NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
623881 |
5xnd   |
36086 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5xnd
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 2020
_Distance_constraint_stats_list.Viol_count 1248
_Distance_constraint_stats_list.Viol_total 206.073
_Distance_constraint_stats_list.Viol_max 0.116
_Distance_constraint_stats_list.Viol_rms 0.0027
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0003
_Distance_constraint_stats_list.Viol_average_violations_only 0.0083
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 6 MET 0.001 0.001 7 0 "[ . 1 . 2]"
1 7 ALA 0.002 0.001 12 0 "[ . 1 . 2]"
1 8 PHE 0.032 0.008 12 0 "[ . 1 . 2]"
1 9 ALA 0.004 0.003 8 0 "[ . 1 . 2]"
1 10 SER 0.007 0.003 8 0 "[ . 1 . 2]"
1 11 VAL 0.020 0.006 2 0 "[ . 1 . 2]"
1 12 LEU 0.021 0.006 12 0 "[ . 1 . 2]"
1 13 LYS 0.010 0.004 2 0 "[ . 1 . 2]"
1 14 ASP 0.011 0.006 9 0 "[ . 1 . 2]"
1 15 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 GLU 0.001 0.001 17 0 "[ . 1 . 2]"
1 17 VAL 0.106 0.014 20 0 "[ . 1 . 2]"
1 18 THR 0.082 0.014 2 0 "[ . 1 . 2]"
1 19 ALA 0.078 0.014 2 0 "[ . 1 . 2]"
1 20 ALA 0.132 0.059 3 0 "[ . 1 . 2]"
1 21 LEU 0.086 0.005 20 0 "[ . 1 . 2]"
1 22 ASP 0.023 0.003 7 0 "[ . 1 . 2]"
1 23 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 CYS 0.032 0.004 3 0 "[ . 1 . 2]"
1 25 LYS 0.037 0.004 3 0 "[ . 1 . 2]"
1 26 ALA 0.014 0.004 20 0 "[ . 1 . 2]"
1 27 ALA 0.010 0.003 6 0 "[ . 1 . 2]"
1 28 GLY 0.019 0.004 2 0 "[ . 1 . 2]"
1 29 SER 0.026 0.004 3 0 "[ . 1 . 2]"
1 30 PHE 0.022 0.004 17 0 "[ . 1 . 2]"
1 31 ASP 0.004 0.003 6 0 "[ . 1 . 2]"
1 32 HIS 0.016 0.008 14 0 "[ . 1 . 2]"
1 33 LYS 0.058 0.021 12 0 "[ . 1 . 2]"
1 34 LYS 0.018 0.009 3 0 "[ . 1 . 2]"
1 35 PHE 0.017 0.005 12 0 "[ . 1 . 2]"
1 36 PHE 0.134 0.023 16 0 "[ . 1 . 2]"
1 37 LYS 0.021 0.006 11 0 "[ . 1 . 2]"
1 38 ALA 0.045 0.009 3 0 "[ . 1 . 2]"
1 39 CYS 0.159 0.059 3 0 "[ . 1 . 2]"
1 40 GLY 0.013 0.006 12 0 "[ . 1 . 2]"
1 41 LEU 0.051 0.013 12 0 "[ . 1 . 2]"
1 42 SER 0.104 0.027 10 0 "[ . 1 . 2]"
1 43 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 LYS 0.124 0.013 12 0 "[ . 1 . 2]"
1 45 SER 0.091 0.013 14 0 "[ . 1 . 2]"
1 46 THR 0.177 0.023 9 0 "[ . 1 . 2]"
1 47 ASP 0.023 0.021 11 0 "[ . 1 . 2]"
1 48 GLU 0.392 0.045 9 0 "[ . 1 . 2]"
1 49 VAL 0.778 0.048 15 0 "[ . 1 . 2]"
1 50 LYS 0.204 0.029 9 0 "[ . 1 . 2]"
1 51 LYS 0.386 0.045 9 0 "[ . 1 . 2]"
1 52 ALA 0.261 0.061 2 0 "[ . 1 . 2]"
1 53 PHE 0.064 0.008 2 0 "[ . 1 . 2]"
1 54 ALA 0.016 0.006 8 0 "[ . 1 . 2]"
1 55 ILE 0.239 0.061 2 0 "[ . 1 . 2]"
1 56 ILE 0.638 0.053 17 0 "[ . 1 . 2]"
1 57 ASP 0.050 0.011 11 0 "[ . 1 . 2]"
1 58 GLN 0.067 0.021 5 0 "[ . 1 . 2]"
1 59 ASP 0.182 0.116 15 0 "[ . 1 . 2]"
1 60 LYS 0.298 0.116 15 0 "[ . 1 . 2]"
1 61 SER 0.020 0.008 11 0 "[ . 1 . 2]"
1 62 GLY 0.011 0.008 12 0 "[ . 1 . 2]"
1 63 PHE 0.160 0.040 17 0 "[ . 1 . 2]"
1 64 ILE 0.229 0.040 17 0 "[ . 1 . 2]"
1 65 GLU 0.086 0.009 17 0 "[ . 1 . 2]"
1 66 GLU 0.031 0.007 5 0 "[ . 1 . 2]"
1 67 GLU 0.119 0.050 6 0 "[ . 1 . 2]"
1 68 GLU 0.133 0.050 6 0 "[ . 1 . 2]"
1 69 LEU 0.123 0.018 6 0 "[ . 1 . 2]"
1 70 LYS 0.101 0.020 4 0 "[ . 1 . 2]"
1 71 LEU 0.029 0.006 5 0 "[ . 1 . 2]"
1 72 PHE 0.246 0.028 7 0 "[ . 1 . 2]"
1 73 LEU 0.212 0.028 7 0 "[ . 1 . 2]"
1 74 GLN 0.004 0.004 10 0 "[ . 1 . 2]"
1 75 ASN 0.576 0.089 19 0 "[ . 1 . 2]"
1 76 PHE 0.720 0.089 19 0 "[ . 1 . 2]"
1 77 LYS 0.155 0.022 11 0 "[ . 1 . 2]"
1 78 ALA 0.000 0.000 1 0 "[ . 1 . 2]"
1 79 GLY 0.005 0.005 1 0 "[ . 1 . 2]"
1 80 ALA 0.215 0.017 4 0 "[ . 1 . 2]"
1 81 ARG 0.073 0.012 18 0 "[ . 1 . 2]"
1 82 ALA 0.022 0.004 13 0 "[ . 1 . 2]"
1 83 LEU 0.202 0.020 4 0 "[ . 1 . 2]"
1 84 SER 0.007 0.003 6 0 "[ . 1 . 2]"
1 85 ASP 0.018 0.004 17 0 "[ . 1 . 2]"
1 86 ALA 0.018 0.003 19 0 "[ . 1 . 2]"
1 87 GLU 0.019 0.004 17 0 "[ . 1 . 2]"
1 88 THR 0.060 0.005 6 0 "[ . 1 . 2]"
1 89 LYS 0.021 0.003 4 0 "[ . 1 . 2]"
1 90 ALA 0.032 0.007 16 0 "[ . 1 . 2]"
1 91 PHE 0.230 0.019 4 0 "[ . 1 . 2]"
1 92 LEU 0.095 0.011 8 0 "[ . 1 . 2]"
1 93 LYS 0.062 0.007 15 0 "[ . 1 . 2]"
1 94 ALA 0.008 0.003 1 0 "[ . 1 . 2]"
1 95 GLY 0.084 0.014 8 0 "[ . 1 . 2]"
1 96 ASP 0.108 0.020 7 0 "[ . 1 . 2]"
1 97 SER 0.086 0.020 7 0 "[ . 1 . 2]"
1 98 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 GLY 0.020 0.011 8 0 "[ . 1 . 2]"
1 102 LYS 0.203 0.036 14 0 "[ . 1 . 2]"
1 103 ILE 0.259 0.028 19 0 "[ . 1 . 2]"
1 104 GLY 0.021 0.005 7 0 "[ . 1 . 2]"
1 105 ILE 0.579 0.097 9 0 "[ . 1 . 2]"
1 106 ASP 0.919 0.097 9 0 "[ . 1 . 2]"
1 107 GLU 0.410 0.066 13 0 "[ . 1 . 2]"
1 108 PHE 0.522 0.058 13 0 "[ . 1 . 2]"
1 109 ALA 0.646 0.081 10 0 "[ . 1 . 2]"
1 110 ALA 0.115 0.031 10 0 "[ . 1 . 2]"
1 111 MET 1.088 0.048 14 0 "[ . 1 . 2]"
1 112 ILE 3.344 0.104 15 0 "[ . 1 . 2]"
1 113 LYS 0.752 0.062 19 0 "[ . 1 . 2]"
1 114 GLY 0.174 0.015 18 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 95 GLY H 1 103 ILE MD . . 4.330 2.758 2.278 3.165 . 0 0 "[ . 1 . 2]" 1
2 1 93 LYS HA 1 95 GLY H . . 4.950 4.362 3.684 4.954 0.004 10 0 "[ . 1 . 2]" 1
3 1 22 ASP HB2 1 23 GLY H . . 4.020 3.907 3.739 4.017 . 0 0 "[ . 1 . 2]" 1
4 1 40 GLY H 1 41 LEU HG . . 5.280 5.044 4.816 5.281 0.001 11 0 "[ . 1 . 2]" 1
5 1 39 CYS H 1 40 GLY H . . 3.480 2.442 2.081 2.588 . 0 0 "[ . 1 . 2]" 1
6 1 71 LEU MD2 1 74 GLN HE21 . . 4.700 2.768 1.849 3.584 . 0 0 "[ . 1 . 2]" 1
7 1 74 GLN HE21 1 82 ALA MB . . 4.290 3.367 2.795 4.016 . 0 0 "[ . 1 . 2]" 1
8 1 74 GLN HE21 1 82 ALA HA . . 5.500 4.418 3.455 5.039 . 0 0 "[ . 1 . 2]" 1
9 1 71 LEU HA 1 74 GLN HE21 . . 5.260 4.193 3.184 4.926 . 0 0 "[ . 1 . 2]" 1
10 1 38 ALA MB 1 39 CYS H . . 3.420 2.517 2.217 3.070 . 0 0 "[ . 1 . 2]" 1
11 1 39 CYS H 1 39 CYS HB2 . . 3.710 3.195 2.200 3.559 . 0 0 "[ . 1 . 2]" 1
12 1 39 CYS H 1 39 CYS HB3 . . 3.710 2.925 2.628 3.662 . 0 0 "[ . 1 . 2]" 1
13 1 38 ALA H 1 39 CYS H . . 3.410 2.586 2.309 2.754 . 0 0 "[ . 1 . 2]" 1
14 1 43 GLY H 1 44 LYS H . . 3.910 2.477 1.895 2.684 . 0 0 "[ . 1 . 2]" 1
15 1 99 GLY H 1 101 GLY H . . 4.940 4.687 4.166 4.917 . 0 0 "[ . 1 . 2]" 1
16 1 96 ASP HB2 1 99 GLY H . . 5.080 4.426 4.051 5.068 . 0 0 "[ . 1 . 2]" 1
17 1 98 ASP HB2 1 99 GLY H . . 4.930 4.279 3.908 4.512 . 0 0 "[ . 1 . 2]" 1
18 1 96 ASP HB3 1 99 GLY H . . 5.080 3.064 2.568 3.682 . 0 0 "[ . 1 . 2]" 1
19 1 98 ASP HB3 1 99 GLY H . . 4.930 4.304 4.104 4.603 . 0 0 "[ . 1 . 2]" 1
20 1 97 SER HA 1 99 GLY H . . 4.840 3.861 3.632 4.044 . 0 0 "[ . 1 . 2]" 1
21 1 99 GLY H 1 100 ASP H . . 3.590 3.153 2.749 3.328 . 0 0 "[ . 1 . 2]" 1
22 1 98 ASP H 1 99 GLY H . . 3.520 2.364 1.934 2.744 . 0 0 "[ . 1 . 2]" 1
23 1 77 LYS QG 1 79 GLY H . . 4.530 2.947 1.913 4.535 0.005 1 0 "[ . 1 . 2]" 1
24 1 78 ALA MB 1 79 GLY H . . 4.970 3.682 3.559 3.787 . 0 0 "[ . 1 . 2]" 1
25 1 79 GLY H 1 80 ALA H . . 4.730 1.914 1.892 2.181 . 0 0 "[ . 1 . 2]" 1
26 1 42 SER H 1 112 ILE MG . . 5.000 3.953 3.490 4.591 . 0 0 "[ . 1 . 2]" 1
27 1 41 LEU MD2 1 42 SER H . . 5.060 4.837 4.633 4.958 . 0 0 "[ . 1 . 2]" 1
28 1 41 LEU HB3 1 42 SER H . . 4.180 3.606 3.157 3.955 . 0 0 "[ . 1 . 2]" 1
29 1 41 LEU HB2 1 42 SER H . . 4.250 3.125 2.597 3.396 . 0 0 "[ . 1 . 2]" 1
30 1 41 LEU HG 1 42 SER H . . 5.240 4.937 4.697 5.007 . 0 0 "[ . 1 . 2]" 1
31 1 36 PHE HB3 1 42 SER H . . 4.590 2.818 2.242 3.158 . 0 0 "[ . 1 . 2]" 1
32 1 42 SER H 1 42 SER HB2 . . 3.640 2.775 2.105 3.547 . 0 0 "[ . 1 . 2]" 1
33 1 42 SER H 1 42 SER HB3 . . 3.640 2.549 2.106 3.539 . 0 0 "[ . 1 . 2]" 1
34 1 42 SER H 1 44 LYS H . . 4.600 3.923 3.470 4.612 0.012 12 0 "[ . 1 . 2]" 1
35 1 27 ALA MB 1 28 GLY H . . 3.810 2.942 2.655 3.296 . 0 0 "[ . 1 . 2]" 1
36 1 28 GLY H 1 87 GLU HE2 . . 4.630 2.897 2.179 3.537 . 0 0 "[ . 1 . 2]" 1
37 1 28 GLY H 1 81 ARG HH11 . . 5.200 3.100 2.336 4.482 . 0 0 "[ . 1 . 2]" 1
38 1 28 GLY H 1 81 ARG QH2 . . 4.830 2.809 2.282 4.273 . 0 0 "[ . 1 . 2]" 1
39 1 28 GLY H 1 30 PHE H . . 4.640 3.547 2.900 4.019 . 0 0 "[ . 1 . 2]" 1
40 1 58 GLN HE21 1 71 LEU MD1 . . 4.570 3.130 2.316 4.157 . 0 0 "[ . 1 . 2]" 1
41 1 58 GLN HE22 1 71 LEU MD1 . . 4.570 3.363 2.626 4.337 . 0 0 "[ . 1 . 2]" 1
42 1 58 GLN HE21 1 71 LEU HB2 . . 5.130 4.159 3.284 4.939 . 0 0 "[ . 1 . 2]" 1
43 1 58 GLN HE22 1 71 LEU HB2 . . 5.130 4.910 3.950 5.136 0.006 5 0 "[ . 1 . 2]" 1
44 1 92 LEU MD1 1 101 GLY H . . 4.940 3.262 2.648 3.838 . 0 0 "[ . 1 . 2]" 1
45 1 92 LEU MD2 1 101 GLY H . . 4.750 3.962 3.123 4.617 . 0 0 "[ . 1 . 2]" 1
46 1 101 GLY H 1 102 LYS H . . 3.340 2.126 1.897 2.905 . 0 0 "[ . 1 . 2]" 1
47 1 75 ASN H 1 75 ASN HB2 . . 3.710 3.450 2.781 3.595 . 0 0 "[ . 1 . 2]" 1
48 1 75 ASN H 1 75 ASN HB3 . . 3.710 2.828 2.515 3.555 . 0 0 "[ . 1 . 2]" 1
49 1 75 ASN H 1 76 PHE HB2 . . 5.200 4.520 4.343 4.668 . 0 0 "[ . 1 . 2]" 1
50 1 72 PHE HA 1 75 ASN H . . 4.600 4.100 3.902 4.272 . 0 0 "[ . 1 . 2]" 1
51 1 74 GLN H 1 75 ASN H . . 3.300 2.528 2.410 2.614 . 0 0 "[ . 1 . 2]" 1
52 1 75 ASN H 1 76 PHE H . . 3.230 2.398 2.320 2.479 . 0 0 "[ . 1 . 2]" 1
53 1 73 LEU H 1 75 ASN H . . 5.280 3.742 3.581 3.944 . 0 0 "[ . 1 . 2]" 1
54 1 26 ALA MB 1 29 SER H . . 4.340 3.791 3.374 4.197 . 0 0 "[ . 1 . 2]" 1
55 1 29 SER H 1 87 GLU HE2 . . 5.370 4.605 3.988 5.368 . 0 0 "[ . 1 . 2]" 1
56 1 29 SER H 1 30 PHE HB2 . . 4.870 4.108 3.816 4.451 . 0 0 "[ . 1 . 2]" 1
57 1 29 SER H 1 30 PHE HB3 . . 4.870 3.928 3.583 4.703 . 0 0 "[ . 1 . 2]" 1
58 1 28 GLY HA2 1 29 SER H . . 3.540 3.222 3.032 3.544 0.004 2 0 "[ . 1 . 2]" 1
59 1 27 ALA HA 1 29 SER H . . 4.250 3.264 3.047 3.391 . 0 0 "[ . 1 . 2]" 1
60 1 29 SER H 1 81 ARG HH11 . . 4.690 3.346 2.727 4.572 . 0 0 "[ . 1 . 2]" 1
61 1 28 GLY H 1 29 SER H . . 3.630 2.690 2.145 2.947 . 0 0 "[ . 1 . 2]" 1
62 1 29 SER H 1 30 PHE H . . 3.710 2.167 1.903 2.617 . 0 0 "[ . 1 . 2]" 1
63 1 24 CYS H 1 25 LYS QG . . 5.000 4.181 3.464 5.000 0.000 15 0 "[ . 1 . 2]" 1
64 1 24 CYS H 1 25 LYS HB2 . . 5.400 4.227 3.597 5.404 0.004 3 0 "[ . 1 . 2]" 1
65 1 24 CYS H 1 25 LYS HB3 . . 5.400 4.756 3.802 5.346 . 0 0 "[ . 1 . 2]" 1
66 1 22 ASP HA 1 24 CYS H . . 4.630 3.488 3.257 3.913 . 0 0 "[ . 1 . 2]" 1
67 1 24 CYS H 1 25 LYS H . . 3.370 2.163 1.898 2.362 . 0 0 "[ . 1 . 2]" 1
68 1 23 GLY H 1 24 CYS H . . 3.620 2.570 2.266 2.702 . 0 0 "[ . 1 . 2]" 1
69 1 113 LYS HG2 1 114 GLY H . . 4.690 4.384 3.813 4.503 . 0 0 "[ . 1 . 2]" 1
70 1 113 LYS HG3 1 114 GLY H . . 4.690 4.613 4.439 4.693 0.003 8 0 "[ . 1 . 2]" 1
71 1 113 LYS HB3 1 114 GLY H . . 4.380 3.283 2.794 3.436 . 0 0 "[ . 1 . 2]" 1
72 1 113 LYS H 1 114 GLY H . . 3.320 2.601 2.501 2.763 . 0 0 "[ . 1 . 2]" 1
73 1 62 GLY H 1 63 PHE H . . 3.380 2.518 2.058 2.984 . 0 0 "[ . 1 . 2]" 1
74 1 63 PHE H 1 63 PHE HB2 . . 3.810 2.623 2.410 2.816 . 0 0 "[ . 1 . 2]" 1
75 1 61 SER QB 1 63 PHE H . . 4.450 3.129 2.669 3.475 . 0 0 "[ . 1 . 2]" 1
76 1 63 PHE H 1 63 PHE QD . . 3.990 3.208 2.515 3.996 0.006 12 0 "[ . 1 . 2]" 1
77 1 61 SER H 1 63 PHE H . . 5.170 4.044 3.485 4.927 . 0 0 "[ . 1 . 2]" 1
78 1 63 PHE H 1 65 GLU HE2 . . 3.990 3.475 2.835 3.985 . 0 0 "[ . 1 . 2]" 1
79 1 63 PHE H 1 64 ILE H . . 5.160 4.378 4.212 4.437 . 0 0 "[ . 1 . 2]" 1
80 1 59 ASP H 1 60 LYS QG . . 4.880 4.042 3.675 4.562 . 0 0 "[ . 1 . 2]" 1
81 1 58 GLN HB2 1 59 ASP H . . 4.230 3.069 2.189 3.311 . 0 0 "[ . 1 . 2]" 1
82 1 58 GLN HB3 1 59 ASP H . . 4.230 4.095 3.488 4.251 0.021 5 0 "[ . 1 . 2]" 1
83 1 59 ASP H 1 60 LYS H . . 3.400 2.204 1.944 2.723 . 0 0 "[ . 1 . 2]" 1
84 1 73 LEU H 1 73 LEU MD2 . . 4.150 3.630 3.199 3.840 . 0 0 "[ . 1 . 2]" 1
85 1 73 LEU H 1 73 LEU MD1 . . 4.330 4.199 3.695 4.351 0.021 4 0 "[ . 1 . 2]" 1
86 1 73 LEU H 1 73 LEU HB2 . . 4.020 2.438 2.329 2.667 . 0 0 "[ . 1 . 2]" 1
87 1 73 LEU H 1 73 LEU HG . . 3.420 3.130 2.599 3.411 . 0 0 "[ . 1 . 2]" 1
88 1 73 LEU H 1 73 LEU HB3 . . 4.020 3.621 3.554 3.752 . 0 0 "[ . 1 . 2]" 1
89 1 73 LEU H 1 74 GLN HG3 . . 4.770 3.786 3.363 4.171 . 0 0 "[ . 1 . 2]" 1
90 1 72 PHE HB2 1 73 LEU H . . 4.480 4.398 4.260 4.508 0.028 7 0 "[ . 1 . 2]" 1
91 1 72 PHE HB3 1 73 LEU H . . 3.920 3.467 3.217 3.654 . 0 0 "[ . 1 . 2]" 1
92 1 72 PHE QD 1 73 LEU H . . 4.800 4.436 4.164 4.682 . 0 0 "[ . 1 . 2]" 1
93 1 72 PHE H 1 73 LEU H . . 3.770 2.654 2.602 2.704 . 0 0 "[ . 1 . 2]" 1
94 1 60 LYS HA 1 62 GLY H . . 4.070 3.078 2.834 3.749 . 0 0 "[ . 1 . 2]" 1
95 1 61 SER QB 1 62 GLY H . . 4.480 3.454 2.394 3.844 . 0 0 "[ . 1 . 2]" 1
96 1 17 VAL MG2 1 18 THR H . . 3.710 2.084 1.785 2.255 . 0 0 "[ . 1 . 2]" 1
97 1 18 THR H 1 18 THR MG . . 3.760 3.408 2.865 3.640 . 0 0 "[ . 1 . 2]" 1
98 1 18 THR H 1 19 ALA MB . . 4.540 4.441 4.332 4.534 . 0 0 "[ . 1 . 2]" 1
99 1 17 VAL HB 1 18 THR H . . 4.040 3.980 3.654 4.042 0.002 16 0 "[ . 1 . 2]" 1
100 1 18 THR H 1 18 THR HB . . 3.200 2.112 2.028 2.172 . 0 0 "[ . 1 . 2]" 1
101 1 18 THR H 1 19 ALA H . . 3.570 2.955 2.814 3.012 . 0 0 "[ . 1 . 2]" 1
102 1 17 VAL H 1 18 THR H . . 3.540 2.796 2.527 3.052 . 0 0 "[ . 1 . 2]" 1
103 1 21 LEU MD2 1 76 PHE H . . 4.800 3.795 3.302 4.190 . 0 0 "[ . 1 . 2]" 1
104 1 75 ASN HB2 1 76 PHE H . . 4.660 3.434 2.422 3.877 . 0 0 "[ . 1 . 2]" 1
105 1 75 ASN HB3 1 76 PHE H . . 4.660 3.844 3.739 4.018 . 0 0 "[ . 1 . 2]" 1
106 1 76 PHE H 1 76 PHE HB3 . . 4.150 3.493 3.472 3.509 . 0 0 "[ . 1 . 2]" 1
107 1 76 PHE H 1 76 PHE HB2 . . 3.710 2.364 2.240 2.489 . 0 0 "[ . 1 . 2]" 1
108 1 73 LEU HA 1 76 PHE H . . 4.610 3.587 3.276 3.727 . 0 0 "[ . 1 . 2]" 1
109 1 76 PHE H 1 76 PHE QD . . 3.630 2.559 1.945 2.866 . 0 0 "[ . 1 . 2]" 1
110 1 76 PHE H 1 77 LYS H . . 3.220 2.663 2.606 2.745 . 0 0 "[ . 1 . 2]" 1
111 1 8 PHE H 1 9 ALA MB . . 4.750 4.291 4.088 4.431 . 0 0 "[ . 1 . 2]" 1
112 1 8 PHE H 1 8 PHE HB2 . . 3.830 2.041 1.949 2.108 . 0 0 "[ . 1 . 2]" 1
113 1 8 PHE H 1 8 PHE HB3 . . 3.930 3.372 3.299 3.411 . 0 0 "[ . 1 . 2]" 1
114 1 8 PHE H 1 8 PHE QD . . 4.680 2.808 2.657 2.976 . 0 0 "[ . 1 . 2]" 1
115 1 60 LYS H 1 60 LYS QG . . 3.510 2.772 2.480 3.139 . 0 0 "[ . 1 . 2]" 1
116 1 60 LYS H 1 60 LYS HD2 . . 4.530 2.617 1.949 3.592 . 0 0 "[ . 1 . 2]" 1
117 1 60 LYS H 1 60 LYS HD3 . . 4.530 2.948 1.949 3.945 . 0 0 "[ . 1 . 2]" 1
118 1 60 LYS H 1 60 LYS HA . . 2.930 2.217 2.206 2.250 . 0 0 "[ . 1 . 2]" 1
119 1 67 GLU QB 1 68 GLU H . . 3.310 2.862 2.407 3.174 . 0 0 "[ . 1 . 2]" 1
120 1 68 GLU H 1 68 GLU HB2 . . 3.190 2.293 2.114 2.543 . 0 0 "[ . 1 . 2]" 1
121 1 66 GLU HA 1 68 GLU H . . 4.770 4.085 3.692 4.757 . 0 0 "[ . 1 . 2]" 1
122 1 67 GLU HA 1 68 GLU H . . 3.590 3.545 3.456 3.640 0.050 6 0 "[ . 1 . 2]" 1
123 1 68 GLU H 1 69 LEU H . . 3.230 2.366 2.132 2.626 . 0 0 "[ . 1 . 2]" 1
124 1 71 LEU H 1 71 LEU MD1 . . 4.070 3.831 3.568 4.074 0.004 6 0 "[ . 1 . 2]" 1
125 1 71 LEU H 1 71 LEU HB2 . . 3.350 2.535 2.380 2.713 . 0 0 "[ . 1 . 2]" 1
126 1 71 LEU H 1 71 LEU HG . . 3.100 2.482 2.121 2.855 . 0 0 "[ . 1 . 2]" 1
127 1 70 LYS QB 1 71 LEU H . . 4.030 3.686 3.006 3.863 . 0 0 "[ . 1 . 2]" 1
128 1 68 GLU HA 1 71 LEU H . . 3.910 3.197 2.942 3.265 . 0 0 "[ . 1 . 2]" 1
129 1 73 LEU MD2 1 74 GLN H . . 4.970 4.618 4.390 4.806 . 0 0 "[ . 1 . 2]" 1
130 1 73 LEU MD1 1 74 GLN H . . 5.410 5.244 4.995 5.374 . 0 0 "[ . 1 . 2]" 1
131 1 73 LEU HB2 1 74 GLN H . . 4.380 3.395 3.119 3.550 . 0 0 "[ . 1 . 2]" 1
132 1 74 GLN H 1 80 ALA MB . . 4.190 3.547 3.068 4.039 . 0 0 "[ . 1 . 2]" 1
133 1 73 LEU HG 1 74 GLN H . . 5.170 4.813 4.473 4.993 . 0 0 "[ . 1 . 2]" 1
134 1 73 LEU HB3 1 74 GLN H . . 4.380 4.123 3.837 4.384 0.004 10 0 "[ . 1 . 2]" 1
135 1 74 GLN H 1 74 GLN HG3 . . 3.110 2.753 2.446 3.103 . 0 0 "[ . 1 . 2]" 1
136 1 74 GLN H 1 74 GLN HG2 . . 4.230 3.723 3.231 4.227 . 0 0 "[ . 1 . 2]" 1
137 1 73 LEU H 1 74 GLN H . . 3.650 1.955 1.858 2.091 . 0 0 "[ . 1 . 2]" 1
138 1 55 ILE H 1 55 ILE MD . . 4.100 3.286 2.141 3.724 . 0 0 "[ . 1 . 2]" 1
139 1 55 ILE H 1 55 ILE MG . . 4.050 3.721 3.698 3.752 . 0 0 "[ . 1 . 2]" 1
140 1 55 ILE H 1 55 ILE HB . . 2.980 2.486 2.398 2.676 . 0 0 "[ . 1 . 2]" 1
141 1 45 SER H 1 49 VAL MG2 . . 5.260 3.762 3.283 4.078 . 0 0 "[ . 1 . 2]" 1
142 1 44 LYS HD2 1 45 SER H . . 4.470 2.664 2.441 2.876 . 0 0 "[ . 1 . 2]" 1
143 1 44 LYS HD3 1 45 SER H . . 4.470 3.946 3.721 4.130 . 0 0 "[ . 1 . 2]" 1
144 1 44 LYS HB3 1 45 SER H . . 3.600 2.051 1.947 2.281 . 0 0 "[ . 1 . 2]" 1
145 1 44 LYS HB2 1 45 SER H . . 3.720 3.516 3.384 3.722 0.002 10 0 "[ . 1 . 2]" 1
146 1 45 SER H 1 48 GLU HG2 . . 4.620 2.767 2.467 3.116 . 0 0 "[ . 1 . 2]" 1
147 1 45 SER H 1 48 GLU HG3 . . 4.620 4.277 3.819 4.616 . 0 0 "[ . 1 . 2]" 1
148 1 44 LYS H 1 45 SER H . . 5.210 4.538 4.477 4.600 . 0 0 "[ . 1 . 2]" 1
149 1 45 SER H 1 48 GLU H . . 5.500 4.040 3.901 4.270 . 0 0 "[ . 1 . 2]" 1
150 1 45 SER H 1 47 ASP H . . 5.130 4.667 4.459 5.024 . 0 0 "[ . 1 . 2]" 1
151 1 45 SER H 1 49 VAL H . . 5.410 4.425 4.018 4.775 . 0 0 "[ . 1 . 2]" 1
152 1 66 GLU HB3 1 67 GLU H . . 3.100 2.868 2.413 3.101 0.001 5 0 "[ . 1 . 2]" 1
153 1 67 GLU H 1 67 GLU QB . . 3.210 2.483 2.159 2.614 . 0 0 "[ . 1 . 2]" 1
154 1 67 GLU H 1 67 GLU HG2 . . 3.550 3.162 2.696 3.553 0.003 12 0 "[ . 1 . 2]" 1
155 1 67 GLU H 1 67 GLU HG3 . . 3.550 2.238 1.951 3.252 . 0 0 "[ . 1 . 2]" 1
156 1 67 GLU H 1 68 GLU HB2 . . 4.940 4.642 4.332 4.941 0.001 19 0 "[ . 1 . 2]" 1
157 1 67 GLU H 1 68 GLU H . . 3.520 2.597 2.375 2.839 . 0 0 "[ . 1 . 2]" 1
158 1 67 GLU H 1 69 LEU H . . 4.570 3.927 3.691 4.176 . 0 0 "[ . 1 . 2]" 1
159 1 60 LYS QG 1 61 SER H . . 5.160 4.646 4.290 4.809 . 0 0 "[ . 1 . 2]" 1
160 1 60 LYS HB2 1 61 SER H . . 4.900 4.354 4.134 4.498 . 0 0 "[ . 1 . 2]" 1
161 1 61 SER H 1 62 GLY H . . 3.450 2.611 2.290 3.088 . 0 0 "[ . 1 . 2]" 1
162 1 60 LYS HB3 1 61 SER H . . 4.900 4.608 4.505 4.683 . 0 0 "[ . 1 . 2]" 1
163 1 60 LYS HA 1 61 SER H . . 3.420 2.791 2.617 3.061 . 0 0 "[ . 1 . 2]" 1
164 1 61 SER H 1 61 SER QB . . 3.330 2.733 2.006 2.890 . 0 0 "[ . 1 . 2]" 1
165 1 60 LYS H 1 61 SER H . . 3.390 2.779 2.474 3.102 . 0 0 "[ . 1 . 2]" 1
166 1 59 ASP H 1 61 SER H . . 4.730 3.942 3.626 4.722 . 0 0 "[ . 1 . 2]" 1
167 1 61 SER H 1 65 GLU HE2 . . 4.810 4.722 4.427 4.818 0.008 11 0 "[ . 1 . 2]" 1
168 1 92 LEU MD1 1 102 LYS H . . 4.450 3.623 3.314 4.237 . 0 0 "[ . 1 . 2]" 1
169 1 102 LYS H 1 102 LYS HG2 . . 4.020 3.659 2.468 4.032 0.012 14 0 "[ . 1 . 2]" 1
170 1 102 LYS H 1 102 LYS HG3 . . 4.020 2.824 2.498 4.027 0.007 10 0 "[ . 1 . 2]" 1
171 1 102 LYS H 1 102 LYS HB2 . . 4.170 2.984 2.623 3.891 . 0 0 "[ . 1 . 2]" 1
172 1 102 LYS H 1 102 LYS HB3 . . 4.170 3.870 3.618 3.981 . 0 0 "[ . 1 . 2]" 1
173 1 96 ASP HB2 1 102 LYS H . . 5.500 4.977 4.328 5.203 . 0 0 "[ . 1 . 2]" 1
174 1 100 ASP HB2 1 102 LYS H . . 5.290 3.592 2.546 4.194 . 0 0 "[ . 1 . 2]" 1
175 1 96 ASP HB3 1 102 LYS H . . 5.500 5.460 4.866 5.514 0.014 18 0 "[ . 1 . 2]" 1
176 1 100 ASP HB3 1 102 LYS H . . 5.290 4.337 3.030 4.708 . 0 0 "[ . 1 . 2]" 1
177 1 100 ASP H 1 102 LYS H . . 4.830 3.169 2.872 3.811 . 0 0 "[ . 1 . 2]" 1
178 1 102 LYS H 1 103 ILE H . . 4.900 4.415 4.360 4.537 . 0 0 "[ . 1 . 2]" 1
179 1 92 LEU MD2 1 93 LYS H . . 4.460 3.887 3.609 4.246 . 0 0 "[ . 1 . 2]" 1
180 1 93 LYS H 1 93 LYS QD . . 4.660 4.051 2.761 4.664 0.004 12 0 "[ . 1 . 2]" 1
181 1 93 LYS H 1 93 LYS HB2 . . 2.850 2.111 2.047 2.153 . 0 0 "[ . 1 . 2]" 1
182 1 93 LYS H 1 93 LYS HB3 . . 3.440 3.409 3.316 3.441 0.001 17 0 "[ . 1 . 2]" 1
183 1 54 ALA H 1 54 ALA MB . . 3.000 2.092 2.001 2.206 . 0 0 "[ . 1 . 2]" 1
184 1 53 PHE HB3 1 54 ALA H . . 4.100 2.990 2.741 3.083 . 0 0 "[ . 1 . 2]" 1
185 1 51 LYS HA 1 54 ALA H . . 3.600 3.460 3.263 3.590 . 0 0 "[ . 1 . 2]" 1
186 1 53 PHE QD 1 54 ALA H . . 4.360 3.458 2.933 3.981 . 0 0 "[ . 1 . 2]" 1
187 1 54 ALA H 1 55 ILE H . . 3.520 2.387 2.251 2.593 . 0 0 "[ . 1 . 2]" 1
188 1 111 MET H 1 111 MET ME . . 5.040 4.053 3.951 4.227 . 0 0 "[ . 1 . 2]" 1
189 1 111 MET H 1 111 MET HB2 . . 3.680 3.521 3.494 3.526 . 0 0 "[ . 1 . 2]" 1
190 1 111 MET H 1 111 MET HB3 . . 3.650 2.490 2.282 2.521 . 0 0 "[ . 1 . 2]" 1
191 1 111 MET H 1 111 MET HG2 . . 3.600 1.959 1.926 2.377 . 0 0 "[ . 1 . 2]" 1
192 1 111 MET H 1 111 MET HG3 . . 3.710 3.409 3.292 3.728 0.018 10 0 "[ . 1 . 2]" 1
193 1 109 ALA HA 1 111 MET H . . 4.670 4.688 4.575 4.718 0.048 14 0 "[ . 1 . 2]" 1
194 1 108 PHE HA 1 111 MET H . . 4.070 3.698 3.566 3.766 . 0 0 "[ . 1 . 2]" 1
195 1 111 MET H 1 112 ILE H . . 3.350 2.796 2.734 2.835 . 0 0 "[ . 1 . 2]" 1
196 1 111 MET H 1 113 LYS H . . 4.570 4.250 4.087 4.444 . 0 0 "[ . 1 . 2]" 1
197 1 55 ILE MD 1 56 ILE H . . 5.040 4.629 4.305 4.779 . 0 0 "[ . 1 . 2]" 1
198 1 56 ILE H 1 64 ILE MD . . 4.790 4.376 3.888 4.705 . 0 0 "[ . 1 . 2]" 1
199 1 56 ILE H 1 56 ILE HG12 . . 3.660 3.453 3.406 3.548 . 0 0 "[ . 1 . 2]" 1
200 1 56 ILE H 1 56 ILE HB . . 3.270 2.630 2.510 2.695 . 0 0 "[ . 1 . 2]" 1
201 1 55 ILE HB 1 56 ILE H . . 3.430 2.469 2.200 2.632 . 0 0 "[ . 1 . 2]" 1
202 1 56 ILE H 1 56 ILE HG13 . . 3.660 2.040 1.942 2.349 . 0 0 "[ . 1 . 2]" 1
203 1 103 ILE HG12 1 104 GLY H . . 4.900 4.123 3.901 4.246 . 0 0 "[ . 1 . 2]" 1
204 1 103 ILE HB 1 104 GLY H . . 5.270 4.597 4.447 4.632 . 0 0 "[ . 1 . 2]" 1
205 1 104 GLY H 1 107 GLU HB2 . . 3.460 2.331 2.089 2.667 . 0 0 "[ . 1 . 2]" 1
206 1 104 GLY H 1 107 GLU HB3 . . 4.180 3.685 3.407 3.959 . 0 0 "[ . 1 . 2]" 1
207 1 103 ILE HA 1 104 GLY H . . 3.130 2.192 2.177 2.205 . 0 0 "[ . 1 . 2]" 1
208 1 63 PHE QD 1 104 GLY H . . 4.740 4.030 3.208 4.742 0.002 10 0 "[ . 1 . 2]" 1
209 1 104 GLY H 1 105 ILE H . . 5.300 4.416 4.330 4.564 . 0 0 "[ . 1 . 2]" 1
210 1 103 ILE H 1 104 GLY H . . 5.000 4.104 3.960 4.437 . 0 0 "[ . 1 . 2]" 1
211 1 112 ILE H 1 112 ILE MD . . 4.070 3.592 3.474 3.639 . 0 0 "[ . 1 . 2]" 1
212 1 112 ILE H 1 112 ILE HG12 . . 3.650 1.920 1.900 1.941 . 0 0 "[ . 1 . 2]" 1
213 1 112 ILE H 1 112 ILE HG13 . . 3.650 2.412 2.236 3.194 . 0 0 "[ . 1 . 2]" 1
214 1 49 VAL MG1 1 112 ILE H . . 4.900 4.773 4.467 4.948 0.048 15 0 "[ . 1 . 2]" 1
215 1 111 MET HB2 1 112 ILE H . . 4.150 4.056 3.947 4.151 0.001 20 0 "[ . 1 . 2]" 1
216 1 111 MET HB3 1 112 ILE H . . 4.340 4.239 3.941 4.296 . 0 0 "[ . 1 . 2]" 1
217 1 111 MET HG2 1 112 ILE H . . 4.110 2.576 2.071 2.806 . 0 0 "[ . 1 . 2]" 1
218 1 111 MET HG3 1 112 ILE H . . 4.210 3.024 2.903 3.151 . 0 0 "[ . 1 . 2]" 1
219 1 110 ALA HA 1 112 ILE H . . 4.260 3.708 3.584 4.086 . 0 0 "[ . 1 . 2]" 1
220 1 12 LEU H 1 12 LEU MD1 . . 4.250 3.521 3.335 3.733 . 0 0 "[ . 1 . 2]" 1
221 1 12 LEU H 1 12 LEU QB . . 3.700 2.587 2.392 2.817 . 0 0 "[ . 1 . 2]" 1
222 1 12 LEU H 1 12 LEU HG . . 3.900 2.651 2.248 3.046 . 0 0 "[ . 1 . 2]" 1
223 1 11 VAL HB 1 12 LEU H . . 3.970 2.184 2.158 2.232 . 0 0 "[ . 1 . 2]" 1
224 1 8 PHE HB3 1 12 LEU H . . 4.960 3.159 2.716 3.582 . 0 0 "[ . 1 . 2]" 1
225 1 36 PHE H 1 37 LYS QB . . 5.050 4.531 4.432 4.684 . 0 0 "[ . 1 . 2]" 1
226 1 35 PHE HB2 1 36 PHE H . . 3.900 3.323 3.202 3.513 . 0 0 "[ . 1 . 2]" 1
227 1 35 PHE HB3 1 36 PHE H . . 4.390 1.959 1.949 2.028 . 0 0 "[ . 1 . 2]" 1
228 1 36 PHE H 1 36 PHE HB3 . . 4.010 3.456 3.430 3.473 . 0 0 "[ . 1 . 2]" 1
229 1 36 PHE H 1 36 PHE HB2 . . 3.570 2.300 2.168 2.408 . 0 0 "[ . 1 . 2]" 1
230 1 33 LYS HA 1 36 PHE H . . 4.580 3.910 3.717 4.118 . 0 0 "[ . 1 . 2]" 1
231 1 35 PHE QD 1 36 PHE H . . 4.670 3.367 2.931 3.687 . 0 0 "[ . 1 . 2]" 1
232 1 36 PHE H 1 37 LYS H . . 3.580 2.769 2.693 2.863 . 0 0 "[ . 1 . 2]" 1
233 1 16 GLU H 1 17 VAL MG2 . . 4.290 3.740 3.487 4.093 . 0 0 "[ . 1 . 2]" 1
234 1 16 GLU H 1 17 VAL MG1 . . 4.170 3.941 3.680 4.160 . 0 0 "[ . 1 . 2]" 1
235 1 15 ALA MB 1 16 GLU H . . 3.610 2.899 2.617 3.110 . 0 0 "[ . 1 . 2]" 1
236 1 13 LYS HB2 1 16 GLU H . . 4.220 3.020 2.075 4.110 . 0 0 "[ . 1 . 2]" 1
237 1 13 LYS HB3 1 16 GLU H . . 4.220 2.775 1.952 3.761 . 0 0 "[ . 1 . 2]" 1
238 1 16 GLU H 1 16 GLU HB2 . . 3.730 2.260 2.156 2.495 . 0 0 "[ . 1 . 2]" 1
239 1 16 GLU H 1 16 GLU QG . . 3.310 2.684 2.039 2.930 . 0 0 "[ . 1 . 2]" 1
240 1 16 GLU H 1 16 GLU HB3 . . 3.730 3.510 3.452 3.596 . 0 0 "[ . 1 . 2]" 1
241 1 16 GLU H 1 17 VAL H . . 3.350 2.679 2.525 2.842 . 0 0 "[ . 1 . 2]" 1
242 1 88 THR H 1 88 THR MG . . 4.110 3.680 3.649 3.746 . 0 0 "[ . 1 . 2]" 1
243 1 83 LEU HB3 1 88 THR H . . 4.500 3.135 2.550 3.617 . 0 0 "[ . 1 . 2]" 1
244 1 83 LEU HB2 1 88 THR H . . 4.600 3.775 3.392 4.390 . 0 0 "[ . 1 . 2]" 1
245 1 88 THR H 1 88 THR HB . . 3.930 2.342 2.186 2.511 . 0 0 "[ . 1 . 2]" 1
246 1 87 GLU H 1 88 THR H . . 3.730 2.876 2.700 3.018 . 0 0 "[ . 1 . 2]" 1
247 1 88 THR H 1 89 LYS H . . 3.680 2.550 2.196 2.764 . 0 0 "[ . 1 . 2]" 1
248 1 94 ALA H 1 94 ALA MB . . 2.840 2.058 1.946 2.158 . 0 0 "[ . 1 . 2]" 1
