NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
610912 |
2k9n   |
15989 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2k9n
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 1151
_Distance_constraint_stats_list.Viol_count 1407
_Distance_constraint_stats_list.Viol_total 2331.998
_Distance_constraint_stats_list.Viol_max 0.766
_Distance_constraint_stats_list.Viol_rms 0.0288
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0051
_Distance_constraint_stats_list.Viol_average_violations_only 0.0829
_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 LYS 0.055 0.040 5 0 "[ . 1 . 2]"
1 2 VAL 0.375 0.077 16 0 "[ . 1 . 2]"
1 3 LYS 0.708 0.077 16 0 "[ . 1 . 2]"
1 4 PHE 1.266 0.109 6 0 "[ . 1 . 2]"
1 5 THR 4.976 0.201 20 0 "[ . 1 . 2]"
1 6 GLU 2.006 0.201 20 0 "[ . 1 . 2]"
1 7 GLU 0.285 0.150 20 0 "[ . 1 . 2]"
1 8 GLU 1.620 0.168 14 0 "[ . 1 . 2]"
1 9 ASP 1.299 0.117 19 0 "[ . 1 . 2]"
1 10 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 LEU 0.458 0.050 3 0 "[ . 1 . 2]"
1 16 VAL 0.458 0.050 3 0 "[ . 1 . 2]"
1 17 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 TYR 0.932 0.083 10 0 "[ . 1 . 2]"
1 20 GLY 2.201 0.134 10 0 "[ . 1 . 2]"
1 21 ALA 3.140 0.134 10 0 "[ . 1 . 2]"
1 22 LYS 1.433 0.084 5 0 "[ . 1 . 2]"
1 23 ASP 3.501 0.137 15 0 "[ . 1 . 2]"
1 24 TRP 5.434 0.303 6 0 "[ . 1 . 2]"
1 25 ILE 5.360 0.220 20 0 "[ . 1 . 2]"
1 26 ARG 7.385 0.220 20 0 "[ . 1 . 2]"
1 27 ILE 3.063 0.202 17 0 "[ . 1 . 2]"
1 28 SER 0.425 0.050 4 0 "[ . 1 . 2]"
1 29 GLN 0.005 0.005 8 0 "[ . 1 . 2]"
1 30 LEU 0.036 0.017 2 0 "[ . 1 . 2]"
1 31 MET 0.557 0.104 15 0 "[ . 1 . 2]"
1 32 ILE 0.440 0.109 18 0 "[ . 1 . 2]"
1 33 THR 0.470 0.070 4 0 "[ . 1 . 2]"
1 34 ARG 1.012 0.104 15 0 "[ . 1 . 2]"
1 35 ASN 3.300 0.218 17 0 "[ . 1 . 2]"
1 36 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ARG 0.023 0.023 14 0 "[ . 1 . 2]"
1 38 GLN 1.097 0.123 11 0 "[ . 1 . 2]"
1 39 CYS 8.902 0.303 6 0 "[ . 1 . 2]"
1 40 ARG 1.139 0.129 2 0 "[ . 1 . 2]"
1 41 GLU 0.372 0.077 6 0 "[ . 1 . 2]"
1 42 ARG 1.606 0.123 11 0 "[ . 1 . 2]"
1 43 TRP 7.215 0.296 17 0 "[ . 1 . 2]"
1 44 ASN 1.901 0.150 15 0 "[ . 1 . 2]"
1 45 ASN 1.395 0.112 8 0 "[ . 1 . 2]"
1 46 TYR 1.658 0.131 4 0 "[ . 1 . 2]"
1 47 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 ASN 5.596 0.296 17 0 "[ . 1 . 2]"
1 49 PRO 0.077 0.014 6 0 "[ . 1 . 2]"
1 50 ALA 0.063 0.014 6 0 "[ . 1 . 2]"
1 51 LEU 11.681 0.766 14 15 "[******** * **+-** 2]"
1 52 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 THR 0.209 0.035 12 0 "[ . 1 . 2]"
1 54 ASP 1.974 0.132 20 0 "[ . 1 . 2]"
1 55 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 TRP 10.127 0.193 7 0 "[ . 1 . 2]"
1 57 SER 0.214 0.050 8 0 "[ . 1 . 2]"
1 58 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 GLU 6.320 0.383 15 0 "[ . 1 . 2]"
1 60 GLU 4.276 0.181 19 0 "[ . 1 . 2]"
1 61 ASP 0.010 0.010 8 0 "[ . 1 . 2]"
1 62 MET 1.279 0.118 8 0 "[ . 1 . 2]"
1 63 LEU 9.101 0.383 15 0 "[ . 1 . 2]"
1 64 LEU 0.032 0.032 8 0 "[ . 1 . 2]"
1 65 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 GLN 4.526 0.179 1 0 "[ . 1 . 2]"
1 67 LYS 0.030 0.012 6 0 "[ . 1 . 2]"
1 68 TYR 1.492 0.113 14 0 "[ . 1 . 2]"
1 69 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 GLU 2.236 0.129 15 0 "[ . 1 . 2]"
1 71 TYR 4.961 0.163 14 0 "[ . 1 . 2]"
1 72 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 LYS 4.104 0.163 14 0 "[ . 1 . 2]"
1 75 TRP 5.311 0.177 18 0 "[ . 1 . 2]"
1 76 ASN 2.423 0.135 13 0 "[ . 1 . 2]"
1 77 LYS 0.387 0.049 20 0 "[ . 1 . 2]"
1 78 ILE 2.731 0.135 13 0 "[ . 1 . 2]"
1 79 SER 2.992 0.137 12 0 "[ . 1 . 2]"
1 80 LYS 2.029 0.117 2 0 "[ . 1 . 2]"
1 81 PHE 1.937 0.117 2 0 "[ . 1 . 2]"
1 82 LEU 1.610 0.137 12 0 "[ . 1 . 2]"
1 83 LYS 3.828 0.268 20 0 "[ . 1 . 2]"
1 84 ASN 3.940 0.268 20 0 "[ . 1 . 2]"
1 85 ARG 3.697 0.217 13 0 "[ . 1 . 2]"
1 86 SER 14.112 0.766 14 15 "[******** * **+-** 2]"
1 87 ASP 3.268 0.193 17 0 "[ . 1 . 2]"
1 88 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 ASN 5.132 0.217 13 0 "[ . 1 . 2]"
1 90 ILE 2.084 0.099 9 0 "[ . 1 . 2]"
1 91 ARG 0.071 0.022 3 0 "[ . 1 . 2]"
1 92 ASN 4.909 0.193 7 0 "[ . 1 . 2]"
1 93 ARG 1.070 0.122 17 0 "[ . 1 . 2]"
1 94 TRP 0.794 0.069 16 0 "[ . 1 . 2]"
1 95 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 MET 2.375 0.161 4 0 "[ . 1 . 2]"
1 97 ILE 3.270 0.161 4 0 "[ . 1 . 2]"
1 98 ALA 3.595 0.199 11 0 "[ . 1 . 2]"
1 99 ARG 4.206 0.199 11 0 "[ . 1 . 2]"
1 100 HIS 3.828 0.184 3 0 "[ . 1 . 2]"
1 101 ARG 1.821 0.184 3 0 "[ . 1 . 2]"
1 102 ALA 0.111 0.020 20 0 "[ . 1 . 2]"
1 103 LYS 0.909 0.100 13 0 "[ . 1 . 2]"
1 104 HIS 0.624 0.100 13 0 "[ . 1 . 2]"
1 105 GLN 0.100 0.050 19 0 "[ . 1 . 2]"
1 106 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 SER 0.006 0.006 11 0 "[ . 1 . 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 LYS QE 1 2 VAL H 1.800 . 5.000 4.055 3.213 4.550 . 0 0 "[ . 1 . 2]" 1
2 1 1 LYS QG 1 2 VAL H 1.800 . 3.600 2.125 1.760 3.062 0.040 5 0 "[ . 1 . 2]" 1
3 1 1 LYS QB 1 2 VAL H 1.800 . 3.600 2.561 1.784 3.350 0.016 19 0 "[ . 1 . 2]" 1
4 1 1 LYS HA 1 2 VAL H 1.800 . 4.200 2.729 2.393 3.367 . 0 0 "[ . 1 . 2]" 1
5 1 2 VAL H 1 4 PHE QE 1.800 . 6.000 5.381 4.322 5.719 . 0 0 "[ . 1 . 2]" 1
6 1 2 VAL H 1 2 VAL HB 1.800 . 3.600 2.704 2.443 3.633 0.033 7 0 "[ . 1 . 2]" 1
7 1 2 VAL H 1 2 VAL QG 1.800 . 4.200 2.035 1.757 2.708 0.043 7 0 "[ . 1 . 2]" 1
8 1 2 VAL HA 1 3 LYS H 1.800 . 2.800 2.481 2.189 2.581 . 0 0 "[ . 1 . 2]" 1
9 1 2 VAL HB 1 3 LYS H 1.800 . 5.000 3.507 2.080 4.179 . 0 0 "[ . 1 . 2]" 1
10 1 2 VAL QG 1 3 LYS H 1.800 . 3.600 1.899 1.723 2.886 0.077 16 0 "[ . 1 . 2]" 1
11 1 3 LYS H 1 4 PHE QD 1.800 . 6.000 4.242 3.189 4.871 . 0 0 "[ . 1 . 2]" 1
12 1 3 LYS H 1 4 PHE HA 1.800 . 5.500 5.449 4.702 5.561 0.061 16 0 "[ . 1 . 2]" 1
13 1 3 LYS H 1 3 LYS QG 1.800 . 4.200 2.305 1.797 3.836 0.003 16 0 "[ . 1 . 2]" 1
14 1 3 LYS H 1 3 LYS QD 1.800 . 5.000 2.990 1.747 3.959 0.053 5 0 "[ . 1 . 2]" 1
15 1 3 LYS H 1 3 LYS QE 1.800 . 5.500 4.219 3.261 4.921 . 0 0 "[ . 1 . 2]" 1
16 1 3 LYS QB 1 4 PHE H 1.800 . 3.600 2.428 2.315 2.840 . 0 0 "[ . 1 . 2]" 1
17 1 3 LYS QG 1 4 PHE H 1.800 . 5.000 3.988 3.673 4.460 . 0 0 "[ . 1 . 2]" 1
18 1 3 LYS QD 1 4 PHE H 1.800 . 5.500 4.505 3.951 4.846 . 0 0 "[ . 1 . 2]" 1
19 1 3 LYS HA 1 4 PHE H 1.800 . 4.200 3.587 3.480 3.616 . 0 0 "[ . 1 . 2]" 1
20 1 4 PHE H 1 4 PHE QE 1.800 . 5.500 3.741 3.463 4.066 . 0 0 "[ . 1 . 2]" 1
21 1 4 PHE H 1 4 PHE QD 1.800 . 4.200 2.321 1.814 2.910 . 0 0 "[ . 1 . 2]" 1
22 1 4 PHE H 1 5 THR H 1.800 . 5.000 4.648 4.617 4.682 . 0 0 "[ . 1 . 2]" 1
23 1 4 PHE HA 1 5 THR H 1.800 . 3.600 2.382 2.357 2.397 . 0 0 "[ . 1 . 2]" 1
24 1 4 PHE QB 1 5 THR H 1.800 . 5.000 2.465 2.424 2.500 . 0 0 "[ . 1 . 2]" 1
25 1 4 PHE QD 1 5 THR H 1.800 . 5.000 3.721 3.570 3.953 . 0 0 "[ . 1 . 2]" 1
26 1 5 THR H 1 5 THR MG 1.800 . 4.200 1.913 1.799 3.697 0.001 7 0 "[ . 1 . 2]" 1
27 1 5 THR H 1 8 GLU H 1.800 . 5.000 3.721 3.634 3.829 . 0 0 "[ . 1 . 2]" 1
28 1 5 THR H 1 8 GLU HA 1.800 . 5.500 5.570 5.432 5.668 0.168 14 0 "[ . 1 . 2]" 1
29 1 5 THR H 1 8 GLU QB 1.800 . 5.000 3.042 2.667 3.605 . 0 0 "[ . 1 . 2]" 1
30 1 5 THR H 1 8 GLU QG 1.800 . 5.000 3.677 2.195 4.446 . 0 0 "[ . 1 . 2]" 1
31 1 6 GLU H 1 9 ASP H 1.800 . 5.500 4.891 4.677 4.957 . 0 0 "[ . 1 . 2]" 1
32 1 6 GLU H 1 9 ASP QB 1.800 . 5.500 4.827 4.657 4.937 . 0 0 "[ . 1 . 2]" 1
33 1 6 GLU H 1 8 GLU H 1.800 . 5.000 4.379 4.261 4.481 . 0 0 "[ . 1 . 2]" 1
34 1 6 GLU H 1 7 GLU H 1.800 . 3.000 2.909 2.872 2.935 . 0 0 "[ . 1 . 2]" 1
35 1 6 GLU H 1 7 GLU HA 1.800 . 5.500 5.499 5.467 5.520 0.020 1 0 "[ . 1 . 2]" 1
36 1 5 THR HA 1 6 GLU H 1.800 . 3.600 2.338 2.331 2.365 . 0 0 "[ . 1 . 2]" 1
37 1 5 THR HB 1 6 GLU H 1.800 . 3.600 3.694 3.674 3.801 0.201 20 0 "[ . 1 . 2]" 1
38 1 5 THR MG 1 6 GLU H 1.800 . 4.200 3.504 1.782 3.619 0.018 20 0 "[ . 1 . 2]" 1
39 1 6 GLU H 1 6 GLU QB 1.800 . 3.600 2.508 2.213 2.658 . 0 0 "[ . 1 . 2]" 1
40 1 6 GLU H 1 6 GLU QG 1.800 . 4.200 2.223 1.829 3.900 . 0 0 "[ . 1 . 2]" 1
41 1 5 THR MG 1 7 GLU H 1.800 . 5.500 2.610 1.650 2.778 0.150 20 0 "[ . 1 . 2]" 1
42 1 5 THR HA 1 7 GLU H 1.800 . 5.000 4.370 4.274 4.451 . 0 0 "[ . 1 . 2]" 1
43 1 5 THR HB 1 7 GLU H 1.800 . 5.000 4.402 3.622 4.535 . 0 0 "[ . 1 . 2]" 1
44 1 5 THR H 1 7 GLU H 1.800 . 5.500 4.996 4.834 5.208 . 0 0 "[ . 1 . 2]" 1
45 1 7 GLU H 1 10 LEU HG 1.800 . 6.000 4.402 4.358 4.424 . 0 0 "[ . 1 . 2]" 1
46 1 7 GLU H 1 10 LEU QD 1.800 . 5.500 4.048 4.017 4.075 . 0 0 "[ . 1 . 2]" 1
47 1 7 GLU H 1 10 LEU H 1.800 . 5.500 5.078 4.982 5.101 . 0 0 "[ . 1 . 2]" 1
48 1 6 GLU HA 1 7 GLU H 1.800 . 3.600 3.570 3.557 3.579 . 0 0 "[ . 1 . 2]" 1
49 1 6 GLU QB 1 7 GLU H 1.800 . 5.000 2.877 2.444 3.409 . 0 0 "[ . 1 . 2]" 1
50 1 6 GLU QG 1 7 GLU H 1.800 . 5.000 3.208 1.864 4.493 . 0 0 "[ . 1 . 2]" 1
51 1 7 GLU H 1 8 GLU H 1.800 . 3.600 2.866 2.829 2.913 . 0 0 "[ . 1 . 2]" 1
52 1 7 GLU H 1 9 ASP H 1.800 . 5.000 4.306 4.112 4.376 . 0 0 "[ . 1 . 2]" 1
53 1 7 GLU H 1 7 GLU QB 1.800 . 3.600 2.554 2.200 2.770 . 0 0 "[ . 1 . 2]" 1
54 1 7 GLU H 1 7 GLU QG 1.800 . 4.200 2.392 1.778 3.903 0.022 7 0 "[ . 1 . 2]" 1
55 1 5 THR MG 1 8 GLU H 1.800 . 5.000 2.186 1.968 3.141 . 0 0 "[ . 1 . 2]" 1
56 1 6 GLU HA 1 8 GLU H 1.800 . 5.500 4.086 4.028 4.152 . 0 0 "[ . 1 . 2]" 1
57 1 8 GLU H 1 9 ASP H 1.800 . 3.600 2.580 2.463 2.632 . 0 0 "[ . 1 . 2]" 1
58 1 8 GLU H 1 10 LEU H 1.800 . 5.500 3.958 3.908 4.009 . 0 0 "[ . 1 . 2]" 1
59 1 8 GLU H 1 9 ASP QB 1.800 . 5.000 4.306 4.235 4.350 . 0 0 "[ . 1 . 2]" 1
60 1 7 GLU HA 1 8 GLU H 1.800 . 5.000 3.555 3.536 3.575 . 0 0 "[ . 1 . 2]" 1
61 1 7 GLU QB 1 8 GLU H 1.800 . 3.600 2.611 2.570 2.690 . 0 0 "[ . 1 . 2]" 1
62 1 7 GLU QG 1 8 GLU H 1.800 . 5.000 3.890 3.684 4.534 . 0 0 "[ . 1 . 2]" 1
63 1 8 GLU H 1 10 LEU QD 1.800 . 6.000 4.555 4.532 4.578 . 0 0 "[ . 1 . 2]" 1
64 1 8 GLU H 1 9 ASP HA 1.800 . 5.500 5.239 5.145 5.280 . 0 0 "[ . 1 . 2]" 1
65 1 5 THR HA 1 8 GLU H 1.800 . 5.000 4.698 4.644 4.761 . 0 0 "[ . 1 . 2]" 1
66 1 5 THR HB 1 8 GLU H 1.800 . 5.000 4.853 3.206 5.012 0.012 7 0 "[ . 1 . 2]" 1
67 1 4 PHE QD 1 8 GLU H 1.800 . 5.500 4.054 3.834 4.488 . 0 0 "[ . 1 . 2]" 1
68 1 8 GLU H 1 8 GLU QB 1.800 . 3.600 2.258 2.055 2.620 . 0 0 "[ . 1 . 2]" 1
69 1 8 GLU H 1 8 GLU QG 1.800 . 5.000 3.396 2.061 4.064 . 0 0 "[ . 1 . 2]" 1
70 1 5 THR MG 1 9 ASP H 1.800 . 5.500 4.276 4.070 4.589 . 0 0 "[ . 1 . 2]" 1
71 1 6 GLU HA 1 9 ASP H 1.800 . 3.600 3.097 2.930 3.137 . 0 0 "[ . 1 . 2]" 1
72 1 5 THR H 1 9 ASP H 1.800 . 5.000 5.062 4.931 5.117 0.117 19 0 "[ . 1 . 2]" 1
73 1 4 PHE QB 1 9 ASP H 1.800 . 5.000 4.258 4.199 4.302 . 0 0 "[ . 1 . 2]" 1
74 1 4 PHE QD 1 9 ASP H 1.800 . 5.000 3.036 2.606 3.496 . 0 0 "[ . 1 . 2]" 1
75 1 4 PHE QE 1 9 ASP H 1.800 . 5.500 3.982 3.541 4.322 . 0 0 "[ . 1 . 2]" 1
76 1 9 ASP H 1 10 LEU H 1.800 . 3.600 2.813 2.751 2.850 . 0 0 "[ . 1 . 2]" 1
77 1 9 ASP H 1 10 LEU QD 1.800 . 5.500 4.073 4.035 4.096 . 0 0 "[ . 1 . 2]" 1
78 1 8 GLU QB 1 9 ASP H 1.800 . 3.600 2.452 2.271 2.742 . 0 0 "[ . 1 . 2]" 1
79 1 8 GLU QG 1 9 ASP H 1.800 . 5.000 4.028 3.635 4.551 . 0 0 "[ . 1 . 2]" 1
80 1 8 GLU HA 1 9 ASP H 1.800 . 5.000 3.559 3.547 3.572 . 0 0 "[ . 1 . 2]" 1
81 1 9 ASP H 1 12 LEU H 1.800 . 5.500 4.832 4.676 5.036 . 0 0 "[ . 1 . 2]" 1
82 1 6 GLU HA 1 10 LEU H 1.800 . 5.000 4.661 4.580 4.697 . 0 0 "[ . 1 . 2]" 1
83 1 7 GLU HA 1 10 LEU H 1.800 . 5.000 3.639 3.584 3.663 . 0 0 "[ . 1 . 2]" 1
84 1 8 GLU HA 1 10 LEU H 1.800 . 5.000 3.740 3.661 3.856 . 0 0 "[ . 1 . 2]" 1
85 1 9 ASP QB 1 10 LEU H 1.800 . 5.000 2.816 2.691 2.902 . 0 0 "[ . 1 . 2]" 1
86 1 9 ASP HA 1 10 LEU H 1.800 . 5.000 3.490 3.477 3.496 . 0 0 "[ . 1 . 2]" 1
87 1 10 LEU H 1 11 LYS QB 1.800 . 5.500 4.359 4.100 4.576 . 0 0 "[ . 1 . 2]" 1
88 1 10 LEU H 1 10 LEU QD 1.800 . 3.600 2.465 2.409 2.506 . 0 0 "[ . 1 . 2]" 1
89 1 10 LEU H 1 10 LEU QB 1.800 . 3.600 2.751 2.722 2.774 . 0 0 "[ . 1 . 2]" 1
90 1 8 GLU HA 1 11 LYS H 1.800 . 5.000 2.906 2.800 3.070 . 0 0 "[ . 1 . 2]" 1
91 1 9 ASP H 1 11 LYS H 1.800 . 5.000 4.222 4.131 4.381 . 0 0 "[ . 1 . 2]" 1
92 1 9 ASP HA 1 11 LYS H 1.800 . 5.000 4.354 4.244 4.489 . 0 0 "[ . 1 . 2]" 1
93 1 10 LEU QD 1 11 LYS H 1.800 . 5.000 3.833 3.806 3.854 . 0 0 "[ . 1 . 2]" 1
94 1 10 LEU QB 1 11 LYS H 1.800 . 5.000 2.640 2.565 2.717 . 0 0 "[ . 1 . 2]" 1
95 1 10 LEU HA 1 11 LYS H 1.800 . 3.600 3.542 3.524 3.561 . 0 0 "[ . 1 . 2]" 1
96 1 11 LYS H 1 11 LYS QB 1.800 . 3.600 2.389 2.171 2.592 . 0 0 "[ . 1 . 2]" 1
97 1 11 LYS H 1 11 LYS QG 1.800 . 4.200 2.689 1.884 3.926 . 0 0 "[ . 1 . 2]" 1
98 1 11 LYS H 1 11 LYS QD 1.800 . 5.000 3.724 2.129 4.415 . 0 0 "[ . 1 . 2]" 1
99 1 11 LYS H 1 12 LEU QD 1.800 . 5.500 3.803 3.578 4.229 . 0 0 "[ . 1 . 2]" 1
100 1 11 LYS H 1 12 LEU H 1.800 . 3.600 2.642 2.560 2.767 . 0 0 "[ . 1 . 2]" 1
101 1 11 LYS H 1 13 GLN H 1.800 . 5.000 4.347 4.178 4.630 . 0 0 "[ . 1 . 2]" 1
