NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
419968 |
2ee0   |
10268 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ee0
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 1646
_Distance_constraint_stats_list.Viol_count 147
_Distance_constraint_stats_list.Viol_total 23.772
_Distance_constraint_stats_list.Viol_max 0.084
_Distance_constraint_stats_list.Viol_rms 0.0011
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0081
_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 8 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ASN 0.008 0.008 14 0 "[ . 1 . 2]"
1 11 ARG 0.061 0.029 12 0 "[ . 1 . 2]"
1 12 PRO 0.053 0.029 12 0 "[ . 1 . 2]"
1 13 VAL 0.002 0.001 5 0 "[ . 1 . 2]"
1 14 PHE 0.000 0.000 17 0 "[ . 1 . 2]"
1 15 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 GLU 0.026 0.026 19 0 "[ . 1 . 2]"
1 17 GLY 0.026 0.026 19 0 "[ . 1 . 2]"
1 18 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 VAL 0.002 0.001 16 0 "[ . 1 . 2]"
1 20 GLU 0.023 0.016 7 0 "[ . 1 . 2]"
1 21 VAL 0.009 0.002 5 0 "[ . 1 . 2]"
1 22 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 ILE 0.006 0.005 18 0 "[ . 1 . 2]"
1 24 PRO 0.007 0.005 18 0 "[ . 1 . 2]"
1 25 GLU 0.001 0.001 19 0 "[ . 1 . 2]"
1 26 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 ALA 0.016 0.012 17 0 "[ . 1 . 2]"
1 28 PRO 0.018 0.012 17 0 "[ . 1 . 2]"
1 29 VAL 0.002 0.002 9 0 "[ . 1 . 2]"
1 30 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 THR 0.022 0.014 11 0 "[ . 1 . 2]"
1 32 SER 0.014 0.014 11 0 "[ . 1 . 2]"
1 33 VAL 0.001 0.001 5 0 "[ . 1 . 2]"
1 34 ILE 0.011 0.011 8 0 "[ . 1 . 2]"
1 35 GLN 0.011 0.011 8 0 "[ . 1 . 2]"
1 36 LEU 0.166 0.084 15 0 "[ . 1 . 2]"
1 37 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 ALA 0.001 0.001 5 0 "[ . 1 . 2]"
1 39 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 ALA 0.044 0.032 12 0 "[ . 1 . 2]"
1 42 ASP 0.139 0.022 8 0 "[ . 1 . 2]"
1 43 ILE 0.122 0.032 12 0 "[ . 1 . 2]"
1 44 GLY 0.061 0.022 8 0 "[ . 1 . 2]"
1 45 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 ALA 0.004 0.004 12 0 "[ . 1 . 2]"
1 48 GLU 0.139 0.069 11 0 "[ . 1 . 2]"
1 49 ILE 0.012 0.010 6 0 "[ . 1 . 2]"
1 50 ARG 0.007 0.005 9 0 "[ . 1 . 2]"
1 51 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 ILE 0.001 0.001 9 0 "[ . 1 . 2]"
1 53 PHE 0.011 0.006 14 0 "[ . 1 . 2]"
1 54 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 VAL 0.009 0.006 19 0 "[ . 1 . 2]"
1 58 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 PRO 0.046 0.034 19 0 "[ . 1 . 2]"
1 60 ALA 0.011 0.005 19 0 "[ . 1 . 2]"
1 61 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 LYS 0.054 0.034 19 0 "[ . 1 . 2]"
1 63 ARG 0.033 0.016 8 0 "[ . 1 . 2]"
1 64 LEU 0.069 0.021 15 0 "[ . 1 . 2]"
1 65 PHE 0.019 0.013 20 0 "[ . 1 . 2]"
1 66 ALA 0.020 0.013 20 0 "[ . 1 . 2]"
1 67 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 ASN 0.001 0.001 5 0 "[ . 1 . 2]"
1 69 ASN 0.009 0.005 9 0 "[ . 1 . 2]"
1 70 THR 0.007 0.006 13 0 "[ . 1 . 2]"
1 71 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 LEU 0.038 0.027 15 0 "[ . 1 . 2]"
1 74 ILE 0.015 0.011 15 0 "[ . 1 . 2]"
1 75 THR 0.032 0.027 15 0 "[ . 1 . 2]"
1 76 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 GLN 0.016 0.005 20 0 "[ . 1 . 2]"
1 78 ARG 0.048 0.021 15 0 "[ . 1 . 2]"
1 79 SER 0.014 0.008 7 0 "[ . 1 . 2]"
1 80 LEU 0.005 0.002 14 0 "[ . 1 . 2]"
1 81 ASP 0.005 0.005 20 0 "[ . 1 . 2]"
1 82 ARG 0.005 0.002 2 0 "[ . 1 . 2]"
1 83 GLU 0.030 0.019 12 0 "[ . 1 . 2]"
1 84 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 ILE 0.054 0.054 2 0 "[ . 1 . 2]"
1 88 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 VAL 0.019 0.009 6 0 "[ . 1 . 2]"
1 91 THR 0.025 0.009 6 0 "[ . 1 . 2]"
1 92 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 LEU 0.017 0.006 12 0 "[ . 1 . 2]"
1 94 ALA 0.006 0.003 11 0 "[ . 1 . 2]"
1 95 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 ASP 0.012 0.010 6 0 "[ . 1 . 2]"
1 97 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 PRO 0.002 0.002 9 0 "[ . 1 . 2]"
1 102 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 ARG 0.022 0.006 12 0 "[ . 1 . 2]"
1 104 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 THR 0.017 0.009 6 0 "[ . 1 . 2]"
1 106 VAL 0.032 0.018 7 0 "[ . 1 . 2]"
1 107 THR 0.025 0.018 7 0 "[ . 1 . 2]"
1 108 ILE 0.009 0.002 5 0 "[ . 1 . 2]"
1 109 ASN 0.016 0.016 7 0 "[ . 1 . 2]"
1 110 VAL 0.001 0.001 20 0 "[ . 1 . 2]"
1 111 THR 0.025 0.023 6 0 "[ . 1 . 2]"
1 112 ASP 0.031 0.023 6 0 "[ . 1 . 2]"
1 113 VAL 0.054 0.039 6 0 "[ . 1 . 2]"
1 114 ASN 0.046 0.039 6 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 8 ASN HB2 1 9 ASP H . . 4.920 3.382 2.130 4.588 . 0 0 "[ . 1 . 2]" 1
2 1 8 ASN HB3 1 9 ASP H . . 4.920 3.443 2.090 4.613 . 0 0 "[ . 1 . 2]" 1
3 1 9 ASP QB 1 10 ASN H . . 3.940 3.215 2.439 3.914 . 0 0 "[ . 1 . 2]" 1
4 1 9 ASP HB2 1 10 ASN H . . 4.600 3.957 2.479 4.592 . 0 0 "[ . 1 . 2]" 1
5 1 9 ASP HB3 1 10 ASN H . . 4.600 3.581 2.503 4.468 . 0 0 "[ . 1 . 2]" 1
6 1 10 ASN H 1 11 ARG H . . 4.270 3.525 1.828 4.253 . 0 0 "[ . 1 . 2]" 1
7 1 10 ASN HA 1 11 ARG H . . 3.490 2.524 2.141 3.498 0.008 14 0 "[ . 1 . 2]" 1
8 1 10 ASN QB 1 11 ARG H . . 4.350 3.559 2.763 4.020 . 0 0 "[ . 1 . 2]" 1
9 1 11 ARG H 1 11 ARG QB . . 3.530 2.700 2.134 3.242 . 0 0 "[ . 1 . 2]" 1
10 1 11 ARG H 1 11 ARG QG . . 3.840 2.706 1.886 3.825 . 0 0 "[ . 1 . 2]" 1
11 1 11 ARG HA 1 12 PRO HD2 . . 3.410 2.278 2.184 2.441 . 0 0 "[ . 1 . 2]" 1
12 1 11 ARG HA 1 12 PRO HD3 . . 3.290 2.266 2.252 2.316 . 0 0 "[ . 1 . 2]" 1
13 1 11 ARG QB 1 11 ARG QD . . 3.420 2.205 1.998 2.554 . 0 0 "[ . 1 . 2]" 1
14 1 11 ARG QB 1 12 PRO HD3 . . 4.170 3.586 3.327 3.997 . 0 0 "[ . 1 . 2]" 1
15 1 11 ARG HB2 1 12 PRO HD2 . . 4.260 2.790 2.017 3.931 . 0 0 "[ . 1 . 2]" 1
16 1 11 ARG HB2 1 12 PRO HD3 . . 4.960 4.049 3.459 4.886 . 0 0 "[ . 1 . 2]" 1
17 1 11 ARG HB3 1 12 PRO HD2 . . 4.260 3.186 2.113 4.122 . 0 0 "[ . 1 . 2]" 1
18 1 11 ARG HB3 1 12 PRO HD3 . . 4.960 4.258 3.542 4.989 0.029 12 0 "[ . 1 . 2]" 1
19 1 11 ARG QG 1 12 PRO HD2 . . 4.600 3.515 1.982 4.417 . 0 0 "[ . 1 . 2]" 1
20 1 12 PRO HA 1 13 VAL H . . 3.120 2.303 2.152 2.720 . 0 0 "[ . 1 . 2]" 1
21 1 12 PRO HA 1 13 VAL QG . . 4.350 3.509 3.263 3.811 . 0 0 "[ . 1 . 2]" 1
22 1 12 PRO HA 1 49 ILE MD . . 5.460 4.134 3.186 4.822 . 0 0 "[ . 1 . 2]" 1
23 1 12 PRO QB 1 13 VAL H . . 4.020 3.064 1.894 3.856 . 0 0 "[ . 1 . 2]" 1
24 1 12 PRO QB 1 49 ILE MD . . 3.790 2.410 2.024 2.933 . 0 0 "[ . 1 . 2]" 1
25 1 12 PRO QB 1 94 ALA MB . . 4.570 2.922 2.104 3.957 . 0 0 "[ . 1 . 2]" 1
26 1 12 PRO HB2 1 13 VAL H . . 4.580 3.245 1.909 4.196 . 0 0 "[ . 1 . 2]" 1
27 1 12 PRO HB2 1 38 ALA MB . . 4.610 2.509 1.990 3.141 . 0 0 "[ . 1 . 2]" 1
28 1 12 PRO HB3 1 13 VAL H . . 4.580 3.854 3.149 4.498 . 0 0 "[ . 1 . 2]" 1
29 1 12 PRO HB3 1 38 ALA MB . . 4.610 3.228 2.504 4.099 . 0 0 "[ . 1 . 2]" 1
30 1 12 PRO HD2 1 102 ALA MB . . 4.710 4.030 3.392 4.703 . 0 0 "[ . 1 . 2]" 1
31 1 12 PRO QG 1 49 ILE MD . . 3.980 3.308 2.549 3.732 . 0 0 "[ . 1 . 2]" 1
32 1 12 PRO QG 1 102 ALA MB . . 3.910 2.774 2.055 3.426 . 0 0 "[ . 1 . 2]" 1
33 1 12 PRO HG2 1 49 ILE MD . . 4.840 4.501 3.950 4.829 . 0 0 "[ . 1 . 2]" 1
34 1 12 PRO HG3 1 49 ILE MD . . 4.840 3.410 2.581 3.919 . 0 0 "[ . 1 . 2]" 1
35 1 13 VAL H 1 13 VAL HB . . 3.770 3.215 2.486 3.726 . 0 0 "[ . 1 . 2]" 1
36 1 13 VAL H 1 13 VAL MG1 . . 4.110 2.770 1.899 3.919 . 0 0 "[ . 1 . 2]" 1
37 1 13 VAL H 1 13 VAL QG . . 3.360 2.237 1.845 2.985 . 0 0 "[ . 1 . 2]" 1
38 1 13 VAL H 1 13 VAL MG2 . . 4.110 3.027 1.893 4.034 . 0 0 "[ . 1 . 2]" 1
39 1 13 VAL H 1 14 PHE H . . 4.630 4.384 4.056 4.596 . 0 0 "[ . 1 . 2]" 1
40 1 13 VAL H 1 38 ALA MB . . 4.580 3.646 2.598 4.581 0.001 5 0 "[ . 1 . 2]" 1
41 1 13 VAL H 1 49 ILE MD . . 5.500 5.167 4.646 5.500 0.000 9 0 "[ . 1 . 2]" 1
42 1 13 VAL HA 1 13 VAL MG1 . . 3.610 2.712 2.082 3.203 . 0 0 "[ . 1 . 2]" 1
43 1 13 VAL HA 1 13 VAL QG . . 3.120 2.216 2.055 2.381 . 0 0 "[ . 1 . 2]" 1
44 1 13 VAL HA 1 13 VAL MG2 . . 3.610 2.591 2.149 3.202 . 0 0 "[ . 1 . 2]" 1
45 1 13 VAL HA 1 14 PHE H . . 3.380 2.193 2.140 2.451 . 0 0 "[ . 1 . 2]" 1
46 1 13 VAL HA 1 102 ALA MB . . 3.930 3.544 2.388 3.927 . 0 0 "[ . 1 . 2]" 1
47 1 13 VAL HB 1 14 PHE H . . 4.270 3.779 2.292 4.270 0.000 17 0 "[ . 1 . 2]" 1
48 1 14 PHE H 1 14 PHE HB2 . . 4.150 2.289 2.185 2.458 . 0 0 "[ . 1 . 2]" 1
49 1 14 PHE H 1 14 PHE QB . . 3.500 2.263 2.164 2.418 . 0 0 "[ . 1 . 2]" 1
50 1 14 PHE H 1 14 PHE HB3 . . 4.150 3.549 3.486 3.644 . 0 0 "[ . 1 . 2]" 1
51 1 14 PHE H 1 14 PHE QD . . 4.160 3.231 2.562 3.643 . 0 0 "[ . 1 . 2]" 1
52 1 14 PHE H 1 102 ALA MB . . 4.690 3.746 3.221 4.211 . 0 0 "[ . 1 . 2]" 1
53 1 14 PHE QD 1 36 LEU QB . . 4.540 2.643 1.996 3.236 . 0 0 "[ . 1 . 2]" 1
54 1 14 PHE QD 1 36 LEU MD2 . . 4.550 2.658 1.932 4.549 . 0 0 "[ . 1 . 2]" 1
55 1 14 PHE QD 1 37 HIS H . . 4.460 3.568 2.469 4.429 . 0 0 "[ . 1 . 2]" 1
56 1 14 PHE QD 1 102 ALA MB . . 3.520 2.620 2.088 3.166 . 0 0 "[ . 1 . 2]" 1
57 1 14 PHE QD 1 103 ARG H . . 4.550 4.146 3.647 4.548 . 0 0 "[ . 1 . 2]" 1
58 1 14 PHE QD 1 104 ALA MB . . 4.410 2.527 2.094 2.964 . 0 0 "[ . 1 . 2]" 1
59 1 14 PHE QE 1 36 LEU HB2 . . 4.440 3.415 2.625 4.085 . 0 0 "[ . 1 . 2]" 1
60 1 14 PHE QE 1 36 LEU QB . . 3.720 2.319 1.958 2.971 . 0 0 "[ . 1 . 2]" 1
61 1 14 PHE QE 1 36 LEU HB3 . . 4.440 2.368 1.999 3.072 . 0 0 "[ . 1 . 2]" 1
62 1 14 PHE QE 1 36 LEU MD1 . . 4.090 2.908 2.080 3.994 . 0 0 "[ . 1 . 2]" 1
63 1 14 PHE QE 1 36 LEU MD2 . . 4.440 3.274 2.228 4.435 . 0 0 "[ . 1 . 2]" 1
64 1 14 PHE QE 1 51 TYR QD . . 4.090 3.234 2.543 3.768 . 0 0 "[ . 1 . 2]" 1
65 1 14 PHE QE 1 51 TYR QE . . 3.760 2.452 1.997 3.420 . 0 0 "[ . 1 . 2]" 1
66 1 14 PHE QE 1 92 VAL HB . . 5.030 4.031 3.606 4.525 . 0 0 "[ . 1 . 2]" 1
67 1 14 PHE QE 1 92 VAL MG1 . . 4.190 3.342 2.674 3.905 . 0 0 "[ . 1 . 2]" 1
68 1 14 PHE QE 1 93 LEU HA . . 4.730 3.467 2.771 3.975 . 0 0 "[ . 1 . 2]" 1
69 1 14 PHE QE 1 94 ALA H . . 4.210 3.229 2.394 4.013 . 0 0 "[ . 1 . 2]" 1
70 1 14 PHE QE 1 94 ALA MB . . 3.910 2.736 2.258 3.148 . 0 0 "[ . 1 . 2]" 1
71 1 14 PHE QE 1 102 ALA MB . . 3.770 2.425 1.961 3.149 . 0 0 "[ . 1 . 2]" 1
72 1 14 PHE QE 1 103 ARG H . . 5.300 4.018 3.327 5.024 . 0 0 "[ . 1 . 2]" 1
73 1 14 PHE QE 1 103 ARG HA . . 4.260 3.470 2.714 4.235 . 0 0 "[ . 1 . 2]" 1
74 1 14 PHE QE 1 104 ALA H . . 4.280 3.846 3.356 4.219 . 0 0 "[ . 1 . 2]" 1
75 1 14 PHE QE 1 104 ALA MB . . 4.590 2.939 2.331 3.481 . 0 0 "[ . 1 . 2]" 1
76 1 14 PHE HZ 1 36 LEU MD1 . . 4.720 3.603 2.922 4.644 . 0 0 "[ . 1 . 2]" 1
77 1 14 PHE HZ 1 51 TYR QD . . 4.150 3.018 2.346 3.812 . 0 0 "[ . 1 . 2]" 1
78 1 14 PHE HZ 1 51 TYR QE . . 4.320 3.563 2.625 4.254 . 0 0 "[ . 1 . 2]" 1
79 1 14 PHE HZ 1 92 VAL HB . . 4.620 3.756 3.019 4.573 . 0 0 "[ . 1 . 2]" 1
80 1 14 PHE HZ 1 92 VAL MG1 . . 3.680 2.777 2.077 3.675 . 0 0 "[ . 1 . 2]" 1
81 1 14 PHE HZ 1 94 ALA MB . . 3.750 2.235 1.843 2.959 . 0 0 "[ . 1 . 2]" 1
82 1 15 LYS HA 1 15 LYS QD . . 4.320 3.532 2.086 4.320 . 0 0 "[ . 1 . 2]" 1
83 1 15 LYS HA 1 15 LYS QE . . 4.790 4.167 3.347 4.773 . 0 0 "[ . 1 . 2]" 1
84 1 15 LYS HA 1 15 LYS QG . . 3.740 2.607 2.172 3.433 . 0 0 "[ . 1 . 2]" 1
85 1 15 LYS QB 1 15 LYS QE . . 4.390 2.894 1.985 3.796 . 0 0 "[ . 1 . 2]" 1
86 1 15 LYS QB 1 16 GLU H . . 3.730 2.726 2.186 3.695 . 0 0 "[ . 1 . 2]" 1
87 1 15 LYS QB 1 16 GLU QG . . 4.280 3.405 2.732 4.276 . 0 0 "[ . 1 . 2]" 1
88 1 15 LYS QB 1 37 HIS HB2 . . 4.580 4.189 2.946 4.579 . 0 0 "[ . 1 . 2]" 1
89 1 15 LYS QB 1 37 HIS HB3 . . 4.580 3.479 2.957 4.564 . 0 0 "[ . 1 . 2]" 1
90 1 15 LYS QG 1 16 GLU QB . . 4.380 3.496 2.382 4.284 . 0 0 "[ . 1 . 2]" 1
91 1 15 LYS QG 1 16 GLU QG . . 4.250 2.933 1.991 4.249 . 0 0 "[ . 1 . 2]" 1
92 1 16 GLU H 1 16 GLU QB . . 3.690 2.837 2.473 3.307 . 0 0 "[ . 1 . 2]" 1
93 1 16 GLU H 1 16 GLU QG . . 4.340 3.109 2.009 4.030 . 0 0 "[ . 1 . 2]" 1
94 1 16 GLU H 1 17 GLY H . . 4.730 3.900 1.796 4.420 . 0 0 "[ . 1 . 2]" 1
95 1 16 GLU H 1 17 GLY QA . . 4.930 4.515 3.754 4.758 . 0 0 "[ . 1 . 2]" 1
96 1 16 GLU HA 1 16 GLU QG . . 3.740 2.718 2.255 3.420 . 0 0 "[ . 1 . 2]" 1
97 1 16 GLU HA 1 17 GLY H . . 3.450 2.361 2.143 3.476 0.026 19 0 "[ . 1 . 2]" 1
98 1 16 GLU HA 1 17 GLY QA . . 4.640 3.970 3.888 4.284 . 0 0 "[ . 1 . 2]" 1
99 1 16 GLU HA 1 18 GLN H . . 5.500 4.656 3.634 5.471 . 0 0 "[ . 1 . 2]" 1
100 1 16 GLU QB 1 17 GLY QA . . 5.180 4.190 3.807 4.630 . 0 0 "[ . 1 . 2]" 1
101 1 16 GLU QB 1 19 VAL MG2 . . 3.640 2.210 1.837 3.634 . 0 0 "[ . 1 . 2]" 1
102 1 16 GLU HB2 1 17 GLY H . . 5.230 3.997 2.095 4.555 . 0 0 "[ . 1 . 2]" 1
103 1 16 GLU HB2 1 19 VAL MG2 . . 4.190 2.609 1.886 4.010 . 0 0 "[ . 1 . 2]" 1
104 1 16 GLU HB3 1 17 GLY H . . 5.230 3.601 2.304 4.655 . 0 0 "[ . 1 . 2]" 1
105 1 16 GLU HB3 1 19 VAL MG2 . . 4.190 2.732 1.915 4.156 . 0 0 "[ . 1 . 2]" 1
106 1 16 GLU QG 1 19 VAL MG1 . . 4.620 4.301 3.880 4.619 . 0 0 "[ . 1 . 2]" 1
107 1 16 GLU QG 1 19 VAL MG2 . . 4.080 2.924 1.811 3.563 . 0 0 "[ . 1 . 2]" 1
108 1 17 GLY H 1 18 GLN H . . 3.690 3.115 2.551 3.683 . 0 0 "[ . 1 . 2]" 1
109 1 17 GLY QA 1 104 ALA MB . . 4.380 3.130 2.144 4.179 . 0 0 "[ . 1 . 2]" 1
110 1 18 GLN H 1 18 GLN HB2 . . 4.180 2.751 2.296 3.868 . 0 0 "[ . 1 . 2]" 1
111 1 18 GLN H 1 18 GLN QB . . 3.430 2.504 2.270 3.180 . 0 0 "[ . 1 . 2]" 1
112 1 18 GLN H 1 18 GLN HB3 . . 4.180 3.219 2.640 3.763 . 0 0 "[ . 1 . 2]" 1
113 1 18 GLN H 1 18 GLN QG . . 4.260 3.410 2.217 4.186 . 0 0 "[ . 1 . 2]" 1
114 1 18 GLN H 1 19 VAL H . . 4.520 4.416 4.240 4.516 . 0 0 "[ . 1 . 2]" 1
115 1 18 GLN H 1 19 VAL HA . . 5.500 5.153 4.723 5.499 . 0 0 "[ . 1 . 2]" 1
116 1 18 GLN HA 1 18 GLN QG . . 3.950 2.489 2.208 3.541 . 0 0 "[ . 1 . 2]" 1
117 1 18 GLN HA 1 19 VAL H . . 2.930 2.179 2.139 2.364 . 0 0 "[ . 1 . 2]" 1
118 1 18 GLN HA 1 19 VAL MG2 . . 4.580 3.539 3.160 3.962 . 0 0 "[ . 1 . 2]" 1
119 1 18 GLN HA 1 105 THR H . . 4.170 3.922 3.264 4.169 . 0 0 "[ . 1 . 2]" 1
120 1 18 GLN HA 1 105 THR HB . . 4.180 3.773 3.224 4.139 . 0 0 "[ . 1 . 2]" 1
121 1 18 GLN QB 1 19 VAL H . . 3.800 3.361 2.524 3.797 . 0 0 "[ . 1 . 2]" 1
122 1 18 GLN HB2 1 19 VAL H . . 4.550 4.096 2.557 4.458 . 0 0 "[ . 1 . 2]" 1
123 1 18 GLN HB3 1 19 VAL H . . 4.550 3.716 3.033 4.191 . 0 0 "[ . 1 . 2]" 1
124 1 18 GLN QG 1 19 VAL H . . 4.410 3.493 2.297 4.285 . 0 0 "[ . 1 . 2]" 1
125 1 18 GLN QG 1 19 VAL MG2 . . 5.250 4.787 4.150 5.244 . 0 0 "[ . 1 . 2]" 1
126 1 18 GLN QG 1 105 THR HB . . 4.360 3.053 2.108 4.343 . 0 0 "[ . 1 . 2]" 1
127 1 19 VAL H 1 19 VAL HB . . 3.760 2.858 2.738 3.009 . 0 0 "[ . 1 . 2]" 1
128 1 19 VAL H 1 19 VAL MG2 . . 3.560 2.869 2.341 3.181 . 0 0 "[ . 1 . 2]" 1
129 1 19 VAL H 1 20 GLU H . . 4.500 4.269 4.009 4.440 . 0 0 "[ . 1 . 2]" 1
130 1 19 VAL H 1 106 VAL HA . . 3.920 2.767 2.434 3.213 . 0 0 "[ . 1 . 2]" 1
131 1 19 VAL H 1 106 VAL MG2 . . 4.400 3.777 3.484 4.109 . 0 0 "[ . 1 . 2]" 1
132 1 19 VAL H 1 107 THR H . . 4.600 3.212 2.557 3.626 . 0 0 "[ . 1 . 2]" 1
133 1 19 VAL HA 1 19 VAL MG1 . . 3.680 2.309 2.187 2.459 . 0 0 "[ . 1 . 2]" 1
134 1 19 VAL HA 1 19 VAL MG2 . . 3.530 2.417 2.268 2.592 . 0 0 "[ . 1 . 2]" 1
135 1 19 VAL HA 1 20 GLU H . . 2.980 2.194 2.141 2.354 . 0 0 "[ . 1 . 2]" 1
136 1 19 VAL HB 1 20 GLU H . . 4.350 4.034 3.694 4.326 . 0 0 "[ . 1 . 2]" 1
137 1 19 VAL HB 1 106 VAL HA . . 4.190 3.915 2.820 4.191 0.001 5 0 "[ . 1 . 2]" 1
138 1 19 VAL HB 1 106 VAL MG1 . . 3.880 3.215 2.705 3.680 . 0 0 "[ . 1 . 2]" 1
139 1 19 VAL HB 1 106 VAL MG2 . . 3.860 3.545 2.604 3.859 . 0 0 "[ . 1 . 2]" 1
140 1 19 VAL HB 1 107 THR H . . 5.340 4.550 3.650 4.894 . 0 0 "[ . 1 . 2]" 1
141 1 19 VAL MG1 1 20 GLU H . . 3.690 2.325 1.828 2.897 . 0 0 "[ . 1 . 2]" 1
142 1 19 VAL MG1 1 20 GLU HA . . 4.780 3.893 3.435 4.156 . 0 0 "[ . 1 . 2]" 1
143 1 19 VAL MG1 1 107 THR H . . 5.500 5.050 3.936 5.400 . 0 0 "[ . 1 . 2]" 1
144 1 19 VAL MG2 1 20 GLU H . . 4.200 4.024 3.675 4.201 0.001 16 0 "[ . 1 . 2]" 1
145 1 19 VAL MG2 1 106 VAL HA . . 4.820 4.545 3.977 4.820 . 0 0 "[ . 1 . 2]" 1
146 1 19 VAL MG2 1 107 THR H . . 5.500 5.310 5.007 5.499 . 0 0 "[ . 1 . 2]" 1
147 1 20 GLU H 1 20 GLU QB . . 3.320 2.375 2.204 2.549 . 0 0 "[ . 1 . 2]" 1
148 1 20 GLU HA 1 20 GLU HG2 . . 4.170 2.868 2.390 3.561 . 0 0 "[ . 1 . 2]" 1
149 1 20 GLU HA 1 20 GLU HG3 . . 4.170 2.637 2.231 3.613 . 0 0 "[ . 1 . 2]" 1
150 1 20 GLU HA 1 21 VAL H . . 2.940 2.173 2.139 2.299 . 0 0 "[ . 1 . 2]" 1
151 1 20 GLU HA 1 21 VAL MG1 . . 5.300 3.831 3.402 4.064 . 0 0 "[ . 1 . 2]" 1
152 1 20 GLU HA 1 21 VAL MG2 . . 4.530 3.648 3.249 3.827 . 0 0 "[ . 1 . 2]" 1
153 1 20 GLU HA 1 107 THR H . . 3.690 3.472 3.144 3.692 0.002 7 0 "[ . 1 . 2]" 1
154 1 20 GLU HA 1 107 THR HB . . 3.700 2.500 1.998 2.809 . 0 0 "[ . 1 . 2]" 1
155 1 20 GLU HA 1 107 THR MG . . 4.480 3.769 3.341 4.078 . 0 0 "[ . 1 . 2]" 1
156 1 20 GLU QB 1 21 VAL H . . 4.030 3.592 2.951 3.866 . 0 0 "[ . 1 . 2]" 1
157 1 20 GLU QB 1 107 THR H . . 5.500 4.941 4.524 5.481 . 0 0 "[ . 1 . 2]" 1
