NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
596561 |
2n3b   |
25640 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n3b
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 1431
_Distance_constraint_stats_list.Viol_count 2364
_Distance_constraint_stats_list.Viol_total 7379.222
_Distance_constraint_stats_list.Viol_max 1.035
_Distance_constraint_stats_list.Viol_rms 0.0391
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0050
_Distance_constraint_stats_list.Viol_average_violations_only 0.0975
_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 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 2 ASP 7.475 0.191 29 0 "[ . 1 . 2 . 3 ]"
1 3 VAL 6.006 0.157 32 0 "[ . 1 . 2 . 3 ]"
1 4 GLU 7.507 0.191 29 0 "[ . 1 . 2 . 3 ]"
1 5 LYS 3.692 0.153 10 0 "[ . 1 . 2 . 3 ]"
1 6 GLY 2.616 0.126 25 0 "[ . 1 . 2 . 3 ]"
1 7 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 8 LYS 5.001 0.153 10 0 "[ . 1 . 2 . 3 ]"
1 9 ILE 0.417 0.030 25 0 "[ . 1 . 2 . 3 ]"
1 10 PHE 6.274 0.295 23 0 "[ . 1 . 2 . 3 ]"
1 11 VAL 3.858 0.162 15 0 "[ . 1 . 2 . 3 ]"
1 12 GLN 37.213 0.596 10 32 [*********+*********-************]
1 13 LYS 3.858 0.162 15 0 "[ . 1 . 2 . 3 ]"
1 14 CYS 17.515 0.596 10 32 [*********+*********-************]
1 15 ALA 0.475 0.067 3 0 "[ . 1 . 2 . 3 ]"
1 16 GLN 0.718 0.052 19 0 "[ . 1 . 2 . 3 ]"
1 17 CYS 1.239 0.065 29 0 "[ . 1 . 2 . 3 ]"
1 18 HIS 2.248 0.072 19 0 "[ . 1 . 2 . 3 ]"
1 19 THR 2.185 0.081 1 0 "[ . 1 . 2 . 3 ]"
1 20 VAL 0.303 0.074 4 0 "[ . 1 . 2 . 3 ]"
1 21 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 22 LYS 1.280 0.102 5 0 "[ . 1 . 2 . 3 ]"
1 23 GLY 0.792 0.129 22 0 "[ . 1 . 2 . 3 ]"
1 24 GLY 3.936 0.312 29 0 "[ . 1 . 2 . 3 ]"
1 25 LYS 2.397 0.312 29 0 "[ . 1 . 2 . 3 ]"
1 26 HIS 1.488 0.094 3 0 "[ . 1 . 2 . 3 ]"
1 27 LYS 1.205 0.094 3 0 "[ . 1 . 2 . 3 ]"
1 28 THR 1.587 0.065 29 0 "[ . 1 . 2 . 3 ]"
1 29 GLY 1.335 0.048 23 0 "[ . 1 . 2 . 3 ]"
1 30 PRO 0.033 0.028 19 0 "[ . 1 . 2 . 3 ]"
1 31 ASN 1.232 0.081 1 0 "[ . 1 . 2 . 3 ]"
1 32 LEU 1.377 0.168 17 0 "[ . 1 . 2 . 3 ]"
1 33 HIS 3.187 0.168 17 0 "[ . 1 . 2 . 3 ]"
1 34 GLY 0.398 0.038 29 0 "[ . 1 . 2 . 3 ]"
1 35 LEU 1.897 0.091 21 0 "[ . 1 . 2 . 3 ]"
1 36 PHE 6.499 0.114 7 0 "[ . 1 . 2 . 3 ]"
1 37 GLY 1.987 0.084 2 0 "[ . 1 . 2 . 3 ]"
1 38 ARG 3.242 0.114 7 0 "[ . 1 . 2 . 3 ]"
1 39 LYS 0.170 0.033 24 0 "[ . 1 . 2 . 3 ]"
1 40 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 41 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 42 GLN 9.282 0.260 27 0 "[ . 1 . 2 . 3 ]"
1 43 ALA 0.221 0.093 28 0 "[ . 1 . 2 . 3 ]"
1 44 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 45 GLY 0.022 0.013 20 0 "[ . 1 . 2 . 3 ]"
1 46 PHE 0.048 0.027 31 0 "[ . 1 . 2 . 3 ]"
1 47 THR 1.398 0.059 24 0 "[ . 1 . 2 . 3 ]"
1 48 TYR 8.616 0.260 27 0 "[ . 1 . 2 . 3 ]"
1 49 THR 5.677 0.182 27 0 "[ . 1 . 2 . 3 ]"
1 50 ASP 2.268 0.145 6 0 "[ . 1 . 2 . 3 ]"
1 51 ALA 1.076 0.066 28 0 "[ . 1 . 2 . 3 ]"
1 52 ASN 5.143 0.161 18 0 "[ . 1 . 2 . 3 ]"
1 53 LYS 8.181 0.188 29 0 "[ . 1 . 2 . 3 ]"
1 54 ASN 16.862 0.260 15 0 "[ . 1 . 2 . 3 ]"
1 55 LYS 16.386 0.260 15 0 "[ . 1 . 2 . 3 ]"
1 56 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 57 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 58 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 59 TRP 3.052 0.132 18 0 "[ . 1 . 2 . 3 ]"
1 60 LYS 0.297 0.042 4 0 "[ . 1 . 2 . 3 ]"
1 61 GLU 0.026 0.014 9 0 "[ . 1 . 2 . 3 ]"
1 62 GLU 3.227 0.131 13 0 "[ . 1 . 2 . 3 ]"
1 63 THR 3.162 0.145 5 0 "[ . 1 . 2 . 3 ]"
1 64 LEU 10.359 0.132 18 0 "[ . 1 . 2 . 3 ]"
1 65 MET 10.600 0.197 29 0 "[ . 1 . 2 . 3 ]"
1 66 GLU 0.199 0.063 18 0 "[ . 1 . 2 . 3 ]"
1 67 TYR 6.189 0.197 29 0 "[ . 1 . 2 . 3 ]"
1 68 LEU 1.474 0.113 5 0 "[ . 1 . 2 . 3 ]"
1 69 GLU 1.747 0.128 21 0 "[ . 1 . 2 . 3 ]"
1 70 ASN 21.819 0.660 12 32 [****-******+********************]
1 71 PRO 0.571 0.102 5 0 "[ . 1 . 2 . 3 ]"
1 72 LYS 0.321 0.040 8 0 "[ . 1 . 2 . 3 ]"
1 73 LYS 2.195 0.131 2 0 "[ . 1 . 2 . 3 ]"
1 74 TYR 2.624 0.082 29 0 "[ . 1 . 2 . 3 ]"
1 75 ILE 2.322 0.082 29 0 "[ . 1 . 2 . 3 ]"
1 76 PRO 0.357 0.041 12 0 "[ . 1 . 2 . 3 ]"
1 77 GLY 0.003 0.003 1 0 "[ . 1 . 2 . 3 ]"
1 78 THR 0.261 0.029 6 0 "[ . 1 . 2 . 3 ]"
1 79 LYS 3.395 0.182 27 0 "[ . 1 . 2 . 3 ]"
1 80 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 81 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 82 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 83 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 84 GLY 0.893 0.102 5 0 "[ . 1 . 2 . 3 ]"
1 85 ILE 49.521 1.035 12 32 [****-******+********************]
1 86 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 87 LYS 30.468 1.035 12 32 [****-******+********************]
1 88 LYS 1.076 0.077 3 0 "[ . 1 . 2 . 3 ]"
1 89 THR 6.672 0.265 3 0 "[ . 1 . 2 . 3 ]"
1 90 GLU 2.766 0.120 5 0 "[ . 1 . 2 . 3 ]"
1 91 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 92 GLU 3.536 0.118 3 0 "[ . 1 . 2 . 3 ]"
1 93 ASP 7.185 0.265 3 0 "[ . 1 . 2 . 3 ]"
1 94 LEU 5.638 0.187 21 0 "[ . 1 . 2 . 3 ]"
1 95 ILE 6.462 0.187 21 0 "[ . 1 . 2 . 3 ]"
1 96 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 97 TYR 5.348 0.157 32 0 "[ . 1 . 2 . 3 ]"
1 98 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 99 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 100 LYS 2.466 0.115 14 0 "[ . 1 . 2 . 3 ]"
1 101 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 102 THR 10.273 0.191 15 0 "[ . 1 . 2 . 3 ]"
1 103 ASN 10.480 0.191 15 0 "[ . 1 . 2 . 3 ]"
1 104 GLU 3.135 0.161 10 0 "[ . 1 . 2 . 3 ]"
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 78 THR HA 1 80 MET H 3.350 . 5.500 5.251 5.201 5.296 . 0 0 "[ . 1 . 2 . 3 ]" 1
2 1 12 GLN H 1 15 ALA MB 3.600 . 6.000 4.126 4.066 4.184 . 0 0 "[ . 1 . 2 . 3 ]" 1
3 1 63 THR HA 1 65 MET H 3.350 . 5.500 4.273 4.213 4.336 . 0 0 "[ . 1 . 2 . 3 ]" 1
4 1 85 ILE H 1 85 ILE HA 2.350 . 3.000 2.919 2.861 2.957 . 0 0 "[ . 1 . 2 . 3 ]" 1
5 1 72 LYS QD 1 77 GLY H 3.350 . 5.500 3.034 1.914 4.023 . 0 0 "[ . 1 . 2 . 3 ]" 1
6 1 11 VAL H 1 11 VAL HB 2.850 . 4.000 3.602 3.597 3.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
7 1 88 LYS QG 1 92 GLU H 3.350 . 5.500 3.430 3.307 3.690 . 0 0 "[ . 1 . 2 . 3 ]" 1
8 1 75 ILE H 1 75 ILE MG 3.600 . 6.000 3.897 3.870 3.915 . 0 0 "[ . 1 . 2 . 3 ]" 1
9 1 55 LYS H 1 55 LYS HA 2.350 . 3.000 2.308 2.304 2.315 . 0 0 "[ . 1 . 2 . 3 ]" 1
10 1 51 ALA MB 1 77 GLY H 3.600 . 6.000 4.082 3.946 4.317 . 0 0 "[ . 1 . 2 . 3 ]" 1
11 1 96 ALA H 1 97 TYR HB2 3.350 . 5.500 5.180 5.053 5.269 . 0 0 "[ . 1 . 2 . 3 ]" 1
12 1 12 GLN QB 1 12 GLN HE21 3.350 . 5.500 1.810 1.779 1.918 . 0 0 "[ . 1 . 2 . 3 ]" 1
13 1 92 GLU H 1 92 GLU QG 3.350 . 5.000 3.920 3.796 4.059 . 0 0 "[ . 1 . 2 . 3 ]" 1
14 1 38 ARG H 1 38 ARG QB 2.850 . 4.000 2.164 2.075 2.253 . 0 0 "[ . 1 . 2 . 3 ]" 1
15 1 54 ASN HB3 1 54 ASN HD22 2.850 . 4.000 3.779 3.773 3.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
16 1 99 LYS HA 1 100 LYS H 2.850 . 4.000 3.571 3.557 3.580 . 0 0 "[ . 1 . 2 . 3 ]" 1
17 1 28 THR HB 1 29 GLY H 3.350 . 4.000 4.039 4.029 4.048 0.048 23 0 "[ . 1 . 2 . 3 ]" 1
18 1 22 LYS H 1 24 GLY H 3.350 . 9.500 4.891 4.778 5.054 . 0 0 "[ . 1 . 2 . 3 ]" 1
19 1 102 THR HA 1 104 GLU H 2.850 . 4.000 4.024 3.929 4.161 0.161 10 0 "[ . 1 . 2 . 3 ]" 1
20 1 86 LYS QG 1 87 LYS H 3.350 . 5.500 3.692 2.659 4.231 . 0 0 "[ . 1 . 2 . 3 ]" 1
21 1 7 LYS HA 1 9 ILE H 3.350 . 5.500 4.570 4.300 4.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
22 1 52 ASN HD22 1 59 TRP HE1 3.350 . 5.500 4.471 3.565 5.075 . 0 0 "[ . 1 . 2 . 3 ]" 1
23 1 46 PHE H 1 46 PHE HB3 2.350 . 3.000 2.679 2.480 2.824 . 0 0 "[ . 1 . 2 . 3 ]" 1
24 1 40 THR H 1 40 THR HA 2.350 . 3.000 2.809 2.692 2.901 . 0 0 "[ . 1 . 2 . 3 ]" 1
25 1 99 LYS H 1 99 LYS QG 2.850 . 4.000 2.664 2.117 2.967 . 0 0 "[ . 1 . 2 . 3 ]" 1
26 1 52 ASN H 1 52 ASN HA 2.850 . 4.000 2.890 2.841 2.899 . 0 0 "[ . 1 . 2 . 3 ]" 1
27 1 39 LYS H 1 42 GLN HE21 3.350 . 5.500 2.799 1.680 5.327 0.020 12 0 "[ . 1 . 2 . 3 ]" 1
28 1 14 CYS H 1 94 LEU QD 3.600 . 6.000 3.679 3.576 3.756 . 0 0 "[ . 1 . 2 . 3 ]" 1
29 1 58 THR H 1 63 THR MG 3.600 . 6.000 3.841 3.513 4.187 . 0 0 "[ . 1 . 2 . 3 ]" 1
30 1 46 PHE H 1 47 THR H 3.350 . 5.500 4.618 4.491 4.635 . 0 0 "[ . 1 . 2 . 3 ]" 1
31 1 64 LEU H 1 64 LEU QB 2.350 . 3.000 2.090 2.066 2.112 . 0 0 "[ . 1 . 2 . 3 ]" 1
32 1 26 HIS HB2 1 27 LYS H 2.850 . 4.000 3.504 3.089 4.061 0.061 11 0 "[ . 1 . 2 . 3 ]" 1
33 1 41 GLY H 1 41 GLY HA3 2.850 . 4.000 2.747 2.727 2.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
34 1 99 LYS H 1 100 LYS H 2.350 . 3.000 2.631 2.488 2.901 . 0 0 "[ . 1 . 2 . 3 ]" 1
35 1 49 THR H 1 49 THR HB 2.850 . 4.000 3.619 3.602 3.636 . 0 0 "[ . 1 . 2 . 3 ]" 1
36 1 81 ILE H 1 82 PHE H 3.350 . 5.500 3.890 3.464 4.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
37 1 35 LEU H 1 35 LEU MD1 3.100 . 4.500 4.038 3.923 4.085 . 0 0 "[ . 1 . 2 . 3 ]" 1
38 1 39 LYS H 1 42 GLN HE22 3.350 . 5.500 2.755 1.667 5.532 0.033 24 0 "[ . 1 . 2 . 3 ]" 1
39 1 9 ILE H 1 9 ILE HA 2.850 . 4.000 2.835 2.818 2.874 . 0 0 "[ . 1 . 2 . 3 ]" 1
40 1 90 GLU H 1 92 GLU H 2.850 . 4.000 4.076 3.984 4.118 0.118 3 0 "[ . 1 . 2 . 3 ]" 1
41 1 6 GLY H 1 7 LYS H 2.350 . 3.000 2.417 2.278 2.475 . 0 0 "[ . 1 . 2 . 3 ]" 1
42 1 65 MET H 1 65 MET QB 2.350 . 3.000 2.474 2.427 2.539 . 0 0 "[ . 1 . 2 . 3 ]" 1
43 1 100 LYS QG 1 101 ALA H 3.350 . 5.500 4.222 4.031 4.656 . 0 0 "[ . 1 . 2 . 3 ]" 1
44 1 21 GLU H 1 22 LYS H 3.350 . 5.500 4.202 4.072 4.357 . 0 0 "[ . 1 . 2 . 3 ]" 1
45 1 53 LYS H 1 53 LYS QG 2.850 . 4.000 3.578 3.016 3.842 . 0 0 "[ . 1 . 2 . 3 ]" 1
46 1 90 GLU HA 1 91 ARG H 3.350 . 5.500 3.520 3.499 3.568 . 0 0 "[ . 1 . 2 . 3 ]" 1
47 1 53 LYS QG 1 54 ASN H 3.350 . 5.500 3.504 2.855 4.451 . 0 0 "[ . 1 . 2 . 3 ]" 1
48 1 65 MET H 1 65 MET HA 2.850 . 4.000 2.809 2.789 2.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
49 1 89 THR H 1 89 THR HB 2.850 . 4.000 3.603 3.596 3.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
50 1 17 CYS H 1 17 CYS HA 2.850 . 4.000 2.965 2.961 2.967 . 0 0 "[ . 1 . 2 . 3 ]" 1
51 1 42 GLN HA 1 42 GLN HE21 3.350 . 5.500 4.513 1.978 5.126 . 0 0 "[ . 1 . 2 . 3 ]" 1
52 1 10 PHE H 1 11 VAL H 2.850 . 4.000 2.612 2.580 2.674 . 0 0 "[ . 1 . 2 . 3 ]" 1
53 1 67 TYR H 1 67 TYR HB3 2.850 . 4.000 2.328 2.238 2.492 . 0 0 "[ . 1 . 2 . 3 ]" 1
54 1 8 LYS QD 1 12 GLN HE22 3.350 . 5.500 2.455 1.909 3.076 . 0 0 "[ . 1 . 2 . 3 ]" 1
55 1 64 LEU H 1 65 MET H 2.850 . 4.000 2.556 2.524 2.612 . 0 0 "[ . 1 . 2 . 3 ]" 1
56 1 8 LYS HA 1 11 VAL H 3.350 . 5.500 3.730 3.576 3.752 . 0 0 "[ . 1 . 2 . 3 ]" 1
57 1 72 LYS HA 1 75 ILE H 2.850 . 4.000 3.829 3.658 3.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
58 1 97 TYR HB3 1 98 LEU H 2.850 . 4.000 2.575 2.337 2.813 . 0 0 "[ . 1 . 2 . 3 ]" 1
59 1 70 ASN H 1 71 PRO HA 3.350 . 5.500 4.015 3.948 4.051 . 0 0 "[ . 1 . 2 . 3 ]" 1
60 1 60 LYS H 1 63 THR H 2.850 . 4.000 3.991 3.917 4.042 0.042 4 0 "[ . 1 . 2 . 3 ]" 1
61 1 65 MET H 1 91 ARG QD 3.350 . 5.500 4.835 4.667 4.980 . 0 0 "[ . 1 . 2 . 3 ]" 1
62 1 41 GLY H 1 59 TRP HE1 2.850 . 4.000 3.132 2.598 3.283 . 0 0 "[ . 1 . 2 . 3 ]" 1
63 1 12 GLN H 1 15 ALA H 3.350 . 5.500 4.640 4.597 4.681 . 0 0 "[ . 1 . 2 . 3 ]" 1
64 1 19 THR HB 1 20 VAL H 2.850 . 3.000 2.872 2.635 3.050 0.050 5 0 "[ . 1 . 2 . 3 ]" 1
65 1 54 ASN H 1 54 ASN HD22 2.850 . 4.000 3.778 3.661 3.914 . 0 0 "[ . 1 . 2 . 3 ]" 1
66 1 10 PHE HA 1 11 VAL H 2.850 . 4.000 3.577 3.573 3.581 . 0 0 "[ . 1 . 2 . 3 ]" 1
67 1 58 THR H 1 58 THR HA 2.850 . 4.000 2.957 2.936 2.961 . 0 0 "[ . 1 . 2 . 3 ]" 1
68 1 71 PRO HD2 1 72 LYS H 3.350 . 5.500 3.010 2.815 3.202 . 0 0 "[ . 1 . 2 . 3 ]" 1
69 1 65 MET QB 1 66 GLU H 2.850 . 4.000 2.232 2.196 2.263 . 0 0 "[ . 1 . 2 . 3 ]" 1
70 1 8 LYS H 1 9 ILE H 2.850 . 4.000 2.770 2.593 2.820 . 0 0 "[ . 1 . 2 . 3 ]" 1
71 1 41 GLY H 1 42 GLN H 2.850 . 4.000 2.969 2.822 3.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
72 1 40 THR MG 1 59 TRP HE1 3.600 . 6.000 2.112 1.906 3.340 . 0 0 "[ . 1 . 2 . 3 ]" 1
73 1 11 VAL H 1 11 VAL HA 2.850 . 4.000 2.777 2.770 2.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
74 1 101 ALA H 1 101 ALA HA 2.350 . 3.000 2.910 2.908 2.912 . 0 0 "[ . 1 . 2 . 3 ]" 1
75 1 37 GLY H 1 59 TRP H 3.350 . 4.000 3.887 3.707 4.009 0.009 29 0 "[ . 1 . 2 . 3 ]" 1
76 1 4 GLU HA 1 7 LYS H 3.350 . 4.000 3.628 3.581 3.714 . 0 0 "[ . 1 . 2 . 3 ]" 1
77 1 36 PHE HD2 1 60 LYS H 3.350 . 5.500 4.386 4.243 4.545 . 0 0 "[ . 1 . 2 . 3 ]" 1
78 1 3 VAL MG2 1 101 ALA H 3.600 . 6.000 4.914 4.835 4.970 . 0 0 "[ . 1 . 2 . 3 ]" 1
79 1 69 GLU QB 1 70 ASN H 2.850 . 4.000 3.614 3.209 3.792 . 0 0 "[ . 1 . 2 . 3 ]" 1
80 1 51 ALA H 1 52 ASN H 2.850 . 3.000 2.780 2.589 2.942 . 0 0 "[ . 1 . 2 . 3 ]" 1
81 1 57 ILE H 1 57 ILE HG12 2.850 . 4.000 3.728 3.586 3.848 . 0 0 "[ . 1 . 2 . 3 ]" 1
82 1 61 GLU H 1 61 GLU QG 3.350 . 5.500 3.959 3.938 4.058 . 0 0 "[ . 1 . 2 . 3 ]" 1
83 1 89 THR HA 1 92 GLU H 2.850 . 4.000 3.262 3.172 3.351 . 0 0 "[ . 1 . 2 . 3 ]" 1
84 1 39 LYS QD 1 56 GLY H 3.350 . 5.500 4.248 3.901 4.462 . 0 0 "[ . 1 . 2 . 3 ]" 1
85 1 21 GLU QB 1 24 GLY H 3.350 . 5.500 4.813 4.036 4.969 . 0 0 "[ . 1 . 2 . 3 ]" 1
86 1 57 ILE H 1 57 ILE MG 3.100 . 4.500 2.889 2.806 3.044 . 0 0 "[ . 1 . 2 . 3 ]" 1
87 1 53 LYS H 1 54 ASN HB3 2.850 . 4.000 4.114 4.093 4.144 0.144 3 0 "[ . 1 . 2 . 3 ]" 1
88 1 26 HIS HA 1 31 ASN H 3.350 . 5.500 4.573 4.041 4.825 . 0 0 "[ . 1 . 2 . 3 ]" 1
89 1 90 GLU H 1 91 ARG H 2.850 . 4.000 2.509 2.447 2.606 . 0 0 "[ . 1 . 2 . 3 ]" 1
90 1 22 LYS H 1 22 LYS HA 2.850 . 4.000 2.768 2.699 2.847 . 0 0 "[ . 1 . 2 . 3 ]" 1
91 1 23 GLY HA2 1 24 GLY H 2.350 . 3.000 3.010 2.878 3.129 0.129 22 0 "[ . 1 . 2 . 3 ]" 1
92 1 94 LEU H 1 94 LEU QD 3.600 . 5.500 3.673 3.652 3.685 . 0 0 "[ . 1 . 2 . 3 ]" 1
93 1 92 GLU H 1 92 GLU HA 2.850 . 4.000 2.801 2.787 2.818 . 0 0 "[ . 1 . 2 . 3 ]" 1
94 1 77 GLY H 1 77 GLY HA3 2.350 . 3.000 2.955 2.910 2.967 . 0 0 "[ . 1 . 2 . 3 ]" 1
95 1 9 ILE H 1 9 ILE MG 3.600 . 6.000 3.739 3.734 3.745 . 0 0 "[ . 1 . 2 . 3 ]" 1
96 1 73 LYS H 1 75 ILE H 3.350 . 5.500 4.723 4.656 4.886 . 0 0 "[ . 1 . 2 . 3 ]" 1
97 1 1 GLY HA3 1 2 ASP H 2.850 . 4.000 3.115 2.345 3.572 . 0 0 "[ . 1 . 2 . 3 ]" 1
98 1 8 LYS H 1 10 PHE H 2.850 . 4.000 3.880 3.850 3.931 . 0 0 "[ . 1 . 2 . 3 ]" 1
99 1 91 ARG HA 1 92 GLU H 3.350 . 5.500 3.568 3.556 3.571 . 0 0 "[ . 1 . 2 . 3 ]" 1
100 1 57 ILE H 1 58 THR H 3.350 . 5.500 4.401 4.381 4.420 . 0 0 "[ . 1 . 2 . 3 ]" 1
101 1 94 LEU HA 1 97 TYR H 2.850 . 4.000 3.623 3.556 3.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
102 1 55 LYS H 1 56 GLY H 2.850 . 4.000 2.993 2.894 3.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
103 1 95 ILE H 1 95 ILE MG 3.600 . 4.500 3.683 3.662 3.706 . 0 0 "[ . 1 . 2 . 3 ]" 1
104 1 58 THR H 1 60 LYS QE 3.350 . 5.500 3.926 3.710 4.729 . 0 0 "[ . 1 . 2 . 3 ]" 1
105 1 49 THR MG 1 50 ASP H 3.600 . 6.000 3.824 3.666 3.952 . 0 0 "[ . 1 . 2 . 3 ]" 1
106 1 59 TRP H 1 59 TRP HD1 2.850 . 4.000 3.131 3.021 3.189 . 0 0 "[ . 1 . 2 . 3 ]" 1
107 1 8 LYS HA 1 9 ILE H 2.850 . 4.000 3.556 3.517 3.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
108 1 17 CYS H 1 18 HIS H 2.350 . 3.000 3.025 2.999 3.055 0.055 8 0 "[ . 1 . 2 . 3 ]" 1
109 1 65 MET HA 1 68 LEU H 3.350 . 5.500 3.245 3.206 3.294 . 0 0 "[ . 1 . 2 . 3 ]" 1
110 1 34 GLY H 1 35 LEU H 2.850 . 4.000 2.916 2.837 3.042 . 0 0 "[ . 1 . 2 . 3 ]" 1
111 1 19 THR H 1 32 LEU H 2.850 . 4.500 4.107 3.788 4.355 . 0 0 "[ . 1 . 2 . 3 ]" 1
112 1 97 TYR HD2 1 98 LEU H 3.350 . 5.500 3.165 2.812 3.651 . 0 0 "[ . 1 . 2 . 3 ]" 1
113 1 60 LYS H 1 60 LYS QG 2.850 . 4.000 3.285 3.208 3.381 . 0 0 "[ . 1 . 2 . 3 ]" 1
114 1 51 ALA MB 1 52 ASN H 3.100 . 4.500 2.508 2.188 2.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
115 1 82 PHE H 1 82 PHE QD 3.350 . 5.500 4.331 4.197 4.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
116 1 89 THR H 1 90 GLU H 2.850 . 4.000 2.730 2.549 2.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
117 1 63 THR H 1 63 THR HB 3.350 . 5.500 3.596 3.592 3.602 . 0 0 "[ . 1 . 2 . 3 ]" 1
118 1 70 ASN H 1 70 ASN HB3 2.850 . 4.000 3.437 3.309 3.762 . 0 0 "[ . 1 . 2 . 3 ]" 1
119 1 60 LYS HA 1 61 GLU H 2.850 . 4.000 2.806 2.707 2.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
120 1 11 VAL H 1 14 CYS H 3.350 . 5.500 5.092 5.061 5.137 . 0 0 "[ . 1 . 2 . 3 ]" 1
121 1 10 PHE HA 1 13 LYS H 3.350 . 5.500 3.219 3.117 3.271 . 0 0 "[ . 1 . 2 . 3 ]" 1
122 1 73 LYS H 1 73 LYS QB 2.350 . 3.000 2.207 2.132 2.262 . 0 0 "[ . 1 . 2 . 3 ]" 1
123 1 72 LYS H 1 72 LYS QG 3.350 . 5.000 4.008 3.994 4.025 . 0 0 "[ . 1 . 2 . 3 ]" 1
124 1 13 LYS H 1 14 CYS H 2.350 . 3.000 2.659 2.624 2.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
125 1 26 HIS HB3 1 27 LYS H 2.850 . 4.000 3.969 3.443 4.094 0.094 3 0 "[ . 1 . 2 . 3 ]" 1
126 1 47 THR H 1 48 TYR H 2.850 . 4.000 4.023 3.974 4.059 0.059 24 0 "[ . 1 . 2 . 3 ]" 1
127 1 16 GLN H 1 17 CYS H 2.850 . 4.000 3.132 3.045 3.211 . 0 0 "[ . 1 . 2 . 3 ]" 1
128 1 67 TYR H 1 67 TYR HB2 2.350 . 3.000 2.777 2.607 2.871 . 0 0 "[ . 1 . 2 . 3 ]" 1
129 1 38 ARG H 1 58 THR MG 3.600 . 6.000 3.445 3.289 3.729 . 0 0 "[ . 1 . 2 . 3 ]" 1
130 1 35 LEU H 1 102 THR HA 3.350 . 5.500 5.455 5.252 5.528 0.028 2 0 "[ . 1 . 2 . 3 ]" 1
131 1 96 ALA H 1 98 LEU H 3.350 . 5.500 4.077 3.843 4.331 . 0 0 "[ . 1 . 2 . 3 ]" 1
132 1 79 LYS H 1 79 LYS QD 3.350 . 5.500 4.190 2.742 4.739 . 0 0 "[ . 1 . 2 . 3 ]" 1
133 1 35 LEU HG 1 36 PHE H 2.850 . 4.000 3.338 3.254 3.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
134 1 9 ILE MD 1 93 ASP H 3.600 . 6.000 4.807 4.711 4.864 . 0 0 "[ . 1 . 2 . 3 ]" 1
135 1 9 ILE MD 1 94 LEU H 3.600 . 4.500 3.412 3.267 3.499 . 0 0 "[ . 1 . 2 . 3 ]" 1
136 1 88 LYS QB 1 89 THR H 2.850 . 4.000 2.363 2.236 2.649 . 0 0 "[ . 1 . 2 . 3 ]" 1
137 1 65 MET H 1 91 ARG QB 3.350 . 5.500 4.647 4.577 4.706 . 0 0 "[ . 1 . 2 . 3 ]" 1
