Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
475824 | 2xk0 RC | 17050 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 7 HT2 GLY 7 7.920 -2.554 9.253
2 H2 GLY 7 HT1 GLY 7 8.034 -3.119 7.683
3 H3 GLY 7 HT3 GLY 7 8.548 -4.111 8.960
4 HA3 GLY 7 HA1 GLY 7 10.327 -2.589 9.445
5 HA2 GLY 7 HA2 GLY 7 10.386 -3.053 7.746
6 HA ALA 8 HA ALA 8 9.806 1.374 7.702
7 HB2 ALA 8 HB1 ALA 8 10.995 2.943 9.178
8 HB1 ALA 8 HB2 ALA 8 11.908 1.599 9.862
9 HB3 ALA 8 HB3 ALA 8 10.166 1.692 10.104
10 H ALA 8 HN ALA 8 11.494 -0.714 8.876
11 HA MET 9 HA MET 9 11.857 2.843 4.201
12 HB2 MET 9 HB2 MET 9 13.189 4.037 5.868
13 HG2 MET 9 HG2 MET 9 14.964 2.739 3.810
14 HE3 MET 9 HE1 MET 9 15.775 6.708 6.047
15 HE2 MET 9 HE2 MET 9 14.422 5.659 6.449
16 HE1 MET 9 HE3 MET 9 14.463 6.486 4.890
17 H MET 9 HN MET 9 10.559 2.068 5.837
18 HB3 MET 9 HB1 MET 9 14.172 2.608 6.135
19 HG3 MET 9 HG1 MET 9 14.009 4.202 3.584
20 HA ALA 10 HA ALA 10 13.762 -1.033 3.150
21 HB2 ALA 10 HB1 ALA 10 15.873 -0.615 4.308
22 HB1 ALA 10 HB2 ALA 10 15.598 -2.345 4.099
23 HB3 ALA 10 HB3 ALA 10 15.328 -1.593 5.670
24 H ALA 10 HN ALA 10 13.293 0.087 5.820
No H/Q in entry = 24
In of MODEL 1
1 HA PRO 11 HA PRO 11 10.781 -3.863 5.112
2 HB2 PRO 11 HB2 PRO 11 9.532 -3.975 2.465
3 HG2 PRO 11 HG2 PRO 11 9.343 -1.719 1.982
4 HD2 PRO 11 HD2 PRO 11 11.608 -2.056 1.793
5 HB3 PRO 11 HB1 PRO 11 8.840 -3.436 4.003
6 HG3 PRO 11 HG1 PRO 11 9.456 -1.257 3.690
7 HD3 PRO 11 HD1 PRO 11 11.582 -0.683 2.900
No H/Q in entry = 7
In of MODEL 1
1 HA PRO 12 HA PRO 12 13.022 -7.346 3.486
2 HB2 PRO 12 HB2 PRO 12 10.769 -9.121 4.120
3 HG2 PRO 12 HG2 PRO 12 10.183 -8.259 6.185
4 HD2 PRO 12 HD2 PRO 12 9.417 -6.577 4.782
5 HB3 PRO 12 HB1 PRO 12 12.382 -9.064 4.840
6 HG3 PRO 12 HG1 PRO 12 11.762 -7.486 6.404
7 HD3 PRO 12 HD1 PRO 12 10.482 -5.639 5.853
8 HA VAL 13 HA VAL 13 11.216 -8.703 -0.260
9 HB VAL 13 HB VAL 13 11.347 -6.955 -2.123
10 HG12 VAL 13 HG11 VAL 13 9.902 -6.137 0.389
11 HG11 VAL 13 HG12 VAL 13 9.323 -7.285 -0.818
12 HG13 VAL 13 HG13 VAL 13 9.553 -5.593 -1.254
13 HG23 VAL 13 HG21 VAL 13 12.248 -5.187 0.148
14 HG22 VAL 13 HG22 VAL 13 11.783 -4.632 -1.462
15 HG21 VAL 13 HG23 VAL 13 13.211 -5.644 -1.255
16 H VAL 13 HN VAL 13 13.120 -7.150 1.318
17 HA ALA 14 HA ALA 14 14.946 -9.489 -2.481
18 HB3 ALA 14 HB1 ALA 14 14.513 -10.583 -4.644
19 HB2 ALA 14 HB2 ALA 14 12.905 -9.856 -4.686
20 HB1 ALA 14 HB3 ALA 14 13.304 -11.047 -3.447
21 H ALA 14 HN ALA 14 12.176 -8.552 -2.705
22 HA ALA 15 HA ALA 15 15.763 -5.734 -4.717
23 HB1 ALA 15 HB1 ALA 15 13.037 -4.702 -3.860
24 HB3 ALA 15 HB2 ALA 15 13.401 -5.504 -5.387
25 HB2 ALA 15 HB3 ALA 15 14.086 -3.917 -5.040
26 H ALA 15 HN ALA 15 14.262 -6.749 -2.448
No H/Q in entry = 26
In of MODEL 1
1 HA PRO 16 HA PRO 16 17.562 -3.131 -1.503
2 HB2 PRO 16 HB2 PRO 16 17.063 -0.690 -3.107
3 HG2 PRO 16 HG2 PRO 16 17.960 -1.498 -5.098
4 HD2 PRO 16 HD2 PRO 16 15.875 -2.532 -4.993
5 HB3 PRO 16 HB1 PRO 16 18.598 -1.345 -2.524
6 HG3 PRO 16 HG1 PRO 16 18.769 -2.846 -4.278
7 HD3 PRO 16 HD1 PRO 16 16.927 -3.953 -5.165
8 HA SER 17 HA SER 17 14.694 -0.856 0.850
9 HB2 SER 17 HB2 SER 17 16.631 1.455 0.714
10 HG SER 17 HG SER 17 17.503 0.475 2.578
11 H SER 17 HN SER 17 17.149 -0.653 -0.536
12 HB3 SER 17 HB1 SER 17 15.433 1.161 1.976
No H/Q in entry = 12
In of MODEL 1
1 HA PRO 18 HA PRO 18 12.376 1.198 -2.451
2 HB2 PRO 18 HB2 PRO 18 10.161 0.704 -0.545
3 HG2 PRO 18 HG2 PRO 18 10.522 -1.572 -0.403
4 HD2 PRO 18 HD2 PRO 18 12.124 -0.478 0.943
5 HB3 PRO 18 HB1 PRO 18 10.278 0.277 -2.265
6 HG3 PRO 18 HG1 PRO 18 11.609 -1.578 -1.809
7 HD3 PRO 18 HD1 PRO 18 13.131 -1.590 -0.041
8 HA ALA 19 HA ALA 19 10.834 4.782 -0.374
9 HB1 ALA 19 HB1 ALA 19 13.231 5.311 -0.477
10 HB3 ALA 19 HB2 ALA 19 12.244 6.718 -0.884
11 HB2 ALA 19 HB3 ALA 19 13.045 5.803 -2.164
12 H ALA 19 HN ALA 19 11.831 3.326 -2.672
13 HA VAL 20 HA VAL 20 8.494 6.189 -3.706
14 HB VAL 20 HB VAL 20 6.517 4.653 -4.233
15 HG13 VAL 20 HG11 VAL 20 7.959 3.073 -5.465
16 HG12 VAL 20 HG12 VAL 20 9.335 3.585 -4.489
17 HG11 VAL 20 HG13 VAL 20 8.557 4.726 -5.586
18 HG21 VAL 20 HG21 VAL 20 6.512 3.434 -2.099
19 HG23 VAL 20 HG22 VAL 20 8.093 2.760 -2.486
20 HG22 VAL 20 HG23 VAL 20 6.690 2.343 -3.471
21 H VAL 20 HN VAL 20 8.869 4.561 -1.340
22 HA THR 21 HA THR 21 5.053 7.384 -1.334
23 HB THR 21 HB THR 21 6.624 9.336 -1.508
24 HG1 THR 21 HG1 THR 21 5.178 10.350 -0.456
25 HG23 THR 21 HG21 THR 21 6.618 9.555 -3.919
26 HG22 THR 21 HG22 THR 21 6.130 11.089 -3.176
27 HG21 THR 21 HG23 THR 21 4.918 10.002 -3.884
28 H THR 21 HN THR 21 6.473 7.276 -3.856
29 HA TYR 22 HA TYR 22 1.706 7.830 -4.153
30 HB2 TYR 22 HB2 TYR 22 0.898 6.421 -1.600
31 HD1 TYR 22 HD1 TYR 22 3.190 5.375 -1.504
32 HD2 TYR 22 HD2 TYR 22 0.553 4.795 -4.788
33 HE1 TYR 22 HE1 TYR 22 4.468 3.424 -2.174
34 HE2 TYR 22 HE2 TYR 22 1.808 2.830 -5.457
35 HH TYR 22 HH TYR 22 4.137 1.324 -3.533
36 H TYR 22 HN TYR 22 2.903 8.285 -1.532
37 HB3 TYR 22 HB1 TYR 22 0.009 6.385 -3.113
38 HA ALA 23 HA ALA 23 -0.841 10.836 -2.277
39 HB2 ALA 23 HB1 ALA 23 -2.284 11.828 -3.990
40 HB3 ALA 23 HB2 ALA 23 -2.002 10.430 -5.033
41 HB1 ALA 23 HB3 ALA 23 -0.670 11.515 -4.630
42 H ALA 23 HN ALA 23 -0.452 8.682 -4.214
43 HA LEU 24 HA LEU 24 -4.261 8.643 -0.729
44 HB2 LEU 24 HB2 LEU 24 -5.315 11.435 -0.237
45 HG LEU 24 HG LEU 24 -3.203 11.391 0.853
46 HD13 LEU 24 HD11 LEU 24 -3.858 11.656 3.179
47 HD12 LEU 24 HD12 LEU 24 -5.410 10.899 2.819
48 HD11 LEU 24 HD13 LEU 24 -4.985 12.436 2.070
49 HD23 LEU 24 HD21 LEU 24 -2.606 9.688 2.520
50 HD22 LEU 24 HD22 LEU 24 -2.761 9.025 0.892
51 HD21 LEU 24 HD23 LEU 24 -4.050 8.781 2.073
52 H LEU 24 HN LEU 24 -2.885 11.058 -1.272
53 HB3 LEU 24 HB1 LEU 24 -5.819 9.970 0.553
54 HA GLN 25 HA GLN 25 -8.417 8.065 -2.351
55 HB2 GLN 25 HB2 GLN 25 -7.637 10.714 -3.601
56 HG2 GLN 25 HG2 GLN 25 -9.405 10.204 -1.203
57 HE21 GLN 25 HE21 GLN 25 -8.635 12.790 -0.258
58 HE22 GLN 25 HE22 GLN 25 -9.501 13.948 -1.202
59 H GLN 25 HN GLN 25 -6.539 8.258 -1.120
60 HB3 GLN 25 HB1 GLN 25 -9.228 9.967 -3.660
61 HG3 GLN 25 HG1 GLN 25 -7.813 10.922 -1.195
62 HA GLU 26 HA GLU 26 -6.220 6.964 -6.172
63 HB2 GLU 26 HB2 GLU 26 -4.168 8.236 -5.500
64 HG2 GLU 26 HG2 GLU 26 -2.450 7.005 -6.697
65 H GLU 26 HN GLU 26 -5.698 7.298 -3.297
66 HB3 GLU 26 HB1 GLU 26 -3.631 6.830 -4.609
67 HG3 GLU 26 HG1 GLU 26 -3.476 5.576 -6.691
68 HA ASP 27 HA ASP 27 -6.381 2.751 -4.892
69 HB2 ASP 27 HB2 ASP 27 -7.063 2.658 -7.849
70 H ASP 27 HN ASP 27 -6.360 4.858 -6.892
71 HB3 ASP 27 HB1 ASP 27 -7.069 1.252 -6.802
72 HA VAL 28 HA VAL 28 -2.830 0.816 -6.655
73 HB VAL 28 HB VAL 28 -1.151 0.738 -4.653
74 HG11 VAL 28 HG11 VAL 28 -1.153 2.494 -6.390
75 HG13 VAL 28 HG12 VAL 28 -0.681 3.076 -4.783
76 HG12 VAL 28 HG13 VAL 28 -2.302 3.416 -5.402
77 HG22 VAL 28 HG21 VAL 28 -1.730 2.168 -2.788
78 HG21 VAL 28 HG22 VAL 28 -2.859 0.813 -2.914
79 HG23 VAL 28 HG23 VAL 28 -3.341 2.418 -3.461
80 H VAL 28 HN VAL 28 -4.958 1.212 -4.694
81 HA PHE 29 HA PHE 29 -3.581 -3.121 -5.129
82 HB2 PHE 29 HB2 PHE 29 -1.238 -3.494 -6.975
83 HD1 PHE 29 HD1 PHE 29 -2.227 -2.769 -8.963
84 HD2 PHE 29 HD2 PHE 29 -4.310 -5.445 -6.403
85 HE1 PHE 29 HE1 PHE 29 -3.913 -3.105 -10.698
86 HE2 PHE 29 HE2 PHE 29 -6.016 -5.774 -8.144
87 HZ PHE 29 HZ PHE 29 -5.811 -4.601 -10.299
88 H PHE 29 HN PHE 29 -1.801 -1.254 -6.410
89 HB3 PHE 29 HB1 PHE 29 -1.880 -4.865 -6.095
90 HA ILE 30 HA ILE 30 -0.466 -3.855 -2.020
91 HB ILE 30 HB ILE 30 -3.216 -3.926 -0.859
92 HG12 ILE 30 HG12 ILE 30 -2.434 -1.988 0.464
93 HG22 ILE 30 HG21 ILE 30 -2.228 -4.056 1.452
94 HG21 ILE 30 HG22 ILE 30 -0.720 -4.573 0.690
95 HG23 ILE 30 HG23 ILE 30 -2.192 -5.531 0.495
96 HD13 ILE 30 HD11 ILE 30 -1.934 -1.631 -2.441
97 HD12 ILE 30 HD12 ILE 30 -2.336 -0.365 -1.268
98 HD11 ILE 30 HD13 ILE 30 -3.534 -1.607 -1.700
99 H ILE 30 HN ILE 30 -3.062 -4.341 -3.322
100 HG13 ILE 30 HG11 ILE 30 -0.891 -2.079 -0.366
101 HA LYS 31 HA LYS 31 -0.500 -8.173 -1.940
102 HB2 LYS 31 HB2 LYS 31 1.592 -7.900 -2.927
103 HG2 LYS 31 HG2 LYS 31 2.082 -9.324 -0.327
104 HD2 LYS 31 HD2 LYS 31 3.573 -9.569 -2.916
105 HE2 LYS 31 HE2 LYS 31 4.083 -10.748 -0.188
106 HZ2 LYS 31 HZ1 LYS 31 5.858 -11.949 -1.298
107 HZ1 LYS 31 HZ2 LYS 31 6.123 -10.300 -1.455
108 HZ3 LYS 31 HZ3 LYS 31 5.541 -11.161 -2.737
109 H LYS 31 HN LYS 31 0.623 -5.535 -1.637
110 HB3 LYS 31 HB1 LYS 31 2.284 -7.129 -1.523
111 HG3 LYS 31 HG1 LYS 31 1.496 -10.035 -1.825
112 HD3 LYS 31 HD1 LYS 31 4.167 -8.685 -1.501
113 HE3 LYS 31 HE1 LYS 31 3.464 -11.621 -1.588
114 HA CYS 32 HA CYS 32 -0.520 -8.647 2.415
115 HB2 CYS 32 HB2 CYS 32 -2.885 -9.377 1.691
116 HG CYS 32 HG CYS 32 -3.340 -9.611 4.178
117 H CYS 32 HN CYS 32 -1.163 -9.391 -0.337
118 HB3 CYS 32 HB1 CYS 32 -2.186 -10.979 1.447
119 HA ASN 33 HA ASN 33 2.722 -11.464 2.745
120 HB2 ASN 33 HB2 ASN 33 2.241 -11.176 5.172
121 HD21 ASN 33 HD21 ASN 33 2.517 -13.667 6.629
122 HD22 ASN 33 HD22 ASN 33 4.089 -14.279 6.292
123 H ASN 33 HN ASN 33 0.269 -10.576 3.802
124 HB3 ASN 33 HB1 ASN 33 1.236 -12.614 5.103
125 HA ASP 34 HA ASP 34 0.443 -15.521 2.025
126 HB2 ASP 34 HB2 ASP 34 -1.787 -15.085 2.911
127 H ASP 34 HN ASP 34 -0.406 -12.865 2.562
128 HB3 ASP 34 HB1 ASP 34 -2.209 -14.189 1.458
129 HA3 GLY 35 HA2 GLY 35 1.825 -12.765 -1.855
130 H GLY 35 HN GLY 35 0.554 -12.727 0.159
131 HA2 GLY 35 HA1 GLY 35 1.205 -14.370 -2.195
132 HA ARG 36 HA ARG 36 -2.246 -12.424 -3.952
133 HB2 ARG 36 HB2 ARG 36 -3.748 -12.738 -1.389
134 HG2 ARG 36 HG2 ARG 36 -5.180 -14.210 -2.742
135 HD2 ARG 36 HD2 ARG 36 -2.238 -14.851 -2.792
136 HE ARG 36 HE ARG 36 -3.771 -16.194 -4.364
137 HH11 ARG 36 HH11 ARG 36 -3.124 -17.125 -0.996
138 HH12 ARG 36 HH12 ARG 36 -3.231 -18.786 -1.313
139 HH21 ARG 36 HH21 ARG 36 -3.887 -18.462 -4.760
140 HH22 ARG 36 HH22 ARG 36 -3.670 -19.575 -3.470
141 H ARG 36 HN ARG 36 -1.452 -12.995 -1.261
142 HB3 ARG 36 HB1 ARG 36 -4.517 -11.907 -2.730
143 HG3 ARG 36 HG1 ARG 36 -4.150 -13.894 -4.134
144 HD3 ARG 36 HD1 ARG 36 -3.430 -15.349 -1.592
145 HA PHE 37 HA PHE 37 -2.298 -8.136 -3.308
146 HB2 PHE 37 HB2 PHE 37 -2.228 -8.848 -6.192
147 HD1 PHE 37 HD1 PHE 37 -1.078 -5.792 -4.569
148 HD2 PHE 37 HD2 PHE 37 0.057 -9.623 -5.992
149 HE1 PHE 37 HE1 PHE 37 1.206 -5.120 -4.402
150 HE2 PHE 37 HE2 PHE 37 2.425 -8.976 -5.819
151 HZ PHE 37 HZ PHE 37 3.026 -6.713 -5.033
152 H PHE 37 HN PHE 37 -2.942 -10.556 -4.804
153 HB3 PHE 37 HB1 PHE 37 -2.672 -7.204 -5.750
154 HA TYR 38 HA TYR 38 -6.497 -7.160 -3.739
155 HB2 TYR 38 HB2 TYR 38 -5.374 -6.249 -1.103
156 HD1 TYR 38 HD1 TYR 38 -8.427 -8.206 -1.500
157 HD2 TYR 38 HD2 TYR 38 -4.258 -8.341 -0.671
158 HE1 TYR 38 HE1 TYR 38 -8.671 -10.495 -0.640
159 HE2 TYR 38 HE2 TYR 38 -4.494 -10.621 0.182
160 HH TYR 38 HH TYR 38 -6.123 -12.026 1.062
161 H TYR 38 HN TYR 38 -3.741 -6.813 -2.790
162 HB3 TYR 38 HB1 TYR 38 -7.074 -6.150 -1.474
163 HA LEU 39 HA LEU 39 -5.697 -3.005 -4.884
164 HB2 LEU 39 HB2 LEU 39 -6.884 -3.913 -6.880
165 HG LEU 39 HG LEU 39 -7.979 -1.159 -6.227
166 HD13 LEU 39 HD11 LEU 39 -5.571 -1.195 -5.987
167 HD12 LEU 39 HD12 LEU 39 -6.024 -0.372 -7.482
168 HD11 LEU 39 HD13 LEU 39 -5.420 -2.025 -7.532
169 HD21 LEU 39 HD21 LEU 39 -9.012 -2.293 -8.171
170 HD23 LEU 39 HD22 LEU 39 -7.367 -2.458 -8.849
171 HD22 LEU 39 HD23 LEU 39 -8.048 -0.869 -8.597
172 H LEU 39 HN LEU 39 -7.293 -5.393 -4.764
173 HB3 LEU 39 HB1 LEU 39 -8.411 -3.571 -6.099
174 HA3 GLY 40 HA2 GLY 40 -8.559 -0.702 -2.466
175 H GLY 40 HN GLY 40 -6.010 -1.153 -3.779
176 HA2 GLY 40 HA1 GLY 40 -7.138 -0.851 -1.438
177 HA THR 41 HA THR 41 -7.222 3.409 -3.026
178 HB THR 41 HB THR 41 -9.607 3.727 -1.196
179 HG1 THR 41 HG1 THR 41 -9.410 2.688 -3.825
180 HG21 THR 41 HG21 THR 41 -8.511 5.795 -1.951
181 HG23 THR 41 HG22 THR 41 -10.115 5.627 -2.664
182 HG22 THR 41 HG23 THR 41 -8.681 5.267 -3.627
183 H THR 41 HN THR 41 -8.558 1.413 -1.351
184 HA ILE 42 HA ILE 42 -4.966 4.253 0.738
185 HB ILE 42 HB ILE 42 -4.069 6.541 -1.034
186 HG12 ILE 42 HG12 ILE 42 -2.891 3.791 -0.743
187 HG22 ILE 42 HG21 ILE 42 -2.756 5.129 1.309
188 HG21 ILE 42 HG22 ILE 42 -3.488 6.726 1.366
189 HG23 ILE 42 HG23 ILE 42 -2.045 6.452 0.383
190 HD13 ILE 42 HD11 ILE 42 -1.457 4.353 -2.546
191 HD12 ILE 42 HD12 ILE 42 -1.183 5.315 -1.101
192 HD11 ILE 42 HD13 ILE 42 -2.032 6.026 -2.487
193 H ILE 42 HN ILE 42 -5.686 4.636 -2.013
194 HG13 ILE 42 HG11 ILE 42 -3.785 4.349 -2.155
195 HA ILE 43 HA ILE 43 -7.248 7.712 2.128
196 HB ILE 43 HB ILE 43 -8.122 7.321 4.449
197 HG12 ILE 43 HG12 ILE 43 -6.225 5.582 4.778
198 HG23 ILE 43 HG21 ILE 43 -9.586 6.910 2.618
199 HG22 ILE 43 HG22 ILE 43 -9.736 5.578 3.787
200 HG21 ILE 43 HG23 ILE 43 -8.821 5.342 2.310
201 HD13 ILE 43 HD11 ILE 43 -7.315 3.259 4.803
202 HD12 ILE 43 HD12 ILE 43 -6.477 3.927 3.424
203 HD11 ILE 43 HD13 ILE 43 -8.226 3.957 3.456
204 H ILE 43 HN ILE 43 -5.605 5.316 2.511
205 HG13 ILE 43 HG11 ILE 43 -7.711 5.339 5.652
206 HA ASP 44 HA ASP 44 -3.813 9.121 4.557
207 HB2 ASP 44 HB2 ASP 44 -5.112 8.077 6.504
208 H ASP 44 HN ASP 44 -4.439 6.423 3.818
209 HB3 ASP 44 HB1 ASP 44 -3.760 6.982 6.672
210 HA GLN 45 HA GLN 45 0.025 6.874 4.546
211 HB2 GLN 45 HB2 GLN 45 1.589 8.169 3.245
212 HG2 GLN 45 HG2 GLN 45 -0.396 10.416 3.108
213 HE21 GLN 45 HE21 GLN 45 1.876 12.195 3.233
214 HE22 GLN 45 HE22 GLN 45 2.658 12.114 1.700
215 H GLN 45 HN GLN 45 -1.523 9.264 5.194
216 HB3 GLN 45 HB1 GLN 45 -0.015 8.165 2.530
217 HG3 GLN 45 HG1 GLN 45 0.960 10.437 4.234
218 HA THR 46 HA THR 46 2.834 8.962 7.204
219 HB THR 46 HB THR 46 3.895 7.254 8.716
220 HG1 THR 46 HG1 THR 46 3.697 5.183 8.425
221 HG23 THR 46 HG21 THR 46 1.719 8.124 9.415
222 HG22 THR 46 HG22 THR 46 1.882 6.416 9.845
223 HG21 THR 46 HG23 THR 46 0.915 6.877 8.454
224 H THR 46 HN THR 46 1.964 6.715 5.582
225 HA SER 47 HA SER 47 6.374 8.253 4.828
226 HB2 SER 47 HB2 SER 47 7.924 8.289 7.408
227 HG SER 47 HG SER 47 6.801 10.297 5.769
228 H SER 47 HN SER 47 5.418 8.377 7.510
229 HB3 SER 47 HB1 SER 47 8.551 8.656 5.799
230 HA ASP 48 HA ASP 48 7.619 4.015 5.980
231 HB2 ASP 48 HB2 ASP 48 7.427 2.639 7.912
232 H ASP 48 HN ASP 48 5.691 5.879 7.182
233 HB3 ASP 48 HB1 ASP 48 7.809 4.281 8.443
234 HA GLN 49 HA GLN 49 3.643 2.159 4.963
235 HB2 GLN 49 HB2 GLN 49 2.516 2.788 7.683
236 HG2 GLN 49 HG2 GLN 49 3.827 0.270 6.633
237 HE21 GLN 49 HE21 GLN 49 4.132 1.546 9.746
238 HE22 GLN 49 HE22 GLN 49 3.202 0.381 10.621
239 H GLN 49 HN GLN 49 4.186 4.574 6.462
240 HB3 GLN 49 HB1 GLN 49 1.777 1.632 6.583
241 HG3 GLN 49 HG1 GLN 49 4.587 1.468 7.659
242 HA TYR 50 HA TYR 50 0.168 4.717 4.115
243 HB2 TYR 50 HB2 TYR 50 0.524 2.670 1.916
244 HD1 TYR 50 HD1 TYR 50 3.102 3.079 2.033
245 HD2 TYR 50 HD2 TYR 50 0.258 6.197 1.342
246 HE1 TYR 50 HE1 TYR 50 4.896 4.548 1.366
247 HE2 TYR 50 HE2 TYR 50 2.090 7.687 0.673
248 HH TYR 50 HH TYR 50 5.286 6.515 0.104
249 H TYR 50 HN TYR 50 1.417 2.085 4.283
250 HB3 TYR 50 HB1 TYR 50 -0.546 4.056 1.786
251 HA LEU 51 HA LEU 51 -3.088 2.291 5.579
252 HB2 LEU 51 HB2 LEU 51 -3.274 4.548 6.814
253 HG LEU 51 HG LEU 51 -5.942 3.372 6.058
254 HD13 LEU 51 HD11 LEU 51 -4.541 1.644 6.924
255 HD12 LEU 51 HD12 LEU 51 -5.774 2.089 8.107
256 HD11 LEU 51 HD13 LEU 51 -4.109 2.647 8.309
257 HD21 LEU 51 HD21 LEU 51 -5.103 5.058 8.411
258 HD23 LEU 51 HD22 LEU 51 -6.685 4.298 8.184
259 HD22 LEU 51 HD23 LEU 51 -6.145 5.544 7.068
260 H LEU 51 HN LEU 51 -1.915 4.744 4.584
261 HB3 LEU 51 HB1 LEU 51 -4.287 5.051 5.492
262 HA ILE 52 HA ILE 52 -5.305 2.397 1.845
263 HB ILE 52 HB ILE 52 -4.618 -0.535 2.105
264 HG12 ILE 52 HG12 ILE 52 -2.566 0.722 2.451
265 HG22 ILE 52 HG21 ILE 52 -5.018 1.230 -0.314
266 HG21 ILE 52 HG22 ILE 52 -6.199 0.094 0.333
267 HG23 ILE 52 HG23 ILE 52 -4.676 -0.498 -0.333
268 HD13 ILE 52 HD11 ILE 52 -3.091 2.002 -0.195
269 HD12 ILE 52 HD12 ILE 52 -1.660 2.264 0.826
270 HD11 ILE 52 HD13 ILE 52 -3.244 2.831 1.350
271 H ILE 52 HN ILE 52 -4.144 1.096 4.208
272 HG13 ILE 52 HG11 ILE 52 -2.536 -0.046 0.875
273 HA ARG 53 HA ARG 53 -8.910 0.477 3.265
274 HB2 ARG 53 HB2 ARG 53 -9.660 2.841 3.419
275 HG2 ARG 53 HG2 ARG 53 -11.752 1.426 1.815
276 HD2 ARG 53 HD2 ARG 53 -11.853 3.166 4.255
277 HE ARG 53 HE ARG 53 -14.057 2.220 2.578
278 HH11 ARG 53 HH11 ARG 53 -12.810 3.133 5.851
279 HH12 ARG 53 HH12 ARG 53 -14.360 3.060 6.522
280 HH21 ARG 53 HH21 ARG 53 -16.124 2.161 3.626
281 HH22 ARG 53 HH22 ARG 53 -16.239 2.504 5.307
282 H ARG 53 HN ARG 53 -7.443 2.307 1.560
283 HB3 ARG 53 HB1 ARG 53 -9.898 2.880 1.691
284 HG3 ARG 53 HG1 ARG 53 -11.365 0.958 3.472
285 HD3 ARG 53 HD1 ARG 53 -12.143 3.719 2.594
286 HA PHE 54 HA PHE 54 -8.954 -1.603 -0.482
287 HB2 PHE 54 HB2 PHE 54 -9.894 -3.524 1.622
288 HD1 PHE 54 HD1 PHE 54 -7.328 -3.967 -0.886
289 HD2 PHE 54 HD2 PHE 54 -8.084 -2.875 3.138
290 HE1 PHE 54 HE1 PHE 54 -4.969 -4.151 -0.413
291 HE2 PHE 54 HE2 PHE 54 -5.688 -3.048 3.641
292 HZ PHE 54 HZ PHE 54 -4.107 -3.682 1.855
293 H PHE 54 HN PHE 54 -9.427 -1.257 2.312
294 HB3 PHE 54 HB1 PHE 54 -9.532 -3.969 -0.038
295 HA ASP 55 HA ASP 55 -12.868 -1.727 -2.183
296 HB2 ASP 55 HB2 ASP 55 -11.711 -3.212 -3.767
297 H ASP 55 HN ASP 55 -10.504 -3.093 -1.628
298 HB3 ASP 55 HB1 ASP 55 -12.062 -4.590 -2.743
299 HA ASP 56 HA ASP 56 -14.840 -4.853 0.835
300 HB2 ASP 56 HB2 ASP 56 -13.146 -6.643 0.756
301 H ASP 56 HN ASP 56 -12.108 -4.275 0.003
302 HB3 ASP 56 HB1 ASP 56 -12.118 -5.748 1.856
303 HA GLN 57 HA GLN 57 -13.181 -0.401 2.485
304 HB2 GLN 57 HB2 GLN 57 -15.372 -1.846 3.968
305 HG2 GLN 57 HG2 GLN 57 -15.952 -1.595 1.631
306 HE21 GLN 57 HE21 GLN 57 -14.661 -0.738 0.106
307 HE22 GLN 57 HE22 GLN 57 -14.581 0.960 -0.225
308 H GLN 57 HN GLN 57 -13.052 -2.267 1.228
309 HB3 GLN 57 HB1 GLN 57 -15.016 -0.132 4.084
310 HG3 GLN 57 HG1 GLN 57 -16.941 -0.553 2.642
311 HA SER 58 HA SER 58 -11.449 -2.387 6.337
312 HB2 SER 58 HB2 SER 58 -9.888 -4.276 4.547
313 HG SER 58 HG SER 58 -12.317 -4.538 5.502
314 H SER 58 HN SER 58 -11.879 -3.112 3.602
315 HB3 SER 58 HB1 SER 58 -9.722 -4.153 6.298
316 HA GLU 59 HA GLU 59 -7.922 0.022 5.279
317 HB2 GLU 59 HB2 GLU 59 -9.008 0.858 7.955
318 HG2 GLU 59 HG2 GLU 59 -9.050 2.333 5.348
319 H GLU 59 HN GLU 59 -9.640 -1.360 7.205
320 HB3 GLU 59 HB1 GLU 59 -7.672 1.686 7.146
321 HG3 GLU 59 HG1 GLU 59 -10.334 1.250 5.855
322 HA GLN 60 HA GLN 60 -4.750 -1.602 7.900
323 HB2 GLN 60 HB2 GLN 60 -5.428 -3.471 6.438
324 HG2 GLN 60 HG2 GLN 60 -2.441 -3.129 6.346
325 HE21 GLN 60 HE21 GLN 60 -2.261 -5.767 7.474
326 HE22 GLN 60 HE22 GLN 60 -2.568 -6.888 6.196
327 H GLN 60 HN GLN 60 -5.851 -0.413 5.447
328 HB3 GLN 60 HB1 GLN 60 -4.508 -2.753 5.123
329 HG3 GLN 60 HG1 GLN 60 -3.356 -3.832 7.676
330 HA TRP 61 HA TRP 61 -1.440 0.894 6.410
331 HB2 TRP 61 HB2 TRP 61 -0.591 -0.159 9.122
332 HD1 TRP 61 HD1 TRP 61 -2.403 0.931 10.584
333 HE1 TRP 61 HE1 TRP 61 -3.200 3.353 10.939
334 HE3 TRP 61 HE3 TRP 61 0.158 3.176 6.815
335 HZ2 TRP 61 HZ2 TRP 61 -2.787 5.896 9.742
336 HZ3 TRP 61 HZ3 TRP 61 -0.107 5.598 6.472
337 HH2 TRP 61 HH2 TRP 61 -1.522 6.910 7.870
338 H TRP 61 HN TRP 61 -2.559 -1.115 8.200
339 HB3 TRP 61 HB1 TRP 61 0.435 0.898 8.166
340 HA CYS 62 HA CYS 62 0.934 -2.376 4.912
341 HB2 CYS 62 HB2 CYS 62 -0.160 -0.920 2.510
342 HG CYS 62 HG CYS 62 -2.402 -1.503 4.021
343 H CYS 62 HN CYS 62 -0.469 0.188 4.773
344 HB3 CYS 62 HB1 CYS 62 0.496 -2.554 2.556
345 HA GLU 63 HA GLU 63 4.469 0.008 4.280
346 HB2 GLU 63 HB2 GLU 63 5.199 -2.887 3.977
347 HG2 GLU 63 HG2 GLU 63 6.123 -0.998 6.087
348 H GLU 63 HN GLU 63 3.027 -2.422 4.302
349 HB3 GLU 63 HB1 GLU 63 6.408 -1.613 3.899
350 HG3 GLU 63 HG1 GLU 63 4.506 -1.685 6.171
No H/Q in entry = 350
In of MODEL 1
1 HA PRO 64 HA PRO 64 4.545 1.164 0.140
2 HB2 PRO 64 HB2 PRO 64 7.113 1.881 -0.357
3 HG2 PRO 64 HG2 PRO 64 8.117 0.921 1.539
4 HD2 PRO 64 HD2 PRO 64 6.876 0.293 3.382
5 HB3 PRO 64 HB1 PRO 64 6.003 2.821 0.614
6 HG3 PRO 64 HG1 PRO 64 7.698 2.527 2.165
7 HD3 PRO 64 HD1 PRO 64 5.859 1.728 3.347
8 HA ASP 65 HA ASP 65 7.307 -2.169 -1.752
9 HB2 ASP 65 HB2 ASP 65 8.188 -4.194 -0.871
10 H ASP 65 HN ASP 65 6.558 -1.502 0.934
11 HB3 ASP 65 HB1 ASP 65 8.542 -2.953 0.322
12 HA LYS 66 HA LYS 66 3.502 -4.921 -1.237
13 HB2 LYS 66 HB2 LYS 66 2.165 -3.157 0.817
14 HG2 LYS 66 HG2 LYS 66 3.990 -4.348 1.807
15 HD2 LYS 66 HD2 LYS 66 2.625 -6.789 0.691
16 HE2 LYS 66 HE2 LYS 66 3.343 -7.164 2.913
17 HZ3 LYS 66 HZ1 LYS 66 5.780 -6.896 3.436
18 HZ2 LYS 66 HZ2 LYS 66 4.934 -5.482 3.259
19 HZ1 LYS 66 HZ3 LYS 66 5.924 -6.000 2.009
20 H LYS 66 HN LYS 66 4.504 -2.600 0.188
21 HB3 LYS 66 HB1 LYS 66 1.506 -4.647 0.162
22 HG3 LYS 66 HG1 LYS 66 2.434 -4.978 2.356
23 HD3 LYS 66 HD1 LYS 66 4.221 -6.174 0.244
24 HE3 LYS 66 HE1 LYS 66 4.420 -8.002 1.786
25 HA LEU 67 HA LEU 67 0.899 -1.503 -2.973
26 HB2 LEU 67 HB2 LEU 67 2.904 0.585 -2.203
27 HG LEU 67 HG LEU 67 1.019 -0.606 -0.551
28 HD13 LEU 67 HD11 LEU 67 2.828 0.625 0.251
29 HD12 LEU 67 HD12 LEU 67 1.358 1.430 0.803
30 HD11 LEU 67 HD13 LEU 67 2.286 2.115 -0.545
31 HD23 LEU 67 HD21 LEU 67 0.015 2.028 -1.493
32 HD22 LEU 67 HD22 LEU 67 -0.693 0.942 -0.272
33 HD21 LEU 67 HD23 LEU 67 -0.642 0.467 -1.967
34 H LEU 67 HN LEU 67 3.550 -1.655 -1.728
35 HB3 LEU 67 HB1 LEU 67 1.394 0.895 -3.014
36 HA ARG 68 HA ARG 68 3.105 -0.735 -6.632
37 HB2 ARG 68 HB2 ARG 68 0.967 -2.703 -7.466
38 HG2 ARG 68 HG2 ARG 68 2.183 -3.778 -5.698
39 HD2 ARG 68 HD2 ARG 68 4.161 -2.562 -5.499
40 HE ARG 68 HE ARG 68 5.005 -3.522 -8.134
41 HH11 ARG 68 HH11 ARG 68 5.035 -1.041 -5.570
42 HH12 ARG 68 HH12 ARG 68 6.329 -0.161 -6.250
43 HH21 ARG 68 HH21 ARG 68 6.839 -2.245 -9.050
44 HH22 ARG 68 HH22 ARG 68 7.341 -0.832 -8.245
45 H ARG 68 HN ARG 68 0.721 -1.399 -5.058
46 HB3 ARG 68 HB1 ARG 68 2.451 -2.342 -8.329
47 HG3 ARG 68 HG1 ARG 68 2.653 -4.513 -7.244
48 HD3 ARG 68 HD1 ARG 68 4.574 -4.237 -5.817
49 HA LYS 69 HA LYS 69 0.426 2.282 -8.134
50 HB2 LYS 69 HB2 LYS 69 2.796 2.310 -10.006
51 HG2 LYS 69 HG2 LYS 69 3.311 4.496 -8.951
52 HD2 LYS 69 HD2 LYS 69 3.389 2.221 -6.999
53 HE2 LYS 69 HE2 LYS 69 4.213 4.349 -6.151
54 HZ1 LYS 69 HZ1 LYS 69 4.971 5.339 -8.209
55 HZ3 LYS 69 HZ2 LYS 69 6.257 4.240 -8.320
56 HZ2 LYS 69 HZ3 LYS 69 6.164 5.350 -7.069
57 H LYS 69 HN LYS 69 2.732 0.595 -8.370
58 HB3 LYS 69 HB1 LYS 69 1.512 3.504 -10.086
59 HG3 LYS 69 HG1 LYS 69 2.143 4.094 -7.707
60 HD3 LYS 69 HD1 LYS 69 4.495 2.320 -8.382
61 HE3 LYS 69 HE1 LYS 69 5.491 3.150 -6.282
62 HA LEU 70 HA LEU 70 -1.715 0.203 -11.276
63 HB2 LEU 70 HB2 LEU 70 -3.326 2.736 -11.122
64 HG LEU 70 HG LEU 70 -3.462 1.755 -8.963
65 HD12 LEU 70 HD11 LEU 70 -5.755 1.106 -8.845
66 HD11 LEU 70 HD12 LEU 70 -5.815 0.935 -10.601
67 HD13 LEU 70 HD13 LEU 70 -5.534 2.534 -9.865
68 HD22 LEU 70 HD21 LEU 70 -2.608 -0.421 -9.303
69 HD21 LEU 70 HD22 LEU 70 -3.941 -0.820 -10.400
70 HD23 LEU 70 HD23 LEU 70 -4.262 -0.582 -8.696
71 H LEU 70 HN LEU 70 -1.200 2.596 -9.757
72 HB3 LEU 70 HB1 LEU 70 -3.828 1.254 -11.900
73 HA3 GLY 71 HA2 GLY 71 -0.516 2.649 -14.801
74 H GLY 71 HN GLY 71 -0.647 3.453 -11.968
75 HA2 GLY 71 HA1 GLY 71 -1.079 4.247 -14.335
76 HA3 GLY 72 HA2 GLY 72 3.909 2.527 -13.638
77 H GLY 72 HN GLY 72 1.642 2.177 -13.409
78 HA2 GLY 72 HA1 GLY 72 3.557 3.981 -14.559
79 HA3 GLY 73 HA2 GLY 73 2.582 7.057 -11.248
80 H GLY 73 HN GLY 73 2.590 5.755 -13.180
81 HA2 GLY 73 HA1 GLY 73 3.565 5.841 -10.445
82 HA SER 74 HA SER 74 6.373 9.003 -12.168
83 HB2 SER 74 HB2 SER 74 4.444 11.213 -11.401
84 HG SER 74 HG SER 74 5.041 9.912 -13.825
85 H SER 74 HN SER 74 3.676 8.883 -11.067
86 HB3 SER 74 HB1 SER 74 5.957 11.411 -12.292
87 HA SER 75 HA SER 75 7.226 9.169 -7.757
88 HB2 SER 75 HB2 SER 75 4.397 10.037 -7.038
89 HG SER 75 HG SER 75 6.279 11.226 -8.496
90 H SER 75 HN SER 75 4.964 8.439 -9.306
91 HB3 SER 75 HB1 SER 75 5.848 10.293 -6.061
No H/Q in entry = 91
In of MODEL 2
1 H1 GLY 7 HT2 GLY 7 7.330 -4.042 7.970
2 H2 GLY 7 HT1 GLY 7 7.429 -3.719 9.658
3 H3 GLY 7 HT3 GLY 7 6.393 -2.860 8.642
4 HA3 GLY 7 HA1 GLY 7 8.227 -1.464 9.074
5 HA2 GLY 7 HA2 GLY 7 9.341 -2.746 8.614
No H/Q in entry = 5
In of MODEL 2
1 HA ALA 8 HA ALA 8 8.310 -2.420 4.307
2 HB1 ALA 8 HB1 ALA 8 8.530 -0.035 4.918
3 HB3 ALA 8 HB2 ALA 8 9.354 -0.389 3.399
4 HB2 ALA 8 HB3 ALA 8 10.285 -0.196 4.883
5 H ALA 8 HN ALA 8 9.937 -2.897 6.517
No H/Q in entry = 5
In of MODEL 2
1 HA MET 9 HA MET 9 12.046 -4.206 2.877
2 HB2 MET 9 HB2 MET 9 9.937 -4.891 0.834
3 HG2 MET 9 HG2 MET 9 11.627 -6.641 2.577
4 HE1 MET 9 HE1 MET 9 9.611 -8.943 2.955
5 HE3 MET 9 HE2 MET 9 11.310 -9.234 2.577
6 HE2 MET 9 HE3 MET 9 10.050 -10.060 1.663
7 H MET 9 HN MET 9 9.259 -3.424 2.629
8 HB3 MET 9 HB1 MET 9 11.620 -5.269 0.537
9 HG3 MET 9 HG1 MET 9 9.912 -6.290 2.792
No H/Q in entry = 9
In of MODEL 2
1 HA ALA 10 HA ALA 10 13.727 -1.049 0.471
2 HB1 ALA 10 HB1 ALA 10 11.703 0.531 2.086
3 HB3 ALA 10 HB2 ALA 10 11.429 -0.116 0.476
4 HB2 ALA 10 HB3 ALA 10 12.637 1.147 0.719
5 H ALA 10 HN ALA 10 12.781 -2.115 2.932
No H/Q in entry = 5
In of MODEL 2
1 HA PRO 11 HA PRO 11 16.601 0.591 3.592
2 HB2 PRO 11 HB2 PRO 11 16.775 2.980 1.821
3 HG2 PRO 11 HG2 PRO 11 17.278 1.820 -0.141
4 HD2 PRO 11 HD2 PRO 11 14.982 1.570 0.131
5 HB3 PRO 11 HB1 PRO 11 18.075 1.921 2.375
6 HG3 PRO 11 HG1 PRO 11 17.633 0.321 0.736
7 HD3 PRO 11 HD1 PRO 11 15.494 -0.121 -0.008
No H/Q in entry = 7
In of MODEL 2
1 HA PRO 12 HA PRO 12 14.637 3.701 6.244
2 HB2 PRO 12 HB2 PRO 12 16.712 5.667 5.338
3 HG2 PRO 12 HG2 PRO 12 18.433 4.357 6.233
4 HD2 PRO 12 HD2 PRO 12 17.994 3.220 4.279
5 HB3 PRO 12 HB1 PRO 12 16.109 5.354 6.977
6 HG3 PRO 12 HG1 PRO 12 17.304 3.366 7.171
7 HD3 PRO 12 HD1 PRO 12 17.547 1.917 5.397
No H/Q in entry = 7
In of MODEL 2
1 HA VAL 13 HA VAL 13 12.341 5.796 3.192
2 HB VAL 13 HB VAL 13 10.059 6.202 3.930
3 HG11 VAL 13 HG11 VAL 13 11.091 3.519 4.822
4 HG13 VAL 13 HG12 VAL 13 10.591 3.968 3.190
5 HG12 VAL 13 HG13 VAL 13 9.402 3.904 4.491
6 HG23 VAL 13 HG21 VAL 13 9.347 5.607 6.233
7 HG22 VAL 13 HG22 VAL 13 10.440 6.985 6.174
8 HG21 VAL 13 HG23 VAL 13 11.046 5.408 6.668
9 H VAL 13 HN VAL 13 12.832 4.756 5.813
No H/Q in entry = 9
In of MODEL 2
1 HA ALA 14 HA ALA 14 11.700 10.143 2.649
2 HB2 ALA 14 HB1 ALA 14 11.294 11.425 4.696
3 HB1 ALA 14 HB2 ALA 14 11.669 10.006 5.676
4 HB3 ALA 14 HB3 ALA 14 10.241 10.010 4.644
5 H ALA 14 HN ALA 14 11.593 7.895 2.721
No H/Q in entry = 5
In of MODEL 2
1 HA ALA 15 HA ALA 15 16.064 10.552 3.564
2 HB2 ALA 15 HB1 ALA 15 16.200 7.524 3.494
3 HB3 ALA 15 HB2 ALA 15 16.172 8.524 4.942
4 HB1 ALA 15 HB3 ALA 15 17.569 8.567 3.869
5 H ALA 15 HN ALA 15 14.042 8.580 2.708
No H/Q in entry = 5
In of MODEL 2
1 HA PRO 16 HA PRO 16 17.283 10.346 -0.774
2 HB2 PRO 16 HB2 PRO 16 19.995 10.290 -0.806
3 HG2 PRO 16 HG2 PRO 16 20.367 9.643 1.402
4 HD2 PRO 16 HD2 PRO 16 18.765 9.876 3.041
5 HB3 PRO 16 HB1 PRO 16 19.089 11.732 -0.331
6 HG3 PRO 16 HG1 PRO 16 20.412 11.409 1.562
7 HD3 PRO 16 HD1 PRO 16 18.310 11.506 2.512
No H/Q in entry = 7
In of MODEL 2
1 HA SER 17 HA SER 17 18.635 5.963 -0.878
2 HB2 SER 17 HB2 SER 17 17.028 5.442 1.643
3 HG SER 17 HG SER 17 19.801 5.776 1.214
4 H SER 17 HN SER 17 17.121 7.805 0.807
5 HB3 SER 17 HB1 SER 17 18.104 4.299 0.825
No H/Q in entry = 5
In of MODEL 2
1 HA PRO 18 HA PRO 18 15.007 5.221 -3.320
2 HB2 PRO 18 HB2 PRO 18 15.617 2.334 -3.312
3 HG2 PRO 18 HG2 PRO 18 17.852 2.528 -3.855
4 HD2 PRO 18 HD2 PRO 18 17.878 3.152 -1.624
5 HB3 PRO 18 HB1 PRO 18 15.499 3.451 -4.677
6 HG3 PRO 18 HG1 PRO 18 17.674 4.201 -4.419
7 HD3 PRO 18 HD1 PRO 18 18.604 4.603 -2.348
No H/Q in entry = 7
In of MODEL 2
1 HA ALA 19 HA ALA 19 11.705 2.838 -1.683
2 HB2 ALA 19 HB1 ALA 19 10.776 4.120 0.221
3 HB1 ALA 19 HB2 ALA 19 11.813 5.484 -0.202
4 HB3 ALA 19 HB3 ALA 19 12.530 3.972 0.356
5 H ALA 19 HN ALA 19 12.928 4.928 -3.030
No H/Q in entry = 5
In of MODEL 2
1 HA VAL 20 HA VAL 20 8.970 5.049 -4.169
2 HB VAL 20 HB VAL 20 6.849 3.858 -4.563
3 HG13 VAL 20 HG11 VAL 20 7.941 2.137 -6.079
4 HG12 VAL 20 HG12 VAL 20 9.448 2.377 -5.195
5 HG11 VAL 20 HG13 VAL 20 8.762 3.697 -6.141
6 HG22 VAL 20 HG21 VAL 20 6.701 1.455 -4.024
7 HG21 VAL 20 HG22 VAL 20 6.840 2.440 -2.555
8 HG23 VAL 20 HG23 VAL 20 8.237 1.566 -3.174
9 H VAL 20 HN VAL 20 9.677 2.852 -2.453
No H/Q in entry = 9
In of MODEL 2
1 HA THR 21 HA THR 21 5.892 6.303 -1.433
2 HB THR 21 HB THR 21 5.722 8.768 -2.000
3 HG1 THR 21 HG1 THR 21 7.393 9.582 -3.249
4 HG22 THR 21 HG21 THR 21 7.904 9.208 -0.856
5 HG21 THR 21 HG22 THR 21 8.314 7.506 -1.117
6 HG23 THR 21 HG23 THR 21 6.950 7.933 -0.091
7 H THR 21 HN THR 21 6.994 6.159 -4.089
No H/Q in entry = 7
In of MODEL 2
1 HA TYR 22 HA TYR 22 2.292 6.949 -3.833
2 HB2 TYR 22 HB2 TYR 22 1.720 5.560 -1.216
3 HD1 TYR 22 HD1 TYR 22 0.673 4.320 -4.414
4 HD2 TYR 22 HD2 TYR 22 3.817 4.259 -1.573
5 HE1 TYR 22 HE1 TYR 22 1.636 2.382 -5.537
6 HE2 TYR 22 HE2 TYR 22 4.806 2.325 -2.683
7 HH TYR 22 HH TYR 22 4.106 0.469 -4.269
8 H TYR 22 HN TYR 22 3.807 7.132 -1.327
9 HB3 TYR 22 HB1 TYR 22 0.551 5.701 -2.528
No H/Q in entry = 9
In of MODEL 2
1 HA ALA 23 HA ALA 23 0.023 10.142 -1.820
2 HB3 ALA 23 HB1 ALA 23 -0.945 9.963 -4.675
3 HB1 ALA 23 HB2 ALA 23 0.472 10.853 -4.128
4 HB2 ALA 23 HB3 ALA 23 -1.143 11.360 -3.616
5 H ALA 23 HN ALA 23 0.152 7.888 -3.710
No H/Q in entry = 5
In of MODEL 2
1 HA LEU 24 HA LEU 24 -3.804 8.476 -0.643
2 HB2 LEU 24 HB2 LEU 24 -4.651 11.362 -0.291
3 HG LEU 24 HG LEU 24 -2.676 11.117 1.014
4 HD11 LEU 24 HD11 LEU 24 -5.128 10.857 2.706
5 HD13 LEU 24 HD12 LEU 24 -4.441 12.343 2.039
6 HD12 LEU 24 HD13 LEU 24 -3.558 11.435 3.266
7 HD22 LEU 24 HD21 LEU 24 -2.469 8.733 1.079
8 HD21 LEU 24 HD22 LEU 24 -3.894 8.617 2.115
9 HD23 LEU 24 HD23 LEU 24 -2.427 9.384 2.716
10 H LEU 24 HN LEU 24 -2.123 10.709 -1.099
11 HB3 LEU 24 HB1 LEU 24 -5.344 9.943 0.438
No H/Q in entry = 11
In of MODEL 2
1 HA GLN 25 HA GLN 25 -7.753 8.084 -2.572
2 HB2 GLN 25 HB2 GLN 25 -6.781 10.612 -3.914
3 HG2 GLN 25 HG2 GLN 25 -8.700 10.239 -1.626
4 HE21 GLN 25 HE21 GLN 25 -7.194 13.162 -2.723
5 HE22 GLN 25 HE22 GLN 25 -8.633 13.954 -3.226
6 H GLN 25 HN GLN 25 -6.023 8.271 -1.206
7 HB3 GLN 25 HB1 GLN 25 -8.363 9.874 -4.111
8 HG3 GLN 25 HG1 GLN 25 -7.225 11.190 -1.673
No H/Q in entry = 8
In of MODEL 2
1 HA GLU 26 HA GLU 26 -5.260 6.911 -6.176
2 HB2 GLU 26 HB2 GLU 26 -3.076 7.814 -5.433
3 HG2 GLU 26 HG2 GLU 26 -1.587 6.322 -6.534
4 H GLU 26 HN GLU 26 -4.824 7.412 -3.358
5 HB3 GLU 26 HB1 GLU 26 -2.843 6.388 -4.437
6 HG3 GLU 26 HG1 GLU 26 -2.734 4.984 -6.401
No H/Q in entry = 6
In of MODEL 2
1 HA ASP 27 HA ASP 27 -6.195 2.816 -5.110
2 HB2 ASP 27 HB2 ASP 27 -6.601 2.967 -8.117
3 H ASP 27 HN ASP 27 -5.363 4.890 -7.006
4 HB3 ASP 27 HB1 ASP 27 -7.222 1.705 -7.062
No H/Q in entry = 4
In of MODEL 2
1 HA VAL 28 HA VAL 28 -2.783 0.556 -6.700
2 HB VAL 28 HB VAL 28 -1.240 0.395 -4.582
3 HG11 VAL 28 HG11 VAL 28 -1.014 2.109 -6.355
4 HG13 VAL 28 HG12 VAL 28 -0.631 2.714 -4.734
5 HG12 VAL 28 HG13 VAL 28 -2.181 3.107 -5.481
6 HG22 VAL 28 HG21 VAL 28 -1.860 1.913 -2.792
7 HG21 VAL 28 HG22 VAL 28 -3.054 0.621 -2.964
8 HG23 VAL 28 HG23 VAL 28 -3.403 2.233 -3.584
9 H VAL 28 HN VAL 28 -4.977 1.115 -4.858
No H/Q in entry = 9
In of MODEL 2
1 HA PHE 29 HA PHE 29 -3.703 -3.397 -5.148
2 HB2 PHE 29 HB2 PHE 29 -1.339 -3.766 -6.979
3 HD1 PHE 29 HD1 PHE 29 -4.493 -5.611 -6.380
4 HD2 PHE 29 HD2 PHE 29 -2.202 -3.241 -9.054
5 HE1 PHE 29 HE1 PHE 29 -6.115 -6.072 -8.168
