NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
536424 |
2lly   |
18093 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lly
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 1047
_Distance_constraint_stats_list.Viol_count 597
_Distance_constraint_stats_list.Viol_total 390.860
_Distance_constraint_stats_list.Viol_max 0.883
_Distance_constraint_stats_list.Viol_rms 0.0165
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0009
_Distance_constraint_stats_list.Viol_average_violations_only 0.0327
_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 4 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 GLU 0.722 0.023 5 0 "[ . 1 . 2]"
1 6 LEU 3.146 0.108 4 0 "[ . 1 . 2]"
1 7 PRO 3.864 0.108 4 0 "[ . 1 . 2]"
1 8 LEU 0.543 0.081 14 0 "[ . 1 . 2]"
1 9 PHE 0.149 0.081 14 0 "[ . 1 . 2]"
1 10 TYR 0.008 0.003 12 0 "[ . 1 . 2]"
1 11 THR 0.447 0.031 14 0 "[ . 1 . 2]"
1 12 ILE 0.059 0.007 14 0 "[ . 1 . 2]"
1 13 ASN 0.004 0.001 5 0 "[ . 1 . 2]"
1 14 LEU 0.309 0.022 5 0 "[ . 1 . 2]"
1 15 ILE 0.305 0.022 5 0 "[ . 1 . 2]"
1 17 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 CYS 0.441 0.045 16 0 "[ . 1 . 2]"
1 19 LEU 0.486 0.045 16 0 "[ . 1 . 2]"
1 20 LEU 0.047 0.010 18 0 "[ . 1 . 2]"
1 21 ILE 0.003 0.001 16 0 "[ . 1 . 2]"
1 22 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 VAL 2.252 0.883 19 2 "[ . -1 . +2]"
1 29 PHE 2.252 0.883 19 2 "[ . -1 . +2]"
1 30 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 VAL 0.001 0.000 4 0 "[ . 1 . 2]"
1 46 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 SER 0.002 0.001 4 0 "[ . 1 . 2]"
1 49 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 THR 0.038 0.002 12 0 "[ . 1 . 2]"
1 51 VAL 0.690 0.042 4 0 "[ . 1 . 2]"
1 52 PHE 0.003 0.001 11 0 "[ . 1 . 2]"
1 53 LEU 0.021 0.002 12 0 "[ . 1 . 2]"
1 54 LEU 0.015 0.007 10 0 "[ . 1 . 2]"
1 55 LEU 0.004 0.001 11 0 "[ . 1 . 2]"
1 56 ILE 0.005 0.001 11 0 "[ . 1 . 2]"
1 57 THR 0.010 0.010 10 0 "[ . 1 . 2]"
1 58 GLU 0.020 0.007 10 0 "[ . 1 . 2]"
1 59 ILE 0.012 0.007 10 0 "[ . 1 . 2]"
1 60 ILE 0.026 0.011 10 0 "[ . 1 . 2]"
1 61 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 SER 0.048 0.048 12 0 "[ . 1 . 2]"
1 65 SER 0.048 0.048 12 0 "[ . 1 . 2]"
1 66 VAL 0.071 0.071 12 0 "[ . 1 . 2]"
1 67 SER 0.071 0.071 12 0 "[ . 1 . 2]"
1 68 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 ILE 0.005 0.001 4 0 "[ . 1 . 2]"
1 71 GLY 0.001 0.001 9 0 "[ . 1 . 2]"
1 72 GLU 0.000 0.000 15 0 "[ . 1 . 2]"
1 73 TYR 0.004 0.001 4 0 "[ . 1 . 2]"
1 74 LEU 0.002 0.001 9 0 "[ . 1 . 2]"
1 75 LEU 0.002 0.002 15 0 "[ . 1 . 2]"
1 76 PHE 0.002 0.002 15 0 "[ . 1 . 2]"
1 77 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 PHE 2.841 0.699 14 3 "[ -. 1 +* 2]"
1 81 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 ILE 0.424 0.424 19 0 "[ . 1 . 2]"
1 86 VAL 1.057 0.067 13 0 "[ . 1 . 2]"
1 87 ILE 0.023 0.007 13 0 "[ . 1 . 2]"
1 88 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 VAL 1.078 0.746 14 1 "[ . 1 +. 2]"
1 90 PHE 2.065 0.746 14 1 "[ . 1 +. 2]"
1 91 VAL 0.068 0.012 5 0 "[ . 1 . 2]"
1 92 LEU 0.023 0.010 13 0 "[ . 1 . 2]"
1 93 ASN 0.007 0.006 13 0 "[ . 1 . 2]"
1 94 VAL 0.275 0.075 10 0 "[ . 1 . 2]"
1 95 HIS 0.121 0.075 10 0 "[ . 1 . 2]"
1 96 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 ARG 0.001 0.000 9 0 "[ . 1 . 2]"
1 112 ILE 0.005 0.001 11 0 "[ . 1 . 2]"
1 113 PHE 0.001 0.000 9 0 "[ . 1 . 2]"
1 114 LEU 0.002 0.000 11 0 "[ . 1 . 2]"
1 115 TRP 0.028 0.003 11 0 "[ . 1 . 2]"
1 116 MET 0.260 0.009 11 0 "[ . 1 . 2]"
1 117 PHE 0.590 0.030 1 0 "[ . 1 . 2]"
1 118 ILE 0.566 0.030 1 0 "[ . 1 . 2]"
1 119 ILE 0.508 0.018 9 0 "[ . 1 . 2]"
1 120 VAL 2.841 0.699 14 3 "[ -. 1 +* 2]"
1 121 CYS 0.001 0.001 17 0 "[ . 1 . 2]"
1 122 LEU 0.000 0.000 14 0 "[ . 1 . 2]"
1 123 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 128 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 129 PHE 2.750 0.558 16 2 "[ . 1 -+ 2]"
1 131 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 132 PRO 0.508 0.185 20 0 "[ . 1 . 2]"
1 133 TRP 0.231 0.185 20 0 "[ . 1 . 2]"
1 134 LEU 0.046 0.023 18 0 "[ . 1 . 2]"
1 135 ALA 0.323 0.113 17 0 "[ . 1 . 2]"
1 136 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 137 GLU 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 10 TYR QE 1 59 ILE QG . . 4.820 4.233 3.896 4.410 . 0 0 "[ . 1 . 2]" 1
2 1 10 TYR QE 1 56 ILE HG13 . . 4.650 4.568 4.302 4.632 . 0 0 "[ . 1 . 2]" 1
3 1 28 VAL MG2 1 38 LYS HD2 . . 4.240 4.088 3.674 4.239 . 0 0 "[ . 1 . 2]" 1
4 1 21 ILE HG13 1 45 VAL MG1 . . 4.040 3.926 3.457 4.040 0.000 4 0 "[ . 1 . 2]" 1
5 1 21 ILE HB 1 45 VAL MG1 . . 4.210 2.796 2.197 3.823 . 0 0 "[ . 1 . 2]" 1
6 1 56 ILE MD 1 74 LEU MD1 . . 3.970 3.781 3.179 3.971 0.001 1 0 "[ . 1 . 2]" 1
7 1 56 ILE HG12 1 70 ILE MG . . 4.620 4.540 4.178 4.621 0.001 1 0 "[ . 1 . 2]" 1
8 1 56 ILE HB 1 70 ILE MD . . 5.050 4.900 4.021 5.050 0.000 19 0 "[ . 1 . 2]" 1
9 1 49 LEU MD1 1 78 MET HG2 . . 3.580 3.257 2.422 3.578 . 0 0 "[ . 1 . 2]" 1
10 1 42 CYS HB2 1 85 ILE MG . . 4.060 3.956 3.411 4.058 . 0 0 "[ . 1 . 2]" 1
11 1 73 TYR HD2 1 128 LEU MD2 . . 4.800 4.463 4.023 4.780 . 0 0 "[ . 1 . 2]" 1
12 1 72 GLU HB2 1 128 LEU MD2 . . 4.550 4.484 4.277 4.549 . 0 0 "[ . 1 . 2]" 1
13 1 91 VAL MG2 1 109 ILE MG . . 4.280 4.145 3.774 4.275 . 0 0 "[ . 1 . 2]" 1
14 1 80 PHE QD 1 120 VAL QG . . 4.080 3.487 3.307 3.672 . 0 0 "[ . 1 . 2]" 1
15 1 30 TYR QD 1 114 LEU QD . . 4.750 3.635 2.571 4.323 . 0 0 "[ . 1 . 2]" 1
16 1 19 LEU MD1 1 121 CYS HB2 . . 5.360 5.320 5.165 5.361 0.001 17 0 "[ . 1 . 2]" 1
17 1 26 VAL MG1 1 118 ILE MG . . 4.980 4.402 3.386 4.966 . 0 0 "[ . 1 . 2]" 1
18 1 26 VAL MG1 1 114 LEU HB3 . . 4.510 2.655 1.982 4.172 . 0 0 "[ . 1 . 2]" 1
19 1 12 ILE MD 1 129 PHE QE . . 5.200 4.320 2.731 5.116 . 0 0 "[ . 1 . 2]" 1
20 1 73 TYR QB 1 128 LEU QD . . 4.250 2.224 1.847 3.653 . 0 0 "[ . 1 . 2]" 1
21 1 56 ILE MD 1 70 ILE MG . . 4.500 3.100 2.353 3.678 . 0 0 "[ . 1 . 2]" 1
22 1 56 ILE MD 1 70 ILE MD . . 4.170 3.255 2.155 4.160 . 0 0 "[ . 1 . 2]" 1
23 1 80 PHE HE1 1 120 VAL QG . . 3.580 3.183 2.245 4.279 0.699 14 3 "[ -. 1 +* 2]" 1
24 1 18 CYS HB2 1 19 LEU MD2 . . 3.880 3.482 2.944 3.841 . 0 0 "[ . 1 . 2]" 1
25 1 17 PRO HG2 1 21 ILE MD . . 4.770 4.004 3.940 4.136 . 0 0 "[ . 1 . 2]" 1
26 1 118 ILE H 1 118 ILE MD . . 3.860 3.608 3.593 3.632 . 0 0 "[ . 1 . 2]" 1
27 1 115 TRP HZ3 1 118 ILE MD . . 4.320 2.692 2.676 2.707 . 0 0 "[ . 1 . 2]" 1
28 1 116 MET H 1 116 MET HG2 . . 4.360 4.131 4.126 4.148 . 0 0 "[ . 1 . 2]" 1
29 1 114 LEU HA 1 118 ILE MD . . 5.160 5.105 5.086 5.126 . 0 0 "[ . 1 . 2]" 1
30 1 53 LEU HA 1 56 ILE HG13 . . 4.410 3.901 3.347 4.266 . 0 0 "[ . 1 . 2]" 1
31 1 63 THR H 1 63 THR HB . . 4.080 3.168 2.557 3.949 . 0 0 "[ . 1 . 2]" 1
32 1 17 PRO HA 1 21 ILE MD . . 4.750 4.263 4.191 4.491 . 0 0 "[ . 1 . 2]" 1
33 1 43 ILE H 1 43 ILE MD . . 3.860 3.358 3.014 3.617 . 0 0 "[ . 1 . 2]" 1
34 1 87 ILE H 1 87 ILE MD . . 4.130 3.440 3.194 3.647 . 0 0 "[ . 1 . 2]" 1
35 1 107 GLY H 1 109 ILE MD . . 3.480 3.100 2.727 3.447 . 0 0 "[ . 1 . 2]" 1
36 1 12 ILE H 1 12 ILE MD . . 3.580 3.230 3.025 3.317 . 0 0 "[ . 1 . 2]" 1
37 1 109 ILE H 1 109 ILE MD . . 3.640 3.592 3.526 3.632 . 0 0 "[ . 1 . 2]" 1
38 1 56 ILE H 1 56 ILE MD . . 3.940 3.438 3.239 3.689 . 0 0 "[ . 1 . 2]" 1
39 1 87 ILE MD 1 88 THR H . . 4.910 4.685 4.571 4.755 . 0 0 "[ . 1 . 2]" 1
40 1 112 ILE H 1 112 ILE MD . . 3.520 3.411 3.343 3.466 . 0 0 "[ . 1 . 2]" 1
41 1 59 ILE H 1 59 ILE MD . . 4.120 3.386 3.294 3.656 . 0 0 "[ . 1 . 2]" 1
42 1 59 ILE H 1 60 ILE MD . . 4.380 4.160 3.952 4.381 0.001 8 0 "[ . 1 . 2]" 1
43 1 115 TRP HE3 1 119 ILE MD . . 4.250 2.188 2.135 2.274 . 0 0 "[ . 1 . 2]" 1
44 1 18 CYS H 1 21 ILE MD . . 4.100 3.782 3.689 3.906 . 0 0 "[ . 1 . 2]" 1
45 1 15 ILE MD 1 18 CYS H . . 5.180 4.449 4.129 5.074 . 0 0 "[ . 1 . 2]" 1
46 1 52 PHE HE1 1 70 ILE MD . . 4.550 3.592 2.407 4.550 . 0 0 "[ . 1 . 2]" 1
47 1 70 ILE MD 1 73 TYR HD2 . . 5.100 2.499 2.302 3.534 . 0 0 "[ . 1 . 2]" 1
48 1 10 TYR QD 1 59 ILE MD . . 3.900 3.790 3.295 3.865 . 0 0 "[ . 1 . 2]" 1
49 1 52 PHE HE1 1 56 ILE MD . . 3.500 2.214 1.980 2.534 . 0 0 "[ . 1 . 2]" 1
50 1 115 TRP HA 1 119 ILE MD . . 4.200 3.958 3.888 4.021 . 0 0 "[ . 1 . 2]" 1
51 1 115 TRP HA 1 118 ILE MD . . 3.920 2.006 1.973 2.012 . 0 0 "[ . 1 . 2]" 1
52 1 52 PHE HA 1 56 ILE MD . . 5.500 5.180 5.020 5.342 . 0 0 "[ . 1 . 2]" 1
53 1 55 LEU HA 1 56 ILE MD . . 5.500 5.304 4.946 5.501 0.001 11 0 "[ . 1 . 2]" 1
54 1 59 ILE HA 1 60 ILE MD . . 3.210 3.152 3.025 3.207 . 0 0 "[ . 1 . 2]" 1
55 1 70 ILE HA 1 70 ILE MD . . 3.870 3.724 3.673 3.759 . 0 0 "[ . 1 . 2]" 1
56 1 56 ILE HA 1 56 ILE MD . . 3.800 2.021 1.952 2.111 . 0 0 "[ . 1 . 2]" 1
57 1 12 ILE HA 1 12 ILE MD . . 3.180 2.099 2.016 2.190 . 0 0 "[ . 1 . 2]" 1
58 1 39 ILE HA 1 39 ILE MD . . 3.920 3.351 2.001 3.871 . 0 0 "[ . 1 . 2]" 1
59 1 15 ILE HA 1 15 ILE MD . . 3.710 2.184 1.986 2.392 . 0 0 "[ . 1 . 2]" 1
60 1 87 ILE HA 1 87 ILE MD . . 3.850 2.004 1.963 2.077 . 0 0 "[ . 1 . 2]" 1
61 1 112 ILE MD 1 115 TRP HB2 . . 3.380 3.242 3.213 3.284 . 0 0 "[ . 1 . 2]" 1
62 1 87 ILE MD 1 90 PHE HB3 . . 4.890 4.286 4.082 4.648 . 0 0 "[ . 1 . 2]" 1
63 1 87 ILE MD 1 90 PHE HB2 . . 5.040 3.569 3.299 3.700 . 0 0 "[ . 1 . 2]" 1
64 1 18 CYS HB2 1 21 ILE MD . . 4.640 4.247 3.952 4.523 . 0 0 "[ . 1 . 2]" 1
65 1 18 CYS HB3 1 21 ILE MD . . 4.640 4.498 4.188 4.641 0.001 16 0 "[ . 1 . 2]" 1
66 1 116 MET HG3 1 119 ILE MD . . 4.880 4.461 4.392 4.484 . 0 0 "[ . 1 . 2]" 1
67 1 116 MET HG2 1 119 ILE MD . . 4.200 3.343 3.312 3.386 . 0 0 "[ . 1 . 2]" 1
68 1 86 VAL HB 1 87 ILE MD . . 4.340 4.294 4.022 4.340 . 0 0 "[ . 1 . 2]" 1
69 1 109 ILE HB 1 109 ILE MD . . 2.850 2.380 2.306 2.483 . 0 0 "[ . 1 . 2]" 1
70 1 85 ILE HB 1 85 ILE MD . . 2.770 2.174 2.027 3.194 0.424 19 0 "[ . 1 . 2]" 1
71 1 56 ILE HB 1 56 ILE MD . . 3.440 3.221 3.216 3.230 . 0 0 "[ . 1 . 2]" 1
72 1 118 ILE HA 1 118 ILE MD . . 4.380 4.161 4.160 4.162 . 0 0 "[ . 1 . 2]" 1
73 1 70 ILE MG 1 71 GLY H . . 3.720 2.537 2.412 2.611 . 0 0 "[ . 1 . 2]" 1
74 1 118 ILE H 1 118 ILE MG . . 2.890 2.402 2.308 2.462 . 0 0 "[ . 1 . 2]" 1
75 1 70 ILE H 1 70 ILE MG . . 3.960 2.318 2.120 2.458 . 0 0 "[ . 1 . 2]" 1
76 1 43 ILE MG 1 44 SER H . . 3.930 3.397 3.016 3.715 . 0 0 "[ . 1 . 2]" 1
77 1 112 ILE MG 1 113 PHE H . . 4.410 3.563 3.526 3.609 . 0 0 "[ . 1 . 2]" 1
78 1 87 ILE MG 1 88 THR H . . 3.980 3.534 3.173 3.649 . 0 0 "[ . 1 . 2]" 1
79 1 112 ILE H 1 112 ILE MG . . 4.310 3.754 3.750 3.760 . 0 0 "[ . 1 . 2]" 1
80 1 56 ILE MG 1 57 THR H . . 3.920 3.622 3.451 3.767 . 0 0 "[ . 1 . 2]" 1
81 1 13 ASN H 1 15 ILE MG . . 4.460 3.997 3.910 4.286 . 0 0 "[ . 1 . 2]" 1
82 1 59 ILE H 1 59 ILE MG . . 3.220 2.313 2.139 2.469 . 0 0 "[ . 1 . 2]" 1
83 1 14 LEU H 1 15 ILE MG . . 4.080 3.501 3.414 3.946 . 0 0 "[ . 1 . 2]" 1
84 1 70 ILE MG 1 73 TYR HD2 . . 4.530 4.122 3.994 4.530 0.000 1 0 "[ . 1 . 2]" 1
85 1 52 PHE HE1 1 56 ILE MG . . 4.560 4.447 4.193 4.561 0.001 10 0 "[ . 1 . 2]" 1
86 1 60 ILE HA 1 60 ILE MG . . 3.060 2.360 2.231 2.383 . 0 0 "[ . 1 . 2]" 1
87 1 70 ILE HA 1 70 ILE MG . . 3.390 3.182 3.172 3.196 . 0 0 "[ . 1 . 2]" 1
88 1 109 ILE HA 1 109 ILE MG . . 2.860 2.302 2.209 2.378 . 0 0 "[ . 1 . 2]" 1
89 1 112 ILE HA 1 112 ILE MG . . 3.410 2.372 2.350 2.415 . 0 0 "[ . 1 . 2]" 1
90 1 56 ILE HA 1 56 ILE MG . . 3.670 2.374 2.324 2.442 . 0 0 "[ . 1 . 2]" 1
91 1 21 ILE HA 1 21 ILE MG . . 2.910 2.294 2.260 2.331 . 0 0 "[ . 1 . 2]" 1
92 1 79 ILE HA 1 79 ILE MG . . 3.400 2.386 2.237 2.503 . 0 0 "[ . 1 . 2]" 1
93 1 112 ILE MG 1 115 TRP HB2 . . 4.200 3.399 3.362 3.495 . 0 0 "[ . 1 . 2]" 1
94 1 87 ILE MG 1 90 PHE HB2 . . 3.900 3.691 3.414 3.862 . 0 0 "[ . 1 . 2]" 1
95 1 109 ILE MG 1 113 PHE HB2 . . 3.500 3.121 2.960 3.302 . 0 0 "[ . 1 . 2]" 1
96 1 112 ILE MG 1 116 MET HG3 . . 3.870 3.766 3.725 3.783 . 0 0 "[ . 1 . 2]" 1
97 1 112 ILE MG 1 116 MET HG2 . . 4.630 4.630 4.629 4.631 0.001 11 0 "[ . 1 . 2]" 1
98 1 70 ILE HG13 1 70 ILE MG . . 3.690 3.198 3.191 3.203 . 0 0 "[ . 1 . 2]" 1
99 1 60 ILE HG12 1 60 ILE MG . . 2.870 2.052 1.961 2.134 . 0 0 "[ . 1 . 2]" 1
100 1 109 ILE HG12 1 109 ILE MG . . 2.420 2.353 2.273 2.412 . 0 0 "[ . 1 . 2]" 1
101 1 60 ILE HG13 1 60 ILE MG . . 2.880 2.874 2.840 2.891 0.011 10 0 "[ . 1 . 2]" 1
102 1 81 VAL H 1 81 VAL QG . . 3.680 1.895 1.831 1.965 . 0 0 "[ . 1 . 2]" 1
103 1 47 LEU H 1 47 LEU MD1 . . 4.670 3.626 2.464 4.232 . 0 0 "[ . 1 . 2]" 1
104 1 123 LEU MD1 1 124 GLY H . . 3.390 2.525 2.308 2.656 . 0 0 "[ . 1 . 2]" 1
105 1 123 LEU H 1 123 LEU MD2 . . 4.470 4.032 4.010 4.066 . 0 0 "[ . 1 . 2]" 1
106 1 123 LEU MD2 1 124 GLY H . . 4.860 3.841 3.753 3.892 . 0 0 "[ . 1 . 2]" 1
107 1 74 LEU H 1 74 LEU MD1 . . 4.380 3.577 3.171 3.796 . 0 0 "[ . 1 . 2]" 1
108 1 83 LEU H 1 83 LEU MD1 . . 4.400 3.690 3.196 4.188 . 0 0 "[ . 1 . 2]" 1
