NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
644915 |
6old   |
30601 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLU 1 HT1 GLU 1 -8.963 -7.961 -1.242
2 H2 GLU 1 HT2 GLU 1 -7.617 -7.056 -0.739
3 H3 GLU 1 HT3 GLU 1 -8.797 -7.521 0.391
4 HA GLU 1 HA GLU 1 -7.427 -9.582 -1.148
5 HB2 GLU 1 HB2 GLU 1 -5.583 -9.689 0.533
6 HB3 GLU 1 HB1 GLU 1 -5.582 -8.118 -0.344
7 HG2 GLU 1 HG2 GLU 1 -6.804 -7.045 1.602
8 HG3 GLU 1 HG1 GLU 1 -6.720 -8.616 2.493
9 H MET 2 HN MET 2 -10.103 -9.111 0.281
10 HA MET 2 HA MET 2 -9.798 -11.377 2.121
11 HB2 MET 2 HB2 MET 2 -11.712 -8.997 2.448
12 HB3 MET 2 HB1 MET 2 -11.688 -10.464 3.483
13 HG2 MET 2 HG2 MET 2 -9.432 -8.383 3.208
14 HG3 MET 2 HG1 MET 2 -10.566 -8.537 4.585
15 HE1 MET 2 HE1 MET 2 -10.910 -10.276 5.988
16 HE2 MET 2 HE2 MET 2 -9.701 -11.458 6.598
17 HE3 MET 2 HE3 MET 2 -10.697 -11.856 5.156
18 H ARG 3 HN ARG 3 -11.668 -12.795 2.185
19 HA ARG 3 HA ARG 3 -13.699 -12.119 0.251
20 HB2 ARG 3 HB2 ARG 3 -12.117 -13.550 -1.042
21 HB3 ARG 3 HB1 ARG 3 -12.153 -14.767 0.278
22 HG2 ARG 3 HG2 ARG 3 -13.594 -15.509 -1.559
23 HG3 ARG 3 HG1 ARG 3 -14.597 -15.127 -0.119
24 HD2 ARG 3 HD2 ARG 3 -15.222 -12.907 -1.119
25 HD3 ARG 3 HD1 ARG 3 -14.192 -13.270 -2.572
26 HE ARG 3 HE ARG 3 -16.820 -14.484 -1.910
27 HH11 ARG 3 HH11 ARG 3 -13.786 -14.645 -3.779
28 HH12 ARG 3 HH12 ARG 3 -14.432 -15.655 -5.029
29 HH21 ARG 3 HH21 ARG 3 -17.692 -15.856 -3.610
30 HH22 ARG 3 HH22 ARG 3 -16.689 -16.354 -4.930
31 H LEU 4 HN LEU 4 -15.682 -12.604 1.055
32 HA LEU 4 HA LEU 4 -16.082 -14.755 2.825
33 HB2 LEU 4 HB2 LEU 4 -17.023 -13.021 4.666
34 HB3 LEU 4 HB1 LEU 4 -15.326 -13.600 4.730
35 HG LEU 4 HG LEU 4 -14.475 -11.589 3.730
36 HD11 LEU 4 HD11 LEU 4 -17.363 -11.061 2.932
37 HD12 LEU 4 HD12 LEU 4 -15.830 -10.826 2.003
38 HD13 LEU 4 HD13 LEU 4 -16.299 -9.645 3.286
39 HD21 LEU 4 HD21 LEU 4 -16.031 -11.568 6.180
40 HD22 LEU 4 HD22 LEU 4 -16.180 -9.949 5.393
41 HD23 LEU 4 HD23 LEU 4 -14.549 -10.627 5.764
42 H SER 5 HN SER 5 -18.496 -14.208 3.894
43 HA SER 5 HA SER 5 -20.043 -12.455 2.357
44 HB2 SER 5 HB2 SER 5 -19.636 -14.314 0.605
45 HB3 SER 5 HB1 SER 5 -20.513 -15.436 1.718
46 HG SER 5 HG SER 5 -21.435 -13.427 0.078
47 H DPP 6 HN DPP 6 -22.214 -14.927 2.740
48 HA DPP 6 HA DPP 6 -22.917 -13.884 5.275
49 HB2 DPP 6 HB2 DPP 6 -24.080 -16.230 3.663
50 HB3 DPP 6 HB3 DPP 6 -24.836 -14.624 3.972
51 H PHE 7 HN PHE 7 -21.339 -14.184 6.717
52 HA PHE 7 HA PHE 7 -21.102 -16.935 7.693
53 HB2 PHE 7 HB2 PHE 7 -18.760 -16.796 7.144
54 HB3 PHE 7 HB1 PHE 7 -18.827 -14.986 7.017
55 HD1 PHE 7 HD1 PHE 7 -19.853 -17.087 9.958
56 HD2 PHE 7 HD2 PHE 7 -17.006 -14.347 8.354
57 HE1 PHE 7 HE1 PHE 7 -18.996 -16.685 12.213
58 HE2 PHE 7 HE2 PHE 7 -16.102 -14.016 10.616
59 HZ PHE 7 HZ PHE 7 -17.068 -15.195 12.530
60 H PHE 8 HN PHE 8 -19.732 -13.832 8.585
61 HA PHE 8 HA PHE 8 -20.585 -14.142 11.204
62 HB2 PHE 8 HB2 PHE 8 -19.246 -12.222 11.624
63 HB3 PHE 8 HB1 PHE 8 -18.451 -13.036 10.261
64 HD1 PHE 8 HD1 PHE 8 -19.587 -10.084 11.527
65 HD2 PHE 8 HD2 PHE 8 -19.280 -12.313 7.954
66 HE1 PHE 8 HE1 PHE 8 -19.842 -8.084 10.288
67 HE2 PHE 8 HE2 PHE 8 -19.502 -10.307 6.661
68 HZ PHE 8 HZ PHE 8 -19.778 -8.151 7.826
69 H ARG 9 HN ARG 9 -21.846 -11.969 8.542
70 HA ARG 9 HA ARG 9 -23.438 -10.784 10.514
71 HB2 ARG 9 HB2 ARG 9 -24.828 -10.656 7.921
72 HB3 ARG 9 HB1 ARG 9 -24.138 -9.327 8.913
73 HG2 ARG 9 HG2 ARG 9 -23.020 -9.227 6.816
74 HG3 ARG 9 HG1 ARG 9 -21.853 -9.944 7.973
75 HD2 ARG 9 HD2 ARG 9 -21.642 -11.796 6.659
76 HD3 ARG 9 HD1 ARG 9 -23.430 -12.090 6.766
77 HE ARG 9 HE ARG 9 -22.046 -10.436 4.651
78 HH11 ARG 9 HH11 ARG 9 -24.915 -12.118 5.958
79 HH12 ARG 9 HH12 ARG 9 -25.848 -11.960 4.506
80 HH21 ARG 9 HH21 ARG 9 -23.320 -10.236 2.690
81 HH22 ARG 9 HH22 ARG 9 -24.926 -10.878 2.622
82 H GLN 10 HN GLN 10 -23.564 -13.972 9.716
83 HA GLN 10 HA GLN 10 -26.194 -13.923 10.827
84 HB2 GLN 10 HB2 GLN 10 -27.205 -15.512 9.305
85 HB3 GLN 10 HB1 GLN 10 -26.613 -14.123 8.345
86 HG2 GLN 10 HG2 GLN 10 -24.641 -16.389 8.596
87 HG3 GLN 10 HG1 GLN 10 -26.158 -16.798 7.708
88 HE21 GLN 10 HE21 GLN 10 -25.023 -16.965 5.696
89 H PHE 11 HN PHE 11 -23.362 -14.420 11.499
90 HA PHE 11 HA PHE 11 -23.810 -17.077 12.605
91 HB2 PHE 11 HB2 PHE 11 -21.925 -17.253 10.984
92 HB3 PHE 11 HB1 PHE 11 -21.151 -15.837 11.775
93 HD1 PHE 11 HD1 PHE 11 -21.487 -19.337 11.704
94 HD2 PHE 11 HD2 PHE 11 -20.593 -16.019 14.208
95 HE1 PHE 11 HE1 PHE 11 -20.327 -20.843 13.266
96 HE2 PHE 11 HE2 PHE 11 -19.408 -17.529 15.767
97 HZ PHE 11 HZ PHE 11 -19.280 -19.937 15.297
98 H ILE 12 HN ILE 12 -22.072 -13.947 12.853
99 HA ILE 12 HA ILE 12 -21.879 -14.348 15.682
100 HB ILE 12 HB ILE 12 -21.491 -11.614 15.176
101 HG12 ILE 12 HG12 ILE 12 -19.521 -11.934 13.462
102 HG13 ILE 12 HG11 ILE 12 -20.647 -13.176 12.828
103 HG21 ILE 12 HG21 ILE 12 -20.148 -12.794 16.832
104 HG22 ILE 12 HG22 ILE 12 -18.990 -12.252 15.560
105 HG23 ILE 12 HG23 ILE 12 -19.540 -13.971 15.604
106 HD11 ILE 12 HD11 ILE 12 -21.211 -11.033 11.799
107 HD12 ILE 12 HD12 ILE 12 -21.298 -10.244 13.412
108 HD13 ILE 12 HD13 ILE 12 -22.511 -11.503 12.947
109 H LEU 13 HN LEU 13 -23.913 -13.373 13.366
110 HA LEU 13 HA LEU 13 -25.265 -11.491 15.021
111 HB2 LEU 13 HB2 LEU 13 -24.503 -11.932 12.306
112 HB3 LEU 13 HB1 LEU 13 -26.306 -11.668 12.388
113 HG LEU 13 HG LEU 13 -25.979 -9.522 13.551
114 HD11 LEU 13 HD11 LEU 13 -23.443 -10.645 14.351
115 HD12 LEU 13 HD12 LEU 13 -24.126 -9.031 14.782
116 HD13 LEU 13 HD13 LEU 13 -23.060 -9.201 13.338
117 HD21 LEU 13 HD21 LEU 13 -23.860 -9.146 11.436
118 HD22 LEU 13 HD22 LEU 13 -25.442 -8.306 11.670
119 HD23 LEU 13 HD23 LEU 13 -25.391 -9.927 10.881
120 H GLN 14 HN GLN 14 -25.113 -14.719 14.558
121 HA GLN 14 HA GLN 14 -27.814 -15.047 15.467
122 HB2 GLN 14 HB2 GLN 14 -26.680 -16.562 13.038
123 HB3 GLN 14 HB1 GLN 14 -28.140 -17.085 13.948
124 HG2 GLN 14 HG2 GLN 14 -27.919 -14.318 12.614
125 HG3 GLN 14 HG1 GLN 14 -28.585 -15.773 11.766
126 HE21 GLN 14 HE21 GLN 14 -29.477 -13.076 13.569
127 HE22 GLN 14 HE22 GLN 14 -30.973 -13.646 14.230
128 H ARG 15 HN ARG 15 -25.353 -14.838 16.623
129 HA ARG 15 HA ARG 15 -24.289 -17.487 16.914
130 HB2 ARG 15 HB2 ARG 15 -23.342 -14.808 17.201
131 HB3 ARG 15 HB1 ARG 15 -23.275 -15.545 18.843
132 HG2 ARG 15 HG2 ARG 15 -22.051 -17.553 17.806
133 HG3 ARG 15 HG1 ARG 15 -21.952 -16.620 16.261
134 HD2 ARG 15 HD2 ARG 15 -19.880 -16.094 17.270
135 HD3 ARG 15 HD1 ARG 15 -20.915 -14.710 17.840
136 HE ARG 15 HE ARG 15 -21.125 -16.883 19.727
137 HH11 ARG 15 HH11 ARG 15 -18.841 -14.451 18.479
138 HH12 ARG 15 HH12 ARG 15 -17.945 -14.312 19.955
139 HH21 ARG 15 HH21 ARG 15 -19.914 -16.696 21.730
140 HH22 ARG 15 HH22 ARG 15 -18.566 -15.612 21.837
141 H LYS 16 HN LYS 16 -25.961 -18.682 17.879
142 HA LYS 16 HA LYS 16 -27.357 -17.788 20.127
143 HB2 LYS 16 HB2 LYS 16 -26.646 -20.634 19.225
144 HB3 LYS 16 HB1 LYS 16 -27.783 -20.262 20.570
145 HG2 LYS 16 HG2 LYS 16 -29.250 -19.006 18.985
146 HG3 LYS 16 HG1 LYS 16 -28.117 -19.385 17.643
147 HD2 LYS 16 HD2 LYS 16 -28.527 -21.830 17.982
148 HD3 LYS 16 HD1 LYS 16 -29.651 -21.457 19.335
149 HE2 LYS 16 HE2 LYS 16 -31.166 -20.230 17.750
150 HE3 LYS 16 HE1 LYS 16 -30.028 -20.594 16.386
151 HZ1 LYS 16 HZ1 LYS 16 -31.105 -22.467 16.153
152 HZ2 LYS 16 HZ2 LYS 16 -32.034 -22.211 17.551
153 HZ3 LYS 16 HZ3 LYS 16 -30.530 -22.992 17.661
154 H LYS 17 HN LYS 17 -24.249 -19.439 19.629
155 HA LYS 17 HA LYS 17 -23.766 -19.051 22.502
156 HB2 LYS 17 HB2 LYS 17 -23.544 -21.574 20.877
157 HB3 LYS 17 HB1 LYS 17 -22.104 -21.191 21.883
158 HG2 LYS 17 HG2 LYS 17 -23.494 -22.595 23.237
159 HG3 LYS 17 HG1 LYS 17 -23.693 -20.931 23.885
160 HD2 LYS 17 HD2 LYS 17 -25.851 -20.682 22.697
161 HD3 LYS 17 HD1 LYS 17 -25.633 -22.279 21.903
162 HE2 LYS 17 HE2 LYS 17 -25.722 -23.412 24.148
163 HE3 LYS 17 HE1 LYS 17 -25.942 -21.798 24.945
164 HZ1 LYS 17 HZ1 LYS 17 -28.029 -22.852 24.630
165 HZ2 LYS 17 HZ2 LYS 17 -27.753 -23.090 22.971
166 HZ3 LYS 17 HZ3 LYS 17 -27.943 -21.517 23.584
Start of MODEL 2
1 H1 GLU 1 HT1 GLU 1 -11.383 -8.490 -0.573
2 H2 GLU 1 HT2 GLU 1 -10.707 -7.027 -1.112
3 H3 GLU 1 HT3 GLU 1 -12.326 -7.076 -0.599
4 HA GLU 1 HA GLU 1 -9.907 -6.840 0.913
5 HB2 GLU 1 HB2 GLU 1 -11.778 -5.141 0.837
6 HB3 GLU 1 HB1 GLU 1 -12.869 -6.360 1.587
7 HG2 GLU 1 HG2 GLU 1 -11.444 -6.404 3.651
8 HG3 GLU 1 HG1 GLU 1 -10.306 -5.217 2.898
9 H MET 2 HN MET 2 -12.856 -8.921 0.965
10 HA MET 2 HA MET 2 -11.474 -10.518 3.004
11 HB2 MET 2 HB2 MET 2 -14.505 -10.073 2.796
12 HB3 MET 2 HB1 MET 2 -13.685 -11.185 3.943
13 HG2 MET 2 HG2 MET 2 -13.443 -8.115 3.881
14 HG3 MET 2 HG1 MET 2 -14.387 -9.079 5.056
15 HE1 MET 2 HE1 MET 2 -12.131 -10.746 7.402
16 HE2 MET 2 HE2 MET 2 -12.317 -11.622 5.844
17 HE3 MET 2 HE3 MET 2 -13.691 -10.673 6.510
18 H ARG 3 HN ARG 3 -12.177 -12.823 2.955
19 HA ARG 3 HA ARG 3 -13.140 -13.475 0.275
20 HB2 ARG 3 HB2 ARG 3 -11.939 -15.739 0.690
21 HB3 ARG 3 HB1 ARG 3 -10.881 -14.332 0.332
22 HG2 ARG 3 HG2 ARG 3 -10.085 -14.169 2.528
23 HG3 ARG 3 HG1 ARG 3 -11.552 -14.925 3.239
24 HD2 ARG 3 HD2 ARG 3 -10.850 -17.167 2.476
25 HD3 ARG 3 HD1 ARG 3 -9.450 -16.456 1.557
26 HE ARG 3 HE ARG 3 -8.290 -16.190 3.607
27 HH11 ARG 3 HH11 ARG 3 -11.730 -16.951 4.164
28 HH12 ARG 3 HH12 ARG 3 -11.552 -17.217 5.866
29 HH21 ARG 3 HH21 ARG 3 -8.053 -16.556 5.919
30 HH22 ARG 3 HH22 ARG 3 -9.427 -16.989 6.879
31 H LEU 4 HN LEU 4 -14.890 -12.835 2.375
32 HA LEU 4 HA LEU 4 -15.867 -15.517 2.982
33 HB2 LEU 4 HB2 LEU 4 -15.766 -13.105 4.856
34 HB3 LEU 4 HB1 LEU 4 -16.876 -14.499 5.127
35 HG LEU 4 HG LEU 4 -13.836 -14.719 4.823
36 HD11 LEU 4 HD11 LEU 4 -13.814 -15.173 7.298
37 HD12 LEU 4 HD12 LEU 4 -15.564 -14.734 7.374
38 HD13 LEU 4 HD13 LEU 4 -14.343 -13.495 6.892
39 HD21 LEU 4 HD21 LEU 4 -16.012 -16.684 4.728
40 HD22 LEU 4 HD22 LEU 4 -14.950 -17.006 6.160
41 HD23 LEU 4 HD23 LEU 4 -14.232 -16.920 4.504
42 H SER 5 HN SER 5 -18.195 -15.567 3.507
43 HA SER 5 HA SER 5 -19.593 -13.483 2.008
44 HB2 SER 5 HB2 SER 5 -19.263 -15.807 0.785
45 HB3 SER 5 HB1 SER 5 -20.401 -16.444 2.031
46 HG SER 5 HG SER 5 -20.842 -14.817 -0.152
47 H DPP 6 HN DPP 6 -22.186 -15.038 2.602
48 HA DPP 6 HA DPP 6 -22.443 -13.895 5.196
49 HB2 DPP 6 HB2 DPP 6 -24.429 -15.539 3.516
50 HB3 DPP 6 HB3 DPP 6 -24.502 -13.777 3.889
51 H PHE 7 HN PHE 7 -20.906 -14.932 6.405
52 HA PHE 7 HA PHE 7 -21.812 -17.568 7.333
53 HB2 PHE 7 HB2 PHE 7 -19.638 -18.351 6.657
54 HB3 PHE 7 HB1 PHE 7 -18.980 -16.660 6.575
55 HD1 PHE 7 HD1 PHE 7 -20.627 -18.348 9.500
56 HD2 PHE 7 HD2 PHE 7 -17.019 -16.807 7.836
57 HE1 PHE 7 HE1 PHE 7 -19.596 -18.418 11.717
58 HE2 PHE 7 HE2 PHE 7 -15.968 -16.962 10.055
59 HZ PHE 7 HZ PHE 7 -17.234 -17.790 11.978
60 H PHE 8 HN PHE 8 -19.275 -15.318 8.232
61 HA PHE 8 HA PHE 8 -20.071 -15.367 10.884
62 HB2 PHE 8 HB2 PHE 8 -18.059 -14.152 11.266
63 HB3 PHE 8 HB1 PHE 8 -17.714 -15.148 9.839
64 HD1 PHE 8 HD1 PHE 8 -17.518 -12.053 11.238
65 HD2 PHE 8 HD2 PHE 8 -18.306 -14.052 7.604
66 HE1 PHE 8 HE1 PHE 8 -17.010 -10.062 10.064
67 HE2 PHE 8 HE2 PHE 8 -17.774 -12.068 6.368
68 HZ PHE 8 HZ PHE 8 -17.111 -10.030 7.602
69 H ARG 9 HN ARG 9 -20.470 -12.804 8.327
70 HA ARG 9 HA ARG 9 -21.361 -11.097 10.331
71 HB2 ARG 9 HB2 ARG 9 -22.656 -9.865 8.396
72 HB3 ARG 9 HB1 ARG 9 -20.861 -9.893 8.356
73 HG2 ARG 9 HG2 ARG 9 -22.251 -12.183 6.977
74 HG3 ARG 9 HG1 ARG 9 -22.452 -10.561 6.228
75 HD2 ARG 9 HD2 ARG 9 -19.735 -10.519 6.722
76 HD3 ARG 9 HD1 ARG 9 -19.997 -12.301 6.470
77 HE ARG 9 HE ARG 9 -20.604 -11.869 4.207
78 HH11 ARG 9 HH11 ARG 9 -20.298 -8.853 6.085
79 HH12 ARG 9 HH12 ARG 9 -20.324 -7.811 4.702
80 HH21 ARG 9 HH21 ARG 9 -20.640 -10.450 2.332
81 HH22 ARG 9 HH22 ARG 9 -20.523 -8.735 2.534
82 H GLN 10 HN GLN 10 -22.850 -13.988 9.402
83 HA GLN 10 HA GLN 10 -25.110 -12.938 10.829
84 HB2 GLN 10 HB2 GLN 10 -26.805 -13.891 9.392
85 HB3 GLN 10 HB1 GLN 10 -25.778 -12.804 8.410
86 HG2 GLN 10 HG2 GLN 10 -24.939 -15.710 8.417
87 HG3 GLN 10 HG1 GLN 10 -26.523 -15.356 7.628
88 HE21 GLN 10 HE21 GLN 10 -25.564 -15.925 5.552
89 H PHE 11 HN PHE 11 -22.726 -14.535 11.315
90 HA PHE 11 HA PHE 11 -24.134 -16.851 12.378
91 HB2 PHE 11 HB2 PHE 11 -22.537 -17.686 10.656
92 HB3 PHE 11 HB1 PHE 11 -21.239 -16.720 11.433
93 HD1 PHE 11 HD1 PHE 11 -22.938 -19.799 11.314
94 HD2 PHE 11 HD2 PHE 11 -20.691 -17.206 13.826
95 HE1 PHE 11 HE1 PHE 11 -22.432 -21.695 12.798
96 HE2 PHE 11 HE2 PHE 11 -20.165 -19.116 15.308
97 HZ PHE 11 HZ PHE 11 -21.036 -21.355 14.793
98 H ILE 12 HN ILE 12 -21.275 -14.692 12.605
99 HA ILE 12 HA ILE 12 -21.142 -15.249 15.406
100 HB ILE 12 HB ILE 12 -19.748 -12.850 14.937
101 HG12 ILE 12 HG12 ILE 12 -18.124 -13.859 13.125
102 HG13 ILE 12 HG11 ILE 12 -19.674 -14.526 12.521
103 HG21 ILE 12 HG21 ILE 12 -18.723 -15.769 15.104
104 HG22 ILE 12 HG22 ILE 12 -19.015 -14.653 16.497
105 HG23 ILE 12 HG23 ILE 12 -17.695 -14.301 15.318
106 HD11 ILE 12 HD11 ILE 12 -19.077 -11.601 13.195
107 HD12 ILE 12 HD12 ILE 12 -20.710 -12.253 12.777
108 HD13 ILE 12 HD13 ILE 12 -19.385 -12.300 11.565
109 H LEU 13 HN LEU 13 -22.661 -13.395 13.211
110 HA LEU 13 HA LEU 13 -23.117 -11.246 15.014
111 HB2 LEU 13 HB2 LEU 13 -22.699 -11.805 12.246
112 HB3 LEU 13 HB1 LEU 13 -24.227 -10.832 12.447
113 HG LEU 13 HG LEU 13 -23.020 -9.062 13.626
114 HD11 LEU 13 HD11 LEU 13 -21.180 -9.487 14.895
115 HD12 LEU 13 HD12 LEU 13 -20.228 -9.881 13.413
116 HD13 LEU 13 HD13 LEU 13 -21.125 -11.184 14.279
117 HD21 LEU 13 HD21 LEU 13 -22.700 -9.523 10.954
118 HD22 LEU 13 HD22 LEU 13 -20.966 -9.589 11.457
119 HD23 LEU 13 HD23 LEU 13 -21.953 -8.117 11.800
120 H GLN 14 HN GLN 14 -24.295 -14.238 14.441
121 HA GLN 14 HA GLN 14 -26.875 -13.469 15.443
122 HB2 GLN 14 HB2 GLN 14 -26.504 -15.238 12.953
123 HB3 GLN 14 HB1 GLN 14 -28.031 -15.154 13.895
124 HG2 GLN 14 HG2 GLN 14 -26.729 -12.674 12.614
125 HG3 GLN 14 HG1 GLN 14 -27.951 -13.703 11.760
126 HE21 GLN 14 HE21 GLN 14 -27.636 -10.922 13.608
127 HE22 GLN 14 HE22 GLN 14 -29.211 -10.856 14.322
128 H ARG 15 HN ARG 15 -24.470 -14.372 16.484
129 HA ARG 15 HA ARG 15 -24.628 -17.224 16.716
130 HB2 ARG 15 HB2 ARG 15 -22.665 -15.148 17.086
131 HB3 ARG 15 HB1 ARG 15 -22.856 -15.995 18.664
132 HG2 ARG 15 HG2 ARG 15 -22.497 -18.216 17.473
133 HG3 ARG 15 HG1 ARG 15 -22.183 -17.318 15.942
134 HD2 ARG 15 HD2 ARG 15 -19.991 -17.306 16.586
135 HD3 ARG 15 HD1 ARG 15 -20.472 -16.041 17.801
136 HE ARG 15 HE ARG 15 -21.044 -18.588 18.958
137 HH11 ARG 15 HH11 ARG 15 -18.284 -16.681 17.763
138 HH12 ARG 15 HH12 ARG 15 -17.133 -17.371 18.858
139 HH21 ARG 15 HH21 ARG 15 -19.478 -19.527 20.451
140 HH22 ARG 15 HH22 ARG 15 -17.824 -19.016 20.411
141 H LYS 16 HN LYS 16 -26.737 -17.508 17.659
142 HA LYS 16 HA LYS 16 -27.219 -16.202 20.175
143 HB2 LYS 16 HB2 LYS 16 -29.363 -17.422 20.208
144 HB3 LYS 16 HB1 LYS 16 -29.129 -16.649 18.602
145 HG2 LYS 16 HG2 LYS 16 -28.314 -18.835 17.673
146 HG3 LYS 16 HG1 LYS 16 -28.576 -19.608 19.274
147 HD2 LYS 16 HD2 LYS 16 -31.014 -19.049 19.143
148 HD3 LYS 16 HD1 LYS 16 -30.751 -18.275 17.542
149 HE2 LYS 16 HE2 LYS 16 -29.998 -20.475 16.591
150 HE3 LYS 16 HE1 LYS 16 -30.253 -21.257 18.208
151 HZ1 LYS 16 HZ1 LYS 16 -32.559 -19.823 17.503
152 HZ2 LYS 16 HZ2 LYS 16 -32.350 -21.497 17.701
153 HZ3 LYS 16 HZ3 LYS 16 -32.104 -20.784 16.179
154 H LYS 17 HN LYS 17 -25.221 -18.701 19.228
155 HA LYS 17 HA LYS 17 -24.212 -20.325 20.345
156 HB2 LYS 17 HB2 LYS 17 -25.340 -18.715 22.636
157 HB3 LYS 17 HB1 LYS 17 -24.931 -20.423 23.015
158 HG2 LYS 17 HG2 LYS 17 -23.001 -19.067 23.544
159 HG3 LYS 17 HG1 LYS 17 -22.612 -20.027 22.075
160 HD2 LYS 17 HD2 LYS 17 -22.984 -18.086 20.626
161 HD3 LYS 17 HD1 LYS 17 -23.623 -17.118 21.997
162 HE2 LYS 17 HE2 LYS 17 -21.374 -17.184 23.107
163 HE3 LYS 17 HE1 LYS 17 -20.729 -18.186 21.740
164 HZ1 LYS 17 HZ1 LYS 17 -20.529 -15.590 21.807
165 HZ2 LYS 17 HZ2 LYS 17 -22.071 -15.664 21.097
166 HZ3 LYS 17 HZ3 LYS 17 -20.754 -16.438 20.351
Start of MODEL 3
1 H1 GLU 1 HT1 GLU 1 -10.769 -5.348 1.858
2 H2 GLU 1 HT2 GLU 1 -10.915 -6.210 3.315
3 H3 GLU 1 HT3 GLU 1 -12.180 -6.238 2.181
4 HA GLU 1 HA GLU 1 -10.980 -7.505 0.675
5 HB2 GLU 1 HB2 GLU 1 -8.801 -6.267 1.016
6 HB3 GLU 1 HB1 GLU 1 -8.581 -7.150 2.568
7 HG2 GLU 1 HG2 GLU 1 -8.473 -9.333 1.344
8 HG3 GLU 1 HG1 GLU 1 -8.746 -8.478 -0.226
9 H MET 2 HN MET 2 -12.476 -9.122 1.312
10 HA MET 2 HA MET 2 -11.412 -10.872 3.403
11 HB2 MET 2 HB2 MET 2 -14.355 -10.090 3.011
12 HB3 MET 2 HB1 MET 2 -13.793 -11.454 4.039
13 HG2 MET 2 HG2 MET 2 -12.412 -9.755 5.376
14 HG3 MET 2 HG1 MET 2 -13.229 -8.457 4.449
15 HE1 MET 2 HE1 MET 2 -16.732 -8.211 5.464
16 HE2 MET 2 HE2 MET 2 -16.386 -9.426 4.186
17 HE3 MET 2 HE3 MET 2 -15.405 -7.923 4.285
18 H ARG 3 HN ARG 3 -12.304 -13.115 3.188
19 HA ARG 3 HA ARG 3 -12.999 -13.585 0.390
20 HB2 ARG 3 HB2 ARG 3 -12.095 -15.963 0.841
21 HB3 ARG 3 HB1 ARG 3 -10.852 -14.668 0.747
22 HG2 ARG 3 HG2 ARG 3 -10.501 -14.635 3.094
23 HG3 ARG 3 HG1 ARG 3 -12.077 -15.423 3.445
24 HD2 ARG 3 HD2 ARG 3 -11.248 -17.586 2.547
25 HD3 ARG 3 HD1 ARG 3 -9.664 -16.815 2.086
26 HE ARG 3 HE ARG 3 -10.588 -17.492 4.838
27 HH11 ARG 3 HH11 ARG 3 -8.309 -15.737 2.729
28 HH12 ARG 3 HH12 ARG 3 -7.075 -15.585 3.935
29 HH21 ARG 3 HH21 ARG 3 -8.906 -17.287 6.469
30 HH22 ARG 3 HH22 ARG 3 -7.421 -16.482 6.095
31 H LEU 4 HN LEU 4 -14.801 -12.851 2.579
32 HA LEU 4 HA LEU 4 -16.163 -15.431 2.855
33 HB2 LEU 4 HB2 LEU 4 -16.093 -13.058 4.784
34 HB3 LEU 4 HB1 LEU 4 -17.288 -14.402 4.903
35 HG LEU 4 HG LEU 4 -14.245 -14.740 4.945
36 HD11 LEU 4 HD11 LEU 4 -14.634 -13.715 7.010
37 HD12 LEU 4 HD12 LEU 4 -14.862 -15.455 7.439
38 HD13 LEU 4 HD13 LEU 4 -16.298 -14.393 7.170
39 HD21 LEU 4 HD21 LEU 4 -16.504 -16.625 4.595
40 HD22 LEU 4 HD22 LEU 4 -15.504 -17.039 6.050
41 HD23 LEU 4 HD23 LEU 4 -14.720 -16.896 4.428
42 H SER 5 HN SER 5 -18.357 -15.501 2.642
43 HA SER 5 HA SER 5 -19.420 -13.247 1.141
44 HB2 SER 5 HB2 SER 5 -19.982 -16.234 1.344
45 HB3 SER 5 HB1 SER 5 -21.368 -15.141 0.910
46 HG SER 5 HG SER 5 -18.865 -14.982 -0.394
47 H DPP 6 HN DPP 6 -21.645 -15.489 2.747
48 HA DPP 6 HA DPP 6 -22.169 -13.304 4.577
49 HB2 DPP 6 HB2 DPP 6 -23.891 -15.838 4.560
50 HB3 DPP 6 HB3 DPP 6 -24.113 -14.612 3.261
51 H PHE 7 HN PHE 7 -23.152 -16.367 5.796
52 HA PHE 7 HA PHE 7 -22.344 -17.706 7.346
53 HB2 PHE 7 HB2 PHE 7 -20.247 -18.423 6.409
54 HB3 PHE 7 HB1 PHE 7 -19.626 -16.722 6.273
55 HD1 PHE 7 HD1 PHE 7 -21.069 -18.380 9.320
56 HD2 PHE 7 HD2 PHE 7 -17.607 -16.825 7.396
57 HE1 PHE 7 HE1 PHE 7 -19.892 -18.398 11.469
58 HE2 PHE 7 HE2 PHE 7 -16.393 -16.956 9.533
59 HZ PHE 7 HZ PHE 7 -17.522 -17.746 11.556
60 H PHE 8 HN PHE 8 -19.765 -15.405 7.901
61 HA PHE 8 HA PHE 8 -20.366 -15.376 10.590
62 HB2 PHE 8 HB2 PHE 8 -18.350 -14.129 10.840
63 HB3 PHE 8 HB1 PHE 8 -18.075 -15.123 9.384
64 HD1 PHE 8 HD1 PHE 8 -17.862 -12.011 10.757
65 HD2 PHE 8 HD2 PHE 8 -18.879 -14.054 7.219
66 HE1 PHE 8 HE1 PHE 8 -17.589 -9.996 9.544
67 HE2 PHE 8 HE2 PHE 8 -18.594 -12.052 5.930
68 HZ PHE 8 HZ PHE 8 -17.929 -9.981 7.104
69 H ARG 9 HN ARG 9 -20.820 -12.646 8.175
70 HA ARG 9 HA ARG 9 -21.677 -11.187 10.421
71 HB2 ARG 9 HB2 ARG 9 -22.170 -9.332 9.034
72 HB3 ARG 9 HB1 ARG 9 -20.767 -10.136 8.263
73 HG2 ARG 9 HG2 ARG 9 -23.697 -10.444 7.396
74 HG3 ARG 9 HG1 ARG 9 -22.475 -9.370 6.634
75 HD2 ARG 9 HD2 ARG 9 -21.139 -11.831 6.629
76 HD3 ARG 9 HD1 ARG 9 -22.865 -12.315 6.335
77 HE ARG 9 HE ARG 9 -21.144 -10.877 4.473
78 HH11 ARG 9 HH11 ARG 9 -24.502 -11.086 5.678
79 HH12 ARG 9 HH12 ARG 9 -25.225 -10.586 4.186
80 HH21 ARG 9 HH21 ARG 9 -22.135 -10.206 2.457
81 HH22 ARG 9 HH22 ARG 9 -23.858 -10.079 2.327
82 H GLN 10 HN GLN 10 -23.083 -13.874 9.543
83 HA GLN 10 HA GLN 10 -25.530 -12.846 10.614
84 HB2 GLN 10 HB2 GLN 10 -26.017 -15.012 8.618
85 HB3 GLN 10 HB1 GLN 10 -26.994 -13.551 8.958
