NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
416003 |
2di9   |
10320 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2di9
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 2013
_Distance_constraint_stats_list.Viol_count 630
_Distance_constraint_stats_list.Viol_total 131.500
_Distance_constraint_stats_list.Viol_max 0.127
_Distance_constraint_stats_list.Viol_rms 0.0026
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0104
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 6 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ASP 0.010 0.010 7 0 "[ . 1 . 2]"
1 9 VAL 0.010 0.010 7 0 "[ . 1 . 2]"
1 10 THR 0.160 0.098 18 0 "[ . 1 . 2]"
1 11 TYR 0.238 0.098 18 0 "[ . 1 . 2]"
1 12 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 GLY 0.001 0.001 1 0 "[ . 1 . 2]"
1 14 HIS 0.001 0.001 1 0 "[ . 1 . 2]"
1 15 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 VAL 0.024 0.024 16 0 "[ . 1 . 2]"
1 17 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 TYR 0.204 0.064 9 0 "[ . 1 . 2]"
1 22 THR 0.145 0.050 4 0 "[ . 1 . 2]"
1 23 VAL 0.189 0.041 7 0 "[ . 1 . 2]"
1 24 GLU 0.318 0.084 14 0 "[ . 1 . 2]"
1 25 ALA 0.042 0.042 3 0 "[ . 1 . 2]"
1 26 SER 0.058 0.014 8 0 "[ . 1 . 2]"
1 27 LEU 0.060 0.014 8 0 "[ . 1 . 2]"
1 28 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 PRO 0.117 0.021 10 0 "[ . 1 . 2]"
1 30 ASP 0.011 0.011 10 0 "[ . 1 . 2]"
1 31 PRO 0.036 0.023 10 0 "[ . 1 . 2]"
1 32 SER 0.029 0.011 10 0 "[ . 1 . 2]"
1 33 LYS 0.128 0.014 18 0 "[ . 1 . 2]"
1 34 VAL 0.106 0.017 12 0 "[ . 1 . 2]"
1 35 LYS 0.067 0.019 10 0 "[ . 1 . 2]"
1 36 ALA 0.003 0.003 10 0 "[ . 1 . 2]"
1 37 HIS 0.014 0.005 10 0 "[ . 1 . 2]"
1 38 GLY 0.004 0.004 17 0 "[ . 1 . 2]"
1 39 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 LEU 0.028 0.014 4 0 "[ . 1 . 2]"
1 42 GLU 0.002 0.002 2 0 "[ . 1 . 2]"
1 43 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 GLY 0.001 0.001 15 0 "[ . 1 . 2]"
1 45 LEU 0.044 0.009 17 0 "[ . 1 . 2]"
1 46 VAL 0.027 0.009 17 0 "[ . 1 . 2]"
1 47 GLY 0.022 0.006 19 0 "[ . 1 . 2]"
1 48 LYS 0.034 0.018 6 0 "[ . 1 . 2]"
1 49 PRO 0.010 0.004 16 0 "[ . 1 . 2]"
1 50 ALA 0.035 0.010 10 0 "[ . 1 . 2]"
1 51 GLU 0.008 0.006 5 0 "[ . 1 . 2]"
1 52 PHE 0.019 0.014 4 0 "[ . 1 . 2]"
1 53 THR 0.009 0.004 16 0 "[ . 1 . 2]"
1 54 ILE 0.029 0.008 4 0 "[ . 1 . 2]"
1 55 ASP 0.028 0.019 10 0 "[ . 1 . 2]"
1 56 THR 0.021 0.013 10 0 "[ . 1 . 2]"
1 57 LYS 0.214 0.107 6 0 "[ . 1 . 2]"
1 58 GLY 0.020 0.013 1 0 "[ . 1 . 2]"
1 59 ALA 0.065 0.008 1 0 "[ . 1 . 2]"
1 60 GLY 0.040 0.013 10 0 "[ . 1 . 2]"
1 61 THR 0.064 0.021 10 0 "[ . 1 . 2]"
1 62 GLY 0.006 0.006 12 0 "[ . 1 . 2]"
1 63 GLY 0.040 0.009 4 0 "[ . 1 . 2]"
1 64 LEU 0.038 0.009 9 0 "[ . 1 . 2]"
1 65 GLY 0.057 0.011 4 0 "[ . 1 . 2]"
1 66 LEU 0.214 0.087 12 0 "[ . 1 . 2]"
1 67 THR 0.034 0.011 17 0 "[ . 1 . 2]"
1 68 VAL 0.010 0.005 19 0 "[ . 1 . 2]"
1 69 GLU 0.322 0.068 7 0 "[ . 1 . 2]"
1 70 GLY 0.302 0.068 7 0 "[ . 1 . 2]"
1 71 PRO 0.177 0.035 12 0 "[ . 1 . 2]"
1 72 CYS 0.637 0.098 15 0 "[ . 1 . 2]"
1 73 GLU 0.028 0.015 17 0 "[ . 1 . 2]"
1 74 ALA 0.003 0.001 1 0 "[ . 1 . 2]"
1 75 LYS 0.021 0.012 13 0 "[ . 1 . 2]"
1 76 ILE 0.026 0.013 9 0 "[ . 1 . 2]"
1 77 GLU 0.043 0.017 16 0 "[ . 1 . 2]"
1 78 CYS 0.044 0.012 15 0 "[ . 1 . 2]"
1 79 SER 0.270 0.086 15 0 "[ . 1 . 2]"
1 80 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 GLY 0.003 0.003 9 0 "[ . 1 . 2]"
1 83 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 THR 0.012 0.008 4 0 "[ . 1 . 2]"
1 86 CYS 0.022 0.005 12 0 "[ . 1 . 2]"
1 87 SER 0.450 0.050 8 0 "[ . 1 . 2]"
1 88 VAL 0.421 0.050 8 0 "[ . 1 . 2]"
1 89 SER 0.029 0.010 10 0 "[ . 1 . 2]"
1 90 TYR 1.124 0.065 17 0 "[ . 1 . 2]"
1 91 LEU 1.142 0.065 17 0 "[ . 1 . 2]"
1 92 PRO 0.040 0.018 6 0 "[ . 1 . 2]"
1 93 THR 0.009 0.006 19 0 "[ . 1 . 2]"
1 94 LYS 0.559 0.127 19 0 "[ . 1 . 2]"
1 95 PRO 0.014 0.007 9 0 "[ . 1 . 2]"
1 96 GLY 0.043 0.023 9 0 "[ . 1 . 2]"
1 97 GLU 0.067 0.023 9 0 "[ . 1 . 2]"
1 98 TYR 0.036 0.008 13 0 "[ . 1 . 2]"
1 99 PHE 0.014 0.009 19 0 "[ . 1 . 2]"
1 100 VAL 0.286 0.087 12 0 "[ . 1 . 2]"
1 101 ASN 0.091 0.011 9 0 "[ . 1 . 2]"
1 102 ILE 0.048 0.011 16 0 "[ . 1 . 2]"
1 103 LEU 0.187 0.038 9 0 "[ . 1 . 2]"
1 104 PHE 0.091 0.023 10 0 "[ . 1 . 2]"
1 105 GLU 0.172 0.019 16 0 "[ . 1 . 2]"
1 106 GLU 0.153 0.019 16 0 "[ . 1 . 2]"
1 107 VAL 0.149 0.038 9 0 "[ . 1 . 2]"
1 108 HIS 0.144 0.016 19 0 "[ . 1 . 2]"
1 109 ILE 0.098 0.010 16 0 "[ . 1 . 2]"
1 110 PRO 0.016 0.009 19 0 "[ . 1 . 2]"
1 111 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 SER 0.199 0.016 19 0 "[ . 1 . 2]"
1 113 PRO 0.078 0.011 17 0 "[ . 1 . 2]"
1 114 PHE 0.222 0.015 19 0 "[ . 1 . 2]"
1 115 LYS 0.287 0.027 2 0 "[ . 1 . 2]"
1 116 ALA 0.244 0.027 2 0 "[ . 1 . 2]"
1 117 ASP 0.010 0.003 15 0 "[ . 1 . 2]"
1 118 ILE 0.028 0.006 4 0 "[ . 1 . 2]"
1 119 GLU 0.005 0.003 4 0 "[ . 1 . 2]"
1 120 MET 0.017 0.007 9 0 "[ . 1 . 2]"
1 121 PRO 0.020 0.006 4 0 "[ . 1 . 2]"
1 122 PHE 0.012 0.005 10 0 "[ . 1 . 2]"
1 123 ASP 0.004 0.004 20 0 "[ . 1 . 2]"
1 124 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 128 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 129 SER 0.003 0.003 16 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 6 SER QB 1 7 GLY H . . 4.920 2.795 2.210 3.746 . 0 0 "[ . 1 . 2]" 1
2 1 8 ASP H 1 9 VAL HA . . 4.680 4.588 4.424 4.678 . 0 0 "[ . 1 . 2]" 1
3 1 8 ASP HA 1 9 VAL H . . 2.980 2.294 2.140 2.833 . 0 0 "[ . 1 . 2]" 1
4 1 8 ASP QB 1 9 VAL H . . 3.990 3.211 2.107 4.000 0.010 7 0 "[ . 1 . 2]" 1
5 1 8 ASP HB2 1 9 VAL H . . 4.760 3.680 2.121 4.526 . 0 0 "[ . 1 . 2]" 1
6 1 8 ASP HB3 1 9 VAL H . . 4.760 3.858 2.679 4.670 . 0 0 "[ . 1 . 2]" 1
7 1 9 VAL H 1 9 VAL HB . . 3.700 2.928 2.423 3.699 . 0 0 "[ . 1 . 2]" 1
8 1 9 VAL H 1 9 VAL MG1 . . 4.060 2.815 1.885 3.885 . 0 0 "[ . 1 . 2]" 1
9 1 9 VAL H 1 9 VAL QG . . 3.300 2.221 1.881 2.916 . 0 0 "[ . 1 . 2]" 1
10 1 9 VAL H 1 9 VAL MG2 . . 4.060 3.063 2.014 3.918 . 0 0 "[ . 1 . 2]" 1
11 1 9 VAL HA 1 10 THR H . . 3.070 2.223 2.140 2.748 . 0 0 "[ . 1 . 2]" 1
12 1 9 VAL HB 1 10 THR H . . 4.270 3.995 2.742 4.266 . 0 0 "[ . 1 . 2]" 1
13 1 9 VAL QG 1 10 THR H . . 4.310 2.531 1.938 3.725 . 0 0 "[ . 1 . 2]" 1
14 1 10 THR H 1 10 THR MG . . 4.070 3.053 2.064 3.991 . 0 0 "[ . 1 . 2]" 1
15 1 10 THR HA 1 10 THR MG . . 3.340 2.442 2.188 3.203 . 0 0 "[ . 1 . 2]" 1
16 1 10 THR HA 1 11 TYR H . . 3.250 2.318 2.146 3.348 0.098 18 0 "[ . 1 . 2]" 1
17 1 10 THR HB 1 11 TYR H . . 3.980 3.393 2.219 4.042 0.062 18 0 "[ . 1 . 2]" 1
18 1 10 THR MG 1 11 TYR H . . 5.030 3.143 1.883 4.149 . 0 0 "[ . 1 . 2]" 1
19 1 11 TYR H 1 11 TYR HB2 . . 4.090 3.311 2.339 4.040 . 0 0 "[ . 1 . 2]" 1
20 1 11 TYR H 1 11 TYR QB . . 3.510 2.746 2.233 3.315 . 0 0 "[ . 1 . 2]" 1
21 1 11 TYR H 1 11 TYR HB3 . . 4.090 3.106 2.284 4.068 . 0 0 "[ . 1 . 2]" 1
22 1 11 TYR H 1 11 TYR QD . . 4.530 3.425 2.077 4.509 . 0 0 "[ . 1 . 2]" 1
23 1 11 TYR HA 1 11 TYR QD . . 3.700 3.082 2.202 3.734 0.034 4 0 "[ . 1 . 2]" 1
24 1 11 TYR HA 1 12 ASP H . . 3.370 2.286 2.137 2.678 . 0 0 "[ . 1 . 2]" 1
25 1 12 ASP H 1 12 ASP QB . . 3.820 2.850 2.246 3.403 . 0 0 "[ . 1 . 2]" 1
26 1 12 ASP H 1 13 GLY H . . 4.270 3.737 2.061 4.264 . 0 0 "[ . 1 . 2]" 1
27 1 12 ASP QB 1 13 GLY H . . 4.700 3.264 2.336 3.910 . 0 0 "[ . 1 . 2]" 1
28 1 13 GLY H 1 14 HIS H . . 4.420 3.846 2.553 4.421 0.001 1 0 "[ . 1 . 2]" 1
29 1 14 HIS H 1 14 HIS QB . . 3.580 2.675 2.225 3.276 . 0 0 "[ . 1 . 2]" 1
30 1 14 HIS HA 1 15 PRO HD2 . . 3.440 2.267 2.089 2.415 . 0 0 "[ . 1 . 2]" 1
31 1 14 HIS HA 1 15 PRO QD . . 2.900 2.018 1.928 2.098 . 0 0 "[ . 1 . 2]" 1
32 1 14 HIS HA 1 15 PRO HD3 . . 3.440 2.266 2.252 2.304 . 0 0 "[ . 1 . 2]" 1
33 1 14 HIS QB 1 15 PRO QD . . 3.400 2.373 2.087 3.364 . 0 0 "[ . 1 . 2]" 1
34 1 14 HIS HB2 1 15 PRO HD2 . . 4.920 3.068 2.160 4.038 . 0 0 "[ . 1 . 2]" 1
35 1 14 HIS HB2 1 15 PRO HD3 . . 4.920 4.249 3.545 4.911 . 0 0 "[ . 1 . 2]" 1
36 1 14 HIS HB3 1 15 PRO HD2 . . 4.920 2.974 2.118 3.863 . 0 0 "[ . 1 . 2]" 1
37 1 14 HIS HB3 1 15 PRO HD3 . . 4.920 4.122 3.550 4.807 . 0 0 "[ . 1 . 2]" 1
38 1 15 PRO HA 1 16 VAL H . . 2.680 2.256 2.151 2.673 . 0 0 "[ . 1 . 2]" 1
39 1 15 PRO QB 1 16 VAL H . . 3.820 3.118 1.983 3.676 . 0 0 "[ . 1 . 2]" 1
40 1 15 PRO HB2 1 16 VAL H . . 4.360 3.307 2.003 3.979 . 0 0 "[ . 1 . 2]" 1
41 1 15 PRO HB3 1 16 VAL H . . 4.360 3.881 3.183 4.322 . 0 0 "[ . 1 . 2]" 1
42 1 16 VAL H 1 16 VAL HB . . 3.670 3.630 3.605 3.694 0.024 16 0 "[ . 1 . 2]" 1
43 1 16 VAL H 1 16 VAL MG1 . . 3.720 2.321 2.013 2.598 . 0 0 "[ . 1 . 2]" 1
44 1 16 VAL H 1 16 VAL MG2 . . 3.720 2.139 1.913 2.326 . 0 0 "[ . 1 . 2]" 1
45 1 16 VAL H 1 17 PRO QD . . 4.830 4.339 4.270 4.375 . 0 0 "[ . 1 . 2]" 1
46 1 16 VAL HA 1 16 VAL MG1 . . 3.320 2.306 2.168 2.431 . 0 0 "[ . 1 . 2]" 1
47 1 16 VAL HA 1 16 VAL MG2 . . 3.320 3.194 3.179 3.203 . 0 0 "[ . 1 . 2]" 1
48 1 16 VAL HA 1 17 PRO HD2 . . 3.200 2.277 2.246 2.370 . 0 0 "[ . 1 . 2]" 1
49 1 16 VAL HA 1 17 PRO QD . . 2.710 2.022 2.006 2.073 . 0 0 "[ . 1 . 2]" 1
50 1 16 VAL HA 1 17 PRO HD3 . . 3.200 2.264 2.258 2.288 . 0 0 "[ . 1 . 2]" 1
51 1 16 VAL HA 1 17 PRO QG . . 4.800 3.927 3.910 3.983 . 0 0 "[ . 1 . 2]" 1
52 1 16 VAL HB 1 17 PRO HD2 . . 3.880 2.220 2.001 2.341 . 0 0 "[ . 1 . 2]" 1
53 1 16 VAL HB 1 17 PRO QD . . 3.140 2.202 1.989 2.318 . 0 0 "[ . 1 . 2]" 1
54 1 16 VAL HB 1 17 PRO HD3 . . 3.880 3.640 3.450 3.740 . 0 0 "[ . 1 . 2]" 1
55 1 20 PRO HA 1 22 THR H . . 4.080 3.586 3.139 4.080 . 0 0 "[ . 1 . 2]" 1
56 1 20 PRO QB 1 21 TYR H . . 3.920 3.462 2.791 3.728 . 0 0 "[ . 1 . 2]" 1
57 1 20 PRO QD 1 21 TYR H . . 4.140 2.798 2.619 2.960 . 0 0 "[ . 1 . 2]" 1
58 1 20 PRO HD2 1 21 TYR H . . 4.980 2.862 2.666 3.043 . 0 0 "[ . 1 . 2]" 1
59 1 20 PRO HD3 1 21 TYR H . . 4.980 3.952 3.840 4.051 . 0 0 "[ . 1 . 2]" 1
60 1 20 PRO QG 1 21 TYR H . . 4.230 2.832 1.884 3.292 . 0 0 "[ . 1 . 2]" 1
61 1 21 TYR H 1 21 TYR HB2 . . 3.800 2.623 2.247 3.609 . 0 0 "[ . 1 . 2]" 1
62 1 21 TYR H 1 21 TYR QB . . 3.230 2.467 2.223 3.235 0.005 9 0 "[ . 1 . 2]" 1
63 1 21 TYR H 1 21 TYR HB3 . . 3.800 3.266 2.431 3.864 0.064 9 0 "[ . 1 . 2]" 1
64 1 21 TYR H 1 21 TYR QD . . 4.390 3.506 2.076 4.333 . 0 0 "[ . 1 . 2]" 1
65 1 21 TYR HA 1 21 TYR QD . . 3.580 2.553 2.066 3.482 . 0 0 "[ . 1 . 2]" 1
66 1 21 TYR HA 1 22 THR H . . 3.170 2.827 2.601 3.171 0.001 8 0 "[ . 1 . 2]" 1
67 1 21 TYR HB2 1 22 THR H . . 4.520 4.397 3.888 4.559 0.039 16 0 "[ . 1 . 2]" 1
68 1 21 TYR HB3 1 22 THR H . . 4.520 4.266 3.751 4.570 0.050 4 0 "[ . 1 . 2]" 1
69 1 21 TYR QD 1 22 THR H . . 5.070 4.753 3.184 4.945 . 0 0 "[ . 1 . 2]" 1
70 1 22 THR H 1 22 THR HB . . 3.830 3.343 2.446 3.835 0.005 18 0 "[ . 1 . 2]" 1
71 1 22 THR H 1 22 THR MG . . 4.190 3.102 2.152 4.025 . 0 0 "[ . 1 . 2]" 1
72 1 22 THR HA 1 22 THR MG . . 3.560 2.399 2.102 3.205 . 0 0 "[ . 1 . 2]" 1
73 1 22 THR HA 1 23 VAL H . . 2.720 2.241 2.143 2.351 . 0 0 "[ . 1 . 2]" 1
74 1 22 THR HB 1 23 VAL H . . 3.950 3.424 2.749 3.891 . 0 0 "[ . 1 . 2]" 1
75 1 22 THR MG 1 23 VAL H . . 3.990 3.218 1.904 3.995 0.005 5 0 "[ . 1 . 2]" 1
76 1 23 VAL H 1 23 VAL HB . . 3.630 3.243 2.499 3.638 0.008 11 0 "[ . 1 . 2]" 1
77 1 23 VAL H 1 23 VAL MG1 . . 4.590 2.947 2.149 3.896 . 0 0 "[ . 1 . 2]" 1
78 1 23 VAL H 1 23 VAL QG . . 3.950 2.078 1.809 2.806 . 0 0 "[ . 1 . 2]" 1
79 1 23 VAL H 1 23 VAL MG2 . . 4.590 2.223 1.833 3.926 . 0 0 "[ . 1 . 2]" 1
80 1 23 VAL H 1 24 GLU H . . 4.520 3.867 2.591 4.531 0.011 11 0 "[ . 1 . 2]" 1
81 1 23 VAL HA 1 24 GLU H . . 3.190 2.506 2.141 3.231 0.041 7 0 "[ . 1 . 2]" 1
82 1 23 VAL HA 1 25 ALA H . . 4.230 3.717 2.912 4.228 . 0 0 "[ . 1 . 2]" 1
83 1 23 VAL HB 1 24 GLU H . . 4.180 3.806 1.981 4.217 0.037 7 0 "[ . 1 . 2]" 1
84 1 23 VAL HB 1 25 ALA H . . 4.920 3.797 2.878 4.798 . 0 0 "[ . 1 . 2]" 1
85 1 23 VAL QG 1 24 GLU H . . 4.200 3.149 2.040 3.749 . 0 0 "[ . 1 . 2]" 1
86 1 23 VAL MG1 1 24 GLU H . . 4.950 3.705 2.047 4.395 . 0 0 "[ . 1 . 2]" 1
87 1 23 VAL MG2 1 24 GLU H . . 4.950 3.754 2.272 4.269 . 0 0 "[ . 1 . 2]" 1
88 1 24 GLU H 1 24 GLU QB . . 3.140 2.520 2.130 3.013 . 0 0 "[ . 1 . 2]" 1
89 1 24 GLU H 1 24 GLU QG . . 3.770 2.863 1.973 3.854 0.084 14 0 "[ . 1 . 2]" 1
90 1 24 GLU HA 1 24 GLU QG . . 3.630 2.816 2.228 3.445 . 0 0 "[ . 1 . 2]" 1
91 1 24 GLU HA 1 25 ALA H . . 3.310 2.823 2.543 3.352 0.042 3 0 "[ . 1 . 2]" 1
92 1 24 GLU HA 1 27 LEU MD1 . . 5.490 3.699 1.903 4.734 . 0 0 "[ . 1 . 2]" 1
93 1 24 GLU HA 1 27 LEU MD2 . . 5.450 4.216 2.669 5.199 . 0 0 "[ . 1 . 2]" 1
94 1 24 GLU HA 1 27 LEU HG . . 4.440 3.968 2.104 4.440 . 0 0 "[ . 1 . 2]" 1
95 1 24 GLU QB 1 25 ALA H . . 4.450 3.871 3.209 4.047 . 0 0 "[ . 1 . 2]" 1
96 1 24 GLU QG 1 25 ALA H . . 4.810 4.299 3.679 4.774 . 0 0 "[ . 1 . 2]" 1
97 1 25 ALA H 1 25 ALA MB . . 3.000 2.312 2.132 2.471 . 0 0 "[ . 1 . 2]" 1
98 1 25 ALA HA 1 26 SER H . . 3.170 2.772 2.172 3.171 0.001 7 0 "[ . 1 . 2]" 1
99 1 25 ALA MB 1 26 SER H . . 3.800 3.384 1.983 3.682 . 0 0 "[ . 1 . 2]" 1
100 1 26 SER H 1 26 SER QB . . 3.450 2.733 2.237 3.309 . 0 0 "[ . 1 . 2]" 1
101 1 26 SER H 1 27 LEU HG . . 4.540 3.462 2.712 4.503 . 0 0 "[ . 1 . 2]" 1
102 1 26 SER HA 1 27 LEU H . . 2.720 2.434 2.144 2.688 . 0 0 "[ . 1 . 2]" 1
103 1 26 SER HA 1 27 LEU QB . . 4.840 4.669 4.372 4.845 0.005 8 0 "[ . 1 . 2]" 1
104 1 26 SER QB 1 27 LEU H . . 3.940 3.889 3.603 3.954 0.014 8 0 "[ . 1 . 2]" 1
105 1 27 LEU H 1 27 LEU QB . . 2.910 2.576 2.322 2.820 . 0 0 "[ . 1 . 2]" 1
106 1 27 LEU H 1 27 LEU MD1 . . 4.360 3.873 3.145 4.304 . 0 0 "[ . 1 . 2]" 1
107 1 27 LEU H 1 27 LEU MD2 . . 4.780 4.006 3.492 4.308 . 0 0 "[ . 1 . 2]" 1
108 1 27 LEU H 1 27 LEU HG . . 3.300 3.010 1.998 3.298 . 0 0 "[ . 1 . 2]" 1
109 1 27 LEU H 1 28 PRO QD . . 5.280 4.311 4.213 4.369 . 0 0 "[ . 1 . 2]" 1
110 1 27 LEU H 1 60 GLY QA . . 5.340 4.256 3.786 4.683 . 0 0 "[ . 1 . 2]" 1
111 1 27 LEU HA 1 27 LEU MD1 . . 4.010 3.900 3.847 3.954 . 0 0 "[ . 1 . 2]" 1
112 1 27 LEU HA 1 27 LEU MD2 . . 3.250 2.234 1.982 2.579 . 0 0 "[ . 1 . 2]" 1
113 1 27 LEU HA 1 27 LEU HG . . 4.040 2.938 2.776 3.190 . 0 0 "[ . 1 . 2]" 1
114 1 27 LEU HA 1 28 PRO HD2 . . 3.500 2.271 2.203 2.404 . 0 0 "[ . 1 . 2]" 1
115 1 27 LEU HA 1 28 PRO QD . . 3.040 2.020 1.984 2.092 . 0 0 "[ . 1 . 2]" 1
116 1 27 LEU HA 1 28 PRO HD3 . . 3.500 2.264 2.253 2.301 . 0 0 "[ . 1 . 2]" 1
117 1 27 LEU HA 1 28 PRO QG . . 4.010 3.925 3.886 4.005 . 0 0 "[ . 1 . 2]" 1
118 1 27 LEU QB 1 27 LEU MD1 . . 2.880 2.042 1.939 2.091 . 0 0 "[ . 1 . 2]" 1
119 1 27 LEU QB 1 27 LEU MD2 . . 3.060 2.190 2.012 2.309 . 0 0 "[ . 1 . 2]" 1
120 1 27 LEU QB 1 28 PRO HD2 . . 3.880 2.279 2.065 2.417 . 0 0 "[ . 1 . 2]" 1
121 1 27 LEU QB 1 28 PRO QD . . 3.350 2.255 2.049 2.387 . 0 0 "[ . 1 . 2]" 1
122 1 27 LEU QB 1 28 PRO HD3 . . 3.880 3.583 3.422 3.687 . 0 0 "[ . 1 . 2]" 1
123 1 27 LEU QB 1 60 GLY H . . 4.790 4.548 4.061 4.792 0.002 7 0 "[ . 1 . 2]" 1
124 1 27 LEU QB 1 60 GLY HA2 . . 4.160 2.375 2.028 2.773 . 0 0 "[ . 1 . 2]" 1
125 1 27 LEU QB 1 60 GLY QA . . 3.590 2.284 2.003 2.495 . 0 0 "[ . 1 . 2]" 1
126 1 27 LEU QB 1 60 GLY HA3 . . 4.160 3.106 2.487 3.473 . 0 0 "[ . 1 . 2]" 1
127 1 27 LEU QB 1 61 THR H . . 4.280 3.906 3.527 4.276 . 0 0 "[ . 1 . 2]" 1
128 1 27 LEU MD1 1 60 GLY H . . 4.830 4.487 3.937 4.830 . 0 0 "[ . 1 . 2]" 1
129 1 27 LEU MD1 1 60 GLY HA2 . . 4.810 2.955 2.563 3.328 . 0 0 "[ . 1 . 2]" 1
130 1 27 LEU MD1 1 60 GLY HA3 . . 4.810 4.245 3.566 4.700 . 0 0 "[ . 1 . 2]" 1
131 1 27 LEU MD2 1 28 PRO HD2 . . 3.840 2.433 1.981 2.803 . 0 0 "[ . 1 . 2]" 1
132 1 27 LEU MD2 1 28 PRO QD . . 3.310 2.367 1.948 2.677 . 0 0 "[ . 1 . 2]" 1
133 1 27 LEU MD2 1 28 PRO HD3 . . 3.840 3.280 2.655 3.694 . 0 0 "[ . 1 . 2]" 1
134 1 27 LEU MD2 1 28 PRO QG . . 4.440 3.944 3.562 4.281 . 0 0 "[ . 1 . 2]" 1
135 1 28 PRO HA 1 29 PRO HD2 . . 3.580 2.248 2.151 2.345 . 0 0 "[ . 1 . 2]" 1
136 1 28 PRO HA 1 29 PRO QD . . 3.110 2.011 1.962 2.062 . 0 0 "[ . 1 . 2]" 1
137 1 28 PRO HA 1 29 PRO HD3 . . 3.580 2.268 2.262 2.288 . 0 0 "[ . 1 . 2]" 1
138 1 28 PRO HA 1 29 PRO QG . . 4.480 3.916 3.863 3.972 . 0 0 "[ . 1 . 2]" 1
139 1 28 PRO QB 1 29 PRO QD . . 3.160 2.510 2.339 2.686 . 0 0 "[ . 1 . 2]" 1
140 1 29 PRO HA 1 30 ASP H . . 3.170 2.175 2.150 2.228 . 0 0 "[ . 1 . 2]" 1
141 1 29 PRO HA 1 61 THR H . . 4.330 2.998 2.653 3.372 . 0 0 "[ . 1 . 2]" 1
142 1 29 PRO HA 1 104 PHE QE . . 4.780 2.188 1.993 2.464 . 0 0 "[ . 1 . 2]" 1
143 1 29 PRO QB 1 30 ASP H . . 3.820 3.462 3.010 3.715 . 0 0 "[ . 1 . 2]" 1
144 1 29 PRO QB 1 61 THR H . . 5.210 3.720 3.262 3.943 . 0 0 "[ . 1 . 2]" 1
145 1 29 PRO QB 1 62 GLY QA . . 4.650 2.993 2.521 3.295 . 0 0 "[ . 1 . 2]" 1
146 1 29 PRO QB 1 63 GLY H . . 5.260 4.494 4.091 4.756 . 0 0 "[ . 1 . 2]" 1
147 1 29 PRO QB 1 105 GLU HG3 . . 3.580 2.443 1.961 2.981 . 0 0 "[ . 1 . 2]" 1
148 1 29 PRO HB2 1 30 ASP H . . 4.360 3.718 3.166 4.026 . 0 0 "[ . 1 . 2]" 1
149 1 29 PRO HB2 1 104 PHE QE . . 4.160 2.921 2.116 3.417 . 0 0 "[ . 1 . 2]" 1
150 1 29 PRO HB2 1 105 GLU HG2 . . 4.640 4.291 3.745 4.647 0.007 4 0 "[ . 1 . 2]" 1
151 1 29 PRO HB3 1 30 ASP H . . 4.360 4.134 3.764 4.359 . 0 0 "[ . 1 . 2]" 1
152 1 29 PRO HB3 1 104 PHE QE . . 4.160 2.565 2.062 2.951 . 0 0 "[ . 1 . 2]" 1
153 1 29 PRO HB3 1 105 GLU HG2 . . 4.640 3.981 3.377 4.529 . 0 0 "[ . 1 . 2]" 1
154 1 29 PRO QD 1 61 THR H . . 4.410 3.902 3.465 4.086 . 0 0 "[ . 1 . 2]" 1
155 1 29 PRO QG 1 30 ASP H . . 5.130 4.700 4.496 4.753 . 0 0 "[ . 1 . 2]" 1
156 1 29 PRO QG 1 61 THR H . . 5.060 4.995 4.673 5.081 0.021 10 0 "[ . 1 . 2]" 1
157 1 29 PRO QG 1 63 GLY H . . 5.500 5.453 5.117 5.509 0.009 4 0 "[ . 1 . 2]" 1
158 1 29 PRO QG 1 104 PHE QE . . 4.630 4.318 3.833 4.636 0.006 9 0 "[ . 1 . 2]" 1
159 1 30 ASP H 1 30 ASP HB2 . . 3.970 2.597 2.321 3.125 . 0 0 "[ . 1 . 2]" 1
160 1 30 ASP H 1 30 ASP QB . . 3.490 2.490 2.292 2.786 . 0 0 "[ . 1 . 2]" 1
161 1 30 ASP H 1 30 ASP HB3 . . 3.970 3.458 2.888 3.849 . 0 0 "[ . 1 . 2]" 1
162 1 30 ASP H 1 31 PRO QD . . 5.020 3.730 3.556 4.077 . 0 0 "[ . 1 . 2]" 1
163 1 30 ASP H 1 59 ALA HA . . 4.180 3.290 2.987 3.530 . 0 0 "[ . 1 . 2]" 1
164 1 30 ASP H 1 59 ALA MB . . 4.210 2.868 2.042 3.284 . 0 0 "[ . 1 . 2]" 1
165 1 30 ASP H 1 104 PHE QE . . 3.880 2.954 2.071 3.450 . 0 0 "[ . 1 . 2]" 1
166 1 30 ASP HA 1 31 PRO QD . . 3.350 1.874 1.852 1.906 . 0 0 "[ . 1 . 2]" 1
167 1 30 ASP HA 1 31 PRO QG . . 4.200 3.789 3.767 3.818 . 0 0 "[ . 1 . 2]" 1
168 1 30 ASP HA 1 32 SER H . . 4.070 3.580 3.229 4.025 . 0 0 "[ . 1 . 2]" 1
169 1 30 ASP QB 1 31 PRO QD . . 4.930 3.587 3.406 3.759 . 0 0 "[ . 1 . 2]" 1
170 1 30 ASP QB 1 32 SER H . . 4.480 3.809 3.280 4.491 0.011 10 0 "[ . 1 . 2]" 1
171 1 30 ASP QB 1 33 LYS H . . 3.890 3.081 2.767 3.499 . 0 0 "[ . 1 . 2]" 1
172 1 30 ASP QB 1 33 LYS QB . . 3.940 2.802 2.159 3.239 . 0 0 "[ . 1 . 2]" 1
173 1 30 ASP QB 1 33 LYS HG2 . . 4.010 2.612 2.282 3.176 . 0 0 "[ . 1 . 2]" 1
174 1 30 ASP QB 1 33 LYS HG3 . . 3.970 2.450 2.061 2.865 . 0 0 "[ . 1 . 2]" 1
175 1 30 ASP QB 1 34 VAL H . . 4.780 4.544 4.141 4.764 . 0 0 "[ . 1 . 2]" 1
176 1 30 ASP QB 1 59 ALA HA . . 3.960 2.111 1.970 2.788 . 0 0 "[ . 1 . 2]" 1
177 1 30 ASP HB2 1 33 LYS HG2 . . 4.810 3.860 3.213 4.522 . 0 0 "[ . 1 . 2]" 1
178 1 30 ASP HB2 1 33 LYS HG3 . . 4.750 3.169 2.359 3.824 . 0 0 "[ . 1 . 2]" 1
179 1 30 ASP HB2 1 59 ALA HA . . 4.660 2.448 1.997 3.763 . 0 0 "[ . 1 . 2]" 1
180 1 30 ASP HB3 1 33 LYS HG2 . . 4.810 2.665 2.305 3.256 . 0 0 "[ . 1 . 2]" 1
181 1 30 ASP HB3 1 33 LYS HG3 . . 4.750 2.612 2.085 3.282 . 0 0 "[ . 1 . 2]" 1
182 1 30 ASP HB3 1 59 ALA HA . . 4.660 2.962 2.000 3.652 . 0 0 "[ . 1 . 2]" 1
183 1 31 PRO HA 1 33 LYS H . . 4.260 3.740 3.422 4.082 . 0 0 "[ . 1 . 2]" 1
184 1 31 PRO HA 1 34 VAL H . . 4.210 3.122 2.925 3.335 . 0 0 "[ . 1 . 2]" 1
185 1 31 PRO HA 1 34 VAL MG2 . . 3.590 2.014 1.906 2.419 . 0 0 "[ . 1 . 2]" 1
186 1 31 PRO HA 1 104 PHE HB2 . . 4.570 3.171 2.932 3.424 . 0 0 "[ . 1 . 2]" 1
187 1 31 PRO HA 1 104 PHE QB . . 3.750 2.770 2.518 3.024 . 0 0 "[ . 1 . 2]" 1
188 1 31 PRO HA 1 104 PHE HB3 . . 4.570 3.067 2.743 3.437 . 0 0 "[ . 1 . 2]" 1
189 1 31 PRO HA 1 104 PHE QD . . 3.570 3.382 3.014 3.593 0.023 10 0 "[ . 1 . 2]" 1
190 1 31 PRO HA 1 109 ILE MG . . 3.790 2.937 2.614 3.181 . 0 0 "[ . 1 . 2]" 1
191 1 31 PRO HB2 1 32 SER H . . 3.920 3.320 3.045 3.710 . 0 0 "[ . 1 . 2]" 1
192 1 31 PRO HB2 1 104 PHE QB . . 4.270 3.492 3.415 3.782 . 0 0 "[ . 1 . 2]" 1
193 1 31 PRO HB2 1 104 PHE QD . . 5.500 4.912 4.762 5.088 . 0 0 "[ . 1 . 2]" 1
194 1 31 PRO HB2 1 107 VAL MG1 . . 3.590 2.935 2.443 3.414 . 0 0 "[ . 1 . 2]" 1
195 1 31 PRO HB2 1 109 ILE MG . . 3.540 2.692 2.366 3.091 . 0 0 "[ . 1 . 2]" 1
196 1 31 PRO HB2 1 110 PRO HD2 . . 4.180 3.852 3.470 4.169 . 0 0 "[ . 1 . 2]" 1
197 1 31 PRO HB3 1 32 SER H . . 4.580 4.132 3.973 4.359 . 0 0 "[ . 1 . 2]" 1
198 1 31 PRO HB3 1 104 PHE QB . . 4.070 2.013 1.937 2.331 . 0 0 "[ . 1 . 2]" 1