138 1 8 LYS H 1 9 ILE HA 3.350 . 5.500 5.369 5.230 5.405 . 0 0 "[ . 1 . 2 . 3 ]" 1
139 1 36 PHE H 1 36 PHE QD 3.350 . 5.500 1.788 1.731 1.954 . 0 0 "[ . 1 . 2 . 3 ]" 1
140 1 103 ASN HB3 1 103 ASN HD21 2.850 . 4.000 3.522 3.504 3.539 . 0 0 "[ . 1 . 2 . 3 ]" 1
141 1 30 PRO HA 1 31 ASN H 2.850 . 3.000 2.451 2.254 2.562 . 0 0 "[ . 1 . 2 . 3 ]" 1
142 1 90 GLU HA 1 93 ASP H 2.850 . 4.000 3.990 3.911 4.120 0.120 5 0 "[ . 1 . 2 . 3 ]" 1
143 1 64 LEU QD 1 67 TYR H 3.600 . 6.000 4.452 4.212 4.625 . 0 0 "[ . 1 . 2 . 3 ]" 1
144 1 95 ILE H 1 98 LEU H 3.350 . 5.500 4.678 4.615 4.773 . 0 0 "[ . 1 . 2 . 3 ]" 1
145 1 63 THR H 1 63 THR MG 3.100 . 3.500 1.930 1.898 1.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
146 1 72 LYS HA 1 73 LYS H 2.850 . 4.000 3.570 3.559 3.579 . 0 0 "[ . 1 . 2 . 3 ]" 1
147 1 99 LYS HA 1 102 THR H 2.850 . 4.000 3.582 3.533 3.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
148 1 26 HIS HD2 1 46 PHE H 3.350 . 5.500 4.676 3.614 5.510 0.010 28 0 "[ . 1 . 2 . 3 ]" 1
149 1 53 LYS H 1 53 LYS QD 3.350 . 5.500 4.311 3.983 4.457 . 0 0 "[ . 1 . 2 . 3 ]" 1
150 1 13 LYS H 1 13 LYS QE 3.350 . 5.500 4.746 3.620 5.019 . 0 0 "[ . 1 . 2 . 3 ]" 1
151 1 48 TYR HB3 1 49 THR H 2.850 . 4.000 2.799 2.729 2.881 . 0 0 "[ . 1 . 2 . 3 ]" 1
152 1 58 THR H 1 58 THR HB 2.350 . 3.000 2.510 2.401 2.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
153 1 21 GLU HA 1 22 LYS H 2.350 . 3.000 2.134 2.126 2.163 . 0 0 "[ . 1 . 2 . 3 ]" 1
154 1 32 LEU H 1 32 LEU HB2 3.350 . 5.500 2.718 2.618 2.873 . 0 0 "[ . 1 . 2 . 3 ]" 1
155 1 16 GLN H 1 16 GLN QG 3.350 . 5.500 2.375 2.031 2.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
156 1 10 PHE HB2 1 11 VAL H 2.850 . 4.000 3.935 3.917 3.950 . 0 0 "[ . 1 . 2 . 3 ]" 1
157 1 65 MET HG2 1 66 GLU H 3.350 . 5.500 4.862 4.814 4.891 . 0 0 "[ . 1 . 2 . 3 ]" 1
158 1 15 ALA HA 1 18 HIS H 3.350 . 4.000 3.542 3.462 3.617 . 0 0 "[ . 1 . 2 . 3 ]" 1
159 1 93 ASP H 1 93 ASP QB 2.850 . 4.000 2.462 2.401 2.532 . 0 0 "[ . 1 . 2 . 3 ]" 1
160 1 64 LEU QB 1 65 MET H 2.850 . 4.000 2.829 2.774 2.860 . 0 0 "[ . 1 . 2 . 3 ]" 1
161 1 2 ASP H 1 2 ASP HB2 2.350 . 3.000 2.646 2.360 2.924 . 0 0 "[ . 1 . 2 . 3 ]" 1
162 1 66 GLU H 1 67 TYR H 2.350 . 3.000 2.600 2.550 2.640 . 0 0 "[ . 1 . 2 . 3 ]" 1
163 1 16 GLN HB3 1 17 CYS H 3.350 . 4.000 2.977 2.546 3.203 . 0 0 "[ . 1 . 2 . 3 ]" 1
164 1 70 ASN H 1 70 ASN HA 2.850 . 4.000 2.840 2.793 2.866 . 0 0 "[ . 1 . 2 . 3 ]" 1
165 1 56 GLY H 1 57 ILE HA 3.350 . 5.500 4.986 4.909 5.054 . 0 0 "[ . 1 . 2 . 3 ]" 1
166 1 12 GLN H 1 13 LYS H 2.850 . 3.000 2.309 2.283 2.344 . 0 0 "[ . 1 . 2 . 3 ]" 1
167 1 40 THR H 1 59 TRP HE1 3.350 . 5.500 4.118 3.674 4.644 . 0 0 "[ . 1 . 2 . 3 ]" 1
168 1 62 GLU H 1 64 LEU H 3.350 . 5.500 4.061 4.018 4.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
169 1 5 LYS H 1 5 LYS QE 3.350 . 5.500 3.003 2.050 3.392 . 0 0 "[ . 1 . 2 . 3 ]" 1
170 1 35 LEU QB 1 36 PHE H 3.350 . 5.500 2.210 2.149 2.230 . 0 0 "[ . 1 . 2 . 3 ]" 1
171 1 18 HIS HD2 1 19 THR H 3.350 . 5.500 5.480 5.293 5.572 0.072 19 0 "[ . 1 . 2 . 3 ]" 1
172 1 80 MET H 1 80 MET HA 2.350 . 3.000 2.826 2.809 2.852 . 0 0 "[ . 1 . 2 . 3 ]" 1
173 1 3 VAL H 1 3 VAL MG1 3.100 . 3.500 1.996 1.877 2.124 . 0 0 "[ . 1 . 2 . 3 ]" 1
174 1 11 VAL H 1 94 LEU QD 3.600 . 6.000 4.699 4.600 4.777 . 0 0 "[ . 1 . 2 . 3 ]" 1
175 1 68 LEU QD 1 91 ARG H 3.600 . 6.000 4.700 4.460 4.805 . 0 0 "[ . 1 . 2 . 3 ]" 1
176 1 101 ALA H 1 104 GLU H 3.350 . 5.500 4.817 4.446 5.079 . 0 0 "[ . 1 . 2 . 3 ]" 1
177 1 103 ASN HB2 1 103 ASN HD21 2.850 . 3.000 3.038 3.004 3.065 0.065 6 0 "[ . 1 . 2 . 3 ]" 1
178 1 95 ILE MG 1 96 ALA H 3.600 . 6.000 3.441 3.351 3.525 . 0 0 "[ . 1 . 2 . 3 ]" 1
179 1 74 TYR H 1 74 TYR QB 3.350 . 5.500 2.175 2.133 2.276 . 0 0 "[ . 1 . 2 . 3 ]" 1
180 1 97 TYR H 1 98 LEU H 2.850 . 4.000 2.499 2.390 2.643 . 0 0 "[ . 1 . 2 . 3 ]" 1
181 1 64 LEU H 1 95 ILE MG 3.600 . 6.000 4.766 4.593 4.842 . 0 0 "[ . 1 . 2 . 3 ]" 1
182 1 57 ILE MD 1 58 THR H 3.600 . 4.500 2.415 2.238 2.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
183 1 35 LEU H 1 35 LEU HA 2.350 . 3.000 2.727 2.705 2.764 . 0 0 "[ . 1 . 2 . 3 ]" 1
184 1 8 LYS QD 1 10 PHE H 3.350 . 5.500 4.596 4.542 4.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
185 1 72 LYS H 1 72 LYS QB 2.850 . 4.000 2.268 2.254 2.295 . 0 0 "[ . 1 . 2 . 3 ]" 1
186 1 7 LYS H 1 97 TYR HB2 2.850 . 4.000 3.086 2.911 3.255 . 0 0 "[ . 1 . 2 . 3 ]" 1
187 1 39 LYS QB 1 40 THR H 2.850 . 4.000 2.639 2.222 3.649 . 0 0 "[ . 1 . 2 . 3 ]" 1
188 1 61 GLU H 1 61 GLU HB3 2.350 . 3.000 2.571 2.416 2.702 . 0 0 "[ . 1 . 2 . 3 ]" 1
189 1 70 ASN HA 1 72 LYS H 2.850 . 4.000 3.508 3.341 3.724 . 0 0 "[ . 1 . 2 . 3 ]" 1
190 1 25 LYS H 1 25 LYS QE 3.350 . 5.500 3.957 2.982 4.603 . 0 0 "[ . 1 . 2 . 3 ]" 1
191 1 23 GLY H 1 24 GLY H 2.850 . 4.000 2.605 2.224 2.930 . 0 0 "[ . 1 . 2 . 3 ]" 1
192 1 37 GLY HA2 1 38 ARG H 2.850 . 4.000 3.507 3.460 3.536 . 0 0 "[ . 1 . 2 . 3 ]" 1
193 1 7 LYS H 1 7 LYS QD 3.350 . 5.500 4.499 4.161 4.685 . 0 0 "[ . 1 . 2 . 3 ]" 1
194 1 92 GLU H 1 95 ILE MD 3.600 . 6.000 3.778 3.680 4.121 . 0 0 "[ . 1 . 2 . 3 ]" 1
195 1 102 THR H 1 104 GLU H 2.850 . 4.000 3.984 3.757 4.044 0.044 6 0 "[ . 1 . 2 . 3 ]" 1
196 1 3 VAL MG1 1 4 GLU H 3.600 . 6.000 2.414 2.295 2.491 . 0 0 "[ . 1 . 2 . 3 ]" 1
197 1 16 GLN H 1 16 GLN HB2 2.850 . 4.000 2.373 2.122 2.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
198 1 99 LYS QB 1 100 LYS H 2.350 . 3.000 2.413 2.313 2.546 . 0 0 "[ . 1 . 2 . 3 ]" 1
199 1 68 LEU H 1 69 GLU H 2.850 . 4.000 2.442 2.383 2.516 . 0 0 "[ . 1 . 2 . 3 ]" 1
200 1 35 LEU H 1 35 LEU QB 2.350 . 3.000 2.226 2.203 2.238 . 0 0 "[ . 1 . 2 . 3 ]" 1
201 1 11 VAL H 1 13 LYS H 2.850 . 4.000 4.121 4.088 4.162 0.162 15 0 "[ . 1 . 2 . 3 ]" 1
202 1 12 GLN QB 1 12 GLN HE22 3.350 . 5.500 3.115 3.100 3.156 . 0 0 "[ . 1 . 2 . 3 ]" 1
203 1 13 LYS H 1 13 LYS QD 3.350 . 5.500 4.472 3.826 4.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
204 1 5 LYS QB 1 6 GLY H 2.850 . 4.000 3.040 2.984 3.120 . 0 0 "[ . 1 . 2 . 3 ]" 1
205 1 36 PHE H 1 36 PHE HA 2.350 . 3.000 2.775 2.745 2.787 . 0 0 "[ . 1 . 2 . 3 ]" 1
206 1 69 GLU HA 1 70 ASN H 2.850 . 4.000 3.352 3.301 3.388 . 0 0 "[ . 1 . 2 . 3 ]" 1
207 1 23 GLY H 1 23 GLY HA3 2.850 . 4.000 2.828 2.716 2.935 . 0 0 "[ . 1 . 2 . 3 ]" 1
208 1 13 LYS H 1 13 LYS HA 2.850 . 4.000 2.945 2.941 2.950 . 0 0 "[ . 1 . 2 . 3 ]" 1
209 1 42 GLN H 1 42 GLN HE21 3.350 . 5.500 4.829 1.657 5.547 0.047 25 0 "[ . 1 . 2 . 3 ]" 1
210 1 50 ASP QB 1 51 ALA H 2.600 . 3.500 2.662 2.450 3.180 . 0 0 "[ . 1 . 2 . 3 ]" 1
211 1 36 PHE H 1 99 LYS QG 3.350 . 5.500 4.774 4.604 4.908 . 0 0 "[ . 1 . 2 . 3 ]" 1
212 1 49 THR H 1 49 THR HA . . 3.000 2.902 2.885 2.917 . 0 0 "[ . 1 . 2 . 3 ]" 1
213 1 46 PHE H 1 46 PHE HB2 2.350 . 3.000 2.466 2.324 3.004 0.004 14 0 "[ . 1 . 2 . 3 ]" 1
214 1 40 THR H 1 57 ILE H 3.350 . 5.500 3.799 3.682 3.985 . 0 0 "[ . 1 . 2 . 3 ]" 1
215 1 31 ASN HA 1 32 LEU H 2.850 . 4.000 2.304 2.125 2.515 . 0 0 "[ . 1 . 2 . 3 ]" 1
216 1 24 GLY H 1 25 LYS H 2.850 . 4.000 4.059 3.876 4.255 0.255 29 0 "[ . 1 . 2 . 3 ]" 1
217 1 35 LEU MD2 1 36 PHE H 3.600 . 6.000 3.287 3.142 3.660 . 0 0 "[ . 1 . 2 . 3 ]" 1
218 1 63 THR H 1 65 MET H 2.850 . 4.000 4.092 4.023 4.145 0.145 5 0 "[ . 1 . 2 . 3 ]" 1
219 1 70 ASN H 1 71 PRO HB3 3.600 . 6.000 5.434 4.867 5.495 . 0 0 "[ . 1 . 2 . 3 ]" 1
220 1 81 ILE H 1 81 ILE HA 2.850 . 4.000 2.957 2.944 2.962 . 0 0 "[ . 1 . 2 . 3 ]" 1
221 1 72 LYS QB 1 73 LYS H 3.350 . 5.500 2.402 2.385 2.431 . 0 0 "[ . 1 . 2 . 3 ]" 1
222 1 103 ASN H 1 104 GLU H 2.350 . 3.000 2.120 1.896 2.333 . 0 0 "[ . 1 . 2 . 3 ]" 1
223 1 100 LYS H 1 101 ALA H 2.350 . 3.000 2.486 2.422 2.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
224 1 70 ASN HB3 1 73 LYS H 3.350 . 5.500 3.794 2.750 4.650 . 0 0 "[ . 1 . 2 . 3 ]" 1
225 1 19 THR H 1 27 LYS H 3.350 . 5.500 4.923 4.420 5.358 . 0 0 "[ . 1 . 2 . 3 ]" 1
226 1 60 LYS HA 1 62 GLU H 3.350 . 5.500 5.175 5.093 5.214 . 0 0 "[ . 1 . 2 . 3 ]" 1
227 1 61 GLU HA 1 63 THR H 3.350 . 5.500 4.764 4.591 4.983 . 0 0 "[ . 1 . 2 . 3 ]" 1
228 1 92 GLU H 1 92 GLU QB 2.850 . 4.000 2.219 2.125 2.259 . 0 0 "[ . 1 . 2 . 3 ]" 1
229 1 37 GLY H 1 38 ARG QB 3.350 . 5.500 4.180 3.957 4.267 . 0 0 "[ . 1 . 2 . 3 ]" 1
230 1 53 LYS HA 1 54 ASN H 3.350 . 5.500 3.351 3.302 3.399 . 0 0 "[ . 1 . 2 . 3 ]" 1
231 1 43 ALA H 1 43 ALA HA 2.850 . 4.000 2.844 2.796 2.897 . 0 0 "[ . 1 . 2 . 3 ]" 1
232 1 57 ILE HB 1 58 THR H 2.350 . 3.000 2.187 2.067 2.436 . 0 0 "[ . 1 . 2 . 3 ]" 1
233 1 2 ASP HB3 1 3 VAL H 3.350 . 4.000 4.072 4.034 4.119 0.119 8 0 "[ . 1 . 2 . 3 ]" 1
234 1 90 GLU H 1 90 GLU HA 2.350 . 3.000 2.851 2.841 2.865 . 0 0 "[ . 1 . 2 . 3 ]" 1
235 1 84 GLY HA3 1 85 ILE H 2.350 . 3.000 2.600 2.216 2.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
236 1 101 ALA MB 1 103 ASN H 3.600 . 4.500 4.219 4.168 4.283 . 0 0 "[ . 1 . 2 . 3 ]" 1
237 1 32 LEU H 1 32 LEU HA 2.850 . 4.000 2.931 2.871 2.966 . 0 0 "[ . 1 . 2 . 3 ]" 1
238 1 38 ARG QB 1 39 LYS H 3.350 . 5.500 2.856 2.661 3.167 . 0 0 "[ . 1 . 2 . 3 ]" 1
239 1 43 ALA H 1 43 ALA MB 3.100 . 3.500 2.056 2.020 2.149 . 0 0 "[ . 1 . 2 . 3 ]" 1
240 1 54 ASN HB3 1 54 ASN HD21 2.850 . 4.000 2.904 2.890 2.920 . 0 0 "[ . 1 . 2 . 3 ]" 1
241 1 47 THR MG 1 48 TYR H 3.600 . 5.500 3.626 3.489 4.245 . 0 0 "[ . 1 . 2 . 3 ]" 1
242 1 4 GLU H 1 4 GLU HA 2.600 . 3.500 2.869 2.863 2.876 . 0 0 "[ . 1 . 2 . 3 ]" 1
243 1 10 PHE H 1 10 PHE HA 2.850 . 4.000 2.887 2.872 2.894 . 0 0 "[ . 1 . 2 . 3 ]" 1
244 1 95 ILE H 1 95 ILE HA 2.850 . 4.000 2.857 2.848 2.862 . 0 0 "[ . 1 . 2 . 3 ]" 1
245 1 98 LEU MD1 1 99 LYS H 3.600 . 6.000 4.686 4.344 4.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
246 1 7 LYS H 1 7 LYS HA 2.350 . 3.000 2.849 2.840 2.864 . 0 0 "[ . 1 . 2 . 3 ]" 1
247 1 60 LYS HD2 1 61 GLU H 2.850 . 4.000 3.900 3.777 4.014 0.014 9 0 "[ . 1 . 2 . 3 ]" 1
248 1 55 LYS H 1 55 LYS QG 3.350 . 5.500 2.662 2.435 3.563 . 0 0 "[ . 1 . 2 . 3 ]" 1
249 1 94 LEU H 1 94 LEU QB . . 3.000 2.254 2.242 2.263 . 0 0 "[ . 1 . 2 . 3 ]" 1
250 1 98 LEU HA 1 101 ALA H 3.350 . 5.500 3.585 3.521 3.653 . 0 0 "[ . 1 . 2 . 3 ]" 1
251 1 81 ILE MG 1 82 PHE H 3.100 . 4.500 3.309 2.714 3.643 . 0 0 "[ . 1 . 2 . 3 ]" 1
252 1 78 THR H 1 78 THR HB 2.350 . 3.000 2.445 2.395 2.537 . 0 0 "[ . 1 . 2 . 3 ]" 1
253 1 12 GLN H 1 12 GLN HG3 2.850 . 3.000 3.346 3.216 3.421 0.421 1 0 "[ . 1 . 2 . 3 ]" 1
254 1 85 ILE HB 1 87 LYS H 3.350 . 5.500 5.457 5.297 5.531 0.031 23 0 "[ . 1 . 2 . 3 ]" 1
255 1 26 HIS H 1 27 LYS H 3.350 . 5.500 4.518 4.453 4.602 . 0 0 "[ . 1 . 2 . 3 ]" 1
256 1 59 TRP H 1 59 TRP HB3 2.850 . 4.000 3.587 3.573 3.603 . 0 0 "[ . 1 . 2 . 3 ]" 1
257 1 3 VAL MG2 1 97 TYR H 3.600 . 6.000 4.203 3.938 4.355 . 0 0 "[ . 1 . 2 . 3 ]" 1
258 1 91 ARG H 1 92 GLU H 2.850 . 4.000 2.536 2.483 2.583 . 0 0 "[ . 1 . 2 . 3 ]" 1
259 1 62 GLU H 1 63 THR MG 3.600 . 6.000 3.928 3.846 4.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
260 1 18 HIS H 1 19 THR HA 3.350 . 5.500 4.707 4.690 4.730 . 0 0 "[ . 1 . 2 . 3 ]" 1
261 1 2 ASP H 1 94 LEU H 3.350 . 5.500 5.465 5.322 5.535 0.035 26 0 "[ . 1 . 2 . 3 ]" 1
262 1 84 GLY HA2 1 85 ILE H 2.350 . 3.000 2.559 2.338 3.037 0.037 5 0 "[ . 1 . 2 . 3 ]" 1
263 1 69 GLU H 1 84 GLY HA3 3.350 . 5.500 5.379 5.045 5.528 0.028 11 0 "[ . 1 . 2 . 3 ]" 1
264 1 90 GLU H 1 90 GLU QG 2.850 . 4.000 2.569 2.496 2.731 . 0 0 "[ . 1 . 2 . 3 ]" 1
265 1 39 LYS H 1 58 THR MG 3.600 . 6.000 3.811 3.613 4.491 . 0 0 "[ . 1 . 2 . 3 ]" 1
266 1 12 GLN H 1 12 GLN HA 2.850 . 3.000 2.934 2.929 2.939 . 0 0 "[ . 1 . 2 . 3 ]" 1
267 1 70 ASN HD21 1 73 LYS HA 2.850 . 4.000 4.064 3.864 4.131 0.131 2 0 "[ . 1 . 2 . 3 ]" 1
268 1 53 LYS H 1 53 LYS QB 2.350 . 3.000 2.119 2.099 2.199 . 0 0 "[ . 1 . 2 . 3 ]" 1
269 1 8 LYS QB 1 9 ILE H 2.850 . 4.000 2.460 2.334 3.549 . 0 0 "[ . 1 . 2 . 3 ]" 1
270 1 97 TYR H 1 100 LYS H 3.350 . 5.500 4.902 4.753 5.023 . 0 0 "[ . 1 . 2 . 3 ]" 1
271 1 16 GLN HG2 1 17 CYS H 3.350 . 5.500 4.776 4.358 4.927 . 0 0 "[ . 1 . 2 . 3 ]" 1
272 1 2 ASP H 1 4 GLU H 3.350 . 5.500 4.892 4.750 5.104 . 0 0 "[ . 1 . 2 . 3 ]" 1
273 1 9 ILE MG 1 13 LYS H 3.600 . 6.000 4.058 3.984 4.124 . 0 0 "[ . 1 . 2 . 3 ]" 1
274 1 72 LYS QG 1 77 GLY H 3.350 . 5.500 3.403 3.107 3.815 . 0 0 "[ . 1 . 2 . 3 ]" 1
275 1 64 LEU QD 1 65 MET H 3.600 . 6.000 4.151 4.079 4.205 . 0 0 "[ . 1 . 2 . 3 ]" 1
276 1 65 MET HA 1 67 TYR H 2.850 . 4.000 4.137 4.057 4.197 0.197 29 0 "[ . 1 . 2 . 3 ]" 1
277 1 66 GLU H 1 67 TYR HA 3.350 . 5.500 5.250 5.218 5.279 . 0 0 "[ . 1 . 2 . 3 ]" 1
278 1 53 LYS H 1 54 ASN HA 3.350 . 5.500 4.811 4.753 4.881 . 0 0 "[ . 1 . 2 . 3 ]" 1
279 1 62 GLU H 1 63 THR H 2.850 . 4.000 2.628 2.568 2.714 . 0 0 "[ . 1 . 2 . 3 ]" 1
280 1 35 LEU H 1 35 LEU HG 3.350 . 5.500 4.407 4.379 4.443 . 0 0 "[ . 1 . 2 . 3 ]" 1
281 1 34 GLY H 1 36 PHE H 3.350 . 5.500 5.332 5.225 5.515 0.015 17 0 "[ . 1 . 2 . 3 ]" 1
282 1 102 THR H 1 102 THR HA 2.850 . 4.000 2.927 2.919 2.941 . 0 0 "[ . 1 . 2 . 3 ]" 1
283 1 9 ILE H 1 12 GLN H 3.350 . 5.500 5.109 4.972 5.149 . 0 0 "[ . 1 . 2 . 3 ]" 1
284 1 78 THR H 1 78 THR HA 2.350 . 3.000 2.787 2.785 2.789 . 0 0 "[ . 1 . 2 . 3 ]" 1
285 1 14 CYS H 1 14 CYS HB3 2.850 . 4.000 3.611 3.579 3.634 . 0 0 "[ . 1 . 2 . 3 ]" 1
286 1 11 VAL H 1 12 GLN H 2.850 . 4.000 2.745 2.731 2.760 . 0 0 "[ . 1 . 2 . 3 ]" 1
287 1 49 THR H 1 51 ALA H 3.350 . 5.500 5.207 4.820 5.504 0.004 29 0 "[ . 1 . 2 . 3 ]" 1
288 1 45 GLY HA2 1 46 PHE H 3.350 . 5.500 3.538 3.494 3.576 . 0 0 "[ . 1 . 2 . 3 ]" 1
289 1 42 GLN H 1 43 ALA H 2.850 . 4.000 1.978 1.892 2.065 . 0 0 "[ . 1 . 2 . 3 ]" 1
290 1 85 ILE MG 1 86 LYS H 3.600 . 6.000 1.808 1.748 1.854 . 0 0 "[ . 1 . 2 . 3 ]" 1
291 1 101 ALA HA 1 102 THR H 2.850 . 4.000 3.494 3.449 3.516 . 0 0 "[ . 1 . 2 . 3 ]" 1
292 1 49 THR HB 1 51 ALA H 2.350 . 3.000 2.972 2.768 3.043 0.043 29 0 "[ . 1 . 2 . 3 ]" 1
293 1 10 PHE HB3 1 11 VAL H 2.850 . 4.000 2.579 2.542 2.603 . 0 0 "[ . 1 . 2 . 3 ]" 1
294 1 11 VAL H 1 11 VAL QG 3.100 . 3.500 1.815 1.800 1.842 . 0 0 "[ . 1 . 2 . 3 ]" 1
295 1 11 VAL HA 1 12 GLN H 2.850 . 4.000 3.495 3.485 3.504 . 0 0 "[ . 1 . 2 . 3 ]" 1
296 1 64 LEU H 1 67 TYR H 3.350 . 5.500 4.715 4.676 4.751 . 0 0 "[ . 1 . 2 . 3 ]" 1
297 1 85 ILE MG 1 87 LYS H 3.600 . 4.500 2.857 2.473 2.939 . 0 0 "[ . 1 . 2 . 3 ]" 1
298 1 66 GLU H 1 66 GLU HG3 3.350 . 5.500 2.840 1.944 3.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
299 1 19 THR MG 1 25 LYS H 3.100 . 4.500 1.995 1.845 3.274 . 0 0 "[ . 1 . 2 . 3 ]" 1
300 1 98 LEU H 1 98 LEU MD2 3.600 . 4.500 3.889 3.792 3.939 . 0 0 "[ . 1 . 2 . 3 ]" 1
301 1 42 GLN H 1 42 GLN HA 2.850 . 4.000 2.963 2.954 2.967 . 0 0 "[ . 1 . 2 . 3 ]" 1
302 1 93 ASP QB 1 94 LEU H 3.350 . 4.000 2.355 2.278 2.460 . 0 0 "[ . 1 . 2 . 3 ]" 1
303 1 69 GLU H 1 84 GLY HA2 3.350 . 5.500 5.496 5.310 5.567 0.067 2 0 "[ . 1 . 2 . 3 ]" 1
304 1 9 ILE H 1 10 PHE H 2.850 . 4.000 2.577 2.432 2.628 . 0 0 "[ . 1 . 2 . 3 ]" 1
305 1 101 ALA H 1 102 THR MG 3.100 . 5.000 3.946 3.907 3.984 . 0 0 "[ . 1 . 2 . 3 ]" 1
306 1 2 ASP HA 1 3 VAL H 2.600 . 3.000 2.283 2.264 2.319 . 0 0 "[ . 1 . 2 . 3 ]" 1
307 1 97 TYR H 1 97 TYR HD2 3.350 . 5.500 4.454 4.339 4.595 . 0 0 "[ . 1 . 2 . 3 ]" 1
308 1 81 ILE HA 1 82 PHE H 2.350 . 3.000 2.235 2.153 2.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
309 1 98 LEU HA 1 100 LYS H 3.350 . 5.500 4.848 4.666 4.948 . 0 0 "[ . 1 . 2 . 3 ]" 1
310 1 103 ASN H 1 104 GLU HA 3.350 . 5.500 4.755 4.205 5.048 . 0 0 "[ . 1 . 2 . 3 ]" 1
311 1 63 THR HB 1 64 LEU H 2.850 . 4.000 3.742 3.647 3.800 . 0 0 "[ . 1 . 2 . 3 ]" 1
312 1 37 GLY H 1 37 GLY HA2 2.350 . 3.000 2.591 2.551 2.614 . 0 0 "[ . 1 . 2 . 3 ]" 1
313 1 2 ASP H 1 96 ALA MB 3.600 . 6.000 3.140 2.779 3.537 . 0 0 "[ . 1 . 2 . 3 ]" 1
314 1 11 VAL QG 1 12 GLN H 3.100 . 4.500 2.125 2.085 2.158 . 0 0 "[ . 1 . 2 . 3 ]" 1
315 1 72 LYS H 1 73 LYS H 2.350 . 3.000 2.596 2.470 2.684 . 0 0 "[ . 1 . 2 . 3 ]" 1
316 1 69 GLU H 1 69 GLU QG 2.850 . 4.000 2.698 1.859 3.745 . 0 0 "[ . 1 . 2 . 3 ]" 1
317 1 70 ASN H 1 71 PRO HD3 3.350 . 4.000 2.268 2.042 2.478 . 0 0 "[ . 1 . 2 . 3 ]" 1
318 1 95 ILE HA 1 99 LYS H 3.350 . 5.500 4.155 4.057 4.232 . 0 0 "[ . 1 . 2 . 3 ]" 1
319 1 17 CYS HA 1 29 GLY H 3.350 . 5.500 5.358 5.024 5.525 0.025 24 0 "[ . 1 . 2 . 3 ]" 1
320 1 98 LEU QB 1 99 LYS H 3.350 . 5.500 2.854 2.439 2.990 . 0 0 "[ . 1 . 2 . 3 ]" 1
321 1 62 GLU H 1 62 GLU QG 2.350 . 3.000 2.102 1.818 2.557 . 0 0 "[ . 1 . 2 . 3 ]" 1
322 1 64 LEU H 1 67 TYR HB2 3.350 . 5.500 5.494 5.230 5.592 0.092 28 0 "[ . 1 . 2 . 3 ]" 1
323 1 48 TYR HA 1 49 THR H 2.350 . 3.000 2.278 2.243 2.305 . 0 0 "[ . 1 . 2 . 3 ]" 1
324 1 54 ASN H 1 54 ASN HD21 3.350 . 5.500 2.188 2.067 2.330 . 0 0 "[ . 1 . 2 . 3 ]" 1
325 1 70 ASN HB2 1 73 LYS H 3.350 . 5.000 3.942 2.585 4.825 . 0 0 "[ . 1 . 2 . 3 ]" 1
326 1 22 LYS QB 1 23 GLY H 3.350 . 5.500 3.510 2.740 3.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
327 1 66 GLU HA 1 67 TYR H 2.850 . 4.000 3.478 3.468 3.486 . 0 0 "[ . 1 . 2 . 3 ]" 1
328 1 53 LYS H 1 54 ASN H 2.350 . 3.000 2.290 2.265 2.331 . 0 0 "[ . 1 . 2 . 3 ]" 1
329 1 45 GLY HA3 1 46 PHE H 2.850 . 4.000 2.379 2.272 2.783 . 0 0 "[ . 1 . 2 . 3 ]" 1
330 1 49 THR H 1 79 LYS H 3.350 . 4.000 4.106 4.039 4.182 0.182 27 0 "[ . 1 . 2 . 3 ]" 1
331 1 59 TRP H 1 60 LYS H 3.350 . 5.500 4.589 4.570 4.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
332 1 103 ASN H 1 103 ASN HB2 2.850 . 3.000 2.294 2.212 2.366 . 0 0 "[ . 1 . 2 . 3 ]" 1
333 1 12 GLN H 1 13 LYS QB 3.350 . 5.500 4.243 4.135 4.447 . 0 0 "[ . 1 . 2 . 3 ]" 1
334 1 22 LYS QD 1 23 GLY H 3.350 . 5.500 3.348 1.940 4.761 . 0 0 "[ . 1 . 2 . 3 ]" 1
335 1 100 LYS H 1 102 THR H 2.850 . 4.000 4.076 3.967 4.115 0.115 14 0 "[ . 1 . 2 . 3 ]" 1
336 1 63 THR H 1 64 LEU H 2.350 . 3.000 2.715 2.615 2.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
337 1 40 THR MG 1 41 GLY H 3.600 . 6.000 3.633 3.459 3.923 . 0 0 "[ . 1 . 2 . 3 ]" 1