86 HG2 GLN 10 HG2 GLN 10 -26.326 -12.756 6.927
87 HG3 GLN 10 HG1 GLN 10 -24.695 -12.523 7.653
88 HE21 GLN 10 HE21 GLN 10 -24.594 -12.914 5.043
89 H PHE 11 HN PHE 11 -22.960 -14.527 11.090
90 HA PHE 11 HA PHE 11 -24.418 -16.760 12.289
91 HB2 PHE 11 HB2 PHE 11 -22.941 -17.679 10.518
92 HB3 PHE 11 HB1 PHE 11 -21.570 -16.735 11.199
93 HD1 PHE 11 HD1 PHE 11 -23.414 -19.761 11.296
94 HD2 PHE 11 HD2 PHE 11 -20.855 -17.207 13.533
95 HE1 PHE 11 HE1 PHE 11 -22.870 -21.634 12.790
96 HE2 PHE 11 HE2 PHE 11 -20.292 -19.098 15.022
97 HZ PHE 11 HZ PHE 11 -21.299 -21.306 14.651
98 H ILE 12 HN ILE 12 -21.538 -14.631 12.382
99 HA ILE 12 HA ILE 12 -21.262 -15.243 15.174
100 HB ILE 12 HB ILE 12 -19.833 -12.883 14.665
101 HG12 ILE 12 HG12 ILE 12 -18.327 -13.847 12.746
102 HG13 ILE 12 HG11 ILE 12 -19.898 -14.537 12.222
103 HG21 ILE 12 HG21 ILE 12 -18.999 -15.847 14.866
104 HG22 ILE 12 HG22 ILE 12 -18.930 -14.576 16.151
105 HG23 ILE 12 HG23 ILE 12 -17.788 -14.513 14.756
106 HD11 ILE 12 HD11 ILE 12 -20.962 -12.290 12.530
107 HD12 ILE 12 HD12 ILE 12 -19.667 -12.284 11.278
108 HD13 ILE 12 HD13 ILE 12 -19.334 -11.607 12.911
109 H LEU 13 HN LEU 13 -23.050 -13.538 13.150
110 HA LEU 13 HA LEU 13 -23.362 -11.310 14.907
111 HB2 LEU 13 HB2 LEU 13 -23.099 -11.893 12.137
112 HB3 LEU 13 HB1 LEU 13 -24.673 -11.007 12.405
113 HG LEU 13 HG LEU 13 -23.425 -9.223 13.654
114 HD11 LEU 13 HD11 LEU 13 -21.423 -11.164 13.998
115 HD12 LEU 13 HD12 LEU 13 -21.225 -9.394 14.303
116 HD13 LEU 13 HD13 LEU 13 -20.710 -10.099 12.724
117 HD21 LEU 13 HD21 LEU 13 -22.875 -8.062 11.742
118 HD22 LEU 13 HD22 LEU 13 -23.602 -9.494 10.927
119 HD23 LEU 13 HD23 LEU 13 -21.811 -9.375 11.110
120 H GLN 14 HN GLN 14 -24.510 -14.336 14.426
121 HA GLN 14 HA GLN 14 -26.976 -13.637 15.698
122 HB2 GLN 14 HB2 GLN 14 -26.895 -15.361 13.148
123 HB3 GLN 14 HB1 GLN 14 -28.300 -15.283 14.269
124 HG2 GLN 14 HG2 GLN 14 -28.525 -12.814 13.808
125 HG3 GLN 14 HG1 GLN 14 -27.152 -12.925 12.636
126 HE21 GLN 14 HE21 GLN 14 -28.260 -12.552 10.705
127 HE22 GLN 14 HE22 GLN 14 -29.505 -13.584 10.089
128 H ARG 15 HN ARG 15 -24.588 -14.415 16.597
129 HA ARG 15 HA ARG 15 -24.568 -17.289 16.723
130 HB2 ARG 15 HB2 ARG 15 -22.640 -15.190 16.839
131 HB3 ARG 15 HB1 ARG 15 -22.657 -15.941 18.477
132 HG2 ARG 15 HG2 ARG 15 -22.444 -18.234 17.328
133 HG3 ARG 15 HG1 ARG 15 -22.164 -17.353 15.773
134 HD2 ARG 15 HD2 ARG 15 -19.951 -17.699 16.533
135 HD3 ARG 15 HD1 ARG 15 -20.305 -16.046 17.205
136 HE ARG 15 HE ARG 15 -21.120 -18.049 19.120
137 HH11 ARG 15 HH11 ARG 15 -18.242 -16.597 17.603
138 HH12 ARG 15 HH12 ARG 15 -17.206 -16.853 18.966
139 HH21 ARG 15 HH21 ARG 15 -19.716 -18.398 20.972
140 HH22 ARG 15 HH22 ARG 15 -18.058 -17.896 20.915
141 H LYS 16 HN LYS 16 -26.441 -17.789 17.927
142 HA LYS 16 HA LYS 16 -27.080 -16.500 20.323
143 HB2 LYS 16 HB2 LYS 16 -27.644 -19.372 19.398
144 HB3 LYS 16 HB1 LYS 16 -28.354 -18.639 20.882
145 HG2 LYS 16 HG2 LYS 16 -29.433 -16.866 19.487
146 HG3 LYS 16 HG1 LYS 16 -28.732 -17.613 18.008
147 HD2 LYS 16 HD2 LYS 16 -29.996 -19.721 18.468
148 HD3 LYS 16 HD1 LYS 16 -30.686 -18.989 19.958
149 HE2 LYS 16 HE2 LYS 16 -31.827 -17.229 18.574
150 HE3 LYS 16 HE1 LYS 16 -31.123 -17.960 17.070
151 HZ1 LYS 16 HZ1 LYS 16 -32.288 -20.047 18.387
152 HZ2 LYS 16 HZ2 LYS 16 -32.915 -19.201 17.056
153 HZ3 LYS 16 HZ3 LYS 16 -33.373 -18.766 18.632
154 H LYS 17 HN LYS 17 -24.945 -19.208 19.456
155 HA LYS 17 HA LYS 17 -23.962 -19.104 22.223
156 HB2 LYS 17 HB2 LYS 17 -25.011 -21.473 20.704
157 HB3 LYS 17 HB1 LYS 17 -23.393 -21.722 21.445
158 HG2 LYS 17 HG2 LYS 17 -24.981 -22.481 23.069
159 HG3 LYS 17 HG1 LYS 17 -24.387 -20.892 23.663
160 HD2 LYS 17 HD2 LYS 17 -26.432 -19.770 22.825
161 HD3 LYS 17 HD1 LYS 17 -27.007 -21.306 22.089
162 HE2 LYS 17 HE2 LYS 17 -27.163 -22.347 24.373
163 HE3 LYS 17 HE1 LYS 17 -26.577 -20.799 25.113
164 HZ1 LYS 17 HZ1 LYS 17 -28.503 -19.720 24.025
165 HZ2 LYS 17 HZ2 LYS 17 -28.912 -20.860 25.214
166 HZ3 LYS 17 HZ3 LYS 17 -29.076 -21.253 23.571
Start of MODEL 4
1 H1 GLU 1 HT1 GLU 1 -10.690 -8.520 -3.072
2 H2 GLU 1 HT2 GLU 1 -10.375 -9.527 -4.402
3 H3 GLU 1 HT3 GLU 1 -9.983 -10.048 -2.834
4 HA GLU 1 HA GLU 1 -12.739 -9.374 -3.592
5 HB2 GLU 1 HB2 GLU 1 -13.130 -11.833 -4.007
6 HB3 GLU 1 HB1 GLU 1 -12.026 -11.083 -5.214
7 HG2 GLU 1 HG2 GLU 1 -10.035 -11.967 -3.879
8 HG3 GLU 1 HG1 GLU 1 -11.200 -12.830 -2.797
9 H MET 2 HN MET 2 -10.715 -9.382 -1.132
10 HA MET 2 HA MET 2 -10.933 -9.671 1.059
11 HB2 MET 2 HB2 MET 2 -13.767 -10.766 0.615
12 HB3 MET 2 HB1 MET 2 -13.079 -10.149 2.152
13 HG2 MET 2 HG2 MET 2 -13.650 -8.491 -0.376
14 HG3 MET 2 HG1 MET 2 -14.625 -8.507 1.125
15 HE1 MET 2 HE1 MET 2 -14.047 -7.992 3.224
16 HE2 MET 2 HE2 MET 2 -12.951 -6.670 3.755
17 HE3 MET 2 HE3 MET 2 -12.328 -8.350 3.611
18 H ARG 3 HN ARG 3 -11.948 -11.621 2.711
19 HA ARG 3 HA ARG 3 -11.454 -14.129 1.362
20 HB2 ARG 3 HB2 ARG 3 -9.990 -14.877 3.322
21 HB3 ARG 3 HB1 ARG 3 -9.213 -13.686 2.225
22 HG2 ARG 3 HG2 ARG 3 -9.796 -11.837 3.802
23 HG3 ARG 3 HG1 ARG 3 -10.592 -13.017 4.898
24 HD2 ARG 3 HD2 ARG 3 -8.328 -12.537 5.762
25 HD3 ARG 3 HD1 ARG 3 -8.325 -14.232 5.099
26 HE ARG 3 HE ARG 3 -7.554 -12.354 3.027
27 HH11 ARG 3 HH11 ARG 3 -6.456 -13.893 6.045
28 HH12 ARG 3 HH12 ARG 3 -4.773 -13.834 5.645
29 HH21 ARG 3 HH21 ARG 3 -5.264 -12.273 2.480
30 HH22 ARG 3 HH22 ARG 3 -4.083 -12.896 3.583
31 H LEU 4 HN LEU 4 -13.757 -12.567 2.511
32 HA LEU 4 HA LEU 4 -14.893 -14.704 3.948
33 HB2 LEU 4 HB2 LEU 4 -15.350 -13.525 6.093
34 HB3 LEU 4 HB1 LEU 4 -13.580 -13.747 5.867
35 HG LEU 4 HG LEU 4 -13.971 -11.301 4.629
36 HD11 LEU 4 HD11 LEU 4 -16.262 -10.939 5.205
37 HD12 LEU 4 HD12 LEU 4 -15.325 -9.953 6.399
38 HD13 LEU 4 HD13 LEU 4 -16.029 -11.541 6.891
39 HD21 LEU 4 HD21 LEU 4 -12.155 -11.859 6.214
40 HD22 LEU 4 HD22 LEU 4 -13.315 -11.815 7.597
41 HD23 LEU 4 HD23 LEU 4 -12.944 -10.305 6.682
42 H SER 5 HN SER 5 -17.210 -13.966 4.701
43 HA SER 5 HA SER 5 -18.103 -11.503 3.665
44 HB2 SER 5 HB2 SER 5 -17.911 -12.714 1.460
45 HB3 SER 5 HB1 SER 5 -18.966 -14.025 2.111
46 HG SER 5 HG SER 5 -19.758 -11.963 0.861
47 H DPP 6 HN DPP 6 -20.231 -14.381 3.378
48 HA DPP 6 HA DPP 6 -21.555 -13.337 5.709
49 HB2 DPP 6 HB2 DPP 6 -22.306 -15.616 3.784
50 HB3 DPP 6 HB3 DPP 6 -23.165 -14.050 4.026
51 H PHE 7 HN PHE 7 -20.187 -13.682 7.382
52 HA PHE 7 HA PHE 7 -20.070 -16.491 8.225
53 HB2 PHE 7 HB2 PHE 7 -17.679 -16.275 8.101
54 HB3 PHE 7 HB1 PHE 7 -17.774 -14.462 8.097
55 HD1 PHE 7 HD1 PHE 7 -19.223 -16.812 10.641
56 HD2 PHE 7 HD2 PHE 7 -16.258 -13.878 9.767
57 HE1 PHE 7 HE1 PHE 7 -18.786 -16.574 13.039
58 HE2 PHE 7 HE2 PHE 7 -15.762 -13.714 12.175
59 HZ PHE 7 HZ PHE 7 -16.993 -15.072 13.797
60 H PHE 8 HN PHE 8 -18.938 -13.476 9.611
61 HA PHE 8 HA PHE 8 -20.300 -13.975 11.971
62 HB2 PHE 8 HB2 PHE 8 -19.062 -12.135 12.804
63 HB3 PHE 8 HB1 PHE 8 -18.030 -12.817 11.543
64 HD1 PHE 8 HD1 PHE 8 -19.285 -9.970 12.881
65 HD2 PHE 8 HD2 PHE 8 -18.497 -11.875 9.198
66 HE1 PHE 8 HE1 PHE 8 -19.231 -7.843 11.815
67 HE2 PHE 8 HE2 PHE 8 -18.428 -9.756 8.104
68 HZ PHE 8 HZ PHE 8 -18.771 -7.705 9.392
69 H ARG 9 HN ARG 9 -21.023 -11.776 9.203
70 HA ARG 9 HA ARG 9 -22.942 -10.533 10.783
71 HB2 ARG 9 HB2 ARG 9 -23.011 -10.884 7.739
72 HB3 ARG 9 HB1 ARG 9 -24.049 -9.751 8.672
73 HG2 ARG 9 HG2 ARG 9 -22.468 -8.187 8.347
74 HG3 ARG 9 HG1 ARG 9 -21.410 -9.119 9.472
75 HD2 ARG 9 HD2 ARG 9 -20.327 -10.290 7.686
76 HD3 ARG 9 HD1 ARG 9 -21.622 -9.840 6.496
77 HE ARG 9 HE ARG 9 -20.410 -7.431 7.555
78 HH11 ARG 9 HH11 ARG 9 -19.794 -10.219 5.426
79 HH12 ARG 9 HH12 ARG 9 -18.704 -9.370 4.379
80 HH21 ARG 9 HH21 ARG 9 -18.925 -6.281 6.135
81 HH22 ARG 9 HH22 ARG 9 -18.199 -7.096 4.791
82 H GLN 10 HN GLN 10 -22.908 -13.785 9.772
83 HA GLN 10 HA GLN 10 -25.678 -13.763 10.560
84 HB2 GLN 10 HB2 GLN 10 -26.402 -15.324 8.840
85 HB3 GLN 10 HB1 GLN 10 -25.721 -13.865 8.055
86 HG2 GLN 10 HG2 GLN 10 -23.756 -16.117 8.498
87 HG3 GLN 10 HG1 GLN 10 -25.086 -16.467 7.330
88 HE21 GLN 10 HE21 GLN 10 -23.611 -16.486 5.547
89 H PHE 11 HN PHE 11 -23.019 -14.285 11.691
90 HA PHE 11 HA PHE 11 -23.607 -17.001 12.553
91 HB2 PHE 11 HB2 PHE 11 -21.454 -17.053 11.302
92 HB3 PHE 11 HB1 PHE 11 -20.875 -15.682 12.301
93 HD1 PHE 11 HD1 PHE 11 -21.120 -19.172 11.969
94 HD2 PHE 11 HD2 PHE 11 -20.758 -15.995 14.772
95 HE1 PHE 11 HE1 PHE 11 -20.255 -20.762 13.639
96 HE2 PHE 11 HE2 PHE 11 -19.867 -17.590 16.445
97 HZ PHE 11 HZ PHE 11 -19.619 -19.967 15.877
98 H ILE 12 HN ILE 12 -22.042 -13.862 13.309
99 HA ILE 12 HA ILE 12 -22.385 -14.435 16.093
100 HB ILE 12 HB ILE 12 -22.003 -11.661 15.805
101 HG12 ILE 12 HG12 ILE 12 -19.692 -11.894 14.548
102 HG13 ILE 12 HG11 ILE 12 -20.654 -13.090 13.622
103 HG21 ILE 12 HG21 ILE 12 -20.056 -13.965 16.499
104 HG22 ILE 12 HG22 ILE 12 -21.026 -12.964 17.652
105 HG23 ILE 12 HG23 ILE 12 -19.661 -12.220 16.737
106 HD11 ILE 12 HD11 ILE 12 -21.002 -10.895 12.607
107 HD12 ILE 12 HD12 ILE 12 -21.415 -10.182 14.206
108 HD13 ILE 12 HD13 ILE 12 -22.510 -11.402 13.443
109 H LEU 13 HN LEU 13 -23.893 -13.224 13.468
110 HA LEU 13 HA LEU 13 -25.589 -11.504 14.949
111 HB2 LEU 13 HB2 LEU 13 -24.351 -11.813 12.398
112 HB3 LEU 13 HB1 LEU 13 -26.139 -11.520 12.181
113 HG LEU 13 HG LEU 13 -26.018 -9.432 13.440
114 HD11 LEU 13 HD11 LEU 13 -23.684 -10.656 14.702
115 HD12 LEU 13 HD12 LEU 13 -24.538 -9.130 15.143
116 HD13 LEU 13 HD13 LEU 13 -23.172 -9.090 13.966
117 HD21 LEU 13 HD21 LEU 13 -24.871 -9.695 10.966
118 HD22 LEU 13 HD22 LEU 13 -23.445 -9.069 11.882
119 HD23 LEU 13 HD23 LEU 13 -24.982 -8.121 11.840
120 H GLN 14 HN GLN 14 -25.321 -14.697 14.402
121 HA GLN 14 HA GLN 14 -28.100 -15.084 14.883
122 HB2 GLN 14 HB2 GLN 14 -26.724 -16.395 12.460
123 HB3 GLN 14 HB1 GLN 14 -28.272 -16.976 13.170
124 HG2 GLN 14 HG2 GLN 14 -29.321 -14.724 12.672
125 HG3 GLN 14 HG1 GLN 14 -27.780 -14.215 11.872
126 HE21 GLN 14 HE21 GLN 14 -28.567 -14.079 9.744
127 HE22 GLN 14 HE22 GLN 14 -29.117 -15.448 8.839
128 H ARG 15 HN ARG 15 -25.980 -15.012 16.462
129 HA ARG 15 HA ARG 15 -24.852 -17.658 16.600
130 HB2 ARG 15 HB2 ARG 15 -24.021 -15.025 17.302
131 HB3 ARG 15 HB1 ARG 15 -24.231 -15.902 18.861
132 HG2 ARG 15 HG2 ARG 15 -22.795 -17.801 17.900
133 HG3 ARG 15 HG1 ARG 15 -22.451 -16.747 16.475
134 HD2 ARG 15 HD2 ARG 15 -20.615 -16.191 17.806
135 HD3 ARG 15 HD1 ARG 15 -21.805 -14.973 18.446
136 HE ARG 15 HE ARG 15 -22.139 -17.377 19.957
137 HH11 ARG 15 HH11 ARG 15 -19.700 -14.866 19.304
138 HH12 ARG 15 HH12 ARG 15 -18.938 -14.986 20.854
139 HH21 ARG 15 HH21 ARG 15 -21.109 -17.545 22.060
140 HH22 ARG 15 HH22 ARG 15 -19.754 -16.537 22.451
141 H LYS 16 HN LYS 16 -26.587 -18.994 17.179
142 HA LYS 16 HA LYS 16 -28.383 -18.363 19.219
143 HB2 LYS 16 HB2 LYS 16 -27.370 -21.091 18.241
144 HB3 LYS 16 HB1 LYS 16 -28.734 -20.883 19.397
145 HG2 LYS 16 HG2 LYS 16 -29.987 -19.564 17.681
146 HG3 LYS 16 HG1 LYS 16 -28.625 -19.785 16.528
147 HD2 LYS 16 HD2 LYS 16 -28.945 -22.264 16.616
148 HD3 LYS 16 HD1 LYS 16 -30.298 -22.052 17.782
149 HE2 LYS 16 HE2 LYS 16 -31.596 -20.771 16.054
150 HE3 LYS 16 HE1 LYS 16 -30.230 -20.976 14.880
151 HZ1 LYS 16 HZ1 LYS 16 -30.876 -23.477 15.957
152 HZ2 LYS 16 HZ2 LYS 16 -31.049 -22.918 14.363
153 HZ3 LYS 16 HZ3 LYS 16 -32.321 -22.730 15.471
154 H LYS 17 HN LYS 17 -25.152 -19.857 19.148
155 HA LYS 17 HA LYS 17 -25.045 -19.448 22.025
156 HB2 LYS 17 HB2 LYS 17 -25.014 -22.133 20.665
157 HB3 LYS 17 HB1 LYS 17 -23.672 -21.852 21.829
158 HG2 LYS 17 HG2 LYS 17 -25.192 -22.681 23.333
159 HG3 LYS 17 HG1 LYS 17 -25.742 -20.970 23.370
160 HD2 LYS 17 HD2 LYS 17 -27.470 -21.503 21.616
161 HD3 LYS 17 HD1 LYS 17 -26.934 -23.220 21.628
162 HE2 LYS 17 HE2 LYS 17 -27.991 -21.745 24.132
163 HE3 LYS 17 HE1 LYS 17 -29.018 -22.764 23.038
164 HZ1 LYS 17 HZ1 LYS 17 -27.286 -23.547 25.115
165 HZ2 LYS 17 HZ2 LYS 17 -26.745 -24.234 23.660
166 HZ3 LYS 17 HZ3 LYS 17 -28.343 -24.487 24.175
Start of MODEL 5
1 H1 GLU 1 HT1 GLU 1 -8.201 -7.791 1.638
2 H2 GLU 1 HT2 GLU 1 -8.597 -8.179 3.244
3 H3 GLU 1 HT3 GLU 1 -8.515 -6.554 2.758
4 HA GLU 1 HA GLU 1 -10.711 -6.764 2.642
5 HB2 GLU 1 HB2 GLU 1 -9.870 -6.395 0.290
6 HB3 GLU 1 HB1 GLU 1 -9.885 -8.176 0.039
7 HG2 GLU 1 HG2 GLU 1 -12.369 -8.231 0.366
8 HG3 GLU 1 HG1 GLU 1 -12.375 -6.449 0.678
9 H MET 2 HN MET 2 -9.156 -9.915 1.846
10 HA MET 2 HA MET 2 -9.714 -11.992 2.406
11 HB2 MET 2 HB2 MET 2 -12.047 -10.860 4.054
12 HB3 MET 2 HB1 MET 2 -11.418 -12.537 4.119
13 HG2 MET 2 HG2 MET 2 -9.201 -11.658 4.935
14 HG3 MET 2 HG1 MET 2 -9.889 -10.003 4.953
15 HE1 MET 2 HE1 MET 2 -11.695 -9.225 5.976
16 HE2 MET 2 HE2 MET 2 -12.163 -9.565 7.678
17 HE3 MET 2 HE3 MET 2 -13.005 -10.405 6.331
18 H ARG 3 HN ARG 3 -11.937 -13.499 2.478
19 HA ARG 3 HA ARG 3 -13.746 -12.401 0.512
20 HB2 ARG 3 HB2 ARG 3 -12.046 -13.826 -0.751
21 HB3 ARG 3 HB1 ARG 3 -12.473 -15.194 0.339
22 HG2 ARG 3 HG2 ARG 3 -14.797 -13.875 -1.026
23 HG3 ARG 3 HG1 ARG 3 -13.643 -14.713 -2.119
24 HD2 ARG 3 HD2 ARG 3 -13.908 -16.837 -0.815
25 HD3 ARG 3 HD1 ARG 3 -15.035 -15.994 0.340
26 HE ARG 3 HE ARG 3 -15.948 -15.674 -2.405
27 HH11 ARG 3 HH11 ARG 3 -15.651 -17.986 0.290
28 HH12 ARG 3 HH12 ARG 3 -17.032 -18.929 -0.161
29 HH21 ARG 3 HH21 ARG 3 -17.828 -16.955 -3.021
30 HH22 ARG 3 HH22 ARG 3 -18.290 -18.331 -2.078
31 H LEU 4 HN LEU 4 -15.704 -12.489 1.597
32 HA LEU 4 HA LEU 4 -16.300 -15.039 2.793
33 HB2 LEU 4 HB2 LEU 4 -16.242 -12.417 4.356
34 HB3 LEU 4 HB1 LEU 4 -17.365 -13.749 4.819
35 HG LEU 4 HG LEU 4 -14.335 -14.015 4.511
36 HD11 LEU 4 HD11 LEU 4 -14.538 -12.720 6.472
37 HD12 LEU 4 HD12 LEU 4 -14.534 -14.405 7.116
38 HD13 LEU 4 HD13 LEU 4 -16.086 -13.503 6.965
39 HD21 LEU 4 HD21 LEU 4 -14.816 -16.222 4.296
40 HD22 LEU 4 HD22 LEU 4 -16.545 -15.987 4.768
41 HD23 LEU 4 HD23 LEU 4 -15.275 -16.189 6.042
42 H SER 5 HN SER 5 -18.639 -15.120 3.513
43 HA SER 5 HA SER 5 -20.253 -13.332 1.878
44 HB2 SER 5 HB2 SER 5 -19.711 -15.628 0.690
45 HB3 SER 5 HB1 SER 5 -20.729 -16.366 1.984
46 HG SER 5 HG SER 5 -21.414 -14.742 -0.171
47 H DPP 6 HN DPP 6 -22.606 -15.262 2.581
48 HA DPP 6 HA DPP 6 -22.995 -14.042 5.130
49 HB2 DPP 6 HB2 DPP 6 -24.755 -15.998 3.532
50 HB3 DPP 6 HB3 DPP 6 -25.076 -14.259 3.878
51 H PHE 7 HN PHE 7 -21.265 -14.821 6.293
52 HA PHE 7 HA PHE 7 -21.765 -17.519 7.353
53 HB2 PHE 7 HB2 PHE 7 -19.510 -17.985 6.659
54 HB3 PHE 7 HB1 PHE 7 -19.135 -16.219 6.471
55 HD1 PHE 7 HD1 PHE 7 -20.388 -18.037 9.511
56 HD2 PHE 7 HD2 PHE 7 -17.186 -15.916 7.673
57 HE1 PHE 7 HE1 PHE 7 -19.300 -17.828 11.691
58 HE2 PHE 7 HE2 PHE 7 -16.056 -15.794 9.858
59 HZ PHE 7 HZ PHE 7 -17.088 -16.768 11.851
60 H PHE 8 HN PHE 8 -19.592 -14.865 8.099
61 HA PHE 8 HA PHE 8 -20.338 -14.890 10.770
62 HB2 PHE 8 HB2 PHE 8 -18.519 -13.390 11.048
63 HB3 PHE 8 HB1 PHE 8 -18.056 -14.386 9.670
64 HD1 PHE 8 HD1 PHE 8 -18.224 -11.246 10.924
65 HD2 PHE 8 HD2 PHE 8 -18.849 -13.486 7.400
66 HE1 PHE 8 HE1 PHE 8 -17.937 -9.265 9.644
67 HE2 PHE 8 HE2 PHE 8 -18.555 -11.518 6.070
68 HZ PHE 8 HZ PHE 8 -18.079 -9.363 7.189
69 H ARG 9 HN ARG 9 -21.204 -12.763 8.022
70 HA ARG 9 HA ARG 9 -22.257 -10.907 9.788
71 HB2 ARG 9 HB2 ARG 9 -22.885 -11.556 6.872
72 HB3 ARG 9 HB1 ARG 9 -23.849 -10.321 7.752
73 HG2 ARG 9 HG2 ARG 9 -22.284 -8.800 7.209
74 HG3 ARG 9 HG1 ARG 9 -21.131 -9.668 8.284
75 HD2 ARG 9 HD2 ARG 9 -20.028 -9.583 6.147
76 HD3 ARG 9 HD1 ARG 9 -20.718 -11.270 6.226
77 HE ARG 9 HE ARG 9 -22.676 -9.523 5.029
78 HH11 ARG 9 HH11 ARG 9 -19.452 -10.914 4.428
79 HH12 ARG 9 HH12 ARG 9 -19.621 -10.957 2.705
80 HH21 ARG 9 HH21 ARG 9 -22.908 -9.578 2.689
81 HH22 ARG 9 HH22 ARG 9 -21.622 -10.183 1.699
82 H GLN 10 HN GLN 10 -23.340 -14.117 9.225
83 HA GLN 10 HA GLN 10 -25.648 -13.291 10.736
84 HB2 GLN 10 HB2 GLN 10 -27.207 -14.680 9.470
85 HB3 GLN 10 HB1 GLN 10 -26.475 -13.444 8.401
86 HG2 GLN 10 HG2 GLN 10 -25.090 -16.143 8.463
87 HG3 GLN 10 HG1 GLN 10 -26.723 -16.094 7.697
88 HE21 GLN 10 HE21 GLN 10 -25.789 -16.503 5.599
89 H PHE 11 HN PHE 11 -23.023 -14.468 11.213
90 HA PHE 11 HA PHE 11 -24.013 -16.887 12.494
91 HB2 PHE 11 HB2 PHE 11 -22.377 -17.577 10.747
92 HB3 PHE 11 HB1 PHE 11 -21.216 -16.378 11.403
93 HD1 PHE 11 HD1 PHE 11 -22.407 -19.680 11.534
94 HD2 PHE 11 HD2 PHE 11 -20.515 -16.613 13.789
95 HE1 PHE 11 HE1 PHE 11 -21.546 -21.378 13.092
96 HE2 PHE 11 HE2 PHE 11 -19.628 -18.324 15.345
97 HZ PHE 11 HZ PHE 11 -20.147 -20.701 14.995
98 H ILE 12 HN ILE 12 -21.566 -14.262 12.468
99 HA ILE 12 HA ILE 12 -21.230 -14.605 15.288
100 HB ILE 12 HB ILE 12 -20.356 -12.010 14.599
101 HG12 ILE 12 HG12 ILE 12 -18.593 -12.867 12.824
102 HG13 ILE 12 HG11 ILE 12 -20.024 -13.822 12.320
103 HG21 ILE 12 HG21 ILE 12 -18.830 -14.669 15.022
104 HG22 ILE 12 HG22 ILE 12 -19.209 -13.413 16.268
105 HG23 ILE 12 HG23 ILE 12 -18.026 -13.054 14.954
106 HD11 ILE 12 HD11 ILE 12 -19.899 -10.790 12.745
107 HD12 ILE 12 HD12 ILE 12 -21.415 -11.728 12.445
108 HD13 ILE 12 HD13 ILE 12 -20.131 -11.664 11.187
109 H LEU 13 HN LEU 13 -23.114 -13.184 13.044
110 HA LEU 13 HA LEU 13 -23.899 -11.051 14.733
111 HB2 LEU 13 HB2 LEU 13 -23.510 -11.734 11.982
112 HB3 LEU 13 HB1 LEU 13 -25.149 -10.970 12.217
113 HG LEU 13 HG LEU 13 -24.216 -8.934 13.027
114 HD11 LEU 13 HD11 LEU 13 -22.668 -9.255 14.714
115 HD12 LEU 13 HD12 LEU 13 -21.464 -9.027 13.390
116 HD13 LEU 13 HD13 LEU 13 -21.913 -10.690 13.923
117 HD21 LEU 13 HD21 LEU 13 -21.914 -9.668 11.144
118 HD22 LEU 13 HD22 LEU 13 -22.851 -8.130 11.271
119 HD23 LEU 13 HD23 LEU 13 -23.612 -9.587 10.526
120 H GLN 14 HN GLN 14 -24.504 -14.214 14.512
121 HA GLN 14 HA GLN 14 -27.082 -13.872 15.662
122 HB2 GLN 14 HB2 GLN 14 -26.687 -15.652 13.184
123 HB3 GLN 14 HB1 GLN 14 -28.111 -15.754 14.280
124 HG2 GLN 14 HG2 GLN 14 -28.670 -13.339 13.731
125 HG3 GLN 14 HG1 GLN 14 -27.301 -13.325 12.548
126 HE21 GLN 14 HE21 GLN 14 -28.828 -12.967 10.799
127 HE22 GLN 14 HE22 GLN 14 -29.792 -14.262 10.173
128 H ARG 15 HN ARG 15 -24.579 -14.271 16.611
129 HA ARG 15 HA ARG 15 -24.147 -17.106 16.841
130 HB2 ARG 15 HB2 ARG 15 -22.563 -14.721 17.001
131 HB3 ARG 15 HB1 ARG 15 -22.510 -15.483 18.630
132 HG2 ARG 15 HG2 ARG 15 -21.850 -17.688 17.519
133 HG3 ARG 15 HG1 ARG 15 -21.755 -16.821 15.941
134 HD2 ARG 15 HD2 ARG 15 -19.521 -16.650 16.601
135 HD3 ARG 15 HD1 ARG 15 -20.167 -15.153 17.406
136 HE ARG 15 HE ARG 15 -20.508 -17.296 19.253
137 HH11 ARG 15 HH11 ARG 15 -17.909 -15.572 17.533
138 HH12 ARG 15 HH12 ARG 15 -16.723 -15.796 18.775
139 HH21 ARG 15 HH21 ARG 15 -18.898 -17.600 20.951
140 HH22 ARG 15 HH22 ARG 15 -17.296 -16.972 20.755
141 H LYS 16 HN LYS 16 -26.054 -17.780 17.978
142 HA LYS 16 HA LYS 16 -26.469 -16.516 20.561
143 HB2 LYS 16 HB2 LYS 16 -27.912 -18.903 19.263
144 HB3 LYS 16 HB1 LYS 16 -28.429 -18.038 20.756
145 HG2 LYS 16 HG2 LYS 16 -28.759 -15.946 19.450
146 HG3 LYS 16 HG1 LYS 16 -28.204 -16.781 17.959
147 HD2 LYS 16 HD2 LYS 16 -30.617 -16.746 17.880
148 HD3 LYS 16 HD1 LYS 16 -30.137 -18.434 18.265
149 HE2 LYS 16 HE2 LYS 16 -30.659 -18.065 20.678
150 HE3 LYS 16 HE1 LYS 16 -31.066 -16.330 20.338
151 HZ1 LYS 16 HZ1 LYS 16 -32.696 -18.578 20.146
152 HZ2 LYS 16 HZ2 LYS 16 -32.485 -17.987 18.569
153 HZ3 LYS 16 HZ3 LYS 16 -33.069 -16.960 19.789
154 H LYS 17 HN LYS 17 -24.462 -18.810 19.168
155 HA LYS 17 HA LYS 17 -23.143 -20.384 20.030
156 HB2 LYS 17 HB2 LYS 17 -24.054 -19.411 22.804
157 HB3 LYS 17 HB1 LYS 17 -22.596 -20.402 22.448
158 HG2 LYS 17 HG2 LYS 17 -21.386 -18.607 21.612
159 HG3 LYS 17 HG1 LYS 17 -22.841 -17.750 20.999
160 HD2 LYS 17 HD2 LYS 17 -21.892 -16.492 22.867
161 HD3 LYS 17 HD1 LYS 17 -23.481 -17.177 23.357
162 HE2 LYS 17 HE2 LYS 17 -22.325 -19.015 24.605
163 HE3 LYS 17 HE1 LYS 17 -20.714 -18.378 24.070
164 HZ1 LYS 17 HZ1 LYS 17 -22.308 -17.588 26.235
165 HZ2 LYS 17 HZ2 LYS 17 -22.164 -16.269 25.177
