NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
490218 |
2l3b   |
17176 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l3b
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 1340
_Distance_constraint_stats_list.Viol_count 845
_Distance_constraint_stats_list.Viol_total 655.542
_Distance_constraint_stats_list.Viol_max 0.449
_Distance_constraint_stats_list.Viol_rms 0.0100
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0012
_Distance_constraint_stats_list.Viol_average_violations_only 0.0388
_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 10 SER 0.393 0.141 17 0 "[ . 1 . 2]"
1 11 TYR 0.991 0.194 18 0 "[ . 1 . 2]"
1 12 PRO 1.265 0.227 9 0 "[ . 1 . 2]"
1 13 PHE 1.147 0.227 9 0 "[ . 1 . 2]"
1 14 SER 0.073 0.038 11 0 "[ . 1 . 2]"
1 15 ILE 1.672 0.134 16 0 "[ . 1 . 2]"
1 16 GLU 0.747 0.214 4 0 "[ . 1 . 2]"
1 17 THR 1.967 0.214 4 0 "[ . 1 . 2]"
1 18 MET 0.641 0.129 1 0 "[ . 1 . 2]"
1 19 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 VAL 0.581 0.068 17 0 "[ . 1 . 2]"
1 21 PRO 0.724 0.214 17 0 "[ . 1 . 2]"
1 22 LYS 0.176 0.094 17 0 "[ . 1 . 2]"
1 23 LYS 0.020 0.013 3 0 "[ . 1 . 2]"
1 24 LEU 1.851 0.214 17 0 "[ . 1 . 2]"
1 25 LYS 0.122 0.043 17 0 "[ . 1 . 2]"
1 26 VAL 0.236 0.059 17 0 "[ . 1 . 2]"
1 27 GLY 0.046 0.027 17 0 "[ . 1 . 2]"
1 28 GLU 0.210 0.069 17 0 "[ . 1 . 2]"
1 29 THR 0.254 0.050 19 0 "[ . 1 . 2]"
1 30 ALA 0.684 0.140 17 0 "[ . 1 . 2]"
1 31 GLU 0.055 0.027 15 0 "[ . 1 . 2]"
1 32 ILE 0.239 0.068 17 0 "[ . 1 . 2]"
1 33 ARG 1.153 0.173 16 0 "[ . 1 . 2]"
1 34 CYS 0.528 0.173 16 0 "[ . 1 . 2]"
1 35 GLN 0.891 0.148 4 0 "[ . 1 . 2]"
1 36 LEU 2.231 0.237 5 0 "[ . 1 . 2]"
1 37 HIS 0.790 0.131 11 0 "[ . 1 . 2]"
1 38 ARG 0.722 0.237 5 0 "[ . 1 . 2]"
1 39 ASP 1.034 0.145 1 0 "[ . 1 . 2]"
1 40 GLY 0.510 0.145 1 0 "[ . 1 . 2]"
1 41 ARG 1.239 0.119 6 0 "[ . 1 . 2]"
1 42 PHE 1.101 0.144 6 0 "[ . 1 . 2]"
1 43 GLU 0.393 0.144 6 0 "[ . 1 . 2]"
1 44 GLU 0.868 0.193 1 0 "[ . 1 . 2]"
1 45 THR 1.041 0.122 18 0 "[ . 1 . 2]"
1 46 LYS 0.070 0.033 1 0 "[ . 1 . 2]"
1 47 TYR 0.345 0.048 8 0 "[ . 1 . 2]"
1 48 PHE 0.410 0.118 12 0 "[ . 1 . 2]"
1 49 ILE 0.642 0.141 12 0 "[ . 1 . 2]"
1 50 ARG 0.461 0.100 4 0 "[ . 1 . 2]"
1 51 TYR 0.093 0.041 12 0 "[ . 1 . 2]"
1 52 PHE 0.059 0.050 11 0 "[ . 1 . 2]"
1 53 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 PRO 0.249 0.054 18 0 "[ . 1 . 2]"
1 55 ASP 0.937 0.185 12 0 "[ . 1 . 2]"
1 56 GLY 0.654 0.185 12 0 "[ . 1 . 2]"
1 57 ALA 0.854 0.187 17 0 "[ . 1 . 2]"
1 58 GLY 0.336 0.070 5 0 "[ . 1 . 2]"
1 59 THR 0.218 0.137 20 0 "[ . 1 . 2]"
1 60 LEU 0.330 0.044 14 0 "[ . 1 . 2]"
1 61 LYS 1.289 0.137 20 0 "[ . 1 . 2]"
1 62 MET 1.421 0.086 8 0 "[ . 1 . 2]"
1 63 SER 0.464 0.060 17 0 "[ . 1 . 2]"
1 64 ASP 0.274 0.055 9 0 "[ . 1 . 2]"
1 65 GLY 0.241 0.063 9 0 "[ . 1 . 2]"
1 66 THR 0.295 0.086 8 0 "[ . 1 . 2]"
1 67 VAL 0.876 0.082 4 0 "[ . 1 . 2]"
1 68 LEU 1.069 0.141 12 0 "[ . 1 . 2]"
1 69 LEU 0.300 0.044 1 0 "[ . 1 . 2]"
1 70 PRO 0.230 0.078 8 0 "[ . 1 . 2]"
1 71 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 ASP 0.232 0.078 8 0 "[ . 1 . 2]"
1 73 LEU 1.141 0.118 12 0 "[ . 1 . 2]"
1 74 TYR 0.694 0.044 1 0 "[ . 1 . 2]"
1 75 PRO 0.197 0.037 14 0 "[ . 1 . 2]"
1 76 LEU 0.322 0.066 18 0 "[ . 1 . 2]"
1 77 PRO 0.072 0.033 13 0 "[ . 1 . 2]"
1 78 GLY 0.111 0.035 14 0 "[ . 1 . 2]"
1 79 GLU 0.547 0.096 20 0 "[ . 1 . 2]"
1 80 THR 0.446 0.148 4 0 "[ . 1 . 2]"
1 81 PHE 0.134 0.039 9 0 "[ . 1 . 2]"
1 82 ARG 0.351 0.060 17 0 "[ . 1 . 2]"
1 83 LEU 0.526 0.049 16 0 "[ . 1 . 2]"
1 84 TYR 0.249 0.049 16 0 "[ . 1 . 2]"
1 85 TYR 0.486 0.103 10 0 "[ . 1 . 2]"
1 86 THR 0.269 0.086 10 0 "[ . 1 . 2]"
1 87 SER 0.065 0.060 10 0 "[ . 1 . 2]"
1 88 ALA 0.388 0.070 5 0 "[ . 1 . 2]"
1 89 SER 0.787 0.187 17 0 "[ . 1 . 2]"
1 90 THR 0.511 0.122 14 0 "[ . 1 . 2]"
1 91 ASP 0.964 0.449 11 0 "[ . 1 . 2]"
1 92 GLN 1.336 0.449 11 0 "[ . 1 . 2]"
1 93 GLN 0.081 0.081 3 0 "[ . 1 . 2]"
1 94 THR 0.197 0.059 6 0 "[ . 1 . 2]"
1 95 VAL 0.647 0.162 6 0 "[ . 1 . 2]"
1 96 ASP 0.009 0.005 20 0 "[ . 1 . 2]"
1 97 VAL 0.097 0.041 12 0 "[ . 1 . 2]"
1 98 TYR 0.770 0.131 5 0 "[ . 1 . 2]"
1 99 PHE 0.999 0.091 7 0 "[ . 1 . 2]"
1 100 GLN 1.667 0.090 5 0 "[ . 1 . 2]"
1 101 ASP 0.840 0.124 7 0 "[ . 1 . 2]"
1 102 SER 0.292 0.058 3 0 "[ . 1 . 2]"
1 103 PHE 0.044 0.024 11 0 "[ . 1 . 2]"
1 104 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 GLN 0.709 0.095 7 0 "[ . 1 . 2]"
1 106 LEU 1.944 0.131 5 0 "[ . 1 . 2]"
1 107 GLN 0.470 0.134 16 0 "[ . 1 . 2]"
1 108 GLN 0.873 0.161 17 0 "[ . 1 . 2]"
1 109 LEU 1.947 0.161 17 0 "[ . 1 . 2]"
1 110 THR 0.017 0.017 15 0 "[ . 1 . 2]"
1 111 PHE 0.903 0.162 6 0 "[ . 1 . 2]"
1 112 SER 0.442 0.103 11 0 "[ . 1 . 2]"
1 113 PHE 0.762 0.140 17 0 "[ . 1 . 2]"
1 115 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 ASP 0.457 0.143 10 0 "[ . 1 . 2]"
1 117 SER 0.566 0.143 10 0 "[ . 1 . 2]"
1 118 SER 0.109 0.045 3 0 "[ . 1 . 2]"
1 119 LYS 0.008 0.008 1 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 SER HA 1 11 TYR H 1.800 . 3.360 2.659 2.126 3.501 0.141 17 0 "[ . 1 . 2]" 1
2 1 10 SER QB 1 11 TYR H 1.800 . 4.000 3.407 2.346 4.035 0.035 14 0 "[ . 1 . 2]" 1
3 1 10 SER H 1 10 SER QB 1.800 . 3.270 2.656 2.236 3.328 0.058 7 0 "[ . 1 . 2]" 1
4 1 11 TYR HA 1 11 TYR QD 1.800 . 4.060 2.780 2.197 3.732 . 0 0 "[ . 1 . 2]" 1
5 1 11 TYR HA 1 12 PRO QB 1.800 . 5.370 4.785 4.513 5.564 0.194 18 0 "[ . 1 . 2]" 1
6 1 11 TYR HA 1 12 PRO QD 1.800 . 3.800 2.211 1.800 3.633 . 0 0 "[ . 1 . 2]" 1
7 1 11 TYR QB 1 12 PRO QD 1.800 . 5.100 3.048 1.719 3.799 0.081 20 0 "[ . 1 . 2]" 1
8 1 11 TYR HB3 1 12 PRO QD 1.800 . 5.000 3.389 1.771 4.381 0.029 18 0 "[ . 1 . 2]" 1
9 1 11 TYR HB2 1 12 PRO QD 1.800 . 5.000 3.847 1.730 4.402 0.070 20 0 "[ . 1 . 2]" 1
10 1 11 TYR QD 1 12 PRO HD3 1.800 . 5.000 4.241 3.127 5.045 0.045 5 0 "[ . 1 . 2]" 1
11 1 11 TYR QD 1 12 PRO HD2 1.800 . 5.000 3.890 2.355 4.998 . 0 0 "[ . 1 . 2]" 1
12 1 11 TYR H 1 11 TYR QB 1.800 . 3.690 2.718 2.309 3.376 . 0 0 "[ . 1 . 2]" 1
13 1 11 TYR H 1 12 PRO HD3 1.800 . 5.740 3.626 2.343 4.761 . 0 0 "[ . 1 . 2]" 1
14 1 11 TYR H 1 12 PRO HD2 1.800 . 5.740 4.261 1.783 5.268 0.017 20 0 "[ . 1 . 2]" 1
15 1 12 PRO HA 1 13 PHE H 1.800 . 3.270 2.455 2.125 3.497 0.227 9 0 "[ . 1 . 2]" 1
16 1 12 PRO HA 1 105 GLN QE 1.800 . 5.200 3.722 2.073 5.295 0.095 7 0 "[ . 1 . 2]" 1
17 1 12 PRO HB3 1 13 PHE H 1.800 . 4.490 3.686 3.090 4.547 0.057 7 0 "[ . 1 . 2]" 1
18 1 12 PRO HB2 1 13 PHE H 1.800 . 4.490 3.215 1.985 4.157 . 0 0 "[ . 1 . 2]" 1
19 1 12 PRO QD 1 13 PHE H 1.800 . 6.050 4.518 2.442 4.996 . 0 0 "[ . 1 . 2]" 1
20 1 13 PHE HA 1 13 PHE QD 1.800 . 4.920 2.993 2.119 3.743 . 0 0 "[ . 1 . 2]" 1
21 1 13 PHE HA 1 14 SER H 1.800 . 3.690 2.216 2.125 2.596 . 0 0 "[ . 1 . 2]" 1
22 1 13 PHE HB3 1 14 SER H 1.800 . 4.490 3.302 2.067 4.179 . 0 0 "[ . 1 . 2]" 1
23 1 13 PHE HB2 1 14 SER H 1.800 . 4.490 3.689 2.748 4.408 . 0 0 "[ . 1 . 2]" 1
24 1 13 PHE QD 1 14 SER H 1.800 . 4.390 3.860 2.330 4.241 . 0 0 "[ . 1 . 2]" 1
25 1 13 PHE QD 1 36 LEU MD1 1.800 . 3.560 3.307 2.323 3.663 0.103 8 0 "[ . 1 . 2]" 1
26 1 13 PHE QD 1 36 LEU MD2 1.800 . 4.190 3.080 1.804 4.229 0.039 20 0 "[ . 1 . 2]" 1
27 1 13 PHE QD 1 36 LEU HG 1.800 . 5.130 3.606 2.014 4.458 . 0 0 "[ . 1 . 2]" 1
28 1 13 PHE QD 1 47 TYR QE 1.800 . 5.240 3.737 2.421 5.256 0.016 7 0 "[ . 1 . 2]" 1
29 1 13 PHE H 1 13 PHE QD 1.800 . 3.810 2.570 1.827 3.744 . 0 0 "[ . 1 . 2]" 1
30 1 13 PHE H 1 14 SER H 1.800 . 5.070 4.527 4.351 4.592 . 0 0 "[ . 1 . 2]" 1
31 1 13 PHE H 1 105 GLN QE 1.800 . 4.600 3.522 2.264 4.617 0.017 7 0 "[ . 1 . 2]" 1
32 1 13 PHE H 1 105 GLN QG 1.800 . 4.600 3.716 1.797 4.686 0.086 20 0 "[ . 1 . 2]" 1
33 1 14 SER HA 1 15 ILE HB 1.800 . 5.310 4.636 4.454 4.859 . 0 0 "[ . 1 . 2]" 1
34 1 14 SER HA 1 15 ILE H 1.800 . 3.340 2.187 2.123 2.525 . 0 0 "[ . 1 . 2]" 1
35 1 14 SER QB 1 15 ILE H 1.800 . 3.880 3.422 2.604 3.918 0.038 11 0 "[ . 1 . 2]" 1
36 1 14 SER H 1 36 LEU HA 1.800 . 5.420 4.816 4.266 5.432 0.012 2 0 "[ . 1 . 2]" 1
37 1 14 SER H 1 36 LEU MD1 1.800 . 6.000 5.055 3.160 5.875 . 0 0 "[ . 1 . 2]" 1
38 1 14 SER H 1 37 HIS H 1.800 . 4.500 3.394 2.875 4.369 . 0 0 "[ . 1 . 2]" 1
39 1 15 ILE HA 1 15 ILE MD 1.800 . 4.700 3.594 2.037 3.830 . 0 0 "[ . 1 . 2]" 1
40 1 15 ILE HB 1 15 ILE MD 1.800 . 3.550 2.533 2.358 3.239 . 0 0 "[ . 1 . 2]" 1
41 1 15 ILE HB 1 16 GLU H 1.800 . 5.040 4.294 4.160 4.410 . 0 0 "[ . 1 . 2]" 1
42 1 15 ILE HB 1 36 LEU HA 1.800 . 5.530 4.682 4.352 5.253 . 0 0 "[ . 1 . 2]" 1
43 1 15 ILE HB 1 99 PHE QD 1.800 . 4.800 4.189 3.484 4.827 0.027 14 0 "[ . 1 . 2]" 1
44 1 15 ILE HB 1 99 PHE QE 1.800 . 6.050 4.765 3.729 5.638 . 0 0 "[ . 1 . 2]" 1
45 1 15 ILE HB 1 109 LEU MD1 1.800 . 4.700 3.110 1.906 3.947 . 0 0 "[ . 1 . 2]" 1
46 1 15 ILE HB 1 109 LEU MD2 1.800 . 4.440 4.193 3.431 4.494 0.054 8 0 "[ . 1 . 2]" 1
47 1 15 ILE MD 1 16 GLU H 1.800 . 5.440 5.044 3.741 5.347 . 0 0 "[ . 1 . 2]" 1
48 1 15 ILE MD 1 35 GLN H 1.800 . 6.000 5.578 4.908 6.099 0.099 11 0 "[ . 1 . 2]" 1
49 1 15 ILE MD 1 36 LEU HA 1.800 . 5.000 3.727 2.142 4.182 . 0 0 "[ . 1 . 2]" 1
50 1 15 ILE MD 1 36 LEU HB3 1.800 . 5.220 4.510 3.903 5.226 0.006 7 0 "[ . 1 . 2]" 1
51 1 15 ILE MD 1 36 LEU HB2 1.800 . 5.220 3.185 2.533 4.109 . 0 0 "[ . 1 . 2]" 1
52 1 15 ILE MD 1 36 LEU MD1 1.800 . 3.060 2.080 1.788 2.377 0.012 17 0 "[ . 1 . 2]" 1
53 1 15 ILE MD 1 36 LEU HG 1.800 . 4.260 3.376 2.073 4.367 0.107 8 0 "[ . 1 . 2]" 1
54 1 15 ILE MD 1 36 LEU H 1.800 . 6.000 4.951 4.084 5.744 . 0 0 "[ . 1 . 2]" 1
55 1 15 ILE MD 1 37 HIS H 1.800 . 5.330 4.966 2.991 5.417 0.087 13 0 "[ . 1 . 2]" 1
56 1 15 ILE MD 1 99 PHE HB3 1.800 . 4.460 2.648 2.195 3.581 . 0 0 "[ . 1 . 2]" 1
57 1 15 ILE MD 1 99 PHE HB2 1.800 . 4.460 2.826 2.210 3.948 . 0 0 "[ . 1 . 2]" 1
58 1 15 ILE MD 1 99 PHE QD 1.800 . 5.260 2.972 2.348 4.235 . 0 0 "[ . 1 . 2]" 1
59 1 15 ILE MD 1 107 GLN QB 1.800 . 4.510 3.215 1.913 4.440 . 0 0 "[ . 1 . 2]" 1
60 1 15 ILE MD 1 107 GLN QG 1.800 . 4.740 3.724 1.821 4.874 0.134 16 0 "[ . 1 . 2]" 1
61 1 15 ILE MD 1 109 LEU HG 1.800 . 6.050 5.021 3.592 6.060 0.010 11 0 "[ . 1 . 2]" 1
62 1 15 ILE QG 1 36 LEU MD1 1.800 . 4.060 2.499 1.900 4.064 0.004 4 0 "[ . 1 . 2]" 1
63 1 15 ILE QG 1 99 PHE QD 1.800 . 5.500 4.407 2.583 4.992 . 0 0 "[ . 1 . 2]" 1
64 1 15 ILE MG 1 16 GLU H 1.800 . 3.770 2.930 2.556 3.154 . 0 0 "[ . 1 . 2]" 1
65 1 15 ILE MG 1 17 THR HA 1.800 . 5.370 4.167 3.591 4.869 . 0 0 "[ . 1 . 2]" 1
66 1 15 ILE MG 1 17 THR MG 1.800 . 3.170 2.574 1.993 3.120 . 0 0 "[ . 1 . 2]" 1
67 1 15 ILE MG 1 17 THR H 1.800 . 4.890 4.318 3.757 4.910 0.020 2 0 "[ . 1 . 2]" 1
68 1 15 ILE MG 1 34 CYS HA 1.800 . 4.300 3.594 3.012 4.316 0.016 2 0 "[ . 1 . 2]" 1
69 1 15 ILE MG 1 34 CYS QB 1.800 . 4.250 2.596 1.915 3.955 . 0 0 "[ . 1 . 2]" 1
70 1 15 ILE MG 1 35 GLN H 1.800 . 4.030 3.083 2.561 3.514 . 0 0 "[ . 1 . 2]" 1
71 1 15 ILE MG 1 36 LEU HA 1.800 . 3.560 3.089 2.683 3.470 . 0 0 "[ . 1 . 2]" 1
72 1 15 ILE MG 1 36 LEU MD1 1.800 . 4.830 3.817 3.169 4.392 . 0 0 "[ . 1 . 2]" 1
73 1 15 ILE MG 1 99 PHE QD 1.800 . 4.390 3.675 2.895 4.430 0.040 20 0 "[ . 1 . 2]" 1
74 1 15 ILE MG 1 99 PHE QE 1.800 . 4.530 3.481 2.877 4.184 . 0 0 "[ . 1 . 2]" 1
75 1 15 ILE MG 1 109 LEU MD1 1.800 . 4.000 2.892 2.443 3.460 . 0 0 "[ . 1 . 2]" 1
76 1 15 ILE MG 1 109 LEU MD2 1.800 . 5.000 4.443 3.708 4.786 . 0 0 "[ . 1 . 2]" 1
77 1 15 ILE MG 1 109 LEU HG 1.800 . 6.050 4.796 4.198 5.450 . 0 0 "[ . 1 . 2]" 1
78 1 15 ILE H 1 15 ILE HB 1.800 . 3.750 2.609 2.502 2.783 . 0 0 "[ . 1 . 2]" 1
79 1 15 ILE H 1 15 ILE MD 1.800 . 4.750 3.852 2.328 4.333 . 0 0 "[ . 1 . 2]" 1
80 1 15 ILE H 1 15 ILE QG 1.800 . 4.040 2.692 2.274 3.598 . 0 0 "[ . 1 . 2]" 1
81 1 15 ILE H 1 15 ILE MG 1.800 . 4.870 3.832 3.790 3.892 . 0 0 "[ . 1 . 2]" 1
82 1 15 ILE H 1 37 HIS H 1.800 . 5.970 4.755 4.514 5.016 . 0 0 "[ . 1 . 2]" 1
83 1 15 ILE H 1 107 GLN QB 1.800 . 5.760 4.560 3.586 5.430 . 0 0 "[ . 1 . 2]" 1
84 1 15 ILE H 1 107 GLN HE21 1.800 . 6.050 4.047 2.673 5.263 . 0 0 "[ . 1 . 2]" 1
85 1 15 ILE H 1 107 GLN QG 1.800 . 5.240 3.977 2.630 5.271 0.031 19 0 "[ . 1 . 2]" 1
86 1 15 ILE H 1 109 LEU MD2 1.800 . 5.430 4.987 4.176 5.508 0.078 9 0 "[ . 1 . 2]" 1
87 1 16 GLU HA 1 16 GLU QG 1.800 . 3.640 2.677 2.255 3.337 . 0 0 "[ . 1 . 2]" 1
88 1 16 GLU HA 1 17 THR H 1.800 . 2.920 2.196 2.059 2.321 . 0 0 "[ . 1 . 2]" 1
89 1 16 GLU QB 1 17 THR H 1.800 . 4.420 3.366 2.591 3.908 . 0 0 "[ . 1 . 2]" 1
90 1 16 GLU QB 1 35 GLN H 1.800 . 5.560 3.790 2.921 4.558 . 0 0 "[ . 1 . 2]" 1
91 1 16 GLU QG 1 17 THR H 1.800 . 3.610 3.286 2.508 3.824 0.214 4 0 "[ . 1 . 2]" 1
92 1 16 GLU H 1 16 GLU QB 1.800 . 3.900 2.430 2.270 2.841 . 0 0 "[ . 1 . 2]" 1
93 1 16 GLU H 1 16 GLU QG 1.800 . 4.540 3.493 1.957 4.125 . 0 0 "[ . 1 . 2]" 1
94 1 16 GLU H 1 17 THR MG 1.800 . 5.120 4.546 4.212 4.796 . 0 0 "[ . 1 . 2]" 1
95 1 16 GLU H 1 17 THR H 1.800 . 4.920 4.436 4.264 4.542 . 0 0 "[ . 1 . 2]" 1
96 1 16 GLU H 1 35 GLN QB 1.800 . 4.720 3.421 2.896 4.007 . 0 0 "[ . 1 . 2]" 1
97 1 16 GLU H 1 35 GLN H 1.800 . 4.180 3.167 2.939 3.569 . 0 0 "[ . 1 . 2]" 1
98 1 16 GLU H 1 36 LEU HA 1.800 . 4.260 3.590 3.257 4.215 . 0 0 "[ . 1 . 2]" 1
99 1 16 GLU H 1 37 HIS H 1.800 . 6.050 4.103 3.346 4.978 . 0 0 "[ . 1 . 2]" 1
100 1 17 THR HA 1 17 THR MG 1.800 . 3.620 2.294 2.213 2.375 . 0 0 "[ . 1 . 2]" 1
101 1 17 THR HA 1 18 MET H 1.800 . 3.660 2.206 2.139 2.369 . 0 0 "[ . 1 . 2]" 1
102 1 17 THR HA 1 32 ILE MG 1.800 . 5.500 3.972 3.437 4.423 . 0 0 "[ . 1 . 2]" 1
103 1 17 THR HA 1 34 CYS HA 1.800 . 4.270 2.386 2.177 2.693 . 0 0 "[ . 1 . 2]" 1
104 1 17 THR HA 1 35 GLN H 1.800 . 4.420 3.502 3.002 3.788 . 0 0 "[ . 1 . 2]" 1
105 1 17 THR HB 1 18 MET H 1.800 . 4.070 3.070 2.547 3.451 . 0 0 "[ . 1 . 2]" 1
106 1 17 THR HB 1 32 ILE MG 1.800 . 4.070 2.866 2.193 3.388 . 0 0 "[ . 1 . 2]" 1
107 1 17 THR HB 1 34 CYS HA 1.800 . 4.750 4.331 4.040 4.744 . 0 0 "[ . 1 . 2]" 1
108 1 17 THR MG 1 18 MET H 1.800 . 4.520 3.751 3.533 3.958 . 0 0 "[ . 1 . 2]" 1
109 1 17 THR MG 1 32 ILE MG 1.800 . 3.740 2.809 2.335 3.154 . 0 0 "[ . 1 . 2]" 1
110 1 17 THR MG 1 34 CYS HA 1.800 . 3.900 2.756 2.300 3.084 . 0 0 "[ . 1 . 2]" 1
111 1 17 THR MG 1 35 GLN QB 1.800 . 5.810 5.460 5.109 5.836 0.026 17 0 "[ . 1 . 2]" 1
112 1 17 THR MG 1 35 GLN H 1.800 . 4.170 3.913 3.491 4.206 0.036 5 0 "[ . 1 . 2]" 1
113 1 17 THR MG 1 99 PHE QE 1.800 . 3.650 3.588 2.921 3.741 0.091 7 0 "[ . 1 . 2]" 1
114 1 17 THR MG 1 109 LEU MD1 1.800 . 3.100 2.134 1.788 2.442 0.012 20 0 "[ . 1 . 2]" 1
115 1 17 THR MG 1 109 LEU MD2 1.800 . 3.860 3.806 3.168 3.936 0.076 18 0 "[ . 1 . 2]" 1
116 1 17 THR H 1 17 THR MG 1.800 . 3.630 2.919 2.592 3.176 . 0 0 "[ . 1 . 2]" 1
117 1 17 THR H 1 18 MET H 1.800 . 5.060 4.430 4.322 4.533 . 0 0 "[ . 1 . 2]" 1
118 1 17 THR H 1 109 LEU MD1 1.800 . 4.980 4.398 3.564 5.039 0.059 20 0 "[ . 1 . 2]" 1
119 1 17 THR H 1 109 LEU MD2 1.800 . 5.650 5.238 4.771 5.708 0.058 11 0 "[ . 1 . 2]" 1
120 1 18 MET HA 1 18 MET ME 1.800 . 5.200 4.010 2.890 4.616 . 0 0 "[ . 1 . 2]" 1
121 1 18 MET HA 1 18 MET QG 1.800 . 3.770 2.746 2.360 3.466 . 0 0 "[ . 1 . 2]" 1
122 1 18 MET HA 1 33 ARG H 1.800 . 6.050 5.538 5.134 5.992 . 0 0 "[ . 1 . 2]" 1
123 1 18 MET QB 1 19 PRO QD 1.800 . 4.970 2.525 2.016 2.922 . 0 0 "[ . 1 . 2]" 1
124 1 18 MET QB 1 33 ARG QD 1.800 . 4.470 3.821 2.745 4.578 0.108 5 0 "[ . 1 . 2]" 1
125 1 18 MET ME 1 33 ARG QD 1.800 . 4.170 3.033 2.000 4.188 0.018 5 0 "[ . 1 . 2]" 1
126 1 18 MET ME 1 18 MET QG 1.800 . 3.400 2.312 2.223 2.451 . 0 0 "[ . 1 . 2]" 1
127 1 18 MET QG 1 33 ARG QB 1.800 . 5.000 2.363 1.749 2.889 0.051 1 0 "[ . 1 . 2]" 1
128 1 18 MET QG 1 33 ARG QD 1.800 . 3.960 3.225 1.926 4.089 0.129 1 0 "[ . 1 . 2]" 1
129 1 18 MET H 1 18 MET QB 1.800 . 3.880 2.416 2.283 2.636 . 0 0 "[ . 1 . 2]" 1
130 1 18 MET H 1 18 MET HG3 1.800 . 4.260 3.270 2.177 3.957 . 0 0 "[ . 1 . 2]" 1