109 1 83 LEU H 1 83 LEU MD2 . . 4.400 3.255 2.262 3.644 . 0 0 "[ . 1 . 2]" 1
110 1 8 LEU MD1 1 12 ILE H . . 3.450 3.173 3.041 3.454 0.004 18 0 "[ . 1 . 2]" 1
111 1 8 LEU H 1 8 LEU MD2 . . 4.000 3.662 3.519 3.959 . 0 0 "[ . 1 . 2]" 1
112 1 114 LEU H 1 114 LEU QD . . 3.850 3.009 2.931 3.139 . 0 0 "[ . 1 . 2]" 1
113 1 114 LEU QD 1 115 TRP H . . 4.310 3.214 3.167 3.245 . 0 0 "[ . 1 . 2]" 1
114 1 28 VAL H 1 28 VAL MG1 . . 3.920 3.087 2.129 3.763 . 0 0 "[ . 1 . 2]" 1
115 1 28 VAL H 1 28 VAL MG2 . . 3.920 2.563 1.940 3.765 . 0 0 "[ . 1 . 2]" 1
116 1 18 CYS H 1 19 LEU MD2 . . 4.150 4.172 4.163 4.195 0.045 16 0 "[ . 1 . 2]" 1
117 1 6 LEU QD 1 10 TYR QD . . 2.910 2.640 2.252 2.796 . 0 0 "[ . 1 . 2]" 1
118 1 6 LEU QD 1 10 TYR QE . . 3.850 2.752 2.556 3.290 . 0 0 "[ . 1 . 2]" 1
119 1 94 VAL MG1 1 95 HIS HA . . 5.200 3.600 2.844 4.444 . 0 0 "[ . 1 . 2]" 1
120 1 94 VAL MG2 1 95 HIS HA . . 5.200 4.469 3.295 5.275 0.075 10 0 "[ . 1 . 2]" 1
121 1 8 LEU HA 1 8 LEU MD2 . . 3.000 2.005 1.928 2.049 . 0 0 "[ . 1 . 2]" 1
122 1 122 LEU HA 1 122 LEU MD2 . . 2.510 2.251 2.037 2.490 . 0 0 "[ . 1 . 2]" 1
123 1 123 LEU HA 1 123 LEU MD2 . . 3.050 1.954 1.944 1.985 . 0 0 "[ . 1 . 2]" 1
124 1 91 VAL HA 1 91 VAL MG2 . . 3.220 2.351 2.283 2.405 . 0 0 "[ . 1 . 2]" 1
125 1 123 LEU MD1 1 124 GLY HA2 . . 2.820 2.435 2.290 2.557 . 0 0 "[ . 1 . 2]" 1
126 1 123 LEU MD2 1 124 GLY HA2 . . 4.280 3.749 3.651 3.812 . 0 0 "[ . 1 . 2]" 1
127 1 81 VAL QG 1 82 THR HA . . 3.520 3.180 3.071 3.309 . 0 0 "[ . 1 . 2]" 1
128 1 27 LEU MD1 1 30 TYR HB3 . . 4.390 3.128 2.257 3.665 . 0 0 "[ . 1 . 2]" 1
129 1 91 VAL MG2 1 92 LEU HB2 . . 4.190 4.181 4.129 4.200 0.010 13 0 "[ . 1 . 2]" 1
130 1 8 LEU HB3 1 8 LEU MD1 . . 2.400 2.200 2.084 2.245 . 0 0 "[ . 1 . 2]" 1
131 1 8 LEU MD2 1 11 THR MG . . 2.710 2.671 2.232 2.732 0.022 14 0 "[ . 1 . 2]" 1
132 1 80 PHE H 1 81 VAL QG . . 3.970 3.501 3.384 3.593 . 0 0 "[ . 1 . 2]" 1
133 1 82 THR MG 1 83 LEU H . . 3.830 2.755 2.508 3.264 . 0 0 "[ . 1 . 2]" 1
134 1 103 THR MG 1 104 GLY H . . 4.490 3.501 1.971 4.251 . 0 0 "[ . 1 . 2]" 1
135 1 77 THR MG 1 78 MET H . . 4.190 3.193 2.211 3.996 . 0 0 "[ . 1 . 2]" 1
136 1 120 VAL H 1 120 VAL QG . . 3.120 1.853 1.851 1.865 . 0 0 "[ . 1 . 2]" 1
137 1 11 THR MG 1 12 ILE H . . 3.580 3.159 3.043 3.185 . 0 0 "[ . 1 . 2]" 1
138 1 56 ILE H 1 57 THR MG . . 3.900 3.730 3.564 3.839 . 0 0 "[ . 1 . 2]" 1
139 1 91 VAL MG1 1 92 LEU H . . 3.570 2.122 2.024 2.267 . 0 0 "[ . 1 . 2]" 1
140 1 57 THR H 1 57 THR MG . . 3.560 2.205 2.075 2.434 . 0 0 "[ . 1 . 2]" 1
141 1 11 THR MG 1 14 LEU H . . 4.800 4.544 4.230 4.650 . 0 0 "[ . 1 . 2]" 1
142 1 80 PHE QD 1 81 VAL QG . . 3.620 3.185 2.885 3.438 . 0 0 "[ . 1 . 2]" 1
143 1 57 THR HA 1 57 THR MG . . 3.200 2.457 2.342 2.561 . 0 0 "[ . 1 . 2]" 1
144 1 48 SER HA 1 51 VAL MG1 . . 3.410 3.385 3.289 3.411 0.001 4 0 "[ . 1 . 2]" 1
145 1 11 THR HA 1 11 THR MG . . 3.160 2.609 2.598 2.648 . 0 0 "[ . 1 . 2]" 1
146 1 11 THR MG 1 12 ILE HA . . 3.420 3.131 3.079 3.149 . 0 0 "[ . 1 . 2]" 1
147 1 80 PHE HB3 1 81 VAL QG . . 4.160 2.908 2.745 3.080 . 0 0 "[ . 1 . 2]" 1
148 1 50 THR MG 1 54 LEU HB2 . . 3.870 3.855 3.699 3.871 0.001 4 0 "[ . 1 . 2]" 1
149 1 91 VAL MG1 1 92 LEU HB2 . . 2.950 2.909 2.857 2.947 . 0 0 "[ . 1 . 2]" 1
150 1 50 THR MG 1 53 LEU HG . . 4.300 3.900 3.497 3.962 . 0 0 "[ . 1 . 2]" 1
151 1 56 ILE HB 1 57 THR MG . . 4.490 3.165 2.946 3.281 . 0 0 "[ . 1 . 2]" 1
152 1 125 THR MG 1 128 LEU HB2 . . 5.100 5.049 4.925 5.093 . 0 0 "[ . 1 . 2]" 1
153 1 91 VAL MG1 1 92 LEU HB3 . . 3.870 3.683 3.609 3.789 . 0 0 "[ . 1 . 2]" 1
154 1 8 LEU MD1 1 11 THR MG . . 3.160 2.654 2.295 3.177 0.017 12 0 "[ . 1 . 2]" 1
155 1 11 THR MG 1 12 ILE MD . . 2.870 2.344 2.154 2.684 . 0 0 "[ . 1 . 2]" 1
156 1 132 PRO HA 1 135 ALA MB . . 2.890 1.994 1.953 2.046 . 0 0 "[ . 1 . 2]" 1
157 1 132 PRO HB3 1 135 ALA MB . . 3.920 3.845 3.257 4.033 0.113 17 0 "[ . 1 . 2]" 1
158 1 116 MET ME 1 117 PHE H . . 3.760 3.307 3.296 3.322 . 0 0 "[ . 1 . 2]" 1
159 1 116 MET ME 1 117 PHE HD1 . . 3.750 3.751 3.751 3.752 0.002 7 0 "[ . 1 . 2]" 1
160 1 116 MET HA 1 116 MET ME . . 3.480 2.958 2.933 3.018 . 0 0 "[ . 1 . 2]" 1
161 1 116 MET ME 1 120 VAL HA . . 5.090 4.418 4.388 4.556 . 0 0 "[ . 1 . 2]" 1
162 1 116 MET ME 1 117 PHE HB2 . . 4.890 4.809 4.798 4.822 . 0 0 "[ . 1 . 2]" 1
163 1 116 MET ME 1 116 MET HG2 . . 3.480 2.578 2.559 2.584 . 0 0 "[ . 1 . 2]" 1
164 1 116 MET HB3 1 116 MET ME . . 3.420 1.963 1.961 1.973 . 0 0 "[ . 1 . 2]" 1
165 1 116 MET ME 1 119 ILE HB . . 3.670 3.604 3.571 3.671 0.001 9 0 "[ . 1 . 2]" 1
166 1 116 MET ME 1 119 ILE MG . . 3.020 2.556 2.526 2.659 . 0 0 "[ . 1 . 2]" 1
167 1 20 LEU HB3 1 21 ILE H . . 4.590 2.863 2.158 3.363 . 0 0 "[ . 1 . 2]" 1
168 1 41 LEU H 1 41 LEU HB3 . . 4.010 2.841 2.269 3.572 . 0 0 "[ . 1 . 2]" 1
169 1 54 LEU H 1 54 LEU HB2 . . 4.060 2.152 2.061 2.246 . 0 0 "[ . 1 . 2]" 1
170 1 55 LEU H 1 55 LEU HB3 . . 3.750 3.179 2.961 3.312 . 0 0 "[ . 1 . 2]" 1
171 1 47 LEU HB2 1 48 SER H . . 4.310 3.067 2.714 3.426 . 0 0 "[ . 1 . 2]" 1
172 1 114 LEU H 1 114 LEU HB2 . . 3.670 3.535 3.530 3.542 . 0 0 "[ . 1 . 2]" 1
173 1 92 LEU HB3 1 94 VAL H . . 5.500 5.319 4.933 5.501 0.001 5 0 "[ . 1 . 2]" 1
174 1 113 PHE HE1 1 114 LEU HB2 . . 4.740 4.691 4.655 4.740 0.000 9 0 "[ . 1 . 2]" 1
175 1 55 LEU HB3 1 56 ILE HA . . 4.180 3.907 3.770 4.053 . 0 0 "[ . 1 . 2]" 1
176 1 50 THR HA 1 54 LEU HB2 . . 5.160 4.974 4.780 5.052 . 0 0 "[ . 1 . 2]" 1
177 1 8 LEU HB3 1 9 PHE HB2 . . 5.460 4.850 4.449 5.110 . 0 0 "[ . 1 . 2]" 1
178 1 6 LEU HB2 1 10 TYR HB2 . . 5.330 5.165 4.567 5.332 0.002 12 0 "[ . 1 . 2]" 1
179 1 54 LEU HB3 1 58 GLU HG2 . . 5.160 4.470 4.058 5.167 0.007 10 0 "[ . 1 . 2]" 1
180 1 7 PRO HB2 1 8 LEU HB3 . . 4.300 4.155 3.794 4.295 . 0 0 "[ . 1 . 2]" 1
181 1 55 LEU HB3 1 56 ILE HG12 . . 3.530 3.415 3.186 3.530 . 0 0 "[ . 1 . 2]" 1
182 1 114 LEU HB2 1 114 LEU QD . . 3.230 2.017 1.923 2.093 . 0 0 "[ . 1 . 2]" 1
183 1 55 LEU HB3 1 56 ILE MD . . 4.080 3.480 3.118 3.785 . 0 0 "[ . 1 . 2]" 1
184 1 70 ILE HB 1 71 GLY H . . 4.330 4.081 4.036 4.143 . 0 0 "[ . 1 . 2]" 1
185 1 109 ILE HB 1 110 ASP H . . 4.110 2.872 2.750 3.031 . 0 0 "[ . 1 . 2]" 1
186 1 79 ILE H 1 79 ILE HB . . 3.940 2.449 2.337 2.635 . 0 0 "[ . 1 . 2]" 1
187 1 70 ILE H 1 70 ILE HB . . 3.890 2.429 2.330 2.531 . 0 0 "[ . 1 . 2]" 1
188 1 12 ILE H 1 12 ILE HB . . 3.920 2.611 2.530 2.644 . 0 0 "[ . 1 . 2]" 1
189 1 85 ILE HB 1 86 VAL H . . 4.430 2.922 2.335 3.026 . 0 0 "[ . 1 . 2]" 1
190 1 43 ILE HB 1 44 SER H . . 4.190 2.725 2.469 2.974 . 0 0 "[ . 1 . 2]" 1
191 1 109 ILE HB 1 111 ARG H . . 5.500 5.345 5.274 5.445 . 0 0 "[ . 1 . 2]" 1
192 1 111 ARG H 1 112 ILE HB . . 5.500 4.927 4.869 5.008 . 0 0 "[ . 1 . 2]" 1
193 1 59 ILE H 1 59 ILE HB . . 4.080 3.637 3.616 3.646 . 0 0 "[ . 1 . 2]" 1
194 1 109 ILE HB 1 110 ASP HA . . 4.250 4.191 4.125 4.245 . 0 0 "[ . 1 . 2]" 1
195 1 112 ILE HB 1 115 TRP HB2 . . 4.860 4.849 4.845 4.854 . 0 0 "[ . 1 . 2]" 1
196 1 79 ILE HB 1 80 PHE HB2 . . 4.610 4.315 4.140 4.480 . 0 0 "[ . 1 . 2]" 1
197 1 109 ILE HB 1 110 ASP HB2 . . 4.510 4.414 4.314 4.505 . 0 0 "[ . 1 . 2]" 1
198 1 112 ILE HB 1 112 ILE MD . . 3.290 3.223 3.216 3.230 . 0 0 "[ . 1 . 2]" 1
199 1 14 LEU H 1 15 ILE HB . . 4.570 4.551 4.339 4.592 0.022 5 0 "[ . 1 . 2]" 1
200 1 116 MET HB3 1 119 ILE HB . . 4.670 4.675 4.670 4.676 0.006 10 0 "[ . 1 . 2]" 1
201 1 120 VAL HB 1 124 GLY H . . 4.760 4.276 4.168 4.430 . 0 0 "[ . 1 . 2]" 1
202 1 116 MET HB3 1 117 PHE H . . 4.860 2.574 2.549 2.578 . 0 0 "[ . 1 . 2]" 1
203 1 126 VAL HB 1 127 GLY H . . 3.750 2.535 2.297 2.802 . 0 0 "[ . 1 . 2]" 1
204 1 7 PRO HB2 1 8 LEU H . . 3.830 2.232 2.076 2.341 . 0 0 "[ . 1 . 2]" 1
205 1 126 VAL H 1 126 VAL HB . . 3.750 2.402 2.296 2.557 . 0 0 "[ . 1 . 2]" 1
206 1 91 VAL HB 1 92 LEU H . . 4.210 4.038 3.972 4.113 . 0 0 "[ . 1 . 2]" 1
207 1 26 VAL H 1 26 VAL HB . . 4.120 2.507 2.344 2.682 . 0 0 "[ . 1 . 2]" 1
208 1 132 PRO HB3 1 133 TRP H . . 4.510 3.851 3.161 4.148 . 0 0 "[ . 1 . 2]" 1
209 1 80 PHE QD 1 81 VAL HB . . 5.500 5.353 5.036 5.439 . 0 0 "[ . 1 . 2]" 1
210 1 58 GLU HA 1 58 GLU HG2 . . 4.030 3.151 2.677 3.781 . 0 0 "[ . 1 . 2]" 1
211 1 58 GLU HA 1 58 GLU HG3 . . 4.120 3.753 3.629 3.804 . 0 0 "[ . 1 . 2]" 1
212 1 55 LEU HA 1 58 GLU HG2 . . 4.300 2.795 1.999 3.403 . 0 0 "[ . 1 . 2]" 1
213 1 78 MET HA 1 78 MET HG3 . . 4.230 3.043 2.654 3.632 . 0 0 "[ . 1 . 2]" 1
214 1 116 MET HA 1 116 MET HG2 . . 4.110 2.037 2.036 2.039 . 0 0 "[ . 1 . 2]" 1
215 1 123 LEU HA 1 126 VAL HB . . 3.770 3.024 2.749 3.376 . 0 0 "[ . 1 . 2]" 1
216 1 120 VAL HB 1 121 CYS HA . . 4.580 4.445 4.441 4.452 . 0 0 "[ . 1 . 2]" 1
217 1 81 VAL HB 1 82 THR HA . . 4.960 4.546 4.415 4.668 . 0 0 "[ . 1 . 2]" 1
218 1 116 MET HB3 1 117 PHE HB2 . . 4.870 4.761 4.741 4.764 . 0 0 "[ . 1 . 2]" 1
219 1 90 PHE HB2 1 91 VAL HB . . 4.990 4.772 4.422 4.985 . 0 0 "[ . 1 . 2]" 1
220 1 116 MET HG2 1 119 ILE MG . . 4.480 2.991 2.980 3.019 . 0 0 "[ . 1 . 2]" 1
221 1 78 MET HA 1 78 MET HG2 . . 4.230 2.296 2.089 2.531 . 0 0 "[ . 1 . 2]" 1
222 1 47 LEU H 1 47 LEU HG . . 4.350 3.903 3.275 4.309 . 0 0 "[ . 1 . 2]" 1
223 1 74 LEU H 1 74 LEU HG . . 4.230 3.411 3.215 3.779 . 0 0 "[ . 1 . 2]" 1
224 1 109 ILE HG13 1 110 ASP H . . 4.490 4.078 3.930 4.204 . 0 0 "[ . 1 . 2]" 1
225 1 100 GLU H 1 100 GLU HB2 . . 3.840 3.134 2.966 3.659 . 0 0 "[ . 1 . 2]" 1
226 1 19 LEU HG 1 20 LEU H . . 3.880 3.779 3.577 3.890 0.010 18 0 "[ . 1 . 2]" 1
227 1 12 ILE H 1 12 ILE HG13 . . 3.660 3.568 3.529 3.660 . 0 0 "[ . 1 . 2]" 1
228 1 66 VAL HB 1 67 SER H . . 4.110 3.464 1.970 4.105 . 0 0 "[ . 1 . 2]" 1
229 1 114 LEU HG 1 115 TRP H . . 4.040 2.317 2.301 2.342 . 0 0 "[ . 1 . 2]" 1
230 1 27 LEU H 1 27 LEU HG . . 4.940 4.424 4.029 4.594 . 0 0 "[ . 1 . 2]" 1
231 1 92 LEU HG 1 93 ASN H . . 5.360 4.700 4.541 5.062 . 0 0 "[ . 1 . 2]" 1
232 1 58 GLU HB3 1 59 ILE H . . 4.320 3.794 3.635 4.003 . 0 0 "[ . 1 . 2]" 1
233 1 59 ILE H 1 59 ILE QG . . 3.720 2.002 1.927 2.120 . 0 0 "[ . 1 . 2]" 1
234 1 59 ILE QG 1 60 ILE H . . 4.130 2.366 2.151 2.699 . 0 0 "[ . 1 . 2]" 1
235 1 128 LEU H 1 128 LEU HG . . 4.550 4.459 4.402 4.523 . 0 0 "[ . 1 . 2]" 1
236 1 17 PRO HG3 1 18 CYS H . . 4.400 3.952 3.934 3.986 . 0 0 "[ . 1 . 2]" 1
237 1 132 PRO HG2 1 133 TRP H . . 4.410 2.531 1.800 3.953 . 0 0 "[ . 1 . 2]" 1
238 1 28 VAL HB 1 29 PHE QD . . 4.590 4.136 2.863 4.555 . 0 0 "[ . 1 . 2]" 1
239 1 111 ARG HB2 1 115 TRP HD1 . . 4.210 3.140 3.113 3.197 . 0 0 "[ . 1 . 2]" 1
240 1 111 ARG HG3 1 115 TRP HD1 . . 4.220 4.066 3.983 4.197 . 0 0 "[ . 1 . 2]" 1
241 1 114 LEU HG 1 115 TRP HD1 . . 4.370 4.020 4.000 4.037 . 0 0 "[ . 1 . 2]" 1
242 1 115 TRP HZ3 1 118 ILE HG12 . . 4.950 4.698 4.605 4.717 . 0 0 "[ . 1 . 2]" 1
243 1 98 SER HA 1 99 PRO HG2 . . 4.980 4.601 4.600 4.602 . 0 0 "[ . 1 . 2]" 1
244 1 98 SER HA 1 99 PRO HG3 . . 4.600 4.539 4.538 4.540 . 0 0 "[ . 1 . 2]" 1
245 1 132 PRO HB2 1 133 TRP HA . . 4.170 3.987 3.791 4.083 . 0 0 "[ . 1 . 2]" 1
246 1 128 LEU HG 1 129 PHE HA . . 3.870 3.754 3.601 3.849 . 0 0 "[ . 1 . 2]" 1
247 1 131 PRO HA 1 132 PRO HG3 . . 4.700 4.563 4.562 4.564 . 0 0 "[ . 1 . 2]" 1
248 1 60 ILE HA 1 60 ILE HG12 . . 3.500 3.327 3.298 3.375 . 0 0 "[ . 1 . 2]" 1
249 1 9 PHE HA 1 12 ILE HG13 . . 3.790 3.554 3.030 3.665 . 0 0 "[ . 1 . 2]" 1
250 1 59 ILE HA 1 59 ILE QG . . 3.810 3.308 3.304 3.309 . 0 0 "[ . 1 . 2]" 1
251 1 70 ILE HA 1 70 ILE HG13 . . 3.390 2.328 2.242 2.388 . 0 0 "[ . 1 . 2]" 1
252 1 47 LEU HA 1 47 LEU HG . . 3.740 2.456 2.145 3.633 . 0 0 "[ . 1 . 2]" 1
253 1 27 LEU HA 1 27 LEU HG . . 3.720 3.654 3.631 3.696 . 0 0 "[ . 1 . 2]" 1
254 1 122 LEU HA 1 122 LEU HG . . 4.120 3.650 3.631 3.699 . 0 0 "[ . 1 . 2]" 1
255 1 108 GLY HA2 1 111 ARG HG2 . . 3.430 2.226 2.060 2.398 . 0 0 "[ . 1 . 2]" 1
256 1 50 THR HA 1 53 LEU HG . . 4.200 3.925 2.765 4.058 . 0 0 "[ . 1 . 2]" 1
257 1 118 ILE HG12 1 119 ILE HA . . 4.650 4.620 4.498 4.647 . 0 0 "[ . 1 . 2]" 1
258 1 132 PRO HB2 1 133 TRP HB2 . . 4.790 4.484 3.463 4.790 . 0 0 "[ . 1 . 2]" 1
259 1 114 LEU HG 1 115 TRP HB2 . . 4.520 3.578 3.566 3.603 . 0 0 "[ . 1 . 2]" 1
260 1 132 PRO HG2 1 133 TRP HB2 . . 4.120 3.503 3.373 3.811 . 0 0 "[ . 1 . 2]" 1
261 1 132 PRO HG3 1 133 TRP HB2 . . 5.340 5.226 5.103 5.525 0.185 20 0 "[ . 1 . 2]" 1
262 1 110 ASP HB3 1 111 ARG HB3 . . 4.670 4.430 4.292 4.565 . 0 0 "[ . 1 . 2]" 1
263 1 116 MET HG2 1 119 ILE HG12 . . 5.260 5.266 5.266 5.269 0.009 11 0 "[ . 1 . 2]" 1
264 1 12 ILE HB 1 12 ILE HG13 . . 2.810 2.435 2.412 2.499 . 0 0 "[ . 1 . 2]" 1
265 1 132 PRO HG2 1 135 ALA MB . . 5.190 5.146 4.905 5.234 0.044 18 0 "[ . 1 . 2]" 1
266 1 111 ARG HB2 1 112 ILE MD . . 4.010 3.992 3.936 4.010 0.000 9 0 "[ . 1 . 2]" 1
267 1 11 THR H 1 12 ILE HG12 . . 4.240 3.926 3.887 4.000 . 0 0 "[ . 1 . 2]" 1
268 1 87 ILE HG12 1 88 THR H . . 4.500 4.382 4.100 4.475 . 0 0 "[ . 1 . 2]" 1
