NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
551043 |
2lkt   |
18012 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lkt
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 1316
_Distance_constraint_stats_list.Viol_count 16
_Distance_constraint_stats_list.Viol_total 21.904
_Distance_constraint_stats_list.Viol_max 0.193
_Distance_constraint_stats_list.Viol_rms 0.0021
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0685
_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 6 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 GLY 0.022 0.022 17 0 "[ . 1 . 2]"
1 12 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 LEU 0.512 0.144 11 0 "[ . 1 . 2]"
1 14 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 ARG 0.056 0.056 17 0 "[ . 1 . 2]"
1 19 LEU 0.090 0.056 17 0 "[ . 1 . 2]"
1 20 GLY 0.034 0.034 3 0 "[ . 1 . 2]"
1 21 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 LEU 0.512 0.144 11 0 "[ . 1 . 2]"
1 27 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 LEU 0.362 0.193 19 0 "[ . 1 . 2]"
1 81 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 TYR 0.362 0.193 19 0 "[ . 1 . 2]"
1 85 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 VAL 0.022 0.022 17 0 "[ . 1 . 2]"
1 90 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 114 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 VAL 0.512 0.144 11 0 "[ . 1 . 2]"
1 118 THR 0.056 0.056 12 0 "[ . 1 . 2]"
1 119 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 ARG 0.109 0.056 12 0 "[ . 1 . 2]"
1 122 TYR 0.109 0.056 12 0 "[ . 1 . 2]"
1 123 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 SER 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 11 GLY QA 1 92 ILE MD 7.930 . 8.680 4.557 3.015 5.180 . 0 0 "[ . 1 . 2]" 1
2 1 88 PRO QG 1 92 ILE MD 6.070 . 6.820 3.191 2.373 4.559 . 0 0 "[ . 1 . 2]" 1
3 1 87 ARG HA 1 92 ILE MD 8.410 . 9.160 3.674 2.746 4.482 . 0 0 "[ . 1 . 2]" 1
4 1 88 PRO QD 1 92 ILE MD 6.490 . 7.240 2.298 1.947 3.322 . 0 0 "[ . 1 . 2]" 1
5 1 89 VAL HA 1 92 ILE MD 5.400 . 6.150 3.537 2.100 4.519 . 0 0 "[ . 1 . 2]" 1
6 1 92 ILE MD 1 121 ARG QG 5.300 . 6.050 3.371 2.095 3.604 . 0 0 "[ . 1 . 2]" 1
7 1 92 ILE MD 1 121 ARG QG 7.410 . 8.160 4.061 2.097 4.855 . 0 0 "[ . 1 . 2]" 1
8 1 87 ARG H 1 92 ILE MD 7.410 . 8.160 4.296 3.780 4.659 . 0 0 "[ . 1 . 2]" 1
9 1 34 ILE MD 1 62 ARG HA 6.610 . 7.360 2.651 2.114 4.909 . 0 0 "[ . 1 . 2]" 1
10 1 34 ILE MD 1 97 LYS H 6.610 . 7.360 4.341 2.969 4.751 . 0 0 "[ . 1 . 2]" 1
11 1 34 ILE MD 1 100 VAL H 10.100 . 10.850 3.775 3.110 4.474 . 0 0 "[ . 1 . 2]" 1
12 1 34 ILE MD 1 97 LYS HA . . 4.950 2.899 2.262 3.236 . 0 0 "[ . 1 . 2]" 1
13 1 34 ILE MD 1 62 ARG QD . . 6.820 2.947 2.229 4.506 . 0 0 "[ . 1 . 2]" 1
14 1 28 ILE HB 1 34 ILE MD 6.070 . 6.820 2.785 2.086 4.011 . 0 0 "[ . 1 . 2]" 1
15 1 34 ILE MD 1 97 LYS QB 6.070 . 6.820 4.355 3.627 4.563 . 0 0 "[ . 1 . 2]" 1
16 1 34 ILE MD 1 62 ARG QB 4.400 . 5.150 2.212 2.018 2.459 . 0 0 "[ . 1 . 2]" 1
17 1 28 ILE MD 1 32 TYR QB 5.670 . 6.420 2.409 2.137 2.810 . 0 0 "[ . 1 . 2]" 1
18 1 28 ILE MD 1 32 TYR QB 6.070 . 6.820 2.759 2.244 4.120 . 0 0 "[ . 1 . 2]" 1
19 1 28 ILE MD 1 34 ILE QG 5.300 . 6.050 2.087 1.995 2.174 . 0 0 "[ . 1 . 2]" 1
20 1 28 ILE MD 1 34 ILE QG 4.720 . 5.470 2.240 2.105 2.328 . 0 0 "[ . 1 . 2]" 1
21 1 11 GLY H 1 93 ILE MD . . 4.950 2.658 2.302 2.914 . 0 0 "[ . 1 . 2]" 1
22 1 93 ILE MD 1 94 SER H 8.410 . 9.160 4.780 4.725 4.867 . 0 0 "[ . 1 . 2]" 1
23 1 29 GLY QA 1 93 ILE MD 6.070 . 6.820 4.149 3.494 4.521 . 0 0 "[ . 1 . 2]" 1
24 1 11 GLY QA 1 93 ILE MD 9.440 . 10.190 2.597 2.370 2.755 . 0 0 "[ . 1 . 2]" 1
25 1 10 PRO HA 1 93 ILE MD . . 4.950 3.552 3.474 3.595 . 0 0 "[ . 1 . 2]" 1
26 1 90 GLU QG 1 93 ILE MD 7.410 . 8.160 4.515 3.496 5.523 . 0 0 "[ . 1 . 2]" 1
27 1 28 ILE HB 1 93 ILE MD 5.400 . 6.150 4.217 3.545 4.515 . 0 0 "[ . 1 . 2]" 1
28 1 90 GLU HA 1 93 ILE MD 7.280 . 8.030 2.998 2.669 3.925 . 0 0 "[ . 1 . 2]" 1
29 1 14 ILE MD 1 27 TYR QB 6.070 . 6.820 2.210 2.136 2.404 . 0 0 "[ . 1 . 2]" 1
30 1 14 ILE MD 1 15 GLU H 7.410 . 8.160 5.237 5.083 5.350 . 0 0 "[ . 1 . 2]" 1
31 1 14 ILE MD 1 27 TYR QD 6.070 . 6.820 2.607 2.154 3.534 . 0 0 "[ . 1 . 2]" 1
32 1 14 ILE MD 1 29 GLY H 9.440 . 10.190 5.319 5.011 5.646 . 0 0 "[ . 1 . 2]" 1
33 1 12 ASP QB 1 14 ILE MD 9.440 . 10.190 4.907 3.542 5.616 . 0 0 "[ . 1 . 2]" 1
34 1 14 ILE MD 1 16 ILE MG 8.900 . 9.650 5.261 4.914 5.531 . 0 0 "[ . 1 . 2]" 1
35 1 8 PRO QB 1 14 ILE MD 5.940 . 6.690 2.060 1.941 2.197 . 0 0 "[ . 1 . 2]" 1
36 1 118 THR H 1 118 THR HB . . 4.250 2.787 2.655 2.861 . 0 0 "[ . 1 . 2]" 1
37 1 118 THR HB 1 119 GLN H 5.500 . 6.250 2.765 2.506 3.091 . 0 0 "[ . 1 . 2]" 1
38 1 118 THR HB 1 122 TYR HA 5.500 . 6.250 5.627 5.360 5.710 . 0 0 "[ . 1 . 2]" 1
39 1 80 LEU QD 1 118 THR HB 8.320 . 9.070 4.932 4.056 5.323 . 0 0 "[ . 1 . 2]" 1
40 1 89 VAL HA 1 90 GLU H 5.500 . 6.250 3.566 3.434 3.612 . 0 0 "[ . 1 . 2]" 1
41 1 12 ASP H 1 89 VAL HA 6.170 . 6.920 3.935 3.689 4.192 . 0 0 "[ . 1 . 2]" 1
42 1 26 LEU QD 1 89 VAL HA 6.490 . 7.240 3.858 3.518 4.149 . 0 0 "[ . 1 . 2]" 1
43 1 89 VAL HA 1 92 ILE H . . 5.250 3.387 2.722 3.711 . 0 0 "[ . 1 . 2]" 1
44 1 88 PRO HA 1 89 VAL HA 5.500 . 6.250 4.502 4.298 4.650 . 0 0 "[ . 1 . 2]" 1
45 1 89 VAL HA 1 92 ILE QG 6.170 . 6.920 3.489 2.090 5.087 . 0 0 "[ . 1 . 2]" 1
46 1 118 THR HA 1 121 ARG H 5.500 . 6.250 3.339 3.105 3.479 . 0 0 "[ . 1 . 2]" 1
47 1 118 THR HA 1 121 ARG HE 5.500 . 6.250 3.666 2.216 5.608 . 0 0 "[ . 1 . 2]" 1
48 1 118 THR HA 1 122 TYR HA 4.500 . 5.250 4.535 3.675 4.695 . 0 0 "[ . 1 . 2]" 1
49 1 13 LEU QD 1 118 THR HA 7.930 . 8.680 4.734 4.044 5.319 . 0 0 "[ . 1 . 2]" 1
50 1 92 ILE HA 1 93 ILE H 5.500 . 6.250 3.600 3.570 3.627 . 0 0 "[ . 1 . 2]" 1
51 1 88 PRO QD 1 92 ILE HA 5.400 . 6.150 4.191 3.673 4.572 . 0 0 "[ . 1 . 2]" 1
52 1 26 LEU HG 1 92 ILE HA 9.680 . 10.430 4.617 3.915 5.130 . 0 0 "[ . 1 . 2]" 1
53 1 100 VAL HA 1 101 GLY H 3.500 . 4.250 2.078 2.040 2.110 . 0 0 "[ . 1 . 2]" 1
54 1 100 VAL HA 1 102 GLN H . . 4.250 3.462 3.263 3.583 . 0 0 "[ . 1 . 2]" 1
55 1 99 MET HA 1 100 VAL HA 6.610 . 7.360 3.771 3.741 3.805 . 0 0 "[ . 1 . 2]" 1
56 1 97 LYS HA 1 100 VAL HA 5.400 . 6.150 3.846 3.786 3.893 . 0 0 "[ . 1 . 2]" 1
57 1 60 VAL HB 1 100 VAL HA 4.500 . 5.250 3.016 2.214 4.012 . 0 0 "[ . 1 . 2]" 1
58 1 60 VAL QG 1 100 VAL HA 4.720 . 5.470 2.215 2.026 2.681 . 0 0 "[ . 1 . 2]" 1
59 1 69 VAL HA 1 70 GLY H 5.500 . 6.250 3.566 3.291 3.665 . 0 0 "[ . 1 . 2]" 1
60 1 91 VAL HA 1 95 SER H 5.500 . 6.250 3.910 3.771 4.042 . 0 0 "[ . 1 . 2]" 1
61 1 91 VAL HA 1 94 SER H . . 4.250 3.336 3.147 3.563 . 0 0 "[ . 1 . 2]" 1
62 1 90 GLU QB 1 91 VAL HA 6.170 . 6.920 4.136 3.863 4.730 . 0 0 "[ . 1 . 2]" 1
63 1 57 SER QB 1 58 ALA H 6.360 . 6.420 2.405 2.280 2.766 . 0 0 "[ . 1 . 2]" 1
64 1 57 SER QB 1 103 LYS QB . . 7.560 2.498 1.974 3.366 . 0 0 "[ . 1 . 2]" 1
65 1 55 SER HA 1 57 SER QB 6.360 . 7.110 4.369 3.809 4.635 . 0 0 "[ . 1 . 2]" 1
66 1 39 PRO HA 1 57 SER QB 4.950 . 5.700 3.947 3.713 4.019 . 0 0 "[ . 1 . 2]" 1
67 1 121 ARG QB 1 125 SER QB 6.930 . 7.680 3.936 2.539 5.350 . 0 0 "[ . 1 . 2]" 1
68 1 68 VAL HA 1 69 VAL H 4.500 . 5.250 3.561 3.501 3.662 . 0 0 "[ . 1 . 2]" 1
69 1 93 ILE HA 1 94 SER H . . 5.250 3.576 3.546 3.634 . 0 0 "[ . 1 . 2]" 1
70 1 93 ILE HA 1 96 ALA H 4.500 . 5.250 3.372 3.225 3.553 . 0 0 "[ . 1 . 2]" 1
71 1 26 LEU QD 1 93 ILE HA 5.050 . 5.800 2.394 2.315 2.544 . 0 0 "[ . 1 . 2]" 1
72 1 28 ILE MG 1 93 ILE HA 3.770 . 4.520 2.514 2.214 2.798 . 0 0 "[ . 1 . 2]" 1
73 1 57 SER QB 1 103 LYS QD 5.670 . 6.420 3.657 2.772 4.525 . 0 0 "[ . 1 . 2]" 1
74 1 9 LYS QD 1 10 PRO HA 9.900 . 10.650 5.820 5.497 6.119 . 0 0 "[ . 1 . 2]" 1
75 1 10 PRO HA 1 11 GLY H 3.500 . 3.550 2.097 2.044 2.135 . 0 0 "[ . 1 . 2]" 1
76 1 10 PRO HA 1 12 ASP H . . 5.250 3.406 3.299 3.576 . 0 0 "[ . 1 . 2]" 1
77 1 10 PRO HA 1 27 TYR QD 5.050 . 5.800 2.128 2.035 2.261 . 0 0 "[ . 1 . 2]" 1
78 1 117 VAL HA 1 120 LEU H 4.500 . 5.250 2.959 2.842 3.140 . 0 0 "[ . 1 . 2]" 1
79 1 117 VAL HA 1 120 LEU QB 5.050 . 5.800 2.517 2.142 3.087 . 0 0 "[ . 1 . 2]" 1
80 1 117 VAL HA 1 120 LEU QD . . 6.820 2.363 2.088 2.841 . 0 0 "[ . 1 . 2]" 1
81 1 57 SER QB 1 58 ALA HA 6.170 . 6.920 4.423 3.928 4.708 . 0 0 "[ . 1 . 2]" 1
82 1 50 VAL QG 1 55 SER QB 12.000 . 12.750 4.041 2.133 5.086 . 0 0 "[ . 1 . 2]" 1
83 1 53 VAL QG 1 55 SER QB 8.320 . 9.070 4.167 2.381 5.523 . 0 0 "[ . 1 . 2]" 1
84 1 108 ILE HB 1 110 SER QB 6.170 . 6.920 4.729 3.934 5.504 . 0 0 "[ . 1 . 2]" 1
85 1 88 PRO HA 1 89 VAL H 3.500 . 3.550 2.252 2.059 2.407 . 0 0 "[ . 1 . 2]" 1
86 1 88 PRO HA 1 89 VAL QG 6.360 . 7.110 3.939 3.598 4.422 . 0 0 "[ . 1 . 2]" 1
87 1 14 ILE MG 1 76 VAL HA 6.610 . 7.360 3.268 2.729 3.698 . 0 0 "[ . 1 . 2]" 1
88 1 76 VAL HA 1 77 ASN H 5.500 . 6.250 2.180 2.118 2.255 . 0 0 "[ . 1 . 2]" 1
89 1 37 ALA H 1 60 VAL HA 5.050 . 5.800 3.322 2.961 3.532 . 0 0 "[ . 1 . 2]" 1
90 1 21 TYR QD 1 109 VAL HA 8.410 . 9.160 3.935 3.689 4.300 . 0 0 "[ . 1 . 2]" 1
91 1 44 GLY H 1 50 VAL HA 5.050 . 5.800 3.879 3.392 4.328 . 0 0 "[ . 1 . 2]" 1
92 1 95 SER QB 1 120 LEU QD 6.810 . 7.560 3.426 2.501 4.506 . 0 0 "[ . 1 . 2]" 1
93 1 95 SER QB 1 96 ALA MB 9.900 . 10.650 3.737 3.325 4.556 . 0 0 "[ . 1 . 2]" 1
94 1 86 PRO HA 1 87 ARG H 3.500 . 4.250 3.300 2.330 3.600 . 0 0 "[ . 1 . 2]" 1
95 1 8 PRO HA 1 9 LYS HA 6.070 . 6.820 3.978 3.950 4.013 . 0 0 "[ . 1 . 2]" 1
96 1 60 VAL HA 1 61 LYS H 3.500 . 3.550 2.144 2.071 2.183 . 0 0 "[ . 1 . 2]" 1
97 1 109 VAL HA 1 110 SER H 3.930 . 4.680 3.041 2.835 3.165 . 0 0 "[ . 1 . 2]" 1
98 1 50 VAL HA 1 51 PHE HA 4.500 . 5.250 4.478 4.242 4.643 . 0 0 "[ . 1 . 2]" 1
99 1 94 SER H 1 95 SER QB 5.050 . 5.800 4.547 4.440 4.609 . 0 0 "[ . 1 . 2]" 1
100 1 95 SER H 1 95 SER QB . . 3.890 2.296 2.188 2.434 . 0 0 "[ . 1 . 2]" 1
101 1 8 PRO HA 1 9 LYS H 3.500 . 3.550 2.237 2.113 2.371 . 0 0 "[ . 1 . 2]" 1
102 1 8 PRO HA 1 9 LYS QG 6.170 . 6.920 4.723 3.501 5.408 . 0 0 "[ . 1 . 2]" 1
103 1 8 PRO HA 1 76 VAL QG 3.770 . 4.520 2.205 2.001 2.800 . 0 0 "[ . 1 . 2]" 1
104 1 94 SER HA 1 97 LYS QB 3.930 . 4.680 2.642 2.385 2.848 . 0 0 "[ . 1 . 2]" 1
105 1 79 SER HA 1 83 GLU QG 6.360 . 7.110 3.433 2.702 4.501 . 0 0 "[ . 1 . 2]" 1
106 1 95 SER HA 1 98 GLU QG 5.050 . 5.800 3.626 3.267 4.042 . 0 0 "[ . 1 . 2]" 1
107 1 95 SER HA 1 98 GLU QB 3.930 . 4.680 2.492 2.331 2.666 . 0 0 "[ . 1 . 2]" 1
108 1 95 SER HA 1 98 GLU H 5.500 . 6.250 3.393 3.114 3.522 . 0 0 "[ . 1 . 2]" 1
109 1 95 SER HA 1 120 LEU QD . . 8.160 4.895 4.160 5.510 . 0 0 "[ . 1 . 2]" 1
110 1 113 CYS HA 1 116 PHE QB 6.170 . 6.920 2.299 2.049 2.652 . 0 0 "[ . 1 . 2]" 1
111 1 36 LEU QB 1 113 CYS HA 6.170 . 6.920 3.592 3.105 4.099 . 0 0 "[ . 1 . 2]" 1
112 1 36 LEU QD 1 113 CYS HA . . 5.470 2.425 2.088 3.176 . 0 0 "[ . 1 . 2]" 1
113 1 116 PHE HA 1 116 PHE QD 3.930 . 4.680 2.797 2.596 2.963 . 0 0 "[ . 1 . 2]" 1
114 1 116 PHE HA 1 119 GLN QE 3.930 . 4.680 2.746 2.089 3.551 . 0 0 "[ . 1 . 2]" 1
115 1 116 PHE HA 1 119 GLN H 5.500 . 6.250 3.527 3.364 3.672 . 0 0 "[ . 1 . 2]" 1
116 1 28 ILE HA 1 93 ILE MG . . 4.110 2.646 2.436 2.808 . 0 0 "[ . 1 . 2]" 1
117 1 16 ILE HA 1 73 CYS QB 6.170 . 6.920 5.298 5.130 5.523 . 0 0 "[ . 1 . 2]" 1
118 1 16 ILE HA 1 73 CYS H 6.170 . 6.920 3.873 3.724 4.210 . 0 0 "[ . 1 . 2]" 1
119 1 16 ILE HA 1 17 PHE H 3.500 . 3.550 2.174 2.071 2.264 . 0 0 "[ . 1 . 2]" 1
120 1 16 ILE HA 1 74 TYR HA 4.500 . 5.250 2.644 2.453 3.048 . 0 0 "[ . 1 . 2]" 1
121 1 16 ILE HA 1 74 TYR QB 5.670 . 5.800 2.453 2.229 2.968 . 0 0 "[ . 1 . 2]" 1
122 1 97 LYS HA 1 98 GLU H 5.500 . 6.250 3.550 3.471 3.623 . 0 0 "[ . 1 . 2]" 1
123 1 97 LYS HA 1 100 VAL HB 5.500 . 6.250 3.682 2.811 4.599 . 0 0 "[ . 1 . 2]" 1
124 1 97 LYS HA 1 100 VAL H . . 5.250 3.649 3.337 3.968 . 0 0 "[ . 1 . 2]" 1
125 1 62 ARG QB 1 97 LYS HA 7.190 . 7.940 3.911 3.782 3.983 . 0 0 "[ . 1 . 2]" 1
126 1 97 LYS HA 1 100 VAL QG 3.770 . 4.520 2.529 2.136 2.826 . 0 0 "[ . 1 . 2]" 1
127 1 34 ILE MG 1 97 LYS HA 6.610 . 7.360 4.431 4.145 4.902 . 0 0 "[ . 1 . 2]" 1
128 1 72 CYS HA 1 73 CYS H 3.500 . 4.250 2.403 2.198 2.731 . 0 0 "[ . 1 . 2]" 1
129 1 118 THR MG 1 125 SER HA 7.190 . 7.940 4.965 4.063 5.526 . 0 0 "[ . 1 . 2]" 1
130 1 80 LEU QD 1 125 SER HA 8.320 . 9.070 5.336 3.337 6.237 . 0 0 "[ . 1 . 2]" 1
131 1 90 GLU HA 1 93 ILE QG 6.170 . 6.920 3.946 2.805 4.245 . 0 0 "[ . 1 . 2]" 1
132 1 90 GLU HA 1 93 ILE H . . 4.250 3.501 3.378 3.562 . 0 0 "[ . 1 . 2]" 1
133 1 90 GLU HA 1 94 SER H 5.500 . 6.250 3.967 3.839 4.093 . 0 0 "[ . 1 . 2]" 1
134 1 90 GLU HA 1 91 VAL H 4.500 . 5.250 3.552 3.517 3.584 . 0 0 "[ . 1 . 2]" 1
135 1 90 GLU HA 1 93 ILE HB 3.500 . 4.250 2.649 2.462 2.800 . 0 0 "[ . 1 . 2]" 1
136 1 89 VAL QG 1 90 GLU HA 6.490 . 7.240 3.157 2.950 3.378 . 0 0 "[ . 1 . 2]" 1
137 1 90 GLU HA 1 93 ILE MD 5.400 . 6.150 3.048 2.676 4.488 . 0 0 "[ . 1 . 2]" 1
138 1 69 VAL QG 1 73 CYS HA 7.410 . 8.160 4.398 3.394 5.422 . 0 0 "[ . 1 . 2]" 1
139 1 66 GLU HA 1 68 VAL H 5.050 . 5.800 3.512 3.250 3.806 . 0 0 "[ . 1 . 2]" 1
140 1 66 GLU HA 1 67 ASP H 4.500 . 5.250 3.556 3.506 3.597 . 0 0 "[ . 1 . 2]" 1
141 1 66 GLU HA 1 69 VAL QG 4.720 . 5.470 2.960 1.934 3.521 . 0 0 "[ . 1 . 2]" 1
142 1 73 CYS HA 1 74 TYR H 3.500 . 3.550 2.308 2.219 2.490 . 0 0 "[ . 1 . 2]" 1
143 1 92 ILE QG 1 121 ARG HA 6.170 . 6.920 2.851 2.155 4.260 . 0 0 "[ . 1 . 2]" 1
144 1 92 ILE MD 1 121 ARG HA 4.200 . 4.950 2.474 2.072 3.441 . 0 0 "[ . 1 . 2]" 1
145 1 92 ILE MG 1 121 ARG HA 5.400 . 6.150 2.862 2.226 4.082 . 0 0 "[ . 1 . 2]" 1
146 1 65 LEU HA 1 66 GLU H 5.500 . 6.250 3.611 3.594 3.640 . 0 0 "[ . 1 . 2]" 1
147 1 65 LEU HA 1 68 VAL H 5.500 . 6.250 3.539 3.370 3.711 . 0 0 "[ . 1 . 2]" 1
148 1 31 GLY QA 1 65 LEU HA 5.400 . 6.150 4.155 4.033 4.253 . 0 0 "[ . 1 . 2]" 1
149 1 65 LEU HA 1 68 VAL HB 4.500 . 5.250 2.791 2.452 3.221 . 0 0 "[ . 1 . 2]" 1
150 1 33 VAL QG 1 65 LEU HA 6.070 . 6.820 2.303 2.211 2.465 . 0 0 "[ . 1 . 2]" 1
151 1 17 PHE HA 1 18 ARG H . . 4.250 2.649 2.230 3.503 . 0 0 "[ . 1 . 2]" 1
152 1 17 PHE HA 1 22 GLU QG . . 6.920 2.873 2.120 3.953 . 0 0 "[ . 1 . 2]" 1
153 1 85 GLN QE 1 121 ARG HA 5.400 . 6.150 3.919 3.081 4.597 . 0 0 "[ . 1 . 2]" 1
154 1 85 GLN QE 1 119 GLN HA 7.410 . 8.160 3.353 3.090 3.513 . 0 0 "[ . 1 . 2]" 1
155 1 116 PHE HA 1 119 GLN HA 6.070 . 6.820 4.176 3.463 4.454 . 0 0 "[ . 1 . 2]" 1
156 1 110 SER HA 1 114 GLU QG 6.610 . 7.360 3.653 3.483 3.972 . 0 0 "[ . 1 . 2]" 1
157 1 115 HIS HA 1 118 THR H 5.500 . 6.250 3.516 3.274 3.887 . 0 0 "[ . 1 . 2]" 1
158 1 110 SER HA 1 111 ARG H 4.500 . 5.250 3.616 3.582 3.659 . 0 0 "[ . 1 . 2]" 1
159 1 24 TRP QB 1 114 GLU HA 6.170 . 6.920 5.360 4.995 5.572 . 0 0 "[ . 1 . 2]" 1
160 1 55 SER HA 1 56 ASN QB 6.170 . 6.920 4.344 3.848 5.137 . 0 0 "[ . 1 . 2]" 1
161 1 82 HIS HA 1 83 GLU H 5.500 . 6.250 3.500 3.376 3.590 . 0 0 "[ . 1 . 2]" 1
