NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
438418 |
2k4q   |
15807 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2k4q
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 1613
_Distance_constraint_stats_list.Viol_count 1517
_Distance_constraint_stats_list.Viol_total 1117.039
_Distance_constraint_stats_list.Viol_max 0.748
_Distance_constraint_stats_list.Viol_rms 0.0187
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0017
_Distance_constraint_stats_list.Viol_average_violations_only 0.0368
_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 3 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 PRO 4.733 0.486 20 0 "[ . 1 . 2]"
1 10 THR 4.733 0.486 20 0 "[ . 1 . 2]"
1 11 MET 1.685 0.293 9 0 "[ . 1 . 2]"
1 12 PRO 0.611 0.066 11 0 "[ . 1 . 2]"
1 13 VAL 7.286 0.400 11 0 "[ . 1 . 2]"
1 14 LYS 1.639 0.460 12 0 "[ . 1 . 2]"
1 15 GLY 0.051 0.012 15 0 "[ . 1 . 2]"
1 16 ALA 0.027 0.012 19 0 "[ . 1 . 2]"
1 17 GLY 0.057 0.023 5 0 "[ . 1 . 2]"
1 18 THR 0.360 0.050 5 0 "[ . 1 . 2]"
1 19 THR 0.502 0.044 10 0 "[ . 1 . 2]"
1 20 LEU 1.017 0.087 4 0 "[ . 1 . 2]"
1 21 TRP 3.261 0.120 10 0 "[ . 1 . 2]"
1 22 VAL 1.105 0.245 4 0 "[ . 1 . 2]"
1 23 TYR 0.245 0.143 4 0 "[ . 1 . 2]"
1 26 SER 0.008 0.005 2 0 "[ . 1 . 2]"
1 27 GLY 0.008 0.005 2 0 "[ . 1 . 2]"
1 30 TYR 0.241 0.022 16 0 "[ . 1 . 2]"
1 31 ALA 1.486 0.311 5 0 "[ . 1 . 2]"
1 32 ASN 3.043 0.311 5 0 "[ . 1 . 2]"
1 33 PRO 0.027 0.011 4 0 "[ . 1 . 2]"
1 34 LEU 1.166 0.288 5 0 "[ . 1 . 2]"
1 35 SER 0.347 0.053 10 0 "[ . 1 . 2]"
1 36 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 TRP 0.597 0.086 4 0 "[ . 1 . 2]"
1 40 SER 0.731 0.059 8 0 "[ . 1 . 2]"
1 41 ARG 0.613 0.057 1 0 "[ . 1 . 2]"
1 42 LEU 0.444 0.035 4 0 "[ . 1 . 2]"
1 43 ALA 0.528 0.042 19 0 "[ . 1 . 2]"
1 44 LYS 0.207 0.027 7 0 "[ . 1 . 2]"
1 45 VAL 1.310 0.120 10 0 "[ . 1 . 2]"
1 46 LYS 0.076 0.016 2 0 "[ . 1 . 2]"
1 47 ASP 0.164 0.071 11 0 "[ . 1 . 2]"
1 48 LEU 1.402 0.378 13 0 "[ . 1 . 2]"
1 49 THR 0.734 0.120 10 0 "[ . 1 . 2]"
1 50 PRO 0.065 0.035 10 0 "[ . 1 . 2]"
1 51 GLY 0.053 0.020 2 0 "[ . 1 . 2]"
1 52 GLU 0.854 0.116 8 0 "[ . 1 . 2]"
1 53 LEU 0.068 0.010 4 0 "[ . 1 . 2]"
1 54 THR 0.325 0.084 14 0 "[ . 1 . 2]"
1 55 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLU 0.024 0.019 14 0 "[ . 1 . 2]"
1 57 SER 0.041 0.019 14 0 "[ . 1 . 2]"
1 58 TYR 0.010 0.006 9 0 "[ . 1 . 2]"
1 59 ASP 0.000 0.000 1 0 "[ . 1 . 2]"
1 60 ASP 0.000 0.000 1 0 "[ . 1 . 2]"
1 61 SER 0.014 0.014 10 0 "[ . 1 . 2]"
1 62 TYR 1.391 0.503 14 1 "[ . 1 +. 2]"
1 63 LEU 4.621 0.748 20 3 "[ . 1 -* +]"
1 64 ASP 1.608 0.255 16 0 "[ . 1 . 2]"
1 65 ASP 0.409 0.398 15 0 "[ . 1 . 2]"
1 66 GLU 0.580 0.398 15 0 "[ . 1 . 2]"
1 67 ASP 0.886 0.531 18 1 "[ . 1 . + 2]"
1 68 ALA 1.338 0.531 18 1 "[ . 1 . + 2]"
1 69 ASP 0.798 0.188 18 0 "[ . 1 . 2]"
1 70 TRP 0.703 0.179 19 0 "[ . 1 . 2]"
1 71 THR 0.006 0.003 1 0 "[ . 1 . 2]"
1 72 ALA 0.000 0.000 7 0 "[ . 1 . 2]"
1 73 THR 0.016 0.007 10 0 "[ . 1 . 2]"
1 74 GLY 0.016 0.007 10 0 "[ . 1 . 2]"
1 75 GLN 0.440 0.350 10 0 "[ . 1 . 2]"
1 76 GLY 0.399 0.350 10 0 "[ . 1 . 2]"
1 77 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 LYS 0.611 0.358 17 0 "[ . 1 . 2]"
1 79 SER 0.725 0.358 17 0 "[ . 1 . 2]"
1 80 ALA 0.308 0.090 17 0 "[ . 1 . 2]"
1 81 GLY 0.061 0.008 18 0 "[ . 1 . 2]"
1 82 ASP 0.336 0.057 18 0 "[ . 1 . 2]"
1 83 THR 0.476 0.051 17 0 "[ . 1 . 2]"
1 84 SER 0.600 0.085 13 0 "[ . 1 . 2]"
1 85 PHE 1.631 0.217 13 0 "[ . 1 . 2]"
1 86 THR 0.926 0.178 19 0 "[ . 1 . 2]"
1 87 LEU 3.267 0.178 19 0 "[ . 1 . 2]"
1 88 ALA 0.349 0.041 13 0 "[ . 1 . 2]"
1 89 TRP 0.917 0.063 15 0 "[ . 1 . 2]"
1 90 MET 0.209 0.021 14 0 "[ . 1 . 2]"
1 91 PRO 0.319 0.038 19 0 "[ . 1 . 2]"
1 92 GLY 0.007 0.007 20 0 "[ . 1 . 2]"
1 93 GLU 0.007 0.007 20 0 "[ . 1 . 2]"
1 94 GLN 0.005 0.005 6 0 "[ . 1 . 2]"
1 95 GLY 0.018 0.006 12 0 "[ . 1 . 2]"
1 96 GLN 0.949 0.088 7 0 "[ . 1 . 2]"
1 97 GLN 0.692 0.088 7 0 "[ . 1 . 2]"
1 98 ALA 0.141 0.037 20 0 "[ . 1 . 2]"
1 99 LEU 0.227 0.024 3 0 "[ . 1 . 2]"
1 100 LEU 0.069 0.016 19 0 "[ . 1 . 2]"
1 101 ALA 0.053 0.018 19 0 "[ . 1 . 2]"
1 102 TRP 0.284 0.029 18 0 "[ . 1 . 2]"
1 103 PHE 1.068 0.078 13 0 "[ . 1 . 2]"
1 104 ASN 0.078 0.018 19 0 "[ . 1 . 2]"
1 105 GLU 0.233 0.086 4 0 "[ . 1 . 2]"
1 106 GLY 0.008 0.008 9 0 "[ . 1 . 2]"
1 107 ASP 0.162 0.086 4 0 "[ . 1 . 2]"
1 108 THR 0.060 0.019 4 0 "[ . 1 . 2]"
1 109 ARG 0.272 0.122 18 0 "[ . 1 . 2]"
1 110 ALA 0.085 0.025 19 0 "[ . 1 . 2]"
1 111 TYR 0.778 0.245 4 0 "[ . 1 . 2]"
1 112 LYS 0.346 0.110 19 0 "[ . 1 . 2]"
1 113 ILE 0.915 0.055 20 0 "[ . 1 . 2]"
1 114 ARG 0.842 0.103 19 0 "[ . 1 . 2]"
1 115 PHE 0.185 0.030 20 0 "[ . 1 . 2]"
1 116 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 118 GLY 0.037 0.010 17 0 "[ . 1 . 2]"
1 119 THR 1.005 0.158 20 0 "[ . 1 . 2]"
1 120 VAL 2.797 0.411 16 0 "[ . 1 . 2]"
1 121 ASP 1.860 0.411 16 0 "[ . 1 . 2]"
1 122 VAL 0.316 0.048 19 0 "[ . 1 . 2]"
1 123 PHE 0.949 0.110 19 0 "[ . 1 . 2]"
1 124 ARG 0.655 0.071 11 0 "[ . 1 . 2]"
1 125 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 TRP 1.071 0.388 18 0 "[ . 1 . 2]"
1 127 VAL 1.014 0.087 12 0 "[ . 1 . 2]"
1 128 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 129 SER 0.893 0.099 18 0 "[ . 1 . 2]"
1 130 ILE 0.946 0.078 13 0 "[ . 1 . 2]"
1 131 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 132 LYS 0.004 0.004 17 0 "[ . 1 . 2]"
1 133 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 134 VAL 0.114 0.040 19 0 "[ . 1 . 2]"
1 135 THR 0.045 0.017 11 0 "[ . 1 . 2]"
1 136 ALA 0.401 0.042 19 0 "[ . 1 . 2]"
1 137 LYS 0.005 0.002 20 0 "[ . 1 . 2]"
1 138 GLU 0.023 0.007 18 0 "[ . 1 . 2]"
1 139 VAL 0.789 0.042 19 0 "[ . 1 . 2]"
1 140 ILE 0.696 0.063 15 0 "[ . 1 . 2]"
1 141 THR 0.119 0.029 10 0 "[ . 1 . 2]"
1 142 ARG 0.396 0.068 5 0 "[ . 1 . 2]"
1 143 THR 1.528 0.086 19 0 "[ . 1 . 2]"
1 144 VAL 2.686 0.094 11 0 "[ . 1 . 2]"
1 145 LYS 1.309 0.101 4 0 "[ . 1 . 2]"
1 146 VAL 0.444 0.062 15 0 "[ . 1 . 2]"
1 147 THR 0.860 0.069 11 0 "[ . 1 . 2]"
1 148 ASN 0.328 0.157 18 0 "[ . 1 . 2]"
1 149 VAL 0.379 0.163 18 0 "[ . 1 . 2]"
1 150 GLY 0.033 0.025 17 0 "[ . 1 . 2]"
1 151 ARG 0.378 0.212 7 0 "[ . 1 . 2]"
1 152 PRO 0.028 0.028 7 0 "[ . 1 . 2]"
1 153 SER 0.035 0.019 16 0 "[ . 1 . 2]"
1 154 MET 0.616 0.154 15 0 "[ . 1 . 2]"
1 155 ALA 0.001 0.001 20 0 "[ . 1 . 2]"
1 156 GLU 0.001 0.001 20 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 3 MET HA 1 3 MET QG . . 3.630 2.565 2.064 3.422 . 0 0 "[ . 1 . 2]" 1
2 1 3 MET HA 1 4 MET H . . 3.270 2.528 2.142 3.236 . 0 0 "[ . 1 . 2]" 1
3 1 3 MET QB 1 4 MET H . . 3.940 3.209 2.032 3.865 . 0 0 "[ . 1 . 2]" 1
4 1 5 PRO QB 1 6 VAL H . . 3.420 3.035 2.833 3.337 . 0 0 "[ . 1 . 2]" 1
5 1 5 PRO QD 1 6 VAL H . . 3.980 2.643 2.601 2.695 . 0 0 "[ . 1 . 2]" 1
6 1 5 PRO QG 1 6 VAL H . . 3.200 2.152 1.920 2.552 . 0 0 "[ . 1 . 2]" 1
7 1 6 VAL H 1 6 VAL QG . . 3.010 2.200 1.931 2.884 . 0 0 "[ . 1 . 2]" 1
8 1 6 VAL HA 1 6 VAL QG . . 2.800 2.170 2.062 2.340 . 0 0 "[ . 1 . 2]" 1
9 1 7 PRO HA 1 8 ASN H . . 3.570 2.557 2.156 3.561 . 0 0 "[ . 1 . 2]" 1
10 1 8 ASN HA 1 9 PRO HB3 . . 4.900 4.864 4.853 4.867 . 0 0 "[ . 1 . 2]" 1
11 1 8 ASN HA 1 9 PRO HD2 . . 2.780 2.485 2.441 2.496 . 0 0 "[ . 1 . 2]" 1
12 1 8 ASN HA 1 9 PRO QD . . 2.400 2.140 2.114 2.147 . 0 0 "[ . 1 . 2]" 1
13 1 8 ASN HA 1 9 PRO HD3 . . 2.780 2.336 2.316 2.341 . 0 0 "[ . 1 . 2]" 1
14 1 8 ASN QB 1 9 PRO QD . . 3.310 1.981 1.916 2.059 . 0 0 "[ . 1 . 2]" 1
15 1 8 ASN QB 1 9 PRO QG . . 4.130 3.487 3.434 3.582 . 0 0 "[ . 1 . 2]" 1
16 1 9 PRO HA 1 10 THR MG . . 5.010 4.427 3.423 5.011 0.001 5 0 "[ . 1 . 2]" 1
17 1 9 PRO QD 1 10 THR H . . 4.230 3.708 2.613 4.716 0.486 20 0 "[ . 1 . 2]" 1
18 1 9 PRO QG 1 10 THR H . . 3.790 2.864 1.748 3.600 . 0 0 "[ . 1 . 2]" 1
19 1 10 THR H 1 10 THR HB . . 3.770 3.616 3.284 3.750 . 0 0 "[ . 1 . 2]" 1
20 1 10 THR H 1 10 THR MG . . 3.780 2.813 2.130 3.633 . 0 0 "[ . 1 . 2]" 1
21 1 10 THR HA 1 10 THR MG . . 2.400 2.210 2.087 2.385 . 0 0 "[ . 1 . 2]" 1
22 1 10 THR HA 1 11 MET H . . 2.810 2.292 2.154 2.531 . 0 0 "[ . 1 . 2]" 1
23 1 10 THR MG 1 11 MET H . . 3.940 3.598 2.839 3.918 . 0 0 "[ . 1 . 2]" 1
24 1 11 MET H 1 11 MET QB . . 3.130 2.802 2.182 3.137 0.007 8 0 "[ . 1 . 2]" 1
25 1 11 MET H 1 11 MET QG . . 3.860 2.886 2.473 4.039 0.179 12 0 "[ . 1 . 2]" 1
26 1 11 MET H 1 12 PRO HD2 . . 4.860 4.785 4.688 4.805 . 0 0 "[ . 1 . 2]" 1
27 1 11 MET HA 1 11 MET HG2 . . 3.920 3.695 3.566 3.753 . 0 0 "[ . 1 . 2]" 1
28 1 11 MET HA 1 11 MET HG3 . . 3.920 3.723 3.419 4.213 0.293 9 0 "[ . 1 . 2]" 1
29 1 11 MET HA 1 12 PRO HD2 . . 2.660 2.445 2.437 2.508 . 0 0 "[ . 1 . 2]" 1
30 1 11 MET HA 1 12 PRO HD3 . . 2.710 2.318 2.314 2.347 . 0 0 "[ . 1 . 2]" 1
31 1 11 MET HA 1 12 PRO QG . . 5.080 4.030 4.025 4.072 . 0 0 "[ . 1 . 2]" 1
32 1 11 MET QB 1 12 PRO HD2 . . 3.250 1.953 1.939 2.109 . 0 0 "[ . 1 . 2]" 1
33 1 11 MET QB 1 12 PRO HD3 . . 3.640 3.244 3.237 3.269 . 0 0 "[ . 1 . 2]" 1
34 1 11 MET HB2 1 12 PRO HD2 . . 3.770 1.962 1.947 2.123 . 0 0 "[ . 1 . 2]" 1
35 1 11 MET HB3 1 12 PRO HD2 . . 3.770 3.573 3.564 3.629 . 0 0 "[ . 1 . 2]" 1
36 1 11 MET QG 1 12 PRO HA . . 4.210 4.162 3.897 4.206 . 0 0 "[ . 1 . 2]" 1
37 1 11 MET QG 1 12 PRO HD2 . . 3.730 2.943 2.153 3.023 . 0 0 "[ . 1 . 2]" 1
38 1 11 MET QG 1 12 PRO HD3 . . 4.130 4.131 3.543 4.196 0.066 11 0 "[ . 1 . 2]" 1
39 1 11 MET HG2 1 12 PRO HD2 . . 4.270 4.011 3.042 4.254 . 0 0 "[ . 1 . 2]" 1
40 1 11 MET HG3 1 12 PRO HD2 . . 4.270 3.136 2.171 3.855 . 0 0 "[ . 1 . 2]" 1
41 1 12 PRO HA 1 13 VAL H . . 2.510 2.250 2.151 2.419 . 0 0 "[ . 1 . 2]" 1
42 1 12 PRO HA 1 13 VAL HA . . 4.660 4.445 4.315 4.595 . 0 0 "[ . 1 . 2]" 1
43 1 13 VAL H 1 13 VAL HB . . 2.920 2.505 2.207 2.715 . 0 0 "[ . 1 . 2]" 1
44 1 13 VAL H 1 13 VAL MG1 . . 3.430 3.618 2.009 3.764 0.334 14 0 "[ . 1 . 2]" 1
45 1 13 VAL H 1 13 VAL QG . . 3.000 2.254 2.001 2.837 . 0 0 "[ . 1 . 2]" 1
46 1 13 VAL H 1 13 VAL MG2 . . 3.430 2.407 2.013 3.756 0.326 11 0 "[ . 1 . 2]" 1
47 1 13 VAL HA 1 13 VAL MG1 . . 2.780 2.442 2.141 3.180 0.400 11 0 "[ . 1 . 2]" 1
48 1 13 VAL HA 1 13 VAL QG . . 2.390 2.101 2.015 2.313 . 0 0 "[ . 1 . 2]" 1
49 1 13 VAL HA 1 13 VAL MG2 . . 2.780 2.334 2.161 2.457 . 0 0 "[ . 1 . 2]" 1
50 1 13 VAL HA 1 14 LYS H . . 2.750 2.209 2.185 2.268 . 0 0 "[ . 1 . 2]" 1
51 1 13 VAL HA 1 14 LYS QB . . 4.560 4.389 4.237 4.583 0.023 19 0 "[ . 1 . 2]" 1
52 1 13 VAL HA 1 14 LYS QG . . 3.910 3.746 3.510 3.964 0.054 19 0 "[ . 1 . 2]" 1
53 1 13 VAL HB 1 14 LYS H . . 4.100 4.016 3.737 4.147 0.047 5 0 "[ . 1 . 2]" 1
54 1 14 LYS H 1 14 LYS QB . . 2.960 2.611 2.345 3.387 0.427 19 0 "[ . 1 . 2]" 1
55 1 14 LYS HA 1 14 LYS QB . . 2.440 2.359 2.168 2.417 . 0 0 "[ . 1 . 2]" 1
56 1 14 LYS HA 1 14 LYS HE2 . . 5.500 4.641 2.338 5.462 . 0 0 "[ . 1 . 2]" 1
57 1 14 LYS HA 1 14 LYS QE . . 4.810 4.087 2.223 4.817 0.007 14 0 "[ . 1 . 2]" 1
58 1 14 LYS HA 1 14 LYS HE3 . . 5.500 4.661 2.780 5.425 . 0 0 "[ . 1 . 2]" 1
59 1 14 LYS HA 1 14 LYS QG . . 2.850 2.591 2.307 3.310 0.460 12 0 "[ . 1 . 2]" 1
60 1 14 LYS HA 1 15 GLY H . . 3.550 2.726 2.148 3.562 0.012 15 0 "[ . 1 . 2]" 1
61 1 14 LYS HB2 1 15 GLY H . . 5.130 3.308 2.020 4.468 . 0 0 "[ . 1 . 2]" 1
62 1 14 LYS HB3 1 15 GLY H . . 5.130 3.095 1.998 4.332 . 0 0 "[ . 1 . 2]" 1
63 1 14 LYS HG2 1 15 GLY H . . 5.500 4.585 3.808 5.502 0.002 12 0 "[ . 1 . 2]" 1
64 1 14 LYS HG3 1 15 GLY H . . 5.500 4.736 4.139 5.475 . 0 0 "[ . 1 . 2]" 1
65 1 15 GLY H 1 16 ALA H . . 4.430 3.714 1.926 4.442 0.012 19 0 "[ . 1 . 2]" 1
66 1 15 GLY H 1 16 ALA MB . . 5.500 4.566 3.567 5.504 0.004 19 0 "[ . 1 . 2]" 1
67 1 15 GLY QA 1 16 ALA H . . 2.920 2.336 2.112 2.882 . 0 0 "[ . 1 . 2]" 1
68 1 15 GLY QA 1 16 ALA HA . . 5.050 3.977 3.934 4.102 . 0 0 "[ . 1 . 2]" 1
69 1 15 GLY QA 1 16 ALA MB . . 4.910 3.754 3.483 4.220 . 0 0 "[ . 1 . 2]" 1
70 1 15 GLY HA2 1 16 ALA H . . 3.550 2.602 2.139 3.552 0.002 1 0 "[ . 1 . 2]" 1
71 1 15 GLY HA3 1 16 ALA H . . 3.550 2.928 2.212 3.557 0.007 12 0 "[ . 1 . 2]" 1
72 1 16 ALA H 1 16 ALA MB . . 3.000 2.518 2.089 2.894 . 0 0 "[ . 1 . 2]" 1
73 1 16 ALA HA 1 17 GLY H . . 3.220 2.618 2.145 3.003 . 0 0 "[ . 1 . 2]" 1
74 1 16 ALA HA 1 17 GLY QA . . 5.340 3.992 3.889 4.135 . 0 0 "[ . 1 . 2]" 1
75 1 16 ALA MB 1 17 GLY H . . 3.620 2.883 2.019 3.622 0.002 6 0 "[ . 1 . 2]" 1
76 1 16 ALA MB 1 17 GLY QA . . 5.340 3.776 3.497 4.036 . 0 0 "[ . 1 . 2]" 1
77 1 17 GLY H 1 18 THR H . . 4.090 3.558 2.693 4.113 0.023 5 0 "[ . 1 . 2]" 1
78 1 17 GLY QA 1 18 THR H . . 3.030 2.363 2.109 2.532 . 0 0 "[ . 1 . 2]" 1
79 1 18 THR H 1 18 THR MG . . 3.890 3.778 2.049 3.930 0.040 11 0 "[ . 1 . 2]" 1
80 1 18 THR H 1 19 THR MG . . 4.530 4.378 3.805 4.567 0.037 5 0 "[ . 1 . 2]" 1
81 1 18 THR HA 1 18 THR MG . . 3.390 2.296 2.033 3.190 . 0 0 "[ . 1 . 2]" 1
82 1 18 THR HA 1 19 THR H . . 3.180 2.187 2.140 2.276 . 0 0 "[ . 1 . 2]" 1
83 1 18 THR HA 1 19 THR MG . . 4.170 3.366 3.140 3.598 . 0 0 "[ . 1 . 2]" 1
84 1 18 THR HA 1 45 VAL QG . . 4.720 3.863 3.310 4.620 . 0 0 "[ . 1 . 2]" 1
85 1 18 THR HA 1 113 ILE MG . . 4.980 4.251 3.534 4.973 . 0 0 "[ . 1 . 2]" 1
86 1 18 THR HB 1 19 THR H . . 4.160 3.945 3.709 4.146 . 0 0 "[ . 1 . 2]" 1
87 1 18 THR HB 1 113 ILE MG . . 4.850 4.304 3.568 4.855 0.005 14 0 "[ . 1 . 2]" 1
88 1 18 THR MG 1 19 THR H . . 3.830 2.470 1.978 3.770 . 0 0 "[ . 1 . 2]" 1
89 1 18 THR MG 1 19 THR HA . . 4.960 3.734 3.410 4.086 . 0 0 "[ . 1 . 2]" 1
90 1 18 THR MG 1 45 VAL H . . 4.410 4.044 3.369 4.413 0.003 17 0 "[ . 1 . 2]" 1
91 1 18 THR MG 1 45 VAL QG . . 3.230 2.142 1.771 2.851 . 0 0 "[ . 1 . 2]" 1
92 1 18 THR MG 1 113 ILE MG . . 3.820 2.306 1.766 3.370 . 0 0 "[ . 1 . 2]" 1
93 1 18 THR MG 1 114 ARG H . . 5.240 3.838 3.215 5.290 0.050 5 0 "[ . 1 . 2]" 1
94 1 19 THR H 1 19 THR MG . . 3.910 2.308 2.200 2.374 . 0 0 "[ . 1 . 2]" 1
95 1 19 THR H 1 20 LEU H . . 4.820 4.281 4.206 4.351 . 0 0 "[ . 1 . 2]" 1
96 1 19 THR H 1 45 VAL H . . 4.300 4.228 4.144 4.323 0.023 3 0 "[ . 1 . 2]" 1
97 1 19 THR H 1 45 VAL QG . . 4.380 3.165 2.958 3.578 . 0 0 "[ . 1 . 2]" 1
98 1 19 THR H 1 113 ILE MG . . 4.040 3.260 2.523 3.907 . 0 0 "[ . 1 . 2]" 1
99 1 19 THR H 1 114 ARG H . . 4.120 3.509 3.144 4.140 0.020 4 0 "[ . 1 . 2]" 1
100 1 19 THR HA 1 20 LEU H . . 3.560 2.216 2.171 2.289 . 0 0 "[ . 1 . 2]" 1
101 1 19 THR HA 1 20 LEU HB3 . . 4.290 4.206 4.168 4.240 . 0 0 "[ . 1 . 2]" 1
102 1 19 THR HA 1 21 TRP HE1 . . 4.960 4.724 4.539 4.841 . 0 0 "[ . 1 . 2]" 1
103 1 19 THR HA 1 44 LYS H . . 5.290 5.210 5.021 5.317 0.027 7 0 "[ . 1 . 2]" 1
104 1 19 THR HA 1 44 LYS HA . . 4.500 2.623 2.406 2.815 . 0 0 "[ . 1 . 2]" 1
105 1 19 THR HA 1 45 VAL H . . 3.910 1.974 1.928 2.125 . 0 0 "[ . 1 . 2]" 1
106 1 19 THR HA 1 45 VAL HB . . 4.950 3.531 3.272 4.779 . 0 0 "[ . 1 . 2]" 1
