Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
608558 | 5kx0 RC | 30144 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H ASN 1 H ASN 1 -1.456 8.673 0.592
2 HA ASN 1 HA ASN 1 -3.947 9.491 -0.369
3 HB2 ASN 1 2HB ASN 1 -1.965 9.072 -1.845
4 HB3 ASN 1 1HB ASN 1 -2.179 7.350 -1.584
5 HD21 ASN 1 1HD2 ASN 1 -3.415 10.150 -3.194
6 HD22 ASN 1 2HD2 ASN 1 -4.527 9.313 -4.211
7 HA PRO 2 HA PRO 2 -6.372 6.301 1.529
8 HB2 PRO 2 2HB PRO 2 -8.743 6.891 0.314
9 HB3 PRO 2 1HB PRO 2 -8.109 7.750 1.718
10 HG2 PRO 2 2HG PRO 2 -8.034 8.511 -1.168
11 HG3 PRO 2 1HG PRO 2 -8.303 9.537 0.253
12 HD2 PRO 2 2HD PRO 2 -5.940 9.438 -1.041
13 HD3 PRO 2 1HD PRO 2 -6.048 9.702 0.712
14 H GLU 3 H GLU 3 -6.408 6.714 -1.980
15 HA GLU 3 HA GLU 3 -7.644 4.151 -2.336
16 HB2 GLU 3 2HB GLU 3 -6.551 6.136 -4.311
17 HB3 GLU 3 1HB GLU 3 -7.273 4.598 -4.771
18 HG2 GLU 3 2HG GLU 3 -8.650 6.798 -3.245
19 HG3 GLU 3 1HG GLU 3 -8.884 6.416 -4.951
20 H LEU 4 H LEU 4 -4.446 5.445 -2.390
21 HA LEU 4 HA LEU 4 -3.150 3.151 -3.415
22 HB2 LEU 4 2HB LEU 4 -2.077 5.365 -3.229
23 HB3 LEU 4 1HB LEU 4 -2.181 5.258 -1.486
24 HG LEU 4 HG LEU 4 -0.595 3.386 -1.502
25 HD11 LEU 4 1HD1 LEU 4 -1.077 2.445 -3.685
26 HD12 LEU 4 2HD1 LEU 4 0.635 2.851 -3.556
27 HD13 LEU 4 3HD1 LEU 4 -0.455 3.898 -4.464
28 HD21 LEU 4 1HD2 LEU 4 0.354 5.837 -2.978
29 HD22 LEU 4 2HD2 LEU 4 1.373 4.688 -2.108
30 HD23 LEU 4 3HD2 LEU 4 0.202 5.669 -1.229
31 H GLN 5 H GLN 5 -3.894 4.295 -0.151
32 HA GLN 5 HA GLN 5 -2.960 2.076 1.296
33 HB2 GLN 5 2HB GLN 5 -5.205 3.999 1.896
34 HB3 GLN 5 1HB GLN 5 -4.562 2.844 3.053
35 HG2 GLN 5 2HG GLN 5 -2.429 3.929 3.039
36 HG3 GLN 5 1HG GLN 5 -2.934 4.990 1.726
37 HE21 GLN 5 1HE2 GLN 5 -1.996 5.594 4.403
38 HE22 GLN 5 2HE2 GLN 5 -3.216 6.554 5.149
39 H ARG 6 H ARG 6 -5.974 2.710 -0.330
40 HA ARG 6 HA ARG 6 -7.541 0.562 0.532
41 HB2 ARG 6 2HB ARG 6 -8.412 2.409 -0.800
42 HB3 ARG 6 1HB ARG 6 -7.430 1.906 -2.162
43 HG2 ARG 6 2HG ARG 6 -8.697 -0.227 -2.224
44 HG3 ARG 6 1HG ARG 6 -9.735 0.432 -0.953
45 HD2 ARG 6 2HD ARG 6 -10.409 2.251 -2.387
46 HD3 ARG 6 1HD ARG 6 -9.288 1.714 -3.633
47 HE ARG 6 HE ARG 6 -11.197 -0.261 -2.850
48 HH11 ARG 6 1HH1 ARG 6 -10.702 2.566 -4.920
49 HH12 ARG 6 2HH1 ARG 6 -11.723 1.999 -6.171
50 HH21 ARG 6 1HH2 ARG 6 -12.625 -1.007 -4.540
51 HH22 ARG 6 2HH2 ARG 6 -12.852 -0.074 -5.951
52 H LYS 7 H LYS 7 -5.246 0.823 -2.145
53 HA LYS 7 HA LYS 7 -5.567 -1.750 -3.211
54 HB2 LYS 7 2HB LYS 7 -4.340 0.083 -4.358
55 HB3 LYS 7 1HB LYS 7 -3.061 -0.046 -3.160
56 HG2 LYS 7 2HG LYS 7 -2.638 -2.359 -3.900
57 HG3 LYS 7 1HG LYS 7 -3.869 -2.162 -5.145
58 HD2 LYS 7 2HD LYS 7 -2.561 -0.275 -6.078
59 HD3 LYS 7 1HD LYS 7 -1.304 -0.594 -4.880
60 HE2 LYS 7 2HE LYS 7 -1.002 -2.837 -5.780
61 HE3 LYS 7 1HE LYS 7 -2.285 -2.551 -6.949
62 HZ1 LYS 7 1HZ LYS 7 0.420 -1.327 -6.855
63 HZ2 LYS 7 2HZ LYS 7 -0.841 -0.620 -7.711
64 HZ3 LYS 7 3HZ LYS 7 -0.321 -2.153 -8.132
65 H CYS 8 H CYS 8 -3.389 -0.454 -0.770
66 HA CYS 8 HA CYS 8 -1.968 -2.766 -0.160
67 HB2 CYS 8 2HB CYS 8 -2.764 -0.506 1.647
68 HB3 CYS 8 1HB CYS 8 -1.446 -1.634 1.935
69 H LYS 9 H LYS 9 -4.942 -1.459 1.263
70 HA LYS 9 HA LYS 9 -5.241 -3.474 3.184
71 HB2 LYS 9 2HB LYS 9 -7.265 -1.634 1.945
72 HB3 LYS 9 1HB LYS 9 -7.623 -2.729 3.275
73 HG2 LYS 9 2HG LYS 9 -5.966 -1.597 4.655
74 HG3 LYS 9 1HG LYS 9 -5.587 -0.505 3.321
75 HD2 LYS 9 2HD LYS 9 -7.095 0.566 4.921
76 HD3 LYS 9 1HD LYS 9 -7.888 0.333 3.364
77 HE2 LYS 9 2HE LYS 9 -9.023 -1.660 4.236
78 HE3 LYS 9 1HE LYS 9 -8.208 -1.447 5.785
79 HZ1 LYS 9 1HZ LYS 9 -10.115 0.465 4.555
80 HZ2 LYS 9 2HZ LYS 9 -9.376 0.638 6.060
81 HZ3 LYS 9 3HZ LYS 9 -10.465 -0.614 5.795
82 H GLU 10 H GLU 10 -6.191 -3.330 -0.163
83 HA GLU 10 HA GLU 10 -7.796 -5.686 0.077
84 HB2 GLU 10 2HB GLU 10 -8.390 -3.892 -1.489
85 HB3 GLU 10 1HB GLU 10 -6.900 -4.174 -2.374
86 HG2 GLU 10 2HG GLU 10 -7.629 -6.249 -3.146
87 HG3 GLU 10 1HG GLU 10 -8.966 -6.303 -1.998
88 H LEU 11 H LEU 11 -4.535 -4.898 -0.920
89 HA LEU 11 HA LEU 11 -3.912 -7.510 -1.893
90 HB2 LEU 11 2HB LEU 11 -2.092 -5.331 -0.858
91 HB3 LEU 11 1HB LEU 11 -1.537 -6.805 -1.609
92 HG LEU 11 HG LEU 11 -3.133 -4.628 -2.959
93 HD11 LEU 11 1HD1 LEU 11 -0.855 -3.952 -2.466
94 HD12 LEU 11 2HD1 LEU 11 -1.064 -4.223 -4.197
95 HD13 LEU 11 3HD1 LEU 11 -0.243 -5.429 -3.210
96 HD21 LEU 11 1HD2 LEU 11 -3.643 -6.811 -3.911
97 HD22 LEU 11 2HD2 LEU 11 -1.923 -7.161 -4.077
98 HD23 LEU 11 3HD2 LEU 11 -2.658 -5.870 -5.029
99 H DAS 12 H DAS 12 -3.562 -5.847 1.183
100 HA DAS 12 HA DAS 12 -3.077 -8.429 2.464
101 HB2 DAS 12 1HB DAS 12 -5.140 -7.153 3.166
102 HB3 DAS 12 2HB DAS 12 -4.077 -5.868 3.732
103 H THR 13 H THR 13 -1.056 -8.664 3.165
104 HA THR 13 HA THR 13 0.545 -6.259 3.597
105 HB THR 13 HB THR 13 2.154 -7.980 4.671
106 HG1 THR 13 1HG THR 13 -0.119 -9.517 5.189
107 HG21 THR 13 1HG2 THR 13 -0.529 -7.469 5.960
108 HG22 THR 13 2HG2 THR 13 0.840 -6.360 5.949
109 HG23 THR 13 3HG2 THR 13 0.962 -7.896 6.804
110 H ARG 14 H ARG 14 -0.273 -8.174 1.317
111 HA ARG 14 HA ARG 14 2.152 -9.036 0.028
112 HB2 ARG 14 2HB ARG 14 -0.715 -8.765 -0.863
113 HB3 ARG 14 1HB ARG 14 0.536 -9.462 -1.868
114 HG2 ARG 14 2HG ARG 14 0.746 -11.338 -0.464
115 HG3 ARG 14 1HG ARG 14 -0.162 -10.556 0.835
116 HD2 ARG 14 2HD ARG 14 -1.472 -12.256 -0.452
117 HD3 ARG 14 1HD ARG 14 -2.189 -10.647 -0.428
118 HE ARG 14 HE ARG 14 -0.619 -11.705 -2.675
119 HH11 ARG 14 1HH1 ARG 14 -3.376 -9.820 -1.482
120 HH12 ARG 14 2HH1 ARG 14 -4.002 -9.483 -3.039
121 HH21 ARG 14 1HH2 ARG 14 -1.450 -11.202 -4.774
122 HH22 ARG 14 2HH2 ARG 14 -2.855 -10.267 -4.974
123 HA DPR 15 HA DPR 15 1.915 -5.654 -3.178
124 HB2 DPR 15 1HB DPR 15 4.595 -6.570 -3.916
125 HB3 DPR 15 2HB DPR 15 3.157 -6.453 -4.932
126 HG2 DPR 15 1HG DPR 15 4.205 -8.833 -4.213
127 HG3 DPR 15 2HG DPR 15 2.459 -8.601 -4.410
128 HD2 DPR 15 1HD DPR 15 4.086 -8.629 -1.892
129 HD3 DPR 15 2HD DPR 15 2.541 -9.434 -2.238
130 H DGL 16 H DGL 16 4.032 -6.700 -0.796
131 HA DGL 16 HA DGL 16 5.923 -4.648 -0.640
132 HB2 DGL 16 1HB DGL 16 4.729 -6.494 1.401
133 HB3 DGL 16 2HB DGL 16 6.085 -5.465 1.772
134 HG2 DGL 16 1HG DGL 16 5.959 -7.644 -0.314
135 HG3 DGL 16 2HG DGL 16 6.821 -7.717 1.223
136 H DAL 17 H DAL 17 2.633 -4.944 0.456
137 HA DAL 17 HA DAL 17 2.484 -2.798 2.240
138 HB1 DAL 17 1HB DAL 17 0.764 -4.532 2.028
139 HB2 DAL 17 2HB DAL 17 0.341 -3.910 0.431
140 HB3 DAL 17 3HB DAL 17 0.085 -2.913 1.864
141 H DGL 18 H DGL 18 2.230 -3.001 -1.255
142 HA DGL 18 HA DGL 18 1.248 -0.479 -1.925
143 HB2 DGL 18 1HB DGL 18 1.484 -2.214 -3.587
144 HB3 DGL 18 2HB DGL 18 3.215 -2.294 -3.333
145 HG2 DGL 18 1HG DGL 18 3.380 0.037 -4.208
146 HG3 DGL 18 2HG DGL 18 1.674 -0.073 -4.638
147 H DAR 19 H DAR 19 4.568 -1.578 -1.531
148 HA DAR 19 HA DAR 19 5.650 1.005 -2.004
149 HB2 DAR 19 1HB DAR 19 6.905 -1.545 -1.097
150 HB3 DAR 19 2HB DAR 19 7.805 -0.045 -0.963
151 HG2 DAR 19 1HG DAR 19 8.454 -1.050 -3.005
152 HG3 DAR 19 2HG DAR 19 7.415 0.304 -3.424
153 HD2 DAR 19 1HD DAR 19 6.784 -1.481 -4.830
154 HD3 DAR 19 2HD DAR 19 5.514 -1.323 -3.617
155 HE DAR 19 HE DAR 19 7.182 -3.151 -2.556
156 HH11 DAR 19 1HH2 DAR 19 7.248 -5.489 -2.969
157 HH12 DAR 19 2HH2 DAR 19 6.540 -6.073 -4.400
158 HH21 DAR 19 1HH1 DAR 19 5.285 -2.959 -5.550
159 HH22 DAR 19 2HH1 DAR 19 5.414 -4.628 -5.889
160 H DLY 20 H DLY 20 4.837 -0.772 0.893
161 HA DLY 20 HA DLY 20 5.907 1.035 2.748
162 HB2 DLY 20 1HB DLY 20 5.052 -1.173 3.403
163 HB3 DLY 20 2HB DLY 20 3.427 -0.689 2.954
164 HG2 DLY 20 1HG DLY 20 3.398 0.965 4.742
165 HG3 DLY 20 2HG DLY 20 5.045 0.521 5.186
166 HD2 DLY 20 1HD DLY 20 4.356 -1.695 5.788
167 HD3 DLY 20 2HD DLY 20 2.732 -1.412 5.174
168 HE2 DLY 20 1HE DLY 20 3.995 0.037 7.503
169 HE3 DLY 20 2HE DLY 20 2.831 -1.278 7.634
170 HZ1 DLY 20 1HZ DLY 20 1.227 0.136 6.412
171 HZ2 DLY 20 2HZ DLY 20 2.335 1.417 6.478
172 HZ3 DLY 20 3HZ DLY 20 1.699 0.785 7.891
173 H DCY 21 H DCY 21 2.673 0.908 1.275
174 HA DCY 21 HA DCY 21 1.656 3.234 2.450
175 HB2 DCY 21 1HB DCY 21 1.012 1.933 -0.171
176 HB3 DCY 21 2HB DCY 21 0.096 3.292 0.489
177 H DAR 22 H DAR 22 3.484 2.793 -0.535
178 HA DAR 22 HA DAR 22 3.251 5.495 -1.336
179 HB2 DAR 22 1HB DAR 22 5.282 3.402 -2.072
180 HB3 DAR 22 2HB DAR 22 5.236 5.000 -2.801
181 HG2 DAR 22 1HG DAR 22 2.964 4.538 -3.619
182 HG3 DAR 22 2HG DAR 22 3.067 2.917 -2.927
183 HD2 DAR 22 1HD DAR 22 4.975 2.422 -4.330
184 HD3 DAR 22 2HD DAR 22 4.906 4.042 -5.026
185 HE DAR 22 HE DAR 22 2.431 2.928 -5.437
186 HH11 DAR 22 1HH1 DAR 22 5.763 2.308 -6.450
187 HH12 DAR 22 2HH1 DAR 22 5.334 1.460 -7.857
188 HH21 DAR 22 1HH2 DAR 22 1.833 1.777 -7.403
189 HH22 DAR 22 2HH2 DAR 22 3.062 1.174 -8.417
190 H DGL 23 H DGL 23 5.682 3.778 0.530
191 HA DGL 23 HA DGL 23 7.528 5.839 0.822
192 HB2 DGL 23 1HB DGL 23 8.035 3.538 1.376
193 HB3 DGL 23 2HB DGL 23 6.812 3.527 2.629
194 HG2 DGL 23 1HG DGL 23 8.088 5.073 3.961
195 HG3 DGL 23 2HG DGL 23 9.305 5.197 2.689
196 H DGL 24 H DGL 24 4.769 4.943 2.850
197 HA DGL 24 HA DGL 24 5.186 7.078 4.702
198 HB2 DGL 24 1HB DGL 24 2.757 5.333 4.287
199 HB3 DGL 24 2HB DGL 24 3.066 6.357 5.684
200 HG2 DGL 24 1HG DGL 24 5.053 5.034 6.198
201 HG3 DGL 24 2HG DGL 24 4.715 3.989 4.822
202 H SER 25 H SER 25 2.734 6.497 2.197
203 HA SER 25 HA SER 25 2.174 9.366 2.155
204 HB2 SER 25 2HB SER 25 1.595 7.175 0.140
205 HB3 SER 25 1HB SER 25 1.097 8.851 -0.053
206 HG SER 25 HG SER 25 3.755 7.810 0.033
207 H ASP 26 H ASP 26 -0.116 9.967 2.088
208 HA ASP 26 HA ASP 26 -1.686 8.027 3.614
209 HB2 ASP 26 2HB ASP 26 -2.919 9.927 4.560
210 HB3 ASP 26 1HB ASP 26 -1.199 10.034 4.902
Start of MODEL 2
1 H ASN 1 H ASN 1 -1.566 8.724 0.381
2 HA ASN 1 HA ASN 1 -4.048 9.883 -0.478
3 HB2 ASN 1 2HB ASN 1 -2.351 7.663 -1.646
4 HB3 ASN 1 1HB ASN 1 -3.766 8.318 -2.448
5 HD21 ASN 1 1HD2 ASN 1 -3.101 11.104 -1.638
6 HD22 ASN 1 2HD2 ASN 1 -1.773 11.545 -2.627
7 HA PRO 2 HA PRO 2 -6.410 6.897 1.988
8 HB2 PRO 2 2HB PRO 2 -8.647 8.070 0.424
9 HB3 PRO 2 1HB PRO 2 -8.481 7.871 2.170
10 HG2 PRO 2 2HG PRO 2 -8.209 10.267 1.060
11 HG3 PRO 2 1HG PRO 2 -7.161 9.766 2.397
12 HD2 PRO 2 2HD PRO 2 -6.560 9.930 -0.522
13 HD3 PRO 2 1HD PRO 2 -5.538 10.322 0.874
14 H GLU 3 H GLU 3 -7.101 7.411 -1.453
15 HA GLU 3 HA GLU 3 -8.458 4.962 -1.848
16 HB2 GLU 3 2HB GLU 3 -8.658 6.883 -3.396
17 HB3 GLU 3 1HB GLU 3 -6.976 6.679 -3.857
18 HG2 GLU 3 2HG GLU 3 -8.408 5.784 -5.554
19 HG3 GLU 3 1HG GLU 3 -7.508 4.487 -4.784
20 H LEU 4 H LEU 4 -5.116 5.947 -2.208
21 HA LEU 4 HA LEU 4 -4.127 3.526 -3.258
22 HB2 LEU 4 2HB LEU 4 -2.888 5.637 -3.389
23 HB3 LEU 4 1HB LEU 4 -2.733 5.649 -1.645
24 HG LEU 4 HG LEU 4 -1.365 3.608 -1.768
25 HD11 LEU 4 1HD1 LEU 4 -1.515 4.041 -4.744
26 HD12 LEU 4 2HD1 LEU 4 -2.189 2.683 -3.840
27 HD13 LEU 4 3HD1 LEU 4 -0.441 2.903 -3.925
28 HD21 LEU 4 1HD2 LEU 4 -0.374 5.912 -3.421
29 HD22 LEU 4 2HD2 LEU 4 0.641 4.693 -2.646
30 HD23 LEU 4 3HD2 LEU 4 -0.325 5.798 -1.664
31 H GLN 5 H GLN 5 -4.469 4.761 0.035
32 HA GLN 5 HA GLN 5 -3.221 2.540 1.234
33 HB2 GLN 5 2HB GLN 5 -5.147 4.525 2.441
34 HB3 GLN 5 1HB GLN 5 -4.273 3.309 3.364
35 HG2 GLN 5 2HG GLN 5 -2.144 4.308 2.558
36 HG3 GLN 5 1HG GLN 5 -3.085 5.588 1.795
37 HE21 GLN 5 1HE2 GLN 5 -2.003 4.227 4.760
38 HE22 GLN 5 2HE2 GLN 5 -2.434 5.535 5.791
39 H ARG 6 H ARG 6 -6.480 3.023 0.132
40 HA ARG 6 HA ARG 6 -7.531 0.717 1.428
41 HB2 ARG 6 2HB ARG 6 -8.466 1.931 -1.196
42 HB3 ARG 6 1HB ARG 6 -9.335 0.716 -0.274
43 HG2 ARG 6 2HG ARG 6 -9.323 2.438 1.623
44 HG3 ARG 6 1HG ARG 6 -8.883 3.599 0.373
45 HD2 ARG 6 2HD ARG 6 -11.343 1.849 0.400
46 HD3 ARG 6 1HD ARG 6 -11.289 3.565 0.758
47 HE ARG 6 HE ARG 6 -10.293 3.301 -1.824
48 HH11 ARG 6 1HH1 ARG 6 -13.343 2.471 -0.195
49 HH12 ARG 6 2HH1 ARG 6 -14.287 2.751 -1.578
50 HH21 ARG 6 1HH2 ARG 6 -11.570 3.659 -3.657
51 HH22 ARG 6 2HH2 ARG 6 -13.269 3.419 -3.625
52 H LYS 7 H LYS 7 -5.975 1.268 -1.655
53 HA LYS 7 HA LYS 7 -6.027 -1.328 -2.660
54 HB2 LYS 7 2HB LYS 7 -5.349 0.276 -4.199
55 HB3 LYS 7 1HB LYS 7 -4.219 1.027 -3.082
56 HG2 LYS 7 2HG LYS 7 -2.705 -0.879 -3.353
57 HG3 LYS 7 1HG LYS 7 -3.859 -1.630 -4.456
58 HD2 LYS 7 2HD LYS 7 -3.497 -0.034 -6.114
59 HD3 LYS 7 1HD LYS 7 -2.804 1.127 -4.986
60 HE2 LYS 7 2HE LYS 7 -1.083 0.147 -6.413
61 HE3 LYS 7 1HE LYS 7 -0.832 -0.275 -4.727
62 HZ1 LYS 7 1HZ LYS 7 -0.446 -2.189 -6.011
63 HZ2 LYS 7 2HZ LYS 7 -1.863 -1.993 -6.899
64 HZ3 LYS 7 3HZ LYS 7 -1.952 -2.463 -5.287
65 H CYS 8 H CYS 8 -3.693 0.216 -0.467
66 HA CYS 8 HA CYS 8 -1.822 -1.812 -0.241
67 HB2 CYS 8 2HB CYS 8 -2.843 -0.133 2.063
68 HB3 CYS 8 1HB CYS 8 -1.272 -0.914 1.952
69 H LYS 9 H LYS 9 -4.784 -1.378 1.704
70 HA LYS 9 HA LYS 9 -4.333 -3.847 3.089
71 HB2 LYS 9 2HB LYS 9 -5.488 -1.784 4.060
72 HB3 LYS 9 1HB LYS 9 -6.897 -2.257 3.125
73 HG2 LYS 9 2HG LYS 9 -7.204 -3.075 5.349
74 HG3 LYS 9 1HG LYS 9 -6.849 -4.464 4.318
75 HD2 LYS 9 2HD LYS 9 -4.489 -4.373 5.050
76 HD3 LYS 9 1HD LYS 9 -4.887 -3.025 6.112
77 HE2 LYS 9 2HE LYS 9 -4.842 -4.989 7.444
78 HE3 LYS 9 1HE LYS 9 -6.535 -4.548 7.244
79 HZ1 LYS 9 1HZ LYS 9 -5.068 -6.656 5.762
80 HZ2 LYS 9 2HZ LYS 9 -6.693 -6.266 5.484
81 HZ3 LYS 9 3HZ LYS 9 -6.212 -6.914 6.954
82 H GLU 10 H GLU 10 -5.852 -2.978 0.159
83 HA GLU 10 HA GLU 10 -7.591 -5.252 0.007
84 HB2 GLU 10 2HB GLU 10 -7.905 -3.114 -1.262
85 HB3 GLU 10 1HB GLU 10 -6.489 -3.534 -2.206
86 HG2 GLU 10 2HG GLU 10 -7.594 -5.517 -3.021
87 HG3 GLU 10 1HG GLU 10 -9.016 -5.126 -2.051
88 H LEU 11 H LEU 11 -4.389 -4.380 -1.104
89 HA LEU 11 HA LEU 11 -3.835 -6.750 -2.542
90 HB2 LEU 11 2HB LEU 11 -2.706 -4.568 -2.856
91 HB3 LEU 11 1HB LEU 11 -1.982 -4.733 -1.274
92 HG LEU 11 HG LEU 11 -0.727 -6.673 -2.052
93 HD11 LEU 11 1HD1 LEU 11 -2.247 -7.471 -3.795
94 HD12 LEU 11 2HD1 LEU 11 -0.641 -7.179 -4.459
95 HD13 LEU 11 3HD1 LEU 11 -1.936 -6.016 -4.742
96 HD21 LEU 11 1HD2 LEU 11 0.263 -4.474 -2.157
97 HD22 LEU 11 2HD2 LEU 11 -0.429 -4.222 -3.761
98 HD23 LEU 11 3HD2 LEU 11 0.796 -5.467 -3.511
99 H DAS 12 H DAS 12 -3.356 -5.671 0.742
100 HA DAS 12 HA DAS 12 -2.960 -8.464 1.522
101 HB2 DAS 12 1HB DAS 12 -4.973 -7.553 2.432
102 HB3 DAS 12 2HB DAS 12 -4.122 -6.143 3.039
103 H THR 13 H THR 13 -0.994 -8.985 2.113
104 HA THR 13 HA THR 13 0.709 -6.907 3.271
105 HB THR 13 HB THR 13 2.013 -8.941 4.148
106 HG1 THR 13 1HG THR 13 1.287 -10.777 3.525
107 HG21 THR 13 1HG2 THR 13 0.499 -9.242 6.068
108 HG22 THR 13 2HG2 THR 13 -0.814 -8.505 5.149
109 HG23 THR 13 3HG2 THR 13 0.589 -7.542 5.605
110 H ARG 14 H ARG 14 0.073 -8.409 0.497
111 HA ARG 14 HA ARG 14 2.535 -9.374 -0.468
112 HB2 ARG 14 2HB ARG 14 0.062 -8.397 -1.867
113 HB3 ARG 14 1HB ARG 14 1.470 -8.959 -2.755
114 HG2 ARG 14 2HG ARG 14 1.243 -11.140 -1.814
115 HG3 ARG 14 1HG ARG 14 -0.046 -10.599 -0.741
116 HD2 ARG 14 2HD ARG 14 -0.939 -11.778 -2.696
117 HD3 ARG 14 1HD ARG 14 -1.451 -10.091 -2.673
118 HE ARG 14 HE ARG 14 0.913 -10.767 -4.222
119 HH11 ARG 14 1HH1 ARG 14 -2.527 -9.964 -4.272
120 HH12 ARG 14 2HH1 ARG 14 -2.566 -9.572 -5.924
121 HH21 ARG 14 1HH2 ARG 14 0.860 -10.266 -6.487
122 HH22 ARG 14 2HH2 ARG 14 -0.575 -9.781 -7.243
123 HA DPR 15 HA DPR 15 4.199 -5.848 -2.887
124 HB2 DPR 15 1HB DPR 15 6.702 -7.186 -2.001
125 HB3 DPR 15 2HB DPR 15 6.236 -6.639 -3.614
126 HG2 DPR 15 1HG DPR 15 6.231 -9.230 -3.028
127 HG3 DPR 15 2HG DPR 15 4.933 -8.528 -4.009
128 HD2 DPR 15 1HD DPR 15 4.921 -9.249 -1.094
129 HD3 DPR 15 2HD DPR 15 3.687 -9.549 -2.335
130 H DGL 16 H DGL 16 4.763 -6.976 0.354
131 HA DGL 16 HA DGL 16 6.398 -4.880 1.298
132 HB2 DGL 16 1HB DGL 16 5.749 -7.133 2.441
133 HB3 DGL 16 2HB DGL 16 4.307 -6.294 2.968
134 HG2 DGL 16 1HG DGL 16 7.129 -5.517 3.691
135 HG3 DGL 16 2HG DGL 16 6.016 -6.394 4.723
136 H DAL 17 H DAL 17 2.914 -5.401 1.297
137 HA DAL 17 HA DAL 17 2.144 -2.917 2.388
138 HB1 DAL 17 1HB DAL 17 0.642 -4.845 2.290
139 HB2 DAL 17 2HB DAL 17 0.605 -4.720 0.533
140 HB3 DAL 17 3HB DAL 17 -0.075 -3.429 1.522
141 H DGL 18 H DGL 18 2.508 -4.064 -0.907
142 HA DGL 18 HA DGL 18 1.611 -1.899 -2.382
143 HB2 DGL 18 1HB DGL 18 2.375 -4.090 -3.300
144 HB3 DGL 18 2HB DGL 18 4.031 -3.616 -2.978
145 HG2 DGL 18 1HG DGL 18 3.551 -3.330 -5.304
146 HG3 DGL 18 2HG DGL 18 3.804 -1.758 -4.553
147 H DAR 19 H DAR 19 4.887 -2.496 -1.223
148 HA DAR 19 HA DAR 19 5.902 0.012 -2.107
149 HB2 DAR 19 1HB DAR 19 7.024 -1.910 -0.068
150 HB3 DAR 19 2HB DAR 19 7.899 -0.556 -0.771
151 HG2 DAR 19 1HG DAR 19 6.849 -2.950 -2.269
152 HG3 DAR 19 2HG DAR 19 8.529 -2.662 -1.818
153 HD2 DAR 19 1HD DAR 19 6.884 -0.918 -3.651
154 HD3 DAR 19 2HD DAR 19 8.110 -2.080 -4.150
155 HE DAR 19 HE DAR 19 9.566 -0.621 -2.577
156 HH11 DAR 19 1HH2 DAR 19 10.688 1.388 -3.053
157 HH12 DAR 19 2HH2 DAR 19 9.979 2.480 -4.160
158 HH21 DAR 19 1HH1 DAR 19 7.093 0.579 -4.824
159 HH22 DAR 19 2HH1 DAR 19 7.933 2.008 -5.177
160 H DLY 20 H DLY 20 4.515 -1.141 0.885
161 HA DLY 20 HA DLY 20 5.304 1.076 2.420
162 HB2 DLY 20 1HB DLY 20 4.783 -1.089 3.418
163 HB3 DLY 20 2HB DLY 20 3.101 -0.905 2.953
164 HG2 DLY 20 1HG DLY 20 2.720 0.776 4.514
165 HG3 DLY 20 2HG DLY 20 4.443 1.088 4.734
166 HD2 DLY 20 1HD DLY 20 4.709 -1.113 5.744
167 HD3 DLY 20 2HD DLY 20 2.989 -1.421 5.524
168 HE2 DLY 20 1HE DLY 20 3.650 -0.696 7.831
169 HE3 DLY 20 2HE DLY 20 2.399 0.290 7.077
170 HZ1 DLY 20 1HZ DLY 20 4.352 1.439 8.256
171 HZ2 DLY 20 2HZ DLY 20 3.715 2.013 6.836
172 HZ3 DLY 20 3HZ DLY 20 5.187 1.192 6.783
173 H DCY 21 H DCY 21 2.618 0.520 0.305
174 HA DCY 21 HA DCY 21 0.946 2.619 0.977
175 HB2 DCY 21 1HB DCY 21 1.754 1.583 -1.737
176 HB3 DCY 21 2HB DCY 21 0.410 2.690 -1.500
177 H DAR 22 H DAR 22 3.724 2.643 -1.251
178 HA DAR 22 HA DAR 22 3.687 5.501 -1.546
179 HB2 DAR 22 1HB DAR 22 5.555 3.349 -2.502
180 HB3 DAR 22 2HB DAR 22 5.929 5.051 -2.724
181 HG2 DAR 22 1HG DAR 22 3.414 3.750 -3.731
182 HG3 DAR 22 2HG DAR 22 4.879 3.948 -4.698
183 HD2 DAR 22 1HD DAR 22 3.284 6.183 -3.425
184 HD3 DAR 22 2HD DAR 22 3.262 5.740 -5.131
185 HE DAR 22 HE DAR 22 5.800 6.192 -4.893
186 HH11 DAR 22 1HH1 DAR 22 3.208 8.101 -3.402
187 HH12 DAR 22 2HH1 DAR 22 4.043 9.573 -3.453
188 HH21 DAR 22 1HH2 DAR 22 6.988 8.288 -4.950
189 HH22 DAR 22 2HH2 DAR 22 6.231 9.655 -4.295
190 H DGL 23 H DGL 23 5.119 3.336 0.625
191 HA DGL 23 HA DGL 23 7.313 4.789 1.573
192 HB2 DGL 23 1HB DGL 23 6.821 2.460 2.160
193 HB3 DGL 23 2HB DGL 23 5.399 2.986 3.051
194 HG2 DGL 23 1HG DGL 23 6.836 4.189 4.620
195 HG3 DGL 23 2HG DGL 23 8.250 3.560 3.775
196 H DGL 24 H DGL 24 3.917 4.785 2.641
197 HA DGL 24 HA DGL 24 4.559 7.067 4.348
198 HB2 DGL 24 1HB DGL 24 2.207 5.205 4.438
199 HB3 DGL 24 2HB DGL 24 2.455 6.575 5.515
200 HG2 DGL 24 1HG DGL 24 4.499 5.585 6.332
201 HG3 DGL 24 2HG DGL 24 4.293 4.224 5.235
202 H SER 25 H SER 25 2.741 6.324 1.473
203 HA SER 25 HA SER 25 2.162 9.055 1.169
204 HB2 SER 25 2HB SER 25 1.125 6.671 -0.376
205 HB3 SER 25 1HB SER 25 1.032 8.356 -0.905
206 HG SER 25 HG SER 25 3.393 8.338 -0.676
207 H ASP 26 H ASP 26 0.389 10.165 1.570
208 HA ASP 26 HA ASP 26 -1.511 9.014 3.438
209 HB2 ASP 26 2HB ASP 26 -2.224 11.315 3.857
210 HB3 ASP 26 1HB ASP 26 -0.477 11.162 3.978
Start of MODEL 3
1 H ASN 1 H ASN 1 -1.756 8.825 1.027
2 HA ASN 1 HA ASN 1 -4.166 10.013 0.141
3 HB2 ASN 1 2HB ASN 1 -2.215 8.229 -1.302
4 HB3 ASN 1 1HB ASN 1 -3.512 9.121 -2.088
5 HD21 ASN 1 1HD2 ASN 1 -3.094 11.506 -0.363
6 HD22 ASN 1 2HD2 ASN 1 -1.643 12.220 -0.938
7 HA PRO 2 HA PRO 2 -7.119 6.839 1.095
8 HB2 PRO 2 2HB PRO 2 -8.212 7.902 -1.469
9 HB3 PRO 2 1HB PRO 2 -9.059 7.540 0.041
10 HG2 PRO 2 2HG PRO 2 -8.442 10.034 -0.566
11 HG3 PRO 2 1HG PRO 2 -8.258 9.440 1.094
12 HD2 PRO 2 2HD PRO 2 -6.186 10.059 -0.935
13 HD3 PRO 2 1HD PRO 2 -6.112 10.145 0.833
14 H GLU 3 H GLU 3 -6.327 7.172 -2.387
15 HA GLU 3 HA GLU 3 -7.118 4.584 -3.094
16 HB2 GLU 3 2HB GLU 3 -5.134 6.416 -4.438
17 HB3 GLU 3 1HB GLU 3 -5.712 4.914 -5.141
18 HG2 GLU 3 2HG GLU 3 -7.403 7.304 -4.435
19 HG3 GLU 3 1HG GLU 3 -6.915 6.815 -6.056
20 H LEU 4 H LEU 4 -4.009 5.783 -2.015
21 HA LEU 4 HA LEU 4 -2.633 3.358 -2.522
22 HB2 LEU 4 2HB LEU 4 -1.994 5.803 -0.905
23 HB3 LEU 4 1HB LEU 4 -0.979 4.390 -0.793
24 HG LEU 4 HG LEU 4 0.012 6.000 -2.287
25 HD11 LEU 4 1HD1 LEU 4 -1.049 3.656 -3.834
26 HD12 LEU 4 2HD1 LEU 4 0.376 3.677 -2.796
27 HD13 LEU 4 3HD1 LEU 4 0.342 4.650 -4.263
28 HD21 LEU 4 1HD2 LEU 4 -2.506 5.800 -3.944
29 HD22 LEU 4 2HD2 LEU 4 -1.034 6.648 -4.413
30 HD23 LEU 4 3HD2 LEU 4 -1.974 7.216 -3.036
31 H GLN 5 H GLN 5 -3.939 4.822 0.416
32 HA GLN 5 HA GLN 5 -3.218 2.648 2.056
33 HB2 GLN 5 2HB GLN 5 -5.150 4.905 2.488
34 HB3 GLN 5 1HB GLN 5 -4.860 3.670 3.709
35 HG2 GLN 5 2HG GLN 5 -2.773 5.483 2.512
36 HG3 GLN 5 1HG GLN 5 -3.496 5.649 4.113
37 HE21 GLN 5 1HE2 GLN 5 -0.707 5.191 3.292
38 HE22 GLN 5 2HE2 GLN 5 -0.212 3.743 4.129
39 H ARG 6 H ARG 6 -6.067 3.213 0.163
40 HA ARG 6 HA ARG 6 -7.486 1.016 1.259
41 HB2 ARG 6 2HB ARG 6 -7.842 2.787 -1.084
42 HB3 ARG 6 1HB ARG 6 -8.637 1.221 -1.137
43 HG2 ARG 6 2HG ARG 6 -8.956 3.211 1.098
44 HG3 ARG 6 1HG ARG 6 -10.074 3.048 -0.258
45 HD2 ARG 6 2HD ARG 6 -9.425 0.958 1.836
46 HD3 ARG 6 1HD ARG 6 -10.957 1.788 1.591
47 HE ARG 6 HE ARG 6 -10.598 0.633 -0.788
48 HH11 ARG 6 1HH1 ARG 6 -10.543 -0.742 2.485
49 HH12 ARG 6 2HH1 ARG 6 -10.883 -2.324 1.969
50 HH21 ARG 6 1HH2 ARG 6 -11.059 -1.507 -1.476
51 HH22 ARG 6 2HH2 ARG 6 -11.207 -2.780 -0.350
52 H LYS 7 H LYS 7 -5.218 1.357 -1.403
53 HA LYS 7 HA LYS 7 -5.710 -1.334 -2.122
54 HB2 LYS 7 2HB LYS 7 -3.621 0.579 -3.132
55 HB3 LYS 7 1HB LYS 7 -3.838 -1.064 -3.750
56 HG2 LYS 7 2HG LYS 7 -6.203 -0.527 -4.197
57 HG3 LYS 7 1HG LYS 7 -5.872 1.135 -3.744
58 HD2 LYS 7 2HD LYS 7 -4.309 1.323 -5.585
59 HD3 LYS 7 1HD LYS 7 -4.607 -0.369 -6.022
60 HE2 LYS 7 2HE LYS 7 -6.627 1.865 -5.987
61 HE3 LYS 7 1HE LYS 7 -5.946 1.085 -7.411
62 HZ1 LYS 7 1HZ LYS 7 -8.164 0.219 -6.852
63 HZ2 LYS 7 2HZ LYS 7 -7.606 -0.335 -5.360
64 HZ3 LYS 7 3HZ LYS 7 -6.994 -0.979 -6.775
65 H CYS 8 H CYS 8 -3.652 0.193 0.100
66 HA CYS 8 HA CYS 8 -1.929 -1.953 0.622
67 HB2 CYS 8 2HB CYS 8 -3.221 -0.066 2.613
68 HB3 CYS 8 1HB CYS 8 -1.868 -1.129 2.963
69 H LYS 9 H LYS 9 -5.287 -1.375 1.374
70 HA LYS 9 HA LYS 9 -5.571 -3.656 3.105
71 HB2 LYS 9 2HB LYS 9 -7.676 -1.978 1.719
72 HB3 LYS 9 1HB LYS 9 -7.991 -3.181 2.952
73 HG2 LYS 9 2HG LYS 9 -6.391 -0.658 3.357
74 HG3 LYS 9 1HG LYS 9 -8.082 -0.867 3.799
75 HD2 LYS 9 2HD LYS 9 -5.777 -2.482 4.914
76 HD3 LYS 9 1HD LYS 9 -6.529 -1.113 5.719
77 HE2 LYS 9 2HE LYS 9 -7.891 -3.722 5.001
78 HE3 LYS 9 1HE LYS 9 -7.373 -3.228 6.605
79 HZ1 LYS 9 1HZ LYS 9 -9.486 -1.900 4.975
80 HZ2 LYS 9 2HZ LYS 9 -8.956 -1.376 6.492
81 HZ3 LYS 9 3HZ LYS 9 -9.717 -2.860 6.333
82 H GLU 10 H GLU 10 -6.166 -2.880 -0.273
83 HA GLU 10 HA GLU 10 -7.448 -5.312 -0.938
84 HB2 GLU 10 2HB GLU 10 -5.927 -3.391 -2.716
85 HB3 GLU 10 1HB GLU 10 -6.882 -4.736 -3.310
86 HG2 GLU 10 2HG GLU 10 -8.882 -3.718 -2.221
87 HG3 GLU 10 1HG GLU 10 -7.887 -2.323 -1.812
88 H LEU 11 H LEU 11 -4.070 -4.310 -1.081
89 HA LEU 11 HA LEU 11 -3.222 -6.868 -2.086
90 HB2 LEU 11 2HB LEU 11 -1.741 -4.459 -1.123
91 HB3 LEU 11 1HB LEU 11 -0.923 -5.903 -1.711
92 HG LEU 11 HG LEU 11 -2.746 -4.088 -3.303
93 HD11 LEU 11 1HD1 LEU 11 0.235 -4.511 -3.432
94 HD12 LEU 11 2HD1 LEU 11 -0.587 -3.076 -2.822
95 HD13 LEU 11 3HD1 LEU 11 -0.712 -3.505 -4.527
96 HD21 LEU 11 1HD2 LEU 11 -1.193 -6.540 -4.143
97 HD22 LEU 11 2HD2 LEU 11 -2.024 -5.439 -5.237
98 HD23 LEU 11 3HD2 LEU 11 -2.951 -6.386 -4.080
99 H DAS 12 H DAS 12 -3.365 -5.298 1.063
100 HA DAS 12 HA DAS 12 -2.890 -7.893 2.195
101 HB2 DAS 12 1HB DAS 12 -4.770 -6.622 3.098
102 HB3 DAS 12 2HB DAS 12 -3.687 -5.306 3.536
103 H THR 13 H THR 13 -1.068 -8.503 3.149
104 HA THR 13 HA THR 13 0.945 -6.469 3.654
105 HB THR 13 HB THR 13 2.022 -8.472 4.903