162 1 97 LYS H 1 98 GLU HA 7.000 . 7.750 5.437 5.398 5.522 . 0 0 "[ . 1 . 2]" 1
163 1 98 GLU HA 1 99 MET H . . 4.250 3.562 3.537 3.606 . 0 0 "[ . 1 . 2]" 1
164 1 98 GLU HA 1 100 VAL H . . 5.250 4.206 3.737 4.539 . 0 0 "[ . 1 . 2]" 1
165 1 97 LYS QB 1 98 GLU HA 6.170 . 6.920 4.208 3.998 4.393 . 0 0 "[ . 1 . 2]" 1
166 1 92 ILE MG 1 120 LEU HA 5.400 . 6.150 3.953 3.640 4.511 . 0 0 "[ . 1 . 2]" 1
167 1 120 LEU HA 1 120 LEU QD 3.770 . 4.520 2.150 2.074 2.488 . 0 0 "[ . 1 . 2]" 1
168 1 58 ALA H 1 105 LYS HA 4.500 . 5.250 3.506 3.213 3.813 . 0 0 "[ . 1 . 2]" 1
169 1 39 PRO QG 1 105 LYS HA 5.050 . 5.800 4.155 2.869 4.542 . 0 0 "[ . 1 . 2]" 1
170 1 33 VAL QG 1 64 ARG HA 8.900 . 9.650 3.020 2.666 3.533 . 0 0 "[ . 1 . 2]" 1
171 1 102 GLN HA 1 103 LYS H 2.800 . 3.550 2.184 2.100 2.319 . 0 0 "[ . 1 . 2]" 1
172 1 102 GLN HA 1 103 LYS HA 5.500 . 6.250 4.456 4.390 4.502 . 0 0 "[ . 1 . 2]" 1
173 1 60 VAL H 1 102 GLN HA 5.500 . 6.250 4.817 4.697 4.909 . 0 0 "[ . 1 . 2]" 1
174 1 83 GLU HA 1 84 TYR H 3.500 . 4.250 3.524 3.445 3.559 . 0 0 "[ . 1 . 2]" 1
175 1 64 ARG HA 1 65 LEU H 3.500 . 3.550 2.231 2.175 2.358 . 0 0 "[ . 1 . 2]" 1
176 1 32 TYR QD 1 64 ARG HA 6.170 . 6.920 3.614 2.986 4.460 . 0 0 "[ . 1 . 2]" 1
177 1 32 TYR HA 1 64 ARG HA 3.500 . 4.250 2.259 2.009 2.603 . 0 0 "[ . 1 . 2]" 1
178 1 67 ASP HA 1 68 VAL H 5.050 . 5.800 3.165 3.035 3.309 . 0 0 "[ . 1 . 2]" 1
179 1 67 ASP HA 1 68 VAL QG 7.280 . 8.030 4.461 4.024 4.577 . 0 0 "[ . 1 . 2]" 1
180 1 17 PHE QB 1 19 LEU HA 5.670 . 6.420 4.461 3.974 4.624 . 0 0 "[ . 1 . 2]" 1
181 1 41 GLU HA 1 54 LEU H 4.720 . 5.470 3.418 2.896 3.534 . 0 0 "[ . 1 . 2]" 1
182 1 19 LEU HA 1 20 GLY QA 4.950 . 5.700 3.457 3.323 3.592 . 0 0 "[ . 1 . 2]" 1
183 1 19 LEU HA 1 20 GLY H 3.500 . 4.250 2.768 2.126 3.378 . 0 0 "[ . 1 . 2]" 1
184 1 30 ASP HA 1 31 GLY H 3.500 . 4.250 2.312 2.140 3.430 . 0 0 "[ . 1 . 2]" 1
185 1 87 ARG HA 1 88 PRO QD 3.140 . 3.890 2.073 1.998 2.160 . 0 0 "[ . 1 . 2]" 1
186 1 87 ARG HA 1 88 PRO QG 6.610 . 7.360 3.957 3.878 4.063 . 0 0 "[ . 1 . 2]" 1
187 1 124 LYS HA 1 125 SER H 3.500 . 4.250 3.291 2.965 3.521 . 0 0 "[ . 1 . 2]" 1
188 1 99 MET HA 1 102 GLN QE 6.170 . 6.920 4.536 2.217 5.544 . 0 0 "[ . 1 . 2]" 1
189 1 99 MET HA 1 102 GLN QG 3.930 . 4.680 2.790 2.174 3.570 . 0 0 "[ . 1 . 2]" 1
190 1 6 GLN HA 1 7 GLU H 3.500 . 4.250 2.297 2.183 2.597 . 0 0 "[ . 1 . 2]" 1
191 1 99 MET HA 1 100 VAL H . . 4.250 3.475 3.250 3.550 . 0 0 "[ . 1 . 2]" 1
192 1 96 ALA HA 1 97 LYS H 4.500 . 5.250 3.598 3.585 3.625 . 0 0 "[ . 1 . 2]" 1
193 1 96 ALA HA 1 99 MET H . . 4.250 3.390 3.140 3.557 . 0 0 "[ . 1 . 2]" 1
194 1 96 ALA HA 1 100 VAL H 8.410 . 9.160 4.045 3.537 4.699 . 0 0 "[ . 1 . 2]" 1
195 1 96 ALA HA 1 99 MET QG 5.050 . 5.800 3.305 2.041 3.983 . 0 0 "[ . 1 . 2]" 1
196 1 96 ALA HA 1 99 MET QB 6.170 . 6.920 2.876 2.267 4.260 . 0 0 "[ . 1 . 2]" 1
197 1 34 ILE MG 1 96 ALA HA 7.190 . 7.940 2.989 2.754 3.302 . 0 0 "[ . 1 . 2]" 1
198 1 96 ALA HA 1 120 LEU QD 4.720 . 5.470 2.133 2.023 2.693 . 0 0 "[ . 1 . 2]" 1
199 1 34 ILE MD 1 96 ALA HA 6.490 . 7.240 3.850 3.382 4.172 . 0 0 "[ . 1 . 2]" 1
200 1 15 GLU HA 1 16 ILE H 3.500 . 3.550 2.178 2.131 2.259 . 0 0 "[ . 1 . 2]" 1
201 1 15 GLU HA 1 24 TRP HA 4.500 . 5.250 2.777 2.542 3.189 . 0 0 "[ . 1 . 2]" 1
202 1 7 GLU HA 1 8 PRO QD 3.140 . 3.890 2.082 2.012 2.167 . 0 0 "[ . 1 . 2]" 1
203 1 7 GLU HA 1 8 PRO QG 6.930 . 7.680 3.987 3.908 4.064 . 0 0 "[ . 1 . 2]" 1
204 1 7 GLU HA 1 8 PRO QG 6.170 . 6.920 4.009 3.931 4.090 . 0 0 "[ . 1 . 2]" 1
205 1 36 LEU HA 1 61 LYS H 4.500 . 5.250 3.402 3.152 3.588 . 0 0 "[ . 1 . 2]" 1
206 1 36 LEU HA 1 37 ALA H 3.500 . 3.550 2.144 2.095 2.216 . 0 0 "[ . 1 . 2]" 1
207 1 36 LEU HA 1 60 VAL HA 3.500 . 4.250 2.367 2.035 2.705 . 0 0 "[ . 1 . 2]" 1
208 1 58 ALA HA 1 59 GLU H 3.500 . 3.550 2.368 2.211 2.435 . 0 0 "[ . 1 . 2]" 1
209 1 58 ALA HA 1 59 GLU QB 6.360 . 7.110 3.763 3.577 3.898 . 0 0 "[ . 1 . 2]" 1
210 1 85 GLN HA 1 86 PRO QD 3.930 . 4.680 2.092 1.988 2.150 . 0 0 "[ . 1 . 2]" 1
211 1 85 GLN QG 1 86 PRO QD . . 6.420 3.711 2.553 4.178 . 0 0 "[ . 1 . 2]" 1
212 1 42 TYR HA 1 43 PRO QD 3.930 . 4.680 2.702 2.008 3.591 . 0 0 "[ . 1 . 2]" 1
213 1 9 LYS QE 1 10 PRO QD 7.140 . 7.890 3.729 2.896 4.225 . 0 0 "[ . 1 . 2]" 1
214 1 21 TYR QD 1 38 PRO QD 12.470 . 13.220 3.486 2.601 5.036 . 0 0 "[ . 1 . 2]" 1
215 1 39 PRO QD 1 112 ASN QB 5.670 . 6.420 3.932 2.922 4.514 . 0 0 "[ . 1 . 2]" 1
216 1 9 LYS H 1 10 PRO QD 9.900 . 10.650 4.154 4.033 4.179 . 0 0 "[ . 1 . 2]" 1
217 1 9 LYS HA 1 10 PRO QD . . 3.890 2.202 2.063 2.408 . 0 0 "[ . 1 . 2]" 1
218 1 7 GLU QG 1 10 PRO QD 7.140 . 7.890 3.687 2.896 4.488 . 0 0 "[ . 1 . 2]" 1
219 1 9 LYS QG 1 10 PRO QD 6.930 . 7.680 3.169 2.497 4.224 . 0 0 "[ . 1 . 2]" 1
220 1 37 ALA HA 1 38 PRO QD 3.960 . 4.710 2.076 1.989 2.165 . 0 0 "[ . 1 . 2]" 1
221 1 19 LEU QB 1 38 PRO QD 8.580 . 9.330 4.107 2.242 4.744 . 0 0 "[ . 1 . 2]" 1
222 1 7 GLU QG 1 10 PRO QD 7.640 . 8.390 3.657 2.894 4.391 . 0 0 "[ . 1 . 2]" 1
223 1 9 LYS QB 1 10 PRO QD 4.760 . 5.510 2.325 1.970 2.788 . 0 0 "[ . 1 . 2]" 1
224 1 37 ALA MB 1 38 PRO QD 7.640 . 8.390 2.077 1.971 2.213 . 0 0 "[ . 1 . 2]" 1
225 1 8 PRO QD 1 14 ILE MD 8.900 . 9.650 2.806 2.206 3.784 . 0 0 "[ . 1 . 2]" 1
226 1 37 ALA HA 1 38 PRO QD 3.930 . 4.680 2.096 2.005 2.190 . 0 0 "[ . 1 . 2]" 1
227 1 37 ALA MB 1 38 PRO QD 6.070 . 6.820 2.877 2.291 3.347 . 0 0 "[ . 1 . 2]" 1
228 1 7 GLU QG 1 8 PRO QD . . 6.420 3.186 2.302 4.499 . 0 0 "[ . 1 . 2]" 1
229 1 88 PRO QD 1 124 LYS QB 4.410 . 5.160 2.710 2.047 3.633 . 0 0 "[ . 1 . 2]" 1
230 1 88 PRO QD 1 124 LYS QG 6.930 . 7.680 3.184 2.011 5.135 . 0 0 "[ . 1 . 2]" 1
231 1 88 PRO QD 1 92 ILE MD 7.410 . 8.160 2.857 2.123 4.383 . 0 0 "[ . 1 . 2]" 1
232 1 6 GLN QB 1 8 PRO QD 6.170 . 6.920 3.411 2.795 3.706 . 0 0 "[ . 1 . 2]" 1
233 1 87 ARG QB 1 88 PRO QD 6.360 . 7.110 3.156 2.237 3.563 . 0 0 "[ . 1 . 2]" 1
234 1 20 GLY QA 1 21 TYR H . . 4.680 2.865 2.537 2.958 . 0 0 "[ . 1 . 2]" 1
235 1 31 GLY QA 1 32 TYR H . . 4.680 2.956 2.913 2.976 . 0 0 "[ . 1 . 2]" 1
236 1 29 GLY H 1 31 GLY QA 6.170 . 6.920 5.513 5.282 5.569 . 0 0 "[ . 1 . 2]" 1
237 1 26 LEU H 1 26 LEU QB . . 3.890 2.359 2.272 2.499 . 0 0 "[ . 1 . 2]" 1
238 1 11 GLY QA 1 14 ILE MD 8.730 . 9.480 4.562 4.190 5.749 . 0 0 "[ . 1 . 2]" 1
239 1 96 ALA H 1 123 GLY QA 7.410 . 8.160 4.638 4.576 4.822 . 0 0 "[ . 1 . 2]" 1
240 1 123 GLY QA 1 124 LYS H . . 4.680 2.717 2.150 2.957 . 0 0 "[ . 1 . 2]" 1
241 1 87 ARG QD 1 123 GLY QA 6.810 . 7.560 3.587 2.470 3.842 . 0 0 "[ . 1 . 2]" 1
242 1 71 GLY QA 1 72 CYS H . . 4.680 2.961 2.876 2.987 . 0 0 "[ . 1 . 2]" 1
243 1 96 ALA H 1 123 GLY QA 7.780 . 8.530 4.661 4.592 4.855 . 0 0 "[ . 1 . 2]" 1
244 1 11 GLY QA 1 12 ASP H . . 7.680 2.882 2.839 2.942 . 0 0 "[ . 1 . 2]" 1
245 1 11 GLY QA 1 89 VAL QG . . 7.560 1.968 1.778 2.112 0.022 17 0 "[ . 1 . 2]" 1
246 1 11 GLY QA 1 26 LEU QD 5.300 . 6.050 2.283 2.030 3.406 . 0 0 "[ . 1 . 2]" 1
247 1 101 GLY QA 1 102 GLN H . . 4.680 3.010 2.988 3.037 . 0 0 "[ . 1 . 2]" 1
248 1 100 VAL QG 1 101 GLY QA . . 7.560 3.174 3.042 3.268 . 0 0 "[ . 1 . 2]" 1
249 1 87 ARG QD 1 125 SER QB 8.820 . 9.570 5.614 3.370 7.016 . 0 0 "[ . 1 . 2]" 1
250 1 87 ARG QD 1 123 GLY QA 6.930 . 7.680 5.183 2.517 5.555 . 0 0 "[ . 1 . 2]" 1
251 1 87 ARG QD 1 88 PRO QD . . 10.190 2.965 2.108 3.705 . 0 0 "[ . 1 . 2]" 1
252 1 87 ARG QD 1 88 PRO QD 6.930 . 7.680 3.465 2.111 4.411 . 0 0 "[ . 1 . 2]" 1
253 1 87 ARG QD 1 124 LYS QB 5.670 . 6.420 3.892 1.903 4.604 . 0 0 "[ . 1 . 2]" 1
254 1 87 ARG QD 1 92 ILE MD 6.070 . 6.820 2.638 1.925 3.853 . 0 0 "[ . 1 . 2]" 1
255 1 100 VAL HA 1 101 GLY QA 6.170 . 6.920 3.932 3.888 3.967 . 0 0 "[ . 1 . 2]" 1
256 1 59 GLU QG 1 101 GLY QA 6.930 . 7.680 3.353 2.939 3.827 . 0 0 "[ . 1 . 2]" 1
257 1 18 ARG HA 1 18 ARG QD 3.140 . 3.890 2.273 2.053 2.844 . 0 0 "[ . 1 . 2]" 1
258 1 9 LYS QD 1 29 GLY QA 11.110 . 11.860 6.840 6.422 7.129 . 0 0 "[ . 1 . 2]" 1
259 1 104 MET QB 1 111 ARG QD 3.960 . 4.710 2.397 2.182 2.810 . 0 0 "[ . 1 . 2]" 1
260 1 18 ARG HA 1 18 ARG QD 3.960 . 4.710 2.094 1.878 2.731 . 0 0 "[ . 1 . 2]" 1
261 1 74 TYR QD 1 75 ARG QD 6.930 . 7.680 5.035 4.496 5.535 . 0 0 "[ . 1 . 2]" 1
262 1 75 ARG QD 1 76 VAL QG 8.320 . 9.070 4.906 3.937 5.596 . 0 0 "[ . 1 . 2]" 1
263 1 62 ARG QD 1 100 VAL QG 6.810 . 7.560 2.998 2.124 3.898 . 0 0 "[ . 1 . 2]" 1
264 1 28 ILE MD 1 62 ARG QD 6.070 . 6.820 2.847 2.281 4.319 . 0 0 "[ . 1 . 2]" 1
265 1 34 ILE QG 1 62 ARG QD 9.800 . 10.550 2.927 2.090 3.718 . 0 0 "[ . 1 . 2]" 1
266 1 64 ARG QD 1 66 GLU QG 8.820 . 9.570 3.927 2.644 5.133 . 0 0 "[ . 1 . 2]" 1
267 1 32 TYR QR 1 64 ARG QD . . 8.530 3.385 2.469 5.341 . 0 0 "[ . 1 . 2]" 1
268 1 9 LYS H 1 12 ASP QB . . 5.800 2.984 2.441 3.489 . 0 0 "[ . 1 . 2]" 1
269 1 12 ASP H 1 12 ASP QB . . 3.890 2.408 2.253 2.573 . 0 0 "[ . 1 . 2]" 1
270 1 12 ASP QB 1 76 VAL QG . . 6.050 2.281 1.931 3.228 . 0 0 "[ . 1 . 2]" 1
271 1 12 ASP QB 1 13 LEU H . . 6.920 2.624 2.130 3.149 . 0 0 "[ . 1 . 2]" 1
272 1 59 GLU QG 1 103 LYS QE 5.670 . 6.420 3.409 2.808 4.359 . 0 0 "[ . 1 . 2]" 1
273 1 57 SER HA 1 105 LYS QE 3.140 . 3.890 2.730 2.168 2.887 . 0 0 "[ . 1 . 2]" 1
274 1 93 ILE MG 1 97 LYS QE . . 6.820 2.516 2.037 4.203 . 0 0 "[ . 1 . 2]" 1
275 1 28 ILE MG 1 32 TYR QB 8.900 . 9.650 3.246 2.879 3.596 . 0 0 "[ . 1 . 2]" 1
276 1 28 ILE MD 1 32 TYR QB 6.810 . 7.560 2.495 1.945 2.856 . 0 0 "[ . 1 . 2]" 1
277 1 32 TYR QB 1 33 VAL H . . 4.680 2.926 2.517 3.081 . 0 0 "[ . 1 . 2]" 1
278 1 28 ILE MG 1 97 LYS QE 10.690 . 11.440 3.683 3.048 4.615 . 0 0 "[ . 1 . 2]" 1
279 1 28 ILE MD 1 97 LYS QE 7.410 . 8.160 3.520 2.131 4.719 . 0 0 "[ . 1 . 2]" 1
280 1 28 ILE QG 1 32 TYR QB 8.730 . 9.480 2.414 2.135 3.479 . 0 0 "[ . 1 . 2]" 1
281 1 120 LEU H 1 120 LEU QB . . 3.890 2.448 2.226 2.635 . 0 0 "[ . 1 . 2]" 1
282 1 26 LEU QD 1 120 LEU QB 8.180 . 8.930 2.345 1.971 2.633 . 0 0 "[ . 1 . 2]" 1
283 1 74 TYR QB 1 75 ARG H . . 5.160 2.442 2.303 2.602 . 0 0 "[ . 1 . 2]" 1
284 1 14 ILE MG 1 74 TYR QB 5.670 . 6.420 2.155 2.022 2.342 . 0 0 "[ . 1 . 2]" 1
285 1 16 ILE MG 1 74 TYR QB . . 6.820 2.643 2.310 3.454 . 0 0 "[ . 1 . 2]" 1
286 1 65 LEU QB 1 66 GLU H 6.170 . 6.920 2.415 2.302 2.506 . 0 0 "[ . 1 . 2]" 1
287 1 33 VAL QG 1 65 LEU QB . . 4.990 2.318 2.122 2.584 . 0 0 "[ . 1 . 2]" 1
288 1 65 LEU H 1 65 LEU QB . . 3.890 2.209 2.162 2.249 . 0 0 "[ . 1 . 2]" 1
289 1 80 LEU H 1 80 LEU QB . . 3.890 2.370 2.155 2.563 . 0 0 "[ . 1 . 2]" 1
290 1 80 LEU QB 1 84 TYR QE 5.670 . 6.420 3.074 2.201 4.556 . 0 0 "[ . 1 . 2]" 1
291 1 84 TYR QB 1 85 GLN H . . 4.680 2.816 2.152 3.546 . 0 0 "[ . 1 . 2]" 1
292 1 8 PRO QG 1 13 LEU QB 11.530 . 12.280 6.374 5.148 7.010 . 0 0 "[ . 1 . 2]" 1
293 1 13 LEU QB 1 24 TRP HZ3 6.170 . 6.920 3.643 2.260 5.522 . 0 0 "[ . 1 . 2]" 1
294 1 13 LEU QB 1 24 TRP HD1 . . 9.570 6.043 5.442 7.023 . 0 0 "[ . 1 . 2]" 1
295 1 26 LEU QB 1 34 ILE HB 6.170 . 6.920 2.333 2.186 2.797 . 0 0 "[ . 1 . 2]" 1
296 1 26 LEU HG 1 34 ILE HB 6.610 . 7.360 3.696 3.416 3.925 . 0 0 "[ . 1 . 2]" 1
297 1 34 ILE H 1 34 ILE HB . . 4.250 2.516 2.387 2.646 . 0 0 "[ . 1 . 2]" 1
298 1 67 ASP QB 1 68 VAL H 5.050 . 5.160 2.587 2.448 2.815 . 0 0 "[ . 1 . 2]" 1
299 1 67 ASP QB 1 68 VAL QG . . 8.390 3.262 2.947 3.445 . 0 0 "[ . 1 . 2]" 1
300 1 67 ASP H 1 67 ASP QB 3.140 . 3.890 2.301 2.258 2.445 . 0 0 "[ . 1 . 2]" 1
301 1 64 ARG QB 1 67 ASP QB 5.670 . 6.420 2.848 2.216 3.450 . 0 0 "[ . 1 . 2]" 1
302 1 30 ASP QB 1 32 TYR QD 5.670 . 6.420 4.277 3.772 4.519 . 0 0 "[ . 1 . 2]" 1
303 1 81 ASP H 1 81 ASP QB . . 3.890 2.295 2.057 2.621 . 0 0 "[ . 1 . 2]" 1
304 1 18 ARG HA 1 19 LEU QB 5.670 . 6.420 4.544 4.100 4.640 . 0 0 "[ . 1 . 2]" 1
305 1 16 ILE HB 1 23 HIS H 5.500 . 6.250 3.467 3.015 3.822 . 0 0 "[ . 1 . 2]" 1
306 1 16 ILE HB 1 23 HIS QB 6.170 . 6.920 3.449 2.276 5.302 . 0 0 "[ . 1 . 2]" 1
307 1 16 ILE HB 1 18 ARG HA 5.400 . 6.150 4.203 3.731 4.379 . 0 0 "[ . 1 . 2]" 1
308 1 116 PHE H 1 116 PHE QB . . 3.890 2.104 2.054 2.186 . 0 0 "[ . 1 . 2]" 1
309 1 116 PHE QB 1 119 GLN QE 5.670 . 6.420 3.996 3.237 4.526 . 0 0 "[ . 1 . 2]" 1
310 1 36 LEU QD 1 116 PHE QB 8.320 . 9.070 2.373 2.068 3.339 . 0 0 "[ . 1 . 2]" 1
311 1 44 GLY QA 1 51 PHE QB 9.060 . 9.810 2.179 2.000 3.003 . 0 0 "[ . 1 . 2]" 1
312 1 63 GLU QG 1 64 ARG H . . 5.800 2.635 2.029 4.253 . 0 0 "[ . 1 . 2]" 1
313 1 33 VAL QG 1 63 GLU QG . . 8.930 2.158 2.030 2.506 . 0 0 "[ . 1 . 2]" 1
314 1 61 LYS QB 1 63 GLU QG 7.140 . 7.560 3.623 2.896 4.104 . 0 0 "[ . 1 . 2]" 1
315 1 61 LYS QB 1 63 GLU QG 7.140 . 7.560 4.467 2.864 4.871 . 0 0 "[ . 1 . 2]" 1
316 1 56 ASN QB 1 57 SER HA 5.050 . 5.800 4.498 4.089 4.611 . 0 0 "[ . 1 . 2]" 1
317 1 56 ASN QB 1 59 GLU QB 10.590 . 11.340 5.019 4.216 5.585 . 0 0 "[ . 1 . 2]" 1
318 1 14 ILE HB 1 25 ALA H . . 5.250 3.245 3.001 3.411 . 0 0 "[ . 1 . 2]" 1
319 1 14 ILE H 1 14 ILE HB . . 3.550 2.735 2.451 2.862 . 0 0 "[ . 1 . 2]" 1
320 1 14 ILE HB 1 25 ALA MB 5.400 . 6.150 2.392 2.192 2.700 . 0 0 "[ . 1 . 2]" 1
321 1 28 ILE HB 1 93 ILE MG 4.200 . 4.950 2.372 2.268 2.657 . 0 0 "[ . 1 . 2]" 1
322 1 18 ARG QB 1 21 TYR QB 6.930 . 7.680 4.797 2.646 5.549 . 0 0 "[ . 1 . 2]" 1
323 1 19 LEU H 1 21 TYR QB 5.050 . 5.800 4.351 3.730 4.568 . 0 0 "[ . 1 . 2]" 1
324 1 8 PRO QG 1 27 TYR QB 14.980 . 15.730 2.649 2.353 2.939 . 0 0 "[ . 1 . 2]" 1
325 1 8 PRO QB 1 27 TYR QB . . 7.890 2.566 2.128 3.037 . 0 0 "[ . 1 . 2]" 1
326 1 27 TYR QB 1 30 ASP HA 7.860 . 8.610 6.326 5.857 7.082 . 0 0 "[ . 1 . 2]" 1
327 1 15 GLU QB 1 77 ASN QB 11.110 . 11.860 3.138 2.176 4.197 . 0 0 "[ . 1 . 2]" 1
328 1 92 ILE HB 1 93 ILE H 4.500 . 5.250 2.763 2.488 3.238 . 0 0 "[ . 1 . 2]" 1
329 1 92 ILE H 1 92 ILE HB . . 4.250 2.445 2.224 2.805 . 0 0 "[ . 1 . 2]" 1
330 1 89 VAL HA 1 92 ILE HB . . 4.250 2.725 2.230 3.235 . 0 0 "[ . 1 . 2]" 1
331 1 39 PRO QD 1 112 ASN QB . . 8.530 3.071 2.291 3.752 . 0 0 "[ . 1 . 2]" 1
332 1 37 ALA MB 1 61 LYS QB 7.280 . 8.030 3.291 2.835 3.449 . 0 0 "[ . 1 . 2]" 1
333 1 61 LYS QB 1 62 ARG H . . 4.680 2.526 2.201 2.805 . 0 0 "[ . 1 . 2]" 1
334 1 61 LYS QB 1 63 GLU QB 6.360 . 7.110 3.808 2.876 4.497 . 0 0 "[ . 1 . 2]" 1
335 1 63 GLU QB 1 64 ARG H 5.050 . 5.800 2.707 1.880 3.335 . 0 0 "[ . 1 . 2]" 1
336 1 33 VAL QG 1 63 GLU QB 8.180 . 8.930 2.558 1.802 3.807 . 0 0 "[ . 1 . 2]" 1
337 1 93 ILE H 1 93 ILE HB 3.500 . 4.250 2.352 2.275 2.527 . 0 0 "[ . 1 . 2]" 1
338 1 93 ILE HB 1 94 SER H . . 3.550 2.795 2.478 2.851 . 0 0 "[ . 1 . 2]" 1
339 1 36 LEU QD 1 104 MET QB . . 7.560 3.120 2.052 3.981 . 0 0 "[ . 1 . 2]" 1
340 1 98 GLU H 1 98 GLU QG . . 3.890 2.668 2.466 2.813 . 0 0 "[ . 1 . 2]" 1
341 1 90 GLU H 1 90 GLU QG 3.930 . 4.680 2.363 2.070 3.364 . 0 0 "[ . 1 . 2]" 1
342 1 90 GLU QG 1 91 VAL H 5.050 . 5.800 3.603 2.372 4.413 . 0 0 "[ . 1 . 2]" 1
