Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
589344 | 2myl RC | 25456 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ASN 1 H ASN 1 1.808 0.001 0.855
2 HA ASN 1 HA ASN 1 3.104 -0.299 -1.009
3 HB2 ASN 1 2HB ASN 1 1.066 -1.829 -1.684
4 HB3 ASN 1 3HB ASN 1 0.722 -0.515 -2.806
5 HD21 ASN 1 1HD2 ASN 1 2.722 0.229 -4.051
6 HD22 ASN 1 2HD2 ASN 1 3.710 -1.028 -4.704
7 H SER 2 H SER 2 3.862 1.790 -0.966
8 HA SER 2 HA SER 2 2.331 3.938 -2.155
9 HB2 SER 2 2HB SER 2 4.679 3.702 -0.444
10 HB3 SER 2 3HB SER 2 4.906 4.894 -1.724
11 HG SER 2 HG SER 2 3.214 4.934 0.457
12 H GLY 3 H GLY 3 5.013 1.854 -3.005
13 HA2 GLY 3 2HA GLY 3 5.745 1.352 -5.162
14 HA3 GLY 3 3HA GLY 3 4.770 2.680 -5.776
15 H LEU 4 H LEU 4 6.924 3.234 -3.120
16 HA LEU 4 HA LEU 4 8.284 5.313 -4.448
17 HB2 LEU 4 2HB LEU 4 8.146 4.254 -1.835
18 HB3 LEU 4 3HB LEU 4 9.850 4.284 -2.287
19 HG LEU 4 HG LEU 4 8.106 6.713 -2.570
20 HD11 LEU 4 1HD1 LEU 4 9.360 7.304 -0.335
21 HD12 LEU 4 2HD1 LEU 4 9.326 5.555 -0.117
22 HD13 LEU 4 3HD1 LEU 4 7.819 6.447 -0.319
23 HD21 LEU 4 3HD2 LEU 4 10.954 6.896 -1.871
24 HD22 LEU 4 1HD2 LEU 4 10.009 7.812 -3.045
25 HD23 LEU 4 2HD2 LEU 4 10.614 6.208 -3.459
26 H SER 5 H SER 5 9.083 1.928 -3.889
27 HA SER 5 HA SER 5 11.675 2.241 -5.179
28 HB2 SER 5 2HB SER 5 10.309 -0.099 -3.845
29 HB3 SER 5 3HB SER 5 11.849 -0.249 -4.691
30 HG SER 5 HG SER 5 12.716 0.411 -2.905
31 H PHE 6 H PHE 6 8.635 2.013 -6.268
32 HA PHE 6 HA PHE 6 9.398 0.372 -8.594
33 HB2 PHE 6 2HB PHE 6 7.346 -0.190 -6.940
34 HB3 PHE 6 3HB PHE 6 6.523 0.878 -8.072
35 HD1 PHE 6 HD2 PHE 6 6.268 0.255 -10.411
36 HD2 PHE 6 HD1 PHE 6 8.126 -2.357 -7.611
37 HE1 PHE 6 HE2 PHE 6 6.017 -1.613 -11.992
38 HE2 PHE 6 HE1 PHE 6 7.879 -4.230 -9.188
39 HZ PHE 6 HZ PHE 6 6.822 -3.859 -11.381
40 H GLU 7 H GLU 7 8.957 3.466 -7.591
41 HA GLU 7 HA GLU 7 7.885 4.373 -10.175
42 HB2 GLU 7 2HB GLU 7 6.830 5.104 -7.948
43 HB3 GLU 7 3HB GLU 7 8.263 6.101 -7.739
44 HG2 GLU 7 2HG GLU 7 7.253 6.571 -10.343
45 HG3 GLU 7 3HG GLU 7 5.905 6.661 -9.210
46 HNA MK8 8 H MK8 8 10.705 4.542 -7.993
47 HB MK8 8 2HB MK8 8 12.659 5.380 -7.050
48 HBA MK8 8 3HB MK8 8 14.048 5.812 -8.037
49 HD MK8 8 2HD MK8 8 13.878 9.185 -6.601
50 HDA MK8 8 3HD MK8 8 14.749 7.640 -6.531
51 HE MK8 8 HE MK8 8 14.592 8.108 -9.458
52 HG MK8 8 2HG MK8 8 12.283 8.080 -8.273
53 HGA MK8 8 3HG MK8 8 12.118 7.573 -6.594
54 HB1 MK8 8 HBA MK8 8 11.953 6.774 -11.068
55 HB1A MK8 8 HGA MK8 8 11.298 7.531 -9.951
56 HB1B MK8 8 HDA MK8 8 12.789 7.567 -10.109
57 H LEU 9 H LEU 9 11.336 3.400 -9.426
58 HA LEU 9 HA LEU 9 13.718 2.220 -10.593
59 HB2 LEU 9 2HB LEU 9 12.434 1.058 -8.833
60 HB3 LEU 9 3HB LEU 9 11.059 0.963 -9.931
61 HG LEU 9 HG LEU 9 12.329 -0.494 -11.416
62 HD11 LEU 9 1HD1 LEU 9 14.541 0.412 -9.768
63 HD12 LEU 9 2HD1 LEU 9 14.548 -0.311 -11.376
64 HD13 LEU 9 3HD1 LEU 9 14.502 -1.343 -9.947
65 HD21 LEU 9 3HD2 LEU 9 12.092 -1.256 -8.526
66 HD22 LEU 9 1HD2 LEU 9 12.670 -2.405 -9.733
67 HD23 LEU 9 2HD2 LEU 9 11.058 -1.704 -9.883
68 H TYR 10 H TYR 10 11.086 3.853 -11.755
69 HA TYR 10 HA TYR 10 11.300 2.510 -14.367
70 HB2 TYR 10 2HB TYR 10 9.090 2.178 -13.109
71 HB3 TYR 10 3HB TYR 10 8.793 3.886 -13.415
72 HD1 TYR 10 HD2 TYR 10 9.451 0.645 -15.105
73 HD2 TYR 10 HD1 TYR 10 7.923 4.598 -15.476
74 HE1 TYR 10 HE2 TYR 10 8.552 0.083 -17.325
75 HE2 TYR 10 HE1 TYR 10 7.018 4.047 -17.696
76 HH TYR 10 HH TYR 10 7.467 2.407 -19.511
77 H ARG 11 H ARG 11 11.479 5.390 -12.562
78 HA ARG 11 HA ARG 11 11.412 7.038 -14.995
79 HB2 ARG 11 2HB ARG 11 10.196 7.463 -12.577
80 HB3 ARG 11 3HB ARG 11 11.666 8.414 -12.413
81 HG2 ARG 11 2HG ARG 11 10.010 9.866 -13.258
82 HG3 ARG 11 3HG ARG 11 11.085 9.494 -14.607
83 HD2 ARG 11 2HD ARG 11 9.489 8.364 -15.739
84 HD3 ARG 11 3HD ARG 11 8.778 7.692 -14.273
85 HE ARG 11 HE ARG 11 7.329 9.472 -14.191
86 HH11 ARG 11 1HH1 ARG 11 9.862 10.135 -16.487
87 HH12 ARG 11 2HH1 ARG 11 9.096 11.556 -17.117
88 HH21 ARG 11 1HH2 ARG 11 6.312 11.340 -15.013
89 HH22 ARG 11 2HH2 ARG 11 7.078 12.241 -16.278
90 HNA MK8 12 H MK8 12 13.450 6.113 -12.182
91 HB MK8 12 2HB MK8 12 15.180 6.568 -10.577
92 HBA MK8 12 3HB MK8 12 16.106 5.312 -11.388
93 HD MK8 12 2HD MK8 12 16.885 6.999 -8.781
94 HDA MK8 12 3HD MK8 12 18.240 8.057 -9.222
95 HE MK8 12 HE MK8 12 16.802 9.840 -9.164
96 HG MK8 12 2HG MK8 12 18.097 6.386 -10.901
97 HGA MK8 12 3HG MK8 12 17.547 7.871 -11.672
98 HB1 MK8 12 HBA MK8 12 15.943 8.968 -12.119
99 HB1A MK8 12 HGA MK8 12 16.596 8.644 -13.430
100 HB1B MK8 12 HDA MK8 12 15.140 9.001 -13.385
101 H ALA 13 H ALA 13 14.433 4.926 -13.716
102 HA ALA 13 HA ALA 13 16.671 3.917 -15.175
103 HB1 ALA 13 3HB ALA 13 13.779 3.134 -15.012
104 HB2 ALA 13 1HB ALA 13 14.894 2.347 -16.130
105 HB3 ALA 13 2HB ALA 13 15.193 2.281 -14.393
106 H TYR 14 H TYR 14 13.467 5.002 -16.320
107 HA TYR 14 HA TYR 14 14.027 5.086 -19.018
108 HB2 TYR 14 2HB TYR 14 11.947 6.019 -17.299
109 HB3 TYR 14 3HB TYR 14 12.339 7.304 -18.437
110 HD1 TYR 14 HD2 TYR 14 12.109 3.576 -18.693
111 HD2 TYR 14 HD1 TYR 14 10.854 7.355 -20.194
112 HE1 TYR 14 HE2 TYR 14 10.781 2.441 -20.425
113 HE2 TYR 14 HE1 TYR 14 9.522 6.230 -21.929
114 HH TYR 14 HH TYR 14 9.904 3.100 -22.799
115 H THR 15 H THR 15 14.977 7.300 -16.518
116 HA THR 15 HA THR 15 15.723 9.427 -18.306
117 HB THR 15 HB THR 15 16.323 8.980 -15.378
118 HG1 THR 15 HG1 THR 15 14.480 10.637 -16.783
119 HG21 THR 15 1HG2 THR 15 17.996 10.450 -15.745
120 HG22 THR 15 2HG2 THR 15 16.692 11.637 -15.792
121 HG23 THR 15 3HG2 THR 15 17.335 10.972 -17.293
122 H MET 16 H MET 16 17.308 6.707 -16.768
123 HA MET 16 HA MET 16 19.962 7.571 -17.469
124 HB2 MET 16 2HB MET 16 19.212 6.011 -15.521
125 HB3 MET 16 3HB MET 16 19.253 4.747 -16.743
126 HG2 MET 16 2HG MET 16 21.415 4.518 -16.366
127 HG3 MET 16 3HG MET 16 21.664 6.140 -17.007
128 HE1 MET 16 3HE MET 16 21.840 8.284 -15.602
129 HE2 MET 16 1HE MET 16 22.832 8.151 -14.149
130 HE3 MET 16 2HE MET 16 23.384 7.431 -15.661
131 H VAL 17 H VAL 17 17.413 6.038 -19.095
132 HA VAL 17 HA VAL 17 19.047 4.513 -20.923
133 HB VAL 17 HB VAL 17 16.143 5.219 -21.302
134 HG11 VAL 17 1HG1 VAL 17 18.059 3.310 -22.499
135 HG12 VAL 17 2HG1 VAL 17 16.413 2.729 -22.238
136 HG13 VAL 17 3HG1 VAL 17 16.698 4.161 -23.228
137 HG21 VAL 17 3HG2 VAL 17 17.369 3.571 -19.246
138 HG22 VAL 17 1HG2 VAL 17 15.709 4.148 -19.393
139 HG23 VAL 17 2HG2 VAL 17 16.209 2.677 -20.227
140 H LEU 18 H LEU 18 17.242 7.554 -20.977
141 HA LEU 18 HA LEU 18 17.637 8.136 -23.708
142 HB2 LEU 18 2HB LEU 18 17.368 10.196 -21.539
143 HB3 LEU 18 3HB LEU 18 16.857 10.308 -23.222
144 HG LEU 18 HG LEU 18 15.545 8.182 -21.673
145 HD11 LEU 18 1HD1 LEU 18 15.874 10.249 -20.120
146 HD12 LEU 18 2HD1 LEU 18 14.295 9.473 -20.236
147 HD13 LEU 18 3HD1 LEU 18 14.612 10.963 -21.124
148 HD21 LEU 18 3HD2 LEU 18 13.670 8.811 -22.940
149 HD22 LEU 18 1HD2 LEU 18 15.041 8.990 -24.034
150 HD23 LEU 18 2HD2 LEU 18 14.327 10.413 -23.276
151 H HIS 19 H HIS 19 19.562 8.756 -20.835
152 HA HIS 19 HA HIS 19 21.484 10.365 -22.287
153 HB2 HIS 19 2HB HIS 19 21.004 10.924 -19.962
154 HB3 HIS 19 3HB HIS 19 21.505 9.315 -19.449
155 HD1 HIS 19 HD1 HIS 19 23.375 11.577 -21.842
156 HD2 HIS 19 HD2 HIS 19 23.755 9.950 -18.039
157 HE1 HIS 19 HE1 HIS 19 25.700 12.169 -21.087
158 H LYS 20 H LYS 20 21.325 7.142 -20.831
159 HA LYS 20 HA LYS 20 22.710 5.331 -20.969
160 HB2 LYS 20 2HB LYS 20 21.746 5.767 -23.374
161 HB3 LYS 20 3HB LYS 20 23.415 6.172 -23.754
162 HG2 LYS 20 2HG LYS 20 23.537 3.981 -24.237
163 HG3 LYS 20 3HG LYS 20 23.797 3.833 -22.498
164 HD2 LYS 20 2HD LYS 20 21.136 3.589 -23.902
165 HD3 LYS 20 3HD LYS 20 22.114 2.241 -23.318
166 HE2 LYS 20 2HE LYS 20 21.012 4.448 -21.583
167 HE3 LYS 20 3HE LYS 20 20.268 2.863 -21.783
168 HZ1 LYS 20 3HZ LYS 20 22.971 2.519 -21.107
169 HZ2 LYS 20 1HZ LYS 20 21.599 2.067 -20.225
170 HZ3 LYS 20 2HZ LYS 20 22.282 3.599 -20.002
Start of MODEL 2
1 H1 ASN 1 H ASN 1 1.846 -0.883 -0.444
2 HA ASN 1 HA ASN 1 1.736 -0.309 -2.853
3 HB2 ASN 1 2HB ASN 1 -0.570 0.847 -2.757
4 HB3 ASN 1 3HB ASN 1 -0.413 -0.745 -2.019
5 HD21 ASN 1 1HD2 ASN 1 -2.117 -0.445 -0.624
6 HD22 ASN 1 2HD2 ASN 1 -2.044 0.635 0.723
7 H SER 2 H SER 2 3.561 1.598 -1.536
8 HA SER 2 HA SER 2 2.673 4.217 -2.383
9 HB2 SER 2 2HB SER 2 4.820 3.134 -0.736
10 HB3 SER 2 3HB SER 2 5.389 4.404 -1.820
11 HG SER 2 HG SER 2 4.666 5.413 0.004
12 H GLY 3 H GLY 3 4.929 1.736 -3.472
13 HA2 GLY 3 2HA GLY 3 5.758 1.365 -5.598
14 HA3 GLY 3 3HA GLY 3 4.837 2.753 -6.157
15 H LEU 4 H LEU 4 7.033 3.045 -3.477
16 HA LEU 4 HA LEU 4 8.461 5.159 -4.684
17 HB2 LEU 4 2HB LEU 4 8.819 3.517 -2.215
18 HB3 LEU 4 3HB LEU 4 10.101 4.613 -2.728
19 HG LEU 4 HG LEU 4 7.266 5.419 -2.077
20 HD11 LEU 4 1HD1 LEU 4 9.005 4.640 -0.241
21 HD12 LEU 4 2HD1 LEU 4 7.936 6.019 0.013
22 HD13 LEU 4 3HD1 LEU 4 9.611 6.280 -0.475
23 HD21 LEU 4 3HD2 LEU 4 8.322 7.717 -2.104
24 HD22 LEU 4 1HD2 LEU 4 8.107 6.943 -3.674
25 HD23 LEU 4 2HD2 LEU 4 9.700 6.974 -2.917
26 H SER 5 H SER 5 9.130 1.719 -4.328
27 HA SER 5 HA SER 5 11.728 2.005 -5.611
28 HB2 SER 5 2HB SER 5 10.272 -0.353 -4.411
29 HB3 SER 5 3HB SER 5 11.801 -0.517 -5.275
30 HG SER 5 HG SER 5 12.105 -0.287 -3.017
31 H PHE 6 H PHE 6 8.679 1.964 -6.698
32 HA PHE 6 HA PHE 6 9.371 0.439 -9.123
33 HB2 PHE 6 2HB PHE 6 6.679 0.885 -7.825
34 HB3 PHE 6 3HB PHE 6 6.878 0.214 -9.440
35 HD1 PHE 6 HD1 PHE 6 8.996 -1.659 -9.267
36 HD2 PHE 6 HD2 PHE 6 6.023 -0.749 -6.360
37 HE1 PHE 6 HE1 PHE 6 9.255 -3.908 -8.303
38 HE2 PHE 6 HE2 PHE 6 6.278 -2.996 -5.391
39 HZ PHE 6 HZ PHE 6 7.895 -4.579 -6.362
40 H GLU 7 H GLU 7 9.065 3.479 -7.936
41 HA GLU 7 HA GLU 7 8.018 4.582 -10.453
42 HB2 GLU 7 2HB GLU 7 6.978 5.221 -8.203
43 HB3 GLU 7 3HB GLU 7 8.457 6.122 -7.902
44 HG2 GLU 7 2HG GLU 7 8.023 7.368 -10.030
45 HG3 GLU 7 3HG GLU 7 6.448 6.579 -10.089
46 HNA MK8 8 H MK8 8 10.846 4.509 -8.277
47 HB MK8 8 2HB MK8 8 12.831 5.219 -7.291
48 HBA MK8 8 3HB MK8 8 14.234 5.658 -8.254
49 HD MK8 8 2HD MK8 8 14.184 8.945 -6.621
50 HDA MK8 8 3HD MK8 8 14.998 7.368 -6.638
51 HE MK8 8 HE MK8 8 14.863 8.009 -9.535
52 HG MK8 8 2HG MK8 8 12.552 7.998 -8.350
53 HGA MK8 8 3HG MK8 8 12.368 7.399 -6.704
54 HB1 MK8 8 HBA MK8 8 12.174 6.872 -11.218
55 HB1A MK8 8 HGA MK8 8 11.548 7.586 -10.057
56 HB1B MK8 8 HDA MK8 8 13.040 7.576 -10.215
57 H LEU 9 H LEU 9 11.431 3.435 -9.777
58 HA LEU 9 HA LEU 9 13.766 2.236 -11.016
59 HB2 LEU 9 2HB LEU 9 12.438 1.022 -9.324
60 HB3 LEU 9 3HB LEU 9 11.062 1.043 -10.424
61 HG LEU 9 HG LEU 9 12.282 -0.371 -11.995
62 HD11 LEU 9 1HD1 LEU 9 14.501 -0.354 -11.949
63 HD12 LEU 9 2HD1 LEU 9 14.417 -1.354 -10.499
64 HD13 LEU 9 3HD1 LEU 9 14.524 0.400 -10.355
65 HD21 LEU 9 3HD2 LEU 9 12.665 -1.831 -9.452
66 HD22 LEU 9 1HD2 LEU 9 11.786 -2.294 -10.909
67 HD23 LEU 9 2HD2 LEU 9 11.056 -1.174 -9.758
68 H TYR 10 H TYR 10 11.197 4.032 -12.073
69 HA TYR 10 HA TYR 10 11.358 2.837 -14.761
70 HB2 TYR 10 2HB TYR 10 9.034 3.270 -13.115
71 HB3 TYR 10 3HB TYR 10 8.917 4.235 -14.581
72 HD1 TYR 10 HD2 TYR 10 9.495 2.933 -16.806
73 HD2 TYR 10 HD1 TYR 10 8.293 1.081 -13.169
74 HE1 TYR 10 HE2 TYR 10 8.778 0.944 -18.063
75 HE2 TYR 10 HE1 TYR 10 7.574 -0.914 -14.415
76 HH TYR 10 HH TYR 10 7.115 -0.960 -17.703
77 H ARG 11 H ARG 11 11.649 5.598 -12.791
78 HA ARG 11 HA ARG 11 11.647 7.387 -15.124
79 HB2 ARG 11 2HB ARG 11 10.683 7.680 -12.456
80 HB3 ARG 11 3HB ARG 11 11.990 8.832 -12.694
81 HG2 ARG 11 2HG ARG 11 9.916 9.887 -13.245
82 HG3 ARG 11 3HG ARG 11 10.839 9.647 -14.729
83 HD2 ARG 11 2HD ARG 11 9.466 7.890 -15.435
84 HD3 ARG 11 3HD ARG 11 8.798 7.647 -13.822
85 HE ARG 11 HE ARG 11 8.062 10.195 -14.567
86 HH11 ARG 11 1HH1 ARG 11 7.583 6.964 -15.773
87 HH12 ARG 11 2HH1 ARG 11 6.043 7.318 -16.483
88 HH21 ARG 11 1HH2 ARG 11 6.035 10.672 -15.498
89 HH22 ARG 11 2HH2 ARG 11 5.164 9.427 -16.327
90 HNA MK8 12 H MK8 12 13.646 6.224 -12.371
91 HB MK8 12 2HB MK8 12 15.387 6.515 -10.748
92 HBA MK8 12 3HB MK8 12 16.279 5.282 -11.628
93 HD MK8 12 2HD MK8 12 17.139 6.798 -8.917
94 HDA MK8 12 3HD MK8 12 18.470 7.900 -9.324
95 HE MK8 12 HE MK8 12 17.019 9.656 -9.194
96 HG MK8 12 2HG MK8 12 18.297 6.264 -11.063
97 HGA MK8 12 3HG MK8 12 17.801 7.802 -11.765
98 HB1 MK8 12 HBA MK8 12 16.237 8.977 -12.156
99 HB1A MK8 12 HGA MK8 12 16.896 8.695 -13.473
100 HB1B MK8 12 HDA MK8 12 15.454 9.104 -13.429
101 H ALA 13 H ALA 13 14.585 5.084 -13.964
102 HA ALA 13 HA ALA 13 16.782 4.067 -15.478
103 HB1 ALA 13 3HB ALA 13 14.640 2.832 -16.570
104 HB2 ALA 13 1HB ALA 13 15.425 2.318 -15.076
105 HB3 ALA 13 2HB ALA 13 13.975 3.321 -15.011
106 H TYR 14 H TYR 14 13.627 5.347 -16.559
107 HA TYR 14 HA TYR 14 14.196 5.553 -19.250
108 HB2 TYR 14 2HB TYR 14 12.153 6.478 -17.482
109 HB3 TYR 14 3HB TYR 14 12.597 7.801 -18.554
110 HD1 TYR 14 HD1 TYR 14 11.872 4.135 -18.748
111 HD2 TYR 14 HD2 TYR 14 11.465 7.966 -20.555
112 HE1 TYR 14 HE1 TYR 14 10.499 3.142 -20.531
113 HE2 TYR 14 HE2 TYR 14 10.091 6.983 -22.342
114 HH TYR 14 HH TYR 14 9.655 3.518 -22.630
115 H THR 15 H THR 15 15.243 7.575 -16.634
116 HA THR 15 HA THR 15 16.074 9.769 -18.303
117 HB THR 15 HB THR 15 16.647 9.139 -15.403
118 HG1 THR 15 HG1 THR 15 15.215 11.063 -15.228
119 HG21 THR 15 1HG2 THR 15 18.469 10.469 -16.058
120 HG22 THR 15 2HG2 THR 15 17.311 11.614 -15.380
121 HG23 THR 15 3HG2 THR 15 17.475 11.456 -17.129
122 H MET 16 H MET 16 17.541 6.904 -16.919
123 HA MET 16 HA MET 16 20.231 7.694 -17.566
124 HB2 MET 16 2HB MET 16 19.352 6.025 -15.731
125 HB3 MET 16 3HB MET 16 19.460 4.853 -17.038
126 HG2 MET 16 2HG MET 16 21.770 5.081 -17.217
127 HG3 MET 16 3HG MET 16 21.778 6.611 -16.343
128 HE1 MET 16 3HE MET 16 23.877 5.615 -14.691
129 HE2 MET 16 1HE MET 16 22.667 6.817 -14.242
130 HE3 MET 16 2HE MET 16 23.085 5.525 -13.117
131 H VAL 17 H VAL 17 17.625 6.358 -19.278
132 HA VAL 17 HA VAL 17 19.203 4.878 -21.190
133 HB VAL 17 HB VAL 17 16.332 5.719 -21.536
134 HG11 VAL 17 1HG1 VAL 17 18.026 4.433 -23.239
135 HG12 VAL 17 2HG1 VAL 17 17.237 3.080 -22.427
136 HG13 VAL 17 3HG1 VAL 17 16.269 4.293 -23.265
137 HG21 VAL 17 3HG2 VAL 17 17.479 3.918 -19.563
138 HG22 VAL 17 1HG2 VAL 17 15.845 4.571 -19.685
139 HG23 VAL 17 2HG2 VAL 17 16.287 3.125 -20.593
140 H LEU 18 H LEU 18 17.509 7.981 -21.077
141 HA LEU 18 HA LEU 18 17.925 8.707 -23.765
142 HB2 LEU 18 2HB LEU 18 17.765 10.642 -21.472
143 HB3 LEU 18 3HB LEU 18 17.261 10.888 -23.143
144 HG LEU 18 HG LEU 18 15.844 8.737 -21.722
145 HD11 LEU 18 1HD1 LEU 18 15.041 11.523 -21.020
146 HD12 LEU 18 2HD1 LEU 18 16.268 10.699 -20.058
147 HD13 LEU 18 3HD1 LEU 18 14.655 10.003 -20.214
148 HD21 LEU 18 3HD2 LEU 18 15.386 9.694 -24.035
149 HD22 LEU 18 1HD2 LEU 18 14.741 11.108 -23.201
150 HD23 LEU 18 2HD2 LEU 18 14.004 9.525 -22.952
151 H HIS 19 H HIS 19 19.896 9.074 -20.880
152 HA HIS 19 HA HIS 19 21.883 10.667 -22.260
153 HB2 HIS 19 2HB HIS 19 21.490 11.161 -19.927
154 HB3 HIS 19 3HB HIS 19 21.812 9.490 -19.476
155 HD1 HIS 19 HD1 HIS 19 23.889 11.816 -21.652
156 HD2 HIS 19 HD2 HIS 19 24.151 9.646 -18.119
157 HE1 HIS 19 HE1 HIS 19 26.265 12.084 -20.873
158 H LYS 20 H LYS 20 21.530 7.368 -21.049
159 HA LYS 20 HA LYS 20 22.822 5.499 -21.293
160 HB2 LYS 20 2HB LYS 20 21.913 6.127 -23.660
161 HB3 LYS 20 3HB LYS 20 23.591 6.528 -24.003
162 HG2 LYS 20 2HG LYS 20 23.675 4.379 -24.655
163 HG3 LYS 20 3HG LYS 20 23.919 4.089 -22.931
164 HD2 LYS 20 2HD LYS 20 21.278 3.989 -24.390
165 HD3 LYS 20 3HD LYS 20 22.216 2.595 -23.850
166 HE2 LYS 20 2HE LYS 20 21.992 3.397 -21.522
167 HE3 LYS 20 3HE LYS 20 20.977 4.717 -22.100
168 HZ1 LYS 20 3HZ LYS 20 20.380 1.815 -22.265
169 HZ2 LYS 20 1HZ LYS 20 19.442 3.019 -22.994
170 HZ3 LYS 20 2HZ LYS 20 19.586 2.963 -21.310
Start of MODEL 3
1 H1 ASN 1 H ASN 1 -0.093 -0.087 -0.311
2 HA ASN 1 HA ASN 1 2.462 0.034 -1.312
3 HB2 ASN 1 2HB ASN 1 0.616 -1.481 -2.096
4 HB3 ASN 1 3HB ASN 1 -0.026 -0.128 -3.022
5 HD21 ASN 1 1HD2 ASN 1 0.459 -0.279 -5.076
6 HD22 ASN 1 2HD2 ASN 1 1.941 -0.872 -5.738
7 H SER 2 H SER 2 3.430 2.023 -1.327
8 HA SER 2 HA SER 2 2.167 4.276 -2.631
9 HB2 SER 2 2HB SER 2 4.421 3.858 -0.831
10 HB3 SER 2 3HB SER 2 4.811 4.979 -2.135
11 HG SER 2 HG SER 2 3.421 5.474 0.044
12 H GLY 3 H GLY 3 5.116 2.338 -3.139
13 HA2 GLY 3 2HA GLY 3 5.797 1.563 -5.285
14 HA3 GLY 3 3HA GLY 3 4.867 2.863 -6.016
15 H LEU 4 H LEU 4 7.019 3.388 -3.312
16 HA LEU 4 HA LEU 4 8.406 5.465 -4.625
17 HB2 LEU 4 2HB LEU 4 8.759 3.973 -2.068
18 HB3 LEU 4 3HB LEU 4 10.057 5.022 -2.635
19 HG LEU 4 HG LEU 4 7.421 6.298 -2.605
20 HD11 LEU 4 1HD1 LEU 4 6.902 5.181 -0.652
21 HD12 LEU 4 2HD1 LEU 4 7.716 6.624 -0.048
22 HD13 LEU 4 3HD1 LEU 4 8.584 5.091 -0.131
23 HD21 LEU 4 3HD2 LEU 4 9.641 7.379 -1.028
24 HD22 LEU 4 1HD2 LEU 4 8.663 8.137 -2.284
25 HD23 LEU 4 2HD2 LEU 4 10.019 7.101 -2.728
26 H SER 5 H SER 5 9.148 2.063 -4.090
27 HA SER 5 HA SER 5 11.742 2.338 -5.382
28 HB2 SER 5 2HB SER 5 10.335 0.014 -4.063
29 HB3 SER 5 3HB SER 5 11.870 -0.160 -4.914
30 HG SER 5 HG SER 5 12.670 1.508 -3.463
31 H PHE 6 H PHE 6 8.698 2.175 -6.470
32 HA PHE 6 HA PHE 6 9.429 0.540 -8.811
33 HB2 PHE 6 2HB PHE 6 7.055 0.536 -7.137
34 HB3 PHE 6 3HB PHE 6 6.652 0.808 -8.829
35 HD1 PHE 6 HD2 PHE 6 7.845 -0.822 -10.518
36 HD2 PHE 6 HD1 PHE 6 7.238 -1.623 -6.382
37 HE1 PHE 6 HE2 PHE 6 8.060 -3.233 -10.957
38 HE2 PHE 6 HE1 PHE 6 7.453 -4.036 -6.815
39 HZ PHE 6 HZ PHE 6 7.863 -4.844 -9.105
40 H GLU 7 H GLU 7 9.054 3.631 -7.784
41 HA GLU 7 HA GLU 7 7.992 4.579 -10.358
42 HB2 GLU 7 2HB GLU 7 6.934 5.311 -8.143
43 HB3 GLU 7 3HB GLU 7 8.391 6.263 -7.894
44 HG2 GLU 7 2HG GLU 7 7.953 7.557 -9.863
45 HG3 GLU 7 3HG GLU 7 6.589 6.525 -10.288
46 HNA MK8 8 H MK8 8 10.814 4.680 -8.175
47 HB MK8 8 2HB MK8 8 12.779 5.484 -7.223
48 HBA MK8 8 3HB MK8 8 14.176 5.901 -8.206
49 HD MK8 8 2HD MK8 8 14.055 9.264 -6.744
50 HDA MK8 8 3HD MK8 8 14.903 7.706 -6.688
51 HE MK8 8 HE MK8 8 14.757 8.202 -9.610
52 HG MK8 8 2HG MK8 8 12.446 8.197 -8.429
53 HGA MK8 8 3HG MK8 8 12.270 7.682 -6.753
54 HB1 MK8 8 HBA MK8 8 12.099 6.914 -11.233
55 HB1A MK8 8 HGA MK8 8 11.456 7.675 -10.112
56 HB1B MK8 8 HDA MK8 8 12.948 7.687 -10.268
57 H LEU 9 H LEU 9 11.426 3.542 -9.617
58 HA LEU 9 HA LEU 9 13.791 2.331 -10.786
59 HB2 LEU 9 2HB LEU 9 12.483 1.179 -9.035
60 HB3 LEU 9 3HB LEU 9 11.110 1.111 -10.139
61 HG LEU 9 HG LEU 9 12.368 -0.355 -11.629
62 HD11 LEU 9 1HD1 LEU 9 14.606 0.362 -11.319
63 HD12 LEU 9 2HD1 LEU 9 14.528 -1.313 -10.772
64 HD13 LEU 9 3HD1 LEU 9 14.555 -0.001 -9.594
65 HD21 LEU 9 3HD2 LEU 9 12.374 -1.285 -8.760
66 HD22 LEU 9 1HD2 LEU 9 12.450 -2.327 -10.181
67 HD23 LEU 9 2HD2 LEU 9 11.009 -1.357 -9.874
68 H TYR 10 H TYR 10 11.187 4.013 -11.941
69 HA TYR 10 HA TYR 10 11.382 2.683 -14.562
70 HB2 TYR 10 2HB TYR 10 9.099 2.802 -13.010
71 HB3 TYR 10 3HB TYR 10 8.892 4.151 -14.121
72 HD1 TYR 10 HD2 TYR 10 9.582 3.482 -16.658
73 HD2 TYR 10 HD1 TYR 10 8.185 0.797 -13.668
74 HE1 TYR 10 HE2 TYR 10 8.834 1.927 -18.411
75 HE2 TYR 10 HE1 TYR 10 7.434 -0.765 -15.412
76 HH TYR 10 HH TYR 10 7.008 0.043 -18.545
77 H ARG 11 H ARG 11 11.608 5.549 -12.739
78 HA ARG 11 HA ARG 11 11.575 7.213 -15.162
79 HB2 ARG 11 2HB ARG 11 10.485 7.624 -12.611
80 HB3 ARG 11 3HB ARG 11 11.877 8.695 -12.699
81 HG2 ARG 11 2HG ARG 11 11.008 9.852 -14.547
82 HG3 ARG 11 3HG ARG 11 9.804 8.601 -14.865
83 HD2 ARG 11 2HD ARG 11 9.762 10.004 -12.237
84 HD3 ARG 11 3HD ARG 11 9.155 10.850 -13.660
85 HE ARG 11 HE ARG 11 7.986 8.314 -13.590
86 HH11 ARG 11 1HH1 ARG 11 7.974 11.280 -11.767