199 1 31 PRO HB3 1 104 PHE QD . . 4.340 3.406 3.205 3.629 . 0 0 "[ . 1 . 2]" 1
200 1 31 PRO HB3 1 107 VAL HB . . 4.080 2.733 2.420 3.130 . 0 0 "[ . 1 . 2]" 1
201 1 31 PRO HB3 1 107 VAL MG1 . . 3.780 3.175 2.752 3.539 . 0 0 "[ . 1 . 2]" 1
202 1 31 PRO HB3 1 109 ILE HA . . 4.840 4.109 3.765 4.347 . 0 0 "[ . 1 . 2]" 1
203 1 31 PRO HB3 1 109 ILE MG . . 3.610 3.004 2.713 3.358 . 0 0 "[ . 1 . 2]" 1
204 1 31 PRO QD 1 32 SER H . . 4.660 2.617 2.601 2.716 . 0 0 "[ . 1 . 2]" 1
205 1 31 PRO QD 1 107 VAL HB . . 4.940 3.917 3.590 4.152 . 0 0 "[ . 1 . 2]" 1
206 1 31 PRO QG 1 32 SER H . . 4.240 2.342 2.039 2.856 . 0 0 "[ . 1 . 2]" 1
207 1 31 PRO QG 1 104 PHE H . . 4.960 4.632 4.234 4.948 . 0 0 "[ . 1 . 2]" 1
208 1 31 PRO QG 1 104 PHE QD . . 4.410 4.240 3.999 4.414 0.004 17 0 "[ . 1 . 2]" 1
209 1 31 PRO QG 1 107 VAL MG1 . . 3.250 1.911 1.829 1.980 . 0 0 "[ . 1 . 2]" 1
210 1 32 SER H 1 32 SER HB2 . . 3.680 2.586 2.197 3.588 . 0 0 "[ . 1 . 2]" 1
211 1 32 SER H 1 32 SER QB . . 3.150 2.356 2.176 2.600 . 0 0 "[ . 1 . 2]" 1
212 1 32 SER H 1 32 SER HB3 . . 3.680 3.195 2.336 3.596 . 0 0 "[ . 1 . 2]" 1
213 1 32 SER H 1 33 LYS H . . 3.310 2.667 2.516 2.794 . 0 0 "[ . 1 . 2]" 1
214 1 32 SER H 1 33 LYS HG2 . . 4.720 4.246 3.852 4.569 . 0 0 "[ . 1 . 2]" 1
215 1 32 SER H 1 34 VAL H . . 4.350 4.116 3.937 4.353 0.003 12 0 "[ . 1 . 2]" 1
216 1 32 SER H 1 110 PRO HD2 . . 4.860 4.808 4.652 4.869 0.009 19 0 "[ . 1 . 2]" 1
217 1 32 SER H 1 110 PRO QG . . 5.100 4.667 4.489 4.796 . 0 0 "[ . 1 . 2]" 1
218 1 32 SER HA 1 109 ILE HA . . 4.640 4.273 4.016 4.638 . 0 0 "[ . 1 . 2]" 1
219 1 32 SER HA 1 110 PRO HD2 . . 4.290 2.882 2.740 3.068 . 0 0 "[ . 1 . 2]" 1
220 1 32 SER HA 1 110 PRO HG2 . . 4.010 3.267 3.138 3.418 . 0 0 "[ . 1 . 2]" 1
221 1 32 SER HA 1 110 PRO QG . . 3.490 2.142 1.980 2.434 . 0 0 "[ . 1 . 2]" 1
222 1 32 SER HA 1 110 PRO HG3 . . 4.010 2.174 1.997 2.526 . 0 0 "[ . 1 . 2]" 1
223 1 32 SER HB2 1 33 LYS H . . 4.370 3.481 2.820 4.225 . 0 0 "[ . 1 . 2]" 1
224 1 32 SER HB3 1 33 LYS H . . 4.370 3.743 2.773 4.171 . 0 0 "[ . 1 . 2]" 1
225 1 33 LYS H 1 33 LYS HB2 . . 3.750 2.495 2.398 2.629 . 0 0 "[ . 1 . 2]" 1
226 1 33 LYS H 1 33 LYS QB . . 3.040 2.453 2.365 2.576 . 0 0 "[ . 1 . 2]" 1
227 1 33 LYS H 1 33 LYS HB3 . . 3.750 3.636 3.608 3.693 . 0 0 "[ . 1 . 2]" 1
228 1 33 LYS H 1 33 LYS HG2 . . 3.480 2.460 2.161 2.773 . 0 0 "[ . 1 . 2]" 1
229 1 33 LYS H 1 33 LYS HG3 . . 3.790 3.600 3.318 3.804 0.014 18 0 "[ . 1 . 2]" 1
230 1 33 LYS H 1 34 VAL H . . 2.990 2.279 2.050 2.444 . 0 0 "[ . 1 . 2]" 1
231 1 33 LYS H 1 34 VAL HA . . 5.080 4.895 4.693 5.027 . 0 0 "[ . 1 . 2]" 1
232 1 33 LYS H 1 34 VAL HB . . 4.850 4.493 4.230 4.695 . 0 0 "[ . 1 . 2]" 1
233 1 33 LYS H 1 34 VAL MG2 . . 3.960 3.700 3.448 3.887 . 0 0 "[ . 1 . 2]" 1
234 1 33 LYS H 1 59 ALA HA . . 4.770 4.331 3.834 4.708 . 0 0 "[ . 1 . 2]" 1
235 1 33 LYS H 1 59 ALA MB . . 4.070 3.910 3.672 4.078 0.008 4 0 "[ . 1 . 2]" 1
236 1 33 LYS HA 1 33 LYS QD . . 3.130 2.498 2.020 3.120 . 0 0 "[ . 1 . 2]" 1
237 1 33 LYS HA 1 33 LYS QE . . 3.900 3.061 1.983 3.912 0.012 18 0 "[ . 1 . 2]" 1
238 1 33 LYS HA 1 33 LYS HG2 . . 3.540 2.874 2.737 3.058 . 0 0 "[ . 1 . 2]" 1
239 1 33 LYS HA 1 33 LYS HG3 . . 3.870 3.802 3.748 3.877 0.007 7 0 "[ . 1 . 2]" 1
240 1 33 LYS HA 1 34 VAL H . . 3.520 3.459 3.372 3.532 0.012 2 0 "[ . 1 . 2]" 1
241 1 33 LYS QB 1 33 LYS QD . . 3.350 2.267 2.040 2.652 . 0 0 "[ . 1 . 2]" 1
242 1 33 LYS QB 1 33 LYS QE . . 4.400 3.051 1.975 3.841 . 0 0 "[ . 1 . 2]" 1
243 1 33 LYS QB 1 34 VAL H . . 3.520 2.886 2.573 3.158 . 0 0 "[ . 1 . 2]" 1
244 1 33 LYS QB 1 34 VAL HA . . 4.690 3.940 3.816 4.033 . 0 0 "[ . 1 . 2]" 1
245 1 33 LYS QB 1 59 ALA HA . . 3.300 2.413 2.008 2.717 . 0 0 "[ . 1 . 2]" 1
246 1 33 LYS QB 1 59 ALA MB . . 3.540 2.535 2.108 2.878 . 0 0 "[ . 1 . 2]" 1
247 1 33 LYS HB2 1 34 VAL H . . 4.100 2.969 2.616 3.286 . 0 0 "[ . 1 . 2]" 1
248 1 33 LYS HB2 1 59 ALA H . . 4.860 4.144 3.421 4.650 . 0 0 "[ . 1 . 2]" 1
249 1 33 LYS HB2 1 59 ALA HA . . 3.890 2.456 2.054 2.782 . 0 0 "[ . 1 . 2]" 1
250 1 33 LYS HB2 1 59 ALA MB . . 4.120 2.589 2.127 2.969 . 0 0 "[ . 1 . 2]" 1
251 1 33 LYS HB3 1 34 VAL H . . 4.100 3.948 3.670 4.107 0.007 14 0 "[ . 1 . 2]" 1
252 1 33 LYS HB3 1 59 ALA H . . 4.860 4.352 3.319 4.868 0.008 1 0 "[ . 1 . 2]" 1
253 1 33 LYS HB3 1 59 ALA HA . . 3.890 3.559 2.835 3.897 0.007 12 0 "[ . 1 . 2]" 1
254 1 33 LYS HB3 1 59 ALA MB . . 4.120 3.651 3.321 3.951 . 0 0 "[ . 1 . 2]" 1
255 1 33 LYS QE 1 33 LYS HG2 . . 3.460 2.569 2.069 3.467 0.007 19 0 "[ . 1 . 2]" 1
256 1 33 LYS QE 1 33 LYS HG3 . . 3.560 2.893 2.198 3.486 . 0 0 "[ . 1 . 2]" 1
257 1 33 LYS HG2 1 34 VAL H . . 4.730 4.363 4.102 4.581 . 0 0 "[ . 1 . 2]" 1
258 1 33 LYS HG2 1 59 ALA HA . . 4.760 4.051 3.436 4.521 . 0 0 "[ . 1 . 2]" 1
259 1 33 LYS HG3 1 34 VAL H . . 5.500 5.022 4.569 5.363 . 0 0 "[ . 1 . 2]" 1
260 1 33 LYS HG3 1 59 ALA HA . . 3.550 2.884 2.152 3.389 . 0 0 "[ . 1 . 2]" 1
261 1 34 VAL H 1 34 VAL HB . . 3.100 2.501 2.417 2.648 . 0 0 "[ . 1 . 2]" 1
262 1 34 VAL H 1 34 VAL MG1 . . 3.940 3.761 3.747 3.776 . 0 0 "[ . 1 . 2]" 1
263 1 34 VAL H 1 34 VAL MG2 . . 3.110 2.286 1.936 2.486 . 0 0 "[ . 1 . 2]" 1
264 1 34 VAL H 1 35 LYS H . . 4.410 4.353 4.186 4.427 0.017 12 0 "[ . 1 . 2]" 1
265 1 34 VAL H 1 35 LYS QG . . 5.500 5.002 4.620 5.502 0.002 7 0 "[ . 1 . 2]" 1
266 1 34 VAL H 1 59 ALA MB . . 3.840 3.382 2.638 3.839 . 0 0 "[ . 1 . 2]" 1
267 1 34 VAL H 1 109 ILE HB . . 4.970 4.781 4.515 4.979 0.009 9 0 "[ . 1 . 2]" 1
268 1 34 VAL H 1 109 ILE MG . . 4.250 4.056 3.834 4.253 0.003 10 0 "[ . 1 . 2]" 1
269 1 34 VAL H 1 110 PRO HD2 . . 4.940 4.546 4.185 4.828 . 0 0 "[ . 1 . 2]" 1
270 1 34 VAL HA 1 34 VAL MG1 . . 3.420 2.441 2.386 2.505 . 0 0 "[ . 1 . 2]" 1
271 1 34 VAL HA 1 34 VAL MG2 . . 3.590 2.280 2.191 2.430 . 0 0 "[ . 1 . 2]" 1
272 1 34 VAL HA 1 35 LYS H . . 2.840 2.164 2.142 2.237 . 0 0 "[ . 1 . 2]" 1
273 1 34 VAL HA 1 35 LYS HB2 . . 5.370 4.432 4.319 4.597 . 0 0 "[ . 1 . 2]" 1
274 1 34 VAL HA 1 54 ILE MG . . 4.370 3.893 3.315 4.254 . 0 0 "[ . 1 . 2]" 1
275 1 34 VAL HA 1 56 THR HA . . 3.730 3.203 2.779 3.519 . 0 0 "[ . 1 . 2]" 1
276 1 34 VAL HA 1 56 THR MG . . 4.320 3.315 2.284 4.186 . 0 0 "[ . 1 . 2]" 1
277 1 34 VAL HA 1 59 ALA MB . . 4.090 3.571 3.091 3.967 . 0 0 "[ . 1 . 2]" 1
278 1 34 VAL HB 1 109 ILE HB . . 3.970 3.160 2.885 3.362 . 0 0 "[ . 1 . 2]" 1
279 1 34 VAL HB 1 109 ILE MD . . 3.740 3.485 3.077 3.695 . 0 0 "[ . 1 . 2]" 1
280 1 34 VAL HB 1 109 ILE MG . . 3.360 2.173 1.970 2.353 . 0 0 "[ . 1 . 2]" 1
281 1 34 VAL MG1 1 35 LYS H . . 3.330 3.030 2.735 3.286 . 0 0 "[ . 1 . 2]" 1
282 1 34 VAL MG1 1 36 ALA H . . 4.660 4.325 3.869 4.617 . 0 0 "[ . 1 . 2]" 1
283 1 34 VAL MG1 1 54 ILE MG . . 2.970 2.369 1.958 2.608 . 0 0 "[ . 1 . 2]" 1
284 1 34 VAL MG1 1 55 ASP H . . 4.540 3.917 3.604 4.215 . 0 0 "[ . 1 . 2]" 1
285 1 34 VAL MG1 1 56 THR HA . . 4.250 3.941 3.567 4.254 0.004 2 0 "[ . 1 . 2]" 1
286 1 34 VAL MG1 1 56 THR MG . . 3.340 2.513 1.933 3.307 . 0 0 "[ . 1 . 2]" 1
287 1 34 VAL MG1 1 109 ILE H . . 5.340 5.244 5.003 5.346 0.006 4 0 "[ . 1 . 2]" 1
288 1 34 VAL MG1 1 109 ILE HB . . 4.300 3.528 3.265 3.887 . 0 0 "[ . 1 . 2]" 1
289 1 34 VAL MG1 1 109 ILE MD . . 2.950 2.343 1.980 2.579 . 0 0 "[ . 1 . 2]" 1
290 1 34 VAL MG1 1 109 ILE MG . . 3.080 2.173 1.993 2.529 . 0 0 "[ . 1 . 2]" 1
291 1 34 VAL MG2 1 35 LYS H . . 4.180 4.107 4.004 4.186 0.006 17 0 "[ . 1 . 2]" 1
292 1 34 VAL MG2 1 56 THR HA . . 3.670 2.903 2.568 3.260 . 0 0 "[ . 1 . 2]" 1
293 1 34 VAL MG2 1 56 THR HB . . 4.460 3.672 2.916 4.241 . 0 0 "[ . 1 . 2]" 1
294 1 34 VAL MG2 1 56 THR MG . . 3.690 2.444 1.810 3.243 . 0 0 "[ . 1 . 2]" 1
295 1 34 VAL MG2 1 59 ALA H . . 5.010 4.701 4.333 4.964 . 0 0 "[ . 1 . 2]" 1
296 1 34 VAL MG2 1 59 ALA HA . . 4.570 4.140 3.712 4.557 . 0 0 "[ . 1 . 2]" 1
297 1 34 VAL MG2 1 59 ALA MB . . 3.030 2.187 1.728 2.544 . 0 0 "[ . 1 . 2]" 1
298 1 34 VAL MG2 1 64 LEU MD1 . . 3.790 3.242 2.844 3.593 . 0 0 "[ . 1 . 2]" 1
299 1 34 VAL MG2 1 104 PHE HB2 . . 4.240 2.854 2.297 3.272 . 0 0 "[ . 1 . 2]" 1
300 1 34 VAL MG2 1 104 PHE QB . . 3.680 2.757 2.258 3.146 . 0 0 "[ . 1 . 2]" 1
301 1 34 VAL MG2 1 104 PHE HB3 . . 4.240 3.659 3.326 4.080 . 0 0 "[ . 1 . 2]" 1
302 1 34 VAL MG2 1 104 PHE QD . . 4.090 3.293 3.010 3.556 . 0 0 "[ . 1 . 2]" 1
303 1 34 VAL MG2 1 109 ILE HB . . 4.720 4.588 4.284 4.728 0.008 15 0 "[ . 1 . 2]" 1
304 1 34 VAL MG2 1 109 ILE MG . . 3.420 2.966 2.598 3.147 . 0 0 "[ . 1 . 2]" 1
305 1 35 LYS H 1 35 LYS HB2 . . 3.560 2.407 2.344 2.474 . 0 0 "[ . 1 . 2]" 1
306 1 35 LYS H 1 35 LYS HB3 . . 3.670 3.604 3.563 3.661 . 0 0 "[ . 1 . 2]" 1
307 1 35 LYS H 1 35 LYS QG . . 3.840 3.346 2.891 3.837 . 0 0 "[ . 1 . 2]" 1
308 1 35 LYS H 1 54 ILE HA . . 4.990 4.840 4.434 4.995 0.005 4 0 "[ . 1 . 2]" 1
309 1 35 LYS H 1 54 ILE MG . . 3.990 3.702 3.327 3.976 . 0 0 "[ . 1 . 2]" 1
310 1 35 LYS H 1 55 ASP H . . 4.030 3.080 2.747 3.308 . 0 0 "[ . 1 . 2]" 1
311 1 35 LYS H 1 55 ASP HB2 . . 4.490 3.669 2.171 4.495 0.005 16 0 "[ . 1 . 2]" 1
312 1 35 LYS H 1 55 ASP QB . . 3.820 2.751 2.160 3.459 . 0 0 "[ . 1 . 2]" 1
313 1 35 LYS H 1 55 ASP HB3 . . 4.490 3.243 2.398 4.232 . 0 0 "[ . 1 . 2]" 1
314 1 35 LYS H 1 56 THR HA . . 4.770 4.471 3.854 4.767 . 0 0 "[ . 1 . 2]" 1
315 1 35 LYS HA 1 35 LYS QD . . 4.560 3.288 2.092 4.110 . 0 0 "[ . 1 . 2]" 1
316 1 35 LYS HA 1 36 ALA H . . 2.860 2.186 2.143 2.261 . 0 0 "[ . 1 . 2]" 1
317 1 35 LYS HA 1 109 ILE MD . . 4.740 3.540 2.986 4.258 . 0 0 "[ . 1 . 2]" 1
318 1 35 LYS HB2 1 35 LYS QE . . 4.560 3.573 2.002 4.422 . 0 0 "[ . 1 . 2]" 1
319 1 35 LYS HB2 1 37 HIS HD2 . . 4.800 3.652 3.388 3.924 . 0 0 "[ . 1 . 2]" 1
320 1 35 LYS HB2 1 55 ASP H . . 4.310 3.869 3.414 4.265 . 0 0 "[ . 1 . 2]" 1
321 1 35 LYS HB2 1 55 ASP HB2 . . 4.050 3.299 2.218 4.050 . 0 0 "[ . 1 . 2]" 1
322 1 35 LYS HB2 1 55 ASP QB . . 3.500 2.596 2.145 2.957 . 0 0 "[ . 1 . 2]" 1
323 1 35 LYS HB2 1 55 ASP HB3 . . 4.050 3.158 2.160 4.051 0.001 13 0 "[ . 1 . 2]" 1
324 1 35 LYS HB3 1 35 LYS QD . . 3.680 2.592 2.059 3.429 . 0 0 "[ . 1 . 2]" 1
325 1 35 LYS HB3 1 35 LYS QE . . 4.720 3.588 2.028 4.453 . 0 0 "[ . 1 . 2]" 1
326 1 35 LYS HB3 1 36 ALA H . . 3.560 3.180 2.837 3.452 . 0 0 "[ . 1 . 2]" 1
327 1 35 LYS HB3 1 37 HIS HD2 . . 4.450 2.690 2.299 3.176 . 0 0 "[ . 1 . 2]" 1
328 1 35 LYS HB3 1 55 ASP H . . 5.060 4.525 4.278 4.753 . 0 0 "[ . 1 . 2]" 1
329 1 35 LYS HB3 1 55 ASP QB . . 3.900 3.790 3.566 3.919 0.019 10 0 "[ . 1 . 2]" 1
330 1 35 LYS QE 1 35 LYS QG . . 3.210 2.273 2.040 2.595 . 0 0 "[ . 1 . 2]" 1
331 1 35 LYS QG 1 37 HIS HD2 . . 4.830 4.563 4.159 4.800 . 0 0 "[ . 1 . 2]" 1
332 1 36 ALA H 1 36 ALA MB . . 3.240 2.379 2.274 2.482 . 0 0 "[ . 1 . 2]" 1
333 1 36 ALA H 1 37 HIS H . . 4.350 4.250 4.033 4.353 0.003 10 0 "[ . 1 . 2]" 1
334 1 36 ALA H 1 37 HIS HD2 . . 5.350 4.350 3.495 4.954 . 0 0 "[ . 1 . 2]" 1
335 1 36 ALA H 1 41 LEU MD1 . . 4.560 4.241 4.038 4.499 . 0 0 "[ . 1 . 2]" 1
336 1 36 ALA H 1 109 ILE MD . . 3.750 3.482 3.033 3.749 . 0 0 "[ . 1 . 2]" 1
337 1 36 ALA H 1 114 PHE QE . . 5.500 4.179 3.639 4.653 . 0 0 "[ . 1 . 2]" 1
338 1 36 ALA H 1 114 PHE HZ . . 5.140 3.441 2.621 4.131 . 0 0 "[ . 1 . 2]" 1
339 1 36 ALA HA 1 37 HIS H . . 2.750 2.147 2.141 2.170 . 0 0 "[ . 1 . 2]" 1
340 1 36 ALA HA 1 41 LEU MD1 . . 4.810 3.522 3.280 3.695 . 0 0 "[ . 1 . 2]" 1
341 1 36 ALA HA 1 53 THR H . . 5.330 4.995 4.753 5.156 . 0 0 "[ . 1 . 2]" 1
342 1 36 ALA HA 1 54 ILE H . . 5.270 4.956 4.772 5.178 . 0 0 "[ . 1 . 2]" 1
343 1 36 ALA HA 1 54 ILE HA . . 4.040 2.433 2.209 2.664 . 0 0 "[ . 1 . 2]" 1
344 1 36 ALA HA 1 54 ILE HG13 . . 5.210 4.059 3.570 4.272 . 0 0 "[ . 1 . 2]" 1
345 1 36 ALA HA 1 54 ILE MG . . 4.600 3.499 3.267 3.656 . 0 0 "[ . 1 . 2]" 1
346 1 36 ALA HA 1 55 ASP H . . 3.920 3.575 3.256 3.835 . 0 0 "[ . 1 . 2]" 1
347 1 36 ALA MB 1 37 HIS H . . 3.530 3.301 3.216 3.444 . 0 0 "[ . 1 . 2]" 1
348 1 36 ALA MB 1 37 HIS HA . . 4.910 4.031 3.956 4.073 . 0 0 "[ . 1 . 2]" 1
349 1 36 ALA MB 1 41 LEU MD1 . . 2.920 2.118 1.953 2.388 . 0 0 "[ . 1 . 2]" 1
350 1 36 ALA MB 1 41 LEU MD2 . . 3.660 2.430 2.116 2.745 . 0 0 "[ . 1 . 2]" 1
351 1 36 ALA MB 1 52 PHE QD . . 4.160 2.827 2.227 3.536 . 0 0 "[ . 1 . 2]" 1
352 1 36 ALA MB 1 54 ILE HA . . 5.110 3.553 3.188 3.865 . 0 0 "[ . 1 . 2]" 1
353 1 36 ALA MB 1 54 ILE HG12 . . 3.160 2.456 2.022 2.792 . 0 0 "[ . 1 . 2]" 1
354 1 36 ALA MB 1 54 ILE HG13 . . 4.180 3.736 3.149 4.175 . 0 0 "[ . 1 . 2]" 1
355 1 36 ALA MB 1 54 ILE MG . . 3.570 3.285 3.029 3.535 . 0 0 "[ . 1 . 2]" 1
356 1 36 ALA MB 1 102 ILE MD . . 3.010 2.242 1.995 2.458 . 0 0 "[ . 1 . 2]" 1
357 1 36 ALA MB 1 114 PHE QD . . 4.260 3.808 3.474 4.139 . 0 0 "[ . 1 . 2]" 1
358 1 36 ALA MB 1 114 PHE QE . . 4.010 3.109 2.622 3.479 . 0 0 "[ . 1 . 2]" 1
359 1 36 ALA MB 1 114 PHE HZ . . 4.670 3.144 2.370 3.803 . 0 0 "[ . 1 . 2]" 1
360 1 37 HIS H 1 37 HIS HB2 . . 3.980 3.785 3.708 3.885 . 0 0 "[ . 1 . 2]" 1
361 1 37 HIS H 1 37 HIS HB3 . . 3.980 3.400 3.250 3.555 . 0 0 "[ . 1 . 2]" 1
362 1 37 HIS H 1 37 HIS HD2 . . 4.240 3.237 2.382 3.834 . 0 0 "[ . 1 . 2]" 1
363 1 37 HIS H 1 41 LEU MD1 . . 3.740 3.026 2.699 3.225 . 0 0 "[ . 1 . 2]" 1
364 1 37 HIS H 1 41 LEU MD2 . . 5.000 4.786 4.578 4.977 . 0 0 "[ . 1 . 2]" 1
365 1 37 HIS H 1 52 PHE HB2 . . 4.420 3.822 3.481 4.048 . 0 0 "[ . 1 . 2]" 1
366 1 37 HIS H 1 52 PHE QD . . 4.360 3.945 3.196 4.365 0.005 10 0 "[ . 1 . 2]" 1
367 1 37 HIS H 1 53 THR H . . 3.760 3.553 3.326 3.759 . 0 0 "[ . 1 . 2]" 1
368 1 37 HIS H 1 53 THR HB . . 4.060 3.727 3.388 3.951 . 0 0 "[ . 1 . 2]" 1
369 1 37 HIS H 1 54 ILE HA . . 4.130 3.386 3.191 3.548 . 0 0 "[ . 1 . 2]" 1
370 1 37 HIS H 1 54 ILE HG12 . . 4.700 4.439 4.103 4.703 0.003 19 0 "[ . 1 . 2]" 1
371 1 37 HIS H 1 54 ILE HG13 . . 5.040 4.825 4.446 5.025 . 0 0 "[ . 1 . 2]" 1
372 1 37 HIS H 1 55 ASP H . . 4.710 4.623 4.350 4.709 . 0 0 "[ . 1 . 2]" 1
373 1 37 HIS HA 1 38 GLY H . . 3.150 2.171 2.144 2.201 . 0 0 "[ . 1 . 2]" 1
374 1 37 HIS QB 1 38 GLY H . . 3.330 3.107 2.967 3.317 . 0 0 "[ . 1 . 2]" 1
375 1 37 HIS HB2 1 38 GLY H . . 4.130 3.230 3.044 3.517 . 0 0 "[ . 1 . 2]" 1
376 1 37 HIS HB3 1 38 GLY H . . 4.130 4.052 3.953 4.134 0.004 17 0 "[ . 1 . 2]" 1
377 1 37 HIS HE1 1 53 THR HB . . 4.590 2.854 2.427 3.593 . 0 0 "[ . 1 . 2]" 1
378 1 37 HIS HE1 1 53 THR MG . . 4.180 2.458 1.980 3.166 . 0 0 "[ . 1 . 2]" 1
379 1 38 GLY H 1 39 PRO HD2 . . 5.090 4.791 4.758 4.808 . 0 0 "[ . 1 . 2]" 1
380 1 38 GLY H 1 39 PRO HD3 . . 5.090 4.926 4.882 4.987 . 0 0 "[ . 1 . 2]" 1
381 1 38 GLY H 1 41 LEU H . . 5.130 4.255 3.995 4.390 . 0 0 "[ . 1 . 2]" 1
382 1 38 GLY H 1 41 LEU HB2 . . 5.040 3.344 3.079 3.484 . 0 0 "[ . 1 . 2]" 1
383 1 38 GLY H 1 41 LEU HB3 . . 4.940 4.716 4.441 4.866 . 0 0 "[ . 1 . 2]" 1
384 1 38 GLY H 1 41 LEU MD1 . . 3.860 2.168 1.946 2.478 . 0 0 "[ . 1 . 2]" 1
385 1 38 GLY QA 1 39 PRO QB . . 5.230 4.273 4.271 4.275 . 0 0 "[ . 1 . 2]" 1
386 1 38 GLY QA 1 39 PRO HD2 . . 3.790 2.171 2.119 2.206 . 0 0 "[ . 1 . 2]" 1
387 1 38 GLY QA 1 39 PRO QD . . 3.190 2.023 2.002 2.034 . 0 0 "[ . 1 . 2]" 1
388 1 38 GLY QA 1 39 PRO HD3 . . 3.790 2.419 2.384 2.462 . 0 0 "[ . 1 . 2]" 1
389 1 38 GLY QA 1 39 PRO HG2 . . 4.200 4.044 4.028 4.054 . 0 0 "[ . 1 . 2]" 1
390 1 38 GLY QA 1 39 PRO HG3 . . 4.960 4.274 4.269 4.278 . 0 0 "[ . 1 . 2]" 1
391 1 38 GLY QA 1 40 GLY H . . 4.840 3.544 3.256 3.740 . 0 0 "[ . 1 . 2]" 1
392 1 38 GLY QA 1 52 PHE HA . . 4.710 2.388 2.202 2.601 . 0 0 "[ . 1 . 2]" 1
393 1 38 GLY QA 1 53 THR H . . 4.430 2.500 2.315 2.725 . 0 0 "[ . 1 . 2]" 1
394 1 39 PRO HA 1 41 LEU H . . 3.950 3.740 3.514 3.908 . 0 0 "[ . 1 . 2]" 1
395 1 39 PRO HA 1 42 GLU H . . 3.700 3.270 3.100 3.557 . 0 0 "[ . 1 . 2]" 1
396 1 39 PRO HA 1 42 GLU QB . . 4.000 3.102 2.593 3.745 . 0 0 "[ . 1 . 2]" 1
397 1 39 PRO HA 1 43 GLY H . . 4.820 3.969 3.705 4.274 . 0 0 "[ . 1 . 2]" 1
398 1 39 PRO QB 1 40 GLY H . . 3.570 2.982 2.807 3.240 . 0 0 "[ . 1 . 2]" 1
399 1 39 PRO HB2 1 40 GLY H . . 4.170 3.078 2.880 3.378 . 0 0 "[ . 1 . 2]" 1
400 1 39 PRO HB3 1 40 GLY H . . 4.170 3.995 3.881 4.168 . 0 0 "[ . 1 . 2]" 1
401 1 39 PRO QD 1 40 GLY H . . 3.760 2.647 2.604 2.710 . 0 0 "[ . 1 . 2]" 1
402 1 39 PRO QD 1 52 PHE HA . . 4.250 2.316 2.128 2.509 . 0 0 "[ . 1 . 2]" 1
403 1 39 PRO HD2 1 40 GLY H . . 4.430 2.697 2.649 2.767 . 0 0 "[ . 1 . 2]" 1
404 1 39 PRO HD2 1 52 PHE HA . . 4.900 2.330 2.138 2.529 . 0 0 "[ . 1 . 2]" 1
405 1 39 PRO HD3 1 40 GLY H . . 4.430 3.854 3.838 3.881 . 0 0 "[ . 1 . 2]" 1
406 1 39 PRO HD3 1 52 PHE HA . . 4.900 4.027 3.837 4.230 . 0 0 "[ . 1 . 2]" 1
407 1 39 PRO HG2 1 40 GLY H . . 4.170 2.089 1.904 2.421 . 0 0 "[ . 1 . 2]" 1
408 1 39 PRO HG2 1 51 GLU H . . 3.770 3.397 3.157 3.625 . 0 0 "[ . 1 . 2]" 1
409 1 39 PRO HG3 1 40 GLY H . . 4.200 3.674 3.533 3.921 . 0 0 "[ . 1 . 2]" 1
410 1 39 PRO HG3 1 51 GLU H . . 4.940 4.799 4.495 4.935 . 0 0 "[ . 1 . 2]" 1
411 1 40 GLY H 1 41 LEU H . . 3.620 2.799 2.582 2.920 . 0 0 "[ . 1 . 2]" 1
412 1 40 GLY H 1 41 LEU HG . . 4.720 4.185 3.746 4.377 . 0 0 "[ . 1 . 2]" 1
413 1 40 GLY H 1 42 GLU H . . 4.690 4.550 4.426 4.662 . 0 0 "[ . 1 . 2]" 1
414 1 40 GLY H 1 50 ALA MB . . 4.340 4.220 4.075 4.317 . 0 0 "[ . 1 . 2]" 1
415 1 40 GLY H 1 51 GLU H . . 4.140 3.730 3.580 4.074 . 0 0 "[ . 1 . 2]" 1
416 1 40 GLY H 1 52 PHE HA . . 4.360 3.274 3.147 3.405 . 0 0 "[ . 1 . 2]" 1
417 1 40 GLY H 1 52 PHE HB2 . . 4.750 4.547 4.169 4.705 . 0 0 "[ . 1 . 2]" 1
418 1 40 GLY H 1 52 PHE HB3 . . 4.170 2.967 2.562 3.161 . 0 0 "[ . 1 . 2]" 1
419 1 40 GLY H 1 52 PHE QD . . 4.190 3.722 3.388 4.104 . 0 0 "[ . 1 . 2]" 1
420 1 40 GLY QA 1 42 GLU H . . 4.940 4.348 4.135 4.461 . 0 0 "[ . 1 . 2]" 1
421 1 40 GLY QA 1 43 GLY H . . 4.390 3.632 3.508 3.834 . 0 0 "[ . 1 . 2]" 1
422 1 40 GLY QA 1 51 GLU H . . 3.850 3.373 3.199 3.688 . 0 0 "[ . 1 . 2]" 1
423 1 40 GLY QA 1 52 PHE QD . . 4.430 2.289 2.000 2.830 . 0 0 "[ . 1 . 2]" 1
424 1 40 GLY HA2 1 50 ALA MB . . 3.590 2.332 2.154 2.455 . 0 0 "[ . 1 . 2]" 1
425 1 40 GLY HA2 1 51 GLU H . . 4.390 3.973 3.694 4.383 . 0 0 "[ . 1 . 2]" 1
426 1 40 GLY HA3 1 50 ALA MB . . 3.590 3.090 2.861 3.264 . 0 0 "[ . 1 . 2]" 1
427 1 40 GLY HA3 1 51 GLU H . . 4.390 3.651 3.452 3.967 . 0 0 "[ . 1 . 2]" 1
428 1 41 LEU H 1 41 LEU HB2 . . 3.350 2.556 2.506 2.683 . 0 0 "[ . 1 . 2]" 1
429 1 41 LEU H 1 41 LEU HB3 . . 3.800 3.626 3.604 3.696 . 0 0 "[ . 1 . 2]" 1
430 1 41 LEU H 1 41 LEU MD1 . . 3.740 3.620 3.521 3.736 . 0 0 "[ . 1 . 2]" 1
431 1 41 LEU H 1 41 LEU MD2 . . 3.700 3.361 3.215 3.574 . 0 0 "[ . 1 . 2]" 1
432 1 41 LEU H 1 41 LEU HG . . 3.140 2.278 2.150 2.509 . 0 0 "[ . 1 . 2]" 1
433 1 41 LEU H 1 42 GLU H . . 3.050 2.448 2.166 2.603 . 0 0 "[ . 1 . 2]" 1
434 1 41 LEU H 1 42 GLU QB . . 4.570 4.438 4.261 4.553 . 0 0 "[ . 1 . 2]" 1
435 1 41 LEU H 1 42 GLU QG . . 4.350 4.146 3.572 4.327 . 0 0 "[ . 1 . 2]" 1
436 1 41 LEU H 1 43 GLY H . . 3.910 3.748 3.519 3.884 . 0 0 "[ . 1 . 2]" 1
437 1 41 LEU H 1 52 PHE HB2 . . 4.460 4.312 4.044 4.474 0.014 4 0 "[ . 1 . 2]" 1
438 1 41 LEU H 1 52 PHE HB3 . . 4.170 2.885 2.639 3.080 . 0 0 "[ . 1 . 2]" 1
439 1 41 LEU H 1 52 PHE QD . . 4.370 3.963 3.545 4.309 . 0 0 "[ . 1 . 2]" 1
440 1 41 LEU H 1 116 ALA MB . . 4.580 4.486 4.280 4.580 . 0 0 "[ . 1 . 2]" 1
441 1 41 LEU HA 1 41 LEU MD1 . . 4.080 3.915 3.888 3.969 . 0 0 "[ . 1 . 2]" 1
442 1 41 LEU HA 1 41 LEU MD2 . . 3.050 2.197 1.982 2.463 . 0 0 "[ . 1 . 2]" 1
443 1 41 LEU HA 1 41 LEU HG . . 4.000 3.186 3.124 3.230 . 0 0 "[ . 1 . 2]" 1
444 1 41 LEU HA 1 43 GLY H . . 4.600 4.367 4.194 4.539 . 0 0 "[ . 1 . 2]" 1
445 1 41 LEU HA 1 100 VAL MG2 . . 4.260 3.614 3.328 3.884 . 0 0 "[ . 1 . 2]" 1
446 1 41 LEU HA 1 114 PHE HB2 . . 5.010 3.914 3.615 4.216 . 0 0 "[ . 1 . 2]" 1
447 1 41 LEU HA 1 114 PHE HB3 . . 4.810 3.351 3.049 3.728 . 0 0 "[ . 1 . 2]" 1
448 1 41 LEU HA 1 116 ALA MB . . 3.800 2.926 2.456 3.143 . 0 0 "[ . 1 . 2]" 1
449 1 41 LEU HB2 1 41 LEU MD1 . . 3.360 2.245 2.134 2.347 . 0 0 "[ . 1 . 2]" 1
450 1 41 LEU HB2 1 42 GLU H . . 3.920 2.454 2.318 2.637 . 0 0 "[ . 1 . 2]" 1
451 1 41 LEU HB2 1 43 GLY H . . 5.190 4.818 4.648 4.962 . 0 0 "[ . 1 . 2]" 1
452 1 41 LEU HB2 1 114 PHE QD . . 4.610 4.147 3.601 4.602 . 0 0 "[ . 1 . 2]" 1
453 1 41 LEU HB3 1 41 LEU MD1 . . 3.020 2.418 2.315 2.512 . 0 0 "[ . 1 . 2]" 1
454 1 41 LEU HB3 1 42 GLU H . . 4.210 3.645 3.502 3.853 . 0 0 "[ . 1 . 2]" 1
455 1 41 LEU HB3 1 114 PHE HB2 . . 4.970 3.800 3.447 4.191 . 0 0 "[ . 1 . 2]" 1
456 1 41 LEU HB3 1 114 PHE HB3 . . 4.630 2.621 2.180 3.088 . 0 0 "[ . 1 . 2]" 1
457 1 41 LEU HB3 1 114 PHE QD . . 3.900 2.769 2.334 3.265 . 0 0 "[ . 1 . 2]" 1
458 1 41 LEU MD1 1 42 GLU H . . 4.440 4.279 4.146 4.421 . 0 0 "[ . 1 . 2]" 1
459 1 41 LEU MD1 1 52 PHE HB2 . . 4.580 2.826 2.420 3.120 . 0 0 "[ . 1 . 2]" 1
460 1 41 LEU MD1 1 52 PHE HB3 . . 4.600 3.359 3.048 3.551 . 0 0 "[ . 1 . 2]" 1
461 1 41 LEU MD1 1 52 PHE QD . . 4.440 3.279 2.679 3.824 . 0 0 "[ . 1 . 2]" 1