249 1 93 LYS HB2 1 94 ALA H . . 3.620 3.307 3.001 3.484 . 0 0 "[ . 1 . 2]" 1
250 1 93 LYS HB3 1 94 ALA H . . 3.870 3.715 3.276 3.872 0.002 16 0 "[ . 1 . 2]" 1
251 1 92 LEU HA 1 94 ALA H . . 4.450 4.073 3.783 4.452 0.002 8 0 "[ . 1 . 2]" 1
252 1 93 LYS H 1 94 ALA H . . 3.340 2.596 2.374 2.738 . 0 0 "[ . 1 . 2]" 1
253 1 83 LEU MD1 1 84 SER H . . 4.160 3.405 3.236 3.779 . 0 0 "[ . 1 . 2]" 1
254 1 83 LEU HB3 1 84 SER H . . 3.750 2.768 2.218 3.292 . 0 0 "[ . 1 . 2]" 1
255 1 83 LEU HG 1 84 SER H . . 4.970 4.704 4.003 4.972 0.002 4 0 "[ . 1 . 2]" 1
256 1 83 LEU HB2 1 84 SER H . . 4.380 3.935 3.504 4.380 . 0 0 "[ . 1 . 2]" 1
257 1 83 LEU HA 1 84 SER H . . 3.390 2.364 2.220 2.599 . 0 0 "[ . 1 . 2]" 1
258 1 84 SER H 1 84 SER HG . . 4.620 4.354 3.439 4.592 . 0 0 "[ . 1 . 2]" 1
259 1 21 LEU MD1 1 77 LYS H . . 4.780 4.614 4.330 4.780 . 10 0 "[ . 1 . 2]" 1
260 1 21 LEU MD2 1 77 LYS H . . 4.840 4.605 4.383 4.840 0.000 7 0 "[ . 1 . 2]" 1
261 1 77 LYS H 1 80 ALA MB . . 4.070 3.803 3.619 4.031 . 0 0 "[ . 1 . 2]" 1
262 1 77 LYS H 1 77 LYS QG . . 4.270 4.251 4.194 4.290 0.020 4 0 "[ . 1 . 2]" 1
263 1 77 LYS H 1 77 LYS HB2 . . 4.010 3.374 3.266 3.502 . 0 0 "[ . 1 . 2]" 1
264 1 77 LYS H 1 77 LYS HB3 . . 4.010 3.380 3.229 3.573 . 0 0 "[ . 1 . 2]" 1
265 1 76 PHE HB2 1 77 LYS H . . 3.930 3.684 3.580 3.825 . 0 0 "[ . 1 . 2]" 1
266 1 75 ASN HA 1 77 LYS H . . 4.300 3.646 3.612 3.673 . 0 0 "[ . 1 . 2]" 1
267 1 76 PHE QD 1 77 LYS H . . 4.780 4.684 4.469 4.802 0.022 11 0 "[ . 1 . 2]" 1
268 1 56 ILE MG 1 57 ASP H . . 4.040 3.496 3.181 3.949 . 0 0 "[ . 1 . 2]" 1
269 1 57 ASP H 1 57 ASP HB2 . . 3.700 2.459 2.084 2.830 . 0 0 "[ . 1 . 2]" 1
270 1 56 ILE H 1 57 ASP H . . 3.330 2.823 2.611 3.041 . 0 0 "[ . 1 . 2]" 1
271 1 110 ALA H 1 110 ALA MB . . 2.800 2.099 1.990 2.227 . 0 0 "[ . 1 . 2]" 1
272 1 110 ALA H 1 111 MET HB3 . . 4.920 4.859 4.536 4.932 0.012 7 0 "[ . 1 . 2]" 1
273 1 107 GLU HB3 1 110 ALA H . . 5.140 4.918 4.692 5.145 0.005 11 0 "[ . 1 . 2]" 1
274 1 110 ALA H 1 111 MET HG2 . . 4.670 3.330 3.247 3.775 . 0 0 "[ . 1 . 2]" 1
275 1 106 ASP HA 1 110 ALA H . . 5.010 4.774 4.532 5.028 0.018 19 0 "[ . 1 . 2]" 1
276 1 110 ALA H 1 112 ILE H . . 4.460 3.623 3.544 3.676 . 0 0 "[ . 1 . 2]" 1
277 1 108 PHE H 1 110 ALA H . . 5.040 3.781 3.689 3.907 . 0 0 "[ . 1 . 2]" 1
278 1 56 ILE MG 1 75 ASN HD21 . . 4.320 3.020 2.417 3.994 . 0 0 "[ . 1 . 2]" 1
279 1 56 ILE MG 1 75 ASN HD22 . . 4.320 3.747 1.781 4.339 0.019 5 0 "[ . 1 . 2]" 1
280 1 37 LYS H 1 38 ALA MB . . 4.540 3.928 3.763 4.122 . 0 0 "[ . 1 . 2]" 1
281 1 37 LYS H 1 37 LYS QB . . 3.030 2.195 2.090 2.265 . 0 0 "[ . 1 . 2]" 1
282 1 36 PHE HB2 1 37 LYS H . . 3.890 2.749 2.518 2.969 . 0 0 "[ . 1 . 2]" 1
283 1 73 LEU MD1 1 81 ARG H . . 4.100 3.461 2.869 4.104 0.004 18 0 "[ . 1 . 2]" 1
284 1 81 ARG H 1 81 ARG HG3 . . 3.420 2.592 1.953 3.037 . 0 0 "[ . 1 . 2]" 1
285 1 80 ALA MB 1 81 ARG H . . 3.290 2.684 2.048 3.115 . 0 0 "[ . 1 . 2]" 1
286 1 81 ARG H 1 81 ARG HG2 . . 3.430 2.696 2.313 3.333 . 0 0 "[ . 1 . 2]" 1
287 1 81 ARG H 1 81 ARG HB2 . . 3.920 3.580 3.535 3.688 . 0 0 "[ . 1 . 2]" 1
288 1 81 ARG H 1 81 ARG HB3 . . 3.920 2.538 2.362 2.933 . 0 0 "[ . 1 . 2]" 1
289 1 81 ARG H 1 81 ARG HD2 . . 5.140 4.566 3.980 4.904 . 0 0 "[ . 1 . 2]" 1
290 1 81 ARG H 1 81 ARG HD3 . . 5.140 4.592 4.439 4.782 . 0 0 "[ . 1 . 2]" 1
291 1 49 VAL MG1 1 53 PHE H . . 4.370 4.063 3.734 4.378 0.008 2 0 "[ . 1 . 2]" 1
292 1 52 ALA MB 1 53 PHE H . . 3.370 2.836 2.669 3.182 . 0 0 "[ . 1 . 2]" 1
293 1 53 PHE H 1 53 PHE HB3 . . 3.250 2.181 2.076 2.374 . 0 0 "[ . 1 . 2]" 1
294 1 53 PHE H 1 53 PHE HB2 . . 3.280 2.552 2.321 2.728 . 0 0 "[ . 1 . 2]" 1
295 1 49 VAL HA 1 53 PHE H . . 4.660 4.224 3.951 4.496 . 0 0 "[ . 1 . 2]" 1
296 1 50 LYS HA 1 53 PHE H . . 3.750 3.242 2.974 3.499 . 0 0 "[ . 1 . 2]" 1
297 1 53 PHE H 1 53 PHE QD . . 4.460 3.999 3.906 4.071 . 0 0 "[ . 1 . 2]" 1
298 1 53 PHE H 1 55 ILE H . . 4.550 3.977 3.712 4.289 . 0 0 "[ . 1 . 2]" 1
299 1 53 PHE H 1 108 PHE QD . . 4.640 4.247 3.903 4.547 . 0 0 "[ . 1 . 2]" 1
300 1 53 PHE H 1 54 ALA H . . 3.570 2.583 2.328 2.742 . 0 0 "[ . 1 . 2]" 1
301 1 52 ALA H 1 53 PHE H . . 3.480 2.375 2.279 2.752 . 0 0 "[ . 1 . 2]" 1
302 1 69 LEU MD2 1 92 LEU H . . 4.890 4.573 4.337 4.890 0.000 11 0 "[ . 1 . 2]" 1
303 1 69 LEU MD1 1 92 LEU H . . 4.000 3.450 2.803 3.841 . 0 0 "[ . 1 . 2]" 1
304 1 92 LEU H 1 92 LEU MD1 . . 4.730 4.173 4.066 4.288 . 0 0 "[ . 1 . 2]" 1
305 1 92 LEU H 1 92 LEU MD2 . . 4.370 4.166 4.084 4.252 . 0 0 "[ . 1 . 2]" 1
306 1 92 LEU H 1 92 LEU HB2 . . 3.180 2.693 2.479 2.896 . 0 0 "[ . 1 . 2]" 1
307 1 92 LEU H 1 92 LEU HG . . 4.570 4.301 4.153 4.418 . 0 0 "[ . 1 . 2]" 1
308 1 92 LEU H 1 92 LEU HB3 . . 3.180 2.311 2.203 2.425 . 0 0 "[ . 1 . 2]" 1
309 1 91 PHE HB2 1 92 LEU H . . 4.100 3.881 3.523 4.110 0.010 8 0 "[ . 1 . 2]" 1
310 1 91 PHE HB3 1 92 LEU H . . 3.290 2.984 2.512 3.228 . 0 0 "[ . 1 . 2]" 1
311 1 112 ILE MD 1 113 LYS H . . 5.040 3.828 3.528 4.200 . 0 0 "[ . 1 . 2]" 1
312 1 112 ILE HG12 1 113 LYS H . . 4.650 3.056 2.105 3.350 . 0 0 "[ . 1 . 2]" 1
313 1 112 ILE MG 1 113 LYS H . . 4.540 4.164 3.845 4.326 . 0 0 "[ . 1 . 2]" 1
314 1 112 ILE HB 1 113 LYS H . . 3.560 3.563 3.413 3.622 0.062 19 0 "[ . 1 . 2]" 1
315 1 109 ALA MB 1 113 LYS H . . 4.250 4.206 4.085 4.267 0.017 3 0 "[ . 1 . 2]" 1
316 1 113 LYS H 1 113 LYS HB2 . . 3.090 2.586 2.397 2.704 . 0 0 "[ . 1 . 2]" 1
317 1 113 LYS H 1 113 LYS HB3 . . 3.090 2.365 2.296 2.523 . 0 0 "[ . 1 . 2]" 1
318 1 109 ALA HA 1 113 LYS H . . 4.320 3.836 3.596 3.970 . 0 0 "[ . 1 . 2]" 1
319 1 110 ALA HA 1 113 LYS H . . 3.550 2.974 2.821 3.420 . 0 0 "[ . 1 . 2]" 1
320 1 112 ILE H 1 113 LYS H . . 3.220 2.115 1.938 2.474 . 0 0 "[ . 1 . 2]" 1
321 1 97 SER HB2 1 98 ASP H . . 4.440 3.710 2.691 4.403 . 0 0 "[ . 1 . 2]" 1
322 1 97 SER HB3 1 98 ASP H . . 4.440 3.426 2.279 4.416 . 0 0 "[ . 1 . 2]" 1
323 1 87 GLU H 1 87 GLU HG2 . . 3.740 3.698 3.471 3.744 0.004 17 0 "[ . 1 . 2]" 1
324 1 87 GLU H 1 87 GLU HG3 . . 3.740 2.458 2.180 2.878 . 0 0 "[ . 1 . 2]" 1
325 1 87 GLU H 1 87 GLU HB3 . . 3.890 3.542 3.509 3.560 . 0 0 "[ . 1 . 2]" 1
326 1 86 ALA H 1 87 GLU H . . 4.380 2.472 2.262 2.821 . 0 0 "[ . 1 . 2]" 1
327 1 84 SER H 1 87 GLU H . . 4.810 3.486 3.133 3.756 . 0 0 "[ . 1 . 2]" 1
328 1 44 LYS H 1 44 LYS HG2 . . 4.090 2.757 2.668 2.797 . 0 0 "[ . 1 . 2]" 1
329 1 44 LYS H 1 44 LYS HD2 . . 4.540 4.528 4.474 4.552 0.012 10 0 "[ . 1 . 2]" 1
330 1 44 LYS H 1 44 LYS HD3 . . 4.540 4.077 4.003 4.144 . 0 0 "[ . 1 . 2]" 1
331 1 44 LYS H 1 44 LYS HG3 . . 4.090 3.907 3.799 3.951 . 0 0 "[ . 1 . 2]" 1
332 1 44 LYS H 1 44 LYS HB3 . . 3.700 3.469 3.449 3.498 . 0 0 "[ . 1 . 2]" 1
333 1 44 LYS H 1 44 LYS HB2 . . 3.370 2.181 2.152 2.225 . 0 0 "[ . 1 . 2]" 1
334 1 44 LYS H 1 44 LYS HE2 . . 5.500 5.493 5.450 5.508 0.008 10 0 "[ . 1 . 2]" 1
335 1 41 LEU HA 1 44 LYS H . . 4.240 3.454 2.713 4.198 . 0 0 "[ . 1 . 2]" 1
336 1 34 LYS H 1 34 LYS HG2 . . 4.330 2.617 1.949 4.095 . 0 0 "[ . 1 . 2]" 1
337 1 34 LYS H 1 34 LYS HG3 . . 4.330 3.491 3.169 4.049 . 0 0 "[ . 1 . 2]" 1
338 1 33 LYS QB 1 34 LYS H . . 3.460 2.963 2.537 3.461 0.001 11 0 "[ . 1 . 2]" 1
339 1 34 LYS H 1 34 LYS HB2 . . 3.730 2.333 2.120 2.536 . 0 0 "[ . 1 . 2]" 1
340 1 34 LYS H 1 34 LYS HB3 . . 3.730 3.506 3.427 3.549 . 0 0 "[ . 1 . 2]" 1
341 1 31 ASP QB 1 34 LYS H . . 4.160 2.261 2.057 3.309 . 0 0 "[ . 1 . 2]" 1
342 1 34 LYS H 1 34 LYS QE . . 5.020 4.289 3.186 4.996 . 0 0 "[ . 1 . 2]" 1
343 1 33 LYS H 1 34 LYS H . . 3.390 2.965 2.837 3.134 . 0 0 "[ . 1 . 2]" 1
344 1 69 LEU MD1 1 70 LYS H . . 5.070 4.573 4.344 5.063 . 0 0 "[ . 1 . 2]" 1
345 1 69 LEU HB2 1 70 LYS H . . 4.270 2.765 2.539 3.268 . 0 0 "[ . 1 . 2]" 1
346 1 69 LEU HG 1 70 LYS H . . 5.090 4.815 4.675 5.031 . 0 0 "[ . 1 . 2]" 1
347 1 70 LYS H 1 70 LYS QB . . 3.030 2.244 2.127 2.540 . 0 0 "[ . 1 . 2]" 1
348 1 66 GLU HA 1 70 LYS H . . 5.320 4.494 4.150 4.994 . 0 0 "[ . 1 . 2]" 1
349 1 70 LYS H 1 71 LEU H . . 3.610 2.645 2.352 2.746 . 0 0 "[ . 1 . 2]" 1
350 1 69 LEU H 1 70 LYS H . . 3.440 2.830 2.613 3.030 . 0 0 "[ . 1 . 2]" 1
351 1 105 ILE MG 1 109 ALA H . . 5.050 4.493 4.389 4.599 . 0 0 "[ . 1 . 2]" 1
352 1 49 VAL MG1 1 109 ALA H . . 4.320 3.672 3.439 3.862 . 0 0 "[ . 1 . 2]" 1
353 1 109 ALA H 1 109 ALA MB . . 2.910 2.212 2.171 2.239 . 0 0 "[ . 1 . 2]" 1
354 1 108 PHE QB 1 109 ALA H . . 3.360 2.824 2.735 2.932 . 0 0 "[ . 1 . 2]" 1
355 1 109 ALA H 1 110 ALA H . . 3.420 2.335 2.265 2.395 . 0 0 "[ . 1 . 2]" 1
356 1 50 LYS H 1 105 ILE MD . . 4.730 3.173 2.859 3.499 . 0 0 "[ . 1 . 2]" 1
357 1 49 VAL MG2 1 50 LYS H . . 4.110 3.941 3.839 4.045 . 0 0 "[ . 1 . 2]" 1
358 1 49 VAL MG1 1 50 LYS H . . 3.650 3.326 3.136 3.610 . 0 0 "[ . 1 . 2]" 1
359 1 50 LYS H 1 50 LYS HB3 . . 3.660 3.537 3.503 3.552 . 0 0 "[ . 1 . 2]" 1
360 1 50 LYS H 1 50 LYS HB2 . . 3.130 2.445 2.264 2.543 . 0 0 "[ . 1 . 2]" 1
361 1 49 VAL HB 1 50 LYS H . . 3.570 2.632 2.399 2.909 . 0 0 "[ . 1 . 2]" 1
362 1 49 VAL H 1 50 LYS H . . 3.290 2.927 2.782 3.023 . 0 0 "[ . 1 . 2]" 1
363 1 11 VAL H 1 11 VAL MG2 . . 3.480 1.999 1.880 2.392 . 0 0 "[ . 1 . 2]" 1
364 1 11 VAL H 1 12 LEU QB . . 5.490 5.164 4.893 5.345 . 0 0 "[ . 1 . 2]" 1
365 1 11 VAL H 1 11 VAL HB . . 3.650 2.566 2.407 2.655 . 0 0 "[ . 1 . 2]" 1
366 1 10 SER HB2 1 11 VAL H . . 4.840 3.140 2.630 3.921 . 0 0 "[ . 1 . 2]" 1
367 1 10 SER HB3 1 11 VAL H . . 4.840 3.272 2.499 4.535 . 0 0 "[ . 1 . 2]" 1
368 1 11 VAL H 1 12 LEU H . . 3.180 2.825 2.287 2.860 . 0 0 "[ . 1 . 2]" 1
369 1 20 ALA MB 1 21 LEU H . . 3.310 2.947 2.627 3.103 . 0 0 "[ . 1 . 2]" 1
370 1 21 LEU H 1 21 LEU MD1 . . 3.860 3.525 3.239 3.759 . 0 0 "[ . 1 . 2]" 1
371 1 21 LEU H 1 21 LEU HB2 . . 3.770 2.189 2.097 2.392 . 0 0 "[ . 1 . 2]" 1
372 1 21 LEU H 1 21 LEU HG . . 3.290 3.029 2.292 3.290 0.000 11 0 "[ . 1 . 2]" 1
373 1 21 LEU H 1 21 LEU HB3 . . 3.770 3.462 3.403 3.547 . 0 0 "[ . 1 . 2]" 1
374 1 18 THR HA 1 21 LEU H . . 3.790 3.110 2.815 3.340 . 0 0 "[ . 1 . 2]" 1
375 1 72 PHE H 1 83 LEU MD2 . . 4.560 2.479 2.128 3.261 . 0 0 "[ . 1 . 2]" 1
376 1 71 LEU MD2 1 72 PHE H . . 5.170 4.402 4.040 4.670 . 0 0 "[ . 1 . 2]" 1
377 1 56 ILE MG 1 72 PHE H . . 4.870 4.121 3.627 4.488 . 0 0 "[ . 1 . 2]" 1
378 1 71 LEU HB2 1 72 PHE H . . 4.950 4.154 4.013 4.176 . 0 0 "[ . 1 . 2]" 1
379 1 71 LEU HB3 1 72 PHE H . . 4.770 4.578 4.516 4.640 . 0 0 "[ . 1 . 2]" 1
380 1 72 PHE H 1 72 PHE HB2 . . 3.440 2.561 2.394 2.698 . 0 0 "[ . 1 . 2]" 1
381 1 72 PHE H 1 72 PHE HB3 . . 3.150 2.186 2.098 2.321 . 0 0 "[ . 1 . 2]" 1
382 1 72 PHE H 1 72 PHE QD . . 4.300 4.035 3.950 4.077 . 0 0 "[ . 1 . 2]" 1
383 1 71 LEU H 1 72 PHE H . . 3.510 2.802 2.632 2.855 . 0 0 "[ . 1 . 2]" 1
384 1 26 ALA H 1 26 ALA MB . . 2.990 2.081 1.963 2.230 . 0 0 "[ . 1 . 2]" 1
385 1 25 LYS QG 1 26 ALA H . . 4.680 3.748 1.893 4.684 0.004 20 0 "[ . 1 . 2]" 1
386 1 25 LYS HB2 1 26 ALA H . . 4.040 3.629 3.184 4.022 . 0 0 "[ . 1 . 2]" 1
387 1 25 LYS HB3 1 26 ALA H . . 4.040 3.631 2.684 4.013 . 0 0 "[ . 1 . 2]" 1
388 1 25 LYS QE 1 26 ALA H . . 4.920 4.599 3.681 4.921 0.001 19 0 "[ . 1 . 2]" 1
389 1 24 CYS HA 1 26 ALA H . . 4.740 3.434 2.968 3.793 . 0 0 "[ . 1 . 2]" 1
390 1 25 LYS H 1 26 ALA H . . 3.810 2.628 2.316 2.939 . 0 0 "[ . 1 . 2]" 1
391 1 47 ASP H 1 47 ASP QB . . 3.430 2.183 2.093 2.296 . 0 0 "[ . 1 . 2]" 1
392 1 46 THR HB 1 47 ASP H . . 3.840 3.386 3.165 3.763 . 0 0 "[ . 1 . 2]" 1
393 1 45 SER HB3 1 47 ASP H . . 4.060 2.399 2.156 2.702 . 0 0 "[ . 1 . 2]" 1
394 1 46 THR H 1 47 ASP H . . 4.580 2.696 2.543 2.804 . 0 0 "[ . 1 . 2]" 1
395 1 96 ASP H 1 96 ASP HB2 . . 3.620 2.110 2.062 2.195 . 0 0 "[ . 1 . 2]" 1
396 1 96 ASP H 1 96 ASP HB3 . . 3.620 2.906 2.750 3.006 . 0 0 "[ . 1 . 2]" 1
397 1 93 LYS HA 1 96 ASP H . . 4.510 4.047 3.626 4.482 . 0 0 "[ . 1 . 2]" 1
398 1 95 GLY H 1 96 ASP H . . 3.420 2.487 2.155 2.905 . 0 0 "[ . 1 . 2]" 1
399 1 48 GLU H 1 49 VAL MG2 . . 4.560 4.021 3.824 4.366 . 0 0 "[ . 1 . 2]" 1
400 1 46 THR MG 1 48 GLU H . . 5.500 5.466 4.918 5.523 0.023 9 0 "[ . 1 . 2]" 1
401 1 48 GLU H 1 50 LYS QD . . 5.500 5.269 4.885 5.504 0.004 9 0 "[ . 1 . 2]" 1
402 1 48 GLU H 1 51 LYS QD . . 5.500 5.450 5.101 5.545 0.045 9 0 "[ . 1 . 2]" 1
403 1 48 GLU H 1 48 GLU HB3 . . 3.630 2.230 2.190 2.325 . 0 0 "[ . 1 . 2]" 1
404 1 48 GLU H 1 48 GLU HG2 . . 3.930 2.609 2.456 2.703 . 0 0 "[ . 1 . 2]" 1
405 1 48 GLU H 1 48 GLU HB2 . . 3.620 3.493 3.474 3.535 . 0 0 "[ . 1 . 2]" 1
406 1 45 SER HB3 1 48 GLU H . . 4.760 3.377 2.206 3.940 . 0 0 "[ . 1 . 2]" 1
407 1 47 ASP H 1 48 GLU H . . 3.600 2.743 2.485 2.962 . 0 0 "[ . 1 . 2]" 1
408 1 34 LYS HB2 1 35 PHE H . . 3.550 2.570 2.270 3.003 . 0 0 "[ . 1 . 2]" 1
409 1 34 LYS HB3 1 35 PHE H . . 3.550 3.372 2.951 3.552 0.002 8 0 "[ . 1 . 2]" 1
410 1 35 PHE H 1 35 PHE HB2 . . 3.450 2.042 1.964 2.169 . 0 0 "[ . 1 . 2]" 1
411 1 35 PHE H 1 35 PHE HB3 . . 3.420 2.793 2.645 2.932 . 0 0 "[ . 1 . 2]" 1
412 1 33 LYS H 1 35 PHE H . . 5.010 4.464 4.067 4.822 . 0 0 "[ . 1 . 2]" 1
413 1 35 PHE H 1 35 PHE QD . . 4.660 3.897 3.770 4.017 . 0 0 "[ . 1 . 2]" 1
414 1 34 LYS H 1 35 PHE H . . 3.360 2.817 2.607 3.128 . 0 0 "[ . 1 . 2]" 1
415 1 35 PHE H 1 36 PHE H . . 3.660 3.151 2.931 3.231 . 0 0 "[ . 1 . 2]" 1
416 1 50 LYS HB2 1 51 LYS H . . 2.990 2.822 2.494 3.019 0.029 9 0 "[ . 1 . 2]" 1
417 1 51 LYS H 1 51 LYS QE . . 5.420 4.204 3.835 4.718 . 0 0 "[ . 1 . 2]" 1
418 1 51 LYS H 1 52 ALA H . . 3.320 2.471 2.268 2.672 . 0 0 "[ . 1 . 2]" 1
419 1 50 LYS H 1 51 LYS H . . 3.510 2.659 2.435 2.845 . 0 0 "[ . 1 . 2]" 1
420 1 41 LEU MD2 1 52 ALA H . . 4.970 4.421 4.140 4.725 . 0 0 "[ . 1 . 2]" 1
421 1 49 VAL MG1 1 52 ALA H . . 4.470 4.306 4.087 4.443 . 0 0 "[ . 1 . 2]" 1
422 1 52 ALA H 1 52 ALA MB . . 2.980 2.111 2.023 2.211 . 0 0 "[ . 1 . 2]" 1
423 1 52 ALA H 1 53 PHE HB2 . . 4.930 4.692 4.438 4.913 . 0 0 "[ . 1 . 2]" 1
424 1 49 VAL HA 1 52 ALA H . . 4.080 3.166 2.950 3.435 . 0 0 "[ . 1 . 2]" 1
425 1 88 THR MG 1 89 LYS H . . 4.160 3.833 3.637 4.025 . 0 0 "[ . 1 . 2]" 1
426 1 89 LYS H 1 89 LYS QG . . 3.320 2.964 2.854 3.107 . 0 0 "[ . 1 . 2]" 1
427 1 89 LYS H 1 89 LYS HB2 . . 3.410 2.102 2.091 2.124 . 0 0 "[ . 1 . 2]" 1
428 1 89 LYS H 1 89 LYS HB3 . . 3.410 3.403 3.385 3.411 0.001 16 0 "[ . 1 . 2]" 1
429 1 88 THR HB 1 89 LYS H . . 3.800 3.043 2.770 3.335 . 0 0 "[ . 1 . 2]" 1
430 1 89 LYS H 1 90 ALA H . . 3.520 2.641 2.383 2.851 . 0 0 "[ . 1 . 2]" 1
431 1 105 ILE H 1 105 ILE HB . . 2.930 2.284 2.218 2.352 . 0 0 "[ . 1 . 2]" 1
432 1 104 GLY HA3 1 105 ILE H . . 3.510 2.460 2.422 2.667 . 0 0 "[ . 1 . 2]" 1
433 1 53 PHE QE 1 105 ILE H . . 5.090 4.239 3.424 4.604 . 0 0 "[ . 1 . 2]" 1
434 1 53 PHE HZ 1 105 ILE H . . 4.790 4.745 4.355 4.796 0.006 2 0 "[ . 1 . 2]" 1
435 1 33 LYS H 1 33 LYS HG2 . . 3.780 2.824 1.949 3.779 . 0 0 "[ . 1 . 2]" 1
436 1 33 LYS H 1 33 LYS QB . . 3.260 2.308 2.164 2.551 . 0 0 "[ . 1 . 2]" 1
437 1 33 LYS H 1 33 LYS QE . . 4.710 4.213 3.348 4.711 0.001 16 0 "[ . 1 . 2]" 1
438 1 71 LEU MD2 1 82 ALA H . . 5.200 4.918 4.416 5.202 0.002 3 0 "[ . 1 . 2]" 1
439 1 82 ALA H 1 82 ALA MB . . 3.050 2.352 2.167 2.547 . 0 0 "[ . 1 . 2]" 1
440 1 81 ARG HG2 1 82 ALA H . . 5.070 4.453 4.236 4.909 . 0 0 "[ . 1 . 2]" 1
441 1 81 ARG HB3 1 82 ALA H . . 3.990 3.687 3.530 3.991 0.001 2 0 "[ . 1 . 2]" 1
442 1 82 ALA H 1 83 LEU H . . 4.600 4.402 4.133 4.550 . 0 0 "[ . 1 . 2]" 1
443 1 85 ASP QB 1 86 ALA H . . 4.090 3.182 2.714 3.620 . 0 0 "[ . 1 . 2]" 1
444 1 90 ALA H 1 90 ALA MB . . 2.850 2.062 1.941 2.164 . 0 0 "[ . 1 . 2]" 1
445 1 89 LYS HB2 1 90 ALA H . . 3.240 2.867 2.598 3.035 . 0 0 "[ . 1 . 2]" 1
446 1 89 LYS HB3 1 90 ALA H . . 3.380 3.193 2.818 3.383 0.003 4 0 "[ . 1 . 2]" 1
447 1 90 ALA H 1 91 PHE HB2 . . 4.780 4.570 4.194 4.782 0.002 4 0 "[ . 1 . 2]" 1
448 1 69 LEU H 1 69 LEU HB2 . . 3.670 2.140 2.071 2.260 . 0 0 "[ . 1 . 2]" 1
449 1 69 LEU H 1 69 LEU HG . . 3.560 2.822 2.528 3.080 . 0 0 "[ . 1 . 2]" 1
450 1 69 LEU H 1 69 LEU HB3 . . 3.670 3.439 3.384 3.496 . 0 0 "[ . 1 . 2]" 1
451 1 68 GLU HB3 1 69 LEU H . . 4.300 3.808 3.359 4.093 . 0 0 "[ . 1 . 2]" 1
452 1 68 GLU HG2 1 69 LEU H . . 5.500 5.111 4.897 5.507 0.007 11 0 "[ . 1 . 2]" 1
453 1 68 GLU HG3 1 69 LEU H . . 5.500 4.729 4.236 4.949 . 0 0 "[ . 1 . 2]" 1
454 1 68 GLU HB2 1 69 LEU H . . 4.020 3.067 2.788 3.413 . 0 0 "[ . 1 . 2]" 1
455 1 66 GLU HA 1 69 LEU H . . 4.000 3.133 2.834 3.304 . 0 0 "[ . 1 . 2]" 1
456 1 17 VAL H 1 17 VAL MG2 . . 3.280 2.342 2.087 2.490 . 0 0 "[ . 1 . 2]" 1
457 1 12 LEU QB 1 17 VAL H . . 4.710 3.688 3.381 4.039 . 0 0 "[ . 1 . 2]" 1
458 1 17 VAL H 1 17 VAL HB . . 3.620 3.513 3.493 3.534 . 0 0 "[ . 1 . 2]" 1
459 1 100 ASP H 1 101 GLY H . . 3.310 2.103 1.900 2.453 . 0 0 "[ . 1 . 2]" 1
460 1 100 ASP H 1 101 GLY HA2 . . 4.930 4.462 4.273 4.736 . 0 0 "[ . 1 . 2]" 1
461 1 6 MET H 1 6 MET ME . . 5.500 4.377 2.323 5.389 . 0 0 "[ . 1 . 2]" 1
462 1 105 ILE MD 1 106 ASP H . . 4.010 3.852 3.589 4.031 0.021 7 0 "[ . 1 . 2]" 1
463 1 105 ILE MG 1 106 ASP H . . 2.940 2.049 1.838 2.314 . 0 0 "[ . 1 . 2]" 1
464 1 106 ASP H 1 106 ASP HB2 . . 3.610 3.084 2.849 3.498 . 0 0 "[ . 1 . 2]" 1
465 1 106 ASP H 1 106 ASP HB3 . . 3.610 3.279 2.851 3.500 . 0 0 "[ . 1 . 2]" 1
466 1 105 ILE H 1 106 ASP H . . 3.680 2.401 2.302 2.545 . 0 0 "[ . 1 . 2]" 1
467 1 12 LEU MD1 1 13 LYS H . . 4.510 4.386 4.282 4.511 0.001 20 0 "[ . 1 . 2]" 1
468 1 12 LEU MD2 1 13 LYS H . . 4.090 3.603 3.038 3.965 . 0 0 "[ . 1 . 2]" 1
469 1 13 LYS H 1 17 VAL MG2 . . 4.930 4.830 4.487 4.931 0.001 3 0 "[ . 1 . 2]" 1
470 1 12 LEU QB 1 13 LYS H . . 3.230 2.154 2.034 2.391 . 0 0 "[ . 1 . 2]" 1
471 1 13 LYS H 1 13 LYS HB2 . . 4.090 2.550 2.123 2.832 . 0 0 "[ . 1 . 2]" 1
472 1 13 LYS H 1 13 LYS HB3 . . 4.090 3.209 2.322 3.642 . 0 0 "[ . 1 . 2]" 1
473 1 13 LYS H 1 16 GLU QG . . 4.550 3.705 3.018 4.407 . 0 0 "[ . 1 . 2]" 1
474 1 49 VAL H 1 49 VAL MG2 . . 3.130 1.981 1.911 2.279 . 0 0 "[ . 1 . 2]" 1
475 1 46 THR HA 1 49 VAL H . . 4.210 3.368 3.217 3.553 . 0 0 "[ . 1 . 2]" 1
476 1 48 GLU H 1 49 VAL H . . 3.550 2.709 2.557 2.802 . 0 0 "[ . 1 . 2]" 1
477 1 21 LEU MD1 1 22 ASP H . . 4.910 4.631 4.160 4.891 . 0 0 "[ . 1 . 2]" 1
478 1 21 LEU MD2 1 22 ASP H . . 5.150 4.851 4.722 4.993 . 0 0 "[ . 1 . 2]" 1
479 1 18 THR MG 1 22 ASP H . . 4.690 4.056 3.628 4.457 . 0 0 "[ . 1 . 2]" 1
480 1 21 LEU HB2 1 22 ASP H . . 3.860 2.946 2.485 3.230 . 0 0 "[ . 1 . 2]" 1
481 1 21 LEU HG 1 22 ASP H . . 4.940 4.818 4.494 4.943 0.003 11 0 "[ . 1 . 2]" 1
482 1 21 LEU HB3 1 22 ASP H . . 3.860 3.566 3.348 3.813 . 0 0 "[ . 1 . 2]" 1
483 1 22 ASP H 1 22 ASP HB3 . . 3.190 2.712 2.563 2.829 . 0 0 "[ . 1 . 2]" 1
484 1 20 ALA HA 1 22 ASP H . . 4.890 4.367 4.009 4.853 . 0 0 "[ . 1 . 2]" 1
485 1 18 THR HA 1 22 ASP H . . 4.640 4.220 4.016 4.492 . 0 0 "[ . 1 . 2]" 1
486 1 19 ALA HA 1 22 ASP H . . 3.700 3.225 3.032 3.446 . 0 0 "[ . 1 . 2]" 1
487 1 22 ASP H 1 23 GLY H . . 3.560 2.395 2.202 2.613 . 0 0 "[ . 1 . 2]" 1
488 1 21 LEU H 1 22 ASP H . . 3.400 2.388 2.194 2.863 . 0 0 "[ . 1 . 2]" 1
489 1 80 ALA H 1 80 ALA MB . . 2.940 2.073 1.962 2.188 . 0 0 "[ . 1 . 2]" 1
490 1 77 LYS HB2 1 80 ALA H . . 4.790 4.631 4.177 4.798 0.008 4 0 "[ . 1 . 2]" 1
491 1 77 LYS HB3 1 80 ALA H . . 4.790 2.939 2.426 3.190 . 0 0 "[ . 1 . 2]" 1
492 1 74 GLN HG2 1 80 ALA H . . 4.300 2.983 2.344 3.981 . 0 0 "[ . 1 . 2]" 1
493 1 80 ALA H 1 81 ARG H . . 5.100 4.590 4.486 4.649 . 0 0 "[ . 1 . 2]" 1
494 1 38 ALA H 1 38 ALA MB . . 2.880 2.005 1.955 2.081 . 0 0 "[ . 1 . 2]" 1
495 1 37 LYS QD 1 38 ALA H . . 5.170 4.761 3.380 5.171 0.001 15 0 "[ . 1 . 2]" 1
496 1 37 LYS QB 1 38 ALA H . . 3.240 3.072 2.252 3.223 . 0 0 "[ . 1 . 2]" 1
497 1 35 PHE HA 1 38 ALA H . . 3.660 3.302 3.066 3.517 . 0 0 "[ . 1 . 2]" 1
498 1 37 LYS H 1 38 ALA H . . 3.360 2.424 2.236 2.689 . 0 0 "[ . 1 . 2]" 1
499 1 12 LEU MD2 1 41 LEU H . . 4.280 3.752 2.933 4.196 . 0 0 "[ . 1 . 2]" 1
500 1 41 LEU H 1 41 LEU MD1 . . 3.990 3.477 3.278 3.664 . 0 0 "[ . 1 . 2]" 1
501 1 41 LEU H 1 41 LEU HB2 . . 3.050 2.200 2.073 2.286 . 0 0 "[ . 1 . 2]" 1
502 1 39 CYS HB2 1 41 LEU H . . 4.560 3.296 2.362 4.128 . 0 0 "[ . 1 . 2]" 1
503 1 39 CYS HB3 1 41 LEU H . . 4.560 3.938 2.440 4.565 0.005 12 0 "[ . 1 . 2]" 1
504 1 37 LYS HA 1 41 LEU H . . 4.910 4.706 4.421 4.911 0.001 20 0 "[ . 1 . 2]" 1
505 1 40 GLY H 1 41 LEU H . . 3.410 2.453 2.178 2.651 . 0 0 "[ . 1 . 2]" 1
506 1 41 LEU H 1 42 SER H . . 3.550 2.868 2.627 3.017 . 0 0 "[ . 1 . 2]" 1
507 1 83 LEU H 1 83 LEU MD1 . . 4.310 2.805 1.931 3.296 . 0 0 "[ . 1 . 2]" 1
508 1 83 LEU H 1 83 LEU MD2 . . 4.320 1.964 1.823 3.398 . 0 0 "[ . 1 . 2]" 1
509 1 71 LEU MD2 1 83 LEU H . . 4.700 4.476 3.855 4.701 0.001 19 0 "[ . 1 . 2]" 1
510 1 82 ALA MB 1 83 LEU H . . 3.430 3.091 2.842 3.424 . 0 0 "[ . 1 . 2]" 1
511 1 83 LEU H 1 83 LEU HB3 . . 3.900 3.532 3.488 3.552 . 0 0 "[ . 1 . 2]" 1
512 1 83 LEU H 1 83 LEU HG . . 4.020 3.852 3.630 4.020 . 0 0 "[ . 1 . 2]" 1
513 1 83 LEU H 1 83 LEU HB2 . . 3.450 2.408 2.227 2.657 . 0 0 "[ . 1 . 2]" 1
514 1 70 LYS HA 1 83 LEU H . . 3.960 2.919 2.431 3.399 . 0 0 "[ . 1 . 2]" 1
515 1 20 ALA H 1 20 ALA MB . . 2.900 2.141 1.996 2.224 . 0 0 "[ . 1 . 2]" 1
516 1 18 THR MG 1 20 ALA H . . 4.620 4.389 4.027 4.609 . 0 0 "[ . 1 . 2]" 1
517 1 19 ALA MB 1 20 ALA H . . 3.080 2.911 2.716 3.057 . 0 0 "[ . 1 . 2]" 1
518 1 17 VAL HA 1 20 ALA H . . 4.060 3.126 2.961 3.343 . 0 0 "[ . 1 . 2]" 1
519 1 19 ALA H 1 20 ALA H . . 3.370 2.669 2.601 2.796 . 0 0 "[ . 1 . 2]" 1
520 1 20 ALA H 1 21 LEU H . . 3.350 2.421 2.234 2.679 . 0 0 "[ . 1 . 2]" 1
521 1 20 ALA H 1 22 ASP H . . 4.980 4.013 3.784 4.391 . 0 0 "[ . 1 . 2]" 1
522 1 105 ILE MD 1 107 GLU H . . 5.080 4.635 4.451 5.041 . 0 0 "[ . 1 . 2]" 1
523 1 105 ILE MG 1 107 GLU H . . 4.630 4.086 3.975 4.259 . 0 0 "[ . 1 . 2]" 1
524 1 103 ILE MG 1 107 GLU H . . 4.300 4.057 3.722 4.295 . 0 0 "[ . 1 . 2]" 1
525 1 107 GLU H 1 107 GLU HB2 . . 2.910 2.266 2.162 2.404 . 0 0 "[ . 1 . 2]" 1
526 1 107 GLU H 1 107 GLU HG3 . . 3.310 3.117 2.534 3.315 0.005 20 0 "[ . 1 . 2]" 1
527 1 107 GLU H 1 108 PHE QB . . 4.840 3.818 3.696 3.893 . 0 0 "[ . 1 . 2]" 1
528 1 106 ASP H 1 107 GLU H . . 3.240 2.603 2.486 2.765 . 0 0 "[ . 1 . 2]" 1
529 1 107 GLU H 1 109 ALA H . . 4.910 3.579 3.382 3.816 . 0 0 "[ . 1 . 2]" 1
530 1 107 GLU H 1 108 PHE H . . 3.500 2.240 2.080 2.366 . 0 0 "[ . 1 . 2]" 1
531 1 104 GLY H 1 107 GLU H . . 4.780 3.681 3.395 4.008 . 0 0 "[ . 1 . 2]" 1
532 1 69 LEU MD1 1 91 PHE H . . 5.330 4.948 4.305 5.259 . 0 0 "[ . 1 . 2]" 1
533 1 89 LYS HB2 1 91 PHE H . . 5.470 4.993 4.551 5.367 . 0 0 "[ . 1 . 2]" 1
534 1 91 PHE H 1 91 PHE HB2 . . 3.100 2.223 1.992 2.461 . 0 0 "[ . 1 . 2]" 1
535 1 91 PHE H 1 91 PHE HB3 . . 3.210 2.551 2.342 2.776 . 0 0 "[ . 1 . 2]" 1
536 1 89 LYS HA 1 91 PHE H . . 4.650 4.220 3.713 4.653 0.003 11 0 "[ . 1 . 2]" 1
537 1 91 PHE H 1 91 PHE QD . . 4.790 4.053 3.981 4.098 . 0 0 "[ . 1 . 2]" 1
538 1 91 PHE H 1 92 LEU H . . 3.430 2.481 2.300 2.715 . 0 0 "[ . 1 . 2]" 1
539 1 105 ILE MG 1 108 PHE H . . 4.950 4.767 4.531 4.910 . 0 0 "[ . 1 . 2]" 1
540 1 108 PHE H 1 109 ALA MB . . 4.980 4.219 4.064 4.376 . 0 0 "[ . 1 . 2]" 1
541 1 107 GLU HB2 1 108 PHE H . . 3.620 2.845 2.569 3.122 . 0 0 "[ . 1 . 2]" 1
542 1 107 GLU HB3 1 108 PHE H . . 3.680 3.498 3.234 3.690 0.010 8 0 "[ . 1 . 2]" 1
543 1 105 ILE HA 1 108 PHE H . . 4.150 3.020 2.849 3.151 . 0 0 "[ . 1 . 2]" 1
544 1 108 PHE H 1 108 PHE QB . . 3.080 2.041 1.987 2.084 . 0 0 "[ . 1 . 2]" 1
545 1 53 PHE QD 1 108 PHE H . . 5.500 4.604 4.336 4.925 . 0 0 "[ . 1 . 2]" 1
546 1 53 PHE QE 1 108 PHE H . . 5.140 4.762 4.468 5.125 . 0 0 "[ . 1 . 2]" 1
547 1 108 PHE H 1 108 PHE QD . . 4.650 4.001 3.880 4.064 . 0 0 "[ . 1 . 2]" 1
548 1 108 PHE H 1 109 ALA H . . 3.630 2.562 2.397 2.724 . 0 0 "[ . 1 . 2]" 1
549 1 66 GLU H 1 69 LEU MD1 . . 4.900 4.099 3.540 4.603 . 0 0 "[ . 1 . 2]" 1
550 1 66 GLU H 1 92 LEU MD1 . . 4.640 4.062 3.567 4.606 . 0 0 "[ . 1 . 2]" 1
551 1 66 GLU H 1 92 LEU MD2 . . 4.920 4.631 3.774 4.925 0.005 11 0 "[ . 1 . 2]" 1
552 1 65 GLU HG2 1 66 GLU H . . 4.720 4.429 4.048 4.654 . 0 0 "[ . 1 . 2]" 1
553 1 66 GLU H 1 66 GLU HB3 . . 2.860 2.556 2.361 2.846 . 0 0 "[ . 1 . 2]" 1
554 1 66 GLU H 1 66 GLU HB2 . . 2.880 2.416 2.160 2.634 . 0 0 "[ . 1 . 2]" 1
555 1 65 GLU HB3 1 66 GLU H . . 3.950 2.471 2.166 2.734 . 0 0 "[ . 1 . 2]" 1
556 1 65 GLU HG3 1 66 GLU H . . 4.720 4.159 3.659 4.642 . 0 0 "[ . 1 . 2]" 1