158 1 20 GLU QB 1 107 THR HB . . 4.440 3.428 2.738 3.990 . 0 0 "[ . 1 . 2]" 1
159 1 20 GLU QB 1 107 THR MG . . 4.620 4.031 3.315 4.450 . 0 0 "[ . 1 . 2]" 1
160 1 20 GLU QB 1 109 ASN HD21 . . 5.040 4.199 2.524 5.056 0.016 7 0 "[ . 1 . 2]" 1
161 1 20 GLU QB 1 109 ASN QD . . 4.250 3.719 2.317 4.174 . 0 0 "[ . 1 . 2]" 1
162 1 20 GLU QB 1 109 ASN HD22 . . 5.040 4.240 2.530 4.909 . 0 0 "[ . 1 . 2]" 1
163 1 20 GLU QG 1 21 VAL H . . 3.970 2.884 2.084 3.814 . 0 0 "[ . 1 . 2]" 1
164 1 20 GLU QG 1 107 THR HB . . 3.680 2.509 1.996 3.307 . 0 0 "[ . 1 . 2]" 1
165 1 20 GLU QG 1 107 THR MG . . 3.980 2.619 2.078 3.315 . 0 0 "[ . 1 . 2]" 1
166 1 20 GLU QG 1 109 ASN QD . . 3.480 2.169 1.789 3.092 . 0 0 "[ . 1 . 2]" 1
167 1 20 GLU HG2 1 21 VAL H . . 4.810 3.147 2.116 4.810 . 1 0 "[ . 1 . 2]" 1
168 1 20 GLU HG2 1 107 THR HB . . 4.270 3.776 2.680 4.275 0.005 7 0 "[ . 1 . 2]" 1
169 1 20 GLU HG2 1 109 ASN HD21 . . 4.620 2.767 2.015 4.447 . 0 0 "[ . 1 . 2]" 1
170 1 20 GLU HG2 1 109 ASN HD22 . . 4.620 3.046 1.902 3.724 . 0 0 "[ . 1 . 2]" 1
171 1 20 GLU HG3 1 21 VAL H . . 4.810 3.702 2.933 4.793 . 0 0 "[ . 1 . 2]" 1
172 1 20 GLU HG3 1 107 THR HB . . 4.270 2.658 2.005 4.027 . 0 0 "[ . 1 . 2]" 1
173 1 20 GLU HG3 1 109 ASN HD21 . . 4.620 3.141 2.097 4.163 . 0 0 "[ . 1 . 2]" 1
174 1 20 GLU HG3 1 109 ASN HD22 . . 4.620 2.830 1.893 3.827 . 0 0 "[ . 1 . 2]" 1
175 1 21 VAL H 1 21 VAL MG1 . . 3.950 2.989 2.704 3.324 . 0 0 "[ . 1 . 2]" 1
176 1 21 VAL H 1 21 VAL MG2 . . 3.420 2.161 1.896 2.465 . 0 0 "[ . 1 . 2]" 1
177 1 21 VAL H 1 106 VAL MG1 . . 4.740 4.294 3.972 4.698 . 0 0 "[ . 1 . 2]" 1
178 1 21 VAL H 1 107 THR HB . . 4.320 3.930 3.638 4.143 . 0 0 "[ . 1 . 2]" 1
179 1 21 VAL H 1 107 THR MG . . 5.140 4.335 3.923 4.573 . 0 0 "[ . 1 . 2]" 1
180 1 21 VAL H 1 108 ILE HA . . 4.000 2.970 2.705 3.316 . 0 0 "[ . 1 . 2]" 1
181 1 21 VAL H 1 109 ASN QD . . 4.580 3.648 2.354 4.536 . 0 0 "[ . 1 . 2]" 1
182 1 21 VAL HA 1 21 VAL MG1 . . 3.570 2.253 2.104 2.460 . 0 0 "[ . 1 . 2]" 1
183 1 21 VAL HA 1 22 HIS H . . 3.030 2.332 2.249 2.425 . 0 0 "[ . 1 . 2]" 1
184 1 21 VAL HB 1 22 HIS H . . 3.600 2.568 2.332 2.799 . 0 0 "[ . 1 . 2]" 1
185 1 21 VAL HB 1 108 ILE HA . . 4.690 4.574 4.381 4.691 0.001 20 0 "[ . 1 . 2]" 1
186 1 21 VAL HB 1 108 ILE QG . . 4.700 4.589 4.345 4.702 0.002 5 0 "[ . 1 . 2]" 1
187 1 21 VAL HB 1 108 ILE MG . . 4.320 4.160 3.753 4.321 0.001 13 0 "[ . 1 . 2]" 1
188 1 21 VAL MG1 1 22 HIS H . . 4.110 3.660 3.391 3.797 . 0 0 "[ . 1 . 2]" 1
189 1 21 VAL MG1 1 107 THR H . . 5.500 5.150 4.734 5.493 . 0 0 "[ . 1 . 2]" 1
190 1 21 VAL MG1 1 108 ILE HA . . 4.770 4.364 3.972 4.771 0.001 19 0 "[ . 1 . 2]" 1
191 1 21 VAL MG2 1 22 HIS H . . 4.370 3.621 3.348 3.865 . 0 0 "[ . 1 . 2]" 1
192 1 21 VAL MG2 1 108 ILE HA . . 3.610 1.960 1.838 2.077 . 0 0 "[ . 1 . 2]" 1
193 1 21 VAL MG2 1 108 ILE HB . . 4.490 3.986 3.687 4.178 . 0 0 "[ . 1 . 2]" 1
194 1 21 VAL MG2 1 108 ILE QG . . 3.750 2.170 1.971 2.329 . 0 0 "[ . 1 . 2]" 1
195 1 21 VAL MG2 1 109 ASN H . . 4.430 2.882 2.474 3.252 . 0 0 "[ . 1 . 2]" 1
196 1 22 HIS H 1 22 HIS QB . . 3.680 2.710 2.352 3.053 . 0 0 "[ . 1 . 2]" 1
197 1 22 HIS H 1 23 ILE H . . 4.930 4.197 3.986 4.400 . 0 0 "[ . 1 . 2]" 1
198 1 22 HIS HA 1 23 ILE H . . 3.050 2.151 2.140 2.172 . 0 0 "[ . 1 . 2]" 1
199 1 22 HIS HA 1 23 ILE MG . . 4.750 3.828 3.614 4.075 . 0 0 "[ . 1 . 2]" 1
200 1 22 HIS HA 1 109 ASN H . . 3.910 3.409 3.118 3.771 . 0 0 "[ . 1 . 2]" 1
201 1 22 HIS HA 1 109 ASN HB2 . . 4.310 2.890 2.499 3.420 . 0 0 "[ . 1 . 2]" 1
202 1 22 HIS HA 1 109 ASN QB . . 3.590 2.819 2.476 3.271 . 0 0 "[ . 1 . 2]" 1
203 1 22 HIS HA 1 109 ASN HB3 . . 4.310 3.989 3.595 4.307 . 0 0 "[ . 1 . 2]" 1
204 1 22 HIS HA 1 111 THR MG . . 4.010 3.400 3.025 3.670 . 0 0 "[ . 1 . 2]" 1
205 1 22 HIS QB 1 23 ILE H . . 4.410 3.453 3.115 3.629 . 0 0 "[ . 1 . 2]" 1
206 1 22 HIS QB 1 109 ASN QB . . 4.630 3.696 3.086 4.431 . 0 0 "[ . 1 . 2]" 1
207 1 22 HIS QB 1 111 THR MG . . 3.660 2.471 1.920 2.851 . 0 0 "[ . 1 . 2]" 1
208 1 22 HIS HB2 1 23 ILE H . . 5.190 3.857 3.333 4.549 . 0 0 "[ . 1 . 2]" 1
209 1 22 HIS HB2 1 111 THR MG . . 4.330 3.012 1.934 4.305 . 0 0 "[ . 1 . 2]" 1
210 1 22 HIS HB3 1 23 ILE H . . 5.190 4.173 3.258 4.483 . 0 0 "[ . 1 . 2]" 1
211 1 22 HIS HB3 1 111 THR MG . . 4.330 3.411 2.339 4.312 . 0 0 "[ . 1 . 2]" 1
212 1 22 HIS HD2 1 111 THR MG . . 3.820 3.094 2.311 3.607 . 0 0 "[ . 1 . 2]" 1
213 1 23 ILE H 1 23 ILE HB . . 4.040 3.179 2.934 3.436 . 0 0 "[ . 1 . 2]" 1
214 1 23 ILE H 1 23 ILE MD . . 5.450 4.695 4.572 4.875 . 0 0 "[ . 1 . 2]" 1
215 1 23 ILE H 1 23 ILE QG . . 4.590 4.110 4.037 4.197 . 0 0 "[ . 1 . 2]" 1
216 1 23 ILE H 1 23 ILE MG . . 3.520 2.176 1.970 2.469 . 0 0 "[ . 1 . 2]" 1
217 1 23 ILE H 1 108 ILE MG . . 4.400 3.676 3.242 4.039 . 0 0 "[ . 1 . 2]" 1
218 1 23 ILE H 1 109 ASN H . . 4.840 4.115 3.593 4.483 . 0 0 "[ . 1 . 2]" 1
219 1 23 ILE H 1 109 ASN QB . . 5.340 3.974 3.593 4.393 . 0 0 "[ . 1 . 2]" 1
220 1 23 ILE H 1 110 VAL HA . . 4.260 3.448 2.996 3.888 . 0 0 "[ . 1 . 2]" 1
221 1 23 ILE H 1 111 THR MG . . 3.850 3.424 3.030 3.757 . 0 0 "[ . 1 . 2]" 1
222 1 23 ILE HA 1 23 ILE MD . . 3.910 3.827 3.729 3.905 . 0 0 "[ . 1 . 2]" 1
223 1 23 ILE HA 1 23 ILE MG . . 3.510 3.192 3.177 3.200 . 0 0 "[ . 1 . 2]" 1
224 1 23 ILE HA 1 24 PRO HD2 . . 3.290 2.146 2.098 2.176 . 0 0 "[ . 1 . 2]" 1
225 1 23 ILE HA 1 24 PRO HD3 . . 3.200 2.254 2.252 2.260 . 0 0 "[ . 1 . 2]" 1
226 1 23 ILE HA 1 24 PRO QG . . 4.230 3.856 3.831 3.871 . 0 0 "[ . 1 . 2]" 1
227 1 23 ILE HB 1 23 ILE MD . . 3.620 2.480 2.405 2.605 . 0 0 "[ . 1 . 2]" 1
228 1 23 ILE HB 1 24 PRO HD2 . . 3.860 3.681 3.505 3.835 . 0 0 "[ . 1 . 2]" 1
229 1 23 ILE HB 1 24 PRO HD3 . . 4.840 4.599 4.465 4.716 . 0 0 "[ . 1 . 2]" 1
230 1 23 ILE HB 1 31 THR MG . . 5.500 4.706 4.186 5.165 . 0 0 "[ . 1 . 2]" 1
231 1 23 ILE HB 1 33 VAL MG1 . . 4.480 3.630 3.227 3.986 . 0 0 "[ . 1 . 2]" 1
232 1 23 ILE HB 1 108 ILE MG . . 4.320 3.664 3.193 4.026 . 0 0 "[ . 1 . 2]" 1
233 1 23 ILE MD 1 24 PRO HD2 . . 4.540 3.475 3.434 3.661 . 0 0 "[ . 1 . 2]" 1
234 1 23 ILE MD 1 24 PRO QG . . 4.900 4.142 4.005 4.323 . 0 0 "[ . 1 . 2]" 1
235 1 23 ILE MD 1 27 ALA MB . . 3.450 2.186 1.908 2.578 . 0 0 "[ . 1 . 2]" 1
236 1 23 ILE MD 1 31 THR HB . . 3.330 2.925 2.394 3.254 . 0 0 "[ . 1 . 2]" 1
237 1 23 ILE MD 1 31 THR MG . . 3.320 2.980 2.348 3.299 . 0 0 "[ . 1 . 2]" 1
238 1 23 ILE MD 1 33 VAL H . . 5.500 4.976 4.234 5.296 . 0 0 "[ . 1 . 2]" 1
239 1 23 ILE MD 1 33 VAL MG1 . . 3.400 3.233 2.690 3.401 0.001 5 0 "[ . 1 . 2]" 1
240 1 23 ILE MD 1 65 PHE QE . . 4.050 3.103 2.619 3.738 . 0 0 "[ . 1 . 2]" 1
241 1 23 ILE MD 1 65 PHE HZ . . 4.750 4.024 3.350 4.616 . 0 0 "[ . 1 . 2]" 1
242 1 23 ILE MD 1 76 VAL HB . . 5.210 4.165 3.909 4.434 . 0 0 "[ . 1 . 2]" 1
243 1 23 ILE MD 1 80 LEU HG . . 5.070 4.347 3.958 4.837 . 0 0 "[ . 1 . 2]" 1
244 1 23 ILE MD 1 108 ILE MG . . 3.880 3.599 3.272 3.855 . 0 0 "[ . 1 . 2]" 1
245 1 23 ILE QG 1 24 PRO HD2 . . 3.740 1.826 1.806 1.936 . 0 0 "[ . 1 . 2]" 1
246 1 23 ILE QG 1 24 PRO HD3 . . 4.160 3.199 3.157 3.373 . 0 0 "[ . 1 . 2]" 1
247 1 23 ILE QG 1 108 ILE MG . . 4.980 4.625 4.404 4.866 . 0 0 "[ . 1 . 2]" 1
248 1 23 ILE HG12 1 24 PRO HD2 . . 4.500 2.121 2.001 2.643 . 0 0 "[ . 1 . 2]" 1
249 1 23 ILE HG12 1 24 PRO HD3 . . 4.900 3.620 3.512 3.991 . 0 0 "[ . 1 . 2]" 1
250 1 23 ILE HG13 1 24 PRO HD2 . . 4.500 2.009 1.988 2.065 . 0 0 "[ . 1 . 2]" 1
251 1 23 ILE HG13 1 24 PRO HD3 . . 4.900 3.572 3.454 3.643 . 0 0 "[ . 1 . 2]" 1
252 1 23 ILE MG 1 24 PRO HD2 . . 4.240 3.874 3.694 4.111 . 0 0 "[ . 1 . 2]" 1
253 1 23 ILE MG 1 24 PRO HD3 . . 4.740 4.631 4.513 4.745 0.005 18 0 "[ . 1 . 2]" 1
254 1 23 ILE MG 1 24 PRO QG . . 5.060 4.736 4.501 5.041 . 0 0 "[ . 1 . 2]" 1
255 1 23 ILE MG 1 65 PHE QE . . 4.440 3.347 2.701 3.995 . 0 0 "[ . 1 . 2]" 1
256 1 24 PRO HB2 1 25 GLU H . . 3.440 3.047 2.558 3.370 . 0 0 "[ . 1 . 2]" 1
257 1 24 PRO HB2 1 26 ASN H . . 3.450 2.607 2.309 2.818 . 0 0 "[ . 1 . 2]" 1
258 1 24 PRO HB2 1 27 ALA H . . 4.100 3.267 2.838 3.851 . 0 0 "[ . 1 . 2]" 1
259 1 24 PRO HB2 1 27 ALA MB . . 4.960 3.656 3.565 3.762 . 0 0 "[ . 1 . 2]" 1
260 1 24 PRO HB2 1 113 VAL HA . . 5.020 4.421 2.759 4.888 . 0 0 "[ . 1 . 2]" 1
261 1 24 PRO HB2 1 113 VAL QG . . 3.770 1.969 1.852 2.264 . 0 0 "[ . 1 . 2]" 1
262 1 24 PRO HB3 1 25 GLU H . . 4.250 3.697 3.426 3.893 . 0 0 "[ . 1 . 2]" 1
263 1 24 PRO HB3 1 26 ASN H . . 4.350 4.177 3.939 4.338 . 0 0 "[ . 1 . 2]" 1
264 1 24 PRO HB3 1 111 THR H . . 4.970 4.824 4.420 4.972 0.002 7 0 "[ . 1 . 2]" 1
265 1 24 PRO HB3 1 113 VAL HA . . 4.570 3.895 2.011 4.328 . 0 0 "[ . 1 . 2]" 1
266 1 24 PRO HB3 1 113 VAL QG . . 3.610 2.294 1.952 2.810 . 0 0 "[ . 1 . 2]" 1
267 1 24 PRO HD2 1 27 ALA HA . . 4.610 4.267 3.946 4.575 . 0 0 "[ . 1 . 2]" 1
268 1 24 PRO HD2 1 27 ALA MB . . 4.760 2.565 2.363 2.908 . 0 0 "[ . 1 . 2]" 1
269 1 24 PRO HD3 1 27 ALA MB . . 4.430 3.946 3.772 4.185 . 0 0 "[ . 1 . 2]" 1
270 1 24 PRO QG 1 25 GLU H . . 4.870 4.427 4.128 4.594 . 0 0 "[ . 1 . 2]" 1
271 1 24 PRO QG 1 26 ASN H . . 4.560 4.035 3.734 4.232 . 0 0 "[ . 1 . 2]" 1
272 1 24 PRO QG 1 27 ALA H . . 4.310 3.055 2.611 3.514 . 0 0 "[ . 1 . 2]" 1
273 1 24 PRO QG 1 27 ALA MB . . 4.010 1.996 1.951 2.200 . 0 0 "[ . 1 . 2]" 1
274 1 24 PRO QG 1 113 VAL QG . . 4.250 3.124 2.708 3.342 . 0 0 "[ . 1 . 2]" 1
275 1 25 GLU H 1 25 GLU HB2 . . 3.770 3.593 3.558 3.629 . 0 0 "[ . 1 . 2]" 1
276 1 25 GLU H 1 25 GLU HB3 . . 3.770 2.659 2.510 2.849 . 0 0 "[ . 1 . 2]" 1
277 1 25 GLU H 1 25 GLU HG2 . . 4.120 2.182 1.900 3.392 . 0 0 "[ . 1 . 2]" 1
278 1 25 GLU H 1 25 GLU HG3 . . 4.120 2.927 1.912 3.429 . 0 0 "[ . 1 . 2]" 1
279 1 25 GLU H 1 26 ASN H . . 3.970 2.592 2.322 2.824 . 0 0 "[ . 1 . 2]" 1
280 1 25 GLU H 1 110 VAL MG1 . . 4.030 2.891 2.450 3.266 . 0 0 "[ . 1 . 2]" 1
281 1 25 GLU H 1 111 THR H . . 4.200 3.923 3.352 4.183 . 0 0 "[ . 1 . 2]" 1
282 1 25 GLU H 1 112 ASP HA . . 4.700 4.059 3.519 4.539 . 0 0 "[ . 1 . 2]" 1
283 1 25 GLU H 1 113 VAL MG1 . . 4.450 2.989 2.320 4.447 . 0 0 "[ . 1 . 2]" 1
284 1 25 GLU H 1 113 VAL QG . . 3.870 2.804 2.294 3.693 . 0 0 "[ . 1 . 2]" 1
285 1 25 GLU H 1 113 VAL MG2 . . 4.450 3.846 2.721 4.376 . 0 0 "[ . 1 . 2]" 1
286 1 25 GLU HA 1 25 GLU QG . . 3.720 3.347 3.309 3.450 . 0 0 "[ . 1 . 2]" 1
287 1 25 GLU HA 1 27 ALA H . . 4.410 3.591 3.498 3.826 . 0 0 "[ . 1 . 2]" 1
288 1 25 GLU HA 1 80 LEU HB2 . . 3.860 2.289 2.000 2.543 . 0 0 "[ . 1 . 2]" 1
289 1 25 GLU HA 1 80 LEU HB3 . . 4.270 3.789 3.370 4.256 . 0 0 "[ . 1 . 2]" 1
290 1 25 GLU HA 1 80 LEU MD1 . . 3.240 2.558 2.034 3.146 . 0 0 "[ . 1 . 2]" 1
291 1 25 GLU HA 1 110 VAL MG1 . . 3.590 2.679 2.253 3.274 . 0 0 "[ . 1 . 2]" 1
292 1 25 GLU HA 1 110 VAL MG2 . . 4.800 3.925 3.502 4.460 . 0 0 "[ . 1 . 2]" 1
293 1 25 GLU QB 1 26 ASN H . . 4.450 3.475 3.339 3.675 . 0 0 "[ . 1 . 2]" 1
294 1 25 GLU QB 1 110 VAL MG1 . . 3.180 2.103 1.860 2.405 . 0 0 "[ . 1 . 2]" 1
295 1 25 GLU HB2 1 26 ASN H . . 5.320 3.787 3.551 4.084 . 0 0 "[ . 1 . 2]" 1
296 1 25 GLU HB2 1 110 VAL MG1 . . 3.740 3.335 2.939 3.740 0.000 19 0 "[ . 1 . 2]" 1
297 1 25 GLU HB3 1 26 ASN H . . 5.320 4.053 3.940 4.207 . 0 0 "[ . 1 . 2]" 1
298 1 25 GLU HB3 1 110 VAL MG1 . . 3.740 2.127 1.875 2.452 . 0 0 "[ . 1 . 2]" 1
299 1 25 GLU QG 1 26 ASN H . . 4.010 2.236 1.978 2.622 . 0 0 "[ . 1 . 2]" 1
300 1 25 GLU QG 1 112 ASP HA . . 4.720 3.181 2.420 3.798 . 0 0 "[ . 1 . 2]" 1
301 1 25 GLU QG 1 113 VAL H . . 4.260 3.752 3.313 4.191 . 0 0 "[ . 1 . 2]" 1
302 1 25 GLU QG 1 113 VAL QG . . 3.220 2.236 1.877 3.051 . 0 0 "[ . 1 . 2]" 1
303 1 25 GLU HG2 1 113 VAL H . . 4.900 4.019 3.410 4.872 . 0 0 "[ . 1 . 2]" 1
304 1 25 GLU HG2 1 113 VAL MG1 . . 4.380 3.160 2.101 4.381 0.001 19 0 "[ . 1 . 2]" 1
305 1 25 GLU HG2 1 113 VAL MG2 . . 4.380 2.933 2.176 4.256 . 0 0 "[ . 1 . 2]" 1
306 1 25 GLU HG3 1 113 VAL H . . 4.900 4.655 3.720 4.886 . 0 0 "[ . 1 . 2]" 1
307 1 25 GLU HG3 1 113 VAL MG1 . . 4.380 3.214 2.328 4.273 . 0 0 "[ . 1 . 2]" 1
308 1 25 GLU HG3 1 113 VAL MG2 . . 4.380 2.717 2.003 4.175 . 0 0 "[ . 1 . 2]" 1
309 1 26 ASN H 1 26 ASN HB2 . . 4.160 2.534 2.201 2.972 . 0 0 "[ . 1 . 2]" 1
310 1 26 ASN H 1 26 ASN QB . . 3.520 2.291 2.178 2.369 . 0 0 "[ . 1 . 2]" 1
311 1 26 ASN H 1 26 ASN HB3 . . 4.160 2.922 2.367 3.620 . 0 0 "[ . 1 . 2]" 1
312 1 26 ASN H 1 27 ALA H . . 3.370 2.697 2.345 3.167 . 0 0 "[ . 1 . 2]" 1
313 1 26 ASN H 1 27 ALA MB . . 4.550 4.272 4.022 4.385 . 0 0 "[ . 1 . 2]" 1
314 1 26 ASN H 1 113 VAL MG1 . . 3.910 2.290 1.890 3.396 . 0 0 "[ . 1 . 2]" 1
315 1 26 ASN H 1 113 VAL QG . . 3.380 2.129 1.863 2.693 . 0 0 "[ . 1 . 2]" 1
316 1 26 ASN H 1 113 VAL MG2 . . 3.910 2.919 1.884 3.624 . 0 0 "[ . 1 . 2]" 1
317 1 26 ASN QB 1 113 VAL QG . . 3.380 1.814 1.703 2.032 . 0 0 "[ . 1 . 2]" 1
318 1 26 ASN HB2 1 27 ALA H . . 4.750 4.283 3.787 4.595 . 0 0 "[ . 1 . 2]" 1
319 1 26 ASN HB2 1 113 VAL MG1 . . 4.750 2.553 1.960 3.467 . 0 0 "[ . 1 . 2]" 1
320 1 26 ASN HB2 1 113 VAL MG2 . . 4.750 2.208 1.887 2.672 . 0 0 "[ . 1 . 2]" 1
321 1 26 ASN HB3 1 27 ALA H . . 4.750 3.989 3.343 4.402 . 0 0 "[ . 1 . 2]" 1
322 1 26 ASN HB3 1 113 VAL MG1 . . 4.750 2.517 1.812 3.554 . 0 0 "[ . 1 . 2]" 1
323 1 26 ASN HB3 1 113 VAL MG2 . . 4.750 2.969 2.130 3.669 . 0 0 "[ . 1 . 2]" 1
324 1 26 ASN QD 1 113 VAL QG . . 3.660 2.613 1.841 3.131 . 0 0 "[ . 1 . 2]" 1
325 1 26 ASN HD21 1 113 VAL MG1 . . 4.920 3.346 1.891 4.215 . 0 0 "[ . 1 . 2]" 1
326 1 26 ASN HD21 1 113 VAL MG2 . . 4.920 3.056 1.878 3.791 . 0 0 "[ . 1 . 2]" 1
327 1 26 ASN HD22 1 113 VAL MG1 . . 4.920 4.648 3.226 4.916 . 0 0 "[ . 1 . 2]" 1
328 1 26 ASN HD22 1 113 VAL MG2 . . 4.920 4.084 2.630 4.878 . 0 0 "[ . 1 . 2]" 1
329 1 27 ALA H 1 27 ALA MB . . 2.930 2.203 2.028 2.272 . 0 0 "[ . 1 . 2]" 1
330 1 27 ALA H 1 28 PRO HD3 . . 4.960 4.907 4.802 4.972 0.012 17 0 "[ . 1 . 2]" 1
331 1 27 ALA H 1 80 LEU MD1 . . 4.430 3.693 3.112 4.331 . 0 0 "[ . 1 . 2]" 1
332 1 27 ALA H 1 113 VAL QG . . 3.880 3.769 3.445 3.879 . 0 0 "[ . 1 . 2]" 1
333 1 27 ALA HA 1 28 PRO HD2 . . 3.220 2.241 2.185 2.255 . 0 0 "[ . 1 . 2]" 1
334 1 27 ALA HA 1 28 PRO HD3 . . 3.190 2.258 2.253 2.260 . 0 0 "[ . 1 . 2]" 1
335 1 27 ALA HA 1 28 PRO QG . . 4.310 3.907 3.877 3.915 . 0 0 "[ . 1 . 2]" 1
336 1 27 ALA MB 1 28 PRO HD2 . . 3.940 2.359 2.271 2.497 . 0 0 "[ . 1 . 2]" 1
337 1 27 ALA MB 1 28 PRO HD3 . . 3.760 3.484 3.452 3.567 . 0 0 "[ . 1 . 2]" 1
338 1 27 ALA MB 1 28 PRO QG . . 5.350 3.734 3.694 3.812 . 0 0 "[ . 1 . 2]" 1
339 1 27 ALA MB 1 31 THR H . . 5.130 4.748 4.443 4.969 . 0 0 "[ . 1 . 2]" 1
340 1 27 ALA MB 1 31 THR HB . . 3.550 3.392 3.126 3.550 0.000 14 0 "[ . 1 . 2]" 1
341 1 27 ALA MB 1 31 THR HG1 . . 4.250 3.892 2.486 4.218 . 0 0 "[ . 1 . 2]" 1
342 1 27 ALA MB 1 76 VAL HB . . 5.420 4.182 3.506 4.652 . 0 0 "[ . 1 . 2]" 1
343 1 27 ALA MB 1 76 VAL MG1 . . 3.370 3.206 2.861 3.366 . 0 0 "[ . 1 . 2]" 1
344 1 27 ALA MB 1 76 VAL MG2 . . 4.100 2.698 2.474 3.044 . 0 0 "[ . 1 . 2]" 1
345 1 27 ALA MB 1 80 LEU HG . . 4.310 4.102 3.752 4.309 . 0 0 "[ . 1 . 2]" 1
346 1 28 PRO HA 1 29 VAL H . . 3.010 2.171 2.153 2.236 . 0 0 "[ . 1 . 2]" 1
347 1 28 PRO HA 1 29 VAL HA . . 4.720 4.366 4.339 4.384 . 0 0 "[ . 1 . 2]" 1
348 1 28 PRO HA 1 29 VAL QG . . 4.100 3.682 3.455 3.939 . 0 0 "[ . 1 . 2]" 1
349 1 28 PRO HB2 1 29 VAL H . . 4.260 3.418 3.094 3.563 . 0 0 "[ . 1 . 2]" 1
350 1 28 PRO HB2 1 31 THR H . . 5.300 4.963 4.572 5.151 . 0 0 "[ . 1 . 2]" 1
351 1 28 PRO HB2 1 31 THR HG1 . . 4.630 3.505 3.315 4.327 . 0 0 "[ . 1 . 2]" 1
352 1 28 PRO HB2 1 31 THR MG . . 5.380 5.318 5.254 5.381 0.001 7 0 "[ . 1 . 2]" 1
353 1 28 PRO HB3 1 29 VAL H . . 4.020 3.925 3.721 4.022 0.002 9 0 "[ . 1 . 2]" 1
354 1 28 PRO HB3 1 31 THR HG1 . . 5.140 4.783 4.642 4.984 . 0 0 "[ . 1 . 2]" 1
355 1 28 PRO HD2 1 31 THR HB . . 4.700 4.335 4.147 4.498 . 0 0 "[ . 1 . 2]" 1
356 1 28 PRO HD2 1 31 THR HG1 . . 4.560 3.570 2.184 3.930 . 0 0 "[ . 1 . 2]" 1
357 1 28 PRO HD2 1 31 THR MG . . 4.480 3.595 3.257 3.816 . 0 0 "[ . 1 . 2]" 1
358 1 28 PRO QG 1 29 VAL H . . 4.860 4.611 4.459 4.670 . 0 0 "[ . 1 . 2]" 1
359 1 28 PRO QG 1 31 THR HG1 . . 4.610 2.314 2.039 2.455 . 0 0 "[ . 1 . 2]" 1
360 1 28 PRO QG 1 31 THR MG . . 4.290 3.376 3.260 3.497 . 0 0 "[ . 1 . 2]" 1
361 1 29 VAL H 1 29 VAL HB . . 3.140 2.493 2.361 2.617 . 0 0 "[ . 1 . 2]" 1
362 1 29 VAL H 1 29 VAL QG . . 3.040 2.162 1.915 2.380 . 0 0 "[ . 1 . 2]" 1
363 1 29 VAL HA 1 29 VAL MG1 . . 3.350 2.500 2.400 3.198 . 0 0 "[ . 1 . 2]" 1
364 1 29 VAL HA 1 29 VAL QG . . 2.850 2.146 2.030 2.303 . 0 0 "[ . 1 . 2]" 1
365 1 29 VAL HA 1 29 VAL MG2 . . 3.350 2.351 2.150 2.443 . 0 0 "[ . 1 . 2]" 1
366 1 29 VAL HA 1 30 GLY H . . 3.050 2.161 2.144 2.211 . 0 0 "[ . 1 . 2]" 1
367 1 29 VAL HA 1 30 GLY QA . . 4.460 3.928 3.900 3.968 . 0 0 "[ . 1 . 2]" 1
368 1 29 VAL HA 1 31 THR H . . 4.060 3.419 3.239 3.563 . 0 0 "[ . 1 . 2]" 1
369 1 29 VAL HA 1 76 VAL HB . . 3.870 2.542 2.231 2.933 . 0 0 "[ . 1 . 2]" 1
370 1 29 VAL HA 1 76 VAL MG1 . . 4.580 2.254 1.977 2.672 . 0 0 "[ . 1 . 2]" 1