462 1 41 LEU MD1 1 53 THR H . . 4.680 3.964 3.649 4.170 . 0 0 "[ . 1 . 2]" 1
463 1 41 LEU MD1 1 102 ILE MD . . 4.050 3.969 3.713 4.059 0.009 4 0 "[ . 1 . 2]" 1
464 1 41 LEU MD1 1 114 PHE HB2 . . 4.990 4.416 4.189 4.819 . 0 0 "[ . 1 . 2]" 1
465 1 41 LEU MD1 1 114 PHE HB3 . . 4.910 3.962 3.620 4.433 . 0 0 "[ . 1 . 2]" 1
466 1 41 LEU MD1 1 114 PHE QD . . 4.380 3.122 2.396 3.727 . 0 0 "[ . 1 . 2]" 1
467 1 41 LEU MD1 1 114 PHE QE . . 4.450 3.322 2.599 4.035 . 0 0 "[ . 1 . 2]" 1
468 1 41 LEU MD2 1 42 GLU H . . 4.880 4.621 4.579 4.676 . 0 0 "[ . 1 . 2]" 1
469 1 41 LEU MD2 1 52 PHE HB2 . . 4.520 3.354 3.115 3.532 . 0 0 "[ . 1 . 2]" 1
470 1 41 LEU MD2 1 52 PHE HB3 . . 4.920 3.203 3.001 3.412 . 0 0 "[ . 1 . 2]" 1
471 1 41 LEU MD2 1 52 PHE QD . . 4.190 2.732 2.471 3.061 . 0 0 "[ . 1 . 2]" 1
472 1 41 LEU MD2 1 52 PHE QE . . 4.380 3.102 2.768 3.499 . 0 0 "[ . 1 . 2]" 1
473 1 41 LEU MD2 1 100 VAL HB . . 3.900 3.489 3.267 3.676 . 0 0 "[ . 1 . 2]" 1
474 1 41 LEU MD2 1 102 ILE MD . . 3.280 2.940 2.744 3.142 . 0 0 "[ . 1 . 2]" 1
475 1 41 LEU MD2 1 114 PHE H . . 4.880 4.639 4.352 4.847 . 0 0 "[ . 1 . 2]" 1
476 1 41 LEU MD2 1 114 PHE HB2 . . 3.960 2.554 2.184 2.757 . 0 0 "[ . 1 . 2]" 1
477 1 41 LEU MD2 1 114 PHE HB3 . . 4.040 2.687 2.126 3.140 . 0 0 "[ . 1 . 2]" 1
478 1 41 LEU MD2 1 114 PHE QD . . 4.020 3.152 2.729 3.660 . 0 0 "[ . 1 . 2]" 1
479 1 41 LEU MD2 1 116 ALA MB . . 5.020 4.244 3.866 4.511 . 0 0 "[ . 1 . 2]" 1
480 1 41 LEU HG 1 42 GLU H . . 4.170 4.096 3.960 4.172 0.002 2 0 "[ . 1 . 2]" 1
481 1 41 LEU HG 1 52 PHE HB2 . . 4.660 2.779 2.632 2.924 . 0 0 "[ . 1 . 2]" 1
482 1 41 LEU HG 1 52 PHE HB3 . . 4.540 2.184 2.055 2.338 . 0 0 "[ . 1 . 2]" 1
483 1 41 LEU HG 1 52 PHE QD . . 4.020 3.396 3.182 3.669 . 0 0 "[ . 1 . 2]" 1
484 1 41 LEU HG 1 53 THR H . . 4.750 4.634 4.507 4.733 . 0 0 "[ . 1 . 2]" 1
485 1 42 GLU H 1 42 GLU HB2 . . 3.780 2.848 2.380 3.599 . 0 0 "[ . 1 . 2]" 1
486 1 42 GLU H 1 42 GLU QB . . 3.200 2.378 2.221 2.479 . 0 0 "[ . 1 . 2]" 1
487 1 42 GLU H 1 42 GLU HB3 . . 3.780 3.146 2.245 3.604 . 0 0 "[ . 1 . 2]" 1
488 1 42 GLU H 1 42 GLU HG2 . . 4.370 2.812 2.158 3.811 . 0 0 "[ . 1 . 2]" 1
489 1 42 GLU H 1 42 GLU QG . . 3.550 2.361 2.141 2.675 . 0 0 "[ . 1 . 2]" 1
490 1 42 GLU H 1 42 GLU HG3 . . 4.370 3.162 2.254 3.863 . 0 0 "[ . 1 . 2]" 1
491 1 42 GLU H 1 43 GLY H . . 2.760 2.587 2.463 2.708 . 0 0 "[ . 1 . 2]" 1
492 1 42 GLU H 1 43 GLY QA . . 4.880 4.539 4.438 4.601 . 0 0 "[ . 1 . 2]" 1
493 1 42 GLU H 1 116 ALA MB . . 4.460 4.164 3.998 4.319 . 0 0 "[ . 1 . 2]" 1
494 1 42 GLU HA 1 42 GLU QG . . 3.710 2.858 2.321 3.436 . 0 0 "[ . 1 . 2]" 1
495 1 42 GLU HA 1 116 ALA HA . . 4.240 3.601 3.349 3.929 . 0 0 "[ . 1 . 2]" 1
496 1 42 GLU QB 1 43 GLY H . . 3.530 2.942 2.549 3.513 . 0 0 "[ . 1 . 2]" 1
497 1 42 GLU QB 1 43 GLY QA . . 5.040 3.956 3.710 4.385 . 0 0 "[ . 1 . 2]" 1
498 1 42 GLU HB2 1 43 GLY H . . 4.290 3.193 2.603 4.138 . 0 0 "[ . 1 . 2]" 1
499 1 42 GLU HB3 1 43 GLY H . . 4.290 3.737 3.611 3.904 . 0 0 "[ . 1 . 2]" 1
500 1 42 GLU QG 1 43 GLY H . . 4.420 3.447 2.083 4.195 . 0 0 "[ . 1 . 2]" 1
501 1 43 GLY H 1 44 GLY H . . 4.570 4.417 4.369 4.444 . 0 0 "[ . 1 . 2]" 1
502 1 43 GLY H 1 90 TYR HH . . 4.950 4.425 4.080 4.891 . 0 0 "[ . 1 . 2]" 1
503 1 43 GLY H 1 116 ALA MB . . 3.790 3.191 2.901 3.392 . 0 0 "[ . 1 . 2]" 1
504 1 43 GLY H 1 118 ILE MD . . 4.840 4.521 4.343 4.700 . 0 0 "[ . 1 . 2]" 1
505 1 43 GLY QA 1 116 ALA HA . . 4.280 3.172 2.869 3.617 . 0 0 "[ . 1 . 2]" 1
506 1 43 GLY QA 1 116 ALA MB . . 3.280 2.198 1.906 2.481 . 0 0 "[ . 1 . 2]" 1
507 1 43 GLY QA 1 117 ASP H . . 3.610 3.066 2.617 3.560 . 0 0 "[ . 1 . 2]" 1
508 1 43 GLY QA 1 117 ASP QB . . 4.350 3.635 3.200 4.200 . 0 0 "[ . 1 . 2]" 1
509 1 43 GLY HA2 1 44 GLY H . . 3.030 2.712 2.570 2.908 . 0 0 "[ . 1 . 2]" 1
510 1 43 GLY HA2 1 116 ALA MB . . 4.050 2.220 1.920 2.512 . 0 0 "[ . 1 . 2]" 1
511 1 43 GLY HA2 1 118 ILE MD . . 3.880 2.518 2.263 2.839 . 0 0 "[ . 1 . 2]" 1
512 1 43 GLY HA3 1 44 GLY H . . 3.030 2.434 2.278 2.564 . 0 0 "[ . 1 . 2]" 1
513 1 43 GLY HA3 1 116 ALA MB . . 4.050 3.553 3.230 3.848 . 0 0 "[ . 1 . 2]" 1
514 1 43 GLY HA3 1 118 ILE MD . . 3.880 3.386 3.034 3.676 . 0 0 "[ . 1 . 2]" 1
515 1 44 GLY H 1 45 LEU H . . 4.180 4.095 3.782 4.181 0.001 15 0 "[ . 1 . 2]" 1
516 1 44 GLY H 1 45 LEU HA . . 4.880 4.533 4.397 4.605 . 0 0 "[ . 1 . 2]" 1
517 1 44 GLY H 1 116 ALA MB . . 4.510 4.275 4.090 4.502 . 0 0 "[ . 1 . 2]" 1
518 1 44 GLY H 1 117 ASP QB . . 5.500 5.056 4.535 5.471 . 0 0 "[ . 1 . 2]" 1
519 1 44 GLY H 1 118 ILE HA . . 3.310 2.183 2.035 2.394 . 0 0 "[ . 1 . 2]" 1
520 1 44 GLY H 1 118 ILE MD . . 3.150 1.960 1.805 2.396 . 0 0 "[ . 1 . 2]" 1
521 1 44 GLY H 1 118 ILE HG12 . . 4.640 3.866 3.579 4.270 . 0 0 "[ . 1 . 2]" 1
522 1 44 GLY H 1 118 ILE MG . . 4.070 3.490 3.338 3.719 . 0 0 "[ . 1 . 2]" 1
523 1 44 GLY H 1 119 GLU H . . 3.720 3.447 3.161 3.690 . 0 0 "[ . 1 . 2]" 1
524 1 44 GLY H 1 119 GLU HB2 . . 5.500 5.309 4.908 5.483 . 0 0 "[ . 1 . 2]" 1
525 1 44 GLY H 1 119 GLU QG . . 4.780 4.562 4.117 4.767 . 0 0 "[ . 1 . 2]" 1
526 1 44 GLY QA 1 45 LEU H . . 2.780 2.146 2.109 2.181 . 0 0 "[ . 1 . 2]" 1
527 1 44 GLY QA 1 45 LEU HA . . 4.500 3.971 3.951 4.015 . 0 0 "[ . 1 . 2]" 1
528 1 44 GLY QA 1 45 LEU HG . . 4.010 3.315 3.176 3.463 . 0 0 "[ . 1 . 2]" 1
529 1 44 GLY QA 1 118 ILE MD . . 3.420 2.578 2.176 2.865 . 0 0 "[ . 1 . 2]" 1
530 1 44 GLY HA2 1 45 LEU H . . 3.290 3.061 2.944 3.270 . 0 0 "[ . 1 . 2]" 1
531 1 44 GLY HA2 1 45 LEU HA . . 5.160 4.559 4.493 4.655 . 0 0 "[ . 1 . 2]" 1
532 1 44 GLY HA2 1 45 LEU HG . . 4.560 3.467 3.308 3.617 . 0 0 "[ . 1 . 2]" 1
533 1 44 GLY HA2 1 118 ILE MD . . 3.980 3.594 3.289 3.890 . 0 0 "[ . 1 . 2]" 1
534 1 44 GLY HA3 1 45 LEU H . . 3.290 2.193 2.137 2.248 . 0 0 "[ . 1 . 2]" 1
535 1 44 GLY HA3 1 45 LEU HA . . 5.160 4.370 4.355 4.387 . 0 0 "[ . 1 . 2]" 1
536 1 44 GLY HA3 1 45 LEU HG . . 4.560 4.219 3.995 4.425 . 0 0 "[ . 1 . 2]" 1
537 1 44 GLY HA3 1 118 ILE MD . . 3.980 2.643 2.208 2.949 . 0 0 "[ . 1 . 2]" 1
538 1 45 LEU H 1 45 LEU HB2 . . 3.360 2.720 2.585 2.865 . 0 0 "[ . 1 . 2]" 1
539 1 45 LEU H 1 45 LEU HB3 . . 4.000 3.823 3.746 3.904 . 0 0 "[ . 1 . 2]" 1
540 1 45 LEU H 1 45 LEU MD1 . . 4.260 3.999 3.878 4.192 . 0 0 "[ . 1 . 2]" 1
541 1 45 LEU H 1 45 LEU MD2 . . 4.300 4.168 4.042 4.297 . 0 0 "[ . 1 . 2]" 1
542 1 45 LEU H 1 45 LEU HG . . 3.460 3.228 3.071 3.374 . 0 0 "[ . 1 . 2]" 1
543 1 45 LEU H 1 46 VAL H . . 4.500 4.396 4.336 4.447 . 0 0 "[ . 1 . 2]" 1
544 1 45 LEU H 1 48 LYS HB2 . . 4.040 3.222 2.953 3.552 . 0 0 "[ . 1 . 2]" 1
545 1 45 LEU H 1 48 LYS QB . . 3.510 3.072 2.864 3.335 . 0 0 "[ . 1 . 2]" 1
546 1 45 LEU H 1 48 LYS HB3 . . 4.040 3.895 3.692 4.045 0.005 17 0 "[ . 1 . 2]" 1
547 1 45 LEU H 1 118 ILE MD . . 3.840 3.147 2.765 3.651 . 0 0 "[ . 1 . 2]" 1
548 1 45 LEU HA 1 45 LEU MD1 . . 4.160 3.912 3.885 3.940 . 0 0 "[ . 1 . 2]" 1
549 1 45 LEU HA 1 45 LEU MD2 . . 3.100 2.226 2.046 2.530 . 0 0 "[ . 1 . 2]" 1
550 1 45 LEU HA 1 45 LEU HG . . 4.130 2.913 2.822 2.976 . 0 0 "[ . 1 . 2]" 1
551 1 45 LEU HA 1 46 VAL H . . 2.950 2.266 2.209 2.377 . 0 0 "[ . 1 . 2]" 1
552 1 45 LEU HA 1 46 VAL HB . . 4.930 4.833 4.749 4.925 . 0 0 "[ . 1 . 2]" 1
553 1 45 LEU HA 1 46 VAL MG2 . . 4.190 3.544 3.453 3.682 . 0 0 "[ . 1 . 2]" 1
554 1 45 LEU HA 1 118 ILE HA . . 4.920 4.126 3.781 4.469 . 0 0 "[ . 1 . 2]" 1
555 1 45 LEU HA 1 118 ILE MG . . 3.980 2.415 2.111 2.753 . 0 0 "[ . 1 . 2]" 1
556 1 45 LEU HA 1 119 GLU H . . 3.710 2.786 2.465 3.200 . 0 0 "[ . 1 . 2]" 1
557 1 45 LEU HB2 1 45 LEU MD1 . . 3.310 2.186 2.022 2.286 . 0 0 "[ . 1 . 2]" 1
558 1 45 LEU HB2 1 45 LEU MD2 . . 3.560 3.165 3.134 3.180 . 0 0 "[ . 1 . 2]" 1
559 1 45 LEU HB2 1 46 VAL H . . 4.020 3.907 3.648 4.029 0.009 17 0 "[ . 1 . 2]" 1
560 1 45 LEU HB2 1 48 LYS HB2 . . 3.590 2.115 1.999 2.264 . 0 0 "[ . 1 . 2]" 1
561 1 45 LEU HB2 1 48 LYS QB . . 3.010 2.080 1.969 2.230 . 0 0 "[ . 1 . 2]" 1
562 1 45 LEU HB2 1 48 LYS HB3 . . 3.590 3.090 2.834 3.394 . 0 0 "[ . 1 . 2]" 1
563 1 45 LEU HB2 1 48 LYS QD . . 3.580 2.670 1.988 3.578 . 0 0 "[ . 1 . 2]" 1
564 1 45 LEU HB3 1 45 LEU MD1 . . 3.340 2.521 2.417 2.654 . 0 0 "[ . 1 . 2]" 1
565 1 45 LEU HB3 1 45 LEU MD2 . . 3.410 2.242 2.052 2.333 . 0 0 "[ . 1 . 2]" 1
566 1 45 LEU HB3 1 46 VAL H . . 3.850 2.784 2.474 2.966 . 0 0 "[ . 1 . 2]" 1
567 1 45 LEU HB3 1 48 LYS HB2 . . 4.970 3.250 2.860 3.488 . 0 0 "[ . 1 . 2]" 1
568 1 45 LEU HB3 1 48 LYS QB . . 4.260 3.187 2.821 3.414 . 0 0 "[ . 1 . 2]" 1
569 1 45 LEU HB3 1 48 LYS HB3 . . 4.970 4.606 4.273 4.956 . 0 0 "[ . 1 . 2]" 1
570 1 45 LEU HB3 1 48 LYS QD . . 5.050 3.552 2.219 4.667 . 0 0 "[ . 1 . 2]" 1
571 1 45 LEU MD1 1 48 LYS QD . . 3.350 2.296 1.749 3.255 . 0 0 "[ . 1 . 2]" 1
572 1 45 LEU MD1 1 48 LYS QE . . 4.180 3.246 1.851 3.973 . 0 0 "[ . 1 . 2]" 1
573 1 45 LEU MD1 1 121 PRO HA . . 3.710 2.986 2.690 3.301 . 0 0 "[ . 1 . 2]" 1
574 1 45 LEU MD1 1 121 PRO HB2 . . 4.100 3.910 3.407 4.106 0.006 4 0 "[ . 1 . 2]" 1
575 1 45 LEU MD1 1 121 PRO QB . . 3.440 2.669 2.087 3.046 . 0 0 "[ . 1 . 2]" 1
576 1 45 LEU MD1 1 121 PRO HB3 . . 4.100 2.721 2.104 3.146 . 0 0 "[ . 1 . 2]" 1
577 1 45 LEU MD1 1 122 PHE H . . 4.220 3.974 3.571 4.225 0.005 10 0 "[ . 1 . 2]" 1
578 1 45 LEU MD2 1 46 VAL H . . 3.700 3.327 3.046 3.561 . 0 0 "[ . 1 . 2]" 1
579 1 45 LEU MD2 1 119 GLU H . . 4.110 3.236 2.944 3.527 . 0 0 "[ . 1 . 2]" 1
580 1 45 LEU MD2 1 119 GLU HB2 . . 3.440 2.534 2.115 2.776 . 0 0 "[ . 1 . 2]" 1
581 1 45 LEU MD2 1 119 GLU HB3 . . 3.700 3.541 3.197 3.698 . 0 0 "[ . 1 . 2]" 1
582 1 45 LEU MD2 1 120 MET H . . 4.720 4.028 3.801 4.228 . 0 0 "[ . 1 . 2]" 1
583 1 45 LEU MD2 1 121 PRO HA . . 3.160 2.049 1.957 2.247 . 0 0 "[ . 1 . 2]" 1
584 1 45 LEU MD2 1 121 PRO HB2 . . 4.230 4.088 3.690 4.233 0.003 17 0 "[ . 1 . 2]" 1
585 1 45 LEU MD2 1 121 PRO QB . . 3.670 2.894 2.479 3.215 . 0 0 "[ . 1 . 2]" 1
586 1 45 LEU MD2 1 121 PRO HB3 . . 4.230 2.963 2.519 3.333 . 0 0 "[ . 1 . 2]" 1
587 1 45 LEU MD2 1 122 PHE H . . 4.010 3.837 3.509 4.012 0.002 7 0 "[ . 1 . 2]" 1
588 1 45 LEU HG 1 46 VAL H . . 4.960 4.847 4.748 4.948 . 0 0 "[ . 1 . 2]" 1
589 1 46 VAL H 1 46 VAL HB . . 3.200 2.576 2.533 2.635 . 0 0 "[ . 1 . 2]" 1
590 1 46 VAL H 1 46 VAL MG1 . . 4.020 3.765 3.763 3.767 . 0 0 "[ . 1 . 2]" 1
591 1 46 VAL H 1 46 VAL MG2 . . 3.000 2.040 1.914 2.305 . 0 0 "[ . 1 . 2]" 1
592 1 46 VAL H 1 47 GLY H . . 4.650 4.611 4.574 4.634 . 0 0 "[ . 1 . 2]" 1
593 1 46 VAL H 1 92 PRO HG2 . . 4.580 4.478 4.179 4.581 0.001 11 0 "[ . 1 . 2]" 1
594 1 46 VAL H 1 118 ILE MG . . 3.390 2.769 2.600 2.897 . 0 0 "[ . 1 . 2]" 1
595 1 46 VAL H 1 119 GLU H . . 4.510 4.226 3.886 4.513 0.003 4 0 "[ . 1 . 2]" 1
596 1 46 VAL H 1 120 MET HA . . 4.030 3.129 2.997 3.279 . 0 0 "[ . 1 . 2]" 1
597 1 46 VAL H 1 121 PRO QD . . 3.490 2.279 1.955 2.530 . 0 0 "[ . 1 . 2]" 1
598 1 46 VAL HA 1 46 VAL MG1 . . 3.330 2.303 2.234 2.464 . 0 0 "[ . 1 . 2]" 1
599 1 46 VAL HA 1 46 VAL MG2 . . 3.440 2.426 2.313 2.483 . 0 0 "[ . 1 . 2]" 1
600 1 46 VAL HA 1 47 GLY H . . 3.000 2.215 2.166 2.282 . 0 0 "[ . 1 . 2]" 1
601 1 46 VAL HA 1 47 GLY HA2 . . 4.610 4.433 4.416 4.453 . 0 0 "[ . 1 . 2]" 1
602 1 46 VAL HA 1 47 GLY QA . . 4.040 3.967 3.938 3.998 . 0 0 "[ . 1 . 2]" 1
603 1 46 VAL HA 1 47 GLY HA3 . . 4.610 4.475 4.426 4.544 . 0 0 "[ . 1 . 2]" 1
604 1 46 VAL HA 1 48 LYS H . . 3.760 3.367 3.223 3.573 . 0 0 "[ . 1 . 2]" 1
605 1 46 VAL HA 1 92 PRO HG2 . . 4.120 2.077 1.999 2.192 . 0 0 "[ . 1 . 2]" 1
606 1 46 VAL HA 1 92 PRO HG3 . . 4.490 3.343 3.110 3.502 . 0 0 "[ . 1 . 2]" 1
607 1 46 VAL HA 1 118 ILE MG . . 3.760 2.842 2.621 3.028 . 0 0 "[ . 1 . 2]" 1
608 1 46 VAL HB 1 47 GLY H . . 4.160 3.973 3.819 4.147 . 0 0 "[ . 1 . 2]" 1
609 1 46 VAL HB 1 118 ILE MG . . 4.200 4.147 4.020 4.200 0.000 11 0 "[ . 1 . 2]" 1
610 1 46 VAL HB 1 120 MET HA . . 4.200 3.325 2.921 3.692 . 0 0 "[ . 1 . 2]" 1
611 1 46 VAL HB 1 121 PRO QD . . 3.710 2.409 2.074 2.660 . 0 0 "[ . 1 . 2]" 1
612 1 46 VAL MG1 1 47 GLY H . . 3.130 2.214 1.945 2.468 . 0 0 "[ . 1 . 2]" 1
613 1 46 VAL MG1 1 47 GLY HA2 . . 4.160 3.581 3.305 3.696 . 0 0 "[ . 1 . 2]" 1
614 1 46 VAL MG1 1 47 GLY QA . . 3.620 3.026 2.872 3.105 . 0 0 "[ . 1 . 2]" 1
615 1 46 VAL MG1 1 47 GLY HA3 . . 4.160 3.268 3.105 3.416 . 0 0 "[ . 1 . 2]" 1
616 1 46 VAL MG1 1 48 LYS H . . 4.390 4.234 4.163 4.322 . 0 0 "[ . 1 . 2]" 1
617 1 46 VAL MG1 1 92 PRO HG2 . . 3.680 3.506 3.261 3.680 0.000 15 0 "[ . 1 . 2]" 1
618 1 46 VAL MG1 1 93 THR H . . 4.340 3.906 3.445 4.337 . 0 0 "[ . 1 . 2]" 1
619 1 46 VAL MG1 1 93 THR HA . . 3.320 2.933 2.441 3.298 . 0 0 "[ . 1 . 2]" 1
620 1 46 VAL MG1 1 95 PRO HD2 . . 4.400 3.919 3.664 4.326 . 0 0 "[ . 1 . 2]" 1
621 1 46 VAL MG1 1 95 PRO QD . . 3.850 2.687 2.279 3.067 . 0 0 "[ . 1 . 2]" 1
622 1 46 VAL MG1 1 95 PRO HD3 . . 4.400 2.737 2.302 3.137 . 0 0 "[ . 1 . 2]" 1
623 1 46 VAL MG1 1 121 PRO QD . . 4.910 3.773 3.492 3.986 . 0 0 "[ . 1 . 2]" 1
624 1 46 VAL MG2 1 47 GLY H . . 4.000 3.954 3.864 4.001 0.001 12 0 "[ . 1 . 2]" 1
625 1 46 VAL MG2 1 92 PRO QB . . 4.850 3.484 3.045 3.795 . 0 0 "[ . 1 . 2]" 1
626 1 46 VAL MG2 1 92 PRO HG2 . . 4.360 3.877 3.676 4.067 . 0 0 "[ . 1 . 2]" 1
627 1 46 VAL MG2 1 94 LYS H . . 4.500 3.979 3.471 4.346 . 0 0 "[ . 1 . 2]" 1
628 1 46 VAL MG2 1 94 LYS HA . . 4.210 2.837 2.347 3.156 . 0 0 "[ . 1 . 2]" 1
629 1 46 VAL MG2 1 95 PRO HA . . 3.590 2.519 2.225 2.790 . 0 0 "[ . 1 . 2]" 1
630 1 46 VAL MG2 1 95 PRO HB2 . . 4.120 3.713 3.237 4.033 . 0 0 "[ . 1 . 2]" 1
631 1 46 VAL MG2 1 95 PRO QB . . 3.480 2.337 1.861 2.651 . 0 0 "[ . 1 . 2]" 1
632 1 46 VAL MG2 1 95 PRO HB3 . . 4.120 2.362 1.873 2.688 . 0 0 "[ . 1 . 2]" 1
633 1 46 VAL MG2 1 95 PRO HD2 . . 3.830 3.404 3.120 3.719 . 0 0 "[ . 1 . 2]" 1
634 1 46 VAL MG2 1 95 PRO QD . . 3.360 2.022 1.821 2.281 . 0 0 "[ . 1 . 2]" 1
635 1 46 VAL MG2 1 95 PRO HD3 . . 3.830 2.037 1.833 2.305 . 0 0 "[ . 1 . 2]" 1
636 1 46 VAL MG2 1 95 PRO QG . . 3.470 3.011 2.570 3.396 . 0 0 "[ . 1 . 2]" 1
637 1 46 VAL MG2 1 96 GLY H . . 4.640 4.186 3.971 4.462 . 0 0 "[ . 1 . 2]" 1
638 1 46 VAL MG2 1 120 MET H . . 4.440 4.248 3.899 4.447 0.007 4 0 "[ . 1 . 2]" 1
639 1 46 VAL MG2 1 120 MET HA . . 4.370 2.715 2.392 3.060 . 0 0 "[ . 1 . 2]" 1
640 1 46 VAL MG2 1 120 MET ME . . 3.910 3.213 1.943 3.913 0.003 9 0 "[ . 1 . 2]" 1
641 1 46 VAL MG2 1 120 MET HG2 . . 4.250 2.686 2.205 3.013 . 0 0 "[ . 1 . 2]" 1
642 1 46 VAL MG2 1 120 MET QG . . 3.730 2.621 2.181 2.942 . 0 0 "[ . 1 . 2]" 1
643 1 46 VAL MG2 1 120 MET HG3 . . 4.250 3.750 3.410 4.195 . 0 0 "[ . 1 . 2]" 1
644 1 46 VAL MG2 1 121 PRO QD . . 4.070 2.983 2.651 3.350 . 0 0 "[ . 1 . 2]" 1
645 1 47 GLY H 1 48 LYS H . . 3.150 2.808 2.634 3.013 . 0 0 "[ . 1 . 2]" 1
646 1 47 GLY H 1 91 LEU MD2 . . 3.990 3.940 3.739 3.995 0.005 19 0 "[ . 1 . 2]" 1
647 1 47 GLY H 1 92 PRO QB . . 4.350 3.658 3.312 3.948 . 0 0 "[ . 1 . 2]" 1
648 1 47 GLY H 1 92 PRO HG2 . . 4.020 2.506 2.028 2.818 . 0 0 "[ . 1 . 2]" 1
649 1 47 GLY H 1 92 PRO HG3 . . 4.600 4.273 3.797 4.591 . 0 0 "[ . 1 . 2]" 1
650 1 47 GLY H 1 93 THR H . . 5.210 4.725 4.343 5.101 . 0 0 "[ . 1 . 2]" 1
651 1 47 GLY H 1 93 THR HA . . 4.070 3.629 3.316 4.068 . 0 0 "[ . 1 . 2]" 1
652 1 47 GLY H 1 93 THR MG . . 5.500 5.242 4.788 5.506 0.006 19 0 "[ . 1 . 2]" 1
653 1 47 GLY QA 1 91 LEU MD2 . . 3.150 2.877 2.638 3.145 . 0 0 "[ . 1 . 2]" 1
654 1 48 LYS H 1 48 LYS HB2 . . 3.700 2.370 2.213 2.529 . 0 0 "[ . 1 . 2]" 1
655 1 48 LYS H 1 48 LYS QB . . 2.890 2.337 2.190 2.485 . 0 0 "[ . 1 . 2]" 1
656 1 48 LYS H 1 48 LYS HB3 . . 3.700 3.579 3.489 3.689 . 0 0 "[ . 1 . 2]" 1
657 1 48 LYS H 1 48 LYS HG2 . . 4.260 3.931 3.202 4.251 . 0 0 "[ . 1 . 2]" 1
658 1 48 LYS H 1 48 LYS QG . . 3.600 3.296 3.072 3.600 0.000 19 0 "[ . 1 . 2]" 1
659 1 48 LYS H 1 48 LYS HG3 . . 4.260 3.636 3.248 4.125 . 0 0 "[ . 1 . 2]" 1
660 1 48 LYS H 1 49 PRO HD2 . . 5.010 4.831 4.822 4.838 . 0 0 "[ . 1 . 2]" 1
661 1 48 LYS H 1 49 PRO HD3 . . 5.160 4.954 4.862 5.011 . 0 0 "[ . 1 . 2]" 1
662 1 48 LYS H 1 91 LEU MD2 . . 3.680 3.279 2.793 3.683 0.003 17 0 "[ . 1 . 2]" 1
663 1 48 LYS H 1 92 PRO QD . . 3.840 3.320 2.715 3.858 0.018 6 0 "[ . 1 . 2]" 1
664 1 48 LYS H 1 92 PRO HG2 . . 4.290 3.273 2.886 3.676 . 0 0 "[ . 1 . 2]" 1
665 1 48 LYS H 1 92 PRO HG3 . . 5.000 4.458 4.085 4.890 . 0 0 "[ . 1 . 2]" 1
666 1 48 LYS HA 1 48 LYS QD . . 4.110 3.456 2.392 3.986 . 0 0 "[ . 1 . 2]" 1
667 1 48 LYS HA 1 49 PRO HD2 . . 3.480 2.293 2.246 2.329 . 0 0 "[ . 1 . 2]" 1
668 1 48 LYS HA 1 49 PRO HD3 . . 3.430 2.269 2.259 2.278 . 0 0 "[ . 1 . 2]" 1
669 1 48 LYS HA 1 49 PRO HG2 . . 4.510 4.426 4.389 4.455 . 0 0 "[ . 1 . 2]" 1
670 1 48 LYS HA 1 49 PRO HG3 . . 4.510 4.413 4.390 4.432 . 0 0 "[ . 1 . 2]" 1
671 1 48 LYS QB 1 48 LYS QD . . 3.250 2.134 2.023 2.228 . 0 0 "[ . 1 . 2]" 1
672 1 48 LYS QB 1 48 LYS QE . . 4.490 3.430 2.391 3.810 . 0 0 "[ . 1 . 2]" 1
673 1 48 LYS QB 1 49 PRO HD2 . . 3.390 2.439 2.272 2.600 . 0 0 "[ . 1 . 2]" 1
674 1 48 LYS QB 1 49 PRO HD3 . . 4.170 3.699 3.585 3.808 . 0 0 "[ . 1 . 2]" 1
675 1 48 LYS QD 1 49 PRO HD2 . . 4.440 3.245 1.988 4.441 0.001 10 0 "[ . 1 . 2]" 1
676 1 48 LYS QD 1 49 PRO HD3 . . 5.100 4.513 3.014 5.102 0.002 17 0 "[ . 1 . 2]" 1
677 1 48 LYS QG 1 49 PRO HD3 . . 4.400 3.735 3.488 4.380 . 0 0 "[ . 1 . 2]" 1
678 1 48 LYS HG2 1 49 PRO HD2 . . 4.660 3.102 2.500 3.956 . 0 0 "[ . 1 . 2]" 1
679 1 48 LYS HG3 1 49 PRO HD2 . . 4.660 4.104 2.818 4.441 . 0 0 "[ . 1 . 2]" 1
680 1 49 PRO HA 1 50 ALA H . . 2.860 2.216 2.155 2.334 . 0 0 "[ . 1 . 2]" 1
681 1 49 PRO HA 1 50 ALA MB . . 4.160 3.849 3.767 3.921 . 0 0 "[ . 1 . 2]" 1
682 1 49 PRO HA 1 90 TYR H . . 4.650 4.470 4.209 4.652 0.002 10 0 "[ . 1 . 2]" 1
683 1 49 PRO HA 1 91 LEU HA . . 4.250 3.206 2.630 3.609 . 0 0 "[ . 1 . 2]" 1
684 1 49 PRO HA 1 91 LEU HB3 . . 5.130 4.875 4.530 5.134 0.004 16 0 "[ . 1 . 2]" 1
685 1 49 PRO HA 1 91 LEU MD1 . . 3.960 3.705 3.558 3.841 . 0 0 "[ . 1 . 2]" 1
686 1 49 PRO HA 1 91 LEU MD2 . . 3.300 2.557 2.273 2.822 . 0 0 "[ . 1 . 2]" 1
687 1 49 PRO HA 1 91 LEU HG . . 4.500 2.316 2.141 2.463 . 0 0 "[ . 1 . 2]" 1
688 1 49 PRO HA 1 92 PRO QD . . 4.870 3.805 3.224 4.224 . 0 0 "[ . 1 . 2]" 1
689 1 49 PRO QB 1 89 SER HB3 . . 4.680 4.308 3.897 4.456 . 0 0 "[ . 1 . 2]" 1
690 1 49 PRO HB2 1 50 ALA H . . 4.090 3.226 2.789 3.529 . 0 0 "[ . 1 . 2]" 1
691 1 49 PRO HB2 1 89 SER HB2 . . 4.180 3.578 2.861 3.931 . 0 0 "[ . 1 . 2]" 1
692 1 49 PRO HB3 1 50 ALA H . . 4.090 3.807 3.546 3.997 . 0 0 "[ . 1 . 2]" 1
693 1 49 PRO HB3 1 89 SER HB2 . . 4.180 3.985 3.518 4.158 . 0 0 "[ . 1 . 2]" 1
694 1 49 PRO HD2 1 91 LEU MD2 . . 4.550 3.687 3.406 3.919 . 0 0 "[ . 1 . 2]" 1
695 1 49 PRO HD3 1 91 LEU MD1 . . 4.490 4.017 3.699 4.262 . 0 0 "[ . 1 . 2]" 1
696 1 49 PRO HD3 1 91 LEU MD2 . . 3.980 2.562 2.276 2.849 . 0 0 "[ . 1 . 2]" 1
697 1 49 PRO HD3 1 91 LEU HG . . 5.500 4.322 3.881 4.566 . 0 0 "[ . 1 . 2]" 1
698 1 49 PRO QG 1 50 ALA H . . 4.820 4.515 4.280 4.657 . 0 0 "[ . 1 . 2]" 1
699 1 50 ALA H 1 50 ALA MB . . 3.130 2.603 2.515 2.699 . 0 0 "[ . 1 . 2]" 1
700 1 50 ALA H 1 51 GLU H . . 4.180 4.118 4.027 4.182 0.002 13 0 "[ . 1 . 2]" 1
701 1 50 ALA H 1 51 GLU HA . . 5.130 4.774 4.680 4.849 . 0 0 "[ . 1 . 2]" 1
702 1 50 ALA H 1 89 SER HA . . 4.120 3.808 3.612 3.928 . 0 0 "[ . 1 . 2]" 1
703 1 50 ALA H 1 89 SER HB2 . . 4.060 3.456 3.225 3.640 . 0 0 "[ . 1 . 2]" 1
704 1 50 ALA H 1 89 SER HB3 . . 4.810 4.658 4.500 4.820 0.010 10 0 "[ . 1 . 2]" 1
705 1 50 ALA H 1 90 TYR H . . 3.390 2.755 2.580 2.861 . 0 0 "[ . 1 . 2]" 1
706 1 50 ALA H 1 91 LEU HA . . 4.130 3.995 3.840 4.121 . 0 0 "[ . 1 . 2]" 1
707 1 50 ALA H 1 91 LEU MD1 . . 5.390 5.105 4.938 5.255 . 0 0 "[ . 1 . 2]" 1
708 1 50 ALA H 1 91 LEU MD2 . . 4.660 4.369 4.197 4.598 . 0 0 "[ . 1 . 2]" 1
709 1 50 ALA H 1 91 LEU HG . . 4.720 3.875 3.763 4.051 . 0 0 "[ . 1 . 2]" 1
710 1 50 ALA H 1 92 PRO QD . . 4.320 4.116 4.050 4.227 . 0 0 "[ . 1 . 2]" 1
711 1 50 ALA HA 1 51 GLU H . . 2.820 2.145 2.142 2.158 . 0 0 "[ . 1 . 2]" 1
712 1 50 ALA HA 1 90 TYR H . . 5.110 4.688 4.604 4.776 . 0 0 "[ . 1 . 2]" 1
713 1 50 ALA MB 1 51 GLU H . . 3.560 3.246 3.137 3.350 . 0 0 "[ . 1 . 2]" 1
714 1 50 ALA MB 1 51 GLU QG . . 4.560 4.507 4.421 4.559 . 0 0 "[ . 1 . 2]" 1
715 1 50 ALA MB 1 90 TYR H . . 3.660 3.586 3.485 3.655 . 0 0 "[ . 1 . 2]" 1
716 1 50 ALA MB 1 90 TYR QD . . 4.200 3.382 3.247 3.514 . 0 0 "[ . 1 . 2]" 1
717 1 50 ALA MB 1 90 TYR QE . . 3.780 2.463 2.243 2.733 . 0 0 "[ . 1 . 2]" 1
718 1 50 ALA MB 1 90 TYR HH . . 3.790 3.183 2.886 3.490 . 0 0 "[ . 1 . 2]" 1
719 1 50 ALA MB 1 91 LEU HG . . 5.500 5.277 5.075 5.442 . 0 0 "[ . 1 . 2]" 1
720 1 50 ALA MB 1 92 PRO HD2 . . 4.240 4.023 3.850 4.191 . 0 0 "[ . 1 . 2]" 1
721 1 50 ALA MB 1 92 PRO HD3 . . 4.240 3.396 3.179 3.534 . 0 0 "[ . 1 . 2]" 1
722 1 50 ALA MB 1 92 PRO HG2 . . 5.190 5.087 4.961 5.194 0.004 10 0 "[ . 1 . 2]" 1
723 1 50 ALA MB 1 92 PRO HG3 . . 4.120 4.090 4.025 4.125 0.005 8 0 "[ . 1 . 2]" 1