338 1 17 CYS H 1 17 CYS HB2 2.850 . 4.000 3.090 3.037 3.144 . 0 0 "[ . 1 . 2 . 3 ]" 1
339 1 22 LYS QB 1 104 GLU H 3.350 . 5.500 4.427 3.617 4.873 . 0 0 "[ . 1 . 2 . 3 ]" 1
340 1 61 GLU H 1 63 THR H 3.350 . 5.500 3.844 3.719 4.044 . 0 0 "[ . 1 . 2 . 3 ]" 1
341 1 92 GLU QB 1 93 ASP H 3.350 . 5.500 2.260 2.242 2.289 . 0 0 "[ . 1 . 2 . 3 ]" 1
342 1 42 GLN H 1 59 TRP HE1 3.350 . 5.500 5.038 3.980 5.230 . 0 0 "[ . 1 . 2 . 3 ]" 1
343 1 48 TYR HB2 1 49 THR H 2.850 . 4.000 4.059 3.991 4.101 0.101 22 0 "[ . 1 . 2 . 3 ]" 1
344 1 20 VAL H 1 21 GLU H 2.850 . 4.000 2.930 2.875 2.960 . 0 0 "[ . 1 . 2 . 3 ]" 1
345 1 78 THR MG 1 79 LYS H 3.600 . 6.000 3.733 3.627 3.901 . 0 0 "[ . 1 . 2 . 3 ]" 1
346 1 50 ASP H 1 50 ASP HA 2.350 . 3.000 2.773 2.734 2.852 . 0 0 "[ . 1 . 2 . 3 ]" 1
347 1 56 GLY H 1 56 GLY HA3 2.350 . 3.000 2.344 2.324 2.369 . 0 0 "[ . 1 . 2 . 3 ]" 1
348 1 85 ILE H 1 85 ILE MD 3.600 . 6.000 3.964 3.757 4.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
349 1 6 GLY H 1 9 ILE MD 3.600 . 6.000 4.409 4.274 4.617 . 0 0 "[ . 1 . 2 . 3 ]" 1
350 1 12 GLN HA 1 12 GLN HE22 3.350 . 5.500 5.649 5.559 5.665 0.165 28 0 "[ . 1 . 2 . 3 ]" 1
351 1 5 LYS HA 1 8 LYS H 2.350 . 3.000 3.115 3.096 3.153 0.153 10 0 "[ . 1 . 2 . 3 ]" 1
352 1 36 PHE HE2 1 61 GLU H 3.350 . 5.500 4.828 4.514 5.512 0.012 27 0 "[ . 1 . 2 . 3 ]" 1
353 1 6 GLY H 1 6 GLY HA2 2.850 . 4.000 2.867 2.856 2.894 . 0 0 "[ . 1 . 2 . 3 ]" 1
354 1 51 ALA HA 1 54 ASN H 2.850 . 4.000 3.559 3.408 3.636 . 0 0 "[ . 1 . 2 . 3 ]" 1
355 1 30 PRO HB3 1 31 ASN H 3.350 . 5.500 3.455 3.303 3.769 . 0 0 "[ . 1 . 2 . 3 ]" 1
356 1 21 GLU QB 1 22 LYS H 2.850 . 4.000 3.404 3.117 3.546 . 0 0 "[ . 1 . 2 . 3 ]" 1
357 1 3 VAL HA 1 4 GLU H 3.350 . 4.000 3.435 3.422 3.449 . 0 0 "[ . 1 . 2 . 3 ]" 1
358 1 66 GLU HB3 1 67 TYR H 2.850 . 4.000 3.864 3.708 4.002 0.002 5 0 "[ . 1 . 2 . 3 ]" 1
359 1 37 GLY H 1 37 GLY HA3 2.350 . 3.000 2.951 2.945 2.960 . 0 0 "[ . 1 . 2 . 3 ]" 1
360 1 48 TYR H 1 49 THR H 3.350 . 5.500 4.638 4.626 4.652 . 0 0 "[ . 1 . 2 . 3 ]" 1
361 1 51 ALA H 1 51 ALA MB 2.850 . 3.500 2.218 2.187 2.245 . 0 0 "[ . 1 . 2 . 3 ]" 1
362 1 15 ALA HA 1 16 GLN H 3.350 . 5.500 3.477 3.471 3.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
363 1 42 GLN H 1 42 GLN QG 3.350 . 5.500 3.889 2.142 4.175 . 0 0 "[ . 1 . 2 . 3 ]" 1
364 1 75 ILE H 1 78 THR MG 3.600 . 4.500 3.553 3.354 3.613 . 0 0 "[ . 1 . 2 . 3 ]" 1
365 1 39 LYS H 1 39 LYS QB 2.600 . 3.000 2.192 2.065 2.331 . 0 0 "[ . 1 . 2 . 3 ]" 1
366 1 68 LEU HG 1 69 GLU H 3.350 . 5.500 4.869 4.682 5.014 . 0 0 "[ . 1 . 2 . 3 ]" 1
367 1 24 GLY HA2 1 25 LYS H 2.850 . 4.000 3.013 2.105 3.153 . 0 0 "[ . 1 . 2 . 3 ]" 1
368 1 40 THR HA 1 59 TRP HE1 2.850 . 4.000 1.859 1.722 1.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
369 1 69 GLU H 1 69 GLU QB 2.850 . 4.000 2.431 2.149 2.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
370 1 61 GLU H 1 62 GLU H 3.350 . 4.000 2.693 2.671 2.779 . 0 0 "[ . 1 . 2 . 3 ]" 1
371 1 34 GLY HA3 1 36 PHE H 3.350 . 5.500 5.048 4.927 5.121 . 0 0 "[ . 1 . 2 . 3 ]" 1
372 1 57 ILE HG12 1 58 THR H 3.350 . 5.500 4.393 4.292 4.635 . 0 0 "[ . 1 . 2 . 3 ]" 1
373 1 52 ASN H 1 52 ASN QB 2.350 . 3.000 2.137 2.082 2.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
374 1 68 LEU H 1 68 LEU QB 3.350 . 5.500 2.168 2.110 2.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
375 1 98 LEU H 1 98 LEU HG 2.850 . 4.000 2.569 2.462 2.674 . 0 0 "[ . 1 . 2 . 3 ]" 1
376 1 22 LYS H 1 104 GLU HA 3.350 . 5.500 4.909 4.033 5.551 0.051 31 0 "[ . 1 . 2 . 3 ]" 1
377 1 35 LEU H 1 35 LEU MD2 3.600 . 6.000 4.244 4.197 4.297 . 0 0 "[ . 1 . 2 . 3 ]" 1
378 1 36 PHE H 1 36 PHE HB3 2.850 . 4.000 3.571 3.507 3.584 . 0 0 "[ . 1 . 2 . 3 ]" 1
379 1 15 ALA MB 1 16 GLN H 3.600 . 6.000 2.859 2.841 2.874 . 0 0 "[ . 1 . 2 . 3 ]" 1
380 1 94 LEU H 1 95 ILE H 2.850 . 4.000 2.677 2.621 2.728 . 0 0 "[ . 1 . 2 . 3 ]" 1
381 1 53 LYS H 1 53 LYS HA 2.850 . 4.000 2.904 2.880 2.909 . 0 0 "[ . 1 . 2 . 3 ]" 1
382 1 97 TYR H 1 97 TYR HB3 2.850 . 4.000 2.371 2.319 2.435 . 0 0 "[ . 1 . 2 . 3 ]" 1
383 1 13 LYS H 1 13 LYS QB 2.850 . 4.000 2.400 2.362 2.465 . 0 0 "[ . 1 . 2 . 3 ]" 1
384 1 40 THR H 1 41 GLY H 3.350 . 5.500 4.616 4.540 4.633 . 0 0 "[ . 1 . 2 . 3 ]" 1
385 1 15 ALA H 1 15 ALA MB 3.100 . 3.500 2.210 2.190 2.233 . 0 0 "[ . 1 . 2 . 3 ]" 1
386 1 48 TYR H 1 48 TYR HB3 2.850 . 4.000 3.522 3.504 3.554 . 0 0 "[ . 1 . 2 . 3 ]" 1
387 1 3 VAL HA 1 6 GLY H 2.850 . 4.000 3.467 3.388 3.530 . 0 0 "[ . 1 . 2 . 3 ]" 1
388 1 64 LEU H 1 66 GLU H 3.350 . 5.500 4.572 4.518 4.624 . 0 0 "[ . 1 . 2 . 3 ]" 1
389 1 54 ASN H 1 55 LYS H 2.850 . 4.000 2.527 2.452 2.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
390 1 99 LYS QG 1 100 LYS H 3.350 . 5.500 4.171 4.038 4.268 . 0 0 "[ . 1 . 2 . 3 ]" 1
391 1 65 MET H 1 65 MET HG2 2.600 . 3.500 3.433 3.267 3.526 0.026 9 0 "[ . 1 . 2 . 3 ]" 1
392 1 40 THR HA 1 41 GLY H 2.850 . 3.000 2.210 2.152 2.243 . 0 0 "[ . 1 . 2 . 3 ]" 1
393 1 55 LYS H 1 55 LYS QD 3.350 . 5.500 4.381 2.264 4.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
394 1 58 THR MG 1 59 TRP H 3.600 . 4.500 2.255 2.084 2.359 . 0 0 "[ . 1 . 2 . 3 ]" 1
395 1 52 ASN H 1 75 ILE MG 3.600 . 6.000 3.577 3.339 3.794 . 0 0 "[ . 1 . 2 . 3 ]" 1
396 1 100 LYS QB 1 101 ALA H 2.850 . 4.000 3.026 2.873 3.105 . 0 0 "[ . 1 . 2 . 3 ]" 1
397 1 99 LYS H 1 99 LYS QB 2.850 . 4.000 2.253 2.171 2.416 . 0 0 "[ . 1 . 2 . 3 ]" 1
398 1 53 LYS QB 1 54 ASN H 2.850 . 4.000 3.348 3.062 3.550 . 0 0 "[ . 1 . 2 . 3 ]" 1
399 1 57 ILE HA 1 58 THR H 2.350 . 3.000 2.549 2.404 2.604 . 0 0 "[ . 1 . 2 . 3 ]" 1
400 1 87 LYS H 1 90 GLU QG 2.850 . 4.000 3.571 3.459 3.705 . 0 0 "[ . 1 . 2 . 3 ]" 1
401 1 33 HIS H 1 34 GLY H 3.350 . 5.500 4.622 4.478 4.645 . 0 0 "[ . 1 . 2 . 3 ]" 1
402 1 25 LYS H 1 25 LYS HA 2.600 . 3.000 2.913 2.745 2.947 . 0 0 "[ . 1 . 2 . 3 ]" 1
403 1 52 ASN HA 1 53 LYS H 3.350 . 5.500 3.465 3.453 3.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
404 1 52 ASN H 1 78 THR H 3.350 . 5.500 5.006 4.521 5.313 . 0 0 "[ . 1 . 2 . 3 ]" 1
405 1 56 GLY H 1 57 ILE H 2.850 . 4.000 2.385 2.236 2.530 . 0 0 "[ . 1 . 2 . 3 ]" 1
406 1 103 ASN HB2 1 104 GLU H 2.850 . 3.000 3.047 3.011 3.079 0.079 23 0 "[ . 1 . 2 . 3 ]" 1
407 1 100 LYS H 1 101 ALA MB 3.600 . 6.000 4.164 4.069 4.275 . 0 0 "[ . 1 . 2 . 3 ]" 1
408 1 89 THR H 1 90 GLU QB 3.350 . 5.500 4.650 4.468 4.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
409 1 12 GLN H 1 14 CYS H 2.850 . 4.000 4.547 4.521 4.596 0.596 10 32 [*********+*********-************] 1
410 1 63 THR HA 1 66 GLU H 2.850 . 4.000 3.810 3.749 3.881 . 0 0 "[ . 1 . 2 . 3 ]" 1
411 1 7 LYS HA 1 8 LYS H 2.850 . 4.000 3.558 3.549 3.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
412 1 56 GLY H 1 57 ILE MG 3.600 . 6.000 4.354 4.198 4.618 . 0 0 "[ . 1 . 2 . 3 ]" 1
413 1 54 ASN H 1 54 ASN HB3 2.350 . 3.000 2.224 2.172 2.274 . 0 0 "[ . 1 . 2 . 3 ]" 1
414 1 99 LYS QE 1 100 LYS H 3.350 . 5.500 4.478 4.203 4.782 . 0 0 "[ . 1 . 2 . 3 ]" 1
415 1 100 LYS H 1 103 ASN H 3.350 . 5.500 4.882 4.704 5.118 . 0 0 "[ . 1 . 2 . 3 ]" 1
416 1 64 LEU H 1 67 TYR HB3 3.350 . 5.500 4.652 4.463 4.892 . 0 0 "[ . 1 . 2 . 3 ]" 1
417 1 37 GLY HA3 1 38 ARG H 2.350 . 3.000 3.023 2.958 3.084 0.084 2 0 "[ . 1 . 2 . 3 ]" 1
418 1 12 GLN H 1 12 GLN QB 2.850 . 4.000 2.658 2.601 2.787 . 0 0 "[ . 1 . 2 . 3 ]" 1
419 1 78 THR H 1 78 THR MG 3.100 . 4.500 2.116 1.944 2.222 . 0 0 "[ . 1 . 2 . 3 ]" 1
420 1 9 ILE MG 1 10 PHE H 3.600 . 4.500 3.733 3.612 3.776 . 0 0 "[ . 1 . 2 . 3 ]" 1
421 1 103 ASN HA 1 104 GLU H 2.600 . 3.500 3.460 3.441 3.476 . 0 0 "[ . 1 . 2 . 3 ]" 1
422 1 21 GLU QG 1 24 GLY H 2.850 . 4.000 3.145 3.035 3.312 . 0 0 "[ . 1 . 2 . 3 ]" 1
423 1 95 ILE MG 1 99 LYS H 3.600 . 6.000 3.926 3.610 4.074 . 0 0 "[ . 1 . 2 . 3 ]" 1
424 1 95 ILE HB 1 97 TYR H 3.350 . 5.500 5.168 5.113 5.219 . 0 0 "[ . 1 . 2 . 3 ]" 1
425 1 14 CYS H 1 15 ALA MB 3.600 . 6.000 4.220 4.157 4.267 . 0 0 "[ . 1 . 2 . 3 ]" 1
426 1 8 LYS H 1 8 LYS QB 2.350 . 3.000 2.251 2.239 2.356 . 0 0 "[ . 1 . 2 . 3 ]" 1
427 1 15 ALA H 1 16 GLN H 2.850 . 4.000 2.811 2.796 2.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
428 1 7 LYS QD 1 8 LYS H 3.350 . 5.500 4.485 3.090 4.919 . 0 0 "[ . 1 . 2 . 3 ]" 1
429 1 2 ASP H 1 3 VAL H 2.850 . 4.000 3.706 3.385 3.959 . 0 0 "[ . 1 . 2 . 3 ]" 1
430 1 46 PHE HA 1 48 TYR H 3.350 . 5.500 5.067 4.967 5.203 . 0 0 "[ . 1 . 2 . 3 ]" 1
431 1 62 GLU HA 1 63 THR H 2.850 . 4.000 3.551 3.530 3.571 . 0 0 "[ . 1 . 2 . 3 ]" 1
432 1 62 GLU H 1 62 GLU QB 2.600 . 3.500 2.495 2.335 2.784 . 0 0 "[ . 1 . 2 . 3 ]" 1
433 1 38 ARG H 1 38 ARG HA 2.350 . 3.000 2.916 2.875 2.930 . 0 0 "[ . 1 . 2 . 3 ]" 1
434 1 41 GLY H 1 41 GLY HA2 2.850 . 4.000 2.300 2.290 2.306 . 0 0 "[ . 1 . 2 . 3 ]" 1
435 1 67 TYR HB2 1 68 LEU H 3.350 . 5.500 4.124 3.986 4.213 . 0 0 "[ . 1 . 2 . 3 ]" 1
436 1 60 LYS QE 1 62 GLU H 3.350 . 5.500 4.624 4.500 4.993 . 0 0 "[ . 1 . 2 . 3 ]" 1
437 1 21 GLU QG 1 22 LYS H 3.350 . 5.500 4.020 3.856 4.403 . 0 0 "[ . 1 . 2 . 3 ]" 1
438 1 72 LYS QG 1 73 LYS H 3.350 . 5.500 3.547 3.453 3.622 . 0 0 "[ . 1 . 2 . 3 ]" 1
439 1 57 ILE H 1 57 ILE MD 3.600 . 4.500 3.429 3.188 3.586 . 0 0 "[ . 1 . 2 . 3 ]" 1
440 1 1 GLY HA2 1 2 ASP H 2.850 . 4.000 2.620 2.155 3.498 . 0 0 "[ . 1 . 2 . 3 ]" 1
441 1 51 ALA MB 1 53 LYS H 3.600 . 6.000 4.278 4.051 4.364 . 0 0 "[ . 1 . 2 . 3 ]" 1
442 1 55 LYS HA 1 56 GLY H 3.350 . 5.500 2.528 2.520 2.535 . 0 0 "[ . 1 . 2 . 3 ]" 1
443 1 3 VAL H 1 3 VAL HA 2.850 . 4.000 2.747 2.730 2.799 . 0 0 "[ . 1 . 2 . 3 ]" 1
444 1 3 VAL H 1 5 LYS H 3.350 . 5.500 4.899 4.804 4.928 . 0 0 "[ . 1 . 2 . 3 ]" 1
445 1 55 LYS QB 1 57 ILE H 3.350 . 5.500 4.922 4.876 4.986 . 0 0 "[ . 1 . 2 . 3 ]" 1
446 1 8 LYS H 1 8 LYS QD 3.350 . 5.500 4.260 4.192 4.331 . 0 0 "[ . 1 . 2 . 3 ]" 1
447 1 92 GLU HA 1 93 ASP H 3.350 . 5.500 3.578 3.573 3.586 . 0 0 "[ . 1 . 2 . 3 ]" 1
448 1 19 THR HB 1 25 LYS H 3.350 . 5.500 3.665 3.219 5.247 . 0 0 "[ . 1 . 2 . 3 ]" 1
449 1 6 GLY HA2 1 94 LEU H 2.850 . 4.000 3.508 3.270 3.729 . 0 0 "[ . 1 . 2 . 3 ]" 1
450 1 72 LYS QE 1 80 MET H 3.350 . 5.500 3.212 2.861 3.622 . 0 0 "[ . 1 . 2 . 3 ]" 1
451 1 75 ILE H 1 76 PRO QD 3.350 . 4.000 2.971 2.881 3.096 . 0 0 "[ . 1 . 2 . 3 ]" 1
452 1 36 PHE H 1 36 PHE HB2 2.350 . 3.000 2.721 2.680 2.960 . 0 0 "[ . 1 . 2 . 3 ]" 1
453 1 6 GLY H 1 6 GLY HA3 2.350 . 3.000 2.315 2.311 2.330 . 0 0 "[ . 1 . 2 . 3 ]" 1
454 1 8 LYS H 1 8 LYS QG 3.350 . 5.500 3.969 2.503 4.023 . 0 0 "[ . 1 . 2 . 3 ]" 1
455 1 99 LYS H 1 99 LYS QD 3.350 . 5.500 4.248 3.493 4.697 . 0 0 "[ . 1 . 2 . 3 ]" 1
456 1 97 TYR H 1 97 TYR HB2 2.350 . 3.000 2.798 2.704 2.865 . 0 0 "[ . 1 . 2 . 3 ]" 1
457 1 52 ASN H 1 78 THR HA 3.350 . 5.500 4.199 3.883 4.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
458 1 13 LYS H 1 15 ALA MB 3.600 . 6.000 4.207 4.131 4.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
459 1 59 TRP H 1 59 TRP HA 2.850 . 4.000 2.830 2.823 2.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
460 1 59 TRP HB3 1 59 TRP HE1 3.350 . 5.500 4.972 4.943 5.161 . 0 0 "[ . 1 . 2 . 3 ]" 1
461 1 92 GLU HA 1 95 ILE H 3.350 . 5.500 3.512 3.426 3.562 . 0 0 "[ . 1 . 2 . 3 ]" 1
462 1 4 GLU H 1 4 GLU QG 2.600 . 3.500 2.281 1.957 2.771 . 0 0 "[ . 1 . 2 . 3 ]" 1
463 1 32 LEU H 1 33 HIS H 2.350 . 3.000 2.895 2.680 3.168 0.168 17 0 "[ . 1 . 2 . 3 ]" 1
464 1 62 GLU H 1 62 GLU HA 2.350 . 3.000 2.848 2.842 2.856 . 0 0 "[ . 1 . 2 . 3 ]" 1
465 1 9 ILE H 1 9 ILE HB 2.600 . 3.500 2.482 2.388 2.519 . 0 0 "[ . 1 . 2 . 3 ]" 1
466 1 42 GLN HA 1 43 ALA H 2.850 . 4.000 3.422 3.233 3.456 . 0 0 "[ . 1 . 2 . 3 ]" 1
467 1 65 MET HA 1 66 GLU H 2.850 . 4.000 3.576 3.571 3.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
468 1 50 ASP HA 1 53 LYS H 2.850 . 4.000 3.158 3.017 3.337 . 0 0 "[ . 1 . 2 . 3 ]" 1
469 1 34 GLY H 1 102 THR HA 3.350 . 5.500 4.240 3.668 4.399 . 0 0 "[ . 1 . 2 . 3 ]" 1
470 1 100 LYS H 1 100 LYS HA 2.350 . 3.000 2.870 2.853 2.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
471 1 103 ASN H 1 103 ASN HB3 2.850 . 4.000 3.562 3.512 3.606 . 0 0 "[ . 1 . 2 . 3 ]" 1
472 1 72 LYS H 1 72 LYS QD 3.350 . 5.500 4.517 4.290 4.707 . 0 0 "[ . 1 . 2 . 3 ]" 1
473 1 75 ILE H 1 75 ILE MD 3.100 . 4.500 3.785 3.677 4.000 . 0 0 "[ . 1 . 2 . 3 ]" 1
474 1 4 GLU H 1 4 GLU QB 2.600 . 3.500 2.402 2.283 2.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
475 1 103 ASN H 1 103 ASN HD22 3.350 . 5.500 4.123 3.961 4.406 . 0 0 "[ . 1 . 2 . 3 ]" 1
476 1 40 THR HA 1 42 GLN H 3.350 . 5.500 3.914 3.855 4.082 . 0 0 "[ . 1 . 2 . 3 ]" 1
477 1 14 CYS H 1 14 CYS HA 2.850 . 3.000 2.892 2.883 2.904 . 0 0 "[ . 1 . 2 . 3 ]" 1
478 1 68 LEU H 1 69 GLU QB 3.350 . 5.500 4.351 4.088 4.886 . 0 0 "[ . 1 . 2 . 3 ]" 1
479 1 36 PHE HA 1 38 ARG H 2.850 . 4.000 4.069 3.862 4.114 0.114 7 0 "[ . 1 . 2 . 3 ]" 1
480 1 95 ILE HA 1 98 LEU H 3.350 . 4.000 3.095 3.031 3.206 . 0 0 "[ . 1 . 2 . 3 ]" 1
481 1 70 ASN QB 1 70 ASN HD22 3.350 . 5.500 3.417 3.330 3.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
482 1 61 GLU HA 1 64 LEU H 3.350 . 5.500 3.894 3.823 3.983 . 0 0 "[ . 1 . 2 . 3 ]" 1
483 1 53 LYS H 1 55 LYS H 2.850 . 4.000 4.139 4.100 4.188 0.188 29 0 "[ . 1 . 2 . 3 ]" 1
484 1 37 GLY H 1 58 THR MG 3.600 . 4.500 2.913 2.755 3.152 . 0 0 "[ . 1 . 2 . 3 ]" 1
485 1 39 LYS QG 1 40 THR H 3.350 . 5.500 3.466 1.792 4.004 . 0 0 "[ . 1 . 2 . 3 ]" 1
486 1 59 TRP H 1 59 TRP HB2 2.350 . 3.000 2.724 2.456 2.779 . 0 0 "[ . 1 . 2 . 3 ]" 1
487 1 96 ALA HA 1 99 LYS H 2.850 . 4.000 3.700 3.535 3.837 . 0 0 "[ . 1 . 2 . 3 ]" 1
488 1 65 MET H 1 95 ILE MG 3.600 . 6.000 4.665 4.468 4.759 . 0 0 "[ . 1 . 2 . 3 ]" 1
489 1 11 VAL HB 1 12 GLN H 2.850 . 4.000 3.814 3.782 3.855 . 0 0 "[ . 1 . 2 . 3 ]" 1
490 1 54 ASN HD21 1 55 LYS H 2.850 . 4.000 1.623 1.607 1.635 0.093 26 0 "[ . 1 . 2 . 3 ]" 1
491 1 39 LYS H 1 39 LYS QG 3.350 . 5.000 3.114 2.590 4.038 . 0 0 "[ . 1 . 2 . 3 ]" 1
492 1 2 ASP H 1 2 ASP HB3 2.850 . 4.000 3.774 3.606 3.938 . 0 0 "[ . 1 . 2 . 3 ]" 1
493 1 79 LYS H 1 80 MET H 3.350 . 5.500 4.102 4.055 4.149 . 0 0 "[ . 1 . 2 . 3 ]" 1
494 1 81 ILE H 1 81 ILE HB 2.850 . 4.000 2.628 2.388 2.778 . 0 0 "[ . 1 . 2 . 3 ]" 1
495 1 34 GLY H 1 34 GLY HA3 2.350 . 3.000 2.691 2.648 2.743 . 0 0 "[ . 1 . 2 . 3 ]" 1
496 1 31 ASN H 1 31 ASN HB2 2.850 . 4.000 3.513 2.413 3.694 . 0 0 "[ . 1 . 2 . 3 ]" 1
497 1 8 LYS HA 1 10 PHE H 2.850 . 4.000 4.041 3.997 4.094 0.094 22 0 "[ . 1 . 2 . 3 ]" 1
498 1 54 ASN HB2 1 54 ASN HD21 3.350 . 5.500 3.581 3.576 3.587 . 0 0 "[ . 1 . 2 . 3 ]" 1
499 1 80 MET HA 1 81 ILE H 2.850 . 4.000 2.215 2.182 2.225 . 0 0 "[ . 1 . 2 . 3 ]" 1
500 1 89 THR MG 1 93 ASP H 3.600 . 6.000 4.791 4.721 4.847 . 0 0 "[ . 1 . 2 . 3 ]" 1
501 1 63 THR H 1 63 THR HA 2.350 . 3.000 2.784 2.742 2.817 . 0 0 "[ . 1 . 2 . 3 ]" 1
502 1 22 LYS QG 1 23 GLY H 3.350 . 5.500 2.681 1.971 4.199 . 0 0 "[ . 1 . 2 . 3 ]" 1
503 1 74 TYR H 1 74 TYR HA 2.600 . 3.500 2.851 2.828 2.915 . 0 0 "[ . 1 . 2 . 3 ]" 1
504 1 85 ILE HA 1 86 LYS H 2.850 . 4.000 2.376 2.341 2.427 . 0 0 "[ . 1 . 2 . 3 ]" 1
505 1 97 TYR H 1 97 TYR HA 2.350 . 3.000 2.878 2.869 2.888 . 0 0 "[ . 1 . 2 . 3 ]" 1
506 1 67 TYR HA 1 69 GLU H 2.850 . 4.000 3.988 3.649 4.128 0.128 21 0 "[ . 1 . 2 . 3 ]" 1
507 1 22 LYS HA 1 23 GLY H 2.850 . 4.000 2.199 2.141 2.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
508 1 16 GLN HB3 1 18 HIS H 3.350 . 5.500 5.436 5.120 5.552 0.052 19 0 "[ . 1 . 2 . 3 ]" 1
509 1 20 VAL H 1 20 VAL MG2 3.600 . 4.000 3.251 3.203 3.304 . 0 0 "[ . 1 . 2 . 3 ]" 1
510 1 49 THR H 1 49 THR MG 3.100 . 4.500 2.243 2.030 2.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
511 1 98 LEU H 1 100 LYS H 3.350 . 5.500 4.555 4.380 4.748 . 0 0 "[ . 1 . 2 . 3 ]" 1
512 1 89 THR H 1 89 THR MG 3.100 . 3.500 2.098 1.964 2.264 . 0 0 "[ . 1 . 2 . 3 ]" 1
513 1 40 THR H 1 75 ILE MD 3.600 . 6.000 5.012 4.915 5.095 . 0 0 "[ . 1 . 2 . 3 ]" 1
514 1 6 GLY H 1 8 LYS H 3.350 . 5.500 3.985 3.921 4.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
515 1 10 PHE H 1 10 PHE HB2 2.350 . 3.000 2.999 2.952 3.022 0.022 3 0 "[ . 1 . 2 . 3 ]" 1
516 1 101 ALA HA 1 104 GLU H 3.350 . 5.500 3.594 3.315 3.777 . 0 0 "[ . 1 . 2 . 3 ]" 1
517 1 49 THR H 1 52 ASN H 3.350 . 5.500 3.837 3.642 4.033 . 0 0 "[ . 1 . 2 . 3 ]" 1
518 1 103 ASN HB3 1 103 ASN HD22 2.850 . 4.000 4.063 4.055 4.070 0.070 1 0 "[ . 1 . 2 . 3 ]" 1
519 1 24 GLY HA3 1 25 LYS H 2.350 . 3.000 2.230 2.156 3.312 0.312 29 0 "[ . 1 . 2 . 3 ]" 1
520 1 62 GLU QG 1 63 THR H 3.350 . 5.500 3.575 1.858 4.238 . 0 0 "[ . 1 . 2 . 3 ]" 1
521 1 91 ARG HA 1 94 LEU H 3.350 . 4.000 3.653 3.455 3.727 . 0 0 "[ . 1 . 2 . 3 ]" 1
522 1 11 VAL HA 1 15 ALA H 2.850 . 4.000 3.460 3.415 3.535 . 0 0 "[ . 1 . 2 . 3 ]" 1
523 1 64 LEU QB 1 68 LEU H 3.350 . 5.500 4.562 4.508 4.618 . 0 0 "[ . 1 . 2 . 3 ]" 1
524 1 16 GLN HE22 1 16 GLN QG 3.350 . 5.500 3.373 3.269 3.530 . 0 0 "[ . 1 . 2 . 3 ]" 1
525 1 85 ILE MD 1 86 LYS H 3.600 . 6.000 3.260 3.097 4.419 . 0 0 "[ . 1 . 2 . 3 ]" 1
526 1 60 LYS QB 1 61 GLU H 2.850 . 4.000 1.806 1.767 1.901 . 0 0 "[ . 1 . 2 . 3 ]" 1
527 1 58 THR HA 1 59 TRP H 2.350 . 3.000 2.201 2.189 2.211 . 0 0 "[ . 1 . 2 . 3 ]" 1
528 1 51 ALA HA 1 52 ASN H 2.850 . 4.000 3.546 3.525 3.575 . 0 0 "[ . 1 . 2 . 3 ]" 1
529 1 9 ILE H 1 9 ILE MD 3.600 . 4.500 3.297 3.234 3.472 . 0 0 "[ . 1 . 2 . 3 ]" 1
530 1 92 GLU QG 1 93 ASP H 3.350 . 5.500 3.692 3.430 4.262 . 0 0 "[ . 1 . 2 . 3 ]" 1
531 1 32 LEU H 1 32 LEU MD1 3.600 . 6.000 3.930 3.669 4.131 . 0 0 "[ . 1 . 2 . 3 ]" 1
532 1 25 LYS QB 1 26 HIS H 2.850 . 4.000 3.412 2.918 3.637 . 0 0 "[ . 1 . 2 . 3 ]" 1
533 1 67 TYR HB3 1 68 LEU H 3.350 . 5.500 2.938 2.829 3.053 . 0 0 "[ . 1 . 2 . 3 ]" 1
534 1 99 LYS H 1 99 LYS HA 2.850 . 4.000 2.870 2.787 2.894 . 0 0 "[ . 1 . 2 . 3 ]" 1
535 1 12 GLN HA 1 13 LYS H 3.350 . 4.000 3.506 3.486 3.522 . 0 0 "[ . 1 . 2 . 3 ]" 1
536 1 56 GLY QA 1 57 ILE H 3.350 . 5.500 2.721 2.653 2.797 . 0 0 "[ . 1 . 2 . 3 ]" 1
537 1 102 THR H 1 103 ASN H 2.350 . 3.000 2.301 2.230 2.364 . 0 0 "[ . 1 . 2 . 3 ]" 1