106 HG1 THR 13 1HG THR 13 -0.110 -9.709 5.613
107 HG21 THR 13 1HG2 THR 13 0.980 -6.553 6.047
108 HG22 THR 13 2HG2 THR 13 0.637 -8.058 6.899
109 HG23 THR 13 3HG2 THR 13 -0.598 -7.320 5.878
110 H ARG 14 H ARG 14 -0.054 -8.323 1.273
111 HA ARG 14 HA ARG 14 2.327 -9.727 0.487
112 HB2 ARG 14 2HB ARG 14 -0.305 -9.247 -0.912
113 HB3 ARG 14 1HB ARG 14 0.979 -10.271 -1.535
114 HG2 ARG 14 2HG ARG 14 0.740 -11.787 0.313
115 HG3 ARG 14 1HG ARG 14 -0.428 -10.714 1.091
116 HD2 ARG 14 2HD ARG 14 -0.807 -12.042 -1.592
117 HD3 ARG 14 1HD ARG 14 -1.494 -12.612 -0.075
118 HE ARG 14 HE ARG 14 -2.655 -10.424 0.039
119 HH11 ARG 14 1HH1 ARG 14 -1.649 -11.599 -3.144
120 HH12 ARG 14 2HH1 ARG 14 -2.915 -10.837 -3.972
121 HH21 ARG 14 1HH2 ARG 14 -4.372 -9.400 -1.074
122 HH22 ARG 14 2HH2 ARG 14 -4.525 -9.567 -2.771
123 HA DPR 15 HA DPR 15 3.234 -7.011 -3.126
124 HB2 DPR 15 1HB DPR 15 5.988 -7.892 -2.659
125 HB3 DPR 15 2HB DPR 15 5.000 -8.061 -4.109
126 HG2 DPR 15 1HG DPR 15 5.667 -10.165 -2.548
127 HG3 DPR 15 2HG DPR 15 4.141 -10.092 -3.442
128 HD2 DPR 15 1HD DPR 15 4.660 -9.605 -0.546
129 HD3 DPR 15 2HD DPR 15 3.290 -10.416 -1.333
130 H DGL 16 H DGL 16 4.565 -7.254 0.025
131 HA DGL 16 HA DGL 16 6.279 -5.012 0.026
132 HB2 DGL 16 1HB DGL 16 6.353 -6.809 1.719
133 HB3 DGL 16 2HB DGL 16 4.803 -6.277 2.341
134 HG2 DGL 16 1HG DGL 16 5.764 -4.167 3.028
135 HG3 DGL 16 2HG DGL 16 7.318 -4.629 2.334
136 H DAL 17 H DAL 17 2.857 -5.371 0.299
137 HA DAL 17 HA DAL 17 2.176 -3.015 1.621
138 HB1 DAL 17 1HB DAL 17 0.618 -4.455 -0.511
139 HB2 DAL 17 2HB DAL 17 -0.026 -3.281 0.636
140 HB3 DAL 17 3HB DAL 17 0.593 -4.830 1.212
141 H DGL 18 H DGL 18 2.852 -3.653 -1.777
142 HA DGL 18 HA DGL 18 1.928 -1.272 -2.899
143 HB2 DGL 18 1HB DGL 18 2.661 -3.201 -4.226
144 HB3 DGL 18 2HB DGL 18 4.321 -2.915 -3.732
145 HG2 DGL 18 1HG DGL 18 4.084 -2.037 -5.933
146 HG3 DGL 18 2HG DGL 18 4.167 -0.686 -4.785
147 H DAR 19 H DAR 19 5.108 -2.033 -1.577
148 HA DAR 19 HA DAR 19 6.281 0.507 -2.072
149 HB2 DAR 19 1HB DAR 19 7.670 -1.446 -1.662
150 HB3 DAR 19 2HB DAR 19 6.994 -1.639 -0.054
151 HG2 DAR 19 1HG DAR 19 9.190 -0.701 0.129
152 HG3 DAR 19 2HG DAR 19 8.012 0.527 0.588
153 HD2 DAR 19 1HD DAR 19 8.210 1.586 -1.573
154 HD3 DAR 19 2HD DAR 19 9.313 0.320 -2.114
155 HE DAR 19 HE DAR 19 10.008 1.953 0.218
156 HH11 DAR 19 1HH2 DAR 19 12.158 2.929 0.137
157 HH12 DAR 19 2HH2 DAR 19 13.071 2.867 -1.295
158 HH21 DAR 19 1HH1 DAR 19 10.647 1.047 -3.152
159 HH22 DAR 19 2HH1 DAR 19 12.201 1.745 -3.190
160 H DLY 20 H DLY 20 4.860 -1.028 0.738
161 HA DLY 20 HA DLY 20 5.184 0.956 2.624
162 HB2 DLY 20 1HB DLY 20 4.491 -1.300 3.163
163 HB3 DLY 20 2HB DLY 20 2.978 -1.073 2.305
164 HG2 DLY 20 1HG DLY 20 2.262 0.568 3.935
165 HG3 DLY 20 2HG DLY 20 3.794 0.395 4.796
166 HD2 DLY 20 1HD DLY 20 3.315 -1.936 5.230
167 HD3 DLY 20 2HD DLY 20 1.815 -1.824 4.311
168 HE2 DLY 20 1HE DLY 20 2.429 -0.243 6.795
169 HE3 DLY 20 2HE DLY 20 1.480 -1.722 6.758
170 HZ1 DLY 20 1HZ DLY 20 -0.105 -0.563 5.255
171 HZ2 DLY 20 2HZ DLY 20 0.766 0.867 5.441
172 HZ3 DLY 20 3HZ DLY 20 0.023 0.152 6.750
173 H DCY 21 H DCY 21 2.424 0.445 0.435
174 HA DCY 21 HA DCY 21 0.765 2.470 1.344
175 HB2 DCY 21 1HB DCY 21 1.155 1.321 -1.409
176 HB3 DCY 21 2HB DCY 21 -0.199 2.375 -0.994
177 H DAR 22 H DAR 22 3.190 2.545 -1.214
178 HA DAR 22 HA DAR 22 2.731 5.228 -1.947
179 HB2 DAR 22 1HB DAR 22 5.156 3.494 -2.436
180 HB3 DAR 22 2HB DAR 22 4.807 5.010 -3.252
181 HG2 DAR 22 1HG DAR 22 2.778 4.018 -4.208
182 HG3 DAR 22 2HG DAR 22 3.161 2.497 -3.406
183 HD2 DAR 22 1HD DAR 22 5.263 2.365 -4.658
184 HD3 DAR 22 2HD DAR 22 4.853 3.882 -5.466
185 HE DAR 22 HE DAR 22 3.049 1.590 -5.660
186 HH11 DAR 22 1HH1 DAR 22 5.373 3.734 -7.298
187 HH12 DAR 22 2HH1 DAR 22 4.779 3.387 -8.858
188 HH21 DAR 22 1HH2 DAR 22 2.267 1.145 -7.790
189 HH22 DAR 22 2HH2 DAR 22 2.982 1.880 -9.155
190 H DGL 23 H DGL 23 5.045 3.625 0.127
191 HA DGL 23 HA DGL 23 6.714 5.826 0.622
192 HB2 DGL 23 1HB DGL 23 7.335 3.443 0.771
193 HB3 DGL 23 2HB DGL 23 6.316 3.278 2.182
194 HG2 DGL 23 1HG DGL 23 7.737 4.533 3.522
195 HG3 DGL 23 2HG DGL 23 8.615 5.184 2.136
196 H DGL 24 H DGL 24 4.014 4.407 2.485
197 HA DGL 24 HA DGL 24 4.220 6.224 4.640
198 HB2 DGL 24 1HB DGL 24 1.770 4.776 3.627
199 HB3 DGL 24 2HB DGL 24 1.857 5.653 5.140
200 HG2 DGL 24 1HG DGL 24 3.580 4.105 5.922
201 HG3 DGL 24 2HG DGL 24 3.381 3.173 4.434
202 H SER 25 H SER 25 2.044 6.170 1.839
203 HA SER 25 HA SER 25 1.753 9.030 2.266
204 HB2 SER 25 2HB SER 25 0.645 9.046 -0.012
205 HB3 SER 25 1HB SER 25 2.339 8.578 -0.029
206 HG SER 25 HG SER 25 1.167 6.308 0.154
207 H ASP 26 H ASP 26 -0.214 9.957 2.664
208 HA ASP 26 HA ASP 26 -2.081 8.121 3.943
209 HB2 ASP 26 2HB ASP 26 -1.840 11.132 4.019
210 HB3 ASP 26 1HB ASP 26 -3.159 10.256 4.782
Start of MODEL 4
1 H ASN 1 H ASN 1 -1.700 8.909 0.292
2 HA ASN 1 HA ASN 1 -4.247 9.934 -0.644
3 HB2 ASN 1 2HB ASN 1 -2.258 9.820 -2.160
4 HB3 ASN 1 1HB ASN 1 -2.252 8.073 -1.969
5 HD21 ASN 1 1HD2 ASN 1 -2.471 9.623 -4.392
6 HD22 ASN 1 2HD2 ASN 1 -3.954 9.159 -5.141
7 HA PRO 2 HA PRO 2 -6.348 6.476 1.318
8 HB2 PRO 2 2HB PRO 2 -8.414 7.217 -0.685
9 HB3 PRO 2 1HB PRO 2 -8.560 6.969 1.061
10 HG2 PRO 2 2HG PRO 2 -8.567 9.418 0.043
11 HG3 PRO 2 1HG PRO 2 -7.733 9.061 1.566
12 HD2 PRO 2 2HD PRO 2 -6.594 9.526 -1.152
13 HD3 PRO 2 1HD PRO 2 -5.960 9.980 0.444
14 H GLU 3 H GLU 3 -6.385 6.862 -2.213
15 HA GLU 3 HA GLU 3 -7.195 4.258 -2.875
16 HB2 GLU 3 2HB GLU 3 -7.242 6.050 -4.505
17 HB3 GLU 3 1HB GLU 3 -5.501 6.246 -4.399
18 HG2 GLU 3 2HG GLU 3 -6.170 5.122 -6.455
19 HG3 GLU 3 1HG GLU 3 -5.182 4.076 -5.438
20 H LEU 4 H LEU 4 -4.002 5.655 -2.399
21 HA LEU 4 HA LEU 4 -2.583 3.310 -3.123
22 HB2 LEU 4 2HB LEU 4 -1.744 5.721 -1.532
23 HB3 LEU 4 1HB LEU 4 -0.641 4.501 -2.118
24 HG LEU 4 HG LEU 4 -2.300 6.376 -3.811
25 HD11 LEU 4 1HD1 LEU 4 -0.157 7.326 -4.466
26 HD12 LEU 4 2HD1 LEU 4 0.672 6.250 -3.343
27 HD13 LEU 4 3HD1 LEU 4 -0.424 7.480 -2.733
28 HD21 LEU 4 1HD2 LEU 4 -1.045 5.452 -5.713
29 HD22 LEU 4 2HD2 LEU 4 -2.073 4.247 -4.945
30 HD23 LEU 4 3HD2 LEU 4 -0.332 4.243 -4.645
31 H GLN 5 H GLN 5 -3.632 4.697 -0.080
32 HA GLN 5 HA GLN 5 -2.281 2.829 1.596
33 HB2 GLN 5 2HB GLN 5 -4.673 4.552 2.191
34 HB3 GLN 5 1HB GLN 5 -3.666 3.752 3.386
35 HG2 GLN 5 2HG GLN 5 -1.763 5.114 2.706
36 HG3 GLN 5 1HG GLN 5 -2.760 5.896 1.476
37 HE21 GLN 5 1HE2 GLN 5 -2.005 5.672 4.796
38 HE22 GLN 5 2HE2 GLN 5 -3.016 6.974 5.332
39 H ARG 6 H ARG 6 -5.708 3.100 0.617
40 HA ARG 6 HA ARG 6 -6.556 0.797 2.039
41 HB2 ARG 6 2HB ARG 6 -7.820 2.372 -0.173
42 HB3 ARG 6 1HB ARG 6 -8.587 0.963 0.533
43 HG2 ARG 6 2HG ARG 6 -8.582 2.089 2.722
44 HG3 ARG 6 1HG ARG 6 -7.861 3.515 1.963
45 HD2 ARG 6 2HD ARG 6 -10.352 3.647 2.213
46 HD3 ARG 6 1HD ARG 6 -9.775 3.811 0.553
47 HE ARG 6 HE ARG 6 -10.364 1.122 1.230
48 HH11 ARG 6 1HH1 ARG 6 -12.069 4.109 0.397
49 HH12 ARG 6 2HH1 ARG 6 -13.261 3.337 -0.534
50 HH21 ARG 6 1HH2 ARG 6 -11.953 0.062 -0.103
51 HH22 ARG 6 2HH2 ARG 6 -13.196 0.977 -0.832
52 H LYS 7 H LYS 7 -5.185 1.269 -1.075
53 HA LYS 7 HA LYS 7 -6.033 -0.925 -2.501
54 HB2 LYS 7 2HB LYS 7 -4.614 0.907 -3.332
55 HB3 LYS 7 1HB LYS 7 -3.257 0.244 -2.438
56 HG2 LYS 7 2HG LYS 7 -3.364 -1.786 -3.793
57 HG3 LYS 7 1HG LYS 7 -4.720 -1.112 -4.693
58 HD2 LYS 7 2HD LYS 7 -1.940 0.048 -4.542
59 HD3 LYS 7 1HD LYS 7 -2.614 -0.827 -5.910
60 HE2 LYS 7 2HE LYS 7 -3.595 1.831 -4.825
61 HE3 LYS 7 1HE LYS 7 -2.667 1.584 -6.291
62 HZ1 LYS 7 1HZ LYS 7 -4.564 0.280 -7.184
63 HZ2 LYS 7 2HZ LYS 7 -4.924 1.878 -6.831
64 HZ3 LYS 7 3HZ LYS 7 -5.471 0.693 -5.809
65 H CYS 8 H CYS 8 -3.219 -0.681 -0.346
66 HA CYS 8 HA CYS 8 -2.370 -3.347 -0.576
67 HB2 CYS 8 2HB CYS 8 -2.085 -1.641 1.863
68 HB3 CYS 8 1HB CYS 8 -1.019 -2.918 1.284
69 H LYS 9 H LYS 9 -4.576 -1.731 1.611
70 HA LYS 9 HA LYS 9 -4.846 -3.812 3.464
71 HB2 LYS 9 2HB LYS 9 -6.694 -1.528 2.785
72 HB3 LYS 9 1HB LYS 9 -6.888 -2.585 4.178
73 HG2 LYS 9 2HG LYS 9 -4.760 -1.852 5.076
74 HG3 LYS 9 1HG LYS 9 -4.483 -0.856 3.650
75 HD2 LYS 9 2HD LYS 9 -6.362 0.551 4.200
76 HD3 LYS 9 1HD LYS 9 -6.809 -0.518 5.529
77 HE2 LYS 9 2HE LYS 9 -4.207 1.002 5.371
78 HE3 LYS 9 1HE LYS 9 -5.631 1.557 6.247
79 HZ1 LYS 9 1HZ LYS 9 -4.135 -0.952 6.812
80 HZ2 LYS 9 2HZ LYS 9 -5.506 -0.452 7.603
81 HZ3 LYS 9 3HZ LYS 9 -4.099 0.449 7.748
82 H GLU 10 H GLU 10 -6.609 -3.052 0.527
83 HA GLU 10 HA GLU 10 -8.317 -5.346 0.950
84 HB2 GLU 10 2HB GLU 10 -8.262 -3.238 -1.198
85 HB3 GLU 10 1HB GLU 10 -9.361 -4.615 -1.236
86 HG2 GLU 10 2HG GLU 10 -10.312 -3.945 0.890
87 HG3 GLU 10 1HG GLU 10 -9.187 -2.600 0.981
88 H LEU 11 H LEU 11 -5.379 -4.699 -0.578
89 HA LEU 11 HA LEU 11 -5.518 -6.877 -2.447
90 HB2 LEU 11 2HB LEU 11 -4.157 -4.850 -2.882
91 HB3 LEU 11 1HB LEU 11 -3.172 -5.214 -1.493
92 HG LEU 11 HG LEU 11 -2.109 -5.656 -3.707
93 HD11 LEU 11 1HD1 LEU 11 -1.157 -7.850 -3.150
94 HD12 LEU 11 2HD1 LEU 11 -2.344 -8.003 -1.855
95 HD13 LEU 11 3HD1 LEU 11 -1.146 -6.710 -1.809
96 HD21 LEU 11 1HD2 LEU 11 -4.036 -6.490 -4.918
97 HD22 LEU 11 2HD2 LEU 11 -4.107 -7.906 -3.869
98 HD23 LEU 11 3HD2 LEU 11 -2.730 -7.675 -4.946
99 H DAS 12 H DAS 12 -3.670 -6.274 0.570
100 HA DAS 12 HA DAS 12 -3.051 -9.106 0.693
101 HB2 DAS 12 1HB DAS 12 -5.162 -8.867 1.937
102 HB3 DAS 12 2HB DAS 12 -4.434 -7.608 2.925
103 H THR 13 H THR 13 -1.147 -9.536 1.752
104 HA THR 13 HA THR 13 0.333 -7.219 2.753
105 HB THR 13 HB THR 13 1.593 -9.042 4.104
106 HG1 THR 13 1HG THR 13 -0.670 -10.541 4.265
107 HG21 THR 13 1HG2 THR 13 0.098 -7.396 5.143
108 HG22 THR 13 2HG2 THR 13 -0.081 -8.976 5.909
109 HG23 THR 13 3HG2 THR 13 -1.290 -8.412 4.759
110 H ARG 14 H ARG 14 0.271 -7.830 0.101
111 HA ARG 14 HA ARG 14 2.880 -9.078 -0.448
112 HB2 ARG 14 2HB ARG 14 0.476 -8.696 -2.246
113 HB3 ARG 14 1HB ARG 14 1.989 -9.397 -2.776
114 HG2 ARG 14 2HG ARG 14 0.231 -10.573 -0.622
115 HG3 ARG 14 1HG ARG 14 0.165 -11.042 -2.315
116 HD2 ARG 14 2HD ARG 14 1.471 -12.673 -1.111
117 HD3 ARG 14 1HD ARG 14 2.549 -11.757 -2.150
118 HE ARG 14 HE ARG 14 2.547 -10.589 0.411
119 HH11 ARG 14 1HH1 ARG 14 3.618 -13.621 -1.105
120 HH12 ARG 14 2HH1 ARG 14 4.902 -13.853 -0.024
121 HH21 ARG 14 1HH2 ARG 14 4.358 -10.906 1.861
122 HH22 ARG 14 2HH2 ARG 14 5.326 -12.282 1.690
123 HA DPR 15 HA DPR 15 3.536 -5.305 -3.122
124 HB2 DPR 15 1HB DPR 15 6.333 -6.124 -3.192
125 HB3 DPR 15 2HB DPR 15 5.217 -5.897 -4.540
126 HG2 DPR 15 1HG DPR 15 6.135 -8.332 -3.802
127 HG3 DPR 15 2HG DPR 15 4.527 -8.088 -4.506
128 HD2 DPR 15 1HD DPR 15 5.304 -8.439 -1.642
129 HD3 DPR 15 2HD DPR 15 3.960 -9.178 -2.531
130 H DGL 16 H DGL 16 5.118 -6.645 -0.374
131 HA DGL 16 HA DGL 16 6.790 -4.541 0.437
132 HB2 DGL 16 1HB DGL 16 6.629 -6.910 1.354
133 HB3 DGL 16 2HB DGL 16 5.212 -6.376 2.237
134 HG2 DGL 16 1HG DGL 16 7.137 -6.388 3.676
135 HG3 DGL 16 2HG DGL 16 6.566 -4.735 3.426
136 H DAL 17 H DAL 17 3.390 -5.270 1.018
137 HA DAL 17 HA DAL 17 2.881 -3.102 2.757
138 HB1 DAL 17 1HB DAL 17 1.446 -5.107 2.638
139 HB2 DAL 17 2HB DAL 17 0.925 -4.624 1.021
140 HB3 DAL 17 3HB DAL 17 0.535 -3.618 2.420
141 H DGL 18 H DGL 18 2.350 -3.645 -0.673
142 HA DGL 18 HA DGL 18 1.230 -1.312 -1.585
143 HB2 DGL 18 1HB DGL 18 1.648 -3.238 -2.989
144 HB3 DGL 18 2HB DGL 18 3.378 -3.070 -2.780
145 HG2 DGL 18 1HG DGL 18 2.807 -2.344 -4.972
146 HG3 DGL 18 2HG DGL 18 3.314 -0.967 -3.991
147 H DAR 19 H DAR 19 4.649 -2.021 -1.247
148 HA DAR 19 HA DAR 19 5.694 0.459 -1.996
149 HB2 DAR 19 1HB DAR 19 6.768 -1.737 -0.254
150 HB3 DAR 19 2HB DAR 19 7.712 -0.324 -0.695
151 HG2 DAR 19 1HG DAR 19 7.673 -0.916 -3.004
152 HG3 DAR 19 2HG DAR 19 6.460 -2.161 -2.709
153 HD2 DAR 19 1HD DAR 19 8.826 -2.985 -2.999
154 HD3 DAR 19 2HD DAR 19 7.983 -3.530 -1.551
155 HE DAR 19 HE DAR 19 9.666 -1.171 -1.328
156 HH11 DAR 19 1HH2 DAR 19 11.225 -1.256 0.393
157 HH12 DAR 19 2HH2 DAR 19 11.589 -2.739 1.169
158 HH21 DAR 19 1HH1 DAR 19 9.380 -4.658 -0.855
159 HH22 DAR 19 2HH1 DAR 19 10.441 -4.740 0.463
160 H DLY 20 H DLY 20 4.981 -0.850 1.227
161 HA DLY 20 HA DLY 20 5.906 1.377 2.661
162 HB2 DLY 20 1HB DLY 20 5.448 -0.989 3.500
163 HB3 DLY 20 2HB DLY 20 3.757 -0.552 3.569
164 HG2 DLY 20 1HG DLY 20 5.856 0.945 5.117
165 HG3 DLY 20 2HG DLY 20 5.042 -0.478 5.752
166 HD2 DLY 20 1HD DLY 20 2.877 0.649 5.524
167 HD3 DLY 20 2HD DLY 20 3.708 2.088 4.936
168 HE2 DLY 20 1HE DLY 20 4.870 2.350 7.024
169 HE3 DLY 20 2HE DLY 20 4.244 0.818 7.619
170 HZ1 DLY 20 1HZ DLY 20 3.058 2.836 8.479
171 HZ2 DLY 20 2HZ DLY 20 2.100 1.685 7.773
172 HZ3 DLY 20 3HZ DLY 20 2.432 3.074 6.924
173 H DCY 21 H DCY 21 2.721 0.628 1.302
174 HA DCY 21 HA DCY 21 1.271 2.760 2.434
175 HB2 DCY 21 1HB DCY 21 0.909 1.374 -0.205
176 HB3 DCY 21 2HB DCY 21 -0.267 2.475 0.504
177 H DAR 22 H DAR 22 3.031 2.525 -0.623
178 HA DAR 22 HA DAR 22 2.394 5.223 -1.273
179 HB2 DAR 22 1HB DAR 22 4.221 3.219 -2.557
180 HB3 DAR 22 2HB DAR 22 4.084 4.880 -3.124
181 HG2 DAR 22 1HG DAR 22 1.684 4.548 -3.495
182 HG3 DAR 22 2HG DAR 22 1.830 2.884 -2.935
183 HD2 DAR 22 1HD DAR 22 3.386 3.974 -5.261
184 HD3 DAR 22 2HD DAR 22 1.810 3.209 -5.426
185 HE DAR 22 HE DAR 22 2.715 1.220 -4.556
186 HH11 DAR 22 1HH1 DAR 22 5.101 3.643 -5.604
187 HH12 DAR 22 2HH1 DAR 22 6.357 2.519 -5.866
188 HH21 DAR 22 1HH2 DAR 22 4.495 -0.353 -5.018
189 HH22 DAR 22 2HH2 DAR 22 6.005 0.214 -5.554
190 H DGL 23 H DGL 23 4.843 3.710 0.532
191 HA DGL 23 HA DGL 23 6.733 5.823 0.446
192 HB2 DGL 23 1HB DGL 23 7.331 3.538 1.141
193 HB3 DGL 23 2HB DGL 23 6.280 3.690 2.540
194 HG2 DGL 23 1HG DGL 23 7.690 5.510 3.387
195 HG3 DGL 23 2HG DGL 23 8.769 5.290 2.010
196 H DGL 24 H DGL 24 4.167 4.896 2.750
197 HA DGL 24 HA DGL 24 4.608 7.175 4.395
198 HB2 DGL 24 1HB DGL 24 2.486 6.612 5.538
199 HB3 DGL 24 2HB DGL 24 3.544 5.223 5.400
200 HG2 DGL 24 1HG DGL 24 2.224 4.282 3.653
201 HG3 DGL 24 2HG DGL 24 1.232 5.732 3.548
202 H SER 25 H SER 25 2.295 6.464 1.839
203 HA SER 25 HA SER 25 2.018 9.244 1.251
204 HB2 SER 25 2HB SER 25 2.047 7.512 -0.527
205 HB3 SER 25 1HB SER 25 0.576 6.816 0.141
206 HG SER 25 HG SER 25 0.967 9.164 -1.299
207 H ASP 26 H ASP 26 -0.176 10.210 1.130
208 HA ASP 26 HA ASP 26 -1.908 9.217 3.287
209 HB2 ASP 26 2HB ASP 26 -1.386 12.099 2.479
210 HB3 ASP 26 1HB ASP 26 -2.611 11.603 3.639
Start of MODEL 5
1 H ASN 1 H ASN 1 -1.561 8.910 0.642
2 HA ASN 1 HA ASN 1 -4.145 9.736 0.019
3 HB2 ASN 1 2HB ASN 1 -2.466 7.682 -1.432
4 HB3 ASN 1 1HB ASN 1 -3.885 8.473 -2.102
5 HD21 ASN 1 1HD2 ASN 1 -1.163 8.501 -3.094
6 HD22 ASN 1 2HD2 ASN 1 -0.678 10.153 -3.084
7 HA PRO 2 HA PRO 2 -6.643 6.535 2.038
8 HB2 PRO 2 2HB PRO 2 -8.632 7.820 0.220
9 HB3 PRO 2 1HB PRO 2 -8.779 7.420 1.936
10 HG2 PRO 2 2HG PRO 2 -8.372 9.925 1.204
11 HG3 PRO 2 1HG PRO 2 -7.513 9.258 2.604
12 HD2 PRO 2 2HD PRO 2 -6.505 9.813 -0.149
13 HD3 PRO 2 1HD PRO 2 -5.689 9.991 1.416
14 H GLU 3 H GLU 3 -6.743 7.230 -1.412
15 HA GLU 3 HA GLU 3 -7.994 4.823 -2.203
16 HB2 GLU 3 2HB GLU 3 -7.950 6.859 -3.568
17 HB3 GLU 3 1HB GLU 3 -6.215 6.695 -3.745
18 HG2 GLU 3 2HG GLU 3 -6.466 4.724 -5.047
19 HG3 GLU 3 1HG GLU 3 -8.207 4.694 -4.745
20 H LEU 4 H LEU 4 -4.676 5.705 -1.629
21 HA LEU 4 HA LEU 4 -3.670 3.276 -2.798
22 HB2 LEU 4 2HB LEU 4 -2.382 5.403 -2.815
23 HB3 LEU 4 1HB LEU 4 -2.231 5.284 -1.073
24 HG LEU 4 HG LEU 4 -0.979 3.171 -1.357
25 HD11 LEU 4 1HD1 LEU 4 -0.093 2.596 -3.562
26 HD12 LEU 4 2HD1 LEU 4 -1.108 3.840 -4.290
27 HD13 LEU 4 3HD1 LEU 4 -1.848 2.449 -3.501
28 HD21 LEU 4 1HD2 LEU 4 0.161 5.269 -1.072
29 HD22 LEU 4 2HD2 LEU 4 0.119 5.553 -2.817
30 HD23 LEU 4 3HD2 LEU 4 1.061 4.210 -2.155
31 H GLN 5 H GLN 5 -4.452 4.518 0.371
32 HA GLN 5 HA GLN 5 -3.491 2.397 1.936
33 HB2 GLN 5 2HB GLN 5 -5.904 4.179 2.290
34 HB3 GLN 5 1HB GLN 5 -5.407 3.003 3.494
35 HG2 GLN 5 2HG GLN 5 -3.289 4.154 3.772
36 HG3 GLN 5 1HG GLN 5 -3.738 5.307 2.515
37 HE21 GLN 5 1HE2 GLN 5 -5.132 6.949 3.005
38 HE22 GLN 5 2HE2 GLN 5 -5.712 7.264 4.594
39 H ARG 6 H ARG 6 -6.540 2.873 0.293
40 HA ARG 6 HA ARG 6 -7.798 0.438 0.871
41 HB2 ARG 6 2HB ARG 6 -7.968 2.201 -1.550
42 HB3 ARG 6 1HB ARG 6 -9.007 0.813 -1.291
43 HG2 ARG 6 2HG ARG 6 -9.911 1.834 0.705
44 HG3 ARG 6 1HG ARG 6 -8.824 3.216 0.505
45 HD2 ARG 6 2HD ARG 6 -11.098 3.656 -0.356
46 HD3 ARG 6 1HD ARG 6 -9.849 3.765 -1.598
47 HE ARG 6 HE ARG 6 -11.074 1.185 -1.373
48 HH11 ARG 6 1HH1 ARG 6 -11.249 4.331 -2.975
49 HH12 ARG 6 2HH1 ARG 6 -12.182 3.764 -4.279
50 HH21 ARG 6 1HH2 ARG 6 -12.257 0.401 -3.137
51 HH22 ARG 6 2HH2 ARG 6 -12.774 1.425 -4.396
52 H LYS 7 H LYS 7 -5.592 1.339 -1.712
53 HA LYS 7 HA LYS 7 -5.617 -0.920 -3.314
54 HB2 LYS 7 2HB LYS 7 -4.440 1.160 -3.890
55 HB3 LYS 7 1HB LYS 7 -3.291 0.879 -2.600
56 HG2 LYS 7 2HG LYS 7 -2.270 0.352 -4.711
57 HG3 LYS 7 1HG LYS 7 -2.497 -1.137 -3.796
58 HD2 LYS 7 2HD LYS 7 -4.480 -1.656 -5.099
59 HD3 LYS 7 1HD LYS 7 -4.325 -0.132 -5.972
60 HE2 LYS 7 2HE LYS 7 -3.460 -1.972 -7.312
61 HE3 LYS 7 1HE LYS 7 -2.169 -0.863 -6.867
62 HZ1 LYS 7 1HZ LYS 7 -2.723 -3.415 -5.440
63 HZ2 LYS 7 2HZ LYS 7 -1.336 -2.406 -5.270
64 HZ3 LYS 7 3HZ LYS 7 -1.601 -3.225 -6.679
65 H CYS 8 H CYS 8 -3.436 -0.227 -0.586
66 HA CYS 8 HA CYS 8 -2.202 -2.765 -0.591
67 HB2 CYS 8 2HB CYS 8 -2.463 -0.794 1.659
68 HB3 CYS 8 1HB CYS 8 -1.315 -2.127 1.568
69 H LYS 9 H LYS 9 -4.999 -1.464 1.056
70 HA LYS 9 HA LYS 9 -5.258 -3.505 2.961
71 HB2 LYS 9 2HB LYS 9 -6.343 -1.229 3.025
72 HB3 LYS 9 1HB LYS 9 -7.462 -1.799 1.805
73 HG2 LYS 9 2HG LYS 9 -8.514 -1.919 3.956
74 HG3 LYS 9 1HG LYS 9 -8.232 -3.550 3.355
75 HD2 LYS 9 2HD LYS 9 -7.670 -3.449 5.711
76 HD3 LYS 9 1HD LYS 9 -6.208 -3.700 4.772
77 HE2 LYS 9 2HE LYS 9 -5.612 -1.361 5.003
78 HE3 LYS 9 1HE LYS 9 -7.137 -1.028 5.824
79 HZ1 LYS 9 1HZ LYS 9 -6.413 -2.523 7.613
80 HZ2 LYS 9 2HZ LYS 9 -5.346 -1.247 7.420
81 HZ3 LYS 9 3HZ LYS 9 -4.940 -2.762 6.833
82 H GLU 10 H GLU 10 -6.570 -3.118 -0.309
83 HA GLU 10 HA GLU 10 -7.917 -5.646 -0.091
84 HB2 GLU 10 2HB GLU 10 -8.584 -5.312 -2.453
85 HB3 GLU 10 1HB GLU 10 -9.022 -3.969 -1.414
86 HG2 GLU 10 2HG GLU 10 -7.181 -2.670 -2.266
87 HG3 GLU 10 1HG GLU 10 -6.653 -4.026 -3.259
88 H LEU 11 H LEU 11 -4.869 -4.526 -1.187
89 HA LEU 11 HA LEU 11 -4.176 -6.787 -2.740
90 HB2 LEU 11 2HB LEU 11 -3.018 -4.649 -2.941
91 HB3 LEU 11 1HB LEU 11 -2.450 -4.802 -1.292
92 HG LEU 11 HG LEU 11 -1.104 -6.756 -1.950
93 HD11 LEU 11 1HD1 LEU 11 -0.729 -7.209 -4.330
94 HD12 LEU 11 2HD1 LEU 11 -2.016 -6.074 -4.743
95 HD13 LEU 11 3HD1 LEU 11 -2.388 -7.545 -3.843
96 HD21 LEU 11 1HD2 LEU 11 -0.625 -4.248 -3.540
97 HD22 LEU 11 2HD2 LEU 11 0.575 -5.495 -3.197
98 HD23 LEU 11 3HD2 LEU 11 -0.118 -4.552 -1.878
99 H DAS 12 H DAS 12 -3.628 -5.932 0.687
100 HA DAS 12 HA DAS 12 -2.888 -8.725 1.117
101 HB2 DAS 12 1HB DAS 12 -3.781 -8.651 3.256
102 HB3 DAS 12 2HB DAS 12 -4.888 -7.564 2.439
103 H THR 13 H THR 13 -1.150 -9.024 2.653
104 HA THR 13 HA THR 13 0.502 -6.714 3.197
105 HB THR 13 HB THR 13 0.952 -9.615 3.952
106 HG1 THR 13 1HG THR 13 -0.974 -7.821 4.702
107 HG21 THR 13 1HG2 THR 13 1.819 -7.013 5.249
108 HG22 THR 13 2HG2 THR 13 2.868 -8.061 4.298
109 HG23 THR 13 3HG2 THR 13 2.206 -8.634 5.828
110 H ARG 14 H ARG 14 0.030 -8.306 0.592
111 HA ARG 14 HA ARG 14 2.567 -9.324 -0.217
112 HB2 ARG 14 2HB ARG 14 0.172 -8.530 -1.895
113 HB3 ARG 14 1HB ARG 14 1.540 -9.481 -2.451
114 HG2 ARG 14 2HG ARG 14 0.934 -11.242 -0.805
115 HG3 ARG 14 1HG ARG 14 -0.476 -10.286 -0.360
116 HD2 ARG 14 2HD ARG 14 -1.069 -12.045 -1.932
117 HD3 ARG 14 1HD ARG 14 -1.306 -10.451 -2.652
118 HE ARG 14 HE ARG 14 1.239 -11.244 -3.344
119 HH11 ARG 14 1HH1 ARG 14 -2.030 -12.501 -3.945
120 HH12 ARG 14 2HH1 ARG 14 -1.647 -13.157 -5.455
121 HH21 ARG 14 1HH2 ARG 14 1.758 -12.093 -5.417
122 HH22 ARG 14 2HH2 ARG 14 0.578 -12.891 -6.345
123 HA DPR 15 HA DPR 15 3.715 -5.703 -2.803
124 HB2 DPR 15 1HB DPR 15 6.383 -6.219 -2.884
125 HB3 DPR 15 2HB DPR 15 5.225 -6.996 -3.968
126 HG2 DPR 15 1HG DPR 15 6.520 -8.059 -1.491
127 HG3 DPR 15 2HG DPR 15 6.165 -8.891 -3.012
128 HD2 DPR 15 1HD DPR 15 4.644 -9.123 -0.749
129 HD3 DPR 15 2HD DPR 15 4.010 -9.362 -2.387
130 H DGL 16 H DGL 16 4.681 -6.782 0.269
131 HA DGL 16 HA DGL 16 6.452 -4.753 1.100
132 HB2 DGL 16 1HB DGL 16 6.230 -6.890 2.277
133 HB3 DGL 16 2HB DGL 16 4.586 -6.477 2.734
134 HG2 DGL 16 1HG DGL 16 5.439 -4.578 4.026
135 HG3 DGL 16 2HG DGL 16 7.084 -5.053 3.617
136 H DAL 17 H DAL 17 2.960 -5.161 1.532
137 HA DAL 17 HA DAL 17 2.606 -2.781 3.018
138 HB1 DAL 17 1HB DAL 17 0.227 -3.103 2.659
139 HB2 DAL 17 2HB DAL 17 1.003 -4.620 3.108
140 HB3 DAL 17 3HB DAL 17 0.561 -4.319 1.425
141 H DGL 18 H DGL 18 2.187 -3.606 -0.365
142 HA DGL 18 HA DGL 18 1.242 -1.263 -1.483
143 HB2 DGL 18 1HB DGL 18 1.667 -3.378 -2.698
144 HB3 DGL 18 2HB DGL 18 3.391 -3.113 -2.549
145 HG2 DGL 18 1HG DGL 18 2.865 -2.513 -4.743
146 HG3 DGL 18 2HG DGL 18 3.065 -0.996 -3.869
147 H DAR 19 H DAR 19 4.603 -2.209 -0.973
148 HA DAR 19 HA DAR 19 5.745 0.207 -1.828
149 HB2 DAR 19 1HB DAR 19 7.118 -1.788 -1.757
150 HB3 DAR 19 2HB DAR 19 6.913 -1.920 -0.015
151 HG2 DAR 19 1HG DAR 19 9.115 -1.029 -0.540
152 HG3 DAR 19 2HG DAR 19 8.144 0.199 0.273
153 HD2 DAR 19 1HD DAR 19 7.555 1.086 -2.022
154 HD3 DAR 19 2HD DAR 19 8.794 0.006 -2.653
155 HE DAR 19 HE DAR 19 9.635 1.756 -0.547
156 HH11 DAR 19 1HH2 DAR 19 11.050 3.550 -1.069
157 HH12 DAR 19 2HH2 DAR 19 11.509 3.822 -2.695
158 HH21 DAR 19 1HH1 DAR 19 9.537 1.187 -4.024
159 HH22 DAR 19 2HH1 DAR 19 10.595 2.453 -4.430
160 H DLY 20 H DLY 20 4.829 -0.949 1.360
161 HA DLY 20 HA DLY 20 5.852 1.092 2.961
162 HB2 DLY 20 1HB DLY 20 4.786 -0.968 3.827
163 HB3 DLY 20 2HB DLY 20 3.237 -0.390 3.249
164 HG2 DLY 20 1HG DLY 20 3.433 1.545 4.810
165 HG3 DLY 20 2HG DLY 20 4.907 0.817 5.454
166 HD2 DLY 20 1HD DLY 20 3.117 0.199 6.911
167 HD3 DLY 20 2HD DLY 20 3.565 -1.230 5.986
168 HE2 DLY 20 1HE DLY 20 1.185 -1.142 6.051
169 HE3 DLY 20 2HE DLY 20 1.668 -0.726 4.417
170 HZ1 DLY 20 1HZ DLY 20 1.385 1.693 5.094
171 HZ2 DLY 20 2HZ DLY 20 0.731 1.114 6.539
172 HZ3 DLY 20 3HZ DLY 20 -0.017 0.750 5.092
173 H DCY 21 H DCY 21 2.698 0.809 1.384
174 HA DCY 21 HA DCY 21 1.622 3.249 2.202
175 HB2 DCY 21 1HB DCY 21 1.145 1.635 -0.265
176 HB3 DCY 21 2HB DCY 21 0.089 2.938 0.304
177 H DAR 22 H DAR 22 3.316 2.340 -0.792
178 HA DAR 22 HA DAR 22 3.007 4.905 -1.951
179 HB2 DAR 22 1HB DAR 22 4.911 2.688 -2.680
180 HB3 DAR 22 2HB DAR 22 4.569 4.097 -3.670
181 HG2 DAR 22 1HG DAR 22 2.179 3.376 -3.739
182 HG3 DAR 22 2HG DAR 22 2.658 1.892 -2.914
183 HD2 DAR 22 1HD DAR 22 2.546 1.480 -5.275
184 HD3 DAR 22 2HD DAR 22 4.231 1.424 -4.754
185 HE DAR 22 HE DAR 22 3.474 4.012 -5.596
186 HH11 DAR 22 1HH1 DAR 22 4.439 0.855 -6.875
187 HH12 DAR 22 2HH1 DAR 22 4.991 1.482 -8.362
188 HH21 DAR 22 1HH2 DAR 22 4.242 4.844 -7.658
189 HH22 DAR 22 2HH2 DAR 22 4.876 3.769 -8.822
190 H DGL 23 H DGL 23 5.294 3.602 0.222
191 HA DGL 23 HA DGL 23 7.323 5.574 -0.263
192 HB2 DGL 23 1HB DGL 23 7.723 3.263 0.667
193 HB3 DGL 23 2HB DGL 23 6.920 3.770 2.139
194 HG2 DGL 23 1HG DGL 23 9.221 3.884 2.565
195 HG3 DGL 23 2HG DGL 23 8.663 5.545 2.382
196 H DGL 24 H DGL 24 4.652 5.086 2.022
197 HA DGL 24 HA DGL 24 5.394 7.437 3.529
198 HB2 DGL 24 1HB DGL 24 3.611 6.865 5.058
199 HB3 DGL 24 2HB DGL 24 4.616 5.459 4.748
200 HG2 DGL 24 1HG DGL 24 2.956 4.522 3.288
201 HG3 DGL 24 2HG DGL 24 1.960 5.970 3.421
202 H SER 25 H SER 25 2.835 6.550 1.250
203 HA SER 25 HA SER 25 2.070 9.340 1.079
204 HB2 SER 25 2HB SER 25 1.021 6.922 -0.393
205 HB3 SER 25 1HB SER 25 0.719 8.608 -0.814
206 HG SER 25 HG SER 25 3.256 8.496 -0.727
207 H ASP 26 H ASP 26 0.155 10.138 1.834
208 HA ASP 26 HA ASP 26 -1.275 8.495 3.776
209 HB2 ASP 26 2HB ASP 26 -2.213 10.552 4.613