557 1 66 GLU H 1 68 GLU H . . 5.030 4.179 3.873 4.756 . 0 0 "[ . 1 . 2]" 1
558 1 66 GLU H 1 67 GLU H . . 3.810 2.792 2.504 2.954 . 0 0 "[ . 1 . 2]" 1
559 1 7 ALA MB 1 9 ALA H . . 4.560 4.139 4.008 4.276 . 0 0 "[ . 1 . 2]" 1
560 1 9 ALA H 1 9 ALA MB . . 3.130 2.101 1.934 2.177 . 0 0 "[ . 1 . 2]" 1
561 1 8 PHE HB3 1 9 ALA H . . 5.120 3.762 3.580 3.960 . 0 0 "[ . 1 . 2]" 1
562 1 8 PHE H 1 9 ALA H . . 4.190 2.733 2.566 2.836 . 0 0 "[ . 1 . 2]" 1
563 1 92 LEU MD1 1 103 ILE H . . 4.530 4.398 3.612 4.533 0.003 5 0 "[ . 1 . 2]" 1
564 1 64 ILE MG 1 103 ILE H . . 4.170 3.697 3.313 4.172 0.002 16 0 "[ . 1 . 2]" 1
565 1 103 ILE H 1 103 ILE MD . . 4.560 4.476 4.205 4.588 0.028 19 0 "[ . 1 . 2]" 1
566 1 103 ILE H 1 103 ILE HG12 . . 4.240 4.161 4.032 4.251 0.011 16 0 "[ . 1 . 2]" 1
567 1 103 ILE H 1 103 ILE MG . . 4.120 3.590 3.514 3.658 . 0 0 "[ . 1 . 2]" 1
568 1 103 ILE H 1 103 ILE HG13 . . 3.990 3.525 3.236 3.676 . 0 0 "[ . 1 . 2]" 1
569 1 102 LYS HB2 1 103 ILE H . . 3.820 3.528 2.436 3.828 0.008 9 0 "[ . 1 . 2]" 1
570 1 102 LYS HB3 1 103 ILE H . . 3.820 2.809 2.217 3.646 . 0 0 "[ . 1 . 2]" 1
571 1 103 ILE H 1 103 ILE HB . . 3.450 2.496 2.314 2.612 . 0 0 "[ . 1 . 2]" 1
572 1 63 PHE HB3 1 103 ILE H . . 4.410 3.370 2.890 3.699 . 0 0 "[ . 1 . 2]" 1
573 1 63 PHE QD 1 103 ILE H . . 5.500 4.524 3.602 5.395 . 0 0 "[ . 1 . 2]" 1
574 1 65 GLU H 1 103 ILE H . . 4.940 4.442 4.295 4.632 . 0 0 "[ . 1 . 2]" 1
575 1 19 ALA H 1 20 ALA MB . . 4.740 4.266 4.205 4.389 . 0 0 "[ . 1 . 2]" 1
576 1 18 THR MG 1 19 ALA H . . 3.940 2.593 1.876 3.114 . 0 0 "[ . 1 . 2]" 1
577 1 19 ALA H 1 19 ALA MB . . 2.980 1.995 1.932 2.131 . 0 0 "[ . 1 . 2]" 1
578 1 16 GLU HA 1 19 ALA H . . 3.730 3.603 3.313 3.731 0.001 17 0 "[ . 1 . 2]" 1
579 1 18 THR HB 1 19 ALA H . . 3.500 2.942 2.599 3.514 0.014 2 0 "[ . 1 . 2]" 1
580 1 97 SER H 1 107 GLU HG2 . . 3.500 2.632 2.071 3.081 . 0 0 "[ . 1 . 2]" 1
581 1 97 SER H 1 107 GLU HG3 . . 4.540 4.199 3.686 4.542 0.002 16 0 "[ . 1 . 2]" 1
582 1 97 SER H 1 97 SER HB2 . . 3.500 2.670 2.024 3.502 0.002 13 0 "[ . 1 . 2]" 1
583 1 97 SER H 1 97 SER HB3 . . 3.500 2.886 2.235 3.442 . 0 0 "[ . 1 . 2]" 1
584 1 96 ASP H 1 97 SER H . . 4.530 4.380 4.055 4.550 0.020 7 0 "[ . 1 . 2]" 1
585 1 25 LYS H 1 25 LYS QG . . 3.870 2.920 1.970 3.820 . 0 0 "[ . 1 . 2]" 1
586 1 25 LYS H 1 25 LYS HB2 . . 3.630 2.584 2.113 3.544 . 0 0 "[ . 1 . 2]" 1
587 1 25 LYS H 1 25 LYS HB3 . . 3.630 2.960 2.414 3.493 . 0 0 "[ . 1 . 2]" 1
588 1 22 ASP HA 1 25 LYS H . . 4.430 3.275 2.916 3.499 . 0 0 "[ . 1 . 2]" 1
589 1 73 LEU MD1 1 81 ARG HE . . 5.110 2.431 1.881 4.434 . 0 0 "[ . 1 . 2]" 1
590 1 25 LYS HA 1 81 ARG HE . . 4.270 3.903 3.245 4.271 0.001 4 0 "[ . 1 . 2]" 1
591 1 30 PHE H 1 87 GLU HE2 . . 5.410 4.273 3.408 5.149 . 0 0 "[ . 1 . 2]" 1
592 1 30 PHE H 1 87 GLU HG2 . . 4.830 3.131 2.560 3.500 . 0 0 "[ . 1 . 2]" 1
593 1 30 PHE H 1 87 GLU HG3 . . 4.830 4.285 3.446 4.832 0.002 19 0 "[ . 1 . 2]" 1
594 1 30 PHE H 1 30 PHE HB2 . . 3.570 2.743 2.402 2.927 . 0 0 "[ . 1 . 2]" 1
595 1 30 PHE H 1 30 PHE HB3 . . 3.570 2.113 2.033 2.295 . 0 0 "[ . 1 . 2]" 1
596 1 30 PHE H 1 81 ARG HH11 . . 4.930 3.390 2.341 4.884 . 0 0 "[ . 1 . 2]" 1
597 1 30 PHE H 1 81 ARG QH2 . . 5.080 4.804 3.830 5.081 0.001 1 0 "[ . 1 . 2]" 1
598 1 30 PHE H 1 31 ASP H . . 4.900 4.565 4.388 4.634 . 0 0 "[ . 1 . 2]" 1
599 1 30 PHE H 1 30 PHE QD . . 4.510 3.930 3.748 4.071 . 0 0 "[ . 1 . 2]" 1
600 1 7 ALA H 1 7 ALA MB . . 3.540 2.070 1.962 2.235 . 0 0 "[ . 1 . 2]" 1
601 1 6 MET HB2 1 7 ALA H . . 5.000 4.270 2.047 4.738 . 0 0 "[ . 1 . 2]" 1
602 1 6 MET HB3 1 7 ALA H . . 5.000 4.175 2.553 4.703 . 0 0 "[ . 1 . 2]" 1
603 1 64 ILE HG12 1 65 GLU H . . 5.140 4.742 4.492 4.926 . 0 0 "[ . 1 . 2]" 1
604 1 65 GLU H 1 65 GLU HB2 . . 3.830 2.462 2.344 2.733 . 0 0 "[ . 1 . 2]" 1
605 1 65 GLU H 1 65 GLU HB3 . . 3.830 3.545 3.533 3.559 . 0 0 "[ . 1 . 2]" 1
606 1 64 ILE HA 1 65 GLU H . . 3.410 2.339 2.205 2.406 . 0 0 "[ . 1 . 2]" 1
607 1 65 GLU H 1 68 GLU H . . 4.340 3.835 3.482 4.316 . 0 0 "[ . 1 . 2]" 1
608 1 65 GLU H 1 66 GLU H . . 4.890 4.655 4.599 4.673 . 0 0 "[ . 1 . 2]" 1
609 1 64 ILE H 1 64 ILE MG . . 4.310 3.689 3.564 3.792 . 0 0 "[ . 1 . 2]" 1
610 1 64 ILE H 1 64 ILE HB . . 3.580 2.434 2.128 2.631 . 0 0 "[ . 1 . 2]" 1
611 1 64 ILE H 1 103 ILE HB . . 4.330 4.047 3.612 4.333 0.003 17 0 "[ . 1 . 2]" 1
612 1 63 PHE HB3 1 64 ILE H . . 3.870 2.470 1.946 3.576 . 0 0 "[ . 1 . 2]" 1
613 1 63 PHE HB2 1 64 ILE H . . 4.320 3.607 3.051 4.360 0.040 17 0 "[ . 1 . 2]" 1
614 1 64 ILE H 1 104 GLY HA2 . . 4.760 3.652 3.305 4.005 . 0 0 "[ . 1 . 2]" 1
615 1 53 PHE QE 1 64 ILE H . . 4.410 3.447 2.553 4.003 . 0 0 "[ . 1 . 2]" 1
616 1 63 PHE QD 1 64 ILE H . . 4.380 3.839 3.348 4.385 0.005 4 0 "[ . 1 . 2]" 1
617 1 53 PHE HZ 1 64 ILE H . . 4.190 3.460 2.181 4.139 . 0 0 "[ . 1 . 2]" 1
618 1 64 ILE H 1 65 GLU H . . 5.090 3.807 3.504 4.350 . 0 0 "[ . 1 . 2]" 1
619 1 64 ILE H 1 103 ILE H . . 4.210 2.635 2.042 3.459 . 0 0 "[ . 1 . 2]" 1
620 1 56 ILE MG 1 58 GLN H . . 4.980 4.440 4.242 4.732 . 0 0 "[ . 1 . 2]" 1
621 1 57 ASP HB2 1 58 GLN H . . 4.710 4.532 4.411 4.701 . 0 0 "[ . 1 . 2]" 1
622 1 58 GLN H 1 58 GLN HB2 . . 3.830 2.595 2.465 2.756 . 0 0 "[ . 1 . 2]" 1
623 1 58 GLN H 1 58 GLN HB3 . . 3.830 3.627 3.577 3.740 . 0 0 "[ . 1 . 2]" 1
624 1 57 ASP HB3 1 58 GLN H . . 4.710 3.972 3.833 4.606 . 0 0 "[ . 1 . 2]" 1
625 1 58 GLN H 1 58 GLN HG2 . . 3.850 3.265 3.001 3.855 0.005 12 0 "[ . 1 . 2]" 1
626 1 58 GLN H 1 58 GLN HG3 . . 3.150 2.251 1.948 2.554 . 0 0 "[ . 1 . 2]" 1
627 1 58 GLN H 1 59 ASP H . . 3.950 2.202 1.857 2.463 . 0 0 "[ . 1 . 2]" 1
628 1 31 ASP H 1 31 ASP QB . . 3.790 2.476 2.279 2.663 . 0 0 "[ . 1 . 2]" 1
629 1 30 PHE QD 1 31 ASP H . . 4.600 3.056 1.954 3.897 . 0 0 "[ . 1 . 2]" 1
630 1 77 LYS QG 1 78 ALA H . . 3.440 2.298 1.936 2.902 . 0 0 "[ . 1 . 2]" 1
631 1 77 LYS HB2 1 78 ALA H . . 4.610 4.229 4.094 4.372 . 0 0 "[ . 1 . 2]" 1
632 1 77 LYS HB3 1 78 ALA H . . 4.610 3.708 3.219 3.995 . 0 0 "[ . 1 . 2]" 1
633 1 77 LYS HA 1 78 ALA H . . 3.180 2.315 2.249 2.418 . 0 0 "[ . 1 . 2]" 1
634 1 69 LEU MD2 1 103 ILE MD . . 3.900 1.888 1.776 2.031 . 0 0 "[ . 1 . 2]" 1
635 1 69 LEU MD1 1 103 ILE MD . . 3.830 2.195 1.749 2.538 . 0 0 "[ . 1 . 2]" 1
636 1 103 ILE MD 1 103 ILE MG . . 3.090 1.834 1.810 1.889 . 0 0 "[ . 1 . 2]" 1
637 1 103 ILE HB 1 103 ILE MD . . 3.750 2.511 2.443 2.547 . 0 0 "[ . 1 . 2]" 1
638 1 103 ILE MD 1 107 GLU HB3 . . 4.430 3.549 3.063 3.867 . 0 0 "[ . 1 . 2]" 1
639 1 103 ILE MD 1 108 PHE QB . . 5.500 4.106 3.669 4.633 . 0 0 "[ . 1 . 2]" 1
640 1 92 LEU HA 1 103 ILE MD . . 3.300 2.048 1.957 2.396 . 0 0 "[ . 1 . 2]" 1
641 1 95 GLY HA3 1 103 ILE MD . . 3.700 2.215 1.962 2.811 . 0 0 "[ . 1 . 2]" 1
642 1 103 ILE MD 1 108 PHE HA . . 4.910 3.648 3.355 3.998 . 0 0 "[ . 1 . 2]" 1
643 1 95 GLY HA2 1 103 ILE MD . . 4.220 3.731 3.429 4.234 0.014 8 0 "[ . 1 . 2]" 1
644 1 102 LYS HA 1 103 ILE MD . . 5.500 5.363 5.237 5.482 . 0 0 "[ . 1 . 2]" 1
645 1 96 ASP HA 1 103 ILE MD . . 4.250 3.631 3.329 4.016 . 0 0 "[ . 1 . 2]" 1
646 1 91 PHE QE 1 103 ILE MD . . 5.120 4.476 3.908 4.912 . 0 0 "[ . 1 . 2]" 1
647 1 91 PHE QD 1 103 ILE MD . . 4.820 4.105 3.267 4.588 . 0 0 "[ . 1 . 2]" 1
648 1 96 ASP H 1 103 ILE MD . . 4.170 1.959 1.784 2.396 . 0 0 "[ . 1 . 2]" 1
649 1 103 ILE MD 1 104 GLY H . . 5.220 5.013 4.750 5.176 . 0 0 "[ . 1 . 2]" 1
650 1 7 ALA MB 1 55 ILE MD . . 3.960 1.867 1.610 2.639 . 0 0 "[ . 1 . 2]" 1
651 1 55 ILE HB 1 55 ILE MD . . 3.270 3.123 2.430 3.216 . 0 0 "[ . 1 . 2]" 1
652 1 52 ALA MB 1 55 ILE MD . . 4.780 4.308 2.988 4.711 . 0 0 "[ . 1 . 2]" 1
653 1 8 PHE QE 1 55 ILE MD . . 4.870 4.075 2.592 4.821 . 0 0 "[ . 1 . 2]" 1
654 1 8 PHE QD 1 55 ILE MD . . 4.610 3.680 2.525 4.604 . 0 0 "[ . 1 . 2]" 1
655 1 49 VAL MG2 1 112 ILE MD . . 3.100 1.795 1.686 1.957 . 0 0 "[ . 1 . 2]" 1
656 1 49 VAL MG1 1 112 ILE MD . . 3.160 1.690 1.612 1.978 . 0 0 "[ . 1 . 2]" 1
657 1 112 ILE HB 1 112 ILE MD . . 3.630 2.311 2.187 2.472 . 0 0 "[ . 1 . 2]" 1
658 1 41 LEU HB3 1 112 ILE MD . . 3.820 3.084 2.810 3.291 . 0 0 "[ . 1 . 2]" 1
659 1 52 ALA MB 1 112 ILE MD . . 4.140 4.035 3.668 4.156 0.016 10 0 "[ . 1 . 2]" 1
660 1 44 LYS HB2 1 112 ILE MD . . 4.760 4.321 3.568 4.751 . 0 0 "[ . 1 . 2]" 1
661 1 49 VAL HB 1 112 ILE MD . . 5.110 3.507 3.241 4.065 . 0 0 "[ . 1 . 2]" 1
662 1 111 MET HG2 1 112 ILE MD . . 4.650 4.123 3.766 4.376 . 0 0 "[ . 1 . 2]" 1
663 1 42 SER HA 1 112 ILE MD . . 4.520 4.056 3.427 4.525 0.005 8 0 "[ . 1 . 2]" 1
664 1 112 ILE MD 1 113 LYS HA . . 5.450 4.875 4.665 5.218 . 0 0 "[ . 1 . 2]" 1
665 1 108 PHE HZ 1 112 ILE MD . . 4.130 3.932 3.573 4.140 0.010 16 0 "[ . 1 . 2]" 1
666 1 36 PHE QD 1 112 ILE MD . . 4.320 3.913 3.502 4.326 0.006 1 0 "[ . 1 . 2]" 1
667 1 36 PHE QE 1 112 ILE MD . . 4.630 3.951 3.386 4.539 . 0 0 "[ . 1 . 2]" 1
668 1 64 ILE MD 1 64 ILE MG . . 3.210 2.001 1.874 2.183 . 0 0 "[ . 1 . 2]" 1
669 1 56 ILE MG 1 64 ILE MD . . 3.260 2.862 2.095 3.235 . 0 0 "[ . 1 . 2]" 1
670 1 64 ILE MD 1 103 ILE MG . . 3.530 2.987 2.638 3.440 . 0 0 "[ . 1 . 2]" 1
671 1 56 ILE HB 1 64 ILE MD . . 3.570 2.579 2.063 2.896 . 0 0 "[ . 1 . 2]" 1
672 1 64 ILE HB 1 64 ILE MD . . 3.530 2.303 2.180 2.403 . 0 0 "[ . 1 . 2]" 1
673 1 64 ILE MD 1 103 ILE HB . . 4.170 4.052 3.475 4.182 0.012 11 0 "[ . 1 . 2]" 1
674 1 64 ILE MD 1 68 GLU HB2 . . 5.500 4.756 4.160 5.153 . 0 0 "[ . 1 . 2]" 1
675 1 64 ILE MD 1 72 PHE HB2 . . 5.500 5.279 4.896 5.512 0.012 17 0 "[ . 1 . 2]" 1
676 1 53 PHE HA 1 64 ILE MD . . 4.280 3.307 2.843 3.526 . 0 0 "[ . 1 . 2]" 1
677 1 64 ILE MD 1 108 PHE QB . . 4.460 3.212 2.894 3.507 . 0 0 "[ . 1 . 2]" 1
678 1 57 ASP HA 1 64 ILE MD . . 4.530 4.376 3.855 4.538 0.008 11 0 "[ . 1 . 2]" 1
679 1 64 ILE HA 1 64 ILE MD . . 4.140 3.770 3.712 3.829 . 0 0 "[ . 1 . 2]" 1
680 1 53 PHE QD 1 64 ILE MD . . 3.900 2.526 2.271 2.895 . 0 0 "[ . 1 . 2]" 1
681 1 53 PHE QE 1 64 ILE MD . . 3.940 2.459 2.032 3.332 . 0 0 "[ . 1 . 2]" 1
682 1 64 ILE MD 1 108 PHE QD . . 3.990 3.434 2.876 3.920 . 0 0 "[ . 1 . 2]" 1
683 1 64 ILE MD 1 108 PHE QE . . 4.360 3.993 3.385 4.360 0.000 4 0 "[ . 1 . 2]" 1
684 1 57 ASP H 1 64 ILE MD . . 4.740 3.418 2.866 4.062 . 0 0 "[ . 1 . 2]" 1
685 1 64 ILE H 1 64 ILE MD . . 4.590 3.987 3.455 4.337 . 0 0 "[ . 1 . 2]" 1
686 1 56 ILE MD 1 64 ILE MD . . 3.950 2.475 2.119 2.960 . 0 0 "[ . 1 . 2]" 1
687 1 55 ILE MG 1 56 ILE MD . . 4.640 4.181 3.681 4.662 0.022 3 0 "[ . 1 . 2]" 1
688 1 56 ILE HB 1 56 ILE MD . . 3.470 2.019 1.963 2.212 . 0 0 "[ . 1 . 2]" 1
689 1 56 ILE MD 1 75 ASN HB2 . . 4.540 3.917 3.670 4.474 . 0 0 "[ . 1 . 2]" 1
690 1 56 ILE MD 1 75 ASN HB3 . . 4.540 3.649 3.541 3.737 . 0 0 "[ . 1 . 2]" 1
691 1 56 ILE MD 1 72 PHE HB2 . . 5.500 5.070 3.930 5.516 0.016 7 0 "[ . 1 . 2]" 1
692 1 53 PHE HA 1 56 ILE MD . . 4.240 2.208 1.925 2.666 . 0 0 "[ . 1 . 2]" 1
693 1 56 ILE HA 1 56 ILE MD . . 4.190 3.789 3.614 3.923 . 0 0 "[ . 1 . 2]" 1
694 1 56 ILE MD 1 72 PHE HA . . 5.090 4.169 2.993 4.919 . 0 0 "[ . 1 . 2]" 1
695 1 52 ALA HA 1 56 ILE MD . . 4.720 4.519 3.972 4.740 0.020 2 0 "[ . 1 . 2]" 1
696 1 56 ILE MD 1 76 PHE QE . . 4.700 4.707 4.696 4.719 0.019 14 0 "[ . 1 . 2]" 1
697 1 56 ILE MD 1 76 PHE HZ . . 5.030 4.878 4.641 5.044 0.014 12 0 "[ . 1 . 2]" 1
698 1 56 ILE MD 1 72 PHE QD . . 3.630 3.080 1.972 3.634 0.004 7 0 "[ . 1 . 2]" 1
699 1 56 ILE H 1 56 ILE MD . . 3.440 2.301 1.872 3.011 . 0 0 "[ . 1 . 2]" 1
700 1 56 ILE MD 1 108 PHE HZ . . 3.530 2.723 2.086 3.388 . 0 0 "[ . 1 . 2]" 1
701 1 56 ILE MD 1 108 PHE QE . . 3.930 2.769 2.322 3.535 . 0 0 "[ . 1 . 2]" 1
702 1 50 LYS HG2 1 105 ILE MD . . 4.100 2.063 1.839 3.336 . 0 0 "[ . 1 . 2]" 1
703 1 50 LYS QD 1 105 ILE MD . . 4.140 3.561 2.682 3.906 . 0 0 "[ . 1 . 2]" 1
704 1 50 LYS HG3 1 105 ILE MD . . 4.100 2.008 1.896 2.462 . 0 0 "[ . 1 . 2]" 1
705 1 50 LYS HB3 1 105 ILE MD . . 4.050 3.464 3.241 3.849 . 0 0 "[ . 1 . 2]" 1
706 1 105 ILE HA 1 105 ILE MD . . 3.540 2.429 2.114 2.826 . 0 0 "[ . 1 . 2]" 1
707 1 50 LYS HA 1 105 ILE MD . . 3.670 2.053 1.962 2.400 . 0 0 "[ . 1 . 2]" 1
708 1 53 PHE QD 1 105 ILE MD . . 4.670 3.938 3.293 4.438 . 0 0 "[ . 1 . 2]" 1
709 1 53 PHE QE 1 105 ILE MD . . 5.500 5.126 4.634 5.504 0.004 3 0 "[ . 1 . 2]" 1
710 1 105 ILE MD 1 108 PHE QD . . 4.580 2.527 1.977 3.088 . 0 0 "[ . 1 . 2]" 1
711 1 105 ILE MD 1 108 PHE QE . . 4.950 3.971 3.492 4.342 . 0 0 "[ . 1 . 2]" 1
712 1 53 PHE H 1 105 ILE MD . . 4.820 4.336 3.905 4.781 . 0 0 "[ . 1 . 2]" 1
713 1 105 ILE H 1 105 ILE MD . . 5.080 4.201 4.143 4.286 . 0 0 "[ . 1 . 2]" 1
714 1 105 ILE MG 1 109 ALA MB . . 4.230 3.580 3.325 3.899 . 0 0 "[ . 1 . 2]" 1
715 1 50 LYS QD 1 105 ILE MG . . 4.530 4.078 3.746 4.505 . 0 0 "[ . 1 . 2]" 1
716 1 50 LYS HB3 1 105 ILE MG . . 5.080 4.260 3.746 4.830 . 0 0 "[ . 1 . 2]" 1
717 1 105 ILE MG 1 106 ASP HB2 . . 4.360 4.325 4.174 4.457 0.097 9 0 "[ . 1 . 2]" 1
718 1 105 ILE MG 1 106 ASP HB3 . . 4.360 3.891 3.387 4.242 . 0 0 "[ . 1 . 2]" 1
719 1 53 PHE HB3 1 105 ILE MG . . 5.500 5.251 5.020 5.472 . 0 0 "[ . 1 . 2]" 1
720 1 105 ILE HA 1 105 ILE MG . . 3.560 3.164 3.138 3.182 . 0 0 "[ . 1 . 2]" 1
721 1 105 ILE MG 1 108 PHE QB . . 4.910 4.557 4.271 4.739 . 0 0 "[ . 1 . 2]" 1
722 1 50 LYS HA 1 105 ILE MG . . 4.700 4.284 4.031 4.661 . 0 0 "[ . 1 . 2]" 1
723 1 105 ILE MG 1 106 ASP HA . . 4.150 2.903 2.760 3.056 . 0 0 "[ . 1 . 2]" 1
724 1 53 PHE QD 1 105 ILE MG . . 5.230 4.923 4.547 5.133 . 0 0 "[ . 1 . 2]" 1
725 1 53 PHE QE 1 105 ILE MG . . 5.300 5.127 4.814 5.276 . 0 0 "[ . 1 . 2]" 1
726 1 105 ILE H 1 105 ILE MG . . 3.040 2.441 2.331 2.567 . 0 0 "[ . 1 . 2]" 1
727 1 69 LEU MD2 1 111 MET ME . . 4.020 3.479 3.004 3.975 . 0 0 "[ . 1 . 2]" 1
728 1 111 MET ME 1 112 ILE MG . . 4.470 4.058 3.829 4.261 . 0 0 "[ . 1 . 2]" 1
729 1 103 ILE MD 1 111 MET ME . . 3.420 2.989 2.431 3.219 . 0 0 "[ . 1 . 2]" 1
730 1 103 ILE MG 1 111 MET ME . . 4.080 3.879 3.523 4.088 0.008 11 0 "[ . 1 . 2]" 1
731 1 94 ALA MB 1 111 MET ME . . 2.880 2.309 1.956 2.883 0.003 1 0 "[ . 1 . 2]" 1
732 1 111 MET HB2 1 111 MET ME . . 3.270 2.051 1.900 2.263 . 0 0 "[ . 1 . 2]" 1
733 1 111 MET HB3 1 111 MET ME . . 3.220 2.085 1.970 2.360 . 0 0 "[ . 1 . 2]" 1
734 1 111 MET ME 1 111 MET HG2 . . 3.460 3.353 3.335 3.384 . 0 0 "[ . 1 . 2]" 1
735 1 111 MET ME 1 111 MET HG3 . . 3.460 2.682 2.490 2.778 . 0 0 "[ . 1 . 2]" 1
736 1 95 GLY HA3 1 111 MET ME . . 3.460 2.599 2.062 3.129 . 0 0 "[ . 1 . 2]" 1
737 1 108 PHE HA 1 111 MET ME . . 4.250 4.008 3.774 4.127 . 0 0 "[ . 1 . 2]" 1
738 1 91 PHE HA 1 111 MET ME . . 3.470 3.280 2.939 3.473 0.003 3 0 "[ . 1 . 2]" 1
739 1 95 GLY HA2 1 111 MET ME . . 3.670 3.081 2.404 3.672 0.002 7 0 "[ . 1 . 2]" 1
740 1 91 PHE QE 1 111 MET ME . . 3.740 1.861 1.772 1.936 . 0 0 "[ . 1 . 2]" 1
741 1 91 PHE QD 1 111 MET ME . . 3.440 2.100 1.917 2.561 . 0 0 "[ . 1 . 2]" 1
742 1 108 PHE QD 1 111 MET ME . . 4.200 4.136 3.907 4.202 0.002 1 0 "[ . 1 . 2]" 1
743 1 36 PHE QE 1 111 MET ME . . 3.510 2.556 1.977 3.412 . 0 0 "[ . 1 . 2]" 1
744 1 95 GLY H 1 111 MET ME . . 3.590 2.637 2.198 3.223 . 0 0 "[ . 1 . 2]" 1
745 1 6 MET ME 1 6 MET HG3 . . 3.550 2.575 2.101 3.344 . 0 0 "[ . 1 . 2]" 1
746 1 109 ALA MB 1 110 ALA H . . 3.320 3.221 3.111 3.303 . 0 0 "[ . 1 . 2]" 1
747 1 55 ILE MD 1 55 ILE MG . . 3.250 1.971 1.845 2.344 . 0 0 "[ . 1 . 2]" 1
748 1 7 ALA MB 1 55 ILE MG . . 3.560 1.814 1.703 1.926 . 0 0 "[ . 1 . 2]" 1
749 1 55 ILE MG 1 75 ASN HB2 . . 3.950 2.248 1.799 2.849 . 0 0 "[ . 1 . 2]" 1
750 1 55 ILE MG 1 75 ASN HB3 . . 3.950 3.403 2.256 3.963 0.013 13 0 "[ . 1 . 2]" 1
751 1 52 ALA HA 1 55 ILE MG . . 4.450 4.179 3.921 4.445 . 0 0 "[ . 1 . 2]" 1
752 1 8 PHE QE 1 55 ILE MG . . 4.060 2.291 2.021 2.660 . 0 0 "[ . 1 . 2]" 1
753 1 8 PHE QD 1 55 ILE MG . . 3.990 1.959 1.800 2.264 . 0 0 "[ . 1 . 2]" 1
754 1 55 ILE MG 1 56 ILE H . . 3.860 3.451 3.259 3.672 . 0 0 "[ . 1 . 2]" 1
755 1 112 ILE MD 1 112 ILE MG . . 3.170 1.985 1.855 2.109 . 0 0 "[ . 1 . 2]" 1
756 1 41 LEU HB3 1 112 ILE MG . . 3.770 2.670 1.997 3.083 . 0 0 "[ . 1 . 2]" 1
757 1 41 LEU HB2 1 112 ILE MG . . 3.980 3.611 3.003 3.985 0.005 10 0 "[ . 1 . 2]" 1
758 1 36 PHE HB3 1 112 ILE MG . . 4.290 2.042 1.933 2.340 . 0 0 "[ . 1 . 2]" 1
759 1 42 SER HB2 1 112 ILE MG . . 4.790 3.796 3.110 4.776 . 0 0 "[ . 1 . 2]" 1
760 1 112 ILE H 1 112 ILE MG . . 3.930 3.009 2.298 3.367 . 0 0 "[ . 1 . 2]" 1
761 1 36 PHE QD 1 112 ILE MG . . 4.030 2.418 2.242 2.720 . 0 0 "[ . 1 . 2]" 1
762 1 78 ALA MB 1 79 GLY HA2 . . 4.540 4.411 4.309 4.509 . 0 0 "[ . 1 . 2]" 1
763 1 78 ALA MB 1 79 GLY HA3 . . 4.540 4.422 4.354 4.486 . 0 0 "[ . 1 . 2]" 1
764 1 78 ALA H 1 78 ALA MB . . 3.410 2.160 2.057 2.305 . 0 0 "[ . 1 . 2]" 1
765 1 103 ILE MG 1 107 GLU HB2 . . 3.250 2.836 2.422 3.096 . 0 0 "[ . 1 . 2]" 1
766 1 103 ILE MG 1 107 GLU HB3 . . 3.240 2.752 2.140 3.167 . 0 0 "[ . 1 . 2]" 1
767 1 103 ILE MG 1 108 PHE QB . . 3.290 2.090 1.825 2.538 . 0 0 "[ . 1 . 2]" 1
768 1 103 ILE MG 1 108 PHE HA . . 3.480 2.684 2.490 2.864 . 0 0 "[ . 1 . 2]" 1
769 1 96 ASP HA 1 103 ILE MG . . 4.560 4.223 3.986 4.568 0.008 14 0 "[ . 1 . 2]" 1
770 1 53 PHE QD 1 103 ILE MG . . 4.630 3.966 3.644 4.267 . 0 0 "[ . 1 . 2]" 1
771 1 53 PHE QE 1 103 ILE MG . . 3.960 3.171 2.703 3.770 . 0 0 "[ . 1 . 2]" 1
772 1 103 ILE MG 1 108 PHE QD . . 3.780 3.086 2.716 3.582 . 0 0 "[ . 1 . 2]" 1
773 1 103 ILE MG 1 105 ILE H . . 5.340 5.159 4.999 5.263 . 0 0 "[ . 1 . 2]" 1
774 1 103 ILE MG 1 108 PHE H . . 3.770 2.857 2.646 3.142 . 0 0 "[ . 1 . 2]" 1
775 1 103 ILE MG 1 104 GLY H . . 4.020 3.242 2.830 3.362 . 0 0 "[ . 1 . 2]" 1
776 1 64 ILE H 1 103 ILE MG . . 4.880 4.035 3.649 4.460 . 0 0 "[ . 1 . 2]" 1
777 1 90 ALA MB 1 91 PHE H . . 3.120 2.810 2.442 3.127 0.007 16 0 "[ . 1 . 2]" 1
778 1 110 ALA MB 1 112 ILE H . . 4.270 4.111 4.075 4.301 0.031 10 0 "[ . 1 . 2]" 1
779 1 110 ALA MB 1 111 MET H . . 3.000 2.417 2.294 2.504 . 0 0 "[ . 1 . 2]" 1
780 1 20 ALA H 1 38 ALA MB . . 4.130 3.947 2.661 4.139 0.009 3 0 "[ . 1 . 2]" 1
781 1 53 PHE QD 1 54 ALA MB . . 4.170 3.366 2.995 3.854 . 0 0 "[ . 1 . 2]" 1
782 1 54 ALA MB 1 55 ILE H . . 3.510 3.141 2.526 3.344 . 0 0 "[ . 1 . 2]" 1
783 1 86 ALA MB 1 87 GLU H . . 3.520 2.360 2.040 2.675 . 0 0 "[ . 1 . 2]" 1
784 1 86 ALA H 1 86 ALA MB . . 2.980 2.185 2.010 2.238 . 0 0 "[ . 1 . 2]" 1
785 1 86 ALA MB 1 88 THR H . . 4.670 4.460 4.028 4.672 0.002 9 0 "[ . 1 . 2]" 1
786 1 56 ILE MG 1 69 LEU MD2 . . 4.890 4.662 4.199 4.892 0.002 4 0 "[ . 1 . 2]" 1
787 1 56 ILE MG 1 68 GLU HB3 . . 4.070 3.560 2.579 4.061 . 0 0 "[ . 1 . 2]" 1
788 1 56 ILE MG 1 72 PHE HB2 . . 4.400 3.888 3.472 4.123 . 0 0 "[ . 1 . 2]" 1
789 1 56 ILE MG 1 72 PHE QD . . 3.530 3.330 2.924 3.536 0.006 6 0 "[ . 1 . 2]" 1
790 1 56 ILE H 1 56 ILE MG . . 3.760 3.703 3.686 3.723 . 0 0 "[ . 1 . 2]" 1
791 1 64 ILE MG 1 69 LEU MD2 . . 3.280 2.075 1.749 2.484 . 0 0 "[ . 1 . 2]" 1
792 1 64 ILE HG12 1 64 ILE MG . . 3.630 2.425 2.295 2.547 . 0 0 "[ . 1 . 2]" 1
793 1 56 ILE MG 1 64 ILE MG . . 3.270 3.175 2.663 3.291 0.021 17 0 "[ . 1 . 2]" 1
794 1 64 ILE HG13 1 64 ILE MG . . 3.630 3.225 3.213 3.238 . 0 0 "[ . 1 . 2]" 1
795 1 64 ILE MG 1 69 LEU HB2 . . 4.440 3.842 3.677 4.176 . 0 0 "[ . 1 . 2]" 1
796 1 64 ILE MG 1 69 LEU HG . . 3.330 2.196 1.956 2.583 . 0 0 "[ . 1 . 2]" 1
797 1 64 ILE MG 1 68 GLU HB3 . . 3.320 2.499 1.786 3.077 . 0 0 "[ . 1 . 2]" 1
798 1 64 ILE MG 1 68 GLU HB2 . . 3.290 2.240 1.975 2.918 . 0 0 "[ . 1 . 2]" 1
799 1 64 ILE MG 1 66 GLU HA . . 4.620 4.430 4.220 4.602 . 0 0 "[ . 1 . 2]" 1
800 1 64 ILE MG 1 69 LEU HA . . 3.930 2.594 2.276 2.915 . 0 0 "[ . 1 . 2]" 1
801 1 64 ILE MG 1 65 GLU HA . . 4.380 4.320 4.087 4.385 0.005 4 0 "[ . 1 . 2]" 1
802 1 64 ILE HA 1 64 ILE MG . . 3.360 2.533 2.415 2.627 . 0 0 "[ . 1 . 2]" 1
803 1 64 ILE MG 1 68 GLU H . . 4.080 3.658 3.351 4.000 . 0 0 "[ . 1 . 2]" 1
804 1 64 ILE MG 1 65 GLU H . . 3.670 3.564 3.136 3.675 0.005 12 0 "[ . 1 . 2]" 1
805 1 64 ILE MG 1 69 LEU H . . 3.760 2.889 2.573 3.215 . 0 0 "[ . 1 . 2]" 1
806 1 41 LEU MD2 1 52 ALA MB . . 3.320 2.139 1.841 2.358 . 0 0 "[ . 1 . 2]" 1
807 1 52 ALA MB 1 56 ILE MD . . 4.330 3.560 3.137 3.989 . 0 0 "[ . 1 . 2]" 1
808 1 41 LEU MD1 1 52 ALA MB . . 3.550 2.864 2.588 3.219 . 0 0 "[ . 1 . 2]" 1
809 1 49 VAL HB 1 52 ALA MB . . 5.500 4.706 4.536 4.856 . 0 0 "[ . 1 . 2]" 1
810 1 8 PHE QE 1 52 ALA MB . . 3.750 2.064 1.803 2.627 . 0 0 "[ . 1 . 2]" 1
811 1 8 PHE HZ 1 52 ALA MB . . 3.870 2.178 1.964 2.795 . 0 0 "[ . 1 . 2]" 1
812 1 52 ALA MB 1 108 PHE HZ . . 4.190 2.945 2.283 3.455 . 0 0 "[ . 1 . 2]" 1
813 1 52 ALA MB 1 108 PHE QE . . 3.900 2.716 2.126 3.105 . 0 0 "[ . 1 . 2]" 1
814 1 20 ALA MB 1 38 ALA MB . . 3.160 2.251 1.845 2.549 . 0 0 "[ . 1 . 2]" 1
815 1 17 VAL HB 1 20 ALA MB . . 5.010 3.483 3.116 3.926 . 0 0 "[ . 1 . 2]" 1
816 1 20 ALA MB 1 35 PHE HB3 . . 5.050 4.419 3.862 5.021 . 0 0 "[ . 1 . 2]" 1
817 1 20 ALA MB 1 35 PHE HZ . . 4.740 3.222 2.535 4.003 . 0 0 "[ . 1 . 2]" 1
818 1 20 ALA MB 1 35 PHE QE . . 4.120 2.785 2.178 3.663 . 0 0 "[ . 1 . 2]" 1
819 1 20 ALA MB 1 35 PHE QD . . 4.180 2.932 2.463 3.686 . 0 0 "[ . 1 . 2]" 1
820 1 20 ALA MB 1 39 CYS H . . 3.610 3.237 2.862 3.579 . 0 0 "[ . 1 . 2]" 1
821 1 6 MET HB2 1 9 ALA MB . . 4.280 3.138 1.954 4.276 . 0 0 "[ . 1 . 2]" 1
822 1 6 MET ME 1 9 ALA MB . . 4.860 3.683 2.005 4.759 . 0 0 "[ . 1 . 2]" 1
823 1 6 MET HB3 1 9 ALA MB . . 4.280 2.860 1.950 4.267 . 0 0 "[ . 1 . 2]" 1
824 1 26 ALA MB 1 29 SER HB2 . . 3.840 2.751 2.008 3.609 . 0 0 "[ . 1 . 2]" 1
825 1 26 ALA MB 1 29 SER HB3 . . 3.840 2.351 1.847 3.615 . 0 0 "[ . 1 . 2]" 1
826 1 26 ALA MB 1 27 ALA H . . 5.040 3.134 1.996 3.614 . 0 0 "[ . 1 . 2]" 1
827 1 71 LEU MD2 1 82 ALA MB . . 3.320 2.208 1.723 2.731 . 0 0 "[ . 1 . 2]" 1
828 1 70 LYS QB 1 82 ALA MB . . 3.950 2.871 2.150 3.706 . 0 0 "[ . 1 . 2]" 1
829 1 70 LYS QE 1 82 ALA MB . . 4.210 3.495 2.061 4.206 . 0 0 "[ . 1 . 2]" 1
830 1 74 GLN HE22 1 82 ALA MB . . 4.780 3.814 2.680 4.716 . 0 0 "[ . 1 . 2]" 1
831 1 91 PHE QD 1 94 ALA MB . . 4.590 2.803 2.536 3.100 . 0 0 "[ . 1 . 2]" 1
832 1 94 ALA MB 1 95 GLY H . . 2.860 2.550 2.213 2.858 . 0 0 "[ . 1 . 2]" 1
833 1 7 ALA MB 1 8 PHE QD . . 4.690 3.940 3.739 4.284 . 0 0 "[ . 1 . 2]" 1
834 1 7 ALA MB 1 8 PHE H . . 4.250 2.623 2.156 3.170 . 0 0 "[ . 1 . 2]" 1
835 1 73 LEU MD2 1 80 ALA MB . . 4.490 3.706 3.571 3.996 . 0 0 "[ . 1 . 2]" 1
836 1 73 LEU MD1 1 80 ALA MB . . 3.630 3.216 2.902 3.385 . 0 0 "[ . 1 . 2]" 1
837 1 77 LYS HB2 1 80 ALA MB . . 3.570 3.335 3.024 3.576 0.006 18 0 "[ . 1 . 2]" 1
838 1 77 LYS HB3 1 80 ALA MB . . 3.570 2.167 1.956 2.474 . 0 0 "[ . 1 . 2]" 1
839 1 74 GLN HG3 1 80 ALA MB . . 4.050 3.313 2.422 4.009 . 0 0 "[ . 1 . 2]" 1
840 1 74 GLN HG2 1 80 ALA MB . . 4.160 3.126 2.433 3.956 . 0 0 "[ . 1 . 2]" 1
841 1 76 PHE HB3 1 80 ALA MB . . 5.500 5.455 5.245 5.517 0.017 6 0 "[ . 1 . 2]" 1
842 1 76 PHE HB2 1 80 ALA MB . . 5.230 4.236 4.006 4.388 . 0 0 "[ . 1 . 2]" 1
843 1 73 LEU HA 1 80 ALA MB . . 4.510 3.557 3.444 3.656 . 0 0 "[ . 1 . 2]" 1
844 1 74 GLN HE21 1 80 ALA MB . . 5.500 4.530 4.082 4.958 . 0 0 "[ . 1 . 2]" 1
845 1 71 LEU MD2 1 74 GLN HG3 . . 4.220 2.991 1.979 3.906 . 0 0 "[ . 1 . 2]" 1
846 1 71 LEU MD2 1 74 GLN HG2 . . 4.810 4.051 3.397 4.706 . 0 0 "[ . 1 . 2]" 1
847 1 70 LYS QE 1 71 LEU MD2 . . 4.510 4.273 3.511 4.513 0.003 11 0 "[ . 1 . 2]" 1
848 1 68 GLU HA 1 71 LEU MD2 . . 4.650 4.126 3.578 4.644 . 0 0 "[ . 1 . 2]" 1
849 1 71 LEU MD2 1 82 ALA HA . . 3.840 3.373 2.939 3.716 . 0 0 "[ . 1 . 2]" 1
850 1 71 LEU HA 1 71 LEU MD2 . . 3.200 2.017 1.929 2.222 . 0 0 "[ . 1 . 2]" 1
851 1 71 LEU MD2 1 74 GLN HE22 . . 4.090 2.409 1.859 2.961 . 0 0 "[ . 1 . 2]" 1
852 1 71 LEU H 1 71 LEU MD2 . . 4.080 3.276 2.803 3.741 . 0 0 "[ . 1 . 2]" 1
853 1 11 VAL MG2 1 55 ILE MD . . 4.180 2.414 1.712 3.100 . 0 0 "[ . 1 . 2]" 1
854 1 11 VAL MG2 1 52 ALA MB . . 3.900 3.854 3.676 3.906 0.006 2 0 "[ . 1 . 2]" 1
855 1 8 PHE HB2 1 11 VAL MG2 . . 4.910 4.870 4.733 4.914 0.004 2 0 "[ . 1 . 2]" 1
856 1 10 SER HB3 1 11 VAL MG2 . . 4.480 3.583 2.943 4.481 0.001 14 0 "[ . 1 . 2]" 1
857 1 11 VAL HA 1 11 VAL MG2 . . 3.240 2.425 2.300 2.516 . 0 0 "[ . 1 . 2]" 1
858 1 8 PHE QD 1 11 VAL MG2 . . 4.240 3.307 2.896 3.580 . 0 0 "[ . 1 . 2]" 1
859 1 11 VAL MG2 1 12 LEU H . . 4.070 3.556 3.437 3.731 . 0 0 "[ . 1 . 2]" 1
860 1 11 VAL MG1 1 12 LEU QB . . 4.490 4.115 3.767 4.402 . 0 0 "[ . 1 . 2]" 1
861 1 11 VAL MG1 1 12 LEU HG . . 3.300 2.361 1.967 2.703 . 0 0 "[ . 1 . 2]" 1
