LYS 26 2.955 18.742 1.805
5 HG2 LYS 26 HG2 LYS 26 0.032 18.341 2.392
6 HG3 LYS 26 HG3 LYS 26 1.157 19.312 3.341
7 HD2 LYS 26 HD2 LYS 26 1.555 20.717 1.334
8 HD3 LYS 26 HD3 LYS 26 0.313 19.793 0.486
9 HE2 LYS 26 HE2 LYS 26 -1.338 20.484 2.155
10 HE3 LYS 26 HE3 LYS 26 -0.096 21.407 2.998
11 HZ1 LYS 26 HZ1 LYS 26 -1.029 21.903 0.225
12 HZ2 LYS 26 HZ2 LYS 26 -1.444 22.821 1.581
13 HZ3 LYS 26 HZ3 LYS 26 0.156 22.791 1.040
No H/Q in entry = 13
In of MODEL 10
1 H MET 27 H MET 27 2.912 15.357 1.142
2 HA MET 27 HA MET 27 5.453 15.544 0.171
3 HB2 MET 27 HB2 MET 27 3.676 13.141 0.532
4 HB3 MET 27 HB3 MET 27 5.366 12.990 0.067
5 HG2 MET 27 HG2 MET 27 4.759 14.638 2.444
6 HG3 MET 27 HG3 MET 27 4.548 12.897 2.586
7 HE1 MET 27 HE1 MET 27 6.402 11.146 2.288
8 HE2 MET 27 HE2 MET 27 6.803 11.738 0.676
9 HE3 MET 27 HE3 MET 27 8.079 11.501 1.872
No H/Q in entry = 9
In of MODEL 10
1 H LYS 28 H LYS 28 2.715 13.958 -1.495
2 HA LYS 28 HA LYS 28 4.077 13.308 -3.859
3 HB2 LYS 28 HB2 LYS 28 1.782 12.529 -2.993
4 HB3 LYS 28 HB3 LYS 28 1.151 13.995 -3.727
5 HG2 LYS 28 HG2 LYS 28 0.827 12.211 -5.263
6 HG3 LYS 28 HG3 LYS 28 2.114 13.237 -5.899
7 HD2 LYS 28 HD2 LYS 28 3.793 11.684 -5.112
8 HD3 LYS 28 HD3 LYS 28 2.559 10.694 -4.339
9 HE2 LYS 28 HE2 LYS 28 3.276 9.711 -6.451
10 HE3 LYS 28 HE3 LYS 28 1.581 10.190 -6.515
11 HZ1 LYS 28 HZ1 LYS 28 3.838 11.769 -7.623
12 HZ2 LYS 28 HZ2 LYS 28 2.803 10.790 -8.527
13 HZ3 LYS 28 HZ3 LYS 28 2.197 12.153 -7.743
No H/Q in entry = 13
In of MODEL 10
1 H LYS 29 H LYS 29 2.211 16.164 -2.939
2 HA LYS 29 HA LYS 29 2.293 17.484 -5.409
3 HB2 LYS 29 HB2 LYS 29 0.757 18.130 -3.632
4 HB3 LYS 29 HB3 LYS 29 2.104 18.643 -2.627
5 HG2 LYS 29 HG2 LYS 29 1.111 20.590 -3.557
6 HG3 LYS 29 HG3 LYS 29 2.661 20.347 -4.360
7 HD2 LYS 29 HD2 LYS 29 1.039 20.956 -6.016
8 HD3 LYS 29 HD3 LYS 29 1.433 19.251 -6.236
9 HE2 LYS 29 HE2 LYS 29 -0.598 18.607 -5.068
10 HE3 LYS 29 HE3 LYS 29 -0.977 20.300 -4.760
11 HZ1 LYS 29 HZ1 LYS 29 -0.790 19.042 -7.440
12 HZ2 LYS 29 HZ2 LYS 29 -2.222 19.420 -6.633
13 HZ3 LYS 29 HZ3 LYS 29 -1.185 20.655 -7.130
No H/Q in entry = 13
In of MODEL 10
1 H ASP 30 H ASP 30 4.523 17.668 -2.640
2 HA ASP 30 HA ASP 30 5.971 19.829 -3.834
3 HB2 ASP 30 HB2 ASP 30 6.276 18.240 -1.320
4 HB3 ASP 30 HB3 ASP 30 7.650 19.182 -1.893
No H/Q in entry = 4
In of MODEL 10
1 H GLY 31 H GLY 31 5.862 16.801 -4.769
2 HA2 GLY 31 HA2 GLY 31 8.338 17.192 -6.224
3 HA3 GLY 31 HA3 GLY 31 7.072 16.037 -6.606
No H/Q in entry = 3
In of MODEL 10
1 H LYS 32 H LYS 32 7.179 15.255 -3.646
2 HA LYS 32 HA LYS 32 9.647 13.886 -3.350
3 HB2 LYS 32 HB2 LYS 32 6.937 13.326 -2.121
4 HB3 LYS 32 HB3 LYS 32 8.426 12.524 -1.653
5 HG2 LYS 32 HG2 LYS 32 7.820 15.460 -1.372
6 HG3 LYS 32 HG3 LYS 32 7.865 14.266 -0.073
7 HD2 LYS 32 HD2 LYS 32 10.256 13.864 -0.592
8 HD3 LYS 32 HD3 LYS 32 10.180 15.157 -1.791
9 HE2 LYS 32 HE2 LYS 32 11.103 16.067 0.216
10 HE3 LYS 32 HE3 LYS 32 9.471 16.706 0.025
11 HZ1 LYS 32 HZ1 LYS 32 10.206 14.427 1.784
12 HZ2 LYS 32 HZ2 LYS 32 9.955 16.016 2.308
13 HZ3 LYS 32 HZ3 LYS 32 8.675 15.134 1.645
No H/Q in entry = 13
In of MODEL 10
1 H ALA 33 H ALA 33 10.057 11.728 -3.712
2 HA ALA 33 HA ALA 33 8.928 10.701 -6.137
3 HB1 ALA 33 HB1 ALA 33 11.303 10.398 -5.590
4 HB2 ALA 33 HB2 ALA 33 10.491 8.860 -5.881
5 HB3 ALA 33 HB3 ALA 33 10.849 9.371 -4.231
No H/Q in entry = 5
In of MODEL 10
1 H LYS 34 H LYS 34 7.729 8.785 -6.408
2 HA LYS 34 HA LYS 34 5.657 8.278 -4.656
3 HB2 LYS 34 HB2 LYS 34 5.581 7.541 -6.945
4 HB3 LYS 34 HB3 LYS 34 6.950 6.471 -6.695
5 HG2 LYS 34 HG2 LYS 34 5.650 5.023 -5.307
6 HG3 LYS 34 HG3 LYS 34 4.290 6.151 -5.331
7 HD2 LYS 34 HD2 LYS 34 3.804 5.701 -7.570
8 HD3 LYS 34 HD3 LYS 34 5.398 5.013 -7.874
9 HE2 LYS 34 HE2 LYS 34 3.332 3.773 -6.065
10 HE3 LYS 34 HE3 LYS 34 3.561 3.332 -7.758
11 HZ1 LYS 34 HZ1 LYS 34 5.851 2.712 -7.233
12 HZ2 LYS 34 HZ2 LYS 34 5.600 3.098 -5.602
13 HZ3 LYS 34 HZ3 LYS 34 4.747 1.819 -6.309
No H/Q in entry = 13
In of MODEL 10
1 H LYS 35 H LYS 35 8.849 6.795 -4.790
2 HA LYS 35 HA LYS 35 8.427 4.735 -2.935
3 HB2 LYS 35 HB2 LYS 35 10.403 5.252 -4.556
4 HB3 LYS 35 HB3 LYS 35 11.057 6.138 -3.189
5 HG2 LYS 35 HG2 LYS 35 11.936 3.859 -3.349
6 HG3 LYS 35 HG3 LYS 35 11.067 4.138 -1.840
7 HD2 LYS 35 HD2 LYS 35 10.592 1.937 -2.969
8 HD3 LYS 35 HD3 LYS 35 9.172 2.918 -2.612
9 HE2 LYS 35 HE2 LYS 35 9.019 1.944 -4.841
10 HE3 LYS 35 HE3 LYS 35 9.125 3.701 -4.927
11 HZ1 LYS 35 HZ1 LYS 35 11.490 3.471 -5.439
12 HZ2 LYS 35 HZ2 LYS 35 11.341 1.786 -5.414
13 HZ3 LYS 35 HZ3 LYS 35 10.516 2.695 -6.586
No H/Q in entry = 13
In of MODEL 10
1 H GLU 36 H GLU 36 8.692 8.126 -2.438
2 HA GLU 36 HA GLU 36 9.561 7.878 0.321
3 HB2 GLU 36 HB2 GLU 36 8.692 10.340 -1.206
4 HB3 GLU 36 HB3 GLU 36 9.538 10.305 0.338
5 HG2 GLU 36 HG2 GLU 36 11.431 9.184 -0.780
6 HG3 GLU 36 HG3 GLU 36 10.594 9.369 -2.308
No H/Q in entry = 6
In of MODEL 10
1 H LEU 37 H LEU 37 6.729 8.321 -1.585
2 HA LEU 37 HA LEU 37 4.924 8.688 0.566
3 HB2 LEU 37 HB2 LEU 37 4.637 7.728 -2.270
4 HB3 LEU 37 HB3 LEU 37 3.273 7.892 -1.190
5 HG LEU 37 HG LEU 37 3.467 9.787 -2.677
6 HD11 LEU 37 HD11 LEU 37 2.529 10.113 -0.444
7 HD12 LEU 37 HD12 LEU 37 4.134 10.542 0.146
8 HD13 LEU 37 HD13 LEU 37 3.330 11.567 -1.043
9 HD21 LEU 37 HD21 LEU 37 6.122 10.320 -1.403
10 HD22 LEU 37 HD22 LEU 37 5.840 9.844 -3.078
11 HD23 LEU 37 HD23 LEU 37 5.270 11.410 -2.498
No H/Q in entry = 11
In of MODEL 10
1 H GLU 38 H GLU 38 6.067 5.907 -1.274
2 HA GLU 38 HA GLU 38 4.566 3.941 0.101
3 HB2 GLU 38 HB2 GLU 38 7.134 3.748 -1.472
4 HB3 GLU 38 HB3 GLU 38 6.254 2.353 -0.856
5 HG2 GLU 38 HG2 GLU 38 4.340 2.905 -2.195
6 HG3 GLU 38 HG3 GLU 38 5.101 4.401 -2.731
No H/Q in entry = 6
In of MODEL 10
1 H ALA 39 H ALA 39 7.241 5.785 0.990
2 HA ALA 39 HA ALA 39 8.165 3.911 3.013
3 HB1 ALA 39 HB1 ALA 39 9.078 6.729 2.445
4 HB2 ALA 39 HB2 ALA 39 9.864 5.564 3.509
5 HB3 ALA 39 HB3 ALA 39 9.796 5.265 1.774
No H/Q in entry = 5
In of MODEL 10
1 H LYS 40 H LYS 40 6.596 7.051 2.840
2 HA LYS 40 HA LYS 40 6.192 7.522 5.559
3 HB2 LYS 40 HB2 LYS 40 5.789 9.179 3.785
4 HB3 LYS 40 HB3 LYS 40 4.429 8.230 3.205
5 HG2 LYS 40 HG2 LYS 40 3.513 9.983 4.465
6 HG3 LYS 40 HG3 LYS 40 3.395 8.545 5.479
7 HD2 LYS 40 HD2 LYS 40 4.175 10.180 6.937
8 HD3 LYS 40 HD3 LYS 40 5.637 9.321 6.470
9 HE2 LYS 40 HE2 LYS 40 6.296 11.036 4.993
10 HE3 LYS 40 HE3 LYS 40 4.708 11.796 5.044
11 HZ1 LYS 40 HZ1 LYS 40 6.559 11.615 7.355
12 HZ2 LYS 40 HZ2 LYS 40 6.382 12.976 6.373
13 HZ3 LYS 40 HZ3 LYS 40 5.078 12.438 7.310
No H/Q in entry = 13
In of MODEL 10
1 H ILE 41 H ILE 41 4.079 5.884 3.191
2 HA ILE 41 HA ILE 41 2.037 5.274 5.021
3 HB ILE 41 HB ILE 41 2.757 4.006 2.384
4 HG12 ILE 41 HG12 ILE 41 0.621 6.017 3.114
5 HG13 ILE 41 HG13 ILE 41 2.171 6.426 2.389
6 HG21 ILE 41 HG21 ILE 41 1.429 2.462 3.721
7 HG22 ILE 41 HG22 ILE 41 0.234 3.726 4.011
8 HG23 ILE 41 HG23 ILE 41 0.481 3.104 2.378
9 HD11 ILE 41 HD11 ILE 41 0.077 4.677 1.144
10 HD12 ILE 41 HD12 ILE 41 0.377 6.370 0.754
11 HD13 ILE 41 HD13 ILE 41 1.611 5.154 0.419
No H/Q in entry = 11
In of MODEL 10
1 H LEU 42 H LEU 42 4.808 3.339 3.873
2 HA LEU 42 HA LEU 42 4.118 0.982 5.239
3 HB2 LEU 42 HB2 LEU 42 6.780 2.057 4.359
4 HB3 LEU 42 HB3 LEU 42 6.623 0.518 5.172
5 HG LEU 42 HG LEU 42 5.546 1.286 2.467
6 HD11 LEU 42 HD11 LEU 42 7.898 0.702 2.540
7 HD12 LEU 42 HD12 LEU 42 7.511 -0.807 3.368
8 HD13 LEU 42 HD13 LEU 42 6.971 -0.547 1.711
9 HD21 LEU 42 HD21 LEU 42 4.995 -1.173 4.122
10 HD22 LEU 42 HD22 LEU 42 3.824 -0.048 3.434
11 HD23 LEU 42 HD23 LEU 42 4.759 -1.105 2.374
No H/Q in entry = 11
In of MODEL 10
1 H HIS 43 H HIS 43 5.917 3.828 6.228
2 HA HIS 43 HA HIS 43 6.752 2.921 8.757
3 HB2 HIS 43 HB2 HIS 43 7.538 5.018 7.623
4 HB3 HIS 43 HB3 HIS 43 5.979 5.748 7.985
5 HD1 HIS 43 HD1 HIS 43 6.199 7.295 9.898
6 HD2 HIS 43 HD2 HIS 43 8.636 3.956 10.321
7 HE1 HIS 43 HE1 HIS 43 7.394 7.603 12.083
8 HE2 HIS 43 HE2 HIS 43 8.731 5.497 12.395
No H/Q in entry = 8
In of MODEL 10
1 H TYR 44 H TYR 44 3.782 4.711 7.791
2 HA TYR 44 HA TYR 44 2.518 4.697 10.289
3 HB2 TYR 44 HB2 TYR 44 1.359 4.524 7.503
4 HB3 TYR 44 HB3 TYR 44 0.393 4.778 8.950
5 HD1 TYR 44 HD1 TYR 44 2.468 6.598 10.307
6 HD2 TYR 44 HD2 TYR 44 0.744 6.562 6.429
7 HE1 TYR 44 HE1 TYR 44 2.879 9.005 10.111
8 HE2 TYR 44 HE2 TYR 44 1.155 8.963 6.214
9 HH TYR 44 HH TYR 44 1.504 10.932 7.714
No H/Q in entry = 9
In of MODEL 10
1 H TYR 45 H TYR 45 2.374 2.449 7.608
2 HA TYR 45 HA TYR 45 0.521 0.629 8.464
3 HB2 TYR 45 HB2 TYR 45 1.483 0.713 6.212
4 HB3 TYR 45 HB3 TYR 45 3.037 0.192 6.844
5 HD1 TYR 45 HD1 TYR 45 -0.489 -0.949 6.952
6 HD2 TYR 45 HD2 TYR 45 3.594 -1.978 6.432
7 HE1 TYR 45 HE1 TYR 45 -1.143 -3.275 6.568
8 HE2 TYR 45 HE2 TYR 45 2.967 -4.322 6.037
9 HH TYR 45 HH TYR 45 1.102 -5.837 6.505
No H/Q in entry = 9
In of MODEL 10
1 H ASP 46 H ASP 46 4.037 0.576 9.086
2 HA ASP 46 HA ASP 46 3.818 -1.919 10.485
3 HB2 ASP 46 HB2 ASP 46 5.860 -1.091 9.160
4 HB3 ASP 46 HB3 ASP 46 6.205 -0.062 10.544
No H/Q in entry = 4
In of MODEL 10
1 H GLU 47 H GLU 47 3.364 1.324 11.414
2 HA GLU 47 HA GLU 47 3.910 0.725 14.216
3 HB2 GLU 47 HB2 GLU 47 3.106 3.271 12.821
4 HB3 GLU 47 HB3 GLU 47 3.269 3.129 14.562
5 HG2 GLU 47 HG2 GLU 47 5.649 2.396 14.151
6 HG3 GLU 47 HG3 GLU 47 5.411 2.899 12.476
No H/Q in entry = 6
In of MODEL 10
1 H LEU 48 H LEU 48 1.429 0.186 12.150
2 HA LEU 48 HA LEU 48 -0.791 1.301 13.396
3 HB2 LEU 48 HB2 LEU 48 -0.395 -0.943 11.475
4 HB3 LEU 48 HB3 LEU 48 -1.981 -0.617 12.145
5 HG LEU 48 HG LEU 48 -0.318 1.312 10.528
6 HD11 LEU 48 HD11 LEU 48 -1.226 -0.532 9.232
7 HD12 LEU 48 HD12 LEU 48 -2.828 -0.213 9.899
8 HD13 LEU 48 HD13 LEU 48 -2.056 0.978 8.852
9 HD21 LEU 48 HD21 LEU 48 -3.082 1.554 11.704
10 HD22 LEU 48 HD22 LEU 48 -1.661 2.497 12.154
11 HD23 LEU 48 HD23 LEU 48 -2.369 2.683 10.551
No H/Q in entry = 11
In of MODEL 10
1 H GLU 49 H GLU 49 -2.279 0.542 14.603
2 HA GLU 49 HA GLU 49 -1.722 -1.261 16.708
3 HB2 GLU 49 HB2 GLU 49 -4.390 -0.156 15.805
4 HB3 GLU 49 HB3 GLU 49 -4.053 -0.885 17.367
5 HG2 GLU 49 HG2 GLU 49 -2.816 1.643 16.308
6 HG3 GLU 49 HG3 GLU 49 -4.121 1.548 17.488
No H/Q in entry = 6
In of MODEL 10
1 H GLY 50 H GLY 50 -3.631 -2.964 17.203
2 HA2 GLY 50 HA2 GLY 50 -4.274 -5.116 16.762
3 HA3 GLY 50 HA3 GLY 50 -2.971 -5.144 15.590
No H/Q in entry = 3
In of MODEL 10
1 H ASP 51 H ASP 51 -6.245 -3.725 15.870
2 HA ASP 51 HA ASP 51 -7.120 -5.249 13.590
3 HB2 ASP 51 HB2 ASP 51 -8.528 -3.109 15.204
4 HB3 ASP 51 HB3 ASP 51 -9.290 -4.079 13.948
No H/Q in entry = 4
In of MODEL 10
1 H ALA 52 H ALA 52 -6.093 -1.965 14.204
2 HA ALA 52 HA ALA 52 -6.906 -0.782 11.759
3 HB1 ALA 52 HB1 ALA 52 -4.446 -0.165 13.409
4 HB2 ALA 52 HB2 ALA 52 -5.180 0.878 12.190
5 HB3 ALA 52 HB3 ALA 52 -6.051 0.514 13.680
No H/Q in entry = 5
In of MODEL 10
1 H LYS 53 H LYS 53 -4.003 -2.562 12.699
2 HA LYS 53 HA LYS 53 -2.560 -2.430 10.329
3 HB2 LYS 53 HB2 LYS 53 -2.392 -3.842 12.751
4 HB3 LYS 53 HB3 LYS 53 -2.456 -5.081 11.511
5 HG2 LYS 53 HG2 LYS 53 -0.457 -2.843 11.701
6 HG3 LYS 53 HG3 LYS 53 -0.171 -4.546 12.046
7 HD2 LYS 53 HD2 LYS 53 -0.768 -5.041 9.666
8 HD3 LYS 53 HD3 LYS 53 -0.815 -3.300 9.378
9 HE2 LYS 53 HE2 LYS 53 1.337 -4.080 8.703
10 HE3 LYS 53 HE3 LYS 53 1.544 -3.179 10.203
11 HZ1 LYS 53 HZ1 LYS 53 1.387 -6.138 9.995
12 HZ2 LYS 53 HZ2 LYS 53 2.813 -5.247 10.184
13 HZ3 LYS 53 HZ3 LYS 53 1.650 -5.253 11.411
No H/Q in entry = 13
In of MODEL 10
1 H LYS 54 H LYS 54 -4.823 -4.931 11.414
2 HA LYS 54 HA LYS 54 -4.847 -6.564 9.211
3 HB2 LYS 54 HB2 LYS 54 -7.179 -5.873 10.990
4 HB3 LYS 54 HB3 LYS 54 -7.091 -7.270 9.928
5 HG2 LYS 54 HG2 LYS 54 -5.126 -8.054 11.197
6 HG3 LYS 54 HG3 LYS 54 -5.351 -6.705 12.312
7 HD2 LYS 54 HD2 LYS 54 -7.594 -7.520 12.831
8 HD3 LYS 54 HD3 LYS 54 -7.353 -8.869 11.724
9 HE2 LYS 54 HE2 LYS 54 -5.660 -8.321 14.157
10 HE3 LYS 54 HE3 LYS 54 -7.000 -9.466 14.107
11 HZ1 LYS 54 HZ1 LYS 54 -4.576 -9.619 12.395
12 HZ2 LYS 54 HZ2 LYS 54 -4.831 -10.528 13.799
13 HZ3 LYS 54 HZ3 LYS 54 -5.839 -10.748 12.456
No H/Q in entry = 13
In of MODEL 10
1 H GLU 55 H GLU 55 -7.000 -3.811 9.872
2 HA GLU 55 HA GLU 55 -8.475 -4.016 7.507
3 HB2 GLU 55 HB2 GLU 55 -8.029 -1.895 9.589
4 HB3 GLU 55 HB3 GLU 55 -8.987 -1.530 8.170
5 HG2 GLU 55 HG2 GLU 55 -9.544 -3.783 10.072
6 HG3 GLU 55 HG3 GLU 55 -10.310 -2.201 10.137
No H/Q in entry = 6
In of MODEL 10
1 H ALA 56 H ALA 56 -5.756 -1.860 8.383
2 HA ALA 56 HA ALA 56 -5.705 -0.556 5.928
3 HB1 ALA 56 HB1 ALA 56 -3.407 0.091 6.476
4 HB2 ALA 56 HB2 ALA 56 -3.362 -1.128 7.751
5 HB3 ALA 56 HB3 ALA 56 -4.459 0.249 7.882
No H/Q in entry = 5
In of MODEL 10
1 H THR 57 H THR 57 -3.863 -3.370 7.037
2 HA THR 57 HA THR 57 -2.365 -3.926 4.815
3 HB THR 57 HB THR 57 -3.784 -5.951 6.555
4 HG1 THR 57 HG1 THR 57 -2.510 -4.783 7.894
5 HG21 THR 57 HG21 THR 57 -1.419 -6.186 4.700
6 HG22 THR 57 HG22 THR 57 -1.868 -7.409 5.891
7 HG23 THR 57 HG23 THR 57 -2.972 -7.012 4.575
No H/Q in entry = 7
In of MODEL 10
1 H GLU 58 H GLU 58 -5.689 -4.941 5.460
2 HA GLU 58 HA GLU 58 -6.020 -6.349 2.987
3 HB2 GLU 58 HB2 GLU 58 -7.913 -5.416 5.119
4 HB3 GLU 58 HB3 GLU 58 -8.491 -6.168 3.634
5 HG2 GLU 58 HG2 GLU 58 -7.043 -8.124 4.131
6 HG3 GLU 58 HG3 GLU 58 -6.637 -7.376 5.675
No H/Q in entry = 6
In of MODEL 10
1 H HIS 59 H HIS 59 -6.268 -2.997 3.856
2 HA HIS 59 HA HIS 59 -7.817 -2.330 1.508
3 HB2 HIS 59 HB2 HIS 59 -6.426 -0.698 3.615
4 HB3 HIS 59 HB3 HIS 59 -7.022 0.056 2.144
5 HD1 HIS 59 HD1 HIS 59 -9.748 -1.053 1.771
6 HD2 HIS 59 HD2 HIS 59 -8.232 -0.168 5.541
7 HE1 HIS 59 HE1 HIS 59 -11.754 -0.734 3.247
8 HE2 HIS 59 HE2 HIS 59 -10.820 -0.135 5.510
No H/Q in entry = 8
In of MODEL 10
1 H LEU 60 H LEU 60 -4.452 -1.850 2.575
2 HA LEU 60 HA LEU 60 -3.359 -1.050 0.186
3 HB2 LEU 60 HB2 LEU 60 -2.301 -2.558 2.541
4 HB3 LEU 60 HB3 LEU 60 -1.281 -2.275 1.141
5 HG LEU 60 HG LEU 60 -1.793 0.151 1.395
6 HD11 LEU 60 HD11 LEU 60 -3.784 0.006 2.682
7 HD12 LEU 60 HD12 LEU 60 -2.876 -0.660 4.042
8 HD13 LEU 60 HD13 LEU 60 -2.569 0.994 3.501
9 HD21 LEU 60 HD21 LEU 60 -0.355 -1.197 3.662
10 HD22 LEU 60 HD22 LEU 60 0.340 -0.749 2.105
11 HD23 LEU 60 HD23 LEU 60 -0.192 0.502 3.225
No H/Q in entry = 11
In of MODEL 10
1 H LYS 61 H LYS 61 -4.225 -4.291 1.281
2 HA LYS 61 HA LYS 61 -3.002 -5.774 -0.742
3 HB2 LYS 61 HB2 LYS 61 -5.489 -6.225 0.881
4 HB3 LYS 61 HB3 LYS 61 -5.045 -7.343 -0.402
5 HG2 LYS 61 HG2 LYS 61 -2.903 -7.755 0.698
6 HG3 LYS 61 HG3 LYS 61 -3.348 -6.633 1.985
7 HD2 LYS 61 HD2 LYS 61 -5.200 -8.059 2.631
8 HD3 LYS 61 HD3 LYS 61 -4.873 -9.140 1.277
9 HE2 LYS 61 HE2 LYS 61 -2.746 -9.755 2.218
10 HE3 LYS 61 HE3 LYS 61 -2.936 -8.581 3.514
11 HZ1 LYS 61 HZ1 LYS 61 -4.713 -10.917 3.078
12 HZ2 LYS 61 HZ2 LYS 61 -3.450 -10.868 4.196
13 HZ3 LYS 61 HZ3 LYS 61 -4.775 -9.840 4.380
No H/Q in entry = 13
In of MODEL 10
1 H GLY 62 H GLY 62 -6.330 -4.485 -0.664
2 HA2 GLY 62 HA2 GLY 62 -7.680 -3.743 -2.360
3 HA3 GLY 62 HA3 GLY 62 -7.036 -5.089 -3.288
No H/Q in entry = 3
In of MODEL 10
1 H GLY 63 H GLY 63 -5.310 -2.244 -2.031
2 HA2 GLY 63 HA2 GLY 63 -3.934 -0.752 -3.106
3 HA3 GLY 63 HA3 GLY 63 -5.078 -0.838 -4.442
No H/Q in entry = 3
In of MODEL 10
1 H CYS 64 H CYS 64 -2.875 -3.223 -3.002
2 HA CYS 64 HA CYS 64 -1.042 -3.315 -5.126
3 HB2 CYS 64 HB2 CYS 64 -0.483 -4.267 -2.979
4 HB3 CYS 64 HB3 CYS 64 -1.821 -5.405 -3.083
No H/Q in entry = 4
In of MODEL 10
1 H ARG 65 H ARG 65 -4.031 -5.053 -4.495
2 HA ARG 65 HA ARG 65 -4.007 -6.893 -6.557
3 HB2 ARG 65 HB2 ARG 65 -5.704 -6.951 -4.853
4 HB3 ARG 65 HB3 ARG 65 -6.311 -5.374 -5.331
5 HG2 ARG 65 HG2 ARG 65 -6.343 -7.320 -7.499
6 HG3 ARG 65 HG3 ARG 65 -7.327 -7.792 -6.111
7 HD2 ARG 65 HD2 ARG 65 -7.496 -5.163 -7.587
8 HD3 ARG 65 HD3 ARG 65 -8.631 -6.504 -7.736
9 HE ARG 65 HE ARG 65 -8.573 -5.911 -5.058
10 HH11 ARG 65 HH11 ARG 65 -9.365 -4.152 -7.985
11 HH12 ARG 65 HH12 ARG 65 -10.457 -3.073 -7.183
12 HH21 ARG 65 HH21 ARG 65 -10.011 -4.500 -4.013
13 HH22 ARG 65 HH22 ARG 65 -10.844 -3.284 -4.930
No H/Q in entry = 13
In of MODEL 10
1 H GLU 66 H GLU 66 -5.140 -3.505 -6.642
2 HA GLU 66 HA GLU 66 -5.958 -3.580 -9.338
3 HB2 GLU 66 HB2 GLU 66 -5.145 -1.283 -7.569
4 HB3 GLU 66 HB3 GLU 66 -5.686 -1.059 -9.226
5 HG2 GLU 66 HG2 GLU 66 -7.785 -2.302 -8.566
6 HG3 GLU 66 HG3 GLU 66 -7.243 -2.121 -6.896
No H/Q in entry = 6
In of MODEL 10
1 H ILE 67 H ILE 67 -2.849 -2.745 -7.852
2 HA ILE 67 HA ILE 67 -1.622 -1.985 -10.303
3 HB ILE 67 HB ILE 67 -0.432 -2.845 -7.671
4 HG12 ILE 67 HG12 ILE 67 -0.649 -0.172 -9.078
5 HG13 ILE 67 HG13 ILE 67 -1.615 -0.695 -7.706
6 HG21 ILE 67 HG21 ILE 67 1.018 -1.845 -10.128
7 HG22 ILE 67 HG22 ILE 67 1.740 -2.067 -8.536
8 HG23 ILE 67 HG23 ILE 67 1.140 -3.463 -9.436
9 HD11 ILE 67 HD11 ILE 67 1.358 -0.242 -7.696
10 HD12 ILE 67 HD12 ILE 67 0.135 0.842 -7.032
11 HD13 ILE 67 HD13 ILE 67 0.383 -0.753 -6.316
No H/Q in entry = 11
In of MODEL 10
1 H LEU 68 H LEU 68 -1.760 -5.022 -8.496
2 HA LEU 68 HA LEU 68 -0.128 -6.509 -10.273
3 HB2 LEU 68 HB2 LEU 68 -0.863 -7.076 -7.882
4 HB3 LEU 68 HB3 LEU 68 -2.367 -7.628 -8.595
5 HG LEU 68 HG LEU 68 -1.171 -9.326 -9.871
6 HD11 LEU 68 HD11 LEU 68 1.291 -8.233 -8.513
7 HD12 LEU 68 HD12 LEU 68 1.225 -9.710 -9.473
8 HD13 LEU 68 HD13 LEU 68 0.923 -8.149 -10.234
9 HD21 LEU 68 HD21 LEU 68 -0.465 -9.293 -6.940
10 HD22 LEU 68 HD22 LEU 68 -1.960 -9.904 -7.653
11 HD23 LEU 68 HD23 LEU 68 -0.429 -10.713 -7.984
No H/Q in entry = 11
In of MODEL 10
1 H LYS 69 H LYS 69 -3.435 -5.513 -10.279
2 HA LYS 69 HA LYS 69 -4.267 -7.184 -12.407
3 HB2 LYS 69 HB2 LYS 69 -5.385 -4.627 -11.295
4 HB3 LYS 69 HB3 LYS 69 -6.079 -5.388 -12.720
5 HG2 LYS 69 HG2 LYS 69 -6.374 -7.469 -11.362
6 HG3 LYS 69 HG3 LYS 69 -5.880 -6.538 -9.948
7 HD2 LYS 69 HD2 LYS 69 -8.274 -6.585 -10.011
8 HD3 LYS 69 HD3 LYS 69 -7.748 -4.953 -10.427
9 HE2 LYS 69 HE2 LYS 69 -8.061 -5.448 -12.796
10 HE3 LYS 69 HE3 LYS 69 -8.549 -7.094 -12.397
11 HZ1 LYS 69 HZ1 LYS 69 -9.974 -4.622 -11.588
12 HZ2 LYS 69 HZ2 LYS 69 -10.448 -5.676 -12.819
13 HZ3 LYS 69 HZ3 LYS 69 -10.451 -6.199 -11.213
No H/Q in entry = 13
In of MODEL 10
1 H HIS 70 H HIS 70 -2.049 -4.747 -12.359
2 HA HIS 70 HA HIS 70 -2.560 -3.976 -15.135
3 HB2 HIS 70 HB2 HIS 70 -2.360 -2.037 -13.638
4 HB3 HIS 70 HB3 HIS 70 -0.814 -2.636 -13.048
5 HD1 HIS 70 HD1 HIS 70 -2.186 -0.329 -15.423
6 HD2 HIS 70 HD2 HIS 70 1.162 -2.804 -15.294
7 HE1 HIS 70 HE1 HIS 70 -0.605 0.589 -17.145
8 HE2 HIS 70 HE2 HIS 70 1.290 -1.065 -17.219
No H/Q in entry = 8
In of MODEL 10
1 H VAL 71 H VAL 71 -0.011 -4.757 -12.821
2 HA VAL 71 HA VAL 71 1.999 -5.033 -14.752
3 HB VAL 71 HB VAL 71 2.590 -4.332 -12.575
4 HG11 VAL 71 HG11 VAL 71 1.474 -6.890 -11.569
5 HG12 VAL 71 HG12 VAL 71 2.409 -5.734 -10.615
6 HG13 VAL 71 HG13 VAL 71 0.851 -5.261 -11.304
7 HG21 VAL 71 HG21 VAL 71 3.583 -7.108 -13.031
8 HG22 VAL 71 HG22 VAL 71 4.269 -5.619 -13.675
9 HG23 VAL 71 HG23 VAL 71 4.304 -5.926 -11.937
No H/Q in entry = 9
In of MODEL 10
1 H VAL 72 H VAL 72 0.244 -7.498 -12.861
2 HA VAL 72 HA VAL 72 1.437 -9.499 -14.608
3 HB VAL 72 HB VAL 72 1.070 -9.586 -11.953
4 HG11 VAL 72 HG11 VAL 72 -1.386 -10.838 -13.081
5 HG12 VAL 72 HG12 VAL 72 -0.731 -11.246 -11.496
6 HG13 VAL 72 HG13 VAL 72 -1.257 -9.600 -11.841
7 HG21 VAL 72 HG21 VAL 72 1.088 -11.870 -13.864
8 HG22 VAL 72 HG22 VAL 72 2.478 -11.037 -13.170
9 HG23 VAL 72 HG23 VAL 72 1.420 -11.994 -12.133
No H/Q in entry = 9
In of MODEL 10
1 H GLY 73 H GLY 73 -1.332 -7.645 -14.312
2 HA2 GLY 73 HA2 GLY 73 -2.522 -9.049 -16.554
3 HA3 GLY 73 HA3 GLY 73 -2.992 -7.471 -15.939
No H/Q in entry = 3
In of MODEL 10
1 H GLU 74 H GLU 74 -5.166 -8.300 -16.236
2 HA GLU 74 HA GLU 74 -6.275 -9.165 -13.776
3 HB2 GLU 74 HB2 GLU 74 -7.561 -9.007 -16.510
4 HB3 GLU 74 HB3 GLU 74 -8.418 -9.151 -14.979
5 HG2 GLU 74 HG2 GLU 74 -7.474 -6.995 -14.270
6 HG3 GLU 74 HG3 GLU 74 -6.680 -6.847 -15.835
No H/Q in entry = 6
In of MODEL 10
1 H GLU 75 H GLU 75 -5.324 -10.768 -16.691
2 HA GLU 75 HA GLU 75 -6.315 -13.357 -16.453
3 HB2 GLU 75 HB2 GLU 75 -4.892 -12.541 -18.291
4 HB3 GLU 75 HB3 GLU 75 -3.517 -12.507 -17.196
5 HG2 GLU 75 HG2 GLU 75 -3.313 -14.484 -18.442
6 HG3 GLU 75 HG3 GLU 75 -3.876 -14.970 -16.845
No H/Q in entry = 6
In of MODEL 10
1 H LYS 76 H LYS 76 -3.210 -12.228 -15.117
2 HA LYS 76 HA LYS 76 -2.934 -14.756 -13.776
3 HB2 LYS 76 HB2 LYS 76 -0.980 -13.896 -14.810
4 HB3 LYS 76 HB3 LYS 76 -1.145 -12.348 -14.019
5 HG2 LYS 76 HG2 LYS 76 0.671 -13.661 -13.092
6 HG3 LYS 76 HG3 LYS 76 -0.566 -13.327 -11.889
7 HD2 LYS 76 HD2 LYS 76 0.261 -15.628 -11.727
8 HD3 LYS 76 HD3 LYS 76 -1.443 -15.596 -12.170
9 HE2 LYS 76 HE2 LYS 76 -0.159 -17.260 -13.449
10 HE3 LYS 76 HE3 LYS 76 -0.891 -16.036 -14.476
11 HZ1 LYS 76 HZ1 LYS 76 1.294 -14.905 -14.515
12 HZ2 LYS 76 HZ2 LYS 76 1.956 -16.209 -13.662
13 HZ3 LYS 76 HZ3 LYS 76 1.324 -16.446 -15.211
No H/Q in entry = 13
In of MODEL 10
1 H ALA 77 H ALA 77 -3.641 -11.436 -12.847
2 HA ALA 77 HA ALA 77 -3.406 -11.814 -10.060
3 HB1 ALA 77 HB1 ALA 77 -4.853 -9.844 -9.850
4 HB2 ALA 77 HB2 ALA 77 -5.245 -9.943 -11.567
5 HB3 ALA 77 HB3 ALA 77 -3.594 -9.586 -11.057
No H/Q in entry = 5
In of MODEL 10
1 H ALA 78 H ALA 78 -5.832 -12.678 -12.397
2 HA ALA 78 HA ALA 78 -7.879 -13.388 -10.542
3 HB1 ALA 78 HB1 ALA 78 -7.359 -14.079 -13.434
4 HB2 ALA 78 HB2 ALA 78 -8.743 -14.720 -12.532
5 HB3 ALA 78 HB3 ALA 78 -8.569 -12.981 -12.768
No H/Q in entry = 5
In of MODEL 10
1 H GLU 79 H GLU 79 -5.194 -15.023 -12.087
2 HA GLU 79 HA GLU 79 -5.843 -17.633 -11.148
3 HB2 GLU 79 HB2 GLU 79 -3.159 -16.586 -12.058
4 HB3 GLU 79 HB3 GLU 79 -3.663 -18.268 -11.988
5 HG2 GLU 79 HG2 GLU 79 -5.405 -17.752 -13.668
6 HG3 GLU 79 HG3 GLU 79 -4.737 -16.132 -13.805
No H/Q in entry = 6
In of MODEL 10
1 H LEU 80 H LEU 80 -3.882 -14.981 -9.965
2 HA LEU 80 HA LEU 80 -2.829 -16.415 -7.735
3 HB2 LEU 80 HB2 LEU 80 -3.076 -13.455 -8.283
4 HB3 LEU 80 HB3 LEU 80 -2.136 -14.163 -6.978
5 HG LEU 80 HG LEU 80 -1.630 -14.772 -9.886
6 HD11 LEU 80 HD11 LEU 80 -0.331 -12.722 -8.118
7 HD12 LEU 80 HD12 LEU 80 0.329 -13.278 -9.660
8 HD13 LEU 80 HD13 LEU 80 -1.232 -12.443 -9.609
9 HD21 LEU 80 HD21 LEU 80 -0.855 -16.440 -8.319
10 HD22 LEU 80 HD22 LEU 80 0.503 -15.582 -9.043
11 HD23 LEU 80 HD23 LEU 80 -0.004 -15.200 -7.397
No H/Q in entry = 11
In of MODEL 10
1 H LYS 81 H LYS 81 -5.718 -14.611 -8.390
2 HA LYS 81 HA LYS 81 -6.564 -14.352 -5.675
3 HB2 LYS 81 HB2 LYS 81 -7.367 -13.050 -7.776
4 HB3 LYS 81 HB3 LYS 81 -8.412 -14.432 -8.059
5 HG2 LYS 81 HG2 LYS 81 -8.428 -12.757 -5.553
6 HG3 LYS 81 HG3 LYS 81 -9.530 -12.550 -6.913
7 HD2 LYS 81 HD2 LYS 81 -10.341 -14.849 -6.574
8 HD3 LYS 81 HD3 LYS 81 -9.266 -15.009 -5.184
9 HE2 LYS 81 HE2 LYS 81 -10.430 -13.101 -4.123
10 HE3 LYS 81 HE3 LYS 81 -11.555 -13.073 -5.480
11 HZ1 LYS 81 HZ1 LYS 81 -12.174 -15.366 -4.918
12 HZ2 LYS 81 HZ2 LYS 81 -11.158 -15.306 -3.562
13 HZ3 LYS 81 HZ3 LYS 81 -12.509 -14.285 -3.665
No H/Q in entry = 13
In of MODEL 10
1 H ASN 82 H ASN 82 -7.413 -16.546 -8.350
2 HA ASN 82 HA ASN 82 -9.112 -18.172 -6.788
3 HB2 ASN 82 HB2 ASN 82 -9.136 -18.077 -9.299
4 HB3 ASN 82 HB3 ASN 82 -7.599 -18.926 -9.310
5 HD21 ASN 82 HD21 ASN 82 -7.538 -21.109 -8.880
6 HD22 ASN 82 HD22 ASN 82 -8.962 -22.083 -8.817
No H/Q in entry = 6
In of MODEL 10
1 H LEU 83 H LEU 83 -5.626 -18.347 -7.512
2 HA LEU 83 HA LEU 83 -5.043 -20.785 -6.354
3 HB2 LEU 83 HB2 LEU 83 -3.678 -18.336 -7.023
4 HB3 LEU 83 HB3 LEU 83 -3.074 -18.969 -5.514
5 HG LEU 83 HG LEU 83 -1.805 -19.658 -7.555
6 HD11 LEU 83 HD11 LEU 83 -3.027 -21.857 -5.898
7 HD12 LEU 83 HD12 LEU 83 -1.573 -22.012 -6.883
8 HD13 LEU 83 HD13 LEU 83 -1.587 -20.920 -5.498
9 HD21 LEU 83 HD21 LEU 83 -3.681 -19.957 -9.071
10 HD22 LEU 83 HD22 LEU 83 -2.728 -21.436 -8.948
11 HD23 LEU 83 HD23 LEU 83 -4.265 -21.304 -8.097
No H/Q in entry = 11
In of MODEL 10
1 H LYS 84 H LYS 84 -5.086 -17.604 -4.778
2 HA LYS 84 HA LYS 84 -4.722 -18.196 -2.165
3 HB2 LYS 84 HB2 LYS 84 -4.979 -15.934 -2.785
4 HB3 LYS 84 HB3 LYS 84 -6.576 -16.212 -3.464
5 HG2 LYS 84 HG2 LYS 84 -7.413 -16.652 -1.168
6 HG3 LYS 84 HG3 LYS 84 -5.821 -16.210 -0.547
7 HD2 LYS 84 HD2 LYS 84 -6.039 -13.979 -1.325
8 HD3 LYS 84 HD3 LYS 84 -7.457 -14.385 -2.294
9 HE2 LYS 84 HE2 LYS 84 -7.325 -14.492 0.716
10 HE3 LYS 84 HE3 LYS 84 -8.017 -13.166 -0.214
11 HZ1 LYS 84 HZ1 LYS 84 -9.607 -14.771 -1.166
12 HZ2 LYS 84 HZ2 LYS 84 -8.980 -15.971 -0.156
13 HZ3 LYS 84 HZ3 LYS 84 -9.753 -14.626 0.515
No H/Q in entry = 13
In of MODEL 10
1 H ASP 85 H ASP 85 -8.021 -18.014 -3.564
2 HA ASP 85 HA ASP 85 -9.188 -18.991 -1.171
3 HB2 ASP 85 HB2 ASP 85 -10.235 -18.323 -3.882
4 HB3 ASP 85 HB3 ASP 85 -11.263 -19.192 -2.743
No H/Q in entry = 4
In of MODEL 10
1 H SER 86 H SER 86 -7.914 -20.640 -3.925
2 HA SER 86 HA SER 86 -9.348 -23.084 -3.362
3 HB2 SER 86 HB2 SER 86 -6.947 -22.607 -5.143
4 HB3 SER 86 HB3 SER 86 -7.922 -24.077 -5.096
5 HG SER 86 HG SER 86 -8.580 -21.519 -6.070
No H/Q in entry = 5
In of MODEL 10
1 H GLY 87 H GLY 87 -6.767 -21.490 -1.998
2 HA2 GLY 87 HA2 GLY 87 -6.021 -23.971 -0.577
3 HA3 GLY 87 HA3 GLY 87 -6.098 -22.387 0.180
No H/Q in entry = 3
In of MODEL 10
1 H ALA 88 H ALA 88 -4.768 -20.970 -1.961
2 HA ALA 88 HA ALA 88 -2.134 -22.112 -1.971
3 HB1 ALA 88 HB1 ALA 88 -2.987 -19.323 -2.724
4 HB2 ALA 88 HB2 ALA 88 -2.835 -20.693 -3.825
5 HB3 ALA 88 HB3 ALA 88 -1.405 -20.045 -3.021
No H/Q in entry = 5
In of MODEL 10
1 H SER 89 H SER 89 -0.913 -22.025 -0.276
2 HA SER 89 HA SER 89 -1.364 -20.375 1.989
3 HB2 SER 89 HB2 SER 89 1.112 -21.982 1.360
4 HB3 SER 89 HB3 SER 89 0.445 -21.577 2.934
5 HG SER 89 HG SER 89 -1.319 -22.929 2.493
No H/Q in entry = 5
In of MODEL 10
1 H LYS 90 H LYS 90 0.737 -19.213 2.885
2 HA LYS 90 HA LYS 90 1.181 -16.914 1.456
3 HB2 LYS 90 HB2 LYS 90 2.918 -18.296 3.492
4 HB3 LYS 90 HB3 LYS 90 3.306 -16.710 2.846
5 HG2 LYS 90 HG2 LYS 90 1.327 -15.766 3.770
6 HG3 LYS 90 HG3 LYS 90 0.716 -17.355 4.227
7 HD2 LYS 90 HD2 LYS 90 1.625 -16.137 6.153
8 HD3 LYS 90 HD3 LYS 90 2.527 -17.616 5.828
9 HE2 LYS 90 HE2 LYS 90 3.486 -15.082 4.602
10 HE3 LYS 90 HE3 LYS 90 3.734 -15.315 6.328
11 HZ1 LYS 90 HZ1 LYS 90 4.650 -17.200 4.214
12 HZ2 LYS 90 HZ2 LYS 90 5.628 -16.068 5.003
13 HZ3 LYS 90 HZ3 LYS 90 4.935 -17.338 5.877
No H/Q in entry = 13
In of MODEL 10
1 H GLU 91 H GLU 91 3.074 -19.892 1.380
2 HA GLU 91 HA GLU 91 5.117 -18.706 -0.209
3 HB2 GLU 91 HB2 GLU 91 4.641 -21.458 0.834
4 HB3 GLU 91 HB3 GLU 91 5.892 -21.167 -0.367
5 HG2 GLU 91 HG2 GLU 91 6.902 -21.092 1.777
6 HG3 GLU 91 HG3 GLU 91 6.864 -19.456 1.146
No H/Q in entry = 6
In of MODEL 10
1 H GLU 92 H GLU 92 2.459 -20.967 -0.947
2 HA GLU 92 HA GLU 92 2.980 -21.533 -3.582
3 HB2 GLU 92 HB2 GLU 92 0.303 -20.954 -2.313
4 HB3 GLU 92 HB3 GLU 92 0.579 -21.855 -3.789
5 HG2 GLU 92 HG2 GLU 92 1.574 -22.676 -1.094
6 HG3 GLU 92 HG3 GLU 92 0.091 -23.254 -1.836
No H/Q in entry = 6
In of MODEL 10
1 H LEU 93 H LEU 93 1.227 -18.790 -2.157
2 HA LEU 93 HA LEU 93 1.024 -17.397 -4.632
3 HB2 LEU 93 HB2 LEU 93 0.881 -16.388 -1.794
4 HB3 LEU 93 HB3 LEU 93 0.622 -15.363 -3.198
5 HG LEU 93 HG LEU 93 -1.062 -17.689 -2.280
6 HD11 LEU 93 HD11 LEU 93 -1.655 -14.780 -2.761
7 HD12 LEU 93 HD12 LEU 93 -2.852 -16.006 -2.340
8 HD13 LEU 93 HD13 LEU 93 -1.567 -15.598 -1.200
9 HD21 LEU 93 HD21 LEU 93 -1.157 -16.222 -4.910
10 HD22 LEU 93 HD22 LEU 93 -0.859 -17.940 -4.657
11 HD23 LEU 93 HD23 LEU 93 -2.443 -17.259 -4.298
No H/Q in entry = 11
In of MODEL 10
1 H LYS 94 H LYS 94 3.582 -17.499 -2.145
2 HA LYS 94 HA LYS 94 4.927 -15.244 -3.221
3 HB2 LYS 94 HB2 LYS 94 5.312 -16.302 -0.929
4 HB3 LYS 94 HB3 LYS 94 6.276 -17.514 -1.759
5 HG2 LYS 94 HG2 LYS 94 7.784 -15.785 -2.575
6 HG3 LYS 94 HG3 LYS 94 6.807 -14.545 -1.790
7 HD2 LYS 94 HD2 LYS 94 8.597 -14.914 -0.320
8 HD3 LYS 94 HD3 LYS 94 7.251 -15.810 0.383
9 HE2 LYS 94 HE2 LYS 94 9.215 -17.176 0.501
10 HE3 LYS 94 HE3 LYS 94 8.133 -17.866 -0.708
11 HZ1 LYS 94 HZ1 LYS 94 10.422 -16.087 -1.354
12 HZ2 LYS 94 HZ2 LYS 94 10.498 -17.775 -1.388
13 HZ3 LYS 94 HZ3 LYS 94 9.467 -16.959 -2.446
No H/Q in entry = 13
In of MODEL 10
1 H ALA 95 H ALA 95 5.073 -18.682 -3.819
2 HA ALA 95 HA ALA 95 7.266 -18.364 -5.660
3 HB1 ALA 95 HB1 ALA 95 7.226 -20.293 -4.137
4 HB2 ALA 95 HB2 ALA 95 7.207 -20.813 -5.825
5 HB3 ALA 95 HB3 ALA 95 5.714 -20.831 -4.878
No H/Q in entry = 5
In of MODEL 10
1 H LYS 96 H LYS 96 3.806 -18.701 -5.767
2 HA LYS 96 HA LYS 96 3.639 -18.986 -8.563
3 HB2 LYS 96 HB2 LYS 96 1.795 -18.808 -6.642
4 HB3 LYS 96 HB3 LYS 96 1.737 -17.143 -7.204
5 HG2 LYS 96 HG2 LYS 96 0.064 -18.313 -8.380
6 HG3 LYS 96 HG3 LYS 96 1.384 -18.051 -9.521
7 HD2 LYS 96 HD2 LYS 96 2.179 -20.334 -9.111
8 HD3 LYS 96 HD3 LYS 96 0.850 -20.591 -7.982
9 HE2 LYS 96 HE2 LYS 96 0.166 -21.566 -10.020
10 HE3 LYS 96 HE3 LYS 96 -0.712 -20.041 -9.889
11 HZ1 LYS 96 HZ1 LYS 96 0.908 -19.029 -11.375
12 HZ2 LYS 96 HZ2 LYS 96 1.747 -20.489 -11.500
13 HZ3 LYS 96 HZ3 LYS 96 0.180 -20.362 -12.111
No H/Q in entry = 13
In of MODEL 10
1 H VAL 97 H VAL 97 3.374 -16.043 -6.680
2 HA VAL 97 HA VAL 97 3.407 -14.130 -8.594
3 HB VAL 97 HB VAL 97 4.637 -14.021 -5.845
4 HG11 VAL 97 HG11 VAL 97 3.922 -11.757 -7.694
5 HG12 VAL 97 HG12 VAL 97 4.423 -11.596 -6.010
6 HG13 VAL 97 HG13 VAL 97 5.550 -12.229 -7.209
7 HG21 VAL 97 HG21 VAL 97 1.954 -13.183 -6.935
8 HG22 VAL 97 HG22 VAL 97 2.279 -14.563 -5.881
9 HG23 VAL 97 HG23 VAL 97 2.512 -12.919 -5.280
No H/Q in entry = 9
In of MODEL 10
1 H GLU 98 H GLU 98 6.345 -15.572 -7.142
2 HA GLU 98 HA GLU 98 8.237 -13.990 -8.419
3 HB2 GLU 98 HB2 GLU 98 8.382 -16.932 -7.752
4 HB3 GLU 98 HB3 GLU 98 9.761 -15.966 -8.259
5 HG2 GLU 98 HG2 GLU 98 8.100 -15.476 -5.795
6 HG3 GLU 98 HG3 GLU 98 9.658 -16.297 -5.828
No H/Q in entry = 6
In of MODEL 10
1 H GLU 99 H GLU 99 6.728 -16.987 -9.577
2 HA GLU 99 HA GLU 99 8.051 -17.096 -12.069
3 HB2 GLU 99 HB2 GLU 99 5.289 -18.122 -11.384
4 HB3 GLU 99 HB3 GLU 99 6.282 -18.637 -12.738
5 HG2 GLU 99 HG2 GLU 99 7.026 -19.006 -9.850
6 HG3 GLU 99 HG3 GLU 99 6.230 -20.224 -10.840
No H/Q in entry = 6
In of MODEL 10
1 H ALA 100 H ALA 100 5.031 -15.555 -11.027
2 HA ALA 100 HA ALA 100 4.170 -14.917 -13.658
3 HB1 ALA 100 HB1 ALA 100 3.341 -13.796 -10.987
4 HB2 ALA 100 HB2 ALA 100 2.588 -15.137 -11.851
5 HB3 ALA 100 HB3 ALA 100 2.513 -13.509 -12.516
No H/Q in entry = 5
In of MODEL 10
1 H LEU 101 H LEU 101 5.803 -13.037 -11.120
2 HA LEU 101 HA LEU 101 5.916 -10.669 -12.701
3 HB2 LEU 101 HB2 LEU 101 7.419 -11.426 -10.205
4 HB3 LEU 101 HB3 LEU 101 7.374 -9.823 -10.911
5 HG LEU 101 HG LEU 101 5.075 -11.317 -9.659
6 HD11 LEU 101 HD11 LEU 101 6.635 -10.312 -8.099
7 HD12 LEU 101 HD12 LEU 101 6.481 -8.760 -8.923
8 HD13 LEU 101 HD13 LEU 101 5.093 -9.456 -8.087
9 HD21 LEU 101 HD21 LEU 101 5.080 -8.661 -11.090
10 HD22 LEU 101 HD22 LEU 101 4.233 -10.123 -11.588
11 HD23 LEU 101 HD23 LEU 101 3.750 -9.284 -10.114
No H/Q in entry = 11
In of MODEL 10
1 H HIS 102 H HIS 102 7.767 -13.531 -12.696
2 HA HIS 102 HA HIS 102 10.024 -12.169 -13.870
3 HB2 HIS 102 HB2 HIS 102 9.407 -15.053 -13.319
4 HB3 HIS 102 HB3 HIS 102 10.712 -14.631 -14.422
5 HD1 HIS 102 HD1 HIS 102 12.295 -15.805 -12.637
6 HD2 HIS 102 HD2 HIS 102 10.440 -12.310 -11.367
7 HE1 HIS 102 HE1 HIS 102 13.546 -15.086 -10.581
8 HE2 HIS 102 HE2 HIS 102 12.500 -12.893 -9.916
No H/Q in entry = 8
In of MODEL 10
1 H ALA 103 H ALA 103 7.381 -14.299 -14.903
2 HA ALA 103 HA ALA 103 8.181 -14.521 -17.578
3 HB1 ALA 103 HB1 ALA 103 5.392 -14.825 -16.487
4 HB2 ALA 103 HB2 ALA 103 6.646 -16.058 -16.377
5 HB3 ALA 103 HB3 ALA 103 6.046 -15.549 -17.957
No H/Q in entry = 5
In of MODEL 10
1 H VAL 104 H VAL 104 7.130 -11.750 -16.117
2 HA VAL 104 HA VAL 104 5.524 -10.764 -18.293
3 HB VAL 104 HB VAL 104 4.879 -10.192 -16.037
4 HG11 VAL 104 HG11 VAL 104 7.655 -9.107 -15.895
5 HG12 VAL 104 HG12 VAL 104 6.383 -8.625 -14.767
6 HG13 VAL 104 HG13 VAL 104 6.884 -10.312 -14.856
7 HG21 VAL 104 HG21 VAL 104 5.956 -7.850 -17.586
8 HG22 VAL 104 HG22 VAL 104 4.336 -8.534 -17.682
9 HG23 VAL 104 HG23 VAL 104 4.856 -7.712 -16.216
No H/Q in entry = 9
In of MODEL 10
1 H THR 105 H THR 105 6.136 -9.062 -19.650
2 HA THR 105 HA THR 105 8.908 -8.143 -19.443
3 HB THR 105 HB THR 105 9.154 -8.490 -21.953
4 HG1 THR 105 HG1 THR 105 7.438 -9.266 -22.889
5 HG21 THR 105 HG21 THR 105 10.379 -9.836 -20.317
6 HG22 THR 105 HG22 THR 105 9.012 -10.943 -20.201
7 HG23 THR 105 HG23 THR 105 9.907 -10.803 -21.714
No H/Q in entry = 7
In of MODEL 10
1 H ASP 106 H ASP 106 5.789 -7.172 -19.720
2 HA ASP 106 HA ASP 106 6.260 -5.001 -21.543
3 HB2 ASP 106 HB2 ASP 106 3.981 -5.842 -21.165
4 HB3 ASP 106 HB3 ASP 106 4.103 -5.388 -19.477
No H/Q in entry = 4
In of MODEL 10
1 H GLU 107 H GLU 107 7.157 -3.121 -21.109
2 HA GLU 107 HA GLU 107 8.890 -2.931 -18.984
3 HB2 GLU 107 HB2 GLU 107 7.837 -0.796 -20.824
4 HB3 GLU 107 HB3 GLU 107 9.159 -0.534 -19.697
5 HG2 GLU 107 HG2 GLU 107 9.181 -2.662 -21.817
6 HG3 GLU 107 HG3 GLU 107 9.841 -1.043 -22.045
No H/Q in entry = 6
In of MODEL 10
1 H GLU 108 H GLU 108 5.922 -1.059 -19.432
2 HA GLU 108 HA GLU 108 5.927 0.405 -17.085
3 HB2 GLU 108 HB2 GLU 108 3.692 -0.707 -18.765
4 HB3 GLU 108 HB3 GLU 108 3.371 0.272 -17.340
5 HG2 GLU 108 HG2 GLU 108 5.117 1.202 -19.596
6 HG3 GLU 108 HG3 GLU 108 3.374 1.471 -19.552
No H/Q in entry = 6
In of MODEL 10
1 H LYS 109 H LYS 109 4.598 -2.833 -17.686
2 HA LYS 109 HA LYS 109 3.571 -3.300 -15.129
3 HB2 LYS 109 HB2 LYS 109 4.679 -5.237 -17.170
4 HB3 LYS 109 HB3 LYS 109 3.759 -5.712 -15.749
5 HG2 LYS 109 HG2 LYS 109 1.852 -4.376 -16.590
6 HG3 LYS 109 HG3 LYS 109 2.778 -4.025 -18.046
7 HD2 LYS 109 HD2 LYS 109 2.819 -6.373 -18.628
8 HD3 LYS 109 HD3 LYS 109 2.064 -6.798 -17.099
9 HE2 LYS 109 HE2 LYS 109 0.478 -6.830 -18.984
10 HE3 LYS 109 HE3 LYS 109 0.032 -5.674 -17.732
11 HZ1 LYS 109 HZ1 LYS 109 0.957 -3.903 -19.094
12 HZ2 LYS 109 HZ2 LYS 109 1.374 -5.017 -20.296
13 HZ3 LYS 109 HZ3 LYS 109 -0.250 -4.738 -19.929
No H/Q in entry = 13
In of MODEL 10
1 H LYS 110 H LYS 110 6.786 -4.047 -16.480
2 HA LYS 110 HA LYS 110 7.711 -5.249 -14.056
3 HB2 LYS 110 HB2 LYS 110 9.291 -4.201 -16.407
4 HB3 LYS 110 HB3 LYS 110 9.933 -5.211 -15.121
5 HG2 LYS 110 HG2 LYS 110 8.286 -6.960 -15.786
6 HG3 LYS 110 HG3 LYS 110 7.868 -5.950 -17.170
7 HD2 LYS 110 HD2 LYS 110 10.663 -6.913 -16.590
8 HD3 LYS 110 HD3 LYS 110 9.536 -7.775 -17.633
9 HE2 LYS 110 HE2 LYS 110 10.696 -6.540 -19.180
10 HE3 LYS 110 HE3 LYS 110 9.352 -5.456 -18.837
11 HZ1 LYS 110 HZ1 LYS 110 10.836 -4.317 -17.219
12 HZ2 LYS 110 HZ2 LYS 110 12.115 -5.277 -17.766
13 HZ3 LYS 110 HZ3 LYS 110 11.352 -4.198 -18.827
No H/Q in entry = 13
In of MODEL 10
1 H GLN 111 H GLN 111 7.497 -2.031 -15.188
2 HA GLN 111 HA GLN 111 9.297 -0.800 -13.396
3 HB2 GLN 111 HB2 GLN 111 8.229 0.434 -15.230
4 HB3 GLN 111 HB3 GLN 111 6.658 0.233 -14.468
5 HG2 GLN 111 HG2 GLN 111 7.471 2.453 -14.062
6 HG3 GLN 111 HG3 GLN 111 7.444 1.551 -12.548
7 HE21 GLN 111 HE21 GLN 111 9.391 0.934 -11.597
8 HE22 GLN 111 HE22 GLN 111 10.895 1.663 -12.038
No H/Q in entry = 8
In of MODEL 10
1 H TYR 112 H TYR 112 5.969 -1.937 -13.017
2 HA TYR 112 HA TYR 112 5.654 -0.895 -10.355
3 HB2 TYR 112 HB2 TYR 112 4.131 -3.030 -11.847
4 HB3 TYR 112 HB3 TYR 112 3.692 -2.437 -10.247
5 HD1 TYR 112 HD1 TYR 112 3.673 0.279 -10.176
6 HD2 TYR 112 HD2 TYR 112 2.933 -2.141 -13.591
7 HE1 TYR 112 HE1 TYR 112 2.372 2.105 -11.187
8 HE2 TYR 112 HE2 TYR 112 1.639 -0.319 -14.615
9 HH TYR 112 HH TYR 112 0.404 1.655 -13.938
No H/Q in entry = 9
In of MODEL 10
1 H ILE 113 H ILE 113 6.869 -3.854 -11.757
2 HA ILE 113 HA ILE 113 6.980 -5.350 -9.375
3 HB ILE 113 HB ILE 113 8.775 -5.511 -11.791
4 HG12 ILE 113 HG12 ILE 113 6.272 -7.000 -10.988
5 HG13 ILE 113 HG13 ILE 113 6.421 -5.837 -12.303
6 HG21 ILE 113 HG21 ILE 113 9.800 -6.568 -9.831
7 HG22 ILE 113 HG22 ILE 113 8.335 -7.513 -9.573
8 HG23 ILE 113 HG23 ILE 113 9.306 -7.770 -11.021
9 HD11 ILE 113 HD11 ILE 113 7.992 -8.377 -12.186
10 HD12 ILE 113 HD12 ILE 113 6.413 -8.246 -12.952
11 HD13 ILE 113 HD13 ILE 113 7.768 -7.292 -13.560
No H/Q in entry = 11
In of MODEL 10
1 H ALA 114 H ALA 114 9.485 -3.363 -10.972
2 HA ALA 114 HA ALA 114 11.414 -3.677 -8.902
3 HB1 ALA 114 HB1 ALA 114 12.094 -3.114 -11.153
4 HB2 ALA 114 HB2 ALA 114 12.582 -1.818 -10.061
5 HB3 ALA 114 HB3 ALA 114 11.166 -1.614 -11.094
No H/Q in entry = 5
In of MODEL 10
1 H ASP 115 H ASP 115 9.009 -1.220 -9.644
2 HA ASP 115 HA ASP 115 10.011 0.562 -7.615
3 HB2 ASP 115 HB2 ASP 115 8.952 1.275 -9.796
4 HB3 ASP 115 HB3 ASP 115 7.403 0.797 -9.110
No H/Q in entry = 4
In of MODEL 10
1 H PHE 116 H PHE 116 7.025 -1.305 -8.025
2 HA PHE 116 HA PHE 116 6.344 -0.601 -5.270
3 HB2 PHE 116 HB2 PHE 116 4.663 0.095 -6.826
4 HB3 PHE 116 HB3 PHE 116 4.637 -1.484 -7.597
5 HD1 PHE 116 HD1 PHE 116 4.034 0.081 -4.269
6 HD2 PHE 116 HD2 PHE 116 2.976 -2.906 -7.097
7 HE1 PHE 116 HE1 PHE 116 2.155 -0.600 -2.825
8 HE2 PHE 116 HE2 PHE 116 1.089 -3.606 -5.662
9 HZ PHE 116 HZ PHE 116 0.679 -2.445 -3.524
No H/Q in entry = 9
In of MODEL 10
1 H GLY 117 H GLY 117 7.354 -3.237 -7.151
2 HA2 GLY 117 HA2 GLY 117 7.644 -5.469 -6.728
3 HA3 GLY 117 HA3 GLY 117 5.964 -5.418 -6.240
No H/Q in entry = 3
In of MODEL 10
1 HA PRO 118 HA PRO 118 9.249 -6.392 -2.772
2 HB2 PRO 118 HB2 PRO 118 10.441 -4.132 -1.703
3 HB3 PRO 118 HB3 PRO 118 11.193 -5.225 -2.868
4 HG2 PRO 118 HG2 PRO 118 9.797 -2.622 -3.340
5 HG3 PRO 118 HG3 PRO 118 11.287 -3.246 -4.077
6 HD2 PRO 118 HD2 PRO 118 8.981 -3.311 -5.410
7 HD3 PRO 118 HD3 PRO 118 10.123 -4.669 -5.512
No H/Q in entry = 7
In of MODEL 10
1 H ALA 119 H ALA 119 7.427 -3.375 -2.685
2 HA ALA 119 HA ALA 119 6.917 -3.619 0.161
3 HB1 ALA 119 HB1 ALA 119 5.666 -1.544 -0.086
4 HB2 ALA 119 HB2 ALA 119 5.847 -1.631 -1.838
5 HB3 ALA 119 HB3 ALA 119 7.267 -1.408 -0.814
No H/Q in entry = 5
In of MODEL 10
1 H CYS 120 H CYS 120 5.148 -3.972 -2.891
2 HA CYS 120 HA CYS 120 2.645 -4.687 -1.909
3 HB2 CYS 120 HB2 CYS 120 3.012 -4.362 -4.272
4 HB3 CYS 120 HB3 CYS 120 4.207 -5.653 -4.314
No H/Q in entry = 4
In of MODEL 10
1 H LYS 121 H LYS 121 5.630 -6.463 -2.191
2 HA LYS 121 HA LYS 121 4.747 -9.062 -1.788
3 HB2 LYS 121 HB2 LYS 121 7.160 -7.811 -2.151
4 HB3 LYS 121 HB3 LYS 121 7.301 -8.402 -0.503
5 HG2 LYS 121 HG2 LYS 121 8.220 -10.030 -1.997
6 HG3 LYS 121 HG3 LYS 121 6.726 -10.671 -1.321
7 HD2 LYS 121 HD2 LYS 121 5.525 -10.205 -3.333
8 HD3 LYS 121 HD3 LYS 121 6.880 -9.289 -3.994
9 HE2 LYS 121 HE2 LYS 121 6.927 -12.238 -3.370
10 HE3 LYS 121 HE3 LYS 121 6.658 -11.552 -4.971
11 HZ1 LYS 121 HZ1 LYS 121 8.868 -10.448 -4.713
12 HZ2 LYS 121 HZ2 LYS 121 9.118 -11.377 -3.323
13 HZ3 LYS 121 HZ3 LYS 121 8.931 -12.137 -4.828
No H/Q in entry = 13
In of MODEL 10
1 H LYS 122 H LYS 122 5.956 -6.760 0.745
2 HA LYS 122 HA LYS 122 5.297 -8.527 2.852
3 HB2 LYS 122 HB2 LYS 122 5.493 -6.634 4.382
4 HB3 LYS 122 HB3 LYS 122 6.842 -6.702 3.264
5 HG2 LYS 122 HG2 LYS 122 6.107 -4.813 2.092
6 HG3 LYS 122 HG3 LYS 122 4.490 -4.901 2.797
7 HD2 LYS 122 HD2 LYS 122 5.853 -3.102 3.797
8 HD3 LYS 122 HD3 LYS 122 5.370 -4.316 4.980
9 HE2 LYS 122 HE2 LYS 122 7.640 -5.400 4.530
10 HE3 LYS 122 HE3 LYS 122 8.064 -3.892 3.724
11 HZ1 LYS 122 HZ1 LYS 122 7.152 -4.110 6.541
12 HZ2 LYS 122 HZ2 LYS 122 8.764 -3.954 6.058
13 HZ3 LYS 122 HZ3 LYS 122 7.670 -2.702 5.763
No H/Q in entry = 13
In of MODEL 10
1 H ILE 123 H ILE 123 3.434 -6.309 0.991
2 HA ILE 123 HA ILE 123 1.497 -5.704 2.891
3 HB ILE 123 HB ILE 123 1.549 -5.445 -0.065
4 HG12 ILE 123 HG12 ILE 123 1.358 -3.518 2.257
5 HG13 ILE 123 HG13 ILE 123 2.814 -3.891 1.341
6 HG21 ILE 123 HG21 ILE 123 -0.815 -4.867 1.720
7 HG22 ILE 123 HG22 ILE 123 -0.630 -4.250 0.079
8 HG23 ILE 123 HG23 ILE 123 -0.760 -5.987 0.356
9 HD11 ILE 123 HD11 ILE 123 0.355 -2.636 0.180
10 HD12 ILE 123 HD12 ILE 123 1.763 -1.745 0.750
11 HD13 ILE 123 HD13 ILE 123 1.912 -2.860 -0.610
No H/Q in entry = 11
In of MODEL 10
1 H TYR 124 H TYR 124 1.566 -8.352 0.561
2 HA TYR 124 HA TYR 124 -1.161 -9.059 1.236
3 HB2 TYR 124 HB2 TYR 124 0.943 -9.975 -0.623
4 HB3 TYR 124 HB3 TYR 124 -0.153 -11.228 -0.069
5 HD1 TYR 124 HD1 TYR 124 -2.740 -9.993 -0.022
6 HD2 TYR 124 HD2 TYR 124 0.463 -9.373 -2.744
7 HE1 TYR 124 HE1 TYR 124 -4.354 -9.289 -1.733
8 HE2 TYR 124 HE2 TYR 124 -1.149 -8.659 -4.475
9 HH TYR 124 HH TYR 124 -3.555 -9.007 -4.999
No H/Q in entry = 9
In of MODEL 10
1 H GLY 125 H GLY 125 1.655 -11.087 1.105
2 HA2 GLY 125 HA2 GLY 125 1.463 -13.267 2.231
3 HA3 GLY 125 HA3 GLY 125 0.769 -12.411 3.592
No H/Q in entry = 3
In of MODEL 10
1 H VAL 126 H VAL 126 3.545 -11.231 1.855
2 HA VAL 126 HA VAL 126 5.228 -12.980 3.508
3 HB VAL 126 HB VAL 126 6.594 -13.168 1.346
4 HG11 VAL 126 HG11 VAL 126 5.110 -14.940 2.255
5 HG12 VAL 126 HG12 VAL 126 3.776 -14.259 1.321
6 HG13 VAL 126 HG13 VAL 126 5.177 -14.938 0.495
7 HG21 VAL 126 HG21 VAL 126 5.544 -11.246 0.192
8 HG22 VAL 126 HG22 VAL 126 5.373 -12.736 -0.736
9 HG23 VAL 126 HG23 VAL 126 3.997 -12.102 0.178
No H/Q in entry = 9
In of MODEL 10
1 H HIS 127 H HIS 127 7.654 -12.284 2.365
2 HA HIS 127 HA HIS 127 9.374 -10.820 2.381
3 HB2 HIS 127 HB2 HIS 127 7.680 -9.594 0.862
4 HB3 HIS 127 HB3 HIS 127 7.433 -8.532 2.241
5 HD1 HIS 127 HD1 HIS 127 9.995 -9.496 -0.323
6 HD2 HIS 127 HD2 HIS 127 9.490 -6.708 2.718
7 HE1 HIS 127 HE1 HIS 127 11.850 -7.830 -0.620
8 HE2 HIS 127 HE2 HIS 127 11.613 -6.246 1.322
No H/Q in entry = 8
In of MODEL 10
1 H THR 128 H THR 128 8.102 -11.657 4.815
2 HA THR 128 HA THR 128 8.433 -9.447 6.658
3 HB THR 128 HB THR 128 8.092 -12.400 7.240
4 HG1 THR 128 HG1 THR 128 6.256 -10.339 6.651
5 HG21 THR 128 HG21 THR 128 8.926 -11.087 9.142
6 HG22 THR 128 HG22 THR 128 7.568 -9.977 8.963
7 HG23 THR 128 HG23 THR 128 7.278 -11.654 9.418
No H/Q in entry = 7
In of MODEL 10
1 H SER 129 H SER 129 10.142 -12.249 5.490
2 HA SER 129 HA SER 129 12.604 -11.246 6.718
3 HB2 SER 129 HB2 SER 129 11.806 -14.168 6.547
4 HB3 SER 129 HB3 SER 129 13.319 -13.540 7.205
5 HG SER 129 HG SER 129 10.823 -13.689 8.347
No H/Q in entry = 5
In of MODEL 11
1 HA2 GLY -4 HA2 GLY -4 -16.053 12.285 -20.465
2 HA3 GLY -4 HA3 GLY -4 -17.349 12.131 -19.289
3 H1 GLY -4 H1 GLY -4 -16.041 13.415 -17.726
4 H2 GLY -4 H2 GLY -4 -16.297 14.284 -19.154
No H/Q in entry = 4
In of MODEL 11
1 H SER -3 H SER -3 -14.347 10.902 -20.381
2 HA SER -3 HA SER -3 -14.689 8.570 -18.729
3 HB2 SER -3 HB2 SER -3 -12.505 9.232 -20.719
4 HB3 SER -3 HB3 SER -3 -12.837 7.645 -20.026
5 HG SER -3 HG SER -3 -14.994 8.882 -21.223
No H/Q in entry = 5
In of MODEL 11
1 HA PRO -2 HA PRO -2 -11.897 10.110 -15.582
2 HB2 PRO -2 HB2 PRO -2 -12.037 7.931 -13.972
3 HB3 PRO -2 HB3 PRO -2 -13.293 9.171 -14.023
4 HG2 PRO -2 HG2 PRO -2 -13.233 6.480 -15.292
5 HG3 PRO -2 HG3 PRO -2 -14.589 7.342 -14.552
6 HD2 PRO -2 HD2 PRO -2 -14.172 7.163 -17.253
7 HD3 PRO -2 HD3 PRO -2 -15.066 8.479 -16.473
No H/Q in entry = 7
In of MODEL 11
1 H GLU -1 H GLU -1 -9.988 10.103 -16.749
2 HA GLU -1 HA GLU -1 -8.574 7.532 -16.933
3 HB2 GLU -1 HB2 GLU -1 -8.924 8.698 -19.079
4 HB3 GLU -1 HB3 GLU -1 -8.083 10.108 -18.447
5 HG2 GLU -1 HG2 GLU -1 -6.640 8.823 -19.903
6 HG3 GLU -1 HG3 GLU -1 -6.031 8.802 -18.249
No H/Q in entry = 6
In of MODEL 11
1 H PHE 0 H PHE 0 -6.365 7.462 -16.364
2 HA PHE 0 HA PHE 0 -5.358 9.664 -14.748
3 HB2 PHE 0 HB2 PHE 0 -4.611 7.900 -13.026
4 HB3 PHE 0 HB3 PHE 0 -6.285 8.441 -12.999
5 HD1 PHE 0 HD1 PHE 0 -8.063 6.998 -13.711
6 HD2 PHE 0 HD2 PHE 0 -4.036 5.663 -13.703
7 HE1 PHE 0 HE1 PHE 0 -8.847 4.667 -13.909
8 HE2 PHE 0 HE2 PHE 0 -4.798 3.329 -13.906
9 HZ PHE 0 HZ PHE 0 -7.211 2.829 -14.008
No H/Q in entry = 9
In of MODEL 11
1 H HIS 1 H HIS 1 -3.051 9.502 -14.313
2 HA HIS 1 HA HIS 1 -1.604 8.873 -16.617
3 HB2 HIS 1 HB2 HIS 1 -0.989 10.521 -14.782
4 HB3 HIS 1 HB3 HIS 1 -0.431 9.142 -13.845
5 HD1 HIS 1 HD1 HIS 1 2.025 9.781 -13.839
6 HD2 HIS 1 HD2 HIS 1 0.402 9.533 -17.658
7 HE1 HIS 1 HE1 HIS 1 3.975 9.959 -15.419
8 HE2 HIS 1 HE2 HIS 1 2.936 10.050 -17.710
No H/Q in entry = 8
In of MODEL 11
1 H HIS 2 H HIS 2 -0.894 7.379 -13.463
2 HA HIS 2 HA HIS 2 -1.123 4.729 -14.700
3 HB2 HIS 2 HB2 HIS 2 1.213 5.660 -13.009
4 HB3 HIS 2 HB3 HIS 2 0.910 3.982 -13.439
5 HD1 HIS 2 HD1 HIS 2 3.164 6.390 -14.329
6 HD2 HIS 2 HD2 HIS 2 0.527 4.112 -16.597
7 HE1 HIS 2 HE1 HIS 2 4.088 6.415 -16.670
8 HE2 HIS 2 HE2 HIS 2 2.403 5.148 -18.049
No H/Q in entry = 8
In of MODEL 11
1 H PHE 3 H PHE 3 -0.037 5.925 -11.563
2 HA PHE 3 HA PHE 3 -2.578 5.256 -10.317
3 HB2 PHE 3 HB2 PHE 3 0.071 4.034 -9.497
4 HB3 PHE 3 HB3 PHE 3 -1.321 4.103 -8.424
5 HD1 PHE 3 HD1 PHE 3 -3.433 2.905 -9.105
6 HD2 PHE 3 HD2 PHE 3 0.288 2.345 -11.096
7 HE1 PHE 3 HE1 PHE 3 -4.262 0.792 -10.053
8 HE2 PHE 3 HE2 PHE 3 -0.534 0.231 -12.044
9 HZ PHE 3 HZ PHE 3 -2.834 -0.538 -11.520
No H/Q in entry = 9
In of MODEL 11
1 H THR 4 H THR 4 -2.946 6.546 -8.475
2 HA THR 4 HA THR 4 -0.785 8.290 -7.578
3 HB THR 4 HB THR 4 -2.491 10.213 -7.584
4 HG1 THR 4 HG1 THR 4 -4.125 8.421 -8.422
5 HG21 THR 4 HG21 THR 4 -1.385 9.162 -10.190
6 HG22 THR 4 HG22 THR 4 -1.982 10.804 -9.932
7 HG23 THR 4 HG23 THR 4 -0.567 10.230 -9.049
No H/Q in entry = 7
In of MODEL 11
1 H LEU 5 H LEU 5 -1.197 9.258 -5.535
2 HA LEU 5 HA LEU 5 -2.342 7.386 -3.754
3 HB2 LEU 5 HB2 LEU 5 -0.882 9.941 -3.519
4 HB3 LEU 5 HB3 LEU 5 -1.885 9.495 -2.155
5 HG LEU 5 HG LEU 5 -0.659 7.324 -2.035
6 HD11 LEU 5 HD11 LEU 5 0.145 7.233 -4.340
7 HD12 LEU 5 HD12 LEU 5 1.169 8.636 -4.040
8 HD13 LEU 5 HD13 LEU 5 1.476 7.123 -3.189
9 HD21 LEU 5 HD21 LEU 5 -0.124 9.214 -0.587
10 HD22 LEU 5 HD22 LEU 5 1.318 8.282 -0.990
11 HD23 LEU 5 HD23 LEU 5 1.010 9.821 -1.793
No H/Q in entry = 11
In of MODEL 11
1 H GLU 6 H GLU 6 -3.543 10.498 -4.982
2 HA GLU 6 HA GLU 6 -5.800 10.716 -3.349
3 HB2 GLU 6 HB2 GLU 6 -5.622 11.235 -6.324
4 HB3 GLU 6 HB3 GLU 6 -6.921 11.790 -5.276
5 HG2 GLU 6 HG2 GLU 6 -5.698 13.668 -5.261
6 HG3 GLU 6 HG3 GLU 6 -4.852 12.836 -3.963
No H/Q in entry = 6
In of MODEL 11
1 H SER 7 H SER 7 -5.317 8.689 -6.269
2 HA SER 7 HA SER 7 -7.849 7.712 -6.562
3 HB2 SER 7 HB2 SER 7 -5.343 6.065 -6.926
4 HB3 SER 7 HB3 SER 7 -6.878 5.886 -7.778
5 HG SER 7 HG SER 7 -6.511 7.790 -8.842
No H/Q in entry = 5
In of MODEL 11
1 H SER 8 H SER 8 -5.671 6.936 -3.952
2 HA SER 8 HA SER 8 -7.241 4.559 -3.333
3 HB2 SER 8 HB2 SER 8 -5.465 4.035 -1.664
4 HB3 SER 8 HB3 SER 8 -4.918 4.099 -3.346
5 HG SER 8 HG SER 8 -4.672 6.547 -2.333
No H/Q in entry = 5
In of MODEL 11
1 H LEU 9 H LEU 9 -7.151 7.830 -2.299
2 HA LEU 9 HA LEU 9 -6.837 7.490 0.429
3 HB2 LEU 9 HB2 LEU 9 -8.197 9.704 -1.051
4 HB3 LEU 9 HB3 LEU 9 -7.663 9.778 0.620
5 HG LEU 9 HG LEU 9 -5.823 9.256 -1.701
6 HD11 LEU 9 HD11 LEU 9 -6.863 11.416 -1.902
7 HD12 LEU 9 HD12 LEU 9 -6.379 11.824 -0.256
8 HD13 LEU 9 HD13 LEU 9 -5.151 11.564 -1.497
9 HD21 LEU 9 HD21 LEU 9 -5.355 9.853 1.211
10 HD22 LEU 9 HD22 LEU 9 -4.875 8.419 0.311
11 HD23 LEU 9 HD23 LEU 9 -4.099 9.968 -0.016
No H/Q in entry = 11
In of MODEL 11
1 H ASP 10 H ASP 10 -9.790 7.311 -1.358
2 HA ASP 10 HA ASP 10 -11.299 7.017 1.136
3 HB2 ASP 10 HB2 ASP 10 -12.270 7.106 -1.727
4 HB3 ASP 10 HB3 ASP 10 -13.297 7.053 -0.301
No H/Q in entry = 4
In of MODEL 11
1 H THR 11 H THR 11 -9.516 5.051 -0.734
2 HA THR 11 HA THR 11 -11.285 2.789 -0.142
3 HB THR 11 HB THR 11 -10.279 1.617 -2.131
4 HG1 THR 11 HG1 THR 11 -9.662 3.577 -3.697
5 HG21 THR 11 HG21 THR 11 -11.904 4.110 -2.649
6 HG22 THR 11 HG22 THR 11 -11.735 2.753 -3.765
7 HG23 THR 11 HG23 THR 11 -12.535 2.522 -2.211
No H/Q in entry = 7
In of MODEL 11
1 H HIS 12 H HIS 12 -8.159 2.449 -1.593
2 HA HIS 12 HA HIS 12 -7.350 0.564 0.294
3 HB2 HIS 12 HB2 HIS 12 -5.523 2.047 -1.580
4 HB3 HIS 12 HB3 HIS 12 -5.254 0.457 -0.872
5 HD1 HIS 12 HD1 HIS 12 -7.435 -1.270 -1.557
6 HD2 HIS 12 HD2 HIS 12 -6.400 1.844 -4.113
7 HE1 HIS 12 HE1 HIS 12 -8.461 -1.849 -3.782
8 HE2 HIS 12 HE2 HIS 12 -7.991 0.148 -5.250
No H/Q in entry = 8
In of MODEL 11
1 H LEU 13 H LEU 13 -6.728 4.026 0.147
2 HA LEU 13 HA LEU 13 -4.908 3.690 2.438
3 HB2 LEU 13 HB2 LEU 13 -4.892 5.546 0.139
4 HB3 LEU 13 HB3 LEU 13 -4.336 6.172 1.678
5 HG LEU 13 HG LEU 13 -2.430 5.402 0.427
6 HD11 LEU 13 HD11 LEU 13 -2.490 4.985 2.878
7 HD12 LEU 13 HD12 LEU 13 -3.018 3.339 2.537
8 HD13 LEU 13 HD13 LEU 13 -1.437 3.890 1.985
9 HD21 LEU 13 HD21 LEU 13 -3.857 2.752 0.235
10 HD22 LEU 13 HD22 LEU 13 -3.485 3.849 -1.094
11 HD23 LEU 13 HD23 LEU 13 -2.179 3.038 -0.230
No H/Q in entry = 11
In of MODEL 11
1 H LYS 14 H LYS 14 -7.828 3.909 2.456
2 HA LYS 14 HA LYS 14 -8.518 6.512 3.406
3 HB2 LYS 14 HB2 LYS 14 -10.710 5.680 3.741
4 HB3 LYS 14 HB3 LYS 14 -10.109 4.958 2.265
5 HG2 LYS 14 HG2 LYS 14 -9.603 2.896 3.549
6 HG3 LYS 14 HG3 LYS 14 -10.368 3.639 4.956
7 HD2 LYS 14 HD2 LYS 14 -12.451 3.887 3.668
8 HD3 LYS 14 HD3 LYS 14 -11.683 3.094 2.294
9 HE2 LYS 14 HE2 LYS 14 -12.981 1.449 3.392
10 HE3 LYS 14 HE3 LYS 14 -11.298 1.113 3.791
11 HZ1 LYS 14 HZ1 LYS 14 -13.238 2.528 5.539
12 HZ2 LYS 14 HZ2 LYS 14 -12.722 0.930 5.732
13 HZ3 LYS 14 HZ3 LYS 14 -11.625 2.202 5.923
No H/Q in entry = 13
In of MODEL 11
1 H TRP 15 H TRP 15 -7.038 3.872 4.867
2 HA TRP 15 HA TRP 15 -8.017 4.251 7.533
3 HB2 TRP 15 HB2 TRP 15 -6.173 2.704 8.158
4 HB3 TRP 15 HB3 TRP 15 -7.194 2.065 6.874
5 HD1 TRP 15 HD1 TRP 15 -6.138 1.941 4.419
6 HE1 TRP 15 HE1 TRP 15 -3.695 1.865 3.609
7 HE3 TRP 15 HE3 TRP 15 -3.821 3.558 8.681
8 HZ2 TRP 15 HZ2 TRP 15 -1.128 2.416 4.645
9 HZ3 TRP 15 HZ3 TRP 15 -1.368 3.755 8.689
10 HH2 TRP 15 HH2 TRP 15 -0.051 3.196 6.711
No H/Q in entry = 10
In of MODEL 11
1 H LEU 16 H LEU 16 -5.890 5.957 5.567
2 HA LEU 16 HA LEU 16 -4.119 6.944 7.601
3 HB2 LEU 16 HB2 LEU 16 -4.875 8.128 4.917
4 HB3 LEU 16 HB3 LEU 16 -3.590 8.716 5.945
5 HG LEU 16 HG LEU 16 -3.604 5.958 4.703
6 HD11 LEU 16 HD11 LEU 16 -3.569 7.689 2.972
7 HD12 LEU 16 HD12 LEU 16 -2.205 8.467 3.778
8 HD13 LEU 16 HD13 LEU 16 -2.021 6.855 3.084
9 HD21 LEU 16 HD21 LEU 16 -1.414 7.579 6.005
10 HD22 LEU 16 HD22 LEU 16 -2.175 6.135 6.671
11 HD23 LEU 16 HD23 LEU 16 -1.197 6.022 5.206
No H/Q in entry = 11
In of MODEL 11
1 H SER 17 H SER 17 -4.289 8.835 8.724
2 HA SER 17 HA SER 17 -6.910 9.798 9.308
3 HB2 SER 17 HB2 SER 17 -4.283 11.098 10.041
4 HB3 SER 17 HB3 SER 17 -5.832 11.309 10.849
5 HG SER 17 HG SER 17 -5.472 8.770 10.930
No H/Q in entry = 5
In of MODEL 11
1 H GLN 18 H GLN 18 -7.578 12.158 9.061
2 HA GLN 18 HA GLN 18 -7.293 13.018 6.406
3 HB2 GLN 18 HB2 GLN 18 -9.128 13.770 7.922
4 HB3 GLN 18 HB3 GLN 18 -7.966 14.759 8.796
5 HG2 GLN 18 HG2 GLN 18 -9.260 16.101 7.244
6 HG3 GLN 18 HG3 GLN 18 -7.558 16.073 6.783
7 HE21 GLN 18 HE21 GLN 18 -7.998 16.593 4.650
8 HE22 GLN 18 HE22 GLN 18 -8.728 15.474 3.555
No H/Q in entry = 8
In of MODEL 11
1 H GLU 19 H GLU 19 -5.661 14.076 9.354
2 HA GLU 19 HA GLU 19 -3.961 15.966 8.275
3 HB2 GLU 19 HB2 GLU 19 -3.686 14.025 10.565
4 HB3 GLU 19 HB3 GLU 19 -2.482 15.234 10.211
5 HG2 GLU 19 HG2 GLU 19 -5.350 15.884 10.745
6 HG3 GLU 19 HG3 GLU 19 -4.106 15.849 11.993
No H/Q in entry = 6
In of MODEL 11
1 H GLN 20 H GLN 20 -3.737 12.454 8.302
2 HA GLN 20 HA GLN 20 -1.089 12.384 7.236
3 HB2 GLN 20 HB2 GLN 20 -3.247 10.284 7.441
4 HB3 GLN 20 HB3 GLN 20 -1.658 9.962 6.759
5 HG2 GLN 20 HG2 GLN 20 -0.596 10.467 8.851
6 HG3 GLN 20 HG3 GLN 20 -2.128 10.982 9.551
7 HE21 GLN 20 HE21 GLN 20 -1.947 9.471 11.214
8 HE22 GLN 20 HE22 GLN 20 -2.205 7.783 10.946
No H/Q in entry = 8
In of MODEL 11
1 H LYS 21 H LYS 21 -4.353 12.063 5.861
2 HA LYS 21 HA LYS 21 -3.775 11.731 3.172
3 HB2 LYS 21 HB2 LYS 21 -5.948 13.027 4.711
4 HB3 LYS 21 HB3 LYS 21 -5.780 13.586 3.058
5 HG2 LYS 21 HG2 LYS 21 -7.422 11.859 3.145
6 HG3 LYS 21 HG3 LYS 21 -6.010 11.262 2.288
7 HD2 LYS 21 HD2 LYS 21 -5.286 10.067 4.286
8 HD3 LYS 21 HD3 LYS 21 -6.677 10.698 5.172
9 HE2 LYS 21 HE2 LYS 21 -6.800 8.914 2.740
10 HE3 LYS 21 HE3 LYS 21 -7.047 8.395 4.407
11 HZ1 LYS 21 HZ1 LYS 21 -8.727 10.415 3.021
12 HZ2 LYS 21 HZ2 LYS 21 -9.132 8.780 3.168
13 HZ3 LYS 21 HZ3 LYS 21 -9.001 9.748 4.550
No H/Q in entry = 13
In of MODEL 11
1 H ASP 22 H ASP 22 -4.104 14.749 4.954
2 HA ASP 22 HA ASP 22 -3.295 16.481 2.879
3 HB2 ASP 22 HB2 ASP 22 -4.625 17.228 4.789
4 HB3 ASP 22 HB3 ASP 22 -3.307 16.838 5.880
No H/Q in entry = 4
In of MODEL 11
1 H GLU 23 H GLU 23 -1.430 14.845 5.440
2 HA GLU 23 HA GLU 23 1.044 16.029 4.955
3 HB2 GLU 23 HB2 GLU 23 0.487 14.549 6.843
4 HB3 GLU 23 HB3 GLU 23 0.366 13.197 5.731
5 HG2 GLU 23 HG2 GLU 23 2.465 13.127 6.835
6 HG3 GLU 23 HG3 GLU 23 2.698 13.508 5.133
No H/Q in entry = 6
In of MODEL 11
1 H LEU 24 H LEU 24 -0.321 13.001 3.613
2 HA LEU 24 HA LEU 24 1.886 12.440 1.953
3 HB2 LEU 24 HB2 LEU 24 -0.971 11.513 2.017
4 HB3 LEU 24 HB3 LEU 24 0.128 10.961 0.773
5 HG LEU 24 HG LEU 24 -0.250 9.448 2.794
6 HD11 LEU 24 HD11 LEU 24 2.551 10.203 2.018
7 HD12 LEU 24 HD12 LEU 24 2.091 8.735 2.885
8 HD13 LEU 24 HD13 LEU 24 1.521 9.001 1.236
9 HD21 LEU 24 HD21 LEU 24 1.255 11.652 4.079
10 HD22 LEU 24 HD22 LEU 24 -0.076 10.675 4.700
11 HD23 LEU 24 HD23 LEU 24 1.546 9.991 4.583
No H/Q in entry = 11
In of MODEL 11
1 H LEU 25 H LEU 25 -1.212 14.052 1.327
2 HA LEU 25 HA LEU 25 -0.879 14.467 -1.423
3 HB2 LEU 25 HB2 LEU 25 -2.391 16.045 0.650
4 HB3 LEU 25 HB3 LEU 25 -2.461 16.398 -1.062
5 HG LEU 25 HG LEU 25 -3.345 13.824 0.236
6 HD11 LEU 25 HD11 LEU 25 -4.840 15.689 0.711
7 HD12 LEU 25 HD12 LEU 25 -4.940 16.055 -1.012
8 HD13 LEU 25 HD13 LEU 25 -5.591 14.538 -0.394
9 HD21 LEU 25 HD21 LEU 25 -3.431 14.724 -2.639
10 HD22 LEU 25 HD22 LEU 25 -2.480 13.395 -1.977
11 HD23 LEU 25 HD23 LEU 25 -4.239 13.293 -2.001
No H/Q in entry = 11
In of MODEL 11
1 H LYS 26 H LYS 26 0.156 16.383 1.356
2 HA LYS 26 HA LYS 26 1.160 18.586 -0.118
3 HB2 LYS 26 HB2 LYS 26 0.670 18.644 2.315
4 HB3 LYS 26 HB3 LYS 26 2.035 17.573 2.593
5 HG2 LYS 26 HG2 LYS 26 2.574 19.907 3.080
6 HG3 LYS 26 HG3 LYS 26 3.566 19.260 1.772
7 HD2 LYS 26 HD2 LYS 26 2.193 20.374 0.124
8 HD3 LYS 26 HD3 LYS 26 1.087 20.932 1.380
9 HE2 LYS 26 HE2 LYS 26 4.001 21.673 1.193
10 HE3 LYS 26 HE3 LYS 26 2.671 22.675 0.619
11 HZ1 LYS 26 HZ1 LYS 26 1.818 22.759 2.884
12 HZ2 LYS 26 HZ2 LYS 26 3.112 21.815 3.424
13 HZ3 LYS 26 HZ3 LYS 26 3.394 23.363 2.809
No H/Q in entry = 13
In of MODEL 11
1 H MET 27 H MET 27 2.685 15.663 1.166
2 HA MET 27 HA MET 27 5.231 16.024 0.283
3 HB2 MET 27 HB2 MET 27 3.588 13.497 0.370
4 HB3 MET 27 HB3 MET 27 5.319 13.505 0.068
5 HG2 MET 27 HG2 MET 27 4.363 14.926 2.478
6 HG3 MET 27 HG3 MET 27 4.274 13.167 2.482
7 HE1 MET 27 HE1 MET 27 6.270 11.576 2.262
8 HE2 MET 27 HE2 MET 27 6.795 12.304 0.744
9 HE3 MET 27 HE3 MET 27 7.951 12.072 2.056
No H/Q in entry = 9
In of MODEL 11
1 H LYS 28 H LYS 28 2.661 14.378 -1.566
2 HA LYS 28 HA LYS 28 4.126 14.018 -3.942
3 HB2 LYS 28 HB2 LYS 28 1.913 12.956 -3.215
4 HB3 LYS 28 HB3 LYS 28 1.148 14.417 -3.824
5 HG2 LYS 28 HG2 LYS 28 3.032 13.129 -5.677
6 HG3 LYS 28 HG3 LYS 28 1.590 12.193 -5.292
7 HD2 LYS 28 HD2 LYS 28 1.471 15.064 -6.178
8 HD3 LYS 28 HD3 LYS 28 1.452 13.715 -7.316
9 HE2 LYS 28 HE2 LYS 28 -0.533 12.813 -6.165
10 HE3 LYS 28 HE3 LYS 28 -0.529 14.215 -5.097
11 HZ1 LYS 28 HZ1 LYS 28 -0.820 14.343 -8.050
12 HZ2 LYS 28 HZ2 LYS 28 -2.104 14.420 -6.945
13 HZ3 LYS 28 HZ3 LYS 28 -0.925 15.640 -6.970
No H/Q in entry = 13
In of MODEL 11
1 H LYS 29 H LYS 29 2.071 16.644 -2.818
2 HA LYS 29 HA LYS 29 2.036 18.163 -5.175
3 HB2 LYS 29 HB2 LYS 29 0.488 18.462 -3.270
4 HB3 LYS 29 HB3 LYS 29 1.806 19.136 -2.326
5 HG2 LYS 29 HG2 LYS 29 1.998 20.982 -3.916
6 HG3 LYS 29 HG3 LYS 29 0.664 20.305 -4.852
7 HD2 LYS 29 HD2 LYS 29 -0.807 20.539 -2.897
8 HD3 LYS 29 HD3 LYS 29 0.528 21.257 -1.993
9 HE2 LYS 29 HE2 LYS 29 -0.977 22.971 -2.870
10 HE3 LYS 29 HE3 LYS 29 0.629 23.099 -3.585
11 HZ1 LYS 29 HZ1 LYS 29 -1.694 21.776 -4.877
12 HZ2 LYS 29 HZ2 LYS 29 -1.165 23.345 -5.215
13 HZ3 LYS 29 HZ3 LYS 29 -0.169 22.027 -5.562
No H/Q in entry = 13
In of MODEL 11
1 H ASP 30 H ASP 30 4.326 18.146 -2.473
2 HA ASP 30 HA ASP 30 5.659 20.491 -3.508
3 HB2 ASP 30 HB2 ASP 30 5.901 18.859 -1.032
4 HB3 ASP 30 HB3 ASP 30 7.324 19.758 -1.548
No H/Q in entry = 4
In of MODEL 11
1 H GLY 31 H GLY 31 5.710 17.423 -4.437
2 HA2 GLY 31 HA2 GLY 31 8.215 17.903 -5.820
3 HA3 GLY 31 HA3 GLY 31 7.024 16.674 -6.213
No H/Q in entry = 3
In of MODEL 11
1 H LYS 32 H LYS 32 7.050 15.963 -3.237
2 HA LYS 32 HA LYS 32 9.537 14.676 -2.816
3 HB2 LYS 32 HB2 LYS 32 6.781 13.983 -1.770
4 HB3 LYS 32 HB3 LYS 32 8.278 13.257 -1.205
5 HG2 LYS 32 HG2 LYS 32 7.592 16.181 -1.002
6 HG3 LYS 32 HG3 LYS 32 7.425 15.001 0.299
7 HD2 LYS 32 HD2 LYS 32 9.862 14.560 0.142
8 HD3 LYS 32 HD3 LYS 32 9.981 15.848 -1.060
9 HE2 LYS 32 HE2 LYS 32 9.096 17.443 0.576
10 HE3 LYS 32 HE3 LYS 32 9.009 16.155 1.777
11 HZ1 LYS 32 HZ1 LYS 32 11.497 17.126 0.479
12 HZ2 LYS 32 HZ2 LYS 32 10.992 17.515 2.046
13 HZ3 LYS 32 HZ3 LYS 32 11.402 15.919 1.664
No H/Q in entry = 13
In of MODEL 11
1 H ALA 33 H ALA 33 10.081 12.562 -3.252
2 HA ALA 33 HA ALA 33 9.069 11.562 -5.731
3 HB1 ALA 33 HB1 ALA 33 11.434 11.279 -5.070
4 HB2 ALA 33 HB2 ALA 33 10.650 9.758 -5.506
5 HB3 ALA 33 HB3 ALA 33 10.921 10.158 -3.811
No H/Q in entry = 5
In of MODEL 11
1 H LYS 34 H LYS 34 8.114 9.516 -6.089
2 HA LYS 34 HA LYS 34 5.995 8.850 -4.434
3 HB2 LYS 34 HB2 LYS 34 5.860 6.775 -5.778
4 HB3 LYS 34 HB3 LYS 34 6.048 8.220 -6.767
5 HG2 LYS 34 HG2 LYS 34 8.544 7.692 -6.711
6 HG3 LYS 34 HG3 LYS 34 8.062 6.093 -6.153
7 HD2 LYS 34 HD2 LYS 34 7.389 7.433 -8.761
8 HD3 LYS 34 HD3 LYS 34 8.277 5.928 -8.506
9 HE2 LYS 34 HE2 LYS 34 5.365 6.411 -7.927
10 HE3 LYS 34 HE3 LYS 34 6.016 5.480 -9.274
11 HZ1 LYS 34 HZ1 LYS 34 6.401 4.803 -6.403
12 HZ2 LYS 34 HZ2 LYS 34 5.260 4.081 -7.423
13 HZ3 LYS 34 HZ3 LYS 34 6.913 3.882 -7.729
No H/Q in entry = 13
In of MODEL 11
1 H LYS 35 H LYS 35 9.276 7.618 -4.565
2 HA LYS 35 HA LYS 35 9.034 5.482 -2.791
3 HB2 LYS 35 HB2 LYS 35 11.002 5.923 -4.222
4 HB3 LYS 35 HB3 LYS 35 11.417 7.295 -3.205
5 HG2 LYS 35 HG2 LYS 35 12.781 5.388 -2.638
6 HG3 LYS 35 HG3 LYS 35 11.698 5.779 -1.300
7 HD2 LYS 35 HD2 LYS 35 10.160 4.008 -2.073
8 HD3 LYS 35 HD3 LYS 35 11.318 3.587 -3.335
9 HE2 LYS 35 HE2 LYS 35 11.849 3.515 -0.373
10 HE3 LYS 35 HE3 LYS 35 11.485 2.112 -1.377
11 HZ1 LYS 35 HZ1 LYS 35 13.492 2.679 -2.691
12 HZ2 LYS 35 HZ2 LYS 35 13.867 3.872 -1.555
13 HZ3 LYS 35 HZ3 LYS 35 13.828 2.244 -1.093
No H/Q in entry = 13
In of MODEL 11
1 H GLU 36 H GLU 36 8.962 8.887 -2.187
2 HA GLU 36 HA GLU 36 9.749 8.659 0.584
3 HB2 GLU 36 HB2 GLU 36 8.613 11.017 -0.927
4 HB3 GLU 36 HB3 GLU 36 9.340 11.065 0.677
5 HG2 GLU 36 HG2 GLU 36 11.439 10.184 -0.365
6 HG3 GLU 36 HG3 GLU 36 10.683 10.439 -1.926
No H/Q in entry = 6
In of MODEL 11
1 H LEU 37 H LEU 37 6.949 8.737 -1.361
2 HA LEU 37 HA LEU 37 5.056 8.905 0.788
3 HB2 LEU 37 HB2 LEU 37 4.696 7.899 -2.039
4 HB3 LEU 37 HB3 LEU 37 3.412 8.344 -0.930
5 HG LEU 37 HG LEU 37 5.499 10.309 -1.858
6 HD11 LEU 37 HD11 LEU 37 4.294 9.408 -3.786
7 HD12 LEU 37 HD12 LEU 37 2.764 9.832 -3.021
8 HD13 LEU 37 HD13 LEU 37 3.899 11.099 -3.487
9 HD21 LEU 37 HD21 LEU 37 2.774 10.624 -0.607
10 HD22 LEU 37 HD22 LEU 37 4.328 10.925 0.171
11 HD23 LEU 37 HD23 LEU 37 3.800 11.943 -1.167
No H/Q in entry = 11
In of MODEL 11
1 H GLU 38 H GLU 38 6.428 6.362 -1.217
2 HA GLU 38 HA GLU 38 5.111 4.148 -0.131
3 HB2 GLU 38 HB2 GLU 38 7.866 4.411 -1.346
4 HB3 GLU 38 HB3 GLU 38 7.090 2.872 -0.994
5 HG2 GLU 38 HG2 GLU 38 5.500 3.144 -2.647
6 HG3 GLU 38 HG3 GLU 38 5.708 4.893 -2.699
No H/Q in entry = 6
In of MODEL 11
1 H ALA 39 H ALA 39 7.601 6.128 1.121
2 HA ALA 39 HA ALA 39 8.351 4.206 3.175
3 HB1 ALA 39 HB1 ALA 39 9.343 7.017 2.730
4 HB2 ALA 39 HB2 ALA 39 10.031 5.814 3.820
5 HB3 ALA 39 HB3 ALA 39 10.084 5.557 2.077
No H/Q in entry = 5
In of MODEL 11
1 H LYS 40 H LYS 40 6.727 7.326 2.920
2 HA LYS 40 HA LYS 40 6.302 7.758 5.650
3 HB2 LYS 40 HB2 LYS 40 5.988 9.442 3.842
4 HB3 LYS 40 HB3 LYS 40 4.538 8.587 3.338
5 HG2 LYS 40 HG2 LYS 40 3.938 10.499 4.664
6 HG3 LYS 40 HG3 LYS 40 3.540 9.021 5.542
7 HD2 LYS 40 HD2 LYS 40 4.528 10.465 7.124
8 HD3 LYS 40 HD3 LYS 40 5.763 9.279 6.722
9 HE2 LYS 40 HE2 LYS 40 6.757 10.893 5.144
10 HE3 LYS 40 HE3 LYS 40 5.550 12.082 5.632
11 HZ1 LYS 40 HZ1 LYS 40 7.570 10.840 7.418
12 HZ2 LYS 40 HZ2 LYS 40 7.641 12.409 6.795
13 HZ3 LYS 40 HZ3 LYS 40 6.419 11.989 7.883
No H/Q in entry = 13
In of MODEL 11
1 H ILE 41 H ILE 41 4.251 6.172 3.203
2 HA ILE 41 HA ILE 41 2.127 5.558 4.946
3 HB ILE 41 HB ILE 41 2.976 4.223 2.375
4 HG12 ILE 41 HG12 ILE 41 0.841 6.303 2.887
5 HG13 ILE 41 HG13 ILE 41 2.449 6.665 2.266
6 HG21 ILE 41 HG21 ILE 41 1.526 2.773 3.699
7 HG22 ILE 41 HG22 ILE 41 0.349 4.080 3.848
8 HG23 ILE 41 HG23 ILE 41 0.689 3.375 2.267
9 HD11 ILE 41 HD11 ILE 41 0.407 4.918 0.929
10 HD12 ILE 41 HD12 ILE 41 0.795 6.582 0.494
11 HD13 ILE 41 HD13 ILE 41 2.008 5.314 0.305
No H/Q in entry = 11
In of MODEL 11
1 H LEU 42 H LEU 42 4.958 3.671 3.906
2 HA LEU 42 HA LEU 42 4.257 1.300 5.243
3 HB2 LEU 42 HB2 LEU 42 6.893 2.400 4.328
4 HB3 LEU 42 HB3 LEU 42 6.782 0.870 5.166
5 HG LEU 42 HG LEU 42 5.584 1.568 2.490
6 HD11 LEU 42 HD11 LEU 42 7.700 -0.401 3.319
7 HD12 LEU 42 HD12 LEU 42 7.042 -0.238 1.692
8 HD13 LEU 42 HD13 LEU 42 7.951 1.090 2.417
9 HD21 LEU 42 HD21 LEU 42 5.231 -0.890 4.195
10 HD22 LEU 42 HD22 LEU 42 3.978 0.167 3.544
11 HD23 LEU 42 HD23 LEU 42 4.918 -0.863 2.457
No H/Q in entry = 11
In of MODEL 11
1 H HIS 43 H HIS 43 5.967 4.180 6.310
2 HA HIS 43 HA HIS 43 6.723 3.178 8.855
3 HB2 HIS 43 HB2 HIS 43 7.658 5.257 7.822
4 HB3 HIS 43 HB3 HIS 43 6.118 6.054 8.119
5 HD1 HIS 43 HD1 HIS 43 6.649 7.689 9.933
6 HD2 HIS 43 HD2 HIS 43 8.204 3.913 10.708
7 HE1 HIS 43 HE1 HIS 43 7.614 7.812 12.251
8 HE2 HIS 43 HE2 HIS 43 8.450 5.492 12.737
No H/Q in entry = 8
In of MODEL 11
1 H TYR 44 H TYR 44 3.865 5.092 7.804
2 HA TYR 44 HA TYR 44 2.536 5.144 10.267
3 HB2 TYR 44 HB2 TYR 44 1.433 5.055 7.456
4 HB3 TYR 44 HB3 TYR 44 0.441 5.329 8.881
5 HD1 TYR 44 HD1 TYR 44 2.653 7.020 10.287
6 HD2 TYR 44 HD2 TYR 44 0.853 7.157 6.442
7 HE1 TYR 44 HE1 TYR 44 3.155 9.416 10.149
8 HE2 TYR 44 HE2 TYR 44 1.350 9.547 6.282
9 HH TYR 44 HH TYR 44 3.505 11.119 8.277
No H/Q in entry = 9
In of MODEL 11
1 H TYR 45 H TYR 45 2.392 2.842 7.619
2 HA TYR 45 HA TYR 45 0.516 1.050 8.524
3 HB2 TYR 45 HB2 TYR 45 1.431 0.930 6.292
4 HB3 TYR 45 HB3 TYR 45 3.048 0.650 6.922
5 HD1 TYR 45 HD1 TYR 45 -0.330 -0.865 7.142
6 HD2 TYR 45 HD2 TYR 45 3.855 -1.482 6.811
7 HE1 TYR 45 HE1 TYR 45 -0.713 -3.278 6.971
8 HE2 TYR 45 HE2 TYR 45 3.490 -3.906 6.642
9 HH TYR 45 HH TYR 45 1.952 -5.571 6.924
No H/Q in entry = 9
In of MODEL 11
1 H ASP 46 H ASP 46 3.999 1.114 9.185
2 HA ASP 46 HA ASP 46 3.902 -1.289 10.712
3 HB2 ASP 46 HB2 ASP 46 5.948 0.584 9.791
4 HB3 ASP 46 HB3 ASP 46 6.279 -0.035 11.403
No H/Q in entry = 4
In of MODEL 11
1 H GLU 47 H GLU 47 3.172 1.957 11.518
2 HA GLU 47 HA GLU 47 3.689 1.473 14.349
3 HB2 GLU 47 HB2 GLU 47 2.805 3.957 12.885
4 HB3 GLU 47 HB3 GLU 47 3.024 3.858 14.622
5 HG2 GLU 47 HG2 GLU 47 5.406 3.194 14.180
6 HG3 GLU 47 HG3 GLU 47 5.119 3.606 12.490
No H/Q in entry = 6
In of MODEL 11
1 H LEU 48 H LEU 48 1.370 0.429 12.475
2 HA LEU 48 HA LEU 48 -1.011 1.576 13.467
3 HB2 LEU 48 HB2 LEU 48 -0.362 -0.898 11.906
4 HB3 LEU 48 HB3 LEU 48 -2.005 -0.503 12.343
5 HG LEU 48 HG LEU 48 -0.192 1.214 10.669
6 HD11 LEU 48 HD11 LEU 48 -2.616 -0.421 9.954
7 HD12 LEU 48 HD12 LEU 48 -1.737 0.655 8.867
8 HD13 LEU 48 HD13 LEU 48 -0.947 -0.786 9.510
9 HD21 LEU 48 HD21 LEU 48 -3.024 1.570 11.616
10 HD22 LEU 48 HD22 LEU 48 -1.643 2.626 11.917
11 HD23 LEU 48 HD23 LEU 48 -2.311 2.493 10.290
No H/Q in entry = 11
In of MODEL 11
1 H GLU 49 H GLU 49 -2.522 -0.745 13.877
2 HA GLU 49 HA GLU 49 -1.771 -1.519 16.596
3 HB2 GLU 49 HB2 GLU 49 -4.498 -0.444 15.835
4 HB3 GLU 49 HB3 GLU 49 -4.020 -1.020 17.424
5 HG2 GLU 49 HG2 GLU 49 -2.309 0.815 17.465
6 HG3 GLU 49 HG3 GLU 49 -3.058 1.440 15.995
No H/Q in entry = 6
In of MODEL 11
1 H GLY 50 H GLY 50 -4.202 -2.877 17.177
2 HA2 GLY 50 HA2 GLY 50 -5.079 -4.984 16.935
3 HA3 GLY 50 HA3 GLY 50 -3.608 -5.374 16.063
No H/Q in entry = 3
In of MODEL 11
1 H ASP 51 H ASP 51 -6.862 -4.035 15.678
2 HA ASP 51 HA ASP 51 -7.256 -5.479 13.223
3 HB2 ASP 51 HB2 ASP 51 -9.061 -4.889 14.910
4 HB3 ASP 51 HB3 ASP 51 -8.973 -3.235 14.310
No H/Q in entry = 4
In of MODEL 11
1 H ALA 52 H ALA 52 -6.127 -2.308 14.054
2 HA ALA 52 HA ALA 52 -6.728 -1.016 11.609
3 HB1 ALA 52 HB1 ALA 52 -4.434 -0.467 13.519
4 HB2 ALA 52 HB2 ALA 52 -5.013 0.622 12.259
5 HB3 ALA 52 HB3 ALA 52 -6.052 0.227 13.628
No H/Q in entry = 5
In of MODEL 11
1 H LYS 53 H LYS 53 -3.866 -2.775 12.746
2 HA LYS 53 HA LYS 53 -2.250 -2.467 10.491
3 HB2 LYS 53 HB2 LYS 53 -1.590 -3.489 12.708
4 HB3 LYS 53 HB3 LYS 53 -2.411 -4.955 12.190
5 HG2 LYS 53 HG2 LYS 53 -0.139 -5.282 11.735
6 HG3 LYS 53 HG3 LYS 53 -0.890 -4.948 10.179
7 HD2 LYS 53 HD2 LYS 53 -0.118 -2.656 10.268
8 HD3 LYS 53 HD3 LYS 53 0.554 -2.918 11.876
9 HE2 LYS 53 HE2 LYS 53 1.434 -4.294 9.343
10 HE3 LYS 53 HE3 LYS 53 2.286 -2.984 10.158
11 HZ1 LYS 53 HZ1 LYS 53 2.467 -4.472 12.117
12 HZ2 LYS 53 HZ2 LYS 53 1.825 -5.729 11.185
13 HZ3 LYS 53 HZ3 LYS 53 3.304 -5.029 10.759
No H/Q in entry = 13
In of MODEL 11
1 H LYS 54 H LYS 54 -4.349 -5.174 11.381
2 HA LYS 54 HA LYS 54 -4.148 -6.628 9.044
3 HB2 LYS 54 HB2 LYS 54 -5.503 -8.009 10.110
4 HB3 LYS 54 HB3 LYS 54 -5.563 -6.832 11.409
5 HG2 LYS 54 HG2 LYS 54 -7.618 -5.992 10.715
6 HG3 LYS 54 HG3 LYS 54 -7.472 -6.700 9.104
7 HD2 LYS 54 HD2 LYS 54 -7.561 -8.938 10.129
8 HD3 LYS 54 HD3 LYS 54 -7.820 -8.183 11.701
9 HE2 LYS 54 HE2 LYS 54 -9.960 -8.825 10.915
10 HE3 LYS 54 HE3 LYS 54 -9.858 -7.078 10.710
11 HZ1 LYS 54 HZ1 LYS 54 -9.245 -7.500 8.348
12 HZ2 LYS 54 HZ2 LYS 54 -9.563 -9.143 8.602
13 HZ3 LYS 54 HZ3 LYS 54 -10.807 -8.016 8.754
No H/Q in entry = 13
In of MODEL 11
1 H GLU 55 H GLU 55 -6.470 -4.000 9.817
2 HA GLU 55 HA GLU 55 -7.951 -4.346 7.452
3 HB2 GLU 55 HB2 GLU 55 -9.187 -2.491 8.202
4 HB3 GLU 55 HB3 GLU 55 -8.538 -3.103 9.692
5 HG2 GLU 55 HG2 GLU 55 -6.902 -1.392 9.753
6 HG3 GLU 55 HG3 GLU 55 -7.302 -0.872 8.122
No H/Q in entry = 6
In of MODEL 11
1 H ALA 56 H ALA 56 -5.365 -2.047 8.339
2 HA ALA 56 HA ALA 56 -5.305 -0.787 5.855
3 HB1 ALA 56 HB1 ALA 56 -3.057 -0.025 6.449
4 HB2 ALA 56 HB2 ALA 56 -2.982 -1.223 7.742
5 HB3 ALA 56 HB3 ALA 56 -4.144 0.102 7.832
No H/Q in entry = 5
In of MODEL 11
1 H THR 57 H THR 57 -3.384 -3.518 7.070
2 HA THR 57 HA THR 57 -1.823 -4.060 4.885
3 HB THR 57 HB THR 57 -3.185 -6.115 6.643
4 HG1 THR 57 HG1 THR 57 -2.034 -4.789 7.977
5 HG21 THR 57 HG21 THR 57 -2.154 -7.067 4.635
6 HG22 THR 57 HG22 THR 57 -0.635 -6.275 5.042
7 HG23 THR 57 HG23 THR 57 -1.282 -7.533 6.094
No H/Q in entry = 7
In of MODEL 11
1 H GLU 58 H GLU 58 -5.103 -5.178 5.523
2 HA GLU 58 HA GLU 58 -5.497 -6.661 3.154
3 HB2 GLU 58 HB2 GLU 58 -7.377 -5.350 5.114
4 HB3 GLU 58 HB3 GLU 58 -7.960 -6.258 3.720
5 HG2 GLU 58 HG2 GLU 58 -6.833 -8.247 4.539
6 HG3 GLU 58 HG3 GLU 58 -6.196 -7.333 5.909
No H/Q in entry = 6
In of MODEL 11
1 H HIS 59 H HIS 59 -5.752 -3.236 3.847
2 HA HIS 59 HA HIS 59 -7.247 -2.625 1.465
3 HB2 HIS 59 HB2 HIS 59 -5.764 -0.880 3.432
4 HB3 HIS 59 HB3 HIS 59 -6.619 -0.244 2.034
5 HD1 HIS 59 HD1 HIS 59 -9.152 -2.132 2.347
6 HD2 HIS 59 HD2 HIS 59 -7.433 0.189 5.336
7 HE1 HIS 59 HE1 HIS 59 -10.967 -1.757 4.039
8 HE2 HIS 59 HE2 HIS 59 -9.861 -0.488 5.914
No H/Q in entry = 8
In of MODEL 11
1 H LEU 60 H LEU 60 -3.897 -2.092 2.545
2 HA LEU 60 HA LEU 60 -2.806 -1.289 0.165
3 HB2 LEU 60 HB2 LEU 60 -1.723 -2.760 2.532
4 HB3 LEU 60 HB3 LEU 60 -0.704 -2.434 1.140
5 HG LEU 60 HG LEU 60 -1.254 -0.035 1.401
6 HD11 LEU 60 HD11 LEU 60 -3.303 -0.222 2.611
7 HD12 LEU 60 HD12 LEU 60 -2.425 -0.838 4.015
8 HD13 LEU 60 HD13 LEU 60 -2.144 0.815 3.451
9 HD21 LEU 60 HD21 LEU 60 0.851 -0.960 2.222
10 HD22 LEU 60 HD22 LEU 60 0.284 0.352 3.253
11 HD23 LEU 60 HD23 LEU 60 0.078 -1.322 3.766
No H/Q in entry = 11
In of MODEL 11
1 H LYS 61 H LYS 61 -3.570 -4.577 1.271
2 HA LYS 61 HA LYS 61 -2.289 -6.017 -0.752
3 HB2 LYS 61 HB2 LYS 61 -4.832 -6.553 0.779
4 HB3 LYS 61 HB3 LYS 61 -4.252 -7.661 -0.455
5 HG2 LYS 61 HG2 LYS 61 -2.144 -7.909 0.810
6 HG3 LYS 61 HG3 LYS 61 -2.817 -6.874 2.072
7 HD2 LYS 61 HD2 LYS 61 -4.659 -8.477 2.381
8 HD3 LYS 61 HD3 LYS 61 -3.949 -9.518 1.146
9 HE2 LYS 61 HE2 LYS 61 -1.919 -9.725 2.530
10 HE3 LYS 61 HE3 LYS 61 -2.684 -8.740 3.771
11 HZ1 LYS 61 HZ1 LYS 61 -4.412 -10.430 3.978
12 HZ2 LYS 61 HZ2 LYS 61 -3.638 -11.381 2.812
13 HZ3 LYS 61 HZ3 LYS 61 -2.882 -11.075 4.290
No H/Q in entry = 13
In of MODEL 11
1 H GLY 62 H GLY 62 -5.677 -4.925 -0.650
2 HA2 GLY 62 HA2 GLY 62 -7.075 -4.200 -2.312
3 HA3 GLY 62 HA3 GLY 62 -6.368 -5.486 -3.277
No H/Q in entry = 3
In of MODEL 11
1 H GLY 63 H GLY 63 -4.851 -2.542 -1.961
2 HA2 GLY 63 HA2 GLY 63 -3.527 -0.973 -2.999
3 HA3 GLY 63 HA3 GLY 63 -4.735 -1.019 -4.277
No H/Q in entry = 3
In of MODEL 11
1 H CYS 64 H CYS 64 -2.312 -3.354 -3.124
2 HA CYS 64 HA CYS 64 -0.667 -3.153 -5.421
3 HB2 CYS 64 HB2 CYS 64 0.210 -3.994 -3.322
4 HB3 CYS 64 HB3 CYS 64 -0.924 -5.340 -3.349
No H/Q in entry = 4
In of MODEL 11
1 H ARG 65 H ARG 65 -3.413 -5.156 -4.568
2 HA ARG 65 HA ARG 65 -3.311 -6.989 -6.689
3 HB2 ARG 65 HB2 ARG 65 -4.767 -7.240 -4.714
4 HB3 ARG 65 HB3 ARG 65 -5.721 -5.864 -5.238
5 HG2 ARG 65 HG2 ARG 65 -5.443 -8.213 -7.050
6 HG3 ARG 65 HG3 ARG 65 -6.539 -8.301 -5.672
7 HD2 ARG 65 HD2 ARG 65 -7.667 -6.262 -6.473
8 HD3 ARG 65 HD3 ARG 65 -6.595 -6.237 -7.872
9 HE ARG 65 HE ARG 65 -7.833 -8.731 -7.788
10 HH11 ARG 65 HH11 ARG 65 -8.741 -5.372 -8.222
11 HH12 ARG 65 HH12 ARG 65 -10.091 -5.751 -9.257
12 HH21 ARG 65 HH21 ARG 65 -9.593 -9.223 -9.155
13 HH22 ARG 65 HH22 ARG 65 -10.565 -7.937 -9.794
No H/Q in entry = 13
In of MODEL 11
1 H GLU 66 H GLU 66 -4.697 -3.746 -6.453
2 HA GLU 66 HA GLU 66 -5.869 -3.699 -9.028
3 HB2 GLU 66 HB2 GLU 66 -4.830 -1.388 -7.377
4 HB3 GLU 66 HB3 GLU 66 -5.912 -1.260 -8.755
5 HG2 GLU 66 HG2 GLU 66 -6.523 -2.641 -6.154
6 HG3 GLU 66 HG3 GLU 66 -7.111 -1.056 -6.653
No H/Q in entry = 6
In of MODEL 11
1 H ILE 67 H ILE 67 -2.670 -2.891 -7.812
2 HA ILE 67 HA ILE 67 -1.631 -1.921 -10.268
3 HB ILE 67 HB ILE 67 -0.272 -3.072 -7.837
4 HG12 ILE 67 HG12 ILE 67 -0.475 -0.262 -8.937
5 HG13 ILE 67 HG13 ILE 67 -1.427 -0.904 -7.603
6 HG21 ILE 67 HG21 ILE 67 1.138 -3.510 -9.803
7 HG22 ILE 67 HG22 ILE 67 1.046 -1.807 -10.245
8 HG23 ILE 67 HG23 ILE 67 1.855 -2.287 -8.753
9 HD11 ILE 67 HD11 ILE 67 0.610 -1.205 -6.300
10 HD12 ILE 67 HD12 ILE 67 1.558 -0.556 -7.639
11 HD13 ILE 67 HD13 ILE 67 0.393 0.472 -6.803
No H/Q in entry = 11
In of MODEL 11
1 H LEU 68 H LEU 68 -1.674 -5.122 -8.752
2 HA LEU 68 HA LEU 68 -0.241 -6.439 -10.797
3 HB2 LEU 68 HB2 LEU 68 -0.755 -7.296 -8.468
4 HB3 LEU 68 HB3 LEU 68 -2.367 -7.666 -9.051
5 HG LEU 68 HG LEU 68 -1.457 -9.236 -10.672
6 HD11 LEU 68 HD11 LEU 68 1.224 -8.478 -9.517
7 HD12 LEU 68 HD12 LEU 68 0.930 -9.775 -10.675
8 HD13 LEU 68 HD13 LEU 68 0.646 -8.096 -11.139
9 HD21 LEU 68 HD21 LEU 68 -1.987 -10.052 -8.435
10 HD22 LEU 68 HD22 LEU 68 -0.608 -10.916 -9.116
11 HD23 LEU 68 HD23 LEU 68 -0.352 -9.665 -7.899
No H/Q in entry = 11
In of MODEL 11
1 H LYS 69 H LYS 69 -3.614 -5.657 -10.327
2 HA LYS 69 HA LYS 69 -4.663 -6.991 -12.555
3 HB2 LYS 69 HB2 LYS 69 -5.951 -5.904 -10.659
4 HB3 LYS 69 HB3 LYS 69 -5.654 -4.360 -11.450
5 HG2 LYS 69 HG2 LYS 69 -6.782 -5.260 -13.475
6 HG3 LYS 69 HG3 LYS 69 -7.198 -6.692 -12.533
7 HD2 LYS 69 HD2 LYS 69 -8.457 -5.324 -10.966
8 HD3 LYS 69 HD3 LYS 69 -7.996 -3.864 -11.845
9 HE2 LYS 69 HE2 LYS 69 -9.153 -4.721 -13.836
10 HE3 LYS 69 HE3 LYS 69 -9.643 -6.145 -12.924
11 HZ1 LYS 69 HZ1 LYS 69 -10.870 -4.699 -11.414
12 HZ2 LYS 69 HZ2 LYS 69 -10.415 -3.346 -12.318
13 HZ3 LYS 69 HZ3 LYS 69 -11.413 -4.520 -13.006
No H/Q in entry = 13
In of MODEL 11
1 H HIS 70 H HIS 70 -2.530 -4.417 -12.366
2 HA HIS 70 HA HIS 70 -3.258 -3.324 -14.981
3 HB2 HIS 70 HB2 HIS 70 -3.002 -1.671 -13.210
4 HB3 HIS 70 HB3 HIS 70 -1.400 -2.285 -12.829
5 HD1 HIS 70 HD1 HIS 70 -3.140 0.170 -14.880
6 HD2 HIS 70 HD2 HIS 70 0.538 -1.769 -14.942
7 HE1 HIS 70 HE1 HIS 70 -1.681 1.551 -16.383
8 HE2 HIS 70 HE2 HIS 70 0.474 0.260 -16.559
No H/Q in entry = 8
In of MODEL 11
1 H VAL 71 H VAL 71 -0.472 -4.470 -13.112
2 HA VAL 71 HA VAL 71 1.306 -4.313 -15.299
3 HB VAL 71 HB VAL 71 2.084 -3.907 -13.062
4 HG11 VAL 71 HG11 VAL 71 1.287 -6.703 -12.477