371 1 29 VAL HB 1 30 GLY H . . 4.570 4.237 4.055 4.382 . 0 0 "[ . 1 . 2]" 1
372 1 29 VAL QG 1 30 GLY H . . 3.270 2.499 2.051 2.941 . 0 0 "[ . 1 . 2]" 1
373 1 29 VAL QG 1 30 GLY QA . . 3.980 2.972 2.851 3.107 . 0 0 "[ . 1 . 2]" 1
374 1 29 VAL QG 1 77 GLN H . . 4.560 4.094 3.614 4.399 . 0 0 "[ . 1 . 2]" 1
375 1 29 VAL QG 1 78 ARG H . . 3.650 3.543 3.160 3.650 . 2 0 "[ . 1 . 2]" 1
376 1 29 VAL QG 1 78 ARG HA . . 3.190 2.346 2.004 2.696 . 0 0 "[ . 1 . 2]" 1
377 1 29 VAL QG 1 78 ARG QG . . 4.370 3.567 3.211 4.367 . 0 0 "[ . 1 . 2]" 1
378 1 29 VAL QG 1 79 SER H . . 3.590 3.366 3.042 3.590 . 0 0 "[ . 1 . 2]" 1
379 1 29 VAL QG 1 79 SER HA . . 4.220 3.869 3.523 4.220 0.000 5 0 "[ . 1 . 2]" 1
380 1 29 VAL MG1 1 30 GLY H . . 4.710 2.599 2.061 3.939 . 0 0 "[ . 1 . 2]" 1
381 1 29 VAL MG1 1 78 ARG HA . . 4.160 3.561 3.106 4.152 . 0 0 "[ . 1 . 2]" 1
382 1 29 VAL MG2 1 30 GLY H . . 4.710 3.887 2.569 4.134 . 0 0 "[ . 1 . 2]" 1
383 1 29 VAL MG2 1 78 ARG HA . . 4.160 2.388 2.012 2.820 . 0 0 "[ . 1 . 2]" 1
384 1 30 GLY H 1 31 THR H . . 3.560 2.123 1.887 2.407 . 0 0 "[ . 1 . 2]" 1
385 1 30 GLY H 1 75 THR HB . . 4.510 3.718 3.459 4.279 . 0 0 "[ . 1 . 2]" 1
386 1 30 GLY H 1 76 VAL H . . 4.190 3.163 2.765 3.686 . 0 0 "[ . 1 . 2]" 1
387 1 30 GLY H 1 76 VAL HB . . 3.910 2.250 1.911 2.582 . 0 0 "[ . 1 . 2]" 1
388 1 30 GLY H 1 76 VAL MG2 . . 5.200 3.833 3.568 4.173 . 0 0 "[ . 1 . 2]" 1
389 1 30 GLY QA 1 75 THR HB . . 4.100 2.837 2.549 3.278 . 0 0 "[ . 1 . 2]" 1
390 1 30 GLY QA 1 75 THR MG . . 4.430 3.626 3.295 4.199 . 0 0 "[ . 1 . 2]" 1
391 1 30 GLY HA2 1 75 THR HB . . 4.830 2.870 2.570 3.336 . 0 0 "[ . 1 . 2]" 1
392 1 30 GLY HA3 1 75 THR HB . . 4.830 4.471 4.238 4.810 . 0 0 "[ . 1 . 2]" 1
393 1 31 THR H 1 31 THR HB . . 3.300 2.601 2.518 2.740 . 0 0 "[ . 1 . 2]" 1
394 1 31 THR H 1 31 THR HG1 . . 3.250 2.278 1.921 3.257 0.007 11 0 "[ . 1 . 2]" 1
395 1 31 THR H 1 31 THR MG . . 4.050 3.788 3.749 3.813 . 0 0 "[ . 1 . 2]" 1
396 1 31 THR H 1 32 SER H . . 4.700 4.540 4.355 4.633 . 0 0 "[ . 1 . 2]" 1
397 1 31 THR H 1 76 VAL H . . 4.210 2.960 2.613 3.479 . 0 0 "[ . 1 . 2]" 1
398 1 31 THR H 1 76 VAL HB . . 3.630 2.476 2.038 2.757 . 0 0 "[ . 1 . 2]" 1
399 1 31 THR H 1 76 VAL MG1 . . 4.260 3.996 3.631 4.201 . 0 0 "[ . 1 . 2]" 1
400 1 31 THR H 1 76 VAL MG2 . . 4.070 3.208 2.765 3.683 . 0 0 "[ . 1 . 2]" 1
401 1 31 THR HA 1 31 THR MG . . 3.170 2.281 2.143 2.379 . 0 0 "[ . 1 . 2]" 1
402 1 31 THR HA 1 32 SER H . . 2.870 2.188 2.142 2.301 . 0 0 "[ . 1 . 2]" 1
403 1 31 THR HB 1 32 SER H . . 4.520 4.018 3.596 4.269 . 0 0 "[ . 1 . 2]" 1
404 1 31 THR HB 1 33 VAL MG2 . . 3.770 3.684 3.542 3.770 . 0 0 "[ . 1 . 2]" 1
405 1 31 THR HB 1 76 VAL H . . 4.570 3.667 3.316 3.961 . 0 0 "[ . 1 . 2]" 1
406 1 31 THR HB 1 76 VAL HB . . 3.780 3.383 3.096 3.685 . 0 0 "[ . 1 . 2]" 1
407 1 31 THR HG1 1 32 SER H . . 4.930 4.708 4.404 4.944 0.014 11 0 "[ . 1 . 2]" 1
408 1 31 THR HG1 1 76 VAL MG2 . . 5.160 3.866 3.136 4.574 . 0 0 "[ . 1 . 2]" 1
409 1 31 THR MG 1 32 SER H . . 3.400 2.265 1.891 2.915 . 0 0 "[ . 1 . 2]" 1
410 1 31 THR MG 1 32 SER HA . . 4.670 4.132 3.925 4.384 . 0 0 "[ . 1 . 2]" 1
411 1 31 THR MG 1 33 VAL H . . 4.770 4.462 4.214 4.731 . 0 0 "[ . 1 . 2]" 1
412 1 31 THR MG 1 33 VAL MG2 . . 3.820 3.587 3.285 3.813 . 0 0 "[ . 1 . 2]" 1
413 1 31 THR MG 1 75 THR HA . . 5.500 5.124 4.872 5.380 . 0 0 "[ . 1 . 2]" 1
414 1 32 SER H 1 32 SER HB2 . . 3.700 3.346 2.251 3.655 . 0 0 "[ . 1 . 2]" 1
415 1 32 SER H 1 32 SER QB . . 3.060 2.517 2.177 2.835 . 0 0 "[ . 1 . 2]" 1
416 1 32 SER H 1 32 SER HB3 . . 3.700 2.766 2.225 3.608 . 0 0 "[ . 1 . 2]" 1
417 1 32 SER H 1 75 THR MG . . 4.580 3.647 3.151 4.218 . 0 0 "[ . 1 . 2]" 1
418 1 32 SER HA 1 33 VAL H . . 3.220 2.150 2.139 2.165 . 0 0 "[ . 1 . 2]" 1
419 1 32 SER HA 1 33 VAL HB . . 4.990 4.694 4.609 4.815 . 0 0 "[ . 1 . 2]" 1
420 1 32 SER HA 1 33 VAL MG2 . . 4.200 3.749 3.530 3.924 . 0 0 "[ . 1 . 2]" 1
421 1 32 SER HA 1 73 LEU HG . . 5.420 4.106 3.528 4.759 . 0 0 "[ . 1 . 2]" 1
422 1 32 SER HA 1 75 THR HA . . 3.750 2.879 2.293 3.327 . 0 0 "[ . 1 . 2]" 1
423 1 32 SER HA 1 75 THR HB . . 4.710 3.999 3.357 4.531 . 0 0 "[ . 1 . 2]" 1
424 1 32 SER HA 1 75 THR MG . . 3.230 2.096 1.836 2.561 . 0 0 "[ . 1 . 2]" 1
425 1 32 SER HA 1 76 VAL H . . 5.150 4.427 3.931 5.019 . 0 0 "[ . 1 . 2]" 1
426 1 32 SER QB 1 33 VAL H . . 4.010 3.537 3.306 3.898 . 0 0 "[ . 1 . 2]" 1
427 1 32 SER QB 1 73 LEU QD . . 3.140 2.284 1.808 2.618 . 0 0 "[ . 1 . 2]" 1
428 1 32 SER QB 1 73 LEU HG . . 4.580 4.122 3.582 4.544 . 0 0 "[ . 1 . 2]" 1
429 1 32 SER QB 1 75 THR MG . . 4.560 3.047 2.524 3.612 . 0 0 "[ . 1 . 2]" 1
430 1 32 SER HB2 1 33 VAL H . . 4.590 3.848 3.439 4.534 . 0 0 "[ . 1 . 2]" 1
431 1 32 SER HB2 1 73 LEU MD1 . . 4.880 2.758 1.896 4.829 . 0 0 "[ . 1 . 2]" 1
432 1 32 SER HB2 1 73 LEU MD2 . . 4.880 3.529 2.953 4.648 . 0 0 "[ . 1 . 2]" 1
433 1 32 SER HB3 1 33 VAL H . . 4.590 4.294 3.572 4.551 . 0 0 "[ . 1 . 2]" 1
434 1 32 SER HB3 1 73 LEU MD1 . . 4.880 3.275 1.981 4.149 . 0 0 "[ . 1 . 2]" 1
435 1 32 SER HB3 1 73 LEU MD2 . . 4.880 3.371 2.043 4.515 . 0 0 "[ . 1 . 2]" 1
436 1 33 VAL H 1 33 VAL HB . . 3.630 2.572 2.496 2.682 . 0 0 "[ . 1 . 2]" 1
437 1 33 VAL H 1 33 VAL MG1 . . 4.180 3.781 3.766 3.798 . 0 0 "[ . 1 . 2]" 1
438 1 33 VAL H 1 33 VAL MG2 . . 3.500 2.315 2.137 2.577 . 0 0 "[ . 1 . 2]" 1
439 1 33 VAL H 1 34 ILE H . . 3.350 2.756 2.568 2.938 . 0 0 "[ . 1 . 2]" 1
440 1 33 VAL H 1 73 LEU QD . . 4.260 3.435 3.046 3.940 . 0 0 "[ . 1 . 2]" 1
441 1 33 VAL H 1 74 ILE HB . . 5.080 4.214 3.801 4.537 . 0 0 "[ . 1 . 2]" 1
442 1 33 VAL H 1 74 ILE MG . . 4.750 3.898 3.401 4.323 . 0 0 "[ . 1 . 2]" 1
443 1 33 VAL H 1 75 THR HA . . 3.870 2.595 2.290 2.889 . 0 0 "[ . 1 . 2]" 1
444 1 33 VAL H 1 75 THR MG . . 3.980 3.211 2.709 3.639 . 0 0 "[ . 1 . 2]" 1
445 1 33 VAL HA 1 33 VAL MG1 . . 3.360 2.353 2.192 2.434 . 0 0 "[ . 1 . 2]" 1
446 1 33 VAL HA 1 33 VAL MG2 . . 3.140 2.380 2.272 2.494 . 0 0 "[ . 1 . 2]" 1
447 1 33 VAL HB 1 34 ILE H . . 3.200 2.040 1.903 2.277 . 0 0 "[ . 1 . 2]" 1
448 1 33 VAL HB 1 34 ILE HA . . 5.360 4.572 4.450 4.703 . 0 0 "[ . 1 . 2]" 1
449 1 33 VAL HB 1 34 ILE HB . . 4.890 4.087 3.812 4.312 . 0 0 "[ . 1 . 2]" 1
450 1 33 VAL HB 1 74 ILE MG . . 3.690 2.585 2.043 3.014 . 0 0 "[ . 1 . 2]" 1
451 1 33 VAL MG1 1 34 ILE H . . 3.760 3.071 2.814 3.407 . 0 0 "[ . 1 . 2]" 1
452 1 33 VAL MG1 1 65 PHE QE . . 4.680 3.263 2.556 3.745 . 0 0 "[ . 1 . 2]" 1
453 1 33 VAL MG1 1 108 ILE HB . . 5.500 4.433 4.046 4.970 . 0 0 "[ . 1 . 2]" 1
454 1 33 VAL MG1 1 108 ILE MD . . 3.040 2.318 1.947 2.911 . 0 0 "[ . 1 . 2]" 1
455 1 33 VAL MG1 1 108 ILE HG12 . . 4.270 2.350 2.142 2.791 . 0 0 "[ . 1 . 2]" 1
456 1 33 VAL MG1 1 108 ILE QG . . 3.530 2.323 2.124 2.753 . 0 0 "[ . 1 . 2]" 1
457 1 33 VAL MG1 1 108 ILE HG13 . . 4.270 3.672 3.420 4.201 . 0 0 "[ . 1 . 2]" 1
458 1 33 VAL MG2 1 34 ILE H . . 3.960 3.564 3.419 3.716 . 0 0 "[ . 1 . 2]" 1
459 1 33 VAL MG2 1 65 PHE QD . . 3.320 2.612 2.076 3.079 . 0 0 "[ . 1 . 2]" 1
460 1 33 VAL MG2 1 65 PHE QE . . 3.450 2.271 1.970 2.578 . 0 0 "[ . 1 . 2]" 1
461 1 33 VAL MG2 1 65 PHE HZ . . 4.770 4.297 3.675 4.754 . 0 0 "[ . 1 . 2]" 1
462 1 33 VAL MG2 1 74 ILE HB . . 4.620 3.959 3.489 4.429 . 0 0 "[ . 1 . 2]" 1
463 1 33 VAL MG2 1 74 ILE MG . . 3.370 2.590 1.955 3.116 . 0 0 "[ . 1 . 2]" 1
464 1 33 VAL MG2 1 75 THR HA . . 3.540 2.673 2.270 3.089 . 0 0 "[ . 1 . 2]" 1
465 1 33 VAL MG2 1 75 THR HB . . 5.220 4.611 4.191 4.884 . 0 0 "[ . 1 . 2]" 1
466 1 33 VAL MG2 1 76 VAL H . . 4.120 3.302 2.633 3.768 . 0 0 "[ . 1 . 2]" 1
467 1 33 VAL MG2 1 108 ILE MD . . 4.120 3.468 3.044 3.905 . 0 0 "[ . 1 . 2]" 1
468 1 33 VAL MG2 1 108 ILE MG . . 4.260 3.532 3.080 4.040 . 0 0 "[ . 1 . 2]" 1
469 1 34 ILE H 1 34 ILE MG . . 3.400 2.266 2.088 2.462 . 0 0 "[ . 1 . 2]" 1
470 1 34 ILE H 1 73 LEU QD . . 3.830 3.414 2.948 3.794 . 0 0 "[ . 1 . 2]" 1
471 1 34 ILE H 1 74 ILE H . . 4.190 3.360 3.045 3.879 . 0 0 "[ . 1 . 2]" 1
472 1 34 ILE H 1 74 ILE HB . . 4.090 2.666 2.083 3.050 . 0 0 "[ . 1 . 2]" 1
473 1 34 ILE H 1 74 ILE MD . . 5.270 4.213 3.740 4.899 . 0 0 "[ . 1 . 2]" 1
474 1 34 ILE H 1 74 ILE MG . . 4.280 3.608 3.277 4.079 . 0 0 "[ . 1 . 2]" 1
475 1 34 ILE H 1 75 THR HA . . 5.230 4.736 4.414 4.995 . 0 0 "[ . 1 . 2]" 1
476 1 34 ILE HA 1 34 ILE MD . . 3.730 2.810 1.969 3.716 . 0 0 "[ . 1 . 2]" 1
477 1 34 ILE HA 1 34 ILE QG . . 3.330 2.541 2.187 2.981 . 0 0 "[ . 1 . 2]" 1
478 1 34 ILE HA 1 35 GLN H . . 3.080 2.244 2.189 2.311 . 0 0 "[ . 1 . 2]" 1
479 1 34 ILE HA 1 35 GLN QB . . 5.340 3.974 3.917 4.008 . 0 0 "[ . 1 . 2]" 1
480 1 34 ILE HB 1 34 ILE MD . . 3.330 2.390 2.149 3.184 . 0 0 "[ . 1 . 2]" 1
481 1 34 ILE HB 1 35 GLN H . . 4.650 4.009 3.871 4.139 . 0 0 "[ . 1 . 2]" 1
482 1 34 ILE HB 1 74 ILE HB . . 5.500 4.601 4.244 4.992 . 0 0 "[ . 1 . 2]" 1
483 1 34 ILE MD 1 35 GLN H . . 3.970 2.806 1.861 3.906 . 0 0 "[ . 1 . 2]" 1
484 1 34 ILE QG 1 35 GLN H . . 3.390 2.158 1.984 2.421 . 0 0 "[ . 1 . 2]" 1
485 1 34 ILE HG12 1 34 ILE MG . . 3.540 2.352 2.066 3.159 . 0 0 "[ . 1 . 2]" 1
486 1 34 ILE HG12 1 35 GLN H . . 3.980 3.251 2.067 3.980 . 0 0 "[ . 1 . 2]" 1
487 1 34 ILE HG13 1 34 ILE MG . . 3.540 2.723 2.405 3.188 . 0 0 "[ . 1 . 2]" 1
488 1 34 ILE HG13 1 35 GLN H . . 3.980 2.438 2.019 3.991 0.011 8 0 "[ . 1 . 2]" 1
489 1 34 ILE MG 1 35 GLN H . . 4.350 3.710 3.484 3.908 . 0 0 "[ . 1 . 2]" 1
490 1 34 ILE MG 1 74 ILE H . . 4.200 3.152 2.628 3.468 . 0 0 "[ . 1 . 2]" 1
491 1 34 ILE MG 1 74 ILE HB . . 3.280 2.130 1.919 2.486 . 0 0 "[ . 1 . 2]" 1
492 1 35 GLN H 1 35 GLN HB2 . . 3.730 3.075 2.811 3.258 . 0 0 "[ . 1 . 2]" 1
493 1 35 GLN H 1 35 GLN QB . . 3.220 2.506 2.416 2.602 . 0 0 "[ . 1 . 2]" 1
494 1 35 GLN H 1 35 GLN HB3 . . 3.730 2.671 2.518 2.909 . 0 0 "[ . 1 . 2]" 1
495 1 35 GLN H 1 36 LEU H . . 4.790 4.214 3.984 4.413 . 0 0 "[ . 1 . 2]" 1
496 1 35 GLN HA 1 35 GLN QG . . 3.670 2.574 2.271 3.015 . 0 0 "[ . 1 . 2]" 1
497 1 35 GLN HA 1 36 LEU H . . 3.190 2.157 2.139 2.199 . 0 0 "[ . 1 . 2]" 1
498 1 35 GLN HA 1 73 LEU HA . . 3.880 2.585 2.221 3.013 . 0 0 "[ . 1 . 2]" 1
499 1 35 GLN HA 1 73 LEU QD . . 3.620 2.493 2.006 2.847 . 0 0 "[ . 1 . 2]" 1
500 1 35 GLN HA 1 74 ILE H . . 4.070 3.478 3.075 3.910 . 0 0 "[ . 1 . 2]" 1
501 1 35 GLN QB 1 73 LEU QD . . 3.920 2.215 1.801 3.110 . 0 0 "[ . 1 . 2]" 1
502 1 35 GLN QE 1 71 THR HB . . 3.890 3.422 2.928 3.855 . 0 0 "[ . 1 . 2]" 1
503 1 35 GLN QG 1 36 LEU H . . 4.160 3.062 2.620 3.798 . 0 0 "[ . 1 . 2]" 1
504 1 35 GLN QG 1 73 LEU HA . . 4.610 3.759 2.699 4.610 . 0 0 "[ . 1 . 2]" 1
505 1 35 GLN HG2 1 36 LEU H . . 4.740 3.959 2.701 4.716 . 0 0 "[ . 1 . 2]" 1
506 1 35 GLN HG3 1 36 LEU H . . 4.740 3.389 2.711 4.635 . 0 0 "[ . 1 . 2]" 1
507 1 36 LEU H 1 36 LEU HB2 . . 4.030 2.385 2.172 2.617 . 0 0 "[ . 1 . 2]" 1
508 1 36 LEU H 1 36 LEU QB . . 3.360 2.353 2.152 2.564 . 0 0 "[ . 1 . 2]" 1
509 1 36 LEU H 1 36 LEU HB3 . . 4.030 3.606 3.486 3.690 . 0 0 "[ . 1 . 2]" 1
510 1 36 LEU H 1 36 LEU MD1 . . 4.380 3.575 1.909 3.977 . 0 0 "[ . 1 . 2]" 1
511 1 36 LEU H 1 36 LEU MD2 . . 4.520 3.894 2.097 4.272 . 0 0 "[ . 1 . 2]" 1
512 1 36 LEU H 1 36 LEU HG . . 4.080 3.007 2.406 3.828 . 0 0 "[ . 1 . 2]" 1
513 1 36 LEU H 1 72 GLY HA3 . . 4.670 4.310 3.947 4.665 . 0 0 "[ . 1 . 2]" 1
514 1 36 LEU H 1 73 LEU HA . . 4.100 3.323 2.796 3.842 . 0 0 "[ . 1 . 2]" 1
515 1 36 LEU H 1 73 LEU QD . . 4.400 4.127 3.478 4.386 . 0 0 "[ . 1 . 2]" 1
516 1 36 LEU HA 1 36 LEU MD1 . . 4.540 3.748 2.277 3.976 . 0 0 "[ . 1 . 2]" 1
517 1 36 LEU HA 1 36 LEU MD2 . . 3.370 2.335 1.965 3.454 0.084 15 0 "[ . 1 . 2]" 1
518 1 36 LEU HA 1 36 LEU HG . . 4.190 2.868 2.400 3.737 . 0 0 "[ . 1 . 2]" 1
519 1 36 LEU HA 1 37 HIS H . . 3.430 2.176 2.139 2.267 . 0 0 "[ . 1 . 2]" 1
520 1 36 LEU QB 1 36 LEU MD1 . . 3.160 2.055 1.974 2.146 . 0 0 "[ . 1 . 2]" 1
521 1 36 LEU QB 1 36 LEU MD2 . . 3.190 2.194 2.057 2.389 . 0 0 "[ . 1 . 2]" 1
522 1 36 LEU QB 1 37 HIS H . . 3.900 3.135 2.716 3.486 . 0 0 "[ . 1 . 2]" 1
523 1 36 LEU QB 1 51 TYR QE . . 4.120 3.412 2.626 4.006 . 0 0 "[ . 1 . 2]" 1
524 1 36 LEU HB2 1 36 LEU MD1 . . 3.630 2.239 2.030 3.166 . 0 0 "[ . 1 . 2]" 1
525 1 36 LEU HB2 1 37 HIS H . . 4.650 4.224 3.926 4.458 . 0 0 "[ . 1 . 2]" 1
526 1 36 LEU HB2 1 51 TYR QE . . 4.760 4.031 3.126 4.759 . 0 0 "[ . 1 . 2]" 1
527 1 36 LEU HB3 1 36 LEU MD1 . . 3.630 2.525 2.183 3.103 . 0 0 "[ . 1 . 2]" 1
528 1 36 LEU HB3 1 37 HIS H . . 4.650 3.237 2.769 3.655 . 0 0 "[ . 1 . 2]" 1
529 1 36 LEU HB3 1 51 TYR QE . . 4.760 3.727 2.823 4.327 . 0 0 "[ . 1 . 2]" 1
530 1 36 LEU MD1 1 92 VAL H . . 4.700 4.006 3.401 4.484 . 0 0 "[ . 1 . 2]" 1
531 1 36 LEU MD1 1 92 VAL HB . . 3.670 2.307 1.863 2.887 . 0 0 "[ . 1 . 2]" 1
532 1 36 LEU MD1 1 92 VAL MG1 . . 3.190 2.378 1.874 3.175 . 0 0 "[ . 1 . 2]" 1
533 1 36 LEU MD1 1 104 ALA MB . . 3.550 2.786 1.887 3.496 . 0 0 "[ . 1 . 2]" 1
534 1 36 LEU MD2 1 37 HIS H . . 4.410 3.468 2.798 4.282 . 0 0 "[ . 1 . 2]" 1
535 1 36 LEU MD2 1 104 ALA MB . . 3.680 2.613 1.899 3.598 . 0 0 "[ . 1 . 2]" 1
536 1 36 LEU HG 1 92 VAL MG2 . . 4.530 4.015 2.146 4.388 . 0 0 "[ . 1 . 2]" 1
537 1 37 HIS QB 1 39 THR MG . . 4.720 4.298 3.540 4.703 . 0 0 "[ . 1 . 2]" 1
538 1 37 HIS HD2 1 38 ALA H . . 4.790 3.667 2.513 4.786 . 0 0 "[ . 1 . 2]" 1
539 1 37 HIS HD2 1 39 THR MG . . 4.470 3.016 2.014 4.330 . 0 0 "[ . 1 . 2]" 1
540 1 38 ALA H 1 39 THR H . . 4.860 4.072 3.711 4.516 . 0 0 "[ . 1 . 2]" 1
541 1 38 ALA H 1 51 TYR QE . . 4.300 3.813 3.259 4.251 . 0 0 "[ . 1 . 2]" 1
542 1 38 ALA HA 1 39 THR MG . . 5.320 4.091 3.740 4.462 . 0 0 "[ . 1 . 2]" 1
543 1 38 ALA MB 1 39 THR H . . 4.560 3.364 2.713 3.593 . 0 0 "[ . 1 . 2]" 1
544 1 38 ALA MB 1 51 TYR QE . . 3.680 2.592 2.027 3.201 . 0 0 "[ . 1 . 2]" 1
545 1 38 ALA MB 1 94 ALA MB . . 3.280 2.813 2.327 3.137 . 0 0 "[ . 1 . 2]" 1
546 1 39 THR H 1 39 THR MG . . 4.080 2.996 2.670 3.158 . 0 0 "[ . 1 . 2]" 1
547 1 39 THR H 1 40 ASP H . . 5.280 4.365 4.007 4.547 . 0 0 "[ . 1 . 2]" 1
548 1 39 THR HA 1 39 THR MG . . 3.570 2.221 2.103 2.400 . 0 0 "[ . 1 . 2]" 1
549 1 39 THR HA 1 40 ASP H . . 3.360 2.223 2.141 2.378 . 0 0 "[ . 1 . 2]" 1
550 1 39 THR HA 1 49 ILE MD . . 4.340 3.172 2.524 3.574 . 0 0 "[ . 1 . 2]" 1
551 1 39 THR HB 1 40 ASP H . . 3.720 3.067 2.441 3.675 . 0 0 "[ . 1 . 2]" 1
552 1 39 THR MG 1 40 ASP H . . 4.480 3.807 3.470 4.127 . 0 0 "[ . 1 . 2]" 1
553 1 39 THR MG 1 49 ILE MD . . 4.690 4.178 3.447 4.657 . 0 0 "[ . 1 . 2]" 1
554 1 40 ASP H 1 40 ASP HB2 . . 4.100 3.093 2.278 3.762 . 0 0 "[ . 1 . 2]" 1
555 1 40 ASP H 1 40 ASP QB . . 3.470 2.562 2.186 3.163 . 0 0 "[ . 1 . 2]" 1
556 1 40 ASP H 1 40 ASP HB3 . . 4.100 2.906 2.228 3.830 . 0 0 "[ . 1 . 2]" 1
557 1 40 ASP H 1 49 ILE MD . . 4.520 3.306 2.518 3.997 . 0 0 "[ . 1 . 2]" 1
558 1 40 ASP HA 1 41 ALA MB . . 4.960 4.276 3.842 4.707 . 0 0 "[ . 1 . 2]" 1
559 1 40 ASP HA 1 49 ILE MD . . 5.500 4.702 3.548 5.470 . 0 0 "[ . 1 . 2]" 1
560 1 40 ASP QB 1 41 ALA H . . 4.160 2.943 2.131 4.046 . 0 0 "[ . 1 . 2]" 1
561 1 40 ASP HB2 1 41 ALA H . . 4.770 3.635 2.147 4.498 . 0 0 "[ . 1 . 2]" 1
562 1 40 ASP HB2 1 49 ILE MD . . 4.800 3.718 1.938 4.721 . 0 0 "[ . 1 . 2]" 1
563 1 40 ASP HB3 1 41 ALA H . . 4.770 3.366 2.225 4.587 . 0 0 "[ . 1 . 2]" 1
564 1 40 ASP HB3 1 49 ILE MD . . 4.800 3.669 2.036 4.798 . 0 0 "[ . 1 . 2]" 1
565 1 41 ALA H 1 41 ALA MB . . 3.400 2.337 2.032 2.909 . 0 0 "[ . 1 . 2]" 1
566 1 41 ALA H 1 42 ASP H . . 4.440 3.917 2.686 4.432 . 0 0 "[ . 1 . 2]" 1
567 1 41 ALA HA 1 43 ILE MG . . 4.650 4.133 3.148 4.682 0.032 12 0 "[ . 1 . 2]" 1
568 1 41 ALA MB 1 42 ASP H . . 3.880 3.267 2.197 3.719 . 0 0 "[ . 1 . 2]" 1
569 1 41 ALA MB 1 42 ASP HA . . 5.350 4.373 3.801 5.017 . 0 0 "[ . 1 . 2]" 1
570 1 41 ALA MB 1 42 ASP QB . . 5.340 4.596 3.643 5.165 . 0 0 "[ . 1 . 2]" 1
571 1 41 ALA MB 1 43 ILE MG . . 4.340 3.196 2.048 4.351 0.011 6 0 "[ . 1 . 2]" 1
572 1 42 ASP H 1 42 ASP HB2 . . 3.960 2.785 2.289 3.723 . 0 0 "[ . 1 . 2]" 1
573 1 42 ASP H 1 42 ASP HB3 . . 3.960 2.994 2.351 3.703 . 0 0 "[ . 1 . 2]" 1
574 1 42 ASP H 1 43 ILE H . . 4.090 3.036 2.144 4.006 . 0 0 "[ . 1 . 2]" 1
575 1 42 ASP HA 1 44 GLY H . . 5.500 5.238 4.782 5.522 0.022 8 0 "[ . 1 . 2]" 1
576 1 42 ASP QB 1 43 ILE H . . 3.930 3.324 2.115 3.933 0.003 19 0 "[ . 1 . 2]" 1
577 1 42 ASP HB2 1 43 ILE H . . 4.570 3.975 2.254 4.591 0.021 18 0 "[ . 1 . 2]" 1
578 1 42 ASP HB3 1 43 ILE H . . 4.570 3.734 2.130 4.569 . 0 0 "[ . 1 . 2]" 1
579 1 43 ILE H 1 43 ILE HB . . 3.790 3.189 2.471 3.738 . 0 0 "[ . 1 . 2]" 1
580 1 43 ILE H 1 43 ILE MD . . 4.790 3.851 3.366 4.443 . 0 0 "[ . 1 . 2]" 1
581 1 43 ILE H 1 43 ILE HG12 . . 4.690 3.360 1.901 4.689 . 0 0 "[ . 1 . 2]" 1
582 1 43 ILE H 1 43 ILE QG . . 4.100 2.840 1.832 4.084 . 0 0 "[ . 1 . 2]" 1
583 1 43 ILE H 1 43 ILE HG13 . . 4.690 3.223 1.896 4.509 . 0 0 "[ . 1 . 2]" 1
584 1 43 ILE H 1 43 ILE MG . . 4.080 2.448 1.872 3.146 . 0 0 "[ . 1 . 2]" 1
585 1 43 ILE H 1 44 GLY H . . 4.600 4.292 3.998 4.462 . 0 0 "[ . 1 . 2]" 1
586 1 43 ILE HA 1 43 ILE MD . . 4.290 3.418 1.959 4.170 . 0 0 "[ . 1 . 2]" 1