131 1 18 MET H 1 18 MET HG2 1.800 . 4.260 3.086 2.105 4.094 . 0 0 "[ . 1 . 2]" 1
132 1 18 MET H 1 32 ILE MG 1.800 . 5.250 3.805 3.311 4.376 . 0 0 "[ . 1 . 2]" 1
133 1 18 MET H 1 33 ARG HB3 1.800 . 5.140 4.114 2.981 5.012 . 0 0 "[ . 1 . 2]" 1
134 1 18 MET H 1 33 ARG HB2 1.800 . 5.140 4.053 2.848 5.171 0.031 3 0 "[ . 1 . 2]" 1
135 1 18 MET H 1 33 ARG H 1.800 . 5.200 3.633 3.287 4.086 . 0 0 "[ . 1 . 2]" 1
136 1 19 PRO HA 1 20 VAL MG2 1.800 . 4.220 3.652 3.503 3.743 . 0 0 "[ . 1 . 2]" 1
137 1 19 PRO HA 1 20 VAL H 1.800 . 3.550 2.158 2.117 2.305 . 0 0 "[ . 1 . 2]" 1
138 1 20 VAL HA 1 20 VAL MG1 1.800 . 3.260 2.340 2.282 2.383 . 0 0 "[ . 1 . 2]" 1
139 1 20 VAL HA 1 20 VAL MG2 1.800 . 3.900 3.212 3.201 3.221 . 0 0 "[ . 1 . 2]" 1
140 1 20 VAL HA 1 21 PRO HD3 1.800 . 3.730 2.119 1.837 2.699 . 0 0 "[ . 1 . 2]" 1
141 1 20 VAL HA 1 21 PRO HD2 1.800 . 3.730 2.818 2.331 3.118 . 0 0 "[ . 1 . 2]" 1
142 1 20 VAL HA 1 21 PRO QG 1.800 . 4.490 3.901 3.700 4.097 . 0 0 "[ . 1 . 2]" 1
143 1 20 VAL HB 1 21 PRO HD3 1.800 . 4.110 3.057 2.715 3.595 . 0 0 "[ . 1 . 2]" 1
144 1 20 VAL HB 1 21 PRO HD2 1.800 . 4.110 2.094 1.797 2.601 0.003 4 0 "[ . 1 . 2]" 1
145 1 20 VAL HB 1 113 PHE QE 1.800 . 5.180 2.659 1.785 3.615 0.015 18 0 "[ . 1 . 2]" 1
146 1 20 VAL HB 1 113 PHE HZ 1.800 . 5.080 4.013 2.260 5.089 0.009 20 0 "[ . 1 . 2]" 1
147 1 20 VAL MG1 1 21 PRO HD3 1.800 . 4.300 3.520 3.160 4.129 . 0 0 "[ . 1 . 2]" 1
148 1 20 VAL MG1 1 21 PRO HD2 1.800 . 4.300 3.357 2.979 3.659 . 0 0 "[ . 1 . 2]" 1
149 1 20 VAL MG1 1 21 PRO HG3 1.800 . 6.020 5.341 4.966 5.515 . 0 0 "[ . 1 . 2]" 1
150 1 20 VAL MG1 1 21 PRO HG2 1.800 . 6.020 5.145 4.653 5.448 . 0 0 "[ . 1 . 2]" 1
151 1 20 VAL MG1 1 32 ILE HA 1.800 . 4.600 2.996 2.201 3.818 . 0 0 "[ . 1 . 2]" 1
152 1 20 VAL MG1 1 32 ILE MD 1.800 . 3.690 2.740 2.271 3.494 . 0 0 "[ . 1 . 2]" 1
153 1 20 VAL MG1 1 32 ILE QG 1.800 . 3.820 1.987 1.749 2.887 0.051 8 0 "[ . 1 . 2]" 1
154 1 20 VAL MG1 1 32 ILE MG 1.800 . 3.450 2.549 2.163 2.946 . 0 0 "[ . 1 . 2]" 1
155 1 20 VAL MG1 1 33 ARG H 1.800 . 5.640 4.476 3.396 5.208 . 0 0 "[ . 1 . 2]" 1
156 1 20 VAL MG1 1 111 PHE QD 1.800 . 3.860 3.728 3.190 3.909 0.049 6 0 "[ . 1 . 2]" 1
157 1 20 VAL MG1 1 113 PHE QE 1.800 . 4.110 3.195 1.893 4.093 . 0 0 "[ . 1 . 2]" 1
158 1 20 VAL MG1 1 113 PHE HZ 1.800 . 6.000 3.238 2.581 4.385 . 0 0 "[ . 1 . 2]" 1
159 1 20 VAL MG2 1 21 PRO HD3 1.800 . 5.100 4.240 4.029 4.592 . 0 0 "[ . 1 . 2]" 1
160 1 20 VAL MG2 1 21 PRO HD2 1.800 . 5.100 3.586 3.391 3.968 . 0 0 "[ . 1 . 2]" 1
161 1 20 VAL MG2 1 21 PRO QG 1.800 . 5.890 4.736 3.877 5.106 . 0 0 "[ . 1 . 2]" 1
162 1 20 VAL MG2 1 32 ILE QG 1.800 . 5.210 4.134 3.610 5.242 0.032 17 0 "[ . 1 . 2]" 1
163 1 20 VAL MG2 1 32 ILE MG 1.800 . 4.810 4.378 3.952 4.878 0.068 17 0 "[ . 1 . 2]" 1
164 1 20 VAL MG2 1 111 PHE QB 1.800 . 5.390 3.656 2.469 4.469 . 0 0 "[ . 1 . 2]" 1
165 1 20 VAL MG2 1 111 PHE QD 1.800 . 3.720 3.064 2.223 3.741 0.021 17 0 "[ . 1 . 2]" 1
166 1 20 VAL MG2 1 113 PHE QE 1.800 . 3.880 2.449 1.774 3.344 0.026 9 0 "[ . 1 . 2]" 1
167 1 20 VAL MG2 1 113 PHE HZ 1.800 . 4.370 3.400 2.694 4.423 0.053 17 0 "[ . 1 . 2]" 1
168 1 20 VAL H 1 20 VAL MG1 1.800 . 4.270 2.504 2.250 2.919 . 0 0 "[ . 1 . 2]" 1
169 1 20 VAL H 1 20 VAL MG2 1.800 . 3.360 1.951 1.853 2.124 . 0 0 "[ . 1 . 2]" 1
170 1 21 PRO HA 1 22 LYS H 1.800 . 3.360 2.234 2.140 2.409 . 0 0 "[ . 1 . 2]" 1
171 1 21 PRO HA 1 23 LYS H 1.800 . 4.860 3.887 3.461 4.264 . 0 0 "[ . 1 . 2]" 1
172 1 21 PRO QB 1 22 LYS H 1.800 . 3.950 3.026 2.416 3.364 . 0 0 "[ . 1 . 2]" 1
173 1 21 PRO QB 1 23 LYS H 1.800 . 4.390 2.946 2.174 3.591 . 0 0 "[ . 1 . 2]" 1
174 1 21 PRO QB 1 24 LEU HG 1.800 . 5.540 3.231 2.146 5.475 . 0 0 "[ . 1 . 2]" 1
175 1 21 PRO QB 1 30 ALA MB 1.800 . 5.870 3.993 3.470 5.219 . 0 0 "[ . 1 . 2]" 1
176 1 21 PRO QD 1 24 LEU MD1 1.800 . 4.850 3.615 2.487 4.932 0.082 17 0 "[ . 1 . 2]" 1
177 1 21 PRO HD3 1 30 ALA MB 1.800 . 4.590 3.310 2.790 4.007 . 0 0 "[ . 1 . 2]" 1
178 1 21 PRO HD2 1 30 ALA MB 1.800 . 4.590 2.583 1.980 4.035 . 0 0 "[ . 1 . 2]" 1
179 1 21 PRO QG 1 23 LYS H 1.800 . 5.890 4.771 3.237 5.558 . 0 0 "[ . 1 . 2]" 1
180 1 21 PRO QG 1 24 LEU QB 1.800 . 5.260 4.995 4.270 5.325 0.065 7 0 "[ . 1 . 2]" 1
181 1 21 PRO QG 1 24 LEU MD1 1.800 . 4.160 3.637 2.513 4.374 0.214 17 0 "[ . 1 . 2]" 1
182 1 21 PRO QG 1 24 LEU MD2 1.800 . 4.870 2.468 1.996 5.003 0.133 17 0 "[ . 1 . 2]" 1
183 1 21 PRO QG 1 30 ALA MB 1.800 . 3.650 2.812 2.189 3.580 . 0 0 "[ . 1 . 2]" 1
184 1 22 LYS HA 1 22 LYS QD 1.800 . 4.530 3.562 2.063 4.488 . 0 0 "[ . 1 . 2]" 1
185 1 22 LYS HA 1 22 LYS QE 1.800 . 5.200 4.301 2.552 5.126 . 0 0 "[ . 1 . 2]" 1
186 1 22 LYS HA 1 22 LYS QG 1.800 . 3.580 2.569 2.327 3.346 . 0 0 "[ . 1 . 2]" 1
187 1 22 LYS QB 1 23 LYS QG 1.800 . 4.390 3.389 2.773 4.403 0.013 3 0 "[ . 1 . 2]" 1
188 1 22 LYS QB 1 23 LYS H 1.800 . 4.500 3.056 2.400 3.560 . 0 0 "[ . 1 . 2]" 1
189 1 22 LYS QE 1 22 LYS HG3 1.800 . 4.170 2.687 2.320 3.518 . 0 0 "[ . 1 . 2]" 1
190 1 22 LYS QE 1 22 LYS HG2 1.800 . 4.170 2.815 2.318 3.513 . 0 0 "[ . 1 . 2]" 1
191 1 22 LYS H 1 22 LYS QB 1.800 . 3.580 2.455 2.293 2.637 . 0 0 "[ . 1 . 2]" 1
192 1 22 LYS H 1 22 LYS QD 1.800 . 4.740 3.567 1.788 4.797 0.057 17 0 "[ . 1 . 2]" 1
193 1 22 LYS H 1 22 LYS QG 1.800 . 3.920 2.617 1.941 4.014 0.094 17 0 "[ . 1 . 2]" 1
194 1 22 LYS H 1 23 LYS QG 1.800 . 4.920 4.041 2.786 4.859 . 0 0 "[ . 1 . 2]" 1
195 1 22 LYS H 1 23 LYS H 1.800 . 3.730 2.387 2.125 2.588 . 0 0 "[ . 1 . 2]" 1
196 1 23 LYS HA 1 23 LYS QD 1.800 . 4.840 3.746 1.908 4.536 . 0 0 "[ . 1 . 2]" 1
197 1 23 LYS HB3 1 23 LYS QE 1.800 . 5.310 3.640 1.892 4.192 . 0 0 "[ . 1 . 2]" 1
198 1 23 LYS HB2 1 23 LYS QE 1.800 . 5.310 3.794 1.793 4.531 0.007 5 0 "[ . 1 . 2]" 1
199 1 23 LYS QE 1 23 LYS QG 1.800 . 3.110 2.349 2.123 2.795 . 0 0 "[ . 1 . 2]" 1
200 1 23 LYS H 1 23 LYS QD 1.800 . 5.000 4.129 1.933 4.592 . 0 0 "[ . 1 . 2]" 1
201 1 23 LYS H 1 23 LYS QG 1.800 . 4.820 2.670 2.012 3.444 . 0 0 "[ . 1 . 2]" 1
202 1 24 LEU HA 1 24 LEU MD1 1.800 . 4.700 3.731 2.148 3.891 . 0 0 "[ . 1 . 2]" 1
203 1 24 LEU HA 1 24 LEU MD2 1.800 . 3.950 2.169 1.841 3.826 . 0 0 "[ . 1 . 2]" 1
204 1 24 LEU HA 1 28 GLU HB3 1.800 . 5.800 3.899 3.319 4.637 . 0 0 "[ . 1 . 2]" 1
205 1 24 LEU HA 1 28 GLU HB2 1.800 . 5.800 4.145 3.303 5.526 . 0 0 "[ . 1 . 2]" 1
206 1 24 LEU QB 1 24 LEU MD1 1.800 . 3.580 2.104 2.080 2.220 . 0 0 "[ . 1 . 2]" 1
207 1 24 LEU QB 1 24 LEU MD2 1.800 . 3.380 2.271 2.075 2.331 . 0 0 "[ . 1 . 2]" 1
208 1 24 LEU QB 1 87 SER QB 1.800 . 5.240 2.607 1.851 4.290 . 0 0 "[ . 1 . 2]" 1
209 1 24 LEU MD1 1 25 LYS H 1.800 . 5.180 4.674 3.350 5.210 0.030 5 0 "[ . 1 . 2]" 1
210 1 24 LEU MD1 1 28 GLU QB 1.800 . 4.660 4.095 2.386 4.729 0.069 17 0 "[ . 1 . 2]" 1
211 1 24 LEU MD1 1 29 THR HA 1.800 . 6.000 5.001 4.330 5.990 . 0 0 "[ . 1 . 2]" 1
212 1 24 LEU MD1 1 30 ALA MB 1.800 . 3.800 2.423 1.985 3.513 . 0 0 "[ . 1 . 2]" 1
213 1 24 LEU MD1 1 30 ALA H 1.800 . 5.170 4.053 3.560 5.186 0.016 17 0 "[ . 1 . 2]" 1
214 1 24 LEU MD1 1 85 TYR QB 1.800 . 5.710 4.110 3.486 5.406 . 0 0 "[ . 1 . 2]" 1
215 1 24 LEU MD1 1 85 TYR QD 1.800 . 3.980 2.695 2.083 4.083 0.103 10 0 "[ . 1 . 2]" 1
216 1 24 LEU MD1 1 85 TYR QE 1.800 . 4.800 2.873 2.324 4.439 . 0 0 "[ . 1 . 2]" 1
217 1 24 LEU MD1 1 87 SER QB 1.800 . 4.190 2.925 1.795 4.148 0.005 12 0 "[ . 1 . 2]" 1
218 1 24 LEU MD2 1 25 LYS H 1.800 . 4.280 3.305 1.757 4.287 0.043 17 0 "[ . 1 . 2]" 1
219 1 24 LEU MD2 1 28 GLU HB3 1.800 . 4.400 2.893 2.234 3.314 . 0 0 "[ . 1 . 2]" 1
220 1 24 LEU MD2 1 28 GLU HB2 1.800 . 4.400 3.604 2.600 4.445 0.045 6 0 "[ . 1 . 2]" 1
221 1 24 LEU MD2 1 28 GLU QG 1.800 . 4.260 2.936 1.783 4.307 0.047 10 0 "[ . 1 . 2]" 1
222 1 24 LEU MD2 1 28 GLU H 1.800 . 6.000 4.824 3.224 5.188 . 0 0 "[ . 1 . 2]" 1
223 1 24 LEU MD2 1 29 THR HA 1.800 . 4.620 4.382 3.252 4.670 0.050 19 0 "[ . 1 . 2]" 1
224 1 24 LEU MD2 1 29 THR H 1.800 . 5.050 4.464 3.921 4.985 . 0 0 "[ . 1 . 2]" 1
225 1 24 LEU MD2 1 30 ALA HA 1.800 . 5.200 3.664 3.108 5.134 . 0 0 "[ . 1 . 2]" 1
226 1 24 LEU MD2 1 30 ALA MB 1.800 . 3.520 2.195 1.784 3.590 0.070 17 0 "[ . 1 . 2]" 1
227 1 24 LEU MD2 1 30 ALA H 1.800 . 4.790 3.756 2.899 4.636 . 0 0 "[ . 1 . 2]" 1
228 1 24 LEU MD2 1 85 TYR QD 1.800 . 5.000 4.031 2.203 5.020 0.020 17 0 "[ . 1 . 2]" 1
229 1 24 LEU MD2 1 85 TYR QE 1.800 . 5.000 4.690 2.326 5.066 0.066 2 0 "[ . 1 . 2]" 1
230 1 24 LEU MD2 1 87 SER QB 1.800 . 5.370 3.509 1.740 4.304 0.060 10 0 "[ . 1 . 2]" 1
231 1 25 LYS HA 1 26 VAL MG2 1.800 . 4.140 3.652 3.555 3.752 . 0 0 "[ . 1 . 2]" 1
232 1 25 LYS QB 1 26 VAL H 1.800 . 4.090 2.588 2.070 3.599 . 0 0 "[ . 1 . 2]" 1
233 1 25 LYS QE 1 25 LYS QG 1.800 . 3.480 2.269 2.123 2.384 . 0 0 "[ . 1 . 2]" 1
234 1 25 LYS QG 1 26 VAL H 1.800 . 5.200 3.737 2.161 4.379 . 0 0 "[ . 1 . 2]" 1
235 1 25 LYS H 1 25 LYS QG 1.800 . 4.790 2.913 1.930 4.001 . 0 0 "[ . 1 . 2]" 1
236 1 25 LYS H 1 28 GLU HB3 1.800 . 5.010 2.911 1.883 4.379 . 0 0 "[ . 1 . 2]" 1
237 1 25 LYS H 1 28 GLU HB2 1.800 . 5.010 2.650 2.026 3.520 . 0 0 "[ . 1 . 2]" 1
238 1 25 LYS H 1 28 GLU QG 1.800 . 4.730 2.770 1.854 3.779 . 0 0 "[ . 1 . 2]" 1
239 1 26 VAL HA 1 26 VAL MG1 1.800 . 3.510 2.379 2.331 2.444 . 0 0 "[ . 1 . 2]" 1
240 1 26 VAL HA 1 26 VAL MG2 1.800 . 3.450 2.416 2.334 2.496 . 0 0 "[ . 1 . 2]" 1
241 1 26 VAL HA 1 27 GLY H 1.800 . 3.810 2.138 2.123 2.158 . 0 0 "[ . 1 . 2]" 1
242 1 26 VAL HA 1 89 SER H 1.800 . 4.710 3.941 3.358 4.536 . 0 0 "[ . 1 . 2]" 1
243 1 26 VAL HB 1 27 GLY H 1.800 . 4.890 4.268 4.144 4.390 . 0 0 "[ . 1 . 2]" 1
244 1 26 VAL MG1 1 27 GLY QA 1.800 . 3.890 3.263 3.132 3.372 . 0 0 "[ . 1 . 2]" 1
245 1 26 VAL MG1 1 27 GLY H 1.800 . 3.490 2.902 2.675 3.028 . 0 0 "[ . 1 . 2]" 1
246 1 26 VAL MG1 1 88 ALA HA 1.800 . 3.180 2.171 1.757 2.392 0.043 10 0 "[ . 1 . 2]" 1
247 1 26 VAL MG1 1 88 ALA MB 1.800 . 3.510 3.304 2.856 3.560 0.050 6 0 "[ . 1 . 2]" 1
248 1 26 VAL MG2 1 27 GLY H 1.800 . 4.520 4.130 4.042 4.204 . 0 0 "[ . 1 . 2]" 1
249 1 26 VAL MG2 1 88 ALA HA 1.800 . 4.000 3.509 2.997 4.017 0.017 6 0 "[ . 1 . 2]" 1
250 1 26 VAL MG2 1 88 ALA MB 1.800 . 5.000 4.380 3.694 4.873 . 0 0 "[ . 1 . 2]" 1
251 1 26 VAL MG2 1 89 SER HA 1.800 . 4.600 3.222 1.882 4.342 . 0 0 "[ . 1 . 2]" 1
252 1 26 VAL MG2 1 89 SER QB 1.800 . 5.000 4.429 3.720 5.059 0.059 17 0 "[ . 1 . 2]" 1
253 1 26 VAL MG2 1 89 SER H 1.800 . 4.000 3.522 3.060 4.011 0.011 17 0 "[ . 1 . 2]" 1
254 1 26 VAL MG2 1 90 THR HA 1.800 . 4.540 3.454 2.685 4.375 . 0 0 "[ . 1 . 2]" 1
255 1 26 VAL MG2 1 90 THR H 1.800 . 5.490 3.664 2.834 4.922 . 0 0 "[ . 1 . 2]" 1
256 1 26 VAL MG2 1 91 ASP H 1.800 . 6.050 5.082 4.549 6.015 . 0 0 "[ . 1 . 2]" 1
257 1 26 VAL H 1 26 VAL HB 1.800 . 3.670 2.583 2.481 2.738 . 0 0 "[ . 1 . 2]" 1
258 1 26 VAL H 1 26 VAL MG1 1.800 . 4.600 3.779 3.761 3.795 . 0 0 "[ . 1 . 2]" 1
259 1 26 VAL H 1 26 VAL MG2 1.800 . 3.070 2.053 1.837 2.281 . 0 0 "[ . 1 . 2]" 1
260 1 27 GLY QA 1 86 THR MG 1.800 . 3.920 2.961 2.393 3.937 0.017 14 0 "[ . 1 . 2]" 1
261 1 27 GLY H 1 28 GLU H 1.800 . 4.210 2.333 2.121 2.567 . 0 0 "[ . 1 . 2]" 1
262 1 27 GLY H 1 86 THR MG 1.800 . 3.960 3.509 2.947 3.987 0.027 17 0 "[ . 1 . 2]" 1
263 1 27 GLY H 1 88 ALA MB 1.800 . 5.430 4.441 3.973 4.769 . 0 0 "[ . 1 . 2]" 1
264 1 28 GLU HA 1 28 GLU HG3 1.800 . 4.180 3.201 2.447 3.729 . 0 0 "[ . 1 . 2]" 1
265 1 28 GLU HA 1 28 GLU HG2 1.800 . 4.180 3.271 2.446 3.789 . 0 0 "[ . 1 . 2]" 1
266 1 28 GLU HA 1 29 THR HB 1.800 . 5.400 4.658 4.556 4.754 . 0 0 "[ . 1 . 2]" 1
267 1 28 GLU HA 1 29 THR H 1.800 . 3.400 2.245 2.126 2.392 . 0 0 "[ . 1 . 2]" 1
268 1 28 GLU QB 1 86 THR MG 1.800 . 6.050 4.924 4.469 5.420 . 0 0 "[ . 1 . 2]" 1
269 1 28 GLU HB3 1 29 THR H 1.800 . 5.020 3.517 2.667 4.184 . 0 0 "[ . 1 . 2]" 1
270 1 28 GLU HB2 1 29 THR H 1.800 . 5.020 4.059 3.825 4.328 . 0 0 "[ . 1 . 2]" 1
271 1 28 GLU H 1 28 GLU HG3 1.800 . 5.160 4.023 2.429 4.511 . 0 0 "[ . 1 . 2]" 1
272 1 28 GLU H 1 28 GLU HG2 1.800 . 5.160 3.937 2.486 4.717 . 0 0 "[ . 1 . 2]" 1
273 1 28 GLU H 1 29 THR H 1.800 . 5.360 4.564 4.484 4.611 . 0 0 "[ . 1 . 2]" 1
274 1 28 GLU H 1 86 THR MG 1.800 . 4.990 4.109 3.561 4.905 . 0 0 "[ . 1 . 2]" 1
275 1 29 THR HA 1 29 THR MG 1.800 . 3.750 2.350 2.263 2.414 . 0 0 "[ . 1 . 2]" 1
276 1 29 THR HA 1 30 ALA MB 1.800 . 4.730 4.007 3.950 4.064 . 0 0 "[ . 1 . 2]" 1
277 1 29 THR HA 1 85 TYR H 1.800 . 5.530 4.565 4.219 4.855 . 0 0 "[ . 1 . 2]" 1
278 1 29 THR HA 1 86 THR HA 1.800 . 4.100 2.203 1.804 2.576 . 0 0 "[ . 1 . 2]" 1
279 1 29 THR HA 1 86 THR MG 1.800 . 4.460 3.530 3.182 3.898 . 0 0 "[ . 1 . 2]" 1
280 1 29 THR HB 1 30 ALA H 1.800 . 5.250 4.224 3.976 4.345 . 0 0 "[ . 1 . 2]" 1
281 1 29 THR MG 1 30 ALA H 1.800 . 3.930 2.882 2.388 3.183 . 0 0 "[ . 1 . 2]" 1
282 1 29 THR MG 1 31 GLU HA 1.800 . 4.490 3.900 3.467 4.196 . 0 0 "[ . 1 . 2]" 1
283 1 29 THR MG 1 31 GLU H 1.800 . 5.090 4.137 3.659 4.501 . 0 0 "[ . 1 . 2]" 1
284 1 29 THR MG 1 84 TYR HA 1.800 . 4.540 3.054 2.781 3.384 . 0 0 "[ . 1 . 2]" 1
285 1 29 THR MG 1 84 TYR QB 1.800 . 3.470 2.265 1.922 2.666 . 0 0 "[ . 1 . 2]" 1
286 1 29 THR MG 1 84 TYR QD 1.800 . 3.650 2.221 1.813 2.659 . 0 0 "[ . 1 . 2]" 1
287 1 29 THR MG 1 84 TYR QE 1.800 . 4.660 3.968 3.392 4.440 . 0 0 "[ . 1 . 2]" 1
288 1 29 THR MG 1 85 TYR HA 1.800 . 5.210 4.176 3.608 4.611 . 0 0 "[ . 1 . 2]" 1
289 1 29 THR MG 1 85 TYR H 1.800 . 3.980 3.230 2.852 3.661 . 0 0 "[ . 1 . 2]" 1
290 1 29 THR MG 1 86 THR MG 1.800 . 5.420 3.726 3.194 4.141 . 0 0 "[ . 1 . 2]" 1
291 1 29 THR H 1 29 THR HB 1.800 . 3.760 2.670 2.571 2.809 . 0 0 "[ . 1 . 2]" 1
292 1 29 THR H 1 29 THR MG 1.800 . 4.700 3.867 3.822 3.928 . 0 0 "[ . 1 . 2]" 1
293 1 29 THR H 1 30 ALA H 1.800 . 5.200 4.275 4.118 4.491 . 0 0 "[ . 1 . 2]" 1
294 1 30 ALA HA 1 31 GLU H 1.800 . 3.450 2.157 2.129 2.192 . 0 0 "[ . 1 . 2]" 1
295 1 30 ALA MB 1 31 GLU HA 1.800 . 4.960 4.321 4.261 4.400 . 0 0 "[ . 1 . 2]" 1
296 1 30 ALA MB 1 31 GLU H 1.800 . 3.950 3.241 3.085 3.499 . 0 0 "[ . 1 . 2]" 1
297 1 30 ALA MB 1 32 ILE MD 1.800 . 4.510 3.517 3.063 4.022 . 0 0 "[ . 1 . 2]" 1
298 1 30 ALA MB 1 32 ILE QG 1.800 . 4.870 3.041 2.768 3.295 . 0 0 "[ . 1 . 2]" 1
299 1 30 ALA MB 1 84 TYR HA 1.800 . 5.830 4.797 4.566 5.063 . 0 0 "[ . 1 . 2]" 1
300 1 30 ALA MB 1 85 TYR HB3 1.800 . 4.960 2.369 1.864 2.914 . 0 0 "[ . 1 . 2]" 1
301 1 30 ALA MB 1 85 TYR HB2 1.800 . 4.960 3.890 3.427 4.409 . 0 0 "[ . 1 . 2]" 1
302 1 30 ALA MB 1 85 TYR QD 1.800 . 4.660 2.762 2.280 3.295 . 0 0 "[ . 1 . 2]" 1
303 1 30 ALA MB 1 85 TYR H 1.800 . 4.230 3.395 3.158 3.749 . 0 0 "[ . 1 . 2]" 1
304 1 30 ALA MB 1 86 THR H 1.800 . 5.750 5.607 5.195 5.836 0.086 10 0 "[ . 1 . 2]" 1
305 1 30 ALA MB 1 113 PHE QE 1.800 . 4.570 3.606 3.143 4.579 0.009 6 0 "[ . 1 . 2]" 1
306 1 30 ALA MB 1 113 PHE HZ 1.800 . 4.200 4.098 3.673 4.340 0.140 17 0 "[ . 1 . 2]" 1
307 1 30 ALA H 1 31 GLU H 1.800 . 5.440 4.366 4.154 4.473 . 0 0 "[ . 1 . 2]" 1
308 1 30 ALA H 1 85 TYR H 1.800 . 4.310 3.271 2.998 3.694 . 0 0 "[ . 1 . 2]" 1
309 1 30 ALA H 1 86 THR HA 1.800 . 5.220 3.535 3.236 3.829 . 0 0 "[ . 1 . 2]" 1
310 1 31 GLU HA 1 83 LEU H 1.800 . 5.830 4.482 3.938 4.876 . 0 0 "[ . 1 . 2]" 1
311 1 31 GLU HA 1 84 TYR HA 1.800 . 4.600 2.622 2.225 2.973 . 0 0 "[ . 1 . 2]" 1
312 1 31 GLU HA 1 84 TYR QD 1.800 . 4.760 3.488 3.092 4.034 . 0 0 "[ . 1 . 2]" 1
313 1 31 GLU HA 1 85 TYR H 1.800 . 5.320 3.590 3.194 3.989 . 0 0 "[ . 1 . 2]" 1
314 1 31 GLU QB 1 84 TYR QE 1.800 . 4.350 3.050 2.356 4.344 . 0 0 "[ . 1 . 2]" 1
315 1 31 GLU QG 1 32 ILE H 1.800 . 4.740 3.626 2.985 4.448 . 0 0 "[ . 1 . 2]" 1
316 1 31 GLU QG 1 82 ARG QB 1.800 . 4.920 3.117 1.958 4.524 . 0 0 "[ . 1 . 2]" 1
317 1 31 GLU QG 1 82 ARG QD 1.800 . 4.930 3.898 2.376 4.957 0.027 15 0 "[ . 1 . 2]" 1
318 1 31 GLU QG 1 84 TYR QE 1.800 . 4.330 3.062 2.117 4.338 0.008 6 0 "[ . 1 . 2]" 1
319 1 31 GLU H 1 31 GLU HB3 1.800 . 4.100 2.715 2.455 3.638 . 0 0 "[ . 1 . 2]" 1