5 HG12 VAL 71 HG12 VAL 71 2.396 -5.765 -11.468
6 HG13 VAL 71 HG13 VAL 71 0.734 -5.209 -11.720
7 HG21 VAL 71 HG21 VAL 71 3.691 -4.748 -14.626
8 HG22 VAL 71 HG22 VAL 71 4.039 -5.323 -12.995
9 HG23 VAL 71 HG23 VAL 71 3.285 -6.402 -14.169
No H/Q in entry = 9
In of MODEL 11
1 H VAL 72 H VAL 72 -0.195 -7.083 -13.604
2 HA VAL 72 HA VAL 72 1.052 -8.871 -15.525
3 HB VAL 72 HB VAL 72 0.693 -9.209 -12.904
4 HG11 VAL 72 HG11 VAL 72 -1.732 -10.515 -14.089
5 HG12 VAL 72 HG12 VAL 72 -1.120 -10.774 -12.453
6 HG13 VAL 72 HG13 VAL 72 -1.708 -9.184 -12.933
7 HG21 VAL 72 HG21 VAL 72 0.631 -11.356 -14.984
8 HG22 VAL 72 HG22 VAL 72 2.053 -10.590 -14.282
9 HG23 VAL 72 HG23 VAL 72 1.019 -11.606 -13.284
No H/Q in entry = 9
In of MODEL 11
1 H GLY 73 H GLY 73 -1.942 -7.324 -14.937
2 HA2 GLY 73 HA2 GLY 73 -3.063 -8.638 -17.287
3 HA3 GLY 73 HA3 GLY 73 -3.637 -7.148 -16.556
No H/Q in entry = 3
In of MODEL 11
1 H GLU 74 H GLU 74 -5.674 -8.454 -17.019
2 HA GLU 74 HA GLU 74 -6.791 -9.306 -14.584
3 HB2 GLU 74 HB2 GLU 74 -7.760 -9.736 -17.420
4 HB3 GLU 74 HB3 GLU 74 -8.712 -10.079 -15.986
5 HG2 GLU 74 HG2 GLU 74 -9.445 -7.996 -16.814
6 HG3 GLU 74 HG3 GLU 74 -8.494 -7.659 -15.371
No H/Q in entry = 6
In of MODEL 11
1 H GLU 75 H GLU 75 -5.359 -11.024 -17.264
2 HA GLU 75 HA GLU 75 -6.145 -13.629 -17.000
3 HB2 GLU 75 HB2 GLU 75 -4.663 -12.953 -18.744
4 HB3 GLU 75 HB3 GLU 75 -3.403 -12.545 -17.589
5 HG2 GLU 75 HG2 GLU 75 -3.127 -14.856 -16.993
6 HG3 GLU 75 HG3 GLU 75 -4.492 -15.318 -18.012
No H/Q in entry = 6
In of MODEL 11
1 H LYS 76 H LYS 76 -3.214 -12.382 -15.357
2 HA LYS 76 HA LYS 76 -2.911 -14.911 -14.068
3 HB2 LYS 76 HB2 LYS 76 -1.380 -12.354 -13.586
4 HB3 LYS 76 HB3 LYS 76 -0.904 -13.976 -13.136
5 HG2 LYS 76 HG2 LYS 76 -1.202 -12.928 -15.929
6 HG3 LYS 76 HG3 LYS 76 0.306 -13.290 -15.093
7 HD2 LYS 76 HD2 LYS 76 -1.828 -15.343 -15.658
8 HD3 LYS 76 HD3 LYS 76 -0.449 -15.044 -16.719
9 HE2 LYS 76 HE2 LYS 76 1.055 -15.585 -14.843
10 HE3 LYS 76 HE3 LYS 76 -0.346 -15.947 -13.845
11 HZ1 LYS 76 HZ1 LYS 76 0.286 -17.333 -16.389
12 HZ2 LYS 76 HZ2 LYS 76 0.681 -17.934 -14.860
13 HZ3 LYS 76 HZ3 LYS 76 -0.946 -17.727 -15.296
No H/Q in entry = 13
In of MODEL 11
1 H ALA 77 H ALA 77 -3.965 -11.690 -13.103
2 HA ALA 77 HA ALA 77 -4.132 -12.173 -10.329
3 HB1 ALA 77 HB1 ALA 77 -5.567 -10.206 -10.257
4 HB2 ALA 77 HB2 ALA 77 -5.758 -10.264 -12.010
5 HB3 ALA 77 HB3 ALA 77 -4.176 -9.923 -11.305
No H/Q in entry = 5
In of MODEL 11
1 H ALA 78 H ALA 78 -6.225 -12.932 -13.007
2 HA ALA 78 HA ALA 78 -8.531 -13.613 -11.491
3 HB1 ALA 78 HB1 ALA 78 -9.208 -14.790 -13.597
4 HB2 ALA 78 HB2 ALA 78 -8.775 -13.092 -13.808
5 HB3 ALA 78 HB3 ALA 78 -7.633 -14.354 -14.271
No H/Q in entry = 5
In of MODEL 11
1 H GLU 79 H GLU 79 -5.810 -15.477 -12.803
2 HA GLU 79 HA GLU 79 -6.878 -17.966 -11.900
3 HB2 GLU 79 HB2 GLU 79 -5.127 -18.984 -12.966
4 HB3 GLU 79 HB3 GLU 79 -5.269 -17.486 -13.870
5 HG2 GLU 79 HG2 GLU 79 -3.482 -16.535 -12.531
6 HG3 GLU 79 HG3 GLU 79 -3.310 -18.080 -11.708
No H/Q in entry = 6
In of MODEL 11
1 H LEU 80 H LEU 80 -4.803 -15.556 -10.550
2 HA LEU 80 HA LEU 80 -3.989 -16.995 -8.266
3 HB2 LEU 80 HB2 LEU 80 -4.402 -14.075 -8.854
4 HB3 LEU 80 HB3 LEU 80 -3.870 -14.631 -7.279
5 HG LEU 80 HG LEU 80 -2.375 -15.402 -9.764
6 HD11 LEU 80 HD11 LEU 80 -2.043 -12.892 -8.132
7 HD12 LEU 80 HD12 LEU 80 -0.871 -13.497 -9.307
8 HD13 LEU 80 HD13 LEU 80 -2.479 -13.004 -9.839
9 HD21 LEU 80 HD21 LEU 80 -1.941 -16.604 -7.690
10 HD22 LEU 80 HD22 LEU 80 -0.546 -15.643 -8.186
11 HD23 LEU 80 HD23 LEU 80 -1.588 -15.080 -6.878
No H/Q in entry = 11
In of MODEL 11
1 H LYS 81 H LYS 81 -6.832 -15.006 -8.953
2 HA LYS 81 HA LYS 81 -7.906 -14.986 -6.363
3 HB2 LYS 81 HB2 LYS 81 -8.651 -13.453 -8.118
4 HB3 LYS 81 HB3 LYS 81 -9.324 -14.796 -9.028
5 HG2 LYS 81 HG2 LYS 81 -11.045 -13.524 -7.847
6 HG3 LYS 81 HG3 LYS 81 -10.961 -15.196 -7.290
7 HD2 LYS 81 HD2 LYS 81 -9.712 -14.515 -5.329
8 HD3 LYS 81 HD3 LYS 81 -9.669 -12.848 -5.901
9 HE2 LYS 81 HE2 LYS 81 -11.377 -13.134 -4.191
10 HE3 LYS 81 HE3 LYS 81 -12.105 -12.733 -5.743
11 HZ1 LYS 81 HZ1 LYS 81 -11.911 -15.474 -4.608
12 HZ2 LYS 81 HZ2 LYS 81 -13.299 -14.501 -4.593
13 HZ3 LYS 81 HZ3 LYS 81 -12.664 -15.044 -6.063
No H/Q in entry = 13
In of MODEL 11
1 H ASN 82 H ASN 82 -8.646 -17.108 -9.132
2 HA ASN 82 HA ASN 82 -10.418 -18.756 -7.665
3 HB2 ASN 82 HB2 ASN 82 -10.322 -18.631 -10.185
4 HB3 ASN 82 HB3 ASN 82 -8.794 -19.490 -10.119
5 HD21 ASN 82 HD21 ASN 82 -9.603 -21.172 -11.360
6 HD22 ASN 82 HD22 ASN 82 -10.706 -22.338 -10.716
No H/Q in entry = 6
In of MODEL 11
1 H LEU 83 H LEU 83 -6.934 -18.800 -8.175
2 HA LEU 83 HA LEU 83 -6.424 -21.401 -7.278
3 HB2 LEU 83 HB2 LEU 83 -4.887 -19.204 -8.005
4 HB3 LEU 83 HB3 LEU 83 -4.464 -19.484 -6.327
5 HG LEU 83 HG LEU 83 -4.211 -21.449 -8.608
6 HD11 LEU 83 HD11 LEU 83 -2.166 -20.069 -6.886
7 HD12 LEU 83 HD12 LEU 83 -1.822 -21.304 -8.095
8 HD13 LEU 83 HD13 LEU 83 -2.494 -19.751 -8.589
9 HD21 LEU 83 HD21 LEU 83 -4.901 -22.550 -6.489
10 HD22 LEU 83 HD22 LEU 83 -3.296 -23.024 -7.046
11 HD23 LEU 83 HD23 LEU 83 -3.465 -21.875 -5.721
No H/Q in entry = 11
In of MODEL 11
1 H LYS 84 H LYS 84 -6.462 -18.346 -5.459
2 HA LYS 84 HA LYS 84 -5.986 -19.297 -2.926
3 HB2 LYS 84 HB2 LYS 84 -6.159 -16.904 -3.545
4 HB3 LYS 84 HB3 LYS 84 -7.906 -17.078 -3.635
5 HG2 LYS 84 HG2 LYS 84 -8.027 -17.587 -1.289
6 HG3 LYS 84 HG3 LYS 84 -6.270 -17.574 -1.158
7 HD2 LYS 84 HD2 LYS 84 -6.259 -15.197 -1.776
8 HD3 LYS 84 HD3 LYS 84 -8.021 -15.222 -1.870
9 HE2 LYS 84 HE2 LYS 84 -6.367 -15.786 0.589
10 HE3 LYS 84 HE3 LYS 84 -7.256 -14.299 0.260
11 HZ1 LYS 84 HZ1 LYS 84 -9.311 -15.586 0.267
12 HZ2 LYS 84 HZ2 LYS 84 -8.448 -16.998 0.618
13 HZ3 LYS 84 HZ3 LYS 84 -8.495 -15.733 1.738
No H/Q in entry = 13
In of MODEL 11
1 H ASP 85 H ASP 85 -9.178 -18.902 -4.454
2 HA ASP 85 HA ASP 85 -10.586 -19.967 -2.227
3 HB2 ASP 85 HB2 ASP 85 -11.405 -19.427 -5.071
4 HB3 ASP 85 HB3 ASP 85 -12.514 -20.107 -3.884
No H/Q in entry = 4
In of MODEL 11
1 H SER 86 H SER 86 -9.104 -21.458 -4.999
2 HA SER 86 HA SER 86 -10.431 -23.986 -4.609
3 HB2 SER 86 HB2 SER 86 -7.963 -23.285 -6.221
4 HB3 SER 86 HB3 SER 86 -8.803 -24.834 -6.274
5 HG SER 86 HG SER 86 -10.001 -22.327 -6.900
No H/Q in entry = 5
In of MODEL 11
1 H GLY 87 H GLY 87 -7.964 -22.357 -3.042
2 HA2 GLY 87 HA2 GLY 87 -7.177 -24.880 -1.717
3 HA3 GLY 87 HA3 GLY 87 -7.463 -23.384 -0.843
No H/Q in entry = 3
In of MODEL 11
1 H ALA 88 H ALA 88 -6.095 -21.626 -2.601
2 HA ALA 88 HA ALA 88 -3.386 -22.595 -2.559
3 HB1 ALA 88 HB1 ALA 88 -4.131 -19.731 -3.032
4 HB2 ALA 88 HB2 ALA 88 -4.317 -20.964 -4.278
5 HB3 ALA 88 HB3 ALA 88 -2.724 -20.621 -3.606
No H/Q in entry = 5
In of MODEL 11
1 H SER 89 H SER 89 -2.210 -22.511 -0.800
2 HA SER 89 HA SER 89 -2.907 -21.045 1.536
3 HB2 SER 89 HB2 SER 89 -0.708 -21.906 2.363
4 HB3 SER 89 HB3 SER 89 -1.779 -23.168 1.772
5 HG SER 89 HG SER 89 0.324 -23.452 0.972
No H/Q in entry = 5
In of MODEL 11
1 H LYS 90 H LYS 90 -0.959 -19.694 2.566
2 HA LYS 90 HA LYS 90 -0.776 -17.365 1.037
3 HB2 LYS 90 HB2 LYS 90 0.843 -16.573 2.711
4 HB3 LYS 90 HB3 LYS 90 -0.558 -17.318 3.460
5 HG2 LYS 90 HG2 LYS 90 0.701 -19.332 3.901
6 HG3 LYS 90 HG3 LYS 90 2.100 -18.667 3.056
7 HD2 LYS 90 HD2 LYS 90 2.290 -16.901 4.706
8 HD3 LYS 90 HD3 LYS 90 0.839 -17.477 5.523
9 HE2 LYS 90 HE2 LYS 90 1.964 -19.599 6.009
10 HE3 LYS 90 HE3 LYS 90 3.415 -19.010 5.200
11 HZ1 LYS 90 HZ1 LYS 90 2.197 -17.688 7.555
12 HZ2 LYS 90 HZ2 LYS 90 3.456 -18.809 7.655
13 HZ3 LYS 90 HZ3 LYS 90 3.691 -17.341 6.852
No H/Q in entry = 13
In of MODEL 11
1 H GLU 91 H GLU 91 1.354 -20.142 1.237
2 HA GLU 91 HA GLU 91 3.516 -18.810 -0.082
3 HB2 GLU 91 HB2 GLU 91 3.075 -21.716 0.586
4 HB3 GLU 91 HB3 GLU 91 4.550 -21.088 -0.138
5 HG2 GLU 91 HG2 GLU 91 4.965 -19.713 1.792
6 HG3 GLU 91 HG3 GLU 91 3.429 -20.195 2.505
No H/Q in entry = 6
In of MODEL 11
1 H GLU 92 H GLU 92 1.032 -21.130 -1.106
2 HA GLU 92 HA GLU 92 1.824 -21.557 -3.715
3 HB2 GLU 92 HB2 GLU 92 -0.973 -21.268 -2.620
4 HB3 GLU 92 HB3 GLU 92 -0.532 -22.040 -4.127
5 HG2 GLU 92 HG2 GLU 92 0.414 -22.958 -1.445
6 HG3 GLU 92 HG3 GLU 92 -1.011 -23.579 -2.264
No H/Q in entry = 6
In of MODEL 11
1 H LEU 93 H LEU 93 -0.151 -18.978 -2.292
2 HA LEU 93 HA LEU 93 -0.281 -17.520 -4.749
3 HB2 LEU 93 HB2 LEU 93 -0.728 -16.614 -1.910
4 HB3 LEU 93 HB3 LEU 93 -0.935 -15.566 -3.305
5 HG LEU 93 HG LEU 93 -2.551 -17.986 -2.541
6 HD11 LEU 93 HD11 LEU 93 -3.283 -15.155 -3.237
7 HD12 LEU 93 HD12 LEU 93 -4.419 -16.446 -2.835
8 HD13 LEU 93 HD13 LEU 93 -3.271 -15.869 -1.623
9 HD21 LEU 93 HD21 LEU 93 -2.451 -16.625 -5.230
10 HD22 LEU 93 HD22 LEU 93 -2.075 -18.312 -4.871
11 HD23 LEU 93 HD23 LEU 93 -3.728 -17.724 -4.710
No H/Q in entry = 11
In of MODEL 11
1 H LYS 94 H LYS 94 2.119 -17.675 -2.169
2 HA LYS 94 HA LYS 94 3.496 -15.328 -2.983
3 HB2 LYS 94 HB2 LYS 94 3.831 -16.328 -0.768
4 HB3 LYS 94 HB3 LYS 94 4.517 -17.765 -1.511
5 HG2 LYS 94 HG2 LYS 94 6.340 -16.361 -2.430
6 HG3 LYS 94 HG3 LYS 94 5.681 -14.990 -1.533
7 HD2 LYS 94 HD2 LYS 94 6.069 -16.111 0.561
8 HD3 LYS 94 HD3 LYS 94 6.555 -17.587 -0.270
9 HE2 LYS 94 HE2 LYS 94 7.987 -14.935 -0.315
10 HE3 LYS 94 HE3 LYS 94 8.508 -16.397 0.520
11 HZ1 LYS 94 HZ1 LYS 94 8.542 -17.472 -1.737
12 HZ2 LYS 94 HZ2 LYS 94 8.362 -15.928 -2.408
13 HZ3 LYS 94 HZ3 LYS 94 9.727 -16.298 -1.473
No H/Q in entry = 13
In of MODEL 11
1 H ALA 95 H ALA 95 3.808 -18.738 -3.732
2 HA ALA 95 HA ALA 95 6.054 -18.208 -5.454
3 HB1 ALA 95 HB1 ALA 95 6.060 -20.215 -4.028
4 HB2 ALA 95 HB2 ALA 95 6.146 -20.654 -5.734
5 HB3 ALA 95 HB3 ALA 95 4.617 -20.801 -4.864
No H/Q in entry = 5
In of MODEL 11
1 H LYS 96 H LYS 96 2.637 -18.711 -5.735
2 HA LYS 96 HA LYS 96 2.683 -18.830 -8.569
3 HB2 LYS 96 HB2 LYS 96 0.678 -19.233 -7.070
4 HB3 LYS 96 HB3 LYS 96 0.534 -17.485 -6.945
5 HG2 LYS 96 HG2 LYS 96 -0.978 -18.293 -8.621
6 HG3 LYS 96 HG3 LYS 96 0.303 -17.354 -9.393
7 HD2 LYS 96 HD2 LYS 96 1.429 -19.359 -10.087
8 HD3 LYS 96 HD3 LYS 96 0.296 -20.360 -9.177
9 HE2 LYS 96 HE2 LYS 96 -1.530 -19.548 -10.608
10 HE3 LYS 96 HE3 LYS 96 -0.363 -18.614 -11.542
11 HZ1 LYS 96 HZ1 LYS 96 -0.320 -21.563 -11.233
12 HZ2 LYS 96 HZ2 LYS 96 -0.921 -20.735 -12.578
13 HZ3 LYS 96 HZ3 LYS 96 0.725 -20.642 -12.193
No H/Q in entry = 13
In of MODEL 11
1 H VAL 97 H VAL 97 2.146 -16.128 -6.398
2 HA VAL 97 HA VAL 97 1.931 -14.061 -8.156
3 HB VAL 97 HB VAL 97 1.822 -14.154 -5.540
4 HG11 VAL 97 HG11 VAL 97 4.480 -13.009 -6.173
5 HG12 VAL 97 HG12 VAL 97 3.655 -12.760 -4.632
6 HG13 VAL 97 HG13 VAL 97 4.125 -14.385 -5.143
7 HG21 VAL 97 HG21 VAL 97 0.908 -12.391 -6.972
8 HG22 VAL 97 HG22 VAL 97 1.679 -11.730 -5.530
9 HG23 VAL 97 HG23 VAL 97 2.514 -11.667 -7.080
No H/Q in entry = 9
In of MODEL 11
1 H GLU 98 H GLU 98 4.909 -15.481 -6.999
2 HA GLU 98 HA GLU 98 6.528 -13.478 -8.201
3 HB2 GLU 98 HB2 GLU 98 7.158 -16.202 -7.094
4 HB3 GLU 98 HB3 GLU 98 8.389 -15.126 -7.758
5 HG2 GLU 98 HG2 GLU 98 7.845 -13.431 -6.145
6 HG3 GLU 98 HG3 GLU 98 6.496 -14.381 -5.534
No H/Q in entry = 6
In of MODEL 11
1 H GLU 99 H GLU 99 5.463 -16.686 -9.262
2 HA GLU 99 HA GLU 99 6.812 -16.713 -11.734
3 HB2 GLU 99 HB2 GLU 99 4.141 -17.880 -10.940
4 HB3 GLU 99 HB3 GLU 99 4.926 -18.197 -12.478
5 HG2 GLU 99 HG2 GLU 99 6.832 -19.183 -11.272
6 HG3 GLU 99 HG3 GLU 99 5.979 -18.914 -9.751
No H/Q in entry = 6
In of MODEL 11
1 H ALA 100 H ALA 100 3.670 -15.400 -10.768
2 HA ALA 100 HA ALA 100 2.885 -14.476 -13.313
3 HB1 ALA 100 HB1 ALA 100 2.104 -13.394 -10.609
4 HB2 ALA 100 HB2 ALA 100 1.348 -14.767 -11.416
5 HB3 ALA 100 HB3 ALA 100 1.235 -13.155 -12.122
No H/Q in entry = 5
In of MODEL 11
1 H LEU 101 H LEU 101 4.374 -12.750 -10.583
2 HA LEU 101 HA LEU 101 4.716 -10.275 -11.814
3 HB2 LEU 101 HB2 LEU 101 5.986 -11.690 -9.525
4 HB3 LEU 101 HB3 LEU 101 6.733 -10.219 -10.110
5 HG LEU 101 HG LEU 101 5.125 -10.018 -8.148
6 HD11 LEU 101 HD11 LEU 101 4.686 -8.336 -10.610
7 HD12 LEU 101 HD12 LEU 101 4.211 -7.887 -8.972
8 HD13 LEU 101 HD13 LEU 101 5.916 -8.086 -9.372
9 HD21 LEU 101 HD21 LEU 101 3.346 -11.445 -9.026
10 HD22 LEU 101 HD22 LEU 101 2.765 -9.820 -8.662
11 HD23 LEU 101 HD23 LEU 101 3.076 -10.293 -10.333
No H/Q in entry = 11
In of MODEL 11
1 H HIS 102 H HIS 102 6.484 -13.219 -12.319
2 HA HIS 102 HA HIS 102 8.556 -11.687 -13.630
3 HB2 HIS 102 HB2 HIS 102 8.288 -14.568 -12.921
4 HB3 HIS 102 HB3 HIS 102 9.382 -14.116 -14.228
5 HD1 HIS 102 HD1 HIS 102 11.686 -13.529 -13.507
6 HD2 HIS 102 HD2 HIS 102 8.918 -13.032 -10.446
7 HE1 HIS 102 HE1 HIS 102 13.019 -12.861 -11.489
8 HE2 HIS 102 HE2 HIS 102 11.308 -12.391 -9.704
No H/Q in entry = 8
In of MODEL 11
1 H ALA 103 H ALA 103 6.034 -14.050 -14.510
2 HA ALA 103 HA ALA 103 6.778 -14.229 -17.191
3 HB1 ALA 103 HB1 ALA 103 4.041 -14.746 -16.049
4 HB2 ALA 103 HB2 ALA 103 5.396 -15.872 -15.947
5 HB3 ALA 103 HB3 ALA 103 4.728 -15.434 -17.520
No H/Q in entry = 5
In of MODEL 11
1 H VAL 104 H VAL 104 5.494 -11.524 -15.748
2 HA VAL 104 HA VAL 104 3.667 -10.667 -17.707
3 HB VAL 104 HB VAL 104 3.352 -9.520 -15.775
4 HG11 VAL 104 HG11 VAL 104 6.315 -9.341 -15.429
5 HG12 VAL 104 HG12 VAL 104 5.131 -8.635 -14.333
6 HG13 VAL 104 HG13 VAL 104 5.191 -10.381 -14.561
7 HG21 VAL 104 HG21 VAL 104 3.752 -7.859 -17.655
8 HG22 VAL 104 HG22 VAL 104 3.903 -7.217 -16.021
9 HG23 VAL 104 HG23 VAL 104 5.357 -7.585 -16.958
No H/Q in entry = 9
In of MODEL 11
1 H THR 105 H THR 105 6.679 -9.061 -16.965
2 HA THR 105 HA THR 105 8.399 -8.298 -18.154
3 HB THR 105 HB THR 105 9.124 -9.252 -20.193
4 HG1 THR 105 HG1 THR 105 6.414 -9.766 -20.590
5 HG21 THR 105 HG21 THR 105 7.670 -11.364 -18.603
6 HG22 THR 105 HG22 THR 105 8.984 -11.665 -19.746
7 HG23 THR 105 HG23 THR 105 9.288 -10.734 -18.279
No H/Q in entry = 7
In of MODEL 11
1 H ASP 106 H ASP 106 8.576 -6.441 -18.725
2 HA ASP 106 HA ASP 106 8.363 -5.082 -21.011
3 HB2 ASP 106 HB2 ASP 106 5.917 -5.500 -21.085
4 HB3 ASP 106 HB3 ASP 106 5.744 -4.779 -19.502
No H/Q in entry = 4
In of MODEL 11
1 H GLU 107 H GLU 107 9.002 -2.929 -20.626
2 HA GLU 107 HA GLU 107 10.526 -2.858 -18.301
3 HB2 GLU 107 HB2 GLU 107 11.147 -1.780 -20.436
4 HB3 GLU 107 HB3 GLU 107 9.909 -0.566 -20.169
5 HG2 GLU 107 HG2 GLU 107 12.056 0.330 -19.590
6 HG3 GLU 107 HG3 GLU 107 11.083 0.151 -18.131
No H/Q in entry = 6
In of MODEL 11
1 H GLU 108 H GLU 108 7.586 -1.004 -19.115
2 HA GLU 108 HA GLU 108 7.617 0.468 -16.678
3 HB2 GLU 108 HB2 GLU 108 5.371 -0.018 -18.636
4 HB3 GLU 108 HB3 GLU 108 5.369 1.186 -17.355
5 HG2 GLU 108 HG2 GLU 108 7.214 2.346 -18.395
6 HG3 GLU 108 HG3 GLU 108 7.310 1.111 -19.649
No H/Q in entry = 6
In of MODEL 11
1 H LYS 109 H LYS 109 5.990 -2.497 -17.766
2 HA LYS 109 HA LYS 109 4.408 -2.963 -15.508
3 HB2 LYS 109 HB2 LYS 109 5.723 -4.679 -17.576
4 HB3 LYS 109 HB3 LYS 109 4.996 -5.446 -16.181
5 HG2 LYS 109 HG2 LYS 109 3.470 -5.442 -18.057
6 HG3 LYS 109 HG3 LYS 109 2.847 -4.450 -16.751
7 HD2 LYS 109 HD2 LYS 109 3.532 -2.439 -17.893
8 HD3 LYS 109 HD3 LYS 109 4.277 -3.397 -19.178
9 HE2 LYS 109 HE2 LYS 109 2.067 -4.333 -19.727
10 HE3 LYS 109 HE3 LYS 109 1.344 -3.327 -18.473
11 HZ1 LYS 109 HZ1 LYS 109 2.097 -1.369 -19.677
12 HZ2 LYS 109 HZ2 LYS 109 2.769 -2.340 -20.882
13 HZ3 LYS 109 HZ3 LYS 109 1.095 -2.323 -20.647
No H/Q in entry = 13
In of MODEL 11
1 H LYS 110 H LYS 110 7.639 -4.148 -16.284
2 HA LYS 110 HA LYS 110 8.241 -5.240 -13.772
3 HB2 LYS 110 HB2 LYS 110 10.099 -4.184 -15.903
4 HB3 LYS 110 HB3 LYS 110 10.578 -5.224 -14.569
5 HG2 LYS 110 HG2 LYS 110 9.111 -6.990 -15.434
6 HG3 LYS 110 HG3 LYS 110 8.660 -5.939 -16.781
7 HD2 LYS 110 HD2 LYS 110 11.495 -6.764 -16.184
8 HD3 LYS 110 HD3 LYS 110 10.443 -7.642 -17.293
9 HE2 LYS 110 HE2 LYS 110 10.217 -5.655 -18.672
10 HE3 LYS 110 HE3 LYS 110 11.209 -4.736 -17.543
11 HZ1 LYS 110 HZ1 LYS 110 12.164 -7.132 -19.005
12 HZ2 LYS 110 HZ2 LYS 110 12.400 -5.545 -19.541
13 HZ3 LYS 110 HZ3 LYS 110 13.094 -6.058 -18.085
No H/Q in entry = 13
In of MODEL 11
1 H GLN 111 H GLN 111 8.091 -1.998 -14.769
2 HA GLN 111 HA GLN 111 9.800 -0.854 -12.807
3 HB2 GLN 111 HB2 GLN 111 8.652 0.269 -14.844
4 HB3 GLN 111 HB3 GLN 111 7.261 0.440 -13.790
5 HG2 GLN 111 HG2 GLN 111 9.963 1.522 -13.060
6 HG3 GLN 111 HG3 GLN 111 8.813 2.433 -14.030
7 HE21 GLN 111 HE21 GLN 111 9.675 1.364 -10.885
8 HE22 GLN 111 HE22 GLN 111 8.418 2.185 -10.024
No H/Q in entry = 8
In of MODEL 11
1 H TYR 112 H TYR 112 6.420 -1.878 -12.810
2 HA TYR 112 HA TYR 112 5.843 -1.005 -10.118
3 HB2 TYR 112 HB2 TYR 112 4.425 -3.136 -11.744
4 HB3 TYR 112 HB3 TYR 112 3.781 -2.250 -10.372
5 HD1 TYR 112 HD1 TYR 112 4.055 0.450 -10.785
6 HD2 TYR 112 HD2 TYR 112 3.526 -2.524 -13.774
7 HE1 TYR 112 HE1 TYR 112 3.119 2.146 -12.295
8 HE2 TYR 112 HE2 TYR 112 2.597 -0.836 -15.301
9 HH TYR 112 HH TYR 112 1.398 1.439 -15.012
No H/Q in entry = 9
In of MODEL 11
1 H ILE 113 H ILE 113 6.996 -3.917 -11.672
2 HA ILE 113 HA ILE 113 6.751 -5.706 -9.543
3 HB ILE 113 HB ILE 113 8.889 -5.653 -11.671
4 HG12 ILE 113 HG12 ILE 113 6.163 -6.964 -11.611
5 HG13 ILE 113 HG13 ILE 113 6.614 -5.568 -12.585
6 HG21 ILE 113 HG21 ILE 113 7.870 -7.905 -9.940
7 HG22 ILE 113 HG22 ILE 113 9.005 -8.079 -11.277
8 HG23 ILE 113 HG23 ILE 113 9.461 -7.151 -9.848
9 HD11 ILE 113 HD11 ILE 113 8.393 -7.097 -13.588
10 HD12 ILE 113 HD12 ILE 113 7.464 -8.405 -12.867
11 HD13 ILE 113 HD13 ILE 113 6.712 -7.347 -14.056
No H/Q in entry = 11
In of MODEL 11
1 H ALA 114 H ALA 114 9.440 -3.593 -10.507
2 HA ALA 114 HA ALA 114 11.108 -4.105 -8.223
3 HB1 ALA 114 HB1 ALA 114 12.092 -3.330 -10.273
4 HB2 ALA 114 HB2 ALA 114 12.330 -2.104 -9.028
5 HB3 ALA 114 HB3 ALA 114 11.083 -1.881 -10.259
No H/Q in entry = 5
In of MODEL 11
1 H ASP 115 H ASP 115 8.577 -1.813 -9.013
2 HA ASP 115 HA ASP 115 9.225 0.077 -6.975
3 HB2 ASP 115 HB2 ASP 115 8.010 0.524 -9.148
4 HB3 ASP 115 HB3 ASP 115 6.607 -0.263 -8.440
No H/Q in entry = 4
In of MODEL 11
1 H PHE 116 H PHE 116 6.523 -2.173 -7.408
2 HA PHE 116 HA PHE 116 5.812 -1.700 -4.617
3 HB2 PHE 116 HB2 PHE 116 4.244 -1.848 -6.965
4 HB3 PHE 116 HB3 PHE 116 3.837 -3.267 -6.001
5 HD1 PHE 116 HD1 PHE 116 3.879 0.397 -6.090
6 HD2 PHE 116 HD2 PHE 116 2.711 -3.084 -3.942
7 HE1 PHE 116 HE1 PHE 116 2.433 1.785 -4.666
8 HE2 PHE 116 HE2 PHE 116 1.244 -1.696 -2.505
9 HZ PHE 116 HZ PHE 116 1.141 0.751 -2.854
No H/Q in entry = 9
In of MODEL 11
1 H GLY 117 H GLY 117 7.058 -4.081 -6.710
2 HA2 GLY 117 HA2 GLY 117 7.781 -6.235 -6.270
3 HA3 GLY 117 HA3 GLY 117 6.124 -6.485 -5.767
No H/Q in entry = 3
In of MODEL 11
1 HA PRO 118 HA PRO 118 9.508 -6.854 -2.253
2 HB2 PRO 118 HB2 PRO 118 10.475 -4.365 -1.459
3 HB3 PRO 118 HB3 PRO 118 11.345 -5.541 -2.448
4 HG2 PRO 118 HG2 PRO 118 9.797 -3.132 -3.285
5 HG3 PRO 118 HG3 PRO 118 11.303 -3.786 -3.950
6 HD2 PRO 118 HD2 PRO 118 8.974 -4.130 -5.211
7 HD3 PRO 118 HD3 PRO 118 10.196 -5.419 -5.178
No H/Q in entry = 7
In of MODEL 11
1 H ALA 119 H ALA 119 7.863 -3.691 -2.209
2 HA ALA 119 HA ALA 119 7.288 -3.752 0.572
3 HB1 ALA 119 HB1 ALA 119 5.869 -1.825 0.122
4 HB2 ALA 119 HB2 ALA 119 5.975 -2.134 -1.611
5 HB3 ALA 119 HB3 ALA 119 7.417 -1.669 -0.707
No H/Q in entry = 5
In of MODEL 11
1 H CYS 120 H CYS 120 5.514 -4.655 -2.315
2 HA CYS 120 HA CYS 120 3.036 -5.307 -1.184
3 HB2 CYS 120 HB2 CYS 120 3.558 -5.154 -3.627
4 HB3 CYS 120 HB3 CYS 120 4.413 -6.685 -3.497
No H/Q in entry = 4
In of MODEL 11
1 H LYS 121 H LYS 121 6.101 -7.014 -1.206
2 HA LYS 121 HA LYS 121 5.121 -9.559 -0.509
3 HB2 LYS 121 HB2 LYS 121 7.690 -8.338 -0.813
4 HB3 LYS 121 HB3 LYS 121 7.664 -9.262 0.683
5 HG2 LYS 121 HG2 LYS 121 8.466 -10.624 -1.153
6 HG3 LYS 121 HG3 LYS 121 6.932 -11.244 -0.540
7 HD2 LYS 121 HD2 LYS 121 5.790 -10.021 -2.402
8 HD3 LYS 121 HD3 LYS 121 7.384 -9.629 -3.047
9 HE2 LYS 121 HE2 LYS 121 6.347 -12.423 -2.570
10 HE3 LYS 121 HE3 LYS 121 6.353 -11.600 -4.129
11 HZ1 LYS 121 HZ1 LYS 121 8.814 -12.089 -2.548
12 HZ2 LYS 121 HZ2 LYS 121 8.250 -13.152 -3.738
13 HZ3 LYS 121 HZ3 LYS 121 8.704 -11.575 -4.156
No H/Q in entry = 13
In of MODEL 11
1 H LYS 122 H LYS 122 6.166 -6.848 1.597
2 HA LYS 122 HA LYS 122 5.485 -8.303 3.975
3 HB2 LYS 122 HB2 LYS 122 5.683 -6.191 5.179
4 HB3 LYS 122 HB3 LYS 122 7.061 -6.438 4.128
5 HG2 LYS 122 HG2 LYS 122 6.066 -4.872 2.507
6 HG3 LYS 122 HG3 LYS 122 4.735 -4.592 3.631
7 HD2 LYS 122 HD2 LYS 122 7.645 -4.098 4.272
8 HD3 LYS 122 HD3 LYS 122 6.519 -2.854 3.730
9 HE2 LYS 122 HE2 LYS 122 5.150 -3.178 5.693
10 HE3 LYS 122 HE3 LYS 122 6.148 -4.534 6.211
11 HZ1 LYS 122 HZ1 LYS 122 7.178 -1.767 5.905
12 HZ2 LYS 122 HZ2 LYS 122 6.611 -2.395 7.373
13 HZ3 LYS 122 HZ3 LYS 122 7.964 -3.080 6.616
No H/Q in entry = 13
In of MODEL 11
1 H ILE 123 H ILE 123 3.770 -6.314 1.693
2 HA ILE 123 HA ILE 123 1.486 -5.779 3.238
3 HB ILE 123 HB ILE 123 1.854 -5.923 0.269
4 HG12 ILE 123 HG12 ILE 123 1.545 -3.635 2.222
5 HG13 ILE 123 HG13 ILE 123 3.053 -4.146 1.469
6 HG21 ILE 123 HG21 ILE 123 -0.565 -5.035 1.830
7 HG22 ILE 123 HG22 ILE 123 -0.319 -4.770 0.104
8 HG23 ILE 123 HG23 ILE 123 -0.467 -6.411 0.730
9 HD11 ILE 123 HD11 ILE 123 0.659 -3.155 -0.032
10 HD12 ILE 123 HD12 ILE 123 2.030 -2.155 0.440
11 HD13 ILE 123 HD13 ILE 123 2.259 -3.494 -0.683
No H/Q in entry = 11
In of MODEL 11
1 H TYR 124 H TYR 124 2.097 -8.234 0.838
2 HA TYR 124 HA TYR 124 -0.181 -9.858 1.487
3 HB2 TYR 124 HB2 TYR 124 2.103 -10.056 -0.430
4 HB3 TYR 124 HB3 TYR 124 1.177 -11.506 -0.048
5 HD1 TYR 124 HD1 TYR 124 0.555 -7.937 -0.999
6 HD2 TYR 124 HD2 TYR 124 -0.608 -12.008 -1.420
7 HE1 TYR 124 HE1 TYR 124 -1.162 -7.274 -2.628
8 HE2 TYR 124 HE2 TYR 124 -2.326 -11.354 -3.053
9 HH TYR 124 HH TYR 124 -2.436 -8.264 -4.465
No H/Q in entry = 9
In of MODEL 11
1 H GLY 125 H GLY 125 1.443 -9.355 3.691
2 HA2 GLY 125 HA2 GLY 125 2.811 -10.281 5.364
3 HA3 GLY 125 HA3 GLY 125 3.923 -9.839 4.105
No H/Q in entry = 3
In of MODEL 11
1 H VAL 126 H VAL 126 3.004 -12.183 2.483
2 HA VAL 126 HA VAL 126 3.762 -14.602 3.606
3 HB VAL 126 HB VAL 126 4.514 -15.221 1.293
4 HG11 VAL 126 HG11 VAL 126 1.845 -13.845 1.526
5 HG12 VAL 126 HG12 VAL 126 2.296 -14.990 0.264
6 HG13 VAL 126 HG13 VAL 126 2.206 -15.520 1.942
7 HG21 VAL 126 HG21 VAL 126 5.389 -13.027 0.630
8 HG22 VAL 126 HG22 VAL 126 4.179 -13.610 -0.513
9 HG23 VAL 126 HG23 VAL 126 3.752 -12.366 0.664
No H/Q in entry = 9
In of MODEL 11
1 H HIS 127 H HIS 127 5.675 -11.847 3.246
2 HA HIS 127 HA HIS 127 8.182 -13.344 3.072
3 HB2 HIS 127 HB2 HIS 127 7.917 -11.404 1.596
4 HB3 HIS 127 HB3 HIS 127 7.631 -10.366 2.986
5 HD1 HIS 127 HD1 HIS 127 10.425 -12.496 1.515
6 HD2 HIS 127 HD2 HIS 127 9.861 -9.208 3.992
7 HE1 HIS 127 HE1 HIS 127 12.723 -11.587 1.967
8 HE2 HIS 127 HE2 HIS 127 12.364 -9.687 3.578
No H/Q in entry = 8
In of MODEL 11
1 H THR 128 H THR 128 6.086 -12.242 5.419
2 HA THR 128 HA THR 128 8.238 -12.186 7.417
3 HB THR 128 HB THR 128 5.943 -10.214 7.392
4 HG1 THR 128 HG1 THR 128 7.487 -8.697 6.775
5 HG21 THR 128 HG21 THR 128 8.391 -10.414 9.156
6 HG22 THR 128 HG22 THR 128 7.182 -9.132 9.213
7 HG23 THR 128 HG23 THR 128 6.734 -10.783 9.639
No H/Q in entry = 7
In of MODEL 11
1 H SER 129 H SER 129 7.776 -14.083 8.375
2 HA SER 129 HA SER 129 6.796 -15.535 9.804
3 HB2 SER 129 HB2 SER 129 4.816 -13.315 10.353
4 HB3 SER 129 HB3 SER 129 5.131 -14.718 11.375
5 HG SER 129 HG SER 129 7.455 -13.557 10.942
No H/Q in entry = 5
In of MODEL 12
1 HA2 GLY -4 HA2 GLY -4 -5.486 10.248 -25.109
2 HA3 GLY -4 HA3 GLY -4 -6.487 9.097 -24.234
3 H1 GLY -4 H1 GLY -4 -7.388 10.838 -26.455
4 H2 GLY -4 H2 GLY -4 -8.367 9.757 -25.599
No H/Q in entry = 4
In of MODEL 12
1 H SER -3 H SER -3 -6.340 10.032 -22.237
2 HA SER -3 HA SER -3 -7.030 12.830 -21.895
3 HB2 SER -3 HB2 SER -3 -9.229 11.764 -21.936
4 HB3 SER -3 HB3 SER -3 -8.709 10.597 -20.722
5 HG SER -3 HG SER -3 -9.903 12.307 -19.796
No H/Q in entry = 5
In of MODEL 12
1 HA PRO -2 HA PRO -2 -4.018 11.953 -18.691
2 HB2 PRO -2 HB2 PRO -2 -3.540 14.491 -17.979
3 HB3 PRO -2 HB3 PRO -2 -2.941 13.827 -19.505
4 HG2 PRO -2 HG2 PRO -2 -5.343 15.534 -18.997
5 HG3 PRO -2 HG3 PRO -2 -4.136 15.663 -20.289
6 HD2 PRO -2 HD2 PRO -2 -6.578 14.492 -20.623
7 HD3 PRO -2 HD3 PRO -2 -5.139 14.031 -21.552
No H/Q in entry = 7
In of MODEL 12
1 H GLU -1 H GLU -1 -7.169 12.953 -18.397
2 HA GLU -1 HA GLU -1 -7.080 13.468 -15.541
3 HB2 GLU -1 HB2 GLU -1 -9.400 13.258 -17.466
4 HB3 GLU -1 HB3 GLU -1 -9.565 13.618 -15.753
5 HG2 GLU -1 HG2 GLU -1 -8.195 15.285 -17.845
6 HG3 GLU -1 HG3 GLU -1 -9.679 15.664 -16.972
No H/Q in entry = 6
In of MODEL 12
1 H PHE 0 H PHE 0 -7.349 10.829 -17.657
2 HA PHE 0 HA PHE 0 -8.769 9.053 -15.938
3 HB2 PHE 0 HB2 PHE 0 -8.511 8.710 -18.406
4 HB3 PHE 0 HB3 PHE 0 -6.805 8.372 -18.139
5 HD1 PHE 0 HD1 PHE 0 -10.230 7.168 -17.468
6 HD2 PHE 0 HD2 PHE 0 -6.078 6.248 -17.419
7 HE1 PHE 0 HE1 PHE 0 -10.764 4.797 -17.086
8 HE2 PHE 0 HE2 PHE 0 -6.603 3.875 -17.035
9 HZ PHE 0 HZ PHE 0 -8.959 3.148 -16.879
No H/Q in entry = 9
In of MODEL 12
1 H HIS 1 H HIS 1 -7.993 8.768 -13.964
2 HA HIS 1 HA HIS 1 -5.145 8.857 -13.465
3 HB2 HIS 1 HB2 HIS 1 -5.795 8.730 -11.062
4 HB3 HIS 1 HB3 HIS 1 -6.522 10.083 -11.918
5 HD1 HIS 1 HD1 HIS 1 -7.340 7.419 -9.652
6 HD2 HIS 1 HD2 HIS 1 -9.346 9.462 -12.668
7 HE1 HIS 1 HE1 HIS 1 -9.783 6.981 -9.261
8 HE2 HIS 1 HE2 HIS 1 -10.968 8.116 -11.173
No H/Q in entry = 8
In of MODEL 12
1 H HIS 2 H HIS 2 -3.929 7.162 -13.581
2 HA HIS 2 HA HIS 2 -5.036 4.496 -13.614
3 HB2 HIS 2 HB2 HIS 2 -2.226 5.563 -13.921
4 HB3 HIS 2 HB3 HIS 2 -2.589 3.843 -13.902
5 HD1 HIS 2 HD1 HIS 2 -2.576 2.954 -16.188
6 HD2 HIS 2 HD2 HIS 2 -4.098 6.817 -16.063
7 HE1 HIS 2 HE1 HIS 2 -3.167 3.524 -18.564
8 HE2 HIS 2 HE2 HIS 2 -3.851 5.943 -18.488
No H/Q in entry = 8
In of MODEL 12
1 H PHE 3 H PHE 3 -2.355 5.976 -11.789
2 HA PHE 3 HA PHE 3 -3.265 4.623 -9.373
3 HB2 PHE 3 HB2 PHE 3 -0.484 4.258 -10.517
4 HB3 PHE 3 HB3 PHE 3 -0.987 3.743 -8.910
5 HD1 PHE 3 HD1 PHE 3 -2.972 2.092 -8.798
6 HD2 PHE 3 HD2 PHE 3 -0.676 2.815 -12.307
7 HE1 PHE 3 HE1 PHE 3 -3.705 -0.067 -9.717
8 HE2 PHE 3 HE2 PHE 3 -1.408 0.656 -13.233
9 HZ PHE 3 HZ PHE 3 -2.966 -0.764 -11.952
No H/Q in entry = 9
In of MODEL 12
1 H THR 4 H THR 4 -3.649 6.504 -8.332
2 HA THR 4 HA THR 4 -1.288 8.112 -7.662
3 HB THR 4 HB THR 4 -2.781 10.129 -7.531
4 HG1 THR 4 HG1 THR 4 -4.728 9.939 -8.887
5 HG21 THR 4 HG21 THR 4 -2.500 8.880 -10.265
6 HG22 THR 4 HG22 THR 4 -2.778 10.593 -9.940
7 HG23 THR 4 HG23 THR 4 -1.273 9.830 -9.427
No H/Q in entry = 7
In of MODEL 12
1 H LEU 5 H LEU 5 -1.462 9.131 -5.552
2 HA LEU 5 HA LEU 5 -2.661 7.369 -3.674
3 HB2 LEU 5 HB2 LEU 5 -1.118 9.925 -3.429
4 HB3 LEU 5 HB3 LEU 5 -1.878 9.201 -2.025
5 HG LEU 5 HG LEU 5 -0.564 7.105 -2.511
6 HD11 LEU 5 HD11 LEU 5 0.892 8.933 -4.413
7 HD12 LEU 5 HD12 LEU 5 1.445 7.339 -3.896
8 HD13 LEU 5 HD13 LEU 5 -0.037 7.496 -4.842
9 HD21 LEU 5 HD21 LEU 5 0.020 8.867 -0.826
10 HD22 LEU 5 HD22 LEU 5 1.369 7.886 -1.398
11 HD23 LEU 5 HD23 LEU 5 1.145 9.523 -2.013
No H/Q in entry = 11
In of MODEL 12
1 H GLU 6 H GLU 6 -3.594 10.471 -5.029
2 HA GLU 6 HA GLU 6 -5.874 10.974 -3.472
3 HB2 GLU 6 HB2 GLU 6 -5.705 11.148 -6.498
4 HB3 GLU 6 HB3 GLU 6 -6.829 12.016 -5.464
5 HG2 GLU 6 HG2 GLU 6 -5.035 13.330 -4.541
6 HG3 GLU 6 HG3 GLU 6 -3.845 12.390 -5.439
No H/Q in entry = 6
In of MODEL 12
1 H SER 7 H SER 7 -5.475 8.727 -6.263
2 HA SER 7 HA SER 7 -8.053 7.847 -6.490
3 HB2 SER 7 HB2 SER 7 -5.539 6.197 -6.790
4 HB3 SER 7 HB3 SER 7 -7.128 5.738 -7.397
5 HG SER 7 HG SER 7 -5.680 8.076 -8.146
No H/Q in entry = 5
In of MODEL 12
1 H SER 8 H SER 8 -5.917 7.118 -3.826
2 HA SER 8 HA SER 8 -7.538 4.799 -3.141
3 HB2 SER 8 HB2 SER 8 -5.763 4.311 -1.455
4 HB3 SER 8 HB3 SER 8 -5.235 4.292 -3.142
5 HG SER 8 HG SER 8 -4.978 6.773 -2.077
No H/Q in entry = 5
In of MODEL 12
1 H LEU 9 H LEU 9 -7.231 8.074 -2.114
2 HA LEU 9 HA LEU 9 -7.022 7.825 0.600
3 HB2 LEU 9 HB2 LEU 9 -8.348 9.993 -0.978
4 HB3 LEU 9 HB3 LEU 9 -7.850 10.125 0.701
5 HG LEU 9 HG LEU 9 -5.942 9.467 -1.528
6 HD11 LEU 9 HD11 LEU 9 -6.987 11.608 -1.930
7 HD12 LEU 9 HD12 LEU 9 -6.542 12.143 -0.308
8 HD13 LEU 9 HD13 LEU 9 -5.289 11.789 -1.498
9 HD21 LEU 9 HD21 LEU 9 -5.529 10.418 1.305
10 HD22 LEU 9 HD22 LEU 9 -5.191 8.801 0.682
11 HD23 LEU 9 HD23 LEU 9 -4.252 10.184 0.112
No H/Q in entry = 11
In of MODEL 12
1 H ASP 10 H ASP 10 -9.977 7.752 -1.205
2 HA ASP 10 HA ASP 10 -11.496 7.502 1.284
3 HB2 ASP 10 HB2 ASP 10 -12.408 7.876 -1.573
4 HB3 ASP 10 HB3 ASP 10 -13.494 7.716 -0.196
No H/Q in entry = 4
In of MODEL 12
1 H THR 11 H THR 11 -9.870 5.431 -0.612
2 HA THR 11 HA THR 11 -11.764 3.294 0.067
3 HB THR 11 HB THR 11 -10.920 2.050 -1.978
4 HG1 THR 11 HG1 THR 11 -10.236 4.613 -2.983
5 HG21 THR 11 HG21 THR 11 -12.504 4.586 -2.406
6 HG22 THR 11 HG22 THR 11 -12.441 3.225 -3.524
7 HG23 THR 11 HG23 THR 11 -13.150 3.017 -1.923
No H/Q in entry = 7
In of MODEL 12
1 H HIS 12 H HIS 12 -8.698 2.819 -1.557
2 HA HIS 12 HA HIS 12 -7.912 0.849 0.236
3 HB2 HIS 12 HB2 HIS 12 -6.090 2.386 -1.607
4 HB3 HIS 12 HB3 HIS 12 -5.775 0.797 -0.915
5 HD1 HIS 12 HD1 HIS 12 -7.702 -1.064 -1.658
6 HD2 HIS 12 HD2 HIS 12 -7.200 2.283 -4.068
7 HE1 HIS 12 HE1 HIS 12 -8.725 -1.667 -3.876
8 HE2 HIS 12 HE2 HIS 12 -8.586 0.446 -5.242
No H/Q in entry = 8
In of MODEL 12
1 H LEU 13 H LEU 13 -7.115 4.294 0.230
2 HA LEU 13 HA LEU 13 -5.327 3.763 2.512
3 HB2 LEU 13 HB2 LEU 13 -5.189 5.688 0.278
4 HB3 LEU 13 HB3 LEU 13 -4.633 6.247 1.845
5 HG LEU 13 HG LEU 13 -2.740 5.422 0.614
6 HD11 LEU 13 HD11 LEU 13 -2.886 4.927 3.049
7 HD12 LEU 13 HD12 LEU 13 -3.463 3.315 2.636
8 HD13 LEU 13 HD13 LEU 13 -1.851 3.828 2.145
9 HD21 LEU 13 HD21 LEU 13 -4.289 2.856 0.295
10 HD22 LEU 13 HD22 LEU 13 -3.820 3.978 -0.982
11 HD23 LEU 13 HD23 LEU 13 -2.586 3.070 -0.114
No H/Q in entry = 11
In of MODEL 12
1 H LYS 14 H LYS 14 -8.212 4.082 2.556
2 HA LYS 14 HA LYS 14 -8.929 6.651 3.520
3 HB2 LYS 14 HB2 LYS 14 -11.048 5.625 4.154
4 HB3 LYS 14 HB3 LYS 14 -10.577 5.152 2.533
5 HG2 LYS 14 HG2 LYS 14 -9.931 2.983 3.276
6 HG3 LYS 14 HG3 LYS 14 -10.114 3.448 4.967
7 HD2 LYS 14 HD2 LYS 14 -11.997 2.084 4.139
8 HD3 LYS 14 HD3 LYS 14 -12.506 3.679 4.682
9 HE2 LYS 14 HE2 LYS 14 -12.439 4.406 2.291
10 HE3 LYS 14 HE3 LYS 14 -12.142 2.724 1.857
11 HZ1 LYS 14 HZ1 LYS 14 -14.524 3.721 3.322
12 HZ2 LYS 14 HZ2 LYS 14 -14.484 3.317 1.681
13 HZ3 LYS 14 HZ3 LYS 14 -14.248 2.121 2.851
No H/Q in entry = 13
In of MODEL 12
1 H TRP 15 H TRP 15 -7.411 3.987 5.015
2 HA TRP 15 HA TRP 15 -8.353 4.457 7.680
3 HB2 TRP 15 HB2 TRP 15 -6.616 2.817 8.332
4 HB3 TRP 15 HB3 TRP 15 -7.645 2.221 7.032
5 HD1 TRP 15 HD1 TRP 15 -6.550 2.021 4.599
6 HE1 TRP 15 HE1 TRP 15 -4.097 1.810 3.835
7 HE3 TRP 15 HE3 TRP 15 -4.237 3.542 8.894
8 HZ2 TRP 15 HZ2 TRP 15 -1.523 2.232 4.924
9 HZ3 TRP 15 HZ3 TRP 15 -1.778 3.610 8.952
10 HH2 TRP 15 HH2 TRP 15 -0.451 2.967 7.007
No H/Q in entry = 10
In of MODEL 12
1 H LEU 16 H LEU 16 -6.194 6.065 5.700
2 HA LEU 16 HA LEU 16 -4.365 6.956 7.735
3 HB2 LEU 16 HB2 LEU 16 -5.031 8.162 5.042
4 HB3 LEU 16 HB3 LEU 16 -3.701 8.648 6.068
5 HG LEU 16 HG LEU 16 -3.962 5.925 4.793
6 HD11 LEU 16 HD11 LEU 16 -2.344 8.337 3.987
7 HD12 LEU 16 HD12 LEU 16 -2.176 6.726 3.290
8 HD13 LEU 16 HD13 LEU 16 -3.683 7.620 3.094
9 HD21 LEU 16 HD21 LEU 16 -1.691 7.262 6.265
10 HD22 LEU 16 HD22 LEU 16 -2.609 5.852 6.797
11 HD23 LEU 16 HD23 LEU 16 -1.565 5.742 5.377
No H/Q in entry = 11
In of MODEL 12
1 H SER 17 H SER 17 -4.362 9.001 8.687
2 HA SER 17 HA SER 17 -6.984 10.184 9.033
3 HB2 SER 17 HB2 SER 17 -5.769 11.700 10.634
4 HB3 SER 17 HB3 SER 17 -5.627 9.988 11.015
5 HG SER 17 HG SER 17 -3.570 10.321 10.964
No H/Q in entry = 5
In of MODEL 12
1 H GLN 18 H GLN 18 -7.204 12.643 8.829
2 HA GLN 18 HA GLN 18 -6.656 13.408 6.196
3 HB2 GLN 18 HB2 GLN 18 -7.290 15.106 8.619
4 HB3 GLN 18 HB3 GLN 18 -7.181 15.755 6.993
5 HG2 GLN 18 HG2 GLN 18 -9.107 13.622 7.881
6 HG3 GLN 18 HG3 GLN 18 -9.491 15.334 7.699
7 HE21 GLN 18 HE21 GLN 18 -8.836 12.354 6.067
8 HE22 GLN 18 HE22 GLN 18 -9.295 12.883 4.485
No H/Q in entry = 8
In of MODEL 12
1 H GLU 19 H GLU 19 -4.974 14.204 9.203
2 HA GLU 19 HA GLU 19 -3.035 15.880 8.153
3 HB2 GLU 19 HB2 GLU 19 -2.859 13.956 10.478
4 HB3 GLU 19 HB3 GLU 19 -1.815 15.325 10.197
5 HG2 GLU 19 HG2 GLU 19 -3.659 16.857 10.471
6 HG3 GLU 19 HG3 GLU 19 -4.766 15.502 10.670
No H/Q in entry = 6
In of MODEL 12
1 H GLN 20 H GLN 20 -3.065 12.314 8.430
2 HA GLN 20 HA GLN 20 -0.398 12.004 7.479
3 HB2 GLN 20 HB2 GLN 20 -2.726 10.084 7.614
4 HB3 GLN 20 HB3 GLN 20 -1.136 9.619 7.026
5 HG2 GLN 20 HG2 GLN 20 -0.150 10.125 9.170
6 HG3 GLN 20 HG3 GLN 20 -1.698 10.721 9.769
7 HE21 GLN 20 HE21 GLN 20 0.002 8.554 10.763
8 HE22 GLN 20 HE22 GLN 20 -0.987 7.136 10.759
No H/Q in entry = 8
In of MODEL 12
1 H LYS 21 H LYS 21 -3.592 11.869 5.944
2 HA LYS 21 HA LYS 21 -2.737 11.185 3.359
3 HB2 LYS 21 HB2 LYS 21 -5.101 12.850 4.252
4 HB3 LYS 21 HB3 LYS 21 -4.864 12.286 2.603
5 HG2 LYS 21 HG2 LYS 21 -5.014 9.986 3.322
6 HG3 LYS 21 HG3 LYS 21 -5.124 10.494 5.008
7 HD2 LYS 21 HD2 LYS 21 -7.241 11.571 4.596
8 HD3 LYS 21 HD3 LYS 21 -7.113 11.239 2.867
9 HE2 LYS 21 HE2 LYS 21 -7.261 8.864 3.270
10 HE3 LYS 21 HE3 LYS 21 -7.244 9.124 5.014
11 HZ1 LYS 21 HZ1 LYS 21 -9.357 10.173 3.216
12 HZ2 LYS 21 HZ2 LYS 21 -9.483 8.717 4.061
13 HZ3 LYS 21 HZ3 LYS 21 -9.362 10.174 4.906
No H/Q in entry = 13
In of MODEL 12
1 H ASP 22 H ASP 22 -3.326 14.352 4.813
2 HA ASP 22 HA ASP 22 -2.592 15.919 2.608
3 HB2 ASP 22 HB2 ASP 22 -3.839 16.769 4.557
4 HB3 ASP 22 HB3 ASP 22 -2.414 16.559 5.562
No H/Q in entry = 4
In of MODEL 12
1 H GLU 23 H GLU 23 -0.578 14.370 5.100
2 HA GLU 23 HA GLU 23 1.848 15.631 4.464
3 HB2 GLU 23 HB2 GLU 23 1.099 12.916 5.493
4 HB3 GLU 23 HB3 GLU 23 2.757 13.353 5.170
5 HG2 GLU 23 HG2 GLU 23 0.903 14.696 7.078
6 HG3 GLU 23 HG3 GLU 23 2.269 13.662 7.492
No H/Q in entry = 6
In of MODEL 12
1 H LEU 24 H LEU 24 0.359 12.669 3.156
2 HA LEU 24 HA LEU 24 2.390 12.109 1.316
3 HB2 LEU 24 HB2 LEU 24 -0.488 11.323 1.609
4 HB3 LEU 24 HB3 LEU 24 0.444 10.798 0.222
5 HG LEU 24 HG LEU 24 1.961 9.579 1.631
6 HD11 LEU 24 HD11 LEU 24 1.821 11.241 3.534
7 HD12 LEU 24 HD12 LEU 24 0.447 10.275 4.081
8 HD13 LEU 24 HD13 LEU 24 2.043 9.534 3.903
9 HD21 LEU 24 HD21 LEU 24 -0.904 9.091 2.358
10 HD22 LEU 24 HD22 LEU 24 -0.017 8.386 1.010
11 HD23 LEU 24 HD23 LEU 24 0.411 7.958 2.663
No H/Q in entry = 11
In of MODEL 12
1 H LEU 25 H LEU 25 -0.808 13.733 0.812
2 HA LEU 25 HA LEU 25 -0.472 14.425 -1.840
3 HB2 LEU 25 HB2 LEU 25 -1.851 15.761 0.461
4 HB3 LEU 25 HB3 LEU 25 -1.891 16.451 -1.148
5 HG LEU 25 HG LEU 25 -3.889 15.168 -0.617
6 HD11 LEU 25 HD11 LEU 25 -2.194 13.959 -2.785
7 HD12 LEU 25 HD12 LEU 25 -3.949 13.815 -2.663
8 HD13 LEU 25 HD13 LEU 25 -3.210 15.396 -2.932
9 HD21 LEU 25 HD21 LEU 25 -2.931 13.502 0.851
10 HD22 LEU 25 HD22 LEU 25 -3.866 12.762 -0.453
11 HD23 LEU 25 HD23 LEU 25 -2.104 12.769 -0.528
No H/Q in entry = 11
In of MODEL 12
1 H LYS 26 H LYS 26 0.684 16.043 1.063
2 HA LYS 26 HA LYS 26 1.668 18.402 -0.065
3 HB2 LYS 26 HB2 LYS 26 1.369 17.750 2.379
4 HB3 LYS 26 HB3 LYS 26 2.889 16.888 2.238
5 HG2 LYS 26 HG2 LYS 26 3.995 19.011 1.652
6 HG3 LYS 26 HG3 LYS 26 2.462 19.846 1.908
7 HD2 LYS 26 HD2 LYS 26 4.129 18.364 3.931
8 HD3 LYS 26 HD3 LYS 26 3.704 20.075 3.922
9 HE2 LYS 26 HE2 LYS 26 1.806 17.764 4.332
10 HE3 LYS 26 HE3 LYS 26 2.388 18.863 5.574
11 HZ1 LYS 26 HZ1 LYS 26 0.833 19.761 3.220
12 HZ2 LYS 26 HZ2 LYS 26 0.118 19.352 4.701
13 HZ3 LYS 26 HZ3 LYS 26 1.209 20.649 4.608
No H/Q in entry = 13
In of MODEL 12
1 H MET 27 H MET 27 3.302 15.360 0.686
2 HA MET 27 HA MET 27 5.757 16.008 -0.468
3 HB2 MET 27 HB2 MET 27 4.492 13.309 -0.042
4 HB3 MET 27 HB3 MET 27 6.179 13.573 -0.458
5 HG2 MET 27 HG2 MET 27 6.088 15.125 1.677
6 HG3 MET 27 HG3 MET 27 4.753 14.055 2.096
7 HE1 MET 27 HE1 MET 27 5.069 11.321 1.957
8 HE2 MET 27 HE2 MET 27 5.987 11.419 0.452
9 HE3 MET 27 HE3 MET 27 6.653 10.550 1.834
No H/Q in entry = 9
In of MODEL 12
1 H LYS 28 H LYS 28 2.992 14.233 -1.966
2 HA LYS 28 HA LYS 28 4.309 13.596 -4.350
3 HB2 LYS 28 HB2 LYS 28 2.066 12.756 -3.458
4 HB3 LYS 28 HB3 LYS 28 1.370 14.236 -4.095
5 HG2 LYS 28 HG2 LYS 28 2.914 12.330 -5.826
6 HG3 LYS 28 HG3 LYS 28 1.187 12.142 -5.525
7 HD2 LYS 28 HD2 LYS 28 0.774 14.354 -6.458
8 HD3 LYS 28 HD3 LYS 28 2.504 14.585 -6.713
9 HE2 LYS 28 HE2 LYS 28 2.527 12.692 -8.261
10 HE3 LYS 28 HE3 LYS 28 0.799 12.459 -8.001
11 HZ1 LYS 28 HZ1 LYS 28 0.402 14.658 -8.922
12 HZ2 LYS 28 HZ2 LYS 28 2.062 14.880 -9.170
13 HZ3 LYS 28 HZ3 LYS 28 1.227 13.684 -10.031
No H/Q in entry = 13
In of MODEL 12
1 H LYS 29 H LYS 29 2.399 16.456 -3.460
2 HA LYS 29 HA LYS 29 2.667 17.689 -6.000
3 HB2 LYS 29 HB2 LYS 29 2.011 18.965 -3.343
4 HB3 LYS 29 HB3 LYS 29 1.800 19.718 -4.916
5 HG2 LYS 29 HG2 LYS 29 0.257 17.777 -5.470
6 HG3 LYS 29 HG3 LYS 29 0.303 17.392 -3.750
7 HD2 LYS 29 HD2 LYS 29 -0.650 19.967 -5.002
8 HD3 LYS 29 HD3 LYS 29 -1.650 18.733 -4.242
9 HE2 LYS 29 HE2 LYS 29 0.466 20.360 -2.839
10 HE3 LYS 29 HE3 LYS 29 -1.260 20.698 -2.795
11 HZ1 LYS 29 HZ1 LYS 29 -0.012 18.185 -1.826
12 HZ2 LYS 29 HZ2 LYS 29 -0.465 19.481 -0.835
13 HZ3 LYS 29 HZ3 LYS 29 -1.643 18.619 -1.691
No H/Q in entry = 13
In of MODEL 12
1 H ASP 30 H ASP 30 4.681 17.667 -3.168
2 HA ASP 30 HA ASP 30 6.193 19.968 -4.036
3 HB2 ASP 30 HB2 ASP 30 5.827 19.515 -1.622
4 HB3 ASP 30 HB3 ASP 30 6.738 18.019 -1.774
No H/Q in entry = 4
In of MODEL 12
1 H GLY 31 H GLY 31 6.077 16.822 -4.928
2 HA2 GLY 31 HA2 GLY 31 8.547 17.198 -6.419
3 HA3 GLY 31 HA3 GLY 31 7.269 16.053 -6.792
No H/Q in entry = 3
In of MODEL 12
1 H LYS 32 H LYS 32 7.336 15.268 -3.848
2 HA LYS 32 HA LYS 32 9.806 13.892 -3.551
3 HB2 LYS 32 HB2 LYS 32 7.129 13.312 -2.265
4 HB3 LYS 32 HB3 LYS 32 8.678 12.661 -1.751
5 HG2 LYS 32 HG2 LYS 32 7.818 15.545 -1.659
6 HG3 LYS 32 HG3 LYS 32 8.025 14.457 -0.289
7 HD2 LYS 32 HD2 LYS 32 10.420 14.282 -0.812
8 HD3 LYS 32 HD3 LYS 32 10.196 15.404 -2.157
9 HE2 LYS 32 HE2 LYS 32 9.375 17.096 -0.540
10 HE3 LYS 32 HE3 LYS 32 9.753 15.979 0.769
11 HZ1 LYS 32 HZ1 LYS 32 12.072 16.024 0.082
12 HZ2 LYS 32 HZ2 LYS 32 11.702 17.111 -1.160
13 HZ3 LYS 32 HZ3 LYS 32 11.519 17.582 0.450
No H/Q in entry = 13
In of MODEL 12
1 H ALA 33 H ALA 33 10.146 11.680 -3.802
2 HA ALA 33 HA ALA 33 9.023 10.659 -6.233
3 HB1 ALA 33 HB1 ALA 33 11.377 10.290 -5.674
4 HB2 ALA 33 HB2 ALA 33 10.526 8.769 -5.945
5 HB3 ALA 33 HB3 ALA 33 10.892 9.294 -4.300
No H/Q in entry = 5
In of MODEL 12
1 H LYS 34 H LYS 34 8.050 8.513 -6.451
2 HA LYS 34 HA LYS 34 5.822 8.176 -4.770
3 HB2 LYS 34 HB2 LYS 34 7.085 6.240 -6.716
4 HB3 LYS 34 HB3 LYS 34 5.544 5.969 -5.919
5 HG2 LYS 34 HG2 LYS 34 5.043 6.760 -8.079
6 HG3 LYS 34 HG3 LYS 34 4.744 8.109 -6.985
7 HD2 LYS 34 HD2 LYS 34 6.905 9.080 -7.580
8 HD3 LYS 34 HD3 LYS 34 7.234 7.713 -8.647
9 HE2 LYS 34 HE2 LYS 34 5.296 8.318 -10.009
10 HE3 LYS 34 HE3 LYS 34 4.974 9.685 -8.945
11 HZ1 LYS 34 HZ1 LYS 34 7.430 9.308 -10.567
12 HZ2 LYS 34 HZ2 LYS 34 6.161 10.360 -10.940
13 HZ3 LYS 34 HZ3 LYS 34 7.108 10.627 -9.564
No H/Q in entry = 13
In of MODEL 12
1 H LYS 35 H LYS 35 9.006 6.718 -4.823
2 HA LYS 35 HA LYS 35 8.569 4.704 -2.919
3 HB2 LYS 35 HB2 LYS 35 11.093 6.228 -3.562
4 HB3 LYS 35 HB3 LYS 35 11.026 4.752 -2.611
5 HG2 LYS 35 HG2 LYS 35 10.232 5.041 -5.498
6 HG3 LYS 35 HG3 LYS 35 11.706 4.289 -4.892
7 HD2 LYS 35 HD2 LYS 35 8.894 3.338 -4.349
8 HD3 LYS 35 HD3 LYS 35 10.012 2.627 -5.509
9 HE2 LYS 35 HE2 LYS 35 10.455 2.813 -2.534
10 HE3 LYS 35 HE3 LYS 35 9.933 1.372 -3.400
11 HZ1 LYS 35 HZ1 LYS 35 12.018 1.422 -4.640
12 HZ2 LYS 35 HZ2 LYS 35 12.521 2.779 -3.766
13 HZ3 LYS 35 HZ3 LYS 35 12.291 1.305 -2.974
No H/Q in entry = 13
In of MODEL 12
1 H GLU 36 H GLU 36 8.700 8.119 -2.492
2 HA GLU 36 HA GLU 36 9.518 7.924 0.292
3 HB2 GLU 36 HB2 GLU 36 8.665 10.363 -1.269
4 HB3 GLU 36 HB3 GLU 36 9.477 10.339 0.292
5 HG2 GLU 36 HG2 GLU 36 11.402 9.218 -0.807
6 HG3 GLU 36 HG3 GLU 36 10.594 9.457 -2.344
No H/Q in entry = 6
In of MODEL 12
1 H LEU 37 H LEU 37 6.794 8.371 -1.721
2 HA LEU 37 HA LEU 37 4.869 8.820 0.342
3 HB2 LEU 37 HB2 LEU 37 4.510 7.735 -2.454
4 HB3 LEU 37 HB3 LEU 37 3.233 8.338 -1.418
5 HG LEU 37 HG LEU 37 5.533 10.066 -2.309
6 HD11 LEU 37 HD11 LEU 37 4.371 9.256 -4.280
7 HD12 LEU 37 HD12 LEU 37 2.828 9.755 -3.595
8 HD13 LEU 37 HD13 LEU 37 4.040 10.965 -4.014
9 HD21 LEU 37 HD21 LEU 37 4.269 10.797 -0.333
10 HD22 LEU 37 HD22 LEU 37 4.042 11.882 -1.707
11 HD23 LEU 37 HD23 LEU 37 2.780 10.730 -1.275
No H/Q in entry = 11
In of MODEL 12
1 H GLU 38 H GLU 38 6.004 6.014 -1.453
2 HA GLU 38 HA GLU 38 4.462 4.021 -0.228
3 HB2 GLU 38 HB2 GLU 38 5.698 3.502 -2.204
4 HB3 GLU 38 HB3 GLU 38 7.209 4.021 -1.483
5 HG2 GLU 38 HG2 GLU 38 5.966 1.850 -0.009
6 HG3 GLU 38 HG3 GLU 38 6.294 1.434 -1.690
No H/Q in entry = 6
In of MODEL 12
1 H ALA 39 H ALA 39 6.932 5.989 0.979
2 HA ALA 39 HA ALA 39 7.822 4.119 3.001
3 HB1 ALA 39 HB1 ALA 39 8.701 6.950 2.496
4 HB2 ALA 39 HB2 ALA 39 9.478 5.782 3.566
5 HB3 ALA 39 HB3 ALA 39 9.453 5.505 1.823
No H/Q in entry = 5
In of MODEL 12
1 H LYS 40 H LYS 40 6.122 7.239 2.897
2 HA LYS 40 HA LYS 40 5.789 7.548 5.650
3 HB2 LYS 40 HB2 LYS 40 4.350 8.511 3.223
4 HB3 LYS 40 HB3 LYS 40 3.573 8.700 4.783
5 HG2 LYS 40 HG2 LYS 40 6.309 9.735 4.116
6 HG3 LYS 40 HG3 LYS 40 4.833 10.693 4.052
7 HD2 LYS 40 HD2 LYS 40 4.473 10.136 6.466
8 HD3 LYS 40 HD3 LYS 40 6.072 9.397 6.473
9 HE2 LYS 40 HE2 LYS 40 7.098 11.504 5.912
10 HE3 LYS 40 HE3 LYS 40 5.517 12.265 5.733
11 HZ1 LYS 40 HZ1 LYS 40 5.116 11.842 8.095
12 HZ2 LYS 40 HZ2 LYS 40 6.666 11.183 8.251
13 HZ3 LYS 40 HZ3 LYS 40 6.476 12.817 7.860
No H/Q in entry = 13
In of MODEL 12
1 H ILE 41 H ILE 41 3.654 6.040 3.226
2 HA ILE 41 HA ILE 41 1.623 5.254 4.938
3 HB ILE 41 HB ILE 41 2.599 3.941 2.405
4 HG12 ILE 41 HG12 ILE 41 0.324 5.867 2.910
5 HG13 ILE 41 HG13 ILE 41 1.887 6.312 2.233
6 HG21 ILE 41 HG21 ILE 41 1.273 2.379 3.717
7 HG22 ILE 41 HG22 ILE 41 -0.010 3.579 3.871
8 HG23 ILE 41 HG23 ILE 41 0.385 2.908 2.288
9 HD11 ILE 41 HD11 ILE 41 -0.082 4.414 1.000
10 HD12 ILE 41 HD12 ILE 41 0.195 6.088 0.517
11 HD13 ILE 41 HD13 ILE 41 1.475 4.889 0.319
No H/Q in entry = 11
In of MODEL 12
1 H LEU 42 H LEU 42 4.549 3.475 3.966
2 HA LEU 42 HA LEU 42 3.920 1.123 5.391
3 HB2 LEU 42 HB2 LEU 42 6.553 2.245 4.472
4 HB3 LEU 42 HB3 LEU 42 6.400 0.686 5.250
5 HG LEU 42 HG LEU 42 5.324 1.520 2.568
6 HD11 LEU 42 HD11 LEU 42 7.665 0.880 2.649
7 HD12 LEU 42 HD12 LEU 42 7.234 -0.640 3.433
8 HD13 LEU 42 HD13 LEU 42 6.713 -0.319 1.777
9 HD21 LEU 42 HD21 LEU 42 4.643 -0.873 4.247
10 HD22 LEU 42 HD22 LEU 42 3.559 0.224 3.397
11 HD23 LEU 42 HD23 LEU 42 4.549 -0.920 2.483
No H/Q in entry = 11
In of MODEL 12
1 H HIS 43 H HIS 43 5.615 4.060 6.298
2 HA HIS 43 HA HIS 43 6.453 3.206 8.868
3 HB2 HIS 43 HB2 HIS 43 7.219 5.283 7.603
4 HB3 HIS 43 HB3 HIS 43 5.711 6.035 8.110
5 HD1 HIS 43 HD1 HIS 43 5.875 7.323 10.232
6 HD2 HIS 43 HD2 HIS 43 8.764 4.343 9.982
7 HE1 HIS 43 HE1 HIS 43 7.311 7.600 12.273
8 HE2 HIS 43 HE2 HIS 43 8.976 5.711 12.165
No H/Q in entry = 8
In of MODEL 12
1 H TYR 44 H TYR 44 3.566 4.997 7.765
2 HA TYR 44 HA TYR 44 2.256 5.196 10.241
3 HB2 TYR 44 HB2 TYR 44 1.031 4.910 7.483
4 HB3 TYR 44 HB3 TYR 44 0.186 5.472 8.921
5 HD1 TYR 44 HD1 TYR 44 2.404 7.218 10.039
6 HD2 TYR 44 HD2 TYR 44 0.820 6.798 6.119
7 HE1 TYR 44 HE1 TYR 44 3.080 9.532 9.534
8 HE2 TYR 44 HE2 TYR 44 1.492 9.082 5.591
9 HH TYR 44 HH TYR 44 3.667 10.828 7.350
No H/Q in entry = 9
In of MODEL 12
1 H TYR 45 H TYR 45 2.477 2.687 7.887
2 HA TYR 45 HA TYR 45 0.366 1.015 8.698
3 HB2 TYR 45 HB2 TYR 45 1.299 0.964 6.473
4 HB3 TYR 45 HB3 TYR 45 2.889 0.589 7.100
5 HD1 TYR 45 HD1 TYR 45 -0.556 -0.853 7.041
6 HD2 TYR 45 HD2 TYR 45 3.636 -1.517 6.982
7 HE1 TYR 45 HE1 TYR 45 -0.946 -3.245 6.627
8 HE2 TYR 45 HE2 TYR 45 3.269 -3.901 6.578
9 HH TYR 45 HH TYR 45 0.186 -5.164 5.745
No H/Q in entry = 9
In of MODEL 12
1 H ASP 46 H ASP 46 3.843 1.004 9.456
2 HA ASP 46 HA ASP 46 3.626 -1.526 10.802
3 HB2 ASP 46 HB2 ASP 46 5.695 -0.067 9.668
4 HB3 ASP 46 HB3 ASP 46 6.046 -0.011 11.389
No H/Q in entry = 4
In of MODEL 12
1 H GLU 47 H GLU 47 3.157 1.704 11.747
2 HA GLU 47 HA GLU 47 3.671 1.099 14.544
3 HB2 GLU 47 HB2 GLU 47 3.152 3.462 14.949
4 HB3 GLU 47 HB3 GLU 47 4.426 3.252 13.761
5 HG2 GLU 47 HG2 GLU 47 2.798 3.646 11.975
6 HG3 GLU 47 HG3 GLU 47 1.546 3.908 13.188
No H/Q in entry = 6
In of MODEL 12
1 H LEU 48 H LEU 48 1.282 0.233 12.638
2 HA LEU 48 HA LEU 48 -1.042 1.336 13.790
3 HB2 LEU 48 HB2 LEU 48 -0.497 -1.038 12.040
4 HB3 LEU 48 HB3 LEU 48 -2.115 -0.638 12.557
5 HG LEU 48 HG LEU 48 -0.319 1.159 10.954
6 HD11 LEU 48 HD11 LEU 48 -1.145 -0.761 9.689
7 HD12 LEU 48 HD12 LEU 48 -2.796 -0.369 10.175
8 HD13 LEU 48 HD13 LEU 48 -1.891 0.741 9.147
9 HD21 LEU 48 HD21 LEU 48 -3.110 1.482 12.019
10 HD22 LEU 48 HD22 LEU 48 -1.704 2.502 12.323
11 HD23 LEU 48 HD23 LEU 48 -2.442 2.477 10.722
No H/Q in entry = 11
In of MODEL 12
1 H GLU 49 H GLU 49 -2.554 -1.033 14.084
2 HA GLU 49 HA GLU 49 -1.776 -1.765 16.815
3 HB2 GLU 49 HB2 GLU 49 -4.560 -0.967 15.941
4 HB3 GLU 49 HB3 GLU 49 -4.087 -1.463 17.558
5 HG2 GLU 49 HG2 GLU 49 -2.587 0.508 17.663
6 HG3 GLU 49 HG3 GLU 49 -3.225 1.025 16.105
No H/Q in entry = 6
In of MODEL 12
1 H GLY 50 H GLY 50 -4.358 -3.189 17.152
2 HA2 GLY 50 HA2 GLY 50 -5.028 -5.384 16.940
3 HA3 GLY 50 HA3 GLY 50 -3.558 -5.693 16.028
No H/Q in entry = 3
In of MODEL 12
1 H ASP 51 H ASP 51 -6.895 -4.628 15.829
2 HA ASP 51 HA ASP 51 -7.270 -5.761 13.258
3 HB2 ASP 51 HB2 ASP 51 -8.918 -4.144 15.123
4 HB3 ASP 51 HB3 ASP 51 -9.374 -4.076 13.423
No H/Q in entry = 4
In of MODEL 12
1 H ALA 52 H ALA 52 -6.257 -2.607 14.337
2 HA ALA 52 HA ALA 52 -6.862 -1.095 12.046
3 HB1 ALA 52 HB1 ALA 52 -4.441 -0.790 13.835
4 HB2 ALA 52 HB2 ALA 52 -5.125 0.438 12.770
5 HB3 ALA 52 HB3 ALA 52 -6.039 -0.123 14.169
No H/Q in entry = 5
In of MODEL 12
1 H LYS 53 H LYS 53 -4.053 -3.066 12.848
2 HA LYS 53 HA LYS 53 -2.591 -2.414 10.495
3 HB2 LYS 53 HB2 LYS 53 -1.822 -3.366 12.831
4 HB3 LYS 53 HB3 LYS 53 -2.129 -4.918 12.078
5 HG2 LYS 53 HG2 LYS 53 -0.348 -2.907 10.766
6 HG3 LYS 53 HG3 LYS 53 0.252 -3.960 12.046
7 HD2 LYS 53 HD2 LYS 53 -0.529 -5.911 10.708
8 HD3 LYS 53 HD3 LYS 53 -0.933 -4.792 9.404
9 HE2 LYS 53 HE2 LYS 53 1.393 -4.071 9.285
10 HE3 LYS 53 HE3 LYS 53 1.808 -5.151 10.613
11 HZ1 LYS 53 HZ1 LYS 53 1.123 -7.027 9.215
12 HZ2 LYS 53 HZ2 LYS 53 0.815 -5.964 7.934
13 HZ3 LYS 53 HZ3 LYS 53 2.389 -6.150 8.519
No H/Q in entry = 13
In of MODEL 12
1 H LYS 54 H LYS 54 -4.466 -5.226 11.564
2 HA LYS 54 HA LYS 54 -4.356 -6.773 9.267
3 HB2 LYS 54 HB2 LYS 54 -5.560 -8.055 10.610
4 HB3 LYS 54 HB3 LYS 54 -5.881 -6.692 11.670
5 HG2 LYS 54 HG2 LYS 54 -7.913 -6.234 10.686
6 HG3 LYS 54 HG3 LYS 54 -7.505 -7.081 9.189
7 HD2 LYS 54 HD2 LYS 54 -7.506 -9.205 10.459
8 HD3 LYS 54 HD3 LYS 54 -8.035 -8.318 11.889
9 HE2 LYS 54 HE2 LYS 54 -9.530 -8.573 9.282
10 HE3 LYS 54 HE3 LYS 54 -9.926 -9.383 10.794
11 HZ1 LYS 54 HZ1 LYS 54 -10.210 -7.118 11.782
12 HZ2 LYS 54 HZ2 LYS 54 -10.067 -6.481 10.215
13 HZ3 LYS 54 HZ3 LYS 54 -11.345 -7.520 10.588
No H/Q in entry = 13
In of MODEL 12
1 H GLU 55 H GLU 55 -6.646 -4.160 10.056
2 HA GLU 55 HA GLU 55 -8.156 -4.422 7.698
3 HB2 GLU 55 HB2 GLU 55 -7.857 -2.344 9.836
4 HB3 GLU 55 HB3 GLU 55 -8.801 -1.976 8.409
5 HG2 GLU 55 HG2 GLU 55 -10.130 -4.049 8.881
6 HG3 GLU 55 HG3 GLU 55 -9.275 -4.153 10.415
No H/Q in entry = 6
In of MODEL 12
1 H ALA 56 H ALA 56 -5.541 -2.157 8.609
2 HA ALA 56 HA ALA 56 -5.530 -0.805 6.182
3 HB1 ALA 56 HB1 ALA 56 -3.239 -0.121 6.722
4 HB2 ALA 56 HB2 ALA 56 -3.161 -1.363 7.972
5 HB3 ALA 56 HB3 ALA 56 -4.284 -0.012 8.138
No H/Q in entry = 5
In of MODEL 12
1 H THR 57 H THR 57 -3.624 -3.615 7.201
2 HA THR 57 HA THR 57 -2.168 -4.057 4.910
3 HB THR 57 HB THR 57 -3.404 -6.188 6.667
4 HG1 THR 57 HG1 THR 57 -2.165 -4.969 7.994
5 HG21 THR 57 HG21 THR 57 -1.027 -6.249 4.806
6 HG22 THR 57 HG22 THR 57 -1.481 -7.542 5.920
7 HG23 THR 57 HG23 THR 57 -2.557 -7.102 4.595
No H/Q in entry = 7
In of MODEL 12
1 H GLU 58 H GLU 58 -5.428 -5.147 5.667
2 HA GLU 58 HA GLU 58 -5.933 -6.589 3.294
3 HB2 GLU 58 HB2 GLU 58 -7.708 -5.304 5.359
4 HB3 GLU 58 HB3 GLU 58 -8.373 -6.139 3.959
5 HG2 GLU 58 HG2 GLU 58 -6.630 -7.297 6.116
6 HG3 GLU 58 HG3 GLU 58 -8.344 -7.607 5.855
No H/Q in entry = 6
In of MODEL 12
1 H HIS 59 H HIS 59 -6.092 -3.176 4.051
2 HA HIS 59 HA HIS 59 -7.611 -2.498 1.693
3 HB2 HIS 59 HB2 HIS 59 -6.099 -0.834 3.705
4 HB3 HIS 59 HB3 HIS 59 -6.857 -0.132 2.284
5 HD1 HIS 59 HD1 HIS 59 -9.579 -1.317 2.225
6 HD2 HIS 59 HD2 HIS 59 -7.702 -0.288 5.785
7 HE1 HIS 59 HE1 HIS 59 -11.429 -0.969 3.891
8 HE2 HIS 59 HE2 HIS 59 -10.254 -0.568 6.081
No H/Q in entry = 8
In of MODEL 12
1 H LEU 60 H LEU 60 -4.245 -2.027 2.753
2 HA LEU 60 HA LEU 60 -3.166 -1.174 0.388
3 HB2 LEU 60 HB2 LEU 60 -2.084 -2.722 2.701
4 HB3 LEU 60 HB3 LEU 60 -1.073 -2.402 1.302
5 HG LEU 60 HG LEU 60 -1.611 0.011 1.605
6 HD11 LEU 60 HD11 LEU 60 -3.594 -0.190 2.905
7 HD12 LEU 60 HD12 LEU 60 -2.659 -0.859 4.249
8 HD13 LEU 60 HD13 LEU 60 -2.391 0.808 3.726
9 HD21 LEU 60 HD21 LEU 60 -0.143 -1.356 3.840
10 HD22 LEU 60 HD22 LEU 60 0.535 -0.888 2.282
11 HD23 LEU 60 HD23 LEU 60 0.005 0.349 3.420
No H/Q in entry = 11
In of MODEL 12
1 H LYS 61 H LYS 61 -3.992 -4.460 1.392
2 HA LYS 61 HA LYS 61 -2.739 -5.838 -0.696
3 HB2 LYS 61 HB2 LYS 61 -5.176 -6.426 0.952
4 HB3 LYS 61 HB3 LYS 61 -4.731 -7.475 -0.388
5 HG2 LYS 61 HG2 LYS 61 -2.563 -7.891 0.646
6 HG3 LYS 61 HG3 LYS 61 -2.995 -6.821 1.984
7 HD2 LYS 61 HD2 LYS 61 -4.868 -8.287 2.547
8 HD3 LYS 61 HD3 LYS 61 -4.439 -9.353 1.209
9 HE2 LYS 61 HE2 LYS 61 -2.348 -9.908 2.247
10 HE3 LYS 61 HE3 LYS 61 -2.610 -8.711 3.516
11 HZ1 LYS 61 HZ1 LYS 61 -4.581 -9.994 4.204
12 HZ2 LYS 61 HZ2 LYS 61 -4.188 -11.183 3.063
13 HZ3 LYS 61 HZ3 LYS 61 -3.138 -10.875 4.356
No H/Q in entry = 13
In of MODEL 12
1 H GLY 62 H GLY 62 -6.101 -4.654 -0.505
2 HA2 GLY 62 HA2 GLY 62 -7.497 -3.864 -2.146
3 HA3 GLY 62 HA3 GLY 62 -6.845 -5.163 -3.137
No H/Q in entry = 3
In of MODEL 12
1 H GLY 63 H GLY 63 -5.218 -2.290 -1.796
2 HA2 GLY 63 HA2 GLY 63 -3.898 -0.716 -2.826
3 HA3 GLY 63 HA3 GLY 63 -5.034 -0.812 -4.167
No H/Q in entry = 3
In of MODEL 12
1 H CYS 64 H CYS 64 -2.727 -3.114 -2.776
2 HA CYS 64 HA CYS 64 -0.881 -3.116 -4.872
3 HB2 CYS 64 HB2 CYS 64 -0.344 -4.130 -2.746
4 HB3 CYS 64 HB3 CYS 64 -1.651 -5.295 -2.924
No H/Q in entry = 4
In of MODEL 12
1 H ARG 65 H ARG 65 -3.802 -5.014 -4.331
2 HA ARG 65 HA ARG 65 -3.688 -6.767 -6.469
3 HB2 ARG 65 HB2 ARG 65 -5.425 -6.879 -4.751
4 HB3 ARG 65 HB3 ARG 65 -6.109 -5.363 -5.321
5 HG2 ARG 65 HG2 ARG 65 -6.459 -6.538 -7.549
6 HG3 ARG 65 HG3 ARG 65 -6.112 -8.036 -6.682
7 HD2 ARG 65 HD2 ARG 65 -8.503 -7.672 -6.771
8 HD3 ARG 65 HD3 ARG 65 -7.934 -7.516 -5.109
9 HE ARG 65 HE ARG 65 -8.250 -5.083 -6.722
10 HH11 ARG 65 HH11 ARG 65 -9.410 -7.119 -4.108
11 HH12 ARG 65 HH12 ARG 65 -10.377 -5.866 -3.402
12 HH21 ARG 65 HH21 ARG 65 -9.549 -3.461 -5.817
13 HH22 ARG 65 HH22 ARG 65 -10.457 -3.782 -4.372
No H/Q in entry = 13
In of MODEL 12
1 H GLU 66 H GLU 66 -4.921 -3.438 -6.381
2 HA GLU 66 HA GLU 66 -5.851 -3.361 -9.026
3 HB2 GLU 66 HB2 GLU 66 -4.834 -1.079 -7.328
4 HB3 GLU 66 HB3 GLU 66 -5.814 -0.920 -8.780
5 HG2 GLU 66 HG2 GLU 66 -6.632 -2.204 -6.184
6 HG3 GLU 66 HG3 GLU 66 -7.195 -0.663 -6.827
No H/Q in entry = 6
In of MODEL 12
1 H ILE 67 H ILE 67 -2.684 -2.507 -7.652
2 HA ILE 67 HA ILE 67 -1.552 -1.736 -10.154
3 HB ILE 67 HB ILE 67 -0.279 -2.582 -7.553
4 HG12 ILE 67 HG12 ILE 67 -0.518 0.074 -8.984
5 HG13 ILE 67 HG13 ILE 67 -1.432 -0.422 -7.564
6 HG21 ILE 67 HG21 ILE 67 1.226 -3.232 -9.369
7 HG22 ILE 67 HG22 ILE 67 1.120 -1.606 -10.047
8 HG23 ILE 67 HG23 ILE 67 1.875 -1.856 -8.473
9 HD11 ILE 67 HD11 ILE 67 0.636 -0.490 -6.267
10 HD12 ILE 67 HD12 ILE 67 1.541 0.015 -7.693
11 HD13 ILE 67 HD13 ILE 67 0.353 1.101 -6.974
No H/Q in entry = 11
In of MODEL 12
1 H LEU 68 H LEU 68 -1.625 -4.739 -8.319
2 HA LEU 68 HA LEU 68 -0.018 -6.275 -10.056
3 HB2 LEU 68 HB2 LEU 68 -0.699 -6.756 -7.655
4 HB3 LEU 68 HB3 LEU 68 -2.252 -7.263 -8.278
5 HG LEU 68 HG LEU 68 -0.369 -9.006 -7.729
6 HD11 LEU 68 HD11 LEU 68 -2.132 -9.104 -10.152
7 HD12 LEU 68 HD12 LEU 68 -1.308 -10.500 -9.456
8 HD13 LEU 68 HD13 LEU 68 -2.527 -9.632 -8.518
9 HD21 LEU 68 HD21 LEU 68 1.344 -7.997 -9.128
10 HD22 LEU 68 HD22 LEU 68 0.941 -9.617 -9.697
11 HD23 LEU 68 HD23 LEU 68 0.321 -8.203 -10.548
No H/Q in entry = 11
In of MODEL 12
1 H LYS 69 H LYS 69 -3.304 -5.233 -10.143
2 HA LYS 69 HA LYS 69 -4.134 -7.013 -12.196
3 HB2 LYS 69 HB2 LYS 69 -5.317 -4.444 -11.169
4 HB3 LYS 69 HB3 LYS 69 -6.011 -5.314 -12.532
5 HG2 LYS 69 HG2 LYS 69 -6.015 -7.344 -10.930
6 HG3 LYS 69 HG3 LYS 69 -5.835 -6.131 -9.661
7 HD2 LYS 69 HD2 LYS 69 -8.166 -6.589 -9.898
8 HD3 LYS 69 HD3 LYS 69 -7.868 -4.993 -10.588
9 HE2 LYS 69 HE2 LYS 69 -7.925 -5.882 -12.816
10 HE3 LYS 69 HE3 LYS 69 -8.001 -7.531 -12.207
11 HZ1 LYS 69 HZ1 LYS 69 -10.174 -7.006 -11.242
12 HZ2 LYS 69 HZ2 LYS 69 -10.097 -5.453 -11.897
13 HZ3 LYS 69 HZ3 LYS 69 -10.168 -6.798 -12.923
No H/Q in entry = 13
In of MODEL 12
1 H HIS 70 H HIS 70 -1.968 -4.524 -12.253
2 HA HIS 70 HA HIS 70 -2.554 -3.847 -15.043
3 HB2 HIS 70 HB2 HIS 70 -2.361 -1.844 -13.660
4 HB3 HIS 70 HB3 HIS 70 -0.825 -2.405 -13.011
5 HD1 HIS 70 HD1 HIS 70 -2.240 -0.383 -15.686
6 HD2 HIS 70 HD2 HIS 70 1.287 -2.487 -15.033
7 HE1 HIS 70 HE1 HIS 70 -0.618 0.481 -17.395
8 HE2 HIS 70 HE2 HIS 70 1.419 -0.971 -17.134
No H/Q in entry = 8
In of MODEL 12
1 H VAL 71 H VAL 71 0.029 -4.543 -12.745
2 HA VAL 71 HA VAL 71 2.033 -4.828 -14.667
3 HB VAL 71 HB VAL 71 2.589 -4.128 -12.468
4 HG11 VAL 71 HG11 VAL 71 1.533 -6.729 -11.504
5 HG12 VAL 71 HG12 VAL 71 2.431 -5.558 -10.530
6 HG13 VAL 71 HG13 VAL 71 0.866 -5.120 -11.229
7 HG21 VAL 71 HG21 VAL 71 3.675 -6.829 -13.099
8 HG22 VAL 71 HG22 VAL 71 4.379 -5.255 -13.463
9 HG23 VAL 71 HG23 VAL 71 4.290 -5.813 -11.795
No H/Q in entry = 9
In of MODEL 12
1 H VAL 72 H VAL 72 0.258 -7.326 -12.800
2 HA VAL 72 HA VAL 72 1.414 -9.287 -14.637
3 HB VAL 72 HB VAL 72 1.099 -9.525 -11.999
4 HG11 VAL 72 HG11 VAL 72 -1.443 -10.606 -13.134
5 HG12 VAL 72 HG12 VAL 72 -0.778 -11.116 -11.580
6 HG13 VAL 72 HG13 VAL 72 -1.235 -9.433 -11.834
7 HG21 VAL 72 HG21 VAL 72 0.923 -11.700 -14.036
8 HG22 VAL 72 HG22 VAL 72 2.379 -11.015 -13.321
9 HG23 VAL 72 HG23 VAL 72 1.269 -11.958 -12.328
No H/Q in entry = 9
In of MODEL 12
1 H GLY 73 H GLY 73 -1.268 -7.369 -14.288
2 HA2 GLY 73 HA2 GLY 73 -2.604 -8.657 -16.487
3 HA3 GLY 73 HA3 GLY 73 -3.071 -7.150 -15.713
No H/Q in entry = 3
In of MODEL 12
1 H GLU 74 H GLU 74 -5.242 -8.047 -15.934
2 HA GLU 74 HA GLU 74 -6.191 -9.212 -13.550
3 HB2 GLU 74 HB2 GLU 74 -7.518 -7.758 -15.096
4 HB3 GLU 74 HB3 GLU 74 -7.579 -9.093 -16.235
5 HG2 GLU 74 HG2 GLU 74 -8.864 -10.415 -14.713
6 HG3 GLU 74 HG3 GLU 74 -8.670 -9.213 -13.437
No H/Q in entry = 6
In of MODEL 12
1 H GLU 75 H GLU 75 -5.114 -10.477 -16.575
2 HA GLU 75 HA GLU 75 -5.973 -13.077 -16.694
3 HB2 GLU 75 HB2 GLU 75 -4.561 -12.190 -18.390
4 HB3 GLU 75 HB3 GLU 75 -3.265 -11.879 -17.245
5 HG2 GLU 75 HG2 GLU 75 -2.925 -14.265 -16.948
6 HG3 GLU 75 HG3 GLU 75 -4.258 -14.603 -18.052
No H/Q in entry = 6
In of MODEL 12
1 H LYS 76 H LYS 76 -2.932 -12.148 -15.029
2 HA LYS 76 HA LYS 76 -2.742 -14.812 -14.001
3 HB2 LYS 76 HB2 LYS 76 -0.999 -12.406 -13.437
4 HB3 LYS 76 HB3 LYS 76 -0.627 -14.079 -13.076
5 HG2 LYS 76 HG2 LYS 76 -0.950 -12.886 -15.810
6 HG3 LYS 76 HG3 LYS 76 0.558 -13.392 -15.052
7 HD2 LYS 76 HD2 LYS 76 -1.745 -15.232 -15.698
8 HD3 LYS 76 HD3 LYS 76 -0.313 -15.024 -16.703
9 HE2 LYS 76 HE2 LYS 76 1.083 -15.801 -14.835
10 HE3 LYS 76 HE3 LYS 76 -0.368 -16.046 -13.868
11 HZ1 LYS 76 HZ1 LYS 76 0.171 -17.409 -16.447
12 HZ2 LYS 76 HZ2 LYS 76 0.451 -18.099 -14.929
13 HZ3 LYS 76 HZ3 LYS 76 -1.129 -17.701 -15.402
No H/Q in entry = 13
In of MODEL 12
1 H ALA 77 H ALA 77 -3.630 -11.661 -12.762
2 HA ALA 77 HA ALA 77 -3.644 -12.298 -10.018
3 HB1 ALA 77 HB1 ALA 77 -5.088 -10.364 -9.753
4 HB2 ALA 77 HB2 ALA 77 -5.446 -10.358 -11.481
5 HB3 ALA 77 HB3 ALA 77 -3.815 -9.995 -10.916
No H/Q in entry = 5
In of MODEL 12
1 H ALA 78 H ALA 78 -5.963 -12.796 -12.608
2 HA ALA 78 HA ALA 78 -8.162 -13.640 -11.085
3 HB1 ALA 78 HB1 ALA 78 -8.785 -14.868 -13.220
4 HB2 ALA 78 HB2 ALA 78 -8.520 -13.130 -13.370
5 HB3 ALA 78 HB3 ALA 78 -7.271 -14.260 -13.899
No H/Q in entry = 5
In of MODEL 12
1 H GLU 79 H GLU 79 -5.320 -15.315 -12.281
2 HA GLU 79 HA GLU 79 -6.289 -17.919 -11.541
3 HB2 GLU 79 HB2 GLU 79 -3.449 -17.165 -12.228
4 HB3 GLU 79 HB3 GLU 79 -4.199 -18.751 -12.347
5 HG2 GLU 79 HG2 GLU 79 -5.756 -17.711 -14.058
6 HG3 GLU 79 HG3 GLU 79 -4.645 -16.343 -14.072
No H/Q in entry = 6
In of MODEL 12
1 H LEU 80 H LEU 80 -4.223 -15.467 -10.119
2 HA LEU 80 HA LEU 80 -3.364 -17.078 -7.938
3 HB2 LEU 80 HB2 LEU 80 -3.504 -14.080 -8.243
4 HB3 LEU 80 HB3 LEU 80 -2.627 -14.933 -6.984
5 HG LEU 80 HG LEU 80 -2.037 -15.302 -9.913
6 HD11 LEU 80 HD11 LEU 80 -0.759 -13.409 -7.957
7 HD12 LEU 80 HD12 LEU 80 -0.114 -13.814 -9.550
8 HD13 LEU 80 HD13 LEU 80 -1.669 -12.989 -9.411
9 HD21 LEU 80 HD21 LEU 80 -1.312 -17.093 -8.444
10 HD22 LEU 80 HD22 LEU 80 0.069 -16.194 -9.075
11 HD23 LEU 80 HD23 LEU 80 -0.475 -15.928 -7.419
No H/Q in entry = 11
In of MODEL 12
1 H LYS 81 H LYS 81 -6.093 -14.991 -8.560
2 HA LYS 81 HA LYS 81 -7.127 -14.860 -5.948
3 HB2 LYS 81 HB2 LYS 81 -7.824 -13.642 -8.177
4 HB3 LYS 81 HB3 LYS 81 -8.906 -15.011 -8.363
5 HG2 LYS 81 HG2 LYS 81 -8.877 -13.127 -6.014
6 HG3 LYS 81 HG3 LYS 81 -10.003 -13.059 -7.365
7 HD2 LYS 81 HD2 LYS 81 -10.742 -15.368 -6.765
8 HD3 LYS 81 HD3 LYS 81 -9.722 -15.265 -5.327
9 HE2 LYS 81 HE2 LYS 81 -11.976 -14.709 -4.709
10 HE3 LYS 81 HE3 LYS 81 -10.994 -13.248 -4.637
11 HZ1 LYS 81 HZ1 LYS 81 -11.866 -12.609 -6.808
12 HZ2 LYS 81 HZ2 LYS 81 -12.819 -14.007 -6.851
13 HZ3 LYS 81 HZ3 LYS 81 -13.115 -12.817 -5.689
No H/Q in entry = 13
In of MODEL 12
1 H ASN 82 H ASN 82 -7.893 -17.061 -8.656
2 HA ASN 82 HA ASN 82 -9.587 -18.714 -7.108
3 HB2 ASN 82 HB2 ASN 82 -9.651 -18.662 -9.602
4 HB3 ASN 82 HB3 ASN 82 -8.068 -19.420 -9.638
5 HD21 ASN 82 HD21 ASN 82 -11.438 -19.879 -8.878
6 HD22 ASN 82 HD22 ASN 82 -11.401 -21.610 -8.874
No H/Q in entry = 6
In of MODEL 12
1 H LEU 83 H LEU 83 -6.113 -18.921 -7.899
2 HA LEU 83 HA LEU 83 -5.599 -21.409 -6.843
3 HB2 LEU 83 HB2 LEU 83 -4.061 -18.893 -7.159
4 HB3 LEU 83 HB3 LEU 83 -3.389 -20.130 -6.138
5 HG LEU 83 HG LEU 83 -4.166 -20.545 -9.018
6 HD11 LEU 83 HD11 LEU 83 -1.452 -20.090 -7.789
7 HD12 LEU 83 HD12 LEU 83 -1.755 -20.549 -9.466
8 HD13 LEU 83 HD13 LEU 83 -2.315 -18.990 -8.864
9 HD21 LEU 83 HD21 LEU 83 -2.647 -22.285 -7.078
10 HD22 LEU 83 HD22 LEU 83 -4.247 -22.603 -7.745
11 HD23 LEU 83 HD23 LEU 83 -2.835 -22.610 -8.799
No H/Q in entry = 11
In of MODEL 12
1 H LYS 84 H LYS 84 -5.853 -18.286 -5.177
2 HA LYS 84 HA LYS 84 -5.061 -19.199 -2.633
3 HB2 LYS 84 HB2 LYS 84 -5.236 -16.797 -3.332
4 HB3 LYS 84 HB3 LYS 84 -6.985 -16.940 -3.214
5 HG2 LYS 84 HG2 LYS 84 -6.820 -17.433 -0.850
6 HG3 LYS 84 HG3 LYS 84 -5.060 -17.400 -0.942
7 HD2 LYS 84 HD2 LYS 84 -5.848 -15.317 -0.024
8 HD3 LYS 84 HD3 LYS 84 -5.180 -15.027 -1.630
9 HE2 LYS 84 HE2 LYS 84 -7.418 -14.984 -2.575
10 HE3 LYS 84 HE3 LYS 84 -8.109 -15.354 -0.997
11 HZ1 LYS 84 HZ1 LYS 84 -6.560 -12.912 -1.659
12 HZ2 LYS 84 HZ2 LYS 84 -8.240 -12.998 -1.510
13 HZ3 LYS 84 HZ3 LYS 84 -7.263 -13.265 -0.163
No H/Q in entry = 13
In of MODEL 12
1 H ASP 85 H ASP 85 -8.342 -18.610 -3.919
2 HA ASP 85 HA ASP 85 -9.699 -19.659 -1.683
3 HB2 ASP 85 HB2 ASP 85 -10.537 -19.105 -4.519
4 HB3 ASP 85 HB3 ASP 85 -11.653 -19.805 -3.352
No H/Q in entry = 4
In of MODEL 12
1 H SER 86 H SER 86 -8.315 -21.222 -4.463
2 HA SER 86 HA SER 86 -9.743 -23.688 -4.028
3 HB2 SER 86 HB2 SER 86 -8.921 -22.954 -6.279
4 HB3 SER 86 HB3 SER 86 -7.273 -23.223 -5.714
5 HG SER 86 HG SER 86 -8.146 -25.441 -5.187
No H/Q in entry = 5
In of MODEL 12
1 H GLY 87 H GLY 87 -7.132 -22.188 -2.544
2 HA2 GLY 87 HA2 GLY 87 -6.643 -24.718 -1.109
3 HA3 GLY 87 HA3 GLY 87 -6.524 -23.119 -0.395
No H/Q in entry = 3
In of MODEL 12
1 H ALA 88 H ALA 88 -5.063 -22.446 -3.129
2 HA ALA 88 HA ALA 88 -2.509 -23.582 -2.847
3 HB1 ALA 88 HB1 ALA 88 -3.206 -20.782 -3.737
4 HB2 ALA 88 HB2 ALA 88 -3.080 -22.201 -4.777
5 HB3 ALA 88 HB3 ALA 88 -1.648 -21.574 -3.964
No H/Q in entry = 5
In of MODEL 12
1 H SER 89 H SER 89 -1.177 -23.425 -1.224
2 HA SER 89 HA SER 89 -1.685 -22.090 1.172
3 HB2 SER 89 HB2 SER 89 1.036 -23.041 0.304
4 HB3 SER 89 HB3 SER 89 0.324 -23.059 1.913
5 HG SER 89 HG SER 89 0.034 -25.094 1.302
No H/Q in entry = 5
In of MODEL 12
1 H LYS 90 H LYS 90 0.057 -20.624 2.225
2 HA LYS 90 HA LYS 90 0.093 -18.191 0.821
3 HB2 LYS 90 HB2 LYS 90 0.292 -18.672 3.365
4 HB3 LYS 90 HB3 LYS 90 2.015 -18.820 3.047
5 HG2 LYS 90 HG2 LYS 90 1.552 -16.601 3.813
6 HG3 LYS 90 HG3 LYS 90 1.989 -16.533 2.107
7 HD2 LYS 90 HD2 LYS 90 -0.349 -16.358 1.483
8 HD3 LYS 90 HD3 LYS 90 -0.833 -16.523 3.172
9 HE2 LYS 90 HE2 LYS 90 0.346 -14.440 3.700
10 HE3 LYS 90 HE3 LYS 90 0.810 -14.279 2.009
11 HZ1 LYS 90 HZ1 LYS 90 -1.543 -14.158 1.428
12 HZ2 LYS 90 HZ2 LYS 90 -1.964 -14.276 3.056
13 HZ3 LYS 90 HZ3 LYS 90 -1.113 -12.925 2.504
No H/Q in entry = 13
In of MODEL 12
1 H GLU 91 H GLU 91 2.400 -20.802 1.077
2 HA GLU 91 HA GLU 91 4.602 -19.492 -0.104
3 HB2 GLU 91 HB2 GLU 91 3.863 -22.375 0.237
4 HB3 GLU 91 HB3 GLU 91 5.308 -21.902 -0.646
5 HG2 GLU 91 HG2 GLU 91 4.665 -21.298 2.224
6 HG3 GLU 91 HG3 GLU 91 5.892 -22.394 1.608
No H/Q in entry = 6
In of MODEL 12
1 H GLU 92 H GLU 92 2.080 -21.532 -1.459
2 HA GLU 92 HA GLU 92 2.815 -21.648 -4.107
3 HB2 GLU 92 HB2 GLU 92 0.042 -21.437 -2.942
4 HB3 GLU 92 HB3 GLU 92 0.451 -22.054 -4.531
5 HG2 GLU 92 HG2 GLU 92 1.424 -23.261 -1.975
6 HG3 GLU 92 HG3 GLU 92 -0.027 -23.770 -2.824
No H/Q in entry = 6
In of MODEL 12
1 H LEU 93 H LEU 93 0.922 -19.204 -2.367
2 HA LEU 93 HA LEU 93 0.646 -17.553 -4.686
3 HB2 LEU 93 HB2 LEU 93 0.405 -16.861 -1.760
4 HB3 LEU 93 HB3 LEU 93 0.082 -15.726 -3.058
5 HG LEU 93 HG LEU 93 -1.602 -17.872 -1.991
6 HD11 LEU 93 HD11 LEU 93 -2.132 -15.465 -3.711
7 HD12 LEU 93 HD12 LEU 93 -3.355 -16.459 -2.917
8 HD13 LEU 93 HD13 LEU 93 -2.213 -15.527 -1.948
9 HD21 LEU 93 HD21 LEU 93 -0.971 -18.972 -4.087
10 HD22 LEU 93 HD22 LEU 93 -2.660 -18.459 -4.105
11 HD23 LEU 93 HD23 LEU 93 -1.445 -17.530 -4.985
No H/Q in entry = 11
In of MODEL 12
1 H LYS 94 H LYS 94 3.125 -17.900 -2.209
2 HA LYS 94 HA LYS 94 4.348 -15.396 -2.826
3 HB2 LYS 94 HB2 LYS 94 4.573 -16.499 -0.629
4 HB3 LYS 94 HB3 LYS 94 5.491 -17.792 -1.381
5 HG2 LYS 94 HG2 LYS 94 7.249 -16.247 -1.979
6 HG3 LYS 94 HG3 LYS 94 6.322 -14.899 -1.321
7 HD2 LYS 94 HD2 LYS 94 6.498 -15.775 0.900
8 HD3 LYS 94 HD3 LYS 94 7.211 -17.276 0.306
9 HE2 LYS 94 HE2 LYS 94 8.469 -14.559 -0.016
10 HE3 LYS 94 HE3 LYS 94 8.845 -15.668 1.301
11 HZ1 LYS 94 HZ1 LYS 94 9.181 -16.305 -1.581
12 HZ2 LYS 94 HZ2 LYS 94 10.429 -15.803 -0.559
13 HZ3 LYS 94 HZ3 LYS 94 9.641 -17.271 -0.273
No H/Q in entry = 13
In of MODEL 12
1 H ALA 95 H ALA 95 4.709 -18.673 -3.870
2 HA ALA 95 HA ALA 95 7.080 -17.980 -5.357
3 HB1 ALA 95 HB1 ALA 95 7.065 -20.129 -4.202
4 HB2 ALA 95 HB2 ALA 95 7.175 -20.387 -5.944
5 HB3 ALA 95 HB3 ALA 95 5.636 -20.630 -5.111
No H/Q in entry = 5
In of MODEL 12
1 H LYS 96 H LYS 96 3.865 -19.349 -6.102
2 HA LYS 96 HA LYS 96 3.974 -19.338 -8.885
3 HB2 LYS 96 HB2 LYS 96 1.994 -19.792 -7.106
4 HB3 LYS 96 HB3 LYS 96 1.488 -18.232 -7.726
5 HG2 LYS 96 HG2 LYS 96 1.966 -20.723 -9.340
6 HG3 LYS 96 HG3 LYS 96 0.405 -20.013 -8.937
7 HD2 LYS 96 HD2 LYS 96 1.295 -17.916 -10.130
8 HD3 LYS 96 HD3 LYS 96 2.515 -18.995 -10.802
9 HE2 LYS 96 HE2 LYS 96 -0.473 -19.302 -11.067
10 HE3 LYS 96 HE3 LYS 96 0.643 -18.782 -12.331
11 HZ1 LYS 96 HZ1 LYS 96 0.657 -21.443 -11.007
12 HZ2 LYS 96 HZ2 LYS 96 0.076 -21.119 -12.559
13 HZ3 LYS 96 HZ3 LYS 96 1.723 -20.939 -12.221
No H/Q in entry = 13
In of MODEL 12
1 H VAL 97 H VAL 97 3.053 -16.661 -6.764
2 HA VAL 97 HA VAL 97 2.605 -14.632 -8.511
3 HB VAL 97 HB VAL 97 2.692 -14.697 -5.893
4 HG11 VAL 97 HG11 VAL 97 5.212 -13.364 -6.715
5 HG12 VAL 97 HG12 VAL 97 4.483 -13.198 -5.115
6 HG13 VAL 97 HG13 VAL 97 5.032 -14.777 -5.681
7 HG21 VAL 97 HG21 VAL 97 1.558 -13.015 -7.264
8 HG22 VAL 97 HG22 VAL 97 2.393 -12.285 -5.892
9 HG23 VAL 97 HG23 VAL 97 3.098 -12.189 -7.505
No H/Q in entry = 9
In of MODEL 12
1 H GLU 98 H GLU 98 5.757 -15.806 -7.551
2 HA GLU 98 HA GLU 98 7.187 -13.683 -8.781
3 HB2 GLU 98 HB2 GLU 98 8.030 -16.411 -7.832
4 HB3 GLU 98 HB3 GLU 98 9.157 -15.234 -8.504
5 HG2 GLU 98 HG2 GLU 98 7.360 -14.550 -6.200
6 HG3 GLU 98 HG3 GLU 98 8.912 -15.364 -5.960
No H/Q in entry = 6
In of MODEL 12
1 H GLU 99 H GLU 99 6.092 -16.826 -9.875
2 HA GLU 99 HA GLU 99 7.544 -16.901 -12.303
3 HB2 GLU 99 HB2 GLU 99 4.838 -18.078 -11.626
4 HB3 GLU 99 HB3 GLU 99 5.793 -18.491 -13.042
5 HG2 GLU 99 HG2 GLU 99 6.634 -18.936 -10.188
6 HG3 GLU 99 HG3 GLU 99 5.970 -20.165 -11.264
No H/Q in entry = 6
In of MODEL 12
1 H ALA 100 H ALA 100 4.401 -15.588 -11.404
2 HA ALA 100 HA ALA 100 3.753 -14.718 -14.043
3 HB1 ALA 100 HB1 ALA 100 2.558 -13.832 -11.424
4 HB2 ALA 100 HB2 ALA 100 2.083 -15.284 -12.305
5 HB3 ALA 100 HB3 ALA 100 1.835 -13.694 -13.026
No H/Q in entry = 5
In of MODEL 12
1 H LEU 101 H LEU 101 4.975 -13.099 -11.119
2 HA LEU 101 HA LEU 101 5.133 -10.510 -12.218
3 HB2 LEU 101 HB2 LEU 101 6.295 -11.901 -9.861
4 HB3 LEU 101 HB3 LEU 101 6.956 -10.348 -10.319
5 HG LEU 101 HG LEU 101 5.129 -10.407 -8.525
6 HD11 LEU 101 HD11 LEU 101 5.934 -8.355 -9.562
7 HD12 LEU 101 HD12 LEU 101 4.829 -8.596 -10.915
8 HD13 LEU 101 HD13 LEU 101 4.191 -8.282 -9.301
9 HD21 LEU 101 HD21 LEU 101 3.578 -11.889 -9.713
10 HD22 LEU 101 HD22 LEU 101 2.839 -10.340 -9.306
11 HD23 LEU 101 HD23 LEU 101 3.370 -10.655 -10.958
No H/Q in entry = 11
In of MODEL 12
1 H HIS 102 H HIS 102 7.123 -13.269 -12.676
2 HA HIS 102 HA HIS 102 9.260 -11.647 -13.789
3 HB2 HIS 102 HB2 HIS 102 8.869 -14.620 -13.522
4 HB3 HIS 102 HB3 HIS 102 10.187 -13.931 -14.468
5 HD1 HIS 102 HD1 HIS 102 10.939 -15.636 -12.093
6 HD2 HIS 102 HD2 HIS 102 10.285 -11.538 -11.816
7 HE1 HIS 102 HE1 HIS 102 12.170 -14.892 -10.030
8 HE2 HIS 102 HE2 HIS 102 11.647 -12.436 -9.809
No H/Q in entry = 8
In of MODEL 12
1 H ALA 103 H ALA 103 6.684 -13.827 -14.878
2 HA ALA 103 HA ALA 103 7.476 -13.930 -17.564
3 HB1 ALA 103 HB1 ALA 103 4.707 -14.372 -16.484
4 HB2 ALA 103 HB2 ALA 103 6.012 -15.556 -16.391
5 HB3 ALA 103 HB3 ALA 103 5.400 -15.034 -17.964
No H/Q in entry = 5
In of MODEL 12
1 H VAL 104 H VAL 104 6.301 -11.212 -16.024
2 HA VAL 104 HA VAL 104 4.435 -10.358 -17.968
3 HB VAL 104 HB VAL 104 3.961 -9.467 -15.940
4 HG11 VAL 104 HG11 VAL 104 6.872 -8.919 -15.504
5 HG12 VAL 104 HG12 VAL 104 5.577 -8.517 -14.379
6 HG13 VAL 104 HG13 VAL 104 5.908 -10.201 -14.773
7 HG21 VAL 104 HG21 VAL 104 4.081 -7.649 -17.611
8 HG22 VAL 104 HG22 VAL 104 4.351 -7.089 -15.961
9 HG23 VAL 104 HG23 VAL 104 5.716 -7.299 -17.054
No H/Q in entry = 9
In of MODEL 12
1 H THR 105 H THR 105 7.367 -8.631 -17.004
2 HA THR 105 HA THR 105 9.168 -7.877 -18.106
3 HB THR 105 HB THR 105 9.922 -8.820 -20.172
4 HG1 THR 105 HG1 THR 105 7.219 -9.567 -20.483
5 HG21 THR 105 HG21 THR 105 8.520 -10.906 -18.504
6 HG22 THR 105 HG22 THR 105 9.826 -11.220 -19.651
7 HG23 THR 105 HG23 THR 105 10.129 -10.242 -18.214
No H/Q in entry = 7
In of MODEL 12
1 H ASP 106 H ASP 106 6.159 -6.860 -18.803
2 HA ASP 106 HA ASP 106 6.907 -5.058 -20.928
3 HB2 ASP 106 HB2 ASP 106 4.474 -5.007 -19.140
4 HB3 ASP 106 HB3 ASP 106 4.702 -4.061 -20.593
No H/Q in entry = 4
In of MODEL 12
1 H GLU 107 H GLU 107 7.287 -2.865 -20.727
2 HA GLU 107 HA GLU 107 9.121 -2.398 -18.699
3 HB2 GLU 107 HB2 GLU 107 9.253 -0.079 -19.628
4 HB3 GLU 107 HB3 GLU 107 9.468 -1.369 -20.794
5 HG2 GLU 107 HG2 GLU 107 7.172 -1.061 -21.564
6 HG3 GLU 107 HG3 GLU 107 6.953 0.230 -20.382
No H/Q in entry = 6
In of MODEL 12
1 H GLU 108 H GLU 108 6.038 -0.645 -19.155
2 HA GLU 108 HA GLU 108 6.266 0.962 -16.871
3 HB2 GLU 108 HB2 GLU 108 4.660 1.358 -18.722
4 HB3 GLU 108 HB3 GLU 108 3.736 -0.040 -18.198
5 HG2 GLU 108 HG2 GLU 108 2.594 1.815 -17.351
6 HG3 GLU 108 HG3 GLU 108 3.466 1.140 -15.976
No H/Q in entry = 6
In of MODEL 12
1 H LYS 109 H LYS 109 4.940 -2.243 -17.350
2 HA LYS 109 HA LYS 109 3.772 -2.581 -14.811
3 HB2 LYS 109 HB2 LYS 109 4.896 -4.640 -16.714
4 HB3 LYS 109 HB3 LYS 109 3.845 -4.989 -15.352
5 HG2 LYS 109 HG2 LYS 109 2.078 -3.635 -16.383
6 HG3 LYS 109 HG3 LYS 109 3.133 -3.348 -17.767
7 HD2 LYS 109 HD2 LYS 109 3.246 -5.859 -18.038
8 HD3 LYS 109 HD3 LYS 109 1.961 -5.958 -16.837
9 HE2 LYS 109 HE2 LYS 109 0.464 -4.741 -18.235
10 HE3 LYS 109 HE3 LYS 109 1.749 -4.363 -19.379
11 HZ1 LYS 109 HZ1 LYS 109 0.712 -7.082 -18.799
12 HZ2 LYS 109 HZ2 LYS 109 0.344 -6.165 -20.170
13 HZ3 LYS 109 HZ3 LYS 109 1.930 -6.706 -19.913
No H/Q in entry = 13
In of MODEL 12
1 H LYS 110 H LYS 110 6.986 -3.429 -16.075
2 HA LYS 110 HA LYS 110 7.942 -4.575 -13.665
3 HB2 LYS 110 HB2 LYS 110 9.441 -3.355 -15.978
4 HB3 LYS 110 HB3 LYS 110 10.210 -4.213 -14.657
5 HG2 LYS 110 HG2 LYS 110 8.882 -6.227 -15.300
6 HG3 LYS 110 HG3 LYS 110 8.341 -5.332 -16.726
7 HD2 LYS 110 HD2 LYS 110 11.224 -5.867 -16.008
8 HD3 LYS 110 HD3 LYS 110 10.296 -6.790 -17.184
9 HE2 LYS 110 HE2 LYS 110 10.012 -4.813 -18.559
10 HE3 LYS 110 HE3 LYS 110 10.831 -3.826 -17.351
11 HZ1 LYS 110 HZ1 LYS 110 12.068 -6.055 -18.870
12 HZ2 LYS 110 HZ2 LYS 110 12.298 -4.413 -19.183
13 HZ3 LYS 110 HZ3 LYS 110 12.851 -5.084 -17.733
No H/Q in entry = 13
In of MODEL 12
1 H GLN 111 H GLN 111 7.593 -1.320 -14.705
2 HA GLN 111 HA GLN 111 9.342 -0.105 -12.844
3 HB2 GLN 111 HB2 GLN 111 6.771 0.879 -14.088
4 HB3 GLN 111 HB3 GLN 111 7.769 1.870 -13.034
5 HG2 GLN 111 HG2 GLN 111 8.649 0.655 -15.644
6 HG3 GLN 111 HG3 GLN 111 8.176 2.337 -15.397
7 HE21 GLN 111 HE21 GLN 111 10.622 -0.065 -14.860
8 HE22 GLN 111 HE22 GLN 111 11.860 1.019 -14.334
No H/Q in entry = 8
In of MODEL 12
1 H TYR 112 H TYR 112 6.028 -1.294 -12.602
2 HA TYR 112 HA TYR 112 5.636 -0.424 -9.892
3 HB2 TYR 112 HB2 TYR 112 4.190 -2.565 -11.467
4 HB3 TYR 112 HB3 TYR 112 3.676 -1.914 -9.913
5 HD1 TYR 112 HD1 TYR 112 3.908 0.902 -10.098
6 HD2 TYR 112 HD2 TYR 112 2.795 -1.843 -13.151
7 HE1 TYR 112 HE1 TYR 112 2.645 2.682 -11.238
8 HE2 TYR 112 HE2 TYR 112 1.539 -0.069 -14.302
9 HH TYR 112 HH TYR 112 0.449 2.066 -13.752
No H/Q in entry = 9
In of MODEL 12
1 H ILE 113 H ILE 113 6.913 -3.294 -11.447
2 HA ILE 113 HA ILE 113 7.018 -4.949 -9.183
3 HB ILE 113 HB ILE 113 8.873 -4.883 -11.563
4 HG12 ILE 113 HG12 ILE 113 6.403 -6.517 -10.942
5 HG13 ILE 113 HG13 ILE 113 6.538 -5.254 -12.161
6 HG21 ILE 113 HG21 ILE 113 8.466 -7.031 -9.483
7 HG22 ILE 113 HG22 ILE 113 9.434 -7.194 -10.948
8 HG23 ILE 113 HG23 ILE 113 9.915 -6.046 -9.696
9 HD11 ILE 113 HD11 ILE 113 8.159 -6.611 -13.377
10 HD12 ILE 113 HD12 ILE 113 8.006 -7.874 -12.158
11 HD13 ILE 113 HD13 ILE 113 6.626 -7.452 -13.166
No H/Q in entry = 11
In of MODEL 12
1 H ALA 114 H ALA 114 9.376 -2.632 -10.500
2 HA ALA 114 HA ALA 114 11.325 -3.073 -8.426
3 HB1 ALA 114 HB1 ALA 114 12.003 -2.410 -10.667
4 HB2 ALA 114 HB2 ALA 114 12.516 -1.205 -9.485
5 HB3 ALA 114 HB3 ALA 114 11.108 -0.896 -10.509
No H/Q in entry = 5
In of MODEL 12
1 H ASP 115 H ASP 115 8.905 -0.587 -9.126
2 HA ASP 115 HA ASP 115 9.848 1.116 -7.005
3 HB2 ASP 115 HB2 ASP 115 8.782 1.957 -9.112
4 HB3 ASP 115 HB3 ASP 115 7.246 1.321 -8.535
No H/Q in entry = 4
In of MODEL 12
1 H PHE 116 H PHE 116 6.923 -0.798 -7.521
2 HA PHE 116 HA PHE 116 6.200 -0.255 -4.747
3 HB2 PHE 116 HB2 PHE 116 4.507 0.484 -6.251
4 HB3 PHE 116 HB3 PHE 116 4.549 -1.025 -7.149
5 HD1 PHE 116 HD1 PHE 116 3.779 0.313 -3.767
6 HD2 PHE 116 HD2 PHE 116 3.010 -2.624 -6.739
7 HE1 PHE 116 HE1 PHE 116 1.919 -0.555 -2.408
8 HE2 PHE 116 HE2 PHE 116 1.144 -3.509 -5.384
9 HZ PHE 116 HZ PHE 116 0.602 -2.469 -3.217
No H/Q in entry = 9
In of MODEL 12
1 H GLY 117 H GLY 117 7.269 -2.768 -6.764
2 HA2 GLY 117 HA2 GLY 117 7.608 -5.010 -6.451
3 HA3 GLY 117 HA3 GLY 117 5.951 -5.024 -5.885
No H/Q in entry = 3
In of MODEL 12
1 HA PRO 118 HA PRO 118 9.506 -5.960 -2.597
2 HB2 PRO 118 HB2 PRO 118 10.186 -3.109 -2.038
3 HB3 PRO 118 HB3 PRO 118 11.219 -4.543 -1.982