107 1 19 THR HA 1 45 VAL MG1 . . 5.500 2.939 1.947 4.452 . 0 0 "[ . 1 . 2]" 1
108 1 19 THR HA 1 45 VAL QG . . 4.290 2.008 1.903 2.277 . 0 0 "[ . 1 . 2]" 1
109 1 19 THR HA 1 45 VAL MG2 . . 5.500 3.519 1.905 4.653 . 0 0 "[ . 1 . 2]" 1
110 1 19 THR HB 1 20 LEU H . . 3.940 3.811 3.576 3.897 . 0 0 "[ . 1 . 2]" 1
111 1 19 THR HB 1 21 TRP HE1 . . 4.330 4.067 3.575 4.331 0.001 4 0 "[ . 1 . 2]" 1
112 1 19 THR HB 1 43 ALA HA . . 5.390 5.205 4.887 5.407 0.017 15 0 "[ . 1 . 2]" 1
113 1 19 THR HB 1 44 LYS HA . . 4.750 2.093 1.995 2.331 . 0 0 "[ . 1 . 2]" 1
114 1 19 THR HB 1 44 LYS QB . . 4.190 3.267 3.079 3.514 . 0 0 "[ . 1 . 2]" 1
115 1 19 THR HB 1 45 VAL H . . 4.310 3.194 2.989 3.334 . 0 0 "[ . 1 . 2]" 1
116 1 19 THR MG 1 20 LEU H . . 4.350 4.097 4.022 4.235 . 0 0 "[ . 1 . 2]" 1
117 1 19 THR MG 1 21 TRP H . . 5.500 5.480 5.346 5.544 0.044 10 0 "[ . 1 . 2]" 1
118 1 19 THR MG 1 21 TRP HE1 . . 3.750 1.887 1.847 2.012 . 0 0 "[ . 1 . 2]" 1
119 1 19 THR MG 1 44 LYS HA . . 4.190 3.799 3.635 4.006 . 0 0 "[ . 1 . 2]" 1
120 1 19 THR MG 1 45 VAL H . . 4.830 4.294 4.115 4.430 . 0 0 "[ . 1 . 2]" 1
121 1 19 THR MG 1 114 ARG H . . 4.750 4.113 3.280 4.594 . 0 0 "[ . 1 . 2]" 1
122 1 20 LEU H 1 20 LEU HB2 . . 3.800 3.666 3.640 3.741 . 0 0 "[ . 1 . 2]" 1
123 1 20 LEU H 1 20 LEU HB3 . . 3.780 2.530 2.473 2.692 . 0 0 "[ . 1 . 2]" 1
124 1 20 LEU H 1 20 LEU QD . . 4.640 1.887 1.861 1.927 . 0 0 "[ . 1 . 2]" 1
125 1 20 LEU H 1 21 TRP H . . 4.780 4.537 4.468 4.566 . 0 0 "[ . 1 . 2]" 1
126 1 20 LEU H 1 21 TRP HD1 . . 4.550 4.161 3.860 4.308 . 0 0 "[ . 1 . 2]" 1
127 1 20 LEU H 1 21 TRP HE1 . . 4.850 4.779 4.446 4.885 0.035 6 0 "[ . 1 . 2]" 1
128 1 20 LEU H 1 42 LEU HB2 . . 4.620 4.438 4.038 4.634 0.014 11 0 "[ . 1 . 2]" 1
129 1 20 LEU H 1 43 ALA H . . 4.070 3.795 3.548 3.996 . 0 0 "[ . 1 . 2]" 1
130 1 20 LEU H 1 44 LYS HA . . 4.260 3.996 3.755 4.191 . 0 0 "[ . 1 . 2]" 1
131 1 20 LEU H 1 45 VAL H . . 4.370 3.625 3.351 3.872 . 0 0 "[ . 1 . 2]" 1
132 1 20 LEU H 1 113 ILE MG . . 4.640 3.763 3.371 4.010 . 0 0 "[ . 1 . 2]" 1
133 1 20 LEU HA 1 20 LEU MD1 . . 4.490 4.079 4.063 4.087 . 0 0 "[ . 1 . 2]" 1
134 1 20 LEU HA 1 20 LEU QD . . 3.820 3.365 3.346 3.381 . 0 0 "[ . 1 . 2]" 1
135 1 20 LEU HA 1 20 LEU MD2 . . 4.490 3.585 3.558 3.608 . 0 0 "[ . 1 . 2]" 1
136 1 20 LEU HA 1 21 TRP H . . 3.500 2.214 2.185 2.246 . 0 0 "[ . 1 . 2]" 1
137 1 20 LEU HA 1 21 TRP HE1 . . 4.880 4.542 4.390 4.714 . 0 0 "[ . 1 . 2]" 1
138 1 20 LEU HA 1 42 LEU HG . . 5.500 5.484 5.318 5.529 0.029 10 0 "[ . 1 . 2]" 1
139 1 20 LEU HA 1 113 ILE H . . 5.000 4.525 4.253 4.848 . 0 0 "[ . 1 . 2]" 1
140 1 20 LEU HA 1 113 ILE HA . . 5.060 2.019 1.957 2.127 . 0 0 "[ . 1 . 2]" 1
141 1 20 LEU HA 1 113 ILE MD . . 4.790 4.461 4.275 4.813 0.023 4 0 "[ . 1 . 2]" 1
142 1 20 LEU HA 1 113 ILE MG . . 4.570 2.963 2.622 3.142 . 0 0 "[ . 1 . 2]" 1
143 1 20 LEU HA 1 114 ARG H . . 4.130 3.308 2.973 3.521 . 0 0 "[ . 1 . 2]" 1
144 1 20 LEU HB2 1 20 LEU HG . . 2.810 2.495 2.487 2.511 . 0 0 "[ . 1 . 2]" 1
145 1 20 LEU HB2 1 21 TRP H . . 3.790 3.053 2.948 3.145 . 0 0 "[ . 1 . 2]" 1
146 1 20 LEU HB2 1 113 ILE H . . 4.430 4.443 4.403 4.485 0.055 20 0 "[ . 1 . 2]" 1
147 1 20 LEU HB2 1 113 ILE QG . . 3.900 1.985 1.893 2.119 . 0 0 "[ . 1 . 2]" 1
148 1 20 LEU HB2 1 114 ARG H . . 5.500 5.182 4.652 5.513 0.013 19 0 "[ . 1 . 2]" 1
149 1 20 LEU HB3 1 21 TRP H . . 4.560 4.225 4.169 4.272 . 0 0 "[ . 1 . 2]" 1
150 1 20 LEU HB3 1 113 ILE HA . . 4.230 3.645 3.488 3.760 . 0 0 "[ . 1 . 2]" 1
151 1 20 LEU QD 1 21 TRP HE1 . . 5.440 5.355 5.166 5.464 0.024 4 0 "[ . 1 . 2]" 1
152 1 20 LEU QD 1 41 ARG HA . . 5.440 4.866 4.468 5.189 . 0 0 "[ . 1 . 2]" 1
153 1 20 LEU QD 1 42 LEU H . . 4.560 3.316 2.928 3.625 . 0 0 "[ . 1 . 2]" 1
154 1 20 LEU QD 1 42 LEU QD . . 3.260 1.896 1.773 2.045 . 0 0 "[ . 1 . 2]" 1
155 1 20 LEU QD 1 42 LEU HG . . 4.190 3.107 2.933 3.451 . 0 0 "[ . 1 . 2]" 1
156 1 20 LEU QD 1 43 ALA H . . 4.050 2.256 1.989 2.488 . 0 0 "[ . 1 . 2]" 1
157 1 20 LEU QD 1 43 ALA HA . . 4.500 4.350 4.113 4.509 0.009 15 0 "[ . 1 . 2]" 1
158 1 20 LEU QD 1 44 LYS H . . 4.960 4.695 4.508 4.867 . 0 0 "[ . 1 . 2]" 1
159 1 20 LEU QD 1 45 VAL QG . . 3.460 2.664 1.834 3.244 . 0 0 "[ . 1 . 2]" 1
160 1 20 LEU QD 1 85 PHE HB2 . . 5.440 4.503 3.863 4.958 . 0 0 "[ . 1 . 2]" 1
161 1 20 LEU QD 1 111 TYR H . . 5.440 5.361 5.070 5.527 0.087 4 0 "[ . 1 . 2]" 1
162 1 20 LEU QD 1 111 TYR QB . . 3.700 2.733 2.490 3.025 . 0 0 "[ . 1 . 2]" 1
163 1 20 LEU QD 1 112 LYS H . . 4.720 4.562 4.186 4.731 0.011 2 0 "[ . 1 . 2]" 1
164 1 20 LEU QD 1 113 ILE H . . 5.370 5.321 5.163 5.382 0.012 12 0 "[ . 1 . 2]" 1
165 1 20 LEU QD 1 113 ILE HA . . 4.550 4.442 4.261 4.558 0.008 19 0 "[ . 1 . 2]" 1
166 1 20 LEU QD 1 113 ILE QG . . 4.290 2.911 2.616 3.133 . 0 0 "[ . 1 . 2]" 1
167 1 20 LEU QD 1 113 ILE MG . . 4.090 3.745 3.524 4.082 . 0 0 "[ . 1 . 2]" 1
168 1 20 LEU MD1 1 21 TRP H . . 4.700 4.469 4.336 4.580 . 0 0 "[ . 1 . 2]" 1
169 1 20 LEU MD1 1 113 ILE MG . . 4.650 4.267 3.912 4.653 0.003 5 0 "[ . 1 . 2]" 1
170 1 20 LEU MD2 1 21 TRP H . . 4.700 4.393 4.352 4.504 . 0 0 "[ . 1 . 2]" 1
171 1 20 LEU MD2 1 113 ILE MG . . 4.650 4.158 3.821 4.518 . 0 0 "[ . 1 . 2]" 1
172 1 20 LEU HG 1 21 TRP H . . 4.040 3.634 3.523 3.792 . 0 0 "[ . 1 . 2]" 1
173 1 20 LEU HG 1 22 VAL H . . 5.200 4.962 4.888 5.080 . 0 0 "[ . 1 . 2]" 1
174 1 20 LEU HG 1 42 LEU HG . . 3.130 2.689 2.428 2.933 . 0 0 "[ . 1 . 2]" 1
175 1 21 TRP H 1 21 TRP QB . . 3.680 2.850 2.797 2.924 . 0 0 "[ . 1 . 2]" 1
176 1 21 TRP H 1 21 TRP HD1 . . 3.820 3.582 3.444 3.719 . 0 0 "[ . 1 . 2]" 1
177 1 21 TRP H 1 21 TRP HE1 . . 4.960 4.921 4.789 5.005 0.045 3 0 "[ . 1 . 2]" 1
178 1 21 TRP H 1 112 LYS H . . 3.800 2.993 2.630 3.472 . 0 0 "[ . 1 . 2]" 1
179 1 21 TRP H 1 112 LYS QB . . 4.880 4.083 3.599 4.709 . 0 0 "[ . 1 . 2]" 1
180 1 21 TRP H 1 113 ILE HA . . 4.280 3.277 2.895 3.427 . 0 0 "[ . 1 . 2]" 1
181 1 21 TRP H 1 113 ILE QG . . 4.800 4.000 3.784 4.268 . 0 0 "[ . 1 . 2]" 1
182 1 21 TRP H 1 114 ARG H . . 4.690 4.590 4.144 4.714 0.024 5 0 "[ . 1 . 2]" 1
183 1 21 TRP HA 1 22 VAL H . . 3.520 2.278 2.267 2.281 . 0 0 "[ . 1 . 2]" 1
184 1 21 TRP HA 1 22 VAL QG . . 4.190 3.794 3.503 3.939 . 0 0 "[ . 1 . 2]" 1
185 1 21 TRP HA 1 39 TRP HD1 . . 5.060 3.973 3.748 4.686 . 0 0 "[ . 1 . 2]" 1
186 1 21 TRP HA 1 40 SER HB3 . . 5.500 5.509 5.322 5.559 0.059 8 0 "[ . 1 . 2]" 1
187 1 21 TRP HA 1 41 ARG H . . 5.260 5.130 4.678 5.277 0.017 17 0 "[ . 1 . 2]" 1
188 1 21 TRP HA 1 41 ARG HA . . 4.840 2.485 2.195 2.633 . 0 0 "[ . 1 . 2]" 1
189 1 21 TRP HA 1 42 LEU H . . 3.900 2.796 2.172 3.172 . 0 0 "[ . 1 . 2]" 1
190 1 21 TRP HA 1 43 ALA H . . 4.900 4.759 4.309 4.928 0.028 4 0 "[ . 1 . 2]" 1
191 1 21 TRP QB 1 22 VAL H . . 3.630 2.773 2.751 2.808 . 0 0 "[ . 1 . 2]" 1
192 1 21 TRP QB 1 39 TRP HD1 . . 5.340 2.059 1.955 2.643 . 0 0 "[ . 1 . 2]" 1
193 1 21 TRP QB 1 41 ARG H . . 5.100 4.672 3.766 5.103 0.003 6 0 "[ . 1 . 2]" 1
194 1 21 TRP HB2 1 22 VAL H . . 4.240 3.526 3.441 3.581 . 0 0 "[ . 1 . 2]" 1
195 1 21 TRP HB3 1 22 VAL H . . 4.240 2.901 2.861 2.961 . 0 0 "[ . 1 . 2]" 1
196 1 21 TRP HD1 1 42 LEU HG . . 5.500 4.659 4.301 4.918 . 0 0 "[ . 1 . 2]" 1
197 1 21 TRP HD1 1 43 ALA H . . 4.870 4.480 3.603 4.832 . 0 0 "[ . 1 . 2]" 1
198 1 21 TRP HE1 1 45 VAL QG . . 5.440 5.495 5.459 5.560 0.120 10 0 "[ . 1 . 2]" 1
199 1 21 TRP HE1 1 113 ILE MG . . 5.500 5.481 5.196 5.544 0.044 12 0 "[ . 1 . 2]" 1
200 1 21 TRP HE1 1 114 ARG H . . 4.640 4.671 4.646 4.743 0.103 19 0 "[ . 1 . 2]" 1
201 1 22 VAL H 1 22 VAL HB . . 3.950 2.908 2.825 3.048 . 0 0 "[ . 1 . 2]" 1
202 1 22 VAL H 1 22 VAL MG1 . . 4.040 2.049 1.896 2.198 . 0 0 "[ . 1 . 2]" 1
203 1 22 VAL H 1 22 VAL QG . . 3.190 2.041 1.891 2.186 . 0 0 "[ . 1 . 2]" 1
204 1 22 VAL H 1 22 VAL MG2 . . 4.040 3.866 3.784 3.899 . 0 0 "[ . 1 . 2]" 1
205 1 22 VAL H 1 23 TYR H . . 4.650 4.487 4.444 4.533 . 0 0 "[ . 1 . 2]" 1
206 1 22 VAL H 1 39 TRP HD1 . . 3.840 3.413 3.189 3.834 . 0 0 "[ . 1 . 2]" 1
207 1 22 VAL H 1 40 SER HA . . 4.990 4.905 4.669 5.012 0.022 7 0 "[ . 1 . 2]" 1
208 1 22 VAL H 1 40 SER HB3 . . 4.370 3.862 3.738 4.094 . 0 0 "[ . 1 . 2]" 1
209 1 22 VAL H 1 41 ARG H . . 4.890 4.796 4.671 4.871 . 0 0 "[ . 1 . 2]" 1
210 1 22 VAL H 1 41 ARG HA . . 4.450 3.292 3.129 3.462 . 0 0 "[ . 1 . 2]" 1
211 1 22 VAL H 1 42 LEU H . . 4.330 4.040 3.392 4.342 0.012 2 0 "[ . 1 . 2]" 1
212 1 22 VAL H 1 42 LEU QD . . 3.910 2.863 2.615 3.155 . 0 0 "[ . 1 . 2]" 1
213 1 22 VAL H 1 42 LEU HG . . 4.170 3.179 2.638 3.461 . 0 0 "[ . 1 . 2]" 1
214 1 22 VAL H 1 111 TYR HA . . 5.460 4.983 4.718 5.330 . 0 0 "[ . 1 . 2]" 1
215 1 22 VAL HA 1 39 TRP HD1 . . 5.500 5.485 4.754 5.586 0.086 4 0 "[ . 1 . 2]" 1
216 1 22 VAL HA 1 111 TYR HA . . 5.200 2.349 2.130 2.591 . 0 0 "[ . 1 . 2]" 1
217 1 22 VAL HA 1 112 LYS H . . 4.040 3.502 2.966 3.721 . 0 0 "[ . 1 . 2]" 1
218 1 22 VAL HB 1 23 TYR H . . 4.420 4.093 3.964 4.180 . 0 0 "[ . 1 . 2]" 1
219 1 22 VAL HB 1 40 SER H . . 5.500 5.452 5.163 5.532 0.032 19 0 "[ . 1 . 2]" 1
220 1 22 VAL HB 1 42 LEU QD . . 3.680 2.012 1.872 2.517 . 0 0 "[ . 1 . 2]" 1
221 1 22 VAL HB 1 42 LEU HG . . 3.490 3.315 2.925 3.503 0.013 15 0 "[ . 1 . 2]" 1
222 1 22 VAL HB 1 111 TYR HB2 . . 4.960 4.121 3.437 5.205 0.245 4 0 "[ . 1 . 2]" 1
223 1 22 VAL HB 1 111 TYR HB3 . . 4.960 3.286 2.449 3.806 . 0 0 "[ . 1 . 2]" 1
224 1 22 VAL HB 1 112 LYS H . . 5.500 5.252 4.861 5.503 0.003 15 0 "[ . 1 . 2]" 1
225 1 22 VAL QG 1 23 TYR H . . 3.570 2.123 1.897 2.515 . 0 0 "[ . 1 . 2]" 1
226 1 22 VAL QG 1 40 SER H . . 3.980 3.008 2.678 3.427 . 0 0 "[ . 1 . 2]" 1
227 1 22 VAL QG 1 40 SER HA . . 4.290 4.024 3.804 4.249 . 0 0 "[ . 1 . 2]" 1
228 1 22 VAL QG 1 40 SER HB2 . . 3.310 2.534 2.405 2.683 . 0 0 "[ . 1 . 2]" 1
229 1 22 VAL QG 1 40 SER HB3 . . 3.320 2.163 1.965 2.520 . 0 0 "[ . 1 . 2]" 1
230 1 22 VAL QG 1 41 ARG H . . 4.690 4.297 3.968 4.747 0.057 1 0 "[ . 1 . 2]" 1
231 1 22 VAL QG 1 41 ARG HA . . 4.880 3.980 3.573 4.354 . 0 0 "[ . 1 . 2]" 1
232 1 22 VAL QG 1 42 LEU H . . 5.090 4.349 3.976 4.708 . 0 0 "[ . 1 . 2]" 1
233 1 22 VAL QG 1 42 LEU HG . . 4.410 3.387 3.049 3.626 . 0 0 "[ . 1 . 2]" 1
234 1 22 VAL QG 1 109 ARG HA . . 5.440 4.658 4.039 5.359 . 0 0 "[ . 1 . 2]" 1
235 1 22 VAL QG 1 109 ARG QB . . 4.410 3.423 2.434 4.414 0.004 18 0 "[ . 1 . 2]" 1
236 1 22 VAL QG 1 110 ALA H . . 4.040 3.367 2.920 3.915 . 0 0 "[ . 1 . 2]" 1
237 1 22 VAL QG 1 110 ALA HA . . 5.440 4.781 4.342 5.462 0.022 8 0 "[ . 1 . 2]" 1
238 1 22 VAL QG 1 111 TYR QB . . 3.720 3.032 2.445 3.646 . 0 0 "[ . 1 . 2]" 1
239 1 22 VAL MG1 1 23 TYR H . . 4.460 3.689 3.429 4.073 . 0 0 "[ . 1 . 2]" 1
240 1 22 VAL MG1 1 40 SER H . . 5.260 3.040 2.706 3.479 . 0 0 "[ . 1 . 2]" 1
241 1 22 VAL MG1 1 40 SER HB2 . . 4.640 2.548 2.424 2.700 . 0 0 "[ . 1 . 2]" 1
242 1 22 VAL MG2 1 23 TYR H . . 4.460 2.136 1.905 2.539 . 0 0 "[ . 1 . 2]" 1
243 1 22 VAL MG2 1 40 SER H . . 5.260 4.835 4.276 5.175 . 0 0 "[ . 1 . 2]" 1
244 1 22 VAL MG2 1 40 SER HB2 . . 4.640 4.529 4.027 4.661 0.021 19 0 "[ . 1 . 2]" 1
245 1 23 TYR H 1 110 ALA MB . . 4.770 4.226 3.536 4.786 0.016 8 0 "[ . 1 . 2]" 1
246 1 23 TYR H 1 111 TYR HA . . 4.380 3.294 2.684 3.563 . 0 0 "[ . 1 . 2]" 1
247 1 23 TYR H 1 111 TYR HB2 . . 5.500 5.381 4.966 5.643 0.143 4 0 "[ . 1 . 2]" 1
248 1 23 TYR H 1 111 TYR HB3 . . 5.500 4.701 4.150 5.271 . 0 0 "[ . 1 . 2]" 1
249 1 23 TYR H 1 112 LYS H . . 5.170 4.871 4.212 5.183 0.013 1 0 "[ . 1 . 2]" 1
250 1 26 SER H 1 27 GLY H . . 4.370 4.223 3.729 4.375 0.005 2 0 "[ . 1 . 2]" 1
251 1 26 SER QB 1 27 GLY H . . 3.940 3.512 2.708 3.942 0.002 11 0 "[ . 1 . 2]" 1
252 1 30 TYR H 1 30 TYR QB . . 3.260 2.506 2.256 2.678 . 0 0 "[ . 1 . 2]" 1
253 1 30 TYR H 1 30 TYR QD . . 3.350 2.657 2.011 3.358 0.008 3 0 "[ . 1 . 2]" 1
254 1 30 TYR H 1 30 TYR QE . . 5.110 4.539 3.948 5.120 0.010 8 0 "[ . 1 . 2]" 1
255 1 30 TYR H 1 31 ALA H . . 3.260 2.192 1.898 2.541 . 0 0 "[ . 1 . 2]" 1
256 1 30 TYR H 1 31 ALA MB . . 4.180 3.776 3.508 4.172 . 0 0 "[ . 1 . 2]" 1
257 1 30 TYR H 1 32 ASN H . . 4.540 4.365 3.859 4.548 0.008 5 0 "[ . 1 . 2]" 1
258 1 30 TYR HA 1 30 TYR QE . . 4.940 4.647 4.414 4.809 . 0 0 "[ . 1 . 2]" 1
259 1 30 TYR HA 1 32 ASN HA . . 5.500 5.459 5.275 5.517 0.017 11 0 "[ . 1 . 2]" 1
260 1 30 TYR HA 1 33 PRO HD2 . . 4.640 4.224 3.846 4.519 . 0 0 "[ . 1 . 2]" 1
261 1 30 TYR HA 1 33 PRO HD3 . . 4.760 2.725 2.386 2.934 . 0 0 "[ . 1 . 2]" 1
262 1 30 TYR HA 1 122 VAL MG1 . . 4.920 4.531 3.949 4.930 0.010 10 0 "[ . 1 . 2]" 1
263 1 30 TYR HA 1 122 VAL QG . . 4.130 3.969 3.500 4.152 0.022 16 0 "[ . 1 . 2]" 1
264 1 30 TYR HA 1 122 VAL MG2 . . 4.920 4.465 3.737 4.930 0.010 19 0 "[ . 1 . 2]" 1
265 1 30 TYR QB 1 31 ALA H . . 3.670 3.071 2.541 3.528 . 0 0 "[ . 1 . 2]" 1
266 1 30 TYR QB 1 31 ALA MB . . 4.720 4.225 3.919 4.410 . 0 0 "[ . 1 . 2]" 1
267 1 30 TYR HB2 1 31 ALA MB . . 5.500 4.463 4.062 4.726 . 0 0 "[ . 1 . 2]" 1
268 1 30 TYR HB3 1 31 ALA MB . . 5.500 5.252 4.875 5.473 . 0 0 "[ . 1 . 2]" 1
269 1 30 TYR QD 1 31 ALA H . . 4.620 4.281 3.828 4.599 . 0 0 "[ . 1 . 2]" 1
270 1 30 TYR QE 1 124 ARG HB2 . . 5.500 5.297 4.508 5.512 0.012 19 0 "[ . 1 . 2]" 1
271 1 30 TYR QE 1 124 ARG HB3 . . 5.500 5.106 4.242 5.518 0.018 8 0 "[ . 1 . 2]" 1
272 1 30 TYR QE 1 124 ARG HD2 . . 5.050 3.528 2.111 4.788 . 0 0 "[ . 1 . 2]" 1
273 1 30 TYR QE 1 124 ARG QD . . 4.350 2.464 1.976 4.172 . 0 0 "[ . 1 . 2]" 1
274 1 30 TYR QE 1 124 ARG HD3 . . 5.050 2.755 1.993 4.929 . 0 0 "[ . 1 . 2]" 1
275 1 30 TYR QE 1 124 ARG HG2 . . 5.450 3.558 2.578 4.441 . 0 0 "[ . 1 . 2]" 1
276 1 30 TYR QE 1 124 ARG QG . . 4.620 3.193 2.541 3.804 . 0 0 "[ . 1 . 2]" 1
277 1 30 TYR QE 1 124 ARG HG3 . . 5.450 3.878 2.885 4.822 . 0 0 "[ . 1 . 2]" 1
278 1 31 ALA H 1 31 ALA MB . . 3.000 2.101 2.026 2.274 . 0 0 "[ . 1 . 2]" 1
279 1 31 ALA H 1 32 ASN H . . 3.770 2.803 2.321 3.062 . 0 0 "[ . 1 . 2]" 1
280 1 31 ALA H 1 33 PRO HD3 . . 4.440 3.820 3.452 4.135 . 0 0 "[ . 1 . 2]" 1
281 1 31 ALA HA 1 32 ASN HA . . 4.770 4.608 4.540 4.668 . 0 0 "[ . 1 . 2]" 1
282 1 31 ALA HA 1 32 ASN QB . . 5.340 4.557 4.324 4.985 . 0 0 "[ . 1 . 2]" 1
283 1 31 ALA HA 1 33 PRO HD2 . . 5.330 5.153 4.865 5.341 0.011 4 0 "[ . 1 . 2]" 1
284 1 31 ALA HA 1 33 PRO HD3 . . 4.770 4.460 4.148 4.670 . 0 0 "[ . 1 . 2]" 1
285 1 31 ALA MB 1 32 ASN H . . 3.420 2.545 2.169 2.956 . 0 0 "[ . 1 . 2]" 1
286 1 31 ALA MB 1 32 ASN HA . . 4.680 4.253 4.098 4.424 . 0 0 "[ . 1 . 2]" 1
287 1 31 ALA MB 1 32 ASN HB2 . . 4.240 3.583 3.175 4.551 0.311 5 0 "[ . 1 . 2]" 1
288 1 31 ALA MB 1 32 ASN QB . . 3.700 3.263 3.041 3.740 0.040 20 0 "[ . 1 . 2]" 1
289 1 31 ALA MB 1 32 ASN HB3 . . 4.240 3.931 3.565 4.139 . 0 0 "[ . 1 . 2]" 1
290 1 32 ASN H 1 32 ASN HB2 . . 4.100 3.378 3.152 3.808 . 0 0 "[ . 1 . 2]" 1
291 1 32 ASN H 1 32 ASN HB3 . . 4.100 3.326 3.065 3.732 . 0 0 "[ . 1 . 2]" 1