320 1 31 GLU H 1 31 GLU HB2 1.800 . 4.100 2.790 2.237 3.646 . 0 0 "[ . 1 . 2]" 1
321 1 31 GLU H 1 31 GLU QG 1.800 . 5.090 3.543 1.932 4.019 . 0 0 "[ . 1 . 2]" 1
322 1 31 GLU H 1 32 ILE H 1.800 . 5.100 4.240 4.171 4.389 . 0 0 "[ . 1 . 2]" 1
323 1 32 ILE HA 1 32 ILE MD 1.800 . 4.940 3.880 3.849 3.913 . 0 0 "[ . 1 . 2]" 1
324 1 32 ILE HA 1 32 ILE MG 1.800 . 3.770 2.337 2.309 2.370 . 0 0 "[ . 1 . 2]" 1
325 1 32 ILE HA 1 33 ARG H 1.800 . 3.720 2.192 2.150 2.239 . 0 0 "[ . 1 . 2]" 1
326 1 32 ILE HB 1 32 ILE MD 1.800 . 3.780 2.425 2.392 2.451 . 0 0 "[ . 1 . 2]" 1
327 1 32 ILE HB 1 83 LEU MD1 1.800 . 4.860 3.103 2.518 3.482 . 0 0 "[ . 1 . 2]" 1
328 1 32 ILE MD 1 60 LEU MD1 1.800 . 3.860 2.928 2.514 3.658 . 0 0 "[ . 1 . 2]" 1
329 1 32 ILE MD 1 83 LEU QB 1.800 . 5.280 2.883 2.343 3.310 . 0 0 "[ . 1 . 2]" 1
330 1 32 ILE MD 1 83 LEU MD1 1.800 . 4.140 3.274 2.845 3.729 . 0 0 "[ . 1 . 2]" 1
331 1 32 ILE MD 1 85 TYR HB3 1.800 . 4.270 3.204 2.708 3.690 . 0 0 "[ . 1 . 2]" 1
332 1 32 ILE MD 1 85 TYR HB2 1.800 . 4.270 2.860 2.497 3.603 . 0 0 "[ . 1 . 2]" 1
333 1 32 ILE MD 1 85 TYR QD 1.800 . 5.420 3.947 3.489 4.499 . 0 0 "[ . 1 . 2]" 1
334 1 32 ILE MD 1 85 TYR H 1.800 . 4.760 4.049 3.774 4.449 . 0 0 "[ . 1 . 2]" 1
335 1 32 ILE MD 1 97 VAL MG2 1.800 . 4.740 3.950 3.575 4.347 . 0 0 "[ . 1 . 2]" 1
336 1 32 ILE MD 1 111 PHE QD 1.800 . 4.220 3.824 3.357 4.169 . 0 0 "[ . 1 . 2]" 1
337 1 32 ILE MD 1 113 PHE QE 1.800 . 4.860 3.450 2.284 4.879 0.019 8 0 "[ . 1 . 2]" 1
338 1 32 ILE MD 1 113 PHE HZ 1.800 . 4.510 2.556 1.817 4.243 . 0 0 "[ . 1 . 2]" 1
339 1 32 ILE MD 1 32 ILE MG 1.800 . 3.260 1.944 1.906 1.983 . 0 0 "[ . 1 . 2]" 1
340 1 32 ILE QG 1 32 ILE MG 1.800 . 4.260 2.317 2.270 2.335 . 0 0 "[ . 1 . 2]" 1
341 1 32 ILE MG 1 33 ARG H 1.800 . 4.170 3.299 3.193 3.352 . 0 0 "[ . 1 . 2]" 1
342 1 32 ILE MG 1 34 CYS H 1.800 . 5.700 4.359 4.100 4.743 . 0 0 "[ . 1 . 2]" 1
343 1 32 ILE MG 1 83 LEU MD1 1.800 . 4.280 3.035 2.196 3.576 . 0 0 "[ . 1 . 2]" 1
344 1 32 ILE MG 1 83 LEU H 1.800 . 5.470 4.058 3.708 4.317 . 0 0 "[ . 1 . 2]" 1
345 1 32 ILE MG 1 99 PHE QE 1.800 . 6.000 5.110 4.705 5.430 . 0 0 "[ . 1 . 2]" 1
346 1 32 ILE MG 1 109 LEU MD1 1.800 . 5.000 4.485 3.687 5.038 0.038 19 0 "[ . 1 . 2]" 1
347 1 32 ILE H 1 32 ILE MD 1.800 . 4.700 3.690 3.550 3.867 . 0 0 "[ . 1 . 2]" 1
348 1 32 ILE H 1 32 ILE HG13 1.800 . 5.330 2.272 2.072 2.555 . 0 0 "[ . 1 . 2]" 1
349 1 32 ILE H 1 32 ILE HG12 1.800 . 5.330 3.508 3.296 3.733 . 0 0 "[ . 1 . 2]" 1
350 1 32 ILE H 1 32 ILE MG 1.800 . 4.820 3.812 3.780 3.854 . 0 0 "[ . 1 . 2]" 1
351 1 32 ILE H 1 33 ARG H 1.800 . 4.940 4.159 4.053 4.247 . 0 0 "[ . 1 . 2]" 1
352 1 32 ILE H 1 83 LEU H 1.800 . 4.880 3.237 2.975 3.533 . 0 0 "[ . 1 . 2]" 1
353 1 32 ILE H 1 84 TYR HA 1.800 . 5.330 3.379 3.192 3.621 . 0 0 "[ . 1 . 2]" 1
354 1 33 ARG HA 1 33 ARG QD 1.800 . 4.570 4.049 3.935 4.210 . 0 0 "[ . 1 . 2]" 1
355 1 33 ARG HA 1 33 ARG QG 1.800 . 3.970 2.433 2.324 2.565 . 0 0 "[ . 1 . 2]" 1
356 1 33 ARG HA 1 82 ARG HA 1.800 . 4.710 2.356 2.028 2.959 . 0 0 "[ . 1 . 2]" 1
357 1 33 ARG QB 1 33 ARG QD 1.800 . 3.520 2.222 2.101 2.475 . 0 0 "[ . 1 . 2]" 1
358 1 33 ARG QD 1 34 CYS H 1.800 . 5.370 5.215 4.799 5.543 0.173 16 0 "[ . 1 . 2]" 1
359 1 33 ARG H 1 33 ARG QD 1.800 . 5.190 4.214 3.606 5.014 . 0 0 "[ . 1 . 2]" 1
360 1 33 ARG H 1 33 ARG QG 1.800 . 5.060 3.026 2.178 4.013 . 0 0 "[ . 1 . 2]" 1
361 1 33 ARG H 1 34 CYS H 1.800 . 5.150 4.446 4.366 4.541 . 0 0 "[ . 1 . 2]" 1
362 1 34 CYS HA 1 35 GLN H 1.800 . 3.360 2.179 2.132 2.273 . 0 0 "[ . 1 . 2]" 1
363 1 34 CYS HB3 1 35 GLN H 1.800 . 4.680 3.384 2.926 4.199 . 0 0 "[ . 1 . 2]" 1
364 1 34 CYS HB2 1 35 GLN H 1.800 . 4.680 4.087 3.861 4.269 . 0 0 "[ . 1 . 2]" 1
365 1 34 CYS H 1 34 CYS QB 1.800 . 3.900 2.585 2.399 2.705 . 0 0 "[ . 1 . 2]" 1
366 1 34 CYS H 1 82 ARG HA 1.800 . 4.000 2.953 2.718 3.111 . 0 0 "[ . 1 . 2]" 1
367 1 35 GLN HA 1 35 GLN HG3 1.800 . 4.230 2.959 2.444 3.767 . 0 0 "[ . 1 . 2]" 1
368 1 35 GLN HA 1 35 GLN HG2 1.800 . 4.230 3.108 2.361 3.775 . 0 0 "[ . 1 . 2]" 1
369 1 35 GLN HA 1 36 LEU H 1.800 . 3.690 2.130 2.101 2.182 . 0 0 "[ . 1 . 2]" 1
370 1 35 GLN QB 1 36 LEU H 1.800 . 4.600 3.767 3.289 3.922 . 0 0 "[ . 1 . 2]" 1
371 1 35 GLN QE 1 79 GLU QB 1.800 . 6.040 4.616 2.474 6.136 0.096 20 0 "[ . 1 . 2]" 1
372 1 35 GLN HE21 1 80 THR MG 1.800 . 5.120 3.449 2.151 5.183 0.063 10 0 "[ . 1 . 2]" 1
373 1 35 GLN HE22 1 80 THR MG 1.800 . 5.120 3.570 1.905 5.144 0.024 15 0 "[ . 1 . 2]" 1
374 1 35 GLN QG 1 36 LEU H 1.800 . 4.540 3.494 2.804 4.647 0.107 8 0 "[ . 1 . 2]" 1
375 1 35 GLN QG 1 80 THR HA 1.800 . 4.610 3.649 2.181 4.758 0.148 4 0 "[ . 1 . 2]" 1
376 1 35 GLN QG 1 80 THR MG 1.800 . 5.280 3.354 1.794 5.295 0.015 3 0 "[ . 1 . 2]" 1
377 1 35 GLN H 1 35 GLN HB3 1.800 . 3.980 2.943 2.563 3.760 . 0 0 "[ . 1 . 2]" 1
378 1 35 GLN H 1 35 GLN HB2 1.800 . 3.980 2.917 2.535 3.357 . 0 0 "[ . 1 . 2]" 1
379 1 35 GLN H 1 35 GLN QG 1.800 . 4.970 3.872 2.800 4.241 . 0 0 "[ . 1 . 2]" 1
380 1 35 GLN H 1 36 LEU H 1.800 . 4.950 4.158 4.005 4.261 . 0 0 "[ . 1 . 2]" 1
381 1 36 LEU HA 1 36 LEU MD1 1.800 . 4.000 3.442 2.516 3.688 . 0 0 "[ . 1 . 2]" 1
382 1 36 LEU HA 1 36 LEU MD2 1.800 . 5.000 3.401 3.107 3.928 . 0 0 "[ . 1 . 2]" 1
383 1 36 LEU HA 1 36 LEU HG 1.800 . 4.180 2.523 2.376 2.798 . 0 0 "[ . 1 . 2]" 1
384 1 36 LEU HA 1 37 HIS H 1.800 . 3.630 2.140 2.106 2.170 . 0 0 "[ . 1 . 2]" 1
385 1 36 LEU QB 1 36 LEU MD1 1.800 . 3.400 2.079 2.053 2.153 . 0 0 "[ . 1 . 2]" 1
386 1 36 LEU QB 1 79 GLU QB 1.800 . 5.260 2.458 1.778 3.646 0.022 18 0 "[ . 1 . 2]" 1
387 1 36 LEU QB 1 79 GLU HG3 1.800 . 4.820 3.920 2.576 4.698 . 0 0 "[ . 1 . 2]" 1
388 1 36 LEU QB 1 79 GLU HG2 1.800 . 4.820 4.136 3.016 4.840 0.020 12 0 "[ . 1 . 2]" 1
389 1 36 LEU HB3 1 36 LEU MD2 1.800 . 4.370 2.202 2.118 2.260 . 0 0 "[ . 1 . 2]" 1
390 1 36 LEU HB3 1 79 GLU HA 1.800 . 4.550 2.515 1.807 3.245 . 0 0 "[ . 1 . 2]" 1
391 1 36 LEU HB3 1 79 GLU QB 1.800 . 5.310 2.488 1.787 3.734 0.013 18 0 "[ . 1 . 2]" 1
392 1 36 LEU HB2 1 36 LEU MD2 1.800 . 4.370 3.088 2.694 3.180 . 0 0 "[ . 1 . 2]" 1
393 1 36 LEU HB2 1 79 GLU HA 1.800 . 4.550 3.435 2.960 4.048 . 0 0 "[ . 1 . 2]" 1
394 1 36 LEU HB2 1 79 GLU QB 1.800 . 5.310 3.948 3.022 5.096 . 0 0 "[ . 1 . 2]" 1
395 1 36 LEU MD1 1 37 HIS H 1.800 . 4.680 4.463 3.070 4.765 0.085 16 0 "[ . 1 . 2]" 1
396 1 36 LEU MD1 1 47 TYR QD 1.800 . 4.210 2.907 2.296 3.380 . 0 0 "[ . 1 . 2]" 1
397 1 36 LEU MD1 1 47 TYR QE 1.800 . 4.710 2.929 2.427 3.587 . 0 0 "[ . 1 . 2]" 1
398 1 36 LEU MD1 1 76 LEU MD1 1.800 . 4.100 3.303 2.260 4.166 0.066 18 0 "[ . 1 . 2]" 1
399 1 36 LEU MD1 1 79 GLU HA 1.800 . 4.600 3.654 2.727 4.325 . 0 0 "[ . 1 . 2]" 1
400 1 36 LEU MD2 1 37 HIS HA 1.800 . 4.730 3.698 3.016 4.861 0.131 11 0 "[ . 1 . 2]" 1
401 1 36 LEU MD2 1 37 HIS H 1.800 . 4.420 3.342 2.789 4.445 0.025 11 0 "[ . 1 . 2]" 1
402 1 36 LEU MD2 1 38 ARG HA 1.800 . 4.740 3.462 2.582 4.518 . 0 0 "[ . 1 . 2]" 1
403 1 36 LEU MD2 1 38 ARG QB 1.800 . 5.000 2.524 1.823 3.828 . 0 0 "[ . 1 . 2]" 1
404 1 36 LEU MD2 1 38 ARG QD 1.800 . 3.790 3.047 2.270 4.027 0.237 5 0 "[ . 1 . 2]" 1
405 1 36 LEU MD2 1 38 ARG HE 1.800 . 5.410 4.234 2.406 5.456 0.046 6 0 "[ . 1 . 2]" 1
406 1 36 LEU MD2 1 38 ARG QG 1.800 . 4.480 2.895 1.808 4.124 . 0 0 "[ . 1 . 2]" 1
407 1 36 LEU MD2 1 47 TYR QD 1.800 . 4.390 3.917 3.128 4.419 0.029 1 0 "[ . 1 . 2]" 1
408 1 36 LEU MD2 1 47 TYR QE 1.800 . 4.400 2.879 2.084 3.318 . 0 0 "[ . 1 . 2]" 1
409 1 36 LEU MD2 1 79 GLU HA 1.800 . 4.310 3.455 2.400 4.397 0.087 5 0 "[ . 1 . 2]" 1
410 1 36 LEU MD2 1 79 GLU QB 1.800 . 4.190 3.016 1.992 3.953 . 0 0 "[ . 1 . 2]" 1
411 1 36 LEU MD2 1 79 GLU HG3 1.800 . 4.510 3.613 1.770 4.519 0.030 11 0 "[ . 1 . 2]" 1
412 1 36 LEU MD2 1 79 GLU HG2 1.800 . 4.510 3.651 2.488 4.547 0.037 2 0 "[ . 1 . 2]" 1
413 1 36 LEU HG 1 37 HIS H 1.800 . 4.520 3.105 2.357 3.348 . 0 0 "[ . 1 . 2]" 1
414 1 36 LEU HG 1 38 ARG H 1.800 . 5.470 5.206 3.865 5.546 0.076 20 0 "[ . 1 . 2]" 1
415 1 36 LEU H 1 36 LEU MD1 1.800 . 5.600 4.315 4.212 4.416 . 0 0 "[ . 1 . 2]" 1
416 1 36 LEU H 1 36 LEU MD2 1.800 . 5.000 4.112 4.015 4.198 . 0 0 "[ . 1 . 2]" 1
417 1 36 LEU H 1 36 LEU HG 1.800 . 5.250 4.500 4.356 4.578 . 0 0 "[ . 1 . 2]" 1
418 1 36 LEU H 1 79 GLU HA 1.800 . 5.200 3.521 2.969 4.007 . 0 0 "[ . 1 . 2]" 1
419 1 36 LEU H 1 79 GLU QB 1.800 . 5.130 3.149 2.346 3.709 . 0 0 "[ . 1 . 2]" 1
420 1 36 LEU H 1 79 GLU QG 1.800 . 6.050 4.729 4.067 5.308 . 0 0 "[ . 1 . 2]" 1
421 1 37 HIS HA 1 38 ARG H 1.800 . 3.210 2.147 2.088 2.185 . 0 0 "[ . 1 . 2]" 1
422 1 37 HIS QB 1 38 ARG H 1.800 . 4.600 3.679 3.362 3.973 . 0 0 "[ . 1 . 2]" 1
423 1 38 ARG HA 1 39 ASP H 1.800 . 3.480 2.218 2.107 2.552 . 0 0 "[ . 1 . 2]" 1
424 1 38 ARG QB 1 38 ARG HE 1.800 . 5.000 3.087 2.070 4.138 . 0 0 "[ . 1 . 2]" 1
425 1 38 ARG QB 1 39 ASP H 1.800 . 4.150 3.323 2.014 3.961 . 0 0 "[ . 1 . 2]" 1
426 1 38 ARG QD 1 47 TYR QE 1.800 . 5.000 3.489 1.755 5.038 0.045 19 0 "[ . 1 . 2]" 1
427 1 38 ARG QG 1 39 ASP H 1.800 . 4.770 3.619 2.209 4.456 . 0 0 "[ . 1 . 2]" 1
428 1 38 ARG H 1 38 ARG QD 1.800 . 5.810 4.274 1.809 4.920 . 0 0 "[ . 1 . 2]" 1
429 1 38 ARG H 1 38 ARG QG 1.800 . 4.280 3.128 1.881 4.217 . 0 0 "[ . 1 . 2]" 1
430 1 39 ASP QB 1 40 GLY H 1.800 . 3.920 2.709 1.857 3.929 0.009 16 0 "[ . 1 . 2]" 1
431 1 39 ASP QB 1 41 ARG H 1.800 . 5.430 4.798 3.581 5.538 0.108 13 0 "[ . 1 . 2]" 1
432 1 39 ASP H 1 39 ASP QB 1.800 . 3.530 2.365 2.224 2.795 . 0 0 "[ . 1 . 2]" 1
433 1 39 ASP H 1 40 GLY H 1.800 . 4.440 2.991 1.970 4.585 0.145 1 0 "[ . 1 . 2]" 1
434 1 40 GLY QA 1 41 ARG H 1.800 . 3.430 2.349 2.095 2.951 . 0 0 "[ . 1 . 2]" 1
435 1 40 GLY H 1 41 ARG H 1.800 . 4.420 3.683 1.950 4.460 0.040 5 0 "[ . 1 . 2]" 1
436 1 41 ARG HA 1 41 ARG QD 1.800 . 5.250 3.486 1.820 4.268 . 0 0 "[ . 1 . 2]" 1
437 1 41 ARG HA 1 41 ARG QG 1.800 . 3.850 2.593 2.285 3.349 . 0 0 "[ . 1 . 2]" 1
438 1 41 ARG HA 1 42 PHE H 1.800 . 3.890 2.669 2.084 3.584 . 0 0 "[ . 1 . 2]" 1
439 1 41 ARG QB 1 41 ARG QD 1.800 . 3.030 2.310 2.079 2.795 . 0 0 "[ . 1 . 2]" 1
440 1 41 ARG QB 1 41 ARG HE 1.800 . 5.190 3.160 1.898 4.040 . 0 0 "[ . 1 . 2]" 1
441 1 41 ARG QB 1 42 PHE H 1.800 . 4.110 3.118 1.708 4.051 0.092 1 0 "[ . 1 . 2]" 1
442 1 41 ARG QG 1 42 PHE H 1.800 . 4.580 3.927 2.415 4.699 0.119 6 0 "[ . 1 . 2]" 1
443 1 41 ARG H 1 41 ARG QB 1.800 . 3.400 2.676 2.224 3.420 0.020 7 0 "[ . 1 . 2]" 1
444 1 41 ARG H 1 41 ARG HD3 1.800 . 6.050 4.958 3.724 6.116 0.066 11 0 "[ . 1 . 2]" 1
445 1 41 ARG H 1 41 ARG HD2 1.800 . 6.050 5.051 3.942 6.092 0.042 1 0 "[ . 1 . 2]" 1
446 1 41 ARG H 1 42 PHE QD 1.800 . 6.000 4.820 3.302 6.082 0.082 15 0 "[ . 1 . 2]" 1
447 1 42 PHE HA 1 42 PHE QD 1.800 . 4.270 3.103 2.039 3.752 . 0 0 "[ . 1 . 2]" 1
448 1 42 PHE QB 1 43 GLU H 1.800 . 3.940 3.046 1.768 3.932 0.032 3 0 "[ . 1 . 2]" 1
449 1 42 PHE QD 1 43 GLU H 1.800 . 4.640 4.099 2.535 4.784 0.144 6 0 "[ . 1 . 2]" 1
450 1 42 PHE QD 1 45 THR HB 1.800 . 5.650 4.332 2.763 5.734 0.084 20 0 "[ . 1 . 2]" 1
451 1 42 PHE QD 1 45 THR MG 1.800 . 5.650 4.194 1.998 5.694 0.044 18 0 "[ . 1 . 2]" 1
452 1 42 PHE H 1 42 PHE QB 1.800 . 3.800 2.811 2.375 3.419 . 0 0 "[ . 1 . 2]" 1
453 1 42 PHE H 1 42 PHE QD 1.800 . 4.150 3.104 2.310 4.264 0.114 9 0 "[ . 1 . 2]" 1
454 1 43 GLU HA 1 44 GLU H 1.800 . 3.610 2.949 2.151 3.562 . 0 0 "[ . 1 . 2]" 1
455 1 43 GLU H 1 43 GLU QB 1.800 . 3.600 2.696 2.267 3.376 . 0 0 "[ . 1 . 2]" 1
456 1 43 GLU H 1 44 GLU H 1.800 . 5.270 3.544 1.746 4.662 0.054 18 0 "[ . 1 . 2]" 1
457 1 44 GLU HA 1 44 GLU QG 1.800 . 3.870 2.707 2.203 3.531 . 0 0 "[ . 1 . 2]" 1
458 1 44 GLU HA 1 45 THR H 1.800 . 3.330 2.771 2.174 3.452 0.122 18 0 "[ . 1 . 2]" 1
459 1 44 GLU HB3 1 45 THR H 1.800 . 5.150 4.250 4.030 4.449 . 0 0 "[ . 1 . 2]" 1
460 1 44 GLU HB2 1 45 THR H 1.800 . 5.150 4.249 3.800 4.579 . 0 0 "[ . 1 . 2]" 1
461 1 44 GLU QG 1 45 THR H 1.800 . 5.180 4.082 2.192 4.921 . 0 0 "[ . 1 . 2]" 1
462 1 44 GLU H 1 44 GLU QB 1.800 . 3.230 2.743 2.268 3.289 0.059 17 0 "[ . 1 . 2]" 1
463 1 44 GLU H 1 44 GLU QG 1.800 . 3.590 2.676 1.881 3.783 0.193 1 0 "[ . 1 . 2]" 1
464 1 44 GLU H 1 45 THR H 1.800 . 3.620 2.997 1.972 3.710 0.090 11 0 "[ . 1 . 2]" 1
465 1 45 THR HA 1 45 THR MG 1.800 . 3.450 2.627 2.163 3.222 . 0 0 "[ . 1 . 2]" 1
466 1 45 THR HA 1 46 LYS H 1.800 . 3.500 2.255 2.117 2.787 . 0 0 "[ . 1 . 2]" 1
467 1 45 THR MG 1 46 LYS H 1.800 . 4.000 3.292 2.398 3.908 . 0 0 "[ . 1 . 2]" 1
468 1 45 THR MG 1 47 TYR QD 1.800 . 5.010 4.000 3.325 5.042 0.032 18 0 "[ . 1 . 2]" 1
469 1 45 THR MG 1 47 TYR QE 1.800 . 4.150 3.277 2.089 4.198 0.048 8 0 "[ . 1 . 2]" 1
470 1 45 THR MG 1 101 ASP HA 1.800 . 5.480 4.339 3.056 5.299 . 0 0 "[ . 1 . 2]" 1
471 1 45 THR MG 1 102 SER QB 1.800 . 5.000 3.297 1.743 5.022 0.057 1 0 "[ . 1 . 2]" 1
472 1 45 THR MG 1 102 SER H 1.800 . 3.940 3.144 2.152 3.998 0.058 3 0 "[ . 1 . 2]" 1
473 1 45 THR MG 1 103 PHE H 1.800 . 4.840 3.672 2.640 4.680 . 0 0 "[ . 1 . 2]" 1
474 1 45 THR H 1 45 THR HB 1.800 . 3.860 2.773 2.449 3.505 . 0 0 "[ . 1 . 2]" 1
475 1 45 THR H 1 45 THR MG 1.800 . 4.390 3.051 1.797 3.964 0.003 6 0 "[ . 1 . 2]" 1
476 1 46 LYS HA 1 46 LYS QD 1.800 . 4.500 3.524 1.975 4.243 . 0 0 "[ . 1 . 2]" 1
477 1 46 LYS HA 1 46 LYS HG3 1.800 . 4.220 2.999 2.216 3.794 . 0 0 "[ . 1 . 2]" 1
478 1 46 LYS HA 1 46 LYS HG2 1.800 . 4.220 2.925 2.493 3.695 . 0 0 "[ . 1 . 2]" 1
479 1 46 LYS HA 1 47 TYR H 1.800 . 3.610 2.179 2.121 2.362 . 0 0 "[ . 1 . 2]" 1
480 1 46 LYS QB 1 47 TYR H 1.800 . 4.020 3.047 2.534 3.540 . 0 0 "[ . 1 . 2]" 1
481 1 46 LYS QB 1 102 SER QB 1.800 . 4.540 3.479 1.855 4.465 . 0 0 "[ . 1 . 2]" 1
482 1 46 LYS HB3 1 46 LYS QE 1.800 . 5.460 3.603 1.967 4.541 . 0 0 "[ . 1 . 2]" 1
483 1 46 LYS HB2 1 46 LYS QE 1.800 . 5.460 3.600 1.767 4.490 0.033 1 0 "[ . 1 . 2]" 1
484 1 46 LYS QD 1 102 SER QB 1.800 . 6.050 4.756 3.069 6.069 0.019 4 0 "[ . 1 . 2]" 1
485 1 46 LYS QE 1 46 LYS QG 1.800 . 3.310 2.329 2.115 2.755 . 0 0 "[ . 1 . 2]" 1
486 1 46 LYS QG 1 47 TYR H 1.800 . 5.320 4.095 3.198 4.785 . 0 0 "[ . 1 . 2]" 1
487 1 46 LYS H 1 46 LYS HB3 1.800 . 4.280 3.641 3.503 3.753 . 0 0 "[ . 1 . 2]" 1
488 1 46 LYS H 1 46 LYS HB2 1.800 . 4.280 2.475 2.240 2.620 . 0 0 "[ . 1 . 2]" 1
489 1 46 LYS H 1 46 LYS QG 1.800 . 3.820 2.790 2.230 3.838 0.018 20 0 "[ . 1 . 2]" 1
490 1 46 LYS H 1 102 SER QB 1.800 . 4.590 2.956 2.103 3.931 . 0 0 "[ . 1 . 2]" 1
491 1 47 TYR HA 1 47 TYR QD 1.800 . 5.060 2.741 2.514 3.044 . 0 0 "[ . 1 . 2]" 1
492 1 47 TYR HA 1 48 PHE H 1.800 . 3.700 2.221 2.120 2.395 . 0 0 "[ . 1 . 2]" 1
493 1 47 TYR HA 1 101 ASP HA 1.800 . 4.640 2.700 2.213 3.476 . 0 0 "[ . 1 . 2]" 1
494 1 47 TYR QB 1 76 LEU MD2 1.800 . 5.280 4.076 3.928 4.283 . 0 0 "[ . 1 . 2]" 1
495 1 47 TYR QB 1 76 LEU H 1.800 . 5.670 3.188 2.666 3.665 . 0 0 "[ . 1 . 2]" 1
496 1 47 TYR QB 1 100 GLN H 1.800 . 5.950 4.685 4.131 5.415 . 0 0 "[ . 1 . 2]" 1
497 1 47 TYR HB3 1 48 PHE H 1.800 . 4.470 3.082 2.526 3.449 . 0 0 "[ . 1 . 2]" 1
498 1 47 TYR HB3 1 76 LEU MD1 1.800 . 4.790 2.128 1.778 2.954 0.022 8 0 "[ . 1 . 2]" 1
499 1 47 TYR HB2 1 48 PHE H 1.800 . 4.470 3.936 3.456 4.235 . 0 0 "[ . 1 . 2]" 1
500 1 47 TYR HB2 1 76 LEU MD1 1.800 . 4.790 2.361 1.836 3.091 . 0 0 "[ . 1 . 2]" 1
501 1 47 TYR QD 1 48 PHE H 1.800 . 4.820 4.195 3.812 4.612 . 0 0 "[ . 1 . 2]" 1
502 1 47 TYR QD 1 76 LEU MD1 1.800 . 5.090 3.574 3.149 3.860 . 0 0 "[ . 1 . 2]" 1
503 1 47 TYR QD 1 101 ASP HA 1.800 . 6.000 3.160 2.084 4.260 . 0 0 "[ . 1 . 2]" 1
504 1 47 TYR QD 1 102 SER H 1.800 . 5.370 4.528 3.641 5.397 0.027 10 0 "[ . 1 . 2]" 1
505 1 47 TYR H 1 47 TYR QD 1.800 . 4.380 2.768 2.288 3.117 . 0 0 "[ . 1 . 2]" 1
506 1 47 TYR H 1 48 PHE H 1.800 . 5.040 4.483 4.383 4.545 . 0 0 "[ . 1 . 2]" 1
507 1 47 TYR H 1 76 LEU H 1.800 . 4.620 3.744 3.352 4.093 . 0 0 "[ . 1 . 2]" 1
508 1 48 PHE HA 1 48 PHE QD 1.800 . 4.890 2.711 2.470 2.843 . 0 0 "[ . 1 . 2]" 1
