NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
389296 |
1nin   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1nin
save_distance_constraint_statistics_1
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 1
_Distance_constraint_stats_list.Constraint_count 1029
_Distance_constraint_stats_list.Viol_count 1858
_Distance_constraint_stats_list.Viol_total 3601.669
_Distance_constraint_stats_list.Viol_max 0.636
_Distance_constraint_stats_list.Viol_rms 0.0398
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0088
_Distance_constraint_stats_list.Viol_average_violations_only 0.0969
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 GLU 0.295 0.103 13 0 "[ . 1 . 2]"
1 2 THR 4.665 0.177 9 0 "[ . 1 . 2]"
1 3 TYR 3.665 0.253 18 0 "[ . 1 . 2]"
1 4 THR 3.040 0.240 3 0 "[ . 1 . 2]"
1 5 VAL 2.913 0.206 19 0 "[ . 1 . 2]"
1 6 LYS 0.058 0.035 14 0 "[ . 1 . 2]"
1 7 LEU 9.642 0.403 14 0 "[ . 1 . 2]"
1 8 GLY 0.924 0.267 17 0 "[ . 1 . 2]"
1 9 SER 0.915 0.165 13 0 "[ . 1 . 2]"
1 10 ASP 0.559 0.165 2 0 "[ . 1 . 2]"
1 11 LYS 0.131 0.080 18 0 "[ . 1 . 2]"
1 12 GLY 0.165 0.058 1 0 "[ . 1 . 2]"
1 13 LEU 3.504 0.357 18 0 "[ . 1 . 2]"
1 14 LEU 5.420 0.481 17 0 "[ . 1 . 2]"
1 15 VAL 2.491 0.267 17 0 "[ . 1 . 2]"
1 16 PHE 1.255 0.241 6 0 "[ . 1 . 2]"
1 17 GLU 0.970 0.241 6 0 "[ . 1 . 2]"
1 18 PRO 0.458 0.206 19 0 "[ . 1 . 2]"
1 19 ALA 1.725 0.226 15 0 "[ . 1 . 2]"
1 20 LYS 1.299 0.133 4 0 "[ . 1 . 2]"
1 21 LEU 11.462 0.458 18 0 "[ . 1 . 2]"
1 22 THR 2.621 0.352 12 0 "[ . 1 . 2]"
1 23 ILE 21.459 0.458 18 0 "[ . 1 . 2]"
1 24 LYS 3.549 0.420 20 0 "[ . 1 . 2]"
1 25 PRO 0.722 0.162 9 0 "[ . 1 . 2]"
1 26 GLY 0.375 0.285 6 0 "[ . 1 . 2]"
1 27 ASP 1.980 0.243 19 0 "[ . 1 . 2]"
1 28 THR 4.270 0.163 12 0 "[ . 1 . 2]"
1 29 VAL 8.513 0.291 18 0 "[ . 1 . 2]"
1 30 GLU 2.925 0.139 18 0 "[ . 1 . 2]"
1 31 PHE 0.918 0.162 15 0 "[ . 1 . 2]"
1 32 LEU 5.304 0.211 9 0 "[ . 1 . 2]"
1 33 ASN 2.283 0.264 14 0 "[ . 1 . 2]"
1 34 ASN 0.777 0.165 2 0 "[ . 1 . 2]"
1 35 LYS 0.619 0.145 2 0 "[ . 1 . 2]"
1 36 VAL 2.429 0.159 1 0 "[ . 1 . 2]"
1 37 PRO 0.459 0.149 5 0 "[ . 1 . 2]"
1 38 PRO 0.083 0.060 15 0 "[ . 1 . 2]"
1 39 HIS 7.277 0.283 20 0 "[ . 1 . 2]"
1 40 ASN 0.456 0.225 19 0 "[ . 1 . 2]"
1 41 VAL 3.187 0.132 12 0 "[ . 1 . 2]"
1 42 VAL 3.721 0.239 18 0 "[ . 1 . 2]"
1 43 PHE 6.993 0.429 16 0 "[ . 1 . 2]"
1 44 ASP 1.281 0.115 5 0 "[ . 1 . 2]"
1 45 ALA 2.003 0.216 2 0 "[ . 1 . 2]"
1 46 ALA 0.046 0.040 6 0 "[ . 1 . 2]"
1 47 LEU 2.575 0.315 19 0 "[ . 1 . 2]"
1 48 ASN 2.045 0.249 16 0 "[ . 1 . 2]"
1 49 PRO 0.410 0.107 8 0 "[ . 1 . 2]"
1 50 ALA 0.069 0.026 17 0 "[ . 1 . 2]"
1 51 LYS 1.735 0.370 2 0 "[ . 1 . 2]"
1 52 SER 1.093 0.228 19 0 "[ . 1 . 2]"
1 53 ALA 0.341 0.083 8 0 "[ . 1 . 2]"
1 54 ASP 0.608 0.100 5 0 "[ . 1 . 2]"
1 55 LEU 4.472 0.324 7 0 "[ . 1 . 2]"
1 56 ALA 0.222 0.159 7 0 "[ . 1 . 2]"
1 57 LYS 3.338 0.350 5 0 "[ . 1 . 2]"
1 58 SER 0.372 0.348 1 0 "[ . 1 . 2]"
1 59 LEU 6.647 0.348 1 0 "[ . 1 . 2]"
1 60 SER 10.432 0.429 16 0 "[ . 1 . 2]"
1 61 HIS 1.774 0.282 19 0 "[ . 1 . 2]"
1 62 LYS 2.466 0.322 2 0 "[ . 1 . 2]"
1 63 GLN 2.339 0.360 2 0 "[ . 1 . 2]"
1 64 LEU 5.614 0.367 3 0 "[ . 1 . 2]"
1 65 LEU 1.904 0.220 15 0 "[ . 1 . 2]"
1 66 MET 0.230 0.082 6 0 "[ . 1 . 2]"
1 67 SER 0.298 0.079 11 0 "[ . 1 . 2]"
1 68 PRO 0.298 0.079 11 0 "[ . 1 . 2]"
1 69 GLY 0.863 0.256 18 0 "[ . 1 . 2]"
1 70 GLN 0.217 0.138 19 0 "[ . 1 . 2]"
1 71 SER 0.331 0.088 15 0 "[ . 1 . 2]"
1 72 THR 0.489 0.196 20 0 "[ . 1 . 2]"
1 73 SER 0.330 0.139 18 0 "[ . 1 . 2]"
1 74 THR 0.991 0.137 20 0 "[ . 1 . 2]"
1 75 THR 0.893 0.123 3 0 "[ . 1 . 2]"
1 76 PHE 1.576 0.199 14 0 "[ . 1 . 2]"
1 77 PRO 1.378 0.279 11 0 "[ . 1 . 2]"
1 78 ALA 2.630 0.408 6 0 "[ . 1 . 2]"
1 79 ASP 2.867 0.408 6 0 "[ . 1 . 2]"
1 80 ALA 1.261 0.224 1 0 "[ . 1 . 2]"
1 81 PRO 0.087 0.057 11 0 "[ . 1 . 2]"
1 82 ALA 0.199 0.142 20 0 "[ . 1 . 2]"
1 83 GLY 1.726 0.542 10 1 "[ . + . 2]"
1 84 GLU 0.337 0.118 8 0 "[ . 1 . 2]"
1 85 TYR 2.559 0.338 12 0 "[ . 1 . 2]"
1 86 THR 3.248 0.315 19 0 "[ . 1 . 2]"
1 87 PHE 3.204 0.189 7 0 "[ . 1 . 2]"
1 88 TYR 3.008 0.141 19 0 "[ . 1 . 2]"
1 89 CYS 0.061 0.039 13 0 "[ . 1 . 2]"
1 90 GLU 0.630 0.202 2 0 "[ . 1 . 2]"
1 91 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 HIS 8.403 0.422 1 0 "[ . 1 . 2]"
1 93 ARG 0.096 0.060 9 0 "[ . 1 . 2]"
1 94 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 ALA 1.529 0.314 19 0 "[ . 1 . 2]"
1 96 GLY 1.835 0.314 19 0 "[ . 1 . 2]"
1 97 MET 10.108 0.636 7 10 "[ * ** +* * ** .*- 2]"
1 98 VAL 4.070 0.292 19 0 "[ . 1 . 2]"
1 99 GLY 0.151 0.066 20 0 "[ . 1 . 2]"
1 100 LYS 0.147 0.084 7 0 "[ . 1 . 2]"
1 101 ILE 6.280 0.220 2 0 "[ . 1 . 2]"
1 102 THR 2.407 0.366 4 0 "[ . 1 . 2]"
1 103 VAL 12.920 0.542 10 1 "[ . + . 2]"
1 104 ALA 0.460 0.118 19 0 "[ . 1 . 2]"
1 105 GLY 0.509 0.142 20 0 "[ . 1 . 2]"
2 1 CU 21.360 0.636 7 10 "[ * ** +* * ** .*- 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 GLU HA 1 1 GLU QB 0.000 . 5.000 2.390 2.209 2.612 . 0 0 "[ . 1 . 2]" 1
2 1 1 GLU HA 1 1 GLU QG 0.000 . 4.160 2.880 2.430 3.688 . 0 0 "[ . 1 . 2]" 1
3 1 1 GLU HA 1 2 THR H 0.000 . 2.850 2.613 2.245 2.953 0.103 13 0 "[ . 1 . 2]" 1
4 1 1 GLU QB 1 3 TYR QE 0.000 . 8.000 3.422 2.024 6.370 . 0 0 "[ . 1 . 2]" 1
5 1 1 GLU QG 1 2 THR H 0.000 . 6.000 3.897 1.915 4.896 0.085 20 0 "[ . 1 . 2]" 1
6 1 1 GLU QG 1 3 TYR QE 0.000 . 8.000 4.361 2.583 6.401 . 0 0 "[ . 1 . 2]" 1
7 1 2 THR H 1 2 THR HB 0.000 . 3.560 2.789 2.067 3.582 0.022 19 0 "[ . 1 . 2]" 1
8 1 2 THR H 1 2 THR HG1 0.000 . 6.000 2.566 1.959 3.285 0.041 19 0 "[ . 1 . 2]" 1
9 1 2 THR H 1 3 TYR H 0.000 . 5.000 3.981 3.095 4.423 . 0 0 "[ . 1 . 2]" 1
10 1 2 THR H 1 3 TYR QD 0.000 . 7.000 5.197 3.329 5.820 . 0 0 "[ . 1 . 2]" 1
11 1 2 THR H 1 29 VAL H 0.000 . 5.000 5.116 5.040 5.176 0.176 18 0 "[ . 1 . 2]" 1
12 1 2 THR HA 1 2 THR HG1 0.000 . 5.600 2.442 2.204 3.020 . 0 0 "[ . 1 . 2]" 1
13 1 2 THR HA 1 3 TYR H 0.000 . 2.850 2.149 1.823 2.693 0.177 9 0 "[ . 1 . 2]" 1
14 1 2 THR HA 1 3 TYR QD 0.000 . 7.000 4.368 3.684 4.978 . 0 0 "[ . 1 . 2]" 1
15 1 2 THR HA 1 28 THR H 0.000 . 5.001 4.134 2.328 5.042 0.041 11 0 "[ . 1 . 2]" 1
16 1 2 THR HA 1 28 THR HB 0.000 . 3.560 3.058 2.426 3.683 0.123 10 0 "[ . 1 . 2]" 1
17 1 2 THR HA 1 28 THR HG1 0.000 . 6.000 3.644 2.745 4.890 . 0 0 "[ . 1 . 2]" 1
18 1 2 THR HB 1 2 THR HG1 0.000 . 3.560 1.982 1.866 2.121 0.134 17 0 "[ . 1 . 2]" 1
19 1 2 THR HB 1 3 TYR H 0.000 . 5.000 4.254 3.355 4.591 . 0 0 "[ . 1 . 2]" 1
20 1 2 THR HG1 1 3 TYR H 0.000 . 6.000 3.527 1.849 4.081 0.151 3 0 "[ . 1 . 2]" 1
21 1 2 THR HG1 1 28 THR HA 0.000 . 6.000 4.276 3.865 4.863 . 0 0 "[ . 1 . 2]" 1
22 1 2 THR HG1 1 28 THR HB 0.000 . 6.000 2.643 1.889 3.577 0.111 14 0 "[ . 1 . 2]" 1
23 1 2 THR HG1 1 29 VAL HA 0.000 . 6.000 3.529 1.856 4.843 0.144 10 0 "[ . 1 . 2]" 1
24 1 3 TYR H 1 3 TYR QB 0.000 . 5.600 2.631 2.470 3.132 . 0 0 "[ . 1 . 2]" 1
25 1 3 TYR H 1 3 TYR QD 0.000 . 5.560 2.955 2.232 3.641 . 0 0 "[ . 1 . 2]" 1
26 1 3 TYR H 1 28 THR HB 0.000 . 5.000 4.811 4.063 5.123 0.123 15 0 "[ . 1 . 2]" 1
27 1 3 TYR H 1 29 VAL HA 0.000 . 5.000 2.498 1.747 5.029 0.253 18 0 "[ . 1 . 2]" 1
28 1 3 TYR H 1 29 VAL QG 0.000 . 7.900 3.151 1.930 5.343 0.070 14 0 "[ . 1 . 2]" 1
29 1 3 TYR H 1 30 GLU H 0.000 . 5.000 3.606 2.980 4.768 . 0 0 "[ . 1 . 2]" 1
30 1 3 TYR HA 1 3 TYR QB 0.000 . 5.000 2.375 2.101 2.443 . 0 0 "[ . 1 . 2]" 1
31 1 3 TYR HA 1 3 TYR QD 0.000 . 4.560 2.532 2.028 3.065 . 0 0 "[ . 1 . 2]" 1
32 1 3 TYR HA 1 3 TYR QE 0.000 . 5.600 4.647 4.236 5.162 . 0 0 "[ . 1 . 2]" 1
33 1 3 TYR HA 1 4 THR H 0.000 . 5.001 2.273 2.032 2.645 . 0 0 "[ . 1 . 2]" 1
34 1 3 TYR QB 1 3 TYR QD 0.000 . 3.560 2.185 2.103 2.266 . 0 0 "[ . 1 . 2]" 1
35 1 3 TYR QB 1 4 THR H 0.000 . 6.000 3.319 2.412 3.984 . 0 0 "[ . 1 . 2]" 1
36 1 3 TYR QB 1 21 LEU QD 0.000 . 8.900 2.650 1.816 3.600 0.184 9 0 "[ . 1 . 2]" 1
37 1 3 TYR QB 1 29 VAL QG 0.000 . 8.900 2.965 1.923 5.691 0.077 7 0 "[ . 1 . 2]" 1
38 1 3 TYR QD 1 21 LEU QD 0.000 . 9.900 2.186 1.782 3.311 0.218 3 0 "[ . 1 . 2]" 1
39 1 3 TYR QD 1 23 ILE MD 0.000 . 8.500 5.382 4.797 6.192 . 0 0 "[ . 1 . 2]" 1
40 1 3 TYR QD 1 23 ILE MG 0.000 . 8.500 2.562 1.959 3.528 0.041 5 0 "[ . 1 . 2]" 1
41 1 3 TYR QD 1 27 ASP QB 0.000 . 8.000 4.677 3.011 6.369 . 0 0 "[ . 1 . 2]" 1
42 1 3 TYR QD 1 29 VAL QG 0.000 . 9.900 3.114 1.907 5.396 0.093 4 0 "[ . 1 . 2]" 1
43 1 3 TYR QE 1 21 LEU QD 0.000 . 9.900 3.097 1.823 4.215 0.177 13 0 "[ . 1 . 2]" 1
44 1 3 TYR QE 1 23 ILE HA 0.000 . 7.000 3.228 2.018 4.297 . 0 0 "[ . 1 . 2]" 1
45 1 3 TYR QE 1 23 ILE MG 0.000 . 8.500 2.682 1.955 3.818 0.045 4 0 "[ . 1 . 2]" 1
46 1 3 TYR QE 1 24 LYS H 0.000 . 7.000 4.029 2.648 5.927 . 0 0 "[ . 1 . 2]" 1
47 1 3 TYR QE 1 27 ASP QB 0.000 . 8.000 3.858 2.389 6.322 . 0 0 "[ . 1 . 2]" 1
48 1 4 THR H 1 4 THR HB 0.000 . 3.560 3.143 2.445 3.661 0.101 15 0 "[ . 1 . 2]" 1
49 1 4 THR H 1 4 THR HG1 0.000 . 6.000 2.336 1.760 3.336 0.240 3 0 "[ . 1 . 2]" 1
50 1 4 THR HA 1 4 THR HG1 0.000 . 4.160 2.417 2.082 2.946 . 0 0 "[ . 1 . 2]" 1
51 1 4 THR HA 1 5 VAL H 0.000 . 2.850 2.152 1.849 2.464 0.151 1 0 "[ . 1 . 2]" 1
52 1 4 THR HA 1 5 VAL QG 0.000 . 7.900 3.723 3.257 4.129 . 0 0 "[ . 1 . 2]" 1
53 1 4 THR HA 1 29 VAL QG 0.000 . 7.900 4.317 2.957 5.474 . 0 0 "[ . 1 . 2]" 1
54 1 4 THR HA 1 30 GLU H 0.000 . 3.560 3.148 2.419 3.618 0.058 12 0 "[ . 1 . 2]" 1
55 1 4 THR HA 1 30 GLU QB 0.000 . 6.000 2.371 1.877 4.218 0.123 20 0 "[ . 1 . 2]" 1
56 1 4 THR HB 1 4 THR HG1 0.000 . 3.560 2.029 1.872 2.131 0.128 1 0 "[ . 1 . 2]" 1
57 1 4 THR HB 1 5 VAL H 0.000 . 5.000 4.134 3.082 4.583 . 0 0 "[ . 1 . 2]" 1
58 1 4 THR HG1 1 5 VAL H 0.000 . 6.000 3.593 3.054 4.259 . 0 0 "[ . 1 . 2]" 1
59 1 4 THR HG1 1 32 LEU QB 0.000 . 7.000 3.440 2.089 4.834 . 0 0 "[ . 1 . 2]" 1
60 1 4 THR HG1 1 32 LEU QD 0.000 . 8.900 3.212 1.789 4.578 0.211 9 0 "[ . 1 . 2]" 1
61 1 5 VAL H 1 5 VAL HB 0.000 . 3.560 2.626 2.308 3.645 0.085 18 0 "[ . 1 . 2]" 1
62 1 5 VAL H 1 5 VAL QG 0.000 . 5.760 2.282 1.859 2.780 0.141 18 0 "[ . 1 . 2]" 1
63 1 5 VAL H 1 29 VAL QG 0.000 . 7.900 3.671 2.823 4.919 . 0 0 "[ . 1 . 2]" 1
64 1 5 VAL H 1 30 GLU H 0.000 . 5.000 3.482 2.621 4.153 . 0 0 "[ . 1 . 2]" 1
65 1 5 VAL H 1 30 GLU QB 0.000 . 6.000 3.562 2.691 5.022 . 0 0 "[ . 1 . 2]" 1
66 1 5 VAL H 1 31 PHE HA 0.000 . 5.000 3.591 2.854 4.900 . 0 0 "[ . 1 . 2]" 1
67 1 5 VAL H 1 31 PHE QD 0.000 . 7.000 4.575 3.294 5.795 . 0 0 "[ . 1 . 2]" 1
68 1 5 VAL H 1 32 LEU H 0.000 . 5.000 3.995 2.882 5.021 0.021 10 0 "[ . 1 . 2]" 1
69 1 5 VAL HA 1 5 VAL QG 0.000 . 3.950 2.190 2.105 2.447 . 0 0 "[ . 1 . 2]" 1
70 1 5 VAL HA 1 6 LYS H 0.000 . 2.850 2.237 2.028 2.885 0.035 14 0 "[ . 1 . 2]" 1
71 1 5 VAL HA 1 18 PRO QD 0.000 . 6.000 3.054 1.888 4.656 0.112 8 0 "[ . 1 . 2]" 1
72 1 5 VAL HB 1 5 VAL QG 0.000 . 3.350 1.938 1.921 1.949 0.079 5 0 "[ . 1 . 2]" 1
73 1 5 VAL HB 1 6 LYS H 0.000 . 5.000 4.009 2.422 4.401 . 0 0 "[ . 1 . 2]" 1
74 1 5 VAL HB 1 29 VAL QG 0.000 . 7.900 3.617 2.503 5.288 . 0 0 "[ . 1 . 2]" 1
75 1 5 VAL HB 1 31 PHE QD 0.000 . 7.000 3.447 2.373 4.676 . 0 0 "[ . 1 . 2]" 1
76 1 5 VAL QG 1 6 LYS H 0.000 . 7.900 2.659 2.126 3.718 . 0 0 "[ . 1 . 2]" 1
77 1 5 VAL QG 1 7 LEU QD 0.000 . 10.800 3.387 1.859 4.788 0.141 16 0 "[ . 1 . 2]" 1
78 1 5 VAL QG 1 16 PHE HA 0.000 . 7.900 3.863 2.450 5.747 . 0 0 "[ . 1 . 2]" 1
79 1 5 VAL QG 1 16 PHE QB 0.000 . 8.900 3.513 1.971 4.828 0.029 16 0 "[ . 1 . 2]" 1