343 1 90 GLU QG 1 91 VAL HA 7.860 . 8.610 5.170 3.596 5.881 . 0 0 "[ . 1 . 2]" 1
344 1 90 GLU QG 1 91 VAL QG 6.810 . 7.560 3.917 2.338 4.537 . 0 0 "[ . 1 . 2]" 1
345 1 89 VAL QG 1 90 GLU QG 8.580 . 9.330 3.047 2.331 3.719 . 0 0 "[ . 1 . 2]" 1
346 1 66 GLU QG 1 67 ASP HA 6.170 . 6.920 3.785 3.632 4.090 . 0 0 "[ . 1 . 2]" 1
347 1 59 GLU QG 1 61 LYS QG 5.670 . 6.420 2.627 2.254 4.363 . 0 0 "[ . 1 . 2]" 1
348 1 59 GLU QG 1 60 VAL H . . 4.680 2.656 2.534 2.905 . 0 0 "[ . 1 . 2]" 1
349 1 59 GLU QG 1 103 LYS HA 6.170 . 6.920 3.593 3.079 3.966 . 0 0 "[ . 1 . 2]" 1
350 1 59 GLU QG 1 61 LYS QD 5.600 . 6.350 2.358 2.024 2.849 . 0 0 "[ . 1 . 2]" 1
351 1 66 GLU H 1 66 GLU QG . . 4.680 2.487 2.220 3.314 . 0 0 "[ . 1 . 2]" 1
352 1 66 GLU QG 1 67 ASP H . . 4.680 2.597 2.338 3.120 . 0 0 "[ . 1 . 2]" 1
353 1 65 LEU QD 1 66 GLU QG 10.490 . 11.240 4.526 4.063 4.810 . 0 0 "[ . 1 . 2]" 1
354 1 33 VAL QG 1 66 GLU QG 10.810 . 11.560 4.424 3.961 4.802 . 0 0 "[ . 1 . 2]" 1
355 1 83 GLU QG 1 84 TYR H 5.050 . 5.800 4.276 3.915 4.520 . 0 0 "[ . 1 . 2]" 1
356 1 80 LEU HA 1 83 GLU QG 6.170 . 6.920 2.954 2.309 4.462 . 0 0 "[ . 1 . 2]" 1
357 1 82 HIS QB 1 83 GLU QG 6.930 . 7.680 4.183 3.079 5.587 . 0 0 "[ . 1 . 2]" 1
358 1 83 GLU QG 1 84 TYR HH 6.170 . 6.920 4.875 3.867 5.497 . 0 0 "[ . 1 . 2]" 1
359 1 80 LEU QD 1 83 GLU QG . . 6.050 2.958 2.515 3.513 . 0 0 "[ . 1 . 2]" 1
360 1 33 VAL HB 1 34 ILE H . . 4.250 2.606 2.446 2.755 . 0 0 "[ . 1 . 2]" 1
361 1 26 LEU H 1 33 VAL HB 5.500 . 6.250 3.399 3.026 3.682 . 0 0 "[ . 1 . 2]" 1
362 1 25 ALA MB 1 33 VAL HB 4.200 . 4.950 2.270 2.136 2.546 . 0 0 "[ . 1 . 2]" 1
363 1 25 ALA HA 1 35 HIS QB 6.170 . 6.920 2.776 2.432 2.987 . 0 0 "[ . 1 . 2]" 1
364 1 25 ALA MB 1 35 HIS QB 6.070 . 6.820 2.242 2.121 2.488 . 0 0 "[ . 1 . 2]" 1
365 1 27 TYR HA 1 33 VAL HB 5.500 . 6.250 3.987 3.813 4.196 . 0 0 "[ . 1 . 2]" 1
366 1 16 ILE MD 1 23 HIS QB 8.070 . 8.820 4.145 3.216 5.452 . 0 0 "[ . 1 . 2]" 1
367 1 102 GLN QG 1 103 LYS H 5.050 . 5.800 3.994 3.138 4.512 . 0 0 "[ . 1 . 2]" 1
368 1 102 GLN H 1 102 GLN QG 3.930 . 4.680 2.686 2.493 3.554 . 0 0 "[ . 1 . 2]" 1
369 1 60 VAL QG 1 102 GLN QG 8.320 . 9.070 3.143 2.045 4.034 . 0 0 "[ . 1 . 2]" 1
370 1 99 MET QG 1 102 GLN QG 5.670 . 6.420 3.633 2.354 4.505 . 0 0 "[ . 1 . 2]" 1
371 1 116 PHE HA 1 119 GLN QG . . 5.800 4.097 2.317 4.503 . 0 0 "[ . 1 . 2]" 1
372 1 119 GLN H 1 119 GLN QG . . 4.680 2.722 2.408 3.560 . 0 0 "[ . 1 . 2]" 1
373 1 119 GLN QG 1 120 LEU H 7.860 . 8.610 4.451 2.821 4.754 . 0 0 "[ . 1 . 2]" 1
374 1 58 ALA H 1 59 GLU QB 5.670 . 6.420 3.554 3.387 3.652 . 0 0 "[ . 1 . 2]" 1
375 1 59 GLU QB 1 103 LYS QE 5.670 . 6.420 3.444 2.443 4.319 . 0 0 "[ . 1 . 2]" 1
376 1 59 GLU QB 1 61 LYS QE 5.670 . 6.420 4.284 2.075 4.579 . 0 0 "[ . 1 . 2]" 1
377 1 55 SER HA 1 59 GLU QB 12.470 . 13.220 3.744 3.473 3.840 . 0 0 "[ . 1 . 2]" 1
378 1 59 GLU QB 1 102 GLN HA 7.860 . 8.610 6.656 6.394 7.015 . 0 0 "[ . 1 . 2]" 1
379 1 103 LYS H 1 103 LYS QB . . 3.890 2.520 2.048 2.935 . 0 0 "[ . 1 . 2]" 1
380 1 99 MET H 1 99 MET QB . . 3.890 2.366 2.248 2.565 . 0 0 "[ . 1 . 2]" 1
381 1 99 MET QB 1 100 VAL H 5.050 . 5.800 3.235 2.797 3.832 . 0 0 "[ . 1 . 2]" 1
382 1 60 VAL QG 1 99 MET QB 6.810 . 7.560 2.432 1.999 3.391 . 0 0 "[ . 1 . 2]" 1
383 1 124 LYS QB 1 125 SER H . . 5.800 3.466 2.979 3.818 . 0 0 "[ . 1 . 2]" 1
384 1 85 GLN QG 1 86 PRO QD 7.140 . 7.890 3.544 2.546 4.100 . 0 0 "[ . 1 . 2]" 1
385 1 24 TRP QB 1 117 VAL QG . . 7.560 1.982 1.903 2.052 . 0 0 "[ . 1 . 2]" 1
386 1 24 TRP QB 1 35 HIS QB 7.410 . 8.160 4.523 4.337 4.758 . 0 0 "[ . 1 . 2]" 1
387 1 75 ARG QB 1 76 VAL H 5.050 . 5.800 2.928 2.401 3.857 . 0 0 "[ . 1 . 2]" 1
388 1 95 SER QB 1 99 MET QG 7.410 . 8.160 3.052 2.037 3.726 . 0 0 "[ . 1 . 2]" 1
389 1 99 MET H 1 99 MET QG . . 4.680 2.491 2.180 2.685 . 0 0 "[ . 1 . 2]" 1
390 1 99 MET QG 1 120 LEU QD 8.320 . 9.070 2.802 2.021 3.770 . 0 0 "[ . 1 . 2]" 1
391 1 36 LEU QD 1 104 MET QG . . 7.560 3.588 2.058 4.283 . 0 0 "[ . 1 . 2]" 1
392 1 57 SER HA 1 105 LYS QB 4.950 . 5.700 3.159 2.179 3.565 . 0 0 "[ . 1 . 2]" 1
393 1 99 MET QG 1 100 VAL H 7.410 . 7.560 3.804 2.522 4.430 . 0 0 "[ . 1 . 2]" 1
394 1 60 VAL QG 1 99 MET QG 10.590 . 11.340 3.482 2.100 4.004 . 0 0 "[ . 1 . 2]" 1
395 1 97 LYS H 1 97 LYS QB . . 3.890 2.355 2.311 2.401 . 0 0 "[ . 1 . 2]" 1
396 1 97 LYS QB 1 98 GLU H . . 4.680 2.936 2.529 3.262 . 0 0 "[ . 1 . 2]" 1
397 1 9 LYS QB 1 10 PRO QD . . 5.160 2.367 1.998 2.798 . 0 0 "[ . 1 . 2]" 1
398 1 83 GLU QB 1 84 TYR H . . 4.680 2.875 2.555 3.229 . 0 0 "[ . 1 . 2]" 1
399 1 83 GLU QB 1 84 TYR QE 5.670 . 6.420 3.111 2.806 3.541 . 0 0 "[ . 1 . 2]" 1
400 1 83 GLU QB 1 84 TYR HH 5.050 . 5.800 4.366 3.685 4.556 . 0 0 "[ . 1 . 2]" 1
401 1 80 LEU HA 1 83 GLU QB 6.170 . 6.920 2.761 2.093 3.957 . 0 0 "[ . 1 . 2]" 1
402 1 80 LEU QD 1 83 GLU QB 8.580 . 9.330 3.170 2.994 3.369 . 0 0 "[ . 1 . 2]" 1
403 1 88 PRO QB 1 89 VAL H . . 5.800 3.784 3.318 3.989 . 0 0 "[ . 1 . 2]" 1
404 1 88 PRO QB 1 91 VAL H . . 4.680 3.042 2.838 3.380 . 0 0 "[ . 1 . 2]" 1
405 1 88 PRO QB 1 91 VAL QG 7.140 . 7.890 2.431 2.237 2.964 . 0 0 "[ . 1 . 2]" 1
406 1 64 ARG QB 1 68 VAL HB 6.610 . 7.360 4.785 4.517 5.345 . 0 0 "[ . 1 . 2]" 1
407 1 62 ARG QB 1 100 VAL QG 8.320 . 9.070 2.132 1.998 2.366 . 0 0 "[ . 1 . 2]" 1
408 1 43 PRO QB 1 44 GLY H 6.070 . 6.820 2.593 2.334 2.800 . 0 0 "[ . 1 . 2]" 1
409 1 91 VAL H 1 91 VAL HB 3.500 . 3.550 2.515 2.384 2.697 . 0 0 "[ . 1 . 2]" 1
410 1 69 VAL H 1 69 VAL HB 3.500 . 4.250 2.718 2.274 3.636 . 0 0 "[ . 1 . 2]" 1
411 1 69 VAL HB 1 70 GLY H 4.500 . 5.250 3.233 2.624 4.399 . 0 0 "[ . 1 . 2]" 1
412 1 66 GLU HA 1 69 VAL HB 4.500 . 5.250 3.238 2.308 4.710 . 0 0 "[ . 1 . 2]" 1
413 1 68 VAL HB 1 69 VAL H . . 4.250 2.804 2.471 2.983 . 0 0 "[ . 1 . 2]" 1
414 1 68 VAL H 1 68 VAL HB 3.500 . 4.250 2.594 2.388 2.770 . 0 0 "[ . 1 . 2]" 1
415 1 89 VAL HB 1 90 GLU H 4.500 . 5.250 3.042 2.688 4.025 . 0 0 "[ . 1 . 2]" 1
416 1 89 VAL H 1 89 VAL HB 3.500 . 3.550 2.305 2.135 2.520 . 0 0 "[ . 1 . 2]" 1
417 1 88 PRO HA 1 89 VAL HB 4.500 . 5.250 4.428 4.202 4.545 . 0 0 "[ . 1 . 2]" 1
418 1 86 PRO QB 1 87 ARG H . . 5.800 3.424 2.744 4.100 . 0 0 "[ . 1 . 2]" 1
419 1 86 PRO QB 1 89 VAL QG 9.700 . 10.450 5.477 5.184 5.558 . 0 0 "[ . 1 . 2]" 1
420 1 100 VAL HB 1 101 GLY H 5.500 . 6.250 4.187 3.927 4.310 . 0 0 "[ . 1 . 2]" 1
421 1 99 MET H 1 100 VAL HB 5.500 . 6.250 5.125 4.834 5.518 . 0 0 "[ . 1 . 2]" 1
422 1 100 VAL H 1 100 VAL HB 3.500 . 3.550 2.513 2.323 2.817 . 0 0 "[ . 1 . 2]" 1
423 1 34 ILE MD 1 100 VAL HB 6.490 . 7.240 2.789 2.039 4.061 . 0 0 "[ . 1 . 2]" 1
424 1 8 PRO QB 1 9 LYS H . . 4.680 3.050 2.807 3.440 . 0 0 "[ . 1 . 2]" 1
425 1 8 PRO QB 1 14 ILE MD 6.810 . 7.560 2.284 2.097 2.864 . 0 0 "[ . 1 . 2]" 1
426 1 8 PRO QB 1 27 TYR QD 6.930 . 7.680 3.128 2.489 3.723 . 0 0 "[ . 1 . 2]" 1
427 1 78 ASN QB 1 87 ARG QB 8.730 . 9.480 5.980 5.146 6.270 . 0 0 "[ . 1 . 2]" 1
428 1 60 VAL HB 1 101 GLY H 4.500 . 5.250 2.867 2.204 3.821 . 0 0 "[ . 1 . 2]" 1
429 1 60 VAL H 1 60 VAL HB . . 4.250 2.549 2.453 2.715 . 0 0 "[ . 1 . 2]" 1
430 1 60 VAL HB 1 102 GLN H 4.500 . 5.250 2.604 2.234 2.867 . 0 0 "[ . 1 . 2]" 1
431 1 79 SER HA 1 87 ARG QB 7.410 . 8.160 4.763 4.082 5.447 . 0 0 "[ . 1 . 2]" 1
432 1 87 ARG QB 1 89 VAL HA 7.860 . 8.610 4.805 3.677 5.760 . 0 0 "[ . 1 . 2]" 1
433 1 115 HIS QB 1 116 PHE H 5.050 . 5.800 2.645 2.487 2.850 . 0 0 "[ . 1 . 2]" 1
434 1 114 GLU QB 1 115 HIS H . . 4.680 2.508 2.415 2.643 . 0 0 "[ . 1 . 2]" 1
435 1 98 GLU QB 1 99 MET HA 7.860 . 8.610 4.023 3.780 4.114 . 0 0 "[ . 1 . 2]" 1
436 1 7 GLU QB 1 8 PRO QD 5.670 . 6.420 3.618 2.814 3.927 . 0 0 "[ . 1 . 2]" 1
437 1 6 GLN QB 1 8 PRO QD . . 6.310 3.432 2.798 3.766 . 0 0 "[ . 1 . 2]" 1
438 1 13 LEU QD 1 121 ARG QB 9.990 . 10.740 2.645 2.090 3.580 . 0 0 "[ . 1 . 2]" 1
439 1 82 HIS QB 1 83 GLU H . . 5.800 3.114 2.664 3.920 . 0 0 "[ . 1 . 2]" 1
440 1 82 HIS QB 1 83 GLU QG 8.730 . 9.480 4.143 3.073 5.514 . 0 0 "[ . 1 . 2]" 1
441 1 77 ASN QD 1 82 HIS QB 8.820 . 9.570 6.587 4.578 7.042 . 0 0 "[ . 1 . 2]" 1
442 1 98 GLU H 1 98 GLU QB 3.140 . 3.890 2.333 2.291 2.392 . 0 0 "[ . 1 . 2]" 1
443 1 98 GLU QB 1 99 MET H . . 3.890 2.750 2.557 2.838 . 0 0 "[ . 1 . 2]" 1
444 1 6 GLN QB 1 8 PRO QD 8.180 . 8.930 3.211 2.165 3.646 . 0 0 "[ . 1 . 2]" 1
445 1 97 LYS H 1 97 LYS QD 5.050 . 5.800 3.991 3.603 4.340 . 0 0 "[ . 1 . 2]" 1
446 1 93 ILE MG 1 97 LYS QD 6.070 . 6.820 2.854 2.243 3.413 . 0 0 "[ . 1 . 2]" 1
447 1 28 ILE MD 1 97 LYS QD 7.410 . 8.160 3.208 2.410 4.080 . 0 0 "[ . 1 . 2]" 1
448 1 85 GLN QB 1 86 PRO QD 5.670 . 6.420 2.539 2.119 3.865 . 0 0 "[ . 1 . 2]" 1
449 1 64 ARG QB 1 67 ASP H . . 4.280 2.909 2.546 3.181 . 0 0 "[ . 1 . 2]" 1
450 1 37 ALA MB 1 61 LYS QD 4.720 . 4.990 2.227 2.005 3.118 . 0 0 "[ . 1 . 2]" 1
451 1 72 CYS QB 1 73 CYS H . . 4.680 2.456 2.127 2.917 . 0 0 "[ . 1 . 2]" 1
452 1 72 CYS H 1 72 CYS QB . . 3.890 2.450 2.225 2.572 . 0 0 "[ . 1 . 2]" 1
453 1 18 ARG HA 1 72 CYS QB 5.050 . 5.800 3.251 2.526 4.260 . 0 0 "[ . 1 . 2]" 1
454 1 16 ILE MG 1 72 CYS QB 6.070 . 6.820 2.993 2.036 3.868 . 0 0 "[ . 1 . 2]" 1
455 1 69 VAL QG 1 72 CYS QB 8.320 . 9.070 3.221 2.390 4.214 . 0 0 "[ . 1 . 2]" 1
456 1 85 GLN H 1 85 GLN QB 3.140 . 3.890 2.756 2.183 2.973 . 0 0 "[ . 1 . 2]" 1
457 1 85 GLN QB 1 87 ARG QB 5.560 . 6.310 2.773 1.983 3.910 . 0 0 "[ . 1 . 2]" 1
458 1 65 LEU QD 1 66 GLU QB 11.890 . 12.640 3.694 3.061 4.042 . 0 0 "[ . 1 . 2]" 1
459 1 34 ILE QG 1 62 ARG HA . . 5.800 4.064 3.097 4.520 . 0 0 "[ . 1 . 2]" 1
460 1 57 SER HA 1 105 LYS QD 3.930 . 4.680 3.079 2.210 3.586 . 0 0 "[ . 1 . 2]" 1
461 1 34 ILE QG 1 64 ARG HA 7.780 . 8.530 3.960 3.582 5.426 . 0 0 "[ . 1 . 2]" 1
462 1 37 ALA HA 1 61 LYS QD 8.320 . 9.070 4.563 4.135 5.865 . 0 0 "[ . 1 . 2]" 1
463 1 59 GLU QB 1 61 LYS QD 3.530 . 4.280 2.759 2.623 2.868 . 0 0 "[ . 1 . 2]" 1
464 1 60 VAL QG 1 102 GLN QB 6.810 . 7.560 2.932 2.113 3.922 . 0 0 "[ . 1 . 2]" 1
465 1 66 GLU H 1 66 GLU QB . . 3.890 2.448 2.357 2.624 . 0 0 "[ . 1 . 2]" 1
466 1 66 GLU QB 1 68 VAL H 8.820 . 9.570 4.382 4.147 4.601 . 0 0 "[ . 1 . 2]" 1
467 1 66 GLU QB 1 67 ASP H 5.050 . 5.800 3.706 3.612 3.811 . 0 0 "[ . 1 . 2]" 1
468 1 66 GLU QB 1 68 VAL QG 8.180 . 8.930 3.980 3.184 4.449 . 0 0 "[ . 1 . 2]" 1
469 1 9 LYS H 1 9 LYS QD 5.050 . 5.800 2.910 2.415 3.765 . 0 0 "[ . 1 . 2]" 1
470 1 58 ALA H 1 103 LYS QD 7.280 . 8.030 4.346 3.010 4.917 . 0 0 "[ . 1 . 2]" 1
471 1 103 LYS H 1 103 LYS QD 5.050 . 5.800 4.186 2.521 4.529 . 0 0 "[ . 1 . 2]" 1
472 1 59 GLU HA 1 103 LYS QD 6.170 . 6.920 4.572 2.922 5.282 . 0 0 "[ . 1 . 2]" 1
473 1 9 LYS QD 1 10 PRO QD 5.670 . 6.420 3.756 2.907 4.541 . 0 0 "[ . 1 . 2]" 1
474 1 7 GLU QB 1 9 LYS QD 4.410 . 5.160 3.526 3.328 3.575 . 0 0 "[ . 1 . 2]" 1
475 1 89 VAL QG 1 90 GLU QB 9.340 . 10.090 3.072 2.743 3.538 . 0 0 "[ . 1 . 2]" 1
476 1 90 GLU QB 1 91 VAL H . . 4.680 2.927 2.495 3.553 . 0 0 "[ . 1 . 2]" 1
477 1 90 GLU QB 1 91 VAL QG 8.320 . 9.070 3.309 2.770 4.315 . 0 0 "[ . 1 . 2]" 1
478 1 6 GLN QG 1 9 LYS QD 8.820 . 9.570 6.782 5.830 7.107 . 0 0 "[ . 1 . 2]" 1
479 1 88 PRO QG 1 91 VAL QG 8.020 . 8.770 2.590 2.184 3.021 . 0 0 "[ . 1 . 2]" 1
480 1 80 LEU QD 1 121 ARG QG 6.670 . 7.420 4.200 3.493 4.466 . 0 0 "[ . 1 . 2]" 1
481 1 73 CYS QB 1 74 TYR H . . 3.890 2.690 2.408 2.812 . 0 0 "[ . 1 . 2]" 1
482 1 17 PHE QB 1 73 CYS QB 3.530 . 4.280 2.466 2.135 2.811 . 0 0 "[ . 1 . 2]" 1
483 1 93 ILE H 1 93 ILE QG . . 4.680 2.333 2.115 2.505 . 0 0 "[ . 1 . 2]" 1
484 1 13 LEU QD 1 121 ARG QG 6.810 . 7.560 3.397 2.267 4.362 . 0 0 "[ . 1 . 2]" 1
485 1 17 PHE QD 1 73 CYS QB 6.930 . 7.680 3.488 2.596 4.260 . 0 0 "[ . 1 . 2]" 1
486 1 64 ARG H 1 64 ARG QG . . 3.890 2.662 2.473 2.845 . 0 0 "[ . 1 . 2]" 1
487 1 32 TYR QD 1 64 ARG QG 6.930 . 7.680 3.035 2.609 4.118 . 0 0 "[ . 1 . 2]" 1
488 1 63 GLU HA 1 64 ARG QG 6.170 . 6.920 3.815 3.458 4.223 . 0 0 "[ . 1 . 2]" 1
489 1 16 ILE QG 1 74 TYR QB 8.730 . 9.480 2.869 2.095 4.026 . 0 0 "[ . 1 . 2]" 1
490 1 18 ARG QG 1 23 HIS H 9.900 . 10.650 2.766 2.432 4.191 . 0 0 "[ . 1 . 2]" 1
491 1 116 PHE HA 1 119 GLN QB 5.050 . 5.800 2.773 2.428 4.291 . 0 0 "[ . 1 . 2]" 1
492 1 119 GLN H 1 119 GLN QB . . 3.890 2.288 2.146 2.517 . 0 0 "[ . 1 . 2]" 1
493 1 119 GLN QB 1 120 LEU H . . 5.800 3.033 2.832 3.865 . 0 0 "[ . 1 . 2]" 1
494 1 26 LEU HG 1 95 SER QB 6.930 . 7.680 4.407 4.087 5.506 . 0 0 "[ . 1 . 2]" 1
495 1 11 GLY QA 1 26 LEU HG 8.410 . 9.160 4.449 4.199 5.600 . 0 0 "[ . 1 . 2]" 1
496 1 26 LEU HG 1 120 LEU QB 6.170 . 6.920 3.363 2.709 4.548 . 0 0 "[ . 1 . 2]" 1
497 1 26 LEU HG 1 34 ILE QG 6.990 . 7.740 4.536 4.497 4.582 . 0 0 "[ . 1 . 2]" 1
498 1 13 LEU QD 1 26 LEU HG 6.810 . 7.560 4.039 3.761 4.459 . 0 0 "[ . 1 . 2]" 1
499 1 26 LEU HG 1 120 LEU QD 4.720 . 5.470 2.355 2.124 3.582 . 0 0 "[ . 1 . 2]" 1
500 1 85 GLN HA 1 86 PRO QG 5.050 . 5.800 4.034 3.892 4.083 . 0 0 "[ . 1 . 2]" 1
501 1 85 GLN QG 1 86 PRO QG 6.930 . 7.680 4.902 3.663 5.562 . 0 0 "[ . 1 . 2]" 1
502 1 39 PRO QG 1 113 CYS QB 8.820 . 9.570 6.938 6.028 7.085 . 0 0 "[ . 1 . 2]" 1
503 1 21 TYR HA 1 39 PRO QG 8.320 . 9.070 4.242 3.419 5.204 . 0 0 "[ . 1 . 2]" 1
504 1 92 ILE H 1 92 ILE QG . . 3.890 2.372 1.970 2.717 . 0 0 "[ . 1 . 2]" 1
505 1 15 GLU QG 1 113 CYS QB 11.110 . 11.860 3.162 2.216 3.825 . 0 0 "[ . 1 . 2]" 1
506 1 110 SER HA 1 111 ARG QG 6.070 . 6.820 4.600 4.571 4.646 . 0 0 "[ . 1 . 2]" 1
507 1 109 VAL HA 1 111 ARG QG 7.860 . 8.610 6.866 6.517 7.068 . 0 0 "[ . 1 . 2]" 1
508 1 107 SER QB 1 111 ARG QG . . 6.420 3.126 2.356 4.139 . 0 0 "[ . 1 . 2]" 1
509 1 39 PRO QD 1 111 ARG QG 9.900 . 10.650 6.637 6.462 6.790 . 0 0 "[ . 1 . 2]" 1
510 1 87 ARG H 1 92 ILE QG 6.360 . 7.110 4.117 3.674 4.482 . 0 0 "[ . 1 . 2]" 1
511 1 111 ARG QG 1 115 HIS HA 6.170 . 6.920 4.715 4.680 4.763 . 0 0 "[ . 1 . 2]" 1
512 1 18 ARG HA 1 19 LEU HG 4.500 . 5.250 4.117 2.587 4.573 . 0 0 "[ . 1 . 2]" 1
513 1 87 ARG QG 1 89 VAL HA 6.170 . 6.920 3.749 2.629 5.499 . 0 0 "[ . 1 . 2]" 1
514 1 19 LEU H 1 19 LEU HG 4.500 . 5.250 3.162 2.270 3.994 . 0 0 "[ . 1 . 2]" 1
515 1 19 LEU HG 1 23 HIS HD2 7.000 . 7.750 5.699 3.252 7.111 . 0 0 "[ . 1 . 2]" 1
516 1 28 ILE MG 1 97 LYS QG 9.340 . 10.090 2.423 2.188 2.646 . 0 0 "[ . 1 . 2]" 1
517 1 80 LEU H 1 80 LEU HG 4.500 . 5.250 3.252 2.190 4.530 . 0 0 "[ . 1 . 2]" 1
518 1 28 ILE QG 1 29 GLY H 6.170 . 6.920 2.657 2.528 3.097 . 0 0 "[ . 1 . 2]" 1
519 1 26 LEU QD 1 27 TYR H . . 6.820 2.469 2.271 2.637 . 0 0 "[ . 1 . 2]" 1
520 1 13 LEU QD 1 24 TRP HD1 7.410 . 8.160 5.166 4.070 5.525 . 0 0 "[ . 1 . 2]" 1
521 1 13 LEU QD 1 78 ASN QB 8.320 . 9.070 3.660 2.288 5.000 . 0 0 "[ . 1 . 2]" 1
522 1 13 LEU QD 1 78 ASN HA . . 5.470 2.577 2.065 3.548 . 0 0 "[ . 1 . 2]" 1
523 1 13 LEU QD 1 79 SER QB 8.900 . 9.650 4.205 3.468 4.947 . 0 0 "[ . 1 . 2]" 1
524 1 97 LYS H 1 97 LYS QG . . 4.680 2.378 2.273 2.463 . 0 0 "[ . 1 . 2]" 1