4 HG2 PRO 118 HG2 PRO 118 11.374 -2.867 -4.032
5 HG3 PRO 118 HG3 PRO 118 11.468 -4.619 -4.289
6 HD2 PRO 118 HD2 PRO 118 9.218 -2.742 -4.833
7 HD3 PRO 118 HD3 PRO 118 9.715 -4.198 -5.717
No H/Q in entry = 7
In of MODEL 12
1 H ALA 119 H ALA 119 7.700 -2.917 -2.287
2 HA ALA 119 HA ALA 119 7.171 -3.309 0.511
3 HB1 ALA 119 HB1 ALA 119 5.767 -1.318 0.291
4 HB2 ALA 119 HB2 ALA 119 5.987 -1.363 -1.458
5 HB3 ALA 119 HB3 ALA 119 7.370 -1.074 -0.404
No H/Q in entry = 5
In of MODEL 12
1 H CYS 120 H CYS 120 5.392 -3.803 -2.499
2 HA CYS 120 HA CYS 120 2.916 -4.555 -1.474
3 HB2 CYS 120 HB2 CYS 120 3.281 -4.273 -3.854
4 HB3 CYS 120 HB3 CYS 120 4.437 -5.599 -3.872
No H/Q in entry = 4
In of MODEL 12
1 H LYS 121 H LYS 121 5.967 -6.261 -1.552
2 HA LYS 121 HA LYS 121 5.046 -8.867 -1.081
3 HB2 LYS 121 HB2 LYS 121 7.634 -7.672 -0.082
4 HB3 LYS 121 HB3 LYS 121 7.295 -9.376 -0.345
5 HG2 LYS 121 HG2 LYS 121 7.423 -7.251 -2.477
6 HG3 LYS 121 HG3 LYS 121 8.665 -8.455 -2.135
7 HD2 LYS 121 HD2 LYS 121 5.848 -9.206 -2.883
8 HD3 LYS 121 HD3 LYS 121 7.108 -8.934 -4.085
9 HE2 LYS 121 HE2 LYS 121 7.244 -10.939 -1.837
10 HE3 LYS 121 HE3 LYS 121 6.848 -11.314 -3.513
11 HZ1 LYS 121 HZ1 LYS 121 9.042 -10.424 -4.141
12 HZ2 LYS 121 HZ2 LYS 121 9.418 -10.229 -2.503
13 HZ3 LYS 121 HZ3 LYS 121 9.148 -11.774 -3.132
No H/Q in entry = 13
In of MODEL 12
1 H LYS 122 H LYS 122 6.144 -6.412 1.323
2 HA LYS 122 HA LYS 122 5.385 -8.001 3.547
3 HB2 LYS 122 HB2 LYS 122 5.665 -6.066 4.918
4 HB3 LYS 122 HB3 LYS 122 6.917 -6.022 3.691
5 HG2 LYS 122 HG2 LYS 122 5.797 -4.300 2.496
6 HG3 LYS 122 HG3 LYS 122 4.356 -4.462 3.501
7 HD2 LYS 122 HD2 LYS 122 5.582 -2.530 4.230
8 HD3 LYS 122 HD3 LYS 122 5.717 -3.777 5.466
9 HE2 LYS 122 HE2 LYS 122 7.928 -4.398 4.482
10 HE3 LYS 122 HE3 LYS 122 7.789 -3.000 3.420
11 HZ1 LYS 122 HZ1 LYS 122 7.580 -1.626 5.476
12 HZ2 LYS 122 HZ2 LYS 122 7.967 -3.002 6.377
13 HZ3 LYS 122 HZ3 LYS 122 9.087 -2.369 5.283
No H/Q in entry = 13
In of MODEL 12
1 H ILE 123 H ILE 123 3.611 -5.958 1.365
2 HA ILE 123 HA ILE 123 1.358 -5.504 2.991
3 HB ILE 123 HB ILE 123 1.634 -5.504 0.010
4 HG12 ILE 123 HG12 ILE 123 1.387 -3.335 2.103
5 HG13 ILE 123 HG13 ILE 123 2.849 -3.760 1.215
6 HG21 ILE 123 HG21 ILE 123 -0.748 -4.786 1.714
7 HG22 ILE 123 HG22 ILE 123 -0.573 -4.354 0.011
8 HG23 ILE 123 HG23 ILE 123 -0.659 -6.051 0.487
9 HD11 ILE 123 HD11 ILE 123 0.334 -2.713 -0.035
10 HD12 ILE 123 HD12 ILE 123 1.737 -1.733 0.386
11 HD13 ILE 123 HD13 ILE 123 1.877 -2.999 -0.834
No H/Q in entry = 11
In of MODEL 12
1 H TYR 124 H TYR 124 1.937 -7.839 0.478
2 HA TYR 124 HA TYR 124 -0.291 -9.548 1.118
3 HB2 TYR 124 HB2 TYR 124 1.864 -9.496 -0.922
4 HB3 TYR 124 HB3 TYR 124 1.210 -11.078 -0.504
5 HD1 TYR 124 HD1 TYR 124 0.088 -7.652 -1.485
6 HD2 TYR 124 HD2 TYR 124 -0.692 -11.832 -1.583
7 HE1 TYR 124 HE1 TYR 124 -1.837 -7.256 -2.963
8 HE2 TYR 124 HE2 TYR 124 -2.617 -11.445 -3.062
9 HH TYR 124 HH TYR 124 -3.165 -8.511 -4.638
No H/Q in entry = 9
In of MODEL 12
1 H GLY 125 H GLY 125 1.405 -9.068 3.270
2 HA2 GLY 125 HA2 GLY 125 2.826 -9.999 4.873
3 HA3 GLY 125 HA3 GLY 125 3.896 -9.522 3.587
No H/Q in entry = 3
In of MODEL 12
1 H VAL 126 H VAL 126 3.003 -11.843 1.935
2 HA VAL 126 HA VAL 126 3.746 -14.294 2.841
3 HB VAL 126 HB VAL 126 4.916 -14.607 0.592
4 HG11 VAL 126 HG11 VAL 126 2.118 -13.486 0.607
5 HG12 VAL 126 HG12 VAL 126 2.825 -14.472 -0.674
6 HG13 VAL 126 HG13 VAL 126 2.572 -15.159 0.928
7 HG21 VAL 126 HG21 VAL 126 5.636 -12.296 0.245
8 HG22 VAL 126 HG22 VAL 126 4.593 -12.835 -1.073
9 HG23 VAL 126 HG23 VAL 126 3.954 -11.774 0.182
No H/Q in entry = 9
In of MODEL 12
1 H HIS 127 H HIS 127 5.172 -14.308 4.521
2 HA HIS 127 HA HIS 127 7.903 -14.535 4.218
3 HB2 HIS 127 HB2 HIS 127 7.727 -12.058 3.644
4 HB3 HIS 127 HB3 HIS 127 7.195 -11.786 5.296
5 HD1 HIS 127 HD1 HIS 127 10.226 -12.773 3.302
6 HD2 HIS 127 HD2 HIS 127 9.210 -11.752 7.198
7 HE1 HIS 127 HE1 HIS 127 12.405 -12.452 4.505
8 HE2 HIS 127 HE2 HIS 127 11.758 -12.059 6.904
No H/Q in entry = 8
In of MODEL 12
1 H THR 128 H THR 128 6.320 -16.054 5.533
2 HA THR 128 HA THR 128 5.776 -17.038 7.498
3 HB THR 128 HB THR 128 7.643 -15.067 8.837
4 HG1 THR 128 HG1 THR 128 8.888 -16.130 7.354
5 HG21 THR 128 HG21 THR 128 6.159 -16.321 10.355
6 HG22 THR 128 HG22 THR 128 6.743 -17.831 9.659
7 HG23 THR 128 HG23 THR 128 7.847 -16.788 10.553
No H/Q in entry = 7
In of MODEL 12
1 H SER 129 H SER 129 3.687 -16.014 7.023
2 HA SER 129 HA SER 129 2.921 -14.230 9.212
3 HB2 SER 129 HB2 SER 129 1.325 -13.139 7.490
4 HB3 SER 129 HB3 SER 129 3.023 -12.674 7.461
5 HG SER 129 HG SER 129 3.055 -13.334 5.480
No H/Q in entry = 5
In of MODEL 13
1 HA2 GLY -4 HA2 GLY -4 -19.179 1.563 -15.102
2 HA3 GLY -4 HA3 GLY -4 -20.418 2.081 -13.968
3 H1 GLY -4 H1 GLY -4 -20.327 2.786 -16.841
4 H2 GLY -4 H2 GLY -4 -21.528 3.246 -15.747
No H/Q in entry = 4
In of MODEL 13
1 H SER -3 H SER -3 -17.963 2.694 -13.256
2 HA SER -3 HA SER -3 -17.489 5.461 -14.116
3 HB2 SER -3 HB2 SER -3 -16.912 5.915 -11.659
4 HB3 SER -3 HB3 SER -3 -18.623 5.739 -12.052
5 HG SER -3 HG SER -3 -17.160 3.467 -11.280
No H/Q in entry = 5
In of MODEL 13
1 HA PRO -2 HA PRO -2 -13.615 2.981 -14.496
2 HB2 PRO -2 HB2 PRO -2 -13.093 4.987 -16.592
3 HB3 PRO -2 HB3 PRO -2 -13.041 3.226 -16.687
4 HG2 PRO -2 HG2 PRO -2 -15.005 4.632 -17.852
5 HG3 PRO -2 HG3 PRO -2 -15.303 3.044 -17.118
6 HD2 PRO -2 HD2 PRO -2 -15.895 5.775 -16.039
7 HD3 PRO -2 HD3 PRO -2 -16.877 4.295 -15.964
No H/Q in entry = 7
In of MODEL 13
1 H GLU -1 H GLU -1 -13.445 6.425 -15.359
2 HA GLU -1 HA GLU -1 -12.147 8.131 -14.600
3 HB2 GLU -1 HB2 GLU -1 -12.958 6.902 -11.965
4 HB3 GLU -1 HB3 GLU -1 -12.326 8.531 -12.171
5 HG2 GLU -1 HG2 GLU -1 -14.243 9.120 -13.543
6 HG3 GLU -1 HG3 GLU -1 -14.870 7.479 -13.388
No H/Q in entry = 6
In of MODEL 13
1 H PHE 0 H PHE 0 -10.394 6.543 -15.532
2 HA PHE 0 HA PHE 0 -8.606 5.367 -13.657
3 HB2 PHE 0 HB2 PHE 0 -8.355 6.027 -16.586
4 HB3 PHE 0 HB3 PHE 0 -7.038 5.306 -15.669
5 HD1 PHE 0 HD1 PHE 0 -10.347 4.779 -17.112
6 HD2 PHE 0 HD2 PHE 0 -7.168 3.012 -14.903
7 HE1 PHE 0 HE1 PHE 0 -11.312 2.555 -17.514
8 HE2 PHE 0 HE2 PHE 0 -8.131 0.783 -15.299
9 HZ PHE 0 HZ PHE 0 -10.167 0.538 -16.609
No H/Q in entry = 9
In of MODEL 13
1 H HIS 1 H HIS 1 -7.314 6.412 -12.348
2 HA HIS 1 HA HIS 1 -6.391 9.104 -13.063
3 HB2 HIS 1 HB2 HIS 1 -6.332 7.644 -10.408
4 HB3 HIS 1 HB3 HIS 1 -5.720 9.274 -10.674
5 HD1 HIS 1 HD1 HIS 1 -8.542 7.677 -9.317
6 HD2 HIS 1 HD2 HIS 1 -8.024 10.931 -11.854
7 HE1 HIS 1 HE1 HIS 1 -10.678 8.998 -9.175
8 HE2 HIS 1 HE2 HIS 1 -10.272 11.042 -10.587
No H/Q in entry = 8
In of MODEL 13
1 H HIS 2 H HIS 2 -5.483 6.054 -13.472
2 HA HIS 2 HA HIS 2 -3.568 4.974 -13.983
3 HB2 HIS 2 HB2 HIS 2 -3.144 7.166 -15.224
4 HB3 HIS 2 HB3 HIS 2 -2.140 7.635 -13.861
5 HD1 HIS 2 HD1 HIS 2 0.233 7.337 -14.467
6 HD2 HIS 2 HD2 HIS 2 -2.148 4.323 -16.047
7 HE1 HIS 2 HE1 HIS 2 1.802 5.812 -15.700
8 HE2 HIS 2 HE2 HIS 2 0.321 4.081 -16.768
No H/Q in entry = 8
In of MODEL 13
1 H PHE 3 H PHE 3 -4.422 5.188 -11.349
2 HA PHE 3 HA PHE 3 -3.835 4.640 -9.248
3 HB2 PHE 3 HB2 PHE 3 -1.215 3.873 -10.542
4 HB3 PHE 3 HB3 PHE 3 -1.713 3.418 -8.914
5 HD1 PHE 3 HD1 PHE 3 -4.190 2.332 -8.885
6 HD2 PHE 3 HD2 PHE 3 -1.477 2.281 -12.163
7 HE1 PHE 3 HE1 PHE 3 -5.314 0.335 -9.781
8 HE2 PHE 3 HE2 PHE 3 -2.599 0.288 -13.064
9 HZ PHE 3 HZ PHE 3 -4.565 -0.656 -11.890
No H/Q in entry = 9
In of MODEL 13
1 H THR 4 H THR 4 -3.965 6.616 -8.309
2 HA THR 4 HA THR 4 -1.415 8.002 -7.882
3 HB THR 4 HB THR 4 -2.765 10.154 -7.772
4 HG1 THR 4 HG1 THR 4 -4.751 10.120 -8.882
5 HG21 THR 4 HG21 THR 4 -1.263 9.617 -9.637
6 HG22 THR 4 HG22 THR 4 -2.573 8.750 -10.440
7 HG23 THR 4 HG23 THR 4 -2.689 10.491 -10.192
No H/Q in entry = 7
In of MODEL 13
1 H LEU 5 H LEU 5 -1.253 9.173 -5.894
2 HA LEU 5 HA LEU 5 -2.127 7.751 -3.681
3 HB2 LEU 5 HB2 LEU 5 -0.206 9.543 -4.134
4 HB3 LEU 5 HB3 LEU 5 -1.365 10.609 -3.373
5 HG LEU 5 HG LEU 5 0.286 9.793 -1.779
6 HD11 LEU 5 HD11 LEU 5 -2.462 8.672 -1.280
7 HD12 LEU 5 HD12 LEU 5 -1.227 8.951 -0.053
8 HD13 LEU 5 HD13 LEU 5 -1.920 10.313 -0.934
9 HD21 LEU 5 HD21 LEU 5 0.758 7.649 -2.883
10 HD22 LEU 5 HD22 LEU 5 0.431 7.467 -1.161
11 HD23 LEU 5 HD23 LEU 5 -0.807 7.045 -2.340
No H/Q in entry = 11
In of MODEL 13
1 H GLU 6 H GLU 6 -3.270 10.980 -4.774
2 HA GLU 6 HA GLU 6 -5.384 11.252 -2.970
3 HB2 GLU 6 HB2 GLU 6 -5.127 12.188 -5.834
4 HB3 GLU 6 HB3 GLU 6 -6.423 12.690 -4.758
5 HG2 GLU 6 HG2 GLU 6 -4.868 13.738 -3.268
6 HG3 GLU 6 HG3 GLU 6 -3.502 13.103 -4.183
No H/Q in entry = 6
In of MODEL 13
1 H SER 7 H SER 7 -5.260 9.424 -6.070
2 HA SER 7 HA SER 7 -7.950 8.878 -6.298
3 HB2 SER 7 HB2 SER 7 -6.204 8.324 -7.982
4 HB3 SER 7 HB3 SER 7 -5.705 6.969 -6.972
5 HG SER 7 HG SER 7 -8.307 6.735 -7.270
No H/Q in entry = 5
In of MODEL 13
1 H SER 8 H SER 8 -5.835 7.688 -3.828
2 HA SER 8 HA SER 8 -7.618 5.432 -3.324
3 HB2 SER 8 HB2 SER 8 -4.958 6.032 -2.044
4 HB3 SER 8 HB3 SER 8 -5.931 4.573 -1.806
5 HG SER 8 HG SER 8 -5.026 5.425 -4.361
No H/Q in entry = 5
In of MODEL 13
1 H LEU 9 H LEU 9 -7.182 8.611 -2.131
2 HA LEU 9 HA LEU 9 -6.979 8.260 0.570
3 HB2 LEU 9 HB2 LEU 9 -8.290 10.497 -0.912
4 HB3 LEU 9 HB3 LEU 9 -7.751 10.559 0.758
5 HG LEU 9 HG LEU 9 -5.930 9.987 -1.563
6 HD11 LEU 9 HD11 LEU 9 -6.904 12.176 -1.759
7 HD12 LEU 9 HD12 LEU 9 -6.434 12.559 -0.103
8 HD13 LEU 9 HD13 LEU 9 -5.200 12.283 -1.333
9 HD21 LEU 9 HD21 LEU 9 -5.376 10.704 1.315
10 HD22 LEU 9 HD22 LEU 9 -5.141 9.118 0.573
11 HD23 LEU 9 HD23 LEU 9 -4.161 10.494 0.054
No H/Q in entry = 11
In of MODEL 13
1 H ASP 10 H ASP 10 -9.974 8.352 -1.208
2 HA ASP 10 HA ASP 10 -11.442 7.970 1.296
3 HB2 ASP 10 HB2 ASP 10 -12.278 8.701 -1.492
4 HB3 ASP 10 HB3 ASP 10 -13.459 8.127 -0.323
No H/Q in entry = 4
In of MODEL 13
1 H THR 11 H THR 11 -9.873 6.043 -0.750
2 HA THR 11 HA THR 11 -11.836 3.894 -0.409
3 HB THR 11 HB THR 11 -10.764 2.844 -2.472
4 HG1 THR 11 HG1 THR 11 -10.142 5.211 -3.612
5 HG21 THR 11 HG21 THR 11 -12.341 5.399 -2.790
6 HG22 THR 11 HG22 THR 11 -12.164 4.146 -4.018
7 HG23 THR 11 HG23 THR 11 -13.010 3.793 -2.511
No H/Q in entry = 7
In of MODEL 13
1 H HIS 12 H HIS 12 -8.743 3.322 -1.814
2 HA HIS 12 HA HIS 12 -8.152 1.290 0.008
3 HB2 HIS 12 HB2 HIS 12 -6.201 2.665 -1.823
4 HB3 HIS 12 HB3 HIS 12 -5.989 1.087 -1.079
5 HD1 HIS 12 HD1 HIS 12 -8.382 -0.460 -1.714
6 HD2 HIS 12 HD2 HIS 12 -6.866 2.321 -4.404
7 HE1 HIS 12 HE1 HIS 12 -9.302 -1.118 -3.962
8 HE2 HIS 12 HE2 HIS 12 -8.310 0.534 -5.594
No H/Q in entry = 8
In of MODEL 13
1 H LEU 13 H LEU 13 -7.241 4.691 0.063
2 HA LEU 13 HA LEU 13 -5.419 4.063 2.294
3 HB2 LEU 13 HB2 LEU 13 -5.393 6.340 0.338
4 HB3 LEU 13 HB3 LEU 13 -4.401 6.299 1.781
5 HG LEU 13 HG LEU 13 -4.271 4.353 -0.524
6 HD11 LEU 13 HD11 LEU 13 -3.315 6.562 -0.990
7 HD12 LEU 13 HD12 LEU 13 -2.297 6.413 0.442
8 HD13 LEU 13 HD13 LEU 13 -2.078 5.308 -0.916
9 HD21 LEU 13 HD21 LEU 13 -2.700 4.450 2.048
10 HD22 LEU 13 HD22 LEU 13 -3.809 3.179 1.534
11 HD23 LEU 13 HD23 LEU 13 -2.301 3.441 0.658
No H/Q in entry = 11
In of MODEL 13
1 H LYS 14 H LYS 14 -8.336 4.557 2.356
2 HA LYS 14 HA LYS 14 -8.740 7.138 3.496
3 HB2 LYS 14 HB2 LYS 14 -11.010 6.439 3.923
4 HB3 LYS 14 HB3 LYS 14 -10.531 5.985 2.301
5 HG2 LYS 14 HG2 LYS 14 -10.304 3.697 2.939
6 HG3 LYS 14 HG3 LYS 14 -10.544 4.099 4.641
7 HD2 LYS 14 HD2 LYS 14 -12.813 4.864 4.145
8 HD3 LYS 14 HD3 LYS 14 -12.572 4.479 2.440
9 HE2 LYS 14 HE2 LYS 14 -12.369 2.146 2.934
10 HE3 LYS 14 HE3 LYS 14 -12.383 2.465 4.669
11 HZ1 LYS 14 HZ1 LYS 14 -14.637 3.006 2.818
12 HZ2 LYS 14 HZ2 LYS 14 -14.529 1.678 3.858
13 HZ3 LYS 14 HZ3 LYS 14 -14.644 3.241 4.490
No H/Q in entry = 13
In of MODEL 13
1 H TRP 15 H TRP 15 -7.522 4.275 4.752
2 HA TRP 15 HA TRP 15 -8.390 4.614 7.460
3 HB2 TRP 15 HB2 TRP 15 -6.706 2.874 7.977
4 HB3 TRP 15 HB3 TRP 15 -7.771 2.394 6.658
5 HD1 TRP 15 HD1 TRP 15 -6.715 2.336 4.195
6 HE1 TRP 15 HE1 TRP 15 -4.282 2.097 3.382
7 HE3 TRP 15 HE3 TRP 15 -4.297 3.451 8.556
8 HZ2 TRP 15 HZ2 TRP 15 -1.683 2.346 4.461
9 HZ3 TRP 15 HZ3 TRP 15 -1.837 3.428 8.582
10 HH2 TRP 15 HH2 TRP 15 -0.558 2.886 6.575
No H/Q in entry = 10
In of MODEL 13
1 H LEU 16 H LEU 16 -6.209 6.203 5.482
2 HA LEU 16 HA LEU 16 -4.282 6.974 7.473
3 HB2 LEU 16 HB2 LEU 16 -5.006 8.235 4.815
4 HB3 LEU 16 HB3 LEU 16 -3.672 8.747 5.823
5 HG LEU 16 HG LEU 16 -3.868 5.996 4.584
6 HD11 LEU 16 HD11 LEU 16 -3.748 7.815 2.894
7 HD12 LEU 16 HD12 LEU 16 -2.252 8.365 3.650
8 HD13 LEU 16 HD13 LEU 16 -2.329 6.767 2.907
9 HD21 LEU 16 HD21 LEU 16 -1.595 7.484 5.900
10 HD22 LEU 16 HD22 LEU 16 -2.418 6.053 6.525
11 HD23 LEU 16 HD23 LEU 16 -1.442 5.941 5.058
No H/Q in entry = 11
In of MODEL 13
1 H SER 17 H SER 17 -4.220 8.861 8.592
2 HA SER 17 HA SER 17 -6.756 10.128 9.134
3 HB2 SER 17 HB2 SER 17 -5.051 9.624 10.913
4 HB3 SER 17 HB3 SER 17 -4.023 10.862 10.198
5 HG SER 17 HG SER 17 -5.933 11.184 11.973
No H/Q in entry = 5
In of MODEL 13
1 H GLN 18 H GLN 18 -7.016 12.551 9.003
2 HA GLN 18 HA GLN 18 -6.517 13.456 6.425
3 HB2 GLN 18 HB2 GLN 18 -8.230 14.429 7.946
4 HB3 GLN 18 HB3 GLN 18 -6.943 15.199 8.864
5 HG2 GLN 18 HG2 GLN 18 -8.002 16.764 7.335
6 HG3 GLN 18 HG3 GLN 18 -6.311 16.505 6.913
7 HE21 GLN 18 HE21 GLN 18 -9.612 15.926 6.007
8 HE22 GLN 18 HE22 GLN 18 -9.291 15.435 4.377
No H/Q in entry = 8
In of MODEL 13
1 H GLU 19 H GLU 19 -4.719 14.168 9.403
2 HA GLU 19 HA GLU 19 -2.865 15.909 8.287
3 HB2 GLU 19 HB2 GLU 19 -2.688 14.029 10.638
4 HB3 GLU 19 HB3 GLU 19 -1.474 15.220 10.253
5 HG2 GLU 19 HG2 GLU 19 -3.239 16.976 10.430
6 HG3 GLU 19 HG3 GLU 19 -4.320 15.721 11.030
No H/Q in entry = 6
In of MODEL 13
1 H GLN 20 H GLN 20 -2.978 12.387 8.389
2 HA GLN 20 HA GLN 20 -0.333 12.031 7.363
3 HB2 GLN 20 HB2 GLN 20 -2.705 10.140 7.332
4 HB3 GLN 20 HB3 GLN 20 -1.047 9.692 6.959
5 HG2 GLN 20 HG2 GLN 20 -0.372 10.230 9.230
6 HG3 GLN 20 HG3 GLN 20 -2.016 10.734 9.611
7 HE21 GLN 20 HE21 GLN 20 -0.377 8.658 10.826
8 HE22 GLN 20 HE22 GLN 20 -1.269 7.184 10.666
No H/Q in entry = 8
In of MODEL 13
1 H LYS 21 H LYS 21 -3.598 11.963 5.932
2 HA LYS 21 HA LYS 21 -2.867 11.458 3.286
3 HB2 LYS 21 HB2 LYS 21 -5.112 13.198 4.332
4 HB3 LYS 21 HB3 LYS 21 -4.965 12.655 2.666
5 HG2 LYS 21 HG2 LYS 21 -5.157 10.337 3.395
6 HG3 LYS 21 HG3 LYS 21 -5.281 10.872 5.073
7 HD2 LYS 21 HD2 LYS 21 -7.344 12.047 4.576
8 HD3 LYS 21 HD3 LYS 21 -7.205 11.618 2.869
9 HE2 LYS 21 HE2 LYS 21 -7.406 9.264 3.423
10 HE3 LYS 21 HE3 LYS 21 -7.475 9.653 5.143
11 HZ1 LYS 21 HZ1 LYS 21 -9.522 10.924 4.669
12 HZ2 LYS 21 HZ2 LYS 21 -9.473 10.376 3.073
13 HZ3 LYS 21 HZ3 LYS 21 -9.678 9.274 4.336
No H/Q in entry = 13
In of MODEL 13
1 H ASP 22 H ASP 22 -3.309 14.560 4.918
2 HA ASP 22 HA ASP 22 -2.472 16.241 2.822
3 HB2 ASP 22 HB2 ASP 22 -3.695 17.052 4.778
4 HB3 ASP 22 HB3 ASP 22 -2.366 16.594 5.831
No H/Q in entry = 4
In of MODEL 13
1 H GLU 23 H GLU 23 -0.605 14.521 5.337
2 HA GLU 23 HA GLU 23 1.896 15.620 4.734
3 HB2 GLU 23 HB2 GLU 23 0.978 13.888 6.586
4 HB3 GLU 23 HB3 GLU 23 1.758 12.763 5.477
5 HG2 GLU 23 HG2 GLU 23 3.814 13.921 5.654
6 HG3 GLU 23 HG3 GLU 23 3.053 15.201 6.586
No H/Q in entry = 6
In of MODEL 13
1 H LEU 24 H LEU 24 0.307 12.678 3.443
2 HA LEU 24 HA LEU 24 2.340 11.899 1.679
3 HB2 LEU 24 HB2 LEU 24 -0.647 11.527 1.672
4 HB3 LEU 24 HB3 LEU 24 0.352 10.875 0.394
5 HG LEU 24 HG LEU 24 -0.371 9.328 2.316
6 HD11 LEU 24 HD11 LEU 24 2.510 9.509 1.491
7 HD12 LEU 24 HD12 LEU 24 1.768 8.127 2.306
8 HD13 LEU 24 HD13 LEU 24 1.227 8.601 0.691
9 HD21 LEU 24 HD21 LEU 24 1.669 11.004 3.684
10 HD22 LEU 24 HD22 LEU 24 0.116 10.410 4.279
11 HD23 LEU 24 HD23 LEU 24 1.475 9.300 4.093
No H/Q in entry = 11
In of MODEL 13
1 H LEU 25 H LEU 25 -0.650 13.739 0.952
2 HA LEU 25 HA LEU 25 -0.181 14.551 -1.595
3 HB2 LEU 25 HB2 LEU 25 -1.529 15.818 0.749
4 HB3 LEU 25 HB3 LEU 25 -1.390 16.715 -0.750
5 HG LEU 25 HG LEU 25 -2.540 14.874 -1.905
6 HD11 LEU 25 HD11 LEU 25 -2.016 13.035 -0.470
7 HD12 LEU 25 HD12 LEU 25 -2.981 13.750 0.821
8 HD13 LEU 25 HD13 LEU 25 -3.759 13.200 -0.660
9 HD21 LEU 25 HD21 LEU 25 -4.025 16.109 0.389
10 HD22 LEU 25 HD22 LEU 25 -3.802 16.806 -1.213
11 HD23 LEU 25 HD23 LEU 25 -4.782 15.355 -1.015
No H/Q in entry = 11
In of MODEL 13
1 H LYS 26 H LYS 26 1.123 15.997 1.358
2 HA LYS 26 HA LYS 26 2.287 18.276 0.191
3 HB2 LYS 26 HB2 LYS 26 1.913 17.835 2.645
4 HB3 LYS 26 HB3 LYS 26 3.299 16.760 2.597
5 HG2 LYS 26 HG2 LYS 26 3.914 18.936 3.471
6 HG3 LYS 26 HG3 LYS 26 4.731 18.625 1.938
7 HD2 LYS 26 HD2 LYS 26 3.231 20.057 0.761
8 HD3 LYS 26 HD3 LYS 26 2.175 20.202 2.166
9 HE2 LYS 26 HE2 LYS 26 5.023 21.184 2.041
10 HE3 LYS 26 HE3 LYS 26 3.601 22.194 1.797
11 HZ1 LYS 26 HZ1 LYS 26 2.877 21.594 4.054
12 HZ2 LYS 26 HZ2 LYS 26 4.318 20.731 4.279
13 HZ3 LYS 26 HZ3 LYS 26 4.360 22.404 4.048
No H/Q in entry = 13
In of MODEL 13
1 H MET 27 H MET 27 3.659 15.104 0.988
2 HA MET 27 HA MET 27 6.170 15.537 -0.092
3 HB2 MET 27 HB2 MET 27 4.617 12.969 0.170
4 HB3 MET 27 HB3 MET 27 6.320 13.050 -0.258
5 HG2 MET 27 HG2 MET 27 6.303 14.538 1.997
6 HG3 MET 27 HG3 MET 27 4.999 13.404 2.342
7 HE1 MET 27 HE1 MET 27 5.364 10.697 2.064
8 HE2 MET 27 HE2 MET 27 6.169 10.920 0.511
9 HE3 MET 27 HE3 MET 27 6.946 9.968 1.777
No H/Q in entry = 9
In of MODEL 13
1 H LYS 28 H LYS 28 3.344 14.033 -1.737
2 HA LYS 28 HA LYS 28 4.628 13.518 -4.161
3 HB2 LYS 28 HB2 LYS 28 2.521 12.515 -3.768
4 HB3 LYS 28 HB3 LYS 28 1.754 14.065 -3.455
5 HG2 LYS 28 HG2 LYS 28 1.944 14.680 -5.781
6 HG3 LYS 28 HG3 LYS 28 2.833 13.196 -6.129
7 HD2 LYS 28 HD2 LYS 28 0.083 13.125 -4.937
8 HD3 LYS 28 HD3 LYS 28 0.323 13.273 -6.677
9 HE2 LYS 28 HE2 LYS 28 1.464 11.071 -4.964
10 HE3 LYS 28 HE3 LYS 28 -0.015 10.938 -5.913
11 HZ1 LYS 28 HZ1 LYS 28 1.315 11.426 -7.906
12 HZ2 LYS 28 HZ2 LYS 28 2.719 11.413 -6.965
13 HZ3 LYS 28 HZ3 LYS 28 1.800 10.001 -7.135
No H/Q in entry = 13
In of MODEL 13
1 H LYS 29 H LYS 29 2.878 16.418 -3.090
2 HA LYS 29 HA LYS 29 3.258 17.790 -5.553
3 HB2 LYS 29 HB2 LYS 29 2.419 18.701 -2.812
4 HB3 LYS 29 HB3 LYS 29 2.612 19.829 -4.147
5 HG2 LYS 29 HG2 LYS 29 0.758 17.454 -4.148
6 HG3 LYS 29 HG3 LYS 29 0.281 19.121 -3.818
7 HD2 LYS 29 HD2 LYS 29 1.169 19.730 -6.080
8 HD3 LYS 29 HD3 LYS 29 1.396 18.008 -6.391
9 HE2 LYS 29 HE2 LYS 29 -1.230 19.325 -5.709
10 HE3 LYS 29 HE3 LYS 29 -0.712 18.878 -7.334
11 HZ1 LYS 29 HZ1 LYS 29 -1.092 16.980 -5.086
12 HZ2 LYS 29 HZ2 LYS 29 -2.200 17.238 -6.336
13 HZ3 LYS 29 HZ3 LYS 29 -0.681 16.579 -6.674
No H/Q in entry = 13
In of MODEL 13
1 H ASP 30 H ASP 30 5.282 17.313 -2.824
2 HA ASP 30 HA ASP 30 6.911 19.633 -3.439
3 HB2 ASP 30 HB2 ASP 30 6.536 19.035 -1.078
4 HB3 ASP 30 HB3 ASP 30 7.256 17.455 -1.350
No H/Q in entry = 4
In of MODEL 13
1 H GLY 31 H GLY 31 6.591 16.590 -4.592
2 HA2 GLY 31 HA2 GLY 31 9.120 16.864 -6.013
3 HA3 GLY 31 HA3 GLY 31 7.771 15.840 -6.477
No H/Q in entry = 3
In of MODEL 13
1 H LYS 32 H LYS 32 7.721 14.931 -3.565
2 HA LYS 32 HA LYS 32 10.041 13.321 -3.265
3 HB2 LYS 32 HB2 LYS 32 7.268 13.094 -2.082
4 HB3 LYS 32 HB3 LYS 32 8.612 12.055 -1.631
5 HG2 LYS 32 HG2 LYS 32 8.651 15.054 -1.359
6 HG3 LYS 32 HG3 LYS 32 8.183 13.950 -0.065
7 HD2 LYS 32 HD2 LYS 32 10.401 12.875 -0.229
8 HD3 LYS 32 HD3 LYS 32 10.856 14.056 -1.456
9 HE2 LYS 32 HE2 LYS 32 9.923 14.860 1.285
10 HE3 LYS 32 HE3 LYS 32 11.611 14.512 0.932
11 HZ1 LYS 32 HZ1 LYS 32 9.973 16.597 -0.415
12 HZ2 LYS 32 HZ2 LYS 32 11.121 16.876 0.793
13 HZ3 LYS 32 HZ3 LYS 32 11.607 16.270 -0.706
No H/Q in entry = 13
In of MODEL 13
1 H ALA 33 H ALA 33 10.282 11.168 -3.747
2 HA ALA 33 HA ALA 33 9.113 10.405 -6.250
3 HB1 ALA 33 HB1 ALA 33 11.466 9.922 -5.660
4 HB2 ALA 33 HB2 ALA 33 10.900 8.761 -4.462
5 HB3 ALA 33 HB3 ALA 33 10.577 8.491 -6.174
No H/Q in entry = 5
In of MODEL 13
1 H LYS 34 H LYS 34 8.037 8.319 -6.658
2 HA LYS 34 HA LYS 34 5.836 7.885 -4.979
3 HB2 LYS 34 HB2 LYS 34 7.027 5.861 -6.892
4 HB3 LYS 34 HB3 LYS 34 5.372 5.903 -6.307
5 HG2 LYS 34 HG2 LYS 34 5.010 8.012 -7.502
6 HG3 LYS 34 HG3 LYS 34 6.666 7.938 -8.108
7 HD2 LYS 34 HD2 LYS 34 6.083 5.707 -9.116
8 HD3 LYS 34 HD3 LYS 34 4.404 6.035 -8.687
9 HE2 LYS 34 HE2 LYS 34 4.743 6.656 -10.979
10 HE3 LYS 34 HE3 LYS 34 4.526 8.121 -10.025
11 HZ1 LYS 34 HZ1 LYS 34 6.948 8.381 -9.998
12 HZ2 LYS 34 HZ2 LYS 34 7.111 7.019 -10.982
13 HZ3 LYS 34 HZ3 LYS 34 6.331 8.396 -11.570
No H/Q in entry = 13
In of MODEL 13
1 H LYS 35 H LYS 35 8.978 6.340 -5.163
2 HA LYS 35 HA LYS 35 8.536 4.202 -3.416
3 HB2 LYS 35 HB2 LYS 35 10.531 4.611 -4.926
4 HB3 LYS 35 HB3 LYS 35 11.120 5.732 -3.711
5 HG2 LYS 35 HG2 LYS 35 12.247 3.718 -3.314
6 HG3 LYS 35 HG3 LYS 35 11.002 3.816 -2.069
7 HD2 LYS 35 HD2 LYS 35 11.070 1.571 -2.944
8 HD3 LYS 35 HD3 LYS 35 9.567 2.340 -3.453
9 HE2 LYS 35 HE2 LYS 35 10.594 1.067 -5.278
10 HE3 LYS 35 HE3 LYS 35 10.521 2.789 -5.649
11 HZ1 LYS 35 HZ1 LYS 35 12.930 1.405 -4.602
12 HZ2 LYS 35 HZ2 LYS 35 12.659 1.745 -6.235
13 HZ3 LYS 35 HZ3 LYS 35 12.835 3.009 -5.130
No H/Q in entry = 13
In of MODEL 13
1 H GLU 36 H GLU 36 8.758 7.586 -2.750
2 HA GLU 36 HA GLU 36 9.538 7.184 0.025
3 HB2 GLU 36 HB2 GLU 36 8.886 9.760 -1.408
4 HB3 GLU 36 HB3 GLU 36 9.690 9.587 0.148
5 HG2 GLU 36 HG2 GLU 36 11.520 8.370 -1.008
6 HG3 GLU 36 HG3 GLU 36 10.741 8.753 -2.528
No H/Q in entry = 6
In of MODEL 13
1 H LEU 37 H LEU 37 6.841 7.987 -1.962
2 HA LEU 37 HA LEU 37 4.971 8.438 0.135
3 HB2 LEU 37 HB2 LEU 37 4.548 7.505 -2.706
4 HB3 LEU 37 HB3 LEU 37 3.279 8.054 -1.628
5 HG LEU 37 HG LEU 37 5.596 9.807 -2.418
6 HD11 LEU 37 HD11 LEU 37 2.886 9.572 -3.706
7 HD12 LEU 37 HD12 LEU 37 4.064 10.846 -4.028
8 HD13 LEU 37 HD13 LEU 37 4.440 9.172 -4.435
9 HD21 LEU 37 HD21 LEU 37 4.383 10.440 -0.393
10 HD22 LEU 37 HD22 LEU 37 4.111 11.596 -1.696
11 HD23 LEU 37 HD23 LEU 37 2.867 10.415 -1.292
No H/Q in entry = 11
In of MODEL 13
1 H GLU 38 H GLU 38 5.931 5.638 -1.761
2 HA GLU 38 HA GLU 38 4.234 3.743 -0.537
3 HB2 GLU 38 HB2 GLU 38 5.626 3.543 -2.698
4 HB3 GLU 38 HB3 GLU 38 6.969 3.128 -1.642
5 HG2 GLU 38 HG2 GLU 38 5.899 1.142 -2.534
6 HG3 GLU 38 HG3 GLU 38 5.722 1.226 -0.781
No H/Q in entry = 6
In of MODEL 13
1 H ALA 39 H ALA 39 6.931 5.433 0.573
2 HA ALA 39 HA ALA 39 7.719 3.447 2.535
3 HB1 ALA 39 HB1 ALA 39 8.804 6.219 2.071
4 HB2 ALA 39 HB2 ALA 39 9.504 4.980 3.113
5 HB3 ALA 39 HB3 ALA 39 9.442 4.733 1.368
No H/Q in entry = 5
In of MODEL 13
1 H LYS 40 H LYS 40 6.375 6.704 2.481
2 HA LYS 40 HA LYS 40 6.042 7.137 5.195
3 HB2 LYS 40 HB2 LYS 40 5.713 8.833 3.446
4 HB3 LYS 40 HB3 LYS 40 4.255 8.003 2.918
5 HG2 LYS 40 HG2 LYS 40 3.639 9.884 4.251
6 HG3 LYS 40 HG3 LYS 40 3.267 8.408 5.143
7 HD2 LYS 40 HD2 LYS 40 4.249 9.871 6.705
8 HD3 LYS 40 HD3 LYS 40 5.503 8.710 6.293
9 HE2 LYS 40 HE2 LYS 40 6.620 10.266 4.902
10 HE3 LYS 40 HE3 LYS 40 5.254 11.382 4.937
11 HZ1 LYS 40 HZ1 LYS 40 6.931 10.664 7.277
12 HZ2 LYS 40 HZ2 LYS 40 7.062 12.095 6.385
13 HZ3 LYS 40 HZ3 LYS 40 5.651 11.777 7.267
No H/Q in entry = 13
In of MODEL 13
1 H ILE 41 H ILE 41 3.743 5.670 2.888
2 HA ILE 41 HA ILE 41 1.692 5.180 4.723
3 HB ILE 41 HB ILE 41 2.406 3.665 2.209
4 HG12 ILE 41 HG12 ILE 41 0.414 5.896 2.647
5 HG13 ILE 41 HG13 ILE 41 2.015 6.112 1.948
6 HG21 ILE 41 HG21 ILE 41 -0.171 3.743 3.765
7 HG22 ILE 41 HG22 ILE 41 0.058 2.961 2.202
8 HG23 ILE 41 HG23 ILE 41 0.920 2.367 3.621
9 HD11 ILE 41 HD11 ILE 41 -0.171 4.403 0.801
10 HD12 ILE 41 HD12 ILE 41 0.276 6.016 0.251
11 HD13 ILE 41 HD13 ILE 41 1.421 4.684 0.092
No H/Q in entry = 11
In of MODEL 13
1 H LEU 42 H LEU 42 4.377 3.114 3.652
2 HA LEU 42 HA LEU 42 3.650 0.845 5.148
3 HB2 LEU 42 HB2 LEU 42 6.323 1.765 4.132
4 HB3 LEU 42 HB3 LEU 42 6.076 0.224 4.922
5 HG LEU 42 HG LEU 42 4.951 1.127 2.281
6 HD11 LEU 42 HD11 LEU 42 6.833 -1.082 3.078
7 HD12 LEU 42 HD12 LEU 42 6.234 -0.786 1.448
8 HD13 LEU 42 HD13 LEU 42 7.260 0.408 2.239
9 HD21 LEU 42 HD21 LEU 42 4.335 -1.351 3.889
10 HD22 LEU 42 HD22 LEU 42 3.201 -0.116 3.348
11 HD23 LEU 42 HD23 LEU 42 3.977 -1.173 2.172
No H/Q in entry = 11
In of MODEL 13
1 H HIS 43 H HIS 43 5.469 3.713 5.968
2 HA HIS 43 HA HIS 43 6.456 2.799 8.466
3 HB2 HIS 43 HB2 HIS 43 7.236 4.861 7.205
4 HB3 HIS 43 HB3 HIS 43 5.767 5.659 7.755
5 HD1 HIS 43 HD1 HIS 43 6.016 6.931 9.866
6 HD2 HIS 43 HD2 HIS 43 8.833 3.892 9.542
7 HE1 HIS 43 HE1 HIS 43 7.496 7.162 11.882
8 HE2 HIS 43 HE2 HIS 43 9.261 5.391 11.608
No H/Q in entry = 8
In of MODEL 13
1 H TYR 44 H TYR 44 3.580 4.754 7.595
2 HA TYR 44 HA TYR 44 2.339 4.865 10.085
3 HB2 TYR 44 HB2 TYR 44 1.148 4.602 7.321
4 HB3 TYR 44 HB3 TYR 44 0.197 4.935 8.758
5 HD1 TYR 44 HD1 TYR 44 2.157 6.816 10.093
6 HD2 TYR 44 HD2 TYR 44 0.736 6.546 6.106
7 HE1 TYR 44 HE1 TYR 44 2.526 9.218 9.813
8 HE2 TYR 44 HE2 TYR 44 1.094 8.951 5.801
9 HH TYR 44 HH TYR 44 2.915 10.840 7.872
No H/Q in entry = 9
In of MODEL 13
1 H TYR 45 H TYR 45 2.222 2.454 7.570
2 HA TYR 45 HA TYR 45 0.257 0.765 8.543
3 HB2 TYR 45 HB2 TYR 45 1.011 0.683 6.272
4 HB3 TYR 45 HB3 TYR 45 2.654 0.316 6.774
5 HD1 TYR 45 HD1 TYR 45 -0.779 -1.112 7.038
6 HD2 TYR 45 HD2 TYR 45 3.387 -1.803 6.623
7 HE1 TYR 45 HE1 TYR 45 -1.215 -3.511 6.751
8 HE2 TYR 45 HE2 TYR 45 2.977 -4.197 6.340
9 HH TYR 45 HH TYR 45 -0.270 -5.487 6.041
No H/Q in entry = 9
In of MODEL 13
1 H ASP 46 H ASP 46 3.774 0.673 9.090
2 HA ASP 46 HA ASP 46 3.574 -1.851 10.422
3 HB2 ASP 46 HB2 ASP 46 5.601 -1.167 9.138
4 HB3 ASP 46 HB3 ASP 46 5.912 0.075 10.342
No H/Q in entry = 4
In of MODEL 13
1 H GLU 47 H GLU 47 3.175 1.383 11.505
2 HA GLU 47 HA GLU 47 3.683 0.569 14.257
3 HB2 GLU 47 HB2 GLU 47 3.401 2.969 14.795
4 HB3 GLU 47 HB3 GLU 47 4.713 2.634 13.681
5 HG2 GLU 47 HG2 GLU 47 3.222 3.293 11.818
6 HG3 GLU 47 HG3 GLU 47 2.008 3.758 13.010
No H/Q in entry = 6
In of MODEL 13
1 H LEU 48 H LEU 48 1.252 -0.004 12.376
2 HA LEU 48 HA LEU 48 -0.991 1.317 13.429
3 HB2 LEU 48 HB2 LEU 48 -0.522 -1.119 11.766
4 HB3 LEU 48 HB3 LEU 48 -2.140 -0.722 12.280
5 HG LEU 48 HG LEU 48 -0.354 1.058 10.638
6 HD11 LEU 48 HD11 LEU 48 -1.124 -0.903 9.412
7 HD12 LEU 48 HD12 LEU 48 -2.787 -0.554 9.884
8 HD13 LEU 48 HD13 LEU 48 -1.917 0.560 8.831
9 HD21 LEU 48 HD21 LEU 48 -3.210 1.357 11.545
10 HD22 LEU 48 HD22 LEU 48 -1.838 2.356 12.023
11 HD23 LEU 48 HD23 LEU 48 -2.414 2.389 10.358
No H/Q in entry = 11
In of MODEL 13
1 H GLU 49 H GLU 49 -2.732 -0.811 13.806
2 HA GLU 49 HA GLU 49 -2.056 -1.725 16.505
3 HB2 GLU 49 HB2 GLU 49 -4.611 -0.350 15.635
4 HB3 GLU 49 HB3 GLU 49 -4.405 -1.159 17.180
5 HG2 GLU 49 HG2 GLU 49 -2.764 1.180 16.241
6 HG3 GLU 49 HG3 GLU 49 -4.164 1.293 17.304
No H/Q in entry = 6
In of MODEL 13
1 H GLY 50 H GLY 50 -4.259 -3.151 17.154
2 HA2 GLY 50 HA2 GLY 50 -5.333 -5.152 16.789
3 HA3 GLY 50 HA3 GLY 50 -3.946 -5.543 15.791
No H/Q in entry = 3
In of MODEL 13
1 H ASP 51 H ASP 51 -7.128 -3.977 15.722
2 HA ASP 51 HA ASP 51 -7.812 -5.218 13.236
3 HB2 ASP 51 HB2 ASP 51 -9.125 -3.149 14.980
4 HB3 ASP 51 HB3 ASP 51 -9.751 -3.469 13.367
No H/Q in entry = 4
In of MODEL 13
1 H ALA 52 H ALA 52 -6.341 -2.180 14.105
2 HA ALA 52 HA ALA 52 -6.936 -0.773 11.718
3 HB1 ALA 52 HB1 ALA 52 -4.518 -0.485 13.509
4 HB2 ALA 52 HB2 ALA 52 -5.069 0.683 12.311
5 HB3 ALA 52 HB3 ALA 52 -6.060 0.338 13.727
No H/Q in entry = 5
In of MODEL 13
1 H LYS 53 H LYS 53 -4.235 -2.864 12.655
2 HA LYS 53 HA LYS 53 -2.717 -2.669 10.319
3 HB2 LYS 53 HB2 LYS 53 -2.750 -4.258 12.695
4 HB3 LYS 53 HB3 LYS 53 -2.576 -5.330 11.322
5 HG2 LYS 53 HG2 LYS 53 -0.811 -2.962 11.874
6 HG3 LYS 53 HG3 LYS 53 -0.432 -4.623 12.317
7 HD2 LYS 53 HD2 LYS 53 -0.559 -5.250 9.932
8 HD3 LYS 53 HD3 LYS 53 -0.843 -3.558 9.526
9 HE2 LYS 53 HE2 LYS 53 1.498 -4.135 9.201
10 HE3 LYS 53 HE3 LYS 53 1.322 -2.960 10.504
11 HZ1 LYS 53 HZ1 LYS 53 1.640 -5.884 10.903
12 HZ2 LYS 53 HZ2 LYS 53 2.891 -4.758 11.030
13 HZ3 LYS 53 HZ3 LYS 53 1.594 -4.707 12.114
No H/Q in entry = 13
In of MODEL 13
1 H LYS 54 H LYS 54 -5.052 -5.170 11.290
2 HA LYS 54 HA LYS 54 -5.052 -6.641 8.947
3 HB2 LYS 54 HB2 LYS 54 -6.560 -7.887 9.986
4 HB3 LYS 54 HB3 LYS 54 -6.372 -6.787 11.340
5 HG2 LYS 54 HG2 LYS 54 -8.327 -5.619 10.812
6 HG3 LYS 54 HG3 LYS 54 -8.395 -6.297 9.177
7 HD2 LYS 54 HD2 LYS 54 -8.749 -8.519 10.150
8 HD3 LYS 54 HD3 LYS 54 -8.751 -7.803 11.761
9 HE2 LYS 54 HE2 LYS 54 -11.029 -8.147 11.069
10 HE3 LYS 54 HE3 LYS 54 -10.695 -6.418 11.097
11 HZ1 LYS 54 HZ1 LYS 54 -10.561 -8.058 8.631
12 HZ2 LYS 54 HZ2 LYS 54 -11.951 -7.231 9.117
13 HZ3 LYS 54 HZ3 LYS 54 -10.545 -6.365 8.747
No H/Q in entry = 13
In of MODEL 13
1 H GLU 55 H GLU 55 -7.132 -3.867 9.809
2 HA GLU 55 HA GLU 55 -8.614 -3.962 7.422
3 HB2 GLU 55 HB2 GLU 55 -8.174 -1.942 9.592
4 HB3 GLU 55 HB3 GLU 55 -9.135 -1.529 8.188
5 HG2 GLU 55 HG2 GLU 55 -9.640 -3.789 10.103
6 HG3 GLU 55 HG3 GLU 55 -10.543 -2.285 9.993
No H/Q in entry = 6
In of MODEL 13
1 H ALA 56 H ALA 56 -5.830 -1.928 8.397
2 HA ALA 56 HA ALA 56 -5.726 -0.534 5.985
3 HB1 ALA 56 HB1 ALA 56 -3.383 -0.042 6.528
4 HB2 ALA 56 HB2 ALA 56 -3.410 -1.291 7.772
5 HB3 ALA 56 HB3 ALA 56 -4.421 0.143 7.943
No H/Q in entry = 5
In of MODEL 13
1 H THR 57 H THR 57 -4.042 -3.501 6.984
2 HA THR 57 HA THR 57 -2.603 -4.015 4.697
3 HB THR 57 HB THR 57 -3.973 -6.057 6.457
4 HG1 THR 57 HG1 THR 57 -2.654 -4.865 7.758
5 HG21 THR 57 HG21 THR 57 -1.601 -6.283 4.607
6 HG22 THR 57 HG22 THR 57 -2.144 -7.539 5.725
7 HG23 THR 57 HG23 THR 57 -3.181 -7.033 4.391
No H/Q in entry = 7
In of MODEL 13
1 H GLU 58 H GLU 58 -5.914 -4.969 5.461
2 HA GLU 58 HA GLU 58 -6.490 -6.323 3.052
3 HB2 GLU 58 HB2 GLU 58 -8.228 -5.029 5.148
4 HB3 GLU 58 HB3 GLU 58 -8.897 -5.863 3.749
5 HG2 GLU 58 HG2 GLU 58 -7.172 -7.028 5.919
6 HG3 GLU 58 HG3 GLU 58 -8.883 -7.332 5.639
No H/Q in entry = 6
In of MODEL 13
1 H HIS 59 H HIS 59 -6.581 -2.907 3.903
2 HA HIS 59 HA HIS 59 -8.103 -2.127 1.602
3 HB2 HIS 59 HB2 HIS 59 -6.430 -0.622 3.599
4 HB3 HIS 59 HB3 HIS 59 -7.039 0.178 2.155
5 HD1 HIS 59 HD1 HIS 59 -9.851 -0.452 1.926
6 HD2 HIS 59 HD2 HIS 59 -8.071 -0.092 5.664
7 HE1 HIS 59 HE1 HIS 59 -11.725 0.033 3.526
8 HE2 HIS 59 HE2 HIS 59 -10.606 0.415 5.745
No H/Q in entry = 8
In of MODEL 13
1 H LEU 60 H LEU 60 -4.676 -1.835 2.490
2 HA LEU 60 HA LEU 60 -3.645 -1.116 0.065
3 HB2 LEU 60 HB2 LEU 60 -2.568 -2.701 2.364
4 HB3 LEU 60 HB3 LEU 60 -1.596 -2.418 0.934
5 HG LEU 60 HG LEU 60 -1.931 0.004 1.260
6 HD11 LEU 60 HD11 LEU 60 -3.963 -0.030 2.509
7 HD12 LEU 60 HD12 LEU 60 -3.117 -0.754 3.881
8 HD13 LEU 60 HD13 LEU 60 -2.706 0.879 3.351
9 HD21 LEU 60 HD21 LEU 60 0.113 -1.073 2.027
10 HD22 LEU 60 HD22 LEU 60 -0.347 0.242 3.108
11 HD23 LEU 60 HD23 LEU 60 -0.658 -1.431 3.574
No H/Q in entry = 11
In of MODEL 13
1 H LYS 61 H LYS 61 -4.676 -4.319 1.168
2 HA LYS 61 HA LYS 61 -3.526 -5.783 -0.952
3 HB2 LYS 61 HB2 LYS 61 -5.794 -6.310 0.936
4 HB3 LYS 61 HB3 LYS 61 -5.512 -7.388 -0.422
5 HG2 LYS 61 HG2 LYS 61 -3.262 -7.843 0.384
6 HG3 LYS 61 HG3 LYS 61 -3.510 -6.725 1.729
7 HD2 LYS 61 HD2 LYS 61 -5.350 -8.115 2.543
8 HD3 LYS 61 HD3 LYS 61 -5.107 -9.228 1.199
9 HE2 LYS 61 HE2 LYS 61 -2.946 -9.847 2.019
10 HE3 LYS 61 HE3 LYS 61 -2.998 -8.588 3.251
11 HZ1 LYS 61 HZ1 LYS 61 -4.969 -9.759 4.187
12 HZ2 LYS 61 HZ2 LYS 61 -4.672 -11.030 3.111
13 HZ3 LYS 61 HZ3 LYS 61 -3.521 -10.638 4.291
No H/Q in entry = 13
In of MODEL 13
1 H GLY 62 H GLY 62 -6.857 -4.540 -0.522
2 HA2 GLY 62 HA2 GLY 62 -8.368 -3.793 -2.081
3 HA3 GLY 62 HA3 GLY 62 -7.812 -5.133 -3.076
No H/Q in entry = 3
In of MODEL 13
1 H GLY 63 H GLY 63 -5.954 -2.331 -1.941
2 HA2 GLY 63 HA2 GLY 63 -4.620 -0.869 -3.109
3 HA3 GLY 63 HA3 GLY 63 -5.861 -0.906 -4.357
No H/Q in entry = 3
In of MODEL 13
1 H CYS 64 H CYS 64 -3.711 -3.395 -3.087
2 HA CYS 64 HA CYS 64 -1.997 -3.586 -5.309
3 HB2 CYS 64 HB2 CYS 64 -1.481 -4.526 -3.092
4 HB3 CYS 64 HB3 CYS 64 -2.788 -5.684 -3.279
No H/Q in entry = 4
In of MODEL 13
1 H ARG 65 H ARG 65 -5.146 -4.883 -4.638
2 HA ARG 65 HA ARG 65 -5.165 -6.889 -6.643
3 HB2 ARG 65 HB2 ARG 65 -6.686 -6.726 -4.614
4 HB3 ARG 65 HB3 ARG 65 -7.571 -5.482 -5.486
5 HG2 ARG 65 HG2 ARG 65 -8.037 -7.100 -7.277
6 HG3 ARG 65 HG3 ARG 65 -7.202 -8.343 -6.344
7 HD2 ARG 65 HD2 ARG 65 -9.654 -6.821 -5.468
8 HD3 ARG 65 HD3 ARG 65 -9.627 -8.479 -6.065
9 HE ARG 65 HE ARG 65 -7.888 -8.345 -3.898
10 HH11 ARG 65 HH11 ARG 65 -11.307 -7.991 -4.548
11 HH12 ARG 65 HH12 ARG 65 -11.792 -8.524 -2.970
12 HH21 ARG 65 HH21 ARG 65 -8.531 -9.047 -1.804
13 HH22 ARG 65 HH22 ARG 65 -10.217 -9.135 -1.419
No H/Q in entry = 13
In of MODEL 13
1 H GLU 66 H GLU 66 -5.653 -3.453 -6.672
2 HA GLU 66 HA GLU 66 -6.766 -3.547 -9.359
3 HB2 GLU 66 HB2 GLU 66 -6.056 -1.173 -7.627
4 HB3 GLU 66 HB3 GLU 66 -6.811 -1.079 -9.212
5 HG2 GLU 66 HG2 GLU 66 -8.630 -2.588 -8.161
6 HG3 GLU 66 HG3 GLU 66 -7.953 -2.040 -6.628
No H/Q in entry = 6
In of MODEL 13
1 H ILE 67 H ILE 67 -3.789 -2.661 -7.676
2 HA ILE 67 HA ILE 67 -2.549 -1.765 -10.119
3 HB ILE 67 HB ILE 67 -1.295 -2.269 -7.421
4 HG12 ILE 67 HG12 ILE 67 -2.028 0.359 -8.732
5 HG13 ILE 67 HG13 ILE 67 -3.016 -0.443 -7.512
6 HG21 ILE 67 HG21 ILE 67 0.316 -2.454 -9.286
7 HG22 ILE 67 HG22 ILE 67 -0.163 -0.838 -9.831
8 HG23 ILE 67 HG23 ILE 67 0.629 -1.038 -8.269
9 HD11 ILE 67 HD11 ILE 67 -1.169 -0.256 -5.916
10 HD12 ILE 67 HD12 ILE 67 -0.211 0.580 -7.136
11 HD13 ILE 67 HD13 ILE 67 -1.689 1.318 -6.521
No H/Q in entry = 11
In of MODEL 13
1 H LEU 68 H LEU 68 -1.490 -4.239 -7.775
2 HA LEU 68 HA LEU 68 0.452 -5.193 -9.599
3 HB2 LEU 68 HB2 LEU 68 0.639 -5.306 -7.105
4 HB3 LEU 68 HB3 LEU 68 -0.557 -6.588 -7.125
5 HG LEU 68 HG LEU 68 1.088 -7.788 -8.735
6 HD11 LEU 68 HD11 LEU 68 2.942 -5.821 -7.403
7 HD12 LEU 68 HD12 LEU 68 3.435 -7.218 -8.357
8 HD13 LEU 68 HD13 LEU 68 2.557 -5.896 -9.122
9 HD21 LEU 68 HD21 LEU 68 1.731 -7.444 -5.810
10 HD22 LEU 68 HD22 LEU 68 0.564 -8.576 -6.496
11 HD23 LEU 68 HD23 LEU 68 2.284 -8.767 -6.837
No H/Q in entry = 11
In of MODEL 13
1 H LYS 69 H LYS 69 -2.596 -6.570 -8.396
2 HA LYS 69 HA LYS 69 -2.577 -8.976 -9.697
3 HB2 LYS 69 HB2 LYS 69 -4.393 -8.161 -8.202
4 HB3 LYS 69 HB3 LYS 69 -4.954 -7.110 -9.490
5 HG2 LYS 69 HG2 LYS 69 -5.224 -9.223 -10.884
6 HG3 LYS 69 HG3 LYS 69 -4.995 -10.096 -9.370
7 HD2 LYS 69 HD2 LYS 69 -7.323 -9.916 -9.624
8 HD3 LYS 69 HD3 LYS 69 -6.892 -8.679 -8.443
9 HE2 LYS 69 HE2 LYS 69 -6.889 -6.998 -10.250
10 HE3 LYS 69 HE3 LYS 69 -7.390 -8.248 -11.387
11 HZ1 LYS 69 HZ1 LYS 69 -9.399 -8.562 -10.028
12 HZ2 LYS 69 HZ2 LYS 69 -8.932 -7.271 -9.043
13 HZ3 LYS 69 HZ3 LYS 69 -9.290 -7.006 -10.676
No H/Q in entry = 13
In of MODEL 13
1 H HIS 70 H HIS 70 -4.676 -6.509 -11.194
2 HA HIS 70 HA HIS 70 -4.459 -6.815 -13.764
3 HB2 HIS 70 HB2 HIS 70 -5.620 -4.928 -13.324
4 HB3 HIS 70 HB3 HIS 70 -4.544 -4.445 -12.027
5 HD1 HIS 70 HD1 HIS 70 -5.422 -3.715 -15.499
6 HD2 HIS 70 HD2 HIS 70 -2.188 -2.975 -12.978
7 HE1 HIS 70 HE1 HIS 70 -4.139 -1.836 -16.570
8 HE2 HIS 70 HE2 HIS 70 -2.115 -1.512 -15.109
No H/Q in entry = 8
In of MODEL 13
1 H VAL 71 H VAL 71 -1.612 -5.745 -11.933
2 HA VAL 71 HA VAL 71 -0.321 -4.667 -14.222
3 HB VAL 71 HB VAL 71 -0.049 -4.257 -11.582
4 HG11 VAL 71 HG11 VAL 71 1.234 -6.328 -11.267
5 HG12 VAL 71 HG12 VAL 71 2.475 -5.671 -12.338
6 HG13 VAL 71 HG13 VAL 71 2.097 -4.854 -10.814
7 HG21 VAL 71 HG21 VAL 71 1.946 -3.665 -13.723
8 HG22 VAL 71 HG22 VAL 71 0.511 -2.724 -13.315
9 HG23 VAL 71 HG23 VAL 71 1.840 -2.855 -12.161
No H/Q in entry = 9
In of MODEL 13
1 H VAL 72 H VAL 72 0.232 -7.729 -12.424
2 HA VAL 72 HA VAL 72 1.663 -8.780 -14.713
3 HB VAL 72 HB VAL 72 1.893 -9.736 -12.370
4 HG11 VAL 72 HG11 VAL 72 -0.809 -10.902 -12.973
5 HG12 VAL 72 HG12 VAL 72 0.248 -11.426 -11.661
6 HG13 VAL 72 HG13 VAL 72 -0.401 -9.786 -11.670
7 HG21 VAL 72 HG21 VAL 72 1.172 -11.612 -14.592
8 HG22 VAL 72 HG22 VAL 72 2.753 -10.893 -14.287
9 HG23 VAL 72 HG23 VAL 72 2.076 -12.048 -13.139
No H/Q in entry = 9
In of MODEL 13
1 H GLY 73 H GLY 73 -1.652 -8.489 -13.621
2 HA2 GLY 73 HA2 GLY 73 -2.483 -9.768 -16.150
3 HA3 GLY 73 HA3 GLY 73 -3.257 -8.331 -15.498
No H/Q in entry = 3
In of MODEL 13
1 H GLU 74 H GLU 74 -5.201 -9.658 -15.733
2 HA GLU 74 HA GLU 74 -5.984 -10.655 -13.205
3 HB2 GLU 74 HB2 GLU 74 -7.369 -10.757 -15.882
4 HB3 GLU 74 HB3 GLU 74 -8.098 -11.323 -14.389
5 HG2 GLU 74 HG2 GLU 74 -8.950 -9.168 -14.749
6 HG3 GLU 74 HG3 GLU 74 -7.745 -9.003 -13.474
No H/Q in entry = 6
In of MODEL 13
1 H GLU 75 H GLU 75 -4.338 -12.132 -15.747
2 HA GLU 75 HA GLU 75 -5.245 -14.794 -15.359
3 HB2 GLU 75 HB2 GLU 75 -2.842 -15.264 -16.360
4 HB3 GLU 75 HB3 GLU 75 -4.188 -14.729 -17.358
5 HG2 GLU 75 HG2 GLU 75 -3.370 -12.593 -17.544
6 HG3 GLU 75 HG3 GLU 75 -2.335 -12.745 -16.138
No H/Q in entry = 6
In of MODEL 13
1 H LYS 76 H LYS 76 -2.148 -13.338 -14.423
2 HA LYS 76 HA LYS 76 -1.321 -15.658 -13.093
3 HB2 LYS 76 HB2 LYS 76 -0.285 -12.844 -13.232
4 HB3 LYS 76 HB3 LYS 76 0.513 -14.078 -12.286
5 HG2 LYS 76 HG2 LYS 76 -0.051 -14.405 -15.215
6 HG3 LYS 76 HG3 LYS 76 1.427 -13.667 -14.598
7 HD2 LYS 76 HD2 LYS 76 2.208 -15.776 -14.672
8 HD3 LYS 76 HD3 LYS 76 1.364 -15.927 -13.131
9 HE2 LYS 76 HE2 LYS 76 0.835 -17.796 -14.507
10 HE3 LYS 76 HE3 LYS 76 -0.598 -16.799 -14.334
11 HZ1 LYS 76 HZ1 LYS 76 -0.110 -15.820 -16.524
12 HZ2 LYS 76 HZ2 LYS 76 1.197 -16.883 -16.688
13 HZ3 LYS 76 HZ3 LYS 76 -0.378 -17.490 -16.605
No H/Q in entry = 13
In of MODEL 13
1 H ALA 77 H ALA 77 -2.344 -12.497 -11.883
2 HA ALA 77 HA ALA 77 -1.904 -13.138 -9.182
3 HB1 ALA 77 HB1 ALA 77 -1.989 -10.857 -9.909
4 HB2 ALA 77 HB2 ALA 77 -3.246 -11.138 -8.702
5 HB3 ALA 77 HB3 ALA 77 -3.670 -11.046 -10.412
No H/Q in entry = 5
In of MODEL 13
1 H ALA 78 H ALA 78 -4.490 -13.845 -11.353
2 HA ALA 78 HA ALA 78 -6.466 -14.458 -9.388
3 HB1 ALA 78 HB1 ALA 78 -7.219 -14.053 -11.602
4 HB2 ALA 78 HB2 ALA 78 -7.485 -15.769 -11.289
5 HB3 ALA 78 HB3 ALA 78 -6.111 -15.255 -12.273
No H/Q in entry = 5
In of MODEL 13
1 H GLU 79 H GLU 79 -3.959 -16.236 -11.091
2 HA GLU 79 HA GLU 79 -4.644 -18.785 -10.036
3 HB2 GLU 79 HB2 GLU 79 -1.967 -17.915 -11.135
4 HB3 GLU 79 HB3 GLU 79 -2.584 -19.559 -11.016
5 HG2 GLU 79 HG2 GLU 79 -4.483 -18.704 -12.534
6 HG3 GLU 79 HG3 GLU 79 -3.380 -17.372 -12.876
No H/Q in entry = 6
In of MODEL 13
1 H LEU 80 H LEU 80 -2.751 -16.116 -8.904
2 HA LEU 80 HA LEU 80 -1.376 -17.669 -6.896
3 HB2 LEU 80 HB2 LEU 80 -1.581 -14.671 -7.020
4 HB3 LEU 80 HB3 LEU 80 -0.297 -15.645 -6.321
5 HG LEU 80 HG LEU 80 -0.910 -15.530 -9.271
6 HD11 LEU 80 HD11 LEU 80 -0.169 -13.364 -8.400
7 HD12 LEU 80 HD12 LEU 80 1.291 -14.134 -7.788
8 HD13 LEU 80 HD13 LEU 80 0.978 -14.088 -9.522
9 HD21 LEU 80 HD21 LEU 80 0.197 -17.585 -8.525
10 HD22 LEU 80 HD22 LEU 80 1.236 -16.602 -9.557
11 HD23 LEU 80 HD23 LEU 80 1.489 -16.619 -7.808
No H/Q in entry = 11
In of MODEL 13
1 H LYS 81 H LYS 81 -4.138 -15.519 -7.117
2 HA LYS 81 HA LYS 81 -4.792 -15.459 -4.366
3 HB2 LYS 81 HB2 LYS 81 -5.721 -14.019 -6.297
4 HB3 LYS 81 HB3 LYS 81 -6.780 -15.375 -6.643
5 HG2 LYS 81 HG2 LYS 81 -6.691 -13.960 -3.989
6 HG3 LYS 81 HG3 LYS 81 -7.798 -13.541 -5.293
7 HD2 LYS 81 HD2 LYS 81 -8.724 -15.819 -5.215
8 HD3 LYS 81 HD3 LYS 81 -7.629 -16.205 -3.884
9 HE2 LYS 81 HE2 LYS 81 -8.668 -14.386 -2.565
10 HE3 LYS 81 HE3 LYS 81 -9.813 -14.126 -3.877
11 HZ1 LYS 81 HZ1 LYS 81 -9.501 -16.693 -2.420
12 HZ2 LYS 81 HZ2 LYS 81 -10.679 -15.527 -2.061
13 HZ3 LYS 81 HZ3 LYS 81 -10.692 -16.307 -3.562
No H/Q in entry = 13
In of MODEL 13
1 H ASN 82 H ASN 82 -5.853 -17.506 -7.062
2 HA ASN 82 HA ASN 82 -7.486 -19.221 -5.529
3 HB2 ASN 82 HB2 ASN 82 -7.638 -19.023 -7.993
4 HB3 ASN 82 HB3 ASN 82 -6.053 -19.761 -8.147
5 HD21 ASN 82 HD21 ASN 82 -9.403 -20.290 -7.479
6 HD22 ASN 82 HD22 ASN 82 -9.357 -22.017 -7.574
No H/Q in entry = 6
In of MODEL 13
1 H LEU 83 H LEU 83 -4.050 -19.169 -6.170
2 HA LEU 83 HA LEU 83 -3.413 -21.770 -5.405
3 HB2 LEU 83 HB2 LEU 83 -2.014 -19.189 -5.636
4 HB3 LEU 83 HB3 LEU 83 -1.287 -20.335 -4.547
5 HG LEU 83 HG LEU 83 -1.904 -20.890 -7.445
6 HD11 LEU 83 HD11 LEU 83 0.708 -20.206 -6.104
7 HD12 LEU 83 HD12 LEU 83 0.526 -20.748 -7.775
8 HD13 LEU 83 HD13 LEU 83 -0.171 -19.211 -7.266
9 HD21 LEU 83 HD21 LEU 83 -1.896 -22.900 -6.050
10 HD22 LEU 83 HD22 LEU 83 -0.505 -22.865 -7.133
11 HD23 LEU 83 HD23 LEU 83 -0.303 -22.465 -5.428
No H/Q in entry = 11
In of MODEL 13
1 H LYS 84 H LYS 84 -3.817 -18.804 -3.513
2 HA LYS 84 HA LYS 84 -2.917 -19.854 -1.052
3 HB2 LYS 84 HB2 LYS 84 -3.150 -17.439 -1.458
4 HB3 LYS 84 HB3 LYS 84 -4.900 -17.617 -1.543
5 HG2 LYS 84 HG2 LYS 84 -4.894 -18.410 0.797
6 HG3 LYS 84 HG3 LYS 84 -3.158 -18.120 0.867
7 HD2 LYS 84 HD2 LYS 84 -5.260 -16.028 0.315
8 HD3 LYS 84 HD3 LYS 84 -4.464 -16.286 1.863
9 HE2 LYS 84 HE2 LYS 84 -2.308 -15.764 0.840
10 HE3 LYS 84 HE3 LYS 84 -3.103 -15.510 -0.713
11 HZ1 LYS 84 HZ1 LYS 84 -3.725 -13.952 1.734
12 HZ2 LYS 84 HZ2 LYS 84 -2.638 -13.446 0.546
13 HZ3 LYS 84 HZ3 LYS 84 -4.273 -13.645 0.162
No H/Q in entry = 13
In of MODEL 13
1 H ASP 85 H ASP 85 -6.217 -19.452 -2.340
2 HA ASP 85 HA ASP 85 -7.505 -20.677 -0.141
3 HB2 ASP 85 HB2 ASP 85 -8.386 -20.157 -2.974
4 HB3 ASP 85 HB3 ASP 85 -9.437 -20.916 -1.784
No H/Q in entry = 4
In of MODEL 13
1 H SER 86 H SER 86 -6.010 -22.005 -2.998
2 HA SER 86 HA SER 86 -7.287 -24.570 -2.743
3 HB2 SER 86 HB2 SER 86 -6.395 -23.642 -4.914
4 HB3 SER 86 HB3 SER 86 -4.770 -23.904 -4.288
5 HG SER 86 HG SER 86 -6.142 -26.151 -3.944
No H/Q in entry = 5
In of MODEL 13
1 H GLY 87 H GLY 87 -4.705 -22.973 -1.213
2 HA2 GLY 87 HA2 GLY 87 -4.062 -25.518 0.134
3 HA3 GLY 87 HA3 GLY 87 -4.053 -23.944 0.916
No H/Q in entry = 3
In of MODEL 13
1 H ALA 88 H ALA 88 -2.696 -23.053 -1.806
2 HA ALA 88 HA ALA 88 -0.133 -24.122 -1.740
3 HB1 ALA 88 HB1 ALA 88 -0.707 -21.251 -2.397
4 HB2 ALA 88 HB2 ALA 88 -1.184 -22.574 -3.461
5 HB3 ALA 88 HB3 ALA 88 0.517 -22.319 -3.086
No H/Q in entry = 5
In of MODEL 13
1 H SER 89 H SER 89 1.532 -23.721 -0.439
2 HA SER 89 HA SER 89 1.310 -22.379 2.026
3 HB2 SER 89 HB2 SER 89 3.846 -23.195 0.600
4 HB3 SER 89 HB3 SER 89 3.595 -23.012 2.328
5 HG SER 89 HG SER 89 1.946 -24.728 2.040
No H/Q in entry = 5
In of MODEL 13
1 H LYS 90 H LYS 90 2.770 -20.565 2.715
2 HA LYS 90 HA LYS 90 2.332 -18.268 1.218
3 HB2 LYS 90 HB2 LYS 90 4.516 -18.776 3.243
4 HB3 LYS 90 HB3 LYS 90 4.018 -17.191 2.668
5 HG2 LYS 90 HG2 LYS 90 1.802 -17.530 3.615
6 HG3 LYS 90 HG3 LYS 90 2.278 -19.135 4.172
7 HD2 LYS 90 HD2 LYS 90 4.011 -18.125 5.578
8 HD3 LYS 90 HD3 LYS 90 3.524 -16.523 5.026
9 HE2 LYS 90 HE2 LYS 90 1.790 -18.474 6.534
10 HE3 LYS 90 HE3 LYS 90 2.580 -17.057 7.222
11 HZ1 LYS 90 HZ1 LYS 90 1.287 -15.692 5.646
12 HZ2 LYS 90 HZ2 LYS 90 0.450 -17.079 5.159
13 HZ3 LYS 90 HZ3 LYS 90 0.322 -16.525 6.754
No H/Q in entry = 13
In of MODEL 13
1 H GLU 91 H GLU 91 5.022 -20.483 1.208
2 HA GLU 91 HA GLU 91 6.844 -19.037 -0.370
3 HB2 GLU 91 HB2 GLU 91 7.327 -21.051 0.998
4 HB3 GLU 91 HB3 GLU 91 6.470 -22.022 -0.191
5 HG2 GLU 91 HG2 GLU 91 8.092 -21.178 -1.902
6 HG3 GLU 91 HG3 GLU 91 9.005 -20.469 -0.570
No H/Q in entry = 6
In of MODEL 13
1 H GLU 92 H GLU 92 4.139 -21.136 -1.312
2 HA GLU 92 HA GLU 92 4.820 -21.378 -4.034
3 HB2 GLU 92 HB2 GLU 92 2.094 -21.513 -2.772
4 HB3 GLU 92 HB3 GLU 92 2.617 -22.279 -4.259
5 HG2 GLU 92 HG2 GLU 92 3.761 -22.943 -1.579
6 HG3 GLU 92 HG3 GLU 92 2.378 -23.769 -2.273
No H/Q in entry = 6
In of MODEL 13
1 H LEU 93 H LEU 93 2.811 -19.166 -2.132
2 HA LEU 93 HA LEU 93 2.317 -17.474 -4.401
3 HB2 LEU 93 HB2 LEU 93 2.287 -16.850 -1.443
4 HB3 LEU 93 HB3 LEU 93 1.865 -15.681 -2.683
5 HG LEU 93 HG LEU 93 0.251 -17.750 -3.374
6 HD11 LEU 93 HD11 LEU 93 0.903 -19.079 -1.446
7 HD12 LEU 93 HD12 LEU 93 0.370 -17.788 -0.370
8 HD13 LEU 93 HD13 LEU 93 -0.803 -18.633 -1.383
9 HD21 LEU 93 HD21 LEU 93 -0.372 -15.393 -3.135
10 HD22 LEU 93 HD22 LEU 93 -1.561 -16.476 -2.410
11 HD23 LEU 93 HD23 LEU 93 -0.428 -15.595 -1.383
No H/Q in entry = 11
In of MODEL 13
1 H LYS 94 H LYS 94 4.970 -17.688 -2.002
2 HA LYS 94 HA LYS 94 5.871 -15.092 -2.708
3 HB2 LYS 94 HB2 LYS 94 6.352 -16.067 -0.517
4 HB3 LYS 94 HB3 LYS 94 7.344 -17.308 -1.268
5 HG2 LYS 94 HG2 LYS 94 8.720 -15.565 -0.298
6 HG3 LYS 94 HG3 LYS 94 8.897 -15.601 -2.053
7 HD2 LYS 94 HD2 LYS 94 7.084 -13.785 -2.070
8 HD3 LYS 94 HD3 LYS 94 7.429 -13.615 -0.350
9 HE2 LYS 94 HE2 LYS 94 8.714 -12.002 -1.629
10 HE3 LYS 94 HE3 LYS 94 9.789 -13.187 -0.890
11 HZ1 LYS 94 HZ1 LYS 94 9.822 -14.369 -3.039
12 HZ2 LYS 94 HZ2 LYS 94 8.907 -13.123 -3.732
13 HZ3 LYS 94 HZ3 LYS 94 10.461 -12.810 -3.138
No H/Q in entry = 13
In of MODEL 13
1 H ALA 95 H ALA 95 6.808 -18.304 -3.638
2 HA ALA 95 HA ALA 95 9.016 -17.405 -5.237
3 HB1 ALA 95 HB1 ALA 95 9.110 -19.557 -4.122
4 HB2 ALA 95 HB2 ALA 95 9.205 -19.770 -5.870
5 HB3 ALA 95 HB3 ALA 95 7.694 -20.107 -5.020
No H/Q in entry = 5
In of MODEL 13
1 H LYS 96 H LYS 96 5.776 -18.793 -5.888
2 HA LYS 96 HA LYS 96 6.160 -18.851 -8.698
3 HB2 LYS 96 HB2 LYS 96 3.813 -19.154 -6.896
4 HB3 LYS 96 HB3 LYS 96 3.550 -18.954 -8.613
5 HG2 LYS 96 HG2 LYS 96 3.580 -21.313 -7.912
6 HG3 LYS 96 HG3 LYS 96 4.838 -20.941 -9.090
7 HD2 LYS 96 HD2 LYS 96 6.527 -20.990 -7.460
8 HD3 LYS 96 HD3 LYS 96 5.370 -20.897 -6.139
9 HE2 LYS 96 HE2 LYS 96 6.249 -23.143 -6.291
10 HE3 LYS 96 HE3 LYS 96 4.546 -23.146 -6.753
11 HZ1 LYS 96 HZ1 LYS 96 6.844 -23.158 -8.632
12 HZ2 LYS 96 HZ2 LYS 96 5.874 -24.490 -8.252
13 HZ3 LYS 96 HZ3 LYS 96 5.214 -23.171 -9.072
No H/Q in entry = 13
In of MODEL 13
1 H VAL 97 H VAL 97 5.346 -16.330 -6.552
2 HA VAL 97 HA VAL 97 3.941 -14.626 -8.364
3 HB VAL 97 HB VAL 97 5.323 -14.186 -5.732
4 HG11 VAL 97 HG11 VAL 97 5.880 -12.235 -7.087
5 HG12 VAL 97 HG12 VAL 97 4.175 -12.011 -7.469
6 HG13 VAL 97 HG13 VAL 97 4.736 -11.824 -5.810
7 HG21 VAL 97 HG21 VAL 97 2.973 -15.099 -5.992
8 HG22 VAL 97 HG22 VAL 97 3.175 -13.709 -4.926
9 HG23 VAL 97 HG23 VAL 97 2.523 -13.483 -6.549
No H/Q in entry = 9
In of MODEL 13
1 H GLU 98 H GLU 98 7.318 -15.019 -7.387
2 HA GLU 98 HA GLU 98 8.353 -12.831 -8.827
3 HB2 GLU 98 HB2 GLU 98 9.820 -15.400 -8.234
4 HB3 GLU 98 HB3 GLU 98 10.515 -13.811 -8.502
5 HG2 GLU 98 HG2 GLU 98 8.974 -14.787 -6.119
6 HG3 GLU 98 HG3 GLU 98 10.644 -14.237 -6.184
No H/Q in entry = 6
In of MODEL 13
1 H GLU 99 H GLU 99 7.405 -16.014 -9.731
2 HA GLU 99 HA GLU 99 8.736 -16.015 -12.282
3 HB2 GLU 99 HB2 GLU 99 6.527 -17.772 -11.199
4 HB3 GLU 99 HB3 GLU 99 7.388 -18.049 -12.709
5 HG2 GLU 99 HG2 GLU 99 8.668 -17.987 -9.983
6 HG3 GLU 99 HG3 GLU 99 8.198 -19.449 -10.851
No H/Q in entry = 6
In of MODEL 13
1 H ALA 100 H ALA 100 5.503 -15.334 -11.078
2 HA ALA 100 HA ALA 100 4.349 -14.997 -13.672
3 HB1 ALA 100 HB1 ALA 100 3.406 -14.202 -10.920
4 HB2 ALA 100 HB2 ALA 100 2.932 -15.631 -11.848
5 HB3 ALA 100 HB3 ALA 100 2.448 -14.023 -12.390
No H/Q in entry = 5
In of MODEL 13
1 H LEU 101 H LEU 101 5.299 -12.715 -11.102
2 HA LEU 101 HA LEU 101 4.914 -10.412 -12.701
3 HB2 LEU 101 HB2 LEU 101 6.295 -10.950 -10.087
4 HB3 LEU 101 HB3 LEU 101 6.342 -9.367 -10.829
5 HG LEU 101 HG LEU 101 4.630 -9.606 -9.055
6 HD11 LEU 101 HD11 LEU 101 3.639 -9.006 -11.829
7 HD12 LEU 101 HD12 LEU 101 2.793 -8.566 -10.344
8 HD13 LEU 101 HD13 LEU 101 4.378 -7.875 -10.698
9 HD21 LEU 101 HD21 LEU 101 3.960 -11.922 -9.487
10 HD22 LEU 101 HD22 LEU 101 2.581 -10.822 -9.470
11 HD23 LEU 101 HD23 LEU 101 3.221 -11.411 -11.004
No H/Q in entry = 11
In of MODEL 13
1 H HIS 102 H HIS 102 7.265 -12.771 -12.813
2 HA HIS 102 HA HIS 102 9.396 -11.133 -13.829
3 HB2 HIS 102 HB2 HIS 102 9.611 -13.513 -12.938
4 HB3 HIS 102 HB3 HIS 102 8.886 -14.048 -14.446
5 HD1 HIS 102 HD1 HIS 102 10.367 -13.986 -16.554
6 HD2 HIS 102 HD2 HIS 102 12.250 -12.613 -13.110
7 HE1 HIS 102 HE1 HIS 102 12.808 -13.842 -17.133
8 HE2 HIS 102 HE2 HIS 102 13.942 -13.117 -15.005
No H/Q in entry = 8
In of MODEL 13
1 H ALA 103 H ALA 103 6.653 -12.925 -15.080
2 HA ALA 103 HA ALA 103 7.419 -13.006 -17.761
3 HB1 ALA 103 HB1 ALA 103 4.661 -13.228 -16.565
4 HB2 ALA 103 HB2 ALA 103 5.836 -14.544 -16.661
5 HB3 ALA 103 HB3 ALA 103 5.168 -13.847 -18.141
No H/Q in entry = 5
In of MODEL 13
1 H VAL 104 H VAL 104 6.433 -10.291 -16.085
2 HA VAL 104 HA VAL 104 4.746 -9.206 -18.136
3 HB VAL 104 HB VAL 104 4.075 -8.782 -15.932
4 HG11 VAL 104 HG11 VAL 104 6.865 -7.809 -15.464
5 HG12 VAL 104 HG12 VAL 104 5.533 -7.588 -14.329
6 HG13 VAL 104 HG13 VAL 104 6.066 -9.212 -14.751
7 HG21 VAL 104 HG21 VAL 104 5.362 -6.295 -17.041
8 HG22 VAL 104 HG22 VAL 104 3.733 -6.871 -17.369
9 HG23 VAL 104 HG23 VAL 104 4.158 -6.306 -15.755
No H/Q in entry = 9
In of MODEL 13
1 H THR 105 H THR 105 5.228 -7.408 -19.390
2 HA THR 105 HA THR 105 8.050 -6.605 -19.474
3 HB THR 105 HB THR 105 7.900 -6.833 -22.022
4 HG1 THR 105 HG1 THR 105 5.890 -7.398 -22.537
5 HG21 THR 105 HG21 THR 105 9.323 -8.266 -20.632
6 HG22 THR 105 HG22 THR 105 7.953 -9.334 -20.327
7 HG23 THR 105 HG23 THR 105 8.605 -9.179 -21.959
No H/Q in entry = 7
In of MODEL 13
1 H ASP 106 H ASP 106 4.852 -5.559 -19.525
2 HA ASP 106 HA ASP 106 5.314 -3.265 -21.173
3 HB2 ASP 106 HB2 ASP 106 3.046 -4.106 -20.865
4 HB3 ASP 106 HB3 ASP 106 3.168 -3.845 -19.132
No H/Q in entry = 4
In of MODEL 13
1 H GLU 107 H GLU 107 6.166 -1.400 -20.638
2 HA GLU 107 HA GLU 107 7.982 -1.342 -18.584
3 HB2 GLU 107 HB2 GLU 107 8.262 1.080 -19.124
4 HB3 GLU 107 HB3 GLU 107 8.337 0.006 -20.510
5 HG2 GLU 107 HG2 GLU 107 6.092 0.614 -21.153
6 HG3 GLU 107 HG3 GLU 107 5.914 1.598 -19.702
No H/Q in entry = 6
In of MODEL 13
1 H GLU 108 H GLU 108 4.981 0.549 -18.703
2 HA GLU 108 HA GLU 108 5.261 1.785 -16.204
3 HB2 GLU 108 HB2 GLU 108 2.790 1.097 -17.787
4 HB3 GLU 108 HB3 GLU 108 2.749 2.039 -16.303
5 HG2 GLU 108 HG2 GLU 108 4.286 2.795 -18.775
6 HG3 GLU 108 HG3 GLU 108 2.694 3.413 -18.343
No H/Q in entry = 6
In of MODEL 13
1 H LYS 109 H LYS 109 3.712 -1.280 -17.098
2 HA LYS 109 HA LYS 109 2.687 -1.897 -14.568
3 HB2 LYS 109 HB2 LYS 109 3.370 -3.495 -17.005
4 HB3 LYS 109 HB3 LYS 109 2.879 -4.318 -15.527
5 HG2 LYS 109 HG2 LYS 109 0.744 -3.461 -15.587
6 HG3 LYS 109 HG3 LYS 109 1.217 -2.062 -16.539
7 HD2 LYS 109 HD2 LYS 109 -0.174 -3.595 -17.832
8 HD3 LYS 109 HD3 LYS 109 1.440 -3.473 -18.518
9 HE2 LYS 109 HE2 LYS 109 2.060 -5.589 -17.552
10 HE3 LYS 109 HE3 LYS 109 0.531 -5.682 -16.682
11 HZ1 LYS 109 HZ1 LYS 109 -0.608 -5.766 -18.836
12 HZ2 LYS 109 HZ2 LYS 109 0.882 -5.767 -19.630
13 HZ3 LYS 109 HZ3 LYS 109 0.453 -7.064 -18.630
No H/Q in entry = 13
In of MODEL 13
1 H LYS 110 H LYS 110 5.882 -2.394 -15.951
2 HA LYS 110 HA LYS 110 6.767 -3.900 -13.651
3 HB2 LYS 110 HB2 LYS 110 8.376 -2.729 -15.923
4 HB3 LYS 110 HB3 LYS 110 8.978 -3.854 -14.717
5 HG2 LYS 110 HG2 LYS 110 7.244 -5.485 -15.540
6 HG3 LYS 110 HG3 LYS 110 6.960 -4.369 -16.880
7 HD2 LYS 110 HD2 LYS 110 9.637 -5.581 -16.190
8 HD3 LYS 110 HD3 LYS 110 8.549 -6.198 -17.434
9 HE2 LYS 110 HE2 LYS 110 8.722 -4.097 -18.648
10 HE3 LYS 110 HE3 LYS 110 9.749 -3.432 -17.380
11 HZ1 LYS 110 HZ1 LYS 110 10.429 -5.782 -19.068
12 HZ2 LYS 110 HZ2 LYS 110 11.031 -4.217 -19.288
13 HZ3 LYS 110 HZ3 LYS 110 11.417 -5.081 -17.888
No H/Q in entry = 13
In of MODEL 13
1 H GLN 111 H GLN 111 6.585 -0.608 -14.582
2 HA GLN 111 HA GLN 111 8.431 0.449 -12.696
3 HB2 GLN 111 HB2 GLN 111 5.929 1.653 -13.890
4 HB3 GLN 111 HB3 GLN 111 7.053 2.542 -12.869
5 HG2 GLN 111 HG2 GLN 111 7.663 1.296 -15.541
6 HG3 GLN 111 HG3 GLN 111 7.467 3.014 -15.201
7 HE21 GLN 111 HE21 GLN 111 9.524 0.252 -14.899
8 HE22 GLN 111 HE22 GLN 111 10.941 1.098 -14.390
No H/Q in entry = 8
In of MODEL 13
1 H TYR 112 H TYR 112 5.020 -0.423 -12.533
2 HA TYR 112 HA TYR 112 4.596 0.404 -9.842
3 HB2 TYR 112 HB2 TYR 112 3.210 -1.695 -11.508
4 HB3 TYR 112 HB3 TYR 112 2.665 -1.188 -9.915
5 HD1 TYR 112 HD1 TYR 112 2.857 1.679 -9.940
6 HD2 TYR 112 HD2 TYR 112 1.723 -0.932 -13.094
7 HE1 TYR 112 HE1 TYR 112 1.559 3.495 -10.971
8 HE2 TYR 112 HE2 TYR 112 0.417 0.865 -14.133
9 HH TYR 112 HH TYR 112 0.689 4.127 -13.134
No H/Q in entry = 9
In of MODEL 13
1 H ILE 113 H ILE 113 5.760 -2.542 -11.352
2 HA ILE 113 HA ILE 113 5.888 -4.121 -9.044
3 HB ILE 113 HB ILE 113 7.494 -4.213 -11.582
4 HG12 ILE 113 HG12 ILE 113 5.158 -5.817 -10.531
5 HG13 ILE 113 HG13 ILE 113 5.085 -4.593 -11.795
6 HG21 ILE 113 HG21 ILE 113 7.392 -6.241 -9.350
7 HG22 ILE 113 HG22 ILE 113 8.140 -6.492 -10.927
8 HG23 ILE 113 HG23 ILE 113 8.792 -5.279 -9.823
9 HD11 ILE 113 HD11 ILE 113 6.618 -7.167 -11.953
10 HD12 ILE 113 HD12 ILE 113 5.041 -6.862 -12.677
11 HD13 ILE 113 HD13 ILE 113 6.456 -5.963 -13.229
No H/Q in entry = 11
In of MODEL 13
1 H ALA 114 H ALA 114 8.177 -1.740 -10.323
2 HA ALA 114 HA ALA 114 10.227 -2.426 -8.416
3 HB1 ALA 114 HB1 ALA 114 10.826 -1.506 -10.604
4 HB2 ALA 114 HB2 ALA 114 11.428 -0.487 -9.297
5 HB3 ALA 114 HB3 ALA 114 9.994 -0.003 -10.201
No H/Q in entry = 5
In of MODEL 13
1 H ASP 115 H ASP 115 7.859 0.184 -8.777
2 HA ASP 115 HA ASP 115 8.754 1.533 -6.412
3 HB2 ASP 115 HB2 ASP 115 6.368 1.886 -8.206
4 HB3 ASP 115 HB3 ASP 115 6.516 2.795 -6.705
No H/Q in entry = 4
In of MODEL 13
1 H PHE 116 H PHE 116 5.860 -0.339 -7.166
2 HA PHE 116 HA PHE 116 5.122 -0.184 -4.344
3 HB2 PHE 116 HB2 PHE 116 3.384 0.737 -5.615
4 HB3 PHE 116 HB3 PHE 116 3.563 -0.448 -6.897
5 HD1 PHE 116 HD1 PHE 116 2.514 -0.084 -3.375
6 HD2 PHE 116 HD2 PHE 116 2.106 -2.244 -7.015
7 HE1 PHE 116 HE1 PHE 116 0.645 -1.370 -2.404
8 HE2 PHE 116 HE2 PHE 116 0.241 -3.531 -6.054
9 HZ PHE 116 HZ PHE 116 -0.542 -3.079 -3.842
No H/Q in entry = 9
In of MODEL 13
1 H GLY 117 H GLY 117 6.132 -2.380 -6.761
2 HA2 GLY 117 HA2 GLY 117 6.521 -4.641 -6.755
3 HA3 GLY 117 HA3 GLY 117 4.904 -4.761 -6.094
No H/Q in entry = 3
In of MODEL 13
1 HA PRO 118 HA PRO 118 8.496 -6.096 -3.118
2 HB2 PRO 118 HB2 PRO 118 9.964 -4.065 -2.004
3 HB3 PRO 118 HB3 PRO 118 10.459 -4.971 -3.437
4 HG2 PRO 118 HG2 PRO 118 9.106 -2.305 -3.254
5 HG3 PRO 118 HG3 PRO 118 10.452 -2.805 -4.295
6 HD2 PRO 118 HD2 PRO 118 7.961 -2.646 -5.247
7 HD3 PRO 118 HD3 PRO 118 9.056 -3.947 -5.762
No H/Q in entry = 7
In of MODEL 13
1 H ALA 119 H ALA 119 6.722 -3.165 -2.649
2 HA ALA 119 HA ALA 119 6.482 -3.496 0.232
3 HB1 ALA 119 HB1 ALA 119 5.076 -1.462 0.048
4 HB2 ALA 119 HB2 ALA 119 5.340 -1.485 -1.696
5 HB3 ALA 119 HB3 ALA 119 6.704 -1.259 -0.600
No H/Q in entry = 5
In of MODEL 13
1 H CYS 120 H CYS 120 4.533 -3.854 -2.678
2 HA CYS 120 HA CYS 120 2.114 -4.611 -1.506
3 HB2 CYS 120 HB2 CYS 120 2.357 -4.198 -3.904
4 HB3 CYS 120 HB3 CYS 120 3.393 -5.613 -4.054
No H/Q in entry = 4
In of MODEL 13
1 H LYS 121 H LYS 121 5.122 -6.320 -1.881
2 HA LYS 121 HA LYS 121 4.269 -8.939 -1.427
3 HB2 LYS 121 HB2 LYS 121 6.794 -7.477 -1.323
4 HB3 LYS 121 HB3 LYS 121 6.732 -8.816 -0.191
5 HG2 LYS 121 HG2 LYS 121 7.701 -9.456 -2.345
6 HG3 LYS 121 HG3 LYS 121 6.231 -10.358 -1.981
7 HD2 LYS 121 HD2 LYS 121 4.961 -8.823 -3.433
8 HD3 LYS 121 HD3 LYS 121 6.462 -7.982 -3.828
9 HE2 LYS 121 HE2 LYS 121 5.971 -10.915 -4.316
10 HE3 LYS 121 HE3 LYS 121 5.740 -9.655 -5.529
11 HZ1 LYS 121 HZ1 LYS 121 8.324 -9.937 -4.138
12 HZ2 LYS 121 HZ2 LYS 121 7.960 -10.920 -5.465
13 HZ3 LYS 121 HZ3 LYS 121 8.000 -9.234 -5.640
No H/Q in entry = 13
In of MODEL 13
1 H LYS 122 H LYS 122 5.473 -6.590 1.028
2 HA LYS 122 HA LYS 122 4.740 -8.254 3.214
3 HB2 LYS 122 HB2 LYS 122 5.101 -6.345 4.639
4 HB3 LYS 122 HB3 LYS 122 6.368 -6.397 3.427
5 HG2 LYS 122 HG2 LYS 122 5.034 -4.695 2.138
6 HG3 LYS 122 HG3 LYS 122 4.020 -4.536 3.570
7 HD2 LYS 122 HD2 LYS 122 6.996 -4.045 3.435
8 HD3 LYS 122 HD3 LYS 122 5.747 -2.805 3.498
9 HE2 LYS 122 HE2 LYS 122 6.440 -2.906 5.697
10 HE3 LYS 122 HE3 LYS 122 5.046 -3.981 5.703
11 HZ1 LYS 122 HZ1 LYS 122 7.847 -4.920 5.411
12 HZ2 LYS 122 HZ2 LYS 122 7.030 -4.850 6.886
13 HZ3 LYS 122 HZ3 LYS 122 6.473 -5.873 5.665
No H/Q in entry = 13
In of MODEL 13
1 H ILE 123 H ILE 123 2.993 -6.043 1.189
2 HA ILE 123 HA ILE 123 0.776 -5.596 2.850
3 HB ILE 123 HB ILE 123 1.052 -5.514 -0.128
4 HG12 ILE 123 HG12 ILE 123 0.700 -3.385 1.992
5 HG13 ILE 123 HG13 ILE 123 2.225 -3.812 1.223
6 HG21 ILE 123 HG21 ILE 123 -1.366 -4.831 1.541
7 HG22 ILE 123 HG22 ILE 123 -1.159 -4.403 -0.160
8 HG23 ILE 123 HG23 ILE 123 -1.249 -6.097 0.319
9 HD11 ILE 123 HD11 ILE 123 -0.159 -2.795 -0.273
10 HD12 ILE 123 HD12 ILE 123 1.121 -1.764 0.351
11 HD13 ILE 123 HD13 ILE 123 1.489 -2.982 -0.866
No H/Q in entry = 11
In of MODEL 13
1 H TYR 124 H TYR 124 1.267 -7.861 0.275
2 HA TYR 124 HA TYR 124 -0.960 -9.573 0.895
3 HB2 TYR 124 HB2 TYR 124 1.039 -9.351 -1.238
4 HB3 TYR 124 HB3 TYR 124 0.649 -11.014 -0.802
5 HD1 TYR 124 HD1 TYR 124 -0.915 -7.780 -1.770
6 HD2 TYR 124 HD2 TYR 124 -1.299 -12.013 -1.624
7 HE1 TYR 124 HE1 TYR 124 -2.959 -7.633 -3.129
8 HE2 TYR 124 HE2 TYR 124 -3.348 -11.876 -2.981
9 HH TYR 124 HH TYR 124 -5.109 -10.207 -3.485
No H/Q in entry = 9
In of MODEL 13
1 H GLY 125 H GLY 125 0.766 -9.230 3.057
2 HA2 GLY 125 HA2 GLY 125 2.143 -10.360 4.589
3 HA3 GLY 125 HA3 GLY 125 3.216 -9.695 3.395
No H/Q in entry = 3
In of MODEL 13
1 H VAL 126 H VAL 126 2.401 -11.839 1.448
2 HA VAL 126 HA VAL 126 3.463 -14.287 2.123
3 HB VAL 126 HB VAL 126 4.454 -14.367 -0.160
4 HG11 VAL 126 HG11 VAL 126 1.674 -13.218 0.012
5 HG12 VAL 126 HG12 VAL 126 2.351 -14.016 -1.407
6 HG13 VAL 126 HG13 VAL 126 2.121 -14.924 0.090
7 HG21 VAL 126 HG21 VAL 126 3.605 -11.474 -0.266
8 HG22 VAL 126 HG22 VAL 126 5.254 -12.100 -0.362
9 HG23 VAL 126 HG23 VAL 126 4.109 -12.430 -1.663
No H/Q in entry = 9
In of MODEL 13
1 H HIS 127 H HIS 127 5.095 -11.201 1.834
2 HA HIS 127 HA HIS 127 7.735 -12.308 2.266
3 HB2 HIS 127 HB2 HIS 127 7.497 -10.338 0.846
4 HB3 HIS 127 HB3 HIS 127 6.732 -9.450 2.154
5 HD1 HIS 127 HD1 HIS 127 10.090 -11.206 1.647
6 HD2 HIS 127 HD2 HIS 127 8.469 -7.775 3.334
7 HE1 HIS 127 HE1 HIS 127 12.042 -9.920 2.564
8 HE2 HIS 127 HE2 HIS 127 11.053 -7.766 3.412
No H/Q in entry = 8
In of MODEL 13
1 H THR 128 H THR 128 6.178 -13.214 4.206
2 HA THR 128 HA THR 128 7.476 -12.145 6.554
3 HB THR 128 HB THR 128 4.469 -12.458 6.667
4 HG1 THR 128 HG1 THR 128 5.993 -10.321 5.746
5 HG21 THR 128 HG21 THR 128 5.707 -12.603 8.789
6 HG22 THR 128 HG22 THR 128 6.436 -11.031 8.466
7 HG23 THR 128 HG23 THR 128 4.696 -11.159 8.727
No H/Q in entry = 7
In of MODEL 13
1 H SER 129 H SER 129 8.063 -14.401 5.305
2 HA SER 129 HA SER 129 6.677 -16.551 6.759
3 HB2 SER 129 HB2 SER 129 8.211 -16.773 4.157
4 HB3 SER 129 HB3 SER 129 7.244 -18.032 4.925
5 HG SER 129 HG SER 129 6.449 -15.837 3.425
No H/Q in entry = 5
In of MODEL 14
1 HA2 GLY -4 HA2 GLY -4 0.622 7.056 -28.005
2 HA3 GLY -4 HA3 GLY -4 2.147 6.492 -28.674
3 H1 GLY -4 H1 GLY -4 1.736 4.329 -27.684
4 H2 GLY -4 H2 GLY -4 0.477 4.759 -28.721
No H/Q in entry = 4
In of MODEL 14
1 H SER -3 H SER -3 1.629 8.674 -26.766
2 HA SER -3 HA SER -3 3.685 8.031 -24.894
3 HB2 SER -3 HB2 SER -3 3.165 10.357 -24.009
4 HB3 SER -3 HB3 SER -3 3.647 10.272 -25.702
5 HG SER -3 HG SER -3 1.330 11.160 -24.608
No H/Q in entry = 5
In of MODEL 14
1 HA PRO -2 HA PRO -2 0.863 6.230 -21.967
2 HB2 PRO -2 HB2 PRO -2 2.694 5.629 -20.070
3 HB3 PRO -2 HB3 PRO -2 2.522 4.698 -21.563
4 HG2 PRO -2 HG2 PRO -2 4.498 6.834 -20.884
5 HG3 PRO -2 HG3 PRO -2 4.762 5.290 -21.711
6 HD2 PRO -2 HD2 PRO -2 4.547 7.651 -23.029
7 HD3 PRO -2 HD3 PRO -2 4.027 6.105 -23.730
No H/Q in entry = 7
In of MODEL 14
1 H GLU -1 H GLU -1 0.095 8.572 -21.805
2 HA GLU -1 HA GLU -1 0.878 9.767 -19.243
3 HB2 GLU -1 HB2 GLU -1 0.881 11.246 -21.219
4 HB3 GLU -1 HB3 GLU -1 -0.823 10.899 -21.476
5 HG2 GLU -1 HG2 GLU -1 -0.491 13.059 -20.403
6 HG3 GLU -1 HG3 GLU -1 -1.381 11.949 -19.364
No H/Q in entry = 6
In of MODEL 14
1 H PHE 0 H PHE 0 -0.301 9.181 -17.555
2 HA PHE 0 HA PHE 0 -3.176 9.134 -17.765
3 HB2 PHE 0 HB2 PHE 0 -3.387 6.916 -16.680
4 HB3 PHE 0 HB3 PHE 0 -2.709 6.836 -18.302
5 HD1 PHE 0 HD1 PHE 0 -0.133 6.747 -18.458
6 HD2 PHE 0 HD2 PHE 0 -2.348 5.856 -14.951
7 HE1 PHE 0 HE1 PHE 0 1.791 5.485 -17.577
8 HE2 PHE 0 HE2 PHE 0 -0.435 4.588 -14.051
9 HZ PHE 0 HZ PHE 0 1.643 4.370 -15.420
No H/Q in entry = 9
In of MODEL 14
1 H HIS 1 H HIS 1 -4.236 9.344 -15.778
2 HA HIS 1 HA HIS 1 -2.483 10.120 -13.534
3 HB2 HIS 1 HB2 HIS 1 -3.761 11.971 -14.790
4 HB3 HIS 1 HB3 HIS 1 -5.216 11.274 -14.100
5 HD1 HIS 1 HD1 HIS 1 -2.041 13.039 -13.069
6 HD2 HIS 1 HD2 HIS 1 -5.761 12.028 -11.519
7 HE1 HIS 1 HE1 HIS 1 -2.232 14.292 -10.902
8 HE2 HIS 1 HE2 HIS 1 -4.506 13.694 -9.995
No H/Q in entry = 8
In of MODEL 14
1 H HIS 2 H HIS 2 -3.310 7.519 -13.866
2 HA HIS 2 HA HIS 2 -5.784 7.082 -12.422
3 HB2 HIS 2 HB2 HIS 2 -5.118 5.662 -14.362
4 HB3 HIS 2 HB3 HIS 2 -3.769 5.055 -13.412
5 HD1 HIS 2 HD1 HIS 2 -4.422 2.673 -13.011
6 HD2 HIS 2 HD2 HIS 2 -7.532 5.315 -12.215
7 HE1 HIS 2 HE1 HIS 2 -6.261 1.278 -12.019
8 HE2 HIS 2 HE2 HIS 2 -8.148 2.884 -11.584
No H/Q in entry = 8
In of MODEL 14
1 H PHE 3 H PHE 3 -2.323 6.457 -11.938
2 HA PHE 3 HA PHE 3 -2.863 5.621 -9.199
3 HB2 PHE 3 HB2 PHE 3 -0.503 5.410 -11.017
4 HB3 PHE 3 HB3 PHE 3 -0.239 5.375 -9.276
5 HD1 PHE 3 HD1 PHE 3 -1.745 3.716 -7.952
6 HD2 PHE 3 HD2 PHE 3 -0.949 3.431 -12.122
7 HE1 PHE 3 HE1 PHE 3 -2.315 1.325 -7.890
8 HE2 PHE 3 HE2 PHE 3 -1.516 1.035 -12.068
9 HZ PHE 3 HZ PHE 3 -2.198 -0.014 -9.949
No H/Q in entry = 9
In of MODEL 14
1 H THR 4 H THR 4 -3.481 7.544 -8.286
2 HA THR 4 HA THR 4 -1.226 9.283 -7.603
3 HB THR 4 HB THR 4 -2.969 11.181 -7.478
4 HG1 THR 4 HG1 THR 4 -4.590 9.288 -8.275
5 HG21 THR 4 HG21 THR 4 -2.076 10.124 -10.157
6 HG22 THR 4 HG22 THR 4 -2.645 11.766 -9.847
7 HG23 THR 4 HG23 THR 4 -1.160 11.190 -9.089
No H/Q in entry = 7
In of MODEL 14
1 H LEU 5 H LEU 5 -1.330 10.123 -5.501
2 HA LEU 5 HA LEU 5 -2.284 8.233 -3.650
3 HB2 LEU 5 HB2 LEU 5 -0.358 10.157 -3.669
4 HB3 LEU 5 HB3 LEU 5 -1.552 10.898 -2.625
5 HG LEU 5 HG LEU 5 0.157 9.706 -1.345
6 HD11 LEU 5 HD11 LEU 5 -2.547 8.387 -1.197
7 HD12 LEU 5 HD12 LEU 5 -1.307 8.339 0.057
8 HD13 LEU 5 HD13 LEU 5 -2.060 9.872 -0.380
9 HD21 LEU 5 HD21 LEU 5 0.715 8.002 -3.003
10 HD22 LEU 5 HD22 LEU 5 0.343 7.285 -1.436
11 HD23 LEU 5 HD23 LEU 5 -0.847 7.227 -2.735
No H/Q in entry = 11
In of MODEL 14
1 H GLU 6 H GLU 6 -3.551 11.354 -4.680
2 HA GLU 6 HA GLU 6 -5.688 11.577 -2.889
3 HB2 GLU 6 HB2 GLU 6 -5.690 12.227 -5.851
4 HB3 GLU 6 HB3 GLU 6 -6.833 12.845 -4.665
5 HG2 GLU 6 HG2 GLU 6 -5.024 14.002 -3.514
6 HG3 GLU 6 HG3 GLU 6 -3.869 13.366 -4.684
No H/Q in entry = 6
In of MODEL 14
1 H SER 7 H SER 7 -5.411 9.578 -5.870
2 HA SER 7 HA SER 7 -8.044 8.843 -6.116
3 HB2 SER 7 HB2 SER 7 -5.606 7.172 -6.729
4 HB3 SER 7 HB3 SER 7 -7.231 6.874 -7.350
5 HG SER 7 HG SER 7 -7.121 9.003 -8.282
No H/Q in entry = 5
In of MODEL 14
1 H SER 8 H SER 8 -5.896 7.780 -3.609
2 HA SER 8 HA SER 8 -7.553 5.427 -3.151
3 HB2 SER 8 HB2 SER 8 -5.772 4.743 -1.534
4 HB3 SER 8 HB3 SER 8 -5.250 4.890 -3.216
5 HG SER 8 HG SER 8 -4.935 7.259 -1.996
No H/Q in entry = 5
In of MODEL 14
1 H LEU 9 H LEU 9 -7.467 8.603 -1.972
2 HA LEU 9 HA LEU 9 -7.063 8.170 0.739
3 HB2 LEU 9 HB2 LEU 9 -8.479 10.418 -0.634
4 HB3 LEU 9 HB3 LEU 9 -7.915 10.440 1.028
5 HG LEU 9 HG LEU 9 -6.098 9.992 -1.327
6 HD11 LEU 9 HD11 LEU 9 -6.786 12.527 0.124
7 HD12 LEU 9 HD12 LEU 9 -5.452 12.339 -1.016
8 HD13 LEU 9 HD13 LEU 9 -7.111 12.125 -1.563
9 HD21 LEU 9 HD21 LEU 9 -5.559 10.717 1.553
10 HD22 LEU 9 HD22 LEU 9 -5.247 9.153 0.795
11 HD23 LEU 9 HD23 LEU 9 -4.343 10.581 0.282
No H/Q in entry = 11
In of MODEL 14
1 H ASP 10 H ASP 10 -10.051 8.012 -0.991
2 HA ASP 10 HA ASP 10 -11.452 7.552 1.541
3 HB2 ASP 10 HB2 ASP 10 -12.411 8.226 -1.220
4 HB3 ASP 10 HB3 ASP 10 -13.510 7.601 0.008
No H/Q in entry = 4
In of MODEL 14
1 H THR 11 H THR 11 -9.778 5.761 -0.538
2 HA THR 11 HA THR 11 -11.563 3.457 -0.197
3 HB THR 11 HB THR 11 -10.476 2.501 -2.278
4 HG1 THR 11 HG1 THR 11 -9.916 5.141 -3.061
5 HG21 THR 11 HG21 THR 11 -12.165 4.986 -2.581
6 HG22 THR 11 HG22 THR 11 -11.935 3.747 -3.816
7 HG23 THR 11 HG23 THR 11 -12.760 3.348 -2.310
No H/Q in entry = 7
In of MODEL 14
1 H HIS 12 H HIS 12 -8.461 3.134 -1.671
2 HA HIS 12 HA HIS 12 -7.669 1.136 0.083
3 HB2 HIS 12 HB2 HIS 12 -5.783 2.751 -1.626
4 HB3 HIS 12 HB3 HIS 12 -5.546 1.107 -1.051
5 HD1 HIS 12 HD1 HIS 12 -7.712 -0.529 -1.968
6 HD2 HIS 12 HD2 HIS 12 -6.536 2.775 -4.201
7 HE1 HIS 12 HE1 HIS 12 -8.566 -0.945 -4.299
8 HE2 HIS 12 HE2 HIS 12 -8.005 1.154 -5.578
No H/Q in entry = 8
In of MODEL 14
1 H LEU 13 H LEU 13 -6.933 4.593 0.175
2 HA LEU 13 HA LEU 13 -5.120 4.054 2.439
3 HB2 LEU 13 HB2 LEU 13 -5.074 6.066 0.271
4 HB3 LEU 13 HB3 LEU 13 -4.486 6.558 1.846
5 HG LEU 13 HG LEU 13 -2.619 5.836 0.510
6 HD11 LEU 13 HD11 LEU 13 -2.645 5.262 2.922
7 HD12 LEU 13 HD12 LEU 13 -3.242 3.661 2.495
8 HD13 LEU 13 HD13 LEU 13 -1.652 4.182 1.945
9 HD21 LEU 13 HD21 LEU 13 -4.082 3.221 0.179
10 HD22 LEU 13 HD22 LEU 13 -3.770 4.411 -1.082
11 HD23 LEU 13 HD23 LEU 13 -2.428 3.544 -0.337
No H/Q in entry = 11
In of MODEL 14
1 H LYS 14 H LYS 14 -8.018 4.303 2.503
2 HA LYS 14 HA LYS 14 -8.817 6.845 3.456
3 HB2 LYS 14 HB2 LYS 14 -10.926 5.831 3.914
4 HB3 LYS 14 HB3 LYS 14 -10.315 5.132 2.426
5 HG2 LYS 14 HG2 LYS 14 -9.476 3.204 3.836
6 HG3 LYS 14 HG3 LYS 14 -10.438 3.880 5.152
7 HD2 LYS 14 HD2 LYS 14 -11.437 2.915 2.473
8 HD3 LYS 14 HD3 LYS 14 -11.716 2.165 4.045
9 HE2 LYS 14 HE2 LYS 14 -12.972 4.151 4.753
10 HE3 LYS 14 HE3 LYS 14 -12.707 4.874 3.165
11 HZ1 LYS 14 HZ1 LYS 14 -13.907 3.001 2.186
12 HZ2 LYS 14 HZ2 LYS 14 -14.213 2.381 3.728
13 HZ3 LYS 14 HZ3 LYS 14 -14.871 3.870 3.267
No H/Q in entry = 13
In of MODEL 14
1 H TRP 15 H TRP 15 -7.262 4.216 4.966
2 HA TRP 15 HA TRP 15 -8.207 4.664 7.629
3 HB2 TRP 15 HB2 TRP 15 -6.366 3.070 8.233
4 HB3 TRP 15 HB3 TRP 15 -7.497 2.448 7.033
5 HD1 TRP 15 HD1 TRP 15 -6.608 2.197 4.524
6 HE1 TRP 15 HE1 TRP 15 -4.234 2.005 3.555
7 HE3 TRP 15 HE3 TRP 15 -3.952 3.843 8.569
8 HZ2 TRP 15 HZ2 TRP 15 -1.582 2.486 4.399
9 HZ3 TRP 15 HZ3 TRP 15 -1.499 3.945 8.404
10 HH2 TRP 15 HH2 TRP 15 -0.340 3.279 6.362
No H/Q in entry = 10
In of MODEL 14
1 H LEU 16 H LEU 16 -6.075 6.349 5.674
2 HA LEU 16 HA LEU 16 -4.274 7.240 7.733
3 HB2 LEU 16 HB2 LEU 16 -4.945 8.404 5.020
4 HB3 LEU 16 HB3 LEU 16 -3.704 9.033 6.081
5 HG LEU 16 HG LEU 16 -3.651 6.235 4.941
6 HD11 LEU 16 HD11 LEU 16 -3.567 7.912 3.150
7 HD12 LEU 16 HD12 LEU 16 -2.216 8.703 3.968
8 HD13 LEU 16 HD13 LEU 16 -2.031 7.065 3.337
9 HD21 LEU 16 HD21 LEU 16 -1.552 7.933 6.291
10 HD22 LEU 16 HD22 LEU 16 -2.302 6.473 6.938
11 HD23 LEU 16 HD23 LEU 16 -1.250 6.375 5.522
No H/Q in entry = 11
In of MODEL 14
1 H SER 17 H SER 17 -4.347 9.145 8.846
2 HA SER 17 HA SER 17 -6.951 10.264 9.332
3 HB2 SER 17 HB2 SER 17 -5.319 10.003 11.164
4 HB3 SER 17 HB3 SER 17 -4.239 11.130 10.356
5 HG SER 17 HG SER 17 -5.789 11.873 12.121
No H/Q in entry = 5
In of MODEL 14
1 H GLN 18 H GLN 18 -7.364 12.669 9.172
2 HA GLN 18 HA GLN 18 -6.944 13.574 6.572
3 HB2 GLN 18 HB2 GLN 18 -7.623 15.091 9.097
4 HB3 GLN 18 HB3 GLN 18 -7.540 15.874 7.527
5 HG2 GLN 18 HG2 GLN 18 -9.368 13.584 8.211
6 HG3 GLN 18 HG3 GLN 18 -9.831 15.287 8.207
7 HE21 GLN 18 HE21 GLN 18 -9.019 12.533 6.274
8 HE22 GLN 18 HE22 GLN 18 -9.508 13.199 4.750
No H/Q in entry = 8
In of MODEL 14
1 H GLU 19 H GLU 19 -5.214 14.427 9.538
2 HA GLU 19 HA GLU 19 -3.413 16.230 8.455
3 HB2 GLU 19 HB2 GLU 19 -2.906 14.253 10.685
4 HB3 GLU 19 HB3 GLU 19 -2.106 15.781 10.427
5 HG2 GLU 19 HG2 GLU 19 -4.165 16.978 10.884
6 HG3 GLU 19 HG3 GLU 19 -4.999 15.443 11.121
No H/Q in entry = 6
In of MODEL 14
1 H GLN 20 H GLN 20 -3.341 12.696 8.563
2 HA GLN 20 HA GLN 20 -0.687 12.481 7.530
3 HB2 GLN 20 HB2 GLN 20 -2.917 10.429 7.526
4 HB3 GLN 20 HB3 GLN 20 -1.221 10.100 7.203
5 HG2 GLN 20 HG2 GLN 20 -0.639 10.715 9.468
6 HG3 GLN 20 HG3 GLN 20 -2.312 11.155 9.804
7 HE21 GLN 20 HE21 GLN 20 -0.066 8.563 9.390
8 HE22 GLN 20 HE22 GLN 20 -1.109 7.293 9.924
No H/Q in entry = 8
In of MODEL 14
1 H LYS 21 H LYS 21 -3.938 12.190 6.086
2 HA LYS 21 HA LYS 21 -3.140 11.616 3.468
3 HB2 LYS 21 HB2 LYS 21 -5.523 13.206 4.441
4 HB3 LYS 21 HB3 LYS 21 -5.319 12.644 2.789
5 HG2 LYS 21 HG2 LYS 21 -5.337 10.331 3.565
6 HG3 LYS 21 HG3 LYS 21 -5.521 10.889 5.227
7 HD2 LYS 21 HD2 LYS 21 -7.661 11.881 4.701
8 HD3 LYS 21 HD3 LYS 21 -7.465 11.468 2.996
9 HE2 LYS 21 HE2 LYS 21 -7.534 9.109 3.526
10 HE3 LYS 21 HE3 LYS 21 -7.612 9.470 5.251
11 HZ1 LYS 21 HZ1 LYS 21 -9.665 10.288 3.266
12 HZ2 LYS 21 HZ2 LYS 21 -9.788 8.932 4.267
13 HZ3 LYS 21 HZ3 LYS 21 -9.754 10.480 4.944
No H/Q in entry = 13
In of MODEL 14
1 H ASP 22 H ASP 22 -3.730 14.720 5.028
2 HA ASP 22 HA ASP 22 -2.976 16.386 2.881
3 HB2 ASP 22 HB2 ASP 22 -4.257 17.122 4.880
4 HB3 ASP 22 HB3 ASP 22 -2.803 16.935 5.848
No H/Q in entry = 4
In of MODEL 14
1 H GLU 23 H GLU 23 -1.054 14.905 5.514
2 HA GLU 23 HA GLU 23 1.399 16.081 4.885
3 HB2 GLU 23 HB2 GLU 23 0.518 14.291 6.735
4 HB3 GLU 23 HB3 GLU 23 1.454 13.247 5.668
5 HG2 GLU 23 HG2 GLU 23 3.340 14.775 5.875
6 HG3 GLU 23 HG3 GLU 23 2.393 15.746 6.995
No H/Q in entry = 6
In of MODEL 14
1 H LEU 24 H LEU 24 0.021 12.988 3.735
2 HA LEU 24 HA LEU 24 2.176 12.291 2.079
3 HB2 LEU 24 HB2 LEU 24 -0.725 11.523 2.158
4 HB3 LEU 24 HB3 LEU 24 0.338 10.891 0.921
5 HG LEU 24 HG LEU 24 -0.098 9.420 2.943
6 HD11 LEU 24 HD11 LEU 24 2.732 10.081 2.181
7 HD12 LEU 24 HD12 LEU 24 2.235 8.654 3.094
8 HD13 LEU 24 HD13 LEU 24 1.675 8.878 1.434
9 HD21 LEU 24 HD21 LEU 24 1.593 11.511 4.237
10 HD22 LEU 24 HD22 LEU 24 0.080 10.801 4.798
11 HD23 LEU 24 HD23 LEU 24 1.563 9.847 4.812
No H/Q in entry = 11
In of MODEL 14
1 H LEU 25 H LEU 25 -0.834 14.055 1.399
2 HA LEU 25 HA LEU 25 -0.443 14.323 -1.374
3 HB2 LEU 25 HB2 LEU 25 -1.948 16.065 0.574
4 HB3 LEU 25 HB3 LEU 25 -2.013 16.257 -1.166
5 HG LEU 25 HG LEU 25 -2.980 13.884 0.421
6 HD11 LEU 25 HD11 LEU 25 -4.460 15.811 0.498
7 HD12 LEU 25 HD12 LEU 25 -4.442 15.911 -1.264
8 HD13 LEU 25 HD13 LEU 25 -5.166 14.514 -0.465
9 HD21 LEU 25 HD21 LEU 25 -2.859 14.301 -2.562
10 HD22 LEU 25 HD22 LEU 25 -1.996 13.081 -1.626
11 HD23 LEU 25 HD23 LEU 25 -3.751 13.008 -1.761
No H/Q in entry = 11
In of MODEL 14
1 H LYS 26 H LYS 26 0.656 16.223 1.356
2 HA LYS 26 HA LYS 26 1.682 18.437 -0.048
3 HB2 LYS 26 HB2 LYS 26 1.363 18.426 2.379
4 HB3 LYS 26 HB3 LYS 26 2.608 17.199 2.552
5 HG2 LYS 26 HG2 LYS 26 3.551 19.301 3.154
6 HG3 LYS 26 HG3 LYS 26 4.244 18.822 1.605
7 HD2 LYS 26 HD2 LYS 26 2.681 20.310 0.449
8 HD3 LYS 26 HD3 LYS 26 1.980 20.781 1.995
9 HE2 LYS 26 HE2 LYS 26 4.137 21.693 2.699
10 HE3 LYS 26 HE3 LYS 26 4.848 21.207 1.162
11 HZ1 LYS 26 HZ1 LYS 26 2.647 23.174 1.497
12 HZ2 LYS 26 HZ2 LYS 26 4.263 23.548 1.168
13 HZ3 LYS 26 HZ3 LYS 26 3.340 22.710 0.026
No H/Q in entry = 13
In of MODEL 14
1 H MET 27 H MET 27 3.221 15.413 1.000
2 HA MET 27 HA MET 27 5.702 15.901 -0.141
3 HB2 MET 27 HB2 MET 27 4.361 13.213 0.184
4 HB3 MET 27 HB3 MET 27 6.080 13.485 -0.051
5 HG2 MET 27 HG2 MET 27 5.731 14.983 2.120
6 HG3 MET 27 HG3 MET 27 4.407 13.844 2.358
7 HE1 MET 27 HE1 MET 27 5.754 11.352 0.782
8 HE2 MET 27 HE2 MET 27 6.520 10.435 2.081
9 HE3 MET 27 HE3 MET 27 4.885 11.072 2.291
No H/Q in entry = 9
In of MODEL 14
1 H LYS 28 H LYS 28 2.957 14.075 -1.589
2 HA LYS 28 HA LYS 28 4.239 13.382 -3.972
3 HB2 LYS 28 HB2 LYS 28 2.174 12.350 -3.189
4 HB3 LYS 28 HB3 LYS 28 1.317 13.872 -3.375
5 HG2 LYS 28 HG2 LYS 28 0.773 12.408 -5.195
6 HG3 LYS 28 HG3 LYS 28 1.716 13.767 -5.801
7 HD2 LYS 28 HD2 LYS 28 3.720 12.375 -5.830
8 HD3 LYS 28 HD3 LYS 28 2.794 11.015 -5.192
9 HE2 LYS 28 HE2 LYS 28 1.385 11.033 -7.182
10 HE3 LYS 28 HE3 LYS 28 2.280 12.410 -7.817
11 HZ1 LYS 28 HZ1 LYS 28 3.439 9.735 -7.259
12 HZ2 LYS 28 HZ2 LYS 28 2.995 10.306 -8.789
13 HZ3 LYS 28 HZ3 LYS 28 4.253 11.053 -7.940
No H/Q in entry = 13
In of MODEL 14
1 H LYS 29 H LYS 29 2.268 16.205 -3.159
2 HA LYS 29 HA LYS 29 2.486 17.302 -5.772
3 HB2 LYS 29 HB2 LYS 29 1.523 18.522 -3.192
4 HB3 LYS 29 HB3 LYS 29 1.377 19.288 -4.770
5 HG2 LYS 29 HG2 LYS 29 -0.015 17.494 -5.565
6 HG3 LYS 29 HG3 LYS 29 0.217 16.603 -4.063
7 HD2 LYS 29 HD2 LYS 29 -0.888 18.477 -2.856
8 HD3 LYS 29 HD3 LYS 29 -1.226 19.224 -4.420
9 HE2 LYS 29 HE2 LYS 29 -2.166 16.505 -3.514
10 HE3 LYS 29 HE3 LYS 29 -3.155 17.961 -3.610
11 HZ1 LYS 29 HZ1 LYS 29 -1.794 16.712 -5.932
12 HZ2 LYS 29 HZ2 LYS 29 -3.419 16.452 -5.533
13 HZ3 LYS 29 HZ3 LYS 29 -2.890 17.998 -5.973
No H/Q in entry = 13
In of MODEL 14
1 H ASP 30 H ASP 30 4.554 17.514 -3.013
2 HA ASP 30 HA ASP 30 5.805 19.939 -4.009
3 HB2 ASP 30 HB2 ASP 30 5.598 19.482 -1.543
4 HB3 ASP 30 HB3 ASP 30 6.738 18.156 -1.742
No H/Q in entry = 4
In of MODEL 14