292 1 32 ASN H 1 33 PRO HD2 . . 4.330 3.569 3.257 3.864 . 0 0 "[ . 1 . 2]" 1
293 1 32 ASN H 1 33 PRO HD3 . . 4.200 2.648 2.269 3.030 . 0 0 "[ . 1 . 2]" 1
294 1 32 ASN HA 1 33 PRO HD2 . . 3.480 2.111 2.036 2.198 . 0 0 "[ . 1 . 2]" 1
295 1 32 ASN HA 1 33 PRO HD3 . . 3.570 2.959 2.851 3.072 . 0 0 "[ . 1 . 2]" 1
296 1 32 ASN HA 1 33 PRO HG2 . . 4.930 4.233 4.183 4.293 . 0 0 "[ . 1 . 2]" 1
297 1 32 ASN HA 1 33 PRO QG . . 4.050 3.941 3.885 4.005 . 0 0 "[ . 1 . 2]" 1
298 1 32 ASN HA 1 33 PRO HG3 . . 4.930 4.699 4.612 4.794 . 0 0 "[ . 1 . 2]" 1
299 1 32 ASN HA 1 34 LEU H . . 4.680 3.109 3.046 3.234 . 0 0 "[ . 1 . 2]" 1
300 1 32 ASN HA 1 34 LEU HB2 . . 5.500 4.204 3.909 4.752 . 0 0 "[ . 1 . 2]" 1
301 1 32 ASN HA 1 34 LEU QB . . 4.740 3.940 3.825 4.017 . 0 0 "[ . 1 . 2]" 1
302 1 32 ASN HA 1 34 LEU HB3 . . 5.500 5.094 4.239 5.788 0.288 5 0 "[ . 1 . 2]" 1
303 1 32 ASN HA 1 34 LEU MD1 . . 5.500 5.020 4.295 5.561 0.061 20 0 "[ . 1 . 2]" 1
304 1 32 ASN HA 1 34 LEU MD2 . . 5.500 5.473 5.276 5.563 0.063 5 0 "[ . 1 . 2]" 1
305 1 32 ASN HA 1 35 SER H . . 4.690 4.643 4.419 4.743 0.053 10 0 "[ . 1 . 2]" 1
306 1 32 ASN QB 1 33 PRO HD2 . . 4.240 4.135 3.867 4.230 . 0 0 "[ . 1 . 2]" 1
307 1 32 ASN QB 1 35 SER H . . 4.590 3.906 3.304 4.312 . 0 0 "[ . 1 . 2]" 1
308 1 32 ASN QB 1 35 SER QB . . 3.980 3.641 3.294 3.918 . 0 0 "[ . 1 . 2]" 1
309 1 32 ASN HB2 1 33 PRO HD2 . . 4.880 4.603 4.406 4.700 . 0 0 "[ . 1 . 2]" 1
310 1 32 ASN HB2 1 33 PRO HD3 . . 5.140 4.967 4.894 5.054 . 0 0 "[ . 1 . 2]" 1
311 1 32 ASN HB3 1 33 PRO HD2 . . 4.880 4.687 4.280 4.837 . 0 0 "[ . 1 . 2]" 1
312 1 32 ASN HB3 1 33 PRO HD3 . . 5.140 4.959 4.893 5.027 . 0 0 "[ . 1 . 2]" 1
313 1 32 ASN QD 1 35 SER H . . 3.860 3.145 2.086 3.907 0.047 5 0 "[ . 1 . 2]" 1
314 1 32 ASN QD 1 35 SER QB . . 3.880 2.688 1.909 3.301 . 0 0 "[ . 1 . 2]" 1
315 1 33 PRO HD2 1 34 LEU H . . 4.360 2.799 2.686 2.865 . 0 0 "[ . 1 . 2]" 1
316 1 33 PRO HD2 1 122 VAL QG . . 5.440 4.796 4.003 5.446 0.006 9 0 "[ . 1 . 2]" 1
317 1 33 PRO HD3 1 34 LEU H . . 4.460 3.923 3.863 3.959 . 0 0 "[ . 1 . 2]" 1
318 1 33 PRO HD3 1 122 VAL QG . . 5.180 4.661 3.884 5.178 . 0 0 "[ . 1 . 2]" 1
319 1 34 LEU H 1 34 LEU HB2 . . 3.790 2.224 2.042 2.609 . 0 0 "[ . 1 . 2]" 1
320 1 34 LEU H 1 34 LEU QB . . 3.310 2.126 2.023 2.261 . 0 0 "[ . 1 . 2]" 1
321 1 34 LEU H 1 34 LEU HB3 . . 3.790 3.048 2.404 3.546 . 0 0 "[ . 1 . 2]" 1
322 1 34 LEU H 1 34 LEU QD . . 5.210 3.186 2.526 3.645 . 0 0 "[ . 1 . 2]" 1
323 1 34 LEU H 1 34 LEU HG . . 4.860 4.136 2.641 4.538 . 0 0 "[ . 1 . 2]" 1
324 1 34 LEU H 1 35 SER H . . 3.480 2.656 2.548 2.815 . 0 0 "[ . 1 . 2]" 1
325 1 34 LEU HA 1 34 LEU MD1 . . 4.410 2.843 2.260 3.811 . 0 0 "[ . 1 . 2]" 1
326 1 34 LEU HA 1 34 LEU QD . . 3.770 2.480 2.071 3.155 . 0 0 "[ . 1 . 2]" 1
327 1 34 LEU HA 1 34 LEU MD2 . . 4.410 3.466 2.080 3.823 . 0 0 "[ . 1 . 2]" 1
328 1 34 LEU HA 1 34 LEU HG . . 3.200 2.595 2.352 2.999 . 0 0 "[ . 1 . 2]" 1
329 1 34 LEU QB 1 35 SER H . . 3.670 2.914 2.587 3.097 . 0 0 "[ . 1 . 2]" 1
330 1 34 LEU HB2 1 35 SER H . . 4.270 3.574 2.983 4.199 . 0 0 "[ . 1 . 2]" 1
331 1 34 LEU HB3 1 35 SER H . . 4.270 3.197 2.669 3.897 . 0 0 "[ . 1 . 2]" 1
332 1 34 LEU MD1 1 35 SER H . . 5.500 4.803 4.526 5.116 . 0 0 "[ . 1 . 2]" 1
333 1 34 LEU MD2 1 35 SER H . . 5.500 4.520 3.162 5.076 . 0 0 "[ . 1 . 2]" 1
334 1 34 LEU HG 1 35 SER H . . 5.500 4.827 4.500 5.196 . 0 0 "[ . 1 . 2]" 1
335 1 35 SER H 1 35 SER HB2 . . 3.560 2.686 2.186 3.554 . 0 0 "[ . 1 . 2]" 1
336 1 35 SER H 1 35 SER QB . . 2.980 2.239 2.133 2.357 . 0 0 "[ . 1 . 2]" 1
337 1 35 SER H 1 35 SER HB3 . . 3.560 2.549 2.224 2.970 . 0 0 "[ . 1 . 2]" 1
338 1 35 SER QB 1 36 ASP H . . 4.140 3.018 2.159 3.934 . 0 0 "[ . 1 . 2]" 1
339 1 38 ASP H 1 38 ASP HB2 . . 3.800 2.681 2.266 3.647 . 0 0 "[ . 1 . 2]" 1
340 1 38 ASP H 1 38 ASP QB . . 3.280 2.478 2.241 2.854 . 0 0 "[ . 1 . 2]" 1
341 1 38 ASP H 1 38 ASP HB3 . . 3.800 3.429 2.783 3.668 . 0 0 "[ . 1 . 2]" 1
342 1 39 TRP HD1 1 40 SER H . . 3.790 2.404 1.979 2.732 . 0 0 "[ . 1 . 2]" 1
343 1 39 TRP HD1 1 40 SER HA . . 4.230 3.690 3.326 4.119 . 0 0 "[ . 1 . 2]" 1
344 1 39 TRP HD1 1 40 SER HB2 . . 4.840 4.734 4.467 4.856 0.016 4 0 "[ . 1 . 2]" 1
345 1 39 TRP HD1 1 40 SER HB3 . . 5.280 4.830 4.638 5.287 0.007 4 0 "[ . 1 . 2]" 1
346 1 39 TRP HD1 1 41 ARG H . . 4.550 4.154 3.227 4.585 0.035 7 0 "[ . 1 . 2]" 1
347 1 39 TRP HD1 1 41 ARG HA . . 4.970 3.698 3.120 4.420 . 0 0 "[ . 1 . 2]" 1
348 1 39 TRP HD1 1 41 ARG QD . . 5.340 4.585 3.235 5.383 0.043 1 0 "[ . 1 . 2]" 1
349 1 40 SER H 1 40 SER HB2 . . 3.590 2.629 2.475 2.716 . 0 0 "[ . 1 . 2]" 1
350 1 40 SER H 1 40 SER HB3 . . 3.580 3.359 3.198 3.551 . 0 0 "[ . 1 . 2]" 1
351 1 40 SER H 1 41 ARG H . . 5.350 4.324 3.757 4.468 . 0 0 "[ . 1 . 2]" 1
352 1 40 SER HA 1 41 ARG H . . 3.150 2.215 2.138 2.249 . 0 0 "[ . 1 . 2]" 1
353 1 40 SER HA 1 41 ARG QD . . 4.390 3.447 3.097 4.393 0.003 16 0 "[ . 1 . 2]" 1
354 1 40 SER HB2 1 41 ARG H . . 4.660 4.357 4.256 4.654 . 0 0 "[ . 1 . 2]" 1
355 1 40 SER HB2 1 42 LEU QD . . 4.560 4.484 4.302 4.578 0.018 3 0 "[ . 1 . 2]" 1
356 1 40 SER HB3 1 41 ARG H . . 4.120 3.418 3.147 4.057 . 0 0 "[ . 1 . 2]" 1
357 1 40 SER HB3 1 41 ARG HA . . 4.980 4.534 4.390 4.882 . 0 0 "[ . 1 . 2]" 1
358 1 40 SER HB3 1 42 LEU HA . . 5.500 5.273 4.969 5.487 . 0 0 "[ . 1 . 2]" 1
359 1 40 SER HB3 1 42 LEU QD . . 3.690 3.248 3.054 3.521 . 0 0 "[ . 1 . 2]" 1
360 1 41 ARG H 1 41 ARG HB2 . . 3.840 3.302 2.203 3.711 . 0 0 "[ . 1 . 2]" 1
361 1 41 ARG H 1 41 ARG QB . . 3.350 2.542 2.180 2.825 . 0 0 "[ . 1 . 2]" 1
362 1 41 ARG H 1 41 ARG HB3 . . 3.840 2.913 2.321 3.493 . 0 0 "[ . 1 . 2]" 1
363 1 41 ARG H 1 41 ARG QD . . 4.070 2.278 1.851 3.518 . 0 0 "[ . 1 . 2]" 1
364 1 41 ARG H 1 41 ARG HG2 . . 4.910 3.237 2.327 4.685 . 0 0 "[ . 1 . 2]" 1
365 1 41 ARG H 1 41 ARG QG . . 4.100 2.937 2.303 3.724 . 0 0 "[ . 1 . 2]" 1
366 1 41 ARG H 1 41 ARG HG3 . . 4.910 3.816 3.660 3.963 . 0 0 "[ . 1 . 2]" 1
367 1 41 ARG H 1 42 LEU H . . 4.570 4.533 4.423 4.605 0.035 4 0 "[ . 1 . 2]" 1
368 1 41 ARG HA 1 42 LEU HG . . 4.280 3.617 3.476 3.909 . 0 0 "[ . 1 . 2]" 1
369 1 41 ARG HA 1 43 ALA H . . 4.620 4.505 4.317 4.629 0.009 15 0 "[ . 1 . 2]" 1
370 1 41 ARG QB 1 41 ARG QD . . 3.270 2.147 1.957 2.784 . 0 0 "[ . 1 . 2]" 1
371 1 41 ARG QG 1 42 LEU H . . 4.440 3.751 3.421 4.156 . 0 0 "[ . 1 . 2]" 1
372 1 41 ARG HG2 1 43 ALA H . . 5.500 5.248 4.364 5.542 0.042 19 0 "[ . 1 . 2]" 1
373 1 41 ARG HG3 1 43 ALA H . . 5.500 5.474 5.219 5.526 0.026 3 0 "[ . 1 . 2]" 1
374 1 42 LEU H 1 42 LEU HB2 . . 4.170 2.679 2.513 2.784 . 0 0 "[ . 1 . 2]" 1
375 1 42 LEU H 1 42 LEU HG . . 4.270 2.323 2.027 2.478 . 0 0 "[ . 1 . 2]" 1
376 1 42 LEU H 1 43 ALA H . . 3.570 2.500 2.361 2.719 . 0 0 "[ . 1 . 2]" 1
377 1 42 LEU H 1 43 ALA MB . . 4.840 4.735 4.625 4.868 0.028 7 0 "[ . 1 . 2]" 1
378 1 42 LEU HA 1 43 ALA MB . . 4.190 4.097 4.011 4.181 . 0 0 "[ . 1 . 2]" 1
379 1 42 LEU HA 1 95 GLY QA . . 4.610 3.823 2.884 4.586 . 0 0 "[ . 1 . 2]" 1
380 1 42 LEU HB2 1 43 ALA H . . 3.810 2.121 2.054 2.302 . 0 0 "[ . 1 . 2]" 1
381 1 42 LEU HB2 1 43 ALA HA . . 4.850 4.594 4.533 4.677 . 0 0 "[ . 1 . 2]" 1
382 1 42 LEU HB3 1 43 ALA H . . 3.930 3.459 3.274 3.675 . 0 0 "[ . 1 . 2]" 1
383 1 42 LEU HG 1 43 ALA H . . 4.090 3.781 3.619 4.050 . 0 0 "[ . 1 . 2]" 1
384 1 43 ALA H 1 43 ALA MB . . 3.410 2.895 2.875 2.916 . 0 0 "[ . 1 . 2]" 1
385 1 43 ALA H 1 44 LYS H . . 5.150 4.356 4.343 4.362 . 0 0 "[ . 1 . 2]" 1
386 1 43 ALA HA 1 44 LYS H . . 3.430 2.639 2.532 2.718 . 0 0 "[ . 1 . 2]" 1
387 1 43 ALA HA 1 44 LYS HA . . 4.580 4.354 4.327 4.392 . 0 0 "[ . 1 . 2]" 1
388 1 43 ALA MB 1 44 LYS H . . 3.370 2.074 1.919 2.270 . 0 0 "[ . 1 . 2]" 1
389 1 43 ALA MB 1 44 LYS HA . . 4.250 4.098 4.018 4.172 . 0 0 "[ . 1 . 2]" 1
390 1 43 ALA MB 1 95 GLY HA2 . . 4.800 4.298 3.690 4.806 0.006 12 0 "[ . 1 . 2]" 1
391 1 43 ALA MB 1 95 GLY QA . . 4.120 3.082 2.625 3.623 . 0 0 "[ . 1 . 2]" 1
392 1 43 ALA MB 1 95 GLY HA3 . . 4.800 3.161 2.687 3.760 . 0 0 "[ . 1 . 2]" 1
393 1 44 LYS H 1 44 LYS QB . . 3.680 2.727 2.583 2.918 . 0 0 "[ . 1 . 2]" 1
394 1 44 LYS H 1 44 LYS QD . . 4.360 3.846 3.194 4.086 . 0 0 "[ . 1 . 2]" 1
395 1 44 LYS H 1 44 LYS QG . . 4.030 1.956 1.911 2.102 . 0 0 "[ . 1 . 2]" 1
396 1 44 LYS H 1 45 VAL QG . . 5.440 5.152 4.392 5.449 0.009 2 0 "[ . 1 . 2]" 1
397 1 44 LYS H 1 87 LEU HA . . 5.500 5.282 4.914 5.514 0.014 4 0 "[ . 1 . 2]" 1
398 1 44 LYS H 1 87 LEU QD . . 5.140 3.763 3.418 4.256 . 0 0 "[ . 1 . 2]" 1
399 1 44 LYS H 1 88 ALA H . . 4.260 4.070 3.649 4.272 0.012 13 0 "[ . 1 . 2]" 1
400 1 44 LYS HA 1 44 LYS QE . . 4.490 4.348 3.964 4.489 . 0 0 "[ . 1 . 2]" 1
401 1 44 LYS HA 1 45 VAL H . . 3.450 2.155 2.141 2.179 . 0 0 "[ . 1 . 2]" 1
402 1 44 LYS HA 1 45 VAL HA . . 5.500 4.380 4.359 4.398 . 0 0 "[ . 1 . 2]" 1
403 1 44 LYS HA 1 45 VAL QG . . 4.520 3.569 3.310 3.667 . 0 0 "[ . 1 . 2]" 1
404 1 44 LYS QB 1 44 LYS QE . . 3.260 2.094 1.974 2.292 . 0 0 "[ . 1 . 2]" 1
405 1 44 LYS QB 1 45 VAL H . . 3.760 3.185 3.029 3.382 . 0 0 "[ . 1 . 2]" 1
406 1 44 LYS HD2 1 90 MET HG3 . . 5.500 3.938 2.534 5.148 . 0 0 "[ . 1 . 2]" 1
407 1 44 LYS HD3 1 90 MET HG3 . . 5.500 3.987 2.944 5.356 . 0 0 "[ . 1 . 2]" 1
408 1 44 LYS QE 1 44 LYS QG . . 2.800 2.311 2.201 2.755 . 0 0 "[ . 1 . 2]" 1
409 1 44 LYS QG 1 45 VAL H . . 5.240 4.171 3.989 4.382 . 0 0 "[ . 1 . 2]" 1
410 1 44 LYS QG 1 88 ALA H . . 3.760 2.953 2.585 3.364 . 0 0 "[ . 1 . 2]" 1
411 1 44 LYS QG 1 89 TRP H . . 5.340 5.050 4.625 5.351 0.011 8 0 "[ . 1 . 2]" 1
412 1 45 VAL H 1 45 VAL HB . . 4.010 2.875 2.608 3.689 . 0 0 "[ . 1 . 2]" 1
413 1 45 VAL H 1 45 VAL MG1 . . 4.640 2.653 1.918 3.796 . 0 0 "[ . 1 . 2]" 1
414 1 45 VAL H 1 45 VAL QG . . 3.380 2.073 1.872 2.278 . 0 0 "[ . 1 . 2]" 1
415 1 45 VAL H 1 45 VAL MG2 . . 4.640 3.160 1.918 3.798 . 0 0 "[ . 1 . 2]" 1
416 1 45 VAL H 1 46 LYS H . . 4.810 4.419 4.276 4.572 . 0 0 "[ . 1 . 2]" 1
417 1 45 VAL HA 1 46 LYS H . . 3.420 2.170 2.139 2.211 . 0 0 "[ . 1 . 2]" 1
418 1 45 VAL HA 1 87 LEU QD . . 3.650 2.185 1.906 2.589 . 0 0 "[ . 1 . 2]" 1
419 1 45 VAL HA 1 87 LEU HG . . 5.500 4.993 3.957 5.514 0.014 18 0 "[ . 1 . 2]" 1
420 1 45 VAL HA 1 88 ALA H . . 4.760 4.370 3.611 4.779 0.019 19 0 "[ . 1 . 2]" 1
421 1 45 VAL QG 1 46 LYS H . . 3.610 2.674 2.038 3.450 . 0 0 "[ . 1 . 2]" 1
422 1 45 VAL QG 1 47 ASP H . . 3.690 2.628 2.082 3.536 . 0 0 "[ . 1 . 2]" 1
423 1 45 VAL QG 1 47 ASP HA . . 3.950 3.548 3.191 3.882 . 0 0 "[ . 1 . 2]" 1
424 1 45 VAL QG 1 48 LEU H . . 4.720 4.170 3.716 4.704 . 0 0 "[ . 1 . 2]" 1
425 1 45 VAL QG 1 85 PHE HA . . 4.320 3.848 3.491 4.337 0.017 3 0 "[ . 1 . 2]" 1
426 1 45 VAL QG 1 85 PHE HB2 . . 4.320 2.401 2.063 3.031 . 0 0 "[ . 1 . 2]" 1
427 1 45 VAL QG 1 86 THR H . . 3.910 3.330 3.064 3.930 0.020 3 0 "[ . 1 . 2]" 1
428 1 45 VAL QG 1 113 ILE HB . . 4.850 4.488 4.086 4.852 0.002 7 0 "[ . 1 . 2]" 1
429 1 45 VAL QG 1 113 ILE MG . . 3.430 2.273 1.973 2.532 . 0 0 "[ . 1 . 2]" 1
430 1 45 VAL QG 1 114 ARG H . . 5.120 4.473 3.873 5.102 . 0 0 "[ . 1 . 2]" 1
431 1 45 VAL MG1 1 113 ILE MG . . 4.190 2.717 2.021 3.759 . 0 0 "[ . 1 . 2]" 1
432 1 45 VAL MG2 1 113 ILE MG . . 4.190 2.861 2.176 3.684 . 0 0 "[ . 1 . 2]" 1
433 1 46 LYS H 1 46 LYS HB2 . . 3.690 2.290 2.131 2.664 . 0 0 "[ . 1 . 2]" 1
434 1 46 LYS H 1 46 LYS QB . . 3.240 2.225 2.090 2.481 . 0 0 "[ . 1 . 2]" 1
435 1 46 LYS H 1 46 LYS HB3 . . 3.690 3.261 2.389 3.682 . 0 0 "[ . 1 . 2]" 1
436 1 46 LYS H 1 46 LYS QG . . 4.420 3.318 2.496 4.107 . 0 0 "[ . 1 . 2]" 1
437 1 46 LYS H 1 47 ASP H . . 3.560 2.555 2.049 2.785 . 0 0 "[ . 1 . 2]" 1
438 1 46 LYS H 1 86 THR HB . . 4.150 3.395 2.836 4.064 . 0 0 "[ . 1 . 2]" 1
439 1 46 LYS H 1 86 THR MG . . 4.780 3.764 3.322 4.783 0.003 20 0 "[ . 1 . 2]" 1
440 1 46 LYS H 1 87 LEU HA . . 4.240 3.014 2.497 3.600 . 0 0 "[ . 1 . 2]" 1
441 1 46 LYS H 1 87 LEU QD . . 3.990 3.313 2.860 3.924 . 0 0 "[ . 1 . 2]" 1
442 1 46 LYS H 1 88 ALA H . . 4.850 4.543 3.906 4.866 0.016 2 0 "[ . 1 . 2]" 1
443 1 46 LYS HA 1 46 LYS HE2 . . 5.500 4.407 3.530 5.458 . 0 0 "[ . 1 . 2]" 1
444 1 46 LYS HA 1 46 LYS QE . . 4.820 3.784 3.297 4.503 . 0 0 "[ . 1 . 2]" 1
445 1 46 LYS HA 1 46 LYS HE3 . . 5.500 4.359 3.492 5.379 . 0 0 "[ . 1 . 2]" 1
446 1 46 LYS HA 1 46 LYS QG . . 3.690 2.352 2.084 2.883 . 0 0 "[ . 1 . 2]" 1
447 1 46 LYS QB 1 86 THR H . . 4.790 4.097 3.791 4.641 . 0 0 "[ . 1 . 2]" 1
448 1 46 LYS QB 1 86 THR HB . . 3.920 2.146 1.919 2.902 . 0 0 "[ . 1 . 2]" 1
449 1 46 LYS HB2 1 47 ASP H . . 4.000 2.987 2.354 3.840 . 0 0 "[ . 1 . 2]" 1
450 1 46 LYS HB2 1 86 THR HB . . 4.660 2.593 1.995 3.920 . 0 0 "[ . 1 . 2]" 1
451 1 46 LYS HB2 1 86 THR MG . . 4.200 2.570 2.019 3.845 . 0 0 "[ . 1 . 2]" 1
452 1 46 LYS HB3 1 47 ASP H . . 4.000 2.924 2.356 3.898 . 0 0 "[ . 1 . 2]" 1
453 1 46 LYS HB3 1 86 THR HB . . 4.660 2.746 1.987 4.357 . 0 0 "[ . 1 . 2]" 1
454 1 46 LYS HB3 1 86 THR MG . . 4.200 3.111 2.172 4.191 . 0 0 "[ . 1 . 2]" 1
455 1 46 LYS QG 1 47 ASP H . . 4.850 4.141 3.140 4.576 . 0 0 "[ . 1 . 2]" 1
456 1 47 ASP H 1 48 LEU H . . 4.460 4.400 4.262 4.442 . 0 0 "[ . 1 . 2]" 1
457 1 47 ASP H 1 86 THR H . . 3.930 2.710 2.279 3.171 . 0 0 "[ . 1 . 2]" 1
458 1 47 ASP H 1 86 THR HB . . 3.950 2.404 1.955 2.801 . 0 0 "[ . 1 . 2]" 1
459 1 47 ASP H 1 86 THR MG . . 5.120 3.921 3.339 4.364 . 0 0 "[ . 1 . 2]" 1
460 1 47 ASP H 1 87 LEU QD . . 5.350 4.462 4.030 5.065 . 0 0 "[ . 1 . 2]" 1
461 1 47 ASP QB 1 48 LEU H . . 3.550 3.064 2.658 3.345 . 0 0 "[ . 1 . 2]" 1
462 1 47 ASP QB 1 86 THR H . . 4.430 3.132 1.900 4.294 . 0 0 "[ . 1 . 2]" 1
463 1 47 ASP QB 1 86 THR MG . . 4.770 4.095 3.353 4.707 . 0 0 "[ . 1 . 2]" 1
464 1 47 ASP HB2 1 86 THR HB . . 4.170 3.498 2.050 4.241 0.071 11 0 "[ . 1 . 2]" 1
465 1 47 ASP HB3 1 86 THR HB . . 4.170 3.571 2.713 4.229 0.059 11 0 "[ . 1 . 2]" 1
466 1 48 LEU H 1 48 LEU HB2 . . 3.520 3.291 3.042 3.898 0.378 13 0 "[ . 1 . 2]" 1
467 1 48 LEU H 1 48 LEU HB3 . . 3.520 2.823 2.565 3.066 . 0 0 "[ . 1 . 2]" 1
468 1 48 LEU H 1 48 LEU MD1 . . 5.410 4.186 1.839 4.808 . 0 0 "[ . 1 . 2]" 1
469 1 48 LEU H 1 48 LEU MD2 . . 5.410 4.316 3.574 4.672 . 0 0 "[ . 1 . 2]" 1
470 1 48 LEU H 1 49 THR H . . 4.310 4.169 3.860 4.412 0.102 13 0 "[ . 1 . 2]" 1
471 1 48 LEU HA 1 49 THR H . . 3.080 2.167 2.137 2.301 . 0 0 "[ . 1 . 2]" 1
472 1 48 LEU HA 1 85 PHE H . . 5.170 5.005 4.607 5.154 . 0 0 "[ . 1 . 2]" 1
473 1 48 LEU HA 1 85 PHE HA . . 4.210 2.539 2.038 2.728 . 0 0 "[ . 1 . 2]" 1
474 1 48 LEU HA 1 86 THR H . . 4.130 3.874 3.062 4.140 0.010 2 0 "[ . 1 . 2]" 1
475 1 48 LEU QB 1 49 THR H . . 4.010 3.702 2.726 3.916 . 0 0 "[ . 1 . 2]" 1
476 1 48 LEU QB 1 83 THR MG . . 5.140 4.692 3.289 5.146 0.006 8 0 "[ . 1 . 2]" 1
477 1 48 LEU QB 1 85 PHE HA . . 4.420 4.221 2.046 4.519 0.099 18 0 "[ . 1 . 2]" 1
478 1 48 LEU QB 1 85 PHE QD . . 5.340 4.991 3.379 5.366 0.026 5 0 "[ . 1 . 2]" 1