6 HE2 PHE 29 HE2 PHE 29 -3.815 -3.681 -10.843
7 HZ PHE 29 HZ PHE 29 -5.783 -5.101 -10.408
8 H PHE 29 HN PHE 29 -1.909 -1.532 -6.444
9 HB3 PHE 29 HB1 PHE 29 -1.988 -5.119 -6.076
No H/Q in entry = 9
In of MODEL 2
1 HA ILE 30 HA ILE 30 -0.682 -3.980 -1.989
2 HB ILE 30 HB ILE 30 -3.492 -4.173 -0.904
3 HG12 ILE 30 HG12 ILE 30 -2.870 -2.200 0.386
4 HG22 ILE 30 HG21 ILE 30 -2.615 -4.314 1.413
5 HG21 ILE 30 HG22 ILE 30 -1.021 -4.675 0.743
6 HG23 ILE 30 HG23 ILE 30 -2.375 -5.771 0.451
7 HD13 ILE 30 HD11 ILE 30 -2.040 -1.886 -2.434
8 HD12 ILE 30 HD12 ILE 30 -2.555 -0.587 -1.339
9 HD11 ILE 30 HD13 ILE 30 -3.715 -1.825 -1.877
10 H ILE 30 HN ILE 30 -3.203 -4.599 -3.368
11 HG13 ILE 30 HG11 ILE 30 -1.233 -2.282 -0.254
No H/Q in entry = 11
In of MODEL 2
1 HA LYS 31 HA LYS 31 -0.311 -8.298 -2.103
2 HB2 LYS 31 HB2 LYS 31 1.732 -7.609 -3.090
3 HG2 LYS 31 HG2 LYS 31 2.302 -9.157 -0.591
4 HD2 LYS 31 HD2 LYS 31 4.007 -8.940 -3.053
5 HE2 LYS 31 HE2 LYS 31 4.414 -10.105 -0.321
6 HZ2 LYS 31 HZ1 LYS 31 6.498 -10.941 -1.210
7 HZ1 LYS 31 HZ2 LYS 31 6.488 -9.255 -1.348
8 HZ3 LYS 31 HZ3 LYS 31 6.204 -10.211 -2.698
9 H LYS 31 HN LYS 31 0.491 -5.555 -1.882
10 HB3 LYS 31 HB1 LYS 31 2.273 -6.865 -1.602
11 HG3 LYS 31 HG1 LYS 31 1.956 -9.791 -2.199
12 HD3 LYS 31 HD1 LYS 31 4.318 -8.038 -1.569
13 HE3 LYS 31 HE1 LYS 31 4.137 -11.029 -1.789
No H/Q in entry = 13
In of MODEL 2
1 HA CYS 32 HA CYS 32 -0.549 -8.620 2.228
2 HB2 CYS 32 HB2 CYS 32 -2.685 -9.765 1.497
3 HG CYS 32 HG CYS 32 -2.563 -9.949 4.190
4 H CYS 32 HN CYS 32 -1.000 -9.424 -0.498
5 HB3 CYS 32 HB1 CYS 32 -1.737 -11.194 1.125
No H/Q in entry = 5
In of MODEL 2
1 HA ASN 33 HA ASN 33 3.093 -10.684 3.078
2 HB2 ASN 33 HB2 ASN 33 1.998 -10.570 5.385
3 HD21 ASN 33 HD21 ASN 33 3.247 -10.968 7.182
4 HD22 ASN 33 HD22 ASN 33 4.801 -11.717 7.106
5 H ASN 33 HN ASN 33 0.362 -10.418 3.737
6 HB3 ASN 33 HB1 ASN 33 1.607 -12.268 5.183
No H/Q in entry = 6
In of MODEL 2
1 HA ASP 34 HA ASP 34 1.741 -15.146 2.071
2 HB2 ASP 34 HB2 ASP 34 -0.528 -15.202 2.899
3 H ASP 34 HN ASP 34 0.344 -12.715 2.638
4 HB3 ASP 34 HB1 ASP 34 -1.097 -14.271 1.523
No H/Q in entry = 4
In of MODEL 2
1 HA3 GLY 35 HA2 GLY 35 2.453 -12.072 -1.827
2 H GLY 35 HN GLY 35 1.211 -12.297 0.228
3 HA2 GLY 35 HA1 GLY 35 2.110 -13.753 -2.165
No H/Q in entry = 3
In of MODEL 2
1 HA ARG 36 HA ARG 36 -1.586 -12.359 -3.969
2 HB2 ARG 36 HB2 ARG 36 -3.134 -13.028 -1.491
3 HG2 ARG 36 HG2 ARG 36 -4.105 -14.769 -2.886
4 HD2 ARG 36 HD2 ARG 36 -1.102 -14.624 -2.864
5 HE ARG 36 HE ARG 36 -2.477 -16.401 -4.403
6 HH11 ARG 36 HH11 ARG 36 -0.553 -16.873 -1.465
7 HH12 ARG 36 HH12 ARG 36 0.290 -18.226 -2.078
8 HH21 ARG 36 HH21 ARG 36 -1.374 -18.277 -5.204
9 HH22 ARG 36 HH22 ARG 36 -0.202 -19.074 -4.258
10 H ARG 36 HN ARG 36 -0.788 -12.790 -1.222
11 HB3 ARG 36 HB1 ARG 36 -3.983 -12.359 -2.874
12 HG3 ARG 36 HG1 ARG 36 -3.177 -14.194 -4.271
13 HD3 ARG 36 HD1 ARG 36 -2.147 -15.494 -1.749
No H/Q in entry = 13
In of MODEL 2
1 HA PHE 37 HA PHE 37 -2.291 -8.164 -3.365
2 HB2 PHE 37 HB2 PHE 37 -2.425 -8.869 -6.255
3 HD1 PHE 37 HD1 PHE 37 -0.182 -9.589 -6.456
4 HD2 PHE 37 HD2 PHE 37 -1.104 -5.932 -4.519
5 HE1 PHE 37 HE1 PHE 37 2.207 -8.963 -6.479
6 HE2 PHE 37 HE2 PHE 37 1.172 -5.278 -4.524
7 HZ PHE 37 HZ PHE 37 2.913 -6.799 -5.519
8 H PHE 37 HN PHE 37 -2.801 -10.670 -4.785
9 HB3 PHE 37 HB1 PHE 37 -2.820 -7.236 -5.744
No H/Q in entry = 9
In of MODEL 2
1 HA TYR 38 HA TYR 38 -6.539 -7.301 -3.864
2 HB2 TYR 38 HB2 TYR 38 -5.603 -6.594 -1.087
3 HD1 TYR 38 HD1 TYR 38 -8.762 -8.171 -1.748
4 HD2 TYR 38 HD2 TYR 38 -4.660 -8.882 -0.934
5 HE1 TYR 38 HE1 TYR 38 -9.293 -10.501 -1.182
6 HE2 TYR 38 HE2 TYR 38 -5.161 -11.221 -0.360
7 HH TYR 38 HH TYR 38 -8.161 -12.617 -1.137
8 H TYR 38 HN TYR 38 -3.838 -6.909 -2.799
9 HB3 TYR 38 HB1 TYR 38 -7.266 -6.346 -1.593
No H/Q in entry = 9
In of MODEL 2
1 HA LEU 39 HA LEU 39 -5.832 -3.131 -4.926
2 HB2 LEU 39 HB2 LEU 39 -6.802 -4.026 -6.957
3 HG LEU 39 HG LEU 39 -8.452 -1.539 -6.437
4 HD12 LEU 39 HD11 LEU 39 -6.573 -0.301 -7.359
5 HD11 LEU 39 HD12 LEU 39 -5.616 -1.792 -7.396
6 HD13 LEU 39 HD13 LEU 39 -6.125 -1.106 -5.857
7 HD23 LEU 39 HD21 LEU 39 -7.246 -2.681 -8.935
8 HD22 LEU 39 HD22 LEU 39 -8.246 -1.240 -8.821
9 HD21 LEU 39 HD23 LEU 39 -8.951 -2.832 -8.488
10 H LEU 39 HN LEU 39 -7.449 -5.525 -4.708
11 HB3 LEU 39 HB1 LEU 39 -8.408 -3.958 -6.268
No H/Q in entry = 11
In of MODEL 2
1 HA3 GLY 40 HA2 GLY 40 -8.679 -0.767 -2.600
2 H GLY 40 HN GLY 40 -6.045 -1.415 -3.692
3 HA2 GLY 40 HA1 GLY 40 -7.317 -0.929 -1.494
No H/Q in entry = 3
In of MODEL 2
1 HA THR 41 HA THR 41 -6.947 3.237 -3.130
2 HB THR 41 HB THR 41 -9.449 3.824 -1.528
3 HG1 THR 41 HG1 THR 41 -9.314 3.242 -4.338
4 HG21 THR 41 HG21 THR 41 -8.115 5.782 -2.206
5 HG23 THR 41 HG22 THR 41 -9.650 5.733 -3.072
6 HG22 THR 41 HG23 THR 41 -8.165 5.235 -3.881
7 H THR 41 HN THR 41 -8.508 1.412 -1.434
No H/Q in entry = 7
In of MODEL 2
1 HA ILE 42 HA ILE 42 -4.909 4.138 0.680
2 HB ILE 42 HB ILE 42 -3.840 6.399 -1.031
3 HG12 ILE 42 HG12 ILE 42 -2.829 3.575 -0.747
4 HG23 ILE 42 HG21 ILE 42 -3.353 6.570 1.382
5 HG22 ILE 42 HG22 ILE 42 -1.880 6.208 0.484
6 HG21 ILE 42 HG23 ILE 42 -2.712 4.932 1.373
7 HD13 ILE 42 HD11 ILE 42 -1.197 4.092 -2.393
8 HD12 ILE 42 HD12 ILE 42 -0.987 5.021 -0.911
9 HD11 ILE 42 HD13 ILE 42 -1.676 5.797 -2.349
10 H ILE 42 HN ILE 42 -5.531 4.591 -2.093
11 HG13 ILE 42 HG11 ILE 42 -3.563 4.258 -2.191
No H/Q in entry = 11
In of MODEL 2
1 HA ILE 43 HA ILE 43 -7.098 7.684 1.939
2 HB ILE 43 HB ILE 43 -8.175 7.330 4.154
3 HG12 ILE 43 HG12 ILE 43 -6.314 5.551 4.658
4 HG22 ILE 43 HG21 ILE 43 -9.740 5.621 3.382
5 HG21 ILE 43 HG22 ILE 43 -8.682 5.314 1.998
6 HG23 ILE 43 HG23 ILE 43 -9.443 6.900 2.197
7 HD13 ILE 43 HD11 ILE 43 -7.513 3.271 4.689
8 HD12 ILE 43 HD12 ILE 43 -6.467 3.854 3.415
9 HD11 ILE 43 HD13 ILE 43 -8.200 3.943 3.197
10 H ILE 43 HN ILE 43 -5.564 5.230 2.411
11 HG13 ILE 43 HG11 ILE 43 -7.858 5.363 5.446
No H/Q in entry = 11
In of MODEL 2
1 HA ASP 44 HA ASP 44 -3.854 9.004 4.653
2 HB2 ASP 44 HB2 ASP 44 -5.280 7.970 6.509
3 H ASP 44 HN ASP 44 -4.496 6.320 3.836
4 HB3 ASP 44 HB1 ASP 44 -4.000 6.799 6.704
No H/Q in entry = 4
In of MODEL 2
1 HA GLN 45 HA GLN 45 -0.042 6.792 4.745
2 HB2 GLN 45 HB2 GLN 45 1.528 8.246 3.583
3 HG2 GLN 45 HG2 GLN 45 -0.591 10.377 3.577
4 HE21 GLN 45 HE21 GLN 45 0.039 12.267 2.502
5 HE22 GLN 45 HE22 GLN 45 1.361 12.271 1.414
6 H GLN 45 HN GLN 45 -1.670 9.083 5.507
7 HB3 GLN 45 HB1 GLN 45 -0.034 8.191 2.782
8 HG3 GLN 45 HG1 GLN 45 0.823 10.415 4.628
No H/Q in entry = 8
In of MODEL 2
1 HA THR 46 HA THR 46 2.364 8.760 7.801
2 HB THR 46 HB THR 46 3.577 6.999 9.106
3 HG1 THR 46 HG1 THR 46 2.968 4.824 8.644
4 HG23 THR 46 HG21 THR 46 1.619 5.886 10.059
5 HG22 THR 46 HG22 THR 46 0.660 6.413 8.678
6 HG21 THR 46 HG23 THR 46 1.325 7.611 9.799
7 H THR 46 HN THR 46 1.793 6.607 5.932
No H/Q in entry = 7
In of MODEL 2
1 HA SER 47 HA SER 47 6.125 8.822 5.764
2 HB2 SER 47 HB2 SER 47 7.015 9.656 7.952
3 HG SER 47 HG SER 47 8.687 8.325 6.123
4 H SER 47 HN SER 47 5.035 8.029 8.273
5 HB3 SER 47 HB1 SER 47 7.602 8.031 8.288
No H/Q in entry = 5
In of MODEL 2
1 HA ASP 48 HA ASP 48 7.517 4.465 5.617
2 HB2 ASP 48 HB2 ASP 48 6.158 3.403 8.103
3 H ASP 48 HN ASP 48 5.664 5.862 7.439
4 HB3 ASP 48 HB1 ASP 48 7.287 2.515 7.097
No H/Q in entry = 4
In of MODEL 2
1 HA GLN 49 HA GLN 49 3.612 2.391 4.773
2 HB2 GLN 49 HB2 GLN 49 2.744 2.613 7.608
3 HG2 GLN 49 HG2 GLN 49 3.693 0.274 5.982
4 HE21 GLN 49 HE21 GLN 49 5.406 -0.419 8.080
5 HE22 GLN 49 HE22 GLN 49 4.422 -1.136 9.313
6 H GLN 49 HN GLN 49 4.152 4.513 6.706
7 HB3 GLN 49 HB1 GLN 49 1.817 1.651 6.466
8 HG3 GLN 49 HG1 GLN 49 4.750 1.330 6.915
No H/Q in entry = 8
In of MODEL 2
1 HA TYR 50 HA TYR 50 -0.026 4.696 4.124
2 HB2 TYR 50 HB2 TYR 50 0.345 2.621 1.953
3 HD1 TYR 50 HD1 TYR 50 0.186 6.227 1.638
4 HD2 TYR 50 HD2 TYR 50 2.831 2.877 1.801
5 HE1 TYR 50 HE1 TYR 50 2.042 7.646 0.921
6 HE2 TYR 50 HE2 TYR 50 4.665 4.255 1.098
7 HH TYR 50 HH TYR 50 4.549 7.629 1.091
8 H TYR 50 HN TYR 50 1.312 2.111 4.335
9 HB3 TYR 50 HB1 TYR 50 -0.712 4.026 1.825
No H/Q in entry = 9
In of MODEL 2
1 HA LEU 51 HA LEU 51 -3.233 2.160 5.563
2 HB2 LEU 51 HB2 LEU 51 -3.495 4.405 6.819
3 HG LEU 51 HG LEU 51 -6.098 3.148 5.993
4 HD13 LEU 51 HD11 LEU 51 -4.660 1.500 6.964
5 HD12 LEU 51 HD12 LEU 51 -5.930 1.931 8.113
6 HD11 LEU 51 HD13 LEU 51 -4.299 2.570 8.316
7 HD21 LEU 51 HD21 LEU 51 -5.388 4.917 8.317
8 HD23 LEU 51 HD22 LEU 51 -6.939 4.110 8.059
9 HD22 LEU 51 HD23 LEU 51 -6.396 5.343 6.922
10 H LEU 51 HN LEU 51 -2.092 4.654 4.625
11 HB3 LEU 51 HB1 LEU 51 -4.480 4.907 5.483
No H/Q in entry = 11
In of MODEL 2
1 HA ILE 52 HA ILE 52 -5.385 2.275 1.792
2 HB ILE 52 HB ILE 52 -4.770 -0.672 2.088
3 HG12 ILE 52 HG12 ILE 52 -2.702 0.558 2.499
4 HG22 ILE 52 HG21 ILE 52 -5.051 1.099 -0.345
5 HG21 ILE 52 HG22 ILE 52 -6.276 -0.019 0.250
6 HG23 ILE 52 HG23 ILE 52 -4.736 -0.632 -0.361
7 HD11 ILE 52 HD11 ILE 52 -3.284 2.649 1.367
8 HD13 ILE 52 HD12 ILE 52 -3.094 1.793 -0.178
9 HD12 ILE 52 HD13 ILE 52 -1.703 2.028 0.883
10 H ILE 52 HN ILE 52 -4.305 0.977 4.195
11 HG13 ILE 52 HG11 ILE 52 -2.630 -0.245 0.937
No H/Q in entry = 11
In of MODEL 2
1 HA ARG 53 HA ARG 53 -9.114 0.502 3.165
2 HB2 ARG 53 HB2 ARG 53 -9.706 2.912 3.312
3 HG2 ARG 53 HG2 ARG 53 -11.813 1.550 1.664
4 HD2 ARG 53 HD2 ARG 53 -11.939 3.946 2.473
5 HE ARG 53 HE ARG 53 -11.476 2.922 4.932
6 HH11 ARG 53 HH11 ARG 53 -14.058 4.913 3.510
7 HH12 ARG 53 HH12 ARG 53 -14.564 5.546 5.009
8 HH21 ARG 53 HH21 ARG 53 -12.231 3.842 7.012
9 HH22 ARG 53 HH22 ARG 53 -13.529 4.936 6.987
10 H ARG 53 HN ARG 53 -7.506 2.177 1.405
11 HB3 ARG 53 HB1 ARG 53 -9.911 2.948 1.579
12 HG3 ARG 53 HG1 ARG 53 -11.522 1.154 3.356
13 HD3 ARG 53 HD1 ARG 53 -13.331 2.872 2.779
No H/Q in entry = 13
In of MODEL 2
1 HA PHE 54 HA PHE 54 -9.768 -1.624 -0.531
2 HB2 PHE 54 HB2 PHE 54 -10.417 -3.493 1.744
3 HD1 PHE 54 HD1 PHE 54 -8.405 -2.759 3.017
4 HD2 PHE 54 HD2 PHE 54 -8.117 -4.204 -0.972
5 HE1 PHE 54 HE1 PHE 54 -5.975 -3.029 3.293
6 HE2 PHE 54 HE2 PHE 54 -5.697 -4.491 -0.696
7 HZ PHE 54 HZ PHE 54 -4.621 -3.891 1.434
8 H PHE 54 HN PHE 54 -9.853 -1.185 2.337
9 HB3 PHE 54 HB1 PHE 54 -10.254 -3.974 0.063
No H/Q in entry = 9
In of MODEL 2
1 HA ASP 55 HA ASP 55 -13.897 -1.333 -1.385
2 HB2 ASP 55 HB2 ASP 55 -13.370 -2.860 -3.239
3 H ASP 55 HN ASP 55 -11.725 -3.120 -1.272
4 HB3 ASP 55 HB1 ASP 55 -13.840 -4.227 -2.236
No H/Q in entry = 4
In of MODEL 2
1 HA ASP 56 HA ASP 56 -15.973 -4.111 1.624
2 HB2 ASP 56 HB2 ASP 56 -15.338 -5.982 2.961
3 H ASP 56 HN ASP 56 -13.213 -3.938 0.751
4 HB3 ASP 56 HB1 ASP 56 -14.467 -6.157 1.451
No H/Q in entry = 4
In of MODEL 2
1 HA GLN 57 HA GLN 57 -13.850 0.019 3.146
2 HB2 GLN 57 HB2 GLN 57 -15.877 -1.266 4.971
3 HG2 GLN 57 HG2 GLN 57 -16.734 -0.891 2.687
4 HE21 GLN 57 HE21 GLN 57 -18.246 1.556 2.461
5 HE22 GLN 57 HE22 GLN 57 -17.219 2.694 1.652
6 H GLN 57 HN GLN 57 -13.971 -1.826 1.928
7 HB3 GLN 57 HB1 GLN 57 -15.374 0.415 5.041
8 HG3 GLN 57 HG1 GLN 57 -17.538 0.076 3.913
No H/Q in entry = 8
In of MODEL 2
1 HA SER 58 HA SER 58 -11.652 -2.148 6.646
2 HB2 SER 58 HB2 SER 58 -10.386 -3.913 4.553
3 HG SER 58 HG SER 58 -12.156 -4.945 4.759
4 H SER 58 HN SER 58 -12.491 -2.685 3.977
5 HB3 SER 58 HB1 SER 58 -10.125 -3.988 6.298
No H/Q in entry = 5
In of MODEL 2
1 HA GLU 59 HA GLU 59 -8.235 0.180 5.265
2 HB2 GLU 59 HB2 GLU 59 -8.856 1.105 8.076
3 HG2 GLU 59 HG2 GLU 59 -9.495 2.413 5.451
4 H GLU 59 HN GLU 59 -9.860 -1.101 7.322
5 HB3 GLU 59 HB1 GLU 59 -7.720 1.875 6.972
6 HG3 GLU 59 HG1 GLU 59 -10.650 1.515 6.433
No H/Q in entry = 6
In of MODEL 2
1 HA GLN 60 HA GLN 60 -5.076 -1.665 7.820
2 HB2 GLN 60 HB2 GLN 60 -5.798 -3.504 6.361
3 HG2 GLN 60 HG2 GLN 60 -2.794 -3.286 6.303
4 HE21 GLN 60 HE21 GLN 60 -4.562 -4.518 4.264
5 HE22 GLN 60 HE22 GLN 60 -4.151 -6.188 4.260
6 H GLN 60 HN GLN 60 -6.142 -0.473 5.341
7 HB3 GLN 60 HB1 GLN 60 -4.849 -2.837 5.042
8 HG3 GLN 60 HG1 GLN 60 -3.752 -3.943 7.621
No H/Q in entry = 8
In of MODEL 2
1 HA TRP 61 HA TRP 61 -1.668 0.743 6.438
2 HB2 TRP 61 HB2 TRP 61 -0.836 -0.371 9.132
3 HD1 TRP 61 HD1 TRP 61 -2.703 0.739 10.569
4 HE1 TRP 61 HE1 TRP 61 -3.469 3.174 10.934
5 HE3 TRP 61 HE3 TRP 61 -0.011 3.001 6.880
6 HZ2 TRP 61 HZ2 TRP 61 -3.014 5.679 9.784
7 HZ3 TRP 61 HZ3 TRP 61 -0.286 5.452 6.568
8 HH2 TRP 61 HH2 TRP 61 -1.718 6.726 7.972
9 H TRP 61 HN TRP 61 -2.878 -1.263 8.185
10 HB3 TRP 61 HB1 TRP 61 0.188 0.700 8.184
No H/Q in entry = 10
In of MODEL 2
1 HA CYS 62 HA CYS 62 0.592 -2.565 4.862
2 HB2 CYS 62 HB2 CYS 62 -0.415 -1.010 2.486
3 HG CYS 62 HG CYS 62 -2.590 -1.517 4.206
4 H CYS 62 HN CYS 62 -0.658 0.068 4.792
5 HB3 CYS 62 HB1 CYS 62 0.119 -2.690 2.517
No H/Q in entry = 5
In of MODEL 2
1 HA GLU 63 HA GLU 63 4.349 -0.519 4.192
2 HB2 GLU 63 HB2 GLU 63 4.746 -3.374 3.362
3 HG2 GLU 63 HG2 GLU 63 5.789 -2.132 5.812
4 H GLU 63 HN GLU 63 2.594 -2.761 4.047
5 HB3 GLU 63 HB1 GLU 63 6.054 -2.216 3.588
6 HG3 GLU 63 HG1 GLU 63 4.098 -2.603 5.744
No H/Q in entry = 6
In of MODEL 2
1 HA PRO 64 HA PRO 64 4.341 0.793 0.016
2 HB2 PRO 64 HB2 PRO 64 6.940 1.559 -0.313
3 HG2 PRO 64 HG2 PRO 64 7.858 0.679 1.645
4 HD2 PRO 64 HD2 PRO 64 6.537 -0.140 3.315
5 HB3 PRO 64 HB1 PRO 64 5.754 2.495 0.569
6 HG3 PRO 64 HG1 PRO 64 7.301 2.243 2.267
7 HD3 PRO 64 HD1 PRO 64 5.467 1.260 3.375
No H/Q in entry = 7
In of MODEL 2
1 HA ASP 65 HA ASP 65 7.229 -2.518 -1.649
2 HB2 ASP 65 HB2 ASP 65 8.192 -4.519 -0.637
3 H ASP 65 HN ASP 65 6.547 -1.693 1.000
4 HB3 ASP 65 HB1 ASP 65 8.709 -3.080 0.225
No H/Q in entry = 4
In of MODEL 2
1 HA LYS 66 HA LYS 66 3.561 -5.260 -1.127
2 HB2 LYS 66 HB2 LYS 66 2.182 -3.513 0.909
3 HG2 LYS 66 HG2 LYS 66 4.015 -4.644 1.939
4 HD2 LYS 66 HD2 LYS 66 2.819 -7.095 0.685
5 HE2 LYS 66 HE2 LYS 66 3.321 -7.542 2.961
6 HZ1 LYS 66 HZ1 LYS 66 5.984 -6.361 2.341
7 HZ3 LYS 66 HZ2 LYS 66 5.721 -7.410 3.638
8 HZ2 LYS 66 HZ3 LYS 66 4.938 -5.945 3.616
9 H LYS 66 HN LYS 66 4.416 -2.781 0.159
10 HB3 LYS 66 HB1 LYS 66 1.543 -5.017 0.274
11 HG3 LYS 66 HG1 LYS 66 2.482 -5.360 2.451
12 HD3 LYS 66 HD1 LYS 66 4.434 -6.432 0.434
13 HE3 LYS 66 HE1 LYS 66 4.473 -8.348 1.898
No H/Q in entry = 13
In of MODEL 2
1 HA LEU 67 HA LEU 67 0.869 -1.925 -2.884
2 HB2 LEU 67 HB2 LEU 67 2.794 0.249 -2.102
3 HG LEU 67 HG LEU 67 0.807 -0.949 -0.529
4 HD13 LEU 67 HD11 LEU 67 2.615 0.264 0.399
5 HD12 LEU 67 HD12 LEU 67 1.130 1.088 0.874
6 HD11 LEU 67 HD13 LEU 67 2.138 1.754 -0.419
7 HD23 LEU 67 HD21 LEU 67 -0.086 1.707 -1.542
8 HD22 LEU 67 HD22 LEU 67 -0.872 0.668 -0.334
9 HD21 LEU 67 HD23 LEU 67 -0.763 0.152 -2.012
10 H LEU 67 HN LEU 67 3.453 -1.962 -1.547
11 HB3 LEU 67 HB1 LEU 67 1.316 0.507 -2.984
No H/Q in entry = 11
In of MODEL 2
1 HA ARG 68 HA ARG 68 3.062 -1.004 -6.637
2 HB2 ARG 68 HB2 ARG 68 0.856 -2.964 -7.338
3 HG2 ARG 68 HG2 ARG 68 2.367 -3.913 -5.649
4 HD2 ARG 68 HD2 ARG 68 4.406 -2.722 -6.168
5 HE ARG 68 HE ARG 68 4.040 -3.725 -8.780
6 HH11 ARG 68 HH11 ARG 68 6.574 -2.993 -6.456
7 HH12 ARG 68 HH12 ARG 68 7.763 -2.642 -7.620
8 HH21 ARG 68 HH21 ARG 68 5.667 -3.198 -10.402
9 HH22 ARG 68 HH22 ARG 68 7.227 -2.732 -9.917
10 H ARG 68 HN ARG 68 0.663 -1.556 -5.006
11 HB3 ARG 68 HB1 ARG 68 2.246 -2.575 -8.334
12 HG3 ARG 68 HG1 ARG 68 2.432 -4.765 -7.190
13 HD3 ARG 68 HD1 ARG 68 4.651 -4.465 -6.229
No H/Q in entry = 13
In of MODEL 2
1 HA LYS 69 HA LYS 69 0.151 1.906 -8.003
2 HB2 LYS 69 HB2 LYS 69 2.461 2.436 -9.869
3 HG2 LYS 69 HG2 LYS 69 2.362 4.703 -8.642
4 HD2 LYS 69 HD2 LYS 69 3.452 2.316 -7.195
5 HE2 LYS 69 HE2 LYS 69 3.601 4.405 -5.938
6 HZ1 LYS 69 HZ1 LYS 69 3.638 6.009 -7.767
7 HZ3 LYS 69 HZ2 LYS 69 5.185 5.503 -8.216
8 HZ2 LYS 69 HZ3 LYS 69 4.939 6.238 -6.737
9 H LYS 69 HN LYS 69 2.665 0.613 -8.143
10 HB3 LYS 69 HB1 LYS 69 0.986 3.373 -9.889
11 HG3 LYS 69 HG1 LYS 69 1.564 3.783 -7.371
12 HD3 LYS 69 HD1 LYS 69 4.216 3.081 -8.590
13 HE3 LYS 69 HE1 LYS 69 5.173 3.811 -6.457
No H/Q in entry = 13
In of MODEL 2
1 HA LEU 70 HA LEU 70 -1.645 -0.338 -11.372
2 HB2 LEU 70 HB2 LEU 70 -3.510 2.027 -11.426
3 HG LEU 70 HG LEU 70 -3.644 1.401 -9.126
4 HD11 LEU 70 HD11 LEU 70 -5.728 1.876 -10.273
5 HD13 LEU 70 HD12 LEU 70 -5.927 0.669 -8.999
6 HD12 LEU 70 HD13 LEU 70 -5.883 0.160 -10.683
7 HD21 LEU 70 HD21 LEU 70 -2.612 -0.798 -9.257
8 HD23 LEU 70 HD22 LEU 70 -4.066 -1.419 -10.070
9 HD22 LEU 70 HD23 LEU 70 -4.161 -0.838 -8.416
10 H LEU 70 HN LEU 70 -1.498 1.975 -9.634
11 HB3 LEU 70 HB1 LEU 70 -3.829 0.400 -11.956
No H/Q in entry = 11
In of MODEL 2
1 HA3 GLY 71 HA2 GLY 71 0.123 2.812 -14.239
2 H GLY 71 HN GLY 71 -1.086 3.089 -11.667
3 HA2 GLY 71 HA1 GLY 71 -1.470 3.562 -14.335
No H/Q in entry = 3
In of MODEL 2
1 HA3 GLY 72 HA2 GLY 72 1.690 6.535 -12.719
2 H GLY 72 HN GLY 72 1.258 3.761 -12.129
3 HA2 GLY 72 HA1 GLY 72 0.870 6.289 -11.185
No H/Q in entry = 3
In of MODEL 2
1 HA3 GLY 73 HA2 GLY 73 4.939 3.679 -10.759
2 H GLY 73 HN GLY 73 3.508 4.648 -12.897
3 HA2 GLY 73 HA1 GLY 73 5.681 4.165 -12.278
No H/Q in entry = 3
In of MODEL 2
1 HA SER 74 HA SER 74 6.490 7.760 -9.754
2 HB2 SER 74 HB2 SER 74 7.568 8.484 -12.500
3 HG SER 74 HG SER 74 8.765 7.044 -10.390
4 H SER 74 HN SER 74 5.472 6.781 -12.308
5 HB3 SER 74 HB1 SER 74 8.158 9.107 -10.956
No H/Q in entry = 5
In of MODEL 2
1 HA SER 75 HA SER 75 3.179 9.948 -12.603
2 HB2 SER 75 HB2 SER 75 5.394 12.064 -12.429
3 HG SER 75 HG SER 75 4.343 11.029 -10.492
4 H SER 75 HN SER 75 5.629 8.958 -13.024
5 HB3 SER 75 HB1 SER 75 3.721 12.424 -12.828
6 H1 GLY 7 HT1 GLY 7 20.953 -3.228 4.335
7 H2 GLY 7 HT3 GLY 7 22.510 -2.627 4.502
8 H3 GLY 7 HT2 GLY 7 21.511 -2.805 5.864
9 HA3 GLY 7 HA1 GLY 7 20.014 -1.129 4.992
10 HA2 GLY 7 HA2 GLY 7 21.653 -0.490 5.148
No H/Q in entry = 10
In of MODEL 3
1 HA ALA 8 HA ALA 8 20.339 1.886 1.505
2 HB2 ALA 8 HB1 ALA 8 22.746 1.348 1.352
3 HB3 ALA 8 HB2 ALA 8 21.955 1.289 -0.223
4 HB1 ALA 8 HB3 ALA 8 22.337 -0.209 0.632
5 H ALA 8 HN ALA 8 20.478 0.980 3.533
No H/Q in entry = 5
In of MODEL 3
1 HA MET 9 HA MET 9 17.364 -0.885 -0.062
2 HB2 MET 9 HB2 MET 9 16.024 1.812 0.132
3 HG2 MET 9 HG2 MET 9 16.387 0.739 2.303
4 HE3 MET 9 HE1 MET 9 15.842 -1.014 4.207
5 HE2 MET 9 HE2 MET 9 14.873 -2.468 3.955
6 HE1 MET 9 HE3 MET 9 14.132 -0.873 3.810
7 H MET 9 HN MET 9 18.308 1.618 0.943
8 HB3 MET 9 HB1 MET 9 15.225 0.357 -0.449
9 HG3 MET 9 HG1 MET 9 14.678 0.849 1.889
No H/Q in entry = 9
In of MODEL 3
1 HA ALA 10 HA ALA 10 18.012 0.409 -4.147
2 HB1 ALA 10 HB1 ALA 10 19.673 -2.091 -3.749
3 HB2 ALA 10 HB2 ALA 10 20.254 -0.431 -3.612
4 HB3 ALA 10 HB3 ALA 10 19.716 -1.054 -5.174
5 H ALA 10 HN ALA 10 17.932 -1.518 -1.952
No H/Q in entry = 5
In of MODEL 3
1 HA PRO 11 HA PRO 11 14.834 -2.117 -5.850
2 HB2 PRO 11 HB2 PRO 11 15.275 -1.717 -8.525
3 HG2 PRO 11 HG2 PRO 11 17.310 -0.656 -8.452
4 HD2 PRO 11 HD2 PRO 11 18.188 0.126 -6.487
5 HB3 PRO 11 HB1 PRO 11 14.490 -0.521 -7.490
6 HG3 PRO 11 HG1 PRO 11 16.252 0.754 -8.272
7 HD3 PRO 11 HD1 PRO 11 16.684 0.951 -6.030
No H/Q in entry = 7
In of MODEL 3
1 HA PRO 12 HA PRO 12 16.953 -5.993 -6.747
2 HB2 PRO 12 HB2 PRO 12 14.746 -7.446 -7.365
3 HG2 PRO 12 HG2 PRO 12 13.219 -5.729 -7.603
4 HD2 PRO 12 HD2 PRO 12 13.572 -3.636 -6.703
5 HB3 PRO 12 HB1 PRO 12 15.148 -7.002 -5.698
6 HG3 PRO 12 HG1 PRO 12 12.993 -6.127 -5.890
7 HD3 PRO 12 HD1 PRO 12 14.191 -4.289 -5.175
No H/Q in entry = 7
In of MODEL 3
1 HA VAL 13 HA VAL 13 17.741 -3.944 -10.917
2 HB VAL 13 HB VAL 13 17.096 -6.898 -11.282
3 HG13 VAL 13 HG11 VAL 13 17.030 -5.707 -13.413
4 HG12 VAL 13 HG12 VAL 13 18.452 -6.749 -13.330
5 HG11 VAL 13 HG13 VAL 13 18.620 -5.012 -13.089
6 HG23 VAL 13 HG21 VAL 13 19.541 -7.213 -11.179
7 HG22 VAL 13 HG22 VAL 13 18.904 -6.537 -9.679
8 HG21 VAL 13 HG23 VAL 13 19.734 -5.495 -10.831
9 H VAL 13 HN VAL 13 17.227 -4.216 -8.755
No H/Q in entry = 9
In of MODEL 3
1 HA ALA 14 HA ALA 14 13.769 -4.368 -13.039
2 HB3 ALA 14 HB1 ALA 14 12.155 -6.168 -13.443
3 HB2 ALA 14 HB2 ALA 14 12.882 -7.114 -12.141
4 HB1 ALA 14 HB3 ALA 14 13.810 -6.753 -13.595
5 H ALA 14 HN ALA 14 14.986 -6.172 -11.097
No H/Q in entry = 5
In of MODEL 3
1 HA ALA 15 HA ALA 15 10.735 -2.950 -10.288
2 HB3 ALA 15 HB1 ALA 15 13.291 -2.227 -8.839
3 HB2 ALA 15 HB2 ALA 15 12.332 -3.683 -8.577
4 HB1 ALA 15 HB3 ALA 15 11.666 -2.103 -8.162
5 H ALA 15 HN ALA 15 13.162 -2.696 -11.756
No H/Q in entry = 5
In of MODEL 3
1 HA PRO 16 HA PRO 16 10.781 1.421 -11.441
2 HB2 PRO 16 HB2 PRO 16 9.486 2.182 -8.911
3 HG2 PRO 16 HG2 PRO 16 7.924 0.482 -8.730
4 HD2 PRO 16 HD2 PRO 16 9.907 -0.630 -8.228
5 HB3 PRO 16 HB1 PRO 16 8.827 2.243 -10.549
6 HG3 PRO 16 HG1 PRO 16 8.033 0.082 -10.453
7 HD3 PRO 16 HD1 PRO 16 9.281 -1.652 -9.540
No H/Q in entry = 7
In of MODEL 3
1 HA SER 17 HA SER 17 13.650 3.802 -9.161
2 HB2 SER 17 HB2 SER 17 11.402 5.614 -8.264
3 HG SER 17 HG SER 17 12.424 6.740 -10.213
4 H SER 17 HN SER 17 10.886 3.654 -9.691
5 HB3 SER 17 HB1 SER 17 13.116 6.029 -8.352
No H/Q in entry = 5
In of MODEL 3
1 HA PRO 18 HA PRO 18 13.817 2.222 -4.983
2 HB2 PRO 18 HB2 PRO 18 15.729 3.934 -3.936
3 HG2 PRO 18 HG2 PRO 18 16.066 5.299 -5.738
4 HD2 PRO 18 HD2 PRO 18 15.129 4.867 -7.791
5 HB3 PRO 18 HB1 PRO 18 16.092 2.466 -4.838
6 HG3 PRO 18 HG1 PRO 18 17.149 3.986 -6.228
7 HD3 PRO 18 HD1 PRO 18 15.647 3.168 -7.779
No H/Q in entry = 7
In of MODEL 3
1 HA ALA 19 HA ALA 19 11.282 3.440 -1.792
2 HB3 ALA 19 HB1 ALA 19 12.776 6.040 -1.970
3 HB1 ALA 19 HB2 ALA 19 13.257 4.664 -0.971
4 HB2 ALA 19 HB3 ALA 19 11.730 5.495 -0.654
5 H ALA 19 HN ALA 19 12.772 2.613 -3.180
No H/Q in entry = 5
In of MODEL 3
1 HA VAL 20 HA VAL 20 8.737 5.455 -4.763
2 HB VAL 20 HB VAL 20 6.692 4.018 -5.182
3 HG11 VAL 20 HG11 VAL 20 9.386 2.882 -5.953
4 HG13 VAL 20 HG12 VAL 20 8.498 4.153 -6.800
5 HG12 VAL 20 HG13 VAL 20 7.853 2.512 -6.748
6 HG22 VAL 20 HG21 VAL 20 6.834 1.628 -4.678
7 HG21 VAL 20 HG22 VAL 20 6.902 2.577 -3.190
8 HG23 VAL 20 HG23 VAL 20 8.373 1.884 -3.860
9 H VAL 20 HN VAL 20 9.711 3.183 -3.319
No H/Q in entry = 9
In of MODEL 3
1 HA THR 21 HA THR 21 5.933 6.414 -1.595
2 HB THR 21 HB THR 21 7.506 8.359 -1.888
3 HG1 THR 21 HG1 THR 21 5.885 8.506 -0.329
4 HG22 THR 21 HG21 THR 21 6.719 10.306 -3.198
5 HG21 THR 21 HG22 THR 21 5.352 9.322 -3.752
6 HG23 THR 21 HG23 THR 21 6.991 8.874 -4.205
7 H THR 21 HN THR 21 6.888 6.639 -4.340
No H/Q in entry = 7
In of MODEL 3
1 HA TYR 22 HA TYR 22 2.151 7.241 -3.772
2 HB2 TYR 22 HB2 TYR 22 1.692 5.735 -1.192
3 HD1 TYR 22 HD1 TYR 22 3.824 4.492 -1.583
4 HD2 TYR 22 HD2 TYR 22 0.711 4.560 -4.482
5 HE1 TYR 22 HE1 TYR 22 4.870 2.628 -2.750
6 HE2 TYR 22 HE2 TYR 22 1.728 2.690 -5.619
7 HH TYR 22 HH TYR 22 4.165 0.784 -4.397
8 H TYR 22 HN TYR 22 3.771 7.500 -1.357
9 HB3 TYR 22 HB1 TYR 22 0.512 5.864 -2.488
No H/Q in entry = 9
In of MODEL 3
1 HA ALA 23 HA ALA 23 -0.186 10.235 -1.488
2 HB2 ALA 23 HB1 ALA 23 -1.365 11.576 -3.181
3 HB3 ALA 23 HB2 ALA 23 -1.143 10.272 -4.352
4 HB1 ALA 23 HB3 ALA 23 0.256 11.133 -3.719
5 H ALA 23 HN ALA 23 -0.058 8.089 -3.501
No H/Q in entry = 5
In of MODEL 3
1 HA LEU 24 HA LEU 24 -4.054 8.576 -0.471
2 HB2 LEU 24 HB2 LEU 24 -5.098 11.418 -0.217
3 HG LEU 24 HG LEU 24 -3.122 11.354 1.138
4 HD11 LEU 24 HD11 LEU 24 -5.035 12.498 2.030
5 HD13 LEU 24 HD12 LEU 24 -4.118 11.730 3.327
6 HD12 LEU 24 HD13 LEU 24 -5.619 11.000 2.760
7 HD23 LEU 24 HD21 LEU 24 -2.857 9.705 2.916
8 HD22 LEU 24 HD22 LEU 24 -2.788 8.993 1.306
9 HD21 LEU 24 HD23 LEU 24 -4.249 8.826 2.284
10 H LEU 24 HN LEU 24 -2.442 10.863 -0.957
11 HB3 LEU 24 HB1 LEU 24 -5.684 9.974 0.531
No H/Q in entry = 11
In of MODEL 3
1 HA GLN 25 HA GLN 25 -7.874 7.841 -2.507
2 HB2 GLN 25 HB2 GLN 25 -7.076 10.412 -3.866
3 HG2 GLN 25 HG2 GLN 25 -8.993 9.859 -1.624
4 HE21 GLN 25 HE21 GLN 25 -8.323 11.926 -4.408
5 HE22 GLN 25 HE22 GLN 25 -9.759 12.871 -4.263
6 H GLN 25 HN GLN 25 -6.209 8.207 -1.099
7 HB3 GLN 25 HB1 GLN 25 -8.569 9.537 -4.157
8 HG3 GLN 25 HG1 GLN 25 -7.703 11.029 -1.729
No H/Q in entry = 8
In of MODEL 3
1 HA GLU 26 HA GLU 26 -5.038 6.941 -6.079
2 HB2 GLU 26 HB2 GLU 26 -3.039 7.850 -4.902
3 HG2 GLU 26 HG2 GLU 26 -1.297 6.368 -5.718
4 H GLU 26 HN GLU 26 -4.897 7.454 -3.244
5 HB3 GLU 26 HB1 GLU 26 -2.929 6.356 -4.002
6 HG3 GLU 26 HG1 GLU 26 -2.520 5.164 -6.122
No H/Q in entry = 6
In of MODEL 3
1 HA ASP 27 HA ASP 27 -6.100 2.814 -5.037
2 HB2 ASP 27 HB2 ASP 27 -6.718 3.098 -7.990
3 H ASP 27 HN ASP 27 -5.644 5.014 -6.869
4 HB3 ASP 27 HB1 ASP 27 -7.032 1.641 -7.053
No H/Q in entry = 4
In of MODEL 3
1 HA VAL 28 HA VAL 28 -2.680 0.691 -6.720
2 HB VAL 28 HB VAL 28 -1.087 0.551 -4.642
3 HG11 VAL 28 HG11 VAL 28 -2.137 3.236 -5.484
4 HG13 VAL 28 HG12 VAL 28 -0.883 2.314 -6.341
5 HG12 VAL 28 HG13 VAL 28 -0.595 2.909 -4.695
6 HG22 VAL 28 HG21 VAL 28 -1.705 2.011 -2.808
7 HG21 VAL 28 HG22 VAL 28 -2.864 0.686 -2.972
8 HG23 VAL 28 HG23 VAL 28 -3.278 2.298 -3.542
9 H VAL 28 HN VAL 28 -4.848 1.174 -4.827
No H/Q in entry = 9
In of MODEL 3
1 HA PHE 29 HA PHE 29 -3.477 -3.303 -5.208
2 HB2 PHE 29 HB2 PHE 29 -1.067 -3.571 -7.000
3 HD1 PHE 29 HD1 PHE 29 -4.256 -5.387 -6.502
4 HD2 PHE 29 HD2 PHE 29 -1.819 -3.097 -9.123
5 HE1 PHE 29 HE1 PHE 29 -5.830 -5.826 -8.341
6 HE2 PHE 29 HE2 PHE 29 -3.387 -3.530 -10.964
7 HZ PHE 29 HZ PHE 29 -5.394 -4.891 -10.576
8 H PHE 29 HN PHE 29 -1.723 -1.364 -6.462
9 HB3 PHE 29 HB1 PHE 29 -1.712 -4.957 -6.146
No H/Q in entry = 9
In of MODEL 3
1 HA ILE 30 HA ILE 30 -0.451 -3.877 -2.033
2 HB ILE 30 HB ILE 30 -3.258 -4.124 -0.940
3 HG12 ILE 30 HG12 ILE 30 -2.682 -2.150 0.361
4 HG22 ILE 30 HG21 ILE 30 -2.379 -4.275 1.361
5 HG21 ILE 30 HG22 ILE 30 -0.764 -4.532 0.701
6 HG23 ILE 30 HG23 ILE 30 -2.045 -5.708 0.389
7 HD11 ILE 30 HD11 ILE 30 -3.564 -1.755 -1.871
8 HD13 ILE 30 HD12 ILE 30 -1.895 -1.791 -2.465
9 HD12 ILE 30 HD13 ILE 30 -2.404 -0.512 -1.350
10 H ILE 30 HN ILE 30 -2.969 -4.484 -3.433
11 HG13 ILE 30 HG11 ILE 30 -1.049 -2.178 -0.295
No H/Q in entry = 11
In of MODEL 3
1 HA LYS 31 HA LYS 31 -0.203 -8.186 -2.177
2 HB2 LYS 31 HB2 LYS 31 1.840 -7.688 -3.213
3 HG2 LYS 31 HG2 LYS 31 2.463 -9.116 -0.657
4 HD2 LYS 31 HD2 LYS 31 3.946 -9.269 -3.248
5 HE2 LYS 31 HE2 LYS 31 4.543 -10.149 -0.453
6 HZ1 LYS 31 HZ1 LYS 31 6.545 -9.535 -1.675
7 HZ3 LYS 31 HZ2 LYS 31 6.106 -10.532 -2.957
8 HZ2 LYS 31 HZ3 LYS 31 6.476 -11.205 -1.452
9 H LYS 31 HN LYS 31 0.726 -5.488 -1.893
10 HB3 LYS 31 HB1 LYS 31 2.470 -6.907 -1.781
11 HG3 LYS 31 HG1 LYS 31 1.939 -9.846 -2.172
12 HD3 LYS 31 HD1 LYS 31 4.450 -8.212 -1.914
13 HE3 LYS 31 HE1 LYS 31 4.080 -11.192 -1.788
No H/Q in entry = 13
In of MODEL 3
1 HA CYS 32 HA CYS 32 -0.411 -8.610 2.110
2 HB2 CYS 32 HB2 CYS 32 -2.676 -9.369 1.313
3 HG CYS 32 HG CYS 32 -2.555 -11.986 2.997
4 H CYS 32 HN CYS 32 -0.847 -9.359 -0.651
5 HB3 CYS 32 HB1 CYS 32 -1.944 -10.917 0.904
No H/Q in entry = 5
In of MODEL 3
1 HA ASN 33 HA ASN 33 2.731 -11.345 2.989
2 HB2 ASN 33 HB2 ASN 33 0.774 -12.275 5.047
3 HD21 ASN 33 HD21 ASN 33 4.055 -11.226 5.504
4 HD22 ASN 33 HD22 ASN 33 3.685 -9.744 6.296
5 H ASN 33 HN ASN 33 0.087 -10.575 3.550
6 HB3 ASN 33 HB1 ASN 33 2.466 -12.793 5.037
No H/Q in entry = 6
In of MODEL 3
1 HA ASP 34 HA ASP 34 0.929 -15.446 1.833
2 HB2 ASP 34 HB2 ASP 34 -1.307 -16.229 1.248
3 H ASP 34 HN ASP 34 -0.302 -12.876 2.294
4 HB3 ASP 34 HB1 ASP 34 -1.358 -15.340 2.760
No H/Q in entry = 4
In of MODEL 3
1 HA3 GLY 35 HA2 GLY 35 2.168 -12.479 -1.831
2 H GLY 35 HN GLY 35 0.998 -12.672 0.160
3 HA2 GLY 35 HA1 GLY 35 1.776 -14.131 -2.242
No H/Q in entry = 3
In of MODEL 3
1 HA ARG 36 HA ARG 36 -1.783 -12.357 -4.159
2 HB2 ARG 36 HB2 ARG 36 -3.433 -12.610 -1.671
3 HG2 ARG 36 HG2 ARG 36 -4.751 -14.193 -2.966
4 HD2 ARG 36 HD2 ARG 36 -1.841 -14.887 -3.131
5 HE ARG 36 HE ARG 36 -3.556 -16.459 -4.050
6 HH11 ARG 36 HH11 ARG 36 -2.923 -16.338 -0.570
7 HH12 ARG 36 HH12 ARG 36 -3.146 -18.010 -0.331
8 HH21 ARG 36 HH21 ARG 36 -3.963 -18.744 -3.708
9 HH22 ARG 36 HH22 ARG 36 -3.769 -19.409 -2.160
10 H ARG 36 HN ARG 36 -1.083 -12.795 -1.372
11 HB3 ARG 36 HB1 ARG 36 -4.121 -11.879 -3.105
12 HG3 ARG 36 HG1 ARG 36 -3.682 -13.954 -4.341
13 HD3 ARG 36 HD1 ARG 36 -2.801 -14.963 -1.655
No H/Q in entry = 13
In of MODEL 3
1 HA PHE 37 HA PHE 37 -2.128 -8.114 -3.527
2 HB2 PHE 37 HB2 PHE 37 -2.297 -8.786 -6.424
3 HD1 PHE 37 HD1 PHE 37 -0.988 -5.884 -4.588
4 HD2 PHE 37 HD2 PHE 37 -0.038 -9.461 -6.680
5 HE1 PHE 37 HE1 PHE 37 1.288 -5.221 -4.556
6 HE2 PHE 37 HE2 PHE 37 2.350 -8.827 -6.649
7 HZ PHE 37 HZ PHE 37 3.044 -6.703 -5.589
8 H PHE 37 HN PHE 37 -2.808 -10.554 -4.959
9 HB3 PHE 37 HB1 PHE 37 -2.694 -7.151 -5.912
No H/Q in entry = 9
In of MODEL 3
1 HA TYR 38 HA TYR 38 -6.393 -7.230 -3.808
2 HB2 TYR 38 HB2 TYR 38 -5.294 -6.295 -1.151
3 HD1 TYR 38 HD1 TYR 38 -8.325 -8.202 -1.408
4 HD2 TYR 38 HD2 TYR 38 -4.123 -8.462 -0.904
5 HE1 TYR 38 HE1 TYR 38 -8.585 -10.496 -0.566
6 HE2 TYR 38 HE2 TYR 38 -4.359 -10.766 -0.047
7 HH TYR 38 HH TYR 38 -7.418 -12.433 -0.198
8 H TYR 38 HN TYR 38 -3.622 -6.815 -2.930
9 HB3 TYR 38 HB1 TYR 38 -6.998 -6.249 -1.566
No H/Q in entry = 9
In of MODEL 3
1 HA LEU 39 HA LEU 39 -5.679 -3.088 -4.989
2 HB2 LEU 39 HB2 LEU 39 -6.646 -4.013 -7.007
3 HG LEU 39 HG LEU 39 -8.299 -1.527 -6.509
4 HD11 LEU 39 HD11 LEU 39 -5.456 -1.786 -7.445
5 HD13 LEU 39 HD12 LEU 39 -5.981 -1.074 -5.915
6 HD12 LEU 39 HD13 LEU 39 -6.406 -0.301 -7.444
7 HD21 LEU 39 HD21 LEU 39 -8.784 -2.834 -8.558
8 HD23 LEU 39 HD22 LEU 39 -7.067 -2.655 -9.000
9 HD22 LEU 39 HD23 LEU 39 -8.091 -1.239 -8.883
10 H LEU 39 HN LEU 39 -7.311 -5.475 -4.705
11 HB3 LEU 39 HB1 LEU 39 -8.253 -3.938 -6.320
No H/Q in entry = 11
In of MODEL 3
1 HA3 GLY 40 HA2 GLY 40 -8.530 -0.807 -2.572
2 H GLY 40 HN GLY 40 -5.891 -1.397 -3.702
3 HA2 GLY 40 HA1 GLY 40 -7.146 -0.959 -1.498
No H/Q in entry = 3
In of MODEL 3
1 HA THR 41 HA THR 41 -6.983 3.300 -3.010
2 HB THR 41 HB THR 41 -9.413 3.672 -1.252
3 HG1 THR 41 HG1 THR 41 -9.241 2.962 -4.021
4 HG22 THR 41 HG21 THR 41 -8.362 5.229 -3.631
5 HG21 THR 41 HG22 THR 41 -8.239 5.724 -1.943
6 HG23 THR 41 HG23 THR 41 -9.820 5.609 -2.713
7 H THR 41 HN THR 41 -8.369 1.330 -1.313
No H/Q in entry = 7
In of MODEL 3
1 HA ILE 42 HA ILE 42 -4.876 4.204 0.810
2 HB ILE 42 HB ILE 42 -3.874 6.447 -0.969
3 HG12 ILE 42 HG12 ILE 42 -2.759 3.692 -0.510
4 HG22 ILE 42 HG21 ILE 42 -2.712 5.145 1.515
5 HG21 ILE 42 HG22 ILE 42 -3.434 6.743 1.446
6 HG23 ILE 42 HG23 ILE 42 -1.933 6.418 0.574
7 HD11 ILE 42 HD11 ILE 42 -1.688 5.842 -2.266
8 HD13 ILE 42 HD12 ILE 42 -1.138 4.159 -2.172
9 HD12 ILE 42 HD13 ILE 42 -0.979 5.217 -0.771
10 H ILE 42 HN ILE 42 -5.515 4.622 -1.964
11 HG13 ILE 42 HG11 ILE 42 -3.515 4.237 -2.002
No H/Q in entry = 11
In of MODEL 3
1 HA ILE 43 HA ILE 43 -7.253 7.653 2.098
2 HB ILE 43 HB ILE 43 -8.257 7.207 4.341
3 HG12 ILE 43 HG12 ILE 43 -6.340 5.499 4.754
4 HG23 ILE 43 HG21 ILE 43 -9.597 6.796 2.422
5 HG22 ILE 43 HG22 ILE 43 -9.793 5.438 3.558
6 HG21 ILE 43 HG23 ILE 43 -8.784 5.250 2.133
7 HD11 ILE 43 HD11 ILE 43 -8.129 3.883 3.226
8 HD13 ILE 43 HD12 ILE 43 -7.559 3.194 4.733
9 HD12 ILE 43 HD13 ILE 43 -6.400 3.761 3.523
10 H ILE 43 HN ILE 43 -5.631 5.220 2.515
11 HG13 ILE 43 HG11 ILE 43 -7.859 5.203 5.555
No H/Q in entry = 11
In of MODEL 3
1 HA ASP 44 HA ASP 44 -4.020 9.068 4.758
2 HB2 ASP 44 HB2 ASP 44 -5.376 7.725 6.608
3 H ASP 44 HN ASP 44 -4.554 6.378 3.913