1 H GLY 31 H GLY 31 5.816 16.865 -4.925
2 HA2 GLY 31 HA2 GLY 31 8.271 17.305 -6.418
3 HA3 GLY 31 HA3 GLY 31 7.020 16.128 -6.792
No H/Q in entry = 3
In of MODEL 14
1 H LYS 32 H LYS 32 7.125 15.342 -3.837
2 HA LYS 32 HA LYS 32 9.628 14.017 -3.571
3 HB2 LYS 32 HB2 LYS 32 6.969 13.459 -2.235
4 HB3 LYS 32 HB3 LYS 32 8.495 12.709 -1.788
5 HG2 LYS 32 HG2 LYS 32 7.793 15.630 -1.579
6 HG3 LYS 32 HG3 LYS 32 7.982 14.487 -0.250
7 HD2 LYS 32 HD2 LYS 32 10.345 14.209 -0.829
8 HD3 LYS 32 HD3 LYS 32 10.153 15.349 -2.161
9 HE2 LYS 32 HE2 LYS 32 9.470 17.073 -0.510
10 HE3 LYS 32 HE3 LYS 32 9.834 15.927 0.780
11 HZ1 LYS 32 HZ1 LYS 32 11.771 16.951 -1.221
12 HZ2 LYS 32 HZ2 LYS 32 11.677 17.436 0.395
13 HZ3 LYS 32 HZ3 LYS 32 12.128 15.852 0.014
No H/Q in entry = 13
In of MODEL 14
1 H ALA 33 H ALA 33 10.012 11.821 -3.817
2 HA ALA 33 HA ALA 33 8.880 10.736 -6.225
3 HB1 ALA 33 HB1 ALA 33 11.269 10.497 -5.719
4 HB2 ALA 33 HB2 ALA 33 10.491 8.927 -5.927
5 HB3 ALA 33 HB3 ALA 33 10.866 9.515 -4.307
No H/Q in entry = 5
In of MODEL 14
1 H LYS 34 H LYS 34 7.715 8.785 -6.435
2 HA LYS 34 HA LYS 34 5.772 8.150 -4.594
3 HB2 LYS 34 HB2 LYS 34 5.458 6.058 -5.787
4 HB3 LYS 34 HB3 LYS 34 5.703 7.392 -6.905
5 HG2 LYS 34 HG2 LYS 34 8.145 6.010 -6.130
6 HG3 LYS 34 HG3 LYS 34 6.986 5.017 -6.999
7 HD2 LYS 34 HD2 LYS 34 7.861 7.725 -7.967
8 HD3 LYS 34 HD3 LYS 34 8.700 6.240 -8.414
9 HE2 LYS 34 HE2 LYS 34 5.759 6.708 -8.868
10 HE3 LYS 34 HE3 LYS 34 7.001 7.039 -10.074
11 HZ1 LYS 34 HZ1 LYS 34 6.655 4.377 -8.809
12 HZ2 LYS 34 HZ2 LYS 34 5.878 4.822 -10.249
13 HZ3 LYS 34 HZ3 LYS 34 7.566 4.769 -10.181
No H/Q in entry = 13
In of MODEL 14
1 H LYS 35 H LYS 35 9.048 6.966 -4.802
2 HA LYS 35 HA LYS 35 8.968 4.854 -2.994
3 HB2 LYS 35 HB2 LYS 35 10.912 5.249 -4.358
4 HB3 LYS 35 HB3 LYS 35 11.152 6.838 -3.650
5 HG2 LYS 35 HG2 LYS 35 12.781 5.307 -2.774
6 HG3 LYS 35 HG3 LYS 35 11.667 5.777 -1.491
7 HD2 LYS 35 HD2 LYS 35 10.411 3.657 -1.920
8 HD3 LYS 35 HD3 LYS 35 11.699 3.184 -3.031
9 HE2 LYS 35 HE2 LYS 35 12.100 3.857 -0.120
10 HE3 LYS 35 HE3 LYS 35 11.935 2.222 -0.751
11 HZ1 LYS 35 HZ1 LYS 35 14.060 4.124 -1.577
12 HZ2 LYS 35 HZ2 LYS 35 14.254 2.923 -0.404
13 HZ3 LYS 35 HZ3 LYS 35 13.935 2.492 -2.006
No H/Q in entry = 13
In of MODEL 14
1 H GLU 36 H GLU 36 8.741 8.279 -2.422
2 HA GLU 36 HA GLU 36 9.540 8.071 0.364
3 HB2 GLU 36 HB2 GLU 36 8.553 10.489 -1.142
4 HB3 GLU 36 HB3 GLU 36 9.404 10.471 0.398
5 HG2 GLU 36 HG2 GLU 36 11.350 9.456 -0.776
6 HG3 GLU 36 HG3 GLU 36 10.494 9.706 -2.284
No H/Q in entry = 6
In of MODEL 14
1 H LEU 37 H LEU 37 6.732 8.548 -1.636
2 HA LEU 37 HA LEU 37 4.842 8.834 0.416
3 HB2 LEU 37 HB2 LEU 37 4.728 7.787 -2.403
4 HB3 LEU 37 HB3 LEU 37 3.302 7.952 -1.401
5 HG LEU 37 HG LEU 37 3.666 9.791 -3.010
6 HD11 LEU 37 HD11 LEU 37 2.286 10.075 -1.016
7 HD12 LEU 37 HD12 LEU 37 3.714 10.596 -0.119
8 HD13 LEU 37 HD13 LEU 37 3.103 11.576 -1.452
9 HD21 LEU 37 HD21 LEU 37 5.976 10.538 -1.259
10 HD22 LEU 37 HD22 LEU 37 6.061 10.026 -2.945
11 HD23 LEU 37 HD23 LEU 37 5.277 11.547 -2.525
No H/Q in entry = 11
In of MODEL 14
1 H GLU 38 H GLU 38 6.114 6.045 -1.323
2 HA GLU 38 HA GLU 38 4.645 4.016 -0.058
3 HB2 GLU 38 HB2 GLU 38 5.966 3.612 -2.067
4 HB3 GLU 38 HB3 GLU 38 7.447 3.988 -1.200
5 HG2 GLU 38 HG2 GLU 38 6.815 2.034 0.332
6 HG3 GLU 38 HG3 GLU 38 5.678 1.588 -0.939
No H/Q in entry = 6
In of MODEL 14
1 H ALA 39 H ALA 39 7.112 6.053 1.108
2 HA ALA 39 HA ALA 39 8.096 4.158 3.076
3 HB1 ALA 39 HB1 ALA 39 8.906 7.021 2.602
4 HB2 ALA 39 HB2 ALA 39 9.739 5.843 3.615
5 HB3 ALA 39 HB3 ALA 39 9.666 5.610 1.869
No H/Q in entry = 5
In of MODEL 14
1 H LYS 40 H LYS 40 6.435 7.262 3.027
2 HA LYS 40 HA LYS 40 6.182 7.514 5.820
3 HB2 LYS 40 HB2 LYS 40 5.920 9.360 4.167
4 HB3 LYS 40 HB3 LYS 40 4.398 8.644 3.658
5 HG2 LYS 40 HG2 LYS 40 4.011 10.489 5.158
6 HG3 LYS 40 HG3 LYS 40 3.491 8.976 5.895
7 HD2 LYS 40 HD2 LYS 40 4.611 10.184 7.589
8 HD3 LYS 40 HD3 LYS 40 5.719 8.921 7.078
9 HE2 LYS 40 HE2 LYS 40 5.913 11.578 5.757
10 HE3 LYS 40 HE3 LYS 40 6.505 11.428 7.409
11 HZ1 LYS 40 HZ1 LYS 40 7.942 9.612 6.670
12 HZ2 LYS 40 HZ2 LYS 40 7.400 9.809 5.083
13 HZ3 LYS 40 HZ3 LYS 40 8.272 11.045 5.833
No H/Q in entry = 13
In of MODEL 14
1 H ILE 41 H ILE 41 4.080 6.126 3.316
2 HA ILE 41 HA ILE 41 1.958 5.449 5.047
3 HB ILE 41 HB ILE 41 2.770 4.355 2.358
4 HG12 ILE 41 HG12 ILE 41 0.526 6.217 3.148
5 HG13 ILE 41 HG13 ILE 41 2.087 6.755 2.537
6 HG21 ILE 41 HG21 ILE 41 1.467 2.683 3.568
7 HG22 ILE 41 HG22 ILE 41 0.214 3.882 3.884
8 HG23 ILE 41 HG23 ILE 41 0.544 3.365 2.230
9 HD11 ILE 41 HD11 ILE 41 0.136 5.021 1.054
10 HD12 ILE 41 HD12 ILE 41 0.378 6.752 0.812
11 HD13 ILE 41 HD13 ILE 41 1.680 5.620 0.446
No H/Q in entry = 11
In of MODEL 14
1 H LEU 42 H LEU 42 4.773 3.588 3.874
2 HA LEU 42 HA LEU 42 4.030 1.157 5.089
3 HB2 LEU 42 HB2 LEU 42 6.680 2.256 4.230
4 HB3 LEU 42 HB3 LEU 42 6.560 0.709 5.036
5 HG LEU 42 HG LEU 42 5.405 1.477 2.365
6 HD11 LEU 42 HD11 LEU 42 7.785 0.943 2.412
7 HD12 LEU 42 HD12 LEU 42 7.421 -0.600 3.183
8 HD13 LEU 42 HD13 LEU 42 6.861 -0.281 1.543
9 HD21 LEU 42 HD21 LEU 42 4.964 -1.005 4.018
10 HD22 LEU 42 HD22 LEU 42 3.742 0.102 3.387
11 HD23 LEU 42 HD23 LEU 42 4.664 -0.926 2.283
No H/Q in entry = 11
In of MODEL 14
1 H HIS 43 H HIS 43 5.865 3.914 6.275
2 HA HIS 43 HA HIS 43 6.611 2.849 8.760
3 HB2 HIS 43 HB2 HIS 43 7.391 5.041 7.792
4 HB3 HIS 43 HB3 HIS 43 5.824 5.721 8.211
5 HD1 HIS 43 HD1 HIS 43 6.734 7.383 9.925
6 HD2 HIS 43 HD2 HIS 43 7.774 3.441 10.731
7 HE1 HIS 43 HE1 HIS 43 7.738 7.406 12.229
8 HE2 HIS 43 HE2 HIS 43 8.493 5.038 12.628
No H/Q in entry = 8
In of MODEL 14
1 H TYR 44 H TYR 44 3.695 4.758 7.879
2 HA TYR 44 HA TYR 44 2.377 4.590 10.334
3 HB2 TYR 44 HB2 TYR 44 1.240 4.658 7.533
4 HB3 TYR 44 HB3 TYR 44 0.292 4.902 8.991
5 HD1 TYR 44 HD1 TYR 44 2.420 6.524 10.473
6 HD2 TYR 44 HD2 TYR 44 0.841 6.766 6.537
7 HE1 TYR 44 HE1 TYR 44 2.967 8.912 10.409
8 HE2 TYR 44 HE2 TYR 44 1.384 9.145 6.453
9 HH TYR 44 HH TYR 44 3.386 10.668 8.768
No H/Q in entry = 9
In of MODEL 14
1 H TYR 45 H TYR 45 2.221 2.528 7.499
2 HA TYR 45 HA TYR 45 0.279 0.727 8.274
3 HB2 TYR 45 HB2 TYR 45 1.065 0.904 5.994
4 HB3 TYR 45 HB3 TYR 45 2.682 0.417 6.476
5 HD1 TYR 45 HD1 TYR 45 -0.788 -0.916 6.768
6 HD2 TYR 45 HD2 TYR 45 3.306 -1.667 5.948
7 HE1 TYR 45 HE1 TYR 45 -1.324 -3.266 6.296
8 HE2 TYR 45 HE2 TYR 45 2.792 -4.013 5.467
9 HH TYR 45 HH TYR 45 -0.303 -5.150 4.951
No H/Q in entry = 9
In of MODEL 14
1 H ASP 46 H ASP 46 3.798 0.572 8.757
2 HA ASP 46 HA ASP 46 3.580 -2.055 9.929
3 HB2 ASP 46 HB2 ASP 46 5.540 -1.093 8.515
4 HB3 ASP 46 HB3 ASP 46 6.068 -0.369 10.030
No H/Q in entry = 4
In of MODEL 14
1 H GLU 47 H GLU 47 3.250 1.106 11.076
2 HA GLU 47 HA GLU 47 3.918 0.374 13.814
3 HB2 GLU 47 HB2 GLU 47 2.882 2.925 12.584
4 HB3 GLU 47 HB3 GLU 47 3.059 2.701 14.316
5 HG2 GLU 47 HG2 GLU 47 5.489 2.183 13.875
6 HG3 GLU 47 HG3 GLU 47 5.214 2.759 12.231
No H/Q in entry = 6
In of MODEL 14
1 H LEU 48 H LEU 48 1.342 0.068 11.704
2 HA LEU 48 HA LEU 48 -0.785 0.384 13.563
3 HB2 LEU 48 HB2 LEU 48 -0.533 -0.731 10.798
4 HB3 LEU 48 HB3 LEU 48 -1.990 -1.009 11.731
5 HG LEU 48 HG LEU 48 -0.917 1.737 11.092
6 HD11 LEU 48 HD11 LEU 48 -1.511 0.510 9.062
7 HD12 LEU 48 HD12 LEU 48 -3.082 0.129 9.763
8 HD13 LEU 48 HD13 LEU 48 -2.666 1.802 9.396
9 HD21 LEU 48 HD21 LEU 48 -2.383 1.609 13.055
10 HD22 LEU 48 HD22 LEU 48 -3.169 2.443 11.712
11 HD23 LEU 48 HD23 LEU 48 -3.597 0.772 12.082
No H/Q in entry = 11
In of MODEL 14
1 H GLU 49 H GLU 49 -2.066 -1.238 14.291
2 HA GLU 49 HA GLU 49 -1.161 -3.994 14.202
3 HB2 GLU 49 HB2 GLU 49 -1.149 -4.182 16.673
4 HB3 GLU 49 HB3 GLU 49 0.123 -3.142 16.048
5 HG2 GLU 49 HG2 GLU 49 -1.329 -1.188 16.553
6 HG3 GLU 49 HG3 GLU 49 -2.451 -2.295 17.341
No H/Q in entry = 6
In of MODEL 14
1 H GLY 50 H GLY 50 -2.677 -5.447 15.416
2 HA2 GLY 50 HA2 GLY 50 -5.182 -4.570 16.347
3 HA3 GLY 50 HA3 GLY 50 -4.774 -6.220 15.909
No H/Q in entry = 3
In of MODEL 14
1 H ASP 51 H ASP 51 -7.217 -4.648 15.503
2 HA ASP 51 HA ASP 51 -7.942 -5.596 12.961
3 HB2 ASP 51 HB2 ASP 51 -9.264 -3.493 14.693
4 HB3 ASP 51 HB3 ASP 51 -10.002 -4.226 13.271
No H/Q in entry = 4
In of MODEL 14
1 H ALA 52 H ALA 52 -6.760 -2.448 14.033
2 HA ALA 52 HA ALA 52 -7.425 -0.992 11.718
3 HB1 ALA 52 HB1 ALA 52 -5.032 -0.558 13.495
4 HB2 ALA 52 HB2 ALA 52 -5.769 0.609 12.396
5 HB3 ALA 52 HB3 ALA 52 -6.658 0.049 13.812
No H/Q in entry = 5
In of MODEL 14
1 H LYS 53 H LYS 53 -4.538 -2.808 12.588
2 HA LYS 53 HA LYS 53 -3.060 -2.236 10.248
3 HB2 LYS 53 HB2 LYS 53 -2.329 -3.264 12.555
4 HB3 LYS 53 HB3 LYS 53 -2.741 -4.792 11.794
5 HG2 LYS 53 HG2 LYS 53 -0.851 -2.877 10.480
6 HG3 LYS 53 HG3 LYS 53 -0.306 -3.988 11.734
7 HD2 LYS 53 HD2 LYS 53 -1.029 -5.880 10.420
8 HD3 LYS 53 HD3 LYS 53 -1.705 -4.805 9.196
9 HE2 LYS 53 HE2 LYS 53 0.529 -3.923 8.733
10 HE3 LYS 53 HE3 LYS 53 1.204 -4.979 9.966
11 HZ1 LYS 53 HZ1 LYS 53 0.480 -6.889 8.684
12 HZ2 LYS 53 HZ2 LYS 53 -0.174 -5.876 7.497
13 HZ3 LYS 53 HZ3 LYS 53 1.497 -5.903 7.764
No H/Q in entry = 13
In of MODEL 14
1 H LYS 54 H LYS 54 -4.954 -5.042 11.271
2 HA LYS 54 HA LYS 54 -4.964 -6.598 9.073
3 HB2 LYS 54 HB2 LYS 54 -6.046 -7.128 11.178
4 HB3 LYS 54 HB3 LYS 54 -7.261 -5.888 10.884
5 HG2 LYS 54 HG2 LYS 54 -8.074 -7.087 8.972
6 HG3 LYS 54 HG3 LYS 54 -6.786 -8.277 9.186
7 HD2 LYS 54 HD2 LYS 54 -7.677 -9.003 11.263
8 HD3 LYS 54 HD3 LYS 54 -8.842 -7.682 11.286
9 HE2 LYS 54 HE2 LYS 54 -9.937 -8.639 9.305
10 HE3 LYS 54 HE3 LYS 54 -8.789 -9.977 9.332
11 HZ1 LYS 54 HZ1 LYS 54 -10.646 -9.319 11.549
12 HZ2 LYS 54 HZ2 LYS 54 -10.934 -10.510 10.384
13 HZ3 LYS 54 HZ3 LYS 54 -9.631 -10.665 11.450
No H/Q in entry = 13
In of MODEL 14
1 H GLU 55 H GLU 55 -7.160 -3.876 9.756
2 HA GLU 55 HA GLU 55 -8.584 -4.040 7.350
3 HB2 GLU 55 HB2 GLU 55 -8.215 -1.931 9.475
4 HB3 GLU 55 HB3 GLU 55 -9.139 -1.574 8.023
5 HG2 GLU 55 HG2 GLU 55 -10.589 -3.533 8.549
6 HG3 GLU 55 HG3 GLU 55 -9.724 -3.685 10.075
No H/Q in entry = 6
In of MODEL 14
1 H ALA 56 H ALA 56 -5.895 -1.903 8.332
2 HA ALA 56 HA ALA 56 -5.800 -0.539 5.909
3 HB1 ALA 56 HB1 ALA 56 -3.554 0.168 6.547
4 HB2 ALA 56 HB2 ALA 56 -3.457 -1.135 7.730
5 HB3 ALA 56 HB3 ALA 56 -4.603 0.185 7.967
No H/Q in entry = 5
In of MODEL 14
1 H THR 57 H THR 57 -3.956 -3.357 7.003
2 HA THR 57 HA THR 57 -2.450 -3.928 4.785
3 HB THR 57 HB THR 57 -3.884 -5.887 6.593
4 HG1 THR 57 HG1 THR 57 -2.539 -4.579 7.783
5 HG21 THR 57 HG21 THR 57 -1.528 -6.279 4.755
6 HG22 THR 57 HG22 THR 57 -2.066 -7.443 5.964
7 HG23 THR 57 HG23 THR 57 -3.118 -7.022 4.612
No H/Q in entry = 7
In of MODEL 14
1 H GLU 58 H GLU 58 -5.762 -4.946 5.453
2 HA GLU 58 HA GLU 58 -6.220 -6.385 3.075
3 HB2 GLU 58 HB2 GLU 58 -7.885 -5.225 5.241
4 HB3 GLU 58 HB3 GLU 58 -8.694 -5.605 3.724
5 HG2 GLU 58 HG2 GLU 58 -7.854 -7.907 3.888
6 HG3 GLU 58 HG3 GLU 58 -7.113 -7.501 5.435
No H/Q in entry = 6
In of MODEL 14
1 H HIS 59 H HIS 59 -6.381 -2.943 3.777
2 HA HIS 59 HA HIS 59 -7.804 -2.320 1.357
3 HB2 HIS 59 HB2 HIS 59 -6.378 -0.634 3.404
4 HB3 HIS 59 HB3 HIS 59 -6.994 0.063 1.911
5 HD1 HIS 59 HD1 HIS 59 -9.732 -0.910 1.608
6 HD2 HIS 59 HD2 HIS 59 -8.144 -0.138 5.367
7 HE1 HIS 59 HE1 HIS 59 -11.710 -0.545 3.114
8 HE2 HIS 59 HE2 HIS 59 -10.722 -0.304 5.418
No H/Q in entry = 8
In of MODEL 14
1 H LEU 60 H LEU 60 -4.444 -1.908 2.470
2 HA LEU 60 HA LEU 60 -3.366 -1.156 0.048
3 HB2 LEU 60 HB2 LEU 60 -2.242 -2.525 2.456
4 HB3 LEU 60 HB3 LEU 60 -1.250 -2.235 1.036
5 HG LEU 60 HG LEU 60 -1.885 0.164 1.218
6 HD11 LEU 60 HD11 LEU 60 -3.847 -0.044 2.536
7 HD12 LEU 60 HD12 LEU 60 -2.886 -0.600 3.910
8 HD13 LEU 60 HD13 LEU 60 -2.679 1.045 3.294
9 HD21 LEU 60 HD21 LEU 60 -0.350 -1.025 3.508
10 HD22 LEU 60 HD22 LEU 60 0.300 -0.609 1.922
11 HD23 LEU 60 HD23 LEU 60 -0.274 0.662 3.001
No H/Q in entry = 11
In of MODEL 14
1 H LYS 61 H LYS 61 -4.172 -4.371 1.272
2 HA LYS 61 HA LYS 61 -2.833 -5.863 -0.709
3 HB2 LYS 61 HB2 LYS 61 -5.147 -6.401 1.112
4 HB3 LYS 61 HB3 LYS 61 -4.810 -7.526 -0.197
5 HG2 LYS 61 HG2 LYS 61 -2.616 -7.964 0.668
6 HG3 LYS 61 HG3 LYS 61 -2.804 -6.708 1.891
7 HD2 LYS 61 HD2 LYS 61 -4.539 -7.959 2.989
8 HD3 LYS 61 HD3 LYS 61 -4.553 -9.155 1.693
9 HE2 LYS 61 HE2 LYS 61 -2.357 -9.908 2.275
10 HE3 LYS 61 HE3 LYS 61 -2.154 -8.589 3.425
11 HZ1 LYS 61 HZ1 LYS 61 -4.163 -10.760 3.673
12 HZ2 LYS 61 HZ2 LYS 61 -2.687 -10.709 4.493
13 HZ3 LYS 61 HZ3 LYS 61 -3.865 -9.538 4.803
No H/Q in entry = 13
In of MODEL 14
1 H GLY 62 H GLY 62 -6.233 -4.798 -0.507
2 HA2 GLY 62 HA2 GLY 62 -7.724 -4.259 -2.166
3 HA3 GLY 62 HA3 GLY 62 -6.998 -5.569 -3.087
No H/Q in entry = 3
In of MODEL 14
1 H GLY 63 H GLY 63 -5.520 -2.562 -1.931
2 HA2 GLY 63 HA2 GLY 63 -4.384 -0.912 -3.036
3 HA3 GLY 63 HA3 GLY 63 -5.532 -1.146 -4.347
No H/Q in entry = 3
In of MODEL 14
1 H CYS 64 H CYS 64 -2.972 -3.198 -2.973
2 HA CYS 64 HA CYS 64 -1.279 -2.944 -5.236
3 HB2 CYS 64 HB2 CYS 64 -0.359 -3.539 -3.074
4 HB3 CYS 64 HB3 CYS 64 -1.336 -5.005 -3.026
No H/Q in entry = 4
In of MODEL 14
1 H ARG 65 H ARG 65 -3.874 -5.112 -4.368
2 HA ARG 65 HA ARG 65 -3.460 -7.039 -6.387
3 HB2 ARG 65 HB2 ARG 65 -4.979 -7.280 -4.410
4 HB3 ARG 65 HB3 ARG 65 -6.094 -6.176 -5.195
5 HG2 ARG 65 HG2 ARG 65 -6.428 -7.730 -7.009
6 HG3 ARG 65 HG3 ARG 65 -5.208 -8.815 -6.337
7 HD2 ARG 65 HD2 ARG 65 -7.840 -8.052 -5.076
8 HD3 ARG 65 HD3 ARG 65 -7.418 -9.620 -5.766
9 HE ARG 65 HE ARG 65 -5.526 -9.313 -3.882
10 HH11 ARG 65 HH11 ARG 65 -9.009 -8.945 -3.773
11 HH12 ARG 65 HH12 ARG 65 -9.125 -9.370 -2.092
12 HH21 ARG 65 HH21 ARG 65 -5.689 -9.892 -1.672
13 HH22 ARG 65 HH22 ARG 65 -7.245 -9.908 -0.904
No H/Q in entry = 13
In of MODEL 14
1 H GLU 66 H GLU 66 -5.136 -3.931 -6.332
2 HA GLU 66 HA GLU 66 -6.196 -3.950 -8.929
3 HB2 GLU 66 HB2 GLU 66 -5.054 -1.654 -7.322
4 HB3 GLU 66 HB3 GLU 66 -5.963 -1.464 -8.812
5 HG2 GLU 66 HG2 GLU 66 -7.053 -2.795 -6.357
6 HG3 GLU 66 HG3 GLU 66 -7.250 -1.082 -6.711
No H/Q in entry = 6
In of MODEL 14
1 H ILE 67 H ILE 67 -3.039 -2.920 -7.707
2 HA ILE 67 HA ILE 67 -1.827 -2.257 -10.139
3 HB ILE 67 HB ILE 67 -0.555 -3.491 -7.689
4 HG12 ILE 67 HG12 ILE 67 -0.846 -0.591 -8.491
5 HG13 ILE 67 HG13 ILE 67 -1.815 -1.399 -7.263
6 HG21 ILE 67 HG21 ILE 67 0.896 -3.666 -9.635
7 HG22 ILE 67 HG22 ILE 67 0.696 -1.944 -9.954
8 HG23 ILE 67 HG23 ILE 67 1.526 -2.479 -8.494
9 HD11 ILE 67 HD11 ILE 67 0.215 -1.791 -5.950
10 HD12 ILE 67 HD12 ILE 67 1.154 -0.938 -7.174
11 HD13 ILE 67 HD13 ILE 67 -0.075 -0.078 -6.247
No H/Q in entry = 11
In of MODEL 14
1 H LEU 68 H LEU 68 -2.001 -5.335 -8.418
2 HA LEU 68 HA LEU 68 -0.523 -6.855 -10.249
3 HB2 LEU 68 HB2 LEU 68 -1.156 -7.480 -7.896
4 HB3 LEU 68 HB3 LEU 68 -2.762 -7.846 -8.496
5 HG LEU 68 HG LEU 68 -1.825 -9.587 -9.954
6 HD11 LEU 68 HD11 LEU 68 0.792 -8.881 -8.636
7 HD12 LEU 68 HD12 LEU 68 0.514 -10.256 -9.703
8 HD13 LEU 68 HD13 LEU 68 0.374 -8.611 -10.329
9 HD21 LEU 68 HD21 LEU 68 -2.595 -10.179 -7.717
10 HD22 LEU 68 HD22 LEU 68 -1.220 -11.172 -8.199
11 HD23 LEU 68 HD23 LEU 68 -0.991 -9.839 -7.068
No H/Q in entry = 11
In of MODEL 14
1 H LYS 69 H LYS 69 -3.595 -5.467 -10.494
2 HA LYS 69 HA LYS 69 -4.773 -7.552 -12.099
3 HB2 LYS 69 HB2 LYS 69 -5.727 -4.918 -11.063
4 HB3 LYS 69 HB3 LYS 69 -6.572 -5.650 -12.418
5 HG2 LYS 69 HG2 LYS 69 -6.124 -6.946 -9.736
6 HG3 LYS 69 HG3 LYS 69 -7.619 -6.177 -10.272
7 HD2 LYS 69 HD2 LYS 69 -7.663 -7.799 -12.182
8 HD3 LYS 69 HD3 LYS 69 -6.305 -8.632 -11.427
9 HE2 LYS 69 HE2 LYS 69 -8.362 -9.744 -10.838
10 HE3 LYS 69 HE3 LYS 69 -7.675 -8.975 -9.408
11 HZ1 LYS 69 HZ1 LYS 69 -9.837 -7.799 -11.064
12 HZ2 LYS 69 HZ2 LYS 69 -10.090 -8.657 -9.629
13 HZ3 LYS 69 HZ3 LYS 69 -9.245 -7.193 -9.602
No H/Q in entry = 13
In of MODEL 14
1 H HIS 70 H HIS 70 -2.719 -4.921 -12.756
2 HA HIS 70 HA HIS 70 -3.600 -4.928 -15.560
3 HB2 HIS 70 HB2 HIS 70 -1.528 -2.973 -15.049
4 HB3 HIS 70 HB3 HIS 70 -3.102 -2.756 -15.791
5 HD1 HIS 70 HD1 HIS 70 -5.023 -1.932 -14.265
6 HD2 HIS 70 HD2 HIS 70 -1.300 -2.237 -12.413
7 HE1 HIS 70 HE1 HIS 70 -5.227 -0.600 -12.150
8 HE2 HIS 70 HE2 HIS 70 -3.045 -0.959 -10.952
No H/Q in entry = 8
In of MODEL 14
1 H VAL 71 H VAL 71 -1.022 -5.083 -13.283
2 HA VAL 71 HA VAL 71 1.098 -5.207 -15.084
3 HB VAL 71 HB VAL 71 0.923 -4.505 -12.591
4 HG11 VAL 71 HG11 VAL 71 0.302 -6.730 -11.803
5 HG12 VAL 71 HG12 VAL 71 1.931 -7.272 -12.197
6 HG13 VAL 71 HG13 VAL 71 1.696 -6.003 -10.989
7 HG21 VAL 71 HG21 VAL 71 3.285 -5.850 -13.784
8 HG22 VAL 71 HG22 VAL 71 2.840 -4.143 -13.846
9 HG23 VAL 71 HG23 VAL 71 3.319 -4.876 -12.319
No H/Q in entry = 9
In of MODEL 14
1 H VAL 72 H VAL 72 -0.484 -7.773 -13.180
2 HA VAL 72 HA VAL 72 0.794 -9.695 -14.989
3 HB VAL 72 HB VAL 72 0.696 -9.855 -12.336
4 HG11 VAL 72 HG11 VAL 72 -1.828 -11.219 -13.199
5 HG12 VAL 72 HG12 VAL 72 -1.028 -11.500 -11.654
6 HG13 VAL 72 HG13 VAL 72 -1.659 -9.898 -12.046
7 HG21 VAL 72 HG21 VAL 72 0.551 -12.100 -14.302
8 HG22 VAL 72 HG22 VAL 72 1.986 -11.323 -13.639
9 HG23 VAL 72 HG23 VAL 72 0.966 -12.319 -12.600
No H/Q in entry = 9
In of MODEL 14
1 H GLY 73 H GLY 73 -1.939 -7.943 -14.701
2 HA2 GLY 73 HA2 GLY 73 -3.393 -9.489 -16.619
3 HA3 GLY 73 HA3 GLY 73 -3.912 -7.980 -15.882
No H/Q in entry = 3
In of MODEL 14
1 H GLU 74 H GLU 74 -6.024 -9.044 -15.796
2 HA GLU 74 HA GLU 74 -6.585 -10.197 -13.291
3 HB2 GLU 74 HB2 GLU 74 -8.283 -9.012 -14.631
4 HB3 GLU 74 HB3 GLU 74 -8.244 -10.306 -15.821
5 HG2 GLU 74 HG2 GLU 74 -9.112 -11.874 -14.206
6 HG3 GLU 74 HG3 GLU 74 -9.050 -10.647 -12.942
No H/Q in entry = 6
In of MODEL 14
1 H GLU 75 H GLU 75 -5.657 -11.507 -16.346
2 HA GLU 75 HA GLU 75 -6.280 -14.162 -16.295
3 HB2 GLU 75 HB2 GLU 75 -5.073 -13.266 -18.131
4 HB3 GLU 75 HB3 GLU 75 -3.740 -12.760 -17.102
5 HG2 GLU 75 HG2 GLU 75 -3.137 -15.079 -16.712
6 HG3 GLU 75 HG3 GLU 75 -4.495 -15.608 -17.712
No H/Q in entry = 6
In of MODEL 14
1 H LYS 76 H LYS 76 -3.193 -12.959 -14.939
2 HA LYS 76 HA LYS 76 -2.743 -15.524 -13.771
3 HB2 LYS 76 HB2 LYS 76 -1.171 -12.953 -13.557
4 HB3 LYS 76 HB3 LYS 76 -0.645 -14.517 -12.973
5 HG2 LYS 76 HG2 LYS 76 -1.188 -13.804 -15.840
6 HG3 LYS 76 HG3 LYS 76 0.397 -14.015 -15.096
7 HD2 LYS 76 HD2 LYS 76 -1.715 -16.147 -15.406
8 HD3 LYS 76 HD3 LYS 76 -0.251 -15.994 -16.372
9 HE2 LYS 76 HE2 LYS 76 1.114 -16.360 -14.390
10 HE3 LYS 76 HE3 LYS 76 -0.334 -16.453 -13.394
11 HZ1 LYS 76 HZ1 LYS 76 -1.024 -18.394 -14.726
12 HZ2 LYS 76 HZ2 LYS 76 0.466 -18.344 -15.533
13 HZ3 LYS 76 HZ3 LYS 76 0.417 -18.652 -13.874
No H/Q in entry = 13
In of MODEL 14
1 H ALA 77 H ALA 77 -3.680 -12.345 -12.600
2 HA ALA 77 HA ALA 77 -3.447 -12.848 -9.848
3 HB1 ALA 77 HB1 ALA 77 -5.004 -10.989 -9.548
4 HB2 ALA 77 HB2 ALA 77 -3.833 -10.596 -10.807
5 HB3 ALA 77 HB3 ALA 77 -5.473 -11.078 -11.244
No H/Q in entry = 5
In of MODEL 14
1 H ALA 78 H ALA 78 -5.869 -13.717 -12.210
2 HA ALA 78 HA ALA 78 -7.893 -14.610 -10.450
3 HB1 ALA 78 HB1 ALA 78 -8.525 -14.237 -12.683
4 HB2 ALA 78 HB2 ALA 78 -8.571 -15.990 -12.495
5 HB3 ALA 78 HB3 ALA 78 -7.206 -15.223 -13.316
No H/Q in entry = 5
In of MODEL 14
1 H GLU 79 H GLU 79 -5.036 -16.126 -11.827
2 HA GLU 79 HA GLU 79 -5.739 -18.761 -10.909
3 HB2 GLU 79 HB2 GLU 79 -3.021 -17.815 -11.820
4 HB3 GLU 79 HB3 GLU 79 -3.625 -19.466 -11.790
5 HG2 GLU 79 HG2 GLU 79 -5.393 -18.643 -13.441
6 HG3 GLU 79 HG3 GLU 79 -4.353 -17.235 -13.637
No H/Q in entry = 6
In of MODEL 14
1 H LEU 80 H LEU 80 -3.878 -16.066 -9.729
2 HA LEU 80 HA LEU 80 -2.621 -17.522 -7.611
3 HB2 LEU 80 HB2 LEU 80 -2.969 -14.570 -8.115
4 HB3 LEU 80 HB3 LEU 80 -1.971 -15.250 -6.839
5 HG LEU 80 HG LEU 80 -1.533 -15.907 -9.741
6 HD11 LEU 80 HD11 LEU 80 -0.299 -13.696 -8.117
7 HD12 LEU 80 HD12 LEU 80 0.295 -14.255 -9.685
8 HD13 LEU 80 HD13 LEU 80 -1.310 -13.532 -9.555
9 HD21 LEU 80 HD21 LEU 80 -0.602 -17.444 -8.101
10 HD22 LEU 80 HD22 LEU 80 0.674 -16.564 -8.942
11 HD23 LEU 80 HD23 LEU 80 0.220 -16.106 -7.302
No H/Q in entry = 11
In of MODEL 14
1 H LYS 81 H LYS 81 -5.470 -15.490 -7.954
2 HA LYS 81 HA LYS 81 -6.147 -15.418 -5.212
3 HB2 LYS 81 HB2 LYS 81 -7.057 -14.012 -7.207
4 HB3 LYS 81 HB3 LYS 81 -8.180 -15.345 -7.431
5 HG2 LYS 81 HG2 LYS 81 -7.902 -13.838 -4.843
6 HG3 LYS 81 HG3 LYS 81 -9.048 -13.398 -6.109
7 HD2 LYS 81 HD2 LYS 81 -10.109 -15.580 -5.923
8 HD3 LYS 81 HD3 LYS 81 -8.940 -16.058 -4.691
9 HE2 LYS 81 HE2 LYS 81 -9.755 -14.269 -3.234
10 HE3 LYS 81 HE3 LYS 81 -10.925 -13.801 -4.468
11 HZ1 LYS 81 HZ1 LYS 81 -10.820 -16.445 -3.120
12 HZ2 LYS 81 HZ2 LYS 81 -11.911 -15.201 -2.751
13 HZ3 LYS 81 HZ3 LYS 81 -11.969 -15.953 -4.264
No H/Q in entry = 13
In of MODEL 14
1 H ASN 82 H ASN 82 -7.165 -17.536 -7.892
2 HA ASN 82 HA ASN 82 -8.750 -19.241 -6.294
3 HB2 ASN 82 HB2 ASN 82 -8.897 -19.183 -8.780
4 HB3 ASN 82 HB3 ASN 82 -7.299 -19.905 -8.871
5 HD21 ASN 82 HD21 ASN 82 -9.845 -20.782 -6.580
6 HD22 ASN 82 HD22 ASN 82 -10.061 -22.386 -7.179
No H/Q in entry = 6
In of MODEL 14
1 H LEU 83 H LEU 83 -5.316 -19.303 -7.199
2 HA LEU 83 HA LEU 83 -4.628 -21.788 -6.180
3 HB2 LEU 83 HB2 LEU 83 -3.300 -19.403 -7.031
4 HB3 LEU 83 HB3 LEU 83 -2.563 -19.954 -5.546
5 HG LEU 83 HG LEU 83 -2.962 -21.782 -7.896
6 HD11 LEU 83 HD11 LEU 83 -0.566 -20.058 -7.278
7 HD12 LEU 83 HD12 LEU 83 -0.630 -21.326 -8.504
8 HD13 LEU 83 HD13 LEU 83 -1.642 -19.889 -8.666
9 HD21 LEU 83 HD21 LEU 83 -2.521 -22.800 -5.694
10 HD22 LEU 83 HD22 LEU 83 -1.226 -23.091 -6.855
11 HD23 LEU 83 HD23 LEU 83 -1.022 -21.876 -5.596
No H/Q in entry = 11
In of MODEL 14
1 H LYS 84 H LYS 84 -4.873 -18.653 -4.579
2 HA LYS 84 HA LYS 84 -3.927 -19.383 -2.053
3 HB2 LYS 84 HB2 LYS 84 -4.218 -17.063 -2.666
4 HB3 LYS 84 HB3 LYS 84 -5.950 -17.289 -2.855
5 HG2 LYS 84 HG2 LYS 84 -6.126 -17.775 -0.449
6 HG3 LYS 84 HG3 LYS 84 -4.398 -17.457 -0.283
7 HD2 LYS 84 HD2 LYS 84 -4.700 -15.173 -0.978
8 HD3 LYS 84 HD3 LYS 84 -6.401 -15.468 -1.343
9 HE2 LYS 84 HE2 LYS 84 -6.780 -15.998 1.041
10 HE3 LYS 84 HE3 LYS 84 -5.099 -15.590 1.373
11 HZ1 LYS 84 HZ1 LYS 84 -7.135 -13.736 0.271
12 HZ2 LYS 84 HZ2 LYS 84 -6.577 -13.750 1.866
13 HZ3 LYS 84 HZ3 LYS 84 -5.527 -13.345 0.606
No H/Q in entry = 13
In of MODEL 14
1 H ASP 85 H ASP 85 -7.324 -19.156 -3.163
2 HA ASP 85 HA ASP 85 -8.380 -20.257 -0.775
3 HB2 ASP 85 HB2 ASP 85 -9.529 -19.787 -3.511
4 HB3 ASP 85 HB3 ASP 85 -10.460 -20.610 -2.261
No H/Q in entry = 4
In of MODEL 14
1 H SER 86 H SER 86 -6.998 -21.737 -3.572
2 HA SER 86 HA SER 86 -8.199 -24.312 -3.075
3 HB2 SER 86 HB2 SER 86 -5.830 -23.562 -4.810
4 HB3 SER 86 HB3 SER 86 -6.618 -25.141 -4.785
5 HG SER 86 HG SER 86 -7.712 -22.653 -5.605
No H/Q in entry = 5
In of MODEL 14
1 H GLY 87 H GLY 87 -5.682 -22.519 -1.706
2 HA2 GLY 87 HA2 GLY 87 -4.704 -24.971 -0.374
3 HA3 GLY 87 HA3 GLY 87 -5.096 -23.507 0.511
No H/Q in entry = 3
In of MODEL 14
1 H ALA 88 H ALA 88 -3.726 -22.365 -2.246
2 HA ALA 88 HA ALA 88 -1.067 -22.963 -2.105
3 HB1 ALA 88 HB1 ALA 88 -2.204 -20.250 -2.751
4 HB2 ALA 88 HB2 ALA 88 -2.057 -21.600 -3.878
5 HB3 ALA 88 HB3 ALA 88 -0.611 -20.848 -3.202
No H/Q in entry = 5
In of MODEL 14
1 H SER 89 H SER 89 0.372 -22.649 -0.589
2 HA SER 89 HA SER 89 -0.045 -21.150 1.791
3 HB2 SER 89 HB2 SER 89 1.392 -23.154 1.740
4 HB3 SER 89 HB3 SER 89 2.521 -22.322 0.673
5 HG SER 89 HG SER 89 2.301 -22.219 3.367
No H/Q in entry = 5
In of MODEL 14
1 H LYS 90 H LYS 90 1.476 -19.407 2.518
2 HA LYS 90 HA LYS 90 1.413 -17.188 0.846
3 HB2 LYS 90 HB2 LYS 90 3.101 -17.819 3.259
4 HB3 LYS 90 HB3 LYS 90 3.193 -16.268 2.437
5 HG2 LYS 90 HG2 LYS 90 0.862 -15.843 2.891
6 HG3 LYS 90 HG3 LYS 90 0.681 -17.440 3.612
7 HD2 LYS 90 HD2 LYS 90 2.537 -15.303 4.651
8 HD3 LYS 90 HD3 LYS 90 0.910 -15.591 5.264
9 HE2 LYS 90 HE2 LYS 90 1.577 -17.917 5.810
10 HE3 LYS 90 HE3 LYS 90 3.220 -17.526 5.307
11 HZ1 LYS 90 HZ1 LYS 90 3.286 -15.822 7.033
12 HZ2 LYS 90 HZ2 LYS 90 1.726 -16.249 7.532
13 HZ3 LYS 90 HZ3 LYS 90 3.002 -17.352 7.688
No H/Q in entry = 13
In of MODEL 14
1 H GLU 91 H GLU 91 3.721 -19.758 1.028
2 HA GLU 91 HA GLU 91 5.848 -18.388 -0.282
3 HB2 GLU 91 HB2 GLU 91 5.341 -21.344 0.068
4 HB3 GLU 91 HB3 GLU 91 6.842 -20.638 -0.515
5 HG2 GLU 91 HG2 GLU 91 7.094 -19.454 1.620
6 HG3 GLU 91 HG3 GLU 91 5.618 -20.226 2.203
No H/Q in entry = 6
In of MODEL 14
1 H GLU 92 H GLU 92 3.182 -20.397 -1.394
2 HA GLU 92 HA GLU 92 4.090 -20.815 -4.040
3 HB2 GLU 92 HB2 GLU 92 1.253 -20.756 -3.011
4 HB3 GLU 92 HB3 GLU 92 1.847 -21.590 -4.430
5 HG2 GLU 92 HG2 GLU 92 2.789 -22.253 -1.674
6 HG3 GLU 92 HG3 GLU 92 1.362 -22.986 -2.393
No H/Q in entry = 6
In of MODEL 14
1 H LEU 93 H LEU 93 2.112 -18.469 -2.363
2 HA LEU 93 HA LEU 93 1.658 -16.796 -4.627
3 HB2 LEU 93 HB2 LEU 93 1.627 -16.319 -1.646
4 HB3 LEU 93 HB3 LEU 93 1.329 -15.021 -2.784
5 HG LEU 93 HG LEU 93 -0.684 -16.209 -1.712
6 HD11 LEU 93 HD11 LEU 93 -0.529 -15.894 -4.708
7 HD12 LEU 93 HD12 LEU 93 -2.017 -15.964 -3.766
8 HD13 LEU 93 HD13 LEU 93 -0.897 -14.619 -3.547
9 HD21 LEU 93 HD21 LEU 93 -0.012 -18.245 -3.813
10 HD22 LEU 93 HD22 LEU 93 -0.023 -18.498 -2.068
11 HD23 LEU 93 HD23 LEU 93 -1.529 -18.153 -2.916
No H/Q in entry = 11
In of MODEL 14
1 H LYS 94 H LYS 94 4.229 -16.994 -2.166
2 HA LYS 94 HA LYS 94 5.409 -14.532 -2.865
3 HB2 LYS 94 HB2 LYS 94 5.844 -15.637 -0.721
4 HB3 LYS 94 HB3 LYS 94 6.624 -16.973 -1.547
5 HG2 LYS 94 HG2 LYS 94 8.308 -15.308 -2.407
6 HG3 LYS 94 HG3 LYS 94 7.605 -14.148 -1.279
7 HD2 LYS 94 HD2 LYS 94 8.147 -15.582 0.591
8 HD3 LYS 94 HD3 LYS 94 8.732 -16.836 -0.503
9 HE2 LYS 94 HE2 LYS 94 10.462 -15.250 -1.309
10 HE3 LYS 94 HE3 LYS 94 9.920 -14.098 -0.091
11 HZ1 LYS 94 HZ1 LYS 94 10.493 -15.707 1.627
12 HZ2 LYS 94 HZ2 LYS 94 11.023 -16.800 0.448
13 HZ3 LYS 94 HZ3 LYS 94 11.839 -15.337 0.672
No H/Q in entry = 13
In of MODEL 14
1 H ALA 95 H ALA 95 5.955 -17.810 -3.900
2 HA ALA 95 HA ALA 95 8.211 -16.991 -5.504
3 HB1 ALA 95 HB1 ALA 95 8.414 -19.046 -4.244
4 HB2 ALA 95 HB2 ALA 95 8.453 -19.411 -5.970
5 HB3 ALA 95 HB3 ALA 95 6.981 -19.710 -5.038
No H/Q in entry = 5
In of MODEL 14
1 H LYS 96 H LYS 96 5.026 -18.549 -6.070
2 HA LYS 96 HA LYS 96 5.450 -18.690 -8.891
3 HB2 LYS 96 HB2 LYS 96 3.241 -19.283 -7.038
4 HB3 LYS 96 HB3 LYS 96 2.758 -18.832 -8.660
5 HG2 LYS 96 HG2 LYS 96 3.084 -21.301 -8.225
6 HG3 LYS 96 HG3 LYS 96 3.906 -20.637 -9.635
7 HD2 LYS 96 HD2 LYS 96 5.505 -22.007 -8.606
8 HD3 LYS 96 HD3 LYS 96 5.941 -20.377 -8.116
9 HE2 LYS 96 HE2 LYS 96 6.110 -21.777 -6.197
10 HE3 LYS 96 HE3 LYS 96 4.689 -20.753 -5.996
11 HZ1 LYS 96 HZ1 LYS 96 4.629 -23.561 -6.952
12 HZ2 LYS 96 HZ2 LYS 96 4.282 -23.071 -5.369
13 HZ3 LYS 96 HZ3 LYS 96 3.289 -22.578 -6.652
No H/Q in entry = 13
In of MODEL 14
1 H VAL 97 H VAL 97 4.499 -16.157 -6.817
2 HA VAL 97 HA VAL 97 3.116 -14.528 -8.697
3 HB VAL 97 HB VAL 97 3.624 -14.310 -6.027
4 HG11 VAL 97 HG11 VAL 97 5.316 -12.378 -7.521
5 HG12 VAL 97 HG12 VAL 97 4.851 -12.160 -5.833
6 HG13 VAL 97 HG13 VAL 97 5.826 -13.555 -6.316
7 HG21 VAL 97 HG21 VAL 97 1.727 -13.359 -7.233
8 HG22 VAL 97 HG22 VAL 97 2.481 -12.159 -6.181
9 HG23 VAL 97 HG23 VAL 97 2.781 -12.121 -7.917
No H/Q in entry = 9
In of MODEL 14
1 H GLU 98 H GLU 98 6.426 -15.228 -8.006
2 HA GLU 98 HA GLU 98 7.486 -12.939 -9.364
3 HB2 GLU 98 HB2 GLU 98 8.764 -15.421 -8.230
4 HB3 GLU 98 HB3 GLU 98 9.672 -14.105 -8.960
5 HG2 GLU 98 HG2 GLU 98 7.806 -13.758 -6.632
6 HG3 GLU 98 HG3 GLU 98 9.544 -14.040 -6.470
No H/Q in entry = 6
In of MODEL 14
1 H GLU 99 H GLU 99 6.618 -16.155 -10.276
2 HA GLU 99 HA GLU 99 8.155 -16.129 -12.726
3 HB2 GLU 99 HB2 GLU 99 7.288 -18.258 -13.156
4 HB3 GLU 99 HB3 GLU 99 7.431 -18.196 -11.406
5 HG2 GLU 99 HG2 GLU 99 5.102 -17.791 -11.154
6 HG3 GLU 99 HG3 GLU 99 4.922 -17.621 -12.897
No H/Q in entry = 6
In of MODEL 14
1 H ALA 100 H ALA 100 4.893 -15.473 -11.699
2 HA ALA 100 HA ALA 100 3.860 -14.894 -14.281
3 HB1 ALA 100 HB1 ALA 100 2.950 -13.807 -11.615
4 HB2 ALA 100 HB2 ALA 100 2.465 -15.364 -12.287
5 HB3 ALA 100 HB3 ALA 100 2.014 -13.872 -13.107
No H/Q in entry = 5
In of MODEL 14
1 H LEU 101 H LEU 101 4.954 -12.758 -11.633
2 HA LEU 101 HA LEU 101 5.120 -10.425 -13.144
3 HB2 LEU 101 HB2 LEU 101 6.248 -11.387 -10.561
4 HB3 LEU 101 HB3 LEU 101 6.850 -9.887 -11.238
5 HG LEU 101 HG LEU 101 4.623 -8.942 -11.195
6 HD11 LEU 101 HD11 LEU 101 3.300 -10.927 -11.586
7 HD12 LEU 101 HD12 LEU 101 3.709 -11.519 -9.975
8 HD13 LEU 101 HD13 LEU 101 2.748 -10.050 -10.160
9 HD21 LEU 101 HD21 LEU 101 6.039 -8.709 -9.223
10 HD22 LEU 101 HD22 LEU 101 4.331 -8.779 -8.785
11 HD23 LEU 101 HD23 LEU 101 5.358 -10.198 -8.569
No H/Q in entry = 11
In of MODEL 14
1 H HIS 102 H HIS 102 7.045 -13.182 -13.453
2 HA HIS 102 HA HIS 102 9.298 -11.646 -14.443
3 HB2 HIS 102 HB2 HIS 102 9.425 -13.982 -13.293
4 HB3 HIS 102 HB3 HIS 102 8.980 -14.602 -14.879
5 HD1 HIS 102 HD1 HIS 102 10.775 -14.501 -16.729
6 HD2 HIS 102 HD2 HIS 102 11.978 -12.888 -13.097
7 HE1 HIS 102 HE1 HIS 102 13.259 -14.175 -16.926
8 HE2 HIS 102 HE2 HIS 102 13.922 -13.003 -14.795
No H/Q in entry = 8
In of MODEL 14
1 H ALA 103 H ALA 103 6.727 -13.754 -15.608
2 HA ALA 103 HA ALA 103 7.573 -13.899 -18.281
3 HB1 ALA 103 HB1 ALA 103 4.795 -14.324 -17.214
4 HB2 ALA 103 HB2 ALA 103 6.104 -15.501 -17.070
5 HB3 ALA 103 HB3 ALA 103 5.507 -15.032 -18.666
No H/Q in entry = 5
In of MODEL 14
1 H VAL 104 H VAL 104 6.171 -11.296 -16.692
2 HA VAL 104 HA VAL 104 4.345 -10.456 -18.668
3 HB VAL 104 HB VAL 104 3.774 -9.727 -16.580
4 HG11 VAL 104 HG11 VAL 104 5.824 -10.261 -15.456
5 HG12 VAL 104 HG12 VAL 104 6.598 -8.835 -16.139
6 HG13 VAL 104 HG13 VAL 104 5.274 -8.655 -14.996
7 HG21 VAL 104 HG21 VAL 104 3.724 -7.874 -18.241
8 HG22 VAL 104 HG22 VAL 104 3.841 -7.344 -16.564
9 HG23 VAL 104 HG23 VAL 104 5.273 -7.334 -17.588
No H/Q in entry = 9
In of MODEL 14
1 H THR 105 H THR 105 7.223 -8.701 -17.558
2 HA THR 105 HA THR 105 8.981 -7.785 -18.606
3 HB THR 105 HB THR 105 9.772 -8.579 -20.729
4 HG1 THR 105 HG1 THR 105 7.094 -9.281 -21.100
5 HG21 THR 105 HG21 THR 105 8.477 -10.805 -19.158
6 HG22 THR 105 HG22 THR 105 9.793 -10.998 -20.319
7 HG23 THR 105 HG23 THR 105 10.054 -10.078 -18.839
No H/Q in entry = 7
In of MODEL 14
1 H ASP 106 H ASP 106 5.959 -6.875 -19.212
2 HA ASP 106 HA ASP 106 6.550 -4.881 -21.199
3 HB2 ASP 106 HB2 ASP 106 4.239 -5.648 -20.933
4 HB3 ASP 106 HB3 ASP 106 4.248 -5.143 -19.254
No H/Q in entry = 4
In of MODEL 14
1 H GLU 107 H GLU 107 7.236 -2.841 -20.856
2 HA GLU 107 HA GLU 107 9.007 -2.562 -18.749
3 HB2 GLU 107 HB2 GLU 107 7.915 -0.514 -20.669
4 HB3 GLU 107 HB3 GLU 107 9.218 -0.175 -19.538
5 HG2 GLU 107 HG2 GLU 107 9.266 -2.262 -21.705
6 HG3 GLU 107 HG3 GLU 107 10.068 -0.692 -21.759
No H/Q in entry = 6
In of MODEL 14
1 H GLU 108 H GLU 108 6.012 -0.706 -19.255
2 HA GLU 108 HA GLU 108 6.155 0.753 -16.867
3 HB2 GLU 108 HB2 GLU 108 4.723 1.338 -18.784
4 HB3 GLU 108 HB3 GLU 108 3.722 -0.064 -18.457
5 HG2 GLU 108 HG2 GLU 108 3.092 0.891 -16.297
6 HG3 GLU 108 HG3 GLU 108 4.092 2.304 -16.642
No H/Q in entry = 6
In of MODEL 14
1 H LYS 109 H LYS 109 4.715 -2.378 -17.632
2 HA LYS 109 HA LYS 109 3.493 -2.817 -15.131
3 HB2 LYS 109 HB2 LYS 109 4.533 -4.768 -17.187
4 HB3 LYS 109 HB3 LYS 109 3.575 -5.231 -15.789
5 HG2 LYS 109 HG2 LYS 109 1.764 -3.749 -16.611
6 HG3 LYS 109 HG3 LYS 109 2.715 -3.463 -18.065
7 HD2 LYS 109 HD2 LYS 109 2.676 -5.903 -18.507
8 HD3 LYS 109 HD3 LYS 109 1.632 -6.107 -17.101
9 HE2 LYS 109 HE2 LYS 109 -0.036 -4.636 -18.151
10 HE3 LYS 109 HE3 LYS 109 1.006 -4.484 -19.564
11 HZ1 LYS 109 HZ1 LYS 109 0.817 -6.884 -19.893
12 HZ2 LYS 109 HZ2 LYS 109 -0.219 -6.998 -18.562
13 HZ3 LYS 109 HZ3 LYS 109 -0.696 -6.136 -19.936
No H/Q in entry = 13
In of MODEL 14
1 H LYS 110 H LYS 110 6.697 -3.760 -16.378
2 HA LYS 110 HA LYS 110 7.571 -5.008 -13.992
3 HB2 LYS 110 HB2 LYS 110 9.115 -3.728 -16.238
4 HB3 LYS 110 HB3 LYS 110 9.883 -4.574 -14.909
5 HG2 LYS 110 HG2 LYS 110 8.582 -6.613 -15.589
6 HG3 LYS 110 HG3 LYS 110 8.094 -5.713 -17.034
7 HD2 LYS 110 HD2 LYS 110 10.963 -6.128 -16.213
8 HD3 LYS 110 HD3 LYS 110 10.114 -7.177 -17.343
9 HE2 LYS 110 HE2 LYS 110 9.797 -5.378 -18.882
10 HE3 LYS 110 HE3 LYS 110 10.389 -4.203 -17.712
11 HZ1 LYS 110 HZ1 LYS 110 12.021 -6.374 -18.914
12 HZ2 LYS 110 HZ2 LYS 110 12.041 -4.752 -19.400
13 HZ3 LYS 110 HZ3 LYS 110 12.570 -5.180 -17.850
No H/Q in entry = 13
In of MODEL 14
1 H GLN 111 H GLN 111 7.191 -1.745 -14.844
2 HA GLN 111 HA GLN 111 8.914 -0.616 -12.913
3 HB2 GLN 111 HB2 GLN 111 7.902 0.728 -14.705
4 HB3 GLN 111 HB3 GLN 111 6.317 0.504 -13.976
5 HG2 GLN 111 HG2 GLN 111 7.236 2.685 -13.433
6 HG3 GLN 111 HG3 GLN 111 7.043 1.696 -11.987
7 HE21 GLN 111 HE21 GLN 111 8.884 0.874 -10.957
8 HE22 GLN 111 HE22 GLN 111 10.455 1.548 -11.229
No H/Q in entry = 8
In of MODEL 14
1 H TYR 112 H TYR 112 5.588 -1.818 -12.728
2 HA TYR 112 HA TYR 112 5.156 -0.979 -10.005
3 HB2 TYR 112 HB2 TYR 112 3.775 -3.135 -11.633
4 HB3 TYR 112 HB3 TYR 112 3.234 -2.560 -10.066
5 HD1 TYR 112 HD1 TYR 112 3.632 0.363 -10.381
6 HD2 TYR 112 HD2 TYR 112 2.053 -2.525 -13.076
7 HE1 TYR 112 HE1 TYR 112 2.330 2.123 -11.488
8 HE2 TYR 112 HE2 TYR 112 0.753 -0.762 -14.205
9 HH TYR 112 HH TYR 112 1.263 2.591 -13.556
No H/Q in entry = 9
In of MODEL 14
1 H ILE 113 H ILE 113 6.276 -3.896 -11.607
2 HA ILE 113 HA ILE 113 6.377 -5.585 -9.386
3 HB ILE 113 HB ILE 113 7.921 -5.534 -11.961
4 HG12 ILE 113 HG12 ILE 113 5.972 -7.585 -10.968
5 HG13 ILE 113 HG13 ILE 113 5.395 -6.092 -11.687
6 HG21 ILE 113 HG21 ILE 113 9.367 -6.579 -10.289
7 HG22 ILE 113 HG22 ILE 113 8.052 -7.654 -9.816
8 HG23 ILE 113 HG23 ILE 113 8.751 -7.772 -11.431
9 HD11 ILE 113 HD11 ILE 113 7.236 -8.044 -13.026
10 HD12 ILE 113 HD12 ILE 113 5.490 -7.971 -13.254
11 HD13 ILE 113 HD13 ILE 113 6.502 -6.616 -13.747
No H/Q in entry = 11
In of MODEL 14
1 H ALA 114 H ALA 114 8.750 -3.263 -10.634
2 HA ALA 114 HA ALA 114 10.688 -3.793 -8.542
3 HB1 ALA 114 HB1 ALA 114 11.402 -3.061 -10.763
4 HB2 ALA 114 HB2 ALA 114 11.913 -1.924 -9.516
5 HB3 ALA 114 HB3 ALA 114 10.533 -1.541 -10.547
No H/Q in entry = 5
In of MODEL 14
1 H ASP 115 H ASP 115 8.200 -1.383 -9.223
2 HA ASP 115 HA ASP 115 9.019 0.426 -7.174
3 HB2 ASP 115 HB2 ASP 115 7.694 1.055 -9.214
4 HB3 ASP 115 HB3 ASP 115 6.307 0.243 -8.501
No H/Q in entry = 4
In of MODEL 14
1 H PHE 116 H PHE 116 6.260 -1.787 -7.443
2 HA PHE 116 HA PHE 116 5.696 -1.260 -4.624
3 HB2 PHE 116 HB2 PHE 116 4.019 -1.390 -6.878
4 HB3 PHE 116 HB3 PHE 116 3.661 -2.837 -5.943
5 HD1 PHE 116 HD1 PHE 116 2.828 -2.666 -3.670
6 HD2 PHE 116 HD2 PHE 116 3.431 0.774 -6.101
7 HE1 PHE 116 HE1 PHE 116 1.413 -1.331 -2.140
8 HE2 PHE 116 HE2 PHE 116 2.033 2.110 -4.585
9 HZ PHE 116 HZ PHE 116 0.989 1.055 -2.630
No H/Q in entry = 9
In of MODEL 14
1 H GLY 117 H GLY 117 6.875 -3.671 -6.703
2 HA2 GLY 117 HA2 GLY 117 7.563 -5.841 -6.307
3 HA3 GLY 117 HA3 GLY 117 5.913 -6.064 -5.760
No H/Q in entry = 3
In of MODEL 14
1 HA PRO 118 HA PRO 118 9.474 -6.511 -2.406
2 HB2 PRO 118 HB2 PRO 118 10.012 -3.608 -2.007
3 HB3 PRO 118 HB3 PRO 118 11.120 -4.981 -1.916
4 HG2 PRO 118 HG2 PRO 118 11.126 -3.369 -4.034
5 HG3 PRO 118 HG3 PRO 118 11.354 -5.117 -4.216
6 HD2 PRO 118 HD2 PRO 118 8.965 -3.444 -4.817
7 HD3 PRO 118 HD3 PRO 118 9.556 -4.905 -5.632
No H/Q in entry = 7
In of MODEL 14
1 H ALA 119 H ALA 119 7.788 -3.377 -2.086
2 HA ALA 119 HA ALA 119 7.230 -3.737 0.688
3 HB1 ALA 119 HB1 ALA 119 5.895 -1.715 0.468
4 HB2 ALA 119 HB2 ALA 119 6.025 -1.811 -1.288
5 HB3 ALA 119 HB3 ALA 119 7.466 -1.529 -0.310
No H/Q in entry = 5
In of MODEL 14
1 H CYS 120 H CYS 120 5.416 -4.331 -2.261
2 HA CYS 120 HA CYS 120 2.899 -4.853 -1.166
3 HB2 CYS 120 HB2 CYS 120 3.339 -4.694 -3.586
4 HB3 CYS 120 HB3 CYS 120 4.250 -6.197 -3.520
No H/Q in entry = 4
In of MODEL 14
1 H LYS 121 H LYS 121 5.833 -6.751 -1.236
2 HA LYS 121 HA LYS 121 4.691 -9.239 -0.604
3 HB2 LYS 121 HB2 LYS 121 7.407 -8.092 -0.581
4 HB3 LYS 121 HB3 LYS 121 7.159 -9.482 0.467
5 HG2 LYS 121 HG2 LYS 121 7.984 -9.980 -1.864
6 HG3 LYS 121 HG3 LYS 121 6.554 -10.870 -1.342
7 HD2 LYS 121 HD2 LYS 121 5.133 -9.282 -2.565
8 HD3 LYS 121 HD3 LYS 121 6.572 -8.411 -3.091
9 HE2 LYS 121 HE2 LYS 121 6.041 -11.313 -3.697
10 HE3 LYS 121 HE3 LYS 121 5.616 -9.988 -4.780
11 HZ1 LYS 121 HZ1 LYS 121 7.989 -9.349 -4.783
12 HZ2 LYS 121 HZ2 LYS 121 8.343 -10.734 -3.879
13 HZ3 LYS 121 HZ3 LYS 121 7.717 -10.884 -5.444
No H/Q in entry = 13
In of MODEL 14
1 H LYS 122 H LYS 122 5.949 -6.695 1.610
2 HA LYS 122 HA LYS 122 5.213 -8.175 3.938
3 HB2 LYS 122 HB2 LYS 122 5.537 -6.170 5.214
4 HB3 LYS 122 HB3 LYS 122 6.814 -6.261 4.018
5 HG2 LYS 122 HG2 LYS 122 5.603 -4.637 2.632
6 HG3 LYS 122 HG3 LYS 122 4.363 -4.523 3.880
7 HD2 LYS 122 HD2 LYS 122 7.269 -3.954 4.423
8 HD3 LYS 122 HD3 LYS 122 6.154 -2.713 3.861
9 HE2 LYS 122 HE2 LYS 122 6.135 -2.432 6.165
10 HE3 LYS 122 HE3 LYS 122 4.704 -3.411 5.875
11 HZ1 LYS 122 HZ1 LYS 122 7.326 -4.519 6.706
12 HZ2 LYS 122 HZ2 LYS 122 6.081 -4.143 7.786
13 HZ3 LYS 122 HZ3 LYS 122 5.858 -5.348 6.619
No H/Q in entry = 13
In of MODEL 14
1 H ILE 123 H ILE 123 3.517 -6.069 1.734
2 HA ILE 123 HA ILE 123 1.283 -5.519 3.357
3 HB ILE 123 HB ILE 123 1.564 -5.524 0.374
4 HG12 ILE 123 HG12 ILE 123 1.515 -3.333 2.457
5 HG13 ILE 123 HG13 ILE 123 2.940 -3.904 1.595
6 HG21 ILE 123 HG21 ILE 123 -0.721 -4.520 2.066
7 HG22 ILE 123 HG22 ILE 123 -0.528 -4.235 0.336
8 HG23 ILE 123 HG23 ILE 123 -0.773 -5.874 0.937
9 HD11 ILE 123 HD11 ILE 123 0.556 -2.600 0.336
10 HD12 ILE 123 HD12 ILE 123 2.083 -1.805 0.707
11 HD13 ILE 123 HD13 ILE 123 2.029 -3.103 -0.486
No H/Q in entry = 11
In of MODEL 14
1 H TYR 124 H TYR 124 1.770 -7.832 0.811
2 HA TYR 124 HA TYR 124 -0.557 -9.422 1.345
3 HB2 TYR 124 HB2 TYR 124 1.622 -9.402 -0.642
4 HB3 TYR 124 HB3 TYR 124 0.975 -10.990 -0.249
5 HD1 TYR 124 HD1 TYR 124 0.129 -7.663 -1.615
6 HD2 TYR 124 HD2 TYR 124 -1.199 -11.651 -0.951
7 HE1 TYR 124 HE1 TYR 124 -1.777 -7.276 -3.123
8 HE2 TYR 124 HE2 TYR 124 -3.105 -11.274 -2.457
9 HH TYR 124 HH TYR 124 -3.313 -8.579 -4.509
No H/Q in entry = 9
In of MODEL 14
1 H GLY 125 H GLY 125 1.000 -9.208 3.648
2 HA2 GLY 125 HA2 GLY 125 2.381 -10.373 5.179
3 HA3 GLY 125 HA3 GLY 125 3.477 -9.668 4.025
No H/Q in entry = 3
In of MODEL 14
1 H VAL 126 H VAL 126 2.682 -11.709 1.991
2 HA VAL 126 HA VAL 126 3.671 -14.228 2.685
3 HB VAL 126 HB VAL 126 4.355 -14.420 0.298
4 HG11 VAL 126 HG11 VAL 126 1.630 -13.232 0.776
5 HG12 VAL 126 HG12 VAL 126 2.113 -14.101 -0.679
6 HG13 VAL 126 HG13 VAL 126 2.072 -14.937 0.876
7 HG21 VAL 126 HG21 VAL 126 3.490 -11.532 0.152
8 HG22 VAL 126 HG22 VAL 126 5.130 -12.146 -0.065
9 HG23 VAL 126 HG23 VAL 126 3.875 -12.557 -1.232
No H/Q in entry = 9
In of MODEL 14
1 H HIS 127 H HIS 127 5.264 -11.290 2.873
2 HA HIS 127 HA HIS 127 7.888 -11.957 2.037
3 HB2 HIS 127 HB2 HIS 127 7.012 -9.630 2.379
4 HB3 HIS 127 HB3 HIS 127 7.065 -9.913 4.112
5 HD1 HIS 127 HD1 HIS 127 9.119 -9.083 5.204
6 HD2 HIS 127 HD2 HIS 127 9.765 -9.994 1.202
7 HE1 HIS 127 HE1 HIS 127 11.500 -8.428 4.740
8 HE2 HIS 127 HE2 HIS 127 11.902 -9.089 2.342
No H/Q in entry = 8
In of MODEL 14
1 H THR 128 H THR 128 7.995 -14.112 3.011
2 HA THR 128 HA THR 128 8.964 -13.957 5.778
3 HB THR 128 HB THR 128 6.822 -15.170 5.666
4 HG1 THR 128 HG1 THR 128 8.794 -17.134 6.142
5 HG21 THR 128 HG21 THR 128 8.331 -17.068 3.879
6 HG22 THR 128 HG22 THR 128 6.722 -17.349 4.543
7 HG23 THR 128 HG23 THR 128 6.989 -16.030 3.401
No H/Q in entry = 7
In of MODEL 14
1 H SER 129 H SER 129 10.832 -15.098 6.260
2 HA SER 129 HA SER 129 12.504 -15.687 3.966
3 HB2 SER 129 HB2 SER 129 13.171 -15.688 6.920
4 HB3 SER 129 HB3 SER 129 14.330 -15.782 5.593
5 HG SER 129 HG SER 129 12.688 -13.668 5.263
No H/Q in entry = 5
In of MODEL 15
1 HA2 GLY -4 HA2 GLY -4 -6.069 16.302 -25.114
2 HA3 GLY -4 HA3 GLY -4 -6.646 17.819 -24.438
3 H1 GLY -4 H1 GLY -4 -3.959 17.367 -25.599
4 H2 GLY -4 H2 GLY -4 -4.528 18.829 -24.970
No H/Q in entry = 4
In of MODEL 15
1 H SER -3 H SER -3 -6.999 16.472 -22.517
2 HA SER -3 HA SER -3 -4.822 16.777 -20.676
3 HB2 SER -3 HB2 SER -3 -7.498 15.427 -20.249
4 HB3 SER -3 HB3 SER -3 -6.410 16.024 -19.000
5 HG SER -3 HG SER -3 -6.875 18.090 -19.559
No H/Q in entry = 5
In of MODEL 15
1 HA PRO -2 HA PRO -2 -2.878 12.781 -20.807
2 HB2 PRO -2 HB2 PRO -2 -3.389 12.673 -17.867
3 HB3 PRO -2 HB3 PRO -2 -1.884 12.403 -18.756
4 HG2 PRO -2 HG2 PRO -2 -2.283 14.678 -17.444
5 HG3 PRO -2 HG3 PRO -2 -1.488 14.675 -19.031
6 HD2 PRO -2 HD2 PRO -2 -4.268 15.479 -18.302
7 HD3 PRO -2 HD3 PRO -2 -3.181 16.154 -19.530
No H/Q in entry = 7
In of MODEL 15
1 H GLU -1 H GLU -1 -5.362 12.695 -18.246
2 HA GLU -1 HA GLU -1 -7.069 11.281 -17.803
3 HB2 GLU -1 HB2 GLU -1 -7.142 11.085 -20.816
4 HB3 GLU -1 HB3 GLU -1 -8.405 10.492 -19.745
5 HG2 GLU -1 HG2 GLU -1 -8.703 12.793 -18.896
6 HG3 GLU -1 HG3 GLU -1 -7.519 13.346 -20.079
No H/Q in entry = 6
In of MODEL 15
1 H PHE 0 H PHE 0 -4.677 10.098 -17.411
2 HA PHE 0 HA PHE 0 -5.161 7.334 -18.308
3 HB2 PHE 0 HB2 PHE 0 -2.616 8.638 -17.319
4 HB3 PHE 0 HB3 PHE 0 -2.787 6.911 -17.599
5 HD1 PHE 0 HD1 PHE 0 -3.306 6.120 -19.937
6 HD2 PHE 0 HD2 PHE 0 -2.092 10.101 -19.056
7 HE1 PHE 0 HE1 PHE 0 -2.651 6.437 -22.286
8 HE2 PHE 0 HE2 PHE 0 -1.442 10.426 -21.403
9 HZ PHE 0 HZ PHE 0 -1.718 8.592 -23.021
No H/Q in entry = 9
In of MODEL 15
1 H HIS 1 H HIS 1 -3.788 9.080 -15.524
2 HA HIS 1 HA HIS 1 -3.932 8.761 -13.283
3 HB2 HIS 1 HB2 HIS 1 -6.686 7.903 -14.149
4 HB3 HIS 1 HB3 HIS 1 -6.209 7.923 -12.454
5 HD1 HIS 1 HD1 HIS 1 -6.925 9.982 -11.317
6 HD2 HIS 1 HD2 HIS 1 -6.066 10.667 -15.329
7 HE1 HIS 1 HE1 HIS 1 -7.364 12.430 -11.698
8 HE2 HIS 1 HE2 HIS 1 -6.708 12.846 -14.092
No H/Q in entry = 8
In of MODEL 15
1 H HIS 2 H HIS 2 -2.361 6.957 -14.211
2 HA HIS 2 HA HIS 2 -3.276 4.276 -13.619
3 HB2 HIS 2 HB2 HIS 2 -0.577 5.344 -14.469
4 HB3 HIS 2 HB3 HIS 2 -0.913 3.641 -14.188
5 HD1 HIS 2 HD1 HIS 2 0.039 4.367 -16.940
6 HD2 HIS 2 HD2 HIS 2 -3.986 4.421 -15.876
7 HE1 HIS 2 HE1 HIS 2 -1.238 4.154 -19.091
8 HE2 HIS 2 HE2 HIS 2 -3.663 4.050 -18.415
No H/Q in entry = 8
In of MODEL 15
1 H PHE 3 H PHE 3 -3.829 4.747 -11.429
2 HA PHE 3 HA PHE 3 -3.547 4.486 -9.209
3 HB2 PHE 3 HB2 PHE 3 -0.763 3.556 -9.939
4 HB3 PHE 3 HB3 PHE 3 -1.525 3.361 -8.363
5 HD1 PHE 3 HD1 PHE 3 -3.701 2.028 -8.264
6 HD2 PHE 3 HD2 PHE 3 -1.048 1.953 -11.590
7 HE1 PHE 3 HE1 PHE 3 -4.708 -0.087 -9.016
8 HE2 PHE 3 HE2 PHE 3 -2.050 -0.159 -12.347
9 HZ PHE 3 HZ PHE 3 -3.884 -1.180 -11.060
No H/Q in entry = 9
In of MODEL 15
1 H THR 4 H THR 4 -3.737 6.468 -8.409
2 HA THR 4 HA THR 4 -1.277 8.021 -8.059
3 HB THR 4 HB THR 4 -2.686 10.105 -8.259
4 HG1 THR 4 HG1 THR 4 -4.693 9.909 -9.251
5 HG21 THR 4 HG21 THR 4 -1.194 9.400 -10.064
6 HG22 THR 4 HG22 THR 4 -2.465 8.366 -10.720
7 HG23 THR 4 HG23 THR 4 -2.667 10.119 -10.714
No H/Q in entry = 7
In of MODEL 15
1 H LEU 5 H LEU 5 -1.269 9.390 -6.158
2 HA LEU 5 HA LEU 5 -2.125 7.992 -3.923
3 HB2 LEU 5 HB2 LEU 5 -0.213 9.465 -3.909
4 HB3 LEU 5 HB3 LEU 5 -1.244 10.859 -4.166
5 HG LEU 5 HG LEU 5 -2.328 10.347 -1.950
6 HD11 LEU 5 HD11 LEU 5 0.019 8.472 -1.691
7 HD12 LEU 5 HD12 LEU 5 -1.067 8.945 -0.386
8 HD13 LEU 5 HD13 LEU 5 -1.683 8.012 -1.749
9 HD21 LEU 5 HD21 LEU 5 -0.637 12.097 -2.271
10 HD22 LEU 5 HD22 LEU 5 -0.561 11.374 -0.668
11 HD23 LEU 5 HD23 LEU 5 0.626 10.928 -1.894
No H/Q in entry = 11
In of MODEL 15
1 H GLU 6 H GLU 6 -3.476 11.103 -5.148
2 HA GLU 6 HA GLU 6 -5.653 11.253 -3.406
3 HB2 GLU 6 HB2 GLU 6 -5.459 12.034 -6.317
4 HB3 GLU 6 HB3 GLU 6 -6.851 12.409 -5.314
5 HG2 GLU 6 HG2 GLU 6 -5.490 13.766 -3.859
6 HG3 GLU 6 HG3 GLU 6 -4.037 13.316 -4.753
No H/Q in entry = 6
In of MODEL 15
1 H SER 7 H SER 7 -5.328 9.336 -6.430
2 HA SER 7 HA SER 7 -7.970 8.517 -6.597
3 HB2 SER 7 HB2 SER 7 -6.300 8.163 -8.375
4 HB3 SER 7 HB3 SER 7 -5.524 6.924 -7.391
5 HG SER 7 HG SER 7 -7.034 6.130 -9.000
No H/Q in entry = 5
In of MODEL 15
1 H SER 8 H SER 8 -5.653 7.595 -4.210
2 HA SER 8 HA SER 8 -7.179 5.189 -3.598
3 HB2 SER 8 HB2 SER 8 -4.613 6.090 -2.312
4 HB3 SER 8 HB3 SER 8 -5.399 4.505 -2.169
5 HG SER 8 HG SER 8 -4.701 5.525 -4.707
No H/Q in entry = 5
In of MODEL 15
1 H LEU 9 H LEU 9 -6.954 8.436 -2.438
2 HA LEU 9 HA LEU 9 -6.731 8.002 0.267
3 HB2 LEU 9 HB2 LEU 9 -8.010 10.278 -1.187
4 HB3 LEU 9 HB3 LEU 9 -7.571 10.294 0.512
5 HG LEU 9 HG LEU 9 -5.595 9.794 -1.703
6 HD11 LEU 9 HD11 LEU 9 -6.608 11.975 -1.931
7 HD12 LEU 9 HD12 LEU 9 -6.213 12.350 -0.254
8 HD13 LEU 9 HD13 LEU 9 -4.922 12.097 -1.431
9 HD21 LEU 9 HD21 LEU 9 -5.250 10.496 1.212
10 HD22 LEU 9 HD22 LEU 9 -4.918 8.929 0.468
11 HD23 LEU 9 HD23 LEU 9 -3.947 10.339 0.034
No H/Q in entry = 11
In of MODEL 15
1 H ASP 10 H ASP 10 -9.656 7.965 -1.572
2 HA ASP 10 HA ASP 10 -11.217 7.570 0.871
3 HB2 ASP 10 HB2 ASP 10 -12.044 7.986 -2.001
4 HB3 ASP 10 HB3 ASP 10 -13.178 7.654 -0.698
No H/Q in entry = 4
In of MODEL 15
1 H THR 11 H THR 11 -9.459 5.685 -1.110
2 HA THR 11 HA THR 11 -11.283 3.415 -0.746
3 HB THR 11 HB THR 11 -10.189 2.432 -2.833
4 HG1 THR 11 HG1 THR 11 -9.676 5.138 -3.502
5 HG21 THR 11 HG21 THR 11 -11.938 4.876 -3.130
6 HG22 THR 11 HG22 THR 11 -11.720 3.614 -4.342
7 HG23 THR 11 HG23 THR 11 -12.499 3.234 -2.807
No H/Q in entry = 7
In of MODEL 15
1 H HIS 12 H HIS 12 -8.159 3.042 -2.214
2 HA HIS 12 HA HIS 12 -7.435 1.018 -0.461
3 HB2 HIS 12 HB2 HIS 12 -5.485 2.613 -2.108
4 HB3 HIS 12 HB3 HIS 12 -5.255 0.989 -1.500
5 HD1 HIS 12 HD1 HIS 12 -4.933 1.507 -4.474
6 HD2 HIS 12 HD2 HIS 12 -8.535 0.403 -2.733
7 HE1 HIS 12 HE1 HIS 12 -6.272 0.442 -6.318
8 HE2 HIS 12 HE2 HIS 12 -8.507 -0.082 -5.272
No H/Q in entry = 8
In of MODEL 15
1 H LEU 13 H LEU 13 -6.698 4.458 -0.315
2 HA LEU 13 HA LEU 13 -4.915 3.907 1.962
3 HB2 LEU 13 HB2 LEU 13 -4.849 5.917 -0.201
4 HB3 LEU 13 HB3 LEU 13 -4.321 6.444 1.385
5 HG LEU 13 HG LEU 13 -2.393 5.753 0.136
6 HD11 LEU 13 HD11 LEU 13 -2.487 5.177 2.538
7 HD12 LEU 13 HD12 LEU 13 -3.057 3.568 2.096
8 HD13 LEU 13 HD13 LEU 13 -1.455 4.099 1.598
9 HD21 LEU 13 HD21 LEU 13 -3.819 3.128 -0.282
10 HD22 LEU 13 HD22 LEU 13 -3.426 4.325 -1.516
11 HD23 LEU 13 HD23 LEU 13 -2.135 3.451 -0.696
No H/Q in entry = 11
In of MODEL 15
1 H LYS 14 H LYS 14 -7.847 4.194 1.984
2 HA LYS 14 HA LYS 14 -8.527 6.745 3.024
3 HB2 LYS 14 HB2 LYS 14 -10.695 5.795 3.531
4 HB3 LYS 14 HB3 LYS 14 -10.181 5.321 1.925
5 HG2 LYS 14 HG2 LYS 14 -9.658 3.116 2.667
6 HG3 LYS 14 HG3 LYS 14 -9.911 3.570 4.355
7 HD2 LYS 14 HD2 LYS 14 -12.256 3.897 3.981
8 HD3 LYS 14 HD3 LYS 14 -12.056 3.689 2.241
9 HE2 LYS 14 HE2 LYS 14 -11.501 1.385 2.510
10 HE3 LYS 14 HE3 LYS 14 -11.423 1.551 4.265
11 HZ1 LYS 14 HZ1 LYS 14 -13.880 1.927 2.644
12 HZ2 LYS 14 HZ2 LYS 14 -13.490 0.510 3.479
13 HZ3 LYS 14 HZ3 LYS 14 -13.775 1.943 4.331
No H/Q in entry = 13
In of MODEL 15
1 H TRP 15 H TRP 15 -7.071 4.034 4.443
2 HA TRP 15 HA TRP 15 -8.062 4.409 7.108
3 HB2 TRP 15 HB2 TRP 15 -6.287 2.764 7.718
4 HB3 TRP 15 HB3 TRP 15 -7.374 2.196 6.454
5 HD1 TRP 15 HD1 TRP 15 -6.379 1.951 3.996
6 HE1 TRP 15 HE1 TRP 15 -3.964 1.713 3.134
7 HE3 TRP 15 HE3 TRP 15 -3.883 3.516 8.166
8 HZ2 TRP 15 HZ2 TRP 15 -1.342 2.134 4.109
9 HZ3 TRP 15 HZ3 TRP 15 -1.424 3.570 8.124
10 HH2 TRP 15 HH2 TRP 15 -0.181 2.892 6.134
No H/Q in entry = 10
In of MODEL 15
1 H LEU 16 H LEU 16 -5.909 6.129 5.235
2 HA LEU 16 HA LEU 16 -4.134 6.971 7.332
3 HB2 LEU 16 HB2 LEU 16 -4.825 8.282 4.696
4 HB3 LEU 16 HB3 LEU 16 -3.545 8.801 5.768
5 HG LEU 16 HG LEU 16 -3.632 6.138 4.338
6 HD11 LEU 16 HD11 LEU 16 -3.344 8.029 2.813
7 HD12 LEU 16 HD12 LEU 16 -1.990 8.607 3.784
8 HD13 LEU 16 HD13 LEU 16 -1.874 7.065 2.937
9 HD21 LEU 16 HD21 LEU 16 -1.478 7.446 6.001
10 HD22 LEU 16 HD22 LEU 16 -2.366 5.975 6.396
11 HD23 LEU 16 HD23 LEU 16 -1.258 5.995 5.024
No H/Q in entry = 11
In of MODEL 15
1 H SER 17 H SER 17 -4.238 8.800 8.523
2 HA SER 17 HA SER 17 -6.844 9.892 9.043
3 HB2 SER 17 HB2 SER 17 -5.271 9.603 10.882
4 HB3 SER 17 HB3 SER 17 -4.119 10.674 10.090
5 HG SER 17 HG SER 17 -5.815 11.423 11.823
No H/Q in entry = 5
In of MODEL 15
1 H GLN 18 H GLN 18 -7.277 12.310 8.937
2 HA GLN 18 HA GLN 18 -6.839 13.235 6.337
3 HB2 GLN 18 HB2 GLN 18 -8.666 14.071 7.785
4 HB3 GLN 18 HB3 GLN 18 -7.481 14.923 8.764
5 HG2 GLN 18 HG2 GLN 18 -8.586 16.436 7.229
6 HG3 GLN 18 HG3 GLN 18 -6.870 16.299 6.851
7 HE21 GLN 18 HE21 GLN 18 -6.235 15.254 4.960
8 HE22 GLN 18 HE22 GLN 18 -7.344 14.925 3.671
No H/Q in entry = 8
In of MODEL 15
1 H GLU 19 H GLU 19 -5.177 14.096 9.354
2 HA GLU 19 HA GLU 19 -3.386 15.934 8.283
3 HB2 GLU 19 HB2 GLU 19 -3.469 14.177 10.685
4 HB3 GLU 19 HB3 GLU 19 -1.958 14.945 10.275
5 HG2 GLU 19 HG2 GLU 19 -4.563 16.334 10.793
6 HG3 GLU 19 HG3 GLU 19 -3.174 16.277 11.878
No H/Q in entry = 6
In of MODEL 15
1 H GLN 20 H GLN 20 -3.287 12.413 8.393
2 HA GLN 20 HA GLN 20 -0.606 12.221 7.419
3 HB2 GLN 20 HB2 GLN 20 -2.852 10.185 7.413
4 HB3 GLN 20 HB3 GLN 20 -1.174 9.833 7.012
5 HG2 GLN 20 HG2 GLN 20 -0.488 10.438 9.259
6 HG3 GLN 20 HG3 GLN 20 -2.148 10.862 9.671
7 HE21 GLN 20 HE21 GLN 20 -0.372 8.901 10.878
8 HE22 GLN 20 HE22 GLN 20 -1.182 7.376 10.766
No H/Q in entry = 8
In of MODEL 15
1 H LYS 21 H LYS 21 -3.822 11.963 5.915
2 HA LYS 21 HA LYS 21 -3.012 11.462 3.285
3 HB2 LYS 21 HB2 LYS 21 -5.361 13.082 4.290
4 HB3 LYS 21 HB3 LYS 21 -5.155 12.567 2.624
5 HG2 LYS 21 HG2 LYS 21 -5.288 10.244 3.294
6 HG3 LYS 21 HG3 LYS 21 -5.406 10.723 4.988
7 HD2 LYS 21 HD2 LYS 21 -7.507 11.822 4.585
8 HD3 LYS 21 HD3 LYS 21 -7.363 11.539 2.851
9 HE2 LYS 21 HE2 LYS 21 -7.540 9.154 3.189
10 HE3 LYS 21 HE3 LYS 21 -7.566 9.375 4.939
11 HZ1 LYS 21 HZ1 LYS 21 -9.648 10.593 4.707
12 HZ2 LYS 21 HZ2 LYS 21 -9.625 10.355 3.033
13 HZ3 LYS 21 HZ3 LYS 21 -9.787 9.032 4.075
No H/Q in entry = 13
In of MODEL 15
1 H ASP 22 H ASP 22 -3.557 14.519 4.951
2 HA ASP 22 HA ASP 22 -2.776 16.233 2.848
3 HB2 ASP 22 HB2 ASP 22 -4.110 16.957 4.783
4 HB3 ASP 22 HB3 ASP 22 -2.725 16.695 5.836
No H/Q in entry = 4
In of MODEL 15
1 H GLU 23 H GLU 23 -0.910 14.674 5.469
2 HA GLU 23 HA GLU 23 1.538 15.910 4.924
3 HB2 GLU 23 HB2 GLU 23 0.901 14.485 6.923
4 HB3 GLU 23 HB3 GLU 23 1.122 13.084 5.886
5 HG2 GLU 23 HG2 GLU 23 3.391 13.558 5.571
6 HG3 GLU 23 HG3 GLU 23 3.228 15.144 6.310
No H/Q in entry = 6
In of MODEL 15
1 H LEU 24 H LEU 24 0.167 12.829 3.727
2 HA LEU 24 HA LEU 24 2.331 12.142 2.064
3 HB2 LEU 24 HB2 LEU 24 -0.591 11.424 2.083
4 HB3 LEU 24 HB3 LEU 24 0.483 10.815 0.844
5 HG LEU 24 HG LEU 24 -0.058 9.334 2.883
6 HD11 LEU 24 HD11 LEU 24 2.785 9.758 2.006
7 HD12 LEU 24 HD12 LEU 24 2.170 8.337 2.854
8 HD13 LEU 24 HD13 LEU 24 1.587 8.718 1.231
9 HD21 LEU 24 HD21 LEU 24 1.831 11.301 4.085
10 HD22 LEU 24 HD22 LEU 24 0.342 10.625 4.749
11 HD23 LEU 24 HD23 LEU 24 1.793 9.626 4.632
No H/Q in entry = 11
In of MODEL 15
1 H LEU 25 H LEU 25 -0.720 13.851 1.379
2 HA LEU 25 HA LEU 25 -0.320 14.287 -1.353
3 HB2 LEU 25 HB2 LEU 25 -1.848 15.802 0.743
4 HB3 LEU 25 HB3 LEU 25 -1.805 16.341 -0.922
5 HG LEU 25 HG LEU 25 -2.835 13.654 -0.012
6 HD11 LEU 25 HD11 LEU 25 -4.305 16.149 -0.851
7 HD12 LEU 25 HD12 LEU 25 -5.047 14.570 -0.583
8 HD13 LEU 25 HD13 LEU 25 -4.291 15.428 0.758
9 HD21 LEU 25 HD21 LEU 25 -1.923 13.629 -2.275
10 HD22 LEU 25 HD22 LEU 25 -3.679 13.480 -2.299
11 HD23 LEU 25 HD23 LEU 25 -2.918 15.020 -2.699
No H/Q in entry = 11
In of MODEL 15
1 H LYS 26 H LYS 26 0.792 16.040 1.453
2 HA LYS 26 HA LYS 26 1.771 18.353 0.193
3 HB2 LYS 26 HB2 LYS 26 1.499 17.634 2.735
4 HB3 LYS 26 HB3 LYS 26 3.185 17.181 2.540
5 HG2 LYS 26 HG2 LYS 26 3.063 19.392 3.445
6 HG3 LYS 26 HG3 LYS 26 3.680 19.479 1.794
7 HD2 LYS 26 HD2 LYS 26 2.012 21.239 2.297
8 HD3 LYS 26 HD3 LYS 26 1.520 20.184 0.974
9 HE2 LYS 26 HE2 LYS 26 -0.339 20.651 2.492
10 HE3 LYS 26 HE3 LYS 26 0.068 18.941 2.484
11 HZ1 LYS 26 HZ1 LYS 26 1.347 19.332 4.545
12 HZ2 LYS 26 HZ2 LYS 26 0.776 20.926 4.573
13 HZ3 LYS 26 HZ3 LYS 26 -0.308 19.631 4.718
No H/Q in entry = 13
In of MODEL 15
1 H MET 27 H MET 27 3.363 15.298 1.038
2 HA MET 27 HA MET 27 5.849 15.885 -0.029
3 HB2 MET 27 HB2 MET 27 4.521 13.181 0.112
4 HB3 MET 27 HB3 MET 27 6.243 13.471 -0.100
5 HG2 MET 27 HG2 MET 27 5.979 14.808 2.135
6 HG3 MET 27 HG3 MET 27 4.546 13.797 2.315
7 HE1 MET 27 HE1 MET 27 5.545 11.232 0.719
8 HE2 MET 27 HE2 MET 27 6.246 10.207 1.972
9 HE3 MET 27 HE3 MET 27 4.705 11.023 2.257
No H/Q in entry = 9
In of MODEL 15
1 H LYS 28 H LYS 28 3.157 14.150 -1.683
2 HA LYS 28 HA LYS 28 4.548 13.789 -4.108
3 HB2 LYS 28 HB2 LYS 28 2.471 13.163 -5.026
4 HB3 LYS 28 HB3 LYS 28 2.527 12.549 -3.393
5 HG2 LYS 28 HG2 LYS 28 0.414 13.334 -3.395
6 HG3 LYS 28 HG3 LYS 28 1.243 14.808 -2.902
7 HD2 LYS 28 HD2 LYS 28 -0.391 15.287 -4.643
8 HD3 LYS 28 HD3 LYS 28 1.246 15.580 -5.232
9 HE2 LYS 28 HE2 LYS 28 1.236 13.455 -6.403
10 HE3 LYS 28 HE3 LYS 28 -0.357 13.075 -5.749
11 HZ1 LYS 28 HZ1 LYS 28 0.245 15.366 -7.538
12 HZ2 LYS 28 HZ2 LYS 28 -0.446 13.905 -8.035
13 HZ3 LYS 28 HZ3 LYS 28 -1.278 14.916 -6.967
No H/Q in entry = 13
In of MODEL 15
1 H LYS 29 H LYS 29 2.482 16.363 -2.899
2 HA LYS 29 HA LYS 29 2.331 17.908 -5.218
3 HB2 LYS 29 HB2 LYS 29 0.934 18.231 -3.202
4 HB3 LYS 29 HB3 LYS 29 2.333 18.863 -2.350
5 HG2 LYS 29 HG2 LYS 29 0.925 20.675 -3.085
6 HG3 LYS 29 HG3 LYS 29 2.457 20.717 -3.956
7 HD2 LYS 29 HD2 LYS 29 0.580 21.160 -5.453
8 HD3 LYS 29 HD3 LYS 29 1.390 19.657 -5.886
9 HE2 LYS 29 HE2 LYS 29 -0.342 18.366 -4.802
10 HE3 LYS 29 HE3 LYS 29 -1.118 19.838 -4.219
11 HZ1 LYS 29 HZ1 LYS 29 -1.506 20.472 -6.536
12 HZ2 LYS 29 HZ2 LYS 29 -0.823 19.019 -7.059
13 HZ3 LYS 29 HZ3 LYS 29 -2.252 19.005 -6.157
No H/Q in entry = 13
In of MODEL 15
1 H ASP 30 H ASP 30 4.706 18.001 -2.572
2 HA ASP 30 HA ASP 30 6.078 20.202 -3.831
3 HB2 ASP 30 HB2 ASP 30 6.465 18.703 -1.268
4 HB3 ASP 30 HB3 ASP 30 7.758 19.727 -1.886
No H/Q in entry = 4
In of MODEL 15
1 H GLY 31 H GLY 31 5.987 17.176 -4.729
2 HA2 GLY 31 HA2 GLY 31 8.454 17.622 -6.185
3 HA3 GLY 31 HA3 GLY 31 7.178 16.497 -6.613
No H/Q in entry = 3
In of MODEL 15
1 H LYS 32 H LYS 32 7.249 15.494 -3.749
2 HA LYS 32 HA LYS 32 9.751 14.139 -3.571
3 HB2 LYS 32 HB2 LYS 32 7.102 13.573 -2.227
4 HB3 LYS 32 HB3 LYS 32 8.607 12.741 -1.856
5 HG2 LYS 32 HG2 LYS 32 8.021 15.668 -1.457
6 HG3 LYS 32 HG3 LYS 32 8.198 14.439 -0.205
7 HD2 LYS 32 HD2 LYS 32 10.538 14.090 -0.954
8 HD3 LYS 32 HD3 LYS 32 10.337 15.427 -2.085
9 HE2 LYS 32 HE2 LYS 32 11.446 16.204 -0.084
10 HE3 LYS 32 HE3 LYS 32 9.841 16.925 -0.199
11 HZ1 LYS 32 HZ1 LYS 32 10.552 14.581 1.486
12 HZ2 LYS 32 HZ2 LYS 32 10.342 16.163 2.048
13 HZ3 LYS 32 HZ3 LYS 32 9.031 15.317 1.398
No H/Q in entry = 13
In of MODEL 15
1 H ALA 33 H ALA 33 10.045 11.908 -3.798
2 HA ALA 33 HA ALA 33 8.938 10.876 -6.242
3 HB1 ALA 33 HB1 ALA 33 11.287 10.507 -5.687
4 HB2 ALA 33 HB2 ALA 33 10.436 8.976 -5.886
5 HB3 ALA 33 HB3 ALA 33 10.811 9.572 -4.269
No H/Q in entry = 5
In of MODEL 15
1 H LYS 34 H LYS 34 7.776 8.912 -6.487
2 HA LYS 34 HA LYS 34 5.676 8.408 -4.727
3 HB2 LYS 34 HB2 LYS 34 6.968 6.470 -6.652
4 HB3 LYS 34 HB3 LYS 34 5.367 6.303 -5.945
5 HG2 LYS 34 HG2 LYS 34 4.627 8.309 -7.105
6 HG3 LYS 34 HG3 LYS 34 6.241 8.518 -7.789
7 HD2 LYS 34 HD2 LYS 34 6.015 6.308 -8.883
8 HD3 LYS 34 HD3 LYS 34 4.363 6.207 -8.272
9 HE2 LYS 34 HE2 LYS 34 3.772 8.215 -9.515
10 HE3 LYS 34 HE3 LYS 34 5.428 8.352 -10.102
11 HZ1 LYS 34 HZ1 LYS 34 5.156 6.212 -11.212
12 HZ2 LYS 34 HZ2 LYS 34 3.560 6.114 -10.671
13 HZ3 LYS 34 HZ3 LYS 34 4.008 7.328 -11.755
No H/Q in entry = 13
In of MODEL 15
1 H LYS 35 H LYS 35 8.909 7.090 -4.877
2 HA LYS 35 HA LYS 35 8.602 4.952 -3.083
3 HB2 LYS 35 HB2 LYS 35 11.063 6.615 -3.626
4 HB3 LYS 35 HB3 LYS 35 11.041 5.023 -2.883
5 HG2 LYS 35 HG2 LYS 35 10.144 5.653 -5.689
6 HG3 LYS 35 HG3 LYS 35 11.693 4.937 -5.242
7 HD2 LYS 35 HD2 LYS 35 8.989 3.715 -4.678
8 HD3 LYS 35 HD3 LYS 35 10.047 3.263 -6.017
9 HE2 LYS 35 HE2 LYS 35 11.793 2.665 -4.361
10 HE3 LYS 35 HE3 LYS 35 10.640 3.005 -3.072
11 HZ1 LYS 35 HZ1 LYS 35 10.151 1.002 -5.203
12 HZ2 LYS 35 HZ2 LYS 35 10.846 0.622 -3.711
13 HZ3 LYS 35 HZ3 LYS 35 9.265 1.227 -3.772
No H/Q in entry = 13
In of MODEL 15
1 H GLU 36 H GLU 36 8.600 8.336 -2.498
2 HA GLU 36 HA GLU 36 9.420 8.076 0.275
3 HB2 GLU 36 HB2 GLU 36 8.417 10.513 -1.204
4 HB3 GLU 36 HB3 GLU 36 9.238 10.487 0.353
5 HG2 GLU 36 HG2 GLU 36 11.220 9.520 -0.767
6 HG3 GLU 36 HG3 GLU 36 10.395 9.708 -2.300
No H/Q in entry = 6
In of MODEL 15
1 H LEU 37 H LEU 37 6.595 8.461 -1.694
2 HA LEU 37 HA LEU 37 4.710 8.637 0.397
3 HB2 LEU 37 HB2 LEU 37 4.571 7.700 -2.462
4 HB3 LEU 37 HB3 LEU 37 3.163 7.808 -1.427
5 HG LEU 37 HG LEU 37 3.417 9.703 -2.963
6 HD11 LEU 37 HD11 LEU 37 2.179 9.935 -0.869
7 HD12 LEU 37 HD12 LEU 37 3.663 10.451 -0.068
8 HD13 LEU 37 HD13 LEU 37 2.955 11.448 -1.338
9 HD21 LEU 37 HD21 LEU 37 5.838 10.417 -1.355
10 HD22 LEU 37 HD22 LEU 37 5.813 9.937 -3.052
11 HD23 LEU 37 HD23 LEU 37 5.055 11.449 -2.551
No H/Q in entry = 11
In of MODEL 15
1 H GLU 38 H GLU 38 6.033 5.973 -1.497
2 HA GLU 38 HA GLU 38 4.596 3.865 -0.311
3 HB2 GLU 38 HB2 GLU 38 5.766 3.570 -2.409
4 HB3 GLU 38 HB3 GLU 38 7.305 3.945 -1.652
5 HG2 GLU 38 HG2 GLU 38 6.063 1.734 -0.311
6 HG3 GLU 38 HG3 GLU 38 6.157 1.429 -2.047
No H/Q in entry = 6
In of MODEL 15
1 H ALA 39 H ALA 39 7.103 5.824 0.853
2 HA ALA 39 HA ALA 39 8.074 3.883 2.782
3 HB1 ALA 39 HB1 ALA 39 8.895 6.747 2.339
4 HB2 ALA 39 HB2 ALA 39 9.704 5.576 3.379
5 HB3 ALA 39 HB3 ALA 39 9.671 5.330 1.633
No H/Q in entry = 5
In of MODEL 15
1 H LYS 40 H LYS 40 6.351 6.959 2.776
2 HA LYS 40 HA LYS 40 6.107 7.184 5.578
3 HB2 LYS 40 HB2 LYS 40 5.774 9.017 3.875
4 HB3 LYS 40 HB3 LYS 40 4.221 8.289 3.494
5 HG2 LYS 40 HG2 LYS 40 3.842 10.092 4.995
6 HG3 LYS 40 HG3 LYS 40 3.571 8.589 5.878
7 HD2 LYS 40 HD2 LYS 40 4.817 9.994 7.316
8 HD3 LYS 40 HD3 LYS 40 5.948 8.792 6.703
9 HE2 LYS 40 HE2 LYS 40 6.751 10.397 5.037
10 HE3 LYS 40 HE3 LYS 40 5.620 11.601 5.655
11 HZ1 LYS 40 HZ1 LYS 40 6.764 11.485 7.797
12 HZ2 LYS 40 HZ2 LYS 40 7.873 10.385 7.152
13 HZ3 LYS 40 HZ3 LYS 40 7.805 11.963 6.556
No H/Q in entry = 13
In of MODEL 15
1 H ILE 41 H ILE 41 3.983 5.864 3.064
2 HA ILE 41 HA ILE 41 1.840 5.159 4.724
3 HB ILE 41 HB ILE 41 2.785 4.003 2.105
4 HG12 ILE 41 HG12 ILE 41 0.475 5.851 2.723
5 HG13 ILE 41 HG13 ILE 41 2.062 6.407 2.202
6 HG21 ILE 41 HG21 ILE 41 0.185 3.526 3.549
7 HG22 ILE 41 HG22 ILE 41 0.552 3.007 1.904
8 HG23 ILE 41 HG23 ILE 41 1.454 2.337 3.263
9 HD11 ILE 41 HD11 ILE 41 0.252 4.600 0.630
10 HD12 ILE 41 HD12 ILE 41 0.452 6.335 0.375
11 HD13 ILE 41 HD13 ILE 41 1.810 5.239 0.108
No H/Q in entry = 11
In of MODEL 15
1 H LEU 42 H LEU 42 4.688 3.295 3.673
2 HA LEU 42 HA LEU 42 3.969 0.905 4.988
3 HB2 LEU 42 HB2 LEU 42 6.631 1.987 4.120
4 HB3 LEU 42 HB3 LEU 42 6.459 0.422 4.879
5 HG LEU 42 HG LEU 42 5.445 1.309 2.197
6 HD11 LEU 42 HD11 LEU 42 7.242 -0.930 3.094
7 HD12 LEU 42 HD12 LEU 42 6.744 -0.619 1.433
8 HD13 LEU 42 HD13 LEU 42 7.739 0.558 2.288
9 HD21 LEU 42 HD21 LEU 42 4.637 -1.098 3.810
10 HD22 LEU 42 HD22 LEU 42 3.599 0.103 3.043
11 HD23 LEU 42 HD23 LEU 42 4.506 -1.041 2.051
No H/Q in entry = 11
In of MODEL 15
1 H HIS 43 H HIS 43 5.713 3.760 6.046
2 HA HIS 43 HA HIS 43 6.548 2.720 8.540
3 HB2 HIS 43 HB2 HIS 43 7.357 4.869 7.419
4 HB3 HIS 43 HB3 HIS 43 5.876 5.618 8.010
5 HD1 HIS 43 HD1 HIS 43 9.258 4.615 9.040
6 HD2 HIS 43 HD2 HIS 43 5.729 5.802 10.885
7 HE1 HIS 43 HE1 HIS 43 9.895 5.201 11.399
8 HE2 HIS 43 HE2 HIS 43 7.724 5.778 12.536
No H/Q in entry = 8
In of MODEL 15
1 H TYR 44 H TYR 44 3.703 4.734 7.656
2 HA TYR 44 HA TYR 44 2.377 4.718 10.096
3 HB2 TYR 44 HB2 TYR 44 1.289 4.581 7.282
4 HB3 TYR 44 HB3 TYR 44 0.269 4.802 8.696
5 HD1 TYR 44 HD1 TYR 44 2.374 6.582 10.123
6 HD2 TYR 44 HD2 TYR 44 0.613 6.659 6.263
7 HE1 TYR 44 HE1 TYR 44 2.786 8.991 9.998
8 HE2 TYR 44 HE2 TYR 44 1.026 9.068 6.111
9 HH TYR 44 HH TYR 44 1.369 11.022 7.844
No H/Q in entry = 9
In of MODEL 15
1 H TYR 45 H TYR 45 2.340 2.416 7.478
2 HA TYR 45 HA TYR 45 0.396 0.648 8.318
3 HB2 TYR 45 HB2 TYR 45 1.281 0.683 6.077
4 HB3 TYR 45 HB3 TYR 45 2.886 0.275 6.659
5 HD1 TYR 45 HD1 TYR 45 -0.409 -1.195 7.431
6 HD2 TYR 45 HD2 TYR 45 3.433 -1.753 5.720
7 HE1 TYR 45 HE1 TYR 45 -0.918 -3.565 7.102
8 HE2 TYR 45 HE2 TYR 45 2.947 -4.133 5.371
9 HH TYR 45 HH TYR 45 -0.262 -5.426 5.879
No H/Q in entry = 9
In of MODEL 15
1 H ASP 46 H ASP 46 3.923 0.481 8.866
2 HA ASP 46 HA ASP 46 3.710 -1.977 10.305
3 HB2 ASP 46 HB2 ASP 46 5.772 -1.291 9.065
4 HB3 ASP 46 HB3 ASP 46 6.027 -0.020 10.252
No H/Q in entry = 4
In of MODEL 15
1 H GLU 47 H GLU 47 3.288 1.299 11.176
2 HA GLU 47 HA GLU 47 3.821 0.842 13.995
3 HB2 GLU 47 HB2 GLU 47 2.842 3.271 12.485
4 HB3 GLU 47 HB3 GLU 47 3.151 3.234 14.214
5 HG2 GLU 47 HG2 GLU 47 5.251 2.599 12.167
6 HG3 GLU 47 HG3 GLU 47 4.962 4.223 12.780
No H/Q in entry = 6
In of MODEL 15
1 H LEU 48 H LEU 48 1.499 -0.287 12.211
2 HA LEU 48 HA LEU 48 -0.743 0.594 13.846
3 HB2 LEU 48 HB2 LEU 48 -0.545 -0.842 11.221
4 HB3 LEU 48 HB3 LEU 48 -2.031 -0.821 12.147
5 HG LEU 48 HG LEU 48 -0.636 1.682 11.206
6 HD11 LEU 48 HD11 LEU 48 -1.304 0.290 9.316
7 HD12 LEU 48 HD12 LEU 48 -2.928 0.164 9.992
8 HD13 LEU 48 HD13 LEU 48 -2.320 1.727 9.448
9 HD21 LEU 48 HD21 LEU 48 -3.408 1.116 12.245
10 HD22 LEU 48 HD22 LEU 48 -2.139 2.008 13.088
11 HD23 LEU 48 HD23 LEU 48 -2.854 2.667 11.616
No H/Q in entry = 11
In of MODEL 15
1 H GLU 49 H GLU 49 -2.142 -0.911 14.662
2 HA GLU 49 HA GLU 49 -1.355 -3.710 14.779
3 HB2 GLU 49 HB2 GLU 49 -1.544 -3.787 17.235
4 HB3 GLU 49 HB3 GLU 49 -0.202 -2.790 16.696
5 HG2 GLU 49 HG2 GLU 49 -1.311 -0.807 17.242
6 HG3 GLU 49 HG3 GLU 49 -2.869 -1.620 17.378
No H/Q in entry = 6
In of MODEL 15
1 H GLY 50 H GLY 50 -3.035 -4.985 16.079
2 HA2 GLY 50 HA2 GLY 50 -5.543 -3.933 16.726
3 HA3 GLY 50 HA3 GLY 50 -5.192 -5.630 16.455
No H/Q in entry = 3
In of MODEL 15
1 H ASP 51 H ASP 51 -7.494 -3.902 15.750
2 HA ASP 51 HA ASP 51 -8.109 -5.063 13.260
3 HB2 ASP 51 HB2 ASP 51 -9.425 -2.778 14.746
4 HB3 ASP 51 HB3 ASP 51 -10.096 -3.531 13.304
No H/Q in entry = 4
In of MODEL 15
1 H ALA 52 H ALA 52 -6.694 -1.960 14.126
2 HA ALA 52 HA ALA 52 -7.262 -0.669 11.670
3 HB1 ALA 52 HB1 ALA 52 -4.926 -0.156 13.502
4 HB2 ALA 52 HB2 ALA 52 -5.550 0.921 12.253
5 HB3 ALA 52 HB3 ALA 52 -6.530 0.555 13.669
No H/Q in entry = 5
In of MODEL 15
1 H LYS 53 H LYS 53 -4.428 -2.423 12.832
2 HA LYS 53 HA LYS 53 -2.840 -2.235 10.552
3 HB2 LYS 53 HB2 LYS 53 -2.372 -3.200 12.950
4 HB3 LYS 53 HB3 LYS 53 -2.863 -4.723 12.225
5 HG2 LYS 53 HG2 LYS 53 -0.673 -3.001 11.096
6 HG3 LYS 53 HG3 LYS 53 -0.391 -4.270 12.285
7 HD2 LYS 53 HD2 LYS 53 -1.264 -5.934 10.756
8 HD3 LYS 53 HD3 LYS 53 -1.659 -4.678 9.581
9 HE2 LYS 53 HE2 LYS 53 0.734 -4.109 9.417
10 HE3 LYS 53 HE3 LYS 53 1.101 -5.408 10.550
11 HZ1 LYS 53 HZ1 LYS 53 -0.188 -5.768 7.897
12 HZ2 LYS 53 HZ2 LYS 53 1.436 -6.091 8.251
13 HZ3 LYS 53 HZ3 LYS 53 0.215 -7.003 8.982
No H/Q in entry = 13
In of MODEL 15
1 H LYS 54 H LYS 54 -5.016 -4.876 11.548
2 HA LYS 54 HA LYS 54 -4.834 -6.461 9.274
3 HB2 LYS 54 HB2 LYS 54 -6.387 -7.693 10.267
4 HB3 LYS 54 HB3 LYS 54 -6.302 -6.533 11.582
5 HG2 LYS 54 HG2 LYS 54 -8.223 -5.394 10.839
6 HG3 LYS 54 HG3 LYS 54 -8.194 -6.217 9.270
7 HD2 LYS 54 HD2 LYS 54 -8.715 -8.303 10.299
8 HD3 LYS 54 HD3 LYS 54 -8.564 -7.608 11.908
9 HE2 LYS 54 HE2 LYS 54 -10.904 -7.828 11.356
10 HE3 LYS 54 HE3 LYS 54 -10.475 -6.122 11.417
11 HZ1 LYS 54 HZ1 LYS 54 -10.678 -7.714 8.918
12 HZ2 LYS 54 HZ2 LYS 54 -11.895 -6.706 9.516
13 HZ3 LYS 54 HZ3 LYS 54 -10.419 -6.041 9.027
No H/Q in entry = 13
In of MODEL 15
1 H GLU 55 H GLU 55 -6.996 -3.687 9.864
2 HA GLU 55 HA GLU 55 -8.325 -3.905 7.403
3 HB2 GLU 55 HB2 GLU 55 -7.968 -1.688 9.425
4 HB3 GLU 55 HB3 GLU 55 -8.910 -1.452 7.959
5 HG2 GLU 55 HG2 GLU 55 -9.432 -3.493 10.098
6 HG3 GLU 55 HG3 GLU 55 -10.337 -2.013 9.816
No H/Q in entry = 6
In of MODEL 15
1 H ALA 56 H ALA 56 -5.590 -1.856 8.438
2 HA ALA 56 HA ALA 56 -5.404 -0.510 6.008
3 HB1 ALA 56 HB1 ALA 56 -3.165 0.146 6.698
4 HB2 ALA 56 HB2 ALA 56 -3.112 -1.164 7.875
5 HB3 ALA 56 HB3 ALA 56 -4.230 0.182 8.104
No H/Q in entry = 5
In of MODEL 15
1 H THR 57 H THR 57 -3.753 -3.411 7.182
2 HA THR 57 HA THR 57 -2.162 -3.984 4.997
3 HB THR 57 HB THR 57 -3.620 -6.047 6.658
4 HG1 THR 57 HG1 THR 57 -2.555 -4.671 8.070
5 HG21 THR 57 HG21 THR 57 -2.402 -6.804 4.610
6 HG22 THR 57 HG22 THR 57 -0.918 -6.186 5.328
7 HG23 THR 57 HG23 THR 57 -1.797 -7.500 6.115
No H/Q in entry = 7
In of MODEL 15
1 H GLU 58 H GLU 58 -5.469 -5.060 5.666
2 HA GLU 58 HA GLU 58 -5.891 -6.541 3.306
3 HB2 GLU 58 HB2 GLU 58 -7.707 -5.246 5.311
4 HB3 GLU 58 HB3 GLU 58 -8.362 -6.000 3.862
5 HG2 GLU 58 HG2 GLU 58 -6.713 -7.328 6.000
6 HG3 GLU 58 HG3 GLU 58 -8.437 -7.546 5.703
No H/Q in entry = 6
In of MODEL 15
1 H HIS 59 H HIS 59 -6.422 -3.109 4.019
2 HA HIS 59 HA HIS 59 -7.664 -2.546 1.517
3 HB2 HIS 59 HB2 HIS 59 -6.277 -0.718 3.487
4 HB3 HIS 59 HB3 HIS 59 -7.129 -0.151 2.055
5 HD1 HIS 59 HD1 HIS 59 -9.617 -2.031 2.299
6 HD2 HIS 59 HD2 HIS 59 -8.008 0.209 5.409
7 HE1 HIS 59 HE1 HIS 59 -11.480 -1.747 3.958
8 HE2 HIS 59 HE2 HIS 59 -10.513 -0.314 5.793
No H/Q in entry = 8
In of MODEL 15
1 H LEU 60 H LEU 60 -4.358 -2.517 2.685
2 HA LEU 60 HA LEU 60 -3.239 -1.455 0.294
3 HB2 LEU 60 HB2 LEU 60 -1.963 -3.136 2.450
4 HB3 LEU 60 HB3 LEU 60 -1.095 -2.304 1.178
5 HG LEU 60 HG LEU 60 -2.676 -1.026 3.405
6 HD11 LEU 60 HD11 LEU 60 -0.506 -1.926 4.081
7 HD12 LEU 60 HD12 LEU 60 0.274 -1.020 2.784
8 HD13 LEU 60 HD13 LEU 60 -0.513 -0.163 4.109
9 HD21 LEU 60 HD21 LEU 60 -1.199 0.220 1.098
10 HD22 LEU 60 HD22 LEU 60 -2.939 0.251 1.373
11 HD23 LEU 60 HD23 LEU 60 -1.858 1.096 2.478
No H/Q in entry = 11
In of MODEL 15
1 H LYS 61 H LYS 61 -4.070 -4.683 1.423
2 HA LYS 61 HA LYS 61 -2.796 -6.136 -0.625
3 HB2 LYS 61 HB2 LYS 61 -5.251 -6.731 1.026
4 HB3 LYS 61 HB3 LYS 61 -4.621 -7.853 -0.168
5 HG2 LYS 61 HG2 LYS 61 -2.512 -7.979 1.070
6 HG3 LYS 61 HG3 LYS 61 -3.165 -6.863 2.273
7 HD2 LYS 61 HD2 LYS 61 -4.991 -8.469 2.717
8 HD3 LYS 61 HD3 LYS 61 -4.249 -9.591 1.577
9 HE2 LYS 61 HE2 LYS 61 -2.294 -9.787 2.957
10 HE3 LYS 61 HE3 LYS 61 -2.877 -8.522 4.037
11 HZ1 LYS 61 HZ1 LYS 61 -4.814 -9.991 4.510
12 HZ2 LYS 61 HZ2 LYS 61 -4.024 -11.227 3.659
13 HZ3 LYS 61 HZ3 LYS 61 -3.327 -10.593 5.062
No H/Q in entry = 13
In of MODEL 15
1 H GLY 62 H GLY 62 -6.199 -5.095 -0.319
2 HA2 GLY 62 HA2 GLY 62 -7.728 -4.496 -1.925
3 HA3 GLY 62 HA3 GLY 62 -7.001 -5.755 -2.916
No H/Q in entry = 3
In of MODEL 15
1 H GLY 63 H GLY 63 -5.584 -2.748 -1.667
2 HA2 GLY 63 HA2 GLY 63 -4.408 -1.104 -2.733
3 HA3 GLY 63 HA3 GLY 63 -5.623 -1.240 -3.996
No H/Q in entry = 3
In of MODEL 15
1 H CYS 64 H CYS 64 -3.006 -3.368 -2.856
2 HA CYS 64 HA CYS 64 -1.503 -3.000 -5.254
3 HB2 CYS 64 HB2 CYS 64 -0.406 -3.507 -3.125
4 HB3 CYS 64 HB3 CYS 64 -1.202 -5.080 -3.082
No H/Q in entry = 4
In of MODEL 15
1 H ARG 65 H ARG 65 -3.964 -5.225 -4.212
2 HA ARG 65 HA ARG 65 -3.689 -7.207 -6.175
3 HB2 ARG 65 HB2 ARG 65 -5.296 -7.358 -4.297
4 HB3 ARG 65 HB3 ARG 65 -6.243 -6.060 -5.009
5 HG2 ARG 65 HG2 ARG 65 -7.352 -8.067 -5.549
6 HG3 ARG 65 HG3 ARG 65 -6.544 -7.539 -7.025
7 HD2 ARG 65 HD2 ARG 65 -6.254 -9.925 -6.732
8 HD3 ARG 65 HD3 ARG 65 -4.703 -9.104 -6.554
9 HE ARG 65 HE ARG 65 -5.786 -9.336 -4.012
10 HH11 ARG 65 HH11 ARG 65 -4.759 -11.513 -6.552
11 HH12 ARG 65 HH12 ARG 65 -4.250 -12.755 -5.453
12 HH21 ARG 65 HH21 ARG 65 -5.117 -10.972 -2.563
13 HH22 ARG 65 HH22 ARG 65 -4.454 -12.451 -3.188
No H/Q in entry = 13
In of MODEL 15
1 H GLU 66 H GLU 66 -5.370 -4.095 -6.199
2 HA GLU 66 HA GLU 66 -6.280 -4.216 -8.861
3 HB2 GLU 66 HB2 GLU 66 -5.598 -1.797 -7.184
4 HB3 GLU 66 HB3 GLU 66 -6.525 -1.768 -8.677
5 HG2 GLU 66 HG2 GLU 66 -7.314 -3.125 -6.108
6 HG3 GLU 66 HG3 GLU 66 -7.990 -1.632 -6.758
No H/Q in entry = 6
In of MODEL 15
1 H ILE 67 H ILE 67 -3.242 -3.171 -7.426
2 HA ILE 67 HA ILE 67 -2.089 -2.137 -9.801
3 HB ILE 67 HB ILE 67 -0.754 -3.310 -7.358
4 HG12 ILE 67 HG12 ILE 67 -1.215 -0.446 -8.221
5 HG13 ILE 67 HG13 ILE 67 -2.126 -1.289 -6.973
6 HG21 ILE 67 HG21 ILE 67 0.745 -3.430 -9.292
7 HG22 ILE 67 HG22 ILE 67 0.467 -1.718 -9.617
8 HG23 ILE 67 HG23 ILE 67 1.293 -2.211 -8.140
9 HD11 ILE 67 HD11 ILE 67 0.816 -0.667 -6.890
10 HD12 ILE 67 HD12 ILE 67 -0.456 0.192 -6.018
11 HD13 ILE 67 HD13 ILE 67 -0.105 -1.493 -5.632
No H/Q in entry = 11
In of MODEL 15
1 H LEU 68 H LEU 68 -1.939 -5.341 -8.272
2 HA LEU 68 HA LEU 68 -0.339 -6.562 -10.252
3 HB2 LEU 68 HB2 LEU 68 -0.904 -7.406 -7.913
4 HB3 LEU 68 HB3 LEU 68 -2.432 -7.948 -8.580
5 HG LEU 68 HG LEU 68 -1.276 -9.465 -10.088
6 HD11 LEU 68 HD11 LEU 68 1.234 -8.364 -8.833
7 HD12 LEU 68 HD12 LEU 68 1.164 -9.771 -9.892
8 HD13 LEU 68 HD13 LEU 68 0.727 -8.179 -10.513
9 HD21 LEU 68 HD21 LEU 68 -1.853 -10.251 -7.842
10 HD22 LEU 68 HD22 LEU 68 -0.378 -11.014 -8.437
11 HD23 LEU 68 HD23 LEU 68 -0.281 -9.713 -7.251
No H/Q in entry = 11
In of MODEL 15
1 H LYS 69 H LYS 69 -3.708 -5.858 -9.990
2 HA LYS 69 HA LYS 69 -4.584 -7.363 -12.207
3 HB2 LYS 69 HB2 LYS 69 -5.693 -4.934 -10.833
4 HB3 LYS 69 HB3 LYS 69 -6.453 -5.584 -12.276
5 HG2 LYS 69 HG2 LYS 69 -6.773 -7.723 -11.146
6 HG3 LYS 69 HG3 LYS 69 -6.015 -7.062 -9.693
7 HD2 LYS 69 HD2 LYS 69 -7.761 -5.392 -9.510
8 HD3 LYS 69 HD3 LYS 69 -8.491 -5.960 -11.012
9 HE2 LYS 69 HE2 LYS 69 -9.059 -8.058 -10.018
10 HE3 LYS 69 HE3 LYS 69 -8.145 -7.669 -8.557
11 HZ1 LYS 69 HZ1 LYS 69 -9.681 -5.838 -8.140
12 HZ2 LYS 69 HZ2 LYS 69 -10.577 -6.260 -9.515
13 HZ3 LYS 69 HZ3 LYS 69 -10.497 -7.324 -8.205
No H/Q in entry = 13
In of MODEL 15
1 H HIS 70 H HIS 70 -2.524 -4.769 -12.064
2 HA HIS 70 HA HIS 70 -3.181 -3.870 -14.771
3 HB2 HIS 70 HB2 HIS 70 -3.114 -2.039 -13.138
4 HB3 HIS 70 HB3 HIS 70 -1.496 -2.521 -12.645
5 HD1 HIS 70 HD1 HIS 70 -3.219 -0.277 -14.881
6 HD2 HIS 70 HD2 HIS 70 0.436 -2.258 -14.854
7 HE1 HIS 70 HE1 HIS 70 -1.796 0.923 -16.572
8 HE2 HIS 70 HE2 HIS 70 0.319 -0.438 -16.699
No H/Q in entry = 8
In of MODEL 15
1 H VAL 71 H VAL 71 -0.487 -4.569 -12.598
2 HA VAL 71 HA VAL 71 1.451 -4.473 -14.598
3 HB VAL 71 HB VAL 71 2.052 -3.912 -12.384
4 HG11 VAL 71 HG11 VAL 71 1.294 -6.659 -11.576
5 HG12 VAL 71 HG12 VAL 71 2.136 -5.478 -10.558
6 HG13 VAL 71 HG13 VAL 71 0.499 -5.144 -11.146
7 HG21 VAL 71 HG21 VAL 71 3.352 -6.445 -13.258
8 HG22 VAL 71 HG22 VAL 71 3.880 -4.789 -13.553
9 HG23 VAL 71 HG23 VAL 71 3.938 -5.451 -11.923
No H/Q in entry = 9
In of MODEL 15
1 H VAL 72 H VAL 72 0.088 -7.338 -12.889
2 HA VAL 72 HA VAL 72 1.362 -8.924 -14.964
3 HB VAL 72 HB VAL 72 1.310 -9.613 -12.471
4 HG11 VAL 72 HG11 VAL 72 -1.417 -10.548 -13.310
5 HG12 VAL 72 HG12 VAL 72 -0.566 -11.063 -11.853
6 HG13 VAL 72 HG13 VAL 72 -1.048 -9.376 -12.048
7 HG21 VAL 72 HG21 VAL 72 2.124 -10.893 -14.427
8 HG22 VAL 72 HG22 VAL 72 1.528 -11.874 -13.098
9 HG23 VAL 72 HG23 VAL 72 0.530 -11.642 -14.530
No H/Q in entry = 9
In of MODEL 15
1 H GLY 73 H GLY 73 -1.885 -8.117 -13.794
2 HA2 GLY 73 HA2 GLY 73 -2.933 -9.195 -16.335
3 HA3 GLY 73 HA3 GLY 73 -3.548 -7.736 -15.572
No H/Q in entry = 3
In of MODEL 15
1 H GLU 74 H GLU 74 -5.535 -9.117 -15.992
2 HA GLU 74 HA GLU 74 -6.541 -9.953 -13.502
3 HB2 GLU 74 HB2 GLU 74 -7.608 -10.134 -16.306
4 HB3 GLU 74 HB3 GLU 74 -8.508 -10.748 -14.924
5 HG2 GLU 74 HG2 GLU 74 -7.489 -7.937 -14.990
6 HG3 GLU 74 HG3 GLU 74 -9.018 -8.384 -15.745
No H/Q in entry = 6
In of MODEL 15
1 H GLU 75 H GLU 75 -5.658 -11.818 -16.396
2 HA GLU 75 HA GLU 75 -6.259 -14.403 -15.818
3 HB2 GLU 75 HB2 GLU 75 -5.035 -13.776 -17.805
4 HB3 GLU 75 HB3 GLU 75 -3.632 -13.338 -16.848
5 HG2 GLU 75 HG2 GLU 75 -3.527 -15.728 -16.092
6 HG3 GLU 75 HG3 GLU 75 -4.761 -16.081 -17.302
No H/Q in entry = 6
In of MODEL 15
1 H LYS 76 H LYS 76 -3.213 -12.933 -14.754
2 HA LYS 76 HA LYS 76 -2.480 -15.224 -13.255
3 HB2 LYS 76 HB2 LYS 76 -0.846 -13.766 -14.283
4 HB3 LYS 76 HB3 LYS 76 -1.377 -12.425 -13.293
5 HG2 LYS 76 HG2 LYS 76 0.740 -13.507 -12.584
6 HG3 LYS 76 HG3 LYS 76 -0.490 -13.389 -11.337
7 HD2 LYS 76 HD2 LYS 76 0.390 -15.559 -11.122
8 HD3 LYS 76 HD3 LYS 76 -1.118 -15.785 -12.000
9 HE2 LYS 76 HE2 LYS 76 1.577 -15.569 -13.322
10 HE3 LYS 76 HE3 LYS 76 0.829 -17.093 -12.870
11 HZ1 LYS 76 HZ1 LYS 76 -1.050 -16.505 -14.339
12 HZ2 LYS 76 HZ2 LYS 76 -0.185 -15.139 -14.854
13 HZ3 LYS 76 HZ3 LYS 76 0.419 -16.682 -15.162
No H/Q in entry = 13
In of MODEL 15
1 H ALA 77 H ALA 77 -3.645 -11.987 -12.298
2 HA ALA 77 HA ALA 77 -3.411 -12.394 -9.524
3 HB1 ALA 77 HB1 ALA 77 -4.940 -10.485 -9.303