479 1 48 LEU HB2 1 49 THR H . . 4.610 4.161 2.770 4.549 . 0 0 "[ . 1 . 2]" 1
480 1 48 LEU HB3 1 49 THR H . . 4.610 4.200 4.061 4.405 . 0 0 "[ . 1 . 2]" 1
481 1 48 LEU QD 1 49 THR H . . 3.780 2.287 1.947 3.117 . 0 0 "[ . 1 . 2]" 1
482 1 48 LEU QD 1 49 THR HA . . 4.370 3.603 2.980 4.358 . 0 0 "[ . 1 . 2]" 1
483 1 48 LEU QD 1 50 PRO HA . . 4.240 3.224 2.729 3.858 . 0 0 "[ . 1 . 2]" 1
484 1 48 LEU QD 1 51 GLY H . . 5.300 4.512 3.575 5.261 . 0 0 "[ . 1 . 2]" 1
485 1 48 LEU QD 1 85 PHE H . . 4.670 4.505 4.263 4.887 0.217 13 0 "[ . 1 . 2]" 1
486 1 48 LEU QD 1 85 PHE HA . . 4.480 3.391 2.907 3.950 . 0 0 "[ . 1 . 2]" 1
487 1 48 LEU MD1 1 49 THR HA . . 5.300 3.876 3.224 5.420 0.120 10 0 "[ . 1 . 2]" 1
488 1 48 LEU MD2 1 49 THR HA . . 5.300 4.736 3.063 5.309 0.009 9 0 "[ . 1 . 2]" 1
489 1 49 THR H 1 49 THR HB . . 3.570 2.603 2.519 2.769 . 0 0 "[ . 1 . 2]" 1
490 1 49 THR H 1 49 THR MG . . 3.990 3.678 2.151 3.896 . 0 0 "[ . 1 . 2]" 1
491 1 49 THR H 1 50 PRO HA . . 5.410 4.900 4.564 5.436 0.026 13 0 "[ . 1 . 2]" 1
492 1 49 THR H 1 83 THR MG . . 4.320 3.596 3.089 4.325 0.005 11 0 "[ . 1 . 2]" 1
493 1 49 THR H 1 84 SER H . . 4.070 3.690 3.192 4.074 0.004 11 0 "[ . 1 . 2]" 1
494 1 49 THR H 1 84 SER QB . . 4.090 3.950 3.481 4.105 0.015 9 0 "[ . 1 . 2]" 1
495 1 49 THR H 1 85 PHE H . . 5.120 4.808 4.617 4.956 . 0 0 "[ . 1 . 2]" 1
496 1 49 THR H 1 85 PHE HA . . 4.190 3.265 2.874 3.462 . 0 0 "[ . 1 . 2]" 1
497 1 49 THR H 1 86 THR H . . 5.300 5.150 4.579 5.334 0.034 5 0 "[ . 1 . 2]" 1
498 1 49 THR HA 1 50 PRO QB . . 5.040 4.663 4.538 4.681 . 0 0 "[ . 1 . 2]" 1
499 1 49 THR HA 1 50 PRO QD . . 3.480 1.896 1.863 1.987 . 0 0 "[ . 1 . 2]" 1
500 1 49 THR HB 1 84 SER H . . 4.230 3.181 2.245 4.315 0.085 13 0 "[ . 1 . 2]" 1
501 1 49 THR HB 1 84 SER QB . . 3.400 2.434 1.991 3.412 0.012 10 0 "[ . 1 . 2]" 1
502 1 49 THR MG 1 51 GLY H . . 4.520 3.715 3.120 4.331 . 0 0 "[ . 1 . 2]" 1
503 1 49 THR MG 1 51 GLY QA . . 4.410 3.409 3.069 3.747 . 0 0 "[ . 1 . 2]" 1
504 1 49 THR MG 1 84 SER H . . 4.470 3.574 1.847 4.188 . 0 0 "[ . 1 . 2]" 1
505 1 49 THR MG 1 84 SER HA . . 5.500 5.309 3.869 5.529 0.029 18 0 "[ . 1 . 2]" 1
506 1 49 THR MG 1 84 SER HB2 . . 4.430 4.033 3.222 4.444 0.014 14 0 "[ . 1 . 2]" 1
507 1 49 THR MG 1 84 SER QB . . 3.820 2.945 1.872 3.729 . 0 0 "[ . 1 . 2]" 1
508 1 49 THR MG 1 84 SER HB3 . . 4.430 3.110 1.882 4.433 0.003 4 0 "[ . 1 . 2]" 1
509 1 50 PRO HA 1 51 GLY H . . 2.890 2.306 2.162 2.439 . 0 0 "[ . 1 . 2]" 1
510 1 50 PRO HA 1 83 THR MG . . 3.420 2.918 2.265 3.455 0.035 10 0 "[ . 1 . 2]" 1
511 1 50 PRO QB 1 51 GLY H . . 3.970 3.779 3.511 3.924 . 0 0 "[ . 1 . 2]" 1
512 1 50 PRO QB 1 83 THR MG . . 4.820 4.127 3.216 4.824 0.004 10 0 "[ . 1 . 2]" 1
513 1 50 PRO HB2 1 51 GLY H . . 4.590 4.102 3.778 4.274 . 0 0 "[ . 1 . 2]" 1
514 1 50 PRO HB2 1 83 THR MG . . 5.500 5.116 4.275 5.468 . 0 0 "[ . 1 . 2]" 1
515 1 50 PRO HB3 1 51 GLY H . . 4.590 4.426 4.172 4.569 . 0 0 "[ . 1 . 2]" 1
516 1 50 PRO HB3 1 83 THR MG . . 5.500 4.369 3.325 5.365 . 0 0 "[ . 1 . 2]" 1
517 1 51 GLY H 1 83 THR HA . . 3.460 3.253 2.600 3.480 0.020 2 0 "[ . 1 . 2]" 1
518 1 51 GLY H 1 83 THR MG . . 4.100 3.170 1.905 4.041 . 0 0 "[ . 1 . 2]" 1
519 1 51 GLY H 1 84 SER H . . 4.680 3.995 3.255 4.526 . 0 0 "[ . 1 . 2]" 1
520 1 51 GLY QA 1 52 GLU H . . 2.820 2.227 2.111 2.488 . 0 0 "[ . 1 . 2]" 1
521 1 51 GLY HA2 1 52 GLU H . . 3.560 2.348 2.139 3.021 . 0 0 "[ . 1 . 2]" 1
522 1 51 GLY HA3 1 52 GLU H . . 3.560 3.054 2.207 3.569 0.009 14 0 "[ . 1 . 2]" 1
523 1 52 GLU H 1 52 GLU QB . . 3.190 2.693 2.066 3.192 0.002 10 0 "[ . 1 . 2]" 1
524 1 52 GLU H 1 52 GLU QG . . 3.110 2.479 1.936 3.226 0.116 8 0 "[ . 1 . 2]" 1
525 1 52 GLU HA 1 52 GLU HB2 . . 2.910 2.553 2.369 2.938 0.028 12 0 "[ . 1 . 2]" 1
526 1 52 GLU HA 1 52 GLU QB . . 2.510 2.267 2.175 2.538 0.028 14 0 "[ . 1 . 2]" 1
527 1 52 GLU HA 1 52 GLU HB3 . . 2.910 2.542 2.393 2.822 . 0 0 "[ . 1 . 2]" 1
528 1 52 GLU HA 1 53 LEU H . . 2.660 2.433 2.139 2.656 . 0 0 "[ . 1 . 2]" 1
529 1 52 GLU HA 1 53 LEU QB . . 4.610 4.311 4.188 4.523 . 0 0 "[ . 1 . 2]" 1
530 1 52 GLU HA 1 53 LEU QD . . 4.440 3.176 2.717 3.746 . 0 0 "[ . 1 . 2]" 1
531 1 52 GLU HA 1 53 LEU HG . . 5.500 4.958 4.417 5.508 0.008 20 0 "[ . 1 . 2]" 1
532 1 52 GLU QB 1 53 LEU H . . 3.530 2.507 1.961 3.537 0.007 12 0 "[ . 1 . 2]" 1
533 1 52 GLU QB 1 54 THR H . . 4.500 2.690 2.489 2.915 . 0 0 "[ . 1 . 2]" 1
534 1 52 GLU QG 1 53 LEU H . . 4.290 3.425 2.812 4.166 . 0 0 "[ . 1 . 2]" 1
535 1 52 GLU QG 1 53 LEU QD . . 4.850 4.295 3.683 4.695 . 0 0 "[ . 1 . 2]" 1
536 1 52 GLU QG 1 54 THR HA . . 4.490 3.835 2.997 4.574 0.084 14 0 "[ . 1 . 2]" 1
537 1 52 GLU QG 1 54 THR MG . . 4.210 3.110 1.924 3.847 . 0 0 "[ . 1 . 2]" 1
538 1 52 GLU HG2 1 53 LEU H . . 4.920 4.296 3.860 4.627 . 0 0 "[ . 1 . 2]" 1
539 1 52 GLU HG2 1 54 THR MG . . 4.810 4.154 3.297 4.837 0.027 8 0 "[ . 1 . 2]" 1
540 1 52 GLU HG3 1 53 LEU H . . 4.920 3.693 2.883 4.878 . 0 0 "[ . 1 . 2]" 1
541 1 52 GLU HG3 1 54 THR MG . . 4.810 3.347 1.937 4.801 . 0 0 "[ . 1 . 2]" 1
542 1 53 LEU H 1 53 LEU QB . . 3.320 2.771 2.317 3.072 . 0 0 "[ . 1 . 2]" 1
543 1 53 LEU H 1 53 LEU QD . . 3.720 2.055 1.887 2.233 . 0 0 "[ . 1 . 2]" 1
544 1 53 LEU H 1 53 LEU HG . . 3.760 2.721 2.246 3.540 . 0 0 "[ . 1 . 2]" 1
545 1 53 LEU H 1 54 THR H . . 3.310 2.367 1.901 2.716 . 0 0 "[ . 1 . 2]" 1
546 1 53 LEU H 1 54 THR MG . . 4.610 4.284 3.452 4.620 0.010 4 0 "[ . 1 . 2]" 1
547 1 53 LEU H 1 81 GLY QA . . 4.540 4.174 2.905 4.542 0.002 5 0 "[ . 1 . 2]" 1
548 1 53 LEU HA 1 53 LEU QB . . 2.590 2.163 2.155 2.166 . 0 0 "[ . 1 . 2]" 1
549 1 53 LEU HA 1 53 LEU QD . . 3.640 3.366 3.282 3.430 . 0 0 "[ . 1 . 2]" 1
550 1 53 LEU HA 1 53 LEU HG . . 3.770 3.677 3.655 3.708 . 0 0 "[ . 1 . 2]" 1
551 1 53 LEU HA 1 54 THR MG . . 4.050 3.505 3.242 3.870 . 0 0 "[ . 1 . 2]" 1
552 1 53 LEU HA 1 55 ALA MB . . 5.490 4.560 4.113 4.948 . 0 0 "[ . 1 . 2]" 1
553 1 53 LEU HA 1 80 ALA MB . . 5.500 4.520 2.862 5.432 . 0 0 "[ . 1 . 2]" 1
554 1 53 LEU HA 1 81 GLY QA . . 5.170 4.102 2.733 5.131 . 0 0 "[ . 1 . 2]" 1
555 1 53 LEU QB 1 53 LEU QD . . 2.850 1.780 1.743 1.876 . 0 0 "[ . 1 . 2]" 1
556 1 53 LEU QD 1 54 THR H . . 4.130 3.373 2.373 3.960 . 0 0 "[ . 1 . 2]" 1
557 1 53 LEU QD 1 55 ALA HA . . 5.230 4.128 3.782 4.443 . 0 0 "[ . 1 . 2]" 1
558 1 53 LEU QD 1 57 SER QB . . 3.910 3.091 2.066 3.897 . 0 0 "[ . 1 . 2]" 1
559 1 53 LEU QD 1 81 GLY H . . 4.720 4.456 3.598 4.728 0.008 18 0 "[ . 1 . 2]" 1
560 1 53 LEU HG 1 54 THR H . . 3.840 3.044 2.355 3.759 . 0 0 "[ . 1 . 2]" 1
561 1 53 LEU HG 1 54 THR HA . . 4.840 4.249 3.509 4.844 0.004 6 0 "[ . 1 . 2]" 1
562 1 53 LEU HG 1 55 ALA HA . . 5.500 4.570 3.826 5.427 . 0 0 "[ . 1 . 2]" 1
563 1 53 LEU HG 1 57 SER QB . . 5.200 4.991 4.195 5.206 0.006 18 0 "[ . 1 . 2]" 1
564 1 54 THR H 1 54 THR MG . . 3.460 2.662 2.351 3.156 . 0 0 "[ . 1 . 2]" 1
565 1 54 THR H 1 55 ALA H . . 3.450 2.888 2.798 3.017 . 0 0 "[ . 1 . 2]" 1
566 1 54 THR H 1 55 ALA MB . . 4.700 4.457 4.358 4.615 . 0 0 "[ . 1 . 2]" 1
567 1 54 THR HA 1 54 THR MG . . 3.660 2.667 2.411 3.206 . 0 0 "[ . 1 . 2]" 1
568 1 54 THR HA 1 55 ALA H . . 3.060 2.812 2.713 2.907 . 0 0 "[ . 1 . 2]" 1
569 1 54 THR MG 1 55 ALA H . . 4.340 4.129 3.770 4.316 . 0 0 "[ . 1 . 2]" 1
570 1 55 ALA H 1 55 ALA MB . . 2.870 2.429 2.185 2.731 . 0 0 "[ . 1 . 2]" 1
571 1 55 ALA HA 1 56 GLU H . . 3.020 2.409 2.143 2.690 . 0 0 "[ . 1 . 2]" 1
572 1 55 ALA HA 1 56 GLU HB2 . . 5.390 4.857 4.676 5.135 . 0 0 "[ . 1 . 2]" 1
573 1 55 ALA HA 1 56 GLU QG . . 4.120 3.607 3.310 4.120 . 0 0 "[ . 1 . 2]" 1
574 1 55 ALA MB 1 56 GLU H . . 3.300 2.532 1.925 3.284 . 0 0 "[ . 1 . 2]" 1
575 1 55 ALA MB 1 56 GLU QG . . 4.660 4.184 3.581 4.649 . 0 0 "[ . 1 . 2]" 1
576 1 55 ALA MB 1 57 SER H . . 4.280 2.789 2.282 3.626 . 0 0 "[ . 1 . 2]" 1
577 1 55 ALA MB 1 57 SER QB . . 4.280 3.004 2.639 3.548 . 0 0 "[ . 1 . 2]" 1
578 1 56 GLU H 1 56 GLU HB2 . . 3.170 2.581 2.333 2.697 . 0 0 "[ . 1 . 2]" 1
579 1 56 GLU H 1 56 GLU QG . . 3.500 2.384 1.980 2.663 . 0 0 "[ . 1 . 2]" 1
580 1 56 GLU H 1 57 SER H . . 3.320 2.737 1.947 3.197 . 0 0 "[ . 1 . 2]" 1
581 1 56 GLU H 1 57 SER QB . . 4.880 4.324 4.018 4.852 . 0 0 "[ . 1 . 2]" 1
582 1 56 GLU HA 1 56 GLU HB3 . . 2.680 2.436 2.374 2.576 . 0 0 "[ . 1 . 2]" 1
583 1 56 GLU HA 1 56 GLU QG . . 2.730 2.481 2.301 2.722 . 0 0 "[ . 1 . 2]" 1
584 1 56 GLU HB2 1 57 SER H . . 4.440 3.319 1.981 4.272 . 0 0 "[ . 1 . 2]" 1
585 1 56 GLU HB2 1 57 SER QB . . 5.340 4.983 4.517 5.359 0.019 14 0 "[ . 1 . 2]" 1
586 1 56 GLU HG2 1 57 SER H . . 5.500 4.905 4.513 5.381 . 0 0 "[ . 1 . 2]" 1
587 1 56 GLU HG3 1 57 SER H . . 5.500 4.601 3.917 5.266 . 0 0 "[ . 1 . 2]" 1
588 1 57 SER H 1 57 SER QB . . 3.230 2.540 2.121 2.968 . 0 0 "[ . 1 . 2]" 1
589 1 57 SER HA 1 57 SER QB . . 2.640 2.376 2.213 2.491 . 0 0 "[ . 1 . 2]" 1
590 1 57 SER HA 1 58 TYR H . . 3.240 2.518 2.138 2.964 . 0 0 "[ . 1 . 2]" 1
591 1 57 SER QB 1 58 TYR H . . 3.800 3.731 3.385 3.806 0.006 9 0 "[ . 1 . 2]" 1
592 1 57 SER QB 1 58 TYR QB . . 5.180 4.716 3.893 5.155 . 0 0 "[ . 1 . 2]" 1
593 1 58 TYR H 1 58 TYR HB2 . . 3.390 2.936 2.280 3.277 . 0 0 "[ . 1 . 2]" 1
594 1 58 TYR H 1 58 TYR QB . . 2.880 2.618 2.187 2.881 0.001 1 0 "[ . 1 . 2]" 1
595 1 58 TYR H 1 58 TYR HB3 . . 3.390 2.967 2.560 3.242 . 0 0 "[ . 1 . 2]" 1
596 1 58 TYR HA 1 58 TYR QB . . 2.550 2.448 2.369 2.487 . 0 0 "[ . 1 . 2]" 1
597 1 58 TYR HA 1 58 TYR QE . . 4.480 4.329 4.221 4.476 . 0 0 "[ . 1 . 2]" 1
598 1 58 TYR HA 1 59 ASP H . . 2.650 2.318 2.162 2.492 . 0 0 "[ . 1 . 2]" 1
599 1 58 TYR QB 1 59 ASP H . . 3.740 3.315 2.916 3.689 . 0 0 "[ . 1 . 2]" 1
600 1 58 TYR QD 1 59 ASP H . . 3.410 2.985 2.528 3.366 . 0 0 "[ . 1 . 2]" 1
601 1 58 TYR QE 1 59 ASP H . . 4.520 4.002 3.700 4.317 . 0 0 "[ . 1 . 2]" 1
602 1 59 ASP H 1 59 ASP QB . . 3.640 2.797 2.154 3.398 . 0 0 "[ . 1 . 2]" 1
603 1 59 ASP HA 1 60 ASP H . . 2.650 2.356 2.138 2.650 0.000 1 0 "[ . 1 . 2]" 1
604 1 60 ASP H 1 60 ASP QB . . 3.640 2.815 2.199 3.429 . 0 0 "[ . 1 . 2]" 1
605 1 60 ASP HA 1 60 ASP QB . . 2.630 2.316 2.170 2.513 . 0 0 "[ . 1 . 2]" 1
606 1 60 ASP HA 1 61 SER H . . 3.010 2.283 2.139 2.656 . 0 0 "[ . 1 . 2]" 1
607 1 60 ASP QB 1 61 SER H . . 3.910 3.113 1.999 3.907 . 0 0 "[ . 1 . 2]" 1
608 1 60 ASP QB 1 61 SER HA . . 4.410 4.217 3.808 4.409 . 0 0 "[ . 1 . 2]" 1
609 1 61 SER H 1 61 SER QB . . 3.630 2.719 2.420 3.057 . 0 0 "[ . 1 . 2]" 1
610 1 61 SER H 1 62 TYR H . . 3.060 2.643 1.905 3.043 . 0 0 "[ . 1 . 2]" 1
611 1 61 SER H 1 62 TYR QB . . 4.740 4.141 3.544 4.690 . 0 0 "[ . 1 . 2]" 1
612 1 61 SER H 1 62 TYR QD . . 4.310 3.689 2.752 4.324 0.014 10 0 "[ . 1 . 2]" 1
613 1 62 TYR H 1 62 TYR QB . . 2.920 2.497 2.111 3.101 0.181 14 0 "[ . 1 . 2]" 1
614 1 62 TYR H 1 62 TYR QD . . 3.270 2.386 1.964 2.947 . 0 0 "[ . 1 . 2]" 1
615 1 62 TYR H 1 62 TYR QE . . 4.990 4.318 3.931 5.085 0.095 3 0 "[ . 1 . 2]" 1
616 1 62 TYR HA 1 63 LEU H . . 2.870 2.449 2.139 3.373 0.503 14 1 "[ . 1 +. 2]" 1
617 1 62 TYR QB 1 63 LEU H . . 3.680 2.597 2.006 3.620 . 0 0 "[ . 1 . 2]" 1
618 1 62 TYR QB 1 63 LEU HA . . 4.720 4.176 3.761 4.994 0.274 14 0 "[ . 1 . 2]" 1
619 1 62 TYR QD 1 63 LEU H . . 3.870 3.111 2.243 3.990 0.120 3 0 "[ . 1 . 2]" 1
620 1 62 TYR QD 1 64 ASP H . . 4.870 4.193 2.975 4.901 0.031 8 0 "[ . 1 . 2]" 1
621 1 63 LEU H 1 63 LEU QB . . 3.660 2.878 2.190 3.216 . 0 0 "[ . 1 . 2]" 1
622 1 63 LEU H 1 63 LEU MD1 . . 5.230 4.286 3.832 4.499 . 0 0 "[ . 1 . 2]" 1
623 1 63 LEU H 1 63 LEU QD . . 4.340 3.765 2.301 4.137 . 0 0 "[ . 1 . 2]" 1
624 1 63 LEU H 1 63 LEU MD2 . . 5.230 4.451 2.308 4.955 . 0 0 "[ . 1 . 2]" 1
625 1 63 LEU H 1 64 ASP H . . 3.850 3.421 1.906 3.998 0.148 15 0 "[ . 1 . 2]" 1
626 1 63 LEU HA 1 63 LEU QD . . 2.560 2.389 1.994 3.308 0.748 20 2 "[ . 1 - +]" 1
627 1 63 LEU HA 1 63 LEU HG . . 3.890 3.401 2.720 3.715 . 0 0 "[ . 1 . 2]" 1
628 1 63 LEU HA 1 64 ASP H . . 3.550 2.448 2.138 3.566 0.016 6 0 "[ . 1 . 2]" 1
629 1 63 LEU HA 1 64 ASP HB2 . . 5.500 4.828 4.265 5.623 0.123 19 0 "[ . 1 . 2]" 1
630 1 63 LEU HA 1 64 ASP QB . . 4.780 4.249 4.042 4.860 0.080 16 0 "[ . 1 . 2]" 1
631 1 63 LEU HA 1 64 ASP HB3 . . 5.500 4.841 4.293 5.600 0.100 1 0 "[ . 1 . 2]" 1
632 1 63 LEU QB 1 63 LEU QD . . 2.500 1.921 1.865 1.976 . 0 0 "[ . 1 . 2]" 1
633 1 63 LEU QB 1 63 LEU HG . . 2.370 2.343 2.272 2.507 0.137 4 0 "[ . 1 . 2]" 1
634 1 63 LEU QB 1 64 ASP H . . 4.320 3.580 2.232 4.027 . 0 0 "[ . 1 . 2]" 1
635 1 63 LEU HB2 1 64 ASP H . . 5.100 4.075 2.254 4.635 . 0 0 "[ . 1 . 2]" 1
636 1 63 LEU HB3 1 64 ASP H . . 5.100 4.151 2.411 4.523 . 0 0 "[ . 1 . 2]" 1
637 1 63 LEU QD 1 64 ASP HA . . 4.480 3.986 3.113 4.735 0.255 16 0 "[ . 1 . 2]" 1
638 1 63 LEU QD 1 64 ASP QB . . 4.090 3.897 3.126 4.169 0.079 8 0 "[ . 1 . 2]" 1
639 1 63 LEU HG 1 64 ASP HA . . 5.000 4.194 3.447 5.046 0.046 16 0 "[ . 1 . 2]" 1
640 1 63 LEU HG 1 64 ASP QB . . 4.870 4.513 3.896 4.880 0.010 1 0 "[ . 1 . 2]" 1
641 1 64 ASP H 1 64 ASP QB . . 3.280 2.716 2.122 3.163 . 0 0 "[ . 1 . 2]" 1
642 1 64 ASP HA 1 65 ASP H . . 2.600 2.312 2.138 2.551 . 0 0 "[ . 1 . 2]" 1
643 1 65 ASP H 1 66 GLU H . . 3.870 3.560 2.518 4.268 0.398 15 0 "[ . 1 . 2]" 1
644 1 65 ASP HA 1 66 GLU H . . 2.940 2.392 2.139 2.941 0.001 14 0 "[ . 1 . 2]" 1
645 1 65 ASP HA 1 66 GLU HA . . 5.000 4.454 4.340 4.658 . 0 0 "[ . 1 . 2]" 1
646 1 65 ASP QB 1 66 GLU H . . 4.010 3.724 1.940 4.015 0.005 16 0 "[ . 1 . 2]" 1
647 1 66 GLU H 1 66 GLU QB . . 3.120 2.452 2.178 3.137 0.017 7 0 "[ . 1 . 2]" 1
648 1 66 GLU H 1 66 GLU HG2 . . 4.740 4.007 2.788 4.748 0.008 7 0 "[ . 1 . 2]" 1
649 1 66 GLU H 1 66 GLU QG . . 4.130 3.371 2.513 4.128 . 0 0 "[ . 1 . 2]" 1
650 1 66 GLU H 1 66 GLU HG3 . . 4.740 3.879 2.556 4.741 0.001 1 0 "[ . 1 . 2]" 1
651 1 66 GLU H 1 67 ASP H . . 3.000 2.519 2.023 2.768 . 0 0 "[ . 1 . 2]" 1
652 1 66 GLU HA 1 66 GLU QB . . 2.550 2.461 2.380 2.523 . 0 0 "[ . 1 . 2]" 1
653 1 66 GLU HA 1 66 GLU QG . . 2.820 2.418 2.164 2.754 . 0 0 "[ . 1 . 2]" 1
654 1 66 GLU HA 1 67 ASP HA . . 5.420 4.714 4.395 5.222 . 0 0 "[ . 1 . 2]" 1
655 1 66 GLU HA 1 67 ASP QB . . 5.220 4.707 3.846 5.244 0.024 10 0 "[ . 1 . 2]" 1
656 1 66 GLU QB 1 67 ASP H . . 3.670 3.108 2.185 3.694 0.024 19 0 "[ . 1 . 2]" 1
657 1 67 ASP H 1 68 ALA H . . 3.690 3.196 2.422 4.221 0.531 18 1 "[ . 1 . + 2]" 1
658 1 67 ASP HA 1 68 ALA H . . 2.900 2.563 2.161 2.980 0.080 10 0 "[ . 1 . 2]" 1
659 1 67 ASP HA 1 68 ALA MB . . 4.840 4.275 3.779 4.609 . 0 0 "[ . 1 . 2]" 1
660 1 67 ASP QB 1 68 ALA H . . 4.040 3.741 1.913 4.053 0.013 19 0 "[ . 1 . 2]" 1
661 1 67 ASP QB 1 68 ALA HA . . 5.040 4.474 4.179 5.164 0.124 10 0 "[ . 1 . 2]" 1
662 1 67 ASP HB2 1 68 ALA H . . 4.830 4.195 1.923 4.658 . 0 0 "[ . 1 . 2]" 1
663 1 67 ASP HB3 1 68 ALA H . . 4.830 4.309 3.421 4.636 . 0 0 "[ . 1 . 2]" 1
