Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
632372 | 6hng RC | 34315 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 LYS 1 H1 LYS 1 5.214 3.602 -0.753
2 H2 LYS 1 H2 LYS 1 4.316 4.315 -1.932
3 H3 LYS 1 H3 LYS 1 5.509 3.254 -2.331
4 HA LYS 1 HA LYS 1 4.353 1.448 -1.315
5 HB2 LYS 1 HB2 LYS 1 2.179 3.526 -0.826
6 HB3 LYS 1 HB3 LYS 1 2.010 1.779 -0.579
7 HG2 LYS 1 HG2 LYS 1 3.834 1.842 1.105
8 HG3 LYS 1 HG3 LYS 1 3.985 3.597 0.878
9 HD2 LYS 1 HD2 LYS 1 1.634 3.904 1.577
10 HD3 LYS 1 HD3 LYS 1 1.478 2.152 1.817
11 HE2 LYS 1 HE2 LYS 1 3.311 2.243 3.500
12 HE3 LYS 1 HE3 LYS 1 3.433 3.993 3.265
13 HZ1 LYS 1 HZ1 LYS 1 2.100 3.447 5.171
14 HZ2 LYS 1 HZ2 LYS 1 1.163 4.186 4.040
15 HZ3 LYS 1 HZ3 LYS 1 1.056 2.563 4.261
16 H LEU 2 H LEU 2 2.730 0.192 -2.485
17 HA LEU 2 HA LEU 2 2.846 0.819 -5.288
18 HB2 LEU 2 HB2 LEU 2 1.332 -1.367 -3.820
19 HB3 LEU 2 HB3 LEU 2 1.663 -1.327 -5.556
20 HG LEU 2 HG LEU 2 3.779 -1.457 -3.364
21 HD11 LEU 2 HD11 LEU 2 4.113 -3.761 -4.173
22 HD12 LEU 2 HD12 LEU 2 2.457 -3.535 -3.580
23 HD13 LEU 2 HD13 LEU 2 2.766 -3.555 -5.328
24 HD21 LEU 2 HD21 LEU 2 3.978 -1.631 -6.406
25 HD22 LEU 2 HD22 LEU 2 4.624 -0.320 -5.383
26 HD23 LEU 2 HD23 LEU 2 5.310 -1.945 -5.268
27 H LEU 3 H LEU 3 0.800 2.181 -3.047
28 HA LEU 3 HA LEU 3 -1.663 2.013 -4.633
29 HB2 LEU 3 HB2 LEU 3 -1.937 2.027 -2.256
30 HB3 LEU 3 HB3 LEU 3 -0.776 3.344 -2.057
31 HG LEU 3 HG LEU 3 -2.290 4.902 -3.187
32 HD11 LEU 3 HD11 LEU 3 -3.575 3.282 -4.579
33 HD12 LEU 3 HD12 LEU 3 -4.272 2.568 -3.106
34 HD13 LEU 3 HD13 LEU 3 -4.658 4.244 -3.551
35 HD21 LEU 3 HD21 LEU 3 -2.314 4.689 -0.742
36 HD22 LEU 3 HD22 LEU 3 -3.944 5.043 -1.354
37 HD23 LEU 3 HD23 LEU 3 -3.532 3.390 -0.853
38 H LYS 4 H LYS 4 0.980 4.327 -3.887
39 HA LYS 4 HA LYS 4 -0.151 6.446 -5.496
40 HB2 LYS 4 HB2 LYS 4 1.407 6.868 -3.637
41 HB3 LYS 4 HB3 LYS 4 2.676 5.944 -4.468
42 HG2 LYS 4 HG2 LYS 4 2.731 7.572 -6.290
43 HG3 LYS 4 HG3 LYS 4 1.368 8.461 -5.574
44 HD2 LYS 4 HD2 LYS 4 2.722 8.933 -3.560
45 HD3 LYS 4 HD3 LYS 4 4.085 8.033 -4.253
46 HE2 LYS 4 HE2 LYS 4 4.162 9.611 -6.160
47 HE3 LYS 4 HE3 LYS 4 2.780 10.497 -5.488
48 HZ1 LYS 4 HZ1 LYS 4 4.128 11.010 -3.569
49 HZ2 LYS 4 HZ2 LYS 4 5.401 10.173 -4.179
50 HZ3 LYS 4 HZ3 LYS 4 4.869 11.535 -4.937
51 H LEU 5 H LEU 5 1.644 3.532 -6.138
52 HA LEU 5 HA LEU 5 2.832 4.312 -8.622
53 HB2 LEU 5 HB2 LEU 5 3.534 2.315 -7.417
54 HB3 LEU 5 HB3 LEU 5 1.907 1.628 -7.531
55 HG LEU 5 HG LEU 5 2.112 1.480 -9.993
56 HD11 LEU 5 HD11 LEU 5 4.348 1.822 -11.029
57 HD12 LEU 5 HD12 LEU 5 3.700 3.338 -10.381
58 HD13 LEU 5 HD13 LEU 5 4.958 2.458 -9.481
59 HD21 LEU 5 HD21 LEU 5 4.428 0.235 -8.456
60 HD22 LEU 5 HD22 LEU 5 2.776 -0.414 -8.561
61 HD23 LEU 5 HD23 LEU 5 3.779 -0.333 -10.018
62 H LEU 6 H LEU 6 -0.475 3.464 -7.684
63 HA LEU 6 HA LEU 6 -1.356 2.843 -10.355
64 HB2 LEU 6 HB2 LEU 6 -2.952 3.794 -7.936
65 HB3 LEU 6 HB3 LEU 6 -3.613 3.023 -9.383
66 HG LEU 6 HG LEU 6 -1.684 1.739 -7.399
67 HD11 LEU 6 HD11 LEU 6 -4.634 1.253 -7.975
68 HD12 LEU 6 HD12 LEU 6 -3.624 0.341 -6.824
69 HD13 LEU 6 HD13 LEU 6 -3.976 2.059 -6.532
70 HD21 LEU 6 HD21 LEU 6 -1.333 0.832 -9.655
71 HD22 LEU 6 HD22 LEU 6 -2.193 -0.356 -8.657
72 HD23 LEU 6 HD23 LEU 6 -3.089 0.609 -9.856
73 H LYS 7 H LYS 7 -0.892 5.821 -8.515
74 HA LYS 7 HA LYS 7 -2.415 7.440 -10.429
75 HB2 LYS 7 HB2 LYS 7 -0.655 8.078 -8.035
76 HB3 LYS 7 HB3 LYS 7 -1.278 9.329 -9.117
77 HG2 LYS 7 HG2 LYS 7 -2.726 9.157 -7.203
78 HG3 LYS 7 HG3 LYS 7 -3.591 8.624 -8.650
79 HD2 LYS 7 HD2 LYS 7 -3.363 6.288 -7.993
80 HD3 LYS 7 HD3 LYS 7 -2.236 6.723 -6.684
81 HE2 LYS 7 HE2 LYS 7 -4.461 6.279 -5.773
82 HE3 LYS 7 HE3 LYS 7 -4.030 7.986 -5.561
83 HZ1 LYS 7 HZ1 LYS 7 -5.772 6.902 -7.682
84 HZ2 LYS 7 HZ2 LYS 7 -6.283 7.702 -6.347
85 HZ3 LYS 7 HZ3 LYS 7 -5.389 8.488 -7.479
86 H LYS 8 H LYS 8 0.920 6.385 -9.931
87 HA LYS 8 HA LYS 8 2.123 8.297 -11.723
88 HB2 LYS 8 HB2 LYS 8 3.358 7.148 -9.954
89 HB3 LYS 8 HB3 LYS 8 3.027 5.575 -10.701
90 HG2 LYS 8 HG2 LYS 8 4.298 6.211 -12.707
91 HG3 LYS 8 HG3 LYS 8 4.597 7.824 -12.021
92 HD2 LYS 8 HD2 LYS 8 5.532 5.190 -10.796
93 HD3 LYS 8 HD3 LYS 8 6.535 6.295 -11.758
94 HE2 LYS 8 HE2 LYS 8 6.112 8.095 -10.095
95 HE3 LYS 8 HE3 LYS 8 5.181 6.954 -9.107
96 HZ1 LYS 8 HZ1 LYS 8 7.161 5.607 -8.905
97 HZ2 LYS 8 HZ2 LYS 8 8.021 6.657 -9.824
98 HZ3 LYS 8 HZ3 LYS 8 7.442 7.129 -8.357
99 H LEU 9 H LEU 9 0.472 5.203 -12.135
100 HA LEU 9 HA LEU 9 1.331 5.001 -14.951
101 HB2 LEU 9 HB2 LEU 9 -0.448 3.284 -13.183
102 HB3 LEU 9 HB3 LEU 9 -0.027 2.899 -14.866
103 HG LEU 9 HG LEU 9 2.028 3.282 -12.650
104 HD11 LEU 9 HD11 LEU 9 0.874 0.723 -13.844
105 HD12 LEU 9 HD12 LEU 9 2.205 0.812 -12.666
106 HD13 LEU 9 HD13 LEU 9 0.573 1.333 -12.199
107 HD21 LEU 9 HD21 LEU 9 2.216 2.119 -15.461
108 HD22 LEU 9 HD22 LEU 9 2.931 3.655 -14.906
109 HD23 LEU 9 HD23 LEU 9 3.519 2.110 -14.257
110 H LEU 10 H LEU 10 -1.260 6.406 -13.117
111 HA LEU 10 HA LEU 10 -3.334 6.084 -15.105
112 HB2 LEU 10 HB2 LEU 10 -3.875 6.386 -12.788
113 HB3 LEU 10 HB3 LEU 10 -2.982 7.907 -12.694
114 HG LEU 10 HG LEU 10 -5.247 7.688 -14.682
115 HD11 LEU 10 HD11 LEU 10 -5.576 8.131 -11.684
116 HD12 LEU 10 HD12 LEU 10 -6.851 8.325 -12.911
117 HD13 LEU 10 HD13 LEU 10 -6.148 6.720 -12.597
118 HD21 LEU 10 HD21 LEU 10 -3.901 9.795 -14.547
119 HD22 LEU 10 HD22 LEU 10 -5.569 10.054 -14.006
120 HD23 LEU 10 HD23 LEU 10 -4.258 9.893 -12.811
121 H LYS 11 H LYS 11 -0.833 8.554 -14.494
122 HA LYS 11 HA LYS 11 -1.964 10.477 -16.317
123 HB2 LYS 11 HB2 LYS 11 0.218 11.598 -16.101
124 HB3 LYS 11 HB3 LYS 11 -0.458 11.145 -14.529
125 HG2 LYS 11 HG2 LYS 11 1.031 9.190 -14.412
126 HG3 LYS 11 HG3 LYS 11 1.642 9.523 -16.046
127 HD2 LYS 11 HD2 LYS 11 3.225 10.302 -14.348
128 HD3 LYS 11 HD3 LYS 11 2.580 11.671 -15.270
129 HE2 LYS 11 HE2 LYS 11 0.968 12.150 -13.455
130 HE3 LYS 11 HE3 LYS 11 1.583 10.761 -12.536
131 HZ1 LYS 11 HZ1 LYS 11 3.141 13.138 -13.312
132 HZ2 LYS 11 HZ2 LYS 11 2.567 12.823 -11.807
133 HZ3 LYS 11 HZ3 LYS 11 3.720 11.852 -12.459
134 H LEU 12 H LEU 12 -0.484 7.472 -16.900
135 HA LEU 12 HA LEU 12 0.726 8.261 -19.458
136 HB2 LEU 12 HB2 LEU 12 0.284 5.493 -18.279
137 HB3 LEU 12 HB3 LEU 12 1.346 5.917 -19.626
138 HG LEU 12 HG LEU 12 1.690 6.846 -16.739
139 HD11 LEU 12 HD11 LEU 12 3.274 4.860 -18.421
140 HD12 LEU 12 HD12 LEU 12 3.642 5.346 -16.752
141 HD13 LEU 12 HD13 LEU 12 2.159 4.434 -17.099
142 HD21 LEU 12 HD21 LEU 12 3.443 7.228 -19.201
143 HD22 LEU 12 HD22 LEU 12 2.556 8.507 -18.336
144 HD23 LEU 12 HD23 LEU 12 3.899 7.663 -17.534
145 H LEU 13 H LEU 13 -2.416 7.794 -18.426
146 HA LEU 13 HA LEU 13 -3.276 6.974 -21.160
147 HB2 LEU 13 HB2 LEU 13 -3.435 5.019 -19.767
148 HB3 LEU 13 HB3 LEU 13 -4.168 5.944 -18.452
149 HG LEU 13 HG LEU 13 -6.180 6.355 -19.862
150 HD11 LEU 13 HD11 LEU 13 -4.803 4.393 -21.762
151 HD12 LEU 13 HD12 LEU 13 -6.482 4.962 -21.889
152 HD13 LEU 13 HD13 LEU 13 -5.139 6.104 -22.105
153 HD21 LEU 13 HD21 LEU 13 -7.027 4.046 -19.656
154 HD22 LEU 13 HD22 LEU 13 -5.361 3.446 -19.505
155 HD23 LEU 13 HD23 LEU 13 -6.033 4.505 -18.248
156 H LYS 14 H LYS 14 -3.950 8.737 -18.131
157 HA LYS 14 HA LYS 14 -6.272 10.065 -19.405
158 HB2 LYS 14 HB2 LYS 14 -5.167 10.282 -16.579
159 HB3 LYS 14 HB3 LYS 14 -6.688 10.974 -17.166
160 HG2 LYS 14 HG2 LYS 14 -6.012 8.007 -16.973
161 HG3 LYS 14 HG3 LYS 14 -7.101 8.919 -15.908
162 HD2 LYS 14 HD2 LYS 14 -8.572 9.412 -17.860
163 HD3 LYS 14 HD3 LYS 14 -7.508 8.452 -18.898
164 HE2 LYS 14 HE2 LYS 14 -9.410 7.093 -18.232
165 HE3 LYS 14 HE3 LYS 14 -7.939 6.453 -17.482
166 HZ1 LYS 14 HZ1 LYS 14 -8.558 7.568 -15.451
167 HZ2 LYS 14 HZ2 LYS 14 -9.916 8.177 -16.156
168 HZ3 LYS 14 HZ3 LYS 14 -9.764 6.562 -15.935
169 HN1 NH2 15 HN1 NHE 15 -3.020 10.496 -19.583
170 HN2 NH2 15 HN2 NHE 15 -2.969 12.246 -19.671
Start of MODEL 2
1 H1 LYS 1 H1 LYS 1 1.740 0.017 -0.207
2 H2 LYS 1 H2 LYS 1 2.955 -0.647 0.684
3 H3 LYS 1 H3 LYS 1 2.127 -1.570 -0.397
4 HA LYS 1 HA LYS 1 3.846 0.717 -1.057
5 HB2 LYS 1 HB2 LYS 1 5.370 -0.928 -2.043
6 HB3 LYS 1 HB3 LYS 1 5.146 -1.235 -0.313
7 HG2 LYS 1 HG2 LYS 1 3.550 -3.046 -0.811
8 HG3 LYS 1 HG3 LYS 1 3.720 -2.731 -2.555
9 HD2 LYS 1 HD2 LYS 1 6.133 -3.262 -2.414
10 HD3 LYS 1 HD3 LYS 1 5.967 -3.562 -0.671
11 HE2 LYS 1 HE2 LYS 1 4.327 -5.365 -1.145
12 HE3 LYS 1 HE3 LYS 1 4.507 -5.069 -2.879
13 HZ1 LYS 1 HZ1 LYS 1 6.652 -5.940 -1.055
14 HZ2 LYS 1 HZ2 LYS 1 5.872 -6.889 -2.142
15 HZ3 LYS 1 HZ3 LYS 1 6.823 -5.656 -2.669
16 H LEU 2 H LEU 2 4.346 0.765 -3.446
17 HA LEU 2 HA LEU 2 3.620 1.114 -5.533
18 HB2 LEU 2 HB2 LEU 2 2.252 -1.577 -5.235
19 HB3 LEU 2 HB3 LEU 2 2.728 -0.797 -6.746
20 HG LEU 2 HG LEU 2 4.646 -1.718 -4.554
21 HD11 LEU 2 HD11 LEU 2 3.557 -3.576 -5.764
22 HD12 LEU 2 HD12 LEU 2 4.040 -2.853 -7.318
23 HD13 LEU 2 HD13 LEU 2 5.278 -3.444 -6.195
24 HD21 LEU 2 HD21 LEU 2 5.549 0.211 -5.803
25 HD22 LEU 2 HD22 LEU 2 6.396 -1.277 -6.260
26 HD23 LEU 2 HD23 LEU 2 5.163 -0.598 -7.345
27 H LEU 3 H LEU 3 1.898 2.231 -3.418
28 HA LEU 3 HA LEU 3 -0.832 2.007 -4.489
29 HB2 LEU 3 HB2 LEU 3 -0.618 2.026 -2.102
30 HB3 LEU 3 HB3 LEU 3 0.520 3.383 -2.150
31 HG LEU 3 HG LEU 3 -1.242 4.869 -2.988
32 HD11 LEU 3 HD11 LEU 3 -3.618 4.131 -2.825
33 HD12 LEU 3 HD12 LEU 3 -2.738 3.186 -4.046
34 HD13 LEU 3 HD13 LEU 3 -3.071 2.479 -2.449
35 HD21 LEU 3 HD21 LEU 3 -1.954 3.395 -0.414
36 HD22 LEU 3 HD22 LEU 3 -0.753 4.698 -0.571
37 HD23 LEU 3 HD23 LEU 3 -2.474 5.036 -0.861
38 H LYS 4 H LYS 4 1.897 4.313 -4.288
39 HA LYS 4 HA LYS 4 0.481 6.428 -5.671
40 HB2 LYS 4 HB2 LYS 4 2.365 6.853 -4.137
41 HB3 LYS 4 HB3 LYS 4 3.451 5.930 -5.196
42 HG2 LYS 4 HG2 LYS 4 3.128 7.554 -7.010
43 HG3 LYS 4 HG3 LYS 4 1.948 8.444 -6.028
44 HD2 LYS 4 HD2 LYS 4 4.892 8.026 -5.334
45 HD3 LYS 4 HD3 LYS 4 4.192 9.507 -6.017
46 HE2 LYS 4 HE2 LYS 4 2.732 9.730 -4.024
47 HE3 LYS 4 HE3 LYS 4 3.473 8.276 -3.326
48 HZ1 LYS 4 HZ1 LYS 4 4.905 10.757 -4.007
49 HZ2 LYS 4 HZ2 LYS 4 4.491 10.274 -2.493
50 HZ3 LYS 4 HZ3 LYS 4 5.583 9.405 -3.364
51 H LEU 5 H LEU 5 2.037 3.479 -6.631
52 HA LEU 5 HA LEU 5 2.802 4.254 -9.270
53 HB2 LEU 5 HB2 LEU 5 3.633 2.212 -8.239
54 HB3 LEU 5 HB3 LEU 5 1.985 1.586 -8.066
55 HG LEU 5 HG LEU 5 1.739 1.482 -10.524
56 HD11 LEU 5 HD11 LEU 5 4.666 2.351 -10.533
57 HD12 LEU 5 HD12 LEU 5 3.762 1.746 -11.945
58 HD13 LEU 5 HD13 LEU 5 3.290 3.277 -11.187
59 HD21 LEU 5 HD21 LEU 5 2.568 -0.467 -9.260
60 HD22 LEU 5 HD22 LEU 5 3.290 -0.390 -10.883
61 HD23 LEU 5 HD23 LEU 5 4.240 0.107 -9.471
62 H LEU 6 H LEU 6 -0.311 3.484 -7.784
63 HA LEU 6 HA LEU 6 -1.668 2.934 -10.266
64 HB2 LEU 6 HB2 LEU 6 -2.782 3.878 -7.594
65 HB3 LEU 6 HB3 LEU 6 -3.704 3.131 -8.907
66 HG LEU 6 HG LEU 6 -1.469 1.786 -7.313
67 HD11 LEU 6 HD11 LEU 6 -4.489 1.382 -7.328
68 HD12 LEU 6 HD12 LEU 6 -3.306 0.429 -6.397
69 HD13 LEU 6 HD13 LEU 6 -3.554 2.151 -6.030
70 HD21 LEU 6 HD21 LEU 6 -2.237 -0.267 -8.471
71 HD22 LEU 6 HD22 LEU 6 -3.358 0.699 -9.454
72 HD23 LEU 6 HD23 LEU 6 -1.595 0.918 -9.620
73 H LYS 7 H LYS 7 -0.769 5.859 -8.525
74 HA LYS 7 HA LYS 7 -2.508 7.573 -10.168
75 HB2 LYS 7 HB2 LYS 7 -0.392 8.072 -8.052
76 HB3 LYS 7 HB3 LYS 7 -1.028 9.378 -9.058
77 HG2 LYS 7 HG2 LYS 7 -2.230 9.311 -6.963
78 HG3 LYS 7 HG3 LYS 7 -3.313 8.915 -8.302
79 HD2 LYS 7 HD2 LYS 7 -3.214 6.533 -7.725
80 HD3 LYS 7 HD3 LYS 7 -1.989 6.866 -6.470
81 HE2 LYS 7 HE2 LYS 7 -3.615 8.298 -5.281
82 HE3 LYS 7 HE3 LYS 7 -4.827 7.976 -6.530
83 HZ1 LYS 7 HZ1 LYS 7 -3.594 5.955 -4.776
84 HZ2 LYS 7 HZ2 LYS 7 -5.118 6.561 -4.626
85 HZ3 LYS 7 HZ3 LYS 7 -4.728 5.653 -5.933
86 H LYS 8 H LYS 8 0.822 6.383 -10.191
87 HA LYS 8 HA LYS 8 1.769 8.254 -12.174
88 HB2 LYS 8 HB2 LYS 8 3.269 7.083 -10.624
89 HB3 LYS 8 HB3 LYS 8 2.769 5.515 -11.276
90 HG2 LYS 8 HG2 LYS 8 3.716 6.090 -13.477
91 HG3 LYS 8 HG3 LYS 8 4.156 7.708 -12.876
92 HD2 LYS 8 HD2 LYS 8 5.645 6.684 -11.191
93 HD3 LYS 8 HD3 LYS 8 5.168 5.064 -11.731
94 HE2 LYS 8 HE2 LYS 8 7.321 5.648 -12.711
95 HE3 LYS 8 HE3 LYS 8 6.092 5.535 -13.981
96 HZ1 LYS 8 HZ1 LYS 8 5.927 7.927 -13.950
97 HZ2 LYS 8 HZ2 LYS 8 7.043 8.036 -12.746
98 HZ3 LYS 8 HZ3 LYS 8 7.481 7.481 -14.228
99 H LEU 9 H LEU 9 0.237 5.045 -12.293
100 HA LEU 9 HA LEU 9 0.579 4.799 -15.177
101 HB2 LEU 9 HB2 LEU 9 -1.140 3.326 -13.135
102 HB3 LEU 9 HB3 LEU 9 -1.037 2.881 -14.846
103 HG LEU 9 HG LEU 9 1.389 3.024 -13.006
104 HD11 LEU 9 HD11 LEU 9 -0.209 1.314 -12.219
105 HD12 LEU 9 HD12 LEU 9 -0.292 0.625 -13.852
106 HD13 LEU 9 HD13 LEU 9 1.231 0.561 -12.933
107 HD21 LEU 9 HD21 LEU 9 1.928 3.214 -15.395
108 HD22 LEU 9 HD22 LEU 9 2.417 1.623 -14.780
109 HD23 LEU 9 HD23 LEU 9 0.940 1.774 -15.752
110 H LEU 10 H LEU 10 -1.704 6.391 -13.043
111 HA LEU 10 HA LEU 10 -3.893 6.402 -14.925
112 HB2 LEU 10 HB2 LEU 10 -4.250 6.646 -12.546
113 HB3 LEU 10 HB3 LEU 10 -3.264 8.111 -12.480
114 HG LEU 10 HG LEU 10 -5.714 7.985 -14.257
115 HD11 LEU 10 HD11 LEU 10 -6.396 7.245 -12.011
116 HD12 LEU 10 HD12 LEU 10 -5.616 8.677 -11.296
117 HD13 LEU 10 HD13 LEU 10 -7.026 8.866 -12.368
118 HD21 LEU 10 HD21 LEU 10 -4.327 10.005 -14.539
119 HD22 LEU 10 HD22 LEU 10 -5.793 10.432 -13.661
120 HD23 LEU 10 HD23 LEU 10 -4.265 10.228 -12.770
121 H LYS 11 H LYS 11 -1.327 8.784 -14.052
122 HA LYS 11 HA LYS 11 -2.256 10.698 -16.016
123 HB2 LYS 11 HB2 LYS 11 -0.217 11.917 -15.459
124 HB3 LYS 11 HB3 LYS 11 -1.036 11.366 -13.987
125 HG2 LYS 11 HG2 LYS 11 0.534 9.434 -13.858
126 HG3 LYS 11 HG3 LYS 11 1.382 10.043 -15.291
127 HD2 LYS 11 HD2 LYS 11 1.081 11.505 -12.632
128 HD3 LYS 11 HD3 LYS 11 2.541 10.690 -13.215
129 HE2 LYS 11 HE2 LYS 11 2.619 12.234 -15.155
130 HE3 LYS 11 HE3 LYS 11 1.171 13.063 -14.548
131 HZ1 LYS 11 HZ1 LYS 11 3.747 12.870 -13.136
132 HZ2 LYS 11 HZ2 LYS 11 3.185 14.195 -13.924
133 HZ3 LYS 11 HZ3 LYS 11 2.404 13.655 -12.586
134 H LEU 12 H LEU 12 -0.438 7.781 -16.248
135 HA LEU 12 HA LEU 12 1.011 8.556 -18.665
136 HB2 LEU 12 HB2 LEU 12 1.966 6.946 -17.110
137 HB3 LEU 12 HB3 LEU 12 0.530 5.915 -17.240
138 HG LEU 12 HG LEU 12 1.040 5.505 -19.643
139 HD11 LEU 12 HD11 LEU 12 3.575 7.081 -19.007
140 HD12 LEU 12 HD12 LEU 12 3.276 6.155 -20.498
141 HD13 LEU 12 HD13 LEU 12 2.292 7.584 -20.134
142 HD21 LEU 12 HD21 LEU 12 1.854 3.976 -17.888
143 HD22 LEU 12 HD22 LEU 12 2.993 4.072 -19.250
144 HD23 LEU 12 HD23 LEU 12 3.340 4.945 -17.735
145 H LEU 13 H LEU 13 -2.084 7.063 -17.817
146 HA LEU 13 HA LEU 13 -2.570 6.275 -20.617
147 HB2 LEU 13 HB2 LEU 13 -3.151 4.700 -18.853
148 HB3 LEU 13 HB3 LEU 13 -4.127 5.920 -18.028
149 HG LEU 13 HG LEU 13 -5.690 5.995 -19.959
150 HD11 LEU 13 HD11 LEU 13 -3.969 3.705 -21.016
151 HD12 LEU 13 HD12 LEU 13 -5.537 4.226 -21.691
152 HD13 LEU 13 HD13 LEU 13 -4.139 5.308 -21.760
153 HD21 LEU 13 HD21 LEU 13 -6.104 4.494 -18.053
154 HD22 LEU 13 HD22 LEU 13 -6.691 3.787 -19.577
155 HD23 LEU 13 HD23 LEU 13 -5.169 3.208 -18.858
156 H LYS 14 H LYS 14 -3.784 8.581 -18.153
157 HA LYS 14 HA LYS 14 -5.652 9.736 -20.123
158 HB2 LYS 14 HB2 LYS 14 -5.167 10.377 -17.187
159 HB3 LYS 14 HB3 LYS 14 -6.435 11.081 -18.207
160 HG2 LYS 14 HG2 LYS 14 -7.368 8.799 -18.590
161 HG3 LYS 14 HG3 LYS 14 -6.133 8.129 -17.504
162 HD2 LYS 14 HD2 LYS 14 -6.976 9.588 -15.670
163 HD3 LYS 14 HD3 LYS 14 -8.245 10.201 -16.746
164 HE2 LYS 14 HE2 LYS 14 -7.873 7.286 -15.929
165 HE3 LYS 14 HE3 LYS 14 -9.052 8.405 -15.233
166 HZ1 LYS 14 HZ1 LYS 14 -10.027 7.025 -16.931
167 HZ2 LYS 14 HZ2 LYS 14 -10.061 8.599 -17.393
168 HZ3 LYS 14 HZ3 LYS 14 -8.964 7.569 -18.058
169 HN1 NH2 15 HN1 NHE 15 -2.403 10.078 -19.489
170 HN2 NH2 15 HN2 NHE 15 -2.213 11.769 -19.898
Start of MODEL 3
1 H1 LYS 1 H1 LYS 1 -0.193 2.298 0.588
2 H2 LYS 1 H2 LYS 1 0.523 1.894 2.011
3 H3 LYS 1 H3 LYS 1 -0.502 0.838 1.276
4 HA LYS 1 HA LYS 1 2.098 1.723 0.238
5 HB2 LYS 1 HB2 LYS 1 2.345 0.253 2.155
6 HB3 LYS 1 HB3 LYS 1 1.241 -0.934 1.437
7 HG2 LYS 1 HG2 LYS 1 2.801 -1.290 -0.444
8 HG3 LYS 1 HG3 LYS 1 3.907 -0.078 0.229
9 HD2 LYS 1 HD2 LYS 1 3.073 -2.663 1.604
10 HD3 LYS 1 HD3 LYS 1 4.600 -2.405 0.739
11 HE2 LYS 1 HE2 LYS 1 5.179 -0.572 2.315
12 HE3 LYS 1 HE3 LYS 1 3.664 -0.848 3.190
13 HZ1 LYS 1 HZ1 LYS 1 5.499 -1.950 4.237
14 HZ2 LYS 1 HZ2 LYS 1 4.422 -3.064 3.685
15 HZ3 LYS 1 HZ3 LYS 1 5.833 -2.807 2.876
16 H LEU 2 H LEU 2 2.678 0.998 -1.797
17 HA LEU 2 HA LEU 2 2.320 0.545 -3.960
18 HB2 LEU 2 HB2 LEU 2 2.550 -1.712 -2.915
19 HB3 LEU 2 HB3 LEU 2 0.793 -1.842 -2.886
20 HG LEU 2 HG LEU 2 0.752 -1.672 -5.391
21 HD11 LEU 2 HD11 LEU 2 3.787 -1.677 -5.085
22 HD12 LEU 2 HD12 LEU 2 2.897 -1.912 -6.609
23 HD13 LEU 2 HD13 LEU 2 2.794 -0.359 -5.755
24 HD21 LEU 2 HD21 LEU 2 0.864 -3.858 -4.249
25 HD22 LEU 2 HD22 LEU 2 1.735 -3.884 -5.797
26 HD23 LEU 2 HD23 LEU 2 2.637 -3.783 -4.268
27 H LEU 3 H LEU 3 0.683 2.555 -3.190
28 HA LEU 3 HA LEU 3 -1.774 2.055 -4.803
29 HB2 LEU 3 HB2 LEU 3 -2.518 2.151 -2.534
30 HB3 LEU 3 HB3 LEU 3 -1.365 3.430 -2.141
31 HG LEU 3 HG LEU 3 -2.582 4.998 -3.599
32 HD11 LEU 3 HD11 LEU 3 -4.897 4.396 -4.321
33 HD12 LEU 3 HD12 LEU 3 -3.677 3.401 -5.142
34 HD13 LEU 3 HD13 LEU 3 -4.613 2.721 -3.788
35 HD21 LEU 3 HD21 LEU 3 -3.040 4.878 -1.182
36 HD22 LEU 3 HD22 LEU 3 -4.522 5.276 -2.078
37 HD23 LEU 3 HD23 LEU 3 -4.276 3.626 -1.466
38 H LYS 4 H LYS 4 0.882 4.235 -3.836
39 HA LYS 4 HA LYS 4 -0.007 6.459 -5.417
40 HB2 LYS 4 HB2 LYS 4 1.607 6.708 -3.585
41 HB3 LYS 4 HB3 LYS 4 2.731 5.606 -4.387
42 HG2 LYS 4 HG2 LYS 4 3.454 7.913 -4.672
43 HG3 LYS 4 HG3 LYS 4 3.023 7.215 -6.240
44 HD2 LYS 4 HD2 LYS 4 0.824 8.356 -6.157
45 HD3 LYS 4 HD3 LYS 4 1.223 9.000 -4.544
46 HE2 LYS 4 HE2 LYS 4 3.194 10.162 -5.514
47 HE3 LYS 4 HE3 LYS 4 2.774 9.543 -7.116
48 HZ1 LYS 4 HZ1 LYS 4 1.973 11.776 -6.788
49 HZ2 LYS 4 HZ2 LYS 4 0.702 10.752 -6.970
50 HZ3 LYS 4 HZ3 LYS 4 1.097 11.320 -5.474
51 H LEU 5 H LEU 5 1.669 3.466 -6.180
52 HA LEU 5 HA LEU 5 2.814 4.279 -8.662
53 HB2 LEU 5 HB2 LEU 5 3.493 2.242 -7.519
54 HB3 LEU 5 HB3 LEU 5 1.848 1.600 -7.589
55 HG LEU 5 HG LEU 5 1.976 1.494 -10.067
56 HD11 LEU 5 HD11 LEU 5 4.876 2.332 -9.615
57 HD12 LEU 5 HD12 LEU 5 4.201 1.755 -11.152
58 HD13 LEU 5 HD13 LEU 5 3.634 3.290 -10.462
59 HD21 LEU 5 HD21 LEU 5 4.262 0.110 -8.603
60 HD22 LEU 5 HD22 LEU 5 2.570 -0.446 -8.683
61 HD23 LEU 5 HD23 LEU 5 3.562 -0.394 -10.155
62 H LEU 6 H LEU 6 -0.492 3.501 -7.682
63 HA LEU 6 HA LEU 6 -1.372 2.865 -10.368
64 HB2 LEU 6 HB2 LEU 6 -3.006 3.657 -7.925
65 HB3 LEU 6 HB3 LEU 6 -3.610 2.881 -9.395
66 HG LEU 6 HG LEU 6 -1.626 1.669 -7.412
67 HD11 LEU 6 HD11 LEU 6 -4.507 0.968 -8.106
68 HD12 LEU 6 HD12 LEU 6 -3.463 0.101 -6.959
69 HD13 LEU 6 HD13 LEU 6 -3.970 1.771 -6.612
70 HD21 LEU 6 HD21 LEU 6 -2.867 0.516 -9.951
71 HD22 LEU 6 HD22 LEU 6 -1.142 0.888 -9.701
72 HD23 LEU 6 HD23 LEU 6 -1.915 -0.398 -8.760
73 H LYS 7 H LYS 7 -0.905 5.807 -8.523
74 HA LYS 7 HA LYS 7 -2.462 7.437 -10.427
75 HB2 LYS 7 HB2 LYS 7 -0.795 8.078 -7.968
76 HB3 LYS 7 HB3 LYS 7 -1.430 9.316 -9.054
77 HG2 LYS 7 HG2 LYS 7 -2.935 9.115 -7.218
78 HG3 LYS 7 HG3 LYS 7 -3.746 8.491 -8.660
79 HD2 LYS 7 HD2 LYS 7 -3.327 6.175 -7.925
80 HD3 LYS 7 HD3 LYS 7 -2.418 6.767 -6.518
81 HE2 LYS 7 HE2 LYS 7 -5.355 7.310 -7.112
82 HE3 LYS 7 HE3 LYS 7 -4.746 6.107 -5.975
83 HZ1 LYS 7 HZ1 LYS 7 -4.317 9.016 -5.770
84 HZ2 LYS 7 HZ2 LYS 7 -5.370 8.140 -4.869
85 HZ3 LYS 7 HZ3 LYS 7 -3.754 7.891 -4.711
86 H LYS 8 H LYS 8 0.842 6.363 -9.882