4 HB2 ALA 77 HB2 ALA 77 -5.325 -10.594 -11.020
5 HB3 ALA 77 HB3 ALA 77 -3.691 -10.173 -10.509
No H/Q in entry = 5
In of MODEL 15
1 H ALA 78 H ALA 78 -5.871 -13.273 -11.839
2 HA ALA 78 HA ALA 78 -7.892 -13.991 -9.970
3 HB1 ALA 78 HB1 ALA 78 -8.523 -13.502 -12.215
4 HB2 ALA 78 HB2 ALA 78 -8.855 -15.214 -11.942
5 HB3 ALA 78 HB3 ALA 78 -7.423 -14.723 -12.859
No H/Q in entry = 5
In of MODEL 15
1 H GLU 79 H GLU 79 -5.397 -15.828 -11.721
2 HA GLU 79 HA GLU 79 -6.174 -18.341 -10.671
3 HB2 GLU 79 HB2 GLU 79 -4.378 -19.252 -11.793
4 HB3 GLU 79 HB3 GLU 79 -4.796 -17.843 -12.754
5 HG2 GLU 79 HG2 GLU 79 -3.045 -16.593 -11.590
6 HG3 GLU 79 HG3 GLU 79 -2.583 -18.086 -10.783
No H/Q in entry = 6
In of MODEL 15
1 H LEU 80 H LEU 80 -4.195 -15.791 -9.487
2 HA LEU 80 HA LEU 80 -2.963 -17.324 -7.412
3 HB2 LEU 80 HB2 LEU 80 -3.300 -14.351 -7.778
4 HB3 LEU 80 HB3 LEU 80 -2.311 -15.095 -6.533
5 HG LEU 80 HG LEU 80 -1.867 -15.514 -9.483
6 HD11 LEU 80 HD11 LEU 80 -0.570 -13.574 -7.589
7 HD12 LEU 80 HD12 LEU 80 0.045 -13.976 -9.194
8 HD13 LEU 80 HD13 LEU 80 -1.534 -13.200 -9.021
9 HD21 LEU 80 HD21 LEU 80 -1.023 -17.279 -8.046
10 HD22 LEU 80 HD22 LEU 80 0.303 -16.353 -8.755
11 HD23 LEU 80 HD23 LEU 80 -0.160 -16.089 -7.072
No H/Q in entry = 11
In of MODEL 15
1 H LYS 81 H LYS 81 -5.823 -15.308 -7.687
2 HA LYS 81 HA LYS 81 -6.444 -15.321 -4.915
3 HB2 LYS 81 HB2 LYS 81 -7.324 -13.676 -6.602
4 HB3 LYS 81 HB3 LYS 81 -8.348 -14.955 -7.237
5 HG2 LYS 81 HG2 LYS 81 -9.593 -13.496 -5.753
6 HG3 LYS 81 HG3 LYS 81 -9.482 -15.123 -5.082
7 HD2 LYS 81 HD2 LYS 81 -7.756 -14.437 -3.556
8 HD3 LYS 81 HD3 LYS 81 -7.662 -12.846 -4.311
9 HE2 LYS 81 HE2 LYS 81 -8.911 -12.784 -2.200
10 HE3 LYS 81 HE3 LYS 81 -9.919 -12.334 -3.573
11 HZ1 LYS 81 HZ1 LYS 81 -10.841 -14.571 -3.574
12 HZ2 LYS 81 HZ2 LYS 81 -9.883 -14.990 -2.249
13 HZ3 LYS 81 HZ3 LYS 81 -11.087 -13.818 -2.083
No H/Q in entry = 13
In of MODEL 15
1 H ASN 82 H ASN 82 -7.412 -17.289 -7.684
2 HA ASN 82 HA ASN 82 -9.092 -19.039 -6.189
3 HB2 ASN 82 HB2 ASN 82 -9.218 -18.751 -8.669
4 HB3 ASN 82 HB3 ASN 82 -7.677 -19.581 -8.808
5 HD21 ASN 82 HD21 ASN 82 -7.579 -21.788 -8.541
6 HD22 ASN 82 HD22 ASN 82 -8.992 -22.784 -8.442
No H/Q in entry = 6
In of MODEL 15
1 H LEU 83 H LEU 83 -5.647 -18.915 -6.852
2 HA LEU 83 HA LEU 83 -4.991 -21.564 -6.285
3 HB2 LEU 83 HB2 LEU 83 -3.638 -19.035 -6.555
4 HB3 LEU 83 HB3 LEU 83 -2.954 -19.952 -5.242
5 HG LEU 83 HG LEU 83 -3.215 -20.912 -8.089
6 HD11 LEU 83 HD11 LEU 83 -0.802 -20.041 -6.507
7 HD12 LEU 83 HD12 LEU 83 -0.770 -20.750 -8.120
8 HD13 LEU 83 HD13 LEU 83 -1.533 -19.182 -7.862
9 HD21 LEU 83 HD21 LEU 83 -3.384 -22.727 -6.424
10 HD22 LEU 83 HD22 LEU 83 -1.917 -22.830 -7.397
11 HD23 LEU 83 HD23 LEU 83 -1.838 -22.220 -5.745
No H/Q in entry = 11
In of MODEL 15
1 H LYS 84 H LYS 84 -5.008 -18.731 -4.164
2 HA LYS 84 HA LYS 84 -4.513 -19.991 -1.738
3 HB2 LYS 84 HB2 LYS 84 -4.564 -17.560 -1.964
4 HB3 LYS 84 HB3 LYS 84 -6.288 -17.606 -2.282
5 HG2 LYS 84 HG2 LYS 84 -6.740 -18.361 -0.051
6 HG3 LYS 84 HG3 LYS 84 -5.018 -18.523 0.288
7 HD2 LYS 84 HD2 LYS 84 -4.714 -16.134 0.087
8 HD3 LYS 84 HD3 LYS 84 -6.398 -15.931 -0.399
9 HE2 LYS 84 HE2 LYS 84 -6.040 -15.349 1.958
10 HE3 LYS 84 HE3 LYS 84 -7.147 -16.707 1.772
11 HZ1 LYS 84 HZ1 LYS 84 -4.270 -16.906 2.475
12 HZ2 LYS 84 HZ2 LYS 84 -5.562 -17.087 3.550
13 HZ3 LYS 84 HZ3 LYS 84 -5.334 -18.208 2.307
No H/Q in entry = 13
In of MODEL 15
1 H ASP 85 H ASP 85 -7.564 -19.474 -3.414
2 HA ASP 85 HA ASP 85 -9.264 -20.526 -1.419
3 HB2 ASP 85 HB2 ASP 85 -9.953 -19.087 -3.362
4 HB3 ASP 85 HB3 ASP 85 -9.751 -20.496 -4.399
No H/Q in entry = 4
In of MODEL 15
1 H SER 86 H SER 86 -7.542 -22.045 -4.091
2 HA SER 86 HA SER 86 -8.785 -24.605 -3.696
3 HB2 SER 86 HB2 SER 86 -6.291 -23.856 -5.244
4 HB3 SER 86 HB3 SER 86 -7.122 -25.409 -5.330
5 HG SER 86 HG SER 86 -8.586 -23.069 -5.820
No H/Q in entry = 5
In of MODEL 15
1 H GLY 87 H GLY 87 -6.332 -22.881 -2.150
2 HA2 GLY 87 HA2 GLY 87 -5.477 -25.350 -0.774
3 HA3 GLY 87 HA3 GLY 87 -5.625 -23.785 0.007
No H/Q in entry = 3
In of MODEL 15
1 H ALA 88 H ALA 88 -4.345 -22.244 -2.035
2 HA ALA 88 HA ALA 88 -1.667 -23.275 -2.176
3 HB1 ALA 88 HB1 ALA 88 -2.673 -20.492 -2.769
4 HB2 ALA 88 HB2 ALA 88 -2.506 -21.801 -3.938
5 HB3 ALA 88 HB3 ALA 88 -1.073 -21.121 -3.163
No H/Q in entry = 5
In of MODEL 15
1 H SER 89 H SER 89 -0.234 -23.039 -0.663
2 HA SER 89 HA SER 89 -0.718 -21.710 1.798
3 HB2 SER 89 HB2 SER 89 1.636 -22.479 2.270
4 HB3 SER 89 HB3 SER 89 0.525 -23.765 1.817
5 HG SER 89 HG SER 89 1.692 -24.136 0.112
No H/Q in entry = 5
In of MODEL 15
1 H LYS 90 H LYS 90 1.363 -20.424 2.647
2 HA LYS 90 HA LYS 90 1.359 -17.944 1.378
3 HB2 LYS 90 HB2 LYS 90 3.511 -19.065 3.181
4 HB3 LYS 90 HB3 LYS 90 3.217 -17.365 2.846
5 HG2 LYS 90 HG2 LYS 90 1.054 -17.501 3.937
6 HG3 LYS 90 HG3 LYS 90 1.298 -19.223 4.230
7 HD2 LYS 90 HD2 LYS 90 3.281 -18.682 5.587
8 HD3 LYS 90 HD3 LYS 90 2.957 -16.965 5.339
9 HE2 LYS 90 HE2 LYS 90 1.140 -18.946 6.704
10 HE3 LYS 90 HE3 LYS 90 2.115 -17.712 7.499
11 HZ1 LYS 90 HZ1 LYS 90 0.838 -16.023 6.299
12 HZ2 LYS 90 HZ2 LYS 90 -0.132 -17.228 5.621
13 HZ3 LYS 90 HZ3 LYS 90 -0.145 -16.969 7.294
No H/Q in entry = 13
In of MODEL 15
1 H GLU 91 H GLU 91 3.313 -20.768 0.831
2 HA GLU 91 HA GLU 91 5.436 -19.303 -0.460
3 HB2 GLU 91 HB2 GLU 91 4.999 -22.273 -0.158
4 HB3 GLU 91 HB3 GLU 91 6.460 -21.518 -0.780
5 HG2 GLU 91 HG2 GLU 91 6.794 -20.403 1.367
6 HG3 GLU 91 HG3 GLU 91 5.338 -21.177 1.988
No H/Q in entry = 6
In of MODEL 15
1 H GLU 92 H GLU 92 2.910 -21.559 -1.515
2 HA GLU 92 HA GLU 92 3.500 -21.664 -4.216
3 HB2 GLU 92 HB2 GLU 92 0.813 -21.715 -2.846
4 HB3 GLU 92 HB3 GLU 92 1.151 -22.284 -4.468
5 HG2 GLU 92 HG2 GLU 92 2.345 -23.404 -1.965
6 HG3 GLU 92 HG3 GLU 92 0.986 -24.079 -2.845
No H/Q in entry = 6
In of MODEL 15
1 H LEU 93 H LEU 93 1.517 -19.415 -2.343
2 HA LEU 93 HA LEU 93 1.115 -17.690 -4.588
3 HB2 LEU 93 HB2 LEU 93 0.989 -17.104 -1.624
4 HB3 LEU 93 HB3 LEU 93 0.510 -15.969 -2.878
5 HG LEU 93 HG LEU 93 -0.760 -18.651 -2.313
6 HD11 LEU 93 HD11 LEU 93 -1.778 -15.843 -1.987
7 HD12 LEU 93 HD12 LEU 93 -2.739 -17.311 -1.803
8 HD13 LEU 93 HD13 LEU 93 -1.402 -16.992 -0.700
9 HD21 LEU 93 HD21 LEU 93 -1.352 -16.623 -4.462
10 HD22 LEU 93 HD22 LEU 93 -0.788 -18.278 -4.686
11 HD23 LEU 93 HD23 LEU 93 -2.401 -17.976 -4.042
No H/Q in entry = 11
In of MODEL 15
1 H LYS 94 H LYS 94 3.668 -17.851 -2.052
2 HA LYS 94 HA LYS 94 4.609 -15.273 -2.718
3 HB2 LYS 94 HB2 LYS 94 5.071 -16.405 -0.559
4 HB3 LYS 94 HB3 LYS 94 6.143 -17.516 -1.396
5 HG2 LYS 94 HG2 LYS 94 7.611 -15.683 -2.004
6 HG3 LYS 94 HG3 LYS 94 6.521 -14.535 -1.221
7 HD2 LYS 94 HD2 LYS 94 6.876 -15.694 0.918
8 HD3 LYS 94 HD3 LYS 94 8.009 -16.787 0.123
9 HE2 LYS 94 HE2 LYS 94 9.488 -14.955 -0.382
10 HE3 LYS 94 HE3 LYS 94 8.325 -13.792 0.254
11 HZ1 LYS 94 HZ1 LYS 94 8.564 -14.804 2.433
12 HZ2 LYS 94 HZ2 LYS 94 9.695 -15.905 1.824
13 HZ3 LYS 94 HZ3 LYS 94 10.062 -14.254 1.863
No H/Q in entry = 13
In of MODEL 15
1 H ALA 95 H ALA 95 5.542 -18.482 -3.745
2 HA ALA 95 HA ALA 95 7.795 -17.464 -5.227
3 HB1 ALA 95 HB1 ALA 95 7.930 -19.624 -4.095
4 HB2 ALA 95 HB2 ALA 95 6.648 -20.245 -5.134
5 HB3 ALA 95 HB3 ALA 95 8.197 -19.778 -5.831
No H/Q in entry = 5
In of MODEL 15
1 H LYS 96 H LYS 96 4.620 -18.931 -5.986
2 HA LYS 96 HA LYS 96 5.061 -18.936 -8.789
3 HB2 LYS 96 HB2 LYS 96 2.608 -19.089 -7.082
4 HB3 LYS 96 HB3 LYS 96 2.506 -19.065 -8.829
5 HG2 LYS 96 HG2 LYS 96 4.073 -21.069 -7.221
6 HG3 LYS 96 HG3 LYS 96 2.462 -21.339 -7.887
7 HD2 LYS 96 HD2 LYS 96 4.752 -20.526 -9.644
8 HD3 LYS 96 HD3 LYS 96 4.492 -22.208 -9.207
9 HE2 LYS 96 HE2 LYS 96 2.403 -20.451 -10.468
10 HE3 LYS 96 HE3 LYS 96 3.469 -21.517 -11.382
11 HZ1 LYS 96 HZ1 LYS 96 2.568 -23.401 -10.158
12 HZ2 LYS 96 HZ2 LYS 96 1.537 -22.378 -9.290
13 HZ3 LYS 96 HZ3 LYS 96 1.337 -22.564 -10.956
No H/Q in entry = 13
In of MODEL 15
1 H VAL 97 H VAL 97 4.182 -16.446 -6.608
2 HA VAL 97 HA VAL 97 3.080 -14.597 -8.493
3 HB VAL 97 HB VAL 97 4.200 -14.308 -5.706
4 HG11 VAL 97 HG11 VAL 97 4.794 -12.279 -6.917
5 HG12 VAL 97 HG12 VAL 97 3.118 -12.091 -7.433
6 HG13 VAL 97 HG13 VAL 97 3.534 -11.966 -5.723
7 HG21 VAL 97 HG21 VAL 97 1.979 -15.297 -5.971
8 HG22 VAL 97 HG22 VAL 97 1.921 -13.747 -5.130
9 HG23 VAL 97 HG23 VAL 97 1.440 -13.849 -6.828
No H/Q in entry = 9
In of MODEL 15
1 H GLU 98 H GLU 98 6.286 -15.462 -7.367
2 HA GLU 98 HA GLU 98 7.730 -13.259 -8.342
3 HB2 GLU 98 HB2 GLU 98 8.668 -16.131 -8.178
4 HB3 GLU 98 HB3 GLU 98 9.690 -14.703 -8.261
5 HG2 GLU 98 HG2 GLU 98 7.786 -15.286 -6.011
6 HG3 GLU 98 HG3 GLU 98 9.495 -15.712 -6.001
No H/Q in entry = 6
In of MODEL 15
1 H GLU 99 H GLU 99 6.557 -16.188 -9.881
2 HA GLU 99 HA GLU 99 7.924 -15.772 -12.361
3 HB2 GLU 99 HB2 GLU 99 5.440 -17.409 -11.797
4 HB3 GLU 99 HB3 GLU 99 6.433 -17.510 -13.243
5 HG2 GLU 99 HG2 GLU 99 7.250 -18.252 -10.445
6 HG3 GLU 99 HG3 GLU 99 6.920 -19.354 -11.779
No H/Q in entry = 6
In of MODEL 15
1 H ALA 100 H ALA 100 4.776 -14.983 -11.047
2 HA ALA 100 HA ALA 100 3.557 -13.907 -13.325
3 HB1 ALA 100 HB1 ALA 100 3.296 -13.309 -10.381
4 HB2 ALA 100 HB2 ALA 100 2.248 -14.313 -11.384
5 HB3 ALA 100 HB3 ALA 100 2.265 -12.564 -11.599
No H/Q in entry = 5
In of MODEL 15
1 H LEU 101 H LEU 101 5.202 -12.204 -10.679
2 HA LEU 101 HA LEU 101 5.316 -9.703 -11.945
3 HB2 LEU 101 HB2 LEU 101 6.735 -10.964 -9.634
4 HB3 LEU 101 HB3 LEU 101 7.245 -9.391 -10.211
5 HG LEU 101 HG LEU 101 5.659 -9.410 -8.249
6 HD11 LEU 101 HD11 LEU 101 4.810 -7.918 -10.724
7 HD12 LEU 101 HD12 LEU 101 4.358 -7.507 -9.070
8 HD13 LEU 101 HD13 LEU 101 6.046 -7.410 -9.572
9 HD21 LEU 101 HD21 LEU 101 4.161 -11.175 -9.026
10 HD22 LEU 101 HD22 LEU 101 3.290 -9.681 -8.685
11 HD23 LEU 101 HD23 LEU 101 3.635 -10.140 -10.352
No H/Q in entry = 11
In of MODEL 15
1 H HIS 102 H HIS 102 7.135 -12.525 -12.545
2 HA HIS 102 HA HIS 102 9.377 -11.028 -13.575
3 HB2 HIS 102 HB2 HIS 102 9.540 -13.339 -12.454
4 HB3 HIS 102 HB3 HIS 102 8.907 -13.989 -13.960
5 HD1 HIS 102 HD1 HIS 102 10.489 -13.397 -16.146
6 HD2 HIS 102 HD2 HIS 102 12.203 -13.140 -12.370
7 HE1 HIS 102 HE1 HIS 102 12.972 -13.454 -16.527
8 HE2 HIS 102 HE2 HIS 102 13.983 -13.460 -14.217
No H/Q in entry = 8
In of MODEL 15
1 H ALA 103 H ALA 103 6.762 -13.096 -14.766
2 HA ALA 103 HA ALA 103 7.554 -13.116 -17.454
3 HB1 ALA 103 HB1 ALA 103 4.883 -13.695 -16.172
4 HB2 ALA 103 HB2 ALA 103 6.172 -14.853 -16.517
5 HB3 ALA 103 HB3 ALA 103 5.301 -14.082 -17.844
No H/Q in entry = 5
In of MODEL 15
1 H VAL 104 H VAL 104 6.410 -10.482 -15.821
2 HA VAL 104 HA VAL 104 4.826 -9.427 -17.971
3 HB VAL 104 HB VAL 104 3.975 -8.918 -15.867
4 HG11 VAL 104 HG11 VAL 104 5.910 -9.476 -14.561
5 HG12 VAL 104 HG12 VAL 104 6.708 -7.993 -15.082
6 HG13 VAL 104 HG13 VAL 104 5.263 -7.910 -14.075
7 HG21 VAL 104 HG21 VAL 104 5.528 -6.523 -16.805
8 HG22 VAL 104 HG22 VAL 104 3.912 -6.992 -17.325
9 HG23 VAL 104 HG23 VAL 104 4.184 -6.469 -15.666
No H/Q in entry = 9
In of MODEL 15
1 H THR 105 H THR 105 5.385 -7.606 -19.187
2 HA THR 105 HA THR 105 8.202 -6.798 -19.079
3 HB THR 105 HB THR 105 8.354 -7.153 -21.584
4 HG1 THR 105 HG1 THR 105 6.577 -9.214 -21.584
5 HG21 THR 105 HG21 THR 105 8.070 -9.591 -19.825
6 HG22 THR 105 HG22 THR 105 8.896 -9.543 -21.380
7 HG23 THR 105 HG23 THR 105 9.524 -8.613 -20.021
No H/Q in entry = 7
In of MODEL 15
1 H ASP 106 H ASP 106 5.055 -5.737 -19.363
2 HA ASP 106 HA ASP 106 5.634 -3.567 -21.166
3 HB2 ASP 106 HB2 ASP 106 3.323 -4.546 -20.765
4 HB3 ASP 106 HB3 ASP 106 3.351 -3.735 -19.209
No H/Q in entry = 4
In of MODEL 15
1 H GLU 107 H GLU 107 6.341 -1.595 -20.679
2 HA GLU 107 HA GLU 107 8.100 -1.418 -18.572
3 HB2 GLU 107 HB2 GLU 107 6.954 0.786 -20.272
4 HB3 GLU 107 HB3 GLU 107 8.347 0.969 -19.214
5 HG2 GLU 107 HG2 GLU 107 9.577 -0.672 -20.488
6 HG3 GLU 107 HG3 GLU 107 8.167 -0.972 -21.503
No H/Q in entry = 6
In of MODEL 15
1 H GLU 108 H GLU 108 5.056 0.390 -18.880
2 HA GLU 108 HA GLU 108 5.170 1.736 -16.445
3 HB2 GLU 108 HB2 GLU 108 2.761 0.717 -17.949
4 HB3 GLU 108 HB3 GLU 108 2.651 1.755 -16.536
5 HG2 GLU 108 HG2 GLU 108 4.071 3.413 -17.791
6 HG3 GLU 108 HG3 GLU 108 3.830 2.402 -19.217
No H/Q in entry = 6
In of MODEL 15
1 H LYS 109 H LYS 109 3.968 -1.508 -17.163
2 HA LYS 109 HA LYS 109 2.973 -2.148 -14.622
3 HB2 LYS 109 HB2 LYS 109 4.179 -3.942 -16.742
4 HB3 LYS 109 HB3 LYS 109 3.218 -4.494 -15.382
5 HG2 LYS 109 HG2 LYS 109 1.307 -3.217 -16.231
6 HG3 LYS 109 HG3 LYS 109 2.277 -2.716 -17.615
7 HD2 LYS 109 HD2 LYS 109 2.567 -5.119 -18.201
8 HD3 LYS 109 HD3 LYS 109 1.469 -5.529 -16.885
9 HE2 LYS 109 HE2 LYS 109 -0.308 -4.248 -17.945
10 HE3 LYS 109 HE3 LYS 109 0.787 -3.781 -19.242
11 HZ1 LYS 109 HZ1 LYS 109 -0.068 -6.555 -18.620
12 HZ2 LYS 109 HZ2 LYS 109 -0.639 -5.611 -19.901
13 HZ3 LYS 109 HZ3 LYS 109 0.975 -6.105 -19.871
No H/Q in entry = 13
In of MODEL 15
1 H LYS 110 H LYS 110 6.206 -2.581 -16.043
2 HA LYS 110 HA LYS 110 7.247 -3.950 -13.762
3 HB2 LYS 110 HB2 LYS 110 8.681 -2.627 -16.063
4 HB3 LYS 110 HB3 LYS 110 9.452 -3.646 -14.858
5 HG2 LYS 110 HG2 LYS 110 7.956 -5.506 -15.585
6 HG3 LYS 110 HG3 LYS 110 7.396 -4.463 -16.894
7 HD2 LYS 110 HD2 LYS 110 10.258 -5.296 -16.419
8 HD3 LYS 110 HD3 LYS 110 9.181 -6.001 -17.623
9 HE2 LYS 110 HE2 LYS 110 9.004 -3.836 -18.741
10 HE3 LYS 110 HE3 LYS 110 10.048 -3.113 -17.519
11 HZ1 LYS 110 HZ1 LYS 110 10.846 -5.287 -19.371
12 HZ2 LYS 110 HZ2 LYS 110 11.259 -3.659 -19.547
13 HZ3 LYS 110 HZ3 LYS 110 11.844 -4.544 -18.230
No H/Q in entry = 13
In of MODEL 15
1 H GLN 111 H GLN 111 6.880 -0.659 -14.607
2 HA GLN 111 HA GLN 111 8.612 0.495 -12.711
3 HB2 GLN 111 HB2 GLN 111 7.369 1.750 -14.473
4 HB3 GLN 111 HB3 GLN 111 5.884 1.496 -13.568
5 HG2 GLN 111 HG2 GLN 111 6.827 3.736 -13.246
6 HG3 GLN 111 HG3 GLN 111 6.716 2.824 -11.743
7 HE21 GLN 111 HE21 GLN 111 8.545 2.262 -10.666
8 HE22 GLN 111 HE22 GLN 111 10.119 2.840 -11.094
No H/Q in entry = 8
In of MODEL 15
1 H TYR 112 H TYR 112 5.367 -0.855 -12.423
2 HA TYR 112 HA TYR 112 4.956 -0.081 -9.687
3 HB2 TYR 112 HB2 TYR 112 3.639 -2.297 -11.279
4 HB3 TYR 112 HB3 TYR 112 3.072 -1.668 -9.736
5 HD1 TYR 112 HD1 TYR 112 3.329 1.231 -10.094
6 HD2 TYR 112 HD2 TYR 112 2.035 -1.752 -12.834
7 HE1 TYR 112 HE1 TYR 112 2.024 2.925 -11.311
8 HE2 TYR 112 HE2 TYR 112 0.739 -0.064 -14.058
9 HH TYR 112 HH TYR 112 1.119 3.247 -13.597
No H/Q in entry = 9
In of MODEL 15
1 H ILE 113 H ILE 113 6.271 -2.879 -11.345
2 HA ILE 113 HA ILE 113 6.558 -4.639 -9.214
3 HB ILE 113 HB ILE 113 8.508 -4.194 -11.474
4 HG12 ILE 113 HG12 ILE 113 6.155 -6.071 -11.196
5 HG13 ILE 113 HG13 ILE 113 6.239 -4.666 -12.253
6 HG21 ILE 113 HG21 ILE 113 8.132 -6.558 -9.634
7 HG22 ILE 113 HG22 ILE 113 9.194 -6.518 -11.043
8 HG23 ILE 113 HG23 ILE 113 9.516 -5.465 -9.663
9 HD11 ILE 113 HD11 ILE 113 8.148 -5.745 -13.410
10 HD12 ILE 113 HD12 ILE 113 7.851 -7.182 -12.435
11 HD13 ILE 113 HD13 ILE 113 6.618 -6.607 -13.556
No H/Q in entry = 11
In of MODEL 15
1 H ALA 114 H ALA 114 8.719 -2.045 -10.317
2 HA ALA 114 HA ALA 114 10.671 -2.477 -8.289
3 HB1 ALA 114 HB1 ALA 114 11.300 -1.461 -10.396
4 HB2 ALA 114 HB2 ALA 114 11.618 -0.325 -9.085
5 HB3 ALA 114 HB3 ALA 114 10.197 -0.115 -10.115
No H/Q in entry = 5
In of MODEL 15
1 H ASP 115 H ASP 115 8.024 -0.167 -8.727
2 HA ASP 115 HA ASP 115 8.623 1.340 -6.401
3 HB2 ASP 115 HB2 ASP 115 6.078 1.122 -8.013
4 HB3 ASP 115 HB3 ASP 115 6.286 2.239 -6.669
No H/Q in entry = 4
In of MODEL 15
1 H PHE 116 H PHE 116 6.054 -1.053 -7.013
2 HA PHE 116 HA PHE 116 5.403 -0.904 -4.162
3 HB2 PHE 116 HB2 PHE 116 3.799 -0.962 -6.527
4 HB3 PHE 116 HB3 PHE 116 3.455 -2.414 -5.596
5 HD1 PHE 116 HD1 PHE 116 2.535 -2.258 -3.346
6 HD2 PHE 116 HD2 PHE 116 3.155 1.188 -5.766
7 HE1 PHE 116 HE1 PHE 116 1.071 -0.942 -1.855
8 HE2 PHE 116 HE2 PHE 116 1.698 2.503 -4.288
9 HZ PHE 116 HZ PHE 116 0.563 1.380 -2.376
No H/Q in entry = 9
In of MODEL 15
1 H GLY 117 H GLY 117 6.675 -3.050 -6.536
2 HA2 GLY 117 HA2 GLY 117 7.378 -5.245 -6.394
3 HA3 GLY 117 HA3 GLY 117 5.730 -5.530 -5.874
No H/Q in entry = 3
In of MODEL 15
1 HA PRO 118 HA PRO 118 9.152 -6.523 -2.593
2 HB2 PRO 118 HB2 PRO 118 10.471 -4.346 -1.539
3 HB3 PRO 118 HB3 PRO 118 11.096 -5.355 -2.849
4 HG2 PRO 118 HG2 PRO 118 9.662 -2.729 -2.995
5 HG3 PRO 118 HG3 PRO 118 11.083 -3.280 -3.907
6 HD2 PRO 118 HD2 PRO 118 8.653 -3.278 -5.021
7 HD3 PRO 118 HD3 PRO 118 9.803 -4.597 -5.341
No H/Q in entry = 7
In of MODEL 15
1 H ALA 119 H ALA 119 7.326 -3.565 -2.371
2 HA ALA 119 HA ALA 119 6.991 -3.710 0.502
3 HB1 ALA 119 HB1 ALA 119 5.574 -1.739 0.190
4 HB2 ALA 119 HB2 ALA 119 5.720 -1.913 -1.558
5 HB3 ALA 119 HB3 ALA 119 7.144 -1.544 -0.587
No H/Q in entry = 5
In of MODEL 15
1 H CYS 120 H CYS 120 5.119 -4.392 -2.395
2 HA CYS 120 HA CYS 120 2.700 -5.157 -1.260
3 HB2 CYS 120 HB2 CYS 120 4.186 -6.302 -3.628
4 HB3 CYS 120 HB3 CYS 120 2.540 -6.757 -3.202
No H/Q in entry = 4
In of MODEL 15
1 H LYS 121 H LYS 121 5.793 -6.822 -1.363
2 HA LYS 121 HA LYS 121 4.972 -9.366 -0.603
3 HB2 LYS 121 HB2 LYS 121 7.479 -7.881 -0.562
4 HB3 LYS 121 HB3 LYS 121 7.374 -9.085 0.716
5 HG2 LYS 121 HG2 LYS 121 8.409 -9.926 -1.375
6 HG3 LYS 121 HG3 LYS 121 6.983 -10.834 -0.872
7 HD2 LYS 121 HD2 LYS 121 5.650 -9.414 -2.469
8 HD3 LYS 121 HD3 LYS 121 7.181 -8.779 -3.068
9 HE2 LYS 121 HE2 LYS 121 6.409 -11.696 -3.039
10 HE3 LYS 121 HE3 LYS 121 6.273 -10.633 -4.441
11 HZ1 LYS 121 HZ1 LYS 121 8.715 -10.247 -4.215
12 HZ2 LYS 121 HZ2 LYS 121 8.755 -11.485 -3.063
13 HZ3 LYS 121 HZ3 LYS 121 8.287 -11.824 -4.655
No H/Q in entry = 13
In of MODEL 15
1 H LYS 122 H LYS 122 6.012 -6.759 1.674
2 HA LYS 122 HA LYS 122 5.182 -8.201 3.966
3 HB2 LYS 122 HB2 LYS 122 5.245 -6.059 5.173
4 HB3 LYS 122 HB3 LYS 122 6.692 -6.314 4.211
5 HG2 LYS 122 HG2 LYS 122 5.998 -4.731 2.593
6 HG3 LYS 122 HG3 LYS 122 4.381 -4.632 3.290
7 HD2 LYS 122 HD2 LYS 122 5.717 -2.689 3.904
8 HD3 LYS 122 HD3 LYS 122 5.318 -3.651 5.327
9 HE2 LYS 122 HE2 LYS 122 7.617 -2.942 5.452
10 HE3 LYS 122 HE3 LYS 122 7.556 -4.684 5.209
11 HZ1 LYS 122 HZ1 LYS 122 8.060 -2.669 3.088
12 HZ2 LYS 122 HZ2 LYS 122 9.234 -3.626 3.828
13 HZ3 LYS 122 HZ3 LYS 122 8.042 -4.346 2.874
No H/Q in entry = 13
In of MODEL 15
1 H ILE 123 H ILE 123 3.466 -6.240 1.661
2 HA ILE 123 HA ILE 123 1.162 -5.745 3.209
3 HB ILE 123 HB ILE 123 1.561 -5.792 0.242
4 HG12 ILE 123 HG12 ILE 123 1.197 -3.576 2.270
5 HG13 ILE 123 HG13 ILE 123 2.719 -4.039 1.517
6 HG21 ILE 123 HG21 ILE 123 -0.892 -5.040 1.828
7 HG22 ILE 123 HG22 ILE 123 -0.641 -4.647 0.123
8 HG23 ILE 123 HG23 ILE 123 -0.749 -6.333 0.634
9 HD11 ILE 123 HD11 ILE 123 0.328 -3.024 0.030
10 HD12 ILE 123 HD12 ILE 123 1.690 -2.029 0.544
11 HD13 ILE 123 HD13 ILE 123 1.933 -3.330 -0.623
No H/Q in entry = 11
In of MODEL 15
1 H TYR 124 H TYR 124 1.765 -8.072 0.695
2 HA TYR 124 HA TYR 124 -0.452 -9.795 1.197
3 HB2 TYR 124 HB2 TYR 124 2.050 -10.041 -0.463
4 HB3 TYR 124 HB3 TYR 124 0.920 -11.376 -0.285
5 HD1 TYR 124 HD1 TYR 124 1.344 -7.968 -1.624
6 HD2 TYR 124 HD2 TYR 124 -1.179 -11.387 -1.431
7 HE1 TYR 124 HE1 TYR 124 -0.014 -7.060 -3.461
8 HE2 TYR 124 HE2 TYR 124 -2.546 -10.489 -3.267
9 HH TYR 124 HH TYR 124 -1.547 -7.831 -5.172
No H/Q in entry = 9
In of MODEL 15
1 H GLY 125 H GLY 125 0.987 -9.296 3.553
2 HA2 GLY 125 HA2 GLY 125 2.168 -10.324 5.294
3 HA3 GLY 125 HA3 GLY 125 3.367 -9.686 4.209
No H/Q in entry = 3
In of MODEL 15
1 H VAL 126 H VAL 126 2.870 -11.936 2.290
2 HA VAL 126 HA VAL 126 4.035 -14.264 3.376
3 HB VAL 126 HB VAL 126 4.966 -14.620 1.067
4 HG11 VAL 126 HG11 VAL 126 2.059 -13.853 1.257
5 HG12 VAL 126 HG12 VAL 126 2.774 -14.790 -0.054
6 HG13 VAL 126 HG13 VAL 126 2.757 -15.437 1.589
7 HG21 VAL 126 HG21 VAL 126 5.377 -12.277 0.490
8 HG22 VAL 126 HG22 VAL 126 4.344 -13.059 -0.707
9 HG23 VAL 126 HG23 VAL 126 3.641 -11.967 0.487
No H/Q in entry = 9
In of MODEL 15
1 H HIS 127 H HIS 127 5.257 -12.305 4.786
2 HA HIS 127 HA HIS 127 7.760 -11.459 3.620
3 HB2 HIS 127 HB2 HIS 127 6.334 -10.050 5.138
4 HB3 HIS 127 HB3 HIS 127 6.732 -11.145 6.449
5 HD1 HIS 127 HD1 HIS 127 8.591 -10.372 7.876
6 HD2 HIS 127 HD2 HIS 127 8.843 -8.834 4.015
7 HE1 HIS 127 HE1 HIS 127 10.542 -8.781 7.897
8 HE2 HIS 127 HE2 HIS 127 10.815 -8.070 5.501
No H/Q in entry = 8
In of MODEL 15
1 H THR 128 H THR 128 9.805 -12.197 4.178
2 HA THR 128 HA THR 128 9.926 -14.891 5.201
3 HB THR 128 HB THR 128 12.384 -13.282 4.630
4 HG1 THR 128 HG1 THR 128 11.914 -13.074 2.566
5 HG21 THR 128 HG21 THR 128 11.550 -16.121 4.008
6 HG22 THR 128 HG22 THR 128 13.128 -15.413 3.652
7 HG23 THR 128 HG23 THR 128 12.608 -15.614 5.326
No H/Q in entry = 7
In of MODEL 15
1 H SER 129 H SER 129 9.021 -13.203 7.187
2 HA SER 129 HA SER 129 10.650 -13.727 9.373
3 HB2 SER 129 HB2 SER 129 12.107 -11.957 8.295
4 HB3 SER 129 HB3 SER 129 10.796 -10.809 8.555
5 HG SER 129 HG SER 129 11.745 -12.320 10.726
No H/Q in entry = 5
In of MODEL 16
1 HA2 GLY -4 HA2 GLY -4 -3.762 18.960 -16.053
2 HA3 GLY -4 HA3 GLY -4 -4.313 18.019 -17.432
3 H1 GLY -4 H1 GLY -4 -6.029 19.139 -15.291
4 H2 GLY -4 H2 GLY -4 -6.572 18.190 -16.579
No H/Q in entry = 4
In of MODEL 16
1 H SER -3 H SER -3 -2.435 17.273 -15.303
2 HA SER -3 HA SER -3 -3.877 15.275 -13.771
3 HB2 SER -3 HB2 SER -3 -1.779 14.475 -15.804
4 HB3 SER -3 HB3 SER -3 -2.593 13.394 -14.674
5 HG SER -3 HG SER -3 -4.498 14.674 -15.935
No H/Q in entry = 5
In of MODEL 16
1 HA PRO -2 HA PRO -2 -0.346 17.193 -11.492
2 HB2 PRO -2 HB2 PRO -2 -2.087 16.391 -9.234
3 HB3 PRO -2 HB3 PRO -2 -1.306 17.942 -9.559
4 HG2 PRO -2 HG2 PRO -2 -3.934 17.645 -9.891
5 HG3 PRO -2 HG3 PRO -2 -2.977 18.626 -11.018
6 HD2 PRO -2 HD2 PRO -2 -4.020 15.837 -11.349
7 HD3 PRO -2 HD3 PRO -2 -3.970 17.168 -12.528
No H/Q in entry = 7
In of MODEL 16
1 H GLU -1 H GLU -1 1.156 15.624 -11.858
2 HA GLU -1 HA GLU -1 2.480 13.817 -11.500
3 HB2 GLU -1 HB2 GLU -1 1.272 13.896 -8.731
4 HB3 GLU -1 HB3 GLU -1 2.748 13.060 -9.186
5 HG2 GLU -1 HG2 GLU -1 3.548 14.968 -8.193
6 HG3 GLU -1 HG3 GLU -1 3.565 15.411 -9.897
No H/Q in entry = 6
In of MODEL 16
1 H PHE 0 H PHE 0 0.411 13.009 -12.908
2 HA PHE 0 HA PHE 0 -0.927 10.815 -11.525
3 HB2 PHE 0 HB2 PHE 0 -2.266 12.342 -12.934
4 HB3 PHE 0 HB3 PHE 0 -1.325 11.854 -14.337
5 HD1 PHE 0 HD1 PHE 0 -3.756 10.700 -11.815
6 HD2 PHE 0 HD2 PHE 0 -1.802 9.847 -15.498
7 HE1 PHE 0 HE1 PHE 0 -5.330 8.852 -12.219
8 HE2 PHE 0 HE2 PHE 0 -3.373 7.999 -15.908
9 HZ PHE 0 HZ PHE 0 -5.140 7.500 -14.266
No H/Q in entry = 9
In of MODEL 16
1 H HIS 1 H HIS 1 -0.023 8.888 -11.512
2 HA HIS 1 HA HIS 1 1.271 7.925 -13.971
3 HB2 HIS 1 HB2 HIS 1 3.000 8.476 -12.300
4 HB3 HIS 1 HB3 HIS 1 2.216 7.418 -11.136
5 HD1 HIS 1 HD1 HIS 1 3.494 5.340 -10.893
6 HD2 HIS 1 HD2 HIS 1 3.555 6.709 -14.813
7 HE1 HIS 1 HE1 HIS 1 4.819 3.642 -12.176
8 HE2 HIS 1 HE2 HIS 1 4.660 4.383 -14.576
No H/Q in entry = 8
In of MODEL 16
1 H HIS 2 H HIS 2 -1.374 7.704 -12.410
2 HA HIS 2 HA HIS 2 -3.050 6.196 -12.189
3 HB2 HIS 2 HB2 HIS 2 -1.986 5.262 -14.337
4 HB3 HIS 2 HB3 HIS 2 -1.247 4.049 -13.300
5 HD1 HIS 2 HD1 HIS 2 -4.537 5.105 -14.742
6 HD2 HIS 2 HD2 HIS 2 -2.979 2.067 -12.368
7 HE1 HIS 2 HE1 HIS 2 -6.336 3.357 -14.614
8 HE2 HIS 2 HE2 HIS 2 -5.341 1.492 -13.252
No H/Q in entry = 8
In of MODEL 16
1 H PHE 3 H PHE 3 -3.773 4.811 -10.573
2 HA PHE 3 HA PHE 3 -3.794 4.091 -8.426
3 HB2 PHE 3 HB2 PHE 3 -1.043 3.020 -9.114
4 HB3 PHE 3 HB3 PHE 3 -1.921 2.636 -7.635
5 HD1 PHE 3 HD1 PHE 3 -4.520 1.941 -8.280
6 HD2 PHE 3 HD2 PHE 3 -1.035 1.327 -10.642
7 HE1 PHE 3 HE1 PHE 3 -5.632 0.070 -9.424
8 HE2 PHE 3 HE2 PHE 3 -2.141 -0.546 -11.793
9 HZ PHE 3 HZ PHE 3 -4.441 -1.175 -11.185
No H/Q in entry = 9
In of MODEL 16
1 H THR 4 H THR 4 -3.464 6.641 -8.490
2 HA THR 4 HA THR 4 -1.045 7.524 -7.189
3 HB THR 4 HB THR 4 -2.277 9.743 -7.136
4 HG1 THR 4 HG1 THR 4 -4.199 9.873 -8.304
5 HG21 THR 4 HG21 THR 4 -0.683 9.188 -8.911
6 HG22 THR 4 HG22 THR 4 -1.966 8.390 -9.820
7 HG23 THR 4 HG23 THR 4 -2.033 10.130 -9.547
No H/Q in entry = 7
In of MODEL 16
1 H LEU 5 H LEU 5 -1.276 8.900 -5.186
2 HA LEU 5 HA LEU 5 -2.496 7.314 -3.169
3 HB2 LEU 5 HB2 LEU 5 -0.993 9.908 -3.133
4 HB3 LEU 5 HB3 LEU 5 -1.758 9.287 -1.685
5 HG LEU 5 HG LEU 5 -0.390 7.171 -2.026
6 HD11 LEU 5 HD11 LEU 5 0.213 7.518 -4.363
7 HD12 LEU 5 HD12 LEU 5 1.121 8.964 -3.922
8 HD13 LEU 5 HD13 LEU 5 1.648 7.382 -3.349
9 HD21 LEU 5 HD21 LEU 5 0.094 8.890 -0.345
10 HD22 LEU 5 HD22 LEU 5 1.557 8.128 -0.962
11 HD23 LEU 5 HD23 LEU 5 1.099 9.736 -1.517
No H/Q in entry = 11
In of MODEL 16
1 H GLU 6 H GLU 6 -3.337 10.376 -4.730
2 HA GLU 6 HA GLU 6 -5.647 10.956 -3.215
3 HB2 GLU 6 HB2 GLU 6 -5.464 11.240 -6.211
4 HB3 GLU 6 HB3 GLU 6 -6.398 12.220 -5.088
5 HG2 GLU 6 HG2 GLU 6 -4.697 13.641 -5.435
6 HG3 GLU 6 HG3 GLU 6 -3.981 12.719 -4.125
No H/Q in entry = 6
In of MODEL 16
1 H SER 7 H SER 7 -5.213 8.848 -6.117
2 HA SER 7 HA SER 7 -7.824 8.025 -6.353
3 HB2 SER 7 HB2 SER 7 -5.978 7.532 -7.955
4 HB3 SER 7 HB3 SER 7 -5.389 6.297 -6.845
5 HG SER 7 HG SER 7 -7.869 6.365 -8.225
No H/Q in entry = 5
In of MODEL 16
1 H SER 8 H SER 8 -5.648 7.216 -3.788
2 HA SER 8 HA SER 8 -7.244 4.874 -3.113
3 HB2 SER 8 HB2 SER 8 -5.459 4.390 -1.434
4 HB3 SER 8 HB3 SER 8 -4.947 4.365 -3.122
5 HG SER 8 HG SER 8 -4.685 6.847 -2.016
No H/Q in entry = 5
In of MODEL 16
1 H LEU 9 H LEU 9 -7.070 8.160 -2.114
2 HA LEU 9 HA LEU 9 -6.829 7.899 0.612
3 HB2 LEU 9 HB2 LEU 9 -8.177 10.042 -0.979
4 HB3 LEU 9 HB3 LEU 9 -7.767 10.173 0.724
5 HG LEU 9 HG LEU 9 -5.740 9.618 -1.422
6 HD11 LEU 9 HD11 LEU 9 -6.530 12.229 -0.172
7 HD12 LEU 9 HD12 LEU 9 -5.152 11.967 -1.243
8 HD13 LEU 9 HD13 LEU 9 -6.789 11.724 -1.845
9 HD21 LEU 9 HD21 LEU 9 -5.480 10.493 1.453
10 HD22 LEU 9 HD22 LEU 9 -5.060 8.908 0.796
11 HD23 LEU 9 HD23 LEU 9 -4.146 10.340 0.310
No H/Q in entry = 11
In of MODEL 16
1 H ASP 10 H ASP 10 -9.782 7.695 -1.190
2 HA ASP 10 HA ASP 10 -11.269 7.349 1.308
3 HB2 ASP 10 HB2 ASP 10 -12.179 7.733 -1.542
4 HB3 ASP 10 HB3 ASP 10 -13.282 7.344 -0.226
No H/Q in entry = 4
In of MODEL 16
1 H THR 11 H THR 11 -9.523 5.454 -0.638
2 HA THR 11 HA THR 11 -11.294 3.163 -0.193
3 HB THR 11 HB THR 11 -10.187 2.097 -2.202
4 HG1 THR 11 HG1 THR 11 -9.612 4.696 -3.110
5 HG21 THR 11 HG21 THR 11 -11.878 4.561 -2.640
6 HG22 THR 11 HG22 THR 11 -11.623 3.278 -3.824
7 HG23 THR 11 HG23 THR 11 -12.466 2.931 -2.313
No H/Q in entry = 7
In of MODEL 16
1 H HIS 12 H HIS 12 -8.164 2.779 -1.590
2 HA HIS 12 HA HIS 12 -7.399 0.839 0.235
3 HB2 HIS 12 HB2 HIS 12 -5.462 2.472 -1.401
4 HB3 HIS 12 HB3 HIS 12 -5.220 0.842 -0.794
5 HD1 HIS 12 HD1 HIS 12 -5.322 2.055 -3.872
6 HD2 HIS 12 HD2 HIS 12 -8.008 -0.472 -1.957
7 HE1 HIS 12 HE1 HIS 12 -6.523 0.829 -5.704
8 HE2 HIS 12 HE2 HIS 12 -8.081 -0.766 -4.531
No H/Q in entry = 8
In of MODEL 16
1 H LEU 13 H LEU 13 -6.750 4.305 0.289
2 HA LEU 13 HA LEU 13 -4.984 3.855 2.606
3 HB2 LEU 13 HB2 LEU 13 -4.876 5.773 0.360
4 HB3 LEU 13 HB3 LEU 13 -4.328 6.329 1.926
5 HG LEU 13 HG LEU 13 -2.415 5.556 0.718
6 HD11 LEU 13 HD11 LEU 13 -2.597 4.967 3.140
7 HD12 LEU 13 HD12 LEU 13 -3.114 3.357 2.646
8 HD13 LEU 13 HD13 LEU 13 -1.513 3.939 2.205
9 HD21 LEU 13 HD21 LEU 13 -3.907 2.970 0.312
10 HD22 LEU 13 HD22 LEU 13 -3.483 4.149 -0.931
11 HD23 LEU 13 HD23 LEU 13 -2.215 3.248 -0.101
No H/Q in entry = 11
In of MODEL 16
1 H LYS 14 H LYS 14 -7.905 4.133 2.588
2 HA LYS 14 HA LYS 14 -8.551 6.747 3.538
3 HB2 LYS 14 HB2 LYS 14 -10.777 5.947 3.852
4 HB3 LYS 14 HB3 LYS 14 -10.169 5.304 2.343
5 HG2 LYS 14 HG2 LYS 14 -9.767 3.149 3.424
6 HG3 LYS 14 HG3 LYS 14 -10.386 3.803 4.946
7 HD2 LYS 14 HD2 LYS 14 -12.549 4.228 3.885
8 HD3 LYS 14 HD3 LYS 14 -11.933 3.587 2.362
9 HE2 LYS 14 HE2 LYS 14 -13.220 1.875 3.399
10 HE3 LYS 14 HE3 LYS 14 -11.523 1.420 3.534
11 HZ1 LYS 14 HZ1 LYS 14 -11.543 2.269 5.819
12 HZ2 LYS 14 HZ2 LYS 14 -13.189 2.625 5.674
13 HZ3 LYS 14 HZ3 LYS 14 -12.666 1.025 5.603
No H/Q in entry = 13
In of MODEL 16
1 H TRP 15 H TRP 15 -7.184 4.063 5.012
2 HA TRP 15 HA TRP 15 -8.172 4.519 7.670
3 HB2 TRP 15 HB2 TRP 15 -6.365 2.936 8.333
4 HB3 TRP 15 HB3 TRP 15 -7.422 2.294 7.078
5 HD1 TRP 15 HD1 TRP 15 -6.402 2.140 4.588
6 HE1 TRP 15 HE1 TRP 15 -3.975 1.926 3.766
7 HE3 TRP 15 HE3 TRP 15 -3.980 3.607 8.841
8 HZ2 TRP 15 HZ2 TRP 15 -1.372 2.320 4.791
9 HZ3 TRP 15 HZ3 TRP 15 -1.518 3.659 8.839
10 HH2 TRP 15 HH2 TRP 15 -0.245 3.029 6.854
No H/Q in entry = 10
In of MODEL 16
1 H LEU 16 H LEU 16 -6.008 6.121 5.670
2 HA LEU 16 HA LEU 16 -4.209 7.093 7.692
3 HB2 LEU 16 HB2 LEU 16 -4.881 8.210 4.963
4 HB3 LEU 16 HB3 LEU 16 -3.583 8.779 5.989
5 HG LEU 16 HG LEU 16 -3.726 6.006 4.800
6 HD11 LEU 16 HD11 LEU 16 -2.134 8.421 3.955
7 HD12 LEU 16 HD12 LEU 16 -1.984 6.799 3.278
8 HD13 LEU 16 HD13 LEU 16 -3.483 7.704 3.073
9 HD21 LEU 16 HD21 LEU 16 -1.514 7.466 6.245
10 HD22 LEU 16 HD22 LEU 16 -2.411 6.069 6.841
11 HD23 LEU 16 HD23 LEU 16 -1.350 5.903 5.439
No H/Q in entry = 11
In of MODEL 16
1 H SER 17 H SER 17 -4.245 9.100 8.630
2 HA SER 17 HA SER 17 -6.879 10.253 8.985
3 HB2 SER 17 HB2 SER 17 -4.240 11.092 10.198
4 HB3 SER 17 HB3 SER 17 -5.845 11.587 10.735
5 HG SER 17 HG SER 17 -5.902 8.977 10.701
No H/Q in entry = 5
In of MODEL 16
1 H GLN 18 H GLN 18 -7.179 12.666 8.796
2 HA GLN 18 HA GLN 18 -6.669 13.440 6.168
3 HB2 GLN 18 HB2 GLN 18 -8.498 14.396 7.495
4 HB3 GLN 18 HB3 GLN 18 -7.336 15.203 8.536
5 HG2 GLN 18 HG2 GLN 18 -8.298 16.762 6.963
6 HG3 GLN 18 HG3 GLN 18 -6.576 16.553 6.652
7 HE21 GLN 18 HE21 GLN 18 -5.915 15.516 4.781
8 HE22 GLN 18 HE22 GLN 18 -6.986 15.233 3.451
No H/Q in entry = 8
In of MODEL 16
1 H GLU 19 H GLU 19 -5.024 14.416 9.149
2 HA GLU 19 HA GLU 19 -3.199 16.185 8.068
3 HB2 GLU 19 HB2 GLU 19 -1.874 15.619 10.086
4 HB3 GLU 19 HB3 GLU 19 -3.546 15.963 10.447
5 HG2 GLU 19 HG2 GLU 19 -3.972 13.527 10.518
6 HG3 GLU 19 HG3 GLU 19 -2.246 13.256 10.292
No H/Q in entry = 6
In of MODEL 16
1 H GLN 20 H GLN 20 -3.100 12.651 8.226
2 HA GLN 20 HA GLN 20 -0.420 12.470 7.242
3 HB2 GLN 20 HB2 GLN 20 -2.611 10.378 7.291
4 HB3 GLN 20 HB3 GLN 20 -0.910 10.066 6.968
5 HG2 GLN 20 HG2 GLN 20 -0.324 10.762 9.205
6 HG3 GLN 20 HG3 GLN 20 -2.003 11.186 9.539
7 HE21 GLN 20 HE21 GLN 20 -0.272 9.299 10.906
8 HE22 GLN 20 HE22 GLN 20 -1.054 7.761 10.815
No H/Q in entry = 8
In of MODEL 16
1 H LYS 21 H LYS 21 -3.658 12.195 5.801
2 HA LYS 21 HA LYS 21 -2.863 11.596 3.180
3 HB2 LYS 21 HB2 LYS 21 -5.218 13.260 4.098
4 HB3 LYS 21 HB3 LYS 21 -5.022 12.588 2.488
5 HG2 LYS 21 HG2 LYS 21 -5.092 10.328 3.432
6 HG3 LYS 21 HG3 LYS 21 -5.321 11.020 5.040
7 HD2 LYS 21 HD2 LYS 21 -7.398 12.064 4.310
8 HD3 LYS 21 HD3 LYS 21 -7.162 11.421 2.685
9 HE2 LYS 21 HE2 LYS 21 -7.338 9.156 3.523
10 HE3 LYS 21 HE3 LYS 21 -7.474 9.754 5.178
11 HZ1 LYS 21 HZ1 LYS 21 -9.528 10.893 4.517
12 HZ2 LYS 21 HZ2 LYS 21 -9.412 10.203 2.976
13 HZ3 LYS 21 HZ3 LYS 21 -9.638 9.216 4.326
No H/Q in entry = 13
In of MODEL 16
1 H ASP 22 H ASP 22 -3.478 14.701 4.736
2 HA ASP 22 HA ASP 22 -2.758 16.353 2.568
3 HB2 ASP 22 HB2 ASP 22 -4.068 17.115 4.530
4 HB3 ASP 22 HB3 ASP 22 -2.637 16.941 5.534
No H/Q in entry = 4
In of MODEL 16
1 H GLU 23 H GLU 23 -0.829 14.938 5.219
2 HA GLU 23 HA GLU 23 1.606 16.160 4.574
3 HB2 GLU 23 HB2 GLU 23 0.754 14.229 6.375
4 HB3 GLU 23 HB3 GLU 23 1.886 13.369 5.331
5 HG2 GLU 23 HG2 GLU 23 3.489 15.211 5.679
6 HG3 GLU 23 HG3 GLU 23 2.375 15.882 6.864
No H/Q in entry = 6
In of MODEL 16
1 H LEU 24 H LEU 24 0.319 13.027 3.436
2 HA LEU 24 HA LEU 24 2.474 12.502 1.718
3 HB2 LEU 24 HB2 LEU 24 -0.277 11.428 2.122
4 HB3 LEU 24 HB3 LEU 24 0.627 10.935 0.703
5 HG LEU 24 HG LEU 24 2.347 9.976 2.050
6 HD11 LEU 24 HD11 LEU 24 2.178 11.718 3.870
7 HD12 LEU 24 HD12 LEU 24 0.920 10.688 4.562
8 HD13 LEU 24 HD13 LEU 24 2.560 10.064 4.341
9 HD21 LEU 24 HD21 LEU 24 -0.369 9.208 3.059
10 HD22 LEU 24 HD22 LEU 24 0.445 8.562 1.635
11 HD23 LEU 24 HD23 LEU 24 1.090 8.237 3.243
No H/Q in entry = 11
In of MODEL 16
1 H LEU 25 H LEU 25 -0.683 14.043 1.166
2 HA LEU 25 HA LEU 25 -0.425 14.320 -1.622
3 HB2 LEU 25 HB2 LEU 25 -1.900 15.988 0.408
4 HB3 LEU 25 HB3 LEU 25 -2.020 16.248 -1.317
5 HG LEU 25 HG LEU 25 -2.855 13.749 0.154
6 HD11 LEU 25 HD11 LEU 25 -4.355 15.634 0.535
7 HD12 LEU 25 HD12 LEU 25 -4.489 15.889 -1.205
8 HD13 LEU 25 HD13 LEU 25 -5.117 14.409 -0.479
9 HD21 LEU 25 HD21 LEU 25 -2.976 14.461 -2.773
10 HD22 LEU 25 HD22 LEU 25 -2.034 13.168 -2.032
11 HD23 LEU 25 HD23 LEU 25 -3.793 13.085 -2.040
No H/Q in entry = 11
In of MODEL 16
1 H LYS 26 H LYS 26 0.681 16.269 1.070
2 HA LYS 26 HA LYS 26 1.694 18.474 -0.395
3 HB2 LYS 26 HB2 LYS 26 1.384 17.958 2.233
4 HB3 LYS 26 HB3 LYS 26 3.093 17.591 2.071
5 HG2 LYS 26 HG2 LYS 26 3.069 19.822 2.696
6 HG3 LYS 26 HG3 LYS 26 3.282 19.887 0.945
7 HD2 LYS 26 HD2 LYS 26 1.638 21.520 1.572
8 HD3 LYS 26 HD3 LYS 26 0.822 20.209 0.721
9 HE2 LYS 26 HE2 LYS 26 0.199 19.236 2.916
10 HE3 LYS 26 HE3 LYS 26 0.932 20.628 3.707
11 HZ1 LYS 26 HZ1 LYS 26 -1.318 20.772 1.776
12 HZ2 LYS 26 HZ2 LYS 26 -1.487 20.815 3.460
13 HZ3 LYS 26 HZ3 LYS 26 -0.663 22.059 2.659
No H/Q in entry = 13
In of MODEL 16
1 H MET 27 H MET 27 3.187 15.547 0.893
2 HA MET 27 HA MET 27 5.721 15.866 -0.089
3 HB2 MET 27 HB2 MET 27 4.110 13.347 0.318
4 HB3 MET 27 HB3 MET 27 5.827 13.336 -0.052
5 HG2 MET 27 HG2 MET 27 5.084 15.044 2.204
6 HG3 MET 27 HG3 MET 27 4.764 13.331 2.446
7 HE1 MET 27 HE1 MET 27 6.569 11.455 2.298
8 HE2 MET 27 HE2 MET 27 7.094 11.979 0.699
9 HE3 MET 27 HE3 MET 27 8.280 11.732 1.981
No H/Q in entry = 9
In of MODEL 16
1 H LYS 28 H LYS 28 3.052 14.077 -1.652
2 HA LYS 28 HA LYS 28 4.409 13.342 -3.978
3 HB2 LYS 28 HB2 LYS 28 2.226 12.482 -3.002
4 HB3 LYS 28 HB3 LYS 28 1.457 13.889 -3.706
5 HG2 LYS 28 HG2 LYS 28 3.067 12.101 -5.459
6 HG3 LYS 28 HG3 LYS 28 1.465 11.583 -4.942
7 HD2 LYS 28 HD2 LYS 28 2.095 14.168 -6.364
8 HD3 LYS 28 HD3 LYS 28 1.423 12.722 -7.118
9 HE2 LYS 28 HE2 LYS 28 -0.530 12.890 -5.611
10 HE3 LYS 28 HE3 LYS 28 0.133 14.383 -4.956
11 HZ1 LYS 28 HZ1 LYS 28 0.089 15.250 -7.292
12 HZ2 LYS 28 HZ2 LYS 28 -0.825 13.888 -7.711
13 HZ3 LYS 28 HZ3 LYS 28 -1.428 14.994 -6.584
No H/Q in entry = 13
In of MODEL 16
1 H LYS 29 H LYS 29 2.423 16.195 -3.256
2 HA LYS 29 HA LYS 29 2.563 17.338 -5.815
3 HB2 LYS 29 HB2 LYS 29 0.919 18.006 -4.118
4 HB3 LYS 29 HB3 LYS 29 2.201 18.740 -3.166
5 HG2 LYS 29 HG2 LYS 29 2.572 20.418 -4.809
6 HG3 LYS 29 HG3 LYS 29 1.531 19.596 -5.970
7 HD2 LYS 29 HD2 LYS 29 0.346 21.475 -5.022
8 HD3 LYS 29 HD3 LYS 29 -0.392 19.975 -4.462
9 HE2 LYS 29 HE2 LYS 29 0.883 20.180 -2.354
10 HE3 LYS 29 HE3 LYS 29 1.521 21.723 -2.919
11 HZ1 LYS 29 HZ1 LYS 29 -0.761 22.559 -3.026
12 HZ2 LYS 29 HZ2 LYS 29 -1.337 21.088 -2.429
13 HZ3 LYS 29 HZ3 LYS 29 -0.355 22.067 -1.460
No H/Q in entry = 13
In of MODEL 16
1 H ASP 30 H ASP 30 4.681 17.795 -2.999
2 HA ASP 30 HA ASP 30 6.147 19.882 -4.322
3 HB2 ASP 30 HB2 ASP 30 6.373 18.522 -1.673
4 HB3 ASP 30 HB3 ASP 30 7.744 19.448 -2.277
No H/Q in entry = 4
In of MODEL 16
1 H GLY 31 H GLY 31 6.110 16.720 -4.915
2 HA2 GLY 31 HA2 GLY 31 8.637 17.025 -6.321
3 HA3 GLY 31 HA3 GLY 31 7.396 15.826 -6.653
No H/Q in entry = 3
In of MODEL 16
1 H LYS 32 H LYS 32 7.373 15.242 -3.656
2 HA LYS 32 HA LYS 32 9.812 13.883 -3.183
3 HB2 LYS 32 HB2 LYS 32 7.047 13.334 -2.086
4 HB3 LYS 32 HB3 LYS 32 8.535 12.621 -1.481
5 HG2 LYS 32 HG2 LYS 32 7.862 15.555 -1.459
6 HG3 LYS 32 HG3 LYS 32 7.773 14.461 -0.077
7 HD2 LYS 32 HD2 LYS 32 10.185 14.058 -0.248
8 HD3 LYS 32 HD3 LYS 32 10.267 15.160 -1.625
9 HE2 LYS 32 HE2 LYS 32 10.971 16.284 0.409
10 HE3 LYS 32 HE3 LYS 32 9.476 16.991 -0.204
11 HZ1 LYS 32 HZ1 LYS 32 9.623 14.984 1.979
12 HZ2 LYS 32 HZ2 LYS 32 9.477 16.650 2.214
13 HZ3 LYS 32 HZ3 LYS 32 8.236 15.796 1.447
No H/Q in entry = 13
In of MODEL 16
1 H ALA 33 H ALA 33 10.339 11.796 -3.601
2 HA ALA 33 HA ALA 33 9.304 10.709 -6.031
3 HB1 ALA 33 HB1 ALA 33 11.682 10.521 -5.351
4 HB2 ALA 33 HB2 ALA 33 10.952 8.968 -5.756
5 HB3 ALA 33 HB3 ALA 33 11.190 9.413 -4.067
No H/Q in entry = 5
In of MODEL 16
1 H LYS 34 H LYS 34 8.295 8.588 -6.298
2 HA LYS 34 HA LYS 34 6.138 8.153 -4.601
3 HB2 LYS 34 HB2 LYS 34 7.509 6.086 -6.336
4 HB3 LYS 34 HB3 LYS 34 5.895 5.939 -5.663
5 HG2 LYS 34 HG2 LYS 34 6.773 7.998 -7.677
6 HG3 LYS 34 HG3 LYS 34 5.863 6.533 -8.032
7 HD2 LYS 34 HD2 LYS 34 4.089 7.920 -7.856
8 HD3 LYS 34 HD3 LYS 34 4.290 7.613 -6.131
9 HE2 LYS 34 HE2 LYS 34 4.040 9.994 -6.539
10 HE3 LYS 34 HE3 LYS 34 5.665 9.645 -5.947
11 HZ1 LYS 34 HZ1 LYS 34 4.937 10.051 -8.798
12 HZ2 LYS 34 HZ2 LYS 34 5.671 11.210 -7.808
13 HZ3 LYS 34 HZ3 LYS 34 6.494 9.787 -8.199
No H/Q in entry = 13
In of MODEL 16
1 H LYS 35 H LYS 35 9.374 6.752 -4.515
2 HA LYS 35 HA LYS 35 8.876 4.842 -2.519
3 HB2 LYS 35 HB2 LYS 35 11.296 6.120 -3.641
4 HB3 LYS 35 HB3 LYS 35 11.463 5.355 -2.066
5 HG2 LYS 35 HG2 LYS 35 12.061 3.744 -3.685
6 HG3 LYS 35 HG3 LYS 35 10.472 3.286 -3.071
7 HD2 LYS 35 HD2 LYS 35 9.547 4.590 -5.081
8 HD3 LYS 35 HD3 LYS 35 11.193 4.502 -5.715
9 HE2 LYS 35 HE2 LYS 35 10.063 2.652 -6.629
10 HE3 LYS 35 HE3 LYS 35 11.058 2.005 -5.324
11 HZ1 LYS 35 HZ1 LYS 35 9.054 2.100 -3.885
12 HZ2 LYS 35 HZ2 LYS 35 8.142 2.554 -5.246
13 HZ3 LYS 35 HZ3 LYS 35 8.896 1.040 -5.190
No H/Q in entry = 13
In of MODEL 16
1 H GLU 36 H GLU 36 8.988 8.267 -2.216
2 HA GLU 36 HA GLU 36 9.797 8.181 0.574
3 HB2 GLU 36 HB2 GLU 36 8.884 10.544 -1.073
4 HB3 GLU 36 HB3 GLU 36 9.678 10.599 0.497
5 HG2 GLU 36 HG2 GLU 36 11.638 9.467 -0.565
6 HG3 GLU 36 HG3 GLU 36 10.844 9.694 -2.109
No H/Q in entry = 6
In of MODEL 16
1 H LEU 37 H LEU 37 7.004 8.570 -1.446
2 HA LEU 37 HA LEU 37 5.120 8.928 0.642
3 HB2 LEU 37 HB2 LEU 37 4.925 7.910 -2.187
4 HB3 LEU 37 HB3 LEU 37 3.528 8.111 -1.152
5 HG LEU 37 HG LEU 37 3.782 9.957 -2.692
6 HD11 LEU 37 HD11 LEU 37 2.760 10.341 -0.502
7 HD12 LEU 37 HD12 LEU 37 4.341 10.791 0.134
8 HD13 LEU 37 HD13 LEU 37 3.576 11.780 -1.110
9 HD21 LEU 37 HD21 LEU 37 6.170 9.995 -3.001
10 HD22 LEU 37 HD22 LEU 37 5.578 11.580 -2.503
11 HD23 LEU 37 HD23 LEU 37 6.384 10.534 -1.335
No H/Q in entry = 11
In of MODEL 16
1 H GLU 38 H GLU 38 6.355 6.182 -1.145
2 HA GLU 38 HA GLU 38 4.954 4.057 -0.050
3 HB2 GLU 38 HB2 GLU 38 6.469 3.803 -1.919
4 HB3 GLU 38 HB3 GLU 38 7.833 4.308 -0.937
5 HG2 GLU 38 HG2 GLU 38 7.284 2.231 0.484
6 HG3 GLU 38 HG3 GLU 38 6.359 1.713 -0.926
No H/Q in entry = 6
In of MODEL 16
1 H ALA 39 H ALA 39 7.293 6.119 1.362
2 HA ALA 39 HA ALA 39 8.088 4.222 3.408
3 HB1 ALA 39 HB1 ALA 39 8.985 7.060 2.959
4 HB2 ALA 39 HB2 ALA 39 9.713 5.882 4.052
5 HB3 ALA 39 HB3 ALA 39 9.766 5.619 2.309
No H/Q in entry = 5
In of MODEL 16
1 H LYS 40 H LYS 40 6.363 7.321 3.236
2 HA LYS 40 HA LYS 40 5.862 7.629 5.955
3 HB2 LYS 40 HB2 LYS 40 4.306 8.387 3.491
4 HB3 LYS 40 HB3 LYS 40 3.786 8.822 5.107
5 HG2 LYS 40 HG2 LYS 40 6.462 9.572 3.988
6 HG3 LYS 40 HG3 LYS 40 5.033 10.598 3.862
7 HD2 LYS 40 HD2 LYS 40 4.849 10.620 6.307
8 HD3 LYS 40 HD3 LYS 40 6.295 9.618 6.422
9 HE2 LYS 40 HE2 LYS 40 7.634 11.356 5.432
10 HE3 LYS 40 HE3 LYS 40 6.200 12.339 5.132
11 HZ1 LYS 40 HZ1 LYS 40 7.127 11.529 7.831
12 HZ2 LYS 40 HZ2 LYS 40 7.477 13.019 7.116
13 HZ3 LYS 40 HZ3 LYS 40 5.874 12.609 7.465
No H/Q in entry = 13
In of MODEL 16
1 H ILE 41 H ILE 41 3.897 6.068 3.431
2 HA ILE 41 HA ILE 41 1.800 5.257 5.068
3 HB ILE 41 HB ILE 41 2.827 4.053 2.501
4 HG12 ILE 41 HG12 ILE 41 0.577 5.999 3.040
5 HG13 ILE 41 HG13 ILE 41 2.173 6.449 2.450
6 HG21 ILE 41 HG21 ILE 41 0.172 3.671 3.873
7 HG22 ILE 41 HG22 ILE 41 0.589 3.083 2.263
8 HG23 ILE 41 HG23 ILE 41 1.427 2.450 3.681
9 HD11 ILE 41 HD11 ILE 41 1.796 5.142 0.438
10 HD12 ILE 41 HD12 ILE 41 0.195 4.694 1.031
11 HD13 ILE 41 HD13 ILE 41 0.557 6.379 0.660
No H/Q in entry = 11
In of MODEL 16
1 H LEU 42 H LEU 42 4.779 3.535 4.177
2 HA LEU 42 HA LEU 42 4.066 1.110 5.453
3 HB2 LEU 42 HB2 LEU 42 6.737 2.251 4.681
4 HB3 LEU 42 HB3 LEU 42 6.548 0.659 5.378
5 HG LEU 42 HG LEU 42 5.565 1.628 2.705
6 HD11 LEU 42 HD11 LEU 42 7.437 -0.581 3.526
7 HD12 LEU 42 HD12 LEU 42 6.947 -0.211 1.873
8 HD13 LEU 42 HD13 LEU 42 7.891 0.959 2.794
9 HD21 LEU 42 HD21 LEU 42 4.854 -0.879 4.211
10 HD22 LEU 42 HD22 LEU 42 3.765 0.309 3.489
11 HD23 LEU 42 HD23 LEU 42 4.728 -0.752 2.457
No H/Q in entry = 11
In of MODEL 16
1 H HIS 43 H HIS 43 5.782 3.982 6.535
2 HA HIS 43 HA HIS 43 6.452 3.040 9.120
3 HB2 HIS 43 HB2 HIS 43 7.378 5.112 8.023
4 HB3 HIS 43 HB3 HIS 43 5.829 5.894 8.320
5 HD1 HIS 43 HD1 HIS 43 5.637 7.108 10.486
6 HD2 HIS 43 HD2 HIS 43 8.671 4.267 10.533
7 HE1 HIS 43 HE1 HIS 43 6.796 7.392 12.697
8 HE2 HIS 43 HE2 HIS 43 8.581 5.620 12.735
No H/Q in entry = 8
In of MODEL 16
1 H TYR 44 H TYR 44 3.654 4.892 7.896
2 HA TYR 44 HA TYR 44 2.223 5.081 10.307
3 HB2 TYR 44 HB2 TYR 44 1.161 4.913 7.474
4 HB3 TYR 44 HB3 TYR 44 0.228 5.424 8.873
5 HD1 TYR 44 HD1 TYR 44 2.430 7.043 10.195
6 HD2 TYR 44 HD2 TYR 44 1.014 6.906 6.192
7 HE1 TYR 44 HE1 TYR 44 3.191 9.335 9.856
8 HE2 TYR 44 HE2 TYR 44 1.784 9.214 5.829
9 HH TYR 44 HH TYR 44 2.273 11.221 7.200
No H/Q in entry = 9
In of MODEL 16
1 H TYR 45 H TYR 45 2.496 2.585 7.919
2 HA TYR 45 HA TYR 45 0.329 0.965 8.650
3 HB2 TYR 45 HB2 TYR 45 1.426 0.762 6.503
4 HB3 TYR 45 HB3 TYR 45 2.955 0.372 7.276
5 HD1 TYR 45 HD1 TYR 45 -0.541 -0.910 7.144
6 HD2 TYR 45 HD2 TYR 45 3.607 -1.782 7.321
7 HE1 TYR 45 HE1 TYR 45 -1.049 -3.303 6.963
8 HE2 TYR 45 HE2 TYR 45 3.125 -4.176 7.147
9 HH TYR 45 HH TYR 45 -0.151 -5.358 6.589
No H/Q in entry = 9
In of MODEL 16
1 H ASP 46 H ASP 46 3.746 0.912 9.639
2 HA ASP 46 HA ASP 46 3.399 -1.516 11.114
3 HB2 ASP 46 HB2 ASP 46 5.576 -0.864 10.082
4 HB3 ASP 46 HB3 ASP 46 5.696 0.459 11.232
No H/Q in entry = 4
In of MODEL 16
1 H GLU 47 H GLU 47 2.784 1.775 11.910
2 HA GLU 47 HA GLU 47 3.182 1.298 14.738
3 HB2 GLU 47 HB2 GLU 47 2.497 3.642 15.024
4 HB3 GLU 47 HB3 GLU 47 3.841 3.463 13.911
5 HG2 GLU 47 HG2 GLU 47 2.351 3.748 12.032
6 HG3 GLU 47 HG3 GLU 47 0.967 3.852 13.118
No H/Q in entry = 6
In of MODEL 16
1 H LEU 48 H LEU 48 0.885 0.384 12.658
2 HA LEU 48 HA LEU 48 -1.535 1.279 13.817
3 HB2 LEU 48 HB2 LEU 48 -0.798 -0.944 11.936
4 HB3 LEU 48 HB3 LEU 48 -2.452 -0.651 12.414
5 HG LEU 48 HG LEU 48 -0.703 1.364 11.025
6 HD11 LEU 48 HD11 LEU 48 -1.289 -0.562 9.600
7 HD12 LEU 48 HD12 LEU 48 -2.993 -0.279 9.956
8 HD13 LEU 48 HD13 LEU 48 -2.064 0.931 9.074
9 HD21 LEU 48 HD21 LEU 48 -3.575 1.357 11.912
10 HD22 LEU 48 HD22 LEU 48 -2.298 2.487 12.363
11 HD23 LEU 48 HD23 LEU 48 -2.936 2.492 10.719
No H/Q in entry = 11
In of MODEL 16
1 H GLU 49 H GLU 49 -2.856 -1.260 13.880
2 HA GLU 49 HA GLU 49 -1.959 -2.553 16.263
3 HB2 GLU 49 HB2 GLU 49 -3.907 -1.957 17.631
4 HB3 GLU 49 HB3 GLU 49 -2.923 -0.558 17.245
5 HG2 GLU 49 HG2 GLU 49 -4.850 0.402 16.719
6 HG3 GLU 49 HG3 GLU 49 -4.718 -0.526 15.229
No H/Q in entry = 6
In of MODEL 16
1 H GLY 50 H GLY 50 -4.155 -3.885 17.067
2 HA2 GLY 50 HA2 GLY 50 -5.554 -5.633 16.524
3 HA3 GLY 50 HA3 GLY 50 -4.216 -6.066 15.487
No H/Q in entry = 3
In of MODEL 16
1 H ASP 51 H ASP 51 -7.228 -4.174 15.530
2 HA ASP 51 HA ASP 51 -8.018 -5.359 13.036
3 HB2 ASP 51 HB2 ASP 51 -9.679 -4.799 14.763
4 HB3 ASP 51 HB3 ASP 51 -9.291 -3.092 14.587
No H/Q in entry = 4
In of MODEL 16
1 H ALA 52 H ALA 52 -6.715 -2.208 14.004
2 HA ALA 52 HA ALA 52 -7.332 -0.821 11.625
3 HB1 ALA 52 HB1 ALA 52 -4.874 -0.374 13.319
4 HB2 ALA 52 HB2 ALA 52 -5.685 0.790 12.273
5 HB3 ALA 52 HB3 ALA 52 -6.479 0.221 13.743
No H/Q in entry = 5
In of MODEL 16
1 H LYS 53 H LYS 53 -4.495 -2.740 12.519
2 HA LYS 53 HA LYS 53 -3.116 -2.263 10.073
3 HB2 LYS 53 HB2 LYS 53 -2.114 -3.017 12.285
4 HB3 LYS 53 HB3 LYS 53 -2.639 -4.633 11.816
5 HG2 LYS 53 HG2 LYS 53 -1.262 -4.647 9.914
6 HG3 LYS 53 HG3 LYS 53 -0.972 -2.908 10.018
7 HD2 LYS 53 HD2 LYS 53 0.239 -3.217 12.083
8 HD3 LYS 53 HD3 LYS 53 -0.091 -4.942 12.023
9 HE2 LYS 53 HE2 LYS 53 1.141 -5.050 9.868
10 HE3 LYS 53 HE3 LYS 53 1.542 -3.347 10.058
11 HZ1 LYS 53 HZ1 LYS 53 2.716 -3.907 12.105
12 HZ2 LYS 53 HZ2 LYS 53 2.351 -5.542 11.885
13 HZ3 LYS 53 HZ3 LYS 53 3.353 -4.748 10.783
No H/Q in entry = 13
In of MODEL 16
1 H LYS 54 H LYS 54 -5.048 -4.953 11.342
2 HA LYS 54 HA LYS 54 -4.960 -6.648 9.167
3 HB2 LYS 54 HB2 LYS 54 -6.305 -7.796 10.505
4 HB3 LYS 54 HB3 LYS 54 -6.530 -6.373 11.510
5 HG2 LYS 54 HG2 LYS 54 -8.488 -5.757 10.402
6 HG3 LYS 54 HG3 LYS 54 -8.154 -6.815 9.028
7 HD2 LYS 54 HD2 LYS 54 -8.364 -8.752 10.566
8 HD3 LYS 54 HD3 LYS 54 -8.868 -7.639 11.835
9 HE2 LYS 54 HE2 LYS 54 -10.282 -8.200 9.231
10 HE3 LYS 54 HE3 LYS 54 -10.832 -8.623 10.850
11 HZ1 LYS 54 HZ1 LYS 54 -10.818 -6.133 11.290
12 HZ2 LYS 54 HZ2 LYS 54 -10.670 -5.937 9.609
13 HZ3 LYS 54 HZ3 LYS 54 -12.027 -6.717 10.258
No H/Q in entry = 13
In of MODEL 16
1 H GLU 55 H GLU 55 -7.158 -3.901 9.720
2 HA GLU 55 HA GLU 55 -8.535 -4.157 7.290
3 HB2 GLU 55 HB2 GLU 55 -8.163 -1.940 9.301
4 HB3 GLU 55 HB3 GLU 55 -9.143 -1.706 7.874
5 HG2 GLU 55 HG2 GLU 55 -9.591 -3.748 10.026
6 HG3 GLU 55 HG3 GLU 55 -10.500 -2.264 9.785
No H/Q in entry = 6
In of MODEL 16
1 H ALA 56 H ALA 56 -5.851 -2.023 8.294
2 HA ALA 56 HA ALA 56 -5.698 -0.701 5.856
3 HB1 ALA 56 HB1 ALA 56 -3.438 -0.013 6.520
4 HB2 ALA 56 HB2 ALA 56 -3.419 -1.256 7.771
5 HB3 ALA 56 HB3 ALA 56 -4.547 0.095 7.886
No H/Q in entry = 5
In of MODEL 16
1 H THR 57 H THR 57 -3.804 -3.471 7.019
2 HA THR 57 HA THR 57 -2.249 -3.995 4.828
3 HB THR 57 HB THR 57 -3.641 -6.080 6.522
4 HG1 THR 57 HG1 THR 57 -2.530 -4.892 7.957
5 HG21 THR 57 HG21 THR 57 -2.578 -6.989 4.521
6 HG22 THR 57 HG22 THR 57 -1.064 -6.200 4.959
7 HG23 THR 57 HG23 THR 57 -1.719 -7.482 5.979
No H/Q in entry = 7
In of MODEL 16
1 H GLU 58 H GLU 58 -5.574 -5.048 5.419
2 HA GLU 58 HA GLU 58 -5.835 -6.494 2.962
3 HB2 GLU 58 HB2 GLU 58 -7.749 -5.596 5.081
4 HB3 GLU 58 HB3 GLU 58 -8.344 -6.260 3.556
5 HG2 GLU 58 HG2 GLU 58 -6.685 -8.191 4.066
6 HG3 GLU 58 HG3 GLU 58 -6.762 -7.575 5.716
No H/Q in entry = 6
In of MODEL 16
1 H HIS 59 H HIS 59 -6.142 -3.136 3.762
2 HA HIS 59 HA HIS 59 -7.690 -2.524 1.400
3 HB2 HIS 59 HB2 HIS 59 -6.296 -0.806 3.447
4 HB3 HIS 59 HB3 HIS 59 -7.012 -0.122 1.992
5 HD1 HIS 59 HD1 HIS 59 -9.656 -1.588 1.843
6 HD2 HIS 59 HD2 HIS 59 -8.049 -0.145 5.397
7 HE1 HIS 59 HE1 HIS 59 -11.604 -1.329 3.412
8 HE2 HIS 59 HE2 HIS 59 -10.579 -0.623 5.604
No H/Q in entry = 8
In of MODEL 16
1 H LEU 60 H LEU 60 -4.324 -1.985 2.466
2 HA LEU 60 HA LEU 60 -3.289 -1.236 0.025
3 HB2 LEU 60 HB2 LEU 60 -2.074 -2.710 2.348
4 HB3 LEU 60 HB3 LEU 60 -1.143 -2.245 0.932
5 HG LEU 60 HG LEU 60 -1.678 0.086 1.358
6 HD11 LEU 60 HD11 LEU 60 -3.775 -0.109 2.456
7 HD12 LEU 60 HD12 LEU 60 -2.990 -0.839 3.859
8 HD13 LEU 60 HD13 LEU 60 -2.641 0.837 3.427
9 HD21 LEU 60 HD21 LEU 60 0.386 -0.861 2.249
10 HD22 LEU 60 HD22 LEU 60 -0.245 0.401 3.307
11 HD23 LEU 60 HD23 LEU 60 -0.463 -1.299 3.732
No H/Q in entry = 11
In of MODEL 16
1 H LYS 61 H LYS 61 -4.057 -4.458 1.302
2 HA LYS 61 HA LYS 61 -2.843 -6.002 -0.694
3 HB2 LYS 61 HB2 LYS 61 -5.179 -6.439 1.129
4 HB3 LYS 61 HB3 LYS 61 -4.892 -7.575 -0.176
5 HG2 LYS 61 HG2 LYS 61 -2.694 -8.084 0.702
6 HG3 LYS 61 HG3 LYS 61 -2.896 -6.873 1.970
7 HD2 LYS 61 HD2 LYS 61 -4.745 -8.134 2.918
8 HD3 LYS 61 HD3 LYS 61 -4.646 -9.310 1.607
9 HE2 LYS 61 HE2 LYS 61 -2.470 -10.024 2.351
10 HE3 LYS 61 HE3 LYS 61 -2.426 -8.755 3.571
11 HZ1 LYS 61 HZ1 LYS 61 -4.368 -11.008 3.517
12 HZ2 LYS 61 HZ2 LYS 61 -3.007 -10.914 4.514
13 HZ3 LYS 61 HZ3 LYS 61 -4.270 -9.806 4.706
No H/Q in entry = 13
In of MODEL 16
1 H GLY 62 H GLY 62 -6.240 -4.912 -0.470
2 HA2 GLY 62 HA2 GLY 62 -7.707 -4.252 -2.102
3 HA3 GLY 62 HA3 GLY 62 -7.062 -5.597 -3.032
No H/Q in entry = 3
In of MODEL 16
1 H GLY 63 H GLY 63 -5.401 -2.663 -1.934
2 HA2 GLY 63 HA2 GLY 63 -4.037 -1.228 -3.097
3 HA3 GLY 63 HA3 GLY 63 -5.300 -1.257 -4.322
No H/Q in entry = 3
In of MODEL 16
1 H CYS 64 H CYS 64 -2.862 -3.551 -3.117
2 HA CYS 64 HA CYS 64 -1.379 -3.642 -5.504
3 HB2 CYS 64 HB2 CYS 64 -1.606 -5.639 -3.255
4 HB3 CYS 64 HB3 CYS 64 -0.423 -5.743 -4.557
No H/Q in entry = 4
In of MODEL 16
1 H ARG 65 H ARG 65 -4.198 -5.400 -4.426
2 HA ARG 65 HA ARG 65 -4.248 -7.477 -6.292
3 HB2 ARG 65 HB2 ARG 65 -5.807 -7.378 -4.422
4 HB3 ARG 65 HB3 ARG 65 -6.533 -5.915 -5.069
5 HG2 ARG 65 HG2 ARG 65 -7.189 -7.271 -7.087
6 HG3 ARG 65 HG3 ARG 65 -6.691 -8.700 -6.179
7 HD2 ARG 65 HD2 ARG 65 -8.797 -6.709 -5.347
8 HD3 ARG 65 HD3 ARG 65 -9.093 -8.320 -5.988
9 HE ARG 65 HE ARG 65 -7.836 -7.746 -3.382
10 HH11 ARG 65 HH11 ARG 65 -9.673 -9.840 -5.504
11 HH12 ARG 65 HH12 ARG 65 -10.018 -11.004 -4.264
12 HH21 ARG 65 HH21 ARG 65 -8.290 -9.272 -1.751
13 HH22 ARG 65 HH22 ARG 65 -9.227 -10.682 -2.132
No H/Q in entry = 13
In of MODEL 16
1 H GLU 66 H GLU 66 -5.587 -4.212 -6.463
2 HA GLU 66 HA GLU 66 -6.518 -4.459 -9.135
3 HB2 GLU 66 HB2 GLU 66 -5.990 -2.044 -7.394
4 HB3 GLU 66 HB3 GLU 66 -6.764 -1.971 -8.973
5 HG2 GLU 66 HG2 GLU 66 -8.630 -3.214 -8.224
6 HG3 GLU 66 HG3 GLU 66 -7.815 -3.676 -6.734
No H/Q in entry = 6
In of MODEL 16
1 H ILE 67 H ILE 67 -3.475 -3.586 -7.687
2 HA ILE 67 HA ILE 67 -2.291 -2.498 -10.044
3 HB ILE 67 HB ILE 67 -1.030 -3.688 -7.573
4 HG12 ILE 67 HG12 ILE 67 -1.306 -0.824 -8.507
5 HG13 ILE 67 HG13 ILE 67 -2.331 -1.590 -7.300
6 HG21 ILE 67 HG21 ILE 67 0.505 -3.932 -9.458
7 HG22 ILE 67 HG22 ILE 67 0.301 -2.225 -9.857
8 HG23 ILE 67 HG23 ILE 67 1.079 -2.689 -8.345
9 HD11 ILE 67 HD11 ILE 67 0.635 -1.169 -7.063
10 HD12 ILE 67 HD12 ILE 67 -0.614 -0.188 -6.296
11 HD13 ILE 67 HD13 ILE 67 -0.419 -1.881 -5.841
No H/Q in entry = 11
In of MODEL 16
1 H LEU 68 H LEU 68 -2.125 -5.713 -8.497
2 HA LEU 68 HA LEU 68 -0.667 -6.958 -10.565
3 HB2 LEU 68 HB2 LEU 68 -2.406 -7.907 -8.340
4 HB3 LEU 68 HB3 LEU 68 -2.075 -9.036 -9.638
5 HG LEU 68 HG LEU 68 -0.522 -9.401 -7.825
6 HD11 LEU 68 HD11 LEU 68 0.251 -9.677 -10.149
7 HD12 LEU 68 HD12 LEU 68 0.890 -8.034 -10.107
8 HD13 LEU 68 HD13 LEU 68 1.553 -9.265 -9.034
9 HD21 LEU 68 HD21 LEU 68 -0.572 -7.180 -6.812
10 HD22 LEU 68 HD22 LEU 68 1.085 -7.698 -7.130
11 HD23 LEU 68 HD23 LEU 68 0.309 -6.525 -8.192
No H/Q in entry = 11
In of MODEL 16
1 H LYS 69 H LYS 69 -4.038 -6.217 -10.151
2 HA LYS 69 HA LYS 69 -4.980 -7.686 -12.341
3 HB2 LYS 69 HB2 LYS 69 -6.364 -6.568 -10.512
4 HB3 LYS 69 HB3 LYS 69 -6.169 -5.073 -11.418
5 HG2 LYS 69 HG2 LYS 69 -7.270 -6.052 -13.336
6 HG3 LYS 69 HG3 LYS 69 -7.392 -7.598 -12.496
7 HD2 LYS 69 HD2 LYS 69 -8.843 -6.587 -10.818
8 HD3 LYS 69 HD3 LYS 69 -8.692 -5.020 -11.619
9 HE2 LYS 69 HE2 LYS 69 -9.701 -6.000 -13.649
10 HE3 LYS 69 HE3 LYS 69 -9.920 -7.518 -12.783
11 HZ1 LYS 69 HZ1 LYS 69 -11.123 -4.926 -11.979
12 HZ2 LYS 69 HZ2 LYS 69 -11.932 -6.136 -12.835
13 HZ3 LYS 69 HZ3 LYS 69 -11.404 -6.429 -11.255
No H/Q in entry = 13
In of MODEL 16
1 H HIS 70 H HIS 70 -2.902 -5.084 -12.239
2 HA HIS 70 HA HIS 70 -3.547 -4.211 -14.961
3 HB2 HIS 70 HB2 HIS 70 -3.382 -2.370 -13.340
4 HB3 HIS 70 HB3 HIS 70 -1.774 -2.910 -12.875
5 HD1 HIS 70 HD1 HIS 70 -3.514 -0.723 -15.209
6 HD2 HIS 70 HD2 HIS 70 0.183 -2.620 -15.037
7 HE1 HIS 70 HE1 HIS 70 -2.070 0.471 -16.875
8 HE2 HIS 70 HE2 HIS 70 0.079 -0.836 -16.916
No H/Q in entry = 8
In of MODEL 16
1 H VAL 71 H VAL 71 -0.817 -4.976 -12.837
2 HA VAL 71 HA VAL 71 1.077 -5.023 -14.921
3 HB VAL 71 HB VAL 71 1.740 -4.327 -12.741
4 HG11 VAL 71 HG11 VAL 71 0.966 -7.031 -11.790
5 HG12 VAL 71 HG12 VAL 71 1.869 -5.838 -10.850
6 HG13 VAL 71 HG13 VAL 71 0.222 -5.480 -11.382
7 HG21 VAL 71 HG21 VAL 71 2.966 -6.880 -13.633
8 HG22 VAL 71 HG22 VAL 71 3.558 -5.232 -13.837
9 HG23 VAL 71 HG23 VAL 71 3.580 -5.983 -12.243
No H/Q in entry = 9
In of MODEL 16
1 H VAL 72 H VAL 72 -0.426 -7.613 -13.008
2 HA VAL 72 HA VAL 72 0.839 -9.553 -14.784
3 HB VAL 72 HB VAL 72 0.562 -9.651 -12.128
4 HG11 VAL 72 HG11 VAL 72 -1.901 -10.993 -13.160
5 HG12 VAL 72 HG12 VAL 72 -1.164 -11.407 -11.613
6 HG13 VAL 72 HG13 VAL 72 -1.760 -9.770 -11.898
7 HG21 VAL 72 HG21 VAL 72 0.621 -11.911 -14.069
8 HG22 VAL 72 HG22 VAL 72 1.978 -11.096 -13.294
9 HG23 VAL 72 HG23 VAL 72 0.895 -12.108 -12.337
No H/Q in entry = 9
In of MODEL 16
1 H GLY 73 H GLY 73 -1.977 -7.820 -14.461
2 HA2 GLY 73 HA2 GLY 73 -3.242 -9.269 -16.601
3 HA3 GLY 73 HA3 GLY 73 -3.806 -7.774 -15.869
No H/Q in entry = 3
In of MODEL 16
1 H GLU 74 H GLU 74 -5.912 -8.833 -16.032
2 HA GLU 74 HA GLU 74 -6.802 -9.951 -13.618
3 HB2 GLU 74 HB2 GLU 74 -8.239 -8.774 -15.273
4 HB3 GLU 74 HB3 GLU 74 -8.079 -10.150 -16.354
5 HG2 GLU 74 HG2 GLU 74 -9.194 -11.571 -14.721
6 HG3 GLU 74 HG3 GLU 74 -9.348 -10.196 -13.626
No H/Q in entry = 6
In of MODEL 16
1 H GLU 75 H GLU 75 -5.631 -11.328 -16.578
2 HA GLU 75 HA GLU 75 -6.241 -13.987 -16.481
3 HB2 GLU 75 HB2 GLU 75 -4.993 -13.120 -18.298
4 HB3 GLU 75 HB3 GLU 75 -3.709 -12.551 -17.247
5 HG2 GLU 75 HG2 GLU 75 -3.063 -14.855 -16.783
6 HG3 GLU 75 HG3 GLU 75 -4.358 -15.428 -17.834
No H/Q in entry = 6
In of MODEL 16
1 H LYS 76 H LYS 76 -3.214 -12.713 -15.047
2 HA LYS 76 HA LYS 76 -2.746 -15.270 -13.880
3 HB2 LYS 76 HB2 LYS 76 -1.239 -12.667 -13.618
4 HB3 LYS 76 HB3 LYS 76 -0.694 -14.219 -13.018
5 HG2 LYS 76 HG2 LYS 76 -1.205 -13.540 -15.901
6 HG3 LYS 76 HG3 LYS 76 0.375 -13.678 -15.129
7 HD2 LYS 76 HD2 LYS 76 -1.646 -15.904 -15.423
8 HD3 LYS 76 HD3 LYS 76 -0.192 -15.698 -16.398
9 HE2 LYS 76 HE2 LYS 76 1.178 -15.923 -14.377
10 HE3 LYS 76 HE3 LYS 76 -0.281 -16.158 -13.420
11 HZ1 LYS 76 HZ1 LYS 76 0.623 -17.928 -15.621
12 HZ2 LYS 76 HZ2 LYS 76 0.788 -18.256 -13.970
13 HZ3 LYS 76 HZ3 LYS 76 -0.758 -18.159 -14.664
No H/Q in entry = 13
In of MODEL 16
1 H ALA 77 H ALA 77 -3.827 -12.144 -12.691
2 HA ALA 77 HA ALA 77 -3.607 -12.710 -9.943
3 HB1 ALA 77 HB1 ALA 77 -5.207 -10.887 -9.622
4 HB2 ALA 77 HB2 ALA 77 -5.588 -10.906 -11.344
5 HB3 ALA 77 HB3 ALA 77 -3.974 -10.445 -10.803
No H/Q in entry = 5
In of MODEL 16
1 H ALA 78 H ALA 78 -6.012 -13.500 -12.362
2 HA ALA 78 HA ALA 78 -8.024 -14.485 -10.651
3 HB1 ALA 78 HB1 ALA 78 -8.613 -14.070 -12.901
4 HB2 ALA 78 HB2 ALA 78 -8.673 -15.825 -12.725
5 HB3 ALA 78 HB3 ALA 78 -7.289 -15.057 -13.522
No H/Q in entry = 5
In of MODEL 16
1 H GLU 79 H GLU 79 -5.103 -15.897 -11.983
2 HA GLU 79 HA GLU 79 -5.728 -18.570 -11.114
3 HB2 GLU 79 HB2 GLU 79 -3.004 -17.568 -11.913
4 HB3 GLU 79 HB3 GLU 79 -3.643 -19.202 -12.036
5 HG2 GLU 79 HG2 GLU 79 -5.287 -18.312 -13.710
6 HG3 GLU 79 HG3 GLU 79 -4.366 -16.808 -13.691
No H/Q in entry = 6
In of MODEL 16
1 H LEU 80 H LEU 80 -3.973 -15.817 -9.902
2 HA LEU 80 HA LEU 80 -2.684 -17.244 -7.778
3 HB2 LEU 80 HB2 LEU 80 -3.106 -14.285 -8.215
4 HB3 LEU 80 HB3 LEU 80 -2.020 -14.996 -7.032
5 HG LEU 80 HG LEU 80 -1.770 -15.452 -10.002
6 HD11 LEU 80 HD11 LEU 80 -0.376 -13.445 -8.253
7 HD12 LEU 80 HD12 LEU 80 0.178 -13.915 -9.865
8 HD13 LEU 80 HD13 LEU 80 -1.399 -13.134 -9.658
9 HD21 LEU 80 HD21 LEU 80 0.052 -16.021 -7.680
10 HD22 LEU 80 HD22 LEU 80 -0.792 -17.194 -8.688
11 HD23 LEU 80 HD23 LEU 80 0.491 -16.205 -9.378
No H/Q in entry = 11
In of MODEL 16
1 H LYS 81 H LYS 81 -5.603 -15.300 -8.136
2 HA LYS 81 HA LYS 81 -6.438 -15.343 -5.453
3 HB2 LYS 81 HB2 LYS 81 -7.637 -13.923 -6.929
4 HB3 LYS 81 HB3 LYS 81 -7.942 -15.230 -8.067
5 HG2 LYS 81 HG2 LYS 81 -9.977 -14.692 -6.916
6 HG3 LYS 81 HG3 LYS 81 -9.430 -16.288 -6.403
7 HD2 LYS 81 HD2 LYS 81 -8.376 -15.152 -4.409
8 HD3 LYS 81 HD3 LYS 81 -9.245 -13.692 -4.890
9 HE2 LYS 81 HE2 LYS 81 -10.475 -16.358 -4.195
10 HE3 LYS 81 HE3 LYS 81 -10.482 -14.918 -3.181
11 HZ1 LYS 81 HZ1 LYS 81 -11.787 -13.788 -4.879
12 HZ2 LYS 81 HZ2 LYS 81 -11.788 -15.180 -5.836
13 HZ3 LYS 81 HZ3 LYS 81 -12.574 -15.180 -4.340
No H/Q in entry = 13
In of MODEL 16
1 H ASN 82 H ASN 82 -6.971 -17.618 -8.120
2 HA ASN 82 HA ASN 82 -8.531 -19.404 -6.551
3 HB2 ASN 82 HB2 ASN 82 -8.631 -19.266 -9.049
4 HB3 ASN 82 HB3 ASN 82 -7.036 -19.994 -9.116
5 HD21 ASN 82 HD21 ASN 82 -6.795 -22.170 -8.754
6 HD22 ASN 82 HD22 ASN 82 -8.136 -23.254 -8.614
No H/Q in entry = 6
In of MODEL 16
1 H LEU 83 H LEU 83 -5.138 -18.907 -6.902
2 HA LEU 83 HA LEU 83 -4.309 -21.448 -6.062
3 HB2 LEU 83 HB2 LEU 83 -3.156 -18.718 -6.193
4 HB3 LEU 83 HB3 LEU 83 -2.381 -19.862 -5.145
5 HG LEU 83 HG LEU 83 -2.762 -20.127 -8.118
6 HD11 LEU 83 HD11 LEU 83 -0.988 -18.588 -7.368
7 HD12 LEU 83 HD12 LEU 83 -0.247 -19.913 -6.473
8 HD13 LEU 83 HD13 LEU 83 -0.361 -19.991 -8.231
9 HD21 LEU 83 HD21 LEU 83 -1.527 -22.076 -6.175
10 HD22 LEU 83 HD22 LEU 83 -3.002 -22.320 -7.107
11 HD23 LEU 83 HD23 LEU 83 -1.450 -22.200 -7.930
No H/Q in entry = 11
In of MODEL 16
1 H LYS 84 H LYS 84 -4.672 -18.401 -4.279
2 HA LYS 84 HA LYS 84 -4.332 -19.374 -1.702
3 HB2 LYS 84 HB2 LYS 84 -4.476 -16.980 -2.245
4 HB3 LYS 84 HB3 LYS 84 -6.189 -17.158 -2.598
5 HG2 LYS 84 HG2 LYS 84 -6.532 -17.872 -0.236
6 HG3 LYS 84 HG3 LYS 84 -4.840 -17.482 0.073
7 HD2 LYS 84 HD2 LYS 84 -5.236 -15.166 -0.548
8 HD3 LYS 84 HD3 LYS 84 -6.912 -15.541 -0.951
9 HE2 LYS 84 HE2 LYS 84 -7.270 -16.230 1.404
10 HE3 LYS 84 HE3 LYS 84 -5.627 -15.712 1.772
11 HZ1 LYS 84 HZ1 LYS 84 -6.233 -13.467 1.088
12 HZ2 LYS 84 HZ2 LYS 84 -7.814 -13.976 0.769
13 HZ3 LYS 84 HZ3 LYS 84 -7.220 -14.007 2.351
No H/Q in entry = 13
In of MODEL 16
1 H ASP 85 H ASP 85 -7.357 -19.073 -3.536
2 HA ASP 85 HA ASP 85 -9.091 -20.073 -1.579
3 HB2 ASP 85 HB2 ASP 85 -9.854 -18.881 -3.582
4 HB3 ASP 85 HB3 ASP 85 -9.338 -20.233 -4.585
No H/Q in entry = 4
In of MODEL 16
1 H SER 86 H SER 86 -7.232 -21.805 -4.067
2 HA SER 86 HA SER 86 -8.533 -24.289 -3.426
3 HB2 SER 86 HB2 SER 86 -6.098 -23.775 -5.144
4 HB3 SER 86 HB3 SER 86 -7.005 -25.287 -5.065
5 HG SER 86 HG SER 86 -7.719 -22.818 -6.199
No H/Q in entry = 5
In of MODEL 16
1 H GLY 87 H GLY 87 -6.022 -22.539 -2.028
2 HA2 GLY 87 HA2 GLY 87 -5.356 -24.937 -0.439
3 HA3 GLY 87 HA3 GLY 87 -5.389 -23.297 0.191
No H/Q in entry = 3
In of MODEL 16
1 H ALA 88 H ALA 88 -3.964 -22.590 -2.524
2 HA ALA 88 HA ALA 88 -1.358 -23.577 -2.262
3 HB1 ALA 88 HB1 ALA 88 -2.249 -20.873 -3.260
4 HB2 ALA 88 HB2 ALA 88 -2.075 -22.336 -4.226
5 HB3 ALA 88 HB3 ALA 88 -0.654 -21.580 -3.508
No H/Q in entry = 5
In of MODEL 16
1 H SER 89 H SER 89 0.174 -23.088 -0.869
2 HA SER 89 HA SER 89 -0.318 -21.433 1.425
3 HB2 SER 89 HB2 SER 89 1.009 -23.586 1.468
4 HB3 SER 89 HB3 SER 89 2.291 -22.738 0.608
5 HG SER 89 HG SER 89 2.927 -22.000 2.458
No H/Q in entry = 5
In of MODEL 16
1 H LYS 90 H LYS 90 1.435 -19.818 2.089
2 HA LYS 90 HA LYS 90 1.409 -17.724 0.218
3 HB2 LYS 90 HB2 LYS 90 2.878 -18.104 2.813
4 HB3 LYS 90 HB3 LYS 90 3.054 -16.643 1.855
5 HG2 LYS 90 HG2 LYS 90 0.641 -16.247 2.024
6 HG3 LYS 90 HG3 LYS 90 0.480 -17.702 3.006
7 HD2 LYS 90 HD2 LYS 90 2.201 -15.337 3.738
8 HD3 LYS 90 HD3 LYS 90 0.557 -15.588 4.323
9 HE2 LYS 90 HE2 LYS 90 1.240 -17.688 5.360
10 HE3 LYS 90 HE3 LYS 90 2.880 -17.460 4.758
11 HZ1 LYS 90 HZ1 LYS 90 1.485 -15.657 6.660
12 HZ2 LYS 90 HZ2 LYS 90 2.666 -16.793 7.075
13 HZ3 LYS 90 HZ3 LYS 90 3.070 -15.471 6.100
No H/Q in entry = 13
In of MODEL 16
1 H GLU 91 H GLU 91 3.493 -20.382 0.427
2 HA GLU 91 HA GLU 91 5.762 -19.050 -0.725
3 HB2 GLU 91 HB2 GLU 91 5.165 -21.965 -0.265
4 HB3 GLU 91 HB3 GLU 91 6.657 -21.383 -0.993
5 HG2 GLU 91 HG2 GLU 91 7.124 -21.747 1.270
6 HG3 GLU 91 HG3 GLU 91 7.005 -20.009 1.077
No H/Q in entry = 6
In of MODEL 16
1 H GLU 92 H GLU 92 3.309 -21.330 -1.852
2 HA GLU 92 HA GLU 92 3.882 -21.518 -4.533
3 HB2 GLU 92 HB2 GLU 92 1.176 -21.352 -3.212
4 HB3 GLU 92 HB3 GLU 92 1.522 -22.059 -4.774
5 HG2 GLU 92 HG2 GLU 92 2.633 -23.068 -2.186
6 HG3 GLU 92 HG3 GLU 92 1.186 -23.691 -2.961
No H/Q in entry = 6
In of MODEL 16
1 H LEU 93 H LEU 93 1.949 -19.150 -2.745
2 HA LEU 93 HA LEU 93 1.511 -17.478 -5.010
3 HB2 LEU 93 HB2 LEU 93 1.415 -16.907 -2.047
4 HB3 LEU 93 HB3 LEU 93 0.967 -15.733 -3.276
5 HG LEU 93 HG LEU 93 -0.345 -18.437 -2.967
6 HD11 LEU 93 HD11 LEU 93 -1.249 -15.735 -2.017
7 HD12 LEU 93 HD12 LEU 93 -2.282 -17.164 -2.123
8 HD13 LEU 93 HD13 LEU 93 -0.893 -17.156 -1.031
9 HD21 LEU 93 HD21 LEU 93 -1.038 -16.027 -4.631
10 HD22 LEU 93 HD22 LEU 93 -0.479 -17.594 -5.216
11 HD23 LEU 93 HD23 LEU 93 -2.054 -17.454 -4.441
No H/Q in entry = 11
In of MODEL 16
1 H LYS 94 H LYS 94 4.086 -17.559 -2.498
2 HA LYS 94 HA LYS 94 5.081 -15.038 -3.278
3 HB2 LYS 94 HB2 LYS 94 5.639 -15.925 -1.106
4 HB3 LYS 94 HB3 LYS 94 6.413 -17.328 -1.820
5 HG2 LYS 94 HG2 LYS 94 8.186 -15.946 -2.704
6 HG3 LYS 94 HG3 LYS 94 7.390 -14.495 -2.093
7 HD2 LYS 94 HD2 LYS 94 7.768 -15.121 0.156
8 HD3 LYS 94 HD3 LYS 94 8.222 -16.763 -0.300
9 HE2 LYS 94 HE2 LYS 94 10.158 -15.352 0.325
10 HE3 LYS 94 HE3 LYS 94 10.253 -15.973 -1.318
11 HZ1 LYS 94 HZ1 LYS 94 9.348 -13.244 -0.592
12 HZ2 LYS 94 HZ2 LYS 94 10.891 -13.634 -1.157
13 HZ3 LYS 94 HZ3 LYS 94 9.547 -13.847 -2.156
No H/Q in entry = 13
In of MODEL 16
1 H ALA 95 H ALA 95 5.730 -18.268 -4.379
2 HA ALA 95 HA ALA 95 7.968 -17.337 -5.965
3 HB1 ALA 95 HB1 ALA 95 6.844 -20.121 -5.702
4 HB2 ALA 95 HB2 ALA 95 8.164 -19.454 -4.745
5 HB3 ALA 95 HB3 ALA 95 8.361 -19.675 -6.482
No H/Q in entry = 5
In of MODEL 16
1 H LYS 96 H LYS 96 4.812 -18.930 -6.551
2 HA LYS 96 HA LYS 96 5.030 -19.014 -9.348
3 HB2 LYS 96 HB2 LYS 96 2.720 -18.950 -7.466
4 HB3 LYS 96 HB3 LYS 96 2.446 -18.846 -9.192
5 HG2 LYS 96 HG2 LYS 96 3.960 -21.053 -7.826
6 HG3 LYS 96 HG3 LYS 96 2.267 -21.138 -8.318
7 HD2 LYS 96 HD2 LYS 96 4.467 -20.505 -10.263
8 HD3 LYS 96 HD3 LYS 96 3.993 -22.156 -9.894
9 HE2 LYS 96 HE2 LYS 96 2.114 -20.023 -10.894
10 HE3 LYS 96 HE3 LYS 96 2.904 -21.213 -11.925
11 HZ1 LYS 96 HZ1 LYS 96 1.063 -21.857 -9.685
12 HZ2 LYS 96 HZ2 LYS 96 0.645 -21.863 -11.326
13 HZ3 LYS 96 HZ3 LYS 96 1.780 -22.968 -10.739
No H/Q in entry = 13
In of MODEL 16
1 H VAL 97 H VAL 97 4.302 -16.355 -7.254
2 HA VAL 97 HA VAL 97 3.185 -14.591 -9.203
3 HB VAL 97 HB VAL 97 4.490 -14.065 -6.527
4 HG11 VAL 97 HG11 VAL 97 4.805 -12.131 -7.968
5 HG12 VAL 97 HG12 VAL 97 3.080 -12.109 -8.328
6 HG13 VAL 97 HG13 VAL 97 3.641 -11.788 -6.688
7 HG21 VAL 97 HG21 VAL 97 1.619 -13.993 -7.434
8 HG22 VAL 97 HG22 VAL 97 2.375 -15.216 -6.403
9 HG23 VAL 97 HG23 VAL 97 2.203 -13.560 -5.822
No H/Q in entry = 9
In of MODEL 16
1 H GLU 98 H GLU 98 6.420 -15.243 -7.949
2 HA GLU 98 HA GLU 98 7.807 -13.233 -9.317
3 HB2 GLU 98 HB2 GLU 98 8.609 -15.950 -8.317
4 HB3 GLU 98 HB3 GLU 98 9.739 -14.948 -9.217
5 HG2 GLU 98 HG2 GLU 98 8.369 -14.196 -6.648
6 HG3 GLU 98 HG3 GLU 98 10.044 -14.716 -6.818
No H/Q in entry = 6
In of MODEL 16
1 H GLU 99 H GLU 99 6.756 -16.450 -10.311
2 HA GLU 99 HA GLU 99 8.136 -16.431 -12.783
3 HB2 GLU 99 HB2 GLU 99 5.643 -17.950 -12.009
4 HB3 GLU 99 HB3 GLU 99 6.628 -18.265 -13.433
5 HG2 GLU 99 HG2 GLU 99 8.559 -18.660 -11.873
6 HG3 GLU 99 HG3 GLU 99 7.395 -18.600 -10.551
No H/Q in entry = 6
In of MODEL 16
1 H ALA 100 H ALA 100 5.116 -15.050 -11.724
2 HA ALA 100 HA ALA 100 4.262 -14.376 -14.389
3 HB1 ALA 100 HB1 ALA 100 2.684 -14.691 -12.530
4 HB2 ALA 100 HB2 ALA 100 2.528 -13.104 -13.282
5 HB3 ALA 100 HB3 ALA 100 3.360 -13.268 -11.736
No H/Q in entry = 5
In of MODEL 16
1 H LEU 101 H LEU 101 5.443 -12.431 -11.639
2 HA LEU 101 HA LEU 101 5.849 -10.061 -13.003
3 HB2 LEU 101 HB2 LEU 101 6.723 -11.241 -10.428
4 HB3 LEU 101 HB3 LEU 101 7.520 -9.777 -10.975
5 HG LEU 101 HG LEU 101 5.404 -8.620 -11.055
6 HD11 LEU 101 HD11 LEU 101 3.961 -10.490 -11.651
7 HD12 LEU 101 HD12 LEU 101 4.110 -11.105 -10.004
8 HD13 LEU 101 HD13 LEU 101 3.336 -9.545 -10.299
9 HD21 LEU 101 HD21 LEU 101 5.846 -10.052 -8.454
10 HD22 LEU 101 HD22 LEU 101 6.629 -8.560 -8.976
11 HD23 LEU 101 HD23 LEU 101 4.894 -8.577 -8.655
No H/Q in entry = 11
In of MODEL 16
1 H HIS 102 H HIS 102 7.795 -12.906 -13.167
2 HA HIS 102 HA HIS 102 10.029 -11.349 -14.187
3 HB2 HIS 102 HB2 HIS 102 9.613 -14.342 -14.008
4 HB3 HIS 102 HB3 HIS 102 11.038 -13.598 -14.723
5 HD1 HIS 102 HD1 HIS 102 11.714 -15.344 -12.497
6 HD2 HIS 102 HD2 HIS 102 10.507 -11.429 -11.821
7 HE1 HIS 102 HE1 HIS 102 12.530 -14.776 -10.193
8 HE2 HIS 102 HE2 HIS 102 11.501 -12.535 -9.699
No H/Q in entry = 8
In of MODEL 16
1 H ALA 103 H ALA 103 7.550 -13.590 -15.367
2 HA ALA 103 HA ALA 103 8.369 -13.588 -18.061
3 HB1 ALA 103 HB1 ALA 103 5.630 -14.188 -16.965
4 HB2 ALA 103 HB2 ALA 103 6.973 -15.330 -17.012
5 HB3 ALA 103 HB3 ALA 103 6.288 -14.708 -18.515
No H/Q in entry = 5
In of MODEL 16
1 H VAL 104 H VAL 104 7.036 -11.051 -16.359
2 HA VAL 104 HA VAL 104 5.318 -10.014 -18.389
3 HB VAL 104 HB VAL 104 4.895 -9.509 -16.050
4 HG11 VAL 104 HG11 VAL 104 7.644 -8.350 -16.214
5 HG12 VAL 104 HG12 VAL 104 6.507 -7.905 -14.942
6 HG13 VAL 104 HG13 VAL 104 7.024 -9.584 -15.103
7 HG21 VAL 104 HG21 VAL 104 5.748 -7.081 -17.611
8 HG22 VAL 104 HG22 VAL 104 4.166 -7.852 -17.660
9 HG23 VAL 104 HG23 VAL 104 4.713 -7.058 -16.183
No H/Q in entry = 9
In of MODEL 16
1 H THR 105 H THR 105 5.771 -8.374 -19.826
2 HA THR 105 HA THR 105 8.517 -7.348 -19.828
3 HB THR 105 HB THR 105 8.515 -7.629 -22.365
4 HG1 THR 105 HG1 THR 105 6.892 -9.839 -22.197
5 HG21 THR 105 HG21 THR 105 8.588 -10.113 -20.649
6 HG22 THR 105 HG22 THR 105 9.293 -9.956 -22.256
7 HG23 THR 105 HG23 THR 105 9.927 -9.000 -20.919
No H/Q in entry = 7
In of MODEL 16
1 H ASP 106 H ASP 106 5.267 -6.558 -19.956
2 HA ASP 106 HA ASP 106 5.564 -4.190 -21.552
3 HB2 ASP 106 HB2 ASP 106 3.351 -5.267 -21.127
4 HB3 ASP 106 HB3 ASP 106 3.510 -4.846 -19.435
No H/Q in entry = 4
In of MODEL 16
1 H GLU 107 H GLU 107 6.622 -2.449 -20.944
2 HA GLU 107 HA GLU 107 8.160 -2.525 -18.634
3 HB2 GLU 107 HB2 GLU 107 8.725 -1.383 -20.792
4 HB3 GLU 107 HB3 GLU 107 7.661 -0.071 -20.304
5 HG2 GLU 107 HG2 GLU 107 9.977 0.462 -19.819
6 HG3 GLU 107 HG3 GLU 107 9.036 0.326 -18.331
No H/Q in entry = 6
In of MODEL 16
1 H GLU 108 H GLU 108 5.272 -0.560 -19.309
2 HA GLU 108 HA GLU 108 5.314 0.958 -16.956
3 HB2 GLU 108 HB2 GLU 108 3.018 0.002 -18.659
4 HB3 GLU 108 HB3 GLU 108 2.819 1.110 -17.312
5 HG2 GLU 108 HG2 GLU 108 4.170 2.764 -18.394
6 HG3 GLU 108 HG3 GLU 108 4.585 1.639 -19.688
No H/Q in entry = 6
In of MODEL 16
1 H LYS 109 H LYS 109 3.954 -2.248 -17.627
2 HA LYS 109 HA LYS 109 2.781 -2.711 -15.116
3 HB2 LYS 109 HB2 LYS 109 3.994 -4.630 -17.113
4 HB3 LYS 109 HB3 LYS 109 3.054 -5.135 -15.718
5 HG2 LYS 109 HG2 LYS 109 1.135 -3.841 -16.607
6 HG3 LYS 109 HG3 LYS 109 2.089 -3.490 -18.046
7 HD2 LYS 109 HD2 LYS 109 2.230 -5.864 -18.556
8 HD3 LYS 109 HD3 LYS 109 1.373 -6.253 -17.070
9 HE2 LYS 109 HE2 LYS 109 -0.078 -6.344 -19.062
10 HE3 LYS 109 HE3 LYS 109 -0.617 -5.157 -17.875
11 HZ1 LYS 109 HZ1 LYS 109 0.975 -4.500 -20.293
12 HZ2 LYS 109 HZ2 LYS 109 -0.703 -4.353 -20.187
13 HZ3 LYS 109 HZ3 LYS 109 0.288 -3.403 -19.205
No H/Q in entry = 13
In of MODEL 16
1 H LYS 110 H LYS 110 6.044 -3.322 -16.321
2 HA LYS 110 HA LYS 110 6.972 -4.608 -13.955
3 HB2 LYS 110 HB2 LYS 110 8.512 -3.286 -16.194
4 HB3 LYS 110 HB3 LYS 110 9.198 -4.356 -14.980
5 HG2 LYS 110 HG2 LYS 110 8.180 -6.229 -15.873
6 HG3 LYS 110 HG3 LYS 110 6.973 -5.280 -16.744
7 HD2 LYS 110 HD2 LYS 110 8.586 -6.186 -18.300
8 HD3 LYS 110 HD3 LYS 110 8.743 -4.437 -18.234
9 HE2 LYS 110 HE2 LYS 110 10.494 -6.297 -16.648
10 HE3 LYS 110 HE3 LYS 110 10.891 -5.773 -18.278
11 HZ1 LYS 110 HZ1 LYS 110 10.676 -3.427 -17.367
12 HZ2 LYS 110 HZ2 LYS 110 10.711 -4.134 -15.829
13 HZ3 LYS 110 HZ3 LYS 110 12.025 -4.326 -16.865
No H/Q in entry = 13
In of MODEL 16
1 H GLN 111 H GLN 111 6.643 -1.338 -14.922
2 HA GLN 111 HA GLN 111 8.367 -0.135 -13.052
3 HB2 GLN 111 HB2 GLN 111 7.313 1.151 -14.844
4 HB3 GLN 111 HB3 GLN 111 5.728 0.875 -14.134
5 HG2 GLN 111 HG2 GLN 111 6.505 3.099 -13.617
6 HG3 GLN 111 HG3 GLN 111 6.400 2.133 -12.148
7 HE21 GLN 111 HE21 GLN 111 8.302 1.468 -11.128
8 HE22 GLN 111 HE22 GLN 111 9.822 2.230 -11.442
No H/Q in entry = 8
In of MODEL 16
1 H TYR 112 H TYR 112 5.088 -1.405 -12.771
2 HA TYR 112 HA TYR 112 4.701 -0.489 -10.076
3 HB2 TYR 112 HB2 TYR 112 3.285 -2.624 -11.688
4 HB3 TYR 112 HB3 TYR 112 2.833 -2.183 -10.046
5 HD1 TYR 112 HD1 TYR 112 3.127 0.767 -10.151
6 HD2 TYR 112 HD2 TYR 112 1.468 -1.955 -12.972
7 HE1 TYR 112 HE1 TYR 112 1.699 2.565 -11.027
8 HE2 TYR 112 HE2 TYR 112 0.037 -0.158 -13.861
9 HH TYR 112 HH TYR 112 0.455 3.155 -12.957
No H/Q in entry = 9
In of MODEL 16
1 H ILE 113 H ILE 113 5.973 -3.362 -11.621
2 HA ILE 113 HA ILE 113 6.200 -4.983 -9.347
3 HB ILE 113 HB ILE 113 7.874 -4.870 -11.843
4 HG12 ILE 113 HG12 ILE 113 5.724 -6.763 -10.883
5 HG13 ILE 113 HG13 ILE 113 5.499 -5.498 -12.081
6 HG21 ILE 113 HG21 ILE 113 9.219 -5.830 -10.045
7 HG22 ILE 113 HG22 ILE 113 7.915 -6.951 -9.656
8 HG23 ILE 113 HG23 ILE 113 8.747 -7.070 -11.207
9 HD11 ILE 113 HD11 ILE 113 7.105 -6.607 -13.539
10 HD12 ILE 113 HD12 ILE 113 7.289 -7.886 -12.341
11 HD13 ILE 113 HD13 ILE 113 5.736 -7.645 -13.136
No H/Q in entry = 11
In of MODEL 16
1 H ALA 114 H ALA 114 8.451 -2.579 -10.700
2 HA ALA 114 HA ALA 114 10.411 -2.931 -8.654
3 HB1 ALA 114 HB1 ALA 114 10.997 -2.033 -10.853
4 HB2 ALA 114 HB2 ALA 114 11.437 -0.907 -9.569
5 HB3 ALA 114 HB3 ALA 114 9.994 -0.615 -10.543
No H/Q in entry = 5
In of MODEL 16
1 H ASP 115 H ASP 115 7.770 -0.661 -9.190
2 HA ASP 115 HA ASP 115 8.504 0.977 -6.966
3 HB2 ASP 115 HB2 ASP 115 7.299 1.849 -8.948
4 HB3 ASP 115 HB3 ASP 115 5.874 0.941 -8.449
No H/Q in entry = 4
In of MODEL 16
1 H PHE 116 H PHE 116 5.781 -1.260 -7.478
2 HA PHE 116 HA PHE 116 5.122 -0.881 -4.650
3 HB2 PHE 116 HB2 PHE 116 3.513 -0.998 -6.992
4 HB3 PHE 116 HB3 PHE 116 3.125 -2.414 -6.028
5 HD1 PHE 116 HD1 PHE 116 2.421 -2.088 -3.642
6 HD2 PHE 116 HD2 PHE 116 2.669 1.103 -6.441
7 HE1 PHE 116 HE1 PHE 116 0.895 -0.763 -2.247
8 HE2 PHE 116 HE2 PHE 116 1.142 2.446 -5.043
9 HZ PHE 116 HZ PHE 116 0.245 1.495 -2.950
No H/Q in entry = 9
In of MODEL 16
1 H GLY 117 H GLY 117 6.375 -3.193 -6.837
2 HA2 GLY 117 HA2 GLY 117 7.016 -5.388 -6.573
3 HA3 GLY 117 HA3 GLY 117 5.362 -5.612 -6.040
No H/Q in entry = 3
In of MODEL 16
1 HA PRO 118 HA PRO 118 8.784 -6.424 -2.706
2 HB2 PRO 118 HB2 PRO 118 9.742 -3.678 -2.136
3 HB3 PRO 118 HB3 PRO 118 10.654 -5.183 -2.281
4 HG2 PRO 118 HG2 PRO 118 10.745 -3.345 -4.203
5 HG3 PRO 118 HG3 PRO 118 10.726 -5.076 -4.590
6 HD2 PRO 118 HD2 PRO 118 8.509 -3.074 -4.738
7 HD3 PRO 118 HD3 PRO 118 8.908 -4.402 -5.849
No H/Q in entry = 7
In of MODEL 16
1 H ALA 119 H ALA 119 7.245 -3.241 -2.448
2 HA ALA 119 HA ALA 119 6.721 -3.429 0.346
3 HB1 ALA 119 HB1 ALA 119 5.310 -1.471 0.003
4 HB2 ALA 119 HB2 ALA 119 5.440 -1.677 -1.744
5 HB3 ALA 119 HB3 ALA 119 6.873 -1.282 -0.793
No H/Q in entry = 5
In of MODEL 16
1 H CYS 120 H CYS 120 4.865 -4.190 -2.559
2 HA CYS 120 HA CYS 120 2.461 -4.936 -1.330
3 HB2 CYS 120 HB2 CYS 120 3.818 -5.870 -3.851
4 HB3 CYS 120 HB3 CYS 120 2.264 -6.518 -3.341
No H/Q in entry = 4
In of MODEL 16
1 H LYS 121 H LYS 121 5.546 -6.544 -1.500
2 HA LYS 121 HA LYS 121 4.548 -9.123 -0.867
3 HB2 LYS 121 HB2 LYS 121 7.287 -7.949 -0.860
4 HB3 LYS 121 HB3 LYS 121 6.976 -9.601 -0.324
5 HG2 LYS 121 HG2 LYS 121 5.807 -9.985 -2.504
6 HG3 LYS 121 HG3 LYS 121 6.414 -8.413 -3.024
7 HD2 LYS 121 HD2 LYS 121 8.665 -9.140 -2.814
8 HD3 LYS 121 HD3 LYS 121 8.153 -10.644 -2.042
9 HE2 LYS 121 HE2 LYS 121 7.181 -11.455 -4.039
10 HE3 LYS 121 HE3 LYS 121 7.308 -9.877 -4.821
11 HZ1 LYS 121 HZ1 LYS 121 9.729 -10.102 -4.750
12 HZ2 LYS 121 HZ2 LYS 121 9.576 -11.641 -4.064
13 HZ3 LYS 121 HZ3 LYS 121 9.012 -11.355 -5.639
No H/Q in entry = 13
In of MODEL 16
1 H LYS 122 H LYS 122 5.867 -6.521 1.237
2 HA LYS 122 HA LYS 122 5.373 -8.078 3.592
3 HB2 LYS 122 HB2 LYS 122 5.484 -5.968 4.854
4 HB3 LYS 122 HB3 LYS 122 6.856 -6.167 3.779
5 HG2 LYS 122 HG2 LYS 122 6.037 -4.532 2.282
6 HG3 LYS 122 HG3 LYS 122 4.461 -4.499 3.075
7 HD2 LYS 122 HD2 LYS 122 5.817 -2.551 3.685
8 HD3 LYS 122 HD3 LYS 122 5.472 -3.563 5.087
9 HE2 LYS 122 HE2 LYS 122 7.723 -4.608 4.783
10 HE3 LYS 122 HE3 LYS 122 8.046 -3.416 3.525
11 HZ1 LYS 122 HZ1 LYS 122 7.427 -2.810 6.366
12 HZ2 LYS 122 HZ2 LYS 122 8.959 -2.734 5.655
13 HZ3 LYS 122 HZ3 LYS 122 7.746 -1.664 5.166
No H/Q in entry = 13
In of MODEL 16
1 H ILE 123 H ILE 123 3.450 -6.091 1.485
2 HA ILE 123 HA ILE 123 1.243 -5.718 3.183
3 HB ILE 123 HB ILE 123 1.500 -5.632 0.208
4 HG12 ILE 123 HG12 ILE 123 1.001 -3.495 2.284
5 HG13 ILE 123 HG13 ILE 123 2.587 -3.900 1.637
6 HG21 ILE 123 HG21 ILE 123 -0.946 -4.993 1.850
7 HG22 ILE 123 HG22 ILE 123 -0.743 -4.647 0.134
8 HG23 ILE 123 HG23 ILE 123 -0.783 -6.317 0.697
9 HD11 ILE 123 HD11 ILE 123 0.293 -2.990 -0.051