664 1 68 ALA H 1 68 ALA MB . . 2.940 2.421 2.029 2.884 . 0 0 "[ . 1 . 2]" 1
665 1 68 ALA HA 1 69 ASP H . . 2.710 2.344 2.141 2.898 0.188 18 0 "[ . 1 . 2]" 1
666 1 68 ALA HA 1 69 ASP QB . . 4.410 4.215 3.959 4.466 0.056 10 0 "[ . 1 . 2]" 1
667 1 68 ALA HA 1 70 TRP H . . 4.710 4.169 3.582 4.731 0.021 9 0 "[ . 1 . 2]" 1
668 1 68 ALA MB 1 69 ASP H . . 3.480 2.807 1.954 3.640 0.160 18 0 "[ . 1 . 2]" 1
669 1 68 ALA MB 1 69 ASP HA . . 5.240 4.237 3.960 4.981 . 0 0 "[ . 1 . 2]" 1
670 1 68 ALA MB 1 70 TRP H . . 4.110 3.018 2.211 4.128 0.018 10 0 "[ . 1 . 2]" 1
671 1 68 ALA MB 1 70 TRP HA . . 4.840 4.539 4.056 4.943 0.103 18 0 "[ . 1 . 2]" 1
672 1 69 ASP H 1 69 ASP QB . . 3.470 2.405 2.115 3.359 . 0 0 "[ . 1 . 2]" 1
673 1 69 ASP H 1 70 TRP H . . 3.110 2.543 1.981 3.107 . 0 0 "[ . 1 . 2]" 1
674 1 69 ASP HA 1 70 TRP QB . . 4.870 4.523 3.945 4.836 . 0 0 "[ . 1 . 2]" 1
675 1 69 ASP QB 1 70 TRP H . . 4.220 3.132 1.926 3.914 . 0 0 "[ . 1 . 2]" 1
676 1 69 ASP QB 1 70 TRP QB . . 4.040 3.722 3.190 4.219 0.179 19 0 "[ . 1 . 2]" 1
677 1 70 TRP H 1 70 TRP HA . . 2.880 2.741 2.274 2.941 0.061 18 0 "[ . 1 . 2]" 1
678 1 70 TRP H 1 70 TRP HB2 . . 4.120 3.384 2.881 4.068 . 0 0 "[ . 1 . 2]" 1
679 1 70 TRP H 1 70 TRP QB . . 3.410 3.018 2.612 3.420 0.010 10 0 "[ . 1 . 2]" 1
680 1 70 TRP H 1 70 TRP HB3 . . 4.120 3.477 2.977 4.065 . 0 0 "[ . 1 . 2]" 1
681 1 70 TRP H 1 70 TRP HE3 . . 4.480 4.205 3.247 4.486 0.006 3 0 "[ . 1 . 2]" 1
682 1 70 TRP HA 1 70 TRP HD1 . . 4.640 4.246 3.007 4.478 . 0 0 "[ . 1 . 2]" 1
683 1 70 TRP HA 1 70 TRP HE3 . . 4.340 3.051 2.087 4.364 0.024 10 0 "[ . 1 . 2]" 1
684 1 70 TRP HA 1 71 THR H . . 2.980 2.329 2.141 2.983 0.003 1 0 "[ . 1 . 2]" 1
685 1 70 TRP HA 1 72 ALA H . . 4.280 3.966 3.443 4.213 . 0 0 "[ . 1 . 2]" 1
686 1 70 TRP QB 1 70 TRP HE3 . . 3.460 2.756 2.416 3.017 . 0 0 "[ . 1 . 2]" 1
687 1 70 TRP QB 1 71 THR H . . 4.380 3.434 2.576 3.920 . 0 0 "[ . 1 . 2]" 1
688 1 70 TRP HB2 1 71 THR H . . 5.010 3.982 2.626 4.590 . 0 0 "[ . 1 . 2]" 1
689 1 70 TRP HB3 1 71 THR H . . 5.010 3.944 3.332 4.517 . 0 0 "[ . 1 . 2]" 1
690 1 70 TRP HD1 1 71 THR H . . 5.360 4.600 3.641 5.363 0.003 1 0 "[ . 1 . 2]" 1
691 1 71 THR H 1 71 THR HB . . 3.040 2.771 2.588 2.982 . 0 0 "[ . 1 . 2]" 1
692 1 71 THR H 1 71 THR MG . . 3.940 3.805 3.679 3.939 . 0 0 "[ . 1 . 2]" 1
693 1 71 THR H 1 72 ALA H . . 3.210 2.348 1.896 2.817 . 0 0 "[ . 1 . 2]" 1
694 1 71 THR HB 1 72 ALA H . . 2.890 2.665 2.279 2.883 . 0 0 "[ . 1 . 2]" 1
695 1 71 THR MG 1 72 ALA H . . 4.170 3.758 3.246 4.028 . 0 0 "[ . 1 . 2]" 1
696 1 72 ALA H 1 72 ALA MB . . 3.110 2.722 2.026 2.881 . 0 0 "[ . 1 . 2]" 1
697 1 72 ALA H 1 73 THR MG . . 4.640 4.230 3.656 4.640 . 7 0 "[ . 1 . 2]" 1
698 1 72 ALA HA 1 73 THR H . . 3.000 2.563 2.141 2.841 . 0 0 "[ . 1 . 2]" 1
699 1 72 ALA MB 1 73 THR H . . 3.750 3.205 2.041 3.720 . 0 0 "[ . 1 . 2]" 1
700 1 73 THR H 1 73 THR MG . . 3.670 2.879 2.271 3.330 . 0 0 "[ . 1 . 2]" 1
701 1 73 THR H 1 74 GLY H . . 4.430 4.352 4.032 4.437 0.007 10 0 "[ . 1 . 2]" 1
702 1 73 THR HA 1 73 THR HB . . 2.700 2.480 2.372 2.566 . 0 0 "[ . 1 . 2]" 1
703 1 73 THR HB 1 74 GLY H . . 3.700 2.961 1.949 3.703 0.003 9 0 "[ . 1 . 2]" 1
704 1 74 GLY QA 1 75 GLN H . . 2.660 2.197 2.109 2.418 . 0 0 "[ . 1 . 2]" 1
705 1 74 GLY QA 1 75 GLN QB . . 4.750 3.953 3.573 4.434 . 0 0 "[ . 1 . 2]" 1
706 1 75 GLN H 1 75 GLN QB . . 3.210 2.796 2.496 3.251 0.041 1 0 "[ . 1 . 2]" 1
707 1 75 GLN H 1 76 GLY H . . 4.010 3.897 3.301 4.360 0.350 10 0 "[ . 1 . 2]" 1
708 1 75 GLN HA 1 76 GLY H . . 3.460 2.236 2.142 2.657 . 0 0 "[ . 1 . 2]" 1
709 1 75 GLN HB2 1 76 GLY H . . 4.670 4.262 3.305 4.621 . 0 0 "[ . 1 . 2]" 1
710 1 75 GLN HB3 1 76 GLY H . . 4.670 3.969 1.919 4.625 . 0 0 "[ . 1 . 2]" 1
711 1 75 GLN HG2 1 76 GLY H . . 5.500 4.619 2.942 5.508 0.008 1 0 "[ . 1 . 2]" 1
712 1 75 GLN HG3 1 76 GLY H . . 5.500 4.583 3.485 5.467 . 0 0 "[ . 1 . 2]" 1
713 1 76 GLY QA 1 77 GLN H . . 3.100 2.207 2.113 2.759 . 0 0 "[ . 1 . 2]" 1
714 1 77 GLN H 1 77 GLN QG . . 2.690 2.465 1.940 2.690 . 0 0 "[ . 1 . 2]" 1
715 1 77 GLN H 1 78 LYS H . . 4.430 3.438 2.114 4.412 . 0 0 "[ . 1 . 2]" 1
716 1 77 GLN H 1 78 LYS QB . . 4.570 4.345 3.892 4.568 . 0 0 "[ . 1 . 2]" 1
717 1 77 GLN QG 1 78 LYS H . . 5.140 4.105 2.155 4.878 . 0 0 "[ . 1 . 2]" 1
718 1 78 LYS HA 1 79 SER H . . 2.910 2.310 2.141 3.268 0.358 17 0 "[ . 1 . 2]" 1
719 1 78 LYS QB 1 78 LYS QE . . 3.780 3.162 2.153 3.744 . 0 0 "[ . 1 . 2]" 1
720 1 78 LYS QB 1 79 SER HA . . 4.540 4.291 3.802 4.793 0.253 17 0 "[ . 1 . 2]" 1
721 1 78 LYS QE 1 78 LYS QG . . 2.800 2.199 2.062 2.447 . 0 0 "[ . 1 . 2]" 1
722 1 79 SER H 1 80 ALA MB . . 4.220 3.979 3.596 4.310 0.090 17 0 "[ . 1 . 2]" 1
723 1 79 SER HA 1 80 ALA H . . 2.830 2.295 2.140 2.493 . 0 0 "[ . 1 . 2]" 1
724 1 79 SER HA 1 80 ALA MB . . 4.330 4.142 3.713 4.332 0.002 2 0 "[ . 1 . 2]" 1
725 1 79 SER QB 1 80 ALA H . . 4.230 3.656 3.012 3.906 . 0 0 "[ . 1 . 2]" 1
726 1 79 SER QB 1 80 ALA HA . . 5.190 4.195 3.984 4.360 . 0 0 "[ . 1 . 2]" 1
727 1 79 SER QB 1 149 VAL HB . . 4.370 4.169 3.422 4.382 0.012 15 0 "[ . 1 . 2]" 1
728 1 79 SER QB 1 149 VAL QG . . 4.390 3.304 1.953 4.265 . 0 0 "[ . 1 . 2]" 1
729 1 79 SER HB2 1 80 ALA H . . 4.960 4.371 3.887 4.617 . 0 0 "[ . 1 . 2]" 1
730 1 79 SER HB3 1 80 ALA H . . 4.960 3.944 3.137 4.350 . 0 0 "[ . 1 . 2]" 1
731 1 80 ALA H 1 80 ALA MB . . 3.000 2.724 2.502 2.910 . 0 0 "[ . 1 . 2]" 1
732 1 80 ALA HA 1 81 GLY H . . 2.890 2.197 2.145 2.401 . 0 0 "[ . 1 . 2]" 1
733 1 80 ALA HA 1 81 GLY HA2 . . 5.500 4.436 4.354 4.621 . 0 0 "[ . 1 . 2]" 1
734 1 80 ALA HA 1 81 GLY HA3 . . 5.500 4.413 4.378 4.507 . 0 0 "[ . 1 . 2]" 1
735 1 80 ALA HA 1 82 ASP H . . 4.210 4.215 4.168 4.238 0.028 9 0 "[ . 1 . 2]" 1
736 1 80 ALA HA 1 148 ASN HB2 . . 4.690 2.863 1.998 3.443 . 0 0 "[ . 1 . 2]" 1
737 1 80 ALA HA 1 148 ASN HB3 . . 4.820 4.294 3.288 4.827 0.007 14 0 "[ . 1 . 2]" 1
738 1 80 ALA MB 1 81 GLY H . . 3.400 3.109 2.408 3.406 0.006 17 0 "[ . 1 . 2]" 1
739 1 80 ALA MB 1 82 ASP H . . 5.200 4.692 4.369 4.889 . 0 0 "[ . 1 . 2]" 1
740 1 81 GLY H 1 82 ASP H . . 3.190 2.291 2.162 2.563 . 0 0 "[ . 1 . 2]" 1
741 1 81 GLY H 1 82 ASP HB3 . . 5.170 4.320 4.045 4.598 . 0 0 "[ . 1 . 2]" 1
742 1 81 GLY H 1 148 ASN HB2 . . 4.610 3.595 2.851 4.024 . 0 0 "[ . 1 . 2]" 1
743 1 81 GLY H 1 148 ASN HB3 . . 5.370 5.095 4.554 5.377 0.007 15 0 "[ . 1 . 2]" 1
744 1 81 GLY QA 1 82 ASP H . . 3.030 2.579 2.540 2.598 . 0 0 "[ . 1 . 2]" 1
745 1 82 ASP H 1 82 ASP HB3 . . 3.000 2.641 2.413 2.769 . 0 0 "[ . 1 . 2]" 1
746 1 82 ASP H 1 83 THR H . . 4.680 4.630 4.560 4.646 . 0 0 "[ . 1 . 2]" 1
747 1 82 ASP HA 1 83 THR H . . 3.110 2.385 2.157 2.545 . 0 0 "[ . 1 . 2]" 1
748 1 82 ASP HA 1 145 LYS HD2 . . 5.500 4.562 3.895 5.205 . 0 0 "[ . 1 . 2]" 1
749 1 82 ASP HA 1 147 THR H . . 5.010 4.848 4.576 5.067 0.057 18 0 "[ . 1 . 2]" 1
750 1 82 ASP HA 1 147 THR HA . . 3.780 2.685 1.994 3.202 . 0 0 "[ . 1 . 2]" 1
751 1 82 ASP HA 1 148 ASN H . . 3.820 3.239 2.865 3.397 . 0 0 "[ . 1 . 2]" 1
752 1 82 ASP HB2 1 83 THR H . . 3.310 2.508 2.129 3.266 . 0 0 "[ . 1 . 2]" 1
753 1 82 ASP HB2 1 145 LYS HD2 . . 3.650 2.887 2.267 3.649 . 0 0 "[ . 1 . 2]" 1
754 1 82 ASP HB2 1 145 LYS QE . . 4.940 3.020 2.170 3.907 . 0 0 "[ . 1 . 2]" 1
755 1 82 ASP HB2 1 145 LYS HG2 . . 4.800 4.404 3.687 4.807 0.007 11 0 "[ . 1 . 2]" 1
756 1 82 ASP HB2 1 145 LYS QG . . 4.090 3.564 2.939 4.022 . 0 0 "[ . 1 . 2]" 1
757 1 82 ASP HB2 1 145 LYS HG3 . . 4.800 3.786 3.050 4.485 . 0 0 "[ . 1 . 2]" 1
758 1 82 ASP HB2 1 146 VAL H . . 5.060 4.534 4.181 5.054 . 0 0 "[ . 1 . 2]" 1
759 1 82 ASP HB2 1 147 THR HA . . 3.940 3.054 2.352 3.470 . 0 0 "[ . 1 . 2]" 1
760 1 82 ASP HB2 1 147 THR MG . . 4.800 2.928 1.936 4.231 . 0 0 "[ . 1 . 2]" 1
761 1 82 ASP HB3 1 147 THR HA . . 4.190 2.340 2.007 2.901 . 0 0 "[ . 1 . 2]" 1
762 1 82 ASP HB3 1 147 THR MG . . 5.370 2.942 2.160 4.061 . 0 0 "[ . 1 . 2]" 1
763 1 82 ASP HB3 1 148 ASN H . . 3.660 3.288 2.597 3.661 0.001 16 0 "[ . 1 . 2]" 1
764 1 83 THR H 1 83 THR HB . . 3.430 3.053 2.717 3.260 . 0 0 "[ . 1 . 2]" 1
765 1 83 THR H 1 83 THR MG . . 4.040 3.987 3.819 4.048 0.008 10 0 "[ . 1 . 2]" 1
766 1 83 THR H 1 84 SER H . . 4.570 4.197 3.947 4.472 . 0 0 "[ . 1 . 2]" 1
767 1 83 THR H 1 85 PHE QE . . 4.690 4.383 3.853 4.695 0.005 11 0 "[ . 1 . 2]" 1
768 1 83 THR H 1 145 LYS HD2 . . 4.600 2.843 2.343 3.274 . 0 0 "[ . 1 . 2]" 1
769 1 83 THR H 1 145 LYS HE2 . . 5.500 4.199 2.849 5.506 0.006 13 0 "[ . 1 . 2]" 1
770 1 83 THR H 1 145 LYS HE3 . . 5.500 4.897 3.843 5.533 0.033 18 0 "[ . 1 . 2]" 1
771 1 83 THR H 1 145 LYS QG . . 5.040 3.974 3.235 4.816 . 0 0 "[ . 1 . 2]" 1
772 1 83 THR H 1 146 VAL H . . 3.630 2.974 2.736 3.348 . 0 0 "[ . 1 . 2]" 1
773 1 83 THR H 1 146 VAL HB . . 4.250 3.277 2.453 4.260 0.010 17 0 "[ . 1 . 2]" 1
774 1 83 THR H 1 146 VAL QG . . 4.700 3.277 1.840 3.978 . 0 0 "[ . 1 . 2]" 1
775 1 83 THR H 1 147 THR MG . . 4.840 4.188 3.103 4.871 0.031 20 0 "[ . 1 . 2]" 1
776 1 83 THR H 1 148 ASN H . . 5.320 5.222 4.763 5.348 0.028 18 0 "[ . 1 . 2]" 1
777 1 83 THR H 1 148 ASN QD . . 5.340 4.957 4.144 5.357 0.017 20 0 "[ . 1 . 2]" 1
778 1 83 THR HA 1 83 THR MG . . 2.990 2.219 1.976 2.398 . 0 0 "[ . 1 . 2]" 1
779 1 83 THR HA 1 84 SER H . . 2.990 2.168 2.143 2.232 . 0 0 "[ . 1 . 2]" 1
780 1 83 THR HA 1 84 SER HA . . 4.410 4.393 4.383 4.406 . 0 0 "[ . 1 . 2]" 1
781 1 83 THR HA 1 145 LYS HD2 . . 4.850 4.142 3.713 4.536 . 0 0 "[ . 1 . 2]" 1
782 1 83 THR HA 1 145 LYS HD3 . . 5.290 4.706 4.098 5.276 . 0 0 "[ . 1 . 2]" 1
783 1 83 THR HB 1 84 SER HA . . 5.070 4.623 4.376 4.759 . 0 0 "[ . 1 . 2]" 1
784 1 83 THR HB 1 85 PHE QD . . 4.350 3.019 2.551 3.683 . 0 0 "[ . 1 . 2]" 1
785 1 83 THR HB 1 85 PHE QE . . 4.640 2.488 1.992 3.398 . 0 0 "[ . 1 . 2]" 1
786 1 83 THR HB 1 146 VAL HB . . 3.710 3.140 2.264 3.761 0.051 17 0 "[ . 1 . 2]" 1
787 1 83 THR MG 1 84 SER H . . 3.390 2.602 2.138 3.144 . 0 0 "[ . 1 . 2]" 1
788 1 83 THR MG 1 84 SER HA . . 4.630 4.195 3.725 4.586 . 0 0 "[ . 1 . 2]" 1
789 1 83 THR MG 1 84 SER QB . . 5.080 4.332 4.025 4.743 . 0 0 "[ . 1 . 2]" 1
790 1 83 THR MG 1 85 PHE H . . 5.400 4.617 4.081 5.281 . 0 0 "[ . 1 . 2]" 1
791 1 83 THR MG 1 85 PHE QD . . 3.600 2.513 2.039 3.487 . 0 0 "[ . 1 . 2]" 1
792 1 84 SER H 1 84 SER QB . . 3.310 2.350 2.198 2.992 . 0 0 "[ . 1 . 2]" 1
793 1 84 SER H 1 85 PHE H . . 4.690 4.361 4.090 4.510 . 0 0 "[ . 1 . 2]" 1
794 1 84 SER H 1 85 PHE QD . . 4.500 3.891 3.450 4.331 . 0 0 "[ . 1 . 2]" 1
795 1 84 SER HA 1 85 PHE H . . 3.190 2.149 2.137 2.184 . 0 0 "[ . 1 . 2]" 1
796 1 84 SER HA 1 145 LYS HD3 . . 3.780 2.005 1.964 2.245 . 0 0 "[ . 1 . 2]" 1
797 1 84 SER HA 1 145 LYS HE2 . . 4.790 4.263 3.326 4.867 0.077 13 0 "[ . 1 . 2]" 1
798 1 84 SER HA 1 145 LYS QE . . 4.100 3.441 3.013 3.660 . 0 0 "[ . 1 . 2]" 1
799 1 84 SER HA 1 145 LYS HE3 . . 4.790 3.702 3.273 4.450 . 0 0 "[ . 1 . 2]" 1
800 1 84 SER HA 1 145 LYS QG . . 5.340 3.942 3.703 4.092 . 0 0 "[ . 1 . 2]" 1
801 1 84 SER QB 1 85 PHE H . . 3.970 3.673 3.360 3.899 . 0 0 "[ . 1 . 2]" 1
802 1 84 SER QB 1 145 LYS HD3 . . 4.080 2.327 1.956 3.258 . 0 0 "[ . 1 . 2]" 1
803 1 84 SER QB 1 145 LYS QE . . 3.520 2.106 1.917 2.708 . 0 0 "[ . 1 . 2]" 1
804 1 84 SER HB2 1 85 PHE H . . 4.560 4.119 3.591 4.548 . 0 0 "[ . 1 . 2]" 1
805 1 84 SER HB2 1 145 LYS HE2 . . 4.690 3.284 1.991 4.194 . 0 0 "[ . 1 . 2]" 1
806 1 84 SER HB2 1 145 LYS HE3 . . 4.690 2.385 1.992 3.912 . 0 0 "[ . 1 . 2]" 1
807 1 84 SER HB3 1 85 PHE H . . 4.560 4.247 3.667 4.609 0.049 13 0 "[ . 1 . 2]" 1
808 1 84 SER HB3 1 145 LYS HE2 . . 4.690 4.314 2.484 4.702 0.012 7 0 "[ . 1 . 2]" 1
809 1 84 SER HB3 1 145 LYS HE3 . . 4.690 3.312 2.162 4.677 . 0 0 "[ . 1 . 2]" 1
810 1 85 PHE H 1 85 PHE HB3 . . 4.170 3.500 3.208 3.673 . 0 0 "[ . 1 . 2]" 1
811 1 85 PHE H 1 85 PHE QD . . 4.120 2.857 2.462 3.108 . 0 0 "[ . 1 . 2]" 1
812 1 85 PHE H 1 86 THR H . . 4.400 4.304 4.204 4.435 0.035 17 0 "[ . 1 . 2]" 1
813 1 85 PHE H 1 144 VAL HB . . 4.650 4.286 4.206 4.432 . 0 0 "[ . 1 . 2]" 1
814 1 85 PHE H 1 145 LYS HD3 . . 4.430 3.892 3.737 4.053 . 0 0 "[ . 1 . 2]" 1
815 1 85 PHE H 1 145 LYS QG . . 5.340 5.359 5.068 5.441 0.101 4 0 "[ . 1 . 2]" 1
816 1 85 PHE H 1 146 VAL H . . 4.840 4.501 4.323 4.706 . 0 0 "[ . 1 . 2]" 1
817 1 85 PHE H 1 146 VAL QG . . 5.440 5.042 4.787 5.237 . 0 0 "[ . 1 . 2]" 1
818 1 85 PHE HA 1 85 PHE QD . . 4.400 3.652 3.618 3.685 . 0 0 "[ . 1 . 2]" 1
819 1 85 PHE HA 1 86 THR H . . 3.300 2.203 2.152 2.337 . 0 0 "[ . 1 . 2]" 1
820 1 85 PHE HB2 1 86 THR H . . 4.160 3.066 2.635 3.345 . 0 0 "[ . 1 . 2]" 1
821 1 85 PHE HB2 1 87 LEU QD . . 4.410 3.110 2.703 3.556 . 0 0 "[ . 1 . 2]" 1
822 1 85 PHE HB2 1 144 VAL H . . 5.500 5.107 4.831 5.287 . 0 0 "[ . 1 . 2]" 1
823 1 85 PHE HB3 1 86 THR H . . 4.920 3.898 3.595 4.041 . 0 0 "[ . 1 . 2]" 1
824 1 85 PHE QD 1 86 THR H . . 4.600 4.387 4.083 4.647 0.047 6 0 "[ . 1 . 2]" 1
825 1 85 PHE QD 1 144 VAL H . . 4.560 3.987 3.276 4.302 . 0 0 "[ . 1 . 2]" 1
826 1 85 PHE QD 1 144 VAL HB . . 4.850 2.904 2.145 3.452 . 0 0 "[ . 1 . 2]" 1
827 1 85 PHE QE 1 146 VAL H . . 4.370 2.881 2.459 4.020 . 0 0 "[ . 1 . 2]" 1
828 1 85 PHE QE 1 146 VAL HB . . 4.160 2.829 2.385 3.796 . 0 0 "[ . 1 . 2]" 1
829 1 86 THR H 1 86 THR HB . . 3.780 2.581 2.450 2.847 . 0 0 "[ . 1 . 2]" 1
830 1 86 THR H 1 86 THR MG . . 3.920 3.797 3.751 3.828 . 0 0 "[ . 1 . 2]" 1
831 1 86 THR H 1 87 LEU MD1 . . 5.500 5.148 4.780 5.678 0.178 19 0 "[ . 1 . 2]" 1
832 1 86 THR H 1 87 LEU MD2 . . 5.500 3.999 3.693 4.659 . 0 0 "[ . 1 . 2]" 1
833 1 86 THR HA 1 87 LEU H . . 3.360 2.249 2.231 2.258 . 0 0 "[ . 1 . 2]" 1
834 1 86 THR HA 1 87 LEU MD1 . . 5.500 4.768 4.646 5.037 . 0 0 "[ . 1 . 2]" 1
835 1 86 THR HA 1 87 LEU MD2 . . 5.500 3.319 2.893 4.737 . 0 0 "[ . 1 . 2]" 1
836 1 86 THR HA 1 143 THR HA . . 4.390 1.998 1.950 2.140 . 0 0 "[ . 1 . 2]" 1
837 1 86 THR HA 1 144 VAL H . . 3.820 2.738 2.556 2.906 . 0 0 "[ . 1 . 2]" 1
838 1 86 THR MG 1 87 LEU H . . 3.400 2.127 1.927 2.325 . 0 0 "[ . 1 . 2]" 1
839 1 86 THR MG 1 142 ARG H . . 3.690 3.392 3.215 3.682 . 0 0 "[ . 1 . 2]" 1
840 1 87 LEU H 1 87 LEU MD1 . . 4.660 3.996 3.892 4.192 . 0 0 "[ . 1 . 2]" 1
841 1 87 LEU H 1 87 LEU QD . . 3.950 2.837 2.552 3.670 . 0 0 "[ . 1 . 2]" 1
842 1 87 LEU H 1 87 LEU MD2 . . 4.660 2.948 2.582 4.092 . 0 0 "[ . 1 . 2]" 1
843 1 87 LEU H 1 87 LEU HG . . 4.600 4.250 3.136 4.566 . 0 0 "[ . 1 . 2]" 1
844 1 87 LEU H 1 88 ALA H . . 4.620 4.446 4.279 4.498 . 0 0 "[ . 1 . 2]" 1
845 1 87 LEU H 1 88 ALA HA . . 5.500 4.932 4.748 5.062 . 0 0 "[ . 1 . 2]" 1
846 1 87 LEU H 1 142 ARG H . . 3.860 3.348 3.147 3.545 . 0 0 "[ . 1 . 2]" 1
847 1 87 LEU H 1 143 THR HA . . 3.830 2.532 2.360 2.714 . 0 0 "[ . 1 . 2]" 1
848 1 87 LEU H 1 144 VAL H . . 4.070 3.457 3.318 3.613 . 0 0 "[ . 1 . 2]" 1