509 1 48 PHE HA 1 49 ILE MG 1.800 . 4.430 3.604 3.475 3.817 . 0 0 "[ . 1 . 2]" 1
510 1 48 PHE HA 1 73 LEU MD1 1.800 . 5.260 4.087 3.638 5.186 . 0 0 "[ . 1 . 2]" 1
511 1 48 PHE HA 1 73 LEU MD2 1.800 . 5.320 4.540 3.067 5.438 0.118 12 0 "[ . 1 . 2]" 1
512 1 48 PHE HA 1 75 PRO HA 1.800 . 4.330 2.372 2.086 2.553 . 0 0 "[ . 1 . 2]" 1
513 1 48 PHE HA 1 76 LEU MD1 1.800 . 5.830 4.288 3.880 4.679 . 0 0 "[ . 1 . 2]" 1
514 1 48 PHE HA 1 76 LEU MD2 1.800 . 5.430 4.625 4.167 5.013 . 0 0 "[ . 1 . 2]" 1
515 1 48 PHE HA 1 76 LEU HG 1.800 . 5.270 3.386 2.876 3.816 . 0 0 "[ . 1 . 2]" 1
516 1 48 PHE HA 1 76 LEU H 1.800 . 4.050 3.083 2.617 3.532 . 0 0 "[ . 1 . 2]" 1
517 1 48 PHE QB 1 73 LEU QB 1.800 . 6.050 3.757 1.794 4.532 0.006 8 0 "[ . 1 . 2]" 1
518 1 48 PHE QB 1 73 LEU MD1 1.800 . 5.000 2.016 1.744 2.900 0.056 2 0 "[ . 1 . 2]" 1
519 1 48 PHE QB 1 73 LEU MD2 1.800 . 4.000 2.485 1.777 3.533 0.023 7 0 "[ . 1 . 2]" 1
520 1 48 PHE QB 1 73 LEU HG 1.800 . 5.040 2.683 1.980 4.390 . 0 0 "[ . 1 . 2]" 1
521 1 48 PHE QB 1 100 GLN H 1.800 . 5.420 3.555 2.968 4.010 . 0 0 "[ . 1 . 2]" 1
522 1 48 PHE HB3 1 49 ILE H 1.800 . 4.710 2.979 2.612 3.437 . 0 0 "[ . 1 . 2]" 1
523 1 48 PHE HB2 1 49 ILE H 1.800 . 4.710 4.000 3.763 4.270 . 0 0 "[ . 1 . 2]" 1
524 1 48 PHE QD 1 49 ILE MG 1.800 . 5.430 4.978 4.622 5.232 . 0 0 "[ . 1 . 2]" 1
525 1 48 PHE QD 1 49 ILE H 1.800 . 5.290 3.886 3.486 4.274 . 0 0 "[ . 1 . 2]" 1
526 1 48 PHE QD 1 73 LEU MD1 1.800 . 4.680 3.583 3.233 4.044 . 0 0 "[ . 1 . 2]" 1
527 1 48 PHE QD 1 73 LEU MD2 1.800 . 4.300 3.294 1.971 4.307 0.007 8 0 "[ . 1 . 2]" 1
528 1 48 PHE QD 1 74 TYR HA 1.800 . 4.800 4.295 3.559 4.806 0.006 7 0 "[ . 1 . 2]" 1
529 1 48 PHE QD 1 75 PRO HA 1.800 . 4.610 2.701 2.077 3.210 . 0 0 "[ . 1 . 2]" 1
530 1 48 PHE QD 1 75 PRO QB 1.800 . 4.710 3.327 2.859 4.065 . 0 0 "[ . 1 . 2]" 1
531 1 48 PHE QD 1 76 LEU H 1.800 . 4.890 4.542 3.939 4.903 0.013 1 0 "[ . 1 . 2]" 1
532 1 48 PHE H 1 48 PHE QD 1.800 . 4.210 3.069 2.861 3.281 . 0 0 "[ . 1 . 2]" 1
533 1 48 PHE H 1 76 LEU MD1 1.800 . 4.810 3.901 3.250 4.473 . 0 0 "[ . 1 . 2]" 1
534 1 48 PHE H 1 76 LEU HG 1.800 . 5.290 4.436 4.052 4.806 . 0 0 "[ . 1 . 2]" 1
535 1 48 PHE H 1 100 GLN QB 1.800 . 5.500 4.055 3.088 4.887 . 0 0 "[ . 1 . 2]" 1
536 1 48 PHE H 1 100 GLN QG 1.800 . 5.870 3.722 2.754 4.891 . 0 0 "[ . 1 . 2]" 1
537 1 48 PHE H 1 101 ASP HA 1.800 . 4.620 3.476 2.838 4.204 . 0 0 "[ . 1 . 2]" 1
538 1 49 ILE HA 1 49 ILE MD 1.800 . 4.510 3.802 3.705 3.849 . 0 0 "[ . 1 . 2]" 1
539 1 49 ILE HA 1 76 LEU MD1 1.800 . 5.620 4.010 3.463 4.654 . 0 0 "[ . 1 . 2]" 1
540 1 49 ILE HA 1 76 LEU MD2 1.800 . 5.180 4.297 3.809 5.045 . 0 0 "[ . 1 . 2]" 1
541 1 49 ILE HA 1 97 VAL MG1 1.800 . 5.620 4.416 3.880 4.916 . 0 0 "[ . 1 . 2]" 1
542 1 49 ILE HA 1 98 TYR H 1.800 . 5.800 4.951 4.619 5.350 . 0 0 "[ . 1 . 2]" 1
543 1 49 ILE HA 1 99 PHE HA 1.800 . 4.550 2.749 2.534 3.068 . 0 0 "[ . 1 . 2]" 1
544 1 49 ILE HA 1 99 PHE QD 1.800 . 5.700 3.529 2.612 4.751 . 0 0 "[ . 1 . 2]" 1
545 1 49 ILE HA 1 100 GLN H 1.800 . 4.790 3.435 3.058 3.704 . 0 0 "[ . 1 . 2]" 1
546 1 49 ILE HB 1 49 ILE MD 1.800 . 3.630 2.431 2.354 2.473 . 0 0 "[ . 1 . 2]" 1
547 1 49 ILE HB 1 50 ARG H 1.800 . 4.840 4.119 4.069 4.189 . 0 0 "[ . 1 . 2]" 1
548 1 49 ILE HB 1 76 LEU MD1 1.800 . 4.170 2.665 2.143 3.249 . 0 0 "[ . 1 . 2]" 1
549 1 49 ILE HB 1 76 LEU MD2 1.800 . 3.860 2.132 1.758 2.906 0.042 3 0 "[ . 1 . 2]" 1
550 1 49 ILE HB 1 99 PHE QD 1.800 . 4.950 3.041 2.622 3.695 . 0 0 "[ . 1 . 2]" 1
551 1 49 ILE MD 1 50 ARG H 1.800 . 4.860 4.203 4.064 4.370 . 0 0 "[ . 1 . 2]" 1
552 1 49 ILE MD 1 62 MET ME 1.800 . 4.570 3.936 3.042 4.638 0.068 3 0 "[ . 1 . 2]" 1
553 1 49 ILE MD 1 68 LEU MD1 1.800 . 3.830 2.311 1.886 3.543 . 0 0 "[ . 1 . 2]" 1
554 1 49 ILE MD 1 68 LEU MD2 1.800 . 3.840 3.358 2.644 3.895 0.055 16 0 "[ . 1 . 2]" 1
555 1 49 ILE MD 1 76 LEU MD2 1.800 . 4.200 2.380 2.020 2.733 . 0 0 "[ . 1 . 2]" 1
556 1 49 ILE MD 1 83 LEU MD1 1.800 . 2.930 2.436 2.063 2.843 . 0 0 "[ . 1 . 2]" 1
557 1 49 ILE MD 1 83 LEU MD2 1.800 . 3.980 2.526 2.086 3.282 . 0 0 "[ . 1 . 2]" 1
558 1 49 ILE MD 1 83 LEU HG 1.800 . 4.990 4.189 3.801 4.593 . 0 0 "[ . 1 . 2]" 1
559 1 49 ILE MD 1 97 VAL MG1 1.800 . 3.900 2.600 1.940 3.199 . 0 0 "[ . 1 . 2]" 1
560 1 49 ILE MD 1 99 PHE QD 1.800 . 4.270 3.478 2.940 4.057 . 0 0 "[ . 1 . 2]" 1
561 1 49 ILE MD 1 99 PHE HZ 1.800 . 4.500 3.276 2.881 3.712 . 0 0 "[ . 1 . 2]" 1
562 1 49 ILE QG 1 50 ARG HA 1.800 . 5.270 3.380 3.081 3.971 . 0 0 "[ . 1 . 2]" 1
563 1 49 ILE QG 1 50 ARG H 1.800 . 4.060 2.526 2.380 2.700 . 0 0 "[ . 1 . 2]" 1
564 1 49 ILE QG 1 97 VAL MG1 1.800 . 4.660 2.622 2.286 3.104 . 0 0 "[ . 1 . 2]" 1
565 1 49 ILE QG 1 99 PHE QD 1.800 . 4.700 3.266 2.941 3.611 . 0 0 "[ . 1 . 2]" 1
566 1 49 ILE MG 1 50 ARG HA 1.800 . 5.310 3.834 3.482 4.140 . 0 0 "[ . 1 . 2]" 1
567 1 49 ILE MG 1 50 ARG H 1.800 . 4.930 3.916 3.704 4.070 . 0 0 "[ . 1 . 2]" 1
568 1 49 ILE MG 1 62 MET QB 1.800 . 5.570 4.475 3.685 5.344 . 0 0 "[ . 1 . 2]" 1
569 1 49 ILE MG 1 62 MET ME 1.800 . 4.000 3.070 2.283 3.867 . 0 0 "[ . 1 . 2]" 1
570 1 49 ILE MG 1 68 LEU MD2 1.800 . 5.000 2.677 2.079 3.186 . 0 0 "[ . 1 . 2]" 1
571 1 49 ILE MG 1 74 TYR HB3 1.800 . 5.570 3.391 3.137 4.117 . 0 0 "[ . 1 . 2]" 1
572 1 49 ILE MG 1 74 TYR HB2 1.800 . 5.570 2.300 1.937 2.823 . 0 0 "[ . 1 . 2]" 1
573 1 49 ILE MG 1 74 TYR QD 1.800 . 4.710 3.317 2.606 3.957 . 0 0 "[ . 1 . 2]" 1
574 1 49 ILE MG 1 74 TYR H 1.800 . 4.230 2.959 2.469 3.392 . 0 0 "[ . 1 . 2]" 1
575 1 49 ILE MG 1 75 PRO HA 1.800 . 5.520 4.072 3.699 4.636 . 0 0 "[ . 1 . 2]" 1
576 1 49 ILE MG 1 76 LEU MD2 1.800 . 4.000 2.223 1.982 2.506 . 0 0 "[ . 1 . 2]" 1
577 1 49 ILE MG 1 76 LEU H 1.800 . 5.170 4.148 3.744 4.556 . 0 0 "[ . 1 . 2]" 1
578 1 49 ILE MG 1 77 PRO QD 1.800 . 5.380 4.504 4.123 4.886 . 0 0 "[ . 1 . 2]" 1
579 1 49 ILE MG 1 99 PHE HA 1.800 . 6.050 5.206 4.821 5.431 . 0 0 "[ . 1 . 2]" 1
580 1 49 ILE H 1 49 ILE QG 1.800 . 4.930 4.056 3.998 4.144 . 0 0 "[ . 1 . 2]" 1
581 1 49 ILE H 1 49 ILE MG 1.800 . 3.520 2.091 1.883 2.353 . 0 0 "[ . 1 . 2]" 1
582 1 49 ILE H 1 68 LEU MD2 1.800 . 5.700 5.367 4.489 5.841 0.141 12 0 "[ . 1 . 2]" 1
583 1 49 ILE H 1 73 LEU MD1 1.800 . 5.800 3.641 2.848 5.400 . 0 0 "[ . 1 . 2]" 1
584 1 49 ILE H 1 73 LEU MD2 1.800 . 6.000 4.612 3.413 5.572 . 0 0 "[ . 1 . 2]" 1
585 1 49 ILE H 1 74 TYR H 1.800 . 4.550 3.113 2.744 3.452 . 0 0 "[ . 1 . 2]" 1
586 1 49 ILE H 1 75 PRO HA 1.800 . 5.170 3.655 3.395 3.956 . 0 0 "[ . 1 . 2]" 1
587 1 49 ILE H 1 76 LEU HG 1.800 . 4.950 3.471 3.179 3.930 . 0 0 "[ . 1 . 2]" 1
588 1 49 ILE H 1 76 LEU H 1.800 . 6.050 4.316 3.925 4.800 . 0 0 "[ . 1 . 2]" 1
589 1 50 ARG HA 1 68 LEU MD2 1.800 . 6.000 5.076 3.467 5.993 . 0 0 "[ . 1 . 2]" 1
590 1 50 ARG QB 1 73 LEU HA 1.800 . 4.980 2.929 2.089 4.447 . 0 0 "[ . 1 . 2]" 1
591 1 50 ARG QB 1 73 LEU MD1 1.800 . 4.500 2.501 1.812 4.494 . 0 0 "[ . 1 . 2]" 1
592 1 50 ARG QB 1 73 LEU MD2 1.800 . 4.830 3.796 1.765 4.628 0.035 8 0 "[ . 1 . 2]" 1
593 1 50 ARG HB3 1 50 ARG HE 1.800 . 5.370 3.021 1.849 4.703 . 0 0 "[ . 1 . 2]" 1
594 1 50 ARG HB2 1 50 ARG HE 1.800 . 5.370 3.554 2.097 4.642 . 0 0 "[ . 1 . 2]" 1
595 1 50 ARG QD 1 73 LEU QB 1.800 . 4.840 3.358 2.703 4.551 . 0 0 "[ . 1 . 2]" 1
596 1 50 ARG QD 1 73 LEU MD1 1.800 . 4.420 2.887 1.795 4.425 0.005 7 0 "[ . 1 . 2]" 1
597 1 50 ARG QD 1 73 LEU MD2 1.800 . 5.000 3.830 1.940 4.799 . 0 0 "[ . 1 . 2]" 1
598 1 50 ARG HE 1 73 LEU MD1 1.800 . 4.690 3.863 1.780 4.790 0.100 4 0 "[ . 1 . 2]" 1
599 1 50 ARG HE 1 73 LEU MD2 1.800 . 6.000 4.933 2.422 6.047 0.047 11 0 "[ . 1 . 2]" 1
600 1 50 ARG QG 1 98 TYR QD 1.800 . 5.180 3.222 1.945 4.540 . 0 0 "[ . 1 . 2]" 1
601 1 50 ARG H 1 73 LEU MD1 1.800 . 6.000 4.289 3.452 6.069 0.069 8 0 "[ . 1 . 2]" 1
602 1 50 ARG H 1 97 VAL MG1 1.800 . 5.460 3.797 3.177 4.246 . 0 0 "[ . 1 . 2]" 1
603 1 50 ARG H 1 98 TYR H 1.800 . 4.740 3.287 2.985 3.615 . 0 0 "[ . 1 . 2]" 1
604 1 50 ARG H 1 99 PHE HA 1.800 . 5.320 3.805 3.328 4.301 . 0 0 "[ . 1 . 2]" 1
605 1 51 TYR HA 1 97 VAL HA 1.800 . 4.310 2.384 1.905 2.894 . 0 0 "[ . 1 . 2]" 1
606 1 51 TYR HA 1 97 VAL MG2 1.800 . 5.060 3.848 3.028 4.427 . 0 0 "[ . 1 . 2]" 1
607 1 51 TYR HA 1 98 TYR QD 1.800 . 4.270 2.790 2.257 3.484 . 0 0 "[ . 1 . 2]" 1
608 1 51 TYR HA 1 98 TYR QE 1.800 . 5.220 3.999 3.357 4.630 . 0 0 "[ . 1 . 2]" 1
609 1 51 TYR HA 1 98 TYR H 1.800 . 4.860 2.756 2.103 3.282 . 0 0 "[ . 1 . 2]" 1
610 1 51 TYR QB 1 52 PHE H 1.800 . 4.050 2.708 2.367 3.555 . 0 0 "[ . 1 . 2]" 1
611 1 51 TYR QB 1 60 LEU MD2 1.800 . 3.930 3.111 2.422 3.962 0.032 16 0 "[ . 1 . 2]" 1
612 1 51 TYR QB 1 95 VAL MG1 1.800 . 4.430 2.840 2.250 4.308 . 0 0 "[ . 1 . 2]" 1
613 1 51 TYR QB 1 97 VAL MG1 1.800 . 5.000 3.052 1.908 4.859 . 0 0 "[ . 1 . 2]" 1
614 1 51 TYR QB 1 98 TYR QD 1.800 . 5.150 4.551 3.989 5.052 . 0 0 "[ . 1 . 2]" 1
615 1 51 TYR HB3 1 97 VAL HA 1.800 . 5.360 3.209 2.254 4.934 . 0 0 "[ . 1 . 2]" 1
616 1 51 TYR HB2 1 97 VAL HA 1.800 . 5.360 3.536 1.879 5.401 0.041 12 0 "[ . 1 . 2]" 1
617 1 51 TYR H 1 68 LEU QB 1.800 . 6.050 4.889 3.775 5.879 . 0 0 "[ . 1 . 2]" 1
618 1 52 PHE HA 1 52 PHE QD 1.800 . 4.400 2.619 2.087 2.829 . 0 0 "[ . 1 . 2]" 1
619 1 52 PHE HA 1 53 GLN H 1.800 . 3.780 2.169 2.125 2.224 . 0 0 "[ . 1 . 2]" 1
620 1 52 PHE QB 1 98 TYR QE 1.800 . 3.990 2.166 1.805 2.838 . 0 0 "[ . 1 . 2]" 1
621 1 52 PHE QD 1 53 GLN H 1.800 . 4.590 3.491 2.597 3.920 . 0 0 "[ . 1 . 2]" 1
622 1 52 PHE QD 1 54 PRO QD 1.800 . 4.290 2.734 2.229 3.364 . 0 0 "[ . 1 . 2]" 1
623 1 52 PHE QD 1 54 PRO HG3 1.800 . 4.950 3.028 2.248 3.953 . 0 0 "[ . 1 . 2]" 1
624 1 52 PHE QD 1 54 PRO HG2 1.800 . 4.950 4.432 3.792 5.000 0.050 11 0 "[ . 1 . 2]" 1
625 1 52 PHE QD 1 70 PRO HB3 1.800 . 5.270 4.064 2.253 5.162 . 0 0 "[ . 1 . 2]" 1
626 1 52 PHE QD 1 70 PRO HB2 1.800 . 5.270 4.113 2.993 5.275 0.005 13 0 "[ . 1 . 2]" 1
627 1 52 PHE H 1 95 VAL MG1 1.800 . 5.070 3.765 3.154 4.393 . 0 0 "[ . 1 . 2]" 1
628 1 52 PHE H 1 96 ASP QB 1.800 . 5.050 3.200 2.457 4.708 . 0 0 "[ . 1 . 2]" 1
629 1 52 PHE H 1 96 ASP H 1.800 . 4.710 3.341 2.973 3.696 . 0 0 "[ . 1 . 2]" 1
630 1 52 PHE H 1 97 VAL HA 1.800 . 4.910 3.547 2.828 4.145 . 0 0 "[ . 1 . 2]" 1
631 1 52 PHE H 1 97 VAL MG2 1.800 . 5.650 4.373 3.768 4.846 . 0 0 "[ . 1 . 2]" 1
632 1 52 PHE H 1 98 TYR QD 1.800 . 4.750 3.642 2.882 4.220 . 0 0 "[ . 1 . 2]" 1
633 1 52 PHE H 1 98 TYR QE 1.800 . 5.210 3.338 2.680 3.963 . 0 0 "[ . 1 . 2]" 1
634 1 53 GLN HA 1 55 ASP H 1.800 . 4.850 3.567 3.113 3.974 . 0 0 "[ . 1 . 2]" 1
635 1 53 GLN HA 1 95 VAL HA 1.800 . 4.920 2.879 2.250 3.638 . 0 0 "[ . 1 . 2]" 1
636 1 53 GLN HA 1 96 ASP H 1.800 . 5.140 3.365 2.674 3.914 . 0 0 "[ . 1 . 2]" 1
637 1 53 GLN H 1 53 GLN HB3 1.800 . 4.290 3.189 2.611 3.829 . 0 0 "[ . 1 . 2]" 1
638 1 53 GLN H 1 53 GLN HB2 1.800 . 4.290 3.206 2.422 3.870 . 0 0 "[ . 1 . 2]" 1
639 1 53 GLN H 1 53 GLN QG 1.800 . 5.290 2.977 2.013 4.183 . 0 0 "[ . 1 . 2]" 1
640 1 54 PRO QB 1 55 ASP H 1.800 . 4.320 2.910 2.329 3.569 . 0 0 "[ . 1 . 2]" 1
641 1 54 PRO QD 1 55 ASP H 1.800 . 4.210 2.451 2.062 2.737 . 0 0 "[ . 1 . 2]" 1
642 1 54 PRO QD 1 96 ASP H 1.800 . 5.000 3.235 2.792 4.051 . 0 0 "[ . 1 . 2]" 1
643 1 54 PRO QG 1 94 THR MG 1.800 . 4.380 3.019 2.350 4.240 . 0 0 "[ . 1 . 2]" 1
644 1 54 PRO HG3 1 55 ASP H 1.800 . 4.540 4.263 3.610 4.594 0.054 18 0 "[ . 1 . 2]" 1
645 1 54 PRO HG3 1 94 THR HB 1.800 . 5.000 4.553 3.444 5.014 0.014 4 0 "[ . 1 . 2]" 1
646 1 54 PRO HG2 1 55 ASP H 1.800 . 4.540 3.412 2.017 4.232 . 0 0 "[ . 1 . 2]" 1
647 1 54 PRO HG2 1 94 THR HB 1.800 . 5.000 3.020 1.984 3.677 . 0 0 "[ . 1 . 2]" 1
648 1 55 ASP HA 1 56 GLY H 1.800 . 3.330 2.488 2.108 3.515 0.185 12 0 "[ . 1 . 2]" 1
649 1 55 ASP QB 1 56 GLY H 1.800 . 4.390 3.123 1.835 4.003 . 0 0 "[ . 1 . 2]" 1
650 1 55 ASP QB 1 94 THR HB 1.800 . 5.000 3.540 1.784 4.867 0.016 13 0 "[ . 1 . 2]" 1
651 1 55 ASP QB 1 94 THR H 1.800 . 4.400 3.139 2.062 4.324 . 0 0 "[ . 1 . 2]" 1
652 1 55 ASP H 1 56 GLY H 1.800 . 5.120 3.943 1.891 4.643 . 0 0 "[ . 1 . 2]" 1
653 1 55 ASP H 1 94 THR HB 1.800 . 4.310 3.573 2.532 4.369 0.059 6 0 "[ . 1 . 2]" 1
654 1 55 ASP H 1 94 THR MG 1.800 . 5.420 4.727 3.867 5.447 0.027 10 0 "[ . 1 . 2]" 1
655 1 55 ASP H 1 94 THR H 1.800 . 5.300 3.860 3.420 5.045 . 0 0 "[ . 1 . 2]" 1
656 1 56 GLY H 1 57 ALA H 1.800 . 4.960 3.782 2.210 4.532 . 0 0 "[ . 1 . 2]" 1
657 1 57 ALA HA 1 58 GLY H 1.800 . 2.940 2.351 2.144 2.901 . 0 0 "[ . 1 . 2]" 1
658 1 57 ALA MB 1 58 GLY H 1.800 . 3.540 2.956 1.790 3.583 0.043 12 0 "[ . 1 . 2]" 1
659 1 57 ALA MB 1 89 SER HB3 1.800 . 4.130 3.404 1.777 4.204 0.074 18 0 "[ . 1 . 2]" 1
660 1 57 ALA MB 1 89 SER HB2 1.800 . 4.130 3.360 1.770 4.317 0.187 17 0 "[ . 1 . 2]" 1
661 1 57 ALA H 1 58 GLY H 1.800 . 4.820 4.056 3.399 4.446 . 0 0 "[ . 1 . 2]" 1
662 1 57 ALA H 1 89 SER QB 1.800 . 5.000 3.886 2.407 5.097 0.097 11 0 "[ . 1 . 2]" 1
663 1 58 GLY HA3 1 85 TYR QE 1.800 . 6.050 2.794 1.950 3.823 . 0 0 "[ . 1 . 2]" 1
664 1 58 GLY HA3 1 88 ALA MB 1.800 . 4.260 3.685 2.476 4.295 0.035 15 0 "[ . 1 . 2]" 1
665 1 58 GLY HA3 1 88 ALA H 1.800 . 4.990 3.238 1.952 4.029 . 0 0 "[ . 1 . 2]" 1
666 1 58 GLY HA2 1 85 TYR QE 1.800 . 6.050 4.147 3.439 4.975 . 0 0 "[ . 1 . 2]" 1
667 1 58 GLY HA2 1 88 ALA MB 1.800 . 4.260 2.469 1.952 3.249 . 0 0 "[ . 1 . 2]" 1
668 1 58 GLY HA2 1 88 ALA H 1.800 . 4.990 2.612 2.002 3.529 . 0 0 "[ . 1 . 2]" 1
669 1 58 GLY H 1 59 THR H 1.800 . 4.710 4.241 3.769 4.517 . 0 0 "[ . 1 . 2]" 1
670 1 58 GLY H 1 85 TYR QE 1.800 . 6.030 4.388 2.398 5.771 . 0 0 "[ . 1 . 2]" 1
671 1 58 GLY H 1 88 ALA MB 1.800 . 4.990 3.640 2.276 4.977 . 0 0 "[ . 1 . 2]" 1
672 1 58 GLY H 1 88 ALA H 1.800 . 5.040 4.487 3.441 5.110 0.070 5 0 "[ . 1 . 2]" 1
673 1 59 THR HA 1 59 THR MG 1.800 . 3.340 2.359 2.290 2.450 . 0 0 "[ . 1 . 2]" 1
674 1 59 THR HA 1 60 LEU H 1.800 . 3.690 2.167 2.146 2.233 . 0 0 "[ . 1 . 2]" 1
675 1 59 THR HB 1 60 LEU H 1.800 . 4.750 4.236 3.883 4.402 . 0 0 "[ . 1 . 2]" 1
676 1 59 THR HB 1 86 THR HB 1.800 . 4.150 2.162 1.844 2.845 . 0 0 "[ . 1 . 2]" 1
677 1 59 THR HB 1 86 THR MG 1.800 . 4.160 3.577 3.287 4.197 0.037 17 0 "[ . 1 . 2]" 1
678 1 59 THR HB 1 86 THR H 1.800 . 4.860 3.479 3.095 3.806 . 0 0 "[ . 1 . 2]" 1
679 1 59 THR MG 1 60 LEU H 1.800 . 3.640 2.903 2.424 3.096 . 0 0 "[ . 1 . 2]" 1
680 1 59 THR MG 1 61 LYS QD 1.800 . 4.750 3.630 2.434 4.556 . 0 0 "[ . 1 . 2]" 1
681 1 59 THR MG 1 61 LYS QE 1.800 . 3.630 2.837 2.171 3.767 0.137 20 0 "[ . 1 . 2]" 1
682 1 59 THR MG 1 86 THR HB 1.800 . 4.570 3.702 2.947 4.322 . 0 0 "[ . 1 . 2]" 1
683 1 59 THR MG 1 86 THR MG 1.800 . 5.950 4.425 3.748 5.121 . 0 0 "[ . 1 . 2]" 1
684 1 59 THR MG 1 86 THR H 1.800 . 4.990 4.168 3.645 4.461 . 0 0 "[ . 1 . 2]" 1
685 1 59 THR H 1 59 THR HB 1.800 . 4.140 2.672 2.567 2.967 . 0 0 "[ . 1 . 2]" 1
686 1 59 THR H 1 59 THR MG 1.800 . 4.800 3.857 3.792 3.993 . 0 0 "[ . 1 . 2]" 1
687 1 59 THR H 1 60 LEU H 1.800 . 5.190 4.283 4.033 4.510 . 0 0 "[ . 1 . 2]" 1
688 1 59 THR H 1 86 THR HB 1.800 . 4.760 2.967 2.553 3.631 . 0 0 "[ . 1 . 2]" 1
689 1 59 THR H 1 86 THR MG 1.800 . 5.050 4.014 3.701 4.540 . 0 0 "[ . 1 . 2]" 1
690 1 59 THR H 1 86 THR H 1.800 . 4.510 3.400 3.088 3.837 . 0 0 "[ . 1 . 2]" 1
691 1 59 THR H 1 88 ALA MB 1.800 . 4.940 3.727 2.910 4.917 . 0 0 "[ . 1 . 2]" 1
692 1 59 THR H 1 88 ALA H 1.800 . 5.200 4.142 3.396 5.238 0.038 5 0 "[ . 1 . 2]" 1
693 1 60 LEU HA 1 60 LEU MD1 1.800 . 3.450 2.061 1.989 2.118 . 0 0 "[ . 1 . 2]" 1
694 1 60 LEU HA 1 60 LEU MD2 1.800 . 4.860 3.868 3.833 3.893 . 0 0 "[ . 1 . 2]" 1
695 1 60 LEU HA 1 61 LYS H 1.800 . 3.580 2.141 2.103 2.181 . 0 0 "[ . 1 . 2]" 1
696 1 60 LEU HA 1 85 TYR HA 1.800 . 4.610 2.276 2.037 2.601 . 0 0 "[ . 1 . 2]" 1
697 1 60 LEU HA 1 85 TYR QD 1.800 . 5.910 2.995 2.521 3.950 . 0 0 "[ . 1 . 2]" 1
698 1 60 LEU HA 1 86 THR H 1.800 . 4.770 3.251 2.981 3.510 . 0 0 "[ . 1 . 2]" 1