87 HH12 ARG 11 2HH1 ARG 11 6.355 11.069 -11.187
88 HH21 ARG 11 1HH2 ARG 11 5.854 8.025 -12.833
89 HH22 ARG 11 2HH2 ARG 11 5.150 9.217 -11.793
90 HNA MK8 12 H MK8 12 13.590 6.239 -12.348
91 HB MK8 12 2HB MK8 12 15.318 6.655 -10.737
92 HBA MK8 12 3HB MK8 12 16.238 5.395 -11.548
93 HD MK8 12 2HD MK8 12 17.078 7.072 -8.918
94 HDA MK8 12 3HD MK8 12 18.361 8.201 -9.395
95 HE MK8 12 HE MK8 12 16.848 9.900 -9.364
96 HG MK8 12 2HG MK8 12 18.232 6.446 -11.029
97 HGA MK8 12 3HG MK8 12 17.711 7.932 -11.819
98 HB1 MK8 12 HBA MK8 12 16.124 9.054 -12.273
99 HB1A MK8 12 HGA MK8 12 16.788 8.717 -13.575
100 HB1B MK8 12 HDA MK8 12 15.338 9.098 -13.550
101 H ALA 13 H ALA 13 14.552 5.042 -13.882
102 HA ALA 13 HA ALA 13 16.777 3.992 -15.334
103 HB1 ALA 13 3HB ALA 13 15.457 2.236 -14.847
104 HB2 ALA 13 1HB ALA 13 13.987 3.212 -14.829
105 HB3 ALA 13 2HB ALA 13 14.661 2.659 -16.363
106 H TYR 14 H TYR 14 13.600 5.150 -16.484
107 HA TYR 14 HA TYR 14 14.170 5.224 -19.182
108 HB2 TYR 14 2HB TYR 14 12.104 6.196 -17.468
109 HB3 TYR 14 3HB TYR 14 12.526 7.474 -18.602
110 HD1 TYR 14 HD2 TYR 14 12.341 7.059 -21.050
111 HD2 TYR 14 HD1 TYR 14 10.930 4.251 -18.181
112 HE1 TYR 14 HE2 TYR 14 10.995 5.964 -22.793
113 HE2 TYR 14 HE1 TYR 14 9.581 3.147 -19.917
114 HH TYR 14 HH TYR 14 8.527 4.090 -22.305
115 H THR 15 H THR 15 15.176 7.399 -16.675
116 HA THR 15 HA THR 15 15.965 9.519 -18.456
117 HB THR 15 HB THR 15 16.544 9.053 -15.527
118 HG1 THR 15 HG1 THR 15 14.367 9.589 -16.063
119 HG21 THR 15 1HG2 THR 15 18.347 10.374 -16.324
120 HG22 THR 15 2HG2 THR 15 17.206 11.498 -15.587
121 HG23 THR 15 3HG2 THR 15 17.281 11.342 -17.342
122 H MET 16 H MET 16 17.485 6.760 -16.923
123 HA MET 16 HA MET 16 20.160 7.568 -17.607
124 HB2 MET 16 2HB MET 16 19.387 6.027 -15.667
125 HB3 MET 16 3HB MET 16 19.364 4.763 -16.888
126 HG2 MET 16 2HG MET 16 21.509 4.441 -16.458
127 HG3 MET 16 3HG MET 16 21.821 5.995 -17.227
128 HE1 MET 16 3HE MET 16 22.664 8.180 -15.841
129 HE2 MET 16 1HE MET 16 23.769 7.604 -14.591
130 HE3 MET 16 2HE MET 16 23.755 6.835 -16.178
131 H VAL 17 H VAL 17 17.585 6.092 -19.249
132 HA VAL 17 HA VAL 17 19.195 4.546 -21.080
133 HB VAL 17 HB VAL 17 16.309 5.311 -21.474
134 HG11 VAL 17 1HG1 VAL 17 18.007 3.996 -23.125
135 HG12 VAL 17 2HG1 VAL 17 17.310 2.651 -22.220
136 HG13 VAL 17 3HG1 VAL 17 16.260 3.760 -23.103
137 HG21 VAL 17 3HG2 VAL 17 17.485 3.639 -19.406
138 HG22 VAL 17 1HG2 VAL 17 15.840 4.256 -19.564
139 HG23 VAL 17 2HG2 VAL 17 16.309 2.772 -20.393
140 H LEU 18 H LEU 18 17.441 7.617 -21.131
141 HA LEU 18 HA LEU 18 17.847 8.210 -23.853
142 HB2 LEU 18 2HB LEU 18 17.646 10.257 -21.664
143 HB3 LEU 18 3HB LEU 18 17.142 10.407 -23.346
144 HG LEU 18 HG LEU 18 15.763 8.306 -21.815
145 HD11 LEU 18 1HD1 LEU 18 16.143 10.361 -20.257
146 HD12 LEU 18 2HD1 LEU 18 14.544 9.628 -20.380
147 HD13 LEU 18 3HD1 LEU 18 14.904 11.110 -21.264
148 HD21 LEU 18 3HD2 LEU 18 14.612 10.573 -23.416
149 HD22 LEU 18 1HD2 LEU 18 13.915 8.985 -23.092
150 HD23 LEU 18 2HD2 LEU 18 15.296 9.136 -24.179
151 H HIS 19 H HIS 19 19.806 8.766 -20.989
152 HA HIS 19 HA HIS 19 21.764 10.321 -22.450
153 HB2 HIS 19 2HB HIS 19 21.377 10.945 -20.156
154 HB3 HIS 19 3HB HIS 19 21.687 9.301 -19.606
155 HD1 HIS 19 HD1 HIS 19 23.911 11.092 -22.058
156 HD2 HIS 19 HD2 HIS 19 23.898 9.924 -18.071
157 HE1 HIS 19 HE1 HIS 19 26.252 11.495 -21.232
158 H LYS 20 H LYS 20 21.471 7.084 -21.071
159 HA LYS 20 HA LYS 20 22.799 5.230 -21.215
160 HB2 LYS 20 2HB LYS 20 21.884 5.717 -23.613
161 HB3 LYS 20 3HB LYS 20 23.554 6.131 -23.975
162 HG2 LYS 20 2HG LYS 20 23.681 3.953 -24.514
163 HG3 LYS 20 3HG LYS 20 23.925 3.757 -22.777
164 HD2 LYS 20 2HD LYS 20 21.291 3.533 -24.233
165 HD3 LYS 20 3HD LYS 20 22.253 2.186 -23.620
166 HE2 LYS 20 2HE LYS 20 22.008 3.103 -21.337
167 HE3 LYS 20 3HE LYS 20 20.970 4.373 -21.984
168 HZ1 LYS 20 3HZ LYS 20 20.428 1.454 -21.998
169 HZ2 LYS 20 1HZ LYS 20 19.471 2.601 -22.793
170 HZ3 LYS 20 2HZ LYS 20 19.609 2.637 -21.107
Start of MODEL 4
1 H1 ASN 1 H ASN 1 3.909 0.163 0.683
2 HA ASN 1 HA ASN 1 2.158 -0.807 -1.474
3 HB2 ASN 1 2HB ASN 1 1.553 0.154 1.323
4 HB3 ASN 1 3HB ASN 1 0.302 -0.052 0.100
5 HD21 ASN 1 1HD2 ASN 1 0.577 -1.423 2.613
6 HD22 ASN 1 2HD2 ASN 1 0.722 -3.106 2.250
7 H SER 2 H SER 2 3.493 0.995 -2.616
8 HA SER 2 HA SER 2 1.729 3.233 -2.934
9 HB2 SER 2 2HB SER 2 3.567 3.630 -0.980
10 HB3 SER 2 3HB SER 2 4.475 4.187 -2.385
11 HG SER 2 HG SER 2 3.157 5.811 -1.303
12 H GLY 3 H GLY 3 4.966 1.935 -3.602
13 HA2 GLY 3 2HA GLY 3 5.519 1.262 -5.862
14 HA3 GLY 3 3HA GLY 3 4.522 2.588 -6.444
15 H LEU 4 H LEU 4 6.599 3.168 -3.749
16 HA LEU 4 HA LEU 4 7.951 5.276 -5.037
17 HB2 LEU 4 2HB LEU 4 7.672 4.363 -2.444
18 HB3 LEU 4 3HB LEU 4 9.388 4.139 -2.779
19 HG LEU 4 HG LEU 4 8.873 6.710 -3.668
20 HD11 LEU 4 1HD1 LEU 4 6.861 7.163 -2.708
21 HD12 LEU 4 2HD1 LEU 4 7.913 7.560 -1.350
22 HD13 LEU 4 3HD1 LEU 4 7.092 6.000 -1.403
23 HD21 LEU 4 3HD2 LEU 4 10.033 5.622 -1.115
24 HD22 LEU 4 1HD2 LEU 4 10.080 7.334 -1.534
25 HD23 LEU 4 2HD2 LEU 4 10.885 6.152 -2.566
26 H SER 5 H SER 5 8.810 1.910 -4.453
27 HA SER 5 HA SER 5 11.431 2.281 -5.668
28 HB2 SER 5 2HB SER 5 10.897 0.774 -3.622
29 HB3 SER 5 3HB SER 5 10.294 -0.372 -4.820
30 HG SER 5 HG SER 5 12.283 -0.895 -5.186
31 H PHE 6 H PHE 6 8.433 1.991 -6.848
32 HA PHE 6 HA PHE 6 9.299 0.367 -9.150
33 HB2 PHE 6 2HB PHE 6 6.503 0.766 -8.065
34 HB3 PHE 6 3HB PHE 6 6.897 -0.121 -9.534
35 HD1 PHE 6 HD1 PHE 6 7.022 -0.142 -5.879
36 HD2 PHE 6 HD2 PHE 6 7.899 -2.310 -9.435
37 HE1 PHE 6 HE1 PHE 6 7.327 -2.191 -4.551
38 HE2 PHE 6 HE2 PHE 6 8.204 -4.362 -8.113
39 HZ PHE 6 HZ PHE 6 7.918 -4.305 -5.668
40 H GLU 7 H GLU 7 8.765 3.449 -8.161
41 HA GLU 7 HA GLU 7 7.748 4.334 -10.775
42 HB2 GLU 7 2HB GLU 7 6.613 5.035 -8.571
43 HB3 GLU 7 3HB GLU 7 8.010 6.076 -8.336
44 HG2 GLU 7 2HG GLU 7 6.484 7.494 -9.315
45 HG3 GLU 7 3HG GLU 7 7.454 6.970 -10.690
46 HNA MK8 8 H MK8 8 10.495 4.564 -8.507
47 HB MK8 8 2HB MK8 8 12.396 5.454 -7.502
48 HBA MK8 8 3HB MK8 8 13.804 5.921 -8.445
49 HD MK8 8 2HD MK8 8 13.499 9.290 -7.020
50 HDA MK8 8 3HD MK8 8 14.406 7.768 -6.913
51 HE MK8 8 HE MK8 8 14.336 8.228 -9.847
52 HG MK8 8 2HG MK8 8 11.991 8.143 -8.741
53 HGA MK8 8 3HG MK8 8 11.782 7.633 -7.067
54 HB1 MK8 8 HBA MK8 8 11.784 6.826 -11.544
55 HB1A MK8 8 HGA MK8 8 11.077 7.569 -10.449
56 HB1B MK8 8 HDA MK8 8 12.571 7.640 -10.560
57 H LEU 9 H LEU 9 11.196 3.441 -9.919
58 HA LEU 9 HA LEU 9 13.643 2.318 -11.004
59 HB2 LEU 9 2HB LEU 9 12.329 1.127 -9.285
60 HB3 LEU 9 3HB LEU 9 10.995 0.996 -10.429
61 HG LEU 9 HG LEU 9 12.354 -0.430 -11.867
62 HD11 LEU 9 1HD1 LEU 9 14.480 0.507 -10.109
63 HD12 LEU 9 2HD1 LEU 9 14.564 -0.152 -11.743
64 HD13 LEU 9 3HD1 LEU 9 14.494 -1.240 -10.357
65 HD21 LEU 9 3HD2 LEU 9 10.981 -1.411 -10.059
66 HD22 LEU 9 1HD2 LEU 9 12.399 -1.392 -9.010
67 HD23 LEU 9 2HD2 LEU 9 12.392 -2.390 -10.464
68 H TYR 10 H TYR 10 11.013 3.886 -12.254
69 HA TYR 10 HA TYR 10 11.343 2.545 -14.856
70 HB2 TYR 10 2HB TYR 10 8.976 2.745 -13.333
71 HB3 TYR 10 3HB TYR 10 8.797 3.873 -14.671
72 HD1 TYR 10 HD1 TYR 10 9.718 2.787 -17.002
73 HD2 TYR 10 HD2 TYR 10 8.115 0.645 -13.693
74 HE1 TYR 10 HE1 TYR 10 9.134 0.925 -18.498
75 HE2 TYR 10 HE2 TYR 10 7.528 -1.224 -15.181
76 HH TYR 10 HH TYR 10 7.827 -0.972 -18.654
77 H ARG 11 H ARG 11 11.395 5.431 -13.052
78 HA ARG 11 HA ARG 11 11.371 7.074 -15.489
79 HB2 ARG 11 2HB ARG 11 10.079 7.471 -13.096
80 HB3 ARG 11 3HB ARG 11 11.512 8.475 -12.917
81 HG2 ARG 11 2HG ARG 11 10.638 9.080 -15.455
82 HG3 ARG 11 3HG ARG 11 9.141 8.881 -14.542
83 HD2 ARG 11 2HD ARG 11 11.313 10.459 -13.284
84 HD3 ARG 11 3HD ARG 11 10.465 11.190 -14.645
85 HE ARG 11 HE ARG 11 8.470 10.297 -13.024
86 HH11 ARG 11 1HH1 ARG 11 11.236 12.365 -12.580
87 HH12 ARG 11 2HH1 ARG 11 10.486 13.322 -11.346
88 HH21 ARG 11 1HH2 ARG 11 7.472 11.551 -11.400
89 HH22 ARG 11 2HH2 ARG 11 8.346 12.858 -10.675
90 HNA MK8 12 H MK8 12 13.334 6.203 -12.605
91 HB MK8 12 2HB MK8 12 14.993 6.699 -10.946
92 HBA MK8 12 3HB MK8 12 15.990 5.474 -11.717
93 HD MK8 12 2HD MK8 12 16.663 7.202 -9.077
94 HDA MK8 12 3HD MK8 12 17.929 8.366 -9.514
95 HE MK8 12 HE MK8 12 16.362 10.020 -9.543
96 HG MK8 12 2HG MK8 12 17.921 6.611 -11.146
97 HGA MK8 12 3HG MK8 12 17.363 8.070 -11.961
98 HB1 MK8 12 HBA MK8 12 15.748 9.120 -12.475
99 HB1A MK8 12 HGA MK8 12 16.468 8.801 -13.752
100 HB1B MK8 12 HDA MK8 12 15.003 9.123 -13.777
101 H ALA 13 H ALA 13 14.403 5.025 -14.085
102 HA ALA 13 HA ALA 13 16.710 4.060 -15.460
103 HB1 ALA 13 3HB ALA 13 15.296 2.278 -16.237
104 HB2 ALA 13 1HB ALA 13 14.934 2.594 -14.540
105 HB3 ALA 13 2HB ALA 13 13.847 3.182 -15.799
106 H TYR 14 H TYR 14 13.521 5.030 -16.743
107 HA TYR 14 HA TYR 14 14.197 5.125 -19.414
108 HB2 TYR 14 2HB TYR 14 11.923 5.574 -18.071
109 HB3 TYR 14 3HB TYR 14 12.359 7.242 -18.426
110 HD1 TYR 14 HD2 TYR 14 12.189 3.955 -20.206
111 HD2 TYR 14 HD1 TYR 14 11.494 8.149 -20.357
112 HE1 TYR 14 HE2 TYR 14 11.251 3.712 -22.467
113 HE2 TYR 14 HE1 TYR 14 10.553 7.919 -22.618
114 HH TYR 14 HH TYR 14 10.016 6.524 -24.255
115 H THR 15 H THR 15 14.946 7.384 -16.887
116 HA THR 15 HA THR 15 15.684 9.532 -18.654
117 HB THR 15 HB THR 15 16.178 9.126 -15.700
118 HG1 THR 15 HG1 THR 15 14.588 10.971 -15.752
119 HG21 THR 15 1HG2 THR 15 17.855 10.618 -16.167
120 HG22 THR 15 2HG2 THR 15 16.508 11.738 -15.964
121 HG23 THR 15 3HG2 THR 15 17.030 11.270 -17.582
122 H MET 16 H MET 16 17.308 6.888 -17.026
123 HA MET 16 HA MET 16 19.953 7.856 -17.615
124 HB2 MET 16 2HB MET 16 19.461 6.433 -15.643
125 HB3 MET 16 3HB MET 16 19.070 5.104 -16.726
126 HG2 MET 16 2HG MET 16 21.690 6.276 -17.228
127 HG3 MET 16 3HG MET 16 21.516 5.600 -15.610
128 HE1 MET 16 3HE MET 16 21.152 2.191 -15.666
129 HE2 MET 16 1HE MET 16 22.840 2.642 -15.907
130 HE3 MET 16 2HE MET 16 21.778 3.679 -14.954
131 H VAL 17 H VAL 17 17.544 6.213 -19.341
132 HA VAL 17 HA VAL 17 19.317 4.740 -21.079
133 HB VAL 17 HB VAL 17 16.407 5.331 -21.588
134 HG11 VAL 17 1HG1 VAL 17 17.583 2.737 -22.300
135 HG12 VAL 17 2HG1 VAL 17 16.513 3.793 -23.224
136 HG13 VAL 17 3HG1 VAL 17 18.246 4.119 -23.174
137 HG21 VAL 17 3HG2 VAL 17 17.605 3.746 -19.473
138 HG22 VAL 17 1HG2 VAL 17 15.927 4.234 -19.707
139 HG23 VAL 17 2HG2 VAL 17 16.544 2.789 -20.507
140 H LEU 18 H LEU 18 17.384 7.698 -21.255
141 HA LEU 18 HA LEU 18 17.868 8.283 -23.963
142 HB2 LEU 18 2HB LEU 18 17.477 10.347 -21.816
143 HB3 LEU 18 3HB LEU 18 17.020 10.440 -23.516
144 HG LEU 18 HG LEU 18 15.709 8.286 -22.009
145 HD11 LEU 18 1HD1 LEU 18 15.941 10.359 -20.445
146 HD12 LEU 18 2HD1 LEU 18 14.387 9.542 -20.608
147 HD13 LEU 18 3HD1 LEU 18 14.690 11.041 -21.486
148 HD21 LEU 18 3HD2 LEU 18 14.470 10.487 -23.631
149 HD22 LEU 18 1HD2 LEU 18 13.873 8.852 -23.345
150 HD23 LEU 18 2HD2 LEU 18 15.271 9.109 -24.389
151 H HIS 19 H HIS 19 19.677 8.996 -21.032
152 HA HIS 19 HA HIS 19 21.600 10.643 -22.431
153 HB2 HIS 19 2HB HIS 19 21.083 11.224 -20.142
154 HB3 HIS 19 3HB HIS 19 21.511 9.606 -19.592
155 HD1 HIS 19 HD1 HIS 19 23.197 10.897 -17.973
156 HD2 HIS 19 HD2 HIS 19 24.075 11.084 -22.030
157 HE1 HIS 19 HE1 HIS 19 25.591 11.655 -18.109
158 H LYS 20 H LYS 20 21.537 7.437 -20.915
159 HA LYS 20 HA LYS 20 22.970 5.665 -21.029
160 HB2 LYS 20 2HB LYS 20 22.039 6.052 -23.458
161 HB3 LYS 20 3HB LYS 20 23.704 6.500 -23.808
162 HG2 LYS 20 2HG LYS 20 23.892 4.307 -24.267
163 HG3 LYS 20 3HG LYS 20 24.125 4.185 -22.522
164 HD2 LYS 20 2HD LYS 20 21.496 3.854 -23.967
165 HD3 LYS 20 3HD LYS 20 22.501 2.538 -23.356
166 HE2 LYS 20 2HE LYS 20 21.309 4.729 -21.660
167 HE3 LYS 20 3HE LYS 20 20.616 3.120 -21.855
168 HZ1 LYS 20 3HZ LYS 20 21.967 2.354 -20.297
169 HZ2 LYS 20 1HZ LYS 20 22.543 3.922 -20.030
170 HZ3 LYS 20 2HZ LYS 20 23.333 2.906 -21.128
Start of MODEL 5
1 H1 ASN 1 H ASN 1 -0.587 -0.247 -1.130
2 HA ASN 1 HA ASN 1 1.846 -0.185 -0.710
3 HB2 ASN 1 2HB ASN 1 2.074 -0.625 -3.688
4 HB3 ASN 1 3HB ASN 1 3.369 -0.619 -2.494
5 HD21 ASN 1 1HD2 ASN 1 3.218 -2.322 -0.806
6 HD22 ASN 1 2HD2 ASN 1 2.669 -3.885 -1.295
7 H SER 2 H SER 2 3.343 1.572 -1.603
8 HA SER 2 HA SER 2 1.686 3.898 -2.181
9 HB2 SER 2 2HB SER 2 3.613 3.670 -0.381
10 HB3 SER 2 3HB SER 2 4.638 4.097 -1.751
11 HG SER 2 HG SER 2 3.066 5.683 -0.259
12 H GLY 3 H GLY 3 4.868 2.741 -3.325
13 HA2 GLY 3 2HA GLY 3 5.192 2.310 -5.706
14 HA3 GLY 3 3HA GLY 3 4.092 3.643 -6.028
15 H LEU 4 H LEU 4 6.849 3.437 -3.798
16 HA LEU 4 HA LEU 4 7.908 5.889 -4.982
17 HB2 LEU 4 2HB LEU 4 7.631 5.111 -2.391
18 HB3 LEU 4 3HB LEU 4 9.314 4.690 -2.699
19 HG LEU 4 HG LEU 4 9.502 7.130 -3.567
20 HD11 LEU 4 1HD1 LEU 4 7.607 8.067 -1.633
21 HD12 LEU 4 2HD1 LEU 4 6.791 7.087 -2.852
22 HD13 LEU 4 3HD1 LEU 4 7.759 8.478 -3.341
23 HD21 LEU 4 3HD2 LEU 4 10.610 6.232 -1.568
24 HD22 LEU 4 1HD2 LEU 4 9.155 6.559 -0.626
25 HD23 LEU 4 2HD2 LEU 4 10.067 7.894 -1.332
26 H SER 5 H SER 5 9.172 2.730 -3.907
27 HA SER 5 HA SER 5 11.671 3.005 -5.184
28 HB2 SER 5 2HB SER 5 11.824 1.341 -3.629
29 HB3 SER 5 3HB SER 5 10.162 0.807 -3.883
30 HG SER 5 HG SER 5 12.499 0.080 -5.230
31 H PHE 6 H PHE 6 8.646 1.470 -6.190
32 HA PHE 6 HA PHE 6 9.657 0.437 -8.634
33 HB2 PHE 6 2HB PHE 6 6.860 0.976 -7.642
34 HB3 PHE 6 3HB PHE 6 7.184 0.286 -9.228
35 HD1 PHE 6 HD2 PHE 6 8.633 -1.854 -9.278
36 HD2 PHE 6 HD1 PHE 6 6.647 -0.405 -5.803
37 HE1 PHE 6 HE2 PHE 6 8.754 -4.098 -8.277
38 HE2 PHE 6 HE1 PHE 6 6.766 -2.647 -4.796
39 HZ PHE 6 HZ PHE 6 7.819 -4.497 -6.034
40 H GLU 7 H GLU 7 8.605 3.551 -7.635
41 HA GLU 7 HA GLU 7 8.012 4.509 -10.293
42 HB2 GLU 7 2HB GLU 7 6.780 5.509 -8.506
43 HB3 GLU 7 3HB GLU 7 8.251 5.880 -7.617
44 HG2 GLU 7 2HG GLU 7 8.641 7.758 -8.781
45 HG3 GLU 7 3HG GLU 7 8.081 7.061 -10.300
46 HNA MK8 8 H MK8 8 10.819 4.393 -8.116
47 HB MK8 8 2HB MK8 8 12.839 5.003 -7.154
48 HBA MK8 8 3HB MK8 8 14.265 5.324 -8.131
49 HD MK8 8 2HD MK8 8 14.457 8.680 -6.650
50 HDA MK8 8 3HD MK8 8 15.161 7.052 -6.571
51 HE MK8 8 HE MK8 8 15.025 7.515 -9.503
52 HG MK8 8 2HG MK8 8 12.719 7.767 -8.260
53 HGA MK8 8 3HG MK8 8 12.554 7.217 -6.595
54 HB1 MK8 8 HBA MK8 8 12.266 6.625 -11.105
55 HB1A MK8 8 HGA MK8 8 11.680 7.387 -9.953
56 HB1B MK8 8 HDA MK8 8 13.169 7.296 -10.113
57 H LEU 9 H LEU 9 11.333 3.257 -9.615
58 HA LEU 9 HA LEU 9 13.589 1.904 -10.838
59 HB2 LEU 9 2HB LEU 9 12.239 0.752 -9.161
60 HB3 LEU 9 3HB LEU 9 10.813 0.926 -10.182
61 HG LEU 9 HG LEU 9 12.906 -0.422 -11.622
62 HD11 LEU 9 1HD1 LEU 9 12.002 -1.980 -9.237
63 HD12 LEU 9 2HD1 LEU 9 13.448 -0.974 -9.150
64 HD13 LEU 9 3HD1 LEU 9 13.355 -2.283 -10.328
65 HD21 LEU 9 3HD2 LEU 9 10.277 -0.360 -11.771
66 HD22 LEU 9 1HD2 LEU 9 10.411 -1.749 -10.692
67 HD23 LEU 9 2HD2 LEU 9 11.188 -1.784 -12.275
68 H TYR 10 H TYR 10 11.164 3.860 -11.932
69 HA TYR 10 HA TYR 10 11.272 2.639 -14.609
70 HB2 TYR 10 2HB TYR 10 8.971 3.007 -13.009
71 HB3 TYR 10 3HB TYR 10 8.886 4.209 -14.292
72 HD1 TYR 10 HD1 TYR 10 9.007 3.436 -16.688
73 HD2 TYR 10 HD2 TYR 10 8.518 0.731 -13.440
74 HE1 TYR 10 HE1 TYR 10 8.196 1.716 -18.249
75 HE2 TYR 10 HE2 TYR 10 7.707 -0.996 -14.992
76 HH TYR 10 HH TYR 10 8.197 -1.149 -17.992
77 H ARG 11 H ARG 11 11.696 5.380 -12.646
78 HA ARG 11 HA ARG 11 11.774 7.169 -14.977
79 HB2 ARG 11 2HB ARG 11 10.706 7.522 -12.416
80 HB3 ARG 11 3HB ARG 11 12.183 8.477 -12.425
81 HG2 ARG 11 2HG ARG 11 10.751 10.040 -13.218
82 HG3 ARG 11 3HG ARG 11 11.196 9.285 -14.750
83 HD2 ARG 11 2HD ARG 11 9.121 7.714 -13.920
84 HD3 ARG 11 3HD ARG 11 8.637 9.303 -13.328
85 HE ARG 11 HE ARG 11 9.498 9.478 -16.015
86 HH11 ARG 11 1HH1 ARG 11 6.848 8.346 -14.062
87 HH12 ARG 11 2HH1 ARG 11 5.668 8.548 -15.314
88 HH21 ARG 11 1HH2 ARG 11 7.954 9.748 -17.672
89 HH22 ARG 11 2HH2 ARG 11 6.298 9.344 -17.368
90 HNA MK8 12 H MK8 12 13.723 5.890 -12.243
91 HB MK8 12 2HB MK8 12 15.521 5.995 -10.639
92 HBA MK8 12 3HB MK8 12 16.267 4.737 -11.614
93 HD MK8 12 2HD MK8 12 17.119 6.148 -8.889
94 HDA MK8 12 3HD MK8 12 18.750 6.786 -9.175
95 HE MK8 12 HE MK8 12 17.821 8.905 -8.896
96 HG MK8 12 2HG MK8 12 18.381 5.494 -11.061
97 HGA MK8 12 3HG MK8 12 18.016 7.104 -11.678
98 HB1 MK8 12 HBA MK8 12 17.155 8.226 -13.063
99 HB1A MK8 12 HGA MK8 12 15.747 8.686 -13.298
100 HB1B MK8 12 HDA MK8 12 16.259 8.523 -11.898
101 H ALA 13 H ALA 13 14.644 4.734 -13.916
102 HA ALA 13 HA ALA 13 16.787 3.783 -15.545
103 HB1 ALA 13 3HB ALA 13 15.284 2.118 -14.976
104 HB2 ALA 13 1HB ALA 13 13.878 3.130 -15.307
105 HB3 ALA 13 2HB ALA 13 14.832 2.482 -16.641
106 H TYR 14 H TYR 14 13.628 5.172 -16.467
107 HA TYR 14 HA TYR 14 14.138 5.532 -19.155
108 HB2 TYR 14 2HB TYR 14 12.145 6.364 -17.290
109 HB3 TYR 14 3HB TYR 14 12.586 7.753 -18.278
110 HD1 TYR 14 HD1 TYR 14 12.315 4.121 -19.106
111 HD2 TYR 14 HD2 TYR 14 10.908 8.068 -19.840
112 HE1 TYR 14 HE1 TYR 14 10.896 3.270 -20.926
113 HE2 TYR 14 HE2 TYR 14 9.484 7.228 -21.661
114 HH TYR 14 HH TYR 14 8.414 4.598 -22.097
115 H THR 15 H THR 15 15.283 7.368 -16.448
116 HA THR 15 HA THR 15 16.101 9.653 -17.999
117 HB THR 15 HB THR 15 16.734 8.838 -15.158
118 HG1 THR 15 HG1 THR 15 14.921 10.675 -16.348
119 HG21 THR 15 1HG2 THR 15 17.730 11.072 -16.842
120 HG22 THR 15 2HG2 THR 15 18.518 10.214 -15.517
121 HG23 THR 15 3HG2 THR 15 17.300 11.442 -15.173
122 H MET 16 H MET 16 17.558 6.689 -16.834
123 HA MET 16 HA MET 16 20.243 7.483 -17.496
124 HB2 MET 16 2HB MET 16 19.385 5.714 -15.747
125 HB3 MET 16 3HB MET 16 19.443 4.625 -17.126
126 HG2 MET 16 2HG MET 16 21.554 4.278 -16.503
127 HG3 MET 16 3HG MET 16 21.873 5.823 -17.289
128 HE1 MET 16 3HE MET 16 23.087 7.547 -16.304
129 HE2 MET 16 1HE MET 16 21.600 8.253 -15.669
130 HE3 MET 16 2HE MET 16 23.017 8.101 -14.630
131 H VAL 17 H VAL 17 17.579 6.287 -19.221
132 HA VAL 17 HA VAL 17 19.089 4.909 -21.260
133 HB VAL 17 HB VAL 17 16.223 5.808 -21.486
134 HG11 VAL 17 1HG1 VAL 17 16.066 4.423 -23.259
135 HG12 VAL 17 2HG1 VAL 17 17.813 4.657 -23.334
136 HG13 VAL 17 3HG1 VAL 17 17.147 3.222 -22.553
137 HG21 VAL 17 3HG2 VAL 17 17.387 3.875 -19.652
138 HG22 VAL 17 1HG2 VAL 17 15.762 4.560 -19.693
139 HG23 VAL 17 2HG2 VAL 17 16.157 3.165 -20.697
140 H LEU 18 H LEU 18 17.443 8.022 -20.914
141 HA LEU 18 HA LEU 18 17.804 8.908 -23.562
142 HB2 LEU 18 2HB LEU 18 17.730 10.696 -21.149
143 HB3 LEU 18 3HB LEU 18 17.191 11.055 -22.789
144 HG LEU 18 HG LEU 18 15.775 8.840 -21.467
145 HD11 LEU 18 1HD1 LEU 18 15.035 11.593 -20.584
146 HD12 LEU 18 2HD1 LEU 18 16.263 10.689 -19.698
147 HD13 LEU 18 3HD1 LEU 18 14.634 10.034 -19.864
148 HD21 LEU 18 3HD2 LEU 18 13.923 9.717 -22.610
149 HD22 LEU 18 1HD2 LEU 18 15.284 9.945 -23.709
150 HD23 LEU 18 2HD2 LEU 18 14.668 11.308 -22.774
151 H HIS 19 H HIS 19 19.851 9.069 -20.710
152 HA HIS 19 HA HIS 19 21.828 10.716 -22.041
153 HB2 HIS 19 2HB HIS 19 21.520 11.088 -19.682
154 HB3 HIS 19 3HB HIS 19 21.781 9.383 -19.328
155 HD1 HIS 19 HD1 HIS 19 23.947 11.620 -21.494
156 HD2 HIS 19 HD2 HIS 19 24.114 9.494 -17.928
157 HE1 HIS 19 HE1 HIS 19 26.337 11.781 -20.726
158 H LYS 20 H LYS 20 21.450 7.354 -21.031
159 HA LYS 20 HA LYS 20 22.707 5.485 -21.420
160 HB2 LYS 20 2HB LYS 20 21.754 6.273 -23.721
161 HB3 LYS 20 3HB LYS 20 23.429 6.671 -24.079
162 HG2 LYS 20 2HG LYS 20 23.466 4.566 -24.865
163 HG3 LYS 20 3HG LYS 20 23.743 4.165 -23.168
164 HD2 LYS 20 2HD LYS 20 21.070 4.194 -24.571
165 HD3 LYS 20 3HD LYS 20 21.998 2.755 -24.138
166 HE2 LYS 20 2HE LYS 20 21.835 3.413 -21.761
167 HE3 LYS 20 3HE LYS 20 20.831 4.784 -22.233
168 HZ1 LYS 20 3HZ LYS 20 19.250 3.167 -23.198