849 1 87 LEU HA 1 87 LEU QD . . 3.940 1.989 1.918 2.285 . 0 0 "[ . 1 . 2]" 1
850 1 87 LEU HA 1 88 ALA H . . 3.430 2.351 2.175 2.437 . 0 0 "[ . 1 . 2]" 1
851 1 87 LEU HB2 1 143 THR H . . 5.500 5.239 4.417 5.586 0.086 19 0 "[ . 1 . 2]" 1
852 1 87 LEU HB2 1 144 VAL H . . 4.410 3.935 3.831 4.050 . 0 0 "[ . 1 . 2]" 1
853 1 87 LEU HB2 1 144 VAL HB . . 4.470 4.353 4.173 4.428 . 0 0 "[ . 1 . 2]" 1
854 1 87 LEU HB3 1 144 VAL H . . 5.500 5.537 5.451 5.574 0.074 19 0 "[ . 1 . 2]" 1
855 1 87 LEU HB3 1 144 VAL HB . . 5.500 5.522 5.259 5.594 0.094 11 0 "[ . 1 . 2]" 1
856 1 87 LEU QD 1 88 ALA H . . 3.390 2.975 2.745 3.431 0.041 13 0 "[ . 1 . 2]" 1
857 1 87 LEU QD 1 144 VAL H . . 4.350 2.442 2.102 3.500 . 0 0 "[ . 1 . 2]" 1
858 1 87 LEU QD 1 144 VAL HA . . 5.230 3.983 3.812 4.361 . 0 0 "[ . 1 . 2]" 1
859 1 87 LEU QD 1 144 VAL HB . . 3.960 1.916 1.860 2.156 . 0 0 "[ . 1 . 2]" 1
860 1 87 LEU QD 1 144 VAL QG . . 3.190 1.901 1.802 2.190 . 0 0 "[ . 1 . 2]" 1
861 1 87 LEU MD1 1 143 THR HA . . 5.500 5.378 4.707 5.557 0.057 15 0 "[ . 1 . 2]" 1
862 1 87 LEU MD2 1 143 THR HA . . 5.500 3.706 3.116 5.542 0.042 12 0 "[ . 1 . 2]" 1
863 1 87 LEU HG 1 144 VAL H . . 5.360 4.483 3.288 4.874 . 0 0 "[ . 1 . 2]" 1
864 1 87 LEU HG 1 144 VAL HB . . 3.900 3.645 3.030 3.858 . 0 0 "[ . 1 . 2]" 1
865 1 87 LEU HG 1 144 VAL QG . . 2.980 2.556 2.221 3.032 0.052 19 0 "[ . 1 . 2]" 1
866 1 88 ALA H 1 88 ALA MB . . 3.080 2.642 2.425 2.764 . 0 0 "[ . 1 . 2]" 1
867 1 88 ALA H 1 89 TRP H . . 4.750 4.296 4.201 4.474 . 0 0 "[ . 1 . 2]" 1
868 1 88 ALA H 1 142 ARG H . . 5.290 4.739 4.562 4.912 . 0 0 "[ . 1 . 2]" 1
869 1 88 ALA HA 1 89 TRP H . . 3.310 2.230 2.169 2.495 . 0 0 "[ . 1 . 2]" 1
870 1 88 ALA HA 1 140 ILE H . . 5.500 5.387 5.119 5.528 0.028 13 0 "[ . 1 . 2]" 1
871 1 88 ALA HA 1 141 THR HA . . 3.690 2.080 1.979 2.289 . 0 0 "[ . 1 . 2]" 1
872 1 88 ALA HA 1 141 THR HB . . 4.610 4.335 4.046 4.616 0.006 15 0 "[ . 1 . 2]" 1
873 1 88 ALA HA 1 141 THR MG . . 3.280 2.922 2.548 3.291 0.011 15 0 "[ . 1 . 2]" 1
874 1 88 ALA HA 1 142 ARG H . . 4.160 3.134 2.744 3.397 . 0 0 "[ . 1 . 2]" 1
875 1 88 ALA MB 1 89 TRP H . . 3.230 2.846 2.182 3.058 . 0 0 "[ . 1 . 2]" 1
876 1 88 ALA MB 1 89 TRP HA . . 5.220 4.056 3.863 4.146 . 0 0 "[ . 1 . 2]" 1
877 1 88 ALA MB 1 90 MET H . . 5.500 4.719 4.463 5.449 . 0 0 "[ . 1 . 2]" 1
878 1 88 ALA MB 1 141 THR HA . . 3.950 2.954 2.225 3.299 . 0 0 "[ . 1 . 2]" 1
879 1 88 ALA MB 1 142 ARG H . . 4.290 3.938 3.320 4.254 . 0 0 "[ . 1 . 2]" 1
880 1 89 TRP H 1 89 TRP HB2 . . 4.090 2.574 2.420 2.752 . 0 0 "[ . 1 . 2]" 1
881 1 89 TRP H 1 89 TRP QB . . 3.580 2.472 2.336 2.691 . 0 0 "[ . 1 . 2]" 1
882 1 89 TRP H 1 89 TRP HB3 . . 4.090 3.253 2.996 3.801 . 0 0 "[ . 1 . 2]" 1
883 1 89 TRP H 1 140 ILE H . . 3.820 3.564 3.377 3.750 . 0 0 "[ . 1 . 2]" 1
884 1 89 TRP H 1 140 ILE HA . . 4.630 4.448 4.281 4.618 . 0 0 "[ . 1 . 2]" 1
885 1 89 TRP H 1 140 ILE HB . . 4.070 2.585 2.310 2.852 . 0 0 "[ . 1 . 2]" 1
886 1 89 TRP H 1 140 ILE HG12 . . 5.430 5.426 5.224 5.493 0.063 15 0 "[ . 1 . 2]" 1
887 1 89 TRP H 1 140 ILE QG . . 4.640 4.366 4.218 4.681 0.041 4 0 "[ . 1 . 2]" 1
888 1 89 TRP H 1 140 ILE HG13 . . 5.430 4.612 4.390 5.247 . 0 0 "[ . 1 . 2]" 1
889 1 89 TRP H 1 141 THR HA . . 4.090 3.176 2.987 3.436 . 0 0 "[ . 1 . 2]" 1
890 1 89 TRP H 1 141 THR MG . . 3.750 3.681 3.548 3.765 0.015 15 0 "[ . 1 . 2]" 1
891 1 89 TRP HA 1 89 TRP HD1 . . 4.750 2.902 2.620 3.331 . 0 0 "[ . 1 . 2]" 1
892 1 89 TRP HA 1 90 MET H . . 3.140 2.155 2.141 2.288 . 0 0 "[ . 1 . 2]" 1
893 1 89 TRP HA 1 90 MET HB2 . . 4.390 4.240 4.210 4.288 . 0 0 "[ . 1 . 2]" 1
894 1 89 TRP QB 1 90 MET H . . 3.810 3.559 2.770 3.787 . 0 0 "[ . 1 . 2]" 1
895 1 89 TRP QB 1 140 ILE H . . 5.100 3.721 3.125 4.026 . 0 0 "[ . 1 . 2]" 1
896 1 89 TRP QB 1 140 ILE HB . . 4.580 1.945 1.900 1.992 . 0 0 "[ . 1 . 2]" 1
897 1 89 TRP QB 1 140 ILE MD . . 4.320 2.203 2.015 2.542 . 0 0 "[ . 1 . 2]" 1
898 1 89 TRP QB 1 140 ILE QG . . 3.890 3.141 2.523 3.494 . 0 0 "[ . 1 . 2]" 1
899 1 89 TRP QB 1 140 ILE MG . . 4.880 2.758 2.245 3.137 . 0 0 "[ . 1 . 2]" 1
900 1 89 TRP HB2 1 90 MET H . . 4.600 4.471 4.086 4.574 . 0 0 "[ . 1 . 2]" 1
901 1 89 TRP HB3 1 90 MET H . . 4.600 3.753 2.817 4.058 . 0 0 "[ . 1 . 2]" 1
902 1 89 TRP HD1 1 90 MET H . . 4.710 4.405 3.197 4.724 0.014 10 0 "[ . 1 . 2]" 1
903 1 89 TRP HD1 1 96 GLN H . . 4.640 4.506 3.394 4.665 0.025 19 0 "[ . 1 . 2]" 1
904 1 89 TRP HE1 1 94 GLN HA . . 4.980 3.739 3.104 4.979 . 0 0 "[ . 1 . 2]" 1
905 1 89 TRP HE1 1 95 GLY H . . 4.500 3.138 2.655 4.089 . 0 0 "[ . 1 . 2]" 1
906 1 89 TRP HE1 1 95 GLY HA2 . . 3.950 3.592 3.516 3.704 . 0 0 "[ . 1 . 2]" 1
907 1 89 TRP HE1 1 95 GLY QA . . 3.440 2.102 1.937 2.304 . 0 0 "[ . 1 . 2]" 1
908 1 89 TRP HE1 1 95 GLY HA3 . . 3.950 2.118 1.946 2.332 . 0 0 "[ . 1 . 2]" 1
909 1 89 TRP HE1 1 96 GLN H . . 4.140 2.603 2.173 3.565 . 0 0 "[ . 1 . 2]" 1
910 1 89 TRP HE1 1 96 GLN HA . . 4.450 4.047 3.372 4.449 . 0 0 "[ . 1 . 2]" 1
911 1 89 TRP HE1 1 96 GLN HG2 . . 4.760 3.878 3.195 4.762 0.002 7 0 "[ . 1 . 2]" 1
912 1 89 TRP HE1 1 96 GLN QG . . 4.160 3.440 3.102 4.073 . 0 0 "[ . 1 . 2]" 1
913 1 89 TRP HE1 1 96 GLN HG3 . . 4.760 4.082 3.271 4.686 . 0 0 "[ . 1 . 2]" 1
914 1 89 TRP HZ2 1 96 GLN H . . 4.420 2.885 1.982 4.433 0.013 15 0 "[ . 1 . 2]" 1
915 1 89 TRP HZ2 1 96 GLN HA . . 4.730 4.256 2.818 4.773 0.043 19 0 "[ . 1 . 2]" 1
916 1 89 TRP HZ2 1 96 GLN QG . . 5.340 3.153 2.674 4.566 . 0 0 "[ . 1 . 2]" 1
917 1 89 TRP HZ3 1 96 GLN QG . . 5.340 4.027 3.356 5.166 . 0 0 "[ . 1 . 2]" 1
918 1 90 MET H 1 90 MET HB2 . . 3.530 2.217 2.164 2.407 . 0 0 "[ . 1 . 2]" 1
919 1 90 MET H 1 90 MET HB3 . . 3.580 3.448 3.384 3.582 0.002 20 0 "[ . 1 . 2]" 1
920 1 90 MET H 1 90 MET HG2 . . 4.440 3.999 3.901 4.133 . 0 0 "[ . 1 . 2]" 1
921 1 90 MET H 1 90 MET HG3 . . 4.630 3.509 3.327 3.655 . 0 0 "[ . 1 . 2]" 1
922 1 90 MET H 1 91 PRO HD2 . . 4.820 4.755 4.746 4.775 . 0 0 "[ . 1 . 2]" 1
923 1 90 MET H 1 139 VAL MG1 . . 5.500 4.977 4.742 5.159 . 0 0 "[ . 1 . 2]" 1
924 1 90 MET H 1 140 ILE H . . 5.160 4.976 4.808 5.089 . 0 0 "[ . 1 . 2]" 1
925 1 90 MET H 1 140 ILE MD . . 5.500 5.170 4.213 5.521 0.021 14 0 "[ . 1 . 2]" 1
926 1 90 MET HA 1 90 MET ME . . 4.770 3.543 3.359 3.866 . 0 0 "[ . 1 . 2]" 1
927 1 90 MET HA 1 90 MET HG2 . . 3.880 2.124 2.065 2.242 . 0 0 "[ . 1 . 2]" 1
928 1 90 MET HA 1 90 MET HG3 . . 3.870 3.104 2.900 3.158 . 0 0 "[ . 1 . 2]" 1
929 1 90 MET HA 1 91 PRO HG2 . . 4.880 4.605 4.599 4.617 . 0 0 "[ . 1 . 2]" 1
930 1 90 MET HA 1 91 PRO HG3 . . 4.900 4.544 4.538 4.553 . 0 0 "[ . 1 . 2]" 1
931 1 90 MET HA 1 139 VAL HA . . 4.010 3.196 3.150 3.222 . 0 0 "[ . 1 . 2]" 1
932 1 90 MET HA 1 139 VAL MG1 . . 5.050 3.316 3.097 3.563 . 0 0 "[ . 1 . 2]" 1
933 1 90 MET HB3 1 91 PRO HD2 . . 4.050 2.120 1.999 2.225 . 0 0 "[ . 1 . 2]" 1
934 1 90 MET ME 1 90 MET HG3 . . 3.800 3.152 2.935 3.337 . 0 0 "[ . 1 . 2]" 1
935 1 90 MET ME 1 91 PRO HG2 . . 4.810 3.227 2.751 3.925 . 0 0 "[ . 1 . 2]" 1
936 1 90 MET ME 1 91 PRO HG3 . . 4.710 3.507 3.069 4.117 . 0 0 "[ . 1 . 2]" 1
937 1 90 MET HG2 1 91 PRO HD2 . . 4.290 2.525 2.282 2.737 . 0 0 "[ . 1 . 2]" 1
938 1 90 MET HG2 1 139 VAL HA . . 4.550 3.867 3.655 4.229 . 0 0 "[ . 1 . 2]" 1
939 1 90 MET HG2 1 139 VAL HB . . 5.500 5.504 5.453 5.517 0.017 19 0 "[ . 1 . 2]" 1
940 1 90 MET HG2 1 139 VAL MG2 . . 3.820 3.133 2.847 3.449 . 0 0 "[ . 1 . 2]" 1
941 1 90 MET HG3 1 91 PRO HD2 . . 4.170 3.865 3.750 4.036 . 0 0 "[ . 1 . 2]" 1
942 1 90 MET HG3 1 139 VAL HA . . 5.450 5.327 5.075 5.432 . 0 0 "[ . 1 . 2]" 1
943 1 91 PRO HB2 1 92 GLY QA . . 4.390 4.091 3.952 4.176 . 0 0 "[ . 1 . 2]" 1
944 1 91 PRO HD2 1 139 VAL MG2 . . 5.500 3.765 3.307 3.981 . 0 0 "[ . 1 . 2]" 1
945 1 91 PRO HD3 1 139 VAL HA . . 4.220 2.842 2.616 3.143 . 0 0 "[ . 1 . 2]" 1
946 1 91 PRO HD3 1 139 VAL HB . . 5.500 5.493 5.041 5.538 0.038 19 0 "[ . 1 . 2]" 1
947 1 91 PRO HD3 1 139 VAL MG2 . . 5.500 3.212 2.705 3.474 . 0 0 "[ . 1 . 2]" 1
948 1 91 PRO HG2 1 92 GLY QA . . 4.990 4.776 4.741 4.801 . 0 0 "[ . 1 . 2]" 1
949 1 92 GLY H 1 93 GLU QG . . 4.540 4.287 3.891 4.547 0.007 20 0 "[ . 1 . 2]" 1
950 1 93 GLU H 1 93 GLU HB2 . . 3.120 2.576 2.348 2.817 . 0 0 "[ . 1 . 2]" 1
951 1 93 GLU H 1 93 GLU QG . . 3.170 2.727 2.114 3.096 . 0 0 "[ . 1 . 2]" 1
952 1 93 GLU HA 1 93 GLU QG . . 2.930 2.673 2.208 2.930 0.000 9 0 "[ . 1 . 2]" 1
953 1 93 GLU HA 1 94 GLN H . . 2.820 2.548 2.308 2.657 . 0 0 "[ . 1 . 2]" 1
954 1 93 GLU HB3 1 94 GLN H . . 3.480 2.151 1.948 2.669 . 0 0 "[ . 1 . 2]" 1
955 1 94 GLN H 1 94 GLN QB . . 3.680 2.758 2.424 3.137 . 0 0 "[ . 1 . 2]" 1
956 1 94 GLN HA 1 94 GLN HG2 . . 4.220 3.012 2.304 4.210 . 0 0 "[ . 1 . 2]" 1
957 1 94 GLN HA 1 94 GLN QG . . 3.520 2.715 2.221 3.428 . 0 0 "[ . 1 . 2]" 1
958 1 94 GLN HA 1 94 GLN HG3 . . 4.220 3.315 2.309 4.218 . 0 0 "[ . 1 . 2]" 1
959 1 94 GLN HA 1 95 GLY H . . 3.570 2.388 2.250 2.675 . 0 0 "[ . 1 . 2]" 1
960 1 94 GLN HA 1 96 GLN H . . 4.090 3.480 3.389 3.650 . 0 0 "[ . 1 . 2]" 1
961 1 94 GLN QB 1 94 GLN QG . . 2.210 2.064 2.007 2.086 . 0 0 "[ . 1 . 2]" 1
962 1 94 GLN QB 1 96 GLN H . . 4.920 4.227 3.518 4.748 . 0 0 "[ . 1 . 2]" 1
963 1 94 GLN HB2 1 95 GLY H . . 4.000 3.347 2.176 3.954 . 0 0 "[ . 1 . 2]" 1
964 1 94 GLN HB3 1 95 GLY H . . 4.000 2.961 1.948 3.965 . 0 0 "[ . 1 . 2]" 1
965 1 94 GLN QG 1 95 GLY H . . 4.360 3.740 1.962 4.365 0.005 6 0 "[ . 1 . 2]" 1
966 1 94 GLN HG2 1 95 GLY H . . 5.190 4.194 2.046 5.185 . 0 0 "[ . 1 . 2]" 1
967 1 94 GLN HG3 1 95 GLY H . . 5.190 4.440 2.521 5.186 . 0 0 "[ . 1 . 2]" 1
968 1 95 GLY H 1 96 GLN H . . 4.040 1.914 1.894 2.011 . 0 0 "[ . 1 . 2]" 1
969 1 95 GLY QA 1 98 ALA H . . 4.400 3.287 3.196 3.549 . 0 0 "[ . 1 . 2]" 1
970 1 95 GLY HA2 1 98 ALA MB . . 4.230 2.682 2.177 3.754 . 0 0 "[ . 1 . 2]" 1
971 1 95 GLY HA3 1 98 ALA MB . . 4.230 3.676 3.379 4.234 0.004 12 0 "[ . 1 . 2]" 1
972 1 96 GLN H 1 96 GLN HB2 . . 3.800 2.435 2.280 2.651 . 0 0 "[ . 1 . 2]" 1
973 1 96 GLN H 1 96 GLN QB . . 3.240 2.394 2.254 2.585 . 0 0 "[ . 1 . 2]" 1
974 1 96 GLN H 1 96 GLN HB3 . . 3.800 3.571 3.545 3.588 . 0 0 "[ . 1 . 2]" 1
975 1 96 GLN H 1 96 GLN QE . . 4.970 4.675 3.684 4.988 0.018 1 0 "[ . 1 . 2]" 1
976 1 96 GLN H 1 96 GLN QG . . 3.490 2.403 1.925 2.690 . 0 0 "[ . 1 . 2]" 1
977 1 96 GLN H 1 97 GLN H . . 3.630 2.966 2.724 3.138 . 0 0 "[ . 1 . 2]" 1
978 1 96 GLN H 1 97 GLN HG2 . . 4.290 4.005 3.835 4.118 . 0 0 "[ . 1 . 2]" 1
979 1 96 GLN HA 1 96 GLN QE . . 5.120 4.232 2.755 4.974 . 0 0 "[ . 1 . 2]" 1
980 1 96 GLN HA 1 96 GLN HG2 . . 4.060 2.394 2.163 2.643 . 0 0 "[ . 1 . 2]" 1
981 1 96 GLN HA 1 96 GLN QG . . 3.430 2.336 2.134 2.504 . 0 0 "[ . 1 . 2]" 1
982 1 96 GLN HA 1 96 GLN HG3 . . 4.060 3.385 2.746 3.675 . 0 0 "[ . 1 . 2]" 1
983 1 96 GLN HA 1 99 LEU QB . . 3.900 3.297 2.835 3.920 0.020 19 0 "[ . 1 . 2]" 1
984 1 96 GLN QB 1 97 GLN H . . 3.460 2.384 2.138 2.820 . 0 0 "[ . 1 . 2]" 1
985 1 96 GLN QB 1 97 GLN HB3 . . 4.800 4.269 4.083 4.627 . 0 0 "[ . 1 . 2]" 1
986 1 96 GLN QB 1 97 GLN HG2 . . 4.490 3.866 3.462 4.495 0.005 3 0 "[ . 1 . 2]" 1
987 1 96 GLN HB2 1 97 GLN H . . 3.940 2.463 2.223 2.888 . 0 0 "[ . 1 . 2]" 1
988 1 96 GLN HB3 1 97 GLN H . . 3.940 3.215 2.713 3.947 0.007 3 0 "[ . 1 . 2]" 1
989 1 96 GLN QE 1 140 ILE MD . . 3.760 3.061 2.290 3.747 . 0 0 "[ . 1 . 2]" 1
990 1 96 GLN QE 1 140 ILE MG . . 4.670 3.701 2.005 4.669 . 0 0 "[ . 1 . 2]" 1
991 1 96 GLN HE21 1 140 ILE MD . . 4.530 3.353 2.502 4.499 . 0 0 "[ . 1 . 2]" 1
992 1 96 GLN HE22 1 140 ILE MD . . 4.530 3.664 2.381 4.536 0.006 4 0 "[ . 1 . 2]" 1
993 1 96 GLN QG 1 97 GLN HG2 . . 5.340 5.360 5.281 5.428 0.088 7 0 "[ . 1 . 2]" 1
994 1 96 GLN QG 1 140 ILE MG . . 5.090 4.781 3.696 5.100 0.010 19 0 "[ . 1 . 2]" 1
995 1 97 GLN H 1 97 GLN HB3 . . 3.250 2.703 2.623 2.722 . 0 0 "[ . 1 . 2]" 1
996 1 97 GLN H 1 97 GLN HG2 . . 3.580 1.950 1.915 2.116 . 0 0 "[ . 1 . 2]" 1
997 1 97 GLN H 1 98 ALA H . . 3.110 2.773 2.751 2.845 . 0 0 "[ . 1 . 2]" 1
998 1 97 GLN HA 1 97 GLN HG2 . . 3.950 3.697 3.669 3.779 . 0 0 "[ . 1 . 2]" 1
999 1 97 GLN HA 1 100 LEU HB2 . . 3.670 3.360 2.263 3.664 . 0 0 "[ . 1 . 2]" 1
1000 1 97 GLN HA 1 100 LEU HB3 . . 3.670 2.778 2.214 3.519 . 0 0 "[ . 1 . 2]" 1
1001 1 97 GLN HA 1 100 LEU QD . . 3.650 3.322 2.640 3.660 0.010 16 0 "[ . 1 . 2]" 1
1002 1 97 GLN HA 1 101 ALA H . . 4.080 3.676 3.436 4.018 . 0 0 "[ . 1 . 2]" 1
1003 1 97 GLN HB2 1 97 GLN HG3 . . 2.750 2.492 2.404 2.594 . 0 0 "[ . 1 . 2]" 1
1004 1 97 GLN HB2 1 98 ALA H . . 3.720 3.684 3.509 3.757 0.037 20 0 "[ . 1 . 2]" 1
1005 1 97 GLN HB3 1 97 GLN HG2 . . 2.930 2.394 2.310 2.479 . 0 0 "[ . 1 . 2]" 1
1006 1 97 GLN HB3 1 100 LEU QD . . 5.390 4.642 3.813 5.108 . 0 0 "[ . 1 . 2]" 1
1007 1 97 GLN HG3 1 98 ALA H . . 4.360 2.256 2.001 2.404 . 0 0 "[ . 1 . 2]" 1
1008 1 97 GLN HG3 1 98 ALA MB . . 4.020 3.256 3.120 3.329 . 0 0 "[ . 1 . 2]" 1
1009 1 98 ALA H 1 98 ALA MB . . 3.070 2.080 2.023 2.164 . 0 0 "[ . 1 . 2]" 1
1010 1 98 ALA MB 1 99 LEU H . . 4.150 2.347 2.239 2.537 . 0 0 "[ . 1 . 2]" 1
1011 1 99 LEU HA 1 102 TRP HA . . 5.500 5.243 4.967 5.501 0.001 3 0 "[ . 1 . 2]" 1
1012 1 99 LEU HA 1 102 TRP QB . . 3.340 2.520 2.243 2.778 . 0 0 "[ . 1 . 2]" 1
1013 1 99 LEU HA 1 102 TRP HE3 . . 4.500 3.095 1.996 4.323 . 0 0 "[ . 1 . 2]" 1
1014 1 99 LEU HA 1 127 VAL QG . . 5.350 4.596 3.826 5.327 . 0 0 "[ . 1 . 2]" 1
1015 1 99 LEU HA 1 130 ILE MD . . 4.700 3.359 2.520 3.930 . 0 0 "[ . 1 . 2]" 1
1016 1 99 LEU HA 1 130 ILE QG . . 4.650 4.613 4.297 4.674 0.024 3 0 "[ . 1 . 2]" 1
1017 1 99 LEU QB 1 130 ILE QG . . 4.220 3.952 3.335 4.240 0.020 17 0 "[ . 1 . 2]" 1
1018 1 100 LEU HA 1 100 LEU QD . . 3.390 2.496 1.976 3.026 . 0 0 "[ . 1 . 2]" 1
1019 1 100 LEU HA 1 103 PHE H . . 3.930 3.778 3.590 3.936 0.006 11 0 "[ . 1 . 2]" 1
1020 1 100 LEU HA 1 103 PHE QB . . 4.110 3.170 2.869 3.530 . 0 0 "[ . 1 . 2]" 1
1021 1 100 LEU HA 1 130 ILE MD . . 5.010 4.525 3.311 5.026 0.016 19 0 "[ . 1 . 2]" 1
1022 1 100 LEU QD 1 101 ALA H . . 4.720 3.372 2.834 3.940 . 0 0 "[ . 1 . 2]" 1
1023 1 100 LEU QD 1 103 PHE H . . 5.180 4.760 4.022 5.085 . 0 0 "[ . 1 . 2]" 1
1024 1 100 LEU QD 1 103 PHE QB . . 4.670 3.924 3.017 4.558 . 0 0 "[ . 1 . 2]" 1
1025 1 100 LEU QD 1 104 ASN H . . 4.370 3.771 3.114 4.289 . 0 0 "[ . 1 . 2]" 1
1026 1 100 LEU MD1 1 101 ALA H . . 5.500 4.259 2.883 4.707 . 0 0 "[ . 1 . 2]" 1
1027 1 100 LEU MD2 1 101 ALA H . . 5.500 3.720 3.040 4.391 . 0 0 "[ . 1 . 2]" 1
1028 1 101 ALA H 1 101 ALA MB . . 2.750 2.197 2.053 2.237 . 0 0 "[ . 1 . 2]" 1
1029 1 101 ALA H 1 102 TRP H . . 3.370 2.641 2.531 2.762 . 0 0 "[ . 1 . 2]" 1
1030 1 101 ALA H 1 103 PHE H . . 4.630 4.398 4.210 4.608 . 0 0 "[ . 1 . 2]" 1
1031 1 101 ALA HA 1 104 ASN H . . 3.820 3.602 3.432 3.749 . 0 0 "[ . 1 . 2]" 1
1032 1 101 ALA HA 1 104 ASN HB2 . . 3.620 3.405 2.746 3.624 0.004 10 0 "[ . 1 . 2]" 1