269 1 60 ILE H 1 60 ILE HG13 . . 4.030 2.476 2.423 2.590 . 0 0 "[ . 1 . 2]" 1
270 1 11 THR HB 1 12 ILE HG12 . . 4.420 3.457 3.407 3.750 . 0 0 "[ . 1 . 2]" 1
271 1 59 ILE HA 1 60 ILE HG13 . . 5.090 4.596 4.445 4.833 . 0 0 "[ . 1 . 2]" 1
272 1 109 ILE HA 1 109 ILE HG12 . . 3.670 2.611 2.578 2.644 . 0 0 "[ . 1 . 2]" 1
273 1 112 ILE HA 1 112 ILE HG13 . . 3.960 3.687 3.681 3.702 . 0 0 "[ . 1 . 2]" 1
274 1 118 ILE HG13 1 118 ILE MG . . 3.430 3.194 3.186 3.202 . 0 0 "[ . 1 . 2]" 1
275 1 70 ILE HA 1 70 ILE HG12 . . 3.640 2.896 2.859 3.002 . 0 0 "[ . 1 . 2]" 1
276 1 70 ILE HG12 1 70 ILE MG . . 3.100 2.306 2.243 2.367 . 0 0 "[ . 1 . 2]" 1
277 1 56 ILE HG12 1 56 ILE MG . . 3.280 3.189 3.184 3.196 . 0 0 "[ . 1 . 2]" 1
278 1 115 TRP H 1 117 PHE HD1 . . 5.390 5.152 5.151 5.159 . 0 0 "[ . 1 . 2]" 1
279 1 129 PHE H 1 129 PHE HD1 . . 4.490 3.977 2.711 5.048 0.558 16 2 "[ . 1 -+ 2]" 1
280 1 129 PHE HA 1 129 PHE HD1 . . 4.740 2.690 2.115 3.527 . 0 0 "[ . 1 . 2]" 1
281 1 29 PHE HA 1 29 PHE QD . . 4.200 2.690 2.299 3.006 . 0 0 "[ . 1 . 2]" 1
282 1 70 ILE HB 1 73 TYR HD2 . . 4.790 4.693 3.533 4.788 . 0 0 "[ . 1 . 2]" 1
283 1 9 PHE HD1 1 12 ILE HB . . 5.070 4.449 3.732 5.071 0.001 4 0 "[ . 1 . 2]" 1
284 1 52 PHE HD1 1 55 LEU HB2 . . 5.500 4.461 3.981 5.354 . 0 0 "[ . 1 . 2]" 1
285 1 52 PHE HE1 1 56 ILE HG13 . . 4.490 2.821 2.460 3.125 . 0 0 "[ . 1 . 2]" 1
286 1 113 PHE HD1 1 114 LEU QD . . 5.200 3.927 3.861 3.992 . 0 0 "[ . 1 . 2]" 1
287 1 82 THR HB 1 83 LEU H . . 4.500 2.447 2.320 2.768 . 0 0 "[ . 1 . 2]" 1
288 1 103 THR HB 1 104 GLY H . . 4.130 3.394 2.037 4.114 . 0 0 "[ . 1 . 2]" 1
289 1 62 SER H 1 63 THR HB . . 5.340 4.789 4.204 5.337 . 0 0 "[ . 1 . 2]" 1
290 1 8 LEU HG 1 11 THR HB . . 5.190 4.791 4.589 5.193 0.003 14 0 "[ . 1 . 2]" 1
291 1 8 LEU MD1 1 11 THR HB . . 3.840 2.466 1.979 3.444 . 0 0 "[ . 1 . 2]" 1
292 1 122 LEU MD1 1 125 THR HB . . 5.330 3.559 3.150 4.193 . 0 0 "[ . 1 . 2]" 1
293 1 122 LEU MD2 1 125 THR HB . . 5.500 4.246 3.942 4.652 . 0 0 "[ . 1 . 2]" 1
294 1 66 VAL HA 1 67 SER H . . 3.450 3.173 2.448 3.449 . 0 0 "[ . 1 . 2]" 1
295 1 113 PHE HA 1 113 PHE HD1 . . 4.370 4.204 4.192 4.208 . 0 0 "[ . 1 . 2]" 1
296 1 52 PHE HA 1 52 PHE HD1 . . 3.900 3.122 2.842 3.845 . 0 0 "[ . 1 . 2]" 1
297 1 9 PHE HA 1 9 PHE HD1 . . 3.760 3.008 2.165 3.762 0.002 1 0 "[ . 1 . 2]" 1
298 1 115 TRP HA 1 115 TRP HZ3 . . 4.670 4.671 4.670 4.673 0.003 11 0 "[ . 1 . 2]" 1
299 1 102 HIS HA 1 103 THR HA . . 4.810 4.467 4.323 4.665 . 0 0 "[ . 1 . 2]" 1
300 1 7 PRO HA 1 8 LEU HA . . 4.490 4.313 4.308 4.322 . 0 0 "[ . 1 . 2]" 1
301 1 59 ILE HA 1 60 ILE HA . . 5.350 5.280 5.217 5.303 . 0 0 "[ . 1 . 2]" 1
302 1 110 ASP HA 1 111 ARG HA . . 4.900 4.797 4.778 4.824 . 0 0 "[ . 1 . 2]" 1
303 1 10 TYR HA 1 11 THR HA . . 5.020 4.778 4.722 4.790 . 0 0 "[ . 1 . 2]" 1
304 1 5 GLU HA 1 7 PRO HD2 . . 4.020 4.043 4.042 4.043 0.023 5 0 "[ . 1 . 2]" 1
305 1 14 LEU HA 1 15 ILE HA . . 4.950 4.721 4.720 4.723 . 0 0 "[ . 1 . 2]" 1
306 1 113 PHE HA 1 116 MET HB3 . . 4.510 4.387 4.360 4.402 . 0 0 "[ . 1 . 2]" 1
307 1 51 VAL HB 1 52 PHE HA . . 4.690 4.634 4.312 4.691 0.001 11 0 "[ . 1 . 2]" 1
308 1 113 PHE HA 1 116 MET HB2 . . 3.930 3.333 3.307 3.348 . 0 0 "[ . 1 . 2]" 1
309 1 52 PHE HA 1 55 LEU HB2 . . 3.780 2.583 2.263 3.050 . 0 0 "[ . 1 . 2]" 1
310 1 9 PHE HA 1 12 ILE HB . . 4.000 3.291 2.717 3.398 . 0 0 "[ . 1 . 2]" 1
311 1 92 LEU HA 1 92 LEU HG . . 3.680 2.545 2.430 3.669 . 0 0 "[ . 1 . 2]" 1
312 1 52 PHE HA 1 55 LEU HB3 . . 3.870 3.497 3.219 3.738 . 0 0 "[ . 1 . 2]" 1
313 1 103 THR HA 1 103 THR MG . . 3.480 2.252 1.975 3.195 . 0 0 "[ . 1 . 2]" 1
314 1 101 THR HA 1 101 THR MG . . 3.410 2.224 1.976 2.618 . 0 0 "[ . 1 . 2]" 1
315 1 117 PHE HA 1 120 VAL QG . . 3.040 2.377 2.373 2.395 . 0 0 "[ . 1 . 2]" 1
316 1 8 LEU MD1 1 9 PHE HA . . 4.110 3.343 2.864 3.676 . 0 0 "[ . 1 . 2]" 1
317 1 114 LEU QD 1 115 TRP HA . . 3.800 2.823 2.623 2.964 . 0 0 "[ . 1 . 2]" 1
318 1 53 LEU HA 1 56 ILE H . . 4.340 3.663 3.388 3.755 . 0 0 "[ . 1 . 2]" 1
319 1 75 LEU HA 1 76 PHE HD1 . . 5.460 5.257 4.988 5.462 0.002 15 0 "[ . 1 . 2]" 1
320 1 114 LEU HA 1 117 PHE HD1 . . 4.310 3.242 3.240 3.250 . 0 0 "[ . 1 . 2]" 1
321 1 8 LEU HA 1 11 THR HB . . 3.830 2.582 2.412 3.175 . 0 0 "[ . 1 . 2]" 1
322 1 122 LEU HA 1 125 THR HB . . 3.930 2.816 2.492 3.026 . 0 0 "[ . 1 . 2]" 1
323 1 24 LEU HA 1 25 THR HA . . 5.340 4.788 4.738 4.827 . 0 0 "[ . 1 . 2]" 1
324 1 49 LEU HA 1 50 THR HA . . 5.500 4.719 4.686 4.764 . 0 0 "[ . 1 . 2]" 1
325 1 110 ASP HB3 1 111 ARG HA . . 5.280 3.831 3.794 3.869 . 0 0 "[ . 1 . 2]" 1
326 1 45 VAL HB 1 46 LEU HA . . 4.500 4.256 4.083 4.477 . 0 0 "[ . 1 . 2]" 1
327 1 53 LEU HA 1 56 ILE HG12 . . 4.170 3.657 2.990 3.999 . 0 0 "[ . 1 . 2]" 1
328 1 80 PHE HA 1 82 THR H . . 4.390 4.186 4.004 4.317 . 0 0 "[ . 1 . 2]" 1
329 1 80 PHE HA 1 80 PHE QD . . 4.190 2.900 2.616 3.077 . 0 0 "[ . 1 . 2]" 1
330 1 109 ILE HA 1 112 ILE HB . . 3.960 2.923 2.809 3.063 . 0 0 "[ . 1 . 2]" 1
331 1 80 PHE HA 1 83 LEU HG . . 4.410 4.017 3.165 4.396 . 0 0 "[ . 1 . 2]" 1
332 1 48 SER HA 1 51 VAL MG2 . . 3.410 2.822 1.920 3.145 . 0 0 "[ . 1 . 2]" 1
333 1 70 ILE HA 1 73 TYR H . . 3.840 2.992 2.938 3.170 . 0 0 "[ . 1 . 2]" 1
334 1 11 THR H 1 12 ILE HA . . 5.500 5.203 5.095 5.227 . 0 0 "[ . 1 . 2]" 1
335 1 121 CYS HA 1 125 THR H . . 4.750 4.142 3.880 4.483 . 0 0 "[ . 1 . 2]" 1
336 1 57 THR HA 1 60 ILE H . . 4.980 3.535 3.383 3.618 . 0 0 "[ . 1 . 2]" 1
337 1 56 ILE HA 1 58 GLU H . . 5.020 3.858 3.721 4.723 . 0 0 "[ . 1 . 2]" 1
338 1 57 THR HA 1 60 ILE HA . . 3.890 3.777 3.656 3.900 0.010 10 0 "[ . 1 . 2]" 1
339 1 112 ILE HA 1 115 TRP HB2 . . 3.680 2.001 1.999 2.007 . 0 0 "[ . 1 . 2]" 1
340 1 48 SER HA 1 51 VAL HB . . 5.120 2.524 2.072 4.681 . 0 0 "[ . 1 . 2]" 1
341 1 12 ILE HA 1 12 ILE HG13 . . 3.910 3.784 3.706 3.798 . 0 0 "[ . 1 . 2]" 1
342 1 56 ILE HA 1 59 ILE QG . . 3.450 2.378 2.156 2.699 . 0 0 "[ . 1 . 2]" 1
343 1 109 ILE HA 1 109 ILE HG13 . . 4.060 3.159 2.962 3.355 . 0 0 "[ . 1 . 2]" 1
344 1 12 ILE HA 1 12 ILE HG12 . . 3.640 3.124 3.024 3.177 . 0 0 "[ . 1 . 2]" 1
345 1 39 ILE HA 1 39 ILE MG . . 3.090 2.369 2.241 2.551 . 0 0 "[ . 1 . 2]" 1
346 1 85 ILE HA 1 85 ILE MG . . 3.430 2.331 2.207 2.455 . 0 0 "[ . 1 . 2]" 1
347 1 112 ILE HA 1 112 ILE MD . . 3.370 2.006 1.965 2.050 . 0 0 "[ . 1 . 2]" 1
348 1 45 VAL HA 1 48 SER H . . 4.590 3.689 3.450 4.048 . 0 0 "[ . 1 . 2]" 1
349 1 89 VAL HA 1 92 LEU H . . 5.250 3.676 3.565 3.807 . 0 0 "[ . 1 . 2]" 1
350 1 26 VAL HA 1 27 LEU HA . . 5.250 4.833 4.767 4.873 . 0 0 "[ . 1 . 2]" 1
351 1 80 PHE HA 1 81 VAL HA . . 5.500 4.787 4.744 4.825 . 0 0 "[ . 1 . 2]" 1
352 1 87 ILE HB 1 88 THR HA . . 4.580 4.366 4.145 4.464 . 0 0 "[ . 1 . 2]" 1
353 1 51 VAL HA 1 54 LEU HB2 . . 4.280 3.915 2.629 4.149 . 0 0 "[ . 1 . 2]" 1
354 1 120 VAL HA 1 123 LEU HB3 . . 4.520 2.428 2.206 2.595 . 0 0 "[ . 1 . 2]" 1
355 1 89 VAL HA 1 92 LEU HB3 . . 4.460 2.844 2.662 3.131 . 0 0 "[ . 1 . 2]" 1
356 1 50 THR MG 1 51 VAL HA . . 4.110 4.096 3.859 4.111 0.001 13 0 "[ . 1 . 2]" 1
357 1 40 THR HA 1 40 THR MG . . 3.660 2.268 1.985 2.502 . 0 0 "[ . 1 . 2]" 1
358 1 77 THR HA 1 77 THR MG . . 3.540 2.431 2.045 3.202 . 0 0 "[ . 1 . 2]" 1
359 1 125 THR HA 1 128 LEU HB3 . . 3.600 2.912 2.673 3.099 . 0 0 "[ . 1 . 2]" 1
360 1 119 ILE MG 1 120 VAL HA . . 3.080 2.933 2.932 2.934 . 0 0 "[ . 1 . 2]" 1
361 1 7 PRO HD2 1 10 TYR H . . 4.460 3.885 3.606 4.040 . 0 0 "[ . 1 . 2]" 1
362 1 59 ILE H 1 61 PRO HD3 . . 4.500 4.035 3.844 4.139 . 0 0 "[ . 1 . 2]" 1
363 1 67 SER HA 1 68 PRO HD2 . . 3.550 2.424 2.073 2.509 . 0 0 "[ . 1 . 2]" 1
364 1 98 SER HA 1 99 PRO HD2 . . 4.050 2.508 2.508 2.509 . 0 0 "[ . 1 . 2]" 1
365 1 67 SER HA 1 68 PRO HD3 . . 3.550 2.463 2.340 2.969 . 0 0 "[ . 1 . 2]" 1
366 1 98 SER HA 1 99 PRO HD3 . . 4.050 2.346 2.345 2.347 . 0 0 "[ . 1 . 2]" 1
367 1 6 LEU HA 1 7 PRO HD2 . . 3.550 2.209 2.208 2.210 . 0 0 "[ . 1 . 2]" 1
368 1 60 ILE HA 1 61 PRO HD2 . . 3.720 2.059 2.033 2.072 . 0 0 "[ . 1 . 2]" 1
369 1 60 ILE HA 1 61 PRO HD3 . . 3.870 2.887 2.846 2.907 . 0 0 "[ . 1 . 2]" 1
370 1 5 GLU HA 1 7 PRO HD3 . . 4.060 2.885 2.884 2.888 . 0 0 "[ . 1 . 2]" 1
371 1 59 ILE HA 1 61 PRO HD3 . . 5.250 5.149 5.069 5.225 . 0 0 "[ . 1 . 2]" 1
372 1 57 THR HA 1 61 PRO HD2 . . 4.450 3.781 3.008 4.132 . 0 0 "[ . 1 . 2]" 1
373 1 60 ILE MG 1 61 PRO HD2 . . 3.870 3.618 3.475 3.690 . 0 0 "[ . 1 . 2]" 1
374 1 59 ILE MG 1 61 PRO HD3 . . 4.830 4.522 4.416 4.755 . 0 0 "[ . 1 . 2]" 1
375 1 60 ILE MG 1 61 PRO HD3 . . 5.210 4.506 4.461 4.542 . 0 0 "[ . 1 . 2]" 1
376 1 6 LEU QD 1 7 PRO HD2 . . 3.950 3.641 3.640 3.641 . 0 0 "[ . 1 . 2]" 1
377 1 52 PHE H 1 52 PHE HB2 . . 3.830 2.915 2.332 3.129 . 0 0 "[ . 1 . 2]" 1
378 1 90 PHE HB3 1 91 VAL H . . 4.170 2.816 2.551 3.226 . 0 0 "[ . 1 . 2]" 1
379 1 90 PHE HB2 1 91 VAL H . . 4.140 2.635 2.436 2.772 . 0 0 "[ . 1 . 2]" 1
380 1 90 PHE H 1 90 PHE HB3 . . 3.830 3.433 3.345 3.562 . 0 0 "[ . 1 . 2]" 1
381 1 90 PHE H 1 90 PHE HB2 . . 3.890 2.158 2.081 2.319 . 0 0 "[ . 1 . 2]" 1
382 1 129 PHE H 1 129 PHE HB2 . . 3.800 2.171 2.090 2.287 . 0 0 "[ . 1 . 2]" 1
383 1 6 LEU HA 1 10 TYR HB2 . . 3.970 2.905 2.714 3.113 . 0 0 "[ . 1 . 2]" 1
384 1 108 GLY HA2 1 110 ASP HB2 . . 5.280 4.747 4.551 4.973 . 0 0 "[ . 1 . 2]" 1
385 1 110 ASP HB2 1 111 ARG HA . . 5.500 5.018 4.905 5.155 . 0 0 "[ . 1 . 2]" 1
386 1 10 TYR HB3 1 11 THR HA . . 4.780 4.109 3.899 4.358 . 0 0 "[ . 1 . 2]" 1
387 1 90 PHE HB3 1 91 VAL HA . . 4.290 3.884 3.755 4.134 . 0 0 "[ . 1 . 2]" 1
388 1 87 ILE HA 1 90 PHE HB3 . . 4.290 3.902 3.660 4.297 0.007 13 0 "[ . 1 . 2]" 1
389 1 7 PRO HD3 1 10 TYR HB2 . . 5.000 4.799 3.929 5.003 0.003 12 0 "[ . 1 . 2]" 1
390 1 52 PHE HB2 1 55 LEU HB2 . . 5.400 4.828 4.382 5.337 . 0 0 "[ . 1 . 2]" 1
391 1 117 PHE HB3 1 118 ILE HG12 . . 5.430 5.295 5.274 5.362 . 0 0 "[ . 1 . 2]" 1
392 1 110 ASP HB2 1 111 ARG HG2 . . 4.720 4.583 4.467 4.720 . 0 0 "[ . 1 . 2]" 1
393 1 6 LEU HB3 1 10 TYR HB3 . . 4.120 3.460 3.134 3.877 . 0 0 "[ . 1 . 2]" 1
394 1 6 LEU HB3 1 10 TYR HB2 . . 4.280 3.800 3.095 4.258 . 0 0 "[ . 1 . 2]" 1
395 1 8 LEU HB3 1 9 PHE HB3 . . 5.460 5.008 4.725 5.541 0.081 14 0 "[ . 1 . 2]" 1
396 1 70 ILE HG12 1 73 TYR HB2 . . 4.280 4.193 2.666 4.281 0.001 19 0 "[ . 1 . 2]" 1
397 1 70 ILE HG12 1 73 TYR HB3 . . 4.280 2.647 2.541 4.280 0.000 1 0 "[ . 1 . 2]" 1
398 1 90 PHE HB2 1 91 VAL MG1 . . 4.180 4.079 3.962 4.172 . 0 0 "[ . 1 . 2]" 1
399 1 128 LEU HB3 1 129 PHE HB2 . . 4.540 4.364 4.119 4.540 . 0 0 "[ . 1 . 2]" 1
400 1 6 LEU QD 1 10 TYR HB2 . . 3.980 3.387 3.118 3.744 . 0 0 "[ . 1 . 2]" 1
401 1 117 PHE HB3 1 118 ILE MG . . 4.380 3.620 3.523 3.672 . 0 0 "[ . 1 . 2]" 1
402 1 27 LEU MD2 1 30 TYR HB3 . . 4.390 3.967 3.248 4.351 . 0 0 "[ . 1 . 2]" 1
403 1 133 TRP HB3 1 133 TRP HD1 . . 3.880 2.884 2.548 3.866 . 0 0 "[ . 1 . 2]" 1
404 1 18 CYS HB3 1 19 LEU MD2 . . 3.880 2.140 2.009 2.499 . 0 0 "[ . 1 . 2]" 1
405 1 114 LEU HG 1 118 ILE MD . . 3.940 3.920 3.892 3.940 0.000 9 0 "[ . 1 . 2]" 1
406 1 21 ILE H 1 21 ILE MG . . 3.100 2.309 2.146 2.440 . 0 0 "[ . 1 . 2]" 1
407 1 119 ILE MG 1 120 VAL H . . 3.320 2.481 2.474 2.483 . 0 0 "[ . 1 . 2]" 1
408 1 118 ILE HA 1 118 ILE MG . . 3.330 2.282 2.259 2.310 . 0 0 "[ . 1 . 2]" 1
409 1 115 TRP H 1 118 ILE MD . . 4.370 4.268 4.258 4.283 . 0 0 "[ . 1 . 2]" 1
410 1 118 ILE MD 1 118 ILE MG . . 2.570 2.025 1.923 2.078 . 0 0 "[ . 1 . 2]" 1
411 1 114 LEU HB2 1 118 ILE MD . . 4.630 4.608 4.570 4.630 0.000 11 0 "[ . 1 . 2]" 1
412 1 118 ILE HG13 1 120 VAL H . . 5.400 4.959 4.941 4.997 . 0 0 "[ . 1 . 2]" 1
413 1 118 ILE HG13 1 122 LEU H . . 5.500 5.475 5.419 5.500 0.000 14 0 "[ . 1 . 2]" 1
414 1 115 TRP HA 1 118 ILE HG13 . . 4.720 3.275 3.254 3.380 . 0 0 "[ . 1 . 2]" 1
415 1 118 ILE HG13 1 119 ILE HA . . 4.540 3.294 3.267 3.307 . 0 0 "[ . 1 . 2]" 1
416 1 114 LEU HA 1 114 LEU HG . . 4.060 3.661 3.653 3.674 . 0 0 "[ . 1 . 2]" 1
417 1 114 LEU HA 1 117 PHE HB3 . . 4.790 4.462 4.446 4.498 . 0 0 "[ . 1 . 2]" 1
418 1 112 ILE HG13 1 112 ILE MG . . 3.040 2.281 2.270 2.330 . 0 0 "[ . 1 . 2]" 1
419 1 25 THR MG 1 26 VAL H . . 3.870 3.669 3.334 3.866 . 0 0 "[ . 1 . 2]" 1
420 1 119 ILE H 1 119 ILE MG . . 3.230 3.244 3.243 3.248 0.018 9 0 "[ . 1 . 2]" 1
421 1 108 GLY HA2 1 111 ARG HB3 . . 4.360 4.096 3.997 4.251 . 0 0 "[ . 1 . 2]" 1
422 1 115 TRP HD1 1 118 ILE MD . . 5.030 4.832 4.798 4.847 . 0 0 "[ . 1 . 2]" 1
423 1 18 CYS H 1 19 LEU HG . . 4.500 4.241 4.119 4.351 . 0 0 "[ . 1 . 2]" 1
424 1 56 ILE MD 1 57 THR H . . 5.050 4.690 4.617 4.734 . 0 0 "[ . 1 . 2]" 1
425 1 70 ILE HB 1 70 ILE MD . . 3.600 2.398 2.318 2.454 . 0 0 "[ . 1 . 2]" 1
426 1 50 THR HA 1 53 LEU H . . 4.570 3.492 3.192 3.746 . 0 0 "[ . 1 . 2]" 1
427 1 123 LEU HB3 1 124 GLY HA2 . . 4.370 4.274 4.262 4.301 . 0 0 "[ . 1 . 2]" 1
428 1 124 GLY HA2 1 128 LEU HB2 . . 5.500 4.655 4.373 5.010 . 0 0 "[ . 1 . 2]" 1