166 HZ3 LYS 17 HZ3 LYS 17 -20.771 -17.034 25.773
Start of MODEL 6
1 H1 GLU 1 HT1 GLU 1 -16.167 -10.671 0.629
2 H2 GLU 1 HT2 GLU 1 -15.392 -10.925 -0.861
3 H3 GLU 1 HT3 GLU 1 -16.654 -9.795 -0.741
4 HA GLU 1 HA GLU 1 -14.970 -8.365 -0.647
5 HB2 GLU 1 HB2 GLU 1 -15.178 -9.459 2.214
6 HB3 GLU 1 HB1 GLU 1 -14.268 -7.960 1.809
7 HG2 GLU 1 HG2 GLU 1 -16.340 -6.878 0.949
8 HG3 GLU 1 HG1 GLU 1 -17.279 -8.395 1.243
9 H MET 2 HN MET 2 -13.865 -11.221 1.353
10 HA MET 2 HA MET 2 -11.387 -11.093 -0.163
11 HB2 MET 2 HB2 MET 2 -11.516 -11.061 2.913
12 HB3 MET 2 HB1 MET 2 -10.037 -11.474 1.964
13 HG2 MET 2 HG2 MET 2 -10.011 -9.225 0.947
14 HG3 MET 2 HG1 MET 2 -11.539 -8.796 1.777
15 HE1 MET 2 HE1 MET 2 -8.197 -10.762 3.211
16 HE2 MET 2 HE2 MET 2 -7.258 -9.239 3.383
17 HE3 MET 2 HE3 MET 2 -7.965 -9.683 1.791
18 H ARG 3 HN ARG 3 -10.939 -12.927 2.640
19 HA ARG 3 HA ARG 3 -11.373 -15.298 1.157
20 HB2 ARG 3 HB2 ARG 3 -10.468 -16.493 3.094
21 HB3 ARG 3 HB1 ARG 3 -9.450 -15.044 2.790
22 HG2 ARG 3 HG2 ARG 3 -10.805 -13.804 4.563
23 HG3 ARG 3 HG1 ARG 3 -11.638 -15.353 4.934
24 HD2 ARG 3 HD2 ARG 3 -9.809 -15.078 6.556
25 HD3 ARG 3 HD1 ARG 3 -9.302 -16.379 5.393
26 HE ARG 3 HE ARG 3 -7.627 -14.929 4.554
27 HH11 ARG 3 HH11 ARG 3 -9.922 -13.169 6.641
28 HH12 ARG 3 HH12 ARG 3 -8.986 -11.713 6.699
29 HH21 ARG 3 HH21 ARG 3 -6.358 -12.952 4.642
30 HH22 ARG 3 HH22 ARG 3 -6.928 -11.588 5.544
31 H LEU 4 HN LEU 4 -13.322 -13.217 3.020
32 HA LEU 4 HA LEU 4 -15.294 -15.344 3.292
33 HB2 LEU 4 HB2 LEU 4 -15.949 -14.575 5.541
34 HB3 LEU 4 HB1 LEU 4 -14.210 -15.034 5.566
35 HG LEU 4 HG LEU 4 -14.186 -12.316 4.799
36 HD11 LEU 4 HD11 LEU 4 -15.494 -11.153 6.604
37 HD12 LEU 4 HD12 LEU 4 -16.256 -12.731 7.042
38 HD13 LEU 4 HD13 LEU 4 -16.547 -12.011 5.409
39 HD21 LEU 4 HD21 LEU 4 -13.502 -13.885 7.307
40 HD22 LEU 4 HD22 LEU 4 -13.474 -12.082 7.382
41 HD23 LEU 4 HD23 LEU 4 -12.440 -12.953 6.184
42 H SER 5 HN SER 5 -17.495 -14.145 3.993
43 HA SER 5 HA SER 5 -17.564 -11.435 3.035
44 HB2 SER 5 HB2 SER 5 -19.093 -13.687 1.604
45 HB3 SER 5 HB1 SER 5 -19.477 -11.931 1.425
46 HG SER 5 HG SER 5 -16.829 -12.521 1.090
47 H DPP 6 HN DPP 6 -19.769 -14.301 3.568
48 HA DPP 6 HA DPP 6 -21.435 -12.564 5.157
49 HB2 DPP 6 HB2 DPP 6 -21.677 -15.369 3.978
50 HB3 DPP 6 HB3 DPP 6 -22.896 -14.043 4.003
51 H PHE 7 HN PHE 7 -20.755 -15.941 6.130
52 HA PHE 7 HA PHE 7 -20.077 -16.767 8.052
53 HB2 PHE 7 HB2 PHE 7 -17.731 -16.449 7.593
54 HB3 PHE 7 HB1 PHE 7 -17.899 -14.642 7.581
55 HD1 PHE 7 HD1 PHE 7 -19.217 -16.859 10.291
56 HD2 PHE 7 HD2 PHE 7 -16.167 -14.131 9.091
57 HE1 PHE 7 HE1 PHE 7 -18.615 -16.543 12.641
58 HE2 PHE 7 HE2 PHE 7 -15.483 -13.915 11.448
59 HZ PHE 7 HZ PHE 7 -16.687 -15.117 13.210
60 H PHE 8 HN PHE 8 -18.880 -13.656 9.074
61 HA PHE 8 HA PHE 8 -20.155 -13.996 11.502
62 HB2 PHE 8 HB2 PHE 8 -18.766 -12.251 12.248
63 HB3 PHE 8 HB1 PHE 8 -17.848 -12.989 10.931
64 HD1 PHE 8 HD1 PHE 8 -18.855 -10.083 12.336
65 HD2 PHE 8 HD2 PHE 8 -18.394 -12.010 8.610
66 HE1 PHE 8 HE1 PHE 8 -18.751 -7.957 11.275
67 HE2 PHE 8 HE2 PHE 8 -18.266 -9.890 7.514
68 HZ PHE 8 HZ PHE 8 -18.436 -7.832 8.833
69 H ARG 9 HN ARG 9 -20.900 -11.662 8.811
70 HA ARG 9 HA ARG 9 -22.682 -10.429 10.590
71 HB2 ARG 9 HB2 ARG 9 -23.940 -9.718 8.332
72 HB3 ARG 9 HB1 ARG 9 -22.356 -8.996 8.766
73 HG2 ARG 9 HG2 ARG 9 -22.112 -11.538 7.224
74 HG3 ARG 9 HG1 ARG 9 -22.993 -10.242 6.346
75 HD2 ARG 9 HD2 ARG 9 -20.655 -9.066 7.674
76 HD3 ARG 9 HD1 ARG 9 -20.138 -10.508 6.686
77 HE ARG 9 HE ARG 9 -21.927 -9.085 5.032
78 HH11 ARG 9 HH11 ARG 9 -18.916 -8.394 6.804
79 HH12 ARG 9 HH12 ARG 9 -18.344 -7.210 5.676
80 HH21 ARG 9 HH21 ARG 9 -21.151 -7.472 3.506
81 HH22 ARG 9 HH22 ARG 9 -19.633 -6.679 3.771
82 H GLN 10 HN GLN 10 -22.805 -13.587 9.689
83 HA GLN 10 HA GLN 10 -25.574 -13.511 10.404
84 HB2 GLN 10 HB2 GLN 10 -26.263 -15.120 8.677
85 HB3 GLN 10 HB1 GLN 10 -25.617 -13.638 7.905
86 HG2 GLN 10 HG2 GLN 10 -23.589 -15.825 8.397
87 HG3 GLN 10 HG1 GLN 10 -24.870 -16.209 7.189
88 HE21 GLN 10 HE21 GLN 10 -22.836 -16.233 5.820
89 H PHE 11 HN PHE 11 -22.796 -14.166 11.430
90 HA PHE 11 HA PHE 11 -23.517 -16.837 12.344
91 HB2 PHE 11 HB2 PHE 11 -21.451 -17.083 11.007
92 HB3 PHE 11 HB1 PHE 11 -20.729 -15.701 11.892
93 HD1 PHE 11 HD1 PHE 11 -21.214 -19.195 11.789
94 HD2 PHE 11 HD2 PHE 11 -20.429 -15.900 14.360
95 HE1 PHE 11 HE1 PHE 11 -20.298 -20.737 13.466
96 HE2 PHE 11 HE2 PHE 11 -19.488 -17.452 16.037
97 HZ PHE 11 HZ PHE 11 -19.427 -19.867 15.592
98 H ILE 12 HN ILE 12 -21.777 -13.777 12.986
99 HA ILE 12 HA ILE 12 -21.958 -14.344 15.790
100 HB ILE 12 HB ILE 12 -21.443 -11.597 15.469
101 HG12 ILE 12 HG12 ILE 12 -19.239 -11.948 14.059
102 HG13 ILE 12 HG11 ILE 12 -20.315 -13.101 13.205
103 HG21 ILE 12 HG21 ILE 12 -19.068 -12.297 16.231
104 HG22 ILE 12 HG22 ILE 12 -19.606 -14.012 16.065
105 HG23 ILE 12 HG23 ILE 12 -20.415 -12.919 17.258
106 HD11 ILE 12 HD11 ILE 12 -20.628 -10.895 12.208
107 HD12 ILE 12 HD12 ILE 12 -20.898 -10.159 13.826
108 HD13 ILE 12 HD13 ILE 12 -22.100 -11.329 13.146
109 H LEU 13 HN LEU 13 -23.607 -13.138 13.267
110 HA LEU 13 HA LEU 13 -25.116 -11.314 14.841
111 HB2 LEU 13 HB2 LEU 13 -24.039 -11.647 12.222
112 HB3 LEU 13 HB1 LEU 13 -25.826 -11.302 12.103
113 HG LEU 13 HG LEU 13 -25.559 -9.249 13.440
114 HD11 LEU 13 HD11 LEU 13 -23.846 -8.905 14.901
115 HD12 LEU 13 HD12 LEU 13 -22.620 -9.060 13.588
116 HD13 LEU 13 HD13 LEU 13 -23.188 -10.530 14.465
117 HD21 LEU 13 HD21 LEU 13 -23.192 -8.856 11.605
118 HD22 LEU 13 HD22 LEU 13 -24.741 -7.935 11.735
119 HD23 LEU 13 HD23 LEU 13 -24.698 -9.500 10.840
120 H GLN 14 HN GLN 14 -25.011 -14.510 14.279
121 HA GLN 14 HA GLN 14 -27.775 -14.782 14.909
122 HB2 GLN 14 HB2 GLN 14 -26.576 -16.188 12.446
123 HB3 GLN 14 HB1 GLN 14 -28.127 -16.662 13.225
124 HG2 GLN 14 HG2 GLN 14 -29.066 -14.371 12.719
125 HG3 GLN 14 HG1 GLN 14 -27.527 -13.953 11.867
126 HE21 GLN 14 HE21 GLN 14 -28.307 -13.826 9.746
127 HE22 GLN 14 HE22 GLN 14 -28.976 -15.169 8.884
128 H ARG 15 HN ARG 15 -25.550 -14.785 16.361
129 HA ARG 15 HA ARG 15 -24.505 -17.458 16.451
130 HB2 ARG 15 HB2 ARG 15 -23.573 -14.855 17.116
131 HB3 ARG 15 HB1 ARG 15 -23.742 -15.720 18.686
132 HG2 ARG 15 HG2 ARG 15 -22.404 -17.663 17.677
133 HG3 ARG 15 HG1 ARG 15 -22.096 -16.627 16.230
134 HD2 ARG 15 HD2 ARG 15 -20.181 -16.138 17.487
135 HD3 ARG 15 HD1 ARG 15 -21.298 -14.857 18.135
136 HE ARG 15 HE ARG 15 -21.676 -17.210 19.718
137 HH11 ARG 15 HH11 ARG 15 -19.164 -14.814 18.917
138 HH12 ARG 15 HH12 ARG 15 -18.357 -14.924 20.445
139 HH21 ARG 15 HH21 ARG 15 -20.586 -17.361 21.791
140 HH22 ARG 15 HH22 ARG 15 -19.180 -16.398 22.110
141 H LYS 16 HN LYS 16 -26.287 -18.731 17.077
142 HA LYS 16 HA LYS 16 -27.928 -18.071 19.239
143 HB2 LYS 16 HB2 LYS 16 -27.130 -20.809 18.105
144 HB3 LYS 16 HB1 LYS 16 -28.407 -20.575 19.352
145 HG2 LYS 16 HG2 LYS 16 -29.683 -19.118 17.766
146 HG3 LYS 16 HG1 LYS 16 -28.412 -19.374 16.522
147 HD2 LYS 16 HD2 LYS 16 -28.883 -21.819 16.513
148 HD3 LYS 16 HD1 LYS 16 -30.107 -21.605 17.810
149 HE2 LYS 16 HE2 LYS 16 -31.232 -21.791 15.601
150 HE3 LYS 16 HE1 LYS 16 -31.450 -20.111 16.245
151 HZ1 LYS 16 HZ1 LYS 16 -30.376 -20.886 13.825
152 HZ2 LYS 16 HZ2 LYS 16 -29.061 -20.313 14.735
153 HZ3 LYS 16 HZ3 LYS 16 -30.423 -19.327 14.496
154 H LYS 17 HN LYS 17 -24.798 -19.728 18.918
155 HA LYS 17 HA LYS 17 -24.625 -19.629 21.848
156 HB2 LYS 17 HB2 LYS 17 -24.316 -22.006 20.038
157 HB3 LYS 17 HB1 LYS 17 -22.951 -21.760 21.181
158 HG2 LYS 17 HG2 LYS 17 -24.483 -23.227 22.294
159 HG3 LYS 17 HG1 LYS 17 -24.686 -21.619 23.071
160 HD2 LYS 17 HD2 LYS 17 -26.733 -21.192 21.736
161 HD3 LYS 17 HD1 LYS 17 -26.502 -22.732 20.840
162 HE2 LYS 17 HE2 LYS 17 -26.805 -24.027 22.975
163 HE3 LYS 17 HE1 LYS 17 -27.036 -22.472 23.879
164 HZ1 LYS 17 HZ1 LYS 17 -29.125 -23.419 23.322
165 HZ2 LYS 17 HZ2 LYS 17 -28.726 -23.538 21.676
166 HZ3 LYS 17 HZ3 LYS 17 -28.914 -22.012 22.396
Start of MODEL 7
1 H1 GLU 1 HT1 GLU 1 -9.353 -10.688 -1.393
2 H2 GLU 1 HT2 GLU 1 -8.373 -9.613 -2.268
3 H3 GLU 1 HT3 GLU 1 -10.032 -9.720 -2.613
4 HA GLU 1 HA GLU 1 -8.647 -8.266 -0.563
5 HB2 GLU 1 HB2 GLU 1 -10.028 -7.245 -2.422
6 HB3 GLU 1 HB1 GLU 1 -11.480 -8.059 -1.741
7 HG2 GLU 1 HG2 GLU 1 -11.256 -6.744 0.381
8 HG3 GLU 1 HG1 GLU 1 -9.765 -5.949 -0.260
9 H MET 2 HN MET 2 -11.433 -10.549 -0.784
10 HA MET 2 HA MET 2 -11.411 -10.568 2.146
11 HB2 MET 2 HB2 MET 2 -13.898 -10.675 0.347
12 HB3 MET 2 HB1 MET 2 -13.891 -11.018 2.111
13 HG2 MET 2 HG2 MET 2 -13.150 -8.700 2.594
14 HG3 MET 2 HG1 MET 2 -13.059 -8.339 0.842
15 HE1 MET 2 HE1 MET 2 -15.991 -10.331 3.015
16 HE2 MET 2 HE2 MET 2 -16.645 -8.787 3.660
17 HE3 MET 2 HE3 MET 2 -14.911 -9.193 3.893
18 H ARG 3 HN ARG 3 -12.246 -12.644 3.025
19 HA ARG 3 HA ARG 3 -12.066 -14.733 0.992
20 HB2 ARG 3 HB2 ARG 3 -11.110 -16.221 2.843
21 HB3 ARG 3 HB1 ARG 3 -9.998 -14.924 2.288
22 HG2 ARG 3 HG2 ARG 3 -10.551 -13.523 4.222
23 HG3 ARG 3 HG1 ARG 3 -11.838 -14.664 4.742
24 HD2 ARG 3 HD2 ARG 3 -8.834 -15.401 4.576
25 HD3 ARG 3 HD1 ARG 3 -9.705 -14.897 6.094
26 HE ARG 3 HE ARG 3 -11.210 -17.021 4.924
27 HH11 ARG 3 HH11 ARG 3 -7.987 -16.391 6.303
28 HH12 ARG 3 HH12 ARG 3 -7.761 -17.998 6.906
29 HH21 ARG 3 HH21 ARG 3 -10.903 -19.208 5.744
30 HH22 ARG 3 HH22 ARG 3 -9.447 -19.628 6.582
31 H LEU 4 HN LEU 4 -14.331 -13.174 2.155
32 HA LEU 4 HA LEU 4 -15.972 -15.390 2.778
33 HB2 LEU 4 HB2 LEU 4 -16.722 -14.622 5.035
34 HB3 LEU 4 HB1 LEU 4 -14.989 -15.096 5.065
35 HG LEU 4 HG LEU 4 -14.829 -12.403 4.385
36 HD11 LEU 4 HD11 LEU 4 -17.168 -11.882 4.720
37 HD12 LEU 4 HD12 LEU 4 -16.272 -11.223 6.148
38 HD13 LEU 4 HD13 LEU 4 -17.211 -12.760 6.298
39 HD21 LEU 4 HD21 LEU 4 -13.373 -13.545 6.005
40 HD22 LEU 4 HD22 LEU 4 -14.734 -13.690 7.183
41 HD23 LEU 4 HD23 LEU 4 -14.075 -12.064 6.763
42 H SER 5 HN SER 5 -18.250 -14.287 3.582
43 HA SER 5 HA SER 5 -18.462 -11.627 2.474
44 HB2 SER 5 HB2 SER 5 -19.922 -14.066 1.318
45 HB3 SER 5 HB1 SER 5 -20.587 -12.390 1.170
46 HG SER 5 HG SER 5 -17.935 -12.605 0.518
47 H DPP 6 HN DPP 6 -20.733 -14.384 3.284
48 HA DPP 6 HA DPP 6 -22.022 -12.528 5.076
49 HB2 DPP 6 HB2 DPP 6 -22.735 -15.519 4.877
50 HB3 DPP 6 HB3 DPP 6 -23.293 -14.354 3.623
51 H PHE 7 HN PHE 7 -21.903 -15.864 6.151
52 HA PHE 7 HA PHE 7 -20.883 -16.854 7.847
53 HB2 PHE 7 HB2 PHE 7 -18.562 -16.651 7.262
54 HB3 PHE 7 HB1 PHE 7 -18.660 -14.843 7.155
55 HD1 PHE 7 HD1 PHE 7 -19.736 -16.986 10.040
56 HD2 PHE 7 HD2 PHE 7 -16.894 -14.189 8.532
57 HE1 PHE 7 HE1 PHE 7 -18.931 -16.605 12.324
58 HE2 PHE 7 HE2 PHE 7 -16.034 -13.881 10.819
59 HZ PHE 7 HZ PHE 7 -17.025 -15.097 12.698
60 H PHE 8 HN PHE 8 -19.547 -13.740 8.754
61 HA PHE 8 HA PHE 8 -20.567 -14.059 11.304
62 HB2 PHE 8 HB2 PHE 8 -19.206 -12.205 11.868
63 HB3 PHE 8 HB1 PHE 8 -18.365 -12.963 10.508
64 HD1 PHE 8 HD1 PHE 8 -19.460 -10.036 11.858
65 HD2 PHE 8 HD2 PHE 8 -19.090 -12.127 8.221
66 HE1 PHE 8 HE1 PHE 8 -19.590 -7.975 10.688
67 HE2 PHE 8 HE2 PHE 8 -19.200 -10.075 7.000
68 HZ PHE 8 HZ PHE 8 -19.443 -7.964 8.226
69 H ARG 9 HN ARG 9 -21.641 -11.818 8.650
70 HA ARG 9 HA ARG 9 -23.343 -10.634 10.526
71 HB2 ARG 9 HB2 ARG 9 -24.796 -10.005 8.401
72 HB3 ARG 9 HB1 ARG 9 -23.165 -9.280 8.599
73 HG2 ARG 9 HG2 ARG 9 -23.128 -11.898 7.171
74 HG3 ARG 9 HG1 ARG 9 -24.100 -10.635 6.340
75 HD2 ARG 9 HD2 ARG 9 -21.659 -9.369 7.280
76 HD3 ARG 9 HD1 ARG 9 -21.198 -10.913 6.428
77 HE ARG 9 HE ARG 9 -23.082 -9.804 4.716
78 HH11 ARG 9 HH11 ARG 9 -20.173 -8.549 6.343
79 HH12 ARG 9 HH12 ARG 9 -19.782 -7.410 5.099
80 HH21 ARG 9 HH21 ARG 9 -22.550 -8.258 3.028
81 HH22 ARG 9 HH22 ARG 9 -21.157 -7.242 3.184
82 H GLN 10 HN GLN 10 -23.391 -13.841 9.678
83 HA GLN 10 HA GLN 10 -26.135 -13.850 10.558
84 HB2 GLN 10 HB2 GLN 10 -25.456 -16.001 8.579
85 HB3 GLN 10 HB1 GLN 10 -27.011 -15.145 8.835
86 HG2 GLN 10 HG2 GLN 10 -26.605 -14.076 6.855
87 HG3 GLN 10 HG1 GLN 10 -25.358 -13.132 7.744
88 HE21 GLN 10 HE21 GLN 10 -24.421 -13.048 5.480
89 H PHE 11 HN PHE 11 -23.224 -14.336 11.396
90 HA PHE 11 HA PHE 11 -23.777 -16.986 12.498
91 HB2 PHE 11 HB2 PHE 11 -21.812 -17.158 10.986
92 HB3 PHE 11 HB1 PHE 11 -21.071 -15.758 11.832
93 HD1 PHE 11 HD1 PHE 11 -21.474 -19.265 11.742
94 HD2 PHE 11 HD2 PHE 11 -20.600 -15.952 14.258
95 HE1 PHE 11 HE1 PHE 11 -20.400 -20.785 13.348
96 HE2 PHE 11 HE2 PHE 11 -19.499 -17.479 15.864
97 HZ PHE 11 HZ PHE 11 -19.405 -19.891 15.411
98 H ILE 12 HN ILE 12 -22.098 -13.845 12.900
99 HA ILE 12 HA ILE 12 -22.038 -14.331 15.728
100 HB ILE 12 HB ILE 12 -21.658 -11.577 15.274
101 HG12 ILE 12 HG12 ILE 12 -19.548 -11.888 13.727
102 HG13 ILE 12 HG11 ILE 12 -20.621 -13.133 13.000
103 HG21 ILE 12 HG21 ILE 12 -19.692 -13.899 15.833
104 HG22 ILE 12 HG22 ILE 12 -20.449 -12.779 17.034
105 HG23 ILE 12 HG23 ILE 12 -19.204 -12.162 15.885
106 HD11 ILE 12 HD11 ILE 12 -21.127 -10.985 11.947
107 HD12 ILE 12 HD12 ILE 12 -21.314 -10.200 13.551
108 HD13 ILE 12 HD13 ILE 12 -22.496 -11.457 13.010
109 H LEU 13 HN LEU 13 -23.962 -13.354 13.328
110 HA LEU 13 HA LEU 13 -25.410 -11.497 14.924
111 HB2 LEU 13 HB2 LEU 13 -24.549 -11.928 12.249
112 HB3 LEU 13 HB1 LEU 13 -26.359 -11.700 12.264
113 HG LEU 13 HG LEU 13 -26.075 -9.575 13.544
114 HD11 LEU 13 HD11 LEU 13 -24.132 -8.926 14.574
115 HD12 LEU 13 HD12 LEU 13 -23.120 -9.333 13.137
116 HD13 LEU 13 HD13 LEU 13 -23.572 -10.625 14.317
117 HD21 LEU 13 HD21 LEU 13 -25.625 -9.902 10.839
118 HD22 LEU 13 HD22 LEU 13 -24.096 -9.075 11.327
119 HD23 LEU 13 HD23 LEU 13 -25.692 -8.304 11.668
120 H GLN 14 HN GLN 14 -25.200 -14.724 14.478
121 HA GLN 14 HA GLN 14 -27.880 -15.075 15.387
122 HB2 GLN 14 HB2 GLN 14 -26.838 -16.552 12.894
123 HB3 GLN 14 HB1 GLN 14 -28.283 -17.063 13.837
124 HG2 GLN 14 HG2 GLN 14 -29.392 -14.855 13.316
125 HG3 GLN 14 HG1 GLN 14 -27.960 -14.396 12.311
126 HE21 GLN 14 HE21 GLN 14 -28.906 -14.422 10.260
127 HE22 GLN 14 HE22 GLN 14 -29.578 -15.836 9.523
128 H ARG 15 HN ARG 15 -25.542 -14.907 16.628
129 HA ARG 15 HA ARG 15 -24.387 -17.537 16.768
130 HB2 ARG 15 HB2 ARG 15 -23.496 -14.863 17.177
131 HB3 ARG 15 HB1 ARG 15 -23.466 -15.640 18.801
132 HG2 ARG 15 HG2 ARG 15 -22.171 -17.596 17.755
133 HG3 ARG 15 HG1 ARG 15 -22.047 -16.625 16.236
134 HD2 ARG 15 HD2 ARG 15 -20.035 -16.014 17.270
135 HD3 ARG 15 HD1 ARG 15 -21.130 -14.738 17.966
136 HE ARG 15 HE ARG 15 -21.252 -17.030 19.681
137 HH11 ARG 15 HH11 ARG 15 -18.959 -14.552 18.546
138 HH12 ARG 15 HH12 ARG 15 -18.014 -14.544 19.996
139 HH21 ARG 15 HH21 ARG 15 -19.973 -17.022 21.649
140 HH22 ARG 15 HH22 ARG 15 -18.599 -15.974 21.792
141 H LYS 16 HN LYS 16 -26.046 -18.818 17.649
142 HA LYS 16 HA LYS 16 -27.496 -18.060 19.909
143 HB2 LYS 16 HB2 LYS 16 -28.123 -20.008 18.403
144 HB3 LYS 16 HB1 LYS 16 -26.701 -20.898 19.051
145 HG2 LYS 16 HG2 LYS 16 -27.673 -20.799 21.350
146 HG3 LYS 16 HG1 LYS 16 -29.084 -19.882 20.722
147 HD2 LYS 16 HD2 LYS 16 -29.684 -21.817 19.252
148 HD3 LYS 16 HD1 LYS 16 -28.270 -22.734 19.876
149 HE2 LYS 16 HE2 LYS 16 -29.242 -22.677 22.191
150 HE3 LYS 16 HE1 LYS 16 -30.664 -21.740 21.567
151 HZ1 LYS 16 HZ1 LYS 16 -30.131 -24.529 21.477
152 HZ2 LYS 16 HZ2 LYS 16 -30.418 -23.923 19.917
153 HZ3 LYS 16 HZ3 LYS 16 -31.562 -23.677 21.148
154 H LYS 17 HN LYS 17 -24.317 -19.628 19.437
155 HA LYS 17 HA LYS 17 -23.888 -19.220 22.305
156 HB2 LYS 17 HB2 LYS 17 -23.798 -21.815 20.816
157 HB3 LYS 17 HB1 LYS 17 -22.286 -21.449 21.719
158 HG2 LYS 17 HG2 LYS 17 -23.696 -22.739 23.191
159 HG3 LYS 17 HG1 LYS 17 -23.700 -21.048 23.800
160 HD2 LYS 17 HD2 LYS 17 -25.931 -20.692 23.236
161 HD3 LYS 17 HD1 LYS 17 -25.876 -21.809 21.831
162 HE2 LYS 17 HE2 LYS 17 -27.318 -22.760 23.619
163 HE3 LYS 17 HE1 LYS 17 -25.829 -23.778 23.444
164 HZ1 LYS 17 HZ1 LYS 17 -25.233 -21.788 25.271
165 HZ2 LYS 17 HZ2 LYS 17 -25.492 -23.440 25.564
166 HZ3 LYS 17 HZ3 LYS 17 -26.784 -22.344 25.682
Start of MODEL 8
1 H1 GLU 1 HT1 GLU 1 -13.261 -6.908 2.029
2 H2 GLU 1 HT2 GLU 1 -13.148 -6.255 0.464
3 H3 GLU 1 HT3 GLU 1 -12.443 -5.442 1.777
4 HA GLU 1 HA GLU 1 -11.358 -7.424 0.119
5 HB2 GLU 1 HB2 GLU 1 -10.324 -5.770 2.490
6 HB3 GLU 1 HB1 GLU 1 -9.254 -6.833 1.507
7 HG2 GLU 1 HG2 GLU 1 -9.723 -5.516 -0.540
8 HG3 GLU 1 HG1 GLU 1 -10.929 -4.504 0.346
9 H MET 2 HN MET 2 -13.056 -9.122 1.216
10 HA MET 2 HA MET 2 -11.377 -10.590 3.110
11 HB2 MET 2 HB2 MET 2 -14.426 -10.276 3.278
12 HB3 MET 2 HB1 MET 2 -13.466 -11.464 4.227
13 HG2 MET 2 HG2 MET 2 -12.230 -9.614 5.340
14 HG3 MET 2 HG1 MET 2 -13.119 -8.404 4.363
15 HE1 MET 2 HE1 MET 2 -14.362 -10.938 7.951
16 HE2 MET 2 HE2 MET 2 -12.961 -11.085 6.835
17 HE3 MET 2 HE3 MET 2 -14.553 -11.783 6.376
18 H ARG 3 HN ARG 3 -12.029 -12.955 3.143
19 HA ARG 3 HA ARG 3 -12.980 -13.620 0.469
20 HB2 ARG 3 HB2 ARG 3 -11.875 -15.906 0.951
21 HB3 ARG 3 HB1 ARG 3 -10.747 -14.532 0.685
22 HG2 ARG 3 HG2 ARG 3 -10.211 -14.342 2.995
23 HG3 ARG 3 HG1 ARG 3 -11.673 -15.253 3.513
24 HD2 ARG 3 HD2 ARG 3 -10.730 -17.375 2.789
25 HD3 ARG 3 HD1 ARG 3 -9.370 -16.546 1.903
26 HE ARG 3 HE ARG 3 -9.280 -15.719 4.649
27 HH11 ARG 3 HH11 ARG 3 -8.917 -18.623 2.620
28 HH12 ARG 3 HH12 ARG 3 -7.777 -19.400 3.666
29 HH21 ARG 3 HH21 ARG 3 -7.728 -16.776 6.072
30 HH22 ARG 3 HH22 ARG 3 -7.091 -18.332 5.663
31 H LEU 4 HN LEU 4 -14.658 -12.919 2.790
32 HA LEU 4 HA LEU 4 -15.844 -15.567 3.169
33 HB2 LEU 4 HB2 LEU 4 -15.699 -13.237 5.141
34 HB3 LEU 4 HB1 LEU 4 -16.848 -14.614 5.327
35 HG LEU 4 HG LEU 4 -13.805 -14.892 5.091
36 HD11 LEU 4 HD11 LEU 4 -15.642 -14.766 7.544
37 HD12 LEU 4 HD12 LEU 4 -14.136 -13.832 7.197
38 HD13 LEU 4 HD13 LEU 4 -14.038 -15.593 7.589
39 HD21 LEU 4 HD21 LEU 4 -14.240 -17.067 4.659
40 HD22 LEU 4 HD22 LEU 4 -16.022 -16.806 4.861
41 HD23 LEU 4 HD23 LEU 4 -14.994 -17.210 6.295
42 H SER 5 HN SER 5 -18.089 -15.698 3.289
43 HA SER 5 HA SER 5 -19.349 -13.553 1.765
44 HB2 SER 5 HB2 SER 5 -19.324 -16.013 0.898
45 HB3 SER 5 HB1 SER 5 -20.377 -16.404 2.309
46 HG SER 5 HG SER 5 -20.908 -14.993 -0.027
47 H DPP 6 HN DPP 6 -21.912 -15.212 2.875
48 HA DPP 6 HA DPP 6 -22.488 -13.331 4.871
49 HB2 DPP 6 HB2 DPP 6 -23.806 -15.887 3.843
50 HB3 DPP 6 HB3 DPP 6 -24.510 -14.235 3.997
51 H PHE 7 HN PHE 7 -22.553 -16.878 5.579
52 HA PHE 7 HA PHE 7 -22.032 -17.905 7.490
53 HB2 PHE 7 HB2 PHE 7 -19.898 -18.517 6.570
54 HB3 PHE 7 HB1 PHE 7 -19.358 -16.789 6.457
55 HD1 PHE 7 HD1 PHE 7 -20.792 -18.426 9.505
56 HD2 PHE 7 HD2 PHE 7 -17.296 -16.943 7.568
57 HE1 PHE 7 HE1 PHE 7 -19.628 -18.429 11.663
58 HE2 PHE 7 HE2 PHE 7 -16.100 -17.048 9.723
59 HZ PHE 7 HZ PHE 7 -17.247 -17.811 11.748
60 H PHE 8 HN PHE 8 -19.545 -15.562 8.122
61 HA PHE 8 HA PHE 8 -20.313 -15.431 10.759
62 HB2 PHE 8 HB2 PHE 8 -18.247 -14.334 11.079
63 HB3 PHE 8 HB1 PHE 8 -17.978 -15.348 9.663
64 HD1 PHE 8 HD1 PHE 8 -17.525 -12.286 11.027
65 HD2 PHE 8 HD2 PHE 8 -18.591 -14.223 7.431
66 HE1 PHE 8 HE1 PHE 8 -16.863 -10.349 9.817
67 HE2 PHE 8 HE2 PHE 8 -17.917 -12.303 6.175
68 HZ PHE 8 HZ PHE 8 -17.034 -10.321 7.364
69 H ARG 9 HN ARG 9 -20.784 -13.116 8.067
70 HA ARG 9 HA ARG 9 -21.459 -11.148 9.935
71 HB2 ARG 9 HB2 ARG 9 -22.136 -11.538 6.982
72 HB3 ARG 9 HB1 ARG 9 -22.897 -10.198 7.910
73 HG2 ARG 9 HG2 ARG 9 -21.077 -8.940 7.503
74 HG3 ARG 9 HG1 ARG 9 -20.108 -10.073 8.510
75 HD2 ARG 9 HD2 ARG 9 -18.973 -10.053 6.397
76 HD3 ARG 9 HD1 ARG 9 -19.981 -11.572 6.326
77 HE ARG 9 HE ARG 9 -21.611 -9.505 5.270
78 HH11 ARG 9 HH11 ARG 9 -18.435 -10.972 4.605
79 HH12 ARG 9 HH12 ARG 9 -18.490 -10.696 2.897
80 HH21 ARG 9 HH21 ARG 9 -21.687 -9.122 2.947
81 HH22 ARG 9 HH22 ARG 9 -20.370 -9.621 1.940
82 H GLN 10 HN GLN 10 -23.026 -14.087 9.354
83 HA GLN 10 HA GLN 10 -25.245 -12.934 10.775
84 HB2 GLN 10 HB2 GLN 10 -26.915 -14.153 9.428
85 HB3 GLN 10 HB1 GLN 10 -26.014 -12.979 8.415
86 HG2 GLN 10 HG2 GLN 10 -24.892 -15.796 8.521