525 1 8 PRO QG 1 9 LYS H 6.170 . 6.920 4.466 4.237 4.685 . 0 0 "[ . 1 . 2]" 1
526 1 8 PRO QG 1 29 GLY H 8.820 . 9.570 4.005 2.203 4.953 . 0 0 "[ . 1 . 2]" 1
527 1 8 PRO QG 1 65 LEU QD 8.580 . 9.330 2.121 1.936 2.630 . 0 0 "[ . 1 . 2]" 1
528 1 14 ILE H 1 14 ILE QG . . 4.680 2.323 2.084 2.716 . 0 0 "[ . 1 . 2]" 1
529 1 8 PRO QB 1 14 ILE QG 6.240 . 6.990 2.198 1.966 2.497 . 0 0 "[ . 1 . 2]" 1
530 1 14 ILE QG 1 16 ILE MD 5.930 . 6.680 3.233 3.098 3.362 . 0 0 "[ . 1 . 2]" 1
531 1 65 LEU HG 1 66 GLU H 5.500 . 6.250 3.507 3.242 3.702 . 0 0 "[ . 1 . 2]" 1
532 1 13 LEU H 1 13 LEU HG . . 5.250 2.645 2.080 4.297 . 0 0 "[ . 1 . 2]" 1
533 1 120 LEU H 1 120 LEU HG . . 5.250 2.551 2.298 4.032 . 0 0 "[ . 1 . 2]" 1
534 1 116 PHE QE 1 120 LEU QD 8.320 . 9.070 2.462 2.248 2.607 . 0 0 "[ . 1 . 2]" 1
535 1 99 MET QB 1 120 LEU QD 8.900 . 9.650 2.753 2.334 3.538 . 0 0 "[ . 1 . 2]" 1
536 1 26 LEU QB 1 120 LEU QD 10.590 . 11.340 2.141 1.973 2.440 . 0 0 "[ . 1 . 2]" 1
537 1 26 LEU QD 1 120 LEU QD 6.800 . 7.550 2.256 1.838 2.560 . 0 0 "[ . 1 . 2]" 1
538 1 11 GLY H 1 26 LEU QD 9.440 . 10.190 2.941 2.662 3.330 . 0 0 "[ . 1 . 2]" 1
539 1 13 LEU HA 1 26 LEU QD 7.410 . 8.160 2.987 2.685 3.359 . 0 0 "[ . 1 . 2]" 1
540 1 26 LEU QD 1 34 ILE QG 9.990 . 10.740 2.511 2.123 3.196 . 0 0 "[ . 1 . 2]" 1
541 1 10 PRO HA 1 26 LEU QD 7.280 . 8.030 3.838 3.477 4.149 . 0 0 "[ . 1 . 2]" 1
542 1 26 LEU QD 1 117 VAL HB 7.410 . 8.160 4.494 4.111 5.024 . 0 0 "[ . 1 . 2]" 1
543 1 26 LEU QD 1 120 LEU QB 6.810 . 7.560 2.684 2.007 3.434 . 0 0 "[ . 1 . 2]" 1
544 1 26 LEU QD 1 120 LEU QD 8.180 . 8.930 2.292 1.841 2.614 . 0 0 "[ . 1 . 2]" 1
545 1 36 LEU QD 1 37 ALA H . . 7.560 2.506 2.149 2.800 . 0 0 "[ . 1 . 2]" 1
546 1 36 LEU QD 1 39 PRO QD 11.890 . 12.640 2.286 2.049 2.995 . 0 0 "[ . 1 . 2]" 1
547 1 36 LEU QD 1 112 ASN QB 8.320 . 9.070 3.318 2.203 3.895 . 0 0 "[ . 1 . 2]" 1
548 1 36 LEU QD 1 99 MET QG 10.590 . 11.340 6.331 5.012 7.000 . 0 0 "[ . 1 . 2]" 1
549 1 8 PRO QG 1 65 LEU QD . . 6.050 2.124 1.939 2.636 . 0 0 "[ . 1 . 2]" 1
550 1 65 LEU QD 1 66 GLU H 7.410 . 8.160 3.737 3.574 3.861 . 0 0 "[ . 1 . 2]" 1
551 1 65 LEU QD 1 67 ASP H 7.280 . 8.030 3.506 2.954 4.006 . 0 0 "[ . 1 . 2]" 1
552 1 29 GLY H 1 65 LEU QD 6.810 . 7.560 3.317 2.554 4.278 . 0 0 "[ . 1 . 2]" 1
553 1 31 GLY QA 1 65 LEU QD 8.320 . 9.070 3.386 2.635 3.949 . 0 0 "[ . 1 . 2]" 1
554 1 8 PRO QD 1 65 LEU QD 11.890 . 12.640 2.757 2.210 3.537 . 0 0 "[ . 1 . 2]" 1
555 1 58 ALA H 1 103 LYS QG 7.410 . 8.160 3.430 2.659 4.136 . 0 0 "[ . 1 . 2]" 1
556 1 103 LYS H 1 103 LYS QG . . 4.680 3.031 2.405 3.800 . 0 0 "[ . 1 . 2]" 1
557 1 59 GLU HA 1 103 LYS QG . . 5.800 3.052 2.224 4.569 . 0 0 "[ . 1 . 2]" 1
558 1 37 ALA MB 1 61 LYS QG . . 8.030 2.892 2.217 3.606 . 0 0 "[ . 1 . 2]" 1
559 1 75 ARG QG 1 76 VAL H 7.780 . 8.530 3.143 2.276 3.753 . 0 0 "[ . 1 . 2]" 1
560 1 80 LEU QD 1 118 THR HA 9.440 . 10.190 4.026 2.624 4.649 . 0 0 "[ . 1 . 2]" 1
561 1 24 TRP H 1 36 LEU QD 8.900 . 9.650 3.776 3.444 4.096 . 0 0 "[ . 1 . 2]" 1
562 1 80 LEU QD 1 84 TYR QE 6.810 . 7.560 2.597 2.152 3.466 . 0 0 "[ . 1 . 2]" 1
563 1 80 LEU QD 1 84 TYR HH 6.070 . 6.820 2.142 1.607 2.654 0.193 19 0 "[ . 1 . 2]" 1
564 1 36 LEU QD 1 60 VAL HA 6.070 . 6.820 2.840 2.491 3.052 . 0 0 "[ . 1 . 2]" 1
565 1 36 LEU QD 1 83 GLU QG 8.580 . 9.330 2.612 2.039 3.180 . 0 0 "[ . 1 . 2]" 1
566 1 57 SER HA 1 105 LYS QG 5.050 . 5.800 2.994 2.144 4.541 . 0 0 "[ . 1 . 2]" 1
567 1 65 LEU QD 1 69 VAL H 9.440 . 10.190 3.765 3.493 3.989 . 0 0 "[ . 1 . 2]" 1
568 1 65 LEU QD 1 68 VAL H 8.320 . 9.070 4.412 4.263 4.557 . 0 0 "[ . 1 . 2]" 1
569 1 27 TYR QD 1 65 LEU QD 6.810 . 7.560 2.693 2.409 3.016 . 0 0 "[ . 1 . 2]" 1
570 1 65 LEU QD 1 66 GLU HA 7.410 . 8.160 4.209 3.988 4.357 . 0 0 "[ . 1 . 2]" 1
571 1 14 ILE QG 1 65 LEU QD 7.640 . 8.390 3.724 3.538 3.979 . 0 0 "[ . 1 . 2]" 1
572 1 33 VAL QG 1 65 LEU QD 5.090 . 5.840 2.146 2.060 2.335 . 0 0 "[ . 1 . 2]" 1
573 1 100 VAL QG 1 101 GLY H . . 4.520 2.609 2.440 2.757 . 0 0 "[ . 1 . 2]" 1
574 1 99 MET H 1 100 VAL QG . . 6.820 4.122 3.920 4.379 . 0 0 "[ . 1 . 2]" 1
575 1 34 ILE MD 1 100 VAL QG 5.440 . 6.190 2.105 1.891 2.424 . 0 0 "[ . 1 . 2]" 1
576 1 116 PHE QD 1 117 VAL QG 5.300 . 6.050 2.406 2.264 2.559 . 0 0 "[ . 1 . 2]" 1
577 1 25 ALA HA 1 117 VAL QG 6.070 . 6.820 4.477 4.290 4.557 . 0 0 "[ . 1 . 2]" 1
578 1 114 GLU HA 1 117 VAL QG . . 6.820 2.130 2.039 2.315 . 0 0 "[ . 1 . 2]" 1
579 1 26 LEU H 1 117 VAL QG 8.320 . 9.070 4.790 4.431 5.066 . 0 0 "[ . 1 . 2]" 1
580 1 26 LEU HA 1 117 VAL QG 9.440 . 10.190 4.926 4.708 5.216 . 0 0 "[ . 1 . 2]" 1
581 1 35 HIS HA 1 117 VAL QG 7.410 . 8.160 5.062 4.571 5.340 . 0 0 "[ . 1 . 2]" 1
582 1 26 LEU QB 1 117 VAL QG 6.810 . 7.560 3.811 3.338 4.144 . 0 0 "[ . 1 . 2]" 1
583 1 15 GLU QG 1 117 VAL QG 6.670 . 7.420 3.520 3.459 3.576 . 0 0 "[ . 1 . 2]" 1
584 1 14 ILE MD 1 117 VAL QG 8.900 . 9.650 4.240 4.052 4.507 . 0 0 "[ . 1 . 2]" 1
585 1 117 VAL QG 1 120 LEU QD 8.180 . 8.930 2.304 2.057 2.668 . 0 0 "[ . 1 . 2]" 1
586 1 62 ARG H 1 100 VAL QG . . 6.820 3.124 2.463 3.946 . 0 0 "[ . 1 . 2]" 1
587 1 61 LYS HA 1 100 VAL QG . . 5.470 2.760 2.190 3.342 . 0 0 "[ . 1 . 2]" 1
588 1 60 VAL HB 1 100 VAL QG 8.900 . 9.650 3.758 3.359 4.064 . 0 0 "[ . 1 . 2]" 1
589 1 26 LEU QB 1 100 VAL QG 9.340 . 10.090 4.779 4.435 5.153 . 0 0 "[ . 1 . 2]" 1
590 1 19 LEU QD 1 20 GLY H 7.410 . 7.560 3.585 2.223 4.378 . 0 0 "[ . 1 . 2]" 1
591 1 36 LEU QD 1 60 VAL H 6.810 . 7.560 3.249 2.820 3.750 . 0 0 "[ . 1 . 2]" 1
592 1 36 LEU QD 1 59 GLU HA 7.410 . 8.160 3.536 2.959 4.101 . 0 0 "[ . 1 . 2]" 1
593 1 36 LEU QD 1 37 ALA HA 7.280 . 8.030 2.744 2.463 2.933 . 0 0 "[ . 1 . 2]" 1
594 1 36 LEU QD 1 104 MET ME 7.280 . 8.030 2.369 1.899 3.410 . 0 0 "[ . 1 . 2]" 1
595 1 13 LEU QD 1 14 ILE H . . 5.470 3.444 2.124 3.621 . 0 0 "[ . 1 . 2]" 1
596 1 13 LEU QD 1 26 LEU HA 6.070 . 6.820 3.713 2.773 4.548 . 0 0 "[ . 1 . 2]" 1
597 1 13 LEU QD 1 77 ASN QB 5.670 . 6.420 2.182 1.942 2.454 . 0 0 "[ . 1 . 2]" 1
598 1 13 LEU QD 1 26 LEU QD 5.710 . 6.460 1.865 1.656 2.097 0.144 11 0 "[ . 1 . 2]" 1
599 1 13 LEU QD 1 117 VAL HA 6.070 . 6.820 3.603 3.183 4.217 . 0 0 "[ . 1 . 2]" 1
600 1 33 VAL QG 1 34 ILE H 6.810 . 7.560 3.192 3.146 3.276 . 0 0 "[ . 1 . 2]" 1
601 1 33 VAL QG 1 63 GLU H 4.720 . 5.470 3.040 2.618 3.193 . 0 0 "[ . 1 . 2]" 1
602 1 26 LEU H 1 33 VAL QG . . 9.070 2.762 2.556 3.170 . 0 0 "[ . 1 . 2]" 1
603 1 28 ILE H 1 33 VAL QG 7.410 . 8.160 3.470 3.349 3.646 . 0 0 "[ . 1 . 2]" 1
604 1 33 VAL QG 1 35 HIS HD2 6.070 . 6.820 2.766 2.403 4.349 . 0 0 "[ . 1 . 2]" 1
605 1 27 TYR QD 1 33 VAL QG 5.300 . 6.050 2.292 2.048 3.354 . 0 0 "[ . 1 . 2]" 1
606 1 32 TYR HA 1 33 VAL QG 6.070 . 6.820 3.222 2.942 3.386 . 0 0 "[ . 1 . 2]" 1
607 1 27 TYR HA 1 33 VAL QG 4.720 . 5.470 2.115 2.056 2.255 . 0 0 "[ . 1 . 2]" 1
608 1 31 GLY QA 1 33 VAL QG 11.330 . 12.080 2.990 2.651 3.504 . 0 0 "[ . 1 . 2]" 1
609 1 33 VAL QG 1 63 GLU QG 5.300 . 6.050 3.461 2.835 3.604 . 0 0 "[ . 1 . 2]" 1
610 1 80 LEU QD 1 115 HIS HA 8.320 . 9.070 4.728 3.919 5.120 . 0 0 "[ . 1 . 2]" 1
611 1 80 LEU QD 1 83 GLU HA 7.410 . 8.160 5.528 5.429 5.576 . 0 0 "[ . 1 . 2]" 1
612 1 89 VAL QG 1 90 GLU H . . 5.470 3.130 2.916 3.481 . 0 0 "[ . 1 . 2]" 1
613 1 10 PRO QB 1 89 VAL QG 5.300 . 6.050 3.359 2.863 3.560 . 0 0 "[ . 1 . 2]" 1
614 1 87 ARG QB 1 89 VAL QG 5.090 . 5.840 2.393 1.975 2.747 . 0 0 "[ . 1 . 2]" 1
615 1 25 ALA MB 1 26 LEU H . . 4.950 2.756 2.404 3.181 . 0 0 "[ . 1 . 2]" 1
616 1 25 ALA MB 1 33 VAL HA 8.410 . 9.160 4.338 4.200 4.568 . 0 0 "[ . 1 . 2]" 1
617 1 25 ALA MB 1 35 HIS HA 5.400 . 6.150 3.463 3.124 4.025 . 0 0 "[ . 1 . 2]" 1
618 1 16 ILE MD 1 25 ALA MB 4.850 . 5.600 2.083 1.925 2.319 . 0 0 "[ . 1 . 2]" 1
619 1 14 ILE H 1 25 ALA MB . . 6.150 3.672 3.537 3.894 . 0 0 "[ . 1 . 2]" 1
620 1 25 ALA MB 1 34 ILE H 7.410 . 8.160 3.665 3.518 3.966 . 0 0 "[ . 1 . 2]" 1
621 1 63 GLU HA 1 68 VAL QG 7.410 . 8.160 4.597 4.239 5.235 . 0 0 "[ . 1 . 2]" 1
622 1 84 TYR QE 1 118 THR MG 8.320 . 9.070 2.831 2.326 3.683 . 0 0 "[ . 1 . 2]" 1
623 1 96 ALA H 1 120 LEU QD 6.070 . 6.820 3.310 2.754 3.915 . 0 0 "[ . 1 . 2]" 1
624 1 99 MET ME 1 120 LEU QD 7.280 . 8.030 3.174 2.087 3.670 . 0 0 "[ . 1 . 2]" 1
625 1 37 ALA H 1 60 VAL QG 7.280 . 8.030 3.178 2.982 3.313 . 0 0 "[ . 1 . 2]" 1
626 1 59 GLU HA 1 60 VAL QG . . 6.820 3.700 3.546 3.846 . 0 0 "[ . 1 . 2]" 1
627 1 60 VAL QG 1 104 MET QG 6.810 . 7.560 3.944 2.440 4.522 . 0 0 "[ . 1 . 2]" 1
628 1 64 ARG H 1 68 VAL QG 7.410 . 8.160 3.821 3.339 4.314 . 0 0 "[ . 1 . 2]" 1
629 1 68 VAL QG 1 69 VAL H 7.410 . 8.160 3.323 3.114 3.419 . 0 0 "[ . 1 . 2]" 1
630 1 67 ASP H 1 68 VAL QG 8.900 . 9.650 3.924 3.828 4.047 . 0 0 "[ . 1 . 2]" 1
631 1 18 ARG HA 1 68 VAL QG 7.410 . 8.160 4.922 3.765 5.556 . 0 0 "[ . 1 . 2]" 1
632 1 63 GLU QG 1 68 VAL QG 8.320 . 9.070 2.182 2.055 2.560 . 0 0 "[ . 1 . 2]" 1
633 1 63 GLU QB 1 68 VAL QG 7.640 . 8.390 2.003 1.877 2.356 . 0 0 "[ . 1 . 2]" 1
634 1 64 ARG QB 1 68 VAL QG 7.640 . 8.390 4.055 3.906 4.232 . 0 0 "[ . 1 . 2]" 1
635 1 25 ALA MB 1 68 VAL QG 8.900 . 9.650 2.703 2.270 3.257 . 0 0 "[ . 1 . 2]" 1
636 1 33 VAL QG 1 68 VAL QG 8.180 . 8.930 2.002 1.934 2.097 . 0 0 "[ . 1 . 2]" 1
637 1 115 HIS H 1 118 THR MG 7.410 . 8.160 3.805 3.596 3.943 . 0 0 "[ . 1 . 2]" 1
638 1 84 TYR HH 1 118 THR MG 6.610 . 7.360 5.209 3.931 5.600 . 0 0 "[ . 1 . 2]" 1
639 1 118 THR MG 1 122 TYR HA 4.200 . 4.950 3.339 2.829 3.506 . 0 0 "[ . 1 . 2]" 1
640 1 118 THR MG 1 119 GLN HA 6.610 . 7.360 4.118 3.786 4.261 . 0 0 "[ . 1 . 2]" 1
641 1 118 THR MG 1 125 SER QB 9.440 . 10.190 3.420 2.350 6.015 . 0 0 "[ . 1 . 2]" 1
642 1 80 LEU QD 1 118 THR MG 5.090 . 5.840 2.903 2.058 3.178 . 0 0 "[ . 1 . 2]" 1
643 1 58 ALA MB 1 59 GLU H 4.200 . 4.950 2.696 2.506 3.129 . 0 0 "[ . 1 . 2]" 1
644 1 23 HIS HD2 1 58 ALA MB 10.370 . 11.120 5.527 5.410 5.568 . 0 0 "[ . 1 . 2]" 1
645 1 57 SER HA 1 58 ALA MB 6.070 . 6.820 3.772 3.609 3.996 . 0 0 "[ . 1 . 2]" 1
646 1 10 PRO QD 1 58 ALA MB 8.180 . 8.930 3.972 3.729 4.440 . 0 0 "[ . 1 . 2]" 1
647 1 88 PRO QB 1 91 VAL QG . . 6.050 2.439 2.238 2.975 . 0 0 "[ . 1 . 2]" 1
648 1 69 VAL QG 1 72 CYS H 6.070 . 6.820 3.274 2.207 4.459 . 0 0 "[ . 1 . 2]" 1
649 1 69 VAL QG 1 74 TYR HH 7.410 . 8.160 4.166 3.282 4.725 . 0 0 "[ . 1 . 2]" 1
650 1 69 VAL QG 1 74 TYR QB . . 9.070 2.600 2.359 3.059 . 0 0 "[ . 1 . 2]" 1
651 1 69 VAL QG 1 70 GLY H . . 5.470 3.122 2.162 3.534 . 0 0 "[ . 1 . 2]" 1
652 1 69 VAL QG 1 74 TYR QD 5.300 . 6.050 2.396 2.104 2.936 . 0 0 "[ . 1 . 2]" 1
653 1 69 VAL QG 1 72 CYS QB 7.640 . 8.390 3.189 2.385 4.109 . 0 0 "[ . 1 . 2]" 1
654 1 60 VAL QG 1 61 LYS H . . 5.470 2.709 2.545 2.910 . 0 0 "[ . 1 . 2]" 1
655 1 60 VAL QG 1 116 PHE QE 6.810 . 7.560 2.103 2.004 2.219 . 0 0 "[ . 1 . 2]" 1
656 1 36 LEU HA 1 60 VAL QG 7.410 . 8.160 3.065 2.649 3.319 . 0 0 "[ . 1 . 2]" 1
657 1 60 VAL QG 1 104 MET ME . . 6.420 2.675 1.999 3.524 . 0 0 "[ . 1 . 2]" 1
658 1 60 VAL QG 1 99 MET HA 11.330 . 12.080 3.705 3.564 3.966 . 0 0 "[ . 1 . 2]" 1
659 1 60 VAL QG 1 99 MET ME 6.170 . 6.920 2.081 1.857 2.227 . 0 0 "[ . 1 . 2]" 1
660 1 91 VAL QG 1 92 ILE H 8.320 . 9.070 3.281 3.034 3.456 . 0 0 "[ . 1 . 2]" 1
661 1 37 ALA H 1 91 VAL QG 9.990 . 10.740 4.103 4.023 4.188 . 0 0 "[ . 1 . 2]" 1
662 1 62 ARG QB 1 91 VAL QG 7.140 . 7.890 2.084 1.932 2.228 . 0 0 "[ . 1 . 2]" 1
663 1 76 VAL QG 1 77 ASN H . . 5.470 2.493 2.277 2.672 . 0 0 "[ . 1 . 2]" 1
664 1 12 ASP QB 1 76 VAL QG . . 8.390 2.219 1.922 2.885 . 0 0 "[ . 1 . 2]" 1
665 1 8 PRO QB 1 76 VAL QG . . 6.050 2.701 2.106 3.524 . 0 0 "[ . 1 . 2]" 1
666 1 14 ILE MD 1 76 VAL QG 5.090 . 5.840 2.578 2.038 2.824 . 0 0 "[ . 1 . 2]" 1
667 1 89 VAL QG 1 90 GLU QG 8.320 . 9.070 3.768 3.010 5.055 . 0 0 "[ . 1 . 2]" 1
668 1 16 ILE MG 1 69 VAL QG 6.800 . 7.550 2.430 2.060 3.326 . 0 0 "[ . 1 . 2]" 1
669 1 13 LEU QD 1 117 VAL QG 5.090 . 5.840 2.003 1.801 2.184 . 0 0 "[ . 1 . 2]" 1
670 1 69 VAL QG 1 74 TYR QE 6.810 . 7.560 2.591 2.156 3.046 . 0 0 "[ . 1 . 2]" 1
671 1 14 ILE HA 1 69 VAL QG 8.900 . 9.650 4.888 4.071 5.424 . 0 0 "[ . 1 . 2]" 1
672 1 68 VAL HA 1 69 VAL QG 6.070 . 6.820 4.580 4.386 4.649 . 0 0 "[ . 1 . 2]" 1
673 1 68 VAL HB 1 69 VAL QG 4.720 . 5.470 3.064 2.592 3.252 . 0 0 "[ . 1 . 2]" 1
674 1 16 ILE QG 1 69 VAL QG 6.810 . 7.560 3.183 2.374 4.499 . 0 0 "[ . 1 . 2]" 1
675 1 8 PRO QG 1 69 VAL QG 5.670 . 6.420 2.367 2.154 2.613 . 0 0 "[ . 1 . 2]" 1
676 1 117 VAL QG 1 118 THR H . . 5.470 2.642 2.434 2.860 . 0 0 "[ . 1 . 2]" 1
677 1 24 TRP HD1 1 117 VAL QG 6.070 . 6.820 2.778 2.426 3.269 . 0 0 "[ . 1 . 2]" 1
678 1 13 LEU QB 1 117 VAL QG 6.810 . 7.560 3.064 2.631 4.070 . 0 0 "[ . 1 . 2]" 1
679 1 76 VAL QG 1 78 ASN QD 6.810 . 7.560 4.041 3.136 4.512 . 0 0 "[ . 1 . 2]" 1
680 1 76 VAL QG 1 78 ASN H . . 6.820 3.749 2.604 4.529 . 0 0 "[ . 1 . 2]" 1
681 1 12 ASP HA 1 76 VAL QG 6.810 . 7.560 3.292 2.991 3.593 . 0 0 "[ . 1 . 2]" 1
682 1 13 LEU HG 1 76 VAL QG 6.070 . 6.820 4.550 4.173 4.648 . 0 0 "[ . 1 . 2]" 1
683 1 49 SER QB 1 53 VAL QG 7.640 . 8.390 3.823 2.757 4.581 . 0 0 "[ . 1 . 2]" 1
684 1 41 GLU QG 1 53 VAL QG 8.320 . 9.070 3.474 2.179 5.513 . 0 0 "[ . 1 . 2]" 1
685 1 49 SER HA 1 50 VAL QG 7.410 . 8.160 4.328 3.260 4.897 . 0 0 "[ . 1 . 2]" 1
686 1 50 VAL QG 1 51 PHE HA 4.720 . 5.470 3.464 3.165 3.554 . 0 0 "[ . 1 . 2]" 1
687 1 45 ALA MB 1 50 VAL QG 7.280 . 8.030 3.076 2.134 4.505 . 0 0 "[ . 1 . 2]" 1
688 1 93 ILE HA 1 96 ALA MB 5.400 . 6.150 2.574 2.387 2.804 . 0 0 "[ . 1 . 2]" 1
689 1 96 ALA MB 1 120 LEU QD 5.670 . 6.420 2.137 2.035 2.251 . 0 0 "[ . 1 . 2]" 1
690 1 96 ALA MB 1 97 LYS H . . 4.110 2.469 2.349 2.577 . 0 0 "[ . 1 . 2]" 1
691 1 34 ILE MG 1 96 ALA MB 4.040 . 4.790 2.529 2.287 2.806 . 0 0 "[ . 1 . 2]" 1
692 1 28 ILE MG 1 96 ALA MB 4.530 . 5.280 2.120 1.969 2.542 . 0 0 "[ . 1 . 2]" 1
693 1 26 LEU HG 1 96 ALA MB 5.810 . 6.560 1.970 1.905 2.116 . 0 0 "[ . 1 . 2]" 1
694 1 23 HIS HE1 1 37 ALA MB 7.410 . 8.160 4.787 3.632 5.531 . 0 0 "[ . 1 . 2]" 1
695 1 37 ALA MB 1 56 ASN HA 9.440 . 10.190 5.503 5.119 5.672 . 0 0 "[ . 1 . 2]" 1
696 1 36 LEU HA 1 37 ALA MB 6.070 . 6.820 3.992 3.929 4.054 . 0 0 "[ . 1 . 2]" 1
697 1 37 ALA MB 1 61 LYS QE 6.070 . 6.820 3.752 2.663 4.155 . 0 0 "[ . 1 . 2]" 1
698 1 37 ALA MB 1 61 LYS QB 4.720 . 5.470 3.453 2.880 3.638 . 0 0 "[ . 1 . 2]" 1
699 1 36 LEU QD 1 37 ALA MB . . 8.030 3.901 3.410 4.223 . 0 0 "[ . 1 . 2]" 1
700 1 45 ALA MB 1 51 PHE HA 5.400 . 6.150 3.687 2.216 4.549 . 0 0 "[ . 1 . 2]" 1
701 1 33 VAL QG 1 63 GLU QB 9.340 . 10.090 2.708 2.115 3.420 . 0 0 "[ . 1 . 2]" 1
702 1 33 VAL QG 1 63 GLU QB 8.320 . 9.070 3.133 2.130 4.626 . 0 0 "[ . 1 . 2]" 1
703 1 25 ALA MB 1 33 VAL QG 5.670 . 6.420 2.547 2.288 2.823 . 0 0 "[ . 1 . 2]" 1
704 1 16 ILE MG 1 17 PHE H . . 4.950 2.821 2.614 3.088 . 0 0 "[ . 1 . 2]" 1