429 1 115 TRP HE3 1 118 ILE MD . . 4.310 2.600 2.595 2.607 . 0 0 "[ . 1 . 2]" 1
430 1 95 HIS HB3 1 96 HIS H . . 5.200 3.631 2.176 4.624 . 0 0 "[ . 1 . 2]" 1
431 1 24 LEU H 1 24 LEU HB3 . . 4.170 3.092 2.409 3.445 . 0 0 "[ . 1 . 2]" 1
432 1 6 LEU HB2 1 7 PRO HD3 . . 4.710 4.817 4.816 4.818 0.108 4 0 "[ . 1 . 2]" 1
433 1 70 ILE H 1 71 GLY H . . 4.120 2.509 2.452 2.607 . 0 0 "[ . 1 . 2]" 1
434 1 73 TYR H 1 74 LEU H . . 3.950 2.529 2.431 2.639 . 0 0 "[ . 1 . 2]" 1
435 1 120 VAL H 1 121 CYS H . . 3.950 2.322 2.321 2.323 . 0 0 "[ . 1 . 2]" 1
436 1 100 GLU H 1 101 THR H . . 3.530 2.395 1.909 3.150 . 0 0 "[ . 1 . 2]" 1
437 1 74 LEU H 1 75 LEU H . . 3.900 2.633 2.381 2.766 . 0 0 "[ . 1 . 2]" 1
438 1 94 VAL H 1 95 HIS H . . 4.680 4.133 2.511 4.644 . 0 0 "[ . 1 . 2]" 1
439 1 91 VAL H 1 93 ASN H . . 4.090 4.003 3.908 4.096 0.006 13 0 "[ . 1 . 2]" 1
440 1 126 VAL H 1 127 GLY H . . 3.360 2.765 2.557 2.874 . 0 0 "[ . 1 . 2]" 1
441 1 89 VAL H 1 90 PHE H . . 3.760 2.538 2.476 2.595 . 0 0 "[ . 1 . 2]" 1
442 1 65 SER H 1 66 VAL H . . 3.300 2.431 1.928 3.116 . 0 0 "[ . 1 . 2]" 1
443 1 83 LEU H 1 84 SER H . . 4.180 2.590 2.499 2.683 . 0 0 "[ . 1 . 2]" 1
444 1 121 CYS H 1 122 LEU H . . 3.940 2.727 2.640 2.814 . 0 0 "[ . 1 . 2]" 1
445 1 4 GLU H 1 5 GLU H . . 2.760 2.554 2.189 2.734 . 0 0 "[ . 1 . 2]" 1
446 1 43 ILE H 1 44 SER H . . 4.130 2.547 2.429 2.795 . 0 0 "[ . 1 . 2]" 1
447 1 90 PHE H 1 91 VAL H . . 4.060 2.739 2.672 2.827 . 0 0 "[ . 1 . 2]" 1
448 1 91 VAL H 1 92 LEU H . . 4.410 2.766 2.716 2.803 . 0 0 "[ . 1 . 2]" 1
449 1 92 LEU H 1 93 ASN H . . 3.590 2.341 2.259 2.434 . 0 0 "[ . 1 . 2]" 1
450 1 136 GLY H 1 137 GLU H . . 3.120 2.563 1.977 3.101 . 0 0 "[ . 1 . 2]" 1
451 1 125 THR H 1 126 VAL H . . 3.670 2.833 2.629 2.964 . 0 0 "[ . 1 . 2]" 1
452 1 133 TRP H 1 134 LEU H . . 3.770 2.900 2.548 3.793 0.023 18 0 "[ . 1 . 2]" 1
453 1 29 PHE H 1 29 PHE QD . . 4.190 3.007 2.238 3.631 . 0 0 "[ . 1 . 2]" 1
454 1 115 TRP H 1 115 TRP HD1 . . 3.950 3.950 3.944 3.951 0.001 4 0 "[ . 1 . 2]" 1
455 1 117 PHE HD1 1 118 ILE H . . 4.440 4.468 4.461 4.470 0.030 1 0 "[ . 1 . 2]" 1
456 1 117 PHE H 1 117 PHE HD1 . . 4.290 1.941 1.940 1.944 . 0 0 "[ . 1 . 2]" 1
457 1 73 TYR H 1 73 TYR HD2 . . 4.380 4.305 3.798 4.380 0.000 19 0 "[ . 1 . 2]" 1
458 1 76 PHE H 1 76 PHE HD1 . . 4.230 2.549 2.194 2.834 . 0 0 "[ . 1 . 2]" 1
459 1 98 SER HA 1 100 GLU H . . 4.650 4.421 3.976 4.577 . 0 0 "[ . 1 . 2]" 1
460 1 64 SER HA 1 65 SER H . . 3.460 2.598 2.140 3.508 0.048 12 0 "[ . 1 . 2]" 1
461 1 90 PHE HA 1 93 ASN H . . 4.210 3.218 3.107 3.303 . 0 0 "[ . 1 . 2]" 1
462 1 103 THR HA 1 104 GLY H . . 3.150 2.301 2.148 2.928 . 0 0 "[ . 1 . 2]" 1
463 1 11 THR HB 1 12 ILE H . . 3.730 2.986 2.974 3.011 . 0 0 "[ . 1 . 2]" 1
464 1 97 ARG HA 1 98 SER H . . 2.990 2.331 2.142 2.989 . 0 0 "[ . 1 . 2]" 1
465 1 63 THR HA 1 64 SER H . . 3.010 2.735 2.155 3.007 . 0 0 "[ . 1 . 2]" 1
466 1 11 THR H 1 11 THR HB . . 3.700 2.252 2.213 2.263 . 0 0 "[ . 1 . 2]" 1
467 1 5 GLU HA 1 6 LEU H . . 3.130 2.897 2.895 2.906 . 0 0 "[ . 1 . 2]" 1
468 1 134 LEU HA 1 135 ALA H . . 3.500 3.107 2.871 3.390 . 0 0 "[ . 1 . 2]" 1
469 1 4 GLU HA 1 5 GLU H . . 3.220 3.095 2.865 3.203 . 0 0 "[ . 1 . 2]" 1
470 1 73 TYR HA 1 75 LEU H . . 4.240 4.099 3.943 4.214 . 0 0 "[ . 1 . 2]" 1
471 1 52 PHE HA 1 56 ILE H . . 4.990 4.490 4.347 4.709 . 0 0 "[ . 1 . 2]" 1
472 1 117 PHE HA 1 121 CYS H . . 5.030 4.654 4.651 4.667 . 0 0 "[ . 1 . 2]" 1
473 1 8 LEU HA 1 11 THR H . . 3.710 3.089 2.973 3.454 . 0 0 "[ . 1 . 2]" 1
474 1 48 SER HA 1 51 VAL H . . 4.070 3.347 3.156 3.633 . 0 0 "[ . 1 . 2]" 1
475 1 80 PHE HA 1 83 LEU H . . 4.530 3.797 3.524 4.060 . 0 0 "[ . 1 . 2]" 1
476 1 48 SER HA 1 52 PHE H . . 4.570 3.885 3.693 4.251 . 0 0 "[ . 1 . 2]" 1
477 1 114 LEU HA 1 118 ILE H . . 4.840 4.283 4.270 4.287 . 0 0 "[ . 1 . 2]" 1
478 1 54 LEU HA 1 57 THR H . . 4.280 3.186 3.023 3.431 . 0 0 "[ . 1 . 2]" 1
479 1 108 GLY HA2 1 111 ARG H . . 4.280 3.356 3.298 3.429 . 0 0 "[ . 1 . 2]" 1
480 1 109 ILE HA 1 112 ILE H . . 4.150 3.707 3.626 3.788 . 0 0 "[ . 1 . 2]" 1
481 1 18 CYS HA 1 21 ILE H . . 4.840 4.087 4.000 4.290 . 0 0 "[ . 1 . 2]" 1
482 1 108 GLY HA2 1 109 ILE H . . 3.350 3.103 2.821 3.325 . 0 0 "[ . 1 . 2]" 1
483 1 24 LEU HA 1 28 VAL H . . 4.620 4.554 4.368 4.620 . 0 0 "[ . 1 . 2]" 1
484 1 83 LEU HA 1 86 VAL H . . 4.210 3.402 3.313 3.543 . 0 0 "[ . 1 . 2]" 1
485 1 6 LEU H 1 7 PRO HD2 . . 3.600 3.650 3.649 3.651 0.051 10 0 "[ . 1 . 2]" 1
486 1 5 GLU H 1 7 PRO HD2 . . 5.190 5.203 5.203 5.204 0.014 1 0 "[ . 1 . 2]" 1
487 1 112 ILE HA 1 115 TRP H . . 4.810 3.318 3.308 3.323 . 0 0 "[ . 1 . 2]" 1
488 1 99 PRO HD3 1 100 GLU H . . 4.000 3.858 3.836 3.923 . 0 0 "[ . 1 . 2]" 1
489 1 125 THR HA 1 129 PHE H . . 5.030 4.482 4.073 4.741 . 0 0 "[ . 1 . 2]" 1
490 1 5 GLU H 1 7 PRO HD3 . . 4.280 4.239 4.238 4.240 . 0 0 "[ . 1 . 2]" 1
491 1 6 LEU H 1 7 PRO HD3 . . 3.570 2.775 2.774 2.775 . 0 0 "[ . 1 . 2]" 1
492 1 117 PHE H 1 117 PHE HB2 . . 4.030 2.324 2.323 2.329 . 0 0 "[ . 1 . 2]" 1
493 1 9 PHE H 1 9 PHE HB2 . . 3.710 2.834 2.363 2.979 . 0 0 "[ . 1 . 2]" 1
494 1 73 TYR HB2 1 74 LEU H . . 4.340 3.872 2.199 4.069 . 0 0 "[ . 1 . 2]" 1
495 1 80 PHE H 1 80 PHE HB2 . . 4.060 2.361 2.276 2.502 . 0 0 "[ . 1 . 2]" 1
496 1 23 CYS H 1 23 CYS HB2 . . 4.130 2.296 2.063 2.795 . 0 0 "[ . 1 . 2]" 1
497 1 117 PHE H 1 117 PHE HB3 . . 4.000 3.561 3.561 3.563 . 0 0 "[ . 1 . 2]" 1
498 1 9 PHE H 1 9 PHE HB3 . . 3.710 2.349 2.170 3.577 . 0 0 "[ . 1 . 2]" 1
499 1 10 TYR HB2 1 11 THR H . . 4.240 3.711 3.159 4.013 . 0 0 "[ . 1 . 2]" 1
500 1 29 PHE H 1 29 PHE HB2 . . 4.040 2.142 2.065 2.226 . 0 0 "[ . 1 . 2]" 1
501 1 29 PHE H 1 29 PHE HB3 . . 4.040 3.384 3.107 3.518 . 0 0 "[ . 1 . 2]" 1
502 1 93 ASN HB2 1 94 VAL H . . 4.280 3.848 3.120 4.232 . 0 0 "[ . 1 . 2]" 1
503 1 93 ASN H 1 93 ASN HB2 . . 3.340 2.677 2.070 3.053 . 0 0 "[ . 1 . 2]" 1
504 1 110 ASP HB2 1 111 ARG H . . 4.010 2.966 2.852 3.117 . 0 0 "[ . 1 . 2]" 1
505 1 116 MET H 1 116 MET HG3 . . 4.330 4.146 4.134 4.151 . 0 0 "[ . 1 . 2]" 1
506 1 110 ASP H 1 110 ASP HB2 . . 3.410 2.095 2.082 2.109 . 0 0 "[ . 1 . 2]" 1
507 1 109 ILE H 1 110 ASP HB2 . . 4.320 4.254 4.209 4.300 . 0 0 "[ . 1 . 2]" 1
508 1 93 ASN HB3 1 94 VAL H . . 4.280 2.744 2.345 3.087 . 0 0 "[ . 1 . 2]" 1
509 1 93 ASN H 1 93 ASN HB3 . . 3.340 2.487 2.144 3.312 . 0 0 "[ . 1 . 2]" 1
510 1 78 MET H 1 78 MET HG3 . . 4.150 3.094 2.420 3.967 . 0 0 "[ . 1 . 2]" 1
511 1 55 LEU H 1 58 GLU HG2 . . 4.820 4.584 3.968 4.821 0.001 2 0 "[ . 1 . 2]" 1
512 1 58 GLU H 1 58 GLU HG2 . . 3.880 2.369 1.940 2.670 . 0 0 "[ . 1 . 2]" 1
513 1 91 VAL H 1 91 VAL HB . . 4.170 2.596 2.516 2.651 . 0 0 "[ . 1 . 2]" 1
514 1 121 CYS H 1 121 CYS HB3 . . 4.020 3.551 3.480 3.567 . 0 0 "[ . 1 . 2]" 1
515 1 99 PRO HB2 1 101 THR H . . 4.090 3.611 2.440 4.088 . 0 0 "[ . 1 . 2]" 1
516 1 26 VAL HB 1 27 LEU H . . 4.100 2.798 2.349 2.994 . 0 0 "[ . 1 . 2]" 1
517 1 86 VAL H 1 86 VAL HB . . 3.690 2.408 2.174 3.612 . 0 0 "[ . 1 . 2]" 1
518 1 45 VAL HB 1 46 LEU H . . 3.960 2.868 2.377 3.812 . 0 0 "[ . 1 . 2]" 1
519 1 81 VAL HB 1 82 THR H . . 4.100 3.888 3.742 4.028 . 0 0 "[ . 1 . 2]" 1
520 1 81 VAL H 1 81 VAL HB . . 3.990 3.614 3.606 3.621 . 0 0 "[ . 1 . 2]" 1
521 1 120 VAL H 1 120 VAL HB . . 3.750 3.637 3.636 3.638 . 0 0 "[ . 1 . 2]" 1
522 1 58 GLU H 1 58 GLU HB2 . . 4.080 2.822 2.443 3.640 . 0 0 "[ . 1 . 2]" 1
523 1 58 GLU H 1 58 GLU HG3 . . 4.270 3.430 2.893 4.010 . 0 0 "[ . 1 . 2]" 1
524 1 58 GLU HB2 1 59 ILE H . . 4.320 3.000 2.617 4.110 . 0 0 "[ . 1 . 2]" 1
525 1 72 GLU H 1 72 GLU HB2 . . 3.730 2.536 2.271 2.792 . 0 0 "[ . 1 . 2]" 1
526 1 119 ILE H 1 119 ILE HB . . 3.870 2.111 2.109 2.112 . 0 0 "[ . 1 . 2]" 1
527 1 66 VAL H 1 66 VAL HB . . 3.970 3.697 3.611 3.907 . 0 0 "[ . 1 . 2]" 1
528 1 137 GLU H 1 137 GLU HB2 . . 3.680 2.786 2.173 3.664 . 0 0 "[ . 1 . 2]" 1
529 1 86 VAL HB 1 87 ILE H . . 4.200 2.879 2.709 3.758 . 0 0 "[ . 1 . 2]" 1
530 1 89 VAL HB 1 90 PHE H . . 3.910 3.585 2.771 3.907 . 0 0 "[ . 1 . 2]" 1
531 1 28 VAL H 1 28 VAL HB . . 3.820 2.714 2.266 3.614 . 0 0 "[ . 1 . 2]" 1
532 1 94 VAL H 1 94 VAL HB . . 3.360 2.875 2.245 3.403 0.043 7 0 "[ . 1 . 2]" 1
533 1 61 PRO HG3 1 62 SER H . . 5.140 4.163 3.630 4.378 . 0 0 "[ . 1 . 2]" 1
534 1 7 PRO HB3 1 8 LEU H . . 4.090 3.276 3.210 3.323 . 0 0 "[ . 1 . 2]" 1
535 1 87 ILE H 1 87 ILE HB . . 3.540 2.449 2.380 2.538 . 0 0 "[ . 1 . 2]" 1
536 1 99 PRO HG3 1 101 THR H . . 5.240 4.423 4.162 5.108 . 0 0 "[ . 1 . 2]" 1
537 1 100 GLU H 1 100 GLU HB3 . . 3.840 3.560 3.062 3.833 . 0 0 "[ . 1 . 2]" 1
538 1 111 ARG H 1 111 ARG HB3 . . 3.360 2.618 2.609 2.626 . 0 0 "[ . 1 . 2]" 1
539 1 112 ILE H 1 112 ILE HB . . 3.350 2.449 2.433 2.470 . 0 0 "[ . 1 . 2]" 1
540 1 74 LEU H 1 74 LEU HB2 . . 4.070 2.079 2.044 2.115 . 0 0 "[ . 1 . 2]" 1
541 1 55 LEU H 1 55 LEU HB2 . . 3.590 2.065 2.040 2.146 . 0 0 "[ . 1 . 2]" 1
542 1 116 MET ME 1 119 ILE H . . 4.260 4.018 3.986 4.099 . 0 0 "[ . 1 . 2]" 1
543 1 43 ILE H 1 43 ILE HB . . 3.690 2.437 2.285 2.558 . 0 0 "[ . 1 . 2]" 1
544 1 12 ILE HB 1 13 ASN H . . 4.170 2.884 2.774 2.952 . 0 0 "[ . 1 . 2]" 1
545 1 137 GLU H 1 137 GLU HB3 . . 3.680 3.285 2.372 3.659 . 0 0 "[ . 1 . 2]" 1
546 1 123 LEU H 1 123 LEU HB3 . . 4.140 2.457 2.407 2.491 . 0 0 "[ . 1 . 2]" 1
547 1 92 LEU HB2 1 93 ASN H . . 4.170 4.057 3.925 4.153 . 0 0 "[ . 1 . 2]" 1
548 1 56 ILE H 1 56 ILE HB . . 3.560 2.446 2.363 2.509 . 0 0 "[ . 1 . 2]" 1
549 1 72 GLU H 1 72 GLU HB3 . . 3.730 3.613 3.544 3.634 . 0 0 "[ . 1 . 2]" 1
550 1 92 LEU H 1 92 LEU HB2 . . 3.450 2.649 2.533 2.720 . 0 0 "[ . 1 . 2]" 1
551 1 56 ILE HB 1 57 THR H . . 4.170 2.957 2.891 3.036 . 0 0 "[ . 1 . 2]" 1
552 1 111 ARG H 1 111 ARG HG2 . . 3.550 1.952 1.949 1.962 . 0 0 "[ . 1 . 2]" 1
553 1 128 LEU HG 1 129 PHE H . . 4.220 3.767 3.497 3.957 . 0 0 "[ . 1 . 2]" 1
554 1 6 LEU H 1 6 LEU HG . . 3.050 3.009 3.008 3.011 . 0 0 "[ . 1 . 2]" 1
555 1 24 LEU HB3 1 25 THR H . . 4.160 2.512 2.214 2.800 . 0 0 "[ . 1 . 2]" 1
556 1 128 LEU H 1 128 LEU HB2 . . 3.650 2.590 2.474 2.736 . 0 0 "[ . 1 . 2]" 1
557 1 8 LEU H 1 8 LEU HB3 . . 3.560 2.844 2.557 2.952 . 0 0 "[ . 1 . 2]" 1
558 1 74 LEU H 1 74 LEU HB3 . . 4.070 3.364 3.193 3.438 . 0 0 "[ . 1 . 2]" 1
559 1 8 LEU HB3 1 9 PHE H . . 3.780 2.820 2.482 2.969 . 0 0 "[ . 1 . 2]" 1
560 1 70 ILE HG13 1 73 TYR H . . 4.190 4.172 3.988 4.191 0.001 4 0 "[ . 1 . 2]" 1
561 1 128 LEU HB2 1 129 PHE H . . 4.040 3.902 3.766 4.006 . 0 0 "[ . 1 . 2]" 1
562 1 47 LEU HB3 1 48 SER H . . 4.310 2.585 2.256 3.166 . 0 0 "[ . 1 . 2]" 1
563 1 55 LEU HB3 1 56 ILE H . . 4.660 2.886 2.584 3.145 . 0 0 "[ . 1 . 2]" 1
564 1 92 LEU H 1 92 LEU HB3 . . 3.840 2.477 2.410 2.540 . 0 0 "[ . 1 . 2]" 1
565 1 92 LEU HB3 1 93 ASN H . . 4.010 2.967 2.746 3.105 . 0 0 "[ . 1 . 2]" 1
566 1 114 LEU HG 1 116 MET H . . 4.730 4.670 4.657 4.702 . 0 0 "[ . 1 . 2]" 1
567 1 114 LEU H 1 114 LEU HG . . 4.030 2.849 2.827 2.865 . 0 0 "[ . 1 . 2]" 1
568 1 56 ILE H 1 56 ILE HG12 . . 3.850 2.363 2.177 2.570 . 0 0 "[ . 1 . 2]" 1
569 1 135 ALA H 1 135 ALA MB . . 2.810 2.171 2.045 2.342 . 0 0 "[ . 1 . 2]" 1
570 1 70 ILE HG12 1 74 LEU H . . 4.150 2.815 2.392 3.066 . 0 0 "[ . 1 . 2]" 1
571 1 50 THR MG 1 51 VAL H . . 4.090 4.000 3.733 4.045 . 0 0 "[ . 1 . 2]" 1
572 1 55 LEU H 1 57 THR MG . . 5.190 4.566 4.297 5.096 . 0 0 "[ . 1 . 2]" 1
573 1 86 VAL H 1 87 ILE HG12 . . 5.500 4.417 4.303 4.612 . 0 0 "[ . 1 . 2]" 1
574 1 57 THR MG 1 58 GLU H . . 4.130 3.885 3.687 3.995 . 0 0 "[ . 1 . 2]" 1
575 1 125 THR MG 1 126 VAL H . . 4.050 3.096 2.803 3.558 . 0 0 "[ . 1 . 2]" 1
576 1 119 ILE HG13 1 120 VAL H . . 4.960 4.948 4.946 4.948 . 0 0 "[ . 1 . 2]" 1
577 1 40 THR H 1 40 THR MG . . 4.020 3.588 2.533 3.768 . 0 0 "[ . 1 . 2]" 1
578 1 101 THR H 1 101 THR MG . . 3.390 2.861 2.394 3.371 . 0 0 "[ . 1 . 2]" 1
579 1 11 THR H 1 11 THR MG . . 3.810 3.649 3.590 3.662 . 0 0 "[ . 1 . 2]" 1
580 1 82 THR MG 1 84 SER H . . 5.260 4.469 4.330 4.692 . 0 0 "[ . 1 . 2]" 1
581 1 88 THR MG 1 89 VAL H . . 4.100 3.192 2.868 3.730 . 0 0 "[ . 1 . 2]" 1
582 1 90 PHE H 1 91 VAL MG1 . . 3.620 3.559 3.462 3.632 0.012 5 0 "[ . 1 . 2]" 1
583 1 56 ILE H 1 56 ILE HG13 . . 4.040 3.743 3.627 3.833 . 0 0 "[ . 1 . 2]" 1
584 1 91 VAL H 1 91 VAL MG1 . . 3.800 1.975 1.925 2.117 . 0 0 "[ . 1 . 2]" 1
585 1 88 THR H 1 88 THR MG . . 4.700 3.726 3.656 3.766 . 0 0 "[ . 1 . 2]" 1
586 1 45 VAL H 1 45 VAL MG1 . . 3.940 3.494 2.356 3.765 . 0 0 "[ . 1 . 2]" 1
587 1 86 VAL H 1 86 VAL MG1 . . 3.470 3.347 2.195 3.537 0.067 13 0 "[ . 1 . 2]" 1
588 1 118 ILE HG13 1 119 ILE H . . 4.030 2.720 2.701 2.796 . 0 0 "[ . 1 . 2]" 1
589 1 128 LEU H 1 128 LEU HB3 . . 3.970 2.452 2.380 2.537 . 0 0 "[ . 1 . 2]" 1
590 1 51 VAL H 1 51 VAL MG1 . . 3.580 3.417 2.232 3.622 0.042 4 0 "[ . 1 . 2]" 1
591 1 120 VAL QG 1 121 CYS H . . 3.290 2.198 2.194 2.200 . 0 0 "[ . 1 . 2]" 1