210 HB3 ASP 26 1HB ASP 26 -0.505 10.816 4.320
Start of MODEL 6
1 H ASN 1 H ASN 1 -1.697 9.764 -0.009
2 HA ASN 1 HA ASN 1 -4.288 10.202 -0.965
3 HB2 ASN 1 2HB ASN 1 -2.222 8.173 -1.866
4 HB3 ASN 1 1HB ASN 1 -3.707 8.521 -2.733
5 HD21 ASN 1 1HD2 ASN 1 -0.894 8.785 -3.534
6 HD22 ASN 1 2HD2 ASN 1 -0.692 10.429 -3.996
7 HA PRO 2 HA PRO 2 -6.246 7.059 1.625
8 HB2 PRO 2 2HB PRO 2 -8.587 7.731 -0.069
9 HB3 PRO 2 1HB PRO 2 -8.437 7.732 1.692
10 HG2 PRO 2 2HG PRO 2 -8.518 10.022 0.352
11 HG3 PRO 2 1HG PRO 2 -7.432 9.821 1.737
12 HD2 PRO 2 2HD PRO 2 -6.808 9.745 -1.186
13 HD3 PRO 2 1HD PRO 2 -5.908 10.494 0.155
14 H GLU 3 H GLU 3 -6.666 7.234 -1.847
15 HA GLU 3 HA GLU 3 -7.674 4.619 -2.255
16 HB2 GLU 3 2HB GLU 3 -6.138 6.404 -4.156
17 HB3 GLU 3 1HB GLU 3 -6.917 4.907 -4.624
18 HG2 GLU 3 2HG GLU 3 -8.261 6.801 -5.282
19 HG3 GLU 3 1HG GLU 3 -9.096 5.871 -4.042
20 H LEU 4 H LEU 4 -4.446 5.950 -2.133
21 HA LEU 4 HA LEU 4 -3.203 3.535 -2.994
22 HB2 LEU 4 2HB LEU 4 -2.273 5.883 -3.327
23 HB3 LEU 4 1HB LEU 4 -1.946 5.898 -1.619
24 HG LEU 4 HG LEU 4 -0.295 4.149 -1.830
25 HD11 LEU 4 1HD1 LEU 4 -1.031 4.111 -4.763
26 HD12 LEU 4 2HD1 LEU 4 -1.334 2.816 -3.600
27 HD13 LEU 4 3HD1 LEU 4 0.317 3.242 -4.033
28 HD21 LEU 4 1HD2 LEU 4 0.031 6.253 -3.960
29 HD22 LEU 4 2HD2 LEU 4 1.332 5.317 -3.225
30 HD23 LEU 4 3HD2 LEU 4 0.396 6.446 -2.247
31 H GLN 5 H GLN 5 -3.967 5.085 0.041
32 HA GLN 5 HA GLN 5 -2.566 3.307 1.751
33 HB2 GLN 5 2HB GLN 5 -5.117 4.823 2.280
34 HB3 GLN 5 1HB GLN 5 -4.116 4.062 3.500
35 HG2 GLN 5 2HG GLN 5 -2.310 5.608 2.989
36 HG3 GLN 5 1HG GLN 5 -3.305 6.355 1.733
37 HE21 GLN 5 1HE2 GLN 5 -2.200 7.548 4.102
38 HE22 GLN 5 2HE2 GLN 5 -3.546 8.114 5.042
39 H ARG 6 H ARG 6 -5.965 3.399 0.679
40 HA ARG 6 HA ARG 6 -6.808 1.062 1.939
41 HB2 ARG 6 2HB ARG 6 -7.779 2.380 -0.571
42 HB3 ARG 6 1HB ARG 6 -8.533 0.940 0.082
43 HG2 ARG 6 2HG ARG 6 -8.810 2.316 2.236
44 HG3 ARG 6 1HG ARG 6 -8.475 3.716 1.203
45 HD2 ARG 6 2HD ARG 6 -10.901 3.212 1.394
46 HD3 ARG 6 1HD ARG 6 -10.302 3.113 -0.269
47 HE ARG 6 HE ARG 6 -10.127 0.648 1.111
48 HH11 ARG 6 1HH1 ARG 6 -12.491 2.629 -0.596
49 HH12 ARG 6 2HH1 ARG 6 -13.358 1.290 -1.221
50 HH21 ARG 6 1HH2 ARG 6 -11.293 -1.179 0.234
51 HH22 ARG 6 2HH2 ARG 6 -12.694 -0.900 -0.694
52 H LYS 7 H LYS 7 -5.138 1.549 -1.038
53 HA LYS 7 HA LYS 7 -5.482 -0.823 -2.395
54 HB2 LYS 7 2HB LYS 7 -4.255 1.287 -3.088
55 HB3 LYS 7 1HB LYS 7 -2.884 0.678 -2.187
56 HG2 LYS 7 2HG LYS 7 -2.818 -1.290 -3.658
57 HG3 LYS 7 1HG LYS 7 -4.164 -0.618 -4.585
58 HD2 LYS 7 2HD LYS 7 -2.740 1.453 -4.895
59 HD3 LYS 7 1HD LYS 7 -1.397 0.516 -4.248
60 HE2 LYS 7 2HE LYS 7 -3.017 -0.139 -6.702
61 HE3 LYS 7 1HE LYS 7 -1.387 0.524 -6.678
62 HZ1 LYS 7 1HZ LYS 7 -2.156 -2.130 -5.594
63 HZ2 LYS 7 2HZ LYS 7 -0.562 -1.524 -5.767
64 HZ3 LYS 7 3HZ LYS 7 -1.508 -1.830 -7.106
65 H CYS 8 H CYS 8 -3.357 -0.077 0.320
66 HA CYS 8 HA CYS 8 -1.721 -2.345 0.314
67 HB2 CYS 8 2HB CYS 8 -2.727 -0.883 2.747
68 HB3 CYS 8 1HB CYS 8 -1.253 -1.830 2.609
69 H LYS 9 H LYS 9 -4.843 -1.726 1.833
70 HA LYS 9 HA LYS 9 -4.858 -4.257 3.219
71 HB2 LYS 9 2HB LYS 9 -7.062 -2.228 2.884
72 HB3 LYS 9 1HB LYS 9 -7.061 -3.570 4.015
73 HG2 LYS 9 2HG LYS 9 -5.153 -1.237 4.047
74 HG3 LYS 9 1HG LYS 9 -6.550 -1.433 5.099
75 HD2 LYS 9 2HD LYS 9 -4.154 -3.288 5.007
76 HD3 LYS 9 1HD LYS 9 -4.414 -2.022 6.200
77 HE2 LYS 9 2HE LYS 9 -6.204 -4.417 5.768
78 HE3 LYS 9 1HE LYS 9 -5.016 -4.236 7.053
79 HZ1 LYS 9 1HZ LYS 9 -7.228 -3.704 7.845
80 HZ2 LYS 9 2HZ LYS 9 -7.422 -2.531 6.668
81 HZ3 LYS 9 3HZ LYS 9 -6.272 -2.320 7.875
82 H GLU 10 H GLU 10 -6.181 -2.876 0.325
83 HA GLU 10 HA GLU 10 -7.938 -5.042 -0.228
84 HB2 GLU 10 2HB GLU 10 -6.727 -3.031 -2.131
85 HB3 GLU 10 1HB GLU 10 -8.091 -4.077 -2.482
86 HG2 GLU 10 2HG GLU 10 -7.996 -1.800 -0.515
87 HG3 GLU 10 1HG GLU 10 -8.881 -1.862 -2.034
88 H LEU 11 H LEU 11 -4.574 -4.391 -0.737
89 HA LEU 11 HA LEU 11 -4.090 -6.567 -2.563
90 HB2 LEU 11 2HB LEU 11 -2.764 -4.340 -2.226
91 HB3 LEU 11 1HB LEU 11 -2.055 -5.148 -0.854
92 HG LEU 11 HG LEU 11 -1.780 -6.000 -3.740
93 HD11 LEU 11 1HD1 LEU 11 0.157 -4.682 -1.861
94 HD12 LEU 11 2HD1 LEU 11 -0.599 -3.958 -3.279
95 HD13 LEU 11 3HD1 LEU 11 0.544 -5.287 -3.469
96 HD21 LEU 11 1HD2 LEU 11 -1.647 -7.926 -2.226
97 HD22 LEU 11 2HD2 LEU 11 -0.420 -7.092 -1.271
98 HD23 LEU 11 3HD2 LEU 11 -0.076 -7.561 -2.936
99 H DAS 12 H DAS 12 -2.964 -5.868 0.754
100 HA DAS 12 HA DAS 12 -2.869 -8.742 1.302
101 HB2 DAS 12 1HB DAS 12 -4.902 -7.870 2.280
102 HB3 DAS 12 2HB DAS 12 -4.018 -6.559 3.048
103 H THR 13 H THR 13 -0.897 -9.304 2.070
104 HA THR 13 HA THR 13 0.749 -7.211 3.295
105 HB THR 13 HB THR 13 1.987 -9.283 4.192
106 HG1 THR 13 1HG THR 13 0.561 -11.122 4.314
107 HG21 THR 13 1HG2 THR 13 0.392 -9.524 6.058
108 HG22 THR 13 2HG2 THR 13 -0.850 -8.725 5.092
109 HG23 THR 13 3HG2 THR 13 0.582 -7.832 5.601
110 H ARG 14 H ARG 14 0.385 -8.924 0.478
111 HA ARG 14 HA ARG 14 3.124 -9.607 -0.055
112 HB2 ARG 14 2HB ARG 14 0.690 -9.555 -1.839
113 HB3 ARG 14 1HB ARG 14 2.248 -10.196 -2.330
114 HG2 ARG 14 2HG ARG 14 0.571 -11.251 -0.052
115 HG3 ARG 14 1HG ARG 14 0.675 -11.974 -1.656
116 HD2 ARG 14 2HD ARG 14 2.959 -11.616 0.286
117 HD3 ARG 14 1HD ARG 14 2.103 -13.122 -0.025
118 HE ARG 14 HE ARG 14 2.885 -12.540 -2.450
119 HH11 ARG 14 1HH1 ARG 14 4.777 -12.333 0.567
120 HH12 ARG 14 2HH1 ARG 14 6.259 -12.709 -0.161
121 HH21 ARG 14 1HH2 ARG 14 4.955 -13.063 -3.453
122 HH22 ARG 14 2HH2 ARG 14 6.360 -13.123 -2.494
123 HA DPR 15 HA DPR 15 3.744 -6.167 -3.127
124 HB2 DPR 15 1HB DPR 15 6.581 -6.888 -2.920
125 HB3 DPR 15 2HB DPR 15 5.558 -6.824 -4.357
126 HG2 DPR 15 1HG DPR 15 6.453 -9.163 -3.347
127 HG3 DPR 15 2HG DPR 15 4.866 -9.019 -4.122
128 HD2 DPR 15 1HD DPR 15 5.543 -9.044 -1.199
129 HD3 DPR 15 2HD DPR 15 4.262 -9.916 -2.060
130 H DGL 16 H DGL 16 5.030 -7.060 -0.108
131 HA DGL 16 HA DGL 16 6.548 -4.784 0.550
132 HB2 DGL 16 1HB DGL 16 6.601 -6.944 1.786
133 HB3 DGL 16 2HB DGL 16 4.981 -6.619 2.380
134 HG2 DGL 16 1HG DGL 16 5.790 -4.668 3.578
135 HG3 DGL 16 2HG DGL 16 7.418 -4.958 2.966
136 H DAL 17 H DAL 17 3.129 -5.571 0.781
137 HA DAL 17 HA DAL 17 2.286 -3.325 2.253
138 HB1 DAL 17 1HB DAL 17 0.761 -4.949 0.221
139 HB2 DAL 17 2HB DAL 17 0.054 -3.837 1.392
140 HB3 DAL 17 3HB DAL 17 0.876 -5.296 1.944
141 H DGL 18 H DGL 18 2.509 -3.974 -1.191
142 HA DGL 18 HA DGL 18 1.468 -1.669 -2.338
143 HB2 DGL 18 1HB DGL 18 2.205 -3.671 -3.587
144 HB3 DGL 18 2HB DGL 18 3.876 -3.280 -3.231
145 HG2 DGL 18 1HG DGL 18 3.442 -2.639 -5.472
146 HG3 DGL 18 2HG DGL 18 3.602 -1.171 -4.512
147 H DAR 19 H DAR 19 4.771 -2.321 -1.312
148 HA DAR 19 HA DAR 19 5.778 0.238 -1.974
149 HB2 DAR 19 1HB DAR 19 6.862 -1.841 -0.081
150 HB3 DAR 19 2HB DAR 19 7.733 -0.396 -0.578
151 HG2 DAR 19 1HG DAR 19 7.656 -1.133 -2.888
152 HG3 DAR 19 2HG DAR 19 6.769 -2.580 -2.409
153 HD2 DAR 19 1HD DAR 19 9.087 -3.102 -2.717
154 HD3 DAR 19 2HD DAR 19 8.666 -3.257 -1.015
155 HE DAR 19 HE DAR 19 9.617 -0.766 -1.137
156 HH11 DAR 19 1HH2 DAR 19 11.872 -0.154 -0.839
157 HH12 DAR 19 2HH2 DAR 19 13.100 -1.242 -1.264
158 HH21 DAR 19 1HH1 DAR 19 10.944 -3.829 -2.363
159 HH22 DAR 19 2HH1 DAR 19 12.566 -3.374 -2.152
160 H DLY 20 H DLY 20 4.597 -1.168 1.039
161 HA DLY 20 HA DLY 20 5.178 1.024 2.682
162 HB2 DLY 20 1HB DLY 20 4.633 -1.229 3.532
163 HB3 DLY 20 2HB DLY 20 2.975 -1.026 2.998
164 HG2 DLY 20 1HG DLY 20 2.609 0.732 4.606
165 HG3 DLY 20 2HG DLY 20 4.309 0.699 5.073
166 HD2 DLY 20 1HD DLY 20 4.067 -1.581 5.892
167 HD3 DLY 20 2HD DLY 20 2.382 -1.607 5.377
168 HE2 DLY 20 1HE DLY 20 3.495 0.319 7.409
169 HE3 DLY 20 2HE DLY 20 2.712 -1.201 7.823
170 HZ1 DLY 20 1HZ DLY 20 0.690 -0.421 6.769
171 HZ2 DLY 20 2HZ DLY 20 1.409 1.037 6.344
172 HZ3 DLY 20 3HZ DLY 20 1.175 0.666 7.963
173 H DCY 21 H DCY 21 2.357 0.329 0.670
174 HA DCY 21 HA DCY 21 0.627 2.381 1.395
175 HB2 DCY 21 1HB DCY 21 1.209 1.361 -1.404
176 HB3 DCY 21 2HB DCY 21 -0.226 2.258 -0.923
177 H DAR 22 H DAR 22 3.270 2.378 -0.900
178 HA DAR 22 HA DAR 22 2.853 5.118 -1.670
179 HB2 DAR 22 1HB DAR 22 5.058 3.196 -2.427
180 HB3 DAR 22 2HB DAR 22 4.658 4.705 -3.245
181 HG2 DAR 22 1HG DAR 22 2.473 3.797 -3.846
182 HG3 DAR 22 2HG DAR 22 2.847 2.305 -2.999
183 HD2 DAR 22 1HD DAR 22 4.725 1.935 -4.534
184 HD3 DAR 22 2HD DAR 22 4.231 3.374 -5.431
185 HE DAR 22 HE DAR 22 2.445 1.058 -5.028
186 HH11 DAR 22 1HH1 DAR 22 3.910 3.422 -7.235
187 HH12 DAR 22 2HH1 DAR 22 2.992 2.883 -8.571
188 HH21 DAR 22 1HH2 DAR 22 1.316 0.355 -6.781
189 HH22 DAR 22 2HH2 DAR 22 1.501 1.065 -8.341
190 H DGL 23 H DGL 23 4.672 3.427 0.647
191 HA DGL 23 HA DGL 23 6.649 5.467 1.026
192 HB2 DGL 23 1HB DGL 23 6.865 2.984 1.612
193 HB3 DGL 23 2HB DGL 23 5.827 3.323 2.987
194 HG2 DGL 23 1HG DGL 23 8.109 3.320 3.705
195 HG3 DGL 23 2HG DGL 23 7.475 4.965 3.790
196 H DGL 24 H DGL 24 3.686 4.385 2.700
197 HA DGL 24 HA DGL 24 3.700 6.378 4.670
198 HB2 DGL 24 1HB DGL 24 1.425 4.744 3.567
199 HB3 DGL 24 2HB DGL 24 1.244 5.854 4.912
200 HG2 DGL 24 1HG DGL 24 2.861 4.574 6.204
201 HG3 DGL 24 2HG DGL 24 3.050 3.457 4.852
202 H SER 25 H SER 25 1.544 6.171 1.825
203 HA SER 25 HA SER 25 1.880 8.985 1.380
204 HB2 SER 25 2HB SER 25 0.255 8.598 -0.475
205 HB3 SER 25 1HB SER 25 1.659 7.530 -0.530
206 HG SER 25 HG SER 25 0.430 5.849 0.135
207 H ASP 26 H ASP 26 -0.071 10.414 1.101
208 HA ASP 26 HA ASP 26 -1.909 10.089 3.354
209 HB2 ASP 26 2HB ASP 26 -0.725 12.281 3.049
210 HB3 ASP 26 1HB ASP 26 -1.511 12.462 1.491
Start of MODEL 7
1 H ASN 1 H ASN 1 -1.327 8.261 0.644
2 HA ASN 1 HA ASN 1 -3.339 9.406 -0.873
3 HB2 ASN 1 2HB ASN 1 -1.490 7.110 -1.492
4 HB3 ASN 1 1HB ASN 1 -2.529 7.854 -2.695
5 HD21 ASN 1 1HD2 ASN 1 -0.703 8.443 -3.907
6 HD22 ASN 1 2HD2 ASN 1 0.323 9.733 -3.416
7 HA PRO 2 HA PRO 2 -6.935 6.964 -0.098
8 HB2 PRO 2 2HB PRO 2 -8.068 7.339 -2.643
9 HB3 PRO 2 1HB PRO 2 -8.306 8.370 -1.231
10 HG2 PRO 2 2HG PRO 2 -6.469 8.706 -3.542
11 HG3 PRO 2 1HG PRO 2 -7.341 9.933 -2.608
12 HD2 PRO 2 2HD PRO 2 -4.728 9.524 -2.304
13 HD3 PRO 2 1HD PRO 2 -5.757 9.947 -0.917
14 H GLU 3 H GLU 3 -5.576 6.485 -3.390
15 HA GLU 3 HA GLU 3 -6.685 3.941 -3.803
16 HB2 GLU 3 2HB GLU 3 -4.163 5.130 -4.961
17 HB3 GLU 3 1HB GLU 3 -4.941 3.674 -5.546
18 HG2 GLU 3 2HG GLU 3 -6.120 6.442 -5.560
19 HG3 GLU 3 1HG GLU 3 -5.473 5.572 -6.952
20 H LEU 4 H LEU 4 -3.569 4.943 -2.558
21 HA LEU 4 HA LEU 4 -2.438 2.401 -2.352
22 HB2 LEU 4 2HB LEU 4 -1.803 5.018 -1.048
23 HB3 LEU 4 1HB LEU 4 -0.975 3.567 -0.550
24 HG LEU 4 HG LEU 4 0.392 4.826 -2.099
25 HD11 LEU 4 1HD1 LEU 4 0.602 2.426 -2.140
26 HD12 LEU 4 2HD1 LEU 4 0.887 3.114 -3.735
27 HD13 LEU 4 3HD1 LEU 4 -0.643 2.314 -3.386
28 HD21 LEU 4 1HD2 LEU 4 -1.339 6.008 -3.357
29 HD22 LEU 4 2HD2 LEU 4 -1.847 4.491 -4.101
30 HD23 LEU 4 3HD2 LEU 4 -0.249 5.153 -4.448
31 H GLN 5 H GLN 5 -3.939 4.391 0.187
32 HA GLN 5 HA GLN 5 -3.502 2.585 2.274
33 HB2 GLN 5 2HB GLN 5 -5.769 4.562 2.057
34 HB3 GLN 5 1HB GLN 5 -5.224 3.780 3.533
35 HG2 GLN 5 2HG GLN 5 -3.692 5.744 1.848
36 HG3 GLN 5 1HG GLN 5 -4.380 6.023 3.442
37 HE21 GLN 5 1HE2 GLN 5 -3.494 3.397 4.478
38 HE22 GLN 5 2HE2 GLN 5 -1.797 3.535 4.678
39 H ARG 6 H ARG 6 -6.027 2.608 -0.090
40 HA ARG 6 HA ARG 6 -7.536 0.599 1.330
41 HB2 ARG 6 2HB ARG 6 -7.859 1.781 -1.410
42 HB3 ARG 6 1HB ARG 6 -8.917 0.548 -0.746
43 HG2 ARG 6 2HG ARG 6 -9.563 2.055 1.051
44 HG3 ARG 6 1HG ARG 6 -8.482 3.294 0.400
45 HD2 ARG 6 2HD ARG 6 -10.778 3.677 -0.308
46 HD3 ARG 6 1HD ARG 6 -9.725 3.302 -1.672
47 HE ARG 6 HE ARG 6 -11.321 1.185 -0.452
48 HH11 ARG 6 1HH1 ARG 6 -10.583 3.200 -3.261
49 HH12 ARG 6 2HH1 ARG 6 -11.611 2.374 -4.334
50 HH21 ARG 6 1HH2 ARG 6 -12.723 0.033 -1.897
51 HH22 ARG 6 2HH2 ARG 6 -12.852 0.489 -3.532
52 H LYS 7 H LYS 7 -5.456 0.771 -1.536
53 HA LYS 7 HA LYS 7 -5.980 -1.904 -2.209
54 HB2 LYS 7 2HB LYS 7 -5.335 -0.176 -3.868
55 HB3 LYS 7 1HB LYS 7 -3.716 -0.163 -3.191
56 HG2 LYS 7 2HG LYS 7 -3.162 -2.196 -4.123
57 HG3 LYS 7 1HG LYS 7 -4.840 -2.742 -4.190
58 HD2 LYS 7 2HD LYS 7 -4.045 -2.281 -6.435
59 HD3 LYS 7 1HD LYS 7 -5.282 -1.117 -5.989
60 HE2 LYS 7 2HE LYS 7 -3.610 0.130 -7.074
61 HE3 LYS 7 1HE LYS 7 -3.375 0.443 -5.359
62 HZ1 LYS 7 1HZ LYS 7 -1.284 0.048 -6.428
63 HZ2 LYS 7 2HZ LYS 7 -1.815 -1.392 -7.070
64 HZ3 LYS 7 3HZ LYS 7 -1.536 -1.292 -5.433
65 H CYS 8 H CYS 8 -3.624 -0.433 -0.123
66 HA CYS 8 HA CYS 8 -1.853 -2.581 0.163
67 HB2 CYS 8 2HB CYS 8 -2.811 -0.646 2.291
68 HB3 CYS 8 1HB CYS 8 -1.386 -1.674 2.415
69 H LYS 9 H LYS 9 -4.873 -1.861 1.871
70 HA LYS 9 HA LYS 9 -4.726 -4.264 3.412
71 HB2 LYS 9 2HB LYS 9 -6.955 -2.251 3.080
72 HB3 LYS 9 1HB LYS 9 -6.935 -3.551 4.269
73 HG2 LYS 9 2HG LYS 9 -4.952 -2.584 5.309
74 HG3 LYS 9 1HG LYS 9 -4.937 -1.304 4.101
75 HD2 LYS 9 2HD LYS 9 -7.103 -0.516 4.903
76 HD3 LYS 9 1HD LYS 9 -7.140 -1.815 6.097
77 HE2 LYS 9 2HE LYS 9 -5.098 -0.916 7.129
78 HE3 LYS 9 1HE LYS 9 -5.075 0.370 5.928
79 HZ1 LYS 9 1HZ LYS 9 -7.240 -0.038 7.922
80 HZ2 LYS 9 2HZ LYS 9 -7.149 1.196 6.798
81 HZ3 LYS 9 3HZ LYS 9 -6.013 1.112 8.028
82 H GLU 10 H GLU 10 -6.004 -3.341 0.373
83 HA GLU 10 HA GLU 10 -7.879 -5.442 0.052
84 HB2 GLU 10 2HB GLU 10 -7.793 -3.247 -1.200
85 HB3 GLU 10 1HB GLU 10 -6.385 -3.878 -2.039
86 HG2 GLU 10 2HG GLU 10 -8.333 -4.080 -3.409
87 HG3 GLU 10 1HG GLU 10 -7.734 -5.675 -2.945
88 H LEU 11 H LEU 11 -4.441 -4.977 -0.624
89 HA LEU 11 HA LEU 11 -4.231 -7.602 -1.875
90 HB2 LEU 11 2HB LEU 11 -2.157 -5.472 -1.415
91 HB3 LEU 11 1HB LEU 11 -1.868 -6.978 -2.260
92 HG LEU 11 HG LEU 11 -3.678 -4.736 -3.150
93 HD11 LEU 11 1HD1 LEU 11 -2.068 -4.508 -4.971
94 HD12 LEU 11 2HD1 LEU 11 -1.066 -5.759 -4.233
95 HD13 LEU 11 3HD1 LEU 11 -1.328 -4.230 -3.396
96 HD21 LEU 11 1HD2 LEU 11 -3.946 -6.034 -5.216
97 HD22 LEU 11 2HD2 LEU 11 -4.613 -6.881 -3.823
98 HD23 LEU 11 3HD2 LEU 11 -3.051 -7.365 -4.487
99 H DAS 12 H DAS 12 -3.843 -6.197 1.188
100 HA DAS 12 HA DAS 12 -2.949 -8.781 2.141
101 HB2 DAS 12 1HB DAS 12 -4.900 -7.821 3.257
102 HB3 DAS 12 2HB DAS 12 -3.971 -6.386 3.675
103 H THR 13 H THR 13 -0.889 -9.032 2.143
104 HA THR 13 HA THR 13 0.796 -6.808 3.046
105 HB THR 13 HB THR 13 0.840 -8.876 4.483
106 HG1 THR 13 1HG THR 13 2.648 -7.578 4.485
107 HG21 THR 13 1HG2 THR 13 2.006 -10.880 3.668
108 HG22 THR 13 2HG2 THR 13 2.122 -10.156 2.065
109 HG23 THR 13 3HG2 THR 13 0.545 -10.569 2.728
110 H ARG 14 H ARG 14 -0.274 -8.226 0.330
111 HA ARG 14 HA ARG 14 2.205 -8.667 -1.034
112 HB2 ARG 14 2HB ARG 14 -0.665 -8.799 -1.993
113 HB3 ARG 14 1HB ARG 14 0.699 -8.994 -3.080
114 HG2 ARG 14 2HG ARG 14 -0.067 -11.174 -2.515
115 HG3 ARG 14 1HG ARG 14 1.450 -10.914 -1.658
116 HD2 ARG 14 2HD ARG 14 0.137 -10.294 0.349
117 HD3 ARG 14 1HD ARG 14 -1.330 -10.726 -0.513
118 HE ARG 14 HE ARG 14 0.833 -12.653 -0.051
119 HH11 ARG 14 1HH1 ARG 14 -2.620 -11.856 0.017
120 HH12 ARG 14 2HH1 ARG 14 -3.083 -13.269 0.831
121 HH21 ARG 14 1HH2 ARG 14 0.189 -14.633 1.069
122 HH22 ARG 14 2HH2 ARG 14 -1.441 -14.886 1.451
123 HA DPR 15 HA DPR 15 1.931 -4.819 -3.507
124 HB2 DPR 15 1HB DPR 15 4.617 -5.423 -4.405
125 HB3 DPR 15 2HB DPR 15 3.153 -5.307 -5.381
126 HG2 DPR 15 1HG DPR 15 4.501 -7.641 -4.964
127 HG3 DPR 15 2HG DPR 15 2.759 -7.571 -5.275
128 HD2 DPR 15 1HD DPR 15 4.206 -7.856 -2.673
129 HD3 DPR 15 2HD DPR 15 2.758 -8.706 -3.253
130 H DGL 16 H DGL 16 3.851 -6.253 -1.182
131 HA DGL 16 HA DGL 16 5.755 -4.190 -0.690
132 HB2 DGL 16 1HB DGL 16 6.063 -6.605 -0.123
133 HB3 DGL 16 2HB DGL 16 4.796 -6.451 1.077
134 HG2 DGL 16 1HG DGL 16 7.014 -6.425 2.070
135 HG3 DGL 16 2HG DGL 16 6.120 -4.939 2.373
136 H DAL 17 H DAL 17 2.537 -4.991 0.280
137 HA DAL 17 HA DAL 17 2.195 -3.368 2.529
138 HB1 DAL 17 1HB DAL 17 0.222 -4.147 0.386
139 HB2 DAL 17 2HB DAL 17 -0.196 -3.492 1.965
140 HB3 DAL 17 3HB DAL 17 0.587 -5.069 1.842
141 H DGL 18 H DGL 18 1.288 -2.763 -0.848
142 HA DGL 18 HA DGL 18 0.663 -0.057 -0.418
143 HB2 DGL 18 1HB DGL 18 0.694 0.164 -2.892
144 HB3 DGL 18 2HB DGL 18 -0.328 -1.131 -2.288
145 HG2 DGL 18 1HG DGL 18 1.279 -2.770 -2.893
146 HG3 DGL 18 2HG DGL 18 2.452 -1.527 -3.327
147 H DAR 19 H DAR 19 3.613 -1.652 -1.160
148 HA DAR 19 HA DAR 19 5.159 0.555 -1.953
149 HB2 DAR 19 1HB DAR 19 5.915 -1.763 -2.178
150 HB3 DAR 19 2HB DAR 19 5.961 -1.927 -0.430
151 HG2 DAR 19 1HG DAR 19 7.701 -0.207 -0.332
152 HG3 DAR 19 2HG DAR 19 7.694 -0.136 -2.097
153 HD2 DAR 19 1HD DAR 19 8.347 -2.452 -2.228
154 HD3 DAR 19 2HD DAR 19 8.266 -2.598 -0.471
155 HE DAR 19 HE DAR 19 10.060 -0.616 -1.621
156 HH11 DAR 19 1HH2 DAR 19 12.241 -0.753 -0.997
157 HH12 DAR 19 2HH2 DAR 19 12.848 -2.088 -0.135
158 HH21 DAR 19 1HH1 DAR 19 9.670 -3.729 0.051
159 HH22 DAR 19 2HH1 DAR 19 11.307 -3.833 0.501
160 H DLY 20 H DLY 20 4.493 -0.875 1.224
161 HA DLY 20 HA DLY 20 6.043 0.905 2.751
162 HB2 DLY 20 1HB DLY 20 5.198 -1.321 3.528
163 HB3 DLY 20 2HB DLY 20 3.586 -0.639 3.610
164 HG2 DLY 20 1HG DLY 20 4.458 -0.641 5.822
165 HG3 DLY 20 2HG DLY 20 4.476 1.034 5.266
166 HD2 DLY 20 1HD DLY 20 6.873 0.758 4.662
167 HD3 DLY 20 2HD DLY 20 6.828 -0.857 5.363
168 HE2 DLY 20 1HE DLY 20 7.750 0.590 6.995
169 HE3 DLY 20 2HE DLY 20 6.122 0.180 7.519
170 HZ1 DLY 20 1HZ DLY 20 6.585 2.547 7.793
171 HZ2 DLY 20 2HZ DLY 20 5.366 2.380 6.649
172 HZ3 DLY 20 3HZ DLY 20 6.964 2.661 6.167
173 H DCY 21 H DCY 21 2.662 0.910 1.735
174 HA DCY 21 HA DCY 21 1.938 3.230 3.168
175 HB2 DCY 21 1HB DCY 21 0.749 2.245 0.578
176 HB3 DCY 21 2HB DCY 21 0.008 3.383 1.693
177 H DAR 22 H DAR 22 3.016 2.834 -0.242
178 HA DAR 22 HA DAR 22 2.844 5.621 -0.768
179 HB2 DAR 22 1HB DAR 22 3.907 5.195 -2.893
180 HB3 DAR 22 2HB DAR 22 2.716 3.949 -2.580
181 HG2 DAR 22 1HG DAR 22 4.551 2.462 -1.842
182 HG3 DAR 22 2HG DAR 22 5.698 3.691 -2.382
183 HD2 DAR 22 1HD DAR 22 4.703 3.575 -4.641
184 HD3 DAR 22 2HD DAR 22 3.641 2.285 -4.085
185 HE DAR 22 HE DAR 22 6.526 1.939 -3.850
186 HH11 DAR 22 1HH1 DAR 22 3.513 1.015 -5.504
187 HH12 DAR 22 2HH1 DAR 22 4.184 -0.343 -6.261
188 HH21 DAR 22 1HH2 DAR 22 7.443 0.038 -4.933
189 HH22 DAR 22 2HH2 DAR 22 6.453 -0.916 -5.911
190 H DGL 23 H DGL 23 5.214 3.746 0.777
191 HA DGL 23 HA DGL 23 7.496 5.317 0.554
192 HB2 DGL 23 1HB DGL 23 7.439 3.155 1.676
193 HB3 DGL 23 2HB DGL 23 6.360 3.793 2.895
194 HG2 DGL 23 1HG DGL 23 8.112 5.273 3.694
195 HG3 DGL 23 2HG DGL 23 9.212 4.606 2.487
196 H DGL 24 H DGL 24 4.697 5.672 2.632
197 HA DGL 24 HA DGL 24 5.830 8.146 3.721
198 HB2 DGL 24 1HB DGL 24 4.168 7.688 5.615
199 HB3 DGL 24 2HB DGL 24 5.614 6.698 5.506
200 HG2 DGL 24 1HG DGL 24 4.242 4.985 4.309
201 HG3 DGL 24 2HG DGL 24 2.819 5.954 4.670
202 H SER 25 H SER 25 3.011 6.803 2.190
203 HA SER 25 HA SER 25 2.062 9.505 1.715
204 HB2 SER 25 2HB SER 25 1.272 6.875 0.462
205 HB3 SER 25 1HB SER 25 0.783 8.479 -0.078
206 HG SER 25 HG SER 25 3.248 8.755 -0.112
207 H ASP 26 H ASP 26 -0.382 9.656 1.601
208 HA ASP 26 HA ASP 26 -1.845 7.912 3.478
209 HB2 ASP 26 2HB ASP 26 -3.081 9.865 4.315
210 HB3 ASP 26 1HB ASP 26 -1.361 10.129 4.564
Start of MODEL 8
1 H ASN 1 H ASN 1 -1.519 8.860 1.007
2 HA ASN 1 HA ASN 1 -3.999 9.612 0.068
3 HB2 ASN 1 2HB ASN 1 -1.949 7.821 -1.217
4 HB3 ASN 1 1HB ASN 1 -3.353 8.459 -2.059
5 HD21 ASN 1 1HD2 ASN 1 -3.436 10.657 -2.528
6 HD22 ASN 1 2HD2 ASN 1 -2.039 11.650 -2.494
7 HA PRO 2 HA PRO 2 -6.559 6.324 1.496
8 HB2 PRO 2 2HB PRO 2 -8.732 6.900 -0.125
9 HB3 PRO 2 1HB PRO 2 -8.391 7.657 1.432
10 HG2 PRO 2 2HG PRO 2 -7.815 8.645 -1.324
11 HG3 PRO 2 1HG PRO 2 -8.365 9.549 0.098
12 HD2 PRO 2 2HD PRO 2 -5.829 9.636 -0.731
13 HD3 PRO 2 1HD PRO 2 -6.233 9.664 0.999
14 H GLU 3 H GLU 3 -6.444 6.804 -2.054
15 HA GLU 3 HA GLU 3 -7.307 4.105 -2.405
16 HB2 GLU 3 2HB GLU 3 -6.445 6.111 -4.478
17 HB3 GLU 3 1HB GLU 3 -7.071 4.507 -4.827
18 HG2 GLU 3 2HG GLU 3 -8.536 6.747 -3.448
19 HG3 GLU 3 1HG GLU 3 -8.850 6.100 -5.058
20 H LEU 4 H LEU 4 -4.323 5.555 -2.003
21 HA LEU 4 HA LEU 4 -2.822 3.399 -3.165
22 HB2 LEU 4 2HB LEU 4 -2.157 5.683 -1.362
23 HB3 LEU 4 1HB LEU 4 -1.043 4.345 -1.396
24 HG LEU 4 HG LEU 4 -0.763 4.702 -3.853
25 HD11 LEU 4 1HD1 LEU 4 -2.377 7.196 -3.398
26 HD12 LEU 4 2HD1 LEU 4 -2.891 5.785 -4.315
27 HD13 LEU 4 3HD1 LEU 4 -1.527 6.753 -4.879
28 HD21 LEU 4 1HD2 LEU 4 -0.165 7.090 -2.118
29 HD22 LEU 4 2HD2 LEU 4 0.614 6.698 -3.651
30 HD23 LEU 4 3HD2 LEU 4 0.813 5.632 -2.260
31 H GLN 5 H GLN 5 -3.899 4.319 0.036
32 HA GLN 5 HA GLN 5 -2.945 1.996 1.343
33 HB2 GLN 5 2HB GLN 5 -5.157 3.886 2.154
34 HB3 GLN 5 1HB GLN 5 -4.355 2.735 3.216
35 HG2 GLN 5 2HG GLN 5 -2.237 3.914 2.909
36 HG3 GLN 5 1HG GLN 5 -3.027 5.056 1.828
37 HE21 GLN 5 1HE2 GLN 5 -5.459 5.115 3.528
38 HE22 GLN 5 2HE2 GLN 5 -5.018 6.064 4.892
39 H ARG 6 H ARG 6 -5.848 2.755 -0.408
40 HA ARG 6 HA ARG 6 -7.576 0.703 0.312
41 HB2 ARG 6 2HB ARG 6 -7.971 2.671 -1.217
42 HB3 ARG 6 1HB ARG 6 -7.180 1.744 -2.491
43 HG2 ARG 6 2HG ARG 6 -9.465 1.426 -2.824
44 HG3 ARG 6 1HG ARG 6 -8.946 -0.041 -1.980
45 HD2 ARG 6 2HD ARG 6 -10.993 0.803 -1.017
46 HD3 ARG 6 1HD ARG 6 -9.677 0.955 0.145
47 HE ARG 6 HE ARG 6 -10.005 3.318 -1.444
48 HH11 ARG 6 1HH1 ARG 6 -11.287 1.701 1.439
49 HH12 ARG 6 2HH1 ARG 6 -11.811 3.163 2.135
50 HH21 ARG 6 1HH2 ARG 6 -10.702 5.197 -0.532
51 HH22 ARG 6 2HH2 ARG 6 -11.468 5.221 1.016
52 H LYS 7 H LYS 7 -5.012 0.832 -2.108
53 HA LYS 7 HA LYS 7 -5.415 -1.815 -3.040
54 HB2 LYS 7 2HB LYS 7 -3.057 0.053 -3.347
55 HB3 LYS 7 1HB LYS 7 -3.154 -1.522 -4.122
56 HG2 LYS 7 2HG LYS 7 -5.088 0.755 -4.549
57 HG3 LYS 7 1HG LYS 7 -3.789 0.293 -5.653
58 HD2 LYS 7 2HD LYS 7 -4.811 -1.876 -6.006
59 HD3 LYS 7 1HD LYS 7 -6.050 -1.533 -4.810
60 HE2 LYS 7 2HE LYS 7 -6.807 0.354 -6.250
61 HE3 LYS 7 1HE LYS 7 -5.672 -0.211 -7.477
62 HZ1 LYS 7 1HZ LYS 7 -7.953 -1.082 -7.773
63 HZ2 LYS 7 2HZ LYS 7 -7.791 -1.895 -6.286
64 HZ3 LYS 7 3HZ LYS 7 -6.805 -2.298 -7.583
65 H CYS 8 H CYS 8 -3.537 -0.428 -0.513
66 HA CYS 8 HA CYS 8 -2.056 -2.764 0.091
67 HB2 CYS 8 2HB CYS 8 -2.879 -0.515 1.908
68 HB3 CYS 8 1HB CYS 8 -1.547 -1.643 2.171
69 H LYS 9 H LYS 9 -5.202 -1.533 0.936
70 HA LYS 9 HA LYS 9 -5.756 -3.408 2.980
71 HB2 LYS 9 2HB LYS 9 -6.941 -1.222 2.652
72 HB3 LYS 9 1HB LYS 9 -7.671 -1.882 1.204
73 HG2 LYS 9 2HG LYS 9 -8.844 -3.535 2.515
74 HG3 LYS 9 1HG LYS 9 -8.074 -2.944 3.989
75 HD2 LYS 9 2HD LYS 9 -9.116 -0.753 3.655
76 HD3 LYS 9 1HD LYS 9 -9.889 -1.346 2.185
77 HE2 LYS 9 2HE LYS 9 -11.444 -1.358 4.074
78 HE3 LYS 9 1HE LYS 9 -11.132 -2.991 3.493
79 HZ1 LYS 9 1HZ LYS 9 -9.787 -1.764 5.842
80 HZ2 LYS 9 2HZ LYS 9 -9.691 -3.384 5.373
81 HZ3 LYS 9 3HZ LYS 9 -11.127 -2.754 5.934
82 H GLU 10 H GLU 10 -6.208 -3.316 -0.494
83 HA GLU 10 HA GLU 10 -7.611 -5.789 -0.693
84 HB2 GLU 10 2HB GLU 10 -5.961 -4.332 -2.782
85 HB3 GLU 10 1HB GLU 10 -7.016 -5.697 -3.113
86 HG2 GLU 10 2HG GLU 10 -8.932 -4.350 -2.312
87 HG3 GLU 10 1HG GLU 10 -7.848 -2.975 -2.126
88 H LEU 11 H LEU 11 -4.209 -4.905 -1.087
89 HA LEU 11 HA LEU 11 -3.333 -7.553 -1.649
90 HB2 LEU 11 2HB LEU 11 -1.819 -5.100 -0.831
91 HB3 LEU 11 1HB LEU 11 -1.062 -6.600 -1.324
92 HG LEU 11 HG LEU 11 -2.792 -4.834 -3.057
93 HD11 LEU 11 1HD1 LEU 11 0.179 -5.326 -3.067
94 HD12 LEU 11 2HD1 LEU 11 -0.632 -3.843 -2.563
95 HD13 LEU 11 3HD1 LEU 11 -0.713 -4.365 -4.246
96 HD21 LEU 11 1HD2 LEU 11 -3.013 -7.177 -3.692
97 HD22 LEU 11 2HD2 LEU 11 -1.259 -7.351 -3.719
98 HD23 LEU 11 3HD2 LEU 11 -2.059 -6.304 -4.890
99 H DAS 12 H DAS 12 -3.578 -5.683 1.314
100 HA DAS 12 HA DAS 12 -3.050 -8.105 2.790
101 HB2 DAS 12 1HB DAS 12 -4.928 -6.697 3.502
102 HB3 DAS 12 2HB DAS 12 -3.835 -5.341 3.748
103 H THR 13 H THR 13 -1.008 -8.580 2.909
104 HA THR 13 HA THR 13 0.942 -6.472 3.581
105 HB THR 13 HB THR 13 1.378 -9.397 4.200
106 HG1 THR 13 1HG THR 13 -0.687 -8.713 5.029