80 1 5 VAL QG 1 17 GLU H 0.000 . 6.460 3.643 2.670 4.811 . 0 0 "[ . 1 . 2]" 1
81 1 5 VAL QG 1 18 PRO QD 0.000 . 6.750 2.480 1.794 3.830 0.206 19 0 "[ . 1 . 2]" 1
82 1 5 VAL QG 1 29 VAL QG 0.000 . 10.800 2.438 1.834 3.463 0.166 14 0 "[ . 1 . 2]" 1
83 1 5 VAL QG 1 31 PHE HA 0.000 . 7.900 3.330 1.838 4.260 0.162 15 0 "[ . 1 . 2]" 1
84 1 5 VAL QG 1 31 PHE QD 0.000 . 7.750 3.008 1.949 4.244 0.051 3 0 "[ . 1 . 2]" 1
85 1 5 VAL QG 1 31 PHE HZ 0.000 . 7.900 4.418 2.836 5.519 . 0 0 "[ . 1 . 2]" 1
86 1 5 VAL QG 1 87 PHE QE 0.000 . 9.900 3.333 2.322 4.533 . 0 0 "[ . 1 . 2]" 1
87 1 5 VAL QG 1 87 PHE HZ 0.000 . 7.900 3.998 2.887 5.021 . 0 0 "[ . 1 . 2]" 1
88 1 6 LYS H 1 6 LYS QB 0.000 . 3.450 2.471 2.172 2.720 . 0 0 "[ . 1 . 2]" 1
89 1 6 LYS H 1 7 LEU H 0.000 . 5.000 4.305 3.104 4.697 . 0 0 "[ . 1 . 2]" 1
90 1 6 LYS H 1 18 PRO QD 0.000 . 6.000 4.032 3.262 5.358 . 0 0 "[ . 1 . 2]" 1
91 1 6 LYS HA 1 6 LYS QB 0.000 . 5.000 2.371 2.151 2.596 . 0 0 "[ . 1 . 2]" 1
92 1 6 LYS HA 1 7 LEU H 0.000 . 2.850 2.187 1.984 2.623 0.016 19 0 "[ . 1 . 2]" 1
93 1 6 LYS HA 1 32 LEU H 0.000 . 5.000 3.069 2.398 4.234 . 0 0 "[ . 1 . 2]" 1
94 1 6 LYS QB 1 7 LEU H 0.000 . 6.000 3.246 2.199 3.954 . 0 0 "[ . 1 . 2]" 1
95 1 7 LEU H 1 7 LEU QB 0.000 . 5.600 2.804 2.146 3.194 . 0 0 "[ . 1 . 2]" 1
96 1 7 LEU H 1 7 LEU QD 0.000 . 7.810 2.291 1.597 3.193 0.403 14 0 "[ . 1 . 2]" 1
97 1 7 LEU H 1 7 LEU HG 0.000 . 3.560 2.440 1.767 3.680 0.233 7 0 "[ . 1 . 2]" 1
98 1 7 LEU H 1 32 LEU H 0.000 . 5.000 3.970 2.813 4.596 . 0 0 "[ . 1 . 2]" 1
99 1 7 LEU H 1 32 LEU QB 0.000 . 5.600 4.007 3.023 5.046 . 0 0 "[ . 1 . 2]" 1
100 1 7 LEU H 1 33 ASN HA 0.000 . 5.000 3.803 2.870 4.989 . 0 0 "[ . 1 . 2]" 1
101 1 7 LEU HA 1 7 LEU QD 0.000 . 7.200 2.982 1.987 3.424 0.013 6 0 "[ . 1 . 2]" 1
102 1 7 LEU HA 1 8 GLY H 0.000 . 2.850 2.274 1.941 2.882 0.059 10 0 "[ . 1 . 2]" 1
103 1 7 LEU QB 1 7 LEU QD 0.000 . 6.910 1.925 1.833 2.082 0.167 3 0 "[ . 1 . 2]" 1
104 1 7 LEU QB 1 34 ASN H 0.000 . 5.600 4.165 2.314 5.107 . 0 0 "[ . 1 . 2]" 1
105 1 7 LEU QD 1 16 PHE QE 0.000 . 9.900 2.748 1.869 4.812 0.131 2 0 "[ . 1 . 2]" 1
106 1 7 LEU QD 1 31 PHE HA 0.000 . 7.900 3.200 2.221 4.464 . 0 0 "[ . 1 . 2]" 1
107 1 7 LEU QD 1 31 PHE QB 0.000 . 8.900 2.390 1.846 3.643 0.154 7 0 "[ . 1 . 2]" 1
108 1 7 LEU QD 1 32 LEU H 0.000 . 7.900 3.249 2.501 3.930 . 0 0 "[ . 1 . 2]" 1
109 1 7 LEU QD 1 33 ASN H 0.000 . 5.000 3.261 2.849 3.741 . 0 0 "[ . 1 . 2]" 1
110 1 7 LEU QD 1 33 ASN HA 0.000 . 7.900 2.164 1.736 2.567 0.264 14 0 "[ . 1 . 2]" 1
111 1 7 LEU QD 1 39 HIS QB 0.000 . 8.900 1.912 1.717 2.329 0.283 20 0 "[ . 1 . 2]" 1
112 1 7 LEU QD 1 39 HIS HD2 0.000 . 7.900 2.907 2.273 3.557 . 0 0 "[ . 1 . 2]" 1
113 1 7 LEU QD 1 39 HIS HE2 0.000 . 7.900 3.981 2.869 5.113 . 0 0 "[ . 1 . 2]" 1
114 1 7 LEU QD 1 40 ASN H 0.000 . 7.900 5.127 4.492 5.722 . 0 0 "[ . 1 . 2]" 1
115 1 7 LEU QD 1 41 VAL QG 0.000 . 9.360 2.724 2.319 3.325 . 0 0 "[ . 1 . 2]" 1
116 1 7 LEU QD 1 65 LEU QD 0.000 . 10.800 2.897 1.780 4.515 0.220 15 0 "[ . 1 . 2]" 1
117 1 7 LEU QD 1 92 HIS HE1 0.000 . 7.900 5.191 4.570 5.814 . 0 0 "[ . 1 . 2]" 1
118 1 7 LEU HG 1 16 PHE QE 0.000 . 7.000 4.588 2.658 6.206 . 0 0 "[ . 1 . 2]" 1
119 1 7 LEU HG 1 34 ASN H 0.000 . 5.000 4.083 2.547 5.100 0.100 17 0 "[ . 1 . 2]" 1
120 1 8 GLY H 1 8 GLY QA 0.000 . 2.850 2.405 2.272 2.483 . 0 0 "[ . 1 . 2]" 1
121 1 8 GLY H 1 9 SER H 0.000 . 5.000 3.428 1.846 4.441 0.154 3 0 "[ . 1 . 2]" 1
122 1 8 GLY H 1 16 PHE HA 0.000 . 5.000 3.460 2.481 4.793 . 0 0 "[ . 1 . 2]" 1
123 1 8 GLY H 1 97 MET ME 0.000 . 6.000 3.164 2.018 4.817 . 0 0 "[ . 1 . 2]" 1
124 1 8 GLY QA 1 9 SER H 0.000 . 4.560 2.288 1.923 2.719 0.077 6 0 "[ . 1 . 2]" 1
125 1 8 GLY QA 1 15 VAL H 0.000 . 6.000 2.708 1.733 4.254 0.267 17 0 "[ . 1 . 2]" 1
126 1 8 GLY QA 1 35 LYS H 0.000 . 6.000 4.020 2.062 5.143 . 0 0 "[ . 1 . 2]" 1
127 1 8 GLY QA 1 39 HIS HE2 0.000 . 6.000 4.239 2.423 5.288 . 0 0 "[ . 1 . 2]" 1
128 1 9 SER H 1 9 SER QB 0.000 . 5.600 2.688 2.299 3.331 . 0 0 "[ . 1 . 2]" 1
129 1 9 SER H 1 13 LEU H 0.000 . 5.000 4.390 3.320 5.114 0.114 15 0 "[ . 1 . 2]" 1
130 1 9 SER H 1 15 VAL H 0.000 . 5.000 3.183 2.619 4.376 . 0 0 "[ . 1 . 2]" 1
131 1 9 SER H 1 15 VAL QG 0.000 . 7.900 3.313 2.328 4.747 . 0 0 "[ . 1 . 2]" 1
132 1 9 SER HA 1 9 SER QB 0.000 . 3.560 2.343 2.192 2.564 . 0 0 "[ . 1 . 2]" 1
133 1 9 SER HA 1 10 ASP H 0.000 . 3.560 2.661 1.889 3.593 0.111 13 0 "[ . 1 . 2]" 1
134 1 9 SER QB 1 10 ASP H 0.000 . 4.560 3.235 2.142 4.011 . 0 0 "[ . 1 . 2]" 1
135 1 9 SER QB 1 15 VAL QG 0.000 . 8.900 3.229 1.835 5.798 0.165 13 0 "[ . 1 . 2]" 1
136 1 10 ASP H 1 10 ASP QB 0.000 . 4.160 2.596 2.089 3.253 . 0 0 "[ . 1 . 2]" 1
137 1 10 ASP H 1 15 VAL QG 0.000 . 7.900 5.253 3.787 5.888 . 0 0 "[ . 1 . 2]" 1
138 1 10 ASP H 1 34 ASN QD 0.000 . 6.000 3.316 1.835 5.381 0.165 2 0 "[ . 1 . 2]" 1
139 1 10 ASP HA 1 10 ASP QB 0.000 . 3.560 2.387 2.210 2.616 . 0 0 "[ . 1 . 2]" 1
140 1 10 ASP HA 1 12 GLY H 0.000 . 5.000 4.394 3.092 5.058 0.058 1 0 "[ . 1 . 2]" 1
141 1 10 ASP HA 1 34 ASN QD 0.000 . 4.560 3.245 2.288 4.154 . 0 0 "[ . 1 . 2]" 1
142 1 11 LYS HA 1 11 LYS QB 0.000 . 2.850 2.371 2.206 2.521 . 0 0 "[ . 1 . 2]" 1
143 1 11 LYS HA 1 11 LYS QD 0.000 . 6.000 3.417 1.920 4.503 0.080 18 0 "[ . 1 . 2]" 1
144 1 11 LYS HA 1 11 LYS QE 0.000 . 5.000 4.027 1.950 4.517 0.050 3 0 "[ . 1 . 2]" 1
145 1 11 LYS HA 1 12 GLY H 0.000 . 5.000 3.092 2.428 3.503 . 0 0 "[ . 1 . 2]" 1
146 1 12 GLY H 1 12 GLY QA 0.000 . 2.850 2.425 2.280 2.527 . 0 0 "[ . 1 . 2]" 1
147 1 12 GLY H 1 13 LEU H 0.000 . 3.560 2.800 2.042 3.589 0.029 20 0 "[ . 1 . 2]" 1
148 1 12 GLY QA 1 13 LEU H 0.000 . 6.000 2.554 2.167 2.994 . 0 0 "[ . 1 . 2]" 1
149 1 13 LEU H 1 13 LEU QB 0.000 . 3.450 2.612 2.246 3.113 . 0 0 "[ . 1 . 2]" 1
150 1 13 LEU H 1 13 LEU QD 0.000 . 7.810 3.202 1.752 4.104 0.248 1 0 "[ . 1 . 2]" 1
151 1 13 LEU H 1 14 LEU H 0.000 . 5.000 4.421 3.791 4.694 . 0 0 "[ . 1 . 2]" 1
152 1 13 LEU HA 1 13 LEU QB 0.000 . 5.000 2.425 2.159 2.609 . 0 0 "[ . 1 . 2]" 1
153 1 13 LEU HA 1 14 LEU H 0.000 . 5.000 2.374 2.032 3.532 . 0 0 "[ . 1 . 2]" 1
154 1 13 LEU QB 1 15 VAL QG 0.000 . 7.460 2.427 1.837 3.314 0.163 4 0 "[ . 1 . 2]" 1
155 1 13 LEU QD 1 13 LEU HG 0.000 . 5.500 1.936 1.910 1.954 0.090 18 0 "[ . 1 . 2]" 1
156 1 13 LEU QD 1 14 LEU H 0.000 . 7.900 3.046 1.643 4.464 0.357 18 0 "[ . 1 . 2]" 1
157 1 14 LEU H 1 14 LEU QB 0.000 . 5.600 2.444 2.226 2.862 . 0 0 "[ . 1 . 2]" 1
158 1 14 LEU H 1 14 LEU QD 0.000 . 7.810 3.106 1.519 3.524 0.481 17 0 "[ . 1 . 2]" 1
159 1 14 LEU H 1 14 LEU HG 0.000 . 2.850 2.604 2.110 3.077 0.227 17 0 "[ . 1 . 2]" 1
160 1 14 LEU H 1 15 VAL QG 0.000 . 7.900 3.621 2.669 4.380 . 0 0 "[ . 1 . 2]" 1
161 1 14 LEU HA 1 14 LEU QB 0.000 . 5.000 2.394 2.189 2.521 . 0 0 "[ . 1 . 2]" 1
162 1 14 LEU HA 1 14 LEU QD 0.000 . 7.200 2.173 1.948 3.389 0.052 6 0 "[ . 1 . 2]" 1
163 1 14 LEU HA 1 15 VAL H 0.000 . 2.850 2.548 2.192 2.867 0.017 6 0 "[ . 1 . 2]" 1
164 1 14 LEU HA 1 39 HIS HE1 0.000 . 5.000 4.408 3.206 5.027 0.027 5 0 "[ . 1 . 2]" 1
165 1 14 LEU QB 1 14 LEU QD 0.000 . 4.760 1.933 1.845 2.100 0.155 20 0 "[ . 1 . 2]" 1
166 1 14 LEU QD 1 14 LEU HG 0.000 . 5.500 1.938 1.829 1.962 0.171 17 0 "[ . 1 . 2]" 1
167 1 14 LEU QD 1 15 VAL H 0.000 . 7.900 4.122 3.501 4.387 . 0 0 "[ . 1 . 2]" 1
168 1 14 LEU QD 1 36 VAL HB 0.000 . 7.900 2.291 1.841 4.153 0.159 1 0 "[ . 1 . 2]" 1
169 1 14 LEU QD 1 39 HIS HD2 0.000 . 7.900 5.466 5.029 5.933 . 0 0 "[ . 1 . 2]" 1
170 1 14 LEU QD 1 39 HIS HE1 0.000 . 6.460 2.511 2.022 3.773 . 0 0 "[ . 1 . 2]" 1
171 1 14 LEU QD 1 39 HIS HE2 0.000 . 7.900 3.732 3.317 4.400 . 0 0 "[ . 1 . 2]" 1
172 1 14 LEU QD 1 92 HIS HD2 0.000 . 7.900 3.831 2.326 5.098 . 0 0 "[ . 1 . 2]" 1
173 1 14 LEU QD 1 92 HIS HE1 0.000 . 7.900 4.041 2.970 5.789 . 0 0 "[ . 1 . 2]" 1
174 1 15 VAL HA 1 15 VAL QG 0.000 . 6.100 2.295 2.139 2.412 . 0 0 "[ . 1 . 2]" 1
175 1 15 VAL HA 1 16 PHE H 0.000 . 2.850 2.479 2.172 2.839 . 0 0 "[ . 1 . 2]" 1
176 1 15 VAL HB 1 15 VAL QG 0.000 . 4.060 1.929 1.903 1.949 0.097 10 0 "[ . 1 . 2]" 1
177 1 15 VAL QG 1 17 GLU QB 0.000 . 8.900 3.730 2.201 5.118 . 0 0 "[ . 1 . 2]" 1
178 1 16 PHE H 1 16 PHE QB 0.000 . 4.160 2.470 2.260 3.347 . 0 0 "[ . 1 . 2]" 1
179 1 16 PHE H 1 16 PHE QD 0.000 . 7.000 3.517 2.510 4.446 . 0 0 "[ . 1 . 2]" 1
180 1 16 PHE HA 1 16 PHE QB 0.000 . 5.000 2.504 2.323 2.604 . 0 0 "[ . 1 . 2]" 1
181 1 16 PHE HA 1 16 PHE QD 0.000 . 6.000 2.513 1.971 3.179 0.029 17 0 "[ . 1 . 2]" 1
182 1 16 PHE HA 1 17 GLU H 0.000 . 2.850 2.314 1.947 3.091 0.241 6 0 "[ . 1 . 2]" 1
183 1 16 PHE QB 1 16 PHE QD 0.000 . 2.850 2.172 2.125 2.271 . 0 0 "[ . 1 . 2]" 1
184 1 16 PHE QB 1 19 ALA HA 0.000 . 3.850 2.529 1.892 3.325 0.108 4 0 "[ . 1 . 2]" 1
185 1 16 PHE QD 1 41 VAL QG 0.000 . 9.900 4.535 3.886 5.382 . 0 0 "[ . 1 . 2]" 1
186 1 16 PHE QD 1 98 VAL HA 0.000 . 7.000 4.096 2.884 5.235 . 0 0 "[ . 1 . 2]" 1
187 1 16 PHE QE 1 41 VAL QG 0.000 . 9.900 2.959 2.101 3.853 . 0 0 "[ . 1 . 2]" 1
188 1 16 PHE QE 1 87 PHE QD 0.000 . 9.000 3.088 2.011 4.449 . 0 0 "[ . 1 . 2]" 1
189 1 16 PHE QE 1 87 PHE QE 0.000 . 9.000 4.045 2.627 5.833 . 0 0 "[ . 1 . 2]" 1
190 1 16 PHE QE 1 88 TYR HA 0.000 . 5.560 3.925 2.386 5.142 . 0 0 "[ . 1 . 2]" 1
191 1 16 PHE QE 1 89 CYS H 0.000 . 7.000 3.885 2.932 4.674 . 0 0 "[ . 1 . 2]" 1
192 1 16 PHE QE 1 89 CYS QB 0.000 . 8.000 3.488 2.371 5.800 . 0 0 "[ . 1 . 2]" 1
193 1 16 PHE QE 1 98 VAL HA 0.000 . 5.560 3.382 2.761 4.159 . 0 0 "[ . 1 . 2]" 1
194 1 16 PHE HZ 1 41 VAL QG 0.000 . 7.900 2.371 1.883 3.308 0.117 10 0 "[ . 1 . 2]" 1
195 1 16 PHE HZ 1 87 PHE QD 0.000 . 7.000 3.791 2.125 5.219 . 0 0 "[ . 1 . 2]" 1
196 1 16 PHE HZ 1 88 TYR HA 0.000 . 5.000 4.579 3.932 5.042 0.042 7 0 "[ . 1 . 2]" 1
197 1 16 PHE HZ 1 99 GLY H 0.000 . 5.000 4.485 3.507 5.066 0.066 20 0 "[ . 1 . 2]" 1
198 1 17 GLU H 1 17 GLU QB 0.000 . 4.160 2.475 2.125 3.088 . 0 0 "[ . 1 . 2]" 1
199 1 17 GLU HA 1 19 ALA H 0.000 . 5.000 2.688 1.774 4.841 0.226 15 0 "[ . 1 . 2]" 1
200 1 18 PRO HA 1 18 PRO QB 0.000 . 5.000 2.184 2.155 2.214 . 0 0 "[ . 1 . 2]" 1
201 1 18 PRO HA 1 19 ALA H 0.000 . 3.560 2.540 2.070 3.321 . 0 0 "[ . 1 . 2]" 1
202 1 18 PRO HA 1 20 LYS H 0.000 . 5.000 4.366 3.933 4.780 . 0 0 "[ . 1 . 2]" 1
203 1 18 PRO QB 1 18 PRO QD 0.000 . 3.610 2.810 2.553 2.967 . 0 0 "[ . 1 . 2]" 1
204 1 18 PRO QB 1 18 PRO QG 0.000 . 5.000 2.058 2.032 2.079 . 0 0 "[ . 1 . 2]" 1
205 1 18 PRO QB 1 19 ALA H 0.000 . 6.000 3.725 2.468 4.031 . 0 0 "[ . 1 . 2]" 1
206 1 18 PRO QB 1 20 LYS H 0.000 . 4.560 3.682 2.825 3.885 . 0 0 "[ . 1 . 2]" 1
207 1 18 PRO QD 1 18 PRO QG 0.000 . 3.560 2.022 1.972 2.053 0.028 6 0 "[ . 1 . 2]" 1
208 1 18 PRO QD 1 21 LEU QD 0.000 . 8.900 4.298 3.517 5.233 . 0 0 "[ . 1 . 2]" 1
209 1 18 PRO QG 1 21 LEU QD 0.000 . 8.900 3.819 2.594 4.874 . 0 0 "[ . 1 . 2]" 1
210 1 19 ALA H 1 19 ALA HA 0.000 . 2.850 2.482 2.300 2.945 0.095 16 0 "[ . 1 . 2]" 1
211 1 19 ALA H 1 19 ALA MB 0.000 . 6.100 2.493 2.141 2.925 . 0 0 "[ . 1 . 2]" 1
212 1 19 ALA H 1 20 LYS H 0.000 . 3.560 3.414 1.933 3.674 0.114 6 0 "[ . 1 . 2]" 1
213 1 19 ALA HA 1 19 ALA MB 0.000 . 3.950 2.160 2.139 2.203 . 0 0 "[ . 1 . 2]" 1
214 1 19 ALA HA 1 20 LYS H 0.000 . 5.000 3.460 3.330 3.519 . 0 0 "[ . 1 . 2]" 1
215 1 20 LYS H 1 20 LYS QB 0.000 . 4.160 2.632 2.201 3.078 . 0 0 "[ . 1 . 2]" 1
216 1 20 LYS H 1 20 LYS QG 0.000 . 6.000 2.817 1.867 4.158 0.133 4 0 "[ . 1 . 2]" 1