538 1 91 ARG HA 1 93 ASP H 3.350 . 5.500 4.783 4.657 4.812 . 0 0 "[ . 1 . 2 . 3 ]" 1
539 1 24 GLY H 1 24 GLY HA3 2.350 . 3.000 2.357 2.327 2.410 . 0 0 "[ . 1 . 2 . 3 ]" 1
540 1 64 LEU H 1 64 LEU QD 3.600 . 6.000 3.560 3.511 3.600 . 0 0 "[ . 1 . 2 . 3 ]" 1
541 1 98 LEU H 1 98 LEU HA 2.850 . 4.000 2.784 2.733 2.813 . 0 0 "[ . 1 . 2 . 3 ]" 1
542 1 35 LEU H 1 36 PHE H 2.350 . 3.000 3.051 2.959 3.091 0.091 21 0 "[ . 1 . 2 . 3 ]" 1
543 1 98 LEU HA 1 102 THR H 3.350 . 4.000 3.838 3.778 3.917 . 0 0 "[ . 1 . 2 . 3 ]" 1
544 1 38 ARG QD 1 42 GLN H 3.350 . 5.500 4.691 4.569 4.923 . 0 0 "[ . 1 . 2 . 3 ]" 1
545 1 36 PHE H 1 37 GLY H 3.350 . 5.500 4.208 4.112 4.275 . 0 0 "[ . 1 . 2 . 3 ]" 1
546 1 70 ASN H 1 72 LYS H 3.350 . 5.500 5.091 4.904 5.319 . 0 0 "[ . 1 . 2 . 3 ]" 1
547 1 66 GLU H 1 95 ILE MD 3.600 . 6.000 4.771 4.705 4.809 . 0 0 "[ . 1 . 2 . 3 ]" 1
548 1 32 LEU H 1 32 LEU HG 2.850 . 4.000 2.404 1.980 2.723 . 0 0 "[ . 1 . 2 . 3 ]" 1
549 1 34 GLY H 1 34 GLY HA2 2.350 . 3.000 2.339 2.313 2.360 . 0 0 "[ . 1 . 2 . 3 ]" 1
550 1 40 THR H 1 40 THR HB 2.850 . 4.000 3.569 3.544 3.614 . 0 0 "[ . 1 . 2 . 3 ]" 1
551 1 70 ASN HD22 1 73 LYS HA 3.350 . 5.500 4.622 3.936 5.445 . 0 0 "[ . 1 . 2 . 3 ]" 1
552 1 58 THR H 1 59 TRP H 3.350 . 5.500 4.472 4.419 4.543 . 0 0 "[ . 1 . 2 . 3 ]" 1
553 1 81 ILE H 1 81 ILE MD 3.600 . 4.500 2.245 2.163 2.344 . 0 0 "[ . 1 . 2 . 3 ]" 1
554 1 15 ALA H 1 15 ALA HA 2.850 . 4.000 2.748 2.743 2.752 . 0 0 "[ . 1 . 2 . 3 ]" 1
555 1 101 ALA H 1 103 ASN H 2.850 . 4.000 3.590 3.483 3.803 . 0 0 "[ . 1 . 2 . 3 ]" 1
556 1 78 THR HA 1 79 LYS H 3.350 . 4.000 2.221 2.178 2.262 . 0 0 "[ . 1 . 2 . 3 ]" 1
557 1 9 ILE HA 1 12 GLN H 2.850 . 4.000 3.883 3.832 3.928 . 0 0 "[ . 1 . 2 . 3 ]" 1
558 1 63 THR HA 1 64 LEU H 2.850 . 4.000 3.518 3.509 3.525 . 0 0 "[ . 1 . 2 . 3 ]" 1
559 1 92 GLU HA 1 94 LEU H 3.350 . 5.500 4.703 4.585 4.808 . 0 0 "[ . 1 . 2 . 3 ]" 1
560 1 5 LYS H 1 5 LYS HA 2.600 . 3.000 2.867 2.860 2.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
561 1 91 ARG H 1 91 ARG QD 3.350 . 5.500 4.114 3.779 4.348 . 0 0 "[ . 1 . 2 . 3 ]" 1
562 1 54 ASN H 1 54 ASN HB2 2.850 . 4.000 3.506 3.478 3.534 . 0 0 "[ . 1 . 2 . 3 ]" 1
563 1 93 ASP H 1 94 LEU H 2.350 . 3.000 2.767 2.725 2.810 . 0 0 "[ . 1 . 2 . 3 ]" 1
564 1 70 ASN H 1 85 ILE H 2.850 . 4.000 4.594 4.525 4.660 0.660 12 32 [****-******+********************] 1
565 1 7 LYS H 1 97 TYR HD1 3.350 . 5.500 4.024 3.687 4.346 . 0 0 "[ . 1 . 2 . 3 ]" 1
566 1 3 VAL MG2 1 7 LYS H 3.600 . 5.200 4.002 3.879 4.088 . 0 0 "[ . 1 . 2 . 3 ]" 1
567 1 49 THR H 1 78 THR HA 3.350 . 4.000 3.911 3.673 4.021 0.021 15 0 "[ . 1 . 2 . 3 ]" 1
568 1 32 LEU HA 1 35 LEU H 3.350 . 5.500 4.320 4.141 4.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
569 1 19 THR MG 1 20 VAL H 3.600 . 6.000 4.110 3.915 4.207 . 0 0 "[ . 1 . 2 . 3 ]" 1
570 1 7 LYS H 1 8 LYS H 2.850 . 3.000 2.570 2.544 2.598 . 0 0 "[ . 1 . 2 . 3 ]" 1
571 1 25 LYS H 1 25 LYS QD 3.350 . 5.500 3.744 2.086 4.687 . 0 0 "[ . 1 . 2 . 3 ]" 1
572 1 64 LEU HA 1 67 TYR H 2.600 . 3.500 3.404 3.244 3.508 0.008 8 0 "[ . 1 . 2 . 3 ]" 1
573 1 26 HIS H 1 26 HIS HB2 3.350 . 5.500 3.475 2.862 3.587 . 0 0 "[ . 1 . 2 . 3 ]" 1
574 1 55 LYS QB 1 56 GLY H 3.350 . 5.500 3.915 3.909 3.934 . 0 0 "[ . 1 . 2 . 3 ]" 1
575 1 95 ILE H 1 96 ALA MB 3.350 . 5.500 4.131 4.102 4.169 . 0 0 "[ . 1 . 2 . 3 ]" 1
576 1 10 PHE HA 1 14 CYS H 2.850 . 4.000 2.453 2.395 2.542 . 0 0 "[ . 1 . 2 . 3 ]" 1
577 1 38 ARG HA 1 39 LYS H 2.600 . 3.500 2.259 2.199 2.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
578 1 104 GLU H 1 104 GLU QG 2.850 . 4.000 2.337 1.964 2.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
579 1 6 GLY H 1 97 TYR HB3 3.350 . 5.500 5.079 4.882 5.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
580 1 6 GLY H 1 93 ASP QB 2.850 . 4.000 3.015 2.859 3.221 . 0 0 "[ . 1 . 2 . 3 ]" 1
581 1 3 VAL H 1 3 VAL HB 2.350 . 3.000 2.551 2.433 2.706 . 0 0 "[ . 1 . 2 . 3 ]" 1
582 1 7 LYS H 1 9 ILE H 3.350 . 5.500 4.200 3.886 4.316 . 0 0 "[ . 1 . 2 . 3 ]" 1
583 1 22 LYS H 1 22 LYS QB 2.850 . 4.000 2.222 2.058 2.531 . 0 0 "[ . 1 . 2 . 3 ]" 1
584 1 104 GLU H 1 104 GLU QB 2.850 . 4.000 2.938 2.283 3.295 . 0 0 "[ . 1 . 2 . 3 ]" 1
585 1 2 ASP H 1 5 LYS QB 3.350 . 5.500 4.601 4.355 4.781 . 0 0 "[ . 1 . 2 . 3 ]" 1
586 1 39 LYS HA 1 59 TRP H 2.850 . 4.000 3.295 3.019 3.417 . 0 0 "[ . 1 . 2 . 3 ]" 1
587 1 60 LYS H 1 64 LEU H 3.350 . 5.500 3.203 3.158 3.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
588 1 96 ALA H 1 96 ALA HA 2.350 . 3.000 2.835 2.815 2.847 . 0 0 "[ . 1 . 2 . 3 ]" 1
589 1 67 TYR HB3 1 69 GLU H 3.350 . 5.500 5.024 4.906 5.133 . 0 0 "[ . 1 . 2 . 3 ]" 1
590 1 12 GLN HE21 1 12 GLN HG3 2.850 . 4.000 3.341 3.200 3.602 . 0 0 "[ . 1 . 2 . 3 ]" 1
591 1 41 GLY HA2 1 42 GLN H 3.350 . 4.000 2.685 2.671 2.718 . 0 0 "[ . 1 . 2 . 3 ]" 1
592 1 31 ASN H 1 31 ASN HA 2.850 . 4.000 2.934 2.885 2.952 . 0 0 "[ . 1 . 2 . 3 ]" 1
593 1 86 LYS H 1 87 LYS H 2.350 . 3.000 2.623 2.321 2.754 . 0 0 "[ . 1 . 2 . 3 ]" 1
594 1 89 THR HB 1 93 ASP H 2.850 . 4.000 4.208 4.137 4.265 0.265 3 0 "[ . 1 . 2 . 3 ]" 1
595 1 73 LYS HA 1 74 TYR H 3.350 . 5.500 3.491 3.382 3.535 . 0 0 "[ . 1 . 2 . 3 ]" 1
596 1 70 ASN H 1 70 ASN HB2 2.850 . 4.000 3.542 3.099 4.056 0.056 31 0 "[ . 1 . 2 . 3 ]" 1
597 1 27 LYS H 1 27 LYS HA 2.850 . 4.000 2.959 2.942 2.967 . 0 0 "[ . 1 . 2 . 3 ]" 1
598 1 95 ILE H 1 96 ALA H 2.850 . 4.000 2.437 2.415 2.469 . 0 0 "[ . 1 . 2 . 3 ]" 1
599 1 72 LYS QE 1 81 ILE H 3.350 . 5.500 5.009 4.925 5.096 . 0 0 "[ . 1 . 2 . 3 ]" 1
600 1 68 LEU QB 1 70 ASN H 3.350 . 5.500 4.590 4.465 4.788 . 0 0 "[ . 1 . 2 . 3 ]" 1
601 1 68 LEU QB 1 69 GLU H 3.350 . 5.500 3.055 2.913 3.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
602 1 34 GLY HA2 1 35 LEU H 2.350 . 3.000 2.911 2.755 2.961 . 0 0 "[ . 1 . 2 . 3 ]" 1
603 1 36 PHE H 1 38 ARG H 3.350 . 5.500 4.783 4.494 4.898 . 0 0 "[ . 1 . 2 . 3 ]" 1
604 1 36 PHE QD 1 61 GLU H 3.350 . 5.500 3.371 3.048 3.668 . 0 0 "[ . 1 . 2 . 3 ]" 1
605 1 87 LYS H 1 90 GLU H 3.350 . 5.500 4.334 4.190 4.444 . 0 0 "[ . 1 . 2 . 3 ]" 1
606 1 49 THR HA 1 50 ASP H 2.600 . 3.500 2.336 2.280 2.485 . 0 0 "[ . 1 . 2 . 3 ]" 1
607 1 96 ALA H 1 96 ALA MB 3.100 . 3.500 2.222 2.184 2.238 . 0 0 "[ . 1 . 2 . 3 ]" 1
608 1 91 ARG H 1 91 ARG HA 2.850 . 4.000 2.882 2.869 2.891 . 0 0 "[ . 1 . 2 . 3 ]" 1
609 1 54 ASN H 1 54 ASN HA 2.350 . 3.000 2.833 2.823 2.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
610 1 19 THR H 1 19 THR HB 3.350 . 5.500 3.287 3.010 3.483 . 0 0 "[ . 1 . 2 . 3 ]" 1
611 1 63 THR H 1 66 GLU H 3.350 . 5.500 5.181 5.112 5.235 . 0 0 "[ . 1 . 2 . 3 ]" 1
612 1 12 GLN HE22 1 12 GLN HG3 2.850 . 4.000 3.976 3.910 4.100 0.100 17 0 "[ . 1 . 2 . 3 ]" 1
613 1 13 LYS H 1 15 ALA H 2.850 . 4.000 3.718 3.679 3.783 . 0 0 "[ . 1 . 2 . 3 ]" 1
614 1 5 LYS H 1 5 LYS QB 3.350 . 5.500 2.261 2.121 2.385 . 0 0 "[ . 1 . 2 . 3 ]" 1
615 1 20 VAL H 1 32 LEU HB2 3.350 . 5.500 4.181 3.948 4.403 . 0 0 "[ . 1 . 2 . 3 ]" 1
616 1 76 PRO HA 1 77 GLY H 2.350 . 3.000 2.201 2.159 2.349 . 0 0 "[ . 1 . 2 . 3 ]" 1
617 1 74 TYR H 1 76 PRO HD2 3.350 . 5.500 5.496 5.382 5.541 0.041 12 0 "[ . 1 . 2 . 3 ]" 1
618 1 49 THR H 1 53 LYS H 3.350 . 5.500 4.573 4.452 4.703 . 0 0 "[ . 1 . 2 . 3 ]" 1
619 1 66 GLU HB2 1 67 TYR H 3.350 . 5.500 2.875 2.781 3.861 . 0 0 "[ . 1 . 2 . 3 ]" 1
620 1 62 GLU QB 1 63 THR H 2.850 . 4.000 2.666 2.328 3.485 . 0 0 "[ . 1 . 2 . 3 ]" 1
621 1 35 LEU MD1 1 36 PHE H 3.600 . 6.000 4.440 4.403 4.529 . 0 0 "[ . 1 . 2 . 3 ]" 1
622 1 8 LYS H 1 8 LYS QE 3.350 . 5.500 4.536 4.316 4.854 . 0 0 "[ . 1 . 2 . 3 ]" 1
623 1 31 ASN H 1 46 PHE HB2 3.350 . 5.500 5.125 4.583 5.527 0.027 31 0 "[ . 1 . 2 . 3 ]" 1
624 1 68 LEU H 1 68 LEU HG 2.850 . 4.000 3.002 2.713 3.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
625 1 22 LYS H 1 104 GLU H 3.350 . 5.500 4.497 4.120 5.037 . 0 0 "[ . 1 . 2 . 3 ]" 1
626 1 57 ILE MG 1 58 THR H 3.100 . 4.500 3.703 3.610 3.789 . 0 0 "[ . 1 . 2 . 3 ]" 1
627 1 57 ILE H 1 57 ILE HA 2.850 . 4.000 2.937 2.924 2.949 . 0 0 "[ . 1 . 2 . 3 ]" 1
628 1 74 TYR H 1 74 TYR HB2 2.350 . 3.000 2.245 2.185 2.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
629 1 39 LYS HA 1 40 THR H 2.600 . 3.500 2.415 2.180 2.590 . 0 0 "[ . 1 . 2 . 3 ]" 1
630 1 15 ALA MB 1 18 HIS H 3.600 . 6.000 4.632 4.582 4.667 . 0 0 "[ . 1 . 2 . 3 ]" 1
631 1 42 GLN H 1 43 ALA HA 3.350 . 5.500 4.610 4.326 4.745 . 0 0 "[ . 1 . 2 . 3 ]" 1
632 1 47 THR H 1 47 THR HB 2.850 . 3.000 2.610 2.447 2.973 . 0 0 "[ . 1 . 2 . 3 ]" 1
633 1 79 LYS HA 1 80 MET H 3.350 . 4.000 2.252 2.235 2.265 . 0 0 "[ . 1 . 2 . 3 ]" 1
634 1 50 ASP H 1 50 ASP QB 2.850 . 4.000 2.566 2.251 2.789 . 0 0 "[ . 1 . 2 . 3 ]" 1
635 1 59 TRP HA 1 60 LYS H 2.350 . 3.000 2.180 2.160 2.213 . 0 0 "[ . 1 . 2 . 3 ]" 1
636 1 14 CYS HA 1 16 GLN H 3.350 . 5.500 3.628 3.596 3.658 . 0 0 "[ . 1 . 2 . 3 ]" 1
637 1 46 PHE HA 1 47 THR H 2.350 . 3.000 2.296 2.238 2.318 . 0 0 "[ . 1 . 2 . 3 ]" 1
638 1 61 GLU HA 1 62 GLU H 2.850 . 4.000 3.578 3.575 3.585 . 0 0 "[ . 1 . 2 . 3 ]" 1
639 1 89 THR H 1 89 THR HA 2.350 . 3.000 2.779 2.756 2.845 . 0 0 "[ . 1 . 2 . 3 ]" 1
640 1 42 GLN QB 1 42 GLN HE21 2.850 . 4.000 2.310 1.812 3.758 . 0 0 "[ . 1 . 2 . 3 ]" 1
641 1 31 ASN H 1 32 LEU H 3.350 . 5.500 4.521 4.403 4.613 . 0 0 "[ . 1 . 2 . 3 ]" 1
642 1 103 ASN HB3 1 104 GLU H 3.350 . 4.000 3.767 3.676 3.840 . 0 0 "[ . 1 . 2 . 3 ]" 1
643 1 19 THR HB 1 24 GLY H 3.350 . 5.500 4.991 4.343 5.318 . 0 0 "[ . 1 . 2 . 3 ]" 1
644 1 49 THR H 1 50 ASP H 3.350 . 5.500 4.610 4.585 4.621 . 0 0 "[ . 1 . 2 . 3 ]" 1
645 1 13 LYS QB 1 14 CYS H 3.350 . 5.500 2.129 2.059 2.231 . 0 0 "[ . 1 . 2 . 3 ]" 1
646 1 55 LYS H 1 55 LYS QB 2.850 . 4.000 3.335 3.160 3.450 . 0 0 "[ . 1 . 2 . 3 ]" 1
647 1 60 LYS H 1 60 LYS HA 2.850 . 4.000 2.902 2.894 2.914 . 0 0 "[ . 1 . 2 . 3 ]" 1
648 1 16 GLN H 1 16 GLN HB3 2.850 . 4.000 3.563 3.443 3.598 . 0 0 "[ . 1 . 2 . 3 ]" 1
649 1 19 THR H 1 31 ASN HA 3.350 . 5.500 3.495 3.309 3.862 . 0 0 "[ . 1 . 2 . 3 ]" 1
650 1 9 ILE H 1 11 VAL H 3.350 . 5.500 4.571 4.383 4.621 . 0 0 "[ . 1 . 2 . 3 ]" 1
651 1 74 TYR H 1 75 ILE H 3.350 . 5.500 2.750 2.544 2.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
652 1 49 THR HB 1 50 ASP H 2.350 . 3.000 2.642 2.303 2.795 . 0 0 "[ . 1 . 2 . 3 ]" 1
653 1 7 LYS QE 1 8 LYS H 3.350 . 5.500 3.908 3.077 5.031 . 0 0 "[ . 1 . 2 . 3 ]" 1
654 1 71 PRO HA 1 72 LYS H 3.350 . 5.500 3.544 3.497 3.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
655 1 38 ARG H 1 38 ARG QG 2.850 . 4.000 3.184 2.689 3.311 . 0 0 "[ . 1 . 2 . 3 ]" 1
656 1 38 ARG H 1 38 ARG QD 3.350 . 5.500 4.634 4.224 4.741 . 0 0 "[ . 1 . 2 . 3 ]" 1
657 1 68 LEU QD 1 95 ILE H 3.600 . 6.000 3.647 3.513 3.700 . 0 0 "[ . 1 . 2 . 3 ]" 1
658 1 77 GLY H 1 78 THR H 2.350 . 3.000 2.664 2.510 2.940 . 0 0 "[ . 1 . 2 . 3 ]" 1
659 1 11 VAL QG 1 12 GLN HE22 3.600 . 6.000 4.564 3.433 4.956 . 0 0 "[ . 1 . 2 . 3 ]" 1
660 1 35 LEU MD1 1 59 TRP HE1 3.600 . 6.000 4.050 2.954 4.244 . 0 0 "[ . 1 . 2 . 3 ]" 1
661 1 43 ALA MB 1 46 PHE H 3.600 . 6.000 4.012 3.367 4.328 . 0 0 "[ . 1 . 2 . 3 ]" 1
662 1 36 PHE HB3 1 37 GLY H 2.850 . 4.000 4.037 4.009 4.075 0.075 18 0 "[ . 1 . 2 . 3 ]" 1
663 1 73 LYS H 1 73 LYS HA 2.850 . 4.000 2.811 2.788 2.848 . 0 0 "[ . 1 . 2 . 3 ]" 1
664 1 57 ILE MD 1 59 TRP H 3.600 . 6.000 3.429 3.352 3.609 . 0 0 "[ . 1 . 2 . 3 ]" 1
665 1 10 PHE H 1 94 LEU QD 3.600 . 6.000 3.048 2.932 3.132 . 0 0 "[ . 1 . 2 . 3 ]" 1
666 1 97 TYR H 1 99 LYS H 3.350 . 5.500 3.840 3.724 4.179 . 0 0 "[ . 1 . 2 . 3 ]" 1
667 1 25 LYS H 1 25 LYS QB 2.850 . 4.000 3.186 2.707 3.298 . 0 0 "[ . 1 . 2 . 3 ]" 1
668 1 101 ALA HA 1 103 ASN H 2.850 . 4.000 3.775 3.594 3.960 . 0 0 "[ . 1 . 2 . 3 ]" 1
669 1 102 THR H 1 103 ASN HB3 3.350 . 5.500 5.660 5.597 5.691 0.191 15 0 "[ . 1 . 2 . 3 ]" 1
670 1 17 CYS H 1 17 CYS HB3 2.850 . 4.000 3.796 3.750 3.849 . 0 0 "[ . 1 . 2 . 3 ]" 1
671 1 59 TRP HB2 1 60 LYS H 2.850 . 4.000 3.899 3.835 4.033 0.033 10 0 "[ . 1 . 2 . 3 ]" 1
672 1 5 LYS H 1 5 LYS QD 3.350 . 5.500 3.853 1.907 4.293 . 0 0 "[ . 1 . 2 . 3 ]" 1
673 1 63 THR MG 1 64 LEU H 3.100 . 4.500 3.808 3.785 3.842 . 0 0 "[ . 1 . 2 . 3 ]" 1
674 1 40 THR MG 1 55 LYS H 3.600 . 6.000 4.780 4.682 5.034 . 0 0 "[ . 1 . 2 . 3 ]" 1
675 1 85 ILE MD 1 91 ARG H 3.600 . 6.000 3.964 3.061 4.117 . 0 0 "[ . 1 . 2 . 3 ]" 1
676 1 54 ASN HB3 1 55 LYS H 2.850 . 4.000 3.842 3.794 3.879 . 0 0 "[ . 1 . 2 . 3 ]" 1
677 1 10 PHE H 1 12 GLN H 3.350 . 5.500 3.858 3.824 3.915 . 0 0 "[ . 1 . 2 . 3 ]" 1
678 1 73 LYS H 1 74 TYR HA 3.350 . 5.500 5.267 5.152 5.345 . 0 0 "[ . 1 . 2 . 3 ]" 1
679 1 89 THR HB 1 90 GLU H 3.350 . 4.000 3.884 3.754 3.930 . 0 0 "[ . 1 . 2 . 3 ]" 1
680 1 34 GLY HA3 1 35 LEU H 2.850 . 4.000 3.485 3.458 3.551 . 0 0 "[ . 1 . 2 . 3 ]" 1
681 1 64 LEU H 1 65 MET HG3 2.850 . 4.000 4.077 4.039 4.111 0.111 9 0 "[ . 1 . 2 . 3 ]" 1
682 1 94 LEU H 1 94 LEU HA 2.350 . 3.000 2.798 2.779 2.816 . 0 0 "[ . 1 . 2 . 3 ]" 1
683 1 33 HIS H 1 35 LEU MD1 3.600 . 6.000 4.888 4.794 4.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
684 1 53 LYS HA 1 55 LYS H 2.850 . 4.000 3.421 3.369 3.537 . 0 0 "[ . 1 . 2 . 3 ]" 1
685 1 100 LYS H 1 100 LYS QE 3.350 . 5.500 4.560 3.914 4.968 . 0 0 "[ . 1 . 2 . 3 ]" 1
686 1 31 ASN H 1 31 ASN HB3 2.850 . 4.000 2.668 2.472 2.889 . 0 0 "[ . 1 . 2 . 3 ]" 1
687 1 36 PHE HA 1 37 GLY H 2.350 . 3.000 2.266 2.230 2.286 . 0 0 "[ . 1 . 2 . 3 ]" 1
688 1 86 LYS H 1 86 LYS QG 3.350 . 5.500 3.201 1.914 4.134 . 0 0 "[ . 1 . 2 . 3 ]" 1
689 1 96 ALA HA 1 97 TYR H 2.850 . 4.000 3.514 3.506 3.522 . 0 0 "[ . 1 . 2 . 3 ]" 1
690 1 40 THR HB 1 41 GLY H 2.850 . 4.000 2.943 2.842 3.301 . 0 0 "[ . 1 . 2 . 3 ]" 1
691 1 66 GLU H 1 66 GLU HB3 2.850 . 4.000 3.556 2.582 3.599 . 0 0 "[ . 1 . 2 . 3 ]" 1
692 1 6 GLY HA2 1 7 LYS H 2.850 . 4.000 3.502 3.469 3.514 . 0 0 "[ . 1 . 2 . 3 ]" 1
693 1 66 GLU H 1 66 GLU HG2 2.350 . 3.000 2.515 1.953 3.063 0.063 18 0 "[ . 1 . 2 . 3 ]" 1
694 1 101 ALA H 1 102 THR H 2.850 . 3.000 2.298 2.271 2.336 . 0 0 "[ . 1 . 2 . 3 ]" 1
695 1 102 THR MG 1 103 ASN H 3.600 . 6.000 4.104 4.026 4.180 . 0 0 "[ . 1 . 2 . 3 ]" 1
696 1 26 HIS HB3 1 46 PHE H 3.350 . 5.500 5.086 4.571 5.506 0.006 31 0 "[ . 1 . 2 . 3 ]" 1
697 1 9 ILE H 1 9 ILE HG12 2.850 . 4.000 3.510 3.412 3.763 . 0 0 "[ . 1 . 2 . 3 ]" 1
698 1 64 LEU HA 1 68 LEU H 2.850 . 4.000 4.011 3.946 4.098 0.098 10 0 "[ . 1 . 2 . 3 ]" 1
699 1 86 LYS H 1 86 LYS QB 2.850 . 4.000 2.401 2.239 2.873 . 0 0 "[ . 1 . 2 . 3 ]" 1
700 1 7 LYS H 1 7 LYS QB 2.350 . 3.000 2.251 2.241 2.264 . 0 0 "[ . 1 . 2 . 3 ]" 1
701 1 95 ILE H 1 95 ILE MD 3.600 . 4.500 3.264 3.162 3.545 . 0 0 "[ . 1 . 2 . 3 ]" 1
702 1 9 ILE H 1 10 PHE HB3 3.350 . 5.500 4.543 4.374 4.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
703 1 64 LEU H 1 64 LEU HA 2.850 . 4.000 2.846 2.836 2.856 . 0 0 "[ . 1 . 2 . 3 ]" 1
704 1 95 ILE HB 1 96 ALA H 2.850 . 4.000 3.009 2.936 3.063 . 0 0 "[ . 1 . 2 . 3 ]" 1
705 1 50 ASP H 1 51 ALA H 2.850 . 4.000 2.814 2.551 2.912 . 0 0 "[ . 1 . 2 . 3 ]" 1
706 1 4 GLU HA 1 6 GLY H 3.350 . 4.000 4.082 4.041 4.126 0.126 25 0 "[ . 1 . 2 . 3 ]" 1
707 1 19 THR HA 1 20 VAL H 2.850 . 4.000 3.527 3.512 3.539 . 0 0 "[ . 1 . 2 . 3 ]" 1
708 1 95 ILE H 1 95 ILE HB 2.350 . 3.000 2.276 2.247 2.321 . 0 0 "[ . 1 . 2 . 3 ]" 1
709 1 20 VAL H 1 20 VAL HB 2.850 . 4.000 3.935 3.909 3.949 . 0 0 "[ . 1 . 2 . 3 ]" 1
710 1 98 LEU H 1 98 LEU QB 2.350 . 3.000 2.279 2.234 2.330 . 0 0 "[ . 1 . 2 . 3 ]" 1
711 1 15 ALA H 1 16 GLN HG3 3.350 . 5.500 4.767 4.227 5.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
712 1 103 ASN H 1 103 ASN HD21 3.350 . 5.500 2.628 2.437 2.878 . 0 0 "[ . 1 . 2 . 3 ]" 1
713 1 81 ILE HB 1 82 PHE H 3.350 . 5.500 4.475 4.330 4.548 . 0 0 "[ . 1 . 2 . 3 ]" 1
714 1 41 GLY HA3 1 53 LYS H 3.350 . 5.500 3.870 3.709 4.206 . 0 0 "[ . 1 . 2 . 3 ]" 1
715 1 93 ASP H 1 95 ILE H 2.850 . 4.000 3.993 3.938 4.034 0.034 20 0 "[ . 1 . 2 . 3 ]" 1
716 1 68 LEU HA 1 69 GLU H 3.350 . 5.500 3.447 3.296 3.483 . 0 0 "[ . 1 . 2 . 3 ]" 1
717 1 39 LYS H 1 40 THR H 3.350 . 5.500 4.613 4.529 4.632 . 0 0 "[ . 1 . 2 . 3 ]" 1
718 1 57 ILE H 1 57 ILE HB 2.850 . 4.000 3.910 3.877 3.936 . 0 0 "[ . 1 . 2 . 3 ]" 1
719 1 64 LEU H 1 95 ILE MD 3.600 . 6.000 4.035 3.713 4.128 . 0 0 "[ . 1 . 2 . 3 ]" 1
720 1 26 HIS H 1 26 HIS HB3 2.850 . 4.000 2.948 2.588 3.533 . 0 0 "[ . 1 . 2 . 3 ]" 1
721 1 75 ILE MG 1 78 THR H 3.600 . 6.000 3.452 3.265 3.763 . 0 0 "[ . 1 . 2 . 3 ]" 1
722 1 58 THR H 1 58 THR MG 3.600 . 4.500 3.767 3.629 3.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
723 1 56 GLY HA3 1 57 ILE H 2.850 . 4.000 2.826 2.737 2.934 . 0 0 "[ . 1 . 2 . 3 ]" 1
724 1 34 GLY H 1 35 LEU QB 3.350 . 5.500 4.632 4.553 4.758 . 0 0 "[ . 1 . 2 . 3 ]" 1
725 1 103 ASN HB2 1 103 ASN HD22 2.850 . 4.000 3.835 3.820 3.849 . 0 0 "[ . 1 . 2 . 3 ]" 1
726 1 52 ASN QB 1 53 LYS H 2.850 . 4.000 2.943 2.909 2.990 . 0 0 "[ . 1 . 2 . 3 ]" 1
727 1 9 ILE HB 1 10 PHE H 2.350 . 3.000 3.003 2.939 3.030 0.030 25 0 "[ . 1 . 2 . 3 ]" 1
728 1 94 LEU QD 1 97 TYR H 3.600 . 6.000 4.161 4.071 4.228 . 0 0 "[ . 1 . 2 . 3 ]" 1
729 1 85 ILE H 1 86 LYS H 3.350 . 5.500 4.597 4.425 4.630 . 0 0 "[ . 1 . 2 . 3 ]" 1
730 1 25 LYS HA 1 26 HIS H 2.600 . 3.000 2.158 2.140 2.207 . 0 0 "[ . 1 . 2 . 3 ]" 1
731 1 87 LYS H 1 88 LYS H 3.350 . 5.500 4.607 4.584 4.621 . 0 0 "[ . 1 . 2 . 3 ]" 1
732 1 65 MET H 1 66 GLU H 2.850 . 4.000 2.901 2.868 2.932 . 0 0 "[ . 1 . 2 . 3 ]" 1
733 1 93 ASP H 1 94 LEU QB 3.350 . 5.500 4.461 4.420 4.490 . 0 0 "[ . 1 . 2 . 3 ]" 1
734 1 41 GLY HA2 1 49 THR H 3.350 . 5.500 5.350 5.217 5.477 . 0 0 "[ . 1 . 2 . 3 ]" 1
735 1 77 GLY H 1 77 GLY HA2 2.850 . 4.000 2.434 2.339 2.473 . 0 0 "[ . 1 . 2 . 3 ]" 1
736 1 69 GLU QG 1 70 ASN H 2.850 . 4.000 2.854 2.551 3.607 . 0 0 "[ . 1 . 2 . 3 ]" 1
737 1 8 LYS QD 1 9 ILE H 2.850 . 4.000 2.711 2.567 3.216 . 0 0 "[ . 1 . 2 . 3 ]" 1