862 1 11 VAL HA 1 11 VAL MG1 . . 3.370 2.302 2.145 2.455 . 0 0 "[ . 1 . 2]" 1
863 1 8 PHE QE 1 11 VAL MG1 . . 4.810 3.158 2.521 3.915 . 0 0 "[ . 1 . 2]" 1
864 1 8 PHE QD 1 11 VAL MG1 . . 4.240 2.983 2.359 3.565 . 0 0 "[ . 1 . 2]" 1
865 1 11 VAL H 1 11 VAL MG1 . . 4.710 3.700 3.680 3.835 . 0 0 "[ . 1 . 2]" 1
866 1 11 VAL MG1 1 12 LEU H . . 4.310 3.343 3.123 3.475 . 0 0 "[ . 1 . 2]" 1
867 1 12 LEU QB 1 12 LEU MD2 . . 3.190 2.141 2.046 2.242 . 0 0 "[ . 1 . 2]" 1
868 1 12 LEU MD2 1 44 LYS HE2 . . 3.600 2.543 1.799 3.594 . 0 0 "[ . 1 . 2]" 1
869 1 12 LEU MD2 1 41 LEU HA . . 4.150 3.739 2.816 4.149 . 0 0 "[ . 1 . 2]" 1
870 1 12 LEU HA 1 12 LEU MD2 . . 3.090 2.459 2.210 2.647 . 0 0 "[ . 1 . 2]" 1
871 1 8 PHE QE 1 12 LEU MD2 . . 5.500 4.523 3.752 5.185 . 0 0 "[ . 1 . 2]" 1
872 1 8 PHE QD 1 12 LEU MD2 . . 5.250 4.191 3.700 4.671 . 0 0 "[ . 1 . 2]" 1
873 1 12 LEU H 1 12 LEU MD2 . . 4.260 3.905 3.433 4.197 . 0 0 "[ . 1 . 2]" 1
874 1 49 VAL MG1 1 112 ILE MG . . 4.280 3.867 3.444 4.236 . 0 0 "[ . 1 . 2]" 1
875 1 49 VAL MG1 1 109 ALA MB . . 3.240 1.789 1.691 1.877 . 0 0 "[ . 1 . 2]" 1
876 1 49 VAL MG1 1 52 ALA MB . . 3.770 3.318 3.124 3.556 . 0 0 "[ . 1 . 2]" 1
877 1 49 VAL MG1 1 53 PHE HB2 . . 4.470 3.671 3.414 4.001 . 0 0 "[ . 1 . 2]" 1
878 1 49 VAL HA 1 49 VAL MG1 . . 3.340 2.454 2.343 2.553 . 0 0 "[ . 1 . 2]" 1
879 1 49 VAL MG1 1 50 LYS HA . . 4.260 3.389 3.231 3.620 . 0 0 "[ . 1 . 2]" 1
880 1 49 VAL MG1 1 108 PHE QD . . 3.480 2.676 1.944 3.146 . 0 0 "[ . 1 . 2]" 1
881 1 49 VAL MG1 1 108 PHE QE . . 3.660 2.516 2.008 3.088 . 0 0 "[ . 1 . 2]" 1
882 1 49 VAL H 1 49 VAL MG1 . . 4.040 3.703 3.688 3.711 . 0 0 "[ . 1 . 2]" 1
883 1 46 THR MG 1 113 LYS QD . . 3.770 3.661 3.324 3.776 0.006 11 0 "[ . 1 . 2]" 1
884 1 46 THR MG 1 49 VAL HB . . 4.090 3.378 2.936 3.956 . 0 0 "[ . 1 . 2]" 1
885 1 46 THR MG 1 50 LYS HE2 . . 3.610 2.528 1.932 3.457 . 0 0 "[ . 1 . 2]" 1
886 1 46 THR MG 1 50 LYS HE3 . . 3.610 2.736 1.839 3.612 0.002 9 0 "[ . 1 . 2]" 1
887 1 46 THR HA 1 46 THR MG . . 3.280 2.577 2.306 3.103 . 0 0 "[ . 1 . 2]" 1
888 1 46 THR MG 1 50 LYS H . . 4.410 4.201 3.743 4.416 0.006 18 0 "[ . 1 . 2]" 1
889 1 46 THR MG 1 47 ASP H . . 4.130 3.737 2.624 4.073 . 0 0 "[ . 1 . 2]" 1
890 1 73 LEU MD1 1 83 LEU MD1 . . 3.320 2.091 1.848 2.395 . 0 0 "[ . 1 . 2]" 1
891 1 83 LEU HB3 1 83 LEU MD1 . . 3.480 2.616 2.508 3.170 . 0 0 "[ . 1 . 2]" 1
892 1 83 LEU MD1 1 87 GLU HB2 . . 4.110 3.411 2.786 4.005 . 0 0 "[ . 1 . 2]" 1
893 1 83 LEU MD1 1 87 GLU HE2 . . 4.610 2.587 1.963 3.877 . 0 0 "[ . 1 . 2]" 1
894 1 83 LEU MD1 1 87 GLU HB3 . . 4.110 2.946 2.189 3.653 . 0 0 "[ . 1 . 2]" 1
895 1 30 PHE HB2 1 83 LEU MD1 . . 3.900 2.571 1.980 3.216 . 0 0 "[ . 1 . 2]" 1
896 1 30 PHE HB3 1 83 LEU MD1 . . 3.900 2.806 2.100 3.632 . 0 0 "[ . 1 . 2]" 1
897 1 83 LEU MD1 1 88 THR HA . . 5.500 5.385 5.004 5.505 0.005 6 0 "[ . 1 . 2]" 1
898 1 70 LYS HA 1 83 LEU MD1 . . 4.530 4.482 4.057 4.550 0.020 4 0 "[ . 1 . 2]" 1
899 1 83 LEU HA 1 83 LEU MD1 . . 3.270 1.919 1.870 1.983 . 0 0 "[ . 1 . 2]" 1
900 1 81 ARG HH11 1 83 LEU MD1 . . 4.300 3.109 2.327 3.926 . 0 0 "[ . 1 . 2]" 1
901 1 81 ARG QH2 1 83 LEU MD1 . . 4.350 3.017 1.995 3.733 . 0 0 "[ . 1 . 2]" 1
902 1 83 LEU MD1 1 91 PHE QD . . 5.330 5.043 4.397 5.349 0.019 4 0 "[ . 1 . 2]" 1
903 1 30 PHE QD 1 83 LEU MD1 . . 4.180 2.405 1.947 2.784 . 0 0 "[ . 1 . 2]" 1
904 1 30 PHE H 1 83 LEU MD1 . . 5.000 4.329 3.825 5.001 0.001 14 0 "[ . 1 . 2]" 1
905 1 69 LEU MD2 1 103 ILE HB . . 4.290 2.731 2.409 3.051 . 0 0 "[ . 1 . 2]" 1
906 1 69 LEU MD2 1 72 PHE HB2 . . 4.640 3.422 3.112 3.677 . 0 0 "[ . 1 . 2]" 1
907 1 69 LEU MD2 1 91 PHE HB3 . . 4.060 3.415 2.960 3.832 . 0 0 "[ . 1 . 2]" 1
908 1 69 LEU MD2 1 92 LEU HA . . 4.300 3.126 2.746 3.603 . 0 0 "[ . 1 . 2]" 1
909 1 69 LEU MD2 1 91 PHE HA . . 5.140 4.751 4.451 4.982 . 0 0 "[ . 1 . 2]" 1
910 1 69 LEU MD2 1 91 PHE HZ . . 4.790 4.135 3.435 4.637 . 0 0 "[ . 1 . 2]" 1
911 1 69 LEU MD2 1 91 PHE QE . . 4.750 3.107 2.251 3.930 . 0 0 "[ . 1 . 2]" 1
912 1 69 LEU MD2 1 91 PHE QD . . 4.380 2.872 2.223 3.545 . 0 0 "[ . 1 . 2]" 1
913 1 69 LEU MD2 1 72 PHE QD . . 4.390 4.248 3.825 4.394 0.004 17 0 "[ . 1 . 2]" 1
914 1 69 LEU H 1 69 LEU MD2 . . 4.740 3.804 3.569 3.975 . 0 0 "[ . 1 . 2]" 1
915 1 69 LEU MD2 1 70 LYS H . . 4.740 4.605 4.427 4.738 . 0 0 "[ . 1 . 2]" 1
916 1 69 LEU MD2 1 96 ASP H . . 5.500 4.777 4.569 5.121 . 0 0 "[ . 1 . 2]" 1
917 1 69 LEU MD2 1 88 THR MG . . 4.380 3.821 3.519 4.195 . 0 0 "[ . 1 . 2]" 1
918 1 69 LEU MD1 1 88 THR MG . . 3.970 2.811 2.306 3.163 . 0 0 "[ . 1 . 2]" 1
919 1 88 THR MG 1 92 LEU MD2 . . 4.200 3.872 3.240 4.205 0.005 6 0 "[ . 1 . 2]" 1
920 1 70 LYS QB 1 88 THR MG . . 3.100 2.202 1.908 2.753 . 0 0 "[ . 1 . 2]" 1
921 1 66 GLU HG2 1 88 THR MG . . 3.560 2.527 1.797 3.527 . 0 0 "[ . 1 . 2]" 1
922 1 66 GLU HG3 1 88 THR MG . . 3.560 2.760 2.192 3.540 . 0 0 "[ . 1 . 2]" 1
923 1 72 PHE HB2 1 88 THR MG . . 5.500 5.383 5.186 5.502 0.002 7 0 "[ . 1 . 2]" 1
924 1 70 LYS QE 1 88 THR MG . . 4.480 3.497 2.684 4.482 0.002 8 0 "[ . 1 . 2]" 1
925 1 88 THR HA 1 88 THR MG . . 3.180 2.456 2.383 2.547 . 0 0 "[ . 1 . 2]" 1
926 1 88 THR MG 1 89 LYS HA . . 4.150 3.827 3.671 4.048 . 0 0 "[ . 1 . 2]" 1
927 1 70 LYS HA 1 88 THR MG . . 3.550 2.868 2.262 3.176 . 0 0 "[ . 1 . 2]" 1
928 1 70 LYS H 1 88 THR MG . . 3.780 2.265 1.970 2.921 . 0 0 "[ . 1 . 2]" 1
929 1 12 LEU QB 1 17 VAL MG2 . . 4.020 3.810 3.282 3.979 . 0 0 "[ . 1 . 2]" 1
930 1 17 VAL MG2 1 21 LEU HG . . 4.100 4.021 3.842 4.101 0.001 2 0 "[ . 1 . 2]" 1
931 1 17 VAL MG2 1 76 PHE HB3 . . 3.310 2.809 2.441 2.997 . 0 0 "[ . 1 . 2]" 1
932 1 17 VAL HA 1 17 VAL MG2 . . 3.290 3.208 3.195 3.218 . 0 0 "[ . 1 . 2]" 1
933 1 17 VAL MG2 1 18 THR HA . . 4.240 3.059 2.885 3.287 . 0 0 "[ . 1 . 2]" 1
934 1 17 VAL MG2 1 35 PHE HZ . . 5.260 4.960 4.558 5.263 0.003 16 0 "[ . 1 . 2]" 1
935 1 17 VAL MG2 1 76 PHE QE . . 4.910 4.306 3.694 4.875 . 0 0 "[ . 1 . 2]" 1
936 1 17 VAL MG2 1 35 PHE QE . . 5.500 4.868 4.469 5.409 . 0 0 "[ . 1 . 2]" 1
937 1 17 VAL MG2 1 76 PHE QD . . 3.650 2.946 2.252 3.583 . 0 0 "[ . 1 . 2]" 1
938 1 17 VAL MG2 1 21 LEU H . . 4.920 4.629 4.456 4.916 . 0 0 "[ . 1 . 2]" 1
939 1 63 PHE QD 1 102 LYS HG2 . . 5.500 5.173 3.450 5.502 0.002 1 0 "[ . 1 . 2]" 1
940 1 63 PHE QD 1 102 LYS HG3 . . 5.500 5.200 2.099 5.503 0.003 6 0 "[ . 1 . 2]" 1
941 1 92 LEU MD1 1 96 ASP HB2 . . 4.270 2.182 1.862 2.666 . 0 0 "[ . 1 . 2]" 1
942 1 92 LEU MD1 1 96 ASP HB3 . . 4.270 2.922 2.654 3.457 . 0 0 "[ . 1 . 2]" 1
943 1 92 LEU MD1 1 101 GLY HA2 . . 4.520 3.178 2.461 3.995 . 0 0 "[ . 1 . 2]" 1
944 1 92 LEU HA 1 92 LEU MD1 . . 3.320 2.072 1.966 2.264 . 0 0 "[ . 1 . 2]" 1
945 1 92 LEU MD1 1 93 LYS HA . . 4.680 4.462 4.182 4.684 0.004 16 0 "[ . 1 . 2]" 1
946 1 92 LEU MD1 1 102 LYS HA . . 4.130 3.693 2.623 4.119 . 0 0 "[ . 1 . 2]" 1
947 1 92 LEU MD1 1 93 LYS H . . 4.510 4.272 4.119 4.391 . 0 0 "[ . 1 . 2]" 1
948 1 92 LEU MD1 1 96 ASP H . . 4.670 3.449 2.867 3.984 . 0 0 "[ . 1 . 2]" 1
949 1 72 PHE HB2 1 73 LEU MD2 . . 5.230 4.977 4.053 5.231 0.001 11 0 "[ . 1 . 2]" 1
950 1 24 CYS HB2 1 73 LEU MD2 . . 4.930 3.682 2.715 4.759 . 0 0 "[ . 1 . 2]" 1
951 1 24 CYS HB3 1 73 LEU MD2 . . 4.930 4.087 2.837 4.932 0.002 2 0 "[ . 1 . 2]" 1
952 1 73 LEU HA 1 73 LEU MD2 . . 3.330 1.943 1.884 2.139 . 0 0 "[ . 1 . 2]" 1
953 1 21 LEU HA 1 73 LEU MD2 . . 4.470 3.239 2.450 3.867 . 0 0 "[ . 1 . 2]" 1
954 1 35 PHE HZ 1 73 LEU MD2 . . 4.490 3.001 2.182 3.835 . 0 0 "[ . 1 . 2]" 1
955 1 30 PHE QE 1 73 LEU MD2 . . 3.810 2.974 1.970 3.811 0.001 13 0 "[ . 1 . 2]" 1
956 1 35 PHE QE 1 73 LEU MD2 . . 3.760 1.948 1.768 2.323 . 0 0 "[ . 1 . 2]" 1
957 1 72 PHE QD 1 73 LEU MD2 . . 3.380 2.708 2.006 3.382 0.002 14 0 "[ . 1 . 2]" 1
958 1 30 PHE QD 1 73 LEU MD2 . . 4.150 3.499 2.881 4.152 0.002 18 0 "[ . 1 . 2]" 1
959 1 49 VAL MG2 1 112 ILE MG . . 3.920 3.877 3.712 3.951 0.031 18 0 "[ . 1 . 2]" 1
960 1 49 VAL MG2 1 109 ALA MB . . 3.610 3.198 2.861 3.450 . 0 0 "[ . 1 . 2]" 1
961 1 49 VAL MG2 1 52 ALA MB . . 3.950 3.756 3.534 3.953 0.003 18 0 "[ . 1 . 2]" 1
962 1 44 LYS HB3 1 49 VAL MG2 . . 3.480 3.179 2.624 3.486 0.006 9 0 "[ . 1 . 2]" 1
963 1 41 LEU HA 1 49 VAL MG2 . . 4.620 4.162 3.878 4.516 . 0 0 "[ . 1 . 2]" 1
964 1 44 LYS HA 1 49 VAL MG2 . . 5.500 4.945 4.365 5.317 . 0 0 "[ . 1 . 2]" 1
965 1 44 LYS H 1 49 VAL MG2 . . 4.990 4.357 3.730 4.809 . 0 0 "[ . 1 . 2]" 1
966 1 41 LEU MD2 1 112 ILE MD . . 3.840 3.090 2.792 3.304 . 0 0 "[ . 1 . 2]" 1
967 1 41 LEU MD2 1 112 ILE MG . . 4.050 3.774 3.460 4.046 . 0 0 "[ . 1 . 2]" 1
968 1 41 LEU HB3 1 41 LEU MD2 . . 3.340 2.222 2.075 2.377 . 0 0 "[ . 1 . 2]" 1
969 1 41 LEU HB2 1 41 LEU MD2 . . 3.220 3.188 3.152 3.220 . 0 0 "[ . 1 . 2]" 1
970 1 41 LEU MD2 1 49 VAL HA . . 3.930 2.924 2.668 3.142 . 0 0 "[ . 1 . 2]" 1
971 1 41 LEU MD2 1 108 PHE HZ . . 4.280 3.964 3.114 4.282 0.002 7 0 "[ . 1 . 2]" 1
972 1 36 PHE QD 1 41 LEU MD2 . . 4.220 3.700 3.228 4.209 . 0 0 "[ . 1 . 2]" 1
973 1 36 PHE QE 1 41 LEU MD2 . . 4.620 4.108 3.456 4.622 0.002 10 0 "[ . 1 . 2]" 1
974 1 41 LEU H 1 41 LEU MD2 . . 4.370 3.892 3.615 4.185 . 0 0 "[ . 1 . 2]" 1
975 1 113 LYS H 1 113 LYS HG2 . . 4.650 4.390 4.306 4.533 . 0 0 "[ . 1 . 2]" 1
976 1 113 LYS H 1 113 LYS HG3 . . 4.650 4.379 4.336 4.408 . 0 0 "[ . 1 . 2]" 1
977 1 41 LEU MD1 1 112 ILE MD . . 4.420 4.043 3.444 4.417 . 0 0 "[ . 1 . 2]" 1
978 1 41 LEU HB2 1 41 LEU MD1 . . 3.010 2.177 2.007 2.368 . 0 0 "[ . 1 . 2]" 1
979 1 41 LEU HA 1 41 LEU MD1 . . 3.820 3.793 3.745 3.819 . 0 0 "[ . 1 . 2]" 1
980 1 36 PHE QD 1 41 LEU MD1 . . 3.840 2.003 1.868 2.254 . 0 0 "[ . 1 . 2]" 1
981 1 21 LEU MD2 1 73 LEU MD2 . . 3.300 1.993 1.751 2.639 . 0 0 "[ . 1 . 2]" 1
982 1 21 LEU MD2 1 80 ALA MB . . 3.210 2.636 2.314 2.843 . 0 0 "[ . 1 . 2]" 1
983 1 21 LEU HB2 1 21 LEU MD2 . . 3.450 3.171 3.145 3.193 . 0 0 "[ . 1 . 2]" 1
984 1 21 LEU MD2 1 76 PHE HB2 . . 3.770 2.426 1.951 2.794 . 0 0 "[ . 1 . 2]" 1
985 1 18 THR HA 1 21 LEU MD2 . . 4.970 4.697 4.386 4.972 0.002 15 0 "[ . 1 . 2]" 1
986 1 21 LEU MD2 1 73 LEU HA . . 4.240 2.953 2.589 3.291 . 0 0 "[ . 1 . 2]" 1
987 1 21 LEU HA 1 21 LEU MD2 . . 3.150 2.418 2.260 2.564 . 0 0 "[ . 1 . 2]" 1
988 1 21 LEU MD2 1 35 PHE HZ . . 4.200 2.644 2.003 3.544 . 0 0 "[ . 1 . 2]" 1
989 1 21 LEU MD2 1 35 PHE QE . . 3.620 2.869 2.374 3.370 . 0 0 "[ . 1 . 2]" 1
990 1 21 LEU MD2 1 76 PHE QD . . 4.440 2.721 1.962 3.433 . 0 0 "[ . 1 . 2]" 1
991 1 21 LEU H 1 21 LEU MD2 . . 4.270 4.117 3.699 4.260 . 0 0 "[ . 1 . 2]" 1
992 1 60 LYS HD2 1 60 LYS QG . . 2.750 2.429 2.271 2.549 . 0 0 "[ . 1 . 2]" 1
993 1 60 LYS HD3 1 60 LYS QG . . 2.750 2.251 2.201 2.514 . 0 0 "[ . 1 . 2]" 1
994 1 33 LYS H 1 33 LYS HG3 . . 3.780 3.098 1.947 3.779 . 0 0 "[ . 1 . 2]" 1
995 1 37 LYS H 1 37 LYS HG2 . . 4.670 4.144 3.084 4.450 . 0 0 "[ . 1 . 2]" 1
996 1 37 LYS H 1 37 LYS HG3 . . 4.670 4.051 2.533 4.613 . 0 0 "[ . 1 . 2]" 1
997 1 12 LEU QB 1 17 VAL MG1 . . 2.980 1.995 1.767 2.292 . 0 0 "[ . 1 . 2]" 1
998 1 17 VAL MG1 1 39 CYS HB2 . . 3.860 3.158 2.490 3.841 . 0 0 "[ . 1 . 2]" 1
999 1 17 VAL MG1 1 39 CYS HB3 . . 3.860 2.709 1.989 3.848 . 0 0 "[ . 1 . 2]" 1
1000 1 17 VAL MG1 1 76 PHE HB3 . . 4.460 4.420 4.214 4.466 0.006 2 0 "[ . 1 . 2]" 1
1001 1 17 VAL MG1 1 39 CYS HA . . 4.140 3.641 2.163 4.140 0.000 17 0 "[ . 1 . 2]" 1
1002 1 17 VAL MG1 1 76 PHE QE . . 4.680 2.862 2.045 3.807 . 0 0 "[ . 1 . 2]" 1
1003 1 17 VAL MG1 1 76 PHE QD . . 3.700 3.039 2.474 3.555 . 0 0 "[ . 1 . 2]" 1
1004 1 17 VAL H 1 17 VAL MG1 . . 3.230 1.976 1.894 2.137 . 0 0 "[ . 1 . 2]" 1
1005 1 17 VAL MG1 1 18 THR H . . 4.540 3.838 3.669 4.021 . 0 0 "[ . 1 . 2]" 1
1006 1 13 LYS H 1 17 VAL MG1 . . 4.590 3.331 2.794 3.704 . 0 0 "[ . 1 . 2]" 1
1007 1 93 LYS QE 1 93 LYS HG2 . . 3.900 2.842 2.234 3.564 . 0 0 "[ . 1 . 2]" 1
1008 1 93 LYS QE 1 93 LYS HG3 . . 3.900 2.801 2.178 3.551 . 0 0 "[ . 1 . 2]" 1
1009 1 69 LEU MD1 1 92 LEU MD1 . . 3.540 1.702 1.615 1.793 . 0 0 "[ . 1 . 2]" 1
1010 1 69 LEU MD1 1 92 LEU MD2 . . 3.680 3.151 2.821 3.552 . 0 0 "[ . 1 . 2]" 1
1011 1 69 LEU HB2 1 69 LEU MD1 . . 3.620 2.295 2.157 2.500 . 0 0 "[ . 1 . 2]" 1
1012 1 69 LEU HB3 1 69 LEU MD1 . . 3.620 2.401 2.200 2.528 . 0 0 "[ . 1 . 2]" 1
1013 1 66 GLU HB2 1 69 LEU MD1 . . 4.990 3.648 3.187 4.142 . 0 0 "[ . 1 . 2]" 1
1014 1 69 LEU MD1 1 103 ILE HB . . 5.220 3.108 2.694 3.532 . 0 0 "[ . 1 . 2]" 1
1015 1 69 LEU MD1 1 92 LEU HA . . 3.860 1.917 1.768 1.998 . 0 0 "[ . 1 . 2]" 1
1016 1 69 LEU HA 1 69 LEU MD1 . . 4.070 3.798 3.749 3.844 . 0 0 "[ . 1 . 2]" 1
1017 1 69 LEU MD1 1 91 PHE HA . . 5.500 5.082 4.530 5.461 . 0 0 "[ . 1 . 2]" 1
1018 1 69 LEU H 1 69 LEU MD1 . . 4.380 3.699 3.508 3.903 . 0 0 "[ . 1 . 2]" 1
1019 1 41 LEU HA 1 44 LYS HG3 . . 4.050 2.304 1.996 2.772 . 0 0 "[ . 1 . 2]" 1
1020 1 13 LYS H 1 13 LYS HG2 . . 4.810 3.291 1.950 4.688 . 0 0 "[ . 1 . 2]" 1
1021 1 13 LYS H 1 13 LYS HG3 . . 4.810 3.722 2.166 4.451 . 0 0 "[ . 1 . 2]" 1
1022 1 71 LEU HB2 1 71 LEU MD1 . . 3.260 2.343 2.133 2.594 . 0 0 "[ . 1 . 2]" 1
1023 1 34 LYS QE 1 34 LYS HG3 . . 3.810 2.819 2.189 3.608 . 0 0 "[ . 1 . 2]" 1
1024 1 69 LEU HA 1 69 LEU HG . . 3.760 2.738 2.643 2.924 . 0 0 "[ . 1 . 2]" 1
1025 1 51 LYS HA 1 51 LYS HG2 . . 3.850 3.108 2.490 3.544 . 0 0 "[ . 1 . 2]" 1
1026 1 24 CYS HB2 1 73 LEU MD1 . . 5.260 3.051 2.313 4.111 . 0 0 "[ . 1 . 2]" 1
1027 1 24 CYS HB3 1 73 LEU MD1 . . 5.260 3.921 2.973 4.732 . 0 0 "[ . 1 . 2]" 1
1028 1 73 LEU MD1 1 80 ALA HA . . 4.870 4.848 4.673 4.887 0.017 4 0 "[ . 1 . 2]" 1
1029 1 30 PHE QE 1 73 LEU MD1 . . 4.980 4.121 3.035 4.982 0.002 8 0 "[ . 1 . 2]" 1
1030 1 35 PHE QD 1 73 LEU MD1 . . 4.970 4.556 3.822 4.975 0.005 12 0 "[ . 1 . 2]" 1
1031 1 30 PHE QD 1 73 LEU MD1 . . 4.860 3.539 2.762 4.316 . 0 0 "[ . 1 . 2]" 1
1032 1 66 GLU HB2 1 92 LEU MD2 . . 3.630 2.872 2.010 3.515 . 0 0 "[ . 1 . 2]" 1
1033 1 92 LEU HA 1 92 LEU MD2 . . 4.420 3.921 3.854 3.982 . 0 0 "[ . 1 . 2]" 1
1034 1 89 LYS HA 1 92 LEU MD2 . . 4.310 3.173 2.439 3.936 . 0 0 "[ . 1 . 2]" 1
1035 1 92 LEU MD2 1 101 GLY HA3 . . 4.930 4.411 3.755 4.941 0.011 8 0 "[ . 1 . 2]" 1
1036 1 89 LYS QG 1 90 ALA H . . 5.330 4.414 4.289 4.502 . 0 0 "[ . 1 . 2]" 1
1037 1 73 LEU MD1 1 83 LEU MD2 . . 4.110 2.861 2.393 3.612 . 0 0 "[ . 1 . 2]" 1
1038 1 83 LEU MD2 1 88 THR MG . . 4.360 4.175 3.578 4.360 0.000 20 0 "[ . 1 . 2]" 1
1039 1 83 LEU HB3 1 83 LEU MD2 . . 3.610 3.122 2.574 3.188 . 0 0 "[ . 1 . 2]" 1
1040 1 83 LEU HB2 1 83 LEU MD2 . . 3.430 2.141 2.056 2.275 . 0 0 "[ . 1 . 2]" 1
1041 1 72 PHE HB2 1 83 LEU MD2 . . 3.890 3.273 2.659 3.741 . 0 0 "[ . 1 . 2]" 1
1042 1 72 PHE HB3 1 83 LEU MD2 . . 4.250 2.004 1.771 2.753 . 0 0 "[ . 1 . 2]" 1
1043 1 83 LEU HA 1 83 LEU MD2 . . 4.380 3.284 3.071 3.804 . 0 0 "[ . 1 . 2]" 1
1044 1 30 PHE QE 1 83 LEU MD2 . . 4.790 3.112 2.519 3.521 . 0 0 "[ . 1 . 2]" 1
1045 1 83 LEU MD2 1 91 PHE QE . . 4.540 3.648 2.421 4.401 . 0 0 "[ . 1 . 2]" 1
1046 1 83 LEU MD2 1 91 PHE QD . . 3.800 3.413 2.890 3.803 0.003 12 0 "[ . 1 . 2]" 1
1047 1 83 LEU MD2 1 84 SER H . . 5.050 4.893 4.697 5.050 0.000 14 0 "[ . 1 . 2]" 1
1048 1 74 GLN HB2 1 80 ALA MB . . 5.500 4.517 3.978 4.920 . 0 0 "[ . 1 . 2]" 1
1049 1 74 GLN HB3 1 80 ALA MB . . 5.500 4.448 3.965 4.956 . 0 0 "[ . 1 . 2]" 1
1050 1 53 PHE QE 1 64 ILE HG12 . . 4.820 4.010 3.599 4.628 . 0 0 "[ . 1 . 2]" 1
1051 1 53 PHE QE 1 64 ILE HG13 . . 4.820 2.552 2.095 3.214 . 0 0 "[ . 1 . 2]" 1
1052 1 64 ILE HG13 1 65 GLU H . . 5.140 5.047 4.840 5.149 0.009 17 0 "[ . 1 . 2]" 1
1053 1 12 LEU MD1 1 44 LYS HE2 . . 5.500 4.596 3.437 5.443 . 0 0 "[ . 1 . 2]" 1
1054 1 12 LEU MD1 1 76 PHE QE . . 3.910 2.732 1.955 3.295 . 0 0 "[ . 1 . 2]" 1
1055 1 12 LEU MD1 1 76 PHE HZ . . 4.660 3.913 3.175 4.604 . 0 0 "[ . 1 . 2]" 1
1056 1 8 PHE QD 1 12 LEU MD1 . . 4.140 2.271 1.873 2.718 . 0 0 "[ . 1 . 2]" 1
1057 1 35 PHE QD 1 73 LEU HG . . 5.500 5.402 5.169 5.501 0.001 3 0 "[ . 1 . 2]" 1
1058 1 72 PHE QD 1 73 LEU HG . . 4.790 3.283 2.868 3.623 . 0 0 "[ . 1 . 2]" 1
1059 1 69 LEU MD1 1 92 LEU HG . . 4.230 3.692 3.491 3.885 . 0 0 "[ . 1 . 2]" 1
1060 1 92 LEU HG 1 93 LYS H . . 3.830 3.250 2.901 3.540 . 0 0 "[ . 1 . 2]" 1
1061 1 8 PHE HB3 1 12 LEU HG . . 4.910 4.349 3.667 4.912 0.002 12 0 "[ . 1 . 2]" 1
1062 1 17 VAL HA 1 39 CYS HB3 . . 4.410 3.145 2.497 4.410 0.000 17 0 "[ . 1 . 2]" 1
1063 1 36 PHE HA 1 39 CYS HB2 . . 5.290 4.393 2.328 5.023 . 0 0 "[ . 1 . 2]" 1
1064 1 36 PHE HA 1 39 CYS HB3 . . 5.290 4.561 3.328 4.895 . 0 0 "[ . 1 . 2]" 1
1065 1 81 ARG HG3 1 83 LEU MD1 . . 5.160 3.767 3.159 4.298 . 0 0 "[ . 1 . 2]" 1
1066 1 73 LEU MD1 1 81 ARG HG3 . . 3.970 2.254 1.866 2.856 . 0 0 "[ . 1 . 2]" 1
1067 1 81 ARG HG3 1 83 LEU HA . . 5.500 4.981 4.553 5.505 0.005 12 0 "[ . 1 . 2]" 1
1068 1 81 ARG HG3 1 81 ARG QH2 . . 5.230 4.207 2.528 4.501 . 0 0 "[ . 1 . 2]" 1
1069 1 69 LEU MD1 1 103 ILE HG13 . . 5.310 2.325 1.980 2.789 . 0 0 "[ . 1 . 2]" 1
1070 1 92 LEU HA 1 103 ILE HG12 . . 5.210 4.271 3.932 4.569 . 0 0 "[ . 1 . 2]" 1
1071 1 92 LEU HA 1 103 ILE HG13 . . 4.840 3.394 2.823 3.640 . 0 0 "[ . 1 . 2]" 1
1072 1 102 LYS HA 1 103 ILE HG13 . . 4.770 4.062 3.929 4.233 . 0 0 "[ . 1 . 2]" 1
1073 1 21 LEU HG 1 35 PHE QE . . 5.040 3.346 2.574 3.727 . 0 0 "[ . 1 . 2]" 1
1074 1 109 ALA HA 1 112 ILE HG12 . . 4.850 2.263 1.971 2.621 . 0 0 "[ . 1 . 2]" 1
1075 1 112 ILE HG13 1 113 LYS H . . 4.650 2.092 1.925 2.536 . 0 0 "[ . 1 . 2]" 1
1076 1 44 LYS HA 1 44 LYS HD2 . . 3.780 2.321 2.240 2.420 . 0 0 "[ . 1 . 2]" 1
1077 1 41 LEU H 1 41 LEU HG . . 4.360 2.746 2.558 3.121 . 0 0 "[ . 1 . 2]" 1
1078 1 21 LEU MD1 1 80 ALA MB . . 3.840 3.837 3.792 3.844 0.004 20 0 "[ . 1 . 2]" 1
1079 1 21 LEU HB2 1 21 LEU MD1 . . 3.520 2.092 2.017 2.170 . 0 0 "[ . 1 . 2]" 1
1080 1 21 LEU MD1 1 76 PHE HB3 . . 4.320 2.124 1.848 2.471 . 0 0 "[ . 1 . 2]" 1
1081 1 21 LEU MD1 1 76 PHE HB2 . . 4.340 2.283 1.971 2.618 . 0 0 "[ . 1 . 2]" 1
1082 1 21 LEU MD1 1 35 PHE QE . . 4.770 4.373 3.966 4.765 . 0 0 "[ . 1 . 2]" 1
1083 1 24 CYS HB2 1 30 PHE HA . . 3.980 3.065 2.208 3.806 . 0 0 "[ . 1 . 2]" 1
1084 1 24 CYS HB2 1 30 PHE QD . . 4.600 2.442 2.018 3.064 . 0 0 "[ . 1 . 2]" 1
1085 1 24 CYS HB3 1 30 PHE QD . . 4.600 2.250 1.998 3.437 . 0 0 "[ . 1 . 2]" 1
1086 1 55 ILE HA 1 55 ILE HG12 . . 3.890 2.981 2.471 3.411 . 0 0 "[ . 1 . 2]" 1
1087 1 52 ALA HA 1 55 ILE HG13 . . 4.970 2.183 1.999 3.057 . 0 0 "[ . 1 . 2]" 1
1088 1 60 LYS HA 1 60 LYS HD2 . . 3.940 2.416 1.996 3.464 . 0 0 "[ . 1 . 2]" 1
1089 1 89 LYS HA 1 89 LYS HD2 . . 4.640 3.878 2.000 4.587 . 0 0 "[ . 1 . 2]" 1
1090 1 89 LYS HA 1 89 LYS HD3 . . 4.640 3.895 2.025 4.484 . 0 0 "[ . 1 . 2]" 1
1091 1 113 LYS HA 1 113 LYS QD . . 3.800 3.649 3.419 3.806 0.006 6 0 "[ . 1 . 2]" 1
1092 1 113 LYS H 1 113 LYS QD . . 4.820 4.415 4.337 4.692 . 0 0 "[ . 1 . 2]" 1
1093 1 37 LYS HA 1 37 LYS QD . . 4.080 3.602 2.002 4.082 0.002 19 0 "[ . 1 . 2]" 1
1094 1 13 LYS H 1 13 LYS QD . . 4.800 3.760 1.809 4.788 . 0 0 "[ . 1 . 2]" 1
1095 1 93 LYS HA 1 93 LYS QD . . 4.220 3.606 2.868 4.022 . 0 0 "[ . 1 . 2]" 1
1096 1 77 LYS HA 1 77 LYS QD . . 3.950 3.222 2.194 3.941 . 0 0 "[ . 1 . 2]" 1
1097 1 77 LYS QD 1 78 ALA H . . 4.840 3.502 2.078 4.719 . 0 0 "[ . 1 . 2]" 1
1098 1 70 LYS HA 1 70 LYS QD . . 4.750 4.389 4.094 4.623 . 0 0 "[ . 1 . 2]" 1
1099 1 70 LYS QD 1 71 LEU H . . 4.970 4.662 4.195 4.969 . 0 0 "[ . 1 . 2]" 1
1100 1 65 GLU HB2 1 66 GLU H . . 3.950 3.685 3.093 3.953 0.003 15 0 "[ . 1 . 2]" 1
1101 1 51 LYS HA 1 51 LYS QD . . 4.020 2.813 1.957 4.023 0.003 15 0 "[ . 1 . 2]" 1
1102 1 25 LYS HA 1 25 LYS QD . . 4.260 3.621 2.024 4.263 0.003 2 0 "[ . 1 . 2]" 1
1103 1 63 PHE HB2 1 102 LYS HD2 . . 4.830 2.994 2.001 4.499 . 0 0 "[ . 1 . 2]" 1
1104 1 102 LYS HA 1 102 LYS HD2 . . 5.140 4.359 4.043 4.934 . 0 0 "[ . 1 . 2]" 1
1105 1 102 LYS HA 1 102 LYS HD3 . . 5.140 4.796 3.607 5.005 . 0 0 "[ . 1 . 2]" 1
1106 1 50 LYS HA 1 50 LYS QD . . 4.100 4.018 3.209 4.093 . 0 0 "[ . 1 . 2]" 1
1107 1 50 LYS H 1 50 LYS QD . . 4.630 3.132 2.124 3.429 . 0 0 "[ . 1 . 2]" 1
1108 1 66 GLU HB2 1 67 GLU H . . 4.360 4.021 3.535 4.185 . 0 0 "[ . 1 . 2]" 1
1109 1 48 GLU HB3 1 49 VAL MG2 . . 4.920 4.690 4.519 4.908 . 0 0 "[ . 1 . 2]" 1
1110 1 48 GLU HB2 1 49 VAL MG2 . . 5.210 4.902 4.642 5.082 . 0 0 "[ . 1 . 2]" 1
1111 1 48 GLU HB3 1 49 VAL H . . 4.820 3.768 3.720 3.823 . 0 0 "[ . 1 . 2]" 1
1112 1 48 GLU HB2 1 49 VAL H . . 4.490 4.062 3.973 4.153 . 0 0 "[ . 1 . 2]" 1
1113 1 45 SER H 1 48 GLU HB2 . . 5.190 5.153 4.889 5.203 0.013 14 0 "[ . 1 . 2]" 1
1114 1 64 ILE HA 1 68 GLU HB3 . . 4.540 3.219 2.795 3.896 . 0 0 "[ . 1 . 2]" 1
1115 1 64 ILE HA 1 68 GLU HB2 . . 4.780 2.657 2.257 3.126 . 0 0 "[ . 1 . 2]" 1
1116 1 81 ARG HB2 1 82 ALA H . . 3.990 2.188 1.959 2.668 . 0 0 "[ . 1 . 2]" 1
1117 1 107 GLU H 1 107 GLU HB3 . . 3.970 3.507 3.428 3.608 . 0 0 "[ . 1 . 2]" 1
1118 1 103 ILE MD 1 111 MET HG2 . . 5.100 5.001 4.874 5.102 0.002 10 0 "[ . 1 . 2]" 1
1119 1 103 ILE MD 1 111 MET HG3 . . 5.500 5.485 5.372 5.515 0.015 11 0 "[ . 1 . 2]" 1
1120 1 95 GLY HA3 1 111 MET HG2 . . 4.730 4.113 3.503 4.519 . 0 0 "[ . 1 . 2]" 1
1121 1 95 GLY HA3 1 111 MET HG3 . . 4.980 4.899 4.419 4.989 0.009 7 0 "[ . 1 . 2]" 1
1122 1 111 MET HA 1 111 MET HG2 . . 4.270 3.619 3.581 3.679 . 0 0 "[ . 1 . 2]" 1
1123 1 91 PHE QD 1 111 MET HG3 . . 5.500 5.497 5.374 5.517 0.017 8 0 "[ . 1 . 2]" 1
1124 1 36 PHE QE 1 111 MET HG2 . . 5.500 4.559 3.737 5.504 0.004 15 0 "[ . 1 . 2]" 1
1125 1 111 MET HG2 1 113 LYS H . . 5.500 4.559 4.438 4.827 . 0 0 "[ . 1 . 2]" 1
1126 1 36 PHE QE 1 111 MET HG3 . . 4.870 3.083 2.158 4.222 . 0 0 "[ . 1 . 2]" 1
1127 1 48 GLU H 1 49 VAL HB . . 5.020 4.762 4.637 4.883 . 0 0 "[ . 1 . 2]" 1
1128 1 49 VAL H 1 49 VAL HB . . 3.490 2.429 2.329 2.512 . 0 0 "[ . 1 . 2]" 1
1129 1 14 ASP HA 1 17 VAL HB . . 4.920 4.861 4.606 4.926 0.006 9 0 "[ . 1 . 2]" 1
1130 1 83 LEU MD2 1 87 GLU HB2 . . 5.120 4.716 3.856 4.867 . 0 0 "[ . 1 . 2]" 1
1131 1 83 LEU MD2 1 87 GLU HB3 . . 5.120 4.365 3.082 4.737 . 0 0 "[ . 1 . 2]" 1
1132 1 87 GLU H 1 87 GLU HB2 . . 3.890 2.410 2.273 2.505 . 0 0 "[ . 1 . 2]" 1
1133 1 50 LYS HB3 1 51 LYS H . . 3.900 3.823 3.641 3.927 0.027 2 0 "[ . 1 . 2]" 1
1134 1 6 MET ME 1 6 MET HG2 . . 3.550 2.685 2.002 3.379 . 0 0 "[ . 1 . 2]" 1
1135 1 93 LYS HB2 1 93 LYS QE . . 4.430 3.391 1.965 4.266 . 0 0 "[ . 1 . 2]" 1
1136 1 93 LYS HB3 1 93 LYS QE . . 4.090 3.155 2.017 4.066 . 0 0 "[ . 1 . 2]" 1
1137 1 89 LYS HB3 1 89 LYS QE . . 4.090 3.173 2.027 4.081 . 0 0 "[ . 1 . 2]" 1
1138 1 70 LYS QB 1 71 LEU MD2 . . 4.430 3.760 2.896 4.427 . 0 0 "[ . 1 . 2]" 1
1139 1 70 LYS QB 1 70 LYS QE . . 4.010 2.230 1.932 3.111 . 0 0 "[ . 1 . 2]" 1
1140 1 51 LYS H 1 51 LYS HB2 . . 3.650 2.719 2.612 2.809 . 0 0 "[ . 1 . 2]" 1
1141 1 51 LYS H 1 51 LYS HB3 . . 3.650 3.550 3.519 3.588 . 0 0 "[ . 1 . 2]" 1
1142 1 51 LYS HB2 1 52 ALA H . . 4.480 3.212 2.608 3.330 . 0 0 "[ . 1 . 2]" 1
1143 1 51 LYS HB3 1 52 ALA H . . 4.480 4.293 3.879 4.394 . 0 0 "[ . 1 . 2]" 1
1144 1 44 LYS HB2 1 49 VAL MG2 . . 4.110 3.176 2.563 3.596 . 0 0 "[ . 1 . 2]" 1
1145 1 44 LYS HB3 1 44 LYS HE2 . . 4.710 4.358 4.218 4.481 . 0 0 "[ . 1 . 2]" 1
1146 1 113 LYS HB2 1 114 GLY H . . 4.380 4.297 4.060 4.395 0.015 18 0 "[ . 1 . 2]" 1
1147 1 37 LYS QB 1 37 LYS QE . . 4.290 3.099 2.050 3.833 . 0 0 "[ . 1 . 2]" 1
1148 1 13 LYS HB2 1 14 ASP H . . 5.500 4.299 3.945 4.551 . 0 0 "[ . 1 . 2]" 1
1149 1 13 LYS HB3 1 14 ASP H . . 5.500 3.749 3.007 4.442 . 0 0 "[ . 1 . 2]" 1
1150 1 110 ALA MB 1 111 MET HB3 . . 5.230 4.066 3.886 4.176 . 0 0 "[ . 1 . 2]" 1
1151 1 36 PHE QD 1 111 MET HB2 . . 5.500 4.505 3.853 5.180 . 0 0 "[ . 1 . 2]" 1
1152 1 36 PHE QE 1 111 MET HB2 . . 5.500 3.995 2.988 5.199 . 0 0 "[ . 1 . 2]" 1
1153 1 56 ILE MG 1 58 GLN HG3 . . 5.020 3.854 3.492 4.701 . 0 0 "[ . 1 . 2]" 1
1154 1 74 GLN HA 1 74 GLN HG3 . . 4.160 2.927 2.489 3.278 . 0 0 "[ . 1 . 2]" 1
1155 1 74 GLN HG2 1 75 ASN H . . 5.500 5.238 4.999 5.500 0.000 1 0 "[ . 1 . 2]" 1
1156 1 74 GLN HG3 1 80 ALA H . . 5.070 4.241 3.452 4.860 . 0 0 "[ . 1 . 2]" 1
1157 1 11 VAL HB 1 12 LEU HG . . 3.980 2.819 2.356 3.374 . 0 0 "[ . 1 . 2]" 1
1158 1 8 PHE HB2 1 11 VAL HB . . 5.410 4.911 4.563 5.300 . 0 0 "[ . 1 . 2]" 1
1159 1 21 LEU MD1 1 77 LYS HB2 . . 4.180 2.797 2.517 3.013 . 0 0 "[ . 1 . 2]" 1
1160 1 21 LEU MD1 1 77 LYS HB3 . . 4.180 3.858 3.498 4.183 0.003 3 0 "[ . 1 . 2]" 1
1161 1 63 PHE QD 1 102 LYS HB2 . . 5.230 3.633 2.428 4.620 . 0 0 "[ . 1 . 2]" 1