699 1 60 LEU QB 1 67 VAL MG1 1.800 . 5.200 4.679 4.079 5.169 . 0 0 "[ . 1 . 2]" 1
700 1 60 LEU HB3 1 60 LEU MD2 1.800 . 4.500 2.322 2.291 2.363 . 0 0 "[ . 1 . 2]" 1
701 1 60 LEU HB2 1 60 LEU MD2 1.800 . 4.500 2.377 2.305 2.407 . 0 0 "[ . 1 . 2]" 1
702 1 60 LEU MD1 1 61 LYS H 1.800 . 3.830 2.517 2.135 2.794 . 0 0 "[ . 1 . 2]" 1
703 1 60 LEU MD1 1 83 LEU QB 1.800 . 4.440 1.994 1.761 2.762 0.039 17 0 "[ . 1 . 2]" 1
704 1 60 LEU MD1 1 84 TYR H 1.800 . 4.360 3.353 2.915 3.918 . 0 0 "[ . 1 . 2]" 1
705 1 60 LEU MD1 1 85 TYR HA 1.800 . 3.860 2.480 2.202 2.729 . 0 0 "[ . 1 . 2]" 1
706 1 60 LEU MD1 1 85 TYR HB3 1.800 . 5.240 3.591 3.243 3.974 . 0 0 "[ . 1 . 2]" 1
707 1 60 LEU MD1 1 85 TYR HB2 1.800 . 5.240 2.137 1.771 2.598 0.029 17 0 "[ . 1 . 2]" 1
708 1 60 LEU MD1 1 85 TYR QD 1.800 . 3.940 2.426 2.019 2.825 . 0 0 "[ . 1 . 2]" 1
709 1 60 LEU MD1 1 85 TYR QE 1.800 . 5.050 4.355 4.029 4.778 . 0 0 "[ . 1 . 2]" 1
710 1 60 LEU MD1 1 85 TYR H 1.800 . 4.810 3.472 3.116 3.872 . 0 0 "[ . 1 . 2]" 1
711 1 60 LEU MD1 1 86 THR H 1.800 . 4.600 4.149 3.801 4.456 . 0 0 "[ . 1 . 2]" 1
712 1 60 LEU MD2 1 61 LYS H 1.800 . 4.970 4.701 4.446 4.920 . 0 0 "[ . 1 . 2]" 1
713 1 60 LEU MD2 1 68 LEU MD1 1.800 . 4.100 2.525 2.172 3.308 . 0 0 "[ . 1 . 2]" 1
714 1 60 LEU MD2 1 83 LEU MD1 1.800 . 4.260 2.679 1.943 4.110 . 0 0 "[ . 1 . 2]" 1
715 1 60 LEU MD2 1 83 LEU MD2 1.800 . 5.260 3.390 2.893 4.188 . 0 0 "[ . 1 . 2]" 1
716 1 60 LEU MD2 1 85 TYR QD 1.800 . 6.020 3.661 3.109 4.152 . 0 0 "[ . 1 . 2]" 1
717 1 60 LEU MD2 1 85 TYR QE 1.800 . 5.400 4.747 4.039 5.444 0.044 14 0 "[ . 1 . 2]" 1
718 1 60 LEU MD2 1 95 VAL MG1 1.800 . 3.870 2.943 2.380 3.646 . 0 0 "[ . 1 . 2]" 1
719 1 60 LEU MD2 1 97 VAL MG2 1.800 . 4.410 3.087 2.316 4.268 . 0 0 "[ . 1 . 2]" 1
720 1 60 LEU HG 1 61 LYS HA 1.800 . 6.050 4.029 3.727 4.247 . 0 0 "[ . 1 . 2]" 1
721 1 60 LEU HG 1 61 LYS H 1.800 . 4.230 3.374 3.021 3.693 . 0 0 "[ . 1 . 2]" 1
722 1 60 LEU H 1 60 LEU MD1 1.800 . 5.170 4.259 4.187 4.355 . 0 0 "[ . 1 . 2]" 1
723 1 60 LEU H 1 60 LEU MD2 1.800 . 5.330 4.399 4.304 4.513 . 0 0 "[ . 1 . 2]" 1
724 1 60 LEU H 1 67 VAL MG1 1.800 . 5.190 3.856 3.076 4.606 . 0 0 "[ . 1 . 2]" 1
725 1 61 LYS HA 1 61 LYS QD 1.800 . 5.170 3.995 3.831 4.069 . 0 0 "[ . 1 . 2]" 1
726 1 61 LYS HA 1 62 MET H 1.800 . 3.610 2.271 2.186 2.362 . 0 0 "[ . 1 . 2]" 1
727 1 61 LYS HA 1 67 VAL HA 1.800 . 4.040 2.347 2.107 2.646 . 0 0 "[ . 1 . 2]" 1
728 1 61 LYS HA 1 67 VAL MG1 1.800 . 4.820 3.879 3.568 4.073 . 0 0 "[ . 1 . 2]" 1
729 1 61 LYS HA 1 67 VAL MG2 1.800 . 4.210 3.868 3.658 4.188 . 0 0 "[ . 1 . 2]" 1
730 1 61 LYS HA 1 68 LEU MD1 1.800 . 3.920 3.700 3.104 3.961 0.041 19 0 "[ . 1 . 2]" 1
731 1 61 LYS HA 1 68 LEU HG 1.800 . 5.490 2.888 2.398 3.732 . 0 0 "[ . 1 . 2]" 1
732 1 61 LYS HA 1 68 LEU H 1.800 . 4.180 2.655 2.408 2.938 . 0 0 "[ . 1 . 2]" 1
733 1 61 LYS QB 1 61 LYS QE 1.800 . 4.500 2.925 1.902 3.652 . 0 0 "[ . 1 . 2]" 1
734 1 61 LYS QB 1 62 MET H 1.800 . 3.920 2.655 2.384 2.849 . 0 0 "[ . 1 . 2]" 1
735 1 61 LYS QB 1 67 VAL HA 1.800 . 4.590 3.464 2.957 3.805 . 0 0 "[ . 1 . 2]" 1
736 1 61 LYS QB 1 84 TYR QB 1.800 . 5.000 2.381 1.917 3.010 . 0 0 "[ . 1 . 2]" 1
737 1 61 LYS QB 1 84 TYR H 1.800 . 5.470 3.554 3.137 4.051 . 0 0 "[ . 1 . 2]" 1
738 1 61 LYS HB3 1 67 VAL MG2 1.800 . 4.660 3.776 3.489 4.091 . 0 0 "[ . 1 . 2]" 1
739 1 61 LYS HB2 1 67 VAL MG2 1.800 . 4.660 4.600 4.356 4.723 0.063 13 0 "[ . 1 . 2]" 1
740 1 61 LYS QD 1 62 MET H 1.800 . 5.440 4.708 4.505 4.977 . 0 0 "[ . 1 . 2]" 1
741 1 61 LYS QD 1 65 GLY HA3 1.800 . 5.000 4.731 3.834 5.063 0.063 9 0 "[ . 1 . 2]" 1
742 1 61 LYS QD 1 65 GLY HA2 1.800 . 5.000 3.494 2.784 3.866 . 0 0 "[ . 1 . 2]" 1
743 1 61 LYS QD 1 67 VAL HA 1.800 . 4.730 4.029 3.304 4.760 0.030 19 0 "[ . 1 . 2]" 1
744 1 61 LYS QD 1 67 VAL MG2 1.800 . 4.000 2.685 1.975 3.593 . 0 0 "[ . 1 . 2]" 1
745 1 61 LYS QD 1 67 VAL H 1.800 . 5.750 4.935 3.991 5.656 . 0 0 "[ . 1 . 2]" 1
746 1 61 LYS QE 1 67 VAL MG2 1.800 . 3.820 3.070 1.868 3.902 0.082 4 0 "[ . 1 . 2]" 1
747 1 61 LYS QG 1 62 MET H 1.800 . 4.490 3.945 3.562 4.207 . 0 0 "[ . 1 . 2]" 1
748 1 61 LYS QG 1 67 VAL HA 1.800 . 5.000 2.293 1.779 2.912 0.021 18 0 "[ . 1 . 2]" 1
749 1 61 LYS QG 1 67 VAL H 1.800 . 5.060 4.243 3.688 4.846 . 0 0 "[ . 1 . 2]" 1
750 1 61 LYS QG 1 68 LEU H 1.800 . 5.080 3.680 3.117 4.175 . 0 0 "[ . 1 . 2]" 1
751 1 61 LYS HG3 1 67 VAL MG2 1.800 . 4.130 3.330 2.908 3.768 . 0 0 "[ . 1 . 2]" 1
752 1 61 LYS HG2 1 67 VAL MG2 1.800 . 4.130 2.039 1.794 2.285 0.006 1 0 "[ . 1 . 2]" 1
753 1 61 LYS H 1 61 LYS QD 1.800 . 5.970 4.416 3.847 4.937 . 0 0 "[ . 1 . 2]" 1
754 1 61 LYS H 1 61 LYS QG 1.800 . 4.430 2.855 2.479 3.360 . 0 0 "[ . 1 . 2]" 1
755 1 61 LYS H 1 67 VAL MG2 1.800 . 6.050 5.471 5.160 5.966 . 0 0 "[ . 1 . 2]" 1
756 1 61 LYS H 1 68 LEU MD1 1.800 . 5.070 4.368 3.929 4.784 . 0 0 "[ . 1 . 2]" 1
757 1 61 LYS H 1 83 LEU MD2 1.800 . 6.050 4.971 4.597 5.377 . 0 0 "[ . 1 . 2]" 1
758 1 61 LYS H 1 84 TYR QB 1.800 . 4.870 3.305 3.068 3.592 . 0 0 "[ . 1 . 2]" 1
759 1 61 LYS H 1 84 TYR H 1.800 . 4.060 3.288 3.042 3.620 . 0 0 "[ . 1 . 2]" 1
760 1 61 LYS H 1 85 TYR HA 1.800 . 4.640 3.336 2.835 3.921 . 0 0 "[ . 1 . 2]" 1
761 1 62 MET HA 1 62 MET ME 1.800 . 5.040 4.128 3.869 4.431 . 0 0 "[ . 1 . 2]" 1
762 1 62 MET HA 1 62 MET HG3 1.800 . 4.480 2.554 2.410 2.831 . 0 0 "[ . 1 . 2]" 1
763 1 62 MET HA 1 62 MET HG2 1.800 . 4.480 3.034 2.772 3.333 . 0 0 "[ . 1 . 2]" 1
764 1 62 MET HA 1 63 SER HA 1.800 . 4.960 4.314 4.251 4.373 . 0 0 "[ . 1 . 2]" 1
765 1 62 MET HA 1 63 SER H 1.800 . 3.640 2.412 2.316 2.487 . 0 0 "[ . 1 . 2]" 1
766 1 62 MET HA 1 68 LEU MD1 1.800 . 4.420 3.297 2.874 3.727 . 0 0 "[ . 1 . 2]" 1
767 1 62 MET HA 1 83 LEU HA 1.800 . 4.200 2.653 2.347 3.017 . 0 0 "[ . 1 . 2]" 1
768 1 62 MET HA 1 83 LEU QB 1.800 . 4.920 4.174 3.692 4.529 . 0 0 "[ . 1 . 2]" 1
769 1 62 MET HA 1 83 LEU MD1 1.800 . 5.210 4.945 4.498 5.248 0.038 12 0 "[ . 1 . 2]" 1
770 1 62 MET HA 1 83 LEU MD2 1.800 . 3.580 2.323 2.049 2.633 . 0 0 "[ . 1 . 2]" 1
771 1 62 MET HA 1 84 TYR H 1.800 . 4.250 3.378 3.090 3.771 . 0 0 "[ . 1 . 2]" 1
772 1 62 MET QB 1 62 MET ME 1.800 . 3.290 2.008 1.915 2.108 . 0 0 "[ . 1 . 2]" 1
773 1 62 MET QB 1 63 SER HA 1.800 . 5.950 4.905 4.464 5.068 . 0 0 "[ . 1 . 2]" 1
774 1 62 MET QB 1 66 THR H 1.800 . 5.000 2.796 2.484 3.274 . 0 0 "[ . 1 . 2]" 1
775 1 62 MET QB 1 83 LEU MD2 1.800 . 4.830 3.277 2.673 3.824 . 0 0 "[ . 1 . 2]" 1
776 1 62 MET HB3 1 63 SER H 1.800 . 4.830 3.516 2.539 3.743 . 0 0 "[ . 1 . 2]" 1
777 1 62 MET HB3 1 64 ASP H 1.800 . 4.480 2.885 2.582 3.193 . 0 0 "[ . 1 . 2]" 1
778 1 62 MET HB3 1 66 THR HB 1.800 . 4.930 2.433 2.093 3.654 . 0 0 "[ . 1 . 2]" 1
779 1 62 MET HB3 1 66 THR MG 1.800 . 5.270 4.027 3.764 4.909 . 0 0 "[ . 1 . 2]" 1
780 1 62 MET HB3 1 68 LEU MD1 1.800 . 4.420 4.095 3.508 4.432 0.012 20 0 "[ . 1 . 2]" 1
781 1 62 MET HB2 1 63 SER H 1.800 . 4.830 3.938 3.695 4.060 . 0 0 "[ . 1 . 2]" 1
782 1 62 MET HB2 1 64 ASP H 1.800 . 4.480 4.275 2.871 4.519 0.039 7 0 "[ . 1 . 2]" 1
783 1 62 MET HB2 1 66 THR HB 1.800 . 4.930 3.012 2.206 3.709 . 0 0 "[ . 1 . 2]" 1
784 1 62 MET HB2 1 66 THR MG 1.800 . 5.270 4.129 3.813 4.854 . 0 0 "[ . 1 . 2]" 1
785 1 62 MET HB2 1 68 LEU MD1 1.800 . 4.420 2.639 2.005 4.488 0.068 8 0 "[ . 1 . 2]" 1
786 1 62 MET ME 1 63 SER H 1.800 . 5.030 4.612 4.154 4.773 . 0 0 "[ . 1 . 2]" 1
787 1 62 MET ME 1 64 ASP H 1.800 . 4.740 4.258 3.222 4.795 0.055 9 0 "[ . 1 . 2]" 1
788 1 62 MET ME 1 66 THR HA 1.800 . 5.680 5.231 4.524 5.503 . 0 0 "[ . 1 . 2]" 1
789 1 62 MET ME 1 66 THR HB 1.800 . 3.320 2.627 2.050 2.869 . 0 0 "[ . 1 . 2]" 1
790 1 62 MET ME 1 66 THR MG 1.800 . 3.090 3.070 2.757 3.176 0.086 8 0 "[ . 1 . 2]" 1
791 1 62 MET ME 1 68 LEU MD1 1.800 . 4.000 3.319 2.752 4.077 0.077 8 0 "[ . 1 . 2]" 1
792 1 62 MET ME 1 68 LEU MD2 1.800 . 3.250 2.238 1.804 3.251 0.001 8 0 "[ . 1 . 2]" 1
793 1 62 MET ME 1 74 TYR QB 1.800 . 4.600 3.034 2.240 3.662 . 0 0 "[ . 1 . 2]" 1
794 1 62 MET ME 1 74 TYR QD 1.800 . 4.570 4.158 3.414 4.611 0.041 2 0 "[ . 1 . 2]" 1
795 1 62 MET ME 1 76 LEU HA 1.800 . 4.470 3.313 2.810 3.933 . 0 0 "[ . 1 . 2]" 1
796 1 62 MET ME 1 76 LEU MD2 1.800 . 3.940 2.900 2.201 3.984 0.044 15 0 "[ . 1 . 2]" 1
797 1 62 MET ME 1 83 LEU MD2 1.800 . 4.810 3.827 2.684 4.825 0.015 15 0 "[ . 1 . 2]" 1
798 1 62 MET QG 1 64 ASP H 1.800 . 4.760 2.385 2.022 4.469 . 0 0 "[ . 1 . 2]" 1
799 1 62 MET QG 1 66 THR MG 1.800 . 5.420 5.085 3.826 5.427 0.007 17 0 "[ . 1 . 2]" 1
800 1 62 MET QG 1 76 LEU MD2 1.800 . 4.650 3.797 3.262 4.658 0.008 9 0 "[ . 1 . 2]" 1
801 1 62 MET QG 1 83 LEU HA 1.800 . 5.310 4.078 3.629 4.723 . 0 0 "[ . 1 . 2]" 1
802 1 62 MET ME 1 62 MET HG3 1.800 . 4.100 2.835 2.510 3.413 . 0 0 "[ . 1 . 2]" 1
803 1 62 MET HG3 1 66 THR HB 1.800 . 5.710 4.908 3.538 5.497 . 0 0 "[ . 1 . 2]" 1
804 1 62 MET HG3 1 68 LEU MD1 1.800 . 3.980 3.603 2.324 4.035 0.055 2 0 "[ . 1 . 2]" 1
805 1 62 MET HG3 1 68 LEU MD2 1.800 . 5.430 4.126 2.801 4.897 . 0 0 "[ . 1 . 2]" 1
806 1 62 MET HG3 1 83 LEU MD2 1.800 . 4.080 2.681 2.217 3.687 . 0 0 "[ . 1 . 2]" 1
807 1 62 MET ME 1 62 MET HG2 1.800 . 4.100 3.117 2.535 3.411 . 0 0 "[ . 1 . 2]" 1
808 1 62 MET HG2 1 66 THR HB 1.800 . 5.710 4.569 4.254 4.794 . 0 0 "[ . 1 . 2]" 1
809 1 62 MET HG2 1 68 LEU MD1 1.800 . 5.000 4.702 2.383 5.020 0.020 5 0 "[ . 1 . 2]" 1
810 1 62 MET HG2 1 68 LEU MD2 1.800 . 5.430 4.808 2.801 5.292 . 0 0 "[ . 1 . 2]" 1
811 1 62 MET HG2 1 83 LEU MD2 1.800 . 4.080 3.814 3.046 4.107 0.027 19 0 "[ . 1 . 2]" 1
812 1 62 MET H 1 62 MET HB3 1.800 . 4.220 2.617 2.448 3.603 . 0 0 "[ . 1 . 2]" 1
813 1 62 MET H 1 62 MET HB2 1.800 . 4.220 2.611 2.418 2.899 . 0 0 "[ . 1 . 2]" 1
814 1 62 MET H 1 62 MET ME 1.800 . 5.000 4.129 3.946 4.563 . 0 0 "[ . 1 . 2]" 1
815 1 62 MET H 1 62 MET HG3 1.800 . 4.970 4.405 2.474 4.606 . 0 0 "[ . 1 . 2]" 1
816 1 62 MET H 1 62 MET HG2 1.800 . 4.970 4.448 3.845 4.524 . 0 0 "[ . 1 . 2]" 1
817 1 62 MET H 1 63 SER H 1.800 . 5.080 4.579 4.531 4.614 . 0 0 "[ . 1 . 2]" 1
818 1 62 MET H 1 65 GLY H 1.800 . 4.910 3.908 3.526 4.399 . 0 0 "[ . 1 . 2]" 1
819 1 62 MET H 1 66 THR HB 1.800 . 4.910 3.330 3.087 3.543 . 0 0 "[ . 1 . 2]" 1
820 1 62 MET H 1 66 THR MG 1.800 . 5.300 4.242 3.932 4.708 . 0 0 "[ . 1 . 2]" 1
821 1 62 MET H 1 66 THR H 1.800 . 4.370 3.505 3.136 3.867 . 0 0 "[ . 1 . 2]" 1
822 1 62 MET H 1 67 VAL HA 1.800 . 4.550 3.658 3.346 3.828 . 0 0 "[ . 1 . 2]" 1
823 1 62 MET H 1 67 VAL MG2 1.800 . 6.050 4.853 4.674 5.064 . 0 0 "[ . 1 . 2]" 1
824 1 62 MET H 1 68 LEU MD1 1.800 . 4.310 3.608 3.042 4.050 . 0 0 "[ . 1 . 2]" 1
825 1 62 MET H 1 68 LEU HG 1.800 . 4.960 3.021 2.610 3.601 . 0 0 "[ . 1 . 2]" 1
826 1 62 MET H 1 68 LEU H 1.800 . 5.210 4.148 3.875 4.410 . 0 0 "[ . 1 . 2]" 1
827 1 62 MET H 1 83 LEU MD2 1.800 . 6.030 4.406 4.089 4.759 . 0 0 "[ . 1 . 2]" 1
828 1 63 SER HA 1 65 GLY H 1.800 . 4.270 3.685 3.463 3.989 . 0 0 "[ . 1 . 2]" 1
829 1 63 SER HA 1 82 ARG H 1.800 . 5.210 4.609 4.019 5.270 0.060 17 0 "[ . 1 . 2]" 1
830 1 63 SER HA 1 84 TYR QB 1.800 . 6.050 4.671 3.734 5.094 . 0 0 "[ . 1 . 2]" 1
831 1 63 SER HA 1 84 TYR QD 1.800 . 4.980 2.646 1.841 3.184 . 0 0 "[ . 1 . 2]" 1
832 1 63 SER HA 1 84 TYR QE 1.800 . 3.960 2.156 1.751 3.240 0.049 16 0 "[ . 1 . 2]" 1
833 1 63 SER QB 1 64 ASP H 1.800 . 4.500 3.252 2.809 3.603 . 0 0 "[ . 1 . 2]" 1
834 1 63 SER QB 1 82 ARG HA 1.800 . 5.310 4.249 3.910 4.659 . 0 0 "[ . 1 . 2]" 1
835 1 63 SER QB 1 82 ARG QB 1.800 . 4.820 2.362 1.750 3.847 0.050 9 0 "[ . 1 . 2]" 1
836 1 63 SER QB 1 82 ARG H 1.800 . 4.370 2.395 1.772 3.316 0.028 8 0 "[ . 1 . 2]" 1
837 1 63 SER QB 1 84 TYR QE 1.800 . 4.400 2.918 1.874 4.087 . 0 0 "[ . 1 . 2]" 1
838 1 63 SER H 1 63 SER QB 1.800 . 3.850 2.490 2.196 2.756 . 0 0 "[ . 1 . 2]" 1
839 1 63 SER H 1 64 ASP H 1.800 . 4.310 2.804 2.710 2.956 . 0 0 "[ . 1 . 2]" 1
840 1 63 SER H 1 82 ARG QB 1.800 . 5.710 4.157 3.397 5.205 . 0 0 "[ . 1 . 2]" 1
841 1 63 SER H 1 82 ARG H 1.800 . 5.170 3.454 2.879 3.929 . 0 0 "[ . 1 . 2]" 1
842 1 63 SER H 1 83 LEU HA 1.800 . 4.860 3.610 3.186 4.081 . 0 0 "[ . 1 . 2]" 1
843 1 63 SER H 1 83 LEU MD2 1.800 . 4.110 3.372 2.791 3.774 . 0 0 "[ . 1 . 2]" 1
844 1 63 SER H 1 84 TYR QE 1.800 . 5.470 4.346 3.659 5.236 . 0 0 "[ . 1 . 2]" 1
845 1 64 ASP QB 1 65 GLY H 1.800 . 4.370 3.374 3.029 3.789 . 0 0 "[ . 1 . 2]" 1
846 1 64 ASP H 1 64 ASP QB 1.800 . 3.530 2.366 2.251 2.545 . 0 0 "[ . 1 . 2]" 1
847 1 64 ASP H 1 65 GLY QA 1.800 . 5.010 4.466 4.327 4.580 . 0 0 "[ . 1 . 2]" 1
848 1 64 ASP H 1 65 GLY H 1.800 . 3.400 2.523 2.316 2.638 . 0 0 "[ . 1 . 2]" 1
849 1 65 GLY H 1 66 THR H 1.800 . 3.430 2.358 2.132 2.658 . 0 0 "[ . 1 . 2]" 1
850 1 66 THR HA 1 66 THR MG 1.800 . 3.280 2.351 2.218 2.453 . 0 0 "[ . 1 . 2]" 1
851 1 66 THR HA 1 67 VAL HB 1.800 . 6.010 4.652 4.597 4.702 . 0 0 "[ . 1 . 2]" 1
852 1 66 THR HA 1 67 VAL H 1.800 . 3.160 2.156 2.119 2.179 . 0 0 "[ . 1 . 2]" 1
853 1 66 THR HB 1 67 VAL H 1.800 . 4.860 4.225 3.888 4.343 . 0 0 "[ . 1 . 2]" 1
854 1 66 THR MG 1 68 LEU MD1 1.800 . 5.000 4.621 4.378 4.988 . 0 0 "[ . 1 . 2]" 1
855 1 66 THR MG 1 68 LEU MD2 1.800 . 3.850 2.595 2.180 3.485 . 0 0 "[ . 1 . 2]" 1
856 1 66 THR MG 1 74 TYR QD 1.800 . 4.150 3.156 2.583 4.001 . 0 0 "[ . 1 . 2]" 1
857 1 66 THR MG 1 74 TYR QE 1.800 . 4.480 3.354 2.724 4.240 . 0 0 "[ . 1 . 2]" 1
858 1 66 THR H 1 66 THR HB 1.800 . 3.720 2.604 2.454 2.861 . 0 0 "[ . 1 . 2]" 1
859 1 66 THR H 1 66 THR MG 1.800 . 4.700 3.738 3.652 3.774 . 0 0 "[ . 1 . 2]" 1
860 1 66 THR H 1 67 VAL H 1.800 . 5.370 4.471 4.411 4.549 . 0 0 "[ . 1 . 2]" 1
861 1 67 VAL HA 1 67 VAL MG1 1.800 . 3.600 2.403 2.363 2.443 . 0 0 "[ . 1 . 2]" 1
862 1 67 VAL HA 1 67 VAL MG2 1.800 . 4.000 2.384 2.325 2.440 . 0 0 "[ . 1 . 2]" 1
863 1 67 VAL HA 1 68 LEU MD1 1.800 . 5.000 4.904 4.335 5.020 0.020 7 0 "[ . 1 . 2]" 1
864 1 67 VAL HA 1 68 LEU H 1.800 . 3.640 2.149 2.116 2.180 . 0 0 "[ . 1 . 2]" 1
865 1 67 VAL HB 1 68 LEU H 1.800 . 4.960 4.194 4.050 4.321 . 0 0 "[ . 1 . 2]" 1
866 1 67 VAL HB 1 69 LEU MD2 1.800 . 5.490 3.890 2.925 4.485 . 0 0 "[ . 1 . 2]" 1
867 1 67 VAL MG1 1 68 LEU H 1.800 . 3.740 2.713 2.503 2.973 . 0 0 "[ . 1 . 2]" 1
868 1 67 VAL H 1 67 VAL HB 1.800 . 3.450 2.521 2.464 2.601 . 0 0 "[ . 1 . 2]" 1
869 1 67 VAL H 1 67 VAL MG2 1.800 . 3.080 2.225 2.023 2.415 . 0 0 "[ . 1 . 2]" 1
870 1 67 VAL H 1 68 LEU H 1.800 . 5.900 4.493 4.400 4.574 . 0 0 "[ . 1 . 2]" 1
871 1 68 LEU HA 1 68 LEU MD1 1.800 . 4.470 3.889 3.862 3.922 . 0 0 "[ . 1 . 2]" 1
872 1 68 LEU HA 1 68 LEU MD2 1.800 . 4.100 2.113 2.049 2.417 . 0 0 "[ . 1 . 2]" 1
873 1 68 LEU HA 1 68 LEU HG 1.800 . 4.210 3.113 2.779 3.289 . 0 0 "[ . 1 . 2]" 1
874 1 68 LEU HA 1 74 TYR QE 1.800 . 4.540 2.787 1.767 3.636 0.033 12 0 "[ . 1 . 2]" 1
875 1 68 LEU QB 1 68 LEU MD2 1.800 . 3.740 2.286 2.153 2.346 . 0 0 "[ . 1 . 2]" 1
876 1 68 LEU MD1 1 83 LEU MD2 1.800 . 3.340 2.245 1.790 2.642 0.010 10 0 "[ . 1 . 2]" 1
877 1 68 LEU MD2 1 69 LEU H 1.800 . 4.330 3.752 3.211 3.911 . 0 0 "[ . 1 . 2]" 1
878 1 68 LEU MD2 1 74 TYR HB3 1.800 . 5.690 3.322 2.789 4.282 . 0 0 "[ . 1 . 2]" 1
879 1 68 LEU MD2 1 74 TYR HB2 1.800 . 5.690 2.689 2.175 3.329 . 0 0 "[ . 1 . 2]" 1
880 1 68 LEU MD2 1 74 TYR QD 1.800 . 3.810 2.547 2.044 2.882 . 0 0 "[ . 1 . 2]" 1
881 1 68 LEU MD2 1 74 TYR QE 1.800 . 4.260 3.407 2.723 3.805 . 0 0 "[ . 1 . 2]" 1
882 1 68 LEU HG 1 74 TYR QD 1.800 . 5.190 5.089 4.610 5.231 0.041 18 0 "[ . 1 . 2]" 1
883 1 68 LEU HG 1 74 TYR QE 1.800 . 6.000 5.408 4.657 5.882 . 0 0 "[ . 1 . 2]" 1
884 1 68 LEU H 1 68 LEU MD1 1.800 . 4.800 3.658 3.267 3.826 . 0 0 "[ . 1 . 2]" 1
885 1 68 LEU H 1 68 LEU MD2 1.800 . 4.550 3.502 3.245 3.967 . 0 0 "[ . 1 . 2]" 1
886 1 68 LEU H 1 68 LEU HG 1.800 . 4.040 2.467 2.220 2.749 . 0 0 "[ . 1 . 2]" 1
887 1 68 LEU H 1 69 LEU MD2 1.800 . 5.940 4.382 3.863 4.902 . 0 0 "[ . 1 . 2]" 1
888 1 68 LEU H 1 69 LEU H 1.800 . 5.960 4.391 4.131 4.601 . 0 0 "[ . 1 . 2]" 1