87 HG3 GLN 10 HG1 GLN 10 -26.459 -15.584 7.654
88 HE21 GLN 10 HE21 GLN 10 -24.861 -16.335 5.889
89 H PHE 11 HN PHE 11 -22.790 -14.591 11.215
90 HA PHE 11 HA PHE 11 -24.206 -16.810 12.457
91 HB2 PHE 11 HB2 PHE 11 -22.723 -17.786 10.734
92 HB3 PHE 11 HB1 PHE 11 -21.373 -16.782 11.347
93 HD1 PHE 11 HD1 PHE 11 -23.095 -19.844 11.585
94 HD2 PHE 11 HD2 PHE 11 -20.632 -17.102 13.704
95 HE1 PHE 11 HE1 PHE 11 -22.452 -21.638 13.135
96 HE2 PHE 11 HE2 PHE 11 -19.967 -18.915 15.249
97 HZ PHE 11 HZ PHE 11 -20.879 -21.178 14.967
98 H ILE 12 HN ILE 12 -21.369 -14.626 12.496
99 HA ILE 12 HA ILE 12 -21.127 -15.090 15.310
100 HB ILE 12 HB ILE 12 -19.764 -12.707 14.677
101 HG12 ILE 12 HG12 ILE 12 -18.181 -13.848 12.895
102 HG13 ILE 12 HG11 ILE 12 -19.758 -14.519 12.365
103 HG21 ILE 12 HG21 ILE 12 -17.683 -14.203 15.017
104 HG22 ILE 12 HG22 ILE 12 -18.799 -15.621 15.073
105 HG23 ILE 12 HG23 ILE 12 -18.918 -14.323 16.326
106 HD11 ILE 12 HD11 ILE 12 -19.469 -12.358 11.270
107 HD12 ILE 12 HD12 ILE 12 -19.074 -11.569 12.837
108 HD13 ILE 12 HD13 ILE 12 -20.740 -12.198 12.529
109 H LEU 13 HN LEU 13 -22.663 -13.286 13.063
110 HA LEU 13 HA LEU 13 -23.048 -11.069 14.784
111 HB2 LEU 13 HB2 LEU 13 -22.789 -11.776 12.034
112 HB3 LEU 13 HB1 LEU 13 -24.284 -10.758 12.270
113 HG LEU 13 HG LEU 13 -22.989 -8.955 13.270
114 HD11 LEU 13 HD11 LEU 13 -21.145 -9.363 14.540
115 HD12 LEU 13 HD12 LEU 13 -20.222 -9.819 13.059
116 HD13 LEU 13 HD13 LEU 13 -21.106 -11.084 13.992
117 HD21 LEU 13 HD21 LEU 13 -21.933 -8.156 11.370
118 HD22 LEU 13 HD22 LEU 13 -22.749 -9.583 10.630
119 HD23 LEU 13 HD23 LEU 13 -21.005 -9.680 11.095
120 H GLN 14 HN GLN 14 -24.270 -14.068 14.458
121 HA GLN 14 HA GLN 14 -26.720 -13.256 15.665
122 HB2 GLN 14 HB2 GLN 14 -26.710 -14.989 13.119
123 HB3 GLN 14 HB1 GLN 14 -28.112 -14.853 14.239
124 HG2 GLN 14 HG2 GLN 14 -28.214 -12.366 13.786
125 HG3 GLN 14 HG1 GLN 14 -26.861 -12.552 12.599
126 HE21 GLN 14 HE21 GLN 14 -28.018 -12.071 10.707
127 HE22 GLN 14 HE22 GLN 14 -29.306 -13.054 10.096
128 H ARG 15 HN ARG 15 -24.387 -14.155 16.617
129 HA ARG 15 HA ARG 15 -24.467 -17.026 16.717
130 HB2 ARG 15 HB2 ARG 15 -22.494 -14.975 17.004
131 HB3 ARG 15 HB1 ARG 15 -22.625 -15.771 18.613
132 HG2 ARG 15 HG2 ARG 15 -22.351 -18.035 17.437
133 HG3 ARG 15 HG1 ARG 15 -22.018 -17.145 15.906
134 HD2 ARG 15 HD2 ARG 15 -19.834 -17.484 16.711
135 HD3 ARG 15 HD1 ARG 15 -20.207 -15.857 17.432
136 HE ARG 15 HE ARG 15 -21.086 -17.852 19.288
137 HH11 ARG 15 HH11 ARG 15 -18.110 -16.622 17.768
138 HH12 ARG 15 HH12 ARG 15 -17.085 -16.992 19.114
139 HH21 ARG 15 HH21 ARG 15 -19.694 -18.355 21.122
140 HH22 ARG 15 HH22 ARG 15 -18.002 -17.995 21.053
141 H LYS 16 HN LYS 16 -26.508 -17.395 17.769
142 HA LYS 16 HA LYS 16 -26.772 -16.236 20.420
143 HB2 LYS 16 HB2 LYS 16 -28.566 -18.239 18.920
144 HB3 LYS 16 HB1 LYS 16 -28.967 -17.436 20.482
145 HG2 LYS 16 HG2 LYS 16 -28.876 -15.205 19.355
146 HG3 LYS 16 HG1 LYS 16 -28.496 -16.017 17.797
147 HD2 LYS 16 HD2 LYS 16 -30.686 -17.256 17.931
148 HD3 LYS 16 HD1 LYS 16 -31.068 -16.392 19.459
149 HE2 LYS 16 HE2 LYS 16 -30.572 -15.014 16.732
150 HE3 LYS 16 HE1 LYS 16 -32.198 -15.345 17.462
151 HZ1 LYS 16 HZ1 LYS 16 -30.725 -14.094 19.419
152 HZ2 LYS 16 HZ2 LYS 16 -31.972 -13.434 18.475
153 HZ3 LYS 16 HZ3 LYS 16 -30.354 -13.255 17.991
154 H LYS 17 HN LYS 17 -25.187 -18.780 18.905
155 HA LYS 17 HA LYS 17 -24.192 -20.612 19.685
156 HB2 LYS 17 HB2 LYS 17 -24.957 -19.668 22.510
157 HB3 LYS 17 HB1 LYS 17 -23.681 -20.862 22.090
158 HG2 LYS 17 HG2 LYS 17 -22.166 -19.247 21.422
159 HG3 LYS 17 HG1 LYS 17 -23.435 -18.135 20.805
160 HD2 LYS 17 HD2 LYS 17 -24.060 -17.520 23.129
161 HD3 LYS 17 HD1 LYS 17 -22.834 -18.668 23.781
162 HE2 LYS 17 HE2 LYS 17 -20.994 -17.336 22.751
163 HE3 LYS 17 HE1 LYS 17 -22.205 -16.221 21.989
164 HZ1 LYS 17 HZ1 LYS 17 -21.262 -16.386 24.720
165 HZ2 LYS 17 HZ2 LYS 17 -22.941 -16.180 24.560
166 HZ3 LYS 17 HZ3 LYS 17 -21.876 -15.073 23.835
Start of MODEL 9
1 H1 GLU 1 HT1 GLU 1 -12.751 -8.994 -3.696
2 H2 GLU 1 HT2 GLU 1 -13.191 -7.443 -3.162
3 H3 GLU 1 HT3 GLU 1 -13.865 -8.818 -2.427
4 HA GLU 1 HA GLU 1 -11.127 -9.100 -2.267
5 HB2 GLU 1 HB2 GLU 1 -12.175 -6.327 -1.468
6 HB3 GLU 1 HB1 GLU 1 -10.641 -7.011 -0.821
7 HG2 GLU 1 HG2 GLU 1 -9.654 -7.117 -3.090
8 HG3 GLU 1 HG1 GLU 1 -11.217 -6.590 -3.831
9 H MET 2 HN MET 2 -13.060 -10.722 -1.379
10 HA MET 2 HA MET 2 -13.029 -10.203 1.505
11 HB2 MET 2 HB2 MET 2 -15.356 -11.367 -0.122
12 HB3 MET 2 HB1 MET 2 -15.245 -11.397 1.673
13 HG2 MET 2 HG2 MET 2 -15.111 -8.845 1.631
14 HG3 MET 2 HG1 MET 2 -15.435 -8.908 -0.129
15 HE1 MET 2 HE1 MET 2 -17.730 -11.217 -0.538
16 HE2 MET 2 HE2 MET 2 -17.214 -9.658 -1.270
17 HE3 MET 2 HE3 MET 2 -18.912 -9.874 -0.723
18 H ARG 3 HN ARG 3 -13.030 -12.206 2.783
19 HA ARG 3 HA ARG 3 -12.256 -14.452 1.106
20 HB2 ARG 3 HB2 ARG 3 -10.353 -13.474 2.520
21 HB3 ARG 3 HB1 ARG 3 -11.324 -13.890 3.974
22 HG2 ARG 3 HG2 ARG 3 -10.938 -16.140 2.036
23 HG3 ARG 3 HG1 ARG 3 -9.426 -15.528 2.791
24 HD2 ARG 3 HD2 ARG 3 -10.517 -15.818 5.090
25 HD3 ARG 3 HD1 ARG 3 -11.941 -16.588 4.258
26 HE ARG 3 HE ARG 3 -9.545 -17.892 3.352
27 HH11 ARG 3 HH11 ARG 3 -11.536 -17.423 6.266
28 HH12 ARG 3 HH12 ARG 3 -11.139 -18.953 6.973
29 HH21 ARG 3 HH21 ARG 3 -9.004 -19.975 4.312
30 HH22 ARG 3 HH22 ARG 3 -9.674 -20.428 5.842
31 H LEU 4 HN LEU 4 -13.537 -13.551 4.358
32 HA LEU 4 HA LEU 4 -14.853 -16.107 4.482
33 HB2 LEU 4 HB2 LEU 4 -15.950 -14.604 6.568
34 HB3 LEU 4 HB1 LEU 4 -14.523 -15.685 6.710
35 HG LEU 4 HG LEU 4 -13.061 -13.678 6.063
36 HD11 LEU 4 HD11 LEU 4 -14.115 -11.815 5.294
37 HD12 LEU 4 HD12 LEU 4 -14.645 -11.513 6.992
38 HD13 LEU 4 HD13 LEU 4 -15.727 -12.405 5.853
39 HD21 LEU 4 HD21 LEU 4 -13.001 -12.786 8.349
40 HD22 LEU 4 HD22 LEU 4 -13.320 -14.561 8.409
41 HD23 LEU 4 HD23 LEU 4 -14.668 -13.392 8.675
42 H SER 5 HN SER 5 -15.535 -12.767 3.549
43 HA SER 5 HA SER 5 -17.350 -11.793 2.770
44 HB2 SER 5 HB2 SER 5 -17.331 -13.836 1.206
45 HB3 SER 5 HB1 SER 5 -18.535 -14.590 2.317
46 HG SER 5 HG SER 5 -19.435 -13.457 0.520
47 H DPP 6 HN DPP 6 -19.831 -14.140 3.399
48 HA DPP 6 HA DPP 6 -20.832 -12.406 5.415
49 HB2 DPP 6 HB2 DPP 6 -21.982 -15.211 4.901
50 HB3 DPP 6 HB3 DPP 6 -22.249 -13.885 3.713
51 H PHE 7 HN PHE 7 -21.370 -15.752 6.230
52 HA PHE 7 HA PHE 7 -20.647 -17.023 7.899
53 HB2 PHE 7 HB2 PHE 7 -18.286 -17.202 7.507
54 HB3 PHE 7 HB1 PHE 7 -18.067 -15.402 7.495
55 HD1 PHE 7 HD1 PHE 7 -19.691 -17.481 10.173
56 HD2 PHE 7 HD2 PHE 7 -16.362 -15.077 9.026
57 HE1 PHE 7 HE1 PHE 7 -19.026 -17.314 12.526
58 HE2 PHE 7 HE2 PHE 7 -15.636 -15.019 11.378
59 HZ PHE 7 HZ PHE 7 -16.949 -16.137 13.115
60 H PHE 8 HN PHE 8 -18.892 -14.219 9.088
61 HA PHE 8 HA PHE 8 -20.129 -14.491 11.547
62 HB2 PHE 8 HB2 PHE 8 -18.558 -12.881 12.304
63 HB3 PHE 8 HB1 PHE 8 -17.733 -13.703 10.966
64 HD1 PHE 8 HD1 PHE 8 -18.514 -10.696 12.377
65 HD2 PHE 8 HD2 PHE 8 -18.135 -12.683 8.685
66 HE1 PHE 8 HE1 PHE 8 -18.278 -8.596 11.300
67 HE2 PHE 8 HE2 PHE 8 -17.876 -10.597 7.549
68 HZ PHE 8 HZ PHE 8 -17.938 -8.508 8.860
69 H ARG 9 HN ARG 9 -20.645 -11.974 8.967
70 HA ARG 9 HA ARG 9 -22.289 -10.642 10.795
71 HB2 ARG 9 HB2 ARG 9 -23.447 -9.649 8.647
72 HB3 ARG 9 HB1 ARG 9 -21.728 -9.243 8.968
73 HG2 ARG 9 HG2 ARG 9 -22.078 -11.742 7.378
74 HG3 ARG 9 HG1 ARG 9 -22.754 -10.276 6.584
75 HD2 ARG 9 HD2 ARG 9 -20.234 -9.438 7.655
76 HD3 ARG 9 HD1 ARG 9 -19.931 -11.079 6.924
77 HE ARG 9 HE ARG 9 -21.458 -9.812 4.981
78 HH11 ARG 9 HH11 ARG 9 -18.557 -8.903 6.839
79 HH12 ARG 9 HH12 ARG 9 -17.874 -7.924 5.584
80 HH21 ARG 9 HH21 ARG 9 -20.529 -8.484 3.279
81 HH22 ARG 9 HH22 ARG 9 -19.015 -7.682 3.527
82 H GLN 10 HN GLN 10 -22.766 -13.749 9.739
83 HA GLN 10 HA GLN 10 -25.541 -13.364 10.415
84 HB2 GLN 10 HB2 GLN 10 -25.027 -15.490 8.358
85 HB3 GLN 10 HB1 GLN 10 -26.460 -14.433 8.560
86 HG2 GLN 10 HG2 GLN 10 -25.756 -13.323 6.691
87 HG3 GLN 10 HG1 GLN 10 -24.456 -12.626 7.724
88 HE21 GLN 10 HE21 GLN 10 -23.293 -12.542 5.593
89 H PHE 11 HN PHE 11 -22.822 -14.343 11.436
90 HA PHE 11 HA PHE 11 -23.865 -16.921 12.335
91 HB2 PHE 11 HB2 PHE 11 -21.836 -17.332 10.958
92 HB3 PHE 11 HB1 PHE 11 -20.957 -16.108 11.933
93 HD1 PHE 11 HD1 PHE 11 -21.898 -19.499 11.614
94 HD2 PHE 11 HD2 PHE 11 -20.712 -16.490 14.373
95 HE1 PHE 11 HE1 PHE 11 -21.236 -21.245 13.214
96 HE2 PHE 11 HE2 PHE 11 -20.026 -18.246 15.974
97 HZ PHE 11 HZ PHE 11 -20.289 -20.619 15.394
98 H ILE 12 HN ILE 12 -21.748 -14.116 13.037
99 HA ILE 12 HA ILE 12 -21.991 -14.733 15.828
100 HB ILE 12 HB ILE 12 -21.147 -12.059 15.571
101 HG12 ILE 12 HG12 ILE 12 -19.004 -12.615 14.151
102 HG13 ILE 12 HG11 ILE 12 -20.190 -13.646 13.280
103 HG21 ILE 12 HG21 ILE 12 -18.884 -13.041 16.330
104 HG22 ILE 12 HG22 ILE 12 -19.592 -14.684 16.091
105 HG23 ILE 12 HG23 ILE 12 -20.296 -13.562 17.323
106 HD11 ILE 12 HD11 ILE 12 -21.791 -11.703 13.260
107 HD12 ILE 12 HD12 ILE 12 -20.287 -11.398 12.322
108 HD13 ILE 12 HD13 ILE 12 -20.484 -10.671 13.954
109 H LEU 13 HN LEU 13 -23.556 -13.364 13.364
110 HA LEU 13 HA LEU 13 -24.814 -11.371 14.960
111 HB2 LEU 13 HB2 LEU 13 -23.815 -11.801 12.334
112 HB3 LEU 13 HB1 LEU 13 -25.566 -11.296 12.228
113 HG LEU 13 HG LEU 13 -25.067 -9.306 13.655
114 HD11 LEU 13 HD11 LEU 13 -23.136 -9.020 14.858
115 HD12 LEU 13 HD12 LEU 13 -22.087 -9.507 13.473
116 HD13 LEU 13 HD13 LEU 13 -22.821 -10.771 14.535
117 HD21 LEU 13 HD21 LEU 13 -24.343 -8.016 11.894
118 HD22 LEU 13 HD22 LEU 13 -24.470 -9.560 10.975
119 HD23 LEU 13 HD23 LEU 13 -22.868 -9.019 11.610
120 H GLN 14 HN GLN 14 -25.071 -14.565 14.324
121 HA GLN 14 HA GLN 14 -27.840 -14.531 15.018
122 HB2 GLN 14 HB2 GLN 14 -26.833 -16.046 12.533
123 HB3 GLN 14 HB1 GLN 14 -28.414 -16.358 13.334
124 HG2 GLN 14 HG2 GLN 14 -29.119 -13.983 12.849
125 HG3 GLN 14 HG1 GLN 14 -27.551 -13.714 11.986
126 HE21 GLN 14 HE21 GLN 14 -28.316 -13.497 9.872
127 HE22 GLN 14 HE22 GLN 14 -29.131 -14.754 9.005
128 H ARG 15 HN ARG 15 -25.604 -14.783 16.431
129 HA ARG 15 HA ARG 15 -24.890 -17.566 16.517
130 HB2 ARG 15 HB2 ARG 15 -23.639 -15.081 17.152
131 HB3 ARG 15 HB1 ARG 15 -23.853 -15.945 18.719
132 HG2 ARG 15 HG2 ARG 15 -22.797 -18.020 17.621
133 HG3 ARG 15 HG1 ARG 15 -22.397 -16.984 16.197
134 HD2 ARG 15 HD2 ARG 15 -20.413 -16.736 17.398
135 HD3 ARG 15 HD1 ARG 15 -21.366 -15.391 18.169
136 HE ARG 15 HE ARG 15 -21.922 -17.806 19.610
137 HH11 ARG 15 HH11 ARG 15 -19.246 -15.568 18.891
138 HH12 ARG 15 HH12 ARG 15 -18.401 -15.859 20.375
139 HH21 ARG 15 HH21 ARG 15 -20.777 -18.208 21.621
140 HH22 ARG 15 HH22 ARG 15 -19.288 -17.387 21.955
141 H LYS 16 HN LYS 16 -26.768 -18.622 17.210
142 HA LYS 16 HA LYS 16 -28.295 -17.744 19.373
143 HB2 LYS 16 HB2 LYS 16 -27.807 -20.579 18.304
144 HB3 LYS 16 HB1 LYS 16 -29.038 -20.177 19.554
145 HG2 LYS 16 HG2 LYS 16 -30.170 -18.636 17.944
146 HG3 LYS 16 HG1 LYS 16 -28.944 -19.050 16.696
147 HD2 LYS 16 HD2 LYS 16 -29.661 -21.445 16.780
148 HD3 LYS 16 HD1 LYS 16 -30.879 -21.040 18.039
149 HE2 LYS 16 HE2 LYS 16 -32.061 -19.526 16.420
150 HE3 LYS 16 HE1 LYS 16 -30.829 -19.925 15.152
151 HZ1 LYS 16 HZ1 LYS 16 -33.127 -21.353 15.932
152 HZ2 LYS 16 HZ2 LYS 16 -31.758 -22.325 16.190
153 HZ3 LYS 16 HZ3 LYS 16 -32.047 -21.653 14.657
154 H LYS 17 HN LYS 17 -25.346 -19.703 19.056
155 HA LYS 17 HA LYS 17 -24.842 -19.248 21.853
156 HB2 LYS 17 HB2 LYS 17 -24.130 -21.851 21.969
157 HB3 LYS 17 HB1 LYS 17 -25.773 -21.313 22.453
158 HG2 LYS 17 HG2 LYS 17 -25.467 -21.947 19.529
159 HG3 LYS 17 HG1 LYS 17 -25.228 -23.337 20.640
160 HD2 LYS 17 HD2 LYS 17 -27.433 -22.931 21.690
161 HD3 LYS 17 HD1 LYS 17 -27.669 -21.454 20.694
162 HE2 LYS 17 HE2 LYS 17 -28.954 -23.260 19.655
163 HE3 LYS 17 HE1 LYS 17 -27.509 -22.968 18.600
164 HZ1 LYS 17 HZ1 LYS 17 -26.891 -24.848 20.615
165 HZ2 LYS 17 HZ2 LYS 17 -26.888 -25.024 18.926
166 HZ3 LYS 17 HZ3 LYS 17 -28.307 -25.325 19.809
Start of MODEL 10
1 H1 GLU 1 HT1 GLU 1 -15.074 -12.594 -3.308
2 H2 GLU 1 HT2 GLU 1 -14.568 -13.267 -4.784
3 H3 GLU 1 HT3 GLU 1 -14.240 -11.637 -4.436
4 HA GLU 1 HA GLU 1 -13.189 -13.919 -2.897
5 HB2 GLU 1 HB2 GLU 1 -12.276 -13.928 -5.219
6 HB3 GLU 1 HB1 GLU 1 -11.871 -12.186 -5.068
7 HG2 GLU 1 HG2 GLU 1 -9.819 -13.539 -4.778
8 HG3 GLU 1 HG1 GLU 1 -10.230 -12.751 -3.207
9 H MET 2 HN MET 2 -13.488 -12.920 -0.843
10 HA MET 2 HA MET 2 -11.729 -10.623 -0.478
11 HB2 MET 2 HB2 MET 2 -14.584 -10.865 0.606
12 HB3 MET 2 HB1 MET 2 -13.359 -9.720 1.254
13 HG2 MET 2 HG2 MET 2 -13.164 -8.743 -1.113
14 HG3 MET 2 HG1 MET 2 -14.560 -9.764 -1.582
15 HE1 MET 2 HE1 MET 2 -16.598 -9.872 -0.766
16 HE2 MET 2 HE2 MET 2 -17.612 -8.491 -0.225
17 HE3 MET 2 HE3 MET 2 -16.761 -9.508 0.987
18 H ARG 3 HN ARG 3 -11.445 -10.267 2.000
19 HA ARG 3 HA ARG 3 -10.601 -12.716 2.999
20 HB2 ARG 3 HB2 ARG 3 -9.506 -10.567 3.683
21 HB3 ARG 3 HB1 ARG 3 -11.035 -10.080 4.494
22 HG2 ARG 3 HG2 ARG 3 -10.841 -11.911 6.114
23 HG3 ARG 3 HG1 ARG 3 -9.429 -12.597 5.241
24 HD2 ARG 3 HD2 ARG 3 -9.438 -9.771 6.507
25 HD3 ARG 3 HD1 ARG 3 -8.810 -11.265 7.338
26 HE ARG 3 HE ARG 3 -7.577 -11.111 4.754
27 HH11 ARG 3 HH11 ARG 3 -7.744 -9.357 7.847
28 HH12 ARG 3 HH12 ARG 3 -6.140 -8.711 7.746
29 HH21 ARG 3 HH21 ARG 3 -5.394 -10.236 4.615
30 HH22 ARG 3 HH22 ARG 3 -4.781 -9.220 5.876
31 H LEU 4 HN LEU 4 -13.489 -10.698 3.518
32 HA LEU 4 HA LEU 4 -14.707 -13.028 4.745
33 HB2 LEU 4 HB2 LEU 4 -15.860 -11.479 6.455
34 HB3 LEU 4 HB1 LEU 4 -14.131 -11.844 6.778
35 HG LEU 4 HG LEU 4 -13.570 -9.651 5.531
36 HD11 LEU 4 HD11 LEU 4 -16.563 -9.544 5.423
37 HD12 LEU 4 HD12 LEU 4 -15.327 -8.700 4.420
38 HD13 LEU 4 HD13 LEU 4 -15.784 -8.035 6.036
39 HD21 LEU 4 HD21 LEU 4 -14.652 -10.057 8.286
40 HD22 LEU 4 HD22 LEU 4 -14.681 -8.341 7.728
41 HD23 LEU 4 HD23 LEU 4 -13.129 -9.264 7.731
42 H SER 5 HN SER 5 -17.163 -12.673 4.888
43 HA SER 5 HA SER 5 -18.275 -10.558 3.445
44 HB2 SER 5 HB2 SER 5 -19.191 -11.857 1.471
45 HB3 SER 5 HB1 SER 5 -17.395 -11.671 1.394
46 HG SER 5 HG SER 5 -18.924 -13.899 1.587
47 H DPP 6 HN DPP 6 -18.293 -13.701 5.011
48 HA DPP 6 HA DPP 6 -21.082 -13.158 5.676
49 HB2 DPP 6 HB2 DPP 6 -19.772 -15.875 4.999
50 HB3 DPP 6 HB3 DPP 6 -21.259 -15.165 4.267
51 H PHE 7 HN PHE 7 -19.567 -15.934 7.115
52 HA PHE 7 HA PHE 7 -18.978 -16.344 9.191
53 HB2 PHE 7 HB2 PHE 7 -16.746 -15.422 9.036
54 HB3 PHE 7 HB1 PHE 7 -17.375 -13.743 8.752
55 HD1 PHE 7 HD1 PHE 7 -18.575 -15.968 11.508
56 HD2 PHE 7 HD2 PHE 7 -16.111 -12.654 10.435
57 HE1 PHE 7 HE1 PHE 7 -18.535 -15.275 13.854
58 HE2 PHE 7 HE2 PHE 7 -15.969 -12.037 12.814
59 HZ PHE 7 HZ PHE 7 -17.158 -13.338 14.515
60 H PHE 8 HN PHE 8 -18.826 -12.939 9.935
61 HA PHE 8 HA PHE 8 -20.435 -13.398 12.142
62 HB2 PHE 8 HB2 PHE 8 -19.708 -11.281 12.865
63 HB3 PHE 8 HB1 PHE 8 -18.383 -11.855 11.845
64 HD1 PHE 8 HD1 PHE 8 -20.392 -9.232 12.624
65 HD2 PHE 8 HD2 PHE 8 -18.625 -11.251 9.367
66 HE1 PHE 8 HE1 PHE 8 -20.607 -7.257 11.317
67 HE2 PHE 8 HE2 PHE 8 -18.799 -9.278 8.029
68 HZ PHE 8 HZ PHE 8 -19.800 -7.241 8.991
69 H ARG 9 HN ARG 9 -21.148 -11.640 9.047
70 HA ARG 9 HA ARG 9 -23.519 -10.775 10.264
71 HB2 ARG 9 HB2 ARG 9 -24.390 -10.679 7.718
72 HB3 ARG 9 HB1 ARG 9 -23.193 -9.491 8.333
73 HG2 ARG 9 HG2 ARG 9 -21.969 -11.998 7.257
74 HG3 ARG 9 HG1 ARG 9 -22.906 -11.058 6.047
75 HD2 ARG 9 HD2 ARG 9 -21.296 -9.194 7.638
76 HD3 ARG 9 HD1 ARG 9 -20.228 -10.528 7.006
77 HE ARG 9 HE ARG 9 -21.728 -9.878 4.779
78 HH11 ARG 9 HH11 ARG 9 -19.947 -7.924 7.172
79 HH12 ARG 9 HH12 ARG 9 -19.530 -6.666 6.057
80 HH21 ARG 9 HH21 ARG 9 -21.161 -8.169 3.273
81 HH22 ARG 9 HH22 ARG 9 -20.232 -6.807 3.804
82 H GLN 10 HN GLN 10 -22.647 -13.928 9.828
83 HA GLN 10 HA GLN 10 -25.429 -14.541 10.067
84 HB2 GLN 10 HB2 GLN 10 -25.400 -16.399 8.484
85 HB3 GLN 10 HB1 GLN 10 -24.942 -14.895 7.626
86 HG2 GLN 10 HG2 GLN 10 -22.649 -16.530 8.748
87 HG3 GLN 10 HG1 GLN 10 -23.558 -17.265 7.375
88 HE21 GLN 10 HE21 GLN 10 -21.344 -16.965 6.383
89 H PHE 11 HN PHE 11 -22.872 -14.306 11.634
90 HA PHE 11 HA PHE 11 -23.045 -16.977 12.784
91 HB2 PHE 11 HB2 PHE 11 -20.761 -16.777 11.869
92 HB3 PHE 11 HB1 PHE 11 -20.605 -15.163 12.632
93 HD1 PHE 11 HD1 PHE 11 -20.175 -18.650 13.003
94 HD2 PHE 11 HD2 PHE 11 -20.743 -15.003 15.114
95 HE1 PHE 11 HE1 PHE 11 -19.273 -19.697 15.032
96 HE2 PHE 11 HE2 PHE 11 -19.814 -16.052 17.149
97 HZ PHE 11 HZ PHE 11 -19.082 -18.397 17.108
98 H ILE 12 HN ILE 12 -22.322 -13.503 13.263
99 HA ILE 12 HA ILE 12 -22.913 -13.840 16.049
100 HB ILE 12 HB ILE 12 -23.084 -11.100 15.422
101 HG12 ILE 12 HG12 ILE 12 -20.619 -10.943 14.488
102 HG13 ILE 12 HG11 ILE 12 -21.162 -12.426 13.636
103 HG21 ILE 12 HG21 ILE 12 -20.819 -11.016 16.678
104 HG22 ILE 12 HG22 ILE 12 -20.844 -12.821 16.680
105 HG23 ILE 12 HG23 ILE 12 -22.139 -11.895 17.538
106 HD11 ILE 12 HD11 ILE 12 -23.292 -11.234 13.017
107 HD12 ILE 12 HD12 ILE 12 -21.820 -10.503 12.288
108 HD13 ILE 12 HD13 ILE 12 -22.595 -9.720 13.709
109 H LEU 13 HN LEU 13 -24.258 -13.370 13.131
110 HA LEU 13 HA LEU 13 -26.482 -11.919 14.139
111 HB2 LEU 13 HB2 LEU 13 -24.840 -12.177 11.820
112 HB3 LEU 13 HB1 LEU 13 -26.593 -12.354 11.349
113 HG LEU 13 HG LEU 13 -27.141 -10.191 12.372
114 HD11 LEU 13 HD11 LEU 13 -24.790 -10.663 14.001
115 HD12 LEU 13 HD12 LEU 13 -25.957 -9.290 14.098
116 HD13 LEU 13 HD13 LEU 13 -24.484 -9.149 13.068
117 HD21 LEU 13 HD21 LEU 13 -26.295 -8.852 10.696
118 HD22 LEU 13 HD22 LEU 13 -25.683 -10.423 10.059
119 HD23 LEU 13 HD23 LEU 13 -24.584 -9.340 11.002
120 H GLN 14 HN GLN 14 -25.441 -14.985 14.101
121 HA GLN 14 HA GLN 14 -28.099 -15.981 14.277
122 HB2 GLN 14 HB2 GLN 14 -26.115 -17.189 12.251
123 HB3 GLN 14 HB1 GLN 14 -27.604 -18.020 12.826
124 HG2 GLN 14 HG2 GLN 14 -29.004 -16.144 11.869
125 HG3 GLN 14 HG1 GLN 14 -27.496 -15.376 11.229
126 HE21 GLN 14 HE21 GLN 14 -27.862 -15.658 9.015
127 HE22 GLN 14 HE22 GLN 14 -27.968 -17.205 8.245
128 H ARG 15 HN ARG 15 -26.331 -15.252 16.088
129 HA ARG 15 HA ARG 15 -24.604 -17.479 16.680
130 HB2 ARG 15 HB2 ARG 15 -24.535 -14.685 17.101
131 HB3 ARG 15 HB1 ARG 15 -24.820 -15.376 18.736
132 HG2 ARG 15 HG2 ARG 15 -22.843 -16.949 18.349
133 HG3 ARG 15 HG1 ARG 15 -22.503 -16.067 16.808
134 HD2 ARG 15 HD2 ARG 15 -21.098 -14.884 18.259
135 HD3 ARG 15 HD1 ARG 15 -22.622 -13.914 18.471
136 HE ARG 15 HE ARG 15 -22.699 -16.049 20.370
137 HH11 ARG 15 HH11 ARG 15 -20.775 -13.162 19.563
138 HH12 ARG 15 HH12 ARG 15 -20.295 -12.836 21.194
139 HH21 ARG 15 HH21 ARG 15 -22.044 -15.606 22.590
140 HH22 ARG 15 HH22 ARG 15 -21.027 -14.251 22.944
141 H LYS 16 HN LYS 16 -26.181 -19.152 17.140
142 HA LYS 16 HA LYS 16 -27.799 -18.557 19.505
143 HB2 LYS 16 HB2 LYS 16 -28.874 -19.704 17.441
144 HB3 LYS 16 HB1 LYS 16 -27.826 -21.119 17.816
145 HG2 LYS 16 HG2 LYS 16 -28.835 -21.288 20.085
146 HG3 LYS 16 HG1 LYS 16 -29.858 -19.853 19.750
147 HD2 LYS 16 HD2 LYS 16 -30.963 -21.084 17.863
148 HD3 LYS 16 HD1 LYS 16 -29.942 -22.523 18.210
149 HE2 LYS 16 HE2 LYS 16 -30.966 -22.712 20.494
150 HE3 LYS 16 HE1 LYS 16 -31.986 -21.251 20.156
151 HZ1 LYS 16 HZ1 LYS 16 -32.657 -23.809 19.652
152 HZ2 LYS 16 HZ2 LYS 16 -32.128 -23.289 18.125
153 HZ3 LYS 16 HZ3 LYS 16 -33.359 -22.442 18.931
154 H LYS 17 HN LYS 17 -25.245 -18.442 20.169
155 HA LYS 17 HA LYS 17 -23.694 -19.332 21.490
156 HB2 LYS 17 HB2 LYS 17 -25.841 -21.426 22.178
157 HB3 LYS 17 HB1 LYS 17 -24.344 -21.109 23.124
158 HG2 LYS 17 HG2 LYS 17 -25.166 -19.177 24.076
159 HG3 LYS 17 HG1 LYS 17 -26.099 -18.710 22.612
160 HD2 LYS 17 HD2 LYS 17 -27.822 -20.412 23.130
161 HD3 LYS 17 HD1 LYS 17 -26.879 -20.965 24.563
162 HE2 LYS 17 HE2 LYS 17 -27.182 -18.741 25.655
163 HE3 LYS 17 HE1 LYS 17 -28.047 -18.120 24.187
164 HZ1 LYS 17 HZ1 LYS 17 -29.890 -19.027 24.900
165 HZ2 LYS 17 HZ2 LYS 17 -29.115 -19.440 26.354
166 HZ3 LYS 17 HZ3 LYS 17 -29.182 -20.560 25.080