592 1 125 THR H 1 128 LEU HB3 . . 5.350 5.233 5.012 5.341 . 0 0 "[ . 1 . 2]" 1
593 1 8 LEU MD2 1 11 THR H . . 3.980 3.915 3.400 4.011 0.031 14 0 "[ . 1 . 2]" 1
594 1 89 VAL H 1 89 VAL MG1 . . 3.810 2.824 2.189 3.610 . 0 0 "[ . 1 . 2]" 1
595 1 70 ILE MD 1 74 LEU H . . 4.860 4.267 3.825 4.529 . 0 0 "[ . 1 . 2]" 1
596 1 6 LEU H 1 6 LEU QD . . 3.590 3.412 3.411 3.414 . 0 0 "[ . 1 . 2]" 1
597 1 66 VAL H 1 66 VAL MG1 . . 3.260 2.572 2.165 2.993 . 0 0 "[ . 1 . 2]" 1
598 1 66 VAL H 1 66 VAL MG2 . . 3.260 2.063 1.936 2.298 . 0 0 "[ . 1 . 2]" 1
599 1 109 ILE MG 1 113 PHE H . . 4.650 3.974 3.821 4.081 . 0 0 "[ . 1 . 2]" 1
600 1 21 ILE MG 1 22 SER H . . 4.110 3.907 3.867 3.932 . 0 0 "[ . 1 . 2]" 1
601 1 107 GLY H 1 109 ILE MG . . 5.210 4.872 4.595 5.159 . 0 0 "[ . 1 . 2]" 1
602 1 45 VAL H 1 45 VAL MG2 . . 3.940 2.067 1.924 2.305 . 0 0 "[ . 1 . 2]" 1
603 1 58 GLU H 1 59 ILE MG . . 4.210 3.919 3.720 4.217 0.007 10 0 "[ . 1 . 2]" 1
604 1 60 ILE MG 1 62 SER H . . 3.800 2.739 2.353 3.553 . 0 0 "[ . 1 . 2]" 1
605 1 51 VAL H 1 51 VAL MG2 . . 3.580 2.691 1.926 2.882 . 0 0 "[ . 1 . 2]" 1
606 1 39 ILE H 1 39 ILE MD . . 3.520 2.749 1.980 3.363 . 0 0 "[ . 1 . 2]" 1
607 1 47 LEU H 1 47 LEU MD2 . . 4.670 4.164 2.762 4.451 . 0 0 "[ . 1 . 2]" 1
608 1 15 ILE H 1 15 ILE MG . . 3.430 2.036 1.955 2.420 . 0 0 "[ . 1 . 2]" 1
609 1 21 ILE H 1 21 ILE MD . . 3.430 3.238 3.217 3.307 . 0 0 "[ . 1 . 2]" 1
610 1 85 ILE MG 1 86 VAL H . . 4.200 3.650 2.944 3.906 . 0 0 "[ . 1 . 2]" 1
611 1 85 ILE MD 1 86 VAL H . . 4.620 4.354 3.998 4.605 . 0 0 "[ . 1 . 2]" 1
612 1 84 SER H 1 85 ILE MD . . 4.660 4.495 3.959 4.659 . 0 0 "[ . 1 . 2]" 1
613 1 19 LEU H 1 19 LEU MD2 . . 3.820 2.548 2.478 2.600 . 0 0 "[ . 1 . 2]" 1
614 1 123 LEU H 1 123 LEU MD1 . . 4.890 4.043 3.963 4.097 . 0 0 "[ . 1 . 2]" 1
615 1 128 LEU H 1 128 LEU MD2 . . 4.320 4.220 4.160 4.287 . 0 0 "[ . 1 . 2]" 1
616 1 56 ILE H 1 56 ILE MG . . 3.970 3.753 3.722 3.774 . 0 0 "[ . 1 . 2]" 1
617 1 85 ILE H 1 85 ILE MD . . 3.610 2.946 2.450 3.351 . 0 0 "[ . 1 . 2]" 1
618 1 79 ILE MG 1 80 PHE H . . 4.240 3.520 3.251 3.903 . 0 0 "[ . 1 . 2]" 1
619 1 123 LEU MD2 1 126 VAL H . . 4.610 4.395 4.160 4.586 . 0 0 "[ . 1 . 2]" 1
620 1 128 LEU H 1 128 LEU MD1 . . 4.320 4.078 3.990 4.127 . 0 0 "[ . 1 . 2]" 1
621 1 89 VAL H 1 89 VAL MG2 . . 3.810 3.376 1.981 3.707 . 0 0 "[ . 1 . 2]" 1
622 1 60 ILE H 1 60 ILE HB . . 3.790 3.626 3.591 3.674 . 0 0 "[ . 1 . 2]" 1
623 1 99 PRO HG2 1 100 GLU H . . 3.200 2.168 1.958 2.959 . 0 0 "[ . 1 . 2]" 1
624 1 103 THR H 1 103 THR HB . . 3.900 3.541 2.592 3.890 . 0 0 "[ . 1 . 2]" 1
625 1 112 ILE HB 1 113 PHE H . . 3.650 2.837 2.800 2.892 . 0 0 "[ . 1 . 2]" 1
626 1 127 GLY H 1 128 LEU H . . 4.270 2.692 2.500 2.811 . 0 0 "[ . 1 . 2]" 1
627 1 135 ALA H 1 136 GLY H . . 3.150 2.659 2.178 3.099 . 0 0 "[ . 1 . 2]" 1
628 1 135 ALA MB 1 136 GLY H . . 3.190 2.431 1.987 3.144 . 0 0 "[ . 1 . 2]" 1
629 1 8 LEU H 1 8 LEU HB2 . . 3.800 2.220 2.139 2.451 . 0 0 "[ . 1 . 2]" 1
630 1 58 GLU H 1 58 GLU HB3 . . 4.080 3.362 2.262 3.641 . 0 0 "[ . 1 . 2]" 1
631 1 94 VAL HB 1 95 HIS H . . 4.270 3.726 2.178 4.244 . 0 0 "[ . 1 . 2]" 1
632 1 126 VAL H 1 126 VAL MG2 . . 3.960 2.387 1.999 2.605 . 0 0 "[ . 1 . 2]" 1
633 1 63 THR MG 1 64 SER H . . 4.650 3.698 3.338 4.392 . 0 0 "[ . 1 . 2]" 1
634 1 103 THR H 1 103 THR MG . . 4.240 3.182 2.057 3.918 . 0 0 "[ . 1 . 2]" 1
635 1 119 ILE H 1 119 ILE HG13 . . 3.920 3.704 3.700 3.706 . 0 0 "[ . 1 . 2]" 1
636 1 99 PRO HD2 1 100 GLU H . . 4.000 2.705 2.649 2.798 . 0 0 "[ . 1 . 2]" 1
637 1 111 ARG H 1 111 ARG HG3 . . 3.830 3.275 3.230 3.349 . 0 0 "[ . 1 . 2]" 1
638 1 109 ILE H 1 110 ASP H . . 3.600 2.443 2.418 2.474 . 0 0 "[ . 1 . 2]" 1
639 1 109 ILE H 1 109 ILE HB . . 3.150 2.626 2.536 2.732 . 0 0 "[ . 1 . 2]" 1
640 1 109 ILE H 1 109 ILE HG13 . . 3.720 2.039 1.951 2.180 . 0 0 "[ . 1 . 2]" 1
641 1 109 ILE H 1 109 ILE HG12 . . 3.630 3.238 2.919 3.531 . 0 0 "[ . 1 . 2]" 1
642 1 109 ILE H 1 109 ILE MG . . 3.900 3.778 3.772 3.783 . 0 0 "[ . 1 . 2]" 1
643 1 37 GLU H 1 38 LYS H . . 4.270 2.657 2.556 2.758 . 0 0 "[ . 1 . 2]" 1
644 1 110 ASP H 1 111 ARG H . . 3.650 2.612 2.552 2.669 . 0 0 "[ . 1 . 2]" 1
645 1 9 PHE H 1 10 TYR H . . 3.700 2.776 2.766 2.825 . 0 0 "[ . 1 . 2]" 1
646 1 47 LEU H 1 47 LEU HB3 . . 4.060 3.208 2.979 3.435 . 0 0 "[ . 1 . 2]" 1
647 1 91 VAL H 1 91 VAL MG2 . . 3.970 3.763 3.761 3.766 . 0 0 "[ . 1 . 2]" 1
648 1 41 LEU H 1 41 LEU HB2 . . 4.010 2.350 2.055 2.774 . 0 0 "[ . 1 . 2]" 1
649 1 70 ILE MG 1 72 GLU H . . 4.710 4.436 4.373 4.514 . 0 0 "[ . 1 . 2]" 1
650 1 59 ILE MG 1 60 ILE H . . 4.450 3.970 3.880 4.177 . 0 0 "[ . 1 . 2]" 1
651 1 60 ILE H 1 60 ILE MG . . 4.800 3.969 3.952 4.001 . 0 0 "[ . 1 . 2]" 1
652 1 5 GLU H 1 6 LEU HA . . 4.580 4.366 4.365 4.368 . 0 0 "[ . 1 . 2]" 1
653 1 133 TRP H 1 133 TRP HB3 . . 3.920 3.060 2.590 3.829 . 0 0 "[ . 1 . 2]" 1
654 1 133 TRP H 1 133 TRP HB2 . . 3.940 2.489 2.104 3.178 . 0 0 "[ . 1 . 2]" 1
655 1 129 PHE H 1 129 PHE QE . . 5.500 5.093 4.779 5.265 . 0 0 "[ . 1 . 2]" 1
656 1 129 PHE H 1 129 PHE HB3 . . 3.930 3.458 3.365 3.559 . 0 0 "[ . 1 . 2]" 1
657 1 128 LEU HB3 1 129 PHE H . . 4.130 2.606 2.401 2.797 . 0 0 "[ . 1 . 2]" 1
658 1 116 MET H 1 116 MET HB2 . . 3.790 2.155 2.155 2.157 . 0 0 "[ . 1 . 2]" 1
659 1 121 CYS H 1 121 CYS HB2 . . 4.020 2.305 2.169 2.344 . 0 0 "[ . 1 . 2]" 1
660 1 112 ILE H 1 112 ILE HG13 . . 4.090 3.723 3.687 3.738 . 0 0 "[ . 1 . 2]" 1
661 1 111 ARG HG3 1 112 ILE H . . 3.710 2.172 2.075 2.273 . 0 0 "[ . 1 . 2]" 1
662 1 112 ILE H 1 112 ILE HG12 . . 3.950 2.329 2.284 2.366 . 0 0 "[ . 1 . 2]" 1
663 1 111 ARG HG2 1 112 ILE H . . 3.960 2.441 2.341 2.501 . 0 0 "[ . 1 . 2]" 1
664 1 112 ILE H 1 113 PHE H . . 3.770 2.503 2.496 2.513 . 0 0 "[ . 1 . 2]" 1
665 1 113 PHE H 1 113 PHE HD1 . . 4.610 4.491 4.476 4.514 . 0 0 "[ . 1 . 2]" 1
666 1 112 ILE HG12 1 113 PHE H . . 4.450 4.375 4.341 4.397 . 0 0 "[ . 1 . 2]" 1
667 1 113 PHE H 1 113 PHE HB2 . . 3.680 2.679 2.663 2.688 . 0 0 "[ . 1 . 2]" 1
668 1 113 PHE HB2 1 114 LEU H . . 3.950 3.758 3.752 3.759 . 0 0 "[ . 1 . 2]" 1
669 1 109 ILE HA 1 113 PHE H . . 3.970 3.934 3.880 3.968 . 0 0 "[ . 1 . 2]" 1
670 1 114 LEU HB2 1 115 TRP H . . 4.380 4.188 4.177 4.197 . 0 0 "[ . 1 . 2]" 1
671 1 115 TRP H 1 116 MET H . . 4.210 2.551 2.544 2.555 . 0 0 "[ . 1 . 2]" 1
672 1 115 TRP H 1 115 TRP HB2 . . 3.850 2.079 2.078 2.080 . 0 0 "[ . 1 . 2]" 1
673 1 113 PHE HA 1 116 MET H . . 4.180 3.734 3.723 3.738 . 0 0 "[ . 1 . 2]" 1
674 1 115 TRP HB2 1 116 MET H . . 4.180 3.339 3.335 3.347 . 0 0 "[ . 1 . 2]" 1
675 1 116 MET HB2 1 117 PHE H . . 4.190 3.218 3.209 3.220 . 0 0 "[ . 1 . 2]" 1
676 1 119 ILE HB 1 120 VAL H . . 4.660 3.297 3.293 3.299 . 0 0 "[ . 1 . 2]" 1
677 1 118 ILE H 1 118 ILE HG12 . . 3.710 2.021 2.007 2.061 . 0 0 "[ . 1 . 2]" 1
678 1 120 VAL HB 1 121 CYS H . . 3.880 3.836 3.830 3.838 . 0 0 "[ . 1 . 2]" 1
679 1 110 ASP H 1 111 ARG HG2 . . 4.130 3.645 3.572 3.712 . 0 0 "[ . 1 . 2]" 1
680 1 122 LEU H 1 122 LEU MD2 . . 3.420 2.836 2.113 3.373 . 0 0 "[ . 1 . 2]" 1
681 1 122 LEU H 1 123 LEU H . . 4.240 2.581 2.415 2.690 . 0 0 "[ . 1 . 2]" 1
682 1 119 ILE HA 1 123 LEU H . . 4.320 4.019 3.866 4.242 . 0 0 "[ . 1 . 2]" 1
683 1 123 LEU HB3 1 124 GLY H . . 3.980 2.251 2.163 2.303 . 0 0 "[ . 1 . 2]" 1
684 1 120 VAL QG 1 124 GLY H . . 5.360 4.273 4.160 4.417 . 0 0 "[ . 1 . 2]" 1
685 1 125 THR H 1 125 THR MG . . 4.010 3.749 3.695 3.771 . 0 0 "[ . 1 . 2]" 1
686 1 124 GLY H 1 125 THR H . . 4.260 2.874 2.764 2.972 . 0 0 "[ . 1 . 2]" 1
687 1 26 VAL HA 1 29 PHE H . . 4.600 3.462 3.269 3.696 . 0 0 "[ . 1 . 2]" 1
688 1 122 LEU HA 1 125 THR H . . 4.250 3.763 3.606 3.935 . 0 0 "[ . 1 . 2]" 1
689 1 123 LEU MD1 1 125 THR H . . 4.970 4.573 4.376 4.699 . 0 0 "[ . 1 . 2]" 1
690 1 122 LEU HA 1 126 VAL H . . 4.660 4.051 3.798 4.291 . 0 0 "[ . 1 . 2]" 1
691 1 123 LEU HA 1 126 VAL H . . 4.830 3.758 3.530 3.913 . 0 0 "[ . 1 . 2]" 1
692 1 126 VAL H 1 126 VAL MG1 . . 3.960 3.729 3.684 3.764 . 0 0 "[ . 1 . 2]" 1
693 1 125 THR HA 1 128 LEU H . . 4.500 3.643 3.475 3.770 . 0 0 "[ . 1 . 2]" 1
694 1 93 ASN H 1 93 ASN HD21 . . 4.780 4.303 2.979 4.778 . 0 0 "[ . 1 . 2]" 1
695 1 95 HIS HB2 1 96 HIS H . . 5.200 3.829 2.312 4.644 . 0 0 "[ . 1 . 2]" 1
696 1 5 GLU H 1 6 LEU QD . . 3.870 3.617 3.610 3.621 . 0 0 "[ . 1 . 2]" 1
697 1 7 PRO HA 1 9 PHE H . . 4.760 4.344 4.194 4.578 . 0 0 "[ . 1 . 2]" 1
698 1 115 TRP HA 1 119 ILE H . . 5.110 4.408 4.396 4.410 . 0 0 "[ . 1 . 2]" 1
699 1 14 LEU H 1 14 LEU HB2 . . 4.140 2.473 2.163 3.644 . 0 0 "[ . 1 . 2]" 1
700 1 14 LEU H 1 14 LEU HB3 . . 4.140 3.333 2.488 3.630 . 0 0 "[ . 1 . 2]" 1
701 1 14 LEU H 1 15 ILE H . . 4.190 2.218 2.216 2.223 . 0 0 "[ . 1 . 2]" 1
702 1 10 TYR H 1 10 TYR HB2 . . 3.620 2.381 2.110 2.612 . 0 0 "[ . 1 . 2]" 1
703 1 11 THR H 1 12 ILE H . . 3.640 2.568 2.451 2.594 . 0 0 "[ . 1 . 2]" 1
704 1 17 PRO HD3 1 18 CYS H . . 4.440 3.843 3.841 3.846 . 0 0 "[ . 1 . 2]" 1
705 1 19 LEU H 1 19 LEU HG . . 4.170 2.188 1.982 2.314 . 0 0 "[ . 1 . 2]" 1
706 1 18 CYS H 1 19 LEU H . . 4.320 2.768 2.734 2.814 . 0 0 "[ . 1 . 2]" 1
707 1 56 ILE H 1 57 THR H . . 4.200 2.487 2.313 2.703 . 0 0 "[ . 1 . 2]" 1
708 1 57 THR H 1 58 GLU HG2 . . 4.340 3.822 3.531 4.148 . 0 0 "[ . 1 . 2]" 1
709 1 57 THR H 1 58 GLU H . . 3.980 2.413 2.290 2.487 . 0 0 "[ . 1 . 2]" 1
710 1 56 ILE HA 1 59 ILE H . . 4.290 3.543 3.402 4.016 . 0 0 "[ . 1 . 2]" 1
711 1 59 ILE H 1 60 ILE H . . 4.200 2.419 2.354 2.535 . 0 0 "[ . 1 . 2]" 1
712 1 60 ILE H 1 61 PRO HD2 . . 4.310 3.171 3.069 3.257 . 0 0 "[ . 1 . 2]" 1
713 1 61 PRO HD2 1 62 SER H . . 4.100 2.760 2.646 2.834 . 0 0 "[ . 1 . 2]" 1
714 1 80 PHE H 1 81 VAL H . . 4.270 2.714 2.588 2.804 . 0 0 "[ . 1 . 2]" 1
715 1 81 VAL H 1 82 THR H . . 4.840 2.670 2.549 2.751 . 0 0 "[ . 1 . 2]" 1
716 1 47 LEU H 1 48 SER H . . 4.350 2.831 2.597 2.983 . 0 0 "[ . 1 . 2]" 1
717 1 46 LEU H 1 47 LEU H . . 4.230 2.660 2.464 2.866 . 0 0 "[ . 1 . 2]" 1
718 1 47 LEU H 1 49 LEU H . . 4.290 4.050 3.772 4.276 . 0 0 "[ . 1 . 2]" 1
719 1 48 SER H 1 49 LEU H . . 4.100 2.662 2.447 2.804 . 0 0 "[ . 1 . 2]" 1
720 1 51 VAL HB 1 52 PHE H . . 4.050 2.771 2.506 3.964 . 0 0 "[ . 1 . 2]" 1
721 1 51 VAL H 1 52 PHE H . . 5.310 2.622 2.477 2.820 . 0 0 "[ . 1 . 2]" 1
722 1 25 THR H 1 25 THR MG . . 4.320 3.593 2.210 3.770 . 0 0 "[ . 1 . 2]" 1
723 1 50 THR H 1 50 THR MG . . 4.740 3.757 3.732 3.788 . 0 0 "[ . 1 . 2]" 1
724 1 24 LEU HB2 1 25 THR H . . 4.160 3.184 2.682 3.804 . 0 0 "[ . 1 . 2]" 1
725 1 43 ILE HA 1 46 LEU H . . 4.620 3.579 3.400 3.895 . 0 0 "[ . 1 . 2]" 1
726 1 55 LEU H 1 55 LEU HG . . 4.200 3.926 3.597 4.200 0.000 16 0 "[ . 1 . 2]" 1
727 1 53 LEU H 1 53 LEU HG . . 4.340 4.024 2.603 4.125 . 0 0 "[ . 1 . 2]" 1
728 1 19 LEU H 1 20 LEU H . . 3.900 2.465 2.440 2.531 . 0 0 "[ . 1 . 2]" 1
729 1 78 MET H 1 78 MET HG2 . . 4.150 3.652 2.739 4.129 . 0 0 "[ . 1 . 2]" 1
730 1 71 GLY HA2 1 74 LEU H . . 4.220 3.768 3.551 4.043 . 0 0 "[ . 1 . 2]" 1
731 1 71 GLY H 1 72 GLU H . . 4.150 2.795 2.788 2.809 . 0 0 "[ . 1 . 2]" 1
732 1 70 ILE H 1 72 GLU H . . 5.190 4.531 4.484 4.592 . 0 0 "[ . 1 . 2]" 1
733 1 72 GLU H 1 75 LEU H . . 5.500 4.747 4.538 4.900 . 0 0 "[ . 1 . 2]" 1
734 1 73 TYR HB3 1 74 LEU H . . 4.340 2.649 2.461 3.430 . 0 0 "[ . 1 . 2]" 1
735 1 82 THR H 1 82 THR MG . . 3.810 3.708 3.676 3.760 . 0 0 "[ . 1 . 2]" 1
736 1 79 ILE HB 1 80 PHE H . . 4.330 2.853 2.595 3.064 . 0 0 "[ . 1 . 2]" 1
737 1 102 HIS H 1 103 THR H . . 4.980 3.439 2.141 4.532 . 0 0 "[ . 1 . 2]" 1
738 1 85 ILE H 1 85 ILE HB . . 4.060 2.512 2.351 2.653 . 0 0 "[ . 1 . 2]" 1
739 1 85 ILE H 1 85 ILE HG12 . . 4.270 3.694 2.146 4.019 . 0 0 "[ . 1 . 2]" 1
740 1 85 ILE H 1 85 ILE HG13 . . 4.270 2.377 2.197 3.635 . 0 0 "[ . 1 . 2]" 1
741 1 75 LEU H 1 76 PHE H . . 4.160 2.635 2.440 2.848 . 0 0 "[ . 1 . 2]" 1
742 1 76 PHE H 1 77 THR H . . 4.470 2.734 2.601 2.836 . 0 0 "[ . 1 . 2]" 1
743 1 79 ILE H 1 79 ILE MD . . 3.960 3.413 2.692 3.942 . 0 0 "[ . 1 . 2]" 1
744 1 80 PHE H 1 80 PHE QD . . 4.990 4.120 4.056 4.187 . 0 0 "[ . 1 . 2]" 1
745 1 80 PHE QD 1 81 VAL H . . 4.610 3.542 3.355 3.755 . 0 0 "[ . 1 . 2]" 1
746 1 86 VAL H 1 86 VAL MG2 . . 3.470 2.857 1.929 3.065 . 0 0 "[ . 1 . 2]" 1
747 1 87 ILE H 1 87 ILE HG12 . . 4.160 2.328 2.147 2.519 . 0 0 "[ . 1 . 2]" 1
748 1 88 THR H 1 89 VAL H . . 4.300 2.617 2.519 2.781 . 0 0 "[ . 1 . 2]" 1
749 1 87 ILE H 1 88 THR H . . 4.380 2.523 2.444 2.661 . 0 0 "[ . 1 . 2]" 1
750 1 87 ILE HA 1 90 PHE H . . 4.100 3.462 3.223 3.600 . 0 0 "[ . 1 . 2]" 1
751 1 90 PHE H 1 90 PHE HD1 . . 4.310 3.396 2.722 4.794 0.484 14 0 "[ . 1 . 2]" 1
752 1 87 ILE HB 1 88 THR H . . 4.340 2.846 2.372 2.986 . 0 0 "[ . 1 . 2]" 1
753 1 58 GLU HG2 1 59 ILE H . . 4.320 3.824 2.406 4.322 0.002 11 0 "[ . 1 . 2]" 1
754 1 27 LEU HG 1 28 VAL H . . 5.070 4.762 4.513 5.066 . 0 0 "[ . 1 . 2]" 1