107 HG21 THR 13 1HG2 THR 13 2.185 -6.841 5.608
108 HG22 THR 13 2HG2 THR 13 3.203 -7.751 4.497
109 HG23 THR 13 3HG2 THR 13 2.709 -8.472 6.031
110 H ARG 14 H ARG 14 -0.233 -8.175 1.157
111 HA ARG 14 HA ARG 14 2.125 -9.380 0.000
112 HB2 ARG 14 2HB ARG 14 -0.674 -8.956 -1.101
113 HB3 ARG 14 1HB ARG 14 0.580 -9.920 -1.869
114 HG2 ARG 14 2HG ARG 14 0.548 -11.506 -0.045
115 HG3 ARG 14 1HG ARG 14 -0.581 -10.496 0.853
116 HD2 ARG 14 2HD ARG 14 -1.167 -11.790 -1.816
117 HD3 ARG 14 1HD ARG 14 -1.671 -12.431 -0.254
118 HE ARG 14 HE ARG 14 -2.630 -9.877 -0.313
119 HH11 ARG 14 1HH1 ARG 14 -3.032 -12.739 -2.306
120 HH12 ARG 14 2HH1 ARG 14 -4.589 -12.358 -2.857
121 HH21 ARG 14 1HH2 ARG 14 -4.870 -9.287 -1.078
122 HH22 ARG 14 2HH2 ARG 14 -5.643 -10.338 -2.143
123 HA DPR 15 HA DPR 15 2.358 -6.191 -3.381
124 HB2 DPR 15 1HB DPR 15 5.198 -7.002 -3.398
125 HB3 DPR 15 2HB DPR 15 4.054 -6.946 -4.741
126 HG2 DPR 15 1HG DPR 15 4.889 -9.276 -3.724
127 HG3 DPR 15 2HG DPR 15 3.223 -9.061 -4.288
128 HD2 DPR 15 1HD DPR 15 4.296 -9.006 -1.491
129 HD3 DPR 15 2HD DPR 15 2.836 -9.808 -2.115
130 H DGL 16 H DGL 16 4.230 -6.808 -0.567
131 HA DGL 16 HA DGL 16 5.840 -4.503 -0.503
132 HB2 DGL 16 1HB DGL 16 6.280 -6.540 0.814
133 HB3 DGL 16 2HB DGL 16 4.852 -6.215 1.783
134 HG2 DGL 16 1HG DGL 16 5.857 -4.134 2.563
135 HG3 DGL 16 2HG DGL 16 7.302 -4.481 1.614
136 H DAL 17 H DAL 17 2.544 -5.100 0.334
137 HA DAL 17 HA DAL 17 2.035 -3.086 2.194
138 HB1 DAL 17 1HB DAL 17 -0.299 -3.288 1.541
139 HB2 DAL 17 2HB DAL 17 0.454 -4.879 1.656
140 HB3 DAL 17 3HB DAL 17 0.174 -4.148 0.076
141 H DGL 18 H DGL 18 1.732 -3.010 -1.341
142 HA DGL 18 HA DGL 18 0.835 -0.373 -1.636
143 HB2 DGL 18 1HB DGL 18 0.811 -2.084 -3.428
144 HB3 DGL 18 2HB DGL 18 2.563 -2.012 -3.509
145 HG2 DGL 18 1HG DGL 18 2.379 0.380 -4.163
146 HG3 DGL 18 2HG DGL 18 0.631 0.172 -4.228
147 H DAR 19 H DAR 19 4.007 -1.752 -1.499
148 HA DAR 19 HA DAR 19 5.575 0.508 -2.083
149 HB2 DAR 19 1HB DAR 19 6.431 -1.811 -2.130
150 HB3 DAR 19 2HB DAR 19 6.238 -1.920 -0.393
151 HG2 DAR 19 1HG DAR 19 8.537 -1.586 -0.831
152 HG3 DAR 19 2HG DAR 19 7.902 -0.091 -0.150
153 HD2 DAR 19 1HD DAR 19 7.717 0.834 -2.452
154 HD3 DAR 19 2HD DAR 19 8.482 -0.635 -3.058
155 HE DAR 19 HE DAR 19 9.927 0.702 -0.975
156 HH11 DAR 19 1HH2 DAR 19 11.985 1.666 -1.444
157 HH12 DAR 19 2HH2 DAR 19 12.495 1.873 -3.055
158 HH21 DAR 19 1HH1 DAR 19 9.564 0.466 -4.522
159 HH22 DAR 19 2HH1 DAR 19 11.077 1.166 -4.831
160 H DLY 20 H DLY 20 4.467 -0.867 0.982
161 HA DLY 20 HA DLY 20 5.737 0.994 2.694
162 HB2 DLY 20 1HB DLY 20 3.273 -0.688 3.174
163 HB3 DLY 20 2HB DLY 20 4.126 0.203 4.420
164 HG2 DLY 20 1HG DLY 20 5.285 -2.035 2.786
165 HG3 DLY 20 2HG DLY 20 4.681 -2.187 4.433
166 HD2 DLY 20 1HD DLY 20 6.377 -0.516 5.158
167 HD3 DLY 20 2HD DLY 20 7.007 -0.501 3.513
168 HE2 DLY 20 1HE DLY 20 8.356 -1.960 4.897
169 HE3 DLY 20 2HE DLY 20 7.504 -2.898 3.678
170 HZ1 DLY 20 1HZ DLY 20 6.758 -2.681 6.550
171 HZ2 DLY 20 2HZ DLY 20 7.410 -4.017 5.764
172 HZ3 DLY 20 3HZ DLY 20 5.863 -3.518 5.389
173 H DCY 21 H DCY 21 2.496 0.920 1.295
174 HA DCY 21 HA DCY 21 1.591 3.245 2.599
175 HB2 DCY 21 1HB DCY 21 0.757 2.000 0.008
176 HB3 DCY 21 2HB DCY 21 -0.099 3.359 0.741
177 H DAR 22 H DAR 22 3.062 2.805 -0.607
178 HA DAR 22 HA DAR 22 2.959 5.542 -1.292
179 HB2 DAR 22 1HB DAR 22 4.681 3.301 -2.344
180 HB3 DAR 22 2HB DAR 22 4.734 4.932 -3.000
181 HG2 DAR 22 1HG DAR 22 2.366 4.771 -3.592
182 HG3 DAR 22 2HG DAR 22 2.314 3.134 -2.939
183 HD2 DAR 22 1HD DAR 22 3.874 2.360 -4.591
184 HD3 DAR 22 2HD DAR 22 4.136 4.001 -5.174
185 HE DAR 22 HE DAR 22 1.418 3.443 -5.373
186 HH11 DAR 22 1HH1 DAR 22 4.435 2.405 -6.887
187 HH12 DAR 22 2HH1 DAR 22 3.721 1.964 -8.365
188 HH21 DAR 22 1HH2 DAR 22 0.421 2.884 -7.449
189 HH22 DAR 22 2HH2 DAR 22 1.390 2.232 -8.683
190 H DGL 23 H DGL 23 5.220 3.677 0.531
191 HA DGL 23 HA DGL 23 7.489 5.245 0.608
192 HB2 DGL 23 1HB DGL 23 7.284 3.005 1.577
193 HB3 DGL 23 2HB DGL 23 6.168 3.602 2.782
194 HG2 DGL 23 1HG DGL 23 7.918 4.898 3.831
195 HG3 DGL 23 2HG DGL 23 9.062 4.361 2.596
196 H DGL 24 H DGL 24 4.643 5.443 2.677
197 HA DGL 24 HA DGL 24 5.660 7.925 3.821
198 HB2 DGL 24 1HB DGL 24 3.350 6.171 4.623
199 HB3 DGL 24 2HB DGL 24 3.821 7.646 5.457
200 HG2 DGL 24 1HG DGL 24 5.953 6.690 6.034
201 HG3 DGL 24 2HG DGL 24 5.602 5.250 5.080
202 H SER 25 H SER 25 2.592 6.724 2.429
203 HA SER 25 HA SER 25 1.897 9.502 1.835
204 HB2 SER 25 2HB SER 25 1.243 7.033 0.196
205 HB3 SER 25 1HB SER 25 0.807 8.695 -0.204
206 HG SER 25 HG SER 25 3.454 7.698 0.064
207 H ASP 26 H ASP 26 -0.188 10.064 2.385
208 HA ASP 26 HA ASP 26 -1.635 8.163 4.084
209 HB2 ASP 26 2HB ASP 26 -1.037 10.411 4.974
210 HB3 ASP 26 1HB ASP 26 -1.960 11.161 3.686
Start of MODEL 9
1 H ASN 1 H ASN 1 -1.625 8.194 0.687
2 HA ASN 1 HA ASN 1 -3.977 9.580 -0.275
3 HB2 ASN 1 2HB ASN 1 -2.351 7.423 -1.625
4 HB3 ASN 1 1HB ASN 1 -3.637 8.366 -2.364
5 HD21 ASN 1 1HD2 ASN 1 -3.263 10.610 -2.742
6 HD22 ASN 1 2HD2 ASN 1 -1.658 11.205 -2.867
7 HA PRO 2 HA PRO 2 -6.703 6.432 1.401
8 HB2 PRO 2 2HB PRO 2 -8.498 7.605 -0.657
9 HB3 PRO 2 1HB PRO 2 -8.797 7.326 1.064
10 HG2 PRO 2 2HG PRO 2 -8.346 9.781 0.187
11 HG3 PRO 2 1HG PRO 2 -7.626 9.228 1.708
12 HD2 PRO 2 2HD PRO 2 -6.353 9.549 -0.979
13 HD3 PRO 2 1HD PRO 2 -5.714 9.920 0.639
14 H GLU 3 H GLU 3 -6.134 7.068 -1.965
15 HA GLU 3 HA GLU 3 -7.181 4.858 -3.274
16 HB2 GLU 3 2HB GLU 3 -6.112 6.812 -4.357
17 HB3 GLU 3 1HB GLU 3 -4.557 6.275 -3.751
18 HG2 GLU 3 2HG GLU 3 -4.863 5.787 -6.115
19 HG3 GLU 3 1HG GLU 3 -4.668 4.320 -5.154
20 H LEU 4 H LEU 4 -3.928 5.293 -1.944
21 HA LEU 4 HA LEU 4 -3.081 2.635 -2.326
22 HB2 LEU 4 2HB LEU 4 -2.074 4.806 -0.510
23 HB3 LEU 4 1HB LEU 4 -1.257 3.284 -0.772
24 HG LEU 4 HG LEU 4 -1.764 5.384 -2.879
25 HD11 LEU 4 1HD1 LEU 4 0.664 5.731 -2.754
26 HD12 LEU 4 2HD1 LEU 4 0.740 4.599 -1.403
27 HD13 LEU 4 3HD1 LEU 4 -0.165 6.107 -1.245
28 HD21 LEU 4 1HD2 LEU 4 -0.242 4.028 -4.256
29 HD22 LEU 4 2HD2 LEU 4 -1.706 3.144 -3.841
30 HD23 LEU 4 3HD2 LEU 4 -0.198 2.800 -2.990
31 H GLN 5 H GLN 5 -4.460 4.396 0.369
32 HA GLN 5 HA GLN 5 -4.112 2.436 2.319
33 HB2 GLN 5 2HB GLN 5 -6.281 4.521 2.130
34 HB3 GLN 5 1HB GLN 5 -5.901 3.594 3.574
35 HG2 GLN 5 2HG GLN 5 -4.026 5.483 2.156
36 HG3 GLN 5 1HG GLN 5 -4.887 5.819 3.655
37 HE21 GLN 5 1HE2 GLN 5 -4.159 4.898 5.558
38 HE22 GLN 5 2HE2 GLN 5 -2.622 4.120 5.669
39 H ARG 6 H ARG 6 -6.720 2.804 -0.027
40 HA ARG 6 HA ARG 6 -8.143 0.537 0.998
41 HB2 ARG 6 2HB ARG 6 -9.457 2.092 -0.257
42 HB3 ARG 6 1HB ARG 6 -8.372 1.995 -1.646
43 HG2 ARG 6 2HG ARG 6 -8.972 -0.402 -1.882
44 HG3 ARG 6 1HG ARG 6 -10.141 -0.202 -0.588
45 HD2 ARG 6 2HD ARG 6 -11.500 1.195 -1.914
46 HD3 ARG 6 1HD ARG 6 -10.219 1.426 -3.112
47 HE ARG 6 HE ARG 6 -10.495 -1.202 -3.148
48 HH11 ARG 6 1HH1 ARG 6 -13.011 1.302 -3.394
49 HH12 ARG 6 2HH1 ARG 6 -14.012 0.365 -4.404
50 HH21 ARG 6 1HH2 ARG 6 -11.894 -2.453 -4.475
51 HH22 ARG 6 2HH2 ARG 6 -13.366 -1.798 -5.048
52 H LYS 7 H LYS 7 -5.951 1.083 -1.730
53 HA LYS 7 HA LYS 7 -6.187 -1.512 -2.749
54 HB2 LYS 7 2HB LYS 7 -3.991 0.513 -3.137
55 HB3 LYS 7 1HB LYS 7 -4.102 -0.999 -4.030
56 HG2 LYS 7 2HG LYS 7 -6.206 1.164 -4.031
57 HG3 LYS 7 1HG LYS 7 -4.995 0.917 -5.288
58 HD2 LYS 7 2HD LYS 7 -5.912 -1.281 -5.782
59 HD3 LYS 7 1HD LYS 7 -7.061 -1.129 -4.460
60 HE2 LYS 7 2HE LYS 7 -8.063 -0.693 -6.680
61 HE3 LYS 7 1HE LYS 7 -8.204 0.665 -5.570
62 HZ1 LYS 7 1HZ LYS 7 -6.542 1.824 -6.700
63 HZ2 LYS 7 2HZ LYS 7 -7.545 1.225 -7.895
64 HZ3 LYS 7 3HZ LYS 7 -6.050 0.486 -7.609
65 H CYS 8 H CYS 8 -3.845 -0.214 -0.457
66 HA CYS 8 HA CYS 8 -2.346 -2.590 -0.251
67 HB2 CYS 8 2HB CYS 8 -2.763 -0.358 1.744
68 HB3 CYS 8 1HB CYS 8 -1.546 -1.618 1.911
69 H LYS 9 H LYS 9 -5.335 -1.548 1.175
70 HA LYS 9 HA LYS 9 -5.480 -3.488 3.231
71 HB2 LYS 9 2HB LYS 9 -6.824 -1.431 3.258
72 HB3 LYS 9 1HB LYS 9 -7.652 -1.939 1.801
73 HG2 LYS 9 2HG LYS 9 -9.057 -2.252 3.739
74 HG3 LYS 9 1HG LYS 9 -8.645 -3.808 3.022
75 HD2 LYS 9 2HD LYS 9 -6.964 -4.185 4.727
76 HD3 LYS 9 1HD LYS 9 -7.260 -2.585 5.406
77 HE2 LYS 9 2HE LYS 9 -9.280 -4.820 5.251
78 HE3 LYS 9 1HE LYS 9 -8.370 -4.361 6.691
79 HZ1 LYS 9 1HZ LYS 9 -10.315 -2.639 5.239
80 HZ2 LYS 9 2HZ LYS 9 -9.400 -2.176 6.581
81 HZ3 LYS 9 3HZ LYS 9 -10.554 -3.387 6.736
82 H GLU 10 H GLU 10 -6.659 -3.328 -0.094
83 HA GLU 10 HA GLU 10 -7.835 -5.940 -0.003
84 HB2 GLU 10 2HB GLU 10 -7.126 -4.218 -2.390
85 HB3 GLU 10 1HB GLU 10 -8.151 -5.648 -2.430
86 HG2 GLU 10 2HG GLU 10 -9.754 -4.535 -0.953
87 HG3 GLU 10 1HG GLU 10 -8.731 -3.103 -0.927
88 H LEU 11 H LEU 11 -4.765 -4.613 -0.978
89 HA LEU 11 HA LEU 11 -3.754 -6.922 -2.258
90 HB2 LEU 11 2HB LEU 11 -2.905 -4.650 -2.681
91 HB3 LEU 11 1HB LEU 11 -2.321 -4.583 -1.034
92 HG LEU 11 HG LEU 11 -0.636 -6.262 -1.501
93 HD11 LEU 11 1HD1 LEU 11 -0.291 -7.109 -3.772
94 HD12 LEU 11 2HD1 LEU 11 -1.769 -6.296 -4.295
95 HD13 LEU 11 3HD1 LEU 11 -1.852 -7.613 -3.126
96 HD21 LEU 11 1HD2 LEU 11 0.734 -4.973 -3.040
97 HD22 LEU 11 2HD2 LEU 11 -0.151 -3.889 -1.961
98 HD23 LEU 11 3HD2 LEU 11 -0.694 -4.121 -3.618
99 H DAS 12 H DAS 12 -3.829 -5.879 1.085
100 HA DAS 12 HA DAS 12 -2.846 -8.539 1.728
101 HB2 DAS 12 1HB DAS 12 -4.896 -7.932 2.869
102 HB3 DAS 12 2HB DAS 12 -4.139 -6.480 3.521
103 H THR 13 H THR 13 -0.983 -8.957 2.658
104 HA THR 13 HA THR 13 0.698 -6.648 3.275
105 HB THR 13 HB THR 13 0.192 -8.165 5.235
106 HG1 THR 13 1HG THR 13 2.940 -8.424 4.680
107 HG21 THR 13 1HG2 THR 13 0.095 -10.318 4.093
108 HG22 THR 13 2HG2 THR 13 1.326 -10.363 5.355
109 HG23 THR 13 3HG2 THR 13 1.799 -10.187 3.666
110 H ARG 14 H ARG 14 -0.040 -8.227 0.859
111 HA ARG 14 HA ARG 14 2.413 -9.453 -0.065
112 HB2 ARG 14 2HB ARG 14 -0.294 -8.954 -1.326
113 HB3 ARG 14 1HB ARG 14 1.032 -9.731 -2.175
114 HG2 ARG 14 2HG ARG 14 0.993 -11.597 -0.720
115 HG3 ARG 14 1HG ARG 14 -0.075 -10.771 0.414
116 HD2 ARG 14 2HD ARG 14 -0.826 -11.514 -2.409
117 HD3 ARG 14 1HD ARG 14 -1.212 -12.487 -0.987
118 HE ARG 14 HE ARG 14 -2.082 -9.702 -1.061
119 HH11 ARG 14 1HH1 ARG 14 -3.003 -13.098 -1.311
120 HH12 ARG 14 2HH1 ARG 14 -4.645 -12.832 -0.974
121 HH21 ARG 14 1HH2 ARG 14 -4.312 -9.312 -0.618
122 HH22 ARG 14 2HH2 ARG 14 -5.408 -10.615 -0.587
123 HA DPR 15 HA DPR 15 2.892 -6.035 -3.160
124 HB2 DPR 15 1HB DPR 15 5.675 -6.996 -3.303
125 HB3 DPR 15 2HB DPR 15 4.506 -6.775 -4.602
126 HG2 DPR 15 1HG DPR 15 5.249 -9.218 -3.784
127 HG3 DPR 15 2HG DPR 15 3.587 -8.877 -4.302
128 HD2 DPR 15 1HD DPR 15 4.701 -9.059 -1.523
129 HD3 DPR 15 2HD DPR 15 3.215 -9.780 -2.181
130 H DGL 16 H DGL 16 4.471 -6.868 -0.215
131 HA DGL 16 HA DGL 16 6.197 -4.710 0.233
132 HB2 DGL 16 1HB DGL 16 6.011 -6.579 1.853
133 HB3 DGL 16 2HB DGL 16 4.381 -6.066 2.255
134 HG2 DGL 16 1HG DGL 16 5.314 -3.916 3.060
135 HG3 DGL 16 2HG DGL 16 6.928 -4.541 2.765
136 H DAL 17 H DAL 17 2.743 -5.038 0.568
137 HA DAL 17 HA DAL 17 2.142 -2.811 2.077
138 HB1 DAL 17 1HB DAL 17 0.449 -4.096 -0.050
139 HB2 DAL 17 2HB DAL 17 -0.129 -3.021 1.220
140 HB3 DAL 17 3HB DAL 17 0.551 -4.595 1.638
141 H DGL 18 H DGL 18 2.343 -3.053 -1.465
142 HA DGL 18 HA DGL 18 1.469 -0.417 -1.881
143 HB2 DGL 18 1HB DGL 18 1.371 -2.069 -3.670
144 HB3 DGL 18 2HB DGL 18 3.126 -2.156 -3.708
145 HG2 DGL 18 1HG DGL 18 3.291 0.086 -4.508
146 HG3 DGL 18 2HG DGL 18 1.569 0.355 -4.265
147 H DAR 19 H DAR 19 4.696 -1.753 -1.563
148 HA DAR 19 HA DAR 19 6.123 0.672 -2.080
149 HB2 DAR 19 1HB DAR 19 6.937 -1.708 -0.412
150 HB3 DAR 19 2HB DAR 19 8.014 -0.418 -0.907
151 HG2 DAR 19 1HG DAR 19 7.666 -1.026 -3.247
152 HG3 DAR 19 2HG DAR 19 6.619 -2.354 -2.728
153 HD2 DAR 19 1HD DAR 19 9.507 -2.000 -1.928
154 HD3 DAR 19 2HD DAR 19 8.935 -3.074 -3.199
155 HE DAR 19 HE DAR 19 7.745 -4.316 -1.525
156 HH11 DAR 19 1HH2 DAR 19 8.203 -5.602 0.374
157 HH12 DAR 19 2HH2 DAR 19 9.390 -5.108 1.477
158 HH21 DAR 19 1HH1 DAR 19 10.310 -2.187 -0.327
159 HH22 DAR 19 2HH1 DAR 19 10.628 -3.111 1.063
160 H DLY 20 H DLY 20 4.947 -0.891 0.756
161 HA DLY 20 HA DLY 20 5.966 0.683 2.813
162 HB2 DLY 20 1HB DLY 20 4.779 -1.584 2.730
163 HB3 DLY 20 2HB DLY 20 3.286 -0.681 2.708
164 HG2 DLY 20 1HG DLY 20 3.615 0.140 4.887
165 HG3 DLY 20 2HG DLY 20 5.272 -0.495 4.933
166 HD2 DLY 20 1HD DLY 20 4.263 -2.771 4.498
167 HD3 DLY 20 2HD DLY 20 2.684 -2.045 4.754
168 HE2 DLY 20 1HE DLY 20 3.202 -1.514 7.005
169 HE3 DLY 20 2HE DLY 20 4.884 -2.002 6.788
170 HZ1 DLY 20 1HZ DLY 20 4.088 -4.248 6.295
171 HZ2 DLY 20 2HZ DLY 20 2.510 -3.785 6.645
172 HZ3 DLY 20 3HZ DLY 20 3.677 -3.779 7.860
173 H DCY 21 H DCY 21 2.891 0.830 1.041
174 HA DCY 21 HA DCY 21 1.963 3.186 2.277
175 HB2 DCY 21 1HB DCY 21 1.181 1.843 -0.295
176 HB3 DCY 21 2HB DCY 21 0.307 3.203 0.426
177 H DAR 22 H DAR 22 3.840 2.590 -0.672
178 HA DAR 22 HA DAR 22 3.713 5.226 -1.679
179 HB2 DAR 22 1HB DAR 22 5.787 3.061 -2.050
180 HB3 DAR 22 2HB DAR 22 5.891 4.616 -2.858
181 HG2 DAR 22 1HG DAR 22 3.589 2.694 -3.165
182 HG3 DAR 22 2HG DAR 22 4.947 2.824 -4.282
183 HD2 DAR 22 1HD DAR 22 2.999 5.039 -3.617
184 HD3 DAR 22 2HD DAR 22 3.015 4.078 -5.094
185 HE DAR 22 HE DAR 22 5.479 5.030 -5.093
186 HH11 DAR 22 1HH1 DAR 22 2.394 6.740 -4.646
187 HH12 DAR 22 2HH1 DAR 22 3.011 8.220 -5.197
188 HH21 DAR 22 1HH2 DAR 22 6.287 7.069 -5.819
189 HH22 DAR 22 2HH2 DAR 22 5.263 8.418 -5.891
190 H DGL 23 H DGL 23 5.758 3.733 0.699
191 HA DGL 23 HA DGL 23 7.592 5.871 0.990
192 HB2 DGL 23 1HB DGL 23 7.824 3.460 1.810
193 HB3 DGL 23 2HB DGL 23 6.738 3.904 3.111
194 HG2 DGL 23 1HG DGL 23 8.983 3.988 3.907
195 HG3 DGL 23 2HG DGL 23 8.329 5.624 3.837
196 H DGL 24 H DGL 24 4.606 4.966 2.654
197 HA DGL 24 HA DGL 24 4.685 7.124 4.520
198 HB2 DGL 24 1HB DGL 24 2.438 5.285 3.744
199 HB3 DGL 24 2HB DGL 24 2.368 6.436 5.066
200 HG2 DGL 24 1HG DGL 24 4.227 5.288 6.154
201 HG3 DGL 24 2HG DGL 24 4.244 4.112 4.836
202 H SER 25 H SER 25 2.671 6.519 1.650
203 HA SER 25 HA SER 25 2.243 9.365 1.393
204 HB2 SER 25 2HB SER 25 1.325 7.051 -0.322
205 HB3 SER 25 1HB SER 25 1.254 8.762 -0.769
206 HG SER 25 HG SER 25 3.671 7.615 0.010
207 H ASP 26 H ASP 26 0.189 10.278 1.731
208 HA ASP 26 HA ASP 26 -1.520 8.683 3.496
209 HB2 ASP 26 2HB ASP 26 -1.621 11.648 2.900
210 HB3 ASP 26 1HB ASP 26 -2.476 10.805 4.181
Start of MODEL 10
1 H ASN 1 H ASN 1 -2.049 7.600 0.748
2 HA ASN 1 HA ASN 1 -4.071 9.586 -0.003
3 HB2 ASN 1 2HB ASN 1 -2.541 7.582 -1.701
4 HB3 ASN 1 1HB ASN 1 -3.834 8.606 -2.298
5 HD21 ASN 1 1HD2 ASN 1 -3.421 10.776 -2.661
6 HD22 ASN 1 2HD2 ASN 1 -1.821 11.427 -2.652
7 HA PRO 2 HA PRO 2 -7.096 6.565 1.268
8 HB2 PRO 2 2HB PRO 2 -8.466 7.653 -1.157
9 HB3 PRO 2 1HB PRO 2 -9.117 7.350 0.456
10 HG2 PRO 2 2HG PRO 2 -8.476 9.819 -0.275
11 HG3 PRO 2 1HG PRO 2 -8.128 9.242 1.364
12 HD2 PRO 2 2HD PRO 2 -6.274 9.727 -0.904
13 HD3 PRO 2 1HD PRO 2 -5.993 9.852 0.842
14 H GLU 3 H GLU 3 -6.546 6.859 -2.248
15 HA GLU 3 HA GLU 3 -7.457 4.311 -2.972
16 HB2 GLU 3 2HB GLU 3 -6.993 6.238 -4.513
17 HB3 GLU 3 1HB GLU 3 -5.281 5.882 -4.338
18 HG2 GLU 3 2HG GLU 3 -5.987 4.914 -6.370
19 HG3 GLU 3 1HG GLU 3 -5.757 3.594 -5.228
20 H LEU 4 H LEU 4 -4.189 5.429 -2.058
21 HA LEU 4 HA LEU 4 -2.933 2.955 -2.558
22 HB2 LEU 4 2HB LEU 4 -2.108 5.307 -0.878
23 HB3 LEU 4 1HB LEU 4 -1.113 3.888 -1.103
24 HG LEU 4 HG LEU 4 -1.982 5.798 -3.275
25 HD11 LEU 4 1HD1 LEU 4 -0.309 6.748 -1.787
26 HD12 LEU 4 2HD1 LEU 4 0.396 6.372 -3.362
27 HD13 LEU 4 3HD1 LEU 4 0.698 5.315 -1.987
28 HD21 LEU 4 1HD2 LEU 4 -0.211 3.351 -3.384
29 HD22 LEU 4 2HD2 LEU 4 -0.402 4.518 -4.683
30 HD23 LEU 4 3HD2 LEU 4 -1.780 3.546 -4.175
31 H GLN 5 H GLN 5 -4.377 4.400 0.297
32 HA GLN 5 HA GLN 5 -3.555 2.330 2.039
33 HB2 GLN 5 2HB GLN 5 -5.933 4.185 2.301
34 HB3 GLN 5 1HB GLN 5 -5.279 3.191 3.598
35 HG2 GLN 5 2HG GLN 5 -3.132 4.410 3.396
36 HG3 GLN 5 1HG GLN 5 -3.868 5.444 2.180
37 HE21 GLN 5 1HE2 GLN 5 -6.446 5.469 3.672
38 HE22 GLN 5 2HE2 GLN 5 -6.177 6.536 4.998
39 H ARG 6 H ARG 6 -6.383 2.773 0.022
40 HA ARG 6 HA ARG 6 -7.726 0.398 0.741
41 HB2 ARG 6 2HB ARG 6 -8.899 2.065 -0.557
42 HB3 ARG 6 1HB ARG 6 -7.722 1.941 -1.858
43 HG2 ARG 6 2HG ARG 6 -8.407 -0.401 -2.216
44 HG3 ARG 6 1HG ARG 6 -9.649 -0.196 -0.987
45 HD2 ARG 6 2HD ARG 6 -10.781 1.421 -2.309
46 HD3 ARG 6 1HD ARG 6 -9.449 1.485 -3.469
47 HE ARG 6 HE ARG 6 -10.032 -1.053 -3.609
48 HH11 ARG 6 1HH1 ARG 6 -12.301 1.661 -3.554
49 HH12 ARG 6 2HH1 ARG 6 -13.469 0.887 -4.529
50 HH21 ARG 6 1HH2 ARG 6 -11.597 -2.091 -4.930
51 HH22 ARG 6 2HH2 ARG 6 -13.064 -1.340 -5.318
52 H LYS 7 H LYS 7 -5.265 1.101 -1.661
53 HA LYS 7 HA LYS 7 -5.123 -1.324 -3.038
54 HB2 LYS 7 2HB LYS 7 -3.911 0.731 -3.698
55 HB3 LYS 7 1HB LYS 7 -2.872 0.563 -2.297
56 HG2 LYS 7 2HG LYS 7 -1.648 -0.175 -4.187
57 HG3 LYS 7 1HG LYS 7 -2.079 -1.610 -3.257
58 HD2 LYS 7 2HD LYS 7 -3.939 -2.042 -4.790
59 HD3 LYS 7 1HD LYS 7 -3.508 -0.602 -5.718
60 HE2 LYS 7 2HE LYS 7 -1.271 -1.615 -6.121
61 HE3 LYS 7 1HE LYS 7 -1.832 -3.068 -5.311
62 HZ1 LYS 7 1HZ LYS 7 -3.561 -3.285 -7.009
63 HZ2 LYS 7 2HZ LYS 7 -2.030 -3.306 -7.675
64 HZ3 LYS 7 3HZ LYS 7 -2.971 -1.912 -7.791
65 H CYS 8 H CYS 8 -3.381 -0.253 -0.186
66 HA CYS 8 HA CYS 8 -2.034 -2.679 0.234
67 HB2 CYS 8 2HB CYS 8 -2.616 -0.425 2.138
68 HB3 CYS 8 1HB CYS 8 -1.381 -1.674 2.357
69 H LYS 9 H LYS 9 -5.131 -1.480 1.285
70 HA LYS 9 HA LYS 9 -5.557 -3.493 3.235
71 HB2 LYS 9 2HB LYS 9 -6.752 -1.336 3.191
72 HB3 LYS 9 1HB LYS 9 -7.562 -1.824 1.711
73 HG2 LYS 9 2HG LYS 9 -8.639 -3.663 2.903
74 HG3 LYS 9 1HG LYS 9 -7.830 -3.176 4.390
75 HD2 LYS 9 2HD LYS 9 -9.764 -1.474 2.813
76 HD3 LYS 9 1HD LYS 9 -10.144 -2.384 4.276
77 HE2 LYS 9 2HE LYS 9 -8.518 -1.038 5.529
78 HE3 LYS 9 1HE LYS 9 -8.148 -0.126 4.067
79 HZ1 LYS 9 1HZ LYS 9 -10.813 -0.246 5.359
80 HZ2 LYS 9 2HZ LYS 9 -10.372 0.691 4.006
81 HZ3 LYS 9 3HZ LYS 9 -9.703 1.021 5.503
82 H GLU 10 H GLU 10 -6.265 -3.198 -0.201
83 HA GLU 10 HA GLU 10 -7.678 -5.678 -0.276
84 HB2 GLU 10 2HB GLU 10 -6.615 -3.976 -2.526
85 HB3 GLU 10 1HB GLU 10 -7.592 -5.417 -2.760
86 HG2 GLU 10 2HG GLU 10 -9.345 -4.296 -1.320
87 HG3 GLU 10 1HG GLU 10 -8.388 -2.826 -1.471
88 H LEU 11 H LEU 11 -4.386 -4.715 -0.984
89 HA LEU 11 HA LEU 11 -3.617 -7.328 -1.909
90 HB2 LEU 11 2HB LEU 11 -2.145 -4.797 -1.329
91 HB3 LEU 11 1HB LEU 11 -1.233 -6.284 -1.398
92 HG LEU 11 HG LEU 11 -1.151 -5.009 -3.503
93 HD11 LEU 11 1HD1 LEU 11 -1.664 -6.845 -5.014
94 HD12 LEU 11 2HD1 LEU 11 -2.558 -7.658 -3.730
95 HD13 LEU 11 3HD1 LEU 11 -0.820 -7.382 -3.565
96 HD21 LEU 11 1HD2 LEU 11 -3.118 -4.900 -4.955
97 HD22 LEU 11 2HD2 LEU 11 -3.357 -4.004 -3.457
98 HD23 LEU 11 3HD2 LEU 11 -4.108 -5.589 -3.665
99 H DAS 12 H DAS 12 -3.837 -5.790 1.155
100 HA DAS 12 HA DAS 12 -3.094 -8.293 2.389
101 HB2 DAS 12 1HB DAS 12 -5.140 -7.212 3.153
102 HB3 DAS 12 2HB DAS 12 -4.259 -5.745 3.538
103 H THR 13 H THR 13 -1.043 -8.548 2.496
104 HA THR 13 HA THR 13 0.665 -6.283 3.254
105 HB THR 13 HB THR 13 1.187 -9.207 3.938
106 HG1 THR 13 1HG THR 13 -0.158 -7.130 5.306
107 HG21 THR 13 1HG2 THR 13 2.367 -6.629 5.022
108 HG22 THR 13 2HG2 THR 13 3.184 -7.739 3.922
109 HG23 THR 13 3HG2 THR 13 2.784 -8.256 5.560
110 H ARG 14 H ARG 14 -0.253 -8.288 0.816
111 HA ARG 14 HA ARG 14 2.199 -9.127 -0.350
112 HB2 ARG 14 2HB ARG 14 -0.557 -8.747 -1.541
113 HB3 ARG 14 1HB ARG 14 0.791 -9.456 -2.419
114 HG2 ARG 14 2HG ARG 14 0.898 -11.285 -0.843
115 HG3 ARG 14 1HG ARG 14 -0.367 -10.544 0.135
116 HD2 ARG 14 2HD ARG 14 -1.953 -10.798 -1.692
117 HD3 ARG 14 1HD ARG 14 -0.689 -11.484 -2.715
118 HE ARG 14 HE ARG 14 -0.552 -13.165 -0.767
119 HH11 ARG 14 1HH1 ARG 14 -3.523 -11.829 -2.151
120 HH12 ARG 14 2HH1 ARG 14 -4.496 -13.171 -1.760
121 HH21 ARG 14 1HH2 ARG 14 -1.895 -15.029 -0.239
122 HH22 ARG 14 2HH2 ARG 14 -3.540 -15.026 -0.646
123 HA DPR 15 HA DPR 15 2.666 -5.652 -3.345
124 HB2 DPR 15 1HB DPR 15 5.445 -6.529 -3.531
125 HB3 DPR 15 2HB DPR 15 4.234 -6.436 -4.808
126 HG2 DPR 15 1HG DPR 15 5.175 -8.796 -3.861
127 HG3 DPR 15 2HG DPR 15 3.525 -8.601 -4.475
128 HD2 DPR 15 1HD DPR 15 4.498 -8.642 -1.645
129 HD3 DPR 15 2HD DPR 15 3.073 -9.434 -2.355
130 H DGL 16 H DGL 16 4.287 -6.676 -0.492
131 HA DGL 16 HA DGL 16 5.993 -4.437 -0.086
132 HB2 DGL 16 1HB DGL 16 6.288 -6.609 1.085
133 HB3 DGL 16 2HB DGL 16 4.791 -6.327 1.957
134 HG2 DGL 16 1HG DGL 16 6.614 -5.830 3.410
135 HG3 DGL 16 2HG DGL 16 5.806 -4.324 2.988
136 H DAL 17 H DAL 17 2.632 -5.049 0.315
137 HA DAL 17 HA DAL 17 1.953 -3.049 2.161
138 HB1 DAL 17 1HB DAL 17 0.413 -4.844 1.468
139 HB2 DAL 17 2HB DAL 17 0.301 -4.109 -0.131
140 HB3 DAL 17 3HB DAL 17 -0.298 -3.241 1.286
141 H DGL 18 H DGL 18 1.765 -2.993 -1.412
142 HA DGL 18 HA DGL 18 1.135 -0.298 -1.666
143 HB2 DGL 18 1HB DGL 18 0.999 -1.950 -3.507
144 HB3 DGL 18 2HB DGL 18 2.755 -1.973 -3.588
145 HG2 DGL 18 1HG DGL 18 2.722 0.437 -4.139
146 HG3 DGL 18 2HG DGL 18 0.962 0.380 -4.163
147 H DAR 19 H DAR 19 4.253 -1.893 -1.547
148 HA DAR 19 HA DAR 19 5.949 0.274 -1.985
149 HB2 DAR 19 1HB DAR 19 6.251 -2.247 -0.399
150 HB3 DAR 19 2HB DAR 19 7.522 -1.036 -0.403
151 HG2 DAR 19 1HG DAR 19 6.439 -2.347 -2.885
152 HG3 DAR 19 2HG DAR 19 7.889 -2.870 -2.022
153 HD2 DAR 19 1HD DAR 19 7.425 -0.185 -3.343
154 HD3 DAR 19 2HD DAR 19 8.547 -1.449 -3.849
155 HE DAR 19 HE DAR 19 9.425 -1.009 -1.422
156 HH11 DAR 19 1HH2 DAR 19 10.762 0.696 -0.544
157 HH12 DAR 19 2HH2 DAR 19 10.883 2.194 -1.331
158 HH21 DAR 19 1HH1 DAR 19 8.669 1.349 -3.963
159 HH22 DAR 19 2HH1 DAR 19 9.629 2.596 -3.296
160 H DLY 20 H DLY 20 4.773 -0.976 1.134
161 HA DLY 20 HA DLY 20 5.997 0.985 2.694
162 HB2 DLY 20 1HB DLY 20 5.005 -1.150 3.578
163 HB3 DLY 20 2HB DLY 20 3.413 -0.438 3.351
164 HG2 DLY 20 1HG DLY 20 4.015 1.368 4.906
165 HG3 DLY 20 2HG DLY 20 5.589 0.611 5.146
166 HD2 DLY 20 1HD DLY 20 4.467 -1.407 5.986
167 HD3 DLY 20 2HD DLY 20 2.918 -0.575 5.849
168 HE2 DLY 20 1HE DLY 20 5.252 0.270 7.574
169 HE3 DLY 20 2HE DLY 20 3.763 -0.477 8.144
170 HZ1 DLY 20 1HZ DLY 20 3.962 2.234 6.909
171 HZ2 DLY 20 2HZ DLY 20 3.710 1.854 8.508
172 HZ3 DLY 20 3HZ DLY 20 2.537 1.447 7.373
173 H DCY 21 H DCY 21 2.766 0.852 1.240
174 HA DCY 21 HA DCY 21 1.935 3.317 2.301
175 HB2 DCY 21 1HB DCY 21 0.979 1.843 -0.125
176 HB3 DCY 21 2HB DCY 21 0.173 3.260 0.557
177 H DAR 22 H DAR 22 3.845 2.581 -0.550
178 HA DAR 22 HA DAR 22 3.671 5.173 -1.716
179 HB2 DAR 22 1HB DAR 22 5.947 3.185 -1.844
180 HB3 DAR 22 2HB DAR 22 5.829 4.641 -2.813
181 HG2 DAR 22 1HG DAR 22 3.842 3.774 -3.915
182 HG3 DAR 22 2HG DAR 22 3.982 2.286 -2.967
183 HD2 DAR 22 1HD DAR 22 6.232 1.938 -3.899
184 HD3 DAR 22 2HD DAR 22 6.047 3.404 -4.855
185 HE DAR 22 HE DAR 22 4.185 1.180 -5.206
186 HH11 DAR 22 1HH1 DAR 22 6.693 3.316 -6.566
187 HH12 DAR 22 2HH1 DAR 22 6.449 2.752 -8.151
188 HH21 DAR 22 1HH2 DAR 22 3.931 0.441 -7.348
189 HH22 DAR 22 2HH2 DAR 22 4.867 1.122 -8.631
190 H DGL 23 H DGL 23 5.730 3.690 0.689
191 HA DGL 23 HA DGL 23 7.316 6.019 1.071
192 HB2 DGL 23 1HB DGL 23 6.917 3.645 2.886
193 HB3 DGL 23 2HB DGL 23 8.143 4.890 3.098
194 HG2 DGL 23 1HG DGL 23 7.903 2.934 0.824
195 HG3 DGL 23 2HG DGL 23 9.145 2.972 2.075
196 H DGL 24 H DGL 24 4.445 4.751 2.632
197 HA DGL 24 HA DGL 24 4.168 6.629 4.711
198 HB2 DGL 24 1HB DGL 24 1.985 5.303 3.090
199 HB3 DGL 24 2HB DGL 24 1.750 6.116 4.617
200 HG2 DGL 24 1HG DGL 24 3.337 3.610 4.207
201 HG3 DGL 24 2HG DGL 24 1.711 3.716 4.875
202 H SER 25 H SER 25 2.702 6.527 1.516
203 HA SER 25 HA SER 25 2.283 9.396 1.583
204 HB2 SER 25 2HB SER 25 3.421 8.337 -0.422
205 HB3 SER 25 1HB SER 25 1.962 7.386 -0.685
206 HG SER 25 HG SER 25 0.827 9.328 -1.006
207 H ASP 26 H ASP 26 0.481 9.603 2.812
208 HA ASP 26 HA ASP 26 -1.499 7.569 2.764
209 HB2 ASP 26 2HB ASP 26 -2.711 8.904 4.501