217 1 20 LYS HA 1 20 LYS QB 0.000 . 3.560 2.281 2.084 2.583 . 0 0 "[ . 1 . 2]" 1
218 1 20 LYS HA 1 20 LYS QD 0.000 . 6.000 3.983 2.385 4.608 . 0 0 "[ . 1 . 2]" 1
219 1 20 LYS HA 1 20 LYS QG 0.000 . 5.600 3.012 2.166 3.553 . 0 0 "[ . 1 . 2]" 1
220 1 20 LYS HA 1 21 LEU H 0.000 . 3.560 2.270 2.038 2.788 . 0 0 "[ . 1 . 2]" 1
221 1 20 LYS HA 1 21 LEU HA 0.000 . 5.000 4.543 4.427 4.815 . 0 0 "[ . 1 . 2]" 1
222 1 20 LYS HA 1 21 LEU QD 0.000 . 7.900 5.347 5.054 5.630 . 0 0 "[ . 1 . 2]" 1
223 1 20 LYS HA 1 100 LYS H 0.000 . 3.560 3.236 2.607 3.592 0.032 14 0 "[ . 1 . 2]" 1
224 1 20 LYS QB 1 21 LEU H 0.000 . 6.000 3.759 3.284 4.108 . 0 0 "[ . 1 . 2]" 1
225 1 21 LEU H 1 21 LEU QD 0.000 . 7.810 3.847 3.666 3.969 . 0 0 "[ . 1 . 2]" 1
226 1 21 LEU H 1 22 THR H 0.000 . 5.000 4.371 4.111 4.570 . 0 0 "[ . 1 . 2]" 1
227 1 21 LEU H 1 101 ILE HA 0.000 . 3.560 3.118 2.687 3.625 0.065 15 0 "[ . 1 . 2]" 1
228 1 21 LEU H 1 102 THR H 0.000 . 5.000 4.068 3.638 4.616 . 0 0 "[ . 1 . 2]" 1
229 1 21 LEU HA 1 21 LEU QD 0.000 . 7.200 2.210 1.900 2.446 0.100 6 0 "[ . 1 . 2]" 1
230 1 21 LEU HA 1 22 THR H 0.000 . 2.850 2.208 2.092 2.331 . 0 0 "[ . 1 . 2]" 1
231 1 21 LEU QB 1 21 LEU QD 0.000 . 6.910 2.049 1.992 2.157 0.008 7 0 "[ . 1 . 2]" 1
232 1 21 LEU QB 1 21 LEU HG 0.000 . 5.000 2.273 2.201 2.332 . 0 0 "[ . 1 . 2]" 1
233 1 21 LEU QB 1 23 ILE MG 0.000 . 7.500 3.314 2.262 4.121 . 0 0 "[ . 1 . 2]" 1
234 1 21 LEU QB 1 101 ILE H 0.000 . 5.600 4.841 3.989 5.051 . 0 0 "[ . 1 . 2]" 1
235 1 21 LEU QB 1 101 ILE MD 0.000 . 7.150 3.906 3.384 4.673 . 0 0 "[ . 1 . 2]" 1
236 1 21 LEU QB 1 101 ILE MG 0.000 . 7.500 4.531 3.185 5.200 . 0 0 "[ . 1 . 2]" 1
237 1 21 LEU QD 1 22 THR H 0.000 . 7.900 2.201 1.658 2.679 0.342 4 0 "[ . 1 . 2]" 1
238 1 21 LEU QD 1 23 ILE MG 0.000 . 9.400 1.615 1.542 1.772 0.458 18 0 "[ . 1 . 2]" 1
239 1 21 LEU QD 1 24 LYS HA 0.000 . 7.900 5.853 5.518 6.010 . 0 0 "[ . 1 . 2]" 1
240 1 21 LEU QD 1 29 VAL QG 0.000 . 10.800 2.232 1.709 3.401 0.291 18 0 "[ . 1 . 2]" 1
241 1 21 LEU QD 1 87 PHE QE 0.000 . 9.900 4.687 3.429 5.707 . 0 0 "[ . 1 . 2]" 1
242 1 21 LEU QD 1 101 ILE MD 0.000 . 9.400 2.729 1.809 3.933 0.191 15 0 "[ . 1 . 2]" 1
243 1 21 LEU HG 1 23 ILE MG 0.000 . 6.500 3.488 1.814 3.861 0.186 9 0 "[ . 1 . 2]" 1
244 1 22 THR H 1 22 THR HB 0.000 . 2.850 2.608 2.425 2.745 . 0 0 "[ . 1 . 2]" 1
245 1 22 THR H 1 22 THR HG1 0.000 . 6.000 3.218 2.319 3.585 . 0 0 "[ . 1 . 2]" 1
246 1 22 THR HA 1 22 THR HG1 0.000 . 5.600 2.171 1.954 2.431 0.046 4 0 "[ . 1 . 2]" 1
247 1 22 THR HA 1 23 ILE H 0.000 . 2.850 2.195 2.016 2.375 . 0 0 "[ . 1 . 2]" 1
248 1 22 THR HA 1 23 ILE MG 0.000 . 6.500 4.198 3.636 4.991 . 0 0 "[ . 1 . 2]" 1
249 1 22 THR HA 1 101 ILE MG 0.000 . 6.500 5.061 3.545 5.457 . 0 0 "[ . 1 . 2]" 1
250 1 22 THR HA 1 102 THR H 0.000 . 2.850 2.574 2.269 2.839 . 0 0 "[ . 1 . 2]" 1
251 1 22 THR HA 1 102 THR HB 0.000 . 3.560 2.331 1.982 3.607 0.047 4 0 "[ . 1 . 2]" 1
252 1 22 THR HB 1 22 THR HG1 0.000 . 3.560 2.093 1.895 2.141 0.105 17 0 "[ . 1 . 2]" 1
253 1 22 THR HB 1 23 ILE H 0.000 . 5.000 4.455 4.239 4.577 . 0 0 "[ . 1 . 2]" 1
254 1 22 THR HG1 1 102 THR HA 0.000 . 6.000 4.244 3.912 4.508 . 0 0 "[ . 1 . 2]" 1
255 1 22 THR HG1 1 102 THR HB 0.000 . 6.000 2.087 1.648 2.728 0.352 12 0 "[ . 1 . 2]" 1
256 1 22 THR HG1 1 104 ALA HA 0.000 . 6.000 3.972 2.292 4.716 . 0 0 "[ . 1 . 2]" 1
257 1 22 THR HG1 1 104 ALA MB 0.000 . 6.060 2.713 2.058 3.883 . 0 0 "[ . 1 . 2]" 1
258 1 23 ILE H 1 23 ILE HA 0.000 . 2.850 2.920 2.881 2.945 0.095 17 0 "[ . 1 . 2]" 1
259 1 23 ILE H 1 23 ILE HB 0.000 . 5.000 3.679 3.409 3.784 . 0 0 "[ . 1 . 2]" 1
260 1 23 ILE H 1 23 ILE MD 0.000 . 6.530 3.674 2.089 4.091 . 0 0 "[ . 1 . 2]" 1
261 1 23 ILE H 1 23 ILE QG 0.000 . 6.500 2.189 1.716 3.610 0.284 20 0 "[ . 1 . 2]" 1
262 1 23 ILE H 1 23 ILE MG 0.000 . 5.060 2.635 1.966 3.434 0.034 2 0 "[ . 1 . 2]" 1
263 1 23 ILE H 1 102 THR H 0.000 . 3.560 3.132 2.702 3.565 0.005 20 0 "[ . 1 . 2]" 1
264 1 23 ILE H 1 103 VAL HA 0.000 . 3.560 3.368 2.841 3.607 0.047 9 0 "[ . 1 . 2]" 1
265 1 23 ILE HA 1 23 ILE MD 0.000 . 6.100 4.020 3.609 4.217 . 0 0 "[ . 1 . 2]" 1
266 1 23 ILE HA 1 23 ILE MG 0.000 . 4.660 2.346 2.153 2.571 . 0 0 "[ . 1 . 2]" 1
267 1 23 ILE HA 1 24 LYS H 0.000 . 2.850 2.609 2.347 3.074 0.224 20 0 "[ . 1 . 2]" 1
268 1 23 ILE HA 1 27 ASP QB 0.000 . 6.000 4.259 3.506 5.412 . 0 0 "[ . 1 . 2]" 1
269 1 23 ILE HB 1 23 ILE MD 0.000 . 4.810 2.196 2.066 3.233 . 0 0 "[ . 1 . 2]" 1
270 1 23 ILE HB 1 23 ILE QG 0.000 . 5.500 2.423 2.188 2.512 . 0 0 "[ . 1 . 2]" 1
271 1 23 ILE HB 1 23 ILE MG 0.000 . 4.060 2.096 2.046 2.176 . 0 0 "[ . 1 . 2]" 1
272 1 23 ILE HB 1 24 LYS H 0.000 . 2.850 1.955 1.580 2.651 0.420 20 0 "[ . 1 . 2]" 1
273 1 23 ILE HB 1 27 ASP H 0.000 . 5.000 4.216 3.321 5.043 0.043 16 0 "[ . 1 . 2]" 1
274 1 23 ILE HB 1 27 ASP QB 0.000 . 4.560 2.497 1.765 4.092 0.235 11 0 "[ . 1 . 2]" 1
275 1 23 ILE HB 1 101 ILE MG 0.000 . 6.500 5.174 4.274 5.493 . 0 0 "[ . 1 . 2]" 1
276 1 23 ILE HB 1 103 VAL QG 0.000 . 7.900 3.865 3.185 5.011 . 0 0 "[ . 1 . 2]" 1
277 1 23 ILE MD 1 23 ILE QG 0.000 . 5.310 1.941 1.919 1.983 0.081 2 0 "[ . 1 . 2]" 1
278 1 23 ILE MD 1 23 ILE MG 0.000 . 5.310 2.328 1.972 3.252 0.028 9 0 "[ . 1 . 2]" 1
279 1 23 ILE MD 1 27 ASP QB 0.000 . 7.500 2.808 1.831 4.920 0.169 1 0 "[ . 1 . 2]" 1
280 1 23 ILE MD 1 76 PHE H 0.000 . 6.500 4.819 3.445 5.435 . 0 0 "[ . 1 . 2]" 1
281 1 23 ILE MD 1 101 ILE MG 0.000 . 6.560 2.804 1.861 3.822 0.139 13 0 "[ . 1 . 2]" 1
282 1 23 ILE MD 1 103 VAL HA 0.000 . 6.500 3.173 1.864 4.870 0.136 9 0 "[ . 1 . 2]" 1
283 1 23 ILE MD 1 103 VAL HB 0.000 . 5.060 4.082 3.887 4.224 . 0 0 "[ . 1 . 2]" 1
284 1 23 ILE MD 1 103 VAL QG 0.000 . 7.960 1.905 1.731 4.114 0.269 2 0 "[ . 1 . 2]" 1
285 1 23 ILE QG 1 23 ILE MG 0.000 . 7.500 2.178 2.061 2.351 . 0 0 "[ . 1 . 2]" 1
286 1 23 ILE QG 1 24 LYS H 0.000 . 6.500 3.318 2.197 4.037 . 0 0 "[ . 1 . 2]" 1
287 1 23 ILE QG 1 29 VAL QG 0.000 . 7.960 3.918 2.657 5.145 . 0 0 "[ . 1 . 2]" 1
288 1 23 ILE QG 1 101 ILE MG 0.000 . 8.000 2.867 1.932 3.832 0.068 13 0 "[ . 1 . 2]" 1
289 1 23 ILE QG 1 103 VAL QG 0.000 . 9.400 2.371 1.770 3.950 0.230 18 0 "[ . 1 . 2]" 1
290 1 23 ILE QG 1 104 ALA H 0.000 . 6.500 3.857 2.769 5.454 . 0 0 "[ . 1 . 2]" 1
291 1 23 ILE MG 1 24 LYS H 0.000 . 5.060 3.370 3.038 3.972 . 0 0 "[ . 1 . 2]" 1
292 1 23 ILE MG 1 24 LYS HA 0.000 . 6.500 5.305 4.529 5.476 . 0 0 "[ . 1 . 2]" 1
293 1 23 ILE MG 1 27 ASP QB 0.000 . 7.500 3.096 1.982 4.595 0.018 4 0 "[ . 1 . 2]" 1
294 1 23 ILE MG 1 76 PHE QD 0.000 . 8.500 4.735 3.133 6.192 . 0 0 "[ . 1 . 2]" 1
295 1 23 ILE MG 1 76 PHE QE 0.000 . 8.500 4.363 3.081 5.897 . 0 0 "[ . 1 . 2]" 1
296 1 23 ILE MG 1 101 ILE MG 0.000 . 8.000 3.926 2.826 5.481 . 0 0 "[ . 1 . 2]" 1
297 1 23 ILE MG 1 103 VAL QG 0.000 . 9.400 4.034 3.565 5.404 . 0 0 "[ . 1 . 2]" 1
298 1 24 LYS H 1 24 LYS QB 0.000 . 3.450 2.501 2.214 2.855 . 0 0 "[ . 1 . 2]" 1
299 1 24 LYS H 1 24 LYS QD 0.000 . 3.560 2.709 1.915 3.381 0.085 10 0 "[ . 1 . 2]" 1
300 1 24 LYS H 1 24 LYS QG 0.000 . 4.560 2.836 1.720 3.866 0.280 2 0 "[ . 1 . 2]" 1
301 1 24 LYS H 1 27 ASP H 0.000 . 5.000 4.294 3.802 5.028 0.028 13 0 "[ . 1 . 2]" 1
302 1 24 LYS H 1 27 ASP QB 0.000 . 4.560 2.695 1.757 3.931 0.243 19 0 "[ . 1 . 2]" 1
303 1 24 LYS HA 1 25 PRO QD 0.000 . 6.000 2.275 2.035 2.570 . 0 0 "[ . 1 . 2]" 1
304 1 24 LYS HA 1 103 VAL QG 0.000 . 7.900 3.571 2.506 5.114 . 0 0 "[ . 1 . 2]" 1
305 1 24 LYS HA 1 104 ALA H 0.000 . 5.001 3.294 1.993 5.020 0.019 9 0 "[ . 1 . 2]" 1
306 1 24 LYS HA 1 104 ALA MB 0.000 . 6.500 3.433 2.111 5.187 . 0 0 "[ . 1 . 2]" 1
307 1 25 PRO HA 1 25 PRO QB 0.000 . 3.560 2.195 2.164 2.231 . 0 0 "[ . 1 . 2]" 1
308 1 25 PRO HA 1 26 GLY H 0.000 . 2.850 2.509 2.295 2.705 . 0 0 "[ . 1 . 2]" 1
309 1 25 PRO HA 1 103 VAL QG 0.000 . 7.900 2.205 1.838 3.309 0.162 9 0 "[ . 1 . 2]" 1
310 1 25 PRO QB 1 25 PRO QD 0.000 . 4.320 2.629 2.493 2.900 . 0 0 "[ . 1 . 2]" 1
311 1 25 PRO QB 1 26 GLY H 0.000 . 6.000 4.019 3.898 4.094 . 0 0 "[ . 1 . 2]" 1
312 1 25 PRO QD 1 25 PRO QG 0.000 . 5.000 2.040 1.998 2.061 0.002 13 0 "[ . 1 . 2]" 1
313 1 25 PRO QD 1 103 VAL QG 0.000 . 8.900 3.038 1.933 4.745 0.067 14 0 "[ . 1 . 2]" 1
314 1 25 PRO QG 1 103 VAL QG 0.000 . 8.900 4.132 3.374 5.432 . 0 0 "[ . 1 . 2]" 1
315 1 26 GLY H 1 26 GLY QA 0.000 . 2.850 2.425 2.321 2.552 . 0 0 "[ . 1 . 2]" 1
316 1 26 GLY H 1 27 ASP H 0.000 . 5.000 2.599 2.045 3.700 . 0 0 "[ . 1 . 2]" 1
317 1 26 GLY H 1 76 PHE QB 0.000 . 6.000 3.491 2.625 4.605 . 0 0 "[ . 1 . 2]" 1
318 1 26 GLY H 1 101 ILE MD 0.000 . 6.500 5.376 5.304 5.456 . 0 0 "[ . 1 . 2]" 1
319 1 26 GLY H 1 103 VAL QG 0.000 . 7.900 2.679 1.715 3.356 0.285 6 0 "[ . 1 . 2]" 1
320 1 26 GLY QA 1 27 ASP H 0.000 . 4.560 2.551 2.284 2.784 . 0 0 "[ . 1 . 2]" 1
321 1 27 ASP H 1 27 ASP QB 0.000 . 4.160 2.363 1.964 3.144 0.036 6 0 "[ . 1 . 2]" 1
322 1 27 ASP H 1 28 THR H 0.000 . 5.000 4.432 4.101 4.706 . 0 0 "[ . 1 . 2]" 1
323 1 27 ASP H 1 76 PHE QB 0.000 . 6.000 3.552 2.159 4.710 . 0 0 "[ . 1 . 2]" 1
324 1 27 ASP HA 1 27 ASP QB 0.000 . 5.000 2.460 2.218 2.584 . 0 0 "[ . 1 . 2]" 1
325 1 27 ASP HA 1 28 THR H 0.000 . 3.560 2.416 1.980 2.819 0.020 9 0 "[ . 1 . 2]" 1
326 1 27 ASP QB 1 28 THR H 0.000 . 4.560 3.074 2.003 3.961 . 0 0 "[ . 1 . 2]" 1
327 1 28 THR H 1 28 THR HA 0.000 . 2.850 2.915 2.767 2.961 0.111 20 0 "[ . 1 . 2]" 1
328 1 28 THR H 1 28 THR HB 0.000 . 5.000 2.779 2.413 3.770 . 0 0 "[ . 1 . 2]" 1
329 1 28 THR H 1 28 THR HG1 0.000 . 6.000 2.836 1.890 3.427 0.110 14 0 "[ . 1 . 2]" 1
330 1 28 THR HA 1 28 THR HG1 0.000 . 5.600 2.054 1.845 2.300 0.155 19 0 "[ . 1 . 2]" 1
331 1 28 THR HA 1 29 VAL H 0.000 . 2.850 2.362 1.949 2.859 0.051 17 0 "[ . 1 . 2]" 1
332 1 28 THR HA 1 29 VAL QG 0.000 . 7.900 3.765 3.303 4.411 . 0 0 "[ . 1 . 2]" 1
333 1 28 THR HA 1 75 THR H 0.000 . 5.000 4.250 3.386 4.872 . 0 0 "[ . 1 . 2]" 1
334 1 28 THR HA 1 75 THR HA 0.000 . 2.850 2.193 1.882 2.842 0.118 10 0 "[ . 1 . 2]" 1
335 1 28 THR HA 1 75 THR HG1 0.000 . 6.000 3.050 1.877 4.237 0.123 3 0 "[ . 1 . 2]" 1
336 1 28 THR HA 1 76 PHE QD 0.000 . 7.000 4.387 2.986 6.350 . 0 0 "[ . 1 . 2]" 1
337 1 28 THR HB 1 28 THR HG1 0.000 . 3.560 2.088 1.837 2.166 0.163 12 0 "[ . 1 . 2]" 1
338 1 28 THR HG1 1 29 VAL H 0.000 . 4.560 3.113 2.090 3.794 . 0 0 "[ . 1 . 2]" 1
339 1 28 THR HG1 1 73 SER HA 0.000 . 6.000 4.090 3.095 4.680 . 0 0 "[ . 1 . 2]" 1
340 1 28 THR HG1 1 73 SER QB 0.000 . 7.000 2.921 1.983 4.224 0.017 10 0 "[ . 1 . 2]" 1
341 1 28 THR HG1 1 74 THR H 0.000 . 6.000 3.828 2.763 4.609 . 0 0 "[ . 1 . 2]" 1
342 1 28 THR HG1 1 75 THR H 0.000 . 6.000 3.607 2.709 4.348 . 0 0 "[ . 1 . 2]" 1
343 1 29 VAL H 1 29 VAL HA 0.000 . 2.850 2.901 2.786 2.970 0.120 3 0 "[ . 1 . 2]" 1
344 1 29 VAL H 1 29 VAL HB 0.000 . 3.560 2.719 2.383 3.617 0.057 19 0 "[ . 1 . 2]" 1
345 1 29 VAL H 1 29 VAL QG 0.000 . 7.200 2.268 1.765 2.839 0.235 19 0 "[ . 1 . 2]" 1
346 1 29 VAL HA 1 29 VAL QG 0.000 . 4.660 2.149 1.989 2.489 0.011 1 0 "[ . 1 . 2]" 1
347 1 29 VAL HA 1 30 GLU H 0.000 . 5.000 2.267 1.992 2.629 0.008 9 0 "[ . 1 . 2]" 1
348 1 29 VAL HB 1 29 VAL QG 0.000 . 3.350 1.940 1.921 1.958 0.079 20 0 "[ . 1 . 2]" 1
349 1 29 VAL HB 1 31 PHE QD 0.000 . 7.000 4.983 3.953 6.143 . 0 0 "[ . 1 . 2]" 1
350 1 29 VAL HB 1 74 THR H 0.000 . 5.000 4.461 2.172 5.073 0.073 20 0 "[ . 1 . 2]" 1
351 1 29 VAL QG 1 31 PHE HA 0.000 . 7.900 4.411 3.815 5.790 . 0 0 "[ . 1 . 2]" 1