87 HA LYS 8 HA LYS 8 2.089 8.349 -11.575
88 HB2 LYS 8 HB2 LYS 8 3.309 7.166 -9.812
89 HB3 LYS 8 HB3 LYS 8 2.974 5.604 -10.587
90 HG2 LYS 8 HG2 LYS 8 4.304 6.239 -12.546
91 HG3 LYS 8 HG3 LYS 8 4.588 7.853 -11.858
92 HD2 LYS 8 HD2 LYS 8 5.759 6.815 -9.930
93 HD3 LYS 8 HD3 LYS 8 5.458 5.207 -10.624
94 HE2 LYS 8 HE2 LYS 8 6.740 5.841 -12.645
95 HE3 LYS 8 HE3 LYS 8 7.046 7.443 -11.954
96 HZ1 LYS 8 HZ1 LYS 8 8.888 5.956 -11.598
97 HZ2 LYS 8 HZ2 LYS 8 8.228 6.380 -10.157
98 HZ3 LYS 8 HZ3 LYS 8 7.941 4.889 -10.786
99 H LEU 9 H LEU 9 0.498 5.249 -12.117
100 HA LEU 9 HA LEU 9 1.444 5.161 -14.912
101 HB2 LEU 9 HB2 LEU 9 -0.325 3.313 -13.271
102 HB3 LEU 9 HB3 LEU 9 0.171 3.007 -14.946
103 HG LEU 9 HG LEU 9 2.114 3.384 -12.627
104 HD11 LEU 9 HD11 LEU 9 2.404 0.933 -12.741
105 HD12 LEU 9 HD12 LEU 9 0.732 1.366 -12.318
106 HD13 LEU 9 HD13 LEU 9 1.125 0.836 -13.973
107 HD21 LEU 9 HD21 LEU 9 3.725 2.349 -14.200
108 HD22 LEU 9 HD22 LEU 9 2.474 2.358 -15.473
109 HD23 LEU 9 HD23 LEU 9 3.105 3.888 -14.820
110 H LEU 10 H LEU 10 -1.200 6.466 -13.119
111 HA LEU 10 HA LEU 10 -3.292 6.127 -15.063
112 HB2 LEU 10 HB2 LEU 10 -3.829 6.611 -12.773
113 HB3 LEU 10 HB3 LEU 10 -2.791 8.046 -12.766
114 HG LEU 10 HG LEU 10 -4.317 9.167 -14.382
115 HD11 LEU 10 HD11 LEU 10 -5.258 7.214 -15.509
116 HD12 LEU 10 HD12 LEU 10 -5.992 6.656 -13.984
117 HD13 LEU 10 HD13 LEU 10 -6.559 8.156 -14.755
118 HD21 LEU 10 HD21 LEU 10 -4.585 9.485 -11.962
119 HD22 LEU 10 HD22 LEU 10 -6.154 9.521 -12.794
120 HD23 LEU 10 HD23 LEU 10 -5.667 8.070 -11.888
121 H LYS 11 H LYS 11 -0.744 8.595 -14.600
122 HA LYS 11 HA LYS 11 -1.930 10.483 -16.402
123 HB2 LYS 11 HB2 LYS 11 0.234 11.627 -16.259
124 HB3 LYS 11 HB3 LYS 11 -0.293 11.095 -14.655
125 HG2 LYS 11 HG2 LYS 11 1.189 9.092 -14.856
126 HG3 LYS 11 HG3 LYS 11 1.734 9.673 -16.444
127 HD2 LYS 11 HD2 LYS 11 2.560 11.763 -15.376
128 HD3 LYS 11 HD3 LYS 11 2.075 11.125 -13.787
129 HE2 LYS 11 HE2 LYS 11 3.570 9.186 -14.101
130 HE3 LYS 11 HE3 LYS 11 4.056 9.813 -15.690
131 HZ1 LYS 11 HZ1 LYS 11 5.642 10.387 -13.992
132 HZ2 LYS 11 HZ2 LYS 11 4.943 11.750 -14.585
133 HZ3 LYS 11 HZ3 LYS 11 4.496 11.169 -13.113
134 H LEU 12 H LEU 12 -0.441 7.475 -16.992
135 HA LEU 12 HA LEU 12 0.680 8.202 -19.600
136 HB2 LEU 12 HB2 LEU 12 0.258 5.459 -18.366
137 HB3 LEU 12 HB3 LEU 12 1.298 5.850 -19.739
138 HG LEU 12 HG LEU 12 1.699 6.842 -16.878
139 HD11 LEU 12 HD11 LEU 12 2.139 4.441 -17.177
140 HD12 LEU 12 HD12 LEU 12 3.225 4.807 -18.546
141 HD13 LEU 12 HD13 LEU 12 3.646 5.353 -16.905
142 HD21 LEU 12 HD21 LEU 12 2.539 8.467 -18.532
143 HD22 LEU 12 HD22 LEU 12 3.882 7.638 -17.735
144 HD23 LEU 12 HD23 LEU 12 3.406 7.166 -19.386
145 H LEU 13 H LEU 13 -2.444 7.779 -18.492
146 HA LEU 13 HA LEU 13 -3.364 6.957 -21.198
147 HB2 LEU 13 HB2 LEU 13 -3.485 4.961 -19.862
148 HB3 LEU 13 HB3 LEU 13 -4.146 5.857 -18.487
149 HG LEU 13 HG LEU 13 -6.229 6.293 -19.771
150 HD11 LEU 13 HD11 LEU 13 -6.650 4.925 -21.807
151 HD12 LEU 13 HD12 LEU 13 -5.324 6.075 -22.078
152 HD13 LEU 13 HD13 LEU 13 -4.960 4.361 -21.772
153 HD21 LEU 13 HD21 LEU 13 -5.986 4.426 -18.201
154 HD22 LEU 13 HD22 LEU 13 -7.058 3.987 -19.553
155 HD23 LEU 13 HD23 LEU 13 -5.375 3.385 -19.511
156 H LYS 14 H LYS 14 -3.951 8.711 -18.171
157 HA LYS 14 HA LYS 14 -6.087 10.238 -19.582
158 HB2 LYS 14 HB2 LYS 14 -5.644 9.863 -16.593
159 HB3 LYS 14 HB3 LYS 14 -6.920 10.838 -17.332
160 HG2 LYS 14 HG2 LYS 14 -6.582 7.826 -17.654
161 HG3 LYS 14 HG3 LYS 14 -7.762 8.648 -16.608
162 HD2 LYS 14 HD2 LYS 14 -8.769 9.721 -18.612
163 HD3 LYS 14 HD3 LYS 14 -7.645 8.810 -19.646
164 HE2 LYS 14 HE2 LYS 14 -8.532 6.683 -18.741
165 HE3 LYS 14 HE3 LYS 14 -9.655 7.586 -17.710
166 HZ1 LYS 14 HZ1 LYS 14 -10.716 6.846 -19.711
167 HZ2 LYS 14 HZ2 LYS 14 -10.659 8.486 -19.683
168 HZ3 LYS 14 HZ3 LYS 14 -9.626 7.647 -20.651
169 HN1 NH2 15 HN1 NHE 15 -2.936 10.423 -19.303
170 HN2 NH2 15 HN2 NHE 15 -2.707 12.123 -18.966
Start of MODEL 4
1 H1 LYS 1 H1 LYS 1 2.657 3.237 -0.785
2 H2 LYS 1 H2 LYS 1 4.049 3.000 0.051
3 H3 LYS 1 H3 LYS 1 3.266 1.718 -0.624
4 HA LYS 1 HA LYS 1 4.516 3.946 -2.074
5 HB2 LYS 1 HB2 LYS 1 6.199 2.503 -1.084
6 HB3 LYS 1 HB3 LYS 1 5.420 1.066 -1.770
7 HG2 LYS 1 HG2 LYS 1 5.859 1.901 -4.061
8 HG3 LYS 1 HG3 LYS 1 6.592 3.376 -3.383
9 HD2 LYS 1 HD2 LYS 1 8.322 1.994 -2.280
10 HD3 LYS 1 HD3 LYS 1 7.578 0.525 -2.939
11 HE2 LYS 1 HE2 LYS 1 7.960 1.383 -5.242
12 HE3 LYS 1 HE3 LYS 1 8.706 2.841 -4.570
13 HZ1 LYS 1 HZ1 LYS 1 9.692 0.091 -4.207
14 HZ2 LYS 1 HZ2 LYS 1 10.353 1.219 -5.203
15 HZ3 LYS 1 HZ3 LYS 1 10.392 1.436 -3.577
16 H LEU 2 H LEU 2 3.213 0.587 -2.568
17 HA LEU 2 HA LEU 2 3.000 1.009 -5.389
18 HB2 LEU 2 HB2 LEU 2 1.712 -1.095 -3.616
19 HB3 LEU 2 HB3 LEU 2 1.865 -1.185 -5.379
20 HG LEU 2 HG LEU 2 4.213 -1.066 -3.430
21 HD11 LEU 2 HD11 LEU 2 3.051 -3.358 -5.069
22 HD12 LEU 2 HD12 LEU 2 4.523 -3.430 -4.072
23 HD13 LEU 2 HD13 LEU 2 2.940 -3.179 -3.301
24 HD21 LEU 2 HD21 LEU 2 4.076 -1.519 -6.439
25 HD22 LEU 2 HD22 LEU 2 4.775 -0.096 -5.627
26 HD23 LEU 2 HD23 LEU 2 5.538 -1.685 -5.441
27 H LEU 3 H LEU 3 1.047 2.402 -3.023
28 HA LEU 3 HA LEU 3 -1.478 2.149 -4.500
29 HB2 LEU 3 HB2 LEU 3 -1.642 2.168 -2.112
30 HB3 LEU 3 HB3 LEU 3 -0.514 3.530 -1.983
31 HG LEU 3 HG LEU 3 -2.133 5.014 -3.066
32 HD11 LEU 3 HD11 LEU 3 -3.438 3.335 -4.363
33 HD12 LEU 3 HD12 LEU 3 -4.025 2.623 -2.841
34 HD13 LEU 3 HD13 LEU 3 -4.499 4.277 -3.296
35 HD21 LEU 3 HD21 LEU 3 -2.025 4.852 -0.620
36 HD22 LEU 3 HD22 LEU 3 -3.687 5.169 -1.157
37 HD23 LEU 3 HD23 LEU 3 -3.215 3.529 -0.637
38 H LYS 4 H LYS 4 1.135 4.525 -3.890
39 HA LYS 4 HA LYS 4 -0.086 6.596 -5.509
40 HB2 LYS 4 HB2 LYS 4 1.515 7.100 -3.719
41 HB3 LYS 4 HB3 LYS 4 2.772 6.152 -4.537
42 HG2 LYS 4 HG2 LYS 4 2.791 7.717 -6.423
43 HG3 LYS 4 HG3 LYS 4 1.431 8.619 -5.717
44 HD2 LYS 4 HD2 LYS 4 2.823 9.181 -3.750
45 HD3 LYS 4 HD3 LYS 4 4.176 8.257 -4.437
46 HE2 LYS 4 HE2 LYS 4 4.180 9.751 -6.413
47 HE3 LYS 4 HE3 LYS 4 2.836 10.676 -5.712
48 HZ1 LYS 4 HZ1 LYS 4 5.503 10.365 -4.505
49 HZ2 LYS 4 HZ2 LYS 4 4.962 11.706 -5.284
50 HZ3 LYS 4 HZ3 LYS 4 4.259 11.238 -3.877
51 H LEU 5 H LEU 5 1.735 3.697 -6.151
52 HA LEU 5 HA LEU 5 2.831 4.457 -8.680
53 HB2 LEU 5 HB2 LEU 5 3.634 2.512 -7.470
54 HB3 LEU 5 HB3 LEU 5 2.016 1.782 -7.497
55 HG LEU 5 HG LEU 5 2.142 1.551 -9.955
56 HD11 LEU 5 HD11 LEU 5 4.973 2.641 -9.579
57 HD12 LEU 5 HD12 LEU 5 4.340 1.914 -11.071
58 HD13 LEU 5 HD13 LEU 5 3.655 3.438 -10.476
59 HD21 LEU 5 HD21 LEU 5 4.552 0.433 -8.464
60 HD22 LEU 5 HD22 LEU 5 2.918 -0.264 -8.474
61 HD23 LEU 5 HD23 LEU 5 3.863 -0.209 -9.975
62 H LEU 6 H LEU 6 -0.421 3.586 -7.641
63 HA LEU 6 HA LEU 6 -1.357 2.794 -10.251
64 HB2 LEU 6 HB2 LEU 6 -2.922 3.899 -7.878
65 HB3 LEU 6 HB3 LEU 6 -3.596 3.001 -9.249
66 HG LEU 6 HG LEU 6 -1.629 1.916 -7.190
67 HD11 LEU 6 HD11 LEU 6 -4.565 1.310 -7.724
68 HD12 LEU 6 HD12 LEU 6 -3.542 0.535 -6.489
69 HD13 LEU 6 HD13 LEU 6 -3.940 2.262 -6.358
70 HD21 LEU 6 HD21 LEU 6 -2.070 -0.274 -8.270
71 HD22 LEU 6 HD22 LEU 6 -3.021 0.541 -9.531
72 HD23 LEU 6 HD23 LEU 6 -1.270 0.841 -9.387
73 H LYS 7 H LYS 7 -0.952 5.878 -8.574
74 HA LYS 7 HA LYS 7 -2.499 7.433 -10.499
75 HB2 LYS 7 HB2 LYS 7 -0.360 8.293 -8.516
76 HB3 LYS 7 HB3 LYS 7 -1.559 9.343 -9.285
77 HG2 LYS 7 HG2 LYS 7 -3.373 8.267 -8.078
78 HG3 LYS 7 HG3 LYS 7 -2.277 7.011 -7.445
79 HD2 LYS 7 HD2 LYS 7 -0.941 8.720 -6.297
80 HD3 LYS 7 HD3 LYS 7 -2.054 9.986 -6.850
81 HE2 LYS 7 HE2 LYS 7 -2.803 7.604 -5.098
82 HE3 LYS 7 HE3 LYS 7 -2.537 9.253 -4.520
83 HZ1 LYS 7 HZ1 LYS 7 -4.864 8.805 -4.840
84 HZ2 LYS 7 HZ2 LYS 7 -4.382 9.961 -5.901
85 HZ3 LYS 7 HZ3 LYS 7 -4.641 8.426 -6.418
86 H LYS 8 H LYS 8 0.908 6.620 -9.902
87 HA LYS 8 HA LYS 8 2.065 8.280 -11.906
88 HB2 LYS 8 HB2 LYS 8 3.339 7.280 -10.072
89 HB3 LYS 8 HB3 LYS 8 2.980 5.649 -10.668
90 HG2 LYS 8 HG2 LYS 8 4.273 6.061 -12.711
91 HG3 LYS 8 HG3 LYS 8 4.542 7.753 -12.226
92 HD2 LYS 8 HD2 LYS 8 5.772 6.994 -10.229
93 HD3 LYS 8 HD3 LYS 8 5.458 5.302 -10.657
94 HE2 LYS 8 HE2 LYS 8 7.723 5.951 -11.337
95 HE3 LYS 8 HE3 LYS 8 6.732 5.591 -12.760
96 HZ1 LYS 8 HZ1 LYS 8 6.419 7.956 -13.054
97 HZ2 LYS 8 HZ2 LYS 8 7.325 8.283 -11.724
98 HZ3 LYS 8 HZ3 LYS 8 8.021 7.588 -13.036
99 H LEU 9 H LEU 9 0.465 5.127 -12.120
100 HA LEU 9 HA LEU 9 1.340 4.808 -14.925
101 HB2 LEU 9 HB2 LEU 9 -0.384 3.123 -13.070
102 HB3 LEU 9 HB3 LEU 9 0.017 2.674 -14.734
103 HG LEU 9 HG LEU 9 2.099 3.198 -12.569
104 HD11 LEU 9 HD11 LEU 9 0.978 0.576 -13.656
105 HD12 LEU 9 HD12 LEU 9 2.320 0.738 -12.494
106 HD13 LEU 9 HD13 LEU 9 0.685 1.248 -12.032
107 HD21 LEU 9 HD21 LEU 9 2.977 3.503 -14.843
108 HD22 LEU 9 HD22 LEU 9 3.597 1.997 -14.153
109 HD23 LEU 9 HD23 LEU 9 2.272 1.934 -15.337
110 H LEU 10 H LEU 10 -1.346 6.146 -13.130
111 HA LEU 10 HA LEU 10 -3.309 5.744 -15.227
112 HB2 LEU 10 HB2 LEU 10 -4.021 5.875 -12.959
113 HB3 LEU 10 HB3 LEU 10 -3.219 7.426 -12.696
114 HG LEU 10 HG LEU 10 -5.315 7.263 -14.852
115 HD11 LEU 10 HD11 LEU 10 -5.890 7.442 -11.865
116 HD12 LEU 10 HD12 LEU 10 -7.074 7.697 -13.166
117 HD13 LEU 10 HD13 LEU 10 -6.332 6.095 -12.940
118 HD21 LEU 10 HD21 LEU 10 -4.588 9.354 -12.739
119 HD22 LEU 10 HD22 LEU 10 -4.078 9.405 -14.441
120 HD23 LEU 10 HD23 LEU 10 -5.796 9.556 -14.028
121 H LYS 11 H LYS 11 -1.004 8.311 -14.353
122 HA LYS 11 HA LYS 11 -2.163 10.288 -16.093
123 HB2 LYS 11 HB2 LYS 11 -0.054 11.504 -15.722
124 HB3 LYS 11 HB3 LYS 11 -0.753 10.899 -14.209
125 HG2 LYS 11 HG2 LYS 11 0.839 9.026 -14.182
126 HG3 LYS 11 HG3 LYS 11 1.485 9.520 -15.756
127 HD2 LYS 11 HD2 LYS 11 2.952 10.269 -13.928
128 HD3 LYS 11 HD3 LYS 11 2.260 11.650 -14.795
129 HE2 LYS 11 HE2 LYS 11 0.550 11.913 -13.027
130 HE3 LYS 11 HE3 LYS 11 1.212 10.507 -12.171
131 HZ1 LYS 11 HZ1 LYS 11 3.277 11.707 -11.941
132 HZ2 LYS 11 HZ2 LYS 11 2.649 13.014 -12.722
133 HZ3 LYS 11 HZ3 LYS 11 2.041 12.555 -11.270
134 H LEU 12 H LEU 12 -0.529 7.408 -16.817
135 HA LEU 12 HA LEU 12 0.791 8.371 -19.236
136 HB2 LEU 12 HB2 LEU 12 0.191 5.527 -18.329
137 HB3 LEU 12 HB3 LEU 12 1.334 6.018 -19.582
138 HG LEU 12 HG LEU 12 1.544 6.708 -16.616
139 HD11 LEU 12 HD11 LEU 12 1.956 4.330 -17.138
140 HD12 LEU 12 HD12 LEU 12 3.148 4.806 -18.372
141 HD13 LEU 12 HD13 LEU 12 3.457 5.159 -16.658
142 HD21 LEU 12 HD21 LEU 12 2.555 8.469 -18.026
143 HD22 LEU 12 HD22 LEU 12 3.806 7.521 -17.211
144 HD23 LEU 12 HD23 LEU 12 3.464 7.231 -18.931
145 H LEU 13 H LEU 13 -2.438 7.679 -18.399
146 HA LEU 13 HA LEU 13 -3.128 7.299 -21.279
147 HB2 LEU 13 HB2 LEU 13 -4.384 5.931 -18.867
148 HB3 LEU 13 HB3 LEU 13 -4.980 5.812 -20.524
149 HG LEU 13 HG LEU 13 -2.212 4.893 -19.617
150 HD11 LEU 13 HD11 LEU 13 -4.741 3.312 -20.217
151 HD12 LEU 13 HD12 LEU 13 -3.140 2.627 -19.838
152 HD13 LEU 13 HD13 LEU 13 -4.023 3.560 -18.609
153 HD21 LEU 13 HD21 LEU 13 -3.768 4.461 -22.215
154 HD22 LEU 13 HD22 LEU 13 -2.330 5.485 -22.029
155 HD23 LEU 13 HD23 LEU 13 -2.200 3.727 -21.812
156 H LYS 14 H LYS 14 -3.687 8.957 -18.267
157 HA LYS 14 HA LYS 14 -6.108 10.245 -19.410
158 HB2 LYS 14 HB2 LYS 14 -5.050 10.224 -16.562
159 HB3 LYS 14 HB3 LYS 14 -6.541 11.003 -17.102
160 HG2 LYS 14 HG2 LYS 14 -5.932 8.015 -17.170
161 HG3 LYS 14 HG3 LYS 14 -7.020 8.836 -16.047
162 HD2 LYS 14 HD2 LYS 14 -7.375 8.583 -19.063
163 HD3 LYS 14 HD3 LYS 14 -8.294 7.728 -17.815
164 HE2 LYS 14 HE2 LYS 14 -8.272 10.747 -18.222
165 HE3 LYS 14 HE3 LYS 14 -9.550 9.644 -18.766
166 HZ1 LYS 14 HZ1 LYS 14 -8.765 10.064 -15.961
167 HZ2 LYS 14 HZ2 LYS 14 -10.104 10.672 -16.696
168 HZ3 LYS 14 HZ3 LYS 14 -9.942 9.048 -16.494
169 HN1 NH2 15 HN1 NHE 15 -2.885 10.727 -19.574
170 HN2 NH2 15 HN2 NHE 15 -2.841 12.473 -19.502
Start of MODEL 5
1 H1 LYS 1 H1 LYS 1 5.156 4.680 -3.453
2 H2 LYS 1 H2 LYS 1 6.110 3.376 -3.772
3 H3 LYS 1 H3 LYS 1 6.252 4.162 -2.336
4 HA LYS 1 HA LYS 1 5.095 2.098 -2.065
5 HB2 LYS 1 HB2 LYS 1 4.608 4.011 -0.582
6 HB3 LYS 1 HB3 LYS 1 3.334 4.549 -1.690
7 HG2 LYS 1 HG2 LYS 1 2.122 2.413 -1.327
8 HG3 LYS 1 HG3 LYS 1 3.393 1.872 -0.220
9 HD2 LYS 1 HD2 LYS 1 1.625 4.326 0.149
10 HD3 LYS 1 HD3 LYS 1 1.416 2.776 0.980
11 HE2 LYS 1 HE2 LYS 1 3.848 4.595 1.212
12 HE3 LYS 1 HE3 LYS 1 2.538 4.476 2.390
13 HZ1 LYS 1 HZ1 LYS 1 3.088 2.179 2.723
14 HZ2 LYS 1 HZ2 LYS 1 4.321 2.259 1.636
15 HZ3 LYS 1 HZ3 LYS 1 4.393 3.128 3.030
16 H LEU 2 H LEU 2 3.445 0.666 -2.683
17 HA LEU 2 HA LEU 2 2.891 0.736 -5.466
18 HB2 LEU 2 HB2 LEU 2 1.708 -1.029 -3.294
19 HB3 LEU 2 HB3 LEU 2 1.678 -1.360 -5.030
20 HG LEU 2 HG LEU 2 4.197 -1.145 -3.319
21 HD11 LEU 2 HD11 LEU 2 2.790 -3.530 -4.583
22 HD12 LEU 2 HD12 LEU 2 4.341 -3.580 -3.719
23 HD13 LEU 2 HD13 LEU 2 2.847 -3.162 -2.845
24 HD21 LEU 2 HD21 LEU 2 4.630 -0.465 -5.653
25 HD22 LEU 2 HD22 LEU 2 5.311 -2.074 -5.350
26 HD23 LEU 2 HD23 LEU 2 3.786 -1.919 -6.241
27 H LEU 3 H LEU 3 1.168 2.365 -2.992
28 HA LEU 3 HA LEU 3 -1.464 2.064 -4.281
29 HB2 LEU 3 HB2 LEU 3 -0.644 4.071 -2.151
30 HB3 LEU 3 HB3 LEU 3 -2.278 3.501 -2.537
31 HG LEU 3 HG LEU 3 -0.020 1.841 -1.348
32 HD11 LEU 3 HD11 LEU 3 -2.608 2.888 -0.131
33 HD12 LEU 3 HD12 LEU 3 -1.419 1.852 0.691
34 HD13 LEU 3 HD13 LEU 3 -0.976 3.507 0.212
35 HD21 LEU 3 HD21 LEU 3 -1.526 0.448 -2.729
36 HD22 LEU 3 HD22 LEU 3 -1.783 0.115 -1.006
37 HD23 LEU 3 HD23 LEU 3 -2.940 1.129 -1.888
38 H LYS 4 H LYS 4 1.114 4.506 -3.923
39 HA LYS 4 HA LYS 4 -0.221 6.388 -5.700
40 HB2 LYS 4 HB2 LYS 4 2.585 6.255 -4.528
41 HB3 LYS 4 HB3 LYS 4 2.046 7.540 -5.624
42 HG2 LYS 4 HG2 LYS 4 0.199 8.107 -4.107
43 HG3 LYS 4 HG3 LYS 4 0.717 6.833 -2.980
44 HD2 LYS 4 HD2 LYS 4 2.912 7.972 -2.720
45 HD3 LYS 4 HD3 LYS 4 2.378 9.251 -3.828
46 HE2 LYS 4 HE2 LYS 4 0.513 9.805 -2.296
47 HE3 LYS 4 HE3 LYS 4 1.036 8.523 -1.191
48 HZ1 LYS 4 HZ1 LYS 4 1.848 10.686 -0.527
49 HZ2 LYS 4 HZ2 LYS 4 3.109 9.696 -0.910
50 HZ3 LYS 4 HZ3 LYS 4 2.639 10.878 -1.952
51 H LEU 5 H LEU 5 1.610 3.515 -6.183
52 HA LEU 5 HA LEU 5 2.838 4.202 -8.674
53 HB2 LEU 5 HB2 LEU 5 3.499 2.238 -7.389
54 HB3 LEU 5 HB3 LEU 5 1.863 1.561 -7.515
55 HG LEU 5 HG LEU 5 2.123 1.336 -9.961
56 HD11 LEU 5 HD11 LEU 5 3.738 3.166 -10.389
57 HD12 LEU 5 HD12 LEU 5 4.966 2.309 -9.416
58 HD13 LEU 5 HD13 LEU 5 4.393 1.622 -10.955
59 HD21 LEU 5 HD21 LEU 5 2.726 -0.506 -8.448
60 HD22 LEU 5 HD22 LEU 5 3.773 -0.490 -9.882
61 HD23 LEU 5 HD23 LEU 5 4.390 0.120 -8.331
62 H LEU 6 H LEU 6 -0.476 3.361 -7.747
63 HA LEU 6 HA LEU 6 -1.337 2.732 -10.435
64 HB2 LEU 6 HB2 LEU 6 -2.945 3.620 -8.002
65 HB3 LEU 6 HB3 LEU 6 -3.595 2.866 -9.462
66 HG LEU 6 HG LEU 6 -1.628 1.564 -7.534
67 HD11 LEU 6 HD11 LEU 6 -4.601 1.102 -7.999
68 HD12 LEU 6 HD12 LEU 6 -3.560 0.163 -6.902
69 HD13 LEU 6 HD13 LEU 6 -3.873 1.881 -6.572
70 HD21 LEU 6 HD21 LEU 6 -3.144 0.453 -9.934
71 HD22 LEU 6 HD22 LEU 6 -1.377 0.682 -9.825
72 HD23 LEU 6 HD23 LEU 6 -2.180 -0.514 -8.791
73 H LYS 7 H LYS 7 -1.070 5.684 -8.486
74 HA LYS 7 HA LYS 7 -2.559 7.332 -10.386
75 HB2 LYS 7 HB2 LYS 7 -0.608 8.131 -8.195
76 HB3 LYS 7 HB3 LYS 7 -1.804 9.179 -8.984
77 HG2 LYS 7 HG2 LYS 7 -3.641 7.945 -7.965
78 HG3 LYS 7 HG3 LYS 7 -2.531 6.697 -7.359
79 HD2 LYS 7 HD2 LYS 7 -3.047 8.191 -5.528
80 HD3 LYS 7 HD3 LYS 7 -1.352 8.382 -6.011
81 HE2 LYS 7 HE2 LYS 7 -2.360 10.566 -5.585
82 HE3 LYS 7 HE3 LYS 7 -1.930 10.418 -7.292
83 HZ1 LYS 7 HZ1 LYS 7 -4.621 10.043 -6.153
84 HZ2 LYS 7 HZ2 LYS 7 -4.114 11.363 -6.988
85 HZ3 LYS 7 HZ3 LYS 7 -4.242 9.919 -7.754
86 H LYS 8 H LYS 8 0.844 6.673 -9.568
87 HA LYS 8 HA LYS 8 2.070 8.473 -11.391
88 HB2 LYS 8 HB2 LYS 8 3.246 7.358 -9.564
89 HB3 LYS 8 HB3 LYS 8 2.992 5.776 -10.326
90 HG2 LYS 8 HG2 LYS 8 4.384 6.401 -12.229
91 HG3 LYS 8 HG3 LYS 8 4.550 8.059 -11.593
92 HD2 LYS 8 HD2 LYS 8 5.654 7.137 -9.558
93 HD3 LYS 8 HD3 LYS 8 5.544 5.506 -10.246
94 HE2 LYS 8 HE2 LYS 8 7.018 7.866 -11.494
95 HE3 LYS 8 HE3 LYS 8 7.778 6.551 -10.585
96 HZ1 LYS 8 HZ1 LYS 8 6.979 5.019 -12.248
97 HZ2 LYS 8 HZ2 LYS 8 6.265 6.236 -13.097
98 HZ3 LYS 8 HZ3 LYS 8 7.899 6.186 -12.946
99 H LEU 9 H LEU 9 0.496 5.372 -12.003
100 HA LEU 9 HA LEU 9 1.583 5.359 -14.763
101 HB2 LEU 9 HB2 LEU 9 -0.048 3.344 -13.169
102 HB3 LEU 9 HB3 LEU 9 0.427 3.120 -14.863
103 HG LEU 9 HG LEU 9 2.403 3.552 -12.575
104 HD11 LEU 9 HD11 LEU 9 2.825 1.125 -12.776
105 HD12 LEU 9 HD12 LEU 9 1.151 1.459 -12.285
106 HD13 LEU 9 HD13 LEU 9 1.512 1.002 -13.971
107 HD21 LEU 9 HD21 LEU 9 2.756 2.623 -15.459
108 HD22 LEU 9 HD22 LEU 9 3.290 4.179 -14.792
109 HD23 LEU 9 HD23 LEU 9 4.032 2.665 -14.223
110 H LEU 10 H LEU 10 -1.196 6.496 -13.051
111 HA LEU 10 HA LEU 10 -3.154 5.990 -15.100
112 HB2 LEU 10 HB2 LEU 10 -3.821 6.322 -12.842
113 HB3 LEU 10 HB3 LEU 10 -2.999 7.883 -12.723
114 HG LEU 10 HG LEU 10 -5.154 7.576 -14.805
115 HD11 LEU 10 HD11 LEU 10 -5.658 7.988 -11.824
116 HD12 LEU 10 HD12 LEU 10 -6.863 8.139 -13.125
117 HD13 LEU 10 HD13 LEU 10 -6.130 6.561 -12.777
118 HD21 LEU 10 HD21 LEU 10 -3.891 9.723 -14.596
119 HD22 LEU 10 HD22 LEU 10 -5.587 9.935 -14.127
120 HD23 LEU 10 HD23 LEU 10 -4.334 9.807 -12.879
121 H LYS 11 H LYS 11 -0.710 8.496 -14.599
122 HA LYS 11 HA LYS 11 -1.913 10.444 -16.337
123 HB2 LYS 11 HB2 LYS 11 0.265 11.539 -16.256
124 HB3 LYS 11 HB3 LYS 11 -0.190 10.975 -14.640
125 HG2 LYS 11 HG2 LYS 11 1.265 8.968 -14.949
126 HG3 LYS 11 HG3 LYS 11 1.742 9.580 -16.549
127 HD2 LYS 11 HD2 LYS 11 2.601 11.660 -15.462
128 HD3 LYS 11 HD3 LYS 11 2.194 10.977 -13.873
129 HE2 LYS 11 HE2 LYS 11 3.717 9.072 -14.292
130 HE3 LYS 11 HE3 LYS 11 4.103 9.725 -15.894
131 HZ1 LYS 11 HZ1 LYS 11 5.011 11.665 -14.819
132 HZ2 LYS 11 HZ2 LYS 11 4.652 11.062 -13.333
133 HZ3 LYS 11 HZ3 LYS 11 5.768 10.313 -14.283
134 H LEU 12 H LEU 12 -0.486 7.411 -17.022
135 HA LEU 12 HA LEU 12 0.545 8.162 -19.654
136 HB2 LEU 12 HB2 LEU 12 0.065 5.419 -18.431
137 HB3 LEU 12 HB3 LEU 12 1.056 5.775 -19.853
138 HG LEU 12 HG LEU 12 1.627 6.753 -17.016
139 HD11 LEU 12 HD11 LEU 12 1.936 4.327 -17.290
140 HD12 LEU 12 HD12 LEU 12 2.950 4.607 -18.719
141 HD13 LEU 12 HD13 LEU 12 3.499 5.155 -17.117
142 HD21 LEU 12 HD21 LEU 12 3.811 7.422 -17.989
143 HD22 LEU 12 HD22 LEU 12 3.240 6.947 -19.604
144 HD23 LEU 12 HD23 LEU 12 2.479 8.311 -18.754
145 H LEU 13 H LEU 13 -2.546 7.554 -18.371
146 HA LEU 13 HA LEU 13 -3.586 6.902 -21.089
147 HB2 LEU 13 HB2 LEU 13 -4.562 5.823 -18.415
148 HB3 LEU 13 HB3 LEU 13 -5.334 5.530 -19.978
149 HG LEU 13 HG LEU 13 -2.484 4.690 -19.290
150 HD11 LEU 13 HD11 LEU 13 -5.070 3.085 -19.379
151 HD12 LEU 13 HD12 LEU 13 -3.438 2.418 -19.151
152 HD13 LEU 13 HD13 LEU 13 -4.143 3.489 -17.919
153 HD21 LEU 13 HD21 LEU 13 -2.884 5.011 -21.719
154 HD22 LEU 13 HD22 LEU 13 -2.729 3.291 -21.318
155 HD23 LEU 13 HD23 LEU 13 -4.337 3.990 -21.614
156 H LYS 14 H LYS 14 -3.523 9.114 -18.547
157 HA LYS 14 HA LYS 14 -6.082 10.320 -19.488
158 HB2 LYS 14 HB2 LYS 14 -4.896 10.402 -16.696
159 HB3 LYS 14 HB3 LYS 14 -6.358 11.255 -17.210
160 HG2 LYS 14 HG2 LYS 14 -6.005 8.228 -17.222
161 HG3 LYS 14 HG3 LYS 14 -6.851 9.166 -15.983
162 HD2 LYS 14 HD2 LYS 14 -8.459 9.986 -17.660
163 HD3 LYS 14 HD3 LYS 14 -7.639 9.044 -18.924
164 HE2 LYS 14 HE2 LYS 14 -8.103 6.959 -17.669
165 HE3 LYS 14 HE3 LYS 14 -8.918 7.895 -16.410
166 HZ1 LYS 14 HZ1 LYS 14 -9.740 7.746 -19.231
167 HZ2 LYS 14 HZ2 LYS 14 -10.467 6.962 -17.982
168 HZ3 LYS 14 HZ3 LYS 14 -10.514 8.604 -18.061