705 1 16 ILE MG 1 74 TYR HA 5.400 . 6.150 4.131 3.777 4.433 . 0 0 "[ . 1 . 2]" 1
706 1 16 ILE MG 1 35 HIS QB 6.490 . 7.240 2.596 2.053 3.881 . 0 0 "[ . 1 . 2]" 1
707 1 16 ILE MG 1 18 ARG QD 6.810 . 7.560 2.816 2.027 3.417 . 0 0 "[ . 1 . 2]" 1
708 1 13 LEU QD 1 33 VAL QG 11.640 . 12.390 4.547 4.452 4.698 . 0 0 "[ . 1 . 2]" 1
709 1 26 LEU HA 1 28 ILE MG 8.410 . 9.160 4.865 4.761 4.991 . 0 0 "[ . 1 . 2]" 1
710 1 28 ILE MG 1 34 ILE H 8.410 . 9.160 3.144 2.946 3.271 . 0 0 "[ . 1 . 2]" 1
711 1 28 ILE MG 1 33 VAL HA 6.610 . 7.360 3.568 3.334 3.801 . 0 0 "[ . 1 . 2]" 1
712 1 26 LEU QB 1 28 ILE MG 5.300 . 6.050 3.014 2.812 3.518 . 0 0 "[ . 1 . 2]" 1
713 1 92 ILE MG 1 93 ILE H 5.400 . 6.150 3.391 3.125 3.832 . 0 0 "[ . 1 . 2]" 1
714 1 11 GLY QA 1 92 ILE MG 7.410 . 8.160 3.334 2.841 4.751 . 0 0 "[ . 1 . 2]" 1
715 1 89 VAL HA 1 92 ILE MG 6.070 . 6.820 3.412 3.204 3.859 . 0 0 "[ . 1 . 2]" 1
716 1 92 ILE MG 1 120 LEU QB 6.070 . 6.820 2.833 2.107 3.334 . 0 0 "[ . 1 . 2]" 1
717 1 26 LEU QD 1 92 ILE MG 6.060 . 6.810 2.144 1.940 2.711 . 0 0 "[ . 1 . 2]" 1
718 1 92 ILE MG 1 120 LEU QD 8.900 . 9.650 3.518 2.811 3.978 . 0 0 "[ . 1 . 2]" 1
719 1 104 MET ME 1 116 PHE HA 6.610 . 7.360 3.033 2.210 3.888 . 0 0 "[ . 1 . 2]" 1
720 1 104 MET ME 1 116 PHE QD 6.070 . 6.820 3.002 2.323 3.690 . 0 0 "[ . 1 . 2]" 1
721 1 104 MET ME 1 112 ASN QD 6.810 . 7.560 3.573 2.566 4.524 . 0 0 "[ . 1 . 2]" 1
722 1 93 ILE MG 1 94 SER H . . 4.950 3.302 3.151 3.381 . 0 0 "[ . 1 . 2]" 1
723 1 93 ILE MG 1 94 SER HA 5.400 . 6.150 3.456 3.279 3.605 . 0 0 "[ . 1 . 2]" 1
724 1 90 GLU HA 1 93 ILE MG 5.400 . 6.150 3.931 3.725 4.110 . 0 0 "[ . 1 . 2]" 1
725 1 104 MET HA 1 104 MET ME 5.400 . 6.150 4.306 2.904 4.551 . 0 0 "[ . 1 . 2]" 1
726 1 34 ILE MG 1 62 ARG HA 6.610 . 7.360 4.040 3.781 4.360 . 0 0 "[ . 1 . 2]" 1
727 1 34 ILE MG 1 35 HIS H . . 4.950 2.672 2.487 2.838 . 0 0 "[ . 1 . 2]" 1
728 1 34 ILE MG 1 36 LEU H 7.930 . 8.680 4.265 4.045 4.394 . 0 0 "[ . 1 . 2]" 1
729 1 34 ILE MG 1 116 PHE QE 7.410 . 8.160 2.918 2.495 3.402 . 0 0 "[ . 1 . 2]" 1
730 1 34 ILE MG 1 60 VAL HB 10.990 . 11.740 3.408 3.059 4.153 . 0 0 "[ . 1 . 2]" 1
731 1 14 ILE MG 1 75 ARG H . . 4.950 2.769 2.366 3.347 . 0 0 "[ . 1 . 2]" 1
732 1 8 PRO QG 1 14 ILE MG 7.070 . 7.820 3.244 2.613 3.600 . 0 0 "[ . 1 . 2]" 1
733 1 99 MET H 1 99 MET ME 6.610 . 7.360 4.885 4.806 4.978 . 0 0 "[ . 1 . 2]" 1
734 1 99 MET ME 1 116 PHE QE 4.720 . 5.470 3.299 2.555 3.537 . 0 0 "[ . 1 . 2]" 1
735 1 99 MET ME 1 120 LEU H 6.610 . 7.360 4.368 3.421 5.122 . 0 0 "[ . 1 . 2]" 1
736 1 96 ALA HA 1 99 MET ME 7.930 . 8.680 4.172 3.582 4.645 . 0 0 "[ . 1 . 2]" 1
737 1 99 MET ME 1 102 GLN QG 3.770 . 4.520 2.818 2.775 2.848 . 0 0 "[ . 1 . 2]" 1
738 1 99 MET QB 1 99 MET ME 3.770 . 4.520 2.170 2.092 2.222 . 0 0 "[ . 1 . 2]" 1
739 1 60 VAL QG 1 99 MET ME 11.330 . 12.080 2.202 2.008 2.535 . 0 0 "[ . 1 . 2]" 1
740 1 34 ILE MG 1 120 LEU QD 7.280 . 8.030 2.676 2.227 3.283 . 0 0 "[ . 1 . 2]" 1
741 1 8 PRO QB 1 14 ILE MG 7.640 . 8.390 3.225 2.608 3.723 . 0 0 "[ . 1 . 2]" 1
742 1 14 ILE MG 1 15 GLU H . . 4.950 2.601 2.327 2.779 . 0 0 "[ . 1 . 2]" 1
743 1 14 ILE MG 1 74 TYR QD 4.720 . 5.470 2.185 2.069 2.319 . 0 0 "[ . 1 . 2]" 1
744 1 14 ILE MG 1 29 GLY H 7.410 . 8.160 5.502 5.402 5.541 . 0 0 "[ . 1 . 2]" 1
745 1 8 PRO QD 1 14 ILE MG 10.990 . 11.740 3.724 3.524 3.891 . 0 0 "[ . 1 . 2]" 1
746 1 14 ILE MG 1 74 TYR QB 6.070 . 6.820 2.323 2.144 2.627 . 0 0 "[ . 1 . 2]" 1
747 1 14 ILE MG 1 74 TYR HA . . 6.150 3.969 3.647 4.498 . 0 0 "[ . 1 . 2]" 1
748 1 14 ILE MG 1 76 VAL QG 7.280 . 8.030 2.685 2.080 3.339 . 0 0 "[ . 1 . 2]" 1
749 1 16 ILE MD 1 74 TYR QE 9.440 . 10.190 5.217 4.427 5.736 . 0 0 "[ . 1 . 2]" 1
750 1 16 ILE MD 1 35 HIS QB 7.930 . 8.680 3.431 3.017 3.841 . 0 0 "[ . 1 . 2]" 1
751 1 16 ILE MD 1 74 TYR QB 7.410 . 8.160 2.962 2.052 3.659 . 0 0 "[ . 1 . 2]" 1
752 1 8 PRO QG 1 16 ILE MD 7.930 . 8.680 4.349 3.949 4.828 . 0 0 "[ . 1 . 2]" 1
753 1 34 ILE HA 1 62 ARG HA 2.800 . 3.550 2.523 2.337 2.608 . 0 0 "[ . 1 . 2]" 1
754 1 34 ILE HA 1 35 HIS HD2 5.500 . 6.250 3.169 2.598 3.938 . 0 0 "[ . 1 . 2]" 1
755 1 33 VAL QG 1 34 ILE HA 7.410 . 8.160 3.985 3.801 4.089 . 0 0 "[ . 1 . 2]" 1
756 1 32 TYR HA 1 33 VAL H 3.500 . 3.550 2.209 2.169 2.247 . 0 0 "[ . 1 . 2]" 1
757 1 32 TYR HA 1 65 LEU H . . 4.250 3.207 2.376 3.456 . 0 0 "[ . 1 . 2]" 1
758 1 25 ALA MB 1 33 VAL HA 7.190 . 7.940 3.563 3.501 3.621 . 0 0 "[ . 1 . 2]" 1
759 1 33 VAL HA 1 34 ILE H 3.500 . 3.550 2.197 2.161 2.249 . 0 0 "[ . 1 . 2]" 1
760 1 28 ILE H 1 33 VAL HA 4.500 . 5.250 2.402 2.277 2.541 . 0 0 "[ . 1 . 2]" 1
761 1 26 LEU HA 1 33 VAL HA 5.500 . 6.250 5.434 5.353 5.487 . 0 0 "[ . 1 . 2]" 1
762 1 27 TYR HA 1 33 VAL HA 3.500 . 4.250 2.622 2.466 2.864 . 0 0 "[ . 1 . 2]" 1
763 1 28 ILE QG 1 33 VAL HA . . 5.800 2.595 2.437 2.808 . 0 0 "[ . 1 . 2]" 1
764 1 81 ASP HA 1 84 TYR H 4.500 . 5.250 3.605 3.306 4.037 . 0 0 "[ . 1 . 2]" 1
765 1 81 ASP HA 1 84 TYR QE 6.170 . 6.920 5.033 3.203 5.560 . 0 0 "[ . 1 . 2]" 1
766 1 81 ASP HA 1 83 GLU H 5.500 . 6.250 3.916 3.672 4.506 . 0 0 "[ . 1 . 2]" 1
767 1 81 ASP HA 1 84 TYR QB 6.170 . 6.920 4.504 2.949 5.551 . 0 0 "[ . 1 . 2]" 1
768 1 22 GLU HA 1 23 HIS H 3.500 . 4.250 2.199 2.086 2.370 . 0 0 "[ . 1 . 2]" 1
769 1 19 LEU H 1 22 GLU HA 5.500 . 6.250 4.810 3.902 5.526 . 0 0 "[ . 1 . 2]" 1
770 1 18 ARG H 1 22 GLU HA 4.500 . 5.250 3.551 2.111 4.538 . 0 0 "[ . 1 . 2]" 1
771 1 24 TRP HA 1 25 ALA H 3.500 . 3.550 2.212 2.115 2.280 . 0 0 "[ . 1 . 2]" 1
772 1 16 ILE H 1 24 TRP HA 5.500 . 6.250 3.417 2.676 3.788 . 0 0 "[ . 1 . 2]" 1
773 1 16 ILE QG 1 24 TRP HA 6.170 . 6.920 3.962 2.552 4.690 . 0 0 "[ . 1 . 2]" 1
774 1 24 TRP HA 1 25 ALA MB 6.610 . 7.360 4.007 3.963 4.056 . 0 0 "[ . 1 . 2]" 1
775 1 74 TYR HA 1 75 ARG H 3.500 . 4.250 2.370 2.269 2.454 . 0 0 "[ . 1 . 2]" 1
776 1 17 PHE H 1 74 TYR HA 4.500 . 5.250 3.174 2.740 3.493 . 0 0 "[ . 1 . 2]" 1
777 1 17 PHE QD 1 74 TYR HA 7.860 . 8.610 5.459 2.278 6.496 . 0 0 "[ . 1 . 2]" 1
778 1 17 PHE QB 1 74 TYR HA 7.410 . 8.160 3.568 3.159 3.752 . 0 0 "[ . 1 . 2]" 1
779 1 61 LYS HA 1 62 ARG H 3.500 . 3.550 2.370 2.252 2.558 . 0 0 "[ . 1 . 2]" 1
780 1 12 ASP HA 1 78 ASN QD 4.410 . 5.160 3.035 2.073 3.973 . 0 0 "[ . 1 . 2]" 1
781 1 103 LYS HA 1 104 MET H 2.800 . 3.550 2.270 2.164 2.339 . 0 0 "[ . 1 . 2]" 1
782 1 59 GLU HA 1 103 LYS HA 2.800 . 3.550 2.321 2.142 2.480 . 0 0 "[ . 1 . 2]" 1
783 1 63 GLU HA 1 64 ARG H 3.500 . 3.550 2.599 2.384 2.900 . 0 0 "[ . 1 . 2]" 1
784 1 32 TYR QD 1 63 GLU HA 5.050 . 5.800 4.257 3.403 4.548 . 0 0 "[ . 1 . 2]" 1
785 1 61 LYS QB 1 63 GLU HA 6.070 . 6.820 4.493 4.286 4.790 . 0 0 "[ . 1 . 2]" 1
786 1 33 VAL QG 1 63 GLU HA 7.280 . 8.030 3.989 3.647 4.334 . 0 0 "[ . 1 . 2]" 1
787 1 33 VAL QG 1 62 ARG HA 9.440 . 10.190 4.160 3.716 4.454 . 0 0 "[ . 1 . 2]" 1
788 1 34 ILE H 1 62 ARG HA 5.050 . 5.800 3.631 3.420 3.802 . 0 0 "[ . 1 . 2]" 1
789 1 62 ARG HA 1 63 GLU H 3.500 . 3.550 2.209 2.148 2.236 . 0 0 "[ . 1 . 2]" 1
790 1 33 VAL QG 1 62 ARG HA 7.070 . 7.820 2.505 2.109 3.694 . 0 0 "[ . 1 . 2]" 1
791 1 35 HIS HA 1 36 LEU H 3.500 . 4.250 2.319 2.222 2.401 . 0 0 "[ . 1 . 2]" 1
792 1 35 HIS HA 1 116 PHE QE 5.050 . 5.800 3.105 2.711 3.559 . 0 0 "[ . 1 . 2]" 1
793 1 26 LEU QB 1 35 HIS HA 6.360 . 7.110 4.360 4.082 4.553 . 0 0 "[ . 1 . 2]" 1
794 1 34 ILE MG 1 35 HIS HA 6.610 . 7.360 3.637 3.327 3.871 . 0 0 "[ . 1 . 2]" 1
795 1 16 ILE MD 1 35 HIS HA 9.140 . 9.890 4.054 3.809 4.393 . 0 0 "[ . 1 . 2]" 1
796 1 17 PHE QD 1 23 HIS HA 7.190 . 7.940 4.591 3.143 5.408 . 0 0 "[ . 1 . 2]" 1
797 1 23 HIS HA 1 24 TRP H 3.500 . 4.250 2.367 2.205 2.760 . 0 0 "[ . 1 . 2]" 1
798 1 25 ALA HA 1 35 HIS HA 4.500 . 5.250 2.454 2.261 2.904 . 0 0 "[ . 1 . 2]" 1
799 1 33 VAL QG 1 35 HIS HA 8.540 . 9.290 3.539 3.358 3.619 . 0 0 "[ . 1 . 2]" 1
800 1 59 GLU HA 1 60 VAL H 2.800 . 3.550 2.189 2.154 2.233 . 0 0 "[ . 1 . 2]" 1
801 1 54 LEU HA 1 59 GLU HA 6.170 . 6.920 4.467 4.409 4.493 . 0 0 "[ . 1 . 2]" 1
802 1 59 GLU HA 1 60 VAL HB 6.610 . 7.360 4.363 3.634 4.727 . 0 0 "[ . 1 . 2]" 1
803 1 13 LEU HA 1 14 ILE H 3.500 . 3.550 2.111 2.012 2.308 . 0 0 "[ . 1 . 2]" 1
804 1 14 ILE H 1 26 LEU HA . . 5.250 3.549 3.235 3.734 . 0 0 "[ . 1 . 2]" 1
805 1 13 LEU HA 1 26 LEU HA 4.500 . 5.250 2.684 2.222 3.255 . 0 0 "[ . 1 . 2]" 1
806 1 26 LEU HA 1 27 TYR H 3.500 . 3.550 2.212 2.143 2.242 . 0 0 "[ . 1 . 2]" 1
807 1 78 ASN HA 1 79 SER H 3.500 . 4.250 2.758 2.300 3.475 . 0 0 "[ . 1 . 2]" 1
808 1 77 ASN HA 1 78 ASN H 3.500 . 4.250 2.435 2.113 3.552 . 0 0 "[ . 1 . 2]" 1
809 1 25 ALA HA 1 26 LEU H 3.500 . 3.550 2.259 2.169 2.428 . 0 0 "[ . 1 . 2]" 1
810 1 25 ALA HA 1 26 LEU QB 6.360 . 7.110 3.653 3.545 3.752 . 0 0 "[ . 1 . 2]" 1
811 1 28 ILE MD 1 62 ARG QB 5.300 . 6.050 2.587 2.225 3.333 . 0 0 "[ . 1 . 2]" 1
812 1 14 ILE MD 1 26 LEU H 8.410 . 9.160 4.771 3.778 5.351 . 0 0 "[ . 1 . 2]" 1
813 1 9 LYS H 1 14 ILE MD 9.440 . 10.190 4.108 3.567 4.454 . 0 0 "[ . 1 . 2]" 1
814 1 8 PRO HA 1 14 ILE MD 6.610 . 7.360 4.142 3.022 4.983 . 0 0 "[ . 1 . 2]" 1
815 1 92 ILE HA 1 95 SER H 6.170 . 6.920 3.169 2.950 3.379 . 0 0 "[ . 1 . 2]" 1
816 1 16 ILE HA 1 72 CYS QB 5.670 . 6.420 4.400 3.594 4.632 . 0 0 "[ . 1 . 2]" 1
817 1 97 LYS HA 1 99 MET H 5.500 . 6.250 4.471 4.254 4.757 . 0 0 "[ . 1 . 2]" 1
818 1 14 ILE MG 1 15 GLU HA 9.150 . 9.900 3.399 3.278 3.523 . 0 0 "[ . 1 . 2]" 1
819 1 67 ASP HA 1 70 GLY QA 7.860 . 8.610 3.747 3.489 4.073 . 0 0 "[ . 1 . 2]" 1
820 1 13 LEU QD 1 26 LEU QB 11.330 . 12.080 3.096 2.346 3.548 . 0 0 "[ . 1 . 2]" 1
821 1 13 LEU QD 1 26 LEU QB 10.590 . 11.340 3.708 2.385 4.513 . 0 0 "[ . 1 . 2]" 1
822 1 101 GLY QA 1 102 GLN HA 7.860 . 8.610 4.127 4.029 4.211 . 0 0 "[ . 1 . 2]" 1
823 1 61 LYS QB 1 63 GLU QG 8.820 . 9.570 4.682 2.903 6.049 . 0 0 "[ . 1 . 2]" 1
824 1 83 GLU QG 1 84 TYR QE 6.930 . 7.680 3.874 2.524 4.673 . 0 0 "[ . 1 . 2]" 1
825 1 14 ILE MD 1 33 VAL HB 7.930 . 8.680 3.633 3.176 3.828 . 0 0 "[ . 1 . 2]" 1
826 1 16 ILE MG 1 23 HIS QB . . 11.020 3.677 2.964 4.308 . 0 0 "[ . 1 . 2]" 1
827 1 69 VAL HA 1 72 CYS QB 7.860 . 8.610 3.044 2.123 3.998 . 0 0 "[ . 1 . 2]" 1
828 1 68 VAL QG 1 72 CYS QB 13.340 . 14.090 5.131 3.069 6.195 . 0 0 "[ . 1 . 2]" 1
829 1 28 ILE MD 1 34 ILE QG 10.270 . 11.020 2.084 2.001 2.177 . 0 0 "[ . 1 . 2]" 1
830 1 9 LYS QD 1 10 PRO HA 7.860 . 8.610 6.087 5.624 6.367 . 0 0 "[ . 1 . 2]" 1
831 1 9 LYS QD 1 14 ILE HA 9.900 . 10.650 6.567 5.481 7.049 . 0 0 "[ . 1 . 2]" 1
832 1 32 TYR QD 1 62 ARG QG 8.820 . 9.570 3.897 2.855 6.814 . 0 0 "[ . 1 . 2]" 1
833 1 32 TYR QD 1 65 LEU QD 7.930 . 8.680 3.488 2.950 3.946 . 0 0 "[ . 1 . 2]" 1
834 1 62 ARG HA 1 100 VAL QG 9.440 . 10.190 3.711 3.291 4.080 . 0 0 "[ . 1 . 2]" 1
835 1 26 LEU HA 1 33 VAL QG 9.440 . 10.190 4.539 4.282 4.829 . 0 0 "[ . 1 . 2]" 1
836 1 7 GLU HA 1 69 VAL QG 10.590 . 11.340 4.300 3.378 5.008 . 0 0 "[ . 1 . 2]" 1
837 1 35 HIS HA 1 116 PHE QD 7.860 . 8.610 5.144 4.667 5.651 . 0 0 "[ . 1 . 2]" 1
838 1 12 ASP HA 1 78 ASN QB 7.860 . 8.610 4.872 3.129 6.889 . 0 0 "[ . 1 . 2]" 1
839 1 76 VAL QG 1 78 ASN QB 10.590 . 11.340 3.764 2.172 5.119 . 0 0 "[ . 1 . 2]" 1
840 1 35 HIS QB 1 36 LEU H . . 5.160 2.735 2.517 3.169 . 0 0 "[ . 1 . 2]" 1
841 1 33 VAL QG 1 35 HIS QB 12.720 . 13.470 2.637 2.243 3.188 . 0 0 "[ . 1 . 2]" 1
842 1 15 GLU QG 1 16 ILE H 7.860 . 8.610 3.644 2.683 4.307 . 0 0 "[ . 1 . 2]" 1
843 1 17 PHE QD 1 22 GLU QG 6.930 . 7.680 2.636 2.150 3.485 . 0 0 "[ . 1 . 2]" 1
844 1 22 GLU QG 1 23 HIS H 7.860 . 8.610 4.091 2.805 4.318 . 0 0 "[ . 1 . 2]" 1
845 1 24 TRP HZ3 1 77 ASN QB 7.860 . 8.610 2.662 2.080 3.446 . 0 0 "[ . 1 . 2]" 1
846 1 91 VAL H 1 92 ILE HB 7.000 . 7.750 4.747 4.422 5.217 . 0 0 "[ . 1 . 2]" 1
847 1 18 ARG H 1 22 GLU QG . . 6.920 4.900 3.496 5.527 . 0 0 "[ . 1 . 2]" 1
848 1 15 GLU H 1 77 ASN QB 9.900 . 10.650 3.286 2.098 3.803 . 0 0 "[ . 1 . 2]" 1
849 1 53 VAL QG 1 56 ASN QB 10.590 . 11.340 5.081 2.357 7.029 . 0 0 "[ . 1 . 2]" 1
850 1 19 LEU QB 1 20 GLY H . . 5.800 3.455 1.766 4.109 0.034 3 0 "[ . 1 . 2]" 1
851 1 16 ILE HB 1 21 TYR QB 10.590 . 11.340 3.244 2.218 4.594 . 0 0 "[ . 1 . 2]" 1
852 1 120 LEU QB 1 121 ARG H . . 4.680 2.453 2.229 2.893 . 0 0 "[ . 1 . 2]" 1
853 1 26 LEU QB 1 34 ILE H 7.860 . 8.610 3.055 2.903 3.327 . 0 0 "[ . 1 . 2]" 1
854 1 26 LEU QB 1 99 MET QB 9.440 . 10.190 5.269 4.849 5.995 . 0 0 "[ . 1 . 2]" 1
855 1 36 LEU H 1 37 ALA HA 7.000 . 7.750 5.313 5.197 5.433 . 0 0 "[ . 1 . 2]" 1
856 1 23 HIS HE1 1 37 ALA HA 7.000 . 7.750 3.927 2.666 5.017 . 0 0 "[ . 1 . 2]" 1
857 1 8 PRO QD 1 74 TYR HH 6.170 . 6.920 3.099 2.482 3.527 . 0 0 "[ . 1 . 2]" 1
858 1 10 PRO QD 1 29 GLY H 7.860 . 8.610 6.419 5.181 7.026 . 0 0 "[ . 1 . 2]" 1
859 1 15 GLU HA 1 25 ALA H 7.000 . 7.750 3.983 3.795 4.278 . 0 0 "[ . 1 . 2]" 1
860 1 114 GLU HA 1 117 VAL H 7.000 . 7.750 3.454 3.341 3.692 . 0 0 "[ . 1 . 2]" 1
861 1 114 GLU HA 1 115 HIS H . . 6.250 3.605 3.580 3.639 . 0 0 "[ . 1 . 2]" 1
862 1 65 LEU HA 1 69 VAL H 7.000 . 7.750 3.875 3.778 3.989 . 0 0 "[ . 1 . 2]" 1
863 1 66 GLU HA 1 69 VAL H 4.500 . 5.250 3.470 3.042 3.679 . 0 0 "[ . 1 . 2]" 1
864 1 65 LEU HA 1 67 ASP H 5.500 . 6.250 4.240 4.089 4.511 . 0 0 "[ . 1 . 2]" 1
865 1 89 VAL HA 1 91 VAL H . . 6.250 4.337 3.769 4.666 . 0 0 "[ . 1 . 2]" 1
866 1 25 ALA H 1 117 VAL QG 9.440 . 10.190 4.026 3.796 4.242 . 0 0 "[ . 1 . 2]" 1
867 1 23 HIS H 1 113 CYS QB 8.820 . 9.570 5.490 4.434 6.307 . 0 0 "[ . 1 . 2]" 1
868 1 24 TRP H 1 113 CYS QB 7.860 . 8.610 3.740 2.565 4.869 . 0 0 "[ . 1 . 2]" 1
869 1 26 LEU HG 1 93 ILE HA 5.500 . 6.250 4.095 3.658 4.576 . 0 0 "[ . 1 . 2]" 1
870 1 11 GLY QA 1 26 LEU HG 7.860 . 8.610 4.640 4.225 6.063 . 0 0 "[ . 1 . 2]" 1
871 1 13 LEU H 1 26 LEU HG 8.410 . 9.160 5.080 4.159 5.317 . 0 0 "[ . 1 . 2]" 1
872 1 59 GLU HA 1 60 VAL HB 7.000 . 7.750 4.724 4.593 4.912 . 0 0 "[ . 1 . 2]" 1
873 1 22 GLU QB 1 23 HIS H . . 6.920 3.132 2.379 3.771 . 0 0 "[ . 1 . 2]" 1
874 1 88 PRO QB 1 90 GLU H . . 5.800 3.947 3.386 4.313 . 0 0 "[ . 1 . 2]" 1
875 1 24 TRP QB 1 25 ALA H . . 4.680 2.750 2.487 3.152 . 0 0 "[ . 1 . 2]" 1
876 1 24 TRP QB 1 114 GLU HA 10.590 . 11.340 4.346 3.998 4.649 . 0 0 "[ . 1 . 2]" 1
877 1 60 VAL HB 1 101 GLY QA 10.590 . 11.340 4.207 3.821 4.735 . 0 0 "[ . 1 . 2]" 1
878 1 9 LYS QB 1 30 ASP HA 6.220 . 6.970 4.834 4.805 4.862 . 0 0 "[ . 1 . 2]" 1
879 1 18 ARG QG 1 23 HIS HD2 10.590 . 11.340 3.270 2.413 4.762 . 0 0 "[ . 1 . 2]" 1
880 1 97 LYS H 1 98 GLU QB . . 6.920 4.767 4.671 4.872 . 0 0 "[ . 1 . 2]" 1
881 1 18 ARG QB 1 19 LEU H . . 5.800 2.711 1.744 3.844 0.056 17 0 "[ . 1 . 2]" 1
882 1 121 ARG H 1 121 ARG QB . . 3.890 2.617 2.249 3.004 . 0 0 "[ . 1 . 2]" 1
883 1 39 PRO QD 1 112 ASN HA 5.670 . 6.420 4.550 4.327 4.629 . 0 0 "[ . 1 . 2]" 1
884 1 107 SER QB 1 112 ASN HA 3.930 . 4.680 3.468 3.088 3.628 . 0 0 "[ . 1 . 2]" 1