587 1 43 ILE HA 1 43 ILE MG . . 3.420 2.636 2.061 3.198 . 0 0 "[ . 1 . 2]" 1
588 1 43 ILE HA 1 44 GLY H . . 3.470 2.179 2.144 2.264 . 0 0 "[ . 1 . 2]" 1
589 1 43 ILE HB 1 43 ILE MD . . 3.550 2.296 2.096 2.601 . 0 0 "[ . 1 . 2]" 1
590 1 43 ILE HB 1 44 GLY H . . 4.700 4.026 3.460 4.454 . 0 0 "[ . 1 . 2]" 1
591 1 43 ILE MD 1 43 ILE MG . . 3.430 2.635 1.852 3.253 . 0 0 "[ . 1 . 2]" 1
592 1 43 ILE MG 1 44 GLY H . . 4.540 4.067 3.778 4.265 . 0 0 "[ . 1 . 2]" 1
593 1 44 GLY H 1 45 SER H . . 4.180 3.538 2.097 4.132 . 0 0 "[ . 1 . 2]" 1
594 1 47 ALA H 1 47 ALA MB . . 3.360 2.498 2.091 2.924 . 0 0 "[ . 1 . 2]" 1
595 1 47 ALA HA 1 48 GLU H . . 3.100 2.328 2.142 2.977 . 0 0 "[ . 1 . 2]" 1
596 1 47 ALA MB 1 48 GLU H . . 3.600 3.056 2.258 3.604 0.004 12 0 "[ . 1 . 2]" 1
597 1 47 ALA MB 1 49 ILE MD . . 4.270 3.849 2.863 4.270 . 9 0 "[ . 1 . 2]" 1
598 1 47 ALA MB 1 49 ILE QG . . 4.370 3.201 2.748 3.842 . 0 0 "[ . 1 . 2]" 1
599 1 47 ALA MB 1 96 ASP HB2 . . 4.630 3.378 2.080 4.179 . 0 0 "[ . 1 . 2]" 1
600 1 47 ALA MB 1 96 ASP QB . . 3.880 3.154 2.014 3.874 . 0 0 "[ . 1 . 2]" 1
601 1 47 ALA MB 1 96 ASP HB3 . . 4.630 4.065 2.210 4.626 . 0 0 "[ . 1 . 2]" 1
602 1 48 GLU H 1 48 GLU HB2 . . 3.870 2.549 2.161 3.801 . 0 0 "[ . 1 . 2]" 1
603 1 48 GLU H 1 48 GLU HB3 . . 3.870 3.536 2.965 3.842 . 0 0 "[ . 1 . 2]" 1
604 1 48 GLU H 1 48 GLU HG2 . . 4.310 3.647 1.968 4.379 0.069 11 0 "[ . 1 . 2]" 1
605 1 48 GLU H 1 48 GLU HG3 . . 4.310 3.547 2.468 4.215 . 0 0 "[ . 1 . 2]" 1
606 1 48 GLU H 1 49 ILE H . . 4.130 4.014 3.549 4.129 . 0 0 "[ . 1 . 2]" 1
607 1 48 GLU HA 1 48 GLU HG2 . . 4.140 3.092 2.381 3.675 . 0 0 "[ . 1 . 2]" 1
608 1 48 GLU HA 1 48 GLU QG . . 3.590 2.545 2.238 3.338 . 0 0 "[ . 1 . 2]" 1
609 1 48 GLU HA 1 48 GLU HG3 . . 4.140 2.988 2.262 3.928 . 0 0 "[ . 1 . 2]" 1
610 1 48 GLU HA 1 49 ILE H . . 3.090 2.246 2.145 2.327 . 0 0 "[ . 1 . 2]" 1
611 1 48 GLU HA 1 49 ILE HB . . 4.720 4.633 4.514 4.719 . 0 0 "[ . 1 . 2]" 1
612 1 48 GLU QB 1 49 ILE H . . 4.460 3.746 3.460 3.979 . 0 0 "[ . 1 . 2]" 1
613 1 49 ILE H 1 49 ILE HB . . 3.280 2.512 2.389 2.631 . 0 0 "[ . 1 . 2]" 1
614 1 49 ILE H 1 49 ILE MD . . 4.470 3.524 3.112 3.820 . 0 0 "[ . 1 . 2]" 1
615 1 49 ILE H 1 49 ILE HG12 . . 4.020 3.408 2.091 3.863 . 0 0 "[ . 1 . 2]" 1
616 1 49 ILE H 1 49 ILE HG13 . . 4.020 2.366 1.910 3.515 . 0 0 "[ . 1 . 2]" 1
617 1 49 ILE H 1 49 ILE MG . . 4.270 3.763 3.733 3.804 . 0 0 "[ . 1 . 2]" 1
618 1 49 ILE HA 1 49 ILE MD . . 4.070 3.669 2.153 3.916 . 0 0 "[ . 1 . 2]" 1
619 1 49 ILE HA 1 49 ILE HG12 . . 4.240 2.621 2.329 2.967 . 0 0 "[ . 1 . 2]" 1
620 1 49 ILE HA 1 49 ILE QG . . 3.690 2.445 2.263 2.861 . 0 0 "[ . 1 . 2]" 1
621 1 49 ILE HA 1 49 ILE HG13 . . 4.240 2.990 2.697 3.751 . 0 0 "[ . 1 . 2]" 1
622 1 49 ILE HA 1 49 ILE MG . . 3.660 2.409 2.295 2.495 . 0 0 "[ . 1 . 2]" 1
623 1 49 ILE HA 1 50 ARG H . . 3.010 2.149 2.139 2.203 . 0 0 "[ . 1 . 2]" 1
624 1 49 ILE HA 1 95 SER H . . 4.770 4.284 3.692 4.761 . 0 0 "[ . 1 . 2]" 1
625 1 49 ILE HB 1 49 ILE MD . . 3.670 2.399 2.139 3.212 . 0 0 "[ . 1 . 2]" 1
626 1 49 ILE HB 1 50 ARG H . . 4.790 4.276 3.947 4.481 . 0 0 "[ . 1 . 2]" 1
627 1 49 ILE MD 1 49 ILE MG . . 3.130 2.163 1.884 2.445 . 0 0 "[ . 1 . 2]" 1
628 1 49 ILE MD 1 50 ARG H . . 5.310 5.071 3.573 5.310 . 0 0 "[ . 1 . 2]" 1
629 1 49 ILE MD 1 96 ASP HB2 . . 4.550 3.544 1.926 4.551 0.001 11 0 "[ . 1 . 2]" 1
630 1 49 ILE MD 1 96 ASP QB . . 3.890 2.860 1.912 3.500 . 0 0 "[ . 1 . 2]" 1
631 1 49 ILE MD 1 96 ASP HB3 . . 4.550 3.366 2.148 4.560 0.010 6 0 "[ . 1 . 2]" 1
632 1 49 ILE QG 1 49 ILE MG . . 3.280 2.235 2.037 2.414 . 0 0 "[ . 1 . 2]" 1
633 1 49 ILE QG 1 96 ASP QB . . 4.580 2.269 1.906 4.228 . 0 0 "[ . 1 . 2]" 1
634 1 49 ILE HG12 1 49 ILE MG . . 3.750 2.363 2.064 3.186 . 0 0 "[ . 1 . 2]" 1
635 1 49 ILE HG13 1 49 ILE MG . . 3.750 3.103 2.366 3.199 . 0 0 "[ . 1 . 2]" 1
636 1 49 ILE MG 1 50 ARG H . . 3.700 2.678 2.293 3.260 . 0 0 "[ . 1 . 2]" 1
637 1 49 ILE MG 1 50 ARG HA . . 4.670 3.786 3.552 3.981 . 0 0 "[ . 1 . 2]" 1
638 1 49 ILE MG 1 51 TYR HA . . 4.810 4.186 3.823 4.785 . 0 0 "[ . 1 . 2]" 1
639 1 49 ILE MG 1 51 TYR QD . . 4.210 3.687 3.359 4.013 . 0 0 "[ . 1 . 2]" 1
640 1 49 ILE MG 1 51 TYR QE . . 3.850 3.054 2.443 3.638 . 0 0 "[ . 1 . 2]" 1
641 1 49 ILE MG 1 94 ALA HA . . 4.840 2.939 2.448 3.803 . 0 0 "[ . 1 . 2]" 1
642 1 49 ILE MG 1 94 ALA MB . . 3.380 2.273 1.813 2.803 . 0 0 "[ . 1 . 2]" 1
643 1 49 ILE MG 1 95 SER H . . 4.080 2.793 2.063 3.904 . 0 0 "[ . 1 . 2]" 1
644 1 50 ARG H 1 50 ARG QB . . 3.630 2.354 2.201 2.597 . 0 0 "[ . 1 . 2]" 1
645 1 50 ARG H 1 50 ARG HG2 . . 5.160 3.742 2.073 4.952 . 0 0 "[ . 1 . 2]" 1
646 1 50 ARG H 1 50 ARG QG . . 4.380 3.378 2.052 4.224 . 0 0 "[ . 1 . 2]" 1
647 1 50 ARG H 1 50 ARG HG3 . . 5.160 4.063 3.280 4.591 . 0 0 "[ . 1 . 2]" 1
648 1 50 ARG H 1 95 SER QB . . 4.940 4.364 3.438 4.840 . 0 0 "[ . 1 . 2]" 1
649 1 50 ARG HA 1 50 ARG HD2 . . 4.350 3.024 2.193 4.350 . 0 0 "[ . 1 . 2]" 1
650 1 50 ARG HA 1 50 ARG QD . . 3.720 2.413 1.975 3.674 . 0 0 "[ . 1 . 2]" 1
651 1 50 ARG HA 1 50 ARG HD3 . . 4.350 3.053 1.991 4.333 . 0 0 "[ . 1 . 2]" 1
652 1 50 ARG HA 1 51 TYR H . . 3.270 2.204 2.139 2.393 . 0 0 "[ . 1 . 2]" 1
653 1 50 ARG HA 1 51 TYR QD . . 4.190 3.413 2.933 3.760 . 0 0 "[ . 1 . 2]" 1
654 1 50 ARG HA 1 69 ASN QB . . 5.340 3.676 2.411 4.777 . 0 0 "[ . 1 . 2]" 1
655 1 50 ARG QB 1 50 ARG QD . . 3.220 2.388 2.050 2.716 . 0 0 "[ . 1 . 2]" 1
656 1 50 ARG QB 1 51 TYR H . . 3.950 3.190 2.638 3.766 . 0 0 "[ . 1 . 2]" 1
657 1 50 ARG QB 1 51 TYR QD . . 5.120 4.922 4.417 5.117 . 0 0 "[ . 1 . 2]" 1
658 1 50 ARG QB 1 69 ASN HB2 . . 5.040 4.658 3.558 5.045 0.005 9 0 "[ . 1 . 2]" 1
659 1 50 ARG QB 1 69 ASN QB . . 4.300 3.315 2.186 3.983 . 0 0 "[ . 1 . 2]" 1
660 1 50 ARG QB 1 69 ASN HB3 . . 5.040 3.404 2.206 4.172 . 0 0 "[ . 1 . 2]" 1
661 1 50 ARG QB 1 95 SER QB . . 4.990 4.344 3.275 4.941 . 0 0 "[ . 1 . 2]" 1
662 1 50 ARG QD 1 70 THR MG . . 4.130 3.705 3.111 4.049 . 0 0 "[ . 1 . 2]" 1
663 1 50 ARG HD2 1 70 THR MG . . 4.980 4.195 3.316 4.963 . 0 0 "[ . 1 . 2]" 1
664 1 50 ARG HD3 1 70 THR MG . . 4.980 4.292 3.462 4.920 . 0 0 "[ . 1 . 2]" 1
665 1 50 ARG QG 1 69 ASN QB . . 4.400 3.398 1.960 4.366 . 0 0 "[ . 1 . 2]" 1
666 1 51 TYR H 1 51 TYR QB . . 3.560 2.608 2.462 2.740 . 0 0 "[ . 1 . 2]" 1
667 1 51 TYR H 1 51 TYR QD . . 3.700 2.362 1.898 3.075 . 0 0 "[ . 1 . 2]" 1
668 1 51 TYR H 1 69 ASN HA . . 3.850 2.456 1.902 3.107 . 0 0 "[ . 1 . 2]" 1
669 1 51 TYR H 1 69 ASN QB . . 4.530 2.945 2.211 3.702 . 0 0 "[ . 1 . 2]" 1
670 1 51 TYR HA 1 51 TYR QD . . 4.110 3.033 2.805 3.279 . 0 0 "[ . 1 . 2]" 1
671 1 51 TYR HA 1 52 ILE H . . 3.130 2.179 2.138 2.357 . 0 0 "[ . 1 . 2]" 1
672 1 51 TYR HA 1 67 LEU MD2 . . 5.330 4.423 3.629 5.266 . 0 0 "[ . 1 . 2]" 1
673 1 51 TYR HA 1 92 VAL MG1 . . 4.290 3.234 2.753 3.805 . 0 0 "[ . 1 . 2]" 1
674 1 51 TYR HA 1 94 ALA HA . . 3.910 3.164 2.719 3.452 . 0 0 "[ . 1 . 2]" 1
675 1 51 TYR HA 1 94 ALA MB . . 5.500 4.131 3.713 4.517 . 0 0 "[ . 1 . 2]" 1
676 1 51 TYR HA 1 95 SER H . . 4.630 4.284 3.520 4.624 . 0 0 "[ . 1 . 2]" 1
677 1 51 TYR QB 1 52 ILE H . . 4.260 3.202 2.579 3.557 . 0 0 "[ . 1 . 2]" 1
678 1 51 TYR QB 1 67 LEU MD1 . . 3.500 2.684 2.151 3.067 . 0 0 "[ . 1 . 2]" 1
679 1 51 TYR QB 1 67 LEU MD2 . . 3.660 2.949 2.481 3.456 . 0 0 "[ . 1 . 2]" 1
680 1 51 TYR QB 1 69 ASN HA . . 3.970 2.543 2.014 3.264 . 0 0 "[ . 1 . 2]" 1
681 1 51 TYR QB 1 92 VAL MG1 . . 3.460 2.054 1.840 2.426 . 0 0 "[ . 1 . 2]" 1
682 1 51 TYR HB2 1 67 LEU MD1 . . 4.000 3.028 2.364 3.587 . 0 0 "[ . 1 . 2]" 1
683 1 51 TYR HB2 1 67 LEU MD2 . . 4.250 3.462 3.084 3.974 . 0 0 "[ . 1 . 2]" 1
684 1 51 TYR HB2 1 92 VAL MG1 . . 4.240 3.385 2.901 3.774 . 0 0 "[ . 1 . 2]" 1
685 1 51 TYR HB3 1 67 LEU MD1 . . 4.000 3.056 2.347 3.696 . 0 0 "[ . 1 . 2]" 1
686 1 51 TYR HB3 1 67 LEU MD2 . . 4.250 3.221 2.611 4.069 . 0 0 "[ . 1 . 2]" 1
687 1 51 TYR HB3 1 92 VAL MG1 . . 4.240 2.073 1.857 2.457 . 0 0 "[ . 1 . 2]" 1
688 1 51 TYR QD 1 52 ILE H . . 4.610 4.483 4.168 4.603 . 0 0 "[ . 1 . 2]" 1
689 1 51 TYR QD 1 67 LEU MD1 . . 4.520 4.100 3.608 4.511 . 0 0 "[ . 1 . 2]" 1
690 1 51 TYR QD 1 69 ASN HA . . 4.590 2.886 2.031 3.770 . 0 0 "[ . 1 . 2]" 1
691 1 51 TYR QD 1 72 GLY H . . 4.020 3.135 2.185 4.004 . 0 0 "[ . 1 . 2]" 1
692 1 51 TYR QD 1 72 GLY HA2 . . 4.640 3.097 2.514 3.869 . 0 0 "[ . 1 . 2]" 1
693 1 51 TYR QD 1 72 GLY HA3 . . 4.640 3.159 2.288 3.776 . 0 0 "[ . 1 . 2]" 1
694 1 51 TYR QD 1 92 VAL HB . . 5.350 4.416 3.894 4.896 . 0 0 "[ . 1 . 2]" 1
695 1 51 TYR QD 1 92 VAL MG1 . . 3.510 2.255 1.940 2.712 . 0 0 "[ . 1 . 2]" 1
696 1 51 TYR QD 1 94 ALA HA . . 4.840 3.636 3.068 4.087 . 0 0 "[ . 1 . 2]" 1
697 1 51 TYR QD 1 94 ALA MB . . 3.820 2.926 2.444 3.512 . 0 0 "[ . 1 . 2]" 1
698 1 51 TYR QE 1 72 GLY HA2 . . 5.160 4.235 3.588 5.038 . 0 0 "[ . 1 . 2]" 1
699 1 51 TYR QE 1 92 VAL MG1 . . 4.690 3.950 3.531 4.514 . 0 0 "[ . 1 . 2]" 1
700 1 51 TYR QE 1 94 ALA MB . . 3.730 2.744 2.158 3.361 . 0 0 "[ . 1 . 2]" 1
701 1 52 ILE H 1 52 ILE MD . . 4.470 3.602 1.849 4.151 . 0 0 "[ . 1 . 2]" 1
702 1 52 ILE H 1 52 ILE HG12 . . 4.150 2.693 1.985 3.723 . 0 0 "[ . 1 . 2]" 1
703 1 52 ILE H 1 52 ILE QG . . 3.460 2.252 1.908 3.073 . 0 0 "[ . 1 . 2]" 1
704 1 52 ILE H 1 52 ILE HG13 . . 4.150 2.722 1.917 4.078 . 0 0 "[ . 1 . 2]" 1
705 1 52 ILE H 1 52 ILE MG . . 4.050 2.966 2.659 3.231 . 0 0 "[ . 1 . 2]" 1
706 1 52 ILE H 1 67 LEU MD2 . . 4.420 3.701 3.069 4.259 . 0 0 "[ . 1 . 2]" 1
707 1 52 ILE H 1 92 VAL MG1 . . 4.070 3.202 2.661 3.743 . 0 0 "[ . 1 . 2]" 1
708 1 52 ILE H 1 93 LEU H . . 4.090 2.904 2.489 3.473 . 0 0 "[ . 1 . 2]" 1
709 1 52 ILE H 1 93 LEU HB2 . . 4.530 3.321 2.855 3.813 . 0 0 "[ . 1 . 2]" 1
710 1 52 ILE H 1 94 ALA HA . . 4.600 4.409 4.062 4.593 . 0 0 "[ . 1 . 2]" 1
711 1 52 ILE HA 1 52 ILE MD . . 4.430 3.995 3.547 4.177 . 0 0 "[ . 1 . 2]" 1
712 1 52 ILE HA 1 52 ILE MG . . 3.300 2.285 2.135 2.512 . 0 0 "[ . 1 . 2]" 1
713 1 52 ILE HA 1 53 PHE H . . 3.110 2.452 2.280 2.565 . 0 0 "[ . 1 . 2]" 1
714 1 52 ILE HA 1 67 LEU MD2 . . 3.640 2.657 2.089 2.935 . 0 0 "[ . 1 . 2]" 1
715 1 52 ILE HA 1 69 ASN HD21 . . 4.620 3.111 2.079 4.621 0.001 9 0 "[ . 1 . 2]" 1
716 1 52 ILE HA 1 69 ASN QD . . 3.960 2.683 2.013 3.241 . 0 0 "[ . 1 . 2]" 1
717 1 52 ILE HA 1 69 ASN HD22 . . 4.620 3.098 2.407 3.731 . 0 0 "[ . 1 . 2]" 1
718 1 52 ILE HB 1 53 PHE H . . 3.360 2.286 2.045 2.697 . 0 0 "[ . 1 . 2]" 1
719 1 52 ILE HB 1 93 LEU HB2 . . 5.480 4.892 4.524 5.208 . 0 0 "[ . 1 . 2]" 1
720 1 52 ILE MD 1 52 ILE MG . . 3.700 2.384 1.879 3.167 . 0 0 "[ . 1 . 2]" 1
721 1 52 ILE MD 1 53 PHE H . . 4.600 3.766 2.965 4.580 . 0 0 "[ . 1 . 2]" 1
722 1 52 ILE MD 1 93 LEU HB2 . . 4.080 2.883 2.007 3.730 . 0 0 "[ . 1 . 2]" 1
723 1 52 ILE QG 1 53 PHE H . . 4.400 3.597 3.134 4.255 . 0 0 "[ . 1 . 2]" 1
724 1 52 ILE QG 1 93 LEU HB2 . . 3.550 2.293 1.898 2.635 . 0 0 "[ . 1 . 2]" 1
725 1 52 ILE QG 1 93 LEU HB3 . . 4.090 3.553 3.215 3.968 . 0 0 "[ . 1 . 2]" 1
726 1 52 ILE HG12 1 93 LEU HB2 . . 4.080 3.017 2.085 3.912 . 0 0 "[ . 1 . 2]" 1
727 1 52 ILE HG13 1 93 LEU HB2 . . 4.080 2.502 2.069 3.954 . 0 0 "[ . 1 . 2]" 1
728 1 52 ILE MG 1 53 PHE H . . 3.920 3.612 3.394 3.802 . 0 0 "[ . 1 . 2]" 1
729 1 52 ILE MG 1 67 LEU MD2 . . 4.480 4.185 3.669 4.443 . 0 0 "[ . 1 . 2]" 1
730 1 52 ILE MG 1 69 ASN QB . . 4.390 3.397 2.563 3.902 . 0 0 "[ . 1 . 2]" 1
731 1 52 ILE MG 1 69 ASN HD21 . . 4.360 2.505 1.902 4.309 . 0 0 "[ . 1 . 2]" 1
732 1 52 ILE MG 1 69 ASN QD . . 3.810 2.350 1.797 3.240 . 0 0 "[ . 1 . 2]" 1
733 1 52 ILE MG 1 69 ASN HD22 . . 4.360 3.077 2.176 3.980 . 0 0 "[ . 1 . 2]" 1
734 1 53 PHE H 1 53 PHE HB2 . . 3.750 2.307 2.232 2.420 . 0 0 "[ . 1 . 2]" 1
735 1 53 PHE H 1 53 PHE QB . . 3.130 2.279 2.209 2.384 . 0 0 "[ . 1 . 2]" 1
736 1 53 PHE H 1 53 PHE HB3 . . 3.750 3.559 3.523 3.599 . 0 0 "[ . 1 . 2]" 1
737 1 53 PHE H 1 53 PHE QD . . 4.170 2.839 2.332 3.213 . 0 0 "[ . 1 . 2]" 1
738 1 53 PHE H 1 67 LEU MD2 . . 3.810 3.255 2.544 3.677 . 0 0 "[ . 1 . 2]" 1
739 1 53 PHE HA 1 53 PHE QD . . 3.560 2.566 2.291 2.939 . 0 0 "[ . 1 . 2]" 1
740 1 53 PHE HA 1 53 PHE QE . . 4.540 4.418 4.271 4.546 0.006 14 0 "[ . 1 . 2]" 1
741 1 53 PHE HA 1 54 GLY H . . 3.220 2.208 2.143 2.261 . 0 0 "[ . 1 . 2]" 1
742 1 53 PHE HA 1 57 VAL QG . . 4.110 3.693 3.314 4.062 . 0 0 "[ . 1 . 2]" 1
743 1 53 PHE HA 1 67 LEU MD2 . . 4.240 2.988 2.526 3.216 . 0 0 "[ . 1 . 2]" 1
744 1 53 PHE HA 1 90 VAL MG1 . . 4.780 3.999 3.466 4.337 . 0 0 "[ . 1 . 2]" 1
745 1 53 PHE HA 1 92 VAL MG2 . . 4.630 4.105 3.624 4.512 . 0 0 "[ . 1 . 2]" 1
746 1 53 PHE QB 1 54 GLY H . . 3.960 2.991 2.769 3.398 . 0 0 "[ . 1 . 2]" 1
747 1 53 PHE QB 1 57 VAL HB . . 3.980 3.147 2.858 3.366 . 0 0 "[ . 1 . 2]" 1
748 1 53 PHE QB 1 57 VAL QG . . 3.310 2.526 2.011 2.829 . 0 0 "[ . 1 . 2]" 1
749 1 53 PHE QB 1 62 LYS QD . . 4.640 3.137 2.226 4.194 . 0 0 "[ . 1 . 2]" 1
750 1 53 PHE QB 1 62 LYS QE . . 4.530 3.319 2.435 4.081 . 0 0 "[ . 1 . 2]" 1
751 1 53 PHE QB 1 62 LYS QG . . 5.160 3.553 2.927 3.930 . 0 0 "[ . 1 . 2]" 1
752 1 53 PHE HB2 1 54 GLY H . . 4.730 4.178 3.967 4.446 . 0 0 "[ . 1 . 2]" 1
753 1 53 PHE HB2 1 57 VAL HB . . 4.780 4.516 3.973 4.757 . 0 0 "[ . 1 . 2]" 1
754 1 53 PHE HB2 1 57 VAL MG1 . . 5.060 4.377 3.730 4.651 . 0 0 "[ . 1 . 2]" 1
755 1 53 PHE HB2 1 57 VAL MG2 . . 5.060 4.204 3.334 4.639 . 0 0 "[ . 1 . 2]" 1
756 1 53 PHE HB3 1 54 GLY H . . 4.730 3.065 2.826 3.526 . 0 0 "[ . 1 . 2]" 1
757 1 53 PHE HB3 1 57 VAL HB . . 4.780 3.214 2.907 3.444 . 0 0 "[ . 1 . 2]" 1
758 1 53 PHE HB3 1 57 VAL MG1 . . 5.060 3.063 2.642 3.389 . 0 0 "[ . 1 . 2]" 1
759 1 53 PHE HB3 1 57 VAL MG2 . . 5.060 2.785 2.098 3.261 . 0 0 "[ . 1 . 2]" 1
760 1 53 PHE QD 1 54 GLY H . . 4.400 3.458 3.019 3.762 . 0 0 "[ . 1 . 2]" 1
761 1 53 PHE QD 1 57 VAL MG1 . . 3.950 2.837 1.987 3.381 . 0 0 "[ . 1 . 2]" 1
762 1 53 PHE QD 1 57 VAL MG2 . . 3.950 3.429 2.937 3.825 . 0 0 "[ . 1 . 2]" 1
763 1 53 PHE QD 1 62 LYS QD . . 4.320 3.196 2.352 4.304 . 0 0 "[ . 1 . 2]" 1
764 1 53 PHE QD 1 67 LEU QB . . 4.660 3.874 3.377 4.221 . 0 0 "[ . 1 . 2]" 1
765 1 53 PHE QD 1 67 LEU MD2 . . 4.530 3.118 2.672 3.523 . 0 0 "[ . 1 . 2]" 1
766 1 53 PHE QD 1 90 VAL MG1 . . 3.800 2.692 2.041 3.221 . 0 0 "[ . 1 . 2]" 1
767 1 53 PHE QE 1 57 VAL QG . . 4.300 3.780 3.276 4.272 . 0 0 "[ . 1 . 2]" 1
768 1 53 PHE QE 1 62 LYS HA . . 4.590 3.249 2.595 3.785 . 0 0 "[ . 1 . 2]" 1
769 1 53 PHE QE 1 62 LYS QG . . 3.890 2.882 2.408 3.388 . 0 0 "[ . 1 . 2]" 1
770 1 53 PHE QE 1 90 VAL MG1 . . 3.640 2.553 1.929 3.452 . 0 0 "[ . 1 . 2]" 1
771 1 53 PHE QE 1 90 VAL MG2 . . 4.340 3.675 2.972 4.319 . 0 0 "[ . 1 . 2]" 1
772 1 53 PHE HZ 1 62 LYS HA . . 4.860 3.094 2.184 3.640 . 0 0 "[ . 1 . 2]" 1
773 1 53 PHE HZ 1 62 LYS QG . . 4.190 3.307 2.752 3.824 . 0 0 "[ . 1 . 2]" 1
774 1 53 PHE HZ 1 67 LEU HB2 . . 4.790 3.376 2.352 4.181 . 0 0 "[ . 1 . 2]" 1
775 1 53 PHE HZ 1 67 LEU QB . . 4.160 2.619 2.106 3.290 . 0 0 "[ . 1 . 2]" 1
776 1 53 PHE HZ 1 67 LEU HB3 . . 4.790 2.771 2.280 3.538 . 0 0 "[ . 1 . 2]" 1
777 1 54 GLY H 1 57 VAL MG1 . . 4.960 4.212 3.929 4.536 . 0 0 "[ . 1 . 2]" 1
778 1 54 GLY H 1 57 VAL QG . . 3.540 2.710 2.450 2.960 . 0 0 "[ . 1 . 2]" 1
779 1 54 GLY H 1 57 VAL MG2 . . 4.960 2.744 2.475 3.005 . 0 0 "[ . 1 . 2]" 1
780 1 54 GLY H 1 67 LEU MD2 . . 4.970 4.596 4.116 4.872 . 0 0 "[ . 1 . 2]" 1
781 1 54 GLY H 1 90 VAL MG1 . . 5.180 3.992 3.527 4.507 . 0 0 "[ . 1 . 2]" 1
782 1 54 GLY H 1 91 THR HB . . 4.280 3.292 2.508 4.013 . 0 0 "[ . 1 . 2]" 1
783 1 54 GLY H 1 91 THR MG . . 4.370 4.063 3.470 4.366 . 0 0 "[ . 1 . 2]" 1
784 1 54 GLY H 1 93 LEU QD . . 4.430 4.028 2.764 4.415 . 0 0 "[ . 1 . 2]" 1
785 1 54 GLY QA 1 55 ALA MB . . 4.640 3.727 3.681 3.768 . 0 0 "[ . 1 . 2]" 1
786 1 54 GLY QA 1 57 VAL QG . . 4.040 2.897 2.517 3.151 . 0 0 "[ . 1 . 2]" 1
787 1 54 GLY QA 1 91 THR MG . . 3.810 2.927 2.410 3.269 . 0 0 "[ . 1 . 2]" 1
788 1 54 GLY QA 1 93 LEU QD . . 3.100 2.091 1.762 2.620 . 0 0 "[ . 1 . 2]" 1
789 1 54 GLY QA 1 93 LEU HG . . 4.090 2.619 2.168 3.406 . 0 0 "[ . 1 . 2]" 1
790 1 54 GLY HA2 1 91 THR MG . . 4.450 3.836 3.412 4.413 . 0 0 "[ . 1 . 2]" 1
791 1 54 GLY HA2 1 93 LEU MD1 . . 5.270 2.266 1.828 4.181 . 0 0 "[ . 1 . 2]" 1
792 1 54 GLY HA2 1 93 LEU MD2 . . 5.270 3.563 1.894 4.273 . 0 0 "[ . 1 . 2]" 1
793 1 54 GLY HA2 1 93 LEU HG . . 4.750 2.705 2.205 3.618 . 0 0 "[ . 1 . 2]" 1
794 1 54 GLY HA3 1 91 THR MG . . 4.450 3.052 2.464 3.481 . 0 0 "[ . 1 . 2]" 1
795 1 54 GLY HA3 1 93 LEU MD1 . . 5.270 3.535 2.761 4.475 . 0 0 "[ . 1 . 2]" 1
796 1 54 GLY HA3 1 93 LEU MD2 . . 5.270 4.113 2.107 5.000 . 0 0 "[ . 1 . 2]" 1
797 1 54 GLY HA3 1 93 LEU HG . . 4.750 3.623 2.895 4.242 . 0 0 "[ . 1 . 2]" 1
798 1 55 ALA HA 1 57 VAL H . . 4.500 3.696 3.360 3.946 . 0 0 "[ . 1 . 2]" 1
799 1 55 ALA MB 1 56 GLN HA . . 4.720 4.266 4.157 4.474 . 0 0 "[ . 1 . 2]" 1
800 1 55 ALA MB 1 56 GLN QG . . 4.250 3.049 2.473 4.041 . 0 0 "[ . 1 . 2]" 1
801 1 56 GLN H 1 57 VAL H . . 4.100 2.795 2.621 2.966 . 0 0 "[ . 1 . 2]" 1