102 1 11 LYS QG 1 12 LEU H 1.800 . 5.000 4.114 3.850 4.552 . 0 0 "[ . 1 . 2]" 1
103 1 11 LYS QB 1 12 LEU H 1.800 . 5.000 2.722 2.528 2.992 . 0 0 "[ . 1 . 2]" 1
104 1 11 LYS HA 1 12 LEU H 1.800 . 3.600 3.521 3.466 3.565 . 0 0 "[ . 1 . 2]" 1
105 1 9 ASP HA 1 12 LEU H 1.800 . 5.000 3.357 3.236 3.509 . 0 0 "[ . 1 . 2]" 1
106 1 9 ASP QB 1 12 LEU H 1.800 . 5.500 4.923 4.853 4.981 . 0 0 "[ . 1 . 2]" 1
107 1 12 LEU H 1 13 GLN H 1.800 . 3.600 2.738 2.574 2.887 . 0 0 "[ . 1 . 2]" 1
108 1 12 LEU H 1 14 GLN H 1.800 . 5.000 4.108 3.956 4.229 . 0 0 "[ . 1 . 2]" 1
109 1 12 LEU H 1 16 VAL MG2 1.800 . 5.500 4.556 4.527 4.595 . 0 0 "[ . 1 . 2]" 1
110 1 12 LEU H 1 12 LEU QD 1.800 . 5.000 2.257 1.887 2.782 . 0 0 "[ . 1 . 2]" 1
111 1 12 LEU H 1 12 LEU QB 1.800 . 3.600 2.337 2.163 2.636 . 0 0 "[ . 1 . 2]" 1
112 1 10 LEU H 1 12 LEU H 1.800 . 5.000 3.829 3.684 3.980 . 0 0 "[ . 1 . 2]" 1
113 1 8 GLU HA 1 12 LEU H 1.800 . 5.000 4.425 4.187 4.731 . 0 0 "[ . 1 . 2]" 1
114 1 9 ASP HA 1 13 GLN H 1.800 . 5.500 4.614 4.442 4.778 . 0 0 "[ . 1 . 2]" 1
115 1 10 LEU HA 1 13 GLN H 1.800 . 5.000 3.243 3.074 3.386 . 0 0 "[ . 1 . 2]" 1
116 1 12 LEU HA 1 13 GLN H 1.800 . 5.000 3.588 3.575 3.625 . 0 0 "[ . 1 . 2]" 1
117 1 12 LEU QD 1 13 GLN H 1.800 . 5.000 3.826 3.722 3.910 . 0 0 "[ . 1 . 2]" 1
118 1 12 LEU QB 1 13 GLN H 1.800 . 5.000 2.501 2.382 2.588 . 0 0 "[ . 1 . 2]" 1
119 1 13 GLN H 1 14 GLN H 1.800 . 4.200 2.823 2.794 2.873 . 0 0 "[ . 1 . 2]" 1
120 1 13 GLN H 1 13 GLN QB 1.800 . 3.600 2.266 2.231 2.281 . 0 0 "[ . 1 . 2]" 1
121 1 13 GLN H 1 47 ILE MG 1.800 . 5.500 4.477 4.435 4.550 . 0 0 "[ . 1 . 2]" 1
122 1 10 LEU HA 1 14 GLN H 1.800 . 5.000 4.740 4.588 4.865 . 0 0 "[ . 1 . 2]" 1
123 1 11 LYS HA 1 14 GLN H 1.800 . 5.000 3.425 3.269 3.800 . 0 0 "[ . 1 . 2]" 1
124 1 12 LEU QB 1 14 GLN H 1.800 . 5.000 4.562 4.501 4.622 . 0 0 "[ . 1 . 2]" 1
125 1 13 GLN HA 1 14 GLN H 1.800 . 3.800 3.550 3.532 3.569 . 0 0 "[ . 1 . 2]" 1
126 1 13 GLN QB 1 14 GLN H 1.800 . 5.000 2.712 2.540 3.564 . 0 0 "[ . 1 . 2]" 1
127 1 13 GLN QG 1 14 GLN H 1.800 . 5.000 3.657 2.106 4.365 . 0 0 "[ . 1 . 2]" 1
128 1 13 GLN QE 1 14 GLN H 1.800 . 5.000 4.124 3.591 4.447 . 0 0 "[ . 1 . 2]" 1
129 1 14 GLN H 1 16 VAL HB 1.800 . 5.500 5.046 4.723 5.158 . 0 0 "[ . 1 . 2]" 1
130 1 14 GLN H 1 14 GLN QB 1.800 . 3.600 2.522 2.382 2.565 . 0 0 "[ . 1 . 2]" 1
131 1 14 GLN H 1 14 GLN QG 1.800 . 5.000 2.178 2.031 3.350 . 0 0 "[ . 1 . 2]" 1
132 1 14 GLN QB 1 15 LEU H 1.800 . 5.000 2.186 2.095 2.346 . 0 0 "[ . 1 . 2]" 1
133 1 14 GLN QG 1 15 LEU H 1.800 . 6.000 3.820 3.739 4.357 . 0 0 "[ . 1 . 2]" 1
134 1 14 GLN HA 1 15 LEU H 1.800 . 5.000 3.598 3.592 3.604 . 0 0 "[ . 1 . 2]" 1
135 1 14 GLN H 1 15 LEU H 1.800 . 5.000 2.693 2.619 2.785 . 0 0 "[ . 1 . 2]" 1
136 1 15 LEU H 1 16 VAL HB 1.800 . 5.000 5.017 4.909 5.050 0.050 3 0 "[ . 1 . 2]" 1
137 1 15 LEU H 1 16 VAL H 1.800 . 5.000 2.817 2.788 2.863 . 0 0 "[ . 1 . 2]" 1
138 1 15 LEU H 1 16 VAL QG 1.800 . 6.000 4.032 3.989 4.092 . 0 0 "[ . 1 . 2]" 1
139 1 15 LEU H 1 15 LEU QB 1.800 . 5.000 2.392 2.205 2.591 . 0 0 "[ . 1 . 2]" 1
140 1 13 GLN HA 1 16 VAL H 1.800 . 5.500 4.435 4.214 4.530 . 0 0 "[ . 1 . 2]" 1
141 1 15 LEU HG 1 16 VAL H 1.800 . 5.500 4.513 3.953 4.961 . 0 0 "[ . 1 . 2]" 1
142 1 15 LEU QB 1 16 VAL H 1.800 . 5.500 2.340 2.193 2.504 . 0 0 "[ . 1 . 2]" 1
143 1 15 LEU HA 1 16 VAL H 1.800 . 5.500 3.558 3.546 3.572 . 0 0 "[ . 1 . 2]" 1
144 1 16 VAL H 1 17 MET H 1.800 . 3.600 2.755 2.726 2.817 . 0 0 "[ . 1 . 2]" 1
145 1 16 VAL H 1 17 MET QB 1.800 . 5.000 4.530 4.479 4.570 . 0 0 "[ . 1 . 2]" 1
146 1 12 LEU QB 1 16 VAL H 1.800 . 5.000 4.112 3.939 4.360 . 0 0 "[ . 1 . 2]" 1
147 1 16 VAL H 1 19 TYR QD 1.800 . 6.000 3.977 3.898 4.035 . 0 0 "[ . 1 . 2]" 1
148 1 16 VAL H 1 18 ARG H 1.800 . 5.000 4.115 4.066 4.240 . 0 0 "[ . 1 . 2]" 1
149 1 14 GLN HA 1 16 VAL H 1.800 . 5.500 4.845 4.691 4.936 . 0 0 "[ . 1 . 2]" 1
150 1 14 GLN H 1 16 VAL H 1.800 . 5.500 4.112 3.945 4.200 . 0 0 "[ . 1 . 2]" 1
151 1 16 VAL H 1 16 VAL HB 1.800 . 3.600 2.649 2.590 2.690 . 0 0 "[ . 1 . 2]" 1
152 1 16 VAL H 1 16 VAL QG 1.800 . 5.000 1.852 1.806 1.924 . 0 0 "[ . 1 . 2]" 1
153 1 16 VAL H 1 27 ILE MG 1.800 . 5.500 4.384 4.147 4.507 . 0 0 "[ . 1 . 2]" 1
154 1 16 VAL H 1 27 ILE MD 1.800 . 5.500 3.569 3.260 3.885 . 0 0 "[ . 1 . 2]" 1
155 1 14 GLN HA 1 17 MET H 1.800 . 5.000 3.490 3.408 3.570 . 0 0 "[ . 1 . 2]" 1
156 1 14 GLN QB 1 17 MET H 1.800 . 5.000 4.636 4.602 4.649 . 0 0 "[ . 1 . 2]" 1
157 1 16 VAL HA 1 17 MET H 1.800 . 5.000 3.563 3.545 3.587 . 0 0 "[ . 1 . 2]" 1
158 1 16 VAL HB 1 17 MET H 1.800 . 5.000 2.801 2.686 2.869 . 0 0 "[ . 1 . 2]" 1
159 1 16 VAL QG 1 17 MET H 1.800 . 5.500 3.368 3.307 3.404 . 0 0 "[ . 1 . 2]" 1
160 1 17 MET H 1 18 ARG H 1.800 . 3.600 2.568 2.489 2.696 . 0 0 "[ . 1 . 2]" 1
161 1 17 MET H 1 18 ARG QB 1.800 . 5.000 4.396 4.329 4.512 . 0 0 "[ . 1 . 2]" 1
162 1 17 MET H 1 17 MET QB 1.800 . 3.600 2.229 2.179 2.261 . 0 0 "[ . 1 . 2]" 1
163 1 17 MET H 1 17 MET QG 1.800 . 4.200 3.932 3.899 3.958 . 0 0 "[ . 1 . 2]" 1
164 1 14 GLN QB 1 18 ARG H 1.800 . 5.500 5.011 4.967 5.059 . 0 0 "[ . 1 . 2]" 1
165 1 15 LEU H 1 18 ARG H 1.800 . 5.000 4.770 4.671 4.893 . 0 0 "[ . 1 . 2]" 1
166 1 15 LEU HA 1 18 ARG H 1.800 . 5.000 3.280 3.172 3.395 . 0 0 "[ . 1 . 2]" 1
167 1 16 VAL HA 1 18 ARG H 1.800 . 5.000 4.056 3.971 4.177 . 0 0 "[ . 1 . 2]" 1
168 1 17 MET HA 1 18 ARG H 1.800 . 5.000 3.527 3.517 3.553 . 0 0 "[ . 1 . 2]" 1
169 1 17 MET QB 1 18 ARG H 1.800 . 4.200 2.804 2.576 2.897 . 0 0 "[ . 1 . 2]" 1
170 1 18 ARG H 1 19 TYR H 1.800 . 3.600 2.458 2.389 2.583 . 0 0 "[ . 1 . 2]" 1
171 1 18 ARG H 1 19 TYR QB 1.800 . 5.500 4.598 4.516 4.724 . 0 0 "[ . 1 . 2]" 1
172 1 18 ARG H 1 19 TYR QE 1.800 . 6.000 5.269 5.142 5.331 . 0 0 "[ . 1 . 2]" 1
173 1 18 ARG H 1 19 TYR QD 1.800 . 5.500 4.235 4.127 4.300 . 0 0 "[ . 1 . 2]" 1
174 1 18 ARG H 1 20 GLY H 1.800 . 5.000 3.674 3.541 3.809 . 0 0 "[ . 1 . 2]" 1
175 1 18 ARG H 1 18 ARG QG 1.800 . 5.000 4.008 3.989 4.087 . 0 0 "[ . 1 . 2]" 1
176 1 18 ARG H 1 18 ARG QB 1.800 . 3.600 2.297 2.259 2.311 . 0 0 "[ . 1 . 2]" 1
177 1 15 LEU HA 1 19 TYR H 1.800 . 5.000 4.403 4.044 4.743 . 0 0 "[ . 1 . 2]" 1
178 1 15 LEU QB 1 19 TYR H 1.800 . 5.500 4.754 4.478 4.959 . 0 0 "[ . 1 . 2]" 1
179 1 16 VAL HA 1 19 TYR H 1.800 . 5.000 3.069 2.966 3.181 . 0 0 "[ . 1 . 2]" 1
180 1 16 VAL QG 1 19 TYR H 1.800 . 6.000 4.045 3.901 4.180 . 0 0 "[ . 1 . 2]" 1
181 1 17 MET H 1 19 TYR H 1.800 . 5.000 3.994 3.898 4.134 . 0 0 "[ . 1 . 2]" 1
182 1 17 MET HA 1 19 TYR H 1.800 . 5.000 4.273 4.041 4.503 . 0 0 "[ . 1 . 2]" 1
183 1 17 MET QB 1 19 TYR H 1.800 . 5.500 4.760 4.536 4.872 . 0 0 "[ . 1 . 2]" 1
184 1 18 ARG HA 1 19 TYR H 1.800 . 3.800 3.522 3.491 3.552 . 0 0 "[ . 1 . 2]" 1
185 1 18 ARG QB 1 19 TYR H 1.800 . 3.800 2.771 2.628 2.867 . 0 0 "[ . 1 . 2]" 1
186 1 18 ARG QG 1 19 TYR H 1.800 . 5.000 3.903 3.718 4.056 . 0 0 "[ . 1 . 2]" 1
187 1 19 TYR H 1 20 GLY QA 1.800 . 5.000 4.241 4.193 4.312 . 0 0 "[ . 1 . 2]" 1
188 1 19 TYR H 1 20 GLY H 1.800 . 3.600 2.235 2.142 2.364 . 0 0 "[ . 1 . 2]" 1
189 1 19 TYR H 1 19 TYR QB 1.800 . 3.600 2.470 2.436 2.491 . 0 0 "[ . 1 . 2]" 1
190 1 19 TYR H 1 19 TYR QD 1.800 . 3.600 2.916 2.763 3.019 . 0 0 "[ . 1 . 2]" 1
191 1 19 TYR H 1 19 TYR QE 1.800 . 5.000 4.560 4.394 4.657 . 0 0 "[ . 1 . 2]" 1
192 1 16 VAL HA 1 20 GLY H 1.800 . 5.000 3.861 3.616 4.125 . 0 0 "[ . 1 . 2]" 1
193 1 16 VAL MG1 1 20 GLY H 1.800 . 5.500 3.838 3.758 3.953 . 0 0 "[ . 1 . 2]" 1
194 1 17 MET HA 1 20 GLY H 1.800 . 5.000 3.344 3.132 3.496 . 0 0 "[ . 1 . 2]" 1
195 1 18 ARG HA 1 20 GLY H 1.800 . 5.000 4.032 3.893 4.129 . 0 0 "[ . 1 . 2]" 1
196 1 18 ARG QB 1 20 GLY H 1.800 . 5.500 4.500 4.399 4.584 . 0 0 "[ . 1 . 2]" 1
197 1 19 TYR HA 1 20 GLY H 1.800 . 3.600 3.349 3.293 3.397 . 0 0 "[ . 1 . 2]" 1
198 1 19 TYR QD 1 20 GLY H 1.800 . 6.000 4.556 4.476 4.610 . 0 0 "[ . 1 . 2]" 1
199 1 19 TYR QB 1 20 GLY H 1.800 . 5.000 3.239 3.128 3.356 . 0 0 "[ . 1 . 2]" 1
200 1 20 GLY H 1 21 ALA H 1.800 . 3.600 3.710 3.686 3.734 0.134 10 0 "[ . 1 . 2]" 1
201 1 16 VAL MG1 1 21 ALA H 1.800 . 5.500 3.812 3.613 3.900 . 0 0 "[ . 1 . 2]" 1
202 1 19 TYR H 1 21 ALA H 1.800 . 5.000 5.047 5.020 5.083 0.083 10 0 "[ . 1 . 2]" 1
203 1 20 GLY QA 1 21 ALA H 1.800 . 3.600 2.421 2.380 2.436 . 0 0 "[ . 1 . 2]" 1
204 1 21 ALA H 1 22 LYS H 1.800 . 3.600 2.077 1.794 2.138 0.006 10 0 "[ . 1 . 2]" 1
205 1 21 ALA H 1 22 LYS QB 1.800 . 5.000 3.834 3.558 4.145 . 0 0 "[ . 1 . 2]" 1
206 1 21 ALA H 1 22 LYS QG 1.800 . 5.000 2.722 2.435 3.443 . 0 0 "[ . 1 . 2]" 1
207 1 21 ALA H 1 21 ALA MB 1.800 . 3.600 3.068 3.041 3.098 . 0 0 "[ . 1 . 2]" 1
208 1 21 ALA MB 1 22 LYS H 1.800 . 5.000 3.744 3.688 3.753 . 0 0 "[ . 1 . 2]" 1
209 1 21 ALA HA 1 22 LYS H 1.800 . 3.600 2.742 2.701 2.919 . 0 0 "[ . 1 . 2]" 1
210 1 20 GLY QA 1 22 LYS H 1.800 . 5.000 4.295 3.911 4.371 . 0 0 "[ . 1 . 2]" 1
211 1 22 LYS H 1 23 ASP HA 1.800 . 5.000 4.572 4.558 4.584 . 0 0 "[ . 1 . 2]" 1
212 1 22 LYS H 1 23 ASP QB 1.800 . 5.000 4.069 3.714 4.157 . 0 0 "[ . 1 . 2]" 1
213 1 22 LYS H 1 23 ASP H 1.800 . 2.800 1.729 1.716 1.749 0.084 5 0 "[ . 1 . 2]" 1
214 1 22 LYS H 1 24 TRP H 1.800 . 5.500 4.187 4.068 4.338 . 0 0 "[ . 1 . 2]" 1
215 1 22 LYS H 1 24 TRP HE1 1.800 . 5.500 3.889 3.422 4.074 . 0 0 "[ . 1 . 2]" 1
216 1 22 LYS H 1 22 LYS QB 1.800 . 3.600 3.155 2.791 3.245 . 0 0 "[ . 1 . 2]" 1
217 1 22 LYS H 1 22 LYS QG 1.800 . 3.600 2.381 2.211 3.186 . 0 0 "[ . 1 . 2]" 1
218 1 16 VAL MG1 1 22 LYS H 1.800 . 6.000 4.270 3.921 4.506 . 0 0 "[ . 1 . 2]" 1
219 1 22 LYS H 1 27 ILE MD 1.800 . 5.500 4.320 4.112 4.455 . 0 0 "[ . 1 . 2]" 1
220 1 21 ALA HA 1 23 ASP H 1.800 . 5.000 4.046 3.964 4.184 . 0 0 "[ . 1 . 2]" 1
221 1 22 LYS HA 1 23 ASP H 1.800 . 3.600 3.419 3.353 3.491 . 0 0 "[ . 1 . 2]" 1
222 1 22 LYS QB 1 23 ASP H 1.800 . 5.000 3.733 3.034 3.865 . 0 0 "[ . 1 . 2]" 1
223 1 22 LYS QG 1 23 ASP H 1.800 . 5.000 2.870 2.551 4.330 . 0 0 "[ . 1 . 2]" 1
224 1 23 ASP H 1 24 TRP H 1.800 . 3.000 3.074 3.053 3.137 0.137 15 0 "[ . 1 . 2]" 1
225 1 23 ASP H 1 24 TRP HE1 1.800 . 5.000 4.597 4.364 4.840 . 0 0 "[ . 1 . 2]" 1
226 1 23 ASP H 1 24 TRP HZ2 1.800 . 6.000 6.029 6.015 6.048 0.048 14 0 "[ . 1 . 2]" 1
227 1 23 ASP H 1 25 ILE H 1.800 . 5.500 5.048 4.906 5.238 . 0 0 "[ . 1 . 2]" 1
228 1 23 ASP H 1 27 ILE MD 1.800 . 5.000 3.885 3.591 4.000 . 0 0 "[ . 1 . 2]" 1
229 1 23 ASP H 1 23 ASP QB 1.800 . 3.600 2.655 2.439 2.738 . 0 0 "[ . 1 . 2]" 1
230 1 22 LYS HA 1 24 TRP H 1.800 . 5.000 3.749 3.602 3.814 . 0 0 "[ . 1 . 2]" 1
231 1 24 TRP H 1 27 ILE MD 1.800 . 6.000 4.169 4.017 4.229 . 0 0 "[ . 1 . 2]" 1
232 1 24 TRP H 1 25 ILE HA 1.800 . 5.500 5.241 5.179 5.296 . 0 0 "[ . 1 . 2]" 1
233 1 24 TRP H 1 25 ILE QG 1.800 . 5.500 3.587 3.495 3.710 . 0 0 "[ . 1 . 2]" 1
234 1 24 TRP H 1 25 ILE MG 1.800 . 5.500 4.272 4.134 4.341 . 0 0 "[ . 1 . 2]" 1
235 1 23 ASP HA 1 24 TRP H 1.800 . 3.600 2.734 2.719 2.753 . 0 0 "[ . 1 . 2]" 1
236 1 23 ASP QB 1 24 TRP H 1.800 . 5.000 3.899 3.888 3.936 . 0 0 "[ . 1 . 2]" 1
237 1 24 TRP H 1 25 ILE H 1.800 . 3.600 2.651 2.574 2.692 . 0 0 "[ . 1 . 2]" 1
238 1 24 TRP H 1 26 ARG H 1.800 . 5.000 4.284 4.022 4.516 . 0 0 "[ . 1 . 2]" 1
239 1 24 TRP H 1 24 TRP QB 1.800 . 3.600 2.488 2.439 2.536 . 0 0 "[ . 1 . 2]" 1
240 1 24 TRP H 1 24 TRP HD1 1.800 . 3.600 2.348 2.164 2.577 . 0 0 "[ . 1 . 2]" 1
241 1 24 TRP H 1 24 TRP HE3 1.800 . 5.000 4.934 4.803 5.053 0.053 18 0 "[ . 1 . 2]" 1
242 1 24 TRP H 1 24 TRP HE1 1.800 . 5.000 4.248 4.141 4.346 . 0 0 "[ . 1 . 2]" 1
243 1 22 LYS QB 1 24 TRP HE1 1.800 . 5.000 4.515 4.473 4.597 . 0 0 "[ . 1 . 2]" 1
244 1 21 ALA HA 1 24 TRP HE1 1.800 . 5.000 3.299 2.895 3.505 . 0 0 "[ . 1 . 2]" 1
245 1 21 ALA MB 1 24 TRP HE1 1.800 . 4.200 3.206 2.941 3.340 . 0 0 "[ . 1 . 2]" 1
246 1 24 TRP HE1 1 40 ARG HA 1.800 . 5.000 4.517 4.215 4.781 . 0 0 "[ . 1 . 2]" 1
247 1 24 TRP HE1 1 40 ARG QB 1.800 . 5.000 4.058 3.561 4.182 . 0 0 "[ . 1 . 2]" 1
248 1 24 TRP HE1 1 40 ARG QG 1.800 . 5.000 4.107 2.659 4.427 . 0 0 "[ . 1 . 2]" 1
249 1 24 TRP HE1 1 40 ARG QD 1.800 . 3.400 2.576 2.405 2.697 . 0 0 "[ . 1 . 2]" 1
250 1 24 TRP QB 1 25 ILE H 1.800 . 5.000 3.041 2.793 3.208 . 0 0 "[ . 1 . 2]" 1
251 1 24 TRP HD1 1 25 ILE H 1.800 . 5.000 4.551 4.335 4.758 . 0 0 "[ . 1 . 2]" 1
252 1 24 TRP HE3 1 25 ILE H 1.800 . 6.000 5.959 5.786 6.064 0.064 15 0 "[ . 1 . 2]" 1
253 1 23 ASP HA 1 25 ILE H 1.800 . 5.000 3.078 2.930 3.302 . 0 0 "[ . 1 . 2]" 1
254 1 23 ASP QB 1 25 ILE H 1.800 . 5.000 4.052 3.817 4.340 . 0 0 "[ . 1 . 2]" 1
255 1 24 TRP HA 1 25 ILE H 1.800 . 5.000 3.430 3.369 3.508 . 0 0 "[ . 1 . 2]" 1
256 1 25 ILE H 1 26 ARG H 1.800 . 3.600 2.473 2.410 2.558 . 0 0 "[ . 1 . 2]" 1
257 1 25 ILE H 1 26 ARG HA 1.800 . 5.000 5.164 5.121 5.220 0.220 20 0 "[ . 1 . 2]" 1
258 1 25 ILE H 1 26 ARG QB 1.800 . 5.500 4.343 4.200 4.527 . 0 0 "[ . 1 . 2]" 1
259 1 25 ILE H 1 36 PRO QG 1.800 . 5.000 4.344 4.258 4.489 . 0 0 "[ . 1 . 2]" 1