724 1 50 ALA MB 1 116 ALA MB . . 4.680 4.518 4.312 4.684 0.004 5 0 "[ . 1 . 2]" 1
725 1 51 GLU H 1 51 GLU HB2 . . 3.860 3.740 3.640 3.802 . 0 0 "[ . 1 . 2]" 1
726 1 51 GLU H 1 51 GLU HB3 . . 3.580 3.422 3.373 3.516 . 0 0 "[ . 1 . 2]" 1
727 1 51 GLU H 1 51 GLU QG . . 3.250 2.075 1.897 2.271 . 0 0 "[ . 1 . 2]" 1
728 1 51 GLU H 1 52 PHE H . . 4.490 4.429 4.412 4.470 . 0 0 "[ . 1 . 2]" 1
729 1 51 GLU HA 1 51 GLU QG . . 3.850 3.324 3.257 3.378 . 0 0 "[ . 1 . 2]" 1
730 1 51 GLU HA 1 52 PHE H . . 2.740 2.516 2.431 2.572 . 0 0 "[ . 1 . 2]" 1
731 1 51 GLU HA 1 89 SER H . . 5.090 4.892 4.653 5.002 . 0 0 "[ . 1 . 2]" 1
732 1 51 GLU HA 1 89 SER HA . . 3.750 2.573 2.384 2.667 . 0 0 "[ . 1 . 2]" 1
733 1 51 GLU HA 1 89 SER HB2 . . 4.970 4.746 4.466 4.903 . 0 0 "[ . 1 . 2]" 1
734 1 51 GLU HA 1 89 SER HB3 . . 4.270 4.171 4.032 4.276 0.006 5 0 "[ . 1 . 2]" 1
735 1 51 GLU HA 1 90 TYR H . . 4.030 3.640 3.475 3.771 . 0 0 "[ . 1 . 2]" 1
736 1 51 GLU HB2 1 52 PHE H . . 3.740 2.187 2.064 2.418 . 0 0 "[ . 1 . 2]" 1
737 1 51 GLU HB3 1 52 PHE H . . 3.490 3.447 3.385 3.487 . 0 0 "[ . 1 . 2]" 1
738 1 51 GLU HB3 1 89 SER H . . 4.830 3.827 3.540 4.142 . 0 0 "[ . 1 . 2]" 1
739 1 51 GLU HB3 1 89 SER HB2 . . 3.990 3.283 2.923 3.451 . 0 0 "[ . 1 . 2]" 1
740 1 51 GLU HB3 1 89 SER HB3 . . 3.880 2.101 2.042 2.178 . 0 0 "[ . 1 . 2]" 1
741 1 51 GLU QG 1 89 SER HA . . 4.170 3.717 3.417 3.868 . 0 0 "[ . 1 . 2]" 1
742 1 51 GLU QG 1 89 SER HB2 . . 4.460 3.863 3.451 4.077 . 0 0 "[ . 1 . 2]" 1
743 1 51 GLU QG 1 89 SER HB3 . . 3.490 3.014 2.622 3.338 . 0 0 "[ . 1 . 2]" 1
744 1 51 GLU QG 1 90 TYR H . . 5.090 4.969 4.685 5.077 . 0 0 "[ . 1 . 2]" 1
745 1 52 PHE H 1 52 PHE QD . . 3.880 2.722 2.319 3.157 . 0 0 "[ . 1 . 2]" 1
746 1 52 PHE H 1 53 THR H . . 4.470 4.397 4.386 4.416 . 0 0 "[ . 1 . 2]" 1
747 1 52 PHE H 1 87 SER HA . . 4.670 4.028 3.550 4.664 . 0 0 "[ . 1 . 2]" 1
748 1 52 PHE H 1 88 VAL HB . . 4.220 4.080 3.617 4.219 . 0 0 "[ . 1 . 2]" 1
749 1 52 PHE H 1 89 SER HA . . 4.630 4.519 4.381 4.621 . 0 0 "[ . 1 . 2]" 1
750 1 52 PHE H 1 89 SER HB3 . . 5.500 5.450 5.387 5.500 . 0 0 "[ . 1 . 2]" 1
751 1 52 PHE HA 1 53 THR H . . 3.110 2.553 2.515 2.573 . 0 0 "[ . 1 . 2]" 1
752 1 52 PHE HB2 1 53 THR H . . 3.430 2.115 2.071 2.187 . 0 0 "[ . 1 . 2]" 1
753 1 52 PHE HB3 1 53 THR H . . 3.550 3.408 3.328 3.499 . 0 0 "[ . 1 . 2]" 1
754 1 52 PHE QD 1 53 THR H . . 3.790 3.556 3.380 3.785 . 0 0 "[ . 1 . 2]" 1
755 1 52 PHE QD 1 54 ILE MD . . 4.130 3.313 2.922 3.689 . 0 0 "[ . 1 . 2]" 1
756 1 52 PHE QD 1 54 ILE HG12 . . 4.280 2.805 2.598 3.141 . 0 0 "[ . 1 . 2]" 1
757 1 52 PHE QD 1 54 ILE HG13 . . 4.530 2.541 2.000 2.969 . 0 0 "[ . 1 . 2]" 1
758 1 52 PHE QD 1 88 VAL HB . . 4.910 4.322 3.913 4.571 . 0 0 "[ . 1 . 2]" 1
759 1 52 PHE QD 1 102 ILE MD . . 4.470 4.059 3.794 4.464 . 0 0 "[ . 1 . 2]" 1
760 1 52 PHE QE 1 54 ILE MD . . 3.370 2.062 1.899 2.320 . 0 0 "[ . 1 . 2]" 1
761 1 52 PHE QE 1 54 ILE HG13 . . 4.450 2.999 2.664 3.351 . 0 0 "[ . 1 . 2]" 1
762 1 52 PHE QE 1 66 LEU MD1 . . 3.930 3.385 3.003 3.930 0.000 19 0 "[ . 1 . 2]" 1
763 1 52 PHE QE 1 88 VAL HB . . 4.780 3.217 2.591 3.671 . 0 0 "[ . 1 . 2]" 1
764 1 52 PHE QE 1 88 VAL MG1 . . 3.870 3.388 2.478 3.833 . 0 0 "[ . 1 . 2]" 1
765 1 52 PHE QE 1 90 TYR QD . . 4.370 2.983 2.632 3.550 . 0 0 "[ . 1 . 2]" 1
766 1 52 PHE QE 1 90 TYR QE . . 4.410 3.551 3.065 4.302 . 0 0 "[ . 1 . 2]" 1
767 1 52 PHE QE 1 100 VAL MG1 . . 3.770 3.185 2.916 3.434 . 0 0 "[ . 1 . 2]" 1
768 1 52 PHE QE 1 100 VAL MG2 . . 4.600 3.403 2.980 3.781 . 0 0 "[ . 1 . 2]" 1
769 1 52 PHE QE 1 102 ILE MD . . 3.690 2.734 2.321 3.307 . 0 0 "[ . 1 . 2]" 1
770 1 52 PHE HZ 1 54 ILE HG13 . . 5.310 5.022 4.483 5.290 . 0 0 "[ . 1 . 2]" 1
771 1 52 PHE HZ 1 66 LEU MD1 . . 4.070 2.589 2.102 3.425 . 0 0 "[ . 1 . 2]" 1
772 1 52 PHE HZ 1 66 LEU MD2 . . 4.550 2.435 2.074 2.836 . 0 0 "[ . 1 . 2]" 1
773 1 52 PHE HZ 1 88 VAL MG1 . . 3.770 3.350 2.299 3.770 . 0 0 "[ . 1 . 2]" 1
774 1 52 PHE HZ 1 100 VAL HB . . 5.500 4.839 4.469 5.182 . 0 0 "[ . 1 . 2]" 1
775 1 52 PHE HZ 1 100 VAL MG1 . . 3.630 2.528 2.168 2.960 . 0 0 "[ . 1 . 2]" 1
776 1 53 THR H 1 53 THR HB . . 3.280 2.708 2.634 2.813 . 0 0 "[ . 1 . 2]" 1
777 1 53 THR H 1 53 THR MG . . 3.960 3.866 3.849 3.888 . 0 0 "[ . 1 . 2]" 1
778 1 53 THR H 1 54 ILE H . . 4.470 4.353 4.249 4.423 . 0 0 "[ . 1 . 2]" 1
779 1 53 THR HA 1 53 THR MG . . 3.470 2.213 2.100 2.356 . 0 0 "[ . 1 . 2]" 1
780 1 53 THR HA 1 54 ILE H . . 2.860 2.145 2.141 2.151 . 0 0 "[ . 1 . 2]" 1
781 1 53 THR HA 1 85 THR HB . . 4.540 4.380 3.545 4.542 0.002 9 0 "[ . 1 . 2]" 1
782 1 53 THR HA 1 86 CYS H . . 4.670 4.361 3.471 4.613 . 0 0 "[ . 1 . 2]" 1
783 1 53 THR HB 1 54 ILE H . . 4.320 4.157 4.031 4.278 . 0 0 "[ . 1 . 2]" 1
784 1 53 THR MG 1 54 ILE H . . 3.160 2.603 2.429 2.889 . 0 0 "[ . 1 . 2]" 1
785 1 53 THR MG 1 54 ILE HA . . 4.830 4.070 3.855 4.257 . 0 0 "[ . 1 . 2]" 1
786 1 53 THR MG 1 86 CYS H . . 4.030 3.918 3.450 4.034 0.004 16 0 "[ . 1 . 2]" 1
787 1 54 ILE H 1 54 ILE HB . . 3.510 2.561 2.444 2.624 . 0 0 "[ . 1 . 2]" 1
788 1 54 ILE H 1 54 ILE MD . . 3.950 3.893 3.833 3.951 0.001 10 0 "[ . 1 . 2]" 1
789 1 54 ILE H 1 54 ILE HG12 . . 4.020 3.887 3.724 4.018 . 0 0 "[ . 1 . 2]" 1
790 1 54 ILE H 1 54 ILE HG13 . . 3.480 2.688 2.514 2.842 . 0 0 "[ . 1 . 2]" 1
791 1 54 ILE H 1 54 ILE MG . . 3.840 3.813 3.756 3.842 0.002 18 0 "[ . 1 . 2]" 1
792 1 54 ILE H 1 55 ASP H . . 4.620 4.460 4.395 4.557 . 0 0 "[ . 1 . 2]" 1
793 1 54 ILE H 1 85 THR HA . . 4.870 4.566 3.923 4.878 0.008 4 0 "[ . 1 . 2]" 1
794 1 54 ILE H 1 85 THR HB . . 3.920 3.553 3.261 3.894 . 0 0 "[ . 1 . 2]" 1
795 1 54 ILE H 1 86 CYS H . . 3.450 2.833 2.323 2.967 . 0 0 "[ . 1 . 2]" 1
796 1 54 ILE H 1 86 CYS QB . . 4.040 3.874 3.491 4.022 . 0 0 "[ . 1 . 2]" 1
797 1 54 ILE HA 1 54 ILE MD . . 4.700 3.839 3.802 3.869 . 0 0 "[ . 1 . 2]" 1
798 1 54 ILE HA 1 55 ASP H . . 3.400 2.176 2.156 2.253 . 0 0 "[ . 1 . 2]" 1
799 1 54 ILE HB 1 54 ILE MD . . 3.320 2.348 2.276 2.463 . 0 0 "[ . 1 . 2]" 1
800 1 54 ILE HB 1 55 ASP H . . 4.760 4.094 3.959 4.215 . 0 0 "[ . 1 . 2]" 1
801 1 54 ILE HB 1 56 THR MG . . 4.350 3.710 3.291 4.264 . 0 0 "[ . 1 . 2]" 1
802 1 54 ILE HB 1 86 CYS H . . 4.110 2.834 2.318 3.208 . 0 0 "[ . 1 . 2]" 1
803 1 54 ILE HB 1 86 CYS HB2 . . 4.020 2.574 2.070 3.914 . 0 0 "[ . 1 . 2]" 1
804 1 54 ILE HB 1 86 CYS HB3 . . 4.020 3.630 2.409 4.021 0.001 5 0 "[ . 1 . 2]" 1
805 1 54 ILE MD 1 54 ILE MG . . 2.870 2.084 1.919 2.251 . 0 0 "[ . 1 . 2]" 1
806 1 54 ILE MD 1 55 ASP H . . 5.090 4.998 4.753 5.087 . 0 0 "[ . 1 . 2]" 1
807 1 54 ILE MD 1 86 CYS HB2 . . 4.370 2.829 2.086 3.824 . 0 0 "[ . 1 . 2]" 1
808 1 54 ILE MD 1 86 CYS QB . . 3.770 2.544 2.014 3.032 . 0 0 "[ . 1 . 2]" 1
809 1 54 ILE MD 1 86 CYS HB3 . . 4.370 3.143 2.655 3.589 . 0 0 "[ . 1 . 2]" 1
810 1 54 ILE MD 1 88 VAL H . . 5.220 3.738 3.014 4.784 . 0 0 "[ . 1 . 2]" 1
811 1 54 ILE MD 1 88 VAL HB . . 4.650 3.581 3.063 4.310 . 0 0 "[ . 1 . 2]" 1
812 1 54 ILE MD 1 88 VAL MG2 . . 3.150 2.541 1.995 3.091 . 0 0 "[ . 1 . 2]" 1
813 1 54 ILE MD 1 102 ILE MD . . 3.380 2.912 2.536 3.222 . 0 0 "[ . 1 . 2]" 1
814 1 54 ILE HG13 1 54 ILE MG . . 3.490 3.193 3.181 3.203 . 0 0 "[ . 1 . 2]" 1
815 1 54 ILE HG13 1 88 VAL MG2 . . 4.540 4.211 3.890 4.548 0.008 10 0 "[ . 1 . 2]" 1
816 1 54 ILE HG13 1 102 ILE MD . . 4.840 4.653 4.387 4.827 . 0 0 "[ . 1 . 2]" 1
817 1 54 ILE MG 1 55 ASP H . . 3.630 2.314 2.085 2.603 . 0 0 "[ . 1 . 2]" 1
818 1 54 ILE MG 1 56 THR MG . . 2.990 2.078 1.826 2.450 . 0 0 "[ . 1 . 2]" 1
819 1 54 ILE MG 1 86 CYS H . . 4.690 4.065 3.437 4.409 . 0 0 "[ . 1 . 2]" 1
820 1 55 ASP H 1 55 ASP HB2 . . 3.810 2.682 2.302 3.260 . 0 0 "[ . 1 . 2]" 1
821 1 55 ASP H 1 55 ASP QB . . 3.340 2.379 2.187 2.618 . 0 0 "[ . 1 . 2]" 1
822 1 55 ASP H 1 55 ASP HB3 . . 3.810 3.030 2.230 3.721 . 0 0 "[ . 1 . 2]" 1
823 1 55 ASP H 1 56 THR H . . 4.620 4.202 3.818 4.453 . 0 0 "[ . 1 . 2]" 1
824 1 55 ASP H 1 56 THR MG . . 4.240 4.021 3.526 4.213 . 0 0 "[ . 1 . 2]" 1
825 1 55 ASP HA 1 56 THR H . . 3.010 2.175 2.138 2.314 . 0 0 "[ . 1 . 2]" 1
826 1 55 ASP HA 1 57 LYS H . . 3.910 3.473 3.223 3.717 . 0 0 "[ . 1 . 2]" 1
827 1 55 ASP HA 1 85 THR HA . . 3.930 3.607 3.015 3.921 . 0 0 "[ . 1 . 2]" 1
828 1 55 ASP HA 1 85 THR HB . . 5.250 4.661 4.128 5.130 . 0 0 "[ . 1 . 2]" 1
829 1 55 ASP HA 1 85 THR MG . . 3.450 2.667 2.338 3.070 . 0 0 "[ . 1 . 2]" 1
830 1 55 ASP HA 1 86 CYS H . . 5.210 4.923 4.540 5.205 . 0 0 "[ . 1 . 2]" 1
831 1 55 ASP QB 1 56 THR H . . 4.180 3.748 3.338 3.958 . 0 0 "[ . 1 . 2]" 1
832 1 55 ASP QB 1 57 LYS H . . 4.670 3.911 3.023 4.625 . 0 0 "[ . 1 . 2]" 1
833 1 55 ASP QB 1 85 THR MG . . 4.450 4.057 3.213 4.446 . 0 0 "[ . 1 . 2]" 1
834 1 55 ASP HB2 1 56 THR H . . 4.920 4.427 3.960 4.613 . 0 0 "[ . 1 . 2]" 1
835 1 55 ASP HB2 1 57 LYS H . . 5.500 4.945 4.589 5.230 . 0 0 "[ . 1 . 2]" 1
836 1 55 ASP HB3 1 56 THR H . . 4.920 4.093 3.490 4.547 . 0 0 "[ . 1 . 2]" 1
837 1 55 ASP HB3 1 57 LYS H . . 5.500 4.204 3.063 5.382 . 0 0 "[ . 1 . 2]" 1
838 1 56 THR H 1 56 THR MG . . 3.790 2.943 2.527 3.436 . 0 0 "[ . 1 . 2]" 1
839 1 56 THR H 1 57 LYS HA . . 4.800 4.449 4.232 4.739 . 0 0 "[ . 1 . 2]" 1
840 1 56 THR H 1 84 GLY QA . . 5.340 4.486 3.517 5.113 . 0 0 "[ . 1 . 2]" 1
841 1 56 THR H 1 85 THR HA . . 4.250 3.306 2.673 3.657 . 0 0 "[ . 1 . 2]" 1
842 1 56 THR H 1 85 THR MG . . 3.900 3.460 2.929 3.860 . 0 0 "[ . 1 . 2]" 1
843 1 56 THR HA 1 56 THR MG . . 3.250 2.272 2.071 2.499 . 0 0 "[ . 1 . 2]" 1
844 1 56 THR HA 1 59 ALA H . . 4.580 3.737 3.317 4.087 . 0 0 "[ . 1 . 2]" 1
845 1 56 THR HA 1 59 ALA MB . . 3.550 2.483 2.069 2.982 . 0 0 "[ . 1 . 2]" 1
846 1 56 THR HB 1 57 LYS H . . 5.050 4.283 3.853 4.511 . 0 0 "[ . 1 . 2]" 1
847 1 56 THR HB 1 59 ALA H . . 4.640 4.415 3.703 4.635 . 0 0 "[ . 1 . 2]" 1
848 1 56 THR HB 1 59 ALA MB . . 4.010 2.946 2.038 3.564 . 0 0 "[ . 1 . 2]" 1
849 1 56 THR HB 1 60 GLY H . . 4.760 4.432 3.735 4.773 0.013 10 0 "[ . 1 . 2]" 1
850 1 56 THR MG 1 57 LYS H . . 4.770 4.269 4.033 4.435 . 0 0 "[ . 1 . 2]" 1
851 1 56 THR MG 1 104 PHE QD . . 4.730 4.389 3.931 4.725 . 0 0 "[ . 1 . 2]" 1
852 1 56 THR MG 1 104 PHE QE . . 4.060 3.917 3.324 4.060 . 0 0 "[ . 1 . 2]" 1
853 1 57 LYS H 1 57 LYS HB2 . . 3.850 3.018 2.530 3.617 . 0 0 "[ . 1 . 2]" 1
854 1 57 LYS H 1 57 LYS QB . . 3.190 2.572 2.483 2.818 . 0 0 "[ . 1 . 2]" 1
855 1 57 LYS H 1 57 LYS HB3 . . 3.850 3.214 2.582 3.627 . 0 0 "[ . 1 . 2]" 1
856 1 57 LYS H 1 57 LYS HD2 . . 4.700 3.896 1.890 4.646 . 0 0 "[ . 1 . 2]" 1
857 1 57 LYS H 1 57 LYS QD . . 4.000 3.463 1.828 3.980 . 0 0 "[ . 1 . 2]" 1
858 1 57 LYS H 1 57 LYS HD3 . . 4.700 4.073 1.895 4.675 . 0 0 "[ . 1 . 2]" 1
859 1 57 LYS H 1 57 LYS QE . . 4.600 3.804 2.708 4.583 . 0 0 "[ . 1 . 2]" 1
860 1 57 LYS H 1 57 LYS HG2 . . 3.720 2.705 1.911 3.753 0.033 14 0 "[ . 1 . 2]" 1
861 1 57 LYS H 1 57 LYS QG . . 3.230 2.029 1.901 2.738 . 0 0 "[ . 1 . 2]" 1
862 1 57 LYS H 1 57 LYS HG3 . . 3.720 2.746 1.924 3.534 . 0 0 "[ . 1 . 2]" 1
863 1 57 LYS H 1 59 ALA H . . 5.130 4.158 3.732 4.657 . 0 0 "[ . 1 . 2]" 1
864 1 57 LYS H 1 85 THR MG . . 5.090 4.464 3.733 4.959 . 0 0 "[ . 1 . 2]" 1
865 1 57 LYS HA 1 57 LYS HG2 . . 3.930 3.232 2.584 3.711 . 0 0 "[ . 1 . 2]" 1
866 1 57 LYS HA 1 57 LYS HG3 . . 3.930 3.391 2.447 3.914 . 0 0 "[ . 1 . 2]" 1
867 1 57 LYS HA 1 59 ALA H . . 3.920 3.770 3.511 3.922 0.002 15 0 "[ . 1 . 2]" 1
868 1 57 LYS QB 1 57 LYS QD . . 3.250 2.174 2.029 2.335 . 0 0 "[ . 1 . 2]" 1
869 1 57 LYS QB 1 57 LYS QE . . 3.490 2.947 1.920 3.597 0.107 6 0 "[ . 1 . 2]" 1
870 1 57 LYS HB2 1 57 LYS HE2 . . 4.770 4.069 2.143 4.751 . 0 0 "[ . 1 . 2]" 1
871 1 57 LYS HB2 1 57 LYS HE3 . . 4.770 4.184 2.035 4.762 . 0 0 "[ . 1 . 2]" 1
872 1 57 LYS HB2 1 58 GLY H . . 4.760 3.428 2.256 4.323 . 0 0 "[ . 1 . 2]" 1
873 1 57 LYS HB3 1 57 LYS HE2 . . 4.770 3.810 2.008 4.699 . 0 0 "[ . 1 . 2]" 1
874 1 57 LYS HB3 1 57 LYS HE3 . . 4.770 3.927 2.261 4.775 0.005 6 0 "[ . 1 . 2]" 1
875 1 57 LYS HB3 1 58 GLY H . . 4.760 3.733 3.212 4.352 . 0 0 "[ . 1 . 2]" 1
876 1 57 LYS QE 1 57 LYS QG . . 3.100 2.213 2.090 2.714 . 0 0 "[ . 1 . 2]" 1
877 1 57 LYS HE2 1 57 LYS HG2 . . 4.190 2.920 2.224 3.653 . 0 0 "[ . 1 . 2]" 1
878 1 57 LYS HE2 1 57 LYS HG3 . . 4.190 3.347 2.348 4.216 0.026 5 0 "[ . 1 . 2]" 1
879 1 57 LYS HE2 1 85 THR MG . . 4.010 3.236 2.352 3.992 . 0 0 "[ . 1 . 2]" 1
880 1 57 LYS HE3 1 57 LYS HG2 . . 4.190 2.938 2.180 4.209 0.019 15 0 "[ . 1 . 2]" 1
881 1 57 LYS HE3 1 57 LYS HG3 . . 4.190 3.148 2.259 4.158 . 0 0 "[ . 1 . 2]" 1
882 1 57 LYS HE3 1 85 THR MG . . 4.010 3.309 2.271 3.970 . 0 0 "[ . 1 . 2]" 1
883 1 57 LYS QG 1 58 GLY H . . 4.860 3.675 1.907 4.747 . 0 0 "[ . 1 . 2]" 1
884 1 58 GLY H 1 59 ALA H . . 3.760 2.790 2.379 3.136 . 0 0 "[ . 1 . 2]" 1
885 1 58 GLY H 1 60 GLY H . . 4.990 4.397 3.377 5.003 0.013 1 0 "[ . 1 . 2]" 1
886 1 59 ALA H 1 59 ALA MB . . 3.240 2.199 2.042 2.488 . 0 0 "[ . 1 . 2]" 1
887 1 59 ALA H 1 60 GLY H . . 3.220 2.561 2.083 3.098 . 0 0 "[ . 1 . 2]" 1
888 1 59 ALA H 1 60 GLY QA . . 5.000 4.360 3.911 4.783 . 0 0 "[ . 1 . 2]" 1
889 1 59 ALA MB 1 60 GLY H . . 3.710 2.486 2.168 2.715 . 0 0 "[ . 1 . 2]" 1
890 1 59 ALA MB 1 104 PHE QD . . 4.580 3.937 3.506 4.288 . 0 0 "[ . 1 . 2]" 1
891 1 59 ALA MB 1 104 PHE QE . . 4.370 3.277 2.834 3.607 . 0 0 "[ . 1 . 2]" 1
892 1 59 ALA MB 1 104 PHE HZ . . 4.090 3.884 3.199 4.092 0.002 19 0 "[ . 1 . 2]" 1
893 1 60 GLY H 1 61 THR H . . 4.460 4.280 3.751 4.462 0.002 2 0 "[ . 1 . 2]" 1
894 1 60 GLY QA 1 61 THR H . . 2.880 2.154 2.108 2.231 . 0 0 "[ . 1 . 2]" 1
895 1 60 GLY HA2 1 61 THR H . . 3.560 3.123 2.853 3.483 . 0 0 "[ . 1 . 2]" 1
896 1 60 GLY HA3 1 61 THR H . . 3.560 2.199 2.137 2.309 . 0 0 "[ . 1 . 2]" 1
897 1 61 THR H 1 61 THR HB . . 3.280 2.969 2.719 3.268 . 0 0 "[ . 1 . 2]" 1
898 1 61 THR H 1 61 THR MG . . 3.980 3.593 2.451 3.988 0.008 16 0 "[ . 1 . 2]" 1
899 1 61 THR H 1 62 GLY H . . 4.450 4.241 3.931 4.431 . 0 0 "[ . 1 . 2]" 1
900 1 61 THR HA 1 61 THR MG . . 3.240 2.545 2.224 3.203 . 0 0 "[ . 1 . 2]" 1
901 1 61 THR HA 1 62 GLY H . . 2.780 2.203 2.145 2.405 . 0 0 "[ . 1 . 2]" 1
902 1 61 THR HA 1 62 GLY QA . . 4.780 3.926 3.912 3.975 . 0 0 "[ . 1 . 2]" 1
903 1 61 THR HA 1 104 PHE QE . . 5.310 4.225 3.632 4.878 . 0 0 "[ . 1 . 2]" 1
904 1 61 THR HA 1 104 PHE HZ . . 4.500 3.165 2.304 3.847 . 0 0 "[ . 1 . 2]" 1
905 1 61 THR HB 1 62 GLY H . . 4.320 4.103 3.826 4.312 . 0 0 "[ . 1 . 2]" 1
906 1 61 THR MG 1 62 GLY H . . 3.400 2.717 2.009 3.366 . 0 0 "[ . 1 . 2]" 1
907 1 62 GLY H 1 63 GLY H . . 4.460 4.175 3.403 4.406 . 0 0 "[ . 1 . 2]" 1
908 1 62 GLY H 1 104 PHE QE . . 4.260 3.783 3.331 4.207 . 0 0 "[ . 1 . 2]" 1
909 1 62 GLY H 1 104 PHE HZ . . 3.860 2.827 2.200 3.377 . 0 0 "[ . 1 . 2]" 1
910 1 62 GLY QA 1 63 GLY H . . 2.970 2.191 2.116 2.280 . 0 0 "[ . 1 . 2]" 1
911 1 62 GLY QA 1 105 GLU HG2 . . 3.870 2.779 2.350 3.127 . 0 0 "[ . 1 . 2]" 1
912 1 62 GLY QA 1 105 GLU HG3 . . 4.100 2.751 2.287 3.175 . 0 0 "[ . 1 . 2]" 1
913 1 62 GLY HA2 1 63 GLY H . . 3.440 2.981 2.647 3.446 0.006 12 0 "[ . 1 . 2]" 1
914 1 62 GLY HA2 1 105 GLU HG2 . . 4.420 3.993 3.662 4.237 . 0 0 "[ . 1 . 2]" 1
915 1 62 GLY HA2 1 105 GLU HG3 . . 4.670 4.199 3.753 4.560 . 0 0 "[ . 1 . 2]" 1
916 1 62 GLY HA3 1 63 GLY H . . 3.440 2.274 2.142 2.489 . 0 0 "[ . 1 . 2]" 1
917 1 62 GLY HA3 1 105 GLU HG2 . . 4.420 2.845 2.373 3.327 . 0 0 "[ . 1 . 2]" 1
918 1 62 GLY HA3 1 105 GLU HG3 . . 4.670 2.792 2.307 3.260 . 0 0 "[ . 1 . 2]" 1
919 1 63 GLY H 1 64 LEU H . . 4.660 4.335 3.908 4.557 . 0 0 "[ . 1 . 2]" 1
920 1 63 GLY H 1 64 LEU HA . . 5.500 4.858 4.476 5.156 . 0 0 "[ . 1 . 2]" 1
921 1 63 GLY H 1 104 PHE HA . . 5.500 4.840 4.240 5.319 . 0 0 "[ . 1 . 2]" 1
922 1 63 GLY H 1 104 PHE QE . . 4.990 4.051 3.048 4.618 . 0 0 "[ . 1 . 2]" 1
923 1 63 GLY H 1 105 GLU HA . . 4.360 3.626 3.145 4.262 . 0 0 "[ . 1 . 2]" 1
924 1 63 GLY H 1 105 GLU HB2 . . 5.500 4.604 4.238 4.957 . 0 0 "[ . 1 . 2]" 1
925 1 63 GLY H 1 105 GLU HG2 . . 4.010 2.124 1.894 2.433 . 0 0 "[ . 1 . 2]" 1
926 1 63 GLY H 1 105 GLU HG3 . . 4.390 3.054 2.226 3.566 . 0 0 "[ . 1 . 2]" 1
927 1 63 GLY HA2 1 64 LEU H . . 3.160 2.223 2.139 2.381 . 0 0 "[ . 1 . 2]" 1
928 1 63 GLY HA2 1 64 LEU HB2 . . 4.820 4.452 4.263 4.656 . 0 0 "[ . 1 . 2]" 1
929 1 63 GLY HA2 1 64 LEU QB . . 4.120 4.010 3.910 4.120 . 0 0 "[ . 1 . 2]" 1
930 1 63 GLY HA2 1 64 LEU HB3 . . 4.820 4.558 4.415 4.706 . 0 0 "[ . 1 . 2]" 1
931 1 63 GLY HA3 1 64 LEU H . . 3.420 3.078 2.763 3.359 . 0 0 "[ . 1 . 2]" 1
932 1 63 GLY HA3 1 64 LEU HA . . 5.070 4.512 4.392 4.637 . 0 0 "[ . 1 . 2]" 1
933 1 63 GLY HA3 1 64 LEU QB . . 5.340 4.877 4.663 5.068 . 0 0 "[ . 1 . 2]" 1
934 1 63 GLY HA3 1 105 GLU H . . 4.690 4.237 4.114 4.403 . 0 0 "[ . 1 . 2]" 1
935 1 64 LEU H 1 64 LEU HB2 . . 3.410 2.947 2.657 3.209 . 0 0 "[ . 1 . 2]" 1
936 1 64 LEU H 1 64 LEU QB . . 2.890 2.423 2.286 2.574 . 0 0 "[ . 1 . 2]" 1
937 1 64 LEU H 1 64 LEU HB3 . . 3.410 2.583 2.439 2.733 . 0 0 "[ . 1 . 2]" 1
938 1 64 LEU H 1 64 LEU MD1 . . 4.590 4.347 4.200 4.512 . 0 0 "[ . 1 . 2]" 1
939 1 64 LEU H 1 64 LEU HG . . 4.720 4.462 4.408 4.536 . 0 0 "[ . 1 . 2]" 1
940 1 64 LEU H 1 65 GLY H . . 4.510 4.424 4.300 4.519 0.009 9 0 "[ . 1 . 2]" 1
941 1 64 LEU H 1 104 PHE QD . . 5.500 4.123 3.725 4.612 . 0 0 "[ . 1 . 2]" 1
942 1 64 LEU H 1 104 PHE QE . . 5.220 3.894 3.384 4.455 . 0 0 "[ . 1 . 2]" 1
943 1 64 LEU HA 1 64 LEU MD1 . . 3.650 2.325 2.069 2.594 . 0 0 "[ . 1 . 2]" 1
944 1 64 LEU HA 1 64 LEU MD2 . . 4.110 3.930 3.899 3.961 . 0 0 "[ . 1 . 2]" 1
945 1 64 LEU HA 1 65 GLY H . . 2.860 2.173 2.148 2.200 . 0 0 "[ . 1 . 2]" 1
946 1 64 LEU HA 1 65 GLY HA2 . . 5.060 4.384 4.379 4.391 . 0 0 "[ . 1 . 2]" 1
947 1 64 LEU HA 1 65 GLY HA3 . . 4.600 4.354 4.345 4.370 . 0 0 "[ . 1 . 2]" 1
948 1 64 LEU HA 1 103 LEU H . . 5.150 4.520 4.370 4.646 . 0 0 "[ . 1 . 2]" 1
949 1 64 LEU HA 1 105 GLU H . . 5.010 2.989 2.867 3.136 . 0 0 "[ . 1 . 2]" 1
950 1 64 LEU QB 1 65 GLY H . . 3.850 3.695 3.629 3.779 . 0 0 "[ . 1 . 2]" 1
951 1 64 LEU QB 1 104 PHE QD . . 4.220 2.080 1.990 2.281 . 0 0 "[ . 1 . 2]" 1
952 1 64 LEU HB2 1 64 LEU MD1 . . 3.280 2.210 2.028 2.325 . 0 0 "[ . 1 . 2]" 1
953 1 64 LEU HB2 1 64 LEU MD2 . . 3.230 2.558 2.424 2.680 . 0 0 "[ . 1 . 2]" 1
954 1 64 LEU HB2 1 65 GLY H . . 4.480 4.179 4.084 4.311 . 0 0 "[ . 1 . 2]" 1
955 1 64 LEU HB3 1 64 LEU MD1 . . 3.280 3.152 3.118 3.184 . 0 0 "[ . 1 . 2]" 1
956 1 64 LEU HB3 1 64 LEU MD2 . . 3.230 2.161 1.991 2.296 . 0 0 "[ . 1 . 2]" 1
957 1 64 LEU HB3 1 65 GLY H . . 4.480 4.120 4.025 4.219 . 0 0 "[ . 1 . 2]" 1
958 1 64 LEU MD1 1 104 PHE HA . . 3.890 2.309 1.985 2.551 . 0 0 "[ . 1 . 2]" 1
959 1 64 LEU MD1 1 104 PHE HB2 . . 4.110 2.672 2.489 2.861 . 0 0 "[ . 1 . 2]" 1
960 1 64 LEU MD1 1 104 PHE HB3 . . 4.110 3.966 3.760 4.115 0.005 4 0 "[ . 1 . 2]" 1
961 1 64 LEU MD1 1 104 PHE QD . . 3.550 2.009 1.812 2.313 . 0 0 "[ . 1 . 2]" 1
962 1 64 LEU MD1 1 105 GLU H . . 4.310 4.066 3.752 4.307 . 0 0 "[ . 1 . 2]" 1
963 1 64 LEU MD2 1 65 GLY H . . 4.400 4.303 4.198 4.406 0.006 8 0 "[ . 1 . 2]" 1
964 1 64 LEU MD2 1 104 PHE QD . . 4.030 3.850 3.592 4.035 0.005 17 0 "[ . 1 . 2]" 1
965 1 64 LEU MD2 1 104 PHE QE . . 4.960 4.400 3.995 4.824 . 0 0 "[ . 1 . 2]" 1
966 1 64 LEU HG 1 65 GLY H . . 3.890 2.720 2.579 2.870 . 0 0 "[ . 1 . 2]" 1
967 1 64 LEU HG 1 66 LEU H . . 4.660 4.373 3.997 4.665 0.005 12 0 "[ . 1 . 2]" 1
968 1 65 GLY H 1 66 LEU H . . 4.490 4.341 4.226 4.461 . 0 0 "[ . 1 . 2]" 1
969 1 65 GLY H 1 103 LEU H . . 3.770 3.026 2.886 3.149 . 0 0 "[ . 1 . 2]" 1
970 1 65 GLY H 1 103 LEU HB2 . . 4.280 4.235 4.149 4.285 0.005 19 0 "[ . 1 . 2]" 1
971 1 65 GLY H 1 104 PHE HA . . 4.590 3.560 3.450 3.665 . 0 0 "[ . 1 . 2]" 1
972 1 65 GLY H 1 104 PHE QD . . 4.820 4.500 4.200 4.749 . 0 0 "[ . 1 . 2]" 1
973 1 65 GLY H 1 105 GLU H . . 4.140 4.073 3.926 4.151 0.011 4 0 "[ . 1 . 2]" 1
974 1 65 GLY HA2 1 66 LEU H . . 2.800 2.146 2.139 2.164 . 0 0 "[ . 1 . 2]" 1
975 1 65 GLY HA2 1 66 LEU HB2 . . 5.260 4.452 4.259 4.974 . 0 0 "[ . 1 . 2]" 1
976 1 65 GLY HA2 1 66 LEU QB . . 4.510 4.058 3.957 4.114 . 0 0 "[ . 1 . 2]" 1
977 1 65 GLY HA2 1 66 LEU HB3 . . 5.260 4.768 4.178 4.947 . 0 0 "[ . 1 . 2]" 1
978 1 65 GLY HA3 1 66 LEU H . . 3.380 3.272 3.120 3.357 . 0 0 "[ . 1 . 2]" 1
979 1 65 GLY HA3 1 103 LEU H . . 4.440 4.102 3.900 4.337 . 0 0 "[ . 1 . 2]" 1
980 1 65 GLY HA3 1 103 LEU HB2 . . 5.140 4.947 4.835 5.113 . 0 0 "[ . 1 . 2]" 1
981 1 65 GLY HA3 1 103 LEU MD2 . . 4.670 4.094 3.982 4.384 . 0 0 "[ . 1 . 2]" 1
982 1 66 LEU H 1 66 LEU HB2 . . 3.570 2.833 2.614 3.486 . 0 0 "[ . 1 . 2]" 1
983 1 66 LEU H 1 66 LEU QB . . 3.000 2.444 2.329 2.520 . 0 0 "[ . 1 . 2]" 1
984 1 66 LEU H 1 66 LEU HB3 . . 3.570 2.736 2.374 2.886 . 0 0 "[ . 1 . 2]" 1
985 1 66 LEU H 1 66 LEU MD1 . . 5.100 4.210 4.043 4.496 . 0 0 "[ . 1 . 2]" 1
986 1 66 LEU H 1 66 LEU MD2 . . 4.870 4.406 4.192 4.521 . 0 0 "[ . 1 . 2]" 1