802 1 56 GLN HA 1 56 GLN QG . . 3.630 2.505 2.249 2.941 . 0 0 "[ . 1 . 2]" 1
803 1 56 GLN QB 1 57 VAL QG . . 4.250 3.921 3.776 4.099 . 0 0 "[ . 1 . 2]" 1
804 1 57 VAL H 1 57 VAL HB . . 3.160 2.549 2.435 2.635 . 0 0 "[ . 1 . 2]" 1
805 1 57 VAL H 1 57 VAL MG1 . . 3.980 3.809 3.750 3.849 . 0 0 "[ . 1 . 2]" 1
806 1 57 VAL H 1 57 VAL QG . . 3.080 2.593 2.332 2.767 . 0 0 "[ . 1 . 2]" 1
807 1 57 VAL H 1 57 VAL MG2 . . 3.980 2.640 2.352 2.837 . 0 0 "[ . 1 . 2]" 1
808 1 57 VAL H 1 58 ALA H . . 4.550 4.373 4.232 4.503 . 0 0 "[ . 1 . 2]" 1
809 1 57 VAL HA 1 57 VAL MG1 . . 3.400 2.403 2.290 2.476 . 0 0 "[ . 1 . 2]" 1
810 1 57 VAL HA 1 57 VAL QG . . 2.930 2.107 2.062 2.169 . 0 0 "[ . 1 . 2]" 1
811 1 57 VAL HA 1 57 VAL MG2 . . 3.400 2.339 2.245 2.495 . 0 0 "[ . 1 . 2]" 1
812 1 57 VAL HA 1 58 ALA H . . 2.840 2.148 2.140 2.175 . 0 0 "[ . 1 . 2]" 1
813 1 57 VAL HA 1 58 ALA MB . . 4.090 3.972 3.918 4.015 . 0 0 "[ . 1 . 2]" 1
814 1 57 VAL HB 1 58 ALA H . . 4.590 4.252 3.996 4.424 . 0 0 "[ . 1 . 2]" 1
815 1 57 VAL HB 1 62 LYS HE2 . . 4.640 3.103 2.004 4.646 0.006 19 0 "[ . 1 . 2]" 1
816 1 57 VAL HB 1 62 LYS QE . . 4.070 2.785 1.996 3.880 . 0 0 "[ . 1 . 2]" 1
817 1 57 VAL HB 1 62 LYS HE3 . . 4.640 3.673 2.760 4.467 . 0 0 "[ . 1 . 2]" 1
818 1 57 VAL HB 1 62 LYS QG . . 4.530 3.941 3.431 4.390 . 0 0 "[ . 1 . 2]" 1
819 1 57 VAL QG 1 58 ALA H . . 3.340 2.599 2.235 2.985 . 0 0 "[ . 1 . 2]" 1
820 1 57 VAL QG 1 58 ALA MB . . 4.230 3.494 3.212 3.620 . 0 0 "[ . 1 . 2]" 1
821 1 57 VAL QG 1 61 THR H . . 5.220 4.534 4.238 5.006 . 0 0 "[ . 1 . 2]" 1
822 1 57 VAL QG 1 61 THR HB . . 3.340 2.936 2.596 3.271 . 0 0 "[ . 1 . 2]" 1
823 1 57 VAL QG 1 61 THR MG . . 3.640 3.142 2.768 3.516 . 0 0 "[ . 1 . 2]" 1
824 1 57 VAL QG 1 62 LYS H . . 4.070 3.798 3.034 4.071 0.001 16 0 "[ . 1 . 2]" 1
825 1 57 VAL QG 1 62 LYS QD . . 3.870 2.939 1.969 3.758 . 0 0 "[ . 1 . 2]" 1
826 1 57 VAL QG 1 62 LYS QE . . 3.640 2.456 1.903 3.629 . 0 0 "[ . 1 . 2]" 1
827 1 57 VAL QG 1 90 VAL HA . . 3.500 3.214 2.782 3.487 . 0 0 "[ . 1 . 2]" 1
828 1 57 VAL QG 1 90 VAL MG2 . . 4.370 3.468 3.115 3.997 . 0 0 "[ . 1 . 2]" 1
829 1 57 VAL QG 1 91 THR H . . 3.090 2.902 2.397 3.089 . 0 0 "[ . 1 . 2]" 1
830 1 57 VAL MG1 1 58 ALA H . . 4.130 2.635 2.245 3.072 . 0 0 "[ . 1 . 2]" 1
831 1 57 VAL MG1 1 91 THR H . . 4.540 3.795 3.179 4.269 . 0 0 "[ . 1 . 2]" 1
832 1 57 VAL MG2 1 58 ALA H . . 4.130 4.055 3.988 4.106 . 0 0 "[ . 1 . 2]" 1
833 1 57 VAL MG2 1 91 THR H . . 4.540 3.027 2.433 3.441 . 0 0 "[ . 1 . 2]" 1
834 1 58 ALA H 1 58 ALA MB . . 3.030 2.153 2.027 2.240 . 0 0 "[ . 1 . 2]" 1
835 1 58 ALA H 1 61 THR HB . . 4.340 4.170 3.574 4.340 . 0 0 "[ . 1 . 2]" 1
836 1 58 ALA HA 1 59 PRO HD2 . . 3.330 2.321 2.244 2.454 . 0 0 "[ . 1 . 2]" 1
837 1 58 ALA HA 1 59 PRO HD3 . . 3.320 2.276 2.257 2.321 . 0 0 "[ . 1 . 2]" 1
838 1 58 ALA HA 1 59 PRO HG2 . . 4.710 4.448 4.387 4.557 . 0 0 "[ . 1 . 2]" 1
839 1 58 ALA HA 1 59 PRO HG3 . . 4.700 4.428 4.387 4.505 . 0 0 "[ . 1 . 2]" 1
840 1 58 ALA MB 1 59 PRO QB . . 5.170 4.571 4.425 4.665 . 0 0 "[ . 1 . 2]" 1
841 1 58 ALA MB 1 59 PRO HD2 . . 3.360 2.210 2.016 2.452 . 0 0 "[ . 1 . 2]" 1
842 1 58 ALA MB 1 59 PRO HD3 . . 3.760 3.367 3.188 3.478 . 0 0 "[ . 1 . 2]" 1
843 1 58 ALA MB 1 59 PRO HG2 . . 4.770 3.829 3.596 4.030 . 0 0 "[ . 1 . 2]" 1
844 1 58 ALA MB 1 60 ALA H . . 3.870 2.976 2.732 3.270 . 0 0 "[ . 1 . 2]" 1
845 1 58 ALA MB 1 60 ALA HA . . 5.500 5.004 4.836 5.120 . 0 0 "[ . 1 . 2]" 1
846 1 58 ALA MB 1 61 THR H . . 3.500 2.759 2.473 3.060 . 0 0 "[ . 1 . 2]" 1
847 1 58 ALA MB 1 61 THR HB . . 3.890 3.275 2.912 3.542 . 0 0 "[ . 1 . 2]" 1
848 1 58 ALA MB 1 61 THR MG . . 4.550 4.222 3.952 4.493 . 0 0 "[ . 1 . 2]" 1
849 1 59 PRO HA 1 62 LYS H . . 4.250 3.496 3.217 3.813 . 0 0 "[ . 1 . 2]" 1
850 1 59 PRO HA 1 62 LYS HB2 . . 4.460 2.815 2.543 3.074 . 0 0 "[ . 1 . 2]" 1
851 1 59 PRO HA 1 62 LYS QB . . 3.590 2.782 2.522 3.022 . 0 0 "[ . 1 . 2]" 1
852 1 59 PRO HA 1 62 LYS HB3 . . 4.460 4.359 4.142 4.462 0.002 19 0 "[ . 1 . 2]" 1
853 1 59 PRO HA 1 62 LYS QD . . 4.050 3.247 1.889 4.047 . 0 0 "[ . 1 . 2]" 1
854 1 59 PRO HA 1 62 LYS HE2 . . 4.640 3.936 2.142 4.642 0.002 20 0 "[ . 1 . 2]" 1
855 1 59 PRO HA 1 62 LYS QE . . 3.980 2.822 1.990 3.966 . 0 0 "[ . 1 . 2]" 1
856 1 59 PRO HA 1 62 LYS HE3 . . 4.640 3.043 2.003 4.674 0.034 19 0 "[ . 1 . 2]" 1
857 1 59 PRO HA 1 62 LYS QG . . 4.230 3.546 2.552 4.230 0.000 16 0 "[ . 1 . 2]" 1
858 1 59 PRO QB 1 60 ALA H . . 3.760 2.953 2.802 3.230 . 0 0 "[ . 1 . 2]" 1
859 1 59 PRO HD2 1 60 ALA H . . 4.360 2.704 2.648 2.767 . 0 0 "[ . 1 . 2]" 1
860 1 59 PRO HD2 1 60 ALA HA . . 5.500 5.442 5.390 5.504 0.004 19 0 "[ . 1 . 2]" 1
861 1 59 PRO HG2 1 60 ALA H . . 4.750 2.059 1.901 2.410 . 0 0 "[ . 1 . 2]" 1
862 1 59 PRO HG2 1 60 ALA HA . . 4.910 4.122 4.068 4.202 . 0 0 "[ . 1 . 2]" 1
863 1 60 ALA H 1 60 ALA MB . . 3.250 2.100 2.027 2.230 . 0 0 "[ . 1 . 2]" 1
864 1 60 ALA H 1 61 THR H . . 3.900 2.893 2.617 3.131 . 0 0 "[ . 1 . 2]" 1
865 1 60 ALA HA 1 63 ARG H . . 4.260 3.436 2.955 3.929 . 0 0 "[ . 1 . 2]" 1
866 1 60 ALA HA 1 63 ARG HB2 . . 4.070 3.215 2.472 4.069 . 0 0 "[ . 1 . 2]" 1
867 1 60 ALA HA 1 63 ARG QB . . 3.570 2.726 2.450 3.208 . 0 0 "[ . 1 . 2]" 1
868 1 60 ALA HA 1 63 ARG HB3 . . 4.070 3.429 2.548 4.075 0.005 19 0 "[ . 1 . 2]" 1
869 1 60 ALA HA 1 63 ARG HD2 . . 5.180 4.268 2.941 5.180 0.000 19 0 "[ . 1 . 2]" 1
870 1 60 ALA HA 1 63 ARG HD3 . . 5.180 4.325 2.418 5.105 . 0 0 "[ . 1 . 2]" 1
871 1 60 ALA HA 1 63 ARG QG . . 5.340 4.143 1.996 5.246 . 0 0 "[ . 1 . 2]" 1
872 1 60 ALA HA 1 64 LEU H . . 4.920 4.048 3.598 4.563 . 0 0 "[ . 1 . 2]" 1
873 1 60 ALA MB 1 61 THR H . . 3.580 2.509 2.106 2.790 . 0 0 "[ . 1 . 2]" 1
874 1 60 ALA MB 1 61 THR HA . . 4.810 3.701 3.538 3.837 . 0 0 "[ . 1 . 2]" 1
875 1 60 ALA MB 1 61 THR HB . . 4.790 4.641 4.419 4.790 . 0 0 "[ . 1 . 2]" 1
876 1 60 ALA MB 1 61 THR MG . . 5.160 4.891 4.767 5.000 . 0 0 "[ . 1 . 2]" 1
877 1 60 ALA MB 1 63 ARG H . . 5.330 4.503 4.157 5.006 . 0 0 "[ . 1 . 2]" 1
878 1 60 ALA MB 1 64 LEU QD . . 4.510 2.987 2.354 3.728 . 0 0 "[ . 1 . 2]" 1
879 1 60 ALA MB 1 85 THR MG . . 4.620 4.356 3.908 4.618 . 0 0 "[ . 1 . 2]" 1
880 1 60 ALA MB 1 88 HIS HE1 . . 4.210 3.908 3.640 4.203 . 0 0 "[ . 1 . 2]" 1
881 1 61 THR H 1 61 THR HB . . 3.150 2.575 2.408 2.794 . 0 0 "[ . 1 . 2]" 1
882 1 61 THR H 1 61 THR MG . . 3.960 3.764 3.732 3.782 . 0 0 "[ . 1 . 2]" 1
883 1 61 THR H 1 62 LYS H . . 3.280 2.740 2.544 2.945 . 0 0 "[ . 1 . 2]" 1
884 1 61 THR H 1 64 LEU QD . . 5.440 4.408 3.733 5.146 . 0 0 "[ . 1 . 2]" 1
885 1 61 THR HA 1 61 THR MG . . 3.370 2.351 2.282 2.468 . 0 0 "[ . 1 . 2]" 1
886 1 61 THR HA 1 64 LEU H . . 4.620 3.737 3.190 4.062 . 0 0 "[ . 1 . 2]" 1
887 1 61 THR HA 1 64 LEU QD . . 3.870 3.125 2.531 3.854 . 0 0 "[ . 1 . 2]" 1
888 1 61 THR HA 1 65 PHE QD . . 4.120 3.087 2.372 3.652 . 0 0 "[ . 1 . 2]" 1
889 1 61 THR HA 1 88 HIS HE1 . . 4.140 3.401 2.562 4.029 . 0 0 "[ . 1 . 2]" 1
890 1 61 THR HA 1 90 VAL MG2 . . 5.500 4.629 4.359 5.028 . 0 0 "[ . 1 . 2]" 1
891 1 61 THR HB 1 62 LYS H . . 3.600 2.682 2.133 3.215 . 0 0 "[ . 1 . 2]" 1
892 1 61 THR MG 1 62 LYS H . . 4.500 3.521 2.943 4.056 . 0 0 "[ . 1 . 2]" 1
893 1 61 THR MG 1 62 LYS HA . . 4.570 3.580 3.288 4.067 . 0 0 "[ . 1 . 2]" 1
894 1 61 THR MG 1 65 PHE QB . . 4.320 3.054 2.417 3.706 . 0 0 "[ . 1 . 2]" 1
895 1 61 THR MG 1 65 PHE QD . . 3.390 2.591 1.979 3.354 . 0 0 "[ . 1 . 2]" 1
896 1 61 THR MG 1 65 PHE QE . . 4.140 3.770 3.048 4.097 . 0 0 "[ . 1 . 2]" 1
897 1 61 THR MG 1 88 HIS QB . . 3.620 2.970 2.262 3.296 . 0 0 "[ . 1 . 2]" 1
898 1 61 THR MG 1 89 LYS H . . 4.580 3.954 2.974 4.560 . 0 0 "[ . 1 . 2]" 1
899 1 61 THR MG 1 90 VAL H . . 5.500 4.671 4.329 5.026 . 0 0 "[ . 1 . 2]" 1
900 1 61 THR MG 1 90 VAL HA . . 4.450 3.686 3.343 4.127 . 0 0 "[ . 1 . 2]" 1
901 1 61 THR MG 1 90 VAL MG1 . . 3.350 3.178 2.900 3.330 . 0 0 "[ . 1 . 2]" 1
902 1 61 THR MG 1 90 VAL MG2 . . 3.220 1.844 1.631 2.084 . 0 0 "[ . 1 . 2]" 1
903 1 62 LYS H 1 62 LYS HB2 . . 3.810 2.394 2.178 2.672 . 0 0 "[ . 1 . 2]" 1
904 1 62 LYS H 1 62 LYS QB . . 3.250 2.358 2.157 2.604 . 0 0 "[ . 1 . 2]" 1
905 1 62 LYS H 1 62 LYS HB3 . . 3.810 3.568 3.485 3.611 . 0 0 "[ . 1 . 2]" 1
906 1 62 LYS H 1 62 LYS QD . . 4.600 3.991 2.237 4.590 . 0 0 "[ . 1 . 2]" 1
907 1 62 LYS H 1 62 LYS QG . . 3.230 2.519 1.888 3.231 0.001 17 0 "[ . 1 . 2]" 1
908 1 62 LYS HA 1 62 LYS QD . . 4.350 3.955 3.271 4.253 . 0 0 "[ . 1 . 2]" 1
909 1 62 LYS HA 1 62 LYS HG2 . . 3.790 2.586 2.344 3.497 . 0 0 "[ . 1 . 2]" 1
910 1 62 LYS HA 1 62 LYS QG . . 3.180 2.371 2.225 2.631 . 0 0 "[ . 1 . 2]" 1
911 1 62 LYS HA 1 62 LYS HG3 . . 3.790 2.914 2.251 3.310 . 0 0 "[ . 1 . 2]" 1
912 1 62 LYS HA 1 65 PHE H . . 4.340 3.841 3.457 4.252 . 0 0 "[ . 1 . 2]" 1
913 1 62 LYS QB 1 62 LYS QE . . 3.920 2.778 2.046 3.671 . 0 0 "[ . 1 . 2]" 1
914 1 62 LYS QB 1 63 ARG H . . 3.400 2.770 2.109 3.078 . 0 0 "[ . 1 . 2]" 1
915 1 62 LYS HB2 1 62 LYS QD . . 3.520 2.516 2.062 2.963 . 0 0 "[ . 1 . 2]" 1
916 1 62 LYS HB2 1 62 LYS HE2 . . 5.500 3.918 2.403 4.810 . 0 0 "[ . 1 . 2]" 1
917 1 62 LYS HB2 1 62 LYS HE3 . . 5.500 3.307 2.088 4.589 . 0 0 "[ . 1 . 2]" 1
918 1 62 LYS HB3 1 62 LYS QD . . 3.520 2.478 2.213 3.222 . 0 0 "[ . 1 . 2]" 1
919 1 62 LYS HB3 1 62 LYS HE2 . . 5.500 4.263 2.419 5.366 . 0 0 "[ . 1 . 2]" 1
920 1 62 LYS HB3 1 62 LYS HE3 . . 5.500 3.940 2.550 4.724 . 0 0 "[ . 1 . 2]" 1
921 1 62 LYS QG 1 63 ARG H . . 4.480 4.239 3.804 4.482 0.002 17 0 "[ . 1 . 2]" 1
922 1 63 ARG H 1 63 ARG HB2 . . 3.740 2.502 2.177 3.584 . 0 0 "[ . 1 . 2]" 1
923 1 63 ARG H 1 63 ARG QB . . 3.020 2.230 2.155 2.434 . 0 0 "[ . 1 . 2]" 1
924 1 63 ARG H 1 63 ARG HB3 . . 3.740 2.921 2.253 3.586 . 0 0 "[ . 1 . 2]" 1
925 1 63 ARG H 1 63 ARG HG2 . . 4.630 4.073 2.201 4.646 0.016 8 0 "[ . 1 . 2]" 1
926 1 63 ARG H 1 63 ARG QG . . 4.060 3.442 2.180 4.060 . 0 0 "[ . 1 . 2]" 1
927 1 63 ARG H 1 63 ARG HG3 . . 4.630 3.903 2.918 4.619 . 0 0 "[ . 1 . 2]" 1
928 1 63 ARG H 1 64 LEU H . . 3.470 2.641 2.243 3.044 . 0 0 "[ . 1 . 2]" 1
929 1 63 ARG H 1 64 LEU QD . . 5.440 4.506 3.605 4.869 . 0 0 "[ . 1 . 2]" 1
930 1 63 ARG HA 1 63 ARG HD2 . . 5.500 4.191 2.096 5.477 . 0 0 "[ . 1 . 2]" 1
931 1 63 ARG HA 1 63 ARG HD3 . . 5.500 4.486 3.686 5.054 . 0 0 "[ . 1 . 2]" 1
932 1 63 ARG HA 1 63 ARG HG2 . . 4.000 2.980 2.264 3.855 . 0 0 "[ . 1 . 2]" 1
933 1 63 ARG HA 1 63 ARG QG . . 3.450 2.473 2.206 3.274 . 0 0 "[ . 1 . 2]" 1
934 1 63 ARG HA 1 63 ARG HG3 . . 4.000 2.780 2.313 3.759 . 0 0 "[ . 1 . 2]" 1
935 1 63 ARG HA 1 77 GLN HE21 . . 4.430 3.807 3.081 4.433 0.003 5 0 "[ . 1 . 2]" 1
936 1 63 ARG HA 1 77 GLN HE22 . . 4.430 2.984 2.302 3.626 . 0 0 "[ . 1 . 2]" 1
937 1 63 ARG QB 1 63 ARG QD . . 3.320 2.190 2.062 2.691 . 0 0 "[ . 1 . 2]" 1
938 1 63 ARG QB 1 64 LEU H . . 3.470 2.481 1.961 3.473 0.003 16 0 "[ . 1 . 2]" 1
939 1 63 ARG QG 1 64 LEU H . . 4.720 3.697 2.321 4.448 . 0 0 "[ . 1 . 2]" 1
940 1 63 ARG QG 1 77 GLN QE . . 4.780 3.669 2.745 4.610 . 0 0 "[ . 1 . 2]" 1
941 1 64 LEU H 1 64 LEU HB2 . . 3.950 2.407 2.179 2.626 . 0 0 "[ . 1 . 2]" 1
942 1 64 LEU H 1 64 LEU QB . . 3.320 2.370 2.158 2.565 . 0 0 "[ . 1 . 2]" 1
943 1 64 LEU H 1 64 LEU HB3 . . 3.950 3.570 3.492 3.621 . 0 0 "[ . 1 . 2]" 1
944 1 64 LEU H 1 64 LEU MD1 . . 4.120 3.324 2.096 3.860 . 0 0 "[ . 1 . 2]" 1
945 1 64 LEU H 1 64 LEU QD . . 3.570 2.865 1.849 3.327 . 0 0 "[ . 1 . 2]" 1
946 1 64 LEU H 1 64 LEU MD2 . . 4.120 3.386 1.864 4.014 . 0 0 "[ . 1 . 2]" 1
947 1 64 LEU H 1 64 LEU HG . . 4.030 2.778 1.988 4.038 0.008 5 0 "[ . 1 . 2]" 1
948 1 64 LEU H 1 65 PHE H . . 3.280 2.716 2.321 2.983 . 0 0 "[ . 1 . 2]" 1
949 1 64 LEU H 1 65 PHE QD . . 4.690 4.408 3.946 4.677 . 0 0 "[ . 1 . 2]" 1
950 1 64 LEU HA 1 64 LEU MD1 . . 4.380 3.445 1.912 3.948 . 0 0 "[ . 1 . 2]" 1
951 1 64 LEU HA 1 64 LEU QD . . 3.020 2.166 1.894 2.454 . 0 0 "[ . 1 . 2]" 1
952 1 64 LEU HA 1 64 LEU MD2 . . 4.380 2.505 1.988 3.856 . 0 0 "[ . 1 . 2]" 1
953 1 64 LEU HA 1 78 ARG H . . 4.850 3.029 2.460 3.659 . 0 0 "[ . 1 . 2]" 1
954 1 64 LEU HA 1 78 ARG QB . . 3.420 2.630 1.987 3.427 0.007 15 0 "[ . 1 . 2]" 1
955 1 64 LEU HA 1 78 ARG QD . . 4.680 3.864 3.280 4.669 . 0 0 "[ . 1 . 2]" 1
956 1 64 LEU HA 1 78 ARG QG . . 4.560 3.781 1.991 4.523 . 0 0 "[ . 1 . 2]" 1
957 1 64 LEU HA 1 80 LEU MD2 . . 4.620 3.897 3.477 4.621 0.001 20 0 "[ . 1 . 2]" 1
958 1 64 LEU QB 1 65 PHE H . . 3.640 2.485 2.303 2.735 . 0 0 "[ . 1 . 2]" 1
959 1 64 LEU QB 1 65 PHE HA . . 5.230 4.024 3.948 4.143 . 0 0 "[ . 1 . 2]" 1
960 1 64 LEU QB 1 65 PHE QD . . 4.100 2.654 2.284 3.063 . 0 0 "[ . 1 . 2]" 1
961 1 64 LEU QB 1 80 LEU MD2 . . 3.420 2.088 1.784 2.518 . 0 0 "[ . 1 . 2]" 1
962 1 64 LEU HB2 1 65 PHE H . . 4.360 2.558 2.331 2.810 . 0 0 "[ . 1 . 2]" 1
963 1 64 LEU HB2 1 65 PHE QD . . 4.710 2.764 2.367 3.235 . 0 0 "[ . 1 . 2]" 1
964 1 64 LEU HB2 1 80 LEU MD2 . . 3.950 3.296 3.012 3.577 . 0 0 "[ . 1 . 2]" 1
965 1 64 LEU HB3 1 65 PHE H . . 4.360 3.431 2.900 3.756 . 0 0 "[ . 1 . 2]" 1
966 1 64 LEU HB3 1 65 PHE QD . . 4.710 3.519 3.005 4.265 . 0 0 "[ . 1 . 2]" 1
967 1 64 LEU HB3 1 80 LEU MD2 . . 3.950 2.115 1.797 2.601 . 0 0 "[ . 1 . 2]" 1
968 1 64 LEU QD 1 65 PHE H . . 4.180 3.951 3.673 4.178 . 0 0 "[ . 1 . 2]" 1
969 1 64 LEU QD 1 65 PHE QD . . 4.790 3.710 3.406 4.187 . 0 0 "[ . 1 . 2]" 1
970 1 64 LEU QD 1 65 PHE QE . . 4.270 3.443 2.881 4.217 . 0 0 "[ . 1 . 2]" 1
971 1 64 LEU QD 1 78 ARG H . . 4.250 3.767 3.299 4.249 . 0 0 "[ . 1 . 2]" 1
972 1 64 LEU QD 1 78 ARG QB . . 3.400 2.530 1.717 3.421 0.021 15 0 "[ . 1 . 2]" 1
973 1 64 LEU QD 1 78 ARG QD . . 3.790 3.472 2.592 3.808 0.018 20 0 "[ . 1 . 2]" 1
974 1 64 LEU QD 1 78 ARG QG . . 4.490 3.960 1.699 4.491 0.001 9 0 "[ . 1 . 2]" 1
975 1 64 LEU QD 1 79 SER HA . . 5.370 4.594 4.010 5.196 . 0 0 "[ . 1 . 2]" 1
976 1 64 LEU QD 1 80 LEU HA . . 3.200 2.367 1.813 2.860 . 0 0 "[ . 1 . 2]" 1
977 1 64 LEU QD 1 80 LEU MD2 . . 3.260 2.305 1.817 2.868 . 0 0 "[ . 1 . 2]" 1
978 1 64 LEU QD 1 88 HIS HE1 . . 3.630 2.888 2.286 3.618 . 0 0 "[ . 1 . 2]" 1
979 1 64 LEU MD1 1 65 PHE H . . 5.140 4.352 4.034 4.757 . 0 0 "[ . 1 . 2]" 1
980 1 64 LEU MD1 1 80 LEU HA . . 3.860 2.985 1.898 3.861 0.001 5 0 "[ . 1 . 2]" 1
981 1 64 LEU MD1 1 81 ASP H . . 4.330 3.475 2.746 4.309 . 0 0 "[ . 1 . 2]" 1
982 1 64 LEU MD2 1 65 PHE H . . 5.140 4.575 3.921 4.827 . 0 0 "[ . 1 . 2]" 1
983 1 64 LEU MD2 1 80 LEU HA . . 3.860 2.746 1.816 3.861 0.001 14 0 "[ . 1 . 2]" 1
984 1 64 LEU MD2 1 81 ASP H . . 4.330 3.762 2.185 4.335 0.005 20 0 "[ . 1 . 2]" 1
985 1 64 LEU HG 1 65 PHE H . . 5.040 4.533 3.991 5.013 . 0 0 "[ . 1 . 2]" 1
986 1 65 PHE H 1 65 PHE HB2 . . 3.990 2.501 2.328 2.585 . 0 0 "[ . 1 . 2]" 1
987 1 65 PHE H 1 65 PHE QB . . 3.340 2.462 2.300 2.541 . 0 0 "[ . 1 . 2]" 1
988 1 65 PHE H 1 65 PHE HB3 . . 3.990 3.683 3.587 3.746 . 0 0 "[ . 1 . 2]" 1
989 1 65 PHE H 1 65 PHE QD . . 4.060 2.671 2.105 3.203 . 0 0 "[ . 1 . 2]" 1
990 1 65 PHE H 1 66 ALA H . . 4.730 4.442 4.358 4.564 . 0 0 "[ . 1 . 2]" 1
991 1 65 PHE H 1 77 GLN HB3 . . 4.750 4.513 3.685 4.755 0.005 20 0 "[ . 1 . 2]" 1
992 1 65 PHE H 1 80 LEU MD2 . . 5.500 4.502 3.997 4.806 . 0 0 "[ . 1 . 2]" 1
993 1 65 PHE HA 1 65 PHE QD . . 3.700 2.899 2.612 3.145 . 0 0 "[ . 1 . 2]" 1
994 1 65 PHE HA 1 66 ALA H . . 3.030 2.192 2.140 2.535 . 0 0 "[ . 1 . 2]" 1
995 1 65 PHE HA 1 66 ALA MB . . 4.250 3.919 3.788 3.995 . 0 0 "[ . 1 . 2]" 1
996 1 65 PHE HA 1 74 ILE MG . . 4.460 3.782 3.399 4.357 . 0 0 "[ . 1 . 2]" 1
997 1 65 PHE HA 1 76 VAL HA . . 3.810 2.967 2.450 3.543 . 0 0 "[ . 1 . 2]" 1
998 1 65 PHE HA 1 77 GLN H . . 3.770 2.581 1.985 3.253 . 0 0 "[ . 1 . 2]" 1
999 1 65 PHE HA 1 77 GLN HB2 . . 4.820 3.480 2.844 3.965 . 0 0 "[ . 1 . 2]" 1
1000 1 65 PHE HA 1 77 GLN HB3 . . 4.410 3.915 3.329 4.306 . 0 0 "[ . 1 . 2]" 1
1001 1 65 PHE QB 1 66 ALA H . . 3.640 3.056 2.133 3.312 . 0 0 "[ . 1 . 2]" 1
1002 1 65 PHE QB 1 74 ILE MD . . 4.680 3.996 3.193 4.675 . 0 0 "[ . 1 . 2]" 1
1003 1 65 PHE QB 1 74 ILE MG . . 3.230 2.262 1.911 2.556 . 0 0 "[ . 1 . 2]" 1
1004 1 65 PHE HB2 1 66 ALA H . . 4.310 4.140 3.553 4.323 0.013 20 0 "[ . 1 . 2]" 1
1005 1 65 PHE HB2 1 74 ILE MG . . 3.850 3.541 3.059 3.845 . 0 0 "[ . 1 . 2]" 1
1006 1 65 PHE HB3 1 66 ALA H . . 4.310 3.152 2.151 3.443 . 0 0 "[ . 1 . 2]" 1
1007 1 65 PHE HB3 1 74 ILE MG . . 3.850 2.289 1.931 2.595 . 0 0 "[ . 1 . 2]" 1
1008 1 65 PHE QD 1 66 ALA H . . 4.290 4.007 3.266 4.290 . 0 0 "[ . 1 . 2]" 1
1009 1 65 PHE QD 1 74 ILE MD . . 5.500 4.804 4.262 5.139 . 0 0 "[ . 1 . 2]" 1
1010 1 65 PHE QD 1 74 ILE MG . . 3.430 2.551 2.119 2.875 . 0 0 "[ . 1 . 2]" 1
1011 1 65 PHE QD 1 75 THR HA . . 5.460 4.510 4.117 4.959 . 0 0 "[ . 1 . 2]" 1
1012 1 65 PHE QD 1 76 VAL HA . . 3.810 3.312 2.661 3.693 . 0 0 "[ . 1 . 2]" 1
1013 1 65 PHE QD 1 76 VAL MG2 . . 5.430 3.417 3.078 4.073 . 0 0 "[ . 1 . 2]" 1
1014 1 65 PHE QD 1 77 GLN H . . 4.690 4.476 3.765 4.691 0.001 20 0 "[ . 1 . 2]" 1
1015 1 65 PHE QD 1 80 LEU MD2 . . 4.190 3.432 3.147 3.708 . 0 0 "[ . 1 . 2]" 1