260 1 25 ILE H 1 36 PRO QB 1.800 . 5.000 3.736 3.240 4.092 . 0 0 "[ . 1 . 2]" 1
261 1 25 ILE H 1 25 ILE MG 1.800 . 4.200 2.518 2.404 2.621 . 0 0 "[ . 1 . 2]" 1
262 1 25 ILE H 1 25 ILE QG 1.800 . 3.600 1.773 1.765 1.783 0.035 12 0 "[ . 1 . 2]" 1
263 1 25 ILE H 1 25 ILE MD 1.800 . 5.000 3.545 3.534 3.550 . 0 0 "[ . 1 . 2]" 1
264 1 25 ILE H 1 25 ILE HB 1.800 . 3.600 3.586 3.578 3.608 0.008 6 0 "[ . 1 . 2]" 1
265 1 23 ASP HA 1 26 ARG H 1.800 . 5.000 3.714 3.474 3.922 . 0 0 "[ . 1 . 2]" 1
266 1 23 ASP QB 1 26 ARG H 1.800 . 5.500 3.231 3.082 3.869 . 0 0 "[ . 1 . 2]" 1
267 1 24 TRP HA 1 26 ARG H 1.800 . 5.000 3.948 3.775 4.121 . 0 0 "[ . 1 . 2]" 1
268 1 25 ILE HA 1 26 ARG H 1.800 . 5.000 3.509 3.471 3.548 . 0 0 "[ . 1 . 2]" 1
269 1 25 ILE HB 1 26 ARG H 1.800 . 3.600 3.646 3.515 3.712 0.112 19 0 "[ . 1 . 2]" 1
270 1 25 ILE QG 1 26 ARG H 1.800 . 5.000 2.003 1.874 2.079 . 0 0 "[ . 1 . 2]" 1
271 1 25 ILE MG 1 26 ARG H 1.800 . 5.000 4.060 4.020 4.080 . 0 0 "[ . 1 . 2]" 1
272 1 26 ARG H 1 27 ILE MD 1.800 . 6.000 4.932 4.891 4.967 . 0 0 "[ . 1 . 2]" 1
273 1 26 ARG H 1 27 ILE HA 1.800 . 5.000 5.153 5.131 5.202 0.202 17 0 "[ . 1 . 2]" 1
274 1 26 ARG H 1 27 ILE HB 1.800 . 5.500 4.658 4.559 4.744 . 0 0 "[ . 1 . 2]" 1
275 1 26 ARG H 1 27 ILE H 1.800 . 2.800 2.509 2.475 2.583 . 0 0 "[ . 1 . 2]" 1
276 1 26 ARG H 1 28 SER H 1.800 . 5.000 3.753 3.646 3.874 . 0 0 "[ . 1 . 2]" 1
277 1 26 ARG H 1 29 GLN H 1.800 . 5.000 4.580 4.457 4.698 . 0 0 "[ . 1 . 2]" 1
278 1 26 ARG H 1 26 ARG QB 1.800 . 3.600 2.281 2.116 2.339 . 0 0 "[ . 1 . 2]" 1
279 1 19 TYR QD 1 27 ILE H 1.800 . 5.000 4.832 4.728 4.916 . 0 0 "[ . 1 . 2]" 1
280 1 19 TYR QE 1 27 ILE H 1.800 . 5.500 4.833 4.619 5.231 . 0 0 "[ . 1 . 2]" 1
281 1 23 ASP H 1 27 ILE H 1.800 . 6.000 5.647 5.383 5.814 . 0 0 "[ . 1 . 2]" 1
282 1 23 ASP QB 1 27 ILE H 1.800 . 5.500 3.770 3.498 4.166 . 0 0 "[ . 1 . 2]" 1
283 1 24 TRP H 1 27 ILE H 1.800 . 5.500 4.934 4.745 5.044 . 0 0 "[ . 1 . 2]" 1
284 1 24 TRP HA 1 27 ILE H 1.800 . 3.600 3.163 3.068 3.251 . 0 0 "[ . 1 . 2]" 1
285 1 25 ILE HA 1 27 ILE H 1.800 . 5.000 4.816 4.722 4.935 . 0 0 "[ . 1 . 2]" 1
286 1 25 ILE H 1 27 ILE H 1.800 . 5.000 4.134 3.974 4.312 . 0 0 "[ . 1 . 2]" 1
287 1 26 ARG QB 1 27 ILE H 1.800 . 3.600 2.357 2.222 2.638 . 0 0 "[ . 1 . 2]" 1
288 1 26 ARG QD 1 27 ILE H 1.800 . 5.000 4.270 3.443 4.562 . 0 0 "[ . 1 . 2]" 1
289 1 26 ARG HA 1 27 ILE H 1.800 . 5.000 3.562 3.551 3.576 . 0 0 "[ . 1 . 2]" 1
290 1 27 ILE H 1 28 SER H 1.800 . 2.800 2.726 2.674 2.753 . 0 0 "[ . 1 . 2]" 1
291 1 27 ILE H 1 28 SER QB 1.800 . 5.500 4.717 4.675 4.758 . 0 0 "[ . 1 . 2]" 1
292 1 27 ILE H 1 27 ILE MD 1.800 . 5.000 3.420 3.368 3.471 . 0 0 "[ . 1 . 2]" 1
293 1 27 ILE H 1 27 ILE MG 1.800 . 5.000 3.766 3.755 3.772 . 0 0 "[ . 1 . 2]" 1
294 1 27 ILE H 1 27 ILE QG 1.800 . 5.000 1.882 1.799 1.926 0.001 10 0 "[ . 1 . 2]" 1
295 1 27 ILE H 1 27 ILE HB 1.800 . 3.600 2.615 2.564 2.703 . 0 0 "[ . 1 . 2]" 1
296 1 24 TRP QB 1 28 SER H 1.800 . 5.000 4.416 4.335 4.466 . 0 0 "[ . 1 . 2]" 1
297 1 24 TRP HA 1 28 SER H 1.800 . 5.000 3.762 3.649 3.886 . 0 0 "[ . 1 . 2]" 1
298 1 25 ILE HA 1 28 SER H 1.800 . 5.000 3.648 3.557 3.722 . 0 0 "[ . 1 . 2]" 1
299 1 25 ILE HB 1 28 SER H 1.800 . 5.500 5.498 5.390 5.550 0.050 4 0 "[ . 1 . 2]" 1
300 1 26 ARG HA 1 28 SER H 1.800 . 5.000 4.115 4.008 4.182 . 0 0 "[ . 1 . 2]" 1
301 1 26 ARG QB 1 28 SER H 1.800 . 5.000 4.457 4.364 4.545 . 0 0 "[ . 1 . 2]" 1
302 1 27 ILE MG 1 28 SER H 1.800 . 5.000 3.636 3.569 3.770 . 0 0 "[ . 1 . 2]" 1
303 1 27 ILE QG 1 28 SER H 1.800 . 5.000 3.956 3.825 4.001 . 0 0 "[ . 1 . 2]" 1
304 1 27 ILE MD 1 28 SER H 1.800 . 5.500 4.519 4.493 4.560 . 0 0 "[ . 1 . 2]" 1
305 1 27 ILE HA 1 28 SER H 1.800 . 5.000 3.519 3.500 3.536 . 0 0 "[ . 1 . 2]" 1
306 1 27 ILE HB 1 28 SER H 1.800 . 3.600 2.732 2.690 2.785 . 0 0 "[ . 1 . 2]" 1
307 1 28 SER H 1 29 GLN H 1.800 . 3.600 2.507 2.476 2.545 . 0 0 "[ . 1 . 2]" 1
308 1 28 SER H 1 29 GLN QG 1.800 . 5.000 4.412 4.318 4.603 . 0 0 "[ . 1 . 2]" 1
309 1 28 SER H 1 29 GLN QB 1.800 . 5.500 4.473 4.388 4.587 . 0 0 "[ . 1 . 2]" 1
310 1 28 SER H 1 28 SER QB 1.800 . 3.600 2.342 2.298 2.381 . 0 0 "[ . 1 . 2]" 1
311 1 28 SER H 1 28 SER HG 1.800 . 4.200 3.718 3.480 3.892 . 0 0 "[ . 1 . 2]" 1
312 1 25 ILE HA 1 29 GLN H 1.800 . 5.000 4.438 4.325 4.613 . 0 0 "[ . 1 . 2]" 1
313 1 26 ARG HA 1 29 GLN H 1.800 . 5.000 3.175 3.077 3.252 . 0 0 "[ . 1 . 2]" 1
314 1 27 ILE QG 1 29 GLN H 1.800 . 6.000 5.375 5.287 5.411 . 0 0 "[ . 1 . 2]" 1
315 1 27 ILE MG 1 29 GLN H 1.800 . 6.000 4.975 4.953 5.016 . 0 0 "[ . 1 . 2]" 1
316 1 27 ILE HA 1 29 GLN H 1.800 . 5.000 4.192 4.126 4.225 . 0 0 "[ . 1 . 2]" 1
317 1 27 ILE HB 1 29 GLN H 1.800 . 5.000 4.964 4.925 5.005 0.005 8 0 "[ . 1 . 2]" 1
318 1 27 ILE H 1 29 GLN H 1.800 . 5.000 4.098 4.042 4.144 . 0 0 "[ . 1 . 2]" 1
319 1 28 SER HA 1 29 GLN H 1.800 . 5.000 3.518 3.506 3.537 . 0 0 "[ . 1 . 2]" 1
320 1 28 SER QB 1 29 GLN H 1.800 . 5.000 2.836 2.805 2.901 . 0 0 "[ . 1 . 2]" 1
321 1 29 GLN H 1 30 LEU H 1.800 . 2.800 2.657 2.557 2.709 . 0 0 "[ . 1 . 2]" 1
322 1 29 GLN H 1 30 LEU HA 1.800 . 5.500 5.325 5.247 5.364 . 0 0 "[ . 1 . 2]" 1
323 1 29 GLN H 1 30 LEU HG 1.800 . 5.000 3.881 3.779 4.070 . 0 0 "[ . 1 . 2]" 1
324 1 29 GLN H 1 31 MET H 1.800 . 5.000 4.141 3.974 4.306 . 0 0 "[ . 1 . 2]" 1
325 1 29 GLN H 1 29 GLN QB 1.800 . 3.600 2.324 2.266 2.417 . 0 0 "[ . 1 . 2]" 1
326 1 29 GLN H 1 29 GLN QG 1.800 . 3.600 2.556 2.407 2.777 . 0 0 "[ . 1 . 2]" 1
327 1 27 ILE HA 1 30 LEU H 1.800 . 5.000 3.630 3.553 3.705 . 0 0 "[ . 1 . 2]" 1
328 1 26 ARG HA 1 30 LEU H 1.800 . 5.000 4.580 4.426 4.706 . 0 0 "[ . 1 . 2]" 1
329 1 28 SER HA 1 30 LEU H 1.800 . 5.000 4.201 3.947 4.367 . 0 0 "[ . 1 . 2]" 1
330 1 29 GLN HA 1 30 LEU H 1.800 . 3.600 3.545 3.488 3.564 . 0 0 "[ . 1 . 2]" 1
331 1 29 GLN QB 1 30 LEU H 1.800 . 4.200 2.695 2.517 3.561 . 0 0 "[ . 1 . 2]" 1
332 1 29 GLN QG 1 30 LEU H 1.800 . 5.000 4.142 2.239 4.291 . 0 0 "[ . 1 . 2]" 1
333 1 30 LEU H 1 31 MET H 1.800 . 3.600 2.594 2.385 2.768 . 0 0 "[ . 1 . 2]" 1
334 1 30 LEU H 1 30 LEU QB 1.800 . 3.600 2.673 2.581 2.705 . 0 0 "[ . 1 . 2]" 1
335 1 30 LEU H 1 30 LEU HG 1.800 . 5.000 1.834 1.800 1.944 . 0 0 "[ . 1 . 2]" 1
336 1 30 LEU H 1 30 LEU QD 1.800 . 5.000 2.593 2.457 2.934 . 0 0 "[ . 1 . 2]" 1
337 1 27 ILE HA 1 31 MET H 1.800 . 5.000 4.540 4.151 4.686 . 0 0 "[ . 1 . 2]" 1
338 1 28 SER HA 1 31 MET H 1.800 . 5.000 3.208 3.045 3.323 . 0 0 "[ . 1 . 2]" 1
339 1 29 GLN HA 1 31 MET H 1.800 . 5.000 4.533 4.290 4.685 . 0 0 "[ . 1 . 2]" 1
340 1 30 LEU HA 1 31 MET H 1.800 . 5.000 3.548 3.522 3.568 . 0 0 "[ . 1 . 2]" 1
341 1 30 LEU QB 1 31 MET H 1.800 . 5.000 2.446 2.229 2.610 . 0 0 "[ . 1 . 2]" 1
342 1 30 LEU HG 1 31 MET H 1.800 . 5.000 3.728 3.673 3.964 . 0 0 "[ . 1 . 2]" 1
343 1 30 LEU QD 1 31 MET H 1.800 . 5.000 3.863 3.804 3.888 . 0 0 "[ . 1 . 2]" 1
344 1 31 MET H 1 32 ILE H 1.800 . 3.600 3.406 3.188 3.554 . 0 0 "[ . 1 . 2]" 1
345 1 31 MET H 1 32 ILE HA 1.800 . 5.000 4.521 4.414 4.644 . 0 0 "[ . 1 . 2]" 1
346 1 31 MET H 1 31 MET QG 1.800 . 4.200 2.809 2.523 3.069 . 0 0 "[ . 1 . 2]" 1
347 1 28 SER HA 1 32 ILE H 1.800 . 5.000 4.914 4.567 5.037 0.037 16 0 "[ . 1 . 2]" 1
348 1 29 GLN HA 1 32 ILE H 1.800 . 5.000 4.252 3.966 4.710 . 0 0 "[ . 1 . 2]" 1
349 1 30 LEU H 1 32 ILE H 1.800 . 5.000 4.872 4.628 5.017 0.017 2 0 "[ . 1 . 2]" 1
350 1 31 MET HA 1 32 ILE H 1.800 . 3.600 2.558 2.478 2.653 . 0 0 "[ . 1 . 2]" 1
351 1 31 MET QB 1 32 ILE H 1.800 . 5.000 3.913 3.901 3.921 . 0 0 "[ . 1 . 2]" 1
352 1 31 MET QG 1 32 ILE H 1.800 . 5.500 4.569 4.434 4.767 . 0 0 "[ . 1 . 2]" 1
353 1 32 ILE H 1 33 THR H 1.800 . 5.000 2.775 2.640 2.849 . 0 0 "[ . 1 . 2]" 1
354 1 32 ILE H 1 32 ILE HA 1.800 . 3.000 2.820 2.783 2.858 . 0 0 "[ . 1 . 2]" 1
355 1 32 ILE H 1 32 ILE MD 1.800 . 4.200 3.227 1.691 3.575 0.109 18 0 "[ . 1 . 2]" 1
356 1 32 ILE H 1 32 ILE HB 1.800 . 4.200 3.550 2.930 3.634 . 0 0 "[ . 1 . 2]" 1
357 1 32 ILE H 1 32 ILE QG 1.800 . 4.200 1.877 1.778 2.178 0.022 7 0 "[ . 1 . 2]" 1
358 1 32 ILE H 1 34 ARG H 1.800 . 5.000 4.530 4.356 4.648 . 0 0 "[ . 1 . 2]" 1
359 1 31 MET H 1 33 THR H 1.800 . 5.000 4.881 4.803 5.011 0.011 2 0 "[ . 1 . 2]" 1
360 1 31 MET HA 1 33 THR H 1.800 . 5.000 2.980 2.900 3.046 . 0 0 "[ . 1 . 2]" 1
361 1 31 MET QB 1 33 THR H 1.800 . 5.500 3.241 3.043 3.420 . 0 0 "[ . 1 . 2]" 1
362 1 31 MET QG 1 33 THR H 1.800 . 6.000 4.735 4.434 5.051 . 0 0 "[ . 1 . 2]" 1
363 1 32 ILE HA 1 33 THR H 1.800 . 5.000 3.370 3.287 3.428 . 0 0 "[ . 1 . 2]" 1
364 1 32 ILE HB 1 33 THR H 1.800 . 5.000 4.017 3.441 4.221 . 0 0 "[ . 1 . 2]" 1
365 1 32 ILE QG 1 33 THR H 1.800 . 5.000 2.932 2.504 4.360 . 0 0 "[ . 1 . 2]" 1
366 1 32 ILE MD 1 33 THR H 1.800 . 5.000 3.703 2.391 4.278 . 0 0 "[ . 1 . 2]" 1
367 1 33 THR H 1 34 ARG H 1.800 . 2.800 2.767 2.607 2.870 0.070 4 0 "[ . 1 . 2]" 1
368 1 33 THR H 1 33 THR MG 1.800 . 5.000 2.623 1.785 3.779 0.015 7 0 "[ . 1 . 2]" 1
369 1 28 SER QB 1 34 ARG H 1.800 . 5.500 4.623 4.576 4.670 . 0 0 "[ . 1 . 2]" 1
370 1 28 SER HG 1 34 ARG H 1.800 . 5.000 4.827 4.676 5.003 0.003 10 0 "[ . 1 . 2]" 1
371 1 31 MET HA 1 34 ARG H 1.800 . 5.000 4.952 4.472 5.104 0.104 15 0 "[ . 1 . 2]" 1
372 1 31 MET QB 1 34 ARG H 1.800 . 5.000 3.803 3.270 3.970 . 0 0 "[ . 1 . 2]" 1
373 1 32 ILE HB 1 34 ARG H 1.800 . 5.000 4.662 4.532 5.021 0.021 11 0 "[ . 1 . 2]" 1
374 1 33 THR HA 1 34 ARG H 1.800 . 3.600 3.364 3.221 3.478 . 0 0 "[ . 1 . 2]" 1
375 1 33 THR MG 1 34 ARG H 1.800 . 5.000 3.902 2.894 4.184 . 0 0 "[ . 1 . 2]" 1
376 1 33 THR HB 1 34 ARG H 1.800 . 5.000 3.938 3.221 4.505 . 0 0 "[ . 1 . 2]" 1
377 1 34 ARG H 1 35 ASN H 1.800 . 5.000 4.422 4.234 4.514 . 0 0 "[ . 1 . 2]" 1
378 1 34 ARG H 1 34 ARG QB 1.800 . 3.600 2.974 2.367 3.308 . 0 0 "[ . 1 . 2]" 1
379 1 34 ARG H 1 34 ARG QG 1.800 . 5.000 3.069 2.187 4.418 . 0 0 "[ . 1 . 2]" 1
380 1 34 ARG H 1 34 ARG QD 1.800 . 5.000 3.340 1.820 4.496 . 0 0 "[ . 1 . 2]" 1
381 1 28 SER HG 1 35 ASN H 1.800 . 5.000 4.802 4.530 5.004 0.004 8 0 "[ . 1 . 2]" 1
382 1 34 ARG QB 1 35 ASN H 1.800 . 5.000 2.766 2.238 3.225 . 0 0 "[ . 1 . 2]" 1
383 1 34 ARG HA 1 35 ASN H 1.800 . 2.800 2.377 2.210 2.522 . 0 0 "[ . 1 . 2]" 1
384 1 34 ARG QG 1 35 ASN H 1.800 . 5.000 3.281 1.813 3.827 . 0 0 "[ . 1 . 2]" 1
385 1 35 ASN H 1 36 PRO QD 1.800 . 5.000 4.484 4.421 4.504 . 0 0 "[ . 1 . 2]" 1
386 1 35 ASN H 1 38 GLN H 1.800 . 5.000 3.668 3.326 4.264 . 0 0 "[ . 1 . 2]" 1
387 1 35 ASN H 1 38 GLN QB 1.800 . 5.000 2.524 2.085 2.916 . 0 0 "[ . 1 . 2]" 1
388 1 35 ASN H 1 38 GLN QG 1.800 . 5.000 2.245 1.806 3.531 . 0 0 "[ . 1 . 2]" 1
389 1 35 ASN H 1 38 GLN QE 1.800 . 5.000 3.912 2.375 4.268 . 0 0 "[ . 1 . 2]" 1
390 1 35 ASN H 1 39 CYS H 1.800 . 5.000 4.804 4.469 5.005 0.005 12 0 "[ . 1 . 2]" 1
391 1 35 ASN H 1 35 ASN QB 1.800 . 3.600 2.509 2.121 2.793 . 0 0 "[ . 1 . 2]" 1
392 1 24 TRP HA 1 36 PRO HA 1.800 . 5.500 4.307 4.140 4.461 . 0 0 "[ . 1 . 2]" 1
393 1 24 TRP QB 1 36 PRO HA 1.800 . 5.000 2.406 2.308 2.604 . 0 0 "[ . 1 . 2]" 1
394 1 25 ILE HA 1 36 PRO HA 1.800 . 5.000 4.595 4.382 4.724 . 0 0 "[ . 1 . 2]" 1
395 1 28 SER H 1 36 PRO HA 1.800 . 5.000 4.497 4.330 4.711 . 0 0 "[ . 1 . 2]" 1
396 1 28 SER QB 1 36 PRO HA 1.800 . 4.000 3.667 3.624 3.734 . 0 0 "[ . 1 . 2]" 1
397 1 28 SER HG 1 36 PRO HA 1.800 . 5.500 2.559 2.324 2.794 . 0 0 "[ . 1 . 2]" 1
398 1 35 ASN HA 1 36 PRO HA 1.800 . 5.000 4.432 4.379 4.462 . 0 0 "[ . 1 . 2]" 1
399 1 36 PRO HA 1 37 ARG H 1.800 . 5.000 3.545 3.506 3.592 . 0 0 "[ . 1 . 2]" 1
400 1 36 PRO HA 1 38 GLN H 1.800 . 5.000 4.157 4.022 4.289 . 0 0 "[ . 1 . 2]" 1
401 1 36 PRO HA 1 39 CYS H 1.800 . 5.000 3.716 3.436 4.036 . 0 0 "[ . 1 . 2]" 1
402 1 36 PRO HA 1 39 CYS QB 1.800 . 5.000 3.860 3.152 4.563 . 0 0 "[ . 1 . 2]" 1
403 1 35 ASN HA 1 37 ARG H 1.800 . 5.000 4.326 4.133 4.853 . 0 0 "[ . 1 . 2]" 1
404 1 35 ASN QB 1 37 ARG H 1.800 . 5.000 2.796 2.508 3.151 . 0 0 "[ . 1 . 2]" 1
405 1 36 PRO QB 1 37 ARG H 1.800 . 5.000 2.690 2.412 3.214 . 0 0 "[ . 1 . 2]" 1
406 1 36 PRO QG 1 37 ARG H 1.800 . 5.000 3.379 2.120 3.922 . 0 0 "[ . 1 . 2]" 1
407 1 36 PRO QD 1 37 ARG H 1.800 . 3.600 3.019 2.312 3.106 . 0 0 "[ . 1 . 2]" 1
408 1 37 ARG H 1 38 GLN QG 1.800 . 5.000 4.137 3.922 4.240 . 0 0 "[ . 1 . 2]" 1
409 1 37 ARG H 1 38 GLN H 1.800 . 3.600 2.598 2.502 2.760 . 0 0 "[ . 1 . 2]" 1
410 1 37 ARG H 1 39 CYS H 1.800 . 5.000 4.481 4.269 4.696 . 0 0 "[ . 1 . 2]" 1
411 1 37 ARG H 1 40 ARG H 1.800 . 5.000 4.782 4.689 4.841 . 0 0 "[ . 1 . 2]" 1
412 1 37 ARG H 1 40 ARG QB 1.800 . 5.000 4.513 4.388 4.572 . 0 0 "[ . 1 . 2]" 1
413 1 37 ARG H 1 37 ARG QB 1.800 . 3.000 2.454 2.231 2.635 . 0 0 "[ . 1 . 2]" 1
414 1 37 ARG H 1 37 ARG QG 1.800 . 4.200 2.258 1.777 3.938 0.023 14 0 "[ . 1 . 2]" 1
415 1 28 SER HG 1 38 GLN H 1.800 . 5.500 5.110 4.910 5.301 . 0 0 "[ . 1 . 2]" 1
416 1 34 ARG QG 1 38 GLN H 1.800 . 5.500 4.648 3.940 5.062 . 0 0 "[ . 1 . 2]" 1