4 HB3 ASP 44 HB1 ASP 44 -3.868 6.886 6.829
No H/Q in entry = 4
In of MODEL 3
1 HA GLN 45 HA GLN 45 -0.158 6.817 4.708
2 HB2 GLN 45 HB2 GLN 45 1.215 8.113 3.202
3 HG2 GLN 45 HG2 GLN 45 -0.793 10.320 3.559
4 HE21 GLN 45 HE21 GLN 45 2.371 10.379 2.151
5 HE22 GLN 45 HE22 GLN 45 1.863 10.834 0.563
6 H GLN 45 HN GLN 45 -1.696 9.145 5.512
7 HB3 GLN 45 HB1 GLN 45 -0.450 8.012 2.640
8 HG3 GLN 45 HG1 GLN 45 0.935 10.377 3.896
No H/Q in entry = 8
In of MODEL 3
1 HA THR 46 HA THR 46 2.659 8.962 7.222
2 HB THR 46 HB THR 46 3.714 7.370 8.839
3 HG1 THR 46 HG1 THR 46 2.443 5.171 8.523
4 HG21 THR 46 HG21 THR 46 1.495 8.263 9.382
5 HG23 THR 46 HG22 THR 46 1.688 6.620 9.994
6 HG22 THR 46 HG23 THR 46 0.734 6.905 8.547
7 H THR 46 HN THR 46 1.783 6.649 5.714
No H/Q in entry = 7
In of MODEL 3
1 HA SER 47 HA SER 47 6.402 8.408 5.107
2 HB2 SER 47 HB2 SER 47 7.799 8.066 7.763
3 HG SER 47 HG SER 47 7.536 10.573 6.633
4 H SER 47 HN SER 47 5.268 8.249 7.720
5 HB3 SER 47 HB1 SER 47 8.468 8.721 6.267
No H/Q in entry = 5
In of MODEL 3
1 HA ASP 48 HA ASP 48 7.524 4.048 5.976
2 HB2 ASP 48 HB2 ASP 48 6.172 3.738 8.659
3 H ASP 48 HN ASP 48 5.659 5.904 7.305
4 HB3 ASP 48 HB1 ASP 48 7.139 2.518 7.840
No H/Q in entry = 4
In of MODEL 3
1 HA GLN 49 HA GLN 49 3.540 2.104 5.257
2 HB2 GLN 49 HB2 GLN 49 2.304 2.938 7.879
3 HG2 GLN 49 HG2 GLN 49 3.712 0.383 7.194
4 HE21 GLN 49 HE21 GLN 49 2.231 -0.905 8.239
5 HE22 GLN 49 HE22 GLN 49 1.971 -0.824 9.934
6 H GLN 49 HN GLN 49 4.119 4.554 6.754
7 HB3 GLN 49 HB1 GLN 49 1.709 1.637 6.861
8 HG3 GLN 49 HG1 GLN 49 4.474 1.717 8.061
No H/Q in entry = 8
In of MODEL 3
1 HA TYR 50 HA TYR 50 0.084 4.649 4.213
2 HB2 TYR 50 HB2 TYR 50 0.519 2.566 2.058
3 HD1 TYR 50 HD1 TYR 50 0.318 6.163 1.731
4 HD2 TYR 50 HD2 TYR 50 3.043 2.869 1.889
5 HE1 TYR 50 HE1 TYR 50 2.150 7.625 1.017
6 HE2 TYR 50 HE2 TYR 50 4.836 4.279 1.189
7 HH TYR 50 HH TYR 50 4.717 7.615 1.247
8 H TYR 50 HN TYR 50 1.390 2.034 4.448
9 HB3 TYR 50 HB1 TYR 50 -0.549 3.952 1.881
No H/Q in entry = 9
In of MODEL 3
1 HA LEU 51 HA LEU 51 -3.171 2.167 5.625
2 HB2 LEU 51 HB2 LEU 51 -3.445 4.411 6.864
3 HG LEU 51 HG LEU 51 -6.051 3.162 6.043
4 HD12 LEU 51 HD11 LEU 51 -5.883 1.926 8.149
5 HD11 LEU 51 HD12 LEU 51 -4.236 2.548 8.346
6 HD13 LEU 51 HD13 LEU 51 -4.628 1.500 6.985
7 HD21 LEU 51 HD21 LEU 51 -5.346 4.923 8.386
8 HD23 LEU 51 HD22 LEU 51 -6.896 4.109 8.126
9 HD22 LEU 51 HD23 LEU 51 -6.362 5.350 7.002
10 H LEU 51 HN LEU 51 -2.033 4.647 4.643
11 HB3 LEU 51 HB1 LEU 51 -4.435 4.914 5.529
No H/Q in entry = 11
In of MODEL 3
1 HA ILE 52 HA ILE 52 -5.344 2.236 1.832
2 HB ILE 52 HB ILE 52 -4.692 -0.705 2.088
3 HG12 ILE 52 HG12 ILE 52 -2.635 0.498 2.542
4 HG23 ILE 52 HG21 ILE 52 -4.635 -0.625 -0.355
5 HG22 ILE 52 HG22 ILE 52 -4.938 1.100 -0.320
6 HG21 ILE 52 HG23 ILE 52 -6.182 -0.021 0.247
7 HD11 ILE 52 HD11 ILE 52 -3.238 2.644 1.484
8 HD13 ILE 52 HD12 ILE 52 -2.997 1.863 -0.091
9 HD12 ILE 52 HD13 ILE 52 -1.635 2.065 1.025
10 H ILE 52 HN ILE 52 -4.218 0.946 4.225
11 HG13 ILE 52 HG11 ILE 52 -2.553 -0.226 0.947
No H/Q in entry = 11
In of MODEL 3
1 HA ARG 53 HA ARG 53 -9.039 0.357 3.209
2 HB2 ARG 53 HB2 ARG 53 -9.581 2.784 3.430
3 HG2 ARG 53 HG2 ARG 53 -11.829 1.430 2.004
4 HD2 ARG 53 HD2 ARG 53 -11.665 3.518 4.165
5 HE ARG 53 HE ARG 53 -14.050 2.479 2.823
6 HH11 ARG 53 HH11 ARG 53 -12.475 3.860 5.705
7 HH12 ARG 53 HH12 ARG 53 -13.894 3.959 6.619
8 HH21 ARG 53 HH21 ARG 53 -16.036 2.712 4.103
9 HH22 ARG 53 HH22 ARG 53 -15.942 3.325 5.706
10 H ARG 53 HN ARG 53 -7.472 2.149 1.516
11 HB3 ARG 53 HB1 ARG 53 -9.919 2.841 1.710
12 HG3 ARG 53 HG1 ARG 53 -11.411 1.150 3.697
13 HD3 ARG 53 HD1 ARG 53 -12.068 3.813 2.475
No H/Q in entry = 13
In of MODEL 3
1 HA PHE 54 HA PHE 54 -9.507 -1.572 -0.615
2 HB2 PHE 54 HB2 PHE 54 -10.261 -3.573 1.511
3 HD1 PHE 54 HD1 PHE 54 -8.335 -2.987 2.978
4 HD2 PHE 54 HD2 PHE 54 -7.766 -3.949 -1.127
5 HE1 PHE 54 HE1 PHE 54 -5.904 -3.197 3.362
6 HE2 PHE 54 HE2 PHE 54 -5.357 -4.179 -0.742
7 HZ PHE 54 HZ PHE 54 -4.420 -3.795 1.497
8 H PHE 54 HN PHE 54 -9.662 -1.307 2.248
9 HB3 PHE 54 HB1 PHE 54 -9.970 -3.944 -0.182
No H/Q in entry = 9
In of MODEL 3
1 HA ASP 55 HA ASP 55 -13.614 -1.325 -1.707
2 HB2 ASP 55 HB2 ASP 55 -12.897 -2.850 -3.530
3 H ASP 55 HN ASP 55 -11.422 -3.096 -1.494
4 HB3 ASP 55 HB1 ASP 55 -13.406 -4.223 -2.566
No H/Q in entry = 4
In of MODEL 3
1 HA ASP 56 HA ASP 56 -15.637 -4.231 1.334
2 HB2 ASP 56 HB2 ASP 56 -14.499 -5.837 2.952
3 H ASP 56 HN ASP 56 -12.953 -3.982 0.294
4 HB3 ASP 56 HB1 ASP 56 -14.486 -6.291 1.257
No H/Q in entry = 4
In of MODEL 3
1 HA GLN 57 HA GLN 57 -13.435 -0.073 2.971
2 HB2 GLN 57 HB2 GLN 57 -15.582 -1.392 4.616
3 HG2 GLN 57 HG2 GLN 57 -15.843 0.722 2.496
4 HE21 GLN 57 HE21 GLN 57 -18.390 -0.517 1.935
5 HE22 GLN 57 HE22 GLN 57 -19.475 0.001 3.164
6 H GLN 57 HN GLN 57 -13.535 -1.889 1.668
7 HB3 GLN 57 HB1 GLN 57 -15.081 0.286 4.754
8 HG3 GLN 57 HG1 GLN 57 -16.274 -0.976 2.304
No H/Q in entry = 8
In of MODEL 3
1 HA SER 58 HA SER 58 -11.503 -2.299 6.559
2 HB2 SER 58 HB2 SER 58 -10.206 -4.211 4.598
3 HG SER 58 HG SER 58 -11.980 -5.208 4.712
4 H SER 58 HN SER 58 -12.218 -2.878 3.856
5 HB3 SER 58 HB1 SER 58 -10.079 -4.257 6.356
No H/Q in entry = 5
In of MODEL 3
1 HA GLU 59 HA GLU 59 -7.988 -0.011 5.222
2 HB2 GLU 59 HB2 GLU 59 -8.622 0.942 8.018
3 HG2 GLU 59 HG2 GLU 59 -9.642 1.982 5.380
4 H GLU 59 HN GLU 59 -9.635 -1.305 7.278
5 HB3 GLU 59 HB1 GLU 59 -7.672 1.774 6.789
6 HG3 GLU 59 HG1 GLU 59 -10.596 1.110 6.574
No H/Q in entry = 6
In of MODEL 3
1 HA GLN 60 HA GLN 60 -4.840 -1.769 7.791
2 HB2 GLN 60 HB2 GLN 60 -5.577 -3.427 5.950
3 HG2 GLN 60 HG2 GLN 60 -3.506 -4.810 6.107
4 HE21 GLN 60 HE21 GLN 60 -2.568 -4.630 8.901
5 HE22 GLN 60 HE22 GLN 60 -3.908 -5.082 9.875
6 H GLN 60 HN GLN 60 -5.905 -0.550 5.313
7 HB3 GLN 60 HB1 GLN 60 -4.199 -2.822 5.044
8 HG3 GLN 60 HG1 GLN 60 -2.769 -3.481 7.004
No H/Q in entry = 8
In of MODEL 3
1 HA TRP 61 HA TRP 61 -1.495 0.815 6.442
2 HB2 TRP 61 HB2 TRP 61 -0.707 -0.238 9.169
3 HD1 TRP 61 HD1 TRP 61 -2.587 0.825 10.596
4 HE1 TRP 61 HE1 TRP 61 -3.409 3.236 10.973
5 HE3 TRP 61 HE3 TRP 61 0.040 3.128 6.910
6 HZ2 TRP 61 HZ2 TRP 61 -2.980 5.799 9.795
7 HZ3 TRP 61 HZ3 TRP 61 -0.229 5.553 6.593
8 HH2 TRP 61 HH2 TRP 61 -1.682 6.836 7.976
9 H TRP 61 HN TRP 61 -2.662 -1.220 8.198
10 HB3 TRP 61 HB1 TRP 61 0.320 0.845 8.254
No H/Q in entry = 10
In of MODEL 3
1 HA CYS 62 HA CYS 62 0.904 -2.479 4.956
2 HB2 CYS 62 HB2 CYS 62 -0.044 -0.955 2.538
3 HG CYS 62 HG CYS 62 -2.315 -1.423 4.130
4 H CYS 62 HN CYS 62 -0.407 0.140 4.820
5 HB3 CYS 62 HB1 CYS 62 0.493 -2.632 2.606
No H/Q in entry = 5
In of MODEL 3
1 HA GLU 63 HA GLU 63 4.702 -0.492 4.138
2 HB2 GLU 63 HB2 GLU 63 5.130 -3.216 2.932
3 HG2 GLU 63 HG2 GLU 63 6.193 -2.183 5.486
4 H GLU 63 HN GLU 63 2.932 -2.708 3.929
5 HB3 GLU 63 HB1 GLU 63 6.378 -2.036 3.225
6 HG3 GLU 63 HG1 GLU 63 4.640 -3.021 5.390
No H/Q in entry = 6
In of MODEL 3
1 HA PRO 64 HA PRO 64 4.418 1.109 0.020
2 HB2 PRO 64 HB2 PRO 64 7.303 1.522 0.022
3 HG2 PRO 64 HG2 PRO 64 7.619 2.204 2.168
4 HD2 PRO 64 HD2 PRO 64 6.771 0.308 3.155
5 HB3 PRO 64 HB1 PRO 64 6.001 2.696 -0.023
6 HG3 PRO 64 HG1 PRO 64 6.049 3.005 2.224
7 HD3 PRO 64 HD1 PRO 64 5.356 1.261 3.507
No H/Q in entry = 7
In of MODEL 3
1 HA ASP 65 HA ASP 65 7.242 -2.075 -2.014
2 HB2 ASP 65 HB2 ASP 65 8.384 -4.084 -1.289
3 H ASP 65 HN ASP 65 6.823 -1.410 0.732
4 HB3 ASP 65 HB1 ASP 65 8.888 -2.756 -0.266
No H/Q in entry = 4
In of MODEL 3
1 HA LYS 66 HA LYS 66 3.757 -5.028 -1.318
2 HB2 LYS 66 HB2 LYS 66 2.512 -3.412 0.909
3 HG2 LYS 66 HG2 LYS 66 4.416 -4.650 1.694
4 HD2 LYS 66 HD2 LYS 66 3.006 -7.016 0.493
5 HE2 LYS 66 HE2 LYS 66 3.842 -7.539 2.670
6 HZ1 LYS 66 HZ1 LYS 66 6.388 -6.380 1.661
7 HZ3 LYS 66 HZ2 LYS 66 6.370 -7.518 2.892
8 HZ2 LYS 66 HZ3 LYS 66 5.613 -6.057 3.133
9 H LYS 66 HN LYS 66 4.665 -2.635 0.066
10 HB3 LYS 66 HB1 LYS 66 1.795 -4.863 0.226
11 HG3 LYS 66 HG1 LYS 66 2.910 -5.335 2.322
12 HD3 LYS 66 HD1 LYS 66 4.578 -6.364 0.033
13 HE3 LYS 66 HE1 LYS 66 4.775 -8.351 1.411
No H/Q in entry = 13
In of MODEL 3
1 HA LEU 67 HA LEU 67 0.942 -1.646 -2.889
2 HB2 LEU 67 HB2 LEU 67 2.887 0.483 -2.068
3 HG LEU 67 HG LEU 67 0.928 -0.762 -0.514
4 HD13 LEU 67 HD11 LEU 67 2.744 0.442 0.391
5 HD12 LEU 67 HD12 LEU 67 1.246 1.185 0.942
6 HD11 LEU 67 HD13 LEU 67 2.192 1.953 -0.352
7 HD21 LEU 67 HD21 LEU 67 -0.678 0.360 -1.937
8 HD23 LEU 67 HD22 LEU 67 -0.014 1.916 -1.412
9 HD22 LEU 67 HD23 LEU 67 -0.759 0.815 -0.244
10 H LEU 67 HN LEU 67 3.494 -1.695 -1.496
11 HB3 LEU 67 HB1 LEU 67 1.396 0.774 -2.927
No H/Q in entry = 11
In of MODEL 3
1 HA ARG 68 HA ARG 68 3.156 -0.774 -6.589
2 HB2 ARG 68 HB2 ARG 68 1.147 -2.931 -7.302
3 HG2 ARG 68 HG2 ARG 68 2.614 -3.679 -5.491
4 HD2 ARG 68 HD2 ARG 68 4.916 -3.447 -7.425
5 HE ARG 68 HE ARG 68 4.998 -3.741 -4.512
6 HH11 ARG 68 HH11 ARG 68 5.890 -4.986 -7.702
7 HH12 ARG 68 HH12 ARG 68 6.995 -6.136 -7.093
8 HH21 ARG 68 HH21 ARG 68 6.519 -5.268 -3.698
9 HH22 ARG 68 HH22 ARG 68 7.382 -6.299 -4.754
10 H ARG 68 HN ARG 68 0.771 -1.465 -5.000
11 HB3 ARG 68 HB1 ARG 68 2.559 -2.475 -8.245
12 HG3 ARG 68 HG1 ARG 68 2.874 -4.568 -6.988
13 HD3 ARG 68 HD1 ARG 68 4.573 -2.199 -6.229
No H/Q in entry = 13
In of MODEL 3
1 HA LYS 69 HA LYS 69 0.309 2.037 -8.264
2 HB2 LYS 69 HB2 LYS 69 2.684 2.128 -10.130
3 HG2 LYS 69 HG2 LYS 69 2.875 4.523 -9.261
4 HD2 LYS 69 HD2 LYS 69 3.206 2.583 -7.004
5 HE2 LYS 69 HE2 LYS 69 5.065 3.863 -6.414
6 HZ1 LYS 69 HZ1 LYS 69 2.962 5.184 -6.080
7 HZ3 LYS 69 HZ2 LYS 69 3.335 6.018 -7.495
8 HZ2 LYS 69 HZ3 LYS 69 4.372 6.071 -6.189
9 H LYS 69 HN LYS 69 2.767 0.625 -8.192
10 HB3 LYS 69 HB1 LYS 69 1.272 3.132 -10.335
11 HG3 LYS 69 HG1 LYS 69 1.731 4.044 -8.043
12 HD3 LYS 69 HD1 LYS 69 4.255 2.498 -8.411
13 HE3 LYS 69 HE1 LYS 69 5.185 4.606 -8.009
No H/Q in entry = 13
In of MODEL 3
1 HA LEU 70 HA LEU 70 -1.631 -0.469 -11.224
2 HB2 LEU 70 HB2 LEU 70 -3.338 1.993 -11.485
3 HG LEU 70 HG LEU 70 -3.498 1.533 -9.177
4 HD12 LEU 70 HD11 LEU 70 -5.741 0.181 -10.601
5 HD11 LEU 70 HD12 LEU 70 -5.573 1.930 -10.357
6 HD13 LEU 70 HD13 LEU 70 -5.784 0.845 -8.969
7 HD23 LEU 70 HD21 LEU 70 -3.980 -1.346 -9.886
8 HD22 LEU 70 HD22 LEU 70 -4.003 -0.636 -8.277
9 HD21 LEU 70 HD23 LEU 70 -2.492 -0.701 -9.190
10 H LEU 70 HN LEU 70 -1.266 2.054 -9.875
11 HB3 LEU 70 HB1 LEU 70 -3.777 0.361 -11.927
No H/Q in entry = 11
In of MODEL 3
1 HA3 GLY 71 HA2 GLY 71 -0.845 2.220 -14.885
2 H GLY 71 HN GLY 71 -0.489 2.658 -12.040
3 HA2 GLY 71 HA1 GLY 71 -0.239 3.676 -14.116
No H/Q in entry = 3
In of MODEL 3
1 HA3 GLY 72 HA2 GLY 72 3.683 1.483 -14.146
2 H GLY 72 HN GLY 72 1.921 3.617 -13.259
3 HA2 GLY 72 HA1 GLY 72 3.822 2.940 -15.106
No H/Q in entry = 3
In of MODEL 3
1 HA3 GLY 73 HA2 GLY 73 5.068 3.878 -10.342
2 H GLY 73 HN GLY 73 3.202 4.229 -12.166
3 HA2 GLY 73 HA1 GLY 73 6.090 4.453 -11.652
No H/Q in entry = 3
In of MODEL 3
1 HA SER 74 HA SER 74 5.069 8.563 -10.654
2 HB2 SER 74 HB2 SER 74 4.652 8.782 -13.649
3 HG SER 74 HG SER 74 7.087 9.507 -12.672
4 H SER 74 HN SER 74 5.442 6.573 -12.629
5 HB3 SER 74 HB1 SER 74 5.091 10.086 -12.543
No H/Q in entry = 5
In of MODEL 3
1 HA SER 75 HA SER 75 0.735 7.235 -11.318
2 HB2 SER 75 HB2 SER 75 0.845 9.161 -13.050
3 HG SER 75 HG SER 75 -1.232 7.371 -12.702
4 H SER 75 HN SER 75 3.072 6.813 -12.852
5 HB3 SER 75 HB1 SER 75 0.743 7.914 -14.286
No H/Q in entry = 5
In of MODEL 4
1 H1 GLY 7 HT3 GLY 7 25.422 6.948 2.816
2 H2 GLY 7 HT2 GLY 7 26.297 5.515 2.583
3 H3 GLY 7 HT1 GLY 7 26.267 6.730 1.384
4 HA3 GLY 7 HA1 GLY 7 24.804 4.975 0.732
5 HA2 GLY 7 HA2 GLY 7 23.960 5.140 2.270
No H/Q in entry = 5
In of MODEL 4
1 HA ALA 8 HA ALA 8 21.551 8.048 0.131
2 HB1 ALA 8 HB1 ALA 8 22.927 7.390 -2.482
3 HB2 ALA 8 HB2 ALA 8 23.488 8.575 -1.307
4 HB3 ALA 8 HB3 ALA 8 21.959 8.824 -2.149
5 H ALA 8 HN ALA 8 22.672 5.419 -0.146
No H/Q in entry = 5
In of MODEL 4
1 HA MET 9 HA MET 9 20.354 3.628 -2.598
2 HB2 MET 9 HB2 MET 9 19.059 3.969 -0.447
3 HG2 MET 9 HG2 MET 9 17.246 3.675 -2.831
4 HE2 MET 9 HE1 MET 9 15.820 1.035 -1.777
5 HE1 MET 9 HE2 MET 9 14.986 2.356 -2.592
6 HE3 MET 9 HE3 MET 9 14.358 1.722 -1.070
7 H MET 9 HN MET 9 21.839 5.088 -1.731
8 HB3 MET 9 HB1 MET 9 18.190 5.281 -1.216
9 HG3 MET 9 HG1 MET 9 18.109 2.378 -2.016
No H/Q in entry = 9
In of MODEL 4
1 HA ALA 10 HA ALA 10 19.113 6.938 -5.562
2 HB1 ALA 10 HB1 ALA 10 22.059 7.610 -5.572
3 HB2 ALA 10 HB2 ALA 10 20.793 8.539 -4.771
4 HB3 ALA 10 HB3 ALA 10 20.818 8.418 -6.531
5 H ALA 10 HN ALA 10 21.263 6.015 -3.856
No H/Q in entry = 5
In of MODEL 4
1 HA PRO 11 HA PRO 11 20.244 3.480 -8.245
2 HB2 PRO 11 HB2 PRO 11 17.879 4.113 -9.805
3 HG2 PRO 11 HG2 PRO 11 16.348 4.645 -8.173
4 HD2 PRO 11 HD2 PRO 11 17.743 6.454 -7.816
5 HB3 PRO 11 HB1 PRO 11 18.184 2.704 -8.789
6 HG3 PRO 11 HG1 PRO 11 17.172 3.645 -6.966
7 HD3 PRO 11 HD1 PRO 11 17.778 5.710 -6.199
No H/Q in entry = 7
In of MODEL 4
1 HA PRO 12 HA PRO 12 22.238 5.760 -11.623
2 HB2 PRO 12 HB2 PRO 12 22.177 2.969 -12.693
3 HG2 PRO 12 HG2 PRO 12 23.471 2.127 -10.920
4 HD2 PRO 12 HD2 PRO 12 21.330 2.292 -10.016
5 HB3 PRO 12 HB1 PRO 12 23.526 4.113 -12.650
6 HG3 PRO 12 HG1 PRO 12 23.916 3.757 -10.379
7 HD3 PRO 12 HD1 PRO 12 22.211 3.349 -8.894
No H/Q in entry = 7
In of MODEL 4
1 HA VAL 13 HA VAL 13 18.912 4.602 -14.553
2 HB VAL 13 HB VAL 13 17.881 2.019 -13.321
3 HG11 VAL 13 HG11 VAL 13 16.238 3.193 -14.711
4 HG13 VAL 13 HG12 VAL 13 16.758 1.672 -15.434
5 HG12 VAL 13 HG13 VAL 13 17.387 3.197 -16.055
6 HG23 VAL 13 HG21 VAL 13 19.744 2.410 -15.663
7 HG22 VAL 13 HG22 VAL 13 19.112 0.863 -15.091
8 HG21 VAL 13 HG23 VAL 13 20.204 1.808 -14.074
9 H VAL 13 HN VAL 13 19.865 3.177 -12.220
No H/Q in entry = 9
In of MODEL 4
1 HA ALA 14 HA ALA 14 16.182 6.329 -11.587
2 HB2 ALA 14 HB1 ALA 14 16.634 8.565 -13.551
3 HB1 ALA 14 HB2 ALA 14 17.582 8.277 -12.089
4 HB3 ALA 14 HB3 ALA 14 15.870 8.702 -11.967
5 H ALA 14 HN ALA 14 17.803 6.355 -13.964
No H/Q in entry = 5
In of MODEL 4
1 HA ALA 15 HA ALA 15 12.823 5.724 -14.284
2 HB3 ALA 15 HB1 ALA 15 13.853 3.747 -15.316
3 HB1 ALA 15 HB2 ALA 15 12.183 3.404 -14.860
4 HB2 ALA 15 HB3 ALA 15 13.511 2.797 -13.874
5 H ALA 15 HN ALA 15 15.050 4.617 -12.784
No H/Q in entry = 5
In of MODEL 4
1 HA PRO 16 HA PRO 16 10.675 4.378 -10.331
2 HB2 PRO 16 HB2 PRO 16 11.878 3.009 -8.389
3 HG2 PRO 16 HG2 PRO 16 14.066 3.030 -9.145
4 HD2 PRO 16 HD2 PRO 16 14.542 3.603 -11.336
5 HB3 PRO 16 HB1 PRO 16 11.291 2.160 -9.826
6 HG3 PRO 16 HG1 PRO 16 13.526 1.492 -9.841
7 HD3 PRO 16 HD1 PRO 16 13.460 2.350 -11.967
No H/Q in entry = 7
In of MODEL 4
1 HA SER 17 HA SER 17 12.697 7.547 -8.070
2 HB2 SER 17 HB2 SER 17 10.179 7.237 -6.442
3 HG SER 17 HG SER 17 10.608 8.088 -9.009
4 H SER 17 HN SER 17 10.595 5.553 -8.290
5 HB3 SER 17 HB1 SER 17 11.176 8.682 -6.606
No H/Q in entry = 5
In of MODEL 4
1 HA PRO 18 HA PRO 18 14.389 5.302 -4.518
2 HB2 PRO 18 HB2 PRO 18 15.701 7.470 -3.382
3 HG2 PRO 18 HG2 PRO 18 15.165 9.132 -4.875
4 HD2 PRO 18 HD2 PRO 18 14.028 8.669 -6.811
5 HB3 PRO 18 HB1 PRO 18 16.413 6.442 -4.624
6 HG3 PRO 18 HG1 PRO 18 16.530 8.442 -5.767
7 HD3 PRO 18 HD1 PRO 18 15.162 7.385 -7.286
No H/Q in entry = 7
In of MODEL 4
1 HA ALA 19 HA ALA 19 11.783 5.238 -1.044
2 HB2 ALA 19 HB1 ALA 19 11.557 7.320 0.219
3 HB3 ALA 19 HB2 ALA 19 12.460 8.188 -1.026
4 HB1 ALA 19 HB3 ALA 19 13.263 6.950 -0.054
5 H ALA 19 HN ALA 19 13.414 5.078 -2.567
No H/Q in entry = 5
In of MODEL 4
1 HA VAL 20 HA VAL 20 8.835 6.411 -4.174
2 HB VAL 20 HB VAL 20 7.163 4.581 -4.511
3 HG13 VAL 20 HG11 VAL 20 8.670 3.074 -5.708
4 HG12 VAL 20 HG12 VAL 20 10.047 3.799 -4.865
5 HG11 VAL 20 HG13 VAL 20 9.074 4.771 -5.973
6 HG23 VAL 20 HG21 VAL 20 8.976 3.000 -2.683
7 HG22 VAL 20 HG22 VAL 20 7.633 2.341 -3.624
8 HG21 VAL 20 HG23 VAL 20 7.320 3.493 -2.331
9 H VAL 20 HN VAL 20 10.271 4.609 -2.543
No H/Q in entry = 9
In of MODEL 4
1 HA THR 21 HA THR 21 5.636 7.132 -1.354
2 HB THR 21 HB THR 21 7.144 9.145 -1.428
3 HG1 THR 21 HG1 THR 21 5.810 9.993 -0.139
4 HG22 THR 21 HG21 THR 21 5.187 10.085 -3.507
5 HG21 THR 21 HG22 THR 21 6.869 9.659 -3.780
6 HG23 THR 21 HG23 THR 21 6.469 11.078 -2.790
7 H THR 21 HN THR 21 6.898 7.388 -3.952
No H/Q in entry = 7
In of MODEL 4
1 HA TYR 22 HA TYR 22 2.102 7.708 -3.931
2 HB2 TYR 22 HB2 TYR 22 1.413 6.198 -1.398
3 HD1 TYR 22 HD1 TYR 22 0.809 4.617 -4.542
4 HD2 TYR 22 HD2 TYR 22 3.791 5.261 -1.577
5 HE1 TYR 22 HE1 TYR 22 2.044 2.716 -5.389
6 HE2 TYR 22 HE2 TYR 22 5.063 3.391 -2.412
7 HH TYR 22 HH TYR 22 4.662 1.317 -3.694
8 H TYR 22 HN TYR 22 3.457 7.970 -1.340
9 HB3 TYR 22 HB1 TYR 22 0.430 6.219 -2.854
No H/Q in entry = 9
In of MODEL 4
1 HA ALA 23 HA ALA 23 -0.391 10.623 -1.823
2 HB3 ALA 23 HB1 ALA 23 -1.586 10.434 -4.586
3 HB1 ALA 23 HB2 ALA 23 -0.217 11.447 -4.128
4 HB2 ALA 23 HB3 ALA 23 -1.821 11.772 -3.463
5 H ALA 23 HN ALA 23 -0.102 8.526 -3.845
No H/Q in entry = 5
In of MODEL 4
1 HA LEU 24 HA LEU 24 -4.006 8.597 -0.490
2 HB2 LEU 24 HB2 LEU 24 -5.116 11.384 -0.060
3 HG LEU 24 HG LEU 24 -3.031 11.338 1.109
4 HD13 LEU 24 HD11 LEU 24 -3.817 11.633 3.395
5 HD12 LEU 24 HD12 LEU 24 -5.340 10.871 2.943
6 HD11 LEU 24 HD13 LEU 24 -4.872 12.408 2.208
7 HD22 LEU 24 HD21 LEU 24 -2.589 8.974 1.207
8 HD21 LEU 24 HD22 LEU 24 -3.955 8.735 2.291
9 HD23 LEU 24 HD23 LEU 24 -2.547 9.649 2.836
10 H LEU 24 HN LEU 24 -2.541 10.981 -0.987
11 HB3 LEU 24 HB1 LEU 24 -5.606 9.898 0.683
No H/Q in entry = 11
In of MODEL 4
1 HA GLN 25 HA GLN 25 -7.953 7.797 -2.359
2 HB2 GLN 25 HB2 GLN 25 -7.301 10.451 -3.624
3 HG2 GLN 25 HG2 GLN 25 -9.051 9.820 -1.279
4 HE21 GLN 25 HE21 GLN 25 -8.081 12.914 -2.514
5 HE22 GLN 25 HE22 GLN 25 -9.667 13.508 -2.844
6 H GLN 25 HN GLN 25 -6.241 8.180 -0.999
7 HB3 GLN 25 HB1 GLN 25 -8.812 9.573 -3.839
8 HG3 GLN 25 HG1 GLN 25 -7.751 10.983 -1.425
No H/Q in entry = 8
In of MODEL 4
1 HA GLU 26 HA GLU 26 -5.260 6.996 -5.984
2 HB2 GLU 26 HB2 GLU 26 -3.233 7.918 -4.921
3 HG2 GLU 26 HG2 GLU 26 -1.502 6.442 -5.744
4 H GLU 26 HN GLU 26 -5.113 7.309 -3.092
5 HB3 GLU 26 HB1 GLU 26 -3.083 6.462 -3.962
6 HG3 GLU 26 HG1 GLU 26 -2.709 5.183 -6.018
No H/Q in entry = 6
In of MODEL 4
1 HA ASP 27 HA ASP 27 -6.170 2.777 -5.059
2 HB2 ASP 27 HB2 ASP 27 -6.805 3.042 -8.026
3 H ASP 27 HN ASP 27 -5.827 5.071 -6.827
4 HB3 ASP 27 HB1 ASP 27 -7.127 1.641 -7.035
No H/Q in entry = 4
In of MODEL 4
1 HA VAL 28 HA VAL 28 -2.694 0.813 -6.894
2 HB VAL 28 HB VAL 28 -1.085 0.624 -4.815
3 HG13 VAL 28 HG11 VAL 28 -0.570 2.988 -4.901
4 HG12 VAL 28 HG12 VAL 28 -2.142 3.307 -5.636
5 HG11 VAL 28 HG13 VAL 28 -0.919 2.398 -6.540
6 HG22 VAL 28 HG21 VAL 28 -2.827 0.772 -3.120
7 HG21 VAL 28 HG22 VAL 28 -3.284 2.362 -3.720
8 HG23 VAL 28 HG23 VAL 28 -1.692 2.119 -3.001
9 H VAL 28 HN VAL 28 -4.840 1.185 -4.936
No H/Q in entry = 9
In of MODEL 4
1 HA PHE 29 HA PHE 29 -3.336 -3.204 -5.307
2 HB2 PHE 29 HB2 PHE 29 -0.947 -3.540 -7.121
3 HD1 PHE 29 HD1 PHE 29 -3.967 -5.564 -6.596
4 HD2 PHE 29 HD2 PHE 29 -1.928 -2.824 -9.108
5 HE1 PHE 29 HE1 PHE 29 -5.631 -5.954 -8.360
6 HE2 PHE 29 HE2 PHE 29 -3.576 -3.198 -10.870
7 HZ PHE 29 HZ PHE 29 -5.427 -4.781 -10.515
8 H PHE 29 HN PHE 29 -1.562 -1.256 -6.545
9 HB3 PHE 29 HB1 PHE 29 -1.598 -4.897 -6.223
No H/Q in entry = 9
In of MODEL 4
1 HA ILE 30 HA ILE 30 -0.348 -3.755 -2.108
2 HB ILE 30 HB ILE 30 -3.180 -4.025 -1.096
3 HG12 ILE 30 HG12 ILE 30 -2.675 -2.052 0.203
4 HG22 ILE 30 HG21 ILE 30 -2.373 -4.161 1.232
5 HG21 ILE 30 HG22 ILE 30 -0.735 -4.401 0.627
6 HG23 ILE 30 HG23 ILE 30 -1.988 -5.591 0.276
7 HD11 ILE 30 HD11 ILE 30 -3.486 -1.650 -2.046
8 HD13 ILE 30 HD12 ILE 30 -1.805 -1.685 -2.603
9 HD12 ILE 30 HD13 ILE 30 -2.337 -0.408 -1.498
10 H ILE 30 HN ILE 30 -2.836 -4.402 -3.543
11 HG13 ILE 30 HG11 ILE 30 -1.013 -2.049 -0.382
No H/Q in entry = 11
In of MODEL 4
1 HA LYS 31 HA LYS 31 -0.154 -8.085 -2.086
2 HB2 LYS 31 HB2 LYS 31 1.925 -7.681 -3.079
3 HG2 LYS 31 HG2 LYS 31 2.473 -9.067 -0.479
4 HD2 LYS 31 HD2 LYS 31 3.858 -9.393 -3.104
5 HE2 LYS 31 HE2 LYS 31 4.423 -10.353 -0.326
6 HZ1 LYS 31 HZ1 LYS 31 6.439 -9.879 -1.669
7 HZ3 LYS 31 HZ2 LYS 31 5.883 -10.952 -2.856
8 HZ2 LYS 31 HZ3 LYS 31 6.252 -11.510 -1.318
9 H LYS 31 HN LYS 31 0.837 -5.384 -1.783
10 HB3 LYS 31 HB1 LYS 31 2.556 -6.901 -1.647
11 HG3 LYS 31 HG1 LYS 31 1.845 -9.820 -1.944
12 HD3 LYS 31 HD1 LYS 31 4.490 -8.390 -1.783
13 HE3 LYS 31 HE1 LYS 31 3.846 -11.321 -1.668
No H/Q in entry = 13
In of MODEL 4
1 HA CYS 32 HA CYS 32 -0.483 -8.485 2.183
2 HB2 CYS 32 HB2 CYS 32 -2.713 -9.291 1.321
3 HG CYS 32 HG CYS 32 -2.573 -11.857 3.347
4 H CYS 32 HN CYS 32 -0.820 -9.292 -0.590
5 HB3 CYS 32 HB1 CYS 32 -1.971 -10.849 0.987
No H/Q in entry = 5
In of MODEL 4
1 HA ASN 33 HA ASN 33 2.739 -11.278 3.119
2 HB2 ASN 33 HB2 ASN 33 1.838 -10.833 5.422
3 HD21 ASN 33 HD21 ASN 33 1.755 -13.316 6.967
4 HD22 ASN 33 HD22 ASN 33 3.349 -13.968 6.913
5 H ASN 33 HN ASN 33 0.175 -10.259 3.732
6 HB3 ASN 33 HB1 ASN 33 0.818 -12.255 5.218
No H/Q in entry = 6
In of MODEL 4
1 HA ASP 34 HA ASP 34 0.132 -15.220 2.214
2 HB2 ASP 34 HB2 ASP 34 -2.140 -13.462 1.318
3 H ASP 34 HN ASP 34 -0.378 -12.440 2.594
4 HB3 ASP 34 HB1 ASP 34 -2.123 -15.218 1.144
No H/Q in entry = 4
In of MODEL 4
1 HA3 GLY 35 HA2 GLY 35 2.139 -12.567 -1.635
2 H GLY 35 HN GLY 35 0.963 -12.534 0.350
3 HA2 GLY 35 HA1 GLY 35 1.730 -14.247 -1.863
No H/Q in entry = 3
In of MODEL 4
1 HA ARG 36 HA ARG 36 -1.744 -12.477 -4.029
2 HB2 ARG 36 HB2 ARG 36 -3.466 -12.387 -1.548
3 HG2 ARG 36 HG2 ARG 36 -4.775 -14.181 -2.650
4 HD2 ARG 36 HD2 ARG 36 -1.909 -15.003 -2.300
5 HE ARG 36 HE ARG 36 -4.215 -16.488 -2.727
6 HH11 ARG 36 HH11 ARG 36 -1.432 -16.494 -0.530
7 HH12 ARG 36 HH12 ARG 36 -1.669 -18.098 -0.022
8 HH21 ARG 36 HH21 ARG 36 -4.492 -18.709 -2.045
9 HH22 ARG 36 HH22 ARG 36 -3.436 -19.386 -0.886
10 H ARG 36 HN ARG 36 -1.055 -12.631 -1.192
11 HB3 ARG 36 HB1 ARG 36 -4.088 -11.957 -3.124
12 HG3 ARG 36 HG1 ARG 36 -3.538 -14.270 -3.892
13 HD3 ARG 36 HD1 ARG 36 -3.008 -14.689 -0.958
No H/Q in entry = 13
In of MODEL 4
1 HA PHE 37 HA PHE 37 -1.966 -8.169 -3.541
2 HB2 PHE 37 HB2 PHE 37 -1.983 -8.902 -6.426
3 HD1 PHE 37 HD1 PHE 37 -0.828 -5.902 -4.625
4 HD2 PHE 37 HD2 PHE 37 0.309 -9.531 -6.526
5 HE1 PHE 37 HE1 PHE 37 1.427 -5.187 -4.499
6 HE2 PHE 37 HE2 PHE 37 2.675 -8.836 -6.395
7 HZ PHE 37 HZ PHE 37 3.261 -6.659 -5.379
8 H PHE 37 HN PHE 37 -2.663 -10.633 -4.940
9 HB3 PHE 37 HB1 PHE 37 -2.439 -7.262 -5.986
No H/Q in entry = 9
In of MODEL 4
1 HA TYR 38 HA TYR 38 -6.197 -7.224 -3.961
2 HB2 TYR 38 HB2 TYR 38 -5.207 -6.310 -1.255
3 HD1 TYR 38 HD1 TYR 38 -8.245 -8.164 -1.747
4 HD2 TYR 38 HD2 TYR 38 -4.108 -8.474 -0.901
5 HE1 TYR 38 HE1 TYR 38 -8.604 -10.451 -0.945
6 HE2 TYR 38 HE2 TYR 38 -4.438 -10.784 -0.084
7 HH TYR 38 HH TYR 38 -7.293 -12.522 -0.653
8 H TYR 38 HN TYR 38 -3.461 -6.858 -2.959
9 HB3 TYR 38 HB1 TYR 38 -6.889 -6.231 -1.758
No H/Q in entry = 9
In of MODEL 4
1 HA LEU 39 HA LEU 39 -5.359 -3.106 -5.149
2 HB2 LEU 39 HB2 LEU 39 -6.828 -4.352 -6.989
3 HG LEU 39 HG LEU 39 -5.522 -2.362 -7.536
4 HD13 LEU 39 HD11 LEU 39 -6.943 -3.332 -9.241
5 HD12 LEU 39 HD12 LEU 39 -6.916 -1.571 -9.394
6 HD11 LEU 39 HD13 LEU 39 -8.312 -2.371 -8.668
7 HD22 LEU 39 HD21 LEU 39 -6.503 -0.215 -7.597
8 HD21 LEU 39 HD22 LEU 39 -6.384 -0.809 -5.931
9 HD23 LEU 39 HD23 LEU 39 -7.958 -0.796 -6.770
10 H LEU 39 HN LEU 39 -7.030 -5.475 -4.922
11 HB3 LEU 39 HB1 LEU 39 -8.097 -3.343 -6.344
No H/Q in entry = 11
In of MODEL 4
1 HA3 GLY 40 HA2 GLY 40 -8.353 -0.879 -2.963
2 H GLY 40 HN GLY 40 -5.710 -1.274 -3.961
3 HA2 GLY 40 HA1 GLY 40 -7.113 -1.040 -1.708
No H/Q in entry = 3
In of MODEL 4
1 HA THR 41 HA THR 41 -7.096 3.284 -3.154
2 HB THR 41 HB THR 41 -9.486 3.523 -1.309
3 HG1 THR 41 HG1 THR 41 -9.424 2.838 -4.109
4 HG22 THR 41 HG21 THR 41 -8.572 5.156 -3.689
5 HG21 THR 41 HG22 THR 41 -8.406 5.624 -1.998
6 HG23 THR 41 HG23 THR 41 -10.010 5.476 -2.720
7 H THR 41 HN THR 41 -8.405 1.208 -1.550
No H/Q in entry = 7
In of MODEL 4
1 HA ILE 42 HA ILE 42 -4.891 4.102 0.665
2 HB ILE 42 HB ILE 42 -3.952 6.422 -1.049
3 HG12 ILE 42 HG12 ILE 42 -2.807 3.645 -0.778
4 HG22 ILE 42 HG21 ILE 42 -2.712 5.031 1.343
5 HG21 ILE 42 HG22 ILE 42 -3.463 6.619 1.354
6 HG23 ILE 42 HG23 ILE 42 -1.976 6.357 0.438
7 HD13 ILE 42 HD11 ILE 42 -1.175 4.276 -2.420
8 HD12 ILE 42 HD12 ILE 42 -1.019 5.166 -0.909
9 HD11 ILE 42 HD13 ILE 42 -1.728 5.957 -2.322
10 H ILE 42 HN ILE 42 -5.582 4.544 -2.099
11 HG13 ILE 42 HG11 ILE 42 -3.552 4.309 -2.225
No H/Q in entry = 11
In of MODEL 4
1 HA ILE 43 HA ILE 43 -7.098 7.586 2.112
2 HB ILE 43 HB ILE 43 -8.037 7.144 4.386
3 HG12 ILE 43 HG12 ILE 43 -6.194 5.381 4.767
4 HG22 ILE 43 HG21 ILE 43 -9.677 5.490 3.663
5 HG21 ILE 43 HG22 ILE 43 -8.732 5.212 2.203
6 HG23 ILE 43 HG23 ILE 43 -9.446 6.808 2.507
7 HD11 ILE 43 HD11 ILE 43 -8.106 3.818 3.273
8 HD13 ILE 43 HD12 ILE 43 -7.333 3.079 4.659
9 HD12 ILE 43 HD13 ILE 43 -6.351 3.735 3.341
10 H ILE 43 HN ILE 43 -5.465 5.161 2.442
11 HG13 ILE 43 HG11 ILE 43 -7.729 5.095 5.538
No H/Q in entry = 11
In of MODEL 4
1 HA ASP 44 HA ASP 44 -3.773 8.842 4.720
2 HB2 ASP 44 HB2 ASP 44 -5.142 7.742 6.589
3 H ASP 44 HN ASP 44 -4.389 6.178 3.861
4 HB3 ASP 44 HB1 ASP 44 -3.797 6.634 6.779
No H/Q in entry = 4
In of MODEL 4
1 HA GLN 45 HA GLN 45 0.137 6.741 4.765
2 HB2 GLN 45 HB2 GLN 45 1.639 8.267 3.618
3 HG2 GLN 45 HG2 GLN 45 -0.594 10.287 3.803
4 HE21 GLN 45 HE21 GLN 45 0.551 9.139 1.373
5 HE22 GLN 45 HE22 GLN 45 1.325 10.421 0.554
6 H GLN 45 HN GLN 45 -1.565 8.957 5.590
7 HB3 GLN 45 HB1 GLN 45 0.063 8.133 2.841
8 HG3 GLN 45 HG1 GLN 45 0.977 10.412 4.593
No H/Q in entry = 8
In of MODEL 4
1 HA THR 46 HA THR 46 2.626 8.737 7.810
2 HB THR 46 HB THR 46 3.781 6.861 9.093
3 HG1 THR 46 HG1 THR 46 2.367 5.313 7.202
4 HG23 THR 46 HG21 THR 46 1.737 5.910 10.056
5 HG22 THR 46 HG22 THR 46 0.813 6.519 8.681
6 HG21 THR 46 HG23 THR 46 1.577 7.648 9.802
7 H THR 46 HN THR 46 2.109 6.704 5.781
No H/Q in entry = 7
In of MODEL 4
1 HA SER 47 HA SER 47 6.559 8.620 5.951
2 HB2 SER 47 HB2 SER 47 7.800 7.623 8.528
3 HG SER 47 HG SER 47 6.400 9.679 8.459
4 H SER 47 HN SER 47 5.273 7.857 8.388
5 HB3 SER 47 HB1 SER 47 8.622 8.478 7.229
No H/Q in entry = 5
In of MODEL 4
1 HA ASP 48 HA ASP 48 7.700 4.203 5.846
2 HB2 ASP 48 HB2 ASP 48 6.562 3.287 8.478
3 H ASP 48 HN ASP 48 5.878 5.662 7.644
4 HB3 ASP 48 HB1 ASP 48 7.609 2.357 7.409
No H/Q in entry = 4
In of MODEL 4
1 HA GLN 49 HA GLN 49 3.817 2.199 4.919
2 HB2 GLN 49 HB2 GLN 49 2.574 2.595 7.630
3 HG2 GLN 49 HG2 GLN 49 4.089 0.232 6.547
4 HE21 GLN 49 HE21 GLN 49 2.576 -1.301 7.228
5 HE22 GLN 49 HE22 GLN 49 2.233 -1.553 8.889
6 H GLN 49 HN GLN 49 4.326 4.432 6.758
7 HB3 GLN 49 HB1 GLN 49 1.960 1.466 6.442
8 HG3 GLN 49 HG1 GLN 49 4.700 1.409 7.706
No H/Q in entry = 8
In of MODEL 4
1 HA TYR 50 HA TYR 50 0.178 4.671 4.203
2 HB2 TYR 50 HB2 TYR 50 0.550 2.669 1.983
3 HD1 TYR 50 HD1 TYR 50 0.154 6.231 1.593
4 HD2 TYR 50 HD2 TYR 50 3.044 3.100 1.868
5 HE1 TYR 50 HE1 TYR 50 1.898 7.751 0.808
6 HE2 TYR 50 HE2 TYR 50 4.750 4.574 1.105
7 HH TYR 50 HH TYR 50 4.407 7.892 1.004
8 H TYR 50 HN TYR 50 1.547 2.081 4.264
9 HB3 TYR 50 HB1 TYR 50 -0.583 4.009 1.896
No H/Q in entry = 9
In of MODEL 4
1 HA LEU 51 HA LEU 51 -3.055 2.045 5.495
2 HB2 LEU 51 HB2 LEU 51 -3.313 4.258 6.795
3 HG LEU 51 HG LEU 51 -5.941 3.052 5.976
4 HD11 LEU 51 HD11 LEU 51 -4.105 2.360 8.239
5 HD13 LEU 51 HD12 LEU 51 -4.506 1.347 6.846
6 HD12 LEU 51 HD13 LEU 51 -5.747 1.750 8.032
7 HD21 LEU 51 HD21 LEU 51 -5.155 4.727 8.357
8 HD23 LEU 51 HD22 LEU 51 -6.717 3.945 8.090
9 HD22 LEU 51 HD23 LEU 51 -6.184 5.215 7.002
10 H LEU 51 HN LEU 51 -1.970 4.579 4.535
11 HB3 LEU 51 HB1 LEU 51 -4.310 4.785 5.471
No H/Q in entry = 11
In of MODEL 4
1 HA ILE 52 HA ILE 52 -5.280 2.197 1.737
2 HB ILE 52 HB ILE 52 -4.593 -0.746 1.936
3 HG12 ILE 52 HG12 ILE 52 -2.557 0.526 2.406
4 HG21 ILE 52 HG21 ILE 52 -6.111 -0.044 0.117
5 HG23 ILE 52 HG22 ILE 52 -4.561 -0.613 -0.505
6 HG22 ILE 52 HG23 ILE 52 -4.891 1.110 -0.441
7 HD12 ILE 52 HD11 ILE 52 -1.593 2.111 0.880
8 HD11 ILE 52 HD12 ILE 52 -3.218 2.654 1.315
9 HD13 ILE 52 HD13 ILE 52 -2.930 1.843 -0.234
10 H ILE 52 HN ILE 52 -4.138 0.873 4.103
11 HG13 ILE 52 HG11 ILE 52 -2.448 -0.208 0.817
No H/Q in entry = 11
In of MODEL 4
1 HA ARG 53 HA ARG 53 -8.987 0.317 3.106
2 HB2 ARG 53 HB2 ARG 53 -9.540 2.714 3.303
3 HG2 ARG 53 HG2 ARG 53 -11.825 1.696 1.719
4 HD2 ARG 53 HD2 ARG 53 -11.631 3.005 4.410
5 HE ARG 53 HE ARG 53 -13.869 2.706 2.585
6 HH11 ARG 53 HH11 ARG 53 -12.648 3.271 5.934
7 HH12 ARG 53 HH12 ARG 53 -14.194 3.492 6.568
8 HH21 ARG 53 HH21 ARG 53 -16.015 3.041 3.574
9 HH22 ARG 53 HH22 ARG 53 -16.144 3.352 5.234
10 H ARG 53 HN ARG 53 -7.414 1.999 1.321
11 HB3 ARG 53 HB1 ARG 53 -9.798 2.799 1.576
12 HG3 ARG 53 HG1 ARG 53 -11.427 0.957 3.275
13 HD3 ARG 53 HD1 ARG 53 -11.733 3.930 2.910
No H/Q in entry = 13
In of MODEL 4
1 HA PHE 54 HA PHE 54 -9.684 -1.753 -0.628
2 HB2 PHE 54 HB2 PHE 54 -10.242 -3.730 1.581
3 HD1 PHE 54 HD1 PHE 54 -7.832 -4.064 -1.162
4 HD2 PHE 54 HD2 PHE 54 -8.284 -3.012 2.939
5 HE1 PHE 54 HE1 PHE 54 -5.403 -4.169 -0.868
6 HE2 PHE 54 HE2 PHE 54 -5.845 -3.110 3.232
7 HZ PHE 54 HZ PHE 54 -4.400 -3.682 1.323
8 H PHE 54 HN PHE 54 -9.777 -1.375 2.251
9 HB3 PHE 54 HB1 PHE 54 -10.015 -4.130 -0.112
No H/Q in entry = 9
In of MODEL 4
1 HA ASP 55 HA ASP 55 -13.835 -1.794 -1.584
2 HB2 ASP 55 HB2 ASP 55 -13.435 -3.294 -3.356
3 H ASP 55 HN ASP 55 -11.571 -3.372 -1.377
4 HB3 ASP 55 HB1 ASP 55 -13.338 -4.680 -2.286
No H/Q in entry = 4
In of MODEL 4
1 HA ASP 56 HA ASP 56 -15.800 -4.381 1.725
2 HB2 ASP 56 HB2 ASP 56 -14.764 -5.874 3.480
3 H ASP 56 HN ASP 56 -13.099 -4.272 0.669
4 HB3 ASP 56 HB1 ASP 56 -14.620 -6.441 1.822
No H/Q in entry = 4
In of MODEL 4
1 HA GLN 57 HA GLN 57 -13.437 -0.166 2.943
2 HB2 GLN 57 HB2 GLN 57 -15.630 -1.187 4.732
3 HG2 GLN 57 HG2 GLN 57 -15.743 0.645 2.352
4 HE21 GLN 57 HE21 GLN 57 -17.729 1.518 1.898
5 HE22 GLN 57 HE22 GLN 57 -18.969 1.687 3.079
6 H GLN 57 HN GLN 57 -13.648 -2.078 1.834
7 HB3 GLN 57 HB1 GLN 57 -15.027 0.466 4.712
8 HG3 GLN 57 HG1 GLN 57 -16.415 -0.981 2.462
No H/Q in entry = 8
In of MODEL 4
1 HA SER 58 HA SER 58 -11.522 -2.121 6.658
2 HB2 SER 58 HB2 SER 58 -10.237 -4.184 4.870
3 HG SER 58 HG SER 58 -12.133 -4.944 5.033
4 H SER 58 HN SER 58 -12.277 -2.919 4.034
5 HB3 SER 58 HB1 SER 58 -10.077 -4.059 6.624
No H/Q in entry = 5
In of MODEL 4
1 HA GLU 59 HA GLU 59 -7.961 -0.050 5.208
2 HB2 GLU 59 HB2 GLU 59 -8.758 1.029 7.915
3 HG2 GLU 59 HG2 GLU 59 -9.150 2.257 5.202
4 H GLU 59 HN GLU 59 -9.668 -1.188 7.297
5 HB3 GLU 59 HB1 GLU 59 -7.550 1.735 6.837
6 HG3 GLU 59 HG1 GLU 59 -10.369 1.250 5.966
No H/Q in entry = 6
In of MODEL 4
1 HA GLN 60 HA GLN 60 -4.799 -1.735 7.812
2 HB2 GLN 60 HB2 GLN 60 -4.609 -3.093 5.103
3 HG2 GLN 60 HG2 GLN 60 -5.782 -4.164 7.667
4 HE21 GLN 60 HE21 GLN 60 -6.820 -4.824 4.431
5 HE22 GLN 60 HE22 GLN 60 -6.325 -6.471 4.390
6 H GLN 60 HN GLN 60 -5.925 -0.660 5.303
7 HB3 GLN 60 HB1 GLN 60 -3.717 -3.586 6.530
8 HG3 GLN 60 HG1 GLN 60 -6.721 -3.577 6.298
No H/Q in entry = 8
In of MODEL 4
1 HA TRP 61 HA TRP 61 -1.421 0.623 6.299
2 HB2 TRP 61 HB2 TRP 61 -0.555 -0.501 8.980
3 HD1 TRP 61 HD1 TRP 61 -2.479 0.497 10.413
4 HE1 TRP 61 HE1 TRP 61 -3.327 2.909 10.848