889 1 69 LEU HA 1 69 LEU MD1 1.800 . 4.700 3.161 1.852 3.871 . 0 0 "[ . 1 . 2]" 1
890 1 69 LEU HA 1 69 LEU MD2 1.800 . 3.200 2.306 1.956 2.959 . 0 0 "[ . 1 . 2]" 1
891 1 69 LEU HA 1 70 PRO QD 1.800 . 3.590 1.905 1.775 2.146 0.025 10 0 "[ . 1 . 2]" 1
892 1 69 LEU QB 1 69 LEU MD1 1.800 . 3.130 2.192 2.088 2.418 . 0 0 "[ . 1 . 2]" 1
893 1 69 LEU QB 1 69 LEU MD2 1.800 . 3.490 2.297 2.240 2.340 . 0 0 "[ . 1 . 2]" 1
894 1 69 LEU QB 1 70 PRO QD 1.800 . 4.130 2.505 2.049 2.975 . 0 0 "[ . 1 . 2]" 1
895 1 69 LEU QB 1 72 ASP H 1.800 . 4.600 3.516 2.332 4.443 . 0 0 "[ . 1 . 2]" 1
896 1 69 LEU MD1 1 70 PRO QD 1.800 . 4.370 3.449 2.135 4.373 0.003 11 0 "[ . 1 . 2]" 1
897 1 69 LEU MD1 1 72 ASP H 1.800 . 6.050 5.300 4.639 6.084 0.034 16 0 "[ . 1 . 2]" 1
898 1 69 LEU MD2 1 70 PRO QD 1.800 . 4.090 3.158 2.517 4.107 0.017 17 0 "[ . 1 . 2]" 1
899 1 69 LEU MD2 1 70 PRO QG 1.800 . 5.890 4.736 3.985 5.720 . 0 0 "[ . 1 . 2]" 1
900 1 69 LEU H 1 69 LEU MD1 1.800 . 5.000 3.874 3.668 4.140 . 0 0 "[ . 1 . 2]" 1
901 1 69 LEU H 1 69 LEU MD2 1.800 . 4.600 3.234 2.210 3.837 . 0 0 "[ . 1 . 2]" 1
902 1 69 LEU H 1 69 LEU HG 1.800 . 4.680 3.341 2.613 4.626 . 0 0 "[ . 1 . 2]" 1
903 1 69 LEU H 1 74 TYR QE 1.800 . 4.510 2.109 1.756 2.927 0.044 1 0 "[ . 1 . 2]" 1
904 1 70 PRO HA 1 72 ASP H 1.800 . 4.600 4.049 3.464 4.678 0.078 8 0 "[ . 1 . 2]" 1
905 1 70 PRO QB 1 71 ASN H 1.800 . 4.480 3.208 2.391 4.000 . 0 0 "[ . 1 . 2]" 1
906 1 71 ASN QB 1 72 ASP H 1.800 . 4.350 2.922 2.198 3.939 . 0 0 "[ . 1 . 2]" 1
907 1 71 ASN H 1 72 ASP H 1.800 . 4.400 2.686 2.100 3.627 . 0 0 "[ . 1 . 2]" 1
908 1 72 ASP HA 1 73 LEU QB 1.800 . 4.620 4.005 3.692 4.541 . 0 0 "[ . 1 . 2]" 1
909 1 72 ASP HA 1 73 LEU H 1.800 . 3.790 2.423 2.152 2.736 . 0 0 "[ . 1 . 2]" 1
910 1 72 ASP QB 1 73 LEU H 1.800 . 3.790 2.774 1.953 3.823 0.033 15 0 "[ . 1 . 2]" 1
911 1 72 ASP QB 1 74 TYR QE 1.800 . 4.880 3.091 1.925 4.736 . 0 0 "[ . 1 . 2]" 1
912 1 72 ASP H 1 72 ASP QB 1.800 . 3.390 2.474 2.233 2.869 . 0 0 "[ . 1 . 2]" 1
913 1 72 ASP H 1 73 LEU H 1.800 . 4.960 4.493 4.248 4.624 . 0 0 "[ . 1 . 2]" 1
914 1 73 LEU HA 1 73 LEU MD1 1.800 . 4.300 2.676 1.930 4.116 . 0 0 "[ . 1 . 2]" 1
915 1 73 LEU HA 1 73 LEU MD2 1.800 . 4.800 3.499 1.946 3.896 . 0 0 "[ . 1 . 2]" 1
916 1 73 LEU HA 1 74 TYR H 1.800 . 3.720 2.162 2.114 2.284 . 0 0 "[ . 1 . 2]" 1
917 1 73 LEU QB 1 73 LEU MD1 1.800 . 3.390 2.217 2.066 2.333 . 0 0 "[ . 1 . 2]" 1
918 1 73 LEU QB 1 73 LEU MD2 1.800 . 3.000 2.153 2.081 2.338 . 0 0 "[ . 1 . 2]" 1
919 1 73 LEU QB 1 74 TYR H 1.800 . 4.310 3.613 2.839 3.896 . 0 0 "[ . 1 . 2]" 1
920 1 73 LEU MD1 1 74 TYR H 1.800 . 5.000 3.336 2.357 5.015 0.015 8 0 "[ . 1 . 2]" 1
921 1 73 LEU MD1 1 100 GLN HE21 1.800 . 5.040 3.284 1.832 5.060 0.020 17 0 "[ . 1 . 2]" 1
922 1 73 LEU MD1 1 100 GLN HE22 1.800 . 5.470 3.137 2.040 4.604 . 0 0 "[ . 1 . 2]" 1
923 1 73 LEU MD1 1 100 GLN H 1.800 . 5.700 4.720 4.103 5.738 0.038 4 0 "[ . 1 . 2]" 1
924 1 73 LEU MD2 1 100 GLN HE21 1.800 . 4.920 3.841 2.355 4.982 0.062 5 0 "[ . 1 . 2]" 1
925 1 73 LEU MD2 1 100 GLN HE22 1.800 . 4.370 3.543 2.385 4.416 0.046 12 0 "[ . 1 . 2]" 1
926 1 73 LEU HG 1 74 TYR H 1.800 . 5.500 3.528 2.619 5.129 . 0 0 "[ . 1 . 2]" 1
927 1 73 LEU H 1 73 LEU QB 1.800 . 3.250 2.469 2.289 2.991 . 0 0 "[ . 1 . 2]" 1
928 1 73 LEU H 1 73 LEU MD1 1.800 . 5.300 4.224 3.855 4.648 . 0 0 "[ . 1 . 2]" 1
929 1 73 LEU H 1 74 TYR QE 1.800 . 6.000 5.129 3.971 5.603 . 0 0 "[ . 1 . 2]" 1
930 1 73 LEU H 1 74 TYR H 1.800 . 5.020 4.350 4.040 4.460 . 0 0 "[ . 1 . 2]" 1
931 1 74 TYR HA 1 74 TYR QD 1.800 . 4.400 2.781 2.094 3.097 . 0 0 "[ . 1 . 2]" 1
932 1 74 TYR HA 1 75 PRO QD 1.800 . 3.530 1.877 1.763 2.089 0.037 14 0 "[ . 1 . 2]" 1
933 1 74 TYR HA 1 75 PRO QG 1.800 . 4.490 3.761 3.569 4.008 . 0 0 "[ . 1 . 2]" 1
934 1 74 TYR QB 1 75 PRO QD 1.800 . 4.600 2.546 2.151 2.983 . 0 0 "[ . 1 . 2]" 1
935 1 74 TYR QD 1 75 PRO QD 1.800 . 4.660 3.026 2.310 3.601 . 0 0 "[ . 1 . 2]" 1
936 1 74 TYR H 1 74 TYR QD 1.800 . 4.130 2.943 2.330 3.397 . 0 0 "[ . 1 . 2]" 1
937 1 74 TYR H 1 74 TYR QE 1.800 . 5.790 4.853 4.255 5.308 . 0 0 "[ . 1 . 2]" 1
938 1 75 PRO HA 1 76 LEU H 1.800 . 3.510 2.197 2.133 2.375 . 0 0 "[ . 1 . 2]" 1
939 1 75 PRO QB 1 76 LEU QB 1.800 . 5.670 4.747 4.445 4.906 . 0 0 "[ . 1 . 2]" 1
940 1 75 PRO HB3 1 76 LEU H 1.800 . 4.600 3.665 3.412 4.000 . 0 0 "[ . 1 . 2]" 1
941 1 75 PRO HB2 1 76 LEU H 1.800 . 4.600 3.395 2.652 3.836 . 0 0 "[ . 1 . 2]" 1
942 1 76 LEU HA 1 76 LEU MD1 1.800 . 4.800 3.852 3.834 3.882 . 0 0 "[ . 1 . 2]" 1
943 1 76 LEU HA 1 76 LEU MD2 1.800 . 3.820 1.976 1.921 2.057 . 0 0 "[ . 1 . 2]" 1
944 1 76 LEU HA 1 78 GLY H 1.800 . 5.640 3.854 3.445 4.566 . 0 0 "[ . 1 . 2]" 1
945 1 76 LEU QB 1 77 PRO QD 1.800 . 4.530 2.735 2.233 3.230 . 0 0 "[ . 1 . 2]" 1
946 1 76 LEU HB3 1 76 LEU MD1 1.800 . 4.100 2.395 2.348 2.435 . 0 0 "[ . 1 . 2]" 1
947 1 76 LEU HB3 1 76 LEU MD2 1.800 . 4.290 2.352 2.309 2.423 . 0 0 "[ . 1 . 2]" 1
948 1 76 LEU HB3 1 77 PRO QD 1.800 . 5.430 2.793 2.252 3.343 . 0 0 "[ . 1 . 2]" 1
949 1 76 LEU HB3 1 78 GLY H 1.800 . 4.880 2.772 2.427 3.327 . 0 0 "[ . 1 . 2]" 1
950 1 76 LEU HB2 1 76 LEU MD1 1.800 . 4.100 2.317 2.274 2.374 . 0 0 "[ . 1 . 2]" 1
951 1 76 LEU HB2 1 76 LEU MD2 1.800 . 4.290 3.195 3.190 3.201 . 0 0 "[ . 1 . 2]" 1
952 1 76 LEU HB2 1 77 PRO QD 1.800 . 5.430 3.983 3.684 4.273 . 0 0 "[ . 1 . 2]" 1
953 1 76 LEU HB2 1 78 GLY H 1.800 . 4.880 3.851 3.373 4.535 . 0 0 "[ . 1 . 2]" 1
954 1 76 LEU MD1 1 77 PRO HD3 1.800 . 6.000 5.316 4.607 5.723 . 0 0 "[ . 1 . 2]" 1
955 1 76 LEU MD1 1 77 PRO HD2 1.800 . 6.000 4.476 3.951 5.023 . 0 0 "[ . 1 . 2]" 1
956 1 76 LEU MD1 1 78 GLY H 1.800 . 5.120 4.540 4.233 5.062 . 0 0 "[ . 1 . 2]" 1
957 1 76 LEU MD1 1 81 PHE QD 1.800 . 5.160 3.724 3.174 4.128 . 0 0 "[ . 1 . 2]" 1
958 1 76 LEU MD1 1 99 PHE HA 1.800 . 5.300 3.970 3.541 4.546 . 0 0 "[ . 1 . 2]" 1
959 1 76 LEU MD1 1 99 PHE QD 1.800 . 3.470 2.117 1.817 2.716 . 0 0 "[ . 1 . 2]" 1
960 1 76 LEU MD1 1 99 PHE QE 1.800 . 4.950 2.960 2.295 3.603 . 0 0 "[ . 1 . 2]" 1
961 1 76 LEU MD1 1 100 GLN H 1.800 . 6.030 4.474 3.894 5.134 . 0 0 "[ . 1 . 2]" 1
962 1 76 LEU MD2 1 77 PRO QB 1.800 . 5.970 5.281 4.920 5.537 . 0 0 "[ . 1 . 2]" 1
963 1 76 LEU MD2 1 77 PRO HD3 1.800 . 4.380 3.238 2.526 3.633 . 0 0 "[ . 1 . 2]" 1
964 1 76 LEU MD2 1 77 PRO HD2 1.800 . 4.380 2.812 2.297 3.230 . 0 0 "[ . 1 . 2]" 1
965 1 76 LEU MD2 1 78 GLY H 1.800 . 4.690 4.184 3.898 4.551 . 0 0 "[ . 1 . 2]" 1
966 1 76 LEU MD2 1 81 PHE QD 1.800 . 4.550 3.340 2.869 3.786 . 0 0 "[ . 1 . 2]" 1
967 1 76 LEU MD2 1 99 PHE QD 1.800 . 4.420 3.544 2.882 4.436 0.016 16 0 "[ . 1 . 2]" 1
968 1 76 LEU MD2 1 99 PHE QE 1.800 . 4.660 3.019 2.256 4.012 . 0 0 "[ . 1 . 2]" 1
969 1 76 LEU H 1 76 LEU MD1 1.800 . 4.700 3.744 3.624 3.869 . 0 0 "[ . 1 . 2]" 1
970 1 76 LEU H 1 76 LEU MD2 1.800 . 4.700 3.639 3.257 3.781 . 0 0 "[ . 1 . 2]" 1
971 1 76 LEU H 1 76 LEU HG 1.800 . 3.510 2.663 2.341 2.859 . 0 0 "[ . 1 . 2]" 1
972 1 76 LEU H 1 77 PRO QD 1.800 . 5.390 4.292 4.126 4.410 . 0 0 "[ . 1 . 2]" 1
973 1 77 PRO HB3 1 78 GLY H 1.800 . 4.540 4.357 3.817 4.573 0.033 13 0 "[ . 1 . 2]" 1
974 1 77 PRO HB2 1 78 GLY H 1.800 . 4.540 3.690 2.374 4.169 . 0 0 "[ . 1 . 2]" 1
975 1 77 PRO HD3 1 78 GLY H 1.800 . 4.360 3.916 3.757 4.141 . 0 0 "[ . 1 . 2]" 1
976 1 77 PRO HD2 1 78 GLY H 1.800 . 4.360 2.735 2.419 3.178 . 0 0 "[ . 1 . 2]" 1
977 1 77 PRO QG 1 78 GLY H 1.800 . 3.670 3.091 2.228 3.666 . 0 0 "[ . 1 . 2]" 1
978 1 77 PRO QG 1 81 PHE QD 1.800 . 5.760 4.683 3.204 5.785 0.025 20 0 "[ . 1 . 2]" 1
979 1 78 GLY HA3 1 79 GLU H 1.800 . 3.600 2.497 2.164 2.915 . 0 0 "[ . 1 . 2]" 1
980 1 78 GLY HA3 1 80 THR H 1.800 . 5.640 3.622 3.141 4.275 . 0 0 "[ . 1 . 2]" 1
981 1 78 GLY HA2 1 79 GLU H 1.800 . 3.600 2.624 2.240 3.034 . 0 0 "[ . 1 . 2]" 1
982 1 78 GLY HA2 1 80 THR H 1.800 . 5.640 4.507 3.882 5.443 . 0 0 "[ . 1 . 2]" 1
983 1 78 GLY H 1 79 GLU HA 1.800 . 5.440 4.825 4.579 5.124 . 0 0 "[ . 1 . 2]" 1
984 1 78 GLY H 1 79 GLU H 1.800 . 4.550 4.328 4.108 4.414 . 0 0 "[ . 1 . 2]" 1
985 1 78 GLY H 1 80 THR H 1.800 . 5.820 5.301 4.778 5.855 0.035 14 0 "[ . 1 . 2]" 1
986 1 78 GLY H 1 81 PHE QB 1.800 . 4.600 3.857 2.984 4.616 0.016 16 0 "[ . 1 . 2]" 1
987 1 79 GLU HA 1 79 GLU HG3 1.800 . 4.060 2.961 2.410 3.900 . 0 0 "[ . 1 . 2]" 1
988 1 79 GLU HA 1 79 GLU HG2 1.800 . 4.060 3.490 2.636 4.131 0.071 13 0 "[ . 1 . 2]" 1
989 1 79 GLU HA 1 80 THR H 1.800 . 3.920 3.488 3.325 3.583 . 0 0 "[ . 1 . 2]" 1
990 1 79 GLU HB3 1 80 THR H 1.800 . 4.400 3.871 3.377 4.397 . 0 0 "[ . 1 . 2]" 1
991 1 79 GLU HB2 1 80 THR H 1.800 . 4.400 2.914 2.119 4.060 . 0 0 "[ . 1 . 2]" 1
992 1 79 GLU HG3 1 80 THR H 1.800 . 5.680 4.193 2.875 4.937 . 0 0 "[ . 1 . 2]" 1
993 1 79 GLU HG2 1 80 THR H 1.800 . 5.680 4.550 2.743 5.111 . 0 0 "[ . 1 . 2]" 1
994 1 79 GLU H 1 79 GLU HB3 1.800 . 4.280 3.517 3.073 3.684 . 0 0 "[ . 1 . 2]" 1
995 1 79 GLU H 1 79 GLU HB2 1.800 . 4.280 2.856 2.427 3.767 . 0 0 "[ . 1 . 2]" 1
996 1 79 GLU H 1 79 GLU HG3 1.800 . 5.300 2.787 2.067 3.526 . 0 0 "[ . 1 . 2]" 1
997 1 79 GLU H 1 79 GLU HG2 1.800 . 5.300 3.371 1.817 4.002 . 0 0 "[ . 1 . 2]" 1
998 1 79 GLU H 1 80 THR MG 1.800 . 6.000 4.544 3.445 5.948 . 0 0 "[ . 1 . 2]" 1
999 1 79 GLU H 1 80 THR H 1.800 . 3.160 2.324 1.787 2.793 0.013 2 0 "[ . 1 . 2]" 1
1000 1 80 THR HA 1 80 THR MG 1.800 . 3.580 2.563 2.176 3.226 . 0 0 "[ . 1 . 2]" 1
1001 1 80 THR HA 1 81 PHE H 1.800 . 3.410 2.309 2.120 2.867 . 0 0 "[ . 1 . 2]" 1
1002 1 80 THR HB 1 81 PHE H 1.800 . 5.270 4.183 3.538 4.479 . 0 0 "[ . 1 . 2]" 1
1003 1 80 THR MG 1 81 PHE H 1.800 . 4.430 3.916 3.169 4.397 . 0 0 "[ . 1 . 2]" 1
1004 1 80 THR H 1 80 THR HB 1.800 . 3.800 3.190 2.543 3.684 . 0 0 "[ . 1 . 2]" 1
1005 1 80 THR H 1 80 THR MG 1.800 . 4.800 2.878 1.871 3.855 . 0 0 "[ . 1 . 2]" 1
1006 1 80 THR H 1 81 PHE H 1.800 . 4.400 3.952 2.731 4.439 0.039 9 0 "[ . 1 . 2]" 1
1007 1 81 PHE HA 1 81 PHE QD 1.800 . 4.990 3.727 3.701 3.745 . 0 0 "[ . 1 . 2]" 1
1008 1 81 PHE HA 1 82 ARG H 1.800 . 3.630 2.403 2.142 2.636 . 0 0 "[ . 1 . 2]" 1
1009 1 81 PHE QB 1 82 ARG H 1.800 . 3.700 2.394 1.943 3.040 . 0 0 "[ . 1 . 2]" 1
1010 1 81 PHE QD 1 82 ARG H 1.800 . 4.480 3.442 2.723 4.406 . 0 0 "[ . 1 . 2]" 1
1011 1 81 PHE QD 1 83 LEU MD1 1.800 . 5.310 3.712 3.222 4.104 . 0 0 "[ . 1 . 2]" 1
1012 1 81 PHE QD 1 83 LEU MD2 1.800 . 4.070 2.572 2.345 2.752 . 0 0 "[ . 1 . 2]" 1
1013 1 81 PHE QD 1 83 LEU HG 1.800 . 5.120 2.722 2.434 3.193 . 0 0 "[ . 1 . 2]" 1
1014 1 81 PHE QE 1 83 LEU MD1 1.800 . 3.520 2.408 2.047 3.042 . 0 0 "[ . 1 . 2]" 1
1015 1 81 PHE H 1 81 PHE QD 1.800 . 4.270 2.621 1.951 3.060 . 0 0 "[ . 1 . 2]" 1
1016 1 82 ARG HA 1 82 ARG QD 1.800 . 5.010 4.041 2.297 4.597 . 0 0 "[ . 1 . 2]" 1
1017 1 82 ARG HA 1 82 ARG QG 1.800 . 3.990 2.691 2.335 3.351 . 0 0 "[ . 1 . 2]" 1
1018 1 82 ARG QB 1 83 LEU H 1.800 . 4.370 3.003 2.469 3.271 . 0 0 "[ . 1 . 2]" 1
1019 1 82 ARG H 1 82 ARG QD 1.800 . 5.730 4.078 2.144 4.905 . 0 0 "[ . 1 . 2]" 1
1020 1 82 ARG H 1 82 ARG QG 1.800 . 4.170 2.732 2.051 3.322 . 0 0 "[ . 1 . 2]" 1
1021 1 83 LEU HA 1 83 LEU MD1 1.800 . 4.700 3.865 3.831 3.931 . 0 0 "[ . 1 . 2]" 1
1022 1 83 LEU HA 1 83 LEU MD2 1.800 . 3.420 2.033 1.952 2.183 . 0 0 "[ . 1 . 2]" 1
1023 1 83 LEU HA 1 84 TYR QB 1.800 . 5.870 4.313 4.205 4.434 . 0 0 "[ . 1 . 2]" 1
1024 1 83 LEU HA 1 84 TYR QD 1.800 . 4.740 3.812 3.433 4.345 . 0 0 "[ . 1 . 2]" 1
1025 1 83 LEU HA 1 84 TYR H 1.800 . 3.490 2.161 2.110 2.213 . 0 0 "[ . 1 . 2]" 1
1026 1 83 LEU HB3 1 83 LEU MD1 1.800 . 4.390 2.377 2.338 2.466 . 0 0 "[ . 1 . 2]" 1
1027 1 83 LEU HB3 1 83 LEU MD2 1.800 . 4.650 2.376 2.299 2.418 . 0 0 "[ . 1 . 2]" 1
1028 1 83 LEU HB3 1 84 TYR HA 1.800 . 6.050 4.776 4.525 5.020 . 0 0 "[ . 1 . 2]" 1
1029 1 83 LEU HB3 1 84 TYR H 1.800 . 4.290 3.309 3.000 3.536 . 0 0 "[ . 1 . 2]" 1
1030 1 83 LEU HB2 1 83 LEU MD1 1.800 . 4.390 2.329 2.258 2.368 . 0 0 "[ . 1 . 2]" 1
1031 1 83 LEU HB2 1 83 LEU MD2 1.800 . 4.650 3.200 3.194 3.204 . 0 0 "[ . 1 . 2]" 1
1032 1 83 LEU HB2 1 84 TYR HA 1.800 . 6.050 4.887 4.748 5.015 . 0 0 "[ . 1 . 2]" 1
1033 1 83 LEU HB2 1 84 TYR H 1.800 . 4.290 4.186 4.008 4.323 0.033 12 0 "[ . 1 . 2]" 1
1034 1 83 LEU MD1 1 97 VAL MG1 1.800 . 4.100 2.996 2.361 3.476 . 0 0 "[ . 1 . 2]" 1
1035 1 83 LEU MD1 1 99 PHE HZ 1.800 . 3.220 2.459 1.784 3.079 0.016 20 0 "[ . 1 . 2]" 1
1036 1 83 LEU MD2 1 84 TYR H 1.800 . 4.350 3.632 3.492 3.872 . 0 0 "[ . 1 . 2]" 1
1037 1 83 LEU MD2 1 99 PHE HZ 1.800 . 5.180 4.401 3.582 5.229 0.049 16 0 "[ . 1 . 2]" 1
1038 1 83 LEU HG 1 84 TYR H 1.800 . 6.050 5.146 5.051 5.235 . 0 0 "[ . 1 . 2]" 1
1039 1 83 LEU H 1 83 LEU MD1 1.800 . 4.930 3.927 3.773 4.062 . 0 0 "[ . 1 . 2]" 1
1040 1 83 LEU H 1 83 LEU MD2 1.800 . 4.580 3.657 3.458 3.798 . 0 0 "[ . 1 . 2]" 1
1041 1 83 LEU H 1 83 LEU HG 1.800 . 4.720 2.809 2.639 3.051 . 0 0 "[ . 1 . 2]" 1
1042 1 84 TYR HA 1 84 TYR QD 1.800 . 4.700 2.836 2.507 3.041 . 0 0 "[ . 1 . 2]" 1
1043 1 84 TYR HA 1 85 TYR QB 1.800 . 5.440 4.159 4.040 4.274 . 0 0 "[ . 1 . 2]" 1
1044 1 84 TYR HA 1 85 TYR H 1.800 . 3.450 2.151 2.084 2.225 . 0 0 "[ . 1 . 2]" 1
1045 1 84 TYR QD 1 85 TYR H 1.800 . 4.940 4.376 4.014 4.612 . 0 0 "[ . 1 . 2]" 1
1046 1 84 TYR H 1 84 TYR QD 1.800 . 4.280 2.825 2.437 3.239 . 0 0 "[ . 1 . 2]" 1
1047 1 85 TYR HA 1 85 TYR QD 1.800 . 5.060 2.613 2.447 2.876 . 0 0 "[ . 1 . 2]" 1
1048 1 85 TYR HA 1 86 THR H 1.800 . 3.700 2.138 2.094 2.175 . 0 0 "[ . 1 . 2]" 1
1049 1 85 TYR HB3 1 86 THR H 1.800 . 5.520 4.377 4.210 4.474 . 0 0 "[ . 1 . 2]" 1
1050 1 85 TYR HB2 1 86 THR H 1.800 . 5.520 4.351 4.177 4.495 . 0 0 "[ . 1 . 2]" 1
1051 1 85 TYR QD 1 86 THR H 1.800 . 5.140 3.661 3.131 4.096 . 0 0 "[ . 1 . 2]" 1
1052 1 85 TYR QD 1 95 VAL MG2 1.800 . 5.000 3.944 3.115 4.835 . 0 0 "[ . 1 . 2]" 1
1053 1 85 TYR QE 1 95 VAL MG1 1.800 . 5.000 4.223 3.458 5.023 0.023 5 0 "[ . 1 . 2]" 1
1054 1 85 TYR QE 1 95 VAL MG2 1.800 . 4.060 3.034 2.142 4.006 . 0 0 "[ . 1 . 2]" 1
1055 1 85 TYR H 1 85 TYR HB3 1.800 . 4.100 2.481 2.377 2.615 . 0 0 "[ . 1 . 2]" 1
1056 1 85 TYR H 1 85 TYR HB2 1.800 . 4.100 2.884 2.686 3.142 . 0 0 "[ . 1 . 2]" 1
1057 1 85 TYR H 1 85 TYR QD 1.800 . 5.420 4.221 4.153 4.279 . 0 0 "[ . 1 . 2]" 1
1058 1 85 TYR H 1 86 THR HA 1.800 . 5.590 5.077 4.898 5.300 . 0 0 "[ . 1 . 2]" 1
1059 1 85 TYR H 1 86 THR H 1.800 . 5.300 4.282 4.142 4.471 . 0 0 "[ . 1 . 2]" 1
1060 1 86 THR HA 1 86 THR MG 1.800 . 3.550 2.329 2.289 2.376 . 0 0 "[ . 1 . 2]" 1
1061 1 86 THR MG 1 87 SER H 1.800 . 5.630 3.049 2.722 3.271 . 0 0 "[ . 1 . 2]" 1
1062 1 86 THR MG 1 88 ALA MB 1.800 . 4.300 3.759 3.102 4.100 . 0 0 "[ . 1 . 2]" 1
1063 1 86 THR H 1 86 THR HB 1.800 . 4.160 2.603 2.529 2.698 . 0 0 "[ . 1 . 2]" 1
1064 1 86 THR H 1 86 THR MG 1.800 . 4.600 3.807 3.783 3.858 . 0 0 "[ . 1 . 2]" 1
1065 1 87 SER HA 1 88 ALA MB 1.800 . 4.870 3.997 3.897 4.110 . 0 0 "[ . 1 . 2]" 1
1066 1 88 ALA HA 1 89 SER H 1.800 . 3.420 3.146 3.010 3.383 . 0 0 "[ . 1 . 2]" 1
1067 1 88 ALA MB 1 89 SER H 1.800 . 3.830 3.404 3.017 3.568 . 0 0 "[ . 1 . 2]" 1
1068 1 88 ALA H 1 89 SER H 1.800 . 4.500 2.208 2.012 2.468 . 0 0 "[ . 1 . 2]" 1
1069 1 89 SER HA 1 90 THR H 1.800 . 3.330 2.352 2.205 2.740 . 0 0 "[ . 1 . 2]" 1
1070 1 89 SER QB 1 91 ASP H 1.800 . 4.110 2.928 2.259 3.568 . 0 0 "[ . 1 . 2]" 1
1071 1 89 SER HB3 1 90 THR H 1.800 . 4.440 3.409 2.253 3.978 . 0 0 "[ . 1 . 2]" 1
1072 1 89 SER HB2 1 90 THR H 1.800 . 4.440 3.624 2.350 4.155 . 0 0 "[ . 1 . 2]" 1
1073 1 89 SER H 1 89 SER QB 1.800 . 3.770 2.691 2.307 3.191 . 0 0 "[ . 1 . 2]" 1
1074 1 89 SER H 1 90 THR H 1.800 . 5.050 4.425 4.321 4.552 . 0 0 "[ . 1 . 2]" 1
1075 1 90 THR HA 1 90 THR MG 1.800 . 3.530 2.603 2.154 3.219 . 0 0 "[ . 1 . 2]" 1
1076 1 90 THR HA 1 91 ASP H 1.800 . 3.930 3.313 3.127 3.579 . 0 0 "[ . 1 . 2]" 1
1077 1 90 THR HB 1 91 ASP H 1.800 . 5.020 3.836 2.308 4.494 . 0 0 "[ . 1 . 2]" 1