417 1 35 ASN HA 1 38 GLN H 1.800 . 5.000 4.478 4.367 4.738 . 0 0 "[ . 1 . 2]" 1
418 1 35 ASN QB 1 38 GLN H 1.800 . 5.000 2.733 2.541 3.004 . 0 0 "[ . 1 . 2]" 1
419 1 36 PRO QD 1 38 GLN H 1.800 . 5.000 4.420 3.877 4.534 . 0 0 "[ . 1 . 2]" 1
420 1 37 ARG HA 1 38 GLN H 1.800 . 4.200 3.510 3.498 3.525 . 0 0 "[ . 1 . 2]" 1
421 1 37 ARG QB 1 38 GLN H 1.800 . 3.600 2.873 2.796 3.399 . 0 0 "[ . 1 . 2]" 1
422 1 37 ARG QG 1 38 GLN H 1.800 . 5.000 3.964 2.016 4.217 . 0 0 "[ . 1 . 2]" 1
423 1 38 GLN H 1 40 ARG H 1.800 . 5.000 3.862 3.730 3.963 . 0 0 "[ . 1 . 2]" 1
424 1 38 GLN H 1 39 CYS H 1.800 . 3.000 2.731 2.613 2.836 . 0 0 "[ . 1 . 2]" 1
425 1 38 GLN H 1 38 GLN QB 1.800 . 3.600 2.392 2.340 2.561 . 0 0 "[ . 1 . 2]" 1
426 1 38 GLN H 1 38 GLN QG 1.800 . 5.000 2.288 1.914 2.396 . 0 0 "[ . 1 . 2]" 1
427 1 4 PHE HZ 1 39 CYS H 1.800 . 5.000 5.047 5.003 5.109 0.109 6 0 "[ . 1 . 2]" 1
428 1 4 PHE QE 1 39 CYS H 1.800 . 5.500 4.175 3.865 4.574 . 0 0 "[ . 1 . 2]" 1
429 1 24 TRP QB 1 39 CYS H 1.800 . 5.500 4.785 4.747 4.832 . 0 0 "[ . 1 . 2]" 1
430 1 24 TRP HE3 1 39 CYS H 1.800 . 5.000 4.490 4.424 4.573 . 0 0 "[ . 1 . 2]" 1
431 1 24 TRP HZ3 1 39 CYS H 1.800 . 5.000 5.154 5.082 5.303 0.303 6 0 "[ . 1 . 2]" 1
432 1 28 SER HG 1 39 CYS H 1.800 . 5.500 4.597 4.368 4.796 . 0 0 "[ . 1 . 2]" 1
433 1 34 ARG QB 1 39 CYS H 1.800 . 5.000 4.090 3.347 4.409 . 0 0 "[ . 1 . 2]" 1
434 1 35 ASN HA 1 39 CYS H 1.800 . 5.500 5.665 5.567 5.718 0.218 17 0 "[ . 1 . 2]" 1
435 1 37 ARG HA 1 39 CYS H 1.800 . 5.000 4.520 4.267 4.717 . 0 0 "[ . 1 . 2]" 1
436 1 38 GLN HA 1 39 CYS H 1.800 . 5.000 3.600 3.562 3.616 . 0 0 "[ . 1 . 2]" 1
437 1 38 GLN QB 1 39 CYS H 1.800 . 5.000 2.596 2.392 2.829 . 0 0 "[ . 1 . 2]" 1
438 1 38 GLN QG 1 39 CYS H 1.800 . 5.000 4.150 3.840 4.277 . 0 0 "[ . 1 . 2]" 1
439 1 39 CYS H 1 40 ARG HA 1.800 . 5.000 5.045 4.891 5.129 0.129 2 0 "[ . 1 . 2]" 1
440 1 39 CYS H 1 40 ARG H 1.800 . 3.000 2.370 2.189 2.494 . 0 0 "[ . 1 . 2]" 1
441 1 39 CYS H 1 40 ARG QB 1.800 . 5.000 4.153 3.985 4.321 . 0 0 "[ . 1 . 2]" 1
442 1 39 CYS H 1 41 GLU H 1.800 . 5.000 4.224 3.874 4.472 . 0 0 "[ . 1 . 2]" 1
443 1 39 CYS H 1 39 CYS QB 1.800 . 3.600 2.557 2.443 2.885 . 0 0 "[ . 1 . 2]" 1
444 1 24 TRP QB 1 40 ARG H 1.800 . 5.500 4.188 3.884 4.380 . 0 0 "[ . 1 . 2]" 1
445 1 24 TRP HZ3 1 40 ARG H 1.800 . 5.000 4.394 4.133 4.697 . 0 0 "[ . 1 . 2]" 1
446 1 24 TRP HE3 1 40 ARG H 1.800 . 5.000 3.886 3.497 4.114 . 0 0 "[ . 1 . 2]" 1
447 1 36 PRO HA 1 40 ARG H 1.800 . 5.000 4.269 4.060 4.428 . 0 0 "[ . 1 . 2]" 1
448 1 36 PRO QB 1 40 ARG H 1.800 . 5.500 4.968 4.882 5.072 . 0 0 "[ . 1 . 2]" 1
449 1 37 ARG HA 1 40 ARG H 1.800 . 5.000 3.440 3.316 3.613 . 0 0 "[ . 1 . 2]" 1
450 1 38 GLN QB 1 40 ARG H 1.800 . 5.000 4.493 4.412 4.555 . 0 0 "[ . 1 . 2]" 1
451 1 39 CYS HA 1 40 ARG H 1.800 . 5.000 3.501 3.466 3.545 . 0 0 "[ . 1 . 2]" 1
452 1 39 CYS QB 1 40 ARG H 1.800 . 5.000 2.864 2.639 3.580 . 0 0 "[ . 1 . 2]" 1
453 1 40 ARG H 1 42 ARG H 1.800 . 5.000 3.961 3.782 4.053 . 0 0 "[ . 1 . 2]" 1
454 1 40 ARG H 1 41 GLU H 1.800 . 3.600 2.703 2.435 2.894 . 0 0 "[ . 1 . 2]" 1
455 1 40 ARG H 1 40 ARG QB 1.800 . 3.600 2.252 2.191 2.309 . 0 0 "[ . 1 . 2]" 1
456 1 40 ARG H 1 40 ARG QG 1.800 . 5.000 4.023 3.963 4.082 . 0 0 "[ . 1 . 2]" 1
457 1 40 ARG H 1 40 ARG QD 1.800 . 5.000 4.274 4.141 4.498 . 0 0 "[ . 1 . 2]" 1
458 1 37 ARG HA 1 41 GLU H 1.800 . 5.000 3.853 3.052 4.115 . 0 0 "[ . 1 . 2]" 1
459 1 38 GLN H 1 41 GLU H 1.800 . 5.000 4.813 4.556 4.999 . 0 0 "[ . 1 . 2]" 1
460 1 38 GLN HA 1 41 GLU H 1.800 . 5.000 3.809 3.509 4.349 . 0 0 "[ . 1 . 2]" 1
461 1 39 CYS HA 1 41 GLU H 1.800 . 5.000 4.408 4.052 4.689 . 0 0 "[ . 1 . 2]" 1
462 1 39 CYS QB 1 41 GLU H 1.800 . 5.500 4.936 4.816 5.064 . 0 0 "[ . 1 . 2]" 1
463 1 40 ARG HA 1 41 GLU H 1.800 . 5.000 3.560 3.515 3.583 . 0 0 "[ . 1 . 2]" 1
464 1 40 ARG QB 1 41 GLU H 1.800 . 5.000 2.450 2.323 2.712 . 0 0 "[ . 1 . 2]" 1
465 1 40 ARG QG 1 41 GLU H 1.800 . 5.000 3.349 3.130 3.706 . 0 0 "[ . 1 . 2]" 1
466 1 40 ARG QD 1 41 GLU H 1.800 . 5.000 4.370 4.214 4.517 . 0 0 "[ . 1 . 2]" 1
467 1 41 GLU H 1 42 ARG H 1.800 . 3.600 2.743 2.492 2.871 . 0 0 "[ . 1 . 2]" 1
468 1 41 GLU H 1 41 GLU HA 1.800 . 2.800 2.817 2.782 2.877 0.077 6 0 "[ . 1 . 2]" 1
469 1 41 GLU H 1 41 GLU QG 1.800 . 3.600 2.267 1.906 2.796 . 0 0 "[ . 1 . 2]" 1
470 1 41 GLU H 1 41 GLU QB 1.800 . 3.600 2.428 2.245 2.688 . 0 0 "[ . 1 . 2]" 1
471 1 4 PHE HZ 1 42 ARG H 1.800 . 5.000 4.356 4.185 4.444 . 0 0 "[ . 1 . 2]" 1
472 1 4 PHE QE 1 42 ARG H 1.800 . 5.500 5.284 5.147 5.350 . 0 0 "[ . 1 . 2]" 1
473 1 38 GLN HA 1 42 ARG H 1.800 . 5.000 5.049 4.940 5.123 0.123 11 0 "[ . 1 . 2]" 1
474 1 39 CYS H 1 42 ARG H 1.800 . 5.000 4.998 4.863 5.074 0.074 20 0 "[ . 1 . 2]" 1
475 1 39 CYS HA 1 42 ARG H 1.800 . 5.000 3.354 3.177 3.524 . 0 0 "[ . 1 . 2]" 1
476 1 39 CYS QB 1 42 ARG H 1.800 . 5.000 4.575 4.506 4.662 . 0 0 "[ . 1 . 2]" 1
477 1 40 ARG HA 1 42 ARG H 1.800 . 5.000 3.894 3.748 4.018 . 0 0 "[ . 1 . 2]" 1
478 1 40 ARG QB 1 42 ARG H 1.800 . 5.000 4.494 4.403 4.580 . 0 0 "[ . 1 . 2]" 1
479 1 41 GLU HA 1 42 ARG H 1.800 . 4.200 3.512 3.458 3.545 . 0 0 "[ . 1 . 2]" 1
480 1 41 GLU QB 1 42 ARG H 1.800 . 5.000 3.063 2.764 3.620 . 0 0 "[ . 1 . 2]" 1
481 1 41 GLU QG 1 42 ARG H 1.800 . 5.000 3.695 2.137 4.449 . 0 0 "[ . 1 . 2]" 1
482 1 42 ARG H 1 43 TRP H 1.800 . 4.200 2.588 2.474 2.815 . 0 0 "[ . 1 . 2]" 1
483 1 42 ARG H 1 42 ARG QG 1.800 . 5.000 3.099 2.032 4.099 . 0 0 "[ . 1 . 2]" 1
484 1 12 LEU QD 1 43 TRP H 1.800 . 6.000 3.782 3.603 4.146 . 0 0 "[ . 1 . 2]" 1
485 1 41 GLU HA 1 43 TRP H 1.800 . 5.000 4.460 4.206 4.814 . 0 0 "[ . 1 . 2]" 1
486 1 40 ARG HA 1 43 TRP H 1.800 . 5.000 3.241 2.954 3.600 . 0 0 "[ . 1 . 2]" 1
487 1 42 ARG QG 1 43 TRP H 1.800 . 5.500 4.064 3.568 4.637 . 0 0 "[ . 1 . 2]" 1
488 1 43 TRP H 1 44 ASN H 1.800 . 3.600 3.106 3.043 3.147 . 0 0 "[ . 1 . 2]" 1
489 1 16 VAL QG 1 43 TRP H 1.800 . 6.000 4.439 4.346 4.482 . 0 0 "[ . 1 . 2]" 1
490 1 43 TRP H 1 47 ILE MD 1.800 . 6.000 4.043 3.915 4.216 . 0 0 "[ . 1 . 2]" 1
491 1 43 TRP H 1 43 TRP QB 1.800 . 3.600 2.193 2.020 2.240 . 0 0 "[ . 1 . 2]" 1
492 1 40 ARG HA 1 44 ASN H 1.800 . 5.000 4.839 4.634 5.030 0.030 18 0 "[ . 1 . 2]" 1
493 1 40 ARG QG 1 44 ASN H 1.800 . 5.500 4.501 3.905 4.708 . 0 0 "[ . 1 . 2]" 1
494 1 41 GLU HA 1 44 ASN H 1.800 . 5.000 3.903 3.704 4.127 . 0 0 "[ . 1 . 2]" 1
495 1 42 ARG H 1 44 ASN H 1.800 . 5.500 4.602 4.323 4.729 . 0 0 "[ . 1 . 2]" 1
496 1 43 TRP HD1 1 44 ASN H 1.800 . 5.000 4.132 1.794 5.150 0.150 15 0 "[ . 1 . 2]" 1
497 1 43 TRP HA 1 44 ASN H 1.800 . 5.000 3.574 3.538 3.600 . 0 0 "[ . 1 . 2]" 1
498 1 43 TRP QB 1 44 ASN H 1.800 . 5.000 2.197 2.031 3.188 . 0 0 "[ . 1 . 2]" 1
499 1 44 ASN H 1 45 ASN H 1.800 . 5.000 2.603 2.504 2.808 . 0 0 "[ . 1 . 2]" 1
500 1 44 ASN H 1 46 TYR H 1.800 . 5.000 4.116 4.060 4.195 . 0 0 "[ . 1 . 2]" 1
501 1 44 ASN H 1 44 ASN QB 1.800 . 3.600 2.628 2.429 2.803 . 0 0 "[ . 1 . 2]" 1
502 1 44 ASN H 1 47 ILE MD 1.800 . 6.000 4.904 4.869 4.945 . 0 0 "[ . 1 . 2]" 1
503 1 41 GLU HA 1 44 ASN QD 1.800 . 5.000 2.517 1.810 3.513 . 0 0 "[ . 1 . 2]" 1
504 1 40 ARG HA 1 44 ASN QD 1.800 . 5.000 4.453 4.027 4.576 . 0 0 "[ . 1 . 2]" 1
505 1 40 ARG QB 1 44 ASN QD 1.800 . 6.000 4.443 3.937 4.743 . 0 0 "[ . 1 . 2]" 1
506 1 40 ARG QG 1 44 ASN QD 1.800 . 4.200 2.873 2.318 3.225 . 0 0 "[ . 1 . 2]" 1
507 1 40 ARG QD 1 44 ASN QD 1.800 . 5.000 3.158 2.423 4.112 . 0 0 "[ . 1 . 2]" 1
508 1 44 ASN HA 1 45 ASN H 1.800 . 5.000 3.554 3.484 3.614 . 0 0 "[ . 1 . 2]" 1
509 1 44 ASN QB 1 45 ASN H 1.800 . 5.000 3.010 2.521 3.488 . 0 0 "[ . 1 . 2]" 1
510 1 45 ASN H 1 46 TYR H 1.800 . 3.600 2.787 2.560 2.933 . 0 0 "[ . 1 . 2]" 1
511 1 45 ASN HA 1 49 PRO QG 1.800 . 6.000 5.442 5.381 5.477 . 0 0 "[ . 1 . 2]" 1
512 1 45 ASN HA 1 51 LEU QD 1.800 . 6.000 3.510 3.276 4.330 . 0 0 "[ . 1 . 2]" 1
513 1 45 ASN HA 1 86 SER H 1.800 . 5.000 5.070 5.033 5.112 0.112 8 0 "[ . 1 . 2]" 1
514 1 45 ASN HA 1 86 SER HA 1.800 . 5.000 2.600 2.376 2.802 . 0 0 "[ . 1 . 2]" 1
515 1 45 ASN HA 1 86 SER QB 1.800 . 5.000 3.500 3.263 4.155 . 0 0 "[ . 1 . 2]" 1
516 1 41 GLU HA 1 45 ASN QD 1.800 . 5.000 3.235 2.791 3.735 . 0 0 "[ . 1 . 2]" 1
517 1 41 GLU QB 1 45 ASN QD 1.800 . 4.200 2.379 1.988 2.797 . 0 0 "[ . 1 . 2]" 1
518 1 41 GLU QG 1 45 ASN QD 1.800 . 5.000 3.542 2.568 4.077 . 0 0 "[ . 1 . 2]" 1
519 1 43 TRP H 1 46 TYR H 1.800 . 5.000 5.083 5.022 5.131 0.131 4 0 "[ . 1 . 2]" 1
520 1 43 TRP HA 1 46 TYR H 1.800 . 5.000 4.168 3.566 4.375 . 0 0 "[ . 1 . 2]" 1
521 1 44 ASN HA 1 46 TYR H 1.800 . 5.500 3.709 3.608 3.852 . 0 0 "[ . 1 . 2]" 1
522 1 45 ASN HA 1 46 TYR H 1.800 . 5.000 3.178 3.152 3.239 . 0 0 "[ . 1 . 2]" 1
523 1 45 ASN QB 1 46 TYR H 1.800 . 5.000 3.669 3.584 4.039 . 0 0 "[ . 1 . 2]" 1
524 1 46 TYR H 1 47 ILE HA 1.800 . 5.000 4.345 4.318 4.370 . 0 0 "[ . 1 . 2]" 1
525 1 46 TYR H 1 47 ILE MD 1.800 . 5.500 3.852 3.719 3.994 . 0 0 "[ . 1 . 2]" 1
526 1 46 TYR H 1 86 SER QB 1.800 . 5.500 3.682 3.439 4.383 . 0 0 "[ . 1 . 2]" 1
527 1 46 TYR H 1 51 LEU QD 1.800 . 6.000 3.622 3.446 3.892 . 0 0 "[ . 1 . 2]" 1
528 1 46 TYR H 1 46 TYR QB 1.800 . 3.600 2.795 2.753 2.839 . 0 0 "[ . 1 . 2]" 1
529 1 46 TYR QD 1 47 ILE MD 1.800 . 5.500 3.821 3.632 3.981 . 0 0 "[ . 1 . 2]" 1
530 1 46 TYR QD 1 47 ILE MG 1.800 . 5.000 2.121 2.068 2.473 . 0 0 "[ . 1 . 2]" 1
531 1 46 TYR QE 1 47 ILE MG 1.800 . 5.500 3.672 3.627 3.869 . 0 0 "[ . 1 . 2]" 1
532 1 48 ASN H 1 51 LEU QD 1.800 . 6.000 4.016 3.060 4.344 . 0 0 "[ . 1 . 2]" 1
533 1 43 TRP HA 1 48 ASN H 1.800 . 5.500 5.732 5.673 5.796 0.296 17 0 "[ . 1 . 2]" 1
534 1 44 ASN HA 1 48 ASN H 1.800 . 5.000 5.045 4.973 5.142 0.142 6 0 "[ . 1 . 2]" 1
535 1 47 ILE HA 1 48 ASN H 1.800 . 5.000 2.080 2.060 2.097 . 0 0 "[ . 1 . 2]" 1
536 1 47 ILE HB 1 48 ASN H 1.800 . 5.000 3.484 3.434 3.606 . 0 0 "[ . 1 . 2]" 1
537 1 47 ILE QG 1 48 ASN H 1.800 . 5.500 3.977 3.908 4.100 . 0 0 "[ . 1 . 2]" 1
538 1 47 ILE MG 1 48 ASN H 1.800 . 5.500 4.256 4.158 4.328 . 0 0 "[ . 1 . 2]" 1
539 1 47 ILE MD 1 48 ASN H 1.800 . 5.500 4.433 4.368 4.562 . 0 0 "[ . 1 . 2]" 1
540 1 48 ASN H 1 49 PRO HA 1.800 . 5.500 4.550 4.523 4.573 . 0 0 "[ . 1 . 2]" 1
541 1 48 ASN H 1 50 ALA HA 1.800 . 5.500 4.423 4.033 5.092 . 0 0 "[ . 1 . 2]" 1
542 1 48 ASN QD 1 49 PRO HA 1.800 . 6.000 3.969 3.546 4.237 . 0 0 "[ . 1 . 2]" 1
543 1 48 ASN QD 1 49 PRO QD 1.800 . 6.000 1.907 1.786 2.076 0.014 14 0 "[ . 1 . 2]" 1
544 1 48 ASN QD 1 51 LEU QD 1.800 . 6.500 3.954 3.669 4.184 . 0 0 "[ . 1 . 2]" 1
545 1 50 ALA HA 1 51 LEU QD 1.800 . 6.000 3.839 3.486 4.559 . 0 0 "[ . 1 . 2]" 1
546 1 49 PRO QB 1 50 ALA H 1.800 . 5.000 3.016 1.786 3.676 0.014 18 0 "[ . 1 . 2]" 1
547 1 49 PRO QG 1 50 ALA H 1.800 . 5.000 2.865 1.825 3.446 . 0 0 "[ . 1 . 2]" 1
548 1 49 PRO QD 1 50 ALA H 1.800 . 5.000 2.214 1.786 3.134 0.014 6 0 "[ . 1 . 2]" 1
549 1 50 ALA H 1 51 LEU QD 1.800 . 5.000 3.671 2.602 3.891 . 0 0 "[ . 1 . 2]" 1
550 1 50 ALA H 1 50 ALA MB 1.800 . 4.200 2.946 2.847 3.024 . 0 0 "[ . 1 . 2]" 1
551 1 49 PRO QB 1 51 LEU H 1.800 . 5.000 4.044 3.171 4.351 . 0 0 "[ . 1 . 2]" 1
552 1 50 ALA HA 1 51 LEU H 1.800 . 5.000 2.657 2.533 2.962 . 0 0 "[ . 1 . 2]" 1
553 1 50 ALA MB 1 51 LEU H 1.800 . 5.000 3.696 3.565 3.740 . 0 0 "[ . 1 . 2]" 1
554 1 51 LEU H 1 52 ARG H 1.800 . 5.000 2.920 2.757 3.142 . 0 0 "[ . 1 . 2]" 1
555 1 51 LEU H 1 51 LEU QB 1.800 . 4.200 2.840 2.538 2.971 . 0 0 "[ . 1 . 2]" 1
556 1 51 LEU H 1 51 LEU HG 1.800 . 4.200 1.963 1.708 3.800 0.092 17 0 "[ . 1 . 2]" 1
557 1 51 LEU H 1 51 LEU QD 1.800 . 5.000 2.169 1.637 2.880 0.163 14 0 "[ . 1 . 2]" 1
558 1 51 LEU QD 1 52 ARG H 1.800 . 5.000 3.091 2.912 3.733 . 0 0 "[ . 1 . 2]" 1
559 1 46 TYR HA 1 51 LEU QD 1.800 . 6.000 3.212 3.040 3.464 . 0 0 "[ . 1 . 2]" 1
560 1 51 LEU QD 1 86 SER QB 1.800 . 6.000 1.942 1.791 2.100 0.009 7 0 "[ . 1 . 2]" 1
561 1 50 ALA MB 1 52 ARG H 1.800 . 5.500 3.586 3.124 3.803 . 0 0 "[ . 1 . 2]" 1
562 1 51 LEU HA 1 52 ARG H 1.800 . 5.000 3.054 2.962 3.394 . 0 0 "[ . 1 . 2]" 1
563 1 52 ARG H 1 53 THR H 1.800 . 5.000 2.765 2.695 2.849 . 0 0 "[ . 1 . 2]" 1
564 1 52 ARG H 1 52 ARG QG 1.800 . 5.000 2.300 1.803 4.091 . 0 0 "[ . 1 . 2]" 1
565 1 52 ARG H 1 52 ARG QD 1.800 . 5.000 3.672 2.486 4.373 . 0 0 "[ . 1 . 2]" 1
566 1 52 ARG HA 1 53 THR H 1.800 . 5.000 3.384 3.322 3.532 . 0 0 "[ . 1 . 2]" 1
567 1 52 ARG QB 1 53 THR H 1.800 . 5.000 3.277 2.752 3.830 . 0 0 "[ . 1 . 2]" 1
568 1 53 THR H 1 54 ASP H 3.000 3.000 5.000 3.014 2.970 3.315 0.030 12 0 "[ . 1 . 2]" 1
569 1 53 THR H 1 53 THR MG 1.800 . 5.000 3.511 2.214 4.057 . 0 0 "[ . 1 . 2]" 1
570 1 53 THR H 1 53 THR HB 1.800 . 3.600 3.204 2.996 3.635 0.035 12 0 "[ . 1 . 2]" 1
571 1 53 THR MG 1 54 ASP H 1.800 . 5.000 3.912 3.590 4.095 . 0 0 "[ . 1 . 2]" 1
572 1 53 THR HB 1 54 ASP H 1.800 . 5.000 4.494 4.400 4.682 . 0 0 "[ . 1 . 2]" 1
573 1 53 THR HA 1 54 ASP H 1.800 . 3.600 2.515 2.349 2.601 . 0 0 "[ . 1 . 2]" 1