169 HN1 NH2 15 HN1 NHE 15 -2.916 10.581 -19.947
170 HN2 NH2 15 HN2 NHE 15 -2.719 12.318 -19.947
Start of MODEL 6
1 H1 LYS 1 H1 LYS 1 3.998 3.568 -1.374
2 H2 LYS 1 H2 LYS 1 5.149 2.464 -1.768
3 H3 LYS 1 H3 LYS 1 4.729 2.675 -0.196
4 HA LYS 1 HA LYS 1 3.793 0.662 -1.039
5 HB2 LYS 1 HB2 LYS 1 2.595 1.909 0.707
6 HB3 LYS 1 HB3 LYS 1 1.737 2.842 -0.522
7 HG2 LYS 1 HG2 LYS 1 0.632 0.817 -1.356
8 HG3 LYS 1 HG3 LYS 1 1.577 -0.190 -0.240
9 HD2 LYS 1 HD2 LYS 1 0.552 0.992 1.686
10 HD3 LYS 1 HD3 LYS 1 -0.404 1.988 0.563
11 HE2 LYS 1 HE2 LYS 1 -1.466 -0.060 -0.340
12 HE3 LYS 1 HE3 LYS 1 -0.512 -1.055 0.772
13 HZ1 LYS 1 HZ1 LYS 1 -2.711 -0.631 1.614
14 HZ2 LYS 1 HZ2 LYS 1 -1.599 0.061 2.599
15 HZ3 LYS 1 HZ3 LYS 1 -2.471 0.996 1.568
16 H LEU 2 H LEU 2 2.614 -0.453 -2.621
17 HA LEU 2 HA LEU 2 2.923 0.636 -5.228
18 HB2 LEU 2 HB2 LEU 2 2.401 -1.457 -6.026
19 HB3 LEU 2 HB3 LEU 2 3.129 -1.800 -4.464
20 HG LEU 2 HG LEU 2 0.130 -1.774 -5.082
21 HD11 LEU 2 HD11 LEU 2 2.077 -4.048 -4.532
22 HD12 LEU 2 HD12 LEU 2 0.325 -4.212 -4.802
23 HD13 LEU 2 HD13 LEU 2 1.379 -3.638 -6.116
24 HD21 LEU 2 HD21 LEU 2 1.633 -2.584 -2.555
25 HD22 LEU 2 HD22 LEU 2 0.528 -1.191 -2.720
26 HD23 LEU 2 HD23 LEU 2 -0.095 -2.846 -2.857
27 H LEU 3 H LEU 3 0.603 1.678 -3.202
28 HA LEU 3 HA LEU 3 -1.695 1.473 -5.025
29 HB2 LEU 3 HB2 LEU 3 -2.198 1.256 -2.708
30 HB3 LEU 3 HB3 LEU 3 -1.154 2.624 -2.273
31 HG LEU 3 HG LEU 3 -2.656 4.170 -3.449
32 HD11 LEU 3 HD11 LEU 3 -3.695 2.603 -5.070
33 HD12 LEU 3 HD12 LEU 3 -4.446 1.708 -3.730
34 HD13 LEU 3 HD13 LEU 3 -4.944 3.376 -4.077
35 HD21 LEU 3 HD21 LEU 3 -4.480 4.080 -1.779
36 HD22 LEU 3 HD22 LEU 3 -4.014 2.421 -1.359
37 HD23 LEU 3 HD23 LEU 3 -2.897 3.767 -1.034
38 H LYS 4 H LYS 4 0.751 3.826 -3.886
39 HA LYS 4 HA LYS 4 -0.367 6.038 -5.378
40 HB2 LYS 4 HB2 LYS 4 1.058 6.346 -3.396
41 HB3 LYS 4 HB3 LYS 4 2.407 5.537 -4.218
42 HG2 LYS 4 HG2 LYS 4 2.522 7.325 -5.890
43 HG3 LYS 4 HG3 LYS 4 1.085 8.106 -5.178
44 HD2 LYS 4 HD2 LYS 4 2.307 8.427 -3.058
45 HD3 LYS 4 HD3 LYS 4 3.744 7.647 -3.757
46 HE2 LYS 4 HE2 LYS 4 3.830 9.406 -5.509
47 HE3 LYS 4 HE3 LYS 4 2.400 10.177 -4.809
48 HZ1 LYS 4 HZ1 LYS 4 4.983 9.817 -3.447
49 HZ2 LYS 4 HZ2 LYS 4 4.408 11.225 -4.058
50 HZ3 LYS 4 HZ3 LYS 4 3.648 10.513 -2.786
51 H LEU 5 H LEU 5 1.547 3.252 -6.171
52 HA LEU 5 HA LEU 5 2.860 4.298 -8.496
53 HB2 LEU 5 HB2 LEU 5 3.568 2.211 -7.480
54 HB3 LEU 5 HB3 LEU 5 1.954 1.509 -7.696
55 HG LEU 5 HG LEU 5 2.225 1.578 -10.151
56 HD11 LEU 5 HD11 LEU 5 4.481 2.043 -11.095
57 HD12 LEU 5 HD12 LEU 5 3.784 3.487 -10.342
58 HD13 LEU 5 HD13 LEU 5 5.048 2.554 -9.489
59 HD21 LEU 5 HD21 LEU 5 2.880 -0.417 -8.854
60 HD22 LEU 5 HD22 LEU 5 3.911 -0.202 -10.287
61 HD23 LEU 5 HD23 LEU 5 4.522 0.238 -8.671
62 H LEU 6 H LEU 6 -0.453 3.248 -7.821
63 HA LEU 6 HA LEU 6 -1.173 2.894 -10.602
64 HB2 LEU 6 HB2 LEU 6 -2.946 3.419 -8.182
65 HB3 LEU 6 HB3 LEU 6 -3.458 2.757 -9.743
66 HG LEU 6 HG LEU 6 -1.547 1.434 -7.766
67 HD11 LEU 6 HD11 LEU 6 -4.394 0.760 -8.604
68 HD12 LEU 6 HD12 LEU 6 -3.388 -0.167 -7.463
69 HD13 LEU 6 HD13 LEU 6 -3.912 1.479 -7.049
70 HD21 LEU 6 HD21 LEU 6 -0.984 0.814 -10.088
71 HD22 LEU 6 HD22 LEU 6 -1.775 -0.548 -9.262
72 HD23 LEU 6 HD23 LEU 6 -2.692 0.440 -10.416
73 H LYS 7 H LYS 7 -0.859 5.645 -8.455
74 HA LYS 7 HA LYS 7 -2.460 7.391 -10.207
75 HB2 LYS 7 HB2 LYS 7 -0.864 7.815 -7.657
76 HB3 LYS 7 HB3 LYS 7 -1.479 9.160 -8.613
77 HG2 LYS 7 HG2 LYS 7 -3.042 8.714 -6.850
78 HG3 LYS 7 HG3 LYS 7 -3.794 8.288 -8.396
79 HD2 LYS 7 HD2 LYS 7 -3.396 5.909 -7.981
80 HD3 LYS 7 HD3 LYS 7 -2.511 6.287 -6.486
81 HE2 LYS 7 HE2 LYS 7 -5.444 6.903 -7.043
82 HE3 LYS 7 HE3 LYS 7 -4.838 5.556 -6.061
83 HZ1 LYS 7 HZ1 LYS 7 -3.867 7.159 -4.567
84 HZ2 LYS 7 HZ2 LYS 7 -4.446 8.411 -5.467
85 HZ3 LYS 7 HZ3 LYS 7 -5.491 7.403 -4.712
86 H LYS 8 H LYS 8 0.908 6.430 -9.752
87 HA LYS 8 HA LYS 8 1.968 8.643 -11.322
88 HB2 LYS 8 HB2 LYS 8 3.281 7.549 -9.568
89 HB3 LYS 8 HB3 LYS 8 3.183 6.003 -10.428
90 HG2 LYS 8 HG2 LYS 8 4.486 6.876 -12.283
91 HG3 LYS 8 HG3 LYS 8 4.388 8.522 -11.626
92 HD2 LYS 8 HD2 LYS 8 6.595 7.546 -11.169
93 HD3 LYS 8 HD3 LYS 8 5.712 7.835 -9.660
94 HE2 LYS 8 HE2 LYS 8 5.054 5.458 -9.573
95 HE3 LYS 8 HE3 LYS 8 5.901 5.161 -11.103
96 HZ1 LYS 8 HZ1 LYS 8 7.941 5.800 -10.027
97 HZ2 LYS 8 HZ2 LYS 8 7.161 6.085 -8.606
98 HZ3 LYS 8 HZ3 LYS 8 7.244 4.560 -9.214
99 H LEU 9 H LEU 9 0.625 5.473 -12.013
100 HA LEU 9 HA LEU 9 1.645 5.534 -14.786
101 HB2 LEU 9 HB2 LEU 9 -0.064 3.545 -13.249
102 HB3 LEU 9 HB3 LEU 9 0.457 3.331 -14.927
103 HG LEU 9 HG LEU 9 2.383 3.699 -12.589
104 HD11 LEU 9 HD11 LEU 9 2.754 1.270 -12.777
105 HD12 LEU 9 HD12 LEU 9 1.066 1.630 -12.352
106 HD13 LEU 9 HD13 LEU 9 1.487 1.161 -14.020
107 HD21 LEU 9 HD21 LEU 9 3.355 4.310 -14.769
108 HD22 LEU 9 HD22 LEU 9 4.040 2.788 -14.187
109 HD23 LEU 9 HD23 LEU 9 2.798 2.763 -15.461
110 H LEU 10 H LEU 10 -1.030 6.794 -13.055
111 HA LEU 10 HA LEU 10 -3.136 6.323 -14.928
112 HB2 LEU 10 HB2 LEU 10 -3.564 6.902 -12.651
113 HB3 LEU 10 HB3 LEU 10 -2.662 8.414 -12.770
114 HG LEU 10 HG LEU 10 -5.017 8.013 -14.610
115 HD11 LEU 10 HD11 LEU 10 -5.182 8.796 -11.671
116 HD12 LEU 10 HD12 LEU 10 -6.515 8.871 -12.842
117 HD13 LEU 10 HD13 LEU 10 -5.815 7.298 -12.390
118 HD21 LEU 10 HD21 LEU 10 -3.906 10.401 -13.047
119 HD22 LEU 10 HD22 LEU 10 -3.630 10.095 -14.773
120 HD23 LEU 10 HD23 LEU 10 -5.264 10.454 -14.193
121 H LYS 11 H LYS 11 -0.504 8.685 -14.821
122 HA LYS 11 HA LYS 11 -1.675 10.569 -16.642
123 HB2 LYS 11 HB2 LYS 11 0.591 11.484 -16.766
124 HB3 LYS 11 HB3 LYS 11 0.168 11.092 -15.086
125 HG2 LYS 11 HG2 LYS 11 1.385 8.887 -15.380
126 HG3 LYS 11 HG3 LYS 11 1.932 9.460 -16.966
127 HD2 LYS 11 HD2 LYS 11 2.489 10.794 -14.288
128 HD3 LYS 11 HD3 LYS 11 3.643 9.835 -15.234
129 HE2 LYS 11 HE2 LYS 11 3.458 11.463 -17.099
130 HE3 LYS 11 HE3 LYS 11 2.327 12.429 -16.144
131 HZ1 LYS 11 HZ1 LYS 11 4.070 12.741 -14.517
132 HZ2 LYS 11 HZ2 LYS 11 5.115 11.832 -15.405
133 HZ3 LYS 11 HZ3 LYS 11 4.568 13.266 -15.990
134 H LEU 12 H LEU 12 -0.529 7.381 -17.153
135 HA LEU 12 HA LEU 12 0.419 7.875 -19.883
136 HB2 LEU 12 HB2 LEU 12 -0.088 5.259 -18.419
137 HB3 LEU 12 HB3 LEU 12 0.827 5.465 -19.916
138 HG LEU 12 HG LEU 12 1.595 6.632 -17.201
139 HD11 LEU 12 HD11 LEU 12 1.802 4.183 -17.307
140 HD12 LEU 12 HD12 LEU 12 2.742 4.314 -18.807
141 HD13 LEU 12 HD13 LEU 12 3.404 4.955 -17.283
142 HD21 LEU 12 HD21 LEU 12 2.416 8.022 -19.067
143 HD22 LEU 12 HD22 LEU 12 3.757 7.131 -18.326
144 HD23 LEU 12 HD23 LEU 12 3.064 6.570 -19.871
145 H LEU 13 H LEU 13 -2.636 7.515 -18.406
146 HA LEU 13 HA LEU 13 -3.811 6.725 -21.025
147 HB2 LEU 13 HB2 LEU 13 -4.643 5.729 -18.265
148 HB3 LEU 13 HB3 LEU 13 -5.511 5.390 -19.767
149 HG LEU 13 HG LEU 13 -2.614 4.573 -19.256
150 HD11 LEU 13 HD11 LEU 13 -3.530 2.313 -18.904
151 HD12 LEU 13 HD12 LEU 13 -4.150 3.447 -17.689
152 HD13 LEU 13 HD13 LEU 13 -5.184 2.955 -19.049
153 HD21 LEU 13 HD21 LEU 13 -3.228 4.753 -21.659
154 HD22 LEU 13 HD22 LEU 13 -3.013 3.062 -21.180
155 HD23 LEU 13 HD23 LEU 13 -4.655 3.738 -21.363
156 H LYS 14 H LYS 14 -3.598 9.061 -18.656
157 HA LYS 14 HA LYS 14 -6.077 10.313 -19.685
158 HB2 LYS 14 HB2 LYS 14 -5.225 10.294 -16.765
159 HB3 LYS 14 HB3 LYS 14 -6.565 11.230 -17.451
160 HG2 LYS 14 HG2 LYS 14 -7.601 9.076 -18.246
161 HG3 LYS 14 HG3 LYS 14 -6.339 8.192 -17.362
162 HD2 LYS 14 HD2 LYS 14 -7.059 9.274 -15.245
163 HD3 LYS 14 HD3 LYS 14 -8.314 10.163 -16.136
164 HE2 LYS 14 HE2 LYS 14 -9.318 8.009 -16.846
165 HE3 LYS 14 HE3 LYS 14 -8.071 7.133 -15.941
166 HZ1 LYS 14 HZ1 LYS 14 -10.052 8.979 -14.782
167 HZ2 LYS 14 HZ2 LYS 14 -10.102 7.342 -14.688
168 HZ3 LYS 14 HZ3 LYS 14 -8.898 8.167 -13.935
169 HN1 NH2 15 HN1 NHE 15 -2.950 10.436 -19.978
170 HN2 NH2 15 HN2 NHE 15 -2.639 12.153 -19.868
Start of MODEL 7
1 H1 LYS 1 H1 LYS 1 6.323 1.416 -1.010
2 H2 LYS 1 H2 LYS 1 6.511 0.319 -2.216
3 H3 LYS 1 H3 LYS 1 5.201 0.231 -1.226
4 HA LYS 1 HA LYS 1 4.359 2.307 -2.034
5 HB2 LYS 1 HB2 LYS 1 6.526 3.326 -2.560
6 HB3 LYS 1 HB3 LYS 1 6.788 2.153 -3.862
7 HG2 LYS 1 HG2 LYS 1 4.762 3.020 -5.038
8 HG3 LYS 1 HG3 LYS 1 4.550 4.219 -3.744
9 HD2 LYS 1 HD2 LYS 1 6.966 3.980 -5.589
10 HD3 LYS 1 HD3 LYS 1 5.671 5.183 -5.726
11 HE2 LYS 1 HE2 LYS 1 6.257 6.051 -3.470
12 HE3 LYS 1 HE3 LYS 1 7.573 4.865 -3.359
13 HZ1 LYS 1 HZ1 LYS 1 8.569 5.883 -5.285
14 HZ2 LYS 1 HZ2 LYS 1 7.361 6.986 -5.389
15 HZ3 LYS 1 HZ3 LYS 1 8.365 6.993 -4.088
16 H LEU 2 H LEU 2 2.525 1.618 -2.964
17 HA LEU 2 HA LEU 2 2.680 0.160 -5.506
18 HB2 LEU 2 HB2 LEU 2 2.871 -1.647 -3.883
19 HB3 LEU 2 HB3 LEU 2 1.481 -1.034 -2.982
20 HG LEU 2 HG LEU 2 -0.006 -1.527 -4.896
21 HD11 LEU 2 HD11 LEU 2 2.519 -2.716 -6.127
22 HD12 LEU 2 HD12 LEU 2 0.870 -2.905 -6.769
23 HD13 LEU 2 HD13 LEU 2 1.626 -1.303 -6.748
24 HD21 LEU 2 HD21 LEU 2 0.115 -3.983 -4.712
25 HD22 LEU 2 HD22 LEU 2 1.752 -3.855 -4.035
26 HD23 LEU 2 HD23 LEU 2 0.364 -3.203 -3.132
27 H LEU 3 H LEU 3 0.874 2.025 -3.109
28 HA LEU 3 HA LEU 3 -1.610 1.857 -4.682
29 HB2 LEU 3 HB2 LEU 3 -1.015 3.656 -2.311
30 HB3 LEU 3 HB3 LEU 3 -2.598 3.131 -2.909
31 HG LEU 3 HG LEU 3 -0.469 1.368 -1.631
32 HD11 LEU 3 HD11 LEU 3 -2.084 1.205 0.230
33 HD12 LEU 3 HD12 LEU 3 -1.590 2.888 -0.048
34 HD13 LEU 3 HD13 LEU 3 -3.176 2.327 -0.616
35 HD21 LEU 3 HD21 LEU 3 -3.314 0.712 -2.528
36 HD22 LEU 3 HD22 LEU 3 -1.821 0.115 -3.296
37 HD23 LEU 3 HD23 LEU 3 -2.225 -0.380 -1.641
38 H LYS 4 H LYS 4 0.874 4.276 -3.801
39 HA LYS 4 HA LYS 4 -0.243 6.359 -5.462
40 HB2 LYS 4 HB2 LYS 4 1.235 6.807 -3.554
41 HB3 LYS 4 HB3 LYS 4 2.568 5.948 -4.347
42 HG2 LYS 4 HG2 LYS 4 2.623 7.601 -6.152
43 HG3 LYS 4 HG3 LYS 4 1.208 8.433 -5.469
44 HD2 LYS 4 HD2 LYS 4 3.909 8.104 -4.100
45 HD3 LYS 4 HD3 LYS 4 3.348 9.571 -4.924
46 HE2 LYS 4 HE2 LYS 4 1.434 9.719 -3.338
47 HE3 LYS 4 HE3 LYS 4 2.033 8.280 -2.491
48 HZ1 LYS 4 HZ1 LYS 4 3.488 10.825 -2.789
49 HZ2 LYS 4 HZ2 LYS 4 2.735 10.312 -1.423
50 HZ3 LYS 4 HZ3 LYS 4 4.039 9.495 -1.994
51 H LEU 5 H LEU 5 1.585 3.488 -6.130
52 HA LEU 5 HA LEU 5 2.830 4.357 -8.561
53 HB2 LEU 5 HB2 LEU 5 3.529 2.324 -7.417
54 HB3 LEU 5 HB3 LEU 5 1.901 1.644 -7.561
55 HG LEU 5 HG LEU 5 2.135 1.558 -10.031
56 HD11 LEU 5 HD11 LEU 5 4.979 2.529 -9.484
57 HD12 LEU 5 HD12 LEU 5 4.365 1.935 -11.042
58 HD13 LEU 5 HD13 LEU 5 3.713 3.432 -10.355
59 HD21 LEU 5 HD21 LEU 5 2.785 -0.374 -8.634
60 HD22 LEU 5 HD22 LEU 5 3.806 -0.254 -10.083
61 HD23 LEU 5 HD23 LEU 5 4.436 0.269 -8.506
62 H LEU 6 H LEU 6 -0.473 3.440 -7.701
63 HA LEU 6 HA LEU 6 -1.329 2.864 -10.390
64 HB2 LEU 6 HB2 LEU 6 -2.963 3.766 -7.988
65 HB3 LEU 6 HB3 LEU 6 -3.578 2.955 -9.436
66 HG LEU 6 HG LEU 6 -1.620 1.744 -7.432
67 HD11 LEU 6 HD11 LEU 6 -3.525 0.312 -6.806
68 HD12 LEU 6 HD12 LEU 6 -3.908 2.025 -6.529
69 HD13 LEU 6 HD13 LEU 6 -4.571 1.187 -7.951
70 HD21 LEU 6 HD21 LEU 6 -1.295 0.837 -9.702
71 HD22 LEU 6 HD22 LEU 6 -2.074 -0.366 -8.663
72 HD23 LEU 6 HD23 LEU 6 -3.044 0.540 -9.845
73 H LYS 7 H LYS 7 -0.894 5.808 -8.496
74 HA LYS 7 HA LYS 7 -2.411 7.469 -10.386
75 HB2 LYS 7 HB2 LYS 7 -0.726 8.025 -7.925
76 HB3 LYS 7 HB3 LYS 7 -1.303 9.316 -8.987
77 HG2 LYS 7 HG2 LYS 7 -2.804 9.076 -7.113
78 HG3 LYS 7 HG3 LYS 7 -3.632 8.640 -8.616
79 HD2 LYS 7 HD2 LYS 7 -3.471 6.271 -8.092
80 HD3 LYS 7 HD3 LYS 7 -2.418 6.610 -6.696
81 HE2 LYS 7 HE2 LYS 7 -4.691 6.158 -5.950
82 HE3 LYS 7 HE3 LYS 7 -4.253 7.837 -5.602
83 HZ1 LYS 7 HZ1 LYS 7 -5.483 8.505 -7.555
84 HZ2 LYS 7 HZ2 LYS 7 -5.883 6.948 -7.886
85 HZ3 LYS 7 HZ3 LYS 7 -6.449 7.671 -6.520
86 H LYS 8 H LYS 8 0.892 6.371 -9.891
87 HA LYS 8 HA LYS 8 2.100 8.356 -11.631
88 HB2 LYS 8 HB2 LYS 8 3.351 7.248 -9.843
89 HB3 LYS 8 HB3 LYS 8 3.067 5.662 -10.587
90 HG2 LYS 8 HG2 LYS 8 4.378 6.293 -12.552
91 HG3 LYS 8 HG3 LYS 8 4.582 7.946 -11.920
92 HD2 LYS 8 HD2 LYS 8 5.769 7.033 -9.938
93 HD3 LYS 8 HD3 LYS 8 5.605 5.399 -10.594
94 HE2 LYS 8 HE2 LYS 8 7.062 7.715 -11.939
95 HE3 LYS 8 HE3 LYS 8 7.838 6.393 -11.055
96 HZ1 LYS 8 HZ1 LYS 8 6.210 6.083 -13.489
97 HZ2 LYS 8 HZ2 LYS 8 7.850 5.992 -13.403
98 HZ3 LYS 8 HZ3 LYS 8 6.930 4.860 -12.659
99 H LEU 9 H LEU 9 0.501 5.259 -12.080
100 HA LEU 9 HA LEU 9 1.424 5.090 -14.886
101 HB2 LEU 9 HB2 LEU 9 -0.308 3.288 -13.147
102 HB3 LEU 9 HB3 LEU 9 0.131 2.939 -14.827
103 HG LEU 9 HG LEU 9 2.157 3.360 -12.588
104 HD11 LEU 9 HD11 LEU 9 1.107 0.787 -13.845
105 HD12 LEU 9 HD12 LEU 9 2.422 0.904 -12.655
106 HD13 LEU 9 HD13 LEU 9 0.769 1.351 -12.192
107 HD21 LEU 9 HD21 LEU 9 3.086 3.806 -14.815
108 HD22 LEU 9 HD22 LEU 9 3.708 2.271 -14.195
109 HD23 LEU 9 HD23 LEU 9 2.416 2.271 -15.416
110 H LEU 10 H LEU 10 -1.171 6.472 -13.092
111 HA LEU 10 HA LEU 10 -3.300 6.070 -14.987
112 HB2 LEU 10 HB2 LEU 10 -3.807 6.622 -12.698
113 HB3 LEU 10 HB3 LEU 10 -2.759 8.050 -12.751
114 HG LEU 10 HG LEU 10 -4.287 9.120 -14.386
115 HD11 LEU 10 HD11 LEU 10 -6.018 6.666 -13.847
116 HD12 LEU 10 HD12 LEU 10 -6.551 8.139 -14.695
117 HD13 LEU 10 HD13 LEU 10 -5.290 7.116 -15.408
118 HD21 LEU 10 HD21 LEU 10 -6.097 9.565 -12.784
119 HD22 LEU 10 HD22 LEU 10 -5.609 8.150 -11.824
120 HD23 LEU 10 HD23 LEU 10 -4.509 9.543 -11.985
121 H LYS 11 H LYS 11 -0.760 8.547 -14.600
122 HA LYS 11 HA LYS 11 -1.980 10.421 -16.390
123 HB2 LYS 11 HB2 LYS 11 0.183 11.579 -16.274
124 HB3 LYS 11 HB3 LYS 11 -0.340 11.051 -14.665
125 HG2 LYS 11 HG2 LYS 11 1.157 9.076 -14.830
126 HG3 LYS 11 HG3 LYS 11 1.695 9.626 -16.437
127 HD2 LYS 11 HD2 LYS 11 2.507 11.747 -15.418
128 HD3 LYS 11 HD3 LYS 11 2.016 11.148 -13.815
129 HE2 LYS 11 HE2 LYS 11 3.550 9.234 -14.062
130 HE3 LYS 11 HE3 LYS 11 4.028 9.812 -15.668
131 HZ1 LYS 11 HZ1 LYS 11 4.437 11.275 -13.145
132 HZ2 LYS 11 HZ2 LYS 11 5.599 10.494 -14.004
133 HZ3 LYS 11 HZ3 LYS 11 4.856 11.811 -14.642
134 H LEU 12 H LEU 12 -0.538 7.416 -17.027
135 HA LEU 12 HA LEU 12 0.714 8.148 -19.558
136 HB2 LEU 12 HB2 LEU 12 -0.018 5.412 -18.443
137 HB3 LEU 12 HB3 LEU 12 1.103 5.748 -19.773
138 HG LEU 12 HG LEU 12 1.491 6.606 -16.872
139 HD11 LEU 12 HD11 LEU 12 3.301 4.926 -16.908
140 HD12 LEU 12 HD12 LEU 12 1.724 4.170 -17.228
141 HD13 LEU 12 HD13 LEU 12 2.855 4.472 -18.568
142 HD21 LEU 12 HD21 LEU 12 2.553 8.186 -18.451
143 HD22 LEU 12 HD22 LEU 12 3.775 7.204 -17.630
144 HD23 LEU 12 HD23 LEU 12 3.312 6.823 -19.310
145 H LEU 13 H LEU 13 -2.521 7.564 -18.546
146 HA LEU 13 HA LEU 13 -3.322 7.262 -21.395
147 HB2 LEU 13 HB2 LEU 13 -4.415 5.719 -19.008
148 HB3 LEU 13 HB3 LEU 13 -5.129 5.694 -20.627
149 HG LEU 13 HG LEU 13 -2.285 4.777 -20.002
150 HD11 LEU 13 HD11 LEU 13 -3.201 2.503 -20.271
151 HD12 LEU 13 HD12 LEU 13 -3.968 3.340 -18.911
152 HD13 LEU 13 HD13 LEU 13 -4.837 3.182 -20.457
153 HD21 LEU 13 HD21 LEU 13 -2.632 5.493 -22.358
154 HD22 LEU 13 HD22 LEU 13 -2.463 3.730 -22.246
155 HD23 LEU 13 HD23 LEU 13 -4.072 4.460 -22.460
156 H LYS 14 H LYS 14 -3.725 8.844 -18.370
157 HA LYS 14 HA LYS 14 -6.061 10.314 -19.499
158 HB2 LYS 14 HB2 LYS 14 -5.518 9.613 -16.589
159 HB3 LYS 14 HB3 LYS 14 -6.819 10.662 -17.151
160 HG2 LYS 14 HG2 LYS 14 -6.488 7.717 -17.873
161 HG3 LYS 14 HG3 LYS 14 -7.601 8.366 -16.664
162 HD2 LYS 14 HD2 LYS 14 -7.699 8.950 -19.650
163 HD3 LYS 14 HD3 LYS 14 -8.775 7.871 -18.751
164 HE2 LYS 14 HE2 LYS 14 -9.525 9.799 -17.364
165 HE3 LYS 14 HE3 LYS 14 -8.488 10.875 -18.315
166 HZ1 LYS 14 HZ1 LYS 14 -10.731 9.274 -19.356
167 HZ2 LYS 14 HZ2 LYS 14 -10.732 10.902 -19.104
168 HZ3 LYS 14 HZ3 LYS 14 -9.762 10.247 -20.258
169 HN1 NH2 15 HN1 NHE 15 -2.923 10.585 -19.300
170 HN2 NH2 15 HN2 NHE 15 -2.748 12.255 -18.795
Start of MODEL 8
1 H1 LYS 1 H1 LYS 1 -0.903 0.266 1.125
2 H2 LYS 1 H2 LYS 1 -1.098 1.836 0.685
3 H3 LYS 1 H3 LYS 1 -0.287 1.467 2.069
4 HA LYS 1 HA LYS 1 1.235 2.114 0.347
5 HB2 LYS 1 HB2 LYS 1 2.738 0.179 0.469
6 HB3 LYS 1 HB3 LYS 1 1.993 0.500 2.038
7 HG2 LYS 1 HG2 LYS 1 0.367 -1.324 1.670
8 HG3 LYS 1 HG3 LYS 1 1.055 -1.628 0.061
9 HD2 LYS 1 HD2 LYS 1 3.234 -2.175 1.084
10 HD3 LYS 1 HD3 LYS 1 2.564 -1.848 2.699
11 HE2 LYS 1 HE2 LYS 1 0.890 -3.644 2.364
12 HE3 LYS 1 HE3 LYS 1 1.553 -3.971 0.755
13 HZ1 LYS 1 HZ1 LYS 1 2.429 -5.473 2.399
14 HZ2 LYS 1 HZ2 LYS 1 3.646 -4.534 1.806
15 HZ3 LYS 1 HZ3 LYS 1 3.029 -4.230 3.293
16 H LEU 2 H LEU 2 2.381 1.326 -1.631
17 HA LEU 2 HA LEU 2 2.341 0.952 -3.850
18 HB2 LEU 2 HB2 LEU 2 0.643 -1.452 -3.121
19 HB3 LEU 2 HB3 LEU 2 1.615 -1.249 -4.585
20 HG LEU 2 HG LEU 2 2.723 -1.346 -1.741
21 HD11 LEU 2 HD11 LEU 2 2.739 -3.411 -3.979
22 HD12 LEU 2 HD12 LEU 2 3.549 -3.572 -2.398
23 HD13 LEU 2 HD13 LEU 2 1.776 -3.500 -2.483
24 HD21 LEU 2 HD21 LEU 2 4.166 -0.042 -3.265
25 HD22 LEU 2 HD22 LEU 2 4.906 -1.602 -2.900
26 HD23 LEU 2 HD23 LEU 2 4.096 -1.358 -4.468
27 H LEU 3 H LEU 3 0.203 2.740 -2.853
28 HA LEU 3 HA LEU 3 -1.951 2.219 -4.834
29 HB2 LEU 3 HB2 LEU 3 -2.792 2.419 -2.609
30 HB3 LEU 3 HB3 LEU 3 -1.729 3.784 -2.249
31 HG LEU 3 HG LEU 3 -2.933 5.187 -3.865
32 HD11 LEU 3 HD11 LEU 3 -3.836 3.452 -5.376
33 HD12 LEU 3 HD12 LEU 3 -4.815 2.782 -4.051
34 HD13 LEU 3 HD13 LEU 3 -5.170 4.402 -4.686
35 HD21 LEU 3 HD21 LEU 3 -4.686 3.851 -1.762
36 HD22 LEU 3 HD22 LEU 3 -3.553 5.197 -1.487
37 HD23 LEU 3 HD23 LEU 3 -4.989 5.438 -2.506
38 H LYS 4 H LYS 4 0.504 4.591 -3.723
39 HA LYS 4 HA LYS 4 -0.224 6.642 -5.580
40 HB2 LYS 4 HB2 LYS 4 1.169 7.070 -3.609
41 HB3 LYS 4 HB3 LYS 4 2.394 5.938 -4.191
42 HG2 LYS 4 HG2 LYS 4 3.099 8.233 -4.571
43 HG3 LYS 4 HG3 LYS 4 2.878 7.407 -6.117
44 HD2 LYS 4 HD2 LYS 4 0.664 8.496 -6.398
45 HD3 LYS 4 HD3 LYS 4 0.854 9.283 -4.813
46 HE2 LYS 4 HE2 LYS 4 2.915 10.408 -5.643
47 HE3 LYS 4 HE3 LYS 4 2.704 9.625 -7.213
48 HZ1 LYS 4 HZ1 LYS 4 0.610 10.782 -7.438
49 HZ2 LYS 4 HZ2 LYS 4 0.807 11.519 -5.982
50 HZ3 LYS 4 HZ3 LYS 4 1.838 11.853 -7.214
51 H LEU 5 H LEU 5 1.510 3.621 -5.896
52 HA LEU 5 HA LEU 5 2.929 4.266 -8.335
53 HB2 LEU 5 HB2 LEU 5 2.154 1.721 -6.882
54 HB3 LEU 5 HB3 LEU 5 2.865 1.672 -8.503
55 HG LEU 5 HG LEU 5 4.836 2.935 -7.708
56 HD11 LEU 5 HD11 LEU 5 5.223 3.087 -5.236
57 HD12 LEU 5 HD12 LEU 5 3.937 4.154 -5.796
58 HD13 LEU 5 HD13 LEU 5 3.532 2.625 -4.962
59 HD21 LEU 5 HD21 LEU 5 5.796 1.077 -6.391
60 HD22 LEU 5 HD22 LEU 5 4.165 0.426 -6.115
61 HD23 LEU 5 HD23 LEU 5 4.840 0.474 -7.760
62 H LEU 6 H LEU 6 -0.419 3.580 -7.604
63 HA LEU 6 HA LEU 6 -1.010 2.649 -10.322
64 HB2 LEU 6 HB2 LEU 6 -2.892 3.502 -8.094
65 HB3 LEU 6 HB3 LEU 6 -3.326 2.614 -9.558
66 HG LEU 6 HG LEU 6 -1.500 1.608 -7.332
67 HD11 LEU 6 HD11 LEU 6 -4.289 0.754 -8.214
68 HD12 LEU 6 HD12 LEU 6 -3.321 0.010 -6.918
69 HD13 LEU 6 HD13 LEU 6 -3.902 1.681 -6.743
70 HD21 LEU 6 HD21 LEU 6 -1.614 -0.564 -8.555
71 HD22 LEU 6 HD22 LEU 6 -2.485 0.240 -9.876
72 HD23 LEU 6 HD23 LEU 6 -0.801 0.687 -9.514
73 H LYS 7 H LYS 7 -1.052 5.665 -8.460
74 HA LYS 7 HA LYS 7 -2.478 7.152 -10.537
75 HB2 LYS 7 HB2 LYS 7 -1.020 7.919 -7.989
76 HB3 LYS 7 HB3 LYS 7 -1.573 9.123 -9.151
77 HG2 LYS 7 HG2 LYS 7 -3.247 8.928 -7.458
78 HG3 LYS 7 HG3 LYS 7 -3.902 8.280 -8.963
79 HD2 LYS 7 HD2 LYS 7 -3.498 5.979 -8.175
80 HD3 LYS 7 HD3 LYS 7 -2.751 6.602 -6.686
81 HE2 LYS 7 HE2 LYS 7 -5.627 7.058 -7.578
82 HE3 LYS 7 HE3 LYS 7 -5.098 5.898 -6.346
83 HZ1 LYS 7 HZ1 LYS 7 -5.885 7.930 -5.367
84 HZ2 LYS 7 HZ2 LYS 7 -4.286 7.763 -5.052
85 HZ3 LYS 7 HZ3 LYS 7 -4.794 8.832 -6.199
86 H LYS 8 H LYS 8 0.843 6.283 -9.836