352 1 29 VAL QG 1 31 PHE QD 0.000 . 9.900 3.235 2.324 4.341 . 0 0 "[ . 1 . 2]" 1
353 1 29 VAL QG 1 31 PHE QE 0.000 . 9.900 2.504 1.856 3.849 0.144 13 0 "[ . 1 . 2]" 1
354 1 29 VAL QG 1 75 THR HA 0.000 . 7.900 4.166 2.156 5.507 . 0 0 "[ . 1 . 2]" 1
355 1 30 GLU H 1 30 GLU HA 0.000 . 2.850 2.933 2.915 2.948 0.098 11 0 "[ . 1 . 2]" 1
356 1 30 GLU H 1 30 GLU QB 0.000 . 3.450 2.409 2.217 2.822 . 0 0 "[ . 1 . 2]" 1
357 1 30 GLU H 1 30 GLU QG 0.000 . 6.000 3.456 2.120 4.189 . 0 0 "[ . 1 . 2]" 1
358 1 30 GLU HA 1 30 GLU QB 0.000 . 5.000 2.315 2.138 2.546 . 0 0 "[ . 1 . 2]" 1
359 1 30 GLU HA 1 30 GLU QG 0.000 . 5.600 2.690 2.353 3.495 . 0 0 "[ . 1 . 2]" 1
360 1 30 GLU HA 1 31 PHE H 0.000 . 2.850 2.153 1.957 2.369 0.043 10 0 "[ . 1 . 2]" 1
361 1 30 GLU HA 1 73 SER HA 0.000 . 2.850 2.282 1.945 2.765 0.055 1 0 "[ . 1 . 2]" 1
362 1 30 GLU HA 1 74 THR H 0.000 . 5.000 3.205 2.233 4.062 . 0 0 "[ . 1 . 2]" 1
363 1 30 GLU QB 1 31 PHE H 0.000 . 6.000 3.380 2.452 3.837 . 0 0 "[ . 1 . 2]" 1
364 1 30 GLU QB 1 73 SER HA 0.000 . 6.000 3.500 2.042 4.666 . 0 0 "[ . 1 . 2]" 1
365 1 30 GLU QG 1 31 PHE H 0.000 . 6.000 3.231 2.352 4.807 . 0 0 "[ . 1 . 2]" 1
366 1 30 GLU QG 1 73 SER HA 0.000 . 6.000 3.634 1.861 4.918 0.139 18 0 "[ . 1 . 2]" 1
367 1 31 PHE H 1 31 PHE QB 0.000 . 5.600 2.535 2.320 2.827 . 0 0 "[ . 1 . 2]" 1
368 1 31 PHE H 1 31 PHE QD 0.000 . 5.560 2.942 2.263 3.566 . 0 0 "[ . 1 . 2]" 1
369 1 31 PHE H 1 32 LEU H 0.000 . 5.000 4.111 3.546 4.420 . 0 0 "[ . 1 . 2]" 1
370 1 31 PHE H 1 72 THR H 0.000 . 5.000 3.067 2.335 4.089 . 0 0 "[ . 1 . 2]" 1
371 1 31 PHE H 1 72 THR HG1 0.000 . 6.000 3.082 2.316 4.589 . 0 0 "[ . 1 . 2]" 1
372 1 31 PHE H 1 73 SER HA 0.000 . 5.000 3.411 2.386 4.542 . 0 0 "[ . 1 . 2]" 1
373 1 31 PHE HA 1 31 PHE QB 0.000 . 5.000 2.393 2.259 2.483 . 0 0 "[ . 1 . 2]" 1
374 1 31 PHE HA 1 31 PHE QD 0.000 . 4.560 2.627 2.068 3.085 . 0 0 "[ . 1 . 2]" 1
375 1 31 PHE HA 1 32 LEU H 0.000 . 2.850 2.286 2.154 2.676 . 0 0 "[ . 1 . 2]" 1
376 1 31 PHE QB 1 31 PHE QD 0.000 . 3.560 2.183 2.143 2.288 . 0 0 "[ . 1 . 2]" 1
377 1 31 PHE QB 1 32 LEU H 0.000 . 6.000 3.691 3.416 3.970 . 0 0 "[ . 1 . 2]" 1
378 1 31 PHE QB 1 41 VAL QG 0.000 . 8.900 3.388 2.908 3.898 . 0 0 "[ . 1 . 2]" 1
379 1 31 PHE QD 1 32 LEU H 0.000 . 7.000 4.500 3.927 4.925 . 0 0 "[ . 1 . 2]" 1
380 1 31 PHE QD 1 72 THR HG1 0.000 . 8.000 2.823 1.958 5.058 0.042 17 0 "[ . 1 . 2]" 1
381 1 31 PHE QD 1 73 SER HA 0.000 . 7.000 4.457 2.684 5.969 . 0 0 "[ . 1 . 2]" 1
382 1 31 PHE QD 1 74 THR H 0.000 . 7.000 4.213 2.937 5.848 . 0 0 "[ . 1 . 2]" 1
383 1 31 PHE QE 1 41 VAL QG 0.000 . 9.900 3.264 2.358 4.714 . 0 0 "[ . 1 . 2]" 1
384 1 31 PHE QE 1 43 PHE HZ 0.000 . 7.000 4.199 2.687 6.178 . 0 0 "[ . 1 . 2]" 1
385 1 31 PHE QE 1 74 THR HB 0.000 . 7.000 2.940 2.013 4.773 . 0 0 "[ . 1 . 2]" 1
386 1 31 PHE QE 1 76 PHE QD 0.000 . 9.000 6.296 5.335 7.364 . 0 0 "[ . 1 . 2]" 1
387 1 31 PHE QE 1 87 PHE QE 0.000 . 9.000 3.236 2.276 4.731 . 0 0 "[ . 1 . 2]" 1
388 1 31 PHE QE 1 101 ILE MD 0.000 . 8.500 4.378 3.119 5.631 . 0 0 "[ . 1 . 2]" 1
389 1 31 PHE HZ 1 74 THR HB 0.000 . 5.000 4.374 2.608 5.011 0.011 15 0 "[ . 1 . 2]" 1
390 1 31 PHE HZ 1 87 PHE QE 0.000 . 7.000 3.851 2.894 4.907 . 0 0 "[ . 1 . 2]" 1
391 1 32 LEU H 1 32 LEU HA 0.000 . 2.850 2.919 2.786 2.945 0.095 3 0 "[ . 1 . 2]" 1
392 1 32 LEU H 1 32 LEU QB 0.000 . 4.160 2.287 2.121 2.645 . 0 0 "[ . 1 . 2]" 1
393 1 32 LEU H 1 32 LEU QD 0.000 . 7.810 3.653 2.114 3.837 . 0 0 "[ . 1 . 2]" 1
394 1 32 LEU HA 1 32 LEU QD 0.000 . 5.050 2.759 1.912 3.301 0.088 9 0 "[ . 1 . 2]" 1
395 1 32 LEU HA 1 33 ASN H 0.000 . 2.850 2.096 1.973 2.278 0.027 9 0 "[ . 1 . 2]" 1
396 1 32 LEU HA 1 71 SER HA 0.000 . 3.560 2.336 1.912 3.520 0.088 15 0 "[ . 1 . 2]" 1
397 1 32 LEU QB 1 32 LEU QD 0.000 . 6.910 1.921 1.839 2.101 0.161 15 0 "[ . 1 . 2]" 1
398 1 32 LEU QB 1 33 ASN H 0.000 . 5.600 3.732 3.026 4.016 . 0 0 "[ . 1 . 2]" 1
399 1 32 LEU QB 1 71 SER HA 0.000 . 6.000 3.711 2.526 5.325 . 0 0 "[ . 1 . 2]" 1
400 1 32 LEU QD 1 32 LEU HG 0.000 . 5.500 1.936 1.921 1.965 0.079 6 0 "[ . 1 . 2]" 1
401 1 32 LEU QD 1 33 ASN H 0.000 . 7.900 2.778 2.144 3.510 . 0 0 "[ . 1 . 2]" 1
402 1 32 LEU QD 1 69 GLY H 0.000 . 7.900 3.805 2.499 4.791 . 0 0 "[ . 1 . 2]" 1
403 1 32 LEU QD 1 69 GLY QA 0.000 . 8.900 2.624 1.827 3.487 0.173 8 0 "[ . 1 . 2]" 1
404 1 32 LEU QD 1 71 SER HA 0.000 . 7.900 3.739 2.097 4.506 . 0 0 "[ . 1 . 2]" 1
405 1 32 LEU QD 1 71 SER QB 0.000 . 8.900 2.645 1.955 3.574 0.045 16 0 "[ . 1 . 2]" 1
406 1 33 ASN H 1 33 ASN QB 0.000 . 4.160 2.364 2.093 2.836 . 0 0 "[ . 1 . 2]" 1
407 1 33 ASN H 1 69 GLY H 0.000 . 5.000 4.334 3.472 4.937 . 0 0 "[ . 1 . 2]" 1
408 1 33 ASN H 1 70 GLN H 0.000 . 5.000 4.159 2.997 4.870 . 0 0 "[ . 1 . 2]" 1
409 1 33 ASN H 1 71 SER HA 0.000 . 5.000 3.476 2.907 4.336 . 0 0 "[ . 1 . 2]" 1
410 1 33 ASN H 1 71 SER QB 0.000 . 6.000 4.415 3.369 5.355 . 0 0 "[ . 1 . 2]" 1
411 1 33 ASN HA 1 33 ASN QB 0.000 . 5.000 2.360 2.190 2.524 . 0 0 "[ . 1 . 2]" 1
412 1 33 ASN HA 1 34 ASN H 0.000 . 3.560 2.334 2.039 2.795 . 0 0 "[ . 1 . 2]" 1
413 1 33 ASN HA 1 39 HIS HD2 0.000 . 3.560 3.219 2.141 3.598 0.038 8 0 "[ . 1 . 2]" 1
414 1 33 ASN QB 1 33 ASN QD 0.000 . 5.760 2.229 2.054 2.826 . 0 0 "[ . 1 . 2]" 1
415 1 33 ASN QB 1 68 PRO HA 0.000 . 6.000 3.747 2.094 5.113 . 0 0 "[ . 1 . 2]" 1
416 1 33 ASN QB 1 69 GLY H 0.000 . 4.560 3.420 1.744 4.181 0.256 18 0 "[ . 1 . 2]" 1
417 1 33 ASN QB 1 70 GLN H 0.000 . 6.000 3.747 2.096 5.412 . 0 0 "[ . 1 . 2]" 1
418 1 33 ASN QD 1 37 PRO QB 0.000 . 7.000 3.773 1.851 5.563 0.149 5 0 "[ . 1 . 2]" 1
419 1 33 ASN QD 1 65 LEU QB 0.000 . 6.650 3.274 1.899 5.168 0.101 20 0 "[ . 1 . 2]" 1
420 1 33 ASN QD 1 67 SER H 0.000 . 6.000 3.593 2.854 4.556 . 0 0 "[ . 1 . 2]" 1
421 1 34 ASN H 1 34 ASN QB 0.000 . 5.600 2.390 2.140 2.676 . 0 0 "[ . 1 . 2]" 1
422 1 34 ASN H 1 35 LYS H 0.000 . 5.000 3.514 2.357 4.399 . 0 0 "[ . 1 . 2]" 1
423 1 34 ASN HA 1 34 ASN QB 0.000 . 3.560 2.358 2.183 2.510 . 0 0 "[ . 1 . 2]" 1
424 1 34 ASN HA 1 35 LYS H 0.000 . 5.000 3.357 2.332 3.627 . 0 0 "[ . 1 . 2]" 1
425 1 34 ASN HA 1 69 GLY H 0.000 . 5.000 4.071 2.978 5.076 0.076 18 0 "[ . 1 . 2]" 1
426 1 34 ASN QB 1 34 ASN QD 0.000 . 5.760 2.214 2.089 2.868 . 0 0 "[ . 1 . 2]" 1
427 1 34 ASN QB 1 35 LYS H 0.000 . 4.560 2.516 1.924 4.020 0.076 5 0 "[ . 1 . 2]" 1
428 1 34 ASN QD 1 35 LYS H 0.000 . 6.000 3.512 2.282 5.357 . 0 0 "[ . 1 . 2]" 1
429 1 35 LYS H 1 39 HIS HE2 0.000 . 5.000 4.069 3.205 5.051 0.051 15 0 "[ . 1 . 2]" 1
430 1 35 LYS HA 1 35 LYS QB 0.000 . 3.560 2.405 2.154 2.569 . 0 0 "[ . 1 . 2]" 1
431 1 35 LYS HA 1 35 LYS QG 0.000 . 5.600 2.712 2.176 3.603 . 0 0 "[ . 1 . 2]" 1
432 1 35 LYS HA 1 36 VAL H 0.000 . 5.001 2.687 2.146 3.049 . 0 0 "[ . 1 . 2]" 1
433 1 35 LYS QB 1 36 VAL H 0.000 . 6.000 2.715 1.855 3.940 0.145 2 0 "[ . 1 . 2]" 1
434 1 36 VAL H 1 36 VAL HB 0.000 . 5.000 3.318 2.666 3.881 . 0 0 "[ . 1 . 2]" 1
435 1 36 VAL H 1 36 VAL QG 0.000 . 7.200 2.280 1.910 2.978 0.090 3 0 "[ . 1 . 2]" 1
436 1 36 VAL H 1 37 PRO QD 0.000 . 4.560 3.164 2.255 4.124 . 0 0 "[ . 1 . 2]" 1
437 1 36 VAL HA 1 36 VAL QG 0.000 . 6.100 2.154 2.105 2.285 . 0 0 "[ . 1 . 2]" 1
438 1 36 VAL HA 1 37 PRO QD 0.000 . 6.000 2.108 1.951 2.273 0.049 8 0 "[ . 1 . 2]" 1
439 1 36 VAL HA 1 39 HIS HE2 0.000 . 5.000 4.681 3.969 5.022 0.022 12 0 "[ . 1 . 2]" 1
440 1 36 VAL HB 1 36 VAL QG 0.000 . 5.500 1.942 1.931 1.963 0.069 19 0 "[ . 1 . 2]" 1
441 1 36 VAL HB 1 39 HIS HE1 0.000 . 5.000 3.789 2.708 5.003 0.003 15 0 "[ . 1 . 2]" 1
442 1 36 VAL HB 1 39 HIS HE2 0.000 . 5.000 3.753 1.963 4.725 0.037 19 0 "[ . 1 . 2]" 1
443 1 36 VAL QG 1 39 HIS HE1 0.000 . 7.900 3.600 2.388 4.136 . 0 0 "[ . 1 . 2]" 1
444 1 36 VAL QG 1 39 HIS HE2 0.000 . 7.900 3.658 2.185 4.536 . 0 0 "[ . 1 . 2]" 1
445 1 37 PRO HA 1 37 PRO QB 0.000 . 5.000 2.227 2.200 2.288 . 0 0 "[ . 1 . 2]" 1
446 1 37 PRO QB 1 37 PRO QD 0.000 . 5.760 2.733 2.546 3.031 . 0 0 "[ . 1 . 2]" 1
447 1 37 PRO QB 1 39 HIS H 0.000 . 6.000 3.548 2.220 4.451 . 0 0 "[ . 1 . 2]" 1
448 1 37 PRO QB 1 39 HIS HE2 0.000 . 6.000 4.303 2.909 5.201 . 0 0 "[ . 1 . 2]" 1
449 1 37 PRO QB 1 66 MET HA 0.000 . 6.000 2.682 1.918 4.020 0.082 6 0 "[ . 1 . 2]" 1
450 1 37 PRO QD 1 37 PRO QG 0.000 . 5.000 2.026 1.999 2.051 0.001 18 0 "[ . 1 . 2]" 1
451 1 38 PRO HA 1 38 PRO QB 0.000 . 3.560 2.189 2.047 2.229 . 0 0 "[ . 1 . 2]" 1
452 1 38 PRO HA 1 39 HIS H 0.000 . 3.560 2.187 2.046 2.360 . 0 0 "[ . 1 . 2]" 1
453 1 38 PRO QB 1 38 PRO QD 0.000 . 5.760 2.920 2.799 3.117 . 0 0 "[ . 1 . 2]" 1
454 1 38 PRO QB 1 39 HIS H 0.000 . 3.850 3.262 2.629 3.617 . 0 0 "[ . 1 . 2]" 1
455 1 38 PRO QB 1 64 LEU QD 0.000 . 8.900 3.638 1.977 5.929 0.023 8 0 "[ . 1 . 2]" 1
456 1 38 PRO QB 1 66 MET HA 0.000 . 6.000 2.917 1.940 4.358 0.060 15 0 "[ . 1 . 2]" 1
457 1 39 HIS H 1 39 HIS QB 0.000 . 5.600 2.573 2.419 2.774 . 0 0 "[ . 1 . 2]" 1
458 1 39 HIS H 1 65 LEU H 0.000 . 5.000 3.738 3.052 4.980 . 0 0 "[ . 1 . 2]" 1
459 1 39 HIS HA 1 39 HIS QB 0.000 . 5.000 2.352 2.235 2.439 . 0 0 "[ . 1 . 2]" 1
460 1 39 HIS HA 1 40 ASN H 0.000 . 3.560 2.294 2.018 2.608 . 0 0 "[ . 1 . 2]" 1
461 1 39 HIS HA 1 65 LEU H 0.000 . 5.000 4.909 4.412 5.114 0.114 15 0 "[ . 1 . 2]" 1
462 1 39 HIS QB 1 40 ASN H 0.000 . 4.560 3.749 3.197 3.974 . 0 0 "[ . 1 . 2]" 1
463 1 39 HIS QB 1 65 LEU QD 0.000 . 8.900 3.097 1.948 4.262 0.052 16 0 "[ . 1 . 2]" 1
464 1 39 HIS HE2 1 97 MET ME 0.000 . 6.000 4.004 3.011 4.874 . 0 0 "[ . 1 . 2]" 1
465 1 39 HIS ND1 2 1 CU CU 0.000 . 2.360 1.770 1.751 1.808 0.209 1 0 "[ . 1 . 2]" 1
466 1 40 ASN H 1 40 ASN QB 0.000 . 5.600 2.346 1.843 2.886 0.157 16 0 "[ . 1 . 2]" 1
467 1 40 ASN H 1 42 VAL QG 0.000 . 7.900 5.322 4.789 5.829 . 0 0 "[ . 1 . 2]" 1
468 1 40 ASN H 1 65 LEU QD 0.000 . 7.900 4.570 3.810 5.735 . 0 0 "[ . 1 . 2]" 1
469 1 40 ASN H 1 89 CYS HA 0.000 . 5.000 3.966 3.384 4.875 . 0 0 "[ . 1 . 2]" 1
470 1 40 ASN H 1 89 CYS QB 0.000 . 6.000 4.308 2.396 5.348 . 0 0 "[ . 1 . 2]" 1
471 1 40 ASN H 1 91 PRO QB 0.000 . 6.000 4.848 3.427 5.433 . 0 0 "[ . 1 . 2]" 1
472 1 40 ASN HA 1 40 ASN QB 0.000 . 5.000 2.406 2.273 2.590 . 0 0 "[ . 1 . 2]" 1
473 1 40 ASN HA 1 41 VAL H 0.000 . 5.000 2.352 2.173 2.654 . 0 0 "[ . 1 . 2]" 1
474 1 40 ASN HA 1 41 VAL QG 0.000 . 7.900 3.515 3.222 3.890 . 0 0 "[ . 1 . 2]" 1
475 1 40 ASN HA 1 65 LEU QD 0.000 . 7.900 3.180 2.118 4.493 . 0 0 "[ . 1 . 2]" 1
476 1 40 ASN QB 1 40 ASN QD 0.000 . 5.760 2.310 2.085 2.866 . 0 0 "[ . 1 . 2]" 1
477 1 40 ASN QB 1 41 VAL H 0.000 . 4.560 3.822 2.999 4.150 . 0 0 "[ . 1 . 2]" 1
478 1 40 ASN QD 1 62 LYS HA 0.000 . 4.560 3.252 1.775 4.123 0.225 19 0 "[ . 1 . 2]" 1
479 1 41 VAL H 1 41 VAL HB 0.000 . 5.000 3.768 3.623 3.865 . 0 0 "[ . 1 . 2]" 1
480 1 41 VAL H 1 41 VAL QG 0.000 . 5.760 2.013 1.899 2.265 0.101 13 0 "[ . 1 . 2]" 1
481 1 41 VAL H 1 42 VAL QG 0.000 . 7.900 4.332 3.997 4.781 . 0 0 "[ . 1 . 2]" 1
482 1 41 VAL HA 1 41 VAL QG 0.000 . 4.660 2.317 2.215 2.508 . 0 0 "[ . 1 . 2]" 1
483 1 41 VAL HA 1 42 VAL H 0.000 . 3.560 1.976 1.881 2.148 0.119 18 0 "[ . 1 . 2]" 1
484 1 41 VAL HA 1 88 TYR QD 0.000 . 7.000 4.752 3.970 5.384 . 0 0 "[ . 1 . 2]" 1
485 1 41 VAL HA 1 88 TYR QE 0.000 . 7.000 5.864 5.238 6.580 . 0 0 "[ . 1 . 2]" 1
486 1 41 VAL HB 1 41 VAL QG 0.000 . 4.060 1.957 1.922 1.989 0.078 6 0 "[ . 1 . 2]" 1
487 1 41 VAL HB 1 61 HIS H 0.000 . 5.000 4.917 4.202 5.132 0.132 12 0 "[ . 1 . 2]" 1