738 1 12 GLN HE21 1 12 GLN HG2 3.350 . 4.000 3.253 2.805 3.426 . 0 0 "[ . 1 . 2 . 3 ]" 1
739 1 68 LEU H 1 68 LEU QD 3.600 . 6.000 3.452 3.327 3.547 . 0 0 "[ . 1 . 2 . 3 ]" 1
740 1 55 LYS H 1 75 ILE MG 3.600 . 6.000 5.041 4.928 5.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
741 1 25 LYS QG 1 26 HIS H 3.350 . 5.500 4.336 3.957 4.530 . 0 0 "[ . 1 . 2 . 3 ]" 1
742 1 38 ARG QD 1 39 LYS H 3.350 . 5.500 4.210 3.104 4.535 . 0 0 "[ . 1 . 2 . 3 ]" 1
743 1 3 VAL H 1 97 TYR HA 3.350 . 5.500 5.615 5.571 5.657 0.157 32 0 "[ . 1 . 2 . 3 ]" 1
744 1 14 CYS HA 1 15 ALA H 3.350 . 5.500 3.547 3.539 3.558 . 0 0 "[ . 1 . 2 . 3 ]" 1
745 1 36 PHE H 1 102 THR MG 3.600 . 6.000 4.748 4.552 4.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
746 1 87 LYS H 1 87 LYS QG 2.350 . 3.000 2.197 1.886 2.559 . 0 0 "[ . 1 . 2 . 3 ]" 1
747 1 46 PHE HE1 1 47 THR H 3.350 . 5.500 4.316 3.587 4.966 . 0 0 "[ . 1 . 2 . 3 ]" 1
748 1 10 PHE H 1 10 PHE HB3 2.850 . 4.000 2.220 2.200 2.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
749 1 12 GLN QB 1 13 LYS H 2.850 . 4.000 3.633 3.604 3.678 . 0 0 "[ . 1 . 2 . 3 ]" 1
750 1 72 LYS H 1 72 LYS HA 2.350 . 3.000 2.876 2.847 2.902 . 0 0 "[ . 1 . 2 . 3 ]" 1
751 1 74 TYR HA 1 75 ILE H 2.600 . 3.500 3.573 3.569 3.582 0.082 29 0 "[ . 1 . 2 . 3 ]" 1
752 1 65 MET ME 1 92 GLU H 3.600 . 6.000 2.989 2.868 3.096 . 0 0 "[ . 1 . 2 . 3 ]" 1
753 1 85 ILE H 1 85 ILE MG 3.100 . 4.500 3.732 3.592 3.769 . 0 0 "[ . 1 . 2 . 3 ]" 1
754 1 52 ASN H 1 53 LYS QB 3.350 . 5.500 4.063 4.014 4.225 . 0 0 "[ . 1 . 2 . 3 ]" 1
755 1 103 ASN H 1 103 ASN HA 2.600 . 3.000 2.937 2.902 2.960 . 0 0 "[ . 1 . 2 . 3 ]" 1
756 1 8 LYS H 1 11 VAL H 3.350 . 5.500 4.874 4.849 4.915 . 0 0 "[ . 1 . 2 . 3 ]" 1
757 1 22 LYS HA 1 24 GLY H 2.850 . 4.000 3.452 3.252 3.630 . 0 0 "[ . 1 . 2 . 3 ]" 1
758 1 12 GLN HG2 1 13 LYS H 3.350 . 5.500 2.484 2.401 2.643 . 0 0 "[ . 1 . 2 . 3 ]" 1
759 1 65 MET H 1 95 ILE MD 3.600 . 6.000 2.723 2.665 2.780 . 0 0 "[ . 1 . 2 . 3 ]" 1
760 1 43 ALA H 1 48 TYR HD2 3.350 . 5.500 4.313 3.711 5.593 0.093 28 0 "[ . 1 . 2 . 3 ]" 1
761 1 19 THR H 1 19 THR MG 3.600 . 4.500 3.843 3.706 3.964 . 0 0 "[ . 1 . 2 . 3 ]" 1
762 1 40 THR H 1 56 GLY H 3.350 . 5.500 4.399 4.257 4.805 . 0 0 "[ . 1 . 2 . 3 ]" 1
763 1 68 LEU H 1 68 LEU HA 2.850 . 4.000 2.883 2.869 2.898 . 0 0 "[ . 1 . 2 . 3 ]" 1
764 1 87 LYS H 1 87 LYS HA 2.350 . 3.000 2.900 2.881 2.927 . 0 0 "[ . 1 . 2 . 3 ]" 1
765 1 89 THR HA 1 90 GLU H 3.350 . 5.500 3.481 3.459 3.504 . 0 0 "[ . 1 . 2 . 3 ]" 1
766 1 9 ILE MG 1 12 GLN H 3.600 . 6.000 4.885 4.804 4.942 . 0 0 "[ . 1 . 2 . 3 ]" 1
767 1 57 ILE H 1 58 THR HA 3.350 . 5.500 4.748 4.691 4.792 . 0 0 "[ . 1 . 2 . 3 ]" 1
768 1 51 ALA H 1 51 ALA HA 2.350 . 3.000 2.791 2.763 2.848 . 0 0 "[ . 1 . 2 . 3 ]" 1
769 1 22 LYS QB 1 24 GLY H 3.350 . 5.500 4.844 4.485 5.008 . 0 0 "[ . 1 . 2 . 3 ]" 1
770 1 42 GLN H 1 52 ASN HD21 3.350 . 5.500 5.603 5.508 5.661 0.161 18 0 "[ . 1 . 2 . 3 ]" 1
771 1 100 LYS H 1 100 LYS QB 2.350 . 3.000 2.337 2.241 2.508 . 0 0 "[ . 1 . 2 . 3 ]" 1
772 1 67 TYR H 1 67 TYR HA 2.350 . 3.000 2.886 2.883 2.890 . 0 0 "[ . 1 . 2 . 3 ]" 1
773 1 4 GLU QG 1 5 LYS H 3.350 . 5.500 3.932 3.616 4.147 . 0 0 "[ . 1 . 2 . 3 ]" 1
774 1 104 GLU H 1 104 GLU HA 2.350 . 3.000 2.799 2.322 2.964 . 0 0 "[ . 1 . 2 . 3 ]" 1
775 1 69 GLU H 1 71 PRO HA 3.350 . 5.500 5.467 5.076 5.551 0.051 10 0 "[ . 1 . 2 . 3 ]" 1
776 1 42 GLN QG 1 43 ALA H 3.350 . 5.500 4.128 3.665 4.625 . 0 0 "[ . 1 . 2 . 3 ]" 1
777 1 6 GLY HA2 1 9 ILE H 3.350 . 5.500 3.614 3.538 3.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
778 1 6 GLY HA3 1 7 LYS H 2.350 . 3.000 2.857 2.824 2.916 . 0 0 "[ . 1 . 2 . 3 ]" 1
779 1 52 ASN HA 1 55 LYS H 2.850 . 4.000 4.058 3.988 4.106 0.106 10 0 "[ . 1 . 2 . 3 ]" 1
780 1 72 LYS H 1 74 TYR H 2.850 . 4.000 3.895 3.633 4.022 0.022 22 0 "[ . 1 . 2 . 3 ]" 1
781 1 46 PHE H 1 46 PHE QD 3.350 . 5.500 4.158 4.048 4.324 . 0 0 "[ . 1 . 2 . 3 ]" 1
782 1 37 GLY H 1 38 ARG H 2.350 . 3.000 2.304 2.168 2.406 . 0 0 "[ . 1 . 2 . 3 ]" 1
783 1 98 LEU H 1 98 LEU MD1 3.100 . 4.500 3.313 3.215 3.486 . 0 0 "[ . 1 . 2 . 3 ]" 1
784 1 26 HIS H 1 31 ASN H 3.350 . 5.500 5.422 5.020 5.549 0.049 19 0 "[ . 1 . 2 . 3 ]" 1
785 1 96 ALA MB 1 97 TYR H 3.100 . 4.500 2.617 2.567 2.663 . 0 0 "[ . 1 . 2 . 3 ]" 1
786 1 95 ILE HA 1 96 ALA H 2.850 . 4.000 3.476 3.464 3.496 . 0 0 "[ . 1 . 2 . 3 ]" 1
787 1 39 LYS QD 1 40 THR H 3.350 . 5.500 2.740 2.046 3.691 . 0 0 "[ . 1 . 2 . 3 ]" 1
788 1 65 MET H 1 65 MET ME 3.600 . 6.000 4.746 4.660 4.784 . 0 0 "[ . 1 . 2 . 3 ]" 1
789 1 86 LYS HA 1 87 LYS H 3.350 . 5.500 3.582 3.573 3.606 . 0 0 "[ . 1 . 2 . 3 ]" 1
790 1 97 TYR HA 1 98 LEU H 2.850 . 4.000 3.555 3.509 3.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
791 1 10 PHE HE2 1 15 ALA H 3.350 . 5.500 4.127 4.006 4.748 . 0 0 "[ . 1 . 2 . 3 ]" 1
792 1 62 GLU H 1 65 MET H 3.350 . 5.500 4.745 4.670 4.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
793 1 16 GLN H 1 18 HIS H 3.350 . 5.500 4.502 4.407 4.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
794 1 40 THR HB 1 55 LYS H 3.350 . 5.500 4.147 3.954 4.522 . 0 0 "[ . 1 . 2 . 3 ]" 1
795 1 73 LYS H 1 73 LYS QG 3.350 . 5.500 3.857 2.824 3.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
796 1 36 PHE H 1 36 PHE HD1 2.600 . 3.500 1.790 1.732 1.959 . 0 0 "[ . 1 . 2 . 3 ]" 1
797 1 22 LYS H 1 33 HIS HD2 3.350 . 5.500 3.699 3.169 4.324 . 0 0 "[ . 1 . 2 . 3 ]" 1
798 1 17 CYS HA 1 18 HIS H 2.850 . 4.000 2.728 2.669 2.788 . 0 0 "[ . 1 . 2 . 3 ]" 1
799 1 41 GLY H 1 53 LYS HA 3.350 . 5.500 5.138 4.929 5.487 . 0 0 "[ . 1 . 2 . 3 ]" 1
800 1 62 GLU HA 1 65 MET H 3.350 . 5.500 3.092 2.990 3.173 . 0 0 "[ . 1 . 2 . 3 ]" 1
801 1 90 GLU QB 1 91 ARG H 2.850 . 4.000 2.655 2.595 2.736 . 0 0 "[ . 1 . 2 . 3 ]" 1
802 1 54 ASN HB2 1 55 LYS H 2.850 . 4.000 4.237 4.215 4.260 0.260 15 0 "[ . 1 . 2 . 3 ]" 1
803 1 85 ILE HA 1 87 LYS H 2.850 . 4.000 4.948 4.578 5.035 1.035 12 32 [****-******+********************] 1
804 1 86 LYS QB 1 87 LYS H 2.600 . 3.500 2.068 1.935 2.467 . 0 0 "[ . 1 . 2 . 3 ]" 1
805 1 100 LYS H 1 100 LYS QG 3.350 . 5.500 2.894 2.060 3.971 . 0 0 "[ . 1 . 2 . 3 ]" 1
806 1 88 LYS HA 1 89 THR H 3.350 . 5.500 3.572 3.538 3.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
807 1 58 THR MG 1 60 LYS H 3.600 . 6.000 4.649 4.488 4.748 . 0 0 "[ . 1 . 2 . 3 ]" 1
808 1 102 THR H 1 102 THR MG 3.100 . 4.500 2.461 2.360 2.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
809 1 48 TYR HB3 1 53 LYS H 2.850 . 4.000 3.914 3.693 4.023 0.023 24 0 "[ . 1 . 2 . 3 ]" 1
810 1 90 GLU H 1 90 GLU QB 2.350 . 3.000 2.273 2.206 2.299 . 0 0 "[ . 1 . 2 . 3 ]" 1
811 1 101 ALA MB 1 102 THR H 3.600 . 4.500 2.741 2.662 2.912 . 0 0 "[ . 1 . 2 . 3 ]" 1
812 1 70 ASN HB2 1 72 LYS H 3.350 . 5.500 4.961 3.898 5.540 0.040 8 0 "[ . 1 . 2 . 3 ]" 1
813 1 18 HIS H 1 19 THR H 3.350 . 5.500 4.380 4.367 4.396 . 0 0 "[ . 1 . 2 . 3 ]" 1
814 1 72 LYS H 1 78 THR MG 3.600 . 6.000 4.166 4.036 4.555 . 0 0 "[ . 1 . 2 . 3 ]" 1
815 1 22 LYS H 1 22 LYS QG 3.350 . 5.500 3.719 2.190 4.081 . 0 0 "[ . 1 . 2 . 3 ]" 1
816 1 27 LYS H 1 29 GLY H 2.850 . 4.000 3.522 3.271 3.813 . 0 0 "[ . 1 . 2 . 3 ]" 1
817 1 61 GLU H 1 61 GLU HA 2.850 . 4.000 2.873 2.848 2.880 . 0 0 "[ . 1 . 2 . 3 ]" 1
818 1 88 LYS QB 1 90 GLU H 3.350 . 5.500 4.401 4.342 4.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
819 1 101 ALA H 1 101 ALA MB 3.100 . 3.500 2.279 2.260 2.291 . 0 0 "[ . 1 . 2 . 3 ]" 1
820 1 25 LYS H 1 25 LYS QG 2.850 . 4.000 2.347 1.871 3.326 . 0 0 "[ . 1 . 2 . 3 ]" 1
821 1 69 GLU H 1 69 GLU HA 2.850 . 4.000 2.934 2.907 2.961 . 0 0 "[ . 1 . 2 . 3 ]" 1
822 1 16 GLN H 1 16 GLN HA 2.850 . 3.000 2.742 2.729 2.752 . 0 0 "[ . 1 . 2 . 3 ]" 1
823 1 51 ALA MB 1 78 THR H 3.600 . 6.000 2.988 2.883 3.168 . 0 0 "[ . 1 . 2 . 3 ]" 1
824 1 20 VAL H 1 20 VAL MG1 3.600 . 4.500 2.394 2.265 2.474 . 0 0 "[ . 1 . 2 . 3 ]" 1
825 1 46 PHE H 1 46 PHE HA 2.350 . 3.000 2.874 2.854 2.964 . 0 0 "[ . 1 . 2 . 3 ]" 1
826 1 67 TYR QD 1 68 LEU H 3.350 . 5.500 3.436 3.146 3.851 . 0 0 "[ . 1 . 2 . 3 ]" 1
827 1 72 LYS H 1 72 LYS QE 3.350 . 5.500 4.242 3.967 4.646 . 0 0 "[ . 1 . 2 . 3 ]" 1
828 1 42 GLN H 1 48 TYR HB3 3.350 . 5.500 5.676 5.488 5.760 0.260 27 0 "[ . 1 . 2 . 3 ]" 1
829 1 59 TRP HB3 1 64 LEU H 3.350 . 5.500 5.592 5.460 5.632 0.132 18 0 "[ . 1 . 2 . 3 ]" 1
830 1 32 LEU MD2 1 33 HIS H 3.600 . 6.000 4.189 4.044 4.353 . 0 0 "[ . 1 . 2 . 3 ]" 1
831 1 14 CYS H 1 15 ALA HA 3.350 . 5.500 5.152 5.107 5.200 . 0 0 "[ . 1 . 2 . 3 ]" 1
832 1 54 ASN H 1 56 GLY H 3.350 . 5.500 4.796 4.712 4.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
833 1 89 THR MG 1 90 GLU H 3.600 . 5.500 4.009 3.953 4.058 . 0 0 "[ . 1 . 2 . 3 ]" 1
834 1 7 LYS HA 1 10 PHE H 2.850 . 4.000 3.372 3.305 3.408 . 0 0 "[ . 1 . 2 . 3 ]" 1
835 1 35 LEU H 1 102 THR MG 3.600 . 6.000 3.656 3.301 3.797 . 0 0 "[ . 1 . 2 . 3 ]" 1
836 1 73 LYS H 1 74 TYR H 2.350 . 3.000 2.692 2.615 2.762 . 0 0 "[ . 1 . 2 . 3 ]" 1
837 1 48 TYR H 1 48 TYR HB2 2.850 . 4.000 2.225 2.189 2.308 . 0 0 "[ . 1 . 2 . 3 ]" 1
838 1 2 ASP H 1 96 ALA H 3.350 . 5.500 5.054 4.782 5.425 . 0 0 "[ . 1 . 2 . 3 ]" 1
839 1 59 TRP HB2 1 59 TRP HE1 3.350 . 5.500 5.219 4.733 5.272 . 0 0 "[ . 1 . 2 . 3 ]" 1
840 1 49 THR MG 1 79 LYS H 3.600 . 4.500 2.371 2.091 2.575 . 0 0 "[ . 1 . 2 . 3 ]" 1
841 1 47 THR HA 1 48 TYR H 2.350 . 3.000 2.308 2.267 2.348 . 0 0 "[ . 1 . 2 . 3 ]" 1
842 1 77 GLY HA3 1 78 THR H 2.350 . 3.000 2.961 2.909 3.003 0.003 1 0 "[ . 1 . 2 . 3 ]" 1
843 1 40 THR H 1 40 THR MG 2.600 . 3.500 2.357 1.924 2.616 . 0 0 "[ . 1 . 2 . 3 ]" 1
844 1 82 PHE H 1 82 PHE HB2 2.850 . 4.000 3.178 2.897 3.487 . 0 0 "[ . 1 . 2 . 3 ]" 1
845 1 85 ILE MG 1 91 ARG H 3.600 . 6.000 2.715 2.488 2.776 . 0 0 "[ . 1 . 2 . 3 ]" 1
846 1 102 THR HA 1 103 ASN H 2.850 . 4.000 3.291 3.224 3.360 . 0 0 "[ . 1 . 2 . 3 ]" 1
847 1 24 GLY H 1 33 HIS HE2 2.350 . 3.000 2.947 2.461 3.079 0.079 22 0 "[ . 1 . 2 . 3 ]" 1
848 1 98 LEU HA 1 102 THR MG 3.100 . 4.500 2.967 2.850 3.184 . 0 0 "[ . 1 . 2 . 3 ]" 1
849 1 95 ILE HA 1 97 TYR H 2.850 . 4.000 4.025 3.958 4.103 0.103 12 0 "[ . 1 . 2 . 3 ]" 1
850 1 74 TYR HB2 1 75 ILE H 3.350 . 5.500 3.361 3.315 3.420 . 0 0 "[ . 1 . 2 . 3 ]" 1
851 1 13 LYS QB 1 13 LYS QE 3.350 . 5.500 2.545 2.109 3.758 . 0 0 "[ . 1 . 2 . 3 ]" 1
852 1 62 GLU HA 1 63 THR HA 3.350 . 5.500 4.853 4.814 4.901 . 0 0 "[ . 1 . 2 . 3 ]" 1
853 1 39 LYS QB 1 39 LYS QG 2.350 . 3.000 2.050 2.041 2.066 . 0 0 "[ . 1 . 2 . 3 ]" 1
854 1 71 PRO HA 1 74 TYR QD 3.350 . 5.500 4.981 4.675 5.204 . 0 0 "[ . 1 . 2 . 3 ]" 1
855 1 32 LEU HA 1 32 LEU HB2 2.850 . 4.000 3.018 3.005 3.025 . 0 0 "[ . 1 . 2 . 3 ]" 1
856 1 78 THR HA 1 78 THR MG . . 3.500 3.179 3.177 3.182 . 0 0 "[ . 1 . 2 . 3 ]" 1
857 1 85 ILE HB 1 86 LYS H 3.350 . 5.500 3.787 3.645 3.993 . 0 0 "[ . 1 . 2 . 3 ]" 1
858 1 91 ARG HA 1 94 LEU QB 2.350 . 3.000 2.422 2.239 2.474 . 0 0 "[ . 1 . 2 . 3 ]" 1
859 1 39 LYS HA 1 40 THR MG 3.600 . 6.000 3.836 3.675 3.993 . 0 0 "[ . 1 . 2 . 3 ]" 1
860 1 4 GLU HA 1 4 GLU QG 2.850 . 4.000 2.479 2.325 2.836 . 0 0 "[ . 1 . 2 . 3 ]" 1
861 1 10 PHE HD2 1 94 LEU QD 3.600 . 6.000 3.355 3.063 5.134 . 0 0 "[ . 1 . 2 . 3 ]" 1
862 1 64 LEU HA 1 64 LEU QD 3.100 . 4.500 2.153 2.114 2.190 . 0 0 "[ . 1 . 2 . 3 ]" 1
863 1 3 VAL HA 1 3 VAL HB 2.350 . 3.000 2.421 2.377 2.472 . 0 0 "[ . 1 . 2 . 3 ]" 1
864 1 20 VAL MG1 1 98 LEU MD2 3.350 . 5.500 1.987 1.957 2.056 . 0 0 "[ . 1 . 2 . 3 ]" 1
865 1 3 VAL MG2 1 100 LYS QD 2.850 . 4.000 2.245 2.112 2.488 . 0 0 "[ . 1 . 2 . 3 ]" 1
866 1 75 ILE H 1 78 THR HB 3.350 . 5.500 4.788 4.601 5.149 . 0 0 "[ . 1 . 2 . 3 ]" 1
867 1 85 ILE MD 1 85 ILE MG 3.350 . 4.000 1.802 1.746 1.826 . 0 0 "[ . 1 . 2 . 3 ]" 1
868 1 7 LYS QE 1 11 VAL QG 3.350 . 5.500 2.621 1.944 3.295 . 0 0 "[ . 1 . 2 . 3 ]" 1
869 1 65 MET QB 1 95 ILE MD 3.350 . 5.500 3.378 3.329 3.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
870 1 20 VAL HB 1 102 THR MG 2.600 . 3.500 2.191 2.125 2.303 . 0 0 "[ . 1 . 2 . 3 ]" 1
871 1 68 LEU QD 1 94 LEU QD 3.850 . 6.000 1.918 1.842 1.991 . 0 0 "[ . 1 . 2 . 3 ]" 1
872 1 21 GLU HA 1 21 GLU QG 2.850 . 4.000 3.288 3.277 3.305 . 0 0 "[ . 1 . 2 . 3 ]" 1
873 1 65 MET ME 1 88 LYS QG 2.350 . 3.000 2.204 2.119 2.283 . 0 0 "[ . 1 . 2 . 3 ]" 1
874 1 4 GLU HA 1 7 LYS QB 2.850 . 4.000 3.179 3.058 3.338 . 0 0 "[ . 1 . 2 . 3 ]" 1
875 1 10 PHE HA 1 10 PHE HB3 2.850 . 4.000 2.993 2.988 2.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
876 1 10 PHE HE1 1 15 ALA MB 3.600 . 6.000 2.706 2.536 4.214 . 0 0 "[ . 1 . 2 . 3 ]" 1
877 1 71 PRO HA 1 71 PRO HD3 3.350 . 5.500 3.549 3.435 3.671 . 0 0 "[ . 1 . 2 . 3 ]" 1
878 1 16 GLN H 1 16 GLN HG3 3.350 . 5.500 2.489 2.068 3.067 . 0 0 "[ . 1 . 2 . 3 ]" 1
879 1 72 LYS QG 1 73 LYS HA 2.850 . 4.000 3.637 3.466 3.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
880 1 39 LYS QB 1 58 THR HA 3.350 . 5.500 4.185 3.817 4.291 . 0 0 "[ . 1 . 2 . 3 ]" 1
881 1 92 GLU HA 1 95 ILE MG 3.100 . 4.500 3.748 3.723 3.790 . 0 0 "[ . 1 . 2 . 3 ]" 1
882 1 49 THR HB 1 51 ALA MB 3.100 . 4.500 3.496 3.394 3.603 . 0 0 "[ . 1 . 2 . 3 ]" 1
883 1 85 ILE MD 1 94 LEU QB 3.100 . 4.500 2.993 2.721 3.064 . 0 0 "[ . 1 . 2 . 3 ]" 1
884 1 7 LYS H 1 9 ILE HB 3.350 . 5.500 5.347 5.024 5.476 . 0 0 "[ . 1 . 2 . 3 ]" 1
885 1 57 ILE HB 1 57 ILE MD . . 3.500 2.112 2.085 2.158 . 0 0 "[ . 1 . 2 . 3 ]" 1
886 1 48 TYR HB3 1 49 THR MG 3.600 . 6.000 4.667 4.549 4.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
887 1 81 ILE HA 1 81 ILE MD 3.100 . 4.500 3.122 2.632 3.389 . 0 0 "[ . 1 . 2 . 3 ]" 1
888 1 25 LYS QD 1 25 LYS QE 2.350 . 3.000 2.075 2.006 2.109 . 0 0 "[ . 1 . 2 . 3 ]" 1
889 1 21 GLU H 1 21 GLU QB 3.350 . 5.500 2.919 2.681 3.152 . 0 0 "[ . 1 . 2 . 3 ]" 1
890 1 22 LYS HA 1 33 HIS H 3.350 . 5.500 5.513 5.316 5.602 0.102 5 0 "[ . 1 . 2 . 3 ]" 1
891 1 74 TYR HB3 1 74 TYR HD1 3.350 . 5.500 3.760 3.705 3.766 . 0 0 "[ . 1 . 2 . 3 ]" 1
892 1 97 TYR HB3 1 97 TYR HD2 2.850 . 4.000 2.381 2.366 2.400 . 0 0 "[ . 1 . 2 . 3 ]" 1
893 1 32 LEU MD2 1 35 LEU MD1 3.350 . 5.500 2.116 2.056 2.217 . 0 0 "[ . 1 . 2 . 3 ]" 1
894 1 67 TYR HB2 1 67 TYR QD 3.350 . 5.500 2.412 2.360 2.485 . 0 0 "[ . 1 . 2 . 3 ]" 1
895 1 95 ILE HA 1 98 LEU QB 3.350 . 5.500 2.174 2.118 2.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
896 1 97 TYR HD2 1 98 LEU MD1 3.600 . 6.000 4.305 4.087 4.760 . 0 0 "[ . 1 . 2 . 3 ]" 1
897 1 74 TYR HA 1 74 TYR HB2 2.850 . 4.000 2.675 2.652 2.700 . 0 0 "[ . 1 . 2 . 3 ]" 1
898 1 36 PHE HD2 1 61 GLU QG 3.350 . 5.500 4.534 4.200 4.963 . 0 0 "[ . 1 . 2 . 3 ]" 1
899 1 65 MET HG3 1 95 ILE MD 2.600 . 3.500 2.127 2.047 2.371 . 0 0 "[ . 1 . 2 . 3 ]" 1
900 1 32 LEU MD2 1 98 LEU MD2 3.850 . 6.000 4.248 4.167 4.295 . 0 0 "[ . 1 . 2 . 3 ]" 1
901 1 68 LEU QD 1 94 LEU HG 3.100 . 3.500 2.660 2.594 2.726 . 0 0 "[ . 1 . 2 . 3 ]" 1
902 1 54 ASN HA 1 54 ASN HB3 2.850 . 4.000 2.643 2.619 2.672 . 0 0 "[ . 1 . 2 . 3 ]" 1
903 1 25 LYS HA 1 25 LYS QG 2.850 . 4.000 3.217 2.439 3.398 . 0 0 "[ . 1 . 2 . 3 ]" 1
904 1 93 ASP QB 1 96 ALA MB 3.350 . 5.500 3.890 3.833 3.923 . 0 0 "[ . 1 . 2 . 3 ]" 1
905 1 94 LEU HA 1 98 LEU MD1 3.600 . 6.000 4.363 4.254 4.588 . 0 0 "[ . 1 . 2 . 3 ]" 1
906 1 75 ILE MG 1 78 THR HB 3.600 . 6.000 3.012 2.824 3.320 . 0 0 "[ . 1 . 2 . 3 ]" 1
907 1 91 ARG QB 1 95 ILE MD 2.850 . 4.000 2.208 2.124 2.572 . 0 0 "[ . 1 . 2 . 3 ]" 1
908 1 20 VAL MG2 1 101 ALA MB 3.350 . 5.500 2.376 2.213 2.488 . 0 0 "[ . 1 . 2 . 3 ]" 1
909 1 32 LEU HA 1 32 LEU MD2 3.100 . 4.500 2.084 2.033 2.137 . 0 0 "[ . 1 . 2 . 3 ]" 1
910 1 38 ARG QD 1 42 GLN HE21 3.350 . 5.500 2.699 1.912 4.112 . 0 0 "[ . 1 . 2 . 3 ]" 1
911 1 49 THR HA 1 49 THR MG 3.100 . 3.500 2.384 2.258 2.452 . 0 0 "[ . 1 . 2 . 3 ]" 1
912 1 50 ASP HA 1 50 ASP QB 2.350 . 3.000 2.286 2.175 2.391 . 0 0 "[ . 1 . 2 . 3 ]" 1
913 1 3 VAL MG2 1 100 LYS QE 3.350 . 5.500 3.405 2.209 3.970 . 0 0 "[ . 1 . 2 . 3 ]" 1
914 1 59 TRP HA 1 64 LEU HA 3.350 . 5.500 5.037 4.907 5.126 . 0 0 "[ . 1 . 2 . 3 ]" 1
915 1 49 THR MG 1 78 THR HA 3.600 . 6.000 2.578 2.259 2.818 . 0 0 "[ . 1 . 2 . 3 ]" 1
916 1 16 GLN HA 1 16 GLN HB2 2.350 . 3.000 2.996 2.917 3.020 0.020 19 0 "[ . 1 . 2 . 3 ]" 1
917 1 41 GLY HA3 1 48 TYR HB3 3.350 . 5.500 2.854 2.705 3.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
918 1 67 TYR QD 1 68 LEU HA 2.850 . 4.000 3.153 2.909 3.552 . 0 0 "[ . 1 . 2 . 3 ]" 1
919 1 19 THR MG 1 25 LYS QE 3.350 . 5.500 3.743 3.023 4.146 . 0 0 "[ . 1 . 2 . 3 ]" 1
920 1 46 PHE HA 1 46 PHE HB3 2.850 . 4.000 3.016 2.997 3.026 . 0 0 "[ . 1 . 2 . 3 ]" 1
921 1 57 ILE MD 1 75 ILE MD 3.850 . 6.000 2.792 2.353 3.335 . 0 0 "[ . 1 . 2 . 3 ]" 1
922 1 84 GLY HA2 1 85 ILE MD 3.600 . 6.000 4.956 4.778 4.995 . 0 0 "[ . 1 . 2 . 3 ]" 1
923 1 39 LYS HA 1 58 THR HA 2.850 . 4.000 2.128 2.060 2.228 . 0 0 "[ . 1 . 2 . 3 ]" 1
924 1 78 THR HA 1 79 LYS HA 3.350 . 5.000 4.367 4.361 4.375 . 0 0 "[ . 1 . 2 . 3 ]" 1
925 1 35 LEU HA 1 38 ARG H 2.850 . 4.000 3.764 3.456 3.913 . 0 0 "[ . 1 . 2 . 3 ]" 1
926 1 56 GLY H 1 56 GLY HA2 2.850 . 4.000 2.913 2.886 2.934 . 0 0 "[ . 1 . 2 . 3 ]" 1
927 1 20 VAL MG1 1 102 THR HA 3.600 . 6.000 5.002 4.901 5.050 . 0 0 "[ . 1 . 2 . 3 ]" 1
928 1 59 TRP HB2 1 64 LEU QD 3.600 . 6.000 4.377 4.253 4.619 . 0 0 "[ . 1 . 2 . 3 ]" 1
929 1 51 ALA MB 1 75 ILE MG 3.350 . 5.500 2.199 2.123 2.306 . 0 0 "[ . 1 . 2 . 3 ]" 1
930 1 8 LYS HA 1 8 LYS QB 2.350 . 3.000 2.327 2.171 2.342 . 0 0 "[ . 1 . 2 . 3 ]" 1
931 1 19 THR HB 1 31 ASN HB2 2.850 . 4.000 3.978 3.581 4.081 0.081 1 0 "[ . 1 . 2 . 3 ]" 1
932 1 6 GLY HA2 1 94 LEU HA 2.850 . 4.000 2.309 2.267 2.442 . 0 0 "[ . 1 . 2 . 3 ]" 1
933 1 73 LYS HA 1 73 LYS QG 2.850 . 4.000 2.290 2.111 3.441 . 0 0 "[ . 1 . 2 . 3 ]" 1
934 1 51 ALA HA 1 54 ASN HB3 3.350 . 4.000 2.528 2.340 2.580 . 0 0 "[ . 1 . 2 . 3 ]" 1
935 1 65 MET ME 1 95 ILE MD 3.850 . 6.000 3.101 2.995 3.249 . 0 0 "[ . 1 . 2 . 3 ]" 1
936 1 15 ALA MB 1 16 GLN HG3 3.600 . 6.000 4.151 3.863 4.913 . 0 0 "[ . 1 . 2 . 3 ]" 1