87 HA LYS 8 HA LYS 8 2.091 8.303 -11.462
88 HB2 LYS 8 HB2 LYS 8 3.258 7.099 -9.682
89 HB3 LYS 8 HB3 LYS 8 3.001 5.554 -10.510
90 HG2 LYS 8 HG2 LYS 8 4.401 6.280 -12.388
91 HG3 LYS 8 HG3 LYS 8 4.586 7.888 -11.653
92 HD2 LYS 8 HD2 LYS 8 5.701 6.847 -9.696
93 HD3 LYS 8 HD3 LYS 8 5.512 5.242 -10.443
94 HE2 LYS 8 HE2 LYS 8 6.866 5.995 -12.377
95 HE3 LYS 8 HE3 LYS 8 7.069 7.584 -11.621
96 HZ1 LYS 8 HZ1 LYS 8 8.016 5.030 -10.501
97 HZ2 LYS 8 HZ2 LYS 8 8.952 6.175 -11.211
98 HZ3 LYS 8 HZ3 LYS 8 8.196 6.506 -9.796
99 H LEU 9 H LEU 9 0.433 5.299 -12.189
100 HA LEU 9 HA LEU 9 1.517 5.307 -14.951
101 HB2 LEU 9 HB2 LEU 9 -0.183 3.297 -13.432
102 HB3 LEU 9 HB3 LEU 9 0.370 3.096 -15.099
103 HG LEU 9 HG LEU 9 2.230 3.468 -12.707
104 HD11 LEU 9 HD11 LEU 9 1.427 0.958 -14.241
105 HD12 LEU 9 HD12 LEU 9 2.677 1.046 -12.973
106 HD13 LEU 9 HD13 LEU 9 0.976 1.348 -12.563
107 HD21 LEU 9 HD21 LEU 9 2.730 2.645 -15.598
108 HD22 LEU 9 HD22 LEU 9 3.248 4.165 -14.834
109 HD23 LEU 9 HD23 LEU 9 3.944 2.625 -14.299
110 H LEU 10 H LEU 10 -1.189 6.443 -13.147
111 HA LEU 10 HA LEU 10 -3.228 6.080 -15.137
112 HB2 LEU 10 HB2 LEU 10 -3.777 6.407 -12.829
113 HB3 LEU 10 HB3 LEU 10 -2.898 7.936 -12.748
114 HG LEU 10 HG LEU 10 -5.171 7.701 -14.716
115 HD11 LEU 10 HD11 LEU 10 -5.453 8.132 -11.715
116 HD12 LEU 10 HD12 LEU 10 -6.750 8.337 -12.917
117 HD13 LEU 10 HD13 LEU 10 -6.055 6.730 -12.634
118 HD21 LEU 10 HD21 LEU 10 -5.481 10.075 -14.047
119 HD22 LEU 10 HD22 LEU 10 -4.181 9.916 -12.846
120 HD23 LEU 10 HD23 LEU 10 -3.814 9.810 -14.585
121 H LYS 11 H LYS 11 -0.677 8.496 -14.666
122 HA LYS 11 HA LYS 11 -1.848 10.503 -16.359
123 HB2 LYS 11 HB2 LYS 11 0.368 11.528 -16.270
124 HB3 LYS 11 HB3 LYS 11 -0.100 10.960 -14.659
125 HG2 LYS 11 HG2 LYS 11 1.279 8.915 -15.000
126 HG3 LYS 11 HG3 LYS 11 1.768 9.532 -16.597
127 HD2 LYS 11 HD2 LYS 11 2.713 11.559 -15.486
128 HD3 LYS 11 HD3 LYS 11 2.294 10.859 -13.907
129 HE2 LYS 11 HE2 LYS 11 3.741 8.908 -14.391
130 HE3 LYS 11 HE3 LYS 11 4.137 9.584 -15.983
131 HZ1 LYS 11 HZ1 LYS 11 4.771 10.836 -13.395
132 HZ2 LYS 11 HZ2 LYS 11 5.844 10.073 -14.379
133 HZ3 LYS 11 HZ3 LYS 11 5.123 11.465 -14.866
134 H LEU 12 H LEU 12 -0.546 7.432 -17.098
135 HA LEU 12 HA LEU 12 0.533 8.196 -19.714
136 HB2 LEU 12 HB2 LEU 12 0.014 5.452 -18.519
137 HB3 LEU 12 HB3 LEU 12 1.009 5.811 -19.935
138 HG LEU 12 HG LEU 12 1.586 6.760 -17.090
139 HD11 LEU 12 HD11 LEU 12 2.908 4.622 -18.800
140 HD12 LEU 12 HD12 LEU 12 3.435 5.138 -17.183
141 HD13 LEU 12 HD13 LEU 12 1.862 4.329 -17.389
142 HD21 LEU 12 HD21 LEU 12 3.791 7.410 -18.038
143 HD22 LEU 12 HD22 LEU 12 3.222 6.950 -19.660
144 HD23 LEU 12 HD23 LEU 12 2.474 8.317 -18.799
145 H LEU 13 H LEU 13 -2.591 7.636 -18.463
146 HA LEU 13 HA LEU 13 -3.597 7.083 -21.204
147 HB2 LEU 13 HB2 LEU 13 -4.525 5.783 -18.614
148 HB3 LEU 13 HB3 LEU 13 -5.330 5.598 -20.177
149 HG LEU 13 HG LEU 13 -2.454 4.758 -19.634
150 HD11 LEU 13 HD11 LEU 13 -3.360 2.459 -19.606
151 HD12 LEU 13 HD12 LEU 13 -4.036 3.443 -18.293
152 HD13 LEU 13 HD13 LEU 13 -5.011 3.113 -19.744
153 HD21 LEU 13 HD21 LEU 13 -4.376 4.162 -21.931
154 HD22 LEU 13 HD22 LEU 13 -2.949 5.214 -22.030
155 HD23 LEU 13 HD23 LEU 13 -2.743 3.476 -21.736
156 H LYS 14 H LYS 14 -3.576 9.179 -18.617
157 HA LYS 14 HA LYS 14 -6.055 10.446 -19.627
158 HB2 LYS 14 HB2 LYS 14 -5.337 10.149 -16.689
159 HB3 LYS 14 HB3 LYS 14 -6.676 11.114 -17.345
160 HG2 LYS 14 HG2 LYS 14 -7.624 9.031 -18.365
161 HG3 LYS 14 HG3 LYS 14 -6.337 8.092 -17.588
162 HD2 LYS 14 HD2 LYS 14 -8.352 7.949 -16.254
163 HD3 LYS 14 HD3 LYS 14 -7.131 8.873 -15.358
164 HE2 LYS 14 HE2 LYS 14 -8.205 10.987 -16.053
165 HE3 LYS 14 HE3 LYS 14 -9.400 10.070 -16.995
166 HZ1 LYS 14 HZ1 LYS 14 -10.260 10.694 -14.854
167 HZ2 LYS 14 HZ2 LYS 14 -10.140 9.059 -14.953
168 HZ3 LYS 14 HZ3 LYS 14 -9.040 9.911 -14.080
169 HN1 NH2 15 HN1 NHE 15 -2.942 10.705 -19.778
170 HN2 NH2 15 HN2 NHE 15 -2.692 12.411 -19.467
Start of MODEL 9
1 H1 LYS 1 H1 LYS 1 4.483 3.632 -0.647
2 H2 LYS 1 H2 LYS 1 3.813 4.246 0.722
3 H3 LYS 1 H3 LYS 1 3.262 4.725 -0.754
4 HA LYS 1 HA LYS 1 3.051 2.020 0.348
5 HB2 LYS 1 HB2 LYS 1 0.896 4.121 -0.090
6 HB3 LYS 1 HB3 LYS 1 0.605 2.440 0.376
7 HG2 LYS 1 HG2 LYS 1 1.938 2.770 2.441
8 HG3 LYS 1 HG3 LYS 1 2.214 4.472 1.990
9 HD2 LYS 1 HD2 LYS 1 -0.233 4.872 2.025
10 HD3 LYS 1 HD3 LYS 1 -0.503 3.175 2.483
11 HE2 LYS 1 HE2 LYS 1 0.841 3.524 4.537
12 HE3 LYS 1 HE3 LYS 1 1.099 5.214 4.083
13 HZ1 LYS 1 HZ1 LYS 1 -1.520 3.973 4.625
14 HZ2 LYS 1 HZ2 LYS 1 -0.704 4.978 5.633
15 HZ3 LYS 1 HZ3 LYS 1 -1.279 5.542 4.199
16 H LEU 2 H LEU 2 1.794 0.540 -0.940
17 HA LEU 2 HA LEU 2 2.475 0.736 -3.748
18 HB2 LEU 2 HB2 LEU 2 0.894 -1.365 -2.222
19 HB3 LEU 2 HB3 LEU 2 1.537 -1.537 -3.864
20 HG LEU 2 HG LEU 2 3.201 -1.133 -1.338
21 HD11 LEU 2 HD11 LEU 2 3.886 -3.463 -1.713
22 HD12 LEU 2 HD12 LEU 2 2.133 -3.344 -1.461
23 HD13 LEU 2 HD13 LEU 2 2.782 -3.575 -3.104
24 HD21 LEU 2 HD21 LEU 2 5.117 -1.687 -2.817
25 HD22 LEU 2 HD22 LEU 2 4.023 -1.699 -4.221
26 HD23 LEU 2 HD23 LEU 2 4.323 -0.188 -3.331
27 H LEU 3 H LEU 3 0.774 2.852 -3.197
28 HA LEU 3 HA LEU 3 -1.496 2.120 -4.944
29 HB2 LEU 3 HB2 LEU 3 -3.115 3.232 -3.563
30 HB3 LEU 3 HB3 LEU 3 -2.263 2.027 -2.606
31 HG LEU 3 HG LEU 3 -0.729 4.088 -1.908
32 HD11 LEU 3 HD11 LEU 3 -3.380 5.422 -2.649
33 HD12 LEU 3 HD12 LEU 3 -2.073 6.169 -1.709
34 HD13 LEU 3 HD13 LEU 3 -1.810 5.759 -3.410
35 HD21 LEU 3 HD21 LEU 3 -2.132 2.736 -0.397
36 HD22 LEU 3 HD22 LEU 3 -2.241 4.459 0.007
37 HD23 LEU 3 HD23 LEU 3 -3.567 3.675 -0.876
38 H LYS 4 H LYS 4 1.015 4.354 -4.014
39 HA LYS 4 HA LYS 4 -0.083 6.583 -5.525
40 HB2 LYS 4 HB2 LYS 4 1.488 6.943 -3.670
41 HB3 LYS 4 HB3 LYS 4 2.724 5.979 -4.492
42 HG2 LYS 4 HG2 LYS 4 2.837 7.625 -6.320
43 HG3 LYS 4 HG3 LYS 4 1.509 8.553 -5.597
44 HD2 LYS 4 HD2 LYS 4 2.908 8.946 -3.576
45 HD3 LYS 4 HD3 LYS 4 4.228 8.020 -4.313
46 HE2 LYS 4 HE2 LYS 4 4.307 9.626 -6.190
47 HE3 LYS 4 HE3 LYS 4 2.975 10.544 -5.474
48 HZ1 LYS 4 HZ1 LYS 4 5.100 11.508 -4.940
49 HZ2 LYS 4 HZ2 LYS 4 4.368 10.970 -3.569
50 HZ3 LYS 4 HZ3 LYS 4 5.610 10.120 -4.223
51 H LEU 5 H LEU 5 1.816 3.704 -6.228
52 HA LEU 5 HA LEU 5 2.870 4.548 -8.745
53 HB2 LEU 5 HB2 LEU 5 3.718 2.577 -7.604
54 HB3 LEU 5 HB3 LEU 5 2.109 1.837 -7.606
55 HG LEU 5 HG LEU 5 2.168 1.660 -10.072
56 HD11 LEU 5 HD11 LEU 5 3.657 3.579 -10.578
57 HD12 LEU 5 HD12 LEU 5 5.009 2.740 -9.775
58 HD13 LEU 5 HD13 LEU 5 4.300 2.071 -11.260
59 HD21 LEU 5 HD21 LEU 5 4.622 0.531 -8.682
60 HD22 LEU 5 HD22 LEU 5 2.989 -0.183 -8.659
61 HD23 LEU 5 HD23 LEU 5 3.895 -0.082 -10.187
62 H LEU 6 H LEU 6 -0.340 3.555 -7.676
63 HA LEU 6 HA LEU 6 -1.327 2.795 -10.266
64 HB2 LEU 6 HB2 LEU 6 -2.857 3.852 -7.856
65 HB3 LEU 6 HB3 LEU 6 -3.536 2.943 -9.209
66 HG LEU 6 HG LEU 6 -1.451 1.881 -7.245
67 HD11 LEU 6 HD11 LEU 6 -4.426 1.284 -7.544
68 HD12 LEU 6 HD12 LEU 6 -3.311 0.500 -6.401
69 HD13 LEU 6 HD13 LEU 6 -3.685 2.233 -6.238
70 HD21 LEU 6 HD21 LEU 6 -1.264 0.817 -9.464
71 HD22 LEU 6 HD22 LEU 6 -1.983 -0.313 -8.299
72 HD23 LEU 6 HD23 LEU 6 -3.021 0.511 -9.477
73 H LYS 7 H LYS 7 -0.903 5.881 -8.611
74 HA LYS 7 HA LYS 7 -2.531 7.416 -10.493
75 HB2 LYS 7 HB2 LYS 7 -0.361 8.301 -8.549
76 HB3 LYS 7 HB3 LYS 7 -1.604 9.333 -9.276
77 HG2 LYS 7 HG2 LYS 7 -3.359 8.207 -8.035
78 HG3 LYS 7 HG3 LYS 7 -2.219 6.982 -7.431
79 HD2 LYS 7 HD2 LYS 7 -0.891 8.718 -6.320
80 HD3 LYS 7 HD3 LYS 7 -2.036 9.962 -6.857
81 HE2 LYS 7 HE2 LYS 7 -2.702 7.580 -5.059
82 HE3 LYS 7 HE3 LYS 7 -2.470 9.248 -4.507
83 HZ1 LYS 7 HZ1 LYS 7 -4.576 8.342 -6.358
84 HZ2 LYS 7 HZ2 LYS 7 -4.783 8.741 -4.778
85 HZ3 LYS 7 HZ3 LYS 7 -4.345 9.888 -5.862
86 H LYS 8 H LYS 8 0.905 6.634 -9.965
87 HA LYS 8 HA LYS 8 1.918 8.328 -12.048
88 HB2 LYS 8 HB2 LYS 8 3.062 5.870 -10.667
89 HB3 LYS 8 HB3 LYS 8 3.970 6.893 -11.800
90 HG2 LYS 8 HG2 LYS 8 3.623 8.854 -10.387
91 HG3 LYS 8 HG3 LYS 8 2.613 7.917 -9.274
92 HD2 LYS 8 HD2 LYS 8 4.877 8.165 -8.358
93 HD3 LYS 8 HD3 LYS 8 4.538 6.463 -8.716
94 HE2 LYS 8 HE2 LYS 8 5.785 6.676 -10.856
95 HE3 LYS 8 HE3 LYS 8 6.100 8.380 -10.499
96 HZ1 LYS 8 HZ1 LYS 8 7.021 6.091 -8.893
97 HZ2 LYS 8 HZ2 LYS 8 7.955 7.002 -9.890
98 HZ3 LYS 8 HZ3 LYS 8 7.306 7.670 -8.539
99 H LEU 9 H LEU 9 0.403 5.168 -12.135
100 HA LEU 9 HA LEU 9 1.291 4.742 -14.924
101 HB2 LEU 9 HB2 LEU 9 -0.454 3.162 -13.009
102 HB3 LEU 9 HB3 LEU 9 -0.119 2.662 -14.679
103 HG LEU 9 HG LEU 9 2.054 3.154 -12.594
104 HD11 LEU 9 HD11 LEU 9 0.813 0.546 -13.563
105 HD12 LEU 9 HD12 LEU 9 2.198 0.700 -12.454
106 HD13 LEU 9 HD13 LEU 9 0.589 1.263 -11.951
107 HD21 LEU 9 HD21 LEU 9 2.838 3.373 -14.915
108 HD22 LEU 9 HD22 LEU 9 3.443 1.868 -14.201
109 HD23 LEU 9 HD23 LEU 9 2.074 1.818 -15.334
110 H LEU 10 H LEU 10 -1.383 6.110 -13.111
111 HA LEU 10 HA LEU 10 -3.350 5.801 -15.218
112 HB2 LEU 10 HB2 LEU 10 -4.063 5.923 -12.949
113 HB3 LEU 10 HB3 LEU 10 -3.201 7.437 -12.658
114 HG LEU 10 HG LEU 10 -5.331 7.373 -14.802
115 HD11 LEU 10 HD11 LEU 10 -5.847 7.572 -11.808
116 HD12 LEU 10 HD12 LEU 10 -7.047 7.851 -13.095
117 HD13 LEU 10 HD13 LEU 10 -6.351 6.234 -12.868
118 HD21 LEU 10 HD21 LEU 10 -4.036 9.473 -14.428
119 HD22 LEU 10 HD22 LEU 10 -5.726 9.677 -13.930
120 HD23 LEU 10 HD23 LEU 10 -4.457 9.424 -12.707
121 H LYS 11 H LYS 11 -1.006 8.337 -14.270
122 HA LYS 11 HA LYS 11 -2.131 10.373 -15.949
123 HB2 LYS 11 HB2 LYS 11 -0.025 11.541 -15.591
124 HB3 LYS 11 HB3 LYS 11 -0.591 10.836 -14.070
125 HG2 LYS 11 HG2 LYS 11 0.986 8.965 -14.319
126 HG3 LYS 11 HG3 LYS 11 1.515 9.594 -15.900
127 HD2 LYS 11 HD2 LYS 11 2.255 11.699 -14.784
128 HD3 LYS 11 HD3 LYS 11 1.814 11.001 -13.211
129 HE2 LYS 11 HE2 LYS 11 3.406 9.146 -13.578
130 HE3 LYS 11 HE3 LYS 11 3.820 9.811 -15.169
131 HZ1 LYS 11 HZ1 LYS 11 4.255 11.169 -12.588
132 HZ2 LYS 11 HZ2 LYS 11 5.414 10.452 -13.499
133 HZ3 LYS 11 HZ3 LYS 11 4.641 11.781 -14.064
134 H LEU 12 H LEU 12 -0.563 7.464 -16.788
135 HA LEU 12 HA LEU 12 0.685 8.506 -19.223
136 HB2 LEU 12 HB2 LEU 12 0.218 5.636 -18.332
137 HB3 LEU 12 HB3 LEU 12 1.339 6.183 -19.585
138 HG LEU 12 HG LEU 12 1.530 6.851 -16.608
139 HD11 LEU 12 HD11 LEU 12 3.192 5.014 -18.374
140 HD12 LEU 12 HD12 LEU 12 3.487 5.369 -16.653
141 HD13 LEU 12 HD13 LEU 12 2.020 4.488 -17.146
142 HD21 LEU 12 HD21 LEU 12 2.477 8.645 -18.012
143 HD22 LEU 12 HD22 LEU 12 3.760 7.738 -17.191
144 HD23 LEU 12 HD23 LEU 12 3.428 7.439 -18.916
145 H LEU 13 H LEU 13 -2.458 7.372 -18.262
146 HA LEU 13 HA LEU 13 -3.216 7.024 -21.130
147 HB2 LEU 13 HB2 LEU 13 -4.255 5.730 -18.575
148 HB3 LEU 13 HB3 LEU 13 -5.199 5.760 -20.064
149 HG LEU 13 HG LEU 13 -4.130 3.636 -19.857
150 HD11 LEU 13 HD11 LEU 13 -2.711 5.230 -22.022
151 HD12 LEU 13 HD12 LEU 13 -3.013 3.483 -22.003
152 HD13 LEU 13 HD13 LEU 13 -4.380 4.615 -22.124
153 HD21 LEU 13 HD21 LEU 13 -2.167 4.385 -18.475
154 HD22 LEU 13 HD22 LEU 13 -1.776 3.258 -19.791
155 HD23 LEU 13 HD23 LEU 13 -1.419 4.987 -19.979
156 H LYS 14 H LYS 14 -3.443 9.085 -18.476
157 HA LYS 14 HA LYS 14 -5.811 10.407 -19.698
158 HB2 LYS 14 HB2 LYS 14 -5.294 10.070 -16.718
159 HB3 LYS 14 HB3 LYS 14 -6.580 11.053 -17.444
160 HG2 LYS 14 HG2 LYS 14 -7.450 9.006 -18.591
161 HG3 LYS 14 HG3 LYS 14 -6.253 8.040 -17.698
162 HD2 LYS 14 HD2 LYS 14 -7.236 8.792 -15.561
163 HD3 LYS 14 HD3 LYS 14 -8.405 9.804 -16.445
164 HE2 LYS 14 HE2 LYS 14 -9.291 7.785 -17.570
165 HE3 LYS 14 HE3 LYS 14 -8.142 6.779 -16.674
166 HZ1 LYS 14 HZ1 LYS 14 -9.196 7.501 -14.642
167 HZ2 LYS 14 HZ2 LYS 14 -10.250 8.449 -15.476
168 HZ3 LYS 14 HZ3 LYS 14 -10.314 6.817 -15.641
169 HN1 NH2 15 HN1 NHE 15 -2.697 10.663 -19.676
170 HN2 NH2 15 HN2 NHE 15 -2.459 12.357 -19.337
Start of MODEL 10
1 H1 LYS 1 H1 LYS 1 2.878 1.329 1.729
2 H2 LYS 1 H2 LYS 1 2.262 0.031 0.917
3 H3 LYS 1 H3 LYS 1 1.631 1.531 0.683
4 HA LYS 1 HA LYS 1 3.626 2.308 -0.322
5 HB2 LYS 1 HB2 LYS 1 5.462 0.748 -0.781
6 HB3 LYS 1 HB3 LYS 1 5.204 0.942 0.955
7 HG2 LYS 1 HG2 LYS 1 3.994 -1.195 1.058
8 HG3 LYS 1 HG3 LYS 1 4.146 -1.395 -0.698
9 HD2 LYS 1 HD2 LYS 1 6.616 -1.375 -0.483
10 HD3 LYS 1 HD3 LYS 1 6.467 -1.214 1.277
11 HE2 LYS 1 HE2 LYS 1 5.409 -3.535 -0.389
12 HE3 LYS 1 HE3 LYS 1 6.900 -3.555 0.557
13 HZ1 LYS 1 HZ1 LYS 1 5.111 -4.544 1.776
14 HZ2 LYS 1 HZ2 LYS 1 5.572 -3.161 2.531
15 HZ3 LYS 1 HZ3 LYS 1 4.186 -3.197 1.645
16 H LEU 2 H LEU 2 4.293 1.776 -2.604
17 HA LEU 2 HA LEU 2 3.754 1.328 -4.719
18 HB2 LEU 2 HB2 LEU 2 2.577 -1.259 -3.688
19 HB3 LEU 2 HB3 LEU 2 3.152 -0.932 -5.328
20 HG LEU 2 HG LEU 2 4.895 -0.928 -2.817
21 HD11 LEU 2 HD11 LEU 2 4.618 -2.949 -5.082
22 HD12 LEU 2 HD12 LEU 2 5.787 -3.034 -3.744
23 HD13 LEU 2 HD13 LEU 2 4.042 -3.166 -3.413
24 HD21 LEU 2 HD21 LEU 2 5.616 -0.767 -5.776
25 HD22 LEU 2 HD22 LEU 2 5.786 0.556 -4.595
26 HD23 LEU 2 HD23 LEU 2 6.772 -0.912 -4.433
27 H LEU 3 H LEU 3 1.725 2.808 -3.116
28 HA LEU 3 HA LEU 3 -0.752 2.079 -4.605
29 HB2 LEU 3 HB2 LEU 3 -0.470 4.124 -2.389
30 HB3 LEU 3 HB3 LEU 3 -1.954 3.393 -3.012
31 HG LEU 3 HG LEU 3 0.259 1.987 -1.477
32 HD11 LEU 3 HD11 LEU 3 -2.582 2.748 -0.683
33 HD12 LEU 3 HD12 LEU 3 -1.435 1.820 0.314
34 HD13 LEU 3 HD13 LEU 3 -1.088 3.513 -0.092
35 HD21 LEU 3 HD21 LEU 3 -0.850 0.430 -3.046
36 HD22 LEU 3 HD22 LEU 3 -1.364 0.074 -1.386
37 HD23 LEU 3 HD23 LEU 3 -2.448 0.970 -2.475
38 H LYS 4 H LYS 4 1.660 4.592 -4.046
39 HA LYS 4 HA LYS 4 0.422 6.657 -5.605
40 HB2 LYS 4 HB2 LYS 4 2.261 7.105 -4.047
41 HB3 LYS 4 HB3 LYS 4 3.344 6.054 -4.970
42 HG2 LYS 4 HG2 LYS 4 3.806 8.412 -5.443
43 HG3 LYS 4 HG3 LYS 4 3.230 7.590 -6.896
44 HD2 LYS 4 HD2 LYS 4 0.947 8.520 -6.507
45 HD3 LYS 4 HD3 LYS 4 1.532 9.329 -5.042
46 HE2 LYS 4 HE2 LYS 4 2.563 9.807 -7.869
47 HE3 LYS 4 HE3 LYS 4 1.424 10.847 -6.995
48 HZ1 LYS 4 HZ1 LYS 4 3.665 11.665 -6.848
49 HZ2 LYS 4 HZ2 LYS 4 3.133 11.234 -5.353
50 HZ3 LYS 4 HZ3 LYS 4 4.188 10.267 -6.158
51 H LEU 5 H LEU 5 2.105 3.718 -6.474
52 HA LEU 5 HA LEU 5 2.810 4.514 -9.157
53 HB2 LEU 5 HB2 LEU 5 2.226 1.757 -8.012
54 HB3 LEU 5 HB3 LEU 5 3.029 2.087 -9.559
55 HG LEU 5 HG LEU 5 4.079 2.851 -6.800
56 HD11 LEU 5 HD11 LEU 5 5.002 0.787 -8.843
57 HD12 LEU 5 HD12 LEU 5 5.793 1.147 -7.295
58 HD13 LEU 5 HD13 LEU 5 4.159 0.432 -7.318
59 HD21 LEU 5 HD21 LEU 5 6.158 3.444 -8.043
60 HD22 LEU 5 HD22 LEU 5 5.309 3.167 -9.577
61 HD23 LEU 5 HD23 LEU 5 4.802 4.492 -8.498
62 H LEU 6 H LEU 6 -0.232 3.659 -7.647
63 HA LEU 6 HA LEU 6 -1.520 2.760 -10.071
64 HB2 LEU 6 HB2 LEU 6 -2.729 3.889 -7.511
65 HB3 LEU 6 HB3 LEU 6 -3.584 2.970 -8.755
66 HG LEU 6 HG LEU 6 -1.293 1.902 -7.049
67 HD11 LEU 6 HD11 LEU 6 -4.288 1.366 -6.947
68 HD12 LEU 6 HD12 LEU 6 -3.051 0.588 -5.939
69 HD13 LEU 6 HD13 LEU 6 -3.365 2.330 -5.770
70 HD21 LEU 6 HD21 LEU 6 -2.003 -0.299 -7.966
71 HD22 LEU 6 HD22 LEU 6 -3.160 0.526 -9.035
72 HD23 LEU 6 HD23 LEU 6 -1.408 0.783 -9.239
73 H LYS 7 H LYS 7 -0.854 5.884 -8.570
74 HA LYS 7 HA LYS 7 -2.635 7.322 -10.426
75 HB2 LYS 7 HB2 LYS 7 -0.708 8.164 -8.234
76 HB3 LYS 7 HB3 LYS 7 -1.430 9.319 -9.362
77 HG2 LYS 7 HG2 LYS 7 -2.723 9.312 -7.350
78 HG3 LYS 7 HG3 LYS 7 -3.695 8.643 -8.663
79 HD2 LYS 7 HD2 LYS 7 -3.318 6.363 -7.849
80 HD3 LYS 7 HD3 LYS 7 -2.220 6.970 -6.582
81 HE2 LYS 7 HE2 LYS 7 -5.180 7.629 -6.876
82 HE3 LYS 7 HE3 LYS 7 -4.501 6.463 -5.727
83 HZ1 LYS 7 HZ1 LYS 7 -3.290 8.271 -4.714
84 HZ2 LYS 7 HZ2 LYS 7 -3.928 9.354 -5.774
85 HZ3 LYS 7 HZ3 LYS 7 -4.902 8.581 -4.700
86 H LYS 8 H LYS 8 0.759 6.378 -10.154
87 HA LYS 8 HA LYS 8 1.760 8.203 -12.133
88 HB2 LYS 8 HB2 LYS 8 3.189 7.073 -10.485
89 HB3 LYS 8 HB3 LYS 8 2.768 5.494 -11.178
90 HG2 LYS 8 HG2 LYS 8 3.819 6.110 -13.313
91 HG3 LYS 8 HG3 LYS 8 4.199 7.729 -12.679
92 HD2 LYS 8 HD2 LYS 8 5.604 6.704 -10.921
93 HD3 LYS 8 HD3 LYS 8 5.213 5.083 -11.554
94 HE2 LYS 8 HE2 LYS 8 6.218 5.695 -13.730
95 HE3 LYS 8 HE3 LYS 8 6.610 7.306 -13.098
96 HZ1 LYS 8 HZ1 LYS 8 7.652 4.751 -12.062
97 HZ2 LYS 8 HZ2 LYS 8 8.486 5.832 -12.976
98 HZ3 LYS 8 HZ3 LYS 8 8.007 6.240 -11.458
99 H LEU 9 H LEU 9 0.285 4.971 -12.273
100 HA LEU 9 HA LEU 9 0.759 4.714 -15.149
101 HB2 LEU 9 HB2 LEU 9 -0.873 3.113 -13.142
102 HB3 LEU 9 HB3 LEU 9 -0.679 2.671 -14.848
103 HG LEU 9 HG LEU 9 1.662 3.036 -12.926
104 HD11 LEU 9 HD11 LEU 9 0.262 0.495 -13.854
105 HD12 LEU 9 HD12 LEU 9 1.745 0.574 -12.877
106 HD13 LEU 9 HD13 LEU 9 0.214 1.174 -12.204
107 HD21 LEU 9 HD21 LEU 9 2.264 3.288 -15.305
108 HD22 LEU 9 HD22 LEU 9 2.873 1.748 -14.667
109 HD23 LEU 9 HD23 LEU 9 1.422 1.767 -15.690
110 H LEU 10 H LEU 10 -1.587 6.296 -13.140
111 HA LEU 10 HA LEU 10 -3.768 6.072 -15.055
112 HB2 LEU 10 HB2 LEU 10 -4.185 6.279 -12.673
113 HB3 LEU 10 HB3 LEU 10 -3.343 7.827 -12.602
114 HG LEU 10 HG LEU 10 -5.710 7.483 -14.464
115 HD11 LEU 10 HD11 LEU 10 -7.187 8.191 -12.613
116 HD12 LEU 10 HD12 LEU 10 -6.429 6.621 -12.274
117 HD13 LEU 10 HD13 LEU 10 -5.818 8.098 -11.486
118 HD21 LEU 10 HD21 LEU 10 -4.451 9.623 -14.592
119 HD22 LEU 10 HD22 LEU 10 -6.045 9.888 -13.880
120 HD23 LEU 10 HD23 LEU 10 -4.616 9.823 -12.827
121 H LYS 11 H LYS 11 -1.391 8.611 -14.116
122 HA LYS 11 HA LYS 11 -2.359 10.496 -16.073
123 HB2 LYS 11 HB2 LYS 11 -0.343 11.754 -15.518
124 HB3 LYS 11 HB3 LYS 11 -1.155 11.172 -14.051
125 HG2 LYS 11 HG2 LYS 11 0.483 9.311 -13.896
126 HG3 LYS 11 HG3 LYS 11 1.276 9.880 -15.377
127 HD2 LYS 11 HD2 LYS 11 2.507 10.624 -13.405
128 HD3 LYS 11 HD3 LYS 11 1.831 12.015 -14.283
129 HE2 LYS 11 HE2 LYS 11 -0.047 12.124 -12.682
130 HE3 LYS 11 HE3 LYS 11 0.595 10.721 -11.816
131 HZ1 LYS 11 HZ1 LYS 11 2.573 12.006 -11.335
132 HZ2 LYS 11 HZ2 LYS 11 1.967 13.312 -12.125
133 HZ3 LYS 11 HZ3 LYS 11 1.237 12.767 -10.761
134 H LEU 12 H LEU 12 -0.492 7.626 -16.343
135 HA LEU 12 HA LEU 12 1.075 8.428 -18.649
136 HB2 LEU 12 HB2 LEU 12 1.820 6.685 -17.110
137 HB3 LEU 12 HB3 LEU 12 0.350 5.740 -17.417
138 HG LEU 12 HG LEU 12 1.047 5.403 -19.771
139 HD11 LEU 12 HD11 LEU 12 3.569 6.860 -18.858
140 HD12 LEU 12 HD12 LEU 12 3.395 5.992 -20.397
141 HD13 LEU 12 HD13 LEU 12 2.413 7.439 -20.080
142 HD21 LEU 12 HD21 LEU 12 1.650 3.770 -18.032
143 HD22 LEU 12 HD22 LEU 12 2.923 3.879 -19.265
144 HD23 LEU 12 HD23 LEU 12 3.142 4.675 -17.685
145 H LEU 13 H LEU 13 -2.214 7.435 -18.115
146 HA LEU 13 HA LEU 13 -2.563 7.042 -21.048
147 HB2 LEU 13 HB2 LEU 13 -3.988 5.597 -18.776
148 HB3 LEU 13 HB3 LEU 13 -4.328 5.380 -20.499
149 HG LEU 13 HG LEU 13 -1.650 4.768 -19.168
150 HD11 LEU 13 HD11 LEU 13 -3.886 2.908 -20.072
151 HD12 LEU 13 HD12 LEU 13 -2.297 2.413 -19.446
152 HD13 LEU 13 HD13 LEU 13 -3.444 3.259 -18.384
153 HD21 LEU 13 HD21 LEU 13 -1.461 5.289 -21.589
154 HD22 LEU 13 HD22 LEU 13 -1.211 3.558 -21.297
155 HD23 LEU 13 HD23 LEU 13 -2.767 4.131 -21.941
156 H LYS 14 H LYS 14 -3.198 9.106 -18.568
157 HA LYS 14 HA LYS 14 -5.595 10.144 -19.986
158 HB2 LYS 14 HB2 LYS 14 -5.301 9.986 -16.964
159 HB3 LYS 14 HB3 LYS 14 -6.622 10.765 -17.850
160 HG2 LYS 14 HG2 LYS 14 -7.163 8.554 -18.916
161 HG3 LYS 14 HG3 LYS 14 -5.929 7.797 -17.883
162 HD2 LYS 14 HD2 LYS 14 -7.154 8.619 -15.868
163 HD3 LYS 14 HD3 LYS 14 -8.395 9.315 -16.934
164 HE2 LYS 14 HE2 LYS 14 -8.835 7.061 -17.874
165 HE3 LYS 14 HE3 LYS 14 -7.627 6.372 -16.780
166 HZ1 LYS 14 HZ1 LYS 14 -8.973 7.123 -14.933
167 HZ2 LYS 14 HZ2 LYS 14 -10.085 7.772 -15.948
168 HZ3 LYS 14 HZ3 LYS 14 -9.851 6.145 -15.922
169 HN1 NH2 15 HN1 NHE 15 -2.493 10.677 -19.574