488 1 41 VAL HB 1 88 TYR QE 0.000 . 7.000 6.519 6.187 6.614 . 0 0 "[ . 1 . 2]" 1
489 1 41 VAL QG 1 42 VAL H 0.000 . 7.900 3.470 3.239 3.650 . 0 0 "[ . 1 . 2]" 1
490 1 41 VAL QG 1 61 HIS H 0.000 . 7.900 3.000 1.929 3.602 0.071 1 0 "[ . 1 . 2]" 1
491 1 41 VAL QG 1 61 HIS QB 0.000 . 8.900 3.114 2.317 5.309 . 0 0 "[ . 1 . 2]" 1
492 1 41 VAL QG 1 61 HIS HD2 0.000 . 7.900 3.840 2.246 5.435 . 0 0 "[ . 1 . 2]" 1
493 1 41 VAL QG 1 65 LEU QD 0.000 . 10.800 3.537 2.557 4.769 . 0 0 "[ . 1 . 2]" 1
494 1 41 VAL QG 1 72 THR HG1 0.000 . 8.900 3.843 2.260 4.788 . 0 0 "[ . 1 . 2]" 1
495 1 41 VAL QG 1 87 PHE QB 0.000 . 8.900 2.730 1.906 3.883 0.094 7 0 "[ . 1 . 2]" 1
496 1 41 VAL QG 1 87 PHE QD 0.000 . 9.900 3.225 2.489 3.979 . 0 0 "[ . 1 . 2]" 1
497 1 41 VAL QG 1 87 PHE QE 0.000 . 9.900 4.488 1.893 5.446 0.107 15 0 "[ . 1 . 2]" 1
498 1 41 VAL QG 1 88 TYR H 0.000 . 7.900 4.110 3.138 4.653 . 0 0 "[ . 1 . 2]" 1
499 1 42 VAL H 1 42 VAL HB 0.000 . 5.000 2.903 2.378 3.724 . 0 0 "[ . 1 . 2]" 1
500 1 42 VAL H 1 42 VAL QG 0.000 . 7.200 2.150 1.761 2.571 0.239 18 0 "[ . 1 . 2]" 1
501 1 42 VAL H 1 88 TYR H 0.000 . 3.560 3.238 2.903 3.580 0.020 14 0 "[ . 1 . 2]" 1
502 1 42 VAL HA 1 42 VAL QG 0.000 . 3.950 2.167 2.041 2.349 . 0 0 "[ . 1 . 2]" 1
503 1 42 VAL HA 1 43 PHE H 0.000 . 2.850 2.350 2.060 2.729 . 0 0 "[ . 1 . 2]" 1
504 1 42 VAL HA 1 43 PHE QD 0.000 . 7.000 3.954 3.001 5.223 . 0 0 "[ . 1 . 2]" 1
505 1 42 VAL HA 1 61 HIS H 0.000 . 5.000 3.244 2.191 5.017 0.017 13 0 "[ . 1 . 2]" 1
506 1 42 VAL HB 1 42 VAL QG 0.000 . 3.350 1.935 1.876 1.959 0.124 9 0 "[ . 1 . 2]" 1
507 1 42 VAL HB 1 43 PHE H 0.000 . 5.000 3.613 2.429 4.497 . 0 0 "[ . 1 . 2]" 1
508 1 42 VAL QG 1 43 PHE H 0.000 . 7.900 2.845 2.234 3.613 . 0 0 "[ . 1 . 2]" 1
509 1 42 VAL QG 1 61 HIS H 0.000 . 7.900 4.026 2.748 5.482 . 0 0 "[ . 1 . 2]" 1
510 1 42 VAL QG 1 62 LYS HA 0.000 . 7.900 3.846 2.319 5.534 . 0 0 "[ . 1 . 2]" 1
511 1 42 VAL QG 1 90 GLU H 0.000 . 7.900 3.222 1.994 4.191 0.006 2 0 "[ . 1 . 2]" 1
512 1 42 VAL QG 1 90 GLU QB 0.000 . 8.900 2.859 1.798 3.827 0.202 2 0 "[ . 1 . 2]" 1
513 1 43 PHE H 1 43 PHE QB 0.000 . 5.600 2.269 2.072 2.446 . 0 0 "[ . 1 . 2]" 1
514 1 43 PHE H 1 43 PHE QD 0.000 . 7.000 3.103 2.541 3.933 . 0 0 "[ . 1 . 2]" 1
515 1 43 PHE H 1 43 PHE QE 0.000 . 6.000 5.271 4.862 5.774 . 0 0 "[ . 1 . 2]" 1
516 1 43 PHE H 1 60 SER HA 0.000 . 5.000 3.360 1.721 5.080 0.279 20 0 "[ . 1 . 2]" 1
517 1 43 PHE H 1 60 SER QB 0.000 . 6.000 1.943 1.599 2.775 0.401 6 0 "[ . 1 . 2]" 1
518 1 43 PHE H 1 60 SER HG 0.000 . 4.560 3.301 1.571 4.548 0.429 16 0 "[ . 1 . 2]" 1
519 1 43 PHE HA 1 43 PHE QB 0.000 . 5.000 2.501 2.371 2.596 . 0 0 "[ . 1 . 2]" 1
520 1 43 PHE HA 1 43 PHE QD 0.000 . 3.850 2.639 1.959 2.965 0.041 5 0 "[ . 1 . 2]" 1
521 1 43 PHE HA 1 44 ASP H 0.000 . 2.850 2.227 2.021 2.489 . 0 0 "[ . 1 . 2]" 1
522 1 43 PHE HA 1 60 SER H 0.000 . 5.000 5.129 4.984 5.291 0.291 7 0 "[ . 1 . 2]" 1
523 1 43 PHE HA 1 87 PHE HA 0.000 . 3.560 2.442 1.993 3.334 0.007 17 0 "[ . 1 . 2]" 1
524 1 43 PHE HA 1 87 PHE QB 0.000 . 6.000 3.463 2.520 4.876 . 0 0 "[ . 1 . 2]" 1
525 1 43 PHE HA 1 87 PHE QD 0.000 . 7.000 4.323 2.830 5.116 . 0 0 "[ . 1 . 2]" 1
526 1 43 PHE QB 1 43 PHE QD 0.000 . 3.560 2.171 2.114 2.264 . 0 0 "[ . 1 . 2]" 1
527 1 43 PHE QB 1 44 ASP H 0.000 . 6.000 3.025 2.137 3.851 . 0 0 "[ . 1 . 2]" 1
528 1 43 PHE QB 1 60 SER H 0.000 . 6.000 2.443 2.114 3.065 . 0 0 "[ . 1 . 2]" 1
529 1 43 PHE QB 1 60 SER HG 0.000 . 7.000 3.670 2.243 4.472 . 0 0 "[ . 1 . 2]" 1
530 1 43 PHE QD 1 59 LEU QB 0.000 . 7.650 3.015 2.265 4.251 . 0 0 "[ . 1 . 2]" 1
531 1 43 PHE QD 1 59 LEU QD 0.000 . 9.900 2.808 2.111 3.728 . 0 0 "[ . 1 . 2]" 1
532 1 43 PHE QD 1 60 SER HA 0.000 . 5.560 2.750 1.972 4.363 0.028 12 0 "[ . 1 . 2]" 1
533 1 43 PHE QD 1 60 SER QB 0.000 . 8.000 2.876 1.883 4.470 0.117 17 0 "[ . 1 . 2]" 1
534 1 43 PHE QD 1 60 SER HG 0.000 . 8.000 4.346 2.179 5.466 . 0 0 "[ . 1 . 2]" 1
535 1 43 PHE QD 1 61 HIS H 0.000 . 7.000 4.084 2.909 5.557 . 0 0 "[ . 1 . 2]" 1
536 1 43 PHE QD 1 85 TYR QB 0.000 . 6.560 2.996 2.413 4.308 . 0 0 "[ . 1 . 2]" 1
537 1 43 PHE QD 1 87 PHE QB 0.000 . 8.000 3.088 2.062 5.448 . 0 0 "[ . 1 . 2]" 1
538 1 43 PHE QD 1 101 ILE MD 0.000 . 8.500 5.958 5.270 6.430 . 0 0 "[ . 1 . 2]" 1
539 1 43 PHE QE 1 87 PHE QD 0.000 . 7.560 2.893 2.147 3.762 . 0 0 "[ . 1 . 2]" 1
540 1 43 PHE QE 1 101 ILE MD 0.000 . 8.500 4.193 3.305 4.706 . 0 0 "[ . 1 . 2]" 1
541 1 44 ASP H 1 44 ASP QB 0.000 . 4.160 2.232 1.921 2.527 0.079 12 0 "[ . 1 . 2]" 1
542 1 44 ASP H 1 87 PHE HA 0.000 . 3.560 3.561 3.186 3.675 0.115 5 0 "[ . 1 . 2]" 1
543 1 44 ASP H 1 88 TYR H 0.000 . 5.000 4.490 3.495 5.062 0.062 6 0 "[ . 1 . 2]" 1
544 1 44 ASP H 1 88 TYR QE 0.000 . 7.000 3.791 2.529 6.558 . 0 0 "[ . 1 . 2]" 1
545 1 44 ASP HA 1 44 ASP QB 0.000 . 3.560 2.339 2.162 2.525 . 0 0 "[ . 1 . 2]" 1
546 1 44 ASP HA 1 45 ALA H 0.000 . 2.850 2.311 1.971 2.796 0.029 20 0 "[ . 1 . 2]" 1
547 1 44 ASP HA 1 88 TYR QD 0.000 . 7.000 4.514 3.142 5.920 . 0 0 "[ . 1 . 2]" 1
548 1 44 ASP HA 1 88 TYR QE 0.000 . 5.560 3.115 2.097 5.346 . 0 0 "[ . 1 . 2]" 1
549 1 44 ASP QB 1 45 ALA H 0.000 . 6.000 3.123 2.159 4.134 . 0 0 "[ . 1 . 2]" 1
550 1 44 ASP QB 1 47 LEU H 0.000 . 4.560 3.123 2.239 4.053 . 0 0 "[ . 1 . 2]" 1
551 1 44 ASP QB 1 86 THR HG1 0.000 . 7.000 3.213 1.943 4.528 0.057 12 0 "[ . 1 . 2]" 1
552 1 44 ASP QB 1 88 TYR QE 0.000 . 8.000 2.957 1.891 4.872 0.109 4 0 "[ . 1 . 2]" 1
553 1 45 ALA H 1 45 ALA HA 0.000 . 2.850 2.919 2.757 2.952 0.102 11 0 "[ . 1 . 2]" 1
554 1 45 ALA H 1 45 ALA MB 0.000 . 3.950 2.299 2.166 2.390 . 0 0 "[ . 1 . 2]" 1
555 1 45 ALA HA 1 45 ALA MB 0.000 . 3.950 2.161 2.098 2.263 . 0 0 "[ . 1 . 2]" 1
556 1 45 ALA HA 1 46 ALA H 0.000 . 5.000 3.342 3.118 3.598 . 0 0 "[ . 1 . 2]" 1
557 1 45 ALA HA 1 48 ASN QD 0.000 . 6.000 2.803 1.784 4.459 0.216 2 0 "[ . 1 . 2]" 1
558 1 45 ALA HA 1 53 ALA HA 0.000 . 5.000 3.869 2.162 5.055 0.055 7 0 "[ . 1 . 2]" 1
559 1 45 ALA MB 1 47 LEU QD 0.000 . 9.400 5.329 4.665 5.841 . 0 0 "[ . 1 . 2]" 1
560 1 45 ALA MB 1 53 ALA HA 0.000 . 5.060 3.231 1.951 4.155 0.049 17 0 "[ . 1 . 2]" 1
561 1 46 ALA H 1 46 ALA MB 0.000 . 3.950 2.276 2.175 2.379 . 0 0 "[ . 1 . 2]" 1
562 1 46 ALA H 1 47 LEU H 0.000 . 2.850 2.362 2.001 2.890 0.040 6 0 "[ . 1 . 2]" 1
563 1 46 ALA HA 1 46 ALA MB 0.000 . 3.950 2.176 2.131 2.227 . 0 0 "[ . 1 . 2]" 1
564 1 46 ALA HA 1 47 LEU H 0.000 . 5.000 3.503 3.379 3.613 . 0 0 "[ . 1 . 2]" 1
565 1 46 ALA MB 1 47 LEU H 0.000 . 4.350 2.426 2.144 3.050 . 0 0 "[ . 1 . 2]" 1
566 1 46 ALA MB 1 47 LEU HA 0.000 . 6.500 4.087 3.959 4.248 . 0 0 "[ . 1 . 2]" 1
567 1 47 LEU H 1 47 LEU QB 0.000 . 3.450 2.378 2.170 2.638 . 0 0 "[ . 1 . 2]" 1
568 1 47 LEU H 1 47 LEU QD 0.000 . 7.810 2.365 1.739 3.338 0.261 11 0 "[ . 1 . 2]" 1
569 1 47 LEU H 1 48 ASN H 0.000 . 5.000 3.228 2.164 3.893 . 0 0 "[ . 1 . 2]" 1
570 1 47 LEU HA 1 47 LEU QB 0.000 . 5.000 2.423 2.304 2.543 . 0 0 "[ . 1 . 2]" 1
571 1 47 LEU HA 1 47 LEU QD 0.000 . 7.200 2.365 1.874 3.149 0.126 12 0 "[ . 1 . 2]" 1
572 1 47 LEU HA 1 48 ASN H 0.000 . 2.850 2.684 2.386 3.099 0.249 16 0 "[ . 1 . 2]" 1
573 1 47 LEU QB 1 47 LEU QD 0.000 . 6.910 1.992 1.881 2.112 0.119 11 0 "[ . 1 . 2]" 1
574 1 47 LEU QB 1 48 ASN H 0.000 . 5.600 3.759 2.108 3.953 . 0 0 "[ . 1 . 2]" 1
575 1 47 LEU QB 1 86 THR HA 0.000 . 6.000 4.748 3.900 5.406 . 0 0 "[ . 1 . 2]" 1
576 1 47 LEU QB 1 86 THR HB 0.000 . 4.560 2.602 1.836 3.681 0.164 5 0 "[ . 1 . 2]" 1
577 1 47 LEU QD 1 86 THR HA 0.000 . 7.900 5.097 4.210 5.689 . 0 0 "[ . 1 . 2]" 1
578 1 47 LEU QD 1 86 THR HG1 0.000 . 8.900 2.717 1.685 4.226 0.315 19 0 "[ . 1 . 2]" 1
579 1 48 ASN H 1 48 ASN QB 0.000 . 5.600 2.697 2.118 3.236 . 0 0 "[ . 1 . 2]" 1
580 1 48 ASN H 1 48 ASN QD 0.000 . 5.000 3.901 2.636 4.425 . 0 0 "[ . 1 . 2]" 1
581 1 48 ASN H 1 51 LYS H 0.000 . 5.000 4.553 3.734 5.036 0.036 20 0 "[ . 1 . 2]" 1
582 1 48 ASN H 1 51 LYS HA 0.000 . 5.000 3.745 3.000 4.879 . 0 0 "[ . 1 . 2]" 1
583 1 48 ASN H 1 51 LYS QB 0.000 . 6.000 4.679 2.782 5.452 . 0 0 "[ . 1 . 2]" 1
584 1 48 ASN HA 1 48 ASN QB 0.000 . 2.850 2.289 2.154 2.615 . 0 0 "[ . 1 . 2]" 1
585 1 48 ASN HA 1 49 PRO QB 0.000 . 6.000 4.735 4.389 5.081 . 0 0 "[ . 1 . 2]" 1
586 1 48 ASN HA 1 49 PRO QD 0.000 . 3.850 2.127 1.893 2.534 0.107 8 0 "[ . 1 . 2]" 1
587 1 48 ASN QB 1 48 ASN QD 0.000 . 5.760 2.164 2.022 2.797 . 0 0 "[ . 1 . 2]" 1
588 1 48 ASN QD 1 50 ALA MB 0.000 . 7.500 4.713 2.417 5.501 . 0 0 "[ . 1 . 2]" 1
589 1 48 ASN QD 1 52 SER H 0.000 . 4.560 2.554 1.772 4.091 0.228 19 0 "[ . 1 . 2]" 1
590 1 49 PRO HA 1 49 PRO QB 0.000 . 2.850 2.221 2.196 2.255 . 0 0 "[ . 1 . 2]" 1
591 1 49 PRO QB 1 83 GLY H 0.000 . 6.000 4.922 4.405 5.320 . 0 0 "[ . 1 . 2]" 1
592 1 49 PRO QB 1 83 GLY QA 0.000 . 7.000 3.150 2.046 5.505 . 0 0 "[ . 1 . 2]" 1
593 1 49 PRO QB 1 84 GLU H 0.000 . 6.000 3.892 1.909 5.050 0.091 15 0 "[ . 1 . 2]" 1
594 1 50 ALA H 1 50 ALA MB 0.000 . 6.100 2.315 2.223 2.460 . 0 0 "[ . 1 . 2]" 1
595 1 50 ALA H 1 51 LYS H 0.000 . 3.560 3.112 2.811 3.487 . 0 0 "[ . 1 . 2]" 1
596 1 50 ALA H 1 52 SER H 0.000 . 5.000 4.328 3.714 5.021 0.021 7 0 "[ . 1 . 2]" 1
597 1 50 ALA HA 1 50 ALA MB 0.000 . 3.950 2.176 2.141 2.212 . 0 0 "[ . 1 . 2]" 1
598 1 50 ALA HA 1 51 LYS H 0.000 . 2.850 2.610 2.308 2.876 0.026 17 0 "[ . 1 . 2]" 1
599 1 50 ALA MB 1 51 LYS H 0.000 . 6.500 3.640 3.575 3.685 . 0 0 "[ . 1 . 2]" 1
600 1 50 ALA MB 1 52 SER HA 0.000 . 6.500 5.239 4.839 5.403 . 0 0 "[ . 1 . 2]" 1
601 1 51 LYS H 1 51 LYS HA 0.000 . 2.850 2.492 2.364 2.902 0.052 7 0 "[ . 1 . 2]" 1
602 1 51 LYS H 1 51 LYS QB 0.000 . 5.600 2.660 1.976 3.198 0.024 8 0 "[ . 1 . 2]" 1
603 1 51 LYS H 1 51 LYS QD 0.000 . 5.000 3.272 1.630 4.556 0.370 2 0 "[ . 1 . 2]" 1
604 1 51 LYS H 1 51 LYS QG 0.000 . 6.000 2.962 1.801 4.277 0.199 4 0 "[ . 1 . 2]" 1
605 1 51 LYS H 1 52 SER H 0.000 . 3.560 3.455 3.128 3.597 0.037 16 0 "[ . 1 . 2]" 1
606 1 51 LYS HA 1 51 LYS QB 0.000 . 3.560 2.348 2.143 2.536 . 0 0 "[ . 1 . 2]" 1
607 1 51 LYS HA 1 51 LYS QE 0.000 . 5.000 3.661 1.935 4.525 0.065 3 0 "[ . 1 . 2]" 1
608 1 51 LYS HA 1 52 SER H 0.000 . 3.560 2.499 2.311 2.798 . 0 0 "[ . 1 . 2]" 1
609 1 52 SER H 1 52 SER QB 0.000 . 5.600 2.588 2.198 3.061 . 0 0 "[ . 1 . 2]" 1
610 1 52 SER HA 1 52 SER QB 0.000 . 3.560 2.290 2.201 2.468 . 0 0 "[ . 1 . 2]" 1
611 1 52 SER HA 1 53 ALA H 0.000 . 2.850 2.472 2.118 2.903 0.053 4 0 "[ . 1 . 2]" 1
612 1 52 SER QB 1 55 LEU QD 0.000 . 8.900 4.547 2.615 5.699 . 0 0 "[ . 1 . 2]" 1
613 1 53 ALA H 1 53 ALA MB 0.000 . 4.660 2.361 2.172 2.492 . 0 0 "[ . 1 . 2]" 1
614 1 53 ALA HA 1 53 ALA MB 0.000 . 3.950 2.203 2.154 2.235 . 0 0 "[ . 1 . 2]" 1
615 1 53 ALA HA 1 54 ASP H 0.000 . 5.000 3.242 2.083 3.585 . 0 0 "[ . 1 . 2]" 1
616 1 53 ALA HA 1 56 ALA H 0.000 . 5.001 4.192 3.681 5.026 0.025 14 0 "[ . 1 . 2]" 1
617 1 53 ALA HA 1 56 ALA MB 0.000 . 6.001 2.739 2.058 5.117 . 0 0 "[ . 1 . 2]" 1
618 1 53 ALA HA 1 57 LYS H 0.000 . 5.001 3.982 2.525 5.084 0.083 8 0 "[ . 1 . 2]" 1
619 1 54 ASP H 1 54 ASP HA 0.000 . 2.850 2.692 2.295 2.939 0.089 16 0 "[ . 1 . 2]" 1
620 1 54 ASP H 1 54 ASP QB 0.000 . 4.160 2.438 2.116 3.035 . 0 0 "[ . 1 . 2]" 1
621 1 54 ASP H 1 55 LEU H 0.000 . 3.560 3.291 2.734 3.627 0.067 15 0 "[ . 1 . 2]" 1
622 1 54 ASP HA 1 54 ASP QB 0.000 . 3.560 2.323 2.226 2.489 . 0 0 "[ . 1 . 2]" 1
623 1 54 ASP HA 1 55 LEU H 0.000 . 5.000 3.479 3.333 3.616 . 0 0 "[ . 1 . 2]" 1