574 1 54 ASP H 1 55 PRO QD 1.800 . 5.100 2.856 2.551 3.103 . 0 0 "[ . 1 . 2]" 1
575 1 54 ASP H 1 55 PRO QG 1.800 . 5.500 4.741 4.202 4.925 . 0 0 "[ . 1 . 2]" 1
576 1 51 LEU QD 1 54 ASP H 1.800 . 6.000 4.343 4.155 4.422 . 0 0 "[ . 1 . 2]" 1
577 1 54 ASP H 1 54 ASP QB 1.800 . 3.600 2.604 2.522 2.705 . 0 0 "[ . 1 . 2]" 1
578 1 54 ASP HA 1 56 TRP H 1.800 . 6.000 6.090 6.058 6.132 0.132 20 0 "[ . 1 . 2]" 1
579 1 55 PRO HA 1 56 TRP H 1.800 . 3.600 2.196 2.171 2.233 . 0 0 "[ . 1 . 2]" 1
580 1 55 PRO QB 1 56 TRP H 1.800 . 3.600 3.207 3.157 3.266 . 0 0 "[ . 1 . 2]" 1
581 1 55 PRO QG 1 56 TRP H 1.800 . 5.000 4.522 4.471 4.586 . 0 0 "[ . 1 . 2]" 1
582 1 56 TRP H 1 56 TRP HD1 1.800 . 3.600 2.332 2.046 2.594 . 0 0 "[ . 1 . 2]" 1
583 1 56 TRP H 1 57 SER H 1.800 . 5.000 4.509 4.448 4.574 . 0 0 "[ . 1 . 2]" 1
584 1 56 TRP H 1 56 TRP QB 1.800 . 3.600 2.939 2.881 2.991 . 0 0 "[ . 1 . 2]" 1
585 1 56 TRP H 1 56 TRP HE1 1.800 . 5.000 3.682 3.559 3.832 . 0 0 "[ . 1 . 2]" 1
586 1 56 TRP H 1 56 TRP HE3 1.800 . 5.000 4.444 4.265 4.638 . 0 0 "[ . 1 . 2]" 1
587 1 55 PRO HA 1 56 TRP HE1 1.800 . 5.000 4.471 4.293 4.751 . 0 0 "[ . 1 . 2]" 1
588 1 56 TRP HE1 1 82 LEU QD 1.800 . 6.000 3.993 3.885 4.167 . 0 0 "[ . 1 . 2]" 1
589 1 56 TRP HE1 1 85 ARG QB 1.800 . 5.000 3.952 3.192 4.318 . 0 0 "[ . 1 . 2]" 1
590 1 56 TRP HE1 1 85 ARG QG 1.800 . 5.000 4.010 3.304 4.260 . 0 0 "[ . 1 . 2]" 1
591 1 56 TRP HE1 1 89 ASN QB 1.800 . 5.000 4.146 3.694 4.268 . 0 0 "[ . 1 . 2]" 1
592 1 56 TRP HE1 1 90 ILE MD 1.800 . 5.000 4.244 4.154 4.303 . 0 0 "[ . 1 . 2]" 1
593 1 56 TRP HE1 1 90 ILE H 1.800 . 5.500 4.020 3.696 4.182 . 0 0 "[ . 1 . 2]" 1
594 1 56 TRP HE1 1 90 ILE HA 1.800 . 5.000 1.873 1.793 2.009 0.007 17 0 "[ . 1 . 2]" 1
595 1 56 TRP HE1 1 90 ILE MG 1.800 . 5.500 3.081 2.938 3.432 . 0 0 "[ . 1 . 2]" 1
596 1 56 TRP HE1 1 93 ARG H 1.800 . 5.500 4.176 4.093 4.336 . 0 0 "[ . 1 . 2]" 1
597 1 56 TRP HE1 1 93 ARG HA 1.800 . 5.500 5.553 5.486 5.622 0.122 17 0 "[ . 1 . 2]" 1
598 1 56 TRP HE1 1 93 ARG QB 1.800 . 5.000 2.558 2.457 2.880 . 0 0 "[ . 1 . 2]" 1
599 1 56 TRP HE1 1 93 ARG QG 1.800 . 6.000 3.718 2.258 4.634 . 0 0 "[ . 1 . 2]" 1
600 1 56 TRP HE1 1 93 ARG QD 1.800 . 4.200 3.442 2.929 3.860 . 0 0 "[ . 1 . 2]" 1
601 1 56 TRP HE1 1 94 TRP H 1.800 . 5.000 4.478 4.258 5.006 0.006 7 0 "[ . 1 . 2]" 1
602 1 56 TRP HA 1 57 SER H 1.800 . 3.600 2.742 2.589 2.860 . 0 0 "[ . 1 . 2]" 1
603 1 56 TRP QB 1 57 SER H 1.800 . 5.000 1.920 1.803 2.093 . 0 0 "[ . 1 . 2]" 1
604 1 56 TRP HD1 1 57 SER H 1.800 . 5.500 5.449 5.361 5.550 0.050 8 0 "[ . 1 . 2]" 1
605 1 56 TRP HE3 1 57 SER H 1.800 . 5.500 3.246 2.979 3.547 . 0 0 "[ . 1 . 2]" 1
606 1 57 SER H 1 58 PRO QD 1.800 . 5.500 4.397 4.355 4.418 . 0 0 "[ . 1 . 2]" 1
607 1 57 SER H 1 59 GLU H 1.800 . 5.500 3.765 3.703 3.842 . 0 0 "[ . 1 . 2]" 1
608 1 57 SER H 1 60 GLU H 1.800 . 5.000 3.153 2.957 3.413 . 0 0 "[ . 1 . 2]" 1
609 1 57 SER H 1 60 GLU QG 1.800 . 5.000 3.034 2.469 4.518 . 0 0 "[ . 1 . 2]" 1
610 1 57 SER H 1 60 GLU QB 1.800 . 5.000 3.452 3.122 3.757 . 0 0 "[ . 1 . 2]" 1
611 1 57 SER H 1 61 ASP H 1.800 . 5.000 4.610 4.317 5.010 0.010 8 0 "[ . 1 . 2]" 1
612 1 58 PRO HA 1 61 ASP QB 1.800 . 5.000 2.093 2.079 2.107 . 0 0 "[ . 1 . 2]" 1
613 1 57 SER QB 1 59 GLU H 1.800 . 5.500 2.784 2.467 3.536 . 0 0 "[ . 1 . 2]" 1
614 1 57 SER HA 1 59 GLU H 1.800 . 5.000 4.167 4.088 4.258 . 0 0 "[ . 1 . 2]" 1
615 1 58 PRO HA 1 59 GLU H 1.800 . 5.000 3.433 3.420 3.448 . 0 0 "[ . 1 . 2]" 1
616 1 58 PRO QB 1 59 GLU H 1.800 . 5.000 3.128 3.078 3.165 . 0 0 "[ . 1 . 2]" 1
617 1 58 PRO QD 1 59 GLU H 1.800 . 5.000 3.136 3.047 3.191 . 0 0 "[ . 1 . 2]" 1
618 1 59 GLU H 1 60 GLU H 1.800 . 3.600 2.613 2.524 2.747 . 0 0 "[ . 1 . 2]" 1
619 1 59 GLU H 1 60 GLU QB 1.800 . 5.500 4.730 4.407 4.810 . 0 0 "[ . 1 . 2]" 1
620 1 59 GLU H 1 61 ASP H 1.800 . 5.000 3.609 3.486 3.891 . 0 0 "[ . 1 . 2]" 1
621 1 59 GLU H 1 61 ASP QB 1.800 . 5.000 4.386 4.272 4.541 . 0 0 "[ . 1 . 2]" 1
622 1 59 GLU H 1 62 MET H 1.800 . 5.000 4.751 4.647 4.842 . 0 0 "[ . 1 . 2]" 1
623 1 59 GLU H 1 63 LEU H 1.800 . 5.500 5.816 5.691 5.883 0.383 15 0 "[ . 1 . 2]" 1
624 1 59 GLU H 1 59 GLU QB 1.800 . 3.600 2.451 2.370 2.563 . 0 0 "[ . 1 . 2]" 1
625 1 59 GLU H 1 59 GLU QG 1.800 . 3.600 2.144 1.919 2.321 . 0 0 "[ . 1 . 2]" 1
626 1 56 TRP HZ3 1 60 GLU H 1.800 . 5.000 5.107 5.039 5.159 0.159 6 0 "[ . 1 . 2]" 1
627 1 56 TRP HE3 1 60 GLU H 1.800 . 5.000 3.492 3.463 3.542 . 0 0 "[ . 1 . 2]" 1
628 1 56 TRP HA 1 60 GLU H 1.800 . 5.500 5.601 5.562 5.681 0.181 19 0 "[ . 1 . 2]" 1
629 1 56 TRP QB 1 60 GLU H 1.800 . 5.500 3.375 3.275 3.468 . 0 0 "[ . 1 . 2]" 1
630 1 57 SER HA 1 60 GLU H 1.800 . 5.000 4.933 4.792 5.046 0.046 19 0 "[ . 1 . 2]" 1
631 1 57 SER QB 1 60 GLU H 1.800 . 5.000 4.239 3.992 4.503 . 0 0 "[ . 1 . 2]" 1
632 1 58 PRO HA 1 60 GLU H 1.800 . 5.000 4.377 4.245 4.530 . 0 0 "[ . 1 . 2]" 1
633 1 59 GLU HA 1 60 GLU H 1.800 . 5.000 3.584 3.568 3.619 . 0 0 "[ . 1 . 2]" 1
634 1 59 GLU QB 1 60 GLU H 1.800 . 5.000 2.501 2.359 3.391 . 0 0 "[ . 1 . 2]" 1
635 1 59 GLU QG 1 60 GLU H 1.800 . 5.000 3.847 1.835 4.085 . 0 0 "[ . 1 . 2]" 1
636 1 60 GLU H 1 61 ASP H 1.800 . 3.600 2.375 2.276 2.510 . 0 0 "[ . 1 . 2]" 1
637 1 60 GLU H 1 61 ASP QB 1.800 . 5.000 4.172 4.068 4.293 . 0 0 "[ . 1 . 2]" 1
638 1 60 GLU H 1 62 MET H 1.800 . 5.000 4.461 4.250 4.562 . 0 0 "[ . 1 . 2]" 1
639 1 60 GLU H 1 60 GLU QG 1.800 . 3.600 2.315 1.964 3.640 0.040 19 0 "[ . 1 . 2]" 1
640 1 60 GLU H 1 60 GLU QB 1.800 . 3.600 2.474 2.016 2.627 . 0 0 "[ . 1 . 2]" 1
641 1 56 TRP HZ3 1 61 ASP H 1.800 . 5.000 3.406 3.195 3.534 . 0 0 "[ . 1 . 2]" 1
642 1 56 TRP HE3 1 61 ASP H 1.800 . 5.000 3.054 2.817 3.263 . 0 0 "[ . 1 . 2]" 1
643 1 56 TRP QB 1 61 ASP H 1.800 . 5.500 4.437 4.236 4.592 . 0 0 "[ . 1 . 2]" 1
644 1 58 PRO HA 1 61 ASP H 1.800 . 5.000 3.089 2.968 3.208 . 0 0 "[ . 1 . 2]" 1
645 1 60 GLU HA 1 61 ASP H 1.800 . 3.600 3.496 3.458 3.559 . 0 0 "[ . 1 . 2]" 1
646 1 60 GLU QG 1 61 ASP H 1.800 . 5.000 4.005 3.294 4.546 . 0 0 "[ . 1 . 2]" 1
647 1 60 GLU QB 1 61 ASP H 1.800 . 5.000 2.899 2.679 3.063 . 0 0 "[ . 1 . 2]" 1
648 1 61 ASP H 1 62 MET H 1.800 . 3.600 2.802 2.757 2.882 . 0 0 "[ . 1 . 2]" 1
649 1 61 ASP H 1 63 LEU H 1.800 . 5.000 3.831 3.676 4.188 . 0 0 "[ . 1 . 2]" 1
650 1 61 ASP H 1 61 ASP QB 1.800 . 3.600 2.247 2.203 2.275 . 0 0 "[ . 1 . 2]" 1
651 1 58 PRO HA 1 62 MET H 1.800 . 5.000 3.599 3.376 3.832 . 0 0 "[ . 1 . 2]" 1
652 1 59 GLU HA 1 62 MET H 1.800 . 5.000 3.898 3.671 4.125 . 0 0 "[ . 1 . 2]" 1
653 1 60 GLU HA 1 62 MET H 1.800 . 5.000 4.706 4.324 4.843 . 0 0 "[ . 1 . 2]" 1
654 1 61 ASP HA 1 62 MET H 1.800 . 5.000 3.578 3.569 3.590 . 0 0 "[ . 1 . 2]" 1
655 1 61 ASP QB 1 62 MET H 1.800 . 5.000 2.179 2.131 2.417 . 0 0 "[ . 1 . 2]" 1
656 1 62 MET H 1 63 LEU H 1.800 . 3.600 2.651 2.501 2.725 . 0 0 "[ . 1 . 2]" 1
657 1 62 MET H 1 63 LEU QB 1.800 . 5.500 4.536 4.446 4.730 . 0 0 "[ . 1 . 2]" 1
658 1 62 MET H 1 64 LEU H 1.800 . 5.000 3.923 3.776 4.175 . 0 0 "[ . 1 . 2]" 1
659 1 62 MET H 1 62 MET HA 1.800 . 2.800 2.850 2.827 2.918 0.118 8 0 "[ . 1 . 2]" 1
660 1 62 MET H 1 62 MET QB 1.800 . 3.600 2.438 2.369 2.539 . 0 0 "[ . 1 . 2]" 1
661 1 62 MET H 1 62 MET QG 1.800 . 3.600 2.155 1.994 2.406 . 0 0 "[ . 1 . 2]" 1
662 1 60 GLU HA 1 63 LEU H 1.800 . 5.000 3.274 3.153 3.383 . 0 0 "[ . 1 . 2]" 1
663 1 61 ASP HA 1 63 LEU H 1.800 . 5.000 4.422 4.125 4.924 . 0 0 "[ . 1 . 2]" 1
664 1 62 MET HA 1 63 LEU H 1.800 . 5.000 3.548 3.517 3.577 . 0 0 "[ . 1 . 2]" 1
665 1 62 MET QB 1 63 LEU H 1.800 . 5.000 2.757 2.516 3.508 . 0 0 "[ . 1 . 2]" 1
666 1 62 MET QG 1 63 LEU H 1.800 . 5.000 3.775 2.012 4.155 . 0 0 "[ . 1 . 2]" 1
667 1 63 LEU H 1 64 LEU H 1.800 . 3.600 2.436 2.364 2.695 . 0 0 "[ . 1 . 2]" 1
668 1 63 LEU H 1 63 LEU QB 1.800 . 5.000 2.285 2.199 2.473 . 0 0 "[ . 1 . 2]" 1
669 1 63 LEU H 1 63 LEU HG 1.800 . 5.000 4.012 2.223 4.539 . 0 0 "[ . 1 . 2]" 1
670 1 63 LEU H 1 63 LEU QD 1.800 . 5.000 3.362 2.108 3.815 . 0 0 "[ . 1 . 2]" 1
671 1 60 GLU HA 1 64 LEU H 1.800 . 5.000 3.505 2.250 3.982 . 0 0 "[ . 1 . 2]" 1
672 1 61 ASP HA 1 64 LEU H 1.800 . 5.000 3.408 3.012 4.431 . 0 0 "[ . 1 . 2]" 1
673 1 62 MET HA 1 64 LEU H 1.800 . 5.000 4.236 4.022 5.032 0.032 8 0 "[ . 1 . 2]" 1
674 1 63 LEU HA 1 64 LEU H 1.800 . 4.200 3.491 3.438 3.587 . 0 0 "[ . 1 . 2]" 1
675 1 63 LEU QB 1 64 LEU H 1.800 . 5.000 2.855 2.329 3.049 . 0 0 "[ . 1 . 2]" 1
676 1 64 LEU H 1 65 ASP H 1.800 . 3.600 2.554 2.430 2.843 . 0 0 "[ . 1 . 2]" 1
677 1 64 LEU H 1 65 ASP QB 1.800 . 5.500 4.337 4.175 4.572 . 0 0 "[ . 1 . 2]" 1
678 1 64 LEU H 1 66 GLN H 1.800 . 5.000 3.992 3.866 4.169 . 0 0 "[ . 1 . 2]" 1
679 1 64 LEU H 1 64 LEU QB 1.800 . 3.600 2.239 2.174 2.286 . 0 0 "[ . 1 . 2]" 1
680 1 64 LEU H 1 64 LEU QD 1.800 . 5.000 3.730 3.600 3.811 . 0 0 "[ . 1 . 2]" 1
681 1 61 ASP HA 1 65 ASP H 1.800 . 5.000 3.932 3.610 4.221 . 0 0 "[ . 1 . 2]" 1
682 1 62 MET HA 1 65 ASP H 1.800 . 5.000 3.574 3.353 3.957 . 0 0 "[ . 1 . 2]" 1
683 1 63 LEU HA 1 65 ASP H 1.800 . 5.000 4.440 4.293 4.676 . 0 0 "[ . 1 . 2]" 1
684 1 64 LEU HA 1 65 ASP H 1.800 . 5.000 3.562 3.545 3.591 . 0 0 "[ . 1 . 2]" 1
685 1 64 LEU QB 1 65 ASP H 1.800 . 5.000 2.598 2.291 2.680 . 0 0 "[ . 1 . 2]" 1
686 1 64 LEU QD 1 65 ASP H 1.800 . 5.000 3.226 2.567 3.855 . 0 0 "[ . 1 . 2]" 1
687 1 65 ASP H 1 66 GLN H 1.800 . 3.600 2.782 2.735 2.835 . 0 0 "[ . 1 . 2]" 1
688 1 65 ASP H 1 66 GLN HA 1.800 . 5.500 5.432 5.404 5.468 . 0 0 "[ . 1 . 2]" 1
689 1 62 MET HA 1 66 GLN H 1.800 . 5.000 4.949 4.727 5.051 0.051 13 0 "[ . 1 . 2]" 1
690 1 63 LEU HA 1 66 GLN H 1.800 . 5.000 3.608 3.360 3.811 . 0 0 "[ . 1 . 2]" 1
691 1 63 LEU H 1 66 GLN H 1.800 . 5.000 5.138 5.044 5.179 0.179 1 0 "[ . 1 . 2]" 1
692 1 64 LEU HA 1 66 GLN H 1.800 . 5.000 3.848 3.700 4.012 . 0 0 "[ . 1 . 2]" 1
693 1 65 ASP HA 1 66 GLN H 1.800 . 4.200 3.512 3.494 3.535 . 0 0 "[ . 1 . 2]" 1
694 1 65 ASP QB 1 66 GLN H 1.800 . 3.600 2.729 2.647 2.798 . 0 0 "[ . 1 . 2]" 1
695 1 66 GLN H 1 67 LYS H 1.800 . 3.600 2.535 2.465 2.577 . 0 0 "[ . 1 . 2]" 1
696 1 66 GLN H 1 68 TYR H 1.800 . 5.000 4.220 4.137 4.279 . 0 0 "[ . 1 . 2]" 1
697 1 66 GLN H 1 69 ALA H 1.800 . 5.000 4.559 4.475 4.647 . 0 0 "[ . 1 . 2]" 1
698 1 66 GLN H 1 69 ALA MB 1.800 . 5.500 4.513 4.482 4.584 . 0 0 "[ . 1 . 2]" 1
699 1 66 GLN H 1 66 GLN QB 1.800 . 3.600 2.369 2.245 2.558 . 0 0 "[ . 1 . 2]" 1
700 1 63 LEU HA 1 67 LYS H 1.800 . 5.000 4.666 4.091 5.012 0.012 6 0 "[ . 1 . 2]" 1
701 1 64 LEU H 1 67 LYS H 1.800 . 5.000 4.795 4.614 4.952 . 0 0 "[ . 1 . 2]" 1
702 1 64 LEU HA 1 67 LYS H 1.800 . 5.000 3.004 2.902 3.202 . 0 0 "[ . 1 . 2]" 1
703 1 65 ASP H 1 67 LYS H 1.800 . 5.000 4.381 4.255 4.477 . 0 0 "[ . 1 . 2]" 1
704 1 65 ASP HA 1 67 LYS H 1.800 . 5.000 4.706 4.452 4.881 . 0 0 "[ . 1 . 2]" 1
705 1 65 ASP QB 1 67 LYS H 1.800 . 5.500 4.904 4.842 4.959 . 0 0 "[ . 1 . 2]" 1
706 1 66 GLN HA 1 67 LYS H 1.800 . 5.000 3.569 3.550 3.583 . 0 0 "[ . 1 . 2]" 1
707 1 66 GLN QB 1 67 LYS H 1.800 . 5.000 2.499 2.403 2.632 . 0 0 "[ . 1 . 2]" 1
708 1 66 GLN QG 1 67 LYS H 1.800 . 5.500 3.925 3.568 4.511 . 0 0 "[ . 1 . 2]" 1
709 1 67 LYS H 1 69 ALA H 1.800 . 5.000 3.965 3.788 4.134 . 0 0 "[ . 1 . 2]" 1
710 1 67 LYS H 1 68 TYR H 1.800 . 3.600 2.679 2.584 2.791 . 0 0 "[ . 1 . 2]" 1
711 1 67 LYS H 1 68 TYR HA 1.800 . 5.500 5.316 5.238 5.404 . 0 0 "[ . 1 . 2]" 1
712 1 67 LYS H 1 67 LYS QB 1.800 . 3.600 2.453 2.244 2.653 . 0 0 "[ . 1 . 2]" 1
713 1 67 LYS H 1 70 GLU H 1.800 . 5.000 4.881 4.793 5.003 0.003 9 0 "[ . 1 . 2]" 1
714 1 64 LEU HA 1 68 TYR H 1.800 . 4.800 3.178 2.903 3.555 . 0 0 "[ . 1 . 2]" 1
715 1 65 ASP HA 1 68 TYR H 1.800 . 5.000 4.150 3.885 4.304 . 0 0 "[ . 1 . 2]" 1
716 1 65 ASP H 1 68 TYR H 1.800 . 5.500 4.804 4.759 4.869 . 0 0 "[ . 1 . 2]" 1
717 1 66 GLN HA 1 68 TYR H 1.800 . 5.000 5.070 4.915 5.113 0.113 14 0 "[ . 1 . 2]" 1
718 1 67 LYS HA 1 68 TYR H 1.800 . 4.200 3.575 3.567 3.585 . 0 0 "[ . 1 . 2]" 1
719 1 67 LYS QB 1 68 TYR H 1.800 . 5.000 2.276 2.223 2.404 . 0 0 "[ . 1 . 2]" 1
720 1 68 TYR H 1 69 ALA MB 1.800 . 5.500 4.404 4.380 4.425 . 0 0 "[ . 1 . 2]" 1
721 1 68 TYR H 1 69 ALA H 1.800 . 3.600 2.822 2.751 2.899 . 0 0 "[ . 1 . 2]" 1
722 1 68 TYR H 1 70 GLU H 1.800 . 5.000 4.130 4.027 4.350 . 0 0 "[ . 1 . 2]" 1
723 1 68 TYR H 1 78 ILE MD 1.800 . 5.500 3.608 3.177 3.939 . 0 0 "[ . 1 . 2]" 1
724 1 68 TYR H 1 68 TYR QD 1.800 . 5.500 4.086 3.957 4.174 . 0 0 "[ . 1 . 2]" 1
725 1 65 ASP HA 1 69 ALA H 1.800 . 5.000 3.679 3.505 4.036 . 0 0 "[ . 1 . 2]" 1
726 1 66 GLN HA 1 69 ALA H 1.800 . 5.000 3.939 3.672 4.125 . 0 0 "[ . 1 . 2]" 1
727 1 67 LYS HA 1 69 ALA H 1.800 . 5.000 4.354 4.171 4.537 . 0 0 "[ . 1 . 2]" 1
728 1 68 TYR QB 1 69 ALA H 1.800 . 5.000 2.642 2.440 2.834 . 0 0 "[ . 1 . 2]" 1
729 1 68 TYR HA 1 69 ALA H 1.800 . 5.000 3.548 3.531 3.559 . 0 0 "[ . 1 . 2]" 1