1033 1 101 ALA HA 1 104 ASN HB3 . . 3.620 2.881 2.169 3.553 . 0 0 "[ . 1 . 2]" 1
1034 1 101 ALA MB 1 102 TRP H . . 3.290 2.639 2.499 2.865 . 0 0 "[ . 1 . 2]" 1
1035 1 101 ALA MB 1 102 TRP HA . . 4.390 3.810 3.730 3.869 . 0 0 "[ . 1 . 2]" 1
1036 1 101 ALA MB 1 104 ASN QB . . 4.150 4.011 3.701 4.168 0.018 19 0 "[ . 1 . 2]" 1
1037 1 102 TRP H 1 102 TRP HB2 . . 3.690 2.251 2.115 2.452 . 0 0 "[ . 1 . 2]" 1
1038 1 102 TRP H 1 102 TRP QB . . 3.110 2.176 2.096 2.278 . 0 0 "[ . 1 . 2]" 1
1039 1 102 TRP H 1 102 TRP HB3 . . 3.690 2.972 2.615 3.556 . 0 0 "[ . 1 . 2]" 1
1040 1 102 TRP H 1 102 TRP HD1 . . 4.870 4.455 3.149 4.853 . 0 0 "[ . 1 . 2]" 1
1041 1 102 TRP H 1 103 PHE H . . 3.700 2.778 2.687 2.856 . 0 0 "[ . 1 . 2]" 1
1042 1 102 TRP H 1 104 ASN H . . 4.420 4.218 3.706 4.430 0.010 15 0 "[ . 1 . 2]" 1
1043 1 102 TRP HA 1 102 TRP HD1 . . 3.870 2.171 2.004 2.486 . 0 0 "[ . 1 . 2]" 1
1044 1 102 TRP HA 1 102 TRP HE3 . . 5.290 5.070 4.867 5.222 . 0 0 "[ . 1 . 2]" 1
1045 1 102 TRP HA 1 105 GLU HB2 . . 4.370 3.628 3.035 4.220 . 0 0 "[ . 1 . 2]" 1
1046 1 102 TRP HA 1 105 GLU QB . . 3.560 2.813 2.539 3.112 . 0 0 "[ . 1 . 2]" 1
1047 1 102 TRP HA 1 105 GLU HB3 . . 4.370 2.939 2.621 3.246 . 0 0 "[ . 1 . 2]" 1
1048 1 102 TRP HA 1 105 GLU HG2 . . 4.750 4.429 4.009 4.758 0.008 12 0 "[ . 1 . 2]" 1
1049 1 102 TRP QB 1 103 PHE H . . 3.840 2.409 2.239 2.614 . 0 0 "[ . 1 . 2]" 1
1050 1 102 TRP QB 1 127 VAL QG . . 4.400 3.024 1.927 3.877 . 0 0 "[ . 1 . 2]" 1
1051 1 102 TRP QB 1 130 ILE QG . . 4.370 4.208 3.373 4.393 0.023 8 0 "[ . 1 . 2]" 1
1052 1 102 TRP HD1 1 105 GLU H . . 5.500 4.956 4.396 5.505 0.005 7 0 "[ . 1 . 2]" 1
1053 1 102 TRP HD1 1 105 GLU QB . . 4.900 3.398 2.703 4.037 . 0 0 "[ . 1 . 2]" 1
1054 1 102 TRP HD1 1 105 GLU HG2 . . 4.980 4.481 3.671 5.007 0.027 18 0 "[ . 1 . 2]" 1
1055 1 102 TRP HE1 1 109 ARG HA . . 5.500 5.095 4.512 5.519 0.019 8 0 "[ . 1 . 2]" 1
1056 1 102 TRP HE1 1 109 ARG HB2 . . 4.440 2.708 1.951 4.448 0.008 7 0 "[ . 1 . 2]" 1
1057 1 102 TRP HE1 1 109 ARG QB . . 3.820 2.482 1.867 3.849 0.029 18 0 "[ . 1 . 2]" 1
1058 1 102 TRP HE1 1 109 ARG HB3 . . 4.440 3.408 2.029 4.398 . 0 0 "[ . 1 . 2]" 1
1059 1 102 TRP HE3 1 127 VAL HB . . 5.460 4.976 3.795 5.472 0.012 20 0 "[ . 1 . 2]" 1
1060 1 102 TRP HE3 1 127 VAL QG . . 4.050 3.267 1.912 4.055 0.005 13 0 "[ . 1 . 2]" 1
1061 1 103 PHE H 1 103 PHE HB2 . . 3.630 2.687 2.438 2.845 . 0 0 "[ . 1 . 2]" 1
1062 1 103 PHE H 1 103 PHE HB3 . . 3.630 2.399 2.278 2.640 . 0 0 "[ . 1 . 2]" 1
1063 1 103 PHE H 1 103 PHE QD . . 4.420 4.147 4.040 4.184 . 0 0 "[ . 1 . 2]" 1
1064 1 103 PHE H 1 104 ASN H . . 3.540 2.685 2.480 2.801 . 0 0 "[ . 1 . 2]" 1
1065 1 103 PHE H 1 105 GLU H . . 4.210 3.985 3.784 4.214 0.004 14 0 "[ . 1 . 2]" 1
1066 1 103 PHE H 1 127 VAL QG . . 5.070 4.192 2.667 5.076 0.006 2 0 "[ . 1 . 2]" 1
1067 1 103 PHE H 1 130 ILE MD . . 4.100 3.070 2.337 4.139 0.039 14 0 "[ . 1 . 2]" 1
1068 1 103 PHE H 1 130 ILE QG . . 4.870 4.502 3.307 4.919 0.049 4 0 "[ . 1 . 2]" 1
1069 1 103 PHE HA 1 103 PHE QD . . 4.170 2.779 2.182 3.125 . 0 0 "[ . 1 . 2]" 1
1070 1 103 PHE HA 1 127 VAL HB . . 4.240 3.917 3.453 4.310 0.070 8 0 "[ . 1 . 2]" 1
1071 1 103 PHE HA 1 127 VAL MG1 . . 4.840 3.893 1.902 4.865 0.025 15 0 "[ . 1 . 2]" 1
1072 1 103 PHE HA 1 127 VAL MG2 . . 4.840 4.423 2.001 4.898 0.058 19 0 "[ . 1 . 2]" 1
1073 1 103 PHE QB 1 104 ASN H . . 3.760 2.492 2.322 2.907 . 0 0 "[ . 1 . 2]" 1
1074 1 103 PHE QB 1 127 VAL HB . . 5.340 4.572 3.725 5.320 . 0 0 "[ . 1 . 2]" 1
1075 1 103 PHE QB 1 127 VAL QG . . 5.030 3.569 1.976 4.394 . 0 0 "[ . 1 . 2]" 1
1076 1 103 PHE QB 1 130 ILE MD . . 3.450 2.213 1.865 3.367 . 0 0 "[ . 1 . 2]" 1
1077 1 103 PHE HB2 1 130 ILE MD . . 3.980 2.264 1.881 3.601 . 0 0 "[ . 1 . 2]" 1
1078 1 103 PHE HB3 1 130 ILE MD . . 3.980 3.357 2.594 4.058 0.078 13 0 "[ . 1 . 2]" 1
1079 1 103 PHE QD 1 104 ASN H . . 3.870 3.170 2.749 3.728 . 0 0 "[ . 1 . 2]" 1
1080 1 103 PHE QD 1 104 ASN HA . . 4.720 3.308 2.893 4.261 . 0 0 "[ . 1 . 2]" 1
1081 1 103 PHE QD 1 105 GLU H . . 5.240 5.193 4.992 5.253 0.013 19 0 "[ . 1 . 2]" 1
1082 1 103 PHE QD 1 127 VAL HB . . 5.500 4.715 3.949 5.505 0.005 13 0 "[ . 1 . 2]" 1
1083 1 103 PHE QD 1 129 SER H . . 5.250 4.348 2.736 5.262 0.012 1 0 "[ . 1 . 2]" 1
1084 1 103 PHE QD 1 130 ILE H . . 4.000 3.583 2.818 4.019 0.019 11 0 "[ . 1 . 2]" 1
1085 1 103 PHE QD 1 130 ILE QG . . 4.850 3.400 2.334 4.127 . 0 0 "[ . 1 . 2]" 1
1086 1 104 ASN H 1 104 ASN HB2 . . 3.310 2.301 2.066 2.643 . 0 0 "[ . 1 . 2]" 1
1087 1 104 ASN H 1 104 ASN QB . . 2.900 2.180 2.045 2.285 . 0 0 "[ . 1 . 2]" 1
1088 1 104 ASN H 1 104 ASN HB3 . . 3.310 2.830 2.430 3.263 . 0 0 "[ . 1 . 2]" 1
1089 1 104 ASN H 1 105 GLU H . . 3.420 2.664 2.403 2.802 . 0 0 "[ . 1 . 2]" 1
1090 1 104 ASN H 1 105 GLU QB . . 4.870 4.423 4.157 4.533 . 0 0 "[ . 1 . 2]" 1
1091 1 104 ASN H 1 106 GLY H . . 4.500 4.382 4.072 4.508 0.008 9 0 "[ . 1 . 2]" 1
1092 1 104 ASN QB 1 105 GLU H . . 3.700 2.740 2.351 2.933 . 0 0 "[ . 1 . 2]" 1
1093 1 104 ASN QB 1 105 GLU QB . . 4.160 3.944 3.725 4.164 0.004 4 0 "[ . 1 . 2]" 1
1094 1 105 GLU H 1 105 GLU QB . . 2.870 2.252 2.222 2.272 . 0 0 "[ . 1 . 2]" 1
1095 1 105 GLU H 1 106 GLY H . . 3.270 2.654 2.561 2.825 . 0 0 "[ . 1 . 2]" 1
1096 1 105 GLU H 1 107 ASP H . . 5.120 4.818 4.591 5.206 0.086 4 0 "[ . 1 . 2]" 1
1097 1 105 GLU HA 1 105 GLU HG3 . . 3.230 2.772 2.477 3.240 0.010 4 0 "[ . 1 . 2]" 1
1098 1 105 GLU QB 1 106 GLY H . . 3.550 2.417 2.367 2.550 . 0 0 "[ . 1 . 2]" 1
1099 1 105 GLU HG2 1 107 ASP H . . 3.690 3.129 1.951 3.690 . 0 0 "[ . 1 . 2]" 1
1100 1 105 GLU HG2 1 107 ASP HA . . 5.490 5.041 4.102 5.507 0.017 4 0 "[ . 1 . 2]" 1
1101 1 105 GLU HG2 1 107 ASP QB . . 3.460 2.458 2.063 3.180 . 0 0 "[ . 1 . 2]" 1
1102 1 105 GLU HG3 1 107 ASP H . . 3.790 2.740 1.936 3.713 . 0 0 "[ . 1 . 2]" 1
1103 1 105 GLU HG3 1 107 ASP HA . . 5.500 4.312 3.928 4.823 . 0 0 "[ . 1 . 2]" 1
1104 1 105 GLU HG3 1 107 ASP QB . . 3.700 2.180 1.960 2.645 . 0 0 "[ . 1 . 2]" 1
1105 1 106 GLY H 1 107 ASP H . . 3.610 2.793 2.579 3.305 . 0 0 "[ . 1 . 2]" 1
1106 1 107 ASP H 1 107 ASP HB2 . . 4.040 2.641 2.110 3.734 . 0 0 "[ . 1 . 2]" 1
1107 1 107 ASP H 1 107 ASP QB . . 3.430 2.457 2.076 2.673 . 0 0 "[ . 1 . 2]" 1
1108 1 107 ASP H 1 107 ASP HB3 . . 4.040 3.297 2.529 3.822 . 0 0 "[ . 1 . 2]" 1
1109 1 107 ASP H 1 108 THR H . . 4.510 4.479 4.418 4.529 0.019 4 0 "[ . 1 . 2]" 1
1110 1 107 ASP HA 1 108 THR H . . 3.150 2.483 2.212 2.679 . 0 0 "[ . 1 . 2]" 1
1111 1 107 ASP QB 1 108 THR H . . 4.130 2.556 1.947 3.403 . 0 0 "[ . 1 . 2]" 1
1112 1 107 ASP HB2 1 108 THR H . . 4.720 3.621 2.524 4.146 . 0 0 "[ . 1 . 2]" 1
1113 1 107 ASP HB3 1 108 THR H . . 4.720 2.705 1.960 3.908 . 0 0 "[ . 1 . 2]" 1
1114 1 108 THR H 1 108 THR HB . . 3.170 2.781 2.506 2.977 . 0 0 "[ . 1 . 2]" 1
1115 1 108 THR H 1 108 THR MG . . 3.930 3.744 3.654 3.815 . 0 0 "[ . 1 . 2]" 1
1116 1 108 THR H 1 109 ARG H . . 4.640 4.501 4.358 4.632 . 0 0 "[ . 1 . 2]" 1
1117 1 108 THR HA 1 108 THR MG . . 3.650 2.199 2.072 2.338 . 0 0 "[ . 1 . 2]" 1
1118 1 108 THR HA 1 109 ARG H . . 3.350 2.175 2.142 2.323 . 0 0 "[ . 1 . 2]" 1
1119 1 108 THR HB 1 109 ARG H . . 4.290 3.989 3.307 4.263 . 0 0 "[ . 1 . 2]" 1
1120 1 108 THR MG 1 109 ARG H . . 3.480 2.613 1.939 3.186 . 0 0 "[ . 1 . 2]" 1
1121 1 108 THR MG 1 125 GLY H . . 3.460 2.607 2.084 3.106 . 0 0 "[ . 1 . 2]" 1
1122 1 109 ARG H 1 109 ARG QB . . 3.560 2.560 2.307 2.794 . 0 0 "[ . 1 . 2]" 1
1123 1 109 ARG H 1 110 ALA H . . 4.590 4.444 4.373 4.505 . 0 0 "[ . 1 . 2]" 1
1124 1 109 ARG H 1 124 ARG HA . . 4.900 4.648 4.451 4.927 0.027 18 0 "[ . 1 . 2]" 1
1125 1 109 ARG H 1 124 ARG HB3 . . 5.070 4.769 4.174 5.088 0.018 18 0 "[ . 1 . 2]" 1
1126 1 109 ARG H 1 125 GLY H . . 3.770 2.789 2.476 3.067 . 0 0 "[ . 1 . 2]" 1
1127 1 109 ARG H 1 126 TRP H . . 5.130 4.442 4.027 4.995 . 0 0 "[ . 1 . 2]" 1
1128 1 109 ARG H 1 126 TRP HA . . 4.320 3.271 2.824 3.825 . 0 0 "[ . 1 . 2]" 1
1129 1 109 ARG H 1 126 TRP QB . . 4.560 3.943 3.639 4.682 0.122 18 0 "[ . 1 . 2]" 1
1130 1 109 ARG HA 1 110 ALA H . . 3.240 2.388 2.168 2.499 . 0 0 "[ . 1 . 2]" 1
1131 1 109 ARG QB 1 110 ALA H . . 3.470 2.674 2.197 3.365 . 0 0 "[ . 1 . 2]" 1
1132 1 109 ARG QB 1 110 ALA HA . . 5.310 4.087 3.881 4.388 . 0 0 "[ . 1 . 2]" 1
1133 1 109 ARG QB 1 111 TYR H . . 5.340 4.960 4.355 5.356 0.016 18 0 "[ . 1 . 2]" 1
1134 1 110 ALA H 1 110 ALA MB . . 3.120 2.517 2.335 2.752 . 0 0 "[ . 1 . 2]" 1
1135 1 110 ALA H 1 111 TYR H . . 4.670 4.280 3.998 4.506 . 0 0 "[ . 1 . 2]" 1
1136 1 110 ALA HA 1 111 TYR H . . 3.180 2.171 2.141 2.232 . 0 0 "[ . 1 . 2]" 1
1137 1 110 ALA HA 1 122 VAL QG . . 5.440 4.498 4.061 4.930 . 0 0 "[ . 1 . 2]" 1
1138 1 110 ALA HA 1 123 PHE H . . 5.370 4.779 4.545 5.049 . 0 0 "[ . 1 . 2]" 1
1139 1 110 ALA HA 1 124 ARG QD . . 5.340 4.305 3.321 5.058 . 0 0 "[ . 1 . 2]" 1
1140 1 110 ALA HA 1 124 ARG HG2 . . 4.820 2.969 2.205 4.349 . 0 0 "[ . 1 . 2]" 1
1141 1 110 ALA HA 1 124 ARG QG . . 4.110 2.723 2.194 3.173 . 0 0 "[ . 1 . 2]" 1
1142 1 110 ALA HA 1 124 ARG HG3 . . 4.820 3.841 2.724 4.692 . 0 0 "[ . 1 . 2]" 1
1143 1 110 ALA HA 1 125 GLY H . . 4.070 3.644 3.424 3.869 . 0 0 "[ . 1 . 2]" 1
1144 1 110 ALA MB 1 111 TYR H . . 3.450 3.094 2.773 3.410 . 0 0 "[ . 1 . 2]" 1
1145 1 110 ALA MB 1 122 VAL QG . . 3.640 3.321 2.911 3.665 0.025 19 0 "[ . 1 . 2]" 1
1146 1 110 ALA MB 1 123 PHE H . . 5.240 4.597 4.099 5.069 . 0 0 "[ . 1 . 2]" 1
1147 1 110 ALA MB 1 124 ARG HD2 . . 4.640 3.333 2.051 4.635 . 0 0 "[ . 1 . 2]" 1
1148 1 110 ALA MB 1 124 ARG QD . . 3.910 2.873 1.831 3.914 0.004 2 0 "[ . 1 . 2]" 1
1149 1 110 ALA MB 1 124 ARG HD3 . . 4.640 3.258 1.880 4.622 . 0 0 "[ . 1 . 2]" 1
1150 1 110 ALA MB 1 124 ARG QG . . 3.850 2.018 1.804 2.341 . 0 0 "[ . 1 . 2]" 1
1151 1 110 ALA MB 1 125 GLY H . . 4.750 4.206 3.670 4.676 . 0 0 "[ . 1 . 2]" 1
1152 1 111 TYR H 1 112 LYS H . . 4.470 4.426 4.362 4.480 0.010 4 0 "[ . 1 . 2]" 1
1153 1 111 TYR H 1 112 LYS QG . . 5.340 4.645 4.091 5.320 . 0 0 "[ . 1 . 2]" 1
1154 1 111 TYR H 1 122 VAL HA . . 5.340 4.996 4.496 5.350 0.010 9 0 "[ . 1 . 2]" 1
1155 1 111 TYR H 1 122 VAL QG . . 4.440 3.811 2.960 4.348 . 0 0 "[ . 1 . 2]" 1
1156 1 111 TYR H 1 123 PHE H . . 3.880 3.300 2.883 3.751 . 0 0 "[ . 1 . 2]" 1
1157 1 111 TYR H 1 124 ARG HA . . 4.490 3.253 2.862 3.605 . 0 0 "[ . 1 . 2]" 1
1158 1 111 TYR H 1 124 ARG HB3 . . 5.390 5.185 4.572 5.404 0.014 8 0 "[ . 1 . 2]" 1
1159 1 111 TYR H 1 124 ARG QG . . 3.960 3.687 3.212 3.969 0.009 18 0 "[ . 1 . 2]" 1
1160 1 111 TYR QB 1 112 LYS H . . 3.500 2.462 2.221 2.803 . 0 0 "[ . 1 . 2]" 1
1161 1 111 TYR HB2 1 112 LYS H . . 4.030 2.586 2.243 3.332 . 0 0 "[ . 1 . 2]" 1
1162 1 111 TYR HB3 1 112 LYS H . . 4.030 3.601 2.283 4.043 0.013 15 0 "[ . 1 . 2]" 1
1163 1 112 LYS H 1 113 ILE H . . 4.530 4.307 4.175 4.409 . 0 0 "[ . 1 . 2]" 1
1164 1 112 LYS H 1 123 PHE H . . 5.200 4.834 4.586 5.069 . 0 0 "[ . 1 . 2]" 1
1165 1 112 LYS HA 1 113 ILE MD . . 5.220 4.201 3.061 4.991 . 0 0 "[ . 1 . 2]" 1
1166 1 112 LYS HA 1 120 VAL QG . . 4.700 3.769 3.408 4.346 . 0 0 "[ . 1 . 2]" 1
1167 1 112 LYS HA 1 122 VAL HA . . 4.940 2.268 1.995 2.612 . 0 0 "[ . 1 . 2]" 1
1168 1 112 LYS HA 1 122 VAL QG . . 5.020 3.301 2.293 3.733 . 0 0 "[ . 1 . 2]" 1
1169 1 112 LYS HA 1 123 PHE H . . 3.990 3.116 2.771 3.441 . 0 0 "[ . 1 . 2]" 1
1170 1 112 LYS QB 1 113 ILE H . . 4.160 3.091 2.716 3.510 . 0 0 "[ . 1 . 2]" 1
1171 1 112 LYS HB2 1 113 ILE H . . 4.860 3.788 2.805 4.511 . 0 0 "[ . 1 . 2]" 1
1172 1 112 LYS HB3 1 113 ILE H . . 4.860 3.467 3.076 3.987 . 0 0 "[ . 1 . 2]" 1
1173 1 112 LYS QG 1 122 VAL HA . . 5.340 2.972 1.934 4.159 . 0 0 "[ . 1 . 2]" 1
1174 1 112 LYS QG 1 123 PHE H . . 4.630 3.936 2.805 4.740 0.110 19 0 "[ . 1 . 2]" 1
1175 1 113 ILE H 1 113 ILE HB . . 3.790 2.686 2.537 2.752 . 0 0 "[ . 1 . 2]" 1
1176 1 113 ILE H 1 113 ILE MD . . 3.750 3.207 2.465 3.795 0.045 7 0 "[ . 1 . 2]" 1
1177 1 113 ILE H 1 113 ILE HG12 . . 4.580 3.749 3.245 4.260 . 0 0 "[ . 1 . 2]" 1
1178 1 113 ILE H 1 113 ILE QG . . 3.980 2.480 2.105 2.858 . 0 0 "[ . 1 . 2]" 1
1179 1 113 ILE H 1 113 ILE HG13 . . 4.580 2.517 2.133 2.904 . 0 0 "[ . 1 . 2]" 1
1180 1 113 ILE H 1 113 ILE MG . . 4.140 3.846 3.805 3.879 . 0 0 "[ . 1 . 2]" 1
1181 1 113 ILE H 1 120 VAL HA . . 5.450 4.852 4.518 5.140 . 0 0 "[ . 1 . 2]" 1
1182 1 113 ILE H 1 120 VAL QG . . 3.820 3.306 2.953 3.588 . 0 0 "[ . 1 . 2]" 1
1183 1 113 ILE H 1 121 ASP H . . 3.740 3.079 2.749 3.310 . 0 0 "[ . 1 . 2]" 1
1184 1 113 ILE H 1 121 ASP HB2 . . 5.250 4.259 3.484 4.947 . 0 0 "[ . 1 . 2]" 1
1185 1 113 ILE H 1 121 ASP QB . . 4.590 3.424 3.042 4.007 . 0 0 "[ . 1 . 2]" 1
1186 1 113 ILE H 1 121 ASP HB3 . . 5.250 3.697 3.100 4.350 . 0 0 "[ . 1 . 2]" 1
1187 1 113 ILE H 1 122 VAL HA . . 4.220 3.617 2.982 3.981 . 0 0 "[ . 1 . 2]" 1
1188 1 113 ILE H 1 123 PHE H . . 4.830 4.658 4.313 4.841 0.011 20 0 "[ . 1 . 2]" 1
1189 1 113 ILE H 1 123 PHE QD . . 4.720 4.153 3.414 4.742 0.022 2 0 "[ . 1 . 2]" 1
1190 1 113 ILE HA 1 113 ILE MD . . 4.110 3.823 3.736 3.885 . 0 0 "[ . 1 . 2]" 1
1191 1 113 ILE HA 1 114 ARG H . . 3.260 2.175 2.141 2.216 . 0 0 "[ . 1 . 2]" 1
1192 1 113 ILE HB 1 113 ILE MD . . 3.160 2.259 2.071 2.428 . 0 0 "[ . 1 . 2]" 1
1193 1 113 ILE HB 1 120 VAL QG . . 4.950 4.508 4.244 4.796 . 0 0 "[ . 1 . 2]" 1
1194 1 113 ILE HB 1 121 ASP HB2 . . 5.480 3.670 2.972 4.145 . 0 0 "[ . 1 . 2]" 1
1195 1 113 ILE HB 1 121 ASP QB . . 4.700 3.134 2.806 3.724 . 0 0 "[ . 1 . 2]" 1
1196 1 113 ILE HB 1 121 ASP HB3 . . 5.480 3.594 2.899 4.334 . 0 0 "[ . 1 . 2]" 1
1197 1 113 ILE MD 1 113 ILE MG . . 2.990 2.416 1.917 2.969 . 0 0 "[ . 1 . 2]" 1
1198 1 113 ILE MD 1 121 ASP HB2 . . 4.690 4.263 3.625 4.699 0.009 2 0 "[ . 1 . 2]" 1
1199 1 113 ILE MD 1 121 ASP QB . . 4.110 3.343 2.519 3.937 . 0 0 "[ . 1 . 2]" 1
1200 1 113 ILE MD 1 121 ASP HB3 . . 4.690 3.550 2.560 4.317 . 0 0 "[ . 1 . 2]" 1
1201 1 113 ILE MD 1 123 PHE H . . 5.500 4.941 3.894 5.513 0.013 11 0 "[ . 1 . 2]" 1
1202 1 113 ILE QG 1 113 ILE MG . . 3.310 2.154 1.941 2.302 . 0 0 "[ . 1 . 2]" 1
1203 1 113 ILE QG 1 114 ARG H . . 4.640 4.247 4.038 4.353 . 0 0 "[ . 1 . 2]" 1
1204 1 113 ILE QG 1 120 VAL QG . . 5.280 4.885 4.596 5.291 0.011 16 0 "[ . 1 . 2]" 1
1205 1 113 ILE MG 1 114 ARG H . . 3.530 2.308 2.076 2.633 . 0 0 "[ . 1 . 2]" 1
1206 1 113 ILE MG 1 121 ASP H . . 4.710 4.573 4.210 4.714 0.004 12 0 "[ . 1 . 2]" 1
1207 1 113 ILE MG 1 121 ASP HB2 . . 5.500 4.763 4.123 5.276 . 0 0 "[ . 1 . 2]" 1
1208 1 113 ILE MG 1 121 ASP HB3 . . 5.500 4.952 4.330 5.502 0.002 8 0 "[ . 1 . 2]" 1
1209 1 114 ARG H 1 120 VAL HA . . 5.500 4.946 4.795 5.193 . 0 0 "[ . 1 . 2]" 1
1210 1 114 ARG H 1 120 VAL QG . . 4.150 3.993 3.549 4.162 0.012 17 0 "[ . 1 . 2]" 1
1211 1 114 ARG HA 1 115 PHE H . . 3.270 2.161 2.140 2.196 . 0 0 "[ . 1 . 2]" 1