169 HZ2 LYS 20 1HZ LYS 20 19.427 3.007 -21.523
170 HZ3 LYS 20 2HZ LYS 20 20.182 1.906 -22.563
Start of MODEL 6
1 H1 ASN 1 H ASN 1 5.027 -2.315 -6.676
2 HA ASN 1 HA ASN 1 2.676 -2.167 -5.425
3 HB2 ASN 1 2HB ASN 1 5.073 -3.622 -4.993
4 HB3 ASN 1 3HB ASN 1 4.509 -3.073 -3.418
5 HD21 ASN 1 1HD2 ASN 1 3.632 -4.867 -6.298
6 HD22 ASN 1 2HD2 ASN 1 2.396 -5.820 -5.556
7 H SER 2 H SER 2 5.654 -0.767 -4.065
8 HA SER 2 HA SER 2 4.316 0.435 -1.852
9 HB2 SER 2 2HB SER 2 6.707 1.828 -2.226
10 HB3 SER 2 3HB SER 2 6.457 0.435 -1.175
11 HG SER 2 HG SER 2 7.600 -0.722 -2.497
12 H GLY 3 H GLY 3 6.055 2.014 -4.542
13 HA2 GLY 3 2HA GLY 3 4.527 3.570 -5.872
14 HA3 GLY 3 3HA GLY 3 4.159 4.261 -4.298
15 H LEU 4 H LEU 4 6.819 4.085 -3.243
16 HA LEU 4 HA LEU 4 7.959 6.392 -4.613
17 HB2 LEU 4 2HB LEU 4 8.059 5.268 -1.901
18 HB3 LEU 4 3HB LEU 4 9.574 5.962 -2.473
19 HG LEU 4 HG LEU 4 6.978 7.484 -2.506
20 HD11 LEU 4 1HD1 LEU 4 7.776 6.631 -0.200
21 HD12 LEU 4 2HD1 LEU 4 7.380 8.339 -0.392
22 HD13 LEU 4 3HD1 LEU 4 9.065 7.819 -0.389
23 HD21 LEU 4 3HD2 LEU 4 9.849 8.407 -2.528
24 HD22 LEU 4 1HD2 LEU 4 8.409 9.415 -2.682
25 HD23 LEU 4 2HD2 LEU 4 8.823 8.268 -3.957
26 H SER 5 H SER 5 8.767 3.075 -3.759
27 HA SER 5 HA SER 5 11.393 3.316 -5.003
28 HB2 SER 5 2HB SER 5 10.040 1.093 -3.471
29 HB3 SER 5 3HB SER 5 11.598 0.888 -4.271
30 HG SER 5 HG SER 5 11.719 1.506 -2.019
31 H PHE 6 H PHE 6 8.387 2.934 -6.131
32 HA PHE 6 HA PHE 6 9.224 1.083 -8.265
33 HB2 PHE 6 2HB PHE 6 7.245 0.465 -6.686
34 HB3 PHE 6 3HB PHE 6 6.343 1.642 -7.634
35 HD1 PHE 6 HD2 PHE 6 8.759 -1.112 -8.367
36 HD2 PHE 6 HD1 PHE 6 5.010 0.707 -9.236
37 HE1 PHE 6 HE2 PHE 6 8.326 -2.828 -10.076
38 HE2 PHE 6 HE1 PHE 6 4.572 -1.006 -10.947
39 HZ PHE 6 HZ PHE 6 6.231 -2.776 -11.369
40 H GLU 7 H GLU 7 8.663 4.256 -7.565
41 HA GLU 7 HA GLU 7 7.658 4.886 -10.255
42 HB2 GLU 7 2HB GLU 7 7.003 7.022 -9.420
43 HB3 GLU 7 3HB GLU 7 6.459 5.824 -8.255
44 HG2 GLU 7 2HG GLU 7 8.476 6.321 -6.893
45 HG3 GLU 7 3HG GLU 7 8.858 7.622 -8.018
46 HNA MK8 8 H MK8 8 10.426 5.312 -8.043
47 HB MK8 8 2HB MK8 8 12.350 6.268 -7.146
48 HBA MK8 8 3HB MK8 8 13.749 6.641 -8.142
49 HD MK8 8 2HD MK8 8 13.473 10.141 -7.064
50 HDA MK8 8 3HD MK8 8 14.371 8.635 -6.791
51 HE MK8 8 HE MK8 8 14.296 8.742 -9.751
52 HG MK8 8 2HG MK8 8 11.930 8.833 -8.614
53 HGA MK8 8 3HG MK8 8 11.757 8.480 -6.896
54 HB1 MK8 8 HBA MK8 8 11.717 7.266 -11.292
55 HB1A MK8 8 HGA MK8 8 11.006 8.106 -10.272
56 HB1B MK8 8 HDA MK8 8 12.501 8.168 -10.385
57 H LEU 9 H LEU 9 11.107 4.052 -9.347
58 HA LEU 9 HA LEU 9 13.533 2.811 -10.346
59 HB2 LEU 9 2HB LEU 9 12.237 1.794 -8.511
60 HB3 LEU 9 3HB LEU 9 10.880 1.579 -9.614
61 HG LEU 9 HG LEU 9 13.148 0.336 -10.782
62 HD11 LEU 9 1HD1 LEU 9 12.638 -0.844 -8.084
63 HD12 LEU 9 2HD1 LEU 9 13.858 0.413 -8.290
64 HD13 LEU 9 3HD1 LEU 9 13.993 -1.101 -9.184
65 HD21 LEU 9 3HD2 LEU 9 10.529 -0.111 -10.702
66 HD22 LEU 9 1HD2 LEU 9 11.026 -1.249 -9.450
67 HD23 LEU 9 2HD2 LEU 9 11.691 -1.384 -11.078
68 H TYR 10 H TYR 10 10.907 4.281 -11.714
69 HA TYR 10 HA TYR 10 11.198 2.697 -14.181
70 HB2 TYR 10 2HB TYR 10 8.814 3.238 -12.661
71 HB3 TYR 10 3HB TYR 10 8.681 3.968 -14.257
72 HD1 TYR 10 HD1 TYR 10 9.860 2.195 -16.100
73 HD2 TYR 10 HD2 TYR 10 7.713 1.220 -12.558
74 HE1 TYR 10 HE1 TYR 10 9.284 0.004 -17.058
75 HE2 TYR 10 HE2 TYR 10 7.133 -0.973 -13.506
76 HH TYR 10 HH TYR 10 8.389 -2.007 -16.650
77 H ARG 11 H ARG 11 11.301 5.736 -12.657
78 HA ARG 11 HA ARG 11 11.256 7.146 -15.236
79 HB2 ARG 11 2HB ARG 11 9.947 7.785 -12.944
80 HB3 ARG 11 3HB ARG 11 11.422 8.721 -12.746
81 HG2 ARG 11 2HG ARG 11 11.005 9.681 -15.025
82 HG3 ARG 11 3HG ARG 11 9.427 8.893 -14.986
83 HD2 ARG 11 2HD ARG 11 8.729 10.811 -14.056
84 HD3 ARG 11 3HD ARG 11 9.454 10.166 -12.584
85 HE ARG 11 HE ARG 11 11.414 11.540 -14.058
86 HH11 ARG 11 1HH1 ARG 11 8.547 12.140 -12.176
87 HH12 ARG 11 2HH1 ARG 11 9.047 13.723 -11.679
88 HH21 ARG 11 1HH2 ARG 11 12.083 13.622 -13.411
89 HH22 ARG 11 2HH2 ARG 11 11.058 14.565 -12.383
90 HNA MK8 12 H MK8 12 13.251 6.527 -12.310
91 HB MK8 12 2HB MK8 12 14.940 7.135 -10.726
92 HBA MK8 12 3HB MK8 12 15.916 5.842 -11.408
93 HD MK8 12 2HD MK8 12 16.532 7.777 -8.952
94 HDA MK8 12 3HD MK8 12 17.939 8.759 -9.407
95 HE MK8 12 HE MK8 12 16.540 10.583 -9.550
96 HG MK8 12 2HG MK8 12 17.868 7.008 -10.977
97 HGA MK8 12 3HG MK8 12 17.295 8.409 -11.879
98 HB1 MK8 12 HBA MK8 12 15.672 9.419 -12.461
99 HB1A MK8 12 HGA MK8 12 16.396 8.987 -13.702
100 HB1B MK8 12 HDA MK8 12 14.933 9.312 -13.762
101 H ALA 13 H ALA 13 14.289 5.213 -13.708
102 HA ALA 13 HA ALA 13 16.569 4.123 -15.037
103 HB1 ALA 13 3HB ALA 13 14.876 2.701 -13.987
104 HB2 ALA 13 1HB ALA 13 13.683 3.255 -15.162
105 HB3 ALA 13 2HB ALA 13 15.077 2.315 -15.696
106 H TYR 14 H TYR 14 13.364 5.040 -16.320
107 HA TYR 14 HA TYR 14 13.983 4.893 -19.009
108 HB2 TYR 14 2HB TYR 14 11.742 5.476 -17.658
109 HB3 TYR 14 3HB TYR 14 12.181 7.102 -18.169
110 HD1 TYR 14 HD1 TYR 14 11.938 3.669 -19.640
111 HD2 TYR 14 HD2 TYR 14 11.293 7.842 -20.161
112 HE1 TYR 14 HE1 TYR 14 10.947 3.234 -21.849
113 HE2 TYR 14 HE2 TYR 14 10.300 7.419 -22.370
114 HH TYR 14 HH TYR 14 10.053 4.121 -23.673
115 H THR 15 H THR 15 14.916 7.265 -16.689
116 HA THR 15 HA THR 15 15.588 9.292 -18.634
117 HB THR 15 HB THR 15 16.182 9.097 -15.677
118 HG1 THR 15 HG1 THR 15 14.296 10.604 -17.193
119 HG21 THR 15 1HG2 THR 15 16.914 11.145 -17.731
120 HG22 THR 15 2HG2 THR 15 17.874 10.504 -16.397
121 HG23 THR 15 3HG2 THR 15 16.571 11.648 -16.077
122 H MET 16 H MET 16 17.223 6.741 -16.877
123 HA MET 16 HA MET 16 19.862 7.619 -17.628
124 HB2 MET 16 2HB MET 16 20.669 5.873 -16.340
125 HB3 MET 16 3HB MET 16 19.134 6.216 -15.554
126 HG2 MET 16 2HG MET 16 18.737 4.040 -15.734
127 HG3 MET 16 3HG MET 16 18.434 4.360 -17.439
128 HE1 MET 16 3HE MET 16 21.951 4.076 -15.324
129 HE2 MET 16 1HE MET 16 20.654 3.033 -14.739
130 HE3 MET 16 2HE MET 16 22.055 2.329 -15.547
131 H VAL 17 H VAL 17 17.368 5.860 -19.114
132 HA VAL 17 HA VAL 17 19.048 4.219 -20.785
133 HB VAL 17 HB VAL 17 16.141 4.845 -21.267
134 HG11 VAL 17 1HG1 VAL 17 18.099 2.859 -22.253
135 HG12 VAL 17 2HG1 VAL 17 16.456 2.283 -21.964
136 HG13 VAL 17 3HG1 VAL 17 16.740 3.620 -23.078
137 HG21 VAL 17 3HG2 VAL 17 17.354 3.420 -19.045
138 HG22 VAL 17 1HG2 VAL 17 15.686 3.944 -19.277
139 HG23 VAL 17 2HG2 VAL 17 16.232 2.411 -19.958
140 H LEU 18 H LEU 18 17.195 7.210 -21.143
141 HA LEU 18 HA LEU 18 17.638 7.546 -23.911
142 HB2 LEU 18 2HB LEU 18 17.263 9.787 -21.947
143 HB3 LEU 18 3HB LEU 18 16.796 9.734 -23.645
144 HG LEU 18 HG LEU 18 15.499 7.742 -21.897
145 HD11 LEU 18 1HD1 LEU 18 14.588 10.599 -21.755
146 HD12 LEU 18 2HD1 LEU 18 15.651 9.890 -20.541
147 HD13 LEU 18 3HD1 LEU 18 14.042 9.218 -20.803
148 HD21 LEU 18 3HD2 LEU 18 15.062 8.183 -24.358
149 HD22 LEU 18 1HD2 LEU 18 14.290 9.684 -23.847
150 HD23 LEU 18 2HD2 LEU 18 13.650 8.133 -23.302
151 H HIS 19 H HIS 19 19.473 8.481 -21.063
152 HA HIS 19 HA HIS 19 21.393 9.995 -22.616
153 HB2 HIS 19 2HB HIS 19 20.832 10.757 -20.364
154 HB3 HIS 19 3HB HIS 19 21.369 9.221 -19.691
155 HD1 HIS 19 HD1 HIS 19 23.150 11.484 -22.174
156 HD2 HIS 19 HD2 HIS 19 23.643 9.880 -18.373
157 HE1 HIS 19 HE1 HIS 19 25.456 12.174 -21.446
158 H LYS 20 H LYS 20 21.262 6.917 -20.876
159 HA LYS 20 HA LYS 20 22.694 5.139 -20.803
160 HB2 LYS 20 2HB LYS 20 21.793 5.324 -23.263
161 HB3 LYS 20 3HB LYS 20 23.461 5.739 -23.635
162 HG2 LYS 20 2HG LYS 20 23.652 3.517 -23.910
163 HG3 LYS 20 3HG LYS 20 23.865 3.536 -22.158
164 HD2 LYS 20 2HD LYS 20 21.253 3.090 -23.604
165 HD3 LYS 20 3HD LYS 20 22.248 1.829 -22.870
166 HE2 LYS 20 2HE LYS 20 21.038 4.157 -21.381
167 HE3 LYS 20 3HE LYS 20 20.343 2.538 -21.450
168 HZ1 LYS 20 3HZ LYS 20 21.697 1.868 -19.847
169 HZ2 LYS 20 1HZ LYS 20 22.203 3.470 -19.644
170 HZ3 LYS 20 2HZ LYS 20 23.066 2.433 -20.664
Start of MODEL 7
1 H1 ASN 1 H ASN 1 3.652 -0.199 1.821
2 HA ASN 1 HA ASN 1 5.079 1.364 -0.019
3 HB2 ASN 1 2HB ASN 1 4.388 -1.560 0.113
4 HB3 ASN 1 3HB ASN 1 5.257 -0.903 -1.272
5 HD21 ASN 1 1HD2 ASN 1 5.472 -2.008 1.923
6 HD22 ASN 1 2HD2 ASN 1 7.144 -1.657 2.186
7 H SER 2 H SER 2 3.993 2.719 -1.332
8 HA SER 2 HA SER 2 1.620 1.782 -2.747
9 HB2 SER 2 2HB SER 2 2.186 4.195 -1.629
10 HB3 SER 2 3HB SER 2 2.645 4.497 -3.305
11 HG SER 2 HG SER 2 0.585 4.781 -3.590
12 H GLY 3 H GLY 3 4.609 3.525 -3.642
13 HA2 GLY 3 2HA GLY 3 5.296 1.768 -5.736
14 HA3 GLY 3 3HA GLY 3 4.384 3.115 -6.401
15 H LEU 4 H LEU 4 6.508 3.408 -3.630
16 HA LEU 4 HA LEU 4 7.916 5.581 -4.763
17 HB2 LEU 4 2HB LEU 4 9.460 5.227 -2.795
18 HB3 LEU 4 3HB LEU 4 7.765 5.531 -2.424
19 HG LEU 4 HG LEU 4 8.121 2.721 -2.566
20 HD11 LEU 4 1HD1 LEU 4 10.210 4.146 -0.931
21 HD12 LEU 4 2HD1 LEU 4 10.469 2.970 -2.219
22 HD13 LEU 4 3HD1 LEU 4 9.749 2.461 -0.692
23 HD21 LEU 4 3HD2 LEU 4 7.439 2.849 -0.209
24 HD22 LEU 4 1HD2 LEU 4 6.438 3.866 -1.246
25 HD23 LEU 4 2HD2 LEU 4 7.691 4.595 -0.241
26 H SER 5 H SER 5 8.710 2.159 -4.352
27 HA SER 5 HA SER 5 11.298 2.516 -5.621
28 HB2 SER 5 2HB SER 5 10.745 0.897 -3.669
29 HB3 SER 5 3HB SER 5 10.081 -0.146 -4.927
30 HG SER 5 HG SER 5 12.399 -0.398 -4.321
31 H PHE 6 H PHE 6 8.269 2.396 -6.760
32 HA PHE 6 HA PHE 6 9.040 0.895 -9.176
33 HB2 PHE 6 2HB PHE 6 6.743 0.636 -7.518
34 HB3 PHE 6 3HB PHE 6 6.213 1.285 -9.067
35 HD1 PHE 6 HD1 PHE 6 7.563 0.050 -11.115
36 HD2 PHE 6 HD2 PHE 6 6.566 -1.632 -7.334
37 HE1 PHE 6 HE1 PHE 6 7.665 -2.205 -12.095
38 HE2 PHE 6 HE2 PHE 6 6.667 -3.889 -8.307
39 HZ PHE 6 HZ PHE 6 7.218 -4.178 -10.690
40 H GLU 7 H GLU 7 8.668 3.927 -7.996
41 HA GLU 7 HA GLU 7 7.639 5.017 -10.527
42 HB2 GLU 7 2HB GLU 7 6.513 5.665 -8.362
43 HB3 GLU 7 3HB GLU 7 7.999 6.492 -7.918
44 HG2 GLU 7 2HG GLU 7 7.027 7.244 -10.553
45 HG3 GLU 7 3HG GLU 7 5.876 7.589 -9.263
46 HNA MK8 8 H MK8 8 10.439 4.991 -8.310
47 HB MK8 8 2HB MK8 8 12.397 5.722 -7.302
48 HBA MK8 8 3HB MK8 8 13.811 6.161 -8.248
49 HD MK8 8 2HD MK8 8 13.731 9.445 -6.606
50 HDA MK8 8 3HD MK8 8 14.539 7.865 -6.599
51 HE MK8 8 HE MK8 8 14.407 8.599 -9.516
52 HG MK8 8 2HG MK8 8 12.141 8.502 -8.376
53 HGA MK8 8 3HG MK8 8 11.912 7.904 -6.734
54 HB1 MK8 8 HBA MK8 8 11.749 7.377 -11.229
55 HB1A MK8 8 HGA MK8 8 11.134 8.087 -10.060
56 HB1B MK8 8 HDA MK8 8 12.624 8.077 -10.232
57 H LEU 9 H LEU 9 11.065 3.916 -9.798
58 HA LEU 9 HA LEU 9 13.426 2.762 -11.031
59 HB2 LEU 9 2HB LEU 9 12.110 1.526 -9.342
60 HB3 LEU 9 3HB LEU 9 10.742 1.515 -10.453
61 HG LEU 9 HG LEU 9 11.999 0.123 -12.009
62 HD11 LEU 9 1HD1 LEU 9 14.185 0.282 -9.941
63 HD12 LEU 9 2HD1 LEU 9 14.238 0.897 -11.593
64 HD13 LEU 9 3HD1 LEU 9 14.165 -0.841 -11.301
65 HD21 LEU 9 3HD2 LEU 9 12.506 -1.521 -9.701
66 HD22 LEU 9 1HD2 LEU 9 11.249 -1.667 -10.930
67 HD23 LEU 9 2HD2 LEU 9 10.987 -0.641 -9.519
68 H TYR 10 H TYR 10 10.839 4.519 -12.098
69 HA TYR 10 HA TYR 10 11.007 3.310 -14.779
70 HB2 TYR 10 2HB TYR 10 8.719 3.506 -13.184
71 HB3 TYR 10 3HB TYR 10 8.559 4.805 -14.361
72 HD1 TYR 10 HD1 TYR 10 9.530 1.192 -14.276
73 HD2 TYR 10 HD2 TYR 10 7.487 4.303 -16.338
74 HE1 TYR 10 HE1 TYR 10 8.762 -0.434 -15.954
75 HE2 TYR 10 HE2 TYR 10 6.712 2.686 -18.021
76 HH TYR 10 HH TYR 10 7.389 -0.770 -17.699
77 H ARG 11 H ARG 11 11.262 6.099 -12.827
78 HA ARG 11 HA ARG 11 11.300 7.858 -15.182
79 HB2 ARG 11 2HB ARG 11 10.119 8.196 -12.693
80 HB3 ARG 11 3HB ARG 11 11.577 9.174 -12.597
81 HG2 ARG 11 2HG ARG 11 10.690 10.757 -13.870
82 HG3 ARG 11 3HG ARG 11 10.216 9.588 -15.105
83 HD2 ARG 11 2HD ARG 11 8.654 9.852 -12.564
84 HD3 ARG 11 3HD ARG 11 8.386 10.967 -13.903
85 HE ARG 11 HE ARG 11 7.496 8.272 -13.726
86 HH11 ARG 11 1HH1 ARG 11 8.624 10.688 -15.965
87 HH12 ARG 11 2HH1 ARG 11 7.793 10.004 -17.323
88 HH21 ARG 11 1HH2 ARG 11 6.397 7.363 -15.506
89 HH22 ARG 11 2HH2 ARG 11 6.526 8.114 -17.060
90 HNA MK8 12 H MK8 12 13.250 6.754 -12.366
91 HB MK8 12 2HB MK8 12 14.876 7.087 -10.730
92 HBA MK8 12 3HB MK8 12 16.025 5.977 -11.465
93 HD MK8 12 2HD MK8 12 16.454 6.996 -8.955
94 HDA MK8 12 3HD MK8 12 18.151 7.474 -9.160
95 HE MK8 12 HE MK8 12 17.324 9.259 -7.752
96 HG MK8 12 2HG MK8 12 17.846 7.604 -11.354
97 HGA MK8 12 3HG MK8 12 16.740 8.963 -11.162
98 HB1 MK8 12 HBA MK8 12 15.382 9.672 -12.484
99 HB1A MK8 12 HGA MK8 12 16.658 9.186 -13.106
100 HB1B MK8 12 HDA MK8 12 15.442 9.400 -13.958
101 H ALA 13 H ALA 13 14.179 5.549 -13.814
102 HA ALA 13 HA ALA 13 16.404 4.327 -15.121
103 HB1 ALA 13 3HB ALA 13 14.630 2.947 -14.260
104 HB2 ALA 13 1HB ALA 13 13.448 3.756 -15.290
105 HB3 ALA 13 2HB ALA 13 14.709 2.754 -16.011
106 H TYR 14 H TYR 14 13.370 5.680 -16.435
107 HA TYR 14 HA TYR 14 14.025 5.589 -19.113
108 HB2 TYR 14 2HB TYR 14 12.003 6.808 -17.510
109 HB3 TYR 14 3HB TYR 14 12.570 7.996 -18.679
110 HD1 TYR 14 HD2 TYR 14 12.937 6.852 -21.135
111 HD2 TYR 14 HD1 TYR 14 10.168 5.587 -18.162
112 HE1 TYR 14 HE2 TYR 14 11.554 5.803 -22.877
113 HE2 TYR 14 HE1 TYR 14 8.778 4.534 -19.896
114 HH TYR 14 HH TYR 14 9.795 3.797 -22.870
115 H THR 15 H THR 15 15.172 7.744 -16.660
116 HA THR 15 HA THR 15 16.185 9.725 -18.490
117 HB THR 15 HB THR 15 16.650 9.313 -15.532
118 HG1 THR 15 HG1 THR 15 14.552 10.029 -16.098
119 HG21 THR 15 1HG2 THR 15 17.617 11.487 -17.385
120 HG22 THR 15 2HG2 THR 15 18.589 10.428 -16.362
121 HG23 THR 15 3HG2 THR 15 17.559 11.659 -15.631
122 H MET 16 H MET 16 17.415 6.900 -16.822
123 HA MET 16 HA MET 16 20.165 7.440 -17.480
124 HB2 MET 16 2HB MET 16 19.105 6.001 -15.522
125 HB3 MET 16 3HB MET 16 19.234 4.712 -16.711
126 HG2 MET 16 2HG MET 16 21.286 4.432 -15.894
127 HG3 MET 16 3HG MET 16 21.700 5.843 -16.865
128 HE1 MET 16 3HE MET 16 23.821 6.088 -13.858
129 HE2 MET 16 1HE MET 16 23.637 5.871 -15.599
130 HE3 MET 16 2HE MET 16 23.631 7.494 -14.907
131 H VAL 17 H VAL 17 17.499 6.134 -19.112
132 HA VAL 17 HA VAL 17 18.987 4.354 -20.829
133 HB VAL 17 HB VAL 17 16.197 5.380 -21.320
134 HG11 VAL 17 1HG1 VAL 17 16.037 3.800 -22.907
135 HG12 VAL 17 2HG1 VAL 17 17.801 3.831 -22.876
136 HG13 VAL 17 3HG1 VAL 17 16.922 2.610 -21.954
137 HG21 VAL 17 3HG2 VAL 17 15.589 4.439 -19.389
138 HG22 VAL 17 1HG2 VAL 17 15.945 2.889 -20.152
139 HG23 VAL 17 2HG2 VAL 17 17.170 3.689 -19.167
140 H LEU 18 H LEU 18 17.554 7.580 -21.061
141 HA LEU 18 HA LEU 18 18.095 7.989 -23.801
142 HB2 LEU 18 2HB LEU 18 17.990 10.162 -21.731
143 HB3 LEU 18 3HB LEU 18 17.548 10.254 -23.434
144 HG LEU 18 HG LEU 18 15.960 8.364 -21.831
145 HD11 LEU 18 1HD1 LEU 18 14.761 9.902 -20.572
146 HD12 LEU 18 2HD1 LEU 18 15.387 11.281 -21.475
147 HD13 LEU 18 3HD1 LEU 18 16.433 10.417 -20.348
148 HD21 LEU 18 3HD2 LEU 18 14.203 9.125 -23.202
149 HD22 LEU 18 1HD2 LEU 18 15.620 9.055 -24.250
150 HD23 LEU 18 2HD2 LEU 18 15.064 10.607 -23.622
151 H HIS 19 H HIS 19 19.983 8.521 -20.886
152 HA HIS 19 HA HIS 19 22.119 9.839 -22.331
153 HB2 HIS 19 2HB HIS 19 21.674 10.584 -20.073
154 HB3 HIS 19 3HB HIS 19 21.878 8.949 -19.451
155 HD1 HIS 19 HD1 HIS 19 24.223 10.694 -21.854
156 HD2 HIS 19 HD2 HIS 19 24.117 9.337 -17.928
157 HE1 HIS 19 HE1 HIS 19 26.569 10.959 -20.988
158 H LYS 20 H LYS 20 21.552 6.724 -20.749
159 HA LYS 20 HA LYS 20 22.730 4.767 -20.758
160 HB2 LYS 20 2HB LYS 20 21.899 5.195 -23.213
161 HB3 LYS 20 3HB LYS 20 23.613 5.396 -23.549
162 HG2 LYS 20 2HG LYS 20 23.504 3.184 -23.934
163 HG3 LYS 20 3HG LYS 20 23.691 3.089 -22.182
164 HD2 LYS 20 2HD LYS 20 21.065 3.075 -23.670
165 HD3 LYS 20 3HD LYS 20 21.868 1.656 -22.993
166 HE2 LYS 20 2HE LYS 20 20.963 4.051 -21.398
167 HE3 LYS 20 3HE LYS 20 20.056 2.547 -21.554
168 HZ1 LYS 20 3HZ LYS 20 21.290 1.610 -19.987
169 HZ2 LYS 20 1HZ LYS 20 21.983 3.122 -19.681
170 HZ3 LYS 20 2HZ LYS 20 22.735 2.048 -20.750
Start of MODEL 8
1 H1 ASN 1 H ASN 1 2.053 -0.030 1.197
2 HA ASN 1 HA ASN 1 2.807 -1.124 -1.424
3 HB2 ASN 1 2HB ASN 1 0.782 -2.297 -0.547
4 HB3 ASN 1 3HB ASN 1 -0.049 -0.744 -0.501
5 HD21 ASN 1 1HD2 ASN 1 2.076 -2.332 -2.859
6 HD22 ASN 1 2HD2 ASN 1 0.990 -2.178 -4.194
7 H SER 2 H SER 2 3.857 0.794 -1.953
8 HA SER 2 HA SER 2 2.059 3.067 -2.456
9 HB2 SER 2 2HB SER 2 3.883 3.207 -0.499
10 HB3 SER 2 3HB SER 2 4.915 3.654 -1.858
11 HG SER 2 HG SER 2 3.318 5.270 -2.365
12 H GLY 3 H GLY 3 5.318 1.812 -3.199
13 HA2 GLY 3 2HA GLY 3 5.846 1.163 -5.480
14 HA3 GLY 3 3HA GLY 3 4.792 2.457 -6.031
15 H LEU 4 H LEU 4 7.005 2.935 -3.384
16 HA LEU 4 HA LEU 4 8.214 5.172 -4.628
17 HB2 LEU 4 2HB LEU 4 7.975 4.902 -2.190
18 HB3 LEU 4 3HB LEU 4 9.155 3.594 -2.238
19 HG LEU 4 HG LEU 4 10.768 5.354 -3.190
20 HD11 LEU 4 1HD1 LEU 4 10.238 7.660 -2.383
21 HD12 LEU 4 2HD1 LEU 4 8.586 7.115 -2.093
22 HD13 LEU 4 3HD1 LEU 4 9.244 7.103 -3.729
23 HD21 LEU 4 3HD2 LEU 4 11.650 5.386 -1.140
24 HD22 LEU 4 1HD2 LEU 4 10.237 4.454 -0.645
25 HD23 LEU 4 2HD2 LEU 4 10.247 6.207 -0.456
26 H SER 5 H SER 5 9.182 1.812 -4.228
27 HA SER 5 HA SER 5 11.745 2.312 -5.521
28 HB2 SER 5 2HB SER 5 10.520 -0.146 -4.265
29 HB3 SER 5 3HB SER 5 12.055 -0.183 -5.132
30 HG SER 5 HG SER 5 11.898 0.257 -2.677
31 H PHE 6 H PHE 6 8.710 1.968 -6.591
32 HA PHE 6 HA PHE 6 9.528 0.453 -8.983
33 HB2 PHE 6 2HB PHE 6 6.992 0.488 -7.426
34 HB3 PHE 6 3HB PHE 6 6.868 0.318 -9.174
35 HD1 PHE 6 HD2 PHE 6 9.083 -1.063 -6.501
36 HD2 PHE 6 HD1 PHE 6 6.592 -1.842 -9.863
37 HE1 PHE 6 HE2 PHE 6 9.565 -3.467 -6.296
38 HE2 PHE 6 HE1 PHE 6 7.070 -4.248 -9.663
39 HZ PHE 6 HZ PHE 6 8.559 -5.063 -7.879
40 H GLU 7 H GLU 7 8.923 3.484 -7.854
41 HA GLU 7 HA GLU 7 7.791 4.432 -10.395
42 HB2 GLU 7 2HB GLU 7 6.692 5.043 -8.183
43 HB3 GLU 7 3HB GLU 7 8.105 6.037 -7.862
44 HG2 GLU 7 2HG GLU 7 7.496 7.627 -9.338
45 HG3 GLU 7 3HG GLU 7 6.780 6.469 -10.458
46 HNA MK8 8 H MK8 8 10.628 4.655 -8.240
47 HB MK8 8 2HB MK8 8 12.554 5.535 -7.293
48 HBA MK8 8 3HB MK8 8 13.913 6.057 -8.279
49 HD MK8 8 2HD MK8 8 13.635 9.359 -6.694
50 HDA MK8 8 3HD MK8 8 14.553 7.839 -6.672
51 HE MK8 8 HE MK8 8 14.314 8.492 -9.599
52 HG MK8 8 2HG MK8 8 12.076 8.271 -8.403
53 HGA MK8 8 3HG MK8 8 11.929 7.687 -6.747
54 HB1 MK8 8 HBA MK8 8 11.706 7.071 -11.230
55 HB1A MK8 8 HGA MK8 8 11.066 7.756 -10.059
56 HB1B MK8 8 HDA MK8 8 12.549 7.849 -10.264
57 H LEU 9 H LEU 9 11.299 3.595 -9.721
58 HA LEU 9 HA LEU 9 13.706 2.588 -10.994
59 HB2 LEU 9 2HB LEU 9 12.499 1.306 -9.243
60 HB3 LEU 9 3HB LEU 9 11.136 1.151 -10.349
61 HG LEU 9 HG LEU 9 13.369 0.177 -11.742
62 HD11 LEU 9 1HD1 LEU 9 14.497 -1.289 -10.368
63 HD12 LEU 9 2HD1 LEU 9 13.235 -1.276 -9.137
64 HD13 LEU 9 3HD1 LEU 9 14.305 0.114 -9.317
65 HD21 LEU 9 3HD2 LEU 9 11.537 -1.704 -10.368
66 HD22 LEU 9 1HD2 LEU 9 12.028 -1.627 -12.061
67 HD23 LEU 9 2HD2 LEU 9 10.813 -0.508 -11.444
68 H TYR 10 H TYR 10 10.978 4.137 -12.026
69 HA TYR 10 HA TYR 10 11.166 2.890 -14.689
70 HB2 TYR 10 2HB TYR 10 8.837 3.312 -12.999
71 HB3 TYR 10 3HB TYR 10 8.650 4.074 -14.574
72 HD1 TYR 10 HD1 TYR 10 8.614 2.724 -16.613
73 HD2 TYR 10 HD2 TYR 10 8.937 0.909 -12.779
74 HE1 TYR 10 HE1 TYR 10 8.030 0.549 -17.601
75 HE2 TYR 10 HE2 TYR 10 8.355 -1.272 -13.756
76 HH TYR 10 HH TYR 10 8.063 -1.716 -17.218
77 H ARG 11 H ARG 11 11.271 5.727 -12.794
78 HA ARG 11 HA ARG 11 11.125 7.438 -15.179
79 HB2 ARG 11 2HB ARG 11 9.916 7.753 -12.742
80 HB3 ARG 11 3HB ARG 11 11.355 8.747 -12.559
81 HG2 ARG 11 2HG ARG 11 10.203 9.293 -15.101
82 HG3 ARG 11 3HG ARG 11 8.938 9.379 -13.873
83 HD2 ARG 11 2HD ARG 11 9.907 11.147 -12.800
84 HD3 ARG 11 3HD ARG 11 11.539 10.683 -13.282
85 HE ARG 11 HE ARG 11 11.325 12.063 -15.079
86 HH11 ARG 11 1HH1 ARG 11 8.140 11.195 -13.973
87 HH12 ARG 11 2HH1 ARG 11 7.325 12.229 -15.099