1016 1 65 PHE QD 1 108 ILE MD . . 4.400 3.549 2.976 3.899 . 0 0 "[ . 1 . 2]" 1
1017 1 65 PHE QE 1 74 ILE MG . . 4.980 4.024 3.341 4.571 . 0 0 "[ . 1 . 2]" 1
1018 1 65 PHE QE 1 80 LEU MD1 . . 4.260 3.021 2.557 3.653 . 0 0 "[ . 1 . 2]" 1
1019 1 65 PHE QE 1 80 LEU MD2 . . 3.940 2.422 2.175 2.746 . 0 0 "[ . 1 . 2]" 1
1020 1 65 PHE QE 1 108 ILE MD . . 4.120 3.162 2.806 3.546 . 0 0 "[ . 1 . 2]" 1
1021 1 65 PHE QE 1 108 ILE MG . . 4.060 3.082 2.560 3.535 . 0 0 "[ . 1 . 2]" 1
1022 1 65 PHE QE 1 110 VAL MG2 . . 4.600 4.438 3.935 4.599 . 0 0 "[ . 1 . 2]" 1
1023 1 65 PHE HZ 1 80 LEU MD1 . . 4.450 2.453 1.922 3.174 . 0 0 "[ . 1 . 2]" 1
1024 1 65 PHE HZ 1 80 LEU MD2 . . 4.090 2.353 1.970 2.689 . 0 0 "[ . 1 . 2]" 1
1025 1 65 PHE HZ 1 108 ILE MD . . 4.770 3.496 2.757 3.953 . 0 0 "[ . 1 . 2]" 1
1026 1 65 PHE HZ 1 108 ILE MG . . 3.870 2.776 2.105 3.476 . 0 0 "[ . 1 . 2]" 1
1027 1 66 ALA H 1 66 ALA MB . . 3.290 2.327 2.177 2.542 . 0 0 "[ . 1 . 2]" 1
1028 1 66 ALA H 1 67 LEU H . . 4.620 4.397 4.041 4.568 . 0 0 "[ . 1 . 2]" 1
1029 1 66 ALA H 1 74 ILE HA . . 4.880 4.555 4.125 4.875 . 0 0 "[ . 1 . 2]" 1
1030 1 66 ALA H 1 74 ILE MG . . 4.140 3.417 3.073 3.894 . 0 0 "[ . 1 . 2]" 1
1031 1 66 ALA H 1 75 THR H . . 3.820 3.224 2.686 3.542 . 0 0 "[ . 1 . 2]" 1
1032 1 66 ALA H 1 76 VAL HA . . 4.370 3.879 3.498 4.361 . 0 0 "[ . 1 . 2]" 1
1033 1 66 ALA H 1 77 GLN H . . 4.200 3.305 2.621 3.967 . 0 0 "[ . 1 . 2]" 1
1034 1 66 ALA H 1 77 GLN HB2 . . 4.420 2.946 2.185 3.357 . 0 0 "[ . 1 . 2]" 1
1035 1 66 ALA H 1 77 GLN HB3 . . 4.900 4.248 3.671 4.728 . 0 0 "[ . 1 . 2]" 1
1036 1 66 ALA H 1 77 GLN HG3 . . 5.500 5.011 4.121 5.495 . 0 0 "[ . 1 . 2]" 1
1037 1 66 ALA MB 1 67 LEU H . . 3.480 3.108 2.611 3.374 . 0 0 "[ . 1 . 2]" 1
1038 1 66 ALA MB 1 74 ILE HA . . 5.330 4.561 4.207 4.982 . 0 0 "[ . 1 . 2]" 1
1039 1 66 ALA MB 1 74 ILE MG . . 5.100 4.447 4.066 4.894 . 0 0 "[ . 1 . 2]" 1
1040 1 66 ALA MB 1 75 THR H . . 4.040 3.479 3.153 3.879 . 0 0 "[ . 1 . 2]" 1
1041 1 66 ALA MB 1 75 THR HB . . 5.120 4.714 4.098 5.103 . 0 0 "[ . 1 . 2]" 1
1042 1 66 ALA MB 1 75 THR HG1 . . 4.730 3.019 2.119 3.878 . 0 0 "[ . 1 . 2]" 1
1043 1 66 ALA MB 1 77 GLN HB2 . . 3.460 2.182 1.937 2.500 . 0 0 "[ . 1 . 2]" 1
1044 1 66 ALA MB 1 77 GLN HB3 . . 3.840 3.622 3.363 3.843 0.003 6 0 "[ . 1 . 2]" 1
1045 1 66 ALA MB 1 77 GLN HE21 . . 4.550 3.186 1.876 4.543 . 0 0 "[ . 1 . 2]" 1
1046 1 66 ALA MB 1 77 GLN QE . . 3.970 2.874 1.868 3.962 . 0 0 "[ . 1 . 2]" 1
1047 1 66 ALA MB 1 77 GLN HE22 . . 4.550 3.761 2.854 4.412 . 0 0 "[ . 1 . 2]" 1
1048 1 66 ALA MB 1 77 GLN HG3 . . 3.300 2.851 1.974 3.302 0.002 20 0 "[ . 1 . 2]" 1
1049 1 67 LEU H 1 67 LEU HB2 . . 3.740 3.111 2.897 3.295 . 0 0 "[ . 1 . 2]" 1
1050 1 67 LEU H 1 67 LEU QB . . 3.190 2.318 2.196 2.583 . 0 0 "[ . 1 . 2]" 1
1051 1 67 LEU H 1 67 LEU HB3 . . 3.740 2.394 2.252 2.699 . 0 0 "[ . 1 . 2]" 1
1052 1 67 LEU H 1 67 LEU MD1 . . 4.660 4.377 4.228 4.478 . 0 0 "[ . 1 . 2]" 1
1053 1 67 LEU H 1 67 LEU MD2 . . 4.580 4.244 4.076 4.495 . 0 0 "[ . 1 . 2]" 1
1054 1 67 LEU H 1 67 LEU HG . . 4.430 4.243 4.103 4.409 . 0 0 "[ . 1 . 2]" 1
1055 1 67 LEU QB 1 67 LEU MD2 . . 2.970 2.053 1.970 2.099 . 0 0 "[ . 1 . 2]" 1
1056 1 67 LEU QB 1 74 ILE MD . . 4.800 3.408 2.434 4.130 . 0 0 "[ . 1 . 2]" 1
1057 1 67 LEU HB2 1 67 LEU MD1 . . 3.510 2.261 2.105 2.426 . 0 0 "[ . 1 . 2]" 1
1058 1 67 LEU HB2 1 67 LEU MD2 . . 3.480 2.464 2.316 2.616 . 0 0 "[ . 1 . 2]" 1
1059 1 67 LEU HB3 1 67 LEU MD1 . . 3.510 3.173 3.153 3.195 . 0 0 "[ . 1 . 2]" 1
1060 1 67 LEU HB3 1 67 LEU MD2 . . 3.480 2.216 2.044 2.364 . 0 0 "[ . 1 . 2]" 1
1061 1 67 LEU MD1 1 68 ASN H . . 3.600 2.558 1.944 3.563 . 0 0 "[ . 1 . 2]" 1
1062 1 67 LEU MD1 1 72 GLY H . . 4.660 4.135 3.754 4.556 . 0 0 "[ . 1 . 2]" 1
1063 1 67 LEU MD1 1 72 GLY HA2 . . 3.990 2.541 2.102 2.917 . 0 0 "[ . 1 . 2]" 1
1064 1 67 LEU MD1 1 72 GLY HA3 . . 4.190 3.832 3.363 4.174 . 0 0 "[ . 1 . 2]" 1
1065 1 67 LEU MD1 1 74 ILE HA . . 4.310 3.481 2.964 3.882 . 0 0 "[ . 1 . 2]" 1
1066 1 67 LEU MD1 1 74 ILE MD . . 3.550 2.729 1.865 3.150 . 0 0 "[ . 1 . 2]" 1
1067 1 67 LEU MD1 1 74 ILE HG12 . . 3.930 2.386 1.925 3.012 . 0 0 "[ . 1 . 2]" 1
1068 1 67 LEU MD1 1 74 ILE QG . . 3.260 2.135 1.804 2.796 . 0 0 "[ . 1 . 2]" 1
1069 1 67 LEU MD1 1 74 ILE HG13 . . 3.930 2.462 2.024 3.846 . 0 0 "[ . 1 . 2]" 1
1070 1 67 LEU MD1 1 74 ILE MG . . 4.570 3.990 3.488 4.495 . 0 0 "[ . 1 . 2]" 1
1071 1 67 LEU MD1 1 92 VAL MG1 . . 3.690 2.617 1.985 3.055 . 0 0 "[ . 1 . 2]" 1
1072 1 67 LEU MD1 1 92 VAL MG2 . . 3.600 2.335 1.955 2.745 . 0 0 "[ . 1 . 2]" 1
1073 1 67 LEU MD2 1 74 ILE MD . . 4.420 3.784 3.131 4.377 . 0 0 "[ . 1 . 2]" 1
1074 1 67 LEU MD2 1 92 VAL MG1 . . 3.400 2.640 1.984 3.384 . 0 0 "[ . 1 . 2]" 1
1075 1 67 LEU MD2 1 92 VAL MG2 . . 3.390 2.556 2.232 2.873 . 0 0 "[ . 1 . 2]" 1
1076 1 67 LEU HG 1 68 ASN H . . 4.100 3.209 2.674 4.010 . 0 0 "[ . 1 . 2]" 1
1077 1 68 ASN H 1 68 ASN HB2 . . 3.630 2.269 2.181 2.365 . 0 0 "[ . 1 . 2]" 1
1078 1 68 ASN H 1 68 ASN HB3 . . 3.620 3.536 3.491 3.611 . 0 0 "[ . 1 . 2]" 1
1079 1 68 ASN H 1 73 LEU H . . 4.380 3.172 2.363 3.830 . 0 0 "[ . 1 . 2]" 1
1080 1 68 ASN H 1 74 ILE HA . . 4.310 3.735 3.256 4.169 . 0 0 "[ . 1 . 2]" 1
1081 1 68 ASN HA 1 69 ASN H . . 3.340 2.172 2.140 2.270 . 0 0 "[ . 1 . 2]" 1
1082 1 68 ASN HA 1 70 THR H . . 4.460 3.565 3.398 3.776 . 0 0 "[ . 1 . 2]" 1
1083 1 68 ASN HB2 1 71 THR H . . 4.210 3.332 3.121 3.647 . 0 0 "[ . 1 . 2]" 1
1084 1 68 ASN HB2 1 71 THR HG1 . . 4.440 2.639 2.058 3.667 . 0 0 "[ . 1 . 2]" 1
1085 1 68 ASN HB2 1 72 GLY H . . 4.680 3.053 2.546 3.804 . 0 0 "[ . 1 . 2]" 1
1086 1 68 ASN HB2 1 73 LEU H . . 3.630 2.180 1.907 2.597 . 0 0 "[ . 1 . 2]" 1
1087 1 68 ASN HB2 1 73 LEU HB2 . . 5.200 4.653 4.134 5.125 . 0 0 "[ . 1 . 2]" 1
1088 1 68 ASN HB2 1 73 LEU HB3 . . 4.440 3.218 2.651 3.673 . 0 0 "[ . 1 . 2]" 1
1089 1 68 ASN HB2 1 73 LEU HG . . 5.500 4.932 4.102 5.446 . 0 0 "[ . 1 . 2]" 1
1090 1 68 ASN HB3 1 70 THR MG . . 4.810 4.521 4.223 4.811 0.001 5 0 "[ . 1 . 2]" 1
1091 1 68 ASN HB3 1 71 THR H . . 4.730 2.210 2.009 2.603 . 0 0 "[ . 1 . 2]" 1
1092 1 68 ASN HB3 1 71 THR HG1 . . 4.760 2.803 2.034 3.780 . 0 0 "[ . 1 . 2]" 1
1093 1 68 ASN HB3 1 73 LEU H . . 3.990 3.405 3.122 3.773 . 0 0 "[ . 1 . 2]" 1
1094 1 68 ASN HB3 1 73 LEU HB3 . . 5.060 4.486 3.914 5.023 . 0 0 "[ . 1 . 2]" 1
1095 1 68 ASN QD 1 71 THR MG . . 3.920 2.931 2.298 3.500 . 0 0 "[ . 1 . 2]" 1
1096 1 68 ASN QD 1 73 LEU H . . 4.550 4.066 3.268 4.441 . 0 0 "[ . 1 . 2]" 1
1097 1 68 ASN HD21 1 71 THR HG1 . . 4.700 2.481 1.933 3.063 . 0 0 "[ . 1 . 2]" 1
1098 1 68 ASN HD21 1 71 THR MG . . 4.660 2.995 2.322 3.652 . 0 0 "[ . 1 . 2]" 1
1099 1 68 ASN HD22 1 71 THR HG1 . . 4.700 3.992 3.324 4.687 . 0 0 "[ . 1 . 2]" 1
1100 1 68 ASN HD22 1 71 THR MG . . 4.660 4.209 3.670 4.639 . 0 0 "[ . 1 . 2]" 1
1101 1 69 ASN H 1 69 ASN HB2 . . 3.970 2.696 2.425 2.867 . 0 0 "[ . 1 . 2]" 1
1102 1 69 ASN H 1 69 ASN HB3 . . 3.970 3.650 3.593 3.711 . 0 0 "[ . 1 . 2]" 1
1103 1 69 ASN H 1 70 THR H . . 4.060 2.489 2.172 2.803 . 0 0 "[ . 1 . 2]" 1
1104 1 69 ASN HA 1 69 ASN HD21 . . 4.500 3.318 2.039 3.915 . 0 0 "[ . 1 . 2]" 1
1105 1 69 ASN HA 1 69 ASN QD . . 3.680 3.186 2.027 3.679 . 0 0 "[ . 1 . 2]" 1
1106 1 69 ASN HA 1 69 ASN HD22 . . 4.500 4.224 3.533 4.500 . 1 0 "[ . 1 . 2]" 1
1107 1 69 ASN QB 1 70 THR H . . 4.140 3.516 3.172 3.777 . 0 0 "[ . 1 . 2]" 1
1108 1 69 ASN QB 1 70 THR MG . . 5.340 3.565 3.097 5.294 . 0 0 "[ . 1 . 2]" 1
1109 1 69 ASN HB2 1 70 THR H . . 4.750 3.689 3.264 4.031 . 0 0 "[ . 1 . 2]" 1
1110 1 69 ASN HB3 1 70 THR H . . 4.750 4.441 4.221 4.560 . 0 0 "[ . 1 . 2]" 1
1111 1 70 THR H 1 70 THR HB . . 3.770 3.561 2.505 3.776 0.006 13 0 "[ . 1 . 2]" 1
1112 1 70 THR H 1 70 THR MG . . 3.980 3.059 2.684 3.890 . 0 0 "[ . 1 . 2]" 1
1113 1 70 THR H 1 71 THR H . . 3.200 1.948 1.820 2.263 . 0 0 "[ . 1 . 2]" 1
1114 1 70 THR H 1 71 THR MG . . 4.450 4.130 3.770 4.408 . 0 0 "[ . 1 . 2]" 1
1115 1 70 THR HB 1 71 THR H . . 3.970 3.733 2.915 3.970 . 0 0 "[ . 1 . 2]" 1
1116 1 70 THR HB 1 71 THR MG . . 3.900 3.238 2.776 3.692 . 0 0 "[ . 1 . 2]" 1
1117 1 70 THR MG 1 71 THR H . . 4.650 4.008 3.711 4.251 . 0 0 "[ . 1 . 2]" 1
1118 1 71 THR H 1 71 THR HG1 . . 4.390 3.036 2.125 3.780 . 0 0 "[ . 1 . 2]" 1
1119 1 71 THR H 1 71 THR MG . . 3.400 2.930 2.650 3.136 . 0 0 "[ . 1 . 2]" 1
1120 1 71 THR H 1 73 LEU H . . 4.660 3.743 3.438 4.080 . 0 0 "[ . 1 . 2]" 1
1121 1 71 THR HA 1 71 THR MG . . 3.220 2.327 2.145 2.442 . 0 0 "[ . 1 . 2]" 1
1122 1 71 THR HB 1 73 LEU H . . 4.400 3.869 3.234 4.305 . 0 0 "[ . 1 . 2]" 1
1123 1 71 THR HG1 1 71 THR MG . . 3.160 2.549 2.029 3.041 . 0 0 "[ . 1 . 2]" 1
1124 1 71 THR HG1 1 73 LEU H . . 3.970 2.703 1.922 3.912 . 0 0 "[ . 1 . 2]" 1
1125 1 71 THR HG1 1 73 LEU HB2 . . 4.630 3.713 2.933 4.330 . 0 0 "[ . 1 . 2]" 1
1126 1 71 THR HG1 1 73 LEU HB3 . . 4.460 2.663 2.050 3.205 . 0 0 "[ . 1 . 2]" 1
1127 1 72 GLY H 1 73 LEU H . . 3.590 2.618 2.301 3.016 . 0 0 "[ . 1 . 2]" 1
1128 1 72 GLY H 1 73 LEU HB3 . . 5.260 4.653 4.367 4.915 . 0 0 "[ . 1 . 2]" 1
1129 1 73 LEU H 1 73 LEU HB2 . . 3.400 3.111 2.624 3.268 . 0 0 "[ . 1 . 2]" 1
1130 1 73 LEU H 1 73 LEU HB3 . . 3.430 2.408 2.221 2.545 . 0 0 "[ . 1 . 2]" 1
1131 1 73 LEU H 1 73 LEU MD1 . . 5.130 4.330 3.408 4.512 . 0 0 "[ . 1 . 2]" 1
1132 1 73 LEU H 1 73 LEU QD . . 4.370 3.797 3.273 3.919 . 0 0 "[ . 1 . 2]" 1
1133 1 73 LEU H 1 73 LEU MD2 . . 5.130 4.226 3.881 4.415 . 0 0 "[ . 1 . 2]" 1
1134 1 73 LEU HA 1 73 LEU QD . . 3.230 2.329 2.054 3.128 . 0 0 "[ . 1 . 2]" 1
1135 1 73 LEU HA 1 74 ILE H . . 3.220 2.185 2.139 2.268 . 0 0 "[ . 1 . 2]" 1
1136 1 73 LEU HA 1 74 ILE HB . . 5.500 4.560 4.428 4.681 . 0 0 "[ . 1 . 2]" 1
1137 1 73 LEU HB2 1 73 LEU QD . . 3.130 2.103 1.963 2.349 . 0 0 "[ . 1 . 2]" 1
1138 1 73 LEU HB2 1 74 ILE H . . 5.110 4.013 3.798 4.240 . 0 0 "[ . 1 . 2]" 1
1139 1 73 LEU HB3 1 75 THR MG . . 4.430 4.138 3.907 4.457 0.027 15 0 "[ . 1 . 2]" 1
1140 1 73 LEU QD 1 74 ILE H . . 3.550 2.457 1.700 3.127 . 0 0 "[ . 1 . 2]" 1
1141 1 73 LEU QD 1 75 THR HB . . 4.960 4.426 3.688 4.895 . 0 0 "[ . 1 . 2]" 1
1142 1 73 LEU HG 1 74 ILE H . . 5.300 3.044 2.151 4.084 . 0 0 "[ . 1 . 2]" 1
1143 1 73 LEU HG 1 74 ILE HA . . 5.500 4.027 3.694 5.511 0.011 15 0 "[ . 1 . 2]" 1
1144 1 73 LEU HG 1 75 THR HA . . 5.500 4.628 4.324 5.398 . 0 0 "[ . 1 . 2]" 1
1145 1 73 LEU HG 1 75 THR MG . . 3.850 2.404 2.021 3.778 . 0 0 "[ . 1 . 2]" 1
1146 1 74 ILE H 1 74 ILE HB . . 3.360 2.506 2.378 2.629 . 0 0 "[ . 1 . 2]" 1
1147 1 74 ILE H 1 74 ILE MD . . 4.350 3.758 3.522 4.021 . 0 0 "[ . 1 . 2]" 1
1148 1 74 ILE H 1 74 ILE HG12 . . 4.300 3.861 2.395 4.219 . 0 0 "[ . 1 . 2]" 1
1149 1 74 ILE H 1 74 ILE QG . . 3.630 2.625 2.361 2.982 . 0 0 "[ . 1 . 2]" 1
1150 1 74 ILE H 1 74 ILE HG13 . . 4.300 2.728 2.405 3.587 . 0 0 "[ . 1 . 2]" 1
1151 1 74 ILE H 1 74 ILE MG . . 4.630 3.782 3.724 3.843 . 0 0 "[ . 1 . 2]" 1
1152 1 74 ILE H 1 75 THR MG . . 4.780 4.129 3.843 4.411 . 0 0 "[ . 1 . 2]" 1
1153 1 74 ILE HA 1 74 ILE MD . . 4.050 3.759 2.164 3.888 . 0 0 "[ . 1 . 2]" 1
1154 1 74 ILE HA 1 74 ILE MG . . 3.440 2.406 2.272 2.492 . 0 0 "[ . 1 . 2]" 1
1155 1 74 ILE HA 1 75 THR H . . 3.010 2.148 2.139 2.183 . 0 0 "[ . 1 . 2]" 1
1156 1 74 ILE HA 1 75 THR MG . . 4.740 3.955 3.724 4.298 . 0 0 "[ . 1 . 2]" 1
1157 1 74 ILE HB 1 74 ILE MD . . 3.360 2.398 2.251 3.206 . 0 0 "[ . 1 . 2]" 1
1158 1 74 ILE HB 1 75 THR H . . 4.690 4.253 4.079 4.401 . 0 0 "[ . 1 . 2]" 1
1159 1 74 ILE HB 1 108 ILE MD . . 4.920 4.577 4.090 4.905 . 0 0 "[ . 1 . 2]" 1
1160 1 74 ILE MD 1 75 THR H . . 5.340 5.097 3.430 5.344 0.004 15 0 "[ . 1 . 2]" 1
1161 1 74 ILE MD 1 90 VAL H . . 5.500 5.282 4.956 5.496 . 0 0 "[ . 1 . 2]" 1
1162 1 74 ILE MD 1 92 VAL MG1 . . 5.500 4.220 3.747 4.561 . 0 0 "[ . 1 . 2]" 1
1163 1 74 ILE MD 1 108 ILE MD . . 3.950 3.500 3.180 3.806 . 0 0 "[ . 1 . 2]" 1
1164 1 74 ILE QG 1 74 ILE MG . . 3.270 2.254 2.126 2.386 . 0 0 "[ . 1 . 2]" 1
1165 1 74 ILE QG 1 75 THR H . . 5.030 4.115 3.853 4.489 . 0 0 "[ . 1 . 2]" 1
1166 1 74 ILE MG 1 75 THR H . . 3.550 2.585 2.231 2.961 . 0 0 "[ . 1 . 2]" 1
1167 1 74 ILE MG 1 75 THR HA . . 4.270 3.522 3.360 3.781 . 0 0 "[ . 1 . 2]" 1
1168 1 74 ILE MG 1 108 ILE MD . . 3.390 3.151 2.686 3.335 . 0 0 "[ . 1 . 2]" 1
1169 1 74 ILE MG 1 108 ILE QG . . 5.340 4.624 4.240 4.928 . 0 0 "[ . 1 . 2]" 1
1170 1 75 THR H 1 75 THR HG1 . . 4.890 3.047 2.056 3.750 . 0 0 "[ . 1 . 2]" 1
1171 1 75 THR H 1 75 THR MG . . 4.230 3.094 2.920 3.264 . 0 0 "[ . 1 . 2]" 1
1172 1 75 THR HA 1 75 THR MG . . 3.270 2.293 2.079 2.393 . 0 0 "[ . 1 . 2]" 1
1173 1 75 THR HA 1 76 VAL H . . 3.230 2.402 2.237 2.602 . 0 0 "[ . 1 . 2]" 1
1174 1 75 THR HA 1 76 VAL HA . . 4.760 4.325 4.304 4.373 . 0 0 "[ . 1 . 2]" 1
1175 1 75 THR HB 1 76 VAL H . . 3.480 2.404 1.971 2.864 . 0 0 "[ . 1 . 2]" 1
1176 1 75 THR HB 1 76 VAL HB . . 4.590 4.374 4.221 4.557 . 0 0 "[ . 1 . 2]" 1
1177 1 75 THR HB 1 76 VAL MG2 . . 5.300 4.396 4.059 4.740 . 0 0 "[ . 1 . 2]" 1
1178 1 75 THR MG 1 76 VAL H . . 3.820 3.533 3.218 3.772 . 0 0 "[ . 1 . 2]" 1
1179 1 75 THR MG 1 76 VAL HB . . 5.500 5.385 5.117 5.497 . 0 0 "[ . 1 . 2]" 1
1180 1 76 VAL H 1 76 VAL HB . . 3.380 2.491 2.381 2.585 . 0 0 "[ . 1 . 2]" 1
1181 1 76 VAL H 1 76 VAL MG1 . . 4.550 3.765 3.731 3.803 . 0 0 "[ . 1 . 2]" 1
1182 1 76 VAL H 1 76 VAL MG2 . . 4.000 2.336 2.031 2.745 . 0 0 "[ . 1 . 2]" 1
1183 1 76 VAL HA 1 76 VAL MG1 . . 3.340 2.388 2.255 2.472 . 0 0 "[ . 1 . 2]" 1
1184 1 76 VAL HA 1 76 VAL MG2 . . 3.340 2.353 2.160 2.442 . 0 0 "[ . 1 . 2]" 1
1185 1 76 VAL HA 1 77 GLN H . . 3.200 2.160 2.141 2.195 . 0 0 "[ . 1 . 2]" 1
1186 1 76 VAL HA 1 77 GLN HA . . 4.610 4.409 4.380 4.457 . 0 0 "[ . 1 . 2]" 1
1187 1 76 VAL HA 1 78 ARG H . . 4.040 3.823 3.627 4.038 . 0 0 "[ . 1 . 2]" 1
1188 1 76 VAL MG1 1 77 GLN H . . 4.430 2.830 2.092 3.173 . 0 0 "[ . 1 . 2]" 1
1189 1 76 VAL MG2 1 77 GLN H . . 4.240 4.086 3.895 4.231 . 0 0 "[ . 1 . 2]" 1
1190 1 76 VAL MG2 1 80 LEU HG . . 4.100 3.753 3.062 4.013 . 0 0 "[ . 1 . 2]" 1
1191 1 77 GLN H 1 77 GLN HB2 . . 4.090 2.543 2.282 2.788 . 0 0 "[ . 1 . 2]" 1
1192 1 77 GLN H 1 77 GLN HB3 . . 3.840 2.678 2.482 2.808 . 0 0 "[ . 1 . 2]" 1
1193 1 77 GLN H 1 77 GLN HG2 . . 4.770 4.516 4.402 4.656 . 0 0 "[ . 1 . 2]" 1
1194 1 77 GLN H 1 77 GLN HG3 . . 4.680 4.471 4.276 4.670 . 0 0 "[ . 1 . 2]" 1
1195 1 77 GLN H 1 78 ARG H . . 3.060 2.358 1.966 2.694 . 0 0 "[ . 1 . 2]" 1
1196 1 77 GLN HB2 1 77 GLN QE . . 4.210 2.975 2.197 4.118 . 0 0 "[ . 1 . 2]" 1
1197 1 77 GLN HB2 1 77 GLN HE22 . . 4.880 4.072 3.683 4.786 . 0 0 "[ . 1 . 2]" 1
1198 1 77 GLN HB2 1 78 ARG H . . 4.520 3.755 3.533 3.971 . 0 0 "[ . 1 . 2]" 1
1199 1 77 GLN HB3 1 77 GLN QE . . 4.180 2.916 1.920 4.039 . 0 0 "[ . 1 . 2]" 1
1200 1 77 GLN HB3 1 78 ARG H . . 4.010 2.633 2.313 2.995 . 0 0 "[ . 1 . 2]" 1
1201 1 77 GLN HB3 1 78 ARG QD . . 5.340 4.231 3.491 4.847 . 0 0 "[ . 1 . 2]" 1
1202 1 77 GLN HB3 1 78 ARG QG . . 4.420 3.052 2.355 3.663 . 0 0 "[ . 1 . 2]" 1
1203 1 77 GLN HG2 1 78 ARG QD . . 5.340 3.938 3.252 4.742 . 0 0 "[ . 1 . 2]" 1
1204 1 77 GLN HG2 1 78 ARG QG . . 4.560 2.717 2.140 4.362 . 0 0 "[ . 1 . 2]" 1
1205 1 78 ARG H 1 78 ARG QB . . 3.540 2.770 2.572 3.016 . 0 0 "[ . 1 . 2]" 1
1206 1 78 ARG H 1 79 SER H . . 4.570 4.401 4.359 4.444 . 0 0 "[ . 1 . 2]" 1
1207 1 78 ARG HA 1 78 ARG QD . . 4.620 4.040 2.458 4.336 . 0 0 "[ . 1 . 2]" 1
1208 1 78 ARG HA 1 78 ARG HG2 . . 4.170 2.647 2.340 3.804 . 0 0 "[ . 1 . 2]" 1
1209 1 78 ARG HA 1 78 ARG HG3 . . 4.170 3.085 2.556 3.734 . 0 0 "[ . 1 . 2]" 1
1210 1 78 ARG HA 1 79 SER H . . 2.970 2.398 2.295 2.514 . 0 0 "[ . 1 . 2]" 1
1211 1 78 ARG HA 1 79 SER QB . . 4.650 4.360 4.238 4.540 . 0 0 "[ . 1 . 2]" 1
1212 1 78 ARG QB 1 78 ARG QD . . 3.070 2.186 2.084 2.382 . 0 0 "[ . 1 . 2]" 1
1213 1 78 ARG QB 1 79 SER H . . 3.350 2.444 2.192 2.651 . 0 0 "[ . 1 . 2]" 1
1214 1 78 ARG HB2 1 79 SER H . . 3.920 3.602 2.559 3.884 . 0 0 "[ . 1 . 2]" 1
1215 1 78 ARG HB3 1 79 SER H . . 3.920 2.551 2.222 3.911 . 0 0 "[ . 1 . 2]" 1
1216 1 79 SER H 1 79 SER HB2 . . 3.570 2.573 2.197 3.568 . 0 0 "[ . 1 . 2]" 1
1217 1 79 SER H 1 79 SER QB . . 3.060 2.233 2.143 2.324 . 0 0 "[ . 1 . 2]" 1
1218 1 79 SER H 1 79 SER HB3 . . 3.570 2.870 2.241 3.578 0.008 7 0 "[ . 1 . 2]" 1
1219 1 79 SER H 1 80 LEU H . . 4.820 4.618 4.489 4.647 . 0 0 "[ . 1 . 2]" 1
1220 1 79 SER HA 1 80 LEU H . . 3.030 2.256 2.139 2.397 . 0 0 "[ . 1 . 2]" 1
1221 1 79 SER HA 1 80 LEU HB2 . . 4.830 4.786 4.693 4.832 0.002 14 0 "[ . 1 . 2]" 1
1222 1 79 SER HA 1 80 LEU MD1 . . 4.780 4.574 4.320 4.773 . 0 0 "[ . 1 . 2]" 1
1223 1 79 SER HA 1 80 LEU MD2 . . 5.500 4.438 4.219 4.834 . 0 0 "[ . 1 . 2]" 1
1224 1 79 SER HA 1 80 LEU HG . . 4.100 3.403 3.174 3.671 . 0 0 "[ . 1 . 2]" 1
1225 1 79 SER QB 1 80 LEU H . . 3.850 3.211 2.641 3.674 . 0 0 "[ . 1 . 2]" 1
1226 1 79 SER HB2 1 80 LEU H . . 4.480 3.877 2.791 4.461 . 0 0 "[ . 1 . 2]" 1
1227 1 79 SER HB3 1 80 LEU H . . 4.480 3.640 2.680 4.250 . 0 0 "[ . 1 . 2]" 1