170 HN2 NH2 15 HN2 NHE 15 -2.457 12.403 -19.311
Start of MODEL 11
1 H1 LYS 1 H1 LYS 1 5.875 0.045 -1.135
2 H2 LYS 1 H2 LYS 1 5.948 1.188 0.044
3 H3 LYS 1 H3 LYS 1 6.413 1.553 -1.497
4 HA LYS 1 HA LYS 1 3.698 0.826 -0.660
5 HB2 LYS 1 HB2 LYS 1 3.090 3.158 -1.113
6 HB3 LYS 1 HB3 LYS 1 4.287 3.037 0.180
7 HG2 LYS 1 HG2 LYS 1 6.087 3.640 -1.413
8 HG3 LYS 1 HG3 LYS 1 4.885 3.756 -2.727
9 HD2 LYS 1 HD2 LYS 1 3.694 5.526 -1.485
10 HD3 LYS 1 HD3 LYS 1 4.881 5.430 -0.177
11 HE2 LYS 1 HE2 LYS 1 5.496 6.161 -3.070
12 HE3 LYS 1 HE3 LYS 1 5.316 7.313 -1.738
13 HZ1 LYS 1 HZ1 LYS 1 7.183 6.260 -0.657
14 HZ2 LYS 1 HZ2 LYS 1 7.371 5.207 -1.902
15 HZ3 LYS 1 HZ3 LYS 1 7.605 6.819 -2.142
16 H LEU 2 H LEU 2 2.107 0.840 -2.299
17 HA LEU 2 HA LEU 2 3.078 0.980 -5.099
18 HB2 LEU 2 HB2 LEU 2 1.604 -1.356 -3.824
19 HB3 LEU 2 HB3 LEU 2 1.841 -1.165 -5.563
20 HG LEU 2 HG LEU 2 4.119 -1.392 -3.544
21 HD11 LEU 2 HD11 LEU 2 2.775 -3.459 -3.673
22 HD12 LEU 2 HD12 LEU 2 2.932 -3.450 -5.448
23 HD13 LEU 2 HD13 LEU 2 4.367 -3.675 -4.420
24 HD21 LEU 2 HD21 LEU 2 4.054 -1.538 -6.596
25 HD22 LEU 2 HD22 LEU 2 4.734 -0.203 -5.638
26 HD23 LEU 2 HD23 LEU 2 5.480 -1.813 -5.569
27 H LEU 3 H LEU 3 1.073 2.382 -3.011
28 HA LEU 3 HA LEU 3 -1.441 2.117 -4.516
29 HB2 LEU 3 HB2 LEU 3 -1.655 2.188 -2.137
30 HB3 LEU 3 HB3 LEU 3 -0.510 3.539 -2.005
31 HG LEU 3 HG LEU 3 -2.084 5.024 -3.152
32 HD11 LEU 3 HD11 LEU 3 -4.003 2.650 -2.950
33 HD12 LEU 3 HD12 LEU 3 -4.454 4.301 -3.436
34 HD13 LEU 3 HD13 LEU 3 -3.369 3.341 -4.461
35 HD21 LEU 3 HD21 LEU 3 -3.256 3.562 -0.747
36 HD22 LEU 3 HD22 LEU 3 -2.055 4.882 -0.691
37 HD23 LEU 3 HD23 LEU 3 -3.698 5.202 -1.282
38 H LYS 4 H LYS 4 1.142 4.526 -3.868
39 HA LYS 4 HA LYS 4 -0.046 6.566 -5.533
40 HB2 LYS 4 HB2 LYS 4 1.571 7.055 -3.742
41 HB3 LYS 4 HB3 LYS 4 2.814 6.119 -4.584
42 HG2 LYS 4 HG2 LYS 4 2.802 7.696 -6.463
43 HG3 LYS 4 HG3 LYS 4 1.455 8.596 -5.722
44 HD2 LYS 4 HD2 LYS 4 2.884 9.127 -3.772
45 HD3 LYS 4 HD3 LYS 4 4.215 8.205 -4.490
46 HE2 LYS 4 HE2 LYS 4 4.552 10.584 -4.916
47 HE3 LYS 4 HE3 LYS 4 4.233 9.741 -6.437
48 HZ1 LYS 4 HZ1 LYS 4 2.248 11.275 -4.893
49 HZ2 LYS 4 HZ2 LYS 4 3.001 11.794 -6.258
50 HZ3 LYS 4 HZ3 LYS 4 1.964 10.523 -6.321
51 H LEU 5 H LEU 5 1.706 3.637 -6.175
52 HA LEU 5 HA LEU 5 2.840 4.386 -8.697
53 HB2 LEU 5 HB2 LEU 5 3.583 2.410 -7.483
54 HB3 LEU 5 HB3 LEU 5 1.958 1.720 -7.521
55 HG LEU 5 HG LEU 5 2.070 1.520 -9.988
56 HD11 LEU 5 HD11 LEU 5 3.646 3.364 -10.478
57 HD12 LEU 5 HD12 LEU 5 4.938 2.501 -9.607
58 HD13 LEU 5 HD13 LEU 5 4.277 1.834 -11.113
59 HD21 LEU 5 HD21 LEU 5 3.730 -0.294 -10.032
60 HD22 LEU 5 HD22 LEU 5 4.437 0.297 -8.509
61 HD23 LEU 5 HD23 LEU 5 2.776 -0.341 -8.535
62 H LEU 6 H LEU 6 -0.433 3.534 -7.651
63 HA LEU 6 HA LEU 6 -1.392 2.824 -10.276
64 HB2 LEU 6 HB2 LEU 6 -2.909 3.828 -7.836
65 HB3 LEU 6 HB3 LEU 6 -3.611 3.013 -9.239
66 HG LEU 6 HG LEU 6 -1.615 1.795 -7.278
67 HD11 LEU 6 HD11 LEU 6 -3.521 0.410 -6.592
68 HD12 LEU 6 HD12 LEU 6 -3.891 2.132 -6.366
69 HD13 LEU 6 HD13 LEU 6 -4.573 1.249 -7.754
70 HD21 LEU 6 HD21 LEU 6 -3.082 0.587 -9.659
71 HD22 LEU 6 HD22 LEU 6 -1.322 0.836 -9.533
72 HD23 LEU 6 HD23 LEU 6 -2.134 -0.325 -8.468
73 H LYS 7 H LYS 7 -0.919 5.855 -8.532
74 HA LYS 7 HA LYS 7 -2.480 7.411 -10.473
75 HB2 LYS 7 HB2 LYS 7 -0.719 8.121 -8.106
76 HB3 LYS 7 HB3 LYS 7 -1.363 9.340 -9.213
77 HG2 LYS 7 HG2 LYS 7 -2.800 9.207 -7.307
78 HG3 LYS 7 HG3 LYS 7 -3.668 8.624 -8.733
79 HD2 LYS 7 HD2 LYS 7 -3.361 6.297 -8.020
80 HD3 LYS 7 HD3 LYS 7 -2.357 6.825 -6.651
81 HE2 LYS 7 HE2 LYS 7 -5.290 7.540 -7.102
82 HE3 LYS 7 HE3 LYS 7 -4.703 6.292 -6.004
83 HZ1 LYS 7 HZ1 LYS 7 -5.144 8.332 -4.849
84 HZ2 LYS 7 HZ2 LYS 7 -3.538 8.000 -4.775
85 HZ3 LYS 7 HZ3 LYS 7 -4.090 9.164 -5.797
86 H LYS 8 H LYS 8 0.854 6.386 -9.975
87 HA LYS 8 HA LYS 8 2.044 8.271 -11.812
88 HB2 LYS 8 HB2 LYS 8 3.304 7.199 -10.023
89 HB3 LYS 8 HB3 LYS 8 2.957 5.592 -10.687
90 HG2 LYS 8 HG2 LYS 8 4.250 6.090 -12.703
91 HG3 LYS 8 HG3 LYS 8 4.519 7.757 -12.144
92 HD2 LYS 8 HD2 LYS 8 5.748 6.913 -10.177
93 HD3 LYS 8 HD3 LYS 8 5.442 5.242 -10.687
94 HE2 LYS 8 HE2 LYS 8 7.702 5.899 -11.330
95 HE3 LYS 8 HE3 LYS 8 6.711 5.617 -12.765
96 HZ1 LYS 8 HZ1 LYS 8 6.417 7.994 -12.953
97 HZ2 LYS 8 HZ2 LYS 8 7.327 8.251 -11.603
98 HZ3 LYS 8 HZ3 LYS 8 8.015 7.616 -12.952
99 H LEU 9 H LEU 9 0.441 5.146 -12.140
100 HA LEU 9 HA LEU 9 1.308 4.883 -14.956
101 HB2 LEU 9 HB2 LEU 9 -0.451 3.189 -13.140
102 HB3 LEU 9 HB3 LEU 9 -0.048 2.772 -14.813
103 HG LEU 9 HG LEU 9 2.038 3.231 -12.640
104 HD11 LEU 9 HD11 LEU 9 2.226 0.760 -12.594
105 HD12 LEU 9 HD12 LEU 9 0.611 1.293 -12.087
106 HD13 LEU 9 HD13 LEU 9 0.859 0.635 -13.727
107 HD21 LEU 9 HD21 LEU 9 3.509 2.020 -14.218
108 HD22 LEU 9 HD22 LEU 9 2.185 1.973 -15.407
109 HD23 LEU 9 HD23 LEU 9 2.892 3.531 -14.921
110 H LEU 10 H LEU 10 -1.369 6.195 -13.117
111 HA LEU 10 HA LEU 10 -3.375 5.863 -15.172
112 HB2 LEU 10 HB2 LEU 10 -3.984 6.062 -12.866
113 HB3 LEU 10 HB3 LEU 10 -3.160 7.616 -12.696
114 HG LEU 10 HG LEU 10 -5.349 7.366 -14.750
115 HD11 LEU 10 HD11 LEU 10 -5.768 7.702 -11.751
116 HD12 LEU 10 HD12 LEU 10 -7.022 7.884 -13.001
117 HD13 LEU 10 HD13 LEU 10 -6.272 6.300 -12.728
118 HD21 LEU 10 HD21 LEU 10 -4.099 9.524 -14.528
119 HD22 LEU 10 HD22 LEU 10 -5.787 9.705 -14.032
120 HD23 LEU 10 HD23 LEU 10 -4.519 9.566 -12.797
121 H LYS 11 H LYS 11 -0.974 8.401 -14.403
122 HA LYS 11 HA LYS 11 -2.161 10.342 -16.171
123 HB2 LYS 11 HB2 LYS 11 -0.039 11.557 -15.853
124 HB3 LYS 11 HB3 LYS 11 -0.740 11.011 -14.322
125 HG2 LYS 11 HG2 LYS 11 0.828 9.117 -14.242
126 HG3 LYS 11 HG3 LYS 11 1.480 9.562 -15.832
127 HD2 LYS 11 HD2 LYS 11 2.954 10.333 -14.030
128 HD3 LYS 11 HD3 LYS 11 2.274 11.713 -14.916
129 HE2 LYS 11 HE2 LYS 11 0.569 12.009 -13.146
130 HE3 LYS 11 HE3 LYS 11 1.229 10.613 -12.275
131 HZ1 LYS 11 HZ1 LYS 11 3.297 11.830 -12.057
132 HZ2 LYS 11 HZ2 LYS 11 2.667 13.116 -12.865
133 HZ3 LYS 11 HZ3 LYS 11 2.055 12.682 -11.405
134 H LEU 12 H LEU 12 -0.519 7.429 -16.851
135 HA LEU 12 HA LEU 12 0.793 8.376 -19.278
136 HB2 LEU 12 HB2 LEU 12 0.215 5.543 -18.342
137 HB3 LEU 12 HB3 LEU 12 1.350 6.021 -19.608
138 HG LEU 12 HG LEU 12 1.567 6.727 -16.652
139 HD11 LEU 12 HD11 LEU 12 3.179 4.835 -18.412
140 HD12 LEU 12 HD12 LEU 12 3.492 5.187 -16.695
141 HD13 LEU 12 HD13 LEU 12 2.003 4.345 -17.173
142 HD21 LEU 12 HD21 LEU 12 2.568 8.499 -18.051
143 HD22 LEU 12 HD22 LEU 12 3.838 7.543 -17.265
144 HD23 LEU 12 HD23 LEU 12 3.462 7.274 -18.981
145 H LEU 13 H LEU 13 -2.429 7.600 -18.437
146 HA LEU 13 HA LEU 13 -3.111 7.332 -21.314
147 HB2 LEU 13 HB2 LEU 13 -4.232 5.666 -19.023
148 HB3 LEU 13 HB3 LEU 13 -4.859 5.647 -20.673
149 HG LEU 13 HG LEU 13 -2.005 4.881 -19.944
150 HD11 LEU 13 HD11 LEU 13 -4.445 3.150 -20.530
151 HD12 LEU 13 HD12 LEU 13 -2.785 2.563 -20.301
152 HD13 LEU 13 HD13 LEU 13 -3.654 3.328 -18.950
153 HD21 LEU 13 HD21 LEU 13 -3.659 4.498 -22.477
154 HD22 LEU 13 HD22 LEU 13 -2.295 5.629 -22.290
155 HD23 LEU 13 HD23 LEU 13 -2.014 3.877 -22.208
156 H LYS 14 H LYS 14 -3.470 9.108 -18.536
157 HA LYS 14 HA LYS 14 -5.944 10.326 -19.623
158 HB2 LYS 14 HB2 LYS 14 -5.417 9.742 -16.684
159 HB3 LYS 14 HB3 LYS 14 -6.739 10.742 -17.315
160 HG2 LYS 14 HG2 LYS 14 -7.555 8.789 -18.638
161 HG3 LYS 14 HG3 LYS 14 -6.296 7.781 -17.885
162 HD2 LYS 14 HD2 LYS 14 -7.245 8.223 -15.657
163 HD3 LYS 14 HD3 LYS 14 -8.440 9.323 -16.364
164 HE2 LYS 14 HE2 LYS 14 -9.464 7.146 -15.922
165 HE3 LYS 14 HE3 LYS 14 -9.423 7.475 -17.660
166 HZ1 LYS 14 HZ1 LYS 14 -7.482 6.055 -17.807
167 HZ2 LYS 14 HZ2 LYS 14 -7.531 5.760 -16.186
168 HZ3 LYS 14 HZ3 LYS 14 -8.749 5.240 -17.162
169 HN1 NH2 15 HN1 NHE 15 -2.826 10.787 -19.452
170 HN2 NH2 15 HN2 NHE 15 -2.737 12.472 -18.981
Start of MODEL 12
1 H1 LYS 1 H1 LYS 1 0.758 1.335 0.643
2 H2 LYS 1 H2 LYS 1 1.861 1.096 1.841
3 H3 LYS 1 H3 LYS 1 1.319 -0.177 0.949
4 HA LYS 1 HA LYS 1 2.901 2.066 -0.074
5 HB2 LYS 1 HB2 LYS 1 4.078 0.468 1.474
6 HB3 LYS 1 HB3 LYS 1 3.737 -0.832 0.321
7 HG2 LYS 1 HG2 LYS 1 5.077 0.324 -1.404
8 HG3 LYS 1 HG3 LYS 1 5.284 1.717 -0.324
9 HD2 LYS 1 HD2 LYS 1 7.293 0.311 -0.334
10 HD3 LYS 1 HD3 LYS 1 6.533 0.314 1.269
11 HE2 LYS 1 HE2 LYS 1 5.477 -1.866 0.781
12 HE3 LYS 1 HE3 LYS 1 6.186 -1.858 -0.845
13 HZ1 LYS 1 HZ1 LYS 1 8.354 -1.887 0.171
14 HZ2 LYS 1 HZ2 LYS 1 7.714 -1.864 1.679
15 HZ3 LYS 1 HZ3 LYS 1 7.474 -3.163 0.705
16 H LEU 2 H LEU 2 3.730 1.587 -2.335
17 HA LEU 2 HA LEU 2 3.315 1.224 -4.498
18 HB2 LEU 2 HB2 LEU 2 1.970 -1.361 -3.702
19 HB3 LEU 2 HB3 LEU 2 2.703 -0.962 -5.251
20 HG LEU 2 HG LEU 2 4.189 -1.261 -2.596
21 HD11 LEU 2 HD11 LEU 2 5.113 -3.275 -3.641
22 HD12 LEU 2 HD12 LEU 2 3.344 -3.380 -3.534
23 HD13 LEU 2 HD13 LEU 2 4.122 -3.000 -5.091
24 HD21 LEU 2 HD21 LEU 2 5.219 -0.777 -5.426
25 HD22 LEU 2 HD22 LEU 2 5.304 0.383 -4.078
26 HD23 LEU 2 HD23 LEU 2 6.226 -1.131 -4.003
27 H LEU 3 H LEU 3 1.252 2.721 -2.973
28 HA LEU 3 HA LEU 3 -1.163 2.112 -4.603
29 HB2 LEU 3 HB2 LEU 3 -0.916 4.123 -2.349
30 HB3 LEU 3 HB3 LEU 3 -2.394 3.459 -3.052
31 HG LEU 3 HG LEU 3 -0.317 1.940 -1.440
32 HD11 LEU 3 HD11 LEU 3 -3.161 2.811 -0.790
33 HD12 LEU 3 HD12 LEU 3 -2.114 1.843 0.269
34 HD13 LEU 3 HD13 LEU 3 -1.677 3.527 -0.119
35 HD21 LEU 3 HD21 LEU 3 -3.013 1.061 -2.574
36 HD22 LEU 3 HD22 LEU 3 -1.420 0.462 -3.097
37 HD23 LEU 3 HD23 LEU 3 -2.010 0.101 -1.462
38 H LYS 4 H LYS 4 1.261 4.588 -3.867
39 HA LYS 4 HA LYS 4 0.137 6.668 -5.499
40 HB2 LYS 4 HB2 LYS 4 1.829 7.083 -3.768
41 HB3 LYS 4 HB3 LYS 4 3.008 6.099 -4.656
42 HG2 LYS 4 HG2 LYS 4 3.011 7.694 -6.515
43 HG3 LYS 4 HG3 LYS 4 1.698 8.618 -5.759
44 HD2 LYS 4 HD2 LYS 4 3.836 9.732 -5.380
45 HD3 LYS 4 HD3 LYS 4 3.168 9.146 -3.843
46 HE2 LYS 4 HE2 LYS 4 4.660 7.168 -3.947
47 HE3 LYS 4 HE3 LYS 4 5.291 7.729 -5.511
48 HZ1 LYS 4 HZ1 LYS 4 6.733 8.319 -3.699
49 HZ2 LYS 4 HZ2 LYS 4 6.123 9.675 -4.397
50 HZ3 LYS 4 HZ3 LYS 4 5.537 9.158 -2.950
51 H LEU 5 H LEU 5 1.851 3.729 -6.248
52 HA LEU 5 HA LEU 5 2.826 4.544 -8.842
53 HB2 LEU 5 HB2 LEU 5 2.358 1.902 -7.441
54 HB3 LEU 5 HB3 LEU 5 2.712 1.944 -9.171
55 HG LEU 5 HG LEU 5 4.800 3.188 -8.757
56 HD11 LEU 5 HD11 LEU 5 5.704 3.311 -6.446
57 HD12 LEU 5 HD12 LEU 5 4.280 4.333 -6.651
58 HD13 LEU 5 HD13 LEU 5 4.127 2.768 -5.813
59 HD21 LEU 5 HD21 LEU 5 6.029 1.307 -7.748
60 HD22 LEU 5 HD22 LEU 5 4.499 0.629 -7.136
61 HD23 LEU 5 HD23 LEU 5 4.799 0.726 -8.888
62 H LEU 6 H LEU 6 -0.354 3.700 -7.615
63 HA LEU 6 HA LEU 6 -1.416 2.806 -10.151
64 HB2 LEU 6 HB2 LEU 6 -2.839 3.964 -7.728
65 HB3 LEU 6 HB3 LEU 6 -3.597 3.052 -9.039
66 HG LEU 6 HG LEU 6 -1.470 1.937 -7.155
67 HD11 LEU 6 HD11 LEU 6 -4.476 1.479 -7.255
68 HD12 LEU 6 HD12 LEU 6 -3.328 0.664 -6.168
69 HD13 LEU 6 HD13 LEU 6 -3.607 2.411 -6.010
70 HD21 LEU 6 HD21 LEU 6 -3.234 0.605 -9.257
71 HD22 LEU 6 HD22 LEU 6 -1.470 0.825 -9.355
72 HD23 LEU 6 HD23 LEU 6 -2.161 -0.245 -8.120
73 H LYS 7 H LYS 7 -0.944 5.938 -8.564
74 HA LYS 7 HA LYS 7 -2.553 7.431 -10.483
75 HB2 LYS 7 HB2 LYS 7 -0.330 8.329 -8.608
76 HB3 LYS 7 HB3 LYS 7 -1.518 9.377 -9.394
77 HG2 LYS 7 HG2 LYS 7 -3.328 8.423 -8.094
78 HG3 LYS 7 HG3 LYS 7 -2.266 7.149 -7.439
79 HD2 LYS 7 HD2 LYS 7 -0.860 8.812 -6.359
80 HD3 LYS 7 HD3 LYS 7 -1.879 10.130 -6.985
81 HE2 LYS 7 HE2 LYS 7 -3.829 9.167 -5.771
82 HE3 LYS 7 HE3 LYS 7 -2.790 7.889 -5.119
83 HZ1 LYS 7 HZ1 LYS 7 -1.494 9.594 -4.023
84 HZ2 LYS 7 HZ2 LYS 7 -2.459 10.776 -4.634
85 HZ3 LYS 7 HZ3 LYS 7 -3.064 9.689 -3.563
86 H LYS 8 H LYS 8 0.871 6.604 -9.990
87 HA LYS 8 HA LYS 8 1.967 8.208 -12.064
88 HB2 LYS 8 HB2 LYS 8 3.274 7.206 -10.246
89 HB3 LYS 8 HB3 LYS 8 2.920 5.576 -10.862
90 HG2 LYS 8 HG2 LYS 8 4.136 6.069 -12.942
91 HG3 LYS 8 HG3 LYS 8 4.435 7.733 -12.393
92 HD2 LYS 8 HD2 LYS 8 5.682 6.846 -10.432
93 HD3 LYS 8 HD3 LYS 8 5.430 5.192 -11.026
94 HE2 LYS 8 HE2 LYS 8 6.907 7.409 -12.504
95 HE3 LYS 8 HE3 LYS 8 7.668 6.076 -11.625
96 HZ1 LYS 8 HZ1 LYS 8 5.907 5.779 -13.965
97 HZ2 LYS 8 HZ2 LYS 8 7.541 5.620 -13.961
98 HZ3 LYS 8 HZ3 LYS 8 6.615 4.544 -13.142
99 H LEU 9 H LEU 9 0.363 5.049 -12.159
100 HA LEU 9 HA LEU 9 1.114 4.644 -14.982
101 HB2 LEU 9 HB2 LEU 9 -0.589 3.083 -13.005
102 HB3 LEU 9 HB3 LEU 9 -0.320 2.575 -14.678
103 HG LEU 9 HG LEU 9 1.937 3.051 -12.676
104 HD11 LEU 9 HD11 LEU 9 0.584 0.465 -13.539
105 HD12 LEU 9 HD12 LEU 9 2.036 0.590 -12.511
106 HD13 LEU 9 HD13 LEU 9 0.478 1.218 -11.928
107 HD21 LEU 9 HD21 LEU 9 1.834 1.645 -15.383
108 HD22 LEU 9 HD22 LEU 9 2.624 3.208 -15.050
109 HD23 LEU 9 HD23 LEU 9 3.244 1.720 -14.316
110 H LEU 10 H LEU 10 -1.491 6.084 -13.131
111 HA LEU 10 HA LEU 10 -3.493 5.765 -15.212
112 HB2 LEU 10 HB2 LEU 10 -4.156 5.891 -12.926
113 HB3 LEU 10 HB3 LEU 10 -3.330 7.433 -12.674
114 HG LEU 10 HG LEU 10 -5.481 7.268 -14.790
115 HD11 LEU 10 HD11 LEU 10 -5.953 7.550 -11.794
116 HD12 LEU 10 HD12 LEU 10 -7.176 7.765 -13.065
117 HD13 LEU 10 HD13 LEU 10 -6.447 6.169 -12.806
118 HD21 LEU 10 HD21 LEU 10 -4.632 9.401 -12.768
119 HD22 LEU 10 HD22 LEU 10 -4.212 9.399 -14.496
120 HD23 LEU 10 HD23 LEU 10 -5.903 9.591 -13.997
121 H LYS 11 H LYS 11 -1.181 8.318 -14.217
122 HA LYS 11 HA LYS 11 -2.293 10.326 -15.943
123 HB2 LYS 11 HB2 LYS 11 -0.252 11.572 -15.432
124 HB3 LYS 11 HB3 LYS 11 -0.936 10.855 -13.963
125 HG2 LYS 11 HG2 LYS 11 0.693 8.972 -14.150
126 HG3 LYS 11 HG3 LYS 11 1.414 9.753 -15.571
127 HD2 LYS 11 HD2 LYS 11 1.265 10.943 -12.767
128 HD3 LYS 11 HD3 LYS 11 2.700 10.214 -13.515
129 HE2 LYS 11 HE2 LYS 11 2.611 11.915 -15.324
130 HE3 LYS 11 HE3 LYS 11 1.214 12.671 -14.537
131 HZ1 LYS 11 HZ1 LYS 11 2.598 13.083 -12.621
132 HZ2 LYS 11 HZ2 LYS 11 3.895 12.386 -13.357
133 HZ3 LYS 11 HZ3 LYS 11 3.246 13.778 -13.958
134 H LEU 12 H LEU 12 -0.568 7.489 -16.694
135 HA LEU 12 HA LEU 12 0.862 8.552 -18.998
136 HB2 LEU 12 HB2 LEU 12 1.700 6.618 -17.750
137 HB3 LEU 12 HB3 LEU 12 0.206 5.730 -18.077
138 HG LEU 12 HG LEU 12 0.725 5.783 -20.523
139 HD11 LEU 12 HD11 LEU 12 2.123 7.815 -20.597
140 HD12 LEU 12 HD12 LEU 12 3.340 7.030 -19.565
141 HD13 LEU 12 HD13 LEU 12 3.030 6.422 -21.212
142 HD21 LEU 12 HD21 LEU 12 1.404 3.875 -19.117
143 HD22 LEU 12 HD22 LEU 12 2.591 4.169 -20.411
144 HD23 LEU 12 HD23 LEU 12 2.950 4.683 -18.750
145 H LEU 13 H LEU 13 -2.336 7.208 -18.321
146 HA LEU 13 HA LEU 13 -2.949 7.096 -21.240
147 HB2 LEU 13 HB2 LEU 13 -4.271 5.939 -18.755
148 HB3 LEU 13 HB3 LEU 13 -5.085 6.009 -20.312
149 HG LEU 13 HG LEU 13 -4.181 3.812 -19.941
150 HD11 LEU 13 HD11 LEU 13 -4.259 4.697 -22.253
151 HD12 LEU 13 HD12 LEU 13 -2.573 5.248 -22.091
152 HD13 LEU 13 HD13 LEU 13 -2.952 3.515 -22.020
153 HD21 LEU 13 HD21 LEU 13 -2.253 4.461 -18.487
154 HD22 LEU 13 HD22 LEU 13 -1.824 3.322 -19.783
155 HD23 LEU 13 HD23 LEU 13 -1.397 5.032 -19.948
156 H LYS 14 H LYS 14 -3.757 8.735 -18.195
157 HA LYS 14 HA LYS 14 -5.927 10.234 -19.525
158 HB2 LYS 14 HB2 LYS 14 -4.939 10.283 -16.651
159 HB3 LYS 14 HB3 LYS 14 -6.382 11.103 -17.266
160 HG2 LYS 14 HG2 LYS 14 -5.917 8.088 -17.204
161 HG3 LYS 14 HG3 LYS 14 -6.961 9.013 -16.111
162 HD2 LYS 14 HD2 LYS 14 -8.357 9.712 -18.047
163 HD3 LYS 14 HD3 LYS 14 -7.345 8.725 -19.124
164 HE2 LYS 14 HE2 LYS 14 -7.908 6.704 -17.788
165 HE3 LYS 14 HE3 LYS 14 -8.946 7.684 -16.745
166 HZ1 LYS 14 HZ1 LYS 14 -9.316 7.286 -19.638
167 HZ2 LYS 14 HZ2 LYS 14 -10.210 6.591 -18.449
168 HZ3 LYS 14 HZ3 LYS 14 -10.274 8.214 -18.683
169 HN1 NH2 15 HN1 NHE 15 -2.642 10.533 -19.499
170 HN2 NH2 15 HN2 NHE 15 -2.518 12.281 -19.533
Start of MODEL 13
1 H1 LYS 1 H1 LYS 1 4.615 2.124 -1.282
2 H2 LYS 1 H2 LYS 1 4.091 2.476 0.240
3 H3 LYS 1 H3 LYS 1 3.442 3.251 -1.063
4 HA LYS 1 HA LYS 1 3.218 0.385 -0.488
5 HB2 LYS 1 HB2 LYS 1 1.117 2.578 -0.295
6 HB3 LYS 1 HB3 LYS 1 0.820 0.837 -0.116
7 HG2 LYS 1 HG2 LYS 1 2.349 0.760 1.823
8 HG3 LYS 1 HG3 LYS 1 2.675 2.493 1.647
9 HD2 LYS 1 HD2 LYS 1 1.041 2.140 3.416
10 HD3 LYS 1 HD3 LYS 1 0.278 2.985 2.063
11 HE2 LYS 1 HE2 LYS 1 -0.700 0.852 1.276
12 HE3 LYS 1 HE3 LYS 1 0.114 -0.010 2.597
13 HZ1 LYS 1 HZ1 LYS 1 -2.167 0.489 3.133
14 HZ2 LYS 1 HZ2 LYS 1 -1.157 1.308 4.143
15 HZ3 LYS 1 HZ3 LYS 1 -1.919 2.097 2.916
16 H LEU 2 H LEU 2 1.725 -0.756 -1.899
17 HA LEU 2 HA LEU 2 2.251 -0.110 -4.660
18 HB2 LEU 2 HB2 LEU 2 0.559 -2.319 -3.435
19 HB3 LEU 2 HB3 LEU 2 1.120 -2.251 -5.111
20 HG LEU 2 HG LEU 2 2.923 -2.424 -2.655
21 HD11 LEU 2 HD11 LEU 2 2.186 -4.504 -4.757
22 HD12 LEU 2 HD12 LEU 2 3.349 -4.713 -3.430
23 HD13 LEU 2 HD13 LEU 2 1.625 -4.484 -3.071
24 HD21 LEU 2 HD21 LEU 2 4.703 -2.899 -4.343
25 HD22 LEU 2 HD22 LEU 2 3.539 -2.566 -5.643
26 HD23 LEU 2 HD23 LEU 2 4.035 -1.267 -4.533
27 H LEU 3 H LEU 3 0.701 1.975 -3.568
28 HA LEU 3 HA LEU 3 -1.710 1.717 -5.289
29 HB2 LEU 3 HB2 LEU 3 -3.100 2.773 -3.680
30 HB3 LEU 3 HB3 LEU 3 -2.278 1.427 -2.894
31 HG LEU 3 HG LEU 3 -0.540 3.297 -2.153
32 HD11 LEU 3 HD11 LEU 3 -1.574 5.184 -3.405
33 HD12 LEU 3 HD12 LEU 3 -3.110 4.890 -2.566
34 HD13 LEU 3 HD13 LEU 3 -1.682 5.448 -1.663
35 HD21 LEU 3 HD21 LEU 3 -3.320 3.028 -0.941
36 HD22 LEU 3 HD22 LEU 3 -1.958 1.916 -0.664
37 HD23 LEU 3 HD23 LEU 3 -1.863 3.599 -0.095
38 H LYS 4 H LYS 4 1.062 3.566 -4.216
39 HA LYS 4 HA LYS 4 0.220 6.055 -5.436
40 HB2 LYS 4 HB2 LYS 4 1.925 5.974 -3.673
41 HB3 LYS 4 HB3 LYS 4 2.961 4.949 -4.687
42 HG2 LYS 4 HG2 LYS 4 3.176 6.748 -6.348
43 HG3 LYS 4 HG3 LYS 4 2.105 7.790 -5.389
44 HD2 LYS 4 HD2 LYS 4 4.784 6.666 -4.471
45 HD3 LYS 4 HD3 LYS 4 4.525 8.310 -5.068
46 HE2 LYS 4 HE2 LYS 4 3.212 7.109 -2.592
47 HE3 LYS 4 HE3 LYS 4 4.595 8.204 -2.592
48 HZ1 LYS 4 HZ1 LYS 4 2.562 9.374 -2.199
49 HZ2 LYS 4 HZ2 LYS 4 3.222 9.871 -3.613
50 HZ3 LYS 4 HZ3 LYS 4 1.916 8.863 -3.622
51 H LEU 5 H LEU 5 1.584 3.033 -6.584
52 HA LEU 5 HA LEU 5 2.633 4.015 -9.069
53 HB2 LEU 5 HB2 LEU 5 1.504 1.277 -8.357
54 HB3 LEU 5 HB3 LEU 5 2.532 1.651 -9.749
55 HG LEU 5 HG LEU 5 3.353 1.948 -6.826
56 HD11 LEU 5 HD11 LEU 5 4.778 -0.012 -7.283
57 HD12 LEU 5 HD12 LEU 5 3.062 -0.403 -7.532
58 HD13 LEU 5 HD13 LEU 5 4.122 -0.116 -8.931
59 HD21 LEU 5 HD21 LEU 5 4.940 2.211 -9.420
60 HD22 LEU 5 HD22 LEU 5 4.557 3.531 -8.280
61 HD23 LEU 5 HD23 LEU 5 5.637 2.217 -7.788
62 H LEU 6 H LEU 6 -0.618 3.418 -7.891
63 HA LEU 6 HA LEU 6 -1.829 3.095 -10.483
64 HB2 LEU 6 HB2 LEU 6 -3.081 4.054 -7.876
65 HB3 LEU 6 HB3 LEU 6 -3.940 3.412 -9.280
66 HG LEU 6 HG LEU 6 -1.937 1.856 -7.578
67 HD11 LEU 6 HD11 LEU 6 -4.977 1.719 -7.734
68 HD12 LEU 6 HD12 LEU 6 -3.931 0.658 -6.770
69 HD13 LEU 6 HD13 LEU 6 -4.030 2.387 -6.386
70 HD21 LEU 6 HD21 LEU 6 -3.794 0.985 -9.837
71 HD22 LEU 6 HD22 LEU 6 -2.016 1.030 -9.906
72 HD23 LEU 6 HD23 LEU 6 -2.826 -0.109 -8.820
73 H LYS 7 H LYS 7 -0.848 5.848 -8.511
74 HA LYS 7 HA LYS 7 -2.278 7.766 -10.226
75 HB2 LYS 7 HB2 LYS 7 -0.452 8.040 -7.815
76 HB3 LYS 7 HB3 LYS 7 -0.962 9.422 -8.782
77 HG2 LYS 7 HG2 LYS 7 -2.407 9.252 -6.886
78 HG3 LYS 7 HG3 LYS 7 -3.343 8.879 -8.338
79 HD2 LYS 7 HD2 LYS 7 -3.246 6.484 -7.848
80 HD3 LYS 7 HD3 LYS 7 -2.186 6.786 -6.450
81 HE2 LYS 7 HE2 LYS 7 -5.040 7.799 -6.779
82 HE3 LYS 7 HE3 LYS 7 -4.546 6.413 -5.795
83 HZ1 LYS 7 HZ1 LYS 7 -4.789 8.384 -4.464
84 HZ2 LYS 7 HZ2 LYS 7 -3.212 7.918 -4.467
85 HZ3 LYS 7 HZ3 LYS 7 -3.695 9.202 -5.370
86 H LYS 8 H LYS 8 0.900 6.285 -9.959
87 HA LYS 8 HA LYS 8 2.278 8.264 -11.567