937 1 57 ILE HG12 1 57 ILE MG 3.100 . 3.500 2.226 2.189 2.262 . 0 0 "[ . 1 . 2 . 3 ]" 1
938 1 63 THR HB 1 64 LEU HG 3.350 . 5.500 5.069 4.832 5.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
939 1 79 LYS HA 1 79 LYS QD 2.850 . 4.000 2.748 2.210 3.891 . 0 0 "[ . 1 . 2 . 3 ]" 1
940 1 7 LYS HA 1 11 VAL H 3.350 . 5.500 3.887 3.845 3.970 . 0 0 "[ . 1 . 2 . 3 ]" 1
941 1 68 LEU HA 1 68 LEU QD 3.600 . 4.500 2.075 1.998 2.132 . 0 0 "[ . 1 . 2 . 3 ]" 1
942 1 75 ILE MD 1 78 THR HB 3.600 . 6.000 3.993 3.724 4.164 . 0 0 "[ . 1 . 2 . 3 ]" 1
943 1 9 ILE HA 1 10 PHE H 3.350 . 5.500 3.463 3.450 3.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
944 1 20 VAL MG1 1 32 LEU H 3.600 . 6.000 3.286 3.037 3.554 . 0 0 "[ . 1 . 2 . 3 ]" 1
945 1 58 THR MG 1 60 LYS QE 3.350 . 5.500 3.760 3.613 4.012 . 0 0 "[ . 1 . 2 . 3 ]" 1
946 1 9 ILE HA 1 9 ILE HG12 2.850 . 4.000 2.633 2.560 2.676 . 0 0 "[ . 1 . 2 . 3 ]" 1
947 1 35 LEU H 1 36 PHE HB2 3.350 . 5.500 5.328 5.203 5.578 0.078 27 0 "[ . 1 . 2 . 3 ]" 1
948 1 68 LEU HA 1 68 LEU QB 2.350 . 3.000 2.492 2.445 2.526 . 0 0 "[ . 1 . 2 . 3 ]" 1
949 1 9 ILE MD 1 9 ILE MG 3.350 . 5.500 1.951 1.861 2.037 . 0 0 "[ . 1 . 2 . 3 ]" 1
950 1 72 LYS HA 1 74 TYR H 3.350 . 5.500 4.137 3.742 4.354 . 0 0 "[ . 1 . 2 . 3 ]" 1
951 1 75 ILE MD 1 75 ILE MG 3.350 . 5.500 1.963 1.764 2.080 . 0 0 "[ . 1 . 2 . 3 ]" 1
952 1 2 ASP HB3 1 5 LYS H 2.850 . 4.000 2.472 2.263 2.713 . 0 0 "[ . 1 . 2 . 3 ]" 1
953 1 98 LEU HA 1 98 LEU MD2 2.600 . 3.500 2.201 2.154 2.252 . 0 0 "[ . 1 . 2 . 3 ]" 1
954 1 13 LYS HA 1 13 LYS QE 3.350 . 5.500 3.775 2.049 4.211 . 0 0 "[ . 1 . 2 . 3 ]" 1
955 1 35 LEU HA 1 35 LEU MD1 3.100 . 4.500 2.353 2.232 2.470 . 0 0 "[ . 1 . 2 . 3 ]" 1
956 1 10 PHE HA 1 12 GLN H 3.350 . 5.500 4.110 4.051 4.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
957 1 94 LEU QB 1 95 ILE HA 2.850 . 4.000 4.168 4.136 4.187 0.187 21 0 "[ . 1 . 2 . 3 ]" 1
958 1 20 VAL HB 1 21 GLU HA 3.350 . 5.500 4.884 4.848 4.931 . 0 0 "[ . 1 . 2 . 3 ]" 1
959 1 3 VAL MG2 1 97 TYR HD1 3.600 . 6.000 2.197 2.152 2.250 . 0 0 "[ . 1 . 2 . 3 ]" 1
960 1 2 ASP HA 1 3 VAL HB 3.350 . 5.500 4.830 4.716 4.968 . 0 0 "[ . 1 . 2 . 3 ]" 1
961 1 40 THR MG 1 57 ILE HG12 3.100 . 4.500 3.467 3.247 3.778 . 0 0 "[ . 1 . 2 . 3 ]" 1
962 1 57 ILE MD 1 63 THR HA 3.600 . 6.000 4.505 4.189 4.807 . 0 0 "[ . 1 . 2 . 3 ]" 1
963 1 38 ARG HA 1 58 THR MG 3.600 . 6.000 3.537 3.342 4.122 . 0 0 "[ . 1 . 2 . 3 ]" 1
964 1 29 GLY H 1 30 PRO HA 3.350 . 5.500 4.721 4.662 4.794 . 0 0 "[ . 1 . 2 . 3 ]" 1
965 1 35 LEU MD1 1 64 LEU QD 3.850 . 6.000 3.435 3.354 3.593 . 0 0 "[ . 1 . 2 . 3 ]" 1
966 1 93 ASP HA 1 96 ALA MB 3.600 . 6.000 2.474 2.333 2.548 . 0 0 "[ . 1 . 2 . 3 ]" 1
967 1 17 CYS HA 1 28 THR HA 3.350 . 5.500 5.480 5.326 5.565 0.065 29 0 "[ . 1 . 2 . 3 ]" 1
968 1 19 THR HA 1 20 VAL MG2 3.600 . 6.000 3.519 3.488 3.591 . 0 0 "[ . 1 . 2 . 3 ]" 1
969 1 39 LYS QD 1 58 THR HB 3.350 . 5.500 4.261 3.864 4.554 . 0 0 "[ . 1 . 2 . 3 ]" 1
970 1 19 THR H 1 20 VAL MG1 3.600 . 6.000 2.783 2.652 2.938 . 0 0 "[ . 1 . 2 . 3 ]" 1
971 1 19 THR MG 1 27 LYS QE 3.350 . 5.500 3.371 2.325 4.069 . 0 0 "[ . 1 . 2 . 3 ]" 1
972 1 68 LEU QB 1 95 ILE HG12 3.350 . 5.500 4.956 4.905 5.024 . 0 0 "[ . 1 . 2 . 3 ]" 1
973 1 101 ALA MB 1 102 THR HA 3.600 . 6.000 3.924 3.882 3.974 . 0 0 "[ . 1 . 2 . 3 ]" 1
974 1 101 ALA HA 1 102 THR MG 3.600 . 6.000 4.705 4.654 4.765 . 0 0 "[ . 1 . 2 . 3 ]" 1
975 1 68 LEU QD 1 94 LEU QB 3.600 . 6.000 2.677 2.558 2.736 . 0 0 "[ . 1 . 2 . 3 ]" 1
976 1 65 MET HA 1 66 GLU HA 3.350 . 5.500 4.771 4.739 4.798 . 0 0 "[ . 1 . 2 . 3 ]" 1
977 1 96 ALA MB 1 97 TYR HB3 3.600 . 6.000 4.466 4.404 4.556 . 0 0 "[ . 1 . 2 . 3 ]" 1
978 1 101 ALA HA 1 104 GLU QG 2.850 . 4.000 3.255 2.351 3.665 . 0 0 "[ . 1 . 2 . 3 ]" 1
979 1 74 TYR HD2 1 75 ILE MG 3.600 . 6.000 4.911 4.498 4.989 . 0 0 "[ . 1 . 2 . 3 ]" 1
980 1 57 ILE MD 1 57 ILE MG 3.350 . 5.500 3.165 3.088 3.204 . 0 0 "[ . 1 . 2 . 3 ]" 1
981 1 57 ILE MD 1 58 THR MG 3.850 . 6.000 4.070 4.004 4.096 . 0 0 "[ . 1 . 2 . 3 ]" 1
982 1 35 LEU MD1 1 59 TRP HB3 3.100 . 4.500 2.868 2.629 3.569 . 0 0 "[ . 1 . 2 . 3 ]" 1
983 1 89 THR HA 1 89 THR MG 3.100 . 4.500 2.310 2.251 2.394 . 0 0 "[ . 1 . 2 . 3 ]" 1
984 1 72 LYS QE 1 72 LYS QG 2.850 . 4.000 2.544 2.269 2.768 . 0 0 "[ . 1 . 2 . 3 ]" 1
985 1 88 LYS HA 1 88 LYS QG 3.350 . 5.500 2.354 2.244 2.501 . 0 0 "[ . 1 . 2 . 3 ]" 1
986 1 19 THR HA 1 19 THR HB 2.350 . 3.000 2.903 2.813 2.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
987 1 72 LYS QD 1 76 PRO HA 3.350 . 5.500 3.516 2.413 4.392 . 0 0 "[ . 1 . 2 . 3 ]" 1
988 1 31 ASN HA 1 32 LEU MD2 3.100 . 4.500 3.420 3.291 3.466 . 0 0 "[ . 1 . 2 . 3 ]" 1
989 1 37 GLY H 1 38 ARG HA 3.350 . 5.500 4.746 4.669 4.799 . 0 0 "[ . 1 . 2 . 3 ]" 1
990 1 62 GLU HA 1 64 LEU H 2.850 . 4.000 4.101 4.058 4.131 0.131 13 0 "[ . 1 . 2 . 3 ]" 1
991 1 11 VAL HA 1 11 VAL HB 2.350 . 3.000 2.483 2.476 2.491 . 0 0 "[ . 1 . 2 . 3 ]" 1
992 1 71 PRO HD3 1 84 GLY HA2 3.350 . 5.500 3.318 3.068 3.601 . 0 0 "[ . 1 . 2 . 3 ]" 1
993 1 12 GLN H 1 12 GLN HG2 2.350 . 3.000 1.958 1.787 2.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
994 1 1 GLY HA3 1 96 ALA MB 3.600 . 6.000 3.199 2.240 4.262 . 0 0 "[ . 1 . 2 . 3 ]" 1
995 1 52 ASN HD22 1 75 ILE MG 3.600 . 6.000 4.293 3.969 4.739 . 0 0 "[ . 1 . 2 . 3 ]" 1
996 1 3 VAL MG1 1 5 LYS H 3.600 . 6.000 4.735 4.676 4.790 . 0 0 "[ . 1 . 2 . 3 ]" 1
997 1 3 VAL HA 1 4 GLU HA 3.350 . 5.500 4.761 4.750 4.776 . 0 0 "[ . 1 . 2 . 3 ]" 1
998 1 38 ARG HA 1 38 ARG QD 3.350 . 5.500 3.789 2.453 3.919 . 0 0 "[ . 1 . 2 . 3 ]" 1
999 1 46 PHE HA 1 46 PHE HB2 2.850 . 4.000 2.556 2.452 2.644 . 0 0 "[ . 1 . 2 . 3 ]" 1
1000 1 53 LYS QB 1 54 ASN HA 3.350 . 5.500 4.601 3.896 4.821 . 0 0 "[ . 1 . 2 . 3 ]" 1
1001 1 41 GLY H 1 75 ILE MD 3.600 . 6.000 4.744 4.434 4.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
1002 1 9 ILE MD 1 90 GLU QG 2.850 . 4.000 2.526 2.259 2.657 . 0 0 "[ . 1 . 2 . 3 ]" 1
1003 1 40 THR H 1 58 THR MG 3.600 . 6.000 4.782 4.547 4.876 . 0 0 "[ . 1 . 2 . 3 ]" 1
1004 1 11 VAL HA 1 13 LYS H 3.350 . 5.500 4.521 4.441 4.556 . 0 0 "[ . 1 . 2 . 3 ]" 1
1005 1 99 LYS HA 1 99 LYS QD 3.350 . 5.500 3.940 3.742 4.163 . 0 0 "[ . 1 . 2 . 3 ]" 1
1006 1 9 ILE HB 1 94 LEU QD . . 3.500 2.294 2.258 2.473 . 0 0 "[ . 1 . 2 . 3 ]" 1
1007 1 19 THR MG 1 24 GLY HA3 3.600 . 6.000 2.876 2.260 3.352 . 0 0 "[ . 1 . 2 . 3 ]" 1
1008 1 21 GLU H 1 21 GLU QG 2.850 . 4.000 2.241 1.949 2.376 . 0 0 "[ . 1 . 2 . 3 ]" 1
1009 1 11 VAL HA 1 11 VAL QG 2.600 . 3.500 2.204 2.191 2.215 . 0 0 "[ . 1 . 2 . 3 ]" 1
1010 1 35 LEU HA 1 35 LEU MD2 3.600 . 6.000 3.913 3.856 3.933 . 0 0 "[ . 1 . 2 . 3 ]" 1
1011 1 14 CYS H 1 14 CYS HB2 2.850 . 4.000 2.810 2.787 2.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
1012 1 62 GLU HA 1 66 GLU H 3.350 . 5.500 4.337 4.186 4.473 . 0 0 "[ . 1 . 2 . 3 ]" 1
1013 1 101 ALA MB 1 104 GLU H 3.600 . 6.000 4.708 4.574 4.811 . 0 0 "[ . 1 . 2 . 3 ]" 1
1014 1 17 CYS HA 1 28 THR MG 3.600 . 6.000 3.847 3.696 4.109 . 0 0 "[ . 1 . 2 . 3 ]" 1
1015 1 57 ILE MD 1 60 LYS H 3.600 . 6.000 4.376 4.242 4.549 . 0 0 "[ . 1 . 2 . 3 ]" 1
1016 1 13 LYS HA 1 82 PHE QD 3.350 . 5.500 4.535 4.159 5.202 . 0 0 "[ . 1 . 2 . 3 ]" 1
1017 1 70 ASN H 1 71 PRO HD2 3.350 . 5.500 3.594 3.290 3.793 . 0 0 "[ . 1 . 2 . 3 ]" 1
1018 1 2 ASP HA 1 5 LYS QE 3.350 . 5.500 4.538 4.317 4.681 . 0 0 "[ . 1 . 2 . 3 ]" 1
1019 1 57 ILE MD 1 63 THR MG 3.850 . 6.000 2.949 2.518 3.238 . 0 0 "[ . 1 . 2 . 3 ]" 1
1020 1 10 PHE HB2 1 10 PHE HD2 2.850 . 4.000 2.511 2.421 3.670 . 0 0 "[ . 1 . 2 . 3 ]" 1
1021 1 35 LEU MD2 1 64 LEU QD 3.850 . 6.000 1.770 1.745 1.787 . 0 0 "[ . 1 . 2 . 3 ]" 1
1022 1 4 GLU HA 1 4 GLU QB 2.350 . 3.000 2.379 2.300 2.433 . 0 0 "[ . 1 . 2 . 3 ]" 1
1023 1 36 PHE HB2 1 37 GLY H 3.350 . 5.500 4.434 4.303 4.458 . 0 0 "[ . 1 . 2 . 3 ]" 1
1024 1 43 ALA MB 1 46 PHE HB3 3.600 . 6.000 4.786 4.519 4.905 . 0 0 "[ . 1 . 2 . 3 ]" 1
1025 1 19 THR HA 1 19 THR MG 3.100 . 3.500 2.149 2.118 2.206 . 0 0 "[ . 1 . 2 . 3 ]" 1
1026 1 32 LEU HB2 1 98 LEU MD2 3.600 . 6.000 3.329 3.095 3.563 . 0 0 "[ . 1 . 2 . 3 ]" 1
1027 1 72 LYS QD 1 78 THR MG 3.350 . 5.500 3.306 2.187 4.122 . 0 0 "[ . 1 . 2 . 3 ]" 1
1028 1 97 TYR HA 1 100 LYS QB 3.350 . 5.500 3.027 2.839 3.185 . 0 0 "[ . 1 . 2 . 3 ]" 1
1029 1 73 LYS HA 1 73 LYS QE 3.350 . 5.500 4.398 4.002 4.860 . 0 0 "[ . 1 . 2 . 3 ]" 1
1030 1 49 THR HB 1 78 THR H 3.350 . 5.500 5.088 4.879 5.289 . 0 0 "[ . 1 . 2 . 3 ]" 1
1031 1 36 PHE HD2 1 60 LYS HA 2.850 . 4.000 2.748 2.521 2.924 . 0 0 "[ . 1 . 2 . 3 ]" 1
1032 1 78 THR MG 1 79 LYS HA 3.600 . 5.500 4.081 3.969 4.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
1033 1 28 THR HA 1 28 THR MG 2.600 . 3.500 2.235 2.178 2.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
1034 1 79 LYS H 1 79 LYS HA 2.850 . 4.000 2.917 2.885 2.935 . 0 0 "[ . 1 . 2 . 3 ]" 1
1035 1 54 ASN HA 1 54 ASN HB2 2.850 . 4.000 2.302 2.285 2.319 . 0 0 "[ . 1 . 2 . 3 ]" 1
1036 1 52 ASN HD22 1 75 ILE MD 3.100 . 4.500 3.671 3.528 3.746 . 0 0 "[ . 1 . 2 . 3 ]" 1
1037 1 57 ILE HA 1 57 ILE HB 2.350 . 3.000 2.425 2.401 2.462 . 0 0 "[ . 1 . 2 . 3 ]" 1
1038 1 98 LEU HA 1 98 LEU MD1 3.600 . 6.000 3.782 3.765 3.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
1039 1 32 LEU HA 1 33 HIS H 3.350 . 5.500 2.882 2.796 2.954 . 0 0 "[ . 1 . 2 . 3 ]" 1
1040 1 51 ALA HA 1 54 ASN HB2 2.850 . 4.000 4.018 3.836 4.066 0.066 28 0 "[ . 1 . 2 . 3 ]" 1
1041 1 64 LEU QB 1 68 LEU QD 3.350 . 5.500 2.698 2.394 3.071 . 0 0 "[ . 1 . 2 . 3 ]" 1
1042 1 20 VAL MG1 1 97 TYR HD2 3.600 . 6.000 4.705 4.550 4.768 . 0 0 "[ . 1 . 2 . 3 ]" 1
1043 1 20 VAL HA 1 20 VAL MG2 2.600 . 3.500 3.190 3.185 3.193 . 0 0 "[ . 1 . 2 . 3 ]" 1
1044 1 103 ASN HA 1 103 ASN HB3 2.350 . 3.000 2.591 2.547 2.627 . 0 0 "[ . 1 . 2 . 3 ]" 1
1045 1 12 GLN HA 1 12 GLN HG3 2.850 . 4.000 3.766 3.711 3.949 . 0 0 "[ . 1 . 2 . 3 ]" 1
1046 1 20 VAL HA 1 20 VAL HB 2.350 . 3.000 2.411 2.392 2.426 . 0 0 "[ . 1 . 2 . 3 ]" 1
1047 1 9 ILE HA 1 12 GLN HG3 2.850 . 4.000 3.238 2.962 3.339 . 0 0 "[ . 1 . 2 . 3 ]" 1
1048 1 72 LYS HA 1 72 LYS QD 2.850 . 4.000 2.966 2.147 3.685 . 0 0 "[ . 1 . 2 . 3 ]" 1
1049 1 102 THR HA 1 102 THR MG 2.600 . 3.500 2.365 2.305 2.404 . 0 0 "[ . 1 . 2 . 3 ]" 1
1050 1 67 TYR QD 1 74 TYR HA 3.350 . 5.500 5.240 5.145 5.476 . 0 0 "[ . 1 . 2 . 3 ]" 1
1051 1 59 TRP HA 1 59 TRP HD1 3.350 . 5.500 2.607 2.351 4.506 . 0 0 "[ . 1 . 2 . 3 ]" 1
1052 1 49 THR MG 1 78 THR HB 3.600 . 6.000 4.744 4.414 4.896 . 0 0 "[ . 1 . 2 . 3 ]" 1
1053 1 2 ASP HA 1 3 VAL MG1 3.600 . 4.500 3.437 3.357 3.510 . 0 0 "[ . 1 . 2 . 3 ]" 1
1054 1 47 THR HB 1 48 TYR H 3.350 . 5.500 4.445 4.405 4.588 . 0 0 "[ . 1 . 2 . 3 ]" 1
1055 1 13 LYS HA 1 13 LYS QG 2.850 . 4.000 2.277 2.159 2.809 . 0 0 "[ . 1 . 2 . 3 ]" 1
1056 1 68 LEU QD 1 95 ILE MD 3.850 . 6.000 1.969 1.929 2.039 . 0 0 "[ . 1 . 2 . 3 ]" 1
1057 1 9 ILE HA 1 9 ILE MG 2.600 . 3.500 2.334 2.301 2.405 . 0 0 "[ . 1 . 2 . 3 ]" 1
1058 1 72 LYS QD 1 72 LYS QG 2.350 . 3.000 2.037 2.020 2.048 . 0 0 "[ . 1 . 2 . 3 ]" 1
1059 1 68 LEU QD 1 98 LEU MD1 3.850 . 6.000 2.504 2.442 2.621 . 0 0 "[ . 1 . 2 . 3 ]" 1
1060 1 62 GLU HA 1 65 MET ME 3.100 . 4.500 4.022 3.935 4.048 . 0 0 "[ . 1 . 2 . 3 ]" 1
1061 1 61 GLU QB 1 62 GLU H 3.350 . 5.500 2.169 2.141 2.232 . 0 0 "[ . 1 . 2 . 3 ]" 1
1062 1 91 ARG HA 1 94 LEU QD 3.600 . 6.000 3.176 3.050 3.315 . 0 0 "[ . 1 . 2 . 3 ]" 1
1063 1 8 LYS QB 1 11 VAL QG 3.350 . 5.500 3.708 3.241 3.754 . 0 0 "[ . 1 . 2 . 3 ]" 1
1064 1 67 TYR QD 1 68 LEU QD 3.600 . 6.000 3.003 2.528 3.494 . 0 0 "[ . 1 . 2 . 3 ]" 1
1065 1 74 TYR H 1 74 TYR HB3 3.350 . 5.500 2.925 2.867 2.991 . 0 0 "[ . 1 . 2 . 3 ]" 1
1066 1 11 VAL MG1 1 11 VAL MG2 2.850 . 4.000 2.058 2.040 2.081 . 0 0 "[ . 1 . 2 . 3 ]" 1
1067 1 69 GLU HA 1 69 GLU QG 2.850 . 4.000 3.154 2.609 3.430 . 0 0 "[ . 1 . 2 . 3 ]" 1
1068 1 102 THR H 1 102 THR HB 2.850 . 4.000 3.627 3.610 3.646 . 0 0 "[ . 1 . 2 . 3 ]" 1
1069 1 79 LYS HA 1 81 ILE MD 3.600 . 6.000 3.025 2.798 3.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
1070 1 61 GLU QG 1 95 ILE MG 3.350 . 5.500 2.187 2.040 2.674 . 0 0 "[ . 1 . 2 . 3 ]" 1
1071 1 48 TYR HB3 1 53 LYS QB 3.350 . 5.500 3.410 3.162 3.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
1072 1 35 LEU MD2 1 59 TRP HB2 3.600 . 6.000 3.576 3.414 3.922 . 0 0 "[ . 1 . 2 . 3 ]" 1
1073 1 40 THR HA 1 40 THR HB 2.350 . 3.000 2.555 2.482 2.602 . 0 0 "[ . 1 . 2 . 3 ]" 1
1074 1 68 LEU HA 1 91 ARG QD 3.350 . 5.500 4.614 4.326 4.961 . 0 0 "[ . 1 . 2 . 3 ]" 1
1075 1 22 LYS QB 1 22 LYS QE 3.350 . 5.500 3.313 2.070 3.827 . 0 0 "[ . 1 . 2 . 3 ]" 1
1076 1 9 ILE H 1 94 LEU QD 3.100 . 4.500 3.981 3.936 4.030 . 0 0 "[ . 1 . 2 . 3 ]" 1
1077 1 94 LEU HA 1 94 LEU QD 3.100 . 4.500 2.040 2.017 2.051 . 0 0 "[ . 1 . 2 . 3 ]" 1
1078 1 16 GLN HA 1 16 GLN HB3 2.350 . 3.000 2.595 2.473 2.784 . 0 0 "[ . 1 . 2 . 3 ]" 1
1079 1 75 ILE MG 1 78 THR MG 3.850 . 6.000 3.819 3.649 4.067 . 0 0 "[ . 1 . 2 . 3 ]" 1
1080 1 32 LEU MD1 1 64 LEU QD 3.850 . 6.000 3.350 3.201 3.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
1081 1 81 ILE MD 1 82 PHE H 3.600 . 6.000 4.762 4.426 4.939 . 0 0 "[ . 1 . 2 . 3 ]" 1
1082 1 85 ILE HA 1 85 ILE MD 3.100 . 4.500 2.344 2.210 3.738 . 0 0 "[ . 1 . 2 . 3 ]" 1
1083 1 19 THR HA 1 20 VAL MG1 3.600 . 6.000 4.166 4.081 4.297 . 0 0 "[ . 1 . 2 . 3 ]" 1
1084 1 19 THR HB 1 21 GLU QB 3.350 . 5.500 4.141 3.867 4.485 . 0 0 "[ . 1 . 2 . 3 ]" 1
1085 1 40 THR MG 1 57 ILE MD 2.600 . 3.500 2.142 2.014 2.274 . 0 0 "[ . 1 . 2 . 3 ]" 1
1086 1 9 ILE MD 1 85 ILE MD 3.850 . 6.000 3.198 2.977 3.394 . 0 0 "[ . 1 . 2 . 3 ]" 1
1087 1 7 LYS H 1 8 LYS QB 3.350 . 5.500 4.317 4.274 4.641 . 0 0 "[ . 1 . 2 . 3 ]" 1
1088 1 7 LYS HA 1 7 LYS QG 2.850 . 4.000 2.358 2.228 2.398 . 0 0 "[ . 1 . 2 . 3 ]" 1
1089 1 36 PHE QD 1 64 LEU QD 3.350 . 5.500 3.134 2.784 3.209 . 0 0 "[ . 1 . 2 . 3 ]" 1
1090 1 3 VAL HA 1 3 VAL MG2 2.600 . 3.500 2.370 2.319 2.442 . 0 0 "[ . 1 . 2 . 3 ]" 1
1091 1 37 GLY HA2 1 58 THR MG 3.100 . 4.500 2.734 2.589 2.782 . 0 0 "[ . 1 . 2 . 3 ]" 1
1092 1 64 LEU QD 1 95 ILE MD 3.850 . 6.000 3.179 2.906 3.255 . 0 0 "[ . 1 . 2 . 3 ]" 1
1093 1 62 GLU HA 1 62 GLU QG 2.850 . 4.000 2.646 2.302 3.433 . 0 0 "[ . 1 . 2 . 3 ]" 1
1094 1 72 LYS QB 1 78 THR MG 3.350 . 5.500 3.678 3.452 3.956 . 0 0 "[ . 1 . 2 . 3 ]" 1
1095 1 68 LEU QD 1 94 LEU HA 3.600 . 6.000 4.773 4.735 4.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
1096 1 94 LEU QD 1 97 TYR HB3 3.100 . 4.500 2.998 2.888 3.160 . 0 0 "[ . 1 . 2 . 3 ]" 1
1097 1 14 CYS HB2 1 94 LEU QD 3.600 . 6.000 3.978 3.839 4.123 . 0 0 "[ . 1 . 2 . 3 ]" 1
1098 1 81 ILE MG 1 82 PHE HA 3.600 . 6.000 3.645 3.284 3.952 . 0 0 "[ . 1 . 2 . 3 ]" 1
1099 1 11 VAL QG 1 12 GLN HA 3.100 . 4.500 3.408 3.383 3.443 . 0 0 "[ . 1 . 2 . 3 ]" 1
1100 1 10 PHE HD1 1 15 ALA HA 3.350 . 5.500 5.487 5.082 5.567 0.067 3 0 "[ . 1 . 2 . 3 ]" 1
1101 1 12 GLN HA 1 16 GLN H 3.350 . 5.500 5.208 5.138 5.266 . 0 0 "[ . 1 . 2 . 3 ]" 1
1102 1 95 ILE H 1 98 LEU MD1 3.600 . 6.000 3.980 3.897 4.090 . 0 0 "[ . 1 . 2 . 3 ]" 1
1103 1 94 LEU QB 1 95 ILE H 2.850 . 4.000 2.617 2.553 2.676 . 0 0 "[ . 1 . 2 . 3 ]" 1
1104 1 10 PHE HA 1 15 ALA MB 3.600 . 6.000 4.744 4.658 4.802 . 0 0 "[ . 1 . 2 . 3 ]" 1
1105 1 16 GLN H 1 16 GLN HG2 2.850 . 4.000 3.474 2.068 4.036 0.036 15 0 "[ . 1 . 2 . 3 ]" 1
1106 1 39 LYS QD 1 56 GLY HA2 3.350 . 5.500 4.934 4.610 5.060 . 0 0 "[ . 1 . 2 . 3 ]" 1
1107 1 31 ASN HA 1 32 LEU HA 3.350 . 5.500 4.418 4.361 4.466 . 0 0 "[ . 1 . 2 . 3 ]" 1
1108 1 7 LYS HA 1 97 TYR HD1 3.350 . 5.500 3.519 3.300 3.678 . 0 0 "[ . 1 . 2 . 3 ]" 1
1109 1 9 ILE HA 1 9 ILE MD 3.100 . 4.500 3.846 3.816 3.861 . 0 0 "[ . 1 . 2 . 3 ]" 1
1110 1 81 ILE H 1 81 ILE MG 3.600 . 6.000 3.825 3.692 3.903 . 0 0 "[ . 1 . 2 . 3 ]" 1
1111 1 1 GLY HA2 1 2 ASP HA 3.350 . 5.500 4.466 4.384 4.606 . 0 0 "[ . 1 . 2 . 3 ]" 1
1112 1 81 ILE HA 1 82 PHE HA 3.350 . 5.500 4.412 4.372 4.457 . 0 0 "[ . 1 . 2 . 3 ]" 1
1113 1 98 LEU HA 1 101 ALA MB 3.100 . 4.500 2.404 2.302 2.521 . 0 0 "[ . 1 . 2 . 3 ]" 1
1114 1 49 THR HA 1 78 THR HA 3.350 . 5.500 5.407 5.223 5.529 0.029 6 0 "[ . 1 . 2 . 3 ]" 1
1115 1 97 TYR HA 1 100 LYS H 2.850 . 4.000 3.330 3.067 3.624 . 0 0 "[ . 1 . 2 . 3 ]" 1
1116 1 51 ALA MB 1 78 THR HA 3.600 . 6.000 3.701 3.410 4.125 . 0 0 "[ . 1 . 2 . 3 ]" 1
1117 1 68 LEU QD 1 85 ILE MD 3.850 . 6.000 3.142 2.284 3.394 . 0 0 "[ . 1 . 2 . 3 ]" 1
1118 1 10 PHE HA 1 14 CYS HA 3.350 . 5.500 5.094 5.011 5.211 . 0 0 "[ . 1 . 2 . 3 ]" 1
1119 1 74 TYR HA 1 74 TYR HB3 2.850 . 4.000 2.983 2.971 2.994 . 0 0 "[ . 1 . 2 . 3 ]" 1
1120 1 10 PHE HB2 1 94 LEU QD 3.600 . 6.000 2.200 2.074 2.312 . 0 0 "[ . 1 . 2 . 3 ]" 1
1121 1 58 THR HA 1 58 THR MG 2.600 . 3.500 2.414 2.351 2.581 . 0 0 "[ . 1 . 2 . 3 ]" 1
1122 1 38 ARG QB 1 38 ARG QD 2.850 . 4.000 2.142 2.074 2.631 . 0 0 "[ . 1 . 2 . 3 ]" 1
1123 1 2 ASP HA 1 4 GLU H 2.350 . 3.000 3.153 3.104 3.191 0.191 29 0 "[ . 1 . 2 . 3 ]" 1
1124 1 10 PHE HA 1 10 PHE HD2 2.850 . 4.000 3.197 3.082 4.295 0.295 23 0 "[ . 1 . 2 . 3 ]" 1
1125 1 71 PRO HB2 1 72 LYS H 3.350 . 5.500 2.706 2.461 3.360 . 0 0 "[ . 1 . 2 . 3 ]" 1
1126 1 2 ASP HB2 1 5 LYS QB 2.850 . 4.000 2.485 2.322 2.707 . 0 0 "[ . 1 . 2 . 3 ]" 1
1127 1 54 ASN HA 1 55 LYS HA 3.350 . 5.500 5.262 5.243 5.275 . 0 0 "[ . 1 . 2 . 3 ]" 1
1128 1 26 HIS HA 1 27 LYS H 2.850 . 4.000 2.141 2.119 2.183 . 0 0 "[ . 1 . 2 . 3 ]" 1
1129 1 85 ILE HA 1 85 ILE MG 3.100 . 4.500 2.396 2.338 2.642 . 0 0 "[ . 1 . 2 . 3 ]" 1
1130 1 72 LYS HA 1 72 LYS QE 2.850 . 4.000 2.956 2.307 3.754 . 0 0 "[ . 1 . 2 . 3 ]" 1
1131 1 1 GLY HA3 1 92 GLU QB 3.350 . 5.500 4.465 3.733 4.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
1132 1 11 VAL HA 1 14 CYS H 3.350 . 5.500 5.158 5.113 5.193 . 0 0 "[ . 1 . 2 . 3 ]" 1
1133 1 72 LYS HA 1 72 LYS QG 2.850 . 4.000 2.512 2.301 2.763 . 0 0 "[ . 1 . 2 . 3 ]" 1
1134 1 57 ILE H 1 75 ILE MD 3.600 . 6.000 4.283 4.050 4.558 . 0 0 "[ . 1 . 2 . 3 ]" 1
1135 1 96 ALA MB 1 97 TYR HB2 3.600 . 5.500 4.087 4.004 4.217 . 0 0 "[ . 1 . 2 . 3 ]" 1