1212 1 114 ARG HA 1 120 VAL HA . . 4.460 2.517 2.276 2.813 . 0 0 "[ . 1 . 2]" 1
1213 1 114 ARG HA 1 120 VAL QG . . 4.670 2.626 2.214 2.949 . 0 0 "[ . 1 . 2]" 1
1214 1 114 ARG HA 1 121 ASP H . . 4.110 3.746 3.388 3.980 . 0 0 "[ . 1 . 2]" 1
1215 1 115 PHE H 1 115 PHE HB2 . . 4.090 2.233 2.188 2.292 . 0 0 "[ . 1 . 2]" 1
1216 1 115 PHE H 1 115 PHE QB . . 3.380 2.209 2.166 2.265 . 0 0 "[ . 1 . 2]" 1
1217 1 115 PHE H 1 115 PHE HB3 . . 4.090 3.510 3.484 3.545 . 0 0 "[ . 1 . 2]" 1
1218 1 115 PHE H 1 115 PHE QD . . 3.530 2.721 2.374 3.532 0.002 2 0 "[ . 1 . 2]" 1
1219 1 115 PHE H 1 117 ASN H . . 5.170 4.887 4.655 5.164 . 0 0 "[ . 1 . 2]" 1
1220 1 115 PHE H 1 118 GLY HA2 . . 5.500 5.320 4.776 5.510 0.010 17 0 "[ . 1 . 2]" 1
1221 1 115 PHE H 1 119 THR H . . 4.420 4.098 3.721 4.420 . 0 0 "[ . 1 . 2]" 1
1222 1 115 PHE H 1 119 THR HA . . 5.500 5.081 4.915 5.284 . 0 0 "[ . 1 . 2]" 1
1223 1 115 PHE H 1 119 THR HB . . 5.500 5.344 4.881 5.530 0.030 20 0 "[ . 1 . 2]" 1
1224 1 115 PHE H 1 120 VAL HA . . 4.060 2.873 2.671 3.048 . 0 0 "[ . 1 . 2]" 1
1225 1 115 PHE H 1 120 VAL MG1 . . 5.500 5.156 4.441 5.457 . 0 0 "[ . 1 . 2]" 1
1226 1 115 PHE H 1 120 VAL QG . . 4.210 3.899 3.201 4.181 . 0 0 "[ . 1 . 2]" 1
1227 1 115 PHE H 1 120 VAL MG2 . . 5.500 4.042 3.242 4.378 . 0 0 "[ . 1 . 2]" 1
1228 1 115 PHE H 1 121 ASP H . . 4.610 4.330 3.949 4.613 0.003 12 0 "[ . 1 . 2]" 1
1229 1 115 PHE HA 1 116 PRO HG3 . . 5.440 4.537 4.525 4.542 . 0 0 "[ . 1 . 2]" 1
1230 1 115 PHE QB 1 116 PRO QD . . 4.210 1.988 1.959 2.065 . 0 0 "[ . 1 . 2]" 1
1231 1 115 PHE QB 1 117 ASN H . . 3.470 2.255 2.195 2.369 . 0 0 "[ . 1 . 2]" 1
1232 1 115 PHE QB 1 118 GLY HA2 . . 5.340 5.063 4.706 5.289 . 0 0 "[ . 1 . 2]" 1
1233 1 115 PHE QB 1 119 THR H . . 3.900 3.002 2.692 3.301 . 0 0 "[ . 1 . 2]" 1
1234 1 115 PHE QB 1 119 THR HB . . 5.340 4.137 3.774 4.393 . 0 0 "[ . 1 . 2]" 1
1235 1 115 PHE QB 1 120 VAL HA . . 4.790 3.941 3.481 4.312 . 0 0 "[ . 1 . 2]" 1
1236 1 115 PHE HB2 1 117 ASN H . . 4.120 3.534 3.324 3.864 . 0 0 "[ . 1 . 2]" 1
1237 1 115 PHE HB2 1 118 GLY H . . 4.310 3.907 3.807 4.009 . 0 0 "[ . 1 . 2]" 1
1238 1 115 PHE HB2 1 119 THR H . . 4.740 3.156 2.846 3.486 . 0 0 "[ . 1 . 2]" 1
1239 1 115 PHE HB3 1 117 ASN H . . 4.120 2.282 2.215 2.390 . 0 0 "[ . 1 . 2]" 1
1240 1 115 PHE HB3 1 118 GLY H . . 4.310 3.736 3.410 3.934 . 0 0 "[ . 1 . 2]" 1
1241 1 115 PHE HB3 1 119 THR H . . 4.740 3.771 3.307 4.084 . 0 0 "[ . 1 . 2]" 1
1242 1 115 PHE QD 1 117 ASN H . . 4.340 3.912 3.644 4.295 . 0 0 "[ . 1 . 2]" 1
1243 1 115 PHE QD 1 120 VAL H . . 4.870 4.801 4.445 4.882 0.012 5 0 "[ . 1 . 2]" 1
1244 1 115 PHE QD 1 120 VAL HA . . 4.770 3.317 2.923 3.769 . 0 0 "[ . 1 . 2]" 1
1245 1 115 PHE QD 1 121 ASP H . . 3.890 3.473 2.909 3.896 0.006 19 0 "[ . 1 . 2]" 1
1246 1 115 PHE QD 1 121 ASP HA . . 5.500 5.227 4.822 5.511 0.011 17 0 "[ . 1 . 2]" 1
1247 1 116 PRO QD 1 117 ASN H . . 4.200 2.670 2.606 2.752 . 0 0 "[ . 1 . 2]" 1
1248 1 116 PRO HG2 1 117 ASN H . . 3.910 2.747 2.450 2.984 . 0 0 "[ . 1 . 2]" 1
1249 1 116 PRO HG2 1 118 GLY H . . 5.240 5.025 4.810 5.199 . 0 0 "[ . 1 . 2]" 1
1250 1 117 ASN H 1 118 GLY H . . 3.330 2.493 2.412 2.560 . 0 0 "[ . 1 . 2]" 1
1251 1 117 ASN QB 1 118 GLY HA2 . . 5.340 4.948 4.892 5.053 . 0 0 "[ . 1 . 2]" 1
1252 1 117 ASN QB 1 118 GLY HA3 . . 4.760 4.364 4.312 4.642 . 0 0 "[ . 1 . 2]" 1
1253 1 117 ASN QB 1 119 THR H . . 4.190 2.859 2.662 3.048 . 0 0 "[ . 1 . 2]" 1
1254 1 117 ASN HB2 1 118 GLY H . . 4.610 3.525 3.321 4.265 . 0 0 "[ . 1 . 2]" 1
1255 1 117 ASN HB2 1 119 THR H . . 5.000 3.183 2.702 4.581 . 0 0 "[ . 1 . 2]" 1
1256 1 117 ASN HB3 1 118 GLY H . . 4.610 4.029 3.332 4.403 . 0 0 "[ . 1 . 2]" 1
1257 1 117 ASN HB3 1 119 THR H . . 5.000 3.691 2.719 4.146 . 0 0 "[ . 1 . 2]" 1
1258 1 118 GLY H 1 119 THR H . . 3.160 2.395 2.252 2.575 . 0 0 "[ . 1 . 2]" 1
1259 1 118 GLY H 1 119 THR MG . . 4.320 4.023 3.679 4.326 0.006 6 0 "[ . 1 . 2]" 1
1260 1 119 THR H 1 119 THR HB . . 3.680 3.371 2.708 3.686 0.006 8 0 "[ . 1 . 2]" 1
1261 1 119 THR H 1 119 THR MG . . 3.280 2.199 1.996 2.632 . 0 0 "[ . 1 . 2]" 1
1262 1 119 THR H 1 120 VAL H . . 4.720 4.500 4.399 4.617 . 0 0 "[ . 1 . 2]" 1
1263 1 119 THR HA 1 119 THR MG . . 3.370 2.645 2.317 3.200 . 0 0 "[ . 1 . 2]" 1
1264 1 119 THR HA 1 120 VAL H . . 3.150 2.593 2.364 2.716 . 0 0 "[ . 1 . 2]" 1
1265 1 119 THR HA 1 120 VAL HB . . 4.950 4.278 4.171 4.495 . 0 0 "[ . 1 . 2]" 1
1266 1 119 THR HB 1 120 VAL H . . 3.380 2.582 1.949 3.538 0.158 20 0 "[ . 1 . 2]" 1
1267 1 119 THR MG 1 120 VAL H . . 3.870 3.332 2.471 3.871 0.001 16 0 "[ . 1 . 2]" 1
1268 1 120 VAL H 1 120 VAL HB . . 3.770 3.176 2.732 3.399 . 0 0 "[ . 1 . 2]" 1
1269 1 120 VAL H 1 120 VAL QG . . 3.770 2.452 2.164 3.190 . 0 0 "[ . 1 . 2]" 1
1270 1 120 VAL H 1 121 ASP QB . . 5.340 5.102 4.701 5.337 . 0 0 "[ . 1 . 2]" 1
1271 1 120 VAL HA 1 121 ASP H . . 3.350 2.205 2.163 2.288 . 0 0 "[ . 1 . 2]" 1
1272 1 120 VAL HA 1 121 ASP QB . . 5.220 3.978 3.891 4.085 . 0 0 "[ . 1 . 2]" 1
1273 1 120 VAL HB 1 121 ASP H . . 4.170 4.104 3.949 4.193 0.023 12 0 "[ . 1 . 2]" 1
1274 1 120 VAL QG 1 121 ASP H . . 3.780 2.237 2.001 2.523 . 0 0 "[ . 1 . 2]" 1
1275 1 120 VAL QG 1 121 ASP HA . . 4.150 3.399 3.184 3.505 . 0 0 "[ . 1 . 2]" 1
1276 1 120 VAL QG 1 121 ASP QB . . 4.750 3.887 3.810 3.955 . 0 0 "[ . 1 . 2]" 1
1277 1 120 VAL QG 1 122 VAL H . . 4.330 3.715 3.425 3.994 . 0 0 "[ . 1 . 2]" 1
1278 1 120 VAL MG1 1 121 ASP HA . . 5.040 3.771 3.206 4.108 . 0 0 "[ . 1 . 2]" 1
1279 1 120 VAL MG2 1 121 ASP HA . . 5.040 4.203 3.668 5.451 0.411 16 0 "[ . 1 . 2]" 1
1280 1 121 ASP H 1 121 ASP QB . . 3.570 2.464 2.288 2.659 . 0 0 "[ . 1 . 2]" 1
1281 1 121 ASP H 1 122 VAL H . . 4.410 4.262 4.065 4.408 . 0 0 "[ . 1 . 2]" 1
1282 1 121 ASP HA 1 122 VAL H . . 3.130 2.145 2.139 2.167 . 0 0 "[ . 1 . 2]" 1
1283 1 121 ASP HA 1 122 VAL HB . . 4.930 4.667 4.476 4.839 . 0 0 "[ . 1 . 2]" 1
1284 1 121 ASP HA 1 122 VAL QG . . 5.150 3.645 3.553 3.750 . 0 0 "[ . 1 . 2]" 1
1285 1 121 ASP QB 1 122 VAL H . . 3.980 3.625 3.293 3.828 . 0 0 "[ . 1 . 2]" 1
1286 1 122 VAL H 1 122 VAL HB . . 3.560 2.706 2.497 3.008 . 0 0 "[ . 1 . 2]" 1
1287 1 122 VAL H 1 122 VAL MG1 . . 4.600 3.070 1.918 3.849 . 0 0 "[ . 1 . 2]" 1
1288 1 122 VAL H 1 122 VAL QG . . 3.410 2.218 1.913 2.507 . 0 0 "[ . 1 . 2]" 1
1289 1 122 VAL H 1 122 VAL MG2 . . 4.600 2.979 2.311 3.853 . 0 0 "[ . 1 . 2]" 1
1290 1 122 VAL H 1 123 PHE H . . 4.650 4.504 4.383 4.583 . 0 0 "[ . 1 . 2]" 1
1291 1 122 VAL HA 1 123 PHE H . . 3.410 2.178 2.140 2.211 . 0 0 "[ . 1 . 2]" 1
1292 1 122 VAL HB 1 123 PHE H . . 4.320 4.071 3.920 4.241 . 0 0 "[ . 1 . 2]" 1
1293 1 122 VAL HB 1 123 PHE QD . . 5.500 5.438 5.064 5.548 0.048 19 0 "[ . 1 . 2]" 1
1294 1 122 VAL QG 1 123 PHE H . . 3.320 2.374 2.063 2.760 . 0 0 "[ . 1 . 2]" 1
1295 1 123 PHE H 1 123 PHE QB . . 3.650 2.630 2.521 3.093 . 0 0 "[ . 1 . 2]" 1
1296 1 123 PHE H 1 123 PHE QD . . 3.850 3.254 2.046 3.878 0.028 12 0 "[ . 1 . 2]" 1
1297 1 123 PHE H 1 123 PHE QE . . 5.500 5.362 4.095 5.529 0.029 12 0 "[ . 1 . 2]" 1
1298 1 123 PHE H 1 124 ARG H . . 4.430 4.394 4.360 4.448 0.018 10 0 "[ . 1 . 2]" 1
1299 1 123 PHE H 1 124 ARG HA . . 5.500 4.809 4.682 4.897 . 0 0 "[ . 1 . 2]" 1
1300 1 123 PHE H 1 124 ARG QG . . 5.110 4.029 3.649 4.398 . 0 0 "[ . 1 . 2]" 1
1301 1 123 PHE HA 1 124 ARG H . . 3.090 2.275 2.202 2.426 . 0 0 "[ . 1 . 2]" 1
1302 1 123 PHE QB 1 124 ARG H . . 3.450 2.791 2.457 3.021 . 0 0 "[ . 1 . 2]" 1
1303 1 123 PHE QD 1 124 ARG H . . 4.040 3.483 3.225 3.737 . 0 0 "[ . 1 . 2]" 1
1304 1 123 PHE QE 1 124 ARG H . . 5.500 5.472 5.230 5.558 0.058 12 0 "[ . 1 . 2]" 1
1305 1 124 ARG H 1 124 ARG HB2 . . 3.850 2.837 2.682 2.985 . 0 0 "[ . 1 . 2]" 1
1306 1 124 ARG H 1 124 ARG HB3 . . 4.110 3.854 3.793 3.937 . 0 0 "[ . 1 . 2]" 1
1307 1 124 ARG H 1 124 ARG HG2 . . 4.170 3.887 3.437 4.241 0.071 11 0 "[ . 1 . 2]" 1
1308 1 124 ARG H 1 124 ARG QG . . 3.620 2.871 2.556 3.215 . 0 0 "[ . 1 . 2]" 1
1309 1 124 ARG H 1 124 ARG HG3 . . 4.170 2.970 2.636 3.446 . 0 0 "[ . 1 . 2]" 1
1310 1 124 ARG H 1 125 GLY H . . 4.500 4.439 4.345 4.483 . 0 0 "[ . 1 . 2]" 1
1311 1 124 ARG HA 1 125 GLY H . . 3.310 2.396 2.201 2.525 . 0 0 "[ . 1 . 2]" 1
1312 1 124 ARG HB2 1 125 GLY H . . 3.900 3.475 3.114 3.886 . 0 0 "[ . 1 . 2]" 1
1313 1 124 ARG QG 1 125 GLY H . . 4.490 4.096 3.900 4.331 . 0 0 "[ . 1 . 2]" 1
1314 1 125 GLY H 1 126 TRP H . . 4.500 4.407 4.181 4.490 . 0 0 "[ . 1 . 2]" 1
1315 1 125 GLY H 1 146 VAL QG . . 5.100 4.640 4.093 5.058 . 0 0 "[ . 1 . 2]" 1
1316 1 126 TRP H 1 126 TRP HE1 . . 4.690 4.422 4.172 5.078 0.388 18 0 "[ . 1 . 2]" 1
1317 1 126 TRP H 1 146 VAL QG . . 3.850 3.334 2.733 3.894 0.044 18 0 "[ . 1 . 2]" 1
1318 1 126 TRP H 1 148 ASN HA . . 4.460 3.513 2.814 3.985 . 0 0 "[ . 1 . 2]" 1
1319 1 126 TRP H 1 148 ASN HB3 . . 4.610 4.542 4.018 4.767 0.157 18 0 "[ . 1 . 2]" 1
1320 1 126 TRP H 1 148 ASN QD . . 4.510 3.232 2.172 4.507 . 0 0 "[ . 1 . 2]" 1
1321 1 126 TRP H 1 149 VAL H . . 5.380 5.158 4.463 5.426 0.046 15 0 "[ . 1 . 2]" 1
1322 1 126 TRP HA 1 146 VAL QG . . 4.870 3.647 3.106 4.076 . 0 0 "[ . 1 . 2]" 1
1323 1 126 TRP HE1 1 149 VAL HB . . 4.510 3.388 2.278 4.673 0.163 18 0 "[ . 1 . 2]" 1
1324 1 126 TRP HE1 1 149 VAL QG . . 3.750 2.439 1.865 3.842 0.092 18 0 "[ . 1 . 2]" 1
1325 1 127 VAL HA 1 146 VAL HA . . 2.830 2.291 1.965 2.677 . 0 0 "[ . 1 . 2]" 1
1326 1 127 VAL HA 1 146 VAL MG1 . . 4.650 2.990 1.996 4.639 . 0 0 "[ . 1 . 2]" 1
1327 1 127 VAL HA 1 146 VAL QG . . 3.880 2.310 1.826 2.743 . 0 0 "[ . 1 . 2]" 1
1328 1 127 VAL HA 1 146 VAL MG2 . . 4.650 2.694 1.977 3.675 . 0 0 "[ . 1 . 2]" 1
1329 1 127 VAL HA 1 147 THR H . . 3.600 3.039 2.409 3.504 . 0 0 "[ . 1 . 2]" 1
1330 1 127 VAL HB 1 130 ILE QG . . 4.390 3.607 2.860 4.452 0.062 18 0 "[ . 1 . 2]" 1
1331 1 127 VAL QG 1 129 SER H . . 3.380 2.150 1.859 3.467 0.087 12 0 "[ . 1 . 2]" 1
1332 1 127 VAL QG 1 130 ILE MD . . 3.390 2.025 1.716 2.945 . 0 0 "[ . 1 . 2]" 1
1333 1 127 VAL QG 1 130 ILE QG . . 3.190 2.032 1.635 3.017 . 0 0 "[ . 1 . 2]" 1
1334 1 127 VAL QG 1 130 ILE MG . . 5.440 3.938 3.233 4.548 . 0 0 "[ . 1 . 2]" 1
1335 1 127 VAL QG 1 145 LYS H . . 4.060 3.547 2.901 4.088 0.028 14 0 "[ . 1 . 2]" 1
1336 1 127 VAL QG 1 146 VAL HA . . 4.870 2.582 1.926 3.165 . 0 0 "[ . 1 . 2]" 1
1337 1 127 VAL QG 1 146 VAL QG . . 4.270 2.005 1.718 2.584 . 0 0 "[ . 1 . 2]" 1
1338 1 127 VAL QG 1 147 THR H . . 4.450 3.819 2.697 4.395 . 0 0 "[ . 1 . 2]" 1
1339 1 127 VAL MG1 1 129 SER H . . 4.780 2.473 1.861 4.284 . 0 0 "[ . 1 . 2]" 1
1340 1 127 VAL MG1 1 130 ILE MD . . 4.350 2.305 1.852 3.664 . 0 0 "[ . 1 . 2]" 1
1341 1 127 VAL MG1 1 147 THR H . . 5.250 4.236 2.727 5.319 0.069 11 0 "[ . 1 . 2]" 1
1342 1 127 VAL MG2 1 129 SER H . . 4.780 3.985 1.909 4.807 0.027 18 0 "[ . 1 . 2]" 1
1343 1 127 VAL MG2 1 130 ILE MD . . 4.350 2.714 1.816 4.235 . 0 0 "[ . 1 . 2]" 1
1344 1 127 VAL MG2 1 147 THR H . . 5.250 4.723 3.840 5.270 0.020 15 0 "[ . 1 . 2]" 1
1345 1 128 SER QB 1 147 THR H . . 3.770 3.094 2.260 3.752 . 0 0 "[ . 1 . 2]" 1
1346 1 128 SER HB2 1 147 THR H . . 4.340 3.439 2.381 4.169 . 0 0 "[ . 1 . 2]" 1
1347 1 128 SER HB3 1 147 THR H . . 4.340 3.662 2.813 4.274 . 0 0 "[ . 1 . 2]" 1
1348 1 129 SER H 1 129 SER QB . . 3.320 2.676 2.242 2.901 . 0 0 "[ . 1 . 2]" 1
1349 1 129 SER H 1 130 ILE H . . 4.120 3.492 2.348 4.112 . 0 0 "[ . 1 . 2]" 1
1350 1 129 SER H 1 130 ILE QG . . 4.000 2.964 2.696 3.475 . 0 0 "[ . 1 . 2]" 1
1351 1 129 SER H 1 145 LYS H . . 4.450 4.063 3.159 4.549 0.099 18 0 "[ . 1 . 2]" 1
1352 1 129 SER H 1 146 VAL HA . . 4.370 4.110 3.783 4.432 0.062 15 0 "[ . 1 . 2]" 1
1353 1 129 SER H 1 147 THR H . . 4.570 4.549 3.821 4.624 0.054 15 0 "[ . 1 . 2]" 1
1354 1 129 SER HA 1 130 ILE H . . 3.460 2.350 2.150 2.964 . 0 0 "[ . 1 . 2]" 1
1355 1 129 SER QB 1 145 LYS H . . 4.210 2.195 1.850 2.937 . 0 0 "[ . 1 . 2]" 1
1356 1 129 SER QB 1 145 LYS HA . . 4.250 4.036 3.855 4.243 . 0 0 "[ . 1 . 2]" 1
1357 1 129 SER QB 1 145 LYS QB . . 3.160 2.061 1.896 2.298 . 0 0 "[ . 1 . 2]" 1
1358 1 129 SER QB 1 145 LYS QG . . 4.130 3.105 2.578 3.653 . 0 0 "[ . 1 . 2]" 1
1359 1 130 ILE H 1 130 ILE HB . . 4.130 2.753 2.491 2.907 . 0 0 "[ . 1 . 2]" 1
1360 1 130 ILE H 1 130 ILE HG12 . . 4.820 3.979 2.996 4.501 . 0 0 "[ . 1 . 2]" 1
1361 1 130 ILE H 1 130 ILE QG . . 4.040 3.028 2.487 3.264 . 0 0 "[ . 1 . 2]" 1
1362 1 130 ILE H 1 130 ILE HG13 . . 4.820 3.391 2.514 4.506 . 0 0 "[ . 1 . 2]" 1
1363 1 130 ILE H 1 130 ILE MG . . 4.150 3.871 3.783 3.932 . 0 0 "[ . 1 . 2]" 1
1364 1 130 ILE H 1 131 GLY H . . 4.460 4.172 4.038 4.432 . 0 0 "[ . 1 . 2]" 1
1365 1 130 ILE H 1 144 VAL QG . . 5.140 4.877 4.287 5.160 0.020 13 0 "[ . 1 . 2]" 1
1366 1 130 ILE HA 1 131 GLY H . . 3.500 2.154 2.143 2.226 . 0 0 "[ . 1 . 2]" 1
1367 1 130 ILE HA 1 144 VAL QG . . 4.180 3.315 2.253 3.663 . 0 0 "[ . 1 . 2]" 1
1368 1 130 ILE HB 1 130 ILE MD . . 3.750 2.560 2.245 3.227 . 0 0 "[ . 1 . 2]" 1
1369 1 130 ILE QG 1 130 ILE MG . . 3.160 2.265 2.122 2.388 . 0 0 "[ . 1 . 2]" 1
1370 1 130 ILE QG 1 144 VAL HA . . 5.340 4.177 3.520 5.059 . 0 0 "[ . 1 . 2]" 1
1371 1 130 ILE QG 1 144 VAL QG . . 3.280 2.534 1.920 3.332 0.052 14 0 "[ . 1 . 2]" 1
1372 1 130 ILE QG 1 145 LYS H . . 4.850 4.162 3.666 4.852 0.002 3 0 "[ . 1 . 2]" 1
1373 1 130 ILE MG 1 131 GLY H . . 4.110 2.698 2.047 2.927 . 0 0 "[ . 1 . 2]" 1
1374 1 131 GLY H 1 132 LYS H . . 4.640 3.979 3.274 4.528 . 0 0 "[ . 1 . 2]" 1
1375 1 131 GLY HA2 1 132 LYS H . . 3.460 3.013 2.408 3.425 . 0 0 "[ . 1 . 2]" 1
1376 1 131 GLY HA3 1 132 LYS H . . 3.460 2.269 2.136 2.727 . 0 0 "[ . 1 . 2]" 1
1377 1 132 LYS H 1 132 LYS HB2 . . 3.730 2.894 2.231 3.730 . 0 0 "[ . 1 . 2]" 1
1378 1 132 LYS H 1 132 LYS QB . . 3.090 2.486 2.208 3.094 0.004 17 0 "[ . 1 . 2]" 1
1379 1 132 LYS H 1 132 LYS HB3 . . 3.730 3.068 2.564 3.691 . 0 0 "[ . 1 . 2]" 1
1380 1 132 LYS H 1 132 LYS HG2 . . 5.230 3.459 1.974 4.702 . 0 0 "[ . 1 . 2]" 1
1381 1 132 LYS H 1 132 LYS QG . . 4.450 3.035 1.956 4.107 . 0 0 "[ . 1 . 2]" 1
1382 1 132 LYS H 1 132 LYS HG3 . . 5.230 3.688 2.451 4.630 . 0 0 "[ . 1 . 2]" 1
1383 1 132 LYS HA 1 133 ALA HA . . 5.180 4.362 4.335 4.380 . 0 0 "[ . 1 . 2]" 1
1384 1 132 LYS QB 1 133 ALA H . . 4.120 2.984 2.419 3.687 . 0 0 "[ . 1 . 2]" 1
1385 1 132 LYS HB2 1 133 ALA H . . 4.720 3.645 2.451 4.416 . 0 0 "[ . 1 . 2]" 1
1386 1 132 LYS HB3 1 133 ALA H . . 4.720 3.509 2.455 4.253 . 0 0 "[ . 1 . 2]" 1
1387 1 133 ALA H 1 133 ALA MB . . 3.500 2.277 2.084 2.400 . 0 0 "[ . 1 . 2]" 1
1388 1 133 ALA H 1 134 VAL H . . 4.610 4.535 4.440 4.601 . 0 0 "[ . 1 . 2]" 1
1389 1 133 ALA HA 1 134 VAL H . . 3.180 2.188 2.142 2.196 . 0 0 "[ . 1 . 2]" 1
1390 1 133 ALA HA 1 134 VAL QG . . 4.180 3.498 3.363 3.609 . 0 0 "[ . 1 . 2]" 1
1391 1 133 ALA HA 1 140 ILE MG . . 4.480 3.556 2.756 3.844 . 0 0 "[ . 1 . 2