88 HH21 ARG 11 1HH2 ARG 11 10.264 13.427 -16.567
89 HH22 ARG 11 2HH2 ARG 11 8.534 13.497 -16.575
90 HNA MK8 12 H MK8 12 13.217 6.531 -12.396
91 HB MK8 12 2HB MK8 12 14.855 7.004 -10.809
92 HBA MK8 12 3HB MK8 12 16.063 5.967 -11.556
93 HD MK8 12 2HD MK8 12 16.463 7.073 -9.069
94 HDA MK8 12 3HD MK8 12 18.119 7.659 -9.319
95 HE MK8 12 HE MK8 12 17.210 9.427 -7.945
96 HG MK8 12 2HG MK8 12 17.766 7.716 -11.509
97 HGA MK8 12 3HG MK8 12 16.573 9.000 -11.326
98 HB1 MK8 12 HBA MK8 12 15.139 9.588 -12.611
99 HB1A MK8 12 HGA MK8 12 16.423 9.183 -13.270
100 HB1B MK8 12 HDA MK8 12 15.167 9.298 -14.082
101 H ALA 13 H ALA 13 14.195 5.367 -13.848
102 HA ALA 13 HA ALA 13 16.466 4.279 -15.189
103 HB1 ALA 13 3HB ALA 13 15.162 2.430 -15.619
104 HB2 ALA 13 1HB ALA 13 14.379 3.086 -14.181
105 HB3 ALA 13 2HB ALA 13 13.682 3.375 -15.775
106 H TYR 14 H TYR 14 13.320 5.394 -16.461
107 HA TYR 14 HA TYR 14 13.931 5.310 -19.150
108 HB2 TYR 14 2HB TYR 14 11.735 6.001 -17.775
109 HB3 TYR 14 3HB TYR 14 12.289 7.609 -18.229
110 HD1 TYR 14 HD1 TYR 14 11.794 4.256 -19.816
111 HD2 TYR 14 HD2 TYR 14 11.468 8.481 -20.197
112 HE1 TYR 14 HE1 TYR 14 10.777 3.972 -22.037
113 HE2 TYR 14 HE2 TYR 14 10.449 8.208 -22.419
114 HH TYR 14 HH TYR 14 9.034 5.806 -23.511
115 H THR 15 H THR 15 14.964 7.580 -16.750
116 HA THR 15 HA THR 15 15.799 9.600 -18.627
117 HB THR 15 HB THR 15 16.349 9.267 -15.674
118 HG1 THR 15 HG1 THR 15 14.913 11.183 -15.688
119 HG21 THR 15 1HG2 THR 15 18.185 10.509 -16.537
120 HG22 THR 15 2HG2 THR 15 17.071 11.683 -15.837
121 HG23 THR 15 3HG2 THR 15 17.134 11.461 -17.585
122 H MET 16 H MET 16 17.260 6.896 -16.942
123 HA MET 16 HA MET 16 19.952 7.620 -17.663
124 HB2 MET 16 2HB MET 16 18.849 5.972 -15.756
125 HB3 MET 16 3HB MET 16 19.484 4.824 -16.926
126 HG2 MET 16 2HG MET 16 21.669 5.513 -16.616
127 HG3 MET 16 3HG MET 16 21.188 7.070 -15.946
128 HE1 MET 16 3HE MET 16 22.920 6.885 -14.480
129 HE2 MET 16 1HE MET 16 22.095 7.016 -12.927
130 HE3 MET 16 2HE MET 16 23.206 5.680 -13.224
131 H VAL 17 H VAL 17 17.355 6.103 -19.223
132 HA VAL 17 HA VAL 17 18.934 4.406 -20.943
133 HB VAL 17 HB VAL 17 16.069 5.222 -21.393
134 HG11 VAL 17 1HG1 VAL 17 16.635 4.052 -23.262
135 HG12 VAL 17 2HG1 VAL 17 17.892 3.127 -22.438
136 HG13 VAL 17 3HG1 VAL 17 16.194 2.702 -22.216
137 HG21 VAL 17 3HG2 VAL 17 15.567 4.270 -19.437
138 HG22 VAL 17 1HG2 VAL 17 16.019 2.738 -20.185
139 HG23 VAL 17 2HG2 VAL 17 17.202 3.639 -19.237
140 H LEU 18 H LEU 18 17.271 7.517 -21.194
141 HA LEU 18 HA LEU 18 17.730 7.920 -23.949
142 HB2 LEU 18 2HB LEU 18 17.508 10.113 -21.910
143 HB3 LEU 18 3HB LEU 18 17.029 10.145 -23.605
144 HG LEU 18 HG LEU 18 15.610 8.173 -21.944
145 HD11 LEU 18 1HD1 LEU 18 14.328 9.640 -20.683
146 HD12 LEU 18 2HD1 LEU 18 14.837 11.046 -21.618
147 HD13 LEU 18 3HD1 LEU 18 15.963 10.277 -20.500
148 HD21 LEU 18 3HD2 LEU 18 15.173 8.795 -24.363
149 HD22 LEU 18 1HD2 LEU 18 14.527 10.318 -23.751
150 HD23 LEU 18 2HD2 LEU 18 13.775 8.791 -23.288
151 H HIS 19 H HIS 19 19.629 8.631 -21.080
152 HA HIS 19 HA HIS 19 21.638 10.076 -22.586
153 HB2 HIS 19 2HB HIS 19 21.218 10.848 -20.350
154 HB3 HIS 19 3HB HIS 19 21.471 9.235 -19.689
155 HD1 HIS 19 HD1 HIS 19 23.825 10.736 -22.199
156 HD2 HIS 19 HD2 HIS 19 23.634 9.983 -18.118
157 HE1 HIS 19 HE1 HIS 19 26.147 11.156 -21.328
158 H LYS 20 H LYS 20 21.325 6.953 -20.947
159 HA LYS 20 HA LYS 20 22.639 5.086 -20.951
160 HB2 LYS 20 2HB LYS 20 21.734 5.414 -23.395
161 HB3 LYS 20 3HB LYS 20 23.423 5.731 -23.768
162 HG2 LYS 20 2HG LYS 20 23.465 3.511 -24.118
163 HG3 LYS 20 3HG LYS 20 23.691 3.458 -22.369
164 HD2 LYS 20 2HD LYS 20 21.045 3.233 -23.803
165 HD3 LYS 20 3HD LYS 20 21.960 1.885 -23.122
166 HE2 LYS 20 2HE LYS 20 20.917 4.235 -21.544
167 HE3 LYS 20 3HE LYS 20 20.117 2.668 -21.661
168 HZ1 LYS 20 3HZ LYS 20 21.396 1.918 -20.037
169 HZ2 LYS 20 1HZ LYS 20 22.125 3.438 -19.890
170 HZ3 LYS 20 2HZ LYS 20 22.796 2.273 -20.917
Start of MODEL 9
1 H1 ASN 1 H ASN 1 2.496 -2.582 -4.960
2 HA ASN 1 HA ASN 1 3.836 -2.098 -2.578
3 HB2 ASN 1 2HB ASN 1 4.301 -1.608 -5.408
4 HB3 ASN 1 3HB ASN 1 4.991 -0.339 -4.401
5 HD21 ASN 1 1HD2 ASN 1 7.098 -0.894 -4.758
6 HD22 ASN 1 2HD2 ASN 1 7.808 -2.352 -4.160
7 H SER 2 H SER 2 4.747 0.089 -1.923
8 HA SER 2 HA SER 2 2.595 1.766 -1.151
9 HB2 SER 2 2HB SER 2 4.990 3.202 -0.787
10 HB3 SER 2 3HB SER 2 4.120 2.251 0.417
11 HG SER 2 HG SER 2 6.265 1.462 -1.242
12 H GLY 3 H GLY 3 5.481 2.590 -3.091
13 HA2 GLY 3 2HA GLY 3 4.772 3.542 -5.373
14 HA3 GLY 3 3HA GLY 3 3.881 4.695 -4.390
15 H LEU 4 H LEU 4 7.137 3.341 -3.960
16 HA LEU 4 HA LEU 4 8.276 5.994 -4.451
17 HB2 LEU 4 2HB LEU 4 8.505 4.386 -1.935
18 HB3 LEU 4 3HB LEU 4 9.783 5.503 -2.410
19 HG LEU 4 HG LEU 4 6.925 6.380 -2.075
20 HD11 LEU 4 1HD1 LEU 4 9.021 6.726 0.033
21 HD12 LEU 4 2HD1 LEU 4 7.996 5.291 -0.002
22 HD13 LEU 4 3HD1 LEU 4 7.270 6.890 0.163
23 HD21 LEU 4 3HD2 LEU 4 9.511 7.919 -1.914
24 HD22 LEU 4 1HD2 LEU 4 7.873 8.573 -1.910
25 HD23 LEU 4 2HD2 LEU 4 8.512 7.803 -3.363
26 H SER 5 H SER 5 8.864 2.557 -3.853
27 HA SER 5 HA SER 5 11.482 2.721 -5.118
28 HB2 SER 5 2HB SER 5 9.996 0.477 -3.747
29 HB3 SER 5 3HB SER 5 11.537 0.238 -4.571
30 HG SER 5 HG SER 5 11.134 1.109 -2.112
31 H PHE 6 H PHE 6 8.447 2.606 -6.239
32 HA PHE 6 HA PHE 6 9.161 0.881 -8.519
33 HB2 PHE 6 2HB PHE 6 6.807 0.925 -6.854
34 HB3 PHE 6 3HB PHE 6 6.372 1.266 -8.526
35 HD1 PHE 6 HD1 PHE 6 8.820 -1.017 -6.871
36 HD2 PHE 6 HD2 PHE 6 5.581 -0.592 -9.599
37 HE1 PHE 6 HE1 PHE 6 8.945 -3.419 -7.387
38 HE2 PHE 6 HE2 PHE 6 5.700 -2.994 -10.119
39 HZ PHE 6 HZ PHE 6 7.382 -4.411 -9.012
40 H GLU 7 H GLU 7 8.747 4.019 -7.558
41 HA GLU 7 HA GLU 7 7.777 4.908 -10.185
42 HB2 GLU 7 2HB GLU 7 6.843 5.703 -7.839
43 HB3 GLU 7 3HB GLU 7 8.212 6.803 -7.920
44 HG2 GLU 7 2HG GLU 7 6.466 6.633 -10.303
45 HG3 GLU 7 3HG GLU 7 5.815 7.425 -8.869
46 HNA MK8 8 H MK8 8 10.573 5.011 -7.972
47 HB MK8 8 2HB MK8 8 12.549 5.789 -7.018
48 HBA MK8 8 3HB MK8 8 13.961 6.169 -7.994
49 HD MK8 8 2HD MK8 8 13.875 9.577 -6.629
50 HDA MK8 8 3HD MK8 8 14.694 8.009 -6.490
51 HE MK8 8 HE MK8 8 14.608 8.368 -9.430
52 HG MK8 8 2HG MK8 8 12.258 8.484 -8.268
53 HGA MK8 8 3HG MK8 8 12.074 8.001 -6.584
54 HB1 MK8 8 HBA MK8 8 11.946 7.156 -11.062
55 HB1A MK8 8 HGA MK8 8 11.288 7.945 -9.970
56 HB1B MK8 8 HDA MK8 8 12.783 7.938 -10.093
57 H LEU 9 H LEU 9 11.181 3.829 -9.381
58 HA LEU 9 HA LEU 9 13.532 2.550 -10.503
59 HB2 LEU 9 2HB LEU 9 12.195 1.455 -8.744
60 HB3 LEU 9 3HB LEU 9 10.823 1.400 -9.849
61 HG LEU 9 HG LEU 9 13.016 0.143 -11.136
62 HD11 LEU 9 1HD1 LEU 9 13.749 -0.016 -8.655
63 HD12 LEU 9 2HD1 LEU 9 13.801 -1.458 -9.668
64 HD13 LEU 9 3HD1 LEU 9 12.470 -1.224 -8.536
65 HD21 LEU 9 3HD2 LEU 9 10.725 -1.309 -9.875
66 HD22 LEU 9 1HD2 LEU 9 11.508 -1.587 -11.431
67 HD23 LEU 9 2HD2 LEU 9 10.448 -0.194 -11.215
68 H TYR 10 H TYR 10 10.979 4.261 -11.720
69 HA TYR 10 HA TYR 10 11.172 2.873 -14.311
70 HB2 TYR 10 2HB TYR 10 8.865 3.149 -12.759
71 HB3 TYR 10 3HB TYR 10 8.709 4.374 -14.012
72 HD1 TYR 10 HD2 TYR 10 9.615 3.328 -16.422
73 HD2 TYR 10 HD1 TYR 10 7.751 1.199 -13.245
74 HE1 TYR 10 HE2 TYR 10 8.876 1.608 -18.017
75 HE2 TYR 10 HE1 TYR 10 7.007 -0.528 -14.831
76 HH TYR 10 HH TYR 10 6.844 -0.150 -18.018
77 H ARG 11 H ARG 11 11.442 5.767 -12.544
78 HA ARG 11 HA ARG 11 11.457 7.385 -14.999
79 HB2 ARG 11 2HB ARG 11 10.417 7.864 -12.410
80 HB3 ARG 11 3HB ARG 11 11.775 8.960 -12.624
81 HG2 ARG 11 2HG ARG 11 9.788 10.072 -13.332
82 HG3 ARG 11 3HG ARG 11 10.757 9.711 -14.762
83 HD2 ARG 11 2HD ARG 11 9.362 7.798 -15.264
84 HD3 ARG 11 3HD ARG 11 8.441 8.047 -13.781
85 HE ARG 11 HE ARG 11 7.211 9.623 -14.877
86 HH11 ARG 11 1HH1 ARG 11 10.204 9.155 -16.594
87 HH12 ARG 11 2HH1 ARG 11 9.760 10.187 -17.913
88 HH21 ARG 11 1HH2 ARG 11 6.615 10.984 -16.608
89 HH22 ARG 11 2HH2 ARG 11 7.719 11.228 -17.920
90 HNA MK8 12 H MK8 12 13.433 6.425 -12.153
91 HB MK8 12 2HB MK8 12 15.160 6.815 -10.540
92 HBA MK8 12 3HB MK8 12 16.063 5.533 -11.335
93 HD MK8 12 2HD MK8 12 16.800 7.226 -8.735
94 HDA MK8 12 3HD MK8 12 18.246 8.177 -9.127
95 HE MK8 12 HE MK8 12 16.934 10.069 -9.111
96 HG MK8 12 2HG MK8 12 18.076 6.557 -10.829
97 HGA MK8 12 3HG MK8 12 17.572 8.054 -11.610
98 HB1 MK8 12 HBA MK8 12 16.002 9.192 -12.092
99 HB1A MK8 12 HGA MK8 12 16.693 8.826 -13.372
100 HB1B MK8 12 HDA MK8 12 15.249 9.230 -13.389
101 H ALA 13 H ALA 13 14.394 5.177 -13.661
102 HA ALA 13 HA ALA 13 16.606 4.082 -15.095
103 HB1 ALA 13 3HB ALA 13 14.554 2.713 -16.110
104 HB2 ALA 13 1HB ALA 13 15.224 2.383 -14.513
105 HB3 ALA 13 2HB ALA 13 13.767 3.364 -14.673
106 H TYR 14 H TYR 14 13.447 5.259 -16.274
107 HA TYR 14 HA TYR 14 14.045 5.302 -18.970
108 HB2 TYR 14 2HB TYR 14 11.843 5.887 -17.556
109 HB3 TYR 14 3HB TYR 14 12.364 7.524 -17.937
110 HD1 TYR 14 HD2 TYR 14 11.940 4.241 -19.683
111 HD2 TYR 14 HD1 TYR 14 11.500 8.470 -19.851
112 HE1 TYR 14 HE2 TYR 14 10.919 4.041 -21.912
113 HE2 TYR 14 HE1 TYR 14 10.476 8.281 -22.079
114 HH TYR 14 HH TYR 14 9.227 6.511 -23.387
115 H THR 15 H THR 15 15.099 7.436 -16.474
116 HA THR 15 HA THR 15 15.871 9.571 -18.257
117 HB THR 15 HB THR 15 16.460 9.114 -15.328
118 HG1 THR 15 HG1 THR 15 14.830 10.586 -15.014
119 HG21 THR 15 1HG2 THR 15 17.312 11.260 -17.224
120 HG22 THR 15 2HG2 THR 15 18.215 10.491 -15.919
121 HG23 THR 15 3HG2 THR 15 16.964 11.677 -15.547
122 H MET 16 H MET 16 17.382 6.816 -16.707
123 HA MET 16 HA MET 16 20.059 7.614 -17.398
124 HB2 MET 16 2HB MET 16 20.774 5.725 -16.266
125 HB3 MET 16 3HB MET 16 19.257 6.077 -15.449
126 HG2 MET 16 2HG MET 16 18.745 3.949 -15.816
127 HG3 MET 16 3HG MET 16 18.470 4.428 -17.489
128 HE1 MET 16 3HE MET 16 20.315 0.917 -17.581
129 HE2 MET 16 1HE MET 16 18.962 1.566 -16.654
130 HE3 MET 16 2HE MET 16 19.037 1.820 -18.397
131 H VAL 17 H VAL 17 17.481 6.120 -19.021
132 HA VAL 17 HA VAL 17 19.080 4.547 -20.834
133 HB VAL 17 HB VAL 17 16.205 5.347 -21.247
134 HG11 VAL 17 1HG1 VAL 17 17.900 3.992 -22.877
135 HG12 VAL 17 2HG1 VAL 17 17.161 2.668 -21.973
136 HG13 VAL 17 3HG1 VAL 17 16.147 3.798 -22.873
137 HG21 VAL 17 3HG2 VAL 17 17.351 3.682 -19.160
138 HG22 VAL 17 1HG2 VAL 17 15.711 4.305 -19.337
139 HG23 VAL 17 2HG2 VAL 17 16.179 2.812 -20.150
140 H LEU 18 H LEU 18 17.351 7.634 -20.936
141 HA LEU 18 HA LEU 18 17.776 8.198 -23.656
142 HB2 LEU 18 2HB LEU 18 17.617 10.270 -21.487
143 HB3 LEU 18 3HB LEU 18 17.111 10.412 -23.169
144 HG LEU 18 HG LEU 18 15.700 8.356 -21.604
145 HD11 LEU 18 1HD1 LEU 18 14.934 11.203 -21.107
146 HD12 LEU 18 2HD1 LEU 18 16.099 10.392 -20.061
147 HD13 LEU 18 3HD1 LEU 18 14.466 9.747 -20.227
148 HD21 LEU 18 3HD2 LEU 18 14.576 10.605 -23.244
149 HD22 LEU 18 1HD2 LEU 18 13.867 9.027 -22.900
150 HD23 LEU 18 2HD2 LEU 18 15.251 9.154 -23.987
151 H HIS 19 H HIS 19 19.741 8.774 -20.795
152 HA HIS 19 HA HIS 19 21.724 10.278 -22.267
153 HB2 HIS 19 2HB HIS 19 21.337 10.888 -19.960
154 HB3 HIS 19 3HB HIS 19 21.669 9.243 -19.427
155 HD1 HIS 19 HD1 HIS 19 23.505 10.403 -17.874
156 HD2 HIS 19 HD2 HIS 19 24.236 10.544 -21.961
157 HE1 HIS 19 HE1 HIS 19 25.940 10.990 -18.101
158 H LYS 20 H LYS 20 21.479 7.078 -20.759
159 HA LYS 20 HA LYS 20 22.773 5.206 -20.927
160 HB2 LYS 20 2HB LYS 20 21.792 5.673 -23.320
161 HB3 LYS 20 3HB LYS 20 23.470 6.003 -23.727
162 HG2 LYS 20 2HG LYS 20 23.487 3.806 -24.201
163 HG3 LYS 20 3HG LYS 20 23.771 3.656 -22.465
164 HD2 LYS 20 2HD LYS 20 21.076 3.522 -23.819
165 HD3 LYS 20 3HD LYS 20 22.006 2.134 -23.250
166 HE2 LYS 20 2HE LYS 20 21.034 4.392 -21.502
167 HE3 LYS 20 3HE LYS 20 20.219 2.839 -21.682
168 HZ1 LYS 20 3HZ LYS 20 22.934 2.417 -21.052
169 HZ2 LYS 20 1HZ LYS 20 21.560 1.966 -20.174
170 HZ3 LYS 20 2HZ LYS 20 22.264 3.483 -19.922
Start of MODEL 10
1 H1 ASN 1 H ASN 1 5.866 -4.802 -4.393
2 HA ASN 1 HA ASN 1 5.977 -2.323 -5.138
3 HB2 ASN 1 2HB ASN 1 3.660 -2.356 -5.968
4 HB3 ASN 1 3HB ASN 1 4.457 -3.905 -6.226
5 HD21 ASN 1 1HD2 ASN 1 1.838 -2.279 -4.806
6 HD22 ASN 1 2HD2 ASN 1 1.118 -3.636 -4.014
7 H SER 2 H SER 2 5.619 -0.300 -4.462
8 HA SER 2 HA SER 2 3.762 0.158 -2.240
9 HB2 SER 2 2HB SER 2 6.347 -0.031 -1.637
10 HB3 SER 2 3HB SER 2 6.350 1.643 -2.190
11 HG SER 2 HG SER 2 4.672 2.046 -0.668
12 H GLY 3 H GLY 3 6.083 1.966 -4.269
13 HA2 GLY 3 2HA GLY 3 4.609 3.277 -6.027
14 HA3 GLY 3 3HA GLY 3 4.111 4.103 -4.558
15 H LEU 4 H LEU 4 6.543 4.182 -3.195
16 HA LEU 4 HA LEU 4 7.810 6.365 -4.576
17 HB2 LEU 4 2HB LEU 4 7.438 5.703 -1.944
18 HB3 LEU 4 3HB LEU 4 9.145 5.337 -2.186
19 HG LEU 4 HG LEU 4 7.802 8.002 -2.635
20 HD11 LEU 4 1HD1 LEU 4 9.728 7.021 -0.536
21 HD12 LEU 4 2HD1 LEU 4 8.059 7.536 -0.294
22 HD13 LEU 4 3HD1 LEU 4 9.282 8.711 -0.776
23 HD21 LEU 4 3HD2 LEU 4 9.608 7.564 -4.251
24 HD22 LEU 4 1HD2 LEU 4 10.709 7.246 -2.911
25 HD23 LEU 4 2HD2 LEU 4 10.016 8.855 -3.120
26 H SER 5 H SER 5 8.541 3.014 -3.875
27 HA SER 5 HA SER 5 11.215 3.292 -5.030
28 HB2 SER 5 2HB SER 5 9.853 1.063 -3.517
29 HB3 SER 5 3HB SER 5 11.403 0.843 -4.328
30 HG SER 5 HG SER 5 12.161 1.578 -2.504
31 H PHE 6 H PHE 6 8.249 2.957 -6.225
32 HA PHE 6 HA PHE 6 9.077 1.064 -8.326
33 HB2 PHE 6 2HB PHE 6 6.826 0.938 -6.723
34 HB3 PHE 6 3HB PHE 6 6.219 1.655 -8.212
35 HD1 PHE 6 HD1 PHE 6 7.803 -1.302 -6.727
36 HD2 PHE 6 HD2 PHE 6 6.103 0.396 -10.241
37 HE1 PHE 6 HE1 PHE 6 7.724 -3.532 -7.762
38 HE2 PHE 6 HE2 PHE 6 6.021 -1.832 -11.281
39 HZ PHE 6 HZ PHE 6 6.831 -3.800 -10.042
40 H GLU 7 H GLU 7 8.231 4.279 -7.603
41 HA GLU 7 HA GLU 7 7.510 4.922 -10.356
42 HB2 GLU 7 2HB GLU 7 6.321 5.900 -8.327
43 HB3 GLU 7 3HB GLU 7 7.775 6.850 -8.053
44 HG2 GLU 7 2HG GLU 7 6.947 7.115 -10.780
45 HG3 GLU 7 3HG GLU 7 5.596 7.466 -9.703
46 HNA MK8 8 H MK8 8 10.236 5.206 -8.089
47 HB MK8 8 2HB MK8 8 12.202 6.003 -7.140
48 HBA MK8 8 3HB MK8 8 13.625 6.365 -8.107
49 HD MK8 8 2HD MK8 8 13.495 9.826 -6.885
50 HDA MK8 8 3HD MK8 8 14.324 8.273 -6.660
51 HE MK8 8 HE MK8 8 14.289 8.469 -9.607
52 HG MK8 8 2HG MK8 8 11.896 8.653 -8.474
53 HGA MK8 8 3HG MK8 8 11.713 8.223 -6.775
54 HB1 MK8 8 HBA MK8 8 11.670 7.232 -11.238
55 HB1A MK8 8 HGA MK8 8 10.970 8.048 -10.192
56 HB1B MK8 8 HDA MK8 8 12.467 8.058 -10.272
57 H LEU 9 H LEU 9 10.887 3.956 -9.436
58 HA LEU 9 HA LEU 9 13.259 2.654 -10.482
59 HB2 LEU 9 2HB LEU 9 11.050 1.876 -8.911
60 HB3 LEU 9 3HB LEU 9 10.973 0.935 -10.399
61 HG LEU 9 HG LEU 9 13.217 1.007 -8.388
62 HD11 LEU 9 1HD1 LEU 9 12.226 -0.775 -7.523
63 HD12 LEU 9 2HD1 LEU 9 12.305 -1.593 -9.084
64 HD13 LEU 9 3HD1 LEU 9 10.904 -0.602 -8.678
65 HD21 LEU 9 3HD2 LEU 9 13.106 -0.098 -11.174
66 HD22 LEU 9 1HD2 LEU 9 14.157 -0.804 -9.945
67 HD23 LEU 9 2HD2 LEU 9 14.361 0.884 -10.416
68 H TYR 10 H TYR 10 10.705 4.296 -11.795
69 HA TYR 10 HA TYR 10 10.948 2.816 -14.330
70 HB2 TYR 10 2HB TYR 10 8.556 3.555 -12.823
71 HB3 TYR 10 3HB TYR 10 8.508 4.108 -14.493
72 HD1 TYR 10 HD2 TYR 10 8.813 1.124 -12.337
73 HD2 TYR 10 HD1 TYR 10 8.195 2.578 -16.287
74 HE1 TYR 10 HE2 TYR 10 8.159 -1.134 -13.059
75 HE2 TYR 10 HE1 TYR 10 7.538 0.324 -17.020
76 HH TYR 10 HH TYR 10 8.217 -2.281 -15.793
77 H ARG 11 H ARG 11 11.178 5.775 -12.670
78 HA ARG 11 HA ARG 11 11.214 7.302 -15.182
79 HB2 ARG 11 2HB ARG 11 10.160 7.871 -12.610
80 HB3 ARG 11 3HB ARG 11 11.501 8.976 -12.879
81 HG2 ARG 11 2HG ARG 11 9.530 8.632 -15.069
82 HG3 ARG 11 3HG ARG 11 9.040 9.548 -13.641
83 HD2 ARG 11 2HD ARG 11 11.592 10.109 -15.128
84 HD3 ARG 11 3HD ARG 11 10.060 10.867 -15.560
85 HE ARG 11 HE ARG 11 10.294 11.368 -12.904
86 HH11 ARG 11 1HH1 ARG 11 12.368 11.886 -15.652
87 HH12 ARG 11 2HH1 ARG 11 13.124 13.293 -14.981
88 HH21 ARG 11 1HH2 ARG 11 11.282 13.219 -12.010
89 HH22 ARG 11 2HH2 ARG 11 12.506 14.050 -12.909
90 HNA MK8 12 H MK8 12 13.163 6.458 -12.280
91 HB MK8 12 2HB MK8 12 14.869 6.907 -10.667
92 HBA MK8 12 3HB MK8 12 15.797 5.608 -11.406
93 HD MK8 12 2HD MK8 12 16.465 7.407 -8.859
94 HDA MK8 12 3HD MK8 12 17.921 8.342 -9.257
95 HE MK8 12 HE MK8 12 16.607 10.235 -9.331
96 HG MK8 12 2HG MK8 12 17.790 6.672 -10.906
97 HGA MK8 12 3HG MK8 12 17.283 8.134 -11.749
98 HB1 MK8 12 HBA MK8 12 15.717 9.237 -12.295
99 HB1A MK8 12 HGA MK8 12 16.429 8.827 -13.550
100 HB1B MK8 12 HDA MK8 12 14.983 9.222 -13.603
101 H ALA 13 H ALA 13 14.153 5.152 -13.723
102 HA ALA 13 HA ALA 13 16.383 4.015 -15.092
103 HB1 ALA 13 3HB ALA 13 14.288 2.861 -14.066
104 HB2 ALA 13 1HB ALA 13 13.566 3.187 -15.642
105 HB3 ALA 13 2HB ALA 13 15.024 2.201 -15.527
106 H TYR 14 H TYR 14 13.240 5.151 -16.353
107 HA TYR 14 HA TYR 14 13.861 5.089 -19.040
108 HB2 TYR 14 2HB TYR 14 11.770 6.154 -17.417
109 HB3 TYR 14 3HB TYR 14 12.226 7.378 -18.597
110 HD1 TYR 14 HD1 TYR 14 12.573 6.360 -21.065
111 HD2 TYR 14 HD2 TYR 14 10.106 4.687 -18.029
112 HE1 TYR 14 HE1 TYR 14 11.255 5.197 -22.786
113 HE2 TYR 14 HE2 TYR 14 8.782 3.519 -19.741
114 HH TYR 14 HH TYR 14 9.484 3.921 -23.198
115 H THR 15 H THR 15 14.851 7.362 -16.620
116 HA THR 15 HA THR 15 15.687 9.393 -18.484
117 HB THR 15 HB THR 15 16.212 9.059 -15.527
118 HG1 THR 15 HG1 THR 15 14.271 9.892 -15.465
119 HG21 THR 15 1HG2 THR 15 17.095 11.161 -17.476
120 HG22 THR 15 2HG2 THR 15 18.026 10.351 -16.216
121 HG23 THR 15 3HG2 THR 15 16.820 11.561 -15.781
122 H MET 16 H MET 16 17.152 6.693 -16.803
123 HA MET 16 HA MET 16 19.847 7.446 -17.478
124 HB2 MET 16 2HB MET 16 18.941 5.952 -15.503
125 HB3 MET 16 3HB MET 16 19.105 4.661 -16.686
126 HG2 MET 16 2HG MET 16 21.150 4.538 -15.720
127 HG3 MET 16 3HG MET 16 21.503 5.714 -16.985
128 HE1 MET 16 3HE MET 16 20.196 5.347 -13.359
129 HE2 MET 16 1HE MET 16 21.921 4.994 -13.255
130 HE3 MET 16 2HE MET 16 21.268 6.434 -12.474
131 H VAL 17 H VAL 17 17.285 5.915 -19.090
132 HA VAL 17 HA VAL 17 18.908 4.267 -20.816
133 HB VAL 17 HB VAL 17 16.037 5.043 -21.295
134 HG11 VAL 17 1HG1 VAL 17 17.850 2.847 -22.220
135 HG12 VAL 17 2HG1 VAL 17 16.099 2.625 -22.213
136 HG13 VAL 17 3HG1 VAL 17 16.821 3.919 -23.169
137 HG21 VAL 17 3HG2 VAL 17 15.994 2.557 -20.096
138 HG22 VAL 17 1HG2 VAL 17 17.161 3.462 -19.131
139 HG23 VAL 17 2HG2 VAL 17 15.525 4.082 -19.345
140 H LEU 18 H LEU 18 17.192 7.352 -21.044
141 HA LEU 18 HA LEU 18 17.652 7.807 -23.785
142 HB2 LEU 18 2HB LEU 18 17.429 9.960 -21.702
143 HB3 LEU 18 3HB LEU 18 16.957 10.031 -23.398
144 HG LEU 18 HG LEU 18 15.532 8.021 -21.790
145 HD11 LEU 18 1HD1 LEU 18 15.895 10.140 -20.327
146 HD12 LEU 18 2HD1 LEU 18 14.286 9.430 -20.460
147 HD13 LEU 18 3HD1 LEU 18 14.699 10.862 -21.404
148 HD21 LEU 18 3HD2 LEU 18 15.104 8.701 -24.195
149 HD22 LEU 18 1HD2 LEU 18 14.457 10.209 -23.550
150 HD23 LEU 18 2HD2 LEU 18 13.701 8.673 -23.125
151 H HIS 19 H HIS 19 19.558 8.495 -20.912
152 HA HIS 19 HA HIS 19 21.561 9.954 -22.412
153 HB2 HIS 19 2HB HIS 19 21.110 10.688 -20.153
154 HB3 HIS 19 3HB HIS 19 21.439 9.078 -19.520
155 HD1 HIS 19 HD1 HIS 19 23.631 10.896 -22.003
156 HD2 HIS 19 HD2 HIS 19 23.655 9.699 -18.024
157 HE1 HIS 19 HE1 HIS 19 25.963 11.348 -21.179
158 H LYS 20 H LYS 20 21.199 6.794 -20.884
159 HA LYS 20 HA LYS 20 22.504 4.919 -20.907
160 HB2 LYS 20 2HB LYS 20 21.673 5.286 -23.344
161 HB3 LYS 20 3HB LYS 20 23.346 5.711 -23.678
162 HG2 LYS 20 2HG LYS 20 22.828 3.359 -24.182
163 HG3 LYS 20 3HG LYS 20 24.093 3.538 -22.964
164 HD2 LYS 20 2HD LYS 20 22.342 1.777 -22.490
165 HD3 LYS 20 3HD LYS 20 22.613 2.960 -21.208
166 HE2 LYS 20 2HE LYS 20 20.211 2.461 -21.651
167 HE3 LYS 20 3HE LYS 20 20.637 4.164 -21.811
168 HZ1 LYS 20 3HZ LYS 20 19.324 2.653 -23.664
169 HZ2 LYS 20 1HZ LYS 20 20.898 2.746 -24.278