624 1 54 ASP HA 1 57 LYS H 0.000 . 5.000 4.373 3.445 5.100 0.100 5 0 "[ . 1 . 2]" 1
625 1 54 ASP QB 1 55 LEU H 0.000 . 6.000 2.554 1.912 3.050 0.088 5 0 "[ . 1 . 2]" 1
626 1 55 LEU H 1 55 LEU QB 0.000 . 3.450 2.285 2.125 2.948 . 0 0 "[ . 1 . 2]" 1
627 1 55 LEU H 1 55 LEU QD 0.000 . 7.810 3.520 1.831 3.862 0.169 5 0 "[ . 1 . 2]" 1
628 1 55 LEU H 1 55 LEU HG 0.000 . 5.000 4.319 2.015 4.830 . 0 0 "[ . 1 . 2]" 1
629 1 55 LEU H 1 56 ALA H 0.000 . 5.000 2.805 2.289 3.541 . 0 0 "[ . 1 . 2]" 1
630 1 55 LEU H 1 57 LYS H 0.000 . 5.000 4.397 3.290 4.790 . 0 0 "[ . 1 . 2]" 1
631 1 55 LEU HA 1 55 LEU QB 0.000 . 2.850 2.416 2.242 2.569 . 0 0 "[ . 1 . 2]" 1
632 1 55 LEU HA 1 55 LEU QD 0.000 . 7.200 2.245 1.863 3.456 0.137 8 0 "[ . 1 . 2]" 1
633 1 55 LEU HA 1 55 LEU HG 0.000 . 5.000 3.469 2.542 3.873 . 0 0 "[ . 1 . 2]" 1
634 1 55 LEU HA 1 56 ALA H 0.000 . 5.000 3.451 2.617 3.577 . 0 0 "[ . 1 . 2]" 1
635 1 55 LEU HA 1 57 LYS H 0.000 . 5.001 4.507 4.000 5.142 0.141 7 0 "[ . 1 . 2]" 1
636 1 55 LEU QB 1 55 LEU QD 0.000 . 4.760 2.054 1.934 2.158 0.066 16 0 "[ . 1 . 2]" 1
637 1 55 LEU QB 1 56 ALA H 0.000 . 5.600 2.428 2.037 3.985 . 0 0 "[ . 1 . 2]" 1
638 1 55 LEU QD 1 55 LEU HG 0.000 . 3.350 1.925 1.903 1.957 0.097 4 0 "[ . 1 . 2]" 1
639 1 55 LEU QD 1 56 ALA H 0.000 . 7.900 3.145 2.458 3.981 . 0 0 "[ . 1 . 2]" 1
640 1 55 LEU QD 1 59 LEU HA 0.000 . 5.750 4.006 3.582 4.333 . 0 0 "[ . 1 . 2]" 1
641 1 55 LEU QD 1 59 LEU QB 0.000 . 8.550 2.360 1.838 3.640 0.162 3 0 "[ . 1 . 2]" 1
642 1 55 LEU QD 1 59 LEU QD 0.000 . 9.360 2.035 1.676 2.736 0.324 7 0 "[ . 1 . 2]" 1
643 1 55 LEU QD 1 81 PRO QD 0.000 . 8.900 3.993 2.449 5.327 . 0 0 "[ . 1 . 2]" 1
644 1 55 LEU QD 1 85 TYR QE 0.000 . 9.900 3.697 1.968 5.259 0.032 12 0 "[ . 1 . 2]" 1
645 1 55 LEU QD 1 85 TYR HH 0.000 . 7.900 5.164 3.974 5.903 . 0 0 "[ . 1 . 2]" 1
646 1 56 ALA H 1 56 ALA MB 0.000 . 3.950 2.265 2.100 2.791 . 0 0 "[ . 1 . 2]" 1
647 1 56 ALA H 1 57 LYS H 0.000 . 5.000 3.084 1.841 3.375 0.159 7 0 "[ . 1 . 2]" 1
648 1 56 ALA HA 1 56 ALA MB 0.000 . 6.100 2.176 2.136 2.214 . 0 0 "[ . 1 . 2]" 1
649 1 56 ALA HA 1 57 LYS H 0.000 . 5.000 3.474 2.614 3.574 . 0 0 "[ . 1 . 2]" 1
650 1 56 ALA HA 1 59 LEU H 0.000 . 5.000 4.370 3.620 5.020 0.020 16 0 "[ . 1 . 2]" 1
651 1 56 ALA HA 1 59 LEU QB 0.000 . 6.000 3.491 2.252 5.032 . 0 0 "[ . 1 . 2]" 1
652 1 56 ALA HA 1 59 LEU QD 0.000 . 7.900 3.987 2.789 5.929 . 0 0 "[ . 1 . 2]" 1
653 1 56 ALA MB 1 57 LYS H 0.000 . 5.060 2.442 2.188 3.681 . 0 0 "[ . 1 . 2]" 1
654 1 57 LYS H 1 57 LYS QB 0.000 . 4.160 2.500 2.069 3.105 . 0 0 "[ . 1 . 2]" 1
655 1 57 LYS H 1 57 LYS QG 0.000 . 6.000 3.036 1.864 4.207 0.136 14 0 "[ . 1 . 2]" 1
656 1 57 LYS H 1 58 SER H 0.000 . 5.000 2.661 2.104 3.697 . 0 0 "[ . 1 . 2]" 1
657 1 57 LYS HA 1 57 LYS QB 0.000 . 5.000 2.438 2.159 2.684 . 0 0 "[ . 1 . 2]" 1
658 1 57 LYS HA 1 57 LYS QE 0.000 . 5.000 3.485 1.914 4.472 0.086 4 0 "[ . 1 . 2]" 1
659 1 57 LYS HA 1 58 SER H 0.000 . 3.561 3.463 2.736 3.572 0.011 2 0 "[ . 1 . 2]" 1
660 1 57 LYS HA 1 60 SER H 0.000 . 2.850 2.968 2.760 3.200 0.350 5 0 "[ . 1 . 2]" 1
661 1 57 LYS QB 1 58 SER H 0.000 . 6.000 2.797 2.283 3.948 . 0 0 "[ . 1 . 2]" 1
662 1 58 SER H 1 58 SER QB 0.000 . 3.450 2.489 2.285 2.699 . 0 0 "[ . 1 . 2]" 1
663 1 58 SER H 1 59 LEU H 0.000 . 5.000 2.598 1.652 3.032 0.348 1 0 "[ . 1 . 2]" 1
664 1 58 SER HA 1 58 SER QB 0.000 . 2.850 2.403 2.253 2.522 . 0 0 "[ . 1 . 2]" 1
665 1 58 SER HA 1 59 LEU H 0.000 . 5.000 3.369 3.032 3.470 . 0 0 "[ . 1 . 2]" 1
666 1 59 LEU H 1 59 LEU QB 0.000 . 4.160 2.259 2.043 2.536 . 0 0 "[ . 1 . 2]" 1
667 1 59 LEU H 1 59 LEU QD 0.000 . 7.810 3.453 2.104 3.844 . 0 0 "[ . 1 . 2]" 1
668 1 59 LEU H 1 59 LEU HG 0.000 . 5.000 4.065 2.162 4.735 . 0 0 "[ . 1 . 2]" 1
669 1 59 LEU HA 1 59 LEU QB 0.000 . 5.000 2.430 2.071 2.565 . 0 0 "[ . 1 . 2]" 1
670 1 59 LEU HA 1 59 LEU QD 0.000 . 5.050 2.091 1.809 3.192 0.191 18 0 "[ . 1 . 2]" 1
671 1 59 LEU QB 1 59 LEU QD 0.000 . 4.760 1.982 1.815 2.109 0.185 7 0 "[ . 1 . 2]" 1
672 1 59 LEU QB 1 59 LEU HG 0.000 . 5.000 2.333 2.195 2.524 . 0 0 "[ . 1 . 2]" 1
673 1 59 LEU QB 1 60 SER H 0.000 . 5.600 2.528 2.053 3.203 . 0 0 "[ . 1 . 2]" 1
674 1 59 LEU QD 1 59 LEU HG 0.000 . 4.060 1.927 1.854 1.945 0.146 7 0 "[ . 1 . 2]" 1
675 1 59 LEU QD 1 60 SER H 0.000 . 7.900 3.636 1.926 4.158 0.074 7 0 "[ . 1 . 2]" 1
676 1 59 LEU QD 1 76 PHE HA 0.000 . 7.900 3.614 2.217 5.090 . 0 0 "[ . 1 . 2]" 1
677 1 59 LEU QD 1 76 PHE QD 0.000 . 7.750 2.837 1.954 4.333 0.046 5 0 "[ . 1 . 2]" 1
678 1 59 LEU QD 1 76 PHE QE 0.000 . 9.900 2.433 1.801 3.901 0.199 14 0 "[ . 1 . 2]" 1
679 1 59 LEU QD 1 76 PHE HZ 0.000 . 7.900 3.429 2.031 5.443 . 0 0 "[ . 1 . 2]" 1
680 1 59 LEU QD 1 77 PRO QD 0.000 . 8.900 3.506 1.812 4.714 0.188 5 0 "[ . 1 . 2]" 1
681 1 60 SER H 1 60 SER QB 0.000 . 5.600 2.386 1.978 2.989 0.022 11 0 "[ . 1 . 2]" 1
682 1 60 SER H 1 60 SER HG 0.000 . 6.000 2.708 1.772 4.504 0.228 19 0 "[ . 1 . 2]" 1
683 1 60 SER H 1 61 HIS H 0.000 . 5.000 4.563 3.902 4.879 . 0 0 "[ . 1 . 2]" 1
684 1 60 SER HA 1 60 SER QB 0.000 . 5.000 2.306 2.093 2.558 . 0 0 "[ . 1 . 2]" 1
685 1 60 SER HA 1 60 SER HG 0.000 . 5.600 3.262 2.621 3.834 . 0 0 "[ . 1 . 2]" 1
686 1 60 SER HA 1 61 HIS H 0.000 . 2.850 2.354 1.946 2.960 0.110 5 0 "[ . 1 . 2]" 1
687 1 60 SER QB 1 60 SER HG 0.000 . 5.000 2.253 2.026 2.434 . 0 0 "[ . 1 . 2]" 1
688 1 60 SER QB 1 61 HIS H 0.000 . 6.000 2.911 1.842 4.011 0.158 4 0 "[ . 1 . 2]" 1
689 1 60 SER QB 1 61 HIS HA 0.000 . 6.000 4.656 4.121 5.190 . 0 0 "[ . 1 . 2]" 1
690 1 61 HIS H 1 61 HIS QB 0.000 . 5.600 2.508 2.152 3.518 . 0 0 "[ . 1 . 2]" 1
691 1 61 HIS H 1 62 LYS H 0.000 . 5.000 4.240 3.192 4.724 . 0 0 "[ . 1 . 2]" 1
692 1 61 HIS HA 1 61 HIS QB 0.000 . 5.000 2.411 2.155 2.584 . 0 0 "[ . 1 . 2]" 1
693 1 61 HIS HA 1 62 LYS H 0.000 . 3.560 2.655 2.042 3.486 . 0 0 "[ . 1 . 2]" 1
694 1 61 HIS QB 1 62 LYS H 0.000 . 6.000 2.578 1.718 4.012 0.282 19 0 "[ . 1 . 2]" 1
695 1 61 HIS HD2 1 72 THR HG1 0.000 . 6.000 3.473 1.804 4.710 0.196 20 0 "[ . 1 . 2]" 1
696 1 62 LYS H 1 62 LYS QB 0.000 . 4.160 2.801 2.151 3.562 . 0 0 "[ . 1 . 2]" 1
697 1 62 LYS H 1 63 GLN H 0.000 . 5.000 3.256 1.714 4.504 0.286 11 0 "[ . 1 . 2]" 1
698 1 62 LYS HA 1 62 LYS QB 0.000 . 2.850 2.419 2.124 2.587 . 0 0 "[ . 1 . 2]" 1
699 1 62 LYS HA 1 62 LYS QD 0.000 . 6.000 3.403 1.939 4.486 0.061 3 0 "[ . 1 . 2]" 1
700 1 62 LYS QB 1 63 GLN H 0.000 . 3.850 2.520 1.678 3.523 0.322 2 0 "[ . 1 . 2]" 1
701 1 62 LYS QB 1 63 GLN HA 0.000 . 4.560 4.051 3.775 4.203 . 0 0 "[ . 1 . 2]" 1
702 1 63 GLN H 1 63 GLN QB 0.000 . 3.450 2.614 2.208 3.215 . 0 0 "[ . 1 . 2]" 1
703 1 63 GLN HA 1 63 GLN QB 0.000 . 2.850 2.380 2.188 2.532 . 0 0 "[ . 1 . 2]" 1
704 1 63 GLN HA 1 63 GLN QG 0.000 . 5.600 2.793 2.343 3.623 . 0 0 "[ . 1 . 2]" 1
705 1 63 GLN HA 1 64 LEU H 0.000 . 2.850 2.567 2.087 3.102 0.252 2 0 "[ . 1 . 2]" 1
706 1 63 GLN QB 1 64 LEU H 0.000 . 6.000 3.186 1.640 4.087 0.360 2 0 "[ . 1 . 2]" 1
707 1 64 LEU H 1 64 LEU QB 0.000 . 5.600 2.804 2.208 3.303 . 0 0 "[ . 1 . 2]" 1
708 1 64 LEU H 1 64 LEU QD 0.000 . 7.810 2.330 1.633 3.473 0.367 3 0 "[ . 1 . 2]" 1
709 1 64 LEU H 1 64 LEU HG 0.000 . 3.560 2.945 2.013 3.628 0.068 9 0 "[ . 1 . 2]" 1
710 1 64 LEU HA 1 64 LEU QB 0.000 . 5.000 2.307 2.144 2.487 . 0 0 "[ . 1 . 2]" 1
711 1 64 LEU HA 1 64 LEU QD 0.000 . 5.050 2.955 1.999 3.413 0.001 9 0 "[ . 1 . 2]" 1
712 1 64 LEU HA 1 64 LEU HG 0.000 . 5.000 3.238 2.375 4.279 . 0 0 "[ . 1 . 2]" 1
713 1 64 LEU HA 1 65 LEU H 0.000 . 3.560 2.398 2.036 3.563 0.003 15 0 "[ . 1 . 2]" 1
714 1 64 LEU QB 1 64 LEU QD 0.000 . 5.470 1.935 1.860 2.144 0.140 15 0 "[ . 1 . 2]" 1
715 1 64 LEU QD 1 64 LEU HG 0.000 . 3.350 1.933 1.896 1.966 0.104 15 0 "[ . 1 . 2]" 1
716 1 65 LEU H 1 65 LEU QB 0.000 . 3.450 2.301 2.037 2.507 . 0 0 "[ . 1 . 2]" 1
717 1 65 LEU H 1 65 LEU QD 0.000 . 7.810 3.001 1.944 3.921 0.056 18 0 "[ . 1 . 2]" 1
718 1 65 LEU HA 1 65 LEU QB 0.000 . 5.000 2.473 2.333 2.559 . 0 0 "[ . 1 . 2]" 1
719 1 65 LEU HA 1 65 LEU QD 0.000 . 5.760 2.168 1.879 2.992 0.121 13 0 "[ . 1 . 2]" 1
720 1 65 LEU HA 1 66 MET H 0.000 . 2.850 2.239 2.065 2.381 . 0 0 "[ . 1 . 2]" 1
721 1 65 LEU QB 1 66 MET H 0.000 . 5.600 3.887 3.419 4.060 . 0 0 "[ . 1 . 2]" 1
722 1 65 LEU QD 1 71 SER HA 0.000 . 7.900 4.431 2.182 5.799 . 0 0 "[ . 1 . 2]" 1
723 1 65 LEU QD 1 72 THR H 0.000 . 7.900 4.207 2.471 5.763 . 0 0 "[ . 1 . 2]" 1
724 1 65 LEU QD 1 72 THR HB 0.000 . 7.900 3.559 2.459 5.578 . 0 0 "[ . 1 . 2]" 1
725 1 66 MET H 1 66 MET QB 0.000 . 4.160 2.319 2.123 2.583 . 0 0 "[ . 1 . 2]" 1
726 1 66 MET H 1 66 MET QG 0.000 . 6.000 3.225 2.102 4.068 . 0 0 "[ . 1 . 2]" 1
727 1 66 MET H 1 67 SER H 0.000 . 3.560 2.835 2.281 3.529 . 0 0 "[ . 1 . 2]" 1
728 1 66 MET HA 1 66 MET QB 0.000 . 3.560 2.378 2.292 2.524 . 0 0 "[ . 1 . 2]" 1
729 1 66 MET HA 1 67 SER H 0.000 . 5.000 2.941 2.268 3.524 . 0 0 "[ . 1 . 2]" 1
730 1 66 MET QB 1 67 SER H 0.000 . 3.850 3.267 2.161 3.679 . 0 0 "[ . 1 . 2]" 1
731 1 67 SER H 1 67 SER QB 0.000 . 5.600 2.613 2.320 2.955 . 0 0 "[ . 1 . 2]" 1
732 1 67 SER HA 1 67 SER QB 0.000 . 5.000 2.329 2.171 2.493 . 0 0 "[ . 1 . 2]" 1
733 1 67 SER HA 1 68 PRO QD 0.000 . 3.850 2.034 1.921 2.141 0.079 11 0 "[ . 1 . 2]" 1
734 1 68 PRO HA 1 68 PRO QB 0.000 . 2.850 2.216 2.157 2.240 . 0 0 "[ . 1 . 2]" 1
735 1 68 PRO HA 1 69 GLY H 0.000 . 2.850 2.299 2.114 2.474 . 0 0 "[ . 1 . 2]" 1
736 1 68 PRO HA 1 70 GLN H 0.000 . 5.000 4.137 3.303 4.823 . 0 0 "[ . 1 . 2]" 1
737 1 68 PRO QB 1 68 PRO QD 0.000 . 5.760 2.634 2.539 2.855 . 0 0 "[ . 1 . 2]" 1
738 1 68 PRO QB 1 69 GLY H 0.000 . 6.000 3.527 2.469 3.982 . 0 0 "[ . 1 . 2]" 1
739 1 68 PRO QD 1 68 PRO QG 0.000 . 5.000 2.041 2.026 2.057 . 0 0 "[ . 1 . 2]" 1
740 1 69 GLY H 1 69 GLY QA 0.000 . 3.560 2.396 2.215 2.527 . 0 0 "[ . 1 . 2]" 1
741 1 69 GLY H 1 70 GLN H 0.000 . 5.000 2.640 1.921 3.987 0.079 1 0 "[ . 1 . 2]" 1
742 1 69 GLY QA 1 70 GLN H 0.000 . 6.000 2.703 2.258 2.923 . 0 0 "[ . 1 . 2]" 1
743 1 70 GLN H 1 70 GLN QB 0.000 . 5.600 2.387 2.033 2.800 . 0 0 "[ . 1 . 2]" 1
744 1 70 GLN H 1 70 GLN QG 0.000 . 6.000 3.534 1.862 4.196 0.138 19 0 "[ . 1 . 2]" 1
745 1 70 GLN HA 1 70 GLN QB 0.000 . 5.000 2.357 2.216 2.525 . 0 0 "[ . 1 . 2]" 1
746 1 70 GLN HA 1 70 GLN QG 0.000 . 5.600 2.718 2.369 3.353 . 0 0 "[ . 1 . 2]" 1
747 1 70 GLN HA 1 71 SER H 0.000 . 2.850 2.233 2.049 2.411 . 0 0 "[ . 1 . 2]" 1
748 1 70 GLN QB 1 71 SER H 0.000 . 6.000 3.504 2.218 4.059 . 0 0 "[ . 1 . 2]" 1
749 1 70 GLN QE 1 70 GLN QG 0.000 . 5.000 2.186 2.081 2.301 . 0 0 "[ . 1 . 2]" 1
750 1 71 SER HA 1 71 SER QB . . 3.560 2.275 2.104 2.474 . 0 0 "[ . 1 . 2]" 1
751 1 71 SER HA 1 72 THR H 0.000 . 3.560 2.162 2.053 2.400 . 0 0 "[ . 1 . 2]" 1
752 1 71 SER HA 1 72 THR HG1 0.000 . 6.000 3.915 3.480 4.611 . 0 0 "[ . 1 . 2]" 1
753 1 71 SER QB 1 72 THR H 0.000 . 4.560 3.085 2.090 3.957 . 0 0 "[ . 1 . 2]" 1
754 1 72 THR H 1 72 THR HG1 0.000 . 6.000 2.336 2.049 3.419 . 0 0 "[ . 1 . 2]" 1
755 1 72 THR H 1 73 SER H 0.000 . 5.000 4.299 3.093 4.640 . 0 0 "[ . 1 . 2]" 1
756 1 72 THR HA 1 72 THR HG1 0.000 . 5.600 2.841 2.119 3.014 . 0 0 "[ . 1 . 2]" 1
757 1 72 THR HA 1 73 SER H 0.000 . 2.850 2.345 2.180 2.682 . 0 0 "[ . 1 . 2]" 1
758 1 72 THR HB 1 72 THR HG1 0.000 . 3.560 2.081 1.927 2.120 0.073 17 0 "[ . 1 . 2]" 1
759 1 72 THR HB 1 73 SER H 0.000 . 5.000 4.232 3.710 4.683 . 0 0 "[ . 1 . 2]" 1