1228 1 80 LEU H 1 80 LEU HB2 . . 3.800 2.673 2.556 2.816 . 0 0 "[ . 1 . 2]" 1
1229 1 80 LEU H 1 80 LEU MD1 . . 3.610 3.477 3.244 3.610 0.000 6 0 "[ . 1 . 2]" 1
1230 1 80 LEU H 1 80 LEU MD2 . . 3.940 3.699 3.373 3.883 . 0 0 "[ . 1 . 2]" 1
1231 1 80 LEU H 1 80 LEU HG . . 3.220 2.402 2.105 2.665 . 0 0 "[ . 1 . 2]" 1
1232 1 80 LEU HA 1 80 LEU MD1 . . 4.230 3.981 3.960 4.001 . 0 0 "[ . 1 . 2]" 1
1233 1 80 LEU HA 1 80 LEU MD2 . . 3.180 2.456 2.256 2.607 . 0 0 "[ . 1 . 2]" 1
1234 1 80 LEU HA 1 80 LEU HG . . 4.260 3.078 2.940 3.190 . 0 0 "[ . 1 . 2]" 1
1235 1 80 LEU HA 1 81 ASP H . . 3.540 2.318 2.160 2.457 . 0 0 "[ . 1 . 2]" 1
1236 1 80 LEU HB2 1 80 LEU MD1 . . 3.390 2.115 1.991 2.261 . 0 0 "[ . 1 . 2]" 1
1237 1 80 LEU HB2 1 110 VAL MG1 . . 4.080 3.517 2.845 4.067 . 0 0 "[ . 1 . 2]" 1
1238 1 80 LEU HB3 1 80 LEU MD1 . . 3.400 2.576 2.442 2.676 . 0 0 "[ . 1 . 2]" 1
1239 1 80 LEU HB3 1 80 LEU MD2 . . 3.540 2.167 2.072 2.300 . 0 0 "[ . 1 . 2]" 1
1240 1 80 LEU HB3 1 81 ASP H . . 4.180 2.691 2.402 3.235 . 0 0 "[ . 1 . 2]" 1
1241 1 80 LEU MD1 1 88 HIS HD2 . . 4.840 4.164 3.349 4.792 . 0 0 "[ . 1 . 2]" 1
1242 1 80 LEU MD1 1 110 VAL MG2 . . 3.720 3.054 2.577 3.512 . 0 0 "[ . 1 . 2]" 1
1243 1 80 LEU MD2 1 81 ASP H . . 4.320 3.762 3.601 3.947 . 0 0 "[ . 1 . 2]" 1
1244 1 81 ASP QB 1 82 ARG H . . 3.990 3.220 2.518 3.669 . 0 0 "[ . 1 . 2]" 1
1245 1 81 ASP QB 1 83 GLU H . . 4.680 3.481 2.976 4.288 . 0 0 "[ . 1 . 2]" 1
1246 1 81 ASP QB 1 83 GLU QB . . 5.160 3.931 3.114 5.028 . 0 0 "[ . 1 . 2]" 1
1247 1 81 ASP QB 1 83 GLU QG . . 5.340 3.419 1.982 5.033 . 0 0 "[ . 1 . 2]" 1
1248 1 81 ASP QB 1 84 GLU HB2 . . 4.580 3.183 2.624 3.914 . 0 0 "[ . 1 . 2]" 1
1249 1 81 ASP QB 1 84 GLU QB . . 4.020 2.851 2.352 3.293 . 0 0 "[ . 1 . 2]" 1
1250 1 81 ASP QB 1 84 GLU HB3 . . 4.580 3.404 2.612 4.573 . 0 0 "[ . 1 . 2]" 1
1251 1 81 ASP QB 1 84 GLU QG . . 5.340 4.060 2.067 4.888 . 0 0 "[ . 1 . 2]" 1
1252 1 82 ARG H 1 82 ARG QB . . 3.670 2.267 2.184 2.472 . 0 0 "[ . 1 . 2]" 1
1253 1 82 ARG H 1 82 ARG HG2 . . 4.620 4.293 3.701 4.605 . 0 0 "[ . 1 . 2]" 1
1254 1 82 ARG H 1 82 ARG HG3 . . 4.620 4.164 3.010 4.622 0.002 2 0 "[ . 1 . 2]" 1
1255 1 82 ARG H 1 83 GLU H . . 3.840 2.359 2.003 2.613 . 0 0 "[ . 1 . 2]" 1
1256 1 82 ARG HA 1 82 ARG QG . . 3.710 2.252 2.130 2.379 . 0 0 "[ . 1 . 2]" 1
1257 1 82 ARG HA 1 83 GLU HA . . 4.960 4.901 4.733 4.957 . 0 0 "[ . 1 . 2]" 1
1258 1 82 ARG HA 1 85 THR H . . 4.440 3.461 3.100 3.998 . 0 0 "[ . 1 . 2]" 1
1259 1 82 ARG HA 1 86 ALA HA . . 4.420 2.998 2.446 3.435 . 0 0 "[ . 1 . 2]" 1
1260 1 82 ARG HA 1 86 ALA MB . . 4.770 4.063 3.641 4.676 . 0 0 "[ . 1 . 2]" 1
1261 1 82 ARG QB 1 82 ARG HE . . 4.980 2.840 1.891 4.366 . 0 0 "[ . 1 . 2]" 1
1262 1 82 ARG QB 1 110 VAL HB . . 4.750 4.148 3.640 4.730 . 0 0 "[ . 1 . 2]" 1
1263 1 82 ARG HB2 1 110 VAL MG1 . . 4.610 2.747 1.970 4.260 . 0 0 "[ . 1 . 2]" 1
1264 1 82 ARG HB3 1 110 VAL MG1 . . 4.610 3.846 3.453 4.604 . 0 0 "[ . 1 . 2]" 1
1265 1 82 ARG QD 1 86 ALA HA . . 3.770 3.417 2.566 3.756 . 0 0 "[ . 1 . 2]" 1
1266 1 82 ARG QD 1 86 ALA MB . . 3.720 2.827 2.196 3.390 . 0 0 "[ . 1 . 2]" 1
1267 1 82 ARG QD 1 110 VAL HB . . 4.100 3.374 2.308 4.037 . 0 0 "[ . 1 . 2]" 1
1268 1 82 ARG QD 1 110 VAL MG1 . . 3.900 2.885 1.858 3.876 . 0 0 "[ . 1 . 2]" 1
1269 1 82 ARG QD 1 110 VAL MG2 . . 5.340 4.430 3.757 4.984 . 0 0 "[ . 1 . 2]" 1
1270 1 82 ARG HD2 1 86 ALA MB . . 4.300 3.272 2.594 4.232 . 0 0 "[ . 1 . 2]" 1
1271 1 82 ARG HD2 1 110 VAL MG1 . . 4.520 3.658 1.887 4.515 . 0 0 "[ . 1 . 2]" 1
1272 1 82 ARG HD3 1 86 ALA MB . . 4.300 3.472 2.279 4.295 . 0 0 "[ . 1 . 2]" 1
1273 1 82 ARG HD3 1 110 VAL MG1 . . 4.520 3.207 1.990 4.261 . 0 0 "[ . 1 . 2]" 1
1274 1 82 ARG QG 1 110 VAL H . . 5.340 4.557 4.171 4.938 . 0 0 "[ . 1 . 2]" 1
1275 1 82 ARG QG 1 110 VAL HB . . 3.810 2.418 2.153 2.660 . 0 0 "[ . 1 . 2]" 1
1276 1 82 ARG QG 1 110 VAL MG1 . . 3.210 2.083 1.847 2.500 . 0 0 "[ . 1 . 2]" 1
1277 1 82 ARG HG2 1 86 ALA HA . . 4.600 2.746 2.124 3.763 . 0 0 "[ . 1 . 2]" 1
1278 1 82 ARG HG2 1 110 VAL HB . . 4.420 3.047 2.176 4.300 . 0 0 "[ . 1 . 2]" 1
1279 1 82 ARG HG2 1 110 VAL MG1 . . 3.700 2.762 2.003 3.701 0.001 20 0 "[ . 1 . 2]" 1
1280 1 82 ARG HG3 1 86 ALA HA . . 4.600 3.535 2.049 4.568 . 0 0 "[ . 1 . 2]" 1
1281 1 82 ARG HG3 1 110 VAL HB . . 4.420 3.102 2.165 3.754 . 0 0 "[ . 1 . 2]" 1
1282 1 82 ARG HG3 1 110 VAL MG1 . . 3.700 2.277 1.980 2.808 . 0 0 "[ . 1 . 2]" 1
1283 1 83 GLU H 1 83 GLU QB . . 3.300 2.485 2.219 2.692 . 0 0 "[ . 1 . 2]" 1
1284 1 83 GLU H 1 83 GLU HG2 . . 4.140 2.638 1.919 3.810 . 0 0 "[ . 1 . 2]" 1
1285 1 83 GLU H 1 83 GLU QG . . 3.600 2.199 1.885 2.671 . 0 0 "[ . 1 . 2]" 1
1286 1 83 GLU H 1 83 GLU HG3 . . 4.140 2.926 1.899 3.674 . 0 0 "[ . 1 . 2]" 1
1287 1 83 GLU H 1 84 GLU H . . 3.740 2.849 2.503 3.016 . 0 0 "[ . 1 . 2]" 1
1288 1 83 GLU H 1 85 THR H . . 4.950 4.753 4.440 4.927 . 0 0 "[ . 1 . 2]" 1
1289 1 83 GLU HA 1 83 GLU HG2 . . 4.140 3.153 2.282 4.159 0.019 12 0 "[ . 1 . 2]" 1
1290 1 83 GLU HA 1 83 GLU QG . . 3.520 2.892 2.221 3.356 . 0 0 "[ . 1 . 2]" 1
1291 1 83 GLU HA 1 83 GLU HG3 . . 4.140 3.552 2.846 3.921 . 0 0 "[ . 1 . 2]" 1
1292 1 83 GLU QB 1 84 GLU H . . 3.880 3.086 2.370 3.748 . 0 0 "[ . 1 . 2]" 1
1293 1 83 GLU QG 1 84 GLU H . . 4.850 3.277 1.888 4.435 . 0 0 "[ . 1 . 2]" 1
1294 1 84 GLU H 1 84 GLU HB2 . . 3.940 2.535 2.202 2.931 . 0 0 "[ . 1 . 2]" 1
1295 1 84 GLU H 1 84 GLU QB . . 3.410 2.321 2.180 2.498 . 0 0 "[ . 1 . 2]" 1
1296 1 84 GLU H 1 84 GLU HB3 . . 3.940 2.867 2.399 3.619 . 0 0 "[ . 1 . 2]" 1
1297 1 84 GLU H 1 84 GLU HG2 . . 5.500 4.265 2.251 4.859 . 0 0 "[ . 1 . 2]" 1
1298 1 84 GLU H 1 84 GLU HG3 . . 5.500 4.330 2.588 4.711 . 0 0 "[ . 1 . 2]" 1
1299 1 84 GLU H 1 85 THR H . . 3.200 2.618 2.206 2.904 . 0 0 "[ . 1 . 2]" 1
1300 1 84 GLU H 1 85 THR MG . . 4.770 4.280 3.829 4.639 . 0 0 "[ . 1 . 2]" 1
1301 1 84 GLU HA 1 84 GLU HG2 . . 3.940 3.240 2.255 3.863 . 0 0 "[ . 1 . 2]" 1
1302 1 84 GLU HA 1 84 GLU QG . . 3.420 2.609 2.223 3.038 . 0 0 "[ . 1 . 2]" 1
1303 1 84 GLU HA 1 84 GLU HG3 . . 3.940 3.059 2.265 3.774 . 0 0 "[ . 1 . 2]" 1
1304 1 84 GLU QB 1 85 THR H . . 3.300 2.107 1.935 2.274 . 0 0 "[ . 1 . 2]" 1
1305 1 84 GLU QB 1 85 THR HB . . 5.340 3.758 3.485 4.088 . 0 0 "[ . 1 . 2]" 1
1306 1 84 GLU QB 1 85 THR MG . . 4.080 2.831 2.534 3.098 . 0 0 "[ . 1 . 2]" 1
1307 1 84 GLU HB2 1 85 THR H . . 3.810 3.225 2.128 3.744 . 0 0 "[ . 1 . 2]" 1
1308 1 84 GLU HB2 1 85 THR MG . . 4.750 4.132 2.877 4.691 . 0 0 "[ . 1 . 2]" 1
1309 1 84 GLU HB3 1 85 THR H . . 3.810 2.301 1.945 3.229 . 0 0 "[ . 1 . 2]" 1
1310 1 84 GLU HB3 1 85 THR MG . . 4.750 2.994 2.559 3.731 . 0 0 "[ . 1 . 2]" 1
1311 1 84 GLU QG 1 85 THR H . . 4.160 3.654 2.988 4.095 . 0 0 "[ . 1 . 2]" 1
1312 1 84 GLU QG 1 85 THR MG . . 4.580 3.823 2.905 4.565 . 0 0 "[ . 1 . 2]" 1
1313 1 84 GLU HG2 1 85 THR H . . 4.740 4.267 3.438 4.634 . 0 0 "[ . 1 . 2]" 1
1314 1 84 GLU HG3 1 85 THR H . . 4.740 4.068 3.106 4.674 . 0 0 "[ . 1 . 2]" 1
1315 1 85 THR H 1 85 THR HB . . 3.700 3.213 3.089 3.352 . 0 0 "[ . 1 . 2]" 1
1316 1 85 THR H 1 85 THR MG . . 3.290 2.110 1.875 2.404 . 0 0 "[ . 1 . 2]" 1
1317 1 85 THR HA 1 85 THR MG . . 3.570 3.201 3.191 3.206 . 0 0 "[ . 1 . 2]" 1
1318 1 85 THR HA 1 86 ALA MB . . 4.560 3.934 3.828 4.062 . 0 0 "[ . 1 . 2]" 1
1319 1 85 THR HA 1 87 ILE H . . 4.140 3.849 3.395 4.123 . 0 0 "[ . 1 . 2]" 1
1320 1 85 THR HB 1 88 HIS HE1 . . 4.490 4.367 4.159 4.466 . 0 0 "[ . 1 . 2]" 1
1321 1 85 THR MG 1 86 ALA H . . 4.770 3.928 3.700 4.197 . 0 0 "[ . 1 . 2]" 1
1322 1 85 THR MG 1 86 ALA HA . . 4.400 4.167 3.870 4.398 . 0 0 "[ . 1 . 2]" 1
1323 1 85 THR MG 1 87 ILE H . . 4.520 4.168 3.589 4.483 . 0 0 "[ . 1 . 2]" 1
1324 1 85 THR MG 1 88 HIS HE1 . . 3.930 2.168 1.950 2.666 . 0 0 "[ . 1 . 2]" 1
1325 1 86 ALA H 1 87 ILE H . . 3.410 2.263 1.940 2.603 . 0 0 "[ . 1 . 2]" 1
1326 1 86 ALA HA 1 110 VAL H . . 4.490 4.157 3.749 4.454 . 0 0 "[ . 1 . 2]" 1
1327 1 86 ALA HA 1 110 VAL HB . . 4.120 2.722 2.021 3.430 . 0 0 "[ . 1 . 2]" 1
1328 1 86 ALA HA 1 110 VAL MG1 . . 4.950 3.726 3.023 4.451 . 0 0 "[ . 1 . 2]" 1
1329 1 86 ALA MB 1 87 ILE H . . 3.490 2.768 2.495 3.168 . 0 0 "[ . 1 . 2]" 1
1330 1 86 ALA MB 1 87 ILE MD . . 4.270 3.422 2.064 3.907 . 0 0 "[ . 1 . 2]" 1
1331 1 86 ALA MB 1 87 ILE QG . . 4.010 2.587 2.374 3.077 . 0 0 "[ . 1 . 2]" 1
1332 1 86 ALA MB 1 110 VAL H . . 4.220 3.904 3.466 4.214 . 0 0 "[ . 1 . 2]" 1
1333 1 86 ALA MB 1 110 VAL HB . . 4.030 3.517 2.770 3.904 . 0 0 "[ . 1 . 2]" 1
1334 1 87 ILE H 1 87 ILE HB . . 3.730 2.644 2.508 2.770 . 0 0 "[ . 1 . 2]" 1
1335 1 87 ILE H 1 87 ILE QG . . 4.110 2.757 2.211 3.279 . 0 0 "[ . 1 . 2]" 1
1336 1 87 ILE H 1 87 ILE MG . . 4.150 3.846 3.793 3.893 . 0 0 "[ . 1 . 2]" 1
1337 1 87 ILE H 1 88 HIS H . . 4.530 4.416 4.208 4.519 . 0 0 "[ . 1 . 2]" 1
1338 1 87 ILE HB 1 87 ILE MD . . 3.330 2.451 2.192 3.229 . 0 0 "[ . 1 . 2]" 1
1339 1 87 ILE HB 1 88 HIS H . . 4.840 4.054 3.811 4.342 . 0 0 "[ . 1 . 2]" 1
1340 1 87 ILE MD 1 87 ILE MG . . 3.060 2.163 1.911 3.114 0.054 2 0 "[ . 1 . 2]" 1
1341 1 87 ILE MD 1 89 LYS QE . . 4.550 4.043 2.894 4.537 . 0 0 "[ . 1 . 2]" 1
1342 1 87 ILE MD 1 109 ASN HA . . 4.760 4.239 2.180 4.746 . 0 0 "[ . 1 . 2]" 1
1343 1 87 ILE QG 1 109 ASN HA . . 4.610 3.243 2.661 4.508 . 0 0 "[ . 1 . 2]" 1
1344 1 87 ILE MG 1 88 HIS H . . 3.700 2.318 2.034 2.890 . 0 0 "[ . 1 . 2]" 1
1345 1 87 ILE MG 1 88 HIS HA . . 4.610 3.642 3.391 3.921 . 0 0 "[ . 1 . 2]" 1
1346 1 87 ILE MG 1 89 LYS H . . 4.790 3.984 3.678 4.620 . 0 0 "[ . 1 . 2]" 1
1347 1 87 ILE MG 1 89 LYS QE . . 3.940 2.538 1.807 3.260 . 0 0 "[ . 1 . 2]" 1
1348 1 87 ILE MG 1 89 LYS HG2 . . 4.630 3.171 2.350 4.339 . 0 0 "[ . 1 . 2]" 1
1349 1 87 ILE MG 1 89 LYS QG . . 4.050 2.720 2.262 3.803 . 0 0 "[ . 1 . 2]" 1
1350 1 87 ILE MG 1 89 LYS HG3 . . 4.630 3.351 2.405 4.216 . 0 0 "[ . 1 . 2]" 1
1351 1 87 ILE MG 1 107 THR MG . . 2.840 2.230 1.964 2.551 . 0 0 "[ . 1 . 2]" 1
1352 1 87 ILE MG 1 108 ILE H . . 4.520 3.161 2.769 3.574 . 0 0 "[ . 1 . 2]" 1
1353 1 87 ILE MG 1 109 ASN HA . . 4.540 3.607 3.078 4.087 . 0 0 "[ . 1 . 2]" 1
1354 1 88 HIS H 1 88 HIS QB . . 3.470 2.398 2.284 2.517 . 0 0 "[ . 1 . 2]" 1
1355 1 88 HIS H 1 88 HIS HD2 . . 4.060 3.928 3.706 4.055 . 0 0 "[ . 1 . 2]" 1
1356 1 88 HIS H 1 107 THR MG . . 4.260 4.063 3.511 4.253 . 0 0 "[ . 1 . 2]" 1
1357 1 88 HIS H 1 108 ILE HB . . 4.030 2.980 2.538 3.362 . 0 0 "[ . 1 . 2]" 1
1358 1 88 HIS H 1 108 ILE MG . . 4.580 3.967 3.524 4.392 . 0 0 "[ . 1 . 2]" 1
1359 1 88 HIS H 1 109 ASN HA . . 4.370 4.073 3.695 4.368 . 0 0 "[ . 1 . 2]" 1
1360 1 88 HIS H 1 110 VAL MG2 . . 4.590 4.020 3.680 4.580 . 0 0 "[ . 1 . 2]" 1
1361 1 88 HIS HA 1 89 LYS H . . 2.900 2.155 2.139 2.238 . 0 0 "[ . 1 . 2]" 1
1362 1 88 HIS QB 1 89 LYS H . . 4.000 3.345 2.891 3.527 . 0 0 "[ . 1 . 2]" 1
1363 1 88 HIS QB 1 90 VAL MG2 . . 3.720 2.919 2.759 3.106 . 0 0 "[ . 1 . 2]" 1
1364 1 88 HIS QB 1 108 ILE H . . 4.080 3.636 3.208 3.851 . 0 0 "[ . 1 . 2]" 1
1365 1 88 HIS QB 1 108 ILE HB . . 3.360 2.090 1.986 2.273 . 0 0 "[ . 1 . 2]" 1
1366 1 88 HIS QB 1 108 ILE MD . . 3.810 2.526 2.054 2.771 . 0 0 "[ . 1 . 2]" 1
1367 1 88 HIS QB 1 108 ILE MG . . 4.350 3.120 2.818 3.492 . 0 0 "[ . 1 . 2]" 1
1368 1 88 HIS QB 1 110 VAL MG2 . . 5.060 3.960 3.655 4.258 . 0 0 "[ . 1 . 2]" 1
1369 1 88 HIS HB2 1 90 VAL MG2 . . 4.440 4.256 4.035 4.432 . 0 0 "[ . 1 . 2]" 1
1370 1 88 HIS HB2 1 108 ILE H . . 4.860 3.821 3.357 4.051 . 0 0 "[ . 1 . 2]" 1
1371 1 88 HIS HB2 1 108 ILE HB . . 3.910 2.113 2.009 2.305 . 0 0 "[ . 1 . 2]" 1
1372 1 88 HIS HB2 1 108 ILE MD . . 4.640 2.827 2.336 3.144 . 0 0 "[ . 1 . 2]" 1
1373 1 88 HIS HB3 1 90 VAL MG2 . . 4.440 2.974 2.799 3.171 . 0 0 "[ . 1 . 2]" 1
1374 1 88 HIS HB3 1 108 ILE H . . 4.860 4.565 4.074 4.813 . 0 0 "[ . 1 . 2]" 1
1375 1 88 HIS HB3 1 108 ILE HB . . 3.910 3.324 3.077 3.680 . 0 0 "[ . 1 . 2]" 1
1376 1 88 HIS HB3 1 108 ILE MD . . 4.640 2.854 2.275 3.228 . 0 0 "[ . 1 . 2]" 1
1377 1 88 HIS HD2 1 108 ILE HB . . 4.430 4.163 3.893 4.400 . 0 0 "[ . 1 . 2]" 1
1378 1 88 HIS HD2 1 108 ILE MG . . 4.490 3.789 3.444 4.051 . 0 0 "[ . 1 . 2]" 1
1379 1 88 HIS HD2 1 110 VAL MG1 . . 5.460 4.773 4.203 5.236 . 0 0 "[ . 1 . 2]" 1
1380 1 88 HIS HD2 1 110 VAL MG2 . . 3.320 2.642 2.162 3.107 . 0 0 "[ . 1 . 2]" 1
1381 1 89 LYS H 1 89 LYS QB . . 3.290 2.421 2.240 2.624 . 0 0 "[ . 1 . 2]" 1
1382 1 89 LYS H 1 89 LYS HG2 . . 4.410 3.572 2.664 4.390 . 0 0 "[ . 1 . 2]" 1
1383 1 89 LYS H 1 89 LYS HG3 . . 4.410 3.632 2.618 4.314 . 0 0 "[ . 1 . 2]" 1
1384 1 89 LYS H 1 90 VAL MG2 . . 4.190 3.828 3.461 4.055 . 0 0 "[ . 1 . 2]" 1
1385 1 89 LYS QB 1 90 VAL H . . 4.080 3.522 3.296 3.607 . 0 0 "[ . 1 . 2]" 1
1386 1 89 LYS HD2 1 105 THR MG . . 4.860 3.788 2.104 4.795 . 0 0 "[ . 1 . 2]" 1
1387 1 89 LYS HD2 1 107 THR MG . . 5.070 4.454 2.016 5.056 . 0 0 "[ . 1 . 2]" 1
1388 1 89 LYS HD3 1 105 THR MG . . 4.860 3.456 2.364 4.800 . 0 0 "[ . 1 . 2]" 1
1389 1 89 LYS HD3 1 107 THR MG . . 5.070 4.080 3.018 5.065 . 0 0 "[ . 1 . 2]" 1
1390 1 89 LYS QE 1 107 THR MG . . 3.880 2.711 2.259 3.290 . 0 0 "[ . 1 . 2]" 1
1391 1 89 LYS QG 1 90 VAL H . . 4.710 4.321 3.882 4.707 . 0 0 "[ . 1 . 2]" 1
1392 1 89 LYS QG 1 105 THR MG . . 4.510 3.674 2.301 4.507 . 0 0 "[ . 1 . 2]" 1
1393 1 89 LYS QG 1 107 THR MG . . 4.650 3.531 2.650 4.323 . 0 0 "[ . 1 . 2]" 1
1394 1 89 LYS HG2 1 105 THR MG . . 5.380 4.110 2.927 5.198 . 0 0 "[ . 1 . 2]" 1
1395 1 89 LYS HG2 1 107 THR MG . . 5.500 3.847 2.804 5.228 . 0 0 "[ . 1 . 2]" 1
1396 1 89 LYS HG3 1 105 THR MG . . 5.380 4.439 2.364 5.263 . 0 0 "[ . 1 . 2]" 1
1397 1 89 LYS HG3 1 107 THR MG . . 5.500 4.371 3.248 5.399 . 0 0 "[ . 1 . 2]" 1
1398 1 90 VAL H 1 90 VAL HB . . 3.590 2.663 2.587 2.805 . 0 0 "[ . 1 . 2]" 1
1399 1 90 VAL H 1 90 VAL MG1 . . 4.380 3.860 3.829 3.922 . 0 0 "[ . 1 . 2]" 1
1400 1 90 VAL H 1 90 VAL MG2 . . 3.580 2.725 2.567 2.929 . 0 0 "[ . 1 . 2]" 1
1401 1 90 VAL H 1 105 THR MG . . 4.410 3.838 2.740 4.290 . 0 0 "[ . 1 . 2]" 1
1402 1 90 VAL H 1 106 VAL H . . 3.970 3.275 2.746 3.671 . 0 0 "[ . 1 . 2]" 1
1403 1 90 VAL H 1 106 VAL HB . . 4.700 3.565 3.089 3.998 . 0 0 "[ . 1 . 2]" 1
1404 1 90 VAL HA 1 90 VAL MG1 . . 3.460 2.353 2.181 2.440 . 0 0 "[ . 1 . 2]" 1
1405 1 90 VAL HA 1 90 VAL MG2 . . 3.470 2.381 2.254 2.481 . 0 0 "[ . 1 . 2]" 1
1406 1 90 VAL HA 1 91 THR H . . 3.090 2.169 2.139 2.231 . 0 0 "[ . 1 . 2]" 1
1407 1 90 VAL HA 1 91 THR HB . . 4.760 4.703 4.613 4.764 0.004 7 0 "[ . 1 . 2]" 1
1408 1 90 VAL HB 1 91 THR H . . 4.580 4.106 3.849 4.340 . 0 0 "[ . 1 . 2]" 1
1409 1 90 VAL HB 1 106 VAL H . . 4.580 4.275 3.459 4.577 . 0 0 "[ . 1 . 2]" 1
1410 1 90 VAL HB 1 106 VAL HB . . 3.520 3.265 2.827 3.517 . 0 0 "[ . 1 . 2]" 1
1411 1 90 VAL HB 1 106 VAL MG1 . . 4.560 4.263 3.741 4.556 . 0 0 "[ . 1 . 2]" 1
1412 1 90 VAL HB 1 108 ILE MD . . 4.700 3.406 3.187 3.750 . 0 0 "[ . 1 . 2]" 1
1413 1 90 VAL MG1 1 91 THR H . . 3.820 2.331 1.907 2.762 . 0 0 "[ . 1 . 2]" 1
1414 1 90 VAL MG1 1 91 THR HA . . 5.090 3.783 3.540 4.043 . 0 0 "[ . 1 . 2]" 1
1415 1 90 VAL MG1 1 91 THR HB . . 4.590 4.436 4.231 4.587 . 0 0 "[ . 1 . 2]" 1
1416 1 90 VAL MG1 1 106 VAL H . . 5.070 4.891 4.430 5.071 0.001 9 0 "[ . 1 . 2]" 1
1417 1 90 VAL MG1 1 106 VAL HB . . 4.490 4.361 4.001 4.499 0.009 6 0 "[ . 1 . 2]" 1
1418 1 90 VAL MG1 1 108 ILE MD . . 4.430 4.265 4.010 4.429 . 0 0 "[ . 1 . 2]" 1
1419 1 90 VAL MG2 1 91 THR H . . 4.330 4.024 3.855 4.156 . 0 0 "[ . 1 . 2]" 1
1420 1 90 VAL MG2 1 108 ILE MD . . 3.390 2.638 2.286 3.049 . 0 0 "[ . 1 . 2]" 1
1421 1 91 THR H 1 91 THR HB . . 3.510 2.670 2.575 2.754 . 0 0 "[ . 1 . 2]" 1
1422 1 91 THR H 1 91 THR MG . . 4.460 3.860 3.806 3.895 . 0 0 "[ . 1 . 2]" 1
1423 1 91 THR H 1 92 VAL MG2 . . 5.170 4.396 4.028 4.629 . 0 0 "[ . 1 . 2]" 1
1424 1 91 THR HA 1 91 THR MG . . 3.300 2.334 2.171 2.426 . 0 0 "[ . 1 . 2]" 1
1425 1 91 THR HA 1 92 VAL H . . 3.030 2.163 2.142 2.221 . 0 0 "[ . 1 . 2]" 1
1426 1 91 THR HA 1 92 VAL MG2 . . 4.790 3.632 3.357 3.795 . 0 0 "[ . 1 . 2]" 1
1427 1 91 THR HA 1 105 THR HA . . 3.720 2.793 2.529 3.049 . 0 0 "[ . 1 . 2]" 1
1428 1 91 THR HA 1 105 THR MG . . 4.430 4.230 3.785 4.431 0.001 5 0 "[ . 1 . 2]" 1
1429 1 91 THR HA 1 106 VAL H . . 3.990 3.687 3.134 3.980 . 0 0 "[ . 1 . 2]" 1
1430 1 91 THR HA 1 106 VAL MG2 . . 4.810 4.297 3.861 4.760 . 0 0 "[ . 1 . 2]" 1
1431 1 91 THR MG 1 92 VAL H . . 3.650 2.551 2.219 2.992 . 0 0 "[ . 1 . 2]" 1
1432 1 91 THR MG 1 103 ARG HB2 . . 4.440 3.438 2.143 4.440 . 0 0 "[ . 1 . 2]" 1
1433 1 91 THR MG 1 103 ARG QB . . 3.890 2.705 2.120 3.131 . 0 0 "[ . 1 . 2]" 1
1434 1 91 THR MG 1 103 ARG HB3 . . 4.440 3.337 2.670 4.099 . 0 0 "[ . 1 . 2]" 1
1435 1 91 THR MG 1 103 ARG HD2 . . 4.660 3.850 2.541 4.659 . 0 0 "[ . 1 . 2]" 1
1436 1 91 THR MG 1 103 ARG QD . . 3.820 3.287 2.430 3.818 . 0 0 "[ . 1 . 2]" 1
1437 1 91 THR MG 1 103 ARG HD3 . . 4.660 3.850 2.699 4.662 0.002 5 0 "[ . 1 . 2]" 1
1438 1 91 THR MG 1 104 ALA H . . 3.700 2.468 2.103 2.891 . 0 0 "[ . 1 . 2]" 1