885 1 93 ILE QG 1 94 SER H 6.170 . 6.920 4.258 3.972 4.324 . 0 0 "[ . 1 . 2]" 1
886 1 92 ILE HA 1 95 SER QB 5.050 . 5.800 2.516 2.207 3.111 . 0 0 "[ . 1 . 2]" 1
887 1 89 VAL HA 1 92 ILE HA 5.050 . 5.800 4.496 4.303 4.564 . 0 0 "[ . 1 . 2]" 1
888 1 61 LYS HA 1 100 VAL HA 7.000 . 7.750 4.161 3.245 4.820 . 0 0 "[ . 1 . 2]" 1
889 1 118 THR HA 1 125 SER QB 6.810 . 7.560 4.354 3.217 5.121 . 0 0 "[ . 1 . 2]" 1
890 1 7 GLU QG 1 10 PRO HA 7.780 . 8.530 5.806 5.495 5.967 . 0 0 "[ . 1 . 2]" 1
891 1 22 GLU QB 1 24 TRP H 10.590 . 11.340 4.409 4.267 4.552 . 0 0 "[ . 1 . 2]" 1
892 1 39 PRO QB 1 55 SER HA 6.170 . 6.920 5.206 4.466 5.616 . 0 0 "[ . 1 . 2]" 1
893 1 13 LEU QD 1 117 VAL HB 4.720 . 5.470 2.209 2.016 2.591 . 0 0 "[ . 1 . 2]" 1
894 1 28 ILE MG 1 97 LYS QD 6.800 . 7.550 3.636 3.221 4.041 . 0 0 "[ . 1 . 2]" 1
895 1 64 ARG QB 1 65 LEU H 6.170 . 6.920 2.802 2.628 3.041 . 0 0 "[ . 1 . 2]" 1
896 1 13 LEU QD 1 79 SER H 8.320 . 9.070 3.176 2.059 3.967 . 0 0 "[ . 1 . 2]" 1
897 1 13 LEU QD 1 24 TRP HZ3 7.410 . 8.160 3.117 2.310 3.791 . 0 0 "[ . 1 . 2]" 1
898 1 93 ILE MG 1 97 LYS QG 9.440 . 10.190 2.976 2.626 3.322 . 0 0 "[ . 1 . 2]" 1
899 1 26 LEU QB 1 120 LEU QD 8.580 . 9.330 1.960 1.814 2.119 . 0 0 "[ . 1 . 2]" 1
900 1 29 GLY H 1 33 VAL QG 7.410 . 8.160 4.489 4.277 4.750 . 0 0 "[ . 1 . 2]" 1
901 1 36 LEU H 1 60 VAL QG 6.810 . 7.560 3.063 2.709 3.345 . 0 0 "[ . 1 . 2]" 1
902 1 60 VAL QG 1 116 PHE QD 8.320 . 9.070 2.505 2.272 2.841 . 0 0 "[ . 1 . 2]" 1
903 1 99 MET H 1 120 LEU QD 11.330 . 12.080 3.164 2.654 3.293 . 0 0 "[ . 1 . 2]" 1
904 1 116 PHE QD 1 120 LEU QD 10.590 . 11.340 3.284 2.677 3.465 . 0 0 "[ . 1 . 2]" 1
905 1 37 ALA MB 1 61 LYS H 6.610 . 7.360 4.475 3.838 4.709 . 0 0 "[ . 1 . 2]" 1
906 1 28 ILE MG 1 93 ILE QG 6.070 . 6.820 2.765 2.303 4.234 . 0 0 "[ . 1 . 2]" 1
907 1 8 PRO QG 1 14 ILE MD 7.070 . 7.820 2.354 2.021 3.084 . 0 0 "[ . 1 . 2]" 1
908 1 79 SER HA 1 81 ASP HA 6.930 . 7.680 5.462 4.988 5.687 . 0 0 "[ . 1 . 2]" 1
909 1 26 LEU H 1 35 HIS QB . . 6.920 3.903 3.663 4.070 . 0 0 "[ . 1 . 2]" 1
910 1 26 LEU HA 1 27 TYR QB 7.860 . 8.610 4.035 3.935 4.126 . 0 0 "[ . 1 . 2]" 1
911 1 27 TYR QB 1 28 ILE HA 8.820 . 9.570 4.719 4.610 4.786 . 0 0 "[ . 1 . 2]" 1
912 1 8 PRO QG 1 27 TYR QB 11.530 . 12.280 2.757 2.604 2.970 . 0 0 "[ . 1 . 2]" 1
913 1 89 VAL HA 1 90 GLU HA 7.000 . 7.750 4.796 4.744 4.892 . 0 0 "[ . 1 . 2]" 1
914 1 24 TRP QB 1 112 ASN QD 10.270 . 11.020 2.439 2.209 2.775 . 0 0 "[ . 1 . 2]" 1
915 1 85 GLN QB 1 87 ARG HA 7.410 . 8.160 3.368 3.113 3.774 . 0 0 "[ . 1 . 2]" 1
916 1 87 ARG HA 1 124 LYS QB 5.050 . 5.800 3.331 2.346 4.288 . 0 0 "[ . 1 . 2]" 1
917 1 28 ILE MD 1 32 TYR QD 9.440 . 10.190 4.040 2.605 4.376 . 0 0 "[ . 1 . 2]" 1
918 1 28 ILE MD 1 62 ARG HA 8.410 . 9.160 4.437 4.066 5.112 . 0 0 "[ . 1 . 2]" 1
919 1 28 ILE MD 1 34 ILE H 9.440 . 10.190 4.296 4.155 4.410 . 0 0 "[ . 1 . 2]" 1
920 1 26 LEU QB 1 28 ILE MD 8.640 . 9.390 4.127 3.915 4.531 . 0 0 "[ . 1 . 2]" 1
921 1 90 GLU H 1 91 VAL HA 5.500 . 6.250 5.369 5.292 5.505 . 0 0 "[ . 1 . 2]" 1
922 1 36 LEU HA 1 37 ALA MB 6.490 . 7.240 3.965 3.912 4.025 . 0 0 "[ . 1 . 2]" 1
923 1 8 PRO QD 1 76 VAL QG 8.320 . 9.070 3.884 2.878 4.737 . 0 0 "[ . 1 . 2]" 1
924 1 16 ILE QG 1 32 TYR QB 8.730 . 9.480 2.696 2.080 3.968 . 0 0 "[ . 1 . 2]" 1
925 1 16 ILE H 1 74 TYR QB 9.440 . 10.190 3.349 3.139 3.715 . 0 0 "[ . 1 . 2]" 1
926 1 17 PHE H 1 74 TYR QB 9.900 . 10.650 3.444 3.193 3.821 . 0 0 "[ . 1 . 2]" 1
927 1 80 LEU QB 1 84 TYR HH 5.050 . 5.800 3.782 2.851 4.603 . 0 0 "[ . 1 . 2]" 1
928 1 29 GLY QA 1 34 ILE QG 11.110 . 11.860 5.517 5.288 5.887 . 0 0 "[ . 1 . 2]" 1
929 1 28 ILE QG 1 32 TYR QB 6.930 . 7.680 2.460 2.163 3.977 . 0 0 "[ . 1 . 2]" 1
930 1 88 PRO QD 1 92 ILE QG 6.810 . 7.560 2.647 2.132 3.775 . 0 0 "[ . 1 . 2]" 1
931 1 60 VAL QG 1 100 VAL QG 8.180 . 8.930 2.938 2.290 3.349 . 0 0 "[ . 1 . 2]" 1
932 1 34 ILE MG 1 60 VAL QG 5.670 . 6.420 2.102 1.970 2.296 . 0 0 "[ . 1 . 2]" 1
933 1 75 ARG HA 1 75 ARG QD 3.930 . 4.680 2.757 2.105 3.689 . 0 0 "[ . 1 . 2]" 1
934 1 13 LEU QD 1 78 ASN QD 11.890 . 12.640 3.498 2.161 4.553 . 0 0 "[ . 1 . 2]" 1
935 1 13 LEU QD 1 81 ASP QB 6.810 . 7.560 4.176 3.268 4.548 . 0 0 "[ . 1 . 2]" 1
936 1 62 ARG QG 1 63 GLU H . . 5.800 2.792 2.435 4.404 . 0 0 "[ . 1 . 2]" 1
937 1 74 TYR QD 1 75 ARG QG 8.820 . 9.570 5.627 4.942 6.146 . 0 0 "[ . 1 . 2]" 1
938 1 14 ILE QG 1 76 VAL QG 5.300 . 6.050 2.300 2.027 2.613 . 0 0 "[ . 1 . 2]" 1
939 1 104 MET QB 1 104 MET ME 3.770 . 4.520 2.202 2.125 2.336 . 0 0 "[ . 1 . 2]" 1
940 1 99 MET ME 1 120 LEU HG 5.400 . 6.150 3.893 2.639 4.521 . 0 0 "[ . 1 . 2]" 1
941 1 64 ARG H 1 67 ASP QB . . 5.800 3.036 2.710 3.509 . 0 0 "[ . 1 . 2]" 1
942 1 63 GLU QB 1 67 ASP QB . . 9.070 2.399 2.170 2.991 . 0 0 "[ . 1 . 2]" 1
943 1 61 LYS QG 1 62 ARG H 6.170 . 6.920 3.938 3.268 4.652 . 0 0 "[ . 1 . 2]" 1
944 1 24 TRP HE1 1 116 PHE QD 6.170 . 6.920 5.500 5.012 5.595 . 0 0 "[ . 1 . 2]" 1
945 1 17 PHE QD 1 24 TRP HE1 7.410 . 8.160 4.753 4.196 5.095 . 0 0 "[ . 1 . 2]" 1
946 1 22 GLU QB 1 24 TRP HE1 7.860 . 8.610 6.245 4.977 7.014 . 0 0 "[ . 1 . 2]" 1
947 1 15 GLU QB 1 24 TRP HE1 7.860 . 8.610 6.565 5.869 7.055 . 0 0 "[ . 1 . 2]" 1
948 1 15 GLU QG 1 24 TRP HE1 6.170 . 6.920 5.208 4.491 5.563 . 0 0 "[ . 1 . 2]" 1
949 1 24 TRP HE1 1 114 GLU QG 7.860 . 8.610 3.501 2.056 4.984 . 0 0 "[ . 1 . 2]" 1
950 1 61 LYS H 1 62 ARG H . . 6.250 4.518 4.472 4.565 . 0 0 "[ . 1 . 2]" 1
951 1 37 ALA H 1 61 LYS H 6.170 . 6.920 3.880 3.230 4.204 . 0 0 "[ . 1 . 2]" 1
952 1 15 GLU H 1 77 ASN H 7.000 . 7.750 4.034 3.609 4.408 . 0 0 "[ . 1 . 2]" 1
953 1 35 HIS H 1 37 ALA H 6.170 . 6.920 3.873 3.229 4.193 . 0 0 "[ . 1 . 2]" 1
954 1 34 ILE QG 1 61 LYS H 6.710 . 7.460 3.805 3.296 4.064 . 0 0 "[ . 1 . 2]" 1
955 1 34 ILE MG 1 61 LYS H 8.410 . 9.160 3.736 3.477 4.198 . 0 0 "[ . 1 . 2]" 1
956 1 35 HIS HD2 1 61 LYS H 5.500 . 6.250 4.718 3.013 5.208 . 0 0 "[ . 1 . 2]" 1
957 1 14 ILE HA 1 15 GLU H 2.800 . 3.550 2.189 2.130 2.263 . 0 0 "[ . 1 . 2]" 1
958 1 14 ILE HB 1 15 GLU H 5.400 . 6.150 3.771 3.349 4.060 . 0 0 "[ . 1 . 2]" 1
959 1 15 GLU H 1 75 ARG H 5.500 . 6.250 3.020 2.893 3.118 . 0 0 "[ . 1 . 2]" 1
960 1 37 ALA H 1 61 LYS QB 8.820 . 9.570 3.599 2.955 4.014 . 0 0 "[ . 1 . 2]" 1
961 1 36 LEU QD 1 37 ALA H 4.720 . 5.470 2.779 2.408 3.306 . 0 0 "[ . 1 . 2]" 1
962 1 37 ALA H 1 37 ALA MB 3.360 . 4.110 2.252 2.184 2.316 . 0 0 "[ . 1 . 2]" 1
963 1 36 LEU QB 1 37 ALA H 6.990 . 7.740 3.559 3.283 3.684 . 0 0 "[ . 1 . 2]" 1
964 1 60 VAL HB 1 61 LYS H 6.610 . 7.360 4.184 4.005 4.310 . 0 0 "[ . 1 . 2]" 1
965 1 13 LEU HA 1 27 TYR H 7.000 . 7.750 3.780 2.895 4.470 . 0 0 "[ . 1 . 2]" 1
966 1 26 LEU QB 1 27 TYR H 7.860 . 8.610 3.913 3.857 3.973 . 0 0 "[ . 1 . 2]" 1
967 1 14 ILE QG 1 27 TYR H 4.950 . 5.700 2.399 2.204 2.550 . 0 0 "[ . 1 . 2]" 1
968 1 26 LEU QD 1 27 TYR H 5.300 . 6.050 2.436 2.252 2.565 . 0 0 "[ . 1 . 2]" 1
969 1 14 ILE MD 1 27 TYR H 4.200 . 4.950 3.464 3.016 3.554 . 0 0 "[ . 1 . 2]" 1
970 1 17 PHE H 1 74 TYR QB 7.860 . 8.610 3.472 3.210 3.879 . 0 0 "[ . 1 . 2]" 1
971 1 17 PHE H 1 73 CYS H 6.170 . 6.920 3.965 3.253 4.317 . 0 0 "[ . 1 . 2]" 1
972 1 17 PHE H 1 18 ARG HA 6.170 . 6.920 4.807 4.614 5.040 . 0 0 "[ . 1 . 2]" 1
973 1 16 ILE MD 1 17 PHE H 5.880 . 6.630 4.049 3.809 4.208 . 0 0 "[ . 1 . 2]" 1
974 1 14 ILE MD 1 77 ASN H 7.410 . 8.160 4.715 4.178 5.165 . 0 0 "[ . 1 . 2]" 1
975 1 77 ASN H 1 78 ASN H 4.500 . 5.250 3.706 2.366 4.481 . 0 0 "[ . 1 . 2]" 1
976 1 14 ILE HA 1 77 ASN H 3.140 . 3.890 2.147 2.097 2.214 . 0 0 "[ . 1 . 2]" 1
977 1 76 VAL HB 1 77 ASN H 5.500 . 6.250 4.133 4.021 4.227 . 0 0 "[ . 1 . 2]" 1
978 1 14 ILE QG 1 77 ASN H 8.820 . 9.570 4.511 3.967 5.261 . 0 0 "[ . 1 . 2]" 1
979 1 76 VAL H 1 77 ASN H 5.500 . 6.250 4.552 4.366 4.680 . 0 0 "[ . 1 . 2]" 1
980 1 89 VAL H 1 90 GLU H 3.500 . 4.250 3.009 2.821 3.216 . 0 0 "[ . 1 . 2]" 1
981 1 87 ARG QB 1 89 VAL H 6.070 . 6.820 3.309 2.999 3.545 . 0 0 "[ . 1 . 2]" 1
982 1 88 PRO QG 1 89 VAL H 6.610 . 7.360 4.471 4.387 4.545 . 0 0 "[ . 1 . 2]" 1
983 1 57 SER H 1 58 ALA H 7.410 . 8.160 3.356 3.277 3.470 . 0 0 "[ . 1 . 2]" 1
984 1 58 ALA HA 1 60 VAL H 6.610 . 7.360 4.360 4.005 4.709 . 0 0 "[ . 1 . 2]" 1
985 1 60 VAL H 1 101 GLY QA 7.860 . 8.610 4.445 4.049 4.853 . 0 0 "[ . 1 . 2]" 1
986 1 57 SER HA 1 58 ALA H 3.500 . 4.250 2.423 2.253 2.622 . 0 0 "[ . 1 . 2]" 1
987 1 39 PRO HA 1 58 ALA H 5.050 . 5.800 3.276 2.983 3.603 . 0 0 "[ . 1 . 2]" 1
988 1 57 SER QB 1 58 ALA H 4.410 . 5.160 2.496 2.317 2.801 . 0 0 "[ . 1 . 2]" 1
989 1 58 ALA H 1 58 ALA MB 3.360 . 4.110 2.267 2.201 2.670 . 0 0 "[ . 1 . 2]" 1
990 1 58 ALA H 1 59 GLU QB 5.560 . 6.310 3.065 2.855 3.176 . 0 0 "[ . 1 . 2]" 1
991 1 60 VAL H 1 100 VAL HA 5.500 . 6.250 5.131 4.670 5.545 . 0 0 "[ . 1 . 2]" 1
992 1 59 GLU H 1 60 VAL H 5.050 . 5.800 3.571 3.478 3.740 . 0 0 "[ . 1 . 2]" 1
993 1 59 GLU QB 1 60 VAL H 5.670 . 6.420 3.641 3.305 3.725 . 0 0 "[ . 1 . 2]" 1
994 1 60 VAL H 1 103 LYS HA 4.500 . 5.250 3.482 3.267 3.688 . 0 0 "[ . 1 . 2]" 1
995 1 60 VAL H 1 102 GLN QB 8.820 . 9.570 3.993 3.478 4.859 . 0 0 "[ . 1 . 2]" 1
996 1 16 ILE H 1 23 HIS H 5.500 . 6.250 3.039 2.773 3.280 . 0 0 "[ . 1 . 2]" 1
997 1 16 ILE H 1 16 ILE MD 3.660 . 4.410 2.558 2.182 2.715 . 0 0 "[ . 1 . 2]" 1
998 1 114 GLU H 1 115 HIS H . . 5.250 2.875 2.821 2.949 . 0 0 "[ . 1 . 2]" 1
999 1 34 ILE HA 1 63 GLU H 4.500 . 5.250 3.827 3.615 4.078 . 0 0 "[ . 1 . 2]" 1
1000 1 62 ARG QB 1 63 GLU H 6.170 . 6.920 3.559 2.680 3.853 . 0 0 "[ . 1 . 2]" 1
1001 1 62 ARG QB 1 63 GLU H 5.670 . 6.420 2.560 2.398 2.884 . 0 0 "[ . 1 . 2]" 1
1002 1 33 VAL H 1 63 GLU H 3.500 . 4.250 3.086 2.997 3.279 . 0 0 "[ . 1 . 2]" 1
1003 1 32 TYR QD 1 63 GLU H 6.170 . 6.920 4.435 3.759 5.135 . 0 0 "[ . 1 . 2]" 1
1004 1 34 ILE QG 1 63 GLU H 5.670 . 6.420 4.524 4.184 4.619 . 0 0 "[ . 1 . 2]" 1
1005 1 16 ILE H 1 23 HIS QB 8.820 . 9.570 3.807 3.415 4.457 . 0 0 "[ . 1 . 2]" 1
1006 1 8 PRO QG 1 31 GLY H 7.860 . 8.610 5.472 4.484 6.890 . 0 0 "[ . 1 . 2]" 1
1007 1 33 VAL QG 1 65 LEU H 7.410 . 8.160 2.831 2.597 3.370 . 0 0 "[ . 1 . 2]" 1
1008 1 65 LEU H 1 66 GLU H . . 4.250 2.991 2.900 3.103 . 0 0 "[ . 1 . 2]" 1
1009 1 33 VAL H 1 65 LEU H 5.050 . 5.800 3.809 3.736 3.925 . 0 0 "[ . 1 . 2]" 1
1010 1 64 ARG QB 1 65 LEU H 3.530 . 4.280 2.128 2.069 2.180 . 0 0 "[ . 1 . 2]" 1
1011 1 33 VAL QG 1 65 LEU H 7.280 . 8.030 2.804 2.577 3.303 . 0 0 "[ . 1 . 2]" 1
1012 1 18 ARG H 1 19 LEU H 7.000 . 7.750 3.221 2.632 4.705 . 0 0 "[ . 1 . 2]" 1
1013 1 18 ARG H 1 23 HIS H 7.000 . 7.750 3.531 2.866 5.096 . 0 0 "[ . 1 . 2]" 1
1014 1 17 PHE QB 1 18 ARG H 5.670 . 6.420 3.527 2.695 3.821 . 0 0 "[ . 1 . 2]" 1
1015 1 7 GLU H 1 14 ILE HA 7.860 . 8.610 6.019 4.053 7.043 . 0 0 "[ . 1 . 2]" 1
1016 1 77 ASN QB 1 78 ASN H 6.170 . 6.920 3.622 2.122 4.119 . 0 0 "[ . 1 . 2]" 1
1017 1 78 ASN H 1 79 SER H 3.500 . 4.250 2.976 2.383 3.645 . 0 0 "[ . 1 . 2]" 1
1018 1 13 LEU QD 1 78 ASN H 10.590 . 11.340 3.434 2.463 4.281 . 0 0 "[ . 1 . 2]" 1
1019 1 34 ILE QG 1 62 ARG H 6.360 . 7.110 3.111 2.462 3.909 . 0 0 "[ . 1 . 2]" 1
1020 1 19 LEU QD 1 45 ALA H 8.180 . 8.930 2.663 2.157 3.338 . 0 0 "[ . 1 . 2]" 1
1021 1 36 LEU H 1 116 PHE QD 7.860 . 8.610 4.258 3.456 4.631 . 0 0 "[ . 1 . 2]" 1
1022 1 62 ARG H 1 63 GLU H 5.050 . 5.800 4.264 4.052 4.385 . 0 0 "[ . 1 . 2]" 1
1023 1 33 VAL QG 1 62 ARG H 10.990 . 11.740 3.990 3.641 4.714 . 0 0 "[ . 1 . 2]" 1
1024 1 41 GLU QG 1 45 ALA H 7.780 . 8.530 4.831 3.311 6.183 . 0 0 "[ . 1 . 2]" 1
1025 1 45 ALA H 1 45 ALA MB 3.360 . 4.110 2.269 2.176 2.814 . 0 0 "[ . 1 . 2]" 1
1026 1 44 GLY QA 1 45 ALA H 3.140 . 3.890 2.694 2.118 2.913 . 0 0 "[ . 1 . 2]" 1
1027 1 41 GLU QB 1 45 ALA H 6.170 . 6.920 4.996 3.449 5.583 . 0 0 "[ . 1 . 2]" 1
1028 1 45 ALA H 1 50 VAL QG 6.810 . 7.560 4.256 3.443 5.083 . 0 0 "[ . 1 . 2]" 1
1029 1 36 LEU H 1 36 LEU HG 5.500 . 6.250 4.509 4.401 4.647 . 0 0 "[ . 1 . 2]" 1
1030 1 75 ARG QG 1 76 VAL H 6.170 . 6.920 3.502 2.297 4.582 . 0 0 "[ . 1 . 2]" 1
1031 1 35 HIS H 1 60 VAL HA 7.000 . 7.750 4.441 4.245 4.683 . 0 0 "[ . 1 . 2]" 1
1032 1 34 ILE HB 1 35 HIS H 5.880 . 6.630 3.566 3.430 3.988 . 0 0 "[ . 1 . 2]" 1
1033 1 25 ALA MB 1 35 HIS H 6.710 . 7.460 3.896 3.533 4.058 . 0 0 "[ . 1 . 2]" 1
1034 1 75 ARG QB 1 76 VAL H 4.200 . 4.950 2.345 2.166 2.566 . 0 0 "[ . 1 . 2]" 1
1035 1 35 HIS H 1 35 HIS HD2 2.800 . 3.550 2.704 2.252 2.827 . 0 0 "[ . 1 . 2]" 1
1036 1 35 HIS H 1 62 ARG HA 4.500 . 5.250 3.734 3.490 3.942 . 0 0 "[ . 1 . 2]" 1
1037 1 34 ILE HA 1 35 HIS H 2.800 . 3.550 2.269 2.224 2.323 . 0 0 "[ . 1 . 2]" 1
1038 1 34 ILE QG 1 35 HIS H 6.170 . 6.920 4.651 3.919 4.828 . 0 0 "[ . 1 . 2]" 1
1039 1 33 VAL QG 1 35 HIS H 5.500 . 6.250 3.111 2.805 3.313 . 0 0 "[ . 1 . 2]" 1
1040 1 33 VAL QG 1 35 HIS H 8.900 . 9.650 4.067 3.852 4.412 . 0 0 "[ . 1 . 2]" 1
1041 1 26 LEU H 1 34 ILE MG 9.150 . 9.900 4.046 3.751 4.338 . 0 0 "[ . 1 . 2]" 1
1042 1 91 VAL HA 1 92 ILE H 6.610 . 7.360 3.488 3.431 3.528 . 0 0 "[ . 1 . 2]" 1
1043 1 88 PRO QG 1 92 ILE H 4.200 . 4.950 2.748 2.585 2.991 . 0 0 "[ . 1 . 2]" 1
1044 1 91 VAL H 1 92 ILE H 3.500 . 4.250 2.587 2.495 2.829 . 0 0 "[ . 1 . 2]" 1
1045 1 89 VAL QG 1 92 ILE H 5.430 . 6.180 3.248 3.146 3.337 . 0 0 "[ . 1 . 2]" 1
1046 1 92 ILE H 1 92 ILE MD 4.200 . 4.950 3.138 2.441 3.542 . 0 0 "[ . 1 . 2]" 1
1047 1 26 LEU H 1 34 ILE H 3.500 . 4.250 2.742 2.610 2.861 . 0 0 "[ . 1 . 2]" 1
1048 1 26 LEU H 1 33 VAL QG 6.070 . 6.820 3.892 3.651 4.095 . 0 0 "[ . 1 . 2]" 1
1049 1 92 ILE H 1 93 ILE H 3.500 . 4.250 2.733 2.604 2.818 . 0 0 "[ . 1 . 2]" 1
1050 1 9 LYS H 1 76 VAL QG 4.720 . 5.470 2.852 2.087 3.513 . 0 0 "[ . 1 . 2]" 1
1051 1 16 ILE MD 1 23 HIS H 7.190 . 7.940 4.508 4.157 4.760 . 0 0 "[ . 1 . 2]" 1
1052 1 18 ARG QB 1 23 HIS H 6.070 . 6.820 2.934 2.357 3.352 . 0 0 "[ . 1 . 2]" 1
1053 1 64 ARG H 1 66 GLU H 7.000 . 7.750 5.843 5.495 6.136 . 0 0 "[ . 1 . 2]" 1
1054 1 32 TYR QD 1 64 ARG H 5.400 . 6.150 3.973 3.617 4.351 . 0 0 "[ . 1 . 2]" 1
1055 1 33 VAL QG 1 64 ARG H 7.280 . 8.030 3.473 3.084 3.951 . 0 0 "[ . 1 . 2]" 1
1056 1 63 GLU QB 1 64 ARG H 4.410 . 5.160 2.078 1.839 2.280 . 0 0 "[ . 1 . 2]" 1
1057 1 81 ASP H 1 84 TYR H 5.500 . 6.250 5.192 4.646 5.577 . 0 0 "[ . 1 . 2]" 1
1058 1 80 LEU QB 1 81 ASP H 5.050 . 5.800 2.823 2.539 3.030 . 0 0 "[ . 1 . 2]" 1
1059 1 79 SER HA 1 81 ASP H 5.500 . 6.250 4.557 4.232 5.211 . 0 0 "[ . 1 . 2]" 1
1060 1 80 LEU QD 1 81 ASP H 8.320 . 9.070 4.213 3.941 4.336 . 0 0 "[ . 1 . 2]" 1
1061 1 111 ARG HA 1 112 ASN H 3.500 . 4.250 3.550 3.529 3.574 . 0 0 "[ . 1 . 2]" 1
1062 1 124 LYS H 1 125 SER H 5.500 . 6.250 2.140 1.831 2.825 . 0 0 "[ . 1 . 2]" 1
1063 1 124 LYS QG 1 125 SER H 5.670 . 6.420 4.529 2.719 4.963 . 0 0 "[ . 1 . 2]" 1
1064 1 81 ASP H 1 121 ARG HE 5.500 . 6.250 4.846 3.102 5.593 . 0 0 "[ . 1 . 2]" 1