987 1 66 LEU H 1 66 LEU HG . . 4.670 4.512 3.967 4.664 . 0 0 "[ . 1 . 2]" 1
988 1 66 LEU H 1 67 THR H . . 4.430 4.298 4.189 4.402 . 0 0 "[ . 1 . 2]" 1
989 1 66 LEU H 1 67 THR MG . . 4.500 3.943 3.703 4.112 . 0 0 "[ . 1 . 2]" 1
990 1 66 LEU H 1 103 LEU H . . 5.380 5.297 5.230 5.367 . 0 0 "[ . 1 . 2]" 1
991 1 66 LEU HA 1 66 LEU MD1 . . 3.780 2.368 1.999 2.654 . 0 0 "[ . 1 . 2]" 1
992 1 66 LEU HA 1 66 LEU HG . . 4.220 2.812 2.607 3.537 . 0 0 "[ . 1 . 2]" 1
993 1 66 LEU HA 1 67 THR H . . 2.710 2.142 2.138 2.179 . 0 0 "[ . 1 . 2]" 1
994 1 66 LEU HA 1 67 THR MG . . 4.650 4.156 4.005 4.311 . 0 0 "[ . 1 . 2]" 1
995 1 66 LEU HA 1 101 ASN H . . 4.790 4.453 4.307 4.539 . 0 0 "[ . 1 . 2]" 1
996 1 66 LEU HA 1 102 ILE HA . . 4.480 3.222 3.129 3.336 . 0 0 "[ . 1 . 2]" 1
997 1 66 LEU HA 1 103 LEU H . . 4.400 4.099 3.920 4.218 . 0 0 "[ . 1 . 2]" 1
998 1 66 LEU QB 1 67 THR H . . 3.920 3.773 3.577 3.826 . 0 0 "[ . 1 . 2]" 1
999 1 66 LEU QB 1 100 VAL MG1 . . 4.020 3.902 3.316 4.032 0.012 4 0 "[ . 1 . 2]" 1
1000 1 66 LEU HB2 1 66 LEU MD2 . . 3.550 2.526 2.396 2.660 . 0 0 "[ . 1 . 2]" 1
1001 1 66 LEU HB2 1 67 THR H . . 4.690 4.365 3.819 4.503 . 0 0 "[ . 1 . 2]" 1
1002 1 66 LEU HB2 1 100 VAL MG1 . . 4.580 4.301 3.401 4.533 . 0 0 "[ . 1 . 2]" 1
1003 1 66 LEU HB3 1 66 LEU MD2 . . 3.550 2.168 2.001 2.300 . 0 0 "[ . 1 . 2]" 1
1004 1 66 LEU HB3 1 67 THR H . . 4.690 4.156 4.024 4.446 . 0 0 "[ . 1 . 2]" 1
1005 1 66 LEU HB3 1 100 VAL MG1 . . 4.580 4.544 4.461 4.667 0.087 12 0 "[ . 1 . 2]" 1
1006 1 66 LEU MD1 1 67 THR H . . 3.690 3.278 2.078 3.687 . 0 0 "[ . 1 . 2]" 1
1007 1 66 LEU MD1 1 100 VAL MG1 . . 3.190 1.843 1.614 2.034 . 0 0 "[ . 1 . 2]" 1
1008 1 66 LEU MD1 1 101 ASN H . . 4.830 3.962 2.918 4.500 . 0 0 "[ . 1 . 2]" 1
1009 1 66 LEU MD1 1 102 ILE HG12 . . 3.400 2.070 1.832 3.288 . 0 0 "[ . 1 . 2]" 1
1010 1 66 LEU MD2 1 78 CYS HB2 . . 4.620 4.449 4.173 4.600 . 0 0 "[ . 1 . 2]" 1
1011 1 66 LEU MD2 1 78 CYS HB3 . . 4.110 3.521 3.189 3.827 . 0 0 "[ . 1 . 2]" 1
1012 1 66 LEU HG 1 67 THR H . . 3.830 3.168 2.865 3.754 . 0 0 "[ . 1 . 2]" 1
1013 1 66 LEU HG 1 100 VAL MG1 . . 4.110 2.609 2.281 4.013 . 0 0 "[ . 1 . 2]" 1
1014 1 67 THR H 1 67 THR HB . . 4.100 3.784 3.719 3.858 . 0 0 "[ . 1 . 2]" 1
1015 1 67 THR H 1 67 THR MG . . 3.890 3.285 3.177 3.420 . 0 0 "[ . 1 . 2]" 1
1016 1 67 THR H 1 68 VAL H . . 4.510 4.281 4.192 4.388 . 0 0 "[ . 1 . 2]" 1
1017 1 67 THR H 1 68 VAL HA . . 5.250 4.728 4.636 4.780 . 0 0 "[ . 1 . 2]" 1
1018 1 67 THR H 1 100 VAL HA . . 4.540 4.329 4.130 4.504 . 0 0 "[ . 1 . 2]" 1
1019 1 67 THR H 1 100 VAL MG1 . . 4.150 3.753 3.486 4.024 . 0 0 "[ . 1 . 2]" 1
1020 1 67 THR H 1 101 ASN H . . 3.890 2.967 2.859 3.034 . 0 0 "[ . 1 . 2]" 1
1021 1 67 THR H 1 101 ASN HA . . 5.500 4.651 4.569 4.737 . 0 0 "[ . 1 . 2]" 1
1022 1 67 THR H 1 101 ASN HB2 . . 3.750 2.545 2.380 2.680 . 0 0 "[ . 1 . 2]" 1
1023 1 67 THR H 1 101 ASN HB3 . . 4.270 3.991 3.753 4.153 . 0 0 "[ . 1 . 2]" 1
1024 1 67 THR H 1 101 ASN HD21 . . 4.620 3.827 3.628 3.942 . 0 0 "[ . 1 . 2]" 1
1025 1 67 THR H 1 101 ASN HD22 . . 5.500 5.459 5.282 5.505 0.005 9 0 "[ . 1 . 2]" 1
1026 1 67 THR H 1 102 ILE HA . . 4.970 4.530 4.470 4.643 . 0 0 "[ . 1 . 2]" 1
1027 1 67 THR H 1 103 LEU H . . 5.500 5.445 5.262 5.511 0.011 17 0 "[ . 1 . 2]" 1
1028 1 67 THR H 1 103 LEU MD2 . . 5.200 5.028 4.707 5.159 . 0 0 "[ . 1 . 2]" 1
1029 1 67 THR HA 1 67 THR MG . . 3.310 2.156 2.058 2.283 . 0 0 "[ . 1 . 2]" 1
1030 1 67 THR HA 1 68 VAL H . . 2.700 2.163 2.147 2.221 . 0 0 "[ . 1 . 2]" 1
1031 1 67 THR HA 1 68 VAL HB . . 4.750 4.529 4.441 4.609 . 0 0 "[ . 1 . 2]" 1
1032 1 67 THR HA 1 76 ILE MD . . 3.740 2.842 2.492 3.165 . 0 0 "[ . 1 . 2]" 1
1033 1 67 THR HB 1 68 VAL H . . 3.360 3.228 2.931 3.355 . 0 0 "[ . 1 . 2]" 1
1034 1 67 THR HB 1 69 GLU QG . . 4.460 3.569 3.256 3.970 . 0 0 "[ . 1 . 2]" 1
1035 1 67 THR HB 1 101 ASN HD21 . . 4.680 4.059 3.680 4.308 . 0 0 "[ . 1 . 2]" 1
1036 1 67 THR HB 1 101 ASN HD22 . . 5.360 4.984 4.677 5.254 . 0 0 "[ . 1 . 2]" 1
1037 1 67 THR MG 1 68 VAL H . . 4.130 3.758 3.630 3.906 . 0 0 "[ . 1 . 2]" 1
1038 1 67 THR MG 1 103 LEU MD2 . . 4.560 4.448 4.274 4.563 0.003 2 0 "[ . 1 . 2]" 1
1039 1 68 VAL H 1 68 VAL HB . . 3.160 2.417 2.337 2.482 . 0 0 "[ . 1 . 2]" 1
1040 1 68 VAL H 1 68 VAL MG1 . . 4.220 3.745 3.697 3.777 . 0 0 "[ . 1 . 2]" 1
1041 1 68 VAL H 1 68 VAL MG2 . . 3.290 2.602 2.412 2.859 . 0 0 "[ . 1 . 2]" 1
1042 1 68 VAL H 1 69 GLU H . . 4.500 4.302 4.169 4.390 . 0 0 "[ . 1 . 2]" 1
1043 1 68 VAL H 1 76 ILE MD . . 3.380 2.297 1.933 2.616 . 0 0 "[ . 1 . 2]" 1
1044 1 68 VAL HA 1 68 VAL MG1 . . 3.380 2.412 2.323 2.484 . 0 0 "[ . 1 . 2]" 1
1045 1 68 VAL HA 1 68 VAL MG2 . . 3.430 2.301 2.122 2.400 . 0 0 "[ . 1 . 2]" 1
1046 1 68 VAL HA 1 69 GLU H . . 2.900 2.162 2.144 2.193 . 0 0 "[ . 1 . 2]" 1
1047 1 68 VAL HA 1 100 VAL HA . . 3.850 2.810 2.536 3.289 . 0 0 "[ . 1 . 2]" 1
1048 1 68 VAL HA 1 100 VAL MG2 . . 4.510 3.816 3.542 4.122 . 0 0 "[ . 1 . 2]" 1
1049 1 68 VAL HA 1 101 ASN H . . 4.000 3.480 3.176 3.829 . 0 0 "[ . 1 . 2]" 1
1050 1 68 VAL HA 1 101 ASN HD21 . . 4.720 3.450 3.146 3.663 . 0 0 "[ . 1 . 2]" 1
1051 1 68 VAL HA 1 101 ASN HD22 . . 4.910 4.533 4.294 4.698 . 0 0 "[ . 1 . 2]" 1
1052 1 68 VAL HB 1 69 GLU H . . 4.730 4.436 4.349 4.521 . 0 0 "[ . 1 . 2]" 1
1053 1 68 VAL HB 1 74 ALA H . . 4.240 3.782 3.354 4.236 . 0 0 "[ . 1 . 2]" 1
1054 1 68 VAL HB 1 74 ALA MB . . 3.890 3.697 3.448 3.870 . 0 0 "[ . 1 . 2]" 1
1055 1 68 VAL HB 1 76 ILE MD . . 2.940 2.518 2.298 2.928 . 0 0 "[ . 1 . 2]" 1
1056 1 68 VAL MG1 1 69 GLU H . . 3.270 2.963 2.710 3.223 . 0 0 "[ . 1 . 2]" 1
1057 1 68 VAL MG1 1 70 GLY H . . 4.450 2.481 1.822 2.984 . 0 0 "[ . 1 . 2]" 1
1058 1 68 VAL MG1 1 72 CYS H . . 4.730 4.588 4.273 4.733 0.003 14 0 "[ . 1 . 2]" 1
1059 1 68 VAL MG1 1 74 ALA H . . 4.280 3.230 2.741 3.602 . 0 0 "[ . 1 . 2]" 1
1060 1 68 VAL MG1 1 74 ALA MB . . 3.280 2.713 2.479 2.948 . 0 0 "[ . 1 . 2]" 1
1061 1 68 VAL MG1 1 90 TYR QD . . 4.750 4.464 4.265 4.601 . 0 0 "[ . 1 . 2]" 1
1062 1 68 VAL MG1 1 90 TYR QE . . 5.060 5.010 4.810 5.065 0.005 19 0 "[ . 1 . 2]" 1
1063 1 68 VAL MG1 1 98 TYR HB3 . . 3.840 2.212 1.849 2.613 . 0 0 "[ . 1 . 2]" 1
1064 1 68 VAL MG1 1 98 TYR QD . . 3.410 1.917 1.821 2.080 . 0 0 "[ . 1 . 2]" 1
1065 1 68 VAL MG1 1 98 TYR QE . . 4.290 3.462 3.062 3.586 . 0 0 "[ . 1 . 2]" 1
1066 1 68 VAL MG1 1 99 PHE H . . 4.000 3.355 3.026 3.581 . 0 0 "[ . 1 . 2]" 1
1067 1 68 VAL MG2 1 76 ILE MD . . 3.060 1.901 1.694 2.146 . 0 0 "[ . 1 . 2]" 1
1068 1 68 VAL MG2 1 76 ILE HG13 . . 3.980 3.026 2.682 3.408 . 0 0 "[ . 1 . 2]" 1
1069 1 68 VAL MG2 1 90 TYR HB2 . . 4.840 3.391 3.134 3.653 . 0 0 "[ . 1 . 2]" 1
1070 1 68 VAL MG2 1 90 TYR QD . . 4.550 3.962 3.767 4.189 . 0 0 "[ . 1 . 2]" 1
1071 1 69 GLU H 1 69 GLU HB2 . . 3.480 2.288 2.189 2.363 . 0 0 "[ . 1 . 2]" 1
1072 1 69 GLU H 1 69 GLU HB3 . . 3.600 3.549 3.479 3.602 0.002 10 0 "[ . 1 . 2]" 1
1073 1 69 GLU H 1 69 GLU HG2 . . 4.330 3.192 2.741 3.982 . 0 0 "[ . 1 . 2]" 1
1074 1 69 GLU H 1 69 GLU QG . . 3.650 2.978 2.687 3.170 . 0 0 "[ . 1 . 2]" 1
1075 1 69 GLU H 1 69 GLU HG3 . . 4.330 3.866 2.966 4.189 . 0 0 "[ . 1 . 2]" 1
1076 1 69 GLU H 1 70 GLY H . . 4.210 3.551 2.804 3.932 . 0 0 "[ . 1 . 2]" 1
1077 1 69 GLU H 1 99 PHE HB2 . . 4.300 3.262 3.075 3.412 . 0 0 "[ . 1 . 2]" 1
1078 1 69 GLU H 1 99 PHE HB3 . . 4.710 4.213 3.882 4.501 . 0 0 "[ . 1 . 2]" 1
1079 1 69 GLU H 1 100 VAL HA . . 4.150 3.785 3.621 4.092 . 0 0 "[ . 1 . 2]" 1
1080 1 69 GLU H 1 101 ASN H . . 4.240 3.796 3.576 4.000 . 0 0 "[ . 1 . 2]" 1
1081 1 69 GLU H 1 101 ASN HD21 . . 4.560 2.760 2.492 3.015 . 0 0 "[ . 1 . 2]" 1
1082 1 69 GLU H 1 101 ASN HD22 . . 4.480 2.984 2.802 3.180 . 0 0 "[ . 1 . 2]" 1
1083 1 69 GLU HA 1 69 GLU QG . . 3.740 2.546 2.119 2.905 . 0 0 "[ . 1 . 2]" 1
1084 1 69 GLU HA 1 70 GLY H . . 3.130 2.532 2.315 3.031 . 0 0 "[ . 1 . 2]" 1
1085 1 69 GLU HA 1 70 GLY QA . . 4.900 4.095 3.992 4.345 . 0 0 "[ . 1 . 2]" 1
1086 1 69 GLU HB2 1 70 GLY H . . 4.540 4.464 4.040 4.546 0.006 10 0 "[ . 1 . 2]" 1
1087 1 69 GLU HB2 1 99 PHE H . . 4.360 3.821 3.383 4.189 . 0 0 "[ . 1 . 2]" 1
1088 1 69 GLU HB2 1 99 PHE HB2 . . 4.250 2.337 2.028 2.659 . 0 0 "[ . 1 . 2]" 1
1089 1 69 GLU HB2 1 99 PHE HB3 . . 3.690 3.373 3.172 3.585 . 0 0 "[ . 1 . 2]" 1
1090 1 69 GLU HB2 1 99 PHE QD . . 4.750 4.278 3.809 4.595 . 0 0 "[ . 1 . 2]" 1
1091 1 69 GLU HB2 1 101 ASN HD21 . . 4.120 3.164 3.045 3.358 . 0 0 "[ . 1 . 2]" 1
1092 1 69 GLU HB2 1 101 ASN HD22 . . 3.650 2.013 1.907 2.209 . 0 0 "[ . 1 . 2]" 1
1093 1 69 GLU HB3 1 70 GLY H . . 4.270 4.256 4.116 4.338 0.068 7 0 "[ . 1 . 2]" 1
1094 1 69 GLU HB3 1 99 PHE H . . 4.900 4.544 4.134 4.895 . 0 0 "[ . 1 . 2]" 1
1095 1 69 GLU HB3 1 99 PHE HB2 . . 4.070 3.303 2.932 3.621 . 0 0 "[ . 1 . 2]" 1
1096 1 69 GLU HB3 1 99 PHE HB3 . . 4.810 4.633 4.300 4.812 0.002 4 0 "[ . 1 . 2]" 1
1097 1 69 GLU HB3 1 99 PHE QD . . 5.360 4.578 3.784 5.181 . 0 0 "[ . 1 . 2]" 1
1098 1 69 GLU QG 1 101 ASN HD21 . . 3.810 2.782 2.472 3.272 . 0 0 "[ . 1 . 2]" 1
1099 1 69 GLU QG 1 101 ASN HD22 . . 3.540 2.010 1.855 2.427 . 0 0 "[ . 1 . 2]" 1
1100 1 69 GLU HG2 1 101 ASN HD21 . . 4.380 3.162 2.540 4.391 0.011 9 0 "[ . 1 . 2]" 1
1101 1 69 GLU HG2 1 101 ASN HD22 . . 4.250 2.611 2.003 3.656 . 0 0 "[ . 1 . 2]" 1
1102 1 69 GLU HG3 1 101 ASN HD21 . . 4.380 3.419 2.489 3.923 . 0 0 "[ . 1 . 2]" 1
1103 1 69 GLU HG3 1 101 ASN HD22 . . 4.250 2.160 1.896 2.591 . 0 0 "[ . 1 . 2]" 1
1104 1 70 GLY H 1 71 PRO HD2 . . 4.730 4.521 4.266 4.654 . 0 0 "[ . 1 . 2]" 1
1105 1 70 GLY H 1 71 PRO HD3 . . 5.310 5.104 5.037 5.126 . 0 0 "[ . 1 . 2]" 1
1106 1 70 GLY H 1 72 CYS H . . 4.760 4.267 3.714 4.752 . 0 0 "[ . 1 . 2]" 1
1107 1 70 GLY QA 1 71 PRO HA . . 4.210 4.030 4.020 4.041 . 0 0 "[ . 1 . 2]" 1
1108 1 70 GLY QA 1 71 PRO HB3 . . 5.060 4.588 4.581 4.595 . 0 0 "[ . 1 . 2]" 1
1109 1 70 GLY QA 1 71 PRO HG2 . . 4.200 4.032 3.995 4.060 . 0 0 "[ . 1 . 2]" 1
1110 1 70 GLY QA 1 71 PRO HG3 . . 4.460 4.272 4.257 4.277 . 0 0 "[ . 1 . 2]" 1
1111 1 70 GLY QA 1 72 CYS H . . 3.560 3.036 2.954 3.110 . 0 0 "[ . 1 . 2]" 1
1112 1 70 GLY QA 1 98 TYR HA . . 3.880 2.540 2.281 2.748 . 0 0 "[ . 1 . 2]" 1
1113 1 70 GLY HA2 1 71 PRO HD2 . . 3.680 2.844 2.631 3.106 . 0 0 "[ . 1 . 2]" 1
1114 1 70 GLY HA2 1 71 PRO HD3 . . 3.580 2.579 2.417 2.814 . 0 0 "[ . 1 . 2]" 1
1115 1 70 GLY HA2 1 71 PRO HG3 . . 5.090 4.802 4.627 5.042 . 0 0 "[ . 1 . 2]" 1
1116 1 70 GLY HA2 1 72 CYS H . . 4.290 4.185 4.097 4.277 . 0 0 "[ . 1 . 2]" 1
1117 1 70 GLY HA2 1 98 TYR HA . . 4.480 2.905 2.384 3.314 . 0 0 "[ . 1 . 2]" 1
1118 1 70 GLY HA2 1 99 PHE H . . 4.420 3.342 3.009 3.598 . 0 0 "[ . 1 . 2]" 1
1119 1 70 GLY HA3 1 71 PRO HD2 . . 3.680 2.214 2.020 2.398 . 0 0 "[ . 1 . 2]" 1
1120 1 70 GLY HA3 1 71 PRO HD3 . . 3.580 3.080 2.817 3.287 . 0 0 "[ . 1 . 2]" 1
1121 1 70 GLY HA3 1 71 PRO HG3 . . 5.090 4.806 4.588 4.994 . 0 0 "[ . 1 . 2]" 1
1122 1 70 GLY HA3 1 72 CYS H . . 4.290 3.117 3.029 3.197 . 0 0 "[ . 1 . 2]" 1
1123 1 70 GLY HA3 1 98 TYR HA . . 4.480 2.853 2.424 3.127 . 0 0 "[ . 1 . 2]" 1
1124 1 70 GLY HA3 1 99 PHE H . . 4.420 3.902 3.348 4.185 . 0 0 "[ . 1 . 2]" 1
1125 1 71 PRO HA 1 72 CYS H . . 3.440 3.427 3.378 3.475 0.035 12 0 "[ . 1 . 2]" 1
1126 1 71 PRO HB2 1 72 CYS H . . 3.860 3.687 3.548 3.814 . 0 0 "[ . 1 . 2]" 1
1127 1 71 PRO HB3 1 72 CYS H . . 4.480 4.346 4.265 4.419 . 0 0 "[ . 1 . 2]" 1
1128 1 71 PRO HD2 1 72 CYS H . . 3.490 2.765 2.687 2.856 . 0 0 "[ . 1 . 2]" 1
1129 1 71 PRO HD2 1 97 GLU H . . 3.820 3.562 3.116 3.735 . 0 0 "[ . 1 . 2]" 1
1130 1 71 PRO HD2 1 98 TYR HA . . 4.900 3.683 3.193 3.959 . 0 0 "[ . 1 . 2]" 1
1131 1 71 PRO HD2 1 98 TYR QE . . 4.570 3.589 3.275 3.799 . 0 0 "[ . 1 . 2]" 1
1132 1 71 PRO HD3 1 72 CYS H . . 4.080 3.905 3.864 3.954 . 0 0 "[ . 1 . 2]" 1
1133 1 71 PRO HD3 1 97 GLU H . . 4.440 3.138 2.173 3.490 . 0 0 "[ . 1 . 2]" 1
1134 1 71 PRO HD3 1 98 TYR HA . . 4.670 4.038 3.577 4.310 . 0 0 "[ . 1 . 2]" 1
1135 1 71 PRO HD3 1 98 TYR QE . . 5.250 5.056 4.773 5.239 . 0 0 "[ . 1 . 2]" 1
1136 1 71 PRO HG2 1 72 CYS H . . 3.320 2.869 2.655 3.073 . 0 0 "[ . 1 . 2]" 1
1137 1 71 PRO HG2 1 72 CYS QB . . 4.580 3.466 3.212 3.996 . 0 0 "[ . 1 . 2]" 1
1138 1 71 PRO HG2 1 97 GLU H . . 4.240 4.130 3.832 4.241 0.001 11 0 "[ . 1 . 2]" 1
1139 1 71 PRO HG2 1 98 TYR QE . . 4.710 4.184 3.715 4.550 . 0 0 "[ . 1 . 2]" 1
1140 1 71 PRO HG3 1 72 CYS H . . 4.540 4.255 4.094 4.409 . 0 0 "[ . 1 . 2]" 1
1141 1 71 PRO HG3 1 97 GLU H . . 4.540 2.999 2.606 3.287 . 0 0 "[ . 1 . 2]" 1
1142 1 71 PRO HG3 1 98 TYR QE . . 5.330 5.029 4.429 5.331 0.001 12 0 "[ . 1 . 2]" 1
1143 1 71 PRO HG3 1 98 TYR HH . . 5.080 4.715 4.057 5.011 . 0 0 "[ . 1 . 2]" 1
1144 1 72 CYS H 1 72 CYS HB2 . . 3.550 3.183 2.463 3.602 0.052 17 0 "[ . 1 . 2]" 1
1145 1 72 CYS H 1 72 CYS HB3 . . 3.550 3.223 2.849 3.590 0.040 5 0 "[ . 1 . 2]" 1
1146 1 72 CYS H 1 73 GLU H . . 4.630 4.386 4.126 4.445 . 0 0 "[ . 1 . 2]" 1
1147 1 72 CYS H 1 73 GLU HA . . 4.950 4.838 4.659 4.965 0.015 17 0 "[ . 1 . 2]" 1
1148 1 72 CYS H 1 74 ALA H . . 5.300 5.034 4.698 5.291 . 0 0 "[ . 1 . 2]" 1
1149 1 72 CYS H 1 74 ALA MB . . 5.030 4.905 4.762 5.031 0.001 5 0 "[ . 1 . 2]" 1
1150 1 72 CYS H 1 98 TYR QE . . 4.000 3.588 3.056 3.893 . 0 0 "[ . 1 . 2]" 1
1151 1 72 CYS H 1 98 TYR HH . . 4.710 4.464 3.811 4.707 . 0 0 "[ . 1 . 2]" 1
1152 1 72 CYS QB 1 94 LYS QD . . 3.510 3.075 2.140 3.608 0.098 15 0 "[ . 1 . 2]" 1
1153 1 73 GLU H 1 74 ALA H . . 4.570 4.150 3.897 4.404 . 0 0 "[ . 1 . 2]" 1
1154 1 73 GLU HA 1 73 GLU HG2 . . 3.890 3.124 2.843 3.276 . 0 0 "[ . 1 . 2]" 1
1155 1 73 GLU HA 1 73 GLU HG3 . . 3.890 2.591 2.212 2.743 . 0 0 "[ . 1 . 2]" 1
1156 1 73 GLU HA 1 74 ALA H . . 2.570 2.211 2.145 2.272 . 0 0 "[ . 1 . 2]" 1
1157 1 73 GLU QB 1 74 ALA H . . 4.050 3.975 3.842 4.032 . 0 0 "[ . 1 . 2]" 1
1158 1 73 GLU HG2 1 74 ALA H . . 4.120 3.861 3.323 4.108 . 0 0 "[ . 1 . 2]" 1
1159 1 73 GLU HG3 1 74 ALA H . . 4.120 3.945 3.497 4.116 . 0 0 "[ . 1 . 2]" 1
1160 1 74 ALA H 1 74 ALA MB . . 2.900 2.253 2.068 2.377 . 0 0 "[ . 1 . 2]" 1
1161 1 74 ALA HA 1 75 LYS H . . 2.790 2.193 2.163 2.211 . 0 0 "[ . 1 . 2]" 1
1162 1 74 ALA HA 1 75 LYS HA . . 4.600 4.335 4.325 4.347 . 0 0 "[ . 1 . 2]" 1
1163 1 74 ALA HA 1 75 LYS HB2 . . 5.100 4.282 4.241 4.350 . 0 0 "[ . 1 . 2]" 1
1164 1 74 ALA HA 1 75 LYS HB3 . . 5.100 5.027 4.921 5.078 . 0 0 "[ . 1 . 2]" 1
1165 1 74 ALA MB 1 75 LYS H . . 3.320 2.967 2.871 3.075 . 0 0 "[ . 1 . 2]" 1
1166 1 74 ALA MB 1 76 ILE MD . . 4.350 4.224 4.029 4.351 0.001 1 0 "[ . 1 . 2]" 1
1167 1 74 ALA MB 1 90 TYR HA . . 5.080 4.667 4.524 4.894 . 0 0 "[ . 1 . 2]" 1
1168 1 74 ALA MB 1 90 TYR HB2 . . 3.680 3.130 2.973 3.232 . 0 0 "[ . 1 . 2]" 1
1169 1 74 ALA MB 1 90 TYR HB3 . . 4.620 4.550 4.405 4.616 . 0 0 "[ . 1 . 2]" 1
1170 1 74 ALA MB 1 90 TYR QD . . 3.530 3.114 2.893 3.276 . 0 0 "[ . 1 . 2]" 1
1171 1 74 ALA MB 1 91 LEU H . . 3.920 3.402 3.007 3.825 . 0 0 "[ . 1 . 2]" 1
1172 1 74 ALA MB 1 92 PRO HA . . 4.100 2.141 1.965 2.437 . 0 0 "[ . 1 . 2]" 1
1173 1 74 ALA MB 1 92 PRO QB . . 4.170 3.478 3.313 3.905 . 0 0 "[ . 1 . 2]" 1
1174 1 74 ALA MB 1 92 PRO QD . . 4.920 3.969 3.712 4.435 . 0 0 "[ . 1 . 2]" 1
1175 1 74 ALA MB 1 93 THR H . . 4.040 3.666 3.342 3.990 . 0 0 "[ . 1 . 2]" 1
1176 1 74 ALA MB 1 98 TYR QD . . 4.430 3.072 2.562 3.417 . 0 0 "[ . 1 . 2]" 1
1177 1 74 ALA MB 1 98 TYR QE . . 3.730 2.388 1.969 2.741 . 0 0 "[ . 1 . 2]" 1
1178 1 75 LYS H 1 75 LYS HB2 . . 3.020 2.247 2.196 2.355 . 0 0 "[ . 1 . 2]" 1
1179 1 75 LYS H 1 75 LYS HB3 . . 3.020 2.849 2.734 2.907 . 0 0 "[ . 1 . 2]" 1
1180 1 75 LYS H 1 75 LYS HG2 . . 4.760 4.551 4.205 4.646 . 0 0 "[ . 1 . 2]" 1
1181 1 75 LYS H 1 75 LYS QG . . 4.110 3.917 3.810 4.060 . 0 0 "[ . 1 . 2]" 1
1182 1 75 LYS H 1 75 LYS HG3 . . 4.760 4.286 4.126 4.493 . 0 0 "[ . 1 . 2]" 1
1183 1 75 LYS H 1 76 ILE H . . 4.680 4.631 4.617 4.642 . 0 0 "[ . 1 . 2]" 1
1184 1 75 LYS H 1 91 LEU H . . 4.170 3.626 3.423 3.898 . 0 0 "[ . 1 . 2]" 1
1185 1 75 LYS HA 1 75 LYS QD . . 4.140 3.448 2.127 4.099 . 0 0 "[ . 1 . 2]" 1
1186 1 75 LYS HA 1 75 LYS QE . . 4.710 4.147 3.438 4.669 . 0 0 "[ . 1 . 2]" 1
1187 1 75 LYS HA 1 75 LYS HG2 . . 3.860 3.050 2.179 3.700 . 0 0 "[ . 1 . 2]" 1
1188 1 75 LYS HA 1 75 LYS HG3 . . 3.860 2.520 2.218 3.480 . 0 0 "[ . 1 . 2]" 1
1189 1 75 LYS HA 1 76 ILE H . . 2.620 2.277 2.219 2.318 . 0 0 "[ . 1 . 2]" 1
1190 1 75 LYS HA 1 76 ILE HB . . 4.690 4.642 4.587 4.692 0.002 12 0 "[ . 1 . 2]" 1
1191 1 75 LYS HA 1 76 ILE HG12 . . 4.930 4.901 4.852 4.929 . 0 0 "[ . 1 . 2]" 1
1192 1 75 LYS HA 1 76 ILE HG13 . . 4.460 3.335 3.263 3.438 . 0 0 "[ . 1 . 2]" 1
1193 1 75 LYS HA 1 76 ILE MG . . 5.500 5.416 5.405 5.427 . 0 0 "[ . 1 . 2]" 1
1194 1 75 LYS QB 1 76 ILE H . . 3.670 3.366 3.278 3.509 . 0 0 "[ . 1 . 2]" 1
1195 1 75 LYS QB 1 90 TYR HA . . 5.170 4.104 3.927 4.302 . 0 0 "[ . 1 . 2]" 1
1196 1 75 LYS QB 1 91 LEU H . . 3.880 3.267 2.809 3.493 . 0 0 "[ . 1 . 2]" 1
1197 1 75 LYS HB2 1 76 ILE H . . 4.230 4.148 4.086 4.229 . 0 0 "[ . 1 . 2]" 1
1198 1 75 LYS HB2 1 91 LEU H . . 4.630 4.513 4.260 4.631 0.001 17 0 "[ . 1 . 2]" 1
1199 1 75 LYS HB3 1 76 ILE H . . 4.230 3.561 3.449 3.751 . 0 0 "[ . 1 . 2]" 1
1200 1 75 LYS HB3 1 91 LEU H . . 4.630 3.355 2.849 3.614 . 0 0 "[ . 1 . 2]" 1
1201 1 75 LYS QE 1 75 LYS HG2 . . 3.390 2.746 2.142 3.402 0.012 13 0 "[ . 1 . 2]" 1
1202 1 75 LYS QE 1 75 LYS QG . . 2.870 2.227 2.048 2.432 . 0 0 "[ . 1 . 2]" 1
1203 1 75 LYS QE 1 75 LYS HG3 . . 3.390 2.647 2.122 3.389 . 0 0 "[ . 1 . 2]" 1
1204 1 75 LYS HG2 1 76 ILE H . . 4.070 2.829 2.162 3.992 . 0 0 "[ . 1 . 2]" 1
1205 1 75 LYS HG3 1 76 ILE H . . 4.070 2.876 2.006 4.075 0.005 1 0 "[ . 1 . 2]" 1
1206 1 76 ILE H 1 76 ILE HB . . 2.960 2.833 2.766 2.864 . 0 0 "[ . 1 . 2]" 1
1207 1 76 ILE H 1 76 ILE MD . . 4.200 3.936 3.742 4.079 . 0 0 "[ . 1 . 2]" 1
1208 1 76 ILE H 1 76 ILE HG12 . . 4.320 4.093 4.036 4.140 . 0 0 "[ . 1 . 2]" 1
1209 1 76 ILE H 1 76 ILE HG13 . . 3.140 2.820 2.733 2.926 . 0 0 "[ . 1 . 2]" 1
1210 1 76 ILE H 1 76 ILE MG . . 4.060 3.932 3.905 3.945 . 0 0 "[ . 1 . 2]" 1
1211 1 76 ILE H 1 77 GLU H . . 4.430 4.147 4.002 4.289 . 0 0 "[ . 1 . 2]" 1
1212 1 76 ILE H 1 77 GLU HA . . 4.920 4.706 4.630 4.797 . 0 0 "[ . 1 . 2]" 1
1213 1 76 ILE H 1 90 TYR HA . . 4.970 4.857 4.750 4.946 . 0 0 "[ . 1 . 2]" 1
1214 1 76 ILE HA 1 76 ILE MD . . 4.610 3.913 3.883 3.943 . 0 0 "[ . 1 . 2]" 1
1215 1 76 ILE HA 1 76 ILE MG . . 3.720 2.237 2.195 2.281 . 0 0 "[ . 1 . 2]" 1
1216 1 76 ILE HA 1 77 GLU H . . 3.090 2.145 2.140 2.161 . 0 0 "[ . 1 . 2]" 1
1217 1 76 ILE HA 1 90 TYR HA . . 4.290 2.575 2.430 2.675 . 0 0 "[ . 1 . 2]" 1
1218 1 76 ILE HA 1 90 TYR HB3 . . 4.980 3.179 2.906 3.296 . 0 0 "[ . 1 . 2]" 1
1219 1 76 ILE HA 1 91 LEU H . . 4.220 4.124 3.897 4.233 0.013 9 0 "[ . 1 . 2]" 1
1220 1 76 ILE HB 1 76 ILE MD . . 3.120 2.264 2.132 2.393 . 0 0 "[ . 1 . 2]" 1
1221 1 76 ILE HB 1 77 GLU H . . 4.460 4.226 4.079 4.334 . 0 0 "[ . 1 . 2]" 1
1222 1 76 ILE MD 1 90 TYR HB2 . . 4.720 4.582 4.271 4.721 0.001 12 0 "[ . 1 . 2]" 1
1223 1 76 ILE MD 1 90 TYR HB3 . . 4.580 4.464 4.249 4.579 . 0 0 "[ . 1 . 2]" 1
1224 1 76 ILE HG12 1 90 TYR HA . . 4.410 4.156 3.863 4.317 . 0 0 "[ . 1 . 2]" 1
1225 1 76 ILE HG12 1 90 TYR HB2 . . 4.650 3.185 2.847 3.355 . 0 0 "[ . 1 . 2]" 1
1226 1 76 ILE HG12 1 90 TYR HB3 . . 4.480 3.044 2.847 3.198 . 0 0 "[ . 1 . 2]" 1
1227 1 76 ILE HG12 1 91 LEU H . . 5.460 5.080 4.829 5.280 . 0 0 "[ . 1 . 2]" 1
1228 1 76 ILE HG13 1 76 ILE MG . . 3.480 3.172 3.145 3.191 . 0 0 "[ . 1 . 2]" 1
1229 1 76 ILE HG13 1 90 TYR HA . . 5.500 4.688 4.497 4.928 . 0 0 "[ . 1 . 2]" 1
1230 1 76 ILE HG13 1 90 TYR HB2 . . 4.590 4.034 3.839 4.248 . 0 0 "[ . 1 . 2]" 1
1231 1 76 ILE HG13 1 90 TYR HB3 . . 4.630 4.411 4.222 4.591 . 0 0 "[ . 1 . 2]" 1
1232 1 76 ILE MG 1 77 GLU H . . 3.200 2.664 2.320 2.905 . 0 0 "[ . 1 . 2]" 1
1233 1 76 ILE MG 1 78 CYS HB2 . . 4.810 4.727 4.503 4.812 0.002 15 0 "[ . 1 . 2]" 1
1234 1 76 ILE MG 1 78 CYS HB3 . . 4.080 3.269 3.031 3.433 . 0 0 "[ . 1 . 2]" 1
1235 1 76 ILE MG 1 89 SER H . . 4.230 4.005 3.760 4.196 . 0 0 "[ . 1 . 2]" 1
1236 1 76 ILE MG 1 90 TYR HA . . 4.640 3.932 3.639 4.075 . 0 0 "[ . 1 . 2]" 1
1237 1 76 ILE MG 1 90 TYR HB2 . . 4.580 4.159 3.856 4.358 . 0 0 "[ . 1 . 2]" 1
1238 1 76 ILE MG 1 90 TYR HB3 . . 4.440 3.217 2.917 3.411 . 0 0 "[ . 1 . 2]" 1
1239 1 77 GLU H 1 77 GLU HB2 . . 3.680 2.603 2.324 3.046 . 0 0 "[ . 1 . 2]" 1
1240 1 77 GLU H 1 77 GLU QB . . 3.110 2.376 2.296 2.459 . 0 0 "[ . 1 . 2]" 1
1241 1 77 GLU H 1 77 GLU HB3 . . 3.680 3.160 2.483 3.678 . 0 0 "[ . 1 . 2]" 1
1242 1 77 GLU H 1 77 GLU QG . . 4.020 3.591 2.638 4.037 0.017 16 0 "[ . 1 . 2]" 1
1243 1 77 GLU H 1 78 CYS H . . 4.220 4.138 4.012 4.219 . 0 0 "[ . 1 . 2]" 1
1244 1 77 GLU H 1 88 VAL MG1 . . 3.920 3.258 2.960 3.825 . 0 0 "[ . 1 . 2]" 1
1245 1 77 GLU H 1 89 SER H . . 3.480 3.236 2.977 3.451 . 0 0 "[ . 1 . 2]" 1