170 HZ3 LYS 20 2HZ LYS 20 20.038 4.162 -23.937
Start of MODEL 11
1 H1 ASN 1 H ASN 1 0.015 -0.486 -1.890
2 HA ASN 1 HA ASN 1 1.863 0.971 -0.194
3 HB2 ASN 1 2HB ASN 1 2.182 -0.538 -2.788
4 HB3 ASN 1 3HB ASN 1 3.496 0.384 -2.064
5 HD21 ASN 1 1HD2 ASN 1 4.849 -0.844 -0.997
6 HD22 ASN 1 2HD2 ASN 1 4.449 -2.249 -0.075
7 H SER 2 H SER 2 3.451 2.455 -1.498
8 HA SER 2 HA SER 2 1.770 4.478 -2.789
9 HB2 SER 2 2HB SER 2 3.480 4.819 -0.764
10 HB3 SER 2 3HB SER 2 4.613 5.041 -2.096
11 HG SER 2 HG SER 2 3.305 6.702 -2.876
12 H GLY 3 H GLY 3 4.705 2.581 -3.284
13 HA2 GLY 3 2HA GLY 3 5.312 1.775 -5.449
14 HA3 GLY 3 3HA GLY 3 4.495 3.160 -6.158
15 H LEU 4 H LEU 4 6.715 3.376 -3.451
16 HA LEU 4 HA LEU 4 8.262 5.384 -4.714
17 HB2 LEU 4 2HB LEU 4 7.926 4.475 -2.143
18 HB3 LEU 4 3HB LEU 4 9.573 3.974 -2.520
19 HG LEU 4 HG LEU 4 9.468 6.618 -3.352
20 HD11 LEU 4 1HD1 LEU 4 7.351 6.962 -2.234
21 HD12 LEU 4 2HD1 LEU 4 8.630 7.820 -1.377
22 HD13 LEU 4 3HD1 LEU 4 8.005 6.301 -0.736
23 HD21 LEU 4 3HD2 LEU 4 11.327 5.459 -2.240
24 HD22 LEU 4 1HD2 LEU 4 10.436 5.510 -0.719
25 HD23 LEU 4 2HD2 LEU 4 10.964 7.010 -1.481
26 H SER 5 H SER 5 8.713 1.922 -4.239
27 HA SER 5 HA SER 5 11.320 2.002 -5.535
28 HB2 SER 5 2HB SER 5 9.731 -0.209 -4.231
29 HB3 SER 5 3HB SER 5 11.232 -0.509 -5.106
30 HG SER 5 HG SER 5 11.830 -0.208 -3.022
31 H PHE 6 H PHE 6 8.289 2.135 -6.630
32 HA PHE 6 HA PHE 6 8.876 0.476 -8.994
33 HB2 PHE 6 2HB PHE 6 6.233 1.086 -7.670
34 HB3 PHE 6 3HB PHE 6 6.355 0.410 -9.291
35 HD1 PHE 6 HD1 PHE 6 7.419 -1.828 -9.603
36 HD2 PHE 6 HD2 PHE 6 6.466 -0.266 -5.760
37 HE1 PHE 6 HE1 PHE 6 7.569 -4.091 -8.649
38 HE2 PHE 6 HE2 PHE 6 6.616 -2.526 -4.800
39 HZ PHE 6 HZ PHE 6 7.169 -4.442 -6.244
40 H GLU 7 H GLU 7 8.741 3.566 -7.911
41 HA GLU 7 HA GLU 7 7.753 4.634 -10.468
42 HB2 GLU 7 2HB GLU 7 7.277 6.680 -9.369
43 HB3 GLU 7 3HB GLU 7 6.681 5.409 -8.310
44 HG2 GLU 7 2HG GLU 7 8.974 5.627 -7.145
45 HG3 GLU 7 3HG GLU 7 9.064 7.179 -7.975
46 HNA MK8 8 H MK8 8 10.557 4.492 -8.267
47 HB MK8 8 2HB MK8 8 12.532 5.213 -7.263
48 HBA MK8 8 3HB MK8 8 13.978 5.507 -8.219
49 HD MK8 8 2HD MK8 8 14.096 8.903 -6.830
50 HDA MK8 8 3HD MK8 8 14.816 7.285 -6.710
51 HE MK8 8 HE MK8 8 14.711 7.769 -9.666
52 HG MK8 8 2HG MK8 8 12.428 7.927 -8.500
53 HGA MK8 8 3HG MK8 8 12.198 7.448 -6.820
54 HB1 MK8 8 HBA MK8 8 12.018 6.662 -11.289
55 HB1A MK8 8 HGA MK8 8 11.415 7.465 -10.176
56 HB1B MK8 8 HDA MK8 8 12.906 7.379 -10.316
57 H LEU 9 H LEU 9 11.087 3.362 -9.740
58 HA LEU 9 HA LEU 9 13.397 1.979 -10.826
59 HB2 LEU 9 2HB LEU 9 11.944 0.900 -9.159
60 HB3 LEU 9 3HB LEU 9 10.599 0.986 -10.294
61 HG LEU 9 HG LEU 9 11.767 -0.550 -11.798
62 HD11 LEU 9 1HD1 LEU 9 13.958 -0.838 -11.664
63 HD12 LEU 9 2HD1 LEU 9 13.762 -1.589 -10.080
64 HD13 LEU 9 3HD1 LEU 9 14.014 0.152 -10.205
65 HD21 LEU 9 3HD2 LEU 9 11.431 -2.532 -10.535
66 HD22 LEU 9 1HD2 LEU 9 10.264 -1.347 -9.946
67 HD23 LEU 9 2HD2 LEU 9 11.721 -1.690 -9.011
68 H TYR 10 H TYR 10 10.941 3.851 -12.054
69 HA TYR 10 HA TYR 10 11.202 2.583 -14.699
70 HB2 TYR 10 2HB TYR 10 8.797 3.178 -13.181
71 HB3 TYR 10 3HB TYR 10 8.786 3.972 -14.752
72 HD1 TYR 10 HD1 TYR 10 8.948 0.709 -13.042
73 HD2 TYR 10 HD2 TYR 10 8.535 2.717 -16.770
74 HE1 TYR 10 HE1 TYR 10 8.266 -1.405 -14.098
75 HE2 TYR 10 HE2 TYR 10 7.851 0.609 -17.836
76 HH TYR 10 HH TYR 10 7.888 -2.443 -16.063
77 H ARG 11 H ARG 11 11.493 5.368 -12.786
78 HA ARG 11 HA ARG 11 11.590 7.116 -15.147
79 HB2 ARG 11 2HB ARG 11 10.354 7.511 -12.723
80 HB3 ARG 11 3HB ARG 11 11.867 8.386 -12.520
81 HG2 ARG 11 2HG ARG 11 10.333 9.958 -13.338
82 HG3 ARG 11 3HG ARG 11 11.341 9.525 -14.720
83 HD2 ARG 11 2HD ARG 11 9.278 7.687 -14.806
84 HD3 ARG 11 3HD ARG 11 8.484 9.181 -14.313
85 HE ARG 11 HE ARG 11 10.067 9.907 -16.416
86 HH11 ARG 11 1HH1 ARG 11 7.553 7.551 -15.918
87 HH12 ARG 11 2HH1 ARG 11 7.004 7.598 -17.561
88 HH21 ARG 11 1HH2 ARG 11 9.354 9.977 -18.581
89 HH22 ARG 11 2HH2 ARG 11 8.030 8.978 -19.075
90 HNA MK8 12 H MK8 12 13.502 5.893 -12.371
91 HB MK8 12 2HB MK8 12 15.256 6.165 -10.690
92 HBA MK8 12 3HB MK8 12 16.018 4.860 -11.587
93 HD MK8 12 2HD MK8 12 16.818 6.336 -8.927
94 HDA MK8 12 3HD MK8 12 18.473 6.922 -9.190
95 HE MK8 12 HE MK8 12 17.579 9.064 -8.913
96 HG MK8 12 2HG MK8 12 18.134 5.658 -11.084
97 HGA MK8 12 3HG MK8 12 17.747 7.257 -11.713
98 HB1 MK8 12 HBA MK8 12 15.345 8.777 -13.211
99 HB1A MK8 12 HGA MK8 12 16.246 8.546 -12.033
100 HB1B MK8 12 HDA MK8 12 16.763 8.337 -13.425
101 H ALA 13 H ALA 13 14.447 4.781 -13.992
102 HA ALA 13 HA ALA 13 16.665 3.794 -15.511
103 HB1 ALA 13 3HB ALA 13 14.952 2.286 -16.525
104 HB2 ALA 13 1HB ALA 13 15.028 2.224 -14.764
105 HB3 ALA 13 2HB ALA 13 13.730 3.115 -15.560
106 H TYR 14 H TYR 14 13.493 5.034 -16.588
107 HA TYR 14 HA TYR 14 14.085 5.330 -19.263
108 HB2 TYR 14 2HB TYR 14 11.885 5.779 -17.805
109 HB3 TYR 14 3HB TYR 14 12.404 7.447 -18.024
110 HD1 TYR 14 HD2 TYR 14 11.989 4.351 -20.085
111 HD2 TYR 14 HD1 TYR 14 11.533 8.573 -19.833
112 HE1 TYR 14 HE2 TYR 14 10.968 4.368 -22.323
113 HE2 TYR 14 HE1 TYR 14 10.509 8.602 -22.069
114 HH TYR 14 HH TYR 14 10.749 6.801 -24.226
115 H THR 15 H THR 15 15.032 7.327 -16.583
116 HA THR 15 HA THR 15 15.838 9.573 -18.190
117 HB THR 15 HB THR 15 16.410 8.894 -15.299
118 HG1 THR 15 HG1 THR 15 14.668 10.841 -16.444
119 HG21 THR 15 1HG2 THR 15 17.036 11.377 -16.897
120 HG22 THR 15 2HG2 THR 15 18.178 10.319 -16.069
121 HG23 THR 15 3HG2 THR 15 17.056 11.308 -15.135
122 H MET 16 H MET 16 17.359 6.716 -16.848
123 HA MET 16 HA MET 16 20.036 7.587 -17.439
124 HB2 MET 16 2HB MET 16 18.762 5.200 -16.250
125 HB3 MET 16 3HB MET 16 20.279 4.910 -17.092
126 HG2 MET 16 2HG MET 16 20.219 7.180 -15.203
127 HG3 MET 16 3HG MET 16 20.138 5.561 -14.512
128 HE1 MET 16 3HE MET 16 23.513 6.064 -13.557
129 HE2 MET 16 1HE MET 16 23.304 7.661 -14.276
130 HE3 MET 16 2HE MET 16 21.974 6.912 -13.394
131 H VAL 17 H VAL 17 17.489 6.227 -19.219
132 HA VAL 17 HA VAL 17 19.131 4.833 -21.141
133 HB VAL 17 HB VAL 17 16.242 5.607 -21.506
134 HG11 VAL 17 1HG1 VAL 17 17.166 4.757 -23.505
135 HG12 VAL 17 2HG1 VAL 17 18.025 3.473 -22.653
136 HG13 VAL 17 3HG1 VAL 17 16.267 3.422 -22.786
137 HG21 VAL 17 3HG2 VAL 17 16.259 2.988 -20.630
138 HG22 VAL 17 1HG2 VAL 17 17.413 3.789 -19.564
139 HG23 VAL 17 2HG2 VAL 17 15.763 4.396 -19.691
140 H LEU 18 H LEU 18 17.359 7.890 -20.978
141 HA LEU 18 HA LEU 18 17.793 8.687 -23.644
142 HB2 LEU 18 2HB LEU 18 17.544 10.564 -21.312
143 HB3 LEU 18 3HB LEU 18 17.058 10.832 -22.985
144 HG LEU 18 HG LEU 18 15.682 8.611 -21.637
145 HD11 LEU 18 1HD1 LEU 18 14.448 9.798 -20.106
146 HD12 LEU 18 2HD1 LEU 18 14.784 11.350 -20.872
147 HD13 LEU 18 3HD1 LEU 18 16.034 10.548 -19.920
148 HD21 LEU 18 3HD2 LEU 18 14.537 10.992 -23.069
149 HD22 LEU 18 1HD2 LEU 18 13.835 9.386 -22.867
150 HD23 LEU 18 2HD2 LEU 18 15.225 9.613 -23.929
151 H HIS 19 H HIS 19 19.705 9.047 -20.717
152 HA HIS 19 HA HIS 19 21.670 10.721 -22.031
153 HB2 HIS 19 2HB HIS 19 21.208 11.144 -19.689
154 HB3 HIS 19 3HB HIS 19 21.605 9.479 -19.274
155 HD1 HIS 19 HD1 HIS 19 23.645 11.813 -21.456
156 HD2 HIS 19 HD2 HIS 19 23.866 9.855 -17.798
157 HE1 HIS 19 HE1 HIS 19 25.984 12.210 -20.621
158 H LYS 20 H LYS 20 21.383 7.389 -20.903
159 HA LYS 20 HA LYS 20 22.722 5.558 -21.168
160 HB2 LYS 20 2HB LYS 20 21.859 6.206 -23.535
161 HB3 LYS 20 3HB LYS 20 23.521 6.701 -23.827
162 HG2 LYS 20 2HG LYS 20 23.040 4.419 -24.613
163 HG3 LYS 20 3HG LYS 20 24.315 4.471 -23.392
164 HD2 LYS 20 2HD LYS 20 22.601 2.632 -23.125
165 HD3 LYS 20 3HD LYS 20 22.863 3.653 -21.709
166 HE2 LYS 20 2HE LYS 20 20.466 3.166 -22.192
167 HE3 LYS 20 3HE LYS 20 20.859 4.884 -22.143
168 HZ1 LYS 20 3HZ LYS 20 21.119 3.782 -24.769
169 HZ2 LYS 20 1HZ LYS 20 20.244 5.134 -24.250
170 HZ3 LYS 20 2HZ LYS 20 19.553 3.593 -24.157
Start of MODEL 12
1 H1 ASN 1 H ASN 1 1.813 -2.122 -0.396
2 HA ASN 1 HA ASN 1 3.151 -0.288 -0.009
3 HB2 ASN 1 2HB ASN 1 4.856 -1.914 -1.567
4 HB3 ASN 1 3HB ASN 1 4.896 -0.311 -2.295
5 HD21 ASN 1 1HD2 ASN 1 7.001 -1.695 -0.900
6 HD22 ASN 1 2HD2 ASN 1 7.434 -0.708 0.450
7 H SER 2 H SER 2 3.343 1.867 -0.881
8 HA SER 2 HA SER 2 1.179 2.565 -2.555
9 HB2 SER 2 2HB SER 2 2.719 3.922 -0.764
10 HB3 SER 2 3HB SER 2 3.343 4.554 -2.288
11 HG SER 2 HG SER 2 1.187 5.092 -2.849
12 H GLY 3 H GLY 3 4.686 2.951 -3.122
13 HA2 GLY 3 2HA GLY 3 5.232 1.862 -5.424
14 HA3 GLY 3 3HA GLY 3 4.135 3.107 -6.001
15 H LEU 4 H LEU 4 6.815 3.025 -3.649
16 HA LEU 4 HA LEU 4 7.809 5.528 -4.788
17 HB2 LEU 4 2HB LEU 4 9.354 5.439 -2.783
18 HB3 LEU 4 3HB LEU 4 7.637 5.664 -2.458
19 HG LEU 4 HG LEU 4 8.282 2.868 -2.379
20 HD11 LEU 4 1HD1 LEU 4 9.761 4.387 -0.275
21 HD12 LEU 4 2HD1 LEU 4 10.545 4.010 -1.808
22 HD13 LEU 4 3HD1 LEU 4 9.940 2.708 -0.784
23 HD21 LEU 4 3HD2 LEU 4 6.339 3.813 -1.323
24 HD22 LEU 4 1HD2 LEU 4 7.343 4.864 -0.323
25 HD23 LEU 4 2HD2 LEU 4 7.381 3.117 -0.081
26 H SER 5 H SER 5 8.836 2.213 -4.124
27 HA SER 5 HA SER 5 11.412 2.670 -5.395
28 HB2 SER 5 2HB SER 5 10.957 1.178 -3.314
29 HB3 SER 5 3HB SER 5 10.410 -0.017 -4.490
30 HG SER 5 HG SER 5 12.409 -0.372 -5.033
31 H PHE 6 H PHE 6 8.424 2.243 -6.544
32 HA PHE 6 HA PHE 6 9.335 0.610 -8.822
33 HB2 PHE 6 2HB PHE 6 6.968 0.399 -7.176
34 HB3 PHE 6 3HB PHE 6 6.529 0.662 -8.860
35 HD1 PHE 6 HD1 PHE 6 9.248 -1.273 -7.190
36 HD2 PHE 6 HD2 PHE 6 5.925 -1.314 -9.849
37 HE1 PHE 6 HE1 PHE 6 9.661 -3.652 -7.663
38 HE2 PHE 6 HE2 PHE 6 6.332 -3.694 -10.325
39 HZ PHE 6 HZ PHE 6 8.201 -4.866 -9.231
40 H GLU 7 H GLU 7 8.682 3.680 -7.885
41 HA GLU 7 HA GLU 7 7.586 4.468 -10.499
42 HB2 GLU 7 2HB GLU 7 6.790 6.466 -9.499
43 HB3 GLU 7 3HB GLU 7 6.380 5.167 -8.387
44 HG2 GLU 7 2HG GLU 7 7.193 6.712 -6.928
45 HG3 GLU 7 3HG GLU 7 8.668 5.814 -7.283
46 HNA MK8 8 H MK8 8 10.345 4.871 -8.270
47 HB MK8 8 2HB MK8 8 12.177 5.904 -7.296
48 HBA MK8 8 3HB MK8 8 13.580 6.352 -8.256
49 HD MK8 8 2HD MK8 8 13.233 9.749 -6.937
50 HDA MK8 8 3HD MK8 8 14.184 8.252 -6.864
51 HE MK8 8 HE MK8 8 13.963 8.749 -9.803
52 HG MK8 8 2HG MK8 8 11.727 8.530 -8.644
53 HGA MK8 8 3HG MK8 8 11.538 8.090 -6.949
54 HB1 MK8 8 HBA MK8 8 11.465 7.121 -11.367
55 HB1A MK8 8 HGA MK8 8 10.775 7.873 -10.268
56 HB1B MK8 8 HDA MK8 8 12.262 7.984 -10.433
57 H LEU 9 H LEU 9 11.084 3.755 -9.665
58 HA LEU 9 HA LEU 9 13.572 2.724 -10.746
59 HB2 LEU 9 2HB LEU 9 12.284 1.530 -8.983
60 HB3 LEU 9 3HB LEU 9 11.000 1.266 -10.162
61 HG LEU 9 HG LEU 9 13.311 0.260 -11.365
62 HD11 LEU 9 1HD1 LEU 9 14.438 -1.056 -9.840
63 HD12 LEU 9 2HD1 LEU 9 13.142 -0.971 -8.648
64 HD13 LEU 9 3HD1 LEU 9 14.177 0.429 -8.925
65 HD21 LEU 9 3HD2 LEU 9 12.164 -1.950 -10.832
66 HD22 LEU 9 1HD2 LEU 9 11.226 -0.756 -11.729
67 HD23 LEU 9 2HD2 LEU 9 10.940 -0.986 -10.004
68 H TYR 10 H TYR 10 10.875 4.149 -12.012
69 HA TYR 10 HA TYR 10 11.238 2.759 -14.584
70 HB2 TYR 10 2HB TYR 10 9.016 2.343 -13.348
71 HB3 TYR 10 3HB TYR 10 8.627 4.010 -13.758
72 HD1 TYR 10 HD1 TYR 10 9.912 0.926 -15.444
73 HD2 TYR 10 HD2 TYR 10 7.408 4.357 -15.682
74 HE1 TYR 10 HE1 TYR 10 9.122 0.189 -17.654
75 HE2 TYR 10 HE2 TYR 10 6.610 3.630 -17.892
76 HH TYR 10 HH TYR 10 7.620 0.539 -19.283
77 H ARG 11 H ARG 11 11.165 5.693 -12.849
78 HA ARG 11 HA ARG 11 11.082 7.269 -15.329
79 HB2 ARG 11 2HB ARG 11 9.827 7.667 -12.877
80 HB3 ARG 11 3HB ARG 11 11.164 8.810 -12.865
81 HG2 ARG 11 2HG ARG 11 9.744 8.815 -15.393
82 HG3 ARG 11 3HG ARG 11 8.692 9.185 -14.026
83 HD2 ARG 11 2HD ARG 11 9.722 11.150 -13.594
84 HD3 ARG 11 3HD ARG 11 11.314 10.531 -14.034
85 HE ARG 11 HE ARG 11 9.748 10.764 -16.352
86 HH11 ARG 11 1HH1 ARG 11 11.323 12.753 -13.968
87 HH12 ARG 11 2HH1 ARG 11 11.573 14.082 -15.052
88 HH21 ARG 11 1HH2 ARG 11 10.071 12.506 -17.789
89 HH22 ARG 11 2HH2 ARG 11 10.860 13.941 -17.225
90 HNA MK8 12 H MK8 12 13.063 6.575 -12.408
91 HB MK8 12 2HB MK8 12 14.629 7.156 -10.774
92 HBA MK8 12 3HB MK8 12 15.861 6.096 -11.444
93 HD MK8 12 2HD MK8 12 16.263 7.214 -9.001
94 HDA MK8 12 3HD MK8 12 17.880 7.910 -9.224
95 HE MK8 12 HE MK8 12 16.720 9.530 -7.822
96 HG MK8 12 2HG MK8 12 17.557 7.862 -11.420
97 HGA MK8 12 3HG MK8 12 16.350 9.139 -11.283
98 HB1 MK8 12 HBA MK8 12 16.217 9.298 -13.224
99 HB1A MK8 12 HGA MK8 12 14.993 9.351 -14.089
100 HB1B MK8 12 HDA MK8 12 14.893 9.671 -12.628
101 H ALA 13 H ALA 13 14.155 5.386 -13.794
102 HA ALA 13 HA ALA 13 16.521 4.372 -15.033
103 HB1 ALA 13 3HB ALA 13 13.677 3.418 -15.336
104 HB2 ALA 13 1HB ALA 13 15.140 2.520 -15.744
105 HB3 ALA 13 2HB ALA 13 14.787 2.915 -14.061
106 H TYR 14 H TYR 14 13.359 5.298 -16.412
107 HA TYR 14 HA TYR 14 14.037 5.159 -19.083
108 HB2 TYR 14 2HB TYR 14 11.877 6.209 -17.540
109 HB3 TYR 14 3HB TYR 14 12.309 7.398 -18.764
110 HD1 TYR 14 HD2 TYR 14 11.739 3.712 -18.476
111 HD2 TYR 14 HD1 TYR 14 11.281 7.232 -20.822
112 HE1 TYR 14 HE2 TYR 14 10.497 2.421 -20.160
113 HE2 TYR 14 HE1 TYR 14 10.036 5.950 -22.512
114 HH TYR 14 HH TYR 14 8.606 3.216 -22.061
115 H THR 15 H THR 15 14.911 7.544 -16.733
116 HA THR 15 HA THR 15 15.699 9.542 -18.655
117 HB THR 15 HB THR 15 16.184 9.330 -15.679
118 HG1 THR 15 HG1 THR 15 14.309 10.663 -17.321
119 HG21 THR 15 1HG2 THR 15 17.929 10.705 -16.242
120 HG22 THR 15 2HG2 THR 15 16.636 11.899 -16.132
121 HG23 THR 15 3HG2 THR 15 17.141 11.288 -17.707
122 H MET 16 H MET 16 17.234 6.961 -16.850
123 HA MET 16 HA MET 16 19.910 7.787 -17.514
124 HB2 MET 16 2HB MET 16 18.987 6.302 -15.512
125 HB3 MET 16 3HB MET 16 19.306 4.999 -16.649
126 HG2 MET 16 2HG MET 16 21.561 5.280 -16.561
127 HG3 MET 16 3HG MET 16 21.445 7.002 -16.204
128 HE1 MET 16 3HE MET 16 21.176 3.314 -14.471
129 HE2 MET 16 1HE MET 16 22.680 3.962 -15.125
130 HE3 MET 16 2HE MET 16 22.477 3.796 -13.381
131 H VAL 17 H VAL 17 17.432 6.107 -19.106
132 HA VAL 17 HA VAL 17 19.141 4.455 -20.744
133 HB VAL 17 HB VAL 17 16.254 5.108 -21.299
134 HG11 VAL 17 1HG1 VAL 17 17.472 2.448 -21.781
135 HG12 VAL 17 2HG1 VAL 17 16.255 3.325 -22.712
136 HG13 VAL 17 3HG1 VAL 17 17.957 3.770 -22.843
137 HG21 VAL 17 3HG2 VAL 17 15.744 4.209 -19.318
138 HG22 VAL 17 1HG2 VAL 17 16.272 2.673 -20.004
139 HG23 VAL 17 2HG2 VAL 17 17.395 3.648 -19.057
140 H LEU 18 H LEU 18 17.317 7.463 -21.116
141 HA LEU 18 HA LEU 18 17.805 7.834 -23.864
142 HB2 LEU 18 2HB LEU 18 17.477 10.052 -21.864
143 HB3 LEU 18 3HB LEU 18 17.032 10.048 -23.569
144 HG LEU 18 HG LEU 18 15.648 8.050 -21.909
145 HD11 LEU 18 1HD1 LEU 18 14.721 10.877 -21.647
146 HD12 LEU 18 2HD1 LEU 18 15.911 10.228 -20.519
147 HD13 LEU 18 3HD1 LEU 18 14.326 9.469 -20.661
148 HD21 LEU 18 3HD2 LEU 18 14.517 10.129 -23.761
149 HD22 LEU 18 1HD2 LEU 18 13.828 8.571 -23.305
150 HD23 LEU 18 2HD2 LEU 18 15.248 8.634 -24.350
151 H HIS 19 H HIS 19 19.647 8.686 -20.994
152 HA HIS 19 HA HIS 19 21.619 10.161 -22.518
153 HB2 HIS 19 2HB HIS 19 21.135 10.970 -20.302
154 HB3 HIS 19 3HB HIS 19 21.463 9.389 -19.600
155 HD1 HIS 19 HD1 HIS 19 23.559 11.545 -21.938
156 HD2 HIS 19 HD2 HIS 19 23.776 9.671 -18.237
157 HE1 HIS 19 HE1 HIS 19 25.903 11.945 -21.118
158 H LYS 20 H LYS 20 21.349 7.046 -20.880
159 HA LYS 20 HA LYS 20 22.724 5.222 -20.817
160 HB2 LYS 20 2HB LYS 20 21.890 5.479 -23.278
161 HB3 LYS 20 3HB LYS 20 23.562 5.908 -23.614
162 HG2 LYS 20 2HG LYS 20 23.764 3.698 -23.961
163 HG3 LYS 20 3HG LYS 20 23.946 3.655 -22.206
164 HD2 LYS 20 2HD LYS 20 21.377 3.233 -23.734
165 HD3 LYS 20 3HD LYS 20 22.348 1.972 -22.971
166 HE2 LYS 20 2HE LYS 20 21.987 3.070 -20.787
167 HE3 LYS 20 3HE LYS 20 20.949 4.255 -21.579
168 HZ1 LYS 20 3HZ LYS 20 19.594 2.562 -20.608
169 HZ2 LYS 20 1HZ LYS 20 20.472 1.332 -21.370
170 HZ3 LYS 20 2HZ LYS 20 19.521 2.386 -22.289
Start of MODEL 13
1 H1 ASN 1 H ASN 1 2.662 -0.064 0.158
2 HA ASN 1 HA ASN 1 2.038 -1.381 -2.336
3 HB2 ASN 1 2HB ASN 1 -0.455 -1.027 -1.981
4 HB3 ASN 1 3HB ASN 1 0.272 -2.356 -1.083
5 HD21 ASN 1 1HD2 ASN 1 -1.019 0.876 -0.875
6 HD22 ASN 1 2HD2 ASN 1 -1.266 0.878 0.835
7 H SER 2 H SER 2 3.389 1.049 -1.408
8 HA SER 2 HA SER 2 1.640 3.220 -2.222
9 HB2 SER 2 2HB SER 2 4.148 2.970 -0.760
10 HB3 SER 2 3HB SER 2 4.203 4.265 -1.956
11 HG SER 2 HG SER 2 2.034 4.818 -0.972
12 H GLY 3 H GLY 3 4.954 2.306 -3.188
13 HA2 GLY 3 2HA GLY 3 5.408 1.718 -5.516
14 HA3 GLY 3 3HA GLY 3 4.177 2.884 -5.979
15 H LEU 4 H LEU 4 6.905 3.127 -3.710
16 HA LEU 4 HA LEU 4 7.689 5.619 -5.016
17 HB2 LEU 4 2HB LEU 4 7.501 4.925 -2.386
18 HB3 LEU 4 3HB LEU 4 9.225 4.713 -2.688
19 HG LEU 4 HG LEU 4 8.691 7.189 -3.782
20 HD11 LEU 4 1HD1 LEU 4 7.441 7.352 -1.097
21 HD12 LEU 4 2HD1 LEU 4 6.442 6.802 -2.441
22 HD13 LEU 4 3HD1 LEU 4 7.226 8.380 -2.514
23 HD21 LEU 4 3HD2 LEU 4 10.625 7.190 -2.628
24 HD22 LEU 4 1HD2 LEU 4 10.007 6.103 -1.383
25 HD23 LEU 4 2HD2 LEU 4 9.617 7.823 -1.325
26 H SER 5 H SER 5 9.297 2.679 -3.790
27 HA SER 5 HA SER 5 11.753 3.171 -5.085
28 HB2 SER 5 2HB SER 5 11.840 1.651 -3.288
29 HB3 SER 5 3HB SER 5 10.492 0.700 -3.911
30 HG SER 5 HG SER 5 13.176 0.604 -4.551
31 H PHE 6 H PHE 6 8.924 1.255 -6.007
32 HA PHE 6 HA PHE 6 10.052 0.223 -8.399
33 HB2 PHE 6 2HB PHE 6 7.503 0.106 -7.017
34 HB3 PHE 6 3HB PHE 6 7.282 0.271 -8.756
35 HD1 PHE 6 HD1 PHE 6 8.697 -1.828 -6.093
36 HD2 PHE 6 HD2 PHE 6 7.840 -1.501 -10.249
37 HE1 PHE 6 HE1 PHE 6 9.140 -4.232 -6.370
38 HE2 PHE 6 HE2 PHE 6 8.280 -3.904 -10.533
39 HZ PHE 6 HZ PHE 6 8.931 -5.274 -8.592
40 H GLU 7 H GLU 7 8.654 3.246 -7.555
41 HA GLU 7 HA GLU 7 7.971 3.999 -10.256
42 HB2 GLU 7 2HB GLU 7 6.628 4.944 -8.519
43 HB3 GLU 7 3HB GLU 7 8.045 5.521 -7.653
44 HG2 GLU 7 2HG GLU 7 8.451 7.215 -9.233
45 HG3 GLU 7 3HG GLU 7 7.335 6.504 -10.396
46 HNA MK8 8 H MK8 8 10.763 4.306 -8.077
47 HB MK8 8 2HB MK8 8 12.702 5.172 -7.152
48 HBA MK8 8 3HB MK8 8 14.087 5.599 -8.146
49 HD MK8 8 2HD MK8 8 13.985 8.960 -6.790
50 HDA MK8 8 3HD MK8 8 14.924 7.473 -7.034
51 HE MK8 8 HE MK8 8 14.896 7.931 -9.685
52 HG MK8 8 2HG MK8 8 12.199 7.829 -8.331
53 HGA MK8 8 3HG MK8 8 12.270 7.360 -6.634
54 HB1 MK8 8 HBA MK8 8 12.001 6.548 -11.173
55 HB1A MK8 8 HGA MK8 8 11.276 7.267 -10.075
56 HB1B MK8 8 HDA MK8 8 12.768 7.372 -10.182
57 H LEU 9 H LEU 9 11.406 3.162 -9.527
58 HA LEU 9 HA LEU 9 13.798 2.017 -10.704
59 HB2 LEU 9 2HB LEU 9 12.572 0.811 -8.957
60 HB3 LEU 9 3HB LEU 9 11.154 0.749 -10.002
61 HG LEU 9 HG LEU 9 12.344 -0.696 -11.560
62 HD11 LEU 9 1HD1 LEU 9 14.634 -0.199 -9.695
63 HD12 LEU 9 2HD1 LEU 9 14.583 -0.080 -11.453
64 HD13 LEU 9 3HD1 LEU 9 14.558 -1.663 -10.676
65 HD21 LEU 9 3HD2 LEU 9 11.090 -1.757 -9.787
66 HD22 LEU 9 1HD2 LEU 9 12.466 -1.624 -8.692
67 HD23 LEU 9 2HD2 LEU 9 12.561 -2.677 -10.104
68 H TYR 10 H TYR 10 11.145 3.620 -11.858
69 HA TYR 10 HA TYR 10 11.363 2.279 -14.472
70 HB2 TYR 10 2HB TYR 10 9.139 2.045 -13.110
71 HB3 TYR 10 3HB TYR 10 8.851 3.695 -13.649
72 HD1 TYR 10 HD1 TYR 10 9.446 0.234 -14.828
73 HD2 TYR 10 HD2 TYR 10 8.122 4.146 -15.853
74 HE1 TYR 10 HE1 TYR 10 8.592 -0.622 -16.969
75 HE2 TYR 10 HE2 TYR 10 7.264 3.300 -17.997
76 HH TYR 10 HH TYR 10 6.438 0.822 -18.801
77 H ARG 11 H ARG 11 11.547 5.161 -12.673
78 HA ARG 11 HA ARG 11 11.468 6.808 -15.106
79 HB2 ARG 11 2HB ARG 11 10.554 7.226 -12.421
80 HB3 ARG 11 3HB ARG 11 11.772 8.435 -12.808
81 HG2 ARG 11 2HG ARG 11 10.434 8.832 -14.950
82 HG3 ARG 11 3HG ARG 11 9.146 7.924 -14.156
83 HD2 ARG 11 2HD ARG 11 8.605 9.653 -12.854
84 HD3 ARG 11 3HD ARG 11 10.289 9.947 -12.420
85 HE ARG 11 HE ARG 11 8.756 11.302 -14.436
86 HH11 ARG 11 1HH1 ARG 11 11.957 10.413 -13.394
87 HH12 ARG 11 2HH1 ARG 11 12.734 11.713 -14.236