10 HD12 ILE 123 HD12 ILE 123 1.503 -1.906 0.631
11 HD13 ILE 123 HD13 ILE 123 1.980 -3.153 -0.521
No H/Q in entry = 11
In of MODEL 16
1 H TYR 124 H TYR 124 1.825 -8.017 0.649
2 HA TYR 124 HA TYR 124 -0.346 -9.790 1.302
3 HB2 TYR 124 HB2 TYR 124 1.914 -9.888 -0.682
4 HB3 TYR 124 HB3 TYR 124 0.868 -11.278 -0.406
5 HD1 TYR 124 HD1 TYR 124 -1.767 -10.350 -0.252
6 HD2 TYR 124 HD2 TYR 124 1.389 -8.789 -2.637
7 HE1 TYR 124 HE1 TYR 124 -3.419 -9.434 -1.823
8 HE2 TYR 124 HE2 TYR 124 -0.255 -7.867 -4.216
9 HH TYR 124 HH TYR 124 -3.512 -7.568 -3.505
No H/Q in entry = 9
In of MODEL 16
1 H GLY 125 H GLY 125 1.324 -9.381 3.481
2 HA2 GLY 125 HA2 GLY 125 2.872 -10.368 4.962
3 HA3 GLY 125 HA3 GLY 125 3.843 -9.629 3.723
No H/Q in entry = 3
In of MODEL 16
1 H VAL 126 H VAL 126 3.114 -11.818 1.811
2 HA VAL 126 HA VAL 126 4.171 -14.262 2.402
3 HB VAL 126 HB VAL 126 5.191 -14.252 0.104
4 HG11 VAL 126 HG11 VAL 126 2.358 -13.247 0.316
5 HG12 VAL 126 HG12 VAL 126 3.072 -14.005 -1.112
6 HG13 VAL 126 HG13 VAL 126 2.886 -14.931 0.381
7 HG21 VAL 126 HG21 VAL 126 4.174 -11.413 0.073
8 HG22 VAL 126 HG22 VAL 126 5.859 -11.928 -0.019
9 HG23 VAL 126 HG23 VAL 126 4.750 -12.304 -1.338
No H/Q in entry = 9
In of MODEL 16
1 H HIS 127 H HIS 127 5.848 -11.221 2.380
2 HA HIS 127 HA HIS 127 8.504 -12.139 2.138
3 HB2 HIS 127 HB2 HIS 127 7.930 -9.793 1.815
4 HB3 HIS 127 HB3 HIS 127 7.403 -9.665 3.488
5 HD1 HIS 127 HD1 HIS 127 9.120 -8.941 5.152
6 HD2 HIS 127 HD2 HIS 127 10.822 -10.226 1.579
7 HE1 HIS 127 HE1 HIS 127 11.580 -8.437 5.339
8 HE2 HIS 127 HE2 HIS 127 12.599 -9.341 3.229
No H/Q in entry = 8
In of MODEL 16
1 H THR 128 H THR 128 6.268 -12.264 4.747
2 HA THR 128 HA THR 128 6.405 -12.971 6.903
3 HB THR 128 HB THR 128 9.145 -14.090 6.319
4 HG1 THR 128 HG1 THR 128 8.252 -15.256 4.802
5 HG21 THR 128 HG21 THR 128 8.290 -14.270 8.617
6 HG22 THR 128 HG22 THR 128 6.844 -15.079 8.015
7 HG23 THR 128 HG23 THR 128 8.421 -15.854 7.854
No H/Q in entry = 7
In of MODEL 16
1 H SER 129 H SER 129 6.677 -10.542 7.144
2 HA SER 129 HA SER 129 9.332 -9.675 7.927
3 HB2 SER 129 HB2 SER 129 6.711 -8.163 7.836
4 HB3 SER 129 HB3 SER 129 8.301 -7.455 8.104
5 HG SER 129 HG SER 129 8.060 -7.217 5.982
No H/Q in entry = 5
In of MODEL 17
1 HA2 GLY -4 HA2 GLY -4 -17.914 13.293 -17.685
2 HA3 GLY -4 HA3 GLY -4 -19.248 12.149 -17.614
3 H1 GLY -4 H1 GLY -4 -19.832 14.233 -16.574
4 H2 GLY -4 H2 GLY -4 -18.535 14.095 -15.499
No H/Q in entry = 4
In of MODEL 17
1 H SER -3 H SER -3 -17.576 10.536 -17.959
2 HA SER -3 HA SER -3 -16.550 9.596 -15.395
3 HB2 SER -3 HB2 SER -3 -16.657 8.171 -18.063
4 HB3 SER -3 HB3 SER -3 -16.317 7.441 -16.493
5 HG SER -3 HG SER -3 -18.729 8.829 -17.006
No H/Q in entry = 5
In of MODEL 17
1 HA PRO -2 HA PRO -2 -12.479 10.909 -16.667
2 HB2 PRO -2 HB2 PRO -2 -11.139 10.178 -14.472
3 HB3 PRO -2 HB3 PRO -2 -12.277 11.531 -14.452
4 HG2 PRO -2 HG2 PRO -2 -12.665 8.714 -13.525
5 HG3 PRO -2 HG3 PRO -2 -13.165 10.225 -12.745
6 HD2 PRO -2 HD2 PRO -2 -14.840 8.638 -14.230
7 HD3 PRO -2 HD3 PRO -2 -15.068 10.384 -14.008
No H/Q in entry = 7
In of MODEL 17
1 H GLU -1 H GLU -1 -13.620 8.024 -17.068
2 HA GLU -1 HA GLU -1 -12.939 6.050 -17.904
3 HB2 GLU -1 HB2 GLU -1 -10.381 7.575 -18.381
4 HB3 GLU -1 HB3 GLU -1 -10.668 5.941 -18.964
5 HG2 GLU -1 HG2 GLU -1 -12.329 8.347 -19.674
6 HG3 GLU -1 HG3 GLU -1 -11.054 7.657 -20.678
No H/Q in entry = 6
In of MODEL 17
1 H PHE 0 H PHE 0 -9.732 6.857 -16.668
2 HA PHE 0 HA PHE 0 -9.987 5.136 -14.386
3 HB2 PHE 0 HB2 PHE 0 -9.809 3.497 -16.251
4 HB3 PHE 0 HB3 PHE 0 -8.271 4.220 -16.706
5 HD1 PHE 0 HD1 PHE 0 -10.014 2.137 -14.258
6 HD2 PHE 0 HD2 PHE 0 -6.276 3.812 -15.415
7 HE1 PHE 0 HE1 PHE 0 -8.854 0.601 -12.730
8 HE2 PHE 0 HE2 PHE 0 -5.110 2.277 -13.889
9 HZ PHE 0 HZ PHE 0 -6.398 0.669 -12.543
No H/Q in entry = 9
In of MODEL 17
1 H HIS 1 H HIS 1 -8.898 6.372 -12.964
2 HA HIS 1 HA HIS 1 -6.524 7.809 -13.729
3 HB2 HIS 1 HB2 HIS 1 -7.847 7.339 -11.053
4 HB3 HIS 1 HB3 HIS 1 -6.335 8.226 -11.225
5 HD1 HIS 1 HD1 HIS 1 -9.833 8.806 -10.995
6 HD2 HIS 1 HD2 HIS 1 -6.742 10.478 -13.218
7 HE1 HIS 1 HE1 HIS 1 -10.684 11.044 -11.763
8 HE2 HIS 1 HE2 HIS 1 -8.737 12.103 -12.962
No H/Q in entry = 8
In of MODEL 17
1 H HIS 2 H HIS 2 -4.501 7.101 -13.677
2 HA HIS 2 HA HIS 2 -4.178 4.255 -13.368
3 HB2 HIS 2 HB2 HIS 2 -2.253 6.394 -14.299
4 HB3 HIS 2 HB3 HIS 2 -1.898 4.671 -14.295
5 HD1 HIS 2 HD1 HIS 2 -2.211 3.648 -16.528
6 HD2 HIS 2 HD2 HIS 2 -4.817 6.827 -15.909
7 HE1 HIS 2 HE1 HIS 2 -3.552 3.847 -18.642
8 HE2 HIS 2 HE2 HIS 2 -5.208 5.693 -18.195
No H/Q in entry = 8
In of MODEL 17
1 H PHE 3 H PHE 3 -4.644 4.663 -10.975
2 HA PHE 3 HA PHE 3 -3.946 4.354 -8.852
3 HB2 PHE 3 HB2 PHE 3 -1.285 3.655 -10.103
4 HB3 PHE 3 HB3 PHE 3 -1.856 3.176 -8.506
5 HD1 PHE 3 HD1 PHE 3 -4.387 2.101 -8.722
6 HD2 PHE 3 HD2 PHE 3 -1.282 1.945 -11.625
7 HE1 PHE 3 HE1 PHE 3 -5.401 0.084 -9.693
8 HE2 PHE 3 HE2 PHE 3 -2.291 -0.074 -12.604
9 HZ PHE 3 HZ PHE 3 -4.357 -1.004 -11.637
No H/Q in entry = 9
In of MODEL 17
1 H THR 4 H THR 4 -4.148 6.462 -8.176
2 HA THR 4 HA THR 4 -1.618 7.926 -7.967
3 HB THR 4 HB THR 4 -2.958 10.063 -8.061
4 HG1 THR 4 HG1 THR 4 -4.979 8.266 -8.304
5 HG21 THR 4 HG21 THR 4 -1.578 9.304 -9.937
6 HG22 THR 4 HG22 THR 4 -2.931 8.356 -10.552
7 HG23 THR 4 HG23 THR 4 -3.037 10.116 -10.506
No H/Q in entry = 7
In of MODEL 17
1 H LEU 5 H LEU 5 -1.446 9.295 -6.087
2 HA LEU 5 HA LEU 5 -2.204 7.972 -3.779
3 HB2 LEU 5 HB2 LEU 5 -0.265 9.406 -3.943
4 HB3 LEU 5 HB3 LEU 5 -1.286 10.809 -4.170
5 HG LEU 5 HG LEU 5 -2.186 10.466 -1.875
6 HD11 LEU 5 HD11 LEU 5 -0.005 8.390 -1.712
7 HD12 LEU 5 HD12 LEU 5 -0.942 9.003 -0.350
8 HD13 LEU 5 HD13 LEU 5 -1.741 8.090 -1.629
9 HD21 LEU 5 HD21 LEU 5 -0.367 12.039 -2.382
10 HD22 LEU 5 HD22 LEU 5 -0.246 11.367 -0.758
11 HD23 LEU 5 HD23 LEU 5 0.804 10.768 -2.043
No H/Q in entry = 11
In of MODEL 17
1 H GLU 6 H GLU 6 -3.542 11.051 -5.036
2 HA GLU 6 HA GLU 6 -5.627 11.355 -3.216
3 HB2 GLU 6 HB2 GLU 6 -5.681 11.935 -6.189
4 HB3 GLU 6 HB3 GLU 6 -6.813 12.578 -5.007
5 HG2 GLU 6 HG2 GLU 6 -5.043 13.805 -3.922
6 HG3 GLU 6 HG3 GLU 6 -3.851 13.094 -5.008
No H/Q in entry = 6
In of MODEL 17
1 H SER 7 H SER 7 -5.547 9.235 -6.162
2 HA SER 7 HA SER 7 -8.333 8.855 -6.060
3 HB2 SER 7 HB2 SER 7 -7.995 7.030 -7.689
4 HB3 SER 7 HB3 SER 7 -7.167 8.516 -8.144
5 HG SER 7 HG SER 7 -6.159 6.056 -7.702
No H/Q in entry = 5
In of MODEL 17
1 H SER 8 H SER 8 -6.036 7.599 -3.946
2 HA SER 8 HA SER 8 -7.723 5.289 -3.366
3 HB2 SER 8 HB2 SER 8 -5.044 5.965 -2.169
4 HB3 SER 8 HB3 SER 8 -5.980 4.480 -1.900
5 HG SER 8 HG SER 8 -4.877 5.399 -4.362
No H/Q in entry = 5
In of MODEL 17
1 H LEU 9 H LEU 9 -7.330 8.499 -2.206
2 HA LEU 9 HA LEU 9 -7.002 8.058 0.493
3 HB2 LEU 9 HB2 LEU 9 -8.242 10.390 -0.907
4 HB3 LEU 9 HB3 LEU 9 -7.709 10.389 0.766
5 HG LEU 9 HG LEU 9 -5.879 9.795 -1.549
6 HD11 LEU 9 HD11 LEU 9 -6.370 12.385 -0.114
7 HD12 LEU 9 HD12 LEU 9 -5.102 12.087 -1.306
8 HD13 LEU 9 HD13 LEU 9 -6.798 12.000 -1.781
9 HD21 LEU 9 HD21 LEU 9 -5.346 10.529 1.330
10 HD22 LEU 9 HD22 LEU 9 -5.124 8.936 0.606
11 HD23 LEU 9 HD23 LEU 9 -4.118 10.292 0.086
No H/Q in entry = 11
In of MODEL 17
1 H ASP 10 H ASP 10 -9.987 8.187 -1.227
2 HA ASP 10 HA ASP 10 -11.495 7.891 1.268
3 HB2 ASP 10 HB2 ASP 10 -12.432 8.313 -1.574
4 HB3 ASP 10 HB3 ASP 10 -13.500 8.162 -0.186
No H/Q in entry = 4
In of MODEL 17
1 H THR 11 H THR 11 -9.913 5.919 -0.751
2 HA THR 11 HA THR 11 -11.839 3.757 -0.282
3 HB THR 11 HB THR 11 -10.886 2.636 -2.329
4 HG1 THR 11 HG1 THR 11 -10.025 5.214 -3.120
5 HG21 THR 11 HG21 THR 11 -12.313 5.272 -2.715
6 HG22 THR 11 HG22 THR 11 -12.222 3.977 -3.908
7 HG23 THR 11 HG23 THR 11 -13.070 3.714 -2.386
No H/Q in entry = 7
In of MODEL 17
1 H HIS 12 H HIS 12 -8.750 3.192 -1.730
2 HA HIS 12 HA HIS 12 -8.118 1.178 0.090
3 HB2 HIS 12 HB2 HIS 12 -6.199 2.577 -1.756
4 HB3 HIS 12 HB3 HIS 12 -5.962 1.000 -1.013
5 HD1 HIS 12 HD1 HIS 12 -8.084 -0.741 -1.682
6 HD2 HIS 12 HD2 HIS 12 -7.164 2.387 -4.266
7 HE1 HIS 12 HE1 HIS 12 -9.071 -1.381 -3.907
8 HE2 HIS 12 HE2 HIS 12 -8.693 0.624 -5.379
No H/Q in entry = 8
In of MODEL 17
1 H LEU 13 H LEU 13 -7.246 4.576 0.122
2 HA LEU 13 HA LEU 13 -5.382 4.001 2.334
3 HB2 LEU 13 HB2 LEU 13 -5.323 5.970 0.125
4 HB3 LEU 13 HB3 LEU 13 -4.665 6.470 1.668
5 HG LEU 13 HG LEU 13 -2.864 5.651 0.310
6 HD11 LEU 13 HD11 LEU 13 -2.869 5.075 2.726
7 HD12 LEU 13 HD12 LEU 13 -3.522 3.495 2.303
8 HD13 LEU 13 HD13 LEU 13 -1.928 3.972 1.724
9 HD21 LEU 13 HD21 LEU 13 -4.494 3.137 -0.008
10 HD22 LEU 13 HD22 LEU 13 -4.062 4.289 -1.271
11 HD23 LEU 13 HD23 LEU 13 -2.810 3.319 -0.501
No H/Q in entry = 11
In of MODEL 17
1 H LYS 14 H LYS 14 -8.271 4.375 2.460
2 HA LYS 14 HA LYS 14 -8.862 6.973 3.462
3 HB2 LYS 14 HB2 LYS 14 -11.056 6.203 3.802
4 HB3 LYS 14 HB3 LYS 14 -10.486 5.356 2.377
5 HG2 LYS 14 HG2 LYS 14 -9.962 3.407 3.867
6 HG3 LYS 14 HG3 LYS 14 -10.801 4.265 5.159
7 HD2 LYS 14 HD2 LYS 14 -11.961 3.342 2.533
8 HD3 LYS 14 HD3 LYS 14 -12.326 2.707 4.134
9 HE2 LYS 14 HE2 LYS 14 -12.911 5.517 3.205
10 HE3 LYS 14 HE3 LYS 14 -14.085 4.207 3.265
11 HZ1 LYS 14 HZ1 LYS 14 -13.746 4.084 5.663
12 HZ2 LYS 14 HZ2 LYS 14 -12.654 5.374 5.592
13 HZ3 LYS 14 HZ3 LYS 14 -14.277 5.618 5.194
No H/Q in entry = 13
In of MODEL 17
1 H TRP 15 H TRP 15 -7.467 4.221 4.893
2 HA TRP 15 HA TRP 15 -8.369 4.664 7.581
3 HB2 TRP 15 HB2 TRP 15 -6.645 2.978 8.172
4 HB3 TRP 15 HB3 TRP 15 -7.719 2.426 6.887
5 HD1 TRP 15 HD1 TRP 15 -6.700 2.252 4.426
6 HE1 TRP 15 HE1 TRP 15 -4.280 2.037 3.586
7 HE3 TRP 15 HE3 TRP 15 -4.239 3.660 8.679
8 HZ2 TRP 15 HZ2 TRP 15 -1.664 2.412 4.599
9 HZ3 TRP 15 HZ3 TRP 15 -1.779 3.704 8.661
10 HH2 TRP 15 HH2 TRP 15 -0.518 3.091 6.661
No H/Q in entry = 10
In of MODEL 17
1 H LEU 16 H LEU 16 -6.210 6.285 5.629
2 HA LEU 16 HA LEU 16 -4.368 7.098 7.684
3 HB2 LEU 16 HB2 LEU 16 -4.968 8.201 4.937
4 HB3 LEU 16 HB3 LEU 16 -3.728 8.839 5.991
5 HG LEU 16 HG LEU 16 -3.720 5.979 5.033
6 HD11 LEU 16 HD11 LEU 16 -2.409 8.404 3.823
7 HD12 LEU 16 HD12 LEU 16 -2.065 6.735 3.373
8 HD13 LEU 16 HD13 LEU 16 -3.668 7.411 3.089
9 HD21 LEU 16 HD21 LEU 16 -2.359 6.527 7.029
10 HD22 LEU 16 HD22 LEU 16 -1.376 6.050 5.643
11 HD23 LEU 16 HD23 LEU 16 -1.510 7.754 6.083
No H/Q in entry = 11
In of MODEL 17
1 H SER 17 H SER 17 -4.308 9.095 8.664
2 HA SER 17 HA SER 17 -6.857 10.349 9.103
3 HB2 SER 17 HB2 SER 17 -4.139 11.220 10.096
4 HB3 SER 17 HB3 SER 17 -5.703 11.711 10.741
5 HG SER 17 HG SER 17 -4.247 9.634 11.455
No H/Q in entry = 5
In of MODEL 17
1 H GLN 18 H GLN 18 -7.155 12.738 8.844
2 HA GLN 18 HA GLN 18 -6.715 13.523 6.211
3 HB2 GLN 18 HB2 GLN 18 -8.456 14.518 7.629
4 HB3 GLN 18 HB3 GLN 18 -7.230 15.273 8.631
5 HG2 GLN 18 HG2 GLN 18 -7.367 15.882 5.709
6 HG3 GLN 18 HG3 GLN 18 -8.467 16.668 6.839
7 HE21 GLN 18 HE21 GLN 18 -6.345 17.808 5.191
8 HE22 GLN 18 HE22 GLN 18 -5.272 18.608 6.287
No H/Q in entry = 8
In of MODEL 17
1 H GLU 19 H GLU 19 -4.865 14.261 9.131
2 HA GLU 19 HA GLU 19 -3.116 16.112 8.056
3 HB2 GLU 19 HB2 GLU 19 -3.253 15.983 10.376
4 HB3 GLU 19 HB3 GLU 19 -3.210 14.229 10.380
5 HG2 GLU 19 HG2 GLU 19 -1.187 14.785 11.224
6 HG3 GLU 19 HG3 GLU 19 -0.862 14.501 9.521
No H/Q in entry = 6
In of MODEL 17
1 H GLN 20 H GLN 20 -3.045 12.568 8.172
2 HA GLN 20 HA GLN 20 -0.409 12.305 7.132
3 HB2 GLN 20 HB2 GLN 20 -2.703 10.327 7.086
4 HB3 GLN 20 HB3 GLN 20 -1.017 9.943 6.766
5 HG2 GLN 20 HG2 GLN 20 -0.415 10.507 9.031
6 HG3 GLN 20 HG3 GLN 20 -2.063 11.030 9.369
7 HE21 GLN 20 HE21 GLN 20 0.047 8.328 8.918
8 HE22 GLN 20 HE22 GLN 20 -1.052 7.118 9.482
No H/Q in entry = 8
In of MODEL 17
1 H LYS 21 H LYS 21 -3.656 12.237 5.708
2 HA LYS 21 HA LYS 21 -2.866 11.650 3.066
3 HB2 LYS 21 HB2 LYS 21 -5.258 13.218 4.046
4 HB3 LYS 21 HB3 LYS 21 -5.065 12.577 2.419
5 HG2 LYS 21 HG2 LYS 21 -5.060 10.312 3.281
6 HG3 LYS 21 HG3 LYS 21 -5.169 10.922 4.933
7 HD2 LYS 21 HD2 LYS 21 -7.342 11.895 4.456
8 HD3 LYS 21 HD3 LYS 21 -7.229 11.375 2.774
9 HE2 LYS 21 HE2 LYS 21 -7.233 9.058 3.451
10 HE3 LYS 21 HE3 LYS 21 -7.217 9.524 5.153
11 HZ1 LYS 21 HZ1 LYS 21 -9.384 10.621 4.762
12 HZ2 LYS 21 HZ2 LYS 21 -9.401 9.982 3.198
13 HZ3 LYS 21 HZ3 LYS 21 -9.431 8.949 4.536
No H/Q in entry = 13
In of MODEL 17
1 H ASP 22 H ASP 22 -3.469 14.708 4.702
2 HA ASP 22 HA ASP 22 -2.845 16.435 2.555
3 HB2 ASP 22 HB2 ASP 22 -4.088 17.107 4.583
4 HB3 ASP 22 HB3 ASP 22 -2.627 16.903 5.536
No H/Q in entry = 4
In of MODEL 17
1 H GLU 23 H GLU 23 -0.812 14.879 5.021
2 HA GLU 23 HA GLU 23 1.543 16.302 4.296
3 HB2 GLU 23 HB2 GLU 23 1.878 15.443 6.354
4 HB3 GLU 23 HB3 GLU 23 0.777 14.100 6.086
5 HG2 GLU 23 HG2 GLU 23 2.442 12.889 4.910
6 HG3 GLU 23 HG3 GLU 23 3.550 14.259 4.967
No H/Q in entry = 6
In of MODEL 17
1 H LEU 24 H LEU 24 0.222 13.099 3.382
2 HA LEU 24 HA LEU 24 2.439 12.400 1.763
3 HB2 LEU 24 HB2 LEU 24 -0.433 11.475 1.599
4 HB3 LEU 24 HB3 LEU 24 0.926 10.710 0.796
5 HG LEU 24 HG LEU 24 0.780 10.968 3.784
6 HD11 LEU 24 HD11 LEU 24 -1.185 9.766 3.011
7 HD12 LEU 24 HD12 LEU 24 -0.145 8.663 2.114
8 HD13 LEU 24 HD13 LEU 24 -0.060 8.717 3.876
9 HD21 LEU 24 HD21 LEU 24 2.344 9.160 1.963
10 HD22 LEU 24 HD22 LEU 24 2.988 10.503 2.910
11 HD23 LEU 24 HD23 LEU 24 2.334 9.079 3.726
No H/Q in entry = 11
In of MODEL 17
1 H LEU 25 H LEU 25 -0.609 14.077 1.106
2 HA LEU 25 HA LEU 25 -0.301 14.333 -1.676
3 HB2 LEU 25 HB2 LEU 25 -1.717 16.068 0.343
4 HB3 LEU 25 HB3 LEU 25 -1.777 16.365 -1.380
5 HG LEU 25 HG LEU 25 -2.789 13.883 0.006
6 HD11 LEU 25 HD11 LEU 25 -4.265 16.174 -1.280
7 HD12 LEU 25 HD12 LEU 25 -4.999 14.708 -0.629
8 HD13 LEU 25 HD13 LEU 25 -4.173 15.833 0.449
9 HD21 LEU 25 HD21 LEU 25 -2.867 14.715 -2.891
10 HD22 LEU 25 HD22 LEU 25 -1.972 13.359 -2.208
11 HD23 LEU 25 HD23 LEU 25 -3.734 13.341 -2.206
No H/Q in entry = 11
In of MODEL 17
1 H LYS 26 H LYS 26 0.919 16.204 1.022
2 HA LYS 26 HA LYS 26 2.014 18.329 -0.527
3 HB2 LYS 26 HB2 LYS 26 1.559 18.079 2.083
4 HB3 LYS 26 HB3 LYS 26 3.223 17.521 2.086
5 HG2 LYS 26 HG2 LYS 26 2.478 20.111 0.786
6 HG3 LYS 26 HG3 LYS 26 2.734 20.009 2.524
7 HD2 LYS 26 HD2 LYS 26 4.756 19.144 0.462
8 HD3 LYS 26 HD3 LYS 26 4.740 20.733 1.230
9 HE2 LYS 26 HE2 LYS 26 4.846 19.523 3.445
10 HE3 LYS 26 HE3 LYS 26 5.163 18.052 2.528
11 HZ1 LYS 26 HZ1 LYS 26 6.820 20.512 2.465
12 HZ2 LYS 26 HZ2 LYS 26 7.205 19.086 3.289
13 HZ3 LYS 26 HZ3 LYS 26 7.131 19.097 1.598
No H/Q in entry = 13
In of MODEL 17
1 H MET 27 H MET 27 3.334 15.312 0.804
2 HA MET 27 HA MET 27 5.875 15.494 -0.185
3 HB2 MET 27 HB2 MET 27 4.139 13.030 0.034
4 HB3 MET 27 HB3 MET 27 5.876 12.992 -0.231
5 HG2 MET 27 HG2 MET 27 6.241 14.084 1.909
6 HG3 MET 27 HG3 MET 27 4.500 14.172 2.170
7 HE1 MET 27 HE1 MET 27 7.518 11.787 1.555
8 HE2 MET 27 HE2 MET 27 6.837 10.201 1.918
9 HE3 MET 27 HE3 MET 27 6.309 11.084 0.486
No H/Q in entry = 9
In of MODEL 17
1 H LYS 28 H LYS 28 3.098 13.967 -1.844
2 HA LYS 28 HA LYS 28 4.403 13.271 -4.210
3 HB2 LYS 28 HB2 LYS 28 2.190 12.431 -3.548
4 HB3 LYS 28 HB3 LYS 28 1.506 14.032 -3.770
5 HG2 LYS 28 HG2 LYS 28 0.902 12.792 -5.672
6 HG3 LYS 28 HG3 LYS 28 2.200 13.868 -6.185
7 HD2 LYS 28 HD2 LYS 28 2.605 11.711 -7.139
8 HD3 LYS 28 HD3 LYS 28 3.795 11.975 -5.864
9 HE2 LYS 28 HE2 LYS 28 2.534 10.585 -4.343
10 HE3 LYS 28 HE3 LYS 28 1.241 10.407 -5.525
11 HZ1 LYS 28 HZ1 LYS 28 2.780 9.245 -6.979
12 HZ2 LYS 28 HZ2 LYS 28 4.018 9.412 -5.840
13 HZ3 LYS 28 HZ3 LYS 28 2.667 8.465 -5.485
No H/Q in entry = 13
In of MODEL 17
1 H LYS 29 H LYS 29 2.680 16.234 -3.345
2 HA LYS 29 HA LYS 29 3.034 17.445 -5.890
3 HB2 LYS 29 HB2 LYS 29 2.244 18.612 -3.225
4 HB3 LYS 29 HB3 LYS 29 2.228 19.513 -4.732
5 HG2 LYS 29 HG2 LYS 29 0.572 18.019 -5.657
6 HG3 LYS 29 HG3 LYS 29 0.645 17.005 -4.216
7 HD2 LYS 29 HD2 LYS 29 -0.167 18.889 -2.866
8 HD3 LYS 29 HD3 LYS 29 -0.266 19.880 -4.324
9 HE2 LYS 29 HE2 LYS 29 -1.892 18.336 -5.271
10 HE3 LYS 29 HE3 LYS 29 -1.783 17.319 -3.835
11 HZ1 LYS 29 HZ1 LYS 29 -2.645 19.157 -2.524
12 HZ2 LYS 29 HZ2 LYS 29 -2.750 20.127 -3.907
13 HZ3 LYS 29 HZ3 LYS 29 -3.722 18.750 -3.761
No H/Q in entry = 13
In of MODEL 17
1 H ASP 30 H ASP 30 5.100 17.202 -3.154
2 HA ASP 30 HA ASP 30 6.671 19.502 -4.016
3 HB2 ASP 30 HB2 ASP 30 6.289 19.169 -1.589
4 HB3 ASP 30 HB3 ASP 30 7.125 17.624 -1.679
No H/Q in entry = 4
In of MODEL 17
1 H GLY 31 H GLY 31 6.404 16.336 -4.798
2 HA2 GLY 31 HA2 GLY 31 8.901 16.536 -6.277
3 HA3 GLY 31 HA3 GLY 31 7.575 15.433 -6.611
No H/Q in entry = 3
In of MODEL 17
1 H LYS 32 H LYS 32 7.575 14.756 -3.641
2 HA LYS 32 HA LYS 32 9.928 13.239 -3.215
3 HB2 LYS 32 HB2 LYS 32 7.123 12.958 -2.123
4 HB3 LYS 32 HB3 LYS 32 8.465 11.946 -1.609
5 HG2 LYS 32 HG2 LYS 32 8.341 14.944 -1.338
6 HG3 LYS 32 HG3 LYS 32 8.028 13.781 -0.048
7 HD2 LYS 32 HD2 LYS 32 10.314 12.924 -0.275
8 HD3 LYS 32 HD3 LYS 32 10.622 14.097 -1.556
9 HE2 LYS 32 HE2 LYS 32 10.192 15.919 0.034
10 HE3 LYS 32 HE3 LYS 32 9.935 14.730 1.309
11 HZ1 LYS 32 HZ1 LYS 32 12.457 15.034 -0.221
12 HZ2 LYS 32 HZ2 LYS 32 12.181 15.692 1.311
13 HZ3 LYS 32 HZ3 LYS 32 12.199 14.015 1.105
No H/Q in entry = 13
In of MODEL 17
1 H ALA 33 H ALA 33 10.328 11.125 -3.709
2 HA ALA 33 HA ALA 33 9.169 10.175 -6.149
3 HB1 ALA 33 HB1 ALA 33 11.544 9.837 -5.638
4 HB2 ALA 33 HB2 ALA 33 11.101 8.785 -4.291
5 HB3 ALA 33 HB3 ALA 33 10.723 8.308 -5.946
No H/Q in entry = 5
In of MODEL 17
1 H LYS 34 H LYS 34 8.104 8.081 -6.449
2 HA LYS 34 HA LYS 34 5.975 7.655 -4.688
3 HB2 LYS 34 HB2 LYS 34 7.200 5.723 -6.673
4 HB3 LYS 34 HB3 LYS 34 5.692 5.431 -5.825
5 HG2 LYS 34 HG2 LYS 34 5.054 6.193 -7.933
6 HG3 LYS 34 HG3 LYS 34 4.870 7.598 -6.884
7 HD2 LYS 34 HD2 LYS 34 7.007 8.470 -7.654
8 HD3 LYS 34 HD3 LYS 34 7.243 7.044 -8.663
9 HE2 LYS 34 HE2 LYS 34 5.260 7.637 -9.959
10 HE3 LYS 34 HE3 LYS 34 5.018 9.058 -8.944
11 HZ1 LYS 34 HZ1 LYS 34 7.213 9.853 -9.680
12 HZ2 LYS 34 HZ2 LYS 34 7.326 8.536 -10.732
13 HZ3 LYS 34 HZ3 LYS 34 6.120 9.696 -10.958
No H/Q in entry = 13
In of MODEL 17
1 H LYS 35 H LYS 35 9.165 6.220 -4.857
2 HA LYS 35 HA LYS 35 8.879 4.144 -3.021
3 HB2 LYS 35 HB2 LYS 35 11.325 5.883 -3.373
4 HB3 LYS 35 HB3 LYS 35 11.284 4.245 -2.740
5 HG2 LYS 35 HG2 LYS 35 10.619 5.070 -5.557
6 HG3 LYS 35 HG3 LYS 35 12.105 4.291 -5.025
7 HD2 LYS 35 HD2 LYS 35 9.346 3.091 -4.803
8 HD3 LYS 35 HD3 LYS 35 10.509 2.722 -6.077
9 HE2 LYS 35 HE2 LYS 35 12.091 1.935 -4.342
10 HE3 LYS 35 HE3 LYS 35 10.850 2.218 -3.125
11 HZ1 LYS 35 HZ1 LYS 35 9.434 0.608 -4.258
12 HZ2 LYS 35 HZ2 LYS 35 10.652 0.319 -5.404
13 HZ3 LYS 35 HZ3 LYS 35 10.897 -0.091 -3.779
No H/Q in entry = 13
In of MODEL 17
1 H GLU 36 H GLU 36 8.891 7.574 -2.454
2 HA GLU 36 HA GLU 36 9.708 7.273 0.325
3 HB2 GLU 36 HB2 GLU 36 9.013 9.798 -1.164
4 HB3 GLU 36 HB3 GLU 36 9.853 9.668 0.378
5 HG2 GLU 36 HG2 GLU 36 11.646 8.400 -0.819
6 HG3 GLU 36 HG3 GLU 36 10.840 8.821 -2.316
No H/Q in entry = 6
In of MODEL 17
1 H LEU 37 H LEU 37 6.945 8.111 -1.653
2 HA LEU 37 HA LEU 37 5.076 8.491 0.401
3 HB2 LEU 37 HB2 LEU 37 4.901 7.431 -2.413
4 HB3 LEU 37 HB3 LEU 37 3.487 7.675 -1.409
5 HG LEU 37 HG LEU 37 3.964 9.468 -3.059
6 HD11 LEU 37 HD11 LEU 37 2.534 9.840 -1.130
7 HD12 LEU 37 HD12 LEU 37 3.950 10.273 -0.170
8 HD13 LEU 37 HD13 LEU 37 3.452 11.296 -1.518
9 HD21 LEU 37 HD21 LEU 37 6.273 10.091 -1.265
10 HD22 LEU 37 HD22 LEU 37 6.340 9.643 -2.968
11 HD23 LEU 37 HD23 LEU 37 5.621 11.183 -2.491
No H/Q in entry = 11
In of MODEL 17
1 H GLU 38 H GLU 38 6.171 5.666 -1.367
2 HA GLU 38 HA GLU 38 4.569 3.740 -0.068
3 HB2 GLU 38 HB2 GLU 38 5.972 3.649 -2.275
4 HB3 GLU 38 HB3 GLU 38 7.272 3.118 -1.216
5 HG2 GLU 38 HG2 GLU 38 6.223 1.192 -2.136
6 HG3 GLU 38 HG3 GLU 38 5.791 1.284 -0.427
No H/Q in entry = 6
In of MODEL 17
1 H ALA 39 H ALA 39 7.265 5.513 0.941
2 HA ALA 39 HA ALA 39 8.118 3.548 2.912
3 HB1 ALA 39 HB1 ALA 39 9.188 6.314 2.366
4 HB2 ALA 39 HB2 ALA 39 9.906 5.109 3.435
5 HB3 ALA 39 HB3 ALA 39 9.825 4.810 1.699
No H/Q in entry = 5
In of MODEL 17
1 H LYS 40 H LYS 40 6.658 6.750 2.812
2 HA LYS 40 HA LYS 40 6.606 7.182 5.595
3 HB2 LYS 40 HB2 LYS 40 6.342 8.892 3.736
4 HB3 LYS 40 HB3 LYS 40 4.706 8.300 3.529
5 HG2 LYS 40 HG2 LYS 40 4.693 10.304 4.850
6 HG3 LYS 40 HG3 LYS 40 4.190 8.932 5.834
7 HD2 LYS 40 HD2 LYS 40 5.647 10.211 7.181
8 HD3 LYS 40 HD3 LYS 40 6.570 8.810 6.665
9 HE2 LYS 40 HE2 LYS 40 6.707 11.404 5.168
10 HE3 LYS 40 HE3 LYS 40 7.695 11.125 6.599
11 HZ1 LYS 40 HZ1 LYS 40 8.531 9.083 5.438
12 HZ2 LYS 40 HZ2 LYS 40 7.760 9.636 4.037
13 HZ3 LYS 40 HZ3 LYS 40 8.992 10.549 4.738
No H/Q in entry = 13
In of MODEL 17
1 H ILE 41 H ILE 41 4.244 5.882 3.320
2 HA ILE 41 HA ILE 41 2.163 5.595 5.229
3 HB ILE 41 HB ILE 41 2.550 4.364 2.497
4 HG12 ILE 41 HG12 ILE 41 0.820 6.686 3.349
5 HG13 ILE 41 HG13 ILE 41 2.461 6.886 2.751
6 HG21 ILE 41 HG21 ILE 41 0.967 3.063 3.830
7 HG22 ILE 41 HG22 ILE 41 0.062 4.532 4.193
8 HG23 ILE 41 HG23 ILE 41 0.146 3.934 2.537
9 HD11 ILE 41 HD11 ILE 41 1.805 5.885 0.626
10 HD12 ILE 41 HD12 ILE 41 0.154 5.705 1.230
11 HD13 ILE 41 HD13 ILE 41 0.846 7.318 1.022
No H/Q in entry = 11
In of MODEL 17
1 H LEU 42 H LEU 42 4.619 3.386 3.916
2 HA LEU 42 HA LEU 42 3.703 1.049 5.171
3 HB2 LEU 42 HB2 LEU 42 6.419 1.930 4.271
4 HB3 LEU 42 HB3 LEU 42 6.200 0.408 5.102
5 HG LEU 42 HG LEU 42 5.099 1.217 2.424
6 HD11 LEU 42 HD11 LEU 42 7.413 0.472 2.484
7 HD12 LEU 42 HD12 LEU 42 6.917 -1.013 3.294
8 HD13 LEU 42 HD13 LEU 42 6.386 -0.689 1.646
9 HD21 LEU 42 HD21 LEU 42 4.429 -1.182 4.123
10 HD22 LEU 42 HD22 LEU 42 3.316 0.009 3.454
11 HD23 LEU 42 HD23 LEU 42 4.153 -1.119 2.383
No H/Q in entry = 11
In of MODEL 17
1 H HIS 43 H HIS 43 5.703 3.690 6.338
2 HA HIS 43 HA HIS 43 6.401 2.539 8.819
3 HB2 HIS 43 HB2 HIS 43 7.500 4.576 7.979
4 HB3 HIS 43 HB3 HIS 43 5.985 5.461 8.122
5 HD1 HIS 43 HD1 HIS 43 8.652 3.851 10.262
6 HD2 HIS 43 HD2 HIS 43 5.432 6.458 10.631
7 HE1 HIS 43 HE1 HIS 43 8.765 4.741 12.609
8 HE2 HIS 43 HE2 HIS 43 6.815 6.324 12.813
No H/Q in entry = 8
In of MODEL 17
1 H TYR 44 H TYR 44 3.670 4.658 7.893
2 HA TYR 44 HA TYR 44 2.473 4.739 10.441
3 HB2 TYR 44 HB2 TYR 44 1.214 5.001 7.699
4 HB3 TYR 44 HB3 TYR 44 0.437 5.450 9.211
5 HD1 TYR 44 HD1 TYR 44 2.975 6.566 10.505
6 HD2 TYR 44 HD2 TYR 44 1.178 7.195 6.704
7 HE1 TYR 44 HE1 TYR 44 4.029 8.758 10.387
8 HE2 TYR 44 HE2 TYR 44 2.232 9.411 6.565
9 HH TYR 44 HH TYR 44 3.206 11.114 8.049
No H/Q in entry = 9
In of MODEL 17
1 H TYR 45 H TYR 45 2.127 2.621 7.707
2 HA TYR 45 HA TYR 45 0.081 0.947 8.520
3 HB2 TYR 45 HB2 TYR 45 0.957 0.934 6.284
4 HB3 TYR 45 HB3 TYR 45 2.564 0.524 6.859
5 HD1 TYR 45 HD1 TYR 45 -0.897 -0.876 6.864
6 HD2 TYR 45 HD2 TYR 45 3.282 -1.585 6.651
7 HE1 TYR 45 HE1 TYR 45 -1.330 -3.253 6.415
8 HE2 TYR 45 HE2 TYR 45 2.871 -3.956 6.204
9 HH TYR 45 HH TYR 45 -0.156 -5.167 5.351
No H/Q in entry = 9
In of MODEL 17
1 H ASP 46 H ASP 46 3.574 0.715 9.142
2 HA ASP 46 HA ASP 46 3.286 -1.741 10.579
3 HB2 ASP 46 HB2 ASP 46 5.480 -0.072 9.643
4 HB3 ASP 46 HB3 ASP 46 5.783 -0.726 11.249
No H/Q in entry = 4
In of MODEL 17
1 H GLU 47 H GLU 47 2.908 1.530 11.474
2 HA GLU 47 HA GLU 47 3.541 1.059 14.275
3 HB2 GLU 47 HB2 GLU 47 2.511 3.507 12.831
4 HB3 GLU 47 HB3 GLU 47 2.934 3.451 14.532
5 HG2 GLU 47 HG2 GLU 47 4.870 2.893 12.306
6 HG3 GLU 47 HG3 GLU 47 4.647 4.474 13.046
No H/Q in entry = 6
In of MODEL 17
1 H LEU 48 H LEU 48 1.062 0.142 12.436
2 HA LEU 48 HA LEU 48 -1.192 1.339 13.659
3 HB2 LEU 48 HB2 LEU 48 -0.794 -1.018 11.844
4 HB3 LEU 48 HB3 LEU 48 -2.380 -0.540 12.395
5 HG LEU 48 HG LEU 48 -0.507 1.186 10.797
6 HD11 LEU 48 HD11 LEU 48 -1.455 -0.654 9.504
7 HD12 LEU 48 HD12 LEU 48 -3.073 -0.189 10.030
8 HD13 LEU 48 HD13 LEU 48 -2.134 0.896 9.009
9 HD21 LEU 48 HD21 LEU 48 -3.267 1.646 11.890
10 HD22 LEU 48 HD22 LEU 48 -1.805 2.574 12.220
11 HD23 LEU 48 HD23 LEU 48 -2.545 2.636 10.619
No H/Q in entry = 11
In of MODEL 17
1 H GLU 49 H GLU 49 -2.819 -0.904 13.939
2 HA GLU 49 HA GLU 49 -2.037 -1.780 16.632
3 HB2 GLU 49 HB2 GLU 49 -4.770 -0.731 15.847
4 HB3 GLU 49 HB3 GLU 49 -4.303 -1.312 17.438
5 HG2 GLU 49 HG2 GLU 49 -3.038 1.061 16.094
6 HG3 GLU 49 HG3 GLU 49 -4.410 1.172 17.194
No H/Q in entry = 6
In of MODEL 17
1 H GLY 50 H GLY 50 -4.085 -3.377 17.328
2 HA2 GLY 50 HA2 GLY 50 -5.012 -5.451 16.981
3 HA3 GLY 50 HA3 GLY 50 -3.602 -5.737 15.982
No H/Q in entry = 3
In of MODEL 17
1 H ASP 51 H ASP 51 -6.788 -4.151 15.817
2 HA ASP 51 HA ASP 51 -7.350 -5.600 13.357
3 HB2 ASP 51 HB2 ASP 51 -9.066 -3.586 14.833
4 HB3 ASP 51 HB3 ASP 51 -9.591 -4.652 13.534
No H/Q in entry = 4
In of MODEL 17
1 H ALA 52 H ALA 52 -6.356 -2.422 14.339
2 HA ALA 52 HA ALA 52 -7.101 -0.962 12.040
3 HB1 ALA 52 HB1 ALA 52 -4.653 -0.568 13.768
4 HB2 ALA 52 HB2 ALA 52 -5.354 0.616 12.665
5 HB3 ALA 52 HB3 ALA 52 -6.252 0.100 14.093
No H/Q in entry = 5
In of MODEL 17
1 H LYS 53 H LYS 53 -4.207 -2.846 12.784
2 HA LYS 53 HA LYS 53 -2.832 -2.248 10.376
3 HB2 LYS 53 HB2 LYS 53 -1.981 -3.238 12.656
4 HB3 LYS 53 HB3 LYS 53 -2.400 -4.780 11.934
5 HG2 LYS 53 HG2 LYS 53 -0.582 -2.851 10.538
6 HG3 LYS 53 HG3 LYS 53 0.020 -3.959 11.770
7 HD2 LYS 53 HD2 LYS 53 -0.964 -5.836 10.434
8 HD3 LYS 53 HD3 LYS 53 -1.319 -4.661 9.166
9 HE2 LYS 53 HE2 LYS 53 1.039 -4.128 8.964
10 HE3 LYS 53 HE3 LYS 53 1.425 -5.221 10.288
11 HZ1 LYS 53 HZ1 LYS 53 0.465 -7.031 8.882
12 HZ2 LYS 53 HZ2 LYS 53 0.407 -5.931 7.595
13 HZ3 LYS 53 HZ3 LYS 53 1.895 -6.354 8.291
No H/Q in entry = 13
In of MODEL 17
1 H LYS 54 H LYS 54 -4.750 -5.010 11.481
2 HA LYS 54 HA LYS 54 -4.711 -6.547 9.172
3 HB2 LYS 54 HB2 LYS 54 -5.909 -7.837 10.515
4 HB3 LYS 54 HB3 LYS 54 -6.146 -6.496 11.622
5 HG2 LYS 54 HG2 LYS 54 -8.205 -5.972 10.770
6 HG3 LYS 54 HG3 LYS 54 -7.876 -6.723 9.205
7 HD2 LYS 54 HD2 LYS 54 -7.805 -8.926 10.443
8 HD3 LYS 54 HD3 LYS 54 -8.470 -8.066 11.834
9 HE2 LYS 54 HE2 LYS 54 -10.261 -9.129 10.611
10 HE3 LYS 54 HE3 LYS 54 -10.391 -7.377 10.444
11 HZ1 LYS 54 HZ1 LYS 54 -9.157 -9.173 8.425
12 HZ2 LYS 54 HZ2 LYS 54 -10.738 -8.583 8.343
13 HZ3 LYS 54 HZ3 LYS 54 -9.435 -7.512 8.260
No H/Q in entry = 13
In of MODEL 17
1 H GLU 55 H GLU 55 -6.939 -3.897 10.046
2 HA GLU 55 HA GLU 55 -8.519 -4.146 7.729
3 HB2 GLU 55 HB2 GLU 55 -8.137 -2.040 9.829
4 HB3 GLU 55 HB3 GLU 55 -9.114 -1.689 8.422
5 HG2 GLU 55 HG2 GLU 55 -10.397 -3.825 9.015
6 HG3 GLU 55 HG3 GLU 55 -9.584 -3.712 10.574
No H/Q in entry = 6
In of MODEL 17
1 H ALA 56 H ALA 56 -5.829 -1.952 8.562
2 HA ALA 56 HA ALA 56 -5.850 -0.615 6.116
3 HB1 ALA 56 HB1 ALA 56 -3.548 0.039 6.603
4 HB2 ALA 56 HB2 ALA 56 -3.457 -1.190 7.864
5 HB3 ALA 56 HB3 ALA 56 -4.556 0.177 8.043
No H/Q in entry = 5
In of MODEL 17
1 H THR 57 H THR 57 -3.999 -3.476 7.141
2 HA THR 57 HA THR 57 -2.575 -3.943 4.833
3 HB THR 57 HB THR 57 -3.802 -6.074 6.589
4 HG1 THR 57 HG1 THR 57 -2.567 -4.749 7.878
5 HG21 THR 57 HG21 THR 57 -1.455 -6.093 4.693
6 HG22 THR 57 HG22 THR 57 -1.821 -7.386 5.841
7 HG23 THR 57 HG23 THR 57 -2.955 -7.007 4.544
No H/Q in entry = 7
In of MODEL 17
1 H GLU 58 H GLU 58 -5.840 -4.985 5.648
2 HA GLU 58 HA GLU 58 -6.378 -6.402 3.263
3 HB2 GLU 58 HB2 GLU 58 -8.157 -5.104 5.323
4 HB3 GLU 58 HB3 GLU 58 -8.802 -5.969 3.931
5 HG2 GLU 58 HG2 GLU 58 -7.133 -7.056 6.177
6 HG3 GLU 58 HG3 GLU 58 -8.806 -7.445 5.786
No H/Q in entry = 6
In of MODEL 17
1 H HIS 59 H HIS 59 -6.509 -2.971 4.039
2 HA HIS 59 HA HIS 59 -8.033 -2.300 1.687
3 HB2 HIS 59 HB2 HIS 59 -6.509 -0.637 3.687
4 HB3 HIS 59 HB3 HIS 59 -7.208 0.070 2.237
5 HD1 HIS 59 HD1 HIS 59 -9.965 -0.913 2.081
6 HD2 HIS 59 HD2 HIS 59 -8.157 -0.144 5.746
7 HE1 HIS 59 HE1 HIS 59 -11.849 -0.542 3.702
8 HE2 HIS 59 HE2 HIS 59 -10.734 0.038 5.887
No H/Q in entry = 8
In of MODEL 17
1 H LEU 60 H LEU 60 -4.639 -1.855 2.684
2 HA LEU 60 HA LEU 60 -3.581 -1.106 0.266
3 HB2 LEU 60 HB2 LEU 60 -2.485 -2.640 2.589
4 HB3 LEU 60 HB3 LEU 60 -1.503 -2.349 1.166
5 HG LEU 60 HG LEU 60 -1.969 0.076 1.467
6 HD11 LEU 60 HD11 LEU 60 -3.936 -0.066 2.789
7 HD12 LEU 60 HD12 LEU 60 -3.015 -0.777 4.119
8 HD13 LEU 60 HD13 LEU 60 -2.696 0.883 3.610
9 HD21 LEU 60 HD21 LEU 60 -0.511 -1.334 3.685
10 HD22 LEU 60 HD22 LEU 60 0.161 -0.867 2.123
11 HD23 LEU 60 HD23 LEU 60 -0.332 0.373 3.275
No H/Q in entry = 11
In of MODEL 17
1 H LYS 61 H LYS 61 -4.519 -4.281 1.420
2 HA LYS 61 HA LYS 61 -3.167 -5.773 -0.581
3 HB2 LYS 61 HB2 LYS 61 -4.221 -6.482 1.729
4 HB3 LYS 61 HB3 LYS 61 -5.650 -6.772 0.753
5 HG2 LYS 61 HG2 LYS 61 -4.438 -8.353 -0.615
6 HG3 LYS 61 HG3 LYS 61 -2.949 -8.006 0.270
7 HD2 LYS 61 HD2 LYS 61 -5.453 -9.113 1.520
8 HD3 LYS 61 HD3 LYS 61 -4.085 -10.098 1.002
9 HE2 LYS 61 HE2 LYS 61 -2.635 -8.945 2.568
10 HE3 LYS 61 HE3 LYS 61 -3.954 -7.877 3.039
11 HZ1 LYS 61 HZ1 LYS 61 -4.007 -10.817 3.399
12 HZ2 LYS 61 HZ2 LYS 61 -3.540 -9.729 4.604
13 HZ3 LYS 61 HZ3 LYS 61 -5.124 -9.692 4.002
No H/Q in entry = 13
In of MODEL 17
1 H GLY 62 H GLY 62 -6.582 -4.806 -0.170
2 HA2 GLY 62 HA2 GLY 62 -8.171 -4.279 -1.739
3 HA3 GLY 62 HA3 GLY 62 -7.491 -5.588 -2.699
No H/Q in entry = 3
In of MODEL 17
1 H GLY 63 H GLY 63 -5.830 -2.651 -1.648
2 HA2 GLY 63 HA2 GLY 63 -4.646 -1.101 -2.851
3 HA3 GLY 63 HA3 GLY 63 -5.880 -1.267 -4.092
No H/Q in entry = 3
In of MODEL 17
1 H CYS 64 H CYS 64 -3.536 -3.596 -2.815
2 HA CYS 64 HA CYS 64 -1.853 -3.655 -5.073
3 HB2 CYS 64 HB2 CYS 64 -1.256 -4.574 -2.843
4 HB3 CYS 64 HB3 CYS 64 -2.430 -5.863 -3.085
No H/Q in entry = 4
In of MODEL 17
1 H ARG 65 H ARG 65 -4.794 -5.334 -4.227
2 HA ARG 65 HA ARG 65 -4.902 -7.157 -6.364
3 HB2 ARG 65 HB2 ARG 65 -6.305 -7.322 -4.365
4 HB3 ARG 65 HB3 ARG 65 -7.120 -5.828 -4.797
5 HG2 ARG 65 HG2 ARG 65 -8.035 -6.909 -6.789
6 HG3 ARG 65 HG3 ARG 65 -7.219 -8.409 -6.341
7 HD2 ARG 65 HD2 ARG 65 -8.492 -8.519 -4.281
8 HD3 ARG 65 HD3 ARG 65 -9.263 -6.978 -4.649
9 HE ARG 65 HE ARG 65 -9.822 -8.606 -6.790
10 HH11 ARG 65 HH11 ARG 65 -10.383 -8.661 -3.345
11 HH12 ARG 65 HH12 ARG 65 -11.846 -9.585 -3.462
12 HH21 ARG 65 HH21 ARG 65 -11.760 -9.820 -6.964
13 HH22 ARG 65 HH22 ARG 65 -12.630 -10.249 -5.525
No H/Q in entry = 13
In of MODEL 17
1 H GLU 66 H GLU 66 -5.360 -3.751 -6.214
2 HA GLU 66 HA GLU 66 -6.738 -3.635 -8.772
3 HB2 GLU 66 HB2 GLU 66 -5.785 -1.490 -6.871
4 HB3 GLU 66 HB3 GLU 66 -6.513 -1.140 -8.430
5 HG2 GLU 66 HG2 GLU 66 -7.854 -2.685 -6.232
6 HG3 GLU 66 HG3 GLU 66 -8.075 -0.965 -6.531
No H/Q in entry = 6
In of MODEL 17
1 H ILE 67 H ILE 67 -3.595 -2.879 -7.339
2 HA ILE 67 HA ILE 67 -2.575 -1.905 -9.853
3 HB ILE 67 HB ILE 67 -1.119 -2.421 -7.260
4 HG12 ILE 67 HG12 ILE 67 -2.012 0.195 -8.490
5 HG13 ILE 67 HG13 ILE 67 -2.853 -0.629 -7.182
6 HG21 ILE 67 HG21 ILE 67 0.361 -2.559 -9.230
7 HG22 ILE 67 HG22 ILE 67 -0.183 -0.951 -9.727
8 HG23 ILE 67 HG23 ILE 67 0.721 -1.146 -8.226
9 HD11 ILE 67 HD11 ILE 67 -0.043 0.442 -7.073
10 HD12 ILE 67 HD12 ILE 67 -1.470 1.180 -6.343
11 HD13 ILE 67 HD13 ILE 67 -0.888 -0.382 -5.761
No H/Q in entry = 11
In of MODEL 17
1 H LEU 68 H LEU 68 -1.346 -4.414 -7.643
2 HA LEU 68 HA LEU 68 0.506 -5.322 -9.561
3 HB2 LEU 68 HB2 LEU 68 0.684 -5.526 -7.048
4 HB3 LEU 68 HB3 LEU 68 -0.452 -6.857 -7.154
5 HG LEU 68 HG LEU 68 1.225 -7.929 -8.778
6 HD11 LEU 68 HD11 LEU 68 2.992 -5.847 -7.497
7 HD12 LEU 68 HD12 LEU 68 3.554 -7.218 -8.451
8 HD13 LEU 68 HD13 LEU 68 2.574 -5.962 -9.205
9 HD21 LEU 68 HD21 LEU 68 1.963 -7.568 -5.873
10 HD22 LEU 68 HD22 LEU 68 0.830 -8.754 -6.519
11 HD23 LEU 68 HD23 LEU 68 2.541 -8.854 -6.932
No H/Q in entry = 11
In of MODEL 17
1 H LYS 69 H LYS 69 -2.518 -6.724 -8.342
2 HA LYS 69 HA LYS 69 -2.508 -9.092 -9.749
3 HB2 LYS 69 HB2 LYS 69 -4.235 -8.660 -8.150
4 HB3 LYS 69 HB3 LYS 69 -4.758 -7.218 -9.001
5 HG2 LYS 69 HG2 LYS 69 -5.534 -8.639 -10.854
6 HG3 LYS 69 HG3 LYS 69 -5.104 -10.064 -9.910
7 HD2 LYS 69 HD2 LYS 69 -6.645 -9.312 -8.134
8 HD3 LYS 69 HD3 LYS 69 -7.115 -7.949 -9.147
9 HE2 LYS 69 HE2 LYS 69 -8.787 -9.610 -9.410
10 HE3 LYS 69 HE3 LYS 69 -7.826 -9.620 -10.884
11 HZ1 LYS 69 HZ1 LYS 69 -7.552 -11.535 -8.629
12 HZ2 LYS 69 HZ2 LYS 69 -8.304 -11.854 -10.112
13 HZ3 LYS 69 HZ3 LYS 69 -6.642 -11.551 -10.053
No H/Q in entry = 13
In of MODEL 17
1 H HIS 70 H HIS 70 -4.775 -6.646 -11.000
2 HA HIS 70 HA HIS 70 -4.707 -6.732 -13.575
3 HB2 HIS 70 HB2 HIS 70 -5.843 -4.927 -12.761
4 HB3 HIS 70 HB3 HIS 70 -4.534 -4.435 -11.707
5 HD1 HIS 70 HD1 HIS 70 -6.153 -3.638 -14.873
6 HD2 HIS 70 HD2 HIS 70 -2.423 -2.943 -13.130
7 HE1 HIS 70 HE1 HIS 70 -5.179 -1.684 -16.110
8 HE2 HIS 70 HE2 HIS 70 -3.033 -1.160 -14.907
No H/Q in entry = 8
In of MODEL 17
1 H VAL 71 H VAL 71 -1.740 -5.611 -11.903
2 HA VAL 71 HA VAL 71 -0.564 -4.584 -14.288
3 HB VAL 71 HB VAL 71 -0.105 -4.126 -11.720
4 HG11 VAL 71 HG11 VAL 71 0.939 -6.316 -11.331
5 HG12 VAL 71 HG12 VAL 71 2.234 -5.842 -12.432
6 HG13 VAL 71 HG13 VAL 71 1.958 -4.928 -10.941
7 HG21 VAL 71 HG21 VAL 71 1.887 -3.869 -13.920
8 HG22 VAL 71 HG22 VAL 71 0.596 -2.746 -13.503
9 HG23 VAL 71 HG23 VAL 71 1.939 -3.004 -12.386
No H/Q in entry = 9
In of MODEL 17
1 H VAL 72 H VAL 72 -0.075 -7.684 -12.550
2 HA VAL 72 HA VAL 72 1.276 -8.727 -14.910
3 HB VAL 72 HB VAL 72 1.693 -9.555 -12.532
4 HG11 VAL 72 HG11 VAL 72 -0.909 -10.948 -13.028
5 HG12 VAL 72 HG12 VAL 72 0.259 -11.445 -11.803
6 HG13 VAL 72 HG13 VAL 72 -0.503 -9.855 -11.705
7 HG21 VAL 72 HG21 VAL 72 2.568 -10.614 -14.531
8 HG22 VAL 72 HG22 VAL 72 2.202 -11.778 -13.262
9 HG23 VAL 72 HG23 VAL 72 1.108 -11.596 -14.634
No H/Q in entry = 9
In of MODEL 17
1 H GLY 73 H GLY 73 -1.889 -8.070 -14.018
2 HA2 GLY 73 HA2 GLY 73 -2.734 -9.440 -16.462
3 HA3 GLY 73 HA3 GLY 73 -3.559 -8.094 -15.694
No H/Q in entry = 3
In of MODEL 17
1 H GLU 74 H GLU 74 -5.458 -9.398 -16.053
2 HA GLU 74 HA GLU 74 -6.251 -10.698 -13.675
3 HB2 GLU 74 HB2 GLU 74 -8.367 -11.145 -14.895
4 HB3 GLU 74 HB3 GLU 74 -7.865 -9.460 -14.948
5 HG2 GLU 74 HG2 GLU 74 -6.964 -9.810 -17.184
6 HG3 GLU 74 HG3 GLU 74 -7.500 -11.486 -17.137
No H/Q in entry = 6
In of MODEL 17
1 H GLU 75 H GLU 75 -4.694 -11.866 -16.485
2 HA GLU 75 HA GLU 75 -5.510 -14.589 -16.314
3 HB2 GLU 75 HB2 GLU 75 -4.460 -13.933 -18.336
4 HB3 GLU 75 HB3 GLU 75 -3.078 -13.252 -17.487
5 HG2 GLU 75 HG2 GLU 75 -2.279 -15.408 -16.886
6 HG3 GLU 75 HG3 GLU 75 -3.756 -16.180 -17.469
No H/Q in entry = 6
In of MODEL 17
1 H LYS 76 H LYS 76 -2.395 -13.148 -15.375
2 HA LYS 76 HA LYS 76 -1.510 -15.531 -14.202
3 HB2 LYS 76 HB2 LYS 76 -0.442 -12.722 -13.829
4 HB3 LYS 76 HB3 LYS 76 0.399 -14.221 -13.480
5 HG2 LYS 76 HG2 LYS 76 -0.501 -13.303 -16.195
6 HG3 LYS 76 HG3 LYS 76 1.154 -13.325 -15.587
7 HD2 LYS 76 HD2 LYS 76 -0.591 -15.762 -15.929
8 HD3 LYS 76 HD3 LYS 76 0.644 -15.235 -17.074
9 HE2 LYS 76 HE2 LYS 76 2.364 -15.557 -15.430
10 HE3 LYS 76 HE3 LYS 76 1.171 -15.916 -14.189
11 HZ1 LYS 76 HZ1 LYS 76 0.512 -17.877 -15.459
12 HZ2 LYS 76 HZ2 LYS 76 1.712 -17.540 -16.611
13 HZ3 LYS 76 HZ3 LYS 76 2.150 -17.935 -15.028
No H/Q in entry = 13
In of MODEL 17
1 H ALA 77 H ALA 77 -2.784 -12.562 -12.793
2 HA ALA 77 HA ALA 77 -2.332 -13.285 -10.103
3 HB1 ALA 77 HB1 ALA 77 -4.380 -11.391 -11.241
4 HB2 ALA 77 HB2 ALA 77 -3.827 -11.456 -9.564
5 HB3 ALA 77 HB3 ALA 77 -2.708 -10.984 -10.844
No H/Q in entry = 5
In of MODEL 17
1 H ALA 78 H ALA 78 -4.837 -14.089 -12.376
2 HA ALA 78 HA ALA 78 -6.756 -15.003 -10.475
3 HB1 ALA 78 HB1 ALA 78 -7.522 -14.494 -12.672
4 HB2 ALA 78 HB2 ALA 78 -7.682 -16.238 -12.468
5 HB3 ALA 78 HB3 ALA 78 -6.338 -15.577 -13.404
No H/Q in entry = 5
In of MODEL 17
1 H GLU 79 H GLU 79 -4.175 -16.472 -12.355
2 HA GLU 79 HA GLU 79 -4.598 -19.138 -11.533
3 HB2 GLU 79 HB2 GLU 79 -1.947 -17.922 -12.307
4 HB3 GLU 79 HB3 GLU 79 -2.448 -19.598 -12.479
5 HG2 GLU 79 HG2 GLU 79 -4.127 -18.870 -14.135
6 HG3 GLU 79 HG3 GLU 79 -3.498 -17.232 -14.004
No H/Q in entry = 6
In of MODEL 17
1 H LEU 80 H LEU 80 -2.782 -16.456 -10.202
2 HA LEU 80 HA LEU 80 -1.477 -17.946 -8.150
3 HB2 LEU 80 HB2 LEU 80 -2.031 -14.997 -8.436
4 HB3 LEU 80 HB3 LEU 80 -0.977 -15.703 -7.223
5 HG LEU 80 HG LEU 80 -0.517 -16.078 -10.173
6 HD11 LEU 80 HD11 LEU 80 0.539 -13.926 -8.355
7 HD12 LEU 80 HD12 LEU 80 1.188 -14.303 -9.951
8 HD13 LEU 80 HD13 LEU 80 -0.466 -13.723 -9.788
9 HD21 LEU 80 HD21 LEU 80 1.259 -16.364 -7.755
10 HD22 LEU 80 HD22 LEU 80 0.563 -17.681 -8.699
11 HD23 LEU 80 HD23 LEU 80 1.752 -16.603 -9.432
No H/Q in entry = 11
In of MODEL 17
1 H LYS 81 H LYS 81 -4.386 -15.934 -8.290
2 HA LYS 81 HA LYS 81 -5.067 -16.121 -5.563
3 HB2 LYS 81 HB2 LYS 81 -6.021 -14.557 -7.355
4 HB3 LYS 81 HB3 LYS 81 -7.039 -15.901 -7.841
5 HG2 LYS 81 HG2 LYS 81 -7.023 -14.826 -5.036
6 HG3 LYS 81 HG3 LYS 81 -8.060 -14.168 -6.298
7 HD2 LYS 81 HD2 LYS 81 -8.998 -16.465 -6.614
8 HD3 LYS 81 HD3 LYS 81 -8.058 -16.985 -5.216
9 HE2 LYS 81 HE2 LYS 81 -10.361 -16.477 -4.591
10 HE3 LYS 81 HE3 LYS 81 -9.232 -15.370 -3.815
11 HZ1 LYS 81 HZ1 LYS 81 -9.754 -13.732 -5.542
12 HZ2 LYS 81 HZ2 LYS 81 -10.887 -14.792 -6.216
13 HZ3 LYS 81 HZ3 LYS 81 -11.126 -14.172 -4.659
No H/Q in entry = 13
In of MODEL 17
1 H ASN 82 H ASN 82 -5.953 -18.076 -8.389
2 HA ASN 82 HA ASN 82 -7.539 -19.904 -6.916
3 HB2 ASN 82 HB2 ASN 82 -7.714 -19.615 -9.393
4 HB3 ASN 82 HB3 ASN 82 -6.121 -20.337 -9.563
5 HD21 ASN 82 HD21 ASN 82 -9.462 -20.906 -8.914
6 HD22 ASN 82 HD22 ASN 82 -9.399 -22.629 -9.013
No H/Q in entry = 6
In of MODEL 17
1 H LEU 83 H LEU 83 -4.097 -19.857 -7.828
2 HA LEU 83 HA LEU 83 -3.332 -22.316 -6.872
3 HB2 LEU 83 HB2 LEU 83 -2.092 -19.856 -7.545
4 HB3 LEU 83 HB3 LEU 83 -1.472 -20.338 -5.983
5 HG LEU 83 HG LEU 83 -1.183 -22.649 -7.206
6 HD11 LEU 83 HD11 LEU 83 -2.203 -21.972 -9.289
7 HD12 LEU 83 HD12 LEU 83 -1.015 -20.681 -9.469
8 HD13 LEU 83 HD13 LEU 83 -0.501 -22.366 -9.530
9 HD21 LEU 83 HD21 LEU 83 0.695 -20.319 -7.546
10 HD22 LEU 83 HD22 LEU 83 0.614 -21.399 -6.154
11 HD23 LEU 83 HD23 LEU 83 1.133 -22.019 -7.722
No H/Q in entry = 11
In of MODEL 17
1 H LYS 84 H LYS 84 -3.604 -19.258 -5.093
2 HA LYS 84 HA LYS 84 -2.973 -20.168 -2.549
3 HB2 LYS 84 HB2 LYS 84 -3.214 -17.797 -3.188
4 HB3 LYS 84 HB3 LYS 84 -4.952 -18.016 -3.305
5 HG2 LYS 84 HG2 LYS 84 -5.078 -18.487 -0.930
6 HG3 LYS 84 HG3 LYS 84 -3.324 -18.344 -0.794
7 HD2 LYS 84 HD2 LYS 84 -3.461 -16.007 -1.506
8 HD3 LYS 84 HD3 LYS 84 -5.213 -16.153 -1.652
9 HE2 LYS 84 HE2 LYS 84 -5.393 -16.605 0.728
10 HE3 LYS 84 HE3 LYS 84 -3.639 -16.532 0.891
11 HZ1 LYS 84 HZ1 LYS 84 -3.725 -14.212 0.184
12 HZ2 LYS 84 HZ2 LYS 84 -5.410 -14.291 0.084
13 HZ3 LYS 84 HZ3 LYS 84 -4.643 -14.464 1.577
No H/Q in entry = 13
In of MODEL 17
1 H ASP 85 H ASP 85 -6.235 -19.779 -3.940
2 HA ASP 85 HA ASP 85 -7.625 -20.840 -1.736
3 HB2 ASP 85 HB2 ASP 85 -8.659 -19.445 -3.493
4 HB3 ASP 85 HB3 ASP 85 -8.475 -20.778 -4.631
No H/Q in entry = 4
In of MODEL 17
1 H SER 86 H SER 86 -6.127 -22.482 -4.471
2 HA SER 86 HA SER 86 -7.518 -24.928 -3.851
3 HB2 SER 86 HB2 SER 86 -5.988 -25.932 -5.586
4 HB3 SER 86 HB3 SER 86 -6.986 -24.597 -6.161
5 HG SER 86 HG SER 86 -5.260 -23.321 -6.289
No H/Q in entry = 5
In of MODEL 17
1 H GLY 87 H GLY 87 -4.938 -23.319 -2.520
2 HA2 GLY 87 HA2 GLY 87 -4.055 -25.817 -1.214
3 HA3 GLY 87 HA3 GLY 87 -4.235 -24.287 -0.370
No H/Q in entry = 3
In of MODEL 17
1 H ALA 88 H ALA 88 -2.978 -22.554 -2.136
2 HA ALA 88 HA ALA 88 -0.307 -23.618 -2.402
3 HB1 ALA 88 HB1 ALA 88 -1.176 -20.787 -2.923
4 HB2 ALA 88 HB2 ALA 88 -1.278 -22.087 -4.108
5 HB3 ALA 88 HB3 ALA 88 0.288 -21.580 -3.486
No H/Q in entry = 5
In of MODEL 17
1 H SER 89 H SER 89 1.155 -23.380 -0.870
2 HA SER 89 HA SER 89 0.687 -22.095 1.606
3 HB2 SER 89 HB2 SER 89 3.125 -22.645 1.981
4 HB3 SER 89 HB3 SER 89 2.107 -24.018 1.568
5 HG SER 89 HG SER 89 3.634 -24.306 0.126
No H/Q in entry = 5
In of MODEL 17
1 H LYS 90 H LYS 90 2.254 -20.436 2.520
2 HA LYS 90 HA LYS 90 2.061 -18.034 1.184
3 HB2 LYS 90 HB2 LYS 90 2.507 -18.057 3.530
4 HB3 LYS 90 HB3 LYS 90 4.005 -18.946 3.306
5 HG2 LYS 90 HG2 LYS 90 3.805 -16.304 1.992
6 HG3 LYS 90 HG3 LYS 90 3.929 -16.325 3.750
7 HD2 LYS 90 HD2 LYS 90 5.822 -17.876 2.000
8 HD3 LYS 90 HD3 LYS 90 6.107 -16.186 2.415
9 HE2 LYS 90 HE2 LYS 90 5.718 -18.409 4.417
10 HE3 LYS 90 HE3 LYS 90 7.282 -17.775 3.908
11 HZ1 LYS 90 HZ1 LYS 90 6.554 -15.578 4.721
12 HZ2 LYS 90 HZ2 LYS 90 5.141 -16.285 5.327
13 HZ3 LYS 90 HZ3 LYS 90 6.648 -16.736 5.947
No H/Q in entry = 13
In of MODEL 17
1 H GLU 91 H GLU 91 4.612 -20.415 1.040
2 HA GLU 91 HA GLU 91 6.541 -18.866 -0.352
3 HB2 GLU 91 HB2 GLU 91 6.180 -21.844 -0.133
4 HB3 GLU 91 HB3 GLU 91 7.596 -21.040 -0.800
5 HG2 GLU 91 HG2 GLU 91 7.870 -19.882 1.398
6 HG3 GLU 91 HG3 GLU 91 6.582 -20.903 2.029
No H/Q in entry = 6
In of MODEL 17
1 H GLU 92 H GLU 92 3.834 -20.816 -1.476
2 HA GLU 92 HA GLU 92 4.695 -21.012 -4.190
3 HB2 GLU 92 HB2 GLU 92 1.996 -21.310 -2.884
4 HB3 GLU 92 HB3 GLU 92 2.370 -21.754 -4.539
5 HG2 GLU 92 HG2 GLU 92 3.735 -22.921 -2.152
6 HG3 GLU 92 HG3 GLU 92 2.317 -23.614 -2.916
No H/Q in entry = 6
In of MODEL 17
1 H LEU 93 H LEU 93 2.654 -18.938 -2.253
2 HA LEU 93 HA LEU 93 2.010 -17.122 -4.346
3 HB2 LEU 93 HB2 LEU 93 2.211 -16.836 -1.348
4 HB3 LEU 93 HB3 LEU 93 1.782 -15.486 -2.378
5 HG LEU 93 HG LEU 93 -0.139 -16.643 -1.297
6 HD11 LEU 93 HD11 LEU 93 -0.448 -15.273 -3.296
7 HD12 LEU 93 HD12 LEU 93 -0.101 -16.673 -4.312
8 HD13 LEU 93 HD13 LEU 93 -1.548 -16.652 -3.306
9 HD21 LEU 93 HD21 LEU 93 0.547 -18.880 -3.169
10 HD22 LEU 93 HD22 LEU 93 0.584 -18.931 -1.406
11 HD23 LEU 93 HD23 LEU 93 -0.952 -18.735 -2.251
No H/Q in entry = 11
In of MODEL 17
1 H LYS 94 H LYS 94 4.772 -17.341 -2.051
2 HA LYS 94 HA LYS 94 5.655 -14.748 -2.796
3 HB2 LYS 94 HB2 LYS 94 6.172 -15.969 -0.629
4 HB3 LYS 94 HB3 LYS 94 7.372 -16.882 -1.534
5 HG2 LYS 94 HG2 LYS 94 8.574 -14.859 -2.064
6 HG3 LYS 94 HG3 LYS 94 7.336 -13.884 -1.272
7 HD2 LYS 94 HD2 LYS 94 9.209 -14.115 0.219
8 HD3 LYS 94 HD3 LYS 94 7.852 -15.041 0.860
9 HE2 LYS 94 HE2 LYS 94 9.951 -16.276 1.060
10 HE3 LYS 94 HE3 LYS 94 8.824 -17.097 -0.020
11 HZ1 LYS 94 HZ1 LYS 94 11.098 -15.390 -0.877
12 HZ2 LYS 94 HZ2 LYS 94 11.065 -17.079 -0.913
13 HZ3 LYS 94 HZ3 LYS 94 10.027 -16.195 -1.907
No H/Q in entry = 13
In of MODEL 17
1 H ALA 95 H ALA 95 6.363 -17.952 -3.894
2 HA ALA 95 HA ALA 95 8.545 -17.019 -5.556
3 HB1 ALA 95 HB1 ALA 95 7.388 -19.785 -5.221
4 HB2 ALA 95 HB2 ALA 95 8.775 -19.126 -4.349
5 HB3 ALA 95 HB3 ALA 95 8.868 -19.373 -6.091
No H/Q in entry = 5
In of MODEL 17
1 H LYS 96 H LYS 96 5.363 -18.636 -6.065
2 HA LYS 96 HA LYS 96 5.682 -18.679 -8.913
3 HB2 LYS 96 HB2 LYS 96 4.007 -19.923 -7.178
4 HB3 LYS 96 HB3 LYS 96 2.942 -18.687 -7.809
5 HG2 LYS 96 HG2 LYS 96 4.446 -20.667 -9.509
6 HG3 LYS 96 HG3 LYS 96 2.776 -20.859 -8.980
7 HD2 LYS 96 HD2 LYS 96 2.652 -18.402 -10.076
8 HD3 LYS 96 HD3 LYS 96 3.924 -19.119 -11.066
9 HE2 LYS 96 HE2 LYS 96 1.161 -20.251 -10.616
10 HE3 LYS 96 HE3 LYS 96 1.730 -19.453 -12.078
11 HZ1 LYS 96 HZ1 LYS 96 3.353 -21.232 -12.360
12 HZ2 LYS 96 HZ2 LYS 96 2.775 -22.003 -10.972
13 HZ3 LYS 96 HZ3 LYS 96 1.775 -21.840 -12.327
No H/Q in entry = 13
In of MODEL 17
1 H VAL 97 H VAL 97 4.697 -16.288 -6.668
2 HA VAL 97 HA VAL 97 3.237 -14.589 -8.412
3 HB VAL 97 HB VAL 97 3.662 -14.549 -5.752
4 HG11 VAL 97 HG11 VAL 97 5.408 -12.501 -7.003
5 HG12 VAL 97 HG12 VAL 97 4.848 -12.401 -5.331
6 HG13 VAL 97 HG13 VAL 97 5.863 -13.750 -5.853
7 HG21 VAL 97 HG21 VAL 97 2.863 -12.246 -7.509
8 HG22 VAL 97 HG22 VAL 97 1.801 -13.502 -6.871
9 HG23 VAL 97 HG23 VAL 97 2.566 -12.352 -5.774
No H/Q in entry = 9
In of MODEL 17
1 H GLU 98 H GLU 98 6.603 -15.060 -7.695
2 HA GLU 98 HA GLU 98 7.403 -12.689 -9.118
3 HB2 GLU 98 HB2 GLU 98 8.974 -14.900 -7.801
4 HB3 GLU 98 HB3 GLU 98 9.715 -13.518 -8.601
5 HG2 GLU 98 HG2 GLU 98 8.487 -12.021 -7.074
6 HG3 GLU 98 HG3 GLU 98 7.849 -13.427 -6.231
No H/Q in entry = 6
In of MODEL 17
1 H GLU 99 H GLU 99 6.841 -15.971 -9.869
2 HA GLU 99 HA GLU 99 8.242 -16.062 -12.350
3 HB2 GLU 99 HB2 GLU 99 5.672 -17.453 -11.548
4 HB3 GLU 99 HB3 GLU 99 6.674 -17.868 -12.930
5 HG2 GLU 99 HG2 GLU 99 7.550 -18.030 -10.056
6 HG3 GLU 99 HG3 GLU 99 6.968 -19.388 -11.019
No H/Q in entry = 6
In of MODEL 17
1 H ALA 100 H ALA 100 5.023 -15.092 -11.353
2 HA ALA 100 HA ALA 100 4.120 -14.341 -13.938
3 HB1 ALA 100 HB1 ALA 100 3.035 -13.299 -11.335
4 HB2 ALA 100 HB2 ALA 100 2.717 -14.938 -11.907
5 HB3 ALA 100 HB3 ALA 100 2.185 -13.558 -12.859
No H/Q in entry = 5
In of MODEL 17
1 H LEU 101 H LEU 101 5.375 -12.510 -11.160
2 HA LEU 101 HA LEU 101 5.244 -9.969 -12.352
3 HB2 LEU 101 HB2 LEU 101 7.107 -10.953 -10.198
4 HB3 LEU 101 HB3 LEU 101 6.834 -9.270 -10.604
5 HG LEU 101 HG LEU 101 4.793 -11.178 -9.466
6 HD11 LEU 101 HD11 LEU 101 6.454 -10.465 -7.844
7 HD12 LEU 101 HD12 LEU 101 6.164 -8.777 -8.270
8 HD13 LEU 101 HD13 LEU 101 4.889 -9.727 -7.507
9 HD21 LEU 101 HD21 LEU 101 4.541 -8.268 -10.211
10 HD22 LEU 101 HD22 LEU 101 3.731 -9.625 -10.995
11 HD23 LEU 101 HD23 LEU 101 3.337 -9.206 -9.329
No H/Q in entry = 11
In of MODEL 17
1 H HIS 102 H HIS 102 7.457 -12.548 -12.861
2 HA HIS 102 HA HIS 102 9.374 -10.837 -14.202
3 HB2 HIS 102 HB2 HIS 102 9.165 -13.749 -13.671
4 HB3 HIS 102 HB3 HIS 102 10.114 -13.231 -15.057
5 HD1 HIS 102 HD1 HIS 102 12.460 -13.529 -14.281
6 HD2 HIS 102 HD2 HIS 102 10.110 -11.562 -11.478
7 HE1 HIS 102 HE1 HIS 102 14.036 -12.814 -12.459
8 HE2 HIS 102 HE2 HIS 102 12.560 -11.794 -10.696
No H/Q in entry = 8
In of MODEL 17
1 H ALA 103 H ALA 103 6.758 -13.075 -15.045
2 HA ALA 103 HA ALA 103 7.366 -13.213 -17.765
3 HB1 ALA 103 HB1 ALA 103 4.670 -13.687 -16.509
4 HB2 ALA 103 HB2 ALA 103 6.013 -14.827 -16.401
5 HB3 ALA 103 HB3 ALA 103 5.321 -14.424 -17.977
No H/Q in entry = 5
In of MODEL 17
1 H VAL 104 H VAL 104 6.005 -10.605 -16.080
2 HA VAL 104 HA VAL 104 3.967 -9.882 -17.884
3 HB VAL 104 HB VAL 104 3.619 -9.065 -15.783
4 HG11 VAL 104 HG11 VAL 104 6.482 -8.196 -15.704
5 HG12 VAL 104 HG12 VAL 104 5.298 -7.862 -14.447
6 HG13 VAL 104 HG13 VAL 104 5.737 -9.522 -14.821
7 HG21 VAL 104 HG21 VAL 104 3.303 -7.269 -17.447
8 HG22 VAL 104 HG22 VAL 104 3.711 -6.655 -15.844
9 HG23 VAL 104 HG23 VAL 104 4.939 -6.709 -17.103
No H/Q in entry = 9
In of MODEL 17
1 H THR 105 H THR 105 6.872 -7.970 -17.190
2 HA THR 105 HA THR 105 8.499 -7.093 -18.457
3 HB THR 105 HB THR 105 9.089 -7.944 -20.607
4 HG1 THR 105 HG1 THR 105 6.438 -8.960 -20.663
5 HG21 THR 105 HG21 THR 105 9.540 -9.410 -18.712
6 HG22 THR 105 HG22 THR 105 7.957 -10.167 -18.912
7 HG23 THR 105 HG23 THR 105 9.187 -10.348 -20.164
No H/Q in entry = 7
In of MODEL 17
1 H ASP 106 H ASP 106 5.338 -6.334 -18.862
2 HA ASP 106 HA ASP 106 5.741 -4.353 -20.890
3 HB2 ASP 106 HB2 ASP 106 3.519 -4.903 -18.931
4 HB3 ASP 106 HB3 ASP 106 3.520 -3.465 -19.940
No H/Q in entry = 4
In of MODEL 17
1 H GLU 107 H GLU 107 6.198 -2.240 -20.652
2 HA GLU 107 HA GLU 107 8.097 -1.784 -18.685
3 HB2 GLU 107 HB2 GLU 107 8.132 0.578 -19.566
4 HB3 GLU 107 HB3 GLU 107 8.379 -0.690 -20.752
5 HG2 GLU 107 HG2 GLU 107 6.067 -0.464 -21.491
6 HG3 GLU 107 HG3 GLU 107 5.796 0.786 -20.276
No H/Q in entry = 6
In of MODEL 17
1 H GLU 108 H GLU 108 4.992 -0.029 -19.006
2 HA GLU 108 HA GLU 108 5.324 1.432 -16.627
3 HB2 GLU 108 HB2 GLU 108 2.923 1.940 -16.789
4 HB3 GLU 108 HB3 GLU 108 3.741 2.151 -18.329
5 HG2 GLU 108 HG2 GLU 108 2.847 0.072 -19.141
6 HG3 GLU 108 HG3 GLU 108 2.131 -0.272 -17.570
No H/Q in entry = 6
In of MODEL 17
1 H LYS 109 H LYS 109 3.851 -1.704 -17.276
2 HA LYS 109 HA LYS 109 2.705 -2.231 -14.800
3 HB2 LYS 109 HB2 LYS 109 3.891 -3.941 -16.942
4 HB3 LYS 109 HB3 LYS 109 3.427 -4.667 -15.415
5 HG2 LYS 109 HG2 LYS 109 1.735 -4.844 -17.202
6 HG3 LYS 109 HG3 LYS 109 1.155 -4.097 -15.726
7 HD2 LYS 109 HD2 LYS 109 1.125 -1.967 -16.702
8 HD3 LYS 109 HD3 LYS 109 2.102 -2.491 -18.079
9 HE2 LYS 109 HE2 LYS 109 -0.275 -2.210 -18.657
10 HE3 LYS 109 HE3 LYS 109 0.281 -3.865 -18.885
11 HZ1 LYS 109 HZ1 LYS 109 -1.208 -2.902 -16.509
12 HZ2 LYS 109 HZ2 LYS 109 -1.918 -3.692 -17.825
13 HZ3 LYS 109 HZ3 LYS 109 -0.790 -4.506 -16.859
No H/Q in entry = 13
In of MODEL 17
1 H LYS 110 H LYS 110 6.013 -2.837 -15.947
2 HA LYS 110 HA LYS 110 6.866 -3.965 -13.464
3 HB2 LYS 110 HB2 LYS 110 8.500 -2.942 -15.786
4 HB3 LYS 110 HB3 LYS 110 9.138 -3.862 -14.433
5 HG2 LYS 110 HG2 LYS 110 7.408 -5.651 -15.155
6 HG3 LYS 110 HG3 LYS 110 7.399 -4.760 -16.683
7 HD2 LYS 110 HD2 LYS 110 9.875 -5.841 -15.337
8 HD3 LYS 110 HD3 LYS 110 9.025 -6.636 -16.660
9 HE2 LYS 110 HE2 LYS 110 9.507 -4.815 -18.143
10 HE3 LYS 110 HE3 LYS 110 10.162 -3.851 -16.823
11 HZ1 LYS 110 HZ1 LYS 110 11.334 -6.404 -17.785
12 HZ2 LYS 110 HZ2 LYS 110 11.885 -4.867 -18.217
13 HZ3 LYS 110 HZ3 LYS 110 11.986 -5.379 -16.610
No H/Q in entry = 13
In of MODEL 17
1 H GLN 111 H GLN 111 6.536 -0.770 -14.591
2 HA GLN 111 HA GLN 111 8.357 0.496 -12.813
3 HB2 GLN 111 HB2 GLN 111 7.178 1.593 -14.758
4 HB3 GLN 111 HB3 GLN 111 5.710 1.585 -13.795
5 HG2 GLN 111 HG2 GLN 111 6.857 3.758 -13.786
6 HG3 GLN 111 HG3 GLN 111 6.701 3.058 -12.175
7 HE21 GLN 111 HE21 GLN 111 8.498 2.514 -11.043
8 HE22 GLN 111 HE22 GLN 111 10.110 2.859 -11.579
No H/Q in entry = 8
In of MODEL 17
1 H TYR 112 H TYR 112 5.007 -0.560 -12.562
2 HA TYR 112 HA TYR 112 4.601 0.273 -9.859
3 HB2 TYR 112 HB2 TYR 112 3.203 -1.840 -11.503
4 HB3 TYR 112 HB3 TYR 112 2.653 -1.272 -9.932
5 HD1 TYR 112 HD1 TYR 112 2.838 1.574 -10.030
6 HD2 TYR 112 HD2 TYR 112 1.775 -1.093 -13.165
7 HE1 TYR 112 HE1 TYR 112 1.593 3.375 -11.114
8 HE2 TYR 112 HE2 TYR 112 0.514 0.711 -14.267
9 HH TYR 112 HH TYR 112 -0.580 2.824 -13.672
No H/Q in entry = 9
In of MODEL 17
1 H ILE 113 H ILE 113 5.814 -2.653 -11.397
2 HA ILE 113 HA ILE 113 5.868 -4.252 -9.086
3 HB ILE 113 HB ILE 113 7.538 -4.409 -11.586
4 HG12 ILE 113 HG12 ILE 113 5.053 -5.870 -10.662
5 HG13 ILE 113 HG13 ILE 113 5.132 -4.662 -11.939
6 HG21 ILE 113 HG21 ILE 113 8.671 -5.542 -9.745
7 HG22 ILE 113 HG22 ILE 113 7.201 -6.450 -9.392
8 HG23 ILE 113 HG23 ILE 113 8.049 -6.707 -10.916
9 HD11 ILE 113 HD11 ILE 113 6.517 -7.325 -11.992
10 HD12 ILE 113 HD12 ILE 113 4.996 -6.946 -12.796
11 HD13 ILE 113 HD13 ILE 113 6.480 -6.133 -13.288
No H/Q in entry = 11
In of MODEL 17
1 H ALA 114 H ALA 114 8.256 -2.011 -10.446
2 HA ALA 114 HA ALA 114 10.284 -2.601 -8.497
3 HB1 ALA 114 HB1 ALA 114 10.872 -1.729 -10.690
4 HB2 ALA 114 HB2 ALA 114 11.426 -0.638 -9.421
5 HB3 ALA 114 HB3 ALA 114 9.981 -0.244 -10.355
No H/Q in entry = 5
In of MODEL 17
1 H ASP 115 H ASP 115 7.882 -0.026 -8.900
2 HA ASP 115 HA ASP 115 8.815 1.412 -6.607
3 HB2 ASP 115 HB2 ASP 115 6.332 1.673 -8.290
4 HB3 ASP 115 HB3 ASP 115 6.582 2.657 -6.853
No H/Q in entry = 4
In of MODEL 17
1 H PHE 116 H PHE 116 5.952 -0.536 -7.220
2 HA PHE 116 HA PHE 116 5.256 -0.263 -4.398
3 HB2 PHE 116 HB2 PHE 116 3.513 0.614 -5.688
4 HB3 PHE 116 HB3 PHE 116 3.659 -0.637 -6.911
5 HD1 PHE 116 HD1 PHE 116 2.685 -0.077 -3.401
6 HD2 PHE 116 HD2 PHE 116 2.190 -2.424 -6.911
7 HE1 PHE 116 HE1 PHE 116 0.822 -1.292 -2.327
8 HE2 PHE 116 HE2 PHE 116 0.335 -3.644 -5.850
9 HZ PHE 116 HZ PHE 116 -0.398 -3.077 -3.650
No H/Q in entry = 9
In of MODEL 17
1 H GLY 117 H GLY 117 6.252 -2.562 -6.722
2 HA2 GLY 117 HA2 GLY 117 6.602 -4.826 -6.648
3 HA3 GLY 117 HA3 GLY 117 4.993 -4.901 -5.967
No H/Q in entry = 3
In of MODEL 17
1 HA PRO 118 HA PRO 118 8.626 -6.203 -3.007
2 HB2 PRO 118 HB2 PRO 118 10.069 -4.108 -1.937
3 HB3 PRO 118 HB3 PRO 118 10.591 -5.088 -3.310
4 HG2 PRO 118 HG2 PRO 118 9.251 -2.412 -3.290
5 HG3 PRO 118 HG3 PRO 118 10.594 -2.983 -4.300
6 HD2 PRO 118 HD2 PRO 118 8.107 -2.844 -5.265
7 HD3 PRO 118 HD3 PRO 118 9.183 -4.189 -5.706
No H/Q in entry = 7
In of MODEL 17
1 H ALA 119 H ALA 119 6.880 -3.227 -2.551
2 HA ALA 119 HA ALA 119 6.636 -3.554 0.329
3 HB1 ALA 119 HB1 ALA 119 5.283 -1.510 0.187
4 HB2 ALA 119 HB2 ALA 119 5.419 -1.555 -1.570
5 HB3 ALA 119 HB3 ALA 119 6.860 -1.317 -0.580
No H/Q in entry = 5
In of MODEL 17
1 H CYS 120 H CYS 120 4.718 -3.990 -2.579
2 HA CYS 120 HA CYS 120 2.283 -4.702 -1.421
3 HB2 CYS 120 HB2 CYS 120 2.508 -4.348 -3.809
4 HB3 CYS 120 HB3 CYS 120 3.624 -5.703 -3.939
No H/Q in entry = 4
In of MODEL 17
1 H LYS 121 H LYS 121 5.296 -6.454 -1.725
2 HA LYS 121 HA LYS 121 4.429 -9.056 -1.237
3 HB2 LYS 121 HB2 LYS 121 6.888 -7.763 -1.455
4 HB3 LYS 121 HB3 LYS 121 6.898 -8.459 0.159
5 HG2 LYS 121 HG2 LYS 121 7.896 -10.005 -1.370
6 HG3 LYS 121 HG3 LYS 121 6.355 -10.657 -0.815
7 HD2 LYS 121 HD2 LYS 121 5.288 -10.053 -2.878
8 HD3 LYS 121 HD3 LYS 121 6.722 -9.180 -3.417
9 HE2 LYS 121 HE2 LYS 121 6.607 -12.145 -2.872
10 HE3 LYS 121 HE3 LYS 121 6.485 -11.408 -4.469
11 HZ1 LYS 121 HZ1 LYS 121 8.697 -10.485 -4.173
12 HZ2 LYS 121 HZ2 LYS 121 8.822 -11.195 -2.646
13 HZ3 LYS 121 HZ3 LYS 121 8.732 -12.173 -4.027
No H/Q in entry = 13
In of MODEL 17
1 H LYS 122 H LYS 122 5.572 -6.663 1.209
2 HA LYS 122 HA LYS 122 4.711 -8.254 3.395
3 HB2 LYS 122 HB2 LYS 122 4.978 -6.252 4.786
4 HB3 LYS 122 HB3 LYS 122 6.378 -6.547 3.771
5 HG2 LYS 122 HG2 LYS 122 5.537 -4.812 2.208
6 HG3 LYS 122 HG3 LYS 122 4.247 -4.465 3.363
7 HD2 LYS 122 HD2 LYS 122 7.202 -4.294 3.949
8 HD3 LYS 122 HD3 LYS 122 6.157 -2.921 3.587
9 HE2 LYS 122 HE2 LYS 122 4.865 -3.313 5.574
10 HE3 LYS 122 HE3 LYS 122 5.727 -4.816 5.893
11 HZ1 LYS 122 HZ1 LYS 122 7.025 -2.152 5.842
12 HZ2 LYS 122 HZ2 LYS 122 6.465 -2.901 7.255
13 HZ3 LYS 122 HZ3 LYS 122 7.709 -3.612 6.349
No H/Q in entry = 13
In of MODEL 17
1 H ILE 123 H ILE 123 3.047 -6.095 1.252
2 HA ILE 123 HA ILE 123 0.823 -5.545 2.890
3 HB ILE 123 HB ILE 123 1.101 -5.580 -0.088
4 HG12 ILE 123 HG12 ILE 123 0.826 -3.393 1.984
5 HG13 ILE 123 HG13 ILE 123 2.303 -3.831 1.130
6 HG21 ILE 123 HG21 ILE 123 -1.299 -4.794 1.559
7 HG22 ILE 123 HG22 ILE 123 -1.100 -4.468 -0.165
8 HG23 ILE 123 HG23 ILE 123 -1.206 -6.132 0.413
9 HD11 ILE 123 HD11 ILE 123 -0.178 -2.790 -0.189
10 HD12 ILE 123 HD12 ILE 123 1.206 -1.802 0.271
11 HD13 ILE 123 HD13 ILE 123 1.389 -3.067 -0.939
No H/Q in entry = 11
In of MODEL 17
1 H TYR 124 H TYR 124 1.284 -7.918 0.385
2 HA TYR 124 HA TYR 124 -0.962 -9.575 0.999
3 HB2 TYR 124 HB2 TYR 124 1.312 -9.623 -0.879
4 HB3 TYR 124 HB3 TYR 124 0.732 -11.204 -0.374
5 HD1 TYR 124 HD1 TYR 124 -0.358 -8.000 -1.907
6 HD2 TYR 124 HD2 TYR 124 -1.204 -12.125 -1.320
7 HE1 TYR 124 HE1 TYR 124 -2.167 -7.864 -3.569
8 HE2 TYR 124 HE2 TYR 124 -3.017 -11.999 -2.978
9 HH TYR 124 HH TYR 124 -3.397 -9.356 -5.074
No H/Q in entry = 9
In of MODEL 17
1 H GLY 125 H GLY 125 0.634 -9.050 3.314
2 HA2 GLY 125 HA2 GLY 125 1.960 -10.071 4.973
3 HA3 GLY 125 HA3 GLY 125 3.068 -9.504 3.759
No H/Q in entry = 3
In of MODEL 17
1 H VAL 126 H VAL 126 2.262 -11.784 1.969
2 HA VAL 126 HA VAL 126 3.228 -14.190 2.900
3 HB VAL 126 HB VAL 126 4.214 -14.510 0.605
4 HG11 VAL 126 HG11 VAL 126 1.397 -13.445 0.736
5 HG12 VAL 126 HG12 VAL 126 2.056 -14.443 -0.559
6 HG13 VAL 126 HG13 VAL 126 1.903 -15.100 1.070
7 HG21 VAL 126 HG21 VAL 126 4.869 -12.176 0.188
8 HG22 VAL 126 HG22 VAL 126 3.817 -12.790 -1.088
9 HG23 VAL 126 HG23 VAL 126 3.168 -11.711 0.147
No H/Q in entry = 9
In of MODEL 17
1 H HIS 127 H HIS 127 5.014 -11.252 2.121
2 HA HIS 127 HA HIS 127 7.568 -12.498 2.696
3 HB2 HIS 127 HB2 HIS 127 7.385 -10.698 0.985
4 HB3 HIS 127 HB3 HIS 127 6.903 -9.573 2.248
5 HD1 HIS 127 HD1 HIS 127 8.754 -8.363 3.440
6 HD2 HIS 127 HD2 HIS 127 10.125 -11.652 1.291
7 HE1 HIS 127 HE1 HIS 127 11.262 -8.258 3.564
8 HE2 HIS 127 HE2 HIS 127 12.062 -10.340 2.393
No H/Q in entry = 8
In of MODEL 17
1 H THR 128 H THR 128 7.295 -13.197 4.821
2 HA THR 128 HA THR 128 6.421 -11.616 6.963
3 HB THR 128 HB THR 128 8.422 -13.886 7.052
4 HG1 THR 128 HG1 THR 128 5.586 -13.802 6.933
5 HG21 THR 128 HG21 THR 128 8.293 -12.577 9.132
6 HG22 THR 128 HG22 THR 128 6.548 -12.822 9.169
7 HG23 THR 128 HG23 THR 128 7.636 -14.200 9.343
No H/Q in entry = 7
In of MODEL 17
1 H SER 129 H SER 129 7.272 -9.644 7.190
2 HA SER 129 HA SER 129 10.099 -9.209 6.733
3 HB2 SER 129 HB2 SER 129 7.934 -7.212 7.438
4 HB3 SER 129 HB3 SER 129 9.542 -6.847 6.808
5 HG SER 129 HG SER 129 7.624 -8.436 5.437
No H/Q in entry = 5
In of MODEL 18
1 HA2 GLY -4 HA2 GLY -4 -16.181 8.832 -24.838
2 HA3 GLY -4 HA3 GLY -4 -17.085 9.051 -23.347
3 H1 GLY -4 H1 GLY -4 -17.925 10.469 -25.102
4 H2 GLY -4 H2 GLY -4 -16.408 11.194 -25.278
No H/Q in entry = 4
In of MODEL 18
1 H SER -3 H SER -3 -14.833 7.930 -22.895
2 HA SER -3 HA SER -3 -12.896 8.003 -21.734
3 HB2 SER -3 HB2 SER -3 -11.940 9.039 -23.734
4 HB3 SER -3 HB3 SER -3 -12.478 10.627 -23.187
5 HG SER -3 HG SER -3 -11.137 10.065 -21.229
No H/Q in entry = 5
In of MODEL 18
1 HA PRO -2 HA PRO -2 -14.762 10.586 -18.420
2 HB2 PRO -2 HB2 PRO -2 -13.983 8.273 -16.785
3 HB3 PRO -2 HB3 PRO -2 -15.568 9.029 -16.963
4 HG2 PRO -2 HG2 PRO -2 -15.029 6.598 -17.987
5 HG3 PRO -2 HG3 PRO -2 -16.124 7.736 -18.794
6 HD2 PRO -2 HD2 PRO -2 -13.259 7.106 -19.405
7 HD3 PRO -2 HD3 PRO -2 -14.623 7.340 -20.520
No H/Q in entry = 7
In of MODEL 18
1 H GLU -1 H GLU -1 -13.716 10.878 -16.105
2 HA GLU -1 HA GLU -1 -11.019 11.722 -16.530
3 HB2 GLU -1 HB2 GLU -1 -12.648 12.908 -15.040
4 HB3 GLU -1 HB3 GLU -1 -12.539 11.556 -13.922
5 HG2 GLU -1 HG2 GLU -1 -11.143 13.514 -13.309
6 HG3 GLU -1 HG3 GLU -1 -10.244 12.007 -13.478
No H/Q in entry = 6
In of MODEL 18
1 H PHE 0 H PHE 0 -9.891 9.868 -17.044
2 HA PHE 0 HA PHE 0 -9.956 7.580 -15.322
3 HB2 PHE 0 HB2 PHE 0 -8.308 6.616 -16.874
4 HB3 PHE 0 HB3 PHE 0 -9.738 7.222 -17.699
5 HD1 PHE 0 HD1 PHE 0 -9.625 9.341 -18.937
6 HD2 PHE 0 HD2 PHE 0 -6.171 7.489 -17.315
7 HE1 PHE 0 HE1 PHE 0 -8.209 10.703 -20.428
8 HE2 PHE 0 HE2 PHE 0 -4.737 8.840 -18.793
9 HZ PHE 0 HZ PHE 0 -5.757 10.450 -20.353
No H/Q in entry = 9
In of MODEL 18
1 H HIS 1 H HIS 1 -8.463 6.869 -13.949
2 HA HIS 1 HA HIS 1 -5.859 8.079 -13.748
3 HB2 HIS 1 HB2 HIS 1 -6.143 8.524 -11.267
4 HB3 HIS 1 HB3 HIS 1 -6.973 9.648 -12.329
5 HD1 HIS 1 HD1 HIS 1 -7.528 7.248 -9.592
6 HD2 HIS 1 HD2 HIS 1 -9.832 9.327 -12.360
7 HE1 HIS 1 HE1 HIS 1 -9.891 7.119 -8.742
8 HE2 HIS 1 HE2 HIS 1 -11.239 8.520 -10.344
No H/Q in entry = 8
In of MODEL 18
1 H HIS 2 H HIS 2 -4.953 6.166 -14.140
2 HA HIS 2 HA HIS 2 -5.934 3.665 -13.340
3 HB2 HIS 2 HB2 HIS 2 -3.075 4.381 -14.021
4 HB3 HIS 2 HB3 HIS 2 -3.755 2.762 -13.997
5 HD1 HIS 2 HD1 HIS 2 -2.484 4.563 -16.431
6 HD2 HIS 2 HD2 HIS 2 -6.428 3.386 -15.851
7 HE1 HIS 2 HE1 HIS 2 -3.547 4.627 -18.706
8 HE2 HIS 2 HE2 HIS 2 -5.963 4.032 -18.316
No H/Q in entry = 8
In of MODEL 18
1 H PHE 3 H PHE 3 -2.861 5.077 -12.222
2 HA PHE 3 HA PHE 3 -3.539 4.253 -9.504
3 HB2 PHE 3 HB2 PHE 3 -0.997 3.460 -10.944
4 HB3 PHE 3 HB3 PHE 3 -1.260 3.275 -9.211
5 HD1 PHE 3 HD1 PHE 3 -3.170 1.799 -8.441
6 HD2 PHE 3 HD2 PHE 3 -1.738 1.830 -12.448
7 HE1 PHE 3 HE1 PHE 3 -4.230 -0.385 -8.835
8 HE2 PHE 3 HE2 PHE 3 -2.793 -0.353 -12.848
9 HZ PHE 3 HZ PHE 3 -4.043 -1.464 -11.041
No H/Q in entry = 9
In of MODEL 18
1 H THR 4 H THR 4 -3.824 6.462 -9.154
2 HA THR 4 HA THR 4 -1.322 8.008 -9.032
3 HB THR 4 HB THR 4 -2.706 10.051 -8.972
4 HG1 THR 4 HG1 THR 4 -4.925 9.935 -9.245
5 HG21 THR 4 HG21 THR 4 -3.327 8.266 -11.330
6 HG22 THR 4 HG22 THR 4 -3.481 10.023 -11.305
7 HG23 THR 4 HG23 THR 4 -1.893 9.274 -11.139
No H/Q in entry = 7
In of MODEL 18
1 H LEU 5 H LEU 5 -0.908 9.099 -7.007
2 HA LEU 5 HA LEU 5 -1.341 7.651 -4.768
3 HB2 LEU 5 HB2 LEU 5 0.283 9.454 -4.923
4 HB3 LEU 5 HB3 LEU 5 -1.008 10.641 -4.908
5 HG LEU 5 HG LEU 5 -1.632 9.821 -2.616
6 HD11 LEU 5 HD11 LEU 5 0.990 8.352 -2.850
7 HD12 LEU 5 HD12 LEU 5 0.056 8.555 -1.369
8 HD13 LEU 5 HD13 LEU 5 -0.609 7.624 -2.710
9 HD21 LEU 5 HD21 LEU 5 -0.340 11.859 -2.946
10 HD22 LEU 5 HD22 LEU 5 0.184 11.006 -1.495
11 HD23 LEU 5 HD23 LEU 5 1.152 10.920 -2.965
No H/Q in entry = 11
In of MODEL 18
1 H GLU 6 H GLU 6 -3.217 10.606 -5.507
2 HA GLU 6 HA GLU 6 -5.116 10.560 -3.546
3 HB2 GLU 6 HB2 GLU 6 -4.968 12.242 -5.379
4 HB3 GLU 6 HB3 GLU 6 -5.744 11.083 -6.451
5 HG2 GLU 6 HG2 GLU 6 -7.673 11.039 -4.874
6 HG3 GLU 6 HG3 GLU 6 -6.908 12.362 -3.997
No H/Q in entry = 6
In of MODEL 18
1 H SER 7 H SER 7 -4.934 8.283 -6.281
2 HA SER 7 HA SER 7 -7.631 7.576 -6.365
3 HB2 SER 7 HB2 SER 7 -5.194 5.964 -7.111
4 HB3 SER 7 HB3 SER 7 -6.848 5.477 -7.481
5 HG SER 7 HG SER 7 -5.479 7.805 -8.384
No H/Q in entry = 5
In of MODEL 18
1 H SER 8 H SER 8 -5.424 6.813 -3.848
2 HA SER 8 HA SER 8 -6.967 4.440 -3.147
3 HB2 SER 8 HB2 SER 8 -5.190 4.077 -1.410
4 HB3 SER 8 HB3 SER 8 -4.659 4.006 -3.096
5 HG SER 8 HG SER 8 -3.838 6.098 -2.902
No H/Q in entry = 5
In of MODEL 18
1 H LEU 9 H LEU 9 -6.692 7.729 -2.123
2 HA LEU 9 HA LEU 9 -6.657 7.565 0.560
3 HB2 LEU 9 HB2 LEU 9 -7.751 9.620 -1.285
4 HB3 LEU 9 HB3 LEU 9 -7.803 9.849 0.452
5 HG LEU 9 HG LEU 9 -5.866 10.932 -0.566
6 HD11 LEU 9 HD11 LEU 9 -5.739 10.103 1.741
7 HD12 LEU 9 HD12 LEU 9 -5.088 8.581 1.134
8 HD13 LEU 9 HD13 LEU 9 -4.167 10.079 0.941
9 HD21 LEU 9 HD21 LEU 9 -5.572 9.273 -2.394
10 HD22 LEU 9 HD22 LEU 9 -4.088 9.780 -1.579
11 HD23 LEU 9 HD23 LEU 9 -4.813 8.217 -1.202
No H/Q in entry = 11
In of MODEL 18
1 H ASP 10 H ASP 10 -9.581 7.399 -1.332
2 HA ASP 10 HA ASP 10 -11.150 7.095 1.120
3 HB2 ASP 10 HB2 ASP 10 -11.891 7.534 -1.757
4 HB3 ASP 10 HB3 ASP 10 -13.087 6.991 -0.586
No H/Q in entry = 4
In of MODEL 18
1 H THR 11 H THR 11 -9.393 5.112 -0.755
2 HA THR 11 HA THR 11 -11.203 2.879 -0.198
3 HB THR 11 HB THR 11 -10.087 1.716 -2.179
4 HG1 THR 11 HG1 THR 11 -9.672 3.965 -3.581
5 HG21 THR 11 HG21 THR 11 -11.865 4.104 -2.692
6 HG22 THR 11 HG22 THR 11 -11.622 2.747 -3.795
7 HG23 THR 11 HG23 THR 11 -12.402 2.488 -2.234
No H/Q in entry = 7
In of MODEL 18
1 H HIS 12 H HIS 12 -8.069 2.493 -1.593
2 HA HIS 12 HA HIS 12 -7.288 0.603 0.283
3 HB2 HIS 12 HB2 HIS 12 -5.363 2.146 -1.432
4 HB3 HIS 12 HB3 HIS 12 -5.188 0.501 -0.833
5 HD1 HIS 12 HD1 HIS 12 -7.672 -0.883 -1.703
6 HD2 HIS 12 HD2 HIS 12 -5.799 1.965 -4.089
7 HE1 HIS 12 HE1 HIS 12 -8.463 -1.333 -4.048
8 HE2 HIS 12 HE2 HIS 12 -7.443 0.501 -5.443
No H/Q in entry = 8
In of MODEL 18
1 H LEU 13 H LEU 13 -6.723 4.071 0.248
2 HA LEU 13 HA LEU 13 -4.967 3.719 2.587
3 HB2 LEU 13 HB2 LEU 13 -5.005 5.821 0.463
4 HB3 LEU 13 HB3 LEU 13 -4.223 6.086 2.008
5 HG LEU 13 HG LEU 13 -3.499 4.029 -0.074
6 HD11 LEU 13 HD11 LEU 13 -2.686 6.288 -0.493
7 HD12 LEU 13 HD12 LEU 13 -1.966 6.335 1.116
8 HD13 LEU 13 HD13 LEU 13 -1.361 5.199 -0.088
9 HD21 LEU 13 HD21 LEU 13 -2.467 4.344 2.739
10 HD22 LEU 13 HD22 LEU 13 -3.270 2.934 2.045
11 HD23 LEU 13 HD23 LEU 13 -1.665 3.400 1.486
No H/Q in entry = 11
In of MODEL 18
1 H LYS 14 H LYS 14 -7.906 3.913 2.509
2 HA LYS 14 HA LYS 14 -8.726 6.477 3.389
3 HB2 LYS 14 HB2 LYS 14 -10.852 5.419 3.921
4 HB3 LYS 14 HB3 LYS 14 -10.278 4.920 2.342
5 HG2 LYS 14 HG2 LYS 14 -9.514 2.800 3.299
6 HG3 LYS 14 HG3 LYS 14 -10.115 3.308 4.881
7 HD2 LYS 14 HD2 LYS 14 -12.369 3.370 4.069
8 HD3 LYS 14 HD3 LYS 14 -11.832 3.089 2.415
9 HE2 LYS 14 HE2 LYS 14 -11.026 0.874 3.049
10 HE3 LYS 14 HE3 LYS 14 -11.547 1.157 4.711
11 HZ1 LYS 14 HZ1 LYS 14 -13.356 1.119 2.356
12 HZ2 LYS 14 HZ2 LYS 14 -13.137 -0.174 3.426
13 HZ3 LYS 14 HZ3 LYS 14 -13.819 1.274 3.976
No H/Q in entry = 13
In of MODEL 18
1 H TRP 15 H TRP 15 -7.213 3.894 4.992
2 HA TRP 15 HA TRP 15 -8.215 4.410 7.626
3 HB2 TRP 15 HB2 TRP 15 -6.368 2.882 8.328
4 HB3 TRP 15 HB3 TRP 15 -7.413 2.190 7.088
5 HD1 TRP 15 HD1 TRP 15 -6.395 1.975 4.611
6 HE1 TRP 15 HE1 TRP 15 -3.967 1.844 3.771
7 HE3 TRP 15 HE3 TRP 15 -3.997 3.669 8.796
8 HZ2 TRP 15 HZ2 TRP 15 -1.377 2.372 4.760
9 HZ3 TRP 15 HZ3 TRP 15 -1.542 3.821 8.768
10 HH2 TRP 15 HH2 TRP 15 -0.259 3.186 6.789
No H/Q in entry = 10
In of MODEL 18
1 H LEU 16 H LEU 16 -6.079 6.033 5.615
2 HA LEU 16 HA LEU 16 -4.283 7.036 7.631
3 HB2 LEU 16 HB2 LEU 16 -4.952 8.109 4.881
4 HB3 LEU 16 HB3 LEU 16 -3.675 8.717 5.907
5 HG LEU 16 HG LEU 16 -3.741 5.907 4.798
6 HD11 LEU 16 HD11 LEU 16 -3.599 7.627 3.029
7 HD12 LEU 16 HD12 LEU 16 -2.178 8.294 3.829
8 HD13 LEU 16 HD13 LEU 16 -2.131 6.660 3.166
9 HD21 LEU 16 HD21 LEU 16 -1.573 7.515 6.150
10 HD22 LEU 16 HD22 LEU 16 -2.372 6.077 6.788
11 HD23 LEU 16 HD23 LEU 16 -1.329 5.952 5.366
No H/Q in entry = 11
In of MODEL 18
1 H SER 17 H SER 17 -4.374 8.982 8.647
2 HA SER 17 HA SER 17 -7.003 10.153 8.927
3 HB2 SER 17 HB2 SER 17 -4.412 11.038 10.200
4 HB3 SER 17 HB3 SER 17 -6.043 11.452 10.720
5 HG SER 17 HG SER 17 -4.680 9.539 11.673
No H/Q in entry = 5
In of MODEL 18
1 H GLN 18 H GLN 18 -7.290 12.569 8.739
2 HA GLN 18 HA GLN 18 -6.721 13.333 6.127
3 HB2 GLN 18 HB2 GLN 18 -8.557 14.264 7.530
4 HB3 GLN 18 HB3 GLN 18 -7.359 15.190 8.422
5 HG2 GLN 18 HG2 GLN 18 -8.521 16.528 6.728
6 HG3 GLN 18 HG3 GLN 18 -6.783 16.437 6.445
7 HE21 GLN 18 HE21 GLN 18 -7.054 16.956 4.269
8 HE22 GLN 18 HE22 GLN 18 -7.674 15.814 3.125
No H/Q in entry = 8
In of MODEL 18
1 H GLU 19 H GLU 19 -5.086 14.296 9.132
2 HA GLU 19 HA GLU 19 -3.286 16.092 8.040
3 HB2 GLU 19 HB2 GLU 19 -3.006 14.203 10.373
4 HB3 GLU 19 HB3 GLU 19 -1.882 15.479 10.003
5 HG2 GLU 19 HG2 GLU 19 -3.688 17.129 10.276
6 HG3 GLU 19 HG3 GLU 19 -4.759 15.812 10.750
No H/Q in entry = 6
In of MODEL 18
1 H GLN 20 H GLN 20 -3.154 12.559 8.219
2 HA GLN 20 HA GLN 20 -0.468 12.385 7.256
3 HB2 GLN 20 HB2 GLN 20 -2.590 10.238 7.075
4 HB3 GLN 20 HB3 GLN 20 -0.848 10.016 7.077
5 HG2 GLN 20 HG2 GLN 20 -0.758 10.813 9.390
6 HG3 GLN 20 HG3 GLN 20 -2.511 10.996 9.384
7 HE21 GLN 20 HE21 GLN 20 0.132 8.802 9.573
8 HE22 GLN 20 HE22 GLN 20 -0.792 7.388 9.945
No H/Q in entry = 8
In of MODEL 18
1 H LYS 21 H LYS 21 -3.688 12.169 5.793
2 HA LYS 21 HA LYS 21 -2.900 11.577 3.177
3 HB2 LYS 21 HB2 LYS 21 -5.253 13.232 4.109
4 HB3 LYS 21 HB3 LYS 21 -5.072 12.533 2.506
5 HG2 LYS 21 HG2 LYS 21 -5.044 10.282 3.546
6 HG3 LYS 21 HG3 LYS 21 -5.369 11.043 5.103
7 HD2 LYS 21 HD2 LYS 21 -7.493 11.799 4.408
8 HD3 LYS 21 HD3 LYS 21 -7.147 11.456 2.712
9 HE2 LYS 21 HE2 LYS 21 -7.126 9.070 3.177
10 HE3 LYS 21 HE3 LYS 21 -7.401 9.384 4.892
11 HZ1 LYS 21 HZ1 LYS 21 -9.278 10.154 2.727
12 HZ2 LYS 21 HZ2 LYS 21 -9.431 8.762 3.666
13 HZ3 LYS 21 HZ3 LYS 21 -9.550 10.285 4.385
No H/Q in entry = 13
In of MODEL 18
1 H ASP 22 H ASP 22 -3.570 14.711 4.683
2 HA ASP 22 HA ASP 22 -2.831 16.319 2.489
3 HB2 ASP 22 HB2 ASP 22 -4.174 17.010 4.517
4 HB3 ASP 22 HB3 ASP 22 -2.659 17.069 5.411
No H/Q in entry = 4
In of MODEL 18
1 H GLU 23 H GLU 23 -0.955 15.018 5.220
2 HA GLU 23 HA GLU 23 1.508 16.182 4.707
3 HB2 GLU 23 HB2 GLU 23 0.501 14.352 6.448
4 HB3 GLU 23 HB3 GLU 23 1.495 13.328 5.419
5 HG2 GLU 23 HG2 GLU 23 3.436 14.442 5.978
6 HG3 GLU 23 HG3 GLU 23 2.553 15.849 6.567
No H/Q in entry = 6
In of MODEL 18
1 H LEU 24 H LEU 24 0.279 13.051 3.442
2 HA LEU 24 HA LEU 24 2.493 12.619 1.772
3 HB2 LEU 24 HB2 LEU 24 -0.236 11.470 2.092
4 HB3 LEU 24 HB3 LEU 24 0.687 11.050 0.665
5 HG LEU 24 HG LEU 24 2.417 10.079 1.993
6 HD11 LEU 24 HD11 LEU 24 2.158 11.756 3.884
7 HD12 LEU 24 HD12 LEU 24 0.977 10.614 4.527
8 HD13 LEU 24 HD13 LEU 24 2.650 10.103 4.264
9 HD21 LEU 24 HD21 LEU 24 -0.286 9.214 2.955
10 HD22 LEU 24 HD22 LEU 24 0.536 8.655 1.497
11 HD23 LEU 24 HD23 LEU 24 1.194 8.264 3.087
No H/Q in entry = 11
In of MODEL 18
1 H LEU 25 H LEU 25 -0.701 14.060 1.158
2 HA LEU 25 HA LEU 25 -0.432 14.392 -1.611
3 HB2 LEU 25 HB2 LEU 25 -1.909 16.088 0.401
4 HB3 LEU 25 HB3 LEU 25 -2.082 16.237 -1.333
5 HG LEU 25 HG LEU 25 -2.811 13.809 0.303
6 HD11 LEU 25 HD11 LEU 25 -4.336 15.673 0.644
7 HD12 LEU 25 HD12 LEU 25 -4.537 15.840 -1.099
8 HD13 LEU 25 HD13 LEU 25 -5.107 14.386 -0.281
9 HD21 LEU 25 HD21 LEU 25 -3.112 14.350 -2.647
10 HD22 LEU 25 HD22 LEU 25 -2.053 13.155 -1.904
11 HD23 LEU 25 HD23 LEU 25 -3.802 12.976 -1.789
No H/Q in entry = 11
In of MODEL 18
1 H LYS 26 H LYS 26 0.638 16.357 1.090
2 HA LYS 26 HA LYS 26 1.601 18.582 -0.370
3 HB2 LYS 26 HB2 LYS 26 1.217 18.513 2.105
4 HB3 LYS 26 HB3 LYS 26 2.639 17.492 2.250
5 HG2 LYS 26 HG2 LYS 26 3.339 19.669 2.796
6 HG3 LYS 26 HG3 LYS 26 3.945 19.360 1.170
7 HD2 LYS 26 HD2 LYS 26 3.036 21.593 1.277
8 HD3 LYS 26 HD3 LYS 26 2.001 20.593 0.256
9 HE2 LYS 26 HE2 LYS 26 0.416 20.325 2.057
10 HE3 LYS 26 HE3 LYS 26 1.478 21.186 3.169
11 HZ1 LYS 26 HZ1 LYS 26 0.262 22.376 0.739
12 HZ2 LYS 26 HZ2 LYS 26 -0.343 22.560 2.304
13 HZ3 LYS 26 HZ3 LYS 26 1.178 23.182 1.909
No H/Q in entry = 13
In of MODEL 18
1 H MET 27 H MET 27 3.204 15.645 0.819
2 HA MET 27 HA MET 27 5.722 16.155 -0.182
3 HB2 MET 27 HB2 MET 27 4.347 13.485 0.109
4 HB3 MET 27 HB3 MET 27 6.068 13.696 -0.171
5 HG2 MET 27 HG2 MET 27 5.826 15.227 1.990
6 HG3 MET 27 HG3 MET 27 4.470 14.137 2.274
7 HE1 MET 27 HE1 MET 27 5.731 11.608 0.654
8 HE2 MET 27 HE2 MET 27 6.461 10.664 1.954
9 HE3 MET 27 HE3 MET 27 4.851 11.360 2.163
No H/Q in entry = 9
In of MODEL 18
1 H LYS 28 H LYS 28 3.123 14.308 -1.830
2 HA LYS 28 HA LYS 28 4.534 13.822 -4.202
3 HB2 LYS 28 HB2 LYS 28 2.497 12.646 -3.713
4 HB3 LYS 28 HB3 LYS 28 1.577 14.146 -3.698
5 HG2 LYS 28 HG2 LYS 28 1.860 14.434 -6.042
6 HG3 LYS 28 HG3 LYS 28 3.016 13.104 -6.122
7 HD2 LYS 28 HD2 LYS 28 1.294 11.512 -5.579
8 HD3 LYS 28 HD3 LYS 28 0.126 12.810 -5.319
9 HE2 LYS 28 HE2 LYS 28 -0.129 11.699 -7.513
10 HE3 LYS 28 HE3 LYS 28 0.211 13.421 -7.642
11 HZ1 LYS 28 HZ1 LYS 28 2.210 11.250 -7.962
12 HZ2 LYS 28 HZ2 LYS 28 1.495 12.120 -9.225
13 HZ3 LYS 28 HZ3 LYS 28 2.511 12.906 -8.126
No H/Q in entry = 13
In of MODEL 18
1 H LYS 29 H LYS 29 2.507 16.524 -3.225
2 HA LYS 29 HA LYS 29 2.546 17.912 -5.663
3 HB2 LYS 29 HB2 LYS 29 0.912 18.339 -3.902
4 HB3 LYS 29 HB3 LYS 29 2.180 18.951 -2.850
5 HG2 LYS 29 HG2 LYS 29 2.565 20.803 -4.384
6 HG3 LYS 29 HG3 LYS 29 1.305 20.184 -5.453
7 HD2 LYS 29 HD2 LYS 29 -0.369 20.517 -3.748
8 HD3 LYS 29 HD3 LYS 29 0.866 20.990 -2.578
9 HE2 LYS 29 HE2 LYS 29 0.204 22.466 -5.122
10 HE3 LYS 29 HE3 LYS 29 -0.325 22.928 -3.505
11 HZ1 LYS 29 HZ1 LYS 29 1.994 23.199 -2.868
12 HZ2 LYS 29 HZ2 LYS 29 2.494 22.766 -4.422
13 HZ3 LYS 29 HZ3 LYS 29 1.613 24.188 -4.186
No H/Q in entry = 13
In of MODEL 18
1 H ASP 30 H ASP 30 4.799 17.901 -2.962
2 HA ASP 30 HA ASP 30 6.169 20.238 -3.999
3 HB2 ASP 30 HB2 ASP 30 5.796 19.874 -1.538
4 HB3 ASP 30 HB3 ASP 30 6.923 18.526 -1.618
No H/Q in entry = 4
In of MODEL 18
1 H GLY 31 H GLY 31 6.198 17.074 -4.752
2 HA2 GLY 31 HA2 GLY 31 8.725 17.461 -6.145
3 HA3 GLY 31 HA3 GLY 31 7.511 16.247 -6.512
No H/Q in entry = 3
In of MODEL 18
1 H LYS 32 H LYS 32 7.485 15.653 -3.518
2 HA LYS 32 HA LYS 32 9.933 14.328 -2.994
3 HB2 LYS 32 HB2 LYS 32 7.140 13.837 -1.935
4 HB3 LYS 32 HB3 LYS 32 8.598 13.089 -1.291
5 HG2 LYS 32 HG2 LYS 32 8.342 16.069 -1.444
6 HG3 LYS 32 HG3 LYS 32 7.633 15.163 -0.107
7 HD2 LYS 32 HD2 LYS 32 10.506 14.789 -0.878
8 HD3 LYS 32 HD3 LYS 32 10.008 16.113 0.177
9 HE2 LYS 32 HE2 LYS 32 9.021 14.524 1.732
10 HE3 LYS 32 HE3 LYS 32 9.453 13.190 0.667
11 HZ1 LYS 32 HZ1 LYS 32 11.484 15.021 1.796
12 HZ2 LYS 32 HZ2 LYS 32 10.976 13.623 2.604
13 HZ3 LYS 32 HZ3 LYS 32 11.717 13.499 1.085
No H/Q in entry = 13
In of MODEL 18
1 H ALA 33 H ALA 33 10.431 12.184 -3.307
2 HA ALA 33 HA ALA 33 9.442 11.046 -5.738
3 HB1 ALA 33 HB1 ALA 33 11.795 10.834 -5.008
4 HB2 ALA 33 HB2 ALA 33 11.047 9.275 -5.358
5 HB3 ALA 33 HB3 ALA 33 11.263 9.792 -3.685
No H/Q in entry = 5
In of MODEL 18
1 H LYS 34 H LYS 34 8.304 9.072 -6.018
2 HA LYS 34 HA LYS 34 6.195 8.536 -4.299
3 HB2 LYS 34 HB2 LYS 34 6.353 7.756 -6.652
4 HB3 LYS 34 HB3 LYS 34 7.535 6.555 -6.149
5 HG2 LYS 34 HG2 LYS 34 5.849 5.537 -4.680
6 HG3 LYS 34 HG3 LYS 34 4.664 6.714 -5.248
7 HD2 LYS 34 HD2 LYS 34 6.115 4.708 -6.978
8 HD3 LYS 34 HD3 LYS 34 4.456 4.552 -6.403
9 HE2 LYS 34 HE2 LYS 34 3.855 6.599 -7.610
10 HE3 LYS 34 HE3 LYS 34 5.511 6.739 -8.192
11 HZ1 LYS 34 HZ1 LYS 34 5.221 4.556 -9.281
12 HZ2 LYS 34 HZ2 LYS 34 3.592 4.569 -8.820
13 HZ3 LYS 34 HZ3 LYS 34 4.171 5.744 -9.882
No H/Q in entry = 13
In of MODEL 18
1 H LYS 35 H LYS 35 9.447 7.201 -4.354
2 HA LYS 35 HA LYS 35 9.115 5.121 -2.514
3 HB2 LYS 35 HB2 LYS 35 11.574 6.828 -2.940
4 HB3 LYS 35 HB3 LYS 35 11.535 5.234 -2.196
5 HG2 LYS 35 HG2 LYS 35 10.879 5.903 -5.056
6 HG3 LYS 35 HG3 LYS 35 12.304 5.046 -4.467
7 HD2 LYS 35 HD2 LYS 35 11.039 3.165 -3.837
8 HD3 LYS 35 HD3 LYS 35 9.519 4.047 -3.957
9 HE2 LYS 35 HE2 LYS 35 10.073 4.301 -6.434
10 HE3 LYS 35 HE3 LYS 35 11.283 3.046 -6.162
11 HZ1 LYS 35 HZ1 LYS 35 8.459 2.689 -5.353
12 HZ2 LYS 35 HZ2 LYS 35 8.989 2.317 -6.928
13 HZ3 LYS 35 HZ3 LYS 35 9.647 1.504 -5.593
No H/Q in entry = 13
In of MODEL 18
1 H GLU 36 H GLU 36 9.002 8.504 -1.977
2 HA GLU 36 HA GLU 36 9.702 8.260 0.834