1246 1 77 GLU H 1 90 TYR HA . . 3.730 3.208 3.053 3.363 . 0 0 "[ . 1 . 2]" 1
1247 1 77 GLU H 1 90 TYR HB2 . . 5.140 5.025 4.789 5.139 . 0 0 "[ . 1 . 2]" 1
1248 1 77 GLU H 1 90 TYR HB3 . . 4.650 4.292 3.959 4.524 . 0 0 "[ . 1 . 2]" 1
1249 1 77 GLU H 1 91 LEU H . . 5.250 5.177 4.980 5.244 . 0 0 "[ . 1 . 2]" 1
1250 1 77 GLU HA 1 78 CYS H . . 2.820 2.172 2.148 2.181 . 0 0 "[ . 1 . 2]" 1
1251 1 77 GLU QB 1 89 SER H . . 3.830 3.102 2.828 3.530 . 0 0 "[ . 1 . 2]" 1
1252 1 77 GLU HB2 1 78 CYS H . . 4.580 4.513 4.404 4.591 0.011 16 0 "[ . 1 . 2]" 1
1253 1 77 GLU HB2 1 89 SER H . . 4.570 3.911 3.035 4.563 . 0 0 "[ . 1 . 2]" 1
1254 1 77 GLU HB3 1 78 CYS H . . 4.580 4.069 3.687 4.455 . 0 0 "[ . 1 . 2]" 1
1255 1 77 GLU HB3 1 89 SER H . . 4.570 3.550 2.857 4.488 . 0 0 "[ . 1 . 2]" 1
1256 1 77 GLU QG 1 78 CYS H . . 4.500 3.872 3.329 4.435 . 0 0 "[ . 1 . 2]" 1
1257 1 78 CYS H 1 78 CYS HB2 . . 3.800 3.671 3.618 3.746 . 0 0 "[ . 1 . 2]" 1
1258 1 78 CYS H 1 78 CYS HB3 . . 3.840 2.819 2.642 2.997 . 0 0 "[ . 1 . 2]" 1
1259 1 78 CYS H 1 79 SER H . . 4.510 4.366 4.042 4.512 0.002 2 0 "[ . 1 . 2]" 1
1260 1 78 CYS HA 1 79 SER H . . 2.740 2.161 2.138 2.253 . 0 0 "[ . 1 . 2]" 1
1261 1 78 CYS HA 1 88 VAL MG2 . . 3.870 2.266 1.975 2.627 . 0 0 "[ . 1 . 2]" 1
1262 1 78 CYS HB2 1 79 SER H . . 4.050 3.488 3.203 4.025 . 0 0 "[ . 1 . 2]" 1
1263 1 78 CYS HB2 1 88 VAL MG2 . . 3.830 2.556 2.081 3.043 . 0 0 "[ . 1 . 2]" 1
1264 1 78 CYS HB3 1 79 SER H . . 4.520 4.323 4.207 4.532 0.012 15 0 "[ . 1 . 2]" 1
1265 1 78 CYS HB3 1 88 VAL MG2 . . 4.240 2.645 2.129 3.480 . 0 0 "[ . 1 . 2]" 1
1266 1 79 SER H 1 79 SER HB2 . . 3.400 3.156 2.201 3.486 0.086 15 0 "[ . 1 . 2]" 1
1267 1 79 SER H 1 79 SER HB3 . . 3.400 2.893 2.679 3.480 0.080 14 0 "[ . 1 . 2]" 1
1268 1 79 SER H 1 86 CYS QB . . 5.240 4.658 4.248 5.061 . 0 0 "[ . 1 . 2]" 1
1269 1 79 SER H 1 88 VAL HA . . 3.770 3.013 2.339 3.652 . 0 0 "[ . 1 . 2]" 1
1270 1 79 SER H 1 88 VAL MG2 . . 3.930 3.173 2.623 3.644 . 0 0 "[ . 1 . 2]" 1
1271 1 79 SER HA 1 80 ASP H . . 3.380 2.186 2.137 2.263 . 0 0 "[ . 1 . 2]" 1
1272 1 79 SER HB2 1 80 ASP H . . 4.630 4.149 2.906 4.456 . 0 0 "[ . 1 . 2]" 1
1273 1 79 SER HB3 1 80 ASP H . . 4.630 4.024 2.905 4.458 . 0 0 "[ . 1 . 2]" 1
1274 1 80 ASP H 1 80 ASP HB2 . . 3.670 2.966 2.223 3.659 . 0 0 "[ . 1 . 2]" 1
1275 1 80 ASP H 1 80 ASP QB . . 3.140 2.523 2.192 2.970 . 0 0 "[ . 1 . 2]" 1
1276 1 80 ASP H 1 80 ASP HB3 . . 3.670 3.147 2.247 3.668 . 0 0 "[ . 1 . 2]" 1
1277 1 80 ASP HA 1 81 ASN H . . 3.070 2.291 2.196 2.334 . 0 0 "[ . 1 . 2]" 1
1278 1 80 ASP HA 1 81 ASN HD21 . . 4.960 3.790 2.895 4.811 . 0 0 "[ . 1 . 2]" 1
1279 1 80 ASP HA 1 81 ASN HD22 . . 4.980 4.533 3.997 4.976 . 0 0 "[ . 1 . 2]" 1
1280 1 80 ASP HA 1 86 CYS HA . . 4.800 2.628 2.296 3.268 . 0 0 "[ . 1 . 2]" 1
1281 1 80 ASP HA 1 87 SER H . . 3.710 3.423 2.854 3.671 . 0 0 "[ . 1 . 2]" 1
1282 1 80 ASP QB 1 81 ASN H . . 3.540 2.767 2.590 3.327 . 0 0 "[ . 1 . 2]" 1
1283 1 80 ASP HB2 1 81 ASN H . . 4.200 3.394 2.668 4.200 . 0 0 "[ . 1 . 2]" 1
1284 1 80 ASP HB3 1 81 ASN H . . 4.200 3.322 2.637 4.149 . 0 0 "[ . 1 . 2]" 1
1285 1 81 ASN H 1 81 ASN HB2 . . 3.790 2.450 2.355 2.584 . 0 0 "[ . 1 . 2]" 1
1286 1 81 ASN H 1 81 ASN QB . . 3.190 2.414 2.325 2.539 . 0 0 "[ . 1 . 2]" 1
1287 1 81 ASN H 1 81 ASN HB3 . . 3.790 3.641 3.591 3.737 . 0 0 "[ . 1 . 2]" 1
1288 1 81 ASN H 1 81 ASN HD21 . . 4.030 2.569 1.801 3.445 . 0 0 "[ . 1 . 2]" 1
1289 1 81 ASN H 1 81 ASN HD22 . . 4.360 3.841 3.332 4.323 . 0 0 "[ . 1 . 2]" 1
1290 1 81 ASN H 1 82 GLY H . . 3.170 2.334 2.123 2.521 . 0 0 "[ . 1 . 2]" 1
1291 1 81 ASN H 1 82 GLY HA2 . . 5.160 4.502 4.216 4.680 . 0 0 "[ . 1 . 2]" 1
1292 1 81 ASN H 1 82 GLY QA . . 4.320 4.167 3.922 4.315 . 0 0 "[ . 1 . 2]" 1
1293 1 81 ASN H 1 82 GLY HA3 . . 5.160 4.915 4.666 5.077 . 0 0 "[ . 1 . 2]" 1
1294 1 81 ASN H 1 83 ASP H . . 4.270 4.210 4.048 4.267 . 0 0 "[ . 1 . 2]" 1
1295 1 81 ASN H 1 85 THR H . . 4.780 3.859 3.450 4.596 . 0 0 "[ . 1 . 2]" 1
1296 1 81 ASN H 1 86 CYS HA . . 3.440 3.130 2.819 3.403 . 0 0 "[ . 1 . 2]" 1
1297 1 81 ASN QB 1 81 ASN HD22 . . 3.460 3.288 3.224 3.371 . 0 0 "[ . 1 . 2]" 1
1298 1 81 ASN QB 1 82 GLY H . . 3.880 2.458 2.235 2.626 . 0 0 "[ . 1 . 2]" 1
1299 1 81 ASN QB 1 82 GLY QA . . 4.650 3.846 3.770 3.896 . 0 0 "[ . 1 . 2]" 1
1300 1 81 ASN QB 1 83 ASP H . . 3.410 2.530 2.433 2.640 . 0 0 "[ . 1 . 2]" 1
1301 1 81 ASN QB 1 84 GLY H . . 4.520 3.522 3.126 4.197 . 0 0 "[ . 1 . 2]" 1
1302 1 81 ASN QB 1 85 THR H . . 3.870 2.811 2.489 3.109 . 0 0 "[ . 1 . 2]" 1
1303 1 81 ASN QB 1 85 THR HB . . 5.340 4.163 3.772 4.607 . 0 0 "[ . 1 . 2]" 1
1304 1 81 ASN HB2 1 82 GLY H . . 4.410 2.510 2.274 2.698 . 0 0 "[ . 1 . 2]" 1
1305 1 81 ASN HB2 1 83 ASP H . . 4.020 2.697 2.512 2.863 . 0 0 "[ . 1 . 2]" 1
1306 1 81 ASN HB2 1 85 THR H . . 4.590 2.846 2.517 3.163 . 0 0 "[ . 1 . 2]" 1
1307 1 81 ASN HB3 1 82 GLY H . . 4.410 3.513 3.249 3.642 . 0 0 "[ . 1 . 2]" 1
1308 1 81 ASN HB3 1 83 ASP H . . 4.020 3.093 2.850 3.361 . 0 0 "[ . 1 . 2]" 1
1309 1 81 ASN HB3 1 85 THR H . . 4.590 4.391 3.932 4.583 . 0 0 "[ . 1 . 2]" 1
1310 1 81 ASN HD21 1 83 ASP H . . 5.140 4.787 4.375 5.119 . 0 0 "[ . 1 . 2]" 1
1311 1 81 ASN HD21 1 85 THR HB . . 4.800 3.206 2.217 3.776 . 0 0 "[ . 1 . 2]" 1
1312 1 81 ASN HD21 1 85 THR MG . . 4.780 4.325 3.531 4.766 . 0 0 "[ . 1 . 2]" 1
1313 1 81 ASN HD21 1 86 CYS H . . 5.200 3.385 3.110 3.657 . 0 0 "[ . 1 . 2]" 1
1314 1 81 ASN HD21 1 86 CYS HA . . 4.860 2.504 2.002 3.314 . 0 0 "[ . 1 . 2]" 1
1315 1 81 ASN HD21 1 87 SER H . . 4.530 3.641 2.932 4.464 . 0 0 "[ . 1 . 2]" 1
1316 1 81 ASN HD21 1 87 SER QB . . 4.920 4.045 3.514 4.541 . 0 0 "[ . 1 . 2]" 1
1317 1 81 ASN HD22 1 85 THR H . . 5.180 5.072 4.916 5.180 . 0 0 "[ . 1 . 2]" 1
1318 1 81 ASN HD22 1 85 THR HB . . 4.920 3.521 2.985 3.797 . 0 0 "[ . 1 . 2]" 1
1319 1 81 ASN HD22 1 85 THR MG . . 5.160 4.827 4.453 5.048 . 0 0 "[ . 1 . 2]" 1
1320 1 81 ASN HD22 1 86 CYS HA . . 4.660 2.914 2.414 3.634 . 0 0 "[ . 1 . 2]" 1
1321 1 81 ASN HD22 1 87 SER H . . 4.350 2.965 2.339 3.710 . 0 0 "[ . 1 . 2]" 1
1322 1 81 ASN HD22 1 87 SER QB . . 4.470 2.657 2.269 3.037 . 0 0 "[ . 1 . 2]" 1
1323 1 82 GLY H 1 83 ASP H . . 3.570 2.362 1.958 2.566 . 0 0 "[ . 1 . 2]" 1
1324 1 82 GLY H 1 84 GLY H . . 4.380 2.910 2.757 3.233 . 0 0 "[ . 1 . 2]" 1
1325 1 82 GLY H 1 85 THR H . . 4.800 3.303 3.083 3.917 . 0 0 "[ . 1 . 2]" 1
1326 1 82 GLY H 1 86 CYS HA . . 5.300 5.186 5.030 5.303 0.003 9 0 "[ . 1 . 2]" 1
1327 1 82 GLY HA2 1 84 GLY H . . 4.830 3.821 3.388 4.079 . 0 0 "[ . 1 . 2]" 1
1328 1 82 GLY HA3 1 84 GLY H . . 4.830 4.524 4.192 4.790 . 0 0 "[ . 1 . 2]" 1
1329 1 83 ASP H 1 83 ASP HB2 . . 4.110 2.853 2.218 3.692 . 0 0 "[ . 1 . 2]" 1
1330 1 83 ASP H 1 83 ASP QB . . 3.530 2.454 2.195 2.960 . 0 0 "[ . 1 . 2]" 1
1331 1 83 ASP H 1 83 ASP HB3 . . 4.110 2.958 2.338 3.708 . 0 0 "[ . 1 . 2]" 1
1332 1 83 ASP H 1 84 GLY H . . 3.220 2.306 1.907 2.801 . 0 0 "[ . 1 . 2]" 1
1333 1 83 ASP H 1 84 GLY QA . . 4.900 4.294 4.034 4.508 . 0 0 "[ . 1 . 2]" 1
1334 1 83 ASP H 1 85 THR H . . 3.450 3.187 2.981 3.405 . 0 0 "[ . 1 . 2]" 1
1335 1 83 ASP H 1 85 THR MG . . 5.500 5.015 4.621 5.348 . 0 0 "[ . 1 . 2]" 1
1336 1 83 ASP QB 1 84 GLY H . . 4.450 3.404 3.044 4.033 . 0 0 "[ . 1 . 2]" 1
1337 1 83 ASP HB2 1 84 GLY H . . 5.110 4.012 3.207 4.520 . 0 0 "[ . 1 . 2]" 1
1338 1 83 ASP HB3 1 84 GLY H . . 5.110 3.849 3.168 4.535 . 0 0 "[ . 1 . 2]" 1
1339 1 84 GLY H 1 85 THR H . . 3.090 2.004 1.801 2.453 . 0 0 "[ . 1 . 2]" 1
1340 1 84 GLY H 1 85 THR MG . . 4.590 4.314 4.031 4.590 . 0 0 "[ . 1 . 2]" 1
1341 1 85 THR H 1 85 THR HB . . 3.900 3.792 3.703 3.855 . 0 0 "[ . 1 . 2]" 1
1342 1 85 THR H 1 85 THR MG . . 3.420 3.115 2.604 3.322 . 0 0 "[ . 1 . 2]" 1
1343 1 85 THR H 1 86 CYS H . . 4.550 4.436 4.389 4.539 . 0 0 "[ . 1 . 2]" 1
1344 1 85 THR HA 1 85 THR MG . . 3.450 2.243 2.124 2.382 . 0 0 "[ . 1 . 2]" 1
1345 1 85 THR HA 1 86 CYS H . . 2.920 2.491 2.321 2.628 . 0 0 "[ . 1 . 2]" 1
1346 1 85 THR HA 1 86 CYS HA . . 5.210 4.478 4.401 4.550 . 0 0 "[ . 1 . 2]" 1
1347 1 85 THR HB 1 86 CYS H . . 3.290 2.202 1.917 2.594 . 0 0 "[ . 1 . 2]" 1
1348 1 85 THR MG 1 86 CYS H . . 3.800 3.474 3.308 3.672 . 0 0 "[ . 1 . 2]" 1
1349 1 86 CYS H 1 86 CYS HB2 . . 4.160 2.787 2.458 3.745 . 0 0 "[ . 1 . 2]" 1
1350 1 86 CYS H 1 86 CYS QB . . 3.570 2.635 2.420 2.760 . 0 0 "[ . 1 . 2]" 1
1351 1 86 CYS H 1 86 CYS HB3 . . 4.160 3.585 2.671 3.884 . 0 0 "[ . 1 . 2]" 1
1352 1 86 CYS H 1 87 SER H . . 4.580 4.360 4.222 4.520 . 0 0 "[ . 1 . 2]" 1
1353 1 86 CYS HA 1 87 SER H . . 2.790 2.217 2.154 2.386 . 0 0 "[ . 1 . 2]" 1
1354 1 86 CYS QB 1 87 SER H . . 3.450 3.053 2.617 3.442 . 0 0 "[ . 1 . 2]" 1
1355 1 86 CYS QB 1 88 VAL H . . 5.340 3.867 3.366 4.395 . 0 0 "[ . 1 . 2]" 1
1356 1 86 CYS HB2 1 87 SER H . . 4.210 4.074 2.653 4.211 0.001 17 0 "[ . 1 . 2]" 1
1357 1 86 CYS HB2 1 88 VAL MG2 . . 4.020 3.787 2.694 4.025 0.005 12 0 "[ . 1 . 2]" 1
1358 1 86 CYS HB3 1 87 SER H . . 4.210 3.221 2.778 3.989 . 0 0 "[ . 1 . 2]" 1
1359 1 86 CYS HB3 1 88 VAL MG2 . . 4.020 2.908 2.508 3.817 . 0 0 "[ . 1 . 2]" 1
1360 1 87 SER H 1 87 SER HB2 . . 3.610 2.943 2.387 3.613 0.003 1 0 "[ . 1 . 2]" 1
1361 1 87 SER H 1 87 SER QB . . 3.010 2.516 2.356 3.015 0.005 6 0 "[ . 1 . 2]" 1
1362 1 87 SER H 1 87 SER HB3 . . 3.610 3.042 2.453 3.625 0.015 9 0 "[ . 1 . 2]" 1
1363 1 87 SER H 1 88 VAL H . . 4.120 3.722 2.806 4.092 . 0 0 "[ . 1 . 2]" 1
1364 1 87 SER HA 1 88 VAL H . . 3.030 2.312 2.168 2.705 . 0 0 "[ . 1 . 2]" 1
1365 1 87 SER QB 1 88 VAL H . . 4.000 3.930 3.645 4.050 0.050 8 0 "[ . 1 . 2]" 1
1366 1 87 SER HB2 1 88 VAL H . . 4.550 4.506 4.116 4.591 0.041 10 0 "[ . 1 . 2]" 1
1367 1 87 SER HB3 1 88 VAL H . . 4.550 4.358 3.832 4.557 0.007 6 0 "[ . 1 . 2]" 1
1368 1 88 VAL H 1 88 VAL HB . . 3.360 2.559 2.475 2.664 . 0 0 "[ . 1 . 2]" 1
1369 1 88 VAL H 1 88 VAL MG1 . . 4.020 3.796 3.770 3.840 . 0 0 "[ . 1 . 2]" 1
1370 1 88 VAL H 1 88 VAL MG2 . . 3.250 2.341 1.909 2.571 . 0 0 "[ . 1 . 2]" 1
1371 1 88 VAL HA 1 89 SER H . . 3.040 2.152 2.140 2.188 . 0 0 "[ . 1 . 2]" 1
1372 1 88 VAL HB 1 89 SER H . . 4.270 4.163 4.005 4.266 . 0 0 "[ . 1 . 2]" 1
1373 1 88 VAL MG1 1 89 SER H . . 3.030 2.518 2.136 2.806 . 0 0 "[ . 1 . 2]" 1
1374 1 88 VAL MG1 1 89 SER HA . . 4.070 3.703 3.476 4.043 . 0 0 "[ . 1 . 2]" 1
1375 1 88 VAL MG1 1 90 TYR H . . 4.430 4.266 4.039 4.429 . 0 0 "[ . 1 . 2]" 1
1376 1 88 VAL MG1 1 90 TYR QD . . 4.560 3.881 3.528 4.198 . 0 0 "[ . 1 . 2]" 1
1377 1 89 SER H 1 89 SER HB2 . . 4.140 3.731 3.646 3.789 . 0 0 "[ . 1 . 2]" 1
1378 1 89 SER H 1 89 SER HB3 . . 3.980 3.181 2.917 3.316 . 0 0 "[ . 1 . 2]" 1
1379 1 89 SER H 1 90 TYR H . . 4.420 4.364 4.300 4.426 0.006 18 0 "[ . 1 . 2]" 1
1380 1 89 SER HA 1 90 TYR H . . 2.910 2.156 2.146 2.169 . 0 0 "[ . 1 . 2]" 1
1381 1 89 SER HA 1 90 TYR HA . . 5.500 4.394 4.389 4.401 . 0 0 "[ . 1 . 2]" 1
1382 1 89 SER HB2 1 90 TYR H . . 3.590 3.270 3.183 3.340 . 0 0 "[ . 1 . 2]" 1
1383 1 89 SER HB3 1 90 TYR H . . 4.350 4.127 4.039 4.229 . 0 0 "[ . 1 . 2]" 1
1384 1 90 TYR H 1 90 TYR QD . . 3.750 2.592 2.372 2.884 . 0 0 "[ . 1 . 2]" 1
1385 1 90 TYR H 1 91 LEU H . . 4.570 4.481 4.441 4.511 . 0 0 "[ . 1 . 2]" 1
1386 1 90 TYR H 1 91 LEU HA . . 5.170 4.935 4.874 4.999 . 0 0 "[ . 1 . 2]" 1
1387 1 90 TYR HA 1 90 TYR QD . . 4.480 3.729 3.711 3.741 . 0 0 "[ . 1 . 2]" 1
1388 1 90 TYR HA 1 91 LEU H . . 2.920 2.314 2.219 2.443 . 0 0 "[ . 1 . 2]" 1
1389 1 90 TYR HA 1 91 LEU HB2 . . 4.760 4.145 4.109 4.182 . 0 0 "[ . 1 . 2]" 1
1390 1 90 TYR HA 1 91 LEU HB3 . . 5.500 5.555 5.547 5.565 0.065 17 0 "[ . 1 . 2]" 1
1391 1 90 TYR HA 1 91 LEU HG . . 5.450 4.519 4.440 4.615 . 0 0 "[ . 1 . 2]" 1
1392 1 90 TYR HB2 1 91 LEU H . . 3.580 2.696 2.396 2.972 . 0 0 "[ . 1 . 2]" 1
1393 1 90 TYR HB3 1 91 LEU H . . 4.430 3.973 3.806 4.128 . 0 0 "[ . 1 . 2]" 1
1394 1 90 TYR QD 1 91 LEU H . . 4.280 3.315 2.875 3.610 . 0 0 "[ . 1 . 2]" 1
1395 1 90 TYR QD 1 92 PRO HD2 . . 5.020 3.882 3.581 4.212 . 0 0 "[ . 1 . 2]" 1
1396 1 90 TYR QD 1 92 PRO QD . . 4.420 2.284 1.988 2.747 . 0 0 "[ . 1 . 2]" 1
1397 1 90 TYR QD 1 92 PRO HD3 . . 5.020 2.301 1.998 2.785 . 0 0 "[ . 1 . 2]" 1
1398 1 90 TYR QE 1 100 VAL MG2 . . 3.970 3.815 3.408 3.964 . 0 0 "[ . 1 . 2]" 1
1399 1 90 TYR QE 1 116 ALA MB . . 4.600 3.760 3.557 3.995 . 0 0 "[ . 1 . 2]" 1
1400 1 90 TYR QE 1 118 ILE MD . . 4.080 2.530 2.183 2.785 . 0 0 "[ . 1 . 2]" 1
1401 1 90 TYR HH 1 100 VAL MG2 . . 4.540 4.259 3.976 4.497 . 0 0 "[ . 1 . 2]" 1
1402 1 90 TYR HH 1 116 ALA MB . . 3.360 2.404 2.142 2.805 . 0 0 "[ . 1 . 2]" 1
1403 1 90 TYR HH 1 118 ILE MD . . 3.950 3.036 2.762 3.318 . 0 0 "[ . 1 . 2]" 1
1404 1 91 LEU H 1 91 LEU HB2 . . 3.270 2.475 2.361 2.589 . 0 0 "[ . 1 . 2]" 1
1405 1 91 LEU H 1 91 LEU HB3 . . 3.910 3.586 3.534 3.638 . 0 0 "[ . 1 . 2]" 1
1406 1 91 LEU H 1 91 LEU MD1 . . 4.360 3.965 3.794 4.119 . 0 0 "[ . 1 . 2]" 1
1407 1 91 LEU H 1 91 LEU MD2 . . 4.560 4.485 4.418 4.548 . 0 0 "[ . 1 . 2]" 1
1408 1 91 LEU H 1 91 LEU HG . . 4.260 3.744 3.632 3.850 . 0 0 "[ . 1 . 2]" 1
1409 1 91 LEU H 1 92 PRO HD2 . . 4.930 4.571 4.518 4.688 . 0 0 "[ . 1 . 2]" 1
1410 1 91 LEU H 1 92 PRO QD . . 4.300 3.839 3.761 4.010 . 0 0 "[ . 1 . 2]" 1
1411 1 91 LEU H 1 92 PRO HD3 . . 4.930 4.126 4.024 4.357 . 0 0 "[ . 1 . 2]" 1
1412 1 91 LEU HA 1 91 LEU MD1 . . 4.100 3.785 3.772 3.808 . 0 0 "[ . 1 . 2]" 1
1413 1 91 LEU HA 1 91 LEU MD2 . . 3.380 2.483 2.292 2.576 . 0 0 "[ . 1 . 2]" 1
1414 1 91 LEU HA 1 92 PRO HD2 . . 4.060 1.917 1.912 1.958 . 0 0 "[ . 1 . 2]" 1
1415 1 91 LEU HA 1 92 PRO QD . . 3.500 1.852 1.850 1.865 . 0 0 "[ . 1 . 2]" 1
1416 1 91 LEU HA 1 92 PRO HD3 . . 4.060 2.454 2.346 2.473 . 0 0 "[ . 1 . 2]" 1
1417 1 91 LEU HB2 1 91 LEU MD1 . . 3.270 2.133 1.985 2.254 . 0 0 "[ . 1 . 2]" 1
1418 1 91 LEU HB2 1 92 PRO QD . . 5.270 4.324 4.237 4.337 . 0 0 "[ . 1 . 2]" 1
1419 1 91 LEU HB3 1 91 LEU MD2 . . 3.110 2.124 2.034 2.214 . 0 0 "[ . 1 . 2]" 1
1420 1 91 LEU HB3 1 92 PRO QD . . 4.600 3.628 3.381 3.667 . 0 0 "[ . 1 . 2]" 1
1421 1 91 LEU MD2 1 92 PRO HD2 . . 4.570 2.855 2.650 2.939 . 0 0 "[ . 1 . 2]" 1
1422 1 91 LEU MD2 1 92 PRO QD . . 3.920 2.809 2.612 2.890 . 0 0 "[ . 1 . 2]" 1
1423 1 91 LEU MD2 1 92 PRO HD3 . . 4.570 4.179 3.955 4.283 . 0 0 "[ . 1 . 2]" 1
1424 1 91 LEU HG 1 92 PRO HD2 . . 4.940 4.054 3.881 4.176 . 0 0 "[ . 1 . 2]" 1
1425 1 91 LEU HG 1 92 PRO QD . . 4.320 3.854 3.700 3.960 . 0 0 "[ . 1 . 2]" 1
1426 1 91 LEU HG 1 92 PRO HD3 . . 4.940 4.819 4.665 4.917 . 0 0 "[ . 1 . 2]" 1
1427 1 92 PRO HA 1 93 THR H . . 3.240 2.406 2.265 2.556 . 0 0 "[ . 1 . 2]" 1
1428 1 92 PRO HA 1 93 THR MG . . 5.140 3.669 3.309 4.031 . 0 0 "[ . 1 . 2]" 1
1429 1 92 PRO QB 1 94 LYS H . . 4.050 3.272 2.998 3.484 . 0 0 "[ . 1 . 2]" 1
1430 1 92 PRO QB 1 98 TYR QE . . 4.970 2.679 2.340 3.010 . 0 0 "[ . 1 . 2]" 1
1431 1 92 PRO QB 1 118 ILE HG13 . . 3.560 2.878 2.408 3.188 . 0 0 "[ . 1 . 2]" 1
1432 1 92 PRO HB2 1 93 THR H . . 4.290 2.607 2.247 2.991 . 0 0 "[ . 1 . 2]" 1
1433 1 92 PRO HB2 1 94 LYS H . . 4.750 3.353 3.056 3.594 . 0 0 "[ . 1 . 2]" 1
1434 1 92 PRO HB2 1 118 ILE MG . . 3.800 3.140 2.561 3.431 . 0 0 "[ . 1 . 2]" 1
1435 1 92 PRO HB3 1 93 THR H . . 4.290 3.454 3.280 3.659 . 0 0 "[ . 1 . 2]" 1
1436 1 92 PRO HB3 1 94 LYS H . . 4.750 4.571 4.345 4.733 . 0 0 "[ . 1 . 2]" 1
1437 1 92 PRO HB3 1 118 ILE MG . . 3.800 3.606 2.795 3.802 0.002 8 0 "[ . 1 . 2]" 1
1438 1 92 PRO HG2 1 118 ILE MD . . 4.020 3.847 3.463 4.016 . 0 0 "[ . 1 . 2]" 1
1439 1 92 PRO HG2 1 118 ILE HG13 . . 4.850 4.397 3.854 4.842 . 0 0 "[ . 1 . 2]" 1
1440 1 92 PRO HG2 1 118 ILE MG . . 3.580 3.160 2.972 3.430 . 0 0 "[ . 1 . 2]" 1
1441 1 92 PRO HG3 1 118 ILE MD . . 3.520 2.403 2.056 2.611 . 0 0 "[ . 1 . 2]" 1
1442 1 92 PRO HG3 1 118 ILE MG . . 3.400 2.671 2.491 2.921 . 0 0 "[ . 1 . 2]" 1
1443 1 93 THR H 1 93 THR HB . . 4.200 3.514 3.000 3.810 . 0 0 "[ . 1 . 2]" 1
1444 1 93 THR H 1 93 THR MG . . 3.410 2.515 1.870 3.169 . 0 0 "[ . 1 . 2]" 1
1445 1 93 THR H 1 94 LYS H . . 3.190 1.985 1.819 2.239 . 0 0 "[ . 1 . 2]" 1
1446 1 93 THR H 1 94 LYS QG . . 4.470 3.899 3.567 4.412 . 0 0 "[ . 1 . 2]" 1
1447 1 93 THR H 1 98 TYR QE . . 4.770 3.577 3.031 4.088 . 0 0 "[ . 1 . 2]" 1
1448 1 93 THR H 1 98 TYR HH . . 4.200 2.772 2.122 3.313 . 0 0 "[ . 1 . 2]" 1
1449 1 93 THR HA 1 93 THR MG . . 3.210 2.636 2.065 3.200 . 0 0 "[ . 1 . 2]" 1
1450 1 93 THR HB 1 94 LYS H . . 4.820 3.802 3.467 4.115 . 0 0 "[ . 1 . 2]" 1
1451 1 93 THR MG 1 94 LYS H . . 4.350 3.152 1.911 4.101 . 0 0 "[ . 1 . 2]" 1
1452 1 94 LYS H 1 94 LYS HB2 . . 4.140 3.577 2.695 3.901 . 0 0 "[ . 1 . 2]" 1
1453 1 94 LYS H 1 94 LYS QB . . 3.560 2.950 2.642 3.186 . 0 0 "[ . 1 . 2]" 1
1454 1 94 LYS H 1 94 LYS HB3 . . 4.140 3.343 2.923 3.890 . 0 0 "[ . 1 . 2]" 1
1455 1 94 LYS H 1 94 LYS QG . . 3.990 2.420 1.990 3.040 . 0 0 "[ . 1 . 2]" 1
1456 1 94 LYS H 1 95 PRO HD2 . . 5.090 4.819 4.808 4.829 . 0 0 "[ . 1 . 2]" 1
1457 1 94 LYS H 1 95 PRO HD3 . . 5.090 4.894 4.814 4.933 . 0 0 "[ . 1 . 2]" 1
1458 1 94 LYS H 1 98 TYR QE . . 4.190 4.018 3.696 4.198 0.008 19 0 "[ . 1 . 2]" 1
1459 1 94 LYS H 1 98 TYR HH . . 3.350 2.336 1.932 3.090 . 0 0 "[ . 1 . 2]" 1
1460 1 94 LYS HA 1 95 PRO HD2 . . 3.870 2.344 2.240 2.423 . 0 0 "[ . 1 . 2]" 1
1461 1 94 LYS HA 1 95 PRO QD . . 3.320 2.059 2.004 2.104 . 0 0 "[ . 1 . 2]" 1
1462 1 94 LYS HA 1 95 PRO HD3 . . 3.870 2.283 2.258 2.310 . 0 0 "[ . 1 . 2]" 1
1463 1 94 LYS HA 1 95 PRO QG . . 4.760 3.968 3.907 4.017 . 0 0 "[ . 1 . 2]" 1
1464 1 94 LYS QB 1 94 LYS QD . . 2.830 2.196 2.064 2.439 . 0 0 "[ . 1 . 2]" 1
1465 1 94 LYS QB 1 94 LYS QE . . 3.990 2.598 1.959 3.666 . 0 0 "[ . 1 . 2]" 1
1466 1 94 LYS QB 1 95 PRO QD . . 3.350 2.069 1.958 2.264 . 0 0 "[ . 1 . 2]" 1
1467 1 94 LYS HB2 1 94 LYS HD2 . . 4.080 3.081 2.345 3.662 . 0 0 "[ . 1 . 2]" 1
1468 1 94 LYS HB2 1 94 LYS HD3 . . 4.080 3.122 2.188 3.951 . 0 0 "[ . 1 . 2]" 1
1469 1 94 LYS HB2 1 94 LYS QE . . 4.860 2.890 1.979 4.114 . 0 0 "[ . 1 . 2]" 1
1470 1 94 LYS HB2 1 95 PRO HD2 . . 4.740 2.479 1.995 3.720 . 0 0 "[ . 1 . 2]" 1
1471 1 94 LYS HB2 1 95 PRO HD3 . . 4.740 3.812 3.446 4.742 0.002 15 0 "[ . 1 . 2]" 1
1472 1 94 LYS HB3 1 94 LYS HD2 . . 4.080 3.079 2.119 4.207 0.127 19 0 "[ . 1 . 2]" 1
1473 1 94 LYS HB3 1 94 LYS HD3 . . 4.080 3.301 2.371 3.677 . 0 0 "[ . 1 . 2]" 1
1474 1 94 LYS HB3 1 94 LYS QE . . 4.860 3.325 2.057 4.287 . 0 0 "[ . 1 . 2]" 1
1475 1 94 LYS HB3 1 95 PRO HD2 . . 4.740 3.101 2.007 3.673 . 0 0 "[ . 1 . 2]" 1
1476 1 94 LYS HB3 1 95 PRO HD3 . . 4.740 4.181 3.450 4.596 . 0 0 "[ . 1 . 2]" 1
1477 1 94 LYS QE 1 94 LYS HG2 . . 3.420 2.834 2.200 3.409 . 0 0 "[ . 1 . 2]" 1
1478 1 94 LYS QE 1 94 LYS QG . . 2.960 2.259 2.062 2.523 . 0 0 "[ . 1 . 2]" 1
1479 1 94 LYS QE 1 94 LYS HG3 . . 3.420 2.710 2.085 3.443 0.023 8 0 "[ . 1 . 2]" 1
1480 1 94 LYS QG 1 95 PRO QD . . 4.390 3.559 3.173 3.984 . 0 0 "[ . 1 . 2]" 1
1481 1 95 PRO HA 1 96 GLY H . . 3.040 2.182 2.154 2.343 . 0 0 "[ . 1 . 2]" 1
1482 1 95 PRO HA 1 96 GLY QA . . 5.110 3.930 3.920 3.992 . 0 0 "[ . 1 . 2]" 1
1483 1 95 PRO HA 1 118 ILE H . . 4.810 4.666 4.327 4.815 0.005 9 0 "[ . 1 . 2]" 1
1484 1 95 PRO HA 1 118 ILE HB . . 4.290 2.686 2.370 2.896 . 0 0 "[ . 1 . 2]" 1
1485 1 95 PRO HA 1 118 ILE MG . . 3.640 2.353 2.062 2.519 . 0 0 "[ . 1 . 2]" 1
1486 1 95 PRO QB 1 96 GLY H . . 3.960 3.458 3.127 3.855 . 0 0 "[ . 1 . 2]" 1
1487 1 95 PRO QB 1 118 ILE HB . . 4.350 4.124 3.812 4.347 . 0 0 "[ . 1 . 2]" 1
1488 1 95 PRO QB 1 118 ILE MG . . 4.060 3.157 2.865 3.549 . 0 0 "[ . 1 . 2]" 1
1489 1 95 PRO QB 1 120 MET H . . 4.690 3.586 3.095 4.037 . 0 0 "[ . 1 . 2]" 1
1490 1 95 PRO QB 1 120 MET QG . . 3.460 2.446 1.973 2.944 . 0 0 "[ . 1 . 2]" 1
1491 1 95 PRO HB2 1 118 ILE HB . . 5.070 4.774 4.510 5.048 . 0 0 "[ . 1 . 2]" 1
1492 1 95 PRO HB2 1 118 ILE MG . . 4.790 4.220 3.850 4.589 . 0 0 "[ . 1 . 2]" 1
1493 1 95 PRO HB3 1 118 ILE HB . . 5.070 4.512 4.111 4.761 . 0 0 "[ . 1 . 2]" 1
1494 1 95 PRO HB3 1 118 ILE MG . . 4.790 3.261 2.947 3.694 . 0 0 "[ . 1 . 2]" 1
1495 1 95 PRO QD 1 120 MET ME . . 3.450 2.563 1.892 3.457 0.007 9 0 "[ . 1 . 2]" 1
1496 1 95 PRO QD 1 120 MET QG . . 4.690 3.142 2.785 3.741 . 0 0 "[ . 1 . 2]" 1
1497 1 95 PRO HD2 1 120 MET ME . . 4.000 3.295 2.766 3.973 . 0 0 "[ . 1 . 2]" 1
1498 1 95 PRO HD3 1 120 MET ME . . 4.000 2.698 1.918 3.940 . 0 0 "[ . 1 . 2]" 1
1499 1 95 PRO QG 1 120 MET HA . . 5.310 4.387 4.035 5.086 . 0 0 "[ . 1 . 2]" 1
1500 1 95 PRO QG 1 120 MET HG2 . . 3.440 2.431 2.006 3.298 . 0 0 "[ . 1 . 2]" 1
1501 1 95 PRO QG 1 120 MET HG3 . . 3.440 2.568 2.020 3.181 . 0 0 "[ . 1 . 2]" 1
1502 1 96 GLY H 1 97 GLU H . . 4.170 3.783 3.572 3.997 . 0 0 "[ . 1 . 2]" 1
1503 1 96 GLY H 1 98 TYR QD . . 4.640 4.397 4.071 4.644 0.004 12 0 "[ . 1 . 2]" 1
1504 1 96 GLY H 1 98 TYR QE . . 3.930 3.136 2.714 3.610 . 0 0 "[ . 1 . 2]" 1
1505 1 96 GLY H 1 118 ILE H . . 3.580 3.350 3.110 3.582 0.002 16 0 "[ . 1 . 2]" 1