5 HE3 TRP 61 HE3 TRP 61 0.178 2.939 6.844
6 HZ2 TRP 61 HZ2 TRP 61 -2.917 5.478 9.785
7 HZ3 TRP 61 HZ3 TRP 61 -0.107 5.349 6.589
8 HH2 TRP 61 HH2 TRP 61 -1.610 6.604 8.017
9 H TRP 61 HN TRP 61 -2.543 -1.424 8.043
10 HB3 TRP 61 HB1 TRP 61 0.431 0.618 8.057
No H/Q in entry = 10
In of MODEL 4
1 HA CYS 62 HA CYS 62 1.215 -2.454 4.691
2 HB2 CYS 62 HB2 CYS 62 -0.041 -1.008 2.365
3 HG CYS 62 HG CYS 62 -2.222 -1.629 3.872
4 H CYS 62 HN CYS 62 -0.238 0.096 4.684
5 HB3 CYS 62 HB1 CYS 62 0.667 -2.619 2.368
No H/Q in entry = 5
In of MODEL 4
1 HA GLU 63 HA GLU 63 4.606 0.181 3.954
2 HB2 GLU 63 HB2 GLU 63 5.740 -2.331 2.743
3 HG2 GLU 63 HG2 GLU 63 6.805 -2.294 5.119
4 H GLU 63 HN GLU 63 3.307 -2.341 3.827
5 HB3 GLU 63 HB1 GLU 63 6.622 -0.977 3.425
6 HG3 GLU 63 HG1 GLU 63 5.222 -1.677 5.540
No H/Q in entry = 6
In of MODEL 4
1 HA PRO 64 HA PRO 64 4.377 1.653 -0.198
2 HB2 PRO 64 HB2 PRO 64 7.225 2.217 -0.361
3 HG2 PRO 64 HG2 PRO 64 7.671 2.928 1.757
4 HD2 PRO 64 HD2 PRO 64 7.189 0.831 2.491
5 HB3 PRO 64 HB1 PRO 64 5.875 3.343 -0.271
6 HG3 PRO 64 HG1 PRO 64 6.030 3.508 2.032
7 HD3 PRO 64 HD1 PRO 64 5.873 1.608 3.320
No H/Q in entry = 7
In of MODEL 4
1 HA ASP 65 HA ASP 65 7.442 -1.452 -2.167
2 HB2 ASP 65 HB2 ASP 65 8.926 -1.928 -0.241
3 H ASP 65 HN ASP 65 6.781 -0.699 0.521
4 HB3 ASP 65 HB1 ASP 65 7.714 -3.028 0.409
No H/Q in entry = 4
In of MODEL 4
1 HA LYS 66 HA LYS 66 3.999 -4.667 -1.157
2 HB2 LYS 66 HB2 LYS 66 2.858 -2.768 0.880
3 HG2 LYS 66 HG2 LYS 66 4.731 -4.234 1.562
4 HD2 LYS 66 HD2 LYS 66 2.569 -6.260 1.125
5 HE2 LYS 66 HE2 LYS 66 3.844 -7.800 2.208
6 HZ1 LYS 66 HZ1 LYS 66 2.507 -6.388 3.710
7 HZ3 LYS 66 HZ2 LYS 66 3.854 -5.422 4.033
8 HZ2 LYS 66 HZ3 LYS 66 3.839 -7.030 4.490
9 H LYS 66 HN LYS 66 4.911 -2.196 0.035
10 HB3 LYS 66 HB1 LYS 66 2.005 -4.208 0.340
11 HG3 LYS 66 HG1 LYS 66 3.240 -4.312 2.510
12 HD3 LYS 66 HD1 LYS 66 4.172 -6.224 0.400
13 HE3 LYS 66 HE1 LYS 66 5.207 -6.665 2.443
No H/Q in entry = 13
In of MODEL 4
1 HA LEU 67 HA LEU 67 1.061 -1.533 -2.989
2 HB2 LEU 67 HB2 LEU 67 2.902 0.735 -2.301
3 HG LEU 67 HG LEU 67 1.033 -0.531 -0.667
4 HD13 LEU 67 HD11 LEU 67 2.785 0.770 0.170
5 HD12 LEU 67 HD12 LEU 67 1.277 1.501 0.692
6 HD11 LEU 67 HD13 LEU 67 2.210 2.239 -0.624
7 HD21 LEU 67 HD21 LEU 67 -0.638 0.457 -2.121
8 HD23 LEU 67 HD22 LEU 67 -0.051 2.061 -1.633
9 HD22 LEU 67 HD23 LEU 67 -0.727 0.938 -0.440
10 H LEU 67 HN LEU 67 3.692 -1.395 -1.747
11 HB3 LEU 67 HB1 LEU 67 1.391 0.916 -3.152
No H/Q in entry = 11
In of MODEL 4
1 HA ARG 68 HA ARG 68 3.234 -0.871 -6.731
2 HB2 ARG 68 HB2 ARG 68 1.005 -2.816 -7.348
3 HG2 ARG 68 HG2 ARG 68 2.665 -3.679 -5.698
4 HD2 ARG 68 HD2 ARG 68 4.817 -4.492 -6.687
5 HE ARG 68 HE ARG 68 4.376 -1.918 -5.625
6 HH11 ARG 68 HH11 ARG 68 6.890 -3.906 -7.097
7 HH12 ARG 68 HH12 ARG 68 8.173 -2.986 -6.452
8 HH21 ARG 68 HH21 ARG 68 6.077 -0.719 -4.707
9 HH22 ARG 68 HH22 ARG 68 7.699 -1.112 -5.003
10 H ARG 68 HN ARG 68 0.871 -1.504 -5.088
11 HB3 ARG 68 HB1 ARG 68 2.348 -2.427 -8.402
12 HG3 ARG 68 HG1 ARG 68 2.526 -4.615 -7.189
13 HD3 ARG 68 HD1 ARG 68 4.579 -3.337 -7.991
No H/Q in entry = 13
In of MODEL 4
1 HA LYS 69 HA LYS 69 0.569 2.312 -8.159
2 HB2 LYS 69 HB2 LYS 69 2.918 2.289 -10.048
3 HG2 LYS 69 HG2 LYS 69 3.462 4.498 -9.010
4 HD2 LYS 69 HD2 LYS 69 3.619 2.265 -6.993
5 HE2 LYS 69 HE2 LYS 69 4.550 4.490 -6.427
6 HZ2 LYS 69 HZ1 LYS 69 6.518 5.239 -7.551
7 HZ1 LYS 69 HZ2 LYS 69 5.345 5.028 -8.738
8 HZ3 LYS 69 HZ3 LYS 69 6.557 3.866 -8.506
9 H LYS 69 HN LYS 69 2.902 0.698 -8.238
10 HB3 LYS 69 HB1 LYS 69 1.652 3.497 -10.118
11 HG3 LYS 69 HG1 LYS 69 2.331 4.091 -7.745
12 HD3 LYS 69 HD1 LYS 69 4.616 2.250 -8.454
13 HE3 LYS 69 HE1 LYS 69 5.733 3.191 -6.426
No H/Q in entry = 13
In of MODEL 4
1 HA LEU 70 HA LEU 70 -1.422 0.156 -11.434
2 HB2 LEU 70 HB2 LEU 70 -3.218 2.576 -11.302
3 HG LEU 70 HG LEU 70 -3.341 1.727 -9.094
4 HD11 LEU 70 HD11 LEU 70 -5.444 2.278 -10.198
5 HD13 LEU 70 HD12 LEU 70 -5.602 1.018 -8.966
6 HD12 LEU 70 HD13 LEU 70 -5.613 0.577 -10.673
7 HD22 LEU 70 HD21 LEU 70 -2.318 -0.441 -9.381
8 HD21 LEU 70 HD22 LEU 70 -3.719 -0.979 -10.321
9 HD23 LEU 70 HD23 LEU 70 -3.904 -0.580 -8.614
10 H LEU 70 HN LEU 70 -1.105 2.495 -9.735
11 HB3 LEU 70 HB1 LEU 70 -3.598 1.022 -12.000
No H/Q in entry = 11
In of MODEL 4
1 HA3 GLY 71 HA2 GLY 71 -1.016 3.748 -14.513
2 H GLY 71 HN GLY 71 -0.521 3.478 -11.712
3 HA2 GLY 71 HA1 GLY 71 -0.161 4.881 -13.484
No H/Q in entry = 3
In of MODEL 4
1 HA3 GLY 72 HA2 GLY 72 1.862 0.916 -16.365
2 H GLY 72 HN GLY 72 0.229 1.710 -14.949
3 HA2 GLY 72 HA1 GLY 72 2.586 2.512 -16.340
No H/Q in entry = 3
In of MODEL 4
1 HA3 GLY 73 HA2 GLY 73 5.815 1.322 -13.967
2 H GLY 73 HN GLY 73 3.514 2.976 -14.056
3 HA2 GLY 73 HA1 GLY 73 5.471 2.670 -12.902
No H/Q in entry = 3
In of MODEL 4
1 HA SER 74 HA SER 74 4.301 -1.309 -10.787
2 HB2 SER 74 HB2 SER 74 6.471 -2.861 -12.225
3 HG SER 74 HG SER 74 4.896 -3.719 -13.428
4 H SER 74 HN SER 74 5.848 -0.622 -13.119
5 HB3 SER 74 HB1 SER 74 5.315 -3.521 -11.065
No H/Q in entry = 5
In of MODEL 4
1 HA SER 75 HA SER 75 7.817 0.243 -8.494
2 HB2 SER 75 HB2 SER 75 9.742 0.039 -10.841
3 HG SER 75 HG SER 75 8.410 -1.814 -9.486
4 H SER 75 HN SER 75 6.939 0.492 -11.203
5 HB3 SER 75 HB1 SER 75 10.194 0.127 -9.138
No H/Q in entry = 5
In of MODEL 5
1 H1 GLY 7 HT3 GLY 7 17.043 -3.249 -6.255
2 H2 GLY 7 HT2 GLY 7 15.666 -4.153 -5.882
3 H3 GLY 7 HT1 GLY 7 16.560 -4.462 -7.294
4 HA3 GLY 7 HA1 GLY 7 14.643 -3.252 -7.919
5 HA2 GLY 7 HA2 GLY 7 15.036 -2.008 -6.733
No H/Q in entry = 5
In of MODEL 5
1 HA ALA 8 HA ALA 8 17.399 -1.412 -10.618
2 HB1 ALA 8 HB1 ALA 8 15.519 -2.009 -12.068
3 HB3 ALA 8 HB2 ALA 8 16.273 -0.502 -12.587
4 HB2 ALA 8 HB3 ALA 8 14.745 -0.467 -11.703
5 H ALA 8 HN ALA 8 14.746 -1.644 -9.542
No H/Q in entry = 5
In of MODEL 5
1 HA MET 9 HA MET 9 19.028 2.644 -11.149
2 HB2 MET 9 HB2 MET 9 16.311 3.292 -9.985
3 HG2 MET 9 HG2 MET 9 17.443 3.839 -12.721
4 HE2 MET 9 HE1 MET 9 14.608 3.816 -14.190
5 HE1 MET 9 HE2 MET 9 15.895 4.960 -14.569
6 HE3 MET 9 HE3 MET 9 14.263 5.545 -14.257
7 H MET 9 HN MET 9 18.316 0.548 -11.284
8 HB3 MET 9 HB1 MET 9 17.534 4.497 -10.340
9 HG3 MET 9 HG1 MET 9 16.162 2.694 -12.326
No H/Q in entry = 9
In of MODEL 5
1 HA ALA 10 HA ALA 10 20.358 2.980 -7.077
2 HB1 ALA 10 HB1 ALA 10 22.072 4.913 -8.647
3 HB2 ALA 10 HB2 ALA 10 22.379 3.194 -8.426
4 HB3 ALA 10 HB3 ALA 10 22.451 4.285 -7.042
5 H ALA 10 HN ALA 10 19.985 4.128 -9.733
No H/Q in entry = 5
In of MODEL 5
1 HA PRO 11 HA PRO 11 17.683 6.400 -5.806
2 HB2 PRO 11 HB2 PRO 11 18.382 5.406 -3.113
3 HG2 PRO 11 HG2 PRO 11 17.852 3.183 -3.478
4 HD2 PRO 11 HD2 PRO 11 19.834 3.315 -4.655
5 HB3 PRO 11 HB1 PRO 11 16.797 5.608 -3.862
6 HG3 PRO 11 HG1 PRO 11 16.871 3.562 -4.903
7 HD3 PRO 11 HD1 PRO 11 18.739 2.787 -5.957
No H/Q in entry = 7
In of MODEL 5
1 HA PRO 12 HA PRO 12 21.176 9.074 -4.661
2 HB2 PRO 12 HB2 PRO 12 19.357 11.270 -5.213
3 HG2 PRO 12 HG2 PRO 12 18.353 10.583 -7.144
4 HD2 PRO 12 HD2 PRO 12 17.423 9.004 -5.744
5 HB3 PRO 12 HB1 PRO 12 20.834 10.832 -6.070
6 HG3 PRO 12 HG1 PRO 12 19.711 9.534 -7.595
7 HD3 PRO 12 HD1 PRO 12 18.208 7.931 -6.930
No H/Q in entry = 7
In of MODEL 5
1 HA VAL 13 HA VAL 13 21.083 9.716 -0.344
2 HB VAL 13 HB VAL 13 18.893 11.594 -1.370
3 HG12 VAL 13 HG11 VAL 13 19.173 12.859 0.710
4 HG11 VAL 13 HG12 VAL 13 20.299 11.629 1.290
5 HG13 VAL 13 HG13 VAL 13 18.608 11.218 1.018
6 HG22 VAL 13 HG21 VAL 13 21.055 12.113 -2.333
7 HG21 VAL 13 HG22 VAL 13 21.790 12.146 -0.730
8 HG23 VAL 13 HG23 VAL 13 20.590 13.361 -1.178
9 H VAL 13 HN VAL 13 21.338 9.091 -2.504
No H/Q in entry = 9
In of MODEL 5
1 HA ALA 14 HA ALA 14 18.253 8.210 2.775
2 HB3 ALA 14 HB1 ALA 14 16.394 9.168 1.434
3 HB2 ALA 14 HB2 ALA 14 16.031 7.514 1.931
4 HB1 ALA 14 HB3 ALA 14 16.554 7.845 0.280
5 H ALA 14 HN ALA 14 19.715 9.319 1.510
No H/Q in entry = 5
In of MODEL 5
1 HA ALA 15 HA ALA 15 18.992 3.990 2.589
2 HB3 ALA 15 HB1 ALA 15 17.233 2.292 2.633
3 HB1 ALA 15 HB2 ALA 15 16.062 3.476 2.058
4 HB2 ALA 15 HB3 ALA 15 16.794 3.665 3.650
5 H ALA 15 HN ALA 15 16.939 5.855 2.493
No H/Q in entry = 5
In of MODEL 5
1 HA PRO 16 HA PRO 16 19.735 3.357 -1.754
2 HB2 PRO 16 HB2 PRO 16 21.428 1.252 -1.581
3 HG2 PRO 16 HG2 PRO 16 21.106 0.623 0.616
4 HD2 PRO 16 HD2 PRO 16 19.935 1.944 2.079
5 HB3 PRO 16 HB1 PRO 16 21.909 2.894 -1.143
6 HG3 PRO 16 HG1 PRO 16 22.379 1.825 0.846
7 HD3 PRO 16 HD1 PRO 16 20.937 3.365 1.731
No H/Q in entry = 7
In of MODEL 5
1 HA SER 17 HA SER 17 17.243 -0.439 -2.020
2 HB2 SER 17 HB2 SER 17 15.578 0.470 0.355
3 HG SER 17 HG SER 17 17.982 -0.740 0.279
4 H SER 17 HN SER 17 17.584 1.890 -0.275
5 HB3 SER 17 HB1 SER 17 15.457 -1.076 -0.488
No H/Q in entry = 5
In of MODEL 5
1 HA PRO 18 HA PRO 18 14.931 2.771 -4.253
2 HB2 PRO 18 HB2 PRO 18 14.399 0.696 -6.252
3 HG2 PRO 18 HG2 PRO 18 16.492 -0.234 -6.445
4 HD2 PRO 18 HD2 PRO 18 16.066 -0.990 -4.308
5 HB3 PRO 18 HB1 PRO 18 15.302 2.205 -6.423
6 HG3 PRO 18 HG1 PRO 18 17.295 1.234 -5.872
7 HD3 PRO 18 HD1 PRO 18 17.531 -0.029 -3.978
No H/Q in entry = 7
In of MODEL 5
1 HA ALA 19 HA ALA 19 10.781 1.316 -4.234
2 HB1 ALA 19 HB1 ALA 19 11.352 2.977 -1.757
3 HB3 ALA 19 HB2 ALA 19 11.426 1.219 -1.860
4 HB2 ALA 19 HB3 ALA 19 9.879 2.047 -2.031
5 H ALA 19 HN ALA 19 12.774 3.278 -4.195
No H/Q in entry = 5
In of MODEL 5
1 HA VAL 20 HA VAL 20 9.092 5.392 -4.938
2 HB VAL 20 HB VAL 20 6.692 4.918 -5.707
3 HG11 VAL 20 HG11 VAL 20 8.619 4.887 -7.268
4 HG13 VAL 20 HG12 VAL 20 7.432 3.629 -7.662
5 HG12 VAL 20 HG13 VAL 20 8.922 3.201 -6.814
6 HG23 VAL 20 HG21 VAL 20 7.546 2.103 -5.089
7 HG22 VAL 20 HG22 VAL 20 6.107 2.558 -6.005
8 HG21 VAL 20 HG23 VAL 20 6.260 3.022 -4.310
9 H VAL 20 HN VAL 20 8.861 2.869 -3.477
No H/Q in entry = 9
In of MODEL 5
1 HA THR 21 HA THR 21 6.061 6.247 -1.832
2 HB THR 21 HB THR 21 5.652 8.801 -1.912
3 HG1 THR 21 HG1 THR 21 6.124 9.143 -4.090
4 HG21 THR 21 HG21 THR 21 7.318 7.738 -0.453
5 HG23 THR 21 HG22 THR 21 7.932 9.265 -1.085
6 HG22 THR 21 HG23 THR 21 8.479 7.736 -1.778
7 H THR 21 HN THR 21 7.022 6.698 -4.539
No H/Q in entry = 7
In of MODEL 5
1 HA TYR 22 HA TYR 22 2.267 6.865 -3.886
2 HB2 TYR 22 HB2 TYR 22 1.883 5.451 -1.252
3 HD1 TYR 22 HD1 TYR 22 0.681 4.194 -4.395
4 HD2 TYR 22 HD2 TYR 22 4.023 4.225 -1.781
5 HE1 TYR 22 HE1 TYR 22 1.606 2.311 -5.591
6 HE2 TYR 22 HE2 TYR 22 4.993 2.334 -2.998
7 HH TYR 22 HH TYR 22 4.124 0.435 -4.454
8 H TYR 22 HN TYR 22 3.877 7.131 -1.467
9 HB3 TYR 22 HB1 TYR 22 0.628 5.560 -2.485
No H/Q in entry = 9
In of MODEL 5
1 HA ALA 23 HA ALA 23 -0.032 10.050 -1.911
2 HB1 ALA 23 HB1 ALA 23 0.323 10.642 -4.256
3 HB2 ALA 23 HB2 ALA 23 -1.287 11.140 -3.725
4 HB3 ALA 23 HB3 ALA 23 -1.089 9.685 -4.706
5 H ALA 23 HN ALA 23 0.057 7.680 -3.664
No H/Q in entry = 5
In of MODEL 5
1 HA LEU 24 HA LEU 24 -3.885 8.496 -0.610
2 HB2 LEU 24 HB2 LEU 24 -4.663 11.415 -0.400
3 HG LEU 24 HG LEU 24 -2.719 11.230 0.923
4 HD11 LEU 24 HD11 LEU 24 -4.524 12.480 1.880
5 HD13 LEU 24 HD12 LEU 24 -3.608 11.659 3.144
6 HD12 LEU 24 HD13 LEU 24 -5.165 11.013 2.625
7 HD22 LEU 24 HD21 LEU 24 -2.490 8.853 1.088
8 HD21 LEU 24 HD22 LEU 24 -3.928 8.761 2.108
9 HD23 LEU 24 HD23 LEU 24 -2.474 9.566 2.700
10 H LEU 24 HN LEU 24 -2.153 10.665 -1.188
11 HB3 LEU 24 HB1 LEU 24 -5.391 10.054 0.393
No H/Q in entry = 11
In of MODEL 5
1 HA GLN 25 HA GLN 25 -7.759 7.956 -2.602
2 HB2 GLN 25 HB2 GLN 25 -6.890 10.512 -3.970
3 HG2 GLN 25 HG2 GLN 25 -8.694 10.109 -1.592
4 HE21 GLN 25 HE21 GLN 25 -9.835 11.874 -0.896
5 HE22 GLN 25 HE22 GLN 25 -10.253 13.199 -1.896
6 H GLN 25 HN GLN 25 -6.021 8.184 -1.239
7 HB3 GLN 25 HB1 GLN 25 -8.480 9.766 -4.076
8 HG3 GLN 25 HG1 GLN 25 -7.200 11.017 -1.664
No H/Q in entry = 8
In of MODEL 5
1 HA GLU 26 HA GLU 26 -5.068 6.922 -6.210
2 HB2 GLU 26 HB2 GLU 26 -2.971 7.818 -5.159
3 HG2 GLU 26 HG2 GLU 26 -2.514 5.097 -6.362
4 H GLU 26 HN GLU 26 -4.793 7.465 -3.396
5 HB3 GLU 26 HB1 GLU 26 -2.827 6.323 -4.266
6 HG3 GLU 26 HG1 GLU 26 -2.741 6.619 -7.240
No H/Q in entry = 6
In of MODEL 5
1 HA ASP 27 HA ASP 27 -6.184 2.866 -5.077
2 HB2 ASP 27 HB2 ASP 27 -6.823 3.030 -8.057
3 H ASP 27 HN ASP 27 -5.577 4.974 -6.985
4 HB3 ASP 27 HB1 ASP 27 -7.260 1.718 -6.990
No H/Q in entry = 4
In of MODEL 5
1 HA VAL 28 HA VAL 28 -2.853 0.565 -6.737
2 HB VAL 28 HB VAL 28 -1.289 0.407 -4.649
3 HG11 VAL 28 HG11 VAL 28 -2.272 3.117 -5.511
4 HG13 VAL 28 HG12 VAL 28 -1.043 2.157 -6.352
5 HG12 VAL 28 HG13 VAL 28 -0.740 2.759 -4.718
6 HG22 VAL 28 HG21 VAL 28 -3.064 0.573 -2.987
7 HG21 VAL 28 HG22 VAL 28 -3.461 2.190 -3.575
8 HG23 VAL 28 HG23 VAL 28 -1.895 1.890 -2.823
9 H VAL 28 HN VAL 28 -5.021 1.146 -4.870
No H/Q in entry = 9
In of MODEL 5
1 HA PHE 29 HA PHE 29 -3.749 -3.327 -5.014
2 HB2 PHE 29 HB2 PHE 29 -1.461 -3.756 -6.915
3 HD1 PHE 29 HD1 PHE 29 -2.441 -3.278 -8.934
4 HD2 PHE 29 HD2 PHE 29 -4.570 -5.537 -6.058
5 HE1 PHE 29 HE1 PHE 29 -4.235 -3.668 -10.572
6 HE2 PHE 29 HE2 PHE 29 -6.371 -5.922 -7.674
7 HZ PHE 29 HZ PHE 29 -6.202 -5.002 -9.940
8 H PHE 29 HN PHE 29 -1.876 -1.502 -6.277
9 HB3 PHE 29 HB1 PHE 29 -2.054 -5.096 -5.958
No H/Q in entry = 9
In of MODEL 5
1 HA ILE 30 HA ILE 30 -0.655 -3.982 -1.913
2 HB ILE 30 HB ILE 30 -3.431 -4.147 -0.764
3 HG12 ILE 30 HG12 ILE 30 -2.783 -2.157 0.485
4 HG22 ILE 30 HG21 ILE 30 -2.491 -4.262 1.538
5 HG21 ILE 30 HG22 ILE 30 -0.916 -4.627 0.828
6 HG23 ILE 30 HG23 ILE 30 -2.276 -5.727 0.585
7 HD12 ILE 30 HD11 ILE 30 -2.543 -0.552 -1.269
8 HD11 ILE 30 HD12 ILE 30 -3.691 -1.822 -1.771
9 HD13 ILE 30 HD13 ILE 30 -2.024 -1.836 -2.359
10 H ILE 30 HN ILE 30 -3.219 -4.562 -3.236
11 HG13 ILE 30 HG11 ILE 30 -1.166 -2.231 -0.198
No H/Q in entry = 11
In of MODEL 5
1 HA LYS 31 HA LYS 31 -0.411 -8.300 -2.002
2 HB2 LYS 31 HB2 LYS 31 1.603 -7.677 -3.080
3 HG2 LYS 31 HG2 LYS 31 2.246 -9.367 -0.686
4 HD2 LYS 31 HD2 LYS 31 3.777 -9.083 -3.260
5 HE2 LYS 31 HE2 LYS 31 4.314 -10.527 -0.685
6 HZ2 LYS 31 HZ1 LYS 31 6.348 -11.263 -1.735
7 HZ1 LYS 31 HZ2 LYS 31 6.331 -9.580 -1.724
8 HZ3 LYS 31 HZ3 LYS 31 5.989 -10.412 -3.149
9 H LYS 31 HN LYS 31 0.502 -5.587 -1.691
10 HB3 LYS 31 HB1 LYS 31 2.277 -7.028 -1.603
11 HG3 LYS 31 HG1 LYS 31 1.750 -9.914 -2.289
12 HD3 LYS 31 HD1 LYS 31 4.232 -8.322 -1.733
13 HE3 LYS 31 HE1 LYS 31 3.950 -11.270 -2.239
No H/Q in entry = 13
In of MODEL 5
1 HA CYS 32 HA CYS 32 -0.229 -8.798 2.320
2 HB2 CYS 32 HB2 CYS 32 -1.685 -10.671 2.973
3 HG CYS 32 HG CYS 32 -3.230 -12.196 1.254
4 H CYS 32 HN CYS 32 -0.866 -9.593 -0.399
5 HB3 CYS 32 HB1 CYS 32 -2.499 -9.620 1.823
No H/Q in entry = 5
In of MODEL 5
1 HA ASN 33 HA ASN 33 3.049 -11.441 2.710
2 HB2 ASN 33 HB2 ASN 33 1.673 -12.272 5.254
3 HD21 ASN 33 HD21 ASN 33 2.538 -11.212 7.069
4 HD22 ASN 33 HD22 ASN 33 3.580 -9.844 6.930
5 H ASN 33 HN ASN 33 0.499 -10.823 3.734
6 HB3 ASN 33 HB1 ASN 33 3.228 -12.954 4.802
No H/Q in entry = 6
In of MODEL 5
1 HA ASP 34 HA ASP 34 1.345 -15.606 1.623
2 HB2 ASP 34 HB2 ASP 34 -0.975 -15.583 2.432
3 H ASP 34 HN ASP 34 0.119 -13.065 2.274
4 HB3 ASP 34 HB1 ASP 34 -1.457 -14.565 1.081
No H/Q in entry = 4
In of MODEL 5
1 HA3 GLY 35 HA2 GLY 35 2.273 -12.187 -1.923
2 H GLY 35 HN GLY 35 1.083 -12.619 0.075
3 HA2 GLY 35 HA1 GLY 35 1.992 -13.841 -2.436
No H/Q in entry = 3
In of MODEL 5
1 HA ARG 36 HA ARG 36 -1.836 -12.280 -3.984
2 HB2 ARG 36 HB2 ARG 36 -3.391 -12.186 -1.406
3 HG2 ARG 36 HG2 ARG 36 -2.194 -14.262 -1.397
4 HD2 ARG 36 HD2 ARG 36 -3.426 -14.956 -4.029
5 HE ARG 36 HE ARG 36 -1.867 -16.324 -2.199
6 HH11 ARG 36 HH11 ARG 36 -2.145 -15.785 -5.689
7 HH12 ARG 36 HH12 ARG 36 -1.235 -17.133 -6.153
8 HH21 ARG 36 HH21 ARG 36 -0.551 -18.213 -2.825
9 HH22 ARG 36 HH22 ARG 36 -0.294 -18.536 -4.482
10 H ARG 36 HN ARG 36 -0.813 -12.393 -1.235
11 HB3 ARG 36 HB1 ARG 36 -4.025 -12.507 -3.012
12 HG3 ARG 36 HG1 ARG 36 -3.893 -14.548 -1.796
13 HD3 ARG 36 HD1 ARG 36 -1.843 -14.194 -3.948
No H/Q in entry = 13
In of MODEL 5
1 HA PHE 37 HA PHE 37 -2.318 -8.067 -3.415
2 HB2 PHE 37 HB2 PHE 37 -2.477 -8.767 -6.301
3 HD1 PHE 37 HD1 PHE 37 -1.145 -5.905 -4.419
4 HD2 PHE 37 HD2 PHE 37 -0.242 -9.431 -6.595
5 HE1 PHE 37 HE1 PHE 37 1.153 -5.260 -4.385
6 HE2 PHE 37 HE2 PHE 37 2.148 -8.826 -6.565
7 HZ PHE 37 HZ PHE 37 2.875 -6.732 -5.470
8 H PHE 37 HN PHE 37 -2.891 -10.566 -4.809
9 HB3 PHE 37 HB1 PHE 37 -2.865 -7.129 -5.781
No H/Q in entry = 9
In of MODEL 5
1 HA TYR 38 HA TYR 38 -6.575 -7.317 -3.624
2 HB2 TYR 38 HB2 TYR 38 -5.478 -6.398 -0.955
3 HD1 TYR 38 HD1 TYR 38 -4.120 -8.394 -0.600
4 HD2 TYR 38 HD2 TYR 38 -8.278 -8.686 -1.439
5 HE1 TYR 38 HE1 TYR 38 -4.095 -10.735 0.120
6 HE2 TYR 38 HE2 TYR 38 -8.248 -11.034 -0.716
7 HH TYR 38 HH TYR 38 -6.718 -12.828 -0.474
8 H TYR 38 HN TYR 38 -3.810 -6.877 -2.754
9 HB3 TYR 38 HB1 TYR 38 -7.187 -6.506 -1.326
No H/Q in entry = 9
In of MODEL 5
1 HA LEU 39 HA LEU 39 -5.845 -3.200 -4.858
2 HB2 LEU 39 HB2 LEU 39 -7.534 -4.408 -6.550
3 HG LEU 39 HG LEU 39 -6.164 -2.479 -7.244
4 HD11 LEU 39 HD11 LEU 39 -9.034 -2.369 -8.138
5 HD13 LEU 39 HD12 LEU 39 -7.742 -3.369 -8.825
6 HD12 LEU 39 HD13 LEU 39 -7.671 -1.607 -8.952
7 HD21 LEU 39 HD21 LEU 39 -6.813 -0.880 -5.566
8 HD23 LEU 39 HD22 LEU 39 -8.443 -0.783 -6.275
9 HD22 LEU 39 HD23 LEU 39 -7.017 -0.271 -7.208
10 H LEU 39 HN LEU 39 -7.504 -5.552 -4.509
11 HB3 LEU 39 HB1 LEU 39 -8.668 -3.312 -5.796
No H/Q in entry = 11
In of MODEL 5
1 HA3 GLY 40 HA2 GLY 40 -8.531 -0.762 -2.517
2 H GLY 40 HN GLY 40 -6.018 -1.360 -3.735
3 HA2 GLY 40 HA1 GLY 40 -7.168 -0.923 -1.399
No H/Q in entry = 3
In of MODEL 5
1 HA THR 41 HA THR 41 -6.867 3.277 -3.052
2 HB THR 41 HB THR 41 -9.300 3.745 -1.320
3 HG1 THR 41 HG1 THR 41 -9.160 3.110 -4.125
4 HG21 THR 41 HG21 THR 41 -8.025 5.748 -1.941
5 HG23 THR 41 HG22 THR 41 -9.599 5.711 -2.733
6 HG22 THR 41 HG23 THR 41 -8.146 5.294 -3.642
7 H THR 41 HN THR 41 -8.319 1.386 -1.310
No H/Q in entry = 7
In of MODEL 5
1 HA ILE 42 HA ILE 42 -4.806 4.189 0.759
2 HB ILE 42 HB ILE 42 -3.713 6.397 -1.007
3 HG12 ILE 42 HG12 ILE 42 -2.730 3.574 -0.620
4 HG22 ILE 42 HG21 ILE 42 -2.592 5.004 1.446
5 HG21 ILE 42 HG22 ILE 42 -3.249 6.635 1.402
6 HG23 ILE 42 HG23 ILE 42 -1.771 6.260 0.517
7 HD13 ILE 42 HD11 ILE 42 -1.090 4.018 -2.282
8 HD12 ILE 42 HD12 ILE 42 -0.872 5.005 -0.838
9 HD11 ILE 42 HD13 ILE 42 -1.555 5.724 -2.305
10 H ILE 42 HN ILE 42 -5.431 4.648 -2.020
11 HG13 ILE 42 HG11 ILE 42 -3.455 4.210 -2.090
No H/Q in entry = 11
In of MODEL 5
1 HA ILE 43 HA ILE 43 -7.033 7.728 2.009
2 HB ILE 43 HB ILE 43 -7.985 7.400 4.335
3 HG12 ILE 43 HG12 ILE 43 -6.196 5.464 4.642
4 HG21 ILE 43 HG21 ILE 43 -8.770 5.452 2.202
5 HG23 ILE 43 HG22 ILE 43 -9.403 7.102 2.429
6 HG22 ILE 43 HG23 ILE 43 -9.697 5.833 3.643
7 HD11 ILE 43 HD11 ILE 43 -7.157 3.977 3.003
8 HD13 ILE 43 HD12 ILE 43 -8.638 3.972 3.978
9 HD12 ILE 43 HD13 ILE 43 -7.169 3.272 4.624
10 H ILE 43 HN ILE 43 -5.551 5.245 2.484
11 HG13 ILE 43 HG11 ILE 43 -7.687 5.442 5.543
No H/Q in entry = 11
In of MODEL 5
1 HA ASP 44 HA ASP 44 -3.724 9.094 4.565
2 HB2 ASP 44 HB2 ASP 44 -5.078 8.196 6.549
3 H ASP 44 HN ASP 44 -4.458 6.363 3.958
4 HB3 ASP 44 HB1 ASP 44 -3.780 7.045 6.785
No H/Q in entry = 4
In of MODEL 5
1 HA GLN 45 HA GLN 45 0.069 6.862 4.670
2 HB2 GLN 45 HB2 GLN 45 1.597 8.187 3.319
3 HG2 GLN 45 HG2 GLN 45 -0.524 10.324 3.372
4 HE21 GLN 45 HE21 GLN 45 -0.764 10.327 1.144
5 HE22 GLN 45 HE22 GLN 45 0.471 10.884 0.086
6 H GLN 45 HN GLN 45 -1.505 9.220 5.340
7 HB3 GLN 45 HB1 GLN 45 -0.008 8.044 2.612
8 HG3 GLN 45 HG1 GLN 45 1.096 10.448 4.055
No H/Q in entry = 8
In of MODEL 5
1 HA THR 46 HA THR 46 2.795 8.919 7.416
2 HB THR 46 HB THR 46 3.814 7.122 8.886
3 HG1 THR 46 HG1 THR 46 2.340 5.450 7.147
4 HG22 THR 46 HG21 THR 46 0.826 6.882 8.536
5 HG21 THR 46 HG22 THR 46 1.649 8.090 9.528
6 HG23 THR 46 HG23 THR 46 1.742 6.378 9.953
7 H THR 46 HN THR 46 2.019 6.743 5.632
No H/Q in entry = 7
In of MODEL 5
1 HA SER 47 HA SER 47 6.547 8.372 5.423
2 HB2 SER 47 HB2 SER 47 7.810 8.009 8.135
3 HG SER 47 HG SER 47 7.891 10.277 8.105
4 H SER 47 HN SER 47 5.348 8.152 7.973
5 HB3 SER 47 HB1 SER 47 8.622 8.578 6.672
No H/Q in entry = 5
In of MODEL 5
1 HA ASP 48 HA ASP 48 7.552 3.990 5.875
2 HB2 ASP 48 HB2 ASP 48 6.490 3.457 8.628
3 H ASP 48 HN ASP 48 5.849 5.697 7.564
4 HB3 ASP 48 HB1 ASP 48 7.221 2.219 7.625
No H/Q in entry = 4
In of MODEL 5
1 HA GLN 49 HA GLN 49 3.569 2.140 5.129
2 HB2 GLN 49 HB2 GLN 49 2.319 2.778 7.789
3 HG2 GLN 49 HG2 GLN 49 3.823 0.332 6.899
4 HE21 GLN 49 HE21 GLN 49 2.316 -1.175 7.539
5 HE22 GLN 49 HE22 GLN 49 1.869 -1.389 9.177
6 H GLN 49 HN GLN 49 4.203 4.439 6.839
7 HB3 GLN 49 HB1 GLN 49 1.705 1.576 6.676
8 HG3 GLN 49 HG1 GLN 49 4.400 1.542 8.046
No H/Q in entry = 8
In of MODEL 5
1 HA TYR 50 HA TYR 50 0.121 4.722 4.155
2 HB2 TYR 50 HB2 TYR 50 0.490 2.578 2.046
3 HD1 TYR 50 HD1 TYR 50 0.343 6.185 1.684
4 HD2 TYR 50 HD2 TYR 50 2.986 2.818 1.728
5 HE1 TYR 50 HE1 TYR 50 2.172 7.584 0.850
6 HE2 TYR 50 HE2 TYR 50 4.764 4.185 0.914
7 HH TYR 50 HH TYR 50 4.808 7.439 0.980
8 H TYR 50 HN TYR 50 1.398 2.090 4.389
9 HB3 TYR 50 HB1 TYR 50 -0.573 3.964 1.855
No H/Q in entry = 9
In of MODEL 5
1 HA LEU 51 HA LEU 51 -3.185 2.291 5.649
2 HB2 LEU 51 HB2 LEU 51 -3.343 4.539 6.853
3 HG LEU 51 HG LEU 51 -6.034 3.413 6.099
4 HD12 LEU 51 HD11 LEU 51 -5.896 2.218 8.221
5 HD11 LEU 51 HD12 LEU 51 -4.220 2.755 8.391
6 HD13 LEU 51 HD13 LEU 51 -4.681 1.699 7.056
7 HD21 LEU 51 HD21 LEU 51 -5.199 5.173 8.396
8 HD23 LEU 51 HD22 LEU 51 -6.800 4.454 8.146
9 HD22 LEU 51 HD23 LEU 51 -6.187 5.642 7.003
10 H LEU 51 HN LEU 51 -1.997 4.738 4.627
11 HB3 LEU 51 HB1 LEU 51 -4.328 5.076 5.516
No H/Q in entry = 11
In of MODEL 5
1 HA ILE 52 HA ILE 52 -5.333 2.324 1.857
2 HB ILE 52 HB ILE 52 -4.745 -0.617 2.221
3 HG12 ILE 52 HG12 ILE 52 -2.664 0.628 2.637
4 HG23 ILE 52 HG21 ILE 52 -4.676 -0.636 -0.219
5 HG22 ILE 52 HG22 ILE 52 -4.958 1.095 -0.256
6 HG21 ILE 52 HG23 ILE 52 -6.216 0.012 0.352
7 HD13 ILE 52 HD11 ILE 52 -2.963 1.745 -0.103
8 HD12 ILE 52 HD12 ILE 52 -1.616 2.019 1.023
9 HD11 ILE 52 HD13 ILE 52 -3.216 2.668 1.375
10 H ILE 52 HN ILE 52 -4.279 1.084 4.302
11 HG13 ILE 52 HG11 ILE 52 -2.576 -0.248 1.117
No H/Q in entry = 11
In of MODEL 5
1 HA ARG 53 HA ARG 53 -9.161 0.668 3.167
2 HB2 ARG 53 HB2 ARG 53 -9.794 2.999 2.963
3 HG2 ARG 53 HG2 ARG 53 -11.658 1.584 1.096
4 HD2 ARG 53 HD2 ARG 53 -12.147 3.628 3.216
5 HE ARG 53 HE ARG 53 -13.909 2.367 1.303
6 HH11 ARG 53 HH11 ARG 53 -13.461 4.780 3.898
7 HH12 ARG 53 HH12 ARG 53 -15.091 5.197 3.989
8 HH21 ARG 53 HH21 ARG 53 -16.205 2.953 1.449
9 HH22 ARG 53 HH22 ARG 53 -16.693 4.127 2.587
10 H ARG 53 HN ARG 53 -7.416 2.164 1.396
11 HB3 ARG 53 HB1 ARG 53 -9.697 2.935 1.226
12 HG3 ARG 53 HG1 ARG 53 -11.683 1.350 2.848
13 HD3 ARG 53 HD1 ARG 53 -11.914 4.037 1.508
No H/Q in entry = 13
In of MODEL 5
1 HA PHE 54 HA PHE 54 -9.553 -1.883 -0.351
2 HB2 PHE 54 HB2 PHE 54 -10.154 -3.584 2.068
3 HD1 PHE 54 HD1 PHE 54 -8.262 -2.720 3.340
4 HD2 PHE 54 HD2 PHE 54 -7.756 -4.233 -0.593
5 HE1 PHE 54 HE1 PHE 54 -5.853 -2.776 3.685
6 HE2 PHE 54 HE2 PHE 54 -5.339 -4.310 -0.261
7 HZ PHE 54 HZ PHE 54 -4.362 -3.578 1.882
8 H PHE 54 HN PHE 54 -9.825 -1.162 2.461
9 HB3 PHE 54 HB1 PHE 54 -9.911 -4.182 0.431
No H/Q in entry = 9
In of MODEL 5
1 HA ASP 55 HA ASP 55 -13.659 -2.059 -1.376
2 HB2 ASP 55 HB2 ASP 55 -13.071 -3.691 -3.047
3 H ASP 55 HN ASP 55 -11.382 -3.630 -0.968
4 HB3 ASP 55 HB1 ASP 55 -13.239 -5.004 -1.891
No H/Q in entry = 4
In of MODEL 5
1 HA ASP 56 HA ASP 56 -15.672 -4.529 2.017
2 HB2 ASP 56 HB2 ASP 56 -13.925 -6.352 2.307
3 H ASP 56 HN ASP 56 -12.915 -4.294 1.106
4 HB3 ASP 56 HB1 ASP 56 -13.117 -5.312 3.467
No H/Q in entry = 4
In of MODEL 5
1 HA GLN 57 HA GLN 57 -13.610 0.021 2.818
2 HB2 GLN 57 HB2 GLN 57 -15.797 -0.911 4.679
3 HG2 GLN 57 HG2 GLN 57 -15.991 0.568 2.067
4 HE21 GLN 57 HE21 GLN 57 -18.018 1.367 1.534
5 HE22 GLN 57 HE22 GLN 57 -19.215 1.698 2.726
6 H GLN 57 HN GLN 57 -13.736 -2.026 1.903
7 HB3 GLN 57 HB1 GLN 57 -15.280 0.759 4.455
8 HG3 GLN 57 HG1 GLN 57 -16.617 -1.030 2.444
No H/Q in entry = 8
In of MODEL 5
1 HA SER 58 HA SER 58 -11.788 -1.847 6.714
2 HB2 SER 58 HB2 SER 58 -10.403 -3.777 4.862
3 HG SER 58 HG SER 58 -12.877 -3.875 6.145
4 H SER 58 HN SER 58 -12.453 -2.556 4.055
5 HB3 SER 58 HB1 SER 58 -10.425 -3.805 6.628
No H/Q in entry = 5
In of MODEL 5
1 HA GLU 59 HA GLU 59 -8.131 0.263 5.349
2 HB2 GLU 59 HB2 GLU 59 -8.638 1.291 8.142
3 HG2 GLU 59 HG2 GLU 59 -9.674 2.382 5.539
4 H GLU 59 HN GLU 59 -9.888 -0.867 7.424
5 HB3 GLU 59 HB1 GLU 59 -7.651 2.047 6.903
6 HG3 GLU 59 HG1 GLU 59 -10.636 1.691 6.847
No H/Q in entry = 6
In of MODEL 5
1 HA GLN 60 HA GLN 60 -4.971 -1.509 7.962
2 HB2 GLN 60 HB2 GLN 60 -5.607 -3.403 6.515
3 HG2 GLN 60 HG2 GLN 60 -2.626 -3.004 6.501
4 HE21 GLN 60 HE21 GLN 60 -2.338 -4.074 4.534
5 HE22 GLN 60 HE22 GLN 60 -2.600 -5.772 4.379
6 H GLN 60 HN GLN 60 -6.069 -0.386 5.455
7 HB3 GLN 60 HB1 GLN 60 -4.687 -2.695 5.196
8 HG3 GLN 60 HG1 GLN 60 -3.573 -3.787 7.765
No H/Q in entry = 8
In of MODEL 5
1 HA TRP 61 HA TRP 61 -1.602 0.903 6.488
2 HB2 TRP 61 HB2 TRP 61 -0.813 -0.187 9.196
3 HD1 TRP 61 HD1 TRP 61 -2.628 0.962 10.634
4 HE1 TRP 61 HE1 TRP 61 -3.378 3.395 10.976
5 HE3 TRP 61 HE3 TRP 61 0.053 3.146 6.905
6 HZ2 TRP 61 HZ2 TRP 61 -2.884 5.918 9.791
7 HZ3 TRP 61 HZ3 TRP 61 -0.153 5.568 6.556
8 HH2 TRP 61 HH2 TRP 61 -1.551 6.918 7.939
9 H TRP 61 HN TRP 61 -2.783 -1.061 8.270
10 HB3 TRP 61 HB1 TRP 61 0.256 0.853 8.265
No H/Q in entry = 10
In of MODEL 5
1 HA CYS 62 HA CYS 62 0.760 -2.396 4.982
2 HB2 CYS 62 HB2 CYS 62 -0.194 -0.921 2.532
3 HG CYS 62 HG CYS 62 -2.500 -1.189 4.074
4 H CYS 62 HN CYS 62 -0.498 0.241 4.867
5 HB3 CYS 62 HB1 CYS 62 0.273 -2.608 2.680
No H/Q in entry = 5
In of MODEL 5
1 HA GLU 63 HA GLU 63 4.486 -0.271 4.133
2 HB2 GLU 63 HB2 GLU 63 4.948 -3.062 3.092
3 HG2 GLU 63 HG2 GLU 63 6.031 -2.038 5.630
4 H GLU 63 HN GLU 63 2.760 -2.558 3.935
5 HB3 GLU 63 HB1 GLU 63 6.204 -1.873 3.386
6 HG3 GLU 63 HG1 GLU 63 4.360 -2.599 5.561
No H/Q in entry = 6
In of MODEL 5
1 HA PRO 64 HA PRO 64 4.316 1.019 -0.182
2 HB2 PRO 64 HB2 PRO 64 7.199 1.380 -0.198
3 HG2 PRO 64 HG2 PRO 64 7.588 2.197 1.885
4 HD2 PRO 64 HD2 PRO 64 6.760 0.320 2.909
5 HB3 PRO 64 HB1 PRO 64 5.945 2.601 -0.292
6 HG3 PRO 64 HG1 PRO 64 6.033 3.020 1.948
7 HD3 PRO 64 HD1 PRO 64 5.416 1.367 3.372
No H/Q in entry = 7
In of MODEL 5
1 HA ASP 65 HA ASP 65 7.458 -2.583 -1.291
2 HB2 ASP 65 HB2 ASP 65 8.523 -3.111 0.740
3 H ASP 65 HN ASP 65 6.489 -1.298 1.007
4 HB3 ASP 65 HB1 ASP 65 7.004 -3.414 1.563
No H/Q in entry = 4
In of MODEL 5
1 HA LYS 66 HA LYS 66 3.591 -5.145 -1.123
2 HB2 LYS 66 HB2 LYS 66 2.204 -3.549 1.018
3 HG2 LYS 66 HG2 LYS 66 4.061 -4.717 1.967
4 HD2 LYS 66 HD2 LYS 66 2.873 -7.129 0.617
5 HE2 LYS 66 HE2 LYS 66 3.426 -7.648 2.894
6 HZ2 LYS 66 HZ1 LYS 66 5.092 -6.053 3.491
7 HZ1 LYS 66 HZ2 LYS 66 6.080 -6.504 2.223
8 HZ3 LYS 66 HZ3 LYS 66 5.864 -7.546 3.539
9 H LYS 66 HN LYS 66 4.353 -2.700 0.282
10 HB3 LYS 66 HB1 LYS 66 1.566 -5.014 0.297
11 HG3 LYS 66 HG1 LYS 66 2.533 -5.462 2.448
12 HD3 LYS 66 HD1 LYS 66 4.479 -6.442 0.370
13 HE3 LYS 66 HE1 LYS 66 4.533 -8.439 1.770
No H/Q in entry = 13
In of MODEL 5
1 HA LEU 67 HA LEU 67 0.839 -1.866 -2.865
2 HB2 LEU 67 HB2 LEU 67 2.779 0.331 -2.213
3 HG LEU 67 HG LEU 67 0.835 -0.834 -0.555
4 HD11 LEU 67 HD11 LEU 67 2.183 1.864 -0.544
5 HD13 LEU 67 HD12 LEU 67 2.649 0.370 0.326
6 HD12 LEU 67 HD13 LEU 67 1.197 1.230 0.773
7 HD22 LEU 67 HD21 LEU 67 -0.803 0.829 -0.338
8 HD21 LEU 67 HD22 LEU 67 -0.782 0.235 -2.007
9 HD23 LEU 67 HD23 LEU 67 -0.058 1.799 -1.605
10 H LEU 67 HN LEU 67 3.533 -1.904 -1.705
11 HB3 LEU 67 HB1 LEU 67 1.278 0.562 -3.055
No H/Q in entry = 11
In of MODEL 5
1 HA ARG 68 HA ARG 68 2.805 -0.858 -6.731
2 HB2 ARG 68 HB2 ARG 68 0.646 -2.919 -7.248
3 HG2 ARG 68 HG2 ARG 68 2.365 -3.795 -5.811
4 HD2 ARG 68 HD2 ARG 68 4.213 -3.023 -8.073
5 HE ARG 68 HE ARG 68 4.986 -5.098 -7.313
6 HH11 ARG 68 HH11 ARG 68 4.912 -2.671 -4.712
7 HH12 ARG 68 HH12 ARG 68 6.138 -3.415 -3.800
8 HH21 ARG 68 HH21 ARG 68 6.707 -6.113 -6.006
9 HH22 ARG 68 HH22 ARG 68 7.170 -5.395 -4.547
10 H ARG 68 HN ARG 68 0.503 -1.361 -4.967
11 HB3 ARG 68 HB1 ARG 68 1.855 -2.416 -8.412
12 HG3 ARG 68 HG1 ARG 68 2.371 -4.578 -7.399
13 HD3 ARG 68 HD1 ARG 68 4.250 -2.418 -6.424
No H/Q in entry = 13
In of MODEL 5
1 HA LYS 69 HA LYS 69 -0.165 2.017 -8.291
2 HB2 LYS 69 HB2 LYS 69 2.299 2.242 -10.015
3 HG2 LYS 69 HG2 LYS 69 2.069 4.728 -9.382
4 HD2 LYS 69 HD2 LYS 69 2.655 2.889 -7.085
5 HE2 LYS 69 HE2 LYS 69 4.053 4.641 -6.324
6 HZ1 LYS 69 HZ1 LYS 69 1.606 5.372 -6.116
7 HZ3 LYS 69 HZ2 LYS 69 1.854 6.201 -7.534
8 HZ2 LYS 69 HZ3 LYS 69 2.749 6.609 -6.199
9 H LYS 69 HN LYS 69 2.381 0.777 -8.145
10 HB3 LYS 69 HB1 LYS 69 0.817 3.048 -10.466
11 HG3 LYS 69 HG1 LYS 69 0.947 4.135 -8.176
12 HD3 LYS 69 HD1 LYS 69 3.761 3.190 -8.413
13 HE3 LYS 69 HE1 LYS 69 4.059 5.437 -7.895
No H/Q in entry = 13
In of MODEL 5
1 HA LEU 70 HA LEU 70 -1.997 -0.710 -11.170
2 HB2 LEU 70 HB2 LEU 70 -3.769 1.706 -11.517
3 HG LEU 70 HG LEU 70 -3.847 1.392 -9.161
4 HD11 LEU 70 HD11 LEU 70 -5.947 1.796 -10.236
5 HD13 LEU 70 HD12 LEU 70 -6.134 0.730 -8.833
6 HD12 LEU 70 HD13 LEU 70 -6.171 0.054 -10.461
7 HD23 LEU 70 HD21 LEU 70 -4.431 -0.729 -8.133
8 HD22 LEU 70 HD22 LEU 70 -2.889 -0.815 -8.987
9 HD21 LEU 70 HD23 LEU 70 -4.341 -1.516 -9.704
10 H LEU 70 HN LEU 70 -1.808 1.719 -9.666
11 HB3 LEU 70 HB1 LEU 70 -4.175 0.030 -11.817
No H/Q in entry = 11
In of MODEL 5
1 HA3 GLY 71 HA2 GLY 71 0.009 1.982 -14.266
2 H GLY 71 HN GLY 71 -1.278 2.601 -11.824
3 HA2 GLY 71 HA1 GLY 71 -1.426 3.012 -14.448
No H/Q in entry = 3
In of MODEL 5
1 HA3 GLY 72 HA2 GLY 72 2.399 5.806 -14.548
2 H GLY 72 HN GLY 72 1.225 3.862 -14.965
3 HA2 GLY 72 HA1 GLY 72 1.315 6.138 -13.200
No H/Q in entry = 3
In of MODEL 5
1 HA3 GLY 73 HA2 GLY 73 4.353 3.102 -11.281
2 H GLY 73 HN GLY 73 3.441 3.429 -13.943
3 HA2 GLY 73 HA1 GLY 73 5.052 2.358 -12.715
No H/Q in entry = 3
In of MODEL 5
1 HA SER 74 HA SER 74 6.770 6.810 -11.615
2 HB2 SER 74 HB2 SER 74 6.781 5.893 -8.747
3 HG SER 74 HG SER 74 5.028 7.448 -10.311
4 H SER 74 HN SER 74 5.176 4.940 -10.502
5 HB3 SER 74 HB1 SER 74 7.200 7.500 -9.349
No H/Q in entry = 5
In of MODEL 5
1 HA SER 75 HA SER 75 10.933 5.653 -10.977
2 HB2 SER 75 HB2 SER 75 10.343 5.073 -13.908
3 HG SER 75 HG SER 75 9.657 3.755 -11.717
4 H SER 75 HN SER 75 8.729 6.904 -12.282
5 HB3 SER 75 HB1 SER 75 11.808 4.611 -13.048
No H/Q in entry = 5
In of MODEL 6
1 H1 GLY 7 HT2 GLY 7 10.934 7.781 -10.643
2 H2 GLY 7 HT1 GLY 7 10.923 6.176 -10.190
3 H3 GLY 7 HT3 GLY 7 10.120 7.307 -9.228
4 HA3 GLY 7 HA1 GLY 7 12.234 8.368 -8.731
5 HA2 GLY 7 HA2 GLY 7 12.215 6.675 -8.245
No H/Q in entry = 5
In of MODEL 6
1 HA ALA 8 HA ALA 8 15.281 6.289 -11.350
2 HB2 ALA 8 HB1 ALA 8 16.726 5.887 -8.723
3 HB1 ALA 8 HB2 ALA 8 16.566 7.414 -9.589
4 HB3 ALA 8 HB3 ALA 8 17.498 6.094 -10.297
5 H ALA 8 HN ALA 8 14.056 5.702 -8.741
No H/Q in entry = 5
In of MODEL 6
1 HA MET 9 HA MET 9 13.005 2.027 -10.510
2 HB2 MET 9 HB2 MET 9 14.408 2.080 -12.594
3 HG2 MET 9 HG2 MET 9 15.032 -0.288 -12.727
4 HE1 MET 9 HE1 MET 9 13.099 0.243 -14.488
5 HE3 MET 9 HE2 MET 9 12.593 1.665 -13.572
6 HE2 MET 9 HE3 MET 9 11.407 0.456 -14.049
7 H MET 9 HN MET 9 13.450 4.212 -10.269