3 HB2 GLU 36 HB2 GLU 36 8.823 10.706 -0.695
4 HB3 GLU 36 HB3 GLU 36 9.576 10.664 0.896
5 HG2 GLU 36 HG2 GLU 36 11.568 9.610 -0.158
6 HG3 GLU 36 HG3 GLU 36 10.814 9.887 -1.717
No H/Q in entry = 6
In of MODEL 18
1 H LEU 37 H LEU 37 6.976 8.667 -1.269
2 HA LEU 37 HA LEU 37 4.985 8.894 0.710
3 HB2 LEU 37 HB2 LEU 37 5.007 7.816 -2.104
4 HB3 LEU 37 HB3 LEU 37 3.547 7.985 -1.155
5 HG LEU 37 HG LEU 37 3.939 9.778 -2.805
6 HD11 LEU 37 HD11 LEU 37 2.475 10.119 -0.900
7 HD12 LEU 37 HD12 LEU 37 3.855 10.647 0.063
8 HD13 LEU 37 HD13 LEU 37 3.320 11.613 -1.311
9 HD21 LEU 37 HD21 LEU 37 6.196 10.581 -1.021
10 HD22 LEU 37 HD22 LEU 37 6.301 10.085 -2.710
11 HD23 LEU 37 HD23 LEU 37 5.494 11.592 -2.280
No H/Q in entry = 11
In of MODEL 18
1 H GLU 38 H GLU 38 6.382 6.175 -1.056
2 HA GLU 38 HA GLU 38 4.966 4.072 0.134
3 HB2 GLU 38 HB2 GLU 38 7.807 4.133 -0.903
4 HB3 GLU 38 HB3 GLU 38 6.910 2.671 -0.532
5 HG2 GLU 38 HG2 GLU 38 5.348 3.113 -2.296
6 HG3 GLU 38 HG3 GLU 38 6.079 4.690 -2.600
No H/Q in entry = 6
In of MODEL 18
1 H ALA 39 H ALA 39 7.361 6.138 1.383
2 HA ALA 39 HA ALA 39 8.266 4.260 3.406
3 HB1 ALA 39 HB1 ALA 39 9.102 7.116 2.938
4 HB2 ALA 39 HB2 ALA 39 9.888 5.946 3.997
5 HB3 ALA 39 HB3 ALA 39 9.888 5.693 2.253
No H/Q in entry = 5
In of MODEL 18
1 H LYS 40 H LYS 40 6.476 7.326 3.282
2 HA LYS 40 HA LYS 40 6.113 7.543 6.058
3 HB2 LYS 40 HB2 LYS 40 4.528 8.563 3.704
4 HB3 LYS 40 HB3 LYS 40 4.141 8.960 5.365
5 HG2 LYS 40 HG2 LYS 40 6.773 9.544 4.052
6 HG3 LYS 40 HG3 LYS 40 5.448 10.695 4.186
7 HD2 LYS 40 HD2 LYS 40 5.555 10.501 6.635
8 HD3 LYS 40 HD3 LYS 40 6.917 9.391 6.474
9 HE2 LYS 40 HE2 LYS 40 6.902 12.193 5.378
10 HE3 LYS 40 HE3 LYS 40 7.533 11.773 6.971
11 HZ1 LYS 40 HZ1 LYS 40 8.516 10.647 4.403
12 HZ2 LYS 40 HZ2 LYS 40 9.273 11.883 5.270
13 HZ3 LYS 40 HZ3 LYS 40 9.151 10.336 5.936
No H/Q in entry = 13
In of MODEL 18
1 H ILE 41 H ILE 41 4.055 6.191 3.477
2 HA ILE 41 HA ILE 41 1.930 5.378 5.065
3 HB ILE 41 HB ILE 41 2.986 4.103 2.543
4 HG12 ILE 41 HG12 ILE 41 0.817 6.167 2.949
5 HG13 ILE 41 HG13 ILE 41 2.450 6.526 2.397
6 HG21 ILE 41 HG21 ILE 41 0.274 3.901 3.846
7 HG22 ILE 41 HG22 ILE 41 0.705 3.244 2.266
8 HG23 ILE 41 HG23 ILE 41 1.470 2.611 3.724
9 HD11 ILE 41 HD11 ILE 41 2.073 5.138 0.428
10 HD12 ILE 41 HD12 ILE 41 0.425 4.826 0.984
11 HD13 ILE 41 HD13 ILE 41 0.914 6.463 0.549
No H/Q in entry = 11
In of MODEL 18
1 H LEU 42 H LEU 42 4.888 3.611 4.188
2 HA LEU 42 HA LEU 42 4.132 1.199 5.449
3 HB2 LEU 42 HB2 LEU 42 6.808 2.310 4.661
4 HB3 LEU 42 HB3 LEU 42 6.634 0.740 5.406
5 HG LEU 42 HG LEU 42 5.597 1.621 2.723
6 HD11 LEU 42 HD11 LEU 42 7.945 1.005 2.810
7 HD12 LEU 42 HD12 LEU 42 7.519 -0.543 3.539
8 HD13 LEU 42 HD13 LEU 42 7.008 -0.174 1.893
9 HD21 LEU 42 HD21 LEU 42 5.008 -0.901 4.265
10 HD22 LEU 42 HD22 LEU 42 3.852 0.271 3.637
11 HD23 LEU 42 HD23 LEU 42 4.772 -0.746 2.525
No H/Q in entry = 11
In of MODEL 18
1 H HIS 43 H HIS 43 5.840 4.055 6.591
2 HA HIS 43 HA HIS 43 6.417 3.034 9.179
3 HB2 HIS 43 HB2 HIS 43 7.525 5.054 8.286
4 HB3 HIS 43 HB3 HIS 43 5.986 5.909 8.330
5 HD1 HIS 43 HD1 HIS 43 8.527 4.363 10.674
6 HD2 HIS 43 HD2 HIS 43 5.358 7.052 10.740
7 HE1 HIS 43 HE1 HIS 43 8.542 5.366 12.975
8 HE2 HIS 43 HE2 HIS 43 6.551 6.908 13.029
No H/Q in entry = 8
In of MODEL 18
1 H TYR 44 H TYR 44 3.684 4.929 7.868
2 HA TYR 44 HA TYR 44 2.279 5.175 10.308
3 HB2 TYR 44 HB2 TYR 44 1.157 5.146 7.494
4 HB3 TYR 44 HB3 TYR 44 0.329 5.744 8.930
5 HD1 TYR 44 HD1 TYR 44 2.839 7.034 10.146
6 HD2 TYR 44 HD2 TYR 44 1.090 7.225 6.275
7 HE1 TYR 44 HE1 TYR 44 3.876 9.211 9.799
8 HE2 TYR 44 HE2 TYR 44 2.140 9.420 5.900
9 HH TYR 44 HH TYR 44 3.008 11.365 7.547
No H/Q in entry = 9
In of MODEL 18
1 H TYR 45 H TYR 45 2.413 2.743 7.847
2 HA TYR 45 HA TYR 45 0.324 1.069 8.651
3 HB2 TYR 45 HB2 TYR 45 1.402 0.860 6.488
4 HB3 TYR 45 HB3 TYR 45 2.952 0.545 7.250
5 HD1 TYR 45 HD1 TYR 45 -0.480 -0.836 7.091
6 HD2 TYR 45 HD2 TYR 45 3.679 -1.627 7.398
7 HE1 TYR 45 HE1 TYR 45 -0.943 -3.239 6.987
8 HE2 TYR 45 HE2 TYR 45 3.235 -4.041 7.291
9 HH TYR 45 HH TYR 45 0.104 -5.297 6.486
No H/Q in entry = 9
In of MODEL 18
1 H ASP 46 H ASP 46 3.755 1.175 9.571
2 HA ASP 46 HA ASP 46 3.528 -1.195 11.155
3 HB2 ASP 46 HB2 ASP 46 5.646 -0.665 10.068
4 HB3 ASP 46 HB3 ASP 46 5.761 0.840 10.978
No H/Q in entry = 4
In of MODEL 18
1 H GLU 47 H GLU 47 2.963 2.153 11.828
2 HA GLU 47 HA GLU 47 3.341 1.775 14.675
3 HB2 GLU 47 HB2 GLU 47 2.618 4.149 14.831
4 HB3 GLU 47 HB3 GLU 47 4.021 3.905 13.800
5 HG2 GLU 47 HG2 GLU 47 2.761 4.199 11.847
6 HG3 GLU 47 HG3 GLU 47 1.237 4.055 12.715
No H/Q in entry = 6
In of MODEL 18
1 H LEU 48 H LEU 48 1.106 0.664 12.701
2 HA LEU 48 HA LEU 48 -1.331 1.647 13.786
3 HB2 LEU 48 HB2 LEU 48 -0.590 -0.650 12.009
4 HB3 LEU 48 HB3 LEU 48 -2.241 -0.385 12.515
5 HG LEU 48 HG LEU 48 -0.575 1.578 10.966
6 HD11 LEU 48 HD11 LEU 48 -1.197 -0.383 9.654
7 HD12 LEU 48 HD12 LEU 48 -2.884 -0.158 10.119
8 HD13 LEU 48 HD13 LEU 48 -2.074 1.052 9.124
9 HD21 LEU 48 HD21 LEU 48 -3.396 1.629 11.992
10 HD22 LEU 48 HD22 LEU 48 -2.102 2.780 12.316
11 HD23 LEU 48 HD23 LEU 48 -2.820 2.693 10.706
No H/Q in entry = 11
In of MODEL 18
1 H GLU 49 H GLU 49 -2.654 -0.878 14.037
2 HA GLU 49 HA GLU 49 -1.793 -2.098 16.420
3 HB2 GLU 49 HB2 GLU 49 -3.499 -0.987 17.927
4 HB3 GLU 49 HB3 GLU 49 -2.080 -0.033 17.520
5 HG2 GLU 49 HG2 GLU 49 -3.386 1.124 15.795
6 HG3 GLU 49 HG3 GLU 49 -4.808 0.198 16.275
No H/Q in entry = 6
In of MODEL 18
1 H GLY 50 H GLY 50 -2.708 -4.011 16.260
2 HA2 GLY 50 HA2 GLY 50 -5.344 -4.514 16.813
3 HA3 GLY 50 HA3 GLY 50 -4.276 -5.665 16.035
No H/Q in entry = 3
In of MODEL 18
1 H ASP 51 H ASP 51 -7.112 -3.968 15.751
2 HA ASP 51 HA ASP 51 -7.645 -5.126 13.213
3 HB2 ASP 51 HB2 ASP 51 -9.204 -3.329 15.039
4 HB3 ASP 51 HB3 ASP 51 -9.785 -3.667 13.413
No H/Q in entry = 4
In of MODEL 18
1 H ALA 52 H ALA 52 -6.570 -1.955 14.238
2 HA ALA 52 HA ALA 52 -7.122 -0.572 11.839
3 HB1 ALA 52 HB1 ALA 52 -4.851 -0.171 13.800
4 HB2 ALA 52 HB2 ALA 52 -5.309 0.962 12.525
5 HB3 ALA 52 HB3 ALA 52 -6.425 0.621 13.844
No H/Q in entry = 5
In of MODEL 18
1 H LYS 53 H LYS 53 -4.417 -2.482 12.955
2 HA LYS 53 HA LYS 53 -2.728 -2.205 10.708
3 HB2 LYS 53 HB2 LYS 53 -2.046 -3.011 12.980
4 HB3 LYS 53 HB3 LYS 53 -2.888 -4.517 12.644
5 HG2 LYS 53 HG2 LYS 53 -0.584 -4.867 12.242
6 HG3 LYS 53 HG3 LYS 53 -1.386 -4.828 10.676
7 HD2 LYS 53 HD2 LYS 53 -0.651 -2.549 10.327
8 HD3 LYS 53 HD3 LYS 53 0.053 -2.505 11.944
9 HE2 LYS 53 HE2 LYS 53 0.920 -4.347 9.724
10 HE3 LYS 53 HE3 LYS 53 1.736 -2.852 10.180
11 HZ1 LYS 53 HZ1 LYS 53 2.088 -3.815 12.401
12 HZ2 LYS 53 HZ2 LYS 53 1.406 -5.269 11.869
13 HZ3 LYS 53 HZ3 LYS 53 2.842 -4.707 11.178
No H/Q in entry = 13
In of MODEL 18
1 H LYS 54 H LYS 54 -4.788 -4.872 11.771
2 HA LYS 54 HA LYS 54 -4.623 -6.511 9.563
3 HB2 LYS 54 HB2 LYS 54 -5.887 -7.724 10.901
4 HB3 LYS 54 HB3 LYS 54 -6.182 -6.322 11.914
5 HG2 LYS 54 HG2 LYS 54 -8.186 -5.822 10.845
6 HG3 LYS 54 HG3 LYS 54 -7.807 -6.847 9.448
7 HD2 LYS 54 HD2 LYS 54 -7.905 -8.819 10.890
8 HD3 LYS 54 HD3 LYS 54 -8.300 -7.799 12.271
9 HE2 LYS 54 HE2 LYS 54 -9.969 -8.122 9.779
10 HE3 LYS 54 HE3 LYS 54 -10.293 -8.874 11.340
11 HZ1 LYS 54 HZ1 LYS 54 -10.490 -6.616 12.291
12 HZ2 LYS 54 HZ2 LYS 54 -10.317 -5.970 10.732
13 HZ3 LYS 54 HZ3 LYS 54 -11.649 -6.940 11.101
No H/Q in entry = 13
In of MODEL 18
1 H GLU 55 H GLU 55 -6.905 -3.803 10.065
2 HA GLU 55 HA GLU 55 -8.217 -4.146 7.607
3 HB2 GLU 55 HB2 GLU 55 -8.060 -2.036 9.682
4 HB3 GLU 55 HB3 GLU 55 -8.507 -1.482 8.079
5 HG2 GLU 55 HG2 GLU 55 -10.183 -3.507 8.255
6 HG3 GLU 55 HG3 GLU 55 -9.976 -3.204 9.977
No H/Q in entry = 6
In of MODEL 18
1 H ALA 56 H ALA 56 -5.533 -1.970 8.537
2 HA ALA 56 HA ALA 56 -5.393 -0.779 6.021
3 HB1 ALA 56 HB1 ALA 56 -3.124 -0.067 6.630
4 HB2 ALA 56 HB2 ALA 56 -3.123 -1.213 7.971
5 HB3 ALA 56 HB3 ALA 56 -4.239 0.153 7.977
No H/Q in entry = 5
In of MODEL 18
1 H THR 57 H THR 57 -3.491 -3.481 7.359
2 HA THR 57 HA THR 57 -1.984 -4.198 5.213
3 HB THR 57 HB THR 57 -3.454 -6.058 7.098
4 HG1 THR 57 HG1 THR 57 -0.764 -5.133 7.269
5 HG21 THR 57 HG21 THR 57 -1.006 -6.530 5.398
6 HG22 THR 57 HG22 THR 57 -1.650 -7.649 6.602
7 HG23 THR 57 HG23 THR 57 -2.594 -7.257 5.165
No H/Q in entry = 7
In of MODEL 18
1 H GLU 58 H GLU 58 -5.324 -5.169 5.858
2 HA GLU 58 HA GLU 58 -5.747 -6.700 3.526
3 HB2 GLU 58 HB2 GLU 58 -7.472 -5.413 5.581
4 HB3 GLU 58 HB3 GLU 58 -8.229 -5.932 4.077
5 HG2 GLU 58 HG2 GLU 58 -7.344 -8.199 4.459
6 HG3 GLU 58 HG3 GLU 58 -6.681 -7.650 5.996
No H/Q in entry = 6
In of MODEL 18
1 H HIS 59 H HIS 59 -6.033 -3.226 4.109
2 HA HIS 59 HA HIS 59 -7.527 -2.779 1.687
3 HB2 HIS 59 HB2 HIS 59 -6.174 -0.821 3.561
4 HB3 HIS 59 HB3 HIS 59 -7.208 -0.366 2.210
5 HD1 HIS 59 HD1 HIS 59 -9.300 -2.767 2.908
6 HD2 HIS 59 HD2 HIS 59 -7.966 0.255 5.431
7 HE1 HIS 59 HE1 HIS 59 -11.041 -2.571 4.702
8 HE2 HIS 59 HE2 HIS 59 -10.126 -0.878 6.323
No H/Q in entry = 8
In of MODEL 18
1 H LEU 60 H LEU 60 -4.201 -2.143 2.775
2 HA LEU 60 HA LEU 60 -3.155 -1.345 0.357
3 HB2 LEU 60 HB2 LEU 60 -1.999 -2.736 2.742
4 HB3 LEU 60 HB3 LEU 60 -1.014 -2.407 1.327
5 HG LEU 60 HG LEU 60 -1.657 -0.020 1.549
6 HD11 LEU 60 HD11 LEU 60 -3.644 -0.245 2.817
7 HD12 LEU 60 HD12 LEU 60 -2.723 -0.856 4.195
8 HD13 LEU 60 HD13 LEU 60 -2.491 0.806 3.647
9 HD21 LEU 60 HD21 LEU 60 -0.161 -1.246 3.847
10 HD22 LEU 60 HD22 LEU 60 0.517 -0.769 2.291
11 HD23 LEU 60 HD23 LEU 60 -0.101 0.458 3.395
No H/Q in entry = 11
In of MODEL 18
1 H LYS 61 H LYS 61 -3.866 -4.602 1.573
2 HA LYS 61 HA LYS 61 -2.596 -6.074 -0.445
3 HB2 LYS 61 HB2 LYS 61 -4.993 -6.608 1.284
4 HB3 LYS 61 HB3 LYS 61 -4.578 -7.718 -0.012
5 HG2 LYS 61 HG2 LYS 61 -2.384 -8.083 1.000
6 HG3 LYS 61 HG3 LYS 61 -2.798 -6.956 2.296
7 HD2 LYS 61 HD2 LYS 61 -4.629 -8.394 2.993
8 HD3 LYS 61 HD3 LYS 61 -4.295 -9.498 1.659
9 HE2 LYS 61 HE2 LYS 61 -2.110 -9.996 2.603
10 HE3 LYS 61 HE3 LYS 61 -2.399 -8.858 3.914
11 HZ1 LYS 61 HZ1 LYS 61 -4.256 -10.236 4.635
12 HZ2 LYS 61 HZ2 LYS 61 -3.952 -11.331 3.384
13 HZ3 LYS 61 HZ3 LYS 61 -2.814 -11.120 4.616
No H/Q in entry = 13
In of MODEL 18
1 H GLY 62 H GLY 62 -6.010 -5.066 -0.220
2 HA2 GLY 62 HA2 GLY 62 -7.498 -4.443 -1.845
3 HA3 GLY 62 HA3 GLY 62 -6.789 -5.735 -2.803
No H/Q in entry = 3
In of MODEL 18
1 H GLY 63 H GLY 63 -5.271 -2.756 -1.617
2 HA2 GLY 63 HA2 GLY 63 -3.990 -1.210 -2.717
3 HA3 GLY 63 HA3 GLY 63 -5.269 -1.243 -3.920
No H/Q in entry = 3
In of MODEL 18
1 H CYS 64 H CYS 64 -2.592 -3.403 -2.930
2 HA CYS 64 HA CYS 64 -1.372 -3.096 -5.493
3 HB2 CYS 64 HB2 CYS 64 0.307 -4.670 -4.729
4 HB3 CYS 64 HB3 CYS 64 -0.011 -3.460 -3.490
No H/Q in entry = 4
In of MODEL 18
1 H ARG 65 H ARG 65 -3.661 -5.306 -4.120
2 HA ARG 65 HA ARG 65 -3.656 -7.354 -6.013
3 HB2 ARG 65 HB2 ARG 65 -5.141 -7.318 -4.043
4 HB3 ARG 65 HB3 ARG 65 -6.045 -5.987 -4.747
5 HG2 ARG 65 HG2 ARG 65 -6.516 -7.561 -6.697
6 HG3 ARG 65 HG3 ARG 65 -5.935 -8.847 -5.635
7 HD2 ARG 65 HD2 ARG 65 -8.310 -8.753 -5.419
8 HD3 ARG 65 HD3 ARG 65 -7.614 -8.087 -3.941
9 HE ARG 65 HE ARG 65 -8.219 -6.087 -5.921
10 HH11 ARG 65 HH11 ARG 65 -9.547 -7.980 -3.282
11 HH12 ARG 65 HH12 ARG 65 -10.830 -6.855 -2.961
12 HH21 ARG 65 HH21 ARG 65 -9.894 -4.629 -5.511
13 HH22 ARG 65 HH22 ARG 65 -11.036 -4.948 -4.239
No H/Q in entry = 13
In of MODEL 18
1 H GLU 66 H GLU 66 -5.331 -4.208 -6.108
2 HA GLU 66 HA GLU 66 -6.373 -4.433 -8.704
3 HB2 GLU 66 HB2 GLU 66 -5.482 -1.909 -7.291
4 HB3 GLU 66 HB3 GLU 66 -6.579 -1.995 -8.663
5 HG2 GLU 66 HG2 GLU 66 -7.090 -3.091 -5.906
6 HG3 GLU 66 HG3 GLU 66 -7.785 -1.627 -6.597
No H/Q in entry = 6
In of MODEL 18
1 H ILE 67 H ILE 67 -3.246 -3.391 -7.505
2 HA ILE 67 HA ILE 67 -2.204 -2.523 -9.991
3 HB ILE 67 HB ILE 67 -0.777 -3.530 -7.531
4 HG12 ILE 67 HG12 ILE 67 -1.350 -0.743 -8.558
5 HG13 ILE 67 HG13 ILE 67 -2.131 -1.516 -7.183
6 HG21 ILE 67 HG21 ILE 67 0.658 -3.765 -9.494
7 HG22 ILE 67 HG22 ILE 67 0.347 -2.083 -9.929
8 HG23 ILE 67 HG23 ILE 67 1.226 -2.460 -8.450
9 HD11 ILE 67 HD11 ILE 67 0.006 -1.570 -6.010
10 HD12 ILE 67 HD12 ILE 67 0.776 -0.785 -7.388
11 HD13 ILE 67 HD13 ILE 67 -0.456 0.068 -6.462
No H/Q in entry = 11
In of MODEL 18
1 H LEU 68 H LEU 68 -2.060 -5.640 -8.293
2 HA LEU 68 HA LEU 68 -0.485 -7.014 -10.184
3 HB2 LEU 68 HB2 LEU 68 -1.210 -7.689 -7.798
4 HB3 LEU 68 HB3 LEU 68 -2.674 -8.286 -8.555
5 HG LEU 68 HG LEU 68 -1.319 -9.825 -9.929
6 HD11 LEU 68 HD11 LEU 68 0.970 -8.766 -8.276
7 HD12 LEU 68 HD12 LEU 68 1.044 -10.160 -9.351
8 HD13 LEU 68 HD13 LEU 68 0.748 -8.554 -10.012
9 HD21 LEU 68 HD21 LEU 68 -0.901 -9.997 -6.949
10 HD22 LEU 68 HD22 LEU 68 -2.266 -10.635 -7.863
11 HD23 LEU 68 HD23 LEU 68 -0.659 -11.324 -8.083
No H/Q in entry = 11
In of MODEL 18
1 H LYS 69 H LYS 69 -3.865 -6.238 -9.999
2 HA LYS 69 HA LYS 69 -4.762 -7.780 -12.170
3 HB2 LYS 69 HB2 LYS 69 -5.781 -5.183 -11.029
4 HB3 LYS 69 HB3 LYS 69 -6.574 -6.006 -12.364
5 HG2 LYS 69 HG2 LYS 69 -6.919 -7.970 -10.950
6 HG3 LYS 69 HG3 LYS 69 -6.121 -7.145 -9.611
7 HD2 LYS 69 HD2 LYS 69 -8.522 -6.987 -9.353
8 HD3 LYS 69 HD3 LYS 69 -7.855 -5.390 -9.695
9 HE2 LYS 69 HE2 LYS 69 -9.842 -5.639 -10.990
10 HE3 LYS 69 HE3 LYS 69 -8.473 -5.736 -12.091
11 HZ1 LYS 69 HZ1 LYS 69 -8.685 -8.197 -11.937
12 HZ2 LYS 69 HZ2 LYS 69 -10.124 -7.978 -11.081
13 HZ3 LYS 69 HZ3 LYS 69 -9.998 -7.432 -12.682
No H/Q in entry = 13
In of MODEL 18
1 H HIS 70 H HIS 70 -2.574 -5.251 -12.124
2 HA HIS 70 HA HIS 70 -3.157 -4.453 -14.881
3 HB2 HIS 70 HB2 HIS 70 -2.985 -2.598 -13.212
4 HB3 HIS 70 HB3 HIS 70 -1.330 -3.093 -12.884
5 HD1 HIS 70 HD1 HIS 70 -3.401 -1.156 -15.248
6 HD2 HIS 70 HD2 HIS 70 0.492 -2.612 -15.040
7 HE1 HIS 70 HE1 HIS 70 -2.127 0.070 -17.033
8 HE2 HIS 70 HE2 HIS 70 0.173 -0.957 -17.009
No H/Q in entry = 8
In of MODEL 18
1 H VAL 71 H VAL 71 -0.530 -5.297 -12.647
2 HA VAL 71 HA VAL 71 1.538 -5.404 -14.504
3 HB VAL 71 HB VAL 71 1.639 -7.281 -12.196
4 HG11 VAL 71 HG11 VAL 71 3.552 -6.933 -13.637
5 HG12 VAL 71 HG12 VAL 71 3.504 -5.204 -13.274
6 HG13 VAL 71 HG13 VAL 71 3.871 -6.361 -11.996
7 HG21 VAL 71 HG21 VAL 71 1.632 -4.289 -11.854
8 HG22 VAL 71 HG22 VAL 71 0.476 -5.434 -11.169
9 HG23 VAL 71 HG23 VAL 71 2.159 -5.457 -10.638
No H/Q in entry = 9
In of MODEL 18
1 H VAL 72 H VAL 72 -0.161 -8.162 -13.001
2 HA VAL 72 HA VAL 72 1.011 -9.888 -15.034
3 HB VAL 72 HB VAL 72 0.280 -11.756 -13.730
4 HG11 VAL 72 HG11 VAL 72 1.337 -9.581 -11.939
5 HG12 VAL 72 HG12 VAL 72 1.382 -11.309 -11.585
6 HG13 VAL 72 HG13 VAL 72 2.289 -10.664 -12.955
7 HG21 VAL 72 HG21 VAL 72 -1.951 -10.940 -13.113
8 HG22 VAL 72 HG22 VAL 72 -1.070 -11.543 -11.709
9 HG23 VAL 72 HG23 VAL 72 -1.218 -9.805 -11.979
No H/Q in entry = 9
In of MODEL 18
1 H GLY 73 H GLY 73 -1.748 -8.115 -14.523
2 HA2 GLY 73 HA2 GLY 73 -3.057 -9.301 -16.813
3 HA3 GLY 73 HA3 GLY 73 -3.538 -7.832 -15.977
No H/Q in entry = 3
In of MODEL 18
1 H GLU 74 H GLU 74 -5.712 -8.697 -16.165
2 HA GLU 74 HA GLU 74 -6.576 -9.992 -13.811
3 HB2 GLU 74 HB2 GLU 74 -8.070 -9.613 -16.415
4 HB3 GLU 74 HB3 GLU 74 -8.793 -10.001 -14.858
5 HG2 GLU 74 HG2 GLU 74 -7.907 -7.864 -13.973
6 HG3 GLU 74 HG3 GLU 74 -7.341 -7.472 -15.593
No H/Q in entry = 6
In of MODEL 18
1 H GLU 75 H GLU 75 -5.627 -11.087 -16.932
2 HA GLU 75 HA GLU 75 -6.397 -13.740 -17.072
3 HB2 GLU 75 HB2 GLU 75 -3.693 -12.539 -17.668
4 HB3 GLU 75 HB3 GLU 75 -4.279 -14.089 -18.255
5 HG2 GLU 75 HG2 GLU 75 -6.029 -12.993 -19.504
6 HG3 GLU 75 HG3 GLU 75 -5.533 -11.427 -18.862
No H/Q in entry = 6
In of MODEL 18
1 H LYS 76 H LYS 76 -3.347 -12.612 -15.634
2 HA LYS 76 HA LYS 76 -2.853 -15.190 -14.511
3 HB2 LYS 76 HB2 LYS 76 -1.072 -13.696 -15.353
4 HB3 LYS 76 HB3 LYS 76 -1.409 -12.599 -14.025
5 HG2 LYS 76 HG2 LYS 76 0.526 -13.987 -13.548
6 HG3 LYS 76 HG3 LYS 76 -0.787 -14.315 -12.419
7 HD2 LYS 76 HD2 LYS 76 0.312 -16.378 -13.204
8 HD3 LYS 76 HD3 LYS 76 -1.393 -16.313 -13.660
9 HE2 LYS 76 HE2 LYS 76 -0.792 -15.602 -15.897
10 HE3 LYS 76 HE3 LYS 76 0.904 -15.551 -15.451
11 HZ1 LYS 76 HZ1 LYS 76 0.751 -17.970 -15.011
12 HZ2 LYS 76 HZ2 LYS 76 -0.822 -17.952 -15.635
13 HZ3 LYS 76 HZ3 LYS 76 0.490 -17.560 -16.628
No H/Q in entry = 13
In of MODEL 18
1 H ALA 77 H ALA 77 -3.967 -12.080 -13.306
2 HA ALA 77 HA ALA 77 -3.837 -12.641 -10.556
3 HB1 ALA 77 HB1 ALA 77 -5.451 -10.835 -10.281
4 HB2 ALA 77 HB2 ALA 77 -5.801 -10.871 -12.009
5 HB3 ALA 77 HB3 ALA 77 -4.203 -10.387 -11.444
No H/Q in entry = 5
In of MODEL 18
1 H ALA 78 H ALA 78 -6.081 -13.565 -13.044
2 HA ALA 78 HA ALA 78 -8.116 -14.584 -11.336
3 HB1 ALA 78 HB1 ALA 78 -8.744 -15.863 -13.459
4 HB2 ALA 78 HB2 ALA 78 -7.406 -15.000 -14.235
5 HB3 ALA 78 HB3 ALA 78 -8.760 -14.104 -13.545
No H/Q in entry = 5
In of MODEL 18
1 H GLU 79 H GLU 79 -5.216 -15.882 -12.820
2 HA GLU 79 HA GLU 79 -5.688 -18.602 -12.105
3 HB2 GLU 79 HB2 GLU 79 -3.033 -17.307 -12.722
4 HB3 GLU 79 HB3 GLU 79 -3.458 -19.008 -12.885
5 HG2 GLU 79 HG2 GLU 79 -5.123 -18.346 -14.611
6 HG3 GLU 79 HG3 GLU 79 -4.482 -16.708 -14.513
No H/Q in entry = 6
In of MODEL 18
1 H LEU 80 H LEU 80 -3.760 -15.966 -10.727
2 HA LEU 80 HA LEU 80 -2.892 -17.302 -8.447
3 HB2 LEU 80 HB2 LEU 80 -3.270 -14.482 -9.323
4 HB3 LEU 80 HB3 LEU 80 -2.874 -14.803 -7.646
5 HG LEU 80 HG LEU 80 -0.773 -15.530 -8.145
6 HD11 LEU 80 HD11 LEU 80 -1.436 -17.238 -9.817
7 HD12 LEU 80 HD12 LEU 80 -1.385 -15.965 -11.039
8 HD13 LEU 80 HD13 LEU 80 0.086 -16.416 -10.162
9 HD21 LEU 80 HD21 LEU 80 -1.438 -13.538 -10.277
10 HD22 LEU 80 HD22 LEU 80 -0.860 -13.198 -8.646
11 HD23 LEU 80 HD23 LEU 80 0.213 -13.970 -9.818
No H/Q in entry = 11
In of MODEL 18
1 H LYS 81 H LYS 81 -5.858 -15.493 -9.122
2 HA LYS 81 HA LYS 81 -6.836 -15.506 -6.474
3 HB2 LYS 81 HB2 LYS 81 -7.753 -14.073 -8.292
4 HB3 LYS 81 HB3 LYS 81 -8.446 -15.507 -9.034
5 HG2 LYS 81 HG2 LYS 81 -10.154 -14.363 -7.807
6 HG3 LYS 81 HG3 LYS 81 -9.777 -15.876 -6.979
7 HD2 LYS 81 HD2 LYS 81 -8.281 -14.591 -5.456
8 HD3 LYS 81 HD3 LYS 81 -8.840 -13.110 -6.228
9 HE2 LYS 81 HE2 LYS 81 -10.520 -15.096 -4.707
10 HE3 LYS 81 HE3 LYS 81 -10.055 -13.486 -4.169
11 HZ1 LYS 81 HZ1 LYS 81 -11.327 -12.557 -6.012
12 HZ2 LYS 81 HZ2 LYS 81 -11.792 -14.108 -6.492
13 HZ3 LYS 81 HZ3 LYS 81 -12.303 -13.497 -5.001
No H/Q in entry = 13
In of MODEL 18
1 H ASN 82 H ASN 82 -7.238 -17.742 -9.194
2 HA ASN 82 HA ASN 82 -8.888 -19.520 -7.689
3 HB2 ASN 82 HB2 ASN 82 -8.886 -19.369 -10.205
4 HB3 ASN 82 HB3 ASN 82 -7.311 -20.140 -10.199
5 HD21 ASN 82 HD21 ASN 82 -7.145 -22.324 -9.745
6 HD22 ASN 82 HD22 ASN 82 -8.523 -23.369 -9.680
No H/Q in entry = 6
In of MODEL 18
1 H LEU 83 H LEU 83 -5.488 -19.039 -7.973
2 HA LEU 83 HA LEU 83 -4.724 -21.537 -6.920
3 HB2 LEU 83 HB2 LEU 83 -3.539 -18.827 -7.206
4 HB3 LEU 83 HB3 LEU 83 -2.815 -19.901 -6.051
5 HG LEU 83 HG LEU 83 -3.133 -20.477 -8.992
6 HD11 LEU 83 HD11 LEU 83 -1.495 -18.724 -8.556
7 HD12 LEU 83 HD12 LEU 83 -0.677 -19.768 -7.397
8 HD13 LEU 83 HD13 LEU 83 -0.716 -20.205 -9.107
9 HD21 LEU 83 HD21 LEU 83 -1.696 -22.029 -6.837
10 HD22 LEU 83 HD22 LEU 83 -3.183 -22.517 -7.652
11 HD23 LEU 83 HD23 LEU 83 -1.679 -22.396 -8.563
No H/Q in entry = 11
In of MODEL 18
1 H LYS 84 H LYS 84 -5.008 -18.336 -5.441
2 HA LYS 84 HA LYS 84 -4.956 -18.886 -2.777
3 HB2 LYS 84 HB2 LYS 84 -5.217 -16.654 -3.848
4 HB3 LYS 84 HB3 LYS 84 -6.910 -17.020 -4.137
5 HG2 LYS 84 HG2 LYS 84 -7.235 -17.201 -1.684
6 HG3 LYS 84 HG3 LYS 84 -5.561 -16.681 -1.470
7 HD2 LYS 84 HD2 LYS 84 -6.081 -14.617 -2.736
8 HD3 LYS 84 HD3 LYS 84 -7.767 -15.128 -2.819
9 HE2 LYS 84 HE2 LYS 84 -7.831 -15.142 -0.341
10 HE3 LYS 84 HE3 LYS 84 -6.187 -14.507 -0.330
11 HZ1 LYS 84 HZ1 LYS 84 -6.994 -12.570 -1.569
12 HZ2 LYS 84 HZ2 LYS 84 -8.571 -13.170 -1.483
13 HZ3 LYS 84 HZ3 LYS 84 -7.760 -12.723 -0.071
No H/Q in entry = 13
In of MODEL 18
1 H ASP 85 H ASP 85 -7.972 -18.786 -4.665
2 HA ASP 85 HA ASP 85 -9.681 -19.741 -2.649
3 HB2 ASP 85 HB2 ASP 85 -10.477 -18.546 -4.622
4 HB3 ASP 85 HB3 ASP 85 -9.965 -19.882 -5.650
No H/Q in entry = 4
In of MODEL 18
1 H SER 86 H SER 86 -7.849 -21.554 -5.101
2 HA SER 86 HA SER 86 -9.240 -23.984 -4.473
3 HB2 SER 86 HB2 SER 86 -8.305 -23.585 -6.723
4 HB3 SER 86 HB3 SER 86 -6.681 -23.599 -6.043
5 HG SER 86 HG SER 86 -8.534 -25.734 -6.216
No H/Q in entry = 5
In of MODEL 18
1 H GLY 87 H GLY 87 -6.779 -22.279 -2.945
2 HA2 GLY 87 HA2 GLY 87 -6.338 -24.647 -1.249
3 HA3 GLY 87 HA3 GLY 87 -6.240 -22.977 -0.710
No H/Q in entry = 3
In of MODEL 18
1 H ALA 88 H ALA 88 -4.724 -22.621 -3.439
2 HA ALA 88 HA ALA 88 -2.180 -23.705 -3.038
3 HB1 ALA 88 HB1 ALA 88 -2.876 -20.985 -4.147
4 HB2 ALA 88 HB2 ALA 88 -2.790 -22.485 -5.068
5 HB3 ALA 88 HB3 ALA 88 -1.335 -21.814 -4.340
No H/Q in entry = 5
In of MODEL 18
1 H SER 89 H SER 89 -0.768 -23.314 -1.498
2 HA SER 89 HA SER 89 -1.417 -21.638 0.722
3 HB2 SER 89 HB2 SER 89 -0.213 -23.854 0.883
4 HB3 SER 89 HB3 SER 89 1.218 -23.039 0.251
5 HG SER 89 HG SER 89 1.374 -22.957 2.449
No H/Q in entry = 5
In of MODEL 18
1 H LYS 90 H LYS 90 0.750 -20.402 1.619
2 HA LYS 90 HA LYS 90 0.675 -18.014 0.162
3 HB2 LYS 90 HB2 LYS 90 2.533 -18.947 2.346
4 HB3 LYS 90 HB3 LYS 90 2.625 -17.339 1.654
5 HG2 LYS 90 HG2 LYS 90 1.388 -17.184 3.672
6 HG3 LYS 90 HG3 LYS 90 0.252 -16.983 2.340
7 HD2 LYS 90 HD2 LYS 90 -0.731 -18.403 4.025
8 HD3 LYS 90 HD3 LYS 90 -0.390 -19.364 2.587
9 HE2 LYS 90 HE2 LYS 90 1.707 -20.135 3.658
10 HE3 LYS 90 HE3 LYS 90 1.253 -19.256 5.113
11 HZ1 LYS 90 HZ1 LYS 90 -0.733 -20.637 5.265
12 HZ2 LYS 90 HZ2 LYS 90 -0.264 -21.490 3.882
13 HZ3 LYS 90 HZ3 LYS 90 0.670 -21.579 5.289
No H/Q in entry = 13
In of MODEL 18
1 H GLU 91 H GLU 91 2.886 -20.707 0.047
2 HA GLU 91 HA GLU 91 4.972 -19.298 -1.282
3 HB2 GLU 91 HB2 GLU 91 5.392 -21.229 0.159
4 HB3 GLU 91 HB3 GLU 91 4.481 -22.258 -0.932
5 HG2 GLU 91 HG2 GLU 91 6.128 -21.802 -2.689
6 HG3 GLU 91 HG3 GLU 91 7.065 -20.855 -1.539
No H/Q in entry = 6
In of MODEL 18
1 H GLU 92 H GLU 92 2.503 -21.589 -2.363
2 HA GLU 92 HA GLU 92 3.115 -21.804 -5.043
3 HB2 GLU 92 HB2 GLU 92 0.397 -21.729 -3.744
4 HB3 GLU 92 HB3 GLU 92 0.787 -22.445 -5.294
5 HG2 GLU 92 HG2 GLU 92 1.934 -23.361 -2.689
6 HG3 GLU 92 HG3 GLU 92 0.501 -24.048 -3.436
No H/Q in entry = 6
In of MODEL 18
1 H LEU 93 H LEU 93 1.107 -19.475 -3.282
2 HA LEU 93 HA LEU 93 0.681 -17.839 -5.577
3 HB2 LEU 93 HB2 LEU 93 0.517 -17.261 -2.619
4 HB3 LEU 93 HB3 LEU 93 0.158 -16.050 -3.844
5 HG LEU 93 HG LEU 93 -1.265 -18.705 -3.607
6 HD11 LEU 93 HD11 LEU 93 -2.110 -15.964 -2.707
7 HD12 LEU 93 HD12 LEU 93 -3.183 -17.362 -2.840
8 HD13 LEU 93 HD13 LEU 93 -1.837 -17.387 -1.696
9 HD21 LEU 93 HD21 LEU 93 -1.771 -16.275 -5.311
10 HD22 LEU 93 HD22 LEU 93 -1.279 -17.877 -5.862
11 HD23 LEU 93 HD23 LEU 93 -2.874 -17.640 -5.149
No H/Q in entry = 11
In of MODEL 18
1 H LYS 94 H LYS 94 3.188 -17.881 -3.024
2 HA LYS 94 HA LYS 94 4.296 -15.422 -3.715
3 HB2 LYS 94 HB2 LYS 94 4.901 -16.518 -1.647
4 HB3 LYS 94 HB3 LYS 94 5.562 -17.890 -2.510
5 HG2 LYS 94 HG2 LYS 94 7.298 -16.429 -1.584
6 HG3 LYS 94 HG3 LYS 94 7.386 -16.561 -3.341
7 HD2 LYS 94 HD2 LYS 94 6.387 -14.405 -3.614
8 HD3 LYS 94 HD3 LYS 94 6.042 -14.293 -1.889
9 HE2 LYS 94 HE2 LYS 94 8.005 -12.958 -2.540
10 HE3 LYS 94 HE3 LYS 94 8.405 -14.222 -1.385
11 HZ1 LYS 94 HZ1 LYS 94 9.144 -15.582 -3.318
12 HZ2 LYS 94 HZ2 LYS 94 8.953 -14.218 -4.303
13 HZ3 LYS 94 HZ3 LYS 94 10.077 -14.202 -3.037
No H/Q in entry = 13
In of MODEL 18
1 H ALA 95 H ALA 95 5.167 -18.668 -4.773
2 HA ALA 95 HA ALA 95 7.316 -17.646 -6.348
3 HB1 ALA 95 HB1 ALA 95 7.480 -19.806 -5.218
4 HB2 ALA 95 HB2 ALA 95 6.178 -20.432 -6.228
5 HB3 ALA 95 HB3 ALA 95 7.713 -19.965 -6.957
No H/Q in entry = 5
In of MODEL 18
1 H LYS 96 H LYS 96 4.149 -19.139 -7.053
2 HA LYS 96 HA LYS 96 4.448 -19.153 -9.855
3 HB2 LYS 96 HB2 LYS 96 2.011 -18.970 -8.108
4 HB3 LYS 96 HB3 LYS 96 1.920 -19.080 -9.851
5 HG2 LYS 96 HG2 LYS 96 3.206 -21.106 -8.038
6 HG3 LYS 96 HG3 LYS 96 1.611 -21.254 -8.778
7 HD2 LYS 96 HD2 LYS 96 2.609 -21.252 -10.988
8 HD3 LYS 96 HD3 LYS 96 4.210 -21.012 -10.290
9 HE2 LYS 96 HE2 LYS 96 4.067 -23.158 -9.165
10 HE3 LYS 96 HE3 LYS 96 2.436 -23.394 -9.786
11 HZ1 LYS 96 HZ1 LYS 96 4.854 -23.109 -11.483
12 HZ2 LYS 96 HZ2 LYS 96 4.143 -24.586 -11.063
13 HZ3 LYS 96 HZ3 LYS 96 3.289 -23.476 -12.007
No H/Q in entry = 13
In of MODEL 18
1 H VAL 97 H VAL 97 3.582 -16.595 -7.678
2 HA VAL 97 HA VAL 97 2.721 -14.676 -9.596
3 HB VAL 97 HB VAL 97 3.822 -14.353 -6.798
4 HG11 VAL 97 HG11 VAL 97 2.637 -12.258 -8.603
5 HG12 VAL 97 HG12 VAL 97 3.037 -12.040 -6.900
6 HG13 VAL 97 HG13 VAL 97 4.315 -12.352 -8.073
7 HG21 VAL 97 HG21 VAL 97 1.617 -15.440 -7.052
8 HG22 VAL 97 HG22 VAL 97 1.559 -13.916 -6.167
9 HG23 VAL 97 HG23 VAL 97 1.029 -13.982 -7.853
No H/Q in entry = 9
In of MODEL 18
1 H GLU 98 H GLU 98 5.843 -15.327 -7.991
2 HA GLU 98 HA GLU 98 7.336 -13.253 -9.103
3 HB2 GLU 98 HB2 GLU 98 8.318 -16.054 -8.522
4 HB3 GLU 98 HB3 GLU 98 9.318 -14.619 -8.683
5 HG2 GLU 98 HG2 GLU 98 7.213 -14.955 -6.564
6 HG3 GLU 98 HG3 GLU 98 8.900 -15.403 -6.345
No H/Q in entry = 6
In of MODEL 18
1 H GLU 99 H GLU 99 6.346 -16.327 -10.439
2 HA GLU 99 HA GLU 99 7.964 -16.280 -12.759
3 HB2 GLU 99 HB2 GLU 99 5.253 -17.562 -12.355
4 HB3 GLU 99 HB3 GLU 99 6.378 -17.923 -13.659
5 HG2 GLU 99 HG2 GLU 99 6.855 -18.402 -10.725
6 HG3 GLU 99 HG3 GLU 99 6.457 -19.625 -11.930
No H/Q in entry = 6
In of MODEL 18
1 H ALA 100 H ALA 100 4.758 -15.005 -12.014
2 HA ALA 100 HA ALA 100 4.244 -14.095 -14.675
3 HB1 ALA 100 HB1 ALA 100 2.430 -14.597 -13.124
4 HB2 ALA 100 HB2 ALA 100 2.343 -12.925 -13.673
5 HB3 ALA 100 HB3 ALA 100 2.960 -13.294 -12.062
No H/Q in entry = 5
In of MODEL 18
1 H LEU 101 H LEU 101 5.610 -12.673 -11.766
2 HA LEU 101 HA LEU 101 5.769 -10.021 -12.814
3 HB2 LEU 101 HB2 LEU 101 7.205 -11.300 -10.493
4 HB3 LEU 101 HB3 LEU 101 7.187 -9.581 -10.843
5 HG LEU 101 HG LEU 101 4.782 -11.250 -10.097
6 HD11 LEU 101 HD11 LEU 101 6.326 -9.174 -8.551
7 HD12 LEU 101 HD12 LEU 101 4.829 -9.942 -8.026
8 HD13 LEU 101 HD13 LEU 101 6.290 -10.907 -8.229
9 HD21 LEU 101 HD21 LEU 101 5.036 -8.284 -10.596
10 HD22 LEU 101 HD22 LEU 101 4.164 -9.438 -11.602
11 HD23 LEU 101 HD23 LEU 101 3.604 -9.095 -9.966
No H/Q in entry = 11
In of MODEL 18
1 H HIS 102 H HIS 102 7.690 -12.854 -13.159
2 HA HIS 102 HA HIS 102 9.914 -11.292 -14.173
3 HB2 HIS 102 HB2 HIS 102 9.468 -14.268 -13.931
4 HB3 HIS 102 HB3 HIS 102 10.859 -13.591 -14.772
5 HD1 HIS 102 HD1 HIS 102 11.548 -15.305 -12.464
6 HD2 HIS 102 HD2 HIS 102 10.698 -11.260 -12.003
7 HE1 HIS 102 HE1 HIS 102 12.598 -14.637 -10.283
8 HE2 HIS 102 HE2 HIS 102 12.225 -12.153 -10.115
No H/Q in entry = 8
In of MODEL 18
1 H ALA 103 H ALA 103 7.443 -13.546 -15.367
2 HA ALA 103 HA ALA 103 8.249 -13.452 -18.064
3 HB1 ALA 103 HB1 ALA 103 5.530 -14.154 -16.977
4 HB2 ALA 103 HB2 ALA 103 6.902 -15.259 -17.061
5 HB3 ALA 103 HB3 ALA 103 6.194 -14.612 -18.544
No H/Q in entry = 5
In of MODEL 18
1 H VAL 104 H VAL 104 6.966 -10.937 -16.326
2 HA VAL 104 HA VAL 104 5.330 -9.859 -18.423
3 HB VAL 104 HB VAL 104 4.730 -9.501 -16.083
4 HG11 VAL 104 HG11 VAL 104 7.406 -8.169 -16.009
5 HG12 VAL 104 HG12 VAL 104 6.151 -7.851 -14.810
6 HG13 VAL 104 HG13 VAL 104 6.797 -9.484 -14.991
7 HG21 VAL 104 HG21 VAL 104 5.543 -7.003 -17.537
8 HG22 VAL 104 HG22 VAL 104 4.003 -7.848 -17.662
9 HG23 VAL 104 HG23 VAL 104 4.453 -7.056 -16.154
No H/Q in entry = 9
In of MODEL 18
1 H THR 105 H THR 105 5.865 -8.114 -19.720
2 HA THR 105 HA THR 105 8.567 -7.032 -19.439
3 HB THR 105 HB THR 105 8.814 -7.285 -21.996
4 HG1 THR 105 HG1 THR 105 6.642 -8.945 -21.415
5 HG21 THR 105 HG21 THR 105 9.072 -9.685 -20.183
6 HG22 THR 105 HG22 THR 105 9.889 -9.478 -21.733
7 HG23 THR 105 HG23 THR 105 10.267 -8.405 -20.386
No H/Q in entry = 7
In of MODEL 18
1 H ASP 106 H ASP 106 5.395 -6.261 -19.756
2 HA ASP 106 HA ASP 106 5.801 -3.907 -21.368
3 HB2 ASP 106 HB2 ASP 106 3.554 -5.069 -20.955
4 HB3 ASP 106 HB3 ASP 106 3.598 -4.357 -19.354
No H/Q in entry = 4
In of MODEL 18
1 H GLU 107 H GLU 107 6.883 -2.208 -20.688
2 HA GLU 107 HA GLU 107 8.374 -2.315 -18.381
3 HB2 GLU 107 HB2 GLU 107 7.754 -0.021 -20.225
4 HB3 GLU 107 HB3 GLU 107 8.894 0.119 -18.894
5 HG2 GLU 107 HG2 GLU 107 9.108 -1.929 -21.081
6 HG3 GLU 107 HG3 GLU 107 9.929 -0.368 -21.100
No H/Q in entry = 6
In of MODEL 18
1 H GLU 108 H GLU 108 5.444 -0.386 -18.927
2 HA GLU 108 HA GLU 108 5.477 1.028 -16.508
3 HB2 GLU 108 HB2 GLU 108 3.113 0.110 -18.149
4 HB3 GLU 108 HB3 GLU 108 3.027 1.277 -16.836
5 HG2 GLU 108 HG2 GLU 108 4.633 2.701 -18.100
6 HG3 GLU 108 HG3 GLU 108 4.488 1.572 -19.445
No H/Q in entry = 6
In of MODEL 18
1 H LYS 109 H LYS 109 4.104 -2.143 -17.296
2 HA LYS 109 HA LYS 109 2.942 -2.757 -14.835
3 HB2 LYS 109 HB2 LYS 109 4.307 -4.560 -16.842
4 HB3 LYS 109 HB3 LYS 109 3.352 -5.142 -15.486
5 HG2 LYS 109 HG2 LYS 109 1.392 -3.961 -16.413
6 HG3 LYS 109 HG3 LYS 109 2.377 -3.484 -17.797
7 HD2 LYS 109 HD2 LYS 109 2.735 -5.817 -18.373
8 HD3 LYS 109 HD3 LYS 109 1.825 -6.325 -16.953
9 HE2 LYS 109 HE2 LYS 109 -0.171 -5.203 -17.871
10 HE3 LYS 109 HE3 LYS 109 0.753 -4.789 -19.315
11 HZ1 LYS 109 HZ1 LYS 109 1.075 -7.155 -19.731
12 HZ2 LYS 109 HZ2 LYS 109 0.169 -7.542 -18.360
13 HZ3 LYS 109 HZ3 LYS 109 -0.569 -6.771 -19.669
No H/Q in entry = 13
In of MODEL 18
1 H LYS 110 H LYS 110 6.240 -3.179 -15.984
2 HA LYS 110 HA LYS 110 7.187 -4.475 -13.625
3 HB2 LYS 110 HB2 LYS 110 8.667 -3.143 -15.895
4 HB3 LYS 110 HB3 LYS 110 9.409 -4.160 -14.668
5 HG2 LYS 110 HG2 LYS 110 8.387 -6.088 -15.476
6 HG3 LYS 110 HG3 LYS 110 7.190 -5.178 -16.393
7 HD2 LYS 110 HD2 LYS 110 8.903 -6.198 -17.831
8 HD3 LYS 110 HD3 LYS 110 8.887 -4.443 -17.952
9 HE2 LYS 110 HE2 LYS 110 10.765 -5.836 -16.080
10 HE3 LYS 110 HE3 LYS 110 11.145 -5.697 -17.792
11 HZ1 LYS 110 HZ1 LYS 110 10.953 -3.286 -17.599
12 HZ2 LYS 110 HZ2 LYS 110 10.639 -3.434 -15.938
13 HZ3 LYS 110 HZ3 LYS 110 12.139 -3.901 -16.557
No H/Q in entry = 13
In of MODEL 18
1 H GLN 111 H GLN 111 6.749 -1.223 -14.558
2 HA GLN 111 HA GLN 111 8.424 -0.003 -12.639
3 HB2 GLN 111 HB2 GLN 111 7.385 1.298 -14.430
4 HB3 GLN 111 HB3 GLN 111 5.789 0.967 -13.769
5 HG2 GLN 111 HG2 GLN 111 6.509 3.202 -13.191
6 HG3 GLN 111 HG3 GLN 111 6.371 2.202 -11.747
7 HE21 GLN 111 HE21 GLN 111 7.761 3.389 -10.517
8 HE22 GLN 111 HE22 GLN 111 9.462 3.474 -10.825
No H/Q in entry = 8
In of MODEL 18
1 H TYR 112 H TYR 112 5.166 -1.306 -12.489
2 HA TYR 112 HA TYR 112 4.640 -0.505 -9.785
3 HB2 TYR 112 HB2 TYR 112 3.389 -2.660 -11.503
4 HB3 TYR 112 HB3 TYR 112 2.781 -2.162 -9.930
5 HD1 TYR 112 HD1 TYR 112 2.344 0.442 -9.725
6 HD2 TYR 112 HD2 TYR 112 2.455 -1.703 -13.391
7 HE1 TYR 112 HE1 TYR 112 1.010 2.210 -10.784
8 HE2 TYR 112 HE2 TYR 112 1.123 0.063 -14.467
9 HH TYR 112 HH TYR 112 -0.448 1.832 -13.827
No H/Q in entry = 9
In of MODEL 18
1 H ILE 113 H ILE 113 6.061 -3.319 -11.348
2 HA ILE 113 HA ILE 113 6.267 -5.004 -9.129
3 HB ILE 113 HB ILE 113 8.179 -4.684 -11.440
4 HG12 ILE 113 HG12 ILE 113 5.897 -6.583 -10.889
5 HG13 ILE 113 HG13 ILE 113 5.944 -5.326 -12.120
6 HG21 ILE 113 HG21 ILE 113 9.297 -5.746 -9.538
7 HG22 ILE 113 HG22 ILE 113 7.986 -6.920 -9.417
8 HG23 ILE 113 HG23 ILE 113 9.024 -6.903 -10.841
9 HD11 ILE 113 HD11 ILE 113 7.805 -7.676 -12.052
10 HD12 ILE 113 HD12 ILE 113 6.302 -7.623 -12.969
11 HD13 ILE 113 HD13 ILE 113 7.603 -6.499 -13.349
No H/Q in entry = 11
In of MODEL 18
1 H ALA 114 H ALA 114 8.466 -2.467 -10.283
2 HA ALA 114 HA ALA 114 10.306 -2.774 -8.133
3 HB1 ALA 114 HB1 ALA 114 10.995 -1.811 -10.264
4 HB2 ALA 114 HB2 ALA 114 11.280 -0.670 -8.950
5 HB3 ALA 114 HB3 ALA 114 9.894 -0.454 -10.023
No H/Q in entry = 5
In of MODEL 18
1 H ASP 115 H ASP 115 7.583 -0.587 -8.764
2 HA ASP 115 HA ASP 115 8.000 1.025 -6.478
3 HB2 ASP 115 HB2 ASP 115 5.611 0.589 -8.254
4 HB3 ASP 115 HB3 ASP 115 5.526 1.632 -6.839
No H/Q in entry = 4
In of MODEL 18
1 H PHE 116 H PHE 116 5.543 -1.503 -7.040
2 HA PHE 116 HA PHE 116 4.946 -1.284 -4.184
3 HB2 PHE 116 HB2 PHE 116 3.267 -1.524 -6.509
4 HB3 PHE 116 HB3 PHE 116 2.970 -2.872 -5.416
5 HD1 PHE 116 HD1 PHE 116 2.831 0.751 -5.828
6 HD2 PHE 116 HD2 PHE 116 2.005 -2.539 -3.257
7 HE1 PHE 116 HE1 PHE 116 1.450 2.217 -4.420
8 HE2 PHE 116 HE2 PHE 116 0.611 -1.074 -1.838
9 HZ PHE 116 HZ PHE 116 0.290 1.260 -2.429
No H/Q in entry = 9
In of MODEL 18
1 H GLY 117 H GLY 117 6.252 -3.431 -6.511
2 HA2 GLY 117 HA2 GLY 117 7.157 -5.543 -6.239
3 HA3 GLY 117 HA3 GLY 117 5.538 -5.948 -5.703
No H/Q in entry = 3
In of MODEL 18
1 HA PRO 118 HA PRO 118 9.075 -6.403 -2.378
2 HB2 PRO 118 HB2 PRO 118 9.685 -3.544 -1.841
3 HB3 PRO 118 HB3 PRO 118 10.776 -4.931 -1.922
4 HG2 PRO 118 HG2 PRO 118 10.695 -3.158 -3.905
5 HG3 PRO 118 HG3 PRO 118 10.872 -4.892 -4.240
6 HD2 PRO 118 HD2 PRO 118 8.459 -3.145 -4.497
7 HD3 PRO 118 HD3 PRO 118 9.007 -4.472 -5.539
No H/Q in entry = 7
In of MODEL 18
1 H ALA 119 H ALA 119 7.317 -3.339 -2.034
2 HA ALA 119 HA ALA 119 6.853 -3.627 0.777
3 HB1 ALA 119 HB1 ALA 119 5.476 -1.653 0.530
4 HB2 ALA 119 HB2 ALA 119 5.521 -1.815 -1.225
5 HB3 ALA 119 HB3 ALA 119 6.999 -1.451 -0.336
No H/Q in entry = 5
In of MODEL 18
1 H CYS 120 H CYS 120 5.016 -4.437 -2.105
2 HA CYS 120 HA CYS 120 2.585 -5.047 -0.778
3 HB2 CYS 120 HB2 CYS 120 2.748 -4.768 -3.237
4 HB3 CYS 120 HB3 CYS 120 3.664 -6.268 -3.327
No H/Q in entry = 4
In of MODEL 18
1 H LYS 121 H LYS 121 5.593 -6.743 -1.165
2 HA LYS 121 HA LYS 121 4.646 -9.318 -0.521
3 HB2 LYS 121 HB2 LYS 121 7.363 -8.085 -0.449
4 HB3 LYS 121 HB3 LYS 121 7.077 -9.758 0.033
5 HG2 LYS 121 HG2 LYS 121 6.014 -10.171 -2.158
6 HG3 LYS 121 HG3 LYS 121 6.429 -8.525 -2.634
7 HD2 LYS 121 HD2 LYS 121 8.757 -9.002 -2.482
8 HD3 LYS 121 HD3 LYS 121 8.427 -10.582 -1.766
9 HE2 LYS 121 HE2 LYS 121 7.479 -11.401 -3.785
10 HE3 LYS 121 HE3 LYS 121 7.465 -9.791 -4.506
11 HZ1 LYS 121 HZ1 LYS 121 9.973 -11.157 -3.733
12 HZ2 LYS 121 HZ2 LYS 121 9.278 -11.350 -5.263
13 HZ3 LYS 121 HZ3 LYS 121 9.789 -9.817 -4.746
No H/Q in entry = 13
In of MODEL 18
1 H LYS 122 H LYS 122 5.914 -6.726 1.618
2 HA LYS 122 HA LYS 122 5.435 -8.281 3.979
3 HB2 LYS 122 HB2 LYS 122 5.646 -6.193 5.233
4 HB3 LYS 122 HB3 LYS 122 6.944 -6.358 4.067
5 HG2 LYS 122 HG2 LYS 122 5.763 -4.815 2.565
6 HG3 LYS 122 HG3 LYS 122 4.512 -4.617 3.790
7 HD2 LYS 122 HD2 LYS 122 5.954 -2.763 4.026
8 HD3 LYS 122 HD3 LYS 122 6.347 -3.851 5.355
9 HE2 LYS 122 HE2 LYS 122 7.877 -3.852 2.767
10 HE3 LYS 122 HE3 LYS 122 8.290 -2.778 4.098
11 HZ1 LYS 122 HZ1 LYS 122 8.446 -4.866 5.487
12 HZ2 LYS 122 HZ2 LYS 122 8.398 -5.735 4.039
13 HZ3 LYS 122 HZ3 LYS 122 9.657 -4.652 4.324
No H/Q in entry = 13
In of MODEL 18
1 H ILE 123 H ILE 123 3.514 -6.219 1.923
2 HA ILE 123 HA ILE 123 1.362 -5.834 3.688
3 HB ILE 123 HB ILE 123 1.542 -5.659 0.715
4 HG12 ILE 123 HG12 ILE 123 1.146 -3.555 2.841
5 HG13 ILE 123 HG13 ILE 123 2.727 -4.037 2.236
6 HG21 ILE 123 HG21 ILE 123 -0.821 -4.991 2.460
7 HG22 ILE 123 HG22 ILE 123 -0.662 -4.583 0.751
8 HG23 ILE 123 HG23 ILE 123 -0.750 -6.273 1.251
9 HD11 ILE 123 HD11 ILE 123 0.545 -2.988 0.480
10 HD12 ILE 123 HD12 ILE 123 1.769 -1.967 1.240
11 HD13 ILE 123 HD13 ILE 123 2.247 -3.210 0.086
No H/Q in entry = 11
In of MODEL 18
1 H TYR 124 H TYR 124 1.762 -8.075 1.045
2 HA TYR 124 HA TYR 124 -0.411 -9.801 1.759
3 HB2 TYR 124 HB2 TYR 124 1.589 -9.664 -0.397
4 HB3 TYR 124 HB3 TYR 124 1.103 -11.295 0.067
5 HD1 TYR 124 HD1 TYR 124 -0.044 -8.103 -1.351
6 HD2 TYR 124 HD2 TYR 124 -1.148 -12.078 -0.313
7 HE1 TYR 124 HE1 TYR 124 -2.118 -7.862 -2.652
8 HE2 TYR 124 HE2 TYR 124 -3.222 -11.849 -1.617
9 HH TYR 124 HH TYR 124 -3.753 -9.283 -3.783
No H/Q in entry = 9
In of MODEL 18
1 H GLY 125 H GLY 125 1.252 -9.430 3.917
2 HA2 GLY 125 HA2 GLY 125 2.780 -10.365 5.433
3 HA3 GLY 125 HA3 GLY 125 3.790 -9.770 4.152
No H/Q in entry = 3
In of MODEL 18
1 H VAL 126 H VAL 126 2.901 -12.056 2.424
2 HA VAL 126 HA VAL 126 3.849 -14.486 3.233
3 HB VAL 126 HB VAL 126 3.005 -14.236 1.015
4 HG11 VAL 126 HG11 VAL 126 3.623 -11.912 0.629
5 HG12 VAL 126 HG12 VAL 126 5.316 -12.378 0.462
6 HG13 VAL 126 HG13 VAL 126 4.130 -12.927 -0.721
7 HG21 VAL 126 HG21 VAL 126 5.948 -14.874 0.933
8 HG22 VAL 126 HG22 VAL 126 4.613 -16.006 1.161
9 HG23 VAL 126 HG23 VAL 126 4.822 -15.184 -0.386
No H/Q in entry = 9
In of MODEL 18
1 H HIS 127 H HIS 127 5.724 -11.597 2.458
2 HA HIS 127 HA HIS 127 8.241 -12.973 2.904
3 HB2 HIS 127 HB2 HIS 127 8.100 -11.210 1.182
4 HB3 HIS 127 HB3 HIS 127 7.669 -10.035 2.419
5 HD1 HIS 127 HD1 HIS 127 9.554 -8.844 3.545
6 HD2 HIS 127 HD2 HIS 127 10.827 -12.225 1.486
7 HE1 HIS 127 HE1 HIS 127 12.067 -8.777 3.615
8 HE2 HIS 127 HE2 HIS 127 12.815 -10.768 2.267
No H/Q in entry = 8
In of MODEL 18
1 H THR 128 H THR 128 7.623 -13.642 5.076
2 HA THR 128 HA THR 128 7.622 -11.532 7.091
3 HB THR 128 HB THR 128 7.477 -14.524 7.520
4 HG1 THR 128 HG1 THR 128 5.612 -12.765 6.548
5 HG21 THR 128 HG21 THR 128 6.704 -12.190 9.276
6 HG22 THR 128 HG22 THR 128 6.463 -13.894 9.668
7 HG23 THR 128 HG23 THR 128 8.097 -13.248 9.507
No H/Q in entry = 7
In of MODEL 18
1 H SER 129 H SER 129 9.599 -14.186 5.913
2 HA SER 129 HA SER 129 11.927 -12.979 7.177
3 HB2 SER 129 HB2 SER 129 11.243 -15.913 7.517
4 HB3 SER 129 HB3 SER 129 12.691 -15.105 8.119
5 HG SER 129 HG SER 129 10.526 -13.769 8.946
No H/Q in entry = 5
In of MODEL 19
1 HA2 GLY -4 HA2 GLY -4 -7.370 -5.843 -16.617
2 HA3 GLY -4 HA3 GLY -4 -7.055 -4.942 -18.094
3 H1 GLY -4 H1 GLY -4 -4.994 -6.044 -16.273
4 H2 GLY -4 H2 GLY -4 -4.690 -5.178 -17.692
No H/Q in entry = 4
In of MODEL 19
1 H SER -3 H SER -3 -8.459 -4.184 -15.615
2 HA SER -3 HA SER -3 -8.683 -2.459 -14.170
3 HB2 SER -3 HB2 SER -3 -5.668 -2.305 -14.347
4 HB3 SER -3 HB3 SER -3 -6.648 -1.345 -13.242
5 HG SER -3 HG SER -3 -5.738 -3.382 -12.403
No H/Q in entry = 5
In of MODEL 19
1 HA PRO -2 HA PRO -2 -8.787 0.721 -17.459
2 HB2 PRO -2 HB2 PRO -2 -11.385 1.293 -16.239
3 HB3 PRO -2 HB3 PRO -2 -11.012 0.866 -17.909
4 HG2 PRO -2 HG2 PRO -2 -12.315 -0.818 -16.249
5 HG3 PRO -2 HG3 PRO -2 -11.220 -1.393 -17.519
6 HD2 PRO -2 HD2 PRO -2 -10.718 -1.091 -14.579
7 HD3 PRO -2 HD3 PRO -2 -10.249 -2.412 -15.671
No H/Q in entry = 7
In of MODEL 19
1 H GLU -1 H GLU -1 -7.111 1.352 -15.688
2 HA GLU -1 HA GLU -1 -8.103 3.051 -13.588
3 HB2 GLU -1 HB2 GLU -1 -5.677 3.333 -13.058
4 HB3 GLU -1 HB3 GLU -1 -6.218 1.662 -13.084
5 HG2 GLU -1 HG2 GLU -1 -5.344 1.577 -15.467
6 HG3 GLU -1 HG3 GLU -1 -4.553 3.110 -15.114
No H/Q in entry = 6
In of MODEL 19
1 H PHE 0 H PHE 0 -8.688 5.064 -13.932
2 HA PHE 0 HA PHE 0 -7.532 6.649 -16.068
3 HB2 PHE 0 HB2 PHE 0 -9.519 7.403 -13.906
4 HB3 PHE 0 HB3 PHE 0 -9.069 8.414 -15.276
5 HD1 PHE 0 HD1 PHE 0 -9.620 7.623 -17.596
6 HD2 PHE 0 HD2 PHE 0 -11.187 5.767 -14.105
7 HE1 PHE 0 HE1 PHE 0 -11.395 6.585 -18.949
8 HE2 PHE 0 HE2 PHE 0 -12.964 4.724 -15.450
9 HZ PHE 0 HZ PHE 0 -13.068 5.132 -17.876
No H/Q in entry = 9
In of MODEL 19
1 H HIS 1 H HIS 1 -7.145 6.037 -12.739
2 HA HIS 1 HA HIS 1 -4.899 7.936 -12.672
3 HB2 HIS 1 HB2 HIS 1 -6.672 7.065 -10.373
4 HB3 HIS 1 HB3 HIS 1 -5.187 7.989 -10.185
5 HD1 HIS 1 HD1 HIS 1 -8.677 8.486 -10.273
6 HD2 HIS 1 HD2 HIS 1 -5.431 10.510 -11.902
7 HE1 HIS 1 HE1 HIS 1 -9.498 10.815 -10.741
8 HE2 HIS 1 HE2 HIS 1 -7.470 12.062 -11.571
No H/Q in entry = 8
In of MODEL 19
1 H HIS 2 H HIS 2 -2.954 7.011 -12.270
2 HA HIS 2 HA HIS 2 -2.856 4.137 -12.293
3 HB2 HIS 2 HB2 HIS 2 -0.673 6.223 -12.279
4 HB3 HIS 2 HB3 HIS 2 -0.367 4.491 -12.350
5 HD1 HIS 2 HD1 HIS 2 -1.978 3.362 -14.445
6 HD2 HIS 2 HD2 HIS 2 -0.590 7.278 -14.758
7 HE1 HIS 2 HE1 HIS 2 -2.062 3.927 -16.898
8 HE2 HIS 2 HE2 HIS 2 -1.187 6.282 -17.069
No H/Q in entry = 8
In of MODEL 19
1 H PHE 3 H PHE 3 -4.056 4.285 -10.143
2 HA PHE 3 HA PHE 3 -4.139 3.871 -7.914
3 HB2 PHE 3 HB2 PHE 3 -1.351 2.770 -8.311
4 HB3 PHE 3 HB3 PHE 3 -2.508 2.304 -7.067
5 HD1 PHE 3 HD1 PHE 3 -4.872 1.540 -8.111
6 HD2 PHE 3 HD2 PHE 3 -1.101 1.328 -10.070
7 HE1 PHE 3 HE1 PHE 3 -5.743 -0.216 -9.591
8 HE2 PHE 3 HE2 PHE 3 -1.966 -0.432 -11.555
9 HZ PHE 3 HZ PHE 3 -4.292 -1.205 -11.317
No H/Q in entry = 9
In of MODEL 19
1 H THR 4 H THR 4 -3.780 6.410 -8.042
2 HA THR 4 HA THR 4 -1.306 7.258 -6.823
3 HB THR 4 HB THR 4 -2.328 9.542 -6.994
4 HG1 THR 4 HG1 THR 4 -4.256 9.666 -8.287
5 HG21 THR 4 HG21 THR 4 -2.251 7.902 -9.527
6 HG22 THR 4 HG22 THR 4 -2.200 9.663 -9.453
7 HG23 THR 4 HG23 THR 4 -0.881 8.713 -8.766
No H/Q in entry = 7
In of MODEL 19
1 H LEU 5 H LEU 5 -1.511 8.879 -4.973
2 HA LEU 5 HA LEU 5 -2.685 7.500 -2.805
3 HB2 LEU 5 HB2 LEU 5 -1.538 10.283 -2.867
4 HB3 LEU 5 HB3 LEU 5 -1.861 9.335 -1.429
5 HG LEU 5 HG LEU 5 0.211 8.761 -3.543
6 HD11 LEU 5 HD11 LEU 5 0.795 10.554 -2.012
7 HD12 LEU 5 HD12 LEU 5 0.433 9.514 -0.635
8 HD13 LEU 5 HD13 LEU 5 1.776 9.123 -1.705
9 HD21 LEU 5 HD21 LEU 5 -0.548 7.165 -1.098
10 HD22 LEU 5 HD22 LEU 5 -0.728 6.665 -2.778
11 HD23 LEU 5 HD23 LEU 5 0.881 6.882 -2.092
No H/Q in entry = 11
In of MODEL 19
1 H GLU 6 H GLU 6 -3.591 10.545 -4.458
2 HA GLU 6 HA GLU 6 -5.917 11.028 -2.922
3 HB2 GLU 6 HB2 GLU 6 -5.353 11.611 -5.840
4 HB3 GLU 6 HB3 GLU 6 -6.752 12.219 -4.963
5 HG2 GLU 6 HG2 GLU 6 -5.273 13.422 -3.440
6 HG3 GLU 6 HG3 GLU 6 -3.873 12.813 -4.323
No H/Q in entry = 6
In of MODEL 19
1 H SER 7 H SER 7 -5.459 9.098 -5.946
2 HA SER 7 HA SER 7 -8.029 8.221 -6.251
3 HB2 SER 7 HB2 SER 7 -6.184 7.744 -7.821
4 HB3 SER 7 HB3 SER 7 -5.522 6.581 -6.676
5 HG SER 7 HG SER 7 -8.141 6.085 -7.183
No H/Q in entry = 5
In of MODEL 19
1 H SER 8 H SER 8 -5.865 7.379 -3.673
2 HA SER 8 HA SER 8 -7.498 5.063 -3.019
3 HB2 SER 8 HB2 SER 8 -4.827 5.835 -1.867
4 HB3 SER 8 HB3 SER 8 -5.733 4.345 -1.543
5 HG SER 8 HG SER 8 -4.635 5.203 -4.028
No H/Q in entry = 5
In of MODEL 19
1 H LEU 9 H LEU 9 -7.250 8.332 -1.981
2 HA LEU 9 HA LEU 9 -7.024 8.047 0.749
3 HB2 LEU 9 HB2 LEU 9 -8.352 10.192 -0.843
4 HB3 LEU 9 HB3 LEU 9 -7.988 10.315 0.869
5 HG LEU 9 HG LEU 9 -5.913 9.802 -1.244
6 HD11 LEU 9 HD11 LEU 9 -6.999 11.921 -1.604
7 HD12 LEU 9 HD12 LEU 9 -6.691 12.384 0.071
8 HD13 LEU 9 HD13 LEU 9 -5.343 12.140 -1.039
9 HD21 LEU 9 HD21 LEU 9 -5.713 10.590 1.661
10 HD22 LEU 9 HD22 LEU 9 -5.263 9.033 0.958
11 HD23 LEU 9 HD23 LEU 9 -4.355 10.493 0.539
No H/Q in entry = 11
In of MODEL 19
1 H ASP 10 H ASP 10 -9.959 7.902 -1.087
2 HA ASP 10 HA ASP 10 -11.500 7.532 1.371
3 HB2 ASP 10 HB2 ASP 10 -12.403 7.744 -1.512
4 HB3 ASP 10 HB3 ASP 10 -13.481 7.550 -0.135
No H/Q in entry = 4
In of MODEL 19
1 H THR 11 H THR 11 -9.677 5.652 -0.559
2 HA THR 11 HA THR 11 -11.461 3.353 -0.232
3 HB THR 11 HB THR 11 -10.350 2.343 -2.241
4 HG1 THR 11 HG1 THR 11 -9.623 4.608 -3.454
5 HG21 THR 11 HG21 THR 11 -11.873 4.915 -2.667
6 HG22 THR 11 HG22 THR 11 -11.649 3.651 -3.875
7 HG23 THR 11 HG23 THR 11 -12.571 3.316 -2.411
No H/Q in entry = 7
In of MODEL 19
1 H HIS 12 H HIS 12 -8.314 2.932 -1.552
2 HA HIS 12 HA HIS 12 -7.629 0.968 0.303
3 HB2 HIS 12 HB2 HIS 12 -5.529 2.464 -1.244
4 HB3 HIS 12 HB3 HIS 12 -5.538 0.774 -0.774
5 HD1 HIS 12 HD1 HIS 12 -5.613 2.529 -3.716
6 HD2 HIS 12 HD2 HIS 12 -8.190 -0.308 -2.126
7 HE1 HIS 12 HE1 HIS 12 -6.804 1.515 -5.687
8 HE2 HIS 12 HE2 HIS 12 -8.514 -0.035 -4.679
No H/Q in entry = 8
In of MODEL 19
1 H LEU 13 H LEU 13 -6.892 4.425 0.316
2 HA LEU 13 HA LEU 13 -5.090 3.966 2.599
3 HB2 LEU 13 HB2 LEU 13 -5.064 5.921 0.372
4 HB3 LEU 13 HB3 LEU 13 -4.467 6.456 1.928
5 HG LEU 13 HG LEU 13 -2.607 5.714 0.591
6 HD11 LEU 13 HD11 LEU 13 -2.585 5.222 3.010
7 HD12 LEU 13 HD12 LEU 13 -3.192 3.608 2.657
8 HD13 LEU 13 HD13 LEU 13 -1.610 4.104 2.060
9 HD21 LEU 13 HD21 LEU 13 -4.063 3.088 0.342
10 HD22 LEU 13 HD22 LEU 13 -3.732 4.235 -0.956
11 HD23 LEU 13 HD23 LEU 13 -2.403 3.387 -0.171
No H/Q in entry = 11
In of MODEL 19
1 H LYS 14 H LYS 14 -8.028 4.272 2.597
2 HA LYS 14 HA LYS 14 -8.681 6.854 3.578
3 HB2 LYS 14 HB2 LYS 14 -10.865 5.934 4.111
4 HB3 LYS 14 HB3 LYS 14 -10.362 5.470 2.499
5 HG2 LYS 14 HG2 LYS 14 -9.783 3.248 3.311
6 HG3 LYS 14 HG3 LYS 14 -10.256 3.718 4.947
7 HD2 LYS 14 HD2 LYS 14 -12.532 4.020 4.277
8 HD3 LYS 14 HD3 LYS 14 -12.114 3.821 2.575
9 HE2 LYS 14 HE2 LYS 14 -11.499 1.498 2.992
10 HE3 LYS 14 HE3 LYS 14 -11.880 1.694 4.701
11 HZ1 LYS 14 HZ1 LYS 14 -13.820 1.992 2.474
12 HZ2 LYS 14 HZ2 LYS 14 -13.685 0.634 3.471
13 HZ3 LYS 14 HZ3 LYS 14 -14.173 2.118 4.121
No H/Q in entry = 13
In of MODEL 19
1 H TRP 15 H TRP 15 -7.236 4.181 5.037
2 HA TRP 15 HA TRP 15 -8.161 4.614 7.711
3 HB2 TRP 15 HB2 TRP 15 -6.303 3.052 8.321
4 HB3 TRP 15 HB3 TRP 15 -7.401 2.404 7.107
5 HD1 TRP 15 HD1 TRP 15 -6.477 2.212 4.597
6 HE1 TRP 15 HE1 TRP 15 -4.088 2.050 3.670
7 HE3 TRP 15 HE3 TRP 15 -3.905 3.813 8.713
8 HZ2 TRP 15 HZ2 TRP 15 -1.452 2.526 4.569
9 HZ3 TRP 15 HZ3 TRP 15 -1.450 3.930 8.597
10 HH2 TRP 15 HH2 TRP 15 -0.251 3.299 6.568
No H/Q in entry = 10
In of MODEL 19
1 H LEU 16 H LEU 16 -6.016 6.245 5.686
2 HA LEU 16 HA LEU 16 -4.218 7.212 7.701
3 HB2 LEU 16 HB2 LEU 16 -4.951 8.310 4.976
4 HB3 LEU 16 HB3 LEU 16 -3.731 9.012 6.015
5 HG LEU 16 HG LEU 16 -3.574 6.209 4.891
6 HD11 LEU 16 HD11 LEU 16 -3.530 7.938 3.129
7 HD12 LEU 16 HD12 LEU 16 -2.170 8.711 3.954
8 HD13 LEU 16 HD13 LEU 16 -1.995 7.084 3.290
9 HD21 LEU 16 HD21 LEU 16 -1.559 7.957 6.304
10 HD22 LEU 16 HD22 LEU 16 -2.241 6.436 6.885
11 HD23 LEU 16 HD23 LEU 16 -1.168 6.449 5.481
No H/Q in entry = 11
In of MODEL 19
1 H SER 17 H SER 17 -4.353 9.062 8.841
2 HA SER 17 HA SER 17 -6.994 10.174 9.182
3 HB2 SER 17 HB2 SER 17 -4.377 10.902 10.509
4 HB3 SER 17 HB3 SER 17 -5.965 11.487 10.998
5 HG SER 17 HG SER 17 -5.870 8.770 10.780
No H/Q in entry = 5
In of MODEL 19
1 H GLN 18 H GLN 18 -7.385 12.557 9.069
2 HA GLN 18 HA GLN 18 -6.883 13.466 6.505
3 HB2 GLN 18 HB2 GLN 18 -7.552 15.114 8.952
4 HB3 GLN 18 HB3 GLN 18 -7.661 15.693 7.294
5 HG2 GLN 18 HG2 GLN 18 -9.245 13.427 8.485
6 HG3 GLN 18 HG3 GLN 18 -9.838 15.054 8.153
7 HE21 GLN 18 HE21 GLN 18 -10.129 15.706 6.016
8 HE22 GLN 18 HE22 GLN 18 -10.265 14.561 4.727
No H/Q in entry = 8
In of MODEL 19
1 H GLU 19 H GLU 19 -5.202 14.382 9.494
2 HA GLU 19 HA GLU 19 -3.467 16.248 8.395
3 HB2 GLU 19 HB2 GLU 19 -2.972 14.338 10.691
4 HB3 GLU 19 HB3 GLU 19 -2.153 15.850 10.402
5 HG2 GLU 19 HG2 GLU 19 -4.175 17.093 10.788
6 HG3 GLU 19 HG3 GLU 19 -5.083 15.593 10.963
No H/Q in entry = 6
In of MODEL 19
1 H GLN 20 H GLN 20 -3.287 12.721 8.513
2 HA GLN 20 HA GLN 20 -0.606 12.596 7.500
3 HB2 GLN 20 HB2 GLN 20 -2.762 10.459 7.413
4 HB3 GLN 20 HB3 GLN 20 -1.039 10.206 7.175
5 HG2 GLN 20 HG2 GLN 20 -0.597 10.793 9.474
6 HG3 GLN 20 HG3 GLN 20 -2.296 11.181 9.731
7 HE21 GLN 20 HE21 GLN 20 0.042 8.653 9.403
8 HE22 GLN 20 HE22 GLN 20 -0.998 7.353 9.866
No H/Q in entry = 8
In of MODEL 19
1 H LYS 21 H LYS 21 -3.852 12.191 6.070
2 HA LYS 21 HA LYS 21 -3.120 11.654 3.442
3 HB2 LYS 21 HB2 LYS 21 -5.444 13.320 4.423
4 HB3 LYS 21 HB3 LYS 21 -5.279 12.699 2.788
5 HG2 LYS 21 HG2 LYS 21 -5.353 10.412 3.650
6 HG3 LYS 21 HG3 LYS 21 -5.533 11.045 5.290
7 HD2 LYS 21 HD2 LYS 21 -7.617 12.135 4.659
8 HD3 LYS 21 HD3 LYS 21 -7.429 11.562 3.001
9 HE2 LYS 21 HE2 LYS 21 -7.670 9.283 3.696
10 HE3 LYS 21 HE3 LYS 21 -7.641 9.751 5.398
11 HZ1 LYS 21 HZ1 LYS 21 -9.705 10.992 5.018
12 HZ2 LYS 21 HZ2 LYS 21 -9.748 10.439 3.421
13 HZ3 LYS 21 HZ3 LYS 21 -9.891 9.343 4.703
No H/Q in entry = 13
In of MODEL 19
1 H ASP 22 H ASP 22 -3.747 14.798 4.933
2 HA ASP 22 HA ASP 22 -3.014 16.404 2.740
3 HB2 ASP 22 HB2 ASP 22 -4.289 17.146 4.782
4 HB3 ASP 22 HB3 ASP 22 -2.773 17.107 5.667
No H/Q in entry = 4
In of MODEL 19
1 H GLU 23 H GLU 23 -1.064 15.060 5.426
2 HA GLU 23 HA GLU 23 1.344 16.300 4.775
3 HB2 GLU 23 HB2 GLU 23 0.663 14.697 6.752
4 HB3 GLU 23 HB3 GLU 23 1.297 13.455 5.673
5 HG2 GLU 23 HG2 GLU 23 3.388 14.615 5.521
6 HG3 GLU 23 HG3 GLU 23 2.745 15.915 6.514
No H/Q in entry = 6
In of MODEL 19
1 H LEU 24 H LEU 24 0.001 13.181 3.611
2 HA LEU 24 HA LEU 24 2.181 12.528 1.953
3 HB2 LEU 24 HB2 LEU 24 -0.727 11.740 1.980
4 HB3 LEU 24 HB3 LEU 24 0.369 11.125 0.766
5 HG LEU 24 HG LEU 24 -0.149 9.655 2.809
6 HD11 LEU 24 HD11 LEU 24 2.707 10.180 2.040
7 HD12 LEU 24 HD12 LEU 24 2.112 8.750 2.894
8 HD13 LEU 24 HD13 LEU 24 1.584 9.076 1.241
9 HD21 LEU 24 HD21 LEU 24 1.619 11.693 4.067
10 HD22 LEU 24 HD22 LEU 24 0.113 10.989 4.664
11 HD23 LEU 24 HD23 LEU 24 1.589 10.025 4.626
No H/Q in entry = 11
In of MODEL 19
1 H LEU 25 H LEU 25 -0.746 14.416 1.422
2 HA LEU 25 HA LEU 25 -0.471 14.743 -1.369
3 HB2 LEU 25 HB2 LEU 25 -1.870 16.458 0.681
4 HB3 LEU 25 HB3 LEU 25 -2.017 16.668 -1.049
5 HG LEU 25 HG LEU 25 -2.917 14.267 0.537
6 HD11 LEU 25 HD11 LEU 25 -4.467 16.380 -0.950
7 HD12 LEU 25 HD12 LEU 25 -5.154 14.961 -0.162
8 HD13 LEU 25 HD13 LEU 25 -4.360 16.206 0.802
9 HD21 LEU 25 HD21 LEU 25 -3.047 14.803 -2.426
10 HD22 LEU 25 HD22 LEU 25 -2.097 13.553 -1.626
11 HD23 LEU 25 HD23 LEU 25 -3.856 13.475 -1.596
No H/Q in entry = 11
In of MODEL 19
1 H LYS 26 H LYS 26 0.672 16.641 1.382
2 HA LYS 26 HA LYS 26 1.737 18.803 -0.123
3 HB2 LYS 26 HB2 LYS 26 2.483 17.750 2.611
4 HB3 LYS 26 HB3 LYS 26 3.107 19.243 1.926
5 HG2 LYS 26 HG2 LYS 26 0.189 18.685 2.421
6 HG3 LYS 26 HG3 LYS 26 1.245 19.568 3.523
7 HD2 LYS 26 HD2 LYS 26 0.783 20.389 0.661
8 HD3 LYS 26 HD3 LYS 26 -0.182 20.989 2.008
9 HE2 LYS 26 HE2 LYS 26 2.806 21.284 1.712
10 HE3 LYS 26 HE3 LYS 26 1.614 22.544 1.403
11 HZ1 LYS 26 HZ1 LYS 26 0.936 22.368 3.744
12 HZ2 LYS 26 HZ2 LYS 26 2.169 21.242 4.012
13 HZ3 LYS 26 HZ3 LYS 26 2.551 22.831 3.578
No H/Q in entry = 13
In of MODEL 19
1 H MET 27 H MET 27 3.179 15.833 1.145
2 HA MET 27 HA MET 27 5.750 16.140 0.325
3 HB2 MET 27 HB2 MET 27 4.146 13.586 0.168
4 HB3 MET 27 HB3 MET 27 5.898 13.695 0.215
5 HG2 MET 27 HG2 MET 27 5.788 14.648 2.458
6 HG3 MET 27 HG3 MET 27 4.029 14.583 2.399
7 HE1 MET 27 HE1 MET 27 7.321 12.490 2.297
8 HE2 MET 27 HE2 MET 27 6.715 10.835 2.347
9 HE3 MET 27 HE3 MET 27 6.441 11.832 0.920
No H/Q in entry = 9
In of MODEL 19
1 H LYS 28 H LYS 28 3.184 14.629 -1.645
2 HA LYS 28 HA LYS 28 4.690 14.277 -3.973
3 HB2 LYS 28 HB2 LYS 28 2.565 13.196 -3.744
4 HB3 LYS 28 HB3 LYS 28 1.730 14.744 -3.661
5 HG2 LYS 28 HG2 LYS 28 2.050 15.182 -5.925
6 HG3 LYS 28 HG3 LYS 28 3.359 14.007 -6.063
7 HD2 LYS 28 HD2 LYS 28 0.525 13.214 -5.454
8 HD3 LYS 28 HD3 LYS 28 1.135 13.366 -7.102
9 HE2 LYS 28 HE2 LYS 28 2.928 11.739 -6.509
10 HE3 LYS 28 HE3 LYS 28 2.142 11.515 -4.947
11 HZ1 LYS 28 HZ1 LYS 28 0.887 10.985 -7.582
12 HZ2 LYS 28 HZ2 LYS 28 1.518 9.803 -6.552
13 HZ3 LYS 28 HZ3 LYS 28 0.179 10.718 -6.072
No H/Q in entry = 13
In of MODEL 19
1 H LYS 29 H LYS 29 2.837 17.097 -2.897
2 HA LYS 29 HA LYS 29 3.173 18.514 -5.343
3 HB2 LYS 29 HB2 LYS 29 2.286 19.400 -2.607
4 HB3 LYS 29 HB3 LYS 29 2.373 20.495 -3.980
5 HG2 LYS 29 HG2 LYS 29 0.704 17.992 -3.852
6 HG3 LYS 29 HG3 LYS 29 0.107 19.631 -3.602
7 HD2 LYS 29 HD2 LYS 29 0.747 20.227 -5.879
8 HD3 LYS 29 HD3 LYS 29 1.401 18.609 -6.133
9 HE2 LYS 29 HE2 LYS 29 -0.794 18.787 -7.139
10 HE3 LYS 29 HE3 LYS 29 -0.837 17.665 -5.783
11 HZ1 LYS 29 HZ1 LYS 29 -1.727 20.493 -5.686
12 HZ2 LYS 29 HZ2 LYS 29 -2.749 19.153 -5.802
13 HZ3 LYS 29 HZ3 LYS 29 -1.810 19.386 -4.415
No H/Q in entry = 13
In of MODEL 19
1 H ASP 30 H ASP 30 5.037 18.410 -2.360
2 HA ASP 30 HA ASP 30 6.649 20.660 -3.200
3 HB2 ASP 30 HB2 ASP 30 6.786 18.807 -0.828
4 HB3 ASP 30 HB3 ASP 30 8.099 19.923 -1.185
No H/Q in entry = 4
In of MODEL 19
1 H GLY 31 H GLY 31 6.486 17.561 -4.143
2 HA2 GLY 31 HA2 GLY 31 9.030 17.889 -5.501
3 HA3 GLY 31 HA3 GLY 31 7.770 16.733 -5.907
No H/Q in entry = 3
In of MODEL 19
1 H LYS 32 H LYS 32 7.715 16.039 -2.935
2 HA LYS 32 HA LYS 32 10.122 14.604 -2.489
3 HB2 LYS 32 HB2 LYS 32 7.339 14.134 -1.389
4 HB3 LYS 32 HB3 LYS 32 8.803 13.357 -0.800
5 HG2 LYS 32 HG2 LYS 32 8.208 16.309 -0.718
6 HG3 LYS 32 HG3 LYS 32 8.152 15.191 0.647
7 HD2 LYS 32 HD2 LYS 32 10.533 14.773 0.440
8 HD3 LYS 32 HD3 LYS 32 10.612 15.802 -0.991
9 HE2 LYS 32 HE2 LYS 32 9.958 17.730 0.343
10 HE3 LYS 32 HE3 LYS 32 9.829 16.708 1.773
11 HZ1 LYS 32 HZ1 LYS 32 12.205 16.221 1.557
12 HZ2 LYS 32 HZ2 LYS 32 12.306 17.272 0.236
13 HZ3 LYS 32 HZ3 LYS 32 11.918 17.874 1.767
No H/Q in entry = 13
In of MODEL 19
1 H ALA 33 H ALA 33 10.565 12.495 -2.929
2 HA ALA 33 HA ALA 33 9.621 11.624 -5.456
3 HB1 ALA 33 HB1 ALA 33 11.930 11.239 -4.594
4 HB2 ALA 33 HB2 ALA 33 11.266 10.013 -3.515
5 HB3 ALA 33 HB3 ALA 33 11.156 9.803 -5.259
No H/Q in entry = 5
In of MODEL 19
1 H LYS 34 H LYS 34 8.536 9.669 -5.995
2 HA LYS 34 HA LYS 34 6.267 9.085 -4.468
3 HB2 LYS 34 HB2 LYS 34 6.797 8.632 -6.965
4 HB3 LYS 34 HB3 LYS 34 7.486 7.124 -6.390
5 HG2 LYS 34 HG2 LYS 34 4.713 7.855 -5.582
6 HG3 LYS 34 HG3 LYS 34 5.007 7.243 -7.207
7 HD2 LYS 34 HD2 LYS 34 5.905 5.832 -4.703
8 HD3 LYS 34 HD3 LYS 34 4.369 5.511 -5.506
9 HE2 LYS 34 HE2 LYS 34 7.100 5.224 -6.757
10 HE3 LYS 34 HE3 LYS 34 6.107 3.901 -6.152
11 HZ1 LYS 34 HZ1 LYS 34 4.420 4.477 -7.787
12 HZ2 LYS 34 HZ2 LYS 34 5.388 5.732 -8.376
13 HZ3 LYS 34 HZ3 LYS 34 5.899 4.122 -8.539
No H/Q in entry = 13
In of MODEL 19
1 H LYS 35 H LYS 35 9.432 7.533 -4.630
2 HA LYS 35 HA LYS 35 8.984 5.376 -2.920
3 HB2 LYS 35 HB2 LYS 35 11.504 7.023 -3.207
4 HB3 LYS 35 HB3 LYS 35 11.409 5.418 -2.497
5 HG2 LYS 35 HG2 LYS 35 10.718 6.085 -5.348
6 HG3 LYS 35 HG3 LYS 35 12.248 5.396 -4.807
7 HD2 LYS 35 HD2 LYS 35 11.224 3.377 -4.160
8 HD3 LYS 35 HD3 LYS 35 9.607 4.080 -4.240
9 HE2 LYS 35 HE2 LYS 35 9.964 2.644 -6.146
10 HE3 LYS 35 HE3 LYS 35 9.855 4.322 -6.675
11 HZ1 LYS 35 HZ1 LYS 35 12.316 4.359 -6.703
12 HZ2 LYS 35 HZ2 LYS 35 12.318 2.700 -6.377
13 HZ3 LYS 35 HZ3 LYS 35 11.642 3.277 -7.817
No H/Q in entry = 13
In of MODEL 19
1 H GLU 36 H GLU 36 9.102 8.749 -2.154
2 HA GLU 36 HA GLU 36 9.785 8.340 0.617
3 HB2 GLU 36 HB2 GLU 36 8.778 10.812 -0.796
4 HB3 GLU 36 HB3 GLU 36 9.400 10.753 0.849
5 HG2 GLU 36 HG2 GLU 36 11.547 9.882 -0.115
6 HG3 GLU 36 HG3 GLU 36 10.895 10.273 -1.696
No H/Q in entry = 6
In of MODEL 19
1 H LEU 37 H LEU 37 7.040 8.581 -1.373
2 HA LEU 37 HA LEU 37 5.103 8.875 0.723
3 HB2 LEU 37 HB2 LEU 37 4.762 7.931 -2.125
4 HB3 LEU 37 HB3 LEU 37 3.476 8.445 -1.048
5 HG LEU 37 HG LEU 37 5.725 10.270 -1.879
6 HD11 LEU 37 HD11 LEU 37 4.523 9.516 -3.860
7 HD12 LEU 37 HD12 LEU 37 2.999 10.003 -3.125
8 HD13 LEU 37 HD13 LEU 37 4.214 11.218 -3.519
9 HD21 LEU 37 HD21 LEU 37 2.998 10.776 -0.698
10 HD22 LEU 37 HD22 LEU 37 4.543 10.928 0.135
11 HD23 LEU 37 HD23 LEU 37 4.148 12.017 -1.195
No H/Q in entry = 11
In of MODEL 19
1 H GLU 38 H GLU 38 6.325 6.227 -1.256
2 HA GLU 38 HA GLU 38 4.844 4.158 -0.041
3 HB2 GLU 38 HB2 GLU 38 7.543 4.063 -1.401
4 HB3 GLU 38 HB3 GLU 38 6.547 2.662 -1.023
5 HG2 GLU 38 HG2 GLU 38 4.829 3.417 -2.524
6 HG3 GLU 38 HG3 GLU 38 5.701 4.920 -2.822
No H/Q in entry = 6
In of MODEL 19
1 H ALA 39 H ALA 39 7.438 6.041 1.042
2 HA ALA 39 HA ALA 39 8.302 4.120 3.048
3 HB1 ALA 39 HB1 ALA 39 9.233 6.948 2.576
4 HB2 ALA 39 HB2 ALA 39 9.988 5.752 3.629
5 HB3 ALA 39 HB3 ALA 39 9.967 5.502 1.884
No H/Q in entry = 5
In of MODEL 19
1 H LYS 40 H LYS 40 6.720 7.249 2.888
2 HA LYS 40 HA LYS 40 6.310 7.684 5.613
3 HB2 LYS 40 HB2 LYS 40 5.969 9.338 3.794
4 HB3 LYS 40 HB3 LYS 40 4.530 8.461 3.295
5 HG2 LYS 40 HG2 LYS 40 3.828 10.318 4.578
6 HG3 LYS 40 HG3 LYS 40 3.587 8.875 5.564
7 HD2 LYS 40 HD2 LYS 40 4.535 10.496 6.993
8 HD3 LYS 40 HD3 LYS 40 5.832 9.372 6.609
9 HE2 LYS 40 HE2 LYS 40 6.895 10.879 5.197
10 HE3 LYS 40 HE3 LYS 40 5.443 11.855 4.985
11 HZ1 LYS 40 HZ1 LYS 40 6.986 11.646 7.511
12 HZ2 LYS 40 HZ2 LYS 40 7.095 12.924 6.413
13 HZ3 LYS 40 HZ3 LYS 40 5.642 12.636 7.233
No H/Q in entry = 13
In of MODEL 19
1 H ILE 41 H ILE 41 4.149 6.171 3.197
2 HA ILE 41 HA ILE 41 2.094 5.553 5.002
3 HB ILE 41 HB ILE 41 2.819 4.314 2.353
4 HG12 ILE 41 HG12 ILE 41 0.689 6.328 3.094
5 HG13 ILE 41 HG13 ILE 41 2.251 6.743 2.397
6 HG21 ILE 41 HG21 ILE 41 1.467 2.763 3.660
7 HG22 ILE 41 HG22 ILE 41 0.277 4.032 3.947
8 HG23 ILE 41 HG23 ILE 41 0.544 3.425 2.313
9 HD11 ILE 41 HD11 ILE 41 0.145 5.043 1.097
10 HD12 ILE 41 HD12 ILE 41 0.491 6.733 0.732
11 HD13 ILE 41 HD13 ILE 41 1.701 5.493 0.398
No H/Q in entry = 11
In of MODEL 19
1 H LEU 42 H LEU 42 4.874 3.629 3.885
2 HA LEU 42 HA LEU 42 4.093 1.237 5.156
3 HB2 LEU 42 HB2 LEU 42 6.790 2.259 4.313
4 HB3 LEU 42 HB3 LEU 42 6.577 0.692 5.061
5 HG LEU 42 HG LEU 42 5.557 1.621 2.389
6 HD11 LEU 42 HD11 LEU 42 7.858 0.866 2.458
7 HD12 LEU 42 HD12 LEU 42 7.358 -0.641 3.222
8 HD13 LEU 42 HD13 LEU 42 6.853 -0.279 1.572
9 HD21 LEU 42 HD21 LEU 42 4.774 -0.802 3.990
10 HD22 LEU 42 HD22 LEU 42 3.726 0.390 3.222
11 HD23 LEU 42 HD23 LEU 42 4.643 -0.751 2.233
No H/Q in entry = 11
In of MODEL 19
1 H HIS 43 H HIS 43 5.907 4.032 6.287
2 HA HIS 43 HA HIS 43 6.643 2.969 8.796
3 HB2 HIS 43 HB2 HIS 43 7.546 5.106 7.861
4 HB3 HIS 43 HB3 HIS 43 5.985 5.857 8.171
5 HD1 HIS 43 HD1 HIS 43 9.048 4.584 9.913
6 HD2 HIS 43 HD2 HIS 43 5.466 6.477 10.858
7 HE1 HIS 43 HE1 HIS 43 9.285 5.328 12.306
8 HE2 HIS 43 HE2 HIS 43 7.126 6.511 12.843
No H/Q in entry = 8
In of MODEL 19
1 H TYR 44 H TYR 44 3.784 4.886 7.801
2 HA TYR 44 HA TYR 44 2.459 4.874 10.269
3 HB2 TYR 44 HB2 TYR 44 1.333 4.878 7.461
4 HB3 TYR 44 HB3 TYR 44 0.384 5.193 8.907
5 HD1 TYR 44 HD1 TYR 44 2.655 6.774 10.311
6 HD2 TYR 44 HD2 TYR 44 0.903 7.000 6.446
7 HE1 TYR 44 HE1 TYR 44 3.272 9.147 10.182
8 HE2 TYR 44 HE2 TYR 44 1.511 9.359 6.295
9 HH TYR 44 HH TYR 44 3.689 10.850 8.389
No H/Q in entry = 9
In of MODEL 19
1 H TYR 45 H TYR 45 2.348 2.669 7.558
2 HA TYR 45 HA TYR 45 0.426 0.856 8.291
3 HB2 TYR 45 HB2 TYR 45 1.632 0.980 6.132
4 HB3 TYR 45 HB3 TYR 45 3.071 0.349 6.911
5 HD1 TYR 45 HD1 TYR 45 -0.506 -0.563 6.518
6 HD2 TYR 45 HD2 TYR 45 3.534 -1.870 6.585
7 HE1 TYR 45 HE1 TYR 45 -1.250 -2.845 6.034
8 HE2 TYR 45 HE2 TYR 45 2.804 -4.167 6.090
9 HH TYR 45 HH TYR 45 0.774 -5.545 6.346
No H/Q in entry = 9
In of MODEL 19
1 H ASP 46 H ASP 46 3.901 0.762 9.105
2 HA ASP 46 HA ASP 46 3.594 -1.687 10.551
3 HB2 ASP 46 HB2 ASP 46 5.708 -0.963 9.375
4 HB3 ASP 46 HB3 ASP 46 5.939 0.226 10.651
No H/Q in entry = 4
In of MODEL 19
1 H GLU 47 H GLU 47 3.071 1.584 11.371
2 HA GLU 47 HA GLU 47 3.541 1.160 14.210
3 HB2 GLU 47 HB2 GLU 47 2.712 3.581 12.613
4 HB3 GLU 47 HB3 GLU 47 2.894 3.579 14.359
5 HG2 GLU 47 HG2 GLU 47 5.108 2.834 12.478
6 HG3 GLU 47 HG3 GLU 47 4.833 4.476 13.049
No H/Q in entry = 6
In of MODEL 19
1 H LEU 48 H LEU 48 1.167 0.215 12.271
2 HA LEU 48 HA LEU 48 -1.145 1.473 13.301
3 HB2 LEU 48 HB2 LEU 48 -0.658 -0.963 11.625
4 HB3 LEU 48 HB3 LEU 48 -2.271 -0.464 12.070
5 HG LEU 48 HG LEU 48 -0.314 1.185 10.491
6 HD11 LEU 48 HD11 LEU 48 -1.198 -0.704 9.232
7 HD12 LEU 48 HD12 LEU 48 -2.841 -0.229 9.662
8 HD13 LEU 48 HD13 LEU 48 -1.860 0.821 8.642
9 HD21 LEU 48 HD21 LEU 48 -3.126 1.701 11.428
10 HD22 LEU 48 HD22 LEU 48 -1.677 2.640 11.784
11 HD23 LEU 48 HD23 LEU 48 -2.336 2.629 10.148
No H/Q in entry = 11
In of MODEL 19
1 H GLU 49 H GLU 49 -2.810 -0.738 13.612
2 HA GLU 49 HA GLU 49 -2.122 -1.580 16.328
3 HB2 GLU 49 HB2 GLU 49 -4.758 -0.283 15.598
4 HB3 GLU 49 HB3 GLU 49 -4.270 -0.838 17.194
5 HG2 GLU 49 HG2 GLU 49 -2.411 0.838 17.106
6 HG3 GLU 49 HG3 GLU 49 -3.144 1.468 15.633
No H/Q in entry = 6
In of MODEL 19
1 H GLY 50 H GLY 50 -4.475 -2.838 17.021
2 HA2 GLY 50 HA2 GLY 50 -5.595 -4.822 16.730
3 HA3 GLY 50 HA3 GLY 50 -4.159 -5.326 15.861
No H/Q in entry = 3
In of MODEL 19
1 H ASP 51 H ASP 51 -7.281 -3.722 15.481
2 HA ASP 51 HA ASP 51 -7.790 -5.119 13.015
3 HB2 ASP 51 HB2 ASP 51 -9.548 -4.546 14.700
4 HB3 ASP 51 HB3 ASP 51 -9.343 -2.850 14.289
No H/Q in entry = 4
In of MODEL 19
1 H ALA 52 H ALA 52 -6.513 -2.011 13.910
2 HA ALA 52 HA ALA 52 -7.034 -0.598 11.532
3 HB1 ALA 52 HB1 ALA 52 -4.667 -0.302 13.386
4 HB2 ALA 52 HB2 ALA 52 -5.206 0.881 12.193
5 HB3 ALA 52 HB3 ALA 52 -6.229 0.492 13.576
No H/Q in entry = 5
In of MODEL 19
1 H LYS 53 H LYS 53 -4.272 -2.584 12.511
2 HA LYS 53 HA LYS 53 -2.763 -2.280 10.141
3 HB2 LYS 53 HB2 LYS 53 -1.849 -3.130 12.286
4 HB3 LYS 53 HB3 LYS 53 -2.784 -4.602 12.068
5 HG2 LYS 53 HG2 LYS 53 -0.546 -5.035 11.415
6 HG3 LYS 53 HG3 LYS 53 -1.531 -5.008 9.959
7 HD2 LYS 53 HD2 LYS 53 -0.748 -2.826 9.392
8 HD3 LYS 53 HD3 LYS 53 0.059 -2.654 10.952
9 HE2 LYS 53 HE2 LYS 53 0.775 -4.621 8.784
10 HE3 LYS 53 HE3 LYS 53 1.663 -3.155 9.191
11 HZ1 LYS 53 HZ1 LYS 53 2.015 -4.114 11.433
12 HZ2 LYS 53 HZ2 LYS 53 1.307 -5.554 10.900
13 HZ3 LYS 53 HZ3 LYS 53 2.743 -5.010 10.196
No H/Q in entry = 13
In of MODEL 19
1 H LYS 54 H LYS 54 -4.899 -4.849 11.292
2 HA LYS 54 HA LYS 54 -4.835 -6.520 9.110
3 HB2 LYS 54 HB2 LYS 54 -6.209 -7.654 10.420
4 HB3 LYS 54 HB3 LYS 54 -6.374 -6.247 11.456
5 HG2 LYS 54 HG2 LYS 54 -8.335 -5.560 10.424
6 HG3 LYS 54 HG3 LYS 54 -8.053 -6.561 8.996
7 HD2 LYS 54 HD2 LYS 54 -8.227 -8.555 10.522
8 HD3 LYS 54 HD3 LYS 54 -8.800 -7.450 11.773
9 HE2 LYS 54 HE2 LYS 54 -10.093 -8.046 9.117
10 HE3 LYS 54 HE3 LYS 54 -10.708 -8.449 10.719
11 HZ1 LYS 54 HZ1 LYS 54 -10.792 -6.000 11.148
12 HZ2 LYS 54 HZ2 LYS 54 -10.461 -5.760 9.508
13 HZ3 LYS 54 HZ3 LYS 54 -11.876 -6.557 9.973
No H/Q in entry = 13
In of MODEL 19
1 H GLU 55 H GLU 55 -7.023 -3.743 9.654
2 HA GLU 55 HA GLU 55 -8.376 -4.022 7.210
3 HB2 GLU 55 HB2 GLU 55 -8.182 -1.992 9.346
4 HB3 GLU 55 HB3 GLU 55 -8.606 -1.353 7.771
5 HG2 GLU 55 HG2 GLU 55 -10.292 -3.441 7.923
6 HG3 GLU 55 HG3 GLU 55 -10.148 -3.015 9.627
No H/Q in entry = 6
In of MODEL 19
1 H ALA 56 H ALA 56 -5.660 -1.877 8.132
2 HA ALA 56 HA ALA 56 -5.534 -0.650 5.631
3 HB1 ALA 56 HB1 ALA 56 -3.244 0.007 6.217
4 HB2 ALA 56 HB2 ALA 56 -3.247 -1.163 7.537
5 HB3 ALA 56 HB3 ALA 56 -4.337 0.222 7.584
No H/Q in entry = 5
In of MODEL 19
1 H THR 57 H THR 57 -3.743 -3.439 6.893
2 HA THR 57 HA THR 57 -2.249 -4.182 4.734
3 HB THR 57 HB THR 57 -3.804 -6.004 6.587
4 HG1 THR 57 HG1 THR 57 -2.457 -4.746 7.809
5 HG21 THR 57 HG21 THR 57 -1.387 -6.548 4.868
6 HG22 THR 57 HG22 THR 57 -2.046 -7.653 6.078
7 HG23 THR 57 HG23 THR 57 -3.002 -7.228 4.658
No H/Q in entry = 7
In of MODEL 19
1 H GLU 58 H GLU 58 -5.612 -5.062 5.390
2 HA GLU 58 HA GLU 58 -6.054 -6.544 3.017
3 HB2 GLU 58 HB2 GLU 58 -7.896 -5.224 5.001
4 HB3 GLU 58 HB3 GLU 58 -8.500 -6.114 3.606
5 HG2 GLU 58 HG2 GLU 58 -7.274 -8.106 4.423
6 HG3 GLU 58 HG3 GLU 58 -6.823 -7.185 5.859
No H/Q in entry = 6
In of MODEL 19
1 H HIS 59 H HIS 59 -6.242 -3.106 3.713
2 HA HIS 59 HA HIS 59 -7.832 -2.522 1.383
3 HB2 HIS 59 HB2 HIS 59 -6.350 -0.739 3.320
4 HB3 HIS 59 HB3 HIS 59 -7.257 -0.123 1.946
5 HD1 HIS 59 HD1 HIS 59 -9.771 -1.913 2.182
6 HD2 HIS 59 HD2 HIS 59 -7.966 0.042 5.374
7 HE1 HIS 59 HE1 HIS 59 -11.543 -1.729 3.950
8 HE2 HIS 59 HE2 HIS 59 -10.383 -0.704 5.938
No H/Q in entry = 8
In of MODEL 19
1 H LEU 60 H LEU 60 -4.442 -1.915 2.334
2 HA LEU 60 HA LEU 60 -3.563 -1.148 -0.172
3 HB2 LEU 60 HB2 LEU 60 -2.172 -2.413 2.162
4 HB3 LEU 60 HB3 LEU 60 -1.315 -2.041 0.674
5 HG LEU 60 HG LEU 60 -2.115 0.305 0.924
6 HD11 LEU 60 HD11 LEU 60 -2.876 -0.578 3.658
7 HD12 LEU 60 HD12 LEU 60 -2.776 1.096 3.102
8 HD13 LEU 60 HD13 LEU 60 -3.946 -0.009 2.371
9 HD21 LEU 60 HD21 LEU 60 -0.325 -0.775 3.081
10 HD22 LEU 60 HD22 LEU 60 0.171 -0.308 1.456
11 HD23 LEU 60 HD23 LEU 60 -0.414 0.914 2.583
No H/Q in entry = 11
In of MODEL 19
1 H LYS 61 H LYS 61 -4.271 -4.336 1.133
2 HA LYS 61 HA LYS 61 -2.988 -5.904 -0.813
3 HB2 LYS 61 HB2 LYS 61 -5.308 -6.309 1.009
4 HB3 LYS 61 HB3 LYS 61 -5.142 -7.409 -0.348
5 HG2 LYS 61 HG2 LYS 61 -2.828 -7.911 0.446
6 HG3 LYS 61 HG3 LYS 61 -3.185 -6.957 1.888
7 HD2 LYS 61 HD2 LYS 61 -5.012 -8.429 2.463
8 HD3 LYS 61 HD3 LYS 61 -4.799 -9.332 0.963
9 HE2 LYS 61 HE2 LYS 61 -2.511 -9.932 1.740
10 HE3 LYS 61 HE3 LYS 61 -2.884 -9.170 3.283
11 HZ1 LYS 61 HZ1 LYS 61 -4.720 -10.738 3.547
12 HZ2 LYS 61 HZ2 LYS 61 -4.313 -11.481 2.084
13 HZ3 LYS 61 HZ3 LYS 61 -3.239 -11.541 3.391
No H/Q in entry = 13
In of MODEL 19
1 H GLY 62 H GLY 62 -6.352 -4.741 -0.667
2 HA2 GLY 62 HA2 GLY 62 -7.809 -4.141 -2.334
3 HA3 GLY 62 HA3 GLY 62 -7.162 -5.520 -3.210
No H/Q in entry = 3
In of MODEL 19
1 H GLY 63 H GLY 63 -5.477 -2.581 -2.188
2 HA2 GLY 63 HA2 GLY 63 -4.175 -1.121 -3.394
3 HA3 GLY 63 HA3 GLY 63 -5.394 -1.267 -4.653
No H/Q in entry = 3
In of MODEL 19
1 H CYS 64 H CYS 64 -3.000 -3.510 -3.263
2 HA CYS 64 HA CYS 64 -1.381 -3.618 -5.576
3 HB2 CYS 64 HB2 CYS 64 -1.671 -5.505 -3.244
4 HB3 CYS 64 HB3 CYS 64 -0.471 -5.713 -4.515
No H/Q in entry = 4
In of MODEL 19
1 H ARG 65 H ARG 65 -4.247 -5.347 -4.619
2 HA ARG 65 HA ARG 65 -4.093 -7.481 -6.450
3 HB2 ARG 65 HB2 ARG 65 -5.689 -7.394 -4.561
4 HB3 ARG 65 HB3 ARG 65 -6.553 -6.093 -5.363
5 HG2 ARG 65 HG2 ARG 65 -7.727 -8.169 -5.682
6 HG3 ARG 65 HG3 ARG 65 -7.078 -7.612 -7.226
7 HD2 ARG 65 HD2 ARG 65 -6.777 -10.033 -6.888
8 HD3 ARG 65 HD3 ARG 65 -5.243 -9.181 -7.061
9 HE ARG 65 HE ARG 65 -5.655 -9.270 -4.372
10 HH11 ARG 65 HH11 ARG 65 -5.595 -11.705 -6.883
11 HH12 ARG 65 HH12 ARG 65 -4.955 -12.937 -5.841
12 HH21 ARG 65 HH21 ARG 65 -4.821 -10.884 -3.006
13 HH22 ARG 65 HH22 ARG 65 -4.519 -12.472 -3.637
No H/Q in entry = 13
In of MODEL 19
1 H GLU 66 H GLU 66 -5.510 -4.247 -6.669
2 HA GLU 66 HA GLU 66 -6.412 -4.484 -9.338
3 HB2 GLU 66 HB2 GLU 66 -5.555 -1.959 -7.914
4 HB3 GLU 66 HB3 GLU 66 -6.619 -2.073 -9.308
5 HG2 GLU 66 HG2 GLU 66 -7.185 -3.003 -6.506
6 HG3 GLU 66 HG3 GLU 66 -7.934 -1.657 -7.361
No H/Q in entry = 6
In of MODEL 19
1 H ILE 67 H ILE 67 -3.344 -3.653 -7.880
2 HA ILE 67 HA ILE 67 -2.068 -2.748 -10.246
3 HB ILE 67 HB ILE 67 -0.856 -3.921 -7.737
4 HG12 ILE 67 HG12 ILE 67 -1.207 -1.057 -8.659
5 HG13 ILE 67 HG13 ILE 67 -2.133 -1.847 -7.387
6 HG21 ILE 67 HG21 ILE 67 0.677 -4.138 -9.639
7 HG22 ILE 67 HG22 ILE 67 0.477 -2.422 -9.999
8 HG23 ILE 67 HG23 ILE 67 1.252 -2.920 -8.495
9 HD11 ILE 67 HD11 ILE 67 -0.086 -2.100 -6.072
10 HD12 ILE 67 HD12 ILE 67 0.819 -1.278 -7.343
11 HD13 ILE 67 HD13 ILE 67 -0.432 -0.412 -6.451
No H/Q in entry = 11
In of MODEL 19
1 H LEU 68 H LEU 68 -2.093 -5.917 -8.593
2 HA LEU 68 HA LEU 68 -0.536 -7.232 -10.562
3 HB2 LEU 68 HB2 LEU 68 -1.048 -8.040 -8.216
4 HB3 LEU 68 HB3 LEU 68 -2.634 -8.505 -8.805
5 HG LEU 68 HG LEU 68 -1.614 -10.074 -10.378
6 HD11 LEU 68 HD11 LEU 68 0.465 -8.852 -10.784
7 HD12 LEU 68 HD12 LEU 68 1.000 -9.213 -9.142
8 HD13 LEU 68 HD13 LEU 68 0.783 -10.521 -10.305
9 HD21 LEU 68 HD21 LEU 68 -0.609 -10.392 -7.550
10 HD22 LEU 68 HD22 LEU 68 -2.201 -10.863 -8.148
11 HD23 LEU 68 HD23 LEU 68 -0.758 -11.682 -8.743
No H/Q in entry = 11
In of MODEL 19
1 H LYS 69 H LYS 69 -3.878 -6.418 -10.277
2 HA LYS 69 HA LYS 69 -4.828 -7.934 -12.458
3 HB2 LYS 69 HB2 LYS 69 -6.131 -6.639 -10.601
4 HB3 LYS 69 HB3 LYS 69 -6.015 -5.277 -11.704
5 HG2 LYS 69 HG2 LYS 69 -7.212 -6.473 -13.403
6 HG3 LYS 69 HG3 LYS 69 -7.202 -7.945 -12.429
7 HD2 LYS 69 HD2 LYS 69 -8.502 -6.688 -10.686
8 HD3 LYS 69 HD3 LYS 69 -8.656 -5.368 -11.848
9 HE2 LYS 69 HE2 LYS 69 -9.790 -6.859 -13.409
10 HE3 LYS 69 HE3 LYS 69 -9.600 -8.201 -12.284
11 HZ1 LYS 69 HZ1 LYS 69 -10.952 -6.899 -10.683
12 HZ2 LYS 69 HZ2 LYS 69 -11.245 -5.766 -11.897
13 HZ3 LYS 69 HZ3 LYS 69 -11.795 -7.352 -12.075
No H/Q in entry = 13
In of MODEL 19
1 H HIS 70 H HIS 70 -2.675 -5.405 -12.315
2 HA HIS 70 HA HIS 70 -3.239 -4.410 -15.014
3 HB2 HIS 70 HB2 HIS 70 -3.020 -2.662 -13.275
4 HB3 HIS 70 HB3 HIS 70 -1.427 -3.276 -12.860
5 HD1 HIS 70 HD1 HIS 70 -2.929 -0.639 -14.666
6 HD2 HIS 70 HD2 HIS 70 0.345 -3.117 -15.333
7 HE1 HIS 70 HE1 HIS 70 -1.521 0.538 -16.386
8 HE2 HIS 70 HE2 HIS 70 0.331 -1.078 -16.929
No H/Q in entry = 8
In of MODEL 19
1 H VAL 71 H VAL 71 -0.571 -5.387 -12.872
2 HA VAL 71 HA VAL 71 1.444 -5.520 -14.785
3 HB VAL 71 HB VAL 71 1.500 -7.441 -12.499
4 HG11 VAL 71 HG11 VAL 71 3.400 -7.223 -13.988
5 HG12 VAL 71 HG12 VAL 71 3.494 -5.503 -13.602
6 HG13 VAL 71 HG13 VAL 71 3.794 -6.701 -12.348
7 HG21 VAL 71 HG21 VAL 71 1.613 -4.454 -12.173
8 HG22 VAL 71 HG22 VAL 71 0.527 -5.593 -11.373
9 HG23 VAL 71 HG23 VAL 71 2.250 -5.601 -10.990
No H/Q in entry = 9
In of MODEL 19
1 H VAL 72 H VAL 72 -0.320 -8.225 -13.296
2 HA VAL 72 HA VAL 72 0.835 -9.987 -15.286
3 HB VAL 72 HB VAL 72 0.591 -10.308 -12.654
4 HG11 VAL 72 HG11 VAL 72 -1.861 -11.650 -13.745
5 HG12 VAL 72 HG12 VAL 72 -1.173 -11.928 -12.146
6 HG13 VAL 72 HG13 VAL 72 -1.806 -10.339 -12.568
7 HG21 VAL 72 HG21 VAL 72 0.561 -12.371 -14.801
8 HG22 VAL 72 HG22 VAL 72 1.943 -11.699 -13.934
9 HG23 VAL 72 HG23 VAL 72 0.804 -12.753 -13.096
No H/Q in entry = 9
In of MODEL 19
1 H GLY 73 H GLY 73 -2.045 -8.334 -14.705
2 HA2 GLY 73 HA2 GLY 73 -3.336 -9.660 -16.929
3 HA3 GLY 73 HA3 GLY 73 -3.897 -8.211 -16.103
No H/Q in entry = 3
In of MODEL 19
1 H GLU 74 H GLU 74 -5.916 -9.583 -16.467
2 HA GLU 74 HA GLU 74 -6.666 -10.698 -13.936
3 HB2 GLU 74 HB2 GLU 74 -8.190 -10.596 -16.542
4 HB3 GLU 74 HB3 GLU 74 -8.873 -10.986 -14.970
5 HG2 GLU 74 HG2 GLU 74 -8.353 -8.760 -14.168
6 HG3 GLU 74 HG3 GLU 74 -7.604 -8.363 -15.712
No H/Q in entry = 6
In of MODEL 19
1 H GLU 75 H GLU 75 -5.113 -11.904 -16.586
2 HA GLU 75 HA GLU 75 -6.042 -14.574 -16.741
3 HB2 GLU 75 HB2 GLU 75 -4.692 -13.670 -18.500
4 HB3 GLU 75 HB3 GLU 75 -3.403 -13.256 -17.381
5 HG2 GLU 75 HG2 GLU 75 -2.998 -15.644 -16.986
6 HG3 GLU 75 HG3 GLU 75 -4.258 -16.034 -18.163
No H/Q in entry = 6
In of MODEL 19
1 H LYS 76 H LYS 76 -3.014 -13.412 -15.238
2 HA LYS 76 HA LYS 76 -2.704 -15.977 -14.015
3 HB2 LYS 76 HB2 LYS 76 -1.033 -13.470 -13.820
4 HB3 LYS 76 HB3 LYS 76 -0.587 -15.034 -13.181
5 HG2 LYS 76 HG2 LYS 76 -1.069 -14.442 -16.087
6 HG3 LYS 76 HG3 LYS 76 0.512 -14.551 -15.314
7 HD2 LYS 76 HD2 LYS 76 -1.496 -16.803 -15.378
8 HD3 LYS 76 HD3 LYS 76 -0.189 -16.614 -16.544
9 HE2 LYS 76 HE2 LYS 76 0.261 -16.806 -13.572
10 HE3 LYS 76 HE3 LYS 76 0.257 -18.204 -14.640
11 HZ1 LYS 76 HZ1 LYS 76 2.069 -15.874 -14.940
12 HZ2 LYS 76 HZ2 LYS 76 2.496 -17.331 -14.194
13 HZ3 LYS 76 HZ3 LYS 76 2.107 -17.302 -15.840
No H/Q in entry = 13
In of MODEL 19
1 H ALA 77 H ALA 77 -3.573 -12.741 -12.967
2 HA ALA 77 HA ALA 77 -3.444 -13.184 -10.196
3 HB1 ALA 77 HB1 ALA 77 -4.955 -11.271 -9.992
4 HB2 ALA 77 HB2 ALA 77 -5.339 -11.371 -11.709
5 HB3 ALA 77 HB3 ALA 77 -3.708 -10.943 -11.194
No H/Q in entry = 5
In of MODEL 19
1 H ALA 78 H ALA 78 -5.760 -14.086 -12.632
2 HA ALA 78 HA ALA 78 -7.876 -14.870 -10.913
3 HB1 ALA 78 HB1 ALA 78 -8.438 -14.570 -13.176
4 HB2 ALA 78 HB2 ALA 78 -8.504 -16.313 -12.932
5 HB3 ALA 78 HB3 ALA 78 -7.107 -15.581 -13.741
No H/Q in entry = 5
In of MODEL 19
1 H GLU 79 H GLU 79 -5.063 -16.494 -12.270
2 HA GLU 79 HA GLU 79 -5.747 -19.081 -11.277
3 HB2 GLU 79 HB2 GLU 79 -2.984 -18.179 -12.062
4 HB3 GLU 79 HB3 GLU 79 -3.656 -19.802 -12.128
5 HG2 GLU 79 HG2 GLU 79 -5.257 -18.940 -13.867
6 HG3 GLU 79 HG3 GLU 79 -4.288 -17.466 -13.899
No H/Q in entry = 6
In of MODEL 19
1 H LEU 80 H LEU 80 -3.921 -16.359 -10.061
2 HA LEU 80 HA LEU 80 -2.757 -17.804 -7.881
3 HB2 LEU 80 HB2 LEU 80 -3.081 -14.841 -8.351
4 HB3 LEU 80 HB3 LEU 80 -2.070 -15.570 -7.113
5 HG LEU 80 HG LEU 80 -1.685 -16.082 -10.057
6 HD11 LEU 80 HD11 LEU 80 -0.332 -14.052 -8.296
7 HD12 LEU 80 HD12 LEU 80 0.198 -14.510 -9.918
8 HD13 LEU 80 HD13 LEU 80 -1.373 -13.734 -9.686
9 HD21 LEU 80 HD21 LEU 80 -0.790 -17.766 -8.547
10 HD22 LEU 80 HD22 LEU 80 0.502 -16.872 -9.350
11 HD23 LEU 80 HD23 LEU 80 0.096 -16.517 -7.671
No H/Q in entry = 11
In of MODEL 19
1 H LYS 81 H LYS 81 -5.680 -15.965 -8.412
2 HA LYS 81 HA LYS 81 -6.472 -15.788 -5.691
3 HB2 LYS 81 HB2 LYS 81 -7.419 -14.551 -7.772
4 HB3 LYS 81 HB3 LYS 81 -8.393 -15.989 -8.003
5 HG2 LYS 81 HG2 LYS 81 -8.416 -14.269 -5.529
6 HG3 LYS 81 HG3 LYS 81 -9.592 -14.183 -6.837
7 HD2 LYS 81 HD2 LYS 81 -10.195 -16.543 -6.395
8 HD3 LYS 81 HD3 LYS 81 -9.076 -16.545 -5.031
9 HE2 LYS 81 HE2 LYS 81 -11.278 -16.179 -4.178
10 HE3 LYS 81 HE3 LYS 81 -10.383 -14.666 -4.045
11 HZ1 LYS 81 HZ1 LYS 81 -11.483 -13.889 -6.056
12 HZ2 LYS 81 HZ2 LYS 81 -12.342 -15.339 -6.177
13 HZ3 LYS 81 HZ3 LYS 81 -12.619 -14.298 -4.872
No H/Q in entry = 13
In of MODEL 19
1 H ASN 82 H ASN 82 -7.360 -18.001 -8.324
2 HA ASN 82 HA ASN 82 -8.872 -19.766 -6.736
3 HB2 ASN 82 HB2 ASN 82 -8.936 -19.604 -9.250
4 HB3 ASN 82 HB3 ASN 82 -7.376 -20.403 -9.296
5 HD21 ASN 82 HD21 ASN 82 -10.020 -21.123 -10.371
6 HD22 ASN 82 HD22 ASN 82 -10.338 -22.715 -9.775
No H/Q in entry = 6
In of MODEL 19
1 H LEU 83 H LEU 83 -5.427 -19.684 -7.587
2 HA LEU 83 HA LEU 83 -4.691 -22.172 -6.580