1506 1 96 GLY H 1 118 ILE HB . . 3.420 2.195 1.944 2.478 . 0 0 "[ . 1 . 2]" 1
1507 1 96 GLY H 1 118 ILE HG12 . . 4.450 4.190 3.847 4.454 0.004 18 0 "[ . 1 . 2]" 1
1508 1 96 GLY H 1 118 ILE HG13 . . 4.930 4.117 3.716 4.436 . 0 0 "[ . 1 . 2]" 1
1509 1 96 GLY H 1 118 ILE MG . . 3.710 3.375 3.157 3.653 . 0 0 "[ . 1 . 2]" 1
1510 1 96 GLY QA 1 97 GLU H . . 2.720 2.114 2.109 2.125 . 0 0 "[ . 1 . 2]" 1
1511 1 96 GLY HA2 1 97 GLU H . . 3.320 3.280 3.174 3.343 0.023 9 0 "[ . 1 . 2]" 1
1512 1 96 GLY HA3 1 97 GLU H . . 3.320 2.141 2.137 2.150 . 0 0 "[ . 1 . 2]" 1
1513 1 97 GLU H 1 97 GLU HB2 . . 4.000 3.363 2.723 3.982 . 0 0 "[ . 1 . 2]" 1
1514 1 97 GLU H 1 97 GLU QB . . 3.240 2.953 2.667 3.234 . 0 0 "[ . 1 . 2]" 1
1515 1 97 GLU H 1 97 GLU HB3 . . 4.000 3.602 3.121 3.924 . 0 0 "[ . 1 . 2]" 1
1516 1 97 GLU H 1 97 GLU QG . . 3.730 3.178 2.377 3.694 . 0 0 "[ . 1 . 2]" 1
1517 1 97 GLU H 1 98 TYR H . . 4.260 4.151 3.976 4.259 . 0 0 "[ . 1 . 2]" 1
1518 1 97 GLU H 1 98 TYR HA . . 4.970 4.641 4.494 4.703 . 0 0 "[ . 1 . 2]" 1
1519 1 97 GLU HA 1 98 TYR H . . 3.070 2.152 2.138 2.196 . 0 0 "[ . 1 . 2]" 1
1520 1 97 GLU HA 1 116 ALA H . . 4.500 4.152 3.952 4.279 . 0 0 "[ . 1 . 2]" 1
1521 1 97 GLU QB 1 98 TYR H . . 3.620 3.220 3.020 3.372 . 0 0 "[ . 1 . 2]" 1
1522 1 97 GLU QB 1 115 LYS QG . . 3.830 2.533 2.074 2.925 . 0 0 "[ . 1 . 2]" 1
1523 1 97 GLU HB2 1 98 TYR H . . 4.330 3.795 3.100 4.330 . 0 0 "[ . 1 . 2]" 1
1524 1 97 GLU HB2 1 99 PHE QE . . 4.330 3.051 2.653 3.921 . 0 0 "[ . 1 . 2]" 1
1525 1 97 GLU HB2 1 115 LYS QG . . 4.440 3.314 2.097 4.409 . 0 0 "[ . 1 . 2]" 1
1526 1 97 GLU HB3 1 98 TYR H . . 4.330 3.797 3.305 4.314 . 0 0 "[ . 1 . 2]" 1
1527 1 97 GLU HB3 1 99 PHE QE . . 4.330 3.405 2.178 4.289 . 0 0 "[ . 1 . 2]" 1
1528 1 97 GLU HB3 1 115 LYS QG . . 4.440 3.159 2.305 4.031 . 0 0 "[ . 1 . 2]" 1
1529 1 97 GLU QG 1 98 TYR H . . 4.660 4.155 3.547 4.662 0.002 6 0 "[ . 1 . 2]" 1
1530 1 97 GLU QG 1 115 LYS QE . . 5.030 4.571 3.849 5.024 . 0 0 "[ . 1 . 2]" 1
1531 1 97 GLU QG 1 115 LYS QG . . 3.870 3.322 2.792 3.708 . 0 0 "[ . 1 . 2]" 1
1532 1 97 GLU HG2 1 115 LYS QG . . 4.440 3.898 2.828 4.449 0.009 10 0 "[ . 1 . 2]" 1
1533 1 97 GLU HG3 1 115 LYS QG . . 4.440 3.878 2.986 4.451 0.011 4 0 "[ . 1 . 2]" 1
1534 1 98 TYR H 1 98 TYR HB2 . . 3.560 2.593 2.486 2.656 . 0 0 "[ . 1 . 2]" 1
1535 1 98 TYR H 1 98 TYR HB3 . . 3.870 3.743 3.671 3.788 . 0 0 "[ . 1 . 2]" 1
1536 1 98 TYR H 1 98 TYR QD . . 3.810 2.549 2.237 2.894 . 0 0 "[ . 1 . 2]" 1
1537 1 98 TYR H 1 98 TYR QE . . 5.010 4.659 4.423 4.882 . 0 0 "[ . 1 . 2]" 1
1538 1 98 TYR H 1 99 PHE H . . 4.650 4.288 4.156 4.469 . 0 0 "[ . 1 . 2]" 1
1539 1 98 TYR H 1 115 LYS HA . . 4.560 4.307 3.984 4.527 . 0 0 "[ . 1 . 2]" 1
1540 1 98 TYR H 1 115 LYS QG . . 4.350 4.008 3.589 4.351 0.001 4 0 "[ . 1 . 2]" 1
1541 1 98 TYR H 1 116 ALA H . . 3.620 2.826 2.527 3.003 . 0 0 "[ . 1 . 2]" 1
1542 1 98 TYR H 1 116 ALA MB . . 4.030 3.334 3.046 3.608 . 0 0 "[ . 1 . 2]" 1
1543 1 98 TYR H 1 118 ILE HG12 . . 4.390 3.860 3.439 4.240 . 0 0 "[ . 1 . 2]" 1
1544 1 98 TYR HA 1 99 PHE H . . 2.850 2.144 2.138 2.176 . 0 0 "[ . 1 . 2]" 1
1545 1 98 TYR HA 1 99 PHE HA . . 4.900 4.391 4.376 4.407 . 0 0 "[ . 1 . 2]" 1
1546 1 98 TYR HA 1 99 PHE QD . . 4.720 3.304 2.969 4.250 . 0 0 "[ . 1 . 2]" 1
1547 1 98 TYR HA 1 116 ALA H . . 5.410 4.747 4.578 4.961 . 0 0 "[ . 1 . 2]" 1
1548 1 98 TYR HB2 1 99 PHE H . . 4.530 4.288 4.127 4.385 . 0 0 "[ . 1 . 2]" 1
1549 1 98 TYR HB2 1 100 VAL MG2 . . 3.960 3.903 3.750 3.968 0.008 13 0 "[ . 1 . 2]" 1
1550 1 98 TYR HB2 1 116 ALA H . . 4.530 3.871 3.583 4.132 . 0 0 "[ . 1 . 2]" 1
1551 1 98 TYR HB2 1 116 ALA MB . . 3.730 2.982 2.839 3.170 . 0 0 "[ . 1 . 2]" 1
1552 1 98 TYR HB3 1 99 PHE H . . 3.920 3.466 3.123 3.661 . 0 0 "[ . 1 . 2]" 1
1553 1 98 TYR HB3 1 100 VAL MG2 . . 4.110 3.701 3.586 3.860 . 0 0 "[ . 1 . 2]" 1
1554 1 98 TYR HB3 1 116 ALA MB . . 4.460 4.268 4.014 4.460 . 0 0 "[ . 1 . 2]" 1
1555 1 98 TYR QD 1 118 ILE H . . 4.230 3.988 3.646 4.190 . 0 0 "[ . 1 . 2]" 1
1556 1 98 TYR QD 1 118 ILE HB . . 4.570 3.660 3.466 3.946 . 0 0 "[ . 1 . 2]" 1
1557 1 98 TYR QD 1 118 ILE MD . . 4.680 3.495 3.245 3.702 . 0 0 "[ . 1 . 2]" 1
1558 1 98 TYR QD 1 118 ILE HG12 . . 4.670 2.353 2.116 2.629 . 0 0 "[ . 1 . 2]" 1
1559 1 98 TYR QD 1 118 ILE HG13 . . 4.710 2.469 2.204 2.801 . 0 0 "[ . 1 . 2]" 1
1560 1 98 TYR QD 1 118 ILE MG . . 4.620 4.331 4.110 4.523 . 0 0 "[ . 1 . 2]" 1
1561 1 98 TYR QE 1 118 ILE H . . 4.840 4.434 4.091 4.812 . 0 0 "[ . 1 . 2]" 1
1562 1 98 TYR QE 1 118 ILE HB . . 4.070 2.730 2.509 3.199 . 0 0 "[ . 1 . 2]" 1
1563 1 98 TYR QE 1 118 ILE MD . . 4.780 3.814 3.669 4.040 . 0 0 "[ . 1 . 2]" 1
1564 1 98 TYR QE 1 118 ILE MG . . 4.210 3.190 2.862 3.501 . 0 0 "[ . 1 . 2]" 1
1565 1 99 PHE H 1 99 PHE HB2 . . 3.500 2.384 2.288 2.445 . 0 0 "[ . 1 . 2]" 1
1566 1 99 PHE H 1 99 PHE HB3 . . 3.820 3.618 3.562 3.653 . 0 0 "[ . 1 . 2]" 1
1567 1 99 PHE H 1 99 PHE QD . . 3.780 2.294 1.965 2.869 . 0 0 "[ . 1 . 2]" 1
1568 1 99 PHE H 1 99 PHE QE . . 4.920 4.566 4.233 4.811 . 0 0 "[ . 1 . 2]" 1
1569 1 99 PHE H 1 100 VAL H . . 4.640 4.304 4.173 4.453 . 0 0 "[ . 1 . 2]" 1
1570 1 99 PHE HA 1 99 PHE QD . . 4.430 3.058 2.652 3.157 . 0 0 "[ . 1 . 2]" 1
1571 1 99 PHE HA 1 100 VAL H . . 2.910 2.152 2.140 2.180 . 0 0 "[ . 1 . 2]" 1
1572 1 99 PHE HA 1 100 VAL HA . . 4.860 4.415 4.391 4.445 . 0 0 "[ . 1 . 2]" 1
1573 1 99 PHE HA 1 100 VAL HB . . 4.870 4.684 4.595 4.727 . 0 0 "[ . 1 . 2]" 1
1574 1 99 PHE HA 1 100 VAL MG2 . . 4.370 3.699 3.597 3.809 . 0 0 "[ . 1 . 2]" 1
1575 1 99 PHE HA 1 113 PRO HB2 . . 4.810 3.042 2.810 3.144 . 0 0 "[ . 1 . 2]" 1
1576 1 99 PHE HA 1 114 PHE H . . 4.150 3.631 3.466 3.959 . 0 0 "[ . 1 . 2]" 1
1577 1 99 PHE HA 1 115 LYS H . . 5.090 4.258 3.985 4.607 . 0 0 "[ . 1 . 2]" 1
1578 1 99 PHE HA 1 115 LYS HA . . 3.980 2.700 2.477 2.996 . 0 0 "[ . 1 . 2]" 1
1579 1 99 PHE HA 1 116 ALA H . . 3.900 3.669 3.472 3.828 . 0 0 "[ . 1 . 2]" 1
1580 1 99 PHE HB2 1 100 VAL H . . 4.520 4.446 4.372 4.478 . 0 0 "[ . 1 . 2]" 1
1581 1 99 PHE HB2 1 101 ASN HD21 . . 4.620 4.386 4.228 4.561 . 0 0 "[ . 1 . 2]" 1
1582 1 99 PHE HB2 1 101 ASN HD22 . . 4.350 3.486 3.256 3.644 . 0 0 "[ . 1 . 2]" 1
1583 1 99 PHE HB2 1 113 PRO HB2 . . 4.490 3.789 3.683 4.003 . 0 0 "[ . 1 . 2]" 1
1584 1 99 PHE HB2 1 113 PRO HB3 . . 4.650 4.262 4.035 4.476 . 0 0 "[ . 1 . 2]" 1
1585 1 99 PHE HB3 1 100 VAL H . . 4.080 3.675 3.480 3.829 . 0 0 "[ . 1 . 2]" 1
1586 1 99 PHE HB3 1 101 ASN HD21 . . 4.850 4.326 3.860 4.570 . 0 0 "[ . 1 . 2]" 1
1587 1 99 PHE HB3 1 101 ASN HD22 . . 4.400 3.544 3.115 3.797 . 0 0 "[ . 1 . 2]" 1
1588 1 99 PHE HB3 1 113 PRO HB2 . . 4.200 2.061 1.998 2.280 . 0 0 "[ . 1 . 2]" 1
1589 1 99 PHE HB3 1 113 PRO HB3 . . 4.160 2.755 2.530 2.888 . 0 0 "[ . 1 . 2]" 1
1590 1 99 PHE QD 1 100 VAL H . . 4.940 4.568 4.072 4.773 . 0 0 "[ . 1 . 2]" 1
1591 1 99 PHE QD 1 113 PRO HB2 . . 3.950 2.541 2.189 2.860 . 0 0 "[ . 1 . 2]" 1
1592 1 99 PHE QD 1 113 PRO HB3 . . 4.470 3.750 3.324 4.087 . 0 0 "[ . 1 . 2]" 1
1593 1 99 PHE QD 1 113 PRO HG2 . . 4.380 2.113 1.996 2.489 . 0 0 "[ . 1 . 2]" 1
1594 1 99 PHE QD 1 113 PRO HG3 . . 4.930 2.812 2.302 3.471 . 0 0 "[ . 1 . 2]" 1
1595 1 99 PHE QD 1 115 LYS HA . . 4.680 3.657 3.198 3.961 . 0 0 "[ . 1 . 2]" 1
1596 1 99 PHE QD 1 115 LYS HB2 . . 4.130 3.692 3.219 4.139 0.009 19 0 "[ . 1 . 2]" 1
1597 1 99 PHE QD 1 115 LYS QG . . 4.670 3.826 3.399 4.168 . 0 0 "[ . 1 . 2]" 1
1598 1 99 PHE QD 1 116 ALA H . . 5.120 4.748 4.357 5.092 . 0 0 "[ . 1 . 2]" 1
1599 1 99 PHE QE 1 113 PRO HB2 . . 5.340 4.758 4.396 5.102 . 0 0 "[ . 1 . 2]" 1
1600 1 99 PHE QE 1 113 PRO HG2 . . 5.010 3.681 3.137 4.115 . 0 0 "[ . 1 . 2]" 1
1601 1 99 PHE QE 1 115 LYS HB3 . . 5.500 4.427 3.839 5.050 . 0 0 "[ . 1 . 2]" 1
1602 1 99 PHE QE 1 115 LYS QD . . 4.890 3.850 2.676 4.733 . 0 0 "[ . 1 . 2]" 1
1603 1 99 PHE QE 1 115 LYS QG . . 4.260 2.929 2.233 3.299 . 0 0 "[ . 1 . 2]" 1
1604 1 99 PHE HZ 1 115 LYS HB2 . . 4.370 3.622 3.015 4.306 . 0 0 "[ . 1 . 2]" 1
1605 1 99 PHE HZ 1 115 LYS QD . . 4.740 3.624 2.015 4.707 . 0 0 "[ . 1 . 2]" 1
1606 1 99 PHE HZ 1 115 LYS QE . . 4.410 3.404 2.107 4.409 . 0 0 "[ . 1 . 2]" 1
1607 1 99 PHE HZ 1 115 LYS QG . . 4.350 2.975 2.421 3.691 . 0 0 "[ . 1 . 2]" 1
1608 1 100 VAL H 1 100 VAL HB . . 3.560 2.552 2.497 2.592 . 0 0 "[ . 1 . 2]" 1
1609 1 100 VAL H 1 100 VAL MG1 . . 4.450 3.788 3.777 3.810 . 0 0 "[ . 1 . 2]" 1
1610 1 100 VAL H 1 100 VAL MG2 . . 3.260 2.286 2.085 2.580 . 0 0 "[ . 1 . 2]" 1
1611 1 100 VAL H 1 101 ASN H . . 4.750 4.294 4.196 4.351 . 0 0 "[ . 1 . 2]" 1
1612 1 100 VAL H 1 113 PRO HA . . 4.560 4.284 4.006 4.435 . 0 0 "[ . 1 . 2]" 1
1613 1 100 VAL H 1 113 PRO HB2 . . 4.690 3.278 3.078 3.524 . 0 0 "[ . 1 . 2]" 1
1614 1 100 VAL H 1 113 PRO HB3 . . 5.190 4.183 3.956 4.354 . 0 0 "[ . 1 . 2]" 1
1615 1 100 VAL H 1 114 PHE H . . 3.840 2.429 2.146 2.621 . 0 0 "[ . 1 . 2]" 1
1616 1 100 VAL H 1 114 PHE HB2 . . 4.170 3.483 3.359 3.608 . 0 0 "[ . 1 . 2]" 1
1617 1 100 VAL H 1 114 PHE HB3 . . 4.850 4.601 4.497 4.704 . 0 0 "[ . 1 . 2]" 1
1618 1 100 VAL H 1 114 PHE QD . . 4.860 4.706 4.527 4.845 . 0 0 "[ . 1 . 2]" 1
1619 1 100 VAL H 1 115 LYS HA . . 4.300 4.075 3.855 4.294 . 0 0 "[ . 1 . 2]" 1
1620 1 100 VAL H 1 116 ALA H . . 4.750 4.559 4.339 4.706 . 0 0 "[ . 1 . 2]" 1
1621 1 100 VAL H 1 116 ALA MB . . 4.850 4.438 4.192 4.733 . 0 0 "[ . 1 . 2]" 1
1622 1 100 VAL HA 1 100 VAL MG1 . . 3.370 2.327 2.229 2.449 . 0 0 "[ . 1 . 2]" 1
1623 1 100 VAL HA 1 100 VAL MG2 . . 3.630 2.433 2.332 2.486 . 0 0 "[ . 1 . 2]" 1
1624 1 100 VAL HA 1 101 ASN H . . 2.920 2.168 2.155 2.185 . 0 0 "[ . 1 . 2]" 1
1625 1 100 VAL HA 1 101 ASN HD21 . . 4.600 3.464 3.324 3.603 . 0 0 "[ . 1 . 2]" 1
1626 1 100 VAL HA 1 101 ASN HD22 . . 4.770 4.736 4.634 4.772 0.002 19 0 "[ . 1 . 2]" 1
1627 1 100 VAL HB 1 102 ILE MD . . 4.520 3.405 3.190 3.711 . 0 0 "[ . 1 . 2]" 1
1628 1 100 VAL HB 1 102 ILE HG13 . . 3.610 3.579 3.460 3.615 0.005 12 0 "[ . 1 . 2]" 1
1629 1 100 VAL HB 1 114 PHE H . . 4.000 2.803 2.629 2.905 . 0 0 "[ . 1 . 2]" 1
1630 1 100 VAL HB 1 114 PHE HB2 . . 3.780 2.497 2.346 2.525 . 0 0 "[ . 1 . 2]" 1
1631 1 100 VAL HB 1 114 PHE HB3 . . 4.160 4.147 3.978 4.166 0.006 4 0 "[ . 1 . 2]" 1
1632 1 100 VAL HB 1 114 PHE QD . . 3.950 3.470 3.333 3.579 . 0 0 "[ . 1 . 2]" 1
1633 1 100 VAL MG1 1 101 ASN H . . 3.270 3.070 2.855 3.181 . 0 0 "[ . 1 . 2]" 1
1634 1 100 VAL MG1 1 102 ILE MD . . 3.090 2.607 2.371 2.828 . 0 0 "[ . 1 . 2]" 1
1635 1 100 VAL MG1 1 102 ILE HG12 . . 3.470 2.593 2.275 2.799 . 0 0 "[ . 1 . 2]" 1
1636 1 100 VAL MG1 1 102 ILE HG13 . . 3.160 2.291 2.072 2.514 . 0 0 "[ . 1 . 2]" 1
1637 1 100 VAL MG1 1 114 PHE H . . 4.530 4.110 3.993 4.201 . 0 0 "[ . 1 . 2]" 1
1638 1 100 VAL MG1 1 114 PHE QD . . 4.040 3.985 3.826 4.043 0.003 5 0 "[ . 1 . 2]" 1
1639 1 100 VAL MG2 1 101 ASN H . . 4.240 4.228 4.195 4.246 0.006 17 0 "[ . 1 . 2]" 1
1640 1 100 VAL MG2 1 114 PHE H . . 4.810 3.853 3.754 3.953 . 0 0 "[ . 1 . 2]" 1
1641 1 100 VAL MG2 1 114 PHE HB3 . . 4.520 4.217 3.945 4.410 . 0 0 "[ . 1 . 2]" 1
1642 1 100 VAL MG2 1 114 PHE QD . . 4.720 4.669 4.573 4.724 0.004 12 0 "[ . 1 . 2]" 1
1643 1 100 VAL MG2 1 116 ALA H . . 4.810 4.510 4.335 4.689 . 0 0 "[ . 1 . 2]" 1
1644 1 101 ASN H 1 101 ASN HB2 . . 3.540 2.423 2.392 2.444 . 0 0 "[ . 1 . 2]" 1
1645 1 101 ASN H 1 101 ASN HB3 . . 3.680 3.605 3.601 3.609 . 0 0 "[ . 1 . 2]" 1
1646 1 101 ASN H 1 101 ASN HD21 . . 3.880 1.913 1.825 2.026 . 0 0 "[ . 1 . 2]" 1
1647 1 101 ASN H 1 101 ASN HD22 . . 4.000 3.446 3.398 3.532 . 0 0 "[ . 1 . 2]" 1
1648 1 101 ASN H 1 102 ILE H . . 4.670 4.338 4.250 4.396 . 0 0 "[ . 1 . 2]" 1
1649 1 101 ASN H 1 102 ILE HG13 . . 5.390 4.582 4.457 4.720 . 0 0 "[ . 1 . 2]" 1
1650 1 101 ASN H 1 113 PRO HA . . 4.740 4.618 4.522 4.726 . 0 0 "[ . 1 . 2]" 1
1651 1 101 ASN HA 1 101 ASN HD22 . . 5.150 4.183 4.086 4.264 . 0 0 "[ . 1 . 2]" 1
1652 1 101 ASN HA 1 102 ILE H . . 3.120 2.158 2.144 2.186 . 0 0 "[ . 1 . 2]" 1
1653 1 101 ASN HA 1 108 HIS HE1 . . 4.690 3.783 3.619 3.879 . 0 0 "[ . 1 . 2]" 1
1654 1 101 ASN HA 1 112 SER HA . . 4.950 4.800 4.717 4.932 . 0 0 "[ . 1 . 2]" 1
1655 1 101 ASN HA 1 113 PRO HA . . 4.170 2.687 2.611 2.805 . 0 0 "[ . 1 . 2]" 1
1656 1 101 ASN HA 1 113 PRO HB2 . . 5.050 4.111 4.003 4.329 . 0 0 "[ . 1 . 2]" 1
1657 1 101 ASN HA 1 113 PRO HB3 . . 4.680 2.624 2.501 2.856 . 0 0 "[ . 1 . 2]" 1
1658 1 101 ASN HA 1 114 PHE H . . 4.410 4.372 4.309 4.419 0.009 12 0 "[ . 1 . 2]" 1
1659 1 101 ASN HB2 1 101 ASN HD21 . . 3.530 2.365 2.306 2.427 . 0 0 "[ . 1 . 2]" 1
1660 1 101 ASN HB2 1 101 ASN HD22 . . 3.650 3.533 3.509 3.558 . 0 0 "[ . 1 . 2]" 1
1661 1 101 ASN HB2 1 102 ILE H . . 4.680 4.423 4.389 4.471 . 0 0 "[ . 1 . 2]" 1
1662 1 101 ASN HB2 1 103 LEU MD2 . . 3.970 3.887 3.731 3.972 0.002 11 0 "[ . 1 . 2]" 1
1663 1 101 ASN HB2 1 108 HIS HE1 . . 5.300 4.694 4.469 4.903 . 0 0 "[ . 1 . 2]" 1
1664 1 101 ASN HB3 1 102 ILE H . . 4.220 3.711 3.603 3.849 . 0 0 "[ . 1 . 2]" 1
1665 1 101 ASN HB3 1 103 LEU MD1 . . 4.800 4.791 4.680 4.809 0.009 12 0 "[ . 1 . 2]" 1
1666 1 101 ASN HB3 1 103 LEU MD2 . . 3.360 2.844 2.671 3.019 . 0 0 "[ . 1 . 2]" 1
1667 1 101 ASN HB3 1 108 HIS HE1 . . 4.190 3.061 2.833 3.305 . 0 0 "[ . 1 . 2]" 1
1668 1 101 ASN HD22 1 113 PRO HB2 . . 4.630 4.571 4.379 4.633 0.003 5 0 "[ . 1 . 2]" 1
1669 1 101 ASN HD22 1 113 PRO HB3 . . 4.650 3.557 3.354 3.650 . 0 0 "[ . 1 . 2]" 1
1670 1 102 ILE H 1 102 ILE HB . . 4.040 2.617 2.527 2.696 . 0 0 "[ . 1 . 2]" 1
1671 1 102 ILE H 1 102 ILE MD . . 4.670 3.821 3.623 3.999 . 0 0 "[ . 1 . 2]" 1
1672 1 102 ILE H 1 102 ILE HG12 . . 4.140 3.798 3.417 3.944 . 0 0 "[ . 1 . 2]" 1
1673 1 102 ILE H 1 102 ILE MG . . 4.160 3.837 3.798 3.866 . 0 0 "[ . 1 . 2]" 1
1674 1 102 ILE H 1 103 LEU H . . 4.710 4.243 4.184 4.302 . 0 0 "[ . 1 . 2]" 1
1675 1 102 ILE H 1 103 LEU MD2 . . 4.830 4.763 4.649 4.827 . 0 0 "[ . 1 . 2]" 1
1676 1 102 ILE H 1 103 LEU HG . . 4.910 4.558 4.490 4.656 . 0 0 "[ . 1 . 2]" 1
1677 1 102 ILE H 1 108 HIS HE1 . . 5.240 4.716 4.500 4.898 . 0 0 "[ . 1 . 2]" 1
1678 1 102 ILE H 1 109 ILE MD . . 5.290 4.325 4.137 4.418 . 0 0 "[ . 1 . 2]" 1
1679 1 102 ILE H 1 109 ILE QG . . 4.820 3.714 3.594 3.777 . 0 0 "[ . 1 . 2]" 1
1680 1 102 ILE H 1 112 SER HA . . 4.730 4.254 4.205 4.334 . 0 0 "[ . 1 . 2]" 1
1681 1 102 ILE H 1 112 SER HB2 . . 4.200 2.068 1.926 2.529 . 0 0 "[ . 1 . 2]" 1
1682 1 102 ILE H 1 112 SER HB3 . . 4.290 2.964 2.768 3.093 . 0 0 "[ . 1 . 2]" 1
1683 1 102 ILE H 1 112 SER HG . . 3.530 2.452 2.284 2.745 . 0 0 "[ . 1 . 2]" 1
1684 1 102 ILE H 1 113 PRO HA . . 4.330 3.115 3.037 3.282 . 0 0 "[ . 1 . 2]" 1
1685 1 102 ILE H 1 114 PHE H . . 5.030 4.859 4.576 5.013 . 0 0 "[ . 1 . 2]" 1
1686 1 102 ILE HA 1 102 ILE MD . . 4.630 3.866 3.801 3.923 . 0 0 "[ . 1 . 2]" 1
1687 1 102 ILE HA 1 102 ILE HG13 . . 4.040 3.016 2.906 3.224 . 0 0 "[ . 1 . 2]" 1
1688 1 102 ILE HA 1 102 ILE MG . . 3.720 2.343 2.162 2.454 . 0 0 "[ . 1 . 2]" 1
1689 1 102 ILE HA 1 103 LEU H . . 2.920 2.149 2.146 2.157 . 0 0 "[ . 1 . 2]" 1
1690 1 102 ILE HA 1 103 LEU HG . . 4.270 3.459 3.431 3.498 . 0 0 "[ . 1 . 2]" 1
1691 1 102 ILE HB 1 102 ILE MD . . 3.480 2.302 2.189 2.496 . 0 0 "[ . 1 . 2]" 1
1692 1 102 ILE HB 1 109 ILE H . . 4.460 3.959 3.834 4.042 . 0 0 "[ . 1 . 2]" 1
1693 1 102 ILE HB 1 109 ILE MD . . 3.430 2.234 2.043 2.333 . 0 0 "[ . 1 . 2]" 1
1694 1 102 ILE HB 1 109 ILE HG12 . . 4.280 2.018 1.994 2.072 . 0 0 "[ . 1 . 2]" 1
1695 1 102 ILE HB 1 109 ILE QG . . 3.720 1.998 1.978 2.050 . 0 0 "[ . 1 . 2]" 1
1696 1 102 ILE HB 1 109 ILE HG13 . . 4.280 3.237 3.035 3.392 . 0 0 "[ . 1 . 2]" 1
1697 1 102 ILE HB 1 112 SER HB2 . . 4.930 2.752 2.378 3.124 . 0 0 "[ . 1 . 2]" 1
1698 1 102 ILE HB 1 112 SER HB3 . . 4.680 2.332 2.129 2.747 . 0 0 "[ . 1 . 2]" 1
1699 1 102 ILE HB 1 114 PHE QE . . 4.600 3.384 3.211 3.593 . 0 0 "[ . 1 . 2]" 1
1700 1 102 ILE MD 1 102 ILE MG . . 2.750 2.145 1.903 2.369 . 0 0 "[ . 1 . 2]" 1
1701 1 102 ILE MD 1 109 ILE MD . . 2.740 1.960 1.912 2.179 . 0 0 "[ . 1 . 2]" 1
1702 1 102 ILE MD 1 109 ILE QG . . 4.210 3.343 3.267 3.494 . 0 0 "[ . 1 . 2]" 1
1703 1 102 ILE MD 1 114 PHE QD . . 3.730 2.574 2.088 2.779 . 0 0 "[ . 1 . 2]" 1
1704 1 102 ILE MD 1 114 PHE QE . . 3.520 2.558 2.324 2.864 . 0 0 "[ . 1 . 2]" 1
1705 1 102 ILE HG12 1 102 ILE MG . . 3.360 2.298 2.130 2.471 . 0 0 "[ . 1 . 2]" 1
1706 1 102 ILE HG12 1 103 LEU H . . 4.810 4.652 4.503 4.786 . 0 0 "[ . 1 . 2]" 1
1707 1 102 ILE HG12 1 112 SER HB2 . . 5.000 4.507 4.095 4.678 . 0 0 "[ . 1 . 2]" 1
1708 1 102 ILE HG12 1 114 PHE QD . . 4.820 4.762 4.554 4.831 0.011 16 0 "[ . 1 . 2]" 1
1709 1 102 ILE MG 1 103 LEU H . . 3.190 2.915 2.777 3.087 . 0 0 "[ . 1 . 2]" 1
1710 1 103 LEU H 1 103 LEU HB2 . . 3.760 3.638 3.622 3.649 . 0 0 "[ . 1 . 2]" 1
1711 1 103 LEU H 1 103 LEU MD1 . . 4.340 2.706 2.586 2.804 . 0 0 "[ . 1 . 2]" 1
1712 1 103 LEU H 1 103 LEU MD2 . . 3.850 3.731 3.698 3.764 . 0 0 "[ . 1 . 2]" 1
1713 1 103 LEU H 1 103 LEU HG . . 4.420 2.040 2.006 2.077 . 0 0 "[ . 1 . 2]" 1
1714 1 103 LEU H 1 104 PHE H . . 4.320 4.301 4.280 4.339 0.019 12 0 "[ . 1 . 2]" 1
1715 1 103 LEU H 1 104 PHE HA . . 5.500 4.747 4.729 4.773 . 0 0 "[ . 1 . 2]" 1
1716 1 103 LEU HA 1 103 LEU MD1 . . 3.960 3.791 3.775 3.806 . 0 0 "[ . 1 . 2]" 1
1717 1 103 LEU HA 1 103 LEU MD2 . . 4.260 3.906 3.869 3.946 . 0 0 "[ . 1 . 2]" 1
1718 1 103 LEU HA 1 103 LEU HG . . 4.030 3.512 3.502 3.520 . 0 0 "[ . 1 . 2]" 1
1719 1 103 LEU HA 1 104 PHE H . . 3.060 2.159 2.151 2.171 . 0 0 "[ . 1 . 2]" 1
1720 1 103 LEU HA 1 107 VAL H . . 3.980 3.862 3.796 3.915 . 0 0 "[ . 1 . 2]" 1
1721 1 103 LEU HA 1 108 HIS HA . . 4.530 2.307 2.184 2.371 . 0 0 "[ . 1 . 2]" 1
1722 1 103 LEU HA 1 109 ILE H . . 4.110 2.565 2.487 2.696 . 0 0 "[ . 1 . 2]" 1
1723 1 103 LEU HA 1 109 ILE MG . . 4.430 2.686 2.566 2.863 . 0 0 "[ . 1 . 2]" 1
1724 1 103 LEU HB2 1 103 LEU MD1 . . 3.520 2.153 2.086 2.207 . 0 0 "[ . 1 . 2]" 1
1725 1 103 LEU HB2 1 103 LEU MD2 . . 3.330 2.651 2.575 2.710 . 0 0 "[ . 1 . 2]" 1
1726 1 103 LEU HB2 1 104 PHE H . . 4.120 3.302 3.235 3.361 . 0 0 "[ . 1 . 2]" 1
1727 1 103 LEU HB2 1 106 GLU H . . 4.030 3.275 3.181 3.345 . 0 0 "[ . 1 . 2]" 1
1728 1 103 LEU HB2 1 106 GLU HA . . 4.040 3.142 3.072 3.200 . 0 0 "[ . 1 . 2]" 1
1729 1 103 LEU HB2 1 107 VAL H . . 3.940 2.573 2.518 2.643 . 0 0 "[ . 1 . 2]" 1
1730 1 103 LEU HB3 1 103 LEU MD1 . . 3.220 3.128 3.120 3.137 . 0 0 "[ . 1 . 2]" 1
1731 1 103 LEU HB3 1 103 LEU MD2 . . 3.310 2.041 1.965 2.158 . 0 0 "[ . 1 . 2]" 1
1732 1 103 LEU HB3 1 104 PHE H . . 3.950 3.868 3.810 3.908 . 0 0 "[ . 1 . 2]" 1
1733 1 103 LEU HB3 1 106 GLU H . . 5.140 5.018 4.923 5.088 . 0 0 "[ . 1 . 2]" 1
1734 1 103 LEU HB3 1 106 GLU HA . . 4.530 4.484 4.401 4.535 0.005 13 0 "[ . 1 . 2]" 1
1735 1 103 LEU HB3 1 107 VAL H . . 3.850 3.844 3.803 3.888 0.038 9 0 "[ . 1 . 2]" 1
1736 1 103 LEU MD1 1 104 PHE H . . 4.660 4.326 4.286 4.371 . 0 0 "[ . 1 . 2]" 1
1737 1 103 LEU MD1 1 106 GLU H . . 4.090 2.938 2.856 3.026 . 0 0 "[ . 1 . 2]" 1
1738 1 103 LEU MD1 1 106 GLU HA . . 3.340 2.862 2.644 3.006 . 0 0 "[ . 1 . 2]" 1
1739 1 103 LEU MD1 1 107 VAL H . . 3.990 3.759 3.688 3.859 . 0 0 "[ . 1 . 2]" 1
1740 1 103 LEU MD1 1 108 HIS HA . . 5.010 4.927 4.857 4.994 . 0 0 "[ . 1 . 2]" 1
1741 1 103 LEU MD1 1 108 HIS HD2 . . 5.020 4.888 4.676 5.015 . 0 0 "[ . 1 . 2]" 1
1742 1 103 LEU MD2 1 104 PHE H . . 5.270 5.208 5.161 5.240 . 0 0 "[ . 1 . 2]" 1
1743 1 103 LEU MD2 1 106 GLU H . . 4.750 4.703 4.637 4.752 0.002 1 0 "[ . 1 . 2]" 1
1744 1 103 LEU MD2 1 106 GLU HA . . 3.840 3.680 3.552 3.805 . 0 0 "[ . 1 . 2]" 1
1745 1 103 LEU MD2 1 107 VAL H . . 4.700 4.552 4.464 4.649 . 0 0 "[ . 1 . 2]" 1
1746 1 103 LEU MD2 1 108 HIS HA . . 4.050 3.710 3.573 3.842 . 0 0 "[ . 1 . 2]" 1
1747 1 103 LEU MD2 1 108 HIS HE1 . . 4.130 3.472 3.300 3.643 . 0 0 "[ . 1 . 2]" 1
1748 1 103 LEU HG 1 108 HIS HA . . 4.540 4.470 4.385 4.537 . 0 0 "[ . 1 . 2]" 1
1749 1 104 PHE H 1 104 PHE HB2 . . 3.940 2.615 2.515 2.755 . 0 0 "[ . 1 . 2]" 1
1750 1 104 PHE H 1 104 PHE HB3 . . 3.940 2.768 2.653 2.859 . 0 0 "[ . 1 . 2]" 1
1751 1 104 PHE H 1 104 PHE QD . . 4.590 4.221 4.160 4.281 . 0 0 "[ . 1 . 2]" 1
1752 1 104 PHE H 1 105 GLU H . . 4.530 4.300 4.244 4.350 . 0 0 "[ . 1 . 2]" 1
1753 1 104 PHE H 1 106 GLU H . . 4.690 4.531 4.410 4.608 . 0 0 "[ . 1 . 2]" 1
1754 1 104 PHE H 1 107 VAL H . . 3.300 2.962 2.880 3.007 . 0 0 "[ . 1 . 2]" 1
1755 1 104 PHE H 1 107 VAL HB . . 4.300 3.110 3.037 3.195 . 0 0 "[ . 1 . 2]" 1
1756 1 104 PHE H 1 108 HIS HA . . 4.020 3.877 3.724 3.941 . 0 0 "[ . 1 . 2]" 1
1757 1 104 PHE H 1 109 ILE H . . 4.550 3.790 3.665 4.005 . 0 0 "[ . 1 . 2]" 1
1758 1 104 PHE H 1 109 ILE MG . . 3.750 2.770 2.611 2.888 . 0 0 "[ . 1 . 2]" 1
1759 1 104 PHE HA 1 104 PHE QD . . 4.010 2.178 2.016 2.518 . 0 0 "[ . 1 . 2]" 1
1760 1 104 PHE HA 1 105 GLU H . . 2.990 2.146 2.142 2.154 . 0 0 "[ . 1 . 2]" 1