760 1 72 THR HG1 1 73 SER H 0.000 . 6.000 3.242 2.384 4.083 . 0 0 "[ . 1 . 2]" 1
761 1 72 THR HG1 1 73 SER HA 0.000 . 6.000 3.862 3.575 4.234 . 0 0 "[ . 1 . 2]" 1
762 1 73 SER H 1 73 SER QB 0.000 . 5.600 2.661 2.413 3.059 . 0 0 "[ . 1 . 2]" 1
763 1 73 SER HA 1 73 SER QB . . 3.560 2.286 2.155 2.479 . 0 0 "[ . 1 . 2]" 1
764 1 73 SER HA 1 74 THR H 0.000 . 3.560 2.149 1.959 2.570 0.041 18 0 "[ . 1 . 2]" 1
765 1 73 SER HA 1 74 THR HB 0.000 . 5.000 4.708 4.288 5.010 0.010 15 0 "[ . 1 . 2]" 1
766 1 73 SER QB 1 74 THR H 0.000 . 6.000 3.318 2.251 3.907 . 0 0 "[ . 1 . 2]" 1
767 1 74 THR H 1 74 THR HB 0.000 . 3.560 2.950 2.494 3.604 0.044 20 0 "[ . 1 . 2]" 1
768 1 74 THR H 1 74 THR HG1 0.000 . 6.000 2.859 2.034 3.616 . 0 0 "[ . 1 . 2]" 1
769 1 74 THR H 1 75 THR H 0.000 . 5.000 3.948 2.386 4.586 . 0 0 "[ . 1 . 2]" 1
770 1 74 THR HA 1 74 THR HG1 0.000 . 5.600 2.306 2.006 2.995 . 0 0 "[ . 1 . 2]" 1
771 1 74 THR HA 1 75 THR H 0.000 . 2.850 2.305 2.071 2.855 0.005 2 0 "[ . 1 . 2]" 1
772 1 74 THR HB 1 74 THR HG1 0.000 . 2.850 2.052 1.863 2.118 0.137 20 0 "[ . 1 . 2]" 1
773 1 74 THR HB 1 76 PHE QE 0.000 . 7.000 4.138 3.063 5.169 . 0 0 "[ . 1 . 2]" 1
774 1 74 THR HB 1 76 PHE HZ 0.000 . 5.000 4.782 3.002 5.066 0.066 10 0 "[ . 1 . 2]" 1
775 1 74 THR HG1 1 75 THR H 0.000 . 6.000 3.107 2.177 4.098 . 0 0 "[ . 1 . 2]" 1
776 1 74 THR HG1 1 76 PHE QD 0.000 . 8.000 3.966 2.350 5.227 . 0 0 "[ . 1 . 2]" 1
777 1 74 THR HG1 1 76 PHE QE 0.000 . 8.000 3.217 1.918 4.328 0.082 20 0 "[ . 1 . 2]" 1
778 1 74 THR HG1 1 76 PHE HZ 0.000 . 6.000 3.691 2.212 4.679 . 0 0 "[ . 1 . 2]" 1
779 1 75 THR H 1 75 THR HB 0.000 . 3.560 2.693 2.240 3.157 . 0 0 "[ . 1 . 2]" 1
780 1 75 THR H 1 75 THR HG1 0.000 . 6.000 2.790 2.222 3.581 . 0 0 "[ . 1 . 2]" 1
781 1 75 THR HA 1 75 THR HG1 0.000 . 4.160 2.482 2.036 2.926 . 0 0 "[ . 1 . 2]" 1
782 1 75 THR HA 1 76 PHE H 0.000 . 2.850 2.292 1.972 2.877 0.028 2 0 "[ . 1 . 2]" 1
783 1 75 THR HA 1 76 PHE QD 0.000 . 7.000 3.281 2.574 4.870 . 0 0 "[ . 1 . 2]" 1
784 1 75 THR HB 1 75 THR HG1 0.000 . 3.560 2.055 1.887 2.121 0.113 12 0 "[ . 1 . 2]" 1
785 1 75 THR HB 1 76 PHE H 0.000 . 5.000 4.036 3.508 4.682 . 0 0 "[ . 1 . 2]" 1
786 1 75 THR HG1 1 76 PHE H 0.000 . 6.000 2.502 1.955 3.710 0.045 17 0 "[ . 1 . 2]" 1
787 1 75 THR HG1 1 77 PRO HA 0.000 . 6.000 4.005 2.053 4.723 . 0 0 "[ . 1 . 2]" 1
788 1 76 PHE H 1 76 PHE QB 0.000 . 3.450 2.504 2.190 3.146 . 0 0 "[ . 1 . 2]" 1
789 1 76 PHE H 1 76 PHE QD 0.000 . 5.560 2.525 2.006 3.086 . 0 0 "[ . 1 . 2]" 1
790 1 76 PHE HA 1 76 PHE QB 0.000 . 5.000 2.416 2.267 2.496 . 0 0 "[ . 1 . 2]" 1
791 1 76 PHE HA 1 76 PHE QD 0.000 . 6.000 2.752 2.223 3.155 . 0 0 "[ . 1 . 2]" 1
792 1 76 PHE HA 1 77 PRO QD 0.000 . 6.000 2.085 1.888 2.363 0.112 2 0 "[ . 1 . 2]" 1
793 1 76 PHE HA 1 77 PRO QG 0.000 . 6.000 4.003 3.675 4.280 . 0 0 "[ . 1 . 2]" 1
794 1 76 PHE HA 1 80 ALA MB 0.000 . 6.500 4.345 3.313 5.368 . 0 0 "[ . 1 . 2]" 1
795 1 76 PHE QB 1 76 PHE QD 0.000 . 5.000 2.170 2.135 2.264 . 0 0 "[ . 1 . 2]" 1
796 1 76 PHE QD 1 80 ALA MB 0.000 . 8.500 3.532 2.036 4.511 . 0 0 "[ . 1 . 2]" 1
797 1 76 PHE QD 1 101 ILE MG 0.000 . 8.500 4.142 3.383 5.476 . 0 0 "[ . 1 . 2]" 1
798 1 76 PHE QD 1 103 VAL QG 0.000 . 9.900 3.773 2.826 4.641 . 0 0 "[ . 1 . 2]" 1
799 1 76 PHE QE 1 80 ALA MB 0.000 . 8.500 5.039 3.481 6.142 . 0 0 "[ . 1 . 2]" 1
800 1 76 PHE QE 1 101 ILE MD 0.000 . 8.500 2.415 1.882 3.665 0.118 9 0 "[ . 1 . 2]" 1
801 1 76 PHE QE 1 101 ILE MG 0.000 . 8.500 3.090 1.990 4.097 0.010 20 0 "[ . 1 . 2]" 1
802 1 76 PHE QE 1 103 VAL QG 0.000 . 9.900 4.219 2.900 4.758 . 0 0 "[ . 1 . 2]" 1
803 1 76 PHE HZ 1 101 ILE MD 0.000 . 6.500 2.749 2.011 3.802 . 0 0 "[ . 1 . 2]" 1
804 1 76 PHE HZ 1 101 ILE MG 0.000 . 6.500 3.335 2.176 4.399 . 0 0 "[ . 1 . 2]" 1
805 1 76 PHE HZ 1 103 VAL QG 0.000 . 7.900 5.179 4.554 5.891 . 0 0 "[ . 1 . 2]" 1
806 1 77 PRO HA 1 77 PRO QB 0.000 . 3.560 2.209 2.154 2.255 . 0 0 "[ . 1 . 2]" 1
807 1 77 PRO HA 1 78 ALA H 0.000 . 3.560 2.922 2.081 3.480 . 0 0 "[ . 1 . 2]" 1
808 1 77 PRO HA 1 79 ASP H 0.000 . 5.000 4.489 3.693 5.080 0.080 12 0 "[ . 1 . 2]" 1
809 1 77 PRO QB 1 77 PRO QD 0.000 . 5.760 2.813 2.594 3.078 . 0 0 "[ . 1 . 2]" 1
810 1 77 PRO QB 1 78 ALA H 0.000 . 4.560 2.313 1.721 3.972 0.279 11 0 "[ . 1 . 2]" 1
811 1 77 PRO QB 1 79 ASP H 0.000 . 4.560 3.383 2.384 4.216 . 0 0 "[ . 1 . 2]" 1
812 1 77 PRO QB 1 80 ALA H 0.000 . 6.000 4.926 3.751 5.429 . 0 0 "[ . 1 . 2]" 1
813 1 77 PRO QD 1 77 PRO QG 0.000 . 5.000 2.037 1.982 2.088 0.018 12 0 "[ . 1 . 2]" 1
814 1 77 PRO QD 1 80 ALA MB 0.000 . 6.060 3.751 2.119 4.517 . 0 0 "[ . 1 . 2]" 1
815 1 78 ALA H 1 78 ALA MB 0.000 . 3.950 2.515 2.208 3.163 . 0 0 "[ . 1 . 2]" 1
816 1 78 ALA H 1 79 ASP H 0.000 . 5.000 2.583 1.592 3.714 0.408 6 0 "[ . 1 . 2]" 1
817 1 78 ALA HA 1 78 ALA MB 0.000 . 6.100 2.197 2.148 2.258 . 0 0 "[ . 1 . 2]" 1
818 1 78 ALA HA 1 79 ASP H 0.000 . 5.000 2.934 2.093 3.529 . 0 0 "[ . 1 . 2]" 1
819 1 78 ALA MB 1 79 ASP H 0.000 . 6.500 3.077 2.413 3.660 . 0 0 "[ . 1 . 2]" 1
820 1 79 ASP H 1 79 ASP QB 0.000 . 5.600 2.555 2.224 2.811 . 0 0 "[ . 1 . 2]" 1
821 1 79 ASP H 1 80 ALA H 0.000 . 3.560 2.935 2.151 3.478 . 0 0 "[ . 1 . 2]" 1
822 1 79 ASP H 1 80 ALA MB 0.000 . 6.500 4.081 3.346 4.671 . 0 0 "[ . 1 . 2]" 1
823 1 79 ASP HA 1 79 ASP QB 0.000 . 3.560 2.379 2.247 2.622 . 0 0 "[ . 1 . 2]" 1
824 1 79 ASP HA 1 80 ALA H 0.000 . 3.560 2.832 1.776 3.467 0.224 20 0 "[ . 1 . 2]" 1
825 1 80 ALA H 1 80 ALA MB 0.000 . 4.660 2.263 2.047 2.494 . 0 0 "[ . 1 . 2]" 1
826 1 80 ALA HA 1 80 ALA MB 0.000 . 3.950 2.169 2.119 2.220 . 0 0 "[ . 1 . 2]" 1
827 1 80 ALA HA 1 81 PRO QD 0.000 . 6.000 2.178 1.979 3.538 0.021 6 0 "[ . 1 . 2]" 1
828 1 80 ALA MB 1 81 PRO QD 0.000 . 7.500 3.143 2.080 3.604 . 0 0 "[ . 1 . 2]" 1
829 1 80 ALA MB 1 85 TYR HH 0.000 . 6.500 3.776 2.352 5.091 . 0 0 "[ . 1 . 2]" 1
830 1 80 ALA MB 1 103 VAL QG 0.000 . 9.400 2.934 1.776 5.172 0.224 1 0 "[ . 1 . 2]" 1
831 1 81 PRO HA 1 81 PRO QB 0.000 . 3.560 2.225 2.174 2.349 . 0 0 "[ . 1 . 2]" 1
832 1 81 PRO HA 1 82 ALA H 0.000 . 2.850 2.409 2.165 2.590 . 0 0 "[ . 1 . 2]" 1
833 1 81 PRO HA 1 82 ALA MB 0.000 . 6.500 4.054 3.701 4.399 . 0 0 "[ . 1 . 2]" 1
834 1 81 PRO QB 1 82 ALA H 0.000 . 6.000 2.900 1.943 3.990 0.057 11 0 "[ . 1 . 2]" 1
835 1 81 PRO QB 1 85 TYR HH 0.000 . 6.000 4.172 2.192 5.205 . 0 0 "[ . 1 . 2]" 1
836 1 81 PRO QD 1 81 PRO QG 0.000 . 5.000 2.027 2.000 2.056 . 0 0 "[ . 1 . 2]" 1
837 1 81 PRO QD 1 85 TYR HH 0.000 . 6.000 3.299 2.486 4.894 . 0 0 "[ . 1 . 2]" 1
838 1 81 PRO QG 1 85 TYR HH 0.000 . 4.560 3.279 2.441 4.128 . 0 0 "[ . 1 . 2]" 1
839 1 82 ALA H 1 82 ALA MB 0.000 . 3.950 2.367 2.164 3.112 . 0 0 "[ . 1 . 2]" 1
840 1 82 ALA HA 1 82 ALA MB 0.000 . 4.660 2.163 2.125 2.232 . 0 0 "[ . 1 . 2]" 1
841 1 82 ALA HA 1 83 GLY H 0.000 . 5.000 2.356 2.091 2.603 . 0 0 "[ . 1 . 2]" 1
842 1 82 ALA MB 1 83 GLY H 0.000 . 6.500 2.995 2.182 3.724 . 0 0 "[ . 1 . 2]" 1
843 1 82 ALA MB 1 85 TYR QE 0.000 . 8.500 5.074 3.961 5.963 . 0 0 "[ . 1 . 2]" 1
844 1 82 ALA MB 1 85 TYR HH 0.000 . 6.500 4.865 3.822 5.437 . 0 0 "[ . 1 . 2]" 1
845 1 82 ALA MB 1 103 VAL QG 0.000 . 9.400 3.806 2.170 5.112 . 0 0 "[ . 1 . 2]" 1
846 1 82 ALA MB 1 105 GLY H 0.000 . 6.500 4.405 1.858 5.483 0.142 20 0 "[ . 1 . 2]" 1
847 1 83 GLY H 1 83 GLY QA 0.000 . 5.000 2.389 2.138 2.550 . 0 0 "[ . 1 . 2]" 1
848 1 83 GLY H 1 85 TYR QE 0.000 . 7.000 3.995 2.227 5.131 . 0 0 "[ . 1 . 2]" 1
849 1 83 GLY H 1 102 THR HA 0.000 . 5.000 4.557 3.899 5.064 0.064 2 0 "[ . 1 . 2]" 1
850 1 83 GLY H 1 102 THR HG1 0.000 . 6.000 4.285 3.307 4.770 . 0 0 "[ . 1 . 2]" 1
851 1 83 GLY H 1 103 VAL H 0.000 . 3.560 3.196 2.081 3.647 0.087 8 0 "[ . 1 . 2]" 1
852 1 83 GLY H 1 103 VAL HB 0.000 . 3.560 3.068 1.847 3.749 0.189 10 0 "[ . 1 . 2]" 1
853 1 83 GLY H 1 103 VAL QG 0.000 . 7.900 3.378 1.458 4.077 0.542 10 1 "[ . + . 2]" 1
854 1 83 GLY QA 1 84 GLU H 0.000 . 4.560 2.301 2.020 3.008 . 0 0 "[ . 1 . 2]" 1
855 1 84 GLU H 1 84 GLU QB 0.000 . 5.600 2.405 1.995 2.886 0.005 9 0 "[ . 1 . 2]" 1
856 1 84 GLU H 1 102 THR HG1 0.000 . 6.000 3.922 3.064 4.636 . 0 0 "[ . 1 . 2]" 1
857 1 84 GLU HA 1 84 GLU QB 0.000 . 5.000 2.399 2.131 2.593 . 0 0 "[ . 1 . 2]" 1
858 1 84 GLU HA 1 85 TYR H 0.000 . 3.560 2.309 2.016 3.423 . 0 0 "[ . 1 . 2]" 1
859 1 84 GLU HA 1 102 THR HG1 0.000 . 6.000 2.847 2.229 3.295 . 0 0 "[ . 1 . 2]" 1
860 1 84 GLU HA 1 103 VAL H 0.000 . 5.000 3.976 2.857 5.118 0.118 8 0 "[ . 1 . 2]" 1
861 1 84 GLU QB 1 85 TYR H 0.000 . 6.000 3.680 2.531 4.144 . 0 0 "[ . 1 . 2]" 1
862 1 85 TYR H 1 85 TYR QB 0.000 . 5.600 2.681 2.306 3.050 . 0 0 "[ . 1 . 2]" 1
863 1 85 TYR H 1 85 TYR QD 0.000 . 7.000 2.589 1.662 3.189 0.338 12 0 "[ . 1 . 2]" 1
864 1 85 TYR H 1 101 ILE H 0.000 . 5.000 3.775 3.083 5.001 0.001 2 0 "[ . 1 . 2]" 1
865 1 85 TYR H 1 102 THR HA 0.000 . 5.000 3.554 3.031 5.040 0.040 8 0 "[ . 1 . 2]" 1
866 1 85 TYR HA 1 85 TYR QB 0.000 . 5.000 2.328 2.233 2.454 . 0 0 "[ . 1 . 2]" 1
867 1 85 TYR HA 1 86 THR H 0.000 . 5.000 2.363 2.005 3.253 . 0 0 "[ . 1 . 2]" 1
868 1 85 TYR QB 1 85 TYR QD 0.000 . 5.000 2.185 2.118 2.276 . 0 0 "[ . 1 . 2]" 1
869 1 85 TYR QB 1 101 ILE H 0.000 . 6.000 3.553 2.550 4.878 . 0 0 "[ . 1 . 2]" 1
870 1 85 TYR QB 1 101 ILE MD 0.000 . 7.500 4.393 3.527 5.291 . 0 0 "[ . 1 . 2]" 1
871 1 85 TYR QB 1 101 ILE MG 0.000 . 7.500 2.284 1.780 4.676 0.220 2 0 "[ . 1 . 2]" 1
872 1 85 TYR QE 1 85 TYR HH . . 2.850 2.277 1.933 2.642 0.067 20 0 "[ . 1 . 2]" 1
873 1 85 TYR QE 1 103 VAL H 0.000 . 7.000 3.861 3.087 4.793 . 0 0 "[ . 1 . 2]" 1
874 1 85 TYR HH 1 103 VAL H 0.000 . 5.000 5.035 4.542 5.144 0.144 6 0 "[ . 1 . 2]" 1
875 1 85 TYR HH 1 103 VAL QG 0.000 . 7.900 3.014 2.026 4.076 . 0 0 "[ . 1 . 2]" 1
876 1 86 THR H 1 86 THR HB 0.000 . 3.560 2.770 2.406 3.598 0.038 14 0 "[ . 1 . 2]" 1
877 1 86 THR H 1 86 THR HG1 0.000 . 6.000 3.036 2.222 3.650 . 0 0 "[ . 1 . 2]" 1
878 1 86 THR HA 1 86 THR HG1 0.000 . 5.600 2.165 1.810 2.361 0.190 1 0 "[ . 1 . 2]" 1
879 1 86 THR HA 1 87 PHE H 0.000 . 5.000 2.065 1.948 2.184 0.052 19 0 "[ . 1 . 2]" 1
880 1 86 THR HA 1 100 LYS HA 0.000 . 3.560 2.307 1.916 2.712 0.084 7 0 "[ . 1 . 2]" 1
881 1 86 THR HA 1 100 LYS QG 0.000 . 6.000 3.231 2.047 4.608 . 0 0 "[ . 1 . 2]" 1
882 1 86 THR HA 1 101 ILE H 0.000 . 5.000 3.568 2.744 4.572 . 0 0 "[ . 1 . 2]" 1
883 1 86 THR HB 1 86 THR HG1 0.000 . 3.560 1.985 1.828 2.130 0.172 20 0 "[ . 1 . 2]" 1
884 1 86 THR HG1 1 87 PHE H 0.000 . 6.000 2.580 2.169 3.352 . 0 0 "[ . 1 . 2]" 1
885 1 86 THR HG1 1 88 TYR QD 0.000 . 8.000 3.073 1.930 3.747 0.070 15 0 "[ . 1 . 2]" 1
886 1 86 THR HG1 1 88 TYR QE 0.000 . 8.000 4.424 2.912 5.249 . 0 0 "[ . 1 . 2]" 1
887 1 86 THR HG1 1 98 VAL QG 0.000 . 8.900 2.657 1.770 3.782 0.230 12 0 "[ . 1 . 2]" 1
888 1 86 THR HG1 1 100 LYS H 0.000 . 6.000 4.388 3.728 4.757 . 0 0 "[ . 1 . 2]" 1
889 1 86 THR HG1 1 100 LYS HA 0.000 . 6.000 3.159 2.525 3.758 . 0 0 "[ . 1 . 2]" 1
890 1 87 PHE H 1 87 PHE HA 0.000 . 2.850 2.924 2.878 2.944 0.094 10 0 "[ . 1 . 2]" 1
891 1 87 PHE H 1 87 PHE QB 0.000 . 5.600 2.975 1.983 3.159 0.017 15 0 "[ . 1 . 2]" 1
892 1 87 PHE H 1 87 PHE QD 0.000 . 5.560 2.741 2.226 3.836 . 0 0 "[ . 1 . 2]" 1
893 1 87 PHE H 1 87 PHE QE 0.000 . 6.000 3.945 3.368 5.667 . 0 0 "[ . 1 . 2]" 1
894 1 87 PHE H 1 99 GLY H 0.000 . 5.000 3.258 2.074 3.895 . 0 0 "[ . 1 . 2]" 1
895 1 87 PHE H 1 100 LYS HA 0.000 . 5.000 3.223 2.733 3.649 . 0 0 "[ . 1 . 2]" 1