755 1 25 THR HA 1 28 VAL H . . 4.370 3.797 3.516 3.965 . 0 0 "[ . 1 . 2]" 1
756 1 113 PHE HD1 1 114 LEU H . . 4.380 2.416 2.410 2.438 . 0 0 "[ . 1 . 2]" 1
757 1 115 TRP H 1 115 TRP HB3 . . 3.600 3.318 3.317 3.320 . 0 0 "[ . 1 . 2]" 1
758 1 96 HIS H 1 96 HIS HD2 . . 4.460 3.733 2.140 4.460 . 0 0 "[ . 1 . 2]" 1
759 1 74 LEU H 1 74 LEU MD2 . . 4.380 4.284 4.207 4.374 . 0 0 "[ . 1 . 2]" 1
760 1 39 ILE MG 1 40 THR H . . 4.160 3.301 2.882 3.703 . 0 0 "[ . 1 . 2]" 1
761 1 21 ILE MD 1 22 SER H . . 3.880 3.851 3.818 3.880 . 0 0 "[ . 1 . 2]" 1
762 1 43 ILE H 1 43 ILE MG . . 3.910 3.744 3.673 3.777 . 0 0 "[ . 1 . 2]" 1
763 1 5 GLU H 1 6 LEU HB2 . . 4.240 3.772 3.771 3.775 . 0 0 "[ . 1 . 2]" 1
764 1 109 ILE H 1 111 ARG H . . 4.340 4.268 4.199 4.325 . 0 0 "[ . 1 . 2]" 1
765 1 12 ILE H 1 13 ASN H . . 4.280 2.411 2.366 2.578 . 0 0 "[ . 1 . 2]" 1
766 1 9 PHE HA 1 12 ILE H . . 3.750 3.563 3.101 3.671 . 0 0 "[ . 1 . 2]" 1
767 1 13 ASN H 1 14 LEU H . . 3.700 2.373 2.354 2.448 . 0 0 "[ . 1 . 2]" 1
768 1 11 THR HA 1 14 LEU H . . 4.500 3.507 3.248 3.632 . 0 0 "[ . 1 . 2]" 1
769 1 15 ILE H 1 15 ILE HB . . 3.940 2.592 2.392 2.633 . 0 0 "[ . 1 . 2]" 1
770 1 20 LEU HB2 1 21 ILE H . . 4.590 3.113 2.574 3.880 . 0 0 "[ . 1 . 2]" 1
771 1 21 ILE HB 1 22 SER H . . 4.290 3.902 3.816 3.979 . 0 0 "[ . 1 . 2]" 1
772 1 10 TYR H 1 11 THR H . . 4.260 2.490 2.413 2.778 . 0 0 "[ . 1 . 2]" 1
773 1 24 LEU H 1 25 THR H . . 4.530 2.896 2.796 2.973 . 0 0 "[ . 1 . 2]" 1
774 1 24 LEU H 1 24 LEU HB2 . . 4.170 2.149 2.041 2.606 . 0 0 "[ . 1 . 2]" 1
775 1 26 VAL H 1 27 LEU H . . 4.720 2.608 2.458 2.811 . 0 0 "[ . 1 . 2]" 1
776 1 29 PHE H 1 30 TYR H . . 4.090 2.479 2.280 2.766 . 0 0 "[ . 1 . 2]" 1
777 1 29 PHE QD 1 30 TYR H . . 5.300 4.712 4.459 4.857 . 0 0 "[ . 1 . 2]" 1
778 1 30 TYR H 1 30 TYR QD . . 5.500 4.146 3.971 4.277 . 0 0 "[ . 1 . 2]" 1
779 1 31 LEU H 1 32 PRO HD2 . . 4.440 3.802 3.453 4.009 . 0 0 "[ . 1 . 2]" 1
780 1 31 LEU H 1 32 PRO HD3 . . 4.440 2.966 2.501 3.263 . 0 0 "[ . 1 . 2]" 1
781 1 30 TYR H 1 30 TYR HB3 . . 4.130 2.525 2.196 2.935 . 0 0 "[ . 1 . 2]" 1
782 1 39 ILE H 1 40 THR H . . 4.680 2.767 2.594 2.895 . 0 0 "[ . 1 . 2]" 1
783 1 49 LEU H 1 50 THR H . . 4.990 2.729 2.412 2.924 . 0 0 "[ . 1 . 2]" 1
784 1 56 ILE HG13 1 57 THR H . . 5.400 5.225 5.165 5.272 . 0 0 "[ . 1 . 2]" 1
785 1 62 SER H 1 63 THR H . . 4.200 3.561 1.905 4.146 . 0 0 "[ . 1 . 2]" 1
786 1 63 THR H 1 63 THR MG . . 3.600 2.389 1.936 3.584 . 0 0 "[ . 1 . 2]" 1
787 1 107 GLY H 1 109 ILE HB . . 4.030 3.769 3.329 4.009 . 0 0 "[ . 1 . 2]" 1
788 1 107 GLY H 1 109 ILE H . . 4.530 2.605 2.324 3.131 . 0 0 "[ . 1 . 2]" 1
789 1 108 GLY H 1 109 ILE H . . 4.850 2.528 2.102 3.016 . 0 0 "[ . 1 . 2]" 1
790 1 113 PHE HA 1 117 PHE H . . 5.020 4.810 4.798 4.813 . 0 0 "[ . 1 . 2]" 1
791 1 118 ILE HA 1 122 LEU H . . 4.290 4.013 3.912 4.125 . 0 0 "[ . 1 . 2]" 1
792 1 70 ILE H 1 70 ILE HG12 . . 4.690 4.557 4.529 4.591 . 0 0 "[ . 1 . 2]" 1
793 1 72 GLU H 1 73 TYR H . . 4.620 2.377 2.330 2.515 . 0 0 "[ . 1 . 2]" 1
794 1 42 CYS H 1 43 ILE H . . 4.320 2.769 2.557 2.852 . 0 0 "[ . 1 . 2]" 1
795 1 86 VAL H 1 87 ILE H . . 4.820 2.539 2.465 2.722 . 0 0 "[ . 1 . 2]" 1
796 1 21 ILE H 1 22 SER H . . 4.080 2.468 2.337 2.648 . 0 0 "[ . 1 . 2]" 1
797 1 52 PHE H 1 53 LEU H . . 4.400 2.500 2.395 2.624 . 0 0 "[ . 1 . 2]" 1
798 1 82 THR H 1 83 LEU H . . 4.080 2.830 2.618 2.952 . 0 0 "[ . 1 . 2]" 1
799 1 81 VAL QG 1 82 THR H . . 3.590 2.150 1.963 2.288 . 0 0 "[ . 1 . 2]" 1
800 1 77 THR H 1 78 MET H . . 4.140 2.717 2.606 2.893 . 0 0 "[ . 1 . 2]" 1
801 1 72 GLU HA 1 76 PHE H . . 4.150 3.983 3.690 4.136 . 0 0 "[ . 1 . 2]" 1
802 1 23 CYS H 1 23 CYS HB3 . . 4.130 3.201 2.301 3.592 . 0 0 "[ . 1 . 2]" 1
803 1 54 LEU HB3 1 55 LEU H . . 4.760 2.632 2.458 3.207 . 0 0 "[ . 1 . 2]" 1
804 1 39 ILE HA 1 42 CYS H . . 4.390 3.494 3.232 3.661 . 0 0 "[ . 1 . 2]" 1
805 1 43 ILE HA 1 47 LEU H . . 4.650 4.174 3.799 4.580 . 0 0 "[ . 1 . 2]" 1
806 1 47 LEU H 1 47 LEU HB2 . . 4.060 2.074 2.040 2.124 . 0 0 "[ . 1 . 2]" 1
807 1 28 VAL HA 1 30 TYR H . . 4.690 3.981 3.702 4.407 . 0 0 "[ . 1 . 2]" 1
808 1 45 VAL H 1 46 LEU H . . 4.180 2.731 2.596 2.875 . 0 0 "[ . 1 . 2]" 1
809 1 52 PHE HB2 1 53 LEU H . . 4.510 4.181 3.836 4.317 . 0 0 "[ . 1 . 2]" 1
810 1 115 TRP HB3 1 116 MET H . . 4.660 3.344 3.336 3.357 . 0 0 "[ . 1 . 2]" 1
811 1 53 LEU H 1 54 LEU H . . 4.070 2.772 2.670 2.862 . 0 0 "[ . 1 . 2]" 1
812 1 51 VAL HA 1 54 LEU H . . 4.390 3.955 3.667 4.032 . 0 0 "[ . 1 . 2]" 1
813 1 47 LEU MD1 1 48 SER H . . 5.500 4.460 3.853 4.804 . 0 0 "[ . 1 . 2]" 1
814 1 47 LEU MD2 1 48 SER H . . 5.500 4.107 3.493 4.664 . 0 0 "[ . 1 . 2]" 1
815 1 55 LEU H 1 56 ILE H . . 4.160 2.777 2.531 2.884 . 0 0 "[ . 1 . 2]" 1
816 1 53 LEU HA 1 57 THR H . . 4.980 4.824 4.642 4.914 . 0 0 "[ . 1 . 2]" 1
817 1 4 GLU H 1 4 GLU QB . . 2.660 2.471 2.283 2.602 . 0 0 "[ . 1 . 2]" 1
818 1 4 GLU H 1 4 GLU QG . . 2.920 2.653 2.034 2.893 . 0 0 "[ . 1 . 2]" 1
819 1 4 GLU HA 1 4 GLU QG . . 3.000 2.468 2.232 2.883 . 0 0 "[ . 1 . 2]" 1
820 1 4 GLU QB 1 4 GLU QG . . 2.370 2.056 1.984 2.086 . 0 0 "[ . 1 . 2]" 1
821 1 4 GLU QB 1 5 GLU H . . 4.230 3.616 3.479 3.821 . 0 0 "[ . 1 . 2]" 1
822 1 5 GLU H 1 5 GLU QB . . 3.320 3.311 3.265 3.322 0.002 14 0 "[ . 1 . 2]" 1
823 1 5 GLU H 1 5 GLU QG . . 2.960 2.685 2.614 2.791 . 0 0 "[ . 1 . 2]" 1
824 1 5 GLU QG 1 6 LEU H . . 3.770 3.661 3.604 3.738 . 0 0 "[ . 1 . 2]" 1
825 1 5 GLU QG 1 6 LEU QD . . 3.470 2.140 1.984 2.251 . 0 0 "[ . 1 . 2]" 1
826 1 5 GLU QG 1 7 PRO HD3 . . 5.340 4.935 4.848 4.977 . 0 0 "[ . 1 . 2]" 1
827 1 8 LEU HB3 1 9 PHE QB . . 4.710 4.369 4.241 4.717 0.007 14 0 "[ . 1 . 2]" 1
828 1 9 PHE QB 1 10 TYR H . . 4.480 2.892 2.487 3.024 . 0 0 "[ . 1 . 2]" 1
829 1 9 PHE QB 1 12 ILE HG13 . . 5.340 5.284 4.788 5.347 0.007 14 0 "[ . 1 . 2]" 1
830 1 11 THR HA 1 14 LEU QB . . 3.830 2.867 2.491 3.797 . 0 0 "[ . 1 . 2]" 1
831 1 13 ASN H 1 14 LEU QD . . 4.570 4.287 3.567 4.571 0.001 5 0 "[ . 1 . 2]" 1
832 1 13 ASN QB 1 14 LEU H . . 4.210 3.053 2.902 3.139 . 0 0 "[ . 1 . 2]" 1
833 1 13 ASN QB 1 14 LEU QD . . 4.570 3.504 2.449 4.551 . 0 0 "[ . 1 . 2]" 1
834 1 14 LEU H 1 14 LEU QB . . 3.480 2.271 2.138 2.457 . 0 0 "[ . 1 . 2]" 1
835 1 14 LEU H 1 14 LEU QD . . 3.700 3.125 2.489 3.408 . 0 0 "[ . 1 . 2]" 1
836 1 14 LEU QB 1 15 ILE H . . 3.610 2.958 2.810 3.509 . 0 0 "[ . 1 . 2]" 1
837 1 15 ILE H 1 15 ILE QG . . 4.510 4.065 4.055 4.099 . 0 0 "[ . 1 . 2]" 1
838 1 15 ILE HA 1 18 CYS QB . . 4.270 2.045 1.976 2.200 . 0 0 "[ . 1 . 2]" 1
839 1 15 ILE QG 1 18 CYS QB . . 4.410 3.399 2.973 3.564 . 0 0 "[ . 1 . 2]" 1
840 1 15 ILE MD 1 18 CYS QB . . 4.250 2.458 2.083 3.167 . 0 0 "[ . 1 . 2]" 1
841 1 18 CYS QB 1 19 LEU HA . . 4.730 3.910 3.809 4.081 . 0 0 "[ . 1 . 2]" 1
842 1 18 CYS QB 1 20 LEU H . . 5.340 4.825 4.710 4.904 . 0 0 "[ . 1 . 2]" 1
843 1 18 CYS QB 1 21 ILE MD . . 4.050 3.876 3.718 4.051 0.001 18 0 "[ . 1 . 2]" 1
844 1 19 LEU H 1 20 LEU QB . . 4.830 4.116 4.040 4.277 . 0 0 "[ . 1 . 2]" 1
845 1 19 LEU QB 1 20 LEU H . . 3.860 2.431 2.374 2.550 . 0 0 "[ . 1 . 2]" 1
846 1 19 LEU QB 1 22 SER H . . 5.340 4.564 4.516 4.656 . 0 0 "[ . 1 . 2]" 1
847 1 20 LEU H 1 20 LEU QB . . 3.620 2.130 2.024 2.334 . 0 0 "[ . 1 . 2]" 1
848 1 20 LEU QB 1 21 ILE H . . 3.770 2.541 2.142 2.753 . 0 0 "[ . 1 . 2]" 1
849 1 20 LEU QB 1 21 ILE HA . . 4.490 3.853 3.698 4.195 . 0 0 "[ . 1 . 2]" 1
850 1 21 ILE H 1 21 ILE QG . . 4.490 2.025 1.939 2.257 . 0 0 "[ . 1 . 2]" 1
851 1 21 ILE QG 1 22 SER H . . 3.740 2.124 2.105 2.151 . 0 0 "[ . 1 . 2]" 1
852 1 22 SER QB 1 23 CYS H . . 3.750 2.462 2.164 2.860 . 0 0 "[ . 1 . 2]" 1
853 1 23 CYS QB 1 24 LEU H . . 3.860 2.797 2.680 3.007 . 0 0 "[ . 1 . 2]" 1
854 1 23 CYS QB 1 24 LEU HA . . 5.340 3.903 3.773 4.341 . 0 0 "[ . 1 . 2]" 1
855 1 24 LEU H 1 24 LEU QB . . 3.500 2.080 2.021 2.233 . 0 0 "[ . 1 . 2]" 1
856 1 24 LEU QB 1 25 THR H . . 3.620 2.393 2.183 2.532 . 0 0 "[ . 1 . 2]" 1
857 1 26 VAL H 1 26 VAL QG . . 3.460 2.261 1.988 2.553 . 0 0 "[ . 1 . 2]" 1
858 1 26 VAL QG 1 27 LEU H . . 4.080 3.280 3.000 3.439 . 0 0 "[ . 1 . 2]" 1
859 1 26 VAL QG 1 30 TYR HB2 . . 4.390 3.150 2.713 3.741 . 0 0 "[ . 1 . 2]" 1
860 1 26 VAL QG 1 30 TYR HB3 . . 4.600 4.152 3.632 4.515 . 0 0 "[ . 1 . 2]" 1
861 1 27 LEU H 1 27 LEU QB . . 3.630 2.054 2.021 2.114 . 0 0 "[ . 1 . 2]" 1
862 1 27 LEU QD 1 30 TYR HB3 . . 3.570 3.007 2.222 3.455 . 0 0 "[ . 1 . 2]" 1
863 1 28 VAL H 1 28 VAL QG . . 3.090 2.236 1.839 2.586 . 0 0 "[ . 1 . 2]" 1
864 1 28 VAL QG 1 29 PHE QB . . 4.970 3.623 3.042 4.488 . 0 0 "[ . 1 . 2]" 1
865 1 28 VAL QG 1 29 PHE QD . . 4.590 2.671 1.908 3.885 . 0 0 "[ . 1 . 2]" 1
866 1 28 VAL QG 1 29 PHE HE1 . . 4.710 4.102 2.795 5.593 0.883 19 2 "[ . -1 . +2]" 1
867 1 29 PHE QB 1 30 TYR H . . 4.230 3.050 2.653 3.252 . 0 0 "[ . 1 . 2]" 1
868 1 30 TYR HA 1 31 LEU QB . . 5.010 4.721 4.365 4.951 . 0 0 "[ . 1 . 2]" 1
869 1 30 TYR HA 1 32 PRO QD . . 5.050 3.731 3.167 4.277 . 0 0 "[ . 1 . 2]" 1
870 1 30 TYR HB3 1 31 LEU QB . . 4.050 3.582 3.266 3.910 . 0 0 "[ . 1 . 2]" 1
871 1 31 LEU H 1 31 LEU QD . . 4.350 3.956 3.737 4.116 . 0 0 "[ . 1 . 2]" 1
872 1 31 LEU H 1 32 PRO QD . . 3.840 2.865 2.445 3.127 . 0 0 "[ . 1 . 2]" 1
873 1 35 CYS QB 1 36 GLY H . . 4.320 3.143 2.517 3.983 . 0 0 "[ . 1 . 2]" 1
874 1 37 GLU H 1 37 GLU QG . . 4.660 3.495 2.022 4.043 . 0 0 "[ . 1 . 2]" 1
875 1 37 GLU QB 1 38 LYS H . . 4.420 2.881 2.722 3.148 . 0 0 "[ . 1 . 2]" 1
876 1 38 LYS QB 1 38 LYS QE . . 3.440 2.516 1.957 3.418 . 0 0 "[ . 1 . 2]" 1
877 1 38 LYS QB 1 39 ILE H . . 4.050 2.423 2.158 2.644 . 0 0 "[ . 1 . 2]" 1
878 1 38 LYS QD 1 38 LYS QE . . 2.320 2.048 1.990 2.090 . 0 0 "[ . 1 . 2]" 1
879 1 38 LYS QE 1 39 ILE H . . 4.460 4.314 4.059 4.445 . 0 0 "[ . 1 . 2]" 1
880 1 39 ILE HA 1 42 CYS QB . . 4.040 2.720 2.349 2.993 . 0 0 "[ . 1 . 2]" 1
881 1 39 ILE MG 1 42 CYS QB . . 3.700 3.471 3.135 3.697 . 0 0 "[ . 1 . 2]" 1
882 1 40 THR H 1 42 CYS QB . . 5.340 4.904 4.480 5.126 . 0 0 "[ . 1 . 2]" 1
883 1 41 LEU H 1 41 LEU QB . . 3.490 2.174 2.030 2.353 . 0 0 "[ . 1 . 2]" 1
884 1 41 LEU QB 1 42 CYS H . . 4.340 2.562 2.385 2.908 . 0 0 "[ . 1 . 2]" 1
885 1 42 CYS QB 1 43 ILE H . . 4.210 2.724 2.508 2.888 . 0 0 "[ . 1 . 2]" 1
886 1 43 ILE H 1 43 ILE QG . . 4.780 2.364 2.071 2.642 . 0 0 "[ . 1 . 2]" 1
887 1 43 ILE HA 1 46 LEU QB . . 3.380 2.491 2.076 2.811 . 0 0 "[ . 1 . 2]" 1
888 1 43 ILE QG 1 43 ILE MG . . 3.300 2.222 2.102 2.378 . 0 0 "[ . 1 . 2]" 1
889 1 45 VAL H 1 45 VAL QG . . 3.450 2.043 1.842 2.286 . 0 0 "[ . 1 . 2]" 1
890 1 45 VAL HA 1 45 VAL QG . . 2.950 2.114 2.062 2.197 . 0 0 "[ . 1 . 2]" 1
891 1 46 LEU H 1 46 LEU QB . . 3.460 2.132 2.019 2.244 . 0 0 "[ . 1 . 2]" 1
892 1 46 LEU H 1 47 LEU QB . . 4.610 4.302 4.100 4.495 . 0 0 "[ . 1 . 2]" 1
893 1 46 LEU QB 1 47 LEU H . . 3.790 2.680 2.306 2.897 . 0 0 "[ . 1 . 2]" 1
894 1 47 LEU H 1 47 LEU QB . . 3.380 2.048 2.020 2.093 . 0 0 "[ . 1 . 2]" 1
895 1 47 LEU QB 1 48 SER H . . 3.760 2.427 2.209 2.699 . 0 0 "[ . 1 . 2]" 1
896 1 47 LEU QD 1 48 SER H . . 4.790 3.761 3.376 4.101 . 0 0 "[ . 1 . 2]" 1
897 1 48 SER H 1 48 SER QB . . 3.700 2.319 2.050 2.918 . 0 0 "[ . 1 . 2]" 1
898 1 49 LEU H 1 49 LEU QB . . 3.480 2.145 2.020 2.321 . 0 0 "[ . 1 . 2]" 1
899 1 49 LEU H 1 49 LEU QD . . 4.620 3.559 3.043 3.735 . 0 0 "[ . 1 . 2]" 1
900 1 49 LEU H 1 51 VAL QG . . 5.080 4.682 3.820 4.904 . 0 0 "[ . 1 . 2]" 1
901 1 50 THR HA 1 53 LEU QB . . 4.380 2.305 2.060 3.931 . 0 0 "[ . 1 . 2]" 1
902 1 50 THR HA 1 53 LEU QD . . 3.630 2.509 1.910 2.652 . 0 0 "[ . 1 . 2]" 1
903 1 50 THR MG 1 53 LEU QD . . 2.400 2.401 2.400 2.402 0.002 12 0 "[ . 1 . 2]" 1
904 1 50 THR MG 1 54 LEU QD . . 3.530 3.403 2.434 3.530 0.000 8 0 "[ . 1 . 2]" 1
905 1 51 VAL H 1 51 VAL QG . . 3.080 2.596 1.818 2.775 . 0 0 "[ . 1 . 2]" 1
906 1 51 VAL QG 1 52 PHE H . . 3.650 2.543 2.017 2.734 . 0 0 "[ . 1 . 2]" 1
907 1 51 VAL QG 1 52 PHE HB2 . . 3.610 3.436 3.179 3.591 . 0 0 "[ . 1 . 2]" 1
908 1 53 LEU H 1 53 LEU QB . . 3.670 2.109 2.094 2.314 . 0 0 "[ . 1 . 2]" 1
909 1 55 LEU QD 1 58 GLU HG2 . . 4.140 3.861 2.477 4.140 . 17 0 "[ . 1 . 2]" 1
910 1 55 LEU QD 1 58 GLU HG3 . . 4.400 3.303 2.744 4.192 . 0 0 "[ . 1 . 2]" 1
911 1 56 ILE MG 1 59 ILE QG . . 3.980 3.072 2.896 3.431 . 0 0 "[ . 1 . 2]" 1
912 1 58 GLU QB 1 59 ILE H . . 3.800 2.857 2.561 3.511 . 0 0 "[ . 1 . 2]" 1
913 1 59 ILE QG 1 61 PRO HG3 . . 3.940 3.488 3.405 3.644 . 0 0 "[ . 1 . 2]" 1
914 1 59 ILE QG 1 61 PRO HD2 . . 4.200 3.405 3.344 3.574 . 0 0 "[ . 1 . 2]" 1
915 1 59 ILE QG 1 61 PRO HD3 . . 4.250 1.925 1.898 1.979 . 0 0 "[ . 1 . 2]" 1
916 1 61 PRO QB 1 62 SER H . . 3.880 3.414 2.937 3.582 . 0 0 "[ . 1 . 2]" 1
917 1 62 SER H 1 62 SER QB . . 3.680 2.955 2.243 3.450 . 0 0 "[ . 1 . 2]" 1
918 1 62 SER HA 1 62 SER QB . . 2.580 2.311 2.157 2.541 . 0 0 "[ . 1 . 2]" 1
919 1 62 SER QB 1 63 THR H . . 4.390 3.585 2.152 4.052 . 0 0 "[ . 1 . 2]" 1