88 HB2 LYS 8 HB2 LYS 8 3.446 6.800 -9.985
89 HB3 LYS 8 HB3 LYS 8 2.925 5.364 -10.896
90 HG2 LYS 8 HG2 LYS 8 4.224 6.097 -12.844
91 HG3 LYS 8 HG3 LYS 8 4.666 7.606 -12.006
92 HD2 LYS 8 HD2 LYS 8 5.830 6.281 -10.260
93 HD3 LYS 8 HD3 LYS 8 5.383 4.780 -11.106
94 HE2 LYS 8 HE2 LYS 8 6.616 5.547 -13.111
95 HE3 LYS 8 HE3 LYS 8 7.062 7.042 -12.269
96 HZ1 LYS 8 HZ1 LYS 8 7.832 4.319 -11.445
97 HZ2 LYS 8 HZ2 LYS 8 8.818 5.410 -12.171
98 HZ3 LYS 8 HZ3 LYS 8 8.244 5.699 -10.656
99 H LEU 9 H LEU 9 0.362 5.373 -12.244
100 HA LEU 9 HA LEU 9 1.114 5.437 -15.093
101 HB2 LEU 9 HB2 LEU 9 -0.767 3.680 -13.477
102 HB3 LEU 9 HB3 LEU 9 -0.441 3.463 -15.201
103 HG LEU 9 HG LEU 9 1.707 3.389 -13.037
104 HD11 LEU 9 HD11 LEU 9 0.308 1.118 -14.515
105 HD12 LEU 9 HD12 LEU 9 1.670 0.941 -13.381
106 HD13 LEU 9 HD13 LEU 9 0.101 1.523 -12.795
107 HD21 LEU 9 HD21 LEU 9 1.718 2.599 -15.986
108 HD22 LEU 9 HD22 LEU 9 2.587 3.978 -15.263
109 HD23 LEU 9 HD23 LEU 9 3.049 2.318 -14.844
110 H LEU 10 H LEU 10 -1.266 6.898 -13.051
111 HA LEU 10 HA LEU 10 -3.484 6.930 -14.847
112 HB2 LEU 10 HB2 LEU 10 -3.812 7.466 -12.529
113 HB3 LEU 10 HB3 LEU 10 -2.573 8.728 -12.580
114 HG LEU 10 HG LEU 10 -3.979 10.098 -14.083
115 HD11 LEU 10 HD11 LEU 10 -6.352 9.465 -14.403
116 HD12 LEU 10 HD12 LEU 10 -5.262 8.315 -15.203
117 HD13 LEU 10 HD13 LEU 10 -6.024 7.879 -13.655
118 HD21 LEU 10 HD21 LEU 10 -5.384 9.146 -11.557
119 HD22 LEU 10 HD22 LEU 10 -4.098 10.376 -11.644
120 HD23 LEU 10 HD23 LEU 10 -5.677 10.684 -12.405
121 H LYS 11 H LYS 11 -0.653 9.105 -14.481
122 HA LYS 11 HA LYS 11 -1.674 11.050 -16.335
123 HB2 LYS 11 HB2 LYS 11 0.580 12.013 -16.203
124 HB3 LYS 11 HB3 LYS 11 -0.042 11.610 -14.592
125 HG2 LYS 11 HG2 LYS 11 1.251 9.488 -14.630
126 HG3 LYS 11 HG3 LYS 11 1.927 9.941 -16.211
127 HD2 LYS 11 HD2 LYS 11 2.243 11.542 -13.638
128 HD3 LYS 11 HD3 LYS 11 3.468 10.457 -14.331
129 HE2 LYS 11 HE2 LYS 11 3.524 11.841 -16.383
130 HE3 LYS 11 HE3 LYS 11 2.310 12.929 -15.689
131 HZ1 LYS 11 HZ1 LYS 11 4.532 13.773 -15.389
132 HZ2 LYS 11 HZ2 LYS 11 3.864 13.429 -13.930
133 HZ3 LYS 11 HZ3 LYS 11 4.994 12.425 -14.579
134 H LEU 12 H LEU 12 -0.581 7.918 -16.870
135 HA LEU 12 HA LEU 12 0.336 8.572 -19.638
136 HB2 LEU 12 HB2 LEU 12 0.639 5.999 -18.048
137 HB3 LEU 12 HB3 LEU 12 1.342 6.346 -19.628
138 HG LEU 12 HG LEU 12 2.004 7.795 -17.022
139 HD11 LEU 12 HD11 LEU 12 3.589 5.811 -18.692
140 HD12 LEU 12 HD12 LEU 12 4.169 6.635 -17.227
141 HD13 LEU 12 HD13 LEU 12 2.826 5.476 -17.116
142 HD21 LEU 12 HD21 LEU 12 2.278 9.275 -18.995
143 HD22 LEU 12 HD22 LEU 12 3.856 8.794 -18.334
144 HD23 LEU 12 HD23 LEU 12 3.237 8.015 -19.809
145 H LEU 13 H LEU 13 -2.147 6.984 -17.703
146 HA LEU 13 HA LEU 13 -3.264 5.592 -20.030
147 HB2 LEU 13 HB2 LEU 13 -3.275 4.515 -17.829
148 HB3 LEU 13 HB3 LEU 13 -4.135 5.888 -17.125
149 HG LEU 13 HG LEU 13 -6.102 5.412 -18.560
150 HD11 LEU 13 HD11 LEU 13 -4.488 2.952 -19.377
151 HD12 LEU 13 HD12 LEU 13 -6.204 3.226 -19.744
152 HD13 LEU 13 HD13 LEU 13 -4.968 4.289 -20.450
153 HD21 LEU 13 HD21 LEU 13 -5.924 4.485 -16.290
154 HD22 LEU 13 HD22 LEU 13 -6.785 3.370 -17.377
155 HD23 LEU 13 HD23 LEU 13 -5.094 3.050 -16.932
156 H LYS 14 H LYS 14 -3.748 8.564 -18.225
157 HA LYS 14 HA LYS 14 -5.788 9.377 -20.230
158 HB2 LYS 14 HB2 LYS 14 -5.800 10.053 -17.263
159 HB3 LYS 14 HB3 LYS 14 -6.909 10.702 -18.486
160 HG2 LYS 14 HG2 LYS 14 -7.660 8.374 -18.999
161 HG3 LYS 14 HG3 LYS 14 -6.631 7.782 -17.671
162 HD2 LYS 14 HD2 LYS 14 -7.874 9.229 -16.082
163 HD3 LYS 14 HD3 LYS 14 -8.933 9.764 -17.406
164 HE2 LYS 14 HE2 LYS 14 -8.606 6.893 -16.442
165 HE3 LYS 14 HE3 LYS 14 -9.957 7.958 -16.039
166 HZ1 LYS 14 HZ1 LYS 14 -9.244 7.069 -18.754
167 HZ2 LYS 14 HZ2 LYS 14 -10.506 6.516 -17.858
168 HZ3 LYS 14 HZ3 LYS 14 -10.490 8.074 -18.375
169 HN1 NH2 15 HN1 NHE 15 -2.716 9.616 -19.688
170 HN2 NH2 15 HN2 NHE 15 -2.425 11.328 -19.874
Start of MODEL 14
1 H1 LYS 1 H1 LYS 1 -1.865 1.413 1.819
2 H2 LYS 1 H2 LYS 1 -2.007 2.881 1.093
3 H3 LYS 1 H3 LYS 1 -1.228 2.763 2.534
4 HA LYS 1 HA LYS 1 0.330 3.042 0.755
5 HB2 LYS 1 HB2 LYS 1 1.793 1.160 1.283
6 HB3 LYS 1 HB3 LYS 1 1.013 1.767 2.751
7 HG2 LYS 1 HG2 LYS 1 -0.623 -0.084 2.657
8 HG3 LYS 1 HG3 LYS 1 0.123 -0.679 1.157
9 HD2 LYS 1 HD2 LYS 1 2.277 -0.981 2.356
10 HD3 LYS 1 HD3 LYS 1 1.510 -0.443 3.860
11 HE2 LYS 1 HE2 LYS 1 0.674 -2.869 2.206
12 HE3 LYS 1 HE3 LYS 1 1.646 -2.924 3.686
13 HZ1 LYS 1 HZ1 LYS 1 -1.113 -1.929 3.498
14 HZ2 LYS 1 HZ2 LYS 1 -0.649 -3.364 4.142
15 HZ3 LYS 1 HZ3 LYS 1 -0.204 -1.961 4.869
16 H LEU 2 H LEU 2 1.536 1.761 -0.966
17 HA LEU 2 HA LEU 2 1.534 0.962 -3.064
18 HB2 LEU 2 HB2 LEU 2 1.477 -1.088 -1.659
19 HB3 LEU 2 HB3 LEU 2 -0.275 -1.172 -1.894
20 HG LEU 2 HG LEU 2 0.073 -1.423 -4.353
21 HD11 LEU 2 HD11 LEU 2 2.226 -0.247 -4.601
22 HD12 LEU 2 HD12 LEU 2 3.025 -1.475 -3.585
23 HD13 LEU 2 HD13 LEU 2 2.361 -1.919 -5.173
24 HD21 LEU 2 HD21 LEU 2 1.673 -3.361 -2.637
25 HD22 LEU 2 HD22 LEU 2 -0.091 -3.399 -2.876
26 HD23 LEU 2 HD23 LEU 2 0.998 -3.691 -4.249
27 H LEU 3 H LEU 3 0.028 3.094 -3.078
28 HA LEU 3 HA LEU 3 -1.947 2.371 -5.149
29 HB2 LEU 3 HB2 LEU 3 -3.724 3.665 -4.236
30 HB3 LEU 3 HB3 LEU 3 -3.146 2.586 -2.974
31 HG LEU 3 HG LEU 3 -1.682 4.675 -2.245
32 HD11 LEU 3 HD11 LEU 3 -2.314 6.181 -4.139
33 HD12 LEU 3 HD12 LEU 3 -4.030 5.954 -3.727
34 HD13 LEU 3 HD13 LEU 3 -2.945 6.798 -2.605
35 HD21 LEU 3 HD21 LEU 3 -4.695 4.514 -1.842
36 HD22 LEU 3 HD22 LEU 3 -3.477 3.591 -0.933
37 HD23 LEU 3 HD23 LEU 3 -3.549 5.365 -0.784
38 H LYS 4 H LYS 4 0.434 4.593 -3.831
39 HA LYS 4 HA LYS 4 -0.125 6.755 -5.631
40 HB2 LYS 4 HB2 LYS 4 1.231 7.035 -3.589
41 HB3 LYS 4 HB3 LYS 4 2.414 5.870 -4.189
42 HG2 LYS 4 HG2 LYS 4 3.244 8.143 -4.457
43 HG3 LYS 4 HG3 LYS 4 3.008 7.405 -6.044
44 HD2 LYS 4 HD2 LYS 4 0.868 8.612 -6.312
45 HD3 LYS 4 HD3 LYS 4 1.045 9.291 -4.672
46 HE2 LYS 4 HE2 LYS 4 3.170 10.366 -5.364
47 HE3 LYS 4 HE3 LYS 4 2.955 9.722 -6.999
48 HZ1 LYS 4 HZ1 LYS 4 1.126 11.591 -5.635
49 HZ2 LYS 4 HZ2 LYS 4 2.188 11.989 -6.820
50 HZ3 LYS 4 HZ3 LYS 4 0.925 11.006 -7.163
51 H LEU 5 H LEU 5 1.510 3.665 -5.970
52 HA LEU 5 HA LEU 5 2.939 4.315 -8.401
53 HB2 LEU 5 HB2 LEU 5 2.023 1.732 -7.068
54 HB3 LEU 5 HB3 LEU 5 2.788 1.738 -8.656
55 HG LEU 5 HG LEU 5 4.773 2.905 -7.705
56 HD11 LEU 5 HD11 LEU 5 3.390 2.359 -5.043
57 HD12 LEU 5 HD12 LEU 5 5.097 2.809 -5.226
58 HD13 LEU 5 HD13 LEU 5 3.847 3.959 -5.705
59 HD21 LEU 5 HD21 LEU 5 5.648 0.896 -6.569
60 HD22 LEU 5 HD22 LEU 5 3.992 0.271 -6.391
61 HD23 LEU 5 HD23 LEU 5 4.699 0.461 -8.008
62 H LEU 6 H LEU 6 -0.420 3.628 -7.632
63 HA LEU 6 HA LEU 6 -1.105 2.768 -10.322
64 HB2 LEU 6 HB2 LEU 6 -2.913 3.834 -8.112
65 HB3 LEU 6 HB3 LEU 6 -3.411 2.918 -9.538
66 HG LEU 6 HG LEU 6 -1.594 1.862 -7.321
67 HD11 LEU 6 HD11 LEU 6 -3.553 0.494 -6.712
68 HD12 LEU 6 HD12 LEU 6 -3.942 2.223 -6.600
69 HD13 LEU 6 HD13 LEU 6 -4.507 1.276 -7.995
70 HD21 LEU 6 HD21 LEU 6 -1.139 0.785 -9.496
71 HD22 LEU 6 HD22 LEU 6 -1.972 -0.333 -8.407
72 HD23 LEU 6 HD23 LEU 6 -2.879 0.469 -9.713
73 H LYS 7 H LYS 7 -0.959 5.859 -8.564
74 HA LYS 7 HA LYS 7 -2.363 7.336 -10.640
75 HB2 LYS 7 HB2 LYS 7 -0.690 8.125 -8.241
76 HB3 LYS 7 HB3 LYS 7 -1.241 9.309 -9.431
77 HG2 LYS 7 HG2 LYS 7 -2.789 9.304 -7.603
78 HG3 LYS 7 HG3 LYS 7 -3.588 8.663 -9.043
79 HD2 LYS 7 HD2 LYS 7 -3.360 6.372 -8.195
80 HD3 LYS 7 HD3 LYS 7 -2.393 6.951 -6.823
81 HE2 LYS 7 HE2 LYS 7 -4.691 6.528 -6.113
82 HE3 LYS 7 HE3 LYS 7 -4.306 8.250 -5.988
83 HZ1 LYS 7 HZ1 LYS 7 -6.453 7.884 -6.971
84 HZ2 LYS 7 HZ2 LYS 7 -5.466 8.594 -8.072
85 HZ3 LYS 7 HZ3 LYS 7 -5.813 6.991 -8.188
86 H LYS 8 H LYS 8 0.964 6.336 -10.055
87 HA LYS 8 HA LYS 8 2.194 8.142 -11.934
88 HB2 LYS 8 HB2 LYS 8 3.449 6.988 -10.156
89 HB3 LYS 8 HB3 LYS 8 3.054 5.419 -10.872
90 HG2 LYS 8 HG2 LYS 8 4.332 5.967 -12.890
91 HG3 LYS 8 HG3 LYS 8 4.595 7.621 -12.308
92 HD2 LYS 8 HD2 LYS 8 6.596 6.284 -11.947
93 HD3 LYS 8 HD3 LYS 8 5.890 6.723 -10.383
94 HE2 LYS 8 HE2 LYS 8 4.834 4.501 -10.214
95 HE3 LYS 8 HE3 LYS 8 5.496 4.054 -11.799
96 HZ1 LYS 8 HZ1 LYS 8 7.083 4.717 -9.413
97 HZ2 LYS 8 HZ2 LYS 8 6.856 3.213 -10.035
98 HZ3 LYS 8 HZ3 LYS 8 7.700 4.338 -10.886
99 H LEU 9 H LEU 9 0.395 5.139 -12.271
100 HA LEU 9 HA LEU 9 1.251 4.818 -15.084
101 HB2 LEU 9 HB2 LEU 9 -0.625 3.238 -13.289
102 HB3 LEU 9 HB3 LEU 9 -0.229 2.811 -14.959
103 HG LEU 9 HG LEU 9 1.855 3.100 -12.757
104 HD11 LEU 9 HD11 LEU 9 0.518 0.611 -13.898
105 HD12 LEU 9 HD12 LEU 9 1.869 0.628 -12.735
106 HD13 LEU 9 HD13 LEU 9 0.279 1.262 -12.261
107 HD21 LEU 9 HD21 LEU 9 2.761 3.381 -15.024
108 HD22 LEU 9 HD22 LEU 9 3.252 1.809 -14.356
109 HD23 LEU 9 HD23 LEU 9 1.940 1.890 -15.552
110 H LEU 10 H LEU 10 -1.496 6.037 -13.167
111 HA LEU 10 HA LEU 10 -3.420 5.931 -15.294
112 HB2 LEU 10 HB2 LEU 10 -4.067 6.022 -12.981
113 HB3 LEU 10 HB3 LEU 10 -3.218 7.552 -12.726
114 HG LEU 10 HG LEU 10 -5.386 7.420 -14.825
115 HD11 LEU 10 HD11 LEU 10 -5.849 7.685 -11.825
116 HD12 LEU 10 HD12 LEU 10 -7.071 7.913 -13.097
117 HD13 LEU 10 HD13 LEU 10 -6.346 6.313 -12.844
118 HD21 LEU 10 HD21 LEU 10 -4.517 9.548 -12.798
119 HD22 LEU 10 HD22 LEU 10 -4.118 9.557 -14.527
120 HD23 LEU 10 HD23 LEU 10 -5.800 9.744 -14.012
121 H LYS 11 H LYS 11 -0.972 8.340 -14.342
122 HA LYS 11 HA LYS 11 -2.099 10.453 -15.944
123 HB2 LYS 11 HB2 LYS 11 0.042 11.583 -15.556
124 HB3 LYS 11 HB3 LYS 11 -0.625 10.905 -14.061
125 HG2 LYS 11 HG2 LYS 11 0.919 9.000 -14.202
126 HG3 LYS 11 HG3 LYS 11 1.530 9.567 -15.766
127 HD2 LYS 11 HD2 LYS 11 3.070 10.169 -13.946
128 HD3 LYS 11 HD3 LYS 11 2.402 11.614 -14.723
129 HE2 LYS 11 HE2 LYS 11 0.744 11.848 -12.907
130 HE3 LYS 11 HE3 LYS 11 1.372 10.394 -12.123
131 HZ1 LYS 11 HZ1 LYS 11 2.911 12.857 -12.613
132 HZ2 LYS 11 HZ2 LYS 11 2.276 12.397 -11.167
133 HZ3 LYS 11 HZ3 LYS 11 3.475 11.512 -11.860
134 H LEU 12 H LEU 12 -0.539 7.565 -16.870
135 HA LEU 12 HA LEU 12 0.566 8.683 -19.353
136 HB2 LEU 12 HB2 LEU 12 1.748 6.882 -18.193
137 HB3 LEU 12 HB3 LEU 12 0.306 5.863 -18.257
138 HG LEU 12 HG LEU 12 0.430 5.825 -20.743
139 HD11 LEU 12 HD11 LEU 12 3.047 7.335 -20.292
140 HD12 LEU 12 HD12 LEU 12 2.514 6.635 -21.831
141 HD13 LEU 12 HD13 LEU 12 1.600 7.973 -21.115
142 HD21 LEU 12 HD21 LEU 12 1.499 4.066 -19.384
143 HD22 LEU 12 HD22 LEU 12 2.420 4.382 -20.868
144 HD23 LEU 12 HD23 LEU 12 2.995 5.022 -19.312
145 H LEU 13 H LEU 13 -2.388 7.137 -18.172
146 HA LEU 13 HA LEU 13 -3.380 6.671 -20.925
147 HB2 LEU 13 HB2 LEU 13 -4.369 6.013 -18.125
148 HB3 LEU 13 HB3 LEU 13 -5.415 5.902 -19.540
149 HG LEU 13 HG LEU 13 -3.822 4.327 -20.615
150 HD11 LEU 13 HD11 LEU 13 -2.452 4.387 -17.892
151 HD12 LEU 13 HD12 LEU 13 -2.159 3.171 -19.157
152 HD13 LEU 13 HD13 LEU 13 -1.725 4.857 -19.455
153 HD21 LEU 13 HD21 LEU 13 -5.788 3.547 -19.358
154 HD22 LEU 13 HD22 LEU 13 -4.431 2.412 -19.192
155 HD23 LEU 13 HD23 LEU 13 -4.824 3.522 -17.858
156 H LYS 14 H LYS 14 -3.840 8.814 -18.119
157 HA LYS 14 HA LYS 14 -6.003 10.263 -19.544
158 HB2 LYS 14 HB2 LYS 14 -4.958 10.561 -16.709
159 HB3 LYS 14 HB3 LYS 14 -6.371 11.380 -17.397
160 HG2 LYS 14 HG2 LYS 14 -6.058 8.369 -16.999
161 HG3 LYS 14 HG3 LYS 14 -7.039 9.467 -16.009
162 HD2 LYS 14 HD2 LYS 14 -8.411 10.027 -18.006
163 HD3 LYS 14 HD3 LYS 14 -7.478 8.853 -18.965
164 HE2 LYS 14 HE2 LYS 14 -8.147 7.050 -17.416
165 HE3 LYS 14 HE3 LYS 14 -9.076 8.208 -16.453
166 HZ1 LYS 14 HZ1 LYS 14 -10.447 8.616 -18.389
167 HZ2 LYS 14 HZ2 LYS 14 -9.588 7.527 -19.270
168 HZ3 LYS 14 HZ3 LYS 14 -10.477 7.029 -17.984
169 HN1 NH2 15 HN1 NHE 15 -2.717 10.306 -19.617
170 HN2 NH2 15 HN2 NHE 15 -2.455 12.027 -19.828
Start of MODEL 15
1 H1 LYS 1 H1 LYS 1 2.911 2.583 0.589
2 H2 LYS 1 H2 LYS 1 2.306 1.286 -0.213
3 H3 LYS 1 H3 LYS 1 1.685 2.788 -0.478
4 HA LYS 1 HA LYS 1 3.716 3.564 -1.421
5 HB2 LYS 1 HB2 LYS 1 4.673 0.727 -0.950
6 HB3 LYS 1 HB3 LYS 1 5.511 1.939 -1.937
7 HG2 LYS 1 HG2 LYS 1 5.707 3.421 0.038
8 HG3 LYS 1 HG3 LYS 1 4.864 2.210 1.034
9 HD2 LYS 1 HD2 LYS 1 6.639 0.553 0.510
10 HD3 LYS 1 HD3 LYS 1 7.511 1.784 -0.422
11 HE2 LYS 1 HE2 LYS 1 6.829 1.959 2.543
12 HE3 LYS 1 HE3 LYS 1 8.407 1.515 1.880
13 HZ1 LYS 1 HZ1 LYS 1 8.510 3.690 0.851
14 HZ2 LYS 1 HZ2 LYS 1 7.056 4.109 1.492
15 HZ3 LYS 1 HZ3 LYS 1 8.337 3.822 2.478
16 H LEU 2 H LEU 2 2.674 0.164 -2.134
17 HA LEU 2 HA LEU 2 3.007 0.528 -4.945
18 HB2 LEU 2 HB2 LEU 2 1.384 -1.562 -3.464
19 HB3 LEU 2 HB3 LEU 2 1.982 -1.679 -5.126
20 HG LEU 2 HG LEU 2 3.717 -1.534 -2.618
21 HD11 LEU 2 HD11 LEU 2 3.138 -3.813 -4.551
22 HD12 LEU 2 HD12 LEU 2 4.259 -3.867 -3.170
23 HD13 LEU 2 HD13 LEU 2 2.521 -3.678 -2.886
24 HD21 LEU 2 HD21 LEU 2 4.451 -1.912 -5.557
25 HD22 LEU 2 HD22 LEU 2 4.858 -0.502 -4.549
26 HD23 LEU 2 HD23 LEU 2 5.571 -2.080 -4.184
27 H LEU 3 H LEU 3 0.596 1.924 -3.073
28 HA LEU 3 HA LEU 3 -1.558 1.498 -5.071
29 HB2 LEU 3 HB2 LEU 3 -1.629 3.193 -2.560
30 HB3 LEU 3 HB3 LEU 3 -3.003 2.544 -3.481
31 HG LEU 3 HG LEU 3 -0.955 0.940 -1.897
32 HD11 LEU 3 HD11 LEU 3 -2.841 0.492 -0.367
33 HD12 LEU 3 HD12 LEU 3 -2.505 2.233 -0.490
34 HD13 LEU 3 HD13 LEU 3 -3.892 1.541 -1.358
35 HD21 LEU 3 HD21 LEU 3 -3.497 0.050 -3.345
36 HD22 LEU 3 HD22 LEU 3 -1.835 -0.357 -3.827
37 HD23 LEU 3 HD23 LEU 3 -2.496 -0.980 -2.303
38 H LYS 4 H LYS 4 0.703 3.910 -3.840
39 HA LYS 4 HA LYS 4 -0.364 6.136 -5.336
40 HB2 LYS 4 HB2 LYS 4 1.071 6.430 -3.363
41 HB3 LYS 4 HB3 LYS 4 2.416 5.619 -4.192
42 HG2 LYS 4 HG2 LYS 4 2.515 7.392 -5.867
43 HG3 LYS 4 HG3 LYS 4 1.089 8.188 -5.154
44 HD2 LYS 4 HD2 LYS 4 2.321 8.520 -3.042
45 HD3 LYS 4 HD3 LYS 4 3.742 7.705 -3.734
46 HE2 LYS 4 HE2 LYS 4 3.869 9.428 -5.507
47 HE3 LYS 4 HE3 LYS 4 2.447 10.237 -4.829
48 HZ1 LYS 4 HZ1 LYS 4 3.699 10.594 -2.804
49 HZ2 LYS 4 HZ2 LYS 4 5.023 9.853 -3.443
50 HZ3 LYS 4 HZ3 LYS 4 4.473 11.264 -4.087
51 H LEU 5 H LEU 5 1.595 3.353 -6.131
52 HA LEU 5 HA LEU 5 2.794 4.466 -8.508
53 HB2 LEU 5 HB2 LEU 5 2.133 1.575 -7.829
54 HB3 LEU 5 HB3 LEU 5 3.225 2.120 -9.114
55 HG LEU 5 HG LEU 5 3.627 2.533 -6.122
56 HD11 LEU 5 HD11 LEU 5 5.521 1.006 -6.447
57 HD12 LEU 5 HD12 LEU 5 4.000 0.223 -6.931
58 HD13 LEU 5 HD13 LEU 5 5.121 0.841 -8.168
59 HD21 LEU 5 HD21 LEU 5 5.870 3.395 -6.803
60 HD22 LEU 5 HD22 LEU 5 5.363 3.308 -8.507
61 HD23 LEU 5 HD23 LEU 5 4.567 4.440 -7.379
62 H LEU 6 H LEU 6 -0.436 3.376 -7.734
63 HA LEU 6 HA LEU 6 -1.184 2.806 -10.473
64 HB2 LEU 6 HB2 LEU 6 -2.923 3.517 -8.082
65 HB3 LEU 6 HB3 LEU 6 -3.472 2.758 -9.583
66 HG LEU 6 HG LEU 6 -1.490 1.533 -7.613
67 HD11 LEU 6 HD11 LEU 6 -4.420 0.923 -8.165
68 HD12 LEU 6 HD12 LEU 6 -3.359 0.011 -7.065
69 HD13 LEU 6 HD13 LEU 6 -3.767 1.695 -6.694
70 HD21 LEU 6 HD21 LEU 6 -1.887 -0.537 -8.931
71 HD22 LEU 6 HD22 LEU 6 -2.863 0.393 -10.088
72 HD23 LEU 6 HD23 LEU 6 -1.124 0.730 -9.914
73 H LYS 7 H LYS 7 -0.955 5.680 -8.456
74 HA LYS 7 HA LYS 7 -2.473 7.353 -10.331
75 HB2 LYS 7 HB2 LYS 7 -0.900 7.907 -7.790
76 HB3 LYS 7 HB3 LYS 7 -1.541 9.184 -8.812
77 HG2 LYS 7 HG2 LYS 7 -3.079 8.785 -7.013
78 HG3 LYS 7 HG3 LYS 7 -3.834 8.292 -8.536
79 HD2 LYS 7 HD2 LYS 7 -3.462 5.937 -8.013
80 HD3 LYS 7 HD3 LYS 7 -2.480 6.375 -6.586
81 HE2 LYS 7 HE2 LYS 7 -4.463 7.460 -5.577
82 HE3 LYS 7 HE3 LYS 7 -5.429 7.023 -6.996
83 HZ1 LYS 7 HZ1 LYS 7 -4.115 5.112 -5.178
84 HZ2 LYS 7 HZ2 LYS 7 -5.719 5.475 -5.194
85 HZ3 LYS 7 HZ3 LYS 7 -5.036 4.720 -6.481
86 H LYS 8 H LYS 8 0.846 6.363 -9.754
87 HA LYS 8 HA LYS 8 2.095 8.491 -11.273
88 HB2 LYS 8 HB2 LYS 8 3.275 7.233 -9.535
89 HB3 LYS 8 HB3 LYS 8 3.043 5.719 -10.429
90 HG2 LYS 8 HG2 LYS 8 4.421 6.549 -12.285
91 HG3 LYS 8 HG3 LYS 8 4.582 8.124 -11.478
92 HD2 LYS 8 HD2 LYS 8 5.760 7.050 -9.595
93 HD3 LYS 8 HD3 LYS 8 5.532 5.457 -10.338
94 HE2 LYS 8 HE2 LYS 8 7.802 6.277 -10.773
95 HE3 LYS 8 HE3 LYS 8 6.884 6.151 -12.282
96 HZ1 LYS 8 HZ1 LYS 8 7.333 8.630 -10.757
97 HZ2 LYS 8 HZ2 LYS 8 8.114 8.199 -12.135
98 HZ3 LYS 8 HZ3 LYS 8 6.507 8.523 -12.175
99 H LEU 9 H LEU 9 0.601 5.406 -12.077
100 HA LEU 9 HA LEU 9 1.653 5.544 -14.839
101 HB2 LEU 9 HB2 LEU 9 -0.012 3.462 -13.374
102 HB3 LEU 9 HB3 LEU 9 0.544 3.316 -15.050
103 HG LEU 9 HG LEU 9 2.424 3.676 -12.676
104 HD11 LEU 9 HD11 LEU 9 1.602 1.153 -14.180
105 HD12 LEU 9 HD12 LEU 9 2.866 1.259 -12.927
106 HD13 LEU 9 HD13 LEU 9 1.171 1.553 -12.501
107 HD21 LEU 9 HD21 LEU 9 3.394 4.374 -14.831
108 HD22 LEU 9 HD22 LEU 9 4.116 2.848 -14.285
109 HD23 LEU 9 HD23 LEU 9 2.881 2.831 -15.565
110 H LEU 10 H LEU 10 -1.048 6.697 -13.082
111 HA LEU 10 HA LEU 10 -3.122 6.237 -15.000
112 HB2 LEU 10 HB2 LEU 10 -3.619 6.740 -12.715
113 HB3 LEU 10 HB3 LEU 10 -2.704 8.251 -12.758
114 HG LEU 10 HG LEU 10 -5.026 7.942 -14.657
115 HD11 LEU 10 HD11 LEU 10 -5.238 8.589 -11.682
116 HD12 LEU 10 HD12 LEU 10 -6.549 8.742 -12.869
117 HD13 LEU 10 HD13 LEU 10 -5.894 7.142 -12.487
118 HD21 LEU 10 HD21 LEU 10 -3.628 10.016 -14.710
119 HD22 LEU 10 HD22 LEU 10 -5.268 10.363 -14.133
120 HD23 LEU 10 HD23 LEU 10 -3.931 10.245 -12.974
121 H LYS 11 H LYS 11 -0.523 8.618 -14.796
122 HA LYS 11 HA LYS 11 -1.694 10.545 -16.573
123 HB2 LYS 11 HB2 LYS 11 0.546 11.500 -16.631
124 HB3 LYS 11 HB3 LYS 11 0.145 11.017 -14.978
125 HG2 LYS 11 HG2 LYS 11 1.398 8.841 -15.395
126 HG3 LYS 11 HG3 LYS 11 1.935 9.520 -16.941
127 HD2 LYS 11 HD2 LYS 11 2.453 10.680 -14.168
128 HD3 LYS 11 HD3 LYS 11 3.637 9.831 -15.170
129 HE2 LYS 11 HE2 LYS 11 2.274 12.457 -15.909
130 HE3 LYS 11 HE3 LYS 11 3.903 12.293 -15.244
131 HZ1 LYS 11 HZ1 LYS 11 2.993 11.168 -17.813
132 HZ2 LYS 11 HZ2 LYS 11 3.952 12.489 -17.623
133 HZ3 LYS 11 HZ3 LYS 11 4.502 11.008 -17.177
134 H LEU 12 H LEU 12 -0.522 7.386 -17.167
135 HA LEU 12 HA LEU 12 0.424 7.963 -19.885
136 HB2 LEU 12 HB2 LEU 12 -0.053 5.308 -18.481
137 HB3 LEU 12 HB3 LEU 12 0.841 5.558 -19.985
138 HG LEU 12 HG LEU 12 1.646 6.674 -17.255
139 HD11 LEU 12 HD11 LEU 12 2.770 4.377 -18.912
140 HD12 LEU 12 HD12 LEU 12 3.438 4.997 -17.377
141 HD13 LEU 12 HD13 LEU 12 1.838 4.227 -17.406
142 HD21 LEU 12 HD21 LEU 12 2.436 8.098 -19.121
143 HD22 LEU 12 HD22 LEU 12 3.784 7.199 -18.404
144 HD23 LEU 12 HD23 LEU 12 3.079 6.659 -19.947
145 H LEU 13 H LEU 13 -2.628 7.541 -18.434
146 HA LEU 13 HA LEU 13 -3.785 6.822 -21.075
147 HB2 LEU 13 HB2 LEU 13 -4.609 5.737 -18.351
148 HB3 LEU 13 HB3 LEU 13 -5.495 5.452 -19.857
149 HG LEU 13 HG LEU 13 -2.605 4.606 -19.389
150 HD11 LEU 13 HD11 LEU 13 -5.196 3.004 -19.263
151 HD12 LEU 13 HD12 LEU 13 -3.552 2.336 -19.143
152 HD13 LEU 13 HD13 LEU 13 -4.158 3.422 -17.880
153 HD21 LEU 13 HD21 LEU 13 -3.209 4.902 -21.783
154 HD22 LEU 13 HD22 LEU 13 -3.022 3.184 -21.373
155 HD23 LEU 13 HD23 LEU 13 -4.646 3.880 -21.541
156 H LYS 14 H LYS 14 -3.603 9.087 -18.625
157 HA LYS 14 HA LYS 14 -6.082 10.355 -19.637
158 HB2 LYS 14 HB2 LYS 14 -5.269 10.221 -16.707
159 HB3 LYS 14 HB3 LYS 14 -6.613 11.168 -17.379
160 HG2 LYS 14 HG2 LYS 14 -7.618 9.032 -18.249
161 HG3 LYS 14 HG3 LYS 14 -6.328 8.132 -17.427
162 HD2 LYS 14 HD2 LYS 14 -8.355 8.132 -16.068
163 HD3 LYS 14 HD3 LYS 14 -7.089 9.061 -15.249
164 HE2 LYS 14 HE2 LYS 14 -8.102 11.167 -16.071
165 HE3 LYS 14 HE3 LYS 14 -9.337 10.235 -16.939
166 HZ1 LYS 14 HZ1 LYS 14 -8.946 10.263 -14.020
167 HZ2 LYS 14 HZ2 LYS 14 -10.138 11.037 -14.834
168 HZ3 LYS 14 HZ3 LYS 14 -10.090 9.394 -14.824
169 HN1 NH2 15 HN1 NHE 15 -2.978 10.513 -19.901