1078 1 90 THR MG 1 91 ASP H 1.800 . 4.880 3.737 2.499 4.402 . 0 0 "[ . 1 . 2]" 1
1079 1 90 THR H 1 90 THR MG 1.800 . 3.730 2.881 2.038 3.852 0.122 14 0 "[ . 1 . 2]" 1
1080 1 91 ASP HA 1 92 GLN H 1.800 . 3.220 2.647 2.214 2.875 . 0 0 "[ . 1 . 2]" 1
1081 1 91 ASP QB 1 92 GLN H 1.800 . 3.300 2.275 1.766 3.749 0.449 11 0 "[ . 1 . 2]" 1
1082 1 91 ASP H 1 91 ASP QB 1.800 . 3.320 2.599 2.204 3.270 . 0 0 "[ . 1 . 2]" 1
1083 1 92 GLN HA 1 93 GLN H 1.800 . 3.560 2.167 2.099 2.301 . 0 0 "[ . 1 . 2]" 1
1084 1 92 GLN QB 1 92 GLN QE 1.800 . 4.760 3.224 1.860 3.722 . 0 0 "[ . 1 . 2]" 1
1085 1 92 GLN HB3 1 93 GLN H 1.800 . 4.640 4.170 3.228 4.430 . 0 0 "[ . 1 . 2]" 1
1086 1 92 GLN HB2 1 93 GLN H 1.800 . 4.640 4.207 2.673 4.549 . 0 0 "[ . 1 . 2]" 1
1087 1 92 GLN QE 1 112 SER QB 1.800 . 4.690 3.581 2.189 4.793 0.103 11 0 "[ . 1 . 2]" 1
1088 1 92 GLN QG 1 93 GLN H 1.800 . 3.950 3.347 2.606 4.031 0.081 3 0 "[ . 1 . 2]" 1
1089 1 92 GLN H 1 92 GLN HB3 1.800 . 3.540 2.634 2.391 3.577 0.037 13 0 "[ . 1 . 2]" 1
1090 1 92 GLN H 1 92 GLN HB2 1.800 . 3.540 2.641 2.123 3.599 0.059 3 0 "[ . 1 . 2]" 1
1091 1 92 GLN H 1 92 GLN QG 1.800 . 4.500 3.733 2.105 4.169 . 0 0 "[ . 1 . 2]" 1
1092 1 93 GLN H 1 94 THR H 1.800 . 4.970 4.267 4.033 4.462 . 0 0 "[ . 1 . 2]" 1
1093 1 93 GLN H 1 113 PHE QB 1.800 . 4.680 3.157 2.243 4.346 . 0 0 "[ . 1 . 2]" 1
1094 1 93 GLN H 1 113 PHE H 1.800 . 4.620 3.255 2.697 3.965 . 0 0 "[ . 1 . 2]" 1
1095 1 94 THR HA 1 94 THR MG 1.800 . 3.550 2.335 2.240 2.450 . 0 0 "[ . 1 . 2]" 1
1096 1 94 THR HA 1 95 VAL HB 1.800 . 5.430 4.733 4.644 4.815 . 0 0 "[ . 1 . 2]" 1
1097 1 94 THR HA 1 95 VAL MG2 1.800 . 4.530 3.658 3.553 3.801 . 0 0 "[ . 1 . 2]" 1
1098 1 94 THR HA 1 95 VAL H 1.800 . 3.490 2.156 2.112 2.198 . 0 0 "[ . 1 . 2]" 1
1099 1 94 THR HA 1 112 SER HA 1.800 . 4.150 2.410 1.995 2.807 . 0 0 "[ . 1 . 2]" 1
1100 1 94 THR HA 1 112 SER QB 1.800 . 5.210 3.702 2.514 4.580 . 0 0 "[ . 1 . 2]" 1
1101 1 94 THR HA 1 112 SER H 1.800 . 6.040 4.857 4.504 5.218 . 0 0 "[ . 1 . 2]" 1
1102 1 94 THR HB 1 95 VAL H 1.800 . 5.710 4.261 4.084 4.364 . 0 0 "[ . 1 . 2]" 1
1103 1 94 THR MG 1 95 VAL H 1.800 . 3.750 3.009 2.701 3.225 . 0 0 "[ . 1 . 2]" 1
1104 1 94 THR MG 1 112 SER HA 1.800 . 3.980 3.441 2.739 3.938 . 0 0 "[ . 1 . 2]" 1
1105 1 94 THR MG 1 112 SER QB 1.800 . 4.000 3.292 1.986 4.009 0.009 2 0 "[ . 1 . 2]" 1
1106 1 94 THR H 1 94 THR MG 1.800 . 4.920 3.861 3.780 3.956 . 0 0 "[ . 1 . 2]" 1
1107 1 95 VAL HA 1 95 VAL MG1 1.800 . 3.620 2.359 2.329 2.391 . 0 0 "[ . 1 . 2]" 1
1108 1 95 VAL HA 1 95 VAL MG2 1.800 . 3.900 2.448 2.395 2.490 . 0 0 "[ . 1 . 2]" 1
1109 1 95 VAL HA 1 96 ASP H 1.800 . 3.790 2.160 2.128 2.189 . 0 0 "[ . 1 . 2]" 1
1110 1 95 VAL HB 1 96 ASP H 1.800 . 5.380 4.261 4.066 4.383 . 0 0 "[ . 1 . 2]" 1
1111 1 95 VAL HB 1 111 PHE QB 1.800 . 5.000 2.667 2.155 4.666 . 0 0 "[ . 1 . 2]" 1
1112 1 95 VAL HB 1 111 PHE QD 1.800 . 4.430 3.462 3.242 3.652 . 0 0 "[ . 1 . 2]" 1
1113 1 95 VAL HB 1 111 PHE H 1.800 . 5.500 3.583 3.007 3.875 . 0 0 "[ . 1 . 2]" 1
1114 1 95 VAL MG1 1 96 ASP QB 1.800 . 5.200 4.375 4.006 4.845 . 0 0 "[ . 1 . 2]" 1
1115 1 95 VAL MG1 1 96 ASP H 1.800 . 3.720 2.948 2.536 3.269 . 0 0 "[ . 1 . 2]" 1
1116 1 95 VAL MG1 1 111 PHE QD 1.800 . 3.980 3.606 3.128 4.002 0.022 6 0 "[ . 1 . 2]" 1
1117 1 95 VAL MG1 1 113 PHE QE 1.800 . 6.000 4.245 3.204 5.999 . 0 0 "[ . 1 . 2]" 1
1118 1 95 VAL MG2 1 96 ASP H 1.800 . 4.880 4.188 4.061 4.286 . 0 0 "[ . 1 . 2]" 1
1119 1 95 VAL MG2 1 111 PHE QB 1.800 . 6.000 3.733 3.314 5.187 . 0 0 "[ . 1 . 2]" 1
1120 1 95 VAL MG2 1 111 PHE QD 1.800 . 4.800 4.728 4.003 4.850 0.050 5 0 "[ . 1 . 2]" 1
1121 1 95 VAL MG2 1 111 PHE H 1.800 . 6.050 4.789 4.414 5.004 . 0 0 "[ . 1 . 2]" 1
1122 1 95 VAL MG2 1 113 PHE QE 1.800 . 5.000 3.020 1.916 4.718 . 0 0 "[ . 1 . 2]" 1
1123 1 95 VAL MG2 1 113 PHE HZ 1.800 . 6.000 4.894 3.541 6.046 0.046 11 0 "[ . 1 . 2]" 1
1124 1 95 VAL H 1 95 VAL HB 1.800 . 4.110 2.705 2.569 2.855 . 0 0 "[ . 1 . 2]" 1
1125 1 95 VAL H 1 95 VAL MG1 1.800 . 4.700 3.883 3.820 3.945 . 0 0 "[ . 1 . 2]" 1
1126 1 95 VAL H 1 95 VAL MG2 1.800 . 3.660 2.628 2.431 2.871 . 0 0 "[ . 1 . 2]" 1
1127 1 95 VAL H 1 111 PHE HB3 1.800 . 5.280 4.546 4.246 5.442 0.162 6 0 "[ . 1 . 2]" 1
1128 1 95 VAL H 1 111 PHE HB2 1.800 . 5.280 3.525 3.125 5.093 . 0 0 "[ . 1 . 2]" 1
1129 1 95 VAL H 1 112 SER HA 1.800 . 4.650 3.440 3.055 3.874 . 0 0 "[ . 1 . 2]" 1
1130 1 96 ASP HA 1 97 VAL MG2 1.800 . 4.570 3.554 3.440 3.733 . 0 0 "[ . 1 . 2]" 1
1131 1 96 ASP HA 1 97 VAL H 1.800 . 3.470 2.146 2.075 2.182 . 0 0 "[ . 1 . 2]" 1
1132 1 96 ASP HA 1 110 THR HA 1.800 . 4.750 2.153 1.865 2.642 . 0 0 "[ . 1 . 2]" 1
1133 1 96 ASP HA 1 111 PHE H 1.800 . 5.040 3.221 2.837 3.625 . 0 0 "[ . 1 . 2]" 1
1134 1 96 ASP QB 1 98 TYR QE 1.800 . 3.610 3.073 1.953 3.615 0.005 20 0 "[ . 1 . 2]" 1
1135 1 96 ASP H 1 97 VAL MG2 1.800 . 5.190 4.272 4.033 4.498 . 0 0 "[ . 1 . 2]" 1
1136 1 97 VAL HA 1 97 VAL MG1 1.800 . 3.930 2.349 2.299 2.378 . 0 0 "[ . 1 . 2]" 1
1137 1 97 VAL HA 1 97 VAL MG2 1.800 . 3.710 2.446 2.405 2.503 . 0 0 "[ . 1 . 2]" 1
1138 1 97 VAL HA 1 98 TYR QD 1.800 . 4.770 3.687 2.986 4.063 . 0 0 "[ . 1 . 2]" 1
1139 1 97 VAL HA 1 98 TYR H 1.800 . 3.790 2.150 2.110 2.208 . 0 0 "[ . 1 . 2]" 1
1140 1 97 VAL HB 1 98 TYR H 1.800 . 5.120 4.131 3.917 4.295 . 0 0 "[ . 1 . 2]" 1
1141 1 97 VAL HB 1 99 PHE QD 1.800 . 5.300 4.470 4.107 5.008 . 0 0 "[ . 1 . 2]" 1
1142 1 97 VAL HB 1 109 LEU QB 1.800 . 4.510 2.552 2.137 3.113 . 0 0 "[ . 1 . 2]" 1
1143 1 97 VAL HB 1 109 LEU H 1.800 . 4.830 3.275 2.811 3.728 . 0 0 "[ . 1 . 2]" 1
1144 1 97 VAL MG1 1 98 TYR H 1.800 . 3.790 2.692 2.345 2.977 . 0 0 "[ . 1 . 2]" 1
1145 1 97 VAL MG1 1 99 PHE HA 1.800 . 6.050 4.347 4.175 4.499 . 0 0 "[ . 1 . 2]" 1
1146 1 97 VAL MG1 1 99 PHE QD 1.800 . 4.350 3.432 3.196 3.559 . 0 0 "[ . 1 . 2]" 1
1147 1 97 VAL MG1 1 99 PHE QE 1.800 . 4.280 2.765 2.535 2.973 . 0 0 "[ . 1 . 2]" 1
1148 1 97 VAL MG1 1 99 PHE HZ 1.800 . 3.720 2.697 2.487 2.866 . 0 0 "[ . 1 . 2]" 1
1149 1 97 VAL MG1 1 109 LEU MD1 1.800 . 4.580 3.895 3.452 4.616 0.036 7 0 "[ . 1 . 2]" 1
1150 1 97 VAL MG2 1 98 TYR H 1.800 . 4.580 4.103 3.945 4.203 . 0 0 "[ . 1 . 2]" 1
1151 1 97 VAL MG2 1 99 PHE QE 1.800 . 4.850 4.196 3.865 4.572 . 0 0 "[ . 1 . 2]" 1
1152 1 97 VAL MG2 1 109 LEU H 1.800 . 5.370 4.511 4.095 4.869 . 0 0 "[ . 1 . 2]" 1
1153 1 97 VAL MG2 1 111 PHE QD 1.800 . 4.150 2.278 1.961 3.078 . 0 0 "[ . 1 . 2]" 1
1154 1 97 VAL H 1 97 VAL HB 1.800 . 4.050 2.622 2.573 2.712 . 0 0 "[ . 1 . 2]" 1
1155 1 97 VAL H 1 97 VAL MG1 1.800 . 4.710 3.839 3.810 3.869 . 0 0 "[ . 1 . 2]" 1
1156 1 97 VAL H 1 97 VAL MG2 1.800 . 3.760 2.389 2.248 2.511 . 0 0 "[ . 1 . 2]" 1
1157 1 97 VAL H 1 98 TYR H 1.800 . 5.250 4.415 4.310 4.519 . 0 0 "[ . 1 . 2]" 1
1158 1 97 VAL H 1 109 LEU H 1.800 . 4.230 3.245 2.896 3.560 . 0 0 "[ . 1 . 2]" 1
1159 1 98 TYR HA 1 98 TYR QD 1.800 . 4.360 2.916 2.673 3.155 . 0 0 "[ . 1 . 2]" 1
1160 1 98 TYR HA 1 99 PHE QD 1.800 . 5.210 4.282 3.723 4.825 . 0 0 "[ . 1 . 2]" 1
1161 1 98 TYR HA 1 99 PHE H 1.800 . 3.650 2.143 2.122 2.177 . 0 0 "[ . 1 . 2]" 1
1162 1 98 TYR HA 1 106 LEU MD1 1.800 . 4.460 3.374 2.760 3.869 . 0 0 "[ . 1 . 2]" 1
1163 1 98 TYR HA 1 108 GLN HA 1.800 . 4.130 2.404 2.194 2.743 . 0 0 "[ . 1 . 2]" 1
1164 1 98 TYR HA 1 108 GLN QB 1.800 . 5.700 3.525 2.735 4.377 . 0 0 "[ . 1 . 2]" 1
1165 1 98 TYR HA 1 108 GLN HG3 1.800 . 6.050 5.278 3.048 6.060 0.010 20 0 "[ . 1 . 2]" 1
1166 1 98 TYR HA 1 108 GLN HG2 1.800 . 6.050 5.199 2.998 6.158 0.108 4 0 "[ . 1 . 2]" 1
1167 1 98 TYR HA 1 109 LEU H 1.800 . 4.760 3.545 3.254 3.841 . 0 0 "[ . 1 . 2]" 1
1168 1 98 TYR QB 1 106 LEU MD1 1.800 . 5.000 2.380 1.737 3.406 0.063 4 0 "[ . 1 . 2]" 1
1169 1 98 TYR HB3 1 106 LEU MD2 1.800 . 6.050 3.417 2.108 4.339 . 0 0 "[ . 1 . 2]" 1
1170 1 98 TYR HB2 1 106 LEU MD2 1.800 . 6.050 4.750 3.305 5.656 . 0 0 "[ . 1 . 2]" 1
1171 1 98 TYR QD 1 106 LEU MD1 1.800 . 4.200 2.437 1.698 3.197 0.102 5 0 "[ . 1 . 2]" 1
1172 1 98 TYR QD 1 106 LEU MD2 1.800 . 4.200 3.087 2.136 4.044 . 0 0 "[ . 1 . 2]" 1
1173 1 98 TYR QD 1 106 LEU HG 1.800 . 5.000 3.849 2.805 4.780 . 0 0 "[ . 1 . 2]" 1
1174 1 98 TYR QD 1 108 GLN HB3 1.800 . 5.840 3.158 1.968 5.522 . 0 0 "[ . 1 . 2]" 1
1175 1 98 TYR QD 1 108 GLN HB2 1.800 . 5.840 3.501 2.779 4.397 . 0 0 "[ . 1 . 2]" 1
1176 1 98 TYR QE 1 106 LEU MD1 1.800 . 5.000 4.088 2.821 5.035 0.035 13 0 "[ . 1 . 2]" 1
1177 1 98 TYR QE 1 106 LEU MD2 1.800 . 5.000 4.237 2.983 4.986 . 0 0 "[ . 1 . 2]" 1
1178 1 98 TYR QE 1 106 LEU HG 1.800 . 5.580 5.315 4.214 5.711 0.131 5 0 "[ . 1 . 2]" 1
1179 1 98 TYR QE 1 108 GLN HB3 1.800 . 5.760 3.604 2.474 5.305 . 0 0 "[ . 1 . 2]" 1
1180 1 98 TYR QE 1 108 GLN HB2 1.800 . 5.760 3.563 2.616 4.645 . 0 0 "[ . 1 . 2]" 1
1181 1 98 TYR QE 1 108 GLN HG3 1.800 . 5.360 4.382 2.534 5.392 0.032 16 0 "[ . 1 . 2]" 1
1182 1 98 TYR QE 1 108 GLN HG2 1.800 . 5.360 4.253 2.253 5.111 . 0 0 "[ . 1 . 2]" 1
1183 1 98 TYR H 1 98 TYR QD 1.800 . 4.070 2.643 2.274 3.002 . 0 0 "[ . 1 . 2]" 1
1184 1 99 PHE HA 1 99 PHE QD 1.800 . 4.360 2.655 2.261 2.945 . 0 0 "[ . 1 . 2]" 1
1185 1 99 PHE HA 1 100 GLN H 1.800 . 3.500 2.160 2.115 2.192 . 0 0 "[ . 1 . 2]" 1
1186 1 99 PHE QB 1 100 GLN H 1.800 . 4.330 3.381 3.043 3.448 . 0 0 "[ . 1 . 2]" 1
1187 1 99 PHE QB 1 107 GLN H 1.800 . 5.390 3.111 2.874 3.400 . 0 0 "[ . 1 . 2]" 1
1188 1 99 PHE HB3 1 107 GLN QB 1.800 . 5.330 3.753 3.303 4.396 . 0 0 "[ . 1 . 2]" 1
1189 1 99 PHE HB2 1 107 GLN QB 1.800 . 5.330 2.378 1.940 3.054 . 0 0 "[ . 1 . 2]" 1
1190 1 99 PHE QD 1 100 GLN H 1.800 . 4.860 4.150 3.864 4.480 . 0 0 "[ . 1 . 2]" 1
1191 1 99 PHE QD 1 107 GLN H 1.800 . 6.050 4.714 4.399 4.986 . 0 0 "[ . 1 . 2]" 1
1192 1 99 PHE QD 1 109 LEU QB 1.800 . 5.730 3.952 3.319 4.325 . 0 0 "[ . 1 . 2]" 1
1193 1 99 PHE QD 1 109 LEU MD1 1.800 . 4.170 2.939 2.384 3.284 . 0 0 "[ . 1 . 2]" 1
1194 1 99 PHE QD 1 109 LEU HG 1.800 . 4.070 2.901 2.329 3.347 . 0 0 "[ . 1 . 2]" 1
1195 1 99 PHE QD 1 109 LEU H 1.800 . 5.410 4.104 3.569 4.678 . 0 0 "[ . 1 . 2]" 1
1196 1 99 PHE QE 1 109 LEU QB 1.800 . 4.710 3.048 2.599 3.654 . 0 0 "[ . 1 . 2]" 1
1197 1 99 PHE QE 1 109 LEU MD1 1.800 . 3.700 1.791 1.760 1.876 0.040 7 0 "[ . 1 . 2]" 1
1198 1 99 PHE QE 1 109 LEU MD2 1.800 . 5.000 4.384 4.108 4.593 . 0 0 "[ . 1 . 2]" 1
1199 1 99 PHE QE 1 109 LEU HG 1.800 . 4.770 3.304 2.743 3.788 . 0 0 "[ . 1 . 2]" 1
1200 1 99 PHE H 1 99 PHE QD 1.800 . 4.300 3.033 2.693 3.457 . 0 0 "[ . 1 . 2]" 1
1201 1 99 PHE H 1 106 LEU MD1 1.800 . 5.000 3.330 2.710 4.251 . 0 0 "[ . 1 . 2]" 1
1202 1 99 PHE H 1 107 GLN QB 1.800 . 4.770 3.538 3.070 4.168 . 0 0 "[ . 1 . 2]" 1
1203 1 99 PHE H 1 107 GLN H 1.800 . 4.460 3.110 2.831 3.378 . 0 0 "[ . 1 . 2]" 1
1204 1 99 PHE H 1 108 GLN HA 1.800 . 4.590 3.289 2.789 3.750 . 0 0 "[ . 1 . 2]" 1
1205 1 100 GLN HA 1 101 ASP H 1.800 . 3.400 2.194 2.075 2.418 . 0 0 "[ . 1 . 2]" 1
1206 1 100 GLN HA 1 106 LEU HA 1.800 . 4.220 2.308 1.996 2.888 . 0 0 "[ . 1 . 2]" 1
1207 1 100 GLN HA 1 106 LEU MD1 1.800 . 4.530 3.455 2.360 4.620 0.090 5 0 "[ . 1 . 2]" 1
1208 1 100 GLN HA 1 106 LEU MD2 1.800 . 4.960 4.334 2.510 4.994 0.034 14 0 "[ . 1 . 2]" 1
1209 1 100 GLN HA 1 107 GLN QB 1.800 . 5.650 5.125 4.643 5.677 0.027 6 0 "[ . 1 . 2]" 1
1210 1 100 GLN HA 1 107 GLN H 1.800 . 5.220 3.472 3.247 3.835 . 0 0 "[ . 1 . 2]" 1
1211 1 100 GLN QB 1 100 GLN HE21 1.800 . 4.530 2.415 1.752 3.755 0.048 10 0 "[ . 1 . 2]" 1
1212 1 100 GLN QB 1 100 GLN HE22 1.800 . 4.700 3.462 3.180 4.070 . 0 0 "[ . 1 . 2]" 1
1213 1 100 GLN QB 1 101 ASP H 1.800 . 4.050 3.138 2.361 3.819 . 0 0 "[ . 1 . 2]" 1
1214 1 100 GLN QB 1 106 LEU HA 1.800 . 5.630 3.534 2.813 4.176 . 0 0 "[ . 1 . 2]" 1
1215 1 100 GLN QB 1 106 LEU QB 1.800 . 5.870 3.439 2.038 5.205 . 0 0 "[ . 1 . 2]" 1
1216 1 100 GLN QB 1 106 LEU MD1 1.800 . 5.000 2.909 1.762 5.038 0.038 17 0 "[ . 1 . 2]" 1
1217 1 100 GLN QB 1 106 LEU MD2 1.800 . 4.110 3.418 1.767 4.161 0.051 1 0 "[ . 1 . 2]" 1
1218 1 100 GLN HE22 1 106 LEU MD2 1.800 . 5.940 4.972 3.632 5.975 0.035 6 0 "[ . 1 . 2]" 1
1219 1 100 GLN QG 1 106 LEU HA 1.800 . 5.210 4.300 2.884 5.134 . 0 0 "[ . 1 . 2]" 1
1220 1 100 GLN HG3 1 101 ASP H 1.800 . 4.910 3.749 2.644 4.943 0.033 18 0 "[ . 1 . 2]" 1
1221 1 100 GLN HG2 1 101 ASP H 1.800 . 4.910 4.086 2.342 4.997 0.087 9 0 "[ . 1 . 2]" 1
1222 1 100 GLN H 1 100 GLN HG3 1.800 . 5.150 3.724 3.020 4.708 . 0 0 "[ . 1 . 2]" 1
1223 1 100 GLN H 1 100 GLN HG2 1.800 . 5.150 3.200 1.962 4.608 . 0 0 "[ . 1 . 2]" 1
1224 1 100 GLN H 1 101 ASP H 1.800 . 4.970 4.411 4.321 4.502 . 0 0 "[ . 1 . 2]" 1
1225 1 101 ASP QB 1 102 SER H 1.800 . 3.940 2.985 2.042 3.573 . 0 0 "[ . 1 . 2]" 1
1226 1 101 ASP QB 1 103 PHE H 1.800 . 4.800 3.143 1.897 3.671 . 0 0 "[ . 1 . 2]" 1
1227 1 101 ASP H 1 105 GLN H 1.800 . 4.300 3.437 2.879 3.767 . 0 0 "[ . 1 . 2]" 1
1228 1 101 ASP H 1 106 LEU HA 1.800 . 5.120 3.588 2.793 4.198 . 0 0 "[ . 1 . 2]" 1
1229 1 101 ASP H 1 106 LEU MD2 1.800 . 6.000 5.506 4.018 6.124 0.124 7 0 "[ . 1 . 2]" 1
1230 1 102 SER QB 1 103 PHE H 1.800 . 4.250 3.312 2.818 3.838 . 0 0 "[ . 1 . 2]" 1
1231 1 102 SER H 1 103 PHE H 1.800 . 4.190 2.588 2.431 2.784 . 0 0 "[ . 1 . 2]" 1
1232 1 103 PHE HA 1 103 PHE QD 1.800 . 4.420 2.657 2.266 2.962 . 0 0 "[ . 1 . 2]" 1
1233 1 103 PHE QB 1 104 GLY H 1.800 . 4.060 3.103 2.911 3.506 . 0 0 "[ . 1 . 2]" 1
1234 1 103 PHE QB 1 105 GLN QG 1.800 . 5.600 4.228 2.386 5.624 0.024 11 0 "[ . 1 . 2]" 1
1235 1 103 PHE QB 1 105 GLN H 1.800 . 4.300 3.078 2.489 3.590 . 0 0 "[ . 1 . 2]" 1
1236 1 103 PHE QD 1 104 GLY H 1.800 . 5.170 4.290 3.707 4.836 . 0 0 "[ . 1 . 2]" 1
1237 1 103 PHE H 1 103 PHE HB3 1.800 . 4.050 2.800 2.290 3.663 . 0 0 "[ . 1 . 2]" 1
1238 1 103 PHE H 1 103 PHE HB2 1.800 . 4.050 2.606 2.345 2.781 . 0 0 "[ . 1 . 2]" 1
1239 1 103 PHE H 1 103 PHE QD 1.800 . 4.600 3.802 2.616 4.230 . 0 0 "[ . 1 . 2]" 1
1240 1 103 PHE H 1 105 GLN H 1.800 . 4.460 3.567 3.286 3.822 . 0 0 "[ . 1 . 2]" 1
1241 1 104 GLY H 1 105 GLN H 1.800 . 3.530 2.135 1.956 2.359 . 0 0 "[ . 1 . 2]" 1
1242 1 105 GLN HA 1 105 GLN QG 1.800 . 3.720 2.802 2.407 3.128 . 0 0 "[ . 1 . 2]" 1
1243 1 105 GLN HA 1 106 LEU HB3 1.800 . 5.710 4.545 4.355 4.850 . 0 0 "[ . 1 . 2]" 1
1244 1 105 GLN HA 1 106 LEU HB2 1.800 . 5.710 4.685 4.128 5.772 0.062 20 0 "[ . 1 . 2]" 1
1245 1 105 GLN HA 1 106 LEU H 1.800 . 3.280 2.198 2.138 2.312 . 0 0 "[ . 1 . 2]" 1
1246 1 105 GLN QB 1 105 GLN QE 1.800 . 4.600 2.486 1.731 3.545 0.069 5 0 "[ . 1 . 2]" 1
1247 1 105 GLN QB 1 106 LEU H 1.800 . 3.940 3.437 2.602 3.943 0.003 11 0 "[ . 1 . 2]" 1
1248 1 105 GLN HG3 1 106 LEU H 1.800 . 5.390 4.054 2.687 5.415 0.025 19 0 "[ . 1 . 2]" 1
1249 1 105 GLN HG2 1 106 LEU H 1.800 . 5.390 4.289 2.565 5.061 . 0 0 "[ . 1 . 2]" 1
1250 1 105 GLN H 1 105 GLN HB3 1.800 . 3.990 2.933 2.320 3.696 . 0 0 "[ . 1 . 2]" 1
1251 1 105 GLN H 1 105 GLN HB2 1.800 . 3.990 2.571 2.351 2.835 . 0 0 "[ . 1 . 2]" 1
1252 1 105 GLN H 1 105 GLN QG 1.800 . 4.000 3.381 1.977 4.034 0.034 3 0 "[ . 1 . 2]" 1
1253 1 105 GLN H 1 106 LEU H 1.800 . 5.210 4.514 4.322 4.619 . 0 0 "[ . 1 . 2]" 1
1254 1 106 LEU HA 1 106 LEU MD1 1.800 . 3.630 2.541 2.002 3.647 0.017 19 0 "[ . 1 . 2]" 1
1255 1 106 LEU HA 1 106 LEU MD2 1.800 . 4.800 3.530 1.936 4.104 . 0 0 "[ . 1 . 2]" 1
1256 1 106 LEU HA 1 107 GLN H 1.800 . 3.660 2.133 2.101 2.198 . 0 0 "[ . 1 . 2]" 1
1257 1 106 LEU QB 1 106 LEU MD1 1.800 . 3.490 2.286 2.108 2.378 . 0 0 "[ . 1 . 2]" 1
1258 1 106 LEU HB3 1 106 LEU MD2 1.800 . 3.740 2.472 2.138 3.199 . 0 0 "[ . 1 . 2]" 1
1259 1 106 LEU HB3 1 107 GLN H 1.800 . 5.040 4.248 3.920 4.380 . 0 0 "[ . 1 . 2]" 1
1260 1 106 LEU HB2 1 106 LEU MD2 1.800 . 3.740 2.431 2.293 2.701 . 0 0 "[ . 1 . 2]" 1
1261 1 106 LEU HB2 1 107 GLN H 1.800 . 5.040 4.074 2.783 4.530 . 0 0 "[ . 1 . 2]" 1
1262 1 106 LEU MD1 1 107 GLN H 1.800 . 3.990 2.691 2.301 3.483 . 0 0 "[ . 1 . 2]" 1