730 1 68 TYR QD 1 69 ALA H 1.800 . 5.000 2.615 2.528 2.969 . 0 0 "[ . 1 . 2]" 1
731 1 68 TYR QE 1 69 ALA H 1.800 . 5.500 4.791 4.713 4.932 . 0 0 "[ . 1 . 2]" 1
732 1 69 ALA H 1 70 GLU H 1.800 . 3.600 2.741 2.686 2.778 . 0 0 "[ . 1 . 2]" 1
733 1 69 ALA H 1 70 GLU QB 1.800 . 5.500 4.715 4.685 4.742 . 0 0 "[ . 1 . 2]" 1
734 1 69 ALA H 1 71 TYR H 1.800 . 5.000 4.506 4.335 4.616 . 0 0 "[ . 1 . 2]" 1
735 1 69 ALA H 1 69 ALA MB 1.800 . 4.200 2.217 2.201 2.233 . 0 0 "[ . 1 . 2]" 1
736 1 66 GLN HA 1 70 GLU H 1.800 . 5.000 4.880 4.779 5.028 0.028 19 0 "[ . 1 . 2]" 1
737 1 67 LYS HA 1 70 GLU H 1.800 . 5.000 3.412 3.262 3.498 . 0 0 "[ . 1 . 2]" 1
738 1 68 TYR HA 1 70 GLU H 1.800 . 5.000 3.940 3.850 4.157 . 0 0 "[ . 1 . 2]" 1
739 1 69 ALA HA 1 70 GLU H 1.800 . 5.000 3.514 3.501 3.543 . 0 0 "[ . 1 . 2]" 1
740 1 70 GLU H 1 71 TYR HA 1.800 . 5.000 5.109 5.085 5.129 0.129 15 0 "[ . 1 . 2]" 1
741 1 70 GLU H 1 71 TYR QB 1.800 . 5.500 4.576 4.340 4.786 . 0 0 "[ . 1 . 2]" 1
742 1 70 GLU H 1 71 TYR H 1.800 . 3.600 2.473 2.408 2.510 . 0 0 "[ . 1 . 2]" 1
743 1 70 GLU H 1 71 TYR QD 1.800 . 5.500 3.978 3.817 4.130 . 0 0 "[ . 1 . 2]" 1
744 1 70 GLU H 1 72 GLY H 1.800 . 5.000 3.647 3.458 3.747 . 0 0 "[ . 1 . 2]" 1
745 1 70 GLU H 1 70 GLU QB 1.800 . 3.600 2.303 2.280 2.333 . 0 0 "[ . 1 . 2]" 1
746 1 70 GLU H 1 70 GLU QG 1.800 . 3.600 2.668 2.579 2.707 . 0 0 "[ . 1 . 2]" 1
747 1 67 LYS HA 1 71 TYR H 1.800 . 5.000 3.749 3.531 3.979 . 0 0 "[ . 1 . 2]" 1
748 1 68 TYR HA 1 71 TYR H 1.800 . 5.000 3.402 3.251 3.544 . 0 0 "[ . 1 . 2]" 1
749 1 68 TYR H 1 71 TYR H 1.800 . 5.000 4.622 4.535 4.780 . 0 0 "[ . 1 . 2]" 1
750 1 69 ALA HA 1 71 TYR H 1.800 . 5.500 5.277 5.084 5.370 . 0 0 "[ . 1 . 2]" 1
751 1 70 GLU HA 1 71 TYR H 1.800 . 3.600 3.588 3.574 3.601 0.001 20 0 "[ . 1 . 2]" 1
752 1 70 GLU QB 1 71 TYR H 1.800 . 3.600 2.279 2.238 2.433 . 0 0 "[ . 1 . 2]" 1
753 1 70 GLU QG 1 71 TYR H 1.800 . 5.000 4.056 4.013 4.110 . 0 0 "[ . 1 . 2]" 1
754 1 71 TYR H 1 72 GLY H 1.800 . 3.600 2.536 2.367 2.639 . 0 0 "[ . 1 . 2]" 1
755 1 71 TYR H 1 72 GLY QA 1.800 . 5.000 4.423 4.326 4.503 . 0 0 "[ . 1 . 2]" 1
756 1 71 TYR H 1 71 TYR QD 1.800 . 5.000 2.365 2.159 2.604 . 0 0 "[ . 1 . 2]" 1
757 1 71 TYR H 1 71 TYR QB 1.800 . 3.600 2.495 2.346 2.646 . 0 0 "[ . 1 . 2]" 1
758 1 71 TYR H 1 78 ILE MD 1.800 . 5.000 4.025 3.910 4.076 . 0 0 "[ . 1 . 2]" 1
759 1 68 TYR QE 1 72 GLY H 1.800 . 5.500 5.108 4.939 5.295 . 0 0 "[ . 1 . 2]" 1
760 1 68 TYR HA 1 72 GLY H 1.800 . 5.000 1.992 1.811 3.293 . 0 0 "[ . 1 . 2]" 1
761 1 69 ALA H 1 72 GLY H 1.800 . 5.500 4.339 4.209 4.620 . 0 0 "[ . 1 . 2]" 1
762 1 69 ALA HA 1 72 GLY H 1.800 . 5.500 4.656 4.065 4.802 . 0 0 "[ . 1 . 2]" 1
763 1 71 TYR HA 1 72 GLY H 1.800 . 5.000 3.544 3.303 3.572 . 0 0 "[ . 1 . 2]" 1
764 1 71 TYR QB 1 72 GLY H 1.800 . 4.600 2.611 2.504 3.390 . 0 0 "[ . 1 . 2]" 1
765 1 72 GLY H 1 73 PRO QD 1.800 . 5.000 4.455 4.396 4.511 . 0 0 "[ . 1 . 2]" 1
766 1 72 GLY H 1 74 LYS H 1.800 . 5.000 4.082 3.976 4.330 . 0 0 "[ . 1 . 2]" 1
767 1 72 GLY H 1 74 LYS QB 1.800 . 5.500 4.570 4.539 4.630 . 0 0 "[ . 1 . 2]" 1
768 1 72 GLY H 1 78 ILE MD 1.800 . 5.500 3.968 3.705 4.282 . 0 0 "[ . 1 . 2]" 1
769 1 71 TYR HA 1 74 LYS H 1.800 . 5.000 5.139 5.042 5.163 0.163 14 0 "[ . 1 . 2]" 1
770 1 71 TYR QB 1 74 LYS H 1.800 . 5.000 3.474 3.338 3.542 . 0 0 "[ . 1 . 2]" 1
771 1 72 GLY QA 1 74 LYS H 1.800 . 5.000 3.339 3.276 3.459 . 0 0 "[ . 1 . 2]" 1
772 1 73 PRO QD 1 74 LYS H 1.800 . 5.000 3.431 3.283 3.571 . 0 0 "[ . 1 . 2]" 1
773 1 73 PRO HA 1 74 LYS H 1.800 . 3.600 3.076 3.025 3.138 . 0 0 "[ . 1 . 2]" 1
774 1 73 PRO QB 1 74 LYS H 1.800 . 5.000 3.902 3.801 4.007 . 0 0 "[ . 1 . 2]" 1
775 1 74 LYS H 1 75 TRP H 1.800 . 4.400 3.685 3.571 3.748 . 0 0 "[ . 1 . 2]" 1
776 1 74 LYS H 1 75 TRP HE3 1.800 . 5.000 5.057 5.019 5.100 0.100 7 0 "[ . 1 . 2]" 1
777 1 74 LYS H 1 76 ASN H 1.800 . 5.000 5.004 4.972 5.054 0.054 20 0 "[ . 1 . 2]" 1
778 1 74 LYS H 1 78 ILE QG 1.800 . 5.500 4.032 3.925 4.437 . 0 0 "[ . 1 . 2]" 1
779 1 74 LYS H 1 78 ILE MD 1.800 . 5.500 4.355 2.981 4.493 . 0 0 "[ . 1 . 2]" 1
780 1 74 LYS H 1 74 LYS QB 1.800 . 3.600 2.294 2.228 2.427 . 0 0 "[ . 1 . 2]" 1
781 1 74 LYS H 1 74 LYS QG 1.800 . 3.600 2.585 2.277 2.685 . 0 0 "[ . 1 . 2]" 1
782 1 73 PRO HA 1 75 TRP H 1.800 . 5.000 3.926 3.750 4.059 . 0 0 "[ . 1 . 2]" 1
783 1 73 PRO QB 1 75 TRP H 1.800 . 5.000 4.182 4.056 4.263 . 0 0 "[ . 1 . 2]" 1
784 1 74 LYS HA 1 75 TRP H 1.800 . 2.800 2.521 2.467 2.568 . 0 0 "[ . 1 . 2]" 1
785 1 74 LYS QB 1 75 TRP H 1.800 . 4.200 3.900 3.890 3.913 . 0 0 "[ . 1 . 2]" 1
786 1 74 LYS QG 1 75 TRP H 1.800 . 5.000 4.446 4.420 4.474 . 0 0 "[ . 1 . 2]" 1
787 1 75 TRP H 1 76 ASN H 1.800 . 3.600 2.766 2.683 2.834 . 0 0 "[ . 1 . 2]" 1
788 1 75 TRP H 1 76 ASN HA 1.800 . 6.000 5.288 5.205 5.387 . 0 0 "[ . 1 . 2]" 1
789 1 75 TRP H 1 76 ASN QB 1.800 . 5.500 4.645 4.530 4.911 . 0 0 "[ . 1 . 2]" 1
790 1 75 TRP H 1 78 ILE H 1.800 . 5.000 4.897 4.813 5.002 0.002 20 0 "[ . 1 . 2]" 1
791 1 75 TRP H 1 87 ASP QB 1.800 . 5.000 4.431 4.350 4.511 . 0 0 "[ . 1 . 2]" 1
792 1 75 TRP H 1 91 ARG QB 1.800 . 6.000 5.105 5.064 5.154 . 0 0 "[ . 1 . 2]" 1
793 1 75 TRP H 1 75 TRP QB 1.800 . 3.600 2.754 2.717 2.801 . 0 0 "[ . 1 . 2]" 1
794 1 73 PRO HA 1 75 TRP HE1 1.800 . 5.000 4.276 3.968 4.433 . 0 0 "[ . 1 . 2]" 1
795 1 73 PRO QB 1 75 TRP HE1 1.800 . 3.600 3.196 3.125 3.259 . 0 0 "[ . 1 . 2]" 1
796 1 75 TRP HE1 1 91 ARG HA 1.800 . 5.000 3.140 2.889 3.538 . 0 0 "[ . 1 . 2]" 1
797 1 75 TRP HE1 1 91 ARG QB 1.800 . 5.000 2.786 2.330 3.103 . 0 0 "[ . 1 . 2]" 1
798 1 75 TRP HE1 1 91 ARG QG 1.800 . 5.000 2.145 1.800 3.160 . 0 0 "[ . 1 . 2]" 1
799 1 75 TRP HE1 1 91 ARG QD 1.800 . 4.200 3.064 1.792 3.690 0.008 17 0 "[ . 1 . 2]" 1
800 1 74 LYS HA 1 76 ASN H 1.800 . 5.000 2.988 2.942 3.028 . 0 0 "[ . 1 . 2]" 1
801 1 74 LYS QB 1 76 ASN H 1.800 . 5.000 3.179 3.096 3.287 . 0 0 "[ . 1 . 2]" 1
802 1 75 TRP HA 1 76 ASN H 1.800 . 4.000 3.331 3.292 3.388 . 0 0 "[ . 1 . 2]" 1
803 1 75 TRP QB 1 76 ASN H 1.800 . 5.000 3.293 3.203 3.370 . 0 0 "[ . 1 . 2]" 1
804 1 76 ASN H 1 77 LYS H 1.800 . 2.800 2.481 2.429 2.557 . 0 0 "[ . 1 . 2]" 1
805 1 76 ASN H 1 78 ILE H 1.800 . 5.000 3.794 3.733 3.844 . 0 0 "[ . 1 . 2]" 1
806 1 76 ASN H 1 78 ILE HB 1.800 . 5.000 5.107 4.932 5.135 0.135 13 0 "[ . 1 . 2]" 1
807 1 76 ASN H 1 78 ILE QG 1.800 . 5.500 4.166 4.110 4.658 . 0 0 "[ . 1 . 2]" 1
808 1 76 ASN H 1 79 SER H 1.800 . 5.000 4.577 4.523 4.642 . 0 0 "[ . 1 . 2]" 1
809 1 76 ASN H 1 76 ASN QB 1.800 . 3.600 2.371 2.278 2.730 . 0 0 "[ . 1 . 2]" 1
810 1 74 LYS HA 1 77 LYS H 1.800 . 5.000 4.296 4.135 4.398 . 0 0 "[ . 1 . 2]" 1
811 1 74 LYS QB 1 77 LYS H 1.800 . 5.000 2.775 2.674 2.855 . 0 0 "[ . 1 . 2]" 1
812 1 75 TRP H 1 77 LYS H 1.800 . 5.000 4.568 4.432 4.639 . 0 0 "[ . 1 . 2]" 1
813 1 75 TRP HA 1 77 LYS H 1.800 . 5.000 3.956 3.875 4.110 . 0 0 "[ . 1 . 2]" 1
814 1 75 TRP QB 1 77 LYS H 1.800 . 5.500 4.936 4.852 5.006 . 0 0 "[ . 1 . 2]" 1
815 1 76 ASN HA 1 77 LYS H 1.800 . 5.000 3.526 3.511 3.538 . 0 0 "[ . 1 . 2]" 1
816 1 76 ASN QB 1 77 LYS H 1.800 . 4.200 2.807 2.621 3.450 . 0 0 "[ . 1 . 2]" 1
817 1 77 LYS H 1 78 ILE H 1.800 . 2.800 2.294 2.208 2.318 . 0 0 "[ . 1 . 2]" 1
818 1 77 LYS H 1 78 ILE HA 1.800 . 5.000 5.013 4.955 5.028 0.028 18 0 "[ . 1 . 2]" 1
819 1 77 LYS H 1 78 ILE QG 1.800 . 5.000 3.413 3.348 3.451 . 0 0 "[ . 1 . 2]" 1
820 1 77 LYS H 1 78 ILE HB 1.800 . 5.000 4.716 4.477 4.753 . 0 0 "[ . 1 . 2]" 1
821 1 77 LYS H 1 78 ILE MD 1.800 . 5.000 4.022 3.984 4.219 . 0 0 "[ . 1 . 2]" 1
822 1 77 LYS H 1 79 SER H 1.800 . 5.000 4.135 4.054 4.214 . 0 0 "[ . 1 . 2]" 1
823 1 77 LYS H 1 80 LYS H 1.800 . 5.000 4.877 4.741 5.049 0.049 20 0 "[ . 1 . 2]" 1
824 1 77 LYS H 1 77 LYS QB 1.800 . 3.600 2.370 2.238 2.535 . 0 0 "[ . 1 . 2]" 1
825 1 77 LYS H 1 77 LYS QG 1.800 . 5.000 2.732 2.105 4.092 . 0 0 "[ . 1 . 2]" 1
826 1 71 TYR QB 1 78 ILE H 1.800 . 5.500 4.461 4.301 4.651 . 0 0 "[ . 1 . 2]" 1
827 1 75 TRP HA 1 78 ILE H 1.800 . 5.000 2.996 2.920 3.268 . 0 0 "[ . 1 . 2]" 1
828 1 76 ASN HA 1 78 ILE H 1.800 . 5.000 4.560 4.318 4.686 . 0 0 "[ . 1 . 2]" 1
829 1 77 LYS HA 1 78 ILE H 1.800 . 5.000 3.525 3.475 3.544 . 0 0 "[ . 1 . 2]" 1
830 1 77 LYS QB 1 78 ILE H 1.800 . 5.000 2.614 2.543 2.709 . 0 0 "[ . 1 . 2]" 1
831 1 77 LYS QG 1 78 ILE H 1.800 . 5.000 4.073 3.786 4.542 . 0 0 "[ . 1 . 2]" 1
832 1 78 ILE H 1 79 SER H 1.800 . 3.600 2.731 2.585 2.820 . 0 0 "[ . 1 . 2]" 1
833 1 78 ILE H 1 78 ILE QG 1.800 . 5.000 1.843 1.817 1.933 . 0 0 "[ . 1 . 2]" 1
834 1 78 ILE H 1 78 ILE MG 1.800 . 5.000 3.745 3.738 3.764 . 0 0 "[ . 1 . 2]" 1
835 1 78 ILE H 1 78 ILE MD 1.800 . 5.000 2.550 2.448 3.180 . 0 0 "[ . 1 . 2]" 1
836 1 78 ILE MD 1 79 SER H 1.800 . 5.500 4.307 4.128 4.325 . 0 0 "[ . 1 . 2]" 1
837 1 78 ILE QG 1 79 SER H 1.800 . 5.500 3.572 3.523 3.908 . 0 0 "[ . 1 . 2]" 1
838 1 78 ILE MG 1 79 SER H 1.800 . 5.000 3.521 3.481 3.555 . 0 0 "[ . 1 . 2]" 1
839 1 78 ILE HB 1 79 SER H 1.800 . 5.000 2.254 2.205 2.436 . 0 0 "[ . 1 . 2]" 1
840 1 78 ILE HA 1 79 SER H 1.800 . 5.000 3.580 3.557 3.591 . 0 0 "[ . 1 . 2]" 1
841 1 75 TRP H 1 79 SER H 1.800 . 5.500 5.595 5.557 5.636 0.136 11 0 "[ . 1 . 2]" 1
842 1 75 TRP HA 1 79 SER H 1.800 . 5.000 3.136 3.074 3.241 . 0 0 "[ . 1 . 2]" 1
843 1 75 TRP QB 1 79 SER H 1.800 . 5.000 3.682 3.613 3.869 . 0 0 "[ . 1 . 2]" 1
844 1 76 ASN HA 1 79 SER H 1.800 . 5.000 4.030 3.860 4.127 . 0 0 "[ . 1 . 2]" 1
845 1 77 LYS HA 1 79 SER H 1.800 . 5.000 4.852 4.805 4.904 . 0 0 "[ . 1 . 2]" 1
846 1 77 LYS QB 1 79 SER H 1.800 . 5.500 4.954 4.926 4.988 . 0 0 "[ . 1 . 2]" 1
847 1 79 SER H 1 80 LYS H 1.800 . 3.600 2.862 2.804 2.911 . 0 0 "[ . 1 . 2]" 1
848 1 79 SER H 1 81 PHE H 1.800 . 5.000 4.205 4.115 4.284 . 0 0 "[ . 1 . 2]" 1
849 1 79 SER H 1 82 LEU H 1.800 . 5.000 5.055 5.006 5.137 0.137 12 0 "[ . 1 . 2]" 1
850 1 79 SER H 1 79 SER QB 1.800 . 3.600 2.378 2.247 2.693 . 0 0 "[ . 1 . 2]" 1
851 1 79 SER H 1 87 ASP QB 1.800 . 5.500 4.749 4.692 4.816 . 0 0 "[ . 1 . 2]" 1
852 1 79 SER H 1 90 ILE MD 1.800 . 5.000 2.810 2.741 2.905 . 0 0 "[ . 1 . 2]" 1
853 1 79 SER H 1 90 ILE QG 1.800 . 5.500 5.017 4.961 5.126 . 0 0 "[ . 1 . 2]" 1
854 1 79 SER H 1 90 ILE MG 1.800 . 5.500 4.336 4.303 4.395 . 0 0 "[ . 1 . 2]" 1
855 1 79 SER HA 1 80 LYS H 1.800 . 5.000 3.485 3.477 3.500 . 0 0 "[ . 1 . 2]" 1
856 1 79 SER QB 1 80 LYS H 1.800 . 5.000 3.311 2.899 3.634 . 0 0 "[ . 1 . 2]" 1
857 1 80 LYS H 1 81 PHE HA 1.800 . 5.000 5.097 5.068 5.117 0.117 2 0 "[ . 1 . 2]" 1
858 1 80 LYS H 1 81 PHE H 1.800 . 3.000 2.398 2.366 2.421 . 0 0 "[ . 1 . 2]" 1
859 1 80 LYS H 1 81 PHE QB 1.800 . 5.000 4.230 4.192 4.261 . 0 0 "[ . 1 . 2]" 1
860 1 80 LYS H 1 81 PHE QD 1.800 . 5.500 4.181 3.632 4.453 . 0 0 "[ . 1 . 2]" 1
861 1 76 ASN HA 1 80 LYS H 1.800 . 5.000 4.794 4.656 5.017 0.017 20 0 "[ . 1 . 2]" 1
862 1 77 LYS HA 1 80 LYS H 1.800 . 5.000 3.702 3.550 3.933 . 0 0 "[ . 1 . 2]" 1
863 1 80 LYS H 1 82 LEU H 1.800 . 5.000 3.788 3.694 3.860 . 0 0 "[ . 1 . 2]" 1
864 1 78 ILE H 1 80 LYS H 1.800 . 5.000 3.918 3.870 3.956 . 0 0 "[ . 1 . 2]" 1
865 1 78 ILE HB 1 80 LYS H 1.800 . 5.000 4.617 4.582 4.746 . 0 0 "[ . 1 . 2]" 1
866 1 78 ILE HA 1 80 LYS H 1.800 . 5.000 3.817 3.726 3.903 . 0 0 "[ . 1 . 2]" 1
867 1 78 ILE QG 1 80 LYS H 1.800 . 6.000 5.254 5.148 5.305 . 0 0 "[ . 1 . 2]" 1
868 1 80 LYS H 1 90 ILE MD 1.800 . 5.500 4.669 4.600 4.715 . 0 0 "[ . 1 . 2]" 1
869 1 80 LYS H 1 80 LYS QB 1.800 . 3.600 2.308 2.166 2.374 . 0 0 "[ . 1 . 2]" 1
870 1 80 LYS H 1 80 LYS QG 1.800 . 3.600 2.638 2.517 3.061 . 0 0 "[ . 1 . 2]" 1
871 1 80 LYS H 1 80 LYS QD 1.800 . 5.000 3.946 3.735 4.540 . 0 0 "[ . 1 . 2]" 1
872 1 78 ILE HA 1 81 PHE H 1.800 . 5.000 3.298 3.187 3.389 . 0 0 "[ . 1 . 2]" 1
873 1 79 SER HA 1 81 PHE H 1.800 . 5.000 3.885 3.795 4.031 . 0 0 "[ . 1 . 2]" 1
874 1 80 LYS HA 1 81 PHE H 1.800 . 3.600 3.448 3.438 3.473 . 0 0 "[ . 1 . 2]" 1
875 1 80 LYS QB 1 81 PHE H 1.800 . 5.000 3.149 2.995 3.592 . 0 0 "[ . 1 . 2]" 1
876 1 80 LYS QG 1 81 PHE H 1.800 . 5.000 3.836 2.265 4.373 . 0 0 "[ . 1 . 2]" 1
877 1 81 PHE H 1 82 LEU H 1.800 . 2.800 2.248 2.201 2.360 . 0 0 "[ . 1 . 2]" 1
878 1 81 PHE H 1 82 LEU MD1 1.800 . 5.500 3.589 2.973 4.674 . 0 0 "[ . 1 . 2]" 1
879 1 81 PHE H 1 82 LEU MD2 1.800 . 5.500 4.525 4.197 4.622 . 0 0 "[ . 1 . 2]" 1
880 1 81 PHE H 1 83 LYS H 1.800 . 5.000 4.375 4.223 4.562 . 0 0 "[ . 1 . 2]" 1
881 1 81 PHE H 1 81 PHE QB 1.800 . 3.600 2.204 2.190 2.241 . 0 0 "[ . 1 . 2]" 1
882 1 78 ILE HA 1 82 LEU H 1.800 . 5.000 4.937 4.781 5.071 0.071 20 0 "[ . 1 . 2]" 1
883 1 79 SER HA 1 82 LEU H 1.800 . 5.000 3.325 3.234 3.487 . 0 0 "[ . 1 . 2]" 1
884 1 80 LYS HA 1 82 LEU H 1.800 . 5.000 3.698 3.446 3.816 . 0 0 "[ . 1 . 2]" 1
885 1 80 LYS QB 1 82 LEU H 1.800 . 5.000 4.560 4.459 4.670 . 0 0 "[ . 1 . 2]" 1
886 1 80 LYS QG 1 82 LEU H 1.800 . 6.000 5.028 4.228 5.315 . 0 0 "[ . 1 . 2]" 1
887 1 81 PHE HA 1 82 LEU H 1.800 . 3.800 3.370 3.328 3.399 . 0 0 "[ . 1 . 2]" 1