8 HB3 MET 9 HB1 MET 9 15.812 1.690 -11.618
9 HG3 MET 9 HG1 MET 9 14.774 -0.446 -10.993
No H/Q in entry = 9
In of MODEL 6
1 HA ALA 10 HA ALA 10 15.659 0.989 -6.989
2 HB1 ALA 10 HB1 ALA 10 18.287 0.910 -8.511
3 HB3 ALA 10 HB2 ALA 10 17.144 -0.419 -8.380
4 HB2 ALA 10 HB3 ALA 10 17.996 0.155 -6.945
5 H ALA 10 HN ALA 10 16.323 2.422 -9.444
No H/Q in entry = 5
In of MODEL 6
1 HA PRO 11 HA PRO 11 16.662 4.825 -5.105
2 HB2 PRO 11 HB2 PRO 11 17.987 3.964 -2.829
3 HG2 PRO 11 HG2 PRO 11 18.080 1.706 -3.346
4 HD2 PRO 11 HD2 PRO 11 16.778 0.766 -5.025
5 HB3 PRO 11 HB1 PRO 11 16.229 4.031 -3.008
6 HG3 PRO 11 HG1 PRO 11 16.487 1.771 -2.570
7 HD3 PRO 11 HD1 PRO 11 15.358 1.747 -4.605
No H/Q in entry = 7
In of MODEL 6
1 HA PRO 12 HA PRO 12 20.743 5.969 -6.460
2 HB2 PRO 12 HB2 PRO 12 21.039 8.188 -4.829
3 HG2 PRO 12 HG2 PRO 12 19.091 7.980 -3.599
4 HD2 PRO 12 HD2 PRO 12 17.373 6.576 -4.238
5 HB3 PRO 12 HB1 PRO 12 20.182 8.188 -6.371
6 HG3 PRO 12 HG1 PRO 12 18.460 8.887 -4.985
7 HD3 PRO 12 HD1 PRO 12 17.538 6.992 -5.960
No H/Q in entry = 7
In of MODEL 6
1 HA VAL 13 HA VAL 13 23.196 4.436 -3.271
2 HB VAL 13 HB VAL 13 25.381 5.135 -5.256
3 HG13 VAL 13 HG11 VAL 13 26.596 3.251 -4.254
4 HG12 VAL 13 HG12 VAL 13 25.270 2.991 -3.125
5 HG11 VAL 13 HG13 VAL 13 26.218 4.475 -3.042
6 HG22 VAL 13 HG21 VAL 13 25.064 2.893 -6.172
7 HG21 VAL 13 HG22 VAL 13 23.598 3.864 -6.343
8 HG23 VAL 13 HG23 VAL 13 23.708 2.637 -5.080
9 H VAL 13 HN VAL 13 22.892 5.886 -5.746
No H/Q in entry = 9
In of MODEL 6
1 HA ALA 14 HA ALA 14 24.423 7.415 -0.471
2 HB1 ALA 14 HB1 ALA 14 24.946 8.904 -2.374
3 HB2 ALA 14 HB2 ALA 14 24.162 9.807 -1.071
4 HB3 ALA 14 HB3 ALA 14 23.238 9.333 -2.499
5 H ALA 14 HN ALA 14 22.508 6.242 -2.140
No H/Q in entry = 5
In of MODEL 6
1 HA ALA 15 HA ALA 15 20.272 7.807 1.022
2 HB3 ALA 15 HB1 ALA 15 18.294 7.089 -0.288
3 HB1 ALA 15 HB2 ALA 15 19.361 6.215 -1.385
4 HB2 ALA 15 HB3 ALA 15 19.457 7.971 -1.276
5 H ALA 15 HN ALA 15 21.986 5.998 -0.456
No H/Q in entry = 5
In of MODEL 6
1 HA PRO 16 HA PRO 16 19.545 3.910 3.251
2 HB2 PRO 16 HB2 PRO 16 17.176 4.459 4.461
3 HG2 PRO 16 HG2 PRO 16 16.428 6.065 2.915
4 HD2 PRO 16 HD2 PRO 16 17.899 7.386 1.716
5 HB3 PRO 16 HB1 PRO 16 18.610 5.396 4.837
6 HG3 PRO 16 HG1 PRO 16 17.075 7.041 4.251
7 HD3 PRO 16 HD1 PRO 16 18.998 7.575 3.098
No H/Q in entry = 7
In of MODEL 6
1 HA SER 17 HA SER 17 16.457 1.421 1.267
2 HB2 SER 17 HB2 SER 17 14.147 1.057 2.385
3 HG SER 17 HG SER 17 13.882 2.869 3.582
4 H SER 17 HN SER 17 16.680 3.068 3.527
5 HB3 SER 17 HB1 SER 17 15.589 0.634 3.313
No H/Q in entry = 5
In of MODEL 6
1 HA PRO 18 HA PRO 18 14.313 3.909 -1.687
2 HB2 PRO 18 HB2 PRO 18 12.118 2.340 -2.334
3 HG2 PRO 18 HG2 PRO 18 12.453 0.648 -0.792
4 HD2 PRO 18 HD2 PRO 18 14.448 0.398 0.357
5 HB3 PRO 18 HB1 PRO 18 13.729 2.155 -3.033
6 HG3 PRO 18 HG1 PRO 18 13.484 0.046 -2.103
7 HD3 PRO 18 HD1 PRO 18 15.434 0.783 -1.063
No H/Q in entry = 7
In of MODEL 6
1 HA ALA 19 HA ALA 19 10.682 5.371 0.223
2 HB1 ALA 19 HB1 ALA 19 12.465 6.749 1.168
3 HB3 ALA 19 HB2 ALA 19 11.032 7.711 0.793
4 HB2 ALA 19 HB3 ALA 19 12.441 7.771 -0.266
5 H ALA 19 HN ALA 19 12.909 5.526 -1.643
No H/Q in entry = 5
In of MODEL 6
1 HA VAL 20 HA VAL 20 8.931 6.858 -3.490
2 HB VAL 20 HB VAL 20 7.427 4.284 -3.205
3 HG13 VAL 20 HG11 VAL 20 6.463 5.769 -4.747
4 HG12 VAL 20 HG12 VAL 20 7.258 4.513 -5.711
5 HG11 VAL 20 HG13 VAL 20 8.011 6.087 -5.513
6 HG21 VAL 20 HG21 VAL 20 9.766 3.621 -3.211
7 HG23 VAL 20 HG22 VAL 20 10.054 4.582 -4.666
8 HG22 VAL 20 HG23 VAL 20 8.994 3.167 -4.730
9 H VAL 20 HN VAL 20 9.286 4.889 -1.348
No H/Q in entry = 9
In of MODEL 6
1 HA THR 21 HA THR 21 5.202 7.294 -1.293
2 HB THR 21 HB THR 21 6.572 9.409 -1.301
3 HG1 THR 21 HG1 THR 21 5.030 9.822 0.013
4 HG22 THR 21 HG21 THR 21 4.662 10.124 -3.497
5 HG21 THR 21 HG22 THR 21 6.398 9.894 -3.648
6 HG23 THR 21 HG23 THR 21 5.764 11.273 -2.716
7 H THR 21 HN THR 21 6.697 7.610 -3.747
No H/Q in entry = 7
In of MODEL 6
1 HA TYR 22 HA TYR 22 1.814 7.684 -4.118
2 HB2 TYR 22 HB2 TYR 22 1.097 6.320 -1.516
3 HD1 TYR 22 HD1 TYR 22 0.558 4.542 -4.561
4 HD2 TYR 22 HD2 TYR 22 3.507 5.388 -1.604
5 HE1 TYR 22 HE1 TYR 22 1.793 2.586 -5.236
6 HE2 TYR 22 HE2 TYR 22 4.761 3.474 -2.272
7 HH TYR 22 HH TYR 22 4.328 1.256 -3.427
8 H TYR 22 HN TYR 22 3.007 8.261 -1.518
9 HB3 TYR 22 HB1 TYR 22 0.143 6.237 -2.985
No H/Q in entry = 9
In of MODEL 6
1 HA ALA 23 HA ALA 23 -0.875 10.651 -2.326
2 HB1 ALA 23 HB1 ALA 23 -0.648 11.210 -4.706
3 HB2 ALA 23 HB2 ALA 23 -2.245 11.605 -4.079
4 HB3 ALA 23 HB3 ALA 23 -2.019 10.160 -5.078
5 H ALA 23 HN ALA 23 -0.449 8.396 -4.144
No H/Q in entry = 5
In of MODEL 6
1 HA LEU 24 HA LEU 24 -4.303 8.519 -0.736
2 HB2 LEU 24 HB2 LEU 24 -5.385 11.292 -0.200
3 HG LEU 24 HG LEU 24 -3.146 11.257 0.783
4 HD13 LEU 24 HD11 LEU 24 -4.886 12.366 2.011
5 HD12 LEU 24 HD12 LEU 24 -3.766 11.578 3.128
6 HD11 LEU 24 HD13 LEU 24 -5.334 10.847 2.785
7 HD23 LEU 24 HD21 LEU 24 -2.550 9.585 2.482
8 HD22 LEU 24 HD22 LEU 24 -2.769 8.872 0.882
9 HD21 LEU 24 HD23 LEU 24 -4.030 8.703 2.102
10 H LEU 24 HN LEU 24 -2.875 10.886 -1.311
11 HB3 LEU 24 HB1 LEU 24 -5.754 9.804 0.596
No H/Q in entry = 11
In of MODEL 6
1 HA GLN 25 HA GLN 25 -8.198 7.530 -2.345
2 HB2 GLN 25 HB2 GLN 25 -8.012 10.348 -3.426
3 HG2 GLN 25 HG2 GLN 25 -9.243 9.253 -0.908
4 HE21 GLN 25 HE21 GLN 25 -9.600 11.788 -3.351
5 HE22 GLN 25 HE22 GLN 25 -10.965 12.516 -2.621
6 H GLN 25 HN GLN 25 -6.412 7.966 -1.162
7 HB3 GLN 25 HB1 GLN 25 -9.444 9.319 -3.485
8 HG3 GLN 25 HG1 GLN 25 -8.121 10.566 -1.113
No H/Q in entry = 8
In of MODEL 6
1 HA GLU 26 HA GLU 26 -6.035 6.925 -6.254
2 HB2 GLU 26 HB2 GLU 26 -3.936 8.091 -5.609
3 HG2 GLU 26 HG2 GLU 26 -2.258 6.762 -6.735
4 H GLU 26 HN GLU 26 -5.472 7.289 -3.413
5 HB3 GLU 26 HB1 GLU 26 -3.470 6.703 -4.644
6 HG3 GLU 26 HG1 GLU 26 -3.312 5.350 -6.664
No H/Q in entry = 6
In of MODEL 6
1 HA ASP 27 HA ASP 27 -6.369 2.721 -5.120
2 HB2 ASP 27 HB2 ASP 27 -6.929 2.700 -8.107
3 H ASP 27 HN ASP 27 -6.038 4.863 -7.090
4 HB3 ASP 27 HB1 ASP 27 -7.186 1.334 -7.035
No H/Q in entry = 4
In of MODEL 6
1 HA VAL 28 HA VAL 28 -2.790 0.671 -6.726
2 HB VAL 28 HB VAL 28 -1.218 0.570 -4.627
3 HG12 VAL 28 HG11 VAL 28 -2.279 3.247 -5.491
4 HG11 VAL 28 HG12 VAL 28 -1.081 2.284 -6.371
5 HG13 VAL 28 HG13 VAL 28 -0.710 2.895 -4.747
6 HG22 VAL 28 HG21 VAL 28 -3.005 0.677 -2.977
7 HG21 VAL 28 HG22 VAL 28 -3.461 2.273 -3.572
8 HG23 VAL 28 HG23 VAL 28 -1.888 2.033 -2.811
9 H VAL 28 HN VAL 28 -5.017 1.090 -4.881
No H/Q in entry = 9
In of MODEL 6
1 HA PHE 29 HA PHE 29 -3.509 -3.310 -5.195
2 HB2 PHE 29 HB2 PHE 29 -1.093 -3.574 -6.966
3 HD1 PHE 29 HD1 PHE 29 -2.013 -3.032 -9.014
4 HD2 PHE 29 HD2 PHE 29 -4.051 -5.695 -6.405
5 HE1 PHE 29 HE1 PHE 29 -3.572 -3.581 -10.807
6 HE2 PHE 29 HE2 PHE 29 -5.626 -6.252 -8.197
7 HZ PHE 29 HZ PHE 29 -5.393 -5.200 -10.404
8 H PHE 29 HN PHE 29 -1.748 -1.366 -6.416
9 HB3 PHE 29 HB1 PHE 29 -1.655 -4.959 -6.060
No H/Q in entry = 9
In of MODEL 6
1 HA ILE 30 HA ILE 30 -0.470 -3.890 -1.989
2 HB ILE 30 HB ILE 30 -3.264 -4.090 -0.854
3 HG12 ILE 30 HG12 ILE 30 -2.654 -2.111 0.406
4 HG23 ILE 30 HG21 ILE 30 -2.041 -5.680 0.478
5 HG22 ILE 30 HG22 ILE 30 -2.354 -4.233 1.442
6 HG21 ILE 30 HG23 ILE 30 -0.752 -4.510 0.759
7 HD11 ILE 30 HD11 ILE 30 -3.519 -1.715 -1.839
8 HD13 ILE 30 HD12 ILE 30 -1.847 -1.762 -2.425
9 HD12 ILE 30 HD13 ILE 30 -2.358 -0.481 -1.314
10 H ILE 30 HN ILE 30 -3.001 -4.502 -3.363
11 HG13 ILE 30 HG11 ILE 30 -1.019 -2.169 -0.233
No H/Q in entry = 11
In of MODEL 6
1 HA LYS 31 HA LYS 31 -0.186 -8.218 -1.974
2 HB2 LYS 31 HB2 LYS 31 1.784 -7.615 -3.107
3 HG2 LYS 31 HG2 LYS 31 2.550 -9.178 -0.668
4 HD2 LYS 31 HD2 LYS 31 3.921 -9.030 -3.345
5 HE2 LYS 31 HE2 LYS 31 4.641 -10.339 -0.742
6 HZ3 LYS 31 HZ1 LYS 31 6.055 -10.370 -3.360
7 HZ2 LYS 31 HZ2 LYS 31 6.479 -11.267 -2.021
8 HZ1 LYS 31 HZ3 LYS 31 6.607 -9.585 -1.966
9 H LYS 31 HN LYS 31 0.701 -5.470 -1.637
10 HB3 LYS 31 HB1 LYS 31 2.486 -6.893 -1.679
11 HG3 LYS 31 HG1 LYS 31 1.965 -9.816 -2.202
12 HD3 LYS 31 HD1 LYS 31 4.486 -8.202 -1.885
13 HE3 LYS 31 HE1 LYS 31 4.093 -11.167 -2.194
No H/Q in entry = 13
In of MODEL 6
1 HA CYS 32 HA CYS 32 0.104 -8.624 2.334
2 HB2 CYS 32 HB2 CYS 32 -1.429 -10.392 3.105
3 HG CYS 32 HG CYS 32 -2.999 -12.029 1.698
4 H CYS 32 HN CYS 32 -0.709 -9.430 -0.341
5 HB3 CYS 32 HB1 CYS 32 -2.246 -9.302 1.993
No H/Q in entry = 5
In of MODEL 6
1 HA ASN 33 HA ASN 33 3.234 -11.497 2.805
2 HB2 ASN 33 HB2 ASN 33 2.765 -11.240 5.192
3 HD21 ASN 33 HD21 ASN 33 4.973 -11.646 5.136
4 HD22 ASN 33 HD22 ASN 33 5.623 -13.221 5.368
5 H ASN 33 HN ASN 33 0.752 -10.612 3.755
6 HB3 ASN 33 HB1 ASN 33 1.630 -12.582 5.136
No H/Q in entry = 6
In of MODEL 6
1 HA ASP 34 HA ASP 34 1.068 -15.534 1.783
2 HB2 ASP 34 HB2 ASP 34 -1.239 -15.222 2.627
3 H ASP 34 HN ASP 34 0.104 -12.908 2.456
4 HB3 ASP 34 HB1 ASP 34 -1.636 -14.288 1.192
No H/Q in entry = 4
In of MODEL 6
1 HA3 GLY 35 HA2 GLY 35 2.255 -12.300 -1.866
2 H GLY 35 HN GLY 35 1.117 -12.604 0.157
3 HA2 GLY 35 HA1 GLY 35 1.924 -13.972 -2.294
No H/Q in entry = 3
In of MODEL 6
1 HA ARG 36 HA ARG 36 -2.008 -12.464 -3.773
2 HB2 ARG 36 HB2 ARG 36 -3.273 -11.838 -1.113
3 HG2 ARG 36 HG2 ARG 36 -2.453 -14.146 -1.111
4 HD2 ARG 36 HD2 ARG 36 -4.368 -14.528 -3.393
5 HE ARG 36 HE ARG 36 -2.986 -16.336 -1.617
6 HH11 ARG 36 HH11 ARG 36 -4.903 -15.992 -4.603
7 HH12 ARG 36 HH12 ARG 36 -5.346 -17.634 -4.675
8 HH21 ARG 36 HH21 ARG 36 -3.618 -18.587 -1.733
9 HH22 ARG 36 HH22 ARG 36 -4.601 -19.152 -3.010
10 H ARG 36 HN ARG 36 -0.822 -12.530 -1.119
11 HB3 ARG 36 HB1 ARG 36 -4.101 -12.152 -2.628
12 HG3 ARG 36 HG1 ARG 36 -4.206 -14.004 -1.038
13 HD3 ARG 36 HD1 ARG 36 -2.607 -14.616 -3.523
No H/Q in entry = 13
In of MODEL 6
1 HA PHE 37 HA PHE 37 -2.093 -8.152 -3.444
2 HB2 PHE 37 HB2 PHE 37 -2.121 -8.942 -6.314
3 HD1 PHE 37 HD1 PHE 37 -0.981 -5.912 -4.556
4 HD2 PHE 37 HD2 PHE 37 0.159 -9.562 -6.399
5 HE1 PHE 37 HE1 PHE 37 1.290 -5.182 -4.472
6 HE2 PHE 37 HE2 PHE 37 2.514 -8.855 -6.301
7 HZ PHE 37 HZ PHE 37 3.106 -6.658 -5.352
8 H PHE 37 HN PHE 37 -2.753 -10.662 -4.753
9 HB3 PHE 37 HB1 PHE 37 -2.580 -7.297 -5.896
No H/Q in entry = 9
In of MODEL 6
1 HA TYR 38 HA TYR 38 -6.354 -7.319 -3.726
2 HB2 TYR 38 HB2 TYR 38 -5.240 -6.166 -1.165
3 HD1 TYR 38 HD1 TYR 38 -3.964 -8.182 -0.657
4 HD2 TYR 38 HD2 TYR 38 -8.151 -8.303 -1.344
5 HE1 TYR 38 HE1 TYR 38 -4.063 -10.410 0.381
6 HE2 TYR 38 HE2 TYR 38 -8.265 -10.531 -0.319
7 HH TYR 38 HH TYR 38 -5.729 -11.880 1.474
8 H TYR 38 HN TYR 38 -3.576 -6.878 -2.871
9 HB3 TYR 38 HB1 TYR 38 -6.946 -6.247 -1.551
No H/Q in entry = 9
In of MODEL 6
1 HA LEU 39 HA LEU 39 -5.620 -3.232 -5.119
2 HB2 LEU 39 HB2 LEU 39 -6.694 -4.208 -7.112
3 HG LEU 39 HG LEU 39 -8.181 -1.619 -6.598
4 HD12 LEU 39 HD11 LEU 39 -6.248 -0.521 -7.604
5 HD11 LEU 39 HD12 LEU 39 -5.381 -2.063 -7.597
6 HD13 LEU 39 HD13 LEU 39 -5.828 -1.292 -6.076
7 HD22 LEU 39 HD21 LEU 39 -8.050 -1.380 -8.966
8 HD21 LEU 39 HD22 LEU 39 -8.753 -2.976 -8.628
9 HD23 LEU 39 HD23 LEU 39 -7.046 -2.807 -9.094
10 H LEU 39 HN LEU 39 -7.099 -5.678 -4.941
11 HB3 LEU 39 HB1 LEU 39 -8.263 -4.026 -6.363
No H/Q in entry = 11
In of MODEL 6
1 HA3 GLY 40 HA2 GLY 40 -8.415 -1.082 -2.499
2 H GLY 40 HN GLY 40 -5.860 -1.512 -3.870
3 HA2 GLY 40 HA1 GLY 40 -6.925 -1.156 -1.575
No H/Q in entry = 3
In of MODEL 6
1 HA THR 41 HA THR 41 -7.107 3.072 -3.107
2 HB THR 41 HB THR 41 -9.536 3.351 -1.330
3 HG1 THR 41 HG1 THR 41 -9.386 2.602 -4.103
4 HG21 THR 41 HG21 THR 41 -8.464 5.438 -2.081
5 HG23 THR 41 HG22 THR 41 -10.054 5.232 -2.820
6 HG22 THR 41 HG23 THR 41 -8.594 4.905 -3.756
7 H THR 41 HN THR 41 -8.352 1.074 -1.347
No H/Q in entry = 7
In of MODEL 6
1 HA ILE 42 HA ILE 42 -4.979 4.065 0.684
2 HB ILE 42 HB ILE 42 -4.056 6.365 -1.057
3 HG12 ILE 42 HG12 ILE 42 -2.908 3.595 -0.785
4 HG23 ILE 42 HG21 ILE 42 -3.535 6.570 1.348
5 HG22 ILE 42 HG22 ILE 42 -2.059 6.280 0.425
6 HG21 ILE 42 HG23 ILE 42 -2.808 4.967 1.333
7 HD11 ILE 42 HD11 ILE 42 -1.898 5.866 -2.416
8 HD13 ILE 42 HD12 ILE 42 -1.326 4.186 -2.446
9 HD12 ILE 42 HD13 ILE 42 -1.148 5.152 -0.983
10 H ILE 42 HN ILE 42 -5.675 4.463 -2.096
11 HG13 ILE 42 HG11 ILE 42 -3.696 4.233 -2.219
No H/Q in entry = 11
In of MODEL 6
1 HA ILE 43 HA ILE 43 -7.178 7.590 1.970
2 HB ILE 43 HB ILE 43 -8.226 7.219 4.185
3 HG12 ILE 43 HG12 ILE 43 -6.330 5.490 4.713
4 HG21 ILE 43 HG21 ILE 43 -8.659 5.211 2.020
5 HG23 ILE 43 HG22 ILE 43 -9.524 6.745 2.282
6 HG22 ILE 43 HG23 ILE 43 -9.690 5.396 3.426
7 HD13 ILE 43 HD11 ILE 43 -7.550 3.182 4.732
8 HD12 ILE 43 HD12 ILE 43 -6.398 3.750 3.547
9 HD11 ILE 43 HD13 ILE 43 -8.102 3.843 3.177
10 H ILE 43 HN ILE 43 -5.528 5.214 2.433
11 HG13 ILE 43 HG11 ILE 43 -7.880 5.264 5.483
No H/Q in entry = 11
In of MODEL 6
1 HA ASP 44 HA ASP 44 -3.919 9.003 4.639
2 HB2 ASP 44 HB2 ASP 44 -5.290 7.844 6.528
3 H ASP 44 HN ASP 44 -4.526 6.287 3.850
4 HB3 ASP 44 HB1 ASP 44 -3.887 6.826 6.744
No H/Q in entry = 4
In of MODEL 6
1 HA GLN 45 HA GLN 45 -0.056 6.792 4.705
2 HB2 GLN 45 HB2 GLN 45 1.378 8.094 3.275
3 HG2 GLN 45 HG2 GLN 45 -0.128 10.170 2.271
4 HE21 GLN 45 HE21 GLN 45 1.507 10.815 5.237
5 HE22 GLN 45 HE22 GLN 45 2.993 11.371 4.549
6 H GLN 45 HN GLN 45 -1.631 9.105 5.446
7 HB3 GLN 45 HB1 GLN 45 -0.257 7.953 2.621
8 HG3 GLN 45 HG1 GLN 45 -0.288 10.317 4.026
No H/Q in entry = 8
In of MODEL 6
1 HA THR 46 HA THR 46 2.515 8.956 7.405
2 HB THR 46 HB THR 46 3.669 7.299 8.927
3 HG1 THR 46 HG1 THR 46 3.034 5.101 8.689
4 HG23 THR 46 HG21 THR 46 1.664 6.389 9.998
5 HG22 THR 46 HG22 THR 46 0.720 6.756 8.562
6 HG21 THR 46 HG23 THR 46 1.413 8.069 9.522
7 H THR 46 HN THR 46 1.819 6.668 5.774
No H/Q in entry = 7
In of MODEL 6
1 HA SER 47 HA SER 47 6.331 8.666 5.405
2 HB2 SER 47 HB2 SER 47 7.104 9.904 7.459
3 HG SER 47 HG SER 47 8.519 9.524 5.679
4 H SER 47 HN SER 47 5.123 8.352 7.967
5 HB3 SER 47 HB1 SER 47 7.674 8.373 8.112
No H/Q in entry = 5
In of MODEL 6
1 HA ASP 48 HA ASP 48 7.457 4.338 5.894
2 HB2 ASP 48 HB2 ASP 48 6.065 3.882 8.515
3 H ASP 48 HN ASP 48 5.446 6.015 7.228
4 HB3 ASP 48 HB1 ASP 48 6.961 2.638 7.650
No H/Q in entry = 4
In of MODEL 6
1 HA GLN 49 HA GLN 49 3.578 2.314 5.018
2 HB2 GLN 49 HB2 GLN 49 2.393 2.806 7.738
3 HG2 GLN 49 HG2 GLN 49 3.853 0.406 6.639
4 HE21 GLN 49 HE21 GLN 49 3.963 1.702 9.825
5 HE22 GLN 49 HE22 GLN 49 3.209 0.365 10.608
6 H GLN 49 HN GLN 49 4.042 4.612 6.762
7 HB3 GLN 49 HB1 GLN 49 1.757 1.628 6.600
8 HG3 GLN 49 HG1 GLN 49 4.568 1.625 7.686
No H/Q in entry = 8
In of MODEL 6
1 HA TYR 50 HA TYR 50 -0.012 4.704 4.144
2 HB2 TYR 50 HB2 TYR 50 0.396 2.594 2.013
3 HD1 TYR 50 HD1 TYR 50 0.085 6.151 1.528
4 HD2 TYR 50 HD2 TYR 50 2.928 2.981 1.919
5 HE1 TYR 50 HE1 TYR 50 1.866 7.633 0.773
6 HE2 TYR 50 HE2 TYR 50 4.675 4.444 1.173
7 HH TYR 50 HH TYR 50 4.397 7.728 1.065
8 H TYR 50 HN TYR 50 1.332 2.118 4.380
9 HB3 TYR 50 HB1 TYR 50 -0.704 3.961 1.865
No H/Q in entry = 9
In of MODEL 6
1 HA LEU 51 HA LEU 51 -3.214 2.176 5.617
2 HB2 LEU 51 HB2 LEU 51 -3.500 4.430 6.855
3 HG LEU 51 HG LEU 51 -6.105 3.175 6.022
4 HD13 LEU 51 HD11 LEU 51 -4.678 1.514 6.955
5 HD12 LEU 51 HD12 LEU 51 -5.947 1.923 8.116
6 HD11 LEU 51 HD13 LEU 51 -4.302 2.551 8.326
7 HD23 LEU 51 HD21 LEU 51 -6.944 4.114 8.121
8 HD22 LEU 51 HD22 LEU 51 -6.417 5.352 6.988
9 HD21 LEU 51 HD23 LEU 51 -5.389 4.926 8.370
10 H LEU 51 HN LEU 51 -2.074 4.663 4.675
11 HB3 LEU 51 HB1 LEU 51 -4.483 4.914 5.507
No H/Q in entry = 11
In of MODEL 6
1 HA ILE 52 HA ILE 52 -5.354 2.233 1.830
2 HB ILE 52 HB ILE 52 -4.655 -0.700 2.108
3 HG12 ILE 52 HG12 ILE 52 -2.623 0.578 2.506
4 HG21 ILE 52 HG21 ILE 52 -6.194 -0.093 0.285
5 HG23 ILE 52 HG22 ILE 52 -4.641 -0.657 -0.332
6 HG22 ILE 52 HG23 ILE 52 -5.002 1.061 -0.327
7 HD12 ILE 52 HD11 ILE 52 -1.680 2.114 0.893
8 HD11 ILE 52 HD12 ILE 52 -3.285 2.678 1.364
9 HD13 ILE 52 HD13 ILE 52 -3.056 1.820 -0.169
10 H ILE 52 HN ILE 52 -4.238 0.962 4.230
11 HG13 ILE 52 HG11 ILE 52 -2.539 -0.200 0.936
No H/Q in entry = 11
In of MODEL 6
1 HA ARG 53 HA ARG 53 -9.002 0.356 3.202
2 HB2 ARG 53 HB2 ARG 53 -9.585 2.781 3.388
3 HG2 ARG 53 HG2 ARG 53 -11.896 1.630 1.937
4 HD2 ARG 53 HD2 ARG 53 -13.088 2.500 3.895
5 HE ARG 53 HE ARG 53 -12.411 4.073 2.020
6 HH11 ARG 53 HH11 ARG 53 -11.368 4.714 5.384
7 HH12 ARG 53 HH12 ARG 53 -11.768 6.353 5.323
8 HH21 ARG 53 HH21 ARG 53 -12.861 6.315 1.958
9 HH22 ARG 53 HH22 ARG 53 -12.636 7.327 3.318
10 H ARG 53 HN ARG 53 -7.469 2.081 1.451
11 HB3 ARG 53 HB1 ARG 53 -9.944 2.818 1.679
12 HG3 ARG 53 HG1 ARG 53 -11.347 0.875 3.434
13 HD3 ARG 53 HD1 ARG 53 -11.564 3.011 4.601
No H/Q in entry = 13
In of MODEL 6
1 HA PHE 54 HA PHE 54 -9.577 -1.710 -0.524
2 HB2 PHE 54 HB2 PHE 54 -10.193 -3.659 1.693
3 HD1 PHE 54 HD1 PHE 54 -8.271 -3.081 3.115
4 HD2 PHE 54 HD2 PHE 54 -7.736 -3.894 -1.027
5 HE1 PHE 54 HE1 PHE 54 -5.826 -3.179 3.449
6 HE2 PHE 54 HE2 PHE 54 -5.309 -4.004 -0.692
7 HZ PHE 54 HZ PHE 54 -4.354 -3.639 1.545
8 H PHE 54 HN PHE 54 -9.716 -1.323 2.336
9 HB3 PHE 54 HB1 PHE 54 -9.931 -4.081 0.005
No H/Q in entry = 9
In of MODEL 6
1 HA ASP 55 HA ASP 55 -13.650 -1.678 -1.588
2 HB2 ASP 55 HB2 ASP 55 -13.149 -3.369 -3.220
3 H ASP 55 HN ASP 55 -11.457 -3.333 -1.241
4 HB3 ASP 55 HB1 ASP 55 -13.402 -4.640 -2.030
No H/Q in entry = 4
In of MODEL 6
1 HA ASP 56 HA ASP 56 -15.922 -3.992 1.697
2 HB2 ASP 56 HB2 ASP 56 -14.595 -6.168 1.803
3 H ASP 56 HN ASP 56 -13.142 -4.181 0.802
4 HB3 ASP 56 HB1 ASP 56 -13.644 -5.443 3.089
No H/Q in entry = 4
In of MODEL 6
1 HA GLN 57 HA GLN 57 -13.225 -0.049 2.897
2 HB2 GLN 57 HB2 GLN 57 -15.576 -0.793 4.644
3 HG2 GLN 57 HG2 GLN 57 -16.184 -0.483 2.291
4 HE21 GLN 57 HE21 GLN 57 -14.680 0.043 0.731
5 HE22 GLN 57 HE22 GLN 57 -14.290 1.670 0.333
6 H GLN 57 HN GLN 57 -13.623 -1.920 1.814
7 HB3 GLN 57 HB1 GLN 57 -14.788 0.776 4.640
8 HG3 GLN 57 HG1 GLN 57 -16.867 0.772 3.312
No H/Q in entry = 8
In of MODEL 6
1 HA SER 58 HA SER 58 -11.448 -2.672 6.400
2 HB2 SER 58 HB2 SER 58 -10.073 -3.916 4.030
3 HG SER 58 HG SER 58 -12.310 -4.942 5.453
4 H SER 58 HN SER 58 -12.318 -2.739 3.726
5 HB3 SER 58 HB1 SER 58 -10.096 -4.483 5.698
No H/Q in entry = 5
In of MODEL 6
1 HA GLU 59 HA GLU 59 -8.033 -0.076 5.257
2 HB2 GLU 59 HB2 GLU 59 -8.842 0.885 8.010
3 HG2 GLU 59 HG2 GLU 59 -9.594 1.944 5.290
4 H GLU 59 HN GLU 59 -9.773 -1.377 7.222
5 HB3 GLU 59 HB1 GLU 59 -7.791 1.716 6.863
6 HG3 GLU 59 HG1 GLU 59 -10.656 1.005 6.330
No H/Q in entry = 6
In of MODEL 6
1 HA GLN 60 HA GLN 60 -4.862 -1.620 7.948
2 HB2 GLN 60 HB2 GLN 60 -4.443 -2.926 5.247
3 HG2 GLN 60 HG2 GLN 60 -5.635 -4.066 7.752
4 HE21 GLN 60 HE21 GLN 60 -7.068 -5.882 5.978
5 HE22 GLN 60 HE22 GLN 60 -5.935 -7.107 5.535
6 H GLN 60 HN GLN 60 -5.962 -0.576 5.418
7 HB3 GLN 60 HB1 GLN 60 -3.542 -3.320 6.697
8 HG3 GLN 60 HG1 GLN 60 -6.487 -3.743 6.243
No H/Q in entry = 8
In of MODEL 6
1 HA TRP 61 HA TRP 61 -1.574 0.820 6.486
2 HB2 TRP 61 HB2 TRP 61 -0.735 -0.246 9.190
3 HD1 TRP 61 HD1 TRP 61 -2.632 0.811 10.604
4 HE1 TRP 61 HE1 TRP 61 -3.476 3.201 10.968
5 HE3 TRP 61 HE3 TRP 61 0.025 3.096 6.937
6 HZ2 TRP 61 HZ2 TRP 61 -3.037 5.794 9.771
7 HZ3 TRP 61 HZ3 TRP 61 -0.240 5.517 6.590
8 HH2 TRP 61 HH2 TRP 61 -1.711 6.817 7.944
9 H TRP 61 HN TRP 61 -2.677 -1.214 8.240
10 HB3 TRP 61 HB1 TRP 61 0.289 0.839 8.264
No H/Q in entry = 10
In of MODEL 6
1 HA CYS 62 HA CYS 62 0.928 -2.346 4.942
2 HB2 CYS 62 HB2 CYS 62 -0.181 -0.884 2.552
3 HG CYS 62 HG CYS 62 -2.412 -1.424 4.097
4 H CYS 62 HN CYS 62 -0.429 0.243 4.864
5 HB3 CYS 62 HB1 CYS 62 0.457 -2.524 2.609
No H/Q in entry = 5
In of MODEL 6
1 HA GLU 63 HA GLU 63 4.648 -0.132 4.229
2 HB2 GLU 63 HB2 GLU 63 5.086 -2.905 3.163
3 HG2 GLU 63 HG2 GLU 63 6.292 -1.900 5.630
4 H GLU 63 HN GLU 63 2.963 -2.426 4.130
5 HB3 GLU 63 HB1 GLU 63 6.360 -1.725 3.408
6 HG3 GLU 63 HG1 GLU 63 4.588 -2.358 5.652
No H/Q in entry = 6
In of MODEL 6
1 HA PRO 64 HA PRO 64 4.478 1.183 -0.018
2 HB2 PRO 64 HB2 PRO 64 7.040 2.005 -0.434
3 HG2 PRO 64 HG2 PRO 64 8.098 1.230 1.490
4 HD2 PRO 64 HD2 PRO 64 6.894 0.237 3.136
5 HB3 PRO 64 HB1 PRO 64 5.873 2.928 0.485
6 HG3 PRO 64 HG1 PRO 64 7.448 2.739 2.149
7 HD3 PRO 64 HD1 PRO 64 5.822 1.590 3.395
No H/Q in entry = 7
In of MODEL 6
1 HA ASP 65 HA ASP 65 7.633 -2.316 -1.314
2 HB2 ASP 65 HB2 ASP 65 8.689 -2.933 0.699
3 H ASP 65 HN ASP 65 6.709 -1.124 1.049
4 HB3 ASP 65 HB1 ASP 65 7.163 -3.297 1.491
No H/Q in entry = 4
In of MODEL 6
1 HA LYS 66 HA LYS 66 3.782 -4.919 -1.084
2 HB2 LYS 66 HB2 LYS 66 2.400 -3.335 1.069
3 HG2 LYS 66 HG2 LYS 66 4.301 -4.479 1.978
4 HD2 LYS 66 HD2 LYS 66 3.115 -6.910 0.658
5 HE2 LYS 66 HE2 LYS 66 3.791 -7.402 2.910
6 HZ1 LYS 66 HZ1 LYS 66 6.420 -6.280 2.065
7 HZ3 LYS 66 HZ2 LYS 66 6.254 -7.309 3.394
8 HZ2 LYS 66 HZ3 LYS 66 5.500 -5.817 3.420
9 H LYS 66 HN LYS 66 4.559 -2.489 0.323
10 HB3 LYS 66 HB1 LYS 66 1.775 -4.814 0.363
11 HG3 LYS 66 HG1 LYS 66 2.801 -5.253 2.500
12 HD3 LYS 66 HD1 LYS 66 4.689 -6.181 0.342
13 HE3 LYS 66 HE1 LYS 66 4.822 -8.194 1.719
No H/Q in entry = 13
In of MODEL 6
1 HA LEU 67 HA LEU 67 1.006 -1.709 -2.884
2 HB2 LEU 67 HB2 LEU 67 2.904 0.533 -2.268
3 HG LEU 67 HG LEU 67 0.998 -0.647 -0.572
4 HD11 LEU 67 HD11 LEU 67 2.350 2.042 -0.612
5 HD13 LEU 67 HD12 LEU 67 2.775 0.560 0.305
6 HD12 LEU 67 HD13 LEU 67 1.338 1.461 0.707
7 HD21 LEU 67 HD21 LEU 67 -0.660 0.386 -2.019
8 HD23 LEU 67 HD22 LEU 67 0.024 1.974 -1.616
9 HD22 LEU 67 HD23 LEU 67 -0.681 0.949 -0.358
10 H LEU 67 HN LEU 67 3.684 -1.700 -1.684
11 HB3 LEU 67 HB1 LEU 67 1.387 0.703 -3.097
No H/Q in entry = 11
In of MODEL 6
1 HA ARG 68 HA ARG 68 2.998 -0.907 -6.691
2 HB2 ARG 68 HB2 ARG 68 0.805 -2.932 -7.141
3 HG2 ARG 68 HG2 ARG 68 2.650 -3.715 -5.770
4 HD2 ARG 68 HD2 ARG 68 4.300 -3.024 -8.203
5 HE ARG 68 HE ARG 68 5.210 -5.003 -7.442
6 HH11 ARG 68 HH11 ARG 68 5.161 -2.507 -4.927
7 HH12 ARG 68 HH12 ARG 68 6.348 -3.231 -3.950
8 HH21 ARG 68 HH21 ARG 68 6.943 -5.954 -6.171
9 HH22 ARG 68 HH22 ARG 68 7.456 -5.261 -4.714
10 H ARG 68 HN ARG 68 0.699 -1.440 -4.945
11 HB3 ARG 68 HB1 ARG 68 1.949 -2.427 -8.370
12 HG3 ARG 68 HG1 ARG 68 2.545 -4.572 -7.321
13 HD3 ARG 68 HD1 ARG 68 4.448 -2.331 -6.592
No H/Q in entry = 13
In of MODEL 6
1 HA LYS 69 HA LYS 69 0.349 2.213 -8.054
2 HB2 LYS 69 HB2 LYS 69 2.704 2.288 -9.955
3 HG2 LYS 69 HG2 LYS 69 3.339 4.384 -8.774
4 HD2 LYS 69 HD2 LYS 69 3.385 2.046 -6.900
5 HE2 LYS 69 HE2 LYS 69 5.474 4.146 -7.402
6 HZ2 LYS 69 HZ1 LYS 69 6.601 3.011 -5.533
7 HZ1 LYS 69 HZ2 LYS 69 6.364 1.904 -6.753
8 HZ3 LYS 69 HZ3 LYS 69 5.335 1.931 -5.436
9 H LYS 69 HN LYS 69 2.696 0.624 -8.064
10 HB3 LYS 69 HB1 LYS 69 1.447 3.499 -9.861
11 HG3 LYS 69 HG1 LYS 69 2.202 3.968 -7.507
12 HD3 LYS 69 HD1 LYS 69 4.429 2.102 -8.331
13 HE3 LYS 69 HE1 LYS 69 4.429 4.061 -5.996
No H/Q in entry = 13
In of MODEL 6
1 HA LEU 70 HA LEU 70 -1.486 -0.177 -11.258
2 HB2 LEU 70 HB2 LEU 70 -3.278 2.251 -11.374
3 HG LEU 70 HG LEU 70 -3.513 1.488 -9.131
4 HD13 LEU 70 HD11 LEU 70 -5.790 0.745 -9.080
5 HD12 LEU 70 HD12 LEU 70 -5.703 0.287 -10.778
6 HD11 LEU 70 HD13 LEU 70 -5.589 1.996 -10.316
7 HD23 LEU 70 HD21 LEU 70 -4.093 -0.810 -8.588
8 HD22 LEU 70 HD22 LEU 70 -2.478 -0.671 -9.277
9 HD21 LEU 70 HD23 LEU 70 -3.826 -1.277 -10.262
10 H LEU 70 HN LEU 70 -1.302 2.173 -9.595
11 HB3 LEU 70 HB1 LEU 70 -3.627 0.664 -12.019
No H/Q in entry = 11
In of MODEL 6
1 HA3 GLY 71 HA2 GLY 71 0.015 2.548 -14.473
2 H GLY 71 HN GLY 71 -0.704 3.166 -11.713
3 HA2 GLY 71 HA1 GLY 71 -0.613 4.122 -13.973
No H/Q in entry = 3
In of MODEL 6
1 HA3 GLY 72 HA2 GLY 72 4.271 3.264 -14.673
2 H GLY 72 HN GLY 72 2.091 2.550 -14.749
3 HA2 GLY 72 HA1 GLY 72 3.769 4.604 -13.643
No H/Q in entry = 3
In of MODEL 6
1 HA3 GLY 73 HA2 GLY 73 4.634 1.475 -10.569
2 H GLY 73 HN GLY 73 3.235 1.195 -13.121
3 HA2 GLY 73 HA1 GLY 73 3.440 0.241 -10.958
No H/Q in entry = 3
In of MODEL 6
1 HA SER 74 HA SER 74 7.551 -1.182 -12.652
2 HB2 SER 74 HB2 SER 74 9.264 0.814 -11.157
3 HG SER 74 HG SER 74 8.018 0.932 -13.652
4 H SER 74 HN SER 74 6.755 1.251 -11.337
5 HB3 SER 74 HB1 SER 74 9.783 -0.311 -12.415
No H/Q in entry = 5
In of MODEL 6
1 HA SER 75 HA SER 75 7.296 -2.239 -8.108
2 HB2 SER 75 HB2 SER 75 9.844 -0.595 -7.721
3 HG SER 75 HG SER 75 9.367 -2.660 -9.269
4 H SER 75 HN SER 75 7.537 0.205 -9.425
5 HB3 SER 75 HB1 SER 75 9.329 -1.916 -6.675
No H/Q in entry = 5
In of MODEL 7
1 H1 GLY 7 HT2 GLY 7 12.085 -0.569 -2.320
2 H2 GLY 7 HT1 GLY 7 11.283 -0.383 -0.824
3 H3 GLY 7 HT3 GLY 7 12.589 -1.442 -0.983
4 HA3 GLY 7 HA1 GLY 7 10.603 -2.698 -0.929
5 HA2 GLY 7 HA2 GLY 7 9.985 -1.765 -2.291
No H/Q in entry = 5
In of MODEL 7
1 HA ALA 8 HA ALA 8 12.551 -5.159 -3.858
2 HB3 ALA 8 HB1 ALA 8 11.263 -6.833 -2.595
3 HB1 ALA 8 HB2 ALA 8 11.438 -7.313 -4.282
4 HB2 ALA 8 HB3 ALA 8 9.912 -6.638 -3.710
5 H ALA 8 HN ALA 8 10.019 -4.352 -2.704
No H/Q in entry = 5
In of MODEL 7
1 HA MET 9 HA MET 9 12.193 -3.959 -7.909
2 HB2 MET 9 HB2 MET 9 9.708 -3.799 -7.555
3 HG2 MET 9 HG2 MET 9 9.145 -2.133 -9.204
4 HE2 MET 9 HE1 MET 9 10.083 -5.590 -10.843
5 HE1 MET 9 HE2 MET 9 8.776 -4.573 -10.237
6 HE3 MET 9 HE3 MET 9 9.952 -5.264 -9.117
7 H MET 9 HN MET 9 12.550 -3.496 -5.279
8 HB3 MET 9 HB1 MET 9 9.933 -2.187 -6.897
9 HG3 MET 9 HG1 MET 9 10.728 -1.378 -9.032
No H/Q in entry = 9
In of MODEL 7
1 HA ALA 10 HA ALA 10 14.031 -0.004 -7.625
2 HB1 ALA 10 HB1 ALA 10 16.187 -0.149 -6.409
3 HB2 ALA 10 HB2 ALA 10 16.054 -1.909 -6.436
4 HB3 ALA 10 HB3 ALA 10 14.868 -0.950 -5.556
5 H ALA 10 HN ALA 10 14.046 -2.824 -8.227
No H/Q in entry = 5
In of MODEL 7
1 HA PRO 11 HA PRO 11 16.303 0.009 -11.522
2 HB2 PRO 11 HB2 PRO 11 17.898 2.230 -10.826
3 HG2 PRO 11 HG2 PRO 11 16.920 2.722 -8.789
4 HD2 PRO 11 HD2 PRO 11 14.979 1.673 -8.091
5 HB3 PRO 11 HB1 PRO 11 16.364 2.295 -11.694
6 HG3 PRO 11 HG1 PRO 11 15.732 3.515 -9.836
7 HD3 PRO 11 HD1 PRO 11 14.240 1.743 -9.702
No H/Q in entry = 7
In of MODEL 7
1 HA PRO 12 HA PRO 12 19.838 -2.268 -9.766
2 HB2 PRO 12 HB2 PRO 12 20.509 -2.896 -12.547
3 HG2 PRO 12 HG2 PRO 12 18.415 -3.410 -13.358
4 HD2 PRO 12 HD2 PRO 12 18.163 -1.118 -13.128
5 HB3 PRO 12 HB1 PRO 12 20.005 -3.980 -11.254
6 HG3 PRO 12 HG1 PRO 12 17.772 -3.738 -11.740
7 HD3 PRO 12 HD1 PRO 12 16.815 -1.708 -12.128
No H/Q in entry = 7
In of MODEL 7
1 HA VAL 13 HA VAL 13 23.081 0.512 -10.626
2 HB VAL 13 HB VAL 13 22.170 0.957 -12.878
3 HG11 VAL 13 HG11 VAL 13 20.806 3.336 -11.655
4 HG13 VAL 13 HG12 VAL 13 20.031 1.904 -12.336
5 HG12 VAL 13 HG13 VAL 13 20.923 3.009 -13.382
6 HG21 VAL 13 HG21 VAL 13 24.282 2.005 -12.301
7 HG23 VAL 13 HG22 VAL 13 23.434 3.403 -11.641
8 HG22 VAL 13 HG23 VAL 13 23.355 3.060 -13.367
9 H VAL 13 HN VAL 13 20.281 0.486 -10.061
No H/Q in entry = 9
In of MODEL 7
1 HA ALA 14 HA ALA 14 22.433 3.459 -7.517
2 HB3 ALA 14 HB1 ALA 14 25.441 3.247 -7.580
3 HB2 ALA 14 HB2 ALA 14 24.361 2.206 -6.646
4 HB1 ALA 14 HB3 ALA 14 24.470 3.929 -6.275
5 H ALA 14 HN ALA 14 24.117 2.045 -9.388
No H/Q in entry = 5
In of MODEL 7
1 HA ALA 15 HA ALA 15 23.190 7.170 -9.444
2 HB3 ALA 15 HB1 ALA 15 22.501 7.559 -11.801
3 HB2 ALA 15 HB2 ALA 15 21.788 5.947 -11.872
4 HB1 ALA 15 HB3 ALA 15 23.509 6.141 -11.619
5 H ALA 15 HN ALA 15 21.668 4.716 -9.270
No H/Q in entry = 5
In of MODEL 7
1 HA PRO 16 HA PRO 16 18.737 8.405 -8.946
2 HB2 PRO 16 HB2 PRO 16 16.663 6.770 -9.508
3 HG2 PRO 16 HG2 PRO 16 17.540 4.810 -10.222
4 HD2 PRO 16 HD2 PRO 16 19.740 4.652 -9.661
5 HB3 PRO 16 HB1 PRO 16 17.484 7.688 -10.771
6 HG3 PRO 16 HG1 PRO 16 17.956 5.677 -11.709
7 HD3 PRO 16 HD1 PRO 16 20.154 5.440 -11.190
No H/Q in entry = 7
In of MODEL 7
1 HA SER 17 HA SER 17 17.956 6.248 -5.243
2 HB2 SER 17 HB2 SER 17 17.724 8.664 -4.670
3 HG SER 17 HG SER 17 17.422 7.677 -2.848
4 H SER 17 HN SER 17 16.996 8.077 -7.296
5 HB3 SER 17 HB1 SER 17 16.009 8.567 -5.045
No H/Q in entry = 5
In of MODEL 7
1 HA PRO 18 HA PRO 18 14.333 3.789 -6.433
2 HB2 PRO 18 HB2 PRO 18 14.803 1.770 -4.642
3 HG2 PRO 18 HG2 PRO 18 16.646 2.640 -3.537
4 HD2 PRO 18 HD2 PRO 18 17.814 4.435 -4.364
5 HB3 PRO 18 HB1 PRO 18 15.586 1.865 -6.220
6 HG3 PRO 18 HG1 PRO 18 17.468 1.816 -4.873
7 HD3 PRO 18 HD1 PRO 18 17.860 3.775 -6.015
No H/Q in entry = 7
In of MODEL 7
1 HA ALA 19 HA ALA 19 11.537 3.778 -2.933
2 HB1 ALA 19 HB1 ALA 19 12.788 5.860 -2.600
3 HB2 ALA 19 HB2 ALA 19 11.053 6.139 -2.464
4 HB3 ALA 19 HB3 ALA 19 11.911 6.607 -3.935
5 H ALA 19 HN ALA 19 12.315 3.865 -5.547
No H/Q in entry = 5
In of MODEL 7
1 HA VAL 20 HA VAL 20 8.032 4.792 -5.301
2 HB VAL 20 HB VAL 20 6.220 3.133 -4.880
3 HG11 VAL 20 HG11 VAL 20 8.932 2.013 -5.651
4 HG13 VAL 20 HG12 VAL 20 7.784 2.800 -6.735
5 HG12 VAL 20 HG13 VAL 20 7.394 1.236 -6.021
6 HG22 VAL 20 HG21 VAL 20 6.735 1.061 -3.676
7 HG21 VAL 20 HG22 VAL 20 6.801 2.469 -2.615
8 HG23 VAL 20 HG23 VAL 20 8.297 1.730 -3.194
9 H VAL 20 HN VAL 20 9.369 3.677 -2.979
No H/Q in entry = 9
In of MODEL 7
1 HA THR 21 HA THR 21 5.647 6.450 -2.129
2 HB THR 21 HB THR 21 7.299 8.166 -2.813
3 HG1 THR 21 HG1 THR 21 6.333 9.436 -1.477
4 HG23 THR 21 HG21 THR 21 6.668 8.478 -5.122
5 HG22 THR 21 HG22 THR 21 6.500 10.035 -4.285
6 HG21 THR 21 HG23 THR 21 5.073 9.039 -4.631
7 H THR 21 HN THR 21 6.424 6.197 -4.909
No H/Q in entry = 7
In of MODEL 7
1 HA TYR 22 HA TYR 22 1.823 6.985 -4.102
2 HB2 TYR 22 HB2 TYR 22 1.608 5.704 -1.376
3 HD1 TYR 22 HD1 TYR 22 3.690 4.429 -1.743
4 HD2 TYR 22 HD2 TYR 22 0.488 4.299 -4.508
5 HE1 TYR 22 HE1 TYR 22 4.712 2.474 -2.819
6 HE2 TYR 22 HE2 TYR 22 1.479 2.347 -5.585
7 HH TYR 22 HH TYR 22 3.996 0.542 -4.314
8 H TYR 22 HN TYR 22 3.601 7.427 -1.837
9 HB3 TYR 22 HB1 TYR 22 0.338 5.689 -2.593
No H/Q in entry = 9
In of MODEL 7
1 HA ALA 23 HA ALA 23 -0.258 10.136 -1.866
2 HB2 ALA 23 HB1 ALA 23 -1.485 11.415 -3.576
3 HB3 ALA 23 HB2 ALA 23 -1.323 10.047 -4.683
4 HB1 ALA 23 HB3 ALA 23 0.112 10.922 -4.151
5 H ALA 23 HN ALA 23 -0.280 7.913 -3.768
No H/Q in entry = 5
In of MODEL 7
1 HA LEU 24 HA LEU 24 -4.072 8.532 -0.614
2 HB2 LEU 24 HB2 LEU 24 -4.931 11.413 -0.360
3 HG LEU 24 HG LEU 24 -2.906 11.306 0.882
4 HD13 LEU 24 HD11 LEU 24 -4.704 12.486 1.909
5 HD12 LEU 24 HD12 LEU 24 -3.728 11.682 3.146
6 HD11 LEU 24 HD13 LEU 24 -5.280 10.996 2.660
7 HD23 LEU 24 HD21 LEU 24 -2.525 9.649 2.649
8 HD22 LEU 24 HD22 LEU 24 -2.599 8.929 1.038
9 HD21 LEU 24 HD23 LEU 24 -3.978 8.796 2.126
10 H LEU 24 HN LEU 24 -2.382 10.743 -1.129
11 HB3 LEU 24 HB1 LEU 24 -5.564 10.024 0.464
No H/Q in entry = 11
In of MODEL 7
1 HA GLN 25 HA GLN 25 -7.940 7.990 -2.639
2 HB2 GLN 25 HB2 GLN 25 -7.049 10.589 -3.898
3 HG2 GLN 25 HG2 GLN 25 -8.964 10.139 -1.606
4 HE21 GLN 25 HE21 GLN 25 -10.712 11.199 -2.659
5 HE22 GLN 25 HE22 GLN 25 -10.658 12.883 -3.018
6 H GLN 25 HN GLN 25 -6.198 8.186 -1.259
7 HB3 GLN 25 HB1 GLN 25 -8.635 9.847 -4.086
8 HG3 GLN 25 HG1 GLN 25 -7.428 10.964 -1.577
No H/Q in entry = 8
In of MODEL 7
1 HA GLU 26 HA GLU 26 -5.262 6.966 -6.266
2 HB2 GLU 26 HB2 GLU 26 -3.117 7.827 -5.560
3 HG2 GLU 26 HG2 GLU 26 -1.480 6.067 -5.955
4 H GLU 26 HN GLU 26 -4.966 7.503 -3.435
5 HB3 GLU 26 HB1 GLU 26 -3.025 6.663 -4.258
6 HG3 GLU 26 HG1 GLU 26 -2.780 4.876 -5.897
No H/Q in entry = 6
In of MODEL 7
1 HA ASP 27 HA ASP 27 -6.210 2.856 -5.164
2 HB2 ASP 27 HB2 ASP 27 -6.724 2.946 -8.161
3 H ASP 27 HN ASP 27 -5.405 4.928 -7.088
4 HB3 ASP 27 HB1 ASP 27 -7.246 1.684 -7.067
No H/Q in entry = 4