Start of MODEL 11
1 H1 GLU 1 HT1 GLU 1 -10.648 -6.665 -0.497
2 H2 GLU 1 HT2 GLU 1 -12.271 -6.823 -0.024
3 H3 GLU 1 HT3 GLU 1 -11.305 -8.207 -0.220
4 HA GLU 1 HA GLU 1 -9.850 -6.900 1.540
5 HB2 GLU 1 HB2 GLU 1 -11.673 -5.098 1.618
6 HB3 GLU 1 HB1 GLU 1 -12.774 -6.343 2.306
7 HG2 GLU 1 HG2 GLU 1 -11.253 -6.626 4.283
8 HG3 GLU 1 HG1 GLU 1 -10.121 -5.395 3.592
9 H MET 2 HN MET 2 -12.907 -8.778 1.193
10 HA MET 2 HA MET 2 -11.701 -10.738 3.003
11 HB2 MET 2 HB2 MET 2 -14.679 -9.997 2.924
12 HB3 MET 2 HB1 MET 2 -13.943 -11.308 3.909
13 HG2 MET 2 HG2 MET 2 -12.636 -9.641 5.209
14 HG3 MET 2 HG1 MET 2 -13.307 -8.312 4.211
15 HE1 MET 2 HE1 MET 2 -13.238 -8.093 7.109
16 HE2 MET 2 HE2 MET 2 -14.891 -7.632 7.645
17 HE3 MET 2 HE3 MET 2 -14.191 -6.899 6.159
18 H ARG 3 HN ARG 3 -12.524 -12.956 2.581
19 HA ARG 3 HA ARG 3 -13.688 -13.083 -0.097
20 HB2 ARG 3 HB2 ARG 3 -12.320 -15.571 0.676
21 HB3 ARG 3 HB1 ARG 3 -12.078 -14.573 -0.799
22 HG2 ARG 3 HG2 ARG 3 -9.971 -14.333 0.076
23 HG3 ARG 3 HG1 ARG 3 -10.748 -12.992 0.980
24 HD2 ARG 3 HD2 ARG 3 -9.596 -14.193 2.699
25 HD3 ARG 3 HD1 ARG 3 -11.273 -14.895 2.807
26 HE ARG 3 HE ARG 3 -9.709 -16.415 0.906
27 HH11 ARG 3 HH11 ARG 3 -10.031 -15.696 4.379
28 HH12 ARG 3 HH12 ARG 3 -9.434 -17.231 4.910
29 HH21 ARG 3 HH21 ARG 3 -8.896 -18.505 1.627
30 HH22 ARG 3 HH22 ARG 3 -8.777 -18.856 3.318
31 H LEU 4 HN LEU 4 -14.681 -12.993 2.798
32 HA LEU 4 HA LEU 4 -15.832 -15.646 2.968
33 HB2 LEU 4 HB2 LEU 4 -15.763 -13.264 4.879
34 HB3 LEU 4 HB1 LEU 4 -16.870 -14.660 5.146
35 HG LEU 4 HG LEU 4 -13.840 -14.907 4.779
36 HD11 LEU 4 HD11 LEU 4 -13.741 -15.322 7.254
37 HD12 LEU 4 HD12 LEU 4 -15.486 -14.882 7.385
38 HD13 LEU 4 HD13 LEU 4 -14.282 -13.647 6.852
39 HD21 LEU 4 HD21 LEU 4 -14.300 -17.099 4.483
40 HD22 LEU 4 HD22 LEU 4 -16.060 -16.835 4.802
41 HD23 LEU 4 HD23 LEU 4 -14.926 -17.159 6.175
42 H SER 5 HN SER 5 -18.206 -15.704 3.676
43 HA SER 5 HA SER 5 -19.654 -13.736 2.073
44 HB2 SER 5 HB2 SER 5 -19.413 -16.173 1.069
45 HB3 SER 5 HB1 SER 5 -20.513 -16.661 2.413
46 HG SER 5 HG SER 5 -20.989 -15.150 0.127
47 H DPP 6 HN DPP 6 -22.244 -15.140 2.884
48 HA DPP 6 HA DPP 6 -22.422 -13.745 5.365
49 HB2 DPP 6 HB2 DPP 6 -24.560 -15.599 4.149
50 HB3 DPP 6 HB3 DPP 6 -24.405 -13.851 3.740
51 H PHE 7 HN PHE 7 -20.497 -15.291 6.042
52 HA PHE 7 HA PHE 7 -21.687 -17.644 7.344
53 HB2 PHE 7 HB2 PHE 7 -19.524 -18.482 6.716
54 HB3 PHE 7 HB1 PHE 7 -18.828 -16.807 6.618
55 HD1 PHE 7 HD1 PHE 7 -20.544 -18.462 9.534
56 HD2 PHE 7 HD2 PHE 7 -16.924 -16.902 7.917
57 HE1 PHE 7 HE1 PHE 7 -19.556 -18.484 11.771
58 HE2 PHE 7 HE2 PHE 7 -15.903 -17.042 10.152
59 HZ PHE 7 HZ PHE 7 -17.202 -17.839 12.066
60 H PHE 8 HN PHE 8 -19.111 -15.426 8.259
61 HA PHE 8 HA PHE 8 -19.939 -15.421 10.903
62 HB2 PHE 8 HB2 PHE 8 -17.934 -14.195 11.297
63 HB3 PHE 8 HB1 PHE 8 -17.563 -15.218 9.893
64 HD1 PHE 8 HD1 PHE 8 -17.380 -12.095 11.227
65 HD2 PHE 8 HD2 PHE 8 -18.152 -14.170 7.632
66 HE1 PHE 8 HE1 PHE 8 -16.888 -10.122 10.014
67 HE2 PHE 8 HE2 PHE 8 -17.636 -12.211 6.358
68 HZ PHE 8 HZ PHE 8 -16.992 -10.141 7.552
69 H ARG 9 HN ARG 9 -20.254 -12.848 8.332
70 HA ARG 9 HA ARG 9 -21.207 -11.153 10.324
71 HB2 ARG 9 HB2 ARG 9 -22.385 -9.866 8.393
72 HB3 ARG 9 HB1 ARG 9 -20.595 -9.986 8.341
73 HG2 ARG 9 HG2 ARG 9 -22.020 -12.236 6.976
74 HG3 ARG 9 HG1 ARG 9 -22.314 -10.616 6.255
75 HD2 ARG 9 HD2 ARG 9 -19.589 -10.464 6.612
76 HD3 ARG 9 HD1 ARG 9 -19.783 -12.259 6.361
77 HE ARG 9 HE ARG 9 -21.344 -11.196 4.334
78 HH11 ARG 9 HH11 ARG 9 -18.031 -10.542 5.477
79 HH12 ARG 9 HH12 ARG 9 -17.405 -10.155 3.909
80 HH21 ARG 9 HH21 ARG 9 -20.490 -10.666 2.209
81 HH22 ARG 9 HH22 ARG 9 -18.825 -10.229 2.022
82 H GLN 10 HN GLN 10 -22.626 -14.035 9.362
83 HA GLN 10 HA GLN 10 -25.068 -12.986 10.505
84 HB2 GLN 10 HB2 GLN 10 -24.936 -14.887 8.102
85 HB3 GLN 10 HB1 GLN 10 -26.444 -14.402 8.949
86 HG2 GLN 10 HG2 GLN 10 -26.642 -12.620 7.548
87 HG3 GLN 10 HG1 GLN 10 -25.106 -11.976 8.235
88 HE21 GLN 10 HE21 GLN 10 -25.509 -15.016 6.247
89 H PHE 11 HN PHE 11 -22.593 -14.534 11.188
90 HA PHE 11 HA PHE 11 -24.044 -16.798 12.341
91 HB2 PHE 11 HB2 PHE 11 -22.407 -17.687 10.677
92 HB3 PHE 11 HB1 PHE 11 -21.119 -16.736 11.490
93 HD1 PHE 11 HD1 PHE 11 -22.885 -19.777 11.356
94 HD2 PHE 11 HD2 PHE 11 -20.668 -17.190 13.899
95 HE1 PHE 11 HE1 PHE 11 -22.442 -21.666 12.871
96 HE2 PHE 11 HE2 PHE 11 -20.203 -19.093 15.411
97 HZ PHE 11 HZ PHE 11 -21.093 -21.325 14.898
98 H ILE 12 HN ILE 12 -21.177 -14.645 12.579
99 HA ILE 12 HA ILE 12 -21.128 -15.155 15.400
100 HB ILE 12 HB ILE 12 -19.707 -12.774 14.904
101 HG12 ILE 12 HG12 ILE 12 -18.013 -13.833 13.199
102 HG13 ILE 12 HG11 ILE 12 -19.527 -14.557 12.565
103 HG21 ILE 12 HG21 ILE 12 -18.649 -15.674 15.178
104 HG22 ILE 12 HG22 ILE 12 -19.084 -14.578 16.550
105 HG23 ILE 12 HG23 ILE 12 -17.692 -14.171 15.476
106 HD11 ILE 12 HD11 ILE 12 -19.248 -12.361 11.529
107 HD12 ILE 12 HD12 ILE 12 -19.000 -11.595 13.133
108 HD13 ILE 12 HD13 ILE 12 -20.613 -12.287 12.694
109 H LEU 13 HN LEU 13 -22.673 -13.437 13.151
110 HA LEU 13 HA LEU 13 -23.143 -11.199 14.842
111 HB2 LEU 13 HB2 LEU 13 -22.683 -11.860 12.114
112 HB3 LEU 13 HB1 LEU 13 -24.239 -10.916 12.251
113 HG LEU 13 HG LEU 13 -23.049 -9.113 13.481
114 HD11 LEU 13 HD11 LEU 13 -21.143 -11.143 14.102
115 HD12 LEU 13 HD12 LEU 13 -21.024 -9.386 14.500
116 HD13 LEU 13 HD13 LEU 13 -20.264 -10.022 12.992
117 HD21 LEU 13 HD21 LEU 13 -22.857 -9.572 10.763
118 HD22 LEU 13 HD22 LEU 13 -21.109 -9.456 11.198
119 HD23 LEU 13 HD23 LEU 13 -22.233 -8.097 11.586
120 H GLN 14 HN GLN 14 -24.289 -14.226 14.360
121 HA GLN 14 HA GLN 14 -26.840 -13.443 15.391
122 HB2 GLN 14 HB2 GLN 14 -26.567 -15.228 12.899
123 HB3 GLN 14 HB1 GLN 14 -28.061 -15.123 13.899
124 HG2 GLN 14 HG2 GLN 14 -28.217 -12.655 13.388
125 HG3 GLN 14 HG1 GLN 14 -26.758 -12.802 12.328
126 HE21 GLN 14 HE21 GLN 14 -27.730 -12.426 10.320
127 HE22 GLN 14 HE22 GLN 14 -28.931 -13.458 9.621
128 H ARG 15 HN ARG 15 -24.507 -14.291 16.486
129 HA ARG 15 HA ARG 15 -24.645 -17.154 16.739
130 HB2 ARG 15 HB2 ARG 15 -22.653 -15.086 17.005
131 HB3 ARG 15 HB1 ARG 15 -22.817 -15.886 18.611
132 HG2 ARG 15 HG2 ARG 15 -22.526 -18.145 17.453
133 HG3 ARG 15 HG1 ARG 15 -22.196 -17.272 15.911
134 HD2 ARG 15 HD2 ARG 15 -20.008 -17.180 16.529
135 HD3 ARG 15 HD1 ARG 15 -20.486 -16.039 17.860
136 HE ARG 15 HE ARG 15 -21.031 -18.655 18.820
137 HH11 ARG 15 HH11 ARG 15 -18.265 -16.746 17.643
138 HH12 ARG 15 HH12 ARG 15 -17.087 -17.565 18.613
139 HH21 ARG 15 HH21 ARG 15 -19.429 -19.772 20.140
140 HH22 ARG 15 HH22 ARG 15 -17.761 -19.315 20.057
141 H LYS 16 HN LYS 16 -26.701 -17.437 17.762
142 HA LYS 16 HA LYS 16 -27.046 -16.069 20.302
143 HB2 LYS 16 HB2 LYS 16 -28.835 -18.117 18.865
144 HB3 LYS 16 HB1 LYS 16 -29.277 -17.195 20.349
145 HG2 LYS 16 HG2 LYS 16 -29.058 -15.052 19.085
146 HG3 LYS 16 HG1 LYS 16 -28.627 -15.977 17.605
147 HD2 LYS 16 HD2 LYS 16 -30.858 -17.117 17.669
148 HD3 LYS 16 HD1 LYS 16 -31.289 -16.192 19.150
149 HE2 LYS 16 HE2 LYS 16 -31.111 -14.039 17.869
150 HE3 LYS 16 HE1 LYS 16 -30.664 -14.967 16.376
151 HZ1 LYS 16 HZ1 LYS 16 -33.192 -14.378 17.365
152 HZ2 LYS 16 HZ2 LYS 16 -32.997 -16.058 17.512
153 HZ3 LYS 16 HZ3 LYS 16 -32.777 -15.306 16.005
154 H LYS 17 HN LYS 17 -25.325 -18.630 19.148
155 HA LYS 17 HA LYS 17 -24.376 -20.391 20.115
156 HB2 LYS 17 HB2 LYS 17 -25.307 -18.878 22.558
157 HB3 LYS 17 HB1 LYS 17 -25.001 -20.630 22.800
158 HG2 LYS 17 HG2 LYS 17 -22.963 -19.460 23.342
159 HG3 LYS 17 HG1 LYS 17 -22.695 -20.315 21.784
160 HD2 LYS 17 HD2 LYS 17 -22.995 -18.237 20.516
161 HD3 LYS 17 HD1 LYS 17 -23.505 -17.350 21.994
162 HE2 LYS 17 HE2 LYS 17 -21.220 -17.664 22.983
163 HE3 LYS 17 HE1 LYS 17 -20.707 -18.580 21.505
164 HZ1 LYS 17 HZ1 LYS 17 -20.661 -16.718 20.278
165 HZ2 LYS 17 HZ2 LYS 17 -20.330 -16.015 21.791
166 HZ3 LYS 17 HZ3 LYS 17 -21.897 -15.932 21.139
Start of MODEL 12
1 H1 GLU 1 HT1 GLU 1 -12.641 -6.993 -0.105
2 H2 GLU 1 HT2 GLU 1 -11.593 -8.331 -0.136
3 H3 GLU 1 HT3 GLU 1 -11.003 -6.781 -0.506
4 HA GLU 1 HA GLU 1 -10.337 -6.722 1.577
5 HB2 GLU 1 HB2 GLU 1 -13.362 -6.503 2.100
6 HB3 GLU 1 HB1 GLU 1 -12.072 -5.924 3.211
7 HG2 GLU 1 HG2 GLU 1 -12.503 -4.857 0.336
8 HG3 GLU 1 HG1 GLU 1 -13.123 -4.064 1.836
9 H MET 2 HN MET 2 -13.178 -8.951 1.333
10 HA MET 2 HA MET 2 -11.762 -10.663 3.245
11 HB2 MET 2 HB2 MET 2 -14.807 -10.320 3.065
12 HB3 MET 2 HB1 MET 2 -13.937 -11.476 4.133
13 HG2 MET 2 HG2 MET 2 -13.745 -8.404 4.293
14 HG3 MET 2 HG1 MET 2 -14.766 -9.437 5.342
15 HE1 MET 2 HE1 MET 2 -12.051 -8.085 7.744
16 HE2 MET 2 HE2 MET 2 -13.778 -8.129 7.246
17 HE3 MET 2 HE3 MET 2 -12.578 -7.235 6.250
18 H ARG 3 HN ARG 3 -12.385 -12.975 2.995
19 HA ARG 3 HA ARG 3 -13.298 -13.430 0.258
20 HB2 ARG 3 HB2 ARG 3 -12.068 -15.689 0.498
21 HB3 ARG 3 HB1 ARG 3 -11.007 -14.244 0.351
22 HG2 ARG 3 HG2 ARG 3 -10.454 -14.247 2.672
23 HG3 ARG 3 HG1 ARG 3 -11.847 -15.296 3.102
24 HD2 ARG 3 HD2 ARG 3 -9.776 -16.634 3.226
25 HD3 ARG 3 HD1 ARG 3 -10.722 -17.195 1.776
26 HE ARG 3 HE ARG 3 -8.900 -15.085 0.993
27 HH11 ARG 3 HH11 ARG 3 -9.028 -18.479 2.065
28 HH12 ARG 3 HH12 ARG 3 -7.594 -18.961 1.221
29 HH21 ARG 3 HH21 ARG 3 -6.949 -15.739 -0.156
30 HH22 ARG 3 HH22 ARG 3 -6.392 -17.376 -0.064
31 H LEU 4 HN LEU 4 -14.902 -13.000 2.683
32 HA LEU 4 HA LEU 4 -15.941 -15.720 2.938
33 HB2 LEU 4 HB2 LEU 4 -15.837 -13.480 5.019
34 HB3 LEU 4 HB1 LEU 4 -16.903 -14.924 5.186
35 HG LEU 4 HG LEU 4 -13.867 -15.036 4.797
36 HD11 LEU 4 HD11 LEU 4 -13.803 -15.727 7.236
37 HD12 LEU 4 HD12 LEU 4 -15.538 -15.252 7.373
38 HD13 LEU 4 HD13 LEU 4 -14.293 -14.010 6.966
39 HD21 LEU 4 HD21 LEU 4 -15.998 -17.042 4.596
40 HD22 LEU 4 HD22 LEU 4 -14.892 -17.449 5.971
41 HD23 LEU 4 HD23 LEU 4 -14.218 -17.213 4.311
42 H SER 5 HN SER 5 -18.276 -15.813 3.483
43 HA SER 5 HA SER 5 -19.633 -13.680 2.010
44 HB2 SER 5 HB2 SER 5 -19.515 -16.131 1.006
45 HB3 SER 5 HB1 SER 5 -20.657 -16.552 2.339
46 HG SER 5 HG SER 5 -21.051 -15.141 0.013
47 H DPP 6 HN DPP 6 -22.296 -14.944 2.816
48 HA DPP 6 HA DPP 6 -22.386 -13.571 5.317
49 HB2 DPP 6 HB2 DPP 6 -24.635 -15.273 4.073
50 HB3 DPP 6 HB3 DPP 6 -24.377 -13.529 3.701
51 H PHE 7 HN PHE 7 -20.549 -15.264 5.934
52 HA PHE 7 HA PHE 7 -21.874 -17.560 7.199
53 HB2 PHE 7 HB2 PHE 7 -19.762 -18.505 6.552
54 HB3 PHE 7 HB1 PHE 7 -18.976 -16.871 6.488
55 HD1 PHE 7 HD1 PHE 7 -20.773 -18.461 9.389
56 HD2 PHE 7 HD2 PHE 7 -17.064 -17.135 7.765
57 HE1 PHE 7 HE1 PHE 7 -19.772 -18.588 11.616
58 HE2 PHE 7 HE2 PHE 7 -16.039 -17.380 9.987
59 HZ PHE 7 HZ PHE 7 -17.376 -18.113 11.900
60 H PHE 8 HN PHE 8 -19.180 -15.510 8.161
61 HA PHE 8 HA PHE 8 -20.012 -15.527 10.803
62 HB2 PHE 8 HB2 PHE 8 -17.941 -14.433 11.230
63 HB3 PHE 8 HB1 PHE 8 -17.630 -15.444 9.802
64 HD1 PHE 8 HD1 PHE 8 -17.266 -12.373 11.215
65 HD2 PHE 8 HD2 PHE 8 -18.141 -14.306 7.565
66 HE1 PHE 8 HE1 PHE 8 -16.646 -10.404 10.056
67 HE2 PHE 8 HE2 PHE 8 -17.499 -12.347 6.341
68 HZ PHE 8 HZ PHE 8 -16.735 -10.353 7.594
69 H ARG 9 HN ARG 9 -20.180 -12.858 8.311
70 HA ARG 9 HA ARG 9 -21.042 -11.185 10.366
71 HB2 ARG 9 HB2 ARG 9 -22.156 -9.769 8.472
72 HB3 ARG 9 HB1 ARG 9 -20.371 -9.960 8.441
73 HG2 ARG 9 HG2 ARG 9 -21.962 -12.042 6.949
74 HG3 ARG 9 HG1 ARG 9 -21.988 -10.376 6.275
75 HD2 ARG 9 HD2 ARG 9 -19.295 -10.608 6.774
76 HD3 ARG 9 HD1 ARG 9 -19.711 -12.354 6.482
77 HE ARG 9 HE ARG 9 -20.263 -11.819 4.225
78 HH11 ARG 9 HH11 ARG 9 -19.675 -8.887 6.166
79 HH12 ARG 9 HH12 ARG 9 -19.576 -7.821 4.805
80 HH21 ARG 9 HH21 ARG 9 -20.127 -10.370 2.379
81 HH22 ARG 9 HH22 ARG 9 -19.838 -8.680 2.616
82 H GLN 10 HN GLN 10 -22.619 -13.946 9.304
83 HA GLN 10 HA GLN 10 -24.995 -12.800 10.496
84 HB2 GLN 10 HB2 GLN 10 -25.000 -14.633 8.036
85 HB3 GLN 10 HB1 GLN 10 -26.464 -14.055 8.902
86 HG2 GLN 10 HG2 GLN 10 -26.530 -12.235 7.538
87 HG3 GLN 10 HG1 GLN 10 -24.954 -11.719 8.243
88 HE21 GLN 10 HE21 GLN 10 -25.548 -14.678 6.184
89 H PHE 11 HN PHE 11 -22.615 -14.497 11.131
90 HA PHE 11 HA PHE 11 -24.188 -16.717 12.206
91 HB2 PHE 11 HB2 PHE 11 -22.613 -17.647 10.507
92 HB3 PHE 11 HB1 PHE 11 -21.269 -16.798 11.340
93 HD1 PHE 11 HD1 PHE 11 -23.217 -19.725 11.127
94 HD2 PHE 11 HD2 PHE 11 -20.832 -17.358 13.731
95 HE1 PHE 11 HE1 PHE 11 -22.904 -21.676 12.594
96 HE2 PHE 11 HE2 PHE 11 -20.500 -19.324 15.196
97 HZ PHE 11 HZ PHE 11 -21.535 -21.478 14.627
98 H ILE 12 HN ILE 12 -21.212 -14.728 12.502
99 HA ILE 12 HA ILE 12 -21.187 -15.335 15.306
100 HB ILE 12 HB ILE 12 -19.620 -13.035 14.885
101 HG12 ILE 12 HG12 ILE 12 -18.001 -14.134 13.135
102 HG13 ILE 12 HG11 ILE 12 -19.559 -14.744 12.485
103 HG21 ILE 12 HG21 ILE 12 -19.005 -14.807 16.484
104 HG22 ILE 12 HG22 ILE 12 -17.674 -14.682 15.273
105 HG23 ILE 12 HG23 ILE 12 -18.874 -16.026 15.157
106 HD11 ILE 12 HD11 ILE 12 -19.143 -12.532 11.523
107 HD12 ILE 12 HD12 ILE 12 -18.859 -11.838 13.154
108 HD13 ILE 12 HD13 ILE 12 -20.507 -12.420 12.688
109 H LEU 13 HN LEU 13 -22.653 -13.476 13.127
110 HA LEU 13 HA LEU 13 -22.979 -11.260 14.884
111 HB2 LEU 13 HB2 LEU 13 -22.553 -11.858 12.135
112 HB3 LEU 13 HB1 LEU 13 -24.051 -10.830 12.302
113 HG LEU 13 HG LEU 13 -22.758 -9.142 13.592
114 HD11 LEU 13 HD11 LEU 13 -20.749 -9.562 14.592
115 HD12 LEU 13 HD12 LEU 13 -20.031 -10.189 13.060
116 HD13 LEU 13 HD13 LEU 13 -20.968 -11.296 14.134
117 HD21 LEU 13 HD21 LEU 13 -22.608 -9.510 10.863
118 HD22 LEU 13 HD22 LEU 13 -20.853 -9.526 11.285
119 HD23 LEU 13 HD23 LEU 13 -21.880 -8.110 11.731
120 H GLN 14 HN GLN 14 -24.288 -14.195 14.299
121 HA GLN 14 HA GLN 14 -26.795 -13.338 15.373
122 HB2 GLN 14 HB2 GLN 14 -26.641 -15.036 12.806
123 HB3 GLN 14 HB1 GLN 14 -28.126 -14.839 13.805
124 HG2 GLN 14 HG2 GLN 14 -28.099 -12.361 13.352
125 HG3 GLN 14 HG1 GLN 14 -26.636 -12.580 12.311
126 HE21 GLN 14 HE21 GLN 14 -28.714 -11.492 11.002
127 HE22 GLN 14 HE22 GLN 14 -29.521 -12.633 9.981
128 H ARG 15 HN ARG 15 -24.554 -14.307 16.453
129 HA ARG 15 HA ARG 15 -24.746 -17.178 16.496
130 HB2 ARG 15 HB2 ARG 15 -22.690 -15.230 16.856
131 HB3 ARG 15 HB1 ARG 15 -22.914 -16.021 18.460
132 HG2 ARG 15 HG2 ARG 15 -22.751 -18.294 17.271
133 HG3 ARG 15 HG1 ARG 15 -22.284 -17.406 15.768
134 HD2 ARG 15 HD2 ARG 15 -20.154 -17.825 16.631
135 HD3 ARG 15 HD1 ARG 15 -20.497 -16.258 17.488
136 HE ARG 15 HE ARG 15 -21.546 -18.383 19.098
137 HH11 ARG 15 HH11 ARG 15 -18.449 -17.125 17.865
138 HH12 ARG 15 HH12 ARG 15 -17.512 -17.686 19.208
139 HH21 ARG 15 HH21 ARG 15 -20.278 -19.147 20.920
140 HH22 ARG 15 HH22 ARG 15 -18.570 -18.857 20.978
141 H LYS 16 HN LYS 16 -26.748 -17.576 17.502
142 HA LYS 16 HA LYS 16 -27.519 -16.316 19.874
143 HB2 LYS 16 HB2 LYS 16 -28.192 -19.111 18.796
144 HB3 LYS 16 HB1 LYS 16 -28.989 -18.368 20.229
145 HG2 LYS 16 HG2 LYS 16 -29.795 -16.480 18.804
146 HG3 LYS 16 HG1 LYS 16 -29.006 -17.230 17.374
147 HD2 LYS 16 HD2 LYS 16 -30.460 -19.251 17.628
148 HD3 LYS 16 HD1 LYS 16 -31.242 -18.512 19.067
149 HE2 LYS 16 HE2 LYS 16 -32.103 -16.629 17.644
150 HE3 LYS 16 HE1 LYS 16 -31.305 -17.367 16.193
151 HZ1 LYS 16 HZ1 LYS 16 -32.860 -19.301 17.535
152 HZ2 LYS 16 HZ2 LYS 16 -33.016 -18.684 15.960
153 HZ3 LYS 16 HZ3 LYS 16 -33.804 -17.917 17.255
154 H LYS 17 HN LYS 17 -25.490 -19.130 19.101
155 HA LYS 17 HA LYS 17 -24.566 -19.061 21.857
156 HB2 LYS 17 HB2 LYS 17 -26.120 -21.325 20.629
157 HB3 LYS 17 HB1 LYS 17 -24.574 -21.807 21.412
158 HG2 LYS 17 HG2 LYS 17 -25.958 -21.973 23.250
159 HG3 LYS 17 HG1 LYS 17 -25.512 -20.239 23.405
160 HD2 LYS 17 HD2 LYS 17 -27.650 -19.799 21.905
161 HD3 LYS 17 HD1 LYS 17 -28.112 -21.476 22.357
162 HE2 LYS 17 HE2 LYS 17 -29.188 -20.083 23.997
163 HE3 LYS 17 HE1 LYS 17 -27.714 -20.705 24.851
164 HZ1 LYS 17 HZ1 LYS 17 -26.935 -18.673 25.018
165 HZ2 LYS 17 HZ2 LYS 17 -28.449 -18.100 24.509
166 HZ3 LYS 17 HZ3 LYS 17 -27.194 -18.306 23.377
Start of MODEL 13
1 H1 GLU 1 HT1 GLU 1 -9.433 -7.380 2.942
2 H2 GLU 1 HT2 GLU 1 -9.574 -7.212 1.257
3 H3 GLU 1 HT3 GLU 1 -8.277 -6.484 2.077
4 HA GLU 1 HA GLU 1 -7.919 -8.658 0.797
5 HB2 GLU 1 HB2 GLU 1 -6.134 -9.321 2.415
6 HB3 GLU 1 HB1 GLU 1 -6.194 -7.537 2.192
7 HG2 GLU 1 HG2 GLU 1 -7.551 -7.332 4.328
8 HG3 GLU 1 HG1 GLU 1 -7.394 -9.117 4.569
9 H MET 2 HN MET 2 -10.661 -8.845 2.232
10 HA MET 2 HA MET 2 -10.323 -11.669 2.942
11 HB2 MET 2 HB2 MET 2 -12.170 -9.654 4.344
12 HB3 MET 2 HB1 MET 2 -12.182 -11.430 4.613
13 HG2 MET 2 HG2 MET 2 -9.844 -11.332 5.473
14 HG3 MET 2 HG1 MET 2 -9.798 -9.565 5.177
15 HE1 MET 2 HE1 MET 2 -9.706 -9.778 9.024
16 HE2 MET 2 HE2 MET 2 -9.033 -9.018 7.539
17 HE3 MET 2 HE3 MET 2 -8.926 -10.799 7.767
18 H ARG 3 HN ARG 3 -12.240 -12.968 2.437
19 HA ARG 3 HA ARG 3 -14.216 -11.481 0.924
20 HB2 ARG 3 HB2 ARG 3 -12.591 -12.540 -0.731
21 HB3 ARG 3 HB1 ARG 3 -12.943 -14.132 0.033
22 HG2 ARG 3 HG2 ARG 3 -15.374 -12.614 -0.811
23 HG3 ARG 3 HG1 ARG 3 -14.279 -13.057 -2.164
24 HD2 ARG 3 HD2 ARG 3 -15.240 -15.111 -0.053
25 HD3 ARG 3 HD1 ARG 3 -16.105 -14.804 -1.626
26 HE ARG 3 HE ARG 3 -13.380 -15.241 -2.288
27 HH11 ARG 3 HH11 ARG 3 -16.060 -16.949 -0.682
28 HH12 ARG 3 HH12 ARG 3 -15.543 -18.532 -1.159
29 HH21 ARG 3 HH21 ARG 3 -12.675 -17.392 -2.938
30 HH22 ARG 3 HH22 ARG 3 -13.584 -18.787 -2.463
31 H LEU 4 HN LEU 4 -16.150 -11.886 1.931
32 HA LEU 4 HA LEU 4 -16.646 -14.643 2.629
33 HB2 LEU 4 HB2 LEU 4 -16.726 -12.344 4.642
34 HB3 LEU 4 HB1 LEU 4 -17.749 -13.816 4.844
35 HG LEU 4 HG LEU 4 -14.706 -13.805 4.516
36 HD11 LEU 4 HD11 LEU 4 -14.936 -12.943 6.679
37 HD12 LEU 4 HD12 LEU 4 -14.916 -14.717 7.011
38 HD13 LEU 4 HD13 LEU 4 -16.481 -13.820 6.994
39 HD21 LEU 4 HD21 LEU 4 -15.086 -15.947 3.837
40 HD22 LEU 4 HD22 LEU 4 -16.788 -15.955 4.448
41 HD23 LEU 4 HD23 LEU 4 -15.414 -16.289 5.581
42 H SER 5 HN SER 5 -18.906 -15.092 2.978
43 HA SER 5 HA SER 5 -20.515 -13.163 1.480
44 HB2 SER 5 HB2 SER 5 -20.187 -15.513 0.478
45 HB3 SER 5 HB1 SER 5 -21.000 -16.173 1.946
46 HG SER 5 HG SER 5 -22.018 -14.641 -0.179
47 H DPP 6 HN DPP 6 -22.534 -15.502 2.820
48 HA DPP 6 HA DPP 6 -23.438 -13.670 4.786
49 HB2 DPP 6 HB2 DPP 6 -24.243 -16.486 3.886
50 HB3 DPP 6 HB3 DPP 6 -25.260 -15.002 3.990
51 H PHE 7 HN PHE 7 -22.875 -17.123 5.615
52 HA PHE 7 HA PHE 7 -22.007 -17.980 7.469
53 HB2 PHE 7 HB2 PHE 7 -19.851 -18.214 6.418
54 HB3 PHE 7 HB1 PHE 7 -19.642 -16.419 6.254
55 HD1 PHE 7 HD1 PHE 7 -20.602 -18.183 9.422
56 HD2 PHE 7 HD2 PHE 7 -17.531 -16.201 7.233
57 HE1 PHE 7 HE1 PHE 7 -19.347 -17.889 11.506
58 HE2 PHE 7 HE2 PHE 7 -16.209 -16.028 9.307
59 HZ PHE 7 HZ PHE 7 -17.102 -16.875 11.426
60 H PHE 8 HN PHE 8 -19.956 -15.205 7.893
61 HA PHE 8 HA PHE 8 -20.623 -15.116 10.564
62 HB2 PHE 8 HB2 PHE 8 -18.761 -13.686 10.763
63 HB3 PHE 8 HB1 PHE 8 -18.383 -14.681 9.362
64 HD1 PHE 8 HD1 PHE 8 -18.376 -11.550 10.636
65 HD2 PHE 8 HD2 PHE 8 -19.270 -13.734 7.135
66 HE1 PHE 8 HE1 PHE 8 -18.076 -9.569 9.353
67 HE2 PHE 8 HE2 PHE 8 -18.962 -11.768 5.809
68 HZ PHE 8 HZ PHE 8 -18.350 -9.641 6.910
69 H ARG 9 HN ARG 9 -21.610 -13.035 7.824
70 HA ARG 9 HA ARG 9 -22.541 -11.140 9.655
71 HB2 ARG 9 HB2 ARG 9 -23.311 -11.785 6.773
72 HB3 ARG 9 HB1 ARG 9 -24.240 -10.557 7.700
73 HG2 ARG 9 HG2 ARG 9 -22.706 -9.016 7.127
74 HG3 ARG 9 HG1 ARG 9 -21.465 -9.928 8.066
75 HD2 ARG 9 HD2 ARG 9 -20.889 -11.298 6.108
76 HD3 ARG 9 HD1 ARG 9 -22.240 -10.560 5.148
77 HE ARG 9 HE ARG 9 -20.544 -8.440 6.126
78 HH11 ARG 9 HH11 ARG 9 -20.590 -11.189 3.862
79 HH12 ARG 9 HH12 ARG 9 -19.483 -10.475 2.732
80 HH21 ARG 9 HH21 ARG 9 -19.046 -7.466 4.586
81 HH22 ARG 9 HH22 ARG 9 -18.596 -8.322 3.149
82 H GLN 10 HN GLN 10 -23.583 -14.338 9.252
83 HA GLN 10 HA GLN 10 -25.897 -13.540 10.765
84 HB2 GLN 10 HB2 GLN 10 -27.390 -15.083 9.553
85 HB3 GLN 10 HB1 GLN 10 -26.761 -13.811 8.456
86 HG2 GLN 10 HG2 GLN 10 -25.165 -16.390 8.589
87 HG3 GLN 10 HG1 GLN 10 -26.783 -16.476 7.795