1162 1 63 PHE QD 1 102 LYS HB3 . . 5.230 3.581 2.796 4.453 . 0 0 "[ . 1 . 2]" 1
1163 1 103 ILE MG 1 107 GLU HG3 . . 5.310 5.079 4.669 5.290 . 0 0 "[ . 1 . 2]" 1
1164 1 107 GLU HA 1 107 GLU HG2 . . 3.870 2.733 2.582 2.807 . 0 0 "[ . 1 . 2]" 1
1165 1 107 GLU H 1 107 GLU HG2 . . 4.540 4.269 3.874 4.424 . 0 0 "[ . 1 . 2]" 1
1166 1 104 GLY H 1 107 GLU HG3 . . 5.170 4.318 3.648 4.787 . 0 0 "[ . 1 . 2]" 1
1167 1 66 GLU HA 1 66 GLU HG2 . . 4.000 2.940 2.348 3.814 . 0 0 "[ . 1 . 2]" 1
1168 1 66 GLU HA 1 66 GLU HG3 . . 4.000 2.791 2.404 3.616 . 0 0 "[ . 1 . 2]" 1
1169 1 66 GLU HG2 1 67 GLU H . . 5.180 4.208 3.444 4.977 . 0 0 "[ . 1 . 2]" 1
1170 1 66 GLU HG3 1 67 GLU H . . 5.180 4.937 4.131 5.182 0.002 6 0 "[ . 1 . 2]" 1
1171 1 66 GLU H 1 66 GLU HG2 . . 4.940 4.419 4.287 4.612 . 0 0 "[ . 1 . 2]" 1
1172 1 66 GLU H 1 66 GLU HG3 . . 4.940 4.397 4.102 4.603 . 0 0 "[ . 1 . 2]" 1
1173 1 105 ILE HB 1 108 PHE QB . . 4.670 4.515 4.327 4.690 0.020 8 0 "[ . 1 . 2]" 1
1174 1 105 ILE HB 1 106 ASP H . . 4.890 3.679 3.574 3.801 . 0 0 "[ . 1 . 2]" 1
1175 1 36 PHE HB3 1 112 ILE MD . . 5.140 4.361 4.181 4.563 . 0 0 "[ . 1 . 2]" 1
1176 1 36 PHE HB2 1 112 ILE MD . . 5.500 5.502 5.448 5.523 0.023 16 0 "[ . 1 . 2]" 1
1177 1 36 PHE HB2 1 112 ILE MG . . 4.880 2.779 2.637 3.008 . 0 0 "[ . 1 . 2]" 1
1178 1 36 PHE HB3 1 41 LEU HB2 . . 4.980 3.009 2.686 3.329 . 0 0 "[ . 1 . 2]" 1
1179 1 36 PHE HB2 1 41 LEU HB2 . . 5.110 4.362 4.088 4.707 . 0 0 "[ . 1 . 2]" 1
1180 1 33 LYS HA 1 36 PHE HB3 . . 4.700 4.655 4.289 4.708 0.008 16 0 "[ . 1 . 2]" 1
1181 1 36 PHE HB3 1 37 LYS H . . 3.970 3.680 3.440 3.966 . 0 0 "[ . 1 . 2]" 1
1182 1 65 GLU HG2 1 102 LYS HG2 . . 5.150 3.353 2.085 4.996 . 0 0 "[ . 1 . 2]" 1
1183 1 65 GLU HG2 1 102 LYS HD2 . . 5.400 3.721 2.662 5.356 . 0 0 "[ . 1 . 2]" 1
1184 1 65 GLU HG3 1 102 LYS HG2 . . 5.150 2.449 1.999 4.527 . 0 0 "[ . 1 . 2]" 1
1185 1 65 GLU HG3 1 102 LYS HD2 . . 5.400 2.827 2.085 4.060 . 0 0 "[ . 1 . 2]" 1
1186 1 65 GLU HG2 1 102 LYS HG3 . . 5.150 4.749 3.691 5.154 0.004 16 0 "[ . 1 . 2]" 1
1187 1 65 GLU HG3 1 102 LYS HG3 . . 5.150 3.908 3.454 4.971 . 0 0 "[ . 1 . 2]" 1
1188 1 65 GLU HG2 1 102 LYS HD3 . . 5.400 3.643 2.617 5.336 . 0 0 "[ . 1 . 2]" 1
1189 1 65 GLU HG3 1 102 LYS HD3 . . 5.400 3.258 2.451 4.488 . 0 0 "[ . 1 . 2]" 1
1190 1 48 GLU HG2 1 49 VAL MG1 . . 5.220 5.035 4.927 5.154 . 0 0 "[ . 1 . 2]" 1
1191 1 48 GLU HG3 1 49 VAL MG1 . . 5.220 4.729 4.531 4.833 . 0 0 "[ . 1 . 2]" 1
1192 1 48 GLU HA 1 48 GLU HG2 . . 3.840 3.800 3.790 3.806 . 0 0 "[ . 1 . 2]" 1
1193 1 48 GLU HA 1 48 GLU HG3 . . 3.840 3.612 3.593 3.620 . 0 0 "[ . 1 . 2]" 1
1194 1 48 GLU H 1 48 GLU HG3 . . 3.930 3.732 3.600 3.815 . 0 0 "[ . 1 . 2]" 1
1195 1 15 ALA MB 1 16 GLU QG . . 4.130 3.339 3.002 3.590 . 0 0 "[ . 1 . 2]" 1
1196 1 16 GLU QG 1 17 VAL H . . 4.930 4.134 3.885 4.299 . 0 0 "[ . 1 . 2]" 1
1197 1 87 GLU HA 1 87 GLU HG2 . . 4.140 2.854 2.420 3.492 . 0 0 "[ . 1 . 2]" 1
1198 1 87 GLU HA 1 87 GLU HG3 . . 4.140 2.524 2.270 2.804 . 0 0 "[ . 1 . 2]" 1
1199 1 109 ALA HA 1 112 ILE HB . . 4.510 4.429 4.232 4.591 0.081 10 0 "[ . 1 . 2]" 1
1200 1 112 ILE H 1 112 ILE HB . . 3.500 3.539 3.467 3.604 0.104 15 0 "[ . 1 . 2]" 1
1201 1 52 ALA HA 1 55 ILE HB . . 4.320 3.365 2.847 3.820 . 0 0 "[ . 1 . 2]" 1
1202 1 8 PHE QE 1 55 ILE HB . . 5.120 2.533 2.039 3.168 . 0 0 "[ . 1 . 2]" 1
1203 1 64 ILE HB 1 103 ILE MG . . 4.350 2.804 2.491 3.114 . 0 0 "[ . 1 . 2]" 1
1204 1 63 PHE HA 1 64 ILE HB . . 5.120 4.461 4.312 4.626 . 0 0 "[ . 1 . 2]" 1
1205 1 53 PHE HZ 1 64 ILE HB . . 4.930 4.321 3.486 4.932 0.002 10 0 "[ . 1 . 2]" 1
1206 1 64 ILE HB 1 103 ILE H . . 4.900 3.187 2.659 3.493 . 0 0 "[ . 1 . 2]" 1
1207 1 57 ASP HB2 1 64 ILE MD . . 5.500 4.503 2.674 5.233 . 0 0 "[ . 1 . 2]" 1
1208 1 57 ASP HB3 1 64 ILE MD . . 5.500 5.187 4.192 5.504 0.004 8 0 "[ . 1 . 2]" 1
1209 1 54 ALA HA 1 57 ASP HB2 . . 4.240 2.736 2.015 4.151 . 0 0 "[ . 1 . 2]" 1
1210 1 54 ALA HA 1 57 ASP HB3 . . 4.240 3.682 2.269 4.246 0.006 8 0 "[ . 1 . 2]" 1
1211 1 57 ASP H 1 57 ASP HB3 . . 3.700 3.362 2.156 3.577 . 0 0 "[ . 1 . 2]" 1
1212 1 8 PHE HB2 1 12 LEU MD1 . . 5.060 4.533 3.966 4.879 . 0 0 "[ . 1 . 2]" 1
1213 1 8 PHE HB3 1 12 LEU MD1 . . 4.100 3.318 2.640 3.782 . 0 0 "[ . 1 . 2]" 1
1214 1 8 PHE HB3 1 11 VAL MG1 . . 5.360 4.962 4.413 5.355 . 0 0 "[ . 1 . 2]" 1
1215 1 8 PHE HB3 1 12 LEU QB . . 4.280 3.160 2.302 4.143 . 0 0 "[ . 1 . 2]" 1
1216 1 8 PHE HB3 1 11 VAL HB . . 4.720 3.797 3.325 4.115 . 0 0 "[ . 1 . 2]" 1
1217 1 8 PHE HB2 1 9 ALA H . . 5.110 3.264 3.081 3.485 . 0 0 "[ . 1 . 2]" 1
1218 1 69 LEU MD1 1 91 PHE HB2 . . 5.460 4.998 3.917 5.462 0.002 17 0 "[ . 1 . 2]" 1
1219 1 69 LEU MD1 1 91 PHE HB3 . . 5.010 3.507 2.344 4.071 . 0 0 "[ . 1 . 2]" 1
1220 1 83 LEU MD2 1 91 PHE HB2 . . 5.500 4.913 3.058 5.493 . 0 0 "[ . 1 . 2]" 1
1221 1 88 THR MG 1 91 PHE HB3 . . 5.200 3.533 2.763 3.947 . 0 0 "[ . 1 . 2]" 1
1222 1 90 ALA MB 1 91 PHE HB3 . . 5.320 4.850 4.526 5.251 . 0 0 "[ . 1 . 2]" 1
1223 1 91 PHE HB2 1 111 MET ME . . 5.360 4.727 4.363 5.056 . 0 0 "[ . 1 . 2]" 1
1224 1 64 ILE HB 1 103 ILE HB . . 3.360 2.818 2.360 3.045 . 0 0 "[ . 1 . 2]" 1
1225 1 64 ILE HA 1 103 ILE HB . . 5.430 5.200 4.938 5.387 . 0 0 "[ . 1 . 2]" 1
1226 1 21 LEU MD2 1 76 PHE HB3 . . 3.830 3.548 3.234 3.765 . 0 0 "[ . 1 . 2]" 1
1227 1 17 VAL MG2 1 76 PHE HB2 . . 4.330 4.196 3.820 4.332 0.002 2 0 "[ . 1 . 2]" 1
1228 1 76 PHE HB3 1 77 LYS H . . 4.510 4.419 4.336 4.486 . 0 0 "[ . 1 . 2]" 1
1229 1 53 PHE HB3 1 64 ILE MD . . 5.160 4.811 4.450 5.162 0.002 8 0 "[ . 1 . 2]" 1
1230 1 53 PHE HB3 1 105 ILE MD . . 4.470 3.674 3.187 4.197 . 0 0 "[ . 1 . 2]" 1
1231 1 53 PHE HB2 1 105 ILE MD . . 4.530 3.286 2.729 3.781 . 0 0 "[ . 1 . 2]" 1
1232 1 49 VAL MG1 1 53 PHE HB3 . . 4.960 4.500 4.097 4.808 . 0 0 "[ . 1 . 2]" 1
1233 1 53 PHE HB3 1 54 ALA MB . . 4.790 4.005 3.897 4.100 . 0 0 "[ . 1 . 2]" 1
1234 1 52 ALA MB 1 53 PHE HB3 . . 4.860 4.612 4.397 4.864 0.004 2 0 "[ . 1 . 2]" 1
1235 1 52 ALA MB 1 53 PHE HB2 . . 4.830 4.291 4.146 4.419 . 0 0 "[ . 1 . 2]" 1
1236 1 53 PHE HA 1 53 PHE HB2 . . 2.730 2.460 2.413 2.532 . 0 0 "[ . 1 . 2]" 1
1237 1 50 LYS HA 1 53 PHE HB3 . . 3.960 2.691 2.304 3.064 . 0 0 "[ . 1 . 2]" 1
1238 1 53 PHE HB2 1 54 ALA H . . 4.330 4.173 4.055 4.259 . 0 0 "[ . 1 . 2]" 1
1239 1 96 ASP HB2 1 103 ILE MD . . 4.350 2.551 2.283 2.864 . 0 0 "[ . 1 . 2]" 1
1240 1 96 ASP HB3 1 103 ILE MD . . 4.350 3.819 3.496 4.163 . 0 0 "[ . 1 . 2]" 1
1241 1 92 LEU HG 1 96 ASP HB2 . . 4.600 3.293 2.578 3.960 . 0 0 "[ . 1 . 2]" 1
1242 1 92 LEU HG 1 96 ASP HB3 . . 4.600 2.991 2.529 3.637 . 0 0 "[ . 1 . 2]" 1
1243 1 8 PHE QE 1 75 ASN HB2 . . 4.610 2.344 1.997 2.768 . 0 0 "[ . 1 . 2]" 1
1244 1 8 PHE QE 1 75 ASN HB3 . . 4.610 3.465 2.477 3.829 . 0 0 "[ . 1 . 2]" 1
1245 1 8 PHE QD 1 75 ASN HB2 . . 4.860 3.258 3.000 3.534 . 0 0 "[ . 1 . 2]" 1
1246 1 8 PHE QD 1 75 ASN HB3 . . 4.860 4.670 3.834 4.868 0.008 12 0 "[ . 1 . 2]" 1
1247 1 30 PHE QE 1 35 PHE HB2 . . 5.490 3.266 2.121 4.384 . 0 0 "[ . 1 . 2]" 1
1248 1 30 PHE QE 1 35 PHE HB3 . . 5.030 4.087 3.022 5.028 . 0 0 "[ . 1 . 2]" 1
1249 1 85 ASP QB 1 86 ALA MB . . 4.310 3.961 3.558 4.313 0.003 15 0 "[ . 1 . 2]" 1
1250 1 85 ASP QB 1 89 LYS QG . . 4.410 3.997 3.263 4.410 . 0 0 "[ . 1 . 2]" 1
1251 1 53 PHE QD 1 108 PHE QB . . 4.120 2.516 2.273 2.820 . 0 0 "[ . 1 . 2]" 1
1252 1 53 PHE QE 1 108 PHE QB . . 4.470 3.199 2.781 3.792 . 0 0 "[ . 1 . 2]" 1
1253 1 18 THR MG 1 22 ASP HB2 . . 4.510 3.659 3.295 4.372 . 0 0 "[ . 1 . 2]" 1
1254 1 18 THR MG 1 22 ASP HB3 . . 5.030 4.611 4.341 5.033 0.003 3 0 "[ . 1 . 2]" 1
1255 1 19 ALA MB 1 22 ASP HB2 . . 4.940 4.802 4.373 4.936 . 0 0 "[ . 1 . 2]" 1
1256 1 19 ALA MB 1 22 ASP HB3 . . 4.500 4.327 4.048 4.500 0.000 20 0 "[ . 1 . 2]" 1
1257 1 19 ALA HA 1 22 ASP HB2 . . 3.460 3.291 2.803 3.462 0.002 3 0 "[ . 1 . 2]" 1
1258 1 22 ASP HB3 1 23 GLY H . . 4.320 3.128 2.812 3.355 . 0 0 "[ . 1 . 2]" 1
1259 1 22 ASP H 1 22 ASP HB2 . . 3.370 2.289 2.141 2.512 . 0 0 "[ . 1 . 2]" 1
1260 1 47 ASP QB 1 50 LYS QD . . 4.680 4.340 3.940 4.624 . 0 0 "[ . 1 . 2]" 1
1261 1 47 ASP QB 1 48 GLU HB3 . . 4.140 3.707 3.477 3.981 . 0 0 "[ . 1 . 2]" 1
1262 1 45 SER HB3 1 47 ASP QB . . 3.220 2.789 2.421 3.002 . 0 0 "[ . 1 . 2]" 1
1263 1 47 ASP QB 1 48 GLU H . . 3.500 2.157 1.975 2.308 . 0 0 "[ . 1 . 2]" 1
1264 1 64 ILE MG 1 69 LEU HB3 . . 4.440 4.217 4.019 4.443 0.003 7 0 "[ . 1 . 2]" 1
1265 1 69 LEU HB3 1 70 LYS H . . 4.270 3.193 2.852 3.702 . 0 0 "[ . 1 . 2]" 1
1266 1 63 PHE QD 1 102 LYS HE2 . . 5.170 4.431 3.031 4.994 . 0 0 "[ . 1 . 2]" 1
1267 1 63 PHE QD 1 102 LYS HE3 . . 5.170 3.580 3.023 4.795 . 0 0 "[ . 1 . 2]" 1
1268 1 63 PHE QE 1 102 LYS HE2 . . 5.500 5.086 3.994 5.500 0.000 20 0 "[ . 1 . 2]" 1
1269 1 63 PHE QE 1 102 LYS HE3 . . 5.500 4.336 3.331 5.082 . 0 0 "[ . 1 . 2]" 1
1270 1 21 LEU HB3 1 21 LEU MD1 . . 3.520 2.590 2.493 2.655 . 0 0 "[ . 1 . 2]" 1
1271 1 21 LEU HB3 1 21 LEU MD2 . . 3.450 2.160 2.064 2.289 . 0 0 "[ . 1 . 2]" 1
1272 1 33 LYS QE 1 33 LYS HG2 . . 3.910 2.986 2.245 3.523 . 0 0 "[ . 1 . 2]" 1
1273 1 33 LYS QE 1 33 LYS HG3 . . 3.910 2.698 2.129 3.580 . 0 0 "[ . 1 . 2]" 1
1274 1 70 LYS HA 1 83 LEU HB3 . . 4.540 3.778 3.341 4.229 . 0 0 "[ . 1 . 2]" 1
1275 1 70 LYS HA 1 83 LEU HB2 . . 3.990 2.091 1.996 2.515 . 0 0 "[ . 1 . 2]" 1
1276 1 34 LYS QE 1 34 LYS HG2 . . 3.810 2.565 2.093 3.589 . 0 0 "[ . 1 . 2]" 1
1277 1 25 LYS QE 1 25 LYS QG . . 2.980 2.372 2.080 2.970 . 0 0 "[ . 1 . 2]" 1
1278 1 50 LYS HE2 1 105 ILE MG . . 5.270 3.885 2.912 5.107 . 0 0 "[ . 1 . 2]" 1
1279 1 50 LYS HE3 1 105 ILE MG . . 5.270 4.348 3.038 5.135 . 0 0 "[ . 1 . 2]" 1
1280 1 69 LEU MD1 1 92 LEU HB2 . . 4.610 2.036 1.826 2.474 . 0 0 "[ . 1 . 2]" 1
1281 1 69 LEU MD1 1 92 LEU HB3 . . 4.610 3.426 3.139 3.760 . 0 0 "[ . 1 . 2]" 1
1282 1 89 LYS HA 1 92 LEU HB3 . . 3.960 2.589 2.083 3.384 . 0 0 "[ . 1 . 2]" 1
1283 1 72 PHE HB2 1 91 PHE QE . . 5.390 2.222 1.992 2.749 . 0 0 "[ . 1 . 2]" 1
1284 1 72 PHE HB3 1 91 PHE QE . . 5.130 2.780 1.996 3.432 . 0 0 "[ . 1 . 2]" 1
1285 1 60 LYS HE2 1 60 LYS QG . . 3.580 3.014 2.180 3.409 . 0 0 "[ . 1 . 2]" 1
1286 1 60 LYS HE3 1 60 LYS QG . . 3.580 2.758 2.198 3.563 . 0 0 "[ . 1 . 2]" 1
1287 1 12 LEU MD2 1 44 LYS HE3 . . 3.580 2.770 1.823 3.582 0.002 12 0 "[ . 1 . 2]" 1
1288 1 44 LYS HE3 1 44 LYS HG2 . . 3.950 3.678 3.550 3.794 . 0 0 "[ . 1 . 2]" 1
1289 1 44 LYS HE3 1 44 LYS HG3 . . 3.950 2.681 2.527 2.812 . 0 0 "[ . 1 . 2]" 1
1290 1 44 LYS HB3 1 44 LYS HE3 . . 4.220 3.886 3.796 3.962 . 0 0 "[ . 1 . 2]" 1
1291 1 44 LYS HB2 1 44 LYS HE3 . . 4.920 4.814 4.717 4.913 . 0 0 "[ . 1 . 2]" 1
1292 1 41 LEU HB2 1 112 ILE MD . . 5.150 4.540 4.310 4.765 . 0 0 "[ . 1 . 2]" 1
1293 1 36 PHE HB3 1 41 LEU HB3 . . 4.380 3.196 2.855 3.629 . 0 0 "[ . 1 . 2]" 1
1294 1 36 PHE HB2 1 41 LEU HB3 . . 5.170 4.814 4.529 5.172 0.002 7 0 "[ . 1 . 2]" 1
1295 1 36 PHE HA 1 41 LEU HB3 . . 5.100 3.530 3.324 3.735 . 0 0 "[ . 1 . 2]" 1
1296 1 36 PHE HA 1 41 LEU HB2 . . 4.820 2.157 2.000 2.410 . 0 0 "[ . 1 . 2]" 1
1297 1 36 PHE QD 1 41 LEU HB3 . . 4.800 2.365 1.999 3.082 . 0 0 "[ . 1 . 2]" 1
1298 1 36 PHE QD 1 41 LEU HB2 . . 4.590 2.187 1.998 2.513 . 0 0 "[ . 1 . 2]" 1
1299 1 31 ASP QB 1 34 LYS HG2 . . 4.790 2.523 1.945 3.598 . 0 0 "[ . 1 . 2]" 1
1300 1 31 ASP QB 1 34 LYS HG3 . . 4.790 2.545 1.914 4.626 . 0 0 "[ . 1 . 2]" 1
1301 1 31 ASP QB 1 34 LYS HB2 . . 3.370 1.868 1.780 2.031 . 0 0 "[ . 1 . 2]" 1
1302 1 31 ASP QB 1 34 LYS HB3 . . 3.370 3.141 3.021 3.373 0.003 6 0 "[ . 1 . 2]" 1
1303 1 81 ARG HB2 1 81 ARG HD2 . . 4.050 2.673 2.227 3.100 . 0 0 "[ . 1 . 2]" 1
1304 1 81 ARG HB2 1 81 ARG HD3 . . 4.050 2.439 2.110 2.887 . 0 0 "[ . 1 . 2]" 1
1305 1 81 ARG HB3 1 81 ARG HD2 . . 4.050 3.673 3.284 4.001 . 0 0 "[ . 1 . 2]" 1
1306 1 81 ARG HB3 1 81 ARG HD3 . . 4.050 3.062 2.690 3.431 . 0 0 "[ . 1 . 2]" 1
1307 1 81 ARG HD2 1 87 GLU HE2 . . 5.500 4.682 4.072 5.395 . 0 0 "[ . 1 . 2]" 1
1308 1 81 ARG HD3 1 87 GLU HE2 . . 5.500 5.313 4.894 5.501 0.001 15 0 "[ . 1 . 2]" 1
1309 1 81 ARG HD2 1 81 ARG QH2 . . 4.540 2.266 1.940 2.703 . 0 0 "[ . 1 . 2]" 1
1310 1 81 ARG HD3 1 81 ARG QH2 . . 4.540 2.402 1.941 3.425 . 0 0 "[ . 1 . 2]" 1
1311 1 104 GLY HA3 1 105 ILE MG . . 4.520 4.372 4.235 4.490 . 0 0 "[ . 1 . 2]" 1
1312 1 104 GLY HA3 1 107 GLU HB2 . . 4.890 3.609 3.370 3.830 . 0 0 "[ . 1 . 2]" 1
1313 1 63 PHE QD 1 104 GLY HA3 . . 3.970 3.396 2.894 3.797 . 0 0 "[ . 1 . 2]" 1
1314 1 63 PHE QD 1 104 GLY HA2 . . 3.840 2.798 2.009 3.365 . 0 0 "[ . 1 . 2]" 1
1315 1 63 PHE QE 1 104 GLY HA3 . . 4.780 3.813 3.032 4.629 . 0 0 "[ . 1 . 2]" 1
1316 1 63 PHE HB2 1 102 LYS HD3 . . 4.830 4.533 3.673 4.866 0.036 14 0 "[ . 1 . 2]" 1
1317 1 63 PHE HB3 1 102 LYS HB2 . . 4.250 3.225 2.093 3.960 . 0 0 "[ . 1 . 2]" 1
1318 1 63 PHE HB2 1 102 LYS HB2 . . 4.690 4.196 2.758 4.692 0.002 7 0 "[ . 1 . 2]" 1
1319 1 63 PHE HB3 1 102 LYS HB3 . . 4.250 2.343 1.997 3.652 . 0 0 "[ . 1 . 2]" 1
1320 1 63 PHE HB2 1 102 LYS HB3 . . 4.690 3.180 2.549 3.647 . 0 0 "[ . 1 . 2]" 1
1321 1 63 PHE HB3 1 64 ILE HA . . 5.400 4.559 4.273 5.091 . 0 0 "[ . 1 . 2]" 1
1322 1 63 PHE HB2 1 64 ILE HA . . 5.310 4.784 4.298 5.284 . 0 0 "[ . 1 . 2]" 1
1323 1 63 PHE HB3 1 65 GLU HE2 . . 5.500 4.795 3.777 5.502 0.002 11 0 "[ . 1 . 2]" 1
1324 1 63 PHE HB2 1 65 GLU HE2 . . 4.710 3.532 2.511 4.482 . 0 0 "[ . 1 . 2]" 1
1325 1 11 VAL HB 1 12 LEU QB . . 4.770 3.988 3.725 4.174 . 0 0 "[ . 1 . 2]" 1
1326 1 92 LEU MD2 1 101 GLY HA2 . . 4.030 2.931 2.200 3.477 . 0 0 "[ . 1 . 2]" 1
1327 1 92 LEU HG 1 101 GLY HA2 . . 5.440 4.876 4.037 5.442 0.002 6 0 "[ . 1 . 2]" 1
1328 1 28 GLY HA2 1 86 ALA MB . . 4.850 4.591 4.201 4.850 0.000 6 0 "[ . 1 . 2]" 1
1329 1 28 GLY HA3 1 86 ALA MB . . 5.500 5.391 4.916 5.503 0.003 19 0 "[ . 1 . 2]" 1
1330 1 28 GLY HA2 1 87 GLU HG2 . . 4.550 3.139 2.624 3.351 . 0 0 "[ . 1 . 2]" 1
1331 1 28 GLY HA3 1 87 GLU HG2 . . 5.000 4.825 4.354 5.002 0.002 13 0 "[ . 1 . 2]" 1
1332 1 28 GLY HA2 1 87 GLU HG3 . . 4.550 2.760 2.333 3.093 . 0 0 "[ . 1 . 2]" 1
1333 1 28 GLY HA3 1 87 GLU HG3 . . 5.000 4.403 3.828 4.834 . 0 0 "[ . 1 . 2]" 1
1334 1 95 GLY HA3 1 103 ILE HG12 . . 4.780 4.015 3.528 4.486 . 0 0 "[ . 1 . 2]" 1
1335 1 94 ALA MB 1 95 GLY HA3 . . 4.740 3.984 3.814 4.149 . 0 0 "[ . 1 . 2]" 1
1336 1 94 ALA MB 1 95 GLY HA2 . . 4.640 3.946 3.815 4.118 . 0 0 "[ . 1 . 2]" 1
1337 1 95 GLY HA3 1 111 MET HB2 . . 5.070 4.207 3.769 4.487 . 0 0 "[ . 1 . 2]" 1
1338 1 95 GLY HA2 1 111 MET HB2 . . 5.050 3.795 3.297 4.109 . 0 0 "[ . 1 . 2]" 1
1339 1 95 GLY HA2 1 111 MET HG2 . . 4.490 4.096 3.837 4.493 0.003 10 0 "[ . 1 . 2]" 1
1340 1 95 GLY HA2 1 111 MET HG3 . . 5.310 4.982 4.823 5.310 0.000 14 0 "[ . 1 . 2]" 1
1341 1 113 LYS HG2 1 114 GLY QA . . 4.610 4.102 3.711 4.351 . 0 0 "[ . 1 . 2]" 1
1342 1 113 LYS HG3 1 114 GLY QA . . 4.610 4.408 4.279 4.547 . 0 0 "[ . 1 . 2]" 1
1343 1 113 LYS H 1 114 GLY QA . . 4.810 4.525 4.379 4.674 . 0 0 "[ . 1 . 2]" 1
1344 1 82 ALA HA 1 83 LEU H . . 3.220 2.243 2.189 2.337 . 0 0 "[ . 1 . 2]" 1
1345 1 56 ILE MG 1 57 ASP HA . . 4.160 3.858 3.497 4.117 . 0 0 "[ . 1 . 2]" 1
1346 1 57 ASP HA 1 68 GLU HB3 . . 4.970 4.467 3.361 4.978 0.008 19 0 "[ . 1 . 2]" 1
1347 1 57 ASP HA 1 58 GLN HG3 . . 4.120 3.898 3.631 4.064 . 0 0 "[ . 1 . 2]" 1
1348 1 57 ASP HA 1 58 GLN HA . . 4.530 4.428 4.408 4.465 . 0 0 "[ . 1 . 2]" 1
1349 1 57 ASP HA 1 58 GLN H . . 3.090 2.279 2.275 2.328 . 0 0 "[ . 1 . 2]" 1
1350 1 80 ALA HA 1 81 ARG H . . 3.010 2.437 2.235 2.744 . 0 0 "[ . 1 . 2]" 1
1351 1 30 PHE QD 1 31 ASP HA . . 4.810 4.007 3.239 4.517 . 0 0 "[ . 1 . 2]" 1
1352 1 31 ASP HA 1 34 LYS H . . 5.500 4.196 3.897 4.669 . 0 0 "[ . 1 . 2]" 1
1353 1 12 LEU HA 1 12 LEU HG . . 4.110 2.956 2.704 3.270 . 0 0 "[ . 1 . 2]" 1
1354 1 12 LEU HA 1 13 LYS H . . 3.520 2.673 2.549 2.706 . 0 0 "[ . 1 . 2]" 1
1355 1 96 ASP HA 1 97 SER H . . 3.280 2.293 2.252 2.419 . 0 0 "[ . 1 . 2]" 1
1356 1 71 LEU HA 1 71 LEU MD1 . . 4.020 3.845 3.649 3.950 . 0 0 "[ . 1 . 2]" 1
1357 1 71 LEU HA 1 71 LEU HB3 . . 2.990 2.414 2.321 2.510 . 0 0 "[ . 1 . 2]" 1
1358 1 74 GLN HG2 1 78 ALA HA . . 5.100 4.187 3.563 4.634 . 0 0 "[ . 1 . 2]" 1
1359 1 78 ALA HA 1 80 ALA H . . 4.380 3.932 3.685 4.293 . 0 0 "[ . 1 . 2]" 1
1360 1 53 PHE HA 1 54 ALA HA . . 4.770 4.692 4.669 4.775 0.005 13 0 "[ . 1 . 2]" 1
1361 1 53 PHE QD 1 54 ALA HA . . 4.240 3.107 2.733 3.634 . 0 0 "[ . 1 . 2]" 1
1362 1 54 ALA HA 1 57 ASP H . . 4.270 3.655 3.280 4.181 . 0 0 "[ . 1 . 2]" 1
1363 1 27 ALA HA 1 87 GLU HE2 . . 4.620 3.635 3.282 4.124 . 0 0 "[ . 1 . 2]" 1
1364 1 27 ALA HA 1 28 GLY HA2 . . 4.540 4.435 4.389 4.499 . 0 0 "[ . 1 . 2]" 1
1365 1 27 ALA HA 1 81 ARG HH11 . . 4.740 2.568 1.947 3.422 . 0 0 "[ . 1 . 2]" 1
1366 1 27 ALA HA 1 81 ARG QH2 . . 4.260 2.344 1.929 3.519 . 0 0 "[ . 1 . 2]" 1
1367 1 27 ALA HA 1 81 ARG HE . . 5.110 4.687 4.158 5.110 . 0 0 "[ . 1 . 2]" 1
1368 1 27 ALA HA 1 28 GLY H . . 2.970 2.284 2.189 2.407 . 0 0 "[ . 1 . 2]" 1
1369 1 27 ALA HA 1 30 PHE H . . 4.710 4.567 4.129 4.711 0.001 13 0 "[ . 1 . 2]" 1
1370 1 44 LYS HA 1 44 LYS HD3 . . 3.780 2.108 2.068 2.204 . 0 0 "[ . 1 . 2]" 1
1371 1 44 LYS HA 1 44 LYS HE2 . . 4.610 4.432 4.389 4.501 . 0 0 "[ . 1 . 2]" 1
1372 1 44 LYS HA 1 44 LYS HE3 . . 4.970 4.481 4.437 4.554 . 0 0 "[ . 1 . 2]" 1
1373 1 44 LYS HA 1 45 SER H . . 3.370 2.713 2.596 2.780 . 0 0 "[ . 1 . 2]" 1
1374 1 20 ALA HA 1 38 ALA MB . . 3.100 2.911 2.188 3.103 0.003 6 0 "[ . 1 . 2]" 1
1375 1 20 ALA HA 1 23 GLY H . . 4.370 3.283 3.002 3.504 . 0 0 "[ . 1 . 2]" 1
1376 1 73 LEU MD1 1 83 LEU HA . . 4.780 4.015 3.597 4.774 . 0 0 "[ . 1 . 2]" 1
1377 1 83 LEU HA 1 83 LEU HG . . 4.200 3.559 2.783 3.678 . 0 0 "[ . 1 . 2]" 1
1378 1 83 LEU HA 1 87 GLU HE2 . . 4.480 2.673 2.115 3.355 . 0 0 "[ . 1 . 2]" 1
1379 1 81 ARG QH2 1 83 LEU HA . . 4.110 2.831 2.140 3.549 . 0 0 "[ . 1 . 2]" 1
1380 1 52 ALA HA 1 55 ILE MD . . 3.580 3.250 1.960 3.641 0.061 2 0 "[ . 1 . 2]" 1
1381 1 52 ALA HA 1 55 ILE HG12 . . 4.970 2.234 1.975 3.404 . 0 0 "[ . 1 . 2]" 1
1382 1 11 VAL MG2 1 52 ALA HA . . 4.350 3.485 2.850 3.853 . 0 0 "[ . 1 . 2]" 1
1383 1 8 PHE QE 1 52 ALA HA . . 3.930 3.194 2.735 3.693 . 0 0 "[ . 1 . 2]" 1
1384 1 8 PHE HZ 1 52 ALA HA . . 4.010 3.395 2.875 4.012 0.002 9 0 "[ . 1 . 2]" 1
1385 1 52 ALA HA 1 55 ILE H . . 4.090 3.332 2.930 3.730 . 0 0 "[ . 1 . 2]" 1
1386 1 52 ALA HA 1 108 PHE QE . . 5.300 4.968 4.721 5.278 . 0 0 "[ . 1 . 2]" 1
1387 1 38 ALA H 1 38 ALA HA . . 2.880 2.860 2.768 2.887 0.007 12 0 "[ . 1 . 2]" 1
1388 1 90 ALA HA 1 93 LYS HB2 . . 3.490 3.432 3.121 3.494 0.004 19 0 "[ . 1 . 2]" 1
1389 1 89 LYS HB3 1 90 ALA HA . . 4.140 4.081 3.948 4.142 0.002 17 0 "[ . 1 . 2]" 1
1390 1 90 ALA HA 1 93 LYS H . . 4.090 3.777 3.542 4.081 . 0 0 "[ . 1 . 2]" 1
1391 1 19 ALA HA 1 22 ASP HB3 . . 3.320 3.060 2.759 3.321 0.001 11 0 "[ . 1 . 2]" 1
1392 1 109 ALA HA 1 112 ILE MD . . 3.740 1.963 1.917 2.063 . 0 0 "[ . 1 . 2]" 1
1393 1 109 ALA HA 1 112 ILE MG . . 4.520 4.036 3.508 4.370 . 0 0 "[ . 1 . 2]" 1
1394 1 109 ALA HA 1 112 ILE HG13 . . 4.850 2.373 2.007 3.015 . 0 0 "[ . 1 . 2]" 1
1395 1 49 VAL MG1 1 109 ALA HA . . 3.140 1.975 1.926 2.068 . 0 0 "[ . 1 . 2]" 1
1396 1 109 ALA HA 1 112 ILE H . . 4.030 3.555 3.495 3.595 . 0 0 "[ . 1 . 2]" 1
1397 1 55 ILE MG 1 75 ASN HA . . 4.450 3.293 2.252 3.613 . 0 0 "[ . 1 . 2]" 1
1398 1 8 PHE QD 1 75 ASN HA . . 4.960 4.835 4.668 4.959 . 0 0 "[ . 1 . 2]" 1
1399 1 24 CYS HA 1 26 ALA MB . . 5.270 4.215 3.748 4.550 . 0 0 "[ . 1 . 2]" 1
1400 1 24 CYS HA 1 29 SER HG . . 4.810 3.949 2.386 4.811 0.001 17 0 "[ . 1 . 2]" 1
1401 1 81 ARG HA 1 81 ARG HG3 . . 3.710 3.607 3.583 3.625 . 0 0 "[ . 1 . 2]" 1
1402 1 81 ARG HA 1 81 ARG HD2 . . 5.020 4.473 4.102 4.910 . 0 0 "[ . 1 . 2]" 1
1403 1 81 ARG HA 1 81 ARG HD3 . . 5.020 4.581 4.044 5.019 . 0 0 "[ . 1 . 2]" 1
1404 1 81 ARG HA 1 82 ALA H . . 2.820 2.696 2.445 2.824 0.004 13 0 "[ . 1 . 2]" 1
1405 1 86 ALA HA 1 89 LYS HB2 . . 3.380 2.167 2.000 2.328 . 0 0 "[ . 1 . 2]" 1
1406 1 86 ALA HA 1 89 LYS HB3 . . 3.750 3.663 3.541 3.751 0.001 17 0 "[ . 1 . 2]" 1
1407 1 13 LYS HA 1 13 LYS HG2 . . 3.900 3.117 2.568 3.650 . 0 0 "[ . 1 . 2]" 1
1408 1 13 LYS HA 1 13 LYS HG3 . . 3.900 3.104 2.147 3.882 . 0 0 "[ . 1 . 2]" 1
1409 1 63 PHE HA 1 64 ILE MD . . 5.500 4.911 4.585 5.361 . 0 0 "[ . 1 . 2]" 1
1410 1 63 PHE HA 1 104 GLY HA3 . . 4.740 4.654 4.042 4.745 0.005 7 0 "[ . 1 . 2]" 1
1411 1 63 PHE HA 1 104 GLY HA2 . . 3.840 3.071 2.470 3.217 . 0 0 "[ . 1 . 2]" 1
1412 1 53 PHE QE 1 63 PHE HA . . 4.000 3.438 2.926 3.995 . 0 0 "[ . 1 . 2]" 1
1413 1 53 PHE HZ 1 63 PHE HA . . 3.260 2.216 1.999 3.086 . 0 0 "[ . 1 . 2]" 1
1414 1 63 PHE HA 1 105 ILE H . . 5.500 5.231 4.772 5.502 0.002 17 0 "[ . 1 . 2]" 1
1415 1 63 PHE HA 1 64 ILE H . . 3.350 2.544 2.193 2.769 . 0 0 "[ . 1 . 2]" 1
1416 1 21 LEU MD1 1 77 LYS HA . . 5.090 4.822 4.668 5.093 0.003 16 0 "[ . 1 . 2]" 1
1417 1 21 LEU MD2 1 77 LYS HA . . 5.500 5.501 5.492 5.505 0.005 20 0 "[ . 1 . 2]" 1
1418 1 77 LYS HA 1 77 LYS QG . . 3.260 2.275 1.993 2.645 . 0 0 "[ . 1 . 2]" 1
1419 1 77 LYS HA 1 77 LYS QE . . 5.130 4.011 1.970 4.888 . 0 0 "[ . 1 . 2]" 1
1420 1 69 LEU HA 1 69 LEU MD2 . . 3.380 1.963 1.898 1.999 . 0 0 "[ . 1 . 2]" 1
1421 1 56 ILE MG 1 69 LEU HA . . 4.490 4.292 3.872 4.508 0.018 6 0 "[ . 1 . 2]" 1
1422 1 69 LEU HA 1 72 PHE HB2 . . 4.250 3.346 2.923 3.715 . 0 0 "[ . 1 . 2]" 1
1423 1 69 LEU HA 1 91 PHE HB3 . . 5.500 5.406 4.914 5.504 0.004 17 0 "[ . 1 . 2]" 1
1424 1 69 LEU HA 1 91 PHE QE . . 5.400 4.228 3.157 5.290 . 0 0 "[ . 1 . 2]" 1
1425 1 69 LEU HA 1 72 PHE QD . . 5.230 4.826 4.481 5.132 . 0 0 "[ . 1 . 2]" 1
1426 1 69 LEU HA 1 71 LEU H . . 4.380 3.680 3.575 4.036 . 0 0 "[ . 1 . 2]" 1
1427 1 69 LEU HA 1 72 PHE H . . 4.650 4.149 3.994 4.317 . 0 0 "[ . 1 . 2]" 1
1428 1 60 LYS HA 1 60 LYS QG . . 3.260 3.132 2.406 3.215 . 0 0 "[ . 1 . 2]" 1
1429 1 60 LYS HA 1 60 LYS HD3 . . 3.940 3.373 2.426 4.002 0.062 15 0 "[ . 1 . 2]" 1
1430 1 59 ASP H 1 60 LYS HA . . 4.910 4.352 4.137 4.923 0.013 17 0 "[ . 1 . 2]" 1
1431 1 74 GLN HA 1 80 ALA MB . . 3.410 2.338 1.944 2.794 . 0 0 "[ . 1 . 2]" 1
1432 1 74 GLN HA 1 74 GLN HG2 . . 3.510 2.372 2.202 2.609 . 0 0 "[ . 1 . 2]" 1
1433 1 74 GLN HA 1 77 LYS H . . 3.980 3.402 3.353 3.475 . 0 0 "[ . 1 . 2]" 1
1434 1 74 GLN HA 1 80 ALA H . . 4.210 2.961 2.640 3.606 . 0 0 "[ . 1 . 2]" 1
1435 1 112 ILE MG 1 113 LYS HA . . 5.480 5.411 5.355 5.452 . 0 0 "[ . 1 . 2]" 1
1436 1 113 LYS HA 1 113 LYS HG2 . . 3.590 3.530 3.462 3.613 0.023 6 0 "[ . 1 . 2]" 1
1437 1 113 LYS HA 1 113 LYS HG3 . . 3.590 2.451 2.345 2.497 . 0 0 "[ . 1 . 2]" 1
1438 1 113 LYS HA 1 113 LYS QE . . 4.820 4.180 2.917 4.822 0.002 8 0 "[ . 1 . 2]" 1
1439 1 65 GLU HA 1 102 LYS HB2 . . 4.580 4.277 2.697 4.582 0.002 6 0 "[ . 1 . 2]" 1
1440 1 65 GLU HA 1 102 LYS HB3 . . 4.580 3.002 2.019 3.535 . 0 0 "[ . 1 . 2]" 1
1441 1 65 GLU HA 1 65 GLU HG2 . . 3.940 3.398 2.775 3.583 . 0 0 "[ . 1 . 2]" 1
1442 1 65 GLU HA 1 65 GLU HG3 . . 3.940 2.349 2.218 2.641 . 0 0 "[ . 1 . 2]" 1
1443 1 63 PHE HB2 1 65 GLU HA . . 5.050 4.931 4.568 5.056 0.006 14 0 "[ . 1 . 2]" 1
1444 1 65 GLU HA 1 66 GLU H . . 3.370 2.502 2.387 2.642 . 0 0 "[ . 1 . 2]" 1
1445 1 106 ASP HA 1 109 ALA MB . . 3.290 3.020 2.869 3.187 . 0 0 "[ . 1 . 2]" 1
1446 1 106 ASP HA 1 109 ALA H . . 4.140 3.774 3.645 3.900 . 0 0 "[ . 1 . 2]" 1
1447 1 73 LEU HA 1 73 LEU MD1 . . 4.550 3.753 3.649 3.919 . 0 0 "[ . 1 . 2]" 1
1448 1 73 LEU HA 1 76 PHE HB2 . . 4.620 4.053 3.706 4.301 . 0 0 "[ . 1 . 2]" 1
1449 1 73 LEU HA 1 76 PHE QE . . 5.040 4.178 3.297 4.993 . 0 0 "[ . 1 . 2]" 1
1450 1 73 LEU HA 1 76 PHE QD . . 3.330 2.841 2.100 3.334 0.004 11 0 "[ . 1 . 2]" 1
1451 1 91 PHE HA 1 94 ALA MB . . 3.610 2.052 1.946 2.223 . 0 0 "[ . 1 . 2]" 1
1452 1 91 PHE HA 1 91 PHE QD . . 3.480 2.005 1.987 2.100 . 0 0 "[ . 1 . 2]" 1
1453 1 91 PHE HA 1 94 ALA H . . 4.250 3.511 3.357 3.725 . 0 0 "[ . 1 . 2]" 1
1454 1 41 LEU HA 1 41 LEU MD2 . . 3.190 2.291 1.988 2.571 . 0 0 "[ . 1 . 2]" 1
1455 1 41 LEU HA 1 44 LYS HG2 . . 4.050 2.584 2.012 3.242 . 0 0 "[ . 1 . 2]" 1
1456 1 41 LEU HA 1 41 LEU HG . . 3.130 2.574 2.384 2.809 . 0 0 "[ . 1 . 2]" 1
1457 1 41 LEU HA 1 44 LYS HB3 . . 4.000 3.497 3.218 4.013 0.013 12 0 "[ . 1 . 2]" 1
1458 1 41 LEU HA 1 44 LYS HE2 . . 4.670 4.276 3.403 4.675 0.005 16 0 "[ . 1 . 2]" 1
1459 1 22 ASP HA 1 25 LYS QD . . 3.950 3.562 1.991 3.952 0.002 6 0 "[ . 1 . 2]" 1