210 HB3 ASP 26 1HB ASP 26 -1.077 8.440 4.940
Start of MODEL 11
1 H ASN 1 H ASN 1 -2.334 7.679 1.687
2 HA ASN 1 HA ASN 1 -4.200 9.612 0.533
3 HB2 ASN 1 2HB ASN 1 -2.270 9.451 -1.001
4 HB3 ASN 1 1HB ASN 1 -2.475 7.706 -1.064
5 HD21 ASN 1 1HD2 ASN 1 -3.767 10.759 -2.080
6 HD22 ASN 1 2HD2 ASN 1 -4.841 10.126 -3.274
7 HA PRO 2 HA PRO 2 -7.067 6.359 1.568
8 HB2 PRO 2 2HB PRO 2 -8.641 7.576 -0.646
9 HB3 PRO 2 1HB PRO 2 -9.134 7.227 1.016
10 HG2 PRO 2 2HG PRO 2 -8.628 9.707 0.294
11 HG3 PRO 2 1HG PRO 2 -8.040 9.108 1.857
12 HD2 PRO 2 2HD PRO 2 -6.546 9.516 -0.701
13 HD3 PRO 2 1HD PRO 2 -6.070 9.884 0.973
14 H GLU 3 H GLU 3 -6.404 7.006 -1.869
15 HA GLU 3 HA GLU 3 -7.461 4.532 -2.754
16 HB2 GLU 3 2HB GLU 3 -5.649 6.513 -4.119
17 HB3 GLU 3 1HB GLU 3 -6.324 5.095 -4.913
18 HG2 GLU 3 2HG GLU 3 -8.554 5.896 -4.577
19 HG3 GLU 3 1HG GLU 3 -7.958 7.240 -3.606
20 H LEU 4 H LEU 4 -4.190 5.673 -2.082
21 HA LEU 4 HA LEU 4 -2.930 3.247 -2.771
22 HB2 LEU 4 2HB LEU 4 -2.091 5.588 -1.094
23 HB3 LEU 4 1HB LEU 4 -1.112 4.148 -1.130
24 HG LEU 4 HG LEU 4 -0.852 4.431 -3.597
25 HD11 LEU 4 1HD1 LEU 4 -2.849 5.726 -4.070
26 HD12 LEU 4 2HD1 LEU 4 -1.392 6.538 -4.641
27 HD13 LEU 4 3HD1 LEU 4 -2.187 7.090 -3.168
28 HD21 LEU 4 1HD2 LEU 4 0.722 6.282 -3.467
29 HD22 LEU 4 2HD2 LEU 4 0.853 5.214 -2.068
30 HD23 LEU 4 3HD2 LEU 4 0.026 6.766 -1.921
31 H GLN 5 H GLN 5 -4.302 4.444 0.221
32 HA GLN 5 HA GLN 5 -3.459 2.291 1.804
33 HB2 GLN 5 2HB GLN 5 -5.623 4.332 2.115
34 HB3 GLN 5 1HB GLN 5 -5.425 3.031 3.283
35 HG2 GLN 5 2HG GLN 5 -3.259 4.965 2.513
36 HG3 GLN 5 1HG GLN 5 -4.294 5.128 3.936
37 HE21 GLN 5 1HE2 GLN 5 -4.052 3.697 5.618
38 HE22 GLN 5 2HE2 GLN 5 -2.663 2.700 5.816
39 H ARG 6 H ARG 6 -6.481 2.777 -0.005
40 HA ARG 6 HA ARG 6 -7.590 0.333 0.889
41 HB2 ARG 6 2HB ARG 6 -9.313 0.588 -0.763
42 HB3 ARG 6 1HB ARG 6 -8.952 2.174 -0.102
43 HG2 ARG 6 2HG ARG 6 -7.600 2.661 -2.077
44 HG3 ARG 6 1HG ARG 6 -8.026 1.085 -2.735
45 HD2 ARG 6 2HD ARG 6 -10.404 1.718 -2.639
46 HD3 ARG 6 1HD ARG 6 -9.929 3.324 -2.085
47 HE ARG 6 HE ARG 6 -8.778 2.380 -4.567
48 HH11 ARG 6 1HH1 ARG 6 -11.230 4.436 -3.029
49 HH12 ARG 6 2HH1 ARG 6 -11.556 5.334 -4.435
50 HH21 ARG 6 1HH2 ARG 6 -9.217 3.637 -6.481
51 HH22 ARG 6 2HH2 ARG 6 -10.395 4.858 -6.437
52 H LYS 7 H LYS 7 -5.417 1.124 -1.702
53 HA LYS 7 HA LYS 7 -5.430 -1.243 -3.188
54 HB2 LYS 7 2HB LYS 7 -4.079 0.522 -4.033
55 HB3 LYS 7 1HB LYS 7 -3.266 0.747 -2.497
56 HG2 LYS 7 2HG LYS 7 -1.696 -0.217 -4.028
57 HG3 LYS 7 1HG LYS 7 -2.120 -1.441 -2.842
58 HD2 LYS 7 2HD LYS 7 -2.063 -2.537 -4.938
59 HD3 LYS 7 1HD LYS 7 -3.770 -2.329 -4.551
60 HE2 LYS 7 2HE LYS 7 -3.284 -1.809 -6.900
61 HE3 LYS 7 1HE LYS 7 -3.888 -0.397 -6.031
62 HZ1 LYS 7 1HZ LYS 7 -0.986 -0.911 -6.434
63 HZ2 LYS 7 2HZ LYS 7 -1.726 0.531 -5.959
64 HZ3 LYS 7 3HZ LYS 7 -1.928 -0.047 -7.530
65 H CYS 8 H CYS 8 -3.634 -0.360 -0.302
66 HA CYS 8 HA CYS 8 -2.430 -2.895 -0.063
67 HB2 CYS 8 2HB CYS 8 -2.655 -0.634 1.887
68 HB3 CYS 8 1HB CYS 8 -1.590 -2.032 2.065
69 H LYS 9 H LYS 9 -5.363 -1.507 1.267
70 HA LYS 9 HA LYS 9 -5.738 -3.692 3.074
71 HB2 LYS 9 2HB LYS 9 -7.692 -1.650 2.010
72 HB3 LYS 9 1HB LYS 9 -8.126 -2.874 3.192
73 HG2 LYS 9 2HG LYS 9 -6.032 -0.734 3.573
74 HG3 LYS 9 1HG LYS 9 -7.668 -0.713 4.239
75 HD2 LYS 9 2HD LYS 9 -7.161 -2.786 5.487
76 HD3 LYS 9 1HD LYS 9 -5.522 -2.753 4.847
77 HE2 LYS 9 2HE LYS 9 -6.767 -0.640 6.600
78 HE3 LYS 9 1HE LYS 9 -5.643 -1.880 7.133
79 HZ1 LYS 9 1HZ LYS 9 -3.982 -0.905 5.596
80 HZ2 LYS 9 2HZ LYS 9 -4.456 0.123 6.805
81 HZ3 LYS 9 3HZ LYS 9 -5.068 0.352 5.246
82 H GLU 10 H GLU 10 -6.358 -3.212 -0.265
83 HA GLU 10 HA GLU 10 -8.107 -5.461 -0.585
84 HB2 GLU 10 2HB GLU 10 -8.078 -3.436 -2.043
85 HB3 GLU 10 1HB GLU 10 -6.482 -3.906 -2.598
86 HG2 GLU 10 2HG GLU 10 -8.118 -4.521 -4.219
87 HG3 GLU 10 1HG GLU 10 -7.437 -5.977 -3.482
88 H LEU 11 H LEU 11 -4.750 -4.668 -1.325
89 HA LEU 11 HA LEU 11 -4.045 -7.190 -2.411
90 HB2 LEU 11 2HB LEU 11 -2.978 -5.034 -2.974
91 HB3 LEU 11 1HB LEU 11 -2.307 -4.961 -1.364
92 HG LEU 11 HG LEU 11 -0.950 -6.959 -1.858
93 HD11 LEU 11 1HD1 LEU 11 -2.420 -7.980 -3.533
94 HD12 LEU 11 2HD1 LEU 11 -0.789 -7.765 -4.154
95 HD13 LEU 11 3HD1 LEU 11 -2.071 -6.657 -4.645
96 HD21 LEU 11 1HD2 LEU 11 -0.044 -4.716 -2.201
97 HD22 LEU 11 2HD2 LEU 11 -0.664 -4.716 -3.854
98 HD23 LEU 11 3HD2 LEU 11 0.596 -5.855 -3.383
99 H DAS 12 H DAS 12 -3.594 -5.683 0.762
100 HA DAS 12 HA DAS 12 -2.917 -8.303 1.865
101 HB2 DAS 12 1HB DAS 12 -5.045 -7.350 2.655
102 HB3 DAS 12 2HB DAS 12 -4.214 -5.883 3.141
103 H THR 13 H THR 13 -1.109 -8.452 3.183
104 HA THR 13 HA THR 13 0.558 -6.068 3.521
105 HB THR 13 HB THR 13 1.985 -7.640 4.874
106 HG1 THR 13 1HG THR 13 -0.080 -9.518 4.981
107 HG21 THR 13 1HG2 THR 13 -0.926 -7.524 5.692
108 HG22 THR 13 2HG2 THR 13 0.272 -6.262 5.980
109 HG23 THR 13 3HG2 THR 13 0.432 -7.828 6.776
110 H ARG 14 H ARG 14 -0.099 -8.051 1.207
111 HA ARG 14 HA ARG 14 2.337 -9.332 0.507
112 HB2 ARG 14 2HB ARG 14 -0.035 -8.733 -1.270
113 HB3 ARG 14 1HB ARG 14 1.218 -9.917 -1.564
114 HG2 ARG 14 2HG ARG 14 -0.867 -10.029 0.622
115 HG3 ARG 14 1HG ARG 14 -0.863 -10.974 -0.859
116 HD2 ARG 14 2HD ARG 14 -0.081 -12.437 0.815
117 HD3 ARG 14 1HD ARG 14 1.364 -11.923 -0.051
118 HE ARG 14 HE ARG 14 0.547 -10.653 2.468
119 HH11 ARG 14 1HH1 ARG 14 2.999 -12.466 0.606
120 HH12 ARG 14 2HH1 ARG 14 4.216 -12.215 1.744
121 HH21 ARG 14 1HH2 ARG 14 2.233 -10.368 4.035
122 HH22 ARG 14 2HH2 ARG 14 3.783 -11.033 3.745
123 HA DPR 15 HA DPR 15 3.550 -6.426 -2.856
124 HB2 DPR 15 1HB DPR 15 6.250 -7.416 -2.279
125 HB3 DPR 15 2HB DPR 15 5.351 -7.464 -3.798
126 HG2 DPR 15 1HG DPR 15 5.836 -9.702 -2.390
127 HG3 DPR 15 2HG DPR 15 4.317 -9.457 -3.275
128 HD2 DPR 15 1HD DPR 15 4.852 -9.111 -0.345
129 HD3 DPR 15 2HD DPR 15 3.503 -9.937 -1.158
130 H DGL 16 H DGL 16 4.565 -6.792 0.395
131 HA DGL 16 HA DGL 16 6.379 -4.589 0.487
132 HB2 DGL 16 1HB DGL 16 6.152 -6.569 2.132
133 HB3 DGL 16 2HB DGL 16 4.823 -5.660 2.834
134 HG2 DGL 16 1HG DGL 16 6.720 -5.173 4.139
135 HG3 DGL 16 2HG DGL 16 6.438 -3.752 3.135
136 H DAL 17 H DAL 17 2.972 -5.040 0.685
137 HA DAL 17 HA DAL 17 2.161 -2.720 2.031
138 HB1 DAL 17 1HB DAL 17 0.689 -4.620 1.632
139 HB2 DAL 17 2HB DAL 17 0.703 -4.265 -0.093
140 HB3 DAL 17 3HB DAL 17 -0.019 -3.119 1.033
141 H DGL 18 H DGL 18 2.285 -3.359 -1.478
142 HA DGL 18 HA DGL 18 1.482 -0.888 -2.445
143 HB2 DGL 18 1HB DGL 18 1.805 -2.880 -3.846
144 HB3 DGL 18 2HB DGL 18 3.539 -2.788 -3.599
145 HG2 DGL 18 1HG DGL 18 3.174 -1.922 -5.755
146 HG3 DGL 18 2HG DGL 18 3.468 -0.550 -4.678
147 H DAR 19 H DAR 19 4.664 -1.979 -1.529
148 HA DAR 19 HA DAR 19 6.125 0.363 -2.167
149 HB2 DAR 19 1HB DAR 19 7.394 -1.608 -1.772
150 HB3 DAR 19 2HB DAR 19 6.623 -1.875 -0.212
151 HG2 DAR 19 1HG DAR 19 7.695 0.317 0.516
152 HG3 DAR 19 2HG DAR 19 8.666 0.207 -0.953
153 HD2 DAR 19 1HD DAR 19 9.706 -1.755 -0.260
154 HD3 DAR 19 2HD DAR 19 8.498 -2.050 0.992
155 HE DAR 19 HE DAR 19 9.954 0.399 1.359
156 HH11 DAR 19 1HH2 DAR 19 11.464 0.522 3.070
157 HH12 DAR 19 2HH2 DAR 19 11.914 -0.890 3.941
158 HH21 DAR 19 1HH1 DAR 19 9.776 -3.050 2.116
159 HH22 DAR 19 2HH1 DAR 19 10.944 -2.955 3.364
160 H DLY 20 H DLY 20 4.962 -0.855 0.957
161 HA DLY 20 HA DLY 20 5.749 1.258 2.542
162 HB2 DLY 20 1HB DLY 20 5.074 -0.928 3.394
163 HB3 DLY 20 2HB DLY 20 3.418 -0.626 2.904
164 HG2 DLY 20 1HG DLY 20 3.236 1.178 4.526
165 HG3 DLY 20 2HG DLY 20 4.914 0.916 5.013
166 HD2 DLY 20 1HD DLY 20 4.387 -1.325 5.752
167 HD3 DLY 20 2HD DLY 20 2.731 -1.163 5.174
168 HE2 DLY 20 1HE DLY 20 2.366 0.662 6.781
169 HE3 DLY 20 2HE DLY 20 4.010 0.446 7.380
170 HZ1 DLY 20 1HZ DLY 20 2.337 -0.696 8.757
171 HZ2 DLY 20 2HZ DLY 20 3.452 -1.766 8.102
172 HZ3 DLY 20 3HZ DLY 20 1.918 -1.657 7.439
173 H DCY 21 H DCY 21 2.754 0.852 0.719
174 HA DCY 21 HA DCY 21 1.528 3.085 1.912
175 HB2 DCY 21 1HB DCY 21 0.914 1.480 -0.515
176 HB3 DCY 21 2HB DCY 21 -0.077 2.877 -0.054
177 H DAR 22 H DAR 22 3.557 2.812 -0.963
178 HA DAR 22 HA DAR 22 3.022 5.607 -1.578
179 HB2 DAR 22 1HB DAR 22 4.527 5.344 -3.480
180 HB3 DAR 22 2HB DAR 22 3.348 4.046 -3.463
181 HG2 DAR 22 1HG DAR 22 5.042 2.574 -2.437
182 HG3 DAR 22 2HG DAR 22 6.219 3.874 -2.605
183 HD2 DAR 22 1HD DAR 22 5.915 3.863 -5.015
184 HD3 DAR 22 2HD DAR 22 4.696 2.597 -4.854
185 HE DAR 22 HE DAR 22 7.461 2.226 -3.963
186 HH11 DAR 22 1HH1 DAR 22 4.728 1.179 -5.964
187 HH12 DAR 22 2HH1 DAR 22 5.432 -0.330 -6.356
188 HH21 DAR 22 1HH2 DAR 22 8.425 0.153 -4.576
189 HH22 DAR 22 2HH2 DAR 22 7.540 -0.924 -5.549
190 H DGL 23 H DGL 23 5.253 3.718 0.155
191 HA DGL 23 HA DGL 23 7.359 5.613 0.297
192 HB2 DGL 23 1HB DGL 23 7.506 3.111 0.725
193 HB3 DGL 23 2HB DGL 23 6.698 3.401 2.253
194 HG2 DGL 23 1HG DGL 23 8.538 4.769 3.015
195 HG3 DGL 23 2HG DGL 23 9.356 4.557 1.469
196 H DGL 24 H DGL 24 4.685 4.701 2.427
197 HA DGL 24 HA DGL 24 5.217 6.782 4.296
198 HB2 DGL 24 1HB DGL 24 2.890 4.909 3.961
199 HB3 DGL 24 2HB DGL 24 3.036 6.061 5.283
200 HG2 DGL 24 1HG DGL 24 5.017 3.884 4.679
201 HG3 DGL 24 2HG DGL 24 3.738 3.764 5.884
202 H SER 25 H SER 25 2.577 6.289 1.886
203 HA SER 25 HA SER 25 2.276 9.197 1.918
204 HB2 SER 25 2HB SER 25 1.359 7.191 -0.144
205 HB3 SER 25 1HB SER 25 1.213 8.946 -0.270
206 HG SER 25 HG SER 25 3.677 7.617 0.105
207 H ASP 26 H ASP 26 0.496 10.065 2.726
208 HA ASP 26 HA ASP 26 -1.595 8.330 3.719
209 HB2 ASP 26 2HB ASP 26 -1.176 11.316 4.030
210 HB3 ASP 26 1HB ASP 26 -2.557 10.452 4.687
Start of MODEL 12
1 H ASN 1 H ASN 1 -1.940 8.781 1.310
2 HA ASN 1 HA ASN 1 -4.523 9.900 1.122
3 HB2 ASN 1 2HB ASN 1 -2.846 8.667 -1.077
4 HB3 ASN 1 1HB ASN 1 -4.182 9.787 -1.298
5 HD21 ASN 1 1HD2 ASN 1 -3.854 11.984 -0.864
6 HD22 ASN 1 2HD2 ASN 1 -2.277 12.633 -0.636
7 HA PRO 2 HA PRO 2 -7.184 6.320 1.392
8 HB2 PRO 2 2HB PRO 2 -8.573 7.838 -0.787
9 HB3 PRO 2 1HB PRO 2 -9.261 7.044 0.636
10 HG2 PRO 2 2HG PRO 2 -8.924 9.669 0.632
11 HG3 PRO 2 1HG PRO 2 -8.549 8.721 2.082
12 HD2 PRO 2 2HD PRO 2 -6.705 10.004 0.134
13 HD3 PRO 2 1HD PRO 2 -6.493 9.703 1.869
14 H GLU 3 H GLU 3 -6.411 7.550 -1.845
15 HA GLU 3 HA GLU 3 -7.010 5.372 -3.441
16 HB2 GLU 3 2HB GLU 3 -6.304 7.605 -4.225
17 HB3 GLU 3 1HB GLU 3 -4.662 7.258 -3.710
18 HG2 GLU 3 2HG GLU 3 -4.831 6.986 -6.084
19 HG3 GLU 3 1HG GLU 3 -4.598 5.404 -5.342
20 H LEU 4 H LEU 4 -3.962 6.050 -1.724
21 HA LEU 4 HA LEU 4 -2.777 3.613 -2.628
22 HB2 LEU 4 2HB LEU 4 -1.865 5.775 -0.766
23 HB3 LEU 4 1HB LEU 4 -0.965 4.290 -0.930
24 HG LEU 4 HG LEU 4 0.117 5.866 -2.294
25 HD11 LEU 4 1HD1 LEU 4 -0.112 3.694 -3.322
26 HD12 LEU 4 2HD1 LEU 4 -0.060 4.982 -4.516
27 HD13 LEU 4 3HD1 LEU 4 -1.593 4.217 -4.130
28 HD21 LEU 4 1HD2 LEU 4 -1.002 7.191 -4.038
29 HD22 LEU 4 2HD2 LEU 4 -1.607 7.574 -2.428
30 HD23 LEU 4 3HD2 LEU 4 -2.560 6.554 -3.509
31 H GLN 5 H GLN 5 -4.180 4.807 0.329
32 HA GLN 5 HA GLN 5 -3.469 2.558 1.865
33 HB2 GLN 5 2HB GLN 5 -5.667 4.572 2.280
34 HB3 GLN 5 1HB GLN 5 -5.206 3.352 3.464
35 HG2 GLN 5 2HG GLN 5 -3.393 5.493 2.365
36 HG3 GLN 5 1HG GLN 5 -4.173 5.515 3.943
37 HE21 GLN 5 1HE2 GLN 5 -1.299 5.481 3.139
38 HE22 GLN 5 2HE2 GLN 5 -0.637 4.175 4.046
39 H ARG 6 H ARG 6 -6.109 3.096 -0.325
40 HA ARG 6 HA ARG 6 -7.622 0.806 0.317
41 HB2 ARG 6 2HB ARG 6 -8.529 2.402 -1.275
42 HB3 ARG 6 1HB ARG 6 -7.168 2.144 -2.364
43 HG2 ARG 6 2HG ARG 6 -7.864 -0.210 -2.632
44 HG3 ARG 6 1HG ARG 6 -9.264 0.111 -1.619
45 HD2 ARG 6 2HD ARG 6 -10.069 1.733 -3.251
46 HD3 ARG 6 1HD ARG 6 -8.629 1.452 -4.236
47 HE ARG 6 HE ARG 6 -9.671 -1.028 -3.990
48 HH11 ARG 6 1HH1 ARG 6 -11.001 2.038 -5.134
49 HH12 ARG 6 2HH1 ARG 6 -12.178 1.321 -6.139
50 HH21 ARG 6 1HH2 ARG 6 -11.285 -2.027 -5.335
51 HH22 ARG 6 2HH2 ARG 6 -12.340 -1.049 -6.252
52 H LYS 7 H LYS 7 -5.022 1.346 -1.988
53 HA LYS 7 HA LYS 7 -4.890 -1.158 -3.158
54 HB2 LYS 7 2HB LYS 7 -3.739 0.855 -3.998
55 HB3 LYS 7 1HB LYS 7 -2.628 0.777 -2.643
56 HG2 LYS 7 2HG LYS 7 -1.827 -1.411 -3.473
57 HG3 LYS 7 1HG LYS 7 -2.885 -1.230 -4.874
58 HD2 LYS 7 2HD LYS 7 -1.724 0.872 -5.440
59 HD3 LYS 7 1HD LYS 7 -0.628 0.604 -4.086
60 HE2 LYS 7 2HE LYS 7 0.448 -0.134 -6.116
61 HE3 LYS 7 1HE LYS 7 0.064 -1.538 -5.121
62 HZ1 LYS 7 1HZ LYS 7 -0.448 -1.952 -7.394
63 HZ2 LYS 7 2HZ LYS 7 -1.435 -0.597 -7.505
64 HZ3 LYS 7 3HZ LYS 7 -1.899 -1.899 -6.554
65 H CYS 8 H CYS 8 -3.099 0.105 -0.389
66 HA CYS 8 HA CYS 8 -1.490 -2.070 0.189
67 HB2 CYS 8 2HB CYS 8 -2.786 -0.239 2.212
68 HB3 CYS 8 1HB CYS 8 -1.335 -1.193 2.443
69 H LYS 9 H LYS 9 -4.699 -1.274 1.501
70 HA LYS 9 HA LYS 9 -4.774 -3.578 3.184
71 HB2 LYS 9 2HB LYS 9 -5.822 -1.307 3.601
72 HB3 LYS 9 1HB LYS 9 -7.049 -1.751 2.433
73 HG2 LYS 9 2HG LYS 9 -7.750 -3.602 3.839
74 HG3 LYS 9 1HG LYS 9 -6.476 -3.218 5.001
75 HD2 LYS 9 2HD LYS 9 -7.482 -0.941 5.225
76 HD3 LYS 9 1HD LYS 9 -8.829 -1.498 4.239
77 HE2 LYS 9 2HE LYS 9 -9.422 -1.637 6.567
78 HE3 LYS 9 1HE LYS 9 -9.263 -3.268 5.911
79 HZ1 LYS 9 1HZ LYS 9 -8.224 -3.005 8.100
80 HZ2 LYS 9 2HZ LYS 9 -7.182 -1.846 7.475
81 HZ3 LYS 9 3HZ LYS 9 -7.090 -3.442 6.941
82 H GLU 10 H GLU 10 -5.763 -2.820 0.006
83 HA GLU 10 HA GLU 10 -7.645 -4.912 -0.367
84 HB2 GLU 10 2HB GLU 10 -7.557 -2.817 -1.679
85 HB3 GLU 10 1HB GLU 10 -6.029 -3.328 -2.358
86 HG2 GLU 10 2HG GLU 10 -7.084 -5.106 -3.539
87 HG3 GLU 10 1HG GLU 10 -8.618 -4.795 -2.717
88 H LEU 11 H LEU 11 -4.187 -4.528 -0.990
89 HA LEU 11 HA LEU 11 -3.904 -7.173 -2.105
90 HB2 LEU 11 2HB LEU 11 -1.860 -5.185 -1.131
91 HB3 LEU 11 1HB LEU 11 -1.462 -6.709 -1.894
92 HG LEU 11 HG LEU 11 -2.995 -4.474 -3.209
93 HD11 LEU 11 1HD1 LEU 11 -0.129 -5.344 -3.524
94 HD12 LEU 11 2HD1 LEU 11 -0.693 -3.848 -2.778
95 HD13 LEU 11 3HD1 LEU 11 -0.952 -4.127 -4.500
96 HD21 LEU 11 1HD2 LEU 11 -3.588 -6.645 -4.118
97 HD22 LEU 11 2HD2 LEU 11 -1.886 -7.068 -4.268
98 HD23 LEU 11 3HD2 LEU 11 -2.560 -5.783 -5.263
99 H DAS 12 H DAS 12 -3.272 -5.603 0.968
100 HA DAS 12 HA DAS 12 -2.945 -8.256 2.127
101 HB2 DAS 12 1HB DAS 12 -5.035 -7.281 2.848
102 HB3 DAS 12 2HB DAS 12 -4.215 -5.798 3.321
103 H THR 13 H THR 13 -1.004 -8.587 2.754
104 HA THR 13 HA THR 13 0.675 -6.318 3.513
105 HB THR 13 HB THR 13 1.906 -8.141 4.853
106 HG1 THR 13 1HG THR 13 0.428 -9.874 5.455
107 HG21 THR 13 1HG2 THR 13 -0.911 -7.372 5.657
108 HG22 THR 13 2HG2 THR 13 0.543 -6.414 5.948
109 HG23 THR 13 3HG2 THR 13 0.333 -7.969 6.754
110 H ARG 14 H ARG 14 -0.001 -7.911 1.020
111 HA ARG 14 HA ARG 14 2.381 -9.357 0.301
112 HB2 ARG 14 2HB ARG 14 -0.113 -8.665 -1.239
113 HB3 ARG 14 1HB ARG 14 1.191 -9.675 -1.848
114 HG2 ARG 14 2HG ARG 14 0.805 -11.257 -0.027
115 HG3 ARG 14 1HG ARG 14 -0.514 -10.245 0.558
116 HD2 ARG 14 2HD ARG 14 -1.744 -10.605 -1.484
117 HD3 ARG 14 1HD ARG 14 -0.391 -11.504 -2.174
118 HE ARG 14 HE ARG 14 -1.313 -12.563 0.293
119 HH11 ARG 14 1HH1 ARG 14 -1.996 -12.512 -3.197
120 HH12 ARG 14 2HH1 ARG 14 -2.579 -14.093 -3.260
121 HH21 ARG 14 1HH2 ARG 14 -2.198 -14.756 0.208
122 HH22 ARG 14 2HH2 ARG 14 -2.734 -15.393 -1.277
123 HA DPR 15 HA DPR 15 3.793 -6.428 -2.977
124 HB2 DPR 15 1HB DPR 15 6.403 -7.536 -2.122
125 HB3 DPR 15 2HB DPR 15 5.722 -7.406 -3.747
126 HG2 DPR 15 1HG DPR 15 5.908 -9.771 -2.525
127 HG3 DPR 15 2HG DPR 15 4.503 -9.372 -3.529
128 HD2 DPR 15 1HD DPR 15 4.762 -9.346 -0.539
129 HD3 DPR 15 2HD DPR 15 3.438 -9.957 -1.555
130 H DGL 16 H DGL 16 4.659 -6.959 0.299
131 HA DGL 16 HA DGL 16 6.235 -4.639 0.735
132 HB2 DGL 16 1HB DGL 16 6.258 -6.525 2.316
133 HB3 DGL 16 2HB DGL 16 4.565 -6.246 2.684
134 HG2 DGL 16 1HG DGL 16 5.117 -4.069 3.629
135 HG3 DGL 16 2HG DGL 16 6.814 -4.326 3.243
136 H DAL 17 H DAL 17 2.827 -5.341 0.748
137 HA DAL 17 HA DAL 17 1.912 -3.056 2.117
138 HB1 DAL 17 1HB DAL 17 -0.276 -3.587 1.215
139 HB2 DAL 17 2HB DAL 17 0.529 -5.054 1.772
140 HB3 DAL 17 3HB DAL 17 0.456 -4.689 0.050
141 H DGL 18 H DGL 18 2.135 -3.779 -1.340
142 HA DGL 18 HA DGL 18 1.230 -1.262 -2.181
143 HB2 DGL 18 1HB DGL 18 2.239 -1.856 -4.390
144 HB3 DGL 18 2HB DGL 18 1.120 -3.043 -3.741
145 HG2 DGL 18 1HG DGL 18 3.007 -4.390 -2.975
146 HG3 DGL 18 2HG DGL 18 4.111 -3.217 -3.683
147 H DAR 19 H DAR 19 4.350 -2.308 -1.145
148 HA DAR 19 HA DAR 19 5.760 -0.022 -2.131
149 HB2 DAR 19 1HB DAR 19 7.017 -2.063 -1.645
150 HB3 DAR 19 2HB DAR 19 6.475 -2.034 0.023
151 HG2 DAR 19 1HG DAR 19 8.797 -1.296 -0.209
152 HG3 DAR 19 2HG DAR 19 7.761 -0.026 0.446
153 HD2 DAR 19 1HD DAR 19 7.577 0.948 -1.789
154 HD3 DAR 19 2HD DAR 19 8.700 -0.263 -2.409
155 HE DAR 19 HE DAR 19 10.137 0.774 -0.482
156 HH11 DAR 19 1HH2 DAR 19 11.480 2.707 -0.574
157 HH12 DAR 19 2HH2 DAR 19 11.056 3.981 -1.616
158 HH21 DAR 19 1HH1 DAR 19 8.119 2.408 -2.882
159 HH22 DAR 19 2HH1 DAR 19 9.068 3.823 -2.959
160 H DLY 20 H DLY 20 4.458 -1.052 0.957
161 HA DLY 20 HA DLY 20 5.041 1.114 2.572
162 HB2 DLY 20 1HB DLY 20 4.183 -1.042 3.357
163 HB3 DLY 20 2HB DLY 20 2.650 -0.743 2.569
164 HG2 DLY 20 1HG DLY 20 2.156 1.057 4.096
165 HG3 DLY 20 2HG DLY 20 3.729 0.853 4.872
166 HD2 DLY 20 1HD DLY 20 3.121 -1.422 5.528
167 HD3 DLY 20 2HD DLY 20 1.564 -1.254 4.720
168 HE2 DLY 20 1HE DLY 20 1.355 -0.955 7.140
169 HE3 DLY 20 2HE DLY 20 0.920 0.510 6.267
170 HZ1 DLY 20 1HZ DLY 20 2.324 0.930 8.231
171 HZ2 DLY 20 2HZ DLY 20 2.959 1.504 6.806
172 HZ3 DLY 20 3HZ DLY 20 3.585 0.085 7.490
173 H DCY 21 H DCY 21 2.353 0.583 0.360
174 HA DCY 21 HA DCY 21 0.745 2.754 0.843
175 HB2 DCY 21 1HB DCY 21 1.446 1.561 -1.846
176 HB3 DCY 21 2HB DCY 21 0.074 2.616 -1.542
177 H DAR 22 H DAR 22 3.480 2.681 -1.470
178 HA DAR 22 HA DAR 22 3.196 5.520 -1.922
179 HB2 DAR 22 1HB DAR 22 5.162 3.501 -2.990
180 HB3 DAR 22 2HB DAR 22 5.249 5.209 -3.378
181 HG2 DAR 22 1HG DAR 22 2.869 3.471 -3.957
182 HG3 DAR 22 2HG DAR 22 4.144 3.821 -5.126
183 HD2 DAR 22 1HD DAR 22 3.630 6.216 -4.961
184 HD3 DAR 22 2HD DAR 22 2.362 5.864 -3.787
185 HE DAR 22 HE DAR 22 1.874 4.377 -6.098
186 HH11 DAR 22 1HH1 DAR 22 1.847 7.764 -5.092
187 HH12 DAR 22 2HH1 DAR 22 0.577 8.229 -6.110
188 HH21 DAR 22 1HH2 DAR 22 0.122 4.973 -7.513
189 HH22 DAR 22 2HH2 DAR 22 -0.442 6.575 -7.547
190 H DGL 23 H DGL 23 5.003 3.542 0.205
191 HA DGL 23 HA DGL 23 7.143 5.384 0.570
192 HB2 DGL 23 1HB DGL 23 7.422 2.994 1.055
193 HB3 DGL 23 2HB DGL 23 6.226 3.108 2.337
194 HG2 DGL 23 1HG DGL 23 7.669 4.595 3.592
195 HG3 DGL 23 2HG DGL 23 8.862 4.559 2.298
196 H DGL 24 H DGL 24 4.091 4.796 2.235
197 HA DGL 24 HA DGL 24 4.740 6.991 4.048
198 HB2 DGL 24 1HB DGL 24 2.467 5.022 4.142
199 HB3 DGL 24 2HB DGL 24 2.742 6.297 5.319
200 HG2 DGL 24 1HG DGL 24 4.891 5.288 5.904
201 HG3 DGL 24 2HG DGL 24 4.595 3.998 4.739
202 H SER 25 H SER 25 2.329 6.155 1.556
203 HA SER 25 HA SER 25 1.493 8.935 1.641
204 HB2 SER 25 2HB SER 25 0.792 6.766 -0.360
205 HB3 SER 25 1HB SER 25 0.525 8.501 -0.549
206 HG SER 25 HG SER 25 2.995 8.467 -0.131
207 H ASP 26 H ASP 26 -0.052 9.225 3.140
208 HA ASP 26 HA ASP 26 -1.833 7.143 4.007
209 HB2 ASP 26 2HB ASP 26 -2.700 8.808 5.569
210 HB3 ASP 26 1HB ASP 26 -0.939 8.804 5.573
Start of MODEL 13
1 H ASN 1 H ASN 1 -1.734 7.445 0.960
2 HA ASN 1 HA ASN 1 -3.710 9.195 -0.331
3 HB2 ASN 1 2HB ASN 1 -1.986 7.001 -1.507
4 HB3 ASN 1 1HB ASN 1 -3.147 7.957 -2.404
5 HD21 ASN 1 1HD2 ASN 1 -2.618 10.119 -2.879
6 HD22 ASN 1 2HD2 ASN 1 -1.001 10.684 -2.780
7 HA PRO 2 HA PRO 2 -6.628 6.003 1.104
8 HB2 PRO 2 2HB PRO 2 -8.228 7.509 -0.926
9 HB3 PRO 2 1HB PRO 2 -8.702 6.966 0.689
10 HG2 PRO 2 2HG PRO 2 -8.093 9.505 0.304
11 HG3 PRO 2 1HG PRO 2 -7.507 8.662 1.751
12 HD2 PRO 2 2HD PRO 2 -6.026 9.433 -0.721
13 HD3 PRO 2 1HD PRO 2 -5.475 9.412 0.966
14 H GLU 3 H GLU 3 -5.912 6.873 -2.200
15 HA GLU 3 HA GLU 3 -7.023 4.721 -3.637
16 HB2 GLU 3 2HB GLU 3 -4.430 6.189 -4.155
17 HB3 GLU 3 1HB GLU 3 -5.314 5.227 -5.326
18 HG2 GLU 3 2HG GLU 3 -7.110 6.788 -5.357
19 HG3 GLU 3 1HG GLU 3 -6.423 7.685 -4.004
20 H LEU 4 H LEU 4 -3.736 5.155 -2.405
21 HA LEU 4 HA LEU 4 -2.844 2.545 -3.010
22 HB2 LEU 4 2HB LEU 4 -1.736 4.782 -1.352
23 HB3 LEU 4 1HB LEU 4 -1.017 3.193 -1.286
24 HG LEU 4 HG LEU 4 0.234 4.643 -2.755
25 HD11 LEU 4 1HD1 LEU 4 0.167 2.272 -3.229
26 HD12 LEU 4 2HD1 LEU 4 0.354 3.227 -4.691
27 HD13 LEU 4 3HD1 LEU 4 -1.212 2.512 -4.307
28 HD21 LEU 4 1HD2 LEU 4 -0.712 5.454 -4.882
29 HD22 LEU 4 2HD2 LEU 4 -1.528 6.164 -3.493
30 HD23 LEU 4 3HD2 LEU 4 -2.298 4.858 -4.393
31 H GLN 5 H GLN 5 -3.955 4.104 -0.069
32 HA GLN 5 HA GLN 5 -3.367 1.948 1.621
33 HB2 GLN 5 2HB GLN 5 -5.413 4.126 2.003
34 HB3 GLN 5 1HB GLN 5 -4.793 3.070 3.269
35 HG2 GLN 5 2HG GLN 5 -2.545 3.948 2.919
36 HG3 GLN 5 1HG GLN 5 -3.151 4.994 1.637
37 HE21 GLN 5 1HE2 GLN 5 -2.945 4.454 5.012
38 HE22 GLN 5 2HE2 GLN 5 -3.584 5.991 5.487
39 H ARG 6 H ARG 6 -6.295 2.700 -0.237
40 HA ARG 6 HA ARG 6 -7.830 0.593 0.800
41 HB2 ARG 6 2HB ARG 6 -8.911 2.313 -0.551
42 HB3 ARG 6 1HB ARG 6 -7.927 1.886 -1.944
43 HG2 ARG 6 2HG ARG 6 -10.160 0.995 -2.211
44 HG3 ARG 6 1HG ARG 6 -9.004 -0.323 -2.013
45 HD2 ARG 6 2HD ARG 6 -9.638 -0.346 0.438
46 HD3 ARG 6 1HD ARG 6 -10.943 0.763 0.014
47 HE ARG 6 HE ARG 6 -10.786 -1.724 -1.451
48 HH11 ARG 6 1HH1 ARG 6 -12.471 0.146 1.071
49 HH12 ARG 6 2HH1 ARG 6 -13.720 -1.003 1.239
50 HH21 ARG 6 1HH2 ARG 6 -12.463 -3.265 -1.170
51 HH22 ARG 6 2HH2 ARG 6 -13.756 -2.947 -0.079
52 H LYS 7 H LYS 7 -5.606 0.791 -1.956
53 HA LYS 7 HA LYS 7 -5.875 -1.832 -2.862
54 HB2 LYS 7 2HB LYS 7 -4.648 -0.145 -4.166
55 HB3 LYS 7 1HB LYS 7 -3.404 -0.071 -2.922
56 HG2 LYS 7 2HG LYS 7 -2.897 -2.458 -3.341
57 HG3 LYS 7 1HG LYS 7 -4.071 -2.446 -4.650
58 HD2 LYS 7 2HD LYS 7 -2.737 -0.747 -5.819
59 HD3 LYS 7 1HD LYS 7 -1.560 -0.768 -4.498
60 HE2 LYS 7 2HE LYS 7 -1.125 -3.138 -4.914
61 HE3 LYS 7 1HE LYS 7 -2.314 -3.133 -6.208
62 HZ1 LYS 7 1HZ LYS 7 -0.220 -2.999 -7.154
63 HZ2 LYS 7 2HZ LYS 7 0.331 -1.784 -6.181
64 HZ3 LYS 7 3HZ LYS 7 -0.881 -1.471 -7.348
65 H CYS 8 H CYS 8 -3.535 -0.455 -0.581
66 HA CYS 8 HA CYS 8 -2.106 -2.735 0.043
67 HB2 CYS 8 2HB CYS 8 -2.797 -0.396 1.817
68 HB3 CYS 8 1HB CYS 8 -1.527 -1.561 2.153
69 H LYS 9 H LYS 9 -4.957 -1.441 1.722
70 HA LYS 9 HA LYS 9 -4.997 -3.479 3.675
71 HB2 LYS 9 2HB LYS 9 -5.924 -1.262 4.053
72 HB3 LYS 9 1HB LYS 9 -7.117 -1.538 2.797
73 HG2 LYS 9 2HG LYS 9 -8.185 -3.240 4.125
74 HG3 LYS 9 1HG LYS 9 -6.930 -3.112 5.355
75 HD2 LYS 9 2HD LYS 9 -8.944 -1.908 6.022
76 HD3 LYS 9 1HD LYS 9 -7.591 -0.802 5.801
77 HE2 LYS 9 2HE LYS 9 -8.431 -0.153 3.628
78 HE3 LYS 9 1HE LYS 9 -9.734 -1.331 3.740
79 HZ1 LYS 9 1HZ LYS 9 -10.477 0.881 4.242
80 HZ2 LYS 9 2HZ LYS 9 -9.364 1.048 5.484
81 HZ3 LYS 9 3HZ LYS 9 -10.625 -0.074 5.617
82 H GLU 10 H GLU 10 -6.539 -3.165 0.532
83 HA GLU 10 HA GLU 10 -8.249 -5.422 1.007
84 HB2 GLU 10 2HB GLU 10 -9.077 -3.594 -0.332
85 HB3 GLU 10 1HB GLU 10 -7.734 -3.750 -1.448
86 HG2 GLU 10 2HG GLU 10 -8.560 -5.756 -2.314
87 HG3 GLU 10 1HG GLU 10 -9.740 -5.935 -1.021
88 H LEU 11 H LEU 11 -5.269 -4.787 -0.724
89 HA LEU 11 HA LEU 11 -5.093 -7.311 -2.010
90 HB2 LEU 11 2HB LEU 11 -3.922 -5.265 -2.777
91 HB3 LEU 11 1HB LEU 11 -2.957 -5.298 -1.325
92 HG LEU 11 HG LEU 11 -1.967 -7.401 -2.022
93 HD11 LEU 11 1HD1 LEU 11 -3.575 -6.990 -4.542
94 HD12 LEU 11 2HD1 LEU 11 -3.735 -8.322 -3.392
95 HD13 LEU 11 3HD1 LEU 11 -2.269 -8.157 -4.358
96 HD21 LEU 11 1HD2 LEU 11 -0.594 -6.482 -3.848
97 HD22 LEU 11 2HD2 LEU 11 -0.850 -5.314 -2.552
98 HD23 LEU 11 3HD2 LEU 11 -1.768 -5.182 -4.053
99 H DAS 12 H DAS 12 -3.520 -5.897 0.835
100 HA DAS 12 HA DAS 12 -3.117 -8.602 1.875
101 HB2 DAS 12 1HB DAS 12 -4.766 -7.398 3.166
102 HB3 DAS 12 2HB DAS 12 -3.713 -5.995 3.278
103 H THR 13 H THR 13 -1.027 -9.136 2.231
104 HA THR 13 HA THR 13 0.827 -6.995 2.920
105 HB THR 13 HB THR 13 1.329 -9.968 3.155
106 HG1 THR 13 1HG THR 13 -0.427 -8.370 4.514