1439 1 91 THR MG 1 105 THR HA . . 4.320 3.396 3.023 3.869 . 0 0 "[ . 1 . 2]" 1
1440 1 91 THR MG 1 105 THR HB . . 5.170 5.127 4.888 5.179 0.009 6 0 "[ . 1 . 2]" 1
1441 1 92 VAL H 1 92 VAL HB . . 3.670 2.596 2.518 2.721 . 0 0 "[ . 1 . 2]" 1
1442 1 92 VAL H 1 92 VAL MG1 . . 4.380 3.831 3.797 3.888 . 0 0 "[ . 1 . 2]" 1
1443 1 92 VAL H 1 92 VAL MG2 . . 3.790 2.619 2.309 2.887 . 0 0 "[ . 1 . 2]" 1
1444 1 92 VAL H 1 104 ALA H . . 3.860 2.979 2.625 3.410 . 0 0 "[ . 1 . 2]" 1
1445 1 92 VAL H 1 104 ALA MB . . 4.640 3.288 2.782 3.648 . 0 0 "[ . 1 . 2]" 1
1446 1 92 VAL H 1 105 THR HA . . 4.530 4.169 3.876 4.530 . 0 0 "[ . 1 . 2]" 1
1447 1 92 VAL H 1 106 VAL MG2 . . 5.110 4.259 3.699 4.759 . 0 0 "[ . 1 . 2]" 1
1448 1 92 VAL HB 1 104 ALA H . . 4.880 4.202 3.720 4.701 . 0 0 "[ . 1 . 2]" 1
1449 1 92 VAL HB 1 104 ALA MB . . 4.020 3.057 2.219 3.799 . 0 0 "[ . 1 . 2]" 1
1450 1 92 VAL MG1 1 93 LEU H . . 3.640 2.212 1.945 2.971 . 0 0 "[ . 1 . 2]" 1
1451 1 92 VAL MG2 1 93 LEU H . . 4.450 3.949 3.812 4.181 . 0 0 "[ . 1 . 2]" 1
1452 1 93 LEU H 1 93 LEU HB2 . . 3.850 2.519 2.256 2.695 . 0 0 "[ . 1 . 2]" 1
1453 1 93 LEU H 1 93 LEU MD1 . . 4.470 3.908 3.672 4.258 . 0 0 "[ . 1 . 2]" 1
1454 1 93 LEU H 1 93 LEU QD . . 3.920 3.408 2.128 3.676 . 0 0 "[ . 1 . 2]" 1
1455 1 93 LEU H 1 93 LEU MD2 . . 4.470 3.849 2.139 4.339 . 0 0 "[ . 1 . 2]" 1
1456 1 93 LEU H 1 93 LEU HG . . 4.110 3.094 2.574 4.095 . 0 0 "[ . 1 . 2]" 1
1457 1 93 LEU HA 1 93 LEU MD1 . . 4.450 3.785 2.098 3.948 . 0 0 "[ . 1 . 2]" 1
1458 1 93 LEU HA 1 93 LEU QD . . 3.610 2.157 1.969 2.482 . 0 0 "[ . 1 . 2]" 1
1459 1 93 LEU HA 1 93 LEU MD2 . . 4.450 2.206 1.975 2.786 . 0 0 "[ . 1 . 2]" 1
1460 1 93 LEU HA 1 94 ALA H . . 3.150 2.185 2.139 2.328 . 0 0 "[ . 1 . 2]" 1
1461 1 93 LEU HA 1 94 ALA MB . . 4.720 3.912 3.770 4.017 . 0 0 "[ . 1 . 2]" 1
1462 1 93 LEU HA 1 103 ARG HA . . 3.890 3.183 2.619 3.689 . 0 0 "[ . 1 . 2]" 1
1463 1 93 LEU HB2 1 101 PRO QB . . 4.580 3.929 3.427 4.470 . 0 0 "[ . 1 . 2]" 1
1464 1 93 LEU HB2 1 101 PRO QG . . 5.500 4.428 3.285 5.502 0.002 9 0 "[ . 1 . 2]" 1
1465 1 93 LEU HB3 1 94 ALA H . . 4.440 3.158 2.597 3.516 . 0 0 "[ . 1 . 2]" 1
1466 1 93 LEU HB3 1 101 PRO HB2 . . 3.970 2.464 1.997 2.969 . 0 0 "[ . 1 . 2]" 1
1467 1 93 LEU HB3 1 101 PRO HB3 . . 3.970 3.450 2.829 3.914 . 0 0 "[ . 1 . 2]" 1
1468 1 93 LEU HB3 1 101 PRO QG . . 4.180 3.167 2.059 4.177 . 0 0 "[ . 1 . 2]" 1
1469 1 93 LEU QD 1 94 ALA H . . 4.190 3.329 2.816 3.735 . 0 0 "[ . 1 . 2]" 1
1470 1 93 LEU QD 1 95 SER QB . . 5.310 4.680 4.376 4.994 . 0 0 "[ . 1 . 2]" 1
1471 1 93 LEU QD 1 101 PRO HA . . 5.180 4.537 4.000 5.026 . 0 0 "[ . 1 . 2]" 1
1472 1 93 LEU QD 1 101 PRO QB . . 3.430 2.519 1.952 3.102 . 0 0 "[ . 1 . 2]" 1
1473 1 93 LEU QD 1 101 PRO QD . . 4.760 3.930 3.322 4.559 . 0 0 "[ . 1 . 2]" 1
1474 1 93 LEU QD 1 102 ALA HA . . 5.430 4.230 3.849 4.615 . 0 0 "[ . 1 . 2]" 1
1475 1 93 LEU QD 1 103 ARG H . . 4.740 3.974 3.333 4.539 . 0 0 "[ . 1 . 2]" 1
1476 1 93 LEU QD 1 103 ARG HA . . 3.630 2.404 2.027 2.952 . 0 0 "[ . 1 . 2]" 1
1477 1 93 LEU QD 1 103 ARG QB . . 3.780 2.888 1.964 3.786 0.006 12 0 "[ . 1 . 2]" 1
1478 1 93 LEU QD 1 103 ARG QD . . 3.820 3.384 1.795 3.824 0.004 9 0 "[ . 1 . 2]" 1
1479 1 93 LEU QD 1 104 ALA H . . 4.440 3.786 3.191 4.282 . 0 0 "[ . 1 . 2]" 1
1480 1 93 LEU MD1 1 101 PRO QG . . 3.650 2.997 1.906 3.604 . 0 0 "[ . 1 . 2]" 1
1481 1 93 LEU MD2 1 101 PRO QG . . 3.650 2.762 2.242 3.626 . 0 0 "[ . 1 . 2]" 1
1482 1 94 ALA H 1 94 ALA MB . . 3.620 2.366 2.213 2.592 . 0 0 "[ . 1 . 2]" 1
1483 1 94 ALA H 1 101 PRO HB2 . . 4.500 2.983 2.068 3.622 . 0 0 "[ . 1 . 2]" 1
1484 1 94 ALA H 1 101 PRO HB3 . . 4.500 4.012 3.372 4.475 . 0 0 "[ . 1 . 2]" 1
1485 1 94 ALA H 1 101 PRO QG . . 5.500 4.701 3.846 5.345 . 0 0 "[ . 1 . 2]" 1
1486 1 94 ALA H 1 102 ALA H . . 3.930 2.684 2.184 3.236 . 0 0 "[ . 1 . 2]" 1
1487 1 94 ALA H 1 102 ALA MB . . 3.870 3.251 2.770 3.668 . 0 0 "[ . 1 . 2]" 1
1488 1 94 ALA H 1 103 ARG HA . . 4.820 4.512 3.939 4.823 0.003 11 0 "[ . 1 . 2]" 1
1489 1 94 ALA HA 1 95 SER H . . 3.110 2.154 2.140 2.186 . 0 0 "[ . 1 . 2]" 1
1490 1 94 ALA HA 1 95 SER QB . . 4.760 4.148 4.012 4.436 . 0 0 "[ . 1 . 2]" 1
1491 1 94 ALA MB 1 95 SER H . . 4.010 3.249 2.953 3.490 . 0 0 "[ . 1 . 2]" 1
1492 1 94 ALA MB 1 102 ALA H . . 4.410 3.189 2.532 3.674 . 0 0 "[ . 1 . 2]" 1
1493 1 94 ALA MB 1 102 ALA MB . . 3.390 2.691 2.005 3.197 . 0 0 "[ . 1 . 2]" 1
1494 1 95 SER H 1 95 SER QB . . 3.650 2.620 2.406 3.043 . 0 0 "[ . 1 . 2]" 1
1495 1 95 SER QB 1 96 ASP H . . 4.390 3.567 2.760 3.904 . 0 0 "[ . 1 . 2]" 1
1496 1 95 SER QB 1 97 GLY H . . 5.500 4.494 3.470 5.356 . 0 0 "[ . 1 . 2]" 1
1497 1 95 SER QB 1 101 PRO HA . . 4.310 3.751 2.762 4.176 . 0 0 "[ . 1 . 2]" 1
1498 1 95 SER QB 1 101 PRO HB2 . . 4.730 3.745 3.333 4.284 . 0 0 "[ . 1 . 2]" 1
1499 1 95 SER QB 1 101 PRO QB . . 3.940 2.298 1.983 2.827 . 0 0 "[ . 1 . 2]" 1
1500 1 95 SER QB 1 101 PRO HB3 . . 4.730 2.320 1.994 2.868 . 0 0 "[ . 1 . 2]" 1
1501 1 95 SER QB 1 101 PRO QG . . 4.560 3.560 2.435 4.346 . 0 0 "[ . 1 . 2]" 1
1502 1 95 SER QB 1 102 ALA H . . 5.500 4.968 4.303 5.354 . 0 0 "[ . 1 . 2]" 1
1503 1 96 ASP H 1 97 GLY H . . 3.760 2.231 1.820 3.097 . 0 0 "[ . 1 . 2]" 1
1504 1 98 SER H 1 98 SER QB . . 3.610 2.704 2.237 3.237 . 0 0 "[ . 1 . 2]" 1
1505 1 98 SER H 1 99 SER H . . 4.570 3.756 2.214 4.499 . 0 0 "[ . 1 . 2]" 1
1506 1 99 SER QB 1 100 THR H . . 4.390 2.831 1.917 3.829 . 0 0 "[ . 1 . 2]" 1
1507 1 100 THR H 1 100 THR HB . . 3.900 3.115 2.530 3.815 . 0 0 "[ . 1 . 2]" 1
1508 1 100 THR H 1 100 THR MG . . 4.690 3.287 2.113 3.869 . 0 0 "[ . 1 . 2]" 1
1509 1 100 THR HA 1 100 THR MG . . 3.450 2.353 2.068 2.493 . 0 0 "[ . 1 . 2]" 1
1510 1 100 THR HA 1 101 PRO HD2 . . 3.250 2.156 2.000 2.253 . 0 0 "[ . 1 . 2]" 1
1511 1 100 THR HA 1 101 PRO HD3 . . 3.250 2.264 2.254 2.307 . 0 0 "[ . 1 . 2]" 1
1512 1 100 THR HA 1 101 PRO QG . . 4.510 3.863 3.788 3.914 . 0 0 "[ . 1 . 2]" 1
1513 1 100 THR HB 1 101 PRO QD . . 4.080 3.230 2.308 4.045 . 0 0 "[ . 1 . 2]" 1
1514 1 100 THR MG 1 101 PRO HD2 . . 4.180 2.437 1.818 3.227 . 0 0 "[ . 1 . 2]" 1
1515 1 100 THR MG 1 101 PRO QD . . 3.360 2.382 1.807 3.091 . 0 0 "[ . 1 . 2]" 1
1516 1 100 THR MG 1 101 PRO HD3 . . 4.180 3.550 3.147 3.955 . 0 0 "[ . 1 . 2]" 1
1517 1 100 THR MG 1 101 PRO QG . . 4.780 3.692 2.842 4.668 . 0 0 "[ . 1 . 2]" 1
1518 1 101 PRO HA 1 102 ALA H . . 3.150 2.330 2.153 2.588 . 0 0 "[ . 1 . 2]" 1
1519 1 101 PRO QB 1 102 ALA H . . 3.670 2.746 2.148 3.444 . 0 0 "[ . 1 . 2]" 1
1520 1 101 PRO QB 1 102 ALA MB . . 5.230 4.229 3.883 4.635 . 0 0 "[ . 1 . 2]" 1
1521 1 101 PRO HB2 1 102 ALA H . . 4.230 2.859 2.180 3.695 . 0 0 "[ . 1 . 2]" 1
1522 1 101 PRO HB3 1 102 ALA H . . 4.230 3.599 3.252 4.113 . 0 0 "[ . 1 . 2]" 1
1523 1 101 PRO QG 1 102 ALA H . . 4.720 4.301 3.843 4.711 . 0 0 "[ . 1 . 2]" 1
1524 1 102 ALA H 1 102 ALA MB . . 3.400 2.225 2.048 2.338 . 0 0 "[ . 1 . 2]" 1
1525 1 102 ALA HA 1 103 ARG H . . 3.020 2.288 2.142 2.530 . 0 0 "[ . 1 . 2]" 1
1526 1 102 ALA HA 1 103 ARG QG . . 5.080 3.859 3.392 4.305 . 0 0 "[ . 1 . 2]" 1
1527 1 102 ALA MB 1 103 ARG H . . 3.570 2.729 2.262 3.255 . 0 0 "[ . 1 . 2]" 1
1528 1 102 ALA MB 1 103 ARG QB . . 5.340 4.597 4.319 4.905 . 0 0 "[ . 1 . 2]" 1
1529 1 103 ARG H 1 103 ARG HB2 . . 3.870 3.138 2.263 3.856 . 0 0 "[ . 1 . 2]" 1
1530 1 103 ARG H 1 103 ARG HB3 . . 3.870 3.295 2.646 3.857 . 0 0 "[ . 1 . 2]" 1
1531 1 103 ARG H 1 103 ARG HG2 . . 4.730 2.974 1.929 4.330 . 0 0 "[ . 1 . 2]" 1
1532 1 103 ARG H 1 103 ARG QG . . 4.090 2.586 1.915 3.312 . 0 0 "[ . 1 . 2]" 1
1533 1 103 ARG H 1 103 ARG HG3 . . 4.730 3.272 2.622 3.849 . 0 0 "[ . 1 . 2]" 1
1534 1 103 ARG HA 1 104 ALA H . . 3.100 2.197 2.140 2.277 . 0 0 "[ . 1 . 2]" 1
1535 1 103 ARG HA 1 104 ALA MB . . 4.720 3.889 3.794 4.016 . 0 0 "[ . 1 . 2]" 1
1536 1 103 ARG QB 1 103 ARG QD . . 3.250 2.151 2.045 2.366 . 0 0 "[ . 1 . 2]" 1
1537 1 103 ARG QB 1 104 ALA H . . 4.040 3.009 2.748 3.376 . 0 0 "[ . 1 . 2]" 1
1538 1 103 ARG HB2 1 104 ALA H . . 4.600 3.591 2.796 4.419 . 0 0 "[ . 1 . 2]" 1
1539 1 103 ARG HB3 1 104 ALA H . . 4.600 3.654 2.893 4.247 . 0 0 "[ . 1 . 2]" 1
1540 1 103 ARG QG 1 104 ALA H . . 4.500 3.937 3.456 4.491 . 0 0 "[ . 1 . 2]" 1
1541 1 104 ALA MB 1 105 THR H . . 3.740 3.211 2.662 3.309 . 0 0 "[ . 1 . 2]" 1
1542 1 104 ALA MB 1 106 VAL MG2 . . 4.100 3.254 2.876 3.453 . 0 0 "[ . 1 . 2]" 1
1543 1 105 THR H 1 105 THR HB . . 3.580 2.562 2.469 2.828 . 0 0 "[ . 1 . 2]" 1
1544 1 105 THR H 1 105 THR MG . . 4.290 3.811 3.777 3.933 . 0 0 "[ . 1 . 2]" 1
1545 1 105 THR HA 1 105 THR MG . . 3.430 2.317 2.205 2.435 . 0 0 "[ . 1 . 2]" 1
1546 1 105 THR HA 1 106 VAL H . . 3.030 2.171 2.142 2.240 . 0 0 "[ . 1 . 2]" 1
1547 1 105 THR HA 1 106 VAL MG2 . . 4.650 3.645 3.414 3.863 . 0 0 "[ . 1 . 2]" 1
1548 1 105 THR HB 1 106 VAL H . . 4.410 4.135 3.819 4.377 . 0 0 "[ . 1 . 2]" 1
1549 1 105 THR MG 1 106 VAL H . . 3.670 2.490 2.013 2.960 . 0 0 "[ . 1 . 2]" 1
1550 1 105 THR MG 1 106 VAL HA . . 5.500 3.768 3.494 3.987 . 0 0 "[ . 1 . 2]" 1
1551 1 106 VAL H 1 106 VAL HB . . 3.710 2.633 2.478 2.815 . 0 0 "[ . 1 . 2]" 1
1552 1 106 VAL H 1 106 VAL MG1 . . 4.300 3.842 3.777 3.903 . 0 0 "[ . 1 . 2]" 1
1553 1 106 VAL H 1 106 VAL MG2 . . 3.620 2.754 2.522 2.999 . 0 0 "[ . 1 . 2]" 1
1554 1 106 VAL HA 1 106 VAL MG1 . . 3.520 2.420 2.319 2.481 . 0 0 "[ . 1 . 2]" 1
1555 1 106 VAL HA 1 106 VAL MG2 . . 3.570 2.372 2.262 2.476 . 0 0 "[ . 1 . 2]" 1
1556 1 106 VAL HA 1 107 THR H . . 3.520 2.158 2.139 2.221 . 0 0 "[ . 1 . 2]" 1
1557 1 106 VAL HA 1 107 THR HB . . 4.870 4.776 4.619 4.888 0.018 7 0 "[ . 1 . 2]" 1
1558 1 106 VAL HB 1 107 THR H . . 4.600 4.303 3.975 4.438 . 0 0 "[ . 1 . 2]" 1
1559 1 106 VAL HB 1 108 ILE MD . . 5.140 3.744 3.169 4.188 . 0 0 "[ . 1 . 2]" 1
1560 1 106 VAL MG1 1 107 THR H . . 3.750 2.814 2.028 3.255 . 0 0 "[ . 1 . 2]" 1
1561 1 106 VAL MG1 1 108 ILE H . . 4.680 4.117 3.538 4.512 . 0 0 "[ . 1 . 2]" 1
1562 1 106 VAL MG1 1 108 ILE HA . . 4.620 4.077 3.806 4.407 . 0 0 "[ . 1 . 2]" 1
1563 1 106 VAL MG1 1 108 ILE MD . . 3.670 2.945 2.493 3.227 . 0 0 "[ . 1 . 2]" 1
1564 1 106 VAL MG1 1 108 ILE HG12 . . 3.840 3.033 2.665 3.456 . 0 0 "[ . 1 . 2]" 1
1565 1 106 VAL MG1 1 108 ILE QG . . 3.340 2.358 1.977 2.534 . 0 0 "[ . 1 . 2]" 1
1566 1 106 VAL MG1 1 108 ILE HG13 . . 3.840 2.465 2.027 2.736 . 0 0 "[ . 1 . 2]" 1
1567 1 106 VAL MG2 1 107 THR H . . 4.360 4.094 3.891 4.204 . 0 0 "[ . 1 . 2]" 1
1568 1 107 THR H 1 107 THR HB . . 3.540 2.663 2.526 2.774 . 0 0 "[ . 1 . 2]" 1
1569 1 107 THR H 1 107 THR MG . . 4.240 3.808 3.754 3.865 . 0 0 "[ . 1 . 2]" 1
1570 1 107 THR MG 1 108 ILE H . . 3.730 2.700 2.272 3.268 . 0 0 "[ . 1 . 2]" 1
1571 1 107 THR MG 1 109 ASN H . . 5.360 4.052 3.671 4.717 . 0 0 "[ . 1 . 2]" 1
1572 1 107 THR MG 1 109 ASN HD21 . . 4.570 3.265 2.320 4.383 . 0 0 "[ . 1 . 2]" 1
1573 1 107 THR MG 1 109 ASN QD . . 3.790 2.542 1.843 3.411 . 0 0 "[ . 1 . 2]" 1
1574 1 107 THR MG 1 109 ASN HD22 . . 4.570 2.660 1.880 3.557 . 0 0 "[ . 1 . 2]" 1
1575 1 108 ILE H 1 108 ILE HB . . 3.710 2.628 2.544 2.800 . 0 0 "[ . 1 . 2]" 1
1576 1 108 ILE H 1 108 ILE MD . . 4.430 3.627 3.412 3.816 . 0 0 "[ . 1 . 2]" 1
1577 1 108 ILE H 1 108 ILE HG12 . . 4.570 4.016 3.704 4.205 . 0 0 "[ . 1 . 2]" 1
1578 1 108 ILE H 1 108 ILE QG . . 3.850 2.622 2.376 2.833 . 0 0 "[ . 1 . 2]" 1
1579 1 108 ILE H 1 108 ILE HG13 . . 4.570 2.657 2.405 2.880 . 0 0 "[ . 1 . 2]" 1
1580 1 108 ILE H 1 108 ILE MG . . 4.520 3.843 3.807 3.920 . 0 0 "[ . 1 . 2]" 1
1581 1 108 ILE H 1 109 ASN H . . 5.270 4.220 3.976 4.456 . 0 0 "[ . 1 . 2]" 1
1582 1 108 ILE HA 1 108 ILE MD . . 4.410 3.897 3.863 3.929 . 0 0 "[ . 1 . 2]" 1
1583 1 108 ILE HA 1 108 ILE HG12 . . 4.090 2.762 2.658 2.851 . 0 0 "[ . 1 . 2]" 1
1584 1 108 ILE HA 1 108 ILE HG13 . . 4.090 2.822 2.694 3.026 . 0 0 "[ . 1 . 2]" 1
1585 1 108 ILE HA 1 108 ILE MG . . 3.430 2.381 2.291 2.439 . 0 0 "[ . 1 . 2]" 1
1586 1 108 ILE HA 1 109 ASN H . . 3.050 2.158 2.139 2.183 . 0 0 "[ . 1 . 2]" 1
1587 1 108 ILE HB 1 108 ILE MD . . 3.410 2.221 2.120 2.419 . 0 0 "[ . 1 . 2]" 1
1588 1 108 ILE MD 1 108 ILE MG . . 3.030 2.283 1.966 2.423 . 0 0 "[ . 1 . 2]" 1
1589 1 108 ILE QG 1 108 ILE MG . . 2.940 2.178 2.060 2.263 . 0 0 "[ . 1 . 2]" 1
1590 1 108 ILE QG 1 109 ASN H . . 5.020 4.290 4.022 4.410 . 0 0 "[ . 1 . 2]" 1
1591 1 108 ILE HG12 1 108 ILE MG . . 3.380 2.220 2.088 2.315 . 0 0 "[ . 1 . 2]" 1
1592 1 108 ILE HG13 1 108 ILE MG . . 3.380 3.166 3.134 3.196 . 0 0 "[ . 1 . 2]" 1
1593 1 108 ILE MG 1 109 ASN H . . 3.790 2.975 2.497 3.239 . 0 0 "[ . 1 . 2]" 1
1594 1 109 ASN H 1 109 ASN HB2 . . 3.960 2.342 2.207 2.743 . 0 0 "[ . 1 . 2]" 1
1595 1 109 ASN H 1 109 ASN QB . . 3.410 2.311 2.185 2.667 . 0 0 "[ . 1 . 2]" 1
1596 1 109 ASN H 1 109 ASN HB3 . . 3.960 3.578 3.495 3.729 . 0 0 "[ . 1 . 2]" 1
1597 1 109 ASN H 1 109 ASN QD . . 3.880 2.749 2.032 3.717 . 0 0 "[ . 1 . 2]" 1
1598 1 109 ASN HA 1 110 VAL H . . 2.970 2.188 2.140 2.300 . 0 0 "[ . 1 . 2]" 1
1599 1 109 ASN QB 1 110 VAL H . . 3.960 3.093 2.675 3.442 . 0 0 "[ . 1 . 2]" 1
1600 1 109 ASN QB 1 111 THR H . . 5.340 4.773 4.231 5.081 . 0 0 "[ . 1 . 2]" 1
1601 1 109 ASN HB2 1 110 VAL H . . 4.580 4.220 3.623 4.475 . 0 0 "[ . 1 . 2]" 1
1602 1 109 ASN HB2 1 111 THR MG . . 4.180 4.012 3.578 4.167 . 0 0 "[ . 1 . 2]" 1
1603 1 109 ASN HB3 1 110 VAL H . . 4.580 3.184 2.723 3.577 . 0 0 "[ . 1 . 2]" 1
1604 1 109 ASN HB3 1 111 THR MG . . 4.180 3.481 3.050 4.170 . 0 0 "[ . 1 . 2]" 1
1605 1 110 VAL H 1 110 VAL HB . . 3.410 2.549 2.434 2.695 . 0 0 "[ . 1 . 2]" 1
1606 1 110 VAL H 1 110 VAL MG1 . . 4.090 3.804 3.755 3.879 . 0 0 "[ . 1 . 2]" 1
1607 1 110 VAL H 1 110 VAL MG2 . . 3.480 2.549 2.069 2.915 . 0 0 "[ . 1 . 2]" 1
1608 1 110 VAL HA 1 110 VAL MG1 . . 3.460 2.360 2.217 2.456 . 0 0 "[ . 1 . 2]" 1
1609 1 110 VAL HA 1 110 VAL MG2 . . 3.460 2.362 2.210 2.526 . 0 0 "[ . 1 . 2]" 1
1610 1 110 VAL HA 1 111 THR H . . 2.980 2.147 2.139 2.190 . 0 0 "[ . 1 . 2]" 1
1611 1 110 VAL HA 1 111 THR MG . . 4.240 3.654 3.356 4.064 . 0 0 "[ . 1 . 2]" 1
1612 1 110 VAL HB 1 111 THR H . . 5.220 4.280 4.085 4.468 . 0 0 "[ . 1 . 2]" 1
1613 1 110 VAL MG1 1 111 THR H . . 3.650 2.720 2.324 3.275 . 0 0 "[ . 1 . 2]" 1
1614 1 110 VAL MG1 1 111 THR HA . . 5.270 3.860 3.627 4.119 . 0 0 "[ . 1 . 2]" 1
1615 1 110 VAL MG1 1 112 ASP HA . . 5.200 4.414 4.192 4.926 . 0 0 "[ . 1 . 2]" 1
1616 1 110 VAL MG2 1 111 THR H . . 4.320 4.096 3.977 4.193 . 0 0 "[ . 1 . 2]" 1
1617 1 111 THR H 1 111 THR MG . . 3.300 2.488 1.874 2.860 . 0 0 "[ . 1 . 2]" 1
1618 1 111 THR HA 1 111 THR MG . . 3.320 2.452 2.200 3.125 . 0 0 "[ . 1 . 2]" 1
1619 1 111 THR HA 1 112 ASP H . . 3.170 2.410 2.235 2.537 . 0 0 "[ . 1 . 2]" 1
1620 1 111 THR HB 1 112 ASP H . . 3.260 2.486 2.118 3.283 0.023 6 0 "[ . 1 . 2]" 1
1621 1 111 THR MG 1 112 ASP H . . 3.950 3.791 3.550 3.935 . 0 0 "[ . 1 . 2]" 1
1622 1 112 ASP H 1 112 ASP HB2 . . 3.710 2.743 2.250 3.668 . 0 0 "[ . 1 . 2]" 1
1623 1 112 ASP H 1 112 ASP QB . . 3.220 2.473 2.170 2.861 . 0 0 "[ . 1 . 2]" 1
1624 1 112 ASP H 1 112 ASP HB3 . . 3.710 3.164 2.401 3.703 . 0 0 "[ . 1 . 2]" 1
1625 1 112 ASP HA 1 113 VAL H . . 3.310 2.449 2.235 2.629 . 0 0 "[ . 1 . 2]" 1
1626 1 112 ASP HA 1 113 VAL MG1 . . 5.360 3.854 3.407 5.240 . 0 0 "[ . 1 . 2]" 1
1627 1 112 ASP HA 1 113 VAL QG . . 4.120 3.222 3.025 3.988 . 0 0 "[ . 1 . 2]" 1
1628 1 112 ASP HA 1 113 VAL MG2 . . 5.360 3.570 3.076 5.368 0.008 17 0 "[ . 1 . 2]" 1
1629 1 112 ASP QB 1 113 VAL H . . 3.440 2.585 1.955 3.375 . 0 0 "[ . 1 . 2]" 1
1630 1 112 ASP QB 1 113 VAL HA . . 5.320 4.206 3.917 4.591 . 0 0 "[ . 1 . 2]" 1
1631 1 112 ASP HB2 1 113 VAL H . . 4.080 3.347 1.969 3.956 . 0 0 "[ . 1 . 2]" 1
1632 1 112 ASP HB3 1 113 VAL H . . 4.080 2.940 1.992 3.973 . 0 0 "[ . 1 . 2]" 1
1633 1 113 VAL H 1 113 VAL HB . . 3.900 3.659 2.705 3.900 . 0 0 "[ . 1 . 2]" 1
1634 1 113 VAL H 1 113 VAL MG1 . . 3.890 3.154 2.208 3.884 . 0 0 "[ . 1 . 2]" 1
1635 1 113 VAL H 1 113 VAL QG . . 3.140 2.028 1.871 2.308 . 0 0 "[ . 1 . 2]" 1
1636 1 113 VAL H 1 113 VAL MG2 . . 3.890 2.134 1.885 3.843 . 0 0 "[ . 1 . 2]" 1
1637 1 113 VAL H 1 114 ASN H . . 4.210 3.064 1.841 4.210 0.000 9 0 "[ . 1 . 2]" 1
1638 1 113 VAL HA 1 113 VAL QG . . 3.110 2.137 1.962 2.303 . 0 0 "[ . 1 . 2]" 1
1639 1 113 VAL HA 1 114 ASN H . . 3.500 2.801 2.141 3.539 0.039 6 0 "[ . 1 . 2]" 1
1640 1 113 VAL HB 1 114 ASN H . . 3.990 3.601 2.644 3.986 . 0 0 "[ . 1 . 2]" 1
1641 1 113 VAL QG 1 114 ASN H . . 3.970 2.964 1.906 3.627 . 0 0 "[ . 1 . 2]" 1
1642 1 113 VAL MG1 1 114 ASN H . . 4.630 3.875 2.333 4.311 . 0 0 "[ . 1 . 2]" 1
1643 1 113 VAL MG2 1 114 ASN H . . 4.630 3.393 1.910 4.289 . 0 0 "[ . 1 . 2]" 1
1644 1 114 ASN H 1 114 ASN HB2 . . 4.210 2.945 2.378 3.682 . 0 0 "[ . 1 . 2]" 1
1645 1 114 ASN H 1 114 ASN QB . . 3.480 2.425 2.191 2.783 . 0 0 "[ . 1 . 2]" 1
1646 1 114 ASN H 1 114 ASN HB3 . . 4.210 2.920 2.233 3.756 . 0 0 "[ . 1 . 2]" 1
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