1460 1 22 ASP HA 1 25 LYS HB2 . . 3.950 2.808 2.000 3.943 . 0 0 "[ . 1 . 2]" 1
1461 1 22 ASP HA 1 25 LYS HB3 . . 3.950 3.339 2.095 3.953 0.003 7 0 "[ . 1 . 2]" 1
1462 1 22 ASP HA 1 22 ASP HB2 . . 2.820 2.640 2.572 2.685 . 0 0 "[ . 1 . 2]" 1
1463 1 68 GLU HA 1 71 LEU MD1 . . 3.870 2.423 1.954 3.425 . 0 0 "[ . 1 . 2]" 1
1464 1 68 GLU HA 1 71 LEU HB2 . . 3.970 2.566 2.064 3.023 . 0 0 "[ . 1 . 2]" 1
1465 1 68 GLU HA 1 71 LEU HB3 . . 4.250 4.042 3.645 4.244 . 0 0 "[ . 1 . 2]" 1
1466 1 68 GLU HA 1 68 GLU HG2 . . 3.440 2.382 2.151 3.428 . 0 0 "[ . 1 . 2]" 1
1467 1 68 GLU HA 1 68 GLU HG3 . . 3.440 2.945 2.214 3.340 . 0 0 "[ . 1 . 2]" 1
1468 1 21 LEU HA 1 21 LEU MD1 . . 4.030 3.816 3.761 3.888 . 0 0 "[ . 1 . 2]" 1
1469 1 21 LEU HA 1 21 LEU HG . . 3.730 2.568 2.416 2.753 . 0 0 "[ . 1 . 2]" 1
1470 1 21 LEU HA 1 35 PHE QE . . 3.950 2.728 2.116 3.506 . 0 0 "[ . 1 . 2]" 1
1471 1 21 LEU HA 1 35 PHE QD . . 4.840 4.470 3.676 4.802 . 0 0 "[ . 1 . 2]" 1
1472 1 45 SER HA 1 46 THR H . . 3.490 2.312 2.281 2.403 . 0 0 "[ . 1 . 2]" 1
1473 1 46 THR MG 1 47 ASP HA . . 4.270 3.615 2.962 4.163 . 0 0 "[ . 1 . 2]" 1
1474 1 47 ASP HA 1 50 LYS QD . . 3.510 2.391 1.996 2.629 . 0 0 "[ . 1 . 2]" 1
1475 1 47 ASP HA 1 50 LYS HB2 . . 4.180 3.786 3.429 4.179 . 0 0 "[ . 1 . 2]" 1
1476 1 47 ASP HA 1 50 LYS H . . 3.940 3.836 3.712 3.942 0.002 17 0 "[ . 1 . 2]" 1
1477 1 14 ASP HA 1 17 VAL MG2 . . 3.700 2.000 1.881 2.141 . 0 0 "[ . 1 . 2]" 1
1478 1 14 ASP HA 1 17 VAL MG1 . . 3.670 3.340 2.926 3.664 . 0 0 "[ . 1 . 2]" 1
1479 1 14 ASP HA 1 17 VAL H . . 4.050 3.763 3.476 3.943 . 0 0 "[ . 1 . 2]" 1
1480 1 14 ASP HA 1 18 THR H . . 4.430 3.867 3.589 4.338 . 0 0 "[ . 1 . 2]" 1
1481 1 111 MET HA 1 113 LYS H . . 5.050 4.760 4.558 5.003 . 0 0 "[ . 1 . 2]" 1
1482 1 92 LEU HA 1 92 LEU HG . . 3.840 3.208 3.083 3.319 . 0 0 "[ . 1 . 2]" 1
1483 1 92 LEU HA 1 95 GLY H . . 4.720 3.757 3.454 4.133 . 0 0 "[ . 1 . 2]" 1
1484 1 107 GLU HA 1 107 GLU HB3 . . 2.910 2.663 2.537 2.732 . 0 0 "[ . 1 . 2]" 1
1485 1 107 GLU HA 1 107 GLU HG3 . . 3.050 2.407 2.245 2.726 . 0 0 "[ . 1 . 2]" 1
1486 1 20 ALA MB 1 39 CYS HA . . 3.990 3.774 2.858 3.991 0.001 12 0 "[ . 1 . 2]" 1
1487 1 85 ASP HA 1 88 THR MG . . 4.460 4.263 3.837 4.464 0.004 17 0 "[ . 1 . 2]" 1
1488 1 85 ASP HA 1 89 LYS QG . . 4.670 4.304 3.765 4.671 0.001 17 0 "[ . 1 . 2]" 1
1489 1 70 LYS QD 1 85 ASP HA . . 5.500 5.310 4.263 5.501 0.001 14 0 "[ . 1 . 2]" 1
1490 1 70 LYS QE 1 85 ASP HA . . 4.340 4.124 3.073 4.342 0.002 16 0 "[ . 1 . 2]" 1
1491 1 85 ASP HA 1 88 THR H . . 4.620 3.901 3.614 4.214 . 0 0 "[ . 1 . 2]" 1
1492 1 37 LYS HA 1 37 LYS HG2 . . 3.590 2.487 2.122 2.808 . 0 0 "[ . 1 . 2]" 1
1493 1 37 LYS HA 1 37 LYS HG3 . . 3.590 2.925 2.300 3.577 . 0 0 "[ . 1 . 2]" 1
1494 1 37 LYS HA 1 42 SER HB2 . . 3.660 3.057 2.093 3.661 0.001 17 0 "[ . 1 . 2]" 1
1495 1 37 LYS HA 1 42 SER HB3 . . 3.660 2.473 2.000 3.662 0.002 19 0 "[ . 1 . 2]" 1
1496 1 37 LYS HA 1 42 SER H . . 4.200 3.049 2.614 3.466 . 0 0 "[ . 1 . 2]" 1
1497 1 92 LEU MD2 1 93 LYS HA . . 4.870 4.662 4.386 4.876 0.006 8 0 "[ . 1 . 2]" 1
1498 1 93 LYS HA 1 93 LYS HG2 . . 3.370 2.317 1.989 3.325 . 0 0 "[ . 1 . 2]" 1
1499 1 93 LYS HA 1 93 LYS HG3 . . 3.370 2.802 2.030 3.377 0.007 15 0 "[ . 1 . 2]" 1
1500 1 93 LYS HA 1 93 LYS HB3 . . 3.010 2.714 2.675 2.783 . 0 0 "[ . 1 . 2]" 1
1501 1 93 LYS HA 1 96 ASP HB2 . . 4.430 4.201 3.874 4.433 0.003 6 0 "[ . 1 . 2]" 1
1502 1 93 LYS HA 1 96 ASP HB3 . . 4.430 3.034 2.662 3.356 . 0 0 "[ . 1 . 2]" 1
1503 1 93 LYS HA 1 93 LYS QE . . 4.880 4.267 2.947 4.754 . 0 0 "[ . 1 . 2]" 1
1504 1 86 ALA MB 1 87 GLU HA . . 3.800 3.700 3.584 3.791 . 0 0 "[ . 1 . 2]" 1
1505 1 87 GLU HA 1 90 ALA MB . . 3.440 3.011 2.547 3.441 0.001 16 0 "[ . 1 . 2]" 1
1506 1 28 GLY HA2 1 87 GLU HA . . 5.430 5.068 4.637 5.395 . 0 0 "[ . 1 . 2]" 1
1507 1 87 GLU HA 1 88 THR HA . . 5.500 4.761 4.647 4.822 . 0 0 "[ . 1 . 2]" 1
1508 1 87 GLU HA 1 90 ALA H . . 4.100 3.542 3.245 4.044 . 0 0 "[ . 1 . 2]" 1
1509 1 16 GLU HA 1 16 GLU QG . . 2.860 2.478 2.239 2.860 . 0 0 "[ . 1 . 2]" 1
1510 1 34 LYS HA 1 34 LYS HG2 . . 3.840 2.862 2.039 3.598 . 0 0 "[ . 1 . 2]" 1
1511 1 34 LYS HA 1 34 LYS HG3 . . 3.840 3.422 2.093 3.794 . 0 0 "[ . 1 . 2]" 1
1512 1 34 LYS HA 1 34 LYS QE . . 5.030 3.431 1.932 4.263 . 0 0 "[ . 1 . 2]" 1
1513 1 17 VAL MG2 1 76 PHE HA . . 4.340 4.214 3.871 4.345 0.005 9 0 "[ . 1 . 2]" 1
1514 1 8 PHE QD 1 76 PHE HA . . 4.090 2.679 2.209 3.092 . 0 0 "[ . 1 . 2]" 1
1515 1 76 PHE HA 1 76 PHE QD . . 3.930 2.669 2.438 3.117 . 0 0 "[ . 1 . 2]" 1
1516 1 33 LYS HA 1 33 LYS HG2 . . 4.060 2.921 2.085 4.081 0.021 12 0 "[ . 1 . 2]" 1
1517 1 33 LYS HA 1 33 LYS HG3 . . 4.060 3.394 2.484 3.959 . 0 0 "[ . 1 . 2]" 1
1518 1 33 LYS HA 1 36 PHE HB2 . . 4.080 3.080 2.679 3.208 . 0 0 "[ . 1 . 2]" 1
1519 1 33 LYS HA 1 36 PHE QD . . 3.930 2.760 2.154 3.285 . 0 0 "[ . 1 . 2]" 1
1520 1 26 ALA MB 1 29 SER HA . . 4.810 4.496 4.133 4.811 0.001 5 0 "[ . 1 . 2]" 1
1521 1 61 SER HA 1 65 GLU HE2 . . 5.340 5.245 4.887 5.342 0.002 3 0 "[ . 1 . 2]" 1
1522 1 103 ILE HA 1 103 ILE MD . . 3.880 3.608 3.583 3.677 . 0 0 "[ . 1 . 2]" 1
1523 1 103 ILE HA 1 103 ILE HG12 . . 3.800 2.176 2.132 2.248 . 0 0 "[ . 1 . 2]" 1
1524 1 103 ILE HA 1 103 ILE MG . . 3.530 2.660 2.594 2.713 . 0 0 "[ . 1 . 2]" 1
1525 1 103 ILE HA 1 103 ILE HG13 . . 3.920 2.982 2.883 3.070 . 0 0 "[ . 1 . 2]" 1
1526 1 103 ILE HA 1 107 GLU HB2 . . 4.030 3.173 2.782 3.475 . 0 0 "[ . 1 . 2]" 1
1527 1 103 ILE HA 1 107 GLU HB3 . . 4.010 3.532 3.231 4.005 . 0 0 "[ . 1 . 2]" 1
1528 1 89 LYS HA 1 92 LEU HB2 . . 3.960 3.409 3.038 3.954 . 0 0 "[ . 1 . 2]" 1
1529 1 89 LYS HA 1 89 LYS QG . . 3.080 2.194 2.018 2.421 . 0 0 "[ . 1 . 2]" 1
1530 1 89 LYS HA 1 92 LEU H . . 3.530 3.283 3.018 3.529 . 0 0 "[ . 1 . 2]" 1
1531 1 48 GLU HA 1 48 GLU HB3 . . 2.870 2.610 2.599 2.635 . 0 0 "[ . 1 . 2]" 1
1532 1 58 GLN HA 1 58 GLN HG2 . . 3.300 2.586 2.457 2.967 . 0 0 "[ . 1 . 2]" 1
1533 1 58 GLN HA 1 58 GLN HG3 . . 3.930 3.235 2.668 3.401 . 0 0 "[ . 1 . 2]" 1
1534 1 70 LYS HA 1 83 LEU MD2 . . 4.040 2.172 1.955 3.064 . 0 0 "[ . 1 . 2]" 1
1535 1 70 LYS HA 1 70 LYS HG2 . . 3.850 3.587 2.532 3.849 . 0 0 "[ . 1 . 2]" 1
1536 1 70 LYS HA 1 70 LYS HG3 . . 3.850 3.535 2.688 3.856 0.006 20 0 "[ . 1 . 2]" 1
1537 1 51 LYS HA 1 54 ALA MB . . 3.340 2.853 2.531 3.188 . 0 0 "[ . 1 . 2]" 1
1538 1 51 LYS HA 1 51 LYS HG3 . . 3.850 3.700 3.530 3.846 . 0 0 "[ . 1 . 2]" 1
1539 1 51 LYS HA 1 51 LYS QE . . 4.620 3.230 1.975 4.507 . 0 0 "[ . 1 . 2]" 1
1540 1 25 LYS HA 1 25 LYS QG . . 3.560 2.599 2.148 3.324 . 0 0 "[ . 1 . 2]" 1
1541 1 24 CYS H 1 25 LYS HA . . 5.030 4.108 3.942 4.395 . 0 0 "[ . 1 . 2]" 1
1542 1 32 HIS HA 1 35 PHE HB2 . . 3.400 2.602 2.185 3.315 . 0 0 "[ . 1 . 2]" 1
1543 1 32 HIS HA 1 35 PHE HB3 . . 3.760 2.810 2.469 3.718 . 0 0 "[ . 1 . 2]" 1
1544 1 32 HIS HA 1 33 LYS HA . . 4.890 4.864 4.801 4.898 0.008 14 0 "[ . 1 . 2]" 1
1545 1 30 PHE HZ 1 32 HIS HA . . 3.850 2.989 2.331 3.499 . 0 0 "[ . 1 . 2]" 1
1546 1 30 PHE QE 1 32 HIS HA . . 4.040 3.020 2.009 3.696 . 0 0 "[ . 1 . 2]" 1
1547 1 30 PHE QD 1 32 HIS HA . . 5.200 4.439 3.882 5.004 . 0 0 "[ . 1 . 2]" 1
1548 1 32 HIS HA 1 34 LYS H . . 5.480 4.459 4.217 4.837 . 0 0 "[ . 1 . 2]" 1
1549 1 32 HIS HA 1 36 PHE QD . . 4.970 4.237 3.565 4.738 . 0 0 "[ . 1 . 2]" 1
1550 1 32 HIS HA 1 36 PHE QE . . 5.390 4.313 3.729 4.993 . 0 0 "[ . 1 . 2]" 1
1551 1 32 HIS HA 1 35 PHE H . . 4.080 3.358 3.059 3.825 . 0 0 "[ . 1 . 2]" 1
1552 1 32 HIS HA 1 36 PHE H . . 4.430 3.874 3.568 4.279 . 0 0 "[ . 1 . 2]" 1
1553 1 67 GLU HA 1 67 GLU QB . . 2.680 2.377 2.321 2.517 . 0 0 "[ . 1 . 2]" 1
1554 1 67 GLU HA 1 67 GLU HG2 . . 3.470 2.649 2.136 3.471 0.001 18 0 "[ . 1 . 2]" 1
1555 1 67 GLU HA 1 67 GLU HG3 . . 3.470 3.097 2.521 3.460 . 0 0 "[ . 1 . 2]" 1
1556 1 67 GLU HA 1 70 LYS H . . 4.140 3.876 3.557 4.127 . 0 0 "[ . 1 . 2]" 1
1557 1 35 PHE HB3 1 36 PHE HA . . 4.170 3.856 3.726 3.994 . 0 0 "[ . 1 . 2]" 1
1558 1 36 PHE HA 1 36 PHE QD . . 3.300 2.275 1.996 2.692 . 0 0 "[ . 1 . 2]" 1
1559 1 8 PHE HA 1 55 ILE MD . . 4.190 2.817 1.965 4.192 0.002 3 0 "[ . 1 . 2]" 1
1560 1 8 PHE HA 1 11 VAL MG2 . . 3.780 2.231 2.027 2.824 . 0 0 "[ . 1 . 2]" 1
1561 1 8 PHE HA 1 11 VAL HB . . 3.980 2.536 2.001 3.747 . 0 0 "[ . 1 . 2]" 1
1562 1 8 PHE HA 1 8 PHE QD . . 3.670 2.659 2.452 3.027 . 0 0 "[ . 1 . 2]" 1
1563 1 97 SER HA 1 107 GLU HG2 . . 5.500 5.154 4.565 5.506 0.006 18 0 "[ . 1 . 2]" 1
1564 1 50 LYS HA 1 50 LYS HG2 . . 3.560 2.770 2.618 3.423 . 0 0 "[ . 1 . 2]" 1
1565 1 50 LYS HA 1 50 LYS HG3 . . 3.560 2.665 2.158 2.761 . 0 0 "[ . 1 . 2]" 1
1566 1 50 LYS HA 1 53 PHE HB2 . . 3.790 3.292 3.033 3.714 . 0 0 "[ . 1 . 2]" 1
1567 1 24 CYS HB3 1 30 PHE HA . . 3.980 2.481 2.001 3.982 0.002 18 0 "[ . 1 . 2]" 1
1568 1 24 CYS HA 1 30 PHE HA . . 4.680 2.813 2.185 3.708 . 0 0 "[ . 1 . 2]" 1
1569 1 30 PHE HA 1 31 ASP H . . 3.270 2.237 2.194 2.307 . 0 0 "[ . 1 . 2]" 1
1570 1 30 PHE HA 1 30 PHE QD . . 3.800 2.776 2.080 3.247 . 0 0 "[ . 1 . 2]" 1
1571 1 42 SER HA 1 112 ILE MG . . 3.180 2.994 2.516 3.207 0.027 10 0 "[ . 1 . 2]" 1
1572 1 42 SER HA 1 49 VAL MG2 . . 5.380 4.956 4.639 5.300 . 0 0 "[ . 1 . 2]" 1
1573 1 42 SER HA 1 112 ILE HB . . 4.570 2.463 1.991 3.060 . 0 0 "[ . 1 . 2]" 1
1574 1 108 PHE HA 1 112 ILE MG . . 5.500 5.144 3.933 5.558 0.058 13 0 "[ . 1 . 2]" 1
1575 1 108 PHE HA 1 110 ALA MB . . 5.250 4.608 4.472 4.760 . 0 0 "[ . 1 . 2]" 1
1576 1 108 PHE HA 1 111 MET HB2 . . 5.280 5.207 4.881 5.302 0.022 6 0 "[ . 1 . 2]" 1
1577 1 108 PHE HA 1 111 MET HB3 . . 4.480 4.259 3.780 4.370 . 0 0 "[ . 1 . 2]" 1
1578 1 108 PHE HA 1 111 MET HG2 . . 3.920 2.813 2.371 2.975 . 0 0 "[ . 1 . 2]" 1
1579 1 108 PHE HA 1 111 MET HG3 . . 4.270 3.972 3.614 4.080 . 0 0 "[ . 1 . 2]" 1
1580 1 108 PHE HA 1 109 ALA HA . . 4.680 4.661 4.654 4.670 . 0 0 "[ . 1 . 2]" 1
1581 1 108 PHE HA 1 108 PHE QD . . 3.560 2.739 2.477 2.918 . 0 0 "[ . 1 . 2]" 1
1582 1 66 GLU HA 1 69 LEU MD2 . . 4.700 4.425 4.149 4.707 0.007 5 0 "[ . 1 . 2]" 1
1583 1 66 GLU HA 1 69 LEU MD1 . . 3.560 2.199 1.969 2.834 . 0 0 "[ . 1 . 2]" 1
1584 1 66 GLU HA 1 88 THR MG . . 3.920 3.426 2.726 3.864 . 0 0 "[ . 1 . 2]" 1
1585 1 66 GLU HA 1 69 LEU HG . . 3.770 3.179 2.781 3.513 . 0 0 "[ . 1 . 2]" 1
1586 1 66 GLU HA 1 66 GLU HB2 . . 2.790 2.486 2.398 2.644 . 0 0 "[ . 1 . 2]" 1
1587 1 66 GLU HA 1 69 LEU HA . . 5.240 4.925 4.622 5.243 0.003 17 0 "[ . 1 . 2]" 1
1588 1 66 GLU HA 1 67 GLU HA . . 5.010 4.748 4.668 4.811 . 0 0 "[ . 1 . 2]" 1
1589 1 65 GLU HA 1 66 GLU HA . . 4.770 4.254 4.248 4.272 . 0 0 "[ . 1 . 2]" 1
1590 1 53 PHE HA 1 56 ILE HB . . 4.320 4.092 3.637 4.319 . 0 0 "[ . 1 . 2]" 1
1591 1 50 LYS HA 1 53 PHE HA . . 5.500 5.274 5.069 5.496 . 0 0 "[ . 1 . 2]" 1
1592 1 53 PHE HA 1 56 ILE H . . 4.400 3.690 3.501 3.917 . 0 0 "[ . 1 . 2]" 1
1593 1 53 PHE HA 1 108 PHE HZ . . 4.470 3.564 3.125 4.207 . 0 0 "[ . 1 . 2]" 1
1594 1 20 ALA MB 1 35 PHE HA . . 3.910 2.628 1.971 3.084 . 0 0 "[ . 1 . 2]" 1
1595 1 35 PHE HA 1 38 ALA MB . . 3.540 2.342 2.035 2.830 . 0 0 "[ . 1 . 2]" 1
1596 1 35 PHE HA 1 35 PHE QD . . 4.030 3.077 2.925 3.175 . 0 0 "[ . 1 . 2]" 1
1597 1 56 ILE MG 1 72 PHE HA . . 4.200 2.100 1.925 2.313 . 0 0 "[ . 1 . 2]" 1
1598 1 72 PHE HA 1 76 PHE QE . . 5.500 5.413 5.023 5.519 0.019 4 0 "[ . 1 . 2]" 1
1599 1 72 PHE HA 1 72 PHE QD . . 3.770 2.634 2.322 2.890 . 0 0 "[ . 1 . 2]" 1
1600 1 72 PHE HA 1 75 ASN HD21 . . 4.410 3.508 2.774 4.398 . 0 0 "[ . 1 . 2]" 1
1601 1 72 PHE HA 1 75 ASN HD22 . . 4.410 3.697 1.943 4.083 . 0 0 "[ . 1 . 2]" 1
1602 1 56 ILE HA 1 64 ILE MD . . 5.450 5.148 4.635 5.425 . 0 0 "[ . 1 . 2]" 1
1603 1 55 ILE MG 1 56 ILE HA . . 4.190 3.695 3.541 3.878 . 0 0 "[ . 1 . 2]" 1
1604 1 56 ILE HA 1 56 ILE MG . . 3.240 2.266 2.114 2.406 . 0 0 "[ . 1 . 2]" 1
1605 1 56 ILE HA 1 56 ILE HG12 . . 3.940 3.302 2.863 3.534 . 0 0 "[ . 1 . 2]" 1
1606 1 56 ILE HA 1 56 ILE HG13 . . 3.940 2.646 2.521 2.826 . 0 0 "[ . 1 . 2]" 1
1607 1 56 ILE HA 1 58 GLN HG2 . . 4.980 4.181 3.881 4.987 0.007 11 0 "[ . 1 . 2]" 1
1608 1 56 ILE HA 1 58 GLN HG3 . . 4.700 4.184 3.485 4.559 . 0 0 "[ . 1 . 2]" 1
1609 1 112 ILE HA 1 112 ILE MD . . 4.310 4.115 4.072 4.138 . 0 0 "[ . 1 . 2]" 1
1610 1 112 ILE HA 1 112 ILE HG12 . . 3.910 3.635 3.469 3.730 . 0 0 "[ . 1 . 2]" 1
1611 1 112 ILE HA 1 112 ILE MG . . 3.400 2.169 2.008 2.386 . 0 0 "[ . 1 . 2]" 1
1612 1 112 ILE HA 1 112 ILE HG13 . . 3.910 3.739 3.697 3.806 . 0 0 "[ . 1 . 2]" 1
1613 1 111 MET ME 1 112 ILE HA . . 5.500 5.486 5.278 5.534 0.034 16 0 "[ . 1 . 2]" 1
1614 1 111 MET HG2 1 112 ILE HA . . 4.890 4.699 4.032 4.858 . 0 0 "[ . 1 . 2]" 1
1615 1 111 MET HG3 1 112 ILE HA . . 5.040 3.914 3.393 4.058 . 0 0 "[ . 1 . 2]" 1
1616 1 42 SER HB3 1 112 ILE MG . . 4.790 4.421 3.481 4.792 0.002 1 0 "[ . 1 . 2]" 1
1617 1 37 LYS HG2 1 42 SER HB2 . . 5.160 4.017 2.043 5.113 . 0 0 "[ . 1 . 2]" 1
1618 1 37 LYS HG2 1 42 SER HB3 . . 5.160 3.597 2.020 5.119 . 0 0 "[ . 1 . 2]" 1
1619 1 37 LYS HG3 1 42 SER HB2 . . 5.160 3.715 2.078 5.019 . 0 0 "[ . 1 . 2]" 1
1620 1 37 LYS HG3 1 42 SER HB3 . . 5.160 3.502 2.261 4.403 . 0 0 "[ . 1 . 2]" 1
1621 1 37 LYS QB 1 42 SER HB2 . . 4.630 3.747 3.007 4.616 . 0 0 "[ . 1 . 2]" 1
1622 1 37 LYS QB 1 42 SER HB3 . . 4.630 3.584 2.727 4.636 0.006 11 0 "[ . 1 . 2]" 1
1623 1 36 PHE HB3 1 42 SER HB2 . . 4.440 3.145 2.171 4.102 . 0 0 "[ . 1 . 2]" 1
1624 1 36 PHE HB3 1 42 SER HB3 . . 4.440 3.622 2.630 4.434 . 0 0 "[ . 1 . 2]" 1
1625 1 97 SER HB2 1 107 GLU HG2 . . 4.800 3.997 2.936 4.802 0.002 9 0 "[ . 1 . 2]" 1
1626 1 97 SER HB3 1 107 GLU HG2 . . 4.800 4.205 3.009 4.809 0.009 19 0 "[ . 1 . 2]" 1
1627 1 10 SER HB2 1 11 VAL MG2 . . 4.480 3.591 2.914 4.479 . 0 0 "[ . 1 . 2]" 1
1628 1 55 ILE HA 1 55 ILE MD . . 4.300 2.204 1.916 3.751 . 0 0 "[ . 1 . 2]" 1
1629 1 55 ILE HA 1 55 ILE MG . . 3.340 2.309 2.211 2.437 . 0 0 "[ . 1 . 2]" 1
1630 1 55 ILE HA 1 55 ILE HG13 . . 3.890 3.722 3.306 3.828 . 0 0 "[ . 1 . 2]" 1
1631 1 105 ILE HA 1 105 ILE HB . . 2.850 2.628 2.590 2.668 . 0 0 "[ . 1 . 2]" 1
1632 1 105 ILE HA 1 105 ILE HG12 . . 3.700 2.326 2.143 2.456 . 0 0 "[ . 1 . 2]" 1
1633 1 105 ILE HA 1 105 ILE HG13 . . 3.700 3.541 3.459 3.581 . 0 0 "[ . 1 . 2]" 1
1634 1 103 ILE MG 1 105 ILE HA . . 4.780 4.426 4.271 4.586 . 0 0 "[ . 1 . 2]" 1
1635 1 105 ILE HA 1 109 ALA MB . . 4.940 3.893 3.555 4.423 . 0 0 "[ . 1 . 2]" 1
1636 1 104 GLY HA3 1 105 ILE HA . . 4.870 4.522 4.503 4.620 . 0 0 "[ . 1 . 2]" 1
1637 1 104 GLY HA2 1 105 ILE HA . . 5.490 4.337 4.303 4.347 . 0 0 "[ . 1 . 2]" 1
1638 1 53 PHE QD 1 105 ILE HA . . 4.080 3.100 2.471 3.579 . 0 0 "[ . 1 . 2]" 1
1639 1 53 PHE QE 1 105 ILE HA . . 4.030 3.746 3.393 4.030 . 0 0 "[ . 1 . 2]" 1
1640 1 105 ILE HA 1 108 PHE QD . . 4.810 3.027 2.586 3.361 . 0 0 "[ . 1 . 2]" 1
1641 1 105 ILE HA 1 107 GLU H . . 5.370 3.813 3.656 3.996 . 0 0 "[ . 1 . 2]" 1
1642 1 61 SER QB 1 63 PHE HB2 . . 5.070 4.357 3.596 4.793 . 0 0 "[ . 1 . 2]" 1
1643 1 61 SER QB 1 63 PHE QD . . 5.090 4.656 3.347 5.089 . 0 0 "[ . 1 . 2]" 1
1644 1 61 SER QB 1 65 GLU HE2 . . 3.310 2.618 2.200 2.856 . 0 0 "[ . 1 . 2]" 1
1645 1 24 CYS HA 1 29 SER HB2 . . 5.440 5.029 3.288 5.443 0.003 16 0 "[ . 1 . 2]" 1
1646 1 24 CYS HA 1 29 SER HB3 . . 5.440 4.605 3.692 5.443 0.003 19 0 "[ . 1 . 2]" 1
1647 1 44 LYS HB3 1 45 SER HB2 . . 5.230 4.237 3.969 4.426 . 0 0 "[ . 1 . 2]" 1
1648 1 45 SER HB2 1 48 GLU HB2 . . 5.500 5.202 4.534 5.504 0.004 18 0 "[ . 1 . 2]" 1
1649 1 45 SER HB2 1 48 GLU H . . 4.980 2.968 2.343 3.908 . 0 0 "[ . 1 . 2]" 1
1650 1 45 SER H 1 45 SER HB2 . . 3.660 2.375 2.176 2.575 . 0 0 "[ . 1 . 2]" 1
1651 1 45 SER H 1 45 SER HB3 . . 4.060 3.474 2.835 3.647 . 0 0 "[ . 1 . 2]" 1
1652 1 46 THR HA 1 49 VAL MG2 . . 3.490 2.167 1.938 2.669 . 0 0 "[ . 1 . 2]" 1
1653 1 46 THR HA 1 109 ALA MB . . 4.870 3.404 3.021 3.894 . 0 0 "[ . 1 . 2]" 1
1654 1 46 THR HA 1 113 LYS QD . . 4.940 4.720 4.102 4.947 0.007 9 0 "[ . 1 . 2]" 1
1655 1 46 THR HA 1 49 VAL HB . . 3.200 2.298 1.993 2.581 . 0 0 "[ . 1 . 2]" 1
1656 1 45 SER HB3 1 46 THR HA . . 5.150 4.955 4.740 5.123 . 0 0 "[ . 1 . 2]" 1
1657 1 46 THR HA 1 47 ASP HA . . 5.490 4.722 4.642 4.807 . 0 0 "[ . 1 . 2]" 1
1658 1 46 THR HA 1 48 GLU H . . 5.270 4.782 4.527 4.992 . 0 0 "[ . 1 . 2]" 1
1659 1 46 THR HA 1 50 LYS H . . 4.740 4.321 3.682 4.646 . 0 0 "[ . 1 . 2]" 1
1660 1 18 THR HA 1 21 LEU MD1 . . 3.660 2.396 1.951 2.804 . 0 0 "[ . 1 . 2]" 1
1661 1 18 THR HA 1 18 THR MG . . 3.250 2.777 2.557 3.142 . 0 0 "[ . 1 . 2]" 1
1662 1 18 THR HA 1 21 LEU HB2 . . 4.340 2.400 2.004 2.797 . 0 0 "[ . 1 . 2]" 1
1663 1 18 THR HA 1 21 LEU HB3 . . 4.340 3.999 3.593 4.339 . 0 0 "[ . 1 . 2]" 1
1664 1 18 THR HA 1 20 ALA H . . 4.830 3.999 3.702 4.245 . 0 0 "[ . 1 . 2]" 1
1665 1 49 VAL HA 1 112 ILE MD . . 4.860 3.481 3.291 3.652 . 0 0 "[ . 1 . 2]" 1
1666 1 49 VAL HA 1 112 ILE MG . . 5.500 5.521 5.510 5.532 0.032 16 0 "[ . 1 . 2]" 1
1667 1 49 VAL HA 1 49 VAL MG2 . . 2.920 2.367 2.250 2.414 . 0 0 "[ . 1 . 2]" 1
1668 1 49 VAL HA 1 52 ALA MB . . 3.480 2.163 1.969 2.377 . 0 0 "[ . 1 . 2]" 1
1669 1 49 VAL HA 1 108 PHE QD . . 5.500 5.128 4.664 5.494 . 0 0 "[ . 1 . 2]" 1
1670 1 49 VAL HA 1 108 PHE QE . . 4.710 3.548 2.971 4.241 . 0 0 "[ . 1 . 2]" 1
1671 1 49 VAL HA 1 51 LYS H . . 4.830 4.310 3.954 4.789 . 0 0 "[ . 1 . 2]" 1
1672 1 17 VAL HA 1 20 ALA MB . . 3.690 2.387 2.100 2.732 . 0 0 "[ . 1 . 2]" 1
1673 1 17 VAL HA 1 17 VAL MG1 . . 3.170 2.368 2.256 2.479 . 0 0 "[ . 1 . 2]" 1
1674 1 17 VAL HA 1 39 CYS HB2 . . 4.410 4.145 2.826 4.424 0.014 20 0 "[ . 1 . 2]" 1
1675 1 17 VAL HA 1 39 CYS HA . . 4.170 3.765 2.380 4.172 0.002 9 0 "[ . 1 . 2]" 1
1676 1 69 LEU MD1 1 88 THR HB . . 5.500 5.315 4.923 5.503 0.003 11 0 "[ . 1 . 2]" 1
1677 1 83 LEU HB3 1 88 THR HB . . 5.130 4.584 3.992 5.054 . 0 0 "[ . 1 . 2]" 1
1678 1 70 LYS QB 1 88 THR HB . . 5.350 3.343 2.856 3.970 . 0 0 "[ . 1 . 2]" 1
1679 1 88 THR HB 1 89 LYS HA . . 4.880 4.481 4.275 4.651 . 0 0 "[ . 1 . 2]" 1
1680 1 69 LEU MD2 1 88 THR HA . . 5.090 4.721 4.289 5.032 . 0 0 "[ . 1 . 2]" 1
1681 1 69 LEU MD1 1 88 THR HA . . 4.530 4.363 3.666 4.533 0.003 9 0 "[ . 1 . 2]" 1
1682 1 83 LEU MD2 1 88 THR HA . . 4.530 4.264 3.104 4.533 0.003 10 0 "[ . 1 . 2]" 1
1683 1 83 LEU HB3 1 88 THR HA . . 4.810 3.754 3.200 4.110 . 0 0 "[ . 1 . 2]" 1
1684 1 83 LEU HB2 1 88 THR HA . . 4.830 3.610 3.240 3.861 . 0 0 "[ . 1 . 2]" 1
1685 1 88 THR HA 1 91 PHE HB2 . . 4.240 2.959 2.033 3.639 . 0 0 "[ . 1 . 2]" 1
1686 1 88 THR HA 1 91 PHE QD . . 5.190 3.268 2.631 3.745 . 0 0 "[ . 1 . 2]" 1
1687 1 88 THR HA 1 91 PHE H . . 4.820 3.292 3.007 3.604 . 0 0 "[ . 1 . 2]" 1
1688 1 46 THR HB 1 49 VAL HB . . 5.430 5.069 4.657 5.337 . 0 0 "[ . 1 . 2]" 1
1689 1 46 THR HB 1 47 ASP QB . . 5.310 4.855 4.547 5.331 0.021 11 0 "[ . 1 . 2]" 1
1690 1 35 PHE HZ 1 76 PHE QD . . 4.530 2.471 2.022 2.989 . 0 0 "[ . 1 . 2]" 1
1691 1 69 LEU MD1 1 91 PHE QD . . 4.420 4.098 3.802 4.283 . 0 0 "[ . 1 . 2]" 1
1692 1 91 PHE QD 1 92 LEU HA . . 5.420 4.686 4.414 4.882 . 0 0 "[ . 1 . 2]" 1
1693 1 91 PHE QD 1 95 GLY HA3 . . 5.500 5.272 4.519 5.507 0.007 1 0 "[ . 1 . 2]" 1
1694 1 108 PHE QE 1 112 ILE MG . . 4.700 4.190 3.029 4.711 0.011 7 0 "[ . 1 . 2]" 1
1695 1 41 LEU MD2 1 108 PHE QE . . 4.500 4.147 3.371 4.399 . 0 0 "[ . 1 . 2]" 1
1696 1 8 PHE HB2 1 76 PHE QE . . 4.310 3.701 3.266 4.031 . 0 0 "[ . 1 . 2]" 1
1697 1 12 LEU MD1 1 76 PHE QD . . 4.400 4.207 3.640 4.401 0.001 5 0 "[ . 1 . 2]" 1
1698 1 53 PHE HA 1 53 PHE QD . . 3.910 3.126 2.862 3.327 . 0 0 "[ . 1 . 2]" 1
1699 1 30 PHE QD 1 83 LEU MD2 . . 4.030 3.812 3.165 4.034 0.004 17 0 "[ . 1 . 2]" 1
1700 1 53 PHE HB3 1 108 PHE QD . . 4.270 3.847 3.575 4.170 . 0 0 "[ . 1 . 2]" 1
1701 1 53 PHE HB2 1 108 PHE QD . . 3.630 2.299 2.067 2.548 . 0 0 "[ . 1 . 2]" 1
1702 1 108 PHE QD 1 109 ALA H . . 4.170 3.663 3.501 4.003 . 0 0 "[ . 1 . 2]" 1
1703 1 6 MET HA 1 6 MET QG . . 3.700 2.685 2.208 3.412 . 0 0 "[ . 1 . 2]" 1
1704 1 6 MET QB 1 6 MET QG . . 2.350 2.102 2.040 2.137 . 0 0 "[ . 1 . 2]" 1
1705 1 6 MET QB 1 7 ALA H . . 4.270 3.709 2.032 4.098 . 0 0 "[ . 1 . 2]" 1
1706 1 6 MET QB 1 9 ALA MB . . 3.760 2.400 1.739 3.516 . 0 0 "[ . 1 . 2]" 1
1707 1 6 MET QG 1 9 ALA MB . . 4.150 3.270 1.767 4.151 0.001 7 0 "[ . 1 . 2]" 1
1708 1 7 ALA MB 1 75 ASN QB . . 4.780 4.574 3.896 4.781 0.001 12 0 "[ . 1 . 2]" 1
1709 1 8 PHE QE 1 75 ASN QB . . 4.040 2.299 1.982 2.703 . 0 0 "[ . 1 . 2]" 1
1710 1 9 ALA MB 1 10 SER QB . . 4.280 4.075 3.594 4.283 0.003 8 0 "[ . 1 . 2]" 1
1711 1 10 SER QB 1 11 VAL MG1 . . 5.080 4.976 4.761 5.082 0.002 10 0 "[ . 1 . 2]" 1
1712 1 10 SER QB 1 11 VAL MG2 . . 3.670 3.035 2.792 3.283 . 0 0 "[ . 1 . 2]" 1
1713 1 12 LEU MD1 1 39 CYS QB . . 4.110 2.086 1.755 2.801 . 0 0 "[ . 1 . 2]" 1
1714 1 12 LEU MD2 1 39 CYS QB . . 4.550 3.049 2.292 4.115 . 0 0 "[ . 1 . 2]" 1
1715 1 12 LEU MD2 1 40 GLY QA . . 4.200 3.992 2.815 4.206 0.006 12 0 "[ . 1 . 2]" 1
1716 1 13 LYS H 1 13 LYS QB . . 3.330 2.421 2.103 2.694 . 0 0 "[ . 1 . 2]" 1
1717 1 13 LYS H 1 13 LYS QG . . 4.130 2.953 1.940 4.054 . 0 0 "[ . 1 . 2]" 1
1718 1 13 LYS H 1 16 GLU QB . . 4.320 2.670 2.205 3.217 . 0 0 "[ . 1 . 2]" 1
1719 1 13 LYS HA 1 13 LYS QG . . 3.400 2.614 2.100 3.170 . 0 0 "[ . 1 . 2]" 1
1720 1 13 LYS QB 1 16 GLU H . . 3.610 2.264 1.925 2.715 . 0 0 "[ . 1 . 2]" 1
1721 1 13 LYS QB 1 16 GLU QG . . 3.700 2.147 1.727 2.532 . 0 0 "[ . 1 . 2]" 1
1722 1 13 LYS QB 1 17 VAL H . . 4.490 3.849 3.336 4.305 . 0 0 "[ . 1 . 2]" 1
1723 1 13 LYS QG 1 16 GLU QG . . 4.360 3.018 1.976 4.300 . 0 0 "[ . 1 . 2]" 1
1724 1 13 LYS QG 1 17 VAL H . . 5.340 5.120 4.284 5.344 0.004 2 0 "[ . 1 . 2]" 1
1725 1 14 ASP QB 1 17 VAL MG2 . . 4.510 3.631 3.314 3.851 . 0 0 "[ . 1 . 2]" 1
1726 1 16 GLU H 1 16 GLU QB . . 3.220 2.234 2.135 2.448 . 0 0 "[ . 1 . 2]" 1
1727 1 16 GLU HA 1 16 GLU QB . . 2.650 2.480 2.390 2.519 . 0 0 "[ . 1 . 2]" 1
1728 1 16 GLU QB 1 17 VAL H . . 3.820 2.312 2.194 2.519 . 0 0 "[ . 1 . 2]" 1
1729 1 16 GLU QB 1 39 CYS HA . . 3.770 3.101 2.060 3.770 . 0 0 "[ . 1 . 2]" 1
1730 1 17 VAL HA 1 39 CYS QB . . 3.830 2.920 2.471 3.833 0.003 16 0 "[ . 1 . 2]" 1
1731 1 17 VAL MG1 1 39 CYS QB . . 3.320 2.499 1.914 3.125 . 0 0 "[ . 1 . 2]" 1
1732 1 18 THR HA 1 21 LEU QB . . 3.500 2.381 1.994 2.764 . 0 0 "[ . 1 . 2]" 1
1733 1 20 ALA MB 1 39 CYS QB . . 3.320 3.128 2.812 3.379 0.059 3 0 "[ . 1 . 2]" 1
1734 1 21 LEU H 1 21 LEU QB . . 3.040 2.166 2.079 2.355 . 0 0 "[ . 1 . 2]" 1
1735 1 21 LEU QB 1 21 LEU MD1 . . 3.080 2.006 1.959 2.059 . 0 0 "[ . 1 . 2]" 1
1736 1 21 LEU QB 1 21 LEU MD2 . . 2.940 2.125 2.037 2.241 . 0 0 "[ . 1 . 2]" 1
1737 1 21 LEU QB 1 22 ASP H . . 3.310 2.809 2.429 3.063 . 0 0 "[ . 1 . 2]" 1
1738 1 21 LEU QB 1 22 ASP HB3 . . 5.340 5.072 4.872 5.217 . 0 0 "[ . 1 . 2]" 1
1739 1 21 LEU MD1 1 77 LYS QB . . 3.530 2.730 2.476 2.897 . 0 0 "[ . 1 . 2]" 1
1740 1 21 LEU MD2 1 77 LYS QB . . 4.030 3.160 3.052 3.306 . 0 0 "[ . 1 . 2]" 1
1741 1 22 ASP H 1 23 GLY QA . . 4.820 4.243 4.073 4.426 . 0 0 "[ . 1 . 2]" 1
1742 1 22 ASP HA 1 25 LYS QB . . 3.280 2.299 1.986 2.672 . 0 0 "[ . 1 . 2]" 1
1743 1 22 ASP HB3 1 23 GLY QA . . 4.950 3.795 3.690 3.857 . 0 0 "[ . 1 . 2]" 1
1744 1 23 GLY QA 1 25 LYS H . . 5.290 3.754 3.614 3.975 . 0 0 "[ . 1 . 2]" 1
1745 1 24 CYS H 1 25 LYS QB . . 4.710 3.713 3.505 3.931 . 0 0 "[ . 1 . 2]" 1
1746 1 24 CYS HA 1 29 SER QB . . 4.720 4.063 3.237 4.724 0.004 3 0 "[ . 1 . 2]" 1
1747 1 24 CYS QB 1 25 LYS HA . . 5.080 4.588 4.271 4.887 . 0 0 "[ . 1 . 2]" 1
1748 1 24 CYS QB 1 30 PHE H . . 5.340 4.193 3.664 5.076 . 0 0 "[ . 1 . 2]" 1
1749 1 24 CYS QB 1 30 PHE HA . . 3.440 2.289 1.863 2.882 . 0 0 "[ . 1 . 2]" 1
1750 1 24 CYS QB 1 30 PHE QD . . 4.050 2.005 1.803 2.708 . 0 0 "[ . 1 . 2]" 1
1751 1 24 CYS QB 1 31 ASP H . . 4.510 3.228 2.576 4.094 . 0 0 "[ . 1 . 2]" 1
1752 1 24 CYS QB 1 73 LEU MD1 . . 4.590 2.901 2.287 3.819 . 0 0 "[ . 1 . 2]" 1
1753 1 25 LYS H 1 25 LYS QB . . 3.030 2.216 2.091 2.473 . 0 0 "[ . 1 . 2]" 1
1754 1 25 LYS QB 1 25 LYS QE . . 4.150 2.610 1.840 3.595 . 0 0 "[ . 1 . 2]" 1
1755 1 25 LYS QB 1 26 ALA H . . 3.440 3.179 2.615 3.442 0.002 3 0 "[ . 1 . 2]" 1
1756 1 25 LYS QB 1 26 ALA HA . . 4.470 4.189 3.980 4.443 . 0 0 "[ . 1 . 2]" 1
1757 1 26 ALA H 1 29 SER QB . . 4.720 3.828 3.033 4.715 . 0 0 "[ . 1 . 2]" 1
1758 1 27 ALA HA 1 81 ARG QD . . 4.570 4.461 4.125 4.572 0.002 12 0 "[ . 1 . 2]" 1
1759 1 27 ALA MB 1 84 SER QB . . 4.170 3.937 3.233 4.173 0.003 6 0 "[ . 1 . 2]" 1