107 HG21 THR 13 1HG2 THR 13 3.274 -8.440 3.404
108 HG22 THR 13 2HG2 THR 13 2.892 -9.265 4.914
109 HG23 THR 13 3HG2 THR 13 2.417 -7.583 4.684
110 H ARG 14 H ARG 14 -0.128 -8.557 0.212
111 HA ARG 14 HA ARG 14 2.319 -9.136 -1.107
112 HB2 ARG 14 2HB ARG 14 -0.361 -8.324 -2.266
113 HB3 ARG 14 1HB ARG 14 0.992 -8.849 -3.230
114 HG2 ARG 14 2HG ARG 14 -0.337 -10.569 -1.145
115 HG3 ARG 14 1HG ARG 14 -0.789 -10.566 -2.846
116 HD2 ARG 14 2HD ARG 14 0.665 -12.406 -2.544
117 HD3 ARG 14 1HD ARG 14 1.615 -11.166 -3.350
118 HE ARG 14 HE ARG 14 1.753 -11.577 -0.445
119 HH11 ARG 14 1HH1 ARG 14 3.415 -11.387 -3.595
120 HH12 ARG 14 2HH1 ARG 14 4.955 -11.618 -2.946
121 HH21 ARG 14 1HH2 ARG 14 3.888 -11.896 0.426
122 HH22 ARG 14 2HH2 ARG 14 5.253 -11.887 -0.583
123 HA DPR 15 HA DPR 15 2.948 -5.089 -3.285
124 HB2 DPR 15 1HB DPR 15 5.750 -6.010 -3.286
125 HB3 DPR 15 2HB DPR 15 4.746 -5.482 -4.640
126 HG2 DPR 15 1HG DPR 15 5.411 -8.053 -4.323
127 HG3 DPR 15 2HG DPR 15 3.813 -7.579 -4.931
128 HD2 DPR 15 1HD DPR 15 4.607 -8.439 -2.173
129 HD3 DPR 15 2HD DPR 15 3.205 -8.929 -3.140
130 H DGL 16 H DGL 16 4.351 -6.562 -0.537
131 HA DGL 16 HA DGL 16 6.154 -4.683 0.480
132 HB2 DGL 16 1HB DGL 16 5.679 -6.964 1.355
133 HB3 DGL 16 2HB DGL 16 4.177 -6.366 2.037
134 HG2 DGL 16 1HG DGL 16 5.777 -6.505 3.778
135 HG3 DGL 16 2HG DGL 16 5.493 -4.802 3.427
136 H DAL 17 H DAL 17 2.681 -4.853 0.630
137 HA DAL 17 HA DAL 17 2.269 -2.770 2.497
138 HB1 DAL 17 1HB DAL 17 -0.055 -2.949 1.882
139 HB2 DAL 17 2HB DAL 17 0.651 -4.558 2.065
140 HB3 DAL 17 3HB DAL 17 0.373 -3.894 0.458
141 H DGL 18 H DGL 18 2.207 -2.931 -1.054
142 HA DGL 18 HA DGL 18 1.303 -0.248 -1.275
143 HB2 DGL 18 1HB DGL 18 1.597 -0.439 -3.660
144 HB3 DGL 18 2HB DGL 18 0.866 -1.913 -3.057
145 HG2 DGL 18 1HG DGL 18 3.102 -2.976 -3.110
146 HG3 DGL 18 2HG DGL 18 3.713 -1.521 -3.893
147 H DAR 19 H DAR 19 4.394 -1.728 -0.987
148 HA DAR 19 HA DAR 19 6.003 0.520 -1.761
149 HB2 DAR 19 1HB DAR 19 6.725 -1.377 0.474
150 HB3 DAR 19 2HB DAR 19 7.817 -0.470 -0.547
151 HG2 DAR 19 1HG DAR 19 6.202 -2.853 -1.338
152 HG3 DAR 19 2HG DAR 19 7.940 -2.776 -1.091
153 HD2 DAR 19 1HD DAR 19 8.147 -1.239 -2.974
154 HD3 DAR 19 2HD DAR 19 6.402 -1.354 -3.241
155 HE DAR 19 HE DAR 19 7.925 -3.811 -3.153
156 HH11 DAR 19 1HH2 DAR 19 7.812 -5.192 -5.007
157 HH12 DAR 19 2HH2 DAR 19 7.102 -4.629 -6.450
158 HH21 DAR 19 1HH1 DAR 19 6.372 -1.393 -5.239
159 HH22 DAR 19 2HH1 DAR 19 6.270 -2.422 -6.583
160 H DLY 20 H DLY 20 4.817 -0.748 1.297
161 HA DLY 20 HA DLY 20 5.691 1.146 3.090
162 HB2 DLY 20 1HB DLY 20 4.566 -0.994 3.677
163 HB3 DLY 20 2HB DLY 20 3.049 -0.325 3.115
164 HG2 DLY 20 1HG DLY 20 3.157 1.388 4.850
165 HG3 DLY 20 2HG DLY 20 4.661 0.671 5.440
166 HD2 DLY 20 1HD DLY 20 3.479 -1.433 5.856
167 HD3 DLY 20 2HD DLY 20 1.974 -0.673 5.333
168 HE2 DLY 20 1HE DLY 20 3.690 0.237 7.635
169 HE3 DLY 20 2HE DLY 20 2.206 -0.699 7.783
170 HZ1 DLY 20 1HZ DLY 20 1.866 1.684 8.169
171 HZ2 DLY 20 2HZ DLY 20 0.949 1.110 6.906
172 HZ3 DLY 20 3HZ DLY 20 2.293 2.050 6.578
173 H DCY 21 H DCY 21 2.596 1.069 1.386
174 HA DCY 21 HA DCY 21 1.612 3.485 2.390
175 HB2 DCY 21 1HB DCY 21 0.945 2.035 -0.159
176 HB3 DCY 21 2HB DCY 21 0.011 3.383 0.498
177 H DAR 22 H DAR 22 3.448 2.827 -0.589
178 HA DAR 22 HA DAR 22 3.243 5.515 -1.510
179 HB2 DAR 22 1HB DAR 22 5.063 3.252 -2.301
180 HB3 DAR 22 2HB DAR 22 5.120 4.840 -3.050
181 HG2 DAR 22 1HG DAR 22 2.855 4.602 -3.839
182 HG3 DAR 22 2HG DAR 22 2.701 3.058 -3.003
183 HD2 DAR 22 1HD DAR 22 4.459 2.111 -4.393
184 HD3 DAR 22 2HD DAR 22 4.649 3.652 -5.232
185 HE DAR 22 HE DAR 22 2.250 3.343 -5.858
186 HH11 DAR 22 1HH1 DAR 22 4.477 0.607 -5.473
187 HH12 DAR 22 2HH1 DAR 22 3.521 -0.481 -6.385
188 HH21 DAR 22 1HH2 DAR 22 1.012 1.860 -7.214
189 HH22 DAR 22 2HH2 DAR 22 1.554 0.264 -7.434
190 H DGL 23 H DGL 23 5.320 3.909 0.701
191 HA DGL 23 HA DGL 23 7.424 5.817 0.581
192 HB2 DGL 23 1HB DGL 23 7.744 3.481 1.341
193 HB3 DGL 23 2HB DGL 23 6.745 3.822 2.746
194 HG2 DGL 23 1HG DGL 23 8.395 5.577 3.396
195 HG3 DGL 23 2HG DGL 23 9.417 5.007 2.081
196 H DGL 24 H DGL 24 4.666 5.249 2.751
197 HA DGL 24 HA DGL 24 5.389 7.540 4.339
198 HB2 DGL 24 1HB DGL 24 3.429 7.022 5.718
199 HB3 DGL 24 2HB DGL 24 4.454 5.633 5.491
200 HG2 DGL 24 1HG DGL 24 2.882 4.819 3.736
201 HG3 DGL 24 2HG DGL 24 1.802 6.146 4.169
202 H SER 25 H SER 25 2.846 6.783 2.022
203 HA SER 25 HA SER 25 2.197 9.617 2.000
204 HB2 SER 25 2HB SER 25 2.136 7.588 -0.237
205 HB3 SER 25 1HB SER 25 1.688 9.290 -0.381
206 HG SER 25 HG SER 25 4.115 8.832 0.770
207 H ASP 26 H ASP 26 0.267 9.949 2.870
208 HA ASP 26 HA ASP 26 -1.567 7.766 3.242
209 HB2 ASP 26 2HB ASP 26 -1.856 10.687 4.000
210 HB3 ASP 26 1HB ASP 26 -3.038 9.448 4.377
Start of MODEL 14
1 H ASN 1 H ASN 1 -1.605 8.091 0.681
2 HA ASN 1 HA ASN 1 -3.948 9.605 -0.055
3 HB2 ASN 1 2HB ASN 1 -2.143 9.296 -1.689
4 HB3 ASN 1 1HB ASN 1 -2.326 7.551 -1.567
5 HD21 ASN 1 1HD2 ASN 1 -3.594 10.466 -2.919
6 HD22 ASN 1 2HD2 ASN 1 -4.762 9.696 -3.932
7 HA PRO 2 HA PRO 2 -6.757 6.520 1.575
8 HB2 PRO 2 2HB PRO 2 -8.511 7.684 -0.535
9 HB3 PRO 2 1HB PRO 2 -8.860 7.381 1.172
10 HG2 PRO 2 2HG PRO 2 -8.340 9.843 0.350
11 HG3 PRO 2 1HG PRO 2 -7.675 9.248 1.881
12 HD2 PRO 2 2HD PRO 2 -6.313 9.652 -0.743
13 HD3 PRO 2 1HD PRO 2 -5.707 9.897 0.910
14 H GLU 3 H GLU 3 -6.519 6.936 -1.948
15 HA GLU 3 HA GLU 3 -7.733 4.440 -2.536
16 HB2 GLU 3 2HB GLU 3 -7.712 6.337 -4.114
17 HB3 GLU 3 1HB GLU 3 -5.972 6.147 -4.281
18 HG2 GLU 3 2HG GLU 3 -6.295 3.914 -5.196
19 HG3 GLU 3 1HG GLU 3 -8.040 4.104 -5.036
20 H LEU 4 H LEU 4 -4.381 5.589 -2.419
21 HA LEU 4 HA LEU 4 -3.181 3.169 -3.165
22 HB2 LEU 4 2HB LEU 4 -2.076 5.337 -1.383
23 HB3 LEU 4 1HB LEU 4 -1.146 4.077 -2.151
24 HG LEU 4 HG LEU 4 -2.553 6.372 -3.507
25 HD11 LEU 4 1HD1 LEU 4 0.364 5.670 -3.276
26 HD12 LEU 4 2HD1 LEU 4 -0.464 6.976 -2.429
27 HD13 LEU 4 3HD1 LEU 4 -0.304 7.025 -4.184
28 HD21 LEU 4 1HD2 LEU 4 -2.754 4.380 -4.895
29 HD22 LEU 4 2HD2 LEU 4 -1.019 4.094 -4.751
30 HD23 LEU 4 3HD2 LEU 4 -1.610 5.521 -5.601
31 H GLN 5 H GLN 5 -4.254 4.422 -0.090
32 HA GLN 5 HA GLN 5 -3.084 2.377 1.476
33 HB2 GLN 5 2HB GLN 5 -5.297 4.319 2.086
34 HB3 GLN 5 1HB GLN 5 -4.626 3.208 3.278
35 HG2 GLN 5 2HG GLN 5 -2.426 4.216 2.982
36 HG3 GLN 5 1HG GLN 5 -3.084 5.302 1.770
37 HE21 GLN 5 1HE2 GLN 5 -5.583 5.765 3.284
38 HE22 GLN 5 2HE2 GLN 5 -5.115 6.803 4.564
39 H ARG 6 H ARG 6 -6.395 2.769 0.192
40 HA ARG 6 HA ARG 6 -7.238 0.305 1.339
41 HB2 ARG 6 2HB ARG 6 -9.222 0.407 -0.114
42 HB3 ARG 6 1HB ARG 6 -8.936 1.940 0.686
43 HG2 ARG 6 2HG ARG 6 -8.084 2.894 -1.320
44 HG3 ARG 6 1HG ARG 6 -8.147 1.336 -2.149
45 HD2 ARG 6 2HD ARG 6 -10.536 2.801 -1.036
46 HD3 ARG 6 1HD ARG 6 -10.046 2.829 -2.732
47 HE ARG 6 HE ARG 6 -10.308 0.165 -1.947
48 HH11 ARG 6 1HH1 ARG 6 -12.459 2.961 -2.340
49 HH12 ARG 6 2HH1 ARG 6 -13.798 2.046 -2.839
50 HH21 ARG 6 1HH2 ARG 6 -12.161 -1.106 -2.616
51 HH22 ARG 6 2HH2 ARG 6 -13.622 -0.327 -2.989
52 H LYS 7 H LYS 7 -5.571 1.121 -1.540
53 HA LYS 7 HA LYS 7 -5.858 -1.211 -3.058
54 HB2 LYS 7 2HB LYS 7 -4.707 0.994 -3.658
55 HB3 LYS 7 1HB LYS 7 -3.329 0.416 -2.747
56 HG2 LYS 7 2HG LYS 7 -2.915 0.037 -5.057
57 HG3 LYS 7 1HG LYS 7 -3.212 -1.529 -4.297
58 HD2 LYS 7 2HD LYS 7 -5.448 -1.592 -5.134
59 HD3 LYS 7 1HD LYS 7 -5.333 0.067 -5.717
60 HE2 LYS 7 2HE LYS 7 -3.622 -0.614 -7.310
61 HE3 LYS 7 1HE LYS 7 -3.718 -2.273 -6.720
62 HZ1 LYS 7 1HZ LYS 7 -6.038 -2.314 -7.441
63 HZ2 LYS 7 2HZ LYS 7 -5.011 -1.995 -8.731
64 HZ3 LYS 7 3HZ LYS 7 -5.900 -0.746 -8.038
65 H CYS 8 H CYS 8 -3.526 -0.306 -0.550
66 HA CYS 8 HA CYS 8 -2.114 -2.750 -0.492
67 HB2 CYS 8 2HB CYS 8 -2.425 -0.706 1.692
68 HB3 CYS 8 1HB CYS 8 -1.176 -1.945 1.595
69 H LYS 9 H LYS 9 -5.031 -1.641 1.074
70 HA LYS 9 HA LYS 9 -5.058 -3.743 3.003
71 HB2 LYS 9 2HB LYS 9 -6.198 -1.586 3.379
72 HB3 LYS 9 1HB LYS 9 -7.322 -1.961 2.083
73 HG2 LYS 9 2HG LYS 9 -8.202 -3.843 3.334
74 HG3 LYS 9 1HG LYS 9 -7.000 -3.587 4.592
75 HD2 LYS 9 2HD LYS 9 -9.140 -1.606 3.827
76 HD3 LYS 9 1HD LYS 9 -9.235 -2.710 5.199
77 HE2 LYS 9 2HE LYS 9 -7.186 -1.694 6.118
78 HE3 LYS 9 1HE LYS 9 -7.172 -0.557 4.773
79 HZ1 LYS 9 1HZ LYS 9 -9.343 -0.784 6.770
80 HZ2 LYS 9 2HZ LYS 9 -9.254 0.362 5.544
81 HZ3 LYS 9 3HZ LYS 9 -8.121 0.359 6.791
82 H GLU 10 H GLU 10 -6.257 -3.291 -0.228
83 HA GLU 10 HA GLU 10 -7.876 -5.604 -0.319
84 HB2 GLU 10 2HB GLU 10 -8.061 -3.628 -1.831
85 HB3 GLU 10 1HB GLU 10 -6.528 -4.085 -2.557
86 HG2 GLU 10 2HG GLU 10 -8.393 -4.774 -3.924
87 HG3 GLU 10 1HG GLU 10 -7.488 -6.164 -3.312
88 H LEU 11 H LEU 11 -4.544 -4.841 -1.165
89 HA LEU 11 HA LEU 11 -3.858 -7.429 -2.131
90 HB2 LEU 11 2HB LEU 11 -2.200 -5.127 -1.150
91 HB3 LEU 11 1HB LEU 11 -1.491 -6.603 -1.761
92 HG LEU 11 HG LEU 11 -3.267 -4.749 -3.349
93 HD11 LEU 11 1HD1 LEU 11 -1.104 -3.738 -2.821
94 HD12 LEU 11 2HD1 LEU 11 -1.213 -4.158 -4.529
95 HD13 LEU 11 3HD1 LEU 11 -0.279 -5.174 -3.429
96 HD21 LEU 11 1HD2 LEU 11 -2.469 -6.124 -5.253
97 HD22 LEU 11 2HD2 LEU 11 -3.458 -7.028 -4.117
98 HD23 LEU 11 3HD2 LEU 11 -1.705 -7.217 -4.101
99 H DAS 12 H DAS 12 -3.622 -5.875 0.997
100 HA DAS 12 HA DAS 12 -3.132 -8.483 2.195
101 HB2 DAS 12 1HB DAS 12 -5.029 -7.280 3.128
102 HB3 DAS 12 2HB DAS 12 -4.016 -5.870 3.432
103 H THR 13 H THR 13 -1.066 -8.907 2.448
104 HA THR 13 HA THR 13 0.659 -6.723 3.320
105 HB THR 13 HB THR 13 0.537 -8.745 4.797
106 HG1 THR 13 1HG THR 13 2.379 -7.470 4.763
107 HG21 THR 13 1HG2 THR 13 0.249 -10.471 3.112
108 HG22 THR 13 2HG2 THR 13 1.680 -10.820 4.082
109 HG23 THR 13 3HG2 THR 13 1.854 -10.140 2.463
110 H ARG 14 H ARG 14 -0.260 -8.379 0.663
111 HA ARG 14 HA ARG 14 2.132 -8.922 -0.722
112 HB2 ARG 14 2HB ARG 14 -0.686 -8.475 -1.710
113 HB3 ARG 14 1HB ARG 14 0.639 -8.975 -2.753
114 HG2 ARG 14 2HG ARG 14 0.925 -10.993 -1.448
115 HG3 ARG 14 1HG ARG 14 -0.344 -10.476 -0.344
116 HD2 ARG 14 2HD ARG 14 -1.970 -10.571 -2.148
117 HD3 ARG 14 1HD ARG 14 -0.706 -11.039 -3.287
118 HE ARG 14 HE ARG 14 -0.462 -12.910 -1.429
119 HH11 ARG 14 1HH1 ARG 14 -3.306 -11.756 -3.188
120 HH12 ARG 14 2HH1 ARG 14 -4.169 -13.208 -3.047
121 HH21 ARG 14 1HH2 ARG 14 -1.656 -14.943 -1.243
122 HH22 ARG 14 2HH2 ARG 14 -3.211 -15.063 -1.918
123 HA DPR 15 HA DPR 15 2.446 -5.023 -3.059
124 HB2 DPR 15 1HB DPR 15 4.904 -5.431 -4.060
125 HB3 DPR 15 2HB DPR 15 3.473 -6.176 -4.791
126 HG2 DPR 15 1HG DPR 15 5.518 -7.372 -2.972
127 HG3 DPR 15 2HG DPR 15 4.741 -8.072 -4.402
128 HD2 DPR 15 1HD DPR 15 3.987 -8.591 -1.803
129 HD3 DPR 15 2HD DPR 15 2.916 -8.765 -3.208
130 H DGL 16 H DGL 16 4.083 -6.533 -0.513
131 HA DGL 16 HA DGL 16 6.120 -4.595 -0.055
132 HB2 DGL 16 1HB DGL 16 6.054 -7.017 0.752
133 HB3 DGL 16 2HB DGL 16 4.921 -6.467 1.979
134 HG2 DGL 16 1HG DGL 16 7.187 -6.612 2.844
135 HG3 DGL 16 2HG DGL 16 6.585 -4.952 2.865
136 H DAL 17 H DAL 17 2.852 -5.155 1.079
137 HA DAL 17 HA DAL 17 2.740 -2.986 2.895
138 HB1 DAL 17 1HB DAL 17 0.505 -4.285 1.342
139 HB2 DAL 17 2HB DAL 17 0.312 -3.207 2.726
140 HB3 DAL 17 3HB DAL 17 1.092 -4.774 2.932
141 H DGL 18 H DGL 18 2.121 -3.342 -0.536
142 HA DGL 18 HA DGL 18 1.099 -0.786 -1.058
143 HB2 DGL 18 1HB DGL 18 1.003 -2.606 -2.714
144 HB3 DGL 18 2HB DGL 18 2.753 -2.558 -2.874
145 HG2 DGL 18 1HG DGL 18 2.597 -0.266 -3.736
146 HG3 DGL 18 2HG DGL 18 0.841 -0.358 -3.610
147 H DAR 19 H DAR 19 4.384 -2.030 -1.074
148 HA DAR 19 HA DAR 19 5.764 0.293 -1.759
149 HB2 DAR 19 1HB DAR 19 6.643 -1.944 0.079
150 HB3 DAR 19 2HB DAR 19 7.715 -0.723 -0.593
151 HG2 DAR 19 1HG DAR 19 7.291 -1.507 -2.820
152 HG3 DAR 19 2HG DAR 19 6.116 -2.674 -2.215
153 HD2 DAR 19 1HD DAR 19 7.907 -3.760 -0.910
154 HD3 DAR 19 2HD DAR 19 9.062 -2.625 -1.610
155 HE DAR 19 HE DAR 19 7.966 -3.647 -3.788
156 HH11 DAR 19 1HH2 DAR 19 8.622 -5.498 -4.941
157 HH12 DAR 19 2HH2 DAR 19 9.348 -6.828 -4.159
158 HH21 DAR 19 1HH1 DAR 19 9.129 -5.406 -0.889
159 HH22 DAR 19 2HH1 DAR 19 9.631 -6.740 -1.788
160 H DLY 20 H DLY 20 4.793 -0.921 1.413
161 HA DLY 20 HA DLY 20 5.846 1.113 2.998
162 HB2 DLY 20 1HB DLY 20 4.800 -0.968 3.892
163 HB3 DLY 20 2HB DLY 20 3.222 -0.341 3.442
164 HG2 DLY 20 1HG DLY 20 3.475 0.052 5.762
165 HG3 DLY 20 2HG DLY 20 3.680 1.612 4.962
166 HD2 DLY 20 1HD DLY 20 6.171 1.183 5.030
167 HD3 DLY 20 2HD DLY 20 5.822 -0.176 6.095
168 HE2 DLY 20 1HE DLY 20 6.355 1.666 7.500
169 HE3 DLY 20 2HE DLY 20 4.609 1.442 7.583
170 HZ1 DLY 20 1HZ DLY 20 4.303 3.244 6.027
171 HZ2 DLY 20 2HZ DLY 20 6.008 3.418 5.896
172 HZ3 DLY 20 3HZ DLY 20 5.232 3.764 7.342
173 H DCY 21 H DCY 21 2.685 0.899 1.390
174 HA DCY 21 HA DCY 21 1.674 3.383 2.218
175 HB2 DCY 21 1HB DCY 21 1.112 1.877 -0.327
176 HB3 DCY 21 2HB DCY 21 0.141 3.208 0.294
177 H DAR 22 H DAR 22 3.676 2.469 -0.523
178 HA DAR 22 HA DAR 22 3.545 4.939 -1.874
179 HB2 DAR 22 1HB DAR 22 5.850 2.991 -1.858
180 HB3 DAR 22 2HB DAR 22 5.603 4.273 -3.024
181 HG2 DAR 22 1HG DAR 22 3.993 1.765 -2.691
182 HG3 DAR 22 2HG DAR 22 4.982 2.236 -4.066
183 HD2 DAR 22 1HD DAR 22 2.361 3.420 -3.187
184 HD3 DAR 22 2HD DAR 22 2.726 2.572 -4.687
185 HE DAR 22 HE DAR 22 4.288 4.931 -4.359
186 HH11 DAR 22 1HH1 DAR 22 1.271 3.636 -5.642
187 HH12 DAR 22 2HH1 DAR 22 0.885 5.058 -6.507
188 HH21 DAR 22 1HH2 DAR 22 3.706 6.888 -5.495
189 HH22 DAR 22 2HH2 DAR 22 2.277 6.926 -6.413
190 H DGL 23 H DGL 23 5.776 3.661 0.487
191 HA DGL 23 HA DGL 23 7.617 5.701 0.728
192 HB2 DGL 23 1HB DGL 23 7.906 3.562 1.794
193 HB3 DGL 23 2HB DGL 23 6.463 3.794 2.763
194 HG2 DGL 23 1HG DGL 23 7.583 5.667 3.915
195 HG3 DGL 23 2HG DGL 23 9.056 5.286 3.026
196 H DGL 24 H DGL 24 4.691 5.216 2.680
197 HA DGL 24 HA DGL 24 5.110 7.735 3.997
198 HB2 DGL 24 1HB DGL 24 3.122 7.151 5.318
199 HB3 DGL 24 2HB DGL 24 4.352 5.899 5.332
200 HG2 DGL 24 1HG DGL 24 3.066 4.666 3.625
201 HG3 DGL 24 2HG DGL 24 1.796 5.884 3.754
202 H SER 25 H SER 25 2.892 6.556 1.534
203 HA SER 25 HA SER 25 2.000 9.284 1.267
204 HB2 SER 25 2HB SER 25 1.731 6.913 -0.598
205 HB3 SER 25 1HB SER 25 1.110 8.530 -0.939
206 HG SER 25 HG SER 25 3.818 7.714 -0.639
207 H ASP 26 H ASP 26 0.340 9.736 2.434
208 HA ASP 26 HA ASP 26 -1.517 7.789 3.467
209 HB2 ASP 26 2HB ASP 26 -2.476 9.768 4.657
210 HB3 ASP 26 1HB ASP 26 -0.757 9.538 4.942
Start of MODEL 15
1 H ASN 1 H ASN 1 -1.326 8.623 0.796
2 HA ASN 1 HA ASN 1 -3.843 9.535 0.072
3 HB2 ASN 1 2HB ASN 1 -2.212 7.426 -1.364
4 HB3 ASN 1 1HB ASN 1 -3.578 8.280 -2.058
5 HD21 ASN 1 1HD2 ASN 1 -2.649 10.838 -0.695
6 HD22 ASN 1 2HD2 ASN 1 -1.333 11.355 -1.662
7 HA PRO 2 HA PRO 2 -6.388 6.559 2.096
8 HB2 PRO 2 2HB PRO 2 -8.741 7.308 0.812
9 HB3 PRO 2 1HB PRO 2 -8.096 8.035 2.285
10 HG2 PRO 2 2HG PRO 2 -7.898 8.968 -0.538
11 HG3 PRO 2 1HG PRO 2 -8.098 9.913 0.945
12 HD2 PRO 2 2HD PRO 2 -5.758 9.754 -0.322
13 HD3 PRO 2 1HD PRO 2 -5.842 9.832 1.451
14 H GLU 3 H GLU 3 -6.854 6.960 -1.426
15 HA GLU 3 HA GLU 3 -8.058 4.384 -1.629
16 HB2 GLU 3 2HB GLU 3 -8.569 6.262 -3.184
17 HB3 GLU 3 1HB GLU 3 -6.951 6.105 -3.851
18 HG2 GLU 3 2HG GLU 3 -8.670 5.034 -5.239
19 HG3 GLU 3 1HG GLU 3 -7.446 3.901 -4.670
20 H LEU 4 H LEU 4 -4.839 5.605 -1.855
21 HA LEU 4 HA LEU 4 -3.755 3.277 -3.069
22 HB2 LEU 4 2HB LEU 4 -2.608 5.498 -3.045
23 HB3 LEU 4 1HB LEU 4 -2.371 5.320 -1.324
24 HG LEU 4 HG LEU 4 -0.916 3.357 -1.743
25 HD11 LEU 4 1HD1 LEU 4 -1.863 2.605 -3.847
26 HD12 LEU 4 2HD1 LEU 4 -0.134 2.901 -4.011
27 HD13 LEU 4 3HD1 LEU 4 -1.291 4.070 -4.644
28 HD21 LEU 4 1HD2 LEU 4 0.084 5.566 -1.494
29 HD22 LEU 4 2HD2 LEU 4 -0.136 5.870 -3.214
30 HD23 LEU 4 3HD2 LEU 4 0.974 4.609 -2.680
31 H GLN 5 H GLN 5 -4.307 4.329 0.251
32 HA GLN 5 HA GLN 5 -3.186 2.013 1.433
33 HB2 GLN 5 2HB GLN 5 -5.265 3.919 2.524
34 HB3 GLN 5 1HB GLN 5 -4.565 2.608 3.462
35 HG2 GLN 5 2HG GLN 5 -2.313 3.647 3.025
36 HG3 GLN 5 1HG GLN 5 -3.185 5.026 2.352
37 HE21 GLN 5 1HE2 GLN 5 -4.280 6.418 3.739
38 HE22 GLN 5 2HE2 GLN 5 -4.098 6.308 5.454
39 H ARG 6 H ARG 6 -6.361 2.733 0.170
40 HA ARG 6 HA ARG 6 -7.690 0.386 0.996
41 HB2 ARG 6 2HB ARG 6 -8.075 2.096 -1.456
42 HB3 ARG 6 1HB ARG 6 -9.105 0.730 -1.090
43 HG2 ARG 6 2HG ARG 6 -8.761 3.201 0.596
44 HG3 ARG 6 1HG ARG 6 -10.133 2.819 -0.449
45 HD2 ARG 6 2HD ARG 6 -10.510 0.774 0.922
46 HD3 ARG 6 1HD ARG 6 -9.258 1.343 2.021
47 HE ARG 6 HE ARG 6 -11.492 3.108 1.464
48 HH11 ARG 6 1HH1 ARG 6 -9.808 1.025 3.765
49 HH12 ARG 6 2HH1 ARG 6 -10.820 1.385 5.076
50 HH21 ARG 6 1HH2 ARG 6 -12.907 3.633 3.279
51 HH22 ARG 6 2HH2 ARG 6 -12.642 2.883 4.779
52 H LYS 7 H LYS 7 -5.743 1.112 -1.823
53 HA LYS 7 HA LYS 7 -5.886 -1.263 -3.255
54 HB2 LYS 7 2HB LYS 7 -4.748 0.787 -4.019
55 HB3 LYS 7 1HB LYS 7 -3.502 0.536 -2.812
56 HG2 LYS 7 2HG LYS 7 -2.971 -1.629 -3.954
57 HG3 LYS 7 1HG LYS 7 -4.069 -1.125 -5.242
58 HD2 LYS 7 2HD LYS 7 -2.735 0.933 -5.524
59 HD3 LYS 7 1HD LYS 7 -1.617 0.343 -4.299
60 HE2 LYS 7 2HE LYS 7 -1.201 -1.648 -5.707
61 HE3 LYS 7 1HE LYS 7 -2.215 -0.927 -6.959
62 HZ1 LYS 7 1HZ LYS 7 0.304 0.132 -5.851
63 HZ2 LYS 7 2HZ LYS 7 -0.676 0.992 -6.933
64 HZ3 LYS 7 3HZ LYS 7 0.065 -0.450 -7.412
65 H CYS 8 H CYS 8 -3.736 -0.327 -0.651
66 HA CYS 8 HA CYS 8 -2.269 -2.698 -0.482
67 HB2 CYS 8 2HB CYS 8 -2.847 -0.586 1.573
68 HB3 CYS 8 1HB CYS 8 -1.591 -1.806 1.738
69 H LYS 9 H LYS 9 -5.236 -1.654 1.110
70 HA LYS 9 HA LYS 9 -5.379 -3.914 2.815
71 HB2 LYS 9 2HB LYS 9 -6.544 -1.794 3.314
72 HB3 LYS 9 1HB LYS 9 -7.582 -2.038 1.920
73 HG2 LYS 9 2HG LYS 9 -8.574 -3.981 2.942
74 HG3 LYS 9 1HG LYS 9 -7.448 -3.878 4.293
75 HD2 LYS 9 2HD LYS 9 -8.387 -1.759 4.965
76 HD3 LYS 9 1HD LYS 9 -9.458 -1.756 3.564
77 HE2 LYS 9 2HE LYS 9 -10.597 -3.726 4.395
78 HE3 LYS 9 1HE LYS 9 -9.468 -3.837 5.744
79 HZ1 LYS 9 1HZ LYS 9 -10.293 -1.746 6.565
80 HZ2 LYS 9 2HZ LYS 9 -11.561 -2.831 6.400
81 HZ3 LYS 9 3HZ LYS 9 -11.352 -1.595 5.266
82 H GLU 10 H GLU 10 -6.357 -3.297 -0.454
83 HA GLU 10 HA GLU 10 -7.843 -5.744 -0.713
84 HB2 GLU 10 2HB GLU 10 -6.721 -3.874 -2.808
85 HB3 GLU 10 1HB GLU 10 -7.736 -5.261 -3.165
86 HG2 GLU 10 2HG GLU 10 -9.562 -4.245 -1.903
87 HG3 GLU 10 1HG GLU 10 -8.520 -2.872 -1.528
88 H LEU 11 H LEU 11 -4.589 -4.713 -1.051
89 HA LEU 11 HA LEU 11 -3.686 -7.057 -2.474
90 HB2 LEU 11 2HB LEU 11 -2.759 -4.762 -2.810
91 HB3 LEU 11 1HB LEU 11 -2.131 -4.818 -1.183
92 HG LEU 11 HG LEU 11 -0.567 -6.584 -1.817
93 HD11 LEU 11 1HD1 LEU 11 -1.782 -6.304 -4.568
94 HD12 LEU 11 2HD1 LEU 11 -1.919 -7.717 -3.516
95 HD13 LEU 11 3HD1 LEU 11 -0.350 -7.248 -4.166
96 HD21 LEU 11 1HD2 LEU 11 -0.564 -4.256 -3.733
97 HD22 LEU 11 2HD2 LEU 11 0.825 -5.264 -3.320
98 HD23 LEU 11 3HD2 LEU 11 0.080 -4.242 -2.092
99 H DAS 12 H DAS 12 -4.156 -6.132 0.762
100 HA DAS 12 HA DAS 12 -3.274 -8.746 1.660
101 HB2 DAS 12 1HB DAS 12 -5.432 -7.906 2.475
102 HB3 DAS 12 2HB DAS 12 -4.634 -6.507 3.183
103 H THR 13 H THR 13 -1.192 -8.916 1.960
104 HA THR 13 HA THR 13 0.220 -6.644 3.118
105 HB THR 13 HB THR 13 -0.273 -8.332 4.905
106 HG1 THR 13 1HG THR 13 1.878 -7.069 4.522
107 HG21 THR 13 1HG2 THR 13 0.930 -10.488 4.885
108 HG22 THR 13 2HG2 THR 13 1.515 -10.134 3.259
109 HG23 THR 13 3HG2 THR 13 -0.210 -10.367 3.542
110 H ARG 14 H ARG 14 -0.166 -8.202 0.467
111 HA ARG 14 HA ARG 14 2.428 -9.261 -0.060
112 HB2 ARG 14 2HB ARG 14 -0.081 -8.965 -1.659
113 HB3 ARG 14 1HB ARG 14 1.433 -9.230 -2.511
114 HG2 ARG 14 2HG ARG 14 0.281 -11.335 -2.161
115 HG3 ARG 14 1HG ARG 14 1.783 -11.292 -1.259
116 HD2 ARG 14 2HD ARG 14 0.082 -12.300 0.109
117 HD3 ARG 14 1HD ARG 14 0.503 -10.732 0.779
118 HE ARG 14 HE ARG 14 -1.629 -10.155 -0.768
119 HH11 ARG 14 1HH1 ARG 14 -1.150 -12.637 1.738
120 HH12 ARG 14 2HH1 ARG 14 -2.782 -12.674 2.187
121 HH21 ARG 14 1HH2 ARG 14 -3.863 -10.206 -0.105
122 HH22 ARG 14 2HH2 ARG 14 -4.348 -11.256 1.125
123 HA DPR 15 HA DPR 15 3.769 -5.876 -2.860
124 HB2 DPR 15 1HB DPR 15 6.438 -6.422 -2.591
125 HB3 DPR 15 2HB DPR 15 5.404 -7.184 -3.803
126 HG2 DPR 15 1HG DPR 15 6.321 -8.229 -1.162
127 HG3 DPR 15 2HG DPR 15 6.176 -9.068 -2.716
128 HD2 DPR 15 1HD DPR 15 4.350 -9.330 -0.748
129 HD3 DPR 15 2HD DPR 15 3.916 -9.408 -2.467
130 H DGL 16 H DGL 16 4.532 -6.786 0.385
131 HA DGL 16 HA DGL 16 6.124 -4.647 1.268
132 HB2 DGL 16 1HB DGL 16 5.528 -6.806 2.498
133 HB3 DGL 16 2HB DGL 16 3.982 -6.086 2.876
134 HG2 DGL 16 1HG DGL 16 6.635 -4.991 3.790
135 HG3 DGL 16 2HG DGL 16 5.601 -6.032 4.747
136 H DAL 17 H DAL 17 2.644 -5.107 1.159
137 HA DAL 17 HA DAL 17 1.719 -2.815 2.388
138 HB1 DAL 17 1HB DAL 17 0.509 -4.307 0.063
139 HB2 DAL 17 2HB DAL 17 -0.353 -3.184 1.106
140 HB3 DAL 17 3HB DAL 17 0.284 -4.689 1.770
141 H DGL 18 H DGL 18 2.397 -3.341 -1.014
142 HA DGL 18 HA DGL 18 1.695 -0.933 -2.180
143 HB2 DGL 18 1HB DGL 18 2.477 -2.975 -3.361
144 HB3 DGL 18 2HB DGL 18 4.109 -2.646 -2.813
145 HG2 DGL 18 1HG DGL 18 4.061 -1.895 -5.018
146 HG3 DGL 18 2HG DGL 18 3.921 -0.441 -4.029
147 H DAR 19 H DAR 19 4.760 -1.844 -0.708
148 HA DAR 19 HA DAR 19 6.031 0.675 -1.250
149 HB2 DAR 19 1HB DAR 19 6.920 -1.690 0.378
150 HB3 DAR 19 2HB DAR 19 7.817 -0.182 0.388
151 HG2 DAR 19 1HG DAR 19 8.854 -1.702 -1.155
152 HG3 DAR 19 2HG DAR 19 8.135 -0.366 -2.049
153 HD2 DAR 19 1HD DAR 19 6.220 -1.731 -2.607
154 HD3 DAR 19 2HD DAR 19 6.911 -3.085 -1.720
155 HE DAR 19 HE DAR 19 8.770 -2.235 -3.605
156 HH11 DAR 19 1HH2 DAR 19 9.062 -3.409 -5.631
157 HH12 DAR 19 2HH2 DAR 19 7.821 -4.421 -6.186
158 HH21 DAR 19 1HH1 DAR 19 5.606 -3.794 -3.507
159 HH22 DAR 19 2HH1 DAR 19 5.803 -4.632 -4.982
160 H DLY 20 H DLY 20 4.700 -0.871 1.600
161 HA DLY 20 HA DLY 20 5.193 0.990 3.567
162 HB2 DLY 20 1HB DLY 20 4.172 -1.146 4.060
163 HB3 DLY 20 2HB DLY 20 2.784 -0.775 3.063
164 HG2 DLY 20 1HG DLY 20 2.123 -0.638 5.338
165 HG3 DLY 20 2HG DLY 20 2.118 0.979 4.656
166 HD2 DLY 20 1HD DLY 20 3.041 1.283 6.756
167 HD3 DLY 20 2HD DLY 20 4.433 1.265 5.687
168 HE2 DLY 20 1HE DLY 20 3.518 -1.169 7.206
169 HE3 DLY 20 2HE DLY 20 4.676 -0.025 7.861
170 HZ1 DLY 20 1HZ DLY 20 6.124 -0.500 5.957
171 HZ2 DLY 20 2HZ DLY 20 5.113 -1.781 5.473
172 HZ3 DLY 20 3HZ DLY 20 5.866 -1.790 6.963
173 H DCY 21 H DCY 21 2.591 0.962 1.192
174 HA DCY 21 HA DCY 21 1.424 3.359 2.177
175 HB2 DCY 21 1HB DCY 21 1.024 1.748 -0.310
176 HB3 DCY 21 2HB DCY 21 0.028 3.148 0.088
177 H DAR 22 H DAR 22 3.234 2.607 -0.846
178 HA DAR 22 HA DAR 22 2.946 5.238 -1.849
179 HB2 DAR 22 1HB DAR 22 4.305 4.599 -3.705
180 HB3 DAR 22 2HB DAR 22 3.298 3.221 -3.289
181 HG2 DAR 22 1HG DAR 22 5.128 2.164 -2.170
182 HG3 DAR 22 2HG DAR 22 6.171 3.551 -2.456
183 HD2 DAR 22 1HD DAR 22 5.823 3.149 -4.932
184 HD3 DAR 22 2HD DAR 22 5.084 1.608 -4.471
185 HE DAR 22 HE DAR 22 7.651 2.151 -3.322
186 HH11 DAR 22 1HH1 DAR 22 6.003 0.638 -6.107
187 HH12 DAR 22 2HH1 DAR 22 7.305 -0.389 -6.490
188 HH21 DAR 22 1HH2 DAR 22 9.433 0.689 -3.887
189 HH22 DAR 22 2HH2 DAR 22 9.277 -0.364 -5.214
190 H DGL 23 H DGL 23 5.543 3.802 0.089
191 HA DGL 23 HA DGL 23 7.431 5.807 -0.629
192 HB2 DGL 23 1HB DGL 23 7.434 3.974 1.767
193 HB3 DGL 23 2HB DGL 23 8.787 4.962 1.245
194 HG2 DGL 23 1HG DGL 23 7.569 2.635 -0.218
195 HG3 DGL 23 2HG DGL 23 9.157 2.705 0.535
196 H DGL 24 H DGL 24 5.032 5.540 1.846
197 HA DGL 24 HA DGL 24 6.040 7.927 3.148
198 HB2 DGL 24 1HB DGL 24 3.781 6.073 3.858
199 HB3 DGL 24 2HB DGL 24 4.122 7.552 4.739
200 HG2 DGL 24 1HG DGL 24 6.360 6.697 5.277
201 HG3 DGL 24 2HG DGL 24 5.965 5.196 4.439
202 H SER 25 H SER 25 2.879 6.870 1.921
203 HA SER 25 HA SER 25 2.192 9.658 1.717
204 HB2 SER 25 2HB SER 25 1.007 9.068 -0.496
205 HB3 SER 25 1HB SER 25 2.759 9.242 -0.538
206 HG SER 25 HG SER 25 2.053 6.682 0.027
207 H ASP 26 H ASP 26 0.193 10.100 2.399
208 HA ASP 26 HA ASP 26 -1.157 7.900 3.743
209 HB2 ASP 26 2HB ASP 26 -2.441 9.630 4.927