In of MODEL 7
1 HA VAL 28 HA VAL 28 -2.809 0.558 -6.711
2 HB VAL 28 HB VAL 28 -1.276 0.417 -4.603
3 HG11 VAL 28 HG11 VAL 28 -1.065 2.186 -6.308
4 HG13 VAL 28 HG12 VAL 28 -0.764 2.764 -4.661
5 HG12 VAL 28 HG13 VAL 28 -2.309 3.099 -5.442
6 HG21 VAL 28 HG21 VAL 28 -3.507 2.141 -3.557
7 HG23 VAL 28 HG22 VAL 28 -1.955 1.871 -2.766
8 HG22 VAL 28 HG23 VAL 28 -3.087 0.532 -2.975
9 H VAL 28 HN VAL 28 -5.026 1.137 -4.890
No H/Q in entry = 9
In of MODEL 7
1 HA PHE 29 HA PHE 29 -3.600 -3.390 -4.991
2 HB2 PHE 29 HB2 PHE 29 -1.160 -3.654 -6.724
3 HD1 PHE 29 HD1 PHE 29 -1.788 -3.357 -8.858
4 HD2 PHE 29 HD2 PHE 29 -4.419 -5.297 -6.174
5 HE1 PHE 29 HE1 PHE 29 -3.384 -3.736 -10.712
6 HE2 PHE 29 HE2 PHE 29 -6.040 -5.650 -7.993
7 HZ PHE 29 HZ PHE 29 -5.510 -4.890 -10.273
8 H PHE 29 HN PHE 29 -1.738 -1.455 -6.132
9 HB3 PHE 29 HB1 PHE 29 -1.780 -5.048 -5.889
No H/Q in entry = 9
In of MODEL 7
1 HA ILE 30 HA ILE 30 -0.614 -3.989 -1.784
2 HB ILE 30 HB ILE 30 -3.411 -4.173 -0.650
3 HG12 ILE 30 HG12 ILE 30 -2.798 -2.156 0.587
4 HG21 ILE 30 HG21 ILE 30 -0.873 -4.514 0.941
5 HG23 ILE 30 HG22 ILE 30 -2.133 -5.722 0.686
6 HG22 ILE 30 HG23 ILE 30 -2.478 -4.275 1.631
7 HD12 ILE 30 HD11 ILE 30 -2.606 -0.553 -1.177
8 HD11 ILE 30 HD12 ILE 30 -3.724 -1.855 -1.674
9 HD13 ILE 30 HD13 ILE 30 -2.054 -1.833 -2.254
10 H ILE 30 HN ILE 30 -3.140 -4.533 -3.183
11 HG13 ILE 30 HG11 ILE 30 -1.187 -2.204 -0.110
No H/Q in entry = 11
In of MODEL 7
1 HA LYS 31 HA LYS 31 -0.430 -8.266 -2.027
2 HB2 LYS 31 HB2 LYS 31 1.558 -7.521 -3.048
3 HG2 LYS 31 HG2 LYS 31 2.183 -9.414 -0.823
4 HD2 LYS 31 HD2 LYS 31 3.834 -8.742 -3.243
5 HE2 LYS 31 HE2 LYS 31 4.261 -10.629 -0.937
6 HZ1 LYS 31 HZ1 LYS 31 6.059 -9.965 -3.191
7 HZ3 LYS 31 HZ2 LYS 31 6.314 -11.189 -2.052
8 HZ2 LYS 31 HZ3 LYS 31 6.309 -9.569 -1.565
9 H LYS 31 HN LYS 31 0.485 -5.583 -1.519
10 HB3 LYS 31 HB1 LYS 31 2.212 -6.980 -1.527
11 HG3 LYS 31 HG1 LYS 31 1.793 -9.783 -2.506
12 HD3 LYS 31 HD1 LYS 31 4.215 -8.251 -1.590
13 HE3 LYS 31 HE1 LYS 31 3.995 -11.072 -2.621
No H/Q in entry = 13
In of MODEL 7
1 HA CYS 32 HA CYS 32 -0.151 -9.182 2.253
2 HB2 CYS 32 HB2 CYS 32 -2.438 -10.083 1.636
3 HG CYS 32 HG CYS 32 -2.611 -10.868 4.050
4 H CYS 32 HN CYS 32 -0.891 -9.638 -0.516
5 HB3 CYS 32 HB1 CYS 32 -1.630 -11.516 1.010
No H/Q in entry = 5
In of MODEL 7
1 HA ASN 33 HA ASN 33 3.328 -11.597 2.374
2 HB2 ASN 33 HB2 ASN 33 1.773 -13.299 4.283
3 HD21 ASN 33 HD21 ASN 33 4.076 -13.177 6.039
4 HD22 ASN 33 HD22 ASN 33 4.105 -11.573 6.676
5 H ASN 33 HN ASN 33 0.685 -11.404 3.277
6 HB3 ASN 33 HB1 ASN 33 3.470 -13.618 3.939
No H/Q in entry = 6
In of MODEL 7
1 HA ASP 34 HA ASP 34 2.294 -15.652 0.390
2 HB2 ASP 34 HB2 ASP 34 -0.690 -15.408 0.548
3 H ASP 34 HN ASP 34 0.612 -13.696 1.677
4 HB3 ASP 34 HB1 ASP 34 0.097 -16.645 -0.418
No H/Q in entry = 4
In of MODEL 7
1 HA3 GLY 35 HA2 GLY 35 2.221 -11.914 -2.788
2 H GLY 35 HN GLY 35 1.654 -12.690 -0.638
3 HA2 GLY 35 HA1 GLY 35 1.983 -13.543 -3.411
No H/Q in entry = 3
In of MODEL 7
1 HA ARG 36 HA ARG 36 -2.383 -12.611 -3.617
2 HB2 ARG 36 HB2 ARG 36 -2.942 -11.975 -0.720
3 HG2 ARG 36 HG2 ARG 36 -1.825 -14.127 -0.732
4 HD2 ARG 36 HD2 ARG 36 -3.990 -14.985 -2.627
5 HE ARG 36 HE ARG 36 -3.187 -16.586 -0.775
6 HH11 ARG 36 HH11 ARG 36 -1.672 -16.391 -3.990
7 HH12 ARG 36 HH12 ARG 36 -1.274 -18.040 -4.038
8 HH21 ARG 36 HH21 ARG 36 -2.606 -18.865 -0.867
9 HH22 ARG 36 HH22 ARG 36 -1.827 -19.478 -2.248
10 H ARG 36 HN ARG 36 -0.492 -12.662 -1.433
11 HB3 ARG 36 HB1 ARG 36 -4.073 -12.537 -1.929
12 HG3 ARG 36 HG1 ARG 36 -3.530 -14.271 -0.306
13 HD3 ARG 36 HD1 ARG 36 -2.254 -14.898 -2.962
No H/Q in entry = 13
In of MODEL 7
1 HA PHE 37 HA PHE 37 -2.415 -8.243 -3.262
2 HB2 PHE 37 HB2 PHE 37 -2.579 -8.963 -6.164
3 HD1 PHE 37 HD1 PHE 37 -0.300 -9.592 -6.455
4 HD2 PHE 37 HD2 PHE 37 -1.274 -6.035 -4.337
5 HE1 PHE 37 HE1 PHE 37 2.074 -8.907 -6.465
6 HE2 PHE 37 HE2 PHE 37 1.000 -5.337 -4.349
7 HZ PHE 37 HZ PHE 37 2.740 -6.762 -5.403
8 H PHE 37 HN PHE 37 -3.054 -10.759 -4.599
9 HB3 PHE 37 HB1 PHE 37 -2.987 -7.335 -5.660
No H/Q in entry = 9
In of MODEL 7
1 HA TYR 38 HA TYR 38 -6.670 -7.300 -3.460
2 HB2 TYR 38 HB2 TYR 38 -5.390 -6.122 -0.992
3 HD1 TYR 38 HD1 TYR 38 -8.541 -7.727 -0.742
4 HD2 TYR 38 HD2 TYR 38 -4.353 -8.379 -0.615
5 HE1 TYR 38 HE1 TYR 38 -8.924 -9.813 0.466
6 HE2 TYR 38 HE2 TYR 38 -4.703 -10.486 0.581
7 HH TYR 38 HH TYR 38 -7.781 -11.904 0.864
8 H TYR 38 HN TYR 38 -3.852 -6.910 -2.725
9 HB3 TYR 38 HB1 TYR 38 -7.101 -6.011 -1.344
No H/Q in entry = 9
In of MODEL 7
1 HA LEU 39 HA LEU 39 -5.730 -3.245 -4.834
2 HB2 LEU 39 HB2 LEU 39 -7.218 -4.449 -6.653
3 HG LEU 39 HG LEU 39 -5.912 -2.408 -7.195
4 HD11 LEU 39 HD11 LEU 39 -8.665 -2.616 -8.372
5 HD13 LEU 39 HD12 LEU 39 -7.205 -3.456 -8.919
6 HD12 LEU 39 HD13 LEU 39 -7.336 -1.696 -9.066
7 HD23 LEU 39 HD21 LEU 39 -7.040 -0.297 -7.315
8 HD22 LEU 39 HD22 LEU 39 -6.868 -0.865 -5.644
9 HD21 LEU 39 HD23 LEU 39 -8.439 -0.976 -6.471
10 H LEU 39 HN LEU 39 -7.532 -5.507 -4.500
11 HB3 LEU 39 HB1 LEU 39 -8.478 -3.430 -5.998
No H/Q in entry = 11
In of MODEL 7
1 HA3 GLY 40 HA2 GLY 40 -8.594 -0.767 -2.639
2 H GLY 40 HN GLY 40 -6.039 -1.311 -3.834
3 HA2 GLY 40 HA1 GLY 40 -7.250 -0.923 -1.504
No H/Q in entry = 3
In of MODEL 7
1 HA THR 41 HA THR 41 -7.084 3.307 -3.142
2 HB THR 41 HB THR 41 -9.537 3.653 -1.408
3 HG1 THR 41 HG1 THR 41 -9.382 3.151 -4.220
4 HG23 THR 41 HG21 THR 41 -8.355 5.728 -2.010
5 HG22 THR 41 HG22 THR 41 -9.913 5.631 -2.833
6 HG21 THR 41 HG23 THR 41 -8.425 5.276 -3.714
7 H THR 41 HN THR 41 -8.511 1.372 -1.458
No H/Q in entry = 7
In of MODEL 7
1 HA ILE 42 HA ILE 42 -4.971 4.178 0.662
2 HB ILE 42 HB ILE 42 -3.937 6.404 -1.110
3 HG12 ILE 42 HG12 ILE 42 -2.889 3.612 -0.724
4 HG23 ILE 42 HG21 ILE 42 -3.441 6.661 1.301
5 HG22 ILE 42 HG22 ILE 42 -1.967 6.295 0.405
6 HG21 ILE 42 HG23 ILE 42 -2.777 5.033 1.339
7 HD12 ILE 42 HD11 ILE 42 -1.087 5.089 -0.998
8 HD11 ILE 42 HD12 ILE 42 -1.823 5.768 -2.460
9 HD13 ILE 42 HD13 ILE 42 -1.303 4.073 -2.422
10 H ILE 42 HN ILE 42 -5.611 4.587 -2.115
11 HG13 ILE 42 HG11 ILE 42 -3.668 4.209 -2.185
No H/Q in entry = 11
In of MODEL 7
1 HA ILE 43 HA ILE 43 -7.126 7.749 1.886
2 HB ILE 43 HB ILE 43 -8.206 7.430 4.092
3 HG12 ILE 43 HG12 ILE 43 -6.380 5.660 4.662
4 HG21 ILE 43 HG21 ILE 43 -8.717 5.384 1.956
5 HG23 ILE 43 HG22 ILE 43 -9.483 6.971 2.134
6 HG22 ILE 43 HG23 ILE 43 -9.771 5.687 3.328
7 HD13 ILE 43 HD11 ILE 43 -7.630 3.382 4.682
8 HD12 ILE 43 HD12 ILE 43 -6.473 3.925 3.488
9 HD11 ILE 43 HD13 ILE 43 -8.176 4.039 3.123
10 H ILE 43 HN ILE 43 -5.574 5.312 2.385
11 HG13 ILE 43 HG11 ILE 43 -7.940 5.471 5.409
No H/Q in entry = 11
In of MODEL 7
1 HA ASP 44 HA ASP 44 -3.884 9.110 4.588
2 HB2 ASP 44 HB2 ASP 44 -5.368 7.807 6.356
3 H ASP 44 HN ASP 44 -4.440 6.435 3.727
4 HB3 ASP 44 HB1 ASP 44 -3.883 6.963 6.705
No H/Q in entry = 4
In of MODEL 7
1 HA GLN 45 HA GLN 45 -0.056 6.770 4.723
2 HB2 GLN 45 HB2 GLN 45 1.496 8.070 3.396
3 HG2 GLN 45 HG2 GLN 45 -0.504 10.305 3.496
4 HE21 GLN 45 HE21 GLN 45 2.912 10.399 2.907
5 HE22 GLN 45 HE22 GLN 45 2.816 10.857 1.248
6 H GLN 45 HN GLN 45 -1.567 9.125 5.512
7 HB3 GLN 45 HB1 GLN 45 -0.116 8.038 2.700
8 HG3 GLN 45 HG1 GLN 45 1.101 10.319 4.232
No H/Q in entry = 8
In of MODEL 7
1 HA THR 46 HA THR 46 2.674 8.699 7.519
2 HB THR 46 HB THR 46 3.641 6.960 9.061
3 HG1 THR 46 HG1 THR 46 2.524 4.819 8.731
4 HG21 THR 46 HG21 THR 46 1.440 7.909 9.572
5 HG23 THR 46 HG22 THR 46 1.552 6.212 10.059
6 HG22 THR 46 HG23 THR 46 0.677 6.640 8.604
7 H THR 46 HN THR 46 1.883 6.528 5.779
No H/Q in entry = 7
In of MODEL 7
1 HA SER 47 HA SER 47 6.498 8.150 5.604
2 HB2 SER 47 HB2 SER 47 7.271 9.356 7.692
3 HG SER 47 HG SER 47 8.845 9.320 6.251
4 H SER 47 HN SER 47 5.197 7.951 8.143
5 HB3 SER 47 HB1 SER 47 7.777 7.798 8.332
No H/Q in entry = 5
In of MODEL 7
1 HA ASP 48 HA ASP 48 7.549 3.765 6.499
2 HB2 ASP 48 HB2 ASP 48 5.829 3.310 8.926
3 H ASP 48 HN ASP 48 5.687 5.618 7.802
4 HB3 ASP 48 HB1 ASP 48 6.856 2.116 8.144
No H/Q in entry = 4
In of MODEL 7
1 HA GLN 49 HA GLN 49 3.588 2.100 5.088
2 HB2 GLN 49 HB2 GLN 49 2.349 2.628 7.763
3 HG2 GLN 49 HG2 GLN 49 3.481 0.075 6.594
4 HE21 GLN 49 HE21 GLN 49 2.026 1.736 9.316
5 HE22 GLN 49 HE22 GLN 49 1.679 0.331 10.229
6 H GLN 49 HN GLN 49 4.096 4.385 6.827
7 HB3 GLN 49 HB1 GLN 49 1.583 1.603 6.565
8 HG3 GLN 49 HG1 GLN 49 4.336 1.131 7.711
No H/Q in entry = 8
In of MODEL 7
1 HA TYR 50 HA TYR 50 0.053 4.734 4.248
2 HB2 TYR 50 HB2 TYR 50 0.416 2.646 2.108
3 HD1 TYR 50 HD1 TYR 50 2.925 3.055 1.935
4 HD2 TYR 50 HD2 TYR 50 0.052 6.192 1.588
5 HE1 TYR 50 HE1 TYR 50 4.640 4.502 1.069
6 HE2 TYR 50 HE2 TYR 50 1.768 7.672 0.727
7 HH TYR 50 HH TYR 50 4.179 7.901 0.759
8 H TYR 50 HN TYR 50 1.250 2.069 4.475
9 HB3 TYR 50 HB1 TYR 50 -0.708 3.984 1.944
No H/Q in entry = 9
In of MODEL 7
1 HA LEU 51 HA LEU 51 -3.300 2.288 5.607
2 HB2 LEU 51 HB2 LEU 51 -3.580 4.563 6.839
3 HG LEU 51 HG LEU 51 -6.166 3.305 5.952
4 HD11 LEU 51 HD11 LEU 51 -4.415 2.675 8.298
5 HD13 LEU 51 HD12 LEU 51 -4.793 1.627 6.929
6 HD12 LEU 51 HD13 LEU 51 -6.058 2.078 8.075
7 HD22 LEU 51 HD21 LEU 51 -6.481 5.498 6.901
8 HD21 LEU 51 HD22 LEU 51 -5.520 5.062 8.320
9 HD23 LEU 51 HD23 LEU 51 -7.070 4.264 8.006
10 H LEU 51 HN LEU 51 -2.104 4.755 4.631
11 HB3 LEU 51 HB1 LEU 51 -4.533 5.034 5.465
No H/Q in entry = 11
In of MODEL 7
1 HA ILE 52 HA ILE 52 -5.419 2.362 1.811
2 HB ILE 52 HB ILE 52 -4.837 -0.577 2.174
3 HG12 ILE 52 HG12 ILE 52 -2.760 0.572 2.575
4 HG22 ILE 52 HG21 ILE 52 -5.103 1.141 -0.294
5 HG21 ILE 52 HG22 ILE 52 -6.324 0.030 0.331
6 HG23 ILE 52 HG23 ILE 52 -4.787 -0.594 -0.271
7 HD13 ILE 52 HD11 ILE 52 -3.095 1.872 -0.091
8 HD12 ILE 52 HD12 ILE 52 -1.736 2.122 1.035
9 HD11 ILE 52 HD13 ILE 52 -3.344 2.713 1.434
10 H ILE 52 HN ILE 52 -4.356 1.100 4.243
11 HG13 ILE 52 HG11 ILE 52 -2.697 -0.184 0.992
No H/Q in entry = 11
In of MODEL 7
1 HA ARG 53 HA ARG 53 -9.130 0.566 3.145
2 HB2 ARG 53 HB2 ARG 53 -9.659 2.979 3.260
3 HG2 ARG 53 HG2 ARG 53 -11.843 1.522 1.840
4 HD2 ARG 53 HD2 ARG 53 -12.221 3.874 2.212
5 HE ARG 53 HE ARG 53 -11.153 3.377 4.842
6 HH11 ARG 53 HH11 ARG 53 -13.203 5.569 2.953
7 HH12 ARG 53 HH12 ARG 53 -13.022 6.878 4.009
8 HH21 ARG 53 HH21 ARG 53 -10.898 5.170 6.311
9 HH22 ARG 53 HH22 ARG 53 -11.686 6.644 5.984
10 H ARG 53 HN ARG 53 -7.521 2.240 1.394
11 HB3 ARG 53 HB1 ARG 53 -9.973 3.000 1.538
12 HG3 ARG 53 HG1 ARG 53 -11.445 1.307 3.544
13 HD3 ARG 53 HD1 ARG 53 -13.247 2.860 3.253
No H/Q in entry = 13
In of MODEL 7
1 HA PHE 54 HA PHE 54 -9.438 -1.522 -0.602
2 HB2 PHE 54 HB2 PHE 54 -10.309 -3.440 1.550
3 HD1 PHE 54 HD1 PHE 54 -8.502 -2.937 3.105
4 HD2 PHE 54 HD2 PHE 54 -7.694 -3.764 -0.983
5 HE1 PHE 54 HE1 PHE 54 -6.099 -3.122 3.616
6 HE2 PHE 54 HE2 PHE 54 -5.318 -3.971 -0.479
7 HZ PHE 54 HZ PHE 54 -4.503 -3.643 1.821
8 H PHE 54 HN PHE 54 -9.775 -1.145 2.237
9 HB3 PHE 54 HB1 PHE 54 -9.948 -3.883 -0.112
No H/Q in entry = 9
In of MODEL 7
1 HA ASP 55 HA ASP 55 -13.465 -1.383 -1.964
2 HB2 ASP 55 HB2 ASP 55 -12.689 -2.954 -3.686
3 H ASP 55 HN ASP 55 -11.244 -3.048 -1.588
4 HB3 ASP 55 HB1 ASP 55 -13.176 -4.309 -2.670
No H/Q in entry = 4
In of MODEL 7
1 HA ASP 56 HA ASP 56 -15.625 -4.211 1.019
2 HB2 ASP 56 HB2 ASP 56 -14.775 -5.912 2.627
3 H ASP 56 HN ASP 56 -12.871 -4.010 0.195
4 HB3 ASP 56 HB1 ASP 56 -14.321 -6.261 0.965
No H/Q in entry = 4
In of MODEL 7
1 HA GLN 57 HA GLN 57 -13.624 -0.043 2.627
2 HB2 GLN 57 HB2 GLN 57 -15.895 -1.304 4.143
3 HG2 GLN 57 HG2 GLN 57 -15.825 0.800 1.987
4 HE21 GLN 57 HE21 GLN 57 -17.769 -0.837 4.446
5 HE22 GLN 57 HE22 GLN 57 -19.151 0.168 4.240
6 H GLN 57 HN GLN 57 -13.639 -1.876 1.409
7 HB3 GLN 57 HB1 GLN 57 -15.355 0.352 4.380
8 HG3 GLN 57 HG1 GLN 57 -16.435 -0.834 1.843
No H/Q in entry = 8
In of MODEL 7
1 HA SER 58 HA SER 58 -11.826 -2.057 6.353
2 HB2 SER 58 HB2 SER 58 -10.080 -3.878 6.090
3 HG SER 58 HG SER 58 -11.230 -4.772 3.790
4 H SER 58 HN SER 58 -12.322 -2.707 3.629
5 HB3 SER 58 HB1 SER 58 -11.745 -4.361 5.758
No H/Q in entry = 5
In of MODEL 7
1 HA GLU 59 HA GLU 59 -8.267 0.237 5.254
2 HB2 GLU 59 HB2 GLU 59 -8.728 0.878 8.169
3 HG2 GLU 59 HG2 GLU 59 -9.855 2.307 5.793
4 H GLU 59 HN GLU 59 -9.918 -1.191 7.204
5 HB3 GLU 59 HB1 GLU 59 -7.816 1.830 7.008
6 HG3 GLU 59 HG1 GLU 59 -10.776 1.319 6.936
No H/Q in entry = 6
In of MODEL 7
1 HA GLN 60 HA GLN 60 -5.069 -1.673 7.761
2 HB2 GLN 60 HB2 GLN 60 -5.774 -3.452 6.118
3 HG2 GLN 60 HG2 GLN 60 -2.777 -3.282 6.406
4 HE21 GLN 60 HE21 GLN 60 -2.377 -4.434 4.512
5 HE22 GLN 60 HE22 GLN 60 -2.756 -6.093 4.343
6 H GLN 60 HN GLN 60 -6.121 -0.371 5.336
7 HB3 GLN 60 HB1 GLN 60 -4.656 -2.745 4.963
8 HG3 GLN 60 HG1 GLN 60 -3.876 -3.949 7.608
No H/Q in entry = 8
In of MODEL 7
1 HA TRP 61 HA TRP 61 -1.717 0.858 6.461
2 HB2 TRP 61 HB2 TRP 61 -1.025 -0.226 9.206
3 HD1 TRP 61 HD1 TRP 61 -2.900 0.903 10.586
4 HE1 TRP 61 HE1 TRP 61 -3.683 3.345 10.908
5 HE3 TRP 61 HE3 TRP 61 -0.096 3.123 6.969
6 HZ2 TRP 61 HZ2 TRP 61 -3.149 5.891 9.753
7 HZ3 TRP 61 HZ3 TRP 61 -0.302 5.546 6.623
8 HH2 TRP 61 HH2 TRP 61 -1.772 6.889 7.961
9 H TRP 61 HN TRP 61 -2.905 -1.195 8.156
10 HB3 TRP 61 HB1 TRP 61 0.072 0.820 8.326
No H/Q in entry = 10
In of MODEL 7
1 HA CYS 62 HA CYS 62 0.748 -2.399 4.965
2 HB2 CYS 62 HB2 CYS 62 -0.304 -0.923 2.561
3 HG CYS 62 HG CYS 62 -2.572 -1.329 4.054
4 H CYS 62 HN CYS 62 -0.604 0.205 4.847
5 HB3 CYS 62 HB1 CYS 62 0.263 -2.594 2.642
No H/Q in entry = 5
In of MODEL 7
1 HA GLU 63 HA GLU 63 4.486 -0.209 4.208
2 HB2 GLU 63 HB2 GLU 63 5.009 -2.930 3.040
3 HG2 GLU 63 HG2 GLU 63 6.057 -1.984 5.625
4 H GLU 63 HN GLU 63 2.824 -2.508 4.130
5 HB3 GLU 63 HB1 GLU 63 6.218 -1.716 3.397
6 HG3 GLU 63 HG1 GLU 63 4.413 -2.624 5.524
No H/Q in entry = 6
In of MODEL 7
1 HA PRO 64 HA PRO 64 4.175 1.309 0.035
2 HB2 PRO 64 HB2 PRO 64 7.079 1.667 -0.033
3 HG2 PRO 64 HG2 PRO 64 7.422 2.446 2.078
4 HD2 PRO 64 HD2 PRO 64 6.601 0.590 3.147
5 HB3 PRO 64 HB1 PRO 64 5.789 2.857 -0.108
6 HG3 PRO 64 HG1 PRO 64 5.851 3.240 2.126
7 HD3 PRO 64 HD1 PRO 64 5.190 1.558 3.478
No H/Q in entry = 7
In of MODEL 7
1 HA ASP 65 HA ASP 65 6.970 -1.963 -1.982
2 HB2 ASP 65 HB2 ASP 65 8.616 -2.569 -0.316
3 H ASP 65 HN ASP 65 6.544 -1.191 0.748
4 HB3 ASP 65 HB1 ASP 65 7.412 -3.497 0.571
No H/Q in entry = 4
In of MODEL 7
1 HA LYS 66 HA LYS 66 3.581 -5.088 -0.952
2 HB2 LYS 66 HB2 LYS 66 2.422 -3.348 1.234
3 HG2 LYS 66 HG2 LYS 66 4.289 -4.676 2.064
4 HD2 LYS 66 HD2 LYS 66 2.743 -6.925 0.839
5 HE2 LYS 66 HE2 LYS 66 3.040 -7.494 3.202
6 HZ1 LYS 66 HZ1 LYS 66 5.949 -7.190 2.708
7 HZ3 LYS 66 HZ2 LYS 66 5.274 -7.916 4.049
8 HZ2 LYS 66 HZ3 LYS 66 5.054 -6.275 3.809
9 H LYS 66 HN LYS 66 4.553 -2.686 0.355
10 HB3 LYS 66 HB1 LYS 66 1.625 -4.781 0.625
11 HG3 LYS 66 HG1 LYS 66 2.752 -5.188 2.760
12 HD3 LYS 66 HD1 LYS 66 4.463 -6.561 0.716
13 HE3 LYS 66 HE1 LYS 66 3.981 -8.524 2.129
No H/Q in entry = 13
In of MODEL 7
1 HA LEU 67 HA LEU 67 0.748 -1.785 -2.656
2 HB2 LEU 67 HB2 LEU 67 2.708 0.393 -2.004
3 HG LEU 67 HG LEU 67 0.747 -0.709 -0.342
4 HD11 LEU 67 HD11 LEU 67 2.035 2.018 -0.410
5 HD13 LEU 67 HD12 LEU 67 2.541 0.556 0.499
6 HD12 LEU 67 HD13 LEU 67 1.052 1.374 0.904
7 HD21 LEU 67 HD21 LEU 67 -0.851 0.277 -1.872
8 HD23 LEU 67 HD22 LEU 67 -0.172 1.871 -1.503
9 HD22 LEU 67 HD23 LEU 67 -0.927 0.897 -0.234
10 H LEU 67 HN LEU 67 3.314 -1.771 -1.289
11 HB3 LEU 67 HB1 LEU 67 1.222 0.615 -2.872
No H/Q in entry = 11
In of MODEL 7
1 HA ARG 68 HA ARG 68 2.956 -0.947 -6.411
2 HB2 ARG 68 HB2 ARG 68 1.038 -3.246 -6.930
3 HG2 ARG 68 HG2 ARG 68 2.700 -3.710 -5.229
4 HD2 ARG 68 HD2 ARG 68 4.744 -3.527 -7.472
5 HE ARG 68 HE ARG 68 5.144 -3.786 -4.582
6 HH11 ARG 68 HH11 ARG 68 6.304 -4.293 -7.889
7 HH12 ARG 68 HH12 ARG 68 7.843 -4.863 -7.425
8 HH21 ARG 68 HH21 ARG 68 7.382 -4.536 -3.939
9 HH22 ARG 68 HH22 ARG 68 8.436 -5.003 -5.170
10 H ARG 68 HN ARG 68 0.587 -1.572 -4.783
11 HB3 ARG 68 HB1 ARG 68 2.323 -2.733 -8.014
12 HG3 ARG 68 HG1 ARG 68 2.856 -4.740 -6.646
13 HD3 ARG 68 HD1 ARG 68 4.477 -2.185 -6.373
No H/Q in entry = 13
In of MODEL 7
1 HA LYS 69 HA LYS 69 -0.069 1.574 -8.074
2 HB2 LYS 69 HB2 LYS 69 2.196 1.981 -10.022
3 HG2 LYS 69 HG2 LYS 69 1.954 4.379 -9.092
4 HD2 LYS 69 HD2 LYS 69 3.133 2.219 -7.393
5 HE2 LYS 69 HE2 LYS 69 3.230 4.205 -6.132
6 HZ1 LYS 69 HZ1 LYS 69 2.758 5.862 -7.906
7 HZ3 LYS 69 HZ2 LYS 69 4.350 5.645 -8.496
8 HZ2 LYS 69 HZ3 LYS 69 4.100 6.261 -6.963
9 H LYS 69 HN LYS 69 2.494 0.380 -8.110
10 HB3 LYS 69 HB1 LYS 69 0.667 2.820 -10.169
11 HG3 LYS 69 HG1 LYS 69 1.183 3.579 -7.725
12 HD3 LYS 69 HD1 LYS 69 3.913 2.951 -8.803
13 HE3 LYS 69 HE1 LYS 69 4.796 3.953 -6.852
No H/Q in entry = 13
In of MODEL 7
1 HA LEU 70 HA LEU 70 -1.876 -1.020 -11.002
2 HB2 LEU 70 HB2 LEU 70 -3.617 1.353 -11.606
3 HG LEU 70 HG LEU 70 -3.783 1.306 -9.254
4 HD13 LEU 70 HD11 LEU 70 -6.036 0.614 -8.906
5 HD12 LEU 70 HD12 LEU 70 -5.972 -0.363 -10.362
6 HD11 LEU 70 HD13 LEU 70 -5.877 1.410 -10.483
7 HD23 LEU 70 HD21 LEU 70 -4.273 -0.703 -7.981
8 HD22 LEU 70 HD22 LEU 70 -2.715 -0.819 -8.800
9 HD21 LEU 70 HD23 LEU 70 -4.120 -1.673 -9.445
10 H LEU 70 HN LEU 70 -1.576 1.642 -9.902
11 HB3 LEU 70 HB1 LEU 70 -4.025 -0.339 -11.752
No H/Q in entry = 11
In of MODEL 7
1 HA3 GLY 71 HA2 GLY 71 -0.775 1.052 -14.863
2 H GLY 71 HN GLY 71 -1.063 2.179 -12.162
3 HA2 GLY 71 HA1 GLY 71 -1.257 2.714 -14.547
No H/Q in entry = 3
In of MODEL 7
1 HA3 GLY 72 HA2 GLY 72 3.572 0.859 -13.404
2 H GLY 72 HN GLY 72 1.281 0.679 -13.224
3 HA2 GLY 72 HA1 GLY 72 3.351 2.201 -14.524
No H/Q in entry = 3
In of MODEL 7
1 HA3 GLY 73 HA2 GLY 73 3.665 4.568 -10.817
2 H GLY 73 HN GLY 73 2.458 4.190 -13.471
3 HA2 GLY 73 HA1 GLY 73 3.909 5.732 -12.117
No H/Q in entry = 3
In of MODEL 7
1 HA SER 74 HA SER 74 0.034 7.072 -10.529
2 HB2 SER 74 HB2 SER 74 1.813 8.227 -8.367
3 HG SER 74 HG SER 74 0.015 6.127 -8.134
4 H SER 74 HN SER 74 2.966 7.164 -10.454
5 HB3 SER 74 HB1 SER 74 0.050 8.200 -8.366
No H/Q in entry = 5
In of MODEL 7
1 HA SER 75 HA SER 75 0.812 11.070 -12.035
2 HB2 SER 75 HB2 SER 75 -2.066 10.461 -12.786
3 HG SER 75 HG SER 75 -0.225 9.061 -13.503
4 H SER 75 HN SER 75 -0.965 8.942 -11.166
5 HB3 SER 75 HB1 SER 75 -1.078 11.740 -13.490
No H/Q in entry = 5
In of MODEL 8
1 H1 GLY 7 HT3 GLY 7 17.043 -11.199 -3.368
2 H2 GLY 7 HT2 GLY 7 16.562 -12.566 -4.247
3 H3 GLY 7 HT1 GLY 7 16.893 -11.093 -5.029
4 HA3 GLY 7 HA1 GLY 7 14.540 -11.314 -4.896
5 HA2 GLY 7 HA2 GLY 7 14.679 -11.575 -3.154
No H/Q in entry = 5
In of MODEL 8
1 HA ALA 8 HA ALA 8 12.732 -7.309 -4.217
2 HB3 ALA 8 HB1 ALA 8 12.780 -7.786 -1.804
3 HB1 ALA 8 HB2 ALA 8 13.296 -6.135 -2.150
4 HB2 ALA 8 HB3 ALA 8 14.493 -7.372 -1.764
5 H ALA 8 HN ALA 8 13.118 -9.522 -4.178
No H/Q in entry = 5
In of MODEL 8
1 HA MET 9 HA MET 9 16.477 -5.985 -6.171
2 HB2 MET 9 HB2 MET 9 16.099 -5.296 -8.491
3 HG2 MET 9 HG2 MET 9 13.224 -6.042 -8.060
4 HE3 MET 9 HE1 MET 9 15.085 -4.538 -12.006
5 HE2 MET 9 HE2 MET 9 16.054 -4.834 -10.567
6 HE1 MET 9 HE3 MET 9 14.858 -3.536 -10.571
7 H MET 9 HN MET 9 13.704 -6.728 -6.117
8 HB3 MET 9 HB1 MET 9 15.480 -6.912 -8.195
9 HG3 MET 9 HG1 MET 9 13.813 -4.404 -8.309
No H/Q in entry = 9
In of MODEL 8
1 HA ALA 10 HA ALA 10 15.597 -1.726 -5.759
2 HB2 ALA 10 HB1 ALA 10 17.376 -0.786 -4.314
3 HB1 ALA 10 HB2 ALA 10 18.308 -2.270 -4.519
4 HB3 ALA 10 HB3 ALA 10 16.757 -2.311 -3.678
5 H ALA 10 HN ALA 10 17.373 -4.011 -6.187
No H/Q in entry = 5
In of MODEL 8
1 HA PRO 11 HA PRO 11 17.999 -0.837 -9.492
2 HB2 PRO 11 HB2 PRO 11 16.281 0.953 -10.556
3 HG2 PRO 11 HG2 PRO 11 14.723 1.202 -8.879
4 HD2 PRO 11 HD2 PRO 11 14.857 -0.079 -6.998
5 HB3 PRO 11 HB1 PRO 11 16.024 -0.791 -10.671
6 HG3 PRO 11 HG1 PRO 11 14.034 -0.243 -9.638
7 HD3 PRO 11 HD1 PRO 11 14.674 -1.587 -7.911
No H/Q in entry = 7
In of MODEL 8
1 HA PRO 12 HA PRO 12 19.852 2.777 -7.460
2 HB2 PRO 12 HB2 PRO 12 21.925 2.297 -9.518
3 HG2 PRO 12 HG2 PRO 12 22.340 0.062 -8.979
4 HD2 PRO 12 HD2 PRO 12 20.329 -0.030 -10.148
5 HB3 PRO 12 HB1 PRO 12 22.111 2.420 -7.764
6 HG3 PRO 12 HG1 PRO 12 21.524 0.202 -7.414
7 HD3 PRO 12 HD1 PRO 12 19.858 -0.844 -8.634
No H/Q in entry = 7
In of MODEL 8
1 HA VAL 13 HA VAL 13 19.004 4.898 -11.348
2 HB VAL 13 HB VAL 13 20.342 5.116 -13.476
3 HG13 VAL 13 HG11 VAL 13 22.446 5.741 -12.388
4 HG12 VAL 13 HG12 VAL 13 21.949 4.856 -10.945
5 HG11 VAL 13 HG13 VAL 13 21.040 6.274 -11.465
6 HG21 VAL 13 HG21 VAL 13 21.843 2.735 -12.379
7 HG23 VAL 13 HG22 VAL 13 22.375 3.733 -13.733
8 HG22 VAL 13 HG23 VAL 13 20.899 2.774 -13.868
9 H VAL 13 HN VAL 13 20.038 2.213 -10.965
No H/Q in entry = 9
In of MODEL 8
1 HA ALA 14 HA ALA 14 16.385 3.524 -14.500
2 HB1 ALA 14 HB1 ALA 14 14.743 1.906 -13.611
3 HB2 ALA 14 HB2 ALA 14 15.280 2.258 -11.971
4 HB3 ALA 14 HB3 ALA 14 16.376 1.463 -13.105
5 H ALA 14 HN ALA 14 17.083 4.760 -12.094
No H/Q in entry = 5
In of MODEL 8
1 HA ALA 15 HA ALA 15 13.235 6.343 -13.898
2 HB1 ALA 15 HB1 ALA 15 11.237 4.195 -14.675
3 HB3 ALA 15 HB2 ALA 15 12.142 5.210 -15.792
4 HB2 ALA 15 HB3 ALA 15 10.968 5.936 -14.704
5 H ALA 15 HN ALA 15 13.835 3.700 -14.556
No H/Q in entry = 5
In of MODEL 8
1 HA PRO 16 HA PRO 16 10.973 5.017 -10.035
2 HB2 PRO 16 HB2 PRO 16 10.572 2.507 -9.300
3 HG2 PRO 16 HG2 PRO 16 11.965 1.388 -10.777
4 HD2 PRO 16 HD2 PRO 16 12.839 2.504 -12.604
5 HB3 PRO 16 HB1 PRO 16 9.606 3.211 -10.600
6 HG3 PRO 16 HG1 PRO 16 10.454 1.337 -11.707
7 HD3 PRO 16 HD1 PRO 16 11.228 2.877 -13.233
No H/Q in entry = 7
In of MODEL 8
1 HA SER 17 HA SER 17 14.472 3.678 -7.673
2 HB2 SER 17 HB2 SER 17 14.652 5.283 -5.772
3 HG SER 17 HG SER 17 12.886 5.867 -4.969
4 H SER 17 HN SER 17 11.732 4.666 -7.868
5 HB3 SER 17 HB1 SER 17 14.250 6.107 -7.280
No H/Q in entry = 5
In of MODEL 8
1 HA PRO 18 HA PRO 18 12.861 0.683 -4.734
2 HB2 PRO 18 HB2 PRO 18 14.657 0.886 -2.637
3 HG2 PRO 18 HG2 PRO 18 15.878 2.710 -3.378
4 HD2 PRO 18 HD2 PRO 18 15.730 3.490 -5.546
5 HB3 PRO 18 HB1 PRO 18 14.966 -0.045 -4.106
6 HG3 PRO 18 HG1 PRO 18 16.771 1.416 -4.196
7 HD3 PRO 18 HD1 PRO 18 15.776 1.860 -6.244
No H/Q in entry = 7
In of MODEL 8
1 HA ALA 19 HA ALA 19 9.784 1.553 -1.803
2 HB3 ALA 19 HB1 ALA 19 10.461 2.724 0.219
3 HB1 ALA 19 HB2 ALA 19 12.023 3.114 -0.503
4 HB2 ALA 19 HB3 ALA 19 11.611 1.435 -0.145
5 H ALA 19 HN ALA 19 11.359 0.748 -3.171
No H/Q in entry = 5
In of MODEL 8
1 HA VAL 20 HA VAL 20 9.119 5.361 -3.955
2 HB VAL 20 HB VAL 20 7.029 5.119 -5.364
3 HG11 VAL 20 HG11 VAL 20 9.283 4.973 -6.321
4 HG13 VAL 20 HG12 VAL 20 8.152 3.844 -7.099
5 HG12 VAL 20 HG13 VAL 20 9.317 3.245 -5.909
6 HG23 VAL 20 HG21 VAL 20 6.450 2.779 -5.989
7 HG22 VAL 20 HG22 VAL 20 5.988 3.282 -4.370
8 HG21 VAL 20 HG23 VAL 20 7.388 2.230 -4.597
9 H VAL 20 HN VAL 20 8.654 2.564 -3.347
No H/Q in entry = 9
In of MODEL 8
1 HA THR 21 HA THR 21 5.825 6.573 -1.479
2 HB THR 21 HB THR 21 5.476 9.079 -1.797
3 HG1 THR 21 HG1 THR 21 6.433 9.998 -3.411
4 HG22 THR 21 HG21 THR 21 7.708 9.577 -0.860
5 HG21 THR 21 HG22 THR 21 8.251 7.974 -1.378
6 HG23 THR 21 HG23 THR 21 7.002 8.123 -0.147
7 H THR 21 HN THR 21 7.234 6.874 -3.979
No H/Q in entry = 7
In of MODEL 8
1 HA TYR 22 HA TYR 22 2.143 7.136 -3.831
2 HB2 TYR 22 HB2 TYR 22 1.689 5.666 -1.230
3 HD1 TYR 22 HD1 TYR 22 3.903 4.508 -1.765
4 HD2 TYR 22 HD2 TYR 22 0.527 4.383 -4.350
5 HE1 TYR 22 HE1 TYR 22 4.895 2.641 -2.945
6 HE2 TYR 22 HE2 TYR 22 1.508 2.488 -5.532
7 HH TYR 22 HH TYR 22 4.078 0.694 -4.454
8 H TYR 22 HN TYR 22 3.669 7.386 -1.347
9 HB3 TYR 22 HB1 TYR 22 0.473 5.789 -2.496
No H/Q in entry = 9
In of MODEL 8
1 HA ALA 23 HA ALA 23 -0.240 10.183 -1.711
2 HB1 ALA 23 HB1 ALA 23 0.133 10.962 -4.007
3 HB2 ALA 23 HB2 ALA 23 -1.478 11.402 -3.444
4 HB3 ALA 23 HB3 ALA 23 -1.265 10.037 -4.546
5 H ALA 23 HN ALA 23 -0.044 7.991 -3.659
No H/Q in entry = 5
In of MODEL 8
1 HA LEU 24 HA LEU 24 -4.003 8.366 -0.493
2 HB2 LEU 24 HB2 LEU 24 -4.880 11.234 -0.113
3 HG LEU 24 HG LEU 24 -2.860 10.999 1.141
4 HD13 LEU 24 HD11 LEU 24 -3.683 11.355 3.383
5 HD12 LEU 24 HD12 LEU 24 -5.259 10.741 2.885
6 HD11 LEU 24 HD13 LEU 24 -4.624 12.224 2.170
7 HD21 LEU 24 HD21 LEU 24 -4.061 8.515 2.290
8 HD23 LEU 24 HD22 LEU 24 -2.580 9.295 2.847
9 HD22 LEU 24 HD23 LEU 24 -2.661 8.615 1.222
10 H LEU 24 HN LEU 24 -2.363 10.633 -0.935
11 HB3 LEU 24 HB1 LEU 24 -5.547 9.811 0.617
No H/Q in entry = 11
In of MODEL 8
1 HA GLN 25 HA GLN 25 -7.981 7.968 -2.427
2 HB2 GLN 25 HB2 GLN 25 -6.996 10.491 -3.746
3 HG2 GLN 25 HG2 GLN 25 -8.928 10.130 -1.467
4 HE21 GLN 25 HE21 GLN 25 -9.623 11.179 -4.205
5 HE22 GLN 25 HE22 GLN 25 -10.073 12.815 -3.969
6 H GLN 25 HN GLN 25 -6.230 8.118 -1.062
7 HB3 GLN 25 HB1 GLN 25 -8.589 9.766 -3.956
8 HG3 GLN 25 HG1 GLN 25 -7.422 11.003 -1.497
No H/Q in entry = 8
In of MODEL 8
1 HA GLU 26 HA GLU 26 -5.492 6.913 -6.131
2 HB2 GLU 26 HB2 GLU 26 -3.325 7.894 -5.441
3 HG2 GLU 26 HG2 GLU 26 -1.774 6.437 -6.522
4 H GLU 26 HN GLU 26 -4.962 7.512 -3.356
5 HB3 GLU 26 HB1 GLU 26 -3.015 6.497 -4.432
6 HG3 GLU 26 HG1 GLU 26 -2.888 5.076 -6.386
No H/Q in entry = 6
In of MODEL 8
1 HA ASP 27 HA ASP 27 -6.271 2.809 -4.930
2 HB2 ASP 27 HB2 ASP 27 -6.921 2.915 -7.890
3 H ASP 27 HN ASP 27 -5.602 4.843 -6.933
4 HB3 ASP 27 HB1 ASP 27 -7.321 1.571 -6.831
No H/Q in entry = 4
In of MODEL 8
1 HA VAL 28 HA VAL 28 -2.936 0.535 -6.608
2 HB VAL 28 HB VAL 28 -1.301 0.449 -4.577
3 HG13 VAL 28 HG11 VAL 28 -0.771 2.787 -4.754
4 HG12 VAL 28 HG12 VAL 28 -2.373 3.126 -5.424
5 HG11 VAL 28 HG13 VAL 28 -1.215 2.163 -6.354
6 HG22 VAL 28 HG21 VAL 28 -1.886 1.937 -2.738
7 HG21 VAL 28 HG22 VAL 28 -3.053 0.614 -2.871
8 HG23 VAL 28 HG23 VAL 28 -3.467 2.221 -3.463
9 H VAL 28 HN VAL 28 -5.068 1.099 -4.691
No H/Q in entry = 9
In of MODEL 8
1 HA PHE 29 HA PHE 29 -3.691 -3.406 -4.971
2 HB2 PHE 29 HB2 PHE 29 -1.361 -3.716 -6.851
3 HD1 PHE 29 HD1 PHE 29 -4.405 -5.707 -6.121
4 HD2 PHE 29 HD2 PHE 29 -2.312 -3.281 -8.920
5 HE1 PHE 29 HE1 PHE 29 -6.056 -6.281 -7.848
6 HE2 PHE 29 HE2 PHE 29 -3.961 -3.838 -10.641
7 HZ PHE 29 HZ PHE 29 -5.841 -5.342 -10.114
8 H PHE 29 HN PHE 29 -1.954 -1.506 -6.285
9 HB3 PHE 29 HB1 PHE 29 -1.905 -5.084 -5.902
No H/Q in entry = 9
In of MODEL 8
1 HA ILE 30 HA ILE 30 -0.545 -3.919 -1.849
2 HB ILE 30 HB ILE 30 -3.311 -4.173 -0.688
3 HG12 ILE 30 HG12 ILE 30 -2.715 -2.170 0.571
4 HG22 ILE 30 HG21 ILE 30 -2.369 -4.265 1.605
5 HG21 ILE 30 HG22 ILE 30 -0.782 -4.576 0.898
6 HG23 ILE 30 HG23 ILE 30 -2.100 -5.723 0.651
7 HD12 ILE 30 HD11 ILE 30 -2.530 -0.556 -1.179
8 HD11 ILE 30 HD12 ILE 30 -3.652 -1.851 -1.667
9 HD13 ILE 30 HD13 ILE 30 -1.991 -1.824 -2.279
10 H ILE 30 HN ILE 30 -3.101 -4.578 -3.163
11 HG13 ILE 30 HG11 ILE 30 -1.102 -2.201 -0.125
No H/Q in entry = 11
In of MODEL 8
1 HA LYS 31 HA LYS 31 -0.211 -8.245 -1.816
2 HB2 LYS 31 HB2 LYS 31 1.782 -7.698 -2.907
3 HG2 LYS 31 HG2 LYS 31 2.417 -9.205 -0.395
4 HD2 LYS 31 HD2 LYS 31 3.989 -9.071 -2.958
5 HE2 LYS 31 HE2 LYS 31 4.415 -10.502 -0.359
6 HZ2 LYS 31 HZ1 LYS 31 6.514 -9.798 -1.300
7 HZ1 LYS 31 HZ2 LYS 31 6.104 -10.399 -2.803
8 HZ3 LYS 31 HZ3 LYS 31 6.370 -11.459 -1.528
9 H LYS 31 HN LYS 31 0.669 -5.502 -1.551
10 HB3 LYS 31 HB1 LYS 31 2.454 -6.938 -1.481
11 HG3 LYS 31 HG1 LYS 31 1.931 -9.880 -1.942
12 HD3 LYS 31 HD1 LYS 31 4.456 -8.330 -1.422
13 HE3 LYS 31 HE1 LYS 31 3.995 -11.267 -1.886
No H/Q in entry = 13
In of MODEL 8
1 HA CYS 32 HA CYS 32 -0.239 -8.701 2.485
2 HB2 CYS 32 HB2 CYS 32 -1.807 -10.570 2.993
3 HG CYS 32 HG CYS 32 -2.415 -10.720 -0.324
4 H CYS 32 HN CYS 32 -0.823 -9.400 -0.276
5 HB3 CYS 32 HB1 CYS 32 -2.528 -9.341 1.953
No H/Q in entry = 5
In of MODEL 8
1 HA ASN 33 HA ASN 33 2.832 -11.595 3.220
2 HB2 ASN 33 HB2 ASN 33 2.121 -11.533 5.541
3 HD21 ASN 33 HD21 ASN 33 1.545 -14.917 5.080
4 HD22 ASN 33 HD22 ASN 33 3.121 -15.458 5.523
5 H ASN 33 HN ASN 33 0.235 -10.783 3.889
6 HB3 ASN 33 HB1 ASN 33 0.901 -12.765 5.239
No H/Q in entry = 6
In of MODEL 8
1 HA ASP 34 HA ASP 34 0.835 -15.633 1.809
2 HB2 ASP 34 HB2 ASP 34 -1.534 -15.274 2.557
3 H ASP 34 HN ASP 34 -0.235 -13.076 2.552
4 HB3 ASP 34 HB1 ASP 34 -1.838 -14.443 1.041
No H/Q in entry = 4
In of MODEL 8
1 HA3 GLY 35 HA2 GLY 35 2.138 -12.241 -1.648
2 H GLY 35 HN GLY 35 0.865 -12.627 0.289
3 HA2 GLY 35 HA1 GLY 35 1.821 -13.886 -2.168
No H/Q in entry = 3
In of MODEL 8
1 HA ARG 36 HA ARG 36 -2.007 -12.412 -3.858
2 HB2 ARG 36 HB2 ARG 36 -3.554 -12.057 -1.286
3 HG2 ARG 36 HG2 ARG 36 -2.561 -14.269 -1.223
4 HD2 ARG 36 HD2 ARG 36 -3.998 -14.773 -3.806
5 HE ARG 36 HE ARG 36 -2.718 -16.472 -1.897
6 HH11 ARG 36 HH11 ARG 36 -3.592 -16.094 -5.305
7 HH12 ARG 36 HH12 ARG 36 -3.487 -17.756 -5.659
8 HH21 ARG 36 HH21 ARG 36 -2.593 -18.782 -2.415
9 HH22 ARG 36 HH22 ARG 36 -2.942 -19.291 -4.007
10 H ARG 36 HN ARG 36 -1.023 -12.715 -1.138
11 HB3 ARG 36 HB1 ARG 36 -4.206 -12.378 -2.883
12 HG3 ARG 36 HG1 ARG 36 -4.307 -14.340 -1.477
13 HD3 ARG 36 HD1 ARG 36 -2.258 -14.526 -3.673
No H/Q in entry = 13
In of MODEL 8
1 HA PHE 37 HA PHE 37 -2.155 -8.122 -3.266
2 HB2 PHE 37 HB2 PHE 37 -2.282 -8.814 -6.154
3 HD1 PHE 37 HD1 PHE 37 -0.998 -5.886 -4.337
4 HD2 PHE 37 HD2 PHE 37 -0.012 -9.505 -6.326
5 HE1 PHE 37 HE1 PHE 37 1.282 -5.227 -4.269
6 HE2 PHE 37 HE2 PHE 37 2.375 -8.876 -6.255
7 HZ PHE 37 HZ PHE 37 3.050 -6.731 -5.231
8 H PHE 37 HN PHE 37 -2.897 -10.550 -4.699
9 HB3 PHE 37 HB1 PHE 37 -2.674 -7.167 -5.674
No H/Q in entry = 9
In of MODEL 8
1 HA TYR 38 HA TYR 38 -6.423 -7.245 -3.541
2 HB2 TYR 38 HB2 TYR 38 -5.355 -6.290 -0.889
3 HD1 TYR 38 HD1 TYR 38 -8.393 -8.201 -1.224
4 HD2 TYR 38 HD2 TYR 38 -4.206 -8.438 -0.580
5 HE1 TYR 38 HE1 TYR 38 -8.659 -10.497 -0.392
6 HE2 TYR 38 HE2 TYR 38 -4.456 -10.736 0.258
7 HH TYR 38 HH TYR 38 -7.326 -12.485 -0.178
8 H TYR 38 HN TYR 38 -3.668 -6.829 -2.615
9 HB3 TYR 38 HB1 TYR 38 -7.057 -6.231 -1.312
No H/Q in entry = 9
In of MODEL 8
1 HA LEU 39 HA LEU 39 -5.840 -3.114 -4.811
2 HB2 LEU 39 HB2 LEU 39 -6.834 -4.097 -6.797
3 HG LEU 39 HG LEU 39 -8.496 -1.626 -6.268
4 HD13 LEU 39 HD11 LEU 39 -6.152 -1.160 -5.765
5 HD12 LEU 39 HD12 LEU 39 -6.653 -0.384 -7.266
6 HD11 LEU 39 HD13 LEU 39 -5.693 -1.868 -7.310
7 HD22 LEU 39 HD21 LEU 39 -8.396 -1.365 -8.650
8 HD21 LEU 39 HD22 LEU 39 -9.022 -2.983 -8.282
9 HD23 LEU 39 HD23 LEU 39 -7.339 -2.757 -8.786
10 H LEU 39 HN LEU 39 -7.326 -5.576 -4.542
11 HB3 LEU 39 HB1 LEU 39 -8.421 -4.037 -6.068
No H/Q in entry = 11
In of MODEL 8
1 HA3 GLY 40 HA2 GLY 40 -8.721 -0.806 -2.460
2 H GLY 40 HN GLY 40 -6.089 -1.407 -3.576
3 HA2 GLY 40 HA1 GLY 40 -7.363 -0.965 -1.354
No H/Q in entry = 3
In of MODEL 8
1 HA THR 41 HA THR 41 -7.082 3.263 -2.940
2 HB THR 41 HB THR 41 -9.487 3.758 -1.164
3 HG1 THR 41 HG1 THR 41 -9.421 3.120 -3.957
4 HG21 THR 41 HG21 THR 41 -8.228 5.748 -1.864
5 HG23 THR 41 HG22 THR 41 -9.818 5.702 -2.628
6 HG22 THR 41 HG23 THR 41 -8.382 5.258 -3.551
7 H THR 41 HN THR 41 -8.537 1.346 -1.232
No H/Q in entry = 7
In of MODEL 8
1 HA ILE 42 HA ILE 42 -4.968 4.100 0.877
2 HB ILE 42 HB ILE 42 -3.929 6.390 -0.810
3 HG12 ILE 42 HG12 ILE 42 -2.891 3.569 -0.590
4 HG21 ILE 42 HG21 ILE 42 -3.423 6.526 1.604
5 HG23 ILE 42 HG22 ILE 42 -1.957 6.197 0.682
6 HG22 ILE 42 HG23 ILE 42 -2.761 4.896 1.555
7 HD12 ILE 42 HD11 ILE 42 -1.054 5.079 -0.749
8 HD11 ILE 42 HD12 ILE 42 -1.772 5.827 -2.184
9 HD13 ILE 42 HD13 ILE 42 -1.251 4.133 -2.224
10 H ILE 42 HN ILE 42 -5.627 4.624 -1.887