1760 1 28 GLY H 1 87 GLU QG . . 4.770 3.287 2.512 3.895 . 0 0 "[ . 1 . 2]" 1
1761 1 28 GLY HA3 1 87 GLU QG . . 4.330 4.072 3.593 4.331 0.001 2 0 "[ . 1 . 2]" 1
1762 1 29 SER H 1 29 SER QB . . 3.360 2.639 2.192 2.869 . 0 0 "[ . 1 . 2]" 1
1763 1 30 PHE H 1 30 PHE QB . . 3.110 2.036 1.984 2.095 . 0 0 "[ . 1 . 2]" 1
1764 1 30 PHE H 1 87 GLU QG . . 4.120 3.050 2.525 3.407 . 0 0 "[ . 1 . 2]" 1
1765 1 30 PHE QB 1 31 ASP H . . 4.280 3.779 3.609 3.992 . 0 0 "[ . 1 . 2]" 1
1766 1 30 PHE QB 1 73 LEU MD1 . . 4.650 3.843 3.399 4.568 . 0 0 "[ . 1 . 2]" 1
1767 1 30 PHE QB 1 83 LEU MD1 . . 3.410 2.345 1.942 3.012 . 0 0 "[ . 1 . 2]" 1
1768 1 30 PHE QB 1 87 GLU QB . . 4.520 2.974 2.181 3.340 . 0 0 "[ . 1 . 2]" 1
1769 1 30 PHE QE 1 32 HIS QB . . 4.640 2.778 2.147 3.710 . 0 0 "[ . 1 . 2]" 1
1770 1 31 ASP QB 1 34 LYS QG . . 4.110 2.189 1.747 3.460 . 0 0 "[ . 1 . 2]" 1
1771 1 32 HIS QB 1 33 LYS H . . 4.880 3.188 3.006 3.356 . 0 0 "[ . 1 . 2]" 1
1772 1 32 HIS QB 1 91 PHE HB3 . . 5.340 4.696 4.392 5.058 . 0 0 "[ . 1 . 2]" 1
1773 1 32 HIS QB 1 91 PHE QD . . 5.300 2.665 1.926 3.216 . 0 0 "[ . 1 . 2]" 1
1774 1 33 LYS HA 1 33 LYS QG . . 3.470 2.712 2.049 3.326 . 0 0 "[ . 1 . 2]" 1
1775 1 34 LYS H 1 34 LYS QB . . 2.950 2.299 2.101 2.483 . 0 0 "[ . 1 . 2]" 1
1776 1 34 LYS H 1 34 LYS QG . . 3.500 2.487 1.934 3.509 0.009 3 0 "[ . 1 . 2]" 1
1777 1 34 LYS H 1 34 LYS QD . . 5.120 3.514 1.939 4.565 . 0 0 "[ . 1 . 2]" 1
1778 1 34 LYS HA 1 34 LYS QG . . 3.210 2.576 2.023 2.885 . 0 0 "[ . 1 . 2]" 1
1779 1 34 LYS HA 1 34 LYS QD . . 3.650 2.427 1.925 3.557 . 0 0 "[ . 1 . 2]" 1
1780 1 34 LYS QB 1 35 PHE HA . . 4.780 3.854 3.776 3.940 . 0 0 "[ . 1 . 2]" 1
1781 1 34 LYS QE 1 34 LYS QG . . 3.310 2.290 2.069 2.818 . 0 0 "[ . 1 . 2]" 1
1782 1 34 LYS QG 1 35 PHE H . . 4.710 4.182 3.856 4.674 . 0 0 "[ . 1 . 2]" 1
1783 1 36 PHE HA 1 39 CYS QB . . 4.610 3.870 2.297 4.383 . 0 0 "[ . 1 . 2]" 1
1784 1 36 PHE HB2 1 42 SER QB . . 4.150 3.139 2.420 4.152 0.002 7 0 "[ . 1 . 2]" 1
1785 1 37 LYS H 1 37 LYS QG . . 4.090 3.575 2.499 4.008 . 0 0 "[ . 1 . 2]" 1
1786 1 37 LYS HA 1 42 SER QB . . 3.150 2.191 1.958 2.736 . 0 0 "[ . 1 . 2]" 1
1787 1 37 LYS QB 1 42 SER QB . . 4.020 3.210 2.618 4.014 . 0 0 "[ . 1 . 2]" 1
1788 1 37 LYS QE 1 37 LYS QG . . 2.800 2.307 2.099 2.668 . 0 0 "[ . 1 . 2]" 1
1789 1 37 LYS QG 1 38 ALA H . . 4.610 4.431 4.230 4.614 0.004 11 0 "[ . 1 . 2]" 1
1790 1 37 LYS QG 1 42 SER QB . . 3.710 2.698 1.761 3.274 . 0 0 "[ . 1 . 2]" 1
1791 1 39 CYS QB 1 40 GLY H . . 4.570 3.496 2.987 3.795 . 0 0 "[ . 1 . 2]" 1
1792 1 39 CYS QB 1 41 LEU H . . 3.800 3.008 2.337 3.640 . 0 0 "[ . 1 . 2]" 1
1793 1 41 LEU HA 1 44 LYS QG . . 3.460 2.144 1.847 2.603 . 0 0 "[ . 1 . 2]" 1
1794 1 42 SER H 1 42 SER QB . . 3.180 2.180 2.062 2.327 . 0 0 "[ . 1 . 2]" 1
1795 1 42 SER H 1 44 LYS QG . . 5.340 4.245 3.973 4.955 . 0 0 "[ . 1 . 2]" 1
1796 1 42 SER HA 1 112 ILE QG . . 5.270 4.430 3.723 5.078 . 0 0 "[ . 1 . 2]" 1
1797 1 42 SER QB 1 43 GLY H . . 4.190 3.245 2.308 4.054 . 0 0 "[ . 1 . 2]" 1
1798 1 42 SER QB 1 112 ILE MG . . 4.130 3.504 3.063 4.140 0.010 19 0 "[ . 1 . 2]" 1
1799 1 43 GLY H 1 44 LYS QG . . 5.340 4.317 3.414 5.093 . 0 0 "[ . 1 . 2]" 1
1800 1 44 LYS H 1 44 LYS QG . . 3.320 2.704 2.618 2.741 . 0 0 "[ . 1 . 2]" 1
1801 1 44 LYS H 1 44 LYS QD . . 3.830 3.797 3.746 3.836 0.006 16 0 "[ . 1 . 2]" 1
1802 1 44 LYS HA 1 44 LYS QD . . 2.970 1.956 1.936 2.044 . 0 0 "[ . 1 . 2]" 1
1803 1 44 LYS HE2 1 44 LYS QG . . 3.460 2.250 2.154 2.354 . 0 0 "[ . 1 . 2]" 1
1804 1 44 LYS HE3 1 44 LYS QG . . 3.270 2.619 2.476 2.741 . 0 0 "[ . 1 . 2]" 1
1805 1 44 LYS QG 1 45 SER H . . 4.890 3.903 3.796 4.000 . 0 0 "[ . 1 . 2]" 1
1806 1 44 LYS QD 1 45 SER H . . 3.920 2.623 2.410 2.824 . 0 0 "[ . 1 . 2]" 1
1807 1 45 SER H 1 48 GLU QG . . 3.990 2.734 2.444 3.070 . 0 0 "[ . 1 . 2]" 1
1808 1 45 SER HB2 1 48 GLU QG . . 5.340 3.451 2.798 3.639 . 0 0 "[ . 1 . 2]" 1
1809 1 46 THR HB 1 50 LYS QE . . 4.710 4.439 4.013 4.712 0.002 9 0 "[ . 1 . 2]" 1
1810 1 48 GLU H 1 48 GLU QG . . 3.150 2.561 2.417 2.650 . 0 0 "[ . 1 . 2]" 1
1811 1 48 GLU QG 1 49 VAL H . . 3.240 2.060 1.944 2.171 . 0 0 "[ . 1 . 2]" 1
1812 1 48 GLU QG 1 49 VAL MG1 . . 4.520 4.334 4.189 4.431 . 0 0 "[ . 1 . 2]" 1
1813 1 48 GLU QG 1 49 VAL MG2 . . 3.550 2.372 2.148 2.540 . 0 0 "[ . 1 . 2]" 1
1814 1 48 GLU QG 1 52 ALA MB . . 5.130 3.229 2.815 3.654 . 0 0 "[ . 1 . 2]" 1
1815 1 49 VAL MG1 1 112 ILE QG . . 3.510 2.889 2.498 3.192 . 0 0 "[ . 1 . 2]" 1
1816 1 50 LYS H 1 50 LYS QG . . 3.240 2.179 1.940 3.169 . 0 0 "[ . 1 . 2]" 1
1817 1 50 LYS QE 1 50 LYS QG . . 3.380 2.280 2.056 2.576 . 0 0 "[ . 1 . 2]" 1
1818 1 50 LYS QG 1 105 ILE MG . . 3.990 2.744 2.480 3.017 . 0 0 "[ . 1 . 2]" 1
1819 1 50 LYS QG 1 105 ILE MD . . 3.560 1.784 1.679 2.088 . 0 0 "[ . 1 . 2]" 1
1820 1 50 LYS QE 1 105 ILE MG . . 4.430 3.500 2.862 4.289 . 0 0 "[ . 1 . 2]" 1
1821 1 50 LYS QE 1 105 ILE MD . . 4.570 3.148 2.586 3.909 . 0 0 "[ . 1 . 2]" 1
1822 1 51 LYS H 1 51 LYS QG . . 3.220 1.943 1.900 2.109 . 0 0 "[ . 1 . 2]" 1
1823 1 51 LYS HA 1 51 LYS QG . . 3.380 2.931 2.442 3.243 . 0 0 "[ . 1 . 2]" 1
1824 1 51 LYS QB 1 52 ALA H . . 3.700 3.126 2.570 3.235 . 0 0 "[ . 1 . 2]" 1
1825 1 51 LYS QG 1 52 ALA H . . 4.390 3.882 3.737 4.041 . 0 0 "[ . 1 . 2]" 1
1826 1 53 PHE H 1 105 ILE QG . . 5.340 4.151 3.792 4.486 . 0 0 "[ . 1 . 2]" 1
1827 1 53 PHE QE 1 62 GLY QA . . 4.320 4.019 2.615 4.328 0.008 12 0 "[ . 1 . 2]" 1
1828 1 53 PHE QE 1 64 ILE QG . . 4.230 2.523 2.082 3.157 . 0 0 "[ . 1 . 2]" 1
1829 1 55 ILE H 1 55 ILE QG . . 2.810 2.007 1.932 2.200 . 0 0 "[ . 1 . 2]" 1
1830 1 55 ILE HA 1 55 ILE QG . . 3.200 2.860 2.406 3.135 . 0 0 "[ . 1 . 2]" 1
1831 1 55 ILE HB 1 55 ILE QG . . 2.550 2.179 2.161 2.291 . 0 0 "[ . 1 . 2]" 1
1832 1 55 ILE HB 1 56 ILE QG . . 4.640 2.895 2.764 3.140 . 0 0 "[ . 1 . 2]" 1
1833 1 55 ILE QG 1 55 ILE MG . . 3.150 2.379 2.101 2.476 . 0 0 "[ . 1 . 2]" 1
1834 1 55 ILE MG 1 75 ASN QB . . 3.340 2.151 1.778 2.589 . 0 0 "[ . 1 . 2]" 1
1835 1 55 ILE QG 1 56 ILE H . . 3.980 3.873 3.681 3.986 0.006 15 0 "[ . 1 . 2]" 1
1836 1 55 ILE MD 1 75 ASN QB . . 4.880 4.726 4.233 4.889 0.009 11 0 "[ . 1 . 2]" 1
1837 1 56 ILE H 1 56 ILE QG . . 3.100 2.025 1.932 2.317 . 0 0 "[ . 1 . 2]" 1
1838 1 56 ILE HA 1 56 ILE QG . . 3.410 2.531 2.456 2.584 . 0 0 "[ . 1 . 2]" 1
1839 1 56 ILE HA 1 75 ASN QB . . 4.750 1.916 1.828 2.060 . 0 0 "[ . 1 . 2]" 1
1840 1 56 ILE HA 1 75 ASN QD . . 4.100 3.853 2.026 4.153 0.053 17 0 "[ . 1 . 2]" 1
1841 1 56 ILE QG 1 56 ILE MG . . 3.060 1.997 1.940 2.140 . 0 0 "[ . 1 . 2]" 1
1842 1 56 ILE MG 1 75 ASN QB . . 4.920 2.379 1.907 3.386 . 0 0 "[ . 1 . 2]" 1
1843 1 56 ILE MG 1 75 ASN QD . . 3.730 2.796 1.738 3.687 . 0 0 "[ . 1 . 2]" 1
1844 1 56 ILE QG 1 57 ASP H . . 4.400 4.009 3.908 4.167 . 0 0 "[ . 1 . 2]" 1
1845 1 57 ASP H 1 57 ASP QB . . 3.010 2.373 2.051 2.590 . 0 0 "[ . 1 . 2]" 1
1846 1 57 ASP H 1 64 ILE QG . . 4.710 3.782 3.052 4.440 . 0 0 "[ . 1 . 2]" 1
1847 1 57 ASP HA 1 64 ILE QG . . 4.140 3.574 3.043 3.810 . 0 0 "[ . 1 . 2]" 1
1848 1 57 ASP QB 1 58 GLN H . . 4.010 3.725 3.619 4.021 0.011 11 0 "[ . 1 . 2]" 1
1849 1 57 ASP QB 1 64 ILE QG . . 4.620 3.863 1.984 4.510 . 0 0 "[ . 1 . 2]" 1
1850 1 58 GLN H 1 58 GLN QB . . 3.130 2.541 2.427 2.677 . 0 0 "[ . 1 . 2]" 1
1851 1 58 GLN QB 1 59 ASP H . . 3.580 2.983 2.168 3.201 . 0 0 "[ . 1 . 2]" 1
1852 1 58 GLN QE 1 58 GLN HG3 . . 3.470 2.195 2.086 2.505 . 0 0 "[ . 1 . 2]" 1
1853 1 58 GLN QE 1 71 LEU HB2 . . 4.380 3.930 3.131 4.381 0.001 11 0 "[ . 1 . 2]" 1
1854 1 58 GLN QE 1 71 LEU HB3 . . 4.360 3.177 2.664 3.929 . 0 0 "[ . 1 . 2]" 1
1855 1 58 GLN QE 1 74 GLN QB . . 5.070 2.472 1.897 3.354 . 0 0 "[ . 1 . 2]" 1
1856 1 59 ASP H 1 59 ASP QB . . 3.460 2.778 2.413 2.999 . 0 0 "[ . 1 . 2]" 1
1857 1 59 ASP QB 1 60 LYS QG . . 5.250 4.626 4.449 5.366 0.116 15 0 "[ . 1 . 2]" 1
1858 1 59 ASP QB 1 60 LYS QD . . 5.180 5.054 3.866 5.192 0.012 5 0 "[ . 1 . 2]" 1
1859 1 59 ASP QB 1 61 SER H . . 5.300 3.670 2.783 4.393 . 0 0 "[ . 1 . 2]" 1
1860 1 60 LYS H 1 60 LYS QD . . 3.960 2.118 1.926 2.413 . 0 0 "[ . 1 . 2]" 1
1861 1 60 LYS HA 1 60 LYS QD . . 3.240 2.311 1.987 3.267 0.027 15 0 "[ . 1 . 2]" 1
1862 1 60 LYS HA 1 60 LYS QE . . 4.640 3.564 1.983 4.681 0.041 15 0 "[ . 1 . 2]" 1
1863 1 60 LYS QB 1 60 LYS QD . . 3.190 2.603 2.158 2.942 . 0 0 "[ . 1 . 2]" 1
1864 1 60 LYS QD 1 60 LYS QG . . 2.370 2.070 2.005 2.129 . 0 0 "[ . 1 . 2]" 1
1865 1 60 LYS QE 1 60 LYS QG . . 3.100 2.386 2.084 2.955 . 0 0 "[ . 1 . 2]" 1
1866 1 61 SER H 1 62 GLY QA . . 5.060 4.516 4.218 4.785 . 0 0 "[ . 1 . 2]" 1
1867 1 63 PHE HA 1 64 ILE QG . . 5.340 3.603 3.275 4.066 . 0 0 "[ . 1 . 2]" 1
1868 1 63 PHE HB2 1 102 LYS QB . . 4.010 3.053 2.452 3.518 . 0 0 "[ . 1 . 2]" 1
1869 1 63 PHE HB2 1 102 LYS QG . . 4.750 4.299 2.082 4.752 0.002 8 0 "[ . 1 . 2]" 1
1870 1 63 PHE HB2 1 102 LYS QD . . 4.130 2.940 1.992 4.149 0.019 14 0 "[ . 1 . 2]" 1
1871 1 63 PHE HB3 1 102 LYS QG . . 4.930 4.091 2.187 4.699 . 0 0 "[ . 1 . 2]" 1
1872 1 63 PHE HB3 1 102 LYS QD . . 4.400 3.356 2.408 4.198 . 0 0 "[ . 1 . 2]" 1
1873 1 63 PHE QD 1 102 LYS QB . . 4.540 3.169 2.391 3.920 . 0 0 "[ . 1 . 2]" 1
1874 1 63 PHE QD 1 102 LYS QG . . 4.840 4.591 2.082 4.842 0.002 4 0 "[ . 1 . 2]" 1
1875 1 63 PHE QD 1 102 LYS QD . . 4.850 3.410 2.593 4.517 . 0 0 "[ . 1 . 2]" 1
1876 1 63 PHE QD 1 102 LYS QE . . 4.410 3.384 2.738 4.170 . 0 0 "[ . 1 . 2]" 1
1877 1 63 PHE QE 1 102 LYS QE . . 4.730 4.064 3.244 4.672 . 0 0 "[ . 1 . 2]" 1
1878 1 64 ILE H 1 64 ILE QG . . 3.580 2.887 2.195 3.318 . 0 0 "[ . 1 . 2]" 1
1879 1 64 ILE QG 1 64 ILE MG . . 3.030 2.358 2.249 2.457 . 0 0 "[ . 1 . 2]" 1
1880 1 64 ILE MG 1 68 GLU QG . . 4.640 3.965 3.475 4.578 . 0 0 "[ . 1 . 2]" 1
1881 1 64 ILE MG 1 69 LEU QB . . 3.890 3.561 3.410 3.826 . 0 0 "[ . 1 . 2]" 1
1882 1 64 ILE QG 1 65 GLU H . . 4.500 4.341 4.199 4.406 . 0 0 "[ . 1 . 2]" 1
1883 1 65 GLU H 1 65 GLU QB . . 3.290 2.418 2.312 2.646 . 0 0 "[ . 1 . 2]" 1
1884 1 65 GLU H 1 65 GLU QG . . 3.200 2.737 1.981 3.202 0.002 3 0 "[ . 1 . 2]" 1
1885 1 65 GLU H 1 68 GLU QG . . 4.930 3.434 2.760 4.481 . 0 0 "[ . 1 . 2]" 1
1886 1 65 GLU HA 1 65 GLU QG . . 3.380 2.295 2.195 2.551 . 0 0 "[ . 1 . 2]" 1
1887 1 65 GLU HA 1 102 LYS QB . . 3.760 2.943 1.965 3.423 . 0 0 "[ . 1 . 2]" 1
1888 1 65 GLU QB 1 66 GLU H . . 3.140 2.434 2.149 2.687 . 0 0 "[ . 1 . 2]" 1
1889 1 65 GLU QB 1 66 GLU HA . . 5.180 4.446 4.284 4.559 . 0 0 "[ . 1 . 2]" 1
1890 1 65 GLU QG 1 66 GLU H . . 4.120 3.788 3.465 4.079 . 0 0 "[ . 1 . 2]" 1
1891 1 65 GLU QG 1 102 LYS QG . . 3.930 2.214 1.975 3.171 . 0 0 "[ . 1 . 2]" 1
1892 1 65 GLU QG 1 102 LYS QD . . 3.940 2.459 1.956 3.107 . 0 0 "[ . 1 . 2]" 1
1893 1 66 GLU H 1 66 GLU QG . . 4.300 3.921 3.787 4.017 . 0 0 "[ . 1 . 2]" 1
1894 1 66 GLU HA 1 69 LEU QB . . 3.400 2.320 1.986 2.671 . 0 0 "[ . 1 . 2]" 1
1895 1 66 GLU QG 1 67 GLU H . . 4.450 3.960 3.348 4.395 . 0 0 "[ . 1 . 2]" 1
1896 1 66 GLU QG 1 88 THR HB . . 4.960 4.097 3.299 4.518 . 0 0 "[ . 1 . 2]" 1
1897 1 66 GLU QG 1 88 THR MG . . 2.890 2.259 1.739 2.581 . 0 0 "[ . 1 . 2]" 1
1898 1 66 GLU QG 1 92 LEU MD1 . . 3.730 3.423 2.655 3.735 0.005 11 0 "[ . 1 . 2]" 1
1899 1 66 GLU QG 1 92 LEU MD2 . . 3.890 2.613 1.942 3.198 . 0 0 "[ . 1 . 2]" 1
1900 1 67 GLU HA 1 67 GLU QG . . 3.030 2.387 2.117 2.489 . 0 0 "[ . 1 . 2]" 1
1901 1 67 GLU QG 1 68 GLU H . . 4.250 4.110 3.841 4.254 0.004 6 0 "[ . 1 . 2]" 1
1902 1 68 GLU H 1 68 GLU QG . . 3.050 2.735 2.066 3.054 0.004 11 0 "[ . 1 . 2]" 1
1903 1 68 GLU HA 1 68 GLU QG . . 3.000 2.213 2.116 2.416 . 0 0 "[ . 1 . 2]" 1
1904 1 68 GLU QG 1 69 LEU H . . 4.690 4.357 4.008 4.612 . 0 0 "[ . 1 . 2]" 1
1905 1 69 LEU H 1 69 LEU QB . . 3.040 2.120 2.053 2.234 . 0 0 "[ . 1 . 2]" 1
1906 1 69 LEU QB 1 69 LEU MD1 . . 3.010 2.079 2.043 2.114 . 0 0 "[ . 1 . 2]" 1
1907 1 69 LEU QB 1 69 LEU MD2 . . 3.260 2.339 2.311 2.397 . 0 0 "[ . 1 . 2]" 1
1908 1 69 LEU QB 1 70 LYS H . . 3.710 2.605 2.415 3.064 . 0 0 "[ . 1 . 2]" 1
1909 1 69 LEU QB 1 88 THR HB . . 5.340 4.570 4.249 4.835 . 0 0 "[ . 1 . 2]" 1
1910 1 69 LEU QB 1 88 THR MG . . 3.120 1.985 1.726 2.252 . 0 0 "[ . 1 . 2]" 1
1911 1 69 LEU QB 1 91 PHE HB3 . . 5.130 3.374 2.781 3.842 . 0 0 "[ . 1 . 2]" 1
1912 1 69 LEU MD1 1 92 LEU QB . . 3.880 2.021 1.814 2.442 . 0 0 "[ . 1 . 2]" 1
1913 1 69 LEU MD2 1 92 LEU QB . . 5.340 4.011 3.623 4.593 . 0 0 "[ . 1 . 2]" 1
1914 1 70 LYS H 1 70 LYS QG . . 3.980 2.678 2.033 3.912 . 0 0 "[ . 1 . 2]" 1
1915 1 70 LYS QE 1 70 LYS QG . . 3.370 2.466 1.996 2.982 . 0 0 "[ . 1 . 2]" 1
1916 1 70 LYS QG 1 71 LEU H . . 4.550 2.877 2.389 4.297 . 0 0 "[ . 1 . 2]" 1
1917 1 70 LYS QG 1 71 LEU MD2 . . 3.530 2.202 1.771 3.409 . 0 0 "[ . 1 . 2]" 1
1918 1 70 LYS QG 1 82 ALA HA . . 4.150 3.579 2.680 4.152 0.002 6 0 "[ . 1 . 2]" 1
1919 1 70 LYS QG 1 82 ALA MB . . 3.480 2.127 1.777 2.742 . 0 0 "[ . 1 . 2]" 1
1920 1 71 LEU HB2 1 74 GLN QB . . 5.340 3.671 3.095 4.127 . 0 0 "[ . 1 . 2]" 1
1921 1 71 LEU HB3 1 74 GLN QB . . 4.360 2.259 1.983 2.723 . 0 0 "[ . 1 . 2]" 1
1922 1 72 PHE HA 1 75 ASN QD . . 3.690 3.020 1.935 3.700 0.010 5 0 "[ . 1 . 2]" 1
1923 1 72 PHE QD 1 73 LEU QB . . 5.340 4.828 4.541 5.059 . 0 0 "[ . 1 . 2]" 1
1924 1 73 LEU H 1 73 LEU QB . . 3.450 2.402 2.300 2.614 . 0 0 "[ . 1 . 2]" 1
1925 1 73 LEU QB 1 75 ASN H . . 5.140 4.465 4.369 4.576 . 0 0 "[ . 1 . 2]" 1
1926 1 73 LEU QB 1 80 ALA MB . . 3.300 1.985 1.759 2.120 . 0 0 "[ . 1 . 2]" 1
1927 1 73 LEU QB 1 83 LEU MD2 . . 4.150 3.189 2.853 4.151 0.001 14 0 "[ . 1 . 2]" 1
1928 1 73 LEU MD1 1 81 ARG QD . . 4.870 3.111 2.105 4.038 . 0 0 "[ . 1 . 2]" 1
1929 1 74 GLN H 1 74 GLN QB . . 3.050 2.266 2.184 2.365 . 0 0 "[ . 1 . 2]" 1
1930 1 74 GLN QB 1 74 GLN HE22 . . 4.550 4.145 4.049 4.186 . 0 0 "[ . 1 . 2]" 1
1931 1 74 GLN QB 1 78 ALA HA . . 5.110 3.564 3.368 3.853 . 0 0 "[ . 1 . 2]" 1
1932 1 74 GLN QB 1 80 ALA MB . . 4.780 3.990 3.538 4.399 . 0 0 "[ . 1 . 2]" 1
1933 1 75 ASN H 1 75 ASN QD . . 4.180 2.744 1.879 3.708 . 0 0 "[ . 1 . 2]" 1
1934 1 75 ASN QB 1 76 PHE H . . 4.010 3.159 2.397 3.395 . 0 0 "[ . 1 . 2]" 1
1935 1 75 ASN QB 1 76 PHE QE . . 4.540 4.215 3.131 4.629 0.089 19 0 "[ . 1 . 2]" 1
1936 1 76 PHE HB2 1 77 LYS QB . . 5.130 3.530 3.368 3.714 . 0 0 "[ . 1 . 2]" 1
1937 1 76 PHE HB3 1 77 LYS QB . . 5.020 3.978 3.881 4.143 . 0 0 "[ . 1 . 2]" 1
1938 1 77 LYS H 1 77 LYS QB . . 3.520 2.999 2.980 3.025 . 0 0 "[ . 1 . 2]" 1
1939 1 77 LYS QB 1 78 ALA H . . 3.990 3.473 3.118 3.652 . 0 0 "[ . 1 . 2]" 1
1940 1 77 LYS QB 1 80 ALA H . . 4.060 2.907 2.411 3.146 . 0 0 "[ . 1 . 2]" 1
1941 1 77 LYS QB 1 80 ALA MB . . 2.920 2.136 1.933 2.418 . 0 0 "[ . 1 . 2]" 1
1942 1 77 LYS QG 1 79 GLY QA . . 5.080 3.799 3.067 4.839 . 0 0 "[ . 1 . 2]" 1
1943 1 78 ALA MB 1 79 GLY QA . . 3.970 3.933 3.870 3.970 0.000 1 0 "[ . 1 . 2]" 1
1944 1 81 ARG H 1 81 ARG QB . . 3.280 2.486 2.329 2.825 . 0 0 "[ . 1 . 2]" 1
1945 1 81 ARG H 1 81 ARG QD . . 4.360 4.055 3.752 4.175 . 0 0 "[ . 1 . 2]" 1
1946 1 81 ARG HA 1 81 ARG QD . . 4.240 4.027 3.643 4.252 0.012 18 0 "[ . 1 . 2]" 1
1947 1 81 ARG QB 1 81 ARG QD . . 3.150 2.104 2.042 2.146 . 0 0 "[ . 1 . 2]" 1
1948 1 81 ARG QB 1 82 ALA H . . 3.350 2.171 1.950 2.630 . 0 0 "[ . 1 . 2]" 1
1949 1 81 ARG QD 1 83 LEU HA . . 4.590 3.456 2.975 4.037 . 0 0 "[ . 1 . 2]" 1
1950 1 81 ARG QD 1 87 GLU HE2 . . 4.750 4.363 3.930 4.750 . 0 0 "[ . 1 . 2]" 1
1951 1 83 LEU HA 1 87 GLU QB . . 4.840 3.194 2.605 3.625 . 0 0 "[ . 1 . 2]" 1
1952 1 83 LEU HB2 1 87 GLU QB . . 4.980 3.314 3.122 3.552 . 0 0 "[ . 1 . 2]" 1
1953 1 83 LEU HB3 1 87 GLU QB . . 4.140 1.875 1.784 2.071 . 0 0 "[ . 1 . 2]" 1
1954 1 83 LEU HB3 1 87 GLU QG . . 5.150 3.915 3.840 4.137 . 0 0 "[ . 1 . 2]" 1
1955 1 83 LEU HG 1 87 GLU QB . . 3.740 2.857 1.950 3.269 . 0 0 "[ . 1 . 2]" 1
1956 1 83 LEU MD2 1 87 GLU QB . . 4.450 4.019 2.965 4.275 . 0 0 "[ . 1 . 2]" 1
1957 1 84 SER H 1 84 SER QB . . 3.570 2.225 2.137 2.580 . 0 0 "[ . 1 . 2]" 1
1958 1 84 SER H 1 87 GLU QB . . 3.460 2.043 1.934 2.709 . 0 0 "[ . 1 . 2]" 1
1959 1 84 SER H 1 87 GLU QG . . 4.310 3.417 3.121 3.795 . 0 0 "[ . 1 . 2]" 1
1960 1 86 ALA MB 1 87 GLU QG . . 3.670 3.308 3.045 3.595 . 0 0 "[ . 1 . 2]" 1
1961 1 87 GLU H 1 87 GLU QB . . 3.240 2.372 2.246 2.457 . 0 0 "[ . 1 . 2]" 1
1962 1 87 GLU H 1 87 GLU QG . . 3.170 2.418 2.164 2.789 . 0 0 "[ . 1 . 2]" 1
1963 1 87 GLU HA 1 87 GLU QG . . 3.620 2.303 2.242 2.383 . 0 0 "[ . 1 . 2]" 1
1964 1 87 GLU QB 1 88 THR H . . 3.760 2.617 2.359 3.055 . 0 0 "[ . 1 . 2]" 1
1965 1 87 GLU QB 1 88 THR HA . . 5.340 3.906 3.820 4.075 . 0 0 "[ . 1 . 2]" 1
1966 1 87 GLU QB 1 88 THR MG . . 5.340 4.981 4.848 5.130 . 0 0 "[ . 1 . 2]" 1
1967 1 89 LYS HA 1 89 LYS QD . . 4.080 3.354 1.986 4.001 . 0 0 "[ . 1 . 2]" 1
1968 1 89 LYS HA 1 92 LEU QB . . 3.420 2.498 2.056 3.081 . 0 0 "[ . 1 . 2]" 1
1969 1 91 PHE H 1 92 LEU QB . . 4.440 4.148 3.943 4.416 . 0 0 "[ . 1 . 2]" 1
1970 1 92 LEU HA 1 96 ASP QB . . 4.740 3.313 2.917 3.635 . 0 0 "[ . 1 . 2]" 1
1971 1 92 LEU QB 1 92 LEU MD1 . . 3.210 2.349 2.252 2.412 . 0 0 "[ . 1 . 2]" 1
1972 1 92 LEU QB 1 92 LEU MD2 . . 3.270 2.077 2.025 2.114 . 0 0 "[ . 1 . 2]" 1
1973 1 92 LEU QB 1 93 LYS H . . 3.920 2.370 2.216 2.712 . 0 0 "[ . 1 . 2]" 1
1974 1 92 LEU QB 1 96 ASP QB . . 4.820 4.094 3.792 4.481 . 0 0 "[ . 1 . 2]" 1
1975 1 92 LEU MD1 1 96 ASP QB . . 3.540 2.118 1.836 2.538 . 0 0 "[ . 1 . 2]" 1
1976 1 93 LYS H 1 93 LYS QG . . 3.370 2.949 2.753 3.376 0.006 10 0 "[ . 1 . 2]" 1
1977 1 93 LYS HA 1 93 LYS QG . . 2.950 2.097 1.975 2.212 . 0 0 "[ . 1 . 2]" 1
1978 1 93 LYS HA 1 96 ASP QB . . 3.760 2.966 2.622 3.260 . 0 0 "[ . 1 . 2]" 1
1979 1 93 LYS HB2 1 93 LYS QG . . 2.660 2.347 2.179 2.539 . 0 0 "[ . 1 . 2]" 1
1980 1 96 ASP QB 1 99 GLY H . . 4.340 3.008 2.541 3.570 . 0 0 "[ . 1 . 2]" 1
1981 1 96 ASP QB 1 102 LYS H . . 4.840 4.613 4.047 4.743 . 0 0 "[ . 1 . 2]" 1
1982 1 96 ASP QB 1 103 ILE MD . . 3.730 2.514 2.255 2.807 . 0 0 "[ . 1 . 2]" 1
1983 1 97 SER QB 1 98 ASP H . . 3.860 3.074 2.251 3.639 . 0 0 "[ . 1 . 2]" 1
1984 1 97 SER QB 1 107 GLU HG2 . . 4.050 3.453 2.886 4.054 0.004 6 0 "[ . 1 . 2]" 1
1985 1 98 ASP H 1 98 ASP QB . . 3.580 2.614 2.294 3.052 . 0 0 "[ . 1 . 2]" 1
1986 1 98 ASP QB 1 99 GLY H . . 4.180 3.812 3.622 4.001 . 0 0 "[ . 1 . 2]" 1
1987 1 99 GLY QA 1 101 GLY H . . 4.660 3.158 2.888 3.294 . 0 0 "[ . 1 . 2]" 1
1988 1 100 ASP H 1 100 ASP QB . . 3.460 2.660 2.190 2.890 . 0 0 "[ . 1 . 2]" 1
1989 1 100 ASP QB 1 102 LYS H . . 4.640 3.360 2.503 3.856 . 0 0 "[ . 1 . 2]" 1
1990 1 100 ASP QB 1 102 LYS QE . . 4.810 3.611 2.227 4.240 . 0 0 "[ . 1 . 2]" 1
1991 1 102 LYS H 1 102 LYS QB . . 3.640 2.876 2.572 3.330 . 0 0 "[ . 1 . 2]" 1
1992 1 102 LYS H 1 102 LYS QG . . 3.390 2.674 2.447 3.111 . 0 0 "[ . 1 . 2]" 1
1993 1 102 LYS H 1 102 LYS QD . . 5.340 4.553 3.044 4.998 . 0 0 "[ . 1 . 2]" 1
1994 1 102 LYS H 1 102 LYS QE . . 4.590 3.945 2.523 4.604 0.014 14 0 "[ . 1 . 2]" 1
1995 1 102 LYS HA 1 102 LYS QD . . 4.440 4.017 3.514 4.325 . 0 0 "[ . 1 . 2]" 1
1996 1 102 LYS HA 1 102 LYS QE . . 4.600 4.498 3.981 4.600 0.000 5 0 "[ . 1 . 2]" 1
1997 1 102 LYS QB 1 102 LYS QD . . 3.240 2.302 2.121 2.516 . 0 0 "[ . 1 . 2]" 1
1998 1 102 LYS QB 1 102 LYS QE . . 4.240 2.107 1.836 3.618 . 0 0 "[ . 1 . 2]" 1
1999 1 102 LYS QB 1 103 ILE H . . 3.340 2.662 2.184 2.940 . 0 0 "[ . 1 . 2]" 1
2000 1 102 LYS QE 1 102 LYS QG . . 3.330 2.373 2.134 2.537 . 0 0 "[ . 1 . 2]" 1
2001 1 105 ILE H 1 105 ILE QG . . 4.390 3.883 3.841 3.939 . 0 0 "[ . 1 . 2]" 1
2002 1 105 ILE HA 1 105 ILE QG . . 2.920 2.296 2.124 2.414 . 0 0 "[ . 1 . 2]" 1
2003 1 105 ILE MG 1 106 ASP QB . . 3.820 3.593 3.289 3.821 0.001 2 0 "[ . 1 . 2]" 1
2004 1 106 ASP H 1 106 ASP QB . . 2.960 2.742 2.729 2.754 . 0 0 "[ . 1 . 2]" 1
2005 1 106 ASP HA 1 106 ASP QB . . 2.630 2.242 2.182 2.293 . 0 0 "[ . 1 . 2]" 1
2006 1 106 ASP QB 1 107 GLU H . . 3.380 3.187 2.861 3.446 0.066 13 0 "[ . 1 . 2]" 1
2007 1 109 ALA H 1 112 ILE QG . . 5.300 4.111 4.028 4.182 . 0 0 "[ . 1 . 2]" 1
2008 1 109 ALA HA 1 112 ILE QG . . 4.030 1.988 1.922 2.092 . 0 0 "[ . 1 . 2]" 1
2009 1 111 MET H 1 112 ILE QG . . 4.930 3.686 3.439 3.975 . 0 0 "[ . 1 . 2]" 1
2010 1 112 ILE H 1 113 LYS QB . . 4.550 3.858 3.686 4.140 . 0 0 "[ . 1 . 2]" 1
2011 1 112 ILE HA 1 112 ILE QG . . 3.280 3.279 3.217 3.324 0.044 10 0 "[ . 1 . 2]" 1
2012 1 112 ILE QG 1 112 ILE MG . . 3.050 2.359 2.299 2.480 . 0 0 "[ . 1 . 2]" 1
2013 1 112 ILE QG 1 113 LYS H . . 4.050 2.053 1.806 2.464 . 0 0 "[ . 1 . 2]" 1
2014 1 112 ILE QG 1 113 LYS HA . . 5.150 3.795 3.183 4.132 . 0 0 "[ . 1 . 2]" 1
2015 1 113 LYS H 1 113 LYS QB . . 2.660 2.182 2.174 2.192 . 0 0 "[ . 1 . 2]" 1
2016 1 113 LYS QB 1 114 GLY H . . 3.550 3.184 2.747 3.320 . 0 0 "[ . 1 . 2]" 1
2017 1 113 LYS QB 1 114 GLY QA . . 4.720 4.135 3.932 4.396 . 0 0 "[ . 1 . 2]" 1
2018 1 113 LYS QE 1 113 LYS QG . . 2.900 2.219 2.078 2.645 . 0 0 "[ . 1 . 2]" 1
2019 1 113 LYS QG 1 114 GLY H . . 4.010 3.995 3.604 4.021 0.011 16 0 "[ . 1 . 2]" 1
2020 1 113 LYS QG 1 114 GLY QA . . 3.940 3.768 3.521 3.926 . 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 303
_Distance_constraint_stats_list.Viol_count 169
_Distance_constraint_stats_list.Viol_total 51.453
_Distance_constraint_stats_list.Viol_max 0.078
_Distance_constraint_stats_list.Viol_rms 0.0038
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0004
_Distance_constraint_stats_list.Viol_average_violations_only 0.0152
_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 6 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 PHE 0.001 0.001 9 0 "[ . 1 . 2]"
1 9 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 LYS 0.014 0.013 2 0 "[ . 1 . 2]"
1 14 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 VAL 0.014 0.013 2 0 "[ . 1 . 2]"
1 18 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 CYS 0.000 0.000 3 0 "[ . 1 . 2]"
1 25 LYS 0.004 0.003 19 0 "[ . 1 . 2]"
1 26 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 PHE 0.004 0.003 6 0 "[ . 1 . 2]"
1 31 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 HIS 0.025 0.009 16 0 "[ . 1 . 2]"
1 33 LYS 0.015 0.008 12 0 "[ . 1 . 2]"
1 34 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 PHE 0.013 0.004 10 0 "[ . 1 . 2]"
1 36 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 LYS 0.015 0.008 12 0 "[ . 1 . 2]"
1 39 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 LEU 0.053 0.010 10 0 "[ . 1 . 2]"
1 42 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 GLU 0.005 0.003 3 0 "[ . 1 . 2]"
1 49 VAL 0.247 0.025 13 0 "[ . 1 . 2]"
1 50 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 LYS 0.005 0.003 3 0 "[ . 1 . 2]"
1 52 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 PHE 0.039 0.022 12 0 "[ . 1 . 2]"
1 54 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ILE 0.036 0.022 12 0 "[ . 1 . 2]"
1 56 ILE 1.024 0.078 4 0 "[ . 1 . 2]"
1 57 ASP 0.012 0.003 19 0 "[ . 1 . 2]"
1 58 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 ASP 0.009 0.007 19 0 "[ . 1 . 2]"
1 60 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 SER 0.063 0.041 17 0 "[ . 1 . 2]"
1 62 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 PHE 0.063 0.041 17 0 "[ . 1 . 2]"
1 64 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 GLU 0.000 0.000 19 0 "[ . 1 . 2]"
1 68 GLU 0.018 0.007 19 0 "[ . 1 . 2]"
1 69 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 LEU 0.000 0.000 19 0 "[ . 1 . 2]"
1 72 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 GLN 0.019 0.005 2 0 "[ . 1 . 2]"
1 75 ASN 0.001 0.001 9 0 "[ . 1 . 2]"
1 76 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 LYS 1.024 0.078 4 0 "[ . 1 . 2]"
1 78 ALA 0.010 0.005 2 0 "[ . 1 . 2]"
1 80 ALA 0.005 0.002 2 0 "[ . 1 . 2]"
1 81 ARG 0.074 0.017 4 0 "[ . 1 . 2]"
1 82 ALA 0.005 0.002 2 0 "[ . 1 . 2]"
1 83 LEU 0.096 0.017 4 0 "[ . 1 . 2]"
1 84 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 GLU 0.029 0.008 17 0 "[ . 1 . 2]"
1 88 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 PHE 0.025 0.009 16 0 "[ . 1 . 2]"
1 92 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 ASP 0.026 0.025 14 0 "[ . 1 . 2]"
1 101 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 LYS 0.026 0.025 14 0 "[ . 1 . 2]"
1 103 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 ILE 0.888 0.057 13 0 "[ . 1 . 2]"
1 106 ASP 0.278 0.051 12 0 "[ . 1 . 2]"
1 107 GLU 0.302 0.030 16 0 "[ . 1 . 2]"