170 HN2 NH2 15 HN2 NHE 15 -2.672 12.223 -19.733
Start of MODEL 16
1 H1 LYS 1 H1 LYS 1 4.548 2.917 -0.881
2 H2 LYS 1 H2 LYS 1 4.059 3.387 0.623
3 H3 LYS 1 H3 LYS 1 3.335 4.012 -0.711
4 HA LYS 1 HA LYS 1 3.247 1.203 0.124
5 HB2 LYS 1 HB2 LYS 1 1.103 3.360 0.180
6 HB3 LYS 1 HB3 LYS 1 0.800 1.638 0.448
7 HG2 LYS 1 HG2 LYS 1 2.618 3.383 2.159
8 HG3 LYS 1 HG3 LYS 1 0.971 2.887 2.568
9 HD2 LYS 1 HD2 LYS 1 1.708 0.483 2.396
10 HD3 LYS 1 HD3 LYS 1 3.377 1.042 2.205
11 HE2 LYS 1 HE2 LYS 1 1.555 1.634 4.572
12 HE3 LYS 1 HE3 LYS 1 2.853 0.434 4.545
13 HZ1 LYS 1 HZ1 LYS 1 4.412 2.231 4.171
14 HZ2 LYS 1 HZ2 LYS 1 3.197 3.344 4.204
15 HZ3 LYS 1 HZ3 LYS 1 3.564 2.486 5.554
16 H LEU 2 H LEU 2 1.773 -0.132 -1.124
17 HA LEU 2 HA LEU 2 2.317 0.253 -3.941
18 HB2 LEU 2 HB2 LEU 2 0.800 -1.943 -2.495
19 HB3 LEU 2 HB3 LEU 2 1.379 -2.002 -4.164
20 HG LEU 2 HG LEU 2 3.156 -1.757 -1.694
21 HD11 LEU 2 HD11 LEU 2 2.028 -3.951 -1.913
22 HD12 LEU 2 HD12 LEU 2 2.619 -4.092 -3.581
23 HD13 LEU 2 HD13 LEU 2 3.771 -4.078 -2.222
24 HD21 LEU 2 HD21 LEU 2 3.818 -2.161 -4.646
25 HD22 LEU 2 HD22 LEU 2 4.196 -0.716 -3.677
26 HD23 LEU 2 HD23 LEU 2 4.985 -2.261 -3.308
27 H LEU 3 H LEU 3 0.665 2.347 -3.247
28 HA LEU 3 HA LEU 3 -1.528 1.706 -5.098
29 HB2 LEU 3 HB2 LEU 3 -3.274 2.442 -3.828
30 HB3 LEU 3 HB3 LEU 3 -2.319 1.557 -2.639
31 HG LEU 3 HG LEU 3 -2.283 4.597 -3.029
32 HD11 LEU 3 HD11 LEU 3 -3.673 2.865 -0.943
33 HD12 LEU 3 HD12 LEU 3 -3.621 4.645 -0.960
34 HD13 LEU 3 HD13 LEU 3 -4.471 3.774 -2.247
35 HD21 LEU 3 HD21 LEU 3 -0.208 3.758 -1.977
36 HD22 LEU 3 HD22 LEU 3 -1.214 4.585 -0.776
37 HD23 LEU 3 HD23 LEU 3 -1.173 2.812 -0.812
38 H LYS 4 H LYS 4 0.885 3.912 -3.915
39 HA LYS 4 HA LYS 4 -0.171 6.237 -5.286
40 HB2 LYS 4 HB2 LYS 4 1.402 6.434 -3.402
41 HB3 LYS 4 HB3 LYS 4 2.612 5.491 -4.282
42 HG2 LYS 4 HG2 LYS 4 3.152 7.876 -4.365
43 HG3 LYS 4 HG3 LYS 4 2.817 7.248 -5.977
44 HD2 LYS 4 HD2 LYS 4 1.773 9.449 -5.677
45 HD3 LYS 4 HD3 LYS 4 0.537 8.208 -5.899
46 HE2 LYS 4 HE2 LYS 4 -0.120 9.743 -4.124
47 HE3 LYS 4 HE3 LYS 4 0.166 8.135 -3.444
48 HZ1 LYS 4 HZ1 LYS 4 2.332 8.908 -2.731
49 HZ2 LYS 4 HZ2 LYS 4 2.060 10.394 -3.381
50 HZ3 LYS 4 HZ3 LYS 4 1.156 9.876 -2.113
51 H LEU 5 H LEU 5 1.752 3.408 -6.186
52 HA LEU 5 HA LEU 5 2.767 4.526 -8.611
53 HB2 LEU 5 HB2 LEU 5 3.523 2.412 -9.132
54 HB3 LEU 5 HB3 LEU 5 3.556 2.418 -7.366
55 HG LEU 5 HG LEU 5 1.321 1.205 -9.067
56 HD11 LEU 5 HD11 LEU 5 2.351 -0.963 -8.497
57 HD12 LEU 5 HD12 LEU 5 3.462 0.048 -9.439
58 HD13 LEU 5 HD13 LEU 5 3.687 -0.119 -7.676
59 HD21 LEU 5 HD21 LEU 5 0.609 1.759 -6.753
60 HD22 LEU 5 HD22 LEU 5 0.756 0.009 -6.969
61 HD23 LEU 5 HD23 LEU 5 2.038 0.901 -6.116
62 H LEU 6 H LEU 6 -0.407 3.455 -7.675
63 HA LEU 6 HA LEU 6 -1.322 2.792 -10.340
64 HB2 LEU 6 HB2 LEU 6 -2.923 3.687 -7.911
65 HB3 LEU 6 HB3 LEU 6 -3.557 2.864 -9.344
66 HG LEU 6 HG LEU 6 -1.557 1.686 -7.367
67 HD11 LEU 6 HD11 LEU 6 -3.831 1.954 -6.453
68 HD12 LEU 6 HD12 LEU 6 -4.498 1.096 -7.862
69 HD13 LEU 6 HD13 LEU 6 -3.437 0.239 -6.722
70 HD21 LEU 6 HD21 LEU 6 -1.242 0.771 -9.639
71 HD22 LEU 6 HD22 LEU 6 -2.014 -0.435 -8.589
72 HD23 LEU 6 HD23 LEU 6 -2.990 0.465 -9.776
73 H LYS 7 H LYS 7 -0.966 5.773 -8.467
74 HA LYS 7 HA LYS 7 -2.496 7.353 -10.422
75 HB2 LYS 7 HB2 LYS 7 -0.964 8.010 -7.884
76 HB3 LYS 7 HB3 LYS 7 -1.575 9.258 -8.972
77 HG2 LYS 7 HG2 LYS 7 -3.147 8.951 -7.178
78 HG3 LYS 7 HG3 LYS 7 -3.878 8.421 -8.696
79 HD2 LYS 7 HD2 LYS 7 -3.498 6.073 -8.107
80 HD3 LYS 7 HD3 LYS 7 -2.640 6.554 -6.629
81 HE2 LYS 7 HE2 LYS 7 -5.560 7.141 -7.276
82 HE3 LYS 7 HE3 LYS 7 -4.983 5.877 -6.186
83 HZ1 LYS 7 HZ1 LYS 7 -4.568 8.770 -5.805
84 HZ2 LYS 7 HZ2 LYS 7 -5.640 7.838 -4.990
85 HZ3 LYS 7 HZ3 LYS 7 -4.026 7.586 -4.801
86 H LYS 8 H LYS 8 0.829 6.414 -9.767
87 HA LYS 8 HA LYS 8 2.057 8.466 -11.387
88 HB2 LYS 8 HB2 LYS 8 3.244 7.266 -9.609
89 HB3 LYS 8 HB3 LYS 8 3.004 5.725 -10.446
90 HG2 LYS 8 HG2 LYS 8 4.388 6.491 -12.331
91 HG3 LYS 8 HG3 LYS 8 4.580 8.083 -11.554
92 HD2 LYS 8 HD2 LYS 8 5.694 7.005 -9.628
93 HD3 LYS 8 HD3 LYS 8 5.499 5.414 -10.409
94 HE2 LYS 8 HE2 LYS 8 6.856 6.185 -12.320
95 HE3 LYS 8 HE3 LYS 8 7.045 7.775 -11.561
96 HZ1 LYS 8 HZ1 LYS 8 8.006 5.220 -10.446
97 HZ2 LYS 8 HZ2 LYS 8 8.939 6.377 -11.148
98 HZ3 LYS 8 HZ3 LYS 8 8.170 6.696 -9.733
99 H LEU 9 H LEU 9 0.555 5.350 -12.058
100 HA LEU 9 HA LEU 9 1.591 5.368 -14.827
101 HB2 LEU 9 HB2 LEU 9 -0.111 3.397 -13.257
102 HB3 LEU 9 HB3 LEU 9 0.403 3.157 -14.935
103 HG LEU 9 HG LEU 9 2.337 3.557 -12.610
104 HD11 LEU 9 HD11 LEU 9 1.448 1.005 -14.017
105 HD12 LEU 9 HD12 LEU 9 2.711 1.129 -12.766
106 HD13 LEU 9 HD13 LEU 9 1.022 1.481 -12.353
107 HD21 LEU 9 HD21 LEU 9 2.731 2.583 -15.469
108 HD22 LEU 9 HD22 LEU 9 3.283 4.149 -14.813
109 HD23 LEU 9 HD23 LEU 9 3.984 2.637 -14.215
110 H LEU 10 H LEU 10 -1.114 6.578 -13.085
111 HA LEU 10 HA LEU 10 -3.170 6.125 -15.037
112 HB2 LEU 10 HB2 LEU 10 -3.702 6.566 -12.754
113 HB3 LEU 10 HB3 LEU 10 -2.830 8.105 -12.748
114 HG LEU 10 HG LEU 10 -5.113 7.755 -14.691
115 HD11 LEU 10 HD11 LEU 10 -5.393 8.359 -11.717
116 HD12 LEU 10 HD12 LEU 10 -6.688 8.486 -12.931
117 HD13 LEU 10 HD13 LEU 10 -5.980 6.904 -12.548
118 HD21 LEU 10 HD21 LEU 10 -3.761 9.876 -14.690
119 HD22 LEU 10 HD22 LEU 10 -5.430 10.161 -14.160
120 HD23 LEU 10 HD23 LEU 10 -4.119 10.074 -12.962
121 H LYS 11 H LYS 11 -0.624 8.554 -14.712
122 HA LYS 11 HA LYS 11 -1.804 10.499 -16.461
123 HB2 LYS 11 HB2 LYS 11 0.398 11.525 -16.429
124 HB3 LYS 11 HB3 LYS 11 -0.015 10.963 -14.803
125 HG2 LYS 11 HG2 LYS 11 1.347 8.884 -15.231
126 HG3 LYS 11 HG3 LYS 11 1.816 9.560 -16.801
127 HD2 LYS 11 HD2 LYS 11 2.773 11.546 -15.631
128 HD3 LYS 11 HD3 LYS 11 2.374 10.794 -14.069
129 HE2 LYS 11 HE2 LYS 11 3.797 8.857 -14.628
130 HE3 LYS 11 HE3 LYS 11 4.188 9.594 -16.198
131 HZ1 LYS 11 HZ1 LYS 11 4.839 10.740 -13.566
132 HZ2 LYS 11 HZ2 LYS 11 5.905 10.006 -14.584
133 HZ3 LYS 11 HZ3 LYS 11 5.193 11.421 -15.016
134 H LEU 12 H LEU 12 -0.502 7.399 -17.113
135 HA LEU 12 HA LEU 12 0.540 8.054 -19.764
136 HB2 LEU 12 HB2 LEU 12 -0.005 5.358 -18.486
137 HB3 LEU 12 HB3 LEU 12 0.987 5.666 -19.919
138 HG LEU 12 HG LEU 12 1.591 6.677 -17.100
139 HD11 LEU 12 HD11 LEU 12 2.872 4.482 -18.781
140 HD12 LEU 12 HD12 LEU 12 3.442 5.050 -17.193
141 HD13 LEU 12 HD13 LEU 12 1.865 4.251 -17.330
142 HD21 LEU 12 HD21 LEU 12 2.475 8.199 -18.842
143 HD22 LEU 12 HD22 LEU 12 3.790 7.297 -18.072
144 HD23 LEU 12 HD23 LEU 12 3.216 6.817 -19.685
145 H LEU 13 H LEU 13 -2.575 7.560 -18.461
146 HA LEU 13 HA LEU 13 -3.618 6.947 -21.176
147 HB2 LEU 13 HB2 LEU 13 -4.534 5.724 -18.544
148 HB3 LEU 13 HB3 LEU 13 -5.355 5.502 -20.094
149 HG LEU 13 HG LEU 13 -2.480 4.658 -19.554
150 HD11 LEU 13 HD11 LEU 13 -5.043 3.023 -19.601
151 HD12 LEU 13 HD12 LEU 13 -3.394 2.374 -19.454
152 HD13 LEU 13 HD13 LEU 13 -4.060 3.394 -18.162
153 HD21 LEU 13 HD21 LEU 13 -4.424 4.022 -21.822
154 HD22 LEU 13 HD22 LEU 13 -2.987 5.055 -21.949
155 HD23 LEU 13 HD23 LEU 13 -2.803 3.319 -21.619
156 H LYS 14 H LYS 14 -3.576 9.086 -18.609
157 HA LYS 14 HA LYS 14 -6.049 10.354 -19.638
158 HB2 LYS 14 HB2 LYS 14 -5.328 10.111 -16.690
159 HB3 LYS 14 HB3 LYS 14 -6.676 11.045 -17.368
160 HG2 LYS 14 HG2 LYS 14 -7.590 8.928 -18.360
161 HG3 LYS 14 HG3 LYS 14 -6.312 8.028 -17.513
162 HD2 LYS 14 HD2 LYS 14 -7.161 8.883 -15.339
163 HD3 LYS 14 HD3 LYS 14 -8.431 9.780 -16.203
164 HE2 LYS 14 HE2 LYS 14 -9.280 7.636 -17.138
165 HE3 LYS 14 HE3 LYS 14 -8.026 6.752 -16.256
166 HZ1 LYS 14 HZ1 LYS 14 -10.112 6.743 -15.072
167 HZ2 LYS 14 HZ2 LYS 14 -8.994 7.569 -14.207
168 HZ3 LYS 14 HZ3 LYS 14 -10.163 8.379 -15.037
169 HN1 NH2 15 HN1 NHE 15 -2.931 10.595 -19.785
170 HN2 NH2 15 HN2 NHE 15 -2.680 12.304 -19.529
Start of MODEL 17
1 H1 LYS 1 H1 LYS 1 0.924 -1.247 0.774
2 H2 LYS 1 H2 LYS 1 0.520 0.316 0.490
3 H3 LYS 1 H3 LYS 1 1.793 -0.033 1.471
4 HA LYS 1 HA LYS 1 2.579 0.714 -0.660
5 HB2 LYS 1 HB2 LYS 1 3.028 -2.260 -0.166
6 HB3 LYS 1 HB3 LYS 1 4.025 -1.220 -1.199
7 HG2 LYS 1 HG2 LYS 1 4.584 0.196 0.766
8 HG3 LYS 1 HG3 LYS 1 3.632 -0.891 1.807
9 HD2 LYS 1 HD2 LYS 1 5.093 -2.790 1.142
10 HD3 LYS 1 HD3 LYS 1 6.065 -1.687 0.148
11 HE2 LYS 1 HE2 LYS 1 5.642 -1.453 3.149
12 HE3 LYS 1 HE3 LYS 1 7.082 -2.127 2.367
13 HZ1 LYS 1 HZ1 LYS 1 7.404 0.163 2.973
14 HZ2 LYS 1 HZ2 LYS 1 7.447 0.013 1.343
15 HZ3 LYS 1 HZ3 LYS 1 6.110 0.637 2.076
16 H LEU 2 H LEU 2 3.052 -0.188 -2.943
17 HA LEU 2 HA LEU 2 2.265 -0.586 -5.011
18 HB2 LEU 2 HB2 LEU 2 0.698 -2.819 -3.684
19 HB3 LEU 2 HB3 LEU 2 1.138 -2.716 -5.394
20 HG LEU 2 HG LEU 2 3.102 -2.916 -3.065
21 HD11 LEU 2 HD11 LEU 2 1.799 -4.976 -3.422
22 HD12 LEU 2 HD12 LEU 2 2.232 -4.960 -5.147
23 HD13 LEU 2 HD13 LEU 2 3.490 -5.195 -3.917
24 HD21 LEU 2 HD21 LEU 2 3.526 -3.008 -6.090
25 HD22 LEU 2 HD22 LEU 2 4.082 -1.719 -4.992
26 HD23 LEU 2 HD23 LEU 2 4.767 -3.349 -4.867
27 H LEU 3 H LEU 3 0.892 1.509 -3.763
28 HA LEU 3 HA LEU 3 -1.548 1.340 -5.421
29 HB2 LEU 3 HB2 LEU 3 -3.030 2.041 -3.844
30 HB3 LEU 3 HB3 LEU 3 -2.038 0.926 -2.912
31 HG LEU 3 HG LEU 3 -1.746 3.979 -2.921
32 HD11 LEU 3 HD11 LEU 3 -3.888 3.231 -1.945
33 HD12 LEU 3 HD12 LEU 3 -3.014 2.103 -0.885
34 HD13 LEU 3 HD13 LEU 3 -2.788 3.856 -0.699
35 HD21 LEU 3 HD21 LEU 3 -0.528 1.824 -1.136
36 HD22 LEU 3 HD22 LEU 3 0.360 2.839 -2.308
37 HD23 LEU 3 HD23 LEU 3 -0.382 3.579 -0.884
38 H LYS 4 H LYS 4 1.202 3.146 -4.317
39 HA LYS 4 HA LYS 4 0.220 5.716 -5.235
40 HB2 LYS 4 HB2 LYS 4 2.011 5.535 -3.552
41 HB3 LYS 4 HB3 LYS 4 3.019 4.625 -4.682
42 HG2 LYS 4 HG2 LYS 4 3.782 6.932 -4.549
43 HG3 LYS 4 HG3 LYS 4 3.181 6.573 -6.172
44 HD2 LYS 4 HD2 LYS 4 2.452 8.790 -5.434
45 HD3 LYS 4 HD3 LYS 4 1.046 7.734 -5.632
46 HE2 LYS 4 HE2 LYS 4 0.979 7.324 -3.205
47 HE3 LYS 4 HE3 LYS 4 2.448 8.290 -2.981
48 HZ1 LYS 4 HZ1 LYS 4 1.246 10.195 -3.795
49 HZ2 LYS 4 HZ2 LYS 4 -0.127 9.307 -3.992
50 HZ3 LYS 4 HZ3 LYS 4 0.484 9.552 -2.492
51 H LEU 5 H LEU 5 1.705 2.886 -6.695
52 HA LEU 5 HA LEU 5 2.615 4.161 -9.102
53 HB2 LEU 5 HB2 LEU 5 1.700 1.294 -8.612
54 HB3 LEU 5 HB3 LEU 5 2.621 1.857 -10.016
55 HG LEU 5 HG LEU 5 3.590 1.948 -7.126
56 HD11 LEU 5 HD11 LEU 5 3.436 -0.336 -8.038
57 HD12 LEU 5 HD12 LEU 5 4.373 0.169 -9.468
58 HD13 LEU 5 HD13 LEU 5 5.132 0.162 -7.863
59 HD21 LEU 5 HD21 LEU 5 4.592 3.754 -8.472
60 HD22 LEU 5 HD22 LEU 5 5.787 2.482 -8.165
61 HD23 LEU 5 HD23 LEU 5 5.001 2.587 -9.756
62 H LEU 6 H LEU 6 -0.548 3.256 -7.908
63 HA LEU 6 HA LEU 6 -1.816 3.060 -10.497
64 HB2 LEU 6 HB2 LEU 6 -3.010 3.700 -7.769
65 HB3 LEU 6 HB3 LEU 6 -3.905 3.168 -9.198
66 HG LEU 6 HG LEU 6 -1.780 1.521 -7.745
67 HD11 LEU 6 HD11 LEU 6 -3.709 0.161 -7.025
68 HD12 LEU 6 HD12 LEU 6 -3.849 1.837 -6.436
69 HD13 LEU 6 HD13 LEU 6 -4.818 1.298 -7.829
70 HD21 LEU 6 HD21 LEU 6 -2.638 -0.327 -9.160
71 HD22 LEU 6 HD22 LEU 6 -3.694 0.818 -10.016
72 HD23 LEU 6 HD23 LEU 6 -1.924 0.959 -10.152
73 H LYS 7 H LYS 7 -0.757 5.710 -8.505
74 HA LYS 7 HA LYS 7 -2.425 7.641 -10.033
75 HB2 LYS 7 HB2 LYS 7 -0.742 7.869 -7.517
76 HB3 LYS 7 HB3 LYS 7 -1.353 9.273 -8.400
77 HG2 LYS 7 HG2 LYS 7 -2.838 8.824 -6.591
78 HG3 LYS 7 HG3 LYS 7 -3.673 8.481 -8.112
79 HD2 LYS 7 HD2 LYS 7 -3.366 6.073 -7.775
80 HD3 LYS 7 HD3 LYS 7 -2.387 6.365 -6.320
81 HE2 LYS 7 HE2 LYS 7 -5.312 7.129 -6.696
82 HE3 LYS 7 HE3 LYS 7 -4.727 5.709 -5.815
83 HZ1 LYS 7 HZ1 LYS 7 -4.150 8.516 -5.113
84 HZ2 LYS 7 HZ2 LYS 7 -5.215 7.531 -4.339
85 HZ3 LYS 7 HZ3 LYS 7 -3.608 7.199 -4.292
86 H LYS 8 H LYS 8 0.865 6.443 -9.676
87 HA LYS 8 HA LYS 8 2.084 8.663 -11.106
88 HB2 LYS 8 HB2 LYS 8 3.300 7.355 -9.425
89 HB3 LYS 8 HB3 LYS 8 3.082 5.878 -10.390
90 HG2 LYS 8 HG2 LYS 8 4.421 6.818 -12.215
91 HG3 LYS 8 HG3 LYS 8 4.587 8.350 -11.336
92 HD2 LYS 8 HD2 LYS 8 5.603 5.642 -10.374
93 HD3 LYS 8 HD3 LYS 8 6.595 6.896 -11.143
94 HE2 LYS 8 HE2 LYS 8 6.007 8.468 -9.302
95 HE3 LYS 8 HE3 LYS 8 5.063 7.191 -8.518
96 HZ1 LYS 8 HZ1 LYS 8 7.950 7.076 -9.075
97 HZ2 LYS 8 HZ2 LYS 8 7.276 7.368 -7.610
98 HZ3 LYS 8 HZ3 LYS 8 7.078 5.903 -8.330
99 H LEU 9 H LEU 9 0.627 5.565 -11.990
100 HA LEU 9 HA LEU 9 1.638 5.803 -14.753
101 HB2 LEU 9 HB2 LEU 9 -0.121 3.757 -13.357
102 HB3 LEU 9 HB3 LEU 9 0.391 3.646 -15.047
103 HG LEU 9 HG LEU 9 2.334 3.800 -12.699
104 HD11 LEU 9 HD11 LEU 9 1.381 1.390 -14.301
105 HD12 LEU 9 HD12 LEU 9 2.645 1.389 -13.050
106 HD13 LEU 9 HD13 LEU 9 0.964 1.742 -12.603
107 HD21 LEU 9 HD21 LEU 9 3.294 4.533 -14.842
108 HD22 LEU 9 HD22 LEU 9 3.946 2.951 -14.382
109 HD23 LEU 9 HD23 LEU 9 2.689 3.057 -15.637
110 H LEU 10 H LEU 10 -1.023 6.987 -12.940
111 HA LEU 10 HA LEU 10 -3.143 6.682 -14.812
112 HB2 LEU 10 HB2 LEU 10 -3.549 7.246 -12.535
113 HB3 LEU 10 HB3 LEU 10 -2.549 8.704 -12.618
114 HG LEU 10 HG LEU 10 -4.942 8.481 -14.446
115 HD11 LEU 10 HD11 LEU 10 -6.347 9.424 -12.650
116 HD12 LEU 10 HD12 LEU 10 -5.761 7.803 -12.222
117 HD13 LEU 10 HD13 LEU 10 -5.005 9.242 -11.494
118 HD21 LEU 10 HD21 LEU 10 -3.605 10.757 -12.895
119 HD22 LEU 10 HD22 LEU 10 -3.456 10.475 -14.648
120 HD23 LEU 10 HD23 LEU 10 -5.020 10.937 -13.953
121 H LYS 11 H LYS 11 -0.433 8.947 -14.667
122 HA LYS 11 HA LYS 11 -1.510 10.894 -16.467
123 HB2 LYS 11 HB2 LYS 11 0.786 11.723 -16.559
124 HB3 LYS 11 HB3 LYS 11 0.373 11.281 -14.898
125 HG2 LYS 11 HG2 LYS 11 1.476 9.013 -15.349
126 HG3 LYS 11 HG3 LYS 11 2.067 9.694 -16.872
127 HD2 LYS 11 HD2 LYS 11 2.634 10.762 -14.077
128 HD3 LYS 11 HD3 LYS 11 3.765 9.854 -15.095
129 HE2 LYS 11 HE2 LYS 11 3.662 11.657 -16.807
130 HE3 LYS 11 HE3 LYS 11 2.559 12.572 -15.767
131 HZ1 LYS 11 HZ1 LYS 11 4.817 13.312 -15.514
132 HZ2 LYS 11 HZ2 LYS 11 4.296 12.647 -14.108
133 HZ3 LYS 11 HZ3 LYS 11 5.319 11.810 -15.083
134 H LEU 12 H LEU 12 -0.570 7.667 -17.020
135 HA LEU 12 HA LEU 12 0.083 8.193 -19.876
136 HB2 LEU 12 HB2 LEU 12 0.231 5.607 -18.295
137 HB3 LEU 12 HB3 LEU 12 0.878 5.902 -19.911
138 HG LEU 12 HG LEU 12 1.834 7.262 -17.345
139 HD11 LEU 12 HD11 LEU 12 3.851 5.899 -17.662
140 HD12 LEU 12 HD12 LEU 12 2.411 4.876 -17.444
141 HD13 LEU 12 HD13 LEU 12 3.108 5.102 -19.065
142 HD21 LEU 12 HD21 LEU 12 2.148 8.701 -19.332
143 HD22 LEU 12 HD22 LEU 12 3.703 8.059 -18.774
144 HD23 LEU 12 HD23 LEU 12 2.913 7.344 -20.199
145 H LEU 13 H LEU 13 -2.536 7.253 -17.806
146 HA LEU 13 HA LEU 13 -3.842 5.710 -19.949
147 HB2 LEU 13 HB2 LEU 13 -4.778 6.408 -17.131
148 HB3 LEU 13 HB3 LEU 13 -5.555 5.249 -18.220
149 HG LEU 13 HG LEU 13 -2.738 4.990 -17.070
150 HD11 LEU 13 HD11 LEU 13 -3.722 3.178 -15.732
151 HD12 LEU 13 HD12 LEU 13 -4.534 4.726 -15.390
152 HD13 LEU 13 HD13 LEU 13 -5.323 3.514 -16.428
153 HD21 LEU 13 HD21 LEU 13 -2.880 2.670 -17.964
154 HD22 LEU 13 HD22 LEU 13 -4.423 3.081 -18.746
155 HD23 LEU 13 HD23 LEU 13 -2.922 3.885 -19.261
156 H LYS 14 H LYS 14 -3.722 8.926 -18.797
157 HA LYS 14 HA LYS 14 -5.744 9.649 -20.809
158 HB2 LYS 14 HB2 LYS 14 -6.830 11.256 -19.321
159 HB3 LYS 14 HB3 LYS 14 -7.015 9.600 -18.719
160 HG2 LYS 14 HG2 LYS 14 -5.190 9.946 -17.106
161 HG3 LYS 14 HG3 LYS 14 -4.952 11.603 -17.696
162 HD2 LYS 14 HD2 LYS 14 -7.496 10.508 -16.412
163 HD3 LYS 14 HD3 LYS 14 -6.295 11.546 -15.619
164 HE2 LYS 14 HE2 LYS 14 -6.734 13.329 -17.286
165 HE3 LYS 14 HE3 LYS 14 -7.955 12.308 -18.062
166 HZ1 LYS 14 HZ1 LYS 14 -8.932 13.867 -16.522
167 HZ2 LYS 14 HZ2 LYS 14 -9.182 12.329 -16.000
168 HZ3 LYS 14 HZ3 LYS 14 -8.044 13.269 -15.278
169 HN1 NH2 15 HN1 NHE 15 -2.710 9.665 -20.175
170 HN2 NH2 15 HN2 NHE 15 -2.229 11.309 -20.522
Start of MODEL 18
1 H1 LYS 1 H1 LYS 1 2.128 2.424 0.743
2 H2 LYS 1 H2 LYS 1 1.409 3.807 0.221
3 H3 LYS 1 H3 LYS 1 2.693 3.883 1.248
4 HA LYS 1 HA LYS 1 3.358 4.486 -0.943
5 HB2 LYS 1 HB2 LYS 1 5.010 3.453 0.504
6 HB3 LYS 1 HB3 LYS 1 4.468 1.836 0.037
7 HG2 LYS 1 HG2 LYS 1 5.155 2.251 -2.301
8 HG3 LYS 1 HG3 LYS 1 5.651 3.903 -1.862
9 HD2 LYS 1 HD2 LYS 1 7.312 2.979 -0.273
10 HD3 LYS 1 HD3 LYS 1 6.821 1.330 -0.721
11 HE2 LYS 1 HE2 LYS 1 7.468 1.778 -3.075
12 HE3 LYS 1 HE3 LYS 1 7.948 3.422 -2.628
13 HZ1 LYS 1 HZ1 LYS 1 9.598 2.478 -1.166
14 HZ2 LYS 1 HZ2 LYS 1 9.158 0.946 -1.584
15 HZ3 LYS 1 HZ3 LYS 1 9.819 1.942 -2.705
16 H LEU 2 H LEU 2 2.286 1.033 -0.882
17 HA LEU 2 HA LEU 2 2.546 0.779 -3.726
18 HB2 LEU 2 HB2 LEU 2 1.153 -1.036 -1.729
19 HB3 LEU 2 HB3 LEU 2 1.637 -1.471 -3.372
20 HG LEU 2 HG LEU 2 3.538 -0.672 -1.123
21 HD11 LEU 2 HD11 LEU 2 4.173 -3.055 -1.177
22 HD12 LEU 2 HD12 LEU 2 2.446 -2.864 -0.795
23 HD13 LEU 2 HD13 LEU 2 2.947 -3.362 -2.427
24 HD21 LEU 2 HD21 LEU 2 4.449 -0.076 -3.347
25 HD22 LEU 2 HD22 LEU 2 5.301 -1.483 -2.678
26 HD23 LEU 2 HD23 LEU 2 4.077 -1.708 -3.945
27 H LEU 3 H LEU 3 0.701 2.942 -2.983
28 HA LEU 3 HA LEU 3 -1.436 2.018 -4.795
29 HB2 LEU 3 HB2 LEU 3 -3.213 2.712 -3.547
30 HB3 LEU 3 HB3 LEU 3 -2.184 1.973 -2.325
31 HG LEU 3 HG LEU 3 -2.389 4.973 -2.893
32 HD11 LEU 3 HD11 LEU 3 -3.642 5.037 -0.766
33 HD12 LEU 3 HD12 LEU 3 -4.468 4.007 -1.960
34 HD13 LEU 3 HD13 LEU 3 -3.530 3.272 -0.639
35 HD21 LEU 3 HD21 LEU 3 -1.023 3.432 -0.647
36 HD22 LEU 3 HD22 LEU 3 -0.211 4.396 -1.906
37 HD23 LEU 3 HD23 LEU 3 -1.242 5.197 -0.704
38 H LYS 4 H LYS 4 0.891 4.391 -3.906
39 HA LYS 4 HA LYS 4 -0.353 6.564 -5.421
40 HB2 LYS 4 HB2 LYS 4 1.116 7.012 -3.502
41 HB3 LYS 4 HB3 LYS 4 2.446 6.150 -4.288
42 HG2 LYS 4 HG2 LYS 4 2.494 7.809 -6.099
43 HG3 LYS 4 HG3 LYS 4 1.083 8.641 -5.397
44 HD2 LYS 4 HD2 LYS 4 2.379 9.087 -3.335
45 HD3 LYS 4 HD3 LYS 4 3.798 8.301 -4.046
46 HE2 LYS 4 HE2 LYS 4 2.377 10.760 -5.155
47 HE3 LYS 4 HE3 LYS 4 3.886 10.771 -4.230
48 HZ1 LYS 4 HZ1 LYS 4 4.885 9.450 -5.980
49 HZ2 LYS 4 HZ2 LYS 4 3.490 9.481 -6.851
50 HZ3 LYS 4 HZ3 LYS 4 4.313 10.870 -6.578
51 H LEU 5 H LEU 5 1.708 3.800 -6.034
52 HA LEU 5 HA LEU 5 2.841 4.728 -8.506
53 HB2 LEU 5 HB2 LEU 5 2.350 1.984 -7.273
54 HB3 LEU 5 HB3 LEU 5 3.013 2.181 -8.896
55 HG LEU 5 HG LEU 5 4.881 3.542 -7.980
56 HD11 LEU 5 HD11 LEU 5 3.750 2.679 -5.283
57 HD12 LEU 5 HD12 LEU 5 5.361 3.374 -5.549
58 HD13 LEU 5 HD13 LEU 5 3.931 4.358 -5.872
59 HD21 LEU 5 HD21 LEU 5 6.070 1.614 -7.010
60 HD22 LEU 5 HD22 LEU 5 4.521 0.776 -6.753
61 HD23 LEU 5 HD23 LEU 5 5.085 1.114 -8.402
62 H LEU 6 H LEU 6 -0.342 3.607 -7.570
63 HA LEU 6 HA LEU 6 -1.179 2.711 -10.181
64 HB2 LEU 6 HB2 LEU 6 -2.840 3.793 -7.866
65 HB3 LEU 6 HB3 LEU 6 -3.435 2.835 -9.230
66 HG LEU 6 HG LEU 6 -1.427 1.875 -7.139
67 HD11 LEU 6 HD11 LEU 6 -3.725 2.178 -6.256
68 HD12 LEU 6 HD12 LEU 6 -4.364 1.176 -7.578
69 HD13 LEU 6 HD13 LEU 6 -3.278 0.463 -6.360
70 HD21 LEU 6 HD21 LEU 6 -1.087 0.762 -9.305
71 HD22 LEU 6 HD22 LEU 6 -1.836 -0.354 -8.147
72 HD23 LEU 6 HD23 LEU 6 -2.828 0.405 -9.414
73 H LYS 7 H LYS 7 -0.965 5.865 -8.576
74 HA LYS 7 HA LYS 7 -2.538 7.267 -10.597
75 HB2 LYS 7 HB2 LYS 7 -0.552 8.306 -8.541
76 HB3 LYS 7 HB3 LYS 7 -1.774 9.262 -9.392
77 HG2 LYS 7 HG2 LYS 7 -3.572 8.139 -8.217
78 HG3 LYS 7 HG3 LYS 7 -2.450 6.936 -7.538
79 HD2 LYS 7 HD2 LYS 7 -1.229 8.705 -6.355
80 HD3 LYS 7 HD3 LYS 7 -2.366 9.919 -6.975
81 HE2 LYS 7 HE2 LYS 7 -3.089 7.540 -5.210
82 HE3 LYS 7 HE3 LYS 7 -2.911 9.211 -4.657
83 HZ1 LYS 7 HZ1 LYS 7 -4.895 8.285 -6.631
84 HZ2 LYS 7 HZ2 LYS 7 -5.199 8.659 -5.061
85 HZ3 LYS 7 HZ3 LYS 7 -4.718 9.831 -6.101
86 H LYS 8 H LYS 8 0.882 6.646 -9.838
87 HA LYS 8 HA LYS 8 2.027 8.336 -11.822
88 HB2 LYS 8 HB2 LYS 8 3.272 7.435 -9.919
89 HB3 LYS 8 HB3 LYS 8 3.048 5.782 -10.518