1136 1 78 THR HB 1 79 LYS H 3.350 . 5.500 4.148 4.059 4.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
1137 1 68 LEU QD 1 91 ARG HA 3.600 . 6.000 2.397 2.182 2.588 . 0 0 "[ . 1 . 2 . 3 ]" 1
1138 1 74 TYR HA 1 74 TYR HD1 2.350 . 3.000 2.339 2.278 2.889 . 0 0 "[ . 1 . 2 . 3 ]" 1
1139 1 65 MET ME 1 92 GLU HA 2.600 . 3.500 2.563 2.504 2.624 . 0 0 "[ . 1 . 2 . 3 ]" 1
1140 1 32 LEU MD2 1 35 LEU MD2 3.850 . 6.000 3.318 3.031 3.518 . 0 0 "[ . 1 . 2 . 3 ]" 1
1141 1 81 ILE HA 1 81 ILE MG 3.100 . 3.500 2.355 2.276 2.487 . 0 0 "[ . 1 . 2 . 3 ]" 1
1142 1 99 LYS HA 1 99 LYS QE 3.350 . 5.500 4.218 3.801 4.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
1143 1 35 LEU MD2 1 98 LEU MD2 3.850 . 6.000 3.673 3.292 3.971 . 0 0 "[ . 1 . 2 . 3 ]" 1
1144 1 16 GLN HA 1 16 GLN HG3 2.850 . 4.000 2.862 2.545 3.696 . 0 0 "[ . 1 . 2 . 3 ]" 1
1145 1 35 LEU MD2 1 98 LEU MD1 3.850 . 6.000 3.826 3.453 3.979 . 0 0 "[ . 1 . 2 . 3 ]" 1
1146 1 20 VAL HA 1 32 LEU HB2 2.850 . 4.000 2.776 2.544 3.018 . 0 0 "[ . 1 . 2 . 3 ]" 1
1147 1 60 LYS HA 1 60 LYS HD3 3.350 . 5.500 4.575 4.524 4.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
1148 1 64 LEU QD 1 68 LEU QD 3.850 . 6.000 2.568 2.397 2.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
1149 1 103 ASN HA 1 103 ASN HB2 2.350 . 3.000 3.007 2.996 3.017 0.017 8 0 "[ . 1 . 2 . 3 ]" 1
1150 1 50 ASP HA 1 54 ASN H 2.850 . 4.000 4.071 4.020 4.145 0.145 6 0 "[ . 1 . 2 . 3 ]" 1
1151 1 20 VAL MG2 1 102 THR HA 3.350 . 5.500 4.530 4.471 4.595 . 0 0 "[ . 1 . 2 . 3 ]" 1
1152 1 50 ASP QB 1 51 ALA MB 3.850 . 6.000 3.978 3.803 4.399 . 0 0 "[ . 1 . 2 . 3 ]" 1
1153 1 64 LEU QD 1 68 LEU H 3.600 . 6.000 4.053 3.917 4.215 . 0 0 "[ . 1 . 2 . 3 ]" 1
1154 1 19 THR HB 1 20 VAL MG2 3.600 . 6.000 4.490 4.443 4.559 . 0 0 "[ . 1 . 2 . 3 ]" 1
1155 1 10 PHE HA 1 94 LEU QD 3.600 . 6.000 2.431 2.326 2.502 . 0 0 "[ . 1 . 2 . 3 ]" 1
1156 1 31 ASN H 1 32 LEU MD2 3.600 . 6.000 4.207 4.078 4.319 . 0 0 "[ . 1 . 2 . 3 ]" 1
1157 1 19 THR MG 1 26 HIS H 3.600 . 6.000 4.582 4.216 4.856 . 0 0 "[ . 1 . 2 . 3 ]" 1
1158 1 21 GLU QG 1 24 GLY HA3 3.350 . 5.500 2.086 2.026 2.220 . 0 0 "[ . 1 . 2 . 3 ]" 1
1159 1 26 HIS HA 1 26 HIS HB2 2.850 . 4.000 2.689 2.503 3.003 . 0 0 "[ . 1 . 2 . 3 ]" 1
1160 1 95 ILE HB 1 96 ALA MB 3.600 . 6.000 4.352 4.221 4.438 . 0 0 "[ . 1 . 2 . 3 ]" 1
1161 1 54 ASN HA 1 54 ASN HD21 3.350 . 5.500 3.637 3.617 3.664 . 0 0 "[ . 1 . 2 . 3 ]" 1
1162 1 61 GLU QB 1 61 GLU QG 2.350 . 3.000 2.104 2.045 2.108 . 0 0 "[ . 1 . 2 . 3 ]" 1
1163 1 68 LEU QD 1 69 GLU H 3.600 . 6.000 4.327 4.275 4.433 . 0 0 "[ . 1 . 2 . 3 ]" 1
1164 1 70 ASN HB2 1 71 PRO HD3 3.350 . 5.500 4.728 4.551 5.084 . 0 0 "[ . 1 . 2 . 3 ]" 1
1165 1 55 LYS HA 1 55 LYS QB 2.350 . 3.000 2.355 2.241 2.497 . 0 0 "[ . 1 . 2 . 3 ]" 1
1166 1 40 THR MG 1 58 THR H 3.600 . 6.000 4.431 4.221 4.646 . 0 0 "[ . 1 . 2 . 3 ]" 1
1167 1 9 ILE HB 1 10 PHE HA 3.350 . 5.500 4.361 4.309 4.485 . 0 0 "[ . 1 . 2 . 3 ]" 1
1168 1 10 PHE HD1 1 11 VAL QG 3.600 . 6.000 2.242 2.023 5.269 . 0 0 "[ . 1 . 2 . 3 ]" 1
1169 1 35 LEU HA 1 35 LEU HG 2.350 . 3.000 2.809 2.681 2.865 . 0 0 "[ . 1 . 2 . 3 ]" 1
1170 1 9 ILE MG 1 13 LYS QB 2.850 . 4.000 2.645 2.506 2.782 . 0 0 "[ . 1 . 2 . 3 ]" 1
1171 1 9 ILE MD 1 90 GLU H 3.600 . 6.000 4.782 4.576 4.863 . 0 0 "[ . 1 . 2 . 3 ]" 1
1172 1 39 LYS HA 1 39 LYS QE 3.350 . 5.500 3.959 3.264 4.381 . 0 0 "[ . 1 . 2 . 3 ]" 1
1173 1 64 LEU QD 1 67 TYR HB2 3.600 . 6.000 4.083 3.558 4.431 . 0 0 "[ . 1 . 2 . 3 ]" 1
1174 1 97 TYR HB3 1 101 ALA MB 3.600 . 6.000 4.435 4.314 4.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
1175 1 88 LYS HA 1 92 GLU H 2.850 . 4.000 4.032 3.949 4.077 0.077 3 0 "[ . 1 . 2 . 3 ]" 1
1176 1 76 PRO HA 1 77 GLY HA3 3.350 . 5.500 4.459 4.438 4.534 . 0 0 "[ . 1 . 2 . 3 ]" 1
1177 1 96 ALA H 1 97 TYR HB3 3.350 . 5.500 4.667 4.579 4.761 . 0 0 "[ . 1 . 2 . 3 ]" 1
1178 1 68 LEU QD 1 95 ILE MG 3.850 . 6.000 3.908 3.813 3.953 . 0 0 "[ . 1 . 2 . 3 ]" 1
1179 1 94 LEU HA 1 97 TYR HB3 2.850 . 4.000 3.199 3.124 3.292 . 0 0 "[ . 1 . 2 . 3 ]" 1
1180 1 42 GLN H 1 43 ALA MB 3.100 . 4.500 3.584 3.431 3.686 . 0 0 "[ . 1 . 2 . 3 ]" 1
1181 1 71 PRO HA 1 72 LYS HA 3.350 . 5.500 4.728 4.694 4.768 . 0 0 "[ . 1 . 2 . 3 ]" 1
1182 1 72 LYS QG 1 78 THR MG 3.350 . 5.500 3.733 3.407 3.986 . 0 0 "[ . 1 . 2 . 3 ]" 1
1183 1 10 PHE HB3 1 10 PHE HD1 3.350 . 5.500 2.533 2.444 3.692 . 0 0 "[ . 1 . 2 . 3 ]" 1
1184 1 55 LYS H 1 56 GLY HA2 3.350 . 5.500 5.208 5.093 5.263 . 0 0 "[ . 1 . 2 . 3 ]" 1
1185 1 35 LEU HG 1 64 LEU QD 3.100 . 4.500 3.527 3.427 3.652 . 0 0 "[ . 1 . 2 . 3 ]" 1
1186 1 95 ILE HA 1 98 LEU MD1 3.600 . 6.000 2.154 2.044 2.240 . 0 0 "[ . 1 . 2 . 3 ]" 1
1187 1 36 PHE HA 1 36 PHE HB3 2.850 . 4.000 2.392 2.308 2.412 . 0 0 "[ . 1 . 2 . 3 ]" 1
1188 1 65 MET HA 1 68 LEU HB3 2.850 . 4.000 3.893 3.727 4.113 0.113 5 0 "[ . 1 . 2 . 3 ]" 1
1189 1 92 GLU HA 1 92 GLU QG 3.350 . 5.500 2.352 2.269 2.673 . 0 0 "[ . 1 . 2 . 3 ]" 1
1190 1 97 TYR HA 1 97 TYR HB2 2.350 . 3.000 2.399 2.373 2.432 . 0 0 "[ . 1 . 2 . 3 ]" 1
1191 1 20 VAL HB 1 101 ALA MB 3.100 . 4.500 2.856 2.534 3.088 . 0 0 "[ . 1 . 2 . 3 ]" 1
1192 1 65 MET HA 1 65 MET HG3 2.850 . 4.000 2.879 2.811 2.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
1193 1 59 TRP HA 1 64 LEU QB 3.600 . 6.000 5.280 5.230 5.341 . 0 0 "[ . 1 . 2 . 3 ]" 1
1194 1 85 ILE MG 1 90 GLU QG 3.350 . 5.500 3.433 3.359 3.461 . 0 0 "[ . 1 . 2 . 3 ]" 1
1195 1 19 THR HB 1 21 GLU H 2.850 . 4.000 2.404 2.225 2.648 . 0 0 "[ . 1 . 2 . 3 ]" 1
1196 1 72 LYS HA 1 73 LYS HA 3.350 . 5.500 4.760 4.725 4.793 . 0 0 "[ . 1 . 2 . 3 ]" 1
1197 1 19 THR MG 1 31 ASN HA 3.600 . 6.000 5.124 5.039 5.184 . 0 0 "[ . 1 . 2 . 3 ]" 1
1198 1 47 THR HA 1 47 THR MG . . 3.500 2.336 2.217 3.183 . 0 0 "[ . 1 . 2 . 3 ]" 1
1199 1 35 LEU MD2 1 64 LEU HG 2.600 . 3.500 2.694 2.526 2.756 . 0 0 "[ . 1 . 2 . 3 ]" 1
1200 1 65 MET ME 1 88 LYS QE 2.850 . 4.000 2.531 2.147 3.004 . 0 0 "[ . 1 . 2 . 3 ]" 1
1201 1 48 TYR HA 1 48 TYR HB3 2.850 . 4.000 2.653 2.595 2.687 . 0 0 "[ . 1 . 2 . 3 ]" 1
1202 1 41 GLY HA3 1 53 LYS HA 2.850 . 4.000 2.833 2.663 3.117 . 0 0 "[ . 1 . 2 . 3 ]" 1
1203 1 10 PHE H 1 12 GLN HG2 2.850 . 4.000 4.099 4.046 4.130 0.130 10 0 "[ . 1 . 2 . 3 ]" 1
1204 1 67 TYR QD 1 68 LEU QB 3.350 . 5.500 4.185 3.849 4.704 . 0 0 "[ . 1 . 2 . 3 ]" 1
1205 1 73 LYS HA 1 73 LYS QB 2.350 . 3.000 2.424 2.166 2.498 . 0 0 "[ . 1 . 2 . 3 ]" 1
1206 1 61 GLU QG 1 62 GLU H 3.350 . 5.500 3.352 3.035 3.574 . 0 0 "[ . 1 . 2 . 3 ]" 1
1207 1 49 THR HB 1 50 ASP QB 3.350 . 5.500 4.337 4.011 4.805 . 0 0 "[ . 1 . 2 . 3 ]" 1
1208 1 12 GLN QB 1 12 GLN HG3 2.350 . 3.000 2.304 2.228 2.336 . 0 0 "[ . 1 . 2 . 3 ]" 1
1209 1 68 LEU QB 1 95 ILE MD 3.350 . 5.500 3.221 3.028 3.433 . 0 0 "[ . 1 . 2 . 3 ]" 1
1210 1 32 LEU MD2 1 102 THR MG 3.850 . 6.000 4.389 4.178 4.521 . 0 0 "[ . 1 . 2 . 3 ]" 1
1211 1 12 GLN HG3 1 13 LYS H 3.350 . 5.500 2.874 2.706 3.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
1212 1 20 VAL MG1 1 98 LEU HA 3.600 . 6.000 3.844 3.720 3.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
1213 1 74 TYR HB3 1 75 ILE MD 3.600 . 6.000 3.470 3.322 3.825 . 0 0 "[ . 1 . 2 . 3 ]" 1
1214 1 10 PHE HE2 1 20 VAL MG2 3.600 . 6.000 2.243 2.104 3.768 . 0 0 "[ . 1 . 2 . 3 ]" 1
1215 1 16 GLN HA 1 17 CYS HA 3.350 . 5.500 4.559 4.555 4.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
1216 1 11 VAL HA 1 15 ALA MB 2.600 . 3.500 2.006 1.973 2.034 . 0 0 "[ . 1 . 2 . 3 ]" 1
1217 1 95 ILE MG 1 96 ALA HA 3.100 . 4.500 3.412 3.336 3.478 . 0 0 "[ . 1 . 2 . 3 ]" 1
1218 1 65 MET HA 1 65 MET ME 3.850 2.700 5.000 4.081 4.024 4.138 . 0 0 "[ . 1 . 2 . 3 ]" 1
1219 1 9 ILE MG 1 94 LEU QD 3.350 . 5.500 2.076 1.957 2.159 . 0 0 "[ . 1 . 2 . 3 ]" 1
1220 1 48 TYR HB2 1 53 LYS H 3.350 . 5.500 5.234 4.941 5.432 . 0 0 "[ . 1 . 2 . 3 ]" 1
1221 1 50 ASP H 1 51 ALA MB 3.600 . 6.000 4.430 4.220 4.526 . 0 0 "[ . 1 . 2 . 3 ]" 1
1222 1 21 GLU QB 1 21 GLU QG 2.350 . 3.000 2.096 2.093 2.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
1223 1 94 LEU HA 1 95 ILE H 2.850 . 4.000 3.511 3.497 3.522 . 0 0 "[ . 1 . 2 . 3 ]" 1
1224 1 47 THR MG 1 48 TYR HA 3.600 . 6.000 4.553 4.313 4.703 . 0 0 "[ . 1 . 2 . 3 ]" 1
1225 1 6 GLY HA2 1 9 ILE MD 3.100 . 4.500 2.592 2.402 2.821 . 0 0 "[ . 1 . 2 . 3 ]" 1
1226 1 20 VAL HA 1 32 LEU MD2 3.600 . 6.000 4.748 4.585 4.890 . 0 0 "[ . 1 . 2 . 3 ]" 1
1227 1 50 ASP QB 1 53 LYS QD 3.350 . 5.500 3.978 3.078 4.415 . 0 0 "[ . 1 . 2 . 3 ]" 1
1228 1 43 ALA MB 1 45 GLY HA3 3.600 . 6.000 4.459 3.569 4.796 . 0 0 "[ . 1 . 2 . 3 ]" 1
1229 1 73 LYS QE 1 74 TYR HD1 3.350 . 5.500 4.421 3.429 4.911 . 0 0 "[ . 1 . 2 . 3 ]" 1
1230 1 64 LEU QD 1 68 LEU HA 3.600 . 6.000 4.307 4.084 4.481 . 0 0 "[ . 1 . 2 . 3 ]" 1
1231 1 73 LYS HA 1 76 PRO HD3 2.850 . 4.000 3.416 3.288 3.794 . 0 0 "[ . 1 . 2 . 3 ]" 1
1232 1 38 ARG QD 1 42 GLN HE22 3.350 . 5.500 3.434 1.896 4.966 . 0 0 "[ . 1 . 2 . 3 ]" 1
1233 1 88 LYS QE 1 89 THR MG 3.350 . 5.500 3.403 2.811 4.008 . 0 0 "[ . 1 . 2 . 3 ]" 1
1234 1 74 TYR HB3 1 75 ILE H 3.350 . 5.500 2.267 2.240 2.340 . 0 0 "[ . 1 . 2 . 3 ]" 1
1235 1 68 LEU HA 1 68 LEU HG 2.850 . 4.000 2.666 2.475 2.944 . 0 0 "[ . 1 . 2 . 3 ]" 1
1236 1 64 LEU QD 1 95 ILE HB 3.600 . 6.000 4.600 4.478 4.655 . 0 0 "[ . 1 . 2 . 3 ]" 1
1237 1 95 ILE MG 1 97 TYR H 3.600 . 6.000 4.768 4.709 4.842 . 0 0 "[ . 1 . 2 . 3 ]" 1
1238 1 64 LEU QD 1 67 TYR QD 3.600 . 6.000 2.366 2.267 2.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
1239 1 14 CYS HA 1 14 CYS HB2 2.850 . 4.000 2.982 2.970 2.987 . 0 0 "[ . 1 . 2 . 3 ]" 1
1240 1 14 CYS HB3 1 20 VAL MG1 3.100 . 4.500 3.840 3.784 3.911 . 0 0 "[ . 1 . 2 . 3 ]" 1
1241 1 39 LYS HA 1 57 ILE MD 3.600 . 6.000 4.449 4.293 4.651 . 0 0 "[ . 1 . 2 . 3 ]" 1
1242 1 94 LEU QB 1 98 LEU MD1 3.600 . 6.000 3.735 3.649 3.876 . 0 0 "[ . 1 . 2 . 3 ]" 1
1243 1 99 LYS H 1 101 ALA MB 3.600 . 6.000 4.365 4.196 4.679 . 0 0 "[ . 1 . 2 . 3 ]" 1
1244 1 36 PHE HE1 1 102 THR HB 2.850 . 4.000 4.022 3.697 4.107 0.107 2 0 "[ . 1 . 2 . 3 ]" 1
1245 1 81 ILE HG12 1 81 ILE MG 2.600 . 3.500 2.166 2.105 2.267 . 0 0 "[ . 1 . 2 . 3 ]" 1
1246 1 28 THR MG 1 29 GLY QA 3.600 . 6.000 4.067 3.888 4.159 . 0 0 "[ . 1 . 2 . 3 ]" 1
1247 1 97 TYR HA 1 98 LEU HA 3.350 . 5.500 4.851 4.825 4.893 . 0 0 "[ . 1 . 2 . 3 ]" 1
1248 1 78 THR MG 1 80 MET H 3.600 . 6.000 3.269 3.154 3.452 . 0 0 "[ . 1 . 2 . 3 ]" 1
1249 1 4 GLU H 1 5 LYS QB 3.350 . 5.500 4.574 4.441 4.669 . 0 0 "[ . 1 . 2 . 3 ]" 1
1250 1 35 LEU MD2 1 36 PHE HE1 3.600 . 6.000 3.597 3.359 4.359 . 0 0 "[ . 1 . 2 . 3 ]" 1
1251 1 3 VAL HA 1 6 GLY HA2 3.350 . 5.500 4.939 4.796 5.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
1252 1 64 LEU QD 1 99 LYS QG 3.350 . 5.500 4.049 3.960 4.110 . 0 0 "[ . 1 . 2 . 3 ]" 1
1253 1 95 ILE MG 1 96 ALA MB 3.850 . 6.000 4.063 4.018 4.130 . 0 0 "[ . 1 . 2 . 3 ]" 1
1254 1 19 THR HB 1 20 VAL MG1 3.600 . 6.000 4.705 4.548 4.827 . 0 0 "[ . 1 . 2 . 3 ]" 1
1255 1 14 CYS HA 1 14 CYS HB3 2.350 . 3.000 2.313 2.291 2.324 . 0 0 "[ . 1 . 2 . 3 ]" 1
1256 1 8 LYS QD 1 9 ILE MG 3.600 . 6.000 4.008 3.946 4.169 . 0 0 "[ . 1 . 2 . 3 ]" 1
1257 1 16 GLN HA 1 16 GLN HG2 2.850 . 4.000 2.383 2.284 2.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
1258 1 53 LYS QG 1 54 ASN HA 3.350 . 5.500 3.418 3.081 4.916 . 0 0 "[ . 1 . 2 . 3 ]" 1
1259 1 62 GLU HA 1 62 GLU QB 2.350 . 3.000 2.319 2.177 2.413 . 0 0 "[ . 1 . 2 . 3 ]" 1
1260 1 30 PRO HA 1 30 PRO HB3 2.350 . 3.000 2.309 2.301 2.319 . 0 0 "[ . 1 . 2 . 3 ]" 1
1261 1 20 VAL MG2 1 21 GLU QB 3.350 . 5.500 3.335 3.220 3.622 . 0 0 "[ . 1 . 2 . 3 ]" 1
1262 1 88 LYS QB 1 89 THR MG 3.350 . 5.500 3.165 2.996 3.386 . 0 0 "[ . 1 . 2 . 3 ]" 1
1263 1 100 LYS H 1 101 ALA HA 3.350 . 5.500 5.115 5.037 5.204 . 0 0 "[ . 1 . 2 . 3 ]" 1
1264 1 17 CYS HB3 1 28 THR HB 2.850 . 4.000 2.347 2.281 2.577 . 0 0 "[ . 1 . 2 . 3 ]" 1
1265 1 91 ARG HA 1 92 GLU HA 3.350 . 5.500 4.823 4.807 4.853 . 0 0 "[ . 1 . 2 . 3 ]" 1
1266 1 36 PHE HB2 1 36 PHE HD2 2.850 . 4.000 3.641 3.632 3.667 . 0 0 "[ . 1 . 2 . 3 ]" 1
1267 1 26 HIS HD2 1 45 GLY HA2 3.350 . 5.500 4.520 2.566 5.513 0.013 20 0 "[ . 1 . 2 . 3 ]" 1
1268 1 20 VAL HA 1 32 LEU H 2.850 . 4.000 2.691 2.478 2.971 . 0 0 "[ . 1 . 2 . 3 ]" 1
1269 1 3 VAL HA 1 96 ALA H 3.350 . 5.500 4.986 4.744 5.242 . 0 0 "[ . 1 . 2 . 3 ]" 1
1270 1 20 VAL HA 1 21 GLU H 2.850 . 4.000 2.955 2.894 3.080 . 0 0 "[ . 1 . 2 . 3 ]" 1
1271 1 54 ASN HA 1 54 ASN HD22 3.350 . 5.500 4.852 4.846 4.857 . 0 0 "[ . 1 . 2 . 3 ]" 1
1272 1 37 GLY HA3 1 58 THR MG 3.100 . 4.500 3.892 3.846 3.920 . 0 0 "[ . 1 . 2 . 3 ]" 1
1273 1 98 LEU MD2 1 102 THR H 3.600 . 6.000 4.823 4.767 4.901 . 0 0 "[ . 1 . 2 . 3 ]" 1
1274 1 1 GLY HA2 1 96 ALA MB 3.100 . 4.500 3.236 2.231 3.746 . 0 0 "[ . 1 . 2 . 3 ]" 1
1275 1 11 VAL QG 1 15 ALA MB 3.850 . 6.000 3.166 3.098 3.207 . 0 0 "[ . 1 . 2 . 3 ]" 1
1276 1 93 ASP H 1 93 ASP HA 2.350 . 3.000 2.809 2.803 2.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
1277 1 63 THR HA 1 63 THR MG 2.600 . 3.500 2.398 2.290 2.430 . 0 0 "[ . 1 . 2 . 3 ]" 1
1278 1 85 ILE H 1 85 ILE HB 3.350 . 5.500 2.390 2.308 2.668 . 0 0 "[ . 1 . 2 . 3 ]" 1
1279 1 40 THR MG 1 57 ILE H 2.600 . 3.500 2.682 2.378 2.773 . 0 0 "[ . 1 . 2 . 3 ]" 1
1280 1 58 THR MG 1 59 TRP HD1 3.600 . 6.000 4.865 4.247 4.969 . 0 0 "[ . 1 . 2 . 3 ]" 1
1281 1 40 THR HA 1 40 THR MG 2.600 . 3.500 2.280 2.217 2.321 . 0 0 "[ . 1 . 2 . 3 ]" 1
1282 1 96 ALA HA 1 99 LYS QD 3.350 . 5.500 3.576 2.330 4.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
1283 1 68 LEU QD 1 98 LEU HG 3.600 . 6.000 4.610 4.513 4.702 . 0 0 "[ . 1 . 2 . 3 ]" 1
1284 1 20 VAL HA 1 20 VAL MG1 3.100 . 4.500 2.383 2.331 2.437 . 0 0 "[ . 1 . 2 . 3 ]" 1
1285 1 88 LYS H 1 89 THR MG 3.600 . 6.000 4.159 4.077 4.311 . 0 0 "[ . 1 . 2 . 3 ]" 1
1286 1 28 THR HA 1 29 GLY H 2.850 . 4.000 2.964 2.956 2.979 . 0 0 "[ . 1 . 2 . 3 ]" 1
1287 1 82 PHE HA 1 82 PHE QD 3.350 . 5.500 2.516 2.266 2.924 . 0 0 "[ . 1 . 2 . 3 ]" 1
1288 1 100 LYS HA 1 100 LYS QB 2.350 . 3.000 2.404 2.331 2.454 . 0 0 "[ . 1 . 2 . 3 ]" 1
1289 1 65 MET HA 1 68 LEU QD 3.600 . 6.000 2.899 2.662 3.099 . 0 0 "[ . 1 . 2 . 3 ]" 1
1290 1 93 ASP HA 1 96 ALA H 2.850 . 4.000 3.236 3.180 3.328 . 0 0 "[ . 1 . 2 . 3 ]" 1
1291 1 9 ILE MD 1 91 ARG H 3.600 . 6.000 4.985 4.776 5.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
1292 1 24 GLY HA2 1 25 LYS HA 3.350 . 5.500 4.645 4.423 4.672 . 0 0 "[ . 1 . 2 . 3 ]" 1
1293 1 8 LYS H 1 11 VAL QG 3.600 . 6.000 3.886 3.828 3.914 . 0 0 "[ . 1 . 2 . 3 ]" 1
1294 1 35 LEU MD1 1 59 TRP HD1 3.600 . 6.000 3.841 2.680 4.052 . 0 0 "[ . 1 . 2 . 3 ]" 1
1295 1 97 TYR HA 1 97 TYR HD1 3.350 . 5.500 2.746 2.641 2.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
1296 1 32 LEU HB2 1 35 LEU QB 3.350 . 5.500 3.471 3.284 3.638 . 0 0 "[ . 1 . 2 . 3 ]" 1
1297 1 95 ILE HA 1 95 ILE MD 3.600 . 4.500 3.735 3.698 3.782 . 0 0 "[ . 1 . 2 . 3 ]" 1
1298 1 97 TYR HA 1 97 TYR HB3 2.350 . 3.000 3.024 3.020 3.029 0.029 10 0 "[ . 1 . 2 . 3 ]" 1
1299 1 40 THR HB 1 59 TRP HE1 3.350 . 5.500 3.533 3.366 4.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
1300 1 65 MET HA 1 95 ILE MD 3.100 . 3.500 2.358 2.277 2.411 . 0 0 "[ . 1 . 2 . 3 ]" 1
1301 1 9 ILE MG 1 94 LEU H 3.600 . 6.000 4.669 4.375 4.780 . 0 0 "[ . 1 . 2 . 3 ]" 1
1302 1 81 ILE HB 1 81 ILE MD 2.600 . 3.500 2.197 2.162 2.265 . 0 0 "[ . 1 . 2 . 3 ]" 1
1303 1 50 ASP HA 1 53 LYS QB 2.350 . 3.000 2.216 2.073 2.362 . 0 0 "[ . 1 . 2 . 3 ]" 1
1304 1 20 VAL MG2 1 98 LEU MD2 3.350 . 5.500 3.207 3.014 3.327 . 0 0 "[ . 1 . 2 . 3 ]" 1
1305 1 72 LYS QB 1 72 LYS QE 3.350 . 5.500 2.181 2.037 2.278 . 0 0 "[ . 1 . 2 . 3 ]" 1
1306 1 40 THR HA 1 41 GLY HA2 3.350 . 5.500 4.395 4.378 4.420 . 0 0 "[ . 1 . 2 . 3 ]" 1
1307 1 47 THR HA 1 47 THR HB 2.350 . 3.000 2.981 2.309 3.027 0.027 19 0 "[ . 1 . 2 . 3 ]" 1
1308 1 40 THR MG 1 75 ILE MD 3.850 . 6.000 1.931 1.851 2.078 . 0 0 "[ . 1 . 2 . 3 ]" 1
1309 1 85 ILE MG 1 90 GLU H 3.350 . 5.500 3.639 3.558 3.709 . 0 0 "[ . 1 . 2 . 3 ]" 1
1310 1 31 ASN HA 1 31 ASN HB3 2.850 . 4.000 2.596 2.452 3.007 . 0 0 "[ . 1 . 2 . 3 ]" 1
1311 1 71 PRO HG2 1 84 GLY HA2 2.850 . 4.000 3.929 3.672 4.102 0.102 5 0 "[ . 1 . 2 . 3 ]" 1
1312 1 89 THR HB 1 90 GLU QG 3.350 . 5.500 4.616 4.497 4.862 . 0 0 "[ . 1 . 2 . 3 ]" 1
1313 1 7 LYS HA 1 97 TYR HD2 3.350 . 5.500 3.698 3.529 3.864 . 0 0 "[ . 1 . 2 . 3 ]" 1
1314 1 95 ILE MG 1 99 LYS QG 3.600 . 6.000 2.530 2.430 2.702 . 0 0 "[ . 1 . 2 . 3 ]" 1
1315 1 22 LYS HA 1 23 GLY HA3 3.350 . 5.500 4.478 4.401 4.537 . 0 0 "[ . 1 . 2 . 3 ]" 1
1316 1 19 THR MG 1 27 LYS H 3.600 . 6.000 3.950 3.464 4.696 . 0 0 "[ . 1 . 2 . 3 ]" 1
1317 1 20 VAL H 1 21 GLU QG 3.350 . 5.500 4.478 3.934 4.658 . 0 0 "[ . 1 . 2 . 3 ]" 1
1318 1 43 ALA MB 1 44 PRO QD 3.350 . 5.500 2.971 2.660 3.081 . 0 0 "[ . 1 . 2 . 3 ]" 1
1319 1 8 LYS QD 1 9 ILE MD 3.350 . 5.500 3.869 3.600 3.911 . 0 0 "[ . 1 . 2 . 3 ]" 1
1320 1 61 GLU QG 1 95 ILE MD 3.350 . 5.500 3.286 3.101 3.530 . 0 0 "[ . 1 . 2 . 3 ]" 1
1321 1 36 PHE HA 1 36 PHE HB2 2.850 . 4.000 3.022 2.988 3.025 . 0 0 "[ . 1 . 2 . 3 ]" 1
1322 1 51 ALA HA 1 75 ILE MG 3.100 . 4.500 3.804 3.732 3.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
1323 1 9 ILE MG 1 90 GLU QG 3.600 . 6.000 4.032 3.877 4.078 . 0 0 "[ . 1 . 2 . 3 ]" 1
1324 1 12 GLN HA 1 12 GLN HG2 2.850 . 4.000 3.655 3.566 3.691 . 0 0 "[ . 1 . 2 . 3 ]" 1
1325 1 2 ASP HB2 1 5 LYS H 2.850 . 4.000 3.076 2.788 3.459 . 0 0 "[ . 1 . 2 . 3 ]" 1
1326 1 85 ILE MD 1 90 GLU QG 3.350 . 5.500 3.830 3.763 3.983 . 0 0 "[ . 1 . 2 . 3 ]" 1
1327 1 99 LYS HA 1 103 ASN H 3.350 . 5.500 4.633 4.327 4.912 . 0 0 "[ . 1 . 2 . 3 ]" 1
1328 1 19 THR MG 1 21 GLU H 3.600 . 6.000 3.534 3.106 3.934 . 0 0 "[ . 1 . 2 . 3 ]" 1
1329 1 19 THR HB 1 31 ASN HA 3.350 . 5.500 4.088 3.690 4.525 . 0 0 "[ . 1 . 2 . 3 ]" 1
1330 1 24 GLY HA3 1 25 LYS QG 3.350 . 5.500 3.897 3.557 4.339 . 0 0 "[ . 1 . 2 . 3 ]" 1