11 HG13 ILE 42 HG11 ILE 42 -3.639 4.272 -2.014
No H/Q in entry = 11
In of MODEL 8
1 HA ILE 43 HA ILE 43 -7.238 7.616 2.217
2 HB ILE 43 HB ILE 43 -8.211 7.203 4.508
3 HG12 ILE 43 HG12 ILE 43 -6.287 5.369 4.810
4 HG23 ILE 43 HG21 ILE 43 -9.835 5.571 3.802
5 HG22 ILE 43 HG22 ILE 43 -8.842 5.161 2.411
6 HG21 ILE 43 HG23 ILE 43 -9.557 6.789 2.543
7 HD11 ILE 43 HD11 ILE 43 -7.509 3.896 3.153
8 HD13 ILE 43 HD12 ILE 43 -8.573 3.569 4.555
9 HD12 ILE 43 HD13 ILE 43 -6.863 3.211 4.629
10 H ILE 43 HN ILE 43 -5.666 5.163 2.653
11 HG13 ILE 43 HG11 ILE 43 -7.758 5.294 5.738
No H/Q in entry = 11
In of MODEL 8
1 HA ASP 44 HA ASP 44 -3.967 8.969 4.893
2 HB2 ASP 44 HB2 ASP 44 -5.333 7.606 6.709
3 H ASP 44 HN ASP 44 -4.522 6.290 4.017
4 HB3 ASP 44 HB1 ASP 44 -3.811 6.783 6.957
No H/Q in entry = 4
In of MODEL 8
1 HA GLN 45 HA GLN 45 -0.025 6.893 4.790
2 HB2 GLN 45 HB2 GLN 45 1.371 8.490 3.596
3 HG2 GLN 45 HG2 GLN 45 -0.873 10.444 4.080
4 HE21 GLN 45 HE21 GLN 45 2.390 11.158 3.109
5 HE22 GLN 45 HE22 GLN 45 1.966 11.846 1.586
6 H GLN 45 HN GLN 45 -1.719 9.043 5.789
7 HB3 GLN 45 HB1 GLN 45 -0.241 8.341 2.888
8 HG3 GLN 45 HG1 GLN 45 0.791 10.593 4.622
No H/Q in entry = 8
In of MODEL 8
1 HA THR 46 HA THR 46 2.496 8.871 7.775
2 HB THR 46 HB THR 46 3.830 7.061 8.988
3 HG1 THR 46 HG1 THR 46 3.081 4.940 8.639
4 HG21 THR 46 HG21 THR 46 1.710 7.840 9.879
5 HG23 THR 46 HG22 THR 46 1.926 6.108 10.159
6 HG22 THR 46 HG23 THR 46 0.851 6.664 8.874
7 H THR 46 HN THR 46 1.883 6.731 5.905
No H/Q in entry = 7
In of MODEL 8
1 HA SER 47 HA SER 47 6.287 9.022 5.767
2 HB2 SER 47 HB2 SER 47 7.707 8.068 8.260
3 HG SER 47 HG SER 47 7.798 10.255 8.748
4 H SER 47 HN SER 47 5.222 8.075 8.216
5 HB3 SER 47 HB1 SER 47 8.444 8.972 6.935
No H/Q in entry = 5
In of MODEL 8
1 HA ASP 48 HA ASP 48 7.385 4.837 4.896
2 HB2 ASP 48 HB2 ASP 48 8.272 4.326 7.193
3 H ASP 48 HN ASP 48 5.737 5.927 7.076
4 HB3 ASP 48 HB1 ASP 48 6.777 3.427 7.479
No H/Q in entry = 4
In of MODEL 8
1 HA GLN 49 HA GLN 49 3.597 2.434 4.859
2 HB2 GLN 49 HB2 GLN 49 2.675 3.054 7.646
3 HG2 GLN 49 HG2 GLN 49 3.705 0.505 6.453
4 HE21 GLN 49 HE21 GLN 49 3.794 -1.173 7.847
5 HE22 GLN 49 HE22 GLN 49 3.081 -1.176 9.415
6 H GLN 49 HN GLN 49 4.352 4.625 6.646
7 HB3 GLN 49 HB1 GLN 49 1.808 1.963 6.578
8 HG3 GLN 49 HG1 GLN 49 4.670 1.636 7.408
No H/Q in entry = 8
In of MODEL 8
1 HA TYR 50 HA TYR 50 -0.032 4.819 4.180
2 HB2 TYR 50 HB2 TYR 50 0.367 2.788 1.961
3 HD1 TYR 50 HD1 TYR 50 2.834 3.148 1.669
4 HD2 TYR 50 HD2 TYR 50 0.075 6.406 1.755
5 HE1 TYR 50 HE1 TYR 50 4.588 4.635 0.922
6 HE2 TYR 50 HE2 TYR 50 1.863 7.913 0.990
7 HH TYR 50 HH TYR 50 4.317 7.989 1.054
8 H TYR 50 HN TYR 50 1.383 2.270 4.356
9 HB3 TYR 50 HB1 TYR 50 -0.748 4.151 1.883
No H/Q in entry = 9
In of MODEL 8
1 HA LEU 51 HA LEU 51 -3.152 2.176 5.709
2 HB2 LEU 51 HB2 LEU 51 -3.393 4.389 6.984
3 HG LEU 51 HG LEU 51 -6.029 3.088 6.272
4 HD12 LEU 51 HD11 LEU 51 -5.788 1.900 8.369
5 HD11 LEU 51 HD12 LEU 51 -4.154 2.557 8.533
6 HD13 LEU 51 HD13 LEU 51 -4.541 1.482 7.194
7 HD21 LEU 51 HD21 LEU 51 -5.296 4.907 8.558
8 HD23 LEU 51 HD22 LEU 51 -6.837 4.066 8.338
9 HD22 LEU 51 HD23 LEU 51 -6.343 5.302 7.186
10 H LEU 51 HN LEU 51 -2.103 4.704 4.721
11 HB3 LEU 51 HB1 LEU 51 -4.446 4.899 5.687
No H/Q in entry = 11
In of MODEL 8
1 HA ILE 52 HA ILE 52 -5.389 2.261 1.967
2 HB ILE 52 HB ILE 52 -4.748 -0.678 2.243
3 HG12 ILE 52 HG12 ILE 52 -2.677 0.585 2.677
4 HG23 ILE 52 HG21 ILE 52 -4.697 -0.616 -0.207
5 HG22 ILE 52 HG22 ILE 52 -5.024 1.108 -0.177
6 HG21 ILE 52 HG23 ILE 52 -6.245 -0.026 0.409
7 HD11 ILE 52 HD11 ILE 52 -3.261 2.647 1.475
8 HD13 ILE 52 HD12 ILE 52 -2.983 1.759 -0.038
9 HD12 ILE 52 HD13 ILE 52 -1.659 2.021 1.103
10 H ILE 52 HN ILE 52 -4.259 0.973 4.356
11 HG13 ILE 52 HG11 ILE 52 -2.590 -0.252 1.138
No H/Q in entry = 11
In of MODEL 8
1 HA ARG 53 HA ARG 53 -9.083 0.457 3.375
2 HB2 ARG 53 HB2 ARG 53 -9.718 2.822 3.318
3 HG2 ARG 53 HG2 ARG 53 -11.746 1.110 1.935
4 HD2 ARG 53 HD2 ARG 53 -13.356 2.709 2.924
5 HE ARG 53 HE ARG 53 -12.276 2.972 0.581
6 HH11 ARG 53 HH11 ARG 53 -12.804 5.511 2.993
7 HH12 ARG 53 HH12 ARG 53 -12.709 6.789 1.883
8 HH21 ARG 53 HH21 ARG 53 -12.210 4.749 -0.965
9 HH22 ARG 53 HH22 ARG 53 -12.357 6.338 -0.415
10 H ARG 53 HN ARG 53 -7.491 2.115 1.598
11 HB3 ARG 53 HB1 ARG 53 -9.920 2.781 1.587
12 HG3 ARG 53 HG1 ARG 53 -11.544 1.327 3.678
13 HD3 ARG 53 HD1 ARG 53 -11.983 3.728 3.376
No H/Q in entry = 13
In of MODEL 8
1 HA PHE 54 HA PHE 54 -9.463 -1.800 -0.311
2 HB2 PHE 54 HB2 PHE 54 -10.120 -3.690 1.957
3 HD1 PHE 54 HD1 PHE 54 -7.666 -4.080 -0.711
4 HD2 PHE 54 HD2 PHE 54 -8.264 -3.008 3.356
5 HE1 PHE 54 HE1 PHE 54 -5.256 -4.194 -0.333
6 HE2 PHE 54 HE2 PHE 54 -5.859 -3.109 3.750
7 HZ PHE 54 HZ PHE 54 -4.328 -3.706 1.894
8 H PHE 54 HN PHE 54 -9.650 -1.336 2.538
9 HB3 PHE 54 HB1 PHE 54 -9.852 -4.160 0.277
No H/Q in entry = 9
In of MODEL 8
1 HA ASP 55 HA ASP 55 -13.602 -1.685 -1.228
2 HB2 ASP 55 HB2 ASP 55 -12.950 -3.159 -3.121
3 H ASP 55 HN ASP 55 -11.357 -3.412 -1.099
4 HB3 ASP 55 HB1 ASP 55 -13.458 -4.556 -2.175
No H/Q in entry = 4
In of MODEL 8
1 HA ASP 56 HA ASP 56 -15.414 -4.728 1.858
2 HB2 ASP 56 HB2 ASP 56 -12.765 -5.323 3.181
3 H ASP 56 HN ASP 56 -12.730 -4.183 0.876
4 HB3 ASP 56 HB1 ASP 56 -14.323 -6.014 3.600
No H/Q in entry = 4
In of MODEL 8
1 HA GLN 57 HA GLN 57 -13.539 -0.208 3.123
2 HB2 GLN 57 HB2 GLN 57 -15.870 -1.392 4.645
3 HG2 GLN 57 HG2 GLN 57 -16.276 -1.235 2.233
4 HE21 GLN 57 HE21 GLN 57 -14.677 -0.414 0.896
5 HE22 GLN 57 HE22 GLN 57 -14.583 1.247 0.471
6 H GLN 57 HN GLN 57 -13.597 -2.102 1.958
7 HB3 GLN 57 HB1 GLN 57 -15.393 0.304 4.660
8 HG3 GLN 57 HG1 GLN 57 -17.305 -0.144 3.144
No H/Q in entry = 8
In of MODEL 8
1 HA SER 58 HA SER 58 -11.675 -2.126 6.802
2 HB2 SER 58 HB2 SER 58 -11.765 -4.486 5.972
3 HG SER 58 HG SER 58 -9.564 -5.069 6.699
4 H SER 58 HN SER 58 -12.157 -2.673 4.004
5 HB3 SER 58 HB1 SER 58 -10.381 -4.134 4.932
No H/Q in entry = 5
In of MODEL 8
1 HA GLU 59 HA GLU 59 -8.086 -0.011 5.437
2 HB2 GLU 59 HB2 GLU 59 -8.572 0.912 8.270
3 HG2 GLU 59 HG2 GLU 59 -9.665 2.025 5.700
4 H GLU 59 HN GLU 59 -9.671 -1.372 7.507
5 HB3 GLU 59 HB1 GLU 59 -7.638 1.741 7.031
6 HG3 GLU 59 HG1 GLU 59 -10.595 1.197 6.938
No H/Q in entry = 6
In of MODEL 8
1 HA GLN 60 HA GLN 60 -4.814 -1.739 7.935
2 HB2 GLN 60 HB2 GLN 60 -4.336 -2.833 5.159
3 HG2 GLN 60 HG2 GLN 60 -5.763 -4.174 7.439
4 HE21 GLN 60 HE21 GLN 60 -3.389 -5.150 6.013
5 HE22 GLN 60 HE22 GLN 60 -3.910 -6.553 5.159
6 H GLN 60 HN GLN 60 -5.976 -0.589 5.466
7 HB3 GLN 60 HB1 GLN 60 -3.608 -3.397 6.645
8 HG3 GLN 60 HG1 GLN 60 -6.536 -3.557 5.983
No H/Q in entry = 8
In of MODEL 8
1 HA TRP 61 HA TRP 61 -1.507 0.812 6.507
2 HB2 TRP 61 HB2 TRP 61 -0.638 -0.301 9.185
3 HD1 TRP 61 HD1 TRP 61 -2.466 0.766 10.671
4 HE1 TRP 61 HE1 TRP 61 -3.273 3.152 11.078
5 HE3 TRP 61 HE3 TRP 61 0.090 3.111 6.936
6 HZ2 TRP 61 HZ2 TRP 61 -2.883 5.740 9.924
7 HZ3 TRP 61 HZ3 TRP 61 -0.185 5.539 6.647
8 HH2 TRP 61 HH2 TRP 61 -1.627 6.815 8.090
9 H TRP 61 HN TRP 61 -2.637 -1.237 8.256
10 HB3 TRP 61 HB1 TRP 61 0.377 0.782 8.248
No H/Q in entry = 10
In of MODEL 8
1 HA CYS 62 HA CYS 62 1.052 -2.321 4.961
2 HB2 CYS 62 HB2 CYS 62 -0.197 -0.945 2.589
3 HG CYS 62 HG CYS 62 -2.415 -1.500 3.989
4 H CYS 62 HN CYS 62 -0.352 0.245 4.876
5 HB3 CYS 62 HB1 CYS 62 0.513 -2.557 2.639
No H/Q in entry = 5
In of MODEL 8
1 HA GLU 63 HA GLU 63 4.458 0.190 3.998
2 HB2 GLU 63 HB2 GLU 63 5.377 -2.645 3.696
3 HG2 GLU 63 HG2 GLU 63 6.895 -1.640 5.574
4 H GLU 63 HN GLU 63 3.128 -2.305 4.179
5 HB3 GLU 63 HB1 GLU 63 6.478 -1.308 3.444
6 HG3 GLU 63 HG1 GLU 63 5.535 -0.583 5.779
No H/Q in entry = 6
In of MODEL 8
1 HA PRO 64 HA PRO 64 4.330 1.195 -0.153
2 HB2 PRO 64 HB2 PRO 64 6.816 2.068 -0.791
3 HG2 PRO 64 HG2 PRO 64 8.012 1.283 1.058
4 HD2 PRO 64 HD2 PRO 64 6.955 0.473 2.923
5 HB3 PRO 64 HB1 PRO 64 5.694 2.960 0.216
6 HG3 PRO 64 HG1 PRO 64 7.451 2.830 1.710
7 HD3 PRO 64 HD1 PRO 64 5.862 1.789 3.080
No H/Q in entry = 7
In of MODEL 8
1 HA ASP 65 HA ASP 65 7.149 -1.967 -2.198
2 HB2 ASP 65 HB2 ASP 65 8.274 -3.946 -1.383
3 H ASP 65 HN ASP 65 6.728 -1.241 0.542
4 HB3 ASP 65 HB1 ASP 65 8.783 -2.578 -0.410
No H/Q in entry = 4
In of MODEL 8
1 HA LYS 66 HA LYS 66 3.680 -4.942 -1.250
2 HB2 LYS 66 HB2 LYS 66 2.459 -3.258 0.949
3 HG2 LYS 66 HG2 LYS 66 4.422 -4.366 1.756
4 HD2 LYS 66 HD2 LYS 66 3.100 -6.850 0.685
5 HE2 LYS 66 HE2 LYS 66 4.007 -7.270 2.809
6 HZ1 LYS 66 HZ1 LYS 66 6.468 -5.946 1.759
7 HZ3 LYS 66 HZ2 LYS 66 6.517 -6.974 3.079
8 HZ2 LYS 66 HZ3 LYS 66 5.601 -5.569 3.168
9 H LYS 66 HN LYS 66 4.623 -2.490 0.012
10 HB3 LYS 66 HB1 LYS 66 1.799 -4.771 0.351
11 HG3 LYS 66 HG1 LYS 66 2.964 -5.101 2.424
12 HD3 LYS 66 HD1 LYS 66 4.618 -6.138 0.134
13 HE3 LYS 66 HE1 LYS 66 5.013 -8.014 1.562
No H/Q in entry = 13
In of MODEL 8
1 HA LEU 67 HA LEU 67 0.820 -1.706 -2.853
2 HB2 LEU 67 HB2 LEU 67 2.756 0.482 -2.147
3 HG LEU 67 HG LEU 67 0.872 -0.741 -0.485
4 HD12 LEU 67 HD11 LEU 67 1.193 1.297 0.880
5 HD11 LEU 67 HD12 LEU 67 2.113 2.009 -0.462
6 HD13 LEU 67 HD13 LEU 67 2.668 0.525 0.353
7 HD21 LEU 67 HD21 LEU 67 -0.798 0.299 -1.902
8 HD23 LEU 67 HD22 LEU 67 -0.139 1.882 -1.454
9 HD22 LEU 67 HD23 LEU 67 -0.832 0.816 -0.226
10 H LEU 67 HN LEU 67 3.497 -1.694 -1.708
11 HB3 LEU 67 HB1 LEU 67 1.237 0.734 -2.965
No H/Q in entry = 11
In of MODEL 8
1 HA ARG 68 HA ARG 68 2.942 -0.792 -6.622
2 HB2 ARG 68 HB2 ARG 68 0.867 -2.867 -7.396
3 HG2 ARG 68 HG2 ARG 68 2.213 -3.856 -5.644
4 HD2 ARG 68 HD2 ARG 68 4.211 -2.554 -5.707
5 HE ARG 68 HE ARG 68 4.302 -3.066 -8.436
6 HH11 ARG 68 HH11 ARG 68 6.528 -2.976 -5.665
7 HH12 ARG 68 HH12 ARG 68 7.875 -2.491 -6.558
8 HH21 ARG 68 HH21 ARG 68 6.102 -2.354 -9.676
9 HH22 ARG 68 HH22 ARG 68 7.618 -2.088 -8.952
10 H ARG 68 HN ARG 68 0.582 -1.483 -4.997
11 HB3 ARG 68 HB1 ARG 68 2.303 -2.437 -8.299
12 HG3 ARG 68 HG1 ARG 68 2.568 -4.599 -7.207
13 HD3 ARG 68 HD1 ARG 68 4.603 -4.254 -5.938
No H/Q in entry = 13
In of MODEL 8
1 HA LYS 69 HA LYS 69 -0.082 1.974 -8.130
2 HB2 LYS 69 HB2 LYS 69 2.196 2.339 -10.094
3 HG2 LYS 69 HG2 LYS 69 2.263 4.667 -9.091
4 HD2 LYS 69 HD2 LYS 69 3.085 2.367 -7.343
5 HE2 LYS 69 HE2 LYS 69 3.320 4.525 -6.243
6 HZ2 LYS 69 HZ1 LYS 69 3.588 6.011 -8.127
7 HZ1 LYS 69 HZ2 LYS 69 5.064 5.271 -8.507
8 HZ3 LYS 69 HZ3 LYS 69 4.900 6.127 -7.080
9 H LYS 69 HN LYS 69 2.453 0.644 -8.299
10 HB3 LYS 69 HB1 LYS 69 0.725 3.289 -10.146
11 HG3 LYS 69 HG1 LYS 69 1.348 3.982 -7.756
12 HD3 LYS 69 HD1 LYS 69 4.007 2.951 -8.732
13 HE3 LYS 69 HE1 LYS 69 4.876 3.800 -6.601
No H/Q in entry = 13
In of MODEL 8
1 HA LEU 70 HA LEU 70 -1.880 -0.457 -11.231
2 HB2 LEU 70 HB2 LEU 70 -3.732 1.915 -11.428
3 HG LEU 70 HG LEU 70 -3.846 1.330 -9.126
4 HD11 LEU 70 HD11 LEU 70 -6.092 0.036 -10.614
5 HD13 LEU 70 HD12 LEU 70 -5.968 1.748 -10.162
6 HD12 LEU 70 HD13 LEU 70 -6.086 0.495 -8.916
7 HD23 LEU 70 HD21 LEU 70 -4.186 -1.527 -9.995
8 HD22 LEU 70 HD22 LEU 70 -4.304 -0.904 -8.351
9 HD21 LEU 70 HD23 LEU 70 -2.762 -0.833 -9.202
10 H LEU 70 HN LEU 70 -1.696 2.039 -9.776
11 HB3 LEU 70 HB1 LEU 70 -4.076 0.278 -11.934
No H/Q in entry = 11
In of MODEL 8
1 HA3 GLY 71 HA2 GLY 71 -0.307 2.176 -14.556
2 H GLY 71 HN GLY 71 -1.193 2.883 -11.889
3 HA2 GLY 71 HA1 GLY 71 -1.486 3.475 -14.374
No H/Q in entry = 3
In of MODEL 8
1 HA3 GLY 72 HA2 GLY 72 2.756 5.386 -15.111
2 H GLY 72 HN GLY 72 1.289 3.606 -15.300
3 HA2 GLY 72 HA1 GLY 72 2.126 5.714 -13.498
No H/Q in entry = 3
In of MODEL 8
1 HA3 GLY 73 HA2 GLY 73 4.352 2.907 -10.871
2 H GLY 73 HN GLY 73 3.069 4.825 -11.762
3 HA2 GLY 73 HA1 GLY 73 5.314 2.993 -12.345
No H/Q in entry = 3
In of MODEL 8
1 HA SER 74 HA SER 74 7.700 6.106 -10.520
2 HB2 SER 74 HB2 SER 74 7.131 7.613 -13.089
3 HG SER 74 HG SER 74 9.227 6.574 -13.586
4 H SER 74 HN SER 74 6.035 5.414 -12.728
5 HB3 SER 74 HB1 SER 74 8.510 7.856 -12.013
No H/Q in entry = 5
In of MODEL 8
1 HA SER 75 HA SER 75 4.250 9.025 -9.715
2 HB2 SER 75 HB2 SER 75 2.554 8.331 -12.130
3 HG SER 75 HG SER 75 3.790 10.618 -12.496
4 H SER 75 HN SER 75 4.598 6.895 -11.670
5 HB3 SER 75 HB1 SER 75 2.451 9.789 -11.138
No H/Q in entry = 5
In of MODEL 9
1 H1 GLY 7 HT2 GLY 7 12.535 -4.948 -12.898
2 H2 GLY 7 HT1 GLY 7 13.839 -3.972 -13.309
3 H3 GLY 7 HT3 GLY 7 14.120 -5.474 -12.585
4 HA3 GLY 7 HA1 GLY 7 13.085 -4.750 -10.573
5 HA2 GLY 7 HA2 GLY 7 14.404 -3.672 -11.028
No H/Q in entry = 5
In of MODEL 9
1 HA ALA 8 HA ALA 8 12.804 0.215 -12.446
2 HB2 ALA 8 HB1 ALA 8 10.409 0.316 -12.907
3 HB1 ALA 8 HB2 ALA 8 10.204 -1.327 -12.298
4 HB3 ALA 8 HB3 ALA 8 11.142 -1.039 -13.764
5 H ALA 8 HN ALA 8 13.829 -1.745 -12.243
No H/Q in entry = 5
In of MODEL 9
1 HA MET 9 HA MET 9 13.547 2.214 -8.690
2 HB2 MET 9 HB2 MET 9 11.285 3.018 -9.536
3 HG2 MET 9 HG2 MET 9 10.380 3.850 -7.432
4 HE3 MET 9 HE1 MET 9 11.263 5.915 -6.012
5 HE2 MET 9 HE2 MET 9 12.976 6.260 -5.772
6 HE1 MET 9 HE3 MET 9 12.268 4.796 -5.091
7 H MET 9 HN MET 9 13.531 1.135 -10.669
8 HB3 MET 9 HB1 MET 9 10.546 1.735 -8.593
9 HG3 MET 9 HG1 MET 9 11.423 2.744 -6.540
No H/Q in entry = 9
In of MODEL 9
1 HA ALA 10 HA ALA 10 13.516 -1.359 -6.118
2 HB3 ALA 10 HB1 ALA 10 12.998 -3.687 -6.769
3 HB2 ALA 10 HB2 ALA 10 12.957 -3.201 -8.464
4 HB1 ALA 10 HB3 ALA 10 11.755 -2.572 -7.339
5 H ALA 10 HN ALA 10 13.771 -0.645 -8.946
No H/Q in entry = 5
In of MODEL 9
1 HA PRO 11 HA PRO 11 17.900 -1.578 -6.766
2 HB2 PRO 11 HB2 PRO 11 18.496 -3.041 -4.501
3 HG2 PRO 11 HG2 PRO 11 16.341 -3.443 -3.765
4 HD2 PRO 11 HD2 PRO 11 14.524 -2.323 -4.618
5 HB3 PRO 11 HB1 PRO 11 18.263 -1.290 -4.549
6 HG3 PRO 11 HG1 PRO 11 16.608 -1.855 -3.025
7 HD3 PRO 11 HD1 PRO 11 15.357 -0.757 -4.632
No H/Q in entry = 7
In of MODEL 9
1 HA PRO 12 HA PRO 12 18.253 -5.663 -8.762
2 HB2 PRO 12 HB2 PRO 12 20.920 -4.569 -9.455
3 HG2 PRO 12 HG2 PRO 12 20.191 -2.588 -10.419
4 HD2 PRO 12 HD2 PRO 12 19.888 -2.124 -8.160
5 HB3 PRO 12 HB1 PRO 12 19.665 -5.203 -10.526
6 HG3 PRO 12 HG1 PRO 12 18.534 -3.181 -10.611
7 HD3 PRO 12 HD1 PRO 12 18.229 -1.870 -8.752
No H/Q in entry = 7
In of MODEL 9
1 HA VAL 13 HA VAL 13 21.839 -6.578 -6.000
2 HB VAL 13 HB VAL 13 23.206 -3.849 -5.948
3 HG11 VAL 13 HG11 VAL 13 23.990 -5.326 -4.189
4 HG13 VAL 13 HG12 VAL 13 25.245 -5.078 -5.399
5 HG12 VAL 13 HG13 VAL 13 24.328 -6.586 -5.377
6 HG23 VAL 13 HG21 VAL 13 23.696 -6.145 -7.846
7 HG22 VAL 13 HG22 VAL 13 24.666 -4.674 -7.747
8 HG21 VAL 13 HG23 VAL 13 22.981 -4.588 -8.258
9 H VAL 13 HN VAL 13 20.899 -4.032 -7.110
No H/Q in entry = 9
In of MODEL 9
1 HA ALA 14 HA ALA 14 20.155 -5.840 -2.057
2 HB3 ALA 14 HB1 ALA 14 21.738 -7.624 -1.500
3 HB2 ALA 14 HB2 ALA 14 21.571 -6.468 -0.177
4 HB1 ALA 14 HB3 ALA 14 22.993 -6.416 -1.221
5 H ALA 14 HN ALA 14 22.152 -6.686 -3.702
No H/Q in entry = 5
In of MODEL 9
1 HA ALA 15 HA ALA 15 21.438 -1.861 -0.623
2 HB3 ALA 15 HB1 ALA 15 20.894 -1.457 -2.960
3 HB2 ALA 15 HB2 ALA 15 20.031 -0.259 -1.991
4 HB1 ALA 15 HB3 ALA 15 19.184 -1.660 -2.625
5 H ALA 15 HN ALA 15 19.544 -3.975 -1.278
No H/Q in entry = 5
In of MODEL 9
1 HA PRO 16 HA PRO 16 18.335 -0.795 2.580
2 HB2 PRO 16 HB2 PRO 16 17.616 1.802 1.833
3 HG2 PRO 16 HG2 PRO 16 18.947 1.920 -0.068
4 HD2 PRO 16 HD2 PRO 16 20.797 0.481 -0.392
5 HB3 PRO 16 HB1 PRO 16 18.977 1.383 2.877
6 HG3 PRO 16 HG1 PRO 16 20.102 2.478 1.157
7 HD3 PRO 16 HD1 PRO 16 21.090 0.356 1.346
No H/Q in entry = 7
In of MODEL 9
1 HA SER 17 HA SER 17 14.389 -1.198 0.908
2 HB2 SER 17 HB2 SER 17 13.961 -0.902 3.393
3 HG SER 17 HG SER 17 11.693 0.210 2.323
4 H SER 17 HN SER 17 16.029 0.308 2.700
5 HB3 SER 17 HB1 SER 17 13.568 0.781 3.063
No H/Q in entry = 5
In of MODEL 9
1 HA PRO 18 HA PRO 18 14.156 2.199 -1.992
2 HB2 PRO 18 HB2 PRO 18 12.072 1.243 -3.498
3 HG2 PRO 18 HG2 PRO 18 11.459 -0.575 -2.203
4 HD2 PRO 18 HD2 PRO 18 12.795 -1.355 -0.503
5 HB3 PRO 18 HB1 PRO 18 13.738 0.677 -3.681
6 HG3 PRO 18 HG1 PRO 18 12.703 -1.343 -3.204
7 HD3 PRO 18 HD1 PRO 18 14.261 -1.324 -1.507
No H/Q in entry = 7
In of MODEL 9
1 HA ALA 19 HA ALA 19 10.602 4.001 -0.385
2 HB2 ALA 19 HB1 ALA 19 12.497 6.310 -0.741
3 HB1 ALA 19 HB2 ALA 19 12.440 5.230 0.648
4 HB3 ALA 19 HB3 ALA 19 11.067 6.281 0.287
5 H ALA 19 HN ALA 19 12.997 4.067 -2.023
No H/Q in entry = 5
In of MODEL 9
1 HA VAL 20 HA VAL 20 8.863 5.605 -4.041
2 HB VAL 20 HB VAL 20 6.769 4.322 -4.511
3 HG12 VAL 20 HG11 VAL 20 8.029 2.516 -5.782
4 HG11 VAL 20 HG12 VAL 20 9.456 2.892 -4.815
5 HG13 VAL 20 HG13 VAL 20 8.799 4.095 -5.924
6 HG21 VAL 20 HG21 VAL 20 6.636 3.078 -2.421
7 HG23 VAL 20 HG22 VAL 20 8.110 2.201 -2.823
8 HG22 VAL 20 HG23 VAL 20 6.654 1.968 -3.792
9 H VAL 20 HN VAL 20 9.250 3.579 -2.014
No H/Q in entry = 9
In of MODEL 9
1 HA THR 21 HA THR 21 5.572 6.963 -1.589
2 HB THR 21 HB THR 21 5.220 9.321 -2.340
3 HG1 THR 21 HG1 THR 21 6.381 10.093 -3.935
4 HG23 THR 21 HG21 THR 21 6.667 8.752 -0.501
5 HG22 THR 21 HG22 THR 21 7.464 10.014 -1.454
6 HG21 THR 21 HG23 THR 21 7.961 8.324 -1.612
7 H THR 21 HN THR 21 6.772 6.651 -4.209
No H/Q in entry = 7
In of MODEL 9
1 HA TYR 22 HA TYR 22 1.912 7.344 -4.040
2 HB2 TYR 22 HB2 TYR 22 1.409 5.962 -1.404
3 HD1 TYR 22 HD1 TYR 22 0.632 4.623 -4.681
4 HD2 TYR 22 HD2 TYR 22 3.509 4.719 -1.562
5 HE1 TYR 22 HE1 TYR 22 1.748 2.706 -5.662
6 HE2 TYR 22 HE2 TYR 22 4.652 2.820 -2.536
7 HH TYR 22 HH TYR 22 4.160 0.919 -4.129
8 H TYR 22 HN TYR 22 3.431 7.766 -1.583
9 HB3 TYR 22 HB1 TYR 22 0.281 5.984 -2.754
No H/Q in entry = 9
In of MODEL 9
1 HA ALA 23 HA ALA 23 -0.459 10.474 -2.059
2 HB2 ALA 23 HB1 ALA 23 -1.742 11.619 -3.805
3 HB3 ALA 23 HB2 ALA 23 -1.513 10.240 -4.878
4 HB1 ALA 23 HB3 ALA 23 -0.123 11.212 -4.387
5 H ALA 23 HN ALA 23 -0.127 8.328 -4.032
No H/Q in entry = 5
In of MODEL 9
1 HA LEU 24 HA LEU 24 -4.093 8.552 -0.737
2 HB2 LEU 24 HB2 LEU 24 -5.072 11.371 -0.300
3 HG LEU 24 HG LEU 24 -2.925 11.199 0.812
4 HD11 LEU 24 HD11 LEU 24 -5.199 10.891 2.742
5 HD13 LEU 24 HD12 LEU 24 -4.629 12.395 1.996
6 HD12 LEU 24 HD13 LEU 24 -3.589 11.504 3.114
7 HD22 LEU 24 HD21 LEU 24 -2.668 8.816 0.882
8 HD21 LEU 24 HD22 LEU 24 -3.989 8.685 2.046
9 HD23 LEU 24 HD23 LEU 24 -2.488 9.493 2.499
10 H LEU 24 HN LEU 24 -2.563 10.868 -1.258
11 HB3 LEU 24 HB1 LEU 24 -5.595 9.907 0.473
No H/Q in entry = 11
In of MODEL 9
1 HA GLN 25 HA GLN 25 -8.073 7.813 -2.398
2 HB2 GLN 25 HB2 GLN 25 -7.484 10.450 -3.735
3 HG2 GLN 25 HG2 GLN 25 -9.113 9.879 -1.266
4 HE21 GLN 25 HE21 GLN 25 -11.068 10.602 -2.132
5 HE22 GLN 25 HE22 GLN 25 -11.355 12.249 -2.551
6 H GLN 25 HN GLN 25 -6.276 8.164 -1.163
7 HB3 GLN 25 HB1 GLN 25 -9.016 9.583 -3.789
8 HG3 GLN 25 HG1 GLN 25 -7.710 10.907 -1.439
No H/Q in entry = 8
In of MODEL 9
1 HA GLU 26 HA GLU 26 -5.819 6.866 -6.146
2 HB2 GLU 26 HB2 GLU 26 -3.683 7.979 -5.526
3 HG2 GLU 26 HG2 GLU 26 -2.182 6.713 -6.886
4 H GLU 26 HN GLU 26 -5.272 7.269 -3.325
5 HB3 GLU 26 HB1 GLU 26 -3.215 6.536 -4.643
6 HG3 GLU 26 HG1 GLU 26 -3.145 5.248 -6.667
No H/Q in entry = 6
In of MODEL 9
1 HA ASP 27 HA ASP 27 -6.309 2.664 -5.137
2 HB2 ASP 27 HB2 ASP 27 -6.752 2.777 -8.142
3 H ASP 27 HN ASP 27 -5.746 4.842 -7.023
4 HB3 ASP 27 HB1 ASP 27 -7.225 1.453 -7.089
No H/Q in entry = 4
In of MODEL 9
1 HA VAL 28 HA VAL 28 -2.730 0.628 -6.748
2 HB VAL 28 HB VAL 28 -1.118 0.606 -4.672
3 HG12 VAL 28 HG11 VAL 28 -0.658 2.960 -4.853
4 HG11 VAL 28 HG12 VAL 28 -2.221 3.241 -5.627
5 HG13 VAL 28 HG13 VAL 28 -0.973 2.296 -6.457
6 HG22 VAL 28 HG21 VAL 28 -2.885 0.767 -2.992
7 HG21 VAL 28 HG22 VAL 28 -3.349 2.342 -3.638
8 HG23 VAL 28 HG23 VAL 28 -1.763 2.127 -2.902
9 H VAL 28 HN VAL 28 -4.885 1.142 -4.834
No H/Q in entry = 9
In of MODEL 9
1 HA PHE 29 HA PHE 29 -3.477 -3.337 -5.083
2 HB2 PHE 29 HB2 PHE 29 -1.137 -3.663 -6.952
3 HD1 PHE 29 HD1 PHE 29 -1.953 -3.531 -9.083
4 HD2 PHE 29 HD2 PHE 29 -4.267 -5.466 -6.094
5 HE1 PHE 29 HE1 PHE 29 -3.591 -4.193 -10.786
6 HE2 PHE 29 HE2 PHE 29 -5.921 -6.121 -7.791
7 HZ PHE 29 HZ PHE 29 -5.584 -5.485 -10.141
8 H PHE 29 HN PHE 29 -1.769 -1.440 -6.464
9 HB3 PHE 29 HB1 PHE 29 -1.655 -5.003 -5.961
No H/Q in entry = 9
In of MODEL 9
1 HA ILE 30 HA ILE 30 -0.376 -3.907 -1.946
2 HB ILE 30 HB ILE 30 -3.149 -4.074 -0.800
3 HG12 ILE 30 HG12 ILE 30 -2.498 -2.073 0.477
4 HG21 ILE 30 HG21 ILE 30 -0.620 -4.503 0.772
5 HG23 ILE 30 HG22 ILE 30 -1.968 -5.627 0.547
6 HG22 ILE 30 HG23 ILE 30 -2.195 -4.163 1.492
7 HD13 ILE 30 HD11 ILE 30 -1.917 -1.753 -2.411
8 HD12 ILE 30 HD12 ILE 30 -2.389 -0.463 -1.289
9 HD11 ILE 30 HD13 ILE 30 -3.538 -1.753 -1.719
10 H ILE 30 HN ILE 30 -2.958 -4.429 -3.271
11 HG13 ILE 30 HG11 ILE 30 -0.921 -2.104 -0.293
No H/Q in entry = 11
In of MODEL 9
1 HA LYS 31 HA LYS 31 -0.470 -8.222 -2.034
2 HB2 LYS 31 HB2 LYS 31 1.562 -7.851 -3.168
3 HG2 LYS 31 HG2 LYS 31 2.069 -9.589 -0.787
4 HD2 LYS 31 HD2 LYS 31 3.476 -9.566 -3.432
5 HE2 LYS 31 HE2 LYS 31 3.724 -11.207 -0.945
6 HZ1 LYS 31 HZ1 LYS 31 5.921 -10.702 -1.802
7 HZ3 LYS 31 HZ2 LYS 31 5.480 -11.250 -3.352
8 HZ2 LYS 31 HZ3 LYS 31 5.526 -12.319 -2.057
9 H LYS 31 HN LYS 31 0.727 -5.619 -1.646
10 HB3 LYS 31 HB1 LYS 31 2.374 -7.311 -1.716
11 HG3 LYS 31 HG1 LYS 31 1.393 -10.105 -2.327
12 HD3 LYS 31 HD1 LYS 31 4.152 -8.967 -1.908
13 HE3 LYS 31 HE1 LYS 31 3.259 -11.754 -2.549
No H/Q in entry = 13
In of MODEL 9
1 HA CYS 32 HA CYS 32 -0.384 -8.871 2.256
2 HB2 CYS 32 HB2 CYS 32 -2.727 -9.491 1.680
3 HG CYS 32 HG CYS 32 -2.916 -10.119 4.157
4 H CYS 32 HN CYS 32 -1.072 -9.466 -0.503
5 HB3 CYS 32 HB1 CYS 32 -2.145 -11.035 1.070
No H/Q in entry = 5
In of MODEL 9
1 HA ASN 33 HA ASN 33 2.760 -11.745 2.763
2 HB2 ASN 33 HB2 ASN 33 2.236 -11.330 5.107
3 HD21 ASN 33 HD21 ASN 33 4.424 -11.956 5.012
4 HD22 ASN 33 HD22 ASN 33 4.948 -13.522 5.469
5 H ASN 33 HN ASN 33 0.308 -10.704 3.615
6 HB3 ASN 33 HB1 ASN 33 1.003 -12.576 5.067
No H/Q in entry = 6
In of MODEL 9
1 HA ASP 34 HA ASP 34 0.424 -15.732 1.888
2 HB2 ASP 34 HB2 ASP 34 -1.813 -15.298 2.769
3 H ASP 34 HN ASP 34 -0.414 -13.019 2.391
4 HB3 ASP 34 HB1 ASP 34 -2.227 -14.369 1.331
No H/Q in entry = 4
In of MODEL 9
1 HA3 GLY 35 HA2 GLY 35 1.710 -12.814 -1.904
2 H GLY 35 HN GLY 35 0.533 -12.889 0.113
3 HA2 GLY 35 HA1 GLY 35 1.137 -14.414 -2.314
No H/Q in entry = 3
In of MODEL 9
1 HA ARG 36 HA ARG 36 -2.432 -12.478 -3.890
2 HB2 ARG 36 HB2 ARG 36 -3.811 -12.721 -1.270
3 HG2 ARG 36 HG2 ARG 36 -5.464 -13.981 -2.592
4 HD2 ARG 36 HD2 ARG 36 -2.620 -14.893 -2.946
5 HE ARG 36 HE ARG 36 -4.859 -16.020 -4.014
6 HH11 ARG 36 HH11 ARG 36 -2.637 -17.114 -1.522
7 HH12 ARG 36 HH12 ARG 36 -2.579 -18.728 -2.049
8 HH21 ARG 36 HH21 ARG 36 -4.914 -18.203 -4.694
9 HH22 ARG 36 HH22 ARG 36 -3.939 -19.375 -3.948
10 H ARG 36 HN ARG 36 -1.532 -13.036 -1.220
11 HB3 ARG 36 HB1 ARG 36 -4.596 -11.755 -2.513
12 HG3 ARG 36 HG1 ARG 36 -4.495 -13.699 -4.026
13 HD3 ARG 36 HD1 ARG 36 -3.677 -15.248 -1.576
No H/Q in entry = 13
In of MODEL 9
1 HA PHE 37 HA PHE 37 -2.306 -8.206 -3.374
2 HB2 PHE 37 HB2 PHE 37 -2.429 -8.980 -6.252
3 HD1 PHE 37 HD1 PHE 37 -1.151 -6.049 -4.415
4 HD2 PHE 37 HD2 PHE 37 -0.176 -9.588 -6.548
5 HE1 PHE 37 HE1 PHE 37 1.125 -5.348 -4.415
6 HE2 PHE 37 HE2 PHE 37 2.202 -8.912 -6.542
7 HZ PHE 37 HZ PHE 37 2.876 -6.797 -5.480
8 H PHE 37 HN PHE 37 -3.130 -10.630 -4.750
9 HB3 PHE 37 HB1 PHE 37 -2.830 -7.324 -5.837
No H/Q in entry = 9
In of MODEL 9
1 HA TYR 38 HA TYR 38 -6.506 -7.143 -3.595
2 HB2 TYR 38 HB2 TYR 38 -5.256 -6.127 -1.045
3 HD1 TYR 38 HD1 TYR 38 -8.333 -8.050 -1.206
4 HD2 TYR 38 HD2 TYR 38 -4.129 -8.244 -0.601
5 HE1 TYR 38 HE1 TYR 38 -8.579 -10.299 -0.240
6 HE2 TYR 38 HE2 TYR 38 -4.365 -10.483 0.372
7 HH TYR 38 HH TYR 38 -7.209 -12.300 0.118
8 H TYR 38 HN TYR 38 -3.700 -6.825 -2.808
9 HB3 TYR 38 HB1 TYR 38 -6.974 -6.051 -1.367
No H/Q in entry = 9
In of MODEL 9
1 HA LEU 39 HA LEU 39 -5.645 -3.094 -4.976
2 HB2 LEU 39 HB2 LEU 39 -6.697 -4.043 -6.939
3 HG LEU 39 HG LEU 39 -8.207 -1.465 -6.459
4 HD12 LEU 39 HD11 LEU 39 -6.289 -0.377 -7.505
5 HD11 LEU 39 HD12 LEU 39 -5.427 -1.917 -7.494
6 HD13 LEU 39 HD13 LEU 39 -5.848 -1.125 -5.974
7 HD23 LEU 39 HD21 LEU 39 -7.142 -2.744 -8.947
8 HD22 LEU 39 HD22 LEU 39 -8.099 -1.269 -8.846
9 HD21 LEU 39 HD23 LEU 39 -8.830 -2.827 -8.435
10 H LEU 39 HN LEU 39 -7.320 -5.425 -4.640
11 HB3 LEU 39 HB1 LEU 39 -8.279 -3.878 -6.214
No H/Q in entry = 11
In of MODEL 9
1 HA3 GLY 40 HA2 GLY 40 -8.349 -0.842 -2.424
2 H GLY 40 HN GLY 40 -5.749 -1.449 -3.641
3 HA2 GLY 40 HA1 GLY 40 -6.888 -0.924 -1.444
No H/Q in entry = 3
In of MODEL 9
1 HA THR 41 HA THR 41 -6.926 3.252 -3.083
2 HB THR 41 HB THR 41 -9.458 3.581 -1.454
3 HG1 THR 41 HG1 THR 41 -9.217 2.937 -4.243
4 HG21 THR 41 HG21 THR 41 -8.344 5.111 -3.813
5 HG23 THR 41 HG22 THR 41 -8.339 5.662 -2.139
6 HG22 THR 41 HG23 THR 41 -9.868 5.454 -2.997
7 H THR 41 HN THR 41 -8.276 1.315 -1.342
No H/Q in entry = 7
In of MODEL 9
1 HA ILE 42 HA ILE 42 -4.909 4.188 0.742
2 HB ILE 42 HB ILE 42 -3.909 6.453 -0.994
3 HG12 ILE 42 HG12 ILE 42 -2.822 3.665 -0.687
4 HG22 ILE 42 HG21 ILE 42 -2.699 5.015 1.391
5 HG21 ILE 42 HG22 ILE 42 -3.410 6.621 1.425
6 HG23 ILE 42 HG23 ILE 42 -1.940 6.332 0.494
7 HD11 ILE 42 HD11 ILE 42 -1.844 5.883 -2.408
8 HD13 ILE 42 HD12 ILE 42 -1.275 4.204 -2.400
9 HD12 ILE 42 HD13 ILE 42 -1.056 5.218 -0.974
10 H ILE 42 HN ILE 42 -5.538 4.594 -2.036
11 HG13 ILE 42 HG11 ILE 42 -3.640 4.273 -2.118
No H/Q in entry = 11
In of MODEL 9
1 HA ILE 43 HA ILE 43 -7.119 7.714 2.011
2 HB ILE 43 HB ILE 43 -8.105 7.352 4.310
3 HG12 ILE 43 HG12 ILE 43 -6.207 5.530 4.664
4 HG23 ILE 43 HG21 ILE 43 -9.434 6.946 2.341
5 HG22 ILE 43 HG22 ILE 43 -9.730 5.696 3.576
6 HG21 ILE 43 HG23 ILE 43 -8.723 5.326 2.188
7 HD11 ILE 43 HD11 ILE 43 -7.424 4.090 2.932
8 HD13 ILE 43 HD12 ILE 43 -8.380 3.640 4.378
9 HD12 ILE 43 HD13 ILE 43 -6.643 3.413 4.340
10 H ILE 43 HN ILE 43 -5.511 5.317 2.497
11 HG13 ILE 43 HG11 ILE 43 -7.721 5.417 5.532
No H/Q in entry = 11
In of MODEL 9
1 HA ASP 44 HA ASP 44 -3.803 9.168 4.617
2 HB2 ASP 44 HB2 ASP 44 -5.162 8.141 6.524
3 H ASP 44 HN ASP 44 -4.403 6.441 3.858
4 HB3 ASP 44 HB1 ASP 44 -3.849 7.011 6.727
No H/Q in entry = 4
In of MODEL 9
1 HA GLN 45 HA GLN 45 0.051 7.045 4.698
2 HB2 GLN 45 HB2 GLN 45 1.533 8.227 3.372
3 HG2 GLN 45 HG2 GLN 45 1.573 10.490 4.282
4 HE21 GLN 45 HE21 GLN 45 -0.052 11.148 5.621
5 HE22 GLN 45 HE22 GLN 45 -1.397 12.066 5.067
6 H GLN 45 HN GLN 45 -1.582 9.356 5.410
7 HB3 GLN 45 HB1 GLN 45 -0.074 8.475 2.693
8 HG3 GLN 45 HG1 GLN 45 1.335 10.492 2.539
No H/Q in entry = 8
In of MODEL 9
1 HA THR 46 HA THR 46 2.618 8.989 7.550
2 HB THR 46 HB THR 46 3.747 7.249 8.996
3 HG1 THR 46 HG1 THR 46 2.370 5.514 7.245
4 HG21 THR 46 HG21 THR 46 0.773 6.913 8.690
5 HG23 THR 46 HG22 THR 46 1.593 8.075 9.743
6 HG22 THR 46 HG23 THR 46 1.719 6.336 10.055
7 H THR 46 HN THR 46 1.859 6.811 5.802
No H/Q in entry = 7
In of MODEL 9
1 HA SER 47 HA SER 47 6.354 8.667 5.492
2 HB2 SER 47 HB2 SER 47 7.657 8.362 8.194
3 HG SER 47 HG SER 47 6.130 10.280 7.180
4 H SER 47 HN SER 47 5.194 8.340 8.064
5 HB3 SER 47 HB1 SER 47 8.436 8.962 6.728
No H/Q in entry = 5
In of MODEL 9
1 HA ASP 48 HA ASP 48 7.644 4.382 5.849
2 HB2 ASP 48 HB2 ASP 48 6.655 3.578 8.587
3 H ASP 48 HN ASP 48 5.780 5.926 7.532
4 HB3 ASP 48 HB1 ASP 48 7.802 2.710 7.577
No H/Q in entry = 4
In of MODEL 9
1 HA GLN 49 HA GLN 49 3.715 2.344 5.156
2 HB2 GLN 49 HB2 GLN 49 2.693 2.843 7.930
3 HG2 GLN 49 HG2 GLN 49 4.037 0.457 6.648
4 HE21 GLN 49 HE21 GLN 49 5.242 -0.034 9.233
5 HE22 GLN 49 HE22 GLN 49 4.066 -0.887 10.150
6 H GLN 49 HN GLN 49 4.313 4.683 6.795
7 HB3 GLN 49 HB1 GLN 49 1.902 1.732 6.826
8 HG3 GLN 49 HG1 GLN 49 4.757 1.569 7.800
No H/Q in entry = 8
In of MODEL 9
1 HA TYR 50 HA TYR 50 0.185 4.825 4.283
2 HB2 TYR 50 HB2 TYR 50 0.572 2.731 2.146
3 HD1 TYR 50 HD1 TYR 50 0.194 6.262 1.546
4 HD2 TYR 50 HD2 TYR 50 3.081 3.158 2.114
5 HE1 TYR 50 HE1 TYR 50 1.963 7.742 0.738
6 HE2 TYR 50 HE2 TYR 50 4.819 4.594 1.319
7 HH TYR 50 HH TYR 50 4.382 7.991 0.874
8 H TYR 50 HN TYR 50 1.514 2.209 4.456
9 HB3 TYR 50 HB1 TYR 50 -0.560 4.072 1.987
No H/Q in entry = 9
In of MODEL 9
1 HA LEU 51 HA LEU 51 -3.123 2.338 5.659
2 HB2 LEU 51 HB2 LEU 51 -3.387 4.570 6.912
3 HG LEU 51 HG LEU 51 -5.998 3.288 6.065
4 HD13 LEU 51 HD11 LEU 51 -4.566 1.674 7.042
5 HD12 LEU 51 HD12 LEU 51 -5.905 2.074 8.118
6 HD11 LEU 51 HD13 LEU 51 -4.284 2.721 8.435
7 HD23 LEU 51 HD21 LEU 51 -5.420 5.010 8.462
8 HD22 LEU 51 HD22 LEU 51 -6.968 4.246 8.005
9 HD21 LEU 51 HD23 LEU 51 -6.292 5.520 7.007
10 H LEU 51 HN LEU 51 -1.979 4.828 4.677
11 HB3 LEU 51 HB1 LEU 51 -4.371 5.076 5.561
No H/Q in entry = 11
In of MODEL 9
1 HA ILE 52 HA ILE 52 -5.221 2.394 1.846
2 HB ILE 52 HB ILE 52 -4.582 -0.541 2.152
3 HG12 ILE 52 HG12 ILE 52 -2.515 0.687 2.642
4 HG22 ILE 52 HG21 ILE 52 -4.784 1.257 -0.269
5 HG21 ILE 52 HG22 ILE 52 -6.024 0.136 0.286
6 HG23 ILE 52 HG23 ILE 52 -4.472 -0.476 -0.291
7 HD12 ILE 52 HD11 ILE 52 -1.443 2.143 1.082
8 HD11 ILE 52 HD12 ILE 52 -3.052 2.788 1.437
9 HD13 ILE 52 HD13 ILE 52 -2.754 1.888 -0.061
10 H ILE 52 HN ILE 52 -4.136 1.133 4.267
11 HG13 ILE 52 HG11 ILE 52 -2.400 -0.123 1.091
No H/Q in entry = 11
In of MODEL 9
1 HA ARG 53 HA ARG 53 -8.919 0.545 3.207
2 HB2 ARG 53 HB2 ARG 53 -9.567 2.921 3.148
3 HG2 ARG 53 HG2 ARG 53 -11.616 1.256 1.729
4 HD2 ARG 53 HD2 ARG 53 -11.744 3.801 3.320
5 HE ARG 53 HE ARG 53 -14.095 2.410 2.269
6 HH11 ARG 53 HH11 ARG 53 -12.347 3.813 5.071
7 HH12 ARG 53 HH12 ARG 53 -13.736 3.932 6.022
8 HH21 ARG 53 HH21 ARG 53 -16.004 2.615 3.630
9 HH22 ARG 53 HH22 ARG 53 -15.857 3.249 5.200
10 H ARG 53 HN ARG 53 -7.337 2.248 1.460
11 HB3 ARG 53 HB1 ARG 53 -9.769 2.863 1.421
12 HG3 ARG 53 HG1 ARG 53 -11.380 1.337 3.476
13 HD3 ARG 53 HD1 ARG 53 -12.154 3.533 1.620
No H/Q in entry = 13
In of MODEL 9
1 HA PHE 54 HA PHE 54 -9.038 -1.663 -0.474
2 HB2 PHE 54 HB2 PHE 54 -9.925 -3.538 1.699
3 HD1 PHE 54 HD1 PHE 54 -7.336 -3.896 -0.836
4 HD2 PHE 54 HD2 PHE 54 -8.099 -2.924 3.218
5 HE1 PHE 54 HE1 PHE 54 -4.963 -4.013 -0.382
6 HE2 PHE 54 HE2 PHE 54 -5.709 -3.030 3.710
7 HZ PHE 54 HZ PHE 54 -4.101 -3.585 1.880
8 H PHE 54 HN PHE 54 -9.438 -1.227 2.331
9 HB3 PHE 54 HB1 PHE 54 -9.547 -4.002 0.043
No H/Q in entry = 9
In of MODEL 9
1 HA ASP 55 HA ASP 55 -13.029 -1.655 -1.973
2 HB2 ASP 55 HB2 ASP 55 -12.074 -3.292 -3.586
3 H ASP 55 HN ASP 55 -10.762 -3.239 -1.479
4 HB3 ASP 55 HB1 ASP 55 -12.620 -4.601 -2.551
No H/Q in entry = 4
In of MODEL 9
1 HA ASP 56 HA ASP 56 -15.058 -4.680 1.057
2 HB2 ASP 56 HB2 ASP 56 -13.324 -6.477 0.874
3 H ASP 56 HN ASP 56 -12.337 -4.219 0.182
4 HB3 ASP 56 HB1 ASP 56 -12.413 -5.677 2.140
No H/Q in entry = 4
In of MODEL 9
1 HA GLN 57 HA GLN 57 -13.357 -0.253 2.629
2 HB2 GLN 57 HB2 GLN 57 -15.492 -1.696 4.185
3 HG2 GLN 57 HG2 GLN 57 -16.206 -1.532 1.912
4 HE21 GLN 57 HE21 GLN 57 -15.003 -0.880 0.238
5 HE22 GLN 57 HE22 GLN 57 -14.790 0.772 -0.203
6 H GLN 57 HN GLN 57 -13.233 -2.158 1.409
7 HB3 GLN 57 HB1 GLN 57 -15.155 0.025 4.261
8 HG3 GLN 57 HG1 GLN 57 -17.097 -0.358 2.869
No H/Q in entry = 8
In of MODEL 9
1 HA SER 58 HA SER 58 -11.543 -2.020 6.472
2 HB2 SER 58 HB2 SER 58 -10.119 -4.121 4.834
3 HG SER 58 HG SER 58 -11.806 -5.254 5.287
4 H SER 58 HN SER 58 -11.981 -2.904 3.784
5 HB3 SER 58 HB1 SER 58 -9.906 -3.864 6.566
No H/Q in entry = 5
In of MODEL 9
1 HA GLU 59 HA GLU 59 -7.969 0.145 5.240
2 HB2 GLU 59 HB2 GLU 59 -8.807 1.417 7.857