210 HB3 ASP 26 1HB ASP 26 -0.710 9.892 5.071
Start of MODEL 16
1 H ASN 1 H ASN 1 -1.529 8.844 0.303
2 HA ASN 1 HA ASN 1 -4.137 9.687 -0.348
3 HB2 ASN 1 2HB ASN 1 -2.392 9.392 -2.066
4 HB3 ASN 1 1HB ASN 1 -2.460 7.646 -1.824
5 HD21 ASN 1 1HD2 ASN 1 -4.025 10.406 -3.147
6 HD22 ASN 1 2HD2 ASN 1 -5.246 9.557 -4.012
7 HA PRO 2 HA PRO 2 -6.402 6.479 1.674
8 HB2 PRO 2 2HB PRO 2 -8.817 6.935 0.420
9 HB3 PRO 2 1HB PRO 2 -8.225 7.844 1.813
10 HG2 PRO 2 2HG PRO 2 -8.122 8.542 -1.089
11 HG3 PRO 2 1HG PRO 2 -8.477 9.584 0.300
12 HD2 PRO 2 2HD PRO 2 -6.095 9.597 -0.911
13 HD3 PRO 2 1HD PRO 2 -6.238 9.815 0.848
14 H GLU 3 H GLU 3 -6.487 6.794 -1.849
15 HA GLU 3 HA GLU 3 -7.674 4.225 -2.189
16 HB2 GLU 3 2HB GLU 3 -6.320 5.997 -4.219
17 HB3 GLU 3 1HB GLU 3 -7.214 4.530 -4.599
18 HG2 GLU 3 2HG GLU 3 -8.292 7.073 -3.416
19 HG3 GLU 3 1HG GLU 3 -8.642 6.390 -5.005
20 H LEU 4 H LEU 4 -4.420 5.472 -2.227
21 HA LEU 4 HA LEU 4 -3.191 3.039 -2.988
22 HB2 LEU 4 2HB LEU 4 -2.215 5.529 -1.650
23 HB3 LEU 4 1HB LEU 4 -1.197 4.114 -1.617
24 HG LEU 4 HG LEU 4 -1.109 4.102 -4.078
25 HD11 LEU 4 1HD1 LEU 4 -2.756 6.613 -3.926
26 HD12 LEU 4 2HD1 LEU 4 -3.262 5.067 -4.607
27 HD13 LEU 4 3HD1 LEU 4 -1.965 5.987 -5.370
28 HD21 LEU 4 1HD2 LEU 4 0.244 6.107 -4.371
29 HD22 LEU 4 2HD2 LEU 4 0.586 5.321 -2.827
30 HD23 LEU 4 3HD2 LEU 4 -0.411 6.772 -2.877
31 H GLN 5 H GLN 5 -4.097 4.425 0.103
32 HA GLN 5 HA GLN 5 -3.060 2.356 1.711
33 HB2 GLN 5 2HB GLN 5 -5.451 4.146 2.195
34 HB3 GLN 5 1HB GLN 5 -4.696 3.143 3.426
35 HG2 GLN 5 2HG GLN 5 -2.623 4.412 3.215
36 HG3 GLN 5 1HG GLN 5 -3.337 5.385 1.935
37 HE21 GLN 5 1HE2 GLN 5 -5.929 5.505 3.323
38 HE22 GLN 5 2HE2 GLN 5 -5.722 6.633 4.598
39 H ARG 6 H ARG 6 -6.229 2.760 0.170
40 HA ARG 6 HA ARG 6 -7.443 0.375 1.043
41 HB2 ARG 6 2HB ARG 6 -7.814 1.835 -1.569
42 HB3 ARG 6 1HB ARG 6 -8.834 0.522 -1.017
43 HG2 ARG 6 2HG ARG 6 -9.481 1.888 0.921
44 HG3 ARG 6 1HG ARG 6 -8.514 3.215 0.270
45 HD2 ARG 6 2HD ARG 6 -10.866 3.454 -0.322
46 HD3 ARG 6 1HD ARG 6 -9.865 3.218 -1.760
47 HE ARG 6 HE ARG 6 -11.129 0.905 -0.545
48 HH11 ARG 6 1HH1 ARG 6 -11.045 3.186 -3.293
49 HH12 ARG 6 2HH1 ARG 6 -12.130 2.275 -4.226
50 HH21 ARG 6 1HH2 ARG 6 -12.583 -0.326 -1.901
51 HH22 ARG 6 2HH2 ARG 6 -13.006 0.249 -3.443
52 H LYS 7 H LYS 7 -5.331 1.049 -1.640
53 HA LYS 7 HA LYS 7 -5.479 -1.339 -3.078
54 HB2 LYS 7 2HB LYS 7 -4.419 0.769 -3.822
55 HB3 LYS 7 1HB LYS 7 -3.127 0.507 -2.670
56 HG2 LYS 7 2HG LYS 7 -2.469 -1.509 -3.889
57 HG3 LYS 7 1HG LYS 7 -3.751 -1.204 -5.065
58 HD2 LYS 7 2HD LYS 7 -2.734 1.025 -5.505
59 HD3 LYS 7 1HD LYS 7 -1.399 0.582 -4.445
60 HE2 LYS 7 2HE LYS 7 -0.734 0.191 -6.718
61 HE3 LYS 7 1HE LYS 7 -0.954 -1.357 -5.910
62 HZ1 LYS 7 1HZ LYS 7 -2.923 -0.064 -7.710
63 HZ2 LYS 7 2HZ LYS 7 -3.124 -1.561 -6.960
64 HZ3 LYS 7 3HZ LYS 7 -1.929 -1.363 -8.115
65 H CYS 8 H CYS 8 -3.377 -0.383 -0.424
66 HA CYS 8 HA CYS 8 -1.885 -2.763 -0.269
67 HB2 CYS 8 2HB CYS 8 -2.540 -0.793 1.902
68 HB3 CYS 8 1HB CYS 8 -1.219 -1.962 1.910
69 H LYS 9 H LYS 9 -4.937 -1.771 1.096
70 HA LYS 9 HA LYS 9 -5.072 -4.062 2.812
71 HB2 LYS 9 2HB LYS 9 -7.083 -1.922 2.150
72 HB3 LYS 9 1HB LYS 9 -7.345 -3.194 3.342
73 HG2 LYS 9 2HG LYS 9 -5.379 -2.405 4.595
74 HG3 LYS 9 1HG LYS 9 -5.156 -1.134 3.405
75 HD2 LYS 9 2HD LYS 9 -7.248 -0.126 3.996
76 HD3 LYS 9 1HD LYS 9 -7.630 -1.476 5.069
77 HE2 LYS 9 2HE LYS 9 -5.264 0.359 5.423
78 HE3 LYS 9 1HE LYS 9 -6.800 0.548 6.262
79 HZ1 LYS 9 1HZ LYS 9 -5.181 -0.602 7.611
80 HZ2 LYS 9 2HZ LYS 9 -5.012 -1.829 6.480
81 HZ3 LYS 9 3HZ LYS 9 -6.476 -1.614 7.287
82 H GLU 10 H GLU 10 -5.912 -3.305 -0.372
83 HA GLU 10 HA GLU 10 -7.811 -5.368 -0.859
84 HB2 GLU 10 2HB GLU 10 -7.544 -3.302 -2.223
85 HB3 GLU 10 1HB GLU 10 -5.958 -3.857 -2.717
86 HG2 GLU 10 2HG GLU 10 -7.483 -4.252 -4.482
87 HG3 GLU 10 1HG GLU 10 -7.033 -5.805 -3.779
88 H LEU 11 H LEU 11 -4.334 -4.928 -1.191
89 HA LEU 11 HA LEU 11 -3.841 -7.580 -2.195
90 HB2 LEU 11 2HB LEU 11 -1.958 -5.463 -1.166
91 HB3 LEU 11 1HB LEU 11 -1.449 -6.952 -1.925
92 HG LEU 11 HG LEU 11 -3.018 -4.745 -3.262
93 HD11 LEU 11 1HD1 LEU 11 -0.958 -4.362 -4.523
94 HD12 LEU 11 2HD1 LEU 11 -0.140 -5.589 -3.558
95 HD13 LEU 11 3HD1 LEU 11 -0.719 -4.108 -2.794
96 HD21 LEU 11 1HD2 LEU 11 -3.578 -6.928 -4.200
97 HD22 LEU 11 2HD2 LEU 11 -1.866 -7.308 -4.373
98 HD23 LEU 11 3HD2 LEU 11 -2.580 -6.015 -5.333
99 H DAS 12 H DAS 12 -3.619 -5.972 0.924
100 HA DAS 12 HA DAS 12 -3.326 -8.593 2.204
101 HB2 DAS 12 1HB DAS 12 -5.265 -7.277 2.933
102 HB3 DAS 12 2HB DAS 12 -4.214 -5.923 3.322
103 H THR 13 H THR 13 -1.231 -9.041 2.439
104 HA THR 13 HA THR 13 0.502 -6.896 3.448
105 HB THR 13 HB THR 13 0.268 -8.855 5.003
106 HG1 THR 13 1HG THR 13 2.492 -7.678 4.294
107 HG21 THR 13 1HG2 THR 13 1.332 -11.004 4.411
108 HG22 THR 13 2HG2 THR 13 1.611 -10.400 2.778
109 HG23 THR 13 3HG2 THR 13 -0.035 -10.641 3.358
110 H ARG 14 H ARG 14 -0.334 -8.338 0.723
111 HA ARG 14 HA ARG 14 2.206 -9.010 -0.425
112 HB2 ARG 14 2HB ARG 14 -0.536 -8.686 -1.676
113 HB3 ARG 14 1HB ARG 14 0.880 -9.290 -2.523
114 HG2 ARG 14 2HG ARG 14 -0.481 -10.574 -0.164
115 HG3 ARG 14 1HG ARG 14 -0.559 -11.119 -1.838
116 HD2 ARG 14 2HD ARG 14 1.878 -11.036 -0.068
117 HD3 ARG 14 1HD ARG 14 1.016 -12.474 -0.611
118 HE ARG 14 HE ARG 14 1.694 -11.258 -2.906
119 HH11 ARG 14 1HH1 ARG 14 3.527 -12.402 -0.118
120 HH12 ARG 14 2HH1 ARG 14 4.987 -12.601 -0.975
121 HH21 ARG 14 1HH2 ARG 14 3.722 -11.499 -4.097
122 HH22 ARG 14 2HH2 ARG 14 5.095 -12.051 -3.277
123 HA DPR 15 HA DPR 15 2.336 -5.174 -3.086
124 HB2 DPR 15 1HB DPR 15 4.818 -5.565 -4.089
125 HB3 DPR 15 2HB DPR 15 3.381 -6.291 -4.817
126 HG2 DPR 15 1HG DPR 15 5.373 -7.510 -2.937
127 HG3 DPR 15 2HG DPR 15 4.688 -8.186 -4.426
128 HD2 DPR 15 1HD DPR 15 3.760 -8.876 -1.987
129 HD3 DPR 15 2HD DPR 15 2.710 -8.755 -3.408
130 H DGL 16 H DGL 16 4.311 -6.594 -0.638
131 HA DGL 16 HA DGL 16 6.109 -4.448 -0.185
132 HB2 DGL 16 1HB DGL 16 6.367 -6.787 0.678
133 HB3 DGL 16 2HB DGL 16 5.084 -6.458 1.830
134 HG2 DGL 16 1HG DGL 16 7.233 -6.271 2.907
135 HG3 DGL 16 2HG DGL 16 6.448 -4.695 2.839
136 H DAL 17 H DAL 17 2.862 -5.168 0.843
137 HA DAL 17 HA DAL 17 2.589 -3.146 2.788
138 HB1 DAL 17 1HB DAL 17 0.458 -4.349 1.017
139 HB2 DAL 17 2HB DAL 17 0.185 -3.445 2.511
140 HB3 DAL 17 3HB DAL 17 0.999 -5.005 2.559
141 H DGL 18 H DGL 18 1.911 -3.273 -0.688
142 HA DGL 18 HA DGL 18 0.929 -0.678 -1.109
143 HB2 DGL 18 1HB DGL 18 0.985 -2.467 -2.872
144 HB3 DGL 18 2HB DGL 18 2.728 -2.262 -2.979
145 HG2 DGL 18 1HG DGL 18 2.075 0.246 -3.431
146 HG3 DGL 18 2HG DGL 18 0.542 -0.465 -3.917
147 H DAR 19 H DAR 19 4.151 -1.975 -1.033
148 HA DAR 19 HA DAR 19 5.619 0.225 -1.839
149 HB2 DAR 19 1HB DAR 19 6.329 -2.223 -1.498
150 HB3 DAR 19 2HB DAR 19 6.573 -1.793 0.188
151 HG2 DAR 19 1HG DAR 19 8.665 -1.721 -1.032
152 HG3 DAR 19 2HG DAR 19 8.207 -0.107 -0.476
153 HD2 DAR 19 1HD DAR 19 9.040 -0.154 -2.818
154 HD3 DAR 19 2HD DAR 19 7.410 0.486 -2.661
155 HE DAR 19 HE DAR 19 8.095 -2.223 -3.592
156 HH11 DAR 19 1HH2 DAR 19 6.566 -3.184 -5.112
157 HH12 DAR 19 2HH2 DAR 19 5.233 -2.277 -5.651
158 HH21 DAR 19 1HH1 DAR 19 5.965 0.651 -3.834
159 HH22 DAR 19 2HH1 DAR 19 4.859 -0.158 -4.874
160 H DLY 20 H DLY 20 4.784 -0.883 1.431
161 HA DLY 20 HA DLY 20 6.032 1.204 2.821
162 HB2 DLY 20 1HB DLY 20 5.163 -0.922 3.837
163 HB3 DLY 20 2HB DLY 20 3.542 -0.261 3.684
164 HG2 DLY 20 1HG DLY 20 4.219 1.634 5.106
165 HG3 DLY 20 2HG DLY 20 5.798 0.878 5.313
166 HD2 DLY 20 1HD DLY 20 4.669 -1.108 6.272
167 HD3 DLY 20 2HD DLY 20 3.142 -0.225 6.184
168 HE2 DLY 20 1HE DLY 20 4.121 1.543 7.588
169 HE3 DLY 20 2HE DLY 20 5.598 0.593 7.724
170 HZ1 DLY 20 1HZ DLY 20 4.285 -1.177 8.747
171 HZ2 DLY 20 2HZ DLY 20 2.922 -0.180 8.741
172 HZ3 DLY 20 3HZ DLY 20 4.280 0.243 9.639
173 H DCY 21 H DCY 21 2.705 0.877 1.634
174 HA DCY 21 HA DCY 21 1.696 3.272 2.662
175 HB2 DCY 21 1HB DCY 21 0.965 1.927 0.080
176 HB3 DCY 21 2HB DCY 21 0.003 3.151 0.901
177 H DAR 22 H DAR 22 3.174 2.625 -0.490
178 HA DAR 22 HA DAR 22 2.897 5.285 -1.432
179 HB2 DAR 22 1HB DAR 22 4.683 3.031 -2.312
180 HB3 DAR 22 2HB DAR 22 4.571 4.566 -3.163
181 HG2 DAR 22 1HG DAR 22 2.259 4.185 -3.659
182 HG3 DAR 22 2HG DAR 22 2.236 2.737 -2.651
183 HD2 DAR 22 1HD DAR 22 2.370 2.152 -5.003
184 HD3 DAR 22 2HD DAR 22 3.824 1.657 -4.147
185 HE DAR 22 HE DAR 22 4.303 4.168 -5.218
186 HH11 DAR 22 1HH1 DAR 22 3.763 0.821 -6.385
187 HH12 DAR 22 2HH1 DAR 22 4.608 1.082 -7.828
188 HH21 DAR 22 1HH2 DAR 22 5.466 4.454 -7.195
189 HH22 DAR 22 2HH2 DAR 22 5.565 3.181 -8.321
190 H DGL 23 H DGL 23 5.310 3.680 0.452
191 HA DGL 23 HA DGL 23 7.322 5.615 0.226
192 HB2 DGL 23 1HB DGL 23 7.706 3.351 1.062
193 HB3 DGL 23 2HB DGL 23 6.685 3.676 2.450
194 HG2 DGL 23 1HG DGL 23 8.234 5.314 3.259
195 HG3 DGL 23 2HG DGL 23 9.267 5.076 1.851
196 H DGL 24 H DGL 24 4.696 5.188 2.575
197 HA DGL 24 HA DGL 24 5.433 7.578 3.993
198 HB2 DGL 24 1HB DGL 24 2.921 5.932 4.233
199 HB3 DGL 24 2HB DGL 24 3.457 7.171 5.355
200 HG2 DGL 24 1HG DGL 24 5.482 5.805 5.798
201 HG3 DGL 24 2HG DGL 24 4.773 4.531 4.805
202 H SER 25 H SER 25 2.797 6.669 1.824
203 HA SER 25 HA SER 25 2.278 9.504 1.396
204 HB2 SER 25 2HB SER 25 0.950 8.786 -0.571
205 HB3 SER 25 1HB SER 25 2.566 8.095 -0.643
206 HG SER 25 HG SER 25 1.590 6.192 0.342
207 H ASP 26 H ASP 26 -0.056 10.149 1.319
208 HA ASP 26 HA ASP 26 -1.498 8.750 3.476
209 HB2 ASP 26 2HB ASP 26 -2.535 10.892 4.042
210 HB3 ASP 26 1HB ASP 26 -0.781 11.018 4.100
Start of MODEL 17
1 H ASN 1 H ASN 1 -2.278 7.525 1.191
2 HA ASN 1 HA ASN 1 -3.955 9.450 -0.259
3 HB2 ASN 1 2HB ASN 1 -2.076 7.339 -1.364
4 HB3 ASN 1 1HB ASN 1 -3.292 8.181 -2.312
5 HD21 ASN 1 1HD2 ASN 1 -0.345 8.087 -2.527
6 HD22 ASN 1 2HD2 ASN 1 0.171 9.727 -2.492
7 HA PRO 2 HA PRO 2 -7.002 6.459 1.262
8 HB2 PRO 2 2HB PRO 2 -8.458 7.846 -0.953
9 HB3 PRO 2 1HB PRO 2 -9.034 7.404 0.659
10 HG2 PRO 2 2HG PRO 2 -8.307 9.889 0.177
11 HG3 PRO 2 1HG PRO 2 -7.835 9.109 1.697
12 HD2 PRO 2 2HD PRO 2 -6.185 9.736 -0.702
13 HD3 PRO 2 1HD PRO 2 -5.722 9.699 1.011
14 H GLU 3 H GLU 3 -6.777 6.950 -2.273
15 HA GLU 3 HA GLU 3 -7.926 4.405 -2.809
16 HB2 GLU 3 2HB GLU 3 -6.522 6.362 -4.627
17 HB3 GLU 3 1HB GLU 3 -7.087 4.807 -5.198
18 HG2 GLU 3 2HG GLU 3 -8.679 6.538 -5.766
19 HG3 GLU 3 1HG GLU 3 -9.386 5.422 -4.610
20 H LEU 4 H LEU 4 -4.624 5.495 -2.507
21 HA LEU 4 HA LEU 4 -3.451 3.078 -3.463
22 HB2 LEU 4 2HB LEU 4 -2.217 5.212 -3.368
23 HB3 LEU 4 1HB LEU 4 -2.360 5.212 -1.624
24 HG LEU 4 HG LEU 4 -0.936 3.197 -1.529
25 HD11 LEU 4 1HD1 LEU 4 0.318 2.512 -3.516
26 HD12 LEU 4 2HD1 LEU 4 -0.635 3.625 -4.498
27 HD13 LEU 4 3HD1 LEU 4 -1.414 2.250 -3.711
28 HD21 LEU 4 1HD2 LEU 4 1.154 4.334 -2.091
29 HD22 LEU 4 2HD2 LEU 4 0.031 5.420 -1.268
30 HD23 LEU 4 3HD2 LEU 4 0.253 5.536 -3.014
31 H GLN 5 H GLN 5 -4.214 4.407 -0.305
32 HA GLN 5 HA GLN 5 -3.331 2.321 1.319
33 HB2 GLN 5 2HB GLN 5 -5.474 4.402 1.681
34 HB3 GLN 5 1HB GLN 5 -5.088 3.240 2.940
35 HG2 GLN 5 2HG GLN 5 -3.080 5.118 1.719
36 HG3 GLN 5 1HG GLN 5 -3.979 5.457 3.197
37 HE21 GLN 5 1HE2 GLN 5 -3.557 4.253 5.012
38 HE22 GLN 5 2HE2 GLN 5 -2.092 3.360 5.218
39 H ARG 6 H ARG 6 -6.422 2.825 -0.283
40 HA ARG 6 HA ARG 6 -7.893 0.670 0.651
41 HB2 ARG 6 2HB ARG 6 -8.894 2.312 -0.805
42 HB3 ARG 6 1HB ARG 6 -7.773 1.912 -2.092
43 HG2 ARG 6 2HG ARG 6 -8.773 -0.331 -2.255
44 HG3 ARG 6 1HG ARG 6 -9.942 0.123 -1.013
45 HD2 ARG 6 2HD ARG 6 -10.851 1.830 -2.415
46 HD3 ARG 6 1HD ARG 6 -9.573 1.601 -3.600
47 HE ARG 6 HE ARG 6 -10.564 -0.769 -3.681
48 HH11 ARG 6 1HH1 ARG 6 -12.488 2.165 -3.220
49 HH12 ARG 6 2HH1 ARG 6 -13.746 1.710 -4.251
50 HH21 ARG 6 1HH2 ARG 6 -12.348 -1.456 -5.109
51 HH22 ARG 6 2HH2 ARG 6 -13.650 -0.385 -5.367
52 H LYS 7 H LYS 7 -5.774 0.824 -2.186
53 HA LYS 7 HA LYS 7 -5.982 -1.817 -2.996
54 HB2 LYS 7 2HB LYS 7 -4.986 -0.121 -4.417
55 HB3 LYS 7 1HB LYS 7 -3.670 0.103 -3.278
56 HG2 LYS 7 2HG LYS 7 -2.895 -2.170 -3.718
57 HG3 LYS 7 1HG LYS 7 -4.218 -2.399 -4.861
58 HD2 LYS 7 2HD LYS 7 -3.353 -0.680 -6.291
59 HD3 LYS 7 1HD LYS 7 -2.117 -0.256 -5.106
60 HE2 LYS 7 2HE LYS 7 -1.174 -1.594 -6.894
61 HE3 LYS 7 1HE LYS 7 -1.100 -2.453 -5.365
62 HZ1 LYS 7 1HZ LYS 7 -1.773 -3.909 -7.129
63 HZ2 LYS 7 2HZ LYS 7 -3.076 -2.933 -7.543
64 HZ3 LYS 7 3HZ LYS 7 -3.077 -3.752 -6.085
65 H CYS 8 H CYS 8 -3.640 -0.327 -0.818
66 HA CYS 8 HA CYS 8 -2.102 -2.597 -0.309
67 HB2 CYS 8 2HB CYS 8 -2.704 -0.267 1.474
68 HB3 CYS 8 1HB CYS 8 -1.410 -1.430 1.743
69 H LYS 9 H LYS 9 -5.035 -1.443 1.342
70 HA LYS 9 HA LYS 9 -4.885 -3.500 3.346
71 HB2 LYS 9 2HB LYS 9 -5.931 -1.250 3.714
72 HB3 LYS 9 1HB LYS 9 -7.232 -1.714 2.633
73 HG2 LYS 9 2HG LYS 9 -7.852 -3.529 4.182
74 HG3 LYS 9 1HG LYS 9 -6.551 -3.035 5.260
75 HD2 LYS 9 2HD LYS 9 -8.875 -1.283 4.447
76 HD3 LYS 9 1HD LYS 9 -8.789 -2.188 5.953
77 HE2 LYS 9 2HE LYS 9 -6.874 -0.009 5.092
78 HE3 LYS 9 1HE LYS 9 -8.197 0.194 6.229
79 HZ1 LYS 9 1HZ LYS 9 -6.089 -0.102 7.374
80 HZ2 LYS 9 2HZ LYS 9 -5.826 -1.586 6.656
81 HZ3 LYS 9 3HZ LYS 9 -7.108 -1.386 7.723
82 H GLU 10 H GLU 10 -6.189 -3.194 0.195
83 HA GLU 10 HA GLU 10 -7.966 -5.446 0.290
84 HB2 GLU 10 2HB GLU 10 -8.165 -3.459 -1.250
85 HB3 GLU 10 1HB GLU 10 -6.727 -4.024 -2.076
86 HG2 GLU 10 2HG GLU 10 -7.929 -6.100 -2.650
87 HG3 GLU 10 1HG GLU 10 -9.378 -5.421 -1.907
88 H LEU 11 H LEU 11 -4.643 -4.799 -0.510
89 HA LEU 11 HA LEU 11 -4.014 -7.362 -1.640
90 HB2 LEU 11 2HB LEU 11 -2.302 -5.147 -0.545
91 HB3 LEU 11 1HB LEU 11 -1.634 -6.590 -1.255
92 HG LEU 11 HG LEU 11 -3.321 -4.538 -2.681
93 HD11 LEU 11 1HD1 LEU 11 -1.103 -3.719 -2.109
94 HD12 LEU 11 2HD1 LEU 11 -1.238 -4.012 -3.842
95 HD13 LEU 11 3HD1 LEU 11 -0.378 -5.161 -2.820
96 HD21 LEU 11 1HD2 LEU 11 -1.919 -7.010 -3.678
97 HD22 LEU 11 2HD2 LEU 11 -2.632 -5.766 -4.694
98 HD23 LEU 11 3HD2 LEU 11 -3.663 -6.732 -3.637
99 H DAS 12 H DAS 12 -3.515 -5.791 1.448
100 HA DAS 12 HA DAS 12 -3.073 -8.408 2.663
101 HB2 DAS 12 1HB DAS 12 -4.848 -7.218 3.741
102 HB3 DAS 12 2HB DAS 12 -3.902 -5.739 3.821
103 H THR 13 H THR 13 -1.036 -8.915 2.952
104 HA THR 13 HA THR 13 0.874 -6.767 3.509
105 HB THR 13 HB THR 13 0.767 -8.734 5.096
106 HG1 THR 13 1HG THR 13 2.916 -7.614 4.033
107 HG21 THR 13 1HG2 THR 13 1.850 -10.267 2.724
108 HG22 THR 13 2HG2 THR 13 0.283 -10.520 3.493
109 HG23 THR 13 3HG2 THR 13 1.770 -10.880 4.372
110 H ARG 14 H ARG 14 -0.385 -8.236 0.989
111 HA ARG 14 HA ARG 14 1.790 -9.203 -0.549
112 HB2 ARG 14 2HB ARG 14 -1.019 -8.404 -1.293
113 HB3 ARG 14 1HB ARG 14 0.123 -9.074 -2.448
114 HG2 ARG 14 2HG ARG 14 0.265 -11.093 -1.157
115 HG3 ARG 14 1HG ARG 14 -0.807 -10.418 0.074
116 HD2 ARG 14 2HD ARG 14 -2.610 -10.295 -1.535
117 HD3 ARG 14 1HD ARG 14 -1.545 -10.863 -2.818
118 HE ARG 14 HE ARG 14 -1.515 -12.710 -0.731
119 HH11 ARG 14 1HH1 ARG 14 -3.698 -11.569 -3.298
120 HH12 ARG 14 2HH1 ARG 14 -4.606 -13.009 -3.352
121 HH21 ARG 14 1HH2 ARG 14 -2.769 -14.707 -0.860
122 HH22 ARG 14 2HH2 ARG 14 -4.072 -14.799 -1.953
123 HA DPR 15 HA DPR 15 2.291 -5.577 -3.352
124 HB2 DPR 15 1HB DPR 15 4.866 -6.845 -3.975
125 HB3 DPR 15 2HB DPR 15 3.541 -6.410 -5.059
126 HG2 DPR 15 1HG DPR 15 4.106 -8.971 -4.507
127 HG3 DPR 15 2HG DPR 15 2.442 -8.409 -4.743
128 HD2 DPR 15 1HD DPR 15 3.925 -8.898 -2.186
129 HD3 DPR 15 2HD DPR 15 2.292 -9.428 -2.652
130 H DGL 16 H DGL 16 4.023 -6.768 -0.663
131 HA DGL 16 HA DGL 16 6.068 -4.773 -0.568
132 HB2 DGL 16 1HB DGL 16 6.217 -6.854 0.748
133 HB3 DGL 16 2HB DGL 16 4.818 -6.358 1.688
134 HG2 DGL 16 1HG DGL 16 6.786 -5.931 2.979
135 HG3 DGL 16 2HG DGL 16 6.108 -4.390 2.470
136 H DAL 17 H DAL 17 2.740 -5.008 0.401
137 HA DAL 17 HA DAL 17 2.546 -2.843 2.135
138 HB1 DAL 17 1HB DAL 17 0.444 -3.869 0.228
139 HB2 DAL 17 2HB DAL 17 0.160 -2.864 1.650
140 HB3 DAL 17 3HB DAL 17 0.766 -4.508 1.839
141 H DGL 18 H DGL 18 2.506 -3.016 -1.353
142 HA DGL 18 HA DGL 18 1.661 -0.418 -1.975
143 HB2 DGL 18 1HB DGL 18 3.610 -2.188 -3.446
144 HB3 DGL 18 2HB DGL 18 2.847 -0.755 -4.115
145 HG2 DGL 18 1HG DGL 18 0.670 -1.788 -3.843
146 HG3 DGL 18 2HG DGL 18 1.440 -3.226 -3.179
147 H DAR 19 H DAR 19 4.873 -1.718 -1.355
148 HA DAR 19 HA DAR 19 6.225 0.729 -1.895
149 HB2 DAR 19 1HB DAR 19 7.190 -1.702 -0.374
150 HB3 DAR 19 2HB DAR 19 8.201 -0.351 -0.869
151 HG2 DAR 19 1HG DAR 19 7.538 -0.846 -3.231
152 HG3 DAR 19 2HG DAR 19 6.778 -2.318 -2.635
153 HD2 DAR 19 1HD DAR 19 9.683 -1.615 -2.296
154 HD3 DAR 19 2HD DAR 19 9.044 -2.689 -3.530
155 HE DAR 19 HE DAR 19 8.501 -3.428 -0.750
156 HH11 DAR 19 1HH2 DAR 19 9.442 -5.437 -0.018
157 HH12 DAR 19 2HH2 DAR 19 10.521 -6.284 -1.026
158 HH21 DAR 19 1HH1 DAR 19 10.425 -3.942 -3.690
159 HH22 DAR 19 2HH1 DAR 19 11.092 -5.410 -3.152
160 H DLY 20 H DLY 20 5.025 -0.854 0.970
161 HA DLY 20 HA DLY 20 6.040 0.966 2.855
162 HB2 DLY 20 1HB DLY 20 5.078 -1.266 3.422
163 HB3 DLY 20 2HB DLY 20 3.484 -0.653 3.014
164 HG2 DLY 20 1HG DLY 20 3.633 0.980 4.821
165 HG3 DLY 20 2HG DLY 20 5.243 0.382 5.223
166 HD2 DLY 20 1HD DLY 20 4.301 -1.827 5.709
167 HD3 DLY 20 2HD DLY 20 2.688 -1.214 5.346
168 HE2 DLY 20 1HE DLY 20 2.914 0.429 7.161
169 HE3 DLY 20 2HE DLY 20 4.516 -0.206 7.527
170 HZ1 DLY 20 1HZ DLY 20 3.503 -2.344 8.075
171 HZ2 DLY 20 2HZ DLY 20 1.971 -1.722 7.746
172 HZ3 DLY 20 3HZ DLY 20 2.871 -1.117 9.023
173 H DCY 21 H DCY 21 2.986 0.899 1.022
174 HA DCY 21 HA DCY 21 1.910 3.211 2.192
175 HB2 DCY 21 1HB DCY 21 1.342 1.914 -0.464
176 HB3 DCY 21 2HB DCY 21 0.388 3.229 0.231
177 H DAR 22 H DAR 22 4.061 2.767 -0.531
178 HA DAR 22 HA DAR 22 3.905 5.459 -1.428
179 HB2 DAR 22 1HB DAR 22 6.149 3.458 -1.715
180 HB3 DAR 22 2HB DAR 22 6.087 5.013 -2.531
181 HG2 DAR 22 1HG DAR 22 4.157 2.744 -2.924
182 HG3 DAR 22 2HG DAR 22 5.445 3.241 -4.027
183 HD2 DAR 22 1HD DAR 22 4.375 5.431 -4.274
184 HD3 DAR 22 2HD DAR 22 3.060 4.882 -3.231
185 HE DAR 22 HE DAR 22 3.472 3.127 -5.397
186 HH11 DAR 22 1HH1 DAR 22 1.962 6.217 -4.538
187 HH12 DAR 22 2HH1 DAR 22 0.823 6.154 -5.808
188 HH21 DAR 22 1HH2 DAR 22 1.928 3.075 -7.138
189 HH22 DAR 22 2HH2 DAR 22 0.800 4.332 -7.319
190 H DGL 23 H DGL 23 5.975 3.771 0.843
191 HA DGL 23 HA DGL 23 7.664 5.944 1.412
192 HB2 DGL 23 1HB DGL 23 8.241 3.606 1.869
193 HB3 DGL 23 2HB DGL 23 6.982 3.528 3.084
194 HG2 DGL 23 1HG DGL 23 8.143 5.098 4.478
195 HG3 DGL 23 2HG DGL 23 9.367 5.349 3.234
196 H DGL 24 H DGL 24 4.603 4.894 2.797
197 HA DGL 24 HA DGL 24 4.701 6.828 4.927
198 HB2 DGL 24 1HB DGL 24 2.394 5.136 3.965
199 HB3 DGL 24 2HB DGL 24 2.397 6.112 5.424
200 HG2 DGL 24 1HG DGL 24 4.147 3.735 4.870
201 HG3 DGL 24 2HG DGL 24 2.760 3.786 5.955
202 H SER 25 H SER 25 2.572 6.464 2.075
203 HA SER 25 HA SER 25 2.137 9.366 2.166
204 HB2 SER 25 2HB SER 25 1.700 7.397 -0.089
205 HB3 SER 25 1HB SER 25 1.487 9.145 -0.177
206 HG SER 25 HG SER 25 3.942 7.893 0.494
207 H ASP 26 H ASP 26 0.176 9.970 2.946
208 HA ASP 26 HA ASP 26 -1.860 7.960 3.175
209 HB2 ASP 26 2HB ASP 26 -1.607 9.503 5.062
210 HB3 ASP 26 1HB ASP 26 -1.920 10.874 3.997
Start of MODEL 18
1 H ASN 1 H ASN 1 -1.719 7.193 0.756
2 HA ASN 1 HA ASN 1 -3.722 9.277 0.405
3 HB2 ASN 1 2HB ASN 1 -2.235 7.548 -1.603
4 HB3 ASN 1 1HB ASN 1 -3.438 8.752 -2.033
5 HD21 ASN 1 1HD2 ASN 1 -1.878 9.832 -3.269
6 HD22 ASN 1 2HD2 ASN 1 -0.681 10.831 -2.539
7 HA PRO 2 HA PRO 2 -7.326 6.751 0.607
8 HB2 PRO 2 2HB PRO 2 -7.878 7.859 -2.114
9 HB3 PRO 2 1HB PRO 2 -8.971 7.699 -0.732
10 HG2 PRO 2 2HG PRO 2 -7.889 10.053 -1.283
11 HG3 PRO 2 1HG PRO 2 -8.023 9.499 0.395
12 HD2 PRO 2 2HD PRO 2 -5.617 9.681 -1.345
13 HD3 PRO 2 1HD PRO 2 -5.764 9.856 0.415
14 H GLU 3 H GLU 3 -6.146 6.800 -2.797
15 HA GLU 3 HA GLU 3 -7.097 4.225 -3.368
16 HB2 GLU 3 2HB GLU 3 -4.920 5.811 -4.724
17 HB3 GLU 3 1HB GLU 3 -5.537 4.284 -5.327
18 HG2 GLU 3 2HG GLU 3 -7.766 5.279 -5.534
19 HG3 GLU 3 1HG GLU 3 -7.115 6.820 -4.972
20 H LEU 4 H LEU 4 -4.001 5.311 -2.132
21 HA LEU 4 HA LEU 4 -2.701 2.835 -2.463
22 HB2 LEU 4 2HB LEU 4 -2.089 5.206 -0.724
23 HB3 LEU 4 1HB LEU 4 -1.081 3.777 -0.779
24 HG LEU 4 HG LEU 4 -1.664 5.571 -3.142
25 HD11 LEU 4 1HD1 LEU 4 0.812 5.271 -1.458
26 HD12 LEU 4 2HD1 LEU 4 -0.251 6.678 -1.491
27 HD13 LEU 4 3HD1 LEU 4 0.675 6.233 -2.927
28 HD21 LEU 4 1HD2 LEU 4 0.136 4.292 -4.215
29 HD22 LEU 4 2HD2 LEU 4 -1.256 3.291 -3.835
30 HD23 LEU 4 3HD2 LEU 4 0.187 3.214 -2.821
31 H GLN 5 H GLN 5 -4.214 4.327 0.388
32 HA GLN 5 HA GLN 5 -3.612 2.128 2.055
33 HB2 GLN 5 2HB GLN 5 -5.718 4.266 2.385
34 HB3 GLN 5 1HB GLN 5 -5.291 3.098 3.627
35 HG2 GLN 5 2HG GLN 5 -3.431 5.140 2.419
36 HG3 GLN 5 1HG GLN 5 -4.211 5.262 3.992
37 HE21 GLN 5 1HE2 GLN 5 -3.799 2.406 4.654
38 HE22 GLN 5 2HE2 GLN 5 -2.115 2.269 4.978
39 H ARG 6 H ARG 6 -6.451 2.885 0.119
40 HA ARG 6 HA ARG 6 -7.982 0.674 1.058
41 HB2 ARG 6 2HB ARG 6 -8.242 2.274 -1.502
42 HB3 ARG 6 1HB ARG 6 -9.441 1.129 -0.911
43 HG2 ARG 6 2HG ARG 6 -9.883 2.472 1.014
44 HG3 ARG 6 1HG ARG 6 -8.538 3.547 0.637
45 HD2 ARG 6 2HD ARG 6 -9.712 4.163 -1.461
46 HD3 ARG 6 1HD ARG 6 -11.096 3.205 -0.930
47 HE ARG 6 HE ARG 6 -10.658 4.853 1.149
48 HH11 ARG 6 1HH1 ARG 6 -11.054 5.517 -2.310
49 HH12 ARG 6 2HH1 ARG 6 -11.777 7.037 -2.107
50 HH21 ARG 6 1HH2 ARG 6 -11.622 6.984 1.447
51 HH22 ARG 6 2HH2 ARG 6 -12.111 7.890 0.105
52 H LYS 7 H LYS 7 -5.703 1.125 -1.580
53 HA LYS 7 HA LYS 7 -6.033 -1.382 -2.790
54 HB2 LYS 7 2HB LYS 7 -4.779 0.378 -3.908
55 HB3 LYS 7 1HB LYS 7 -3.613 0.402 -2.598
56 HG2 LYS 7 2HG LYS 7 -2.780 -1.758 -3.199
57 HG3 LYS 7 1HG LYS 7 -4.055 -1.976 -4.393
58 HD2 LYS 7 2HD LYS 7 -1.919 -1.354 -5.434
59 HD3 LYS 7 1HD LYS 7 -3.157 -0.137 -5.714
60 HE2 LYS 7 2HE LYS 7 -2.224 1.230 -3.927
61 HE3 LYS 7 1HE LYS 7 -0.992 0.001 -3.623
62 HZ1 LYS 7 1HZ LYS 7 -0.266 0.303 -5.915
63 HZ2 LYS 7 2HZ LYS 7 0.027 1.563 -4.961
64 HZ3 LYS 7 3HZ LYS 7 -1.262 1.670 -6.091
65 H CYS 8 H CYS 8 -3.703 -0.264 -0.351
66 HA CYS 8 HA CYS 8 -2.503 -2.731 0.091
67 HB2 CYS 8 2HB CYS 8 -2.842 -0.391 1.967
68 HB3 CYS 8 1HB CYS 8 -1.740 -1.738 2.241
69 H LYS 9 H LYS 9 -5.429 -1.367 1.440
70 HA LYS 9 HA LYS 9 -5.892 -3.260 3.446
71 HB2 LYS 9 2HB LYS 9 -7.127 -1.133 3.223
72 HB3 LYS 9 1HB LYS 9 -7.907 -1.751 1.777
73 HG2 LYS 9 2HG LYS 9 -8.941 -3.529 3.111
74 HG3 LYS 9 1HG LYS 9 -8.194 -2.862 4.561
75 HD2 LYS 9 2HD LYS 9 -9.385 -0.735 4.140
76 HD3 LYS 9 1HD LYS 9 -10.188 -1.490 2.765
77 HE2 LYS 9 2HE LYS 9 -10.377 -2.385 5.642
78 HE3 LYS 9 1HE LYS 9 -11.623 -1.527 4.741
79 HZ1 LYS 9 1HZ LYS 9 -10.580 -4.219 4.038
80 HZ2 LYS 9 2HZ LYS 9 -11.870 -3.436 3.285
81 HZ3 LYS 9 3HZ LYS 9 -11.997 -3.936 4.872
82 H GLU 10 H GLU 10 -6.974 -3.146 0.052
83 HA GLU 10 HA GLU 10 -8.307 -5.666 0.145
84 HB2 GLU 10 2HB GLU 10 -8.919 -3.845 -1.399
85 HB3 GLU 10 1HB GLU 10 -7.373 -4.018 -2.210
86 HG2 GLU 10 2HG GLU 10 -7.998 -6.320 -2.819
87 HG3 GLU 10 1HG GLU 10 -9.581 -6.050 -2.095
88 H LEU 11 H LEU 11 -5.134 -4.598 -0.812
89 HA LEU 11 HA LEU 11 -4.334 -6.962 -2.187
90 HB2 LEU 11 2HB LEU 11 -3.480 -4.758 -2.718
91 HB3 LEU 11 1HB LEU 11 -2.783 -4.620 -1.126
92 HG LEU 11 HG LEU 11 -1.197 -6.412 -1.673
93 HD11 LEU 11 1HD1 LEU 11 -1.004 -7.169 -3.999
94 HD12 LEU 11 2HD1 LEU 11 -2.479 -6.286 -4.401
95 HD13 LEU 11 3HD1 LEU 11 -2.540 -7.648 -3.282
96 HD21 LEU 11 1HD2 LEU 11 -0.629 -4.063 -2.037
97 HD22 LEU 11 2HD2 LEU 11 -1.270 -4.160 -3.679
98 HD23 LEU 11 3HD2 LEU 11 0.146 -5.110 -3.220
99 H DAS 12 H DAS 12 -3.961 -5.803 1.098
100 HA DAS 12 HA DAS 12 -2.933 -8.422 1.870
101 HB2 DAS 12 1HB DAS 12 -4.777 -7.629 3.191
102 HB3 DAS 12 2HB DAS 12 -3.990 -6.080 3.461
103 H THR 13 H THR 13 -0.909 -8.711 2.680
104 HA THR 13 HA THR 13 0.761 -6.326 3.052
105 HB THR 13 HB THR 13 1.349 -9.170 3.966
106 HG1 THR 13 1HG THR 13 -0.611 -7.645 4.878