888 1 81 PHE QB 1 82 LEU H 1.800 . 4.000 3.136 3.059 3.236 . 0 0 "[ . 1 . 2]" 1
889 1 82 LEU H 1 83 LYS HA 1.800 . 5.000 4.580 4.445 4.651 . 0 0 "[ . 1 . 2]" 1
890 1 82 LEU H 1 83 LYS H 1.800 . 5.000 2.496 2.353 2.647 . 0 0 "[ . 1 . 2]" 1
891 1 82 LEU H 1 84 ASN H 1.800 . 5.000 4.450 4.322 4.579 . 0 0 "[ . 1 . 2]" 1
892 1 82 LEU H 1 82 LEU QB 1.800 . 3.600 2.395 2.263 2.664 . 0 0 "[ . 1 . 2]" 1
893 1 82 LEU H 1 82 LEU MD1 1.800 . 5.000 2.777 2.218 3.747 . 0 0 "[ . 1 . 2]" 1
894 1 82 LEU H 1 82 LEU MD2 1.800 . 5.000 3.540 3.186 3.715 . 0 0 "[ . 1 . 2]" 1
895 1 82 LEU H 1 82 LEU HG 1.800 . 5.000 3.554 2.224 4.343 . 0 0 "[ . 1 . 2]" 1
896 1 81 PHE HA 1 83 LYS H 1.800 . 6.000 5.330 5.111 5.536 . 0 0 "[ . 1 . 2]" 1
897 1 82 LEU HA 1 83 LYS H 1.800 . 3.600 3.579 3.571 3.586 . 0 0 "[ . 1 . 2]" 1
898 1 82 LEU QB 1 83 LYS H 1.800 . 5.000 2.145 1.960 2.296 . 0 0 "[ . 1 . 2]" 1
899 1 82 LEU QD 1 83 LYS H 1.800 . 6.000 3.643 3.556 3.815 . 0 0 "[ . 1 . 2]" 1
900 1 83 LYS H 1 84 ASN HA 1.800 . 5.000 5.191 5.137 5.268 0.268 20 0 "[ . 1 . 2]" 1
901 1 83 LYS H 1 84 ASN H 1.800 . 5.000 2.521 2.448 2.612 . 0 0 "[ . 1 . 2]" 1
902 1 83 LYS H 1 84 ASN QB 1.800 . 5.500 4.716 4.691 4.760 . 0 0 "[ . 1 . 2]" 1
903 1 83 LYS H 1 85 ARG H 1.800 . 5.000 3.351 3.225 3.475 . 0 0 "[ . 1 . 2]" 1
904 1 83 LYS H 1 83 LYS QE 1.800 . 5.000 4.450 3.173 4.606 . 0 0 "[ . 1 . 2]" 1
905 1 83 LYS H 1 83 LYS QG 1.800 . 5.000 3.620 2.638 4.356 . 0 0 "[ . 1 . 2]" 1
906 1 83 LYS HA 1 84 ASN H 1.800 . 3.800 3.196 3.136 3.314 . 0 0 "[ . 1 . 2]" 1
907 1 83 LYS QB 1 84 ASN H 1.800 . 5.000 3.478 3.268 3.596 . 0 0 "[ . 1 . 2]" 1
908 1 83 LYS QG 1 84 ASN H 1.800 . 5.500 4.395 4.015 4.686 . 0 0 "[ . 1 . 2]" 1
909 1 82 LEU HA 1 84 ASN H 1.800 . 5.000 3.684 3.550 3.854 . 0 0 "[ . 1 . 2]" 1
910 1 82 LEU QB 1 84 ASN H 1.800 . 5.000 2.226 2.132 2.435 . 0 0 "[ . 1 . 2]" 1
911 1 82 LEU QD 1 84 ASN H 1.800 . 6.000 3.920 3.791 4.011 . 0 0 "[ . 1 . 2]" 1
912 1 84 ASN H 1 85 ARG HA 1.800 . 5.000 4.704 4.638 4.847 . 0 0 "[ . 1 . 2]" 1
913 1 84 ASN H 1 85 ARG H 1.800 . 3.000 1.846 1.774 2.024 0.026 6 0 "[ . 1 . 2]" 1
914 1 84 ASN H 1 84 ASN QB 1.800 . 3.600 2.481 2.376 2.567 . 0 0 "[ . 1 . 2]" 1
915 1 83 LYS HA 1 84 ASN QD 1.800 . 5.500 3.880 3.725 4.053 . 0 0 "[ . 1 . 2]" 1
916 1 83 LYS QB 1 84 ASN QD 1.800 . 4.800 2.338 2.201 2.682 . 0 0 "[ . 1 . 2]" 1
917 1 83 LYS QG 1 84 ASN QD 1.800 . 4.800 3.690 3.492 3.859 . 0 0 "[ . 1 . 2]" 1
918 1 51 LEU QD 1 85 ARG H 1.800 . 6.000 3.887 3.754 4.215 . 0 0 "[ . 1 . 2]" 1
919 1 82 LEU HA 1 85 ARG H 1.800 . 5.000 4.812 4.570 5.013 0.013 4 0 "[ . 1 . 2]" 1
920 1 82 LEU HG 1 85 ARG H 1.800 . 5.000 4.745 4.424 5.068 0.068 4 0 "[ . 1 . 2]" 1
921 1 82 LEU QD 1 85 ARG H 1.800 . 5.000 3.485 3.329 3.607 . 0 0 "[ . 1 . 2]" 1
922 1 83 LYS HA 1 85 ARG H 1.800 . 5.000 4.160 3.956 4.492 . 0 0 "[ . 1 . 2]" 1
923 1 83 LYS QB 1 85 ARG H 1.800 . 5.500 4.989 4.869 5.033 . 0 0 "[ . 1 . 2]" 1
924 1 84 ASN HA 1 85 ARG H 1.800 . 3.800 3.444 3.368 3.518 . 0 0 "[ . 1 . 2]" 1
925 1 84 ASN QB 1 85 ARG H 1.800 . 4.400 2.992 2.677 3.218 . 0 0 "[ . 1 . 2]" 1
926 1 84 ASN QD 1 85 ARG H 1.800 . 5.000 4.083 3.972 4.256 . 0 0 "[ . 1 . 2]" 1
927 1 85 ARG H 1 86 SER H 1.800 . 5.000 4.446 4.331 4.523 . 0 0 "[ . 1 . 2]" 1
928 1 85 ARG H 1 85 ARG QB 1.800 . 3.600 2.598 2.284 2.812 . 0 0 "[ . 1 . 2]" 1
929 1 85 ARG H 1 85 ARG QG 1.800 . 5.000 3.238 2.138 3.730 . 0 0 "[ . 1 . 2]" 1
930 1 51 LEU QD 1 86 SER H 3.000 3.000 6.000 2.464 2.234 2.888 0.766 14 15 "[******** * **+-** 2]" 1
931 1 85 ARG HA 1 86 SER H 1.800 . 2.800 2.550 2.436 2.701 . 0 0 "[ . 1 . 2]" 1
932 1 85 ARG QB 1 86 SER H 1.800 . 5.000 2.145 1.822 2.368 . 0 0 "[ . 1 . 2]" 1
933 1 86 SER H 1 87 ASP H 1.800 . 5.000 4.420 4.272 4.462 . 0 0 "[ . 1 . 2]" 1
934 1 86 SER H 1 87 ASP HA 1.800 . 5.000 5.099 5.006 5.193 0.193 17 0 "[ . 1 . 2]" 1
935 1 86 SER H 1 89 ASN H 1.800 . 5.000 3.226 3.149 3.325 . 0 0 "[ . 1 . 2]" 1
936 1 86 SER H 1 89 ASN QB 1.800 . 5.000 2.040 1.808 2.227 . 0 0 "[ . 1 . 2]" 1
937 1 86 SER H 1 90 ILE MD 1.800 . 6.000 4.001 3.440 4.344 . 0 0 "[ . 1 . 2]" 1
938 1 45 ASN HA 1 87 ASP H 1.800 . 6.000 4.224 3.640 4.772 . 0 0 "[ . 1 . 2]" 1
939 1 46 TYR QD 1 87 ASP H 1.800 . 5.000 4.491 4.135 4.831 . 0 0 "[ . 1 . 2]" 1
940 1 46 TYR QE 1 87 ASP H 1.800 . 6.000 5.322 5.128 5.571 . 0 0 "[ . 1 . 2]" 1
941 1 51 LEU QD 1 87 ASP H 3.000 3.000 6.000 4.543 4.450 4.626 . 0 0 "[ . 1 . 2]" 1
942 1 86 SER HA 1 87 ASP H 1.800 . 2.800 2.343 2.230 2.571 . 0 0 "[ . 1 . 2]" 1
943 1 86 SER QB 1 87 ASP H 1.800 . 3.600 2.818 2.421 3.417 . 0 0 "[ . 1 . 2]" 1
944 1 87 ASP H 1 88 ASN H 1.800 . 3.600 2.620 2.431 2.698 . 0 0 "[ . 1 . 2]" 1
945 1 87 ASP H 1 89 ASN H 1.800 . 5.000 4.024 3.963 4.052 . 0 0 "[ . 1 . 2]" 1
946 1 87 ASP H 1 89 ASN QB 1.800 . 5.500 5.005 4.920 5.065 . 0 0 "[ . 1 . 2]" 1
947 1 87 ASP H 1 90 ILE HB 1.800 . 5.000 5.028 4.949 5.082 0.082 11 0 "[ . 1 . 2]" 1
948 1 87 ASP H 1 90 ILE QG 1.800 . 5.500 4.720 4.625 4.992 . 0 0 "[ . 1 . 2]" 1
949 1 87 ASP H 1 90 ILE MD 1.800 . 5.000 3.960 3.807 4.039 . 0 0 "[ . 1 . 2]" 1
950 1 87 ASP H 1 90 ILE H 1.800 . 5.500 4.650 4.602 4.697 . 0 0 "[ . 1 . 2]" 1
951 1 87 ASP H 1 87 ASP HA 1.800 . 2.800 2.832 2.807 2.889 0.089 14 0 "[ . 1 . 2]" 1
952 1 87 ASP H 1 87 ASP QB 1.800 . 3.600 2.665 2.623 2.705 . 0 0 "[ . 1 . 2]" 1
953 1 75 TRP QB 1 88 ASN H 1.800 . 5.500 5.024 4.961 5.052 . 0 0 "[ . 1 . 2]" 1
954 1 86 SER HA 1 88 ASN H 1.800 . 5.000 4.106 3.849 4.476 . 0 0 "[ . 1 . 2]" 1
955 1 86 SER QB 1 88 ASN H 1.800 . 5.000 2.744 2.303 3.370 . 0 0 "[ . 1 . 2]" 1
956 1 87 ASP HA 1 88 ASN H 1.800 . 4.400 3.487 3.446 3.523 . 0 0 "[ . 1 . 2]" 1
957 1 88 ASN H 1 89 ASN H 1.800 . 3.600 2.536 2.348 2.681 . 0 0 "[ . 1 . 2]" 1
958 1 88 ASN H 1 89 ASN QB 1.800 . 5.000 4.321 4.156 4.456 . 0 0 "[ . 1 . 2]" 1
959 1 88 ASN H 1 91 ARG H 1.800 . 5.000 4.691 4.562 4.817 . 0 0 "[ . 1 . 2]" 1
960 1 88 ASN H 1 91 ARG QB 1.800 . 5.500 4.695 4.479 4.961 . 0 0 "[ . 1 . 2]" 1
961 1 88 ASN H 1 88 ASN QB 1.800 . 3.600 2.326 2.267 2.658 . 0 0 "[ . 1 . 2]" 1
962 1 56 TRP HE1 1 89 ASN H 1.800 . 6.000 5.990 5.683 6.090 0.090 2 0 "[ . 1 . 2]" 1
963 1 85 ARG HA 1 89 ASN H 1.800 . 5.500 5.664 5.605 5.717 0.217 13 0 "[ . 1 . 2]" 1
964 1 87 ASP HA 1 89 ASN H 1.800 . 5.000 3.992 3.905 4.141 . 0 0 "[ . 1 . 2]" 1
965 1 88 ASN HA 1 89 ASN H 1.800 . 4.200 3.517 3.502 3.541 . 0 0 "[ . 1 . 2]" 1
966 1 88 ASN QB 1 89 ASN H 1.800 . 4.200 2.836 2.756 3.531 . 0 0 "[ . 1 . 2]" 1
967 1 89 ASN H 1 90 ILE HA 1.800 . 5.000 5.072 5.031 5.099 0.099 9 0 "[ . 1 . 2]" 1
968 1 89 ASN H 1 90 ILE H 1.800 . 3.000 2.359 2.283 2.438 . 0 0 "[ . 1 . 2]" 1
969 1 89 ASN H 1 91 ARG QB 1.800 . 5.500 4.821 4.706 4.917 . 0 0 "[ . 1 . 2]" 1
970 1 89 ASN H 1 89 ASN QB 1.800 . 3.600 2.266 2.233 2.293 . 0 0 "[ . 1 . 2]" 1
971 1 56 TRP HE1 1 89 ASN QD 1.800 . 5.000 4.153 3.201 4.525 . 0 0 "[ . 1 . 2]" 1
972 1 86 SER H 1 89 ASN QD 1.800 . 5.000 3.222 2.985 4.173 . 0 0 "[ . 1 . 2]" 1
973 1 89 ASN H 1 89 ASN QD 1.800 . 5.500 4.656 4.611 4.682 . 0 0 "[ . 1 . 2]" 1
974 1 51 LEU QD 1 89 ASN QD 1.800 . 6.000 3.627 2.742 3.858 . 0 0 "[ . 1 . 2]" 1
975 1 85 ARG QB 1 90 ILE H 1.800 . 5.000 3.798 3.389 4.208 . 0 0 "[ . 1 . 2]" 1
976 1 86 SER H 1 90 ILE H 1.800 . 5.000 3.659 3.111 4.059 . 0 0 "[ . 1 . 2]" 1
977 1 87 ASP HA 1 90 ILE H 1.800 . 5.000 3.225 3.092 3.513 . 0 0 "[ . 1 . 2]" 1
978 1 88 ASN H 1 90 ILE H 1.800 . 5.000 4.067 3.887 4.216 . 0 0 "[ . 1 . 2]" 1
979 1 88 ASN HA 1 90 ILE H 1.800 . 5.000 4.621 4.191 4.893 . 0 0 "[ . 1 . 2]" 1
980 1 88 ASN QB 1 90 ILE H 1.800 . 5.500 4.837 4.727 4.993 . 0 0 "[ . 1 . 2]" 1
981 1 89 ASN HA 1 90 ILE H 1.800 . 4.600 3.531 3.475 3.558 . 0 0 "[ . 1 . 2]" 1
982 1 89 ASN QB 1 90 ILE H 1.800 . 3.600 2.453 2.245 2.754 . 0 0 "[ . 1 . 2]" 1
983 1 90 ILE H 1 91 ARG H 1.800 . 3.000 2.720 2.443 2.941 . 0 0 "[ . 1 . 2]" 1
984 1 90 ILE H 1 91 ARG QB 1.800 . 5.500 4.386 4.157 4.602 . 0 0 "[ . 1 . 2]" 1
985 1 90 ILE H 1 90 ILE HB 1.800 . 3.600 2.502 2.429 2.557 . 0 0 "[ . 1 . 2]" 1
986 1 90 ILE H 1 90 ILE QG 1.800 . 5.000 2.003 1.876 2.187 . 0 0 "[ . 1 . 2]" 1
987 1 90 ILE H 1 90 ILE MG 1.800 . 5.000 3.756 3.743 3.771 . 0 0 "[ . 1 . 2]" 1
988 1 90 ILE H 1 90 ILE MD 1.800 . 5.000 3.391 3.227 3.547 . 0 0 "[ . 1 . 2]" 1
989 1 75 TRP HE1 1 91 ARG H 1.800 . 5.500 4.743 4.597 4.858 . 0 0 "[ . 1 . 2]" 1
990 1 75 TRP QB 1 91 ARG H 1.800 . 5.000 3.522 3.298 3.778 . 0 0 "[ . 1 . 2]" 1
991 1 87 ASP HA 1 91 ARG H 1.800 . 5.000 3.249 2.953 3.538 . 0 0 "[ . 1 . 2]" 1
992 1 87 ASP QB 1 91 ARG H 1.800 . 5.500 4.099 3.815 4.541 . 0 0 "[ . 1 . 2]" 1
993 1 88 ASN HA 1 91 ARG H 1.800 . 4.400 3.977 3.632 4.149 . 0 0 "[ . 1 . 2]" 1
994 1 89 ASN H 1 91 ARG H 1.800 . 5.000 4.085 4.017 4.162 . 0 0 "[ . 1 . 2]" 1
995 1 89 ASN HA 1 91 ARG H 1.800 . 5.000 4.915 4.695 5.022 0.022 3 0 "[ . 1 . 2]" 1
996 1 89 ASN QB 1 91 ARG H 1.800 . 5.500 4.861 4.772 4.908 . 0 0 "[ . 1 . 2]" 1
997 1 90 ILE HA 1 91 ARG H 1.800 . 4.400 3.566 3.557 3.579 . 0 0 "[ . 1 . 2]" 1
998 1 90 ILE HB 1 91 ARG H 1.800 . 5.000 2.247 2.141 2.434 . 0 0 "[ . 1 . 2]" 1
999 1 90 ILE QG 1 91 ARG H 1.800 . 5.000 3.868 3.785 3.947 . 0 0 "[ . 1 . 2]" 1
1000 1 90 ILE MG 1 91 ARG H 1.800 . 5.000 3.224 3.088 3.393 . 0 0 "[ . 1 . 2]" 1
1001 1 91 ARG H 1 92 ASN H 1.800 . 3.200 2.659 2.509 2.724 . 0 0 "[ . 1 . 2]" 1
1002 1 91 ARG H 1 94 TRP QB 1.800 . 5.500 4.686 4.530 4.953 . 0 0 "[ . 1 . 2]" 1
1003 1 91 ARG H 1 92 ASN QB 1.800 . 5.000 4.478 4.340 4.527 . 0 0 "[ . 1 . 2]" 1
1004 1 91 ARG H 1 91 ARG QB 1.800 . 3.600 2.238 2.230 2.248 . 0 0 "[ . 1 . 2]" 1
1005 1 91 ARG H 1 91 ARG QG 1.800 . 5.000 3.975 3.950 4.047 . 0 0 "[ . 1 . 2]" 1
1006 1 91 ARG H 1 91 ARG QD 1.800 . 5.000 4.368 4.191 4.431 . 0 0 "[ . 1 . 2]" 1
1007 1 56 TRP HE1 1 92 ASN H 1.800 . 5.500 5.632 5.553 5.693 0.193 7 0 "[ . 1 . 2]" 1
1008 1 75 TRP HE1 1 92 ASN H 1.800 . 6.000 6.114 6.073 6.177 0.177 18 0 "[ . 1 . 2]" 1
1009 1 91 ARG QB 1 92 ASN H 1.800 . 3.600 2.660 2.630 2.717 . 0 0 "[ . 1 . 2]" 1
1010 1 91 ARG HA 1 92 ASN H 1.800 . 3.600 3.493 3.489 3.499 . 0 0 "[ . 1 . 2]" 1
1011 1 91 ARG QG 1 92 ASN H 1.800 . 5.000 3.857 3.604 3.950 . 0 0 "[ . 1 . 2]" 1
1012 1 91 ARG QD 1 92 ASN H 1.800 . 5.000 4.492 4.397 4.533 . 0 0 "[ . 1 . 2]" 1
1013 1 90 ILE HA 1 92 ASN H 1.800 . 5.000 4.077 4.021 4.164 . 0 0 "[ . 1 . 2]" 1
1014 1 90 ILE H 1 92 ASN H 1.800 . 5.000 3.757 3.573 3.923 . 0 0 "[ . 1 . 2]" 1
1015 1 89 ASN HA 1 92 ASN H 1.800 . 4.600 3.632 3.339 3.851 . 0 0 "[ . 1 . 2]" 1
1016 1 92 ASN H 1 93 ARG QB 1.800 . 5.500 4.390 4.242 4.499 . 0 0 "[ . 1 . 2]" 1
1017 1 92 ASN H 1 93 ARG HA 1.800 . 5.500 5.213 5.171 5.297 . 0 0 "[ . 1 . 2]" 1
1018 1 92 ASN H 1 93 ARG H 1.800 . 3.600 2.537 2.478 2.648 . 0 0 "[ . 1 . 2]" 1
1019 1 92 ASN H 1 94 TRP H 1.800 . 5.000 4.012 3.779 4.339 . 0 0 "[ . 1 . 2]" 1
1020 1 92 ASN H 1 92 ASN HA 1.800 . 3.000 2.926 2.902 2.944 . 0 0 "[ . 1 . 2]" 1
1021 1 92 ASN H 1 92 ASN QB 1.800 . 3.000 2.296 2.285 2.313 . 0 0 "[ . 1 . 2]" 1
1022 1 89 ASN HA 1 93 ARG H 1.800 . 5.000 3.873 3.542 4.294 . 0 0 "[ . 1 . 2]" 1
1023 1 90 ILE H 1 93 ARG H 1.800 . 5.000 4.412 4.250 4.553 . 0 0 "[ . 1 . 2]" 1
1024 1 90 ILE HA 1 93 ARG H 1.800 . 5.000 3.226 3.122 3.331 . 0 0 "[ . 1 . 2]" 1
1025 1 90 ILE QG 1 93 ARG H 1.800 . 5.500 5.062 5.033 5.091 . 0 0 "[ . 1 . 2]" 1
1026 1 91 ARG HA 1 93 ARG H 1.800 . 5.000 4.691 4.455 4.830 . 0 0 "[ . 1 . 2]" 1
1027 1 91 ARG QB 1 93 ARG H 1.800 . 5.500 4.860 4.747 4.905 . 0 0 "[ . 1 . 2]" 1
1028 1 92 ASN HA 1 93 ARG H 1.800 . 4.200 3.584 3.541 3.599 . 0 0 "[ . 1 . 2]" 1
1029 1 92 ASN QB 1 93 ARG H 1.800 . 3.200 2.571 2.545 2.615 . 0 0 "[ . 1 . 2]" 1
1030 1 93 ARG H 1 93 ARG QG 1.800 . 5.000 3.784 2.622 4.028 . 0 0 "[ . 1 . 2]" 1
1031 1 93 ARG H 1 93 ARG QD 1.800 . 5.000 3.470 2.156 4.564 . 0 0 "[ . 1 . 2]" 1
1032 1 93 ARG H 1 93 ARG QB 1.800 . 3.600 2.246 2.169 2.317 . 0 0 "[ . 1 . 2]" 1
1033 1 93 ARG H 1 94 TRP H 1.800 . 3.200 2.576 2.468 2.780 . 0 0 "[ . 1 . 2]" 1
1034 1 93 ARG H 1 94 TRP QB 1.800 . 5.000 4.342 4.254 4.416 . 0 0 "[ . 1 . 2]" 1
1035 1 93 ARG H 1 96 MET H 1.800 . 5.000 4.666 4.539 4.806 . 0 0 "[ . 1 . 2]" 1
1036 1 93 ARG H 1 96 MET QB 1.800 . 5.500 4.776 4.486 4.979 . 0 0 "[ . 1 . 2]" 1
1037 1 90 ILE HA 1 94 TRP H 1.800 . 5.000 3.471 3.200 3.814 . 0 0 "[ . 1 . 2]" 1
1038 1 91 ARG HA 1 94 TRP H 1.800 . 5.000 3.922 3.640 4.143 . 0 0 "[ . 1 . 2]" 1
1039 1 92 ASN HA 1 94 TRP H 1.800 . 5.000 4.650 4.218 4.937 . 0 0 "[ . 1 . 2]" 1
1040 1 93 ARG HA 1 94 TRP H 1.800 . 5.000 3.547 3.468 3.586 . 0 0 "[ . 1 . 2]" 1
1041 1 93 ARG QD 1 94 TRP H 1.800 . 5.500 4.654 4.181 4.966 . 0 0 "[ . 1 . 2]" 1
1042 1 93 ARG QG 1 94 TRP H 1.800 . 5.000 4.141 3.547 4.565 . 0 0 "[ . 1 . 2]" 1
1043 1 93 ARG QB 1 94 TRP H 1.800 . 5.000 2.649 2.236 3.000 . 0 0 "[ . 1 . 2]" 1