3 HG2 GLU 59 HG2 GLU 59 -9.624 1.986 5.018
4 H GLU 59 HN GLU 59 -9.729 -1.003 7.276
5 HB3 GLU 59 HB1 GLU 59 -7.782 2.109 6.589
6 HG3 GLU 59 HG1 GLU 59 -10.647 1.284 6.273
No H/Q in entry = 6
In of MODEL 9
1 HA GLN 60 HA GLN 60 -4.917 -1.294 8.005
2 HB2 GLN 60 HB2 GLN 60 -5.644 -3.274 6.689
3 HG2 GLN 60 HG2 GLN 60 -3.634 -4.603 6.696
4 HE21 GLN 60 HE21 GLN 60 -1.644 -3.821 8.653
5 HE22 GLN 60 HE22 GLN 60 -2.466 -3.800 10.175
6 H GLN 60 HN GLN 60 -5.970 -0.368 5.424
7 HB3 GLN 60 HB1 GLN 60 -4.587 -2.765 5.388
8 HG3 GLN 60 HG1 GLN 60 -2.639 -3.152 6.752
No H/Q in entry = 8
In of MODEL 9
1 HA TRP 61 HA TRP 61 -1.482 0.953 6.508
2 HB2 TRP 61 HB2 TRP 61 -0.744 -0.098 9.252
3 HD1 TRP 61 HD1 TRP 61 -2.597 1.021 10.673
4 HE1 TRP 61 HE1 TRP 61 -3.386 3.469 10.995
5 HE3 TRP 61 HE3 TRP 61 0.077 3.229 6.976
6 HZ2 TRP 61 HZ2 TRP 61 -2.945 5.966 9.801
7 HZ3 TRP 61 HZ3 TRP 61 -0.161 5.649 6.602
8 HH2 TRP 61 HH2 TRP 61 -1.618 6.990 7.973
9 H TRP 61 HN TRP 61 -2.714 -0.973 8.297
10 HB3 TRP 61 HB1 TRP 61 0.311 0.958 8.333
No H/Q in entry = 10
In of MODEL 9
1 HA CYS 62 HA CYS 62 0.966 -2.338 5.085
2 HB2 CYS 62 HB2 CYS 62 -0.050 -0.960 2.608
3 HG CYS 62 HG CYS 62 -2.329 -1.442 4.233
4 H CYS 62 HN CYS 62 -0.381 0.256 4.911
5 HB3 CYS 62 HB1 CYS 62 0.531 -2.586 2.755
No H/Q in entry = 5
In of MODEL 9
1 HA GLU 63 HA GLU 63 4.721 -0.274 4.162
2 HB2 GLU 63 HB2 GLU 63 5.020 -2.906 2.747
3 HG2 GLU 63 HG2 GLU 63 6.290 -2.228 5.312
4 H GLU 63 HN GLU 63 2.942 -2.482 4.007
5 HB3 GLU 63 HB1 GLU 63 6.308 -1.786 3.115
6 HG3 GLU 63 HG1 GLU 63 4.616 -2.787 5.299
No H/Q in entry = 6
In of MODEL 9
1 HA PRO 64 HA PRO 64 4.299 1.411 -0.019
2 HB2 PRO 64 HB2 PRO 64 7.185 1.838 -0.027
3 HG2 PRO 64 HG2 PRO 64 7.550 2.515 2.114
4 HD2 PRO 64 HD2 PRO 64 6.770 0.541 2.992
5 HB3 PRO 64 HB1 PRO 64 5.886 3.027 -0.030
6 HG3 PRO 64 HG1 PRO 64 5.970 3.288 2.235
7 HD3 PRO 64 HD1 PRO 64 5.398 1.502 3.527
No H/Q in entry = 7
In of MODEL 9
1 HA ASP 65 HA ASP 65 7.507 -1.981 -1.498
2 HB2 ASP 65 HB2 ASP 65 8.719 -2.546 0.449
3 H ASP 65 HN ASP 65 6.655 -0.891 0.941
4 HB3 ASP 65 HB1 ASP 65 7.273 -3.056 1.304
No H/Q in entry = 4
In of MODEL 9
1 HA LYS 66 HA LYS 66 3.843 -4.803 -1.244
2 HB2 LYS 66 HB2 LYS 66 2.437 -3.439 1.046
3 HG2 LYS 66 HG2 LYS 66 4.344 -4.681 1.764
4 HD2 LYS 66 HD2 LYS 66 3.039 -6.978 0.299
5 HE2 LYS 66 HE2 LYS 66 3.919 -7.667 2.414
6 HZ2 LYS 66 HZ1 LYS 66 5.617 -6.094 2.890
7 HZ1 LYS 66 HZ2 LYS 66 6.445 -6.412 1.461
8 HZ3 LYS 66 HZ3 LYS 66 6.406 -7.572 2.690
9 H LYS 66 HN LYS 66 4.536 -2.435 0.312
10 HB3 LYS 66 HB1 LYS 66 1.799 -4.836 0.185
11 HG3 LYS 66 HG1 LYS 66 2.822 -5.454 2.237
12 HD3 LYS 66 HD1 LYS 66 4.580 -6.224 -0.108
13 HE3 LYS 66 HE1 LYS 66 4.849 -8.325 1.066
No H/Q in entry = 13
In of MODEL 9
1 HA LEU 67 HA LEU 67 0.983 -1.591 -2.871
2 HB2 LEU 67 HB2 LEU 67 2.884 0.598 -2.110
3 HG LEU 67 HG LEU 67 0.937 -0.604 -0.521
4 HD12 LEU 67 HD11 LEU 67 1.130 1.474 0.793
5 HD11 LEU 67 HD12 LEU 67 2.149 2.166 -0.495
6 HD13 LEU 67 HD13 LEU 67 2.638 0.697 0.394
7 HD21 LEU 67 HD21 LEU 67 -0.671 0.358 -2.049
8 HD23 LEU 67 HD22 LEU 67 -0.066 1.966 -1.608
9 HD22 LEU 67 HD23 LEU 67 -0.797 0.913 -0.387
10 H LEU 67 HN LEU 67 3.557 -1.570 -1.510
11 HB3 LEU 67 HB1 LEU 67 1.410 0.832 -3.002
No H/Q in entry = 11
In of MODEL 9
1 HA ARG 68 HA ARG 68 3.244 -0.931 -6.592
2 HB2 ARG 68 HB2 ARG 68 1.012 -2.890 -7.189
3 HG2 ARG 68 HG2 ARG 68 2.462 -3.712 -5.365
4 HD2 ARG 68 HD2 ARG 68 4.547 -2.566 -6.080
5 HE ARG 68 HE ARG 68 4.203 -4.201 -8.396
6 HH11 ARG 68 HH11 ARG 68 6.566 -2.325 -6.517
7 HH12 ARG 68 HH12 ARG 68 7.745 -2.363 -7.746
8 HH21 ARG 68 HH21 ARG 68 5.859 -4.208 -10.076
9 HH22 ARG 68 HH22 ARG 68 7.337 -3.413 -9.784
10 H ARG 68 HN ARG 68 0.802 -1.344 -4.984
11 HB3 ARG 68 HB1 ARG 68 2.444 -2.617 -8.169
12 HG3 ARG 68 HG1 ARG 68 2.533 -4.691 -6.826
13 HD3 ARG 68 HD1 ARG 68 4.755 -4.295 -5.794
No H/Q in entry = 13
In of MODEL 9
1 HA LYS 69 HA LYS 69 0.472 1.972 -8.437
2 HB2 LYS 69 HB2 LYS 69 3.009 2.158 -10.099
3 HG2 LYS 69 HG2 LYS 69 2.997 4.563 -9.292
4 HD2 LYS 69 HD2 LYS 69 3.481 2.416 -7.243
5 HE2 LYS 69 HE2 LYS 69 3.627 4.675 -6.338
6 HZ2 LYS 69 HZ1 LYS 69 4.366 6.063 -8.163
7 HZ1 LYS 69 HZ2 LYS 69 5.740 5.124 -8.351
8 HZ3 LYS 69 HZ3 LYS 69 5.548 6.043 -6.978
9 H LYS 69 HN LYS 69 2.971 0.651 -8.112
10 HB3 LYS 69 HB1 LYS 69 1.579 3.120 -10.445
11 HG3 LYS 69 HG1 LYS 69 1.881 4.014 -8.054
12 HD3 LYS 69 HD1 LYS 69 4.623 2.838 -8.521
13 HE3 LYS 69 HE1 LYS 69 5.169 3.833 -6.313
No H/Q in entry = 13
In of MODEL 9
1 HA LEU 70 HA LEU 70 -1.299 -0.984 -11.062
2 HB2 LEU 70 HB2 LEU 70 -3.071 1.357 -11.712
3 HG LEU 70 HG LEU 70 -3.138 1.189 -9.295
4 HD13 LEU 70 HD11 LEU 70 -5.504 0.790 -9.060
5 HD12 LEU 70 HD12 LEU 70 -5.526 -0.087 -10.585
6 HD11 LEU 70 HD13 LEU 70 -5.195 1.653 -10.575
7 HD21 LEU 70 HD21 LEU 70 -2.380 -1.160 -9.112
8 HD23 LEU 70 HD22 LEU 70 -3.982 -1.668 -9.699
9 HD22 LEU 70 HD23 LEU 70 -3.831 -0.798 -8.186
10 H LEU 70 HN LEU 70 -1.104 1.675 -9.993
11 HB3 LEU 70 HB1 LEU 70 -3.447 -0.342 -11.868
No H/Q in entry = 11
In of MODEL 9
1 HA3 GLY 71 HA2 GLY 71 -0.562 1.002 -15.081
2 H GLY 71 HN GLY 71 -0.655 2.186 -12.382
3 HA2 GLY 71 HA1 GLY 71 -0.883 2.699 -14.746
No H/Q in entry = 3
In of MODEL 9
1 HA3 GLY 72 HA2 GLY 72 3.851 1.005 -13.183
2 H GLY 72 HN GLY 72 1.537 1.010 -13.007
3 HA2 GLY 72 HA1 GLY 72 3.697 1.794 -14.746
No H/Q in entry = 3
In of MODEL 9
1 HA3 GLY 73 HA2 GLY 73 4.032 5.439 -12.231
2 H GLY 73 HN GLY 73 2.663 4.091 -14.443
3 HA2 GLY 73 HA1 GLY 73 4.161 6.029 -13.887
No H/Q in entry = 3
In of MODEL 9
1 HA SER 74 HA SER 74 0.643 8.314 -12.300
2 HB2 SER 74 HB2 SER 74 -1.035 7.256 -10.729
3 HG SER 74 HG SER 74 0.336 6.246 -9.344
4 H SER 74 HN SER 74 2.822 6.830 -11.203
5 HB3 SER 74 HB1 SER 74 -0.523 6.166 -12.021
No H/Q in entry = 5
In of MODEL 9
1 HA SER 75 HA SER 75 4.118 10.125 -9.818
2 HB2 SER 75 HB2 SER 75 1.540 10.380 -8.211
3 HG SER 75 HG SER 75 1.334 12.334 -9.154
4 H SER 75 HN SER 75 2.962 9.033 -11.287
5 HB3 SER 75 HB1 SER 75 3.018 11.286 -7.905
No H/Q in entry = 5
In of MODEL 10
1 H1 GLY 7 HT1 GLY 7 4.223 15.720 -4.736
2 H2 GLY 7 HT3 GLY 7 4.699 16.297 -6.247
3 H3 GLY 7 HT2 GLY 7 3.115 15.725 -6.005
4 HA3 GLY 7 HA1 GLY 7 3.918 13.533 -5.629
5 HA2 GLY 7 HA2 GLY 7 4.460 14.140 -7.198
No H/Q in entry = 5
In of MODEL 10
1 HA ALA 8 HA ALA 8 7.626 11.202 -5.081
2 HB1 ALA 8 HB1 ALA 8 8.868 13.785 -6.060
3 HB3 ALA 8 HB2 ALA 8 8.524 12.374 -7.061
4 HB2 ALA 8 HB3 ALA 8 9.710 12.262 -5.761
5 H ALA 8 HN ALA 8 5.655 12.051 -5.718
No H/Q in entry = 5
In of MODEL 10
1 HA MET 9 HA MET 9 9.003 13.372 -1.489
2 HB2 MET 9 HB2 MET 9 8.599 11.986 0.409
3 HG2 MET 9 HG2 MET 9 8.724 9.562 -1.374
4 HE2 MET 9 HE1 MET 9 9.705 7.611 0.972
5 HE1 MET 9 HE2 MET 9 8.521 7.153 -0.248
6 HE3 MET 9 HE3 MET 9 8.171 6.887 1.460
7 H MET 9 HN MET 9 9.158 11.136 -3.363
8 HB3 MET 9 HB1 MET 9 7.381 11.551 -0.777
9 HG3 MET 9 HG1 MET 9 9.893 10.023 -0.154
No H/Q in entry = 9
In of MODEL 10
1 HA ALA 10 HA ALA 10 13.003 11.572 -0.703
2 HB2 ALA 10 HB1 ALA 10 14.432 13.523 -0.118
3 HB1 ALA 10 HB2 ALA 10 12.974 14.480 0.171
4 HB3 ALA 10 HB3 ALA 10 13.330 13.890 -1.446
5 H ALA 10 HN ALA 10 10.695 13.081 0.227
No H/Q in entry = 5
In of MODEL 10
1 HA PRO 11 HA PRO 11 13.053 10.390 3.592
2 HB2 PRO 11 HB2 PRO 11 15.794 10.307 4.024
3 HG2 PRO 11 HG2 PRO 11 16.512 11.103 1.977
4 HD2 PRO 11 HD2 PRO 11 15.084 11.309 0.173
5 HB3 PRO 11 HB1 PRO 11 14.861 8.997 3.296
6 HG3 PRO 11 HG1 PRO 11 16.343 9.388 1.562
7 HD3 PRO 11 HD1 PRO 11 14.336 9.726 0.461
No H/Q in entry = 7
In of MODEL 10
1 HA PRO 12 HA PRO 12 13.081 14.524 5.400
2 HB2 PRO 12 HB2 PRO 12 13.159 12.891 7.908
3 HG2 PRO 12 HG2 PRO 12 11.183 11.746 7.382
4 HD2 PRO 12 HD2 PRO 12 12.664 10.651 5.986
5 HB3 PRO 12 HB1 PRO 12 12.098 14.236 7.480
6 HG3 PRO 12 HG1 PRO 12 10.736 12.921 6.135
7 HD3 PRO 12 HD1 PRO 12 11.584 11.310 4.741
No H/Q in entry = 7
In of MODEL 10
1 HA VAL 13 HA VAL 13 17.231 13.898 7.202
2 HB VAL 13 HB VAL 13 16.791 11.303 8.748
3 HG12 VAL 13 HG11 VAL 13 18.980 13.367 8.994
4 HG11 VAL 13 HG12 VAL 13 19.150 11.743 8.327
5 HG13 VAL 13 HG13 VAL 13 18.774 11.958 10.037
6 HG23 VAL 13 HG21 VAL 13 16.665 14.155 9.730
7 HG22 VAL 13 HG22 VAL 13 16.545 12.715 10.739
8 HG21 VAL 13 HG23 VAL 13 15.297 13.060 9.544
9 H VAL 13 HN VAL 13 14.938 12.088 7.189
No H/Q in entry = 9
In of MODEL 10
1 HA ALA 14 HA ALA 14 18.469 11.216 4.050
2 HB2 ALA 14 HB1 ALA 14 19.374 13.364 3.279
3 HB3 ALA 14 HB2 ALA 14 20.442 12.019 2.871
4 HB1 ALA 14 HB3 ALA 14 20.835 13.081 4.223
5 H ALA 14 HN ALA 14 18.933 13.345 5.903
No H/Q in entry = 5
In of MODEL 10
1 HA ALA 15 HA ALA 15 21.125 8.285 5.621
2 HB2 ALA 15 HB1 ALA 15 20.824 7.550 7.945
3 HB3 ALA 15 HB2 ALA 15 19.277 8.387 8.028
4 HB1 ALA 15 HB3 ALA 15 20.766 9.309 7.859
5 H ALA 15 HN ALA 15 18.538 9.476 5.318
No H/Q in entry = 5
In of MODEL 10
1 HA PRO 16 HA PRO 16 17.571 4.896 5.555
2 HB2 PRO 16 HB2 PRO 16 15.086 5.912 4.965
3 HG2 PRO 16 HG2 PRO 16 15.672 8.163 5.153
4 HD2 PRO 16 HD2 PRO 16 17.475 8.872 6.491
5 HB3 PRO 16 HB1 PRO 16 15.616 5.549 6.612
6 HG3 PRO 16 HG1 PRO 16 15.064 7.819 6.788
7 HD3 PRO 16 HD1 PRO 16 17.240 7.541 7.641
No H/Q in entry = 7
In of MODEL 10
1 HA SER 17 HA SER 17 17.698 5.280 1.298
2 HB2 SER 17 HB2 SER 17 16.097 2.735 1.588
3 HG SER 17 HG SER 17 18.820 3.383 1.873
4 H SER 17 HN SER 17 16.438 4.107 3.596
5 HB3 SER 17 HB1 SER 17 17.121 3.200 0.223
No H/Q in entry = 5
In of MODEL 10
1 HA PRO 18 HA PRO 18 13.889 7.288 -0.109
2 HB2 PRO 18 HB2 PRO 18 15.190 7.065 -2.765
3 HG2 PRO 18 HG2 PRO 18 17.226 8.004 -2.176
4 HD2 PRO 18 HD2 PRO 18 17.413 5.901 -1.212
5 HB3 PRO 18 HB1 PRO 18 14.623 8.512 -1.926
6 HG3 PRO 18 HG1 PRO 18 16.566 8.725 -0.697
7 HD3 PRO 18 HD1 PRO 18 17.633 6.930 0.224
No H/Q in entry = 7
In of MODEL 10
1 HA ALA 19 HA ALA 19 12.150 4.129 -2.742
2 HB3 ALA 19 HB1 ALA 19 11.970 3.410 -0.410
3 HB2 ALA 19 HB2 ALA 19 10.464 3.093 -1.269
4 HB1 ALA 19 HB3 ALA 19 10.585 4.475 -0.180
5 H ALA 19 HN ALA 19 11.978 6.591 -1.345
No H/Q in entry = 5
In of MODEL 10
1 HA VAL 20 HA VAL 20 8.517 5.709 -4.489
2 HB VAL 20 HB VAL 20 6.568 4.176 -4.780
3 HG11 VAL 20 HG11 VAL 20 8.505 3.943 -6.238
4 HG13 VAL 20 HG12 VAL 20 7.774 2.371 -5.914
5 HG12 VAL 20 HG13 VAL 20 9.256 2.844 -5.083
6 HG21 VAL 20 HG21 VAL 20 6.561 3.180 -2.539
7 HG23 VAL 20 HG22 VAL 20 8.077 2.357 -2.902
8 HG22 VAL 20 HG23 VAL 20 6.617 1.939 -3.793
9 H VAL 20 HN VAL 20 9.606 3.672 -2.770
No H/Q in entry = 9
In of MODEL 10
1 HA THR 21 HA THR 21 5.519 6.811 -1.429
2 HB THR 21 HB THR 21 7.062 8.700 -1.905
3 HG1 THR 21 HG1 THR 21 5.359 9.080 -0.473
4 HG21 THR 21 HG21 THR 21 5.030 9.389 -4.003
5 HG23 THR 21 HG22 THR 21 6.699 8.891 -4.287
6 HG22 THR 21 HG23 THR 21 6.358 10.447 -3.504
7 H THR 21 HN THR 21 6.356 6.591 -4.198
No H/Q in entry = 7
In of MODEL 10
1 HA TYR 22 HA TYR 22 1.798 7.483 -3.739
2 HB2 TYR 22 HB2 TYR 22 1.275 5.835 -1.263
3 HD1 TYR 22 HD1 TYR 22 0.501 4.817 -4.656
4 HD2 TYR 22 HD2 TYR 22 3.377 4.591 -1.548
5 HE1 TYR 22 HE1 TYR 22 1.577 2.954 -5.796
6 HE2 TYR 22 HE2 TYR 22 4.469 2.720 -2.693
7 HH TYR 22 HH TYR 22 3.933 0.973 -4.431
8 H TYR 22 HN TYR 22 3.357 7.590 -1.272
9 HB3 TYR 22 HB1 TYR 22 0.159 6.010 -2.612
No H/Q in entry = 9
In of MODEL 10
1 HA ALA 23 HA ALA 23 -0.487 10.399 -1.363
2 HB3 ALA 23 HB1 ALA 23 -1.601 10.357 -4.148
3 HB1 ALA 23 HB2 ALA 23 -0.287 11.389 -3.553
4 HB2 ALA 23 HB3 ALA 23 -1.936 11.618 -2.961
5 H ALA 23 HN ALA 23 -0.296 8.421 -3.524
No H/Q in entry = 5
In of MODEL 10
1 HA LEU 24 HA LEU 24 -4.286 8.569 -0.260
2 HB2 LEU 24 HB2 LEU 24 -5.274 11.418 -0.001
3 HG LEU 24 HG LEU 24 -3.377 11.336 1.349
4 HD11 LEU 24 HD11 LEU 24 -5.819 10.894 3.012
5 HD13 LEU 24 HD12 LEU 24 -5.261 12.420 2.328
6 HD12 LEU 24 HD13 LEU 24 -4.315 11.616 3.582
7 HD23 LEU 24 HD21 LEU 24 -3.010 9.651 3.082
8 HD22 LEU 24 HD22 LEU 24 -2.963 8.980 1.453
9 HD21 LEU 24 HD23 LEU 24 -4.393 8.749 2.463
10 H LEU 24 HN LEU 24 -2.739 10.910 -0.721
11 HB3 LEU 24 HB1 LEU 24 -5.952 9.989 0.732
No H/Q in entry = 11
In of MODEL 10
1 HA GLN 25 HA GLN 25 -8.168 7.976 -2.443
2 HB2 GLN 25 HB2 GLN 25 -7.133 10.496 -3.735
3 HG2 GLN 25 HG2 GLN 25 -9.188 10.194 -1.563
4 HE21 GLN 25 HE21 GLN 25 -8.564 12.979 -0.991
5 HE22 GLN 25 HE22 GLN 25 -9.408 13.934 -2.144
6 H GLN 25 HN GLN 25 -6.483 8.207 -0.959
7 HB3 GLN 25 HB1 GLN 25 -8.717 9.781 -4.013
8 HG3 GLN 25 HG1 GLN 25 -7.654 11.027 -1.505
No H/Q in entry = 8
In of MODEL 10
1 HA GLU 26 HA GLU 26 -5.155 7.016 -5.913
2 HB2 GLU 26 HB2 GLU 26 -3.204 7.857 -4.618
3 HG2 GLU 26 HG2 GLU 26 -1.462 6.311 -5.309
4 H GLU 26 HN GLU 26 -5.156 7.491 -3.064
5 HB3 GLU 26 HB1 GLU 26 -3.185 6.352 -3.725
6 HG3 GLU 26 HG1 GLU 26 -2.706 5.179 -5.866
No H/Q in entry = 6
In of MODEL 10
1 HA ASP 27 HA ASP 27 -6.245 2.851 -4.983
2 HB2 ASP 27 HB2 ASP 27 -6.853 3.226 -7.926
3 H ASP 27 HN ASP 27 -5.704 5.079 -6.779
4 HB3 ASP 27 HB1 ASP 27 -7.117 1.719 -7.072
No H/Q in entry = 4
In of MODEL 10
1 HA VAL 28 HA VAL 28 -2.798 0.781 -6.701
2 HB VAL 28 HB VAL 28 -1.168 0.643 -4.651
3 HG13 VAL 28 HG11 VAL 28 -0.668 2.988 -4.767
4 HG12 VAL 28 HG12 VAL 28 -2.262 3.303 -5.466
5 HG11 VAL 28 HG13 VAL 28 -1.055 2.387 -6.391
6 HG22 VAL 28 HG21 VAL 28 -2.912 0.789 -2.938
7 HG21 VAL 28 HG22 VAL 28 -3.348 2.393 -3.525
8 HG23 VAL 28 HG23 VAL 28 -1.758 2.118 -2.822
9 H VAL 28 HN VAL 28 -4.940 1.243 -4.776
No H/Q in entry = 9
In of MODEL 10
1 HA PHE 29 HA PHE 29 -3.519 -3.161 -5.178
2 HB2 PHE 29 HB2 PHE 29 -1.183 -3.396 -7.026
3 HD1 PHE 29 HD1 PHE 29 -4.147 -5.430 -6.227
4 HD2 PHE 29 HD2 PHE 29 -2.157 -2.977 -9.041
5 HE1 PHE 29 HE1 PHE 29 -5.861 -5.992 -7.888
6 HE2 PHE 29 HE2 PHE 29 -3.877 -3.523 -10.734
7 HZ PHE 29 HZ PHE 29 -5.730 -5.037 -10.148
8 H PHE 29 HN PHE 29 -1.737 -1.242 -6.368
9 HB3 PHE 29 HB1 PHE 29 -1.671 -4.805 -6.104
No H/Q in entry = 9
In of MODEL 10
1 HA ILE 30 HA ILE 30 -0.435 -3.851 -2.031
2 HB ILE 30 HB ILE 30 -3.207 -4.099 -0.872
3 HG12 ILE 30 HG12 ILE 30 -2.608 -2.128 0.423
4 HG21 ILE 30 HG21 ILE 30 -0.655 -4.482 0.672
5 HG23 ILE 30 HG22 ILE 30 -1.948 -5.661 0.423
6 HG22 ILE 30 HG23 ILE 30 -2.240 -4.224 1.400
7 HD12 ILE 30 HD11 ILE 30 -2.489 -0.465 -1.294
8 HD11 ILE 30 HD12 ILE 30 -3.596 -1.775 -1.792
9 HD13 ILE 30 HD13 ILE 30 -1.943 -1.700 -2.422
10 H ILE 30 HN ILE 30 -3.000 -4.379 -3.383
11 HG13 ILE 30 HG11 ILE 30 -1.008 -2.112 -0.309
No H/Q in entry = 11
In of MODEL 10
1 HA LYS 31 HA LYS 31 -0.442 -8.170 -2.100
2 HB2 LYS 31 HB2 LYS 31 1.561 -7.812 -3.287
3 HG2 LYS 31 HG2 LYS 31 2.305 -9.345 -0.825
4 HD2 LYS 31 HD2 LYS 31 3.344 -9.594 -3.613
5 HE2 LYS 31 HE2 LYS 31 4.263 -10.696 -1.001
6 HZ1 LYS 31 HZ1 LYS 31 5.289 -11.035 -3.767
7 HZ3 LYS 31 HZ2 LYS 31 5.775 -11.975 -2.470
8 HZ2 LYS 31 HZ3 LYS 31 6.120 -10.316 -2.483
9 H LYS 31 HN LYS 31 0.698 -5.530 -1.782
10 HB3 LYS 31 HB1 LYS 31 2.373 -7.145 -1.884
11 HG3 LYS 31 HG1 LYS 31 1.482 -10.000 -2.240
12 HD3 LYS 31 HD1 LYS 31 4.180 -8.680 -2.342
13 HE3 LYS 31 HE1 LYS 31 3.442 -11.595 -2.268
No H/Q in entry = 13
In of MODEL 10
1 HA CYS 32 HA CYS 32 -0.104 -8.592 2.200
2 HB2 CYS 32 HB2 CYS 32 -2.539 -9.065 1.690
3 HG CYS 32 HG CYS 32 -2.472 -11.563 3.633
4 H CYS 32 HN CYS 32 -0.919 -9.419 -0.480
5 HB3 CYS 32 HB1 CYS 32 -2.061 -10.725 1.343
No H/Q in entry = 5
In of MODEL 10
1 HA ASN 33 HA ASN 33 2.757 -11.783 2.591
2 HB2 ASN 33 HB2 ASN 33 2.250 -11.348 5.036
3 HD21 ASN 33 HD21 ASN 33 2.491 -13.976 6.400
4 HD22 ASN 33 HD22 ASN 33 4.086 -14.529 6.043
5 H ASN 33 HN ASN 33 0.382 -10.648 3.663
6 HB3 ASN 33 HB1 ASN 33 1.252 -12.800 4.988
No H/Q in entry = 6
In of MODEL 10
1 HA ASP 34 HA ASP 34 -0.196 -15.468 1.958
2 HB2 ASP 34 HB2 ASP 34 -2.549 -15.352 1.107
3 H ASP 34 HN ASP 34 -0.494 -12.681 2.459
4 HB3 ASP 34 HB1 ASP 34 -2.361 -14.682 2.713
No H/Q in entry = 4
In of MODEL 10
1 HA3 GLY 35 HA2 GLY 35 1.706 -12.758 -1.814
2 H GLY 35 HN GLY 35 0.477 -12.733 0.114
3 HA2 GLY 35 HA1 GLY 35 1.262 -14.416 -2.117
No H/Q in entry = 3
In of MODEL 10
1 HA ARG 36 HA ARG 36 -2.031 -12.344 -4.309
2 HB2 ARG 36 HB2 ARG 36 -3.847 -12.175 -1.915
3 HG2 ARG 36 HG2 ARG 36 -5.207 -13.861 -3.138
4 HD2 ARG 36 HD2 ARG 36 -2.434 -14.857 -2.569
5 HE ARG 36 HE ARG 36 -4.721 -16.170 -3.222
6 HH11 ARG 36 HH11 ARG 36 -2.352 -16.265 -0.610
7 HH12 ARG 36 HH12 ARG 36 -2.818 -17.784 -0.008
8 HH21 ARG 36 HH21 ARG 36 -5.381 -18.267 -2.437
9 HH22 ARG 36 HH22 ARG 36 -4.590 -18.970 -1.095
10 H ARG 36 HN ARG 36 -1.510 -12.564 -1.440
11 HB3 ARG 36 HB1 ARG 36 -4.364 -11.688 -3.506
12 HG3 ARG 36 HG1 ARG 36 -3.871 -14.026 -4.265
13 HD3 ARG 36 HD1 ARG 36 -3.595 -14.448 -1.304
No H/Q in entry = 13
In of MODEL 10
1 HA PHE 37 HA PHE 37 -2.199 -8.056 -3.694
2 HB2 PHE 37 HB2 PHE 37 -2.326 -8.690 -6.589
3 HD1 PHE 37 HD1 PHE 37 -1.071 -5.864 -4.597
4 HD2 PHE 37 HD2 PHE 37 -0.071 -9.298 -6.879
5 HE1 PHE 37 HE1 PHE 37 1.205 -5.202 -4.471
6 HE2 PHE 37 HE2 PHE 37 2.310 -8.671 -6.761
7 HZ PHE 37 HZ PHE 37 2.981 -6.614 -5.562
8 H PHE 37 HN PHE 37 -2.963 -10.446 -5.161
9 HB3 PHE 37 HB1 PHE 37 -2.729 -7.051 -6.098
No H/Q in entry = 9
In of MODEL 10
1 HA TYR 38 HA TYR 38 -6.436 -7.152 -3.728
2 HB2 TYR 38 HB2 TYR 38 -5.190 -6.122 -1.165
3 HD1 TYR 38 HD1 TYR 38 -7.970 -8.447 -1.211
4 HD2 TYR 38 HD2 TYR 38 -3.740 -8.122 -0.996
5 HE1 TYR 38 HE1 TYR 38 -7.835 -10.759 -0.399
6 HE2 TYR 38 HE2 TYR 38 -3.592 -10.430 -0.185
7 HH TYR 38 HH TYR 38 -4.805 -12.135 0.745
8 H TYR 38 HN TYR 38 -3.621 -6.771 -2.996
9 HB3 TYR 38 HB1 TYR 38 -6.911 -6.302 -1.446
No H/Q in entry = 9
In of MODEL 10
1 HA LEU 39 HA LEU 39 -5.720 -3.006 -4.969
2 HB2 LEU 39 HB2 LEU 39 -6.699 -3.935 -6.985
3 HG LEU 39 HG LEU 39 -8.321 -1.434 -6.456
4 HD13 LEU 39 HD11 LEU 39 -5.992 -0.995 -5.931
5 HD12 LEU 39 HD12 LEU 39 -6.439 -0.236 -7.463
6 HD11 LEU 39 HD13 LEU 39 -5.509 -1.740 -7.454
7 HD23 LEU 39 HD21 LEU 39 -7.195 -2.619 -8.970
8 HD22 LEU 39 HD22 LEU 39 -8.154 -1.155 -8.845
9 HD21 LEU 39 HD23 LEU 39 -8.894 -2.724 -8.483
10 H LEU 39 HN LEU 39 -7.299 -5.421 -4.736
11 HB3 LEU 39 HB1 LEU 39 -8.298 -3.860 -6.285
No H/Q in entry = 11
In of MODEL 10
1 HA3 GLY 40 HA2 GLY 40 -8.597 -0.802 -2.533
2 H GLY 40 HN GLY 40 -5.961 -1.314 -3.706
3 HA2 GLY 40 HA1 GLY 40 -7.190 -0.918 -1.484
No H/Q in entry = 3
In of MODEL 10
1 HA THR 41 HA THR 41 -7.126 3.320 -2.999
2 HB THR 41 HB THR 41 -9.635 3.684 -1.334
3 HG1 THR 41 HG1 THR 41 -9.363 2.987 -4.107
4 HG21 THR 41 HG21 THR 41 -8.414 5.748 -1.848
5 HG23 THR 41 HG22 THR 41 -9.947 5.693 -2.718
6 HG22 THR 41 HG23 THR 41 -8.441 5.345 -3.564
7 H THR 41 HN THR 41 -8.580 1.321 -1.392
No H/Q in entry = 7
In of MODEL 10
1 HA ILE 42 HA ILE 42 -5.083 4.104 0.866
2 HB ILE 42 HB ILE 42 -4.113 6.440 -0.804
3 HG12 ILE 42 HG12 ILE 42 -2.995 3.645 -0.557
4 HG22 ILE 42 HG21 ILE 42 -2.902 5.006 1.583
5 HG21 ILE 42 HG22 ILE 42 -3.638 6.602 1.616
6 HG23 ILE 42 HG23 ILE 42 -2.155 6.336 0.696
7 HD13 ILE 42 HD11 ILE 42 -1.385 4.282 -2.214
8 HD12 ILE 42 HD12 ILE 42 -1.201 5.146 -0.690
9 HD11 ILE 42 HD13 ILE 42 -1.925 5.963 -2.080
10 H ILE 42 HN ILE 42 -5.697 4.595 -1.896
11 HG13 ILE 42 HG11 ILE 42 -3.750 4.329 -1.991
No H/Q in entry = 11
In of MODEL 10
1 HA ILE 43 HA ILE 43 -7.447 7.516 2.298
2 HB ILE 43 HB ILE 43 -8.375 6.989 4.590
3 HG12 ILE 43 HG12 ILE 43 -6.412 5.157 4.760
4 HG23 ILE 43 HG21 ILE 43 -9.743 6.665 2.641
5 HG22 ILE 43 HG22 ILE 43 -9.972 5.344 3.812
6 HG21 ILE 43 HG23 ILE 43 -8.998 5.073 2.378
7 HD12 ILE 43 HD11 ILE 43 -7.154 2.944 4.666
8 HD11 ILE 43 HD12 ILE 43 -7.551 3.680 3.106
9 HD13 ILE 43 HD13 ILE 43 -8.786 3.501 4.364
10 H ILE 43 HN ILE 43 -5.772 5.115 2.650
11 HG13 ILE 43 HG11 ILE 43 -7.849 5.045 5.732
No H/Q in entry = 11
In of MODEL 10
1 HA ASP 44 HA ASP 44 -4.170 8.943 4.875
2 HB2 ASP 44 HB2 ASP 44 -5.488 7.745 6.788
3 H ASP 44 HN ASP 44 -4.737 6.225 4.083
4 HB3 ASP 44 HB1 ASP 44 -4.062 6.757 6.954
No H/Q in entry = 4
In of MODEL 10
1 HA GLN 45 HA GLN 45 -0.365 6.792 4.721
2 HB2 GLN 45 HB2 GLN 45 1.087 8.073 3.242
3 HG2 GLN 45 HG2 GLN 45 0.123 10.219 2.217
4 HE21 GLN 45 HE21 GLN 45 2.380 10.378 2.197
5 HE22 GLN 45 HE22 GLN 45 3.248 11.104 3.489
6 H GLN 45 HN GLN 45 -1.894 9.150 5.412
7 HB3 GLN 45 HB1 GLN 45 -0.564 8.050 2.662
8 HG3 GLN 45 HG1 GLN 45 -0.733 10.387 3.744
No H/Q in entry = 8
In of MODEL 10
1 HA THR 46 HA THR 46 2.501 9.052 7.215
2 HB THR 46 HB THR 46 3.658 7.257 8.636
3 HG1 THR 46 HG1 THR 46 2.180 5.661 6.886
4 HG23 THR 46 HG21 THR 46 1.665 6.598 9.900
5 HG22 THR 46 HG22 THR 46 0.636 7.032 8.549
6 HG21 THR 46 HG23 THR 46 1.536 8.287 9.404
7 H THR 46 HN THR 46 1.914 7.032 5.271
No H/Q in entry = 7
In of MODEL 10
1 HA SER 47 HA SER 47 6.346 8.787 5.235
2 HB2 SER 47 HB2 SER 47 8.381 8.650 6.725
3 HG SER 47 HG SER 47 7.455 7.425 8.388
4 H SER 47 HN SER 47 5.079 8.461 7.737
5 HB3 SER 47 HB1 SER 47 7.229 9.958 7.084
No H/Q in entry = 5
In of MODEL 10
1 HA ASP 48 HA ASP 48 7.465 4.432 5.540
2 HB2 ASP 48 HB2 ASP 48 6.533 3.856 8.337
3 H ASP 48 HN ASP 48 5.409 6.019 6.946
4 HB3 ASP 48 HB1 ASP 48 7.775 3.015 7.422
No H/Q in entry = 4
In of MODEL 10
1 HA GLN 49 HA GLN 49 3.588 2.186 5.235
2 HB2 GLN 49 HB2 GLN 49 2.273 3.118 7.782
3 HG2 GLN 49 HG2 GLN 49 3.016 0.757 8.514
4 HE21 GLN 49 HE21 GLN 49 3.210 3.695 9.119
5 HE22 GLN 49 HE22 GLN 49 4.697 3.895 9.935
6 H GLN 49 HN GLN 49 4.143 4.733 6.551
7 HB3 GLN 49 HB1 GLN 49 1.798 1.726 6.834
8 HG3 GLN 49 HG1 GLN 49 4.194 0.914 7.231
No H/Q in entry = 8
In of MODEL 10
1 HA TYR 50 HA TYR 50 -0.022 4.619 4.237
2 HB2 TYR 50 HB2 TYR 50 0.444 2.524 2.109
3 HD1 TYR 50 HD1 TYR 50 0.090 6.116 1.758
4 HD2 TYR 50 HD2 TYR 50 2.926 2.919 1.859
5 HE1 TYR 50 HE1 TYR 50 1.849 7.628 0.988
6 HE2 TYR 50 HE2 TYR 50 4.649 4.390 1.102
7 HH TYR 50 HH TYR 50 4.379 7.714 1.146
8 H TYR 50 HN TYR 50 1.332 2.040 4.533
9 HB3 TYR 50 HB1 TYR 50 -0.692 3.858 1.928
No H/Q in entry = 9
In of MODEL 10
1 HA LEU 51 HA LEU 51 -3.235 2.062 5.673
2 HB2 LEU 51 HB2 LEU 51 -3.449 4.271 6.940
3 HG LEU 51 HG LEU 51 -6.088 3.005 6.213
4 HD11 LEU 51 HD11 LEU 51 -4.225 2.471 8.491
5 HD13 LEU 51 HD12 LEU 51 -4.599 1.386 7.150
6 HD12 LEU 51 HD13 LEU 51 -5.850 1.807 8.323
7 HD23 LEU 51 HD21 LEU 51 -5.350 4.795 8.518
8 HD22 LEU 51 HD22 LEU 51 -6.904 3.985 8.269
9 HD21 LEU 51 HD23 LEU 51 -6.375 5.224 7.139
10 H LEU 51 HN LEU 51 -2.151 4.565 4.688
11 HB3 LEU 51 HB1 LEU 51 -4.499 4.801 5.647
No H/Q in entry = 11
In of MODEL 10
1 HA ILE 52 HA ILE 52 -5.414 2.204 1.878
2 HB ILE 52 HB ILE 52 -4.744 -0.733 2.083
3 HG12 ILE 52 HG12 ILE 52 -2.698 0.546 2.597
4 HG21 ILE 52 HG21 ILE 52 -6.211 -0.010 0.240
5 HG23 ILE 52 HG22 ILE 52 -4.653 -0.591 -0.353
6 HG22 ILE 52 HG23 ILE 52 -4.973 1.133 -0.288
7 HD13 ILE 52 HD11 ILE 52 -2.996 1.788 -0.089
8 HD12 ILE 52 HD12 ILE 52 -1.666 2.037 1.062
9 HD11 ILE 52 HD13 ILE 52 -3.283 2.635 1.426
10 H ILE 52 HN ILE 52 -4.287 0.872 4.248
11 HG13 ILE 52 HG11 ILE 52 -2.569 -0.251 1.040
No H/Q in entry = 11
In of MODEL 10
1 HA ARG 53 HA ARG 53 -9.118 0.291 3.157
2 HB2 ARG 53 HB2 ARG 53 -9.829 2.615 3.135
3 HG2 ARG 53 HG2 ARG 53 -11.795 1.024 1.528
4 HD2 ARG 53 HD2 ARG 53 -13.432 2.442 2.737
5 HE ARG 53 HE ARG 53 -12.319 3.134 0.489
6 HH11 ARG 53 HH11 ARG 53 -12.768 5.136 3.377
7 HH12 ARG 53 HH12 ARG 53 -12.994 6.604 2.562
8 HH21 ARG 53 HH21 ARG 53 -12.621 5.160 -0.697
9 HH22 ARG 53 HH22 ARG 53 -12.904 6.616 0.121
10 H ARG 53 HN ARG 53 -7.525 1.984 1.421
11 HB3 ARG 53 HB1 ARG 53 -9.948 2.635 1.391
12 HG3 ARG 53 HG1 ARG 53 -11.616 0.966 3.279
13 HD3 ARG 53 HD1 ARG 53 -12.072 3.374 3.365
No H/Q in entry = 13
In of MODEL 10
1 HA PHE 54 HA PHE 54 -9.374 -1.974 -0.538
2 HB2 PHE 54 HB2 PHE 54 -10.003 -3.886 1.704
3 HD1 PHE 54 HD1 PHE 54 -8.202 -3.217 3.177
4 HD2 PHE 54 HD2 PHE 54 -7.473 -4.027 -0.922
5 HE1 PHE 54 HE1 PHE 54 -5.801 -3.191 3.612
6 HE2 PHE 54 HE2 PHE 54 -5.077 -4.026 -0.516
7 HZ PHE 54 HZ PHE 54 -4.201 -3.602 1.747
8 H PHE 54 HN PHE 54 -9.688 -1.504 2.305
9 HB3 PHE 54 HB1 PHE 54 -9.652 -4.327 0.035
No H/Q in entry = 9
In of MODEL 10
1 HA ASP 55 HA ASP 55 -13.477 -2.242 -1.720
2 HB2 ASP 55 HB2 ASP 55 -12.512 -3.769 -3.436
3 H ASP 55 HN ASP 55 -11.094 -3.724 -1.345
4 HB3 ASP 55 HB1 ASP 55 -12.918 -5.140 -2.419
No H/Q in entry = 4
In of MODEL 10
1 HA ASP 56 HA ASP 56 -15.146 -5.287 1.498
2 HB2 ASP 56 HB2 ASP 56 -13.428 -7.012 1.553
3 H ASP 56 HN ASP 56 -12.502 -4.642 0.476
4 HB3 ASP 56 HB1 ASP 56 -12.335 -5.957 2.425
No H/Q in entry = 4
In of MODEL 10
1 HA GLN 57 HA GLN 57 -13.645 -0.629 2.698
2 HB2 GLN 57 HB2 GLN 57 -15.663 -2.019 4.440
3 HG2 GLN 57 HG2 GLN 57 -16.377 -2.080 2.137
4 HE21 GLN 57 HE21 GLN 57 -15.440 1.213 3.025
5 HE22 GLN 57 HE22 GLN 57 -15.548 1.825 1.418
6 H GLN 57 HN GLN 57 -13.480 -2.572 1.600
7 HB3 GLN 57 HB1 GLN 57 -15.430 -0.278 4.352
8 HG3 GLN 57 HG1 GLN 57 -17.395 -1.021 3.097
No H/Q in entry = 8
In of MODEL 10
1 HA SER 58 HA SER 58 -11.682 -2.261 6.564
2 HB2 SER 58 HB2 SER 58 -10.406 -4.429 4.893
3 HG SER 58 HG SER 58 -12.237 -5.421 5.472
4 H SER 58 HN SER 58 -12.146 -3.133 3.871
5 HB3 SER 58 HB1 SER 58 -10.063 -4.149 6.602
No H/Q in entry = 5
In of MODEL 10
1 HA GLU 59 HA GLU 59 -8.049 -0.131 5.367
2 HB2 GLU 59 HB2 GLU 59 -8.540 0.672 8.242
3 HG2 GLU 59 HG2 GLU 59 -9.727 1.855 5.744
4 H GLU 59 HN GLU 59 -9.735 -1.457 7.372
5 HB3 GLU 59 HB1 GLU 59 -7.645 1.579 7.035
6 HG3 GLU 59 HG1 GLU 59 -10.597 1.015 7.025
No H/Q in entry = 6
In of MODEL 10
1 HA GLN 60 HA GLN 60 -4.775 -1.765 7.962
2 HB2 GLN 60 HB2 GLN 60 -5.378 -3.704 6.612
3 HG2 GLN 60 HG2 GLN 60 -3.254 -4.780 6.102
4 HE21 GLN 60 HE21 GLN 60 -1.082 -3.816 7.865
5 HE22 GLN 60 HE22 GLN 60 -1.645 -4.127 9.468
6 H GLN 60 HN GLN 60 -5.878 -0.533 5.542
7 HB3 GLN 60 HB1 GLN 60 -4.624 -2.987 5.197
8 HG3 GLN 60 HG1 GLN 60 -2.427 -3.229 6.224
No H/Q in entry = 8
In of MODEL 10
1 HA TRP 61 HA TRP 61 -1.474 0.740 6.486
2 HB2 TRP 61 HB2 TRP 61 -0.621 -0.308 9.201
3 HD1 TRP 61 HD1 TRP 61 -2.452 0.763 10.703
4 HE1 TRP 61 HE1 TRP 61 -3.294 3.171 11.062
5 HE3 TRP 61 HE3 TRP 61 0.006 3.088 6.887
6 HZ2 TRP 61 HZ2 TRP 61 -2.965 5.693 9.862
7 HZ3 TRP 61 HZ3 TRP 61 -0.360 5.509 6.569
8 HH2 TRP 61 HH2 TRP 61 -1.772 6.751 8.008
9 H TRP 61 HN TRP 61 -2.604 -1.244 8.289
10 HB3 TRP 61 HB1 TRP 61 0.377 0.779 8.257
No H/Q in entry = 10
In of MODEL 10
1 HA CYS 62 HA CYS 62 0.978 -2.518 5.011
2 HB2 CYS 62 HB2 CYS 62 -0.078 -1.093 2.573
3 HG CYS 62 HG CYS 62 -2.312 -1.533 4.192
4 H CYS 62 HN CYS 62 -0.412 0.060 4.869
5 HB3 CYS 62 HB1 CYS 62 0.496 -2.751 2.694
No H/Q in entry = 5
In of MODEL 10
1 HA GLU 63 HA GLU 63 4.661 -0.319 4.107
2 HB2 GLU 63 HB2 GLU 63 5.069 -2.992 2.813
3 HG2 GLU 63 HG2 GLU 63 6.406 -2.016 5.257
4 H GLU 63 HN GLU 63 2.995 -2.612 3.943
5 HB3 GLU 63 HB1 GLU 63 6.300 -1.771 2.996
6 HG3 GLU 63 HG1 GLU 63 4.841 -2.822 5.344
No H/Q in entry = 6
In of MODEL 10
1 HA PRO 64 HA PRO 64 4.295 1.238 -0.106
2 HB2 PRO 64 HB2 PRO 64 7.176 1.697 -0.093
3 HG2 PRO 64 HG2 PRO 64 7.503 2.447 2.033
4 HD2 PRO 64 HD2 PRO 64 6.741 0.503 2.991
5 HB3 PRO 64 HB1 PRO 64 5.866 2.867 -0.150
6 HG3 PRO 64 HG1 PRO 64 5.906 3.194 2.105
7 HD3 PRO 64 HD1 PRO 64 5.343 1.449 3.443
No H/Q in entry = 7
In of MODEL 10
1 HA ASP 65 HA ASP 65 7.457 -2.232 -1.492
2 HB2 ASP 65 HB2 ASP 65 8.588 -2.881 0.470
3 H ASP 65 HN ASP 65 6.576 -1.102 0.913
4 HB3 ASP 65 HB1 ASP 65 7.098 -3.310 1.288
No H/Q in entry = 4
In of MODEL 10
1 HA LYS 66 HA LYS 66 3.724 -4.931 -1.339
2 HB2 LYS 66 HB2 LYS 66 2.315 -3.520 0.909
3 HG2 LYS 66 HG2 LYS 66 4.198 -4.694 1.763
4 HD2 LYS 66 HD2 LYS 66 3.142 -7.037 0.184
5 HE2 LYS 66 HE2 LYS 66 3.753 -7.716 2.402
6 HZ1 LYS 66 HZ1 LYS 66 6.393 -6.475 1.795
7 HZ3 LYS 66 HZ2 LYS 66 6.141 -7.599 3.028
8 HZ2 LYS 66 HZ3 LYS 66 5.391 -6.120 3.130
9 H LYS 66 HN LYS 66 4.466 -2.614 0.242
10 HB3 LYS 66 HB1 LYS 66 1.697 -4.947 0.095
11 HG3 LYS 66 HG1 LYS 66 2.715 -5.566 2.167
12 HD3 LYS 66 HD1 LYS 66 4.699 -6.230 -0.005
13 HE3 LYS 66 HE1 LYS 66 4.869 -8.354 1.194
No H/Q in entry = 13
In of MODEL 10
1 HA LEU 67 HA LEU 67 0.924 -1.571 -2.942
2 HB2 LEU 67 HB2 LEU 67 2.830 0.570 -2.095
3 HG LEU 67 HG LEU 67 0.888 -0.713 -0.550
4 HD11 LEU 67 HD11 LEU 67 2.085 2.047 -0.407
5 HD13 LEU 67 HD12 LEU 67 2.653 0.540 0.383
6 HD12 LEU 67 HD13 LEU 67 1.139 1.273 0.867
7 HD22 LEU 67 HD21 LEU 67 -0.807 0.867 -0.294
8 HD21 LEU 67 HD22 LEU 67 -0.730 0.363 -1.990
9 HD23 LEU 67 HD23 LEU 67 -0.079 1.932 -1.491
10 H LEU 67 HN LEU 67 3.465 -1.631 -1.501
11 HB3 LEU 67 HB1 LEU 67 1.345 0.830 -2.960
No H/Q in entry = 11
In of MODEL 10
1 HA ARG 68 HA ARG 68 3.151 -0.707 -6.615
2 HB2 ARG 68 HB2 ARG 68 1.099 -2.810 -7.328
3 HG2 ARG 68 HG2 ARG 68 2.474 -3.666 -5.539
4 HD2 ARG 68 HD2 ARG 68 4.886 -3.444 -7.332
5 HE ARG 68 HE ARG 68 4.751 -3.759 -4.415
6 HH11 ARG 68 HH11 ARG 68 6.107 -4.788 -7.534
7 HH12 ARG 68 HH12 ARG 68 7.082 -5.985 -6.845
8 HH21 ARG 68 HH21 ARG 68 6.177 -5.366 -3.491
9 HH22 ARG 68 HH22 ARG 68 7.131 -6.345 -4.488
10 H ARG 68 HN ARG 68 0.775 -1.418 -5.018
11 HB3 ARG 68 HB1 ARG 68 2.519 -2.410 -8.274
12 HG3 ARG 68 HG1 ARG 68 2.804 -4.500 -7.049
13 HD3 ARG 68 HD1 ARG 68 4.505 -2.177 -6.169
No H/Q in entry = 13
In of MODEL 10
1 HA LYS 69 HA LYS 69 0.261 2.104 -8.223
2 HB2 LYS 69 HB2 LYS 69 2.572 2.204 -10.153
3 HG2 LYS 69 HG2 LYS 69 2.812 4.564 -9.307
4 HD2 LYS 69 HD2 LYS 69 3.301 2.503 -7.182
5 HE2 LYS 69 HE2 LYS 69 3.916 4.776 -6.633
6 HZ2 LYS 69 HZ1 LYS 69 4.315 5.697 -8.821
7 HZ1 LYS 69 HZ2 LYS 69 5.577 4.629 -9.079
8 HZ3 LYS 69 HZ3 LYS 69 5.746 5.828 -7.936
9 H LYS 69 HN LYS 69 2.722 0.673 -8.280
10 HB3 LYS 69 HB1 LYS 69 1.183 3.239 -10.329
11 HG3 LYS 69 HG1 LYS 69 1.763 4.079 -7.987
12 HD3 LYS 69 HD1 LYS 69 4.281 2.560 -8.645
13 HE3 LYS 69 HE1 LYS 69 5.341 3.748 -6.813
No H/Q in entry = 13
In of MODEL 10
1 HA LEU 70 HA LEU 70 -1.647 -0.295 -11.306
2 HB2 LEU 70 HB2 LEU 70 -3.378 2.171 -11.538
3 HG LEU 70 HG LEU 70 -3.540 1.626 -9.218
4 HD11 LEU 70 HD11 LEU 70 -5.838 0.453 -10.730
5 HD13 LEU 70 HD12 LEU 70 -5.630 2.161 -10.278
6 HD12 LEU 70 HD13 LEU 70 -5.832 0.912 -9.035
7 HD21 LEU 70 HD21 LEU 70 -2.607 -0.627 -9.287
8 HD23 LEU 70 HD22 LEU 70 -4.113 -1.207 -10.033
9 HD22 LEU 70 HD23 LEU 70 -4.132 -0.539 -8.408
10 H LEU 70 HN LEU 70 -1.338 2.186 -9.856
11 HB3 LEU 70 HB1 LEU 70 -3.794 0.544 -12.015
No H/Q in entry = 11
In of MODEL 10
1 HA3 GLY 71 HA2 GLY 71 -0.540 2.456 -14.796
2 H GLY 71 HN GLY 71 -0.758 3.002 -11.927
3 HA2 GLY 71 HA1 GLY 71 -0.595 4.048 -14.054
No H/Q in entry = 3
In of MODEL 10
1 HA3 GLY 72 HA2 GLY 72 3.692 3.890 -14.710
2 H GLY 72 HN GLY 72 1.238 5.076 -13.883
3 HA2 GLY 72 HA1 GLY 72 3.477 5.529 -14.113
No H/Q in entry = 3
In of MODEL 10
1 HA3 GLY 73 HA2 GLY 73 6.104 2.527 -11.510
2 H GLY 73 HN GLY 73 4.255 2.320 -13.329
3 HA2 GLY 73 HA1 GLY 73 4.724 3.025 -10.533
No H/Q in entry = 3
In of MODEL 10
1 HA SER 74 HA SER 74 3.783 -1.352 -11.122
2 HB2 SER 74 HB2 SER 74 2.599 -1.034 -13.343
3 HG SER 74 HG SER 74 2.464 -3.027 -12.351
4 H SER 74 HN SER 74 4.614 0.617 -13.051
5 HB3 SER 74 HB1 SER 74 4.079 -1.557 -14.143
No H/Q in entry = 5
In of MODEL 10
1 HA SER 75 HA SER 75 7.710 -3.208 -11.630
2 HB2 SER 75 HB2 SER 75 7.818 -1.656 -9.024
3 HG SER 75 HG SER 75 7.822 -0.892 -11.515
4 H SER 75 HN SER 75 5.417 -2.360 -10.114
5 HB3 SER 75 HB1 SER 75 9.201 -2.432 -9.800
No H/Q in entry = 5