88 HE21 GLN 10 HE21 GLN 10 -25.158 -17.017 5.981
89 H PHE 11 HN PHE 11 -23.169 -14.718 11.117
90 HA PHE 11 HA PHE 11 -24.102 -17.105 12.496
91 HB2 PHE 11 HB2 PHE 11 -22.540 -17.862 10.733
92 HB3 PHE 11 HB1 PHE 11 -21.370 -16.610 11.253
93 HD1 PHE 11 HD1 PHE 11 -22.513 -19.917 11.676
94 HD2 PHE 11 HD2 PHE 11 -20.474 -16.701 13.567
95 HE1 PHE 11 HE1 PHE 11 -21.494 -21.506 13.250
96 HE2 PHE 11 HE2 PHE 11 -19.429 -18.304 15.134
97 HZ PHE 11 HZ PHE 11 -19.943 -20.700 14.979
98 H ILE 12 HN ILE 12 -21.717 -14.440 12.331
99 HA ILE 12 HA ILE 12 -21.280 -14.746 15.144
100 HB ILE 12 HB ILE 12 -20.397 -12.184 14.367
101 HG12 ILE 12 HG12 ILE 12 -18.699 -13.113 12.562
102 HG13 ILE 12 HG11 ILE 12 -20.154 -14.066 12.124
103 HG21 ILE 12 HG21 ILE 12 -18.894 -14.855 14.811
104 HG22 ILE 12 HG22 ILE 12 -19.230 -13.572 16.041
105 HG23 ILE 12 HG23 ILE 12 -18.075 -13.250 14.693
106 HD11 ILE 12 HD11 ILE 12 -21.517 -11.940 12.250
107 HD12 ILE 12 HD12 ILE 12 -20.285 -11.938 10.940
108 HD13 ILE 12 HD13 ILE 12 -19.977 -11.024 12.459
109 H LEU 13 HN LEU 13 -23.192 -13.322 12.910
110 HA LEU 13 HA LEU 13 -23.901 -11.145 14.575
111 HB2 LEU 13 HB2 LEU 13 -23.643 -11.915 11.841
112 HB3 LEU 13 HB1 LEU 13 -25.280 -11.161 12.118
113 HG LEU 13 HG LEU 13 -24.279 -9.117 12.973
114 HD11 LEU 13 HD11 LEU 13 -22.019 -10.856 13.683
115 HD12 LEU 13 HD12 LEU 13 -22.355 -9.159 14.190
116 HD13 LEU 13 HD13 LEU 13 -21.418 -9.480 12.683
117 HD21 LEU 13 HD21 LEU 13 -23.442 -8.240 10.998
118 HD22 LEU 13 HD22 LEU 13 -24.028 -9.818 10.352
119 HD23 LEU 13 HD23 LEU 13 -22.277 -9.598 10.744
120 H GLN 14 HN GLN 14 -24.573 -14.322 14.415
121 HA GLN 14 HA GLN 14 -27.067 -13.929 15.728
122 HB2 GLN 14 HB2 GLN 14 -26.874 -15.722 13.233
123 HB3 GLN 14 HB1 GLN 14 -28.223 -15.787 14.422
124 HG2 GLN 14 HG2 GLN 14 -28.780 -13.375 13.895
125 HG3 GLN 14 HG1 GLN 14 -27.477 -13.375 12.640
126 HE21 GLN 14 HE21 GLN 14 -28.805 -13.176 10.806
127 HE22 GLN 14 HE22 GLN 14 -29.925 -14.394 10.301
128 H ARG 15 HN ARG 15 -24.583 -14.338 16.584
129 HA ARG 15 HA ARG 15 -24.124 -17.172 16.751
130 HB2 ARG 15 HB2 ARG 15 -22.532 -14.808 16.860
131 HB3 ARG 15 HB1 ARG 15 -22.453 -15.531 18.507
132 HG2 ARG 15 HG2 ARG 15 -21.861 -17.778 17.407
133 HG3 ARG 15 HG1 ARG 15 -21.728 -16.907 15.831
134 HD2 ARG 15 HD2 ARG 15 -19.502 -16.770 16.504
135 HD3 ARG 15 HD1 ARG 15 -20.125 -15.281 17.341
136 HE ARG 15 HE ARG 15 -20.517 -17.501 19.108
137 HH11 ARG 15 HH11 ARG 15 -17.904 -15.649 17.548
138 HH12 ARG 15 HH12 ARG 15 -16.750 -15.921 18.810
139 HH21 ARG 15 HH21 ARG 15 -18.953 -17.876 20.819
140 HH22 ARG 15 HH22 ARG 15 -17.357 -17.211 20.703
141 H LYS 16 HN LYS 16 -25.880 -17.965 17.946
142 HA LYS 16 HA LYS 16 -26.754 -16.791 20.321
143 HB2 LYS 16 HB2 LYS 16 -26.811 -19.720 19.405
144 HB3 LYS 16 HB1 LYS 16 -27.657 -19.114 20.874
145 HG2 LYS 16 HG2 LYS 16 -28.928 -17.485 19.394
146 HG3 LYS 16 HG1 LYS 16 -28.169 -18.269 17.966
147 HD2 LYS 16 HD2 LYS 16 -29.850 -19.777 20.062
148 HD3 LYS 16 HD1 LYS 16 -30.526 -19.080 18.550
149 HE2 LYS 16 HE2 LYS 16 -28.941 -20.528 17.201
150 HE3 LYS 16 HE1 LYS 16 -28.344 -21.267 18.745
151 HZ1 LYS 16 HZ1 LYS 16 -31.143 -21.329 18.735
152 HZ2 LYS 16 HZ2 LYS 16 -30.041 -22.618 18.682
153 HZ3 LYS 16 HZ3 LYS 16 -30.602 -21.921 17.239
154 H LYS 17 HN LYS 17 -24.167 -19.091 19.501
155 HA LYS 17 HA LYS 17 -23.017 -18.569 22.099
156 HB2 LYS 17 HB2 LYS 17 -22.476 -21.238 22.100
157 HB3 LYS 17 HB1 LYS 17 -23.878 -20.548 22.982
158 HG2 LYS 17 HG2 LYS 17 -24.368 -21.260 20.088
159 HG3 LYS 17 HG1 LYS 17 -24.047 -22.633 21.198
160 HD2 LYS 17 HD2 LYS 17 -26.085 -20.461 21.925
161 HD3 LYS 17 HD1 LYS 17 -26.527 -21.821 20.837
162 HE2 LYS 17 HE2 LYS 17 -25.844 -23.463 22.634
163 HE3 LYS 17 HE1 LYS 17 -25.458 -22.073 23.731
164 HZ1 LYS 17 HZ1 LYS 17 -27.595 -21.698 24.100
165 HZ2 LYS 17 HZ2 LYS 17 -27.827 -23.290 23.556
166 HZ3 LYS 17 HZ3 LYS 17 -28.075 -21.985 22.498
Start of MODEL 14
1 H1 GLU 1 HT1 GLU 1 -10.568 -14.644 -3.444
2 H2 GLU 1 HT2 GLU 1 -12.063 -14.838 -2.662
3 H3 GLU 1 HT3 GLU 1 -10.807 -13.991 -1.893
4 HA GLU 1 HA GLU 1 -11.050 -12.652 -4.197
5 HB2 GLU 1 HB2 GLU 1 -13.154 -14.038 -4.645
6 HB3 GLU 1 HB1 GLU 1 -13.873 -13.299 -3.172
7 HG2 GLU 1 HG2 GLU 1 -13.704 -11.020 -4.196
8 HG3 GLU 1 HG1 GLU 1 -12.927 -11.728 -5.669
9 H MET 2 HN MET 2 -12.634 -13.066 -0.964
10 HA MET 2 HA MET 2 -11.777 -10.327 -0.405
11 HB2 MET 2 HB2 MET 2 -14.471 -11.567 0.358
12 HB3 MET 2 HB1 MET 2 -13.806 -10.061 1.080
13 HG2 MET 2 HG2 MET 2 -13.843 -8.937 -1.121
14 HG3 MET 2 HG1 MET 2 -14.367 -10.450 -1.926
15 HE1 MET 2 HE1 MET 2 -16.662 -7.477 0.710
16 HE2 MET 2 HE2 MET 2 -14.899 -7.661 0.413
17 HE3 MET 2 HE3 MET 2 -15.725 -8.724 1.605
18 H ARG 3 HN ARG 3 -11.681 -9.927 1.989
19 HA ARG 3 HA ARG 3 -10.405 -12.126 3.147
20 HB2 ARG 3 HB2 ARG 3 -9.755 -9.754 3.698
21 HB3 ARG 3 HB1 ARG 3 -11.361 -9.536 4.471
22 HG2 ARG 3 HG2 ARG 3 -10.820 -11.263 6.166
23 HG3 ARG 3 HG1 ARG 3 -9.242 -11.584 5.364
24 HD2 ARG 3 HD2 ARG 3 -8.492 -9.239 5.865
25 HD3 ARG 3 HD1 ARG 3 -10.094 -8.900 6.662
26 HE ARG 3 HE ARG 3 -8.991 -11.254 7.868
27 HH11 ARG 3 HH11 ARG 3 -8.340 -7.773 7.492
28 HH12 ARG 3 HH12 ARG 3 -7.527 -7.601 9.011
29 HH21 ARG 3 HH21 ARG 3 -7.886 -11.024 9.937
30 HH22 ARG 3 HH22 ARG 3 -7.264 -9.484 10.426
31 H LEU 4 HN LEU 4 -13.623 -10.631 3.437
32 HA LEU 4 HA LEU 4 -14.516 -13.073 4.696
33 HB2 LEU 4 HB2 LEU 4 -15.889 -11.688 6.400
34 HB3 LEU 4 HB1 LEU 4 -14.135 -11.843 6.749
35 HG LEU 4 HG LEU 4 -13.764 -9.597 5.632
36 HD11 LEU 4 HD11 LEU 4 -16.089 -8.174 5.747
37 HD12 LEU 4 HD12 LEU 4 -16.766 -9.778 5.269
38 HD13 LEU 4 HD13 LEU 4 -15.511 -8.989 4.243
39 HD21 LEU 4 HD21 LEU 4 -15.204 -10.091 8.223
40 HD22 LEU 4 HD22 LEU 4 -15.237 -8.387 7.634
41 HD23 LEU 4 HD23 LEU 4 -13.659 -9.223 7.889
42 H SER 5 HN SER 5 -17.121 -12.746 5.001
43 HA SER 5 HA SER 5 -18.203 -10.854 3.195
44 HB2 SER 5 HB2 SER 5 -17.427 -12.517 1.478
45 HB3 SER 5 HB1 SER 5 -18.301 -13.824 2.367
46 HG SER 5 HG SER 5 -19.322 -11.590 0.965
47 H DPP 6 HN DPP 6 -19.214 -14.253 4.087
48 HA DPP 6 HA DPP 6 -21.521 -13.020 5.333
49 HB2 DPP 6 HB2 DPP 6 -20.775 -15.868 4.476
50 HB3 DPP 6 HB3 DPP 6 -22.287 -14.951 4.136
51 H PHE 7 HN PHE 7 -20.141 -15.983 6.708
52 HA PHE 7 HA PHE 7 -19.461 -16.443 8.744
53 HB2 PHE 7 HB2 PHE 7 -17.224 -15.576 8.459
54 HB3 PHE 7 HB1 PHE 7 -17.828 -13.877 8.248
55 HD1 PHE 7 HD1 PHE 7 -18.865 -16.145 11.037
56 HD2 PHE 7 HD2 PHE 7 -16.456 -12.830 9.855
57 HE1 PHE 7 HE1 PHE 7 -18.633 -15.509 13.389
58 HE2 PHE 7 HE2 PHE 7 -16.124 -12.268 12.230
59 HZ PHE 7 HZ PHE 7 -17.193 -13.600 13.987
60 H PHE 8 HN PHE 8 -19.185 -13.051 9.521
61 HA PHE 8 HA PHE 8 -20.593 -13.517 11.854
62 HB2 PHE 8 HB2 PHE 8 -19.782 -11.416 12.537
63 HB3 PHE 8 HB1 PHE 8 -18.559 -12.000 11.403
64 HD1 PHE 8 HD1 PHE 8 -20.458 -9.362 12.374
65 HD2 PHE 8 HD2 PHE 8 -18.996 -11.364 8.960
66 HE1 PHE 8 HE1 PHE 8 -20.763 -7.374 11.113
67 HE2 PHE 8 HE2 PHE 8 -19.263 -9.375 7.657
68 HZ PHE 8 HZ PHE 8 -20.159 -7.340 8.724
69 H ARG 9 HN ARG 9 -21.603 -11.630 8.898
70 HA ARG 9 HA ARG 9 -23.817 -10.803 10.409
71 HB2 ARG 9 HB2 ARG 9 -24.971 -10.566 8.001
72 HB3 ARG 9 HB1 ARG 9 -23.676 -9.435 8.515
73 HG2 ARG 9 HG2 ARG 9 -22.693 -11.929 7.172
74 HG3 ARG 9 HG1 ARG 9 -23.703 -10.858 6.139
75 HD2 ARG 9 HD2 ARG 9 -21.867 -9.151 7.620
76 HD3 ARG 9 HD1 ARG 9 -20.910 -10.525 6.907
77 HE ARG 9 HE ARG 9 -21.431 -9.708 4.739
78 HH11 ARG 9 HH11 ARG 9 -23.439 -8.111 7.218
79 HH12 ARG 9 HH12 ARG 9 -24.059 -6.897 6.152
80 HH21 ARG 9 HH21 ARG 9 -22.279 -8.057 3.295
81 HH22 ARG 9 HH22 ARG 9 -23.388 -6.866 3.885
82 H GLN 10 HN GLN 10 -23.050 -13.928 9.776
83 HA GLN 10 HA GLN 10 -25.815 -14.516 10.220
84 HB2 GLN 10 HB2 GLN 10 -25.906 -16.338 8.585
85 HB3 GLN 10 HB1 GLN 10 -25.512 -14.805 7.744
86 HG2 GLN 10 HG2 GLN 10 -23.126 -16.424 8.649
87 HG3 GLN 10 HG1 GLN 10 -24.137 -17.184 7.365
88 HE21 GLN 10 HE21 GLN 10 -22.019 -16.854 6.200
89 H PHE 11 HN PHE 11 -23.108 -14.364 11.567
90 HA PHE 11 HA PHE 11 -23.246 -17.060 12.667
91 HB2 PHE 11 HB2 PHE 11 -21.042 -16.859 11.553
92 HB3 PHE 11 HB1 PHE 11 -20.788 -15.285 12.374
93 HD1 PHE 11 HD1 PHE 11 -20.413 -18.799 12.557
94 HD2 PHE 11 HD2 PHE 11 -20.720 -15.235 14.858
95 HE1 PHE 11 HE1 PHE 11 -19.381 -19.955 14.462
96 HE2 PHE 11 HE2 PHE 11 -19.659 -16.395 16.766
97 HZ PHE 11 HZ PHE 11 -18.993 -18.751 16.568
98 H ILE 12 HN ILE 12 -22.379 -13.621 13.158
99 HA ILE 12 HA ILE 12 -22.732 -14.006 15.976
100 HB ILE 12 HB ILE 12 -22.858 -11.251 15.450
101 HG12 ILE 12 HG12 ILE 12 -20.520 -11.114 14.249
102 HG13 ILE 12 HG11 ILE 12 -21.170 -12.568 13.427
103 HG21 ILE 12 HG21 ILE 12 -21.714 -12.152 17.420
104 HG22 ILE 12 HG22 ILE 12 -20.464 -11.289 16.447
105 HG23 ILE 12 HG23 ILE 12 -20.560 -13.091 16.395
106 HD11 ILE 12 HD11 ILE 12 -23.332 -11.336 13.046
107 HD12 ILE 12 HD12 ILE 12 -21.927 -10.599 12.197
108 HD13 ILE 12 HD13 ILE 12 -22.553 -9.849 13.708
109 H LEU 13 HN LEU 13 -24.348 -13.473 13.217
110 HA LEU 13 HA LEU 13 -26.412 -11.965 14.467
111 HB2 LEU 13 HB2 LEU 13 -24.997 -12.183 12.004
112 HB3 LEU 13 HB1 LEU 13 -26.788 -12.315 11.684
113 HG LEU 13 HG LEU 13 -27.196 -10.178 12.831
114 HD11 LEU 13 HD11 LEU 13 -25.830 -9.364 14.458
115 HD12 LEU 13 HD12 LEU 13 -24.470 -9.195 13.285
116 HD13 LEU 13 HD13 LEU 13 -24.695 -10.740 14.187
117 HD21 LEU 13 HD21 LEU 13 -26.512 -8.812 11.106
118 HD22 LEU 13 HD22 LEU 13 -25.979 -10.371 10.374
119 HD23 LEU 13 HD23 LEU 13 -24.782 -9.319 11.230
120 H GLN 14 HN GLN 14 -25.477 -15.054 14.241
121 HA GLN 14 HA GLN 14 -28.143 -15.971 14.628
122 HB2 GLN 14 HB2 GLN 14 -26.364 -17.201 12.433
123 HB3 GLN 14 HB1 GLN 14 -27.836 -17.990 13.104
124 HG2 GLN 14 HG2 GLN 14 -29.234 -16.048 12.292
125 HG3 GLN 14 HG1 GLN 14 -27.752 -15.315 11.558
126 HE21 GLN 14 HE21 GLN 14 -28.306 -15.527 9.373
127 HE22 GLN 14 HE22 GLN 14 -28.518 -17.050 8.578
128 H ARG 15 HN ARG 15 -26.156 -15.305 16.262
129 HA ARG 15 HA ARG 15 -24.510 -17.614 16.715
130 HB2 ARG 15 HB2 ARG 15 -24.329 -14.816 17.203
131 HB3 ARG 15 HB1 ARG 15 -24.453 -15.582 18.827
132 HG2 ARG 15 HG2 ARG 15 -22.573 -17.184 18.139
133 HG3 ARG 15 HG1 ARG 15 -22.371 -16.212 16.630
134 HD2 ARG 15 HD2 ARG 15 -20.789 -15.157 17.996
135 HD3 ARG 15 HD1 ARG 15 -22.255 -14.163 18.416
136 HE ARG 15 HE ARG 15 -22.229 -16.395 20.187
137 HH11 ARG 15 HH11 ARG 15 -20.224 -13.571 19.351
138 HH12 ARG 15 HH12 ARG 15 -19.566 -13.376 20.941
139 HH21 ARG 15 HH21 ARG 15 -21.341 -16.131 22.345
140 HH22 ARG 15 HH22 ARG 15 -20.213 -14.858 22.675
141 H LYS 16 HN LYS 16 -25.974 -19.251 17.306
142 HA LYS 16 HA LYS 16 -27.977 -18.873 19.215
143 HB2 LYS 16 HB2 LYS 16 -26.383 -21.390 18.477
144 HB3 LYS 16 HB1 LYS 16 -27.821 -21.396 19.560
145 HG2 LYS 16 HG2 LYS 16 -29.219 -20.465 17.705
146 HG3 LYS 16 HG1 LYS 16 -27.781 -20.482 16.625
147 HD2 LYS 16 HD2 LYS 16 -27.616 -22.958 16.854
148 HD3 LYS 16 HD1 LYS 16 -29.010 -22.962 17.987
149 HE2 LYS 16 HE2 LYS 16 -29.766 -23.627 15.717
150 HE3 LYS 16 HE1 LYS 16 -30.472 -22.009 16.131
151 HZ1 LYS 16 HZ1 LYS 16 -28.934 -22.697 13.943
152 HZ2 LYS 16 HZ2 LYS 16 -27.940 -21.710 14.904
153 HZ3 LYS 16 HZ3 LYS 16 -29.464 -21.152 14.405
154 H LYS 17 HN LYS 17 -24.514 -19.677 19.389
155 HA LYS 17 HA LYS 17 -24.732 -19.283 22.291
156 HB2 LYS 17 HB2 LYS 17 -23.643 -21.661 20.814
157 HB3 LYS 17 HB1 LYS 17 -22.524 -20.975 22.042
158 HG2 LYS 17 HG2 LYS 17 -23.779 -22.673 23.174
159 HG3 LYS 17 HG1 LYS 17 -24.455 -21.103 23.732
160 HD2 LYS 17 HD2 LYS 17 -26.370 -21.330 22.175
161 HD3 LYS 17 HD1 LYS 17 -25.669 -22.834 21.487
162 HE2 LYS 17 HE2 LYS 17 -25.906 -23.973 23.716
163 HE3 LYS 17 HE1 LYS 17 -26.608 -22.452 24.411
164 HZ1 LYS 17 HZ1 LYS 17 -27.718 -24.092 22.193
165 HZ2 LYS 17 HZ2 LYS 17 -28.352 -22.608 22.720
166 HZ3 LYS 17 HZ3 LYS 17 -28.325 -23.942 23.770
Start of MODEL 15
1 H1 GLU 1 HT1 GLU 1 -12.371 -5.309 2.410
2 H2 GLU 1 HT2 GLU 1 -13.388 -6.666 2.502
3 H3 GLU 1 HT3 GLU 1 -13.295 -5.771 1.062
4 HA GLU 1 HA GLU 1 -11.836 -7.239 0.385
5 HB2 GLU 1 HB2 GLU 1 -10.385 -5.260 1.004
6 HB3 GLU 1 HB1 GLU 1 -10.109 -6.011 2.615
7 HG2 GLU 1 HG2 GLU 1 -8.975 -7.969 1.540
8 HG3 GLU 1 HG1 GLU 1 -9.288 -7.264 -0.096
9 H MET 2 HN MET 2 -12.752 -9.291 0.899
10 HA MET 2 HA MET 2 -11.238 -10.711 2.863
11 HB2 MET 2 HB2 MET 2 -13.375 -11.718 3.899
12 HB3 MET 2 HB1 MET 2 -12.901 -10.080 4.487
13 HG2 MET 2 HG2 MET 2 -14.542 -9.055 2.882
14 HG3 MET 2 HG1 MET 2 -15.013 -10.693 2.330
15 HE1 MET 2 HE1 MET 2 -14.713 -8.085 4.860
16 HE2 MET 2 HE2 MET 2 -14.363 -9.226 6.204
17 HE3 MET 2 HE3 MET 2 -15.940 -8.365 6.144
18 H ARG 3 HN ARG 3 -12.149 -13.074 2.945
19 HA ARG 3 HA ARG 3 -13.079 -13.671 0.253
20 HB2 ARG 3 HB2 ARG 3 -11.945 -15.967 0.654
21 HB3 ARG 3 HB1 ARG 3 -10.843 -14.582 0.343
22 HG2 ARG 3 HG2 ARG 3 -10.200 -14.397 2.625
23 HG3 ARG 3 HG1 ARG 3 -11.623 -15.330 3.206
24 HD2 ARG 3 HD2 ARG 3 -10.690 -17.436 2.424
25 HD3 ARG 3 HD1 ARG 3 -9.382 -16.584 1.482
26 HE ARG 3 HE ARG 3 -9.183 -15.775 4.229
27 HH11 ARG 3 HH11 ARG 3 -8.851 -18.644 2.147
28 HH12 ARG 3 HH12 ARG 3 -7.654 -19.415 3.133
29 HH21 ARG 3 HH21 ARG 3 -7.553 -16.819 5.572
30 HH22 ARG 3 HH22 ARG 3 -6.903 -18.357 5.116
31 H LEU 4 HN LEU 4 -14.667 -13.029 2.645
32 HA LEU 4 HA LEU 4 -15.808 -15.693 3.035
33 HB2 LEU 4 HB2 LEU 4 -15.623 -13.377 5.023
34 HB3 LEU 4 HB1 LEU 4 -16.751 -14.767 5.237
35 HG LEU 4 HG LEU 4 -13.714 -15.004 4.909
36 HD11 LEU 4 HD11 LEU 4 -13.710 -15.597 7.360
37 HD12 LEU 4 HD12 LEU 4 -15.452 -15.132 7.450
38 HD13 LEU 4 HD13 LEU 4 -14.207 -13.891 7.039
39 HD21 LEU 4 HD21 LEU 4 -14.845 -17.349 6.124
40 HD22 LEU 4 HD22 LEU 4 -14.125 -17.185 4.475
41 HD23 LEU 4 HD23 LEU 4 -15.906 -16.947 4.713
42 H SER 5 HN SER 5 -18.094 -15.777 3.411
43 HA SER 5 HA SER 5 -19.412 -13.637 1.921
44 HB2 SER 5 HB2 SER 5 -19.382 -16.150 1.062
45 HB3 SER 5 HB1 SER 5 -20.527 -16.448 2.424
46 HG SER 5 HG SER 5 -21.100 -15.579 0.052
47 H DPP 6 HN DPP 6 -22.113 -14.640 2.790
48 HA DPP 6 HA DPP 6 -21.997 -13.295 5.321
49 HB2 DPP 6 HB2 DPP 6 -24.552 -14.616 4.292
50 HB3 DPP 6 HB3 DPP 6 -23.968 -13.080 3.551
51 H PHE 7 HN PHE 7 -20.445 -15.206 5.896
52 HA PHE 7 HA PHE 7 -21.990 -17.440 7.000
53 HB2 PHE 7 HB2 PHE 7 -19.904 -18.482 6.496
54 HB3 PHE 7 HB1 PHE 7 -19.066 -16.877 6.389
55 HD1 PHE 7 HD1 PHE 7 -20.874 -18.501 9.274
56 HD2 PHE 7 HD2 PHE 7 -17.209 -16.995 7.709
57 HE1 PHE 7 HE1 PHE 7 -19.883 -18.639 11.507
58 HE2 PHE 7 HE2 PHE 7 -16.190 -17.253 9.936
59 HZ PHE 7 HZ PHE 7 -17.511 -18.082 11.821
60 H PHE 8 HN PHE 8 -19.327 -15.459 8.136
61 HA PHE 8 HA PHE 8 -20.185 -15.540 10.764
62 HB2 PHE 8 HB2 PHE 8 -18.119 -14.428 11.202
63 HB3 PHE 8 HB1 PHE 8 -17.811 -15.418 9.773
64 HD1 PHE 8 HD1 PHE 8 -17.434 -12.362 11.206
65 HD2 PHE 8 HD2 PHE 8 -18.323 -14.273 7.549
66 HE1 PHE 8 HE1 PHE 8 -16.766 -10.404 10.050
67 HE2 PHE 8 HE2 PHE 8 -17.643 -12.329 6.337
68 HZ PHE 8 HZ PHE 8 -16.839 -10.348 7.591
69 H ARG 9 HN ARG 9 -20.526 -13.042 8.206
70 HA ARG 9 HA ARG 9 -21.255 -11.175 10.123
71 HB2 ARG 9 HB2 ARG 9 -22.003 -11.411 7.165
72 HB3 ARG 9 HB1 ARG 9 -22.577 -10.041 8.179
73 HG2 ARG 9 HG2 ARG 9 -20.665 -8.965 7.684
74 HG3 ARG 9 HG1 ARG 9 -19.778 -10.199 8.652
75 HD2 ARG 9 HD2 ARG 9 -18.756 -10.186 6.446
76 HD3 ARG 9 HD1 ARG 9 -19.788 -11.688 6.517
77 HE ARG 9 HE ARG 9 -21.411 -9.563 5.485
78 HH11 ARG 9 HH11 ARG 9 -18.484 -11.414 4.655
79 HH12 ARG 9 HH12 ARG 9 -18.710 -11.302 2.942
80 HH21 ARG 9 HH21 ARG 9 -21.720 -9.410 3.155
81 HH22 ARG 9 HH22 ARG 9 -20.581 -10.142 2.076
82 H GLN 10 HN GLN 10 -22.976 -14.037 9.256
83 HA GLN 10 HA GLN 10 -25.147 -12.825 10.754
84 HB2 GLN 10 HB2 GLN 10 -25.806 -14.802 8.547
85 HB3 GLN 10 HB1 GLN 10 -26.891 -13.631 9.369
86 HG2 GLN 10 HG2 GLN 10 -26.616 -12.165 7.649
87 HG3 GLN 10 HG1 GLN 10 -24.850 -12.094 8.014
88 HE21 GLN 10 HE21 GLN 10 -24.004 -12.122 5.953
89 H PHE 11 HN PHE 11 -22.766 -14.573 11.121
90 HA PHE 11 HA PHE 11 -24.272 -16.809 12.251
91 HB2 PHE 11 HB2 PHE 11 -22.709 -17.645 10.483
92 HB3 PHE 11 HB1 PHE 11 -21.374 -16.799 11.328
93 HD1 PHE 11 HD1 PHE 11 -23.195 -19.763 10.993
94 HD2 PHE 11 HD2 PHE 11 -20.950 -17.401 13.723
95 HE1 PHE 11 HE1 PHE 11 -22.797 -21.763 12.378
96 HE2 PHE 11 HE2 PHE 11 -20.529 -19.414 15.103
97 HZ PHE 11 HZ PHE 11 -21.456 -21.589 14.431
98 H ILE 12 HN ILE 12 -21.341 -14.752 12.496
99 HA ILE 12 HA ILE 12 -21.228 -15.363 15.292
100 HB ILE 12 HB ILE 12 -19.757 -13.000 14.814
101 HG12 ILE 12 HG12 ILE 12 -18.141 -14.109 13.054
102 HG13 ILE 12 HG11 ILE 12 -19.709 -14.729 12.439
103 HG21 ILE 12 HG21 ILE 12 -17.745 -14.571 15.189
104 HG22 ILE 12 HG22 ILE 12 -18.900 -15.959 15.124
105 HG23 ILE 12 HG23 ILE 12 -19.045 -14.718 16.432
106 HD11 ILE 12 HD11 ILE 12 -18.995 -11.815 13.065
107 HD12 ILE 12 HD12 ILE 12 -20.657 -12.398 12.660
108 HD13 ILE 12 HD13 ILE 12 -19.339 -12.524 11.447
109 H LEU 13 HN LEU 13 -22.679 -13.441 13.113
110 HA LEU 13 HA LEU 13 -23.007 -11.261 14.899
111 HB2 LEU 13 HB2 LEU 13 -22.706 -11.883 12.136
112 HB3 LEU 13 HB1 LEU 13 -24.188 -10.845 12.368
113 HG LEU 13 HG LEU 13 -22.865 -9.119 13.507
114 HD11 LEU 13 HD11 LEU 13 -20.943 -9.568 14.640
115 HD12 LEU 13 HD12 LEU 13 -20.127 -10.117 13.129
116 HD13 LEU 13 HD13 LEU 13 -21.060 -11.296 14.127
117 HD21 LEU 13 HD21 LEU 13 -21.886 -8.211 11.623
118 HD22 LEU 13 HD22 LEU 13 -22.679 -9.613 10.817
119 HD23 LEU 13 HD23 LEU 13 -20.928 -9.697 11.254
120 H GLN 14 HN GLN 14 -24.354 -14.209 14.368
121 HA GLN 14 HA GLN 14 -26.832 -13.335 15.518
122 HB2 GLN 14 HB2 GLN 14 -26.704 -15.026 12.950
123 HB3 GLN 14 HB1 GLN 14 -28.164 -14.908 13.990
124 HG2 GLN 14 HG2 GLN 14 -26.827 -12.442 12.721
125 HG3 GLN 14 HG1 GLN 14 -28.145 -13.380 11.907
126 HE21 GLN 14 HE21 GLN 14 -27.586 -10.696 13.842
127 HE22 GLN 14 HE22 GLN 14 -29.112 -10.590 14.654
128 H ARG 15 HN ARG 15 -24.488 -14.344 16.460
129 HA ARG 15 HA ARG 15 -24.734 -17.200 16.572
130 HB2 ARG 15 HB2 ARG 15 -22.658 -15.267 16.883
131 HB3 ARG 15 HB1 ARG 15 -22.848 -16.060 18.488
132 HG2 ARG 15 HG2 ARG 15 -22.700 -18.329 17.325
133 HG3 ARG 15 HG1 ARG 15 -22.331 -17.468 15.779
134 HD2 ARG 15 HD2 ARG 15 -20.152 -17.858 16.517
135 HD3 ARG 15 HD1 ARG 15 -20.452 -16.274 17.360
136 HE ARG 15 HE ARG 15 -21.373 -18.347 19.094
137 HH11 ARG 15 HH11 ARG 15 -18.373 -17.173 17.578
138 HH12 ARG 15 HH12 ARG 15 -17.334 -17.708 18.856
139 HH21 ARG 15 HH21 ARG 15 -19.960 -19.075 20.836
140 HH22 ARG 15 HH22 ARG 15 -18.253 -18.808 20.739
141 H LYS 16 HN LYS 16 -26.727 -17.556 17.614
142 HA LYS 16 HA LYS 16 -27.384 -16.289 20.021
143 HB2 LYS 16 HB2 LYS 16 -29.070 -17.529 18.589
144 HB3 LYS 16 HB1 LYS 16 -28.249 -19.066 19.030
145 HG2 LYS 16 HG2 LYS 16 -28.801 -18.697 21.431
146 HG3 LYS 16 HG1 LYS 16 -29.579 -17.128 21.023
147 HD2 LYS 16 HD2 LYS 16 -31.266 -18.312 19.622
148 HD3 LYS 16 HD1 LYS 16 -30.464 -19.884 19.959
149 HE2 LYS 16 HE2 LYS 16 -32.458 -19.615 21.420
150 HE3 LYS 16 HE1 LYS 16 -30.957 -19.564 22.436
151 HZ1 LYS 16 HZ1 LYS 16 -31.800 -16.997 21.432
152 HZ2 LYS 16 HZ2 LYS 16 -31.355 -17.483 22.998
153 HZ3 LYS 16 HZ3 LYS 16 -32.939 -17.745 22.444
154 H LYS 17 HN LYS 17 -25.452 -19.160 19.171
155 HA LYS 17 HA LYS 17 -24.075 -20.394 20.407
156 HB2 LYS 17 HB2 LYS 17 -24.513 -18.471 22.766
157 HB3 LYS 17 HB1 LYS 17 -23.150 -19.619 22.544
158 HG2 LYS 17 HG2 LYS 17 -22.008 -18.225 21.125
159 HG3 LYS 17 HG1 LYS 17 -23.498 -17.624 20.321
160 HD2 LYS 17 HD2 LYS 17 -23.986 -16.135 22.215
161 HD3 LYS 17 HD1 LYS 17 -22.608 -16.811 23.157
162 HE2 LYS 17 HE2 LYS 17 -20.982 -15.879 21.523
163 HE3 LYS 17 HE1 LYS 17 -22.338 -15.301 20.466
164 HZ1 LYS 17 HZ1 LYS 17 -21.877 -14.453 23.280
165 HZ2 LYS 17 HZ2 LYS 17 -23.048 -13.854 22.205
166 HZ3 LYS 17 HZ3 LYS 17 -21.399 -13.588 21.899
Start of MODEL 16