920 1 64 SER H 1 64 SER QB . . 3.210 2.750 2.098 3.063 . 0 0 "[ . 1 . 2]" 1
921 1 65 SER H 1 65 SER QB . . 3.220 2.623 2.091 3.116 . 0 0 "[ . 1 . 2]" 1
922 1 65 SER QB 1 66 VAL H . . 3.880 3.263 1.966 3.805 . 0 0 "[ . 1 . 2]" 1
923 1 66 VAL H 1 66 VAL QG . . 2.740 1.975 1.862 2.213 . 0 0 "[ . 1 . 2]" 1
924 1 66 VAL HA 1 66 VAL QG . . 2.770 2.264 2.179 2.366 . 0 0 "[ . 1 . 2]" 1
925 1 66 VAL QG 1 67 SER H . . 3.220 2.450 2.151 3.108 . 0 0 "[ . 1 . 2]" 1
926 1 66 VAL QG 1 67 SER QB . . 2.960 2.616 2.246 3.031 0.071 12 0 "[ . 1 . 2]" 1
927 1 67 SER H 1 67 SER QB . . 3.170 2.666 2.094 3.120 . 0 0 "[ . 1 . 2]" 1
928 1 67 SER HA 1 68 PRO QD . . 3.100 2.132 2.031 2.154 . 0 0 "[ . 1 . 2]" 1
929 1 68 PRO QB 1 69 SER H . . 3.790 3.089 2.172 3.787 . 0 0 "[ . 1 . 2]" 1
930 1 70 ILE HA 1 72 GLU QB . . 5.340 4.508 4.196 4.715 . 0 0 "[ . 1 . 2]" 1
931 1 70 ILE HA 1 73 TYR QB . . 4.100 2.631 2.413 2.995 . 0 0 "[ . 1 . 2]" 1
932 1 70 ILE MG 1 74 LEU QB . . 3.900 3.100 2.897 3.307 . 0 0 "[ . 1 . 2]" 1
933 1 70 ILE HG12 1 74 LEU QB . . 3.520 3.202 2.712 3.439 . 0 0 "[ . 1 . 2]" 1
934 1 70 ILE HG13 1 73 TYR QB . . 3.560 2.408 2.227 2.613 . 0 0 "[ . 1 . 2]" 1
935 1 70 ILE MD 1 73 TYR QB . . 4.320 3.631 3.454 3.663 . 0 0 "[ . 1 . 2]" 1
936 1 71 GLY H 1 72 GLU QB . . 5.340 4.943 4.691 5.152 . 0 0 "[ . 1 . 2]" 1
937 1 71 GLY H 1 74 LEU QB . . 4.850 4.832 4.782 4.851 0.001 9 0 "[ . 1 . 2]" 1
938 1 71 GLY HA2 1 74 LEU QD . . 3.700 3.492 3.213 3.700 0.000 15 0 "[ . 1 . 2]" 1
939 1 71 GLY HA3 1 72 GLU QG . . 5.340 3.946 3.723 4.449 . 0 0 "[ . 1 . 2]" 1
940 1 71 GLY HA3 1 74 LEU QB . . 5.100 4.570 4.424 4.738 . 0 0 "[ . 1 . 2]" 1
941 1 72 GLU H 1 72 GLU QG . . 3.850 2.357 2.087 2.742 . 0 0 "[ . 1 . 2]" 1
942 1 72 GLU HA 1 72 GLU QG . . 3.490 2.559 2.182 3.113 . 0 0 "[ . 1 . 2]" 1
943 1 72 GLU HA 1 76 PHE QB . . 5.140 4.779 4.568 4.990 . 0 0 "[ . 1 . 2]" 1
944 1 72 GLU QB 1 73 TYR H . . 3.690 2.814 2.732 2.907 . 0 0 "[ . 1 . 2]" 1
945 1 72 GLU QB 1 74 LEU H . . 5.340 4.967 4.808 5.184 . 0 0 "[ . 1 . 2]" 1
946 1 72 GLU QB 1 76 PHE H . . 5.290 4.723 4.476 4.871 . 0 0 "[ . 1 . 2]" 1
947 1 72 GLU QB 1 76 PHE QB . . 4.750 4.462 4.193 4.750 0.000 15 0 "[ . 1 . 2]" 1
948 1 73 TYR H 1 73 TYR QB . . 3.550 2.216 2.163 2.526 . 0 0 "[ . 1 . 2]" 1
949 1 73 TYR H 1 74 LEU QB . . 4.780 4.173 4.116 4.208 . 0 0 "[ . 1 . 2]" 1
950 1 74 LEU QB 1 74 LEU QD . . 2.690 1.819 1.730 1.882 . 0 0 "[ . 1 . 2]" 1
951 1 74 LEU QB 1 75 LEU H . . 4.080 2.899 2.788 2.997 . 0 0 "[ . 1 . 2]" 1
952 1 74 LEU QD 1 75 LEU H . . 4.800 4.219 4.130 4.303 . 0 0 "[ . 1 . 2]" 1
953 1 74 LEU QD 1 78 MET QG . . 3.580 2.958 2.438 3.309 . 0 0 "[ . 1 . 2]" 1
954 1 74 LEU QD 1 78 MET ME . . 2.810 2.440 2.085 2.765 . 0 0 "[ . 1 . 2]" 1
955 1 75 LEU H 1 75 LEU QB . . 3.510 2.164 2.050 2.270 . 0 0 "[ . 1 . 2]" 1
956 1 75 LEU H 1 75 LEU QD . . 5.090 3.327 2.257 3.739 . 0 0 "[ . 1 . 2]" 1
957 1 75 LEU QB 1 76 PHE H . . 3.750 2.326 2.108 2.729 . 0 0 "[ . 1 . 2]" 1
958 1 75 LEU QB 1 76 PHE HD1 . . 4.520 2.957 2.619 3.999 . 0 0 "[ . 1 . 2]" 1
959 1 75 LEU QB 1 77 THR H . . 5.340 4.512 4.264 5.004 . 0 0 "[ . 1 . 2]" 1
960 1 76 PHE H 1 76 PHE QB . . 3.430 2.130 2.075 2.212 . 0 0 "[ . 1 . 2]" 1
961 1 78 MET HA 1 78 MET QG . . 3.670 2.222 2.070 2.486 . 0 0 "[ . 1 . 2]" 1
962 1 78 MET QB 1 79 ILE QG . . 5.090 3.199 2.943 3.454 . 0 0 "[ . 1 . 2]" 1
963 1 78 MET ME 1 78 MET QG . . 3.390 2.155 1.980 2.282 . 0 0 "[ . 1 . 2]" 1
964 1 79 ILE H 1 79 ILE QG . . 4.090 2.357 2.064 2.629 . 0 0 "[ . 1 . 2]" 1
965 1 79 ILE QG 1 79 ILE MG . . 3.260 2.267 2.089 2.450 . 0 0 "[ . 1 . 2]" 1
966 1 79 ILE QG 1 80 PHE H . . 4.310 4.154 3.944 4.305 . 0 0 "[ . 1 . 2]" 1
967 1 83 LEU H 1 83 LEU QB . . 3.530 2.388 2.122 2.546 . 0 0 "[ . 1 . 2]" 1
968 1 83 LEU H 1 83 LEU QD . . 3.720 2.993 2.252 3.282 . 0 0 "[ . 1 . 2]" 1
969 1 83 LEU H 1 84 SER QB . . 4.570 4.342 4.177 4.553 . 0 0 "[ . 1 . 2]" 1
970 1 83 LEU HA 1 86 VAL QG . . 3.180 2.881 1.906 3.119 . 0 0 "[ . 1 . 2]" 1
971 1 83 LEU QB 1 84 SER H . . 4.060 3.045 2.644 3.584 . 0 0 "[ . 1 . 2]" 1
972 1 84 SER H 1 84 SER QB . . 3.500 2.144 2.055 2.328 . 0 0 "[ . 1 . 2]" 1
973 1 84 SER H 1 85 ILE QG . . 5.340 4.469 4.208 4.689 . 0 0 "[ . 1 . 2]" 1
974 1 84 SER H 1 86 VAL QG . . 4.960 4.807 3.985 4.960 . 0 0 "[ . 1 . 2]" 1
975 1 85 ILE H 1 85 ILE QG . . 3.710 2.282 2.131 2.637 . 0 0 "[ . 1 . 2]" 1
976 1 85 ILE H 1 86 VAL QG . . 4.570 4.345 3.283 4.570 . 0 0 "[ . 1 . 2]" 1
977 1 86 VAL H 1 86 VAL QG . . 3.030 2.705 1.817 2.889 . 0 0 "[ . 1 . 2]" 1
978 1 86 VAL QG 1 87 ILE H . . 3.590 2.461 2.099 2.589 . 0 0 "[ . 1 . 2]" 1
979 1 86 VAL QG 1 87 ILE HG12 . . 2.590 2.427 2.078 2.529 . 0 0 "[ . 1 . 2]" 1
980 1 86 VAL QG 1 87 ILE MD . . 2.940 2.396 2.085 2.895 . 0 0 "[ . 1 . 2]" 1
981 1 86 VAL QG 1 88 THR H . . 4.470 4.210 3.982 4.456 . 0 0 "[ . 1 . 2]" 1
982 1 88 THR H 1 89 VAL QG . . 4.650 4.230 3.454 4.643 . 0 0 "[ . 1 . 2]" 1
983 1 89 VAL H 1 89 VAL QG . . 3.160 2.551 1.842 2.746 . 0 0 "[ . 1 . 2]" 1
984 1 89 VAL QG 1 90 PHE H . . 4.100 2.392 2.196 2.837 . 0 0 "[ . 1 . 2]" 1
985 1 89 VAL QG 1 90 PHE HA . . 4.170 2.982 2.940 3.177 . 0 0 "[ . 1 . 2]" 1
986 1 89 VAL QG 1 90 PHE HB2 . . 4.260 3.653 3.348 4.266 0.006 5 0 "[ . 1 . 2]" 1
987 1 89 VAL QG 1 90 PHE HB3 . . 4.680 4.534 4.434 4.708 0.028 13 0 "[ . 1 . 2]" 1
988 1 89 VAL QG 1 90 PHE HD1 . . 4.880 2.685 1.924 4.870 . 0 0 "[ . 1 . 2]" 1
989 1 89 VAL QG 1 90 PHE HE1 . . 5.000 3.790 3.212 5.746 0.746 14 1 "[ . 1 +. 2]" 1
990 1 92 LEU HB3 1 92 LEU QD . . 2.650 2.023 1.932 2.097 . 0 0 "[ . 1 . 2]" 1
991 1 92 LEU QD 1 93 ASN H . . 3.480 3.404 3.142 3.480 0.000 5 0 "[ . 1 . 2]" 1
992 1 92 LEU QD 1 93 ASN QB . . 4.630 3.879 3.531 4.269 . 0 0 "[ . 1 . 2]" 1
993 1 93 ASN QB 1 94 VAL H . . 3.630 2.666 2.324 3.007 . 0 0 "[ . 1 . 2]" 1
994 1 94 VAL H 1 94 VAL QG . . 2.820 2.480 1.975 2.857 0.037 17 0 "[ . 1 . 2]" 1
995 1 94 VAL HA 1 94 VAL QG . . 2.860 2.084 1.927 2.309 . 0 0 "[ . 1 . 2]" 1
996 1 94 VAL QG 1 95 HIS H . . 3.660 2.217 1.945 2.760 . 0 0 "[ . 1 . 2]" 1
997 1 94 VAL QG 1 95 HIS HA . . 4.420 3.375 2.833 4.217 . 0 0 "[ . 1 . 2]" 1
998 1 94 VAL QG 1 95 HIS QB . . 4.280 3.813 3.010 4.209 . 0 0 "[ . 1 . 2]" 1
999 1 94 VAL QG 1 95 HIS HD2 . . 4.050 3.762 3.047 4.049 . 0 0 "[ . 1 . 2]" 1
1000 1 95 HIS H 1 95 HIS QB . . 3.700 2.847 2.133 3.441 . 0 0 "[ . 1 . 2]" 1
1001 1 96 HIS H 1 97 ARG QG . . 5.250 4.337 2.735 5.212 . 0 0 "[ . 1 . 2]" 1
1002 1 96 HIS H 1 97 ARG QD . . 5.330 4.116 2.875 5.163 . 0 0 "[ . 1 . 2]" 1
1003 1 96 HIS QB 1 97 ARG H . . 4.320 3.147 2.029 4.013 . 0 0 "[ . 1 . 2]" 1
1004 1 96 HIS QB 1 97 ARG HA . . 4.710 4.267 3.839 4.701 . 0 0 "[ . 1 . 2]" 1
1005 1 97 ARG H 1 97 ARG QB . . 3.690 2.588 2.065 3.415 . 0 0 "[ . 1 . 2]" 1
1006 1 97 ARG H 1 97 ARG QG . . 4.150 3.055 2.006 3.823 . 0 0 "[ . 1 . 2]" 1
1007 1 97 ARG H 1 97 ARG QD . . 4.300 2.974 1.945 4.103 . 0 0 "[ . 1 . 2]" 1
1008 1 97 ARG HA 1 97 ARG QD . . 3.670 3.171 2.002 3.665 . 0 0 "[ . 1 . 2]" 1
1009 1 97 ARG QB 1 97 ARG QD . . 2.960 2.236 1.978 2.887 . 0 0 "[ . 1 . 2]" 1
1010 1 97 ARG QB 1 98 SER H . . 4.460 3.227 2.086 3.969 . 0 0 "[ . 1 . 2]" 1
1011 1 97 ARG QD 1 97 ARG QG . . 2.320 2.049 1.970 2.090 . 0 0 "[ . 1 . 2]" 1
1012 1 98 SER H 1 98 SER QB . . 3.690 2.930 2.157 3.437 . 0 0 "[ . 1 . 2]" 1
1013 1 98 SER HA 1 99 PRO QD . . 3.370 2.154 2.153 2.155 . 0 0 "[ . 1 . 2]" 1
1014 1 98 SER QB 1 99 PRO HG2 . . 3.850 3.683 3.595 3.799 . 0 0 "[ . 1 . 2]" 1
1015 1 99 PRO QD 1 100 GLU H . . 3.420 2.654 2.604 2.741 . 0 0 "[ . 1 . 2]" 1
1016 1 100 GLU H 1 100 GLU QB . . 3.240 2.909 2.866 2.948 . 0 0 "[ . 1 . 2]" 1
1017 1 100 GLU HA 1 100 GLU QG . . 3.230 2.207 2.003 2.548 . 0 0 "[ . 1 . 2]" 1
1018 1 102 HIS QB 1 103 THR H . . 4.120 2.952 2.177 3.927 . 0 0 "[ . 1 . 2]" 1
1019 1 103 THR HA 1 104 GLY QA . . 4.460 3.940 3.890 4.047 . 0 0 "[ . 1 . 2]" 1
1020 1 104 GLY QA 1 105 GLY H . . 2.990 2.308 2.114 2.747 . 0 0 "[ . 1 . 2]" 1
1021 1 105 GLY QA 1 106 GLY H . . 2.930 2.350 2.115 2.888 . 0 0 "[ . 1 . 2]" 1
1022 1 106 GLY QA 1 107 GLY H . . 2.450 2.186 2.112 2.382 . 0 0 "[ . 1 . 2]" 1
1023 1 106 GLY QA 1 109 ILE HG13 . . 4.050 3.269 2.768 4.004 . 0 0 "[ . 1 . 2]" 1
1024 1 106 GLY QA 1 109 ILE MD . . 3.530 2.512 2.034 3.064 . 0 0 "[ . 1 . 2]" 1
1025 1 108 GLY H 1 111 ARG QD . . 4.690 4.392 3.951 4.670 . 0 0 "[ . 1 . 2]" 1
1026 1 108 GLY HA2 1 111 ARG QD . . 3.370 2.256 2.004 2.769 . 0 0 "[ . 1 . 2]" 1
1027 1 111 ARG H 1 111 ARG QD . . 4.390 3.595 3.478 3.942 . 0 0 "[ . 1 . 2]" 1
1028 1 119 ILE HA 1 122 LEU QB . . 4.380 3.665 3.489 3.791 . 0 0 "[ . 1 . 2]" 1
1029 1 121 CYS H 1 121 CYS QB . . 3.480 2.278 2.148 2.314 . 0 0 "[ . 1 . 2]" 1
1030 1 122 LEU H 1 122 LEU QB . . 3.310 2.081 2.038 2.170 . 0 0 "[ . 1 . 2]" 1
1031 1 122 LEU QB 1 123 LEU H . . 3.870 2.553 2.324 2.840 . 0 0 "[ . 1 . 2]" 1
1032 1 125 THR HA 1 128 LEU QD . . 4.440 3.371 3.190 3.532 . 0 0 "[ . 1 . 2]" 1
1033 1 126 VAL HB 1 127 GLY QA . . 4.550 3.988 3.840 4.139 . 0 0 "[ . 1 . 2]" 1
1034 1 126 VAL QG 1 127 GLY H . . 4.130 2.955 2.704 3.265 . 0 0 "[ . 1 . 2]" 1
1035 1 128 LEU HA 1 128 LEU QD . . 4.080 2.054 1.956 2.202 . 0 0 "[ . 1 . 2]" 1
1036 1 128 LEU HB2 1 128 LEU QD . . 2.990 2.048 2.004 2.134 . 0 0 "[ . 1 . 2]" 1
1037 1 128 LEU HB3 1 128 LEU QD . . 2.910 2.361 2.279 2.432 . 0 0 "[ . 1 . 2]" 1
1038 1 128 LEU QD 1 129 PHE H . . 4.210 3.905 3.767 4.008 . 0 0 "[ . 1 . 2]" 1
1039 1 131 PRO HA 1 132 PRO QD . . 3.350 2.174 2.174 2.175 . 0 0 "[ . 1 . 2]" 1
1040 1 134 LEU H 1 134 LEU QD . . 3.480 3.196 2.693 3.447 . 0 0 "[ . 1 . 2]" 1
1041 1 134 LEU HA 1 134 LEU QD . . 2.960 2.345 1.911 2.900 . 0 0 "[ . 1 . 2]" 1
1042 1 134 LEU QD 1 135 ALA H . . 4.730 4.381 3.952 4.604 . 0 0 "[ . 1 . 2]" 1
1043 1 135 ALA MB 1 136 GLY QA . . 3.730 3.560 3.395 3.722 . 0 0 "[ . 1 . 2]" 1
1044 1 136 GLY H 1 136 GLY QA . . 2.550 2.404 2.230 2.501 . 0 0 "[ . 1 . 2]" 1
1045 1 136 GLY QA 1 137 GLU QG . . 5.070 4.041 3.255 4.623 . 0 0 "[ . 1 . 2]" 1
1046 1 137 GLU H 1 137 GLU QB . . 2.850 2.432 2.152 2.803 . 0 0 "[ . 1 . 2]" 1
1047 1 137 GLU H 1 137 GLU QG . . 3.140 2.498 2.032 3.113 . 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 148
_Distance_constraint_stats_list.Viol_count 237
_Distance_constraint_stats_list.Viol_total 27.969
_Distance_constraint_stats_list.Viol_max 0.047
_Distance_constraint_stats_list.Viol_rms 0.0027
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0059
_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 9 PHE 0.098 0.012 14 0 "[ . 1 . 2]"
1 10 TYR 0.007 0.003 12 0 "[ . 1 . 2]"
1 11 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 ILE 0.076 0.008 12 0 "[ . 1 . 2]"
1 13 ASN 0.098 0.012 14 0 "[ . 1 . 2]"
1 14 LEU 0.520 0.047 18 0 "[ . 1 . 2]"
1 15 ILE 0.210 0.027 17 0 "[ . 1 . 2]"
1 16 ILE 0.187 0.010 18 0 "[ . 1 . 2]"
1 17 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 CYS 0.513 0.047 18 0 "[ . 1 . 2]"
1 19 LEU 0.211 0.027 17 0 "[ . 1 . 2]"
1 20 LEU 0.111 0.010 18 0 "[ . 1 . 2]"
1 21 ILE 0.002 0.001 13 0 "[ . 1 . 2]"
1 22 SER 0.001 0.001 7 0 "[ . 1 . 2]"
1 23 CYS 0.001 0.000 5 0 "[ . 1 . 2]"
1 24 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 THR 0.003 0.001 13 0 "[ . 1 . 2]"
1 26 VAL 0.001 0.001 7 0 "[ . 1 . 2]"
1 27 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 PHE 0.001 0.000 11 0 "[ . 1 . 2]"
1 30 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ILE 0.000 0.000 9 0 "[ . 1 . 2]"
1 40 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 CYS 0.000 0.000 14 0 "[ . 1 . 2]"
1 43 ILE 0.000 0.000 9 0 "[ . 1 . 2]"
1 44 SER 0.001 0.001 14 0 "[ . 1 . 2]"
1 45 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 LEU 0.001 0.000 4 0 "[ . 1 . 2]"
1 47 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 SER 0.001 0.001 14 0 "[ . 1 . 2]"
1 49 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 THR 0.003 0.001 15 0 "[ . 1 . 2]"
1 51 VAL 0.005 0.001 4 0 "[ . 1 . 2]"
1 52 PHE 0.004 0.001 7 0 "[ . 1 . 2]"
1 53 LEU 0.004 0.001 10 0 "[ . 1 . 2]"
1 54 LEU 0.002 0.001 15 0 "[ . 1 . 2]"
1 55 LEU 0.094 0.019 10 0 "[ . 1 . 2]"
1 56 ILE 0.004 0.001 7 0 "[ . 1 . 2]"
1 57 THR 0.004 0.001 10 0 "[ . 1 . 2]"
1 58 GLU 0.000 0.000 1 0 "[ . 1 . 2]"
1 59 ILE 0.089 0.019 10 0 "[ . 1 . 2]"
1 72 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 TYR 0.001 0.001 15 0 "[ . 1 . 2]"
1 74 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 THR 0.001 0.001 15 0 "[ . 1 . 2]"
1 78 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 VAL 0.000 0.000 11 0 "[ . 1 . 2]"
1 82 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 ILE 0.019 0.006 13 0 "[ . 1 . 2]"
1 86 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 ILE 0.002 0.001 11 0 "[ . 1 . 2]"
1 88 THR 0.014 0.005 13 0 "[ . 1 . 2]"
1 89 VAL 0.019 0.006 13 0 "[ . 1 . 2]"