88 HH21 ARG 11 1HH2 ARG 11 9.767 13.018 -15.549
89 HH22 ARG 11 2HH2 ARG 11 11.487 13.194 -15.460
90 HNA MK8 12 H MK8 12 13.534 5.856 -12.326
91 HB MK8 12 2HB MK8 12 15.328 6.311 -10.728
92 HBA MK8 12 3HB MK8 12 16.123 4.999 -11.587
93 HD MK8 12 2HD MK8 12 18.489 7.780 -9.593
94 HDA MK8 12 3HD MK8 12 16.854 8.392 -9.912
95 HE MK8 12 HE MK8 12 16.648 5.541 -9.014
96 HG MK8 12 2HG MK8 12 18.184 5.900 -11.069
97 HGA MK8 12 3HG MK8 12 17.788 7.362 -11.971
98 HB1 MK8 12 HBA MK8 12 16.073 8.680 -12.209
99 HB1A MK8 12 HGA MK8 12 16.640 8.419 -13.572
100 HB1B MK8 12 HDA MK8 12 15.192 8.779 -13.419
101 H ALA 13 H ALA 13 14.515 4.691 -13.911
102 HA ALA 13 HA ALA 13 16.731 3.762 -15.456
103 HB1 ALA 13 3HB ALA 13 14.528 2.449 -16.448
104 HB2 ALA 13 1HB ALA 13 15.531 1.916 -15.098
105 HB3 ALA 13 2HB ALA 13 14.054 2.832 -14.793
106 H TYR 14 H TYR 14 13.475 4.795 -16.499
107 HA TYR 14 HA TYR 14 13.982 4.985 -19.202
108 HB2 TYR 14 2HB TYR 14 11.801 5.399 -17.703
109 HB3 TYR 14 3HB TYR 14 12.229 7.076 -18.021
110 HD1 TYR 14 HD1 TYR 14 11.930 3.862 -19.917
111 HD2 TYR 14 HD2 TYR 14 11.243 8.061 -19.854
112 HE1 TYR 14 HE1 TYR 14 10.849 3.712 -22.121
113 HE2 TYR 14 HE2 TYR 14 10.159 7.922 -22.057
114 HH TYR 14 HH TYR 14 10.504 5.759 -24.143
115 H THR 15 H THR 15 14.906 7.147 -16.648
116 HA THR 15 HA THR 15 15.551 9.353 -18.378
117 HB THR 15 HB THR 15 16.230 8.836 -15.479
118 HG1 THR 15 HG1 THR 15 14.267 10.415 -16.801
119 HG21 THR 15 1HG2 THR 15 16.709 11.337 -15.498
120 HG22 THR 15 2HG2 THR 15 16.788 11.201 -17.254
121 HG23 THR 15 3HG2 THR 15 17.919 10.297 -16.248
122 H MET 16 H MET 16 17.251 6.640 -16.956
123 HA MET 16 HA MET 16 19.862 7.611 -17.676
124 HB2 MET 16 2HB MET 16 18.765 5.416 -16.146
125 HB3 MET 16 3HB MET 16 20.023 4.847 -17.236
126 HG2 MET 16 2HG MET 16 20.442 7.213 -15.446
127 HG3 MET 16 3HG MET 16 20.705 5.562 -14.887
128 HE1 MET 16 3HE MET 16 22.583 7.981 -14.892
129 HE2 MET 16 1HE MET 16 23.566 6.579 -14.470
130 HE3 MET 16 2HE MET 16 24.091 7.668 -15.754
131 H VAL 17 H VAL 17 17.334 6.045 -19.303
132 HA VAL 17 HA VAL 17 18.981 4.629 -21.205
133 HB VAL 17 HB VAL 17 16.050 5.257 -21.510
134 HG11 VAL 17 1HG1 VAL 17 16.053 3.798 -23.213
135 HG12 VAL 17 2HG1 VAL 17 17.797 4.063 -23.229
136 HG13 VAL 17 3HG1 VAL 17 17.123 2.674 -22.376
137 HG21 VAL 17 3HG2 VAL 17 17.364 3.587 -19.529
138 HG22 VAL 17 1HG2 VAL 17 15.681 4.106 -19.634
139 HG23 VAL 17 2HG2 VAL 17 16.222 2.681 -20.522
140 H LEU 18 H LEU 18 17.082 7.612 -21.135
141 HA LEU 18 HA LEU 18 17.416 8.288 -23.854
142 HB2 LEU 18 2HB LEU 18 17.113 10.275 -21.623
143 HB3 LEU 18 3HB LEU 18 16.569 10.416 -23.293
144 HG LEU 18 HG LEU 18 15.356 8.204 -21.785
145 HD11 LEU 18 1HD1 LEU 18 14.351 10.939 -21.137
146 HD12 LEU 18 2HD1 LEU 18 15.643 10.225 -20.172
147 HD13 LEU 18 3HD1 LEU 18 14.082 9.412 -20.295
148 HD21 LEU 18 3HD2 LEU 18 14.025 10.435 -23.292
149 HD22 LEU 18 1HD2 LEU 18 13.445 8.794 -23.008
150 HD23 LEU 18 2HD2 LEU 18 14.788 9.074 -24.116
151 H HIS 19 H HIS 19 19.362 8.884 -20.991
152 HA HIS 19 HA HIS 19 21.207 10.600 -22.419
153 HB2 HIS 19 2HB HIS 19 20.766 11.092 -20.083
154 HB3 HIS 19 3HB HIS 19 21.275 9.473 -19.612
155 HD1 HIS 19 HD1 HIS 19 23.136 11.781 -21.966
156 HD2 HIS 19 HD2 HIS 19 23.520 10.102 -18.185
157 HE1 HIS 19 HE1 HIS 19 25.459 12.368 -21.202
158 H LYS 20 H LYS 20 21.182 7.332 -21.055
159 HA LYS 20 HA LYS 20 22.624 5.575 -21.269
160 HB2 LYS 20 2HB LYS 20 21.605 6.047 -23.645
161 HB3 LYS 20 3HB LYS 20 23.253 6.518 -24.040
162 HG2 LYS 20 2HG LYS 20 23.437 4.346 -24.589
163 HG3 LYS 20 3HG LYS 20 23.733 4.158 -22.859
164 HD2 LYS 20 2HD LYS 20 21.057 3.865 -24.224
165 HD3 LYS 20 3HD LYS 20 22.090 2.534 -23.696
166 HE2 LYS 20 2HE LYS 20 20.944 4.654 -21.881
167 HE3 LYS 20 3HE LYS 20 20.253 3.049 -22.112
168 HZ1 LYS 20 3HZ LYS 20 21.697 3.283 -20.118
169 HZ2 LYS 20 1HZ LYS 20 23.018 3.517 -21.148
170 HZ3 LYS 20 2HZ LYS 20 22.175 2.051 -21.174
Start of MODEL 14
1 H1 ASN 1 H ASN 1 4.016 -0.101 1.497
2 HA ASN 1 HA ASN 1 4.651 -0.884 -0.863
3 HB2 ASN 1 2HB ASN 1 2.473 -2.278 -1.050
4 HB3 ASN 1 3HB ASN 1 3.507 -2.518 0.356
5 HD21 ASN 1 1HD2 ASN 1 0.473 -1.371 -0.805
6 HD22 ASN 1 2HD2 ASN 1 -0.250 -1.079 0.737
7 H SER 2 H SER 2 3.900 1.862 -1.179
8 HA SER 2 HA SER 2 1.657 1.938 -2.999
9 HB2 SER 2 2HB SER 2 3.320 3.877 -1.593
10 HB3 SER 2 3HB SER 2 3.020 4.346 -3.267
11 HG SER 2 HG SER 2 1.417 4.826 -1.396
12 H GLY 3 H GLY 3 5.148 2.635 -3.286
13 HA2 GLY 3 2HA GLY 3 5.960 1.232 -5.366
14 HA3 GLY 3 3HA GLY 3 4.932 2.394 -6.192
15 H LEU 4 H LEU 4 7.127 2.841 -3.437
16 HA LEU 4 HA LEU 4 8.223 5.213 -4.615
17 HB2 LEU 4 2HB LEU 4 8.233 3.914 -2.046
18 HB3 LEU 4 3HB LEU 4 9.863 4.417 -2.488
19 HG LEU 4 HG LEU 4 8.967 6.724 -2.848
20 HD11 LEU 4 1HD1 LEU 4 6.506 5.467 -2.726
21 HD12 LEU 4 2HD1 LEU 4 6.800 7.205 -2.707
22 HD13 LEU 4 3HD1 LEU 4 6.626 6.325 -1.189
23 HD21 LEU 4 3HD2 LEU 4 8.283 6.073 -0.049
24 HD22 LEU 4 1HD2 LEU 4 9.406 7.269 -0.698
25 HD23 LEU 4 2HD2 LEU 4 9.880 5.572 -0.606
26 H SER 5 H SER 5 9.250 1.878 -4.225
27 HA SER 5 HA SER 5 11.849 2.471 -5.421
28 HB2 SER 5 2HB SER 5 11.442 0.890 -3.392
29 HB3 SER 5 3HB SER 5 10.940 -0.277 -4.615
30 HG SER 5 HG SER 5 13.205 -0.362 -4.053
31 H PHE 6 H PHE 6 8.881 2.027 -6.584
32 HA PHE 6 HA PHE 6 9.797 0.439 -8.891
33 HB2 PHE 6 2HB PHE 6 7.815 -0.368 -7.385
34 HB3 PHE 6 3HB PHE 6 6.894 0.847 -8.265
35 HD1 PHE 6 HD2 PHE 6 9.008 -2.164 -8.719
36 HD2 PHE 6 HD1 PHE 6 6.041 0.392 -10.386
37 HE1 PHE 6 HE2 PHE 6 8.672 -3.761 -10.560
38 HE2 PHE 6 HE1 PHE 6 5.700 -1.201 -12.230
39 HZ PHE 6 HZ PHE 6 7.017 -3.280 -12.319
40 H GLU 7 H GLU 7 8.745 3.479 -7.814
41 HA GLU 7 HA GLU 7 7.873 4.342 -10.463
42 HB2 GLU 7 2HB GLU 7 7.074 6.321 -9.431
43 HB3 GLU 7 3HB GLU 7 6.650 5.003 -8.347
44 HG2 GLU 7 2HG GLU 7 8.594 5.541 -6.953
45 HG3 GLU 7 3HG GLU 7 8.977 6.885 -8.027
46 HNA MK8 8 H MK8 8 10.629 4.636 -8.228
47 HB MK8 8 2HB MK8 8 12.556 5.475 -7.251
48 HBA MK8 8 3HB MK8 8 13.914 6.054 -8.205
49 HD MK8 8 2HD MK8 8 13.550 9.331 -6.581
50 HDA MK8 8 3HD MK8 8 14.496 7.830 -6.542
51 HE MK8 8 HE MK8 8 14.346 8.400 -9.460
52 HG MK8 8 2HG MK8 8 12.016 8.226 -8.280
53 HGA MK8 8 3HG MK8 8 11.894 7.596 -6.639
54 HB1 MK8 8 HBA MK8 8 11.776 7.099 -11.168
55 HB1A MK8 8 HGA MK8 8 11.070 7.740 -10.010
56 HB1B MK8 8 HDA MK8 8 12.558 7.872 -10.147
57 H LEU 9 H LEU 9 11.354 3.580 -9.708
58 HA LEU 9 HA LEU 9 13.783 2.620 -10.972
59 HB2 LEU 9 2HB LEU 9 11.727 1.482 -9.412
60 HB3 LEU 9 3HB LEU 9 11.668 0.694 -10.987
61 HG LEU 9 HG LEU 9 13.993 0.779 -9.070
62 HD11 LEU 9 1HD1 LEU 9 13.268 -1.193 -8.367
63 HD12 LEU 9 2HD1 LEU 9 13.215 -1.809 -10.018
64 HD13 LEU 9 3HD1 LEU 9 11.816 -0.973 -9.344
65 HD21 LEU 9 3HD2 LEU 9 14.896 -0.863 -10.910
66 HD22 LEU 9 1HD2 LEU 9 15.130 0.879 -11.058
67 HD23 LEU 9 2HD2 LEU 9 13.843 0.082 -11.963
68 H TYR 10 H TYR 10 11.046 4.152 -12.012
69 HA TYR 10 HA TYR 10 11.274 2.943 -14.689
70 HB2 TYR 10 2HB TYR 10 8.945 3.235 -13.017
71 HB3 TYR 10 3HB TYR 10 8.740 4.159 -14.500
72 HD1 TYR 10 HD1 TYR 10 8.703 3.033 -16.674
73 HD2 TYR 10 HD2 TYR 10 9.045 0.824 -13.053
74 HE1 TYR 10 HE1 TYR 10 8.117 0.972 -17.882
75 HE2 TYR 10 HE2 TYR 10 8.461 -1.243 -14.252
76 HH TYR 10 HH TYR 10 7.041 -1.333 -17.176
77 H ARG 11 H ARG 11 11.348 5.756 -12.759
78 HA ARG 11 HA ARG 11 11.211 7.497 -15.123
79 HB2 ARG 11 2HB ARG 11 10.236 7.761 -12.452
80 HB3 ARG 11 3HB ARG 11 11.437 9.015 -12.730
81 HG2 ARG 11 2HG ARG 11 9.104 8.493 -14.556
82 HG3 ARG 11 3HG ARG 11 9.096 9.680 -13.250
83 HD2 ARG 11 2HD ARG 11 11.145 10.691 -14.335
84 HD3 ARG 11 3HD ARG 11 10.820 9.645 -15.716
85 HE ARG 11 HE ARG 11 8.465 10.964 -15.262
86 HH11 ARG 11 1HH1 ARG 11 11.756 11.903 -15.904
87 HH12 ARG 11 2HH1 ARG 11 11.317 13.372 -16.711
88 HH21 ARG 11 1HH2 ARG 11 7.875 12.895 -16.322
89 HH22 ARG 11 2HH2 ARG 11 9.109 13.936 -16.948
90 HNA MK8 12 H MK8 12 13.288 6.566 -12.335
91 HB MK8 12 2HB MK8 12 14.906 7.005 -10.738
92 HBA MK8 12 3HB MK8 12 16.163 6.026 -11.482
93 HD MK8 12 2HD MK8 12 16.441 7.136 -8.960
94 HDA MK8 12 3HD MK8 12 18.093 7.753 -9.162
95 HE MK8 12 HE MK8 12 17.140 9.519 -7.828
96 HG MK8 12 2HG MK8 12 17.805 7.820 -11.360
97 HGA MK8 12 3HG MK8 12 16.570 9.068 -11.208
98 HB1 MK8 12 HBA MK8 12 15.187 9.637 -12.524
99 HB1A MK8 12 HGA MK8 12 16.490 9.241 -13.152
100 HB1B MK8 12 HDA MK8 12 15.254 9.349 -13.995
101 H ALA 13 H ALA 13 14.280 5.419 -13.785
102 HA ALA 13 HA ALA 13 16.567 4.350 -15.116
103 HB1 ALA 13 3HB ALA 13 13.662 3.555 -15.274
104 HB2 ALA 13 1HB ALA 13 15.010 2.630 -15.937
105 HB3 ALA 13 2HB ALA 13 14.881 2.876 -14.195
106 H TYR 14 H TYR 14 13.423 5.467 -16.392
107 HA TYR 14 HA TYR 14 14.040 5.391 -19.080
108 HB2 TYR 14 2HB TYR 14 11.961 6.483 -17.455
109 HB3 TYR 14 3HB TYR 14 12.421 7.691 -18.649
110 HD1 TYR 14 HD2 TYR 14 12.854 6.503 -21.090
111 HD2 TYR 14 HD1 TYR 14 10.182 5.162 -18.062
112 HE1 TYR 14 HE2 TYR 14 11.520 5.332 -22.793
113 HE2 TYR 14 HE1 TYR 14 8.842 3.987 -19.756
114 HH TYR 14 HH TYR 14 8.685 3.395 -21.895
115 H THR 15 H THR 15 15.071 7.648 -16.669
116 HA THR 15 HA THR 15 15.909 9.676 -18.537
117 HB THR 15 HB THR 15 16.445 9.336 -15.582
118 HG1 THR 15 HG1 THR 15 14.303 9.897 -16.068
119 HG21 THR 15 1HG2 THR 15 18.282 10.589 -16.376
120 HG22 THR 15 2HG2 THR 15 17.134 11.784 -15.772
121 HG23 THR 15 3HG2 THR 15 17.277 11.496 -17.505
122 H MET 16 H MET 16 17.362 6.966 -16.860
123 HA MET 16 HA MET 16 20.058 7.694 -17.555
124 HB2 MET 16 2HB MET 16 18.933 6.017 -15.681
125 HB3 MET 16 3HB MET 16 19.591 4.889 -16.859
126 HG2 MET 16 2HG MET 16 21.779 5.709 -16.572
127 HG3 MET 16 3HG MET 16 21.212 7.128 -15.695
128 HE1 MET 16 3HE MET 16 20.823 3.380 -15.794
129 HE2 MET 16 1HE MET 16 21.093 2.822 -14.143
130 HE3 MET 16 2HE MET 16 19.549 3.550 -14.586
131 H VAL 17 H VAL 17 17.472 6.184 -19.147
132 HA VAL 17 HA VAL 17 19.069 4.518 -20.880
133 HB VAL 17 HB VAL 17 16.204 5.319 -21.346
134 HG11 VAL 17 1HG1 VAL 17 16.095 3.596 -22.824
135 HG12 VAL 17 2HG1 VAL 17 17.816 3.958 -22.971
136 HG13 VAL 17 3HG1 VAL 17 17.279 2.625 -21.949
137 HG21 VAL 17 3HG2 VAL 17 16.137 2.841 -20.138
138 HG22 VAL 17 1HG2 VAL 17 17.325 3.731 -19.184
139 HG23 VAL 17 2HG2 VAL 17 15.695 4.374 -19.387
140 H LEU 18 H LEU 18 17.378 7.617 -21.106
141 HA LEU 18 HA LEU 18 17.824 8.063 -23.849
142 HB2 LEU 18 2HB LEU 18 17.641 10.220 -21.766
143 HB3 LEU 18 3HB LEU 18 17.160 10.298 -23.460
144 HG LEU 18 HG LEU 18 15.721 8.306 -21.839
145 HD11 LEU 18 1HD1 LEU 18 14.931 11.161 -21.460
146 HD12 LEU 18 2HD1 LEU 18 16.112 10.419 -20.381
147 HD13 LEU 18 3HD1 LEU 18 14.490 9.738 -20.515
148 HD21 LEU 18 3HD2 LEU 18 14.638 10.497 -23.586
149 HD22 LEU 18 1HD2 LEU 18 13.903 8.946 -23.180
150 HD23 LEU 18 2HD2 LEU 18 15.302 9.004 -24.252
151 H HIS 19 H HIS 19 19.763 8.727 -20.994
152 HA HIS 19 HA HIS 19 21.768 10.166 -22.510
153 HB2 HIS 19 2HB HIS 19 21.362 10.911 -20.253
154 HB3 HIS 19 3HB HIS 19 21.647 9.293 -19.618
155 HD1 HIS 19 HD1 HIS 19 23.721 11.599 -21.840
156 HD2 HIS 19 HD2 HIS 19 24.047 9.295 -18.398
157 HE1 HIS 19 HE1 HIS 19 26.109 11.844 -21.090
158 H LYS 20 H LYS 20 21.391 7.010 -20.975
159 HA LYS 20 HA LYS 20 22.682 5.125 -21.007
160 HB2 LYS 20 2HB LYS 20 21.808 5.507 -23.438
161 HB3 LYS 20 3HB LYS 20 23.491 5.871 -23.797
162 HG2 LYS 20 2HG LYS 20 23.582 3.667 -24.225
163 HG3 LYS 20 3HG LYS 20 23.800 3.554 -22.477
164 HD2 LYS 20 2HD LYS 20 21.181 3.305 -23.957
165 HD3 LYS 20 3HD LYS 20 22.109 1.974 -23.263
166 HE2 LYS 20 2HE LYS 20 21.850 3.008 -21.033
167 HE3 LYS 20 3HE LYS 20 20.848 4.265 -21.758
168 HZ1 LYS 20 3HZ LYS 20 19.438 2.604 -20.817
169 HZ2 LYS 20 1HZ LYS 20 20.246 1.362 -21.633
170 HZ3 LYS 20 2HZ LYS 20 19.324 2.483 -22.500
Start of MODEL 15
1 H1 ASN 1 H ASN 1 2.138 -1.740 0.518
2 HA ASN 1 HA ASN 1 3.336 0.196 0.117
3 HB2 ASN 1 2HB ASN 1 4.751 -0.051 -1.846
4 HB3 ASN 1 3HB ASN 1 4.524 -1.620 -1.080
5 HD21 ASN 1 1HD2 ASN 1 5.390 -1.534 -3.626
6 HD22 ASN 1 2HD2 ASN 1 4.149 -2.060 -4.708
7 H SER 2 H SER 2 3.811 1.968 -1.602
8 HA SER 2 HA SER 2 1.210 2.866 -2.642
9 HB2 SER 2 2HB SER 2 2.814 4.160 -0.881
10 HB3 SER 2 3HB SER 2 3.413 4.827 -2.399
11 HG SER 2 HG SER 2 1.373 5.571 -2.863
12 H GLY 3 H GLY 3 4.695 3.007 -3.385
13 HA2 GLY 3 2HA GLY 3 5.168 2.106 -5.711
14 HA3 GLY 3 3HA GLY 3 3.972 3.283 -6.234
15 H LEU 4 H LEU 4 6.668 3.488 -3.917
16 HA LEU 4 HA LEU 4 7.519 5.959 -5.226
17 HB2 LEU 4 2HB LEU 4 8.027 4.713 -2.557
18 HB3 LEU 4 3HB LEU 4 9.125 5.944 -3.177
19 HG LEU 4 HG LEU 4 6.933 7.342 -3.458
20 HD11 LEU 4 1HD1 LEU 4 5.837 5.027 -2.426
21 HD12 LEU 4 2HD1 LEU 4 5.061 6.609 -2.504
22 HD13 LEU 4 3HD1 LEU 4 5.908 6.114 -1.039
23 HD21 LEU 4 3HD2 LEU 4 7.372 8.387 -1.402
24 HD22 LEU 4 1HD2 LEU 4 8.913 7.682 -1.893
25 HD23 LEU 4 2HD2 LEU 4 7.932 6.887 -0.661
26 H SER 5 H SER 5 9.063 3.019 -3.919
27 HA SER 5 HA SER 5 11.547 3.442 -5.174
28 HB2 SER 5 2HB SER 5 10.212 1.009 -4.005
29 HB3 SER 5 3HB SER 5 11.793 0.900 -4.780
30 HG SER 5 HG SER 5 11.624 1.351 -2.385
31 H PHE 6 H PHE 6 8.709 1.555 -6.137
32 HA PHE 6 HA PHE 6 9.868 0.491 -8.497
33 HB2 PHE 6 2HB PHE 6 7.079 0.726 -7.430
34 HB3 PHE 6 3HB PHE 6 7.325 0.239 -9.104
35 HD1 PHE 6 HD2 PHE 6 8.366 -0.613 -5.636
36 HD2 PHE 6 HD1 PHE 6 7.704 -1.984 -9.611
37 HE1 PHE 6 HE2 PHE 6 8.755 -2.928 -4.899
38 HE2 PHE 6 HE1 PHE 6 8.091 -4.301 -8.880
39 HZ PHE 6 HZ PHE 6 8.618 -4.776 -6.522
40 H GLU 7 H GLU 7 8.500 3.543 -7.708
41 HA GLU 7 HA GLU 7 7.881 4.286 -10.426
42 HB2 GLU 7 2HB GLU 7 6.533 5.275 -8.717
43 HB3 GLU 7 3HB GLU 7 7.949 5.831 -7.836
44 HG2 GLU 7 2HG GLU 7 8.220 7.648 -9.139
45 HG3 GLU 7 3HG GLU 7 7.674 6.821 -10.597
46 HNA MK8 8 H MK8 8 10.646 4.556 -8.208
47 HB MK8 8 2HB MK8 8 12.590 5.380 -7.264
48 HBA MK8 8 3HB MK8 8 14.000 5.764 -8.242
49 HD MK8 8 2HD MK8 8 13.970 9.138 -6.915
50 HDA MK8 8 3HD MK8 8 14.871 7.625 -7.131
51 HE MK8 8 HE MK8 8 14.882 8.054 -9.789
52 HG MK8 8 2HG MK8 8 12.172 8.041 -8.464
53 HGA MK8 8 3HG MK8 8 12.212 7.582 -6.764
54 HB1 MK8 8 HBA MK8 8 11.965 6.752 -11.298
55 HB1A MK8 8 HGA MK8 8 11.255 7.497 -10.207
56 HB1B MK8 8 HDA MK8 8 12.750 7.559 -10.307
57 H LEU 9 H LEU 9 11.290 3.383 -9.636
58 HA LEU 9 HA LEU 9 13.669 2.185 -10.787
59 HB2 LEU 9 2HB LEU 9 12.351 1.045 -9.028
60 HB3 LEU 9 3HB LEU 9 10.998 0.939 -10.152
61 HG LEU 9 HG LEU 9 13.203 -0.233 -11.452
62 HD11 LEU 9 1HD1 LEU 9 12.854 -1.550 -8.788
63 HD12 LEU 9 2HD1 LEU 9 14.076 -0.302 -9.026
64 HD13 LEU 9 3HD1 LEU 9 14.124 -1.778 -9.990
65 HD21 LEU 9 3HD2 LEU 9 11.747 -1.955 -11.762
66 HD22 LEU 9 1HD2 LEU 9 10.600 -0.711 -11.263
67 HD23 LEU 9 2HD2 LEU 9 11.163 -1.910 -10.098
68 H TYR 10 H TYR 10 11.073 3.842 -11.979
69 HA TYR 10 HA TYR 10 11.273 2.470 -14.577
70 HB2 TYR 10 2HB TYR 10 8.972 2.725 -13.012
71 HB3 TYR 10 3HB TYR 10 8.800 3.950 -14.264
72 HD1 TYR 10 HD1 TYR 10 9.316 0.329 -13.687
73 HD2 TYR 10 HD2 TYR 10 8.256 3.352 -16.487
74 HE1 TYR 10 HE1 TYR 10 8.582 -1.404 -15.271
75 HE2 TYR 10 HE2 TYR 10 7.518 1.628 -18.078
76 HH TYR 10 HH TYR 10 6.766 -1.340 -17.357
77 H ARG 11 H ARG 11 11.511 5.366 -12.803
78 HA ARG 11 HA ARG 11 11.506 6.988 -15.254
79 HB2 ARG 11 2HB ARG 11 10.363 7.459 -12.765
80 HB3 ARG 11 3HB ARG 11 11.811 8.457 -12.759
81 HG2 ARG 11 2HG ARG 11 10.814 9.031 -15.207
82 HG3 ARG 11 3HG ARG 11 9.330 8.731 -14.300
83 HD2 ARG 11 2HD ARG 11 11.374 10.420 -12.990
84 HD3 ARG 11 3HD ARG 11 10.548 11.117 -14.383
85 HE ARG 11 HE ARG 11 8.526 10.140 -12.861
86 HH11 ARG 11 1HH1 ARG 11 11.201 12.281 -12.245
87 HH12 ARG 11 2HH1 ARG 11 10.365 13.187 -11.027
88 HH21 ARG 11 1HH2 ARG 11 7.415 11.325 -11.259
89 HH22 ARG 11 2HH2 ARG 11 8.212 12.641 -10.466
90 HNA MK8 12 H MK8 12 13.511 6.013 -12.438
91 HB MK8 12 2HB MK8 12 15.296 6.429 -10.822
92 HBA MK8 12 3HB MK8 12 16.071 5.094 -11.664
93 HD MK8 12 2HD MK8 12 18.478 7.819 -9.648
94 HDA MK8 12 3HD MK8 12 16.864 8.474 -9.989
95 HE MK8 12 HE MK8 12 16.571 5.629 -9.092
96 HG MK8 12 2HG MK8 12 18.147 5.950 -11.129
97 HGA MK8 12 3HG MK8 12 17.794 7.419 -12.036
98 HB1 MK8 12 HBA MK8 12 16.112 8.772 -12.306
99 HB1A MK8 12 HGA MK8 12 16.700 8.487 -13.657
100 HB1B MK8 12 HDA MK8 12 15.258 8.883 -13.534
101 H ALA 13 H ALA 13 14.491 4.801 -13.995
102 HA ALA 13 HA ALA 13 16.701 3.813 -15.509
103 HB1 ALA 13 3HB ALA 13 14.990 2.328 -14.573
104 HB2 ALA 13 1HB ALA 13 13.790 3.038 -15.653
105 HB3 ALA 13 2HB ALA 13 15.146 2.128 -16.318
106 H TYR 14 H TYR 14 13.484 4.913 -16.601
107 HA TYR 14 HA TYR 14 14.029 5.072 -19.299
108 HB2 TYR 14 2HB TYR 14 11.840 5.547 -17.830
109 HB3 TYR 14 3HB TYR 14 12.310 7.211 -18.156
110 HD1 TYR 14 HD2 TYR 14 11.954 3.988 -20.026
111 HD2 TYR 14 HD1 TYR 14 11.375 8.204 -20.011
112 HE1 TYR 14 HE2 TYR 14 10.899 3.846 -22.243
113 HE2 TYR 14 HE1 TYR 14 10.317 8.072 -22.228
114 HH TYR 14 HH TYR 14 9.702 4.964 -23.788
115 H THR 15 H THR 15 14.973 7.228 -16.747
116 HA THR 15 HA THR 15 15.689 9.408 -18.484
117 HB THR 15 HB THR 15 16.320 8.895 -15.573
118 HG1 THR 15 HG1 THR 15 14.083 9.409 -16.354
119 HG21 THR 15 1HG2 THR 15 16.813 11.421 -15.646
120 HG22 THR 15 2HG2 THR 15 17.005 11.190 -17.384
121 HG23 THR 15 3HG2 THR 15 18.046 10.319 -16.258
122 H MET 16 H MET 16 17.308 6.665 -17.023
123 HA MET 16 HA MET 16 19.950 7.572 -17.716
124 HB2 MET 16 2HB MET 16 19.296 6.002 -15.786
125 HB3 MET 16 3HB MET 16 19.203 4.743 -17.010
126 HG2 MET 16 2HG MET 16 21.438 4.619 -17.253
127 HG3 MET 16 3HG MET 16 21.672 6.347 -16.994
128 HE1 MET 16 3HE MET 16 23.872 4.978 -15.887
129 HE2 MET 16 1HE MET 16 23.795 4.234 -14.289
130 HE3 MET 16 2HE MET 16 23.129 3.390 -15.687
131 H VAL 17 H VAL 17 17.406 6.052 -19.364
132 HA VAL 17 HA VAL 17 19.043 4.586 -21.236
133 HB VAL 17 HB VAL 17 16.132 5.279 -21.582
134 HG11 VAL 17 1HG1 VAL 17 17.865 4.042 -23.276
135 HG12 VAL 17 2HG1 VAL 17 17.168 2.667 -22.418
136 HG13 VAL 17 3HG1 VAL 17 16.118 3.800 -23.270
137 HG21 VAL 17 3HG2 VAL 17 15.714 4.150 -19.702
138 HG22 VAL 17 1HG2 VAL 17 16.233 2.708 -20.576
139 HG23 VAL 17 2HG2 VAL 17 17.382 3.593 -19.573
140 H LEU 18 H LEU 18 17.214 7.612 -21.211
141 HA LEU 18 HA LEU 18 17.597 8.261 -23.929
142 HB2 LEU 18 2HB LEU 18 17.313 10.270 -21.716
143 HB3 LEU 18 3HB LEU 18 16.793 10.412 -23.394
144 HG LEU 18 HG LEU 18 15.511 8.239 -21.886
145 HD11 LEU 18 1HD1 LEU 18 14.563 11.003 -21.271
146 HD12 LEU 18 2HD1 LEU 18 15.823 10.264 -20.283
147 HD13 LEU 18 3HD1 LEU 18 14.244 9.489 -20.422
148 HD21 LEU 18 3HD2 LEU 18 14.990 9.097 -24.228
149 HD22 LEU 18 1HD2 LEU 18 14.258 10.490 -23.431
150 HD23 LEU 18 2HD2 LEU 18 13.625 8.871 -23.133
151 H HIS 19 H HIS 19 19.521 8.833 -21.046
152 HA HIS 19 HA HIS 19 21.424 10.494 -22.462
153 HB2 HIS 19 2HB HIS 19 21.005 11.050 -20.157
154 HB3 HIS 19 3HB HIS 19 21.375 9.406 -19.643
155 HD1 HIS 19 HD1 HIS 19 23.371 11.823 -21.807
156 HD2 HIS 19 HD2 HIS 19 23.723 9.588 -18.322
157 HE1 HIS 19 HE1 HIS 19 25.734 12.171 -21.021
158 H LYS 20 H LYS 20 21.304 7.238 -21.077
159 HA LYS 20 HA LYS 20 22.707 5.446 -21.260
160 HB2 LYS 20 2HB LYS 20 21.731 5.925 -23.652
161 HB3 LYS 20 3HB LYS 20 23.394 6.355 -24.029
162 HG2 LYS 20 2HG LYS 20 23.535 4.176 -24.561
163 HG3 LYS 20 3HG LYS 20 23.804 3.993 -22.826
164 HD2 LYS 20 2HD LYS 20 21.139 3.752 -24.224
165 HD3 LYS 20 3HD LYS 20 22.134 2.402 -23.673
166 HE2 LYS 20 2HE LYS 20 21.015 4.560 -21.888
167 HE3 LYS 20 3HE LYS 20 20.289 2.970 -22.117
168 HZ1 LYS 20 3HZ LYS 20 23.005 3.480 -21.028
169 HZ2 LYS 20 1HZ LYS 20 22.290 1.960 -21.230