1331 1 85 ILE MD 1 91 ARG HA 3.600 . 6.000 3.170 2.266 3.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
1332 1 95 ILE MG 1 99 LYS HA 3.600 . 6.000 4.857 4.795 4.961 . 0 0 "[ . 1 . 2 . 3 ]" 1
1333 1 64 LEU HG 1 67 TYR HB2 3.350 . 5.500 5.339 4.985 5.514 0.014 8 0 "[ . 1 . 2 . 3 ]" 1
1334 1 72 LYS HA 1 78 THR HB 3.350 . 5.500 4.836 4.625 5.214 . 0 0 "[ . 1 . 2 . 3 ]" 1
1335 1 39 LYS QB 1 58 THR MG 3.600 . 6.000 4.359 4.147 4.461 . 0 0 "[ . 1 . 2 . 3 ]" 1
1336 1 51 ALA MB 1 78 THR HB 3.600 . 6.000 3.812 3.521 4.053 . 0 0 "[ . 1 . 2 . 3 ]" 1
1337 1 28 THR MG 1 29 GLY H 3.600 . 6.000 4.226 4.145 4.279 . 0 0 "[ . 1 . 2 . 3 ]" 1
1338 1 36 PHE HD2 1 95 ILE MG 3.100 . 4.500 3.924 3.833 3.955 . 0 0 "[ . 1 . 2 . 3 ]" 1
1339 1 78 THR HA 1 78 THR HB 2.850 . 4.000 2.489 2.441 2.517 . 0 0 "[ . 1 . 2 . 3 ]" 1
1340 1 10 PHE HD1 1 15 ALA MB 3.600 . 6.000 3.645 3.510 4.792 . 0 0 "[ . 1 . 2 . 3 ]" 1
1341 1 84 GLY H 1 84 GLY HA2 2.850 . 4.000 2.843 2.793 2.899 . 0 0 "[ . 1 . 2 . 3 ]" 1
1342 1 35 LEU MD2 1 36 PHE HD1 3.600 . 6.000 3.983 3.801 4.704 . 0 0 "[ . 1 . 2 . 3 ]" 1
1343 1 39 LYS H 1 39 LYS HA 2.850 . 4.000 2.861 2.821 2.932 . 0 0 "[ . 1 . 2 . 3 ]" 1
1344 1 36 PHE QD 1 99 LYS HA 3.350 . 5.500 3.530 3.288 4.116 . 0 0 "[ . 1 . 2 . 3 ]" 1
1345 1 20 VAL MG1 1 32 LEU HB2 3.100 . 4.500 2.312 2.243 2.453 . 0 0 "[ . 1 . 2 . 3 ]" 1
1346 1 65 MET ME 1 91 ARG H 3.600 . 6.000 4.519 4.382 4.642 . 0 0 "[ . 1 . 2 . 3 ]" 1
1347 1 56 GLY HA2 1 57 ILE MG 3.600 . 6.000 3.851 3.766 3.960 . 0 0 "[ . 1 . 2 . 3 ]" 1
1348 1 7 LYS QG 1 97 TYR HD2 3.350 . 5.500 4.887 4.736 4.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
1349 1 64 LEU QD 1 67 TYR HB3 3.600 . 6.000 2.902 2.545 3.160 . 0 0 "[ . 1 . 2 . 3 ]" 1
1350 1 49 THR MG 1 78 THR H 3.600 . 6.000 4.406 4.123 4.579 . 0 0 "[ . 1 . 2 . 3 ]" 1
1351 1 60 LYS QE 1 63 THR MG 3.600 . 6.000 1.981 1.913 2.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
1352 1 17 CYS HA 1 28 THR HB 2.850 . 4.000 2.650 2.482 2.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
1353 1 76 PRO HA 1 78 THR HB 3.350 . 5.500 5.306 4.935 5.522 0.022 19 0 "[ . 1 . 2 . 3 ]" 1
1354 1 5 LYS HA 1 6 GLY H 2.850 . 4.000 3.420 3.397 3.439 . 0 0 "[ . 1 . 2 . 3 ]" 1
1355 1 68 LEU HB3 1 69 GLU H 3.350 . 5.500 3.738 3.622 4.013 . 0 0 "[ . 1 . 2 . 3 ]" 1
1356 1 9 ILE MD 1 93 ASP QB 2.850 . 4.000 2.863 2.779 2.927 . 0 0 "[ . 1 . 2 . 3 ]" 1
1357 1 65 MET HA 1 68 LEU HA 3.350 . 5.500 5.220 5.163 5.306 . 0 0 "[ . 1 . 2 . 3 ]" 1
1358 1 3 VAL HA 1 96 ALA MB 3.600 . 6.000 2.713 2.476 3.026 . 0 0 "[ . 1 . 2 . 3 ]" 1
1359 1 65 MET HA 1 65 MET HG2 2.350 . 3.000 2.543 2.525 2.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
1360 1 38 ARG HA 1 38 ARG QG 2.350 . 3.000 2.145 2.108 2.437 . 0 0 "[ . 1 . 2 . 3 ]" 1
1361 1 58 THR HB 1 59 TRP H 3.350 . 5.500 4.113 4.006 4.238 . 0 0 "[ . 1 . 2 . 3 ]" 1
1362 1 64 LEU QB 1 95 ILE MD 2.850 . 4.000 2.133 1.968 2.190 . 0 0 "[ . 1 . 2 . 3 ]" 1
1363 1 48 TYR HB3 1 48 TYR HD2 3.350 . 5.500 3.479 2.401 3.682 . 0 0 "[ . 1 . 2 . 3 ]" 1
1364 1 27 LYS H 1 30 PRO HA 3.350 . 5.500 5.192 4.749 5.528 0.028 19 0 "[ . 1 . 2 . 3 ]" 1
1365 1 68 LEU QD 1 95 ILE HA 3.600 . 6.000 3.537 3.489 3.577 . 0 0 "[ . 1 . 2 . 3 ]" 1
1366 1 21 GLU QG 1 24 GLY HA2 3.350 . 5.500 2.968 2.525 3.759 . 0 0 "[ . 1 . 2 . 3 ]" 1
1367 1 22 LYS HA 1 22 LYS QG 2.850 . 4.000 2.375 2.166 3.405 . 0 0 "[ . 1 . 2 . 3 ]" 1
1368 1 94 LEU QD 1 98 LEU HA 3.600 . 6.000 4.745 4.705 4.804 . 0 0 "[ . 1 . 2 . 3 ]" 1
1369 1 8 LYS QB 1 8 LYS QE 3.350 . 5.500 2.229 2.157 2.280 . 0 0 "[ . 1 . 2 . 3 ]" 1
1370 1 21 GLU HA 1 33 HIS HD2 3.350 . 5.500 4.051 3.654 4.648 . 0 0 "[ . 1 . 2 . 3 ]" 1
1371 1 74 TYR HB2 1 74 TYR HD1 3.350 . 5.500 2.712 2.488 2.742 . 0 0 "[ . 1 . 2 . 3 ]" 1
1372 1 101 ALA HA 1 102 THR HA 3.350 . 5.500 4.656 4.625 4.675 . 0 0 "[ . 1 . 2 . 3 ]" 1
1373 1 8 LYS HA 1 11 VAL QG 2.600 . 3.500 2.121 1.985 2.145 . 0 0 "[ . 1 . 2 . 3 ]" 1
1374 1 89 THR HA 1 92 GLU HA 3.350 . 5.500 5.074 4.989 5.130 . 0 0 "[ . 1 . 2 . 3 ]" 1
1375 1 9 ILE HB 1 9 ILE MD 3.100 . 4.500 2.268 2.227 2.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
1376 1 9 ILE HB 1 85 ILE MD 3.600 . 6.000 4.424 4.261 4.596 . 0 0 "[ . 1 . 2 . 3 ]" 1
1377 1 60 LYS QG 1 63 THR H 3.350 . 5.500 4.625 4.552 4.658 . 0 0 "[ . 1 . 2 . 3 ]" 1
1378 1 10 PHE H 1 11 VAL QG 3.600 . 6.000 3.295 3.242 3.383 . 0 0 "[ . 1 . 2 . 3 ]" 1
1379 1 57 ILE HA 1 57 ILE MG 3.100 . 3.500 2.353 2.292 2.393 . 0 0 "[ . 1 . 2 . 3 ]" 1
1380 1 43 ALA MB 1 44 PRO QG 3.600 . 6.000 4.440 4.087 4.544 . 0 0 "[ . 1 . 2 . 3 ]" 1
1381 1 95 ILE MD 1 95 ILE MG 3.350 . 5.500 2.333 1.952 2.543 . 0 0 "[ . 1 . 2 . 3 ]" 1
1382 1 9 ILE HA 1 12 GLN QB 3.350 . 5.500 4.291 4.189 4.423 . 0 0 "[ . 1 . 2 . 3 ]" 1
1383 1 7 LYS HA 1 11 VAL QG 3.600 . 6.000 3.587 3.530 3.661 . 0 0 "[ . 1 . 2 . 3 ]" 1
1384 1 19 THR MG 1 21 GLU QG 3.350 . 5.500 2.359 2.026 2.848 . 0 0 "[ . 1 . 2 . 3 ]" 1
1385 1 65 MET HG2 1 95 ILE MG 3.600 . 6.000 4.491 4.367 4.585 . 0 0 "[ . 1 . 2 . 3 ]" 1
1386 1 94 LEU QD 1 95 ILE H 3.350 . 5.500 3.885 3.826 3.930 . 0 0 "[ . 1 . 2 . 3 ]" 1
1387 1 20 VAL HA 1 102 THR MG 3.600 . 6.000 2.515 2.311 2.803 . 0 0 "[ . 1 . 2 . 3 ]" 1
1388 1 41 GLY HA3 1 52 ASN HD21 3.350 . 5.500 3.997 3.634 4.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
1389 1 20 VAL MG2 1 21 GLU H 3.100 . 4.500 3.541 3.352 3.631 . 0 0 "[ . 1 . 2 . 3 ]" 1
1390 1 32 LEU HB2 1 35 LEU H 3.350 . 5.500 4.806 4.488 4.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
1391 1 74 TYR H 1 76 PRO HD3 2.850 . 4.000 3.834 3.716 3.887 . 0 0 "[ . 1 . 2 . 3 ]" 1
1392 1 90 GLU HA 1 94 LEU H 2.850 . 4.000 3.710 3.603 3.903 . 0 0 "[ . 1 . 2 . 3 ]" 1
1393 1 20 VAL MG1 1 98 LEU MD1 3.850 . 6.000 4.058 4.014 4.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
1394 1 50 ASP H 1 51 ALA HA 3.350 . 5.500 5.394 5.181 5.472 . 0 0 "[ . 1 . 2 . 3 ]" 1
1395 1 7 LYS HA 1 7 LYS QD 3.350 . 5.500 4.008 3.477 4.152 . 0 0 "[ . 1 . 2 . 3 ]" 1
1396 1 9 ILE HA 1 11 VAL H 3.350 . 5.500 4.914 4.883 4.945 . 0 0 "[ . 1 . 2 . 3 ]" 1
1397 1 32 LEU HA 1 35 LEU MD1 3.600 . 6.000 2.751 2.578 2.928 . 0 0 "[ . 1 . 2 . 3 ]" 1
1398 1 33 HIS HD2 1 102 THR HA 2.850 . 4.000 3.448 3.098 4.003 0.003 10 0 "[ . 1 . 2 . 3 ]" 1
1399 1 68 LEU QB 1 94 LEU QD 3.350 . 5.500 3.445 3.331 3.521 . 0 0 "[ . 1 . 2 . 3 ]" 1
1400 1 70 ASN HA 1 71 PRO HA 3.350 . 5.500 4.716 4.667 4.778 . 0 0 "[ . 1 . 2 . 3 ]" 1
1401 1 64 LEU QD 1 95 ILE HA 3.600 . 6.000 3.667 3.547 3.729 . 0 0 "[ . 1 . 2 . 3 ]" 1
1402 1 64 LEU QD 1 95 ILE MG 3.850 . 6.000 2.708 2.494 2.820 . 0 0 "[ . 1 . 2 . 3 ]" 1
1403 1 22 LYS HA 1 22 LYS QD 2.850 . 4.000 2.978 2.112 3.888 . 0 0 "[ . 1 . 2 . 3 ]" 1
1404 1 34 GLY HA2 1 103 ASN HD22 2.850 . 4.000 3.927 3.324 4.038 0.038 29 0 "[ . 1 . 2 . 3 ]" 1
1405 1 52 ASN QB 1 53 LYS HA 3.350 . 5.500 3.965 3.934 4.007 . 0 0 "[ . 1 . 2 . 3 ]" 1
1406 1 47 THR H 1 47 THR MG 3.600 . 6.000 3.636 1.773 3.772 . 0 0 "[ . 1 . 2 . 3 ]" 1
1407 1 78 THR MG 1 81 ILE MD 3.850 . 6.000 3.821 3.620 3.944 . 0 0 "[ . 1 . 2 . 3 ]" 1
1408 1 57 ILE HA 1 57 ILE MD 3.350 . 5.500 3.562 3.469 3.666 . 0 0 "[ . 1 . 2 . 3 ]" 1
1409 1 16 GLN HE21 1 16 GLN HG2 3.350 . 5.500 2.951 2.246 3.622 . 0 0 "[ . 1 . 2 . 3 ]" 1
1410 1 53 LYS HA 1 53 LYS QG 2.850 . 4.000 2.777 2.156 3.139 . 0 0 "[ . 1 . 2 . 3 ]" 1
1411 1 31 ASN H 1 43 ALA MB 3.600 . 6.000 3.603 3.141 3.956 . 0 0 "[ . 1 . 2 . 3 ]" 1
1412 1 13 LYS QE 1 83 ALA MB 3.350 . 5.500 3.667 3.195 4.009 . 0 0 "[ . 1 . 2 . 3 ]" 1
1413 1 102 THR HA 1 103 ASN HA 3.350 . 5.500 4.638 4.568 4.709 . 0 0 "[ . 1 . 2 . 3 ]" 1
1414 1 58 THR H 1 60 LYS QG 3.350 . 5.500 4.476 4.356 4.628 . 0 0 "[ . 1 . 2 . 3 ]" 1
1415 1 42 GLN HA 1 43 ALA HA 3.350 . 5.500 4.774 4.689 4.850 . 0 0 "[ . 1 . 2 . 3 ]" 1
1416 1 9 ILE MD 1 90 GLU HA 2.600 . 3.500 2.521 2.354 2.591 . 0 0 "[ . 1 . 2 . 3 ]" 1
1417 1 11 VAL H 1 15 ALA MB 3.600 . 6.000 4.084 4.040 4.129 . 0 0 "[ . 1 . 2 . 3 ]" 1
1418 1 57 ILE MD 1 59 TRP HA 3.600 . 6.000 3.130 2.998 3.234 . 0 0 "[ . 1 . 2 . 3 ]" 1
1419 1 20 VAL MG1 1 32 LEU MD2 3.600 . 6.000 3.666 3.501 3.796 . 0 0 "[ . 1 . 2 . 3 ]" 1
1420 1 10 PHE HD2 1 20 VAL MG1 3.600 . 6.000 3.414 3.069 6.074 0.074 4 0 "[ . 1 . 2 . 3 ]" 1
1421 1 58 THR HA 1 58 THR HB 2.850 . 4.000 3.018 2.992 3.026 . 0 0 "[ . 1 . 2 . 3 ]" 1
1422 1 71 PRO HB3 1 71 PRO HD2 3.350 . 5.500 3.973 3.935 4.014 . 0 0 "[ . 1 . 2 . 3 ]" 1
1423 1 61 GLU HA 1 61 GLU QG 2.850 . 4.000 2.320 2.254 2.532 . 0 0 "[ . 1 . 2 . 3 ]" 1
1424 1 60 LYS QG 1 63 THR HB 3.350 . 5.500 4.635 4.514 4.698 . 0 0 "[ . 1 . 2 . 3 ]" 1
1425 1 100 LYS QB 1 100 LYS QE 3.350 . 5.500 2.932 2.076 3.852 . 0 0 "[ . 1 . 2 . 3 ]" 1
1426 1 21 GLU H 1 21 GLU HA 2.850 . 4.000 2.957 2.945 2.964 . 0 0 "[ . 1 . 2 . 3 ]" 1
1427 1 41 GLY HA2 1 42 GLN HA 3.350 . 5.500 4.490 4.411 4.528 . 0 0 "[ . 1 . 2 . 3 ]" 1
1428 1 70 ASN HB2 1 71 PRO HD2 3.350 . 5.500 4.779 4.363 5.081 . 0 0 "[ . 1 . 2 . 3 ]" 1
1429 1 99 LYS HA 1 99 LYS QG 2.850 . 4.000 2.216 2.112 2.364 . 0 0 "[ . 1 . 2 . 3 ]" 1
1430 1 76 PRO QB 1 76 PRO HD3 2.850 . 4.000 3.518 3.513 3.522 . 0 0 "[ . 1 . 2 . 3 ]" 1
1431 1 2 ASP HB2 1 93 ASP HA 3.350 . 5.500 4.090 3.582 4.465 . 0 0 "[ . 1 . 2 . 3 ]" 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 55
_Distance_constraint_stats_list.Viol_count 962
_Distance_constraint_stats_list.Viol_total 3467.319
_Distance_constraint_stats_list.Viol_max 1.772
_Distance_constraint_stats_list.Viol_rms 0.2123
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0616
_Distance_constraint_stats_list.Viol_average_violations_only 0.1126
_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 2 ASP 2.272 0.356 2 0 "[ . 1 . 2 . 3 ]"
1 3 VAL 0.923 0.056 17 0 "[ . 1 . 2 . 3 ]"
1 4 GLU 1.901 0.084 5 0 "[ . 1 . 2 . 3 ]"
1 5 LYS 0.014 0.014 10 0 "[ . 1 . 2 . 3 ]"
1 6 GLY 2.657 0.097 10 0 "[ . 1 . 2 . 3 ]"
1 7 LYS 1.673 0.074 32 0 "[ . 1 . 2 . 3 ]"
1 8 LYS 7.791 0.233 10 0 "[ . 1 . 2 . 3 ]"
1 9 ILE 0.022 0.014 10 0 "[ . 1 . 2 . 3 ]"
1 10 PHE 5.596 0.109 20 0 "[ . 1 . 2 . 3 ]"
1 11 VAL 0.751 0.074 32 0 "[ . 1 . 2 . 3 ]"
1 12 GLN 5.890 0.233 10 0 "[ . 1 . 2 . 3 ]"
1 13 LYS 0.008 0.008 32 0 "[ . 1 . 2 . 3 ]"
1 14 CYS 2.081 0.087 1 0 "[ . 1 . 2 . 3 ]"
1 15 ALA 4.167 0.121 4 0 "[ . 1 . 2 . 3 ]"
1 17 CYS 0.055 0.023 14 0 "[ . 1 . 2 . 3 ]"
1 18 HIS 2.069 0.121 4 0 "[ . 1 . 2 . 3 ]"
1 19 THR 0.183 0.056 29 0 "[ . 1 . 2 . 3 ]"
1 21 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 24 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 25 LYS 0.183 0.056 29 0 "[ . 1 . 2 . 3 ]"
1 30 PRO 0.163 0.030 6 0 "[ . 1 . 2 . 3 ]"
1 32 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 34 GLY 1.041 0.100 3 0 "[ . 1 . 2 . 3 ]"
1 35 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 37 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 38 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 40 THR 1.129 0.086 12 0 "[ . 1 . 2 . 3 ]"
1 49 THR 0.805 0.059 19 0 "[ . 1 . 2 . 3 ]"
1 50 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 52 ASN 3.051 0.133 25 0 "[ . 1 . 2 . 3 ]"
1 53 LYS 0.563 0.059 19 0 "[ . 1 . 2 . 3 ]"
1 54 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 55 LYS 2.810 0.133 25 0 "[ . 1 . 2 . 3 ]"
1 56 GLY 0.897 0.086 12 0 "[ . 1 . 2 . 3 ]"
1 57 ILE 0.232 0.049 19 0 "[ . 1 . 2 . 3 ]"
1 59 TRP 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 60 LYS 1.453 0.079 4 0 "[ . 1 . 2 . 3 ]"
1 61 GLU 4.122 0.145 23 0 "[ . 1 . 2 . 3 ]"
1 62 GLU 0.141 0.034 31 0 "[ . 1 . 2 . 3 ]"
1 63 THR 1.911 0.079 4 0 "[ . 1 . 2 . 3 ]"
1 64 LEU 2.484 0.110 31 0 "[ . 1 . 2 . 3 ]"
1 65 MET 4.127 0.145 23 0 "[ . 1 . 2 . 3 ]"
1 66 GLU 0.141 0.034 31 0 "[ . 1 . 2 . 3 ]"
1 67 TYR 2.877 0.124 31 0 "[ . 1 . 2 . 3 ]"
1 68 LEU 2.726 0.110 31 0 "[ . 1 . 2 . 3 ]"
1 69 GLU 0.005 0.005 9 0 "[ . 1 . 2 . 3 ]"
1 70 ASN 2.339 0.124 31 0 "[ . 1 . 2 . 3 ]"
1 71 PRO 0.784 0.081 5 0 "[ . 1 . 2 . 3 ]"
1 74 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 75 ILE 0.784 0.081 5 0 "[ . 1 . 2 . 3 ]"
1 78 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 80 MET 0.060 0.028 31 0 "[ . 1 . 2 . 3 ]"
1 85 ILE 0.262 0.048 21 0 "[ . 1 . 2 . 3 ]"
1 86 LYS 50.623 1.772 10 32 [****-****+**********************]
1 87 LYS 3.117 0.151 20 0 "[ . 1 . 2 . 3 ]"
1 88 LYS 2.437 0.109 12 0 "[ . 1 . 2 . 3 ]"
1 89 THR 2.486 0.098 13 0 "[ . 1 . 2 . 3 ]"
1 90 GLU 50.623 1.772 10 32 [****-****+**********************]
1 91 ARG 7.256 0.159 20 0 "[ . 1 . 2 . 3 ]"
1 92 GLU 3.088 0.109 12 0 "[ . 1 . 2 . 3 ]"
1 93 ASP 3.453 0.356 2 0 "[ . 1 . 2 . 3 ]"
1 94 LEU 0.055 0.039 12 0 "[ . 1 . 2 . 3 ]"
1 95 ILE 4.240 0.159 20 0 "[ . 1 . 2 . 3 ]"
1 96 ALA 3.332 0.131 27 0 "[ . 1 . 2 . 3 ]"
1 97 TYR 3.511 0.172 11 0 "[ . 1 . 2 . 3 ]"
1 98 LEU 1.054 0.085 5 0 "[ . 1 . 2 . 3 ]"
1 99 LYS 0.137 0.020 13 0 "[ . 1 . 2 . 3 ]"
1 100 LYS 2.646 0.131 27 0 "[ . 1 . 2 . 3 ]"
1 101 ALA 3.467 0.172 11 0 "[ . 1 . 2 . 3 ]"
1 102 THR 2.040 0.100 3 0 "[ . 1 . 2 . 3 ]"
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 2 ASP O 1 6 GLY H 2.000 . 2.300 1.858 1.830 1.880 0.070 32 0 "[ . 1 . 2 . 3 ]" 2
2 1 3 VAL O 1 7 LYS H 2.000 . 2.300 2.329 2.306 2.356 0.056 17 0 "[ . 1 . 2 . 3 ]" 2
3 1 4 GLU O 1 8 LYS H 2.000 . 2.300 2.359 2.323 2.384 0.084 5 0 "[ . 1 . 2 . 3 ]" 2
4 1 5 LYS O 1 9 ILE H 2.000 . 2.300 2.163 2.095 2.314 0.014 10 0 "[ . 1 . 2 . 3 ]" 2
5 1 6 GLY O 1 10 PHE H 2.000 . 2.300 2.341 2.310 2.397 0.097 10 0 "[ . 1 . 2 . 3 ]" 2
6 1 7 LYS O 1 11 VAL H 2.000 . 2.300 1.880 1.826 1.985 0.074 32 0 "[ . 1 . 2 . 3 ]" 2
7 1 8 LYS O 1 12 GLN H 2.000 . 2.300 2.484 2.455 2.533 0.233 10 0 "[ . 1 . 2 . 3 ]" 2
8 1 9 ILE O 1 13 LYS H 2.000 . 2.300 2.237 2.149 2.308 0.008 32 0 "[ . 1 . 2 . 3 ]" 2
9 1 10 PHE O 1 14 CYS H 2.000 . 2.300 2.363 2.332 2.387 0.087 1 0 "[ . 1 . 2 . 3 ]" 2
10 1 10 PHE O 1 15 ALA H 2.000 . 2.300 1.829 1.791 1.900 0.109 20 0 "[ . 1 . 2 . 3 ]" 2
11 1 98 LEU O 1 102 THR H 2.000 . 2.300 2.211 1.815 2.338 0.085 5 0 "[ . 1 . 2 . 3 ]" 2
12 1 97 TYR O 1 101 ALA H 2.000 . 2.300 1.792 1.728 1.855 0.172 11 0 "[ . 1 . 2 . 3 ]" 2
13 1 96 ALA O 1 100 LYS H 2.000 . 2.300 2.383 2.333 2.431 0.131 27 0 "[ . 1 . 2 . 3 ]" 2
14 1 95 ILE O 1 99 LYS H 2.000 . 2.300 2.245 2.035 2.320 0.020 13 0 "[ . 1 . 2 . 3 ]" 2
15 1 94 LEU O 1 98 LEU H 2.000 . 2.300 2.152 2.054 2.339 0.039 12 0 "[ . 1 . 2 . 3 ]" 2
16 1 93 ASP O 1 97 TYR H 2.000 . 2.300 2.236 2.097 2.319 0.019 24 0 "[ . 1 . 2 . 3 ]" 2
17 1 92 GLU O 1 96 ALA H 2.000 . 2.300 1.885 1.828 1.991 0.072 12 0 "[ . 1 . 2 . 3 ]" 2
18 1 91 ARG O 1 95 ILE H 2.000 . 2.300 1.772 1.741 1.803 0.159 20 0 "[ . 1 . 2 . 3 ]" 2
19 1 90 GLU O 1 94 LEU H 2.000 . 2.300 2.103 1.975 2.238 . 0 0 "[ . 1 . 2 . 3 ]" 2
20 1 89 THR O 1 93 ASP H 2.000 . 2.300 1.822 1.802 1.841 0.098 13 0 "[ . 1 . 2 . 3 ]" 2
21 1 88 LYS O 1 92 GLU H 2.000 . 2.300 1.825 1.791 1.881 0.109 12 0 "[ . 1 . 2 . 3 ]" 2
22 1 64 LEU O 1 68 LEU H 2.000 . 2.300 1.823 1.790 1.862 0.110 31 0 "[ . 1 . 2 . 3 ]" 2
23 1 63 THR O 1 67 TYR H 2.000 . 2.300 2.306 2.248 2.354 0.054 10 0 "[ . 1 . 2 . 3 ]" 2
24 1 62 GLU O 1 66 GLU H 2.000 . 2.300 2.247 2.139 2.334 0.034 31 0 "[ . 1 . 2 . 3 ]" 2
25 1 61 GLU O 1 65 MET H 2.000 . 2.300 2.429 2.411 2.445 0.145 23 0 "[ . 1 . 2 . 3 ]" 2
26 1 49 THR O 1 53 LYS H 2.000 . 2.300 1.899 1.841 2.160 0.059 19 0 "[ . 1 . 2 . 3 ]" 2
27 1 14 CYS O 1 17 CYS H 2.000 . 2.600 2.445 2.257 2.623 0.023 14 0 "[ . 1 . 2 . 3 ]" 2
28 1 15 ALA O 1 18 HIS H 2.000 . 2.600 2.660 2.602 2.721 0.121 4 0 "[ . 1 . 2 . 3 ]" 2
29 1 21 GLU O 1 24 GLY H 2.000 . 2.600 2.307 2.046 2.583 . 0 0 "[ . 1 . 2 . 3 ]" 2
30 1 32 LEU O 1 35 LEU H 2.000 . 2.600 2.310 2.053 2.469 . 0 0 "[ . 1 . 2 . 3 ]" 2
31 1 37 GLY H 1 59 TRP O 2.000 . 2.600 2.178 2.048 2.401 . 0 0 "[ . 1 . 2 . 3 ]" 2
32 1 40 THR H 1 57 ILE O 2.000 . 2.600 2.349 2.105 2.649 0.049 19 0 "[ . 1 . 2 . 3 ]" 2
33 1 50 ASP O 1 54 ASN H 2.000 . 2.600 1.970 1.876 2.279 . 0 0 "[ . 1 . 2 . 3 ]" 2
34 1 52 ASN O 1 55 LYS H 2.000 . 2.600 2.688 2.650 2.733 0.133 25 0 "[ . 1 . 2 . 3 ]" 2
35 1 38 ARG O 1 59 TRP H 2.000 . 2.600 2.071 1.827 2.211 . 0 0 "[ . 1 . 2 . 3 ]" 2
36 1 60 LYS O 1 64 LEU H 2.000 . 2.600 2.534 2.305 2.611 0.011 22 0 "[ . 1 . 2 . 3 ]" 2
37 1 65 MET O 1 69 GLU H 2.000 . 2.600 2.254 2.029 2.605 0.005 9 0 "[ . 1 . 2 . 3 ]" 2
38 1 70 ASN O 1 74 TYR H 2.000 . 2.600 2.132 1.973 2.407 . 0 0 "[ . 1 . 2 . 3 ]" 2
39 1 71 PRO O 1 75 ILE H 2.000 . 2.600 2.607 2.466 2.681 0.081 5 0 "[ . 1 . 2 . 3 ]" 2
40 1 75 ILE O 1 78 THR H 2.000 . 2.600 2.198 2.079 2.291 . 0 0 "[ . 1 . 2 . 3 ]" 2
41 1 68 LEU O 1 85 ILE H 2.000 . 2.600 1.839 1.752 2.288 0.048 21 0 "[ . 1 . 2 . 3 ]" 2
42 1 87 LYS O 1 91 ARG H 2.000 . 2.600 2.697 2.649 2.751 0.151 20 0 "[ . 1 . 2 . 3 ]" 2
43 1 2 ASP H 1 93 ASP OD1 2.000 . 2.600 2.406 1.911 2.956 0.356 2 0 "[ . 1 . 2 . 3 ]" 2
44 1 18 HIS HD1 1 30 PRO O 2.000 . 2.600 2.527 2.343 2.630 0.030 6 0 "[ . 1 . 2 . 3 ]" 2
45 1 49 THR OG1 1 52 ASN H 2.000 . 2.600 2.588 2.499 2.636 0.036 6 0 "[ . 1 . 2 . 3 ]" 2
46 1 98 LEU O 1 102 THR HG1 2.000 . 2.600 2.212 1.748 2.629 0.052 3 0 "[ . 1 . 2 . 3 ]" 2
47 1 34 GLY H 1 102 THR O 2.000 . 2.600 2.627 2.511 2.700 0.100 3 0 "[ . 1 . 2 . 3 ]" 2
48 1 67 TYR O 1 70 ASN H 2.000 . 2.600 2.673 2.621 2.724 0.124 31 0 "[ . 1 . 2 . 3 ]" 2
49 1 88 LYS O 1 91 ARG H 2.000 . 2.600 1.963 1.777 2.610 0.023 3 0 "[ . 1 . 2 . 3 ]" 2
50 1 19 THR HG1 1 25 LYS O 2.000 . 2.600 2.474 2.037 2.656 0.056 29 0 "[ . 1 . 2 . 3 ]" 2
51 1 40 THR HG1 1 57 ILE O 2.000 . 2.600 2.535 2.133 2.626 0.026 25 0 "[ . 1 . 2 . 3 ]" 2
52 1 40 THR OG1 1 56 GLY H 2.000 . 2.600 2.612 2.483 2.686 0.086 12 0 "[ . 1 . 2 . 3 ]" 2
53 1 60 LYS H 1 63 THR OG1 2.000 . 2.600 1.755 1.721 1.802 0.079 4 0 "[ . 1 . 2 . 3 ]" 2
54 1 86 LYS H 1 90 GLU OE2 2.000 . 2.600 4.182 3.894 4.372 1.772 10 32 [****-****+**********************] 2
55 1 67 TYR HH 1 80 MET SD 2.000 . 2.600 2.448 2.336 2.628 0.028 31 0 "[ . 1 . 2 . 3 ]" 2
stop_
save_
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