107 HG21 THR 13 1HG2 THR 13 3.293 -7.633 3.927
108 HG22 THR 13 2HG2 THR 13 2.854 -8.063 5.580
109 HG23 THR 13 3HG2 THR 13 2.401 -6.488 4.930
110 H ARG 14 H ARG 14 -0.086 -7.811 0.597
111 HA ARG 14 HA ARG 14 2.343 -8.965 -0.434
112 HB2 ARG 14 2HB ARG 14 -0.303 -8.378 -1.806
113 HB3 ARG 14 1HB ARG 14 1.021 -9.305 -2.505
114 HG2 ARG 14 2HG ARG 14 0.802 -10.941 -0.666
115 HG3 ARG 14 1HG ARG 14 -0.588 -10.036 -0.071
116 HD2 ARG 14 2HD ARG 14 -0.365 -11.314 -2.788
117 HD3 ARG 14 1HD ARG 14 -1.190 -12.013 -1.401
118 HE ARG 14 HE ARG 14 -2.469 -9.717 -1.598
119 HH11 ARG 14 1HH1 ARG 14 -1.481 -11.934 -4.176
120 HH12 ARG 14 2HH1 ARG 14 -2.847 -11.688 -5.149
121 HH21 ARG 14 1HH2 ARG 14 -4.449 -9.418 -2.933
122 HH22 ARG 14 2HH2 ARG 14 -4.573 -10.262 -4.402
123 HA DPR 15 HA DPR 15 3.144 -5.372 -3.256
124 HB2 DPR 15 1HB DPR 15 5.891 -6.414 -3.210
125 HB3 DPR 15 2HB DPR 15 4.841 -6.123 -4.598
126 HG2 DPR 15 1HG DPR 15 5.492 -8.613 -3.803
127 HG3 DPR 15 2HG DPR 15 3.912 -8.232 -4.507
128 HD2 DPR 15 1HD DPR 15 4.664 -8.587 -1.630
129 HD3 DPR 15 2HD DPR 15 3.244 -9.204 -2.502
130 H DGL 16 H DGL 16 4.341 -6.567 -0.346
131 HA DGL 16 HA DGL 16 6.285 -4.698 0.468
132 HB2 DGL 16 1HB DGL 16 5.553 -6.971 1.475
133 HB3 DGL 16 2HB DGL 16 4.269 -6.082 2.253
134 HG2 DGL 16 1HG DGL 16 7.199 -5.645 2.712
135 HG3 DGL 16 2HG DGL 16 6.116 -6.535 3.768
136 H DAL 17 H DAL 17 2.796 -4.905 0.943
137 HA DAL 17 HA DAL 17 2.385 -2.567 2.413
138 HB1 DAL 17 1HB DAL 17 0.705 -4.320 2.193
139 HB2 DAL 17 2HB DAL 17 0.516 -3.924 0.485
140 HB3 DAL 17 3HB DAL 17 0.058 -2.750 1.718
141 H DGL 18 H DGL 18 2.200 -3.172 -1.039
142 HA DGL 18 HA DGL 18 1.445 -0.754 -2.088
143 HB2 DGL 18 1HB DGL 18 1.798 -2.706 -3.468
144 HB3 DGL 18 2HB DGL 18 3.502 -2.750 -3.063
145 HG2 DGL 18 1HG DGL 18 3.310 -1.936 -5.283
146 HG3 DGL 18 2HG DGL 18 3.790 -0.603 -4.226
147 H DAR 19 H DAR 19 4.739 -1.781 -1.425
148 HA DAR 19 HA DAR 19 5.966 0.669 -2.176
149 HB2 DAR 19 1HB DAR 19 7.048 -1.480 -0.380
150 HB3 DAR 19 2HB DAR 19 7.991 -0.263 -1.225
151 HG2 DAR 19 1HG DAR 19 7.348 -1.238 -3.364
152 HG3 DAR 19 2HG DAR 19 6.379 -2.449 -2.521
153 HD2 DAR 19 1HD DAR 19 9.366 -2.089 -2.374
154 HD3 DAR 19 2HD DAR 19 8.486 -3.424 -3.122
155 HE DAR 19 HE DAR 19 7.981 -3.012 -0.310
156 HH11 DAR 19 1HH2 DAR 19 8.689 -4.606 1.189
157 HH12 DAR 19 2HH2 DAR 19 9.684 -5.898 0.672
158 HH21 DAR 19 1HH1 DAR 19 9.840 -4.852 -2.706
159 HH22 DAR 19 2HH1 DAR 19 10.360 -6.021 -1.595
160 H DLY 20 H DLY 20 5.148 -0.769 0.958
161 HA DLY 20 HA DLY 20 6.266 1.306 2.495
162 HB2 DLY 20 1HB DLY 20 5.839 -0.961 3.365
163 HB3 DLY 20 2HB DLY 20 4.112 -0.668 3.264
164 HG2 DLY 20 1HG DLY 20 4.261 1.059 4.940
165 HG3 DLY 20 2HG DLY 20 6.014 0.894 4.992
166 HD2 DLY 20 1HD DLY 20 5.803 -1.383 5.798
167 HD3 DLY 20 2HD DLY 20 4.044 -1.274 5.696
168 HE2 DLY 20 1HE DLY 20 4.022 0.475 7.358
169 HE3 DLY 20 2HE DLY 20 5.782 0.478 7.419
170 HZ1 DLY 20 1HZ DLY 20 4.724 -0.753 9.256
171 HZ2 DLY 20 2HZ DLY 20 5.779 -1.696 8.349
172 HZ3 DLY 20 3HZ DLY 20 4.130 -1.881 8.143
173 H DCY 21 H DCY 21 3.046 0.855 1.123
174 HA DCY 21 HA DCY 21 1.884 3.065 2.455
175 HB2 DCY 21 1HB DCY 21 1.118 1.656 -0.099
176 HB3 DCY 21 2HB DCY 21 0.174 2.976 0.593
177 H DAR 22 H DAR 22 3.492 2.702 -0.680
178 HA DAR 22 HA DAR 22 3.050 5.391 -1.437
179 HB2 DAR 22 1HB DAR 22 5.045 3.369 -2.422
180 HB3 DAR 22 2HB DAR 22 4.800 4.944 -3.162
181 HG2 DAR 22 1HG DAR 22 2.474 4.349 -3.635
182 HG3 DAR 22 2HG DAR 22 2.735 2.768 -2.900
183 HD2 DAR 22 1HD DAR 22 2.885 2.615 -5.314
184 HD3 DAR 22 2HD DAR 22 4.445 2.269 -4.569
185 HE DAR 22 HE DAR 22 4.222 4.999 -5.229
186 HH11 DAR 22 1HH1 DAR 22 4.681 1.834 -6.764
187 HH12 DAR 22 2HH1 DAR 22 5.629 2.431 -8.040
188 HH21 DAR 22 1HH2 DAR 22 5.560 5.821 -7.000
189 HH22 DAR 22 2HH2 DAR 22 6.147 4.730 -8.168
190 H DGL 23 H DGL 23 5.512 3.845 0.446
191 HA DGL 23 HA DGL 23 7.399 5.952 0.443
192 HB2 DGL 23 1HB DGL 23 7.890 3.633 1.173
193 HB3 DGL 23 2HB DGL 23 6.865 3.877 2.579
194 HG2 DGL 23 1HG DGL 23 8.363 5.668 3.334
195 HG3 DGL 23 2HG DGL 23 9.415 5.343 1.960
196 H DGL 24 H DGL 24 4.849 5.079 2.751
197 HA DGL 24 HA DGL 24 5.220 7.386 4.391
198 HB2 DGL 24 1HB DGL 24 3.027 5.343 4.209
199 HB3 DGL 24 2HB DGL 24 3.002 6.668 5.361
200 HG2 DGL 24 1HG DGL 24 5.156 4.586 5.173
201 HG3 DGL 24 2HG DGL 24 3.825 4.580 6.333
202 H SER 25 H SER 25 2.946 6.512 1.884
203 HA SER 25 HA SER 25 2.000 9.267 1.866
204 HB2 SER 25 2HB SER 25 3.394 8.561 -0.118
205 HB3 SER 25 1HB SER 25 2.230 7.284 -0.431
206 HG SER 25 HG SER 25 0.729 9.341 -0.379
207 H ASP 26 H ASP 26 0.340 8.725 3.366
208 HA ASP 26 HA ASP 26 -1.323 6.467 2.825
209 HB2 ASP 26 2HB ASP 26 -2.625 7.132 4.831
210 HB3 ASP 26 1HB ASP 26 -0.908 7.003 5.164
Start of MODEL 19
1 H ASN 1 H ASN 1 -2.084 7.433 1.374
2 HA ASN 1 HA ASN 1 -4.131 9.355 0.524
3 HB2 ASN 1 2HB ASN 1 -2.395 9.104 -1.226
4 HB3 ASN 1 1HB ASN 1 -2.729 7.379 -1.288
5 HD21 ASN 1 1HD2 ASN 1 -3.900 10.526 -2.016
6 HD22 ASN 1 2HD2 ASN 1 -5.180 10.077 -3.073
7 HA PRO 2 HA PRO 2 -6.908 6.348 2.210
8 HB2 PRO 2 2HB PRO 2 -8.697 7.680 0.231
9 HB3 PRO 2 1HB PRO 2 -8.984 7.306 1.933
10 HG2 PRO 2 2HG PRO 2 -8.388 9.779 1.227
11 HG3 PRO 2 1HG PRO 2 -7.671 9.067 2.682
12 HD2 PRO 2 2HD PRO 2 -6.448 9.566 0.015
13 HD3 PRO 2 1HD PRO 2 -5.740 9.681 1.643
14 H GLU 3 H GLU 3 -7.161 6.907 -1.324
15 HA GLU 3 HA GLU 3 -8.314 4.344 -1.756
16 HB2 GLU 3 2HB GLU 3 -8.761 6.264 -3.223
17 HB3 GLU 3 1HB GLU 3 -7.081 6.223 -3.749
18 HG2 GLU 3 2HG GLU 3 -7.411 4.082 -4.778
19 HG3 GLU 3 1HG GLU 3 -9.059 3.998 -4.155
20 H LEU 4 H LEU 4 -5.066 5.650 -2.101
21 HA LEU 4 HA LEU 4 -3.852 3.411 -3.287
22 HB2 LEU 4 2HB LEU 4 -2.743 5.594 -3.101
23 HB3 LEU 4 1HB LEU 4 -2.743 5.427 -1.355
24 HG LEU 4 HG LEU 4 -1.172 3.585 -1.503
25 HD11 LEU 4 1HD1 LEU 4 -0.056 3.046 -3.614
26 HD12 LEU 4 2HD1 LEU 4 -1.157 4.131 -4.460
27 HD13 LEU 4 3HD1 LEU 4 -1.780 2.678 -3.676
28 HD21 LEU 4 1HD2 LEU 4 -0.314 5.836 -1.235
29 HD22 LEU 4 2HD2 LEU 4 -0.300 6.061 -2.983
30 HD23 LEU 4 3HD2 LEU 4 0.785 4.890 -2.238
31 H GLN 5 H GLN 5 -4.229 4.335 0.097
32 HA GLN 5 HA GLN 5 -3.126 2.022 1.221
33 HB2 GLN 5 2HB GLN 5 -5.036 4.091 2.254
34 HB3 GLN 5 1HB GLN 5 -4.546 2.730 3.248
35 HG2 GLN 5 2HG GLN 5 -2.626 4.666 1.972
36 HG3 GLN 5 1HG GLN 5 -3.224 4.812 3.622
37 HE21 GLN 5 1HE2 GLN 5 -3.194 1.958 4.125
38 HE22 GLN 5 2HE2 GLN 5 -1.545 1.505 4.318
39 H ARG 6 H ARG 6 -6.425 2.784 0.239
40 HA ARG 6 HA ARG 6 -7.650 0.440 1.124
41 HB2 ARG 6 2HB ARG 6 -9.082 2.199 0.318
42 HB3 ARG 6 1HB ARG 6 -8.274 2.222 -1.241
43 HG2 ARG 6 2HG ARG 6 -10.488 1.190 -1.390
44 HG3 ARG 6 1HG ARG 6 -9.206 0.049 -1.793
45 HD2 ARG 6 2HD ARG 6 -9.340 -0.704 0.632
46 HD3 ARG 6 1HD ARG 6 -10.862 0.194 0.715
47 HE ARG 6 HE ARG 6 -11.169 -1.321 -1.456
48 HH11 ARG 6 1HH1 ARG 6 -10.341 -2.070 1.874
49 HH12 ARG 6 2HH1 ARG 6 -10.795 -3.706 1.807
50 HH21 ARG 6 1HH2 ARG 6 -11.720 -3.554 -1.631
51 HH22 ARG 6 2HH2 ARG 6 -11.629 -4.598 -0.296
52 H LYS 7 H LYS 7 -6.087 1.149 -1.973
53 HA LYS 7 HA LYS 7 -6.360 -1.324 -3.217
54 HB2 LYS 7 2HB LYS 7 -4.060 0.638 -3.350
55 HB3 LYS 7 1HB LYS 7 -4.248 -0.730 -4.429
56 HG2 LYS 7 2HG LYS 7 -6.231 1.525 -4.188
57 HG3 LYS 7 1HG LYS 7 -4.948 1.453 -5.392
58 HD2 LYS 7 2HD LYS 7 -5.895 -0.690 -6.196
59 HD3 LYS 7 1HD LYS 7 -7.235 -0.486 -5.062
60 HE2 LYS 7 2HE LYS 7 -7.873 1.587 -6.170
61 HE3 LYS 7 1HE LYS 7 -6.490 1.440 -7.250
62 HZ1 LYS 7 1HZ LYS 7 -7.467 -0.576 -8.169
63 HZ2 LYS 7 2HZ LYS 7 -8.548 0.705 -8.305
64 HZ3 LYS 7 3HZ LYS 7 -8.781 -0.450 -7.132
65 H CYS 8 H CYS 8 -3.766 -0.159 -1.115
66 HA CYS 8 HA CYS 8 -2.258 -2.505 -1.104
67 HB2 CYS 8 2HB CYS 8 -2.447 -0.369 1.009
68 HB3 CYS 8 1HB CYS 8 -1.207 -1.613 0.936
69 H LYS 9 H LYS 9 -4.972 -1.547 1.000
70 HA LYS 9 HA LYS 9 -4.595 -3.865 2.638
71 HB2 LYS 9 2HB LYS 9 -5.636 -1.785 3.526
72 HB3 LYS 9 1HB LYS 9 -7.023 -2.058 2.481
73 HG2 LYS 9 2HG LYS 9 -7.574 -4.086 3.657
74 HG3 LYS 9 1HG LYS 9 -6.116 -3.959 4.637
75 HD2 LYS 9 2HD LYS 9 -6.963 -1.868 5.604
76 HD3 LYS 9 1HD LYS 9 -8.419 -2.011 4.620
77 HE2 LYS 9 2HE LYS 9 -7.512 -3.970 6.725
78 HE3 LYS 9 1HE LYS 9 -8.805 -2.788 6.905
79 HZ1 LYS 9 1HZ LYS 9 -8.770 -5.072 5.004
80 HZ2 LYS 9 2HZ LYS 9 -9.980 -3.913 5.073
81 HZ3 LYS 9 3HZ LYS 9 -9.727 -4.934 6.377
82 H GLU 10 H GLU 10 -6.353 -3.147 -0.242
83 HA GLU 10 HA GLU 10 -7.877 -5.570 -0.209
84 HB2 GLU 10 2HB GLU 10 -8.540 -3.461 -1.416
85 HB3 GLU 10 1HB GLU 10 -7.203 -3.722 -2.520
86 HG2 GLU 10 2HG GLU 10 -8.218 -5.743 -3.330
87 HG3 GLU 10 1HG GLU 10 -9.508 -5.602 -2.135
88 H LEU 11 H LEU 11 -4.717 -4.623 -0.959
89 HA LEU 11 HA LEU 11 -4.018 -7.014 -2.443
90 HB2 LEU 11 2HB LEU 11 -3.019 -4.809 -2.971
91 HB3 LEU 11 1HB LEU 11 -2.331 -4.749 -1.370
92 HG LEU 11 HG LEU 11 -0.874 -6.632 -1.915
93 HD11 LEU 11 1HD1 LEU 11 -2.103 -6.423 -4.668
94 HD12 LEU 11 2HD1 LEU 11 -2.276 -7.778 -3.550
95 HD13 LEU 11 3HD1 LEU 11 -0.700 -7.404 -4.244
96 HD21 LEU 11 1HD2 LEU 11 -0.094 -4.362 -2.277
97 HD22 LEU 11 2HD2 LEU 11 -0.772 -4.371 -3.905
98 HD23 LEU 11 3HD2 LEU 11 0.567 -5.446 -3.501
99 H DAS 12 H DAS 12 -3.941 -5.823 0.824
100 HA DAS 12 HA DAS 12 -3.189 -8.467 1.783
101 HB2 DAS 12 1HB DAS 12 -5.108 -7.575 2.905
102 HB3 DAS 12 2HB DAS 12 -4.297 -6.051 3.218
103 H THR 13 H THR 13 -1.315 -8.953 2.523
104 HA THR 13 HA THR 13 0.468 -6.802 3.402
105 HB THR 13 HB THR 13 0.049 -8.607 5.062
106 HG1 THR 13 1HG THR 13 2.138 -7.574 5.008
107 HG21 THR 13 1HG2 THR 13 0.972 -10.870 4.667
108 HG22 THR 13 2HG2 THR 13 1.317 -10.412 2.997
109 HG23 THR 13 3HG2 THR 13 -0.349 -10.473 3.570
110 H ARG 14 H ARG 14 -0.259 -8.306 0.707
111 HA ARG 14 HA ARG 14 2.263 -9.233 -0.231
112 HB2 ARG 14 2HB ARG 14 -0.241 -8.496 -1.776
113 HB3 ARG 14 1HB ARG 14 1.153 -9.326 -2.450
114 HG2 ARG 14 2HG ARG 14 -0.641 -10.358 -0.264
115 HG3 ARG 14 1HG ARG 14 -0.666 -10.868 -1.952
116 HD2 ARG 14 2HD ARG 14 1.657 -11.190 -0.040
117 HD3 ARG 14 1HD ARG 14 0.550 -12.464 -0.534
118 HE ARG 14 HE ARG 14 1.414 -11.695 -2.881
119 HH11 ARG 14 1HH1 ARG 14 3.370 -12.136 0.058
120 HH12 ARG 14 2HH1 ARG 14 4.720 -12.700 -0.793
121 HH21 ARG 14 1HH2 ARG 14 3.305 -12.469 -4.012
122 HH22 ARG 14 2HH2 ARG 14 4.688 -12.896 -3.105
123 HA DPR 15 HA DPR 15 3.351 -5.565 -2.777
124 HB2 DPR 15 1HB DPR 15 6.067 -6.614 -2.412
125 HB3 DPR 15 2HB DPR 15 5.195 -6.272 -3.909
126 HG2 DPR 15 1HG DPR 15 5.724 -8.784 -3.140
127 HG3 DPR 15 2HG DPR 15 4.222 -8.359 -3.982
128 HD2 DPR 15 1HD DPR 15 4.684 -8.811 -1.057
129 HD3 DPR 15 2HD DPR 15 3.364 -9.390 -2.093
130 H DGL 16 H DGL 16 4.289 -6.735 0.283
131 HA DGL 16 HA DGL 16 6.116 -4.820 1.196
132 HB2 DGL 16 1HB DGL 16 5.589 -6.946 2.328
133 HB3 DGL 16 2HB DGL 16 3.997 -6.335 2.739
134 HG2 DGL 16 1HG DGL 16 5.417 -6.217 4.648
135 HG3 DGL 16 2HG DGL 16 5.044 -4.584 4.098
136 H DAL 17 H DAL 17 2.579 -4.933 1.428
137 HA DAL 17 HA DAL 17 2.283 -2.478 2.810
138 HB1 DAL 17 1HB DAL 17 0.552 -4.229 2.764
139 HB2 DAL 17 2HB DAL 17 0.249 -3.860 1.064
140 HB3 DAL 17 3HB DAL 17 -0.067 -2.647 2.306
141 H DGL 18 H DGL 18 2.341 -3.355 -0.535
142 HA DGL 18 HA DGL 18 1.592 -0.961 -1.765
143 HB2 DGL 18 1HB DGL 18 1.686 -2.944 -3.056
144 HB3 DGL 18 2HB DGL 18 3.329 -3.286 -2.566
145 HG2 DGL 18 1HG DGL 18 3.215 -2.632 -4.896
146 HG3 DGL 18 2HG DGL 18 4.178 -1.521 -3.936
147 H DAR 19 H DAR 19 4.813 -2.148 -0.856
148 HA DAR 19 HA DAR 19 6.154 0.199 -1.739
149 HB2 DAR 19 1HB DAR 19 7.085 -1.880 0.238
150 HB3 DAR 19 2HB DAR 19 8.102 -0.663 -0.511
151 HG2 DAR 19 1HG DAR 19 6.668 -2.890 -1.957
152 HG3 DAR 19 2HG DAR 19 8.382 -2.854 -1.562
153 HD2 DAR 19 1HD DAR 19 8.221 -2.257 -3.843
154 HD3 DAR 19 2HD DAR 19 8.584 -0.779 -2.970
155 HE DAR 19 HE DAR 19 5.804 -0.979 -3.295
156 HH11 DAR 19 1HH2 DAR 19 4.666 0.273 -5.051
157 HH12 DAR 19 2HH2 DAR 19 5.628 0.825 -6.340
158 HH21 DAR 19 1HH1 DAR 19 8.724 -0.380 -5.194
159 HH22 DAR 19 2HH1 DAR 19 7.929 0.482 -6.432
160 H DLY 20 H DLY 20 4.790 -0.798 1.331
161 HA DLY 20 HA DLY 20 5.760 1.345 2.865
162 HB2 DLY 20 1HB DLY 20 4.749 -0.689 3.838
163 HB3 DLY 20 2HB DLY 20 3.186 -0.203 3.209
164 HG2 DLY 20 1HG DLY 20 3.143 1.728 4.648
165 HG3 DLY 20 2HG DLY 20 4.776 1.385 5.215
166 HD2 DLY 20 1HD DLY 20 3.991 -0.747 6.146
167 HD3 DLY 20 2HD DLY 20 2.353 -0.367 5.617
168 HE2 DLY 20 1HE DLY 20 3.992 1.259 7.557
169 HE3 DLY 20 2HE DLY 20 2.722 0.134 8.007
170 HZ1 DLY 20 1HZ DLY 20 1.119 1.530 6.801
171 HZ2 DLY 20 2HZ DLY 20 2.321 2.635 6.418
172 HZ3 DLY 20 3HZ DLY 20 1.905 2.379 8.002
173 H DCY 21 H DCY 21 2.848 0.991 0.881
174 HA DCY 21 HA DCY 21 1.670 3.443 1.498
175 HB2 DCY 21 1HB DCY 21 1.518 1.743 -0.982
176 HB3 DCY 21 2HB DCY 21 0.598 3.227 -0.787
177 H DAR 22 H DAR 22 4.070 2.630 -0.956
178 HA DAR 22 HA DAR 22 4.009 5.275 -2.048
179 HB2 DAR 22 1HB DAR 22 6.119 3.149 -2.425
180 HB3 DAR 22 2HB DAR 22 5.937 4.610 -3.385
181 HG2 DAR 22 1HG DAR 22 4.007 2.304 -3.237
182 HG3 DAR 22 2HG DAR 22 5.057 2.711 -4.589
183 HD2 DAR 22 1HD DAR 22 2.801 4.430 -3.550
184 HD3 DAR 22 2HD DAR 22 2.734 3.415 -4.979
185 HE DAR 22 HE DAR 22 4.845 5.386 -4.976
186 HH11 DAR 22 1HH1 DAR 22 1.524 4.624 -6.026
187 HH12 DAR 22 2HH1 DAR 22 1.453 5.886 -7.157
188 HH21 DAR 22 1HH2 DAR 22 4.721 7.106 -6.600
189 HH22 DAR 22 2HH2 DAR 22 3.305 7.269 -7.534
190 H DGL 23 H DGL 23 5.831 3.694 0.459
191 HA DGL 23 HA DGL 23 7.796 5.739 0.711
192 HB2 DGL 23 1HB DGL 23 8.061 3.438 1.583
193 HB3 DGL 23 2HB DGL 23 6.809 3.757 2.773
194 HG2 DGL 23 1HG DGL 23 8.919 3.947 3.858
195 HG3 DGL 23 2HG DGL 23 8.242 5.567 3.704
196 H DGL 24 H DGL 24 4.711 5.079 2.335
197 HA DGL 24 HA DGL 24 5.038 7.324 4.101
198 HB2 DGL 24 1HB DGL 24 2.745 5.409 3.769
199 HB3 DGL 24 2HB DGL 24 2.888 6.625 5.031
200 HG2 DGL 24 1HG DGL 24 4.805 4.350 4.606
201 HG3 DGL 24 2HG DGL 24 3.501 4.360 5.786
202 H SER 25 H SER 25 3.093 6.685 1.189
203 HA SER 25 HA SER 25 2.303 9.469 1.245
204 HB2 SER 25 2HB SER 25 1.765 7.284 -0.809
205 HB3 SER 25 1HB SER 25 1.314 8.977 -0.997
206 HG SER 25 HG SER 25 3.926 8.689 -0.346
207 H ASP 26 H ASP 26 0.693 9.861 2.619
208 HA ASP 26 HA ASP 26 -1.259 7.898 3.324
209 HB2 ASP 26 2HB ASP 26 -1.213 10.856 3.996
210 HB3 ASP 26 1HB ASP 26 -2.348 9.691 4.648
Start of MODEL 20
1 H ASN 1 H ASN 1 -1.234 8.998 0.238
2 HA ASN 1 HA ASN 1 -3.877 9.525 -0.683
3 HB2 ASN 1 2HB ASN 1 -1.797 7.550 -1.635
4 HB3 ASN 1 1HB ASN 1 -3.329 7.805 -2.455
5 HD21 ASN 1 1HD2 ASN 1 -0.588 8.222 -3.404
6 HD22 ASN 1 2HD2 ASN 1 -0.468 9.880 -3.835
7 HA PRO 2 HA PRO 2 -5.734 6.289 1.917
8 HB2 PRO 2 2HB PRO 2 -8.240 7.346 0.785
9 HB3 PRO 2 1HB PRO 2 -7.744 7.224 2.477
10 HG2 PRO 2 2HG PRO 2 -7.892 9.588 1.242
11 HG3 PRO 2 1HG PRO 2 -6.626 9.239 2.432
12 HD2 PRO 2 2HD PRO 2 -6.474 9.218 -0.553
13 HD3 PRO 2 1HD PRO 2 -5.326 9.896 0.633
14 H GLU 3 H GLU 3 -6.585 7.061 -1.428
15 HA GLU 3 HA GLU 3 -7.936 4.649 -2.016
16 HB2 GLU 3 2HB GLU 3 -6.477 6.598 -3.796
17 HB3 GLU 3 1HB GLU 3 -7.398 5.239 -4.406
18 HG2 GLU 3 2HG GLU 3 -9.432 6.108 -3.548
19 HG3 GLU 3 1HG GLU 3 -8.582 7.349 -2.633
20 H LEU 4 H LEU 4 -4.594 5.608 -2.119
21 HA LEU 4 HA LEU 4 -3.577 3.261 -3.327
22 HB2 LEU 4 2HB LEU 4 -2.254 5.323 -3.184
23 HB3 LEU 4 1HB LEU 4 -2.286 5.228 -1.443
24 HG LEU 4 HG LEU 4 -0.941 3.172 -1.521
25 HD11 LEU 4 1HD1 LEU 4 -1.593 2.320 -3.685
26 HD12 LEU 4 2HD1 LEU 4 0.159 2.503 -3.590
27 HD13 LEU 4 3HD1 LEU 4 -0.805 3.684 -4.477
28 HD21 LEU 4 1HD2 LEU 4 0.148 5.319 -1.235
29 HD22 LEU 4 2HD2 LEU 4 0.264 5.520 -2.981
30 HD23 LEU 4 3HD2 LEU 4 1.161 4.233 -2.179
31 H GLN 5 H GLN 5 -3.823 4.329 0.054
32 HA GLN 5 HA GLN 5 -2.805 2.005 1.221
33 HB2 GLN 5 2HB GLN 5 -4.772 3.983 2.363
34 HB3 GLN 5 1HB GLN 5 -3.962 2.735 3.303
35 HG2 GLN 5 2HG GLN 5 -1.795 3.719 2.734
36 HG3 GLN 5 1HG GLN 5 -2.616 4.974 1.808
37 HE21 GLN 5 1HE2 GLN 5 -1.917 3.744 4.978
38 HE22 GLN 5 2HE2 GLN 5 -2.405 5.152 5.834
39 H ARG 6 H ARG 6 -6.111 2.732 0.293
40 HA ARG 6 HA ARG 6 -7.363 0.479 1.397
41 HB2 ARG 6 2HB ARG 6 -8.013 2.102 -1.039
42 HB3 ARG 6 1HB ARG 6 -9.018 0.769 -0.495
43 HG2 ARG 6 2HG ARG 6 -9.406 1.904 1.618
44 HG3 ARG 6 1HG ARG 6 -8.350 3.224 1.106
45 HD2 ARG 6 2HD ARG 6 -10.757 3.704 0.813
46 HD3 ARG 6 1HD ARG 6 -9.835 3.794 -0.689
47 HE ARG 6 HE ARG 6 -10.780 1.225 -0.540
48 HH11 ARG 6 1HH1 ARG 6 -12.352 4.383 -0.498
49 HH12 ARG 6 2HH1 ARG 6 -13.692 3.898 -1.428
50 HH21 ARG 6 1HH2 ARG 6 -12.569 0.555 -1.789
51 HH22 ARG 6 2HH2 ARG 6 -13.837 1.648 -2.177
52 H LYS 7 H LYS 7 -5.758 0.896 -1.712
53 HA LYS 7 HA LYS 7 -6.437 -1.693 -2.655
54 HB2 LYS 7 2HB LYS 7 -4.258 0.195 -3.563
55 HB3 LYS 7 1HB LYS 7 -4.714 -1.280 -4.407
56 HG2 LYS 7 2HG LYS 7 -6.526 1.080 -3.907
57 HG3 LYS 7 1HG LYS 7 -5.708 0.710 -5.426
58 HD2 LYS 7 2HD LYS 7 -6.953 -1.359 -5.640
59 HD3 LYS 7 1HD LYS 7 -7.693 -1.120 -4.063
60 HE2 LYS 7 2HE LYS 7 -9.228 -0.529 -5.870
61 HE3 LYS 7 1HE LYS 7 -8.838 0.853 -4.860
62 HZ1 LYS 7 1HZ LYS 7 -7.554 0.303 -7.496
63 HZ2 LYS 7 2HZ LYS 7 -7.352 1.662 -6.517
64 HZ3 LYS 7 3HZ LYS 7 -8.824 1.384 -7.229
65 H CYS 8 H CYS 8 -3.903 -0.457 -0.699
66 HA CYS 8 HA CYS 8 -2.194 -2.712 -0.739
67 HB2 CYS 8 2HB CYS 8 -2.732 -0.738 1.471
68 HB3 CYS 8 1HB CYS 8 -1.356 -1.821 1.405
69 H LYS 9 H LYS 9 -4.798 -1.694 1.441
70 HA LYS 9 HA LYS 9 -4.761 -3.946 3.136
71 HB2 LYS 9 2HB LYS 9 -7.031 -2.053 2.493
72 HB3 LYS 9 1HB LYS 9 -6.977 -3.157 3.862
73 HG2 LYS 9 2HG LYS 9 -5.124 -1.962 4.826
74 HG3 LYS 9 1HG LYS 9 -4.989 -0.939 3.397
75 HD2 LYS 9 2HD LYS 9 -6.103 0.282 5.169
76 HD3 LYS 9 1HD LYS 9 -7.244 -0.040 3.868
77 HE2 LYS 9 2HE LYS 9 -8.142 -1.940 5.145
78 HE3 LYS 9 1HE LYS 9 -7.001 -1.587 6.443
79 HZ1 LYS 9 1HZ LYS 9 -9.145 0.226 5.484
80 HZ2 LYS 9 2HZ LYS 9 -8.074 0.553 6.753
81 HZ3 LYS 9 3HZ LYS 9 -9.184 -0.697 6.889
82 H GLU 10 H GLU 10 -6.223 -3.320 0.079
83 HA GLU 10 HA GLU 10 -8.009 -5.514 0.006
84 HB2 GLU 10 2HB GLU 10 -8.282 -3.582 -1.431
85 HB3 GLU 10 1HB GLU 10 -6.714 -3.874 -2.157
86 HG2 GLU 10 2HG GLU 10 -7.546 -5.975 -3.083
87 HG3 GLU 10 1HG GLU 10 -9.134 -5.635 -2.395
88 H LEU 11 H LEU 11 -4.764 -4.908 -1.224
89 HA LEU 11 HA LEU 11 -4.362 -7.409 -2.481
90 HB2 LEU 11 2HB LEU 11 -3.162 -5.317 -3.009
91 HB3 LEU 11 1HB LEU 11 -2.387 -5.388 -1.455
92 HG LEU 11 HG LEU 11 -1.203 -7.432 -2.081
93 HD11 LEU 11 1HD1 LEU 11 -2.796 -8.382 -3.657
94 HD12 LEU 11 2HD1 LEU 11 -1.210 -8.209 -4.408
95 HD13 LEU 11 3HD1 LEU 11 -2.492 -7.059 -4.783
96 HD21 LEU 11 1HD2 LEU 11 -0.889 -5.171 -4.047
97 HD22 LEU 11 2HD2 LEU 11 0.310 -6.426 -3.730
98 HD23 LEU 11 3HD2 LEU 11 -0.136 -5.290 -2.456
99 H DAS 12 H DAS 12 -3.611 -6.130 0.692
100 HA DAS 12 HA DAS 12 -2.923 -8.844 1.549
101 HB2 DAS 12 1HB DAS 12 -5.143 -8.092 2.369
102 HB3 DAS 12 2HB DAS 12 -4.373 -6.707 3.132
103 H THR 13 H THR 13 -1.015 -9.021 2.577
104 HA THR 13 HA THR 13 0.338 -6.508 3.240
105 HB THR 13 HB THR 13 0.113 -8.133 5.152
106 HG1 THR 13 1HG THR 13 2.004 -6.686 4.779
107 HG21 THR 13 1HG2 THR 13 1.484 -10.187 5.161
108 HG22 THR 13 2HG2 THR 13 1.927 -9.889 3.480
109 HG23 THR 13 3HG2 THR 13 0.253 -10.238 3.901
110 H ARG 14 H ARG 14 -0.030 -8.457 0.810
111 HA ARG 14 HA ARG 14 2.592 -9.223 0.018
112 HB2 ARG 14 2HB ARG 14 0.051 -8.940 -1.603
113 HB3 ARG 14 1HB ARG 14 1.533 -9.675 -2.191
114 HG2 ARG 14 2HG ARG 14 -0.142 -10.675 0.110
115 HG3 ARG 14 1HG ARG 14 -0.096 -11.355 -1.516
116 HD2 ARG 14 2HD ARG 14 2.221 -11.209 0.416
117 HD3 ARG 14 1HD ARG 14 1.287 -12.648 0.028
118 HE ARG 14 HE ARG 14 2.090 -12.114 -2.358
119 HH11 ARG 14 1HH1 ARG 14 4.024 -11.851 0.603
120 HH12 ARG 14 2HH1 ARG 14 5.516 -12.002 -0.214
121 HH21 ARG 14 1HH2 ARG 14 4.144 -12.331 -3.433
122 HH22 ARG 14 2HH2 ARG 14 5.584 -12.319 -2.524
123 HA DPR 15 HA DPR 15 3.285 -5.809 -3.008
124 HB2 DPR 15 1HB DPR 15 5.969 -6.166 -3.208
125 HB3 DPR 15 2HB DPR 15 4.811 -7.080 -4.180
126 HG2 DPR 15 1HG DPR 15 6.263 -7.885 -1.691
127 HG3 DPR 15 2HG DPR 15 5.938 -8.836 -3.150
128 HD2 DPR 15 1HD DPR 15 4.493 -9.089 -0.873
129 HD3 DPR 15 2HD DPR 15 3.801 -9.356 -2.483
130 H DGL 16 H DGL 16 4.623 -6.595 0.080
131 HA DGL 16 HA DGL 16 6.211 -4.336 0.608
132 HB2 DGL 16 1HB DGL 16 6.181 -6.299 2.121
133 HB3 DGL 16 2HB DGL 16 4.523 -5.919 2.570
134 HG2 DGL 16 1HG DGL 16 5.365 -3.699 3.401
135 HG3 DGL 16 2HG DGL 16 6.998 -4.290 3.139
136 H DAL 17 H DAL 17 2.815 -5.003 0.952
137 HA DAL 17 HA DAL 17 1.998 -2.831 2.438
138 HB1 DAL 17 1HB DAL 17 -0.220 -3.322 1.668
139 HB2 DAL 17 2HB DAL 17 0.650 -4.839 1.887
140 HB3 DAL 17 3HB DAL 17 0.417 -4.184 0.268
141 H DGL 18 H DGL 18 1.970 -3.140 -1.100
142 HA DGL 18 HA DGL 18 1.035 -0.523 -1.574
143 HB2 DGL 18 1HB DGL 18 0.899 -2.512 -3.119
144 HB3 DGL 18 2HB DGL 18 2.603 -2.299 -3.450
145 HG2 DGL 18 1HG DGL 18 0.586 -0.158 -4.042
146 HG3 DGL 18 2HG DGL 18 0.992 -1.422 -5.194
147 H DAR 19 H DAR 19 4.304 -1.889 -1.491
148 HA DAR 19 HA DAR 19 5.778 0.405 -2.205
149 HB2 DAR 19 1HB DAR 19 6.488 -1.823 -0.297
150 HB3 DAR 19 2HB DAR 19 7.617 -0.601 -0.848
151 HG2 DAR 19 1HG DAR 19 7.450 -1.373 -3.103
152 HG3 DAR 19 2HG DAR 19 6.247 -2.580 -2.627
153 HD2 DAR 19 1HD DAR 19 8.517 -3.524 -2.825
154 HD3 DAR 19 2HD DAR 19 7.876 -3.662 -1.186
155 HE DAR 19 HE DAR 19 9.387 -1.292 -1.506
156 HH11 DAR 19 1HH2 DAR 19 11.470 -1.088 -0.496
157 HH12 DAR 19 2HH2 DAR 19 12.291 -2.475 0.037
158 HH21 DAR 19 1HH1 DAR 19 9.815 -4.792 -1.029
159 HH22 DAR 19 2HH1 DAR 19 11.341 -4.641 -0.308
160 H DLY 20 H DLY 20 4.830 -0.818 0.939
161 HA DLY 20 HA DLY 20 5.964 1.250 2.449
162 HB2 DLY 20 1HB DLY 20 5.475 -1.021 3.252
163 HB3 DLY 20 2HB DLY 20 3.764 -0.673 3.124
164 HG2 DLY 20 1HG DLY 20 3.854 0.900 4.911
165 HG3 DLY 20 2HG DLY 20 5.617 0.818 4.946
166 HD2 DLY 20 1HD DLY 20 4.585 -0.526 6.741
167 HD3 DLY 20 2HD DLY 20 5.531 -1.513 5.628
168 HE2 DLY 20 1HE DLY 20 3.448 -2.144 4.454
169 HE3 DLY 20 2HE DLY 20 2.522 -1.224 5.635
170 HZ1 DLY 20 1HZ DLY 20 3.485 -2.682 7.362
171 HZ2 DLY 20 2HZ DLY 20 4.165 -3.639 6.116
172 HZ3 DLY 20 3HZ DLY 20 2.501 -3.477 6.247
173 H DCY 21 H DCY 21 2.766 0.823 1.006
174 HA DCY 21 HA DCY 21 1.604 3.060 2.241
175 HB2 DCY 21 1HB DCY 21 0.985 1.812 -0.418
176 HB3 DCY 21 2HB DCY 21 0.063 3.133 0.292
177 H DAR 22 H DAR 22 3.487 2.792 -0.776
178 HA DAR 22 HA DAR 22 3.138 5.601 -1.254
179 HB2 DAR 22 1HB DAR 22 4.684 5.384 -3.119
180 HB3 DAR 22 2HB DAR 22 3.526 4.069 -3.155
181 HG2 DAR 22 1HG DAR 22 5.145 2.546 -2.267
182 HG3 DAR 22 2HG DAR 22 6.313 3.851 -2.085
183 HD2 DAR 22 1HD DAR 22 6.838 2.611 -4.062
184 HD3 DAR 22 2HD DAR 22 6.248 4.203 -4.527
185 HE DAR 22 HE DAR 22 4.230 2.139 -4.492
186 HH11 DAR 22 1HH1 DAR 22 6.607 3.850 -6.483
187 HH12 DAR 22 2HH1 DAR 22 5.904 3.346 -7.953
188 HH21 DAR 22 1HH2 DAR 22 3.400 1.419 -6.395
189 HH22 DAR 22 2HH2 DAR 22 4.037 1.871 -7.935
190 H DGL 23 H DGL 23 5.268 3.702 0.582
191 HA DGL 23 HA DGL 23 7.376 5.532 1.041
192 HB2 DGL 23 1HB DGL 23 7.466 3.151 1.664
193 HB3 DGL 23 2HB DGL 23 6.161 3.394 2.809
194 HG2 DGL 23 1HG DGL 23 8.201 3.254 4.015
195 HG3 DGL 23 2HG DGL 23 7.600 4.907 4.094
196 H DGL 24 H DGL 24 4.452 4.764 2.874
197 HA DGL 24 HA DGL 24 4.606 6.874 4.731
198 HB2 DGL 24 1HB DGL 24 2.237 5.293 3.745
199 HB3 DGL 24 2HB DGL 24 2.210 6.387 5.117
200 HG2 DGL 24 1HG DGL 24 3.758 5.004 6.321
201 HG3 DGL 24 2HG DGL 24 3.916 3.929 4.929
202 H SER 25 H SER 25 2.483 6.447 1.925
203 HA SER 25 HA SER 25 2.508 9.273 1.396
204 HB2 SER 25 2HB SER 25 2.584 7.626 -0.469
205 HB3 SER 25 1HB SER 25 1.017 7.000 0.033
206 HG SER 25 HG SER 25 1.438 8.846 -1.680
207 H ASP 26 H ASP 26 0.353 10.267 0.960
208 HA ASP 26 HA ASP 26 -1.272 9.883 3.376
209 HB2 ASP 26 2HB ASP 26 -0.199 12.120 2.855
210 HB3 ASP 26 1HB ASP 26 -1.251 12.226 1.454