1 H1 GLU 1 HT1 GLU 1 -16.600 -10.196 -1.140
2 H2 GLU 1 HT2 GLU 1 -15.141 -10.893 -1.660
3 H3 GLU 1 HT3 GLU 1 -15.915 -9.727 -2.622
4 HA GLU 1 HA GLU 1 -14.551 -8.287 -1.712
5 HB2 GLU 1 HB2 GLU 1 -16.410 -8.893 0.654
6 HB3 GLU 1 HB1 GLU 1 -15.259 -7.509 0.653
7 HG2 GLU 1 HG2 GLU 1 -16.388 -6.505 -1.321
8 HG3 GLU 1 HG1 GLU 1 -17.491 -7.932 -1.449
9 H MET 2 HN MET 2 -15.003 -11.009 0.642
10 HA MET 2 HA MET 2 -12.109 -10.915 1.029
11 HB2 MET 2 HB2 MET 2 -14.197 -11.174 3.255
12 HB3 MET 2 HB1 MET 2 -12.459 -11.583 3.448
13 HG2 MET 2 HG2 MET 2 -11.834 -9.227 2.923
14 HG3 MET 2 HG1 MET 2 -13.560 -8.808 2.687
15 HE1 MET 2 HE1 MET 2 -12.502 -6.887 5.898
16 HE2 MET 2 HE2 MET 2 -13.120 -6.813 4.211
17 HE3 MET 2 HE3 MET 2 -11.430 -7.336 4.526
18 H ARG 3 HN ARG 3 -11.482 -13.009 2.342
19 HA ARG 3 HA ARG 3 -12.374 -15.113 0.794
20 HB2 ARG 3 HB2 ARG 3 -10.132 -15.168 1.863
21 HB3 ARG 3 HB1 ARG 3 -10.914 -15.145 3.481
22 HG2 ARG 3 HG2 ARG 3 -11.842 -17.368 1.704
23 HG3 ARG 3 HG1 ARG 3 -10.091 -17.426 2.105
24 HD2 ARG 3 HD2 ARG 3 -10.669 -17.281 4.572
25 HD3 ARG 3 HD1 ARG 3 -12.434 -17.312 4.131
26 HE ARG 3 HE ARG 3 -11.143 -19.537 2.852
27 HH11 ARG 3 HH11 ARG 3 -11.976 -18.278 6.078
28 HH12 ARG 3 HH12 ARG 3 -12.149 -19.837 6.812
29 HH21 ARG 3 HH21 ARG 3 -11.379 -21.658 3.848
30 HH22 ARG 3 HH22 ARG 3 -11.804 -21.791 5.522
31 H LEU 4 HN LEU 4 -13.167 -14.049 4.107
32 HA LEU 4 HA LEU 4 -15.018 -16.218 4.399
33 HB2 LEU 4 HB2 LEU 4 -15.749 -14.873 6.500
34 HB3 LEU 4 HB1 LEU 4 -14.083 -15.544 6.497
35 HG LEU 4 HG LEU 4 -13.789 -13.001 5.299
36 HD11 LEU 4 HD11 LEU 4 -15.386 -12.494 7.848
37 HD12 LEU 4 HD12 LEU 4 -16.234 -12.665 6.260
38 HD13 LEU 4 HD13 LEU 4 -14.989 -11.375 6.488
39 HD21 LEU 4 HD21 LEU 4 -12.157 -14.031 6.806
40 HD22 LEU 4 HD22 LEU 4 -13.301 -13.916 8.198
41 HD23 LEU 4 HD23 LEU 4 -12.625 -12.414 7.457
42 H SER 5 HN SER 5 -15.176 -12.612 4.013
43 HA SER 5 HA SER 5 -16.732 -11.325 3.128
44 HB2 SER 5 HB2 SER 5 -16.832 -13.126 1.257
45 HB3 SER 5 HB1 SER 5 -18.270 -13.785 2.123
46 HG SER 5 HG SER 5 -19.069 -12.370 0.713
47 H DPP 6 HN DPP 6 -19.214 -13.914 3.544
48 HA DPP 6 HA DPP 6 -20.487 -12.144 5.397
49 HB2 DPP 6 HB2 DPP 6 -21.408 -15.038 4.905
50 HB3 DPP 6 HB3 DPP 6 -21.710 -13.760 3.675
51 H PHE 7 HN PHE 7 -20.796 -15.520 6.257
52 HA PHE 7 HA PHE 7 -20.071 -16.695 7.989
53 HB2 PHE 7 HB2 PHE 7 -17.687 -16.679 7.715
54 HB3 PHE 7 HB1 PHE 7 -17.618 -14.869 7.694
55 HD1 PHE 7 HD1 PHE 7 -19.216 -17.038 10.303
56 HD2 PHE 7 HD2 PHE 7 -16.001 -14.422 9.311
57 HE1 PHE 7 HE1 PHE 7 -18.678 -16.829 12.685
58 HE2 PHE 7 HE2 PHE 7 -15.414 -14.290 11.699
59 HZ PHE 7 HZ PHE 7 -16.724 -15.504 13.372
60 H PHE 8 HN PHE 8 -18.609 -13.755 9.230
61 HA PHE 8 HA PHE 8 -19.956 -14.102 11.621
62 HB2 PHE 8 HB2 PHE 8 -18.542 -12.388 12.445
63 HB3 PHE 8 HB1 PHE 8 -17.595 -13.154 11.158
64 HD1 PHE 8 HD1 PHE 8 -18.637 -10.207 12.514
65 HD2 PHE 8 HD2 PHE 8 -17.959 -12.167 8.848
66 HE1 PHE 8 HE1 PHE 8 -18.473 -8.095 11.440
67 HE2 PHE 8 HE2 PHE 8 -17.772 -10.065 7.726
68 HZ PHE 8 HZ PHE 8 -18.019 -7.995 9.017
69 H ARG 9 HN ARG 9 -20.513 -11.653 8.988
70 HA ARG 9 HA ARG 9 -22.339 -10.424 10.713
71 HB2 ARG 9 HB2 ARG 9 -23.456 -9.545 8.489
72 HB3 ARG 9 HB1 ARG 9 -21.794 -9.001 8.902
73 HG2 ARG 9 HG2 ARG 9 -21.855 -11.535 7.328
74 HG3 ARG 9 HG1 ARG 9 -22.597 -10.135 6.478
75 HD2 ARG 9 HD2 ARG 9 -20.213 -9.095 7.682
76 HD3 ARG 9 HD1 ARG 9 -19.745 -10.711 6.980
77 HE ARG 9 HE ARG 9 -21.266 -9.556 4.954
78 HH11 ARG 9 HH11 ARG 9 -18.517 -8.463 6.939
79 HH12 ARG 9 HH12 ARG 9 -17.829 -7.461 5.706
80 HH21 ARG 9 HH21 ARG 9 -20.328 -8.198 3.280
81 HH22 ARG 9 HH22 ARG 9 -18.873 -7.309 3.589
82 H GLN 10 HN GLN 10 -22.535 -13.568 9.676
83 HA GLN 10 HA GLN 10 -25.360 -13.384 10.211
84 HB2 GLN 10 HB2 GLN 10 -24.602 -15.483 8.206
85 HB3 GLN 10 HB1 GLN 10 -26.109 -14.518 8.323
86 HG2 GLN 10 HG2 GLN 10 -25.381 -13.386 6.476
87 HG3 GLN 10 HG1 GLN 10 -24.187 -12.593 7.564
88 HE21 GLN 10 HE21 GLN 10 -22.941 -12.461 5.472
89 H PHE 11 HN PHE 11 -22.626 -14.154 11.370
90 HA PHE 11 HA PHE 11 -23.521 -16.796 12.241
91 HB2 PHE 11 HB2 PHE 11 -21.400 -17.066 10.971
92 HB3 PHE 11 HB1 PHE 11 -20.664 -15.776 11.977
93 HD1 PHE 11 HD1 PHE 11 -21.342 -19.229 11.646
94 HD2 PHE 11 HD2 PHE 11 -20.513 -16.123 14.427
95 HE1 PHE 11 HE1 PHE 11 -20.636 -20.911 13.295
96 HE2 PHE 11 HE2 PHE 11 -19.782 -17.815 16.079
97 HZ PHE 11 HZ PHE 11 -19.846 -20.205 15.512
98 H ILE 12 HN ILE 12 -21.660 -13.835 13.024
99 HA ILE 12 HA ILE 12 -21.997 -14.457 15.805
100 HB ILE 12 HB ILE 12 -21.351 -11.724 15.560
101 HG12 ILE 12 HG12 ILE 12 -19.094 -12.134 14.267
102 HG13 ILE 12 HG11 ILE 12 -20.156 -13.251 13.344
103 HG21 ILE 12 HG21 ILE 12 -20.485 -13.145 17.377
104 HG22 ILE 12 HG22 ILE 12 -19.065 -12.517 16.457
105 HG23 ILE 12 HG23 ILE 12 -19.626 -14.214 16.198
106 HD11 ILE 12 HD11 ILE 12 -20.363 -11.024 12.360
107 HD12 ILE 12 HD12 ILE 12 -20.690 -10.301 13.971
108 HD13 ILE 12 HD13 ILE 12 -21.888 -11.430 13.220
109 H LEU 13 HN LEU 13 -23.527 -13.216 13.250
110 HA LEU 13 HA LEU 13 -25.019 -11.322 14.762
111 HB2 LEU 13 HB2 LEU 13 -23.857 -11.692 12.192
112 HB3 LEU 13 HB1 LEU 13 -25.633 -11.315 11.997
113 HG LEU 13 HG LEU 13 -25.351 -9.285 13.425
114 HD11 LEU 13 HD11 LEU 13 -23.053 -10.582 14.433
115 HD12 LEU 13 HD12 LEU 13 -23.513 -8.860 14.729
116 HD13 LEU 13 HD13 LEU 13 -22.360 -9.268 13.403
117 HD21 LEU 13 HD21 LEU 13 -24.630 -7.959 11.690
118 HD22 LEU 13 HD22 LEU 13 -24.589 -9.514 10.782
119 HD23 LEU 13 HD23 LEU 13 -23.070 -8.850 11.499
120 H GLN 14 HN GLN 14 -24.997 -14.531 14.140
121 HA GLN 14 HA GLN 14 -27.789 -14.709 14.701
122 HB2 GLN 14 HB2 GLN 14 -26.564 -16.136 12.263
123 HB3 GLN 14 HB1 GLN 14 -28.153 -16.564 12.990
124 HG2 GLN 14 HG2 GLN 14 -29.002 -14.240 12.476
125 HG3 GLN 14 HG1 GLN 14 -27.422 -13.864 11.677
126 HE21 GLN 14 HE21 GLN 14 -28.102 -13.706 9.531
127 HE22 GLN 14 HE22 GLN 14 -28.798 -15.015 8.636
128 H ARG 15 HN ARG 15 -25.635 -14.804 16.232
129 HA ARG 15 HA ARG 15 -24.686 -17.515 16.327
130 HB2 ARG 15 HB2 ARG 15 -23.686 -14.947 17.047
131 HB3 ARG 15 HB1 ARG 15 -23.924 -15.833 18.599
132 HG2 ARG 15 HG2 ARG 15 -22.628 -17.804 17.590
133 HG3 ARG 15 HG1 ARG 15 -22.249 -16.757 16.169
134 HD2 ARG 15 HD2 ARG 15 -20.354 -16.329 17.465
135 HD3 ARG 15 HD1 ARG 15 -21.454 -15.051 18.148
136 HE ARG 15 HE ARG 15 -21.892 -17.463 19.629
137 HH11 ARG 15 HH11 ARG 15 -19.350 -15.056 18.969
138 HH12 ARG 15 HH12 ARG 15 -18.564 -15.242 20.501
139 HH21 ARG 15 HH21 ARG 15 -20.828 -17.718 21.707
140 HH22 ARG 15 HH22 ARG 15 -19.420 -16.783 22.086
141 H LYS 16 HN LYS 16 -26.505 -18.738 16.892
142 HA LYS 16 HA LYS 16 -28.215 -18.037 18.982
143 HB2 LYS 16 HB2 LYS 16 -27.439 -20.793 17.875
144 HB3 LYS 16 HB1 LYS 16 -28.759 -20.532 19.071
145 HG2 LYS 16 HG2 LYS 16 -29.867 -18.958 17.408
146 HG3 LYS 16 HG1 LYS 16 -28.604 -19.414 16.213
147 HD2 LYS 16 HD2 LYS 16 -30.465 -21.443 17.594
148 HD3 LYS 16 HD1 LYS 16 -30.828 -20.671 16.012
149 HE2 LYS 16 HE2 LYS 16 -28.679 -21.640 15.075
150 HE3 LYS 16 HE1 LYS 16 -28.397 -22.473 16.661
151 HZ1 LYS 16 HZ1 LYS 16 -29.569 -24.087 15.765
152 HZ2 LYS 16 HZ2 LYS 16 -30.189 -23.120 14.514
153 HZ3 LYS 16 HZ3 LYS 16 -30.946 -23.131 16.033
154 H LYS 17 HN LYS 17 -25.101 -19.748 18.798
155 HA LYS 17 HA LYS 17 -24.888 -19.401 21.674
156 HB2 LYS 17 HB2 LYS 17 -23.631 -21.862 21.439
157 HB3 LYS 17 HB1 LYS 17 -25.278 -21.635 22.112
158 HG2 LYS 17 HG2 LYS 17 -25.067 -21.939 19.105
159 HG3 LYS 17 HG1 LYS 17 -24.698 -23.385 20.102
160 HD2 LYS 17 HD2 LYS 17 -26.918 -23.048 21.305
161 HD3 LYS 17 HD1 LYS 17 -27.291 -21.720 20.154
162 HE2 LYS 17 HE2 LYS 17 -27.127 -23.340 18.232
163 HE3 LYS 17 HE1 LYS 17 -26.763 -24.676 19.403
164 HZ1 LYS 17 HZ1 LYS 17 -29.245 -23.569 18.648
165 HZ2 LYS 17 HZ2 LYS 17 -29.033 -23.382 20.322
166 HZ3 LYS 17 HZ3 LYS 17 -28.910 -24.922 19.617
Start of MODEL 17
1 H1 GLU 1 HT1 GLU 1 -9.406 -8.768 0.070
2 H2 GLU 1 HT2 GLU 1 -8.037 -7.834 -0.301
3 H3 GLU 1 HT3 GLU 1 -9.357 -7.125 0.500
4 HA GLU 1 HA GLU 1 -7.149 -8.579 1.538
5 HB2 GLU 1 HB2 GLU 1 -9.393 -6.843 2.706
6 HB3 GLU 1 HB1 GLU 1 -8.078 -7.535 3.722
7 HG2 GLU 1 HG2 GLU 1 -6.357 -6.279 2.465
8 HG3 GLU 1 HG1 GLU 1 -7.595 -5.681 1.292
9 H MET 2 HN MET 2 -10.754 -8.766 1.989
10 HA MET 2 HA MET 2 -10.304 -11.495 2.950
11 HB2 MET 2 HB2 MET 2 -12.240 -9.427 4.134
12 HB3 MET 2 HB1 MET 2 -12.302 -11.187 4.490
13 HG2 MET 2 HG2 MET 2 -9.891 -11.008 5.341
14 HG3 MET 2 HG1 MET 2 -10.026 -9.230 5.167
15 HE1 MET 2 HE1 MET 2 -12.295 -7.901 7.721
16 HE2 MET 2 HE2 MET 2 -13.042 -8.456 6.182
17 HE3 MET 2 HE3 MET 2 -11.387 -7.752 6.175
18 H ARG 3 HN ARG 3 -12.123 -12.932 2.483
19 HA ARG 3 HA ARG 3 -14.108 -11.686 0.776
20 HB2 ARG 3 HB2 ARG 3 -12.354 -12.818 -0.701
21 HB3 ARG 3 HB1 ARG 3 -12.694 -14.349 0.183
22 HG2 ARG 3 HG2 ARG 3 -15.123 -12.991 -0.913
23 HG3 ARG 3 HG1 ARG 3 -13.947 -13.524 -2.162
24 HD2 ARG 3 HD2 ARG 3 -14.960 -15.402 0.084
25 HD3 ARG 3 HD1 ARG 3 -15.753 -15.269 -1.551
26 HE ARG 3 HE ARG 3 -12.984 -15.682 -2.033
27 HH11 ARG 3 HH11 ARG 3 -15.712 -17.314 -0.428
28 HH12 ARG 3 HH12 ARG 3 -15.134 -18.917 -0.732
29 HH21 ARG 3 HH21 ARG 3 -12.196 -17.863 -2.449
30 HH22 ARG 3 HH22 ARG 3 -13.100 -19.234 -1.901
31 H LEU 4 HN LEU 4 -16.055 -12.087 1.759
32 HA LEU 4 HA LEU 4 -16.470 -14.788 2.679
33 HB2 LEU 4 HB2 LEU 4 -16.658 -12.342 4.498
34 HB3 LEU 4 HB1 LEU 4 -17.657 -13.813 4.795
35 HG LEU 4 HG LEU 4 -14.608 -13.752 4.548
36 HD11 LEU 4 HD11 LEU 4 -14.783 -14.416 7.078
37 HD12 LEU 4 HD12 LEU 4 -16.454 -13.739 6.993
38 HD13 LEU 4 HD13 LEU 4 -15.035 -12.687 6.625
39 HD21 LEU 4 HD21 LEU 4 -16.632 -15.958 4.589
40 HD22 LEU 4 HD22 LEU 4 -15.287 -16.165 5.782
41 HD23 LEU 4 HD23 LEU 4 -14.914 -15.951 4.027
42 H SER 5 HN SER 5 -18.770 -15.178 3.206
43 HA SER 5 HA SER 5 -20.407 -13.466 1.485
44 HB2 SER 5 HB2 SER 5 -19.986 -15.939 0.750
45 HB3 SER 5 HB1 SER 5 -20.914 -16.413 2.223
46 HG SER 5 HG SER 5 -21.750 -15.054 -0.103
47 H DPP 6 HN DPP 6 -22.631 -15.421 2.773
48 HA DPP 6 HA DPP 6 -23.401 -13.560 4.719
49 HB2 DPP 6 HB2 DPP 6 -24.370 -16.308 3.831
50 HB3 DPP 6 HB3 DPP 6 -25.311 -14.785 4.031
51 H PHE 7 HN PHE 7 -22.778 -17.049 5.490
52 HA PHE 7 HA PHE 7 -22.046 -17.911 7.422
53 HB2 PHE 7 HB2 PHE 7 -19.884 -18.182 6.406
54 HB3 PHE 7 HB1 PHE 7 -19.644 -16.390 6.241
55 HD1 PHE 7 HD1 PHE 7 -20.647 -18.148 9.402
56 HD2 PHE 7 HD2 PHE 7 -17.540 -16.193 7.239
57 HE1 PHE 7 HE1 PHE 7 -19.397 -17.878 11.491
58 HE2 PHE 7 HE2 PHE 7 -16.232 -16.037 9.321
59 HZ PHE 7 HZ PHE 7 -17.146 -16.882 11.430
60 H PHE 8 HN PHE 8 -19.971 -15.157 7.867
61 HA PHE 8 HA PHE 8 -20.611 -15.097 10.540
62 HB2 PHE 8 HB2 PHE 8 -18.758 -13.649 10.734
63 HB3 PHE 8 HB1 PHE 8 -18.384 -14.638 9.321
64 HD1 PHE 8 HD1 PHE 8 -18.421 -11.505 10.609
65 HD2 PHE 8 HD2 PHE 8 -19.293 -13.699 7.111
66 HE1 PHE 8 HE1 PHE 8 -18.193 -9.513 9.333
67 HE2 PHE 8 HE2 PHE 8 -19.052 -11.722 5.789
68 HZ PHE 8 HZ PHE 8 -18.485 -9.584 6.892
69 H ARG 9 HN ARG 9 -21.648 -12.920 7.856
70 HA ARG 9 HA ARG 9 -22.536 -11.119 9.812
71 HB2 ARG 9 HB2 ARG 9 -23.660 -11.513 6.986
72 HB3 ARG 9 HB1 ARG 9 -24.055 -10.128 8.062
73 HG2 ARG 9 HG2 ARG 9 -22.345 -9.035 7.091
74 HG3 ARG 9 HG1 ARG 9 -21.236 -10.150 7.972
75 HD2 ARG 9 HD2 ARG 9 -21.079 -11.662 6.111
76 HD3 ARG 9 HD1 ARG 9 -22.501 -10.909 5.274
77 HE ARG 9 HE ARG 9 -19.728 -9.837 5.336
78 HH11 ARG 9 HH11 ARG 9 -23.194 -9.258 4.735
79 HH12 ARG 9 HH12 ARG 9 -22.941 -7.900 3.691
80 HH21 ARG 9 HH21 ARG 9 -19.388 -7.992 3.916
81 HH22 ARG 9 HH22 ARG 9 -20.742 -7.170 3.218
82 H GLN 10 HN GLN 10 -23.587 -14.265 9.303
83 HA GLN 10 HA GLN 10 -25.912 -13.501 10.813
84 HB2 GLN 10 HB2 GLN 10 -27.400 -15.021 9.568
85 HB3 GLN 10 HB1 GLN 10 -26.767 -13.732 8.493
86 HG2 GLN 10 HG2 GLN 10 -25.155 -16.299 8.582
87 HG3 GLN 10 HG1 GLN 10 -26.779 -16.398 7.802
88 HE21 GLN 10 HE21 GLN 10 -25.182 -16.893 5.953
89 H PHE 11 HN PHE 11 -23.182 -14.681 11.145
90 HA PHE 11 HA PHE 11 -24.120 -17.086 12.493
91 HB2 PHE 11 HB2 PHE 11 -22.560 -17.808 10.702
92 HB3 PHE 11 HB1 PHE 11 -21.382 -16.580 11.263
93 HD1 PHE 11 HD1 PHE 11 -22.556 -19.889 11.590
94 HD2 PHE 11 HD2 PHE 11 -20.509 -16.739 13.583
95 HE1 PHE 11 HE1 PHE 11 -21.561 -21.527 13.130
96 HE2 PHE 11 HE2 PHE 11 -19.490 -18.391 15.117
97 HZ PHE 11 HZ PHE 11 -20.021 -20.780 14.893
98 H ILE 12 HN ILE 12 -21.703 -14.450 12.342
99 HA ILE 12 HA ILE 12 -21.255 -14.784 15.149
100 HB ILE 12 HB ILE 12 -20.328 -12.236 14.405
101 HG12 ILE 12 HG12 ILE 12 -18.682 -13.131 12.545
102 HG13 ILE 12 HG11 ILE 12 -20.148 -14.072 12.114
103 HG21 ILE 12 HG21 ILE 12 -18.898 -14.952 14.791
104 HG22 ILE 12 HG22 ILE 12 -19.137 -13.645 16.019
105 HG23 ILE 12 HG23 ILE 12 -18.015 -13.385 14.631
106 HD11 ILE 12 HD11 ILE 12 -19.958 -11.040 12.518
107 HD12 ILE 12 HD12 ILE 12 -21.503 -11.953 12.304
108 HD13 ILE 12 HD13 ILE 12 -20.289 -11.915 10.982
109 H LEU 13 HN LEU 13 -23.205 -13.351 12.966
110 HA LEU 13 HA LEU 13 -23.860 -11.167 14.655
111 HB2 LEU 13 HB2 LEU 13 -23.617 -11.897 11.909
112 HB3 LEU 13 HB1 LEU 13 -25.255 -11.150 12.199
113 HG LEU 13 HG LEU 13 -24.241 -9.121 13.104
114 HD11 LEU 13 HD11 LEU 13 -22.258 -9.140 14.221
115 HD12 LEU 13 HD12 LEU 13 -21.380 -9.536 12.696
116 HD13 LEU 13 HD13 LEU 13 -21.992 -10.863 13.753
117 HD21 LEU 13 HD21 LEU 13 -24.053 -9.774 10.451
118 HD22 LEU 13 HD22 LEU 13 -22.301 -9.517 10.809
119 HD23 LEU 13 HD23 LEU 13 -23.492 -8.195 11.119
120 H GLN 14 HN GLN 14 -24.576 -14.341 14.431
121 HA GLN 14 HA GLN 14 -27.064 -13.917 15.763
122 HB2 GLN 14 HB2 GLN 14 -26.898 -15.781 13.314
123 HB3 GLN 14 HB1 GLN 14 -28.277 -15.714 14.468
124 HG2 GLN 14 HG2 GLN 14 -28.648 -13.280 13.824
125 HG3 GLN 14 HG1 GLN 14 -27.354 -13.457 12.574
126 HE21 GLN 14 HE21 GLN 14 -30.455 -13.090 12.479
127 HE22 GLN 14 HE22 GLN 14 -30.982 -14.315 11.377
128 H ARG 15 HN ARG 15 -24.557 -14.368 16.594
129 HA ARG 15 HA ARG 15 -24.140 -17.206 16.790
130 HB2 ARG 15 HB2 ARG 15 -22.539 -14.836 16.897
131 HB3 ARG 15 HB1 ARG 15 -22.438 -15.588 18.529
132 HG2 ARG 15 HG2 ARG 15 -21.865 -17.816 17.368
133 HG3 ARG 15 HG1 ARG 15 -21.736 -16.904 15.819
134 HD2 ARG 15 HD2 ARG 15 -19.500 -16.855 16.528
135 HD3 ARG 15 HD1 ARG 15 -20.111 -15.320 17.292
136 HE ARG 15 HE ARG 15 -20.558 -17.493 19.125
137 HH11 ARG 15 HH11 ARG 15 -17.937 -15.624 17.597
138 HH12 ARG 15 HH12 ARG 15 -16.830 -15.810 18.915
139 HH21 ARG 15 HH21 ARG 15 -19.057 -17.744 20.915
140 HH22 ARG 15 HH22 ARG 15 -17.478 -17.037 20.835
141 H LYS 16 HN LYS 16 -26.008 -17.887 17.989
142 HA LYS 16 HA LYS 16 -26.657 -16.632 20.426
143 HB2 LYS 16 HB2 LYS 16 -28.096 -18.576 20.887
144 HB3 LYS 16 HB1 LYS 16 -28.311 -18.048 19.184
145 HG2 LYS 16 HG2 LYS 16 -26.744 -19.852 18.426
146 HG3 LYS 16 HG1 LYS 16 -26.543 -20.389 20.129
147 HD2 LYS 16 HD2 LYS 16 -28.995 -20.870 20.267
148 HD3 LYS 16 HD1 LYS 16 -29.196 -20.333 18.563
149 HE2 LYS 16 HE2 LYS 16 -27.681 -22.182 17.792
150 HE3 LYS 16 HE1 LYS 16 -27.467 -22.720 19.511
151 HZ1 LYS 16 HZ1 LYS 16 -29.288 -23.881 19.280
152 HZ2 LYS 16 HZ2 LYS 16 -29.536 -23.305 17.703
153 HZ3 LYS 16 HZ3 LYS 16 -30.198 -22.471 19.026
154 H LYS 17 HN LYS 17 -24.172 -18.903 19.454
155 HA LYS 17 HA LYS 17 -23.435 -19.061 22.280
156 HB2 LYS 17 HB2 LYS 17 -24.111 -21.357 20.471
157 HB3 LYS 17 HB1 LYS 17 -22.505 -21.500 21.268
158 HG2 LYS 17 HG2 LYS 17 -23.961 -22.588 22.776
159 HG3 LYS 17 HG1 LYS 17 -23.763 -20.953 23.496
160 HD2 LYS 17 HD2 LYS 17 -25.938 -20.231 22.536
161 HD3 LYS 17 HD1 LYS 17 -26.120 -21.813 21.705
162 HE2 LYS 17 HE2 LYS 17 -26.202 -22.983 23.928
163 HE3 LYS 17 HE1 LYS 17 -26.017 -21.387 24.769
164 HZ1 LYS 17 HZ1 LYS 17 -28.054 -20.668 23.688
165 HZ2 LYS 17 HZ2 LYS 17 -28.298 -22.054 24.638
166 HZ3 LYS 17 HZ3 LYS 17 -28.230 -22.185 22.947
Start of MODEL 18
1 H1 GLU 1 HT1 GLU 1 -8.596 -9.664 -2.569
2 H2 GLU 1 HT2 GLU 1 -10.225 -9.949 -2.956
3 H3 GLU 1 HT3 GLU 1 -9.517 -10.735 -1.626
4 HA GLU 1 HA GLU 1 -9.053 -8.187 -1.021
5 HB2 GLU 1 HB2 GLU 1 -10.462 -7.482 -3.002
6 HB3 GLU 1 HB1 GLU 1 -11.853 -8.365 -2.281
7 HG2 GLU 1 HG2 GLU 1 -11.814 -6.842 -0.285
8 HG3 GLU 1 HG1 GLU 1 -10.395 -5.961 -0.984
9 H MET 2 HN MET 2 -11.696 -10.658 -1.099
10 HA MET 2 HA MET 2 -11.710 -10.462 1.826
11 HB2 MET 2 HB2 MET 2 -14.149 -10.806 -0.006
12 HB3 MET 2 HB1 MET 2 -14.168 -11.056 1.772
13 HG2 MET 2 HG2 MET 2 -13.377 -8.632 2.033
14 HG3 MET 2 HG1 MET 2 -13.629 -8.428 0.271
15 HE1 MET 2 HE1 MET 2 -16.391 -10.055 -0.420
16 HE2 MET 2 HE2 MET 2 -15.503 -8.594 -0.976
17 HE3 MET 2 HE3 MET 2 -17.225 -8.463 -0.474
18 H ARG 3 HN ARG 3 -12.195 -12.510 2.882
19 HA ARG 3 HA ARG 3 -12.078 -14.724 0.976
20 HB2 ARG 3 HB2 ARG 3 -11.066 -15.074 3.818
21 HB3 ARG 3 HB1 ARG 3 -10.575 -15.953 2.327
22 HG2 ARG 3 HG2 ARG 3 -8.733 -14.649 2.263
23 HG3 ARG 3 HG1 ARG 3 -9.805 -13.276 1.827
24 HD2 ARG 3 HD2 ARG 3 -8.539 -12.496 3.733
25 HD3 ARG 3 HD1 ARG 3 -10.150 -12.973 4.433
26 HE ARG 3 HE ARG 3 -8.384 -15.255 4.480
27 HH11 ARG 3 HH11 ARG 3 -8.878 -12.041 5.934
28 HH12 ARG 3 HH12 ARG 3 -8.156 -12.448 7.455
29 HH21 ARG 3 HH21 ARG 3 -7.400 -15.809 6.548
30 HH22 ARG 3 HH22 ARG 3 -7.301 -14.627 7.809
31 H LEU 4 HN LEU 4 -14.183 -13.058 2.501
32 HA LEU 4 HA LEU 4 -15.750 -15.349 3.235
33 HB2 LEU 4 HB2 LEU 4 -16.417 -14.469 5.463
34 HB3 LEU 4 HB1 LEU 4 -14.652 -14.806 5.436
35 HG LEU 4 HG LEU 4 -14.531 -12.230 4.656
36 HD11 LEU 4 HD11 LEU 4 -17.297 -12.519 5.858
37 HD12 LEU 4 HD12 LEU 4 -16.684 -11.379 4.601
38 HD13 LEU 4 HD13 LEU 4 -16.324 -11.075 6.346
39 HD21 LEU 4 HD21 LEU 4 -14.694 -13.437 7.455
40 HD22 LEU 4 HD22 LEU 4 -14.453 -11.661 7.247
41 HD23 LEU 4 HD23 LEU 4 -13.263 -12.822 6.544
42 H SER 5 HN SER 5 -18.067 -14.340 3.982
43 HA SER 5 HA SER 5 -18.466 -11.746 2.817
44 HB2 SER 5 HB2 SER 5 -19.641 -14.280 1.544
45 HB3 SER 5 HB1 SER 5 -20.422 -12.659 1.363
46 HG SER 5 HG SER 5 -17.713 -12.692 0.894
47 H DPP 6 HN DPP 6 -20.358 -14.773 3.625
48 HA DPP 6 HA DPP 6 -22.141 -13.093 5.142
49 HB2 DPP 6 HB2 DPP 6 -22.116 -16.010 4.231
50 HB3 DPP 6 HB3 DPP 6 -23.461 -14.815 4.157
51 H PHE 7 HN PHE 7 -21.093 -16.286 6.362
52 HA PHE 7 HA PHE 7 -20.275 -16.871 8.318
53 HB2 PHE 7 HB2 PHE 7 -17.987 -16.379 7.724
54 HB3 PHE 7 HB1 PHE 7 -18.328 -14.602 7.578
55 HD1 PHE 7 HD1 PHE 7 -19.334 -16.692 10.511
56 HD2 PHE 7 HD2 PHE 7 -16.590 -13.819 8.963
57 HE1 PHE 7 HE1 PHE 7 -18.677 -16.127 12.800
58 HE2 PHE 7 HE2 PHE 7 -15.842 -13.346 11.262
59 HZ PHE 7 HZ PHE 7 -16.868 -14.495 13.166
60 H PHE 8 HN PHE 8 -19.334 -13.591 9.026
61 HA PHE 8 HA PHE 8 -20.489 -13.833 11.525
62 HB2 PHE 8 HB2 PHE 8 -19.234 -11.922 12.068
63 HB3 PHE 8 HB1 PHE 8 -18.303 -12.682 10.774
64 HD1 PHE 8 HD1 PHE 8 -19.506 -9.771 11.997
65 HD2 PHE 8 HD2 PHE 8 -19.030 -11.943 8.411
66 HE1 PHE 8 HE1 PHE 8 -19.625 -7.735 10.774
67 HE2 PHE 8 HE2 PHE 8 -19.129 -9.913 7.154
68 HZ PHE 8 HZ PHE 8 -19.419 -7.778 8.318
69 H ARG 9 HN ARG 9 -21.537 -11.813 8.686
70 HA ARG 9 HA ARG 9 -23.353 -10.590 10.438
71 HB2 ARG 9 HB2 ARG 9 -24.756 -10.183 8.189
72 HB3 ARG 9 HB1 ARG 9 -23.226 -9.292 8.490
73 HG2 ARG 9 HG2 ARG 9 -22.823 -11.928 7.148
74 HG3 ARG 9 HG1 ARG 9 -23.839 -10.781 6.208
75 HD2 ARG 9 HD2 ARG 9 -21.583 -9.294 7.323
76 HD3 ARG 9 HD1 ARG 9 -20.951 -10.787 6.491
77 HE ARG 9 HE ARG 9 -22.826 -9.797 4.685
78 HH11 ARG 9 HH11 ARG 9 -20.082 -8.383 6.463
79 HH12 ARG 9 HH12 ARG 9 -19.690 -7.222 5.240
80 HH21 ARG 9 HH21 ARG 9 -22.294 -8.220 3.026
81 HH22 ARG 9 HH22 ARG 9 -20.969 -7.128 3.254
82 H GLN 10 HN GLN 10 -23.224 -13.812 9.785
83 HA GLN 10 HA GLN 10 -25.956 -13.919 10.628
84 HB2 GLN 10 HB2 GLN 10 -26.582 -15.698 9.061
85 HB3 GLN 10 HB1 GLN 10 -26.075 -14.243 8.144
86 HG2 GLN 10 HG2 GLN 10 -23.873 -16.233 8.721
87 HG3 GLN 10 HG1 GLN 10 -25.167 -16.805 7.604