1 108 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 ALA 0.339 0.057 13 0 "[ . 1 . 2]"
1 110 ALA 0.278 0.051 12 0 "[ . 1 . 2]"
1 111 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 ILE 0.040 0.010 10 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 49 VAL HB 1 105 ILE MG . . 6.000 6.012 6.000 6.025 0.025 13 0 "[ . 1 . 2]" 2
2 1 50 LYS HG2 1 105 ILE MG . . 6.000 2.824 2.518 3.151 . 0 0 "[ . 1 . 2]" 2
3 1 105 ILE HG12 1 107 GLU H . . 6.000 6.015 6.000 6.030 0.030 16 0 "[ . 1 . 2]" 2
4 1 41 LEU QD 1 108 PHE QE . . 6.000 3.722 3.198 4.014 . 0 0 "[ . 1 . 2]" 2
5 1 105 ILE HG13 1 109 ALA H . . 6.000 6.004 5.911 6.057 0.057 13 0 "[ . 1 . 2]" 2
6 1 49 VAL QG 1 109 ALA H . . 6.000 3.633 3.403 3.815 . 0 0 "[ . 1 . 2]" 2
7 1 106 ASP HB2 1 110 ALA H . . 6.000 6.004 5.935 6.051 0.051 12 0 "[ . 1 . 2]" 2
8 1 36 PHE QD 1 111 MET HG2 . . 6.000 5.470 5.082 5.915 . 0 0 "[ . 1 . 2]" 2
9 1 36 PHE QD 1 111 MET HG3 . . 6.000 3.904 3.453 4.431 . 0 0 "[ . 1 . 2]" 2
10 1 69 LEU QD 1 111 MET ME . . 6.000 3.373 2.931 3.845 . 0 0 "[ . 1 . 2]" 2
11 1 41 LEU QD 1 112 ILE HA . . 6.000 5.962 5.725 6.010 0.010 10 0 "[ . 1 . 2]" 2
12 1 49 VAL QG 1 112 ILE HG12 . . 6.000 3.303 3.162 3.605 . 0 0 "[ . 1 . 2]" 2
13 1 42 SER HA 1 112 ILE HG13 . . 6.000 4.743 3.880 5.498 . 0 0 "[ . 1 . 2]" 2
14 1 49 VAL QG 1 112 ILE H . . 6.000 4.476 4.248 4.610 . 0 0 "[ . 1 . 2]" 2
15 1 44 LYS HB3 1 112 ILE MD . . 6.000 5.201 4.551 5.617 . 0 0 "[ . 1 . 2]" 2
16 1 16 GLU HB2 1 39 CYS HA . . 6.000 4.461 3.741 5.214 . 0 0 "[ . 1 . 2]" 2
17 1 16 GLU HB3 1 39 CYS HA . . 6.000 3.174 2.069 3.885 . 0 0 "[ . 1 . 2]" 2
18 1 13 LYS HB2 1 16 GLU QG . . 6.000 2.579 1.906 3.651 . 0 0 "[ . 1 . 2]" 2
19 1 13 LYS HB2 1 17 VAL H . . 6.000 4.508 3.417 5.529 . 0 0 "[ . 1 . 2]" 2
20 1 13 LYS HG2 1 17 VAL H . . 6.000 5.623 4.502 6.013 0.013 2 0 "[ . 1 . 2]" 2
21 1 17 VAL QG 1 21 LEU HG . . 6.000 3.924 3.761 4.009 . 0 0 "[ . 1 . 2]" 2
22 1 17 VAL QG 1 21 LEU H . . 6.000 4.470 4.328 4.697 . 0 0 "[ . 1 . 2]" 2
23 1 17 VAL QG 1 35 PHE HZ . . 6.000 4.547 4.080 4.907 . 0 0 "[ . 1 . 2]" 2
24 1 17 VAL QG 1 35 PHE QE . . 6.000 3.928 3.589 4.449 . 0 0 "[ . 1 . 2]" 2
25 1 17 VAL QG 1 39 CYS HA . . 6.000 3.604 2.160 4.089 . 0 0 "[ . 1 . 2]" 2
26 1 17 VAL QG 1 39 CYS HB2 . . 6.000 3.140 2.486 3.806 . 0 0 "[ . 1 . 2]" 2
27 1 17 VAL QG 1 39 CYS HB3 . . 6.000 2.698 1.987 3.814 . 0 0 "[ . 1 . 2]" 2
28 1 17 VAL QG 1 76 PHE HB2 . . 6.000 4.079 3.740 4.210 . 0 0 "[ . 1 . 2]" 2
29 1 17 VAL QG 1 76 PHE QE . . 6.000 2.813 2.036 3.680 . 0 0 "[ . 1 . 2]" 2
30 1 13 LYS H 1 17 VAL QG . . 6.000 3.272 2.773 3.587 . 0 0 "[ . 1 . 2]" 2
31 1 14 ASP HB2 1 17 VAL QG . . 6.000 3.904 3.506 4.408 . 0 0 "[ . 1 . 2]" 2
32 1 18 THR HA 1 21 LEU QD . . 6.000 2.388 1.949 2.789 . 0 0 "[ . 1 . 2]" 2
33 1 17 VAL QG 1 19 ALA H . . 6.000 4.316 4.093 4.417 . 0 0 "[ . 1 . 2]" 2
34 1 20 ALA MB 1 39 CYS HB2 . . 6.000 4.238 2.856 4.785 . 0 0 "[ . 1 . 2]" 2
35 1 20 ALA MB 1 39 CYS HB3 . . 6.000 3.413 2.948 4.253 . 0 0 "[ . 1 . 2]" 2
36 1 21 LEU HA 1 73 LEU QD . . 6.000 3.084 2.426 3.405 . 0 0 "[ . 1 . 2]" 2
37 1 21 LEU QD 1 35 PHE QE . . 6.000 2.828 2.357 3.292 . 0 0 "[ . 1 . 2]" 2
38 1 21 LEU QD 1 73 LEU HA . . 6.000 2.932 2.580 3.258 . 0 0 "[ . 1 . 2]" 2
39 1 21 LEU QD 1 73 LEU QD . . 6.000 1.960 1.742 2.489 . 0 0 "[ . 1 . 2]" 2
40 1 21 LEU QD 1 76 PHE HB2 . . 6.000 2.078 1.823 2.402 . 0 0 "[ . 1 . 2]" 2
41 1 21 LEU QD 1 76 PHE HB3 . . 6.000 2.106 1.839 2.437 . 0 0 "[ . 1 . 2]" 2
42 1 21 LEU QD 1 76 PHE QD . . 6.000 2.607 1.950 3.202 . 0 0 "[ . 1 . 2]" 2
43 1 21 LEU QD 1 80 ALA MB . . 6.000 2.590 2.296 2.767 . 0 0 "[ . 1 . 2]" 2
44 1 23 GLY HA3 1 25 LYS H . . 6.000 4.652 4.555 4.729 . 0 0 "[ . 1 . 2]" 2
45 1 24 CYS HB2 1 30 PHE H . . 6.000 4.863 3.837 6.000 0.000 3 0 "[ . 1 . 2]" 2
46 1 24 CYS HB3 1 31 ASP H . . 6.000 3.410 2.623 4.728 . 0 0 "[ . 1 . 2]" 2
47 1 25 LYS HA 1 81 ARG HD3 . . 6.000 5.442 4.431 6.003 0.003 19 0 "[ . 1 . 2]" 2
48 1 26 ALA H 1 29 SER HB2 . . 6.000 4.784 3.917 5.583 . 0 0 "[ . 1 . 2]" 2
49 1 27 ALA HA 1 81 ARG HD2 . . 6.000 5.290 4.810 5.759 . 0 0 "[ . 1 . 2]" 2
50 1 28 GLY H 1 87 GLU HG3 . . 6.000 3.808 3.447 4.376 . 0 0 "[ . 1 . 2]" 2
51 1 30 PHE HB2 1 83 LEU QD . . 6.000 2.560 1.977 3.143 . 0 0 "[ . 1 . 2]" 2
52 1 30 PHE HB2 1 87 GLU HB2 . . 6.000 5.384 4.183 6.003 0.003 6 0 "[ . 1 . 2]" 2
53 1 30 PHE HB3 1 73 LEU QD . . 6.000 4.865 4.349 5.648 . 0 0 "[ . 1 . 2]" 2
54 1 30 PHE HB3 1 83 LEU QD . . 6.000 2.785 2.098 3.532 . 0 0 "[ . 1 . 2]" 2
55 1 30 PHE QD 1 83 LEU QD . . 6.000 2.373 1.939 2.667 . 0 0 "[ . 1 . 2]" 2
56 1 30 PHE QE 1 32 HIS HB2 . . 6.000 4.121 3.609 5.123 . 0 0 "[ . 1 . 2]" 2
57 1 32 HIS HE1 1 90 ALA MB . . 6.000 4.233 2.405 5.987 . 0 0 "[ . 1 . 2]" 2
58 1 32 HIS HE1 1 94 ALA MB . . 6.000 2.438 1.912 3.480 . 0 0 "[ . 1 . 2]" 2
59 1 31 ASP HA 1 33 LYS H . . 6.000 4.133 3.761 4.779 . 0 0 "[ . 1 . 2]" 2
60 1 7 ALA MB 1 75 ASN HB2 . . 6.000 4.863 4.052 5.660 . 0 0 "[ . 1 . 2]" 2
61 1 21 LEU QD 1 35 PHE HZ . . 6.000 2.575 1.992 3.328 . 0 0 "[ . 1 . 2]" 2
62 1 34 LYS HA 1 37 LYS H . . 6.000 3.366 3.263 3.540 . 0 0 "[ . 1 . 2]" 2
63 1 33 LYS HG2 1 37 LYS QB . . 6.000 5.783 5.464 6.008 0.008 12 0 "[ . 1 . 2]" 2
64 1 12 LEU QD 1 40 GLY HA2 . . 6.000 5.018 4.100 5.228 . 0 0 "[ . 1 . 2]" 2
65 1 41 LEU HA 1 44 LYS HB2 . . 6.000 2.283 1.996 3.110 . 0 0 "[ . 1 . 2]" 2
66 1 35 PHE QD 1 41 LEU HG . . 6.000 5.862 5.398 6.004 0.004 10 0 "[ . 1 . 2]" 2
67 1 12 LEU QD 1 41 LEU H . . 6.000 3.239 2.760 3.690 . 0 0 "[ . 1 . 2]" 2
68 1 41 LEU QD 1 108 PHE HZ . . 6.000 3.298 2.537 3.891 . 0 0 "[ . 1 . 2]" 2
69 1 41 LEU QD 1 112 ILE MD . . 6.000 2.990 2.710 3.132 . 0 0 "[ . 1 . 2]" 2
70 1 41 LEU QD 1 112 ILE MG . . 6.000 3.327 3.067 3.613 . 0 0 "[ . 1 . 2]" 2
71 1 36 PHE QD 1 41 LEU QD . . 6.000 1.994 1.860 2.245 . 0 0 "[ . 1 . 2]" 2
72 1 41 LEU QD 1 49 VAL HA . . 6.000 2.901 2.650 3.116 . 0 0 "[ . 1 . 2]" 2
73 1 42 SER HA 1 49 VAL QG . . 6.000 4.758 4.473 5.072 . 0 0 "[ . 1 . 2]" 2
74 1 36 PHE HB2 1 42 SER HB2 . . 6.000 3.551 2.442 4.704 . 0 0 "[ . 1 . 2]" 2
75 1 36 PHE HB2 1 42 SER HB3 . . 6.000 4.116 2.904 5.262 . 0 0 "[ . 1 . 2]" 2
76 1 36 PHE HB2 1 42 SER H . . 6.000 4.091 3.525 4.549 . 0 0 "[ . 1 . 2]" 2
77 1 44 LYS HB2 1 49 VAL QG . . 6.000 3.155 2.553 3.565 . 0 0 "[ . 1 . 2]" 2
78 1 44 LYS HB3 1 49 VAL QG . . 6.000 3.164 2.618 3.465 . 0 0 "[ . 1 . 2]" 2
79 1 42 SER H 1 44 LYS HG3 . . 6.000 5.362 5.096 5.942 . 0 0 "[ . 1 . 2]" 2
80 1 8 PHE HA 1 11 VAL QG . . 6.000 2.219 2.021 2.792 . 0 0 "[ . 1 . 2]" 2
81 1 8 PHE HB2 1 12 LEU QD . . 6.000 4.465 3.932 4.796 . 0 0 "[ . 1 . 2]" 2
82 1 8 PHE HB3 1 11 VAL QG . . 6.000 4.144 3.678 4.312 . 0 0 "[ . 1 . 2]" 2
83 1 8 PHE HB3 1 12 LEU QD . . 6.000 3.286 2.632 3.726 . 0 0 "[ . 1 . 2]" 2
84 1 8 PHE H 1 75 ASN HB2 . . 6.000 5.387 4.836 6.001 0.001 9 0 "[ . 1 . 2]" 2
85 1 45 SER HB2 1 48 GLU HG3 . . 6.000 5.170 4.484 5.336 . 0 0 "[ . 1 . 2]" 2
86 1 45 SER HB3 1 48 GLU HB3 . . 6.000 4.664 3.168 5.311 . 0 0 "[ . 1 . 2]" 2
87 1 45 SER H 1 49 VAL QG . . 6.000 3.738 3.269 4.047 . 0 0 "[ . 1 . 2]" 2
88 1 46 THR HA 1 49 VAL QG . . 6.000 2.140 1.926 2.553 . 0 0 "[ . 1 . 2]" 2
89 1 46 THR HB 1 50 LYS HE2 . . 6.000 5.088 4.570 5.971 . 0 0 "[ . 1 . 2]" 2
90 1 47 ASP HA 1 50 LYS HB3 . . 6.000 5.321 4.992 5.616 . 0 0 "[ . 1 . 2]" 2
91 1 45 SER H 1 48 GLU HB3 . . 6.000 3.994 3.892 4.108 . 0 0 "[ . 1 . 2]" 2
92 1 48 GLU H 1 51 LYS HG2 . . 6.000 4.930 4.040 6.003 0.003 3 0 "[ . 1 . 2]" 2
93 1 49 VAL QG 1 108 PHE QD . . 6.000 2.666 1.942 3.126 . 0 0 "[ . 1 . 2]" 2
94 1 49 VAL QG 1 108 PHE QE . . 6.000 2.501 2.002 3.057 . 0 0 "[ . 1 . 2]" 2
95 1 49 VAL QG 1 109 ALA HA . . 6.000 1.966 1.920 2.056 . 0 0 "[ . 1 . 2]" 2
96 1 49 VAL QG 1 109 ALA MB . . 6.000 1.779 1.686 1.861 . 0 0 "[ . 1 . 2]" 2
97 1 49 VAL QG 1 112 ILE HG13 . . 6.000 2.921 2.494 3.180 . 0 0 "[ . 1 . 2]" 2
98 1 49 VAL QG 1 112 ILE MD . . 6.000 1.540 1.483 1.753 . 0 0 "[ . 1 . 2]" 2
99 1 49 VAL QG 1 112 ILE MG . . 6.000 3.445 3.192 3.580 . 0 0 "[ . 1 . 2]" 2
100 1 41 LEU HA 1 49 VAL QG . . 6.000 4.082 3.812 4.422 . 0 0 "[ . 1 . 2]" 2
101 1 44 LYS HA 1 49 VAL QG . . 6.000 4.879 4.317 5.239 . 0 0 "[ . 1 . 2]" 2
102 1 44 LYS H 1 49 VAL QG . . 6.000 4.293 3.686 4.729 . 0 0 "[ . 1 . 2]" 2
103 1 49 VAL QG 1 52 ALA MB . . 6.000 3.108 2.927 3.294 . 0 0 "[ . 1 . 2]" 2
104 1 49 VAL QG 1 53 PHE HB2 . . 6.000 3.642 3.394 3.958 . 0 0 "[ . 1 . 2]" 2
105 1 49 VAL QG 1 53 PHE HB3 . . 6.000 4.434 4.054 4.731 . 0 0 "[ . 1 . 2]" 2
106 1 50 LYS HB2 1 105 ILE MD . . 6.000 3.864 3.741 4.090 . 0 0 "[ . 1 . 2]" 2
107 1 50 LYS HB2 1 105 ILE MG . . 6.000 5.273 4.923 5.654 . 0 0 "[ . 1 . 2]" 2
108 1 11 VAL QG 1 52 ALA HA . . 6.000 3.206 2.533 3.585 . 0 0 "[ . 1 . 2]" 2
109 1 41 LEU QD 1 52 ALA H . . 6.000 4.293 3.985 4.584 . 0 0 "[ . 1 . 2]" 2
110 1 49 VAL QG 1 52 ALA H . . 6.000 4.050 3.871 4.175 . 0 0 "[ . 1 . 2]" 2
111 1 41 LEU QD 1 52 ALA MB . . 6.000 2.077 1.819 2.279 . 0 0 "[ . 1 . 2]" 2
112 1 53 PHE HA 1 55 ILE HG12 . . 6.000 5.226 4.619 6.022 0.022 12 0 "[ . 1 . 2]" 2
113 1 53 PHE HB2 1 64 ILE MD . . 6.000 4.090 3.626 4.502 . 0 0 "[ . 1 . 2]" 2
114 1 49 VAL QG 1 53 PHE H . . 6.000 3.981 3.676 4.273 . 0 0 "[ . 1 . 2]" 2
115 1 54 ALA MB 1 60 LYS HE2 . . 6.000 3.463 2.001 5.237 . 0 0 "[ . 1 . 2]" 2
116 1 9 ALA HA 1 12 LEU H . . 6.000 4.409 3.857 4.690 . 0 0 "[ . 1 . 2]" 2
117 1 6 MET HG3 1 9 ALA MB . . 6.000 3.822 1.801 5.225 . 0 0 "[ . 1 . 2]" 2
118 1 8 PHE HZ 1 55 ILE MD . . 6.000 4.797 3.004 5.575 . 0 0 "[ . 1 . 2]" 2
119 1 55 ILE MD 1 75 ASN HB2 . . 6.000 5.037 4.360 5.920 . 0 0 "[ . 1 . 2]" 2
120 1 56 ILE HA 1 75 ASN HB2 . . 6.000 2.767 2.140 3.571 . 0 0 "[ . 1 . 2]" 2
121 1 56 ILE HA 1 75 ASN HD22 . . 6.000 5.139 2.972 5.580 . 0 0 "[ . 1 . 2]" 2
122 1 56 ILE HA 1 77 LYS H . . 6.000 6.051 6.028 6.078 0.078 4 0 "[ . 1 . 2]" 2
123 1 56 ILE MD 1 72 PHE HZ . . 6.000 5.435 4.664 5.992 . 0 0 "[ . 1 . 2]" 2
124 1 56 ILE MG 1 68 GLU HB2 . . 6.000 4.911 3.920 5.515 . 0 0 "[ . 1 . 2]" 2
125 1 56 ILE MG 1 69 LEU QD . . 6.000 4.570 4.138 4.790 . 0 0 "[ . 1 . 2]" 2
126 1 57 ASP HA 1 64 ILE HG12 . . 6.000 3.700 3.097 3.961 . 0 0 "[ . 1 . 2]" 2
127 1 57 ASP HA 1 68 GLU HB2 . . 6.000 5.682 4.216 6.003 0.003 19 0 "[ . 1 . 2]" 2
128 1 53 PHE HZ 1 57 ASP HB3 . . 6.000 5.681 4.861 6.003 0.003 1 0 "[ . 1 . 2]" 2
129 1 58 GLN HE21 1 71 LEU HB3 . . 6.000 3.507 2.903 4.766 . 0 0 "[ . 1 . 2]" 2
130 1 58 GLN HE22 1 71 LEU QD . . 6.000 3.244 2.617 4.147 . 0 0 "[ . 1 . 2]" 2
131 1 59 ASP H 1 68 GLU HG2 . . 6.000 5.482 4.127 6.007 0.007 19 0 "[ . 1 . 2]" 2
132 1 59 ASP HB3 1 61 SER H . . 6.000 4.740 4.128 5.200 . 0 0 "[ . 1 . 2]" 2
133 1 61 SER QB 1 63 PHE HB3 . . 6.000 5.806 5.184 6.041 0.041 17 0 "[ . 1 . 2]" 2
134 1 53 PHE QE 1 62 GLY HA2 . . 6.000 4.139 2.642 4.475 . 0 0 "[ . 1 . 2]" 2
135 1 53 PHE QE 1 62 GLY HA3 . . 6.000 5.472 4.192 5.809 . 0 0 "[ . 1 . 2]" 2
136 1 63 PHE HB2 1 103 ILE H . . 6.000 4.831 4.424 5.140 . 0 0 "[ . 1 . 2]" 2
137 1 63 PHE HB3 1 102 LYS HD2 . . 6.000 3.441 2.426 4.736 . 0 0 "[ . 1 . 2]" 2
138 1 63 PHE HB3 1 102 LYS HD3 . . 6.000 4.952 4.055 5.512 . 0 0 "[ . 1 . 2]" 2
139 1 57 ASP HB2 1 64 ILE HG12 . . 6.000 4.734 2.073 5.743 . 0 0 "[ . 1 . 2]" 2
140 1 64 ILE H 1 104 GLY HA3 . . 6.000 5.168 4.889 5.440 . 0 0 "[ . 1 . 2]" 2
141 1 64 ILE MD 1 68 GLU HB3 . . 6.000 4.155 3.618 4.663 . 0 0 "[ . 1 . 2]" 2
142 1 64 ILE MG 1 68 GLU HG2 . . 6.000 4.539 3.759 5.276 . 0 0 "[ . 1 . 2]" 2
143 1 64 ILE MG 1 69 LEU QD . . 6.000 2.058 1.741 2.456 . 0 0 "[ . 1 . 2]" 2
144 1 63 PHE HB3 1 65 GLU HA . . 6.000 4.565 4.247 5.002 . 0 0 "[ . 1 . 2]" 2
145 1 66 GLU HA 1 69 LEU HB2 . . 6.000 2.338 1.998 2.700 . 0 0 "[ . 1 . 2]" 2
146 1 66 GLU HA 1 69 LEU HB3 . . 6.000 3.874 3.381 4.258 . 0 0 "[ . 1 . 2]" 2
147 1 66 GLU HA 1 69 LEU QD . . 6.000 2.193 1.966 2.812 . 0 0 "[ . 1 . 2]" 2
148 1 66 GLU HG2 1 92 LEU QD . . 6.000 3.620 2.705 4.249 . 0 0 "[ . 1 . 2]" 2
149 1 66 GLU HG3 1 92 LEU QD . . 6.000 2.627 1.937 3.724 . 0 0 "[ . 1 . 2]" 2
150 1 66 GLU H 1 69 LEU QD . . 6.000 4.038 3.508 4.506 . 0 0 "[ . 1 . 2]" 2
151 1 66 GLU H 1 92 LEU QD . . 6.000 3.801 3.353 4.228 . 0 0 "[ . 1 . 2]" 2
152 1 67 GLU HG2 1 71 LEU QD . . 6.000 5.661 5.311 6.000 0.000 19 0 "[ . 1 . 2]" 2
153 1 68 GLU HA 1 71 LEU QD . . 6.000 2.399 1.945 3.319 . 0 0 "[ . 1 . 2]" 2
154 1 65 GLU H 1 68 GLU HG2 . . 6.000 4.795 4.337 5.344 . 0 0 "[ . 1 . 2]" 2
155 1 69 LEU QD 1 72 PHE HB2 . . 6.000 3.398 3.097 3.639 . 0 0 "[ . 1 . 2]" 2
156 1 69 LEU QD 1 72 PHE QD . . 6.000 4.196 3.793 4.338 . 0 0 "[ . 1 . 2]" 2
157 1 69 LEU QD 1 88 THR HB . . 6.000 5.082 4.744 5.289 . 0 0 "[ . 1 . 2]" 2
158 1 69 LEU QD 1 91 PHE HA . . 6.000 4.352 4.015 4.512 . 0 0 "[ . 1 . 2]" 2
159 1 69 LEU QD 1 91 PHE HZ . . 6.000 4.084 3.410 4.551 . 0 0 "[ . 1 . 2]" 2
160 1 69 LEU QD 1 91 PHE QE . . 6.000 3.071 2.246 3.838 . 0 0 "[ . 1 . 2]" 2
161 1 69 LEU QD 1 92 LEU HA . . 6.000 1.898 1.757 1.985 . 0 0 "[ . 1 . 2]" 2
162 1 69 LEU QD 1 92 LEU H . . 6.000 3.340 2.772 3.658 . 0 0 "[ . 1 . 2]" 2
163 1 69 LEU QD 1 92 LEU QD . . 6.000 1.690 1.607 1.776 . 0 0 "[ . 1 . 2]" 2
164 1 69 LEU QD 1 103 ILE HB . . 6.000 2.551 2.338 2.855 . 0 0 "[ . 1 . 2]" 2
165 1 70 LYS HA 1 83 LEU QD . . 6.000 2.164 1.953 2.978 . 0 0 "[ . 1 . 2]" 2
166 1 58 GLN HE21 1 71 LEU QD . . 6.000 3.083 2.303 4.090 . 0 0 "[ . 1 . 2]" 2
167 1 71 LEU QD 1 74 GLN HE21 . . 6.000 2.739 1.842 3.448 . 0 0 "[ . 1 . 2]" 2
168 1 71 LEU QD 1 74 GLN HG2 . . 6.000 3.910 3.352 4.412 . 0 0 "[ . 1 . 2]" 2
169 1 71 LEU QD 1 74 GLN HG3 . . 6.000 2.947 1.976 3.829 . 0 0 "[ . 1 . 2]" 2
170 1 71 LEU QD 1 82 ALA HA . . 6.000 3.355 2.929 3.692 . 0 0 "[ . 1 . 2]" 2
171 1 71 LEU QD 1 82 ALA H . . 6.000 4.854 4.373 5.129 . 0 0 "[ . 1 . 2]" 2
172 1 71 LEU QD 1 82 ALA MB . . 6.000 2.202 1.721 2.719 . 0 0 "[ . 1 . 2]" 2
173 1 71 LEU QD 1 83 LEU H . . 6.000 4.420 3.829 4.633 . 0 0 "[ . 1 . 2]" 2
174 1 72 PHE HB2 1 83 LEU QD . . 6.000 3.251 2.647 3.710 . 0 0 "[ . 1 . 2]" 2
175 1 72 PHE HB3 1 83 LEU QD . . 6.000 1.999 1.765 2.739 . 0 0 "[ . 1 . 2]" 2
176 1 73 LEU HA 1 76 PHE HB3 . . 6.000 5.722 5.387 5.998 . 0 0 "[ . 1 . 2]" 2
177 1 24 CYS HB2 1 73 LEU QD . . 6.000 2.877 2.240 3.762 . 0 0 "[ . 1 . 2]" 2
178 1 24 CYS HB3 1 73 LEU QD . . 6.000 3.528 2.583 4.125 . 0 0 "[ . 1 . 2]" 2
179 1 30 PHE QD 1 73 LEU QD . . 6.000 3.114 2.573 3.756 . 0 0 "[ . 1 . 2]" 2
180 1 30 PHE QE 1 73 LEU QD . . 6.000 2.900 1.946 3.691 . 0 0 "[ . 1 . 2]" 2
181 1 35 PHE HZ 1 73 LEU QD . . 6.000 2.983 2.173 3.802 . 0 0 "[ . 1 . 2]" 2
182 1 35 PHE QD 1 73 LEU QD . . 6.000 3.040 2.713 3.284 . 0 0 "[ . 1 . 2]" 2
183 1 35 PHE QE 1 73 LEU QD . . 6.000 1.935 1.755 2.315 . 0 0 "[ . 1 . 2]" 2
184 1 73 LEU QD 1 80 ALA HA . . 6.000 4.659 4.500 4.738 . 0 0 "[ . 1 . 2]" 2
185 1 73 LEU QD 1 81 ARG H . . 6.000 3.423 2.845 4.045 . 0 0 "[ . 1 . 2]" 2
186 1 73 LEU QD 1 83 LEU HA . . 6.000 3.960 3.557 4.666 . 0 0 "[ . 1 . 2]" 2
187 1 73 LEU QD 1 83 LEU QD . . 6.000 1.983 1.767 2.277 . 0 0 "[ . 1 . 2]" 2
188 1 71 LEU HB2 1 74 GLN HB3 . . 6.000 5.220 4.608 5.774 . 0 0 "[ . 1 . 2]" 2
189 1 71 LEU HB3 1 74 GLN HB3 . . 6.000 3.660 3.287 4.214 . 0 0 "[ . 1 . 2]" 2
190 1 71 LEU HA 1 74 GLN HE22 . . 6.000 4.757 3.649 5.536 . 0 0 "[ . 1 . 2]" 2
191 1 71 LEU QD 1 74 GLN HE22 . . 6.000 2.358 1.852 2.882 . 0 0 "[ . 1 . 2]" 2
192 1 74 GLN HE22 1 82 ALA HA . . 6.000 5.526 4.330 6.002 0.002 2 0 "[ . 1 . 2]" 2
193 1 8 PHE HB2 1 11 VAL QG . . 6.000 4.653 4.547 4.753 . 0 0 "[ . 1 . 2]" 2
194 1 8 PHE QD 1 11 VAL QG . . 6.000 2.738 2.318 3.164 . 0 0 "[ . 1 . 2]" 2
195 1 8 PHE QE 1 11 VAL QG . . 6.000 3.027 2.485 3.583 . 0 0 "[ . 1 . 2]" 2
196 1 11 VAL QG 1 48 GLU HB3 . . 6.000 4.122 3.337 4.930 . 0 0 "[ . 1 . 2]" 2
197 1 11 VAL QG 1 52 ALA MB . . 6.000 2.878 2.417 3.274 . 0 0 "[ . 1 . 2]" 2
198 1 11 VAL QG 1 55 ILE MD . . 6.000 2.394 1.667 3.060 . 0 0 "[ . 1 . 2]" 2
199 1 56 ILE MG 1 75 ASN HB2 . . 6.000 3.714 3.302 4.641 . 0 0 "[ . 1 . 2]" 2
200 1 56 ILE HA 1 75 ASN HD21 . . 6.000 3.992 2.062 4.284 . 0 0 "[ . 1 . 2]" 2
201 1 73 LEU HB2 1 75 ASN H . . 6.000 5.035 4.893 5.170 . 0 0 "[ . 1 . 2]" 2
202 1 17 VAL QG 1 76 PHE HA . . 6.000 4.044 3.732 4.185 . 0 0 "[ . 1 . 2]" 2
203 1 17 VAL QG 1 76 PHE HB3 . . 6.000 2.778 2.427 2.949 . 0 0 "[ . 1 . 2]" 2
204 1 21 LEU QD 1 76 PHE H . . 6.000 3.536 3.204 3.857 . 0 0 "[ . 1 . 2]" 2
205 1 17 VAL QG 1 76 PHE QD . . 6.000 2.652 2.122 3.168 . 0 0 "[ . 1 . 2]" 2
206 1 12 LEU QD 1 76 PHE QD . . 6.000 4.162 3.614 4.350 . 0 0 "[ . 1 . 2]" 2
207 1 12 LEU QD 1 76 PHE QE . . 6.000 2.723 1.953 3.276 . 0 0 "[ . 1 . 2]" 2
208 1 21 LEU QD 1 77 LYS HA . . 6.000 4.528 4.426 4.696 . 0 0 "[ . 1 . 2]" 2
209 1 21 LEU QD 1 77 LYS HB2 . . 6.000 2.680 2.446 2.867 . 0 0 "[ . 1 . 2]" 2
210 1 21 LEU QD 1 77 LYS HB3 . . 6.000 3.375 3.052 3.718 . 0 0 "[ . 1 . 2]" 2
211 1 21 LEU QD 1 77 LYS H . . 6.000 4.103 3.922 4.273 . 0 0 "[ . 1 . 2]" 2
212 1 6 MET HA 1 77 LYS H . . 6.000 4.784 3.899 5.988 . 0 0 "[ . 1 . 2]" 2
213 1 74 GLN HB3 1 78 ALA HA . . 6.000 3.623 3.416 3.928 . 0 0 "[ . 1 . 2]" 2
214 1 74 GLN HG3 1 78 ALA HA . . 6.000 5.658 5.019 6.005 0.005 2 0 "[ . 1 . 2]" 2
215 1 73 LEU HB3 1 80 ALA MB . . 6.000 2.065 1.957 2.287 . 0 0 "[ . 1 . 2]" 2
216 1 73 LEU QD 1 80 ALA MB . . 6.000 3.024 2.826 3.147 . 0 0 "[ . 1 . 2]" 2
217 1 74 GLN HE22 1 80 ALA MB . . 6.000 5.837 5.409 6.002 0.002 2 0 "[ . 1 . 2]" 2
218 1 73 LEU QD 1 81 ARG HD3 . . 6.000 4.000 3.323 4.871 . 0 0 "[ . 1 . 2]" 2
219 1 73 LEU QD 1 81 ARG HE . . 6.000 2.422 1.878 4.381 . 0 0 "[ . 1 . 2]" 2
220 1 73 LEU QD 1 81 ARG HG2 . . 6.000 2.876 2.017 3.361 . 0 0 "[ . 1 . 2]" 2
221 1 81 ARG HG2 1 83 LEU HA . . 6.000 5.921 5.736 6.017 0.017 4 0 "[ . 1 . 2]" 2
222 1 81 ARG HG2 1 83 LEU QD . . 6.000 4.422 3.979 4.875 . 0 0 "[ . 1 . 2]" 2
223 1 70 LYS HG3 1 82 ALA HA . . 6.000 3.854 3.205 4.837 . 0 0 "[ . 1 . 2]" 2
224 1 70 LYS HG3 1 82 ALA MB . . 6.000 2.298 1.786 3.863 . 0 0 "[ . 1 . 2]" 2
225 1 81 ARG HD2 1 83 LEU HA . . 6.000 3.569 3.154 4.136 . 0 0 "[ . 1 . 2]" 2
226 1 83 LEU HA 1 87 GLU HB3 . . 6.000 3.973 3.401 4.450 . 0 0 "[ . 1 . 2]" 2
227 1 83 LEU HB2 1 87 GLU HB3 . . 6.000 3.875 3.614 4.344 . 0 0 "[ . 1 . 2]" 2
228 1 83 LEU HB3 1 87 GLU HB3 . . 6.000 2.273 1.998 2.772 . 0 0 "[ . 1 . 2]" 2
229 1 30 PHE H 1 83 LEU QD . . 6.000 4.276 3.798 4.801 . 0 0 "[ . 1 . 2]" 2
230 1 30 PHE QE 1 83 LEU QD . . 6.000 2.796 2.452 3.023 . 0 0 "[ . 1 . 2]" 2
231 1 72 PHE H 1 83 LEU QD . . 6.000 2.466 2.125 3.117 . 0 0 "[ . 1 . 2]" 2
232 1 73 LEU HB2 1 83 LEU QD . . 6.000 3.081 2.848 3.803 . 0 0 "[ . 1 . 2]" 2
233 1 81 ARG HH11 1 83 LEU QD . . 6.000 3.092 2.323 3.878 . 0 0 "[ . 1 . 2]" 2
234 1 81 ARG QH2 1 83 LEU QD . . 6.000 2.985 1.987 3.675 . 0 0 "[ . 1 . 2]" 2
235 1 83 LEU QD 1 87 GLU HB3 . . 6.000 2.866 2.182 3.473 . 0 0 "[ . 1 . 2]" 2
236 1 83 LEU QD 1 87 GLU HE2 . . 6.000 2.576 1.960 3.803 . 0 0 "[ . 1 . 2]" 2
237 1 83 LEU QD 1 88 THR HA . . 6.000 4.100 3.084 4.332 . 0 0 "[ . 1 . 2]" 2
238 1 83 LEU QD 1 88 THR MG . . 6.000 4.078 3.536 4.253 . 0 0 "[ . 1 . 2]" 2
239 1 83 LEU QD 1 91 PHE QE . . 6.000 3.591 2.410 4.312 . 0 0 "[ . 1 . 2]" 2
240 1 70 LYS QE 1 84 SER HA . . 6.000 4.999 4.072 5.941 . 0 0 "[ . 1 . 2]" 2
241 1 27 ALA MB 1 84 SER HB2 . . 6.000 4.087 3.287 4.425 . 0 0 "[ . 1 . 2]" 2
242 1 84 SER HB2 1 87 GLU HG3 . . 6.000 4.238 3.220 5.688 . 0 0 "[ . 1 . 2]" 2
243 1 27 ALA MB 1 84 SER HB3 . . 6.000 5.205 4.716 5.499 . 0 0 "[ . 1 . 2]" 2
244 1 84 SER H 1 87 GLU HG2 . . 6.000 4.049 3.610 4.434 . 0 0 "[ . 1 . 2]" 2
245 1 12 LEU QB 1 17 VAL QG . . 6.000 1.988 1.760 2.274 . 0 0 "[ . 1 . 2]" 2
246 1 12 LEU QD 1 39 CYS HB3 . . 6.000 2.736 2.134 3.138 . 0 0 "[ . 1 . 2]" 2
247 1 12 LEU QD 1 40 GLY HA3 . . 6.000 3.957 2.764 4.221 . 0 0 "[ . 1 . 2]" 2
248 1 12 LEU QD 1 41 LEU HA . . 6.000 3.435 2.732 3.827 . 0 0 "[ . 1 . 2]" 2
249 1 12 LEU QD 1 41 LEU QD . . 6.000 2.115 1.695 2.728 . 0 0 "[ . 1 . 2]" 2
250 1 12 LEU QD 1 44 LYS HE2 . . 6.000 2.525 1.793 3.531 . 0 0 "[ . 1 . 2]" 2
251 1 12 LEU QD 1 44 LYS HE3 . . 6.000 2.752 1.820 3.553 . 0 0 "[ . 1 . 2]" 2
252 1 8 PHE QD 1 12 LEU QD . . 6.000 2.259 1.869 2.697 . 0 0 "[ . 1 . 2]" 2
253 1 8 PHE QE 1 12 LEU QD . . 6.000 2.589 1.953 3.128 . 0 0 "[ . 1 . 2]" 2
254 1 12 LEU QD 1 76 PHE HZ . . 6.000 3.876 3.159 4.539 . 0 0 "[ . 1 . 2]" 2
255 1 83 LEU QD 1 87 GLU HB2 . . 6.000 3.321 2.763 3.798 . 0 0 "[ . 1 . 2]" 2
256 1 84 SER H 1 87 GLU HB2 . . 6.000 2.058 1.945 2.740 . 0 0 "[ . 1 . 2]" 2
257 1 84 SER H 1 87 GLU HB3 . . 6.000 3.486 3.271 4.270 . 0 0 "[ . 1 . 2]" 2
258 1 83 LEU HB2 1 87 GLU HG2 . . 6.000 5.957 5.799 6.008 0.008 17 0 "[ . 1 . 2]" 2
259 1 69 LEU QD 1 88 THR HA . . 6.000 4.016 3.539 4.221 . 0 0 "[ . 1 . 2]" 2
260 1 66 GLU HG2 1 88 THR HB . . 6.000 4.494 3.423 5.312 . 0 0 "[ . 1 . 2]" 2
261 1 69 LEU HB3 1 88 THR HB . . 6.000 4.998 4.679 5.457 . 0 0 "[ . 1 . 2]" 2
262 1 83 LEU HB2 1 88 THR HB . . 6.000 4.314 4.016 4.649 . 0 0 "[ . 1 . 2]" 2
263 1 69 LEU HB3 1 88 THR MG . . 6.000 2.137 1.928 2.629 . 0 0 "[ . 1 . 2]" 2
264 1 69 LEU QD 1 88 THR MG . . 6.000 2.739 2.281 3.052 . 0 0 "[ . 1 . 2]" 2
265 1 88 THR MG 1 92 LEU QD . . 6.000 3.559 3.083 3.914 . 0 0 "[ . 1 . 2]" 2
266 1 89 LYS HA 1 92 LEU QD . . 6.000 3.133 2.431 3.848 . 0 0 "[ . 1 . 2]" 2
267 1 90 ALA HA 1 93 LYS HB3 . . 6.000 4.668 4.415 4.901 . 0 0 "[ . 1 . 2]" 2
268 1 69 LEU QD 1 91 PHE HB2 . . 6.000 4.236 3.679 4.618 . 0 0 "[ . 1 . 2]" 2
269 1 83 LEU QD 1 91 PHE HB2 . . 6.000 4.592 3.045 5.093 . 0 0 "[ . 1 . 2]" 2
270 1 32 HIS HB2 1 91 PHE HB3 . . 6.000 5.948 5.711 6.009 0.009 16 0 "[ . 1 . 2]" 2
271 1 69 LEU QD 1 91 PHE HB3 . . 6.000 3.039 2.291 3.494 . 0 0 "[ . 1 . 2]" 2
272 1 69 LEU QD 1 91 PHE H . . 6.000 4.562 4.125 4.799 . 0 0 "[ . 1 . 2]" 2
273 1 72 PHE HZ 1 91 PHE HZ . . 6.000 3.639 3.170 4.328 . 0 0 "[ . 1 . 2]" 2
274 1 32 HIS HB2 1 91 PHE QD . . 6.000 3.154 2.523 3.674 . 0 0 "[ . 1 . 2]" 2
275 1 69 LEU QD 1 91 PHE QD . . 6.000 2.798 2.213 3.365 . 0 0 "[ . 1 . 2]" 2
276 1 83 LEU QD 1 91 PHE QD . . 6.000 3.356 2.878 3.726 . 0 0 "[ . 1 . 2]" 2
277 1 92 LEU HA 1 96 ASP HB2 . . 6.000 3.439 3.040 3.846 . 0 0 "[ . 1 . 2]" 2
278 1 69 LEU QD 1 92 LEU HB2 . . 6.000 2.031 1.824 2.464 . 0 0 "[ . 1 . 2]" 2
279 1 69 LEU QD 1 92 LEU HB3 . . 6.000 3.386 3.116 3.710 . 0 0 "[ . 1 . 2]" 2
280 1 69 LEU QD 1 92 LEU HG . . 6.000 3.647 3.456 3.835 . 0 0 "[ . 1 . 2]" 2
281 1 66 GLU HB3 1 92 LEU QD . . 6.000 3.891 3.166 4.468 . 0 0 "[ . 1 . 2]" 2
282 1 92 LEU QD 1 96 ASP HB2 . . 6.000 2.176 1.859 2.655 . 0 0 "[ . 1 . 2]" 2
283 1 92 LEU QD 1 96 ASP HB3 . . 6.000 2.873 2.630 3.335 . 0 0 "[ . 1 . 2]" 2
284 1 92 LEU QD 1 101 GLY HA2 . . 6.000 2.675 2.119 3.219 . 0 0 "[ . 1 . 2]" 2
285 1 92 LEU QD 1 101 GLY HA3 . . 6.000 3.948 3.473 4.467 . 0 0 "[ . 1 . 2]" 2
286 1 92 LEU QD 1 102 LYS HA . . 6.000 3.625 2.594 4.042 . 0 0 "[ . 1 . 2]" 2
287 1 13 LYS HG2 1 16 GLU QG . . 6.000 3.536 2.438 4.661 . 0 0 "[ . 1 . 2]" 2
288 1 13 LYS H 1 16 GLU HB2 . . 6.000 2.709 2.231 3.271 . 0 0 "[ . 1 . 2]" 2
289 1 95 GLY HA2 1 103 ILE HG12 . . 6.000 5.364 4.878 5.837 . 0 0 "[ . 1 . 2]" 2
290 1 92 LEU HB3 1 96 ASP HB2 . . 6.000 5.152 4.657 5.672 . 0 0 "[ . 1 . 2]" 2
291 1 100 ASP HB3 1 102 LYS HE3 . . 6.000 5.592 2.636 6.025 0.025 14 0 "[ . 1 . 2]" 2
292 1 92 LEU QD 1 101 GLY H . . 6.000 3.103 2.512 3.532 . 0 0 "[ . 1 . 2]" 2
293 1 99 GLY HA2 1 101 GLY H . . 6.000 3.225 2.972 3.362 . 0 0 "[ . 1 . 2]" 2
294 1 63 PHE QD 1 102 LYS HD2 . . 6.000 3.531 2.625 5.361 . 0 0 "[ . 1 . 2]" 2
295 1 63 PHE HB2 1 102 LYS HG2 . . 6.000 4.621 3.729 5.072 . 0 0 "[ . 1 . 2]" 2
296 1 63 PHE HB3 1 102 LYS HG2 . . 6.000 4.416 3.157 5.031 . 0 0 "[ . 1 . 2]" 2
297 1 92 LEU QD 1 102 LYS H . . 6.000 3.534 3.234 4.115 . 0 0 "[ . 1 . 2]" 2
298 1 69 LEU QD 1 103 ILE HG13 . . 6.000 2.287 1.968 2.704 . 0 0 "[ . 1 . 2]" 2
299 1 92 LEU QD 1 103 ILE H . . 6.000 4.334 3.577 4.475 . 0 0 "[ . 1 . 2]" 2
300 1 69 LEU QD 1 103 ILE MD . . 6.000 1.765 1.620 1.929 . 0 0 "[ . 1 . 2]" 2
301 1 104 GLY HA2 1 107 GLU HB2 . . 6.000 4.527 4.398 4.728 . 0 0 "[ . 1 . 2]" 2
302 1 63 PHE QE 1 104 GLY HA2 . . 6.000 4.165 3.519 4.769 . 0 0 "[ . 1 . 2]" 2
303 1 14 ASP HA 1 17 VAL QG . . 6.000 1.985 1.876 2.124 . 0 0 "[ . 1 . 2]" 2
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