1065 1 80 LEU H 1 81 ASP H 3.500 . 4.250 2.626 2.038 2.921 . 0 0 "[ . 1 . 2]" 1
1066 1 80 LEU HA 1 81 ASP H 3.930 . 4.680 3.484 3.417 3.541 . 0 0 "[ . 1 . 2]" 1
1067 1 118 THR H 1 119 GLN H 3.500 . 4.250 2.702 2.563 2.867 . 0 0 "[ . 1 . 2]" 1
1068 1 116 PHE HA 1 119 GLN H 3.930 . 4.680 2.666 2.464 2.922 . 0 0 "[ . 1 . 2]" 1
1069 1 117 VAL QG 1 119 GLN H 6.490 . 7.240 4.115 3.942 4.508 . 0 0 "[ . 1 . 2]" 1
1070 1 121 ARG HE 1 125 SER H 6.170 . 6.920 4.937 4.081 5.531 . 0 0 "[ . 1 . 2]" 1
1071 1 119 GLN H 1 120 LEU H 3.500 . 4.250 2.814 2.687 2.974 . 0 0 "[ . 1 . 2]" 1
1072 1 118 THR HA 1 119 GLN H 4.500 . 5.250 3.618 3.574 3.679 . 0 0 "[ . 1 . 2]" 1
1073 1 116 PHE H 1 119 GLN H 5.500 . 6.250 4.726 4.568 4.880 . 0 0 "[ . 1 . 2]" 1
1074 1 117 VAL QG 1 119 GLN H 6.710 . 7.460 3.634 3.462 3.708 . 0 0 "[ . 1 . 2]" 1
1075 1 80 LEU H 1 81 ASP QB 5.670 . 6.420 4.011 3.448 4.539 . 0 0 "[ . 1 . 2]" 1
1076 1 79 SER QB 1 80 LEU H 3.930 . 4.680 2.882 2.220 3.518 . 0 0 "[ . 1 . 2]" 1
1077 1 13 LEU QB 1 14 ILE H 6.170 . 6.920 3.059 2.267 4.048 . 0 0 "[ . 1 . 2]" 1
1078 1 14 ILE H 1 26 LEU QB 7.780 . 8.530 4.269 3.865 4.609 . 0 0 "[ . 1 . 2]" 1
1079 1 79 SER H 1 80 LEU H 3.930 . 4.680 3.138 2.808 3.589 . 0 0 "[ . 1 . 2]" 1
1080 1 78 ASN HA 1 80 LEU H 7.000 . 7.750 4.236 3.611 5.023 . 0 0 "[ . 1 . 2]" 1
1081 1 79 SER HA 1 80 LEU H 3.500 . 4.250 3.565 3.486 3.602 . 0 0 "[ . 1 . 2]" 1
1082 1 14 ILE H 1 25 ALA H 3.500 . 4.250 2.895 2.598 3.259 . 0 0 "[ . 1 . 2]" 1
1083 1 13 LEU H 1 14 ILE H 5.500 . 6.250 4.393 4.048 4.512 . 0 0 "[ . 1 . 2]" 1
1084 1 19 LEU H 1 19 LEU QB 3.360 . 4.110 2.544 2.218 2.936 . 0 0 "[ . 1 . 2]" 1
1085 1 25 ALA H 1 26 LEU QB 6.360 . 7.110 3.897 3.694 4.092 . 0 0 "[ . 1 . 2]" 1
1086 1 14 ILE MG 1 25 ALA H 5.880 . 6.630 3.524 2.652 3.911 . 0 0 "[ . 1 . 2]" 1
1087 1 14 ILE H 1 24 TRP HA 7.000 . 7.750 4.587 4.210 4.971 . 0 0 "[ . 1 . 2]" 1
1088 1 14 ILE QG 1 25 ALA H 5.140 . 5.890 3.270 2.625 3.510 . 0 0 "[ . 1 . 2]" 1
1089 1 86 PRO QG 1 87 ARG H 5.050 . 5.800 3.076 2.066 4.528 . 0 0 "[ . 1 . 2]" 1
1090 1 87 ARG H 1 87 ARG QB 3.140 . 3.890 2.727 1.964 2.929 . 0 0 "[ . 1 . 2]" 1
1091 1 87 ARG H 1 124 LYS QB 6.170 . 6.920 4.012 2.859 5.636 . 0 0 "[ . 1 . 2]" 1
1092 1 87 ARG H 1 121 ARG QB 7.860 . 8.610 6.912 6.455 7.097 . 0 0 "[ . 1 . 2]" 1
1093 1 87 ARG H 1 92 ILE MD 6.610 . 7.360 5.096 4.107 5.591 . 0 0 "[ . 1 . 2]" 1
1094 1 59 GLU QG 1 103 LYS H 7.190 . 7.940 4.542 3.930 4.939 . 0 0 "[ . 1 . 2]" 1
1095 1 102 GLN H 1 103 LYS H 4.500 . 5.250 4.570 4.545 4.586 . 0 0 "[ . 1 . 2]" 1
1096 1 102 GLN QB 1 103 LYS H 3.930 . 4.680 2.762 2.334 3.257 . 0 0 "[ . 1 . 2]" 1
1097 1 103 LYS H 1 103 LYS QD 4.410 . 5.160 2.914 2.395 3.571 . 0 0 "[ . 1 . 2]" 1
1098 1 11 GLY QA 1 12 ASP H 3.930 . 4.680 2.956 2.915 2.987 . 0 0 "[ . 1 . 2]" 1
1099 1 12 ASP H 1 14 ILE QG 10.270 . 11.020 3.327 2.789 3.655 . 0 0 "[ . 1 . 2]" 1
1100 1 8 PRO QB 1 12 ASP H 6.710 . 7.460 3.300 2.781 3.588 . 0 0 "[ . 1 . 2]" 1
1101 1 12 ASP H 1 13 LEU H 7.000 . 7.750 4.558 4.486 4.620 . 0 0 "[ . 1 . 2]" 1
1102 1 103 LYS H 1 104 MET H 4.500 . 5.250 4.505 4.383 4.573 . 0 0 "[ . 1 . 2]" 1
1103 1 9 LYS H 1 12 ASP H 3.930 . 4.680 2.665 2.488 2.795 . 0 0 "[ . 1 . 2]" 1
1104 1 12 ASP H 1 27 TYR QD 6.170 . 6.920 4.540 4.088 4.941 . 0 0 "[ . 1 . 2]" 1
1105 1 12 ASP H 1 14 ILE MD 10.270 . 11.020 5.190 4.842 5.433 . 0 0 "[ . 1 . 2]" 1
1106 1 72 CYS H 1 73 CYS H 5.500 . 6.250 4.572 4.437 4.656 . 0 0 "[ . 1 . 2]" 1
1107 1 36 LEU QD 1 59 GLU H 9.440 . 10.190 2.886 2.404 3.278 . 0 0 "[ . 1 . 2]" 1
1108 1 59 GLU H 1 59 GLU QB 3.140 . 3.890 2.679 2.421 2.790 . 0 0 "[ . 1 . 2]" 1
1109 1 32 TYR H 1 32 TYR QD 3.930 . 4.680 2.913 2.571 3.304 . 0 0 "[ . 1 . 2]" 1
1110 1 28 ILE MG 1 32 TYR H 7.930 . 8.680 4.065 3.902 4.530 . 0 0 "[ . 1 . 2]" 1
1111 1 58 ALA H 1 59 GLU H 5.670 . 6.420 3.457 3.356 3.590 . 0 0 "[ . 1 . 2]" 1
1112 1 31 GLY H 1 32 TYR H 3.500 . 4.250 2.432 1.842 2.693 . 0 0 "[ . 1 . 2]" 1
1113 1 29 GLY H 1 32 TYR H 4.500 . 5.250 3.249 3.075 3.834 . 0 0 "[ . 1 . 2]" 1
1114 1 28 ILE QG 1 32 TYR H 6.170 . 6.920 4.238 3.780 4.410 . 0 0 "[ . 1 . 2]" 1
1115 1 8 PRO QG 1 32 TYR H 6.930 . 7.680 4.189 3.766 4.371 . 0 0 "[ . 1 . 2]" 1
1116 1 36 LEU QD 1 104 MET H 7.410 . 8.160 4.078 3.499 4.751 . 0 0 "[ . 1 . 2]" 1
1117 1 101 GLY H 1 102 GLN H 3.500 . 4.250 2.665 2.540 2.799 . 0 0 "[ . 1 . 2]" 1
1118 1 60 VAL HB 1 102 GLN H 3.360 . 4.110 2.328 2.200 2.527 . 0 0 "[ . 1 . 2]" 1
1119 1 60 VAL QG 1 102 GLN H . . 5.470 3.346 3.079 3.549 . 0 0 "[ . 1 . 2]" 1
1120 1 103 LYS QG 1 104 MET H 6.930 . 7.680 3.748 2.735 4.180 . 0 0 "[ . 1 . 2]" 1
1121 1 103 LYS H 1 104 MET H 6.170 . 6.920 3.976 3.909 4.007 . 0 0 "[ . 1 . 2]" 1
1122 1 59 GLU HA 1 104 MET H 4.500 . 5.250 3.710 3.077 4.004 . 0 0 "[ . 1 . 2]" 1
1123 1 103 LYS QB 1 104 MET H 3.530 . 4.280 2.452 2.314 2.599 . 0 0 "[ . 1 . 2]" 1
1124 1 58 ALA MB 1 104 MET H 6.610 . 7.360 2.957 2.338 3.428 . 0 0 "[ . 1 . 2]" 1
1125 1 84 TYR H 1 85 GLN H 4.500 . 5.250 2.581 1.991 4.365 . 0 0 "[ . 1 . 2]" 1
1126 1 84 TYR QE 1 85 GLN H 8.820 . 9.570 5.743 3.853 6.457 . 0 0 "[ . 1 . 2]" 1
1127 1 84 TYR QB 1 85 GLN H 3.530 . 4.280 2.411 2.088 2.749 . 0 0 "[ . 1 . 2]" 1
1128 1 64 ARG QB 1 68 VAL H 6.930 . 7.680 4.108 3.888 4.261 . 0 0 "[ . 1 . 2]" 1
1129 1 67 ASP HA 1 68 VAL H 4.500 . 5.250 3.580 3.522 3.609 . 0 0 "[ . 1 . 2]" 1
1130 1 64 ARG QB 1 68 VAL H 5.400 . 6.150 4.102 3.841 4.471 . 0 0 "[ . 1 . 2]" 1
1131 1 83 GLU HA 1 85 GLN H 6.610 . 7.360 4.213 3.838 4.366 . 0 0 "[ . 1 . 2]" 1
1132 1 85 GLN H 1 86 PRO QD 6.930 . 7.680 4.335 3.848 4.459 . 0 0 "[ . 1 . 2]" 1
1133 1 26 LEU HA 1 28 ILE H 7.000 . 7.750 5.516 5.246 5.847 . 0 0 "[ . 1 . 2]" 1
1134 1 28 ILE H 1 28 ILE MG 4.040 . 4.790 2.628 2.461 2.763 . 0 0 "[ . 1 . 2]" 1
1135 1 63 GLU QB 1 68 VAL H 7.410 . 8.160 3.169 2.770 3.868 . 0 0 "[ . 1 . 2]" 1
1136 1 68 VAL H 1 69 VAL H 3.500 . 4.250 2.752 2.609 2.903 . 0 0 "[ . 1 . 2]" 1
1137 1 67 ASP H 1 68 VAL H 2.800 . 3.550 2.454 2.393 2.538 . 0 0 "[ . 1 . 2]" 1
1138 1 65 LEU QD 1 68 VAL H 6.810 . 7.560 3.816 3.563 4.000 . 0 0 "[ . 1 . 2]" 1
1139 1 90 GLU H 1 91 VAL H 3.500 . 4.250 2.692 2.598 2.884 . 0 0 "[ . 1 . 2]" 1
1140 1 88 PRO QD 1 91 VAL H 6.170 . 6.920 5.428 5.199 5.552 . 0 0 "[ . 1 . 2]" 1
1141 1 12 ASP HA 1 13 LEU H 2.800 . 3.550 2.324 2.102 2.439 . 0 0 "[ . 1 . 2]" 1
1142 1 27 TYR HA 1 28 ILE H 3.500 . 4.250 2.208 2.144 2.273 . 0 0 "[ . 1 . 2]" 1
1143 1 13 LEU H 1 76 VAL QG 4.720 . 5.470 3.028 2.536 3.515 . 0 0 "[ . 1 . 2]" 1
1144 1 8 PRO QB 1 13 LEU H 9.680 . 10.430 5.501 4.906 6.140 . 0 0 "[ . 1 . 2]" 1
1145 1 28 ILE QG 1 34 ILE H 6.170 . 6.920 3.303 3.087 3.470 . 0 0 "[ . 1 . 2]" 1
1146 1 13 LEU H 1 26 LEU H 5.670 . 6.420 2.703 2.586 2.807 . 0 0 "[ . 1 . 2]" 1
1147 1 25 ALA MB 1 34 ILE H 4.580 . 5.330 2.767 2.704 2.839 . 0 0 "[ . 1 . 2]" 1
1148 1 28 ILE MG 1 34 ILE H 5.050 . 5.800 2.849 2.732 2.935 . 0 0 "[ . 1 . 2]" 1
1149 1 33 VAL QG 1 34 ILE H 6.070 . 6.820 3.264 3.202 3.344 . 0 0 "[ . 1 . 2]" 1
1150 1 27 TYR HA 1 34 ILE H 5.500 . 6.250 4.023 3.882 4.220 . 0 0 "[ . 1 . 2]" 1
1151 1 84 TYR H 1 84 TYR QE 6.170 . 6.920 4.686 4.461 5.067 . 0 0 "[ . 1 . 2]" 1
1152 1 115 HIS H 1 116 PHE H 3.500 . 4.250 2.778 2.672 2.864 . 0 0 "[ . 1 . 2]" 1
1153 1 34 ILE MG 1 100 VAL H 8.410 . 9.160 3.882 3.167 4.669 . 0 0 "[ . 1 . 2]" 1
1154 1 73 CYS H 1 74 TYR H 5.050 . 5.800 4.019 3.985 4.075 . 0 0 "[ . 1 . 2]" 1
1155 1 65 LEU QD 1 74 TYR H 8.320 . 9.070 4.482 4.057 5.050 . 0 0 "[ . 1 . 2]" 1
1156 1 100 VAL H 1 101 GLY H 4.500 . 5.250 4.554 4.535 4.579 . 0 0 "[ . 1 . 2]" 1
1157 1 26 LEU QB 1 100 VAL H 10.100 . 10.850 6.317 5.980 6.685 . 0 0 "[ . 1 . 2]" 1
1158 1 26 LEU QB 1 100 VAL H 9.900 . 10.650 6.097 5.756 6.440 . 0 0 "[ . 1 . 2]" 1
1159 1 34 ILE MD 1 100 VAL H 5.050 . 5.800 3.236 2.852 3.510 . 0 0 "[ . 1 . 2]" 1
1160 1 98 GLU H 1 100 VAL H 6.610 . 7.360 4.115 3.873 4.373 . 0 0 "[ . 1 . 2]" 1
1161 1 99 MET H 1 100 VAL H 2.800 . 3.550 2.773 2.606 2.837 . 0 0 "[ . 1 . 2]" 1
1162 1 99 MET QG 1 100 VAL H 7.860 . 8.610 4.165 2.624 4.600 . 0 0 "[ . 1 . 2]" 1
1163 1 60 VAL HB 1 100 VAL H 4.200 . 4.950 3.184 2.784 3.710 . 0 0 "[ . 1 . 2]" 1
1164 1 80 LEU HA 1 84 TYR H 5.050 . 5.800 3.896 3.515 4.279 . 0 0 "[ . 1 . 2]" 1
1165 1 83 GLU H 1 84 TYR H 2.800 . 3.550 2.523 2.139 2.804 . 0 0 "[ . 1 . 2]" 1
1166 1 83 GLU QG 1 84 TYR H 6.070 . 6.820 4.231 3.876 4.452 . 0 0 "[ . 1 . 2]" 1
1167 1 80 LEU QB 1 84 TYR H 9.150 . 9.900 5.248 4.527 6.479 . 0 0 "[ . 1 . 2]" 1
1168 1 74 TYR H 1 74 TYR QD 3.930 . 4.680 2.991 2.675 3.504 . 0 0 "[ . 1 . 2]" 1
1169 1 74 TYR H 1 74 TYR HH 7.000 . 7.750 6.945 6.690 7.035 . 0 0 "[ . 1 . 2]" 1
1170 1 80 LEU HA 1 83 GLU H 3.930 . 4.680 2.999 2.813 3.228 . 0 0 "[ . 1 . 2]" 1
1171 1 16 ILE MG 1 72 CYS H 6.610 . 7.360 4.998 4.549 5.515 . 0 0 "[ . 1 . 2]" 1
1172 1 68 VAL QG 1 72 CYS H 8.900 . 9.650 3.230 2.206 4.343 . 0 0 "[ . 1 . 2]" 1
1173 1 80 LEU QD 1 83 GLU H 8.320 . 9.070 4.477 4.289 4.686 . 0 0 "[ . 1 . 2]" 1
1174 1 66 GLU H 1 67 ASP H 3.500 . 4.250 2.946 2.782 3.019 . 0 0 "[ . 1 . 2]" 1
1175 1 67 ASP H 1 68 VAL HA 5.500 . 6.250 5.137 5.071 5.227 . 0 0 "[ . 1 . 2]" 1
1176 1 63 GLU QB 1 67 ASP H 6.610 . 7.360 4.424 3.869 4.631 . 0 0 "[ . 1 . 2]" 1
1177 1 67 ASP H 1 68 VAL QG 5.670 . 6.420 3.756 3.513 3.798 . 0 0 "[ . 1 . 2]" 1
1178 1 121 ARG QD 1 124 LYS H 6.930 . 7.680 4.812 4.260 5.508 . 0 0 "[ . 1 . 2]" 1
1179 1 123 GLY H 1 124 LYS H 4.500 . 5.250 2.988 2.260 3.366 . 0 0 "[ . 1 . 2]" 1
1180 1 88 PRO QD 1 124 LYS H 5.400 . 6.150 3.703 3.156 4.510 . 0 0 "[ . 1 . 2]" 1
1181 1 87 ARG QD 1 124 LYS H 9.440 . 10.190 3.964 2.523 4.616 . 0 0 "[ . 1 . 2]" 1
1182 1 117 VAL QG 1 120 LEU H 6.710 . 7.460 3.945 3.757 4.042 . 0 0 "[ . 1 . 2]" 1
1183 1 120 LEU H 1 121 ARG H 3.500 . 4.250 2.800 2.662 2.912 . 0 0 "[ . 1 . 2]" 1
1184 1 120 LEU H 1 122 TYR HA 7.000 . 7.750 6.090 5.854 6.482 . 0 0 "[ . 1 . 2]" 1
1185 1 77 ASN QD 1 79 SER H 7.860 . 8.610 3.825 2.349 4.767 . 0 0 "[ . 1 . 2]" 1
1186 1 13 LEU QD 1 79 SER H 8.730 . 9.480 3.831 2.152 4.853 . 0 0 "[ . 1 . 2]" 1
1187 1 77 ASN HA 1 79 SER H 4.500 . 5.250 4.159 3.601 4.557 . 0 0 "[ . 1 . 2]" 1
1188 1 79 SER H 1 79 SER HA 2.800 . 3.550 2.700 2.181 2.847 . 0 0 "[ . 1 . 2]" 1
1189 1 79 SER H 1 79 SER QB 3.140 . 3.890 2.512 2.222 2.935 . 0 0 "[ . 1 . 2]" 1
1190 1 26 LEU QD 1 120 LEU H 8.640 . 9.390 4.608 4.382 4.788 . 0 0 "[ . 1 . 2]" 1
1191 1 91 VAL HB 1 95 SER H 8.410 . 9.160 4.594 4.489 4.681 . 0 0 "[ . 1 . 2]" 1
1192 1 79 SER H 1 80 LEU H 3.500 . 4.250 3.233 2.814 3.656 . 0 0 "[ . 1 . 2]" 1
1193 1 77 ASN QB 1 79 SER H 6.930 . 7.680 3.492 2.793 3.809 . 0 0 "[ . 1 . 2]" 1
1194 1 94 SER H 1 95 SER H 2.800 . 3.550 2.759 2.652 2.816 . 0 0 "[ . 1 . 2]" 1
1195 1 92 ILE HB 1 95 SER H 6.930 . 7.680 4.422 4.303 4.539 . 0 0 "[ . 1 . 2]" 1
1196 1 91 VAL QG 1 95 SER H 6.810 . 7.560 3.743 3.605 3.870 . 0 0 "[ . 1 . 2]" 1
1197 1 95 SER H 1 96 ALA MB 5.670 . 6.420 4.369 4.247 4.499 . 0 0 "[ . 1 . 2]" 1
1198 1 26 LEU HG 1 95 SER H 7.610 . 8.360 5.052 4.450 5.506 . 0 0 "[ . 1 . 2]" 1
1199 1 93 ILE H 1 95 SER H 5.050 . 5.800 3.834 3.750 3.930 . 0 0 "[ . 1 . 2]" 1
1200 1 117 VAL H 1 118 THR H 3.500 . 4.250 2.822 2.747 2.900 . 0 0 "[ . 1 . 2]" 1
1201 1 118 THR H 1 119 GLN HA 6.170 . 6.920 5.247 5.144 5.353 . 0 0 "[ . 1 . 2]" 1
1202 1 90 GLU H 1 92 ILE H 5.500 . 6.250 4.159 4.016 4.350 . 0 0 "[ . 1 . 2]" 1
1203 1 113 CYS HA 1 116 PHE H 5.500 . 6.250 3.438 3.159 3.675 . 0 0 "[ . 1 . 2]" 1
1204 1 26 LEU QD 1 121 ARG H 6.490 . 7.240 3.785 3.446 4.354 . 0 0 "[ . 1 . 2]" 1
1205 1 121 ARG H 1 121 ARG HE 3.930 . 4.680 2.767 2.326 3.115 . 0 0 "[ . 1 . 2]" 1
1206 1 26 LEU HG 1 121 ARG H 9.680 . 10.430 4.010 3.887 4.191 . 0 0 "[ . 1 . 2]" 1
1207 1 88 PRO HA 1 90 GLU H 5.500 . 6.250 3.997 3.805 4.459 . 0 0 "[ . 1 . 2]" 1
1208 1 88 PRO QG 1 90 GLU H 5.400 . 6.150 4.512 4.421 4.550 . 0 0 "[ . 1 . 2]" 1
1209 1 89 VAL HB 1 90 GLU H 3.360 . 4.110 2.419 2.290 2.538 . 0 0 "[ . 1 . 2]" 1
1210 1 90 GLU H 1 93 ILE HB 5.500 . 6.250 5.121 4.987 5.326 . 0 0 "[ . 1 . 2]" 1
1211 1 13 LEU QD 1 121 ARG H 6.490 . 7.240 3.881 3.315 4.547 . 0 0 "[ . 1 . 2]" 1
1212 1 96 ALA H 1 98 GLU H 5.500 . 6.250 4.111 3.915 4.382 . 0 0 "[ . 1 . 2]" 1
1213 1 98 GLU H 1 100 VAL H 5.500 . 6.250 4.153 3.880 4.447 . 0 0 "[ . 1 . 2]" 1
1214 1 98 GLU H 1 99 MET HA 5.500 . 6.250 5.274 5.086 5.481 . 0 0 "[ . 1 . 2]" 1
1215 1 95 SER QB 1 98 GLU H 4.200 . 4.950 3.465 3.373 3.536 . 0 0 "[ . 1 . 2]" 1
1216 1 96 ALA MB 1 98 GLU H 6.610 . 7.360 4.497 4.333 4.766 . 0 0 "[ . 1 . 2]" 1
1217 1 98 GLU H 1 100 VAL QG 9.440 . 10.190 4.421 4.026 4.727 . 0 0 "[ . 1 . 2]" 1
1218 1 98 GLU H 1 99 MET H 2.800 . 3.550 2.603 2.357 2.827 . 0 0 "[ . 1 . 2]" 1
1219 1 98 GLU H 1 99 MET QG 7.860 . 8.610 4.458 4.035 4.749 . 0 0 "[ . 1 . 2]" 1
1220 1 97 LYS QE 1 98 GLU H 8.820 . 9.570 4.221 3.948 4.635 . 0 0 "[ . 1 . 2]" 1
1221 1 97 LYS QG 1 98 GLU H 6.170 . 6.920 4.394 4.261 4.481 . 0 0 "[ . 1 . 2]" 1
1222 1 97 LYS H 1 98 GLU H 3.500 . 4.250 2.816 2.764 2.930 . 0 0 "[ . 1 . 2]" 1
1223 1 68 VAL H 1 69 VAL H 3.140 . 3.890 2.418 2.319 2.521 . 0 0 "[ . 1 . 2]" 1
1224 1 67 ASP H 1 69 VAL H 6.610 . 7.360 3.877 3.684 4.116 . 0 0 "[ . 1 . 2]" 1
1225 1 112 ASN QD 1 116 PHE H 5.400 . 6.150 4.522 4.361 4.574 . 0 0 "[ . 1 . 2]" 1
1226 1 112 ASN HA 1 116 PHE H 5.500 . 6.250 4.095 3.961 4.326 . 0 0 "[ . 1 . 2]" 1
1227 1 116 PHE H 1 117 VAL HB 6.610 . 7.360 5.292 4.574 5.627 . 0 0 "[ . 1 . 2]" 1
1228 1 100 VAL HB 1 101 GLY H 5.400 . 6.150 3.899 3.707 4.048 . 0 0 "[ . 1 . 2]" 1
1229 1 60 VAL QG 1 101 GLY H . . 5.470 3.159 2.725 3.468 . 0 0 "[ . 1 . 2]" 1
1230 1 51 PHE HA 1 52 SER H 3.500 . 4.250 3.300 2.258 3.581 . 0 0 "[ . 1 . 2]" 1
1231 1 59 GLU QG 1 101 GLY H 6.170 . 6.920 3.987 3.516 4.438 . 0 0 "[ . 1 . 2]" 1
1232 1 60 VAL H 1 101 GLY H 7.000 . 7.750 4.038 3.726 4.451 . 0 0 "[ . 1 . 2]" 1
1233 1 100 VAL H 1 101 GLY H 8.410 . 9.160 4.486 4.461 4.514 . 0 0 "[ . 1 . 2]" 1
1234 1 34 ILE MG 1 97 LYS H 7.410 . 8.160 3.842 3.693 3.978 . 0 0 "[ . 1 . 2]" 1
1235 1 28 ILE MG 1 97 LYS H 4.720 . 5.470 3.325 2.893 3.504 . 0 0 "[ . 1 . 2]" 1
1236 1 96 ALA H 1 97 LYS H 3.500 . 4.250 2.830 2.764 2.883 . 0 0 "[ . 1 . 2]" 1
1237 1 94 SER HA 1 97 LYS H 3.500 . 4.250 3.474 3.172 3.529 . 0 0 "[ . 1 . 2]" 1
1238 1 97 LYS H 1 100 VAL QG 9.440 . 10.190 4.665 4.220 4.971 . 0 0 "[ . 1 . 2]" 1
1239 1 20 GLY H 1 21 TYR H 3.500 . 4.250 2.713 2.357 3.359 . 0 0 "[ . 1 . 2]" 1
1240 1 19 LEU H 1 21 TYR H 5.500 . 6.250 2.837 2.368 4.082 . 0 0 "[ . 1 . 2]" 1
1241 1 21 TYR H 1 23 HIS HD2 7.000 . 7.750 5.690 4.087 7.049 . 0 0 "[ . 1 . 2]" 1
1242 1 20 GLY QA 1 21 TYR H 4.200 . 4.950 2.864 2.537 2.958 . 0 0 "[ . 1 . 2]" 1