90 HG2 LYS 8 HG2 LYS 8 4.381 6.277 -12.519
91 HG3 LYS 8 HG3 LYS 8 4.537 7.973 -12.020
92 HD2 LYS 8 HD2 LYS 8 5.733 7.262 -9.971
93 HD3 LYS 8 HD3 LYS 8 5.562 5.556 -10.465
94 HE2 LYS 8 HE2 LYS 8 6.852 6.024 -12.519
95 HE3 LYS 8 HE3 LYS 8 7.012 7.722 -12.047
96 HZ1 LYS 8 HZ1 LYS 8 8.076 5.433 -10.530
97 HZ2 LYS 8 HZ2 LYS 8 8.958 6.463 -11.457
98 HZ3 LYS 8 HZ3 LYS 8 8.220 7.007 -10.097
99 H LEU 9 H LEU 9 0.529 5.156 -12.075
100 HA LEU 9 HA LEU 9 1.559 4.818 -14.831
101 HB2 LEU 9 HB2 LEU 9 -0.115 3.074 -12.985
102 HB3 LEU 9 HB3 LEU 9 0.327 2.622 -14.640
103 HG LEU 9 HG LEU 9 2.366 3.287 -12.475
104 HD11 LEU 9 HD11 LEU 9 2.711 0.862 -12.322
105 HD12 LEU 9 HD12 LEU 9 1.041 1.280 -11.884
106 HD13 LEU 9 HD13 LEU 9 1.390 0.580 -13.484
107 HD21 LEU 9 HD21 LEU 9 3.202 3.565 -14.784
108 HD22 LEU 9 HD22 LEU 9 3.919 2.129 -14.034
109 HD23 LEU 9 HD23 LEU 9 2.591 1.946 -15.205
110 H LEU 10 H LEU 10 -1.203 6.123 -13.192
111 HA LEU 10 HA LEU 10 -3.116 5.558 -15.310
112 HB2 LEU 10 HB2 LEU 10 -3.887 5.674 -13.079
113 HB3 LEU 10 HB3 LEU 10 -3.126 7.240 -12.785
114 HG LEU 10 HG LEU 10 -5.199 7.072 -14.968
115 HD11 LEU 10 HD11 LEU 10 -6.212 5.825 -13.096
116 HD12 LEU 10 HD12 LEU 10 -5.804 7.152 -11.984
117 HD13 LEU 10 HD13 LEU 10 -6.985 7.411 -13.290
118 HD21 LEU 10 HD21 LEU 10 -5.723 9.335 -14.083
119 HD22 LEU 10 HD22 LEU 10 -4.528 9.110 -12.783
120 HD23 LEU 10 HD23 LEU 10 -3.995 9.220 -14.473
121 H LYS 11 H LYS 11 -0.865 8.187 -14.523
122 HA LYS 11 HA LYS 11 -2.143 10.153 -16.177
123 HB2 LYS 11 HB2 LYS 11 -0.084 11.428 -15.879
124 HB3 LYS 11 HB3 LYS 11 -0.638 10.734 -14.345
125 HG2 LYS 11 HG2 LYS 11 1.014 8.866 -14.640
126 HG3 LYS 11 HG3 LYS 11 1.607 9.661 -16.111
127 HD2 LYS 11 HD2 LYS 11 1.631 10.860 -13.311
128 HD3 LYS 11 HD3 LYS 11 3.028 10.163 -14.154
129 HE2 LYS 11 HE2 LYS 11 2.772 11.863 -15.950
130 HE3 LYS 11 HE3 LYS 11 1.408 12.577 -15.068
131 HZ1 LYS 11 HZ1 LYS 11 3.449 13.740 -14.634
132 HZ2 LYS 11 HZ2 LYS 11 2.897 13.041 -13.255
133 HZ3 LYS 11 HZ3 LYS 11 4.162 12.372 -14.060
134 H LEU 12 H LEU 12 -0.535 7.309 -17.069
135 HA LEU 12 HA LEU 12 0.669 8.299 -19.541
136 HB2 LEU 12 HB2 LEU 12 0.035 5.567 -18.364
137 HB3 LEU 12 HB3 LEU 12 0.581 5.738 -20.035
138 HG LEU 12 HG LEU 12 2.419 5.154 -18.527
139 HD11 LEU 12 HD11 LEU 12 2.846 6.446 -20.591
140 HD12 LEU 12 HD12 LEU 12 2.697 7.959 -19.670
141 HD13 LEU 12 HD13 LEU 12 4.013 6.823 -19.309
142 HD21 LEU 12 HD21 LEU 12 1.608 6.383 -16.504
143 HD22 LEU 12 HD22 LEU 12 3.309 6.714 -16.905
144 HD23 LEU 12 HD23 LEU 12 2.070 7.911 -17.304
145 H LEU 13 H LEU 13 -2.555 7.602 -18.496
146 HA LEU 13 HA LEU 13 -3.438 7.465 -21.342
147 HB2 LEU 13 HB2 LEU 13 -4.631 6.037 -18.931
148 HB3 LEU 13 HB3 LEU 13 -5.281 5.987 -20.570
149 HG LEU 13 HG LEU 13 -2.515 4.958 -19.778
150 HD11 LEU 13 HD11 LEU 13 -5.112 3.475 -20.356
151 HD12 LEU 13 HD12 LEU 13 -3.520 2.732 -20.062
152 HD13 LEU 13 HD13 LEU 13 -4.332 3.640 -18.769
153 HD21 LEU 13 HD21 LEU 13 -2.674 5.654 -22.154
154 HD22 LEU 13 HD22 LEU 13 -2.583 3.889 -22.007
155 HD23 LEU 13 HD23 LEU 13 -4.143 4.669 -22.347
156 H LYS 14 H LYS 14 -3.626 9.097 -18.321
157 HA LYS 14 HA LYS 14 -6.066 10.544 -19.252
158 HB2 LYS 14 HB2 LYS 14 -4.983 10.241 -16.429
159 HB3 LYS 14 HB3 LYS 14 -6.434 11.135 -16.890
160 HG2 LYS 14 HG2 LYS 14 -6.004 8.127 -17.209
161 HG3 LYS 14 HG3 LYS 14 -6.999 8.907 -15.988
162 HD2 LYS 14 HD2 LYS 14 -7.480 8.961 -18.994
163 HD3 LYS 14 HD3 LYS 14 -8.386 8.025 -17.802
164 HE2 LYS 14 HE2 LYS 14 -8.242 11.064 -17.919
165 HE3 LYS 14 HE3 LYS 14 -9.582 10.072 -18.504
166 HZ1 LYS 14 HZ1 LYS 14 -9.903 9.277 -16.268
167 HZ2 LYS 14 HZ2 LYS 14 -8.672 10.211 -15.703
168 HZ3 LYS 14 HZ3 LYS 14 -10.022 10.913 -16.315
169 HN1 NH2 15 HN1 NHE 15 -2.862 10.845 -19.513
170 HN2 NH2 15 HN2 NHE 15 -2.692 12.575 -19.284
Start of MODEL 19
1 H1 LYS 1 H1 LYS 1 0.246 -1.580 0.898
2 H2 LYS 1 H2 LYS 1 -0.444 -2.064 -0.513
3 H3 LYS 1 H3 LYS 1 -0.513 -0.482 -0.061
4 HA LYS 1 HA LYS 1 1.844 -0.245 -0.239
5 HB2 LYS 1 HB2 LYS 1 2.462 -2.538 0.334
6 HB3 LYS 1 HB3 LYS 1 1.734 -3.130 -1.172
7 HG2 LYS 1 HG2 LYS 1 3.373 -1.839 -2.494
8 HG3 LYS 1 HG3 LYS 1 4.066 -1.175 -0.997
9 HD2 LYS 1 HD2 LYS 1 4.675 -3.462 -0.272
10 HD3 LYS 1 HD3 LYS 1 3.955 -4.131 -1.750
11 HE2 LYS 1 HE2 LYS 1 6.370 -3.970 -2.028
12 HE3 LYS 1 HE3 LYS 1 5.561 -2.841 -3.124
13 HZ1 LYS 1 HZ1 LYS 1 6.770 -2.130 -0.536
14 HZ2 LYS 1 HZ2 LYS 1 7.434 -1.838 -2.002
15 HZ3 LYS 1 HZ3 LYS 1 6.044 -1.076 -1.571
16 H LEU 2 H LEU 2 0.190 -2.361 -2.679
17 HA LEU 2 HA LEU 2 1.092 -0.675 -4.850
18 HB2 LEU 2 HB2 LEU 2 0.812 -3.086 -5.111
19 HB3 LEU 2 HB3 LEU 2 -0.897 -2.964 -4.679
20 HG LEU 2 HG LEU 2 -1.318 -1.586 -6.718
21 HD11 LEU 2 HD11 LEU 2 0.439 -1.497 -8.457
22 HD12 LEU 2 HD12 LEU 2 0.925 -0.595 -7.009
23 HD13 LEU 2 HD13 LEU 2 1.609 -2.206 -7.320
24 HD21 LEU 2 HD21 LEU 2 -1.021 -3.427 -8.328
25 HD22 LEU 2 HD22 LEU 2 0.109 -4.230 -7.216
26 HD23 LEU 2 HD23 LEU 2 -1.601 -4.037 -6.761
27 H LEU 3 H LEU 3 0.318 1.401 -4.336
28 HA LEU 3 HA LEU 3 -2.344 1.832 -5.469
29 HB2 LEU 3 HB2 LEU 3 -3.317 2.992 -3.652
30 HB3 LEU 3 HB3 LEU 3 -2.701 1.469 -3.015
31 HG LEU 3 HG LEU 3 -0.558 2.979 -2.439
32 HD11 LEU 3 HD11 LEU 3 -1.506 5.083 -3.442
33 HD12 LEU 3 HD12 LEU 3 -2.908 4.938 -2.368
34 HD13 LEU 3 HD13 LEU 3 -1.287 5.228 -1.687
35 HD21 LEU 3 HD21 LEU 3 -1.958 1.709 -0.843
36 HD22 LEU 3 HD22 LEU 3 -1.536 3.314 -0.204
37 HD23 LEU 3 HD23 LEU 3 -3.160 3.015 -0.864
38 H LYS 4 H LYS 4 0.789 3.122 -4.352
39 HA LYS 4 HA LYS 4 0.216 5.798 -5.335
40 HB2 LYS 4 HB2 LYS 4 2.584 6.212 -4.893
41 HB3 LYS 4 HB3 LYS 4 1.827 5.380 -3.520
42 HG2 LYS 4 HG2 LYS 4 2.795 3.232 -4.295
43 HG3 LYS 4 HG3 LYS 4 3.539 4.065 -5.682
44 HD2 LYS 4 HD2 LYS 4 4.818 5.502 -4.132
45 HD3 LYS 4 HD3 LYS 4 4.098 4.657 -2.743
46 HE2 LYS 4 HE2 LYS 4 5.057 2.519 -3.536
47 HE3 LYS 4 HE3 LYS 4 5.790 3.353 -4.916
48 HZ1 LYS 4 HZ1 LYS 4 6.372 3.903 -2.079
49 HZ2 LYS 4 HZ2 LYS 4 7.339 3.058 -3.101
50 HZ3 LYS 4 HZ3 LYS 4 7.075 4.658 -3.361
51 H LEU 5 H LEU 5 1.458 2.820 -6.735
52 HA LEU 5 HA LEU 5 2.605 4.063 -9.075
53 HB2 LEU 5 HB2 LEU 5 1.544 1.246 -8.613
54 HB3 LEU 5 HB3 LEU 5 2.524 1.752 -9.996
55 HG LEU 5 HG LEU 5 3.408 1.808 -7.077
56 HD11 LEU 5 HD11 LEU 5 4.909 -0.018 -7.764
57 HD12 LEU 5 HD12 LEU 5 3.213 -0.467 -8.026
58 HD13 LEU 5 HD13 LEU 5 4.229 0.023 -9.404
59 HD21 LEU 5 HD21 LEU 5 4.916 2.434 -9.656
60 HD22 LEU 5 HD22 LEU 5 4.516 3.594 -8.360
61 HD23 LEU 5 HD23 LEU 5 5.659 2.273 -8.052
62 H LEU 6 H LEU 6 -0.684 3.463 -8.054
63 HA LEU 6 HA LEU 6 -1.793 3.325 -10.727
64 HB2 LEU 6 HB2 LEU 6 -3.129 4.150 -8.123
65 HB3 LEU 6 HB3 LEU 6 -3.937 3.613 -9.601
66 HG LEU 6 HG LEU 6 -2.092 1.919 -7.860
67 HD11 LEU 6 HD11 LEU 6 -5.105 1.833 -8.329
68 HD12 LEU 6 HD12 LEU 6 -4.168 0.688 -7.333
69 HD13 LEU 6 HD13 LEU 6 -4.294 2.393 -6.851
70 HD21 LEU 6 HD21 LEU 6 -3.720 1.197 -10.342
71 HD22 LEU 6 HD22 LEU 6 -1.950 1.238 -10.234
72 HD23 LEU 6 HD23 LEU 6 -2.863 0.041 -9.293
73 H LYS 7 H LYS 7 -0.853 5.899 -8.499
74 HA LYS 7 HA LYS 7 -2.203 8.028 -9.955
75 HB2 LYS 7 HB2 LYS 7 0.191 8.160 -8.077
76 HB3 LYS 7 HB3 LYS 7 -0.905 9.489 -8.495
77 HG2 LYS 7 HG2 LYS 7 -2.733 8.435 -7.283
78 HG3 LYS 7 HG3 LYS 7 -1.794 6.942 -7.062
79 HD2 LYS 7 HD2 LYS 7 -1.707 8.198 -4.996
80 HD3 LYS 7 HD3 LYS 7 -0.109 8.168 -5.759
81 HE2 LYS 7 HE2 LYS 7 -0.598 10.402 -4.872
82 HE3 LYS 7 HE3 LYS 7 -0.472 10.458 -6.634
83 HZ1 LYS 7 HZ1 LYS 7 -2.357 11.694 -5.816
84 HZ2 LYS 7 HZ2 LYS 7 -2.881 10.437 -6.732
85 HZ3 LYS 7 HZ3 LYS 7 -2.986 10.358 -5.096
86 H LYS 8 H LYS 8 1.045 6.583 -9.828
87 HA LYS 8 HA LYS 8 2.314 8.385 -11.648
88 HB2 LYS 8 HB2 LYS 8 3.553 6.928 -10.119
89 HB3 LYS 8 HB3 LYS 8 2.882 5.489 -10.903
90 HG2 LYS 8 HG2 LYS 8 5.178 5.855 -11.626
91 HG3 LYS 8 HG3 LYS 8 4.077 6.053 -12.997
92 HD2 LYS 8 HD2 LYS 8 4.180 8.510 -12.735
93 HD3 LYS 8 HD3 LYS 8 5.257 8.326 -11.339
94 HE2 LYS 8 HE2 LYS 8 5.834 7.400 -14.185
95 HE3 LYS 8 HE3 LYS 8 6.480 8.864 -13.440
96 HZ1 LYS 8 HZ1 LYS 8 6.998 6.118 -12.519
97 HZ2 LYS 8 HZ2 LYS 8 8.052 7.085 -13.333
98 HZ3 LYS 8 HZ3 LYS 8 7.578 7.481 -11.809
99 H LEU 9 H LEU 9 0.203 5.628 -12.178
100 HA LEU 9 HA LEU 9 0.944 5.447 -15.035
101 HB2 LEU 9 HB2 LEU 9 -0.940 3.907 -13.223
102 HB3 LEU 9 HB3 LEU 9 -0.848 3.622 -14.966
103 HG LEU 9 HG LEU 9 1.566 3.420 -13.116
104 HD11 LEU 9 HD11 LEU 9 -0.254 1.234 -14.216
105 HD12 LEU 9 HD12 LEU 9 1.246 0.982 -13.300
106 HD13 LEU 9 HD13 LEU 9 -0.150 1.754 -12.514
107 HD21 LEU 9 HD21 LEU 9 2.508 2.144 -15.030
108 HD22 LEU 9 HD22 LEU 9 1.036 2.495 -15.968
109 HD23 LEU 9 HD23 LEU 9 2.133 3.814 -15.480
110 H LEU 10 H LEU 10 -1.499 6.940 -12.987
111 HA LEU 10 HA LEU 10 -3.541 7.245 -14.949
112 HB2 LEU 10 HB2 LEU 10 -3.977 7.617 -12.629
113 HB3 LEU 10 HB3 LEU 10 -2.717 8.843 -12.489
114 HG LEU 10 HG LEU 10 -4.974 9.332 -14.427
115 HD11 LEU 10 HD11 LEU 10 -5.116 9.689 -11.408
116 HD12 LEU 10 HD12 LEU 10 -6.301 10.305 -12.582
117 HD13 LEU 10 HD13 LEU 10 -6.079 8.550 -12.379
118 HD21 LEU 10 HD21 LEU 10 -4.626 11.668 -13.648
119 HD22 LEU 10 HD22 LEU 10 -3.404 11.108 -12.491
120 HD23 LEU 10 HD23 LEU 10 -3.096 10.990 -14.235
121 H LYS 11 H LYS 11 -0.430 8.765 -14.511
122 HA LYS 11 HA LYS 11 -0.980 11.126 -16.078
123 HB2 LYS 11 HB2 LYS 11 1.777 9.972 -15.557
124 HB3 LYS 11 HB3 LYS 11 1.281 11.665 -15.704
125 HG2 LYS 11 HG2 LYS 11 -0.126 11.201 -13.544
126 HG3 LYS 11 HG3 LYS 11 0.865 9.743 -13.395
127 HD2 LYS 11 HD2 LYS 11 2.919 11.093 -13.380
128 HD3 LYS 11 HD3 LYS 11 1.966 12.573 -13.622
129 HE2 LYS 11 HE2 LYS 11 0.774 12.153 -11.489
130 HE3 LYS 11 HE3 LYS 11 1.742 10.691 -11.238
131 HZ1 LYS 11 HZ1 LYS 11 3.708 12.089 -11.204
132 HZ2 LYS 11 HZ2 LYS 11 2.792 13.441 -11.412
133 HZ3 LYS 11 HZ3 LYS 11 2.645 12.544 -10.042
134 H LEU 12 H LEU 12 -0.936 7.992 -17.055
135 HA LEU 12 HA LEU 12 0.100 8.715 -19.747
136 HB2 LEU 12 HB2 LEU 12 1.901 7.558 -18.599
137 HB3 LEU 12 HB3 LEU 12 0.794 6.278 -18.082
138 HG LEU 12 HG LEU 12 0.453 5.609 -20.454
139 HD11 LEU 12 HD11 LEU 12 2.605 7.711 -20.983
140 HD12 LEU 12 HD12 LEU 12 2.020 6.519 -22.165
141 HD13 LEU 12 HD13 LEU 12 0.922 7.773 -21.556
142 HD21 LEU 12 HD21 LEU 12 2.191 4.541 -19.065
143 HD22 LEU 12 HD22 LEU 12 2.696 4.638 -20.769
144 HD23 LEU 12 HD23 LEU 12 3.361 5.779 -19.573
145 H LEU 13 H LEU 13 -2.016 6.682 -17.703
146 HA LEU 13 HA LEU 13 -3.279 5.468 -20.034
147 HB2 LEU 13 HB2 LEU 13 -4.012 5.512 -17.070
148 HB3 LEU 13 HB3 LEU 13 -4.833 4.528 -18.301
149 HG LEU 13 HG LEU 13 -1.864 4.313 -17.606
150 HD11 LEU 13 HD11 LEU 13 -4.225 2.553 -16.826
151 HD12 LEU 13 HD12 LEU 13 -2.513 2.222 -16.479
152 HD13 LEU 13 HD13 LEU 13 -3.315 3.619 -15.728
153 HD21 LEU 13 HD21 LEU 13 -2.023 2.188 -18.870
154 HD22 LEU 13 HD22 LEU 13 -3.711 2.571 -19.298
155 HD23 LEU 13 HD23 LEU 13 -2.371 3.579 -19.903
156 H LYS 14 H LYS 14 -3.577 8.465 -18.414
157 HA LYS 14 HA LYS 14 -5.939 9.050 -20.089
158 HB2 LYS 14 HB2 LYS 14 -5.662 9.873 -17.169
159 HB3 LYS 14 HB3 LYS 14 -6.907 10.445 -18.294
160 HG2 LYS 14 HG2 LYS 14 -7.563 8.020 -18.664
161 HG3 LYS 14 HG3 LYS 14 -6.494 7.593 -17.311
162 HD2 LYS 14 HD2 LYS 14 -8.876 9.493 -17.205
163 HD3 LYS 14 HD3 LYS 14 -8.838 7.830 -16.585
164 HE2 LYS 14 HE2 LYS 14 -7.047 8.471 -14.993
165 HE3 LYS 14 HE3 LYS 14 -7.116 10.141 -15.589
166 HZ1 LYS 14 HZ1 LYS 14 -8.419 9.839 -13.597
167 HZ2 LYS 14 HZ2 LYS 14 -9.393 10.252 -14.854
168 HZ3 LYS 14 HZ3 LYS 14 -9.353 8.700 -14.329
169 HN1 NH2 15 HN1 NHE 15 -2.887 9.471 -20.018
170 HN2 NH2 15 HN2 NHE 15 -2.716 11.187 -20.305
Start of MODEL 20
1 H1 LYS 1 H1 LYS 1 1.716 2.970 1.493
2 H2 LYS 1 H2 LYS 1 0.414 2.498 0.611
3 H3 LYS 1 H3 LYS 1 1.639 3.328 -0.111
4 HA LYS 1 HA LYS 1 3.161 1.531 0.258
5 HB2 LYS 1 HB2 LYS 1 2.056 0.745 2.348
6 HB3 LYS 1 HB3 LYS 1 0.701 0.142 1.396
7 HG2 LYS 1 HG2 LYS 1 2.144 -1.699 1.938
8 HG3 LYS 1 HG3 LYS 1 2.272 -1.413 0.199
9 HD2 LYS 1 HD2 LYS 1 4.398 -0.168 0.562
10 HD3 LYS 1 HD3 LYS 1 4.242 -0.397 2.308
11 HE2 LYS 1 HE2 LYS 1 4.499 -2.636 0.261
12 HE3 LYS 1 HE3 LYS 1 5.813 -2.024 1.269
13 HZ1 LYS 1 HZ1 LYS 1 4.585 -2.703 3.209
14 HZ2 LYS 1 HZ2 LYS 1 3.355 -3.288 2.285
15 HZ3 LYS 1 HZ3 LYS 1 4.840 -3.981 2.214
16 H LEU 2 H LEU 2 3.351 1.582 -1.952
17 HA LEU 2 HA LEU 2 2.967 1.137 -4.136
18 HB2 LEU 2 HB2 LEU 2 1.855 -1.372 -2.843
19 HB3 LEU 2 HB3 LEU 2 1.937 -1.175 -4.584
20 HG LEU 2 HG LEU 2 3.823 -2.450 -3.812
21 HD11 LEU 2 HD11 LEU 2 4.746 0.305 -4.709
22 HD12 LEU 2 HD12 LEU 2 5.601 -1.240 -4.913
23 HD13 LEU 2 HD13 LEU 2 4.078 -0.950 -5.778
24 HD21 LEU 2 HD21 LEU 2 4.762 -0.003 -2.274
25 HD22 LEU 2 HD22 LEU 2 4.047 -1.470 -1.536
26 HD23 LEU 2 HD23 LEU 2 5.583 -1.558 -2.427
27 H LEU 3 H LEU 3 1.015 2.881 -2.941
28 HA LEU 3 HA LEU 3 -1.418 2.180 -4.513
29 HB2 LEU 3 HB2 LEU 3 -1.951 2.306 -2.189
30 HB3 LEU 3 HB3 LEU 3 -0.933 3.737 -1.957
31 HG LEU 3 HG LEU 3 -2.441 5.059 -3.379
32 HD11 LEU 3 HD11 LEU 3 -3.438 3.238 -4.739
33 HD12 LEU 3 HD12 LEU 3 -4.201 2.557 -3.282
34 HD13 LEU 3 HD13 LEU 3 -4.702 4.152 -3.901
35 HD21 LEU 3 HD21 LEU 3 -3.795 3.630 -1.051
36 HD22 LEU 3 HD22 LEU 3 -2.690 5.024 -0.927
37 HD23 LEU 3 HD23 LEU 3 -4.269 5.209 -1.721
38 H LYS 4 H LYS 4 1.052 4.683 -3.795
39 HA LYS 4 HA LYS 4 -0.130 6.672 -5.509
40 HB2 LYS 4 HB2 LYS 4 1.472 7.200 -3.706
41 HB3 LYS 4 HB3 LYS 4 2.736 6.279 -4.540
42 HG2 LYS 4 HG2 LYS 4 2.698 7.833 -6.424
43 HG3 LYS 4 HG3 LYS 4 1.323 8.708 -5.708
44 HD2 LYS 4 HD2 LYS 4 2.731 9.269 -3.737
45 HD3 LYS 4 HD3 LYS 4 4.110 8.443 -4.488
46 HE2 LYS 4 HE2 LYS 4 2.622 10.832 -5.654
47 HE3 LYS 4 HE3 LYS 4 4.184 10.903 -4.828
48 HZ1 LYS 4 HZ1 LYS 4 5.075 9.481 -6.553
49 HZ2 LYS 4 HZ2 LYS 4 3.628 9.443 -7.329
50 HZ3 LYS 4 HZ3 LYS 4 4.455 10.855 -7.198
51 H LEU 5 H LEU 5 1.657 3.759 -6.115
52 HA LEU 5 HA LEU 5 2.803 4.542 -8.648
53 HB2 LEU 5 HB2 LEU 5 2.190 1.894 -7.287
54 HB3 LEU 5 HB3 LEU 5 2.774 1.954 -8.946
55 HG LEU 5 HG LEU 5 4.600 1.549 -7.367
56 HD11 LEU 5 HD11 LEU 5 5.009 2.758 -9.500
57 HD12 LEU 5 HD12 LEU 5 4.842 4.304 -8.636
58 HD13 LEU 5 HD13 LEU 5 6.158 3.193 -8.215
59 HD21 LEU 5 HD21 LEU 5 4.119 4.353 -6.288
60 HD22 LEU 5 HD22 LEU 5 3.687 2.849 -5.435
61 HD23 LEU 5 HD23 LEU 5 5.384 3.213 -5.806
62 H LEU 6 H LEU 6 -0.442 3.695 -7.628
63 HA LEU 6 HA LEU 6 -1.295 2.794 -10.250
64 HB2 LEU 6 HB2 LEU 6 -2.947 3.848 -7.925
65 HB3 LEU 6 HB3 LEU 6 -3.553 2.944 -9.325
66 HG LEU 6 HG LEU 6 -1.656 1.888 -7.186
67 HD11 LEU 6 HD11 LEU 6 -4.528 1.184 -7.926
68 HD12 LEU 6 HD12 LEU 6 -3.549 0.415 -6.650
69 HD13 LEU 6 HD13 LEU 6 -4.028 2.122 -6.500
70 HD21 LEU 6 HD21 LEU 6 -1.960 -0.298 -8.350
71 HD22 LEU 6 HD22 LEU 6 -2.837 0.535 -9.649
72 HD23 LEU 6 HD23 LEU 6 -1.110 0.886 -9.361
73 H LYS 7 H LYS 7 -1.006 5.916 -8.605
74 HA LYS 7 HA LYS 7 -2.501 7.393 -10.619
75 HB2 LYS 7 HB2 LYS 7 -0.455 8.261 -8.544
76 HB3 LYS 7 HB3 LYS 7 -1.469 9.354 -9.497
77 HG2 LYS 7 HG2 LYS 7 -3.481 8.546 -8.456
78 HG3 LYS 7 HG3 LYS 7 -2.620 7.198 -7.676
79 HD2 LYS 7 HD2 LYS 7 -1.305 8.723 -6.333
80 HD3 LYS 7 HD3 LYS 7 -1.969 10.129 -7.185
81 HE2 LYS 7 HE2 LYS 7 -3.066 9.870 -5.005
82 HE3 LYS 7 HE3 LYS 7 -4.218 9.620 -6.324
83 HZ1 LYS 7 HZ1 LYS 7 -4.459 7.977 -4.614
84 HZ2 LYS 7 HZ2 LYS 7 -3.984 7.251 -6.002
85 HZ3 LYS 7 HZ3 LYS 7 -2.906 7.478 -4.781
86 H LYS 8 H LYS 8 0.905 6.634 -9.931
87 HA LYS 8 HA LYS 8 2.088 8.234 -11.956
88 HB2 LYS 8 HB2 LYS 8 3.308 7.240 -10.070
89 HB3 LYS 8 HB3 LYS 8 3.011 5.615 -10.707
90 HG2 LYS 8 HG2 LYS 8 4.345 6.119 -12.714
91 HG3 LYS 8 HG3 LYS 8 4.570 7.797 -12.162
92 HD2 LYS 8 HD2 LYS 8 5.725 6.951 -10.130
93 HD3 LYS 8 HD3 LYS 8 5.555 5.291 -10.731
94 HE2 LYS 8 HE2 LYS 8 7.043 7.549 -12.138
95 HE3 LYS 8 HE3 LYS 8 7.797 6.249 -11.204
96 HZ1 LYS 8 HZ1 LYS 8 7.821 5.776 -13.544
97 HZ2 LYS 8 HZ2 LYS 8 6.890 4.676 -12.764
98 HZ3 LYS 8 HZ3 LYS 8 6.187 5.884 -13.643
99 H LEU 9 H LEU 9 0.403 5.143 -12.172
100 HA LEU 9 HA LEU 9 1.337 4.767 -14.955
101 HB2 LEU 9 HB2 LEU 9 -0.381 3.091 -13.090
102 HB3 LEU 9 HB3 LEU 9 0.016 2.640 -14.761
103 HG LEU 9 HG LEU 9 2.114 3.164 -12.614
104 HD11 LEU 9 HD11 LEU 9 1.000 0.535 -13.671
105 HD12 LEU 9 HD12 LEU 9 2.341 0.720 -12.514
106 HD13 LEU 9 HD13 LEU 9 0.696 1.215 -12.056
107 HD21 LEU 9 HD21 LEU 9 2.958 3.458 -14.903
108 HD22 LEU 9 HD22 LEU 9 3.587 1.959 -14.202
109 HD23 LEU 9 HD23 LEU 9 2.256 1.887 -15.375
110 H LEU 10 H LEU 10 -1.390 6.063 -13.167
111 HA LEU 10 HA LEU 10 -3.312 5.694 -15.315
112 HB2 LEU 10 HB2 LEU 10 -4.054 5.753 -13.046
113 HB3 LEU 10 HB3 LEU 10 -3.267 7.310 -12.740
114 HG LEU 10 HG LEU 10 -5.346 7.162 -14.918
115 HD11 LEU 10 HD11 LEU 10 -5.923 7.264 -11.928
116 HD12 LEU 10 HD12 LEU 10 -7.117 7.546 -13.215
117 HD13 LEU 10 HD13 LEU 10 -6.361 5.945 -13.040
118 HD21 LEU 10 HD21 LEU 10 -5.866 9.443 -14.034
119 HD22 LEU 10 HD22 LEU 10 -4.643 9.225 -12.770
120 HD23 LEU 10 HD23 LEU 10 -4.157 9.319 -14.476
121 H LYS 11 H LYS 11 -1.022 8.229 -14.342
122 HA LYS 11 HA LYS 11 -2.151 10.285 -16.000
123 HB2 LYS 11 HB2 LYS 11 -0.033 11.449 -15.605
124 HB3 LYS 11 HB3 LYS 11 -0.674 10.760 -14.103
125 HG2 LYS 11 HG2 LYS 11 0.853 8.814 -14.349
126 HG3 LYS 11 HG3 LYS 11 1.534 9.526 -15.823
127 HD2 LYS 11 HD2 LYS 11 1.592 10.777 -13.044
128 HD3 LYS 11 HD3 LYS 11 2.951 9.956 -13.837
129 HE2 LYS 11 HE2 LYS 11 2.862 11.626 -15.684
130 HE3 LYS 11 HE3 LYS 11 1.547 12.463 -14.853
131 HZ1 LYS 11 HZ1 LYS 11 3.044 12.851 -13.010
132 HZ2 LYS 11 HZ2 LYS 11 4.268 12.075 -13.787
133 HZ3 LYS 11 HZ3 LYS 11 3.667 13.473 -14.396
134 H LEU 12 H LEU 12 -0.555 7.394 -16.847
135 HA LEU 12 HA LEU 12 0.779 8.451 -19.217
136 HB2 LEU 12 HB2 LEU 12 0.192 5.583 -18.412
137 HB3 LEU 12 HB3 LEU 12 1.345 6.121 -19.640
138 HG LEU 12 HG LEU 12 1.526 6.710 -16.643
139 HD11 LEU 12 HD11 LEU 12 1.968 4.351 -17.251
140 HD12 LEU 12 HD12 LEU 12 3.166 4.890 -18.449
141 HD13 LEU 12 HD13 LEU 12 3.444 5.178 -16.712
142 HD21 LEU 12 HD21 LEU 12 3.791 7.554 -17.201
143 HD22 LEU 12 HD22 LEU 12 3.450 7.323 -18.931
144 HD23 LEU 12 HD23 LEU 12 2.529 8.521 -17.991
145 H LEU 13 H LEU 13 -2.454 7.642 -18.441
146 HA LEU 13 HA LEU 13 -3.125 7.493 -21.333
147 HB2 LEU 13 HB2 LEU 13 -4.251 5.745 -19.106
148 HB3 LEU 13 HB3 LEU 13 -4.879 5.797 -20.760
149 HG LEU 13 HG LEU 13 -2.032 4.969 -20.045
150 HD11 LEU 13 HD11 LEU 13 -3.688 3.406 -19.119
151 HD12 LEU 13 HD12 LEU 13 -4.480 3.283 -20.706
152 HD13 LEU 13 HD13 LEU 13 -2.822 2.674 -20.487
153 HD21 LEU 13 HD21 LEU 13 -2.296 5.810 -22.364
154 HD22 LEU 13 HD22 LEU 13 -2.049 4.050 -22.349
155 HD23 LEU 13 HD23 LEU 13 -3.680 4.717 -22.602
156 H LYS 14 H LYS 14 -3.480 9.143 -18.473
157 HA LYS 14 HA LYS 14 -5.908 10.461 -19.532
158 HB2 LYS 14 HB2 LYS 14 -5.474 9.744 -16.606
159 HB3 LYS 14 HB3 LYS 14 -6.795 10.728 -17.258
160 HG2 LYS 14 HG2 LYS 14 -7.490 8.758 -18.675
161 HG3 LYS 14 HG3 LYS 14 -6.236 7.790 -17.875
162 HD2 LYS 14 HD2 LYS 14 -8.394 7.370 -16.829
163 HD3 LYS 14 HD3 LYS 14 -7.349 8.223 -15.680
164 HE2 LYS 14 HE2 LYS 14 -8.459 10.357 -16.233
165 HE3 LYS 14 HE3 LYS 14 -9.463 9.537 -17.440
166 HZ1 LYS 14 HZ1 LYS 14 -10.413 8.230 -15.678
167 HZ2 LYS 14 HZ2 LYS 14 -9.476 8.977 -14.550
168 HZ3 LYS 14 HZ3 LYS 14 -10.612 9.833 -15.366
169 HN1 NH2 15 HN1 NHE 15 -2.817 10.857 -19.338
170 HN2 NH2 15 HN2 NHE 15 -2.684 12.492 -18.736