896 1 87 PHE HA 1 87 PHE QB 0.000 . 5.000 2.145 1.965 2.393 0.035 17 0 "[ . 1 . 2]" 1
897 1 87 PHE HA 1 87 PHE QD 0.000 . 6.000 3.269 2.240 3.575 . 0 0 "[ . 1 . 2]" 1
898 1 87 PHE HA 1 87 PHE QE 0.000 . 5.600 5.274 4.533 5.480 . 0 0 "[ . 1 . 2]" 1
899 1 87 PHE HA 1 88 TYR H 0.000 . 3.560 2.215 1.979 2.415 0.021 7 0 "[ . 1 . 2]" 1
900 1 87 PHE QB 1 87 PHE QD . . 5.000 2.115 2.065 2.184 . 0 0 "[ . 1 . 2]" 1
901 1 87 PHE QB 1 88 TYR H 0.000 . 4.560 3.274 2.816 3.964 . 0 0 "[ . 1 . 2]" 1
902 1 87 PHE QB 1 99 GLY H 0.000 . 4.560 3.845 2.856 4.182 . 0 0 "[ . 1 . 2]" 1
903 1 87 PHE QD 1 88 TYR H 0.000 . 7.000 4.646 3.378 4.976 . 0 0 "[ . 1 . 2]" 1
904 1 87 PHE QD 1 100 LYS HA 0.000 . 7.000 4.000 3.249 5.233 . 0 0 "[ . 1 . 2]" 1
905 1 87 PHE QD 1 101 ILE H 0.000 . 7.000 3.882 2.733 4.791 . 0 0 "[ . 1 . 2]" 1
906 1 87 PHE QD 1 101 ILE MD 0.000 . 8.500 4.967 4.048 5.567 . 0 0 "[ . 1 . 2]" 1
907 1 87 PHE QE 1 99 GLY QA . . 8.000 2.574 2.041 3.517 . 0 0 "[ . 1 . 2]" 1
908 1 87 PHE QE 1 100 LYS H 0.000 . 7.000 3.752 2.500 5.948 . 0 0 "[ . 1 . 2]" 1
909 1 87 PHE QE 1 100 LYS HA 0.000 . 7.000 3.464 2.551 6.235 . 0 0 "[ . 1 . 2]" 1
910 1 87 PHE QE 1 101 ILE H 0.000 . 7.000 2.599 1.811 4.482 0.189 7 0 "[ . 1 . 2]" 1
911 1 87 PHE QE 1 101 ILE HA 0.000 . 7.000 3.939 2.966 5.206 . 0 0 "[ . 1 . 2]" 1
912 1 87 PHE QE 1 101 ILE MD 0.000 . 8.500 3.805 2.980 4.323 . 0 0 "[ . 1 . 2]" 1
913 1 87 PHE QE 1 101 ILE QG 0.000 . 8.500 3.458 2.117 4.282 . 0 0 "[ . 1 . 2]" 1
914 1 87 PHE QE 1 101 ILE MG 0.000 . 8.500 3.307 1.992 4.951 0.008 2 0 "[ . 1 . 2]" 1
915 1 87 PHE HZ 1 99 GLY QA 0.000 . 6.000 3.924 2.529 5.320 . 0 0 "[ . 1 . 2]" 1
916 1 88 TYR H 1 88 TYR HA 0.000 . 2.850 2.945 2.865 2.967 0.117 20 0 "[ . 1 . 2]" 1
917 1 88 TYR H 1 88 TYR QB 0.000 . 5.600 2.790 1.896 3.050 0.104 7 0 "[ . 1 . 2]" 1
918 1 88 TYR H 1 88 TYR QD 0.000 . 7.000 2.635 1.883 4.106 0.117 17 0 "[ . 1 . 2]" 1
919 1 88 TYR HA 1 88 TYR QB 0.000 . 5.000 2.204 2.083 2.545 . 0 0 "[ . 1 . 2]" 1
920 1 88 TYR HA 1 88 TYR QD 0.000 . 6.000 3.481 2.611 3.708 . 0 0 "[ . 1 . 2]" 1
921 1 88 TYR HA 1 89 CYS H 0.000 . 3.560 2.272 2.086 2.690 . 0 0 "[ . 1 . 2]" 1
922 1 88 TYR HA 1 98 VAL HA 0.000 . 5.000 2.552 2.028 5.003 0.003 5 0 "[ . 1 . 2]" 1
923 1 88 TYR HA 1 98 VAL QG 0.000 . 7.900 3.062 2.447 5.243 . 0 0 "[ . 1 . 2]" 1
924 1 88 TYR QB 1 88 TYR QD 0.000 . 3.560 2.133 2.021 2.169 . 0 0 "[ . 1 . 2]" 1
925 1 88 TYR QB 1 89 CYS H 0.000 . 6.000 3.156 2.571 4.108 . 0 0 "[ . 1 . 2]" 1
926 1 88 TYR QB 1 98 VAL QG 0.000 . 8.900 2.628 1.859 5.709 0.141 19 0 "[ . 1 . 2]" 1
927 1 88 TYR QD 1 89 CYS H 0.000 . 7.000 4.196 3.047 4.803 . 0 0 "[ . 1 . 2]" 1
928 1 88 TYR QD 1 98 VAL QG 0.000 . 9.900 3.641 2.736 5.152 . 0 0 "[ . 1 . 2]" 1
929 1 88 TYR QE 1 90 GLU QB 0.000 . 8.000 4.307 2.182 6.021 . 0 0 "[ . 1 . 2]" 1
930 1 88 TYR QE 1 98 VAL QG 0.000 . 9.900 5.040 3.729 5.761 . 0 0 "[ . 1 . 2]" 1
931 1 89 CYS H 1 89 CYS QB 0.000 . 5.600 2.295 2.123 3.084 . 0 0 "[ . 1 . 2]" 1
932 1 89 CYS HA 1 89 CYS QB 0.000 . 5.000 2.397 2.194 2.473 . 0 0 "[ . 1 . 2]" 1
933 1 89 CYS HA 1 90 GLU H 0.000 . 5.000 2.471 2.134 3.326 . 0 0 "[ . 1 . 2]" 1
934 1 89 CYS QB 1 90 GLU H 0.000 . 4.560 3.758 2.405 4.062 . 0 0 "[ . 1 . 2]" 1
935 1 89 CYS QB 1 92 HIS H 0.000 . 6.000 3.569 2.586 4.805 . 0 0 "[ . 1 . 2]" 1
936 1 89 CYS SG 2 1 CU CU 0.000 . 2.350 2.151 2.010 2.389 0.039 13 0 "[ . 1 . 2]" 1
937 1 90 GLU H 1 90 GLU QB 0.000 . 4.160 2.422 1.966 3.104 0.034 19 0 "[ . 1 . 2]" 1
938 1 90 GLU H 1 90 GLU QG 0.000 . 6.000 3.218 1.895 4.323 0.105 14 0 "[ . 1 . 2]" 1
939 1 90 GLU HA 1 90 GLU QB 0.000 . 3.560 2.362 2.188 2.571 . 0 0 "[ . 1 . 2]" 1
940 1 90 GLU HA 1 90 GLU QG 0.000 . 5.600 2.719 2.285 3.146 . 0 0 "[ . 1 . 2]" 1
941 1 90 GLU QB 1 90 GLU QG 0.000 . 3.560 2.100 2.030 2.158 . 0 0 "[ . 1 . 2]" 1
942 1 91 PRO HA 1 91 PRO QB 0.000 . 5.000 2.213 2.195 2.229 . 0 0 "[ . 1 . 2]" 1
943 1 91 PRO HA 1 92 HIS H 0.000 . 5.000 3.202 2.149 3.503 . 0 0 "[ . 1 . 2]" 1
944 1 91 PRO QB 1 91 PRO QD 0.000 . 5.760 2.644 2.441 2.971 . 0 0 "[ . 1 . 2]" 1
945 1 91 PRO QB 1 92 HIS H 0.000 . 6.000 3.504 2.821 4.119 . 0 0 "[ . 1 . 2]" 1
946 1 91 PRO QG 1 92 HIS H 0.000 . 6.000 2.904 2.037 4.803 . 0 0 "[ . 1 . 2]" 1
947 1 92 HIS H 1 92 HIS QB 0.000 . 5.600 2.590 2.188 3.555 . 0 0 "[ . 1 . 2]" 1
948 1 92 HIS HA 1 92 HIS HD2 0.000 . 3.560 2.545 2.239 3.681 0.121 13 0 "[ . 1 . 2]" 1
949 1 92 HIS HA 1 93 ARG H 0.000 . 5.000 2.964 2.317 3.490 . 0 0 "[ . 1 . 2]" 1
950 1 92 HIS HA 1 95 ALA MB 0.000 . 6.500 4.511 3.478 5.523 . 0 0 "[ . 1 . 2]" 1
951 1 92 HIS QB 1 93 ARG H 0.000 . 6.000 3.312 2.197 3.952 . 0 0 "[ . 1 . 2]" 1
952 1 92 HIS QB 1 95 ALA MB 0.000 . 7.500 4.276 2.933 5.569 . 0 0 "[ . 1 . 2]" 1
953 1 92 HIS QB 1 97 MET H 0.000 . 6.000 3.959 2.942 5.119 . 0 0 "[ . 1 . 2]" 1
954 1 92 HIS QB 1 97 MET QB 0.000 . 7.000 2.556 1.788 3.754 0.212 18 0 "[ . 1 . 2]" 1
955 1 92 HIS ND1 2 1 CU CU 0.000 2.170 2.570 1.768 1.748 1.794 0.422 1 0 "[ . 1 . 2]" 1
956 1 93 ARG H 1 93 ARG QB 0.000 . 4.160 2.425 2.018 3.223 . 0 0 "[ . 1 . 2]" 1
957 1 93 ARG HA 1 93 ARG QB 0.000 . 5.000 2.396 2.178 2.573 . 0 0 "[ . 1 . 2]" 1
958 1 93 ARG HA 1 93 ARG QG 0.000 . 5.600 2.616 2.122 3.525 . 0 0 "[ . 1 . 2]" 1
959 1 93 ARG HA 1 95 ALA H 0.000 . 5.000 4.250 3.590 5.020 0.020 2 0 "[ . 1 . 2]" 1
960 1 93 ARG HA 1 97 MET H 0.000 . 5.000 4.161 2.621 5.060 0.060 9 0 "[ . 1 . 2]" 1
961 1 93 ARG HA 1 98 VAL QG 0.000 . 7.900 4.397 2.892 5.879 . 0 0 "[ . 1 . 2]" 1
962 1 93 ARG QB 1 93 ARG QG 0.000 . 5.000 2.104 1.996 2.214 0.004 20 0 "[ . 1 . 2]" 1
963 1 93 ARG QD 1 93 ARG QG 0.000 . 5.000 2.073 2.008 2.133 . 0 0 "[ . 1 . 2]" 1
964 1 94 GLY H 1 94 GLY QA 0.000 . 5.000 2.369 2.241 2.524 . 0 0 "[ . 1 . 2]" 1
965 1 94 GLY QA 1 95 ALA H 0.000 . 6.000 2.582 2.438 2.824 . 0 0 "[ . 1 . 2]" 1
966 1 95 ALA H 1 95 ALA MB 0.000 . 4.660 2.253 2.187 2.345 . 0 0 "[ . 1 . 2]" 1
967 1 95 ALA H 1 96 GLY H 0.000 . 3.560 3.267 2.309 3.596 0.036 20 0 "[ . 1 . 2]" 1
968 1 95 ALA HA 1 95 ALA MB 0.000 . 3.950 2.172 2.047 2.219 . 0 0 "[ . 1 . 2]" 1
969 1 95 ALA HA 1 96 GLY H 0.000 . 2.850 2.545 2.210 3.080 0.230 18 0 "[ . 1 . 2]" 1
970 1 95 ALA MB 1 96 GLY H 0.000 . 6.500 3.411 1.686 3.723 0.314 19 0 "[ . 1 . 2]" 1
971 1 95 ALA MB 1 97 MET H 0.000 . 6.500 4.215 3.703 5.436 . 0 0 "[ . 1 . 2]" 1
972 1 96 GLY H 1 96 GLY QA 0.000 . 3.560 2.340 2.226 2.523 . 0 0 "[ . 1 . 2]" 1
973 1 96 GLY H 1 97 MET H 0.000 . 3.560 3.299 2.484 3.624 0.064 11 0 "[ . 1 . 2]" 1
974 1 96 GLY QA 1 97 MET H 0.000 . 6.000 2.654 2.321 2.900 . 0 0 "[ . 1 . 2]" 1
975 1 96 GLY QA 1 98 VAL QG 0.000 . 8.900 3.406 2.180 4.946 . 0 0 "[ . 1 . 2]" 1
976 1 97 MET H 1 97 MET QB 0.000 . 4.160 2.509 2.223 3.325 . 0 0 "[ . 1 . 2]" 1
977 1 97 MET HA 1 97 MET QB 0.000 . 5.000 2.403 2.180 2.585 . 0 0 "[ . 1 . 2]" 1
978 1 97 MET HA 1 98 VAL H 0.000 . 3.560 2.379 1.970 2.697 0.030 19 0 "[ . 1 . 2]" 1
979 1 97 MET SD 2 1 CU CU 0.000 2.680 3.080 2.224 2.044 2.920 0.636 7 10 "[ * ** +* * ** .*- 2]" 1
980 1 98 VAL H 1 98 VAL HB 0.000 . 3.560 3.043 2.403 3.651 0.091 11 0 "[ . 1 . 2]" 1
981 1 98 VAL H 1 98 VAL QG 0.000 . 7.200 2.258 1.708 3.011 0.292 19 0 "[ . 1 . 2]" 1
982 1 98 VAL HA 1 98 VAL QG 0.000 . 4.660 2.167 2.041 2.338 . 0 0 "[ . 1 . 2]" 1
983 1 98 VAL HA 1 99 GLY H 0.000 . 2.850 2.295 2.110 2.580 . 0 0 "[ . 1 . 2]" 1
984 1 98 VAL HB 1 98 VAL QG 0.000 . 4.060 1.940 1.930 1.964 0.070 3 0 "[ . 1 . 2]" 1
985 1 98 VAL HB 1 99 GLY H 0.000 . 5.000 3.972 3.162 4.555 . 0 0 "[ . 1 . 2]" 1
986 1 98 VAL QG 1 99 GLY H 0.000 . 7.900 3.177 2.290 3.941 . 0 0 "[ . 1 . 2]" 1
987 1 99 GLY H 1 99 GLY QA 0.000 . 2.850 2.428 2.267 2.486 . 0 0 "[ . 1 . 2]" 1
988 1 99 GLY QA 1 100 LYS H 0.000 . 3.850 2.221 2.132 2.366 . 0 0 "[ . 1 . 2]" 1
989 1 100 LYS H 1 100 LYS QB 0.000 . 5.600 2.612 2.378 3.362 . 0 0 "[ . 1 . 2]" 1
990 1 100 LYS H 1 100 LYS QG 0.000 . 6.000 3.293 2.103 4.227 . 0 0 "[ . 1 . 2]" 1
991 1 100 LYS HA 1 100 LYS QB 0.000 . 5.000 2.381 2.174 2.534 . 0 0 "[ . 1 . 2]" 1
992 1 100 LYS HA 1 100 LYS QG 0.000 . 5.600 2.580 2.078 3.458 . 0 0 "[ . 1 . 2]" 1
993 1 100 LYS HA 1 101 ILE H 0.000 . 2.850 2.176 2.017 2.570 . 0 0 "[ . 1 . 2]" 1
994 1 100 LYS QB 1 101 ILE H 0.000 . 6.000 3.412 2.303 4.119 . 0 0 "[ . 1 . 2]" 1
995 1 100 LYS QG 1 101 ILE H 0.000 . 6.000 3.732 2.282 4.635 . 0 0 "[ . 1 . 2]" 1
996 1 101 ILE H 1 101 ILE HB 0.000 . 2.850 2.605 2.100 2.941 0.091 20 0 "[ . 1 . 2]" 1
997 1 101 ILE H 1 101 ILE MG 0.000 . 6.500 2.959 1.959 3.968 0.041 20 0 "[ . 1 . 2]" 1
998 1 101 ILE HA 1 101 ILE MD 0.000 . 6.100 3.729 2.693 4.039 . 0 0 "[ . 1 . 2]" 1
999 1 101 ILE HA 1 101 ILE QG 0.000 . 6.100 2.245 2.016 2.596 . 0 0 "[ . 1 . 2]" 1
1000 1 101 ILE HA 1 101 ILE MG 0.000 . 4.660 3.100 2.440 3.239 . 0 0 "[ . 1 . 2]" 1
1001 1 101 ILE HA 1 102 THR H 0.000 . 2.850 2.121 1.973 2.270 0.027 20 0 "[ . 1 . 2]" 1
1002 1 101 ILE HB 1 101 ILE MG 0.000 . 3.350 2.183 2.086 2.224 . 0 0 "[ . 1 . 2]" 1
1003 1 101 ILE HB 1 102 THR H 0.000 . 5.000 4.410 3.808 4.691 . 0 0 "[ . 1 . 2]" 1
1004 1 101 ILE MD 1 101 ILE QG 0.000 . 6.750 1.967 1.946 1.996 0.054 9 0 "[ . 1 . 2]" 1
1005 1 101 ILE MD 1 101 ILE MG 0.000 . 5.310 1.851 1.790 1.902 0.210 20 0 "[ . 1 . 2]" 1
1006 1 101 ILE QG 1 101 ILE MG 0.000 . 6.060 2.420 2.296 2.611 . 0 0 "[ . 1 . 2]" 1
1007 1 101 ILE MG 1 102 THR H 0.000 . 5.060 3.381 2.521 3.908 . 0 0 "[ . 1 . 2]" 1
1008 1 101 ILE MG 1 102 THR HA 0.000 . 6.500 3.705 3.462 4.269 . 0 0 "[ . 1 . 2]" 1
1009 1 101 ILE MG 1 103 VAL HA 0.000 . 6.500 4.248 3.163 4.939 . 0 0 "[ . 1 . 2]" 1
1010 1 102 THR H 1 102 THR HB 0.000 . 5.000 2.972 2.583 3.734 . 0 0 "[ . 1 . 2]" 1
1011 1 102 THR H 1 102 THR HG1 0.000 . 6.000 2.840 1.634 3.505 0.366 4 0 "[ . 1 . 2]" 1
1012 1 102 THR HA 1 102 THR HG1 0.000 . 5.600 2.125 1.933 2.283 0.067 8 0 "[ . 1 . 2]" 1
1013 1 102 THR HA 1 103 VAL H 0.000 . 2.850 2.292 2.008 2.539 . 0 0 "[ . 1 . 2]" 1
1014 1 102 THR HA 1 103 VAL QG 0.000 . 7.900 3.683 3.164 4.193 . 0 0 "[ . 1 . 2]" 1
1015 1 102 THR HB 1 102 THR HG1 0.000 . 3.560 2.096 1.930 2.136 0.070 13 0 "[ . 1 . 2]" 1
1016 1 102 THR HB 1 103 VAL H 0.000 . 5.000 4.238 3.129 4.561 . 0 0 "[ . 1 . 2]" 1
1017 1 102 THR HG1 1 103 VAL H 0.000 . 6.000 3.356 2.587 4.071 . 0 0 "[ . 1 . 2]" 1
1018 1 103 VAL H 1 103 VAL HB 0.000 . 5.000 2.666 2.324 3.615 . 0 0 "[ . 1 . 2]" 1
1019 1 103 VAL H 1 103 VAL QG 0.000 . 7.200 2.129 1.741 2.552 0.259 10 0 "[ . 1 . 2]" 1
1020 1 103 VAL HA 1 103 VAL QG 0.000 . 3.950 2.178 2.072 2.414 . 0 0 "[ . 1 . 2]" 1
1021 1 103 VAL HA 1 104 ALA H 0.000 . 2.850 2.154 1.941 2.423 0.059 14 0 "[ . 1 . 2]" 1
1022 1 103 VAL HB 1 103 VAL QG 0.000 . 3.350 1.905 1.834 1.939 0.166 10 0 "[ . 1 . 2]" 1
1023 1 103 VAL HB 1 104 ALA H 0.000 . 5.000 4.091 2.644 4.449 . 0 0 "[ . 1 . 2]" 1
1024 1 103 VAL QG 1 104 ALA H 0.000 . 7.900 2.887 2.019 3.679 . 0 0 "[ . 1 . 2]" 1
1025 1 104 ALA H 1 104 ALA MB 0.000 . 6.100 2.450 2.238 3.187 . 0 0 "[ . 1 . 2]" 1
1026 1 104 ALA HA 1 104 ALA MB 0.000 . 4.660 2.181 2.148 2.234 . 0 0 "[ . 1 . 2]" 1
1027 1 104 ALA HA 1 105 GLY H 0.000 . 3.560 2.952 2.246 3.525 . 0 0 "[ . 1 . 2]" 1
1028 1 104 ALA MB 1 105 GLY H 0.000 . 6.500 2.586 1.882 3.708 0.118 19 0 "[ . 1 . 2]" 1
1029 1 105 GLY H 1 105 GLY QA 0.000 . 5.000 2.444 2.351 2.497 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Friday, June 28, 2024 6:42:29 AM GMT (wattos1)