88 HE21 GLN 10 HE21 GLN 10 -23.169 -16.797 6.170
89 H PHE 11 HN PHE 11 -23.107 -14.236 11.585
90 HA PHE 11 HA PHE 11 -23.544 -16.879 12.731
91 HB2 PHE 11 HB2 PHE 11 -21.516 -17.061 11.334
92 HB3 PHE 11 HB1 PHE 11 -20.891 -15.545 12.059
93 HD1 PHE 11 HD1 PHE 11 -21.074 -19.067 12.295
94 HD2 PHE 11 HD2 PHE 11 -20.459 -15.489 14.508
95 HE1 PHE 11 HE1 PHE 11 -19.975 -20.366 14.067
96 HE2 PHE 11 HE2 PHE 11 -19.334 -16.793 16.278
97 HZ PHE 11 HZ PHE 11 -19.094 -19.228 16.059
98 H ILE 12 HN ILE 12 -22.058 -13.640 13.054
99 HA ILE 12 HA ILE 12 -22.092 -13.983 15.900
100 HB ILE 12 HB ILE 12 -21.840 -11.237 15.341
101 HG12 ILE 12 HG12 ILE 12 -19.669 -11.504 13.865
102 HG13 ILE 12 HG11 ILE 12 -20.666 -12.815 13.152
103 HG21 ILE 12 HG21 ILE 12 -19.360 -11.689 16.014
104 HG22 ILE 12 HG22 ILE 12 -19.799 -13.438 16.068
105 HG23 ILE 12 HG23 ILE 12 -20.613 -12.265 17.177
106 HD11 ILE 12 HD11 ILE 12 -22.606 -11.216 13.034
107 HD12 ILE 12 HD12 ILE 12 -21.214 -10.731 12.001
108 HD13 ILE 12 HD13 ILE 12 -21.498 -9.896 13.569
109 H LEU 13 HN LEU 13 -23.928 -13.127 13.356
110 HA LEU 13 HA LEU 13 -25.536 -11.321 14.847
111 HB2 LEU 13 HB2 LEU 13 -24.526 -11.767 12.220
112 HB3 LEU 13 HB1 LEU 13 -26.340 -11.586 12.150
113 HG LEU 13 HG LEU 13 -26.216 -9.414 13.294
114 HD11 LEU 13 HD11 LEU 13 -23.319 -8.933 13.374
115 HD12 LEU 13 HD12 LEU 13 -23.703 -10.409 14.337
116 HD13 LEU 13 HD13 LEU 13 -24.526 -8.846 14.710
117 HD21 LEU 13 HD21 LEU 13 -23.913 -8.990 11.381
118 HD22 LEU 13 HD22 LEU 13 -25.523 -8.175 11.477
119 HD23 LEU 13 HD23 LEU 13 -25.383 -9.799 10.706
120 H GLN 14 HN GLN 14 -25.183 -14.544 14.501
121 HA GLN 14 HA GLN 14 -27.894 -14.959 15.282
122 HB2 GLN 14 HB2 GLN 14 -26.693 -16.531 12.920
123 HB3 GLN 14 HB1 GLN 14 -28.212 -16.970 13.778
124 HG2 GLN 14 HG2 GLN 14 -29.218 -14.748 13.074
125 HG3 GLN 14 HG1 GLN 14 -27.718 -14.410 12.122
126 HE21 GLN 14 HE21 GLN 14 -30.831 -15.482 11.760
127 HE22 GLN 14 HE22 GLN 14 -30.643 -16.561 10.419
128 H ARG 15 HN ARG 15 -25.604 -14.695 16.630
129 HA ARG 15 HA ARG 15 -24.364 -17.270 16.900
130 HB2 ARG 15 HB2 ARG 15 -23.653 -14.543 17.366
131 HB3 ARG 15 HB1 ARG 15 -23.682 -15.330 18.986
132 HG2 ARG 15 HG2 ARG 15 -22.183 -17.178 18.054
133 HG3 ARG 15 HG1 ARG 15 -22.055 -16.244 16.516
134 HD2 ARG 15 HD2 ARG 15 -20.111 -15.575 17.724
135 HD3 ARG 15 HD1 ARG 15 -21.290 -14.241 18.074
136 HE ARG 15 HE ARG 15 -21.403 -14.967 20.325
137 HH11 ARG 15 HH11 ARG 15 -19.767 -17.387 18.278
138 HH12 ARG 15 HH12 ARG 15 -19.187 -18.338 19.604
139 HH21 ARG 15 HH21 ARG 15 -20.609 -16.259 22.121
140 HH22 ARG 15 HH22 ARG 15 -19.676 -17.687 21.824
141 H LYS 16 HN LYS 16 -26.173 -18.559 17.604
142 HA LYS 16 HA LYS 16 -27.353 -17.745 20.141
143 HB2 LYS 16 HB2 LYS 16 -27.852 -20.282 18.473
144 HB3 LYS 16 HB1 LYS 16 -28.848 -19.695 19.853
145 HG2 LYS 16 HG2 LYS 16 -28.454 -18.214 17.189
146 HG3 LYS 16 HG1 LYS 16 -29.880 -19.228 17.607
147 HD2 LYS 16 HD2 LYS 16 -30.356 -17.698 19.561
148 HD3 LYS 16 HD1 LYS 16 -28.965 -16.670 19.072
149 HE2 LYS 16 HE2 LYS 16 -30.079 -16.201 16.867
150 HE3 LYS 16 HE1 LYS 16 -31.485 -17.234 17.365
151 HZ1 LYS 16 HZ1 LYS 16 -32.295 -15.568 18.504
152 HZ2 LYS 16 HZ2 LYS 16 -31.086 -14.559 17.869
153 HZ3 LYS 16 HZ3 LYS 16 -30.854 -15.324 19.366
154 H LYS 17 HN LYS 17 -24.606 -19.264 18.960
155 HA LYS 17 HA LYS 17 -23.049 -20.521 19.939
156 HB2 LYS 17 HB2 LYS 17 -24.643 -20.266 22.559
157 HB3 LYS 17 HB1 LYS 17 -22.912 -20.727 22.395
158 HG2 LYS 17 HG2 LYS 17 -22.206 -18.552 21.989
159 HG3 LYS 17 HG1 LYS 17 -23.750 -18.062 21.213
160 HD2 LYS 17 HD2 LYS 17 -23.533 -16.899 23.346
161 HD3 LYS 17 HD1 LYS 17 -24.869 -18.097 23.466
162 HE2 LYS 17 HE2 LYS 17 -23.364 -19.678 24.697
163 HE3 LYS 17 HE1 LYS 17 -21.988 -18.510 24.532
164 HZ1 LYS 17 HZ1 LYS 17 -24.011 -18.596 26.460
165 HZ2 LYS 17 HZ2 LYS 17 -24.194 -17.152 25.585
166 HZ3 LYS 17 HZ3 LYS 17 -22.709 -17.516 26.322
Start of MODEL 19
1 H1 GLU 1 HT1 GLU 1 -12.781 -8.476 -3.240
2 H2 GLU 1 HT2 GLU 1 -11.704 -7.881 -4.412
3 H3 GLU 1 HT3 GLU 1 -11.929 -7.034 -2.957
4 HA GLU 1 HA GLU 1 -10.665 -9.670 -3.323
5 HB2 GLU 1 HB2 GLU 1 -9.243 -7.673 -3.881
6 HB3 GLU 1 HB1 GLU 1 -9.616 -6.977 -2.268
7 HG2 GLU 1 HG2 GLU 1 -7.363 -7.991 -2.218
8 HG3 GLU 1 HG1 GLU 1 -8.465 -8.969 -1.172
9 H MET 2 HN MET 2 -12.117 -10.791 -1.851
10 HA MET 2 HA MET 2 -11.550 -10.039 0.918
11 HB2 MET 2 HB2 MET 2 -14.279 -10.955 -0.153
12 HB3 MET 2 HB1 MET 2 -13.858 -10.761 1.583
13 HG2 MET 2 HG2 MET 2 -13.451 -8.317 1.214
14 HG3 MET 2 HG1 MET 2 -13.872 -8.505 -0.517
15 HE1 MET 2 HE1 MET 2 -14.582 -8.933 2.974
16 HE2 MET 2 HE2 MET 2 -16.109 -9.882 2.981
17 HE3 MET 2 HE3 MET 2 -16.153 -8.108 3.263
18 H ARG 3 HN ARG 3 -11.795 -11.918 2.402
19 HA ARG 3 HA ARG 3 -11.707 -14.414 0.893
20 HB2 ARG 3 HB2 ARG 3 -10.086 -15.254 2.711
21 HB3 ARG 3 HB1 ARG 3 -9.388 -14.083 1.541
22 HG2 ARG 3 HG2 ARG 3 -9.633 -12.237 3.143
23 HG3 ARG 3 HG1 ARG 3 -10.520 -13.296 4.293
24 HD2 ARG 3 HD2 ARG 3 -8.190 -13.073 5.070
25 HD3 ARG 3 HD1 ARG 3 -8.401 -14.765 4.436
26 HE ARG 3 HE ARG 3 -7.500 -13.027 2.302
27 HH11 ARG 3 HH11 ARG 3 -6.464 -14.587 5.332
28 HH12 ARG 3 HH12 ARG 3 -4.797 -14.709 4.880
29 HH21 ARG 3 HH21 ARG 3 -5.232 -13.193 1.687
30 HH22 ARG 3 HH22 ARG 3 -4.084 -13.901 2.773
31 H LEU 4 HN LEU 4 -13.860 -12.884 2.304
32 HA LEU 4 HA LEU 4 -14.824 -15.073 3.842
33 HB2 LEU 4 HB2 LEU 4 -15.193 -13.780 5.958
34 HB3 LEU 4 HB1 LEU 4 -13.443 -14.040 5.635
35 HG LEU 4 HG LEU 4 -13.873 -11.651 4.307
36 HD11 LEU 4 HD11 LEU 4 -16.166 -11.325 5.034
37 HD12 LEU 4 HD12 LEU 4 -15.133 -10.166 5.960
38 HD13 LEU 4 HD13 LEU 4 -15.736 -11.669 6.755
39 HD21 LEU 4 HD21 LEU 4 -13.050 -12.032 7.253
40 HD22 LEU 4 HD22 LEU 4 -12.716 -10.573 6.245
41 HD23 LEU 4 HD23 LEU 4 -11.975 -12.161 5.806
42 H SER 5 HN SER 5 -17.114 -14.785 4.300
43 HA SER 5 HA SER 5 -18.297 -12.282 3.699
44 HB2 SER 5 HB2 SER 5 -19.722 -12.998 1.802
45 HB3 SER 5 HB1 SER 5 -17.987 -13.172 1.332
46 HG SER 5 HG SER 5 -18.975 -15.382 2.588
47 H DPP 6 HN DPP 6 -20.665 -12.390 4.242
48 HA DPP 6 HA DPP 6 -22.160 -12.968 5.760
49 HB2 DPP 6 HB2 DPP 6 -21.573 -15.781 4.622
50 HB3 DPP 6 HB3 DPP 6 -22.939 -14.694 4.179
51 H PHE 7 HN PHE 7 -21.025 -16.151 6.582
52 HA PHE 7 HA PHE 7 -20.322 -16.952 8.514
53 HB2 PHE 7 HB2 PHE 7 -17.979 -16.642 8.015
54 HB3 PHE 7 HB1 PHE 7 -18.150 -14.837 7.947
55 HD1 PHE 7 HD1 PHE 7 -19.433 -16.968 10.747
56 HD2 PHE 7 HD2 PHE 7 -16.401 -14.273 9.428
57 HE1 PHE 7 HE1 PHE 7 -18.827 -16.558 13.084
58 HE2 PHE 7 HE2 PHE 7 -15.703 -13.970 11.773
59 HZ PHE 7 HZ PHE 7 -16.894 -15.109 13.586
60 H PHE 8 HN PHE 8 -19.101 -13.846 9.494
61 HA PHE 8 HA PHE 8 -20.434 -14.103 11.899
62 HB2 PHE 8 HB2 PHE 8 -19.045 -12.341 12.617
63 HB3 PHE 8 HB1 PHE 8 -18.108 -13.120 11.345
64 HD1 PHE 8 HD1 PHE 8 -19.094 -10.158 12.644
65 HD2 PHE 8 HD2 PHE 8 -18.615 -12.208 8.987
66 HE1 PHE 8 HE1 PHE 8 -18.913 -8.063 11.517
67 HE2 PHE 8 HE2 PHE 8 -18.424 -10.128 7.837
68 HZ PHE 8 HZ PHE 8 -18.549 -8.020 9.077
69 H ARG 9 HN ARG 9 -21.105 -12.092 9.014
70 HA ARG 9 HA ARG 9 -22.887 -10.584 10.547
71 HB2 ARG 9 HB2 ARG 9 -22.835 -11.184 7.546
72 HB3 ARG 9 HB1 ARG 9 -24.083 -10.119 8.282
73 HG2 ARG 9 HG2 ARG 9 -22.670 -8.388 8.044
74 HG3 ARG 9 HG1 ARG 9 -21.569 -9.163 9.245
75 HD2 ARG 9 HD2 ARG 9 -20.361 -10.359 7.494
76 HD3 ARG 9 HD1 ARG 9 -21.571 -9.849 6.239
77 HE ARG 9 HE ARG 9 -20.484 -7.492 7.514
78 HH11 ARG 9 HH11 ARG 9 -19.634 -10.161 5.317
79 HH12 ARG 9 HH12 ARG 9 -18.455 -9.258 4.425
80 HH21 ARG 9 HH21 ARG 9 -18.883 -6.261 6.303
81 HH22 ARG 9 HH22 ARG 9 -18.021 -7.002 4.997
82 H GLN 10 HN GLN 10 -23.027 -13.892 9.807
83 HA GLN 10 HA GLN 10 -25.766 -13.732 10.667
84 HB2 GLN 10 HB2 GLN 10 -26.546 -15.415 9.062
85 HB3 GLN 10 HB1 GLN 10 -25.915 -13.979 8.194
86 HG2 GLN 10 HG2 GLN 10 -23.952 -16.246 8.696
87 HG3 GLN 10 HG1 GLN 10 -25.253 -16.539 7.482
88 HE21 GLN 10 HE21 GLN 10 -23.150 -16.657 6.150
89 H PHE 11 HN PHE 11 -23.069 -14.294 11.753
90 HA PHE 11 HA PHE 11 -23.740 -16.929 12.789
91 HB2 PHE 11 HB2 PHE 11 -21.669 -17.242 11.491
92 HB3 PHE 11 HB1 PHE 11 -20.968 -15.792 12.269
93 HD1 PHE 11 HD1 PHE 11 -21.398 -19.283 12.420
94 HD2 PHE 11 HD2 PHE 11 -20.666 -15.801 14.746
95 HE1 PHE 11 HE1 PHE 11 -20.484 -20.689 14.216
96 HE2 PHE 11 HE2 PHE 11 -19.725 -17.215 16.542
97 HZ PHE 11 HZ PHE 11 -19.636 -19.654 16.277
98 H ILE 12 HN ILE 12 -22.080 -13.790 13.291
99 HA ILE 12 HA ILE 12 -22.312 -14.214 16.119
100 HB ILE 12 HB ILE 12 -21.874 -11.467 15.642
101 HG12 ILE 12 HG12 ILE 12 -19.592 -11.880 14.358
102 HG13 ILE 12 HG11 ILE 12 -20.634 -13.082 13.529
103 HG21 ILE 12 HG21 ILE 12 -19.518 -12.039 16.549
104 HG22 ILE 12 HG22 ILE 12 -19.990 -13.779 16.466
105 HG23 ILE 12 HG23 ILE 12 -20.887 -12.647 17.556
106 HD11 ILE 12 HD11 ILE 12 -20.913 -10.949 12.383
107 HD12 ILE 12 HD12 ILE 12 -21.228 -10.105 13.940
108 HD13 ILE 12 HD13 ILE 12 -22.414 -11.310 13.301
109 H LEU 13 HN LEU 13 -23.833 -13.056 13.468
110 HA LEU 13 HA LEU 13 -25.457 -11.237 14.902
111 HB2 LEU 13 HB2 LEU 13 -24.311 -11.724 12.329
112 HB3 LEU 13 HB1 LEU 13 -26.088 -11.360 12.160
113 HG LEU 13 HG LEU 13 -25.833 -9.214 13.273
114 HD11 LEU 13 HD11 LEU 13 -22.990 -8.940 13.773
115 HD12 LEU 13 HD12 LEU 13 -23.514 -10.473 14.562
116 HD13 LEU 13 HD13 LEU 13 -24.340 -8.922 14.967
117 HD21 LEU 13 HD21 LEU 13 -23.255 -9.100 11.673
118 HD22 LEU 13 HD22 LEU 13 -24.716 -8.039 11.613
119 HD23 LEU 13 HD23 LEU 13 -24.745 -9.655 10.812
120 H GLN 14 HN GLN 14 -25.290 -14.468 14.512
121 HA GLN 14 HA GLN 14 -28.065 -14.758 15.075
122 HB2 GLN 14 HB2 GLN 14 -26.811 -16.324 12.736
123 HB3 GLN 14 HB1 GLN 14 -28.436 -16.633 13.442
124 HG2 GLN 14 HG2 GLN 14 -29.162 -14.313 12.729
125 HG3 GLN 14 HG1 GLN 14 -27.552 -14.084 11.938
126 HE21 GLN 14 HE21 GLN 14 -29.437 -13.839 10.139
127 HE22 GLN 14 HE22 GLN 14 -29.704 -15.267 9.198
128 H ARG 15 HN ARG 15 -25.904 -14.702 16.607
129 HA ARG 15 HA ARG 15 -24.769 -17.340 16.748
130 HB2 ARG 15 HB2 ARG 15 -23.908 -14.727 17.369
131 HB3 ARG 15 HB1 ARG 15 -24.157 -15.499 18.974
132 HG2 ARG 15 HG2 ARG 15 -22.728 -17.456 18.219
133 HG3 ARG 15 HG1 ARG 15 -22.396 -16.582 16.670
134 HD2 ARG 15 HD2 ARG 15 -20.524 -15.927 17.920
135 HD3 ARG 15 HD1 ARG 15 -21.677 -14.599 18.383
136 HE ARG 15 HE ARG 15 -22.072 -16.746 20.225
137 HH11 ARG 15 HH11 ARG 15 -19.557 -14.445 19.196
138 HH12 ARG 15 HH12 ARG 15 -18.781 -14.363 20.742
139 HH21 ARG 15 HH21 ARG 15 -21.020 -16.634 22.330
140 HH22 ARG 15 HH22 ARG 15 -19.628 -15.629 22.554
141 H LYS 16 HN LYS 16 -26.647 -18.618 17.306
142 HA LYS 16 HA LYS 16 -27.632 -17.986 19.984
143 HB2 LYS 16 HB2 LYS 16 -29.349 -18.347 18.080
144 HB3 LYS 16 HB1 LYS 16 -28.768 -20.049 18.025
145 HG2 LYS 16 HG2 LYS 16 -29.404 -20.369 20.405
146 HG3 LYS 16 HG1 LYS 16 -29.934 -18.657 20.509
147 HD2 LYS 16 HD2 LYS 16 -31.692 -19.076 18.790
148 HD3 LYS 16 HD1 LYS 16 -31.138 -20.777 18.621
149 HE2 LYS 16 HE2 LYS 16 -33.152 -20.679 20.073
150 HE3 LYS 16 HE1 LYS 16 -31.718 -21.170 21.067
151 HZ1 LYS 16 HZ1 LYS 16 -31.925 -19.373 22.286
152 HZ2 LYS 16 HZ2 LYS 16 -33.437 -19.116 21.559
153 HZ3 LYS 16 HZ3 LYS 16 -32.058 -18.334 20.950
154 H LYS 17 HN LYS 17 -25.172 -18.718 20.253
155 HA LYS 17 HA LYS 17 -25.284 -21.633 20.628
156 HB2 LYS 17 HB2 LYS 17 -22.656 -20.118 20.720
157 HB3 LYS 17 HB1 LYS 17 -22.969 -21.817 20.224
158 HG2 LYS 17 HG2 LYS 17 -23.604 -19.280 18.596
159 HG3 LYS 17 HG1 LYS 17 -22.283 -20.455 18.283
160 HD2 LYS 17 HD2 LYS 17 -24.061 -22.255 17.944
161 HD3 LYS 17 HD1 LYS 17 -25.315 -20.973 18.103
162 HE2 LYS 17 HE2 LYS 17 -24.336 -19.767 16.123
163 HE3 LYS 17 HE1 LYS 17 -23.095 -21.080 15.949
164 HZ1 LYS 17 HZ1 LYS 17 -25.593 -21.009 14.856
165 HZ2 LYS 17 HZ2 LYS 17 -25.753 -22.109 16.141
166 HZ3 LYS 17 HZ3 LYS 17 -24.560 -22.353 14.957
Start of MODEL 20
1 H1 GLU 1 HT1 GLU 1 -8.963 -10.419 -4.013
2 H2 GLU 1 HT2 GLU 1 -10.404 -11.316 -4.095
3 H3 GLU 1 HT3 GLU 1 -9.595 -11.140 -2.610
4 HA GLU 1 HA GLU 1 -9.945 -8.598 -3.296
5 HB2 GLU 1 HB2 GLU 1 -12.338 -10.244 -4.290
6 HB3 GLU 1 HB1 GLU 1 -12.460 -8.489 -3.906
7 HG2 GLU 1 HG2 GLU 1 -10.798 -7.927 -5.655
8 HG3 GLU 1 HG1 GLU 1 -10.504 -9.680 -5.987
9 H MET 2 HN MET 2 -11.673 -11.491 -1.999
10 HA MET 2 HA MET 2 -12.025 -9.945 0.463
11 HB2 MET 2 HB2 MET 2 -14.060 -11.866 -0.795
12 HB3 MET 2 HB1 MET 2 -14.158 -11.236 0.884
13 HG2 MET 2 HG2 MET 2 -14.192 -8.870 -0.096
14 HG3 MET 2 HG1 MET 2 -14.332 -9.612 -1.721
15 HE1 MET 2 HE1 MET 2 -16.376 -12.147 -1.376
16 HE2 MET 2 HE2 MET 2 -15.935 -10.917 -2.611
17 HE3 MET 2 HE3 MET 2 -17.651 -11.118 -2.118
18 H ARG 3 HN ARG 3 -12.016 -11.293 2.399
19 HA ARG 3 HA ARG 3 -10.978 -13.959 1.802
20 HB2 ARG 3 HB2 ARG 3 -9.625 -13.835 3.892
21 HB3 ARG 3 HB1 ARG 3 -9.153 -12.523 2.757
22 HG2 ARG 3 HG2 ARG 3 -10.587 -10.905 4.008
23 HG3 ARG 3 HG1 ARG 3 -11.092 -12.211 5.134
24 HD2 ARG 3 HD2 ARG 3 -8.719 -12.485 5.904
25 HD3 ARG 3 HD1 ARG 3 -8.198 -11.165 4.768
26 HE ARG 3 HE ARG 3 -9.700 -10.836 7.306
27 HH11 ARG 3 HH11 ARG 3 -8.724 -9.460 4.163
28 HH12 ARG 3 HH12 ARG 3 -8.963 -7.813 4.639
29 HH21 ARG 3 HH21 ARG 3 -10.018 -8.597 7.948
30 HH22 ARG 3 HH22 ARG 3 -9.710 -7.315 6.827
31 H LEU 4 HN LEU 4 -13.698 -12.477 2.581
32 HA LEU 4 HA LEU 4 -14.627 -14.638 4.145
33 HB2 LEU 4 HB2 LEU 4 -15.473 -13.153 6.065
34 HB3 LEU 4 HB1 LEU 4 -13.708 -13.485 6.089
35 HG LEU 4 HG LEU 4 -13.500 -11.247 4.712
36 HD11 LEU 4 HD11 LEU 4 -15.524 -9.731 5.905
37 HD12 LEU 4 HD12 LEU 4 -16.394 -11.244 5.433
38 HD13 LEU 4 HD13 LEU 4 -15.498 -10.295 4.189
39 HD21 LEU 4 HD21 LEU 4 -13.686 -9.933 7.016
40 HD22 LEU 4 HD22 LEU 4 -12.453 -11.238 6.808
41 HD23 LEU 4 HD23 LEU 4 -13.984 -11.574 7.706
42 H SER 5 HN SER 5 -17.063 -14.017 4.809
43 HA SER 5 HA SER 5 -18.198 -11.907 3.338
44 HB2 SER 5 HB2 SER 5 -17.728 -13.570 1.422
45 HB3 SER 5 HB1 SER 5 -18.829 -14.729 2.262
46 HG SER 5 HG SER 5 -19.382 -12.229 1.071
47 H DPP 6 HN DPP 6 -20.546 -14.297 3.135
48 HA DPP 6 HA DPP 6 -21.619 -13.397 5.589
49 HB2 DPP 6 HB2 DPP 6 -22.556 -15.583 3.643
50 HB3 DPP 6 HB3 DPP 6 -23.325 -13.985 3.963
51 H PHE 7 HN PHE 7 -20.518 -13.856 7.337
52 HA PHE 7 HA PHE 7 -20.426 -16.662 8.114
53 HB2 PHE 7 HB2 PHE 7 -18.027 -16.599 7.944
54 HB3 PHE 7 HB1 PHE 7 -18.009 -14.784 7.913
55 HD1 PHE 7 HD1 PHE 7 -19.543 -16.997 10.539
56 HD2 PHE 7 HD2 PHE 7 -16.415 -14.278 9.539
57 HE1 PHE 7 HE1 PHE 7 -19.050 -16.721 12.912
58 HE2 PHE 7 HE2 PHE 7 -15.853 -14.097 11.925
59 HZ PHE 7 HZ PHE 7 -17.150 -15.318 13.605
60 H PHE 8 HN PHE 8 -19.111 -13.678 9.425
61 HA PHE 8 HA PHE 8 -20.399 -14.101 11.846
62 HB2 PHE 8 HB2 PHE 8 -19.109 -12.249 12.598
63 HB3 PHE 8 HB1 PHE 8 -18.110 -13.015 11.344
64 HD1 PHE 8 HD1 PHE 8 -19.373 -10.094 12.566
65 HD2 PHE 8 HD2 PHE 8 -18.525 -12.149 8.977
66 HE1 PHE 8 HE1 PHE 8 -19.363 -8.024 11.414
67 HE2 PHE 8 HE2 PHE 8 -18.478 -10.073 7.785
68 HZ PHE 8 HZ PHE 8 -18.884 -7.974 8.993
69 H ARG 9 HN ARG 9 -21.129 -11.759 9.141
70 HA ARG 9 HA ARG 9 -23.021 -10.622 10.853
71 HB2 ARG 9 HB2 ARG 9 -23.926 -10.369 8.057
72 HB3 ARG 9 HB1 ARG 9 -23.411 -9.088 9.208
73 HG2 ARG 9 HG2 ARG 9 -21.913 -8.922 7.380
74 HG3 ARG 9 HG1 ARG 9 -20.997 -9.754 8.676
75 HD2 ARG 9 HD2 ARG 9 -20.477 -11.143 6.841
76 HD3 ARG 9 HD1 ARG 9 -21.972 -11.965 7.465
77 HE ARG 9 HE ARG 9 -23.167 -11.186 5.572
78 HH11 ARG 9 HH11 ARG 9 -19.974 -9.616 5.826
79 HH12 ARG 9 HH12 ARG 9 -20.033 -8.898 4.252
80 HH21 ARG 9 HH21 ARG 9 -23.239 -10.214 3.431
81 HH22 ARG 9 HH22 ARG 9 -21.919 -9.245 2.867
82 H GLN 10 HN GLN 10 -23.037 -13.768 9.849
83 HA GLN 10 HA GLN 10 -25.817 -13.743 10.511
84 HB2 GLN 10 HB2 GLN 10 -26.564 -15.209 8.731
85 HB3 GLN 10 HB1 GLN 10 -25.812 -13.767 7.985
86 HG2 GLN 10 HG2 GLN 10 -23.924 -16.080 8.398
87 HG3 GLN 10 HG1 GLN 10 -25.271 -16.397 7.241
88 HE21 GLN 10 HE21 GLN 10 -23.810 -16.449 5.445
89 H PHE 11 HN PHE 11 -23.255 -14.284 11.721
90 HA PHE 11 HA PHE 11 -23.876 -17.003 12.547
91 HB2 PHE 11 HB2 PHE 11 -21.743 -17.118 11.259
92 HB3 PHE 11 HB1 PHE 11 -21.107 -15.767 12.254
93 HD1 PHE 11 HD1 PHE 11 -21.491 -19.252 11.924
94 HD2 PHE 11 HD2 PHE 11 -20.936 -16.093 14.714
95 HE1 PHE 11 HE1 PHE 11 -20.650 -20.874 13.574
96 HE2 PHE 11 HE2 PHE 11 -20.070 -17.719 16.367
97 HZ PHE 11 HZ PHE 11 -19.929 -20.105 15.796
98 H ILE 12 HN ILE 12 -22.163 -13.935 13.246
99 HA ILE 12 HA ILE 12 -22.490 -14.448 16.046
100 HB ILE 12 HB ILE 12 -21.896 -11.728 15.748
101 HG12 ILE 12 HG12 ILE 12 -19.693 -12.048 14.364
102 HG13 ILE 12 HG11 ILE 12 -20.731 -13.222 13.491
103 HG21 ILE 12 HG21 ILE 12 -20.949 -13.240 17.502
104 HG22 ILE 12 HG22 ILE 12 -19.619 -12.387 16.633
105 HG23 ILE 12 HG23 ILE 12 -19.986 -14.113 16.248
106 HD11 ILE 12 HD11 ILE 12 -22.539 -11.494 13.372
107 HD12 ILE 12 HD12 ILE 12 -21.045 -11.006 12.496
108 HD13 ILE 12 HD13 ILE 12 -21.405 -10.301 14.111
109 H LEU 13 HN LEU 13 -24.127 -13.383 13.480
110 HA LEU 13 HA LEU 13 -25.580 -11.416 14.945
111 HB2 LEU 13 HB2 LEU 13 -24.421 -11.824 12.382
112 HB3 LEU 13 HB1 LEU 13 -26.202 -11.479 12.173
113 HG LEU 13 HG LEU 13 -25.991 -9.387 13.453
114 HD11 LEU 13 HD11 LEU 13 -24.372 -9.046 15.018
115 HD12 LEU 13 HD12 LEU 13 -23.077 -9.177 13.770
116 HD13 LEU 13 HD13 LEU 13 -23.662 -10.658 14.618
117 HD21 LEU 13 HD21 LEU 13 -23.525 -9.017 11.765
118 HD22 LEU 13 HD22 LEU 13 -25.106 -8.144 11.735
119 HD23 LEU 13 HD23 LEU 13 -24.942 -9.739 10.911
120 H GLN 14 HN GLN 14 -25.614 -14.451 15.006
121 HA GLN 14 HA GLN 14 -28.272 -14.724 15.595
122 HB2 GLN 14 HB2 GLN 14 -28.643 -16.709 13.873
123 HB3 GLN 14 HB1 GLN 14 -29.074 -15.038 13.368
124 HG2 GLN 14 HG2 GLN 14 -26.907 -14.802 12.170
125 HG3 GLN 14 HG1 GLN 14 -26.409 -16.456 12.719
126 HE21 GLN 14 HE21 GLN 14 -27.584 -18.326 11.926
127 HE22 GLN 14 HE22 GLN 14 -28.533 -18.242 10.481
128 H ARG 15 HN ARG 15 -26.052 -14.857 16.903
129 HA ARG 15 HA ARG 15 -24.988 -17.513 16.707
130 HB2 ARG 15 HB2 ARG 15 -23.981 -14.975 17.436
131 HB3 ARG 15 HB1 ARG 15 -24.107 -15.865 18.996
132 HG2 ARG 15 HG2 ARG 15 -22.822 -17.801 17.916
133 HG3 ARG 15 HG1 ARG 15 -22.564 -16.751 16.469
134 HD2 ARG 15 HD2 ARG 15 -20.670 -16.035 17.540
135 HD3 ARG 15 HD1 ARG 15 -21.788 -15.078 18.608
136 HE ARG 15 HE ARG 15 -21.631 -17.746 19.651
137 HH11 ARG 15 HH11 ARG 15 -19.609 -14.870 19.087
138 HH12 ARG 15 HH12 ARG 15 -18.558 -15.152 20.434
139 HH21 ARG 15 HH21 ARG 15 -20.202 -18.133 21.487
140 HH22 ARG 15 HH22 ARG 15 -18.902 -17.039 21.821
141 H LYS 16 HN LYS 16 -26.694 -18.850 17.372
142 HA LYS 16 HA LYS 16 -28.211 -18.334 19.651
143 HB2 LYS 16 HB2 LYS 16 -28.868 -20.030 17.898
144 HB3 LYS 16 HB1 LYS 16 -27.477 -21.047 18.407
145 HG2 LYS 16 HG2 LYS 16 -29.504 -21.940 19.415
146 HG3 LYS 16 HG1 LYS 16 -28.485 -21.230 20.713
147 HD2 LYS 16 HD2 LYS 16 -29.893 -19.187 20.747
148 HD3 LYS 16 HD1 LYS 16 -30.869 -19.807 19.370
149 HE2 LYS 16 HE2 LYS 16 -31.649 -21.733 20.784
150 HE3 LYS 16 HE1 LYS 16 -30.659 -21.111 22.170
151 HZ1 LYS 16 HZ1 LYS 16 -32.585 -20.121 22.635
152 HZ2 LYS 16 HZ2 LYS 16 -33.149 -20.118 21.033
153 HZ3 LYS 16 HZ3 LYS 16 -32.032 -18.944 21.542
154 H LYS 17 HN LYS 17 -25.069 -19.951 19.107
155 HA LYS 17 HA LYS 17 -23.481 -20.545 20.545
156 HB2 LYS 17 HB2 LYS 17 -25.066 -19.188 22.805
157 HB3 LYS 17 HB1 LYS 17 -23.316 -19.597 22.803
158 HG2 LYS 17 HG2 LYS 17 -22.730 -17.743 21.586
159 HG3 LYS 17 HG1 LYS 17 -24.191 -17.815 20.547
160 HD2 LYS 17 HD2 LYS 17 -24.285 -15.784 21.889
161 HD3 LYS 17 HD1 LYS 17 -25.564 -16.912 22.458
162 HE2 LYS 17 HE2 LYS 17 -24.131 -17.584 24.401
163 HE3 LYS 17 HE1 LYS 17 -22.807 -16.495 23.811
164 HZ1 LYS 17 HZ1 LYS 17 -23.802 -14.795 24.736
165 HZ2 LYS 17 HZ2 LYS 17 -24.912 -15.857 25.458
166 HZ3 LYS 17 HZ3 LYS 17 -25.286 -15.117 23.976
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