1761 1 104 PHE HA 1 105 GLU HA . . 4.410 4.367 4.365 4.372 . 0 0 "[ . 1 . 2]" 1
1762 1 104 PHE HA 1 106 GLU H . . 4.370 4.018 3.938 4.122 . 0 0 "[ . 1 . 2]" 1
1763 1 104 PHE HA 1 107 VAL H . . 4.610 4.140 4.100 4.194 . 0 0 "[ . 1 . 2]" 1
1764 1 104 PHE QB 1 107 VAL H . . 4.480 4.143 4.038 4.219 . 0 0 "[ . 1 . 2]" 1
1765 1 104 PHE HB2 1 107 VAL HB . . 5.500 4.497 4.341 4.719 . 0 0 "[ . 1 . 2]" 1
1766 1 104 PHE HB2 1 109 ILE MG . . 3.700 2.829 2.677 2.965 . 0 0 "[ . 1 . 2]" 1
1767 1 104 PHE HB3 1 107 VAL HB . . 5.500 3.250 3.077 3.407 . 0 0 "[ . 1 . 2]" 1
1768 1 104 PHE HB3 1 109 ILE MG . . 3.700 3.613 3.473 3.706 0.006 12 0 "[ . 1 . 2]" 1
1769 1 104 PHE QD 1 105 GLU H . . 4.290 3.603 3.166 3.779 . 0 0 "[ . 1 . 2]" 1
1770 1 104 PHE QD 1 105 GLU HB2 . . 4.440 3.907 3.206 4.143 . 0 0 "[ . 1 . 2]" 1
1771 1 104 PHE QD 1 109 ILE MG . . 4.510 4.343 4.164 4.477 . 0 0 "[ . 1 . 2]" 1
1772 1 105 GLU H 1 105 GLU HB2 . . 3.890 3.467 3.372 3.566 . 0 0 "[ . 1 . 2]" 1
1773 1 105 GLU H 1 105 GLU HB3 . . 4.170 4.077 4.038 4.094 . 0 0 "[ . 1 . 2]" 1
1774 1 105 GLU H 1 105 GLU HG2 . . 3.720 2.973 2.597 3.376 . 0 0 "[ . 1 . 2]" 1
1775 1 105 GLU H 1 105 GLU HG3 . . 4.300 3.837 3.104 4.273 . 0 0 "[ . 1 . 2]" 1
1776 1 105 GLU H 1 106 GLU H . . 3.580 2.737 2.699 2.806 . 0 0 "[ . 1 . 2]" 1
1777 1 105 GLU H 1 107 VAL H . . 4.510 3.936 3.886 3.996 . 0 0 "[ . 1 . 2]" 1
1778 1 105 GLU HA 1 105 GLU HG2 . . 4.000 2.504 2.219 2.754 . 0 0 "[ . 1 . 2]" 1
1779 1 105 GLU HA 1 105 GLU HG3 . . 4.040 3.544 3.230 3.792 . 0 0 "[ . 1 . 2]" 1
1780 1 105 GLU HA 1 106 GLU H . . 3.190 2.750 2.714 2.786 . 0 0 "[ . 1 . 2]" 1
1781 1 105 GLU HA 1 106 GLU HA . . 4.710 4.714 4.697 4.729 0.019 16 0 "[ . 1 . 2]" 1
1782 1 105 GLU HA 1 107 VAL H . . 4.580 4.481 4.429 4.526 . 0 0 "[ . 1 . 2]" 1
1783 1 105 GLU HB2 1 106 GLU H . . 4.860 4.292 4.264 4.335 . 0 0 "[ . 1 . 2]" 1
1784 1 105 GLU HB2 1 107 VAL MG2 . . 4.620 2.950 2.842 3.125 . 0 0 "[ . 1 . 2]" 1
1785 1 105 GLU HB3 1 106 GLU H . . 4.650 4.406 4.371 4.442 . 0 0 "[ . 1 . 2]" 1
1786 1 105 GLU HB3 1 107 VAL MG2 . . 4.900 3.565 3.363 3.746 . 0 0 "[ . 1 . 2]" 1
1787 1 106 GLU H 1 106 GLU HB2 . . 3.840 3.748 3.700 3.789 . 0 0 "[ . 1 . 2]" 1
1788 1 106 GLU H 1 106 GLU HG2 . . 3.850 3.098 2.914 3.431 . 0 0 "[ . 1 . 2]" 1
1789 1 106 GLU H 1 106 GLU QG . . 3.340 2.813 2.766 2.844 . 0 0 "[ . 1 . 2]" 1
1790 1 106 GLU H 1 106 GLU HG3 . . 3.850 3.270 2.983 3.474 . 0 0 "[ . 1 . 2]" 1
1791 1 106 GLU H 1 107 VAL H . . 3.450 2.510 2.467 2.548 . 0 0 "[ . 1 . 2]" 1
1792 1 106 GLU H 1 107 VAL MG2 . . 4.620 3.884 3.812 4.003 . 0 0 "[ . 1 . 2]" 1
1793 1 106 GLU HA 1 106 GLU HG2 . . 3.690 2.627 2.563 2.719 . 0 0 "[ . 1 . 2]" 1
1794 1 106 GLU HA 1 106 GLU HG3 . . 3.690 3.474 3.250 3.594 . 0 0 "[ . 1 . 2]" 1
1795 1 106 GLU HB2 1 107 VAL MG2 . . 3.230 3.189 3.114 3.234 0.004 11 0 "[ . 1 . 2]" 1
1796 1 106 GLU HB3 1 107 VAL H . . 4.590 4.530 4.507 4.546 . 0 0 "[ . 1 . 2]" 1
1797 1 106 GLU HB3 1 107 VAL MG2 . . 4.320 4.298 4.160 4.328 0.008 2 0 "[ . 1 . 2]" 1
1798 1 107 VAL H 1 107 VAL HB . . 2.950 2.856 2.828 2.901 . 0 0 "[ . 1 . 2]" 1
1799 1 107 VAL H 1 107 VAL MG1 . . 3.990 3.940 3.927 3.956 . 0 0 "[ . 1 . 2]" 1
1800 1 107 VAL H 1 107 VAL MG2 . . 3.010 2.562 2.511 2.654 . 0 0 "[ . 1 . 2]" 1
1801 1 107 VAL H 1 108 HIS H . . 4.270 4.088 4.008 4.146 . 0 0 "[ . 1 . 2]" 1
1802 1 107 VAL HA 1 107 VAL MG1 . . 3.200 2.221 2.144 2.346 . 0 0 "[ . 1 . 2]" 1
1803 1 107 VAL HA 1 107 VAL MG2 . . 2.910 2.556 2.529 2.579 . 0 0 "[ . 1 . 2]" 1
1804 1 107 VAL HA 1 108 HIS H . . 2.770 2.150 2.143 2.165 . 0 0 "[ . 1 . 2]" 1
1805 1 107 VAL HA 1 108 HIS HB2 . . 4.500 4.276 4.271 4.280 . 0 0 "[ . 1 . 2]" 1
1806 1 107 VAL HA 1 108 HIS HD2 . . 4.540 4.319 4.266 4.375 . 0 0 "[ . 1 . 2]" 1
1807 1 107 VAL HB 1 108 HIS H . . 4.450 4.254 4.210 4.317 . 0 0 "[ . 1 . 2]" 1
1808 1 107 VAL MG1 1 108 HIS H . . 3.060 2.898 2.737 3.070 0.010 9 0 "[ . 1 . 2]" 1
1809 1 107 VAL MG1 1 108 HIS HB2 . . 4.390 4.226 4.127 4.346 . 0 0 "[ . 1 . 2]" 1
1810 1 107 VAL MG1 1 108 HIS HB3 . . 5.180 5.063 4.969 5.144 . 0 0 "[ . 1 . 2]" 1
1811 1 107 VAL MG1 1 108 HIS HD2 . . 5.440 5.381 5.285 5.444 0.004 8 0 "[ . 1 . 2]" 1
1812 1 108 HIS H 1 108 HIS HB2 . . 3.160 2.183 2.175 2.200 . 0 0 "[ . 1 . 2]" 1
1813 1 108 HIS H 1 108 HIS HB3 . . 3.630 3.493 3.486 3.504 . 0 0 "[ . 1 . 2]" 1
1814 1 108 HIS H 1 108 HIS HD2 . . 3.320 2.875 2.802 2.915 . 0 0 "[ . 1 . 2]" 1
1815 1 108 HIS H 1 109 ILE H . . 4.710 4.493 4.457 4.549 . 0 0 "[ . 1 . 2]" 1
1816 1 108 HIS HA 1 108 HIS HD2 . . 4.820 3.518 3.466 3.621 . 0 0 "[ . 1 . 2]" 1
1817 1 108 HIS HA 1 109 ILE H . . 3.040 2.142 2.139 2.152 . 0 0 "[ . 1 . 2]" 1
1818 1 108 HIS HA 1 109 ILE HG12 . . 5.390 4.239 4.172 4.292 . 0 0 "[ . 1 . 2]" 1
1819 1 108 HIS HA 1 109 ILE QG . . 4.510 3.987 3.935 4.021 . 0 0 "[ . 1 . 2]" 1
1820 1 108 HIS HA 1 109 ILE HG13 . . 5.390 4.863 4.709 5.156 . 0 0 "[ . 1 . 2]" 1
1821 1 108 HIS HA 1 109 ILE MG . . 3.760 3.634 3.498 3.743 . 0 0 "[ . 1 . 2]" 1
1822 1 108 HIS HA 1 112 SER HG . . 4.970 4.337 4.234 4.465 . 0 0 "[ . 1 . 2]" 1
1823 1 108 HIS HB2 1 108 HIS HD2 . . 3.910 2.948 2.909 2.969 . 0 0 "[ . 1 . 2]" 1
1824 1 108 HIS HB2 1 109 ILE H . . 4.520 4.470 4.402 4.506 . 0 0 "[ . 1 . 2]" 1
1825 1 108 HIS HB2 1 112 SER HG . . 5.500 5.488 5.426 5.516 0.016 19 0 "[ . 1 . 2]" 1
1826 1 108 HIS HB3 1 109 ILE H . . 4.160 3.539 3.386 3.626 . 0 0 "[ . 1 . 2]" 1
1827 1 108 HIS HB3 1 112 SER HG . . 4.810 4.004 3.917 4.062 . 0 0 "[ . 1 . 2]" 1
1828 1 108 HIS HE1 1 112 SER HG . . 4.370 3.593 3.493 3.686 . 0 0 "[ . 1 . 2]" 1
1829 1 108 HIS HE1 1 113 PRO HB3 . . 4.490 4.480 4.399 4.501 0.011 17 0 "[ . 1 . 2]" 1
1830 1 108 HIS HE1 1 113 PRO HD2 . . 5.200 5.104 4.969 5.199 . 0 0 "[ . 1 . 2]" 1
1831 1 108 HIS HE1 1 113 PRO HD3 . . 4.410 3.377 3.248 3.464 . 0 0 "[ . 1 . 2]" 1
1832 1 108 HIS HE1 1 113 PRO HG3 . . 4.970 4.763 4.630 4.853 . 0 0 "[ . 1 . 2]" 1
1833 1 109 ILE H 1 109 ILE MD . . 3.960 3.892 3.838 3.929 . 0 0 "[ . 1 . 2]" 1
1834 1 109 ILE H 1 109 ILE HG12 . . 3.810 2.370 2.294 2.429 . 0 0 "[ . 1 . 2]" 1
1835 1 109 ILE H 1 109 ILE HG13 . . 3.810 2.980 2.793 3.287 . 0 0 "[ . 1 . 2]" 1
1836 1 109 ILE H 1 109 ILE MG . . 3.240 2.113 1.906 2.212 . 0 0 "[ . 1 . 2]" 1
1837 1 109 ILE H 1 112 SER H . . 4.650 4.568 4.436 4.638 . 0 0 "[ . 1 . 2]" 1
1838 1 109 ILE H 1 112 SER HB3 . . 4.030 3.909 3.372 4.040 0.010 16 0 "[ . 1 . 2]" 1
1839 1 109 ILE H 1 112 SER HG . . 4.330 4.285 4.188 4.335 0.005 6 0 "[ . 1 . 2]" 1
1840 1 109 ILE HA 1 109 ILE MG . . 3.480 2.391 2.305 2.466 . 0 0 "[ . 1 . 2]" 1
1841 1 109 ILE HA 1 110 PRO HD3 . . 3.820 2.288 2.284 2.290 . 0 0 "[ . 1 . 2]" 1
1842 1 109 ILE HA 1 110 PRO HG2 . . 5.030 4.486 4.480 4.492 . 0 0 "[ . 1 . 2]" 1
1843 1 109 ILE HA 1 110 PRO QG . . 4.400 3.981 3.977 3.986 . 0 0 "[ . 1 . 2]" 1
1844 1 109 ILE HA 1 110 PRO HG3 . . 5.030 4.452 4.448 4.457 . 0 0 "[ . 1 . 2]" 1
1845 1 109 ILE HB 1 109 ILE MD . . 3.520 2.306 2.261 2.389 . 0 0 "[ . 1 . 2]" 1
1846 1 109 ILE HB 1 110 PRO HD2 . . 3.700 1.978 1.966 1.990 . 0 0 "[ . 1 . 2]" 1
1847 1 109 ILE HB 1 110 PRO HD3 . . 3.930 3.423 3.411 3.438 . 0 0 "[ . 1 . 2]" 1
1848 1 109 ILE HB 1 110 PRO QG . . 4.490 3.649 3.626 3.677 . 0 0 "[ . 1 . 2]" 1
1849 1 109 ILE HB 1 114 PHE QE . . 5.500 5.012 4.805 5.138 . 0 0 "[ . 1 . 2]" 1
1850 1 109 ILE MD 1 109 ILE MG . . 2.800 2.241 1.959 2.383 . 0 0 "[ . 1 . 2]" 1
1851 1 109 ILE MD 1 112 SER H . . 4.380 3.513 3.394 3.650 . 0 0 "[ . 1 . 2]" 1
1852 1 109 ILE MD 1 112 SER HB2 . . 4.210 3.558 3.058 3.751 . 0 0 "[ . 1 . 2]" 1
1853 1 109 ILE MD 1 112 SER HB3 . . 4.150 2.542 2.291 3.140 . 0 0 "[ . 1 . 2]" 1
1854 1 109 ILE MD 1 114 PHE QD . . 4.290 3.724 3.583 3.826 . 0 0 "[ . 1 . 2]" 1
1855 1 109 ILE MD 1 114 PHE QE . . 3.480 1.964 1.940 1.998 . 0 0 "[ . 1 . 2]" 1
1856 1 109 ILE MD 1 114 PHE HZ . . 4.100 3.005 2.727 3.261 . 0 0 "[ . 1 . 2]" 1
1857 1 109 ILE QG 1 110 PRO HD2 . . 4.380 3.782 3.650 3.858 . 0 0 "[ . 1 . 2]" 1
1858 1 109 ILE QG 1 112 SER H . . 3.690 2.407 2.260 2.493 . 0 0 "[ . 1 . 2]" 1
1859 1 109 ILE QG 1 112 SER HB2 . . 4.700 3.393 3.020 3.523 . 0 0 "[ . 1 . 2]" 1
1860 1 109 ILE QG 1 112 SER HB3 . . 4.020 2.077 1.980 2.172 . 0 0 "[ . 1 . 2]" 1
1861 1 109 ILE QG 1 114 PHE QE . . 4.530 3.025 2.835 3.164 . 0 0 "[ . 1 . 2]" 1
1862 1 109 ILE HG12 1 109 ILE MG . . 3.620 2.196 2.107 2.329 . 0 0 "[ . 1 . 2]" 1
1863 1 109 ILE HG12 1 110 PRO HD2 . . 5.060 4.780 4.729 4.812 . 0 0 "[ . 1 . 2]" 1
1864 1 109 ILE HG12 1 112 SER H . . 4.310 3.867 3.443 4.021 . 0 0 "[ . 1 . 2]" 1
1865 1 109 ILE HG12 1 112 SER HB2 . . 5.500 3.748 3.353 3.930 . 0 0 "[ . 1 . 2]" 1
1866 1 109 ILE HG12 1 112 SER HB3 . . 4.600 2.450 2.129 2.667 . 0 0 "[ . 1 . 2]" 1
1867 1 109 ILE HG13 1 109 ILE MG . . 3.620 3.154 3.131 3.192 . 0 0 "[ . 1 . 2]" 1
1868 1 109 ILE HG13 1 110 PRO HD2 . . 5.060 3.964 3.798 4.062 . 0 0 "[ . 1 . 2]" 1
1869 1 109 ILE HG13 1 112 SER H . . 4.310 2.432 2.291 2.522 . 0 0 "[ . 1 . 2]" 1
1870 1 109 ILE HG13 1 112 SER HB2 . . 5.500 3.885 3.431 4.099 . 0 0 "[ . 1 . 2]" 1
1871 1 109 ILE HG13 1 112 SER HB3 . . 4.600 2.259 2.158 2.530 . 0 0 "[ . 1 . 2]" 1
1872 1 109 ILE MG 1 110 PRO HD2 . . 3.980 3.238 3.137 3.310 . 0 0 "[ . 1 . 2]" 1
1873 1 109 ILE MG 1 110 PRO HD3 . . 4.070 3.978 3.898 4.045 . 0 0 "[ . 1 . 2]" 1
1874 1 109 ILE MG 1 112 SER H . . 5.300 5.099 4.933 5.170 . 0 0 "[ . 1 . 2]" 1
1875 1 110 PRO HA 1 111 GLY H . . 2.890 2.377 2.355 2.408 . 0 0 "[ . 1 . 2]" 1
1876 1 110 PRO HA 1 111 GLY HA2 . . 4.730 4.314 4.310 4.316 . 0 0 "[ . 1 . 2]" 1
1877 1 110 PRO HA 1 111 GLY QA . . 4.130 3.925 3.920 3.934 . 0 0 "[ . 1 . 2]" 1
1878 1 110 PRO HA 1 111 GLY HA3 . . 4.730 4.513 4.498 4.543 . 0 0 "[ . 1 . 2]" 1
1879 1 110 PRO HA 1 112 SER H . . 4.360 3.955 3.907 4.025 . 0 0 "[ . 1 . 2]" 1
1880 1 110 PRO QB 1 111 GLY H . . 4.020 3.882 3.865 3.905 . 0 0 "[ . 1 . 2]" 1
1881 1 111 GLY H 1 112 SER H . . 3.420 1.801 1.792 1.831 . 0 0 "[ . 1 . 2]" 1
1882 1 111 GLY QA 1 112 SER HA . . 4.970 4.009 4.005 4.010 . 0 0 "[ . 1 . 2]" 1
1883 1 111 GLY QA 1 114 PHE QE . . 3.960 3.139 2.870 3.308 . 0 0 "[ . 1 . 2]" 1
1884 1 111 GLY QA 1 114 PHE HZ . . 4.000 2.371 1.995 2.714 . 0 0 "[ . 1 . 2]" 1
1885 1 111 GLY HA2 1 114 PHE QE . . 4.530 4.210 3.907 4.429 . 0 0 "[ . 1 . 2]" 1
1886 1 111 GLY HA2 1 114 PHE HZ . . 4.650 3.915 3.518 4.253 . 0 0 "[ . 1 . 2]" 1
1887 1 111 GLY HA3 1 114 PHE QE . . 4.530 3.240 2.953 3.419 . 0 0 "[ . 1 . 2]" 1
1888 1 111 GLY HA3 1 114 PHE HZ . . 4.650 2.391 2.006 2.745 . 0 0 "[ . 1 . 2]" 1
1889 1 112 SER H 1 112 SER HB2 . . 3.710 3.622 3.325 3.708 . 0 0 "[ . 1 . 2]" 1
1890 1 112 SER H 1 112 SER HB3 . . 3.450 2.488 2.283 2.561 . 0 0 "[ . 1 . 2]" 1
1891 1 112 SER H 1 112 SER HG . . 4.000 3.710 3.631 3.821 . 0 0 "[ . 1 . 2]" 1
1892 1 112 SER H 1 113 PRO HA . . 4.810 4.761 4.758 4.764 . 0 0 "[ . 1 . 2]" 1
1893 1 112 SER H 1 114 PHE QD . . 4.720 4.594 4.364 4.707 . 0 0 "[ . 1 . 2]" 1
1894 1 112 SER H 1 114 PHE QE . . 4.250 3.316 3.085 3.540 . 0 0 "[ . 1 . 2]" 1
1895 1 112 SER H 1 114 PHE HZ . . 5.130 4.433 4.092 4.743 . 0 0 "[ . 1 . 2]" 1
1896 1 112 SER HA 1 113 PRO HA . . 3.570 2.403 2.396 2.414 . 0 0 "[ . 1 . 2]" 1
1897 1 112 SER HA 1 113 PRO HB2 . . 5.060 4.407 4.404 4.414 . 0 0 "[ . 1 . 2]" 1
1898 1 112 SER HA 1 113 PRO HB3 . . 4.810 4.505 4.500 4.514 . 0 0 "[ . 1 . 2]" 1
1899 1 112 SER HA 1 114 PHE H . . 3.600 3.388 3.086 3.475 . 0 0 "[ . 1 . 2]" 1
1900 1 112 SER HA 1 114 PHE QD . . 4.270 2.449 2.346 2.573 . 0 0 "[ . 1 . 2]" 1
1901 1 112 SER HA 1 114 PHE QE . . 4.650 2.997 2.794 3.234 . 0 0 "[ . 1 . 2]" 1
1902 1 112 SER HB2 1 113 PRO HA . . 4.380 2.116 1.954 2.728 . 0 0 "[ . 1 . 2]" 1
1903 1 112 SER HB2 1 114 PHE H . . 4.310 3.738 3.639 3.781 . 0 0 "[ . 1 . 2]" 1
1904 1 112 SER HB2 1 114 PHE QD . . 4.150 2.578 2.175 2.738 . 0 0 "[ . 1 . 2]" 1
1905 1 112 SER HB2 1 114 PHE QE . . 4.750 3.115 2.450 3.366 . 0 0 "[ . 1 . 2]" 1
1906 1 112 SER HB3 1 113 PRO HA . . 4.790 3.604 3.569 3.710 . 0 0 "[ . 1 . 2]" 1
1907 1 112 SER HB3 1 114 PHE H . . 5.180 5.171 5.111 5.195 0.015 19 0 "[ . 1 . 2]" 1
1908 1 112 SER HB3 1 114 PHE QD . . 4.770 3.330 3.157 3.775 . 0 0 "[ . 1 . 2]" 1
1909 1 112 SER HB3 1 114 PHE QE . . 4.520 2.464 2.162 3.229 . 0 0 "[ . 1 . 2]" 1
1910 1 112 SER HG 1 113 PRO HA . . 4.390 2.893 2.858 3.006 . 0 0 "[ . 1 . 2]" 1
1911 1 112 SER HG 1 114 PHE H . . 5.290 5.250 5.026 5.300 0.010 14 0 "[ . 1 . 2]" 1
1912 1 113 PRO HA 1 114 PHE H . . 3.180 2.412 2.286 2.451 . 0 0 "[ . 1 . 2]" 1
1913 1 113 PRO HA 1 114 PHE QD . . 4.520 3.112 2.963 3.374 . 0 0 "[ . 1 . 2]" 1
1914 1 113 PRO HB2 1 114 PHE H . . 4.100 2.590 2.489 2.926 . 0 0 "[ . 1 . 2]" 1
1915 1 113 PRO HB2 1 114 PHE HA . . 5.080 4.325 4.252 4.490 . 0 0 "[ . 1 . 2]" 1
1916 1 113 PRO HB3 1 114 PHE H . . 4.090 3.444 3.391 3.623 . 0 0 "[ . 1 . 2]" 1
1917 1 114 PHE H 1 114 PHE HB2 . . 3.710 2.467 2.364 2.544 . 0 0 "[ . 1 . 2]" 1
1918 1 114 PHE H 1 114 PHE HB3 . . 3.830 3.669 3.609 3.718 . 0 0 "[ . 1 . 2]" 1
1919 1 114 PHE H 1 114 PHE QD . . 3.320 2.753 2.481 2.867 . 0 0 "[ . 1 . 2]" 1
1920 1 114 PHE H 1 114 PHE QE . . 5.030 4.973 4.755 5.036 0.006 1 0 "[ . 1 . 2]" 1
1921 1 114 PHE H 1 115 LYS H . . 4.480 4.007 3.900 4.214 . 0 0 "[ . 1 . 2]" 1
1922 1 114 PHE HA 1 114 PHE QD . . 4.250 3.072 3.032 3.105 . 0 0 "[ . 1 . 2]" 1
1923 1 114 PHE HA 1 115 LYS H . . 2.650 2.202 2.160 2.229 . 0 0 "[ . 1 . 2]" 1
1924 1 114 PHE HA 1 115 LYS HB2 . . 4.790 4.618 4.455 4.792 0.002 18 0 "[ . 1 . 2]" 1
1925 1 114 PHE HA 1 115 LYS HB3 . . 4.960 4.646 4.503 4.817 . 0 0 "[ . 1 . 2]" 1
1926 1 114 PHE HB2 1 115 LYS H . . 4.700 4.531 4.497 4.555 . 0 0 "[ . 1 . 2]" 1
1927 1 114 PHE HB3 1 115 LYS H . . 3.970 3.906 3.756 3.978 0.008 19 0 "[ . 1 . 2]" 1
1928 1 114 PHE QD 1 115 LYS H . . 4.690 4.666 4.533 4.693 0.003 17 0 "[ . 1 . 2]" 1
1929 1 115 LYS H 1 115 LYS HB2 . . 3.200 2.446 2.268 2.631 . 0 0 "[ . 1 . 2]" 1
1930 1 115 LYS H 1 115 LYS HB3 . . 3.100 2.606 2.436 2.808 . 0 0 "[ . 1 . 2]" 1
1931 1 115 LYS H 1 115 LYS QD . . 4.860 4.569 4.296 4.728 . 0 0 "[ . 1 . 2]" 1
1932 1 115 LYS H 1 115 LYS QE . . 4.460 4.358 4.132 4.467 0.007 18 0 "[ . 1 . 2]" 1
1933 1 115 LYS H 1 115 LYS QG . . 4.220 3.959 3.872 4.029 . 0 0 "[ . 1 . 2]" 1
1934 1 115 LYS H 1 116 ALA H . . 4.470 4.478 4.417 4.497 0.027 2 0 "[ . 1 . 2]" 1
1935 1 115 LYS HA 1 115 LYS QD . . 4.350 3.938 3.366 4.209 . 0 0 "[ . 1 . 2]" 1
1936 1 115 LYS HA 1 115 LYS QG . . 3.620 2.421 2.257 2.521 . 0 0 "[ . 1 . 2]" 1
1937 1 115 LYS HA 1 116 ALA H . . 2.820 2.141 2.140 2.147 . 0 0 "[ . 1 . 2]" 1
1938 1 115 LYS HB2 1 115 LYS QE . . 4.100 2.662 2.025 3.247 . 0 0 "[ . 1 . 2]" 1
1939 1 115 LYS HB2 1 116 ALA H . . 4.470 4.361 4.258 4.446 . 0 0 "[ . 1 . 2]" 1
1940 1 115 LYS HB3 1 115 LYS QE . . 3.220 2.427 2.008 2.944 . 0 0 "[ . 1 . 2]" 1
1941 1 115 LYS HB3 1 116 ALA H . . 4.550 4.255 4.137 4.371 . 0 0 "[ . 1 . 2]" 1
1942 1 115 LYS QE 1 115 LYS QG . . 3.270 2.324 2.178 2.575 . 0 0 "[ . 1 . 2]" 1
1943 1 115 LYS QG 1 116 ALA H . . 3.490 2.937 2.841 3.148 . 0 0 "[ . 1 . 2]" 1
1944 1 116 ALA H 1 116 ALA MB . . 3.150 2.321 2.256 2.374 . 0 0 "[ . 1 . 2]" 1
1945 1 116 ALA H 1 117 ASP H . . 4.350 4.181 4.081 4.349 . 0 0 "[ . 1 . 2]" 1
1946 1 116 ALA H 1 117 ASP HA . . 5.500 4.846 4.763 4.962 . 0 0 "[ . 1 . 2]" 1
1947 1 116 ALA HA 1 117 ASP H . . 2.780 2.160 2.140 2.174 . 0 0 "[ . 1 . 2]" 1
1948 1 116 ALA HA 1 117 ASP QB . . 4.250 4.176 4.073 4.247 . 0 0 "[ . 1 . 2]" 1
1949 1 116 ALA MB 1 117 ASP H . . 3.460 3.396 3.209 3.463 0.003 15 0 "[ . 1 . 2]" 1
1950 1 116 ALA MB 1 118 ILE H . . 4.610 4.595 4.545 4.616 0.006 4 0 "[ . 1 . 2]" 1
1951 1 116 ALA MB 1 118 ILE MD . . 3.390 2.839 2.688 3.070 . 0 0 "[ . 1 . 2]" 1
1952 1 117 ASP H 1 117 ASP QB . . 3.050 2.215 2.169 2.362 . 0 0 "[ . 1 . 2]" 1
1953 1 117 ASP H 1 118 ILE H . . 4.630 4.403 4.380 4.414 . 0 0 "[ . 1 . 2]" 1
1954 1 117 ASP HA 1 118 ILE H . . 2.830 2.144 2.141 2.150 . 0 0 "[ . 1 . 2]" 1
1955 1 117 ASP HA 1 118 ILE HB . . 4.980 4.607 4.568 4.644 . 0 0 "[ . 1 . 2]" 1
1956 1 117 ASP QB 1 118 ILE H . . 3.900 3.630 3.479 3.884 . 0 0 "[ . 1 . 2]" 1
1957 1 118 ILE H 1 118 ILE HB . . 3.360 2.488 2.453 2.534 . 0 0 "[ . 1 . 2]" 1
1958 1 118 ILE H 1 118 ILE MD . . 3.800 3.682 3.420 3.788 . 0 0 "[ . 1 . 2]" 1
1959 1 118 ILE H 1 118 ILE HG12 . . 3.500 2.561 2.462 2.681 . 0 0 "[ . 1 . 2]" 1
1960 1 118 ILE H 1 118 ILE HG13 . . 3.960 3.857 3.759 3.952 . 0 0 "[ . 1 . 2]" 1
1961 1 118 ILE H 1 118 ILE MG . . 3.890 3.782 3.766 3.804 . 0 0 "[ . 1 . 2]" 1
1962 1 118 ILE H 1 119 GLU H . . 4.770 4.522 4.433 4.570 . 0 0 "[ . 1 . 2]" 1
1963 1 118 ILE HA 1 118 ILE MD . . 3.180 2.059 1.953 2.174 . 0 0 "[ . 1 . 2]" 1
1964 1 118 ILE HA 1 118 ILE MG . . 3.630 2.366 2.318 2.455 . 0 0 "[ . 1 . 2]" 1
1965 1 118 ILE HA 1 119 GLU H . . 2.940 2.197 2.145 2.276 . 0 0 "[ . 1 . 2]" 1
1966 1 118 ILE HB 1 119 GLU H . . 4.820 4.065 3.894 4.255 . 0 0 "[ . 1 . 2]" 1
1967 1 118 ILE MD 1 118 ILE MG . . 2.880 2.004 1.922 2.126 . 0 0 "[ . 1 . 2]" 1
1968 1 118 ILE MD 1 119 GLU H . . 3.510 3.334 3.124 3.487 . 0 0 "[ . 1 . 2]" 1
1969 1 118 ILE HG12 1 119 GLU H . . 5.160 4.944 4.831 5.042 . 0 0 "[ . 1 . 2]" 1
1970 1 118 ILE MG 1 119 GLU H . . 3.530 2.224 1.892 2.466 . 0 0 "[ . 1 . 2]" 1
1971 1 118 ILE MG 1 119 GLU HB2 . . 5.230 4.353 4.205 4.472 . 0 0 "[ . 1 . 2]" 1
1972 1 118 ILE MG 1 119 GLU QG . . 5.050 4.328 3.990 4.627 . 0 0 "[ . 1 . 2]" 1
1973 1 119 GLU H 1 119 GLU HB2 . . 3.500 2.619 2.468 2.788 . 0 0 "[ . 1 . 2]" 1
1974 1 119 GLU H 1 119 GLU HB3 . . 3.850 3.753 3.673 3.827 . 0 0 "[ . 1 . 2]" 1
1975 1 119 GLU H 1 119 GLU QG . . 3.780 2.798 2.554 3.019 . 0 0 "[ . 1 . 2]" 1
1976 1 119 GLU H 1 120 MET H . . 4.590 4.495 4.456 4.539 . 0 0 "[ . 1 . 2]" 1
1977 1 119 GLU HA 1 120 MET H . . 2.990 2.400 2.310 2.446 . 0 0 "[ . 1 . 2]" 1
1978 1 119 GLU HB2 1 120 MET H . . 4.150 3.595 3.453 3.765 . 0 0 "[ . 1 . 2]" 1
1979 1 119 GLU HB3 1 120 MET H . . 2.940 2.450 2.332 2.666 . 0 0 "[ . 1 . 2]" 1
1980 1 119 GLU QG 1 120 MET H . . 5.190 4.031 3.759 4.418 . 0 0 "[ . 1 . 2]" 1
1981 1 120 MET H 1 120 MET HB2 . . 2.860 2.309 2.180 2.409 . 0 0 "[ . 1 . 2]" 1
1982 1 120 MET H 1 120 MET HB3 . . 4.080 3.562 3.481 3.614 . 0 0 "[ . 1 . 2]" 1
1983 1 120 MET H 1 120 MET HG2 . . 3.840 3.528 2.918 3.836 . 0 0 "[ . 1 . 2]" 1
1984 1 120 MET H 1 120 MET QG . . 3.250 2.704 2.497 3.006 . 0 0 "[ . 1 . 2]" 1
1985 1 120 MET H 1 120 MET HG3 . . 3.840 2.935 2.531 3.830 . 0 0 "[ . 1 . 2]" 1
1986 1 120 MET ME 1 120 MET HG2 . . 3.620 2.213 2.000 2.816 . 0 0 "[ . 1 . 2]" 1
1987 1 120 MET ME 1 120 MET QG . . 3.000 2.082 1.972 2.226 . 0 0 "[ . 1 . 2]" 1
1988 1 120 MET ME 1 120 MET HG3 . . 3.620 2.823 2.238 3.289 . 0 0 "[ . 1 . 2]" 1
1989 1 120 MET QG 1 121 PRO QD . . 4.760 3.167 2.691 3.604 . 0 0 "[ . 1 . 2]" 1
1990 1 121 PRO HA 1 122 PHE H . . 2.580 2.309 2.206 2.537 . 0 0 "[ . 1 . 2]" 1
1991 1 121 PRO QB 1 122 PHE H . . 3.350 2.767 2.249 3.047 . 0 0 "[ . 1 . 2]" 1
1992 1 121 PRO HB2 1 122 PHE H . . 3.930 2.880 2.289 3.210 . 0 0 "[ . 1 . 2]" 1
1993 1 121 PRO HB3 1 122 PHE H . . 3.930 3.602 3.298 3.792 . 0 0 "[ . 1 . 2]" 1
1994 1 122 PHE H 1 122 PHE HB2 . . 3.720 2.979 2.261 3.714 . 0 0 "[ . 1 . 2]" 1
1995 1 122 PHE H 1 122 PHE QB . . 2.960 2.478 2.237 2.948 . 0 0 "[ . 1 . 2]" 1
1996 1 122 PHE H 1 122 PHE HB3 . . 3.720 3.084 2.313 3.655 . 0 0 "[ . 1 . 2]" 1
1997 1 122 PHE H 1 122 PHE QD . . 4.630 2.840 1.992 4.469 . 0 0 "[ . 1 . 2]" 1
1998 1 122 PHE HA 1 122 PHE QD . . 3.940 3.033 2.055 3.728 . 0 0 "[ . 1 . 2]" 1
1999 1 122 PHE HA 1 123 ASP H . . 2.770 2.281 2.139 2.535 . 0 0 "[ . 1 . 2]" 1
2000 1 122 PHE QB 1 123 ASP H . . 3.790 2.975 2.139 3.794 0.004 20 0 "[ . 1 . 2]" 1
2001 1 122 PHE HB2 1 123 ASP H . . 4.340 3.645 2.185 4.336 . 0 0 "[ . 1 . 2]" 1
2002 1 122 PHE HB3 1 123 ASP H . . 4.340 3.505 2.155 4.340 . 0 0 "[ . 1 . 2]" 1
2003 1 122 PHE QD 1 123 ASP H . . 4.420 3.495 2.582 4.420 . 0 0 "[ . 1 . 2]" 1
2004 1 123 ASP H 1 123 ASP HB2 . . 3.820 3.016 2.282 3.731 . 0 0 "[ . 1 . 2]" 1
2005 1 123 ASP H 1 123 ASP QB . . 3.330 2.594 2.256 2.928 . 0 0 "[ . 1 . 2]" 1
2006 1 123 ASP H 1 123 ASP HB3 . . 3.820 3.169 2.419 3.733 . 0 0 "[ . 1 . 2]" 1
2007 1 123 ASP HA 1 124 PRO QG . . 5.300 3.890 3.773 3.969 . 0 0 "[ . 1 . 2]" 1
2008 1 128 PRO QB 1 129 SER H . . 4.080 3.373 2.815 3.723 . 0 0 "[ . 1 . 2]" 1
2009 1 128 PRO QD 1 129 SER H . . 3.790 2.743 2.608 2.951 . 0 0 "[ . 1 . 2]" 1
2010 1 128 PRO QG 1 129 SER H . . 4.440 2.675 1.903 3.279 . 0 0 "[ . 1 . 2]" 1
2011 1 129 SER H 1 129 SER HB2 . . 3.880 2.812 2.232 3.878 . 0 0 "[ . 1 . 2]" 1
2012 1 129 SER H 1 129 SER QB . . 3.310 2.472 2.180 3.249 . 0 0 "[ . 1 . 2]" 1
2013 1 129 SER H 1 129 SER HB3 . . 3.880 3.175 2.298 3.883 0.003 16 0 "[ . 1 . 2]" 1
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