1044 1 94 TRP H 1 96 MET H 1.800 . 5.000 3.931 3.609 4.206 . 0 0 "[ . 1 . 2]" 1
1045 1 94 TRP H 1 97 ILE H 1.800 . 5.000 4.625 4.516 4.854 . 0 0 "[ . 1 . 2]" 1
1046 1 94 TRP H 1 98 ALA H 1.800 . 5.500 5.539 5.516 5.569 0.069 16 0 "[ . 1 . 2]" 1
1047 1 93 ARG HA 1 96 MET H 1.800 . 5.000 3.290 3.047 3.539 . 0 0 "[ . 1 . 2]" 1
1048 1 94 TRP HA 1 96 MET H 1.800 . 5.000 4.123 3.804 4.333 . 0 0 "[ . 1 . 2]" 1
1049 1 95 MET HA 1 96 MET H 1.800 . 5.000 3.498 3.426 3.543 . 0 0 "[ . 1 . 2]" 1
1050 1 95 MET QB 1 96 MET H 1.800 . 5.000 2.886 2.656 3.655 . 0 0 "[ . 1 . 2]" 1
1051 1 96 MET H 1 97 ILE HA 1.800 . 5.000 5.119 5.093 5.161 0.161 4 0 "[ . 1 . 2]" 1
1052 1 96 MET H 1 96 MET QG 1.800 . 5.000 4.014 3.975 4.085 . 0 0 "[ . 1 . 2]" 1
1053 1 93 ARG HA 1 97 ILE H 1.800 . 5.000 3.920 3.741 4.131 . 0 0 "[ . 1 . 2]" 1
1054 1 95 MET HA 1 97 ILE H 1.800 . 5.000 4.475 4.330 4.718 . 0 0 "[ . 1 . 2]" 1
1055 1 96 MET H 1 97 ILE H 1.800 . 3.600 2.403 2.354 2.504 . 0 0 "[ . 1 . 2]" 1
1056 1 96 MET HA 1 97 ILE H 1.800 . 4.200 3.540 3.509 3.578 . 0 0 "[ . 1 . 2]" 1
1057 1 96 MET QB 1 97 ILE H 1.800 . 5.000 2.587 2.353 2.739 . 0 0 "[ . 1 . 2]" 1
1058 1 96 MET QG 1 97 ILE H 1.800 . 5.500 3.759 3.321 4.341 . 0 0 "[ . 1 . 2]" 1
1059 1 97 ILE H 1 98 ALA H 1.800 . 3.600 2.339 2.318 2.381 . 0 0 "[ . 1 . 2]" 1
1060 1 97 ILE H 1 98 ALA HA 1.800 . 5.000 5.045 5.021 5.068 0.068 18 0 "[ . 1 . 2]" 1
1061 1 97 ILE H 1 97 ILE MG 1.800 . 5.000 3.526 2.066 3.802 . 0 0 "[ . 1 . 2]" 1
1062 1 97 ILE H 1 97 ILE QG 1.800 . 5.000 2.563 1.999 3.972 . 0 0 "[ . 1 . 2]" 1
1063 1 97 ILE H 1 97 ILE MD 1.800 . 5.000 3.302 1.943 4.263 . 0 0 "[ . 1 . 2]" 1
1064 1 97 ILE H 1 99 ARG H 1.800 . 5.000 3.771 3.668 3.946 . 0 0 "[ . 1 . 2]" 1
1065 1 93 ARG QG 1 97 ILE MD 1.800 . 5.000 2.875 1.993 3.765 . 0 0 "[ . 1 . 2]" 1
1066 1 56 TRP HH2 1 97 ILE MD 1.800 . 5.500 2.892 2.251 4.397 . 0 0 "[ . 1 . 2]" 1
1067 1 56 TRP HH2 1 97 ILE MG 1.800 . 5.500 4.009 2.425 4.477 . 0 0 "[ . 1 . 2]" 1
1068 1 96 MET H 1 98 ALA H 1.800 . 5.000 3.653 3.487 3.786 . 0 0 "[ . 1 . 2]" 1
1069 1 96 MET HA 1 98 ALA H 1.800 . 5.000 4.447 4.323 4.580 . 0 0 "[ . 1 . 2]" 1
1070 1 97 ILE HA 1 98 ALA H 1.800 . 5.000 3.511 3.491 3.525 . 0 0 "[ . 1 . 2]" 1
1071 1 97 ILE HB 1 98 ALA H 1.800 . 5.000 3.016 2.766 4.012 . 0 0 "[ . 1 . 2]" 1
1072 1 97 ILE QG 1 98 ALA H 1.800 . 5.000 3.978 2.269 4.626 . 0 0 "[ . 1 . 2]" 1
1073 1 98 ALA H 1 99 ARG H 1.800 . 2.800 2.484 2.432 2.632 . 0 0 "[ . 1 . 2]" 1
1074 1 98 ALA H 1 99 ARG QB 1.800 . 5.500 4.288 4.181 4.629 . 0 0 "[ . 1 . 2]" 1
1075 1 98 ALA H 1 99 ARG HA 1.800 . 5.000 5.096 5.060 5.199 0.199 11 0 "[ . 1 . 2]" 1
1076 1 98 ALA H 1 100 HIS H 1.800 . 5.000 4.086 3.720 4.216 . 0 0 "[ . 1 . 2]" 1
1077 1 98 ALA H 1 98 ALA MB 1.800 . 3.600 2.269 2.220 2.284 . 0 0 "[ . 1 . 2]" 1
1078 1 95 MET HA 1 99 ARG H 1.800 . 5.000 4.139 3.556 4.788 . 0 0 "[ . 1 . 2]" 1
1079 1 98 ALA HA 1 99 ARG H 1.800 . 3.600 3.427 3.405 3.508 . 0 0 "[ . 1 . 2]" 1
1080 1 98 ALA MB 1 99 ARG H 1.800 . 4.600 2.973 2.695 3.036 . 0 0 "[ . 1 . 2]" 1
1081 1 99 ARG H 1 100 HIS HA 1.800 . 5.000 5.106 5.064 5.150 0.150 12 0 "[ . 1 . 2]" 1
1082 1 99 ARG H 1 100 HIS H 1.800 . 3.600 2.429 2.353 2.496 . 0 0 "[ . 1 . 2]" 1
1083 1 99 ARG H 1 100 HIS QB 1.800 . 5.000 4.246 4.220 4.284 . 0 0 "[ . 1 . 2]" 1
1084 1 99 ARG H 1 99 ARG QB 1.800 . 3.600 2.284 2.190 2.394 . 0 0 "[ . 1 . 2]" 1
1085 1 99 ARG H 1 99 ARG QG 1.800 . 5.000 3.699 2.427 4.095 . 0 0 "[ . 1 . 2]" 1
1086 1 99 ARG H 1 99 ARG QD 1.800 . 5.000 4.275 3.507 4.453 . 0 0 "[ . 1 . 2]" 1
1087 1 97 ILE HA 1 100 HIS H 1.800 . 5.000 3.552 3.319 3.682 . 0 0 "[ . 1 . 2]" 1
1088 1 98 ALA HA 1 100 HIS H 1.800 . 5.000 3.673 3.584 3.845 . 0 0 "[ . 1 . 2]" 1
1089 1 99 ARG HA 1 100 HIS H 1.800 . 3.600 3.436 3.409 3.446 . 0 0 "[ . 1 . 2]" 1
1090 1 99 ARG QB 1 100 HIS H 1.800 . 5.000 3.012 2.931 3.608 . 0 0 "[ . 1 . 2]" 1
1091 1 99 ARG QG 1 100 HIS H 1.800 . 5.000 3.943 2.343 4.289 . 0 0 "[ . 1 . 2]" 1
1092 1 100 HIS H 1 101 ARG H 1.800 . 3.600 2.352 2.303 2.493 . 0 0 "[ . 1 . 2]" 1
1093 1 100 HIS H 1 101 ARG HA 1.800 . 5.000 5.085 5.042 5.184 0.184 3 0 "[ . 1 . 2]" 1
1094 1 100 HIS H 1 100 HIS QB 1.800 . 3.600 2.294 2.254 2.325 . 0 0 "[ . 1 . 2]" 1
1095 1 99 ARG HA 1 101 ARG H 1.800 . 5.000 4.366 4.217 4.492 . 0 0 "[ . 1 . 2]" 1
1096 1 98 ALA HA 1 101 ARG H 1.800 . 5.000 3.105 2.960 3.375 . 0 0 "[ . 1 . 2]" 1
1097 1 100 HIS HA 1 101 ARG H 1.800 . 3.600 3.532 3.515 3.557 . 0 0 "[ . 1 . 2]" 1
1098 1 100 HIS QB 1 101 ARG H 1.800 . 3.600 2.623 2.499 2.743 . 0 0 "[ . 1 . 2]" 1
1099 1 101 ARG H 1 102 ALA H 1.800 . 3.600 2.348 2.289 2.387 . 0 0 "[ . 1 . 2]" 1
1100 1 101 ARG H 1 102 ALA MB 1.800 . 5.000 4.059 4.020 4.075 . 0 0 "[ . 1 . 2]" 1
1101 1 101 ARG H 1 102 ALA HA 1.800 . 5.000 4.985 4.814 5.020 0.020 20 0 "[ . 1 . 2]" 1
1102 1 101 ARG H 1 101 ARG QG 1.800 . 5.000 2.595 1.797 4.066 0.003 3 0 "[ . 1 . 2]" 1
1103 1 101 ARG H 1 101 ARG QD 1.800 . 5.000 3.877 2.920 4.478 . 0 0 "[ . 1 . 2]" 1
1104 1 98 ALA HA 1 102 ALA H 1.800 . 5.000 4.097 3.828 4.241 . 0 0 "[ . 1 . 2]" 1
1105 1 98 ALA MB 1 102 ALA H 1.800 . 5.500 4.414 4.217 4.512 . 0 0 "[ . 1 . 2]" 1
1106 1 99 ARG HA 1 102 ALA H 1.800 . 5.000 3.365 3.170 3.513 . 0 0 "[ . 1 . 2]" 1
1107 1 100 HIS HA 1 102 ALA H 1.800 . 5.000 4.068 3.931 4.274 . 0 0 "[ . 1 . 2]" 1
1108 1 100 HIS QB 1 102 ALA H 1.800 . 5.000 4.452 4.373 4.499 . 0 0 "[ . 1 . 2]" 1
1109 1 101 ARG HA 1 102 ALA H 1.800 . 3.600 3.435 3.378 3.469 . 0 0 "[ . 1 . 2]" 1
1110 1 101 ARG QG 1 102 ALA H 1.800 . 5.000 4.011 2.553 4.266 . 0 0 "[ . 1 . 2]" 1
1111 1 101 ARG QB 1 102 ALA H 1.800 . 5.000 3.061 2.916 3.708 . 0 0 "[ . 1 . 2]" 1
1112 1 102 ALA H 1 102 ALA MB 1.800 . 2.800 2.255 2.226 2.306 . 0 0 "[ . 1 . 2]" 1
1113 1 99 ARG HA 1 103 LYS H 1.800 . 5.000 4.955 4.451 5.042 0.042 13 0 "[ . 1 . 2]" 1
1114 1 100 HIS HA 1 103 LYS H 1.800 . 4.600 4.051 3.625 4.609 0.009 1 0 "[ . 1 . 2]" 1
1115 1 102 ALA HA 1 103 LYS H 1.800 . 3.600 3.399 3.145 3.594 . 0 0 "[ . 1 . 2]" 1
1116 1 103 LYS H 1 104 HIS H 1.800 . 3.600 2.705 2.325 3.331 . 0 0 "[ . 1 . 2]" 1
1117 1 103 LYS H 1 104 HIS HA 1.800 . 5.000 5.017 4.917 5.100 0.100 13 0 "[ . 1 . 2]" 1
1118 1 103 LYS H 1 104 HIS HD2 1.800 . 5.000 4.506 3.423 5.029 0.029 19 0 "[ . 1 . 2]" 1
1119 1 103 LYS H 1 103 LYS QB 1.800 . 2.800 2.296 2.241 2.524 . 0 0 "[ . 1 . 2]" 1
1120 1 103 LYS H 1 103 LYS QG 1.800 . 3.600 2.526 1.909 2.838 . 0 0 "[ . 1 . 2]" 1
1121 1 103 LYS H 1 105 GLN QB 1.800 . 5.000 4.402 4.088 4.563 . 0 0 "[ . 1 . 2]" 1
1122 1 103 LYS HA 1 104 HIS H 1.800 . 3.600 3.349 2.949 3.581 . 0 0 "[ . 1 . 2]" 1
1123 1 103 LYS QB 1 104 HIS H 1.800 . 4.400 2.954 1.831 4.014 . 0 0 "[ . 1 . 2]" 1
1124 1 103 LYS QG 1 104 HIS H 1.800 . 5.000 4.218 3.541 4.481 . 0 0 "[ . 1 . 2]" 1
1125 1 104 HIS H 1 104 HIS QB 1.800 . 3.600 3.035 2.356 3.430 . 0 0 "[ . 1 . 2]" 1
1126 1 104 HIS H 1 104 HIS HD2 1.800 . 5.000 2.446 1.839 3.902 . 0 0 "[ . 1 . 2]" 1
1127 1 104 HIS H 1 105 GLN QB 1.800 . 5.000 4.181 3.336 4.551 . 0 0 "[ . 1 . 2]" 1
1128 1 103 LYS H 1 105 GLN H 1.800 . 5.000 3.792 3.401 5.050 0.050 19 0 "[ . 1 . 2]" 1
1129 1 103 LYS HA 1 105 GLN H 1.800 . 5.000 4.270 3.501 5.009 0.009 6 0 "[ . 1 . 2]" 1
1130 1 103 LYS QB 1 105 GLN H 1.800 . 5.000 3.440 2.652 4.429 . 0 0 "[ . 1 . 2]" 1
1131 1 104 HIS HA 1 105 GLN H 1.800 . 3.600 3.269 2.987 3.592 . 0 0 "[ . 1 . 2]" 1
1132 1 104 HIS QB 1 105 GLN H 1.800 . 4.200 3.467 1.961 3.862 . 0 0 "[ . 1 . 2]" 1
1133 1 104 HIS HD2 1 105 GLN H 1.800 . 5.000 4.095 2.054 4.993 . 0 0 "[ . 1 . 2]" 1
1134 1 105 GLN H 1 105 GLN QB 1.800 . 3.600 2.326 2.218 2.915 . 0 0 "[ . 1 . 2]" 1
1135 1 105 GLN H 1 105 GLN QG 1.800 . 5.000 3.958 2.443 4.494 . 0 0 "[ . 1 . 2]" 1
1136 1 105 GLN H 1 106 LYS H 1.800 . 5.000 2.973 2.481 4.196 . 0 0 "[ . 1 . 2]" 1
1137 1 104 HIS HA 1 106 LYS H 1.800 . 5.000 3.663 2.998 4.691 . 0 0 "[ . 1 . 2]" 1
1138 1 104 HIS QB 1 106 LYS H 1.800 . 5.500 4.602 4.004 4.967 . 0 0 "[ . 1 . 2]" 1
1139 1 105 GLN HA 1 106 LYS H 1.800 . 3.600 3.383 2.316 3.572 . 0 0 "[ . 1 . 2]" 1
1140 1 105 GLN QB 1 106 LYS H 1.800 . 5.000 2.859 1.808 4.038 . 0 0 "[ . 1 . 2]" 1
1141 1 105 GLN QG 1 106 LYS H 1.800 . 5.000 3.866 2.283 4.506 . 0 0 "[ . 1 . 2]" 1
1142 1 106 LYS H 1 107 SER QB 1.800 . 6.000 4.479 3.420 4.814 . 0 0 "[ . 1 . 2]" 1
1143 1 106 LYS H 1 106 LYS QB 1.800 . 3.600 2.604 2.249 3.411 . 0 0 "[ . 1 . 2]" 1
1144 1 106 LYS H 1 106 LYS QG 1.800 . 5.000 2.905 1.815 4.239 . 0 0 "[ . 1 . 2]" 1
1145 1 106 LYS H 1 106 LYS QD 1.800 . 5.000 3.908 2.307 4.490 . 0 0 "[ . 1 . 2]" 1
1146 1 104 HIS HA 1 107 SER H 1.800 . 5.000 3.942 2.854 5.006 0.006 11 0 "[ . 1 . 2]" 1
1147 1 105 GLN QB 1 107 SER H 1.800 . 5.000 4.236 3.204 4.524 . 0 0 "[ . 1 . 2]" 1
1148 1 106 LYS HA 1 107 SER H 1.800 . 5.000 3.470 3.342 3.586 . 0 0 "[ . 1 . 2]" 1
1149 1 106 LYS QB 1 107 SER H 1.800 . 3.600 3.010 2.207 3.380 . 0 0 "[ . 1 . 2]" 1
1150 1 106 LYS QG 1 107 SER H 1.800 . 5.000 3.697 1.839 4.403 . 0 0 "[ . 1 . 2]" 1
1151 1 107 SER H 1 107 SER QB 1.800 . 3.000 2.405 2.223 2.871 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 28
_Distance_constraint_stats_list.Viol_count 249
_Distance_constraint_stats_list.Viol_total 290.191
_Distance_constraint_stats_list.Viol_max 0.167
_Distance_constraint_stats_list.Viol_rms 0.0416
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0259
_Distance_constraint_stats_list.Viol_average_violations_only 0.0583
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 5 THR 0.664 0.076 18 0 "[ . 1 . 2]"
1 6 GLU 0.410 0.056 4 0 "[ . 1 . 2]"
1 7 GLU 3.189 0.167 20 0 "[ . 1 . 2]"
1 8 GLU 0.005 0.005 3 0 "[ . 1 . 2]"
1 9 ASP 2.457 0.141 20 0 "[ . 1 . 2]"
1 10 LEU 1.987 0.115 3 0 "[ . 1 . 2]"
1 11 LYS 3.806 0.167 20 0 "[ . 1 . 2]"
1 12 LEU 2.205 0.148 13 0 "[ . 1 . 2]"
1 13 GLN 3.899 0.145 16 0 "[ . 1 . 2]"
1 14 GLN 1.577 0.115 3 0 "[ . 1 . 2]"
1 15 LEU 0.617 0.075 16 0 "[ . 1 . 2]"
1 16 VAL 2.200 0.148 13 0 "[ . 1 . 2]"
1 17 MET 2.107 0.145 16 0 "[ . 1 . 2]"
1 23 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 TRP 0.239 0.050 13 0 "[ . 1 . 2]"
1 25 ILE 1.030 0.109 8 0 "[ . 1 . 2]"
1 26 ARG 0.265 0.062 1 0 "[ . 1 . 2]"
1 27 ILE 0.415 0.045 19 0 "[ . 1 . 2]"
1 28 SER 0.239 0.050 13 0 "[ . 1 . 2]"
1 29 GLN 1.030 0.109 8 0 "[ . 1 . 2]"
1 30 LEU 0.265 0.062 1 0 "[ . 1 . 2]"
1 31 MET 0.415 0.045 19 0 "[ . 1 . 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 5 THR O 1 9 ASP H 1.800 . 2.400 2.412 2.211 2.476 0.076 18 0 "[ . 1 . 2]" 2
2 1 5 THR O 1 9 ASP N 2.800 2.800 3.400 3.350 3.137 3.421 0.021 18 0 "[ . 1 . 2]" 2
3 1 6 GLU O 1 10 LEU H 1.800 . 2.400 2.416 2.314 2.456 0.056 4 0 "[ . 1 . 2]" 2
4 1 6 GLU O 1 10 LEU N 2.800 2.800 3.400 3.214 3.104 3.241 . 0 0 "[ . 1 . 2]" 2
5 1 7 GLU O 1 11 LYS H 1.800 . 2.400 2.542 2.520 2.567 0.167 20 0 "[ . 1 . 2]" 2
6 1 7 GLU O 1 11 LYS N 2.800 2.800 3.400 3.416 3.389 3.442 0.042 16 0 "[ . 1 . 2]" 2
7 1 8 GLU O 1 12 LEU H 1.800 . 2.400 2.105 1.882 2.387 . 0 0 "[ . 1 . 2]" 2
8 1 8 GLU O 1 12 LEU N 2.800 2.800 3.400 2.976 2.795 3.202 0.005 3 0 "[ . 1 . 2]" 2
9 1 9 ASP O 1 13 GLN H 1.800 . 2.400 2.478 2.427 2.541 0.141 20 0 "[ . 1 . 2]" 2
10 1 9 ASP O 1 13 GLN N 2.800 2.800 3.400 3.404 3.335 3.442 0.042 6 0 "[ . 1 . 2]" 2
11 1 10 LEU O 1 14 GLN H 1.800 . 2.400 2.477 2.432 2.515 0.115 3 0 "[ . 1 . 2]" 2
12 1 10 LEU O 1 14 GLN N 2.800 2.800 3.400 3.380 3.334 3.416 0.016 6 0 "[ . 1 . 2]" 2
13 1 11 LYS O 1 15 LEU H 1.800 . 2.400 1.847 1.778 2.220 0.022 17 0 "[ . 1 . 2]" 2
14 1 11 LYS O 1 15 LEU N 2.800 2.800 3.400 2.795 2.725 3.171 0.075 16 0 "[ . 1 . 2]" 2
15 1 12 LEU O 1 16 VAL H 1.800 . 2.400 1.879 1.806 1.960 . 0 0 "[ . 1 . 2]" 2
16 1 12 LEU O 1 16 VAL N 2.800 2.800 3.400 2.690 2.652 2.765 0.148 13 0 "[ . 1 . 2]" 2
17 1 13 GLN O 1 17 MET H 1.800 . 2.400 2.505 2.475 2.545 0.145 16 0 "[ . 1 . 2]" 2
18 1 13 GLN O 1 17 MET N 2.800 2.800 3.400 3.237 3.169 3.332 . 0 0 "[ . 1 . 2]" 2
19 1 23 ASP O 1 27 ILE H 1.800 . 2.400 2.216 1.954 2.393 . 0 0 "[ . 1 . 2]" 2
20 1 23 ASP O 1 27 ILE N 2.800 2.800 3.400 3.185 2.927 3.364 . 0 0 "[ . 1 . 2]" 2
21 1 24 TRP O 1 28 SER H 1.800 . 2.400 2.063 1.854 2.234 . 0 0 "[ . 1 . 2]" 2
22 1 24 TRP O 1 28 SER N 2.800 2.800 3.400 2.921 2.750 3.097 0.050 13 0 "[ . 1 . 2]" 2
23 1 25 ILE O 1 29 GLN H 1.800 . 2.400 2.451 2.415 2.509 0.109 8 0 "[ . 1 . 2]" 2
24 1 25 ILE O 1 29 GLN N 2.800 2.800 3.400 3.210 3.124 3.315 . 0 0 "[ . 1 . 2]" 2
25 1 26 ARG O 1 30 LEU H 1.800 . 2.400 2.384 2.288 2.462 0.062 1 0 "[ . 1 . 2]" 2
26 1 26 ARG O 1 30 LEU N 2.800 2.800 3.400 3.291 3.226 3.377 . 0 0 "[ . 1 . 2]" 2
27 1 27 ILE O 1 31 MET H 1.800 . 2.400 2.354 1.978 2.445 0.045 19 0 "[ . 1 . 2]" 2
28 1 27 ILE O 1 31 MET N 2.800 2.800 3.400 3.303 2.910 3.420 0.020 19 0 "[ . 1 . 2]" 2
stop_
save_
Contact the webmaster for help, if required. Tuesday, May 14, 2024 4:31:30 PM GMT (wattos1)