170 HZ3 LYS 20 2HZ LYS 20 21.644 3.057 -20.116
Start of MODEL 16
1 H1 ASN 1 H ASN 1 4.083 -4.837 -3.599
2 HA ASN 1 HA ASN 1 5.265 -2.800 -4.451
3 HB2 ASN 1 2HB ASN 1 2.364 -3.027 -3.996
4 HB3 ASN 1 3HB ASN 1 2.932 -1.387 -4.295
5 HD21 ASN 1 1HD2 ASN 1 1.369 -3.466 -5.867
6 HD22 ASN 1 2HD2 ASN 1 2.143 -3.479 -7.412
7 H SER 2 H SER 2 4.841 -0.291 -4.146
8 HA SER 2 HA SER 2 4.674 0.584 -1.413
9 HB2 SER 2 2HB SER 2 7.124 -0.330 -2.022
10 HB3 SER 2 3HB SER 2 7.284 1.316 -2.635
11 HG SER 2 HG SER 2 7.464 0.508 -0.136
12 H GLY 3 H GLY 3 5.943 1.499 -4.618
13 HA2 GLY 3 2HA GLY 3 4.725 3.157 -5.920
14 HA3 GLY 3 3HA GLY 3 4.347 3.974 -4.411
15 H LEU 4 H LEU 4 6.584 4.371 -3.126
16 HA LEU 4 HA LEU 4 7.921 6.362 -4.642
17 HB2 LEU 4 2HB LEU 4 7.826 5.470 -1.911
18 HB3 LEU 4 3HB LEU 4 9.495 5.752 -2.401
19 HG LEU 4 HG LEU 4 7.391 7.836 -2.865
20 HD11 LEU 4 1HD1 LEU 4 7.893 8.822 -0.720
21 HD12 LEU 4 2HD1 LEU 4 9.009 7.510 -0.342
22 HD13 LEU 4 3HD1 LEU 4 7.282 7.183 -0.489
23 HD21 LEU 4 3HD2 LEU 4 9.488 9.261 -2.461
24 HD22 LEU 4 1HD2 LEU 4 9.372 8.366 -3.976
25 HD23 LEU 4 2HD2 LEU 4 10.383 7.754 -2.666
26 H SER 5 H SER 5 8.731 3.070 -3.692
27 HA SER 5 HA SER 5 11.355 3.272 -4.944
28 HB2 SER 5 2HB SER 5 9.993 1.090 -3.362
29 HB3 SER 5 3HB SER 5 11.552 0.861 -4.154
30 HG SER 5 HG SER 5 12.280 2.710 -2.915
31 H PHE 6 H PHE 6 8.349 2.870 -6.066
32 HA PHE 6 HA PHE 6 9.186 0.970 -8.158
33 HB2 PHE 6 2HB PHE 6 7.286 0.224 -6.670
34 HB3 PHE 6 3HB PHE 6 6.339 1.551 -7.334
35 HD1 PHE 6 HD1 PHE 6 8.153 -1.546 -8.246
36 HD2 PHE 6 HD2 PHE 6 5.219 1.324 -9.374
37 HE1 PHE 6 HE1 PHE 6 7.481 -2.978 -10.131
38 HE2 PHE 6 HE2 PHE 6 4.542 -0.103 -11.260
39 HZ PHE 6 HZ PHE 6 5.673 -2.258 -11.640
40 H GLU 7 H GLU 7 8.645 4.156 -7.535
41 HA GLU 7 HA GLU 7 7.640 4.723 -10.240
42 HB2 GLU 7 2HB GLU 7 6.934 6.852 -9.462
43 HB3 GLU 7 3HB GLU 7 6.432 5.689 -8.243
44 HG2 GLU 7 2HG GLU 7 8.465 6.282 -6.936
45 HG3 GLU 7 3HG GLU 7 8.785 7.556 -8.111
46 HNA MK8 8 H MK8 8 10.383 5.219 -8.012
47 HB MK8 8 2HB MK8 8 12.269 6.233 -7.114
48 HBA MK8 8 3HB MK8 8 13.691 6.554 -8.096
49 HD MK8 8 2HD MK8 8 13.513 10.051 -7.159
50 HDA MK8 8 3HD MK8 8 14.470 8.556 -7.189
51 HE MK8 8 HE MK8 8 14.541 8.696 -9.875
52 HG MK8 8 2HG MK8 8 11.797 8.723 -8.624
53 HGA MK8 8 3HG MK8 8 11.802 8.463 -6.881
54 HB1 MK8 8 HBA MK8 8 11.718 7.108 -11.295
55 HB1A MK8 8 HGA MK8 8 10.950 7.948 -10.318
56 HB1B MK8 8 HDA MK8 8 12.445 8.052 -10.383
57 H LEU 9 H LEU 9 11.075 3.941 -9.301
58 HA LEU 9 HA LEU 9 13.525 2.690 -10.228
59 HB2 LEU 9 2HB LEU 9 12.205 1.697 -8.401
60 HB3 LEU 9 3HB LEU 9 10.861 1.468 -9.519
61 HG LEU 9 HG LEU 9 12.196 -0.121 -10.808
62 HD11 LEU 9 1HD1 LEU 9 14.408 0.669 -10.524
63 HD12 LEU 9 2HD1 LEU 9 14.347 -0.926 -9.773
64 HD13 LEU 9 3HD1 LEU 9 14.311 0.523 -8.769
65 HD21 LEU 9 3HD2 LEU 9 10.830 -1.069 -9.107
66 HD22 LEU 9 1HD2 LEU 9 11.992 -0.644 -7.850
67 HD23 LEU 9 2HD2 LEU 9 12.392 -1.887 -9.035
68 H TYR 10 H TYR 10 10.886 4.100 -11.661
69 HA TYR 10 HA TYR 10 11.238 2.476 -14.094
70 HB2 TYR 10 2HB TYR 10 8.907 2.641 -12.669
71 HB3 TYR 10 3HB TYR 10 8.687 3.921 -13.856
72 HD1 TYR 10 HD1 TYR 10 9.943 0.394 -13.787
73 HD2 TYR 10 HD2 TYR 10 7.592 3.322 -15.788
74 HE1 TYR 10 HE1 TYR 10 9.292 -1.283 -15.464
75 HE2 TYR 10 HE2 TYR 10 6.934 1.652 -17.470
76 HH TYR 10 HH TYR 10 8.099 -1.700 -17.285
77 H ARG 11 H ARG 11 11.328 5.546 -12.635
78 HA ARG 11 HA ARG 11 11.322 6.904 -15.242
79 HB2 ARG 11 2HB ARG 11 9.988 7.599 -12.989
80 HB3 ARG 11 3HB ARG 11 11.473 8.514 -12.769
81 HG2 ARG 11 2HG ARG 11 11.042 9.289 -15.213
82 HG3 ARG 11 3HG ARG 11 9.387 8.773 -14.883
83 HD2 ARG 11 2HD ARG 11 8.985 10.561 -13.609
84 HD3 ARG 11 3HD ARG 11 10.496 10.362 -12.723
85 HE ARG 11 HE ARG 11 11.084 11.395 -15.255
86 HH11 ARG 11 1HH1 ARG 11 9.494 12.340 -12.306
87 HH12 ARG 11 2HH1 ARG 11 9.837 14.026 -12.508
88 HH21 ARG 11 1HH2 ARG 11 11.542 13.612 -15.532
89 HH22 ARG 11 2HH2 ARG 11 11.001 14.749 -14.344
90 HNA MK8 12 H MK8 12 13.292 6.304 -12.298
91 HB MK8 12 2HB MK8 12 15.022 6.970 -10.699
92 HBA MK8 12 3HB MK8 12 15.856 5.574 -11.369
93 HD MK8 12 2HD MK8 12 18.131 8.593 -9.634
94 HDA MK8 12 3HD MK8 12 16.505 9.148 -10.080
95 HE MK8 12 HE MK8 12 16.282 6.419 -8.862
96 HG MK8 12 2HG MK8 12 17.891 6.552 -10.890
97 HGA MK8 12 3HG MK8 12 17.519 7.893 -11.970
98 HB1 MK8 12 HBA MK8 12 15.801 9.156 -12.420
99 HB1A MK8 12 HGA MK8 12 16.419 8.746 -13.724
100 HB1B MK8 12 HDA MK8 12 14.963 9.102 -13.664
101 H ALA 13 H ALA 13 14.337 4.981 -13.705
102 HA ALA 13 HA ALA 13 16.619 3.905 -15.048
103 HB1 ALA 13 3HB ALA 13 15.410 2.109 -14.492
104 HB2 ALA 13 1HB ALA 13 13.909 3.032 -14.405
105 HB3 ALA 13 2HB ALA 13 14.492 2.441 -15.962
106 H TYR 14 H TYR 14 13.396 4.770 -16.321
107 HA TYR 14 HA TYR 14 14.002 4.652 -19.008
108 HB2 TYR 14 2HB TYR 14 11.763 5.208 -17.647
109 HB3 TYR 14 3HB TYR 14 12.187 6.842 -18.143
110 HD1 TYR 14 HD2 TYR 14 11.990 3.427 -19.661
111 HD2 TYR 14 HD1 TYR 14 11.257 7.594 -20.109
112 HE1 TYR 14 HE2 TYR 14 10.995 3.008 -21.871
113 HE2 TYR 14 HE1 TYR 14 10.259 7.187 -22.320
114 HH TYR 14 HH TYR 14 9.487 5.604 -23.729
115 H THR 15 H THR 15 14.815 7.103 -16.689
116 HA THR 15 HA THR 15 15.504 9.103 -18.641
117 HB THR 15 HB THR 15 16.076 8.937 -15.677
118 HG1 THR 15 HG1 THR 15 14.213 10.481 -17.189
119 HG21 THR 15 1HG2 THR 15 17.701 10.429 -16.222
120 HG22 THR 15 2HG2 THR 15 16.338 11.548 -16.245
121 HG23 THR 15 3HG2 THR 15 16.941 10.861 -17.753
122 H MET 16 H MET 16 17.169 6.593 -16.853
123 HA MET 16 HA MET 16 19.799 7.509 -17.573
124 HB2 MET 16 2HB MET 16 18.665 5.196 -16.084
125 HB3 MET 16 3HB MET 16 20.272 5.007 -16.773
126 HG2 MET 16 2HG MET 16 20.774 7.256 -15.601
127 HG3 MET 16 3HG MET 16 19.336 6.887 -14.652
128 HE1 MET 16 3HE MET 16 20.324 7.091 -12.709
129 HE2 MET 16 1HE MET 16 20.680 5.599 -11.839
130 HE3 MET 16 2HE MET 16 21.996 6.656 -12.353
131 H VAL 17 H VAL 17 17.352 5.734 -19.111
132 HA VAL 17 HA VAL 17 19.090 4.143 -20.780
133 HB VAL 17 HB VAL 17 16.167 4.681 -21.272
134 HG11 VAL 17 1HG1 VAL 17 17.890 3.408 -22.852
135 HG12 VAL 17 2HG1 VAL 17 17.471 2.069 -21.782
136 HG13 VAL 17 3HG1 VAL 17 16.209 2.904 -22.688
137 HG21 VAL 17 3HG2 VAL 17 16.315 2.249 -19.976
138 HG22 VAL 17 1HG2 VAL 17 17.415 3.275 -19.055
139 HG23 VAL 17 2HG2 VAL 17 15.735 3.763 -19.282
140 H LEU 18 H LEU 18 17.143 7.078 -21.120
141 HA LEU 18 HA LEU 18 17.558 7.458 -23.878
142 HB2 LEU 18 2HB LEU 18 17.188 9.670 -21.879
143 HB3 LEU 18 3HB LEU 18 16.703 9.639 -23.573
144 HG LEU 18 HG LEU 18 15.437 7.592 -21.883
145 HD11 LEU 18 1HD1 LEU 18 14.387 10.367 -21.580
146 HD12 LEU 18 2HD1 LEU 18 15.663 9.797 -20.505
147 HD13 LEU 18 3HD1 LEU 18 14.120 8.945 -20.572
148 HD21 LEU 18 3HD2 LEU 18 13.570 8.040 -23.232
149 HD22 LEU 18 1HD2 LEU 18 14.956 8.191 -24.313
150 HD23 LEU 18 2HD2 LEU 18 14.169 9.638 -23.681
151 H HIS 19 H HIS 19 19.428 8.384 -21.051
152 HA HIS 19 HA HIS 19 21.307 9.935 -22.618
153 HB2 HIS 19 2HB HIS 19 20.819 10.707 -20.378
154 HB3 HIS 19 3HB HIS 19 21.276 9.148 -19.699
155 HD1 HIS 19 HD1 HIS 19 23.095 11.553 -22.033
156 HD2 HIS 19 HD2 HIS 19 23.657 9.473 -18.481
157 HE1 HIS 19 HE1 HIS 19 25.446 12.079 -21.311
158 H LYS 20 H LYS 20 21.200 6.815 -20.966
159 HA LYS 20 HA LYS 20 22.647 5.047 -20.934
160 HB2 LYS 20 2HB LYS 20 21.740 5.264 -23.375
161 HB3 LYS 20 3HB LYS 20 23.386 5.753 -23.754
162 HG2 LYS 20 2HG LYS 20 23.661 3.550 -24.099
163 HG3 LYS 20 3HG LYS 20 23.890 3.522 -22.349
164 HD2 LYS 20 2HD LYS 20 21.299 3.000 -23.807
165 HD3 LYS 20 3HD LYS 20 22.336 1.778 -23.068
166 HE2 LYS 20 2HE LYS 20 21.995 2.872 -20.877
167 HE3 LYS 20 3HE LYS 20 20.888 4.009 -21.645
168 HZ1 LYS 20 3HZ LYS 20 19.632 2.267 -20.629
169 HZ2 LYS 20 1HZ LYS 20 20.538 1.071 -21.412
170 HZ3 LYS 20 2HZ LYS 20 19.518 2.081 -22.307
Start of MODEL 17
1 H1 ASN 1 H ASN 1 1.796 -0.933 1.569
2 HA ASN 1 HA ASN 1 3.738 -0.548 0.430
3 HB2 ASN 1 2HB ASN 1 2.988 -2.345 -1.118
4 HB3 ASN 1 3HB ASN 1 2.147 -1.131 -2.077
5 HD21 ASN 1 1HD2 ASN 1 3.207 -0.515 -3.802
6 HD22 ASN 1 2HD2 ASN 1 4.925 -0.444 -3.978
7 H SER 2 H SER 2 4.739 1.119 -0.906
8 HA SER 2 HA SER 2 3.017 3.493 -1.071
9 HB2 SER 2 2HB SER 2 5.281 3.298 0.304
10 HB3 SER 2 3HB SER 2 5.991 3.687 -1.263
11 HG SER 2 HG SER 2 5.070 5.393 0.424
12 H GLY 3 H GLY 3 5.802 2.073 -2.800
13 HA2 GLY 3 2HA GLY 3 5.729 1.606 -5.151
14 HA3 GLY 3 3HA GLY 3 4.519 2.869 -5.325
15 H LEU 4 H LEU 4 7.142 3.657 -3.290
16 HA LEU 4 HA LEU 4 8.076 5.608 -5.225
17 HB2 LEU 4 2HB LEU 4 8.525 5.135 -2.308
18 HB3 LEU 4 3HB LEU 4 9.619 6.181 -3.210
19 HG LEU 4 HG LEU 4 7.949 7.498 -2.051
20 HD11 LEU 4 1HD1 LEU 4 6.934 7.751 -4.800
21 HD12 LEU 4 2HD1 LEU 4 8.688 7.808 -4.625
22 HD13 LEU 4 3HD1 LEU 4 7.677 8.953 -3.744
23 HD21 LEU 4 3HD2 LEU 4 5.716 7.117 -2.070
24 HD22 LEU 4 1HD2 LEU 4 6.249 5.464 -2.381
25 HD23 LEU 4 2HD2 LEU 4 5.723 6.487 -3.718
26 H SER 5 H SER 5 8.770 2.460 -4.616
27 HA SER 5 HA SER 5 11.641 2.746 -5.173
28 HB2 SER 5 2HB SER 5 10.998 1.353 -3.217
29 HB3 SER 5 3HB SER 5 10.116 0.278 -4.303
30 HG SER 5 HG SER 5 12.595 0.050 -3.655
31 H PHE 6 H PHE 6 8.700 1.143 -6.302
32 HA PHE 6 HA PHE 6 10.014 -0.030 -8.580
33 HB2 PHE 6 2HB PHE 6 8.030 -1.130 -8.989
34 HB3 PHE 6 3HB PHE 6 7.870 -0.826 -7.263
35 HD1 PHE 6 HD2 PHE 6 6.914 1.755 -6.896
36 HD2 PHE 6 HD1 PHE 6 6.069 -0.881 -10.129
37 HE1 PHE 6 HE2 PHE 6 4.794 2.937 -7.301
38 HE2 PHE 6 HE1 PHE 6 3.948 0.297 -10.540
39 HZ PHE 6 HZ PHE 6 3.308 2.208 -9.124
40 H GLU 7 H GLU 7 8.628 2.988 -7.838
41 HA GLU 7 HA GLU 7 7.986 3.656 -10.590
42 HB2 GLU 7 2HB GLU 7 6.657 4.461 -8.583
43 HB3 GLU 7 3HB GLU 7 8.015 5.516 -8.215
44 HG2 GLU 7 2HG GLU 7 7.150 7.035 -9.561
45 HG3 GLU 7 3HG GLU 7 7.411 5.942 -10.919
46 HNA MK8 8 H MK8 8 10.635 4.105 -8.265
47 HB MK8 8 2HB MK8 8 12.532 4.977 -7.264
48 HBA MK8 8 3HB MK8 8 13.922 5.517 -8.194
49 HD MK8 8 2HD MK8 8 13.510 8.876 -6.769
50 HDA MK8 8 3HD MK8 8 14.474 7.390 -6.651
51 HE MK8 8 HE MK8 8 14.419 7.735 -9.566
52 HG MK8 8 2HG MK8 8 11.995 7.670 -8.414
53 HGA MK8 8 3HG MK8 8 11.876 7.119 -6.745
54 HB1 MK8 8 HBA MK8 8 11.911 6.430 -11.274
55 HB1A MK8 8 HGA MK8 8 11.134 7.107 -10.184
56 HB1B MK8 8 HDA MK8 8 12.626 7.255 -10.245
57 H LEU 9 H LEU 9 11.429 2.969 -9.654
58 HA LEU 9 HA LEU 9 13.897 1.963 -10.797
59 HB2 LEU 9 2HB LEU 9 12.772 0.652 -9.096
60 HB3 LEU 9 3HB LEU 9 11.312 0.588 -10.081
61 HG LEU 9 HG LEU 9 13.609 -0.488 -11.487
62 HD11 LEU 9 1HD1 LEU 9 14.229 -2.254 -10.153
63 HD12 LEU 9 2HD1 LEU 9 12.768 -2.165 -9.169
64 HD13 LEU 9 3HD1 LEU 9 14.046 -0.968 -8.960
65 HD21 LEU 9 3HD2 LEU 9 12.089 -2.061 -12.186
66 HD22 LEU 9 1HD2 LEU 9 11.019 -0.713 -11.799
67 HD23 LEU 9 2HD2 LEU 9 11.205 -2.046 -10.659
68 H TYR 10 H TYR 10 11.192 3.433 -11.997
69 HA TYR 10 HA TYR 10 11.531 2.118 -14.611
70 HB2 TYR 10 2HB TYR 10 9.254 1.926 -13.157
71 HB3 TYR 10 3HB TYR 10 8.921 3.397 -14.064
72 HD1 TYR 10 HD2 TYR 10 10.459 0.066 -14.818
73 HD2 TYR 10 HD1 TYR 10 7.643 3.051 -15.943
74 HE1 TYR 10 HE2 TYR 10 9.808 -1.289 -16.764
75 HE2 TYR 10 HE1 TYR 10 6.983 1.703 -17.891
76 HH TYR 10 HH TYR 10 8.293 -0.203 -19.338
77 H ARG 11 H ARG 11 11.516 4.991 -12.793
78 HA ARG 11 HA ARG 11 11.382 6.647 -15.218
79 HB2 ARG 11 2HB ARG 11 10.076 6.994 -12.857
80 HB3 ARG 11 3HB ARG 11 11.507 7.981 -12.591
81 HG2 ARG 11 2HG ARG 11 10.122 8.344 -15.173
82 HG3 ARG 11 3HG ARG 11 9.274 8.904 -13.730
83 HD2 ARG 11 2HD ARG 11 12.132 9.633 -14.311
84 HD3 ARG 11 3HD ARG 11 10.774 10.584 -14.912
85 HE ARG 11 HE ARG 11 11.790 10.527 -12.236
86 HH11 ARG 11 1HH1 ARG 11 8.944 11.044 -14.174
87 HH12 ARG 11 2HH1 ARG 11 8.170 12.057 -13.002
88 HH21 ARG 11 1HH2 ARG 11 10.781 11.860 -10.684
89 HH22 ARG 11 2HH2 ARG 11 9.216 12.521 -11.017
90 HNA MK8 12 H MK8 12 13.431 5.833 -12.378
91 HB MK8 12 2HB MK8 12 15.105 6.331 -10.757
92 HBA MK8 12 3HB MK8 12 16.152 5.181 -11.578
93 HD MK8 12 2HD MK8 12 16.666 6.880 -8.925
94 HDA MK8 12 3HD MK8 12 18.007 7.989 -9.275
95 HE MK8 12 HE MK8 12 16.503 9.733 -9.243
96 HG MK8 12 2HG MK8 12 18.032 6.407 -11.017
97 HGA MK8 12 3HG MK8 12 17.374 7.858 -11.769
98 HB1 MK8 12 HBA MK8 12 15.704 8.832 -12.248
99 HB1A MK8 12 HGA MK8 12 16.457 8.561 -13.517
100 HB1B MK8 12 HDA MK8 12 14.980 8.820 -13.562
101 H ALA 13 H ALA 13 14.520 4.707 -13.905
102 HA ALA 13 HA ALA 13 16.830 3.866 -15.354
103 HB1 ALA 13 3HB ALA 13 15.418 2.068 -16.183
104 HB2 ALA 13 1HB ALA 13 15.205 2.273 -14.445
105 HB3 ALA 13 2HB ALA 13 13.985 2.886 -15.562
106 H TYR 14 H TYR 14 13.576 4.763 -16.523
107 HA TYR 14 HA TYR 14 14.162 4.916 -19.214
108 HB2 TYR 14 2HB TYR 14 12.004 5.682 -17.513
109 HB3 TYR 14 3HB TYR 14 12.326 7.011 -18.623
110 HD1 TYR 14 HD1 TYR 14 12.578 6.329 -21.145
111 HD2 TYR 14 HD2 TYR 14 10.631 3.950 -18.203
112 HE1 TYR 14 HE1 TYR 14 11.351 5.149 -22.920
113 HE2 TYR 14 HE2 TYR 14 9.400 2.762 -19.971
114 HH TYR 14 HH TYR 14 9.394 3.838 -23.247
115 H THR 15 H THR 15 14.951 7.143 -16.675
116 HA THR 15 HA THR 15 15.570 9.342 -18.425
117 HB THR 15 HB THR 15 16.168 8.892 -15.497
118 HG1 THR 15 HG1 THR 15 14.180 9.578 -15.329
119 HG21 THR 15 1HG2 THR 15 16.391 11.559 -15.828
120 HG22 THR 15 2HG2 THR 15 17.035 11.001 -17.373
121 HG23 THR 15 3HG2 THR 15 17.765 10.455 -15.864
122 H MET 16 H MET 16 17.313 6.708 -16.908
123 HA MET 16 HA MET 16 19.912 7.751 -17.571
124 HB2 MET 16 2HB MET 16 19.314 6.171 -15.631
125 HB3 MET 16 3HB MET 16 19.310 4.895 -16.841
126 HG2 MET 16 2HG MET 16 21.572 4.992 -17.158
127 HG3 MET 16 3HG MET 16 21.678 6.680 -16.665
128 HE1 MET 16 3HE MET 16 23.409 6.797 -15.346
129 HE2 MET 16 1HE MET 16 22.536 7.253 -13.883
130 HE3 MET 16 2HE MET 16 23.755 5.980 -13.820
131 H VAL 17 H VAL 17 17.483 6.075 -19.239
132 HA VAL 17 HA VAL 17 19.227 4.678 -21.065
133 HB VAL 17 HB VAL 17 16.288 5.209 -21.466
134 HG11 VAL 17 1HG1 VAL 17 16.703 2.764 -22.443
135 HG12 VAL 17 2HG1 VAL 17 16.944 4.224 -23.405
136 HG13 VAL 17 3HG1 VAL 17 18.325 3.419 -22.658
137 HG21 VAL 17 3HG2 VAL 17 16.510 2.659 -20.426
138 HG22 VAL 17 1HG2 VAL 17 17.594 3.618 -19.418
139 HG23 VAL 17 2HG2 VAL 17 15.900 4.080 -19.580
140 H LEU 18 H LEU 18 17.237 7.602 -21.108
141 HA LEU 18 HA LEU 18 17.630 8.238 -23.828
142 HB2 LEU 18 2HB LEU 18 17.201 10.254 -21.644
143 HB3 LEU 18 3HB LEU 18 16.702 10.349 -23.332
144 HG LEU 18 HG LEU 18 15.514 8.128 -21.816
145 HD11 LEU 18 1HD1 LEU 18 14.150 9.331 -20.398
146 HD12 LEU 18 2HD1 LEU 18 14.414 10.848 -21.257
147 HD13 LEU 18 3HD1 LEU 18 15.687 10.182 -20.234
148 HD21 LEU 18 3HD2 LEU 18 13.601 8.670 -23.088
149 HD22 LEU 18 1HD2 LEU 18 14.976 8.887 -24.171
150 HD23 LEU 18 2HD2 LEU 18 14.199 10.292 -23.440
151 H HIS 19 H HIS 19 19.471 8.948 -20.921
152 HA HIS 19 HA HIS 19 21.305 10.693 -22.328
153 HB2 HIS 19 2HB HIS 19 20.807 11.242 -20.031
154 HB3 HIS 19 3HB HIS 19 21.283 9.633 -19.497
155 HD1 HIS 19 HD1 HIS 19 23.067 12.300 -21.560
156 HD2 HIS 19 HD2 HIS 19 23.664 9.850 -18.258
157 HE1 HIS 19 HE1 HIS 19 25.408 12.782 -20.779
158 H LYS 20 H LYS 20 21.337 7.451 -20.903
159 HA LYS 20 HA LYS 20 22.838 5.736 -21.041
160 HB2 LYS 20 2HB LYS 20 21.878 6.133 -23.454
161 HB3 LYS 20 3HB LYS 20 23.522 6.648 -23.809
162 HG2 LYS 20 2HG LYS 20 23.790 4.474 -24.311
163 HG3 LYS 20 3HG LYS 20 24.038 4.326 -22.570
164 HD2 LYS 20 2HD LYS 20 21.415 3.925 -24.008
165 HD3 LYS 20 3HD LYS 20 22.472 2.637 -23.424
166 HE2 LYS 20 2HE LYS 20 21.207 4.752 -21.685
167 HE3 LYS 20 3HE LYS 20 20.572 3.123 -21.907
168 HZ1 LYS 20 3HZ LYS 20 21.916 2.432 -20.309
169 HZ2 LYS 20 1HZ LYS 20 22.549 3.989 -20.120
170 HZ3 LYS 20 2HZ LYS 20 23.267 2.911 -21.207
Start of MODEL 18
1 H1 ASN 1 H ASN 1 5.760 2.241 0.626
2 HA ASN 1 HA ASN 1 6.751 0.366 -0.439
3 HB2 ASN 1 2HB ASN 1 5.790 -1.929 0.117
4 HB3 ASN 1 3HB ASN 1 6.732 -1.149 1.384
5 HD21 ASN 1 1HD2 ASN 1 5.629 -2.596 2.824
6 HD22 ASN 1 2HD2 ASN 1 4.044 -2.203 3.389
7 H SER 2 H SER 2 4.558 2.132 -1.076
8 HA SER 2 HA SER 2 2.551 0.518 -2.392
9 HB2 SER 2 2HB SER 2 2.888 3.327 -1.689
10 HB3 SER 2 3HB SER 2 2.263 3.121 -3.325
11 HG SER 2 HG SER 2 0.482 3.066 -2.087
12 H GLY 3 H GLY 3 4.833 3.014 -3.547
13 HA2 GLY 3 2HA GLY 3 5.610 1.362 -5.783
14 HA3 GLY 3 3HA GLY 3 4.606 2.733 -6.233
15 H LEU 4 H LEU 4 6.774 2.992 -3.538
16 HA LEU 4 HA LEU 4 8.086 5.245 -4.619
17 HB2 LEU 4 2HB LEU 4 8.919 3.469 -2.330
18 HB3 LEU 4 3HB LEU 4 9.568 5.071 -2.675
19 HG LEU 4 HG LEU 4 6.640 4.862 -2.252
20 HD11 LEU 4 1HD1 LEU 4 7.533 5.252 0.295
21 HD12 LEU 4 2HD1 LEU 4 8.621 3.992 -0.286
22 HD13 LEU 4 3HD1 LEU 4 6.877 3.739 -0.332
23 HD21 LEU 4 3HD2 LEU 4 8.839 6.823 -1.732
24 HD22 LEU 4 1HD2 LEU 4 7.295 6.964 -0.890
25 HD23 LEU 4 2HD2 LEU 4 7.347 7.030 -2.652
26 H SER 5 H SER 5 8.931 1.833 -4.460
27 HA SER 5 HA SER 5 11.523 2.337 -5.695
28 HB2 SER 5 2HB SER 5 10.208 -0.162 -4.624
29 HB3 SER 5 3HB SER 5 11.751 -0.185 -5.476
30 HG SER 5 HG SER 5 12.206 1.594 -3.774
31 H PHE 6 H PHE 6 8.482 2.156 -6.799
32 HA PHE 6 HA PHE 6 9.268 0.782 -9.284
33 HB2 PHE 6 2HB PHE 6 7.068 0.283 -7.620
34 HB3 PHE 6 3HB PHE 6 6.409 1.139 -9.010
35 HD1 PHE 6 HD2 PHE 6 6.890 0.233 -11.318
36 HD2 PHE 6 HD1 PHE 6 7.654 -1.973 -7.759
37 HE1 PHE 6 HE2 PHE 6 6.941 -1.851 -12.625
38 HE2 PHE 6 HE1 PHE 6 7.707 -4.061 -9.060
39 HZ PHE 6 HZ PHE 6 7.349 -4.002 -11.496
40 H GLU 7 H GLU 7 8.737 3.753 -7.950
41 HA GLU 7 HA GLU 7 7.676 4.912 -10.432
42 HB2 GLU 7 2HB GLU 7 6.621 5.406 -8.146
43 HB3 GLU 7 3HB GLU 7 8.054 6.374 -7.828
44 HG2 GLU 7 2HG GLU 7 6.320 7.818 -8.592
45 HG3 GLU 7 3HG GLU 7 7.545 7.706 -9.854
46 HNA MK8 8 H MK8 8 10.508 4.880 -8.258
47 HB MK8 8 2HB MK8 8 12.461 5.610 -7.251
48 HBA MK8 8 3HB MK8 8 13.847 6.131 -8.199
49 HD MK8 8 2HD MK8 8 13.734 9.287 -6.349
50 HDA MK8 8 3HD MK8 8 14.604 7.755 -6.559
51 HE MK8 8 HE MK8 8 14.311 8.730 -9.367
52 HG MK8 8 2HG MK8 8 12.111 8.431 -8.173
53 HGA MK8 8 3HG MK8 8 11.946 7.747 -6.558
54 HB1 MK8 8 HBA MK8 8 11.693 7.450 -11.072
55 HB1A MK8 8 HGA MK8 8 11.081 8.077 -9.855
56 HB1B MK8 8 HDA MK8 8 12.567 8.121 -10.054
57 H LEU 9 H LEU 9 11.146 3.892 -9.806
58 HA LEU 9 HA LEU 9 13.511 2.889 -11.160
59 HB2 LEU 9 2HB LEU 9 12.294 1.526 -9.491
60 HB3 LEU 9 3HB LEU 9 10.898 1.509 -10.566
61 HG LEU 9 HG LEU 9 12.160 0.238 -12.215
62 HD11 LEU 9 1HD1 LEU 9 14.376 1.135 -11.777
63 HD12 LEU 9 2HD1 LEU 9 14.387 -0.626 -11.685
64 HD13 LEU 9 3HD1 LEU 9 14.406 0.334 -10.206
65 HD21 LEU 9 3HD2 LEU 9 12.615 -1.814 -10.726
66 HD22 LEU 9 1HD2 LEU 9 10.976 -1.164 -10.786
67 HD23 LEU 9 2HD2 LEU 9 12.018 -0.803 -9.409
68 H TYR 10 H TYR 10 10.846 4.606 -12.067
69 HA TYR 10 HA TYR 10 10.933 3.496 -14.796
70 HB2 TYR 10 2HB TYR 10 8.691 3.773 -13.076
71 HB3 TYR 10 3HB TYR 10 8.508 4.956 -14.367
72 HD1 TYR 10 HD2 TYR 10 9.877 1.477 -14.311
73 HD2 TYR 10 HD1 TYR 10 6.989 4.160 -15.912
74 HE1 TYR 10 HE2 TYR 10 9.073 -0.295 -15.814
75 HE2 TYR 10 HE1 TYR 10 6.176 2.394 -17.419
76 HH TYR 10 HH TYR 10 7.008 0.311 -18.432
77 H ARG 11 H ARG 11 11.188 6.246 -12.759
78 HA ARG 11 HA ARG 11 11.209 8.056 -15.074
79 HB2 ARG 11 2HB ARG 11 10.040 8.324 -12.565
80 HB3 ARG 11 3HB ARG 11 11.480 9.330 -12.473
81 HG2 ARG 11 2HG ARG 11 9.837 10.786 -13.221
82 HG3 ARG 11 3HG ARG 11 10.683 10.324 -14.700
83 HD2 ARG 11 2HD ARG 11 8.536 8.488 -14.107
84 HD3 ARG 11 3HD ARG 11 7.946 10.147 -14.192
85 HE ARG 11 HE ARG 11 9.628 9.645 -16.388
86 HH11 ARG 11 1HH1 ARG 11 6.493 8.782 -15.145
87 HH12 ARG 11 2HH1 ARG 11 5.805 8.501 -16.711
88 HH21 ARG 11 1HH2 ARG 11 8.735 9.278 -18.454