3 HB2 LEU 83 HB2 LEU 83 -3.399 -19.835 -7.511
4 HB3 LEU 83 HB3 LEU 83 -2.705 -20.201 -5.950
5 HG LEU 83 HG LEU 83 -2.856 -22.144 -8.249
6 HD11 LEU 83 HD11 LEU 83 -0.535 -20.512 -7.236
7 HD12 LEU 83 HD12 LEU 83 -0.450 -21.766 -8.474
8 HD13 LEU 83 HD13 LEU 83 -1.371 -20.292 -8.773
9 HD21 LEU 83 HD21 LEU 83 -2.819 -23.178 -6.009
10 HD22 LEU 83 HD22 LEU 83 -1.365 -23.518 -6.945
11 HD23 LEU 83 HD23 LEU 83 -1.324 -22.310 -5.661
No H/Q in entry = 11
In of MODEL 19
1 H LYS 84 H LYS 84 -5.084 -19.054 -4.973
2 HA LYS 84 HA LYS 84 -4.031 -19.856 -2.473
3 HB2 LYS 84 HB2 LYS 84 -4.202 -17.503 -3.160
4 HB3 LYS 84 HB3 LYS 84 -5.955 -17.615 -3.120
5 HG2 LYS 84 HG2 LYS 84 -4.533 -18.340 -0.631
6 HG3 LYS 84 HG3 LYS 84 -4.490 -16.641 -1.103
7 HD2 LYS 84 HD2 LYS 84 -7.039 -18.237 -0.935
8 HD3 LYS 84 HD3 LYS 84 -6.388 -17.316 0.421
9 HE2 LYS 84 HE2 LYS 84 -6.550 -15.266 -0.818
10 HE3 LYS 84 HE3 LYS 84 -7.015 -16.135 -2.280
11 HZ1 LYS 84 HZ1 LYS 84 -8.612 -16.123 0.220
12 HZ2 LYS 84 HZ2 LYS 84 -8.888 -15.085 -1.086
13 HZ3 LYS 84 HZ3 LYS 84 -9.073 -16.756 -1.288
No H/Q in entry = 13
In of MODEL 19
1 H ASP 85 H ASP 85 -7.404 -19.494 -3.598
2 HA ASP 85 HA ASP 85 -8.544 -20.527 -1.215
3 HB2 ASP 85 HB2 ASP 85 -9.594 -20.012 -3.978
4 HB3 ASP 85 HB3 ASP 85 -10.584 -20.862 -2.797
No H/Q in entry = 4
In of MODEL 19
1 H SER 86 H SER 86 -7.149 -22.063 -3.968
2 HA SER 86 HA SER 86 -8.412 -24.612 -3.507
3 HB2 SER 86 HB2 SER 86 -7.604 -23.946 -5.753
4 HB3 SER 86 HB3 SER 86 -5.951 -23.930 -5.142
5 HG SER 86 HG SER 86 -6.336 -26.204 -4.588
No H/Q in entry = 5
In of MODEL 19
1 H GLY 87 H GLY 87 -5.937 -22.860 -2.057
2 HA2 GLY 87 HA2 GLY 87 -5.069 -25.302 -0.643
3 HA3 GLY 87 HA3 GLY 87 -5.201 -23.718 0.105
No H/Q in entry = 3
In of MODEL 19
1 H ALA 88 H ALA 88 -3.955 -22.250 -2.029
2 HA ALA 88 HA ALA 88 -1.284 -23.292 -2.158
3 HB1 ALA 88 HB1 ALA 88 -2.158 -20.493 -2.843
4 HB2 ALA 88 HB2 ALA 88 -2.301 -21.859 -3.948
5 HB3 ALA 88 HB3 ALA 88 -0.711 -21.339 -3.389
No H/Q in entry = 5
In of MODEL 19
1 H SER 89 H SER 89 0.151 -22.986 -0.640
2 HA SER 89 HA SER 89 -0.295 -21.491 1.717
3 HB2 SER 89 HB2 SER 89 2.311 -22.646 0.715
4 HB3 SER 89 HB3 SER 89 1.848 -22.317 2.376
5 HG SER 89 HG SER 89 0.424 -23.990 2.342
No H/Q in entry = 5
In of MODEL 19
1 H LYS 90 H LYS 90 1.405 -19.871 2.503
2 HA LYS 90 HA LYS 90 1.304 -17.593 0.930
3 HB2 LYS 90 HB2 LYS 90 2.928 -16.609 2.468
4 HB3 LYS 90 HB3 LYS 90 1.715 -17.530 3.347
5 HG2 LYS 90 HG2 LYS 90 3.284 -19.365 3.615
6 HG3 LYS 90 HG3 LYS 90 4.495 -18.479 2.687
7 HD2 LYS 90 HD2 LYS 90 4.300 -16.649 4.416
8 HD3 LYS 90 HD3 LYS 90 3.345 -17.776 5.378
9 HE2 LYS 90 HE2 LYS 90 6.164 -18.240 4.414
10 HE3 LYS 90 HE3 LYS 90 5.710 -17.752 6.044
11 HZ1 LYS 90 HZ1 LYS 90 4.798 -20.271 4.768
12 HZ2 LYS 90 HZ2 LYS 90 6.158 -20.160 5.773
13 HZ3 LYS 90 HZ3 LYS 90 4.616 -19.818 6.386
No H/Q in entry = 13
In of MODEL 19
1 H GLU 91 H GLU 91 3.698 -20.123 1.034
2 HA GLU 91 HA GLU 91 5.711 -18.710 -0.383
3 HB2 GLU 91 HB2 GLU 91 5.353 -21.631 0.221
4 HB3 GLU 91 HB3 GLU 91 6.777 -20.957 -0.566
5 HG2 GLU 91 HG2 GLU 91 7.267 -19.609 1.364
6 HG3 GLU 91 HG3 GLU 91 5.775 -20.124 2.146
No H/Q in entry = 6
In of MODEL 19
1 H GLU 92 H GLU 92 3.091 -20.835 -1.415
2 HA GLU 92 HA GLU 92 3.962 -21.331 -4.041
3 HB2 GLU 92 HB2 GLU 92 1.135 -21.138 -3.006
4 HB3 GLU 92 HB3 GLU 92 1.684 -22.008 -4.423
5 HG2 GLU 92 HG2 GLU 92 2.476 -22.670 -1.614
6 HG3 GLU 92 HG3 GLU 92 1.171 -23.443 -2.500
No H/Q in entry = 6
In of MODEL 19
1 H LEU 93 H LEU 93 2.010 -18.902 -2.451
2 HA LEU 93 HA LEU 93 1.650 -17.297 -4.798
3 HB2 LEU 93 HB2 LEU 93 1.416 -16.755 -1.841
4 HB3 LEU 93 HB3 LEU 93 1.231 -15.465 -3.010
5 HG LEU 93 HG LEU 93 -0.863 -16.743 -2.056
6 HD11 LEU 93 HD11 LEU 93 -0.528 -16.062 -4.980
7 HD12 LEU 93 HD12 LEU 93 -2.073 -16.256 -4.154
8 HD13 LEU 93 HD13 LEU 93 -0.985 -14.944 -3.694
9 HD21 LEU 93 HD21 LEU 93 -0.092 -18.504 -4.365
10 HD22 LEU 93 HD22 LEU 93 -0.166 -18.978 -2.669
11 HD23 LEU 93 HD23 LEU 93 -1.640 -18.520 -3.522
No H/Q in entry = 11
In of MODEL 19
1 H LYS 94 H LYS 94 4.144 -17.515 -2.288
2 HA LYS 94 HA LYS 94 5.371 -15.050 -2.879
3 HB2 LYS 94 HB2 LYS 94 5.777 -16.210 -0.784
4 HB3 LYS 94 HB3 LYS 94 6.454 -17.580 -1.639
5 HG2 LYS 94 HG2 LYS 94 8.343 -16.221 -2.355
6 HG3 LYS 94 HG3 LYS 94 7.669 -14.835 -1.491
7 HD2 LYS 94 HD2 LYS 94 7.913 -15.939 0.616
8 HD3 LYS 94 HD3 LYS 94 8.336 -17.461 -0.168
9 HE2 LYS 94 HE2 LYS 94 9.968 -14.931 -0.317
10 HE3 LYS 94 HE3 LYS 94 10.285 -16.266 0.786
11 HZ1 LYS 94 HZ1 LYS 94 10.594 -17.712 -1.139
12 HZ2 LYS 94 HZ2 LYS 94 10.330 -16.408 -2.179
13 HZ3 LYS 94 HZ3 LYS 94 11.680 -16.417 -1.161
No H/Q in entry = 13
In of MODEL 19
1 H ALA 95 H ALA 95 5.941 -18.312 -4.000
2 HA ALA 95 HA ALA 95 8.166 -17.410 -5.610
3 HB1 ALA 95 HB1 ALA 95 8.335 -19.500 -4.335
4 HB2 ALA 95 HB2 ALA 95 8.571 -19.747 -6.064
5 HB3 ALA 95 HB3 ALA 95 7.037 -20.183 -5.311
No H/Q in entry = 5
In of MODEL 19
1 H LYS 96 H LYS 96 5.013 -19.043 -6.170
2 HA LYS 96 HA LYS 96 5.329 -19.119 -8.983
3 HB2 LYS 96 HB2 LYS 96 2.974 -19.333 -7.150
4 HB3 LYS 96 HB3 LYS 96 2.754 -19.297 -8.884
5 HG2 LYS 96 HG2 LYS 96 4.463 -21.288 -7.413
6 HG3 LYS 96 HG3 LYS 96 2.807 -21.577 -7.947
7 HD2 LYS 96 HD2 LYS 96 3.497 -21.209 -10.270
8 HD3 LYS 96 HD3 LYS 96 5.156 -20.933 -9.730
9 HE2 LYS 96 HE2 LYS 96 5.268 -23.196 -8.861
10 HE3 LYS 96 HE3 LYS 96 3.594 -23.480 -9.329
11 HZ1 LYS 96 HZ1 LYS 96 4.239 -23.136 -11.644
12 HZ2 LYS 96 HZ2 LYS 96 5.848 -22.920 -11.177
13 HZ3 LYS 96 HZ3 LYS 96 5.099 -24.416 -10.951
No H/Q in entry = 13
In of MODEL 19
1 H VAL 97 H VAL 97 4.407 -16.567 -6.862
2 HA VAL 97 HA VAL 97 3.107 -14.839 -8.679
3 HB VAL 97 HB VAL 97 3.613 -14.665 -6.046
4 HG11 VAL 97 HG11 VAL 97 5.577 -12.938 -7.450
5 HG12 VAL 97 HG12 VAL 97 5.084 -12.676 -5.773
6 HG13 VAL 97 HG13 VAL 97 5.897 -14.173 -6.244
7 HG21 VAL 97 HG21 VAL 97 1.887 -13.452 -7.273
8 HG22 VAL 97 HG22 VAL 97 2.758 -12.385 -6.170
9 HG23 VAL 97 HG23 VAL 97 3.111 -12.346 -7.898
No H/Q in entry = 9
In of MODEL 19
1 H GLU 98 H GLU 98 6.435 -15.578 -8.047
2 HA GLU 98 HA GLU 98 7.445 -13.369 -9.552
3 HB2 GLU 98 HB2 GLU 98 8.727 -15.774 -8.291
4 HB3 GLU 98 HB3 GLU 98 9.644 -14.628 -9.266
5 HG2 GLU 98 HG2 GLU 98 7.981 -13.837 -6.886
6 HG3 GLU 98 HG3 GLU 98 9.710 -14.215 -6.798
No H/Q in entry = 6
In of MODEL 19
1 H GLU 99 H GLU 99 6.705 -16.722 -10.221
2 HA GLU 99 HA GLU 99 7.986 -16.929 -12.712
3 HB2 GLU 99 HB2 GLU 99 5.383 -18.116 -11.731
4 HB3 GLU 99 HB3 GLU 99 6.113 -18.533 -13.276
5 HG2 GLU 99 HG2 GLU 99 7.362 -18.932 -10.571
6 HG3 GLU 99 HG3 GLU 99 6.622 -20.185 -11.569
No H/Q in entry = 6
In of MODEL 19
1 H ALA 100 H ALA 100 4.950 -15.507 -11.738
2 HA ALA 100 HA ALA 100 4.154 -14.824 -14.403
3 HB1 ALA 100 HB1 ALA 100 3.075 -13.886 -11.752
4 HB2 ALA 100 HB2 ALA 100 2.540 -15.320 -12.632
5 HB3 ALA 100 HB3 ALA 100 2.295 -13.721 -13.323
No H/Q in entry = 5
In of MODEL 19
1 H LEU 101 H LEU 101 5.461 -13.033 -11.624
2 HA LEU 101 HA LEU 101 5.474 -10.522 -12.958
3 HB2 LEU 101 HB2 LEU 101 6.913 -11.426 -10.467
4 HB3 LEU 101 HB3 LEU 101 6.807 -9.765 -11.017
5 HG LEU 101 HG LEU 101 4.474 -11.485 -10.176
6 HD11 LEU 101 HD11 LEU 101 5.899 -10.832 -8.309
7 HD12 LEU 101 HD12 LEU 101 5.787 -9.144 -8.808
8 HD13 LEU 101 HD13 LEU 101 4.347 -9.998 -8.254
9 HD21 LEU 101 HD21 LEU 101 4.590 -8.590 -11.012
10 HD22 LEU 101 HD22 LEU 101 3.812 -9.906 -11.890
11 HD23 LEU 101 HD23 LEU 101 3.180 -9.397 -10.325
No H/Q in entry = 11
In of MODEL 19
1 H HIS 102 H HIS 102 7.636 -13.193 -13.037
2 HA HIS 102 HA HIS 102 9.768 -11.578 -14.149
3 HB2 HIS 102 HB2 HIS 102 9.404 -14.577 -13.954
4 HB3 HIS 102 HB3 HIS 102 10.792 -13.816 -14.732
5 HD1 HIS 102 HD1 HIS 102 11.608 -15.507 -12.504
6 HD2 HIS 102 HD2 HIS 102 10.280 -11.634 -11.832
7 HE1 HIS 102 HE1 HIS 102 12.470 -14.883 -10.229
8 HE2 HIS 102 HE2 HIS 102 11.394 -12.656 -9.736
No H/Q in entry = 8
In of MODEL 19
1 H ALA 103 H ALA 103 7.249 -13.807 -15.278
2 HA ALA 103 HA ALA 103 8.038 -13.836 -17.971
3 HB1 ALA 103 HB1 ALA 103 5.293 -14.364 -16.850
4 HB2 ALA 103 HB2 ALA 103 6.610 -15.537 -16.889
5 HB3 ALA 103 HB3 ALA 103 5.928 -14.924 -18.398
No H/Q in entry = 5
In of MODEL 19
1 H VAL 104 H VAL 104 6.841 -11.215 -16.317
2 HA VAL 104 HA VAL 104 5.275 -10.163 -18.493
3 HB VAL 104 HB VAL 104 4.527 -9.756 -16.218
4 HG11 VAL 104 HG11 VAL 104 7.210 -8.475 -15.938
5 HG12 VAL 104 HG12 VAL 104 5.875 -8.187 -14.815
6 HG13 VAL 104 HG13 VAL 104 6.529 -9.815 -15.005
7 HG21 VAL 104 HG21 VAL 104 5.532 -7.263 -17.567
8 HG22 VAL 104 HG22 VAL 104 3.994 -8.066 -17.869
9 HG23 VAL 104 HG23 VAL 104 4.302 -7.308 -16.307
No H/Q in entry = 9
In of MODEL 19
1 H THR 105 H THR 105 5.877 -8.392 -19.729
2 HA THR 105 HA THR 105 8.614 -7.423 -19.393
3 HB THR 105 HB THR 105 8.838 -7.674 -21.967
4 HG1 THR 105 HG1 THR 105 7.489 -10.054 -21.819
5 HG21 THR 105 HG21 THR 105 9.080 -10.038 -20.107
6 HG22 THR 105 HG22 THR 105 9.857 -9.901 -21.684
7 HG23 THR 105 HG23 THR 105 10.299 -8.795 -20.385
No H/Q in entry = 7
In of MODEL 19
1 H ASP 106 H ASP 106 5.507 -6.517 -19.710
2 HA ASP 106 HA ASP 106 5.946 -4.236 -21.399
3 HB2 ASP 106 HB2 ASP 106 3.689 -5.149 -21.131
4 HB3 ASP 106 HB3 ASP 106 3.767 -4.859 -19.404
No H/Q in entry = 4
In of MODEL 19
1 H GLU 107 H GLU 107 6.824 -2.394 -20.840
2 HA GLU 107 HA GLU 107 8.512 -2.280 -18.685
3 HB2 GLU 107 HB2 GLU 107 7.546 -0.260 -20.644
4 HB3 GLU 107 HB3 GLU 107 8.468 0.301 -19.257
5 HG2 GLU 107 HG2 GLU 107 9.894 -0.048 -21.194
6 HG3 GLU 107 HG3 GLU 107 10.321 -1.136 -19.877
No H/Q in entry = 6
In of MODEL 19
1 H GLU 108 H GLU 108 5.467 -0.520 -19.031
2 HA GLU 108 HA GLU 108 5.597 0.802 -16.548
3 HB2 GLU 108 HB2 GLU 108 3.413 0.225 -18.491
4 HB3 GLU 108 HB3 GLU 108 2.971 0.770 -16.881
5 HG2 GLU 108 HG2 GLU 108 3.077 2.640 -18.395
6 HG3 GLU 108 HG3 GLU 108 4.350 2.769 -17.185
No H/Q in entry = 6
In of MODEL 19
1 H LYS 109 H LYS 109 4.156 -2.314 -17.471
2 HA LYS 109 HA LYS 109 2.992 -2.945 -15.007
3 HB2 LYS 109 HB2 LYS 109 4.231 -4.788 -17.059
4 HB3 LYS 109 HB3 LYS 109 3.183 -5.304 -15.748
5 HG2 LYS 109 HG2 LYS 109 1.400 -3.841 -16.702
6 HG3 LYS 109 HG3 LYS 109 2.457 -3.549 -18.079
7 HD2 LYS 109 HD2 LYS 109 2.455 -5.921 -18.610
8 HD3 LYS 109 HD3 LYS 109 1.478 -6.257 -17.182
9 HE2 LYS 109 HE2 LYS 109 0.102 -6.230 -19.189
10 HE3 LYS 109 HE3 LYS 109 -0.345 -4.924 -18.096
11 HZ1 LYS 109 HZ1 LYS 109 0.971 -3.406 -19.475
12 HZ2 LYS 109 HZ2 LYS 109 1.312 -4.671 -20.546
13 HZ3 LYS 109 HZ3 LYS 109 -0.275 -4.134 -20.351
No H/Q in entry = 13
In of MODEL 19
1 H LYS 110 H LYS 110 6.287 -3.445 -16.191
2 HA LYS 110 HA LYS 110 7.159 -4.791 -13.804
3 HB2 LYS 110 HB2 LYS 110 8.798 -3.525 -16.002
4 HB3 LYS 110 HB3 LYS 110 9.393 -4.648 -14.792
5 HG2 LYS 110 HG2 LYS 110 8.055 -6.425 -15.724
6 HG3 LYS 110 HG3 LYS 110 7.325 -5.302 -16.879
7 HD2 LYS 110 HD2 LYS 110 10.280 -5.880 -16.726
8 HD3 LYS 110 HD3 LYS 110 9.173 -6.694 -17.826
9 HE2 LYS 110 HE2 LYS 110 8.601 -4.557 -18.851
10 HE3 LYS 110 HE3 LYS 110 9.662 -3.721 -17.722
11 HZ1 LYS 110 HZ1 LYS 110 10.597 -5.762 -19.658
12 HZ2 LYS 110 HZ2 LYS 110 10.629 -4.095 -19.953
13 HZ3 LYS 110 HZ3 LYS 110 11.553 -4.755 -18.692
No H/Q in entry = 13
In of MODEL 19
1 H GLN 111 H GLN 111 6.851 -1.550 -14.820
2 HA GLN 111 HA GLN 111 8.598 -0.320 -12.959
3 HB2 GLN 111 HB2 GLN 111 7.516 0.846 -14.889
4 HB3 GLN 111 HB3 GLN 111 5.978 0.750 -14.043
5 HG2 GLN 111 HG2 GLN 111 6.947 2.947 -13.802
6 HG3 GLN 111 HG3 GLN 111 6.888 2.130 -12.240
7 HE21 GLN 111 HE21 GLN 111 8.780 1.608 -11.198
8 HE22 GLN 111 HE22 GLN 111 10.334 2.142 -11.746
No H/Q in entry = 8
In of MODEL 19
1 H TYR 112 H TYR 112 5.271 -1.449 -12.799
2 HA TYR 112 HA TYR 112 4.753 -0.587 -10.135
3 HB2 TYR 112 HB2 TYR 112 3.503 -2.670 -11.918
4 HB3 TYR 112 HB3 TYR 112 2.977 -2.456 -10.255
5 HD1 TYR 112 HD1 TYR 112 2.590 0.209 -9.702
6 HD2 TYR 112 HD2 TYR 112 2.176 -1.661 -13.501
7 HE1 TYR 112 HE1 TYR 112 1.060 2.000 -10.410
8 HE2 TYR 112 HE2 TYR 112 0.646 0.124 -14.219
9 HH TYR 112 HH TYR 112 -0.933 1.780 -13.077
No H/Q in entry = 9
In of MODEL 19
1 H ILE 113 H ILE 113 6.091 -3.522 -11.566
2 HA ILE 113 HA ILE 113 6.249 -5.095 -9.273
3 HB ILE 113 HB ILE 113 8.111 -4.982 -11.637
4 HG12 ILE 113 HG12 ILE 113 5.813 -6.795 -10.886
5 HG13 ILE 113 HG13 ILE 113 5.815 -5.589 -12.168
6 HG21 ILE 113 HG21 ILE 113 7.935 -7.063 -9.454
7 HG22 ILE 113 HG22 ILE 113 8.897 -7.197 -10.926
8 HG23 ILE 113 HG23 ILE 113 9.282 -5.958 -9.733
9 HD11 ILE 113 HD11 ILE 113 7.621 -7.980 -12.088
10 HD12 ILE 113 HD12 ILE 113 6.090 -7.905 -12.959
11 HD13 ILE 113 HD13 ILE 113 7.415 -6.840 -13.416
No H/Q in entry = 11
In of MODEL 19
1 H ALA 114 H ALA 114 8.632 -2.777 -10.566
2 HA ALA 114 HA ALA 114 10.502 -3.142 -8.462
3 HB1 ALA 114 HB1 ALA 114 11.191 -2.256 -10.614
4 HB2 ALA 114 HB2 ALA 114 11.561 -1.094 -9.341
5 HB3 ALA 114 HB3 ALA 114 10.163 -0.840 -10.387
No H/Q in entry = 5
In of MODEL 19
1 H ASP 115 H ASP 115 7.896 -0.827 -9.008
2 HA ASP 115 HA ASP 115 8.568 0.781 -6.746
3 HB2 ASP 115 HB2 ASP 115 6.128 0.655 -8.508
4 HB3 ASP 115 HB3 ASP 115 6.243 1.755 -7.140
No H/Q in entry = 4
In of MODEL 19
1 H PHE 116 H PHE 116 5.864 -1.471 -7.334
2 HA PHE 116 HA PHE 116 5.195 -1.151 -4.504
3 HB2 PHE 116 HB2 PHE 116 3.588 -1.273 -6.878
4 HB3 PHE 116 HB3 PHE 116 3.148 -2.611 -5.825
5 HD1 PHE 116 HD1 PHE 116 2.397 -2.141 -3.505
6 HD2 PHE 116 HD2 PHE 116 2.935 0.936 -6.394
7 HE1 PHE 116 HE1 PHE 116 0.974 -0.650 -2.167
8 HE2 PHE 116 HE2 PHE 116 1.511 2.439 -5.055
9 HZ PHE 116 HZ PHE 116 0.521 1.639 -2.942
No H/Q in entry = 9
In of MODEL 19
1 H GLY 117 H GLY 117 6.403 -3.434 -6.742
2 HA2 GLY 117 HA2 GLY 117 7.076 -5.626 -6.459
3 HA3 GLY 117 HA3 GLY 117 5.414 -5.866 -5.963
No H/Q in entry = 3
In of MODEL 19
1 HA PRO 118 HA PRO 118 8.660 -6.734 -2.529
2 HB2 PRO 118 HB2 PRO 118 9.948 -4.137 -1.994
3 HB3 PRO 118 HB3 PRO 118 10.680 -5.727 -2.228
4 HG2 PRO 118 HG2 PRO 118 10.877 -3.816 -4.095
5 HG3 PRO 118 HG3 PRO 118 10.706 -5.526 -4.530
6 HD2 PRO 118 HD2 PRO 118 8.640 -3.357 -4.527
7 HD3 PRO 118 HD3 PRO 118 8.914 -4.650 -5.714
No H/Q in entry = 7
In of MODEL 19
1 H ALA 119 H ALA 119 6.985 -3.675 -2.539
2 HA ALA 119 HA ALA 119 6.681 -3.602 0.346
3 HB1 ALA 119 HB1 ALA 119 5.310 -1.622 -0.068
4 HB2 ALA 119 HB2 ALA 119 5.391 -1.921 -1.805
5 HB3 ALA 119 HB3 ALA 119 6.855 -1.514 -0.910
No H/Q in entry = 5
In of MODEL 19
1 H CYS 120 H CYS 120 4.740 -4.398 -2.484
2 HA CYS 120 HA CYS 120 2.370 -5.123 -1.172
3 HB2 CYS 120 HB2 CYS 120 3.638 -6.216 -3.685
4 HB3 CYS 120 HB3 CYS 120 2.029 -6.669 -3.134
No H/Q in entry = 4
In of MODEL 19
1 H LYS 121 H LYS 121 5.454 -6.693 -1.414
2 HA LYS 121 HA LYS 121 4.842 -9.306 -0.680
3 HB2 LYS 121 HB2 LYS 121 7.100 -8.233 -1.299
4 HB3 LYS 121 HB3 LYS 121 7.226 -7.816 0.403
5 HG2 LYS 121 HG2 LYS 121 8.448 -9.833 -0.008
6 HG3 LYS 121 HG3 LYS 121 7.025 -10.217 0.963
7 HD2 LYS 121 HD2 LYS 121 5.866 -11.063 -0.960
8 HD3 LYS 121 HD3 LYS 121 7.145 -10.496 -2.036
9 HE2 LYS 121 HE2 LYS 121 7.520 -12.575 0.116
10 HE3 LYS 121 HE3 LYS 121 7.203 -12.942 -1.578
11 HZ1 LYS 121 HZ1 LYS 121 9.544 -11.419 -0.567
12 HZ2 LYS 121 HZ2 LYS 121 9.569 -13.032 -1.060
13 HZ3 LYS 121 HZ3 LYS 121 9.241 -11.815 -2.182
No H/Q in entry = 13
In of MODEL 19
1 H LYS 122 H LYS 122 5.776 -6.651 1.575
2 HA LYS 122 HA LYS 122 5.028 -8.094 3.897
3 HB2 LYS 122 HB2 LYS 122 5.159 -5.949 5.086
4 HB3 LYS 122 HB3 LYS 122 6.553 -6.202 4.051
5 HG2 LYS 122 HG2 LYS 122 5.593 -4.700 2.385
6 HG3 LYS 122 HG3 LYS 122 4.190 -4.453 3.423
7 HD2 LYS 122 HD2 LYS 122 5.565 -2.587 3.797
8 HD3 LYS 122 HD3 LYS 122 5.829 -3.634 5.188
9 HE2 LYS 122 HE2 LYS 122 7.636 -3.726 2.793
10 HE3 LYS 122 HE3 LYS 122 7.867 -2.532 4.065
11 HZ1 LYS 122 HZ1 LYS 122 8.002 -4.419 5.652
12 HZ2 LYS 122 HZ2 LYS 122 7.998 -5.481 4.338
13 HZ3 LYS 122 HZ3 LYS 122 9.258 -4.376 4.527
No H/Q in entry = 13
In of MODEL 19
1 H ILE 123 H ILE 123 3.246 -6.086 1.659
2 HA ILE 123 HA ILE 123 1.003 -5.614 3.285
3 HB ILE 123 HB ILE 123 1.257 -5.632 0.305
4 HG12 ILE 123 HG12 ILE 123 1.007 -3.391 2.316
5 HG13 ILE 123 HG13 ILE 123 2.527 -3.937 1.613
6 HG21 ILE 123 HG21 ILE 123 -1.074 -4.769 2.007
7 HG22 ILE 123 HG22 ILE 123 -0.905 -4.447 0.279
8 HG23 ILE 123 HG23 ILE 123 -1.054 -6.107 0.860
9 HD11 ILE 123 HD11 ILE 123 0.227 -2.902 0.005
10 HD12 ILE 123 HD12 ILE 123 1.556 -1.898 0.583
11 HD13 ILE 123 HD13 ILE 123 1.868 -3.220 -0.543
No H/Q in entry = 11
In of MODEL 19
1 H TYR 124 H TYR 124 1.652 -8.032 0.880
2 HA TYR 124 HA TYR 124 -0.647 -9.661 1.474
3 HB2 TYR 124 HB2 TYR 124 1.697 -9.948 -0.387
4 HB3 TYR 124 HB3 TYR 124 0.589 -11.285 -0.096
5 HD1 TYR 124 HD1 TYR 124 -1.994 -10.569 -0.326
6 HD2 TYR 124 HD2 TYR 124 1.283 -8.612 -2.199
7 HE1 TYR 124 HE1 TYR 124 -3.516 -9.663 -2.031
8 HE2 TYR 124 HE2 TYR 124 -0.229 -7.700 -3.907
9 HH TYR 124 HH TYR 124 -2.443 -8.291 -4.904
No H/Q in entry = 9
In of MODEL 19
1 H GLY 125 H GLY 125 0.995 -9.184 3.687
2 HA2 GLY 125 HA2 GLY 125 2.386 -10.167 5.318
3 HA3 GLY 125 HA3 GLY 125 3.476 -9.656 4.063
No H/Q in entry = 3
In of MODEL 19
1 H VAL 126 H VAL 126 2.590 -11.931 2.343
2 HA VAL 126 HA VAL 126 3.588 -14.337 3.440
3 HB VAL 126 HB VAL 126 3.953 -15.003 1.064
4 HG11 VAL 126 HG11 VAL 126 1.722 -15.184 2.141
5 HG12 VAL 126 HG12 VAL 126 1.310 -13.606 1.475
6 HG13 VAL 126 HG13 VAL 126 1.639 -14.961 0.394
7 HG21 VAL 126 HG21 VAL 126 4.692 -12.842 0.189
8 HG22 VAL 126 HG22 VAL 126 3.317 -13.453 -0.728
9 HG23 VAL 126 HG23 VAL 126 3.086 -12.169 0.458
No H/Q in entry = 9
In of MODEL 19
1 H HIS 127 H HIS 127 5.313 -12.319 4.322
2 HA HIS 127 HA HIS 127 7.656 -12.273 2.600
3 HB2 HIS 127 HB2 HIS 127 6.873 -10.211 3.737
4 HB3 HIS 127 HB3 HIS 127 7.191 -10.967 5.292
5 HD1 HIS 127 HD1 HIS 127 9.238 -10.003 6.258
6 HD2 HIS 127 HD2 HIS 127 9.549 -10.433 2.137
7 HE1 HIS 127 HE1 HIS 127 11.547 -9.209 5.668
8 HE2 HIS 127 HE2 HIS 127 11.677 -9.375 3.162
No H/Q in entry = 8
In of MODEL 19
1 H THR 128 H THR 128 6.453 -14.061 5.224
2 HA THR 128 HA THR 128 9.021 -14.838 6.281
3 HB THR 128 HB THR 128 7.512 -16.550 7.520
4 HG1 THR 128 HG1 THR 128 5.314 -15.147 7.489
5 HG21 THR 128 HG21 THR 128 7.173 -13.580 7.952
6 HG22 THR 128 HG22 THR 128 6.830 -14.836 9.141
7 HG23 THR 128 HG23 THR 128 8.483 -14.579 8.583
No H/Q in entry = 7
In of MODEL 19
1 H SER 129 H SER 129 9.193 -17.381 6.618
2 HA SER 129 HA SER 129 8.614 -18.726 4.081
3 HB2 SER 129 HB2 SER 129 10.963 -19.699 4.204
4 HB3 SER 129 HB3 SER 129 10.864 -17.990 3.775
5 HG SER 129 HG SER 129 11.152 -18.753 6.470
No H/Q in entry = 5
In of MODEL 20
1 HA2 GLY -4 HA2 GLY -4 0.191 14.302 -22.885
2 HA3 GLY -4 HA3 GLY -4 -0.761 13.978 -24.328
3 H1 GLY -4 H1 GLY -4 0.664 15.886 -24.634
4 H2 GLY -4 H2 GLY -4 -0.033 16.661 -23.306
No H/Q in entry = 4
In of MODEL 20
1 H SER -3 H SER -3 -1.340 13.173 -21.629
2 HA SER -3 HA SER -3 -3.916 14.550 -21.281
3 HB2 SER -3 HB2 SER -3 -3.168 11.707 -20.552
4 HB3 SER -3 HB3 SER -3 -4.765 12.432 -20.396
5 HG SER -3 HG SER -3 -5.015 11.647 -22.336
No H/Q in entry = 5
In of MODEL 20
1 HA PRO -2 HA PRO -2 -1.681 15.645 -17.469
2 HB2 PRO -2 HB2 PRO -2 -3.143 17.835 -16.890
3 HB3 PRO -2 HB3 PRO -2 -1.855 17.845 -18.100
4 HG2 PRO -2 HG2 PRO -2 -4.810 17.629 -18.483
5 HG3 PRO -2 HG3 PRO -2 -3.630 18.588 -19.394
6 HD2 PRO -2 HD2 PRO -2 -4.610 16.205 -20.270
7 HD3 PRO -2 HD3 PRO -2 -2.988 16.796 -20.682
No H/Q in entry = 7
In of MODEL 20
1 H GLU -1 H GLU -1 -5.058 15.060 -17.998
2 HA GLU -1 HA GLU -1 -5.477 14.641 -15.114
3 HB2 GLU -1 HB2 GLU -1 -7.425 15.276 -17.332
4 HB3 GLU -1 HB3 GLU -1 -7.928 14.771 -15.726
5 HG2 GLU -1 HG2 GLU -1 -6.271 17.207 -16.330
6 HG3 GLU -1 HG3 GLU -1 -8.012 17.203 -16.043
No H/Q in entry = 6
In of MODEL 20
1 H PHE 0 H PHE 0 -4.132 12.716 -16.633
2 HA PHE 0 HA PHE 0 -5.907 10.727 -17.621
3 HB2 PHE 0 HB2 PHE 0 -3.478 11.037 -18.279
4 HB3 PHE 0 HB3 PHE 0 -3.050 10.317 -16.734
5 HD1 PHE 0 HD1 PHE 0 -5.847 9.290 -18.941
6 HD2 PHE 0 HD2 PHE 0 -1.970 8.363 -17.449
7 HE1 PHE 0 HE1 PHE 0 -5.999 7.051 -19.946
8 HE2 PHE 0 HE2 PHE 0 -2.114 6.126 -18.459
9 HZ PHE 0 HZ PHE 0 -4.132 5.468 -19.709
No H/Q in entry = 9
In of MODEL 20
1 H HIS 1 H HIS 1 -4.263 11.283 -14.538
2 HA HIS 1 HA HIS 1 -4.557 10.377 -12.459
3 HB2 HIS 1 HB2 HIS 1 -6.835 11.415 -13.041
4 HB3 HIS 1 HB3 HIS 1 -7.380 9.773 -13.344
5 HD1 HIS 1 HD1 HIS 1 -6.820 12.217 -10.662
6 HD2 HIS 1 HD2 HIS 1 -7.434 8.118 -10.964
7 HE1 HIS 1 HE1 HIS 1 -7.465 11.458 -8.356
8 HE2 HIS 1 HE2 HIS 1 -8.007 9.013 -8.605
No H/Q in entry = 8
In of MODEL 20
1 H HIS 2 H HIS 2 -3.194 8.642 -13.761
2 HA HIS 2 HA HIS 2 -4.621 6.078 -13.853
3 HB2 HIS 2 HB2 HIS 2 -3.275 6.985 -15.842
4 HB3 HIS 2 HB3 HIS 2 -1.841 6.621 -14.887
5 HD1 HIS 2 HD1 HIS 2 -0.858 4.448 -15.506
6 HD2 HIS 2 HD2 HIS 2 -4.983 4.467 -15.987
7 HE1 HIS 2 HE1 HIS 2 -1.438 2.193 -16.443
8 HE2 HIS 2 HE2 HIS 2 -3.913 2.309 -16.916
No H/Q in entry = 8
In of MODEL 20
1 H PHE 3 H PHE 3 -4.624 5.452 -11.750
2 HA PHE 3 HA PHE 3 -3.904 4.637 -9.769
3 HB2 PHE 3 HB2 PHE 3 -1.516 4.024 -11.495
4 HB3 PHE 3 HB3 PHE 3 -1.535 3.621 -9.781
5 HD1 PHE 3 HD1 PHE 3 -3.102 1.944 -8.919
6 HD2 PHE 3 HD2 PHE 3 -2.796 2.790 -13.077
7 HE1 PHE 3 HE1 PHE 3 -4.283 -0.149 -9.431
8 HE2 PHE 3 HE2 PHE 3 -3.978 0.697 -13.596
9 HZ PHE 3 HZ PHE 3 -4.701 -0.794 -11.750
No H/Q in entry = 9
In of MODEL 20
1 H THR 4 H THR 4 -3.707 7.424 -10.106
2 HA THR 4 HA THR 4 -1.234 8.344 -9.015
3 HB THR 4 HB THR 4 -2.426 10.486 -8.660
4 HG1 THR 4 HG1 THR 4 -4.544 10.594 -8.756
5 HG21 THR 4 HG21 THR 4 -2.902 9.240 -11.365
6 HG22 THR 4 HG22 THR 4 -2.910 10.971 -11.016
7 HG23 THR 4 HG23 THR 4 -1.424 10.039 -10.835
No H/Q in entry = 7
In of MODEL 20
1 H LEU 5 H LEU 5 -0.956 9.192 -6.856
2 HA LEU 5 HA LEU 5 -1.509 7.329 -4.941
3 HB2 LEU 5 HB2 LEU 5 0.190 9.255 -4.993
4 HB3 LEU 5 HB3 LEU 5 -1.074 10.227 -4.275
5 HG LEU 5 HG LEU 5 0.648 9.294 -2.687
6 HD11 LEU 5 HD11 LEU 5 -1.500 10.117 -1.890
7 HD12 LEU 5 HD12 LEU 5 -2.215 8.529 -2.161
8 HD13 LEU 5 HD13 LEU 5 -0.955 8.731 -0.946
9 HD21 LEU 5 HD21 LEU 5 0.836 7.073 -3.719
10 HD22 LEU 5 HD22 LEU 5 0.467 6.984 -1.997
11 HD23 LEU 5 HD23 LEU 5 -0.804 6.702 -3.187
No H/Q in entry = 11
In of MODEL 20
1 H GLU 6 H GLU 6 -3.270 10.382 -5.430
2 HA GLU 6 HA GLU 6 -5.199 10.399 -3.519
3 HB2 GLU 6 HB2 GLU 6 -5.762 10.744 -6.473
4 HB3 GLU 6 HB3 GLU 6 -6.744 11.368 -5.159
5 HG2 GLU 6 HG2 GLU 6 -5.302 13.064 -4.694
6 HG3 GLU 6 HG3 GLU 6 -3.895 12.172 -5.278
No H/Q in entry = 6
In of MODEL 20
1 H SER 7 H SER 7 -5.046 8.062 -6.201
2 HA SER 7 HA SER 7 -7.724 7.370 -6.318
3 HB2 SER 7 HB2 SER 7 -5.399 5.524 -6.854
4 HB3 SER 7 HB3 SER 7 -7.027 5.399 -7.520
5 HG SER 7 HG SER 7 -5.026 7.317 -8.062
No H/Q in entry = 5
In of MODEL 20
1 H SER 8 H SER 8 -5.566 6.577 -3.746
2 HA SER 8 HA SER 8 -7.170 4.239 -3.049
3 HB2 SER 8 HB2 SER 8 -5.371 3.891 -1.291
4 HB3 SER 8 HB3 SER 8 -4.894 3.707 -2.985
5 HG SER 8 HG SER 8 -3.792 5.564 -2.910
No H/Q in entry = 5
In of MODEL 20
1 H LEU 9 H LEU 9 -6.775 7.512 -2.044
2 HA LEU 9 HA LEU 9 -6.661 7.375 0.635
3 HB2 LEU 9 HB2 LEU 9 -7.708 9.428 -1.232
4 HB3 LEU 9 HB3 LEU 9 -7.723 9.704 0.501
5 HG LEU 9 HG LEU 9 -5.750 10.659 -0.634
6 HD11 LEU 9 HD11 LEU 9 -5.672 10.010 1.736
7 HD12 LEU 9 HD12 LEU 9 -5.081 8.420 1.250
8 HD13 LEU 9 HD13 LEU 9 -4.099 9.858 0.951
9 HD21 LEU 9 HD21 LEU 9 -5.450 8.925 -2.340
10 HD22 LEU 9 HD22 LEU 9 -3.975 9.295 -1.448
11 HD23 LEU 9 HD23 LEU 9 -4.886 7.833 -1.077
No H/Q in entry = 11
In of MODEL 20
1 H ASP 10 H ASP 10 -9.665 7.239 -1.129
2 HA ASP 10 HA ASP 10 -11.108 7.052 1.421
3 HB2 ASP 10 HB2 ASP 10 -12.087 7.350 -1.426
4 HB3 ASP 10 HB3 ASP 10 -13.154 7.143 -0.043
No H/Q in entry = 4
In of MODEL 20
1 H THR 11 H THR 11 -9.499 4.972 -0.380
2 HA THR 11 HA THR 11 -11.375 2.823 0.285
3 HB THR 11 HB THR 11 -10.463 1.561 -1.715
4 HG1 THR 11 HG1 THR 11 -9.773 4.124 -2.721
5 HG21 THR 11 HG21 THR 11 -12.708 2.533 -1.714
6 HG22 THR 11 HG22 THR 11 -12.048 4.076 -2.258
7 HG23 THR 11 HG23 THR 11 -11.967 2.664 -3.312
No H/Q in entry = 7
In of MODEL 20
1 H HIS 12 H HIS 12 -8.305 2.384 -1.280
2 HA HIS 12 HA HIS 12 -7.439 0.508 0.575
3 HB2 HIS 12 HB2 HIS 12 -5.658 2.005 -1.338
4 HB3 HIS 12 HB3 HIS 12 -5.388 0.399 -0.668
5 HD1 HIS 12 HD1 HIS 12 -7.842 -1.121 -1.251
6 HD2 HIS 12 HD2 HIS 12 -6.378 1.699 -3.931
7 HE1 HIS 12 HE1 HIS 12 -8.865 -1.703 -3.471
8 HE2 HIS 12 HE2 HIS 12 -7.835 -0.093 -5.108
No H/Q in entry = 8
In of MODEL 20
1 H LEU 13 H LEU 13 -6.818 3.976 0.401
2 HA LEU 13 HA LEU 13 -4.999 3.655 2.693
3 HB2 LEU 13 HB2 LEU 13 -5.120 5.752 0.561
4 HB3 LEU 13 HB3 LEU 13 -4.267 6.015 2.067
5 HG LEU 13 HG LEU 13 -3.642 3.961 -0.047
6 HD11 LEU 13 HD11 LEU 13 -2.860 6.220 -0.510
7 HD12 LEU 13 HD12 LEU 13 -2.070 6.280 1.067
8 HD13 LEU 13 HD13 LEU 13 -1.509 5.141 -0.158
9 HD21 LEU 13 HD21 LEU 13 -2.450 4.285 2.703
10 HD22 LEU 13 HD22 LEU 13 -3.319 2.884 2.080
11 HD23 LEU 13 HD23 LEU 13 -1.747 3.313 1.411
No H/Q in entry = 11
In of MODEL 20
1 H LYS 14 H LYS 14 -7.943 3.886 2.633
2 HA LYS 14 HA LYS 14 -8.812 6.405 3.492
3 HB2 LYS 14 HB2 LYS 14 -10.180 4.509 2.539
4 HB3 LYS 14 HB3 LYS 14 -10.075 3.741 4.114
5 HG2 LYS 14 HG2 LYS 14 -11.175 5.666 5.116
6 HG3 LYS 14 HG3 LYS 14 -11.283 6.405 3.520
7 HD2 LYS 14 HD2 LYS 14 -13.403 5.364 4.130
8 HD3 LYS 14 HD3 LYS 14 -12.677 4.549 2.747
9 HE2 LYS 14 HE2 LYS 14 -13.582 2.913 4.276
10 HE3 LYS 14 HE3 LYS 14 -11.824 2.798 4.256
11 HZ1 LYS 14 HZ1 LYS 14 -13.407 4.218 6.330
12 HZ2 LYS 14 HZ2 LYS 14 -12.756 2.665 6.506
13 HZ3 LYS 14 HZ3 LYS 14 -11.732 3.998 6.330
No H/Q in entry = 13
In of MODEL 20
1 H TRP 15 H TRP 15 -7.239 3.846 5.159
2 HA TRP 15 HA TRP 15 -8.173 4.449 7.795
3 HB2 TRP 15 HB2 TRP 15 -6.310 2.911 8.481
4 HB3 TRP 15 HB3 TRP 15 -7.427 2.210 7.310
5 HD1 TRP 15 HD1 TRP 15 -6.534 1.941 4.781
6 HE1 TRP 15 HE1 TRP 15 -4.158 1.735 3.833
7 HE3 TRP 15 HE3 TRP 15 -3.903 3.619 8.828
8 HZ2 TRP 15 HZ2 TRP 15 -1.506 2.208 4.692
9 HZ3 TRP 15 HZ3 TRP 15 -1.450 3.706 8.685
10 HH2 TRP 15 HH2 TRP 15 -0.275 3.013 6.660
No H/Q in entry = 10
In of MODEL 20
1 H LEU 16 H LEU 16 -6.032 6.008 5.735
2 HA LEU 16 HA LEU 16 -4.176 6.999 7.700
3 HB2 LEU 16 HB2 LEU 16 -4.919 8.132 4.993
4 HB3 LEU 16 HB3 LEU 16 -3.555 8.631 5.967
5 HG LEU 16 HG LEU 16 -3.872 5.881 4.756
6 HD11 LEU 16 HD11 LEU 16 -3.619 7.627 3.057
7 HD12 LEU 16 HD12 LEU 16 -2.175 8.212 3.877
8 HD13 LEU 16 HD13 LEU 16 -2.187 6.603 3.157
9 HD21 LEU 16 HD21 LEU 16 -1.566 7.225 6.163
10 HD22 LEU 16 HD22 LEU 16 -2.470 5.816 6.717
11 HD23 LEU 16 HD23 LEU 16 -1.453 5.702 5.278
No H/Q in entry = 11
In of MODEL 20
1 H SER 17 H SER 17 -4.216 8.985 8.690
2 HA SER 17 HA SER 17 -6.834 10.126 9.097
3 HB2 SER 17 HB2 SER 17 -5.768 11.553 10.741
4 HB3 SER 17 HB3 SER 17 -5.147 9.918 10.940
5 HG SER 17 HG SER 17 -3.347 11.106 10.922
No H/Q in entry = 5
In of MODEL 20
1 H GLN 18 H GLN 18 -7.099 12.598 8.919
2 HA GLN 18 HA GLN 18 -6.689 13.338 6.250
3 HB2 GLN 18 HB2 GLN 18 -8.420 14.334 7.771
4 HB3 GLN 18 HB3 GLN 18 -7.136 15.205 8.598
5 HG2 GLN 18 HG2 GLN 18 -8.192 16.702 7.082
6 HG3 GLN 18 HG3 GLN 18 -6.592 16.321 6.448
7 HE21 GLN 18 HE21 GLN 18 -7.148 16.839 4.349
8 HE22 GLN 18 HE22 GLN 18 -8.215 15.863 3.397
No H/Q in entry = 8
In of MODEL 20
1 H GLU 19 H GLU 19 -4.931 14.230 9.186
2 HA GLU 19 HA GLU 19 -3.100 15.961 8.011
3 HB2 GLU 19 HB2 GLU 19 -2.866 14.163 10.422
4 HB3 GLU 19 HB3 GLU 19 -1.733 15.420 10.014
5 HG2 GLU 19 HG2 GLU 19 -3.600 17.060 10.143
6 HG3 GLU 19 HG3 GLU 19 -4.604 15.753 10.771
No H/Q in entry = 6
In of MODEL 20
1 H GLN 20 H GLN 20 -3.090 12.425 8.273
2 HA GLN 20 HA GLN 20 -0.428 12.147 7.267
3 HB2 GLN 20 HB2 GLN 20 -2.715 10.164 7.391
4 HB3 GLN 20 HB3 GLN 20 -1.072 9.752 6.920
5 HG2 GLN 20 HG2 GLN 20 -0.251 10.336 9.104
6 HG3 GLN 20 HG3 GLN 20 -1.848 10.907 9.587
7 HE21 GLN 20 HE21 GLN 20 -0.213 8.865 10.818
8 HE22 GLN 20 HE22 GLN 20 -1.143 7.405 10.780
No H/Q in entry = 8
In of MODEL 20
1 H LYS 21 H LYS 21 -3.674 11.920 5.823
2 HA LYS 21 HA LYS 21 -2.931 11.311 3.201
3 HB2 LYS 21 HB2 LYS 21 -5.186 13.106 4.128
4 HB3 LYS 21 HB3 LYS 21 -5.033 12.431 2.515
5 HG2 LYS 21 HG2 LYS 21 -5.131 10.144 3.606
6 HG3 LYS 21 HG3 LYS 21 -5.604 10.982 5.086
7 HD2 LYS 21 HD2 LYS 21 -7.554 11.879 4.055
8 HD3 LYS 21 HD3 LYS 21 -7.034 11.344 2.461
9 HE2 LYS 21 HE2 LYS 21 -8.644 9.782 3.036
10 HE3 LYS 21 HE3 LYS 21 -7.140 8.974 3.468
11 HZ1 LYS 21 HZ1 LYS 21 -8.795 10.485 5.404
12 HZ2 LYS 21 HZ2 LYS 21 -8.949 8.822 5.151
13 HZ3 LYS 21 HZ3 LYS 21 -7.498 9.454 5.750
No H/Q in entry = 13
In of MODEL 20
1 H ASP 22 H ASP 22 -3.391 14.441 4.742
2 HA ASP 22 HA ASP 22 -2.593 16.072 2.590
3 HB2 ASP 22 HB2 ASP 22 -3.862 16.966 4.443
4 HB3 ASP 22 HB3 ASP 22 -2.597 16.524 5.577
No H/Q in entry = 4
In of MODEL 20
1 H GLU 23 H GLU 23 -0.707 14.621 5.261
2 HA GLU 23 HA GLU 23 1.766 15.760 4.680
3 HB2 GLU 23 HB2 GLU 23 0.822 13.901 6.453
4 HB3 GLU 23 HB3 GLU 23 1.809 12.911 5.380
5 HG2 GLU 23 HG2 GLU 23 3.697 14.325 5.747
6 HG3 GLU 23 HG3 GLU 23 2.716 15.421 6.712
No H/Q in entry = 6
In of MODEL 20
1 H LEU 24 H LEU 24 0.421 12.684 3.414
2 HA LEU 24 HA LEU 24 2.529 12.142 1.666
3 HB2 LEU 24 HB2 LEU 24 -0.330 11.309 1.879
4 HB3 LEU 24 HB3 LEU 24 0.604 10.836 0.475
5 HG LEU 24 HG LEU 24 2.143 9.613 1.843
6 HD11 LEU 24 HD11 LEU 24 2.092 11.175 3.769
7 HD12 LEU 24 HD12 LEU 24 0.620 10.354 4.285
8 HD13 LEU 24 HD13 LEU 24 2.139 9.455 4.157
9 HD21 LEU 24 HD21 LEU 24 -0.703 9.051 2.592
10 HD22 LEU 24 HD22 LEU 24 0.157 8.431 1.182
11 HD23 LEU 24 HD23 LEU 24 0.639 7.926 2.803
No H/Q in entry = 11
In of MODEL 20
1 H LEU 25 H LEU 25 -0.555 13.842 1.125
2 HA LEU 25 HA LEU 25 -0.237 14.315 -1.612
3 HB2 LEU 25 HB2 LEU 25 -1.642 15.962 0.489
4 HB3 LEU 25 HB3 LEU 25 -1.776 16.246 -1.233
5 HG LEU 25 HG LEU 25 -2.668 13.752 0.212
6 HD11 LEU 25 HD11 LEU 25 -4.246 15.981 -1.061
7 HD12 LEU 25 HD12 LEU 25 -4.919 14.500 -0.381
8 HD13 LEU 25 HD13 LEU 25 -4.103 15.660 0.667
9 HD21 LEU 25 HD21 LEU 25 -2.870 14.523 -2.696
10 HD22 LEU 25 HD22 LEU 25 -1.898 13.217 -2.019
11 HD23 LEU 25 HD23 LEU 25 -3.659 13.131 -1.953
No H/Q in entry = 11
In of MODEL 20
1 H LYS 26 H LYS 26 0.904 16.108 1.195
2 HA LYS 26 HA LYS 26 1.941 18.356 -0.146
3 HB2 LYS 26 HB2 LYS 26 1.609 18.302 2.269
4 HB3 LYS 26 HB3 LYS 26 2.830 17.046 2.422
5 HG2 LYS 26 HG2 LYS 26 4.510 18.640 1.539
6 HG3 LYS 26 HG3 LYS 26 3.267 19.893 1.545
7 HD2 LYS 26 HD2 LYS 26 4.671 20.022 3.543
8 HD3 LYS 26 HD3 LYS 26 3.004 19.626 3.958
9 HE2 LYS 26 HE2 LYS 26 3.596 17.276 4.168
10 HE3 LYS 26 HE3 LYS 26 5.255 17.638 3.702
11 HZ1 LYS 26 HZ1 LYS 26 5.428 19.044 5.688
12 HZ2 LYS 26 HZ2 LYS 26 3.864 18.596 6.145
13 HZ3 LYS 26 HZ3 LYS 26 5.093 17.436 6.079
No H/Q in entry = 13
In of MODEL 20
1 H MET 27 H MET 27 3.500 15.327 0.873
2 HA MET 27 HA MET 27 6.000 15.830 -0.180
3 HB2 MET 27 HB2 MET 27 4.586 13.169 -0.006
4 HB3 MET 27 HB3 MET 27 6.309 13.379 -0.274
5 HG2 MET 27 HG2 MET 27 6.172 14.741 1.956
6 HG3 MET 27 HG3 MET 27 4.704 13.793 2.190
7 HE1 MET 27 HE1 MET 27 5.541 11.181 0.567
8 HE2 MET 27 HE2 MET 27 6.243 10.128 1.798
9 HE3 MET 27 HE3 MET 27 4.749 11.007 2.133
No H/Q in entry = 9
In of MODEL 20
1 H LYS 28 H LYS 28 3.309 14.117 -1.817
2 HA LYS 28 HA LYS 28 4.690 13.664 -4.237
3 HB2 LYS 28 HB2 LYS 28 2.529 12.607 -3.391
4 HB3 LYS 28 HB3 LYS 28 1.721 14.041 -4.009
5 HG2 LYS 28 HG2 LYS 28 2.531 13.579 -6.241
6 HG3 LYS 28 HG3 LYS 28 3.441 12.188 -5.647
7 HD2 LYS 28 HD2 LYS 28 1.289 11.184 -4.903
8 HD3 LYS 28 HD3 LYS 28 0.447 12.524 -5.679
9 HE2 LYS 28 HE2 LYS 28 2.232 10.504 -7.025
10 HE3 LYS 28 HE3 LYS 28 0.475 10.588 -7.138
11 HZ1 LYS 28 HZ1 LYS 28 0.728 12.789 -8.178
12 HZ2 LYS 28 HZ2 LYS 28 2.409 12.601 -8.148
13 HZ3 LYS 28 HZ3 LYS 28 1.459 11.561 -9.079
No H/Q in entry = 13
In of MODEL 20
1 H LYS 29 H LYS 29 2.628 16.323 -3.145
2 HA LYS 29 HA LYS 29 2.571 17.677 -5.614
3 HB2 LYS 29 HB2 LYS 29 0.956 18.035 -3.759
4 HB3 LYS 29 HB3 LYS 29 2.216 18.873 -2.867
5 HG2 LYS 29 HG2 LYS 29 0.689 20.432 -3.960
6 HG3 LYS 29 HG3 LYS 29 2.330 20.583 -4.591
7 HD2 LYS 29 HD2 LYS 29 1.719 19.243 -6.535
8 HD3 LYS 29 HD3 LYS 29 0.088 19.041 -5.899
9 HE2 LYS 29 HE2 LYS 29 1.345 21.691 -6.589
10 HE3 LYS 29 HE3 LYS 29 0.274 20.784 -7.656
11 HZ1 LYS 29 HZ1 LYS 29 -0.455 21.805 -4.964
12 HZ2 LYS 29 HZ2 LYS 29 -0.902 22.511 -6.433
13 HZ3 LYS 29 HZ3 LYS 29 -1.478 20.977 -6.023
No H/Q in entry = 13
In of MODEL 20
1 H ASP 30 H ASP 30 4.895 17.730 -2.995
2 HA ASP 30 HA ASP 30 6.166 20.100 -4.103
3 HB2 ASP 30 HB2 ASP 30 5.925 19.850 -1.638
4 HB3 ASP 30 HB3 ASP 30 6.995 18.454 -1.699
No H/Q in entry = 4
In of MODEL 20
1 H GLY 31 H GLY 31 6.212 16.937 -4.802
2 HA2 GLY 31 HA2 GLY 31 8.694 17.323 -6.274
3 HA3 GLY 31 HA3 GLY 31 7.451 16.137 -6.630
No H/Q in entry = 3
In of MODEL 20
1 H LYS 32 H LYS 32 7.512 15.436 -3.645
2 HA LYS 32 HA LYS 32 10.004 14.094 -3.335
3 HB2 LYS 32 HB2 LYS 32 7.329 13.666 -1.994
4 HB3 LYS 32 HB3 LYS 32 8.783 12.776 -1.571
5 HG2 LYS 32 HG2 LYS 32 8.389 15.753 -1.330
6 HG3 LYS 32 HG3 LYS 32 8.403 14.586 -0.006
7 HD2 LYS 32 HD2 LYS 32 10.736 14.007 -0.593
8 HD3 LYS 32 HD3 LYS 32 10.707 15.253 -1.840
9 HE2 LYS 32 HE2 LYS 32 11.780 16.180 0.073
10 HE3 LYS 32 HE3 LYS 32 10.183 16.918 -0.053
11 HZ1 LYS 32 HZ1 LYS 32 9.392 15.375 1.644
12 HZ2 LYS 32 HZ2 LYS 32 10.941 14.706 1.778
13 HZ3 LYS 32 HZ3 LYS 32 10.674 16.316 2.218
No H/Q in entry = 13
In of MODEL 20
1 H ALA 33 H ALA 33 10.381 11.894 -3.581
2 HA ALA 33 HA ALA 33 9.393 10.883 -6.051
3 HB1 ALA 33 HB1 ALA 33 11.693 10.474 -5.247
4 HB2 ALA 33 HB2 ALA 33 10.847 8.989 -5.683
5 HB3 ALA 33 HB3 ALA 33 11.038 9.428 -3.988
No H/Q in entry = 5
In of MODEL 20
1 H LYS 34 H LYS 34 8.150 9.040 -6.459
2 HA LYS 34 HA LYS 34 5.957 8.477 -4.856
3 HB2 LYS 34 HB2 LYS 34 6.085 7.903 -7.226
4 HB3 LYS 34 HB3 LYS 34 7.356 6.739 -6.900
5 HG2 LYS 34 HG2 LYS 34 5.205 5.669 -7.301
6 HG3 LYS 34 HG3 LYS 34 5.814 5.339 -5.680
7 HD2 LYS 34 HD2 LYS 34 4.266 6.820 -4.692
8 HD3 LYS 34 HD3 LYS 34 3.853 7.547 -6.248
9 HE2 LYS 34 HE2 LYS 34 2.144 5.953 -5.332
10 HE3 LYS 34 HE3 LYS 34 2.717 5.578 -6.956
11 HZ1 LYS 34 HZ1 LYS 34 3.695 4.291 -4.458
12 HZ2 LYS 34 HZ2 LYS 34 2.583 3.610 -5.537
13 HZ3 LYS 34 HZ3 LYS 34 4.177 3.896 -6.038
No H/Q in entry = 13
In of MODEL 20
1 H LYS 35 H LYS 35 9.131 6.972 -4.981
2 HA LYS 35 HA LYS 35 8.762 4.847 -3.240
3 HB2 LYS 35 HB2 LYS 35 10.775 5.360 -4.655
4 HB3 LYS 35 HB3 LYS 35 11.241 6.551 -3.453
5 HG2 LYS 35 HG2 LYS 35 12.474 4.502 -3.133
6 HG3 LYS 35 HG3 LYS 35 11.392 4.788 -1.769
7 HD2 LYS 35 HD2 LYS 35 11.341 2.446 -2.421
8 HD3 LYS 35 HD3 LYS 35 9.781 3.206 -2.729
9 HE2 LYS 35 HE2 LYS 35 10.368 3.446 -5.093
10 HE3 LYS 35 HE3 LYS 35 11.931 2.691 -4.782
11 HZ1 LYS 35 HZ1 LYS 35 10.723 0.694 -4.053
12 HZ2 LYS 35 HZ2 LYS 35 9.263 1.424 -4.495
13 HZ3 LYS 35 HZ3 LYS 35 10.427 1.076 -5.672
No H/Q in entry = 13
In of MODEL 20
1 H GLU 36 H GLU 36 8.667 8.199 -2.508
2 HA GLU 36 HA GLU 36 9.380 7.827 0.283
3 HB2 GLU 36 HB2 GLU 36 8.497 10.331 -1.149
4 HB3 GLU 36 HB3 GLU 36 9.210 10.235 0.458
5 HG2 GLU 36 HG2 GLU 36 11.239 9.254 -0.571
6 HG3 GLU 36 HG3 GLU 36 10.523 9.546 -2.144
No H/Q in entry = 6
In of MODEL 20
1 H LEU 37 H LEU 37 6.618 8.234 -1.749
2 HA LEU 37 HA LEU 37 4.662 8.585 0.224
3 HB2 LEU 37 HB2 LEU 37 4.660 7.345 -2.516
4 HB3 LEU 37 HB3 LEU 37 3.202 7.532 -1.566
5 HG LEU 37 HG LEU 37 3.586 9.267 -3.304
6 HD11 LEU 37 HD11 LEU 37 2.106 9.590 -1.359
7 HD12 LEU 37 HD12 LEU 37 3.467 10.305 -0.494
8 HD13 LEU 37 HD13 LEU 37 2.822 11.097 -1.930
9 HD21 LEU 37 HD21 LEU 37 5.969 9.603 -3.105
10 HD22 LEU 37 HD22 LEU 37 5.093 11.113 -2.860
11 HD23 LEU 37 HD23 LEU 37 5.745 10.238 -1.474
No H/Q in entry = 11
In of MODEL 20
1 H GLU 38 H GLU 38 5.988 5.667 -1.310
2 HA GLU 38 HA GLU 38 4.453 3.816 0.192
3 HB2 GLU 38 HB2 GLU 38 6.887 3.637 -1.498
4 HB3 GLU 38 HB3 GLU 38 6.613 2.335 -0.348
5 HG2 GLU 38 HG2 GLU 38 5.681 1.725 -2.464
6 HG3 GLU 38 HG3 GLU 38 4.372 1.997 -1.315
No H/Q in entry = 6
In of MODEL 20
1 H ALA 39 H ALA 39 6.960 5.860 1.075
2 HA ALA 39 HA ALA 39 8.042 4.074 3.088
3 HB1 ALA 39 HB1 ALA 39 8.780 6.946 2.529
4 HB2 ALA 39 HB2 ALA 39 9.682 5.786 3.504
5 HB3 ALA 39 HB3 ALA 39 9.529 5.545 1.765
No H/Q in entry = 5
In of MODEL 20
1 H LYS 40 H LYS 40 6.252 7.126 2.973
2 HA LYS 40 HA LYS 40 6.052 7.426 5.777
3 HB2 LYS 40 HB2 LYS 40 5.617 9.122 3.849
4 HB3 LYS 40 HB3 LYS 40 4.002 8.434 3.824
5 HG2 LYS 40 HG2 LYS 40 3.936 10.384 5.171
6 HG3 LYS 40 HG3 LYS 40 3.803 8.991 6.246
7 HD2 LYS 40 HD2 LYS 40 5.313 10.537 7.255
8 HD3 LYS 40 HD3 LYS 40 6.269 9.185 6.654
9 HE2 LYS 40 HE2 LYS 40 6.802 10.510 4.634
10 HE3 LYS 40 HE3 LYS 40 5.915 11.867 5.322
11 HZ1 LYS 40 HZ1 LYS 40 7.470 11.873 7.182
12 HZ2 LYS 40 HZ2 LYS 40 8.328 10.593 6.492
13 HZ3 LYS 40 HZ3 LYS 40 8.274 12.091 5.713
No H/Q in entry = 13
In of MODEL 20
1 H ILE 41 H ILE 41 3.984 5.955 3.294
2 HA ILE 41 HA ILE 41 1.844 5.235 4.950
3 HB ILE 41 HB ILE 41 2.858 3.971 2.408
4 HG12 ILE 41 HG12 ILE 41 0.560 5.870 2.893
5 HG13 ILE 41 HG13 ILE 41 2.151 6.362 2.316
6 HG21 ILE 41 HG21 ILE 41 0.220 3.588 3.817
7 HG22 ILE 41 HG22 ILE 41 0.629 2.967 2.218
8 HG23 ILE 41 HG23 ILE 41 1.493 2.381 3.640
9 HD11 ILE 41 HD11 ILE 41 1.854 4.988 0.336
10 HD12 ILE 41 HD12 ILE 41 0.261 4.498 0.915
11 HD13 ILE 41 HD13 ILE 41 0.567 6.183 0.500
No H/Q in entry = 11
In of MODEL 20
1 H LEU 42 H LEU 42 4.690 3.343 3.918
2 HA LEU 42 HA LEU 42 4.001 1.000 5.308
3 HB2 LEU 42 HB2 LEU 42 6.650 2.086 4.397
4 HB3 LEU 42 HB3 LEU 42 6.499 0.532 5.180
5 HG LEU 42 HG LEU 42 5.361 1.364 2.525
6 HD11 LEU 42 HD11 LEU 42 7.349 -0.747 3.314
7 HD12 LEU 42 HD12 LEU 42 6.749 -0.456 1.682
8 HD13 LEU 42 HD13 LEU 42 7.700 0.777 2.504
9 HD21 LEU 42 HD21 LEU 42 4.832 -1.120 4.144
10 HD22 LEU 42 HD22 LEU 42 3.657 0.023 3.501
11 HD23 LEU 42 HD23 LEU 42 4.559 -1.025 2.404
No H/Q in entry = 11
In of MODEL 20
1 H HIS 43 H HIS 43 5.746 3.876 6.271
2 HA HIS 43 HA HIS 43 6.526 2.982 8.839
3 HB2 HIS 43 HB2 HIS 43 7.401 5.031 7.671
4 HB3 HIS 43 HB3 HIS 43 5.864 5.818 8.008
5 HD1 HIS 43 HD1 HIS 43 6.297 7.461 9.802
6 HD2 HIS 43 HD2 HIS 43 8.246 3.860 10.501
7 HE1 HIS 43 HE1 HIS 43 7.413 7.722 12.035
8 HE2 HIS 43 HE2 HIS 43 8.496 5.495 12.489
No H/Q in entry = 8
In of MODEL 20
1 H TYR 44 H TYR 44 3.676 4.896 7.761
2 HA TYR 44 HA TYR 44 2.280 5.035 10.155
3 HB2 TYR 44 HB2 TYR 44 1.221 4.630 7.351
4 HB3 TYR 44 HB3 TYR 44 0.208 5.013 8.733
5 HD1 TYR 44 HD1 TYR 44 2.166 6.983 10.016
6 HD2 TYR 44 HD2 TYR 44 0.733 6.534 6.046
7 HE1 TYR 44 HE1 TYR 44 2.501 9.373 9.638
8 HE2 TYR 44 HE2 TYR 44 1.068 8.932 5.637
9 HH TYR 44 HH TYR 44 2.883 10.909 7.591
No H/Q in entry = 9
In of MODEL 20
1 H TYR 45 H TYR 45 2.220 2.555 7.677
2 HA TYR 45 HA TYR 45 0.294 0.837 8.609
3 HB2 TYR 45 HB2 TYR 45 1.289 0.699 6.391
4 HB3 TYR 45 HB3 TYR 45 2.846 0.277 7.086
5 HD1 TYR 45 HD1 TYR 45 -0.660 -0.930 7.130
6 HD2 TYR 45 HD2 TYR 45 3.465 -1.919 7.033
7 HE1 TYR 45 HE1 TYR 45 -1.249 -3.301 6.957
8 HE2 TYR 45 HE2 TYR 45 2.895 -4.303 6.859
9 HH TYR 45 HH TYR 45 1.194 -5.813 7.124
No H/Q in entry = 9
In of MODEL 20
1 H ASP 46 H ASP 46 3.779 0.795 9.335
2 HA ASP 46 HA ASP 46 3.570 -1.586 10.893
3 HB2 ASP 46 HB2 ASP 46 5.678 -0.935 9.764
4 HB3 ASP 46 HB3 ASP 46 5.785 0.486 10.792
No H/Q in entry = 4
In of MODEL 20
1 H GLU 47 H GLU 47 3.031 1.740 11.620
2 HA GLU 47 HA GLU 47 3.476 1.357 14.462
3 HB2 GLU 47 HB2 GLU 47 2.510 3.756 12.901
4 HB3 GLU 47 HB3 GLU 47 2.854 3.745 14.624
5 HG2 GLU 47 HG2 GLU 47 5.194 3.253 14.161
6 HG3 GLU 47 HG3 GLU 47 4.849 3.236 12.431
No H/Q in entry = 6
In of MODEL 20
1 H LEU 48 H LEU 48 1.102 0.380 12.506
2 HA LEU 48 HA LEU 48 -1.225 1.576 13.569
3 HB2 LEU 48 HB2 LEU 48 -0.682 -0.816 11.858
4 HB3 LEU 48 HB3 LEU 48 -2.305 -0.415 12.351
5 HG LEU 48 HG LEU 48 -0.483 1.354 10.739
6 HD11 LEU 48 HD11 LEU 48 -1.310 -0.583 9.513
7 HD12 LEU 48 HD12 LEU 48 -2.960 -0.182 9.989
8 HD13 LEU 48 HD13 LEU 48 -2.058 0.908 8.936
9 HD21 LEU 48 HD21 LEU 48 -3.308 1.720 11.717
10 HD22 LEU 48 HD22 LEU 48 -1.903 2.712 12.106
11 HD23 LEU 48 HD23 LEU 48 -2.555 2.711 10.468
No H/Q in entry = 11
In of MODEL 20
1 H GLU 49 H GLU 49 -2.844 -0.682 13.887
2 HA GLU 49 HA GLU 49 -2.185 -1.786 16.462
3 HB2 GLU 49 HB2 GLU 49 -4.240 0.423 16.203
4 HB3 GLU 49 HB3 GLU 49 -4.053 -0.597 17.618
5 HG2 GLU 49 HG2 GLU 49 -1.815 1.088 16.563
6 HG3 GLU 49 HG3 GLU 49 -3.019 1.717 17.688
No H/Q in entry = 6
In of MODEL 20
1 H GLY 50 H GLY 50 -3.413 -3.578 16.815
2 HA2 GLY 50 HA2 GLY 50 -5.999 -4.001 16.910
3 HA3 GLY 50 HA3 GLY 50 -4.950 -5.260 16.305
No H/Q in entry = 3
In of MODEL 20
1 H ASP 51 H ASP 51 -7.576 -3.264 15.636
2 HA ASP 51 HA ASP 51 -8.091 -4.667 13.187
3 HB2 ASP 51 HB2 ASP 51 -10.215 -3.573 13.154
4 HB3 ASP 51 HB3 ASP 51 -9.878 -3.992 14.826
No H/Q in entry = 4
In of MODEL 20
1 H ALA 52 H ALA 52 -6.731 -1.557 13.994
2 HA ALA 52 HA ALA 52 -7.225 -0.288 11.511
3 HB1 ALA 52 HB1 ALA 52 -4.915 0.148 13.417
4 HB2 ALA 52 HB2 ALA 52 -5.395 1.231 12.111
5 HB3 ALA 52 HB3 ALA 52 -6.474 0.970 13.482
No H/Q in entry = 5
In of MODEL 20
1 H LYS 53 H LYS 53 -4.615 -2.242 12.779
2 HA LYS 53 HA LYS 53 -2.908 -2.259 10.547
3 HB2 LYS 53 HB2 LYS 53 -2.339 -2.991 12.864
4 HB3 LYS 53 HB3 LYS 53 -3.289 -4.442 12.584
5 HG2 LYS 53 HG2 LYS 53 -1.019 -4.985 12.247
6 HG3 LYS 53 HG3 LYS 53 -1.786 -4.968 10.667
7 HD2 LYS 53 HD2 LYS 53 -0.858 -2.777 10.217
8 HD3 LYS 53 HD3 LYS 53 -0.173 -2.709 11.841
9 HE2 LYS 53 HE2 LYS 53 0.578 -4.655 9.662
10 HE3 LYS 53 HE3 LYS 53 1.540 -3.289 10.219
11 HZ1 LYS 53 HZ1 LYS 53 1.658 -4.352 12.413
12 HZ2 LYS 53 HZ2 LYS 53 0.811 -5.687 11.814
13 HZ3 LYS 53 HZ3 LYS 53 2.344 -5.314 11.202
No H/Q in entry = 13
In of MODEL 20
1 H LYS 54 H LYS 54 -5.186 -4.736 11.672
2 HA LYS 54 HA LYS 54 -5.069 -6.457 9.512
3 HB2 LYS 54 HB2 LYS 54 -6.491 -7.589 10.763
4 HB3 LYS 54 HB3 LYS 54 -6.590 -6.209 11.844
5 HG2 LYS 54 HG2 LYS 54 -8.536 -5.403 10.812
6 HG3 LYS 54 HG3 LYS 54 -8.328 -6.458 9.408
7 HD2 LYS 54 HD2 LYS 54 -8.675 -8.403 10.836
8 HD3 LYS 54 HD3 LYS 54 -8.898 -7.346 12.229
9 HE2 LYS 54 HE2 LYS 54 -10.835 -6.314 11.093
10 HE3 LYS 54 HE3 LYS 54 -10.637 -7.455 9.764
11 HZ1 LYS 54 HZ1 LYS 54 -11.018 -9.267 11.334
12 HZ2 LYS 54 HZ2 LYS 54 -11.244 -8.154 12.585
13 HZ3 LYS 54 HZ3 LYS 54 -12.333 -8.205 11.294
No H/Q in entry = 13
In of MODEL 20
1 H GLU 55 H GLU 55 -7.232 -3.648 9.936
2 HA GLU 55 HA GLU 55 -8.573 -4.030 7.492
3 HB2 GLU 55 HB2 GLU 55 -8.372 -1.858 9.511
4 HB3 GLU 55 HB3 GLU 55 -8.872 -1.375 7.901
5 HG2 GLU 55 HG2 GLU 55 -10.521 -3.429 8.236
6 HG3 GLU 55 HG3 GLU 55 -10.281 -2.991 9.926
No H/Q in entry = 6
In of MODEL 20
1 H ALA 56 H ALA 56 -5.848 -1.925 8.413
2 HA ALA 56 HA ALA 56 -5.671 -0.703 5.924
3 HB1 ALA 56 HB1 ALA 56 -3.376 -0.087 6.534
4 HB2 ALA 56 HB2 ALA 56 -3.400 -1.268 7.844
5 HB3 ALA 56 HB3 ALA 56 -4.466 0.135 7.901
No H/Q in entry = 5
In of MODEL 20
1 H THR 57 H THR 57 -3.888 -3.504 7.194
2 HA THR 57 HA THR 57 -2.376 -4.177 5.019
3 HB THR 57 HB THR 57 -3.872 -6.132 6.779
4 HG1 THR 57 HG1 THR 57 -2.688 -4.872 8.145
5 HG21 THR 57 HG21 THR 57 -1.351 -6.403 5.141
6 HG22 THR 57 HG22 THR 57 -1.962 -7.612 6.271
7 HG23 THR 57 HG23 THR 57 -2.899 -7.193 4.840
No H/Q in entry = 7
In of MODEL 20
1 H GLU 58 H GLU 58 -5.711 -5.154 5.689
2 HA GLU 58 HA GLU 58 -6.060 -6.643 3.275
3 HB2 GLU 58 HB2 GLU 58 -7.928 -5.602 5.392
4 HB3 GLU 58 HB3 GLU 58 -8.520 -6.444 3.960
5 HG2 GLU 58 HG2 GLU 58 -7.195 -8.396 4.545
6 HG3 GLU 58 HG3 GLU 58 -6.548 -7.548 5.949
No H/Q in entry = 6
In of MODEL 20
1 H HIS 59 H HIS 59 -6.293 -3.260 4.024
2 HA HIS 59 HA HIS 59 -7.924 -2.668 1.713
3 HB2 HIS 59 HB2 HIS 59 -6.449 -0.927 3.689
4 HB3 HIS 59 HB3 HIS 59 -7.245 -0.261 2.270
5 HD1 HIS 59 HD1 HIS 59 -9.843 -1.977 2.371
6 HD2 HIS 59 HD2 HIS 59 -8.151 -0.042 5.637
7 HE1 HIS 59 HE1 HIS 59 -11.711 -1.682 4.025
8 HE2 HIS 59 HE2 HIS 59 -10.616 -0.708 6.074
No H/Q in entry = 8
In of MODEL 20
1 H LEU 60 H LEU 60 -4.535 -2.105 2.664
2 HA LEU 60 HA LEU 60 -3.531 -1.353 0.223
3 HB2 LEU 60 HB2 LEU 60 -2.358 -2.800 2.564
4 HB3 LEU 60 HB3 LEU 60 -1.402 -2.477 1.130
5 HG LEU 60 HG LEU 60 -1.912 -0.087 1.406
6 HD11 LEU 60 HD11 LEU 60 -3.927 -0.211 2.643
7 HD12 LEU 60 HD12 LEU 60 -3.060 -0.892 4.024
8 HD13 LEU 60 HD13 LEU 60 -2.727 0.761 3.502
9 HD21 LEU 60 HD21 LEU 60 0.205 -0.993 2.186
10 HD22 LEU 60 HD22 LEU 60 -0.351 0.301 3.249
11 HD23 LEU 60 HD23 LEU 60 -0.537 -1.384 3.740
No H/Q in entry = 11
In of MODEL 20
1 H LYS 61 H LYS 61 -4.298 -4.594 1.428
2 HA LYS 61 HA LYS 61 -2.987 -6.070 -0.565
3 HB2 LYS 61 HB2 LYS 61 -5.333 -6.627 1.211
4 HB3 LYS 61 HB3 LYS 61 -4.953 -7.742 -0.093
5 HG2 LYS 61 HG2 LYS 61 -2.696 -8.034 0.832
6 HG3 LYS 61 HG3 LYS 61 -3.117 -6.945 2.157
7 HD2 LYS 61 HD2 LYS 61 -4.839 -8.457 2.911
8 HD3 LYS 61 HD3 LYS 61 -4.567 -9.511 1.523
9 HE2 LYS 61 HE2 LYS 61 -2.309 -9.980 2.314
10 HE3 LYS 61 HE3 LYS 61 -2.555 -8.906 3.687
11 HZ1 LYS 61 HZ1 LYS 61 -4.106 -11.381 3.148
12 HZ2 LYS 61 HZ2 LYS 61 -2.867 -11.229 4.286
13 HZ3 LYS 61 HZ3 LYS 61 -4.303 -10.361 4.479
No H/Q in entry = 13
In of MODEL 20
1 H GLY 62 H GLY 62 -6.401 -5.036 -0.404
2 HA2 GLY 62 HA2 GLY 62 -7.863 -4.472 -2.084
3 HA3 GLY 62 HA3 GLY 62 -7.149 -5.813 -2.970
No H/Q in entry = 3
In of MODEL 20
1 H GLY 63 H GLY 63 -5.609 -2.823 -1.879
2 HA2 GLY 63 HA2 GLY 63 -4.401 -1.250 -3.013
3 HA3 GLY 63 HA3 GLY 63 -5.587 -1.435 -4.298
No H/Q in entry = 3
In of MODEL 20
1 H CYS 64 H CYS 64 -3.027 -3.484 -2.935
2 HA CYS 64 HA CYS 64 -1.432 -3.319 -5.278
3 HB2 CYS 64 HB2 CYS 64 -0.394 -3.719 -3.136
4 HB3 CYS 64 HB3 CYS 64 -1.322 -5.204 -2.921
No H/Q in entry = 4
In of MODEL 20
1 H ARG 65 H ARG 65 -3.998 -5.427 -4.245
2 HA ARG 65 HA ARG 65 -3.653 -7.505 -6.094
3 HB2 ARG 65 HB2 ARG 65 -5.314 -7.608 -4.286
4 HB3 ARG 65 HB3 ARG 65 -6.233 -6.317 -5.047
5 HG2 ARG 65 HG2 ARG 65 -6.595 -7.766 -7.006
6 HG3 ARG 65 HG3 ARG 65 -5.741 -9.066 -6.173
7 HD2 ARG 65 HD2 ARG 65 -7.411 -9.058 -4.406
8 HD3 ARG 65 HD3 ARG 65 -8.242 -7.706 -5.176
9 HE ARG 65 HE ARG 65 -7.997 -9.878 -6.980
10 HH11 ARG 65 HH11 ARG 65 -9.796 -8.861 -4.147
11 HH12 ARG 65 HH12 ARG 65 -11.200 -9.801 -4.549
12 HH21 ARG 65 HH21 ARG 65 -9.847 -11.109 -7.514
13 HH22 ARG 65 HH22 ARG 65 -11.227 -11.085 -6.457
No H/Q in entry = 13
In of MODEL 20
1 H GLU 66 H GLU 66 -5.349 -4.393 -6.368
2 HA GLU 66 HA GLU 66 -6.100 -4.715 -9.075
3 HB2 GLU 66 HB2 GLU 66 -5.636 -2.186 -7.482
4 HB3 GLU 66 HB3 GLU 66 -6.376 -2.241 -9.074
5 HG2 GLU 66 HG2 GLU 66 -8.126 -3.757 -8.076
6 HG3 GLU 66 HG3 GLU 66 -7.451 -3.352 -6.499
No H/Q in entry = 6
In of MODEL 20
1 H ILE 67 H ILE 67 -3.149 -3.722 -7.519
2 HA ILE 67 HA ILE 67 -1.891 -2.701 -9.852
3 HB ILE 67 HB ILE 67 -0.645 -3.830 -7.345
4 HG12 ILE 67 HG12 ILE 67 -1.170 -0.991 -8.254
5 HG13 ILE 67 HG13 ILE 67 -2.057 -1.846 -7.000
6 HG21 ILE 67 HG21 ILE 67 0.915 -3.930 -9.243
7 HG22 ILE 67 HG22 ILE 67 0.622 -2.220 -9.567
8 HG23 ILE 67 HG23 ILE 67 1.408 -2.709 -8.066
9 HD11 ILE 67 HD11 ILE 67 -0.013 -1.970 -5.663
10 HD12 ILE 67 HD12 ILE 67 0.846 -1.077 -6.919
11 HD13 ILE 67 HD13 ILE 67 -0.473 -0.309 -6.034
No H/Q in entry = 11
In of MODEL 20
1 H LEU 68 H LEU 68 -1.642 -5.911 -8.246
2 HA LEU 68 HA LEU 68 -0.131 -7.136 -10.292
3 HB2 LEU 68 HB2 LEU 68 -1.506 -7.939 -7.913
4 HB3 LEU 68 HB3 LEU 68 -1.921 -9.052 -9.201
5 HG LEU 68 HG LEU 68 0.009 -9.806 -7.850
6 HD11 LEU 68 HD11 LEU 68 -0.272 -10.505 -10.192
7 HD12 LEU 68 HD12 LEU 68 0.718 -9.139 -10.702
8 HD13 LEU 68 HD13 LEU 68 1.423 -10.417 -9.714
9 HD21 LEU 68 HD21 LEU 68 0.944 -7.603 -7.332
10 HD22 LEU 68 HD22 LEU 68 2.150 -8.659 -8.066
11 HD23 LEU 68 HD23 LEU 68 1.387 -7.393 -9.026
No H/Q in entry = 11
In of MODEL 20
1 H LYS 69 H LYS 69 -3.501 -6.515 -9.876
2 HA LYS 69 HA LYS 69 -4.508 -7.936 -12.072
3 HB2 LYS 69 HB2 LYS 69 -5.799 -6.865 -10.159
4 HB3 LYS 69 HB3 LYS 69 -5.612 -5.339 -11.008
5 HG2 LYS 69 HG2 LYS 69 -6.849 -6.208 -12.900
6 HG3 LYS 69 HG3 LYS 69 -6.974 -7.779 -12.107
7 HD2 LYS 69 HD2 LYS 69 -8.263 -6.791 -10.297
8 HD3 LYS 69 HD3 LYS 69 -8.090 -5.194 -11.027
9 HE2 LYS 69 HE2 LYS 69 -9.485 -7.548 -12.289
10 HE3 LYS 69 HE3 LYS 69 -10.286 -6.201 -11.482
11 HZ1 LYS 69 HZ1 LYS 69 -9.213 -4.722 -13.137
12 HZ2 LYS 69 HZ2 LYS 69 -8.662 -6.095 -13.967
13 HZ3 LYS 69 HZ3 LYS 69 -10.320 -5.805 -13.806
No H/Q in entry = 13
In of MODEL 20
1 H HIS 70 H HIS 70 -2.467 -5.316 -11.924
2 HA HIS 70 HA HIS 70 -3.222 -4.274 -14.554
3 HB2 HIS 70 HB2 HIS 70 -3.078 -2.626 -12.700
4 HB3 HIS 70 HB3 HIS 70 -1.386 -3.059 -12.477
5 HD1 HIS 70 HD1 HIS 70 -3.673 -1.105 -14.642
6 HD2 HIS 70 HD2 HIS 70 0.366 -2.117 -14.486
7 HE1 HIS 70 HE1 HIS 70 -2.527 0.453 -16.242
8 HE2 HIS 70 HE2 HIS 70 -0.106 -0.242 -16.233
No H/Q in entry = 8
In of MODEL 20
1 H VAL 71 H VAL 71 -0.392 -5.032 -12.581
2 HA VAL 71 HA VAL 71 1.567 -4.793 -14.501
3 HB VAL 71 HB VAL 71 1.759 -6.827 -12.286
4 HG11 VAL 71 HG11 VAL 71 3.615 -6.557 -13.864
5 HG12 VAL 71 HG12 VAL 71 3.707 -4.853 -13.408
6 HG13 VAL 71 HG13 VAL 71 4.046 -6.105 -12.213
7 HG21 VAL 71 HG21 VAL 71 1.937 -3.834 -12.016
8 HG22 VAL 71 HG22 VAL 71 0.792 -4.908 -11.208
9 HG23 VAL 71 HG23 VAL 71 2.512 -4.987 -10.806
No H/Q in entry = 9
In of MODEL 20
1 H VAL 72 H VAL 72 0.177 -7.858 -13.283
2 HA VAL 72 HA VAL 72 1.336 -9.195 -15.555
3 HB VAL 72 HB VAL 72 1.263 -10.202 -13.235
4 HG11 VAL 72 HG11 VAL 72 -1.595 -10.767 -13.976
5 HG12 VAL 72 HG12 VAL 72 -0.717 -11.474 -12.618
6 HG13 VAL 72 HG13 VAL 72 -1.038 -9.742 -12.654
7 HG21 VAL 72 HG21 VAL 72 0.340 -11.641 -15.678
8 HG22 VAL 72 HG22 VAL 72 1.976 -11.484 -15.043
9 HG23 VAL 72 HG23 VAL 72 0.788 -12.468 -14.194
No H/Q in entry = 9
In of MODEL 20
1 H GLY 73 H GLY 73 -1.928 -8.413 -14.390
2 HA2 GLY 73 HA2 GLY 73 -2.927 -9.179 -17.058
3 HA3 GLY 73 HA3 GLY 73 -3.452 -7.717 -16.232
No H/Q in entry = 3
In of MODEL 20
1 H GLU 74 H GLU 74 -5.468 -9.073 -16.937
2 HA GLU 74 HA GLU 74 -6.828 -9.776 -14.584
3 HB2 GLU 74 HB2 GLU 74 -7.576 -10.524 -17.418
4 HB3 GLU 74 HB3 GLU 74 -8.659 -10.438 -16.038
5 HG2 GLU 74 HG2 GLU 74 -7.198 -8.107 -17.256
6 HG3 GLU 74 HG3 GLU 74 -8.890 -8.517 -17.532
No H/Q in entry = 6
In of MODEL 20
1 H GLU 75 H GLU 75 -5.584 -11.774 -17.217
2 HA GLU 75 HA GLU 75 -6.381 -14.324 -16.604
3 HB2 GLU 75 HB2 GLU 75 -5.057 -13.720 -18.554
4 HB3 GLU 75 HB3 GLU 75 -3.656 -13.454 -17.530
5 HG2 GLU 75 HG2 GLU 75 -3.651 -15.800 -16.895
6 HG3 GLU 75 HG3 GLU 75 -5.080 -16.076 -17.892
No H/Q in entry = 6
In of MODEL 20
1 H LYS 76 H LYS 76 -3.304 -12.952 -15.416
2 HA LYS 76 HA LYS 76 -2.856 -15.336 -13.907
3 HB2 LYS 76 HB2 LYS 76 -1.002 -14.184 -14.914
4 HB3 LYS 76 HB3 LYS 76 -1.359 -12.731 -13.998
5 HG2 LYS 76 HG2 LYS 76 0.551 -14.035 -13.126
6 HG3 LYS 76 HG3 LYS 76 -0.731 -13.778 -11.950
7 HD2 LYS 76 HD2 LYS 76 0.098 -16.070 -11.847
8 HD3 LYS 76 HD3 LYS 76 -1.570 -16.051 -12.422
9 HE2 LYS 76 HE2 LYS 76 -0.778 -16.241 -14.724
10 HE3 LYS 76 HE3 LYS 76 0.883 -16.251 -14.155
11 HZ1 LYS 76 HZ1 LYS 76 0.232 -18.282 -12.841
12 HZ2 LYS 76 HZ2 LYS 76 -1.194 -18.318 -13.758
13 HZ3 LYS 76 HZ3 LYS 76 0.311 -18.476 -14.517
No H/Q in entry = 13
In of MODEL 20
1 H ALA 77 H ALA 77 -3.772 -12.008 -13.077
2 HA ALA 77 HA ALA 77 -3.626 -12.275 -10.286
3 HB1 ALA 77 HB1 ALA 77 -5.138 -10.350 -10.201
4 HB2 ALA 77 HB2 ALA 77 -5.512 -10.559 -11.913
5 HB3 ALA 77 HB3 ALA 77 -3.881 -10.111 -11.414
No H/Q in entry = 5
In of MODEL 20
1 H ALA 78 H ALA 78 -6.014 -13.261 -12.625
2 HA ALA 78 HA ALA 78 -8.062 -13.973 -10.785
3 HB1 ALA 78 HB1 ALA 78 -7.475 -14.808 -13.625
4 HB2 ALA 78 HB2 ALA 78 -8.919 -15.308 -12.732
5 HB3 ALA 78 HB3 ALA 78 -8.635 -13.601 -13.073
No H/Q in entry = 5
In of MODEL 20
1 H GLU 79 H GLU 79 -5.417 -15.719 -12.364
2 HA GLU 79 HA GLU 79 -6.081 -18.266 -11.312
3 HB2 GLU 79 HB2 GLU 79 -3.341 -17.363 -12.190
4 HB3 GLU 79 HB3 GLU 79 -3.955 -19.009 -12.128
5 HG2 GLU 79 HG2 GLU 79 -5.692 -18.218 -13.826
6 HG3 GLU 79 HG3 GLU 79 -4.640 -16.822 -14.040
No H/Q in entry = 6
In of MODEL 20
1 H LEU 80 H LEU 80 -4.212 -15.585 -10.092
2 HA LEU 80 HA LEU 80 -2.986 -17.053 -7.971
3 HB2 LEU 80 HB2 LEU 80 -3.398 -14.089 -8.344
4 HB3 LEU 80 HB3 LEU 80 -2.358 -14.824 -7.134
5 HG LEU 80 HG LEU 80 -1.985 -15.206 -10.099
6 HD11 LEU 80 HD11 LEU 80 -0.708 -13.226 -8.235
7 HD12 LEU 80 HD12 LEU 80 -0.088 -13.628 -9.839
8 HD13 LEU 80 HD13 LEU 80 -1.686 -12.891 -9.667
9 HD21 LEU 80 HD21 LEU 80 -1.046 -16.960 -8.701
10 HD22 LEU 80 HD22 LEU 80 0.228 -15.993 -9.447
11 HD23 LEU 80 HD23 LEU 80 -0.184 -15.753 -7.748
No H/Q in entry = 11
In of MODEL 20
1 H LYS 81 H LYS 81 -5.897 -15.112 -8.322
2 HA LYS 81 HA LYS 81 -6.614 -15.083 -5.586
3 HB2 LYS 81 HB2 LYS 81 -7.564 -13.761 -7.661
4 HB3 LYS 81 HB3 LYS 81 -8.671 -15.119 -7.767
5 HG2 LYS 81 HG2 LYS 81 -8.315 -13.415 -5.311
6 HG3 LYS 81 HG3 LYS 81 -9.561 -13.157 -6.531
7 HD2 LYS 81 HD2 LYS 81 -10.459 -15.390 -6.070
8 HD3 LYS 81 HD3 LYS 81 -9.216 -15.638 -4.844
9 HE2 LYS 81 HE2 LYS 81 -10.093 -13.725 -3.586
10 HE3 LYS 81 HE3 LYS 81 -11.344 -13.502 -4.806
11 HZ1 LYS 81 HZ1 LYS 81 -12.172 -15.729 -4.276
12 HZ2 LYS 81 HZ2 LYS 81 -11.008 -15.874 -3.055
13 HZ3 LYS 81 HZ3 LYS 81 -12.218 -14.701 -2.933
No H/Q in entry = 13
In of MODEL 20
1 H ASN 82 H ASN 82 -7.514 -17.197 -8.300
2 HA ASN 82 HA ASN 82 -9.030 -19.007 -6.732
3 HB2 ASN 82 HB2 ASN 82 -9.188 -18.833 -9.222
4 HB3 ASN 82 HB3 ASN 82 -7.590 -19.553 -9.342
5 HD21 ASN 82 HD21 ASN 82 -10.936 -20.112 -8.644
6 HD22 ASN 82 HD22 ASN 82 -10.860 -21.838 -8.646
No H/Q in entry = 6
In of MODEL 20
1 H LEU 83 H LEU 83 -5.606 -18.739 -7.483
2 HA LEU 83 HA LEU 83 -4.807 -21.295 -6.644
3 HB2 LEU 83 HB2 LEU 83 -3.575 -18.798 -7.347
4 HB3 LEU 83 HB3 LEU 83 -2.811 -19.440 -5.915
5 HG LEU 83 HG LEU 83 -3.142 -21.002 -8.473
6 HD11 LEU 83 HD11 LEU 83 -0.773 -19.436 -7.465
7 HD12 LEU 83 HD12 LEU 83 -0.747 -20.554 -8.829
8 HD13 LEU 83 HD13 LEU 83 -1.729 -19.092 -8.908
9 HD21 LEU 83 HD21 LEU 83 -2.883 -22.354 -6.439
10 HD22 LEU 83 HD22 LEU 83 -1.485 -22.488 -7.504
11 HD23 LEU 83 HD23 LEU 83 -1.400 -21.480 -6.059
No H/Q in entry = 11
In of MODEL 20
1 H LYS 84 H LYS 84 -5.274 -18.256 -4.920
2 HA LYS 84 HA LYS 84 -4.350 -19.138 -2.400
3 HB2 LYS 84 HB2 LYS 84 -4.667 -16.753 -3.048
4 HB3 LYS 84 HB3 LYS 84 -6.404 -17.001 -2.998
5 HG2 LYS 84 HG2 LYS 84 -6.315 -17.456 -0.632
6 HG3 LYS 84 HG3 LYS 84 -4.553 -17.351 -0.650
7 HD2 LYS 84 HD2 LYS 84 -4.691 -15.005 -1.305
8 HD3 LYS 84 HD3 LYS 84 -6.453 -15.105 -1.333
9 HE2 LYS 84 HE2 LYS 84 -4.726 -15.571 1.094
10 HE3 LYS 84 HE3 LYS 84 -5.575 -14.069 0.731
11 HZ1 LYS 84 HZ1 LYS 84 -6.883 -16.704 1.131
12 HZ2 LYS 84 HZ2 LYS 84 -6.787 -15.480 2.295
13 HZ3 LYS 84 HZ3 LYS 84 -7.662 -15.226 0.875
No H/Q in entry = 13
In of MODEL 20
1 H ASP 85 H ASP 85 -7.613 -18.935 -3.800
2 HA ASP 85 HA ASP 85 -8.989 -20.011 -1.589
3 HB2 ASP 85 HB2 ASP 85 -10.075 -18.732 -3.401
4 HB3 ASP 85 HB3 ASP 85 -9.771 -20.071 -4.506
No H/Q in entry = 4
In of MODEL 20
1 H SER 86 H SER 86 -7.347 -21.582 -4.276
2 HA SER 86 HA SER 86 -8.608 -24.112 -3.714
3 HB2 SER 86 HB2 SER 86 -6.922 -24.989 -5.407
4 HB3 SER 86 HB3 SER 86 -8.064 -23.784 -5.999
5 HG SER 86 HG SER 86 -6.489 -22.269 -6.005
No H/Q in entry = 5
In of MODEL 20
1 H GLY 87 H GLY 87 -6.082 -22.381 -2.391
2 HA2 GLY 87 HA2 GLY 87 -5.207 -24.823 -0.977
3 HA3 GLY 87 HA3 GLY 87 -5.389 -23.257 -0.203
No H/Q in entry = 3
In of MODEL 20
1 H ALA 88 H ALA 88 -4.120 -21.709 -2.281
2 HA ALA 88 HA ALA 88 -1.435 -22.713 -2.357
3 HB1 ALA 88 HB1 ALA 88 -2.491 -19.977 -3.057
4 HB2 ALA 88 HB2 ALA 88 -2.211 -21.309 -4.176
5 HB3 ALA 88 HB3 ALA 88 -0.852 -20.547 -3.356
No H/Q in entry = 5
In of MODEL 20
1 H SER 89 H SER 89 -0.076 -22.476 -0.772
2 HA SER 89 HA SER 89 -0.581 -20.979 1.592
3 HB2 SER 89 HB2 SER 89 1.773 -21.750 2.139
4 HB3 SER 89 HB3 SER 89 0.623 -23.038 1.798
5 HG SER 89 HG SER 89 1.703 -23.547 0.060
No H/Q in entry = 5
In of MODEL 20
1 H LYS 90 H LYS 90 1.549 -19.669 2.383
2 HA LYS 90 HA LYS 90 1.595 -17.287 0.933
3 HB2 LYS 90 HB2 LYS 90 3.650 -18.380 2.859
4 HB3 LYS 90 HB3 LYS 90 3.620 -16.725 2.273
5 HG2 LYS 90 HG2 LYS 90 1.350 -16.493 3.290
6 HG3 LYS 90 HG3 LYS 90 1.583 -18.084 4.018
7 HD2 LYS 90 HD2 LYS 90 3.320 -15.652 4.445
8 HD3 LYS 90 HD3 LYS 90 2.167 -16.321 5.596
9 HE2 LYS 90 HE2 LYS 90 3.465 -18.329 5.816
10 HE3 LYS 90 HE3 LYS 90 4.544 -17.827 4.518
11 HZ1 LYS 90 HZ1 LYS 90 5.272 -15.975 5.886
12 HZ2 LYS 90 HZ2 LYS 90 4.245 -16.463 7.136
13 HZ3 LYS 90 HZ3 LYS 90 5.542 -17.447 6.675
No H/Q in entry = 13
In of MODEL 20
1 H GLU 91 H GLU 91 3.455 -20.202 0.579
2 HA GLU 91 HA GLU 91 5.634 -18.911 -0.742
3 HB2 GLU 91 HB2 GLU 91 5.042 -21.836 -0.382
4 HB3 GLU 91 HB3 GLU 91 6.558 -21.168 -0.975
5 HG2 GLU 91 HG2 GLU 91 5.365 -20.686 1.741
6 HG3 GLU 91 HG3 GLU 91 6.693 -21.767 1.358
No H/Q in entry = 6
In of MODEL 20
1 H GLU 92 H GLU 92 3.056 -21.118 -1.759
2 HA GLU 92 HA GLU 92 3.674 -21.358 -4.452
3 HB2 GLU 92 HB2 GLU 92 0.929 -21.306 -3.200
4 HB3 GLU 92 HB3 GLU 92 1.396 -22.087 -4.696
5 HG2 GLU 92 HG2 GLU 92 2.454 -22.845 -2.005
6 HG3 GLU 92 HG3 GLU 92 1.083 -23.611 -2.789
No H/Q in entry = 6
In of MODEL 20
1 H LEU 93 H LEU 93 1.662 -19.017 -2.687
2 HA LEU 93 HA LEU 93 1.203 -17.437 -5.022
3 HB2 LEU 93 HB2 LEU 93 1.061 -16.705 -2.095
4 HB3 LEU 93 HB3 LEU 93 0.607 -15.617 -3.400
5 HG LEU 93 HG LEU 93 -0.711 -18.223 -2.643
6 HD11 LEU 93 HD11 LEU 93 -1.708 -15.392 -2.786
7 HD12 LEU 93 HD12 LEU 93 -2.716 -16.811 -2.487
8 HD13 LEU 93 HD13 LEU 93 -1.457 -16.363 -1.332
9 HD21 LEU 93 HD21 LEU 93 -1.115 -16.543 -5.109
10 HD22 LEU 93 HD22 LEU 93 -0.606 -18.230 -5.030
11 HD23 LEU 93 HD23 LEU 93 -2.243 -17.780 -4.553
No H/Q in entry = 11
In of MODEL 20
1 H LYS 94 H LYS 94 3.769 -17.412 -2.508
2 HA LYS 94 HA LYS 94 4.780 -14.926 -3.335
3 HB2 LYS 94 HB2 LYS 94 5.348 -16.007 -1.179
4 HB3 LYS 94 HB3 LYS 94 6.263 -17.231 -2.037
5 HG2 LYS 94 HG2 LYS 94 6.992 -14.356 -2.364
6 HG3 LYS 94 HG3 LYS 94 7.482 -15.230 -0.912
7 HD2 LYS 94 HD2 LYS 94 8.595 -16.909 -2.301
8 HD3 LYS 94 HD3 LYS 94 8.101 -16.039 -3.754
9 HE2 LYS 94 HE2 LYS 94 9.382 -14.088 -2.996
10 HE3 LYS 94 HE3 LYS 94 9.900 -14.991 -1.573
11 HZ1 LYS 94 HZ1 LYS 94 10.954 -16.600 -3.076
12 HZ2 LYS 94 HZ2 LYS 94 10.528 -15.640 -4.408
13 HZ3 LYS 94 HZ3 LYS 94 11.602 -15.049 -3.237
No H/Q in entry = 13
In of MODEL 20
1 H ALA 95 H ALA 95 5.506 -18.192 -4.315
2 HA ALA 95 HA ALA 95 7.673 -17.327 -5.977
3 HB1 ALA 95 HB1 ALA 95 7.863 -19.431 -4.791
4 HB2 ALA 95 HB2 ALA 95 7.893 -19.723 -6.532
5 HB3 ALA 95 HB3 ALA 95 6.424 -20.049 -5.605
No H/Q in entry = 5
In of MODEL 20
1 H LYS 96 H LYS 96 4.456 -18.795 -6.510
2 HA LYS 96 HA LYS 96 4.646 -18.875 -9.322
3 HB2 LYS 96 HB2 LYS 96 2.459 -19.042 -7.359
4 HB3 LYS 96 HB3 LYS 96 1.998 -18.504 -8.959
5 HG2 LYS 96 HG2 LYS 96 1.815 -20.968 -8.561
6 HG3 LYS 96 HG3 LYS 96 2.766 -20.497 -9.968
7 HD2 LYS 96 HD2 LYS 96 4.820 -20.752 -8.584
8 HD3 LYS 96 HD3 LYS 96 3.812 -21.374 -7.283
9 HE2 LYS 96 HE2 LYS 96 4.828 -23.194 -8.551
10 HE3 LYS 96 HE3 LYS 96 3.075 -23.205 -8.734
11 HZ1 LYS 96 HZ1 LYS 96 4.919 -21.960 -10.700
12 HZ2 LYS 96 HZ2 LYS 96 4.339 -23.548 -10.831
13 HZ3 LYS 96 HZ3 LYS 96 3.261 -22.249 -10.884
No H/Q in entry = 13
In of MODEL 20
1 H VAL 97 H VAL 97 3.905 -16.278 -7.157
2 HA VAL 97 HA VAL 97 2.842 -14.441 -9.052
3 HB VAL 97 HB VAL 97 4.091 -14.076 -6.331
4 HG11 VAL 97 HG11 VAL 97 4.586 -12.092 -7.657
5 HG12 VAL 97 HG12 VAL 97 2.880 -11.942 -8.075
6 HG13 VAL 97 HG13 VAL 97 3.397 -11.746 -6.402
7 HG21 VAL 97 HG21 VAL 97 1.872 -15.105 -6.462
8 HG22 VAL 97 HG22 VAL 97 1.849 -13.541 -5.644
9 HG23 VAL 97 HG23 VAL 97 1.271 -13.674 -7.312
No H/Q in entry = 9
In of MODEL 20
1 H GLU 98 H GLU 98 6.103 -15.033 -7.735
2 HA GLU 98 HA GLU 98 7.390 -12.950 -9.100
3 HB2 GLU 98 HB2 GLU 98 8.471 -15.620 -8.203
4 HB3 GLU 98 HB3 GLU 98 9.469 -14.332 -8.869
5 HG2 GLU 98 HG2 GLU 98 8.568 -12.864 -7.018
6 HG3 GLU 98 HG3 GLU 98 7.914 -14.336 -6.302
No H/Q in entry = 6
In of MODEL 20
1 H GLU 99 H GLU 99 6.423 -16.148 -10.137
2 HA GLU 99 HA GLU 99 7.867 -16.171 -12.573
3 HB2 GLU 99 HB2 GLU 99 5.248 -17.523 -11.903
4 HB3 GLU 99 HB3 GLU 99 6.265 -17.899 -13.288
5 HG2 GLU 99 HG2 GLU 99 8.090 -18.484 -11.684
6 HG3 GLU 99 HG3 GLU 99 6.918 -18.300 -10.381
No H/Q in entry = 6
In of MODEL 20
1 H ALA 100 H ALA 100 4.734 -14.880 -11.641
2 HA ALA 100 HA ALA 100 4.003 -14.022 -14.268
3 HB1 ALA 100 HB1 ALA 100 2.341 -14.405 -12.539
4 HB2 ALA 100 HB2 ALA 100 2.280 -12.730 -13.086
5 HB3 ALA 100 HB3 ALA 100 3.047 -13.128 -11.551
No H/Q in entry = 5
In of MODEL 20
1 H LEU 101 H LEU 101 5.354 -12.421 -11.416
2 HA LEU 101 HA LEU 101 5.589 -9.848 -12.519
3 HB2 LEU 101 HB2 LEU 101 6.832 -11.263 -10.200
4 HB3 LEU 101 HB3 LEU 101 7.400 -9.670 -10.649
5 HG LEU 101 HG LEU 101 5.641 -9.844 -8.793
6 HD11 LEU 101 HD11 LEU 101 6.294 -7.744 -9.825
7 HD12 LEU 101 HD12 LEU 101 5.152 -8.023 -11.141
8 HD13 LEU 101 HD13 LEU 101 4.558 -7.768 -9.498
9 HD21 LEU 101 HD21 LEU 101 4.115 -11.380 -9.920
10 HD22 LEU 101 HD22 LEU 101 3.321 -9.859 -9.511
11 HD23 LEU 101 HD23 LEU 101 3.824 -10.173 -11.171
No H/Q in entry = 11
In of MODEL 20
1 H HIS 102 H HIS 102 7.532 -12.666 -12.971
2 HA HIS 102 HA HIS 102 9.696 -11.092 -14.090
3 HB2 HIS 102 HB2 HIS 102 9.251 -14.077 -13.926
4 HB3 HIS 102 HB3 HIS 102 10.638 -13.353 -14.732
5 HD1 HIS 102 HD1 HIS 102 11.102 -15.225 -12.376
6 HD2 HIS 102 HD2 HIS 102 10.678 -11.110 -11.986
7 HE1 HIS 102 HE1 HIS 102 12.201 -14.633 -10.195
8 HE2 HIS 102 HE2 HIS 102 12.076 -12.124 -10.059
No H/Q in entry = 8
In of MODEL 20
1 H ALA 103 H ALA 103 7.127 -13.284 -15.191
2 HA ALA 103 HA ALA 103 7.879 -13.290 -17.897
3 HB1 ALA 103 HB1 ALA 103 5.146 -13.846 -16.760
4 HB2 ALA 103 HB2 ALA 103 6.476 -15.005 -16.793
5 HB3 ALA 103 HB3 ALA 103 5.788 -14.405 -18.305
No H/Q in entry = 5
In of MODEL 20
1 H VAL 104 H VAL 104 6.583 -10.745 -16.163
2 HA VAL 104 HA VAL 104 5.023 -9.646 -18.302
3 HB VAL 104 HB VAL 104 4.273 -9.240 -16.062
4 HG11 VAL 104 HG11 VAL 104 6.455 -9.469 -14.994
5 HG12 VAL 104 HG12 VAL 104 6.897 -7.874 -15.600
6 HG13 VAL 104 HG13 VAL 104 5.572 -8.047 -14.446
7 HG21 VAL 104 HG21 VAL 104 5.434 -6.756 -17.292
8 HG22 VAL 104 HG22 VAL 104 3.843 -7.446 -17.611
9 HG23 VAL 104 HG23 VAL 104 4.212 -6.775 -16.022
No H/Q in entry = 9
In of MODEL 20
1 H THR 105 H THR 105 5.622 -7.919 -19.580
2 HA THR 105 HA THR 105 8.369 -6.947 -19.310
3 HB THR 105 HB THR 105 8.683 -7.297 -21.812
4 HG1 THR 105 HG1 THR 105 6.847 -7.958 -22.683
5 HG21 THR 105 HG21 THR 105 8.520 -9.728 -20.030
6 HG22 THR 105 HG22 THR 105 9.409 -9.633 -21.551
7 HG23 THR 105 HG23 THR 105 9.896 -8.635 -20.181
No H/Q in entry = 7
In of MODEL 20
1 H ASP 106 H ASP 106 5.240 -6.061 -19.648
2 HA ASP 106 HA ASP 106 5.682 -3.852 -21.431
3 HB2 ASP 106 HB2 ASP 106 3.436 -4.942 -20.970
4 HB3 ASP 106 HB3 ASP 106 3.478 -4.183 -19.386
No H/Q in entry = 4
In of MODEL 20
1 H GLU 107 H GLU 107 6.649 -2.033 -20.927
2 HA GLU 107 HA GLU 107 8.356 -1.912 -18.794
3 HB2 GLU 107 HB2 GLU 107 8.692 -0.684 -20.848
4 HB3 GLU 107 HB3 GLU 107 7.312 0.345 -20.499
5 HG2 GLU 107 HG2 GLU 107 8.495 1.202 -18.516
6 HG3 GLU 107 HG3 GLU 107 9.894 0.225 -18.964
No H/Q in entry = 6
In of MODEL 20
1 H GLU 108 H GLU 108 5.376 -0.057 -19.148
2 HA GLU 108 HA GLU 108 5.426 1.440 -16.822
3 HB2 GLU 108 HB2 GLU 108 3.748 1.782 -18.533
4 HB3 GLU 108 HB3 GLU 108 3.085 0.178 -18.258
5 HG2 GLU 108 HG2 GLU 108 2.618 0.991 -15.878
6 HG3 GLU 108 HG3 GLU 108 2.901 2.607 -16.525
No H/Q in entry = 6
In of MODEL 20
1 H LYS 109 H LYS 109 4.238 -1.832 -17.338
2 HA LYS 109 HA LYS 109 3.143 -2.272 -14.796
3 HB2 LYS 109 HB2 LYS 109 4.105 -4.087 -16.978
4 HB3 LYS 109 HB3 LYS 109 3.480 -4.725 -15.467
5 HG2 LYS 109 HG2 LYS 109 1.778 -4.683 -17.202
6 HG3 LYS 109 HG3 LYS 109 1.344 -3.641 -15.863
7 HD2 LYS 109 HD2 LYS 109 1.922 -1.699 -17.075
8 HD3 LYS 109 HD3 LYS 109 2.654 -2.639 -18.374
9 HE2 LYS 109 HE2 LYS 109 0.473 -3.536 -18.970
10 HE3 LYS 109 HE3 LYS 109 -0.269 -2.662 -17.630
11 HZ1 LYS 109 HZ1 LYS 109 0.404 -0.576 -18.676
12 HZ2 LYS 109 HZ2 LYS 109 1.080 -1.435 -19.977
13 HZ3 LYS 109 HZ3 LYS 109 -0.591 -1.487 -19.703
No H/Q in entry = 13
In of MODEL 20
1 H LYS 110 H LYS 110 6.363 -2.889 -16.119
2 HA LYS 110 HA LYS 110 7.305 -4.238 -13.784
3 HB2 LYS 110 HB2 LYS 110 8.848 -2.971 -16.041
4 HB3 LYS 110 HB3 LYS 110 9.532 -4.036 -14.825
5 HG2 LYS 110 HG2 LYS 110 7.998 -5.826 -15.636
6 HG3 LYS 110 HG3 LYS 110 7.510 -4.742 -16.941
7 HD2 LYS 110 HD2 LYS 110 10.324 -5.697 -16.398
8 HD3 LYS 110 HD3 LYS 110 9.261 -6.306 -17.666
9 HE2 LYS 110 HE2 LYS 110 9.268 -4.197 -18.786
10 HE3 LYS 110 HE3 LYS 110 10.100 -3.422 -17.441
11 HZ1 LYS 110 HZ1 LYS 110 12.022 -4.841 -17.894
12 HZ2 LYS 110 HZ2 LYS 110 11.228 -5.500 -19.233
13 HZ3 LYS 110 HZ3 LYS 110 11.635 -3.858 -19.214
No H/Q in entry = 13
In of MODEL 20
1 H GLN 111 H GLN 111 7.000 -0.959 -14.689
2 HA GLN 111 HA GLN 111 8.760 0.111 -12.744
3 HB2 GLN 111 HB2 GLN 111 6.344 1.251 -14.122
4 HB3 GLN 111 HB3 GLN 111 7.206 2.150 -12.880
5 HG2 GLN 111 HG2 GLN 111 8.209 1.234 -15.552
6 HG3 GLN 111 HG3 GLN 111 8.103 2.878 -14.917
7 HE21 GLN 111 HE21 GLN 111 9.598 3.543 -13.332
8 HE22 GLN 111 HE22 GLN 111 11.102 2.717 -13.108
No H/Q in entry = 8
In of MODEL 20
1 H TYR 112 H TYR 112 5.437 -0.985 -12.597
2 HA TYR 112 HA TYR 112 4.977 -0.171 -9.879
3 HB2 TYR 112 HB2 TYR 112 3.621 -2.230 -11.643
4 HB3 TYR 112 HB3 TYR 112 3.065 -1.811 -10.028
5 HD1 TYR 112 HD1 TYR 112 2.907 0.907 -9.733
6 HD2 TYR 112 HD2 TYR 112 2.465 -1.242 -13.374
7 HE1 TYR 112 HE1 TYR 112 1.593 2.763 -10.659
8 HE2 TYR 112 HE2 TYR 112 1.147 0.610 -14.312
9 HH TYR 112 HH TYR 112 -0.234 2.483 -13.497
No H/Q in entry = 9
In of MODEL 20
1 H ILE 113 H ILE 113 6.338 -2.970 -11.486
2 HA ILE 113 HA ILE 113 6.525 -4.732 -9.328
3 HB ILE 113 HB ILE 113 8.499 -4.333 -11.572
4 HG12 ILE 113 HG12 ILE 113 6.157 -6.206 -11.233
5 HG13 ILE 113 HG13 ILE 113 6.260 -4.863 -12.365
6 HG21 ILE 113 HG21 ILE 113 9.518 -5.534 -9.716
7 HG22 ILE 113 HG22 ILE 113 8.160 -6.656 -9.676
8 HG23 ILE 113 HG23 ILE 113 9.233 -6.621 -11.074
9 HD11 ILE 113 HD11 ILE 113 8.198 -6.032 -13.418
10 HD12 ILE 113 HD12 ILE 113 7.827 -7.417 -12.391
11 HD13 ILE 113 HD13 ILE 113 6.650 -6.852 -13.572
No H/Q in entry = 11
In of MODEL 20
1 H ALA 114 H ALA 114 8.966 -2.410 -10.503
2 HA ALA 114 HA ALA 114 10.731 -2.734 -8.323
3 HB1 ALA 114 HB1 ALA 114 11.497 -1.825 -10.433
4 HB2 ALA 114 HB2 ALA 114 11.776 -0.646 -9.151
5 HB3 ALA 114 HB3 ALA 114 10.420 -0.437 -10.262
No H/Q in entry = 5
In of MODEL 20
1 H ASP 115 H ASP 115 8.103 -0.457 -8.965
2 HA ASP 115 HA ASP 115 8.672 1.244 -6.771
3 HB2 ASP 115 HB2 ASP 115 7.356 1.867 -8.817
4 HB3 ASP 115 HB3 ASP 115 6.032 0.888 -8.198
No H/Q in entry = 4
In of MODEL 20
1 H PHE 116 H PHE 116 6.074 -1.149 -7.249
2 HA PHE 116 HA PHE 116 5.401 -0.805 -4.421
3 HB2 PHE 116 HB2 PHE 116 3.819 -0.877 -6.740
4 HB3 PHE 116 HB3 PHE 116 3.512 -2.406 -5.927
5 HD1 PHE 116 HD1 PHE 116 2.763 -2.357 -3.525
6 HD2 PHE 116 HD2 PHE 116 2.849 1.084 -6.027
7 HE1 PHE 116 HE1 PHE 116 1.167 -1.244 -2.022
8 HE2 PHE 116 HE2 PHE 116 1.249 2.216 -4.517
9 HZ PHE 116 HZ PHE 116 0.407 1.036 -2.517
No H/Q in entry = 9
In of MODEL 20
1 H GLY 117 H GLY 117 6.666 -3.109 -6.633
2 HA2 GLY 117 HA2 GLY 117 7.403 -5.277 -6.325
3 HA3 GLY 117 HA3 GLY 117 5.762 -5.549 -5.775
No H/Q in entry = 3
In of MODEL 20
1 HA PRO 118 HA PRO 118 9.204 -6.330 -2.494
2 HB2 PRO 118 HB2 PRO 118 10.577 -4.114 -1.595
3 HB3 PRO 118 HB3 PRO 118 11.160 -5.222 -2.842
4 HG2 PRO 118 HG2 PRO 118 9.813 -2.569 -3.140
5 HG3 PRO 118 HG3 PRO 118 11.175 -3.244 -4.053
6 HD2 PRO 118 HD2 PRO 118 8.693 -3.200 -5.067
7 HD3 PRO 118 HD3 PRO 118 9.796 -4.557 -5.378
No H/Q in entry = 7
In of MODEL 20
1 H ALA 119 H ALA 119 7.385 -3.357 -2.352
2 HA ALA 119 HA ALA 119 7.122 -3.408 0.548
3 HB1 ALA 119 HB1 ALA 119 5.725 -1.421 0.202
4 HB2 ALA 119 HB2 ALA 119 5.862 -1.637 -1.543
5 HB3 ALA 119 HB3 ALA 119 7.295 -1.267 -0.583
No H/Q in entry = 5
In of MODEL 20
1 H CYS 120 H CYS 120 5.229 -4.138 -2.308
2 HA CYS 120 HA CYS 120 2.789 -4.835 -1.151
3 HB2 CYS 120 HB2 CYS 120 3.204 -4.711 -3.578
4 HB3 CYS 120 HB3 CYS 120 4.239 -6.128 -3.476
No H/Q in entry = 4
In of MODEL 20
1 H LYS 121 H LYS 121 5.850 -6.495 -1.294
2 HA LYS 121 HA LYS 121 5.211 -9.083 -0.549
3 HB2 LYS 121 HB2 LYS 121 7.476 -7.962 -1.132
4 HB3 LYS 121 HB3 LYS 121 7.583 -7.626 0.589
5 HG2 LYS 121 HG2 LYS 121 8.804 -9.598 0.199
6 HG3 LYS 121 HG3 LYS 121 7.300 -10.088 0.981
7 HD2 LYS 121 HD2 LYS 121 6.379 -10.837 -1.082
8 HD3 LYS 121 HD3 LYS 121 7.693 -10.101 -2.003
9 HE2 LYS 121 HE2 LYS 121 8.023 -12.358 -0.029
10 HE3 LYS 121 HE3 LYS 121 7.910 -12.559 -1.776
11 HZ1 LYS 121 HZ1 LYS 121 10.008 -10.993 -0.371
12 HZ2 LYS 121 HZ2 LYS 121 10.212 -12.550 -0.992
13 HZ3 LYS 121 HZ3 LYS 121 9.909 -11.255 -2.041
No H/Q in entry = 13
In of MODEL 20
1 H LYS 122 H LYS 122 6.145 -6.440 1.714
2 HA LYS 122 HA LYS 122 5.418 -7.926 4.025
3 HB2 LYS 122 HB2 LYS 122 5.665 -5.856 5.269
4 HB3 LYS 122 HB3 LYS 122 6.988 -6.039 4.131
5 HG2 LYS 122 HG2 LYS 122 5.795 -4.480 2.604
6 HG3 LYS 122 HG3 LYS 122 4.617 -4.215 3.886
7 HD2 LYS 122 HD2 LYS 122 7.581 -3.676 4.089
8 HD3 LYS 122 HD3 LYS 122 6.338 -2.457 3.822
9 HE2 LYS 122 HE2 LYS 122 6.643 -2.270 6.090
10 HE3 LYS 122 HE3 LYS 122 5.328 -3.441 6.033
11 HZ1 LYS 122 HZ1 LYS 122 7.032 -5.211 6.230
12 HZ2 LYS 122 HZ2 LYS 122 8.212 -4.018 6.447
13 HZ3 LYS 122 HZ3 LYS 122 6.967 -4.193 7.576
No H/Q in entry = 13
In of MODEL 20
1 H ILE 123 H ILE 123 3.621 -5.884 1.827
2 HA ILE 123 HA ILE 123 1.418 -5.384 3.505
3 HB ILE 123 HB ILE 123 1.621 -5.410 0.521
4 HG12 ILE 123 HG12 ILE 123 1.439 -3.214 2.593
5 HG13 ILE 123 HG13 ILE 123 2.901 -3.700 1.744
6 HG21 ILE 123 HG21 ILE 123 -0.705 -4.571 2.253
7 HG22 ILE 123 HG22 ILE 123 -0.562 -4.267 0.519
8 HG23 ILE 123 HG23 ILE 123 -0.679 -5.920 1.119
9 HD11 ILE 123 HD11 ILE 123 0.449 -2.569 0.449
10 HD12 ILE 123 HD12 ILE 123 1.902 -1.659 0.852
11 HD13 ILE 123 HD13 ILE 123 1.973 -2.956 -0.341
No H/Q in entry = 11
In of MODEL 20
1 H TYR 124 H TYR 124 1.925 -7.781 1.037
2 HA TYR 124 HA TYR 124 -0.325 -9.429 1.676
3 HB2 TYR 124 HB2 TYR 124 2.006 -9.614 -0.177
4 HB3 TYR 124 HB3 TYR 124 1.148 -11.094 0.237
5 HD1 TYR 124 HD1 TYR 124 0.543 -7.641 -1.043
6 HD2 TYR 124 HD2 TYR 124 -0.752 -11.691 -0.955
7 HE1 TYR 124 HE1 TYR 124 -1.154 -7.133 -2.745
8 HE2 TYR 124 HE2 TYR 124 -2.451 -11.193 -2.661
9 HH TYR 124 HH TYR 124 -2.448 -8.338 -4.471
No H/Q in entry = 9
In of MODEL 20
1 H GLY 125 H GLY 125 1.224 -8.892 3.951
2 HA2 GLY 125 HA2 GLY 125 2.505 -9.878 5.664
3 HA3 GLY 125 HA3 GLY 125 3.656 -9.332 4.482
No H/Q in entry = 3
In of MODEL 20
1 H VAL 126 H VAL 126 2.994 -11.568 2.668
2 HA VAL 126 HA VAL 126 3.610 -14.069 3.240
3 HB VAL 126 HB VAL 126 5.597 -12.593 1.530
4 HG11 VAL 126 HG11 VAL 126 5.855 -15.020 1.884
5 HG12 VAL 126 HG12 VAL 126 4.272 -15.266 1.147
6 HG13 VAL 126 HG13 VAL 126 5.591 -14.586 0.196
7 HG21 VAL 126 HG21 VAL 126 2.713 -13.143 0.871
8 HG22 VAL 126 HG22 VAL 126 3.572 -11.602 0.820
9 HG23 VAL 126 HG23 VAL 126 3.946 -12.859 -0.360
No H/Q in entry = 9
In of MODEL 20
1 H HIS 127 H HIS 127 6.173 -11.597 3.248
2 HA HIS 127 HA HIS 127 8.139 -11.409 4.350
3 HB2 HIS 127 HB2 HIS 127 6.623 -11.297 6.286
4 HB3 HIS 127 HB3 HIS 127 6.708 -13.047 6.456
5 HD1 HIS 127 HD1 HIS 127 8.328 -13.813 8.151
6 HD2 HIS 127 HD2 HIS 127 9.385 -10.115 6.569
7 HE1 HIS 127 HE1 HIS 127 10.354 -13.080 9.441
8 HE2 HIS 127 HE2 HIS 127 11.098 -10.955 8.314
No H/Q in entry = 8
In of MODEL 20
1 H THR 128 H THR 128 8.391 -13.081 2.425
2 HA THR 128 HA THR 128 10.099 -15.206 3.506
3 HB THR 128 HB THR 128 8.398 -15.459 1.012
4 HG1 THR 128 HG1 THR 128 7.396 -17.179 2.363
5 HG21 THR 128 HG21 THR 128 10.515 -16.670 0.876
6 HG22 THR 128 HG22 THR 128 10.178 -17.450 2.422
7 HG23 THR 128 HG23 THR 128 9.160 -17.792 1.021
No H/Q in entry = 7
In of MODEL 20
1 H SER 129 H SER 129 11.953 -14.034 3.231
2 HA SER 129 HA SER 129 12.522 -12.932 0.580
3 HB2 SER 129 HB2 SER 129 14.047 -12.519 3.161
4 HB3 SER 129 HB3 SER 129 14.223 -11.603 1.665
5 HG SER 129 HG SER 129 12.683 -10.368 2.343
No H/Q in entry = 5
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