1263 1 106 LEU HG 1 107 GLN H 1.800 . 5.300 4.013 3.321 5.000 . 0 0 "[ . 1 . 2]" 1
1264 1 106 LEU H 1 106 LEU HB3 1.800 . 3.980 2.788 2.498 3.377 . 0 0 "[ . 1 . 2]" 1
1265 1 106 LEU H 1 106 LEU HB2 1.800 . 3.980 3.263 2.758 3.949 . 0 0 "[ . 1 . 2]" 1
1266 1 106 LEU H 1 106 LEU MD1 1.800 . 5.000 4.180 3.550 4.388 . 0 0 "[ . 1 . 2]" 1
1267 1 106 LEU H 1 106 LEU MD2 1.800 . 5.000 4.291 3.330 4.696 . 0 0 "[ . 1 . 2]" 1
1268 1 106 LEU H 1 106 LEU HG 1.800 . 5.690 4.150 2.325 5.079 . 0 0 "[ . 1 . 2]" 1
1269 1 106 LEU H 1 107 GLN H 1.800 . 4.870 4.188 3.964 4.434 . 0 0 "[ . 1 . 2]" 1
1270 1 107 GLN HA 1 107 GLN QE 1.800 . 4.940 3.908 2.817 4.667 . 0 0 "[ . 1 . 2]" 1
1271 1 107 GLN HA 1 108 GLN H 1.800 . 3.280 2.149 2.080 2.302 . 0 0 "[ . 1 . 2]" 1
1272 1 107 GLN QE 1 109 LEU MD2 1.800 . 6.050 3.938 2.271 5.659 . 0 0 "[ . 1 . 2]" 1
1273 1 107 GLN QG 1 108 GLN H 1.800 . 4.620 3.611 2.586 4.721 0.101 5 0 "[ . 1 . 2]" 1
1274 1 107 GLN H 1 107 GLN QB 1.800 . 3.900 2.443 2.369 2.597 . 0 0 "[ . 1 . 2]" 1
1275 1 107 GLN H 1 107 GLN HE21 1.800 . 6.000 5.421 4.072 5.908 . 0 0 "[ . 1 . 2]" 1
1276 1 107 GLN H 1 107 GLN QG 1.800 . 4.930 3.646 2.671 4.160 . 0 0 "[ . 1 . 2]" 1
1277 1 108 GLN HA 1 109 LEU HG 1.800 . 4.980 3.948 3.660 4.471 . 0 0 "[ . 1 . 2]" 1
1278 1 108 GLN HA 1 109 LEU H 1.800 . 3.410 2.131 2.091 2.203 . 0 0 "[ . 1 . 2]" 1
1279 1 108 GLN QB 1 108 GLN HE21 1.800 . 4.970 3.193 1.729 3.998 0.071 7 0 "[ . 1 . 2]" 1
1280 1 108 GLN QB 1 108 GLN HE22 1.800 . 4.970 3.837 3.179 4.326 . 0 0 "[ . 1 . 2]" 1
1281 1 108 GLN QB 1 109 LEU MD2 1.800 . 5.640 4.875 4.230 5.149 . 0 0 "[ . 1 . 2]" 1
1282 1 108 GLN HB3 1 109 LEU H 1.800 . 5.260 4.140 3.248 4.447 . 0 0 "[ . 1 . 2]" 1
1283 1 108 GLN HB2 1 109 LEU H 1.800 . 5.260 3.662 2.837 4.507 . 0 0 "[ . 1 . 2]" 1
1284 1 108 GLN QG 1 109 LEU MD2 1.800 . 5.260 4.722 4.327 5.421 0.161 17 0 "[ . 1 . 2]" 1
1285 1 108 GLN H 1 108 GLN HB3 1.800 . 3.790 2.920 2.347 3.644 . 0 0 "[ . 1 . 2]" 1
1286 1 108 GLN H 1 108 GLN HB2 1.800 . 3.790 3.356 2.434 3.816 0.026 9 0 "[ . 1 . 2]" 1
1287 1 108 GLN H 1 108 GLN HG3 1.800 . 5.410 3.383 1.987 4.720 . 0 0 "[ . 1 . 2]" 1
1288 1 108 GLN H 1 108 GLN HG2 1.800 . 5.410 3.072 1.944 4.641 . 0 0 "[ . 1 . 2]" 1
1289 1 108 GLN H 1 109 LEU MD2 1.800 . 5.000 4.328 3.785 5.003 0.003 19 0 "[ . 1 . 2]" 1
1290 1 108 GLN H 1 109 LEU H 1.800 . 5.010 4.361 4.252 4.526 . 0 0 "[ . 1 . 2]" 1
1291 1 109 LEU HA 1 109 LEU MD1 1.800 . 4.460 3.865 3.829 3.908 . 0 0 "[ . 1 . 2]" 1
1292 1 109 LEU HA 1 109 LEU MD2 1.800 . 3.170 2.058 1.910 2.146 . 0 0 "[ . 1 . 2]" 1
1293 1 109 LEU HA 1 109 LEU HG 1.800 . 4.210 3.172 2.980 3.348 . 0 0 "[ . 1 . 2]" 1
1294 1 109 LEU HA 1 110 THR H 1.800 . 2.950 2.143 2.110 2.173 . 0 0 "[ . 1 . 2]" 1
1295 1 109 LEU QB 1 110 THR H 1.800 . 3.590 3.418 3.224 3.497 . 0 0 "[ . 1 . 2]" 1
1296 1 109 LEU HB3 1 109 LEU MD2 1.800 . 4.360 2.392 2.330 2.451 . 0 0 "[ . 1 . 2]" 1
1297 1 109 LEU HB2 1 109 LEU MD2 1.800 . 4.360 3.201 3.192 3.210 . 0 0 "[ . 1 . 2]" 1
1298 1 109 LEU MD2 1 110 THR H 1.800 . 4.390 3.758 3.413 3.913 . 0 0 "[ . 1 . 2]" 1
1299 1 109 LEU H 1 109 LEU QB 1.800 . 3.820 2.560 2.387 2.663 . 0 0 "[ . 1 . 2]" 1
1300 1 109 LEU H 1 109 LEU MD1 1.800 . 5.000 4.016 3.860 4.226 . 0 0 "[ . 1 . 2]" 1
1301 1 109 LEU H 1 109 LEU MD2 1.800 . 3.990 3.656 3.346 3.966 . 0 0 "[ . 1 . 2]" 1
1302 1 109 LEU H 1 109 LEU HG 1.800 . 4.460 2.890 2.624 3.301 . 0 0 "[ . 1 . 2]" 1
1303 1 109 LEU H 1 110 THR H 1.800 . 5.080 4.201 4.063 4.344 . 0 0 "[ . 1 . 2]" 1
1304 1 110 THR HA 1 110 THR MG 1.800 . 3.610 2.324 2.250 2.398 . 0 0 "[ . 1 . 2]" 1
1305 1 110 THR HA 1 111 PHE QB 1.800 . 4.590 4.422 4.350 4.497 . 0 0 "[ . 1 . 2]" 1
1306 1 110 THR HA 1 111 PHE H 1.800 . 3.580 2.151 2.131 2.175 . 0 0 "[ . 1 . 2]" 1
1307 1 110 THR HB 1 111 PHE HA 1.800 . 4.940 4.752 4.501 4.867 . 0 0 "[ . 1 . 2]" 1
1308 1 110 THR HB 1 111 PHE H 1.800 . 5.020 4.249 4.191 4.326 . 0 0 "[ . 1 . 2]" 1
1309 1 110 THR MG 1 111 PHE H 1.800 . 3.560 2.981 2.865 3.063 . 0 0 "[ . 1 . 2]" 1
1310 1 110 THR MG 1 112 SER HA 1.800 . 5.650 4.514 4.231 4.961 . 0 0 "[ . 1 . 2]" 1
1311 1 110 THR MG 1 112 SER QB 1.800 . 4.440 3.919 3.041 4.457 0.017 15 0 "[ . 1 . 2]" 1
1312 1 110 THR MG 1 112 SER H 1.800 . 5.050 4.199 3.911 4.634 . 0 0 "[ . 1 . 2]" 1
1313 1 110 THR H 1 110 THR HB 1.800 . 3.330 2.620 2.550 2.735 . 0 0 "[ . 1 . 2]" 1
1314 1 110 THR H 1 110 THR MG 1.800 . 4.590 3.813 3.792 3.857 . 0 0 "[ . 1 . 2]" 1
1315 1 110 THR H 1 111 PHE H 1.800 . 5.120 4.355 4.307 4.413 . 0 0 "[ . 1 . 2]" 1
1316 1 111 PHE HA 1 111 PHE QD 1.800 . 3.980 2.807 2.590 3.742 . 0 0 "[ . 1 . 2]" 1
1317 1 111 PHE HA 1 112 SER H 1.800 . 3.050 2.143 2.091 2.205 . 0 0 "[ . 1 . 2]" 1
1318 1 111 PHE HB3 1 112 SER H 1.800 . 5.060 3.480 3.014 4.105 . 0 0 "[ . 1 . 2]" 1
1319 1 111 PHE HB2 1 112 SER H 1.800 . 5.060 4.235 3.195 4.360 . 0 0 "[ . 1 . 2]" 1
1320 1 111 PHE QD 1 112 SER H 1.800 . 4.310 4.176 3.841 4.338 0.028 4 0 "[ . 1 . 2]" 1
1321 1 111 PHE H 1 111 PHE QD 1.800 . 5.080 2.833 2.453 3.123 . 0 0 "[ . 1 . 2]" 1
1322 1 111 PHE H 1 112 SER H 1.800 . 4.570 4.340 4.260 4.490 . 0 0 "[ . 1 . 2]" 1
1323 1 112 SER HA 1 113 PHE QB 1.800 . 5.170 4.382 4.223 4.470 . 0 0 "[ . 1 . 2]" 1
1324 1 112 SER HA 1 113 PHE H 1.800 . 3.720 2.143 2.108 2.216 . 0 0 "[ . 1 . 2]" 1
1325 1 112 SER QB 1 113 PHE HA 1.800 . 5.870 4.556 4.340 4.734 . 0 0 "[ . 1 . 2]" 1
1326 1 112 SER HB3 1 113 PHE H 1.800 . 4.390 4.011 3.390 4.397 0.007 10 0 "[ . 1 . 2]" 1
1327 1 112 SER HB2 1 113 PHE H 1.800 . 4.390 4.076 3.005 4.456 0.066 3 0 "[ . 1 . 2]" 1
1328 1 112 SER H 1 112 SER QB 1.800 . 3.600 2.698 2.330 3.062 . 0 0 "[ . 1 . 2]" 1
1329 1 112 SER H 1 113 PHE H 1.800 . 4.980 4.211 4.074 4.420 . 0 0 "[ . 1 . 2]" 1
1330 1 113 PHE HA 1 113 PHE QD 1.800 . 4.510 2.695 1.788 3.172 0.012 17 0 "[ . 1 . 2]" 1
1331 1 113 PHE H 1 113 PHE QD 1.800 . 5.580 2.760 2.005 3.655 . 0 0 "[ . 1 . 2]" 1
1332 1 115 ASN HA 1 116 ASP H 1.800 . 3.720 2.685 2.086 3.569 . 0 0 "[ . 1 . 2]" 1
1333 1 116 ASP HA 1 117 SER H 1.800 . 3.370 2.732 2.090 3.513 0.143 10 0 "[ . 1 . 2]" 1
1334 1 116 ASP QB 1 117 SER H 1.800 . 4.460 3.265 1.798 3.988 0.002 7 0 "[ . 1 . 2]" 1
1335 1 117 SER HA 1 118 SER H 1.800 . 3.470 2.638 2.104 3.503 0.033 15 0 "[ . 1 . 2]" 1
1336 1 117 SER QB 1 118 SER H 1.800 . 3.970 3.340 2.004 4.015 0.045 3 0 "[ . 1 . 2]" 1
1337 1 117 SER H 1 117 SER QB 1.800 . 3.890 2.868 2.223 3.394 . 0 0 "[ . 1 . 2]" 1
1338 1 119 LYS QE 1 119 LYS QG 1.800 . 3.370 2.304 2.134 2.721 . 0 0 "[ . 1 . 2]" 1
1339 1 119 LYS H 1 119 LYS QB 1.800 . 3.380 2.755 2.276 3.388 0.008 1 0 "[ . 1 . 2]" 1
1340 1 119 LYS H 1 119 LYS QG 1.800 . 4.610 3.223 2.037 4.189 . 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 78
_Distance_constraint_stats_list.Viol_count 137
_Distance_constraint_stats_list.Viol_total 37.639
_Distance_constraint_stats_list.Viol_max 0.065
_Distance_constraint_stats_list.Viol_rms 0.0053
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0012
_Distance_constraint_stats_list.Viol_average_violations_only 0.0137
_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 14 SER 0.023 0.009 3 0 "[ . 1 . 2]"
1 16 GLU 0.017 0.009 3 0 "[ . 1 . 2]"
1 18 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 LYS 0.008 0.008 12 0 "[ . 1 . 2]"
1 27 GLY 0.015 0.011 6 0 "[ . 1 . 2]"
1 28 GLU 0.020 0.010 17 0 "[ . 1 . 2]"
1 30 ALA 0.052 0.024 5 0 "[ . 1 . 2]"
1 32 ILE 0.172 0.025 17 0 "[ . 1 . 2]"
1 33 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 CYS 0.088 0.026 11 0 "[ . 1 . 2]"
1 35 GLN 0.017 0.009 3 0 "[ . 1 . 2]"
1 36 LEU 0.002 0.002 9 0 "[ . 1 . 2]"
1 37 HIS 0.023 0.009 3 0 "[ . 1 . 2]"
1 47 TYR 0.030 0.009 13 0 "[ . 1 . 2]"
1 48 PHE 0.102 0.028 3 0 "[ . 1 . 2]"
1 49 ILE 0.152 0.036 15 0 "[ . 1 . 2]"
1 50 ARG 0.108 0.025 14 0 "[ . 1 . 2]"
1 52 PHE 0.059 0.018 8 0 "[ . 1 . 2]"
1 59 THR 0.112 0.039 6 0 "[ . 1 . 2]"
1 60 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 LYS 0.069 0.020 16 0 "[ . 1 . 2]"
1 62 MET 0.028 0.017 10 0 "[ . 1 . 2]"
1 63 SER 0.393 0.065 16 0 "[ . 1 . 2]"
1 65 GLY 0.004 0.004 16 0 "[ . 1 . 2]"
1 66 THR 0.025 0.017 10 0 "[ . 1 . 2]"
1 68 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 TYR 0.152 0.036 15 0 "[ . 1 . 2]"
1 76 LEU 0.030 0.009 13 0 "[ . 1 . 2]"
1 79 GLU 0.002 0.002 9 0 "[ . 1 . 2]"
1 81 PHE 0.088 0.026 11 0 "[ . 1 . 2]"
1 82 ARG 0.393 0.065 16 0 "[ . 1 . 2]"
1 83 LEU 0.172 0.025 17 0 "[ . 1 . 2]"
1 84 TYR 0.069 0.020 16 0 "[ . 1 . 2]"
1 85 TYR 0.052 0.024 5 0 "[ . 1 . 2]"
1 86 THR 0.112 0.039 6 0 "[ . 1 . 2]"
1 87 SER 0.027 0.011 6 0 "[ . 1 . 2]"
1 93 GLN 0.089 0.038 8 0 "[ . 1 . 2]"
1 95 VAL 0.033 0.026 4 0 "[ . 1 . 2]"
1 96 ASP 0.059 0.018 8 0 "[ . 1 . 2]"
1 97 VAL 0.011 0.010 10 0 "[ . 1 . 2]"
1 98 TYR 0.108 0.025 14 0 "[ . 1 . 2]"
1 99 PHE 0.036 0.016 15 0 "[ . 1 . 2]"
1 100 GLN 0.102 0.028 3 0 "[ . 1 . 2]"
1 101 ASP 0.271 0.044 17 0 "[ . 1 . 2]"
1 104 GLY 0.244 0.044 17 0 "[ . 1 . 2]"
1 105 GLN 0.027 0.023 15 0 "[ . 1 . 2]"
1 107 GLN 0.036 0.016 15 0 "[ . 1 . 2]"
1 109 LEU 0.011 0.010 10 0 "[ . 1 . 2]"
1 111 PHE 0.033 0.026 4 0 "[ . 1 . 2]"
1 113 PHE 0.089 0.038 8 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 16 GLU H 1 35 GLN O 1.700 . 2.300 1.951 1.714 2.299 . 0 0 "[ . 1 . 2]" 2
2 1 16 GLU N 1 35 GLN O 2.700 2.700 3.300 2.888 2.691 3.156 0.009 3 0 "[ . 1 . 2]" 2
3 1 18 MET H 1 33 ARG O 1.700 . 2.300 2.000 1.777 2.272 . 0 0 "[ . 1 . 2]" 2
4 1 18 MET N 1 33 ARG O 2.700 2.700 3.300 2.943 2.739 3.246 . 0 0 "[ . 1 . 2]" 2
5 1 27 GLY H 1 87 SER O 1.700 . 2.300 1.843 1.714 2.169 . 0 0 "[ . 1 . 2]" 2
6 1 27 GLY N 1 87 SER O 2.700 2.700 3.300 2.803 2.689 3.094 0.011 6 0 "[ . 1 . 2]" 2
7 1 25 LYS O 1 28 GLU H 1.700 . 2.300 2.104 1.937 2.308 0.008 12 0 "[ . 1 . 2]" 2
8 1 25 LYS O 1 28 GLU N 2.700 2.700 3.300 3.018 2.843 3.234 . 0 0 "[ . 1 . 2]" 2
9 1 30 ALA H 1 85 TYR O 1.700 . 2.300 1.791 1.709 1.861 . 0 0 "[ . 1 . 2]" 2
10 1 30 ALA N 1 85 TYR O 2.700 2.700 3.300 2.742 2.676 2.832 0.024 5 0 "[ . 1 . 2]" 2
11 1 32 ILE H 1 83 LEU O 1.700 . 2.300 1.759 1.710 1.826 . 0 0 "[ . 1 . 2]" 2
12 1 32 ILE N 1 83 LEU O 2.700 2.700 3.300 2.700 2.675 2.805 0.025 17 0 "[ . 1 . 2]" 2
13 1 34 CYS H 1 81 PHE O 1.700 . 2.300 2.079 1.802 2.326 0.026 11 0 "[ . 1 . 2]" 2
14 1 34 CYS N 1 81 PHE O 2.700 2.700 3.300 3.017 2.776 3.270 . 0 0 "[ . 1 . 2]" 2
15 1 16 GLU O 1 35 GLN H 1.700 . 2.300 1.884 1.718 2.039 . 0 0 "[ . 1 . 2]" 2
16 1 16 GLU O 1 35 GLN N 2.700 2.700 3.300 2.841 2.701 2.983 . 0 0 "[ . 1 . 2]" 2
17 1 36 LEU H 1 79 GLU O 1.700 . 2.300 1.928 1.734 2.162 . 0 0 "[ . 1 . 2]" 2
18 1 36 LEU N 1 79 GLU O 2.700 2.700 3.300 2.882 2.698 3.077 0.002 9 0 "[ . 1 . 2]" 2
19 1 14 SER O 1 37 HIS H 1.700 . 2.300 1.827 1.709 2.082 . 0 0 "[ . 1 . 2]" 2
20 1 14 SER O 1 37 HIS N 2.700 2.700 3.300 2.784 2.691 3.013 0.009 3 0 "[ . 1 . 2]" 2
21 1 48 PHE H 1 100 GLN O 1.700 . 2.300 1.853 1.707 2.304 0.004 20 0 "[ . 1 . 2]" 2
22 1 48 PHE N 1 100 GLN O 2.700 2.700 3.300 2.816 2.672 3.257 0.028 3 0 "[ . 1 . 2]" 2
23 1 49 ILE H 1 74 TYR O 1.700 . 2.300 1.764 1.698 1.890 0.002 3 0 "[ . 1 . 2]" 2
24 1 49 ILE N 1 74 TYR O 2.700 2.700 3.300 2.734 2.681 2.860 0.019 5 0 "[ . 1 . 2]" 2
25 1 50 ARG H 1 98 TYR O 1.700 . 2.300 2.023 1.749 2.321 0.021 16 0 "[ . 1 . 2]" 2
26 1 50 ARG N 1 98 TYR O 2.700 2.700 3.300 2.980 2.698 3.264 0.002 10 0 "[ . 1 . 2]" 2
27 1 52 PHE H 1 96 ASP O 1.700 . 2.300 1.896 1.701 2.260 . 0 0 "[ . 1 . 2]" 2
28 1 52 PHE N 1 96 ASP O 2.700 2.700 3.300 2.816 2.682 3.060 0.018 8 0 "[ . 1 . 2]" 2
29 1 59 THR H 1 86 THR O 1.700 . 2.300 2.009 1.750 2.339 0.039 6 0 "[ . 1 . 2]" 2
30 1 59 THR N 1 86 THR O 2.700 2.700 3.300 2.926 2.718 3.250 . 0 0 "[ . 1 . 2]" 2
31 1 61 LYS H 1 84 TYR O 1.700 . 2.300 1.866 1.730 2.104 . 0 0 "[ . 1 . 2]" 2
32 1 61 LYS N 1 84 TYR O 2.700 2.700 3.300 2.829 2.698 3.066 0.002 17 0 "[ . 1 . 2]" 2
33 1 62 MET H 1 66 THR O 1.700 . 2.300 1.779 1.699 1.888 0.001 10 0 "[ . 1 . 2]" 2
34 1 62 MET N 1 66 THR O 2.700 2.700 3.300 2.740 2.683 2.863 0.017 10 0 "[ . 1 . 2]" 2
35 1 63 SER H 1 82 ARG O 1.700 . 2.300 2.251 1.891 2.365 0.065 16 0 "[ . 1 . 2]" 2
36 1 63 SER N 1 82 ARG O 2.700 2.700 3.300 2.848 2.716 3.038 . 0 0 "[ . 1 . 2]" 2
37 1 62 MET O 1 65 GLY H 1.700 . 2.300 1.865 1.768 2.040 . 0 0 "[ . 1 . 2]" 2
38 1 62 MET O 1 65 GLY N 2.700 2.700 3.300 2.780 2.696 2.905 0.004 16 0 "[ . 1 . 2]" 2
39 1 60 LEU O 1 68 LEU H 1.700 . 2.300 1.936 1.771 2.245 . 0 0 "[ . 1 . 2]" 2
40 1 60 LEU O 1 68 LEU N 2.700 2.700 3.300 2.887 2.701 3.198 . 0 0 "[ . 1 . 2]" 2
41 1 49 ILE O 1 74 TYR H 1.700 . 2.500 2.140 1.824 2.536 0.036 15 0 "[ . 1 . 2]" 2
42 1 49 ILE O 1 74 TYR N 2.700 2.700 3.500 3.089 2.787 3.451 . 0 0 "[ . 1 . 2]" 2
43 1 47 TYR O 1 76 LEU H 1.700 . 2.300 1.807 1.713 2.025 . 0 0 "[ . 1 . 2]" 2
44 1 47 TYR O 1 76 LEU N 2.700 2.700 3.300 2.765 2.691 2.901 0.009 13 0 "[ . 1 . 2]" 2
45 1 32 ILE O 1 83 LEU H 1.700 . 2.300 1.860 1.713 2.028 . 0 0 "[ . 1 . 2]" 2
46 1 32 ILE O 1 83 LEU N 2.700 2.700 3.300 2.809 2.693 2.986 0.007 5 0 "[ . 1 . 2]" 2
47 1 61 LYS O 1 84 TYR H 1.700 . 2.300 1.803 1.721 1.989 . 0 0 "[ . 1 . 2]" 2
48 1 61 LYS O 1 84 TYR N 2.700 2.700 3.300 2.724 2.680 2.800 0.020 16 0 "[ . 1 . 2]" 2
49 1 30 ALA O 1 85 TYR H 1.700 . 2.300 1.939 1.751 2.038 . 0 0 "[ . 1 . 2]" 2
50 1 30 ALA O 1 85 TYR N 2.700 2.700 3.300 2.900 2.731 3.008 . 0 0 "[ . 1 . 2]" 2
51 1 59 THR O 1 86 THR H 1.700 . 2.300 1.787 1.711 1.895 . 0 0 "[ . 1 . 2]" 2
52 1 59 THR O 1 86 THR N 2.700 2.700 3.300 2.735 2.674 2.792 0.026 6 0 "[ . 1 . 2]" 2
53 1 28 GLU O 1 87 SER H 1.700 . 2.300 1.960 1.744 2.310 0.010 17 0 "[ . 1 . 2]" 2
54 1 28 GLU O 1 87 SER N 2.700 2.700 3.300 2.889 2.716 3.190 . 0 0 "[ . 1 . 2]" 2
55 1 95 VAL H 1 111 PHE O 1.700 . 2.300 1.823 1.710 1.964 . 0 0 "[ . 1 . 2]" 2
56 1 95 VAL N 1 111 PHE O 2.700 2.700 3.300 2.793 2.674 2.928 0.026 4 0 "[ . 1 . 2]" 2
57 1 52 PHE O 1 96 ASP H 1.700 . 2.300 2.032 1.791 2.316 0.016 20 0 "[ . 1 . 2]" 2
58 1 52 PHE O 1 96 ASP N 2.700 2.700 3.300 2.966 2.759 3.260 . 0 0 "[ . 1 . 2]" 2
59 1 97 VAL H 1 109 LEU O 1.700 . 2.300 1.868 1.732 2.109 . 0 0 "[ . 1 . 2]" 2
60 1 97 VAL N 1 109 LEU O 2.700 2.700 3.300 2.827 2.690 2.963 0.010 10 0 "[ . 1 . 2]" 2
61 1 50 ARG O 1 98 TYR H 1.700 . 2.300 1.863 1.701 2.309 0.009 20 0 "[ . 1 . 2]" 2
62 1 50 ARG O 1 98 TYR N 2.700 2.700 3.300 2.779 2.675 3.125 0.025 14 0 "[ . 1 . 2]" 2
63 1 99 PHE H 1 107 GLN O 1.700 . 2.300 1.874 1.724 2.141 . 0 0 "[ . 1 . 2]" 2
64 1 99 PHE N 1 107 GLN O 2.700 2.700 3.300 2.838 2.692 3.061 0.008 9 0 "[ . 1 . 2]" 2
65 1 48 PHE O 1 100 GLN H 1.700 . 2.300 1.916 1.788 2.109 . 0 0 "[ . 1 . 2]" 2
66 1 48 PHE O 1 100 GLN N 2.700 2.700 3.300 2.882 2.752 3.069 . 0 0 "[ . 1 . 2]" 2
67 1 101 ASP H 1 105 GLN O 1.700 . 2.300 1.939 1.700 2.249 . 0 0 "[ . 1 . 2]" 2
68 1 101 ASP N 1 105 GLN O 2.700 2.700 3.300 2.862 2.677 3.144 0.023 15 0 "[ . 1 . 2]" 2
69 1 101 ASP O 1 104 GLY H 1.700 . 2.300 2.224 1.889 2.344 0.044 17 0 "[ . 1 . 2]" 2
70 1 101 ASP O 1 104 GLY N 2.700 2.700 3.300 3.090 2.804 3.254 . 0 0 "[ . 1 . 2]" 2
71 1 99 PHE O 1 107 GLN H 1.700 . 2.300 1.793 1.722 1.892 . 0 0 "[ . 1 . 2]" 2
72 1 99 PHE O 1 107 GLN N 2.700 2.700 3.300 2.764 2.684 2.834 0.016 15 0 "[ . 1 . 2]" 2
73 1 97 VAL O 1 109 LEU H 1.700 . 2.300 1.812 1.714 1.924 . 0 0 "[ . 1 . 2]" 2
74 1 97 VAL O 1 109 LEU N 2.700 2.700 3.300 2.775 2.699 2.878 0.001 8 0 "[ . 1 . 2]" 2
75 1 95 VAL O 1 111 PHE H 1.700 . 2.300 1.808 1.720 1.910 . 0 0 "[ . 1 . 2]" 2
76 1 95 VAL O 1 111 PHE N 2.700 2.700 3.300 2.779 2.698 2.872 0.002 8 0 "[ . 1 . 2]" 2
77 1 93 GLN O 1 113 PHE H 1.700 . 2.300 1.935 1.700 2.338 0.038 8 0 "[ . 1 . 2]" 2
78 1 93 GLN O 1 113 PHE N 2.700 2.700 3.300 2.878 2.673 3.317 0.027 1 0 "[ . 1 . 2]" 2
stop_
save_
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