1243 1 18 ARG QB 1 21 TYR H 6.930 . 7.680 4.413 3.593 4.905 . 0 0 "[ . 1 . 2]" 1
1244 1 18 ARG QB 1 21 TYR H 6.170 . 6.920 4.632 3.631 5.552 . 0 0 "[ . 1 . 2]" 1
1245 1 16 ILE H 1 75 ARG H 8.410 . 9.160 3.996 3.904 4.059 . 0 0 "[ . 1 . 2]" 1
1246 1 19 LEU HA 1 20 GLY H 3.930 . 4.680 2.768 2.126 3.378 . 0 0 "[ . 1 . 2]" 1
1247 1 74 TYR QD 1 75 ARG H 3.930 . 4.680 3.303 2.874 3.527 . 0 0 "[ . 1 . 2]" 1
1248 1 16 ILE HA 1 75 ARG H 5.500 . 6.250 3.944 3.776 4.320 . 0 0 "[ . 1 . 2]" 1
1249 1 65 LEU QD 1 66 GLU H 6.810 . 7.560 3.488 3.190 3.639 . 0 0 "[ . 1 . 2]" 1
1250 1 33 VAL QG 1 66 GLU H 7.640 . 8.390 3.776 3.424 3.998 . 0 0 "[ . 1 . 2]" 1
1251 1 64 ARG QB 1 66 GLU H 3.530 . 4.280 2.339 2.252 2.426 . 0 0 "[ . 1 . 2]" 1
1252 1 65 LEU QB 1 66 GLU H 4.200 . 4.950 2.374 2.260 2.458 . 0 0 "[ . 1 . 2]" 1
1253 1 92 ILE QG 1 93 ILE H 7.860 . 8.610 4.174 3.708 4.510 . 0 0 "[ . 1 . 2]" 1
1254 1 90 GLU QB 1 94 SER H 7.860 . 8.610 4.680 4.541 4.843 . 0 0 "[ . 1 . 2]" 1
1255 1 93 ILE H 1 94 SER H 3.500 . 4.250 2.741 2.677 2.830 . 0 0 "[ . 1 . 2]" 1
1256 1 90 GLU HA 1 94 SER H 5.400 . 6.150 3.732 3.642 3.820 . 0 0 "[ . 1 . 2]" 1
1257 1 93 ILE QG 1 94 SER H 5.670 . 6.420 4.065 3.773 4.246 . 0 0 "[ . 1 . 2]" 1
1258 1 28 ILE MG 1 94 SER H 6.490 . 7.240 4.446 4.357 4.517 . 0 0 "[ . 1 . 2]" 1
1259 1 11 GLY QA 1 93 ILE H 5.400 . 6.150 3.357 3.241 3.553 . 0 0 "[ . 1 . 2]" 1
1260 1 92 ILE HB 1 93 ILE H 3.140 . 3.890 2.217 2.145 2.301 . 0 0 "[ . 1 . 2]" 1
1261 1 93 ILE H 1 93 ILE MD 4.200 . 4.950 3.534 3.486 3.586 . 0 0 "[ . 1 . 2]" 1
1262 1 26 LEU QD 1 94 SER H 7.780 . 8.530 4.127 3.894 4.202 . 0 0 "[ . 1 . 2]" 1
1263 1 98 GLU QG 1 99 MET H 5.670 . 6.420 4.126 3.946 4.279 . 0 0 "[ . 1 . 2]" 1
1264 1 34 ILE MD 1 99 MET H 6.490 . 7.240 4.306 3.978 4.551 . 0 0 "[ . 1 . 2]" 1
1265 1 10 PRO QG 1 11 GLY H 5.400 . 6.150 4.495 4.345 4.552 . 0 0 "[ . 1 . 2]" 1
1266 1 10 PRO QB 1 11 GLY H 5.050 . 5.800 3.222 2.974 3.424 . 0 0 "[ . 1 . 2]" 1
1267 1 11 GLY H 1 12 ASP H 3.500 . 4.250 2.686 2.503 2.816 . 0 0 "[ . 1 . 2]" 1
1268 1 11 GLY H 1 27 TYR QD 6.170 . 6.920 3.831 3.529 4.097 . 0 0 "[ . 1 . 2]" 1
1269 1 11 GLY H 1 28 ILE HA 4.500 . 5.250 3.654 3.429 3.952 . 0 0 "[ . 1 . 2]" 1
1270 1 11 GLY H 1 89 VAL QG 6.070 . 6.820 3.742 3.407 4.116 . 0 0 "[ . 1 . 2]" 1
1271 1 78 ASN QD 1 85 GLN QE . . 7.680 5.171 4.114 5.548 . 0 0 "[ . 1 . 2]" 1
1272 1 84 TYR QE 1 85 GLN QE 6.930 . 7.680 4.782 2.542 5.571 . 0 0 "[ . 1 . 2]" 1
1273 1 84 TYR QB 1 85 GLN QE 6.930 . 7.680 4.659 3.584 5.525 . 0 0 "[ . 1 . 2]" 1
1274 1 83 GLU H 1 85 GLN QE 7.860 . 8.610 5.981 4.258 6.877 . 0 0 "[ . 1 . 2]" 1
1275 1 85 GLN QE 1 122 TYR HA 7.860 . 8.610 5.673 4.268 7.072 . 0 0 "[ . 1 . 2]" 1
1276 1 85 GLN QE 1 92 ILE H 9.900 . 10.650 5.506 4.007 7.296 . 0 0 "[ . 1 . 2]" 1
1277 1 77 ASN QD 1 79 SER QB 8.820 . 9.570 3.263 2.251 4.248 . 0 0 "[ . 1 . 2]" 1
1278 1 122 TYR H 1 123 GLY H 2.800 . 3.550 2.851 2.802 2.880 . 0 0 "[ . 1 . 2]" 1
1279 1 121 ARG H 1 122 TYR H 3.500 . 4.250 2.797 2.337 3.246 . 0 0 "[ . 1 . 2]" 1
1280 1 85 GLN QE 1 122 TYR H 6.610 . 7.360 3.907 3.688 4.373 . 0 0 "[ . 1 . 2]" 1
1281 1 118 THR HA 1 122 TYR H 5.400 . 6.150 3.856 3.307 4.034 . 0 0 "[ . 1 . 2]" 1
1282 1 119 GLN HA 1 122 TYR H 3.930 . 4.680 2.973 2.719 3.367 . 0 0 "[ . 1 . 2]" 1
1283 1 118 THR MG 1 122 TYR H 5.880 . 6.630 3.445 1.744 3.771 0.056 12 0 "[ . 1 . 2]" 1
1284 1 121 ARG QB 1 122 TYR H 5.050 . 5.800 3.701 1.747 4.060 0.053 12 0 "[ . 1 . 2]" 1
1285 1 6 GLN QE 1 17 PHE QB 7.780 . 8.530 4.662 3.940 5.452 . 0 0 "[ . 1 . 2]" 1
1286 1 6 GLN QE 1 17 PHE QB 8.730 . 9.480 6.151 5.745 6.261 . 0 0 "[ . 1 . 2]" 1
1287 1 122 TYR H 1 124 LYS H 7.000 . 7.750 5.008 4.281 5.810 . 0 0 "[ . 1 . 2]" 1
1288 1 119 GLN QE 1 122 TYR QD 6.930 . 7.680 5.514 5.499 5.521 . 0 0 "[ . 1 . 2]" 1
1289 1 99 MET H 1 119 GLN QE 9.440 . 10.190 4.681 4.015 5.459 . 0 0 "[ . 1 . 2]" 1
1290 1 115 HIS HA 1 119 GLN QE . . 7.680 2.674 2.082 3.528 . 0 0 "[ . 1 . 2]" 1
1291 1 13 LEU H 1 78 ASN QD . . 6.920 3.369 2.544 4.390 . 0 0 "[ . 1 . 2]" 1
1292 1 28 ILE QG 1 33 VAL H 8.820 . 9.570 3.381 3.231 3.657 . 0 0 "[ . 1 . 2]" 1
1293 1 33 VAL H 1 65 LEU H 4.500 . 5.250 4.062 3.948 4.254 . 0 0 "[ . 1 . 2]" 1
1294 1 32 TYR QD 1 33 VAL H 5.050 . 5.800 3.622 3.175 3.904 . 0 0 "[ . 1 . 2]" 1
1295 1 33 VAL H 1 64 ARG HA 4.500 . 5.250 3.127 2.891 3.497 . 0 0 "[ . 1 . 2]" 1
1296 1 28 ILE MD 1 33 VAL H 8.410 . 9.160 4.091 3.846 4.523 . 0 0 "[ . 1 . 2]" 1
1297 1 33 VAL H 1 34 ILE H 5.500 . 6.250 4.452 4.427 4.474 . 0 0 "[ . 1 . 2]" 1
1298 1 33 VAL H 1 34 ILE QG 7.410 . 8.160 3.951 3.775 4.154 . 0 0 "[ . 1 . 2]" 1
1299 1 121 ARG HA 1 123 GLY H 3.500 . 4.250 3.513 3.208 3.692 . 0 0 "[ . 1 . 2]" 1
1300 1 122 TYR QB 1 123 GLY H 3.930 . 4.680 2.888 2.547 3.377 . 0 0 "[ . 1 . 2]" 1
1301 1 116 PHE QB 1 117 VAL H 6.170 . 6.920 2.726 2.612 2.881 . 0 0 "[ . 1 . 2]" 1
1302 1 69 VAL H 1 70 GLY H 3.500 . 4.250 2.687 2.497 2.829 . 0 0 "[ . 1 . 2]" 1
1303 1 68 VAL QG 1 70 GLY H 5.300 . 6.050 3.077 2.159 3.434 . 0 0 "[ . 1 . 2]" 1
1304 1 67 ASP HA 1 70 GLY H 5.500 . 6.250 3.541 3.275 3.914 . 0 0 "[ . 1 . 2]" 1
1305 1 18 ARG QG 1 70 GLY H 8.410 . 9.160 5.053 4.654 5.407 . 0 0 "[ . 1 . 2]" 1
1306 1 114 GLU HA 1 117 VAL H 8.410 . 9.160 2.627 2.530 2.753 . 0 0 "[ . 1 . 2]" 1
1307 1 115 HIS HA 1 117 VAL H 7.860 . 8.610 3.567 3.534 3.587 . 0 0 "[ . 1 . 2]" 1
1308 1 92 ILE HB 1 123 GLY H 8.410 . 9.160 6.076 5.355 7.050 . 0 0 "[ . 1 . 2]" 1
1309 1 92 ILE QG 1 123 GLY H 7.860 . 8.610 4.355 2.497 7.063 . 0 0 "[ . 1 . 2]" 1
1310 1 95 SER QB 1 119 GLN QE 9.440 . 10.190 6.666 5.964 7.020 . 0 0 "[ . 1 . 2]" 1
1311 1 11 GLY H 1 26 LEU QD 9.900 . 10.650 2.700 2.499 3.060 . 0 0 "[ . 1 . 2]" 1
1312 1 60 VAL QG 1 99 MET H 10.590 . 11.340 3.898 3.597 4.332 . 0 0 "[ . 1 . 2]" 1
1313 1 96 ALA MB 1 99 MET H 8.820 . 9.570 4.562 4.174 4.689 . 0 0 "[ . 1 . 2]" 1
1314 1 93 ILE H 1 95 SER H 5.500 . 6.250 4.256 4.170 4.365 . 0 0 "[ . 1 . 2]" 1
1315 1 10 PRO HA 1 93 ILE H 8.820 . 9.570 4.222 4.111 4.349 . 0 0 "[ . 1 . 2]" 1
1316 1 89 VAL QG 1 93 ILE H 10.590 . 11.340 3.692 3.379 3.835 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 80
_Distance_constraint_stats_list.Viol_count 98
_Distance_constraint_stats_list.Viol_total 75.283
_Distance_constraint_stats_list.Viol_max 0.095
_Distance_constraint_stats_list.Viol_rms 0.0114
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0024
_Distance_constraint_stats_list.Viol_average_violations_only 0.0384
_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 12 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ILE 0.298 0.043 15 0 "[ . 1 . 2]"
1 15 GLU 0.071 0.033 16 0 "[ . 1 . 2]"
1 16 ILE 0.238 0.045 12 0 "[ . 1 . 2]"
1 17 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 HIS 0.238 0.045 12 0 "[ . 1 . 2]"
1 25 ALA 0.298 0.043 15 0 "[ . 1 . 2]"
1 26 LEU 0.117 0.023 8 0 "[ . 1 . 2]"
1 27 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 VAL 1.172 0.080 13 0 "[ . 1 . 2]"
1 34 ILE 0.117 0.023 8 0 "[ . 1 . 2]"
1 35 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 ALA 0.008 0.008 9 0 "[ . 1 . 2]"
1 59 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 GLU 1.172 0.080 13 0 "[ . 1 . 2]"
1 64 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 LEU 0.347 0.052 5 0 "[ . 1 . 2]"
1 66 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 VAL 0.347 0.052 5 0 "[ . 1 . 2]"
1 70 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 ARG 0.071 0.033 16 0 "[ . 1 . 2]"
1 77 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 MET 0.008 0.008 9 0 "[ . 1 . 2]"
1 109 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 ARG 1.485 0.095 2 0 "[ . 1 . 2]"
1 112 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 114 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 HIS 1.513 0.095 2 0 "[ . 1 . 2]"
1 116 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 118 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 GLN 0.028 0.028 11 0 "[ . 1 . 2]"
1 120 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 122 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 12 ASP O 1 27 TYR H 2.300 . 3.050 2.210 1.998 2.343 . 0 0 "[ . 1 . 2]" 2
2 1 12 ASP O 1 27 TYR N 3.300 2.500 4.050 3.202 3.002 3.340 . 0 0 "[ . 1 . 2]" 2
3 1 13 LEU O 1 77 ASN H 2.300 . 3.050 2.018 1.835 2.319 . 0 0 "[ . 1 . 2]" 2
4 1 13 LEU O 1 77 ASN N 3.300 2.500 4.050 3.010 2.841 3.309 . 0 0 "[ . 1 . 2]" 2
5 1 14 ILE O 1 25 ALA H 2.300 . 3.050 1.946 1.872 2.141 . 0 0 "[ . 1 . 2]" 2
6 1 14 ILE O 1 25 ALA N 3.300 2.500 4.050 2.880 2.830 2.999 . 0 0 "[ . 1 . 2]" 2
7 1 15 GLU O 1 75 ARG H 2.300 . 3.050 2.091 1.882 2.324 . 0 0 "[ . 1 . 2]" 2
8 1 15 GLU O 1 75 ARG N 3.300 2.500 4.050 3.036 2.870 3.283 . 0 0 "[ . 1 . 2]" 2
9 1 16 ILE O 1 23 HIS H 2.300 . 3.050 1.844 1.755 1.941 0.045 12 0 "[ . 1 . 2]" 2
10 1 16 ILE O 1 23 HIS N 3.300 2.500 4.050 2.840 2.750 2.917 . 0 0 "[ . 1 . 2]" 2
11 1 16 ILE H 1 23 HIS O 2.300 . 3.050 1.813 1.765 1.930 0.035 20 0 "[ . 1 . 2]" 2
12 1 16 ILE N 1 23 HIS O 3.300 2.500 4.050 2.822 2.773 2.921 . 0 0 "[ . 1 . 2]" 2
13 1 14 ILE H 1 25 ALA O 2.300 . 3.050 1.799 1.757 1.934 0.043 15 0 "[ . 1 . 2]" 2
14 1 14 ILE N 1 25 ALA O 3.300 2.500 4.050 2.793 2.764 2.866 . 0 0 "[ . 1 . 2]" 2
15 1 26 LEU O 1 34 ILE H 2.300 . 3.050 1.929 1.848 2.060 . 0 0 "[ . 1 . 2]" 2
16 1 26 LEU O 1 34 ILE N 3.300 2.500 4.050 2.919 2.852 3.042 . 0 0 "[ . 1 . 2]" 2
17 1 29 GLY O 1 32 TYR H 2.300 . 3.050 2.149 1.857 2.314 . 0 0 "[ . 1 . 2]" 2
18 1 29 GLY O 1 32 TYR N 3.300 2.500 4.050 3.114 2.866 3.300 . 0 0 "[ . 1 . 2]" 2
19 1 31 GLY O 1 65 LEU H 2.300 . 3.050 1.875 1.831 1.986 . 0 0 "[ . 1 . 2]" 2
20 1 31 GLY O 1 65 LEU N 3.300 2.500 4.050 2.873 2.819 2.979 . 0 0 "[ . 1 . 2]" 2
21 1 28 ILE H 1 32 TYR O 2.300 . 3.050 2.176 1.906 2.325 . 0 0 "[ . 1 . 2]" 2
22 1 28 ILE N 1 32 TYR O 3.300 2.500 4.050 2.943 2.856 3.029 . 0 0 "[ . 1 . 2]" 2
23 1 33 VAL O 1 63 GLU H 2.300 . 3.050 2.044 1.915 2.248 . 0 0 "[ . 1 . 2]" 2
24 1 33 VAL O 1 63 GLU N 3.300 2.500 4.050 3.025 2.917 3.239 . 0 0 "[ . 1 . 2]" 2
25 1 26 LEU H 1 34 ILE O 2.300 . 3.050 1.809 1.777 1.860 0.023 8 0 "[ . 1 . 2]" 2
26 1 26 LEU N 1 34 ILE O 3.300 2.500 4.050 2.798 2.772 2.840 . 0 0 "[ . 1 . 2]" 2
27 1 35 HIS O 1 61 LYS H 2.300 . 3.050 1.843 1.807 1.945 . 0 0 "[ . 1 . 2]" 2
28 1 35 HIS O 1 61 LYS N 3.300 2.500 4.050 2.858 2.826 2.962 . 0 0 "[ . 1 . 2]" 2
29 1 37 ALA O 1 59 GLU H 2.300 . 3.050 2.108 1.896 2.338 . 0 0 "[ . 1 . 2]" 2
30 1 37 ALA O 1 59 GLU N 3.300 2.500 4.050 3.069 2.873 3.306 . 0 0 "[ . 1 . 2]" 2
31 1 58 ALA O 1 104 MET H 2.300 . 3.050 2.038 1.839 2.312 . 0 0 "[ . 1 . 2]" 2
32 1 58 ALA O 1 104 MET N 3.300 2.500 4.050 3.004 2.826 3.274 . 0 0 "[ . 1 . 2]" 2
33 1 35 HIS H 1 61 LYS O 2.300 . 3.050 1.922 1.852 1.997 . 0 0 "[ . 1 . 2]" 2
34 1 35 HIS N 1 61 LYS O 3.300 2.500 4.050 2.913 2.846 2.992 . 0 0 "[ . 1 . 2]" 2
35 1 33 VAL H 1 63 GLU O 2.300 . 3.050 1.741 1.720 1.771 0.080 13 0 "[ . 1 . 2]" 2
36 1 33 VAL N 1 63 GLU O 3.300 2.500 4.050 2.756 2.732 2.785 . 0 0 "[ . 1 . 2]" 2
37 1 64 ARG O 1 68 VAL H 2.300 . 3.050 2.077 1.933 2.309 . 0 0 "[ . 1 . 2]" 2
38 1 64 ARG O 1 68 VAL N 3.300 2.500 4.050 3.073 2.945 3.285 . 0 0 "[ . 1 . 2]" 2
39 1 65 LEU O 1 69 VAL H 2.300 . 3.050 1.784 1.748 1.813 0.052 5 0 "[ . 1 . 2]" 2
40 1 65 LEU O 1 69 VAL N 3.300 2.500 4.050 2.774 2.733 2.811 . 0 0 "[ . 1 . 2]" 2
41 1 66 GLU O 1 70 GLY H 2.300 . 3.050 2.148 1.938 2.329 . 0 0 "[ . 1 . 2]" 2
42 1 66 GLU O 1 70 GLY N 3.300 2.500 4.050 2.992 2.902 3.244 . 0 0 "[ . 1 . 2]" 2
43 1 17 PHE H 1 73 CYS O 2.300 . 3.050 1.949 1.859 2.113 . 0 0 "[ . 1 . 2]" 2
44 1 17 PHE N 1 73 CYS O 3.300 2.500 4.050 2.939 2.837 3.083 . 0 0 "[ . 1 . 2]" 2
45 1 15 GLU H 1 75 ARG O 2.300 . 3.050 1.814 1.767 1.896 0.033 16 0 "[ . 1 . 2]" 2
46 1 15 GLU N 1 75 ARG O 3.300 2.500 4.050 2.804 2.763 2.875 . 0 0 "[ . 1 . 2]" 2
47 1 89 VAL O 1 93 ILE H 2.300 . 3.050 1.966 1.906 2.114 . 0 0 "[ . 1 . 2]" 2
48 1 89 VAL O 1 93 ILE N 3.300 2.500 4.050 2.963 2.900 3.118 . 0 0 "[ . 1 . 2]" 2
49 1 90 GLU O 1 94 SER H 2.300 . 3.050 1.955 1.862 2.063 . 0 0 "[ . 1 . 2]" 2
50 1 90 GLU O 1 94 SER N 3.300 2.500 4.050 2.892 2.816 2.976 . 0 0 "[ . 1 . 2]" 2
51 1 91 VAL O 1 95 SER H 2.300 . 3.050 1.949 1.870 2.032 . 0 0 "[ . 1 . 2]" 2
52 1 91 VAL O 1 95 SER N 3.300 2.500 4.050 2.894 2.825 2.945 . 0 0 "[ . 1 . 2]" 2
53 1 92 ILE O 1 96 ALA H 2.300 . 3.050 2.012 1.876 2.310 . 0 0 "[ . 1 . 2]" 2
54 1 92 ILE O 1 96 ALA N 3.300 2.500 4.050 2.985 2.859 3.276 . 0 0 "[ . 1 . 2]" 2
55 1 93 ILE O 1 97 LYS H 2.300 . 3.050 2.026 1.885 2.257 . 0 0 "[ . 1 . 2]" 2
56 1 93 ILE O 1 97 LYS N 3.300 2.500 4.050 3.027 2.890 3.258 . 0 0 "[ . 1 . 2]" 2
57 1 94 SER O 1 98 GLU H 2.300 . 3.050 2.078 1.901 2.309 . 0 0 "[ . 1 . 2]" 2
58 1 94 SER O 1 98 GLU N 3.300 2.500 4.050 2.939 2.809 3.115 . 0 0 "[ . 1 . 2]" 2
59 1 58 ALA H 1 104 MET O 2.300 . 3.050 1.902 1.792 2.080 0.008 9 0 "[ . 1 . 2]" 2
60 1 58 ALA N 1 104 MET O 3.300 2.500 4.050 2.855 2.771 2.977 . 0 0 "[ . 1 . 2]" 2
61 1 109 VAL O 1 113 CYS H 2.300 . 3.050 2.103 1.946 2.324 . 0 0 "[ . 1 . 2]" 2
62 1 109 VAL O 1 113 CYS N 3.300 2.500 4.050 3.070 2.940 3.302 . 0 0 "[ . 1 . 2]" 2
63 1 110 SER O 1 114 GLU H 2.300 . 3.050 2.048 1.893 2.309 . 0 0 "[ . 1 . 2]" 2
64 1 110 SER O 1 114 GLU N 3.300 2.500 4.050 3.047 2.899 3.311 . 0 0 "[ . 1 . 2]" 2
65 1 111 ARG O 1 115 HIS H 2.300 . 3.050 1.726 1.705 1.751 0.095 2 0 "[ . 1 . 2]" 2
66 1 111 ARG O 1 115 HIS N 3.300 2.500 4.050 2.727 2.705 2.749 . 0 0 "[ . 1 . 2]" 2
67 1 112 ASN O 1 116 PHE H 2.300 . 3.050 2.165 1.908 2.317 . 0 0 "[ . 1 . 2]" 2
68 1 112 ASN O 1 116 PHE N 3.300 2.500 4.050 3.079 2.864 3.258 . 0 0 "[ . 1 . 2]" 2
69 1 113 CYS O 1 117 VAL H 2.300 . 3.050 1.967 1.846 2.289 . 0 0 "[ . 1 . 2]" 2
70 1 113 CYS O 1 117 VAL N 3.300 2.500 4.050 2.980 2.861 3.303 . 0 0 "[ . 1 . 2]" 2
71 1 114 GLU O 1 118 THR H 2.300 . 3.050 1.966 1.841 2.172 . 0 0 "[ . 1 . 2]" 2
72 1 114 GLU O 1 118 THR N 3.300 2.500 4.050 2.890 2.817 3.017 . 0 0 "[ . 1 . 2]" 2
73 1 115 HIS O 1 119 GLN H 2.300 . 3.050 1.974 1.772 2.239 0.028 11 0 "[ . 1 . 2]" 2
74 1 115 HIS O 1 119 GLN N 3.300 2.500 4.050 2.941 2.769 3.192 . 0 0 "[ . 1 . 2]" 2
75 1 116 PHE O 1 120 LEU H 2.300 . 3.050 2.200 1.981 2.336 . 0 0 "[ . 1 . 2]" 2
76 1 116 PHE O 1 120 LEU N 3.300 2.500 4.050 3.075 2.907 3.213 . 0 0 "[ . 1 . 2]" 2
77 1 117 VAL O 1 121 ARG H 2.300 . 3.050 2.135 1.944 2.399 . 0 0 "[ . 1 . 2]" 2
78 1 117 VAL O 1 121 ARG N 3.300 2.500 4.050 3.122 2.950 3.352 . 0 0 "[ . 1 . 2]" 2
79 1 118 THR O 1 122 TYR H 2.300 . 3.050 2.283 1.812 2.366 . 0 0 "[ . 1 . 2]" 2
80 1 118 THR O 1 122 TYR N 3.300 2.500 4.050 2.772 2.633 2.830 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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