89 HH22 ARG 11 2HH2 ARG 11 7.082 8.783 -18.592
90 HNA MK8 12 H MK8 12 13.174 6.909 -12.287
91 HB MK8 12 2HB MK8 12 14.766 7.264 -10.643
92 HBA MK8 12 3HB MK8 12 16.018 6.241 -11.333
93 HD MK8 12 2HD MK8 12 16.917 7.173 -8.862
94 HDA MK8 12 3HD MK8 12 17.768 8.730 -8.911
95 HE MK8 12 HE MK8 12 16.030 9.087 -7.616
96 HG MK8 12 2HG MK8 12 17.713 7.964 -11.140
97 HGA MK8 12 3HG MK8 12 16.527 9.266 -11.101
98 HB1 MK8 12 HBA MK8 12 15.261 9.874 -12.488
99 HB1A MK8 12 HGA MK8 12 16.568 9.374 -13.029
100 HB1B MK8 12 HDA MK8 12 15.390 9.534 -13.943
101 H ALA 13 H ALA 13 14.066 5.755 -13.727
102 HA ALA 13 HA ALA 13 16.300 4.457 -14.951
103 HB1 ALA 13 3HB ALA 13 14.312 3.104 -16.016
104 HB2 ALA 13 1HB ALA 13 14.735 2.915 -14.314
105 HB3 ALA 13 2HB ALA 13 13.375 3.938 -14.777
106 H TYR 14 H TYR 14 13.315 5.827 -16.356
107 HA TYR 14 HA TYR 14 14.021 5.671 -19.017
108 HB2 TYR 14 2HB TYR 14 11.844 6.565 -17.736
109 HB3 TYR 14 3HB TYR 14 12.557 8.115 -18.167
110 HD1 TYR 14 HD1 TYR 14 11.854 4.812 -19.782
111 HD2 TYR 14 HD2 TYR 14 11.873 9.050 -20.156
112 HE1 TYR 14 HE1 TYR 14 10.906 4.611 -22.043
113 HE2 TYR 14 HE2 TYR 14 10.924 8.861 -22.417
114 HH TYR 14 HH TYR 14 9.521 6.096 -23.597
115 H THR 15 H THR 15 15.139 7.878 -16.589
116 HA THR 15 HA THR 15 16.233 9.791 -18.441
117 HB THR 15 HB THR 15 16.638 9.440 -15.467
118 HG1 THR 15 HG1 THR 15 14.552 10.227 -16.509
119 HG21 THR 15 1HG2 THR 15 18.601 10.519 -16.279
120 HG22 THR 15 2HG2 THR 15 17.566 11.782 -15.611
121 HG23 THR 15 3HG2 THR 15 17.663 11.552 -17.357
122 H MET 16 H MET 16 17.381 6.989 -16.676
123 HA MET 16 HA MET 16 20.153 7.465 -17.281
124 HB2 MET 16 2HB MET 16 19.551 6.257 -15.257
125 HB3 MET 16 3HB MET 16 18.736 5.021 -16.206
126 HG2 MET 16 2HG MET 16 20.809 4.280 -17.141
127 HG3 MET 16 3HG MET 16 21.675 5.624 -16.399
128 HE1 MET 16 3HE MET 16 23.156 3.542 -16.044
129 HE2 MET 16 1HE MET 16 23.478 4.353 -14.511
130 HE3 MET 16 2HE MET 16 23.129 2.625 -14.537
131 H VAL 17 H VAL 17 17.504 6.171 -18.956
132 HA VAL 17 HA VAL 17 19.010 4.348 -20.613
133 HB VAL 17 HB VAL 17 16.243 5.392 -21.187
134 HG11 VAL 17 1HG1 VAL 17 17.017 2.601 -21.734
135 HG12 VAL 17 2HG1 VAL 17 16.074 3.732 -22.707
136 HG13 VAL 17 3HG1 VAL 17 17.835 3.829 -22.700
137 HG21 VAL 17 3HG2 VAL 17 17.146 3.730 -18.977
138 HG22 VAL 17 1HG2 VAL 17 15.587 4.511 -19.244
139 HG23 VAL 17 2HG2 VAL 17 15.920 2.938 -19.968
140 H LEU 18 H LEU 18 17.608 7.581 -20.927
141 HA LEU 18 HA LEU 18 18.190 7.953 -23.657
142 HB2 LEU 18 2HB LEU 18 18.120 10.144 -21.603
143 HB3 LEU 18 3HB LEU 18 17.708 10.240 -23.314
144 HG LEU 18 HG LEU 18 16.043 8.399 -21.736
145 HD11 LEU 18 1HD1 LEU 18 16.578 10.492 -20.279
146 HD12 LEU 18 2HD1 LEU 18 14.915 9.930 -20.442
147 HD13 LEU 18 3HD1 LEU 18 15.477 11.308 -21.389
148 HD21 LEU 18 3HD2 LEU 18 15.223 10.671 -23.522
149 HD22 LEU 18 1HD2 LEU 18 14.335 9.196 -23.136
150 HD23 LEU 18 2HD2 LEU 18 15.768 9.120 -24.161
151 H HIS 19 H HIS 19 20.075 8.478 -20.738
152 HA HIS 19 HA HIS 19 22.251 9.721 -22.190
153 HB2 HIS 19 2HB HIS 19 21.843 10.529 -19.961
154 HB3 HIS 19 3HB HIS 19 21.936 8.900 -19.298
155 HD1 HIS 19 HD1 HIS 19 24.291 11.080 -21.363
156 HD2 HIS 19 HD2 HIS 19 24.303 8.553 -18.065
157 HE1 HIS 19 HE1 HIS 19 26.666 11.064 -20.537
158 H LYS 20 H LYS 20 21.548 6.627 -20.640
159 HA LYS 20 HA LYS 20 22.671 4.637 -20.610
160 HB2 LYS 20 2HB LYS 20 21.916 5.064 -23.073
161 HB3 LYS 20 3HB LYS 20 23.635 5.275 -23.377
162 HG2 LYS 20 2HG LYS 20 23.547 3.066 -23.781
163 HG3 LYS 20 3HG LYS 20 23.695 2.957 -22.025
164 HD2 LYS 20 2HD LYS 20 21.116 2.920 -23.592
165 HD3 LYS 20 3HD LYS 20 21.899 1.521 -22.854
166 HE2 LYS 20 2HE LYS 20 21.659 2.603 -20.644
167 HE3 LYS 20 3HE LYS 20 20.793 3.931 -21.416
168 HZ1 LYS 20 3HZ LYS 20 19.217 2.408 -20.505
169 HZ2 LYS 20 1HZ LYS 20 19.941 1.091 -21.282
170 HZ3 LYS 20 2HZ LYS 20 19.147 2.278 -22.190
Start of MODEL 19
1 H1 ASN 1 H ASN 1 4.426 -0.619 1.224
2 HA ASN 1 HA ASN 1 5.463 0.466 -0.949
3 HB2 ASN 1 2HB ASN 1 4.477 -2.337 -0.546
4 HB3 ASN 1 3HB ASN 1 5.185 -1.875 -2.091
5 HD21 ASN 1 1HD2 ASN 1 7.356 -1.028 -2.075
6 HD22 ASN 1 2HD2 ASN 1 8.464 -1.548 -0.855
7 H SER 2 H SER 2 3.728 2.052 -1.491
8 HA SER 2 HA SER 2 1.503 1.091 -3.059
9 HB2 SER 2 2HB SER 2 2.319 3.614 -1.848
10 HB3 SER 2 3HB SER 2 1.683 3.833 -3.478
11 HG SER 2 HG SER 2 0.058 3.879 -1.825
12 H GLY 3 H GLY 3 4.440 3.003 -3.693
13 HA2 GLY 3 2HA GLY 3 5.180 1.831 -6.057
14 HA3 GLY 3 3HA GLY 3 4.003 3.049 -6.526
15 H LEU 4 H LEU 4 6.616 2.997 -4.103
16 HA LEU 4 HA LEU 4 7.528 5.576 -5.160
17 HB2 LEU 4 2HB LEU 4 7.288 4.448 -2.534
18 HB3 LEU 4 3HB LEU 4 8.961 4.914 -2.832
19 HG LEU 4 HG LEU 4 6.602 6.767 -3.143
20 HD11 LEU 4 1HD1 LEU 4 8.357 7.426 -0.981
21 HD12 LEU 4 2HD1 LEU 4 7.741 5.788 -0.771
22 HD13 LEU 4 3HD1 LEU 4 6.618 7.134 -0.958
23 HD21 LEU 4 3HD2 LEU 4 9.579 7.104 -3.314
24 HD22 LEU 4 1HD2 LEU 4 8.512 8.460 -2.950
25 HD23 LEU 4 2HD2 LEU 4 8.341 7.588 -4.474
26 H SER 5 H SER 5 8.596 2.303 -4.457
27 HA SER 5 HA SER 5 11.332 2.823 -5.191
28 HB2 SER 5 2HB SER 5 10.461 0.019 -5.203
29 HB3 SER 5 3HB SER 5 11.759 0.793 -4.294
30 HG SER 5 HG SER 5 9.136 0.302 -3.576
31 H PHE 6 H PHE 6 8.503 1.338 -6.693
32 HA PHE 6 HA PHE 6 9.921 0.567 -9.068
33 HB2 PHE 6 2HB PHE 6 7.053 0.534 -8.201
34 HB3 PHE 6 3HB PHE 6 7.450 0.302 -9.901
35 HD1 PHE 6 HD2 PHE 6 9.515 -1.434 -10.204
36 HD2 PHE 6 HD1 PHE 6 6.728 -1.371 -6.988
37 HE1 PHE 6 HE2 PHE 6 9.964 -3.815 -9.773
38 HE2 PHE 6 HE1 PHE 6 7.173 -3.751 -6.551
39 HZ PHE 6 HZ PHE 6 8.792 -4.977 -7.945
40 H GLU 7 H GLU 7 8.535 3.447 -7.913
41 HA GLU 7 HA GLU 7 7.919 4.574 -10.496
42 HB2 GLU 7 2HB GLU 7 6.591 5.332 -8.660
43 HB3 GLU 7 3HB GLU 7 8.017 5.736 -7.714
44 HG2 GLU 7 2HG GLU 7 8.440 7.656 -8.917
45 HG3 GLU 7 3HG GLU 7 7.536 7.098 -10.323
46 HNA MK8 8 H MK8 8 10.673 4.566 -8.226
47 HB MK8 8 2HB MK8 8 12.688 5.124 -7.237
48 HBA MK8 8 3HB MK8 8 14.067 5.718 -8.151
49 HD MK8 8 2HD MK8 8 13.917 8.786 -6.150
50 HDA MK8 8 3HD MK8 8 14.795 7.262 -6.387
51 HE MK8 8 HE MK8 8 14.611 8.226 -9.168
52 HG MK8 8 2HG MK8 8 12.300 7.991 -7.982
53 HGA MK8 8 3HG MK8 8 12.155 7.208 -6.410
54 HB1 MK8 8 HBA MK8 8 12.005 7.159 -10.976
55 HB1A MK8 8 HGA MK8 8 11.327 7.734 -9.768
56 HB1B MK8 8 HDA MK8 8 12.822 7.785 -9.885
57 H LEU 9 H LEU 9 11.524 3.443 -9.565
58 HA LEU 9 HA LEU 9 13.804 2.570 -11.132
59 HB2 LEU 9 2HB LEU 9 12.768 1.235 -9.262
60 HB3 LEU 9 3HB LEU 9 11.390 0.962 -10.326
61 HG LEU 9 HG LEU 9 13.784 0.213 -11.696
62 HD11 LEU 9 1HD1 LEU 9 14.727 -1.427 -10.311
63 HD12 LEU 9 2HD1 LEU 9 13.419 -1.311 -9.135
64 HD13 LEU 9 3HD1 LEU 9 14.585 0.003 -9.289
65 HD21 LEU 9 3HD2 LEU 9 12.624 -1.822 -12.020
66 HD22 LEU 9 1HD2 LEU 9 11.397 -0.555 -12.007
67 HD23 LEU 9 2HD2 LEU 9 11.631 -1.571 -10.584
68 H TYR 10 H TYR 10 11.408 4.343 -12.050
69 HA TYR 10 HA TYR 10 11.066 2.943 -14.611
70 HB2 TYR 10 2HB TYR 10 9.009 2.756 -13.165
71 HB3 TYR 10 3HB TYR 10 8.861 4.507 -13.262
72 HD1 TYR 10 HD1 TYR 10 8.198 5.588 -15.339
73 HD2 TYR 10 HD2 TYR 10 8.529 1.354 -15.086
74 HE1 TYR 10 HE1 TYR 10 6.947 5.370 -17.446
75 HE2 TYR 10 HE2 TYR 10 7.281 1.124 -17.192
76 HH TYR 10 HH TYR 10 5.470 3.505 -18.524
77 H ARG 11 H ARG 11 11.273 5.936 -12.822
78 HA ARG 11 HA ARG 11 11.388 7.459 -15.330
79 HB2 ARG 11 2HB ARG 11 10.929 8.285 -12.469
80 HB3 ARG 11 3HB ARG 11 11.286 9.451 -13.735
81 HG2 ARG 11 2HG ARG 11 9.299 8.603 -14.978
82 HG3 ARG 11 3HG ARG 11 8.911 7.612 -13.570
83 HD2 ARG 11 2HD ARG 11 8.016 9.347 -12.496
84 HD3 ARG 11 3HD ARG 11 9.422 10.359 -12.826
85 HE ARG 11 HE ARG 11 7.902 10.159 -15.168
86 HH11 ARG 11 1HH1 ARG 11 7.694 11.527 -11.973
87 HH12 ARG 11 2HH1 ARG 11 6.652 12.825 -12.456
88 HH21 ARG 11 1HH2 ARG 11 6.530 11.862 -15.815
89 HH22 ARG 11 2HH2 ARG 11 5.990 13.014 -14.641
90 HNA MK8 12 H MK8 12 13.269 6.610 -12.395
91 HB MK8 12 2HB MK8 12 14.863 7.014 -10.733
92 HBA MK8 12 3HB MK8 12 16.003 5.880 -11.442
93 HD MK8 12 2HD MK8 12 16.523 6.808 -8.978
94 HDA MK8 12 3HD MK8 12 18.211 7.296 -9.225
95 HE MK8 12 HE MK8 12 17.531 9.073 -7.772
96 HG MK8 12 2HG MK8 12 17.831 7.543 -11.396
97 HGA MK8 12 3HG MK8 12 16.712 8.871 -11.100
98 HB1 MK8 12 HBA MK8 12 15.298 9.568 -12.477
99 HB1A MK8 12 HGA MK8 12 16.606 9.136 -13.069
100 HB1B MK8 12 HDA MK8 12 15.404 9.305 -13.950
101 H ALA 13 H ALA 13 14.313 5.381 -13.818
102 HA ALA 13 HA ALA 13 16.624 4.295 -15.104
103 HB1 ALA 13 3HB ALA 13 13.723 3.503 -15.327
104 HB2 ALA 13 1HB ALA 13 15.092 2.569 -15.930
105 HB3 ALA 13 2HB ALA 13 14.903 2.838 -14.197
106 H TYR 14 H TYR 14 13.504 5.435 -16.417
107 HA TYR 14 HA TYR 14 14.159 5.353 -19.100
108 HB2 TYR 14 2HB TYR 14 12.057 6.443 -17.504
109 HB3 TYR 14 3HB TYR 14 12.534 7.653 -18.690
110 HD1 TYR 14 HD1 TYR 14 12.912 6.597 -21.144
111 HD2 TYR 14 HD2 TYR 14 10.378 4.997 -18.124
112 HE1 TYR 14 HE1 TYR 14 11.605 5.428 -22.869
113 HE2 TYR 14 HE2 TYR 14 9.064 3.823 -19.840
114 HH TYR 14 HH TYR 14 9.115 3.119 -22.037
115 H THR 15 H THR 15 15.212 7.560 -16.670
116 HA THR 15 HA THR 15 16.054 9.613 -18.517
117 HB THR 15 HB THR 15 16.568 9.249 -15.561
118 HG1 THR 15 HG1 THR 15 14.953 11.144 -16.949
119 HG21 THR 15 1HG2 THR 15 17.747 11.090 -17.518
120 HG22 THR 15 2HG2 THR 15 18.299 10.646 -15.903
121 HG23 THR 15 3HG2 THR 15 17.056 11.881 -16.101
122 H MET 16 H MET 16 17.487 6.891 -16.837
123 HA MET 16 HA MET 16 20.189 7.611 -17.516
124 HB2 MET 16 2HB MET 16 20.851 5.755 -16.300
125 HB3 MET 16 3HB MET 16 19.329 6.167 -15.522
126 HG2 MET 16 2HG MET 16 18.786 4.034 -15.811
127 HG3 MET 16 3HG MET 16 18.536 4.455 -17.503
128 HE1 MET 16 3HE MET 16 20.976 2.290 -15.048
129 HE2 MET 16 1HE MET 16 19.359 1.910 -15.643
130 HE3 MET 16 2HE MET 16 20.760 1.062 -16.296
131 H VAL 17 H VAL 17 17.608 6.103 -19.121
132 HA VAL 17 HA VAL 17 19.202 4.429 -20.845
133 HB VAL 17 HB VAL 17 16.351 5.270 -21.334
134 HG11 VAL 17 1HG1 VAL 17 16.283 3.657 -22.898
135 HG12 VAL 17 2HG1 VAL 17 18.040 3.822 -22.887
136 HG13 VAL 17 3HG1 VAL 17 17.267 2.548 -21.943
137 HG21 VAL 17 3HG2 VAL 17 15.808 4.311 -19.392
138 HG22 VAL 17 1HG2 VAL 17 16.257 2.780 -20.143
139 HG23 VAL 17 2HG2 VAL 17 17.432 3.662 -19.168
140 H LEU 18 H LEU 18 17.540 7.544 -21.095
141 HA LEU 18 HA LEU 18 18.019 7.991 -23.828
142 HB2 LEU 18 2HB LEU 18 17.867 10.150 -21.745
143 HB3 LEU 18 3HB LEU 18 17.392 10.236 -23.440
144 HG LEU 18 HG LEU 18 15.914 8.271 -21.820
145 HD11 LEU 18 1HD1 LEU 18 14.684 9.743 -20.522
146 HD12 LEU 18 2HD1 LEU 18 15.202 11.152 -21.447
147 HD13 LEU 18 3HD1 LEU 18 16.329 10.356 -20.349
148 HD21 LEU 18 3HD2 LEU 18 14.860 10.476 -23.563
149 HD22 LEU 18 1HD2 LEU 18 14.118 8.924 -23.173
150 HD23 LEU 18 2HD2 LEU 18 15.521 8.986 -24.239
151 H HIS 19 H HIS 19 19.949 8.641 -20.960
152 HA HIS 19 HA HIS 19 21.986 10.047 -22.456
153 HB2 HIS 19 2HB HIS 19 21.575 10.755 -20.182
154 HB3 HIS 19 3HB HIS 19 21.864 9.126 -19.579
155 HD1 HIS 19 HD1 HIS 19 23.698 10.310 -18.042
156 HD2 HIS 19 HD2 HIS 19 24.498 10.275 -22.119
157 HE1 HIS 19 HE1 HIS 19 26.148 10.839 -18.252
158 H LYS 20 H LYS 20 21.652 6.914 -20.827
159 HA LYS 20 HA LYS 20 22.910 5.012 -20.901
160 HB2 LYS 20 2HB LYS 20 21.976 5.403 -23.326
161 HB3 LYS 20 3HB LYS 20 23.667 5.683 -23.718
162 HG2 LYS 20 2HG LYS 20 23.646 3.469 -24.104
163 HG3 LYS 20 3HG LYS 20 23.900 3.383 -22.360
164 HD2 LYS 20 2HD LYS 20 21.224 3.249 -23.751
165 HD3 LYS 20 3HD LYS 20 22.117 1.866 -23.113
166 HE2 LYS 20 2HE LYS 20 21.164 4.210 -21.471
167 HE3 LYS 20 3HE LYS 20 20.320 2.668 -21.603
168 HZ1 LYS 20 3HZ LYS 20 22.304 3.326 -19.808
169 HZ2 LYS 20 1HZ LYS 20 23.040 2.269 -20.906
170 HZ3 LYS 20 2HZ LYS 20 21.645 1.791 -20.077
Start of MODEL 20
1 H1 ASN 1 H ASN 1 3.765 -1.583 -1.722
2 HA ASN 1 HA ASN 1 1.250 -1.277 -2.735
3 HB2 ASN 1 2HB ASN 1 2.473 -0.331 -0.157
4 HB3 ASN 1 3HB ASN 1 0.777 -0.019 -0.516
5 HD21 ASN 1 1HD2 ASN 1 -0.134 -1.324 0.974
6 HD22 ASN 1 2HD2 ASN 1 0.040 -3.043 0.995
7 H SER 2 H SER 2 3.164 1.450 -1.454
8 HA SER 2 HA SER 2 1.462 3.435 -2.519
9 HB2 SER 2 2HB SER 2 3.352 3.530 -0.661
10 HB3 SER 2 3HB SER 2 4.348 4.033 -2.027
11 HG SER 2 HG SER 2 3.191 5.838 -2.233
12 H GLY 3 H GLY 3 4.757 2.500 -3.540
13 HA2 GLY 3 2HA GLY 3 5.183 2.025 -5.889
14 HA3 GLY 3 3HA GLY 3 3.991 3.253 -6.289
15 H LEU 4 H LEU 4 6.754 3.283 -4.047
16 HA LEU 4 HA LEU 4 7.630 5.789 -5.280
17 HB2 LEU 4 2HB LEU 4 7.669 4.685 -2.611
18 HB3 LEU 4 3HB LEU 4 9.272 5.230 -3.098
19 HG LEU 4 HG LEU 4 7.405 7.267 -3.771
20 HD11 LEU 4 1HD1 LEU 4 5.814 6.600 -2.221
21 HD12 LEU 4 2HD1 LEU 4 6.784 7.762 -1.317
22 HD13 LEU 4 3HD1 LEU 4 7.025 6.032 -1.071
23 HD21 LEU 4 3HD2 LEU 4 8.777 8.351 -1.796
24 HD22 LEU 4 1HD2 LEU 4 9.526 8.009 -3.356
25 HD23 LEU 4 2HD2 LEU 4 9.768 6.906 -2.000
26 H SER 5 H SER 5 9.119 2.793 -4.038
27 HA SER 5 HA SER 5 11.614 3.203 -5.277
28 HB2 SER 5 2HB SER 5 12.211 1.207 -4.342
29 HB3 SER 5 3HB SER 5 10.726 1.460 -3.426
30 HG SER 5 HG SER 5 11.044 -0.649 -4.540
31 H PHE 6 H PHE 6 8.745 1.392 -6.291
32 HA PHE 6 HA PHE 6 9.893 0.364 -8.674
33 HB2 PHE 6 2HB PHE 6 7.041 0.710 -7.755
34 HB3 PHE 6 3HB PHE 6 7.449 0.007 -9.317
35 HD1 PHE 6 HD2 PHE 6 8.817 -2.092 -9.385
36 HD2 PHE 6 HD1 PHE 6 7.144 -0.558 -5.784
37 HE1 PHE 6 HE2 PHE 6 9.093 -4.294 -8.322
38 HE2 PHE 6 HE1 PHE 6 7.419 -2.757 -4.715
39 HZ PHE 6 HZ PHE 6 8.393 -4.629 -5.985
40 H GLU 7 H GLU 7 8.585 3.419 -7.812
41 HA GLU 7 HA GLU 7 7.974 4.237 -10.512
42 HB2 GLU 7 2HB GLU 7 6.658 5.180 -8.724
43 HB3 GLU 7 3HB GLU 7 8.103 5.764 -7.909
44 HG2 GLU 7 2HG GLU 7 8.249 7.592 -9.193
45 HG3 GLU 7 3HG GLU 7 7.767 6.733 -10.655
46 HNA MK8 8 H MK8 8 10.742 4.409 -8.287
47 HB MK8 8 2HB MK8 8 12.685 5.213 -7.316
48 HBA MK8 8 3HB MK8 8 14.108 5.584 -8.280
49 HD MK8 8 2HD MK8 8 14.043 8.960 -6.849
50 HDA MK8 8 3HD MK8 8 14.858 7.384 -6.782
51 HE MK8 8 HE MK8 8 14.688 7.963 -9.724
52 HG MK8 8 2HG MK8 8 12.438 7.917 -8.561
53 HGA MK8 8 3HG MK8 8 12.220 7.428 -6.883
54 HB1 MK8 8 HBA MK8 8 12.050 6.626 -11.337
55 HB1A MK8 8 HGA MK8 8 11.431 7.400 -10.211
56 HB1B MK8 8 HDA MK8 8 12.921 7.386 -10.381
57 H LEU 9 H LEU 9 11.366 3.259 -9.732
58 HA LEU 9 HA LEU 9 13.739 2.030 -10.862
59 HB2 LEU 9 2HB LEU 9 12.417 0.863 -9.156
60 HB3 LEU 9 3HB LEU 9 11.029 0.860 -10.243
61 HG LEU 9 HG LEU 9 12.205 -0.622 -11.773
62 HD11 LEU 9 1HD1 LEU 9 14.460 -0.310 -9.811
63 HD12 LEU 9 2HD1 LEU 9 14.466 -0.000 -11.547
64 HD13 LEU 9 3HD1 LEU 9 14.362 -1.656 -10.947
65 HD21 LEU 9 3HD2 LEU 9 12.533 -1.831 -9.053
66 HD22 LEU 9 1HD2 LEU 9 11.948 -2.573 -10.542
67 HD23 LEU 9 2HD2 LEU 9 10.933 -1.421 -9.674
68 H TYR 10 H TYR 10 11.197 3.757 -12.073
69 HA TYR 10 HA TYR 10 11.456 2.454 -14.700
70 HB2 TYR 10 2HB TYR 10 9.137 2.481 -13.218
71 HB3 TYR 10 3HB TYR 10 8.928 3.874 -14.274
72 HD1 TYR 10 HD1 TYR 10 9.873 0.265 -14.393
73 HD2 TYR 10 HD2 TYR 10 8.086 3.557 -16.412
74 HE1 TYR 10 HE1 TYR 10 9.193 -1.233 -16.222
75 HE2 TYR 10 HE2 TYR 10 7.401 2.068 -18.246
76 HH TYR 10 HH TYR 10 6.944 -0.725 -18.276
77 H ARG 11 H ARG 11 11.611 5.286 -12.830
78 HA ARG 11 HA ARG 11 11.593 6.993 -15.223
79 HB2 ARG 11 2HB ARG 11 10.372 7.356 -12.772
80 HB3 ARG 11 3HB ARG 11 11.817 8.350 -12.645
81 HG2 ARG 11 2HG ARG 11 11.181 9.718 -14.418
82 HG3 ARG 11 3HG ARG 11 10.015 8.542 -15.027
83 HD2 ARG 11 2HD ARG 11 8.398 9.215 -13.605
84 HD3 ARG 11 3HD ARG 11 9.534 9.492 -12.285
85 HE ARG 11 HE ARG 11 9.864 11.451 -14.298
86 HH11 ARG 11 1HH1 ARG 11 7.714 10.497 -11.732
87 HH12 ARG 11 2HH1 ARG 11 7.131 12.103 -11.447
88 HH21 ARG 11 1HH2 ARG 11 9.105 13.571 -13.932
89 HH22 ARG 11 2HH2 ARG 11 7.922 13.851 -12.699
90 HNA MK8 12 H MK8 12 13.579 5.972 -12.410
91 HB MK8 12 2HB MK8 12 15.280 6.308 -10.773
92 HBA MK8 12 3HB MK8 12 16.248 5.120 -11.635
93 HD MK8 12 2HD MK8 12 17.182 6.784 -8.871
94 HDA MK8 12 3HD MK8 12 18.144 8.163 -9.438
95 HE MK8 12 HE MK8 12 16.365 9.482 -9.511
96 HG MK8 12 2HG MK8 12 18.185 6.179 -10.956
97 HGA MK8 12 3HG MK8 12 17.693 7.658 -11.777
98 HB1 MK8 12 HBA MK8 12 15.279 8.909 -13.421
99 HB1A MK8 12 HGA MK8 12 16.107 8.797 -12.175
100 HB1B MK8 12 HDA MK8 12 16.732 8.549 -13.515
101 H ALA 13 H ALA 13 14.591 4.845 -13.989
102 HA ALA 13 HA ALA 13 16.851 3.922 -15.474
103 HB1 ALA 13 3HB ALA 13 15.310 2.250 -16.380
104 HB2 ALA 13 1HB ALA 13 15.185 2.366 -14.624
105 HB3 ALA 13 2HB ALA 13 13.953 3.106 -15.647
106 H TYR 14 H TYR 14 13.643 5.035 -16.582
107 HA TYR 14 HA TYR 14 14.215 5.246 -19.272
108 HB2 TYR 14 2HB TYR 14 12.119 6.080 -17.523
109 HB3 TYR 14 3HB TYR 14 12.505 7.421 -18.596
110 HD1 TYR 14 HD2 TYR 14 11.238 3.985 -18.410
111 HD2 TYR 14 HD1 TYR 14 12.099 7.267 -20.978
112 HE1 TYR 14 HE2 TYR 14 9.926 2.922 -20.198
113 HE2 TYR 14 HE1 TYR 14 10.788 6.214 -22.773
114 HH TYR 14 HH TYR 14 9.713 2.968 -22.602
115 H THR 15 H THR 15 15.145 7.342 -16.668
116 HA THR 15 HA THR 15 15.878 9.558 -18.353
117 HB THR 15 HB THR 15 16.466 8.981 -15.445
118 HG1 THR 15 HG1 THR 15 14.725 10.199 -15.067
119 HG21 THR 15 1HG2 THR 15 17.038 11.461 -15.412
120 HG22 THR 15 2HG2 THR 15 17.159 11.350 -17.168
121 HG23 THR 15 3HG2 THR 15 18.229 10.389 -16.148
122 H MET 16 H MET 16 17.477 6.782 -16.934
123 HA MET 16 HA MET 16 20.127 7.698 -17.581
124 HB2 MET 16 2HB MET 16 19.463 6.094 -15.690
125 HB3 MET 16 3HB MET 16 19.355 4.859 -16.937
126 HG2 MET 16 2HG MET 16 21.840 6.283 -17.151
127 HG3 MET 16 3HG MET 16 21.619 5.661 -15.517
128 HE1 MET 16 3HE MET 16 22.061 2.186 -15.487
129 HE2 MET 16 1HE MET 16 23.511 3.181 -15.618
130 HE3 MET 16 2HE MET 16 22.099 3.790 -14.755
131 H VAL 17 H VAL 17 17.598 6.222 -19.288
132 HA VAL 17 HA VAL 17 19.253 4.794 -21.175
133 HB VAL 17 HB VAL 17 16.345 5.497 -21.535
134 HG11 VAL 17 1HG1 VAL 17 16.337 4.034 -23.242
135 HG12 VAL 17 2HG1 VAL 17 18.080 4.310 -23.250
136 HG13 VAL 17 3HG1 VAL 17 17.412 2.907 -22.416
137 HG21 VAL 17 3HG2 VAL 17 15.907 4.327 -19.685
138 HG22 VAL 17 1HG2 VAL 17 16.435 2.905 -20.584
139 HG23 VAL 17 2HG2 VAL 17 17.574 3.768 -19.550
140 H LEU 18 H LEU 18 17.403 7.811 -21.115
141 HA LEU 18 HA LEU 18 17.790 8.530 -23.804
142 HB2 LEU 18 2HB LEU 18 17.567 10.481 -21.530
143 HB3 LEU 18 3HB LEU 18 17.046 10.689 -23.201
144 HG LEU 18 HG LEU 18 15.718 8.498 -21.760
145 HD11 LEU 18 1HD1 LEU 18 14.501 9.719 -20.241
146 HD12 LEU 18 2HD1 LEU 18 14.814 11.252 -21.055
147 HD13 LEU 18 3HD1 LEU 18 16.086 10.483 -20.105
148 HD21 LEU 18 3HD2 LEU 18 14.492 10.822 -23.211
149 HD22 LEU 18 1HD2 LEU 18 13.856 9.191 -22.993
150 HD23 LEU 18 2HD2 LEU 18 15.221 9.467 -24.075
151 H HIS 19 H HIS 19 19.755 9.020 -20.930
152 HA HIS 19 HA HIS 19 21.670 10.675 -22.332
153 HB2 HIS 19 2HB HIS 19 21.271 11.150 -19.993
154 HB3 HIS 19 3HB HIS 19 21.678 9.496 -19.547
155 HD1 HIS 19 HD1 HIS 19 23.479 10.640 -17.950
156 HD2 HIS 19 HD2 HIS 19 24.160 11.049 -22.028
157 HE1 HIS 19 HE1 HIS 19 25.883 11.347 -18.163
158 H LYS 20 H LYS 20 21.518 7.385 -21.032
159 HA LYS 20 HA LYS 20 22.867 5.566 -21.309
160 HB2 LYS 20 2HB LYS 20 21.902 6.110 -23.662
161 HB3 LYS 20 3HB LYS 20 23.541 6.625 -24.036
162 HG2 LYS 20 2HG LYS 20 23.073 4.306 -24.718
163 HG3 LYS 20 3HG LYS 20 24.397 4.430 -23.556
164 HD2 LYS 20 2HD LYS 20 22.732 2.569 -23.150
165 HD3 LYS 20 3HD LYS 20 23.039 3.644 -21.784
166 HE2 LYS 20 2HE LYS 20 20.632 3.097 -22.142
167 HE3 LYS 20 3HE LYS 20 20.995 4.822 -22.164
168 HZ1 LYS 20 3HZ LYS 20 21.176 3.691 -24.768
169 HZ2 LYS 20 1HZ LYS 20 20.233 4.987 -24.226
170 HZ3 LYS 20 2HZ LYS 20 19.652 3.404 -24.092