1 90 PHE 0.000 0.000 5 0 "[ . 1 . 2]"
1 91 VAL 0.002 0.001 11 0 "[ . 1 . 2]"
1 92 LEU 0.014 0.005 13 0 "[ . 1 . 2]"
1 93 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 VAL 0.000 0.000 5 0 "[ . 1 . 2]"
1 109 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 ARG 0.002 0.001 10 0 "[ . 1 . 2]"
1 112 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 PHE 0.108 0.007 3 0 "[ . 1 . 2]"
1 114 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 TRP 0.018 0.002 11 0 "[ . 1 . 2]"
1 116 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 PHE 0.220 0.009 9 0 "[ . 1 . 2]"
1 118 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 ILE 0.015 0.002 11 0 "[ . 1 . 2]"
1 120 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 CYS 0.112 0.009 9 0 "[ . 1 . 2]"
1 122 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 123 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 128 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 129 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 130 LEU 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 9 PHE O 1 13 ASN H . . 2.500 2.443 1.881 2.512 0.012 14 0 "[ . 1 . 2]" 2
2 1 9 PHE O 1 13 ASN N . 2.700 3.500 3.252 2.750 3.366 . 0 0 "[ . 1 . 2]" 2
3 1 10 TYR O 1 14 LEU H . . 2.500 2.277 2.079 2.503 0.003 12 0 "[ . 1 . 2]" 2
4 1 10 TYR O 1 14 LEU N . 2.700 3.500 2.987 2.800 3.269 . 0 0 "[ . 1 . 2]" 2
5 1 11 THR O 1 15 ILE H . . 2.500 2.272 1.915 2.442 . 0 0 "[ . 1 . 2]" 2
6 1 11 THR O 1 15 ILE N . 2.700 3.500 3.077 2.750 3.253 . 0 0 "[ . 1 . 2]" 2
7 1 12 ILE O 1 16 ILE H . . 2.500 2.473 2.290 2.508 0.008 12 0 "[ . 1 . 2]" 2
8 1 12 ILE O 1 16 ILE N . 2.700 3.500 3.332 3.086 3.380 . 0 0 "[ . 1 . 2]" 2
9 1 14 LEU O 1 18 CYS H . . 2.500 2.526 2.519 2.547 0.047 18 0 "[ . 1 . 2]" 2
10 1 14 LEU O 1 18 CYS N . 2.700 3.500 3.322 3.312 3.346 . 0 0 "[ . 1 . 2]" 2
11 1 15 ILE O 1 19 LEU H . . 2.500 2.511 2.504 2.527 0.027 17 0 "[ . 1 . 2]" 2
12 1 15 ILE O 1 19 LEU N . 2.700 3.500 3.352 3.316 3.402 . 0 0 "[ . 1 . 2]" 2
13 1 16 ILE O 1 20 LEU H . . 2.500 2.506 2.501 2.510 0.010 18 0 "[ . 1 . 2]" 2
14 1 16 ILE O 1 20 LEU N . 2.700 3.500 3.477 3.465 3.485 . 0 0 "[ . 1 . 2]" 2
15 1 17 PRO O 1 21 ILE H . . 2.500 1.927 1.850 2.004 . 0 0 "[ . 1 . 2]" 2
16 1 17 PRO O 1 21 ILE N . 2.700 3.500 2.887 2.825 2.929 . 0 0 "[ . 1 . 2]" 2
17 1 18 CYS O 1 22 SER H . . 2.500 2.482 2.393 2.500 0.000 9 0 "[ . 1 . 2]" 2
18 1 18 CYS O 1 22 SER N . 2.700 3.500 3.235 3.139 3.309 . 0 0 "[ . 1 . 2]" 2
19 1 19 LEU O 1 23 CYS H . . 2.500 1.818 1.800 1.939 0.000 5 0 "[ . 1 . 2]" 2
20 1 19 LEU O 1 23 CYS N . 2.700 3.500 2.767 2.750 2.811 . 0 0 "[ . 1 . 2]" 2
21 1 20 LEU O 1 24 LEU H . . 2.500 2.387 2.242 2.500 . 0 0 "[ . 1 . 2]" 2
22 1 20 LEU O 1 24 LEU N . 2.700 3.500 3.218 3.106 3.358 . 0 0 "[ . 1 . 2]" 2
23 1 21 ILE O 1 25 THR H . . 2.500 2.492 2.430 2.501 0.001 13 0 "[ . 1 . 2]" 2
24 1 21 ILE O 1 25 THR N . 2.700 3.500 3.443 3.392 3.467 . 0 0 "[ . 1 . 2]" 2
25 1 22 SER O 1 26 VAL H . . 2.500 2.472 2.404 2.501 0.001 7 0 "[ . 1 . 2]" 2
26 1 22 SER O 1 26 VAL N . 2.700 3.500 3.403 3.273 3.477 . 0 0 "[ . 1 . 2]" 2
27 1 23 CYS O 1 27 LEU H . . 2.500 1.930 1.847 2.118 . 0 0 "[ . 1 . 2]" 2
28 1 23 CYS O 1 27 LEU N . 2.700 3.500 2.778 2.750 2.879 . 0 0 "[ . 1 . 2]" 2
29 1 24 LEU O 1 28 VAL H . . 2.500 2.431 2.322 2.492 . 0 0 "[ . 1 . 2]" 2
30 1 24 LEU O 1 28 VAL N . 2.700 3.500 3.375 3.257 3.450 . 0 0 "[ . 1 . 2]" 2
31 1 25 THR O 1 29 PHE H . . 2.500 2.468 2.399 2.500 0.000 11 0 "[ . 1 . 2]" 2
32 1 25 THR O 1 29 PHE N . 2.700 3.500 3.340 3.171 3.457 . 0 0 "[ . 1 . 2]" 2
33 1 26 VAL O 1 30 TYR H . . 2.500 2.247 2.022 2.478 . 0 0 "[ . 1 . 2]" 2
34 1 26 VAL O 1 30 TYR N . 2.700 3.500 2.903 2.750 3.119 . 0 0 "[ . 1 . 2]" 2
35 1 36 GLY O 1 40 THR H . . 2.500 2.315 1.936 2.493 . 0 0 "[ . 1 . 2]" 2
36 1 36 GLY O 1 40 THR N . 2.700 3.500 3.273 2.909 3.463 . 0 0 "[ . 1 . 2]" 2
37 1 37 GLU O 1 41 LEU H . . 2.500 2.187 1.903 2.469 . 0 0 "[ . 1 . 2]" 2
38 1 37 GLU O 1 41 LEU N . 2.700 3.500 3.054 2.779 3.288 . 0 0 "[ . 1 . 2]" 2
39 1 38 LYS O 1 42 CYS H . . 2.500 2.156 1.845 2.442 . 0 0 "[ . 1 . 2]" 2
40 1 38 LYS O 1 42 CYS N . 2.700 3.500 3.080 2.756 3.387 . 0 0 "[ . 1 . 2]" 2
41 1 39 ILE O 1 43 ILE H . . 2.500 2.410 2.114 2.500 0.000 9 0 "[ . 1 . 2]" 2
42 1 39 ILE O 1 43 ILE N . 2.700 3.500 3.306 3.075 3.404 . 0 0 "[ . 1 . 2]" 2
43 1 40 THR O 1 44 SER H . . 2.500 2.266 1.899 2.497 . 0 0 "[ . 1 . 2]" 2
44 1 40 THR O 1 44 SER N . 2.700 3.500 3.153 2.808 3.378 . 0 0 "[ . 1 . 2]" 2
45 1 41 LEU O 1 45 VAL H . . 2.500 2.074 1.845 2.414 . 0 0 "[ . 1 . 2]" 2
46 1 41 LEU O 1 45 VAL N . 2.700 3.500 3.030 2.821 3.354 . 0 0 "[ . 1 . 2]" 2
47 1 42 CYS O 1 46 LEU H . . 2.500 2.354 2.044 2.500 0.000 14 0 "[ . 1 . 2]" 2
48 1 42 CYS O 1 46 LEU N . 2.700 3.500 3.217 2.918 3.439 . 0 0 "[ . 1 . 2]" 2
49 1 43 ILE O 1 47 LEU H . . 2.500 2.111 1.909 2.453 . 0 0 "[ . 1 . 2]" 2
50 1 43 ILE O 1 47 LEU N . 2.700 3.500 2.969 2.772 3.304 . 0 0 "[ . 1 . 2]" 2
51 1 44 SER O 1 48 SER H . . 2.500 2.402 1.865 2.501 0.001 14 0 "[ . 1 . 2]" 2
52 1 44 SER O 1 48 SER N . 2.700 3.500 3.345 2.843 3.437 . 0 0 "[ . 1 . 2]" 2
53 1 45 VAL O 1 49 LEU H . . 2.500 2.185 1.835 2.489 . 0 0 "[ . 1 . 2]" 2
54 1 45 VAL O 1 49 LEU N . 2.700 3.500 3.077 2.753 3.409 . 0 0 "[ . 1 . 2]" 2
55 1 46 LEU O 1 50 THR H . . 2.500 2.066 1.800 2.368 0.000 4 0 "[ . 1 . 2]" 2
56 1 46 LEU O 1 50 THR N . 2.700 3.500 2.979 2.759 3.292 . 0 0 "[ . 1 . 2]" 2
57 1 47 LEU O 1 51 VAL H . . 2.500 2.153 1.868 2.500 . 0 0 "[ . 1 . 2]" 2
58 1 47 LEU O 1 51 VAL N . 2.700 3.500 2.934 2.757 3.230 . 0 0 "[ . 1 . 2]" 2
59 1 48 SER O 1 52 PHE H . . 2.500 1.986 1.805 2.490 . 0 0 "[ . 1 . 2]" 2
60 1 48 SER O 1 52 PHE N . 2.700 3.500 2.941 2.783 3.412 . 0 0 "[ . 1 . 2]" 2
61 1 49 LEU O 1 53 LEU H . . 2.500 2.266 2.000 2.465 . 0 0 "[ . 1 . 2]" 2
62 1 49 LEU O 1 53 LEU N . 2.700 3.500 3.065 2.863 3.407 . 0 0 "[ . 1 . 2]" 2
63 1 50 THR O 1 54 LEU H . . 2.500 2.402 1.928 2.501 0.001 15 0 "[ . 1 . 2]" 2
64 1 50 THR O 1 54 LEU N . 2.700 3.500 3.359 2.897 3.454 . 0 0 "[ . 1 . 2]" 2
65 1 51 VAL O 1 55 LEU H . . 2.500 2.495 2.447 2.501 0.001 4 0 "[ . 1 . 2]" 2
66 1 51 VAL O 1 55 LEU N . 2.700 3.500 3.429 3.291 3.471 . 0 0 "[ . 1 . 2]" 2
67 1 52 PHE O 1 56 ILE H . . 2.500 2.450 2.336 2.501 0.001 7 0 "[ . 1 . 2]" 2
68 1 52 PHE O 1 56 ILE N . 2.700 3.500 3.290 3.235 3.368 . 0 0 "[ . 1 . 2]" 2
69 1 53 LEU O 1 57 THR H . . 2.500 2.462 2.257 2.501 0.001 10 0 "[ . 1 . 2]" 2
70 1 53 LEU O 1 57 THR N . 2.700 3.500 3.250 3.074 3.325 . 0 0 "[ . 1 . 2]" 2
71 1 54 LEU O 1 58 GLU H . . 2.500 2.312 1.810 2.500 0.000 1 0 "[ . 1 . 2]" 2
72 1 54 LEU O 1 58 GLU N . 2.700 3.500 2.973 2.747 3.077 . 0 0 "[ . 1 . 2]" 2
73 1 55 LEU O 1 59 ILE H . . 2.500 2.504 2.491 2.519 0.019 10 0 "[ . 1 . 2]" 2
74 1 55 LEU O 1 59 ILE N . 2.700 3.500 3.395 3.341 3.420 . 0 0 "[ . 1 . 2]" 2
75 1 72 GLU O 1 76 PHE H . . 2.500 2.227 1.999 2.480 . 0 0 "[ . 1 . 2]" 2
76 1 72 GLU O 1 76 PHE N . 2.700 3.500 3.170 2.935 3.452 . 0 0 "[ . 1 . 2]" 2
77 1 73 TYR O 1 77 THR H . . 2.500 1.973 1.810 2.501 0.001 15 0 "[ . 1 . 2]" 2
78 1 73 TYR O 1 77 THR N . 2.700 3.500 2.872 2.751 3.265 . 0 0 "[ . 1 . 2]" 2
79 1 74 LEU O 1 78 MET H . . 2.500 2.321 2.062 2.465 . 0 0 "[ . 1 . 2]" 2
80 1 74 LEU O 1 78 MET N . 2.700 3.500 3.201 3.013 3.362 . 0 0 "[ . 1 . 2]" 2
81 1 75 LEU O 1 79 ILE H . . 2.500 2.212 1.853 2.487 . 0 0 "[ . 1 . 2]" 2
82 1 75 LEU O 1 79 ILE N . 2.700 3.500 3.135 2.777 3.426 . 0 0 "[ . 1 . 2]" 2
83 1 76 PHE O 1 80 PHE H . . 2.500 2.079 1.885 2.412 . 0 0 "[ . 1 . 2]" 2
84 1 76 PHE O 1 80 PHE N . 2.700 3.500 2.909 2.763 3.225 . 0 0 "[ . 1 . 2]" 2
85 1 77 THR O 1 81 VAL H . . 2.500 1.862 1.800 2.105 0.000 11 0 "[ . 1 . 2]" 2
86 1 77 THR O 1 81 VAL N . 2.700 3.500 2.829 2.750 3.078 . 0 0 "[ . 1 . 2]" 2
87 1 78 MET O 1 82 THR H . . 2.500 2.395 1.956 2.499 . 0 0 "[ . 1 . 2]" 2
88 1 78 MET O 1 82 THR N . 2.700 3.500 3.199 2.814 3.352 . 0 0 "[ . 1 . 2]" 2
89 1 79 ILE O 1 83 LEU H . . 2.500 2.388 2.219 2.491 . 0 0 "[ . 1 . 2]" 2
90 1 79 ILE O 1 83 LEU N . 2.700 3.500 3.349 3.106 3.466 . 0 0 "[ . 1 . 2]" 2
91 1 80 PHE O 1 84 SER H . . 2.500 2.226 2.002 2.468 . 0 0 "[ . 1 . 2]" 2
92 1 80 PHE O 1 84 SER N . 2.700 3.500 3.061 2.847 3.275 . 0 0 "[ . 1 . 2]" 2
93 1 81 VAL O 1 85 ILE H . . 2.500 2.176 1.950 2.464 . 0 0 "[ . 1 . 2]" 2
94 1 81 VAL O 1 85 ILE N . 2.700 3.500 3.088 2.913 3.282 . 0 0 "[ . 1 . 2]" 2
95 1 82 THR O 1 86 VAL H . . 2.500 2.452 2.361 2.498 . 0 0 "[ . 1 . 2]" 2
96 1 82 THR O 1 86 VAL N . 2.700 3.500 3.281 3.175 3.431 . 0 0 "[ . 1 . 2]" 2
97 1 83 LEU O 1 87 ILE H . . 2.500 1.928 1.803 2.295 . 0 0 "[ . 1 . 2]" 2
98 1 83 LEU O 1 87 ILE N . 2.700 3.500 2.873 2.755 3.182 . 0 0 "[ . 1 . 2]" 2
99 1 84 SER O 1 88 THR H . . 2.500 1.977 1.845 2.491 . 0 0 "[ . 1 . 2]" 2
100 1 84 SER O 1 88 THR N . 2.700 3.500 2.826 2.750 3.177 . 0 0 "[ . 1 . 2]" 2
101 1 85 ILE O 1 89 VAL H . . 2.500 2.372 1.820 2.506 0.006 13 0 "[ . 1 . 2]" 2
102 1 85 ILE O 1 89 VAL N . 2.700 3.500 3.256 2.782 3.423 . 0 0 "[ . 1 . 2]" 2
103 1 86 VAL O 1 90 PHE H . . 2.500 2.377 2.248 2.498 . 0 0 "[ . 1 . 2]" 2
104 1 86 VAL O 1 90 PHE N . 2.700 3.500 3.176 3.057 3.390 . 0 0 "[ . 1 . 2]" 2
105 1 87 ILE O 1 91 VAL H . . 2.500 2.208 1.799 2.484 0.001 11 0 "[ . 1 . 2]" 2
106 1 87 ILE O 1 91 VAL N . 2.700 3.500 3.181 2.758 3.463 . 0 0 "[ . 1 . 2]" 2
107 1 88 THR O 1 92 LEU H . . 2.500 2.462 2.352 2.505 0.005 13 0 "[ . 1 . 2]" 2
108 1 88 THR O 1 92 LEU N . 2.700 3.500 3.330 3.267 3.385 . 0 0 "[ . 1 . 2]" 2
109 1 89 VAL O 1 93 ASN H . . 2.500 2.129 1.930 2.360 . 0 0 "[ . 1 . 2]" 2
110 1 89 VAL O 1 93 ASN N . 2.700 3.500 2.790 2.746 2.946 . 0 0 "[ . 1 . 2]" 2
111 1 90 PHE O 1 94 VAL H . . 2.500 2.144 1.806 2.500 . 5 0 "[ . 1 . 2]" 2
112 1 90 PHE O 1 94 VAL N . 2.700 3.500 3.059 2.768 3.404 . 0 0 "[ . 1 . 2]" 2
113 1 109 ILE O 1 113 PHE H . . 2.500 2.099 1.977 2.243 . 0 0 "[ . 1 . 2]" 2
114 1 109 ILE O 1 113 PHE N . 2.700 3.500 2.873 2.771 2.981 . 0 0 "[ . 1 . 2]" 2
115 1 110 ASP O 1 114 LEU H . . 2.500 2.298 2.157 2.417 . 0 0 "[ . 1 . 2]" 2
116 1 110 ASP O 1 114 LEU N . 2.700 3.500 3.265 3.123 3.384 . 0 0 "[ . 1 . 2]" 2
117 1 111 ARG O 1 115 TRP H . . 2.500 2.496 2.480 2.501 0.001 10 0 "[ . 1 . 2]" 2
118 1 111 ARG O 1 115 TRP N . 2.700 3.500 3.259 3.246 3.278 . 0 0 "[ . 1 . 2]" 2
119 1 112 ILE O 1 116 MET H . . 2.500 2.301 2.284 2.327 . 0 0 "[ . 1 . 2]" 2
120 1 112 ILE O 1 116 MET N . 2.700 3.500 3.015 2.993 3.042 . 0 0 "[ . 1 . 2]" 2
121 1 113 PHE O 1 117 PHE H . . 2.500 2.505 2.503 2.507 0.007 3 0 "[ . 1 . 2]" 2
122 1 113 PHE O 1 117 PHE N . 2.700 3.500 3.462 3.459 3.463 . 0 0 "[ . 1 . 2]" 2
123 1 114 LEU O 1 118 ILE H . . 2.500 2.372 2.361 2.376 . 0 0 "[ . 1 . 2]" 2
124 1 114 LEU O 1 118 ILE N . 2.700 3.500 3.314 3.303 3.318 . 0 0 "[ . 1 . 2]" 2
125 1 115 TRP O 1 119 ILE H . . 2.500 2.501 2.500 2.502 0.002 11 0 "[ . 1 . 2]" 2
126 1 115 TRP O 1 119 ILE N . 2.700 3.500 3.123 3.119 3.124 . 0 0 "[ . 1 . 2]" 2
127 1 116 MET O 1 120 VAL H . . 2.500 2.206 2.201 2.240 . 0 0 "[ . 1 . 2]" 2
128 1 116 MET O 1 120 VAL N . 2.700 3.500 3.047 3.041 3.079 . 0 0 "[ . 1 . 2]" 2
129 1 117 PHE O 1 121 CYS H . . 2.500 2.506 2.505 2.509 0.009 9 0 "[ . 1 . 2]" 2
130 1 117 PHE O 1 121 CYS N . 2.700 3.500 3.352 3.351 3.358 . 0 0 "[ . 1 . 2]" 2
131 1 118 ILE O 1 122 LEU H . . 2.500 2.305 2.228 2.395 . 0 0 "[ . 1 . 2]" 2
132 1 118 ILE O 1 122 LEU N . 2.700 3.500 3.272 3.199 3.361 . 0 0 "[ . 1 . 2]" 2
133 1 119 ILE O 1 123 LEU H . . 2.500 2.416 2.330 2.496 . 0 0 "[ . 1 . 2]" 2
134 1 119 ILE O 1 123 LEU N . 2.700 3.500 3.260 3.192 3.336 . 0 0 "[ . 1 . 2]" 2
135 1 120 VAL O 1 124 GLY H . . 2.500 1.957 1.838 2.105 . 0 0 "[ . 1 . 2]" 2
136 1 120 VAL O 1 124 GLY N . 2.700 3.500 2.819 2.756 3.004 . 0 0 "[ . 1 . 2]" 2
137 1 121 CYS O 1 125 THR H . . 2.500 2.396 2.145 2.493 . 0 0 "[ . 1 . 2]" 2
138 1 121 CYS O 1 125 THR N . 2.700 3.500 3.275 3.022 3.406 . 0 0 "[ . 1 . 2]" 2
139 1 122 LEU O 1 126 VAL H . . 2.500 2.041 1.864 2.283 . 0 0 "[ . 1 . 2]" 2
140 1 122 LEU O 1 126 VAL N . 2.700 3.500 2.992 2.841 3.262 . 0 0 "[ . 1 . 2]" 2
141 1 123 LEU O 1 127 GLY H . . 2.500 1.874 1.804 2.098 . 0 0 "[ . 1 . 2]" 2
142 1 123 LEU O 1 127 GLY N . 2.700 3.500 2.832 2.763 3.065 . 0 0 "[ . 1 . 2]" 2
143 1 124 GLY O 1 128 LEU H . . 2.500 2.069 1.853 2.446 . 0 0 "[ . 1 . 2]" 2
144 1 124 GLY O 1 128 LEU N . 2.700 3.500 2.871 2.750 3.180 . 0 0 "[ . 1 . 2]" 2
145 1 125 THR O 1 129 PHE H . . 2.500 2.303 1.978 2.498 . 0 0 "[ . 1 . 2]" 2
146 1 125 THR O 1 129 PHE N . 2.700 3.500 3.202 2.938 3.402 . 0 0 "[ . 1 . 2]" 2
147 1 126 VAL O 1 130 LEU H . . 2.500 2.225 1.874 2.496 . 0 0 "[ . 1 . 2]" 2
148 1 126 VAL O 1 130 LEU N . 2.700 3.500 3.051 2.834 3.366 . 0 0 "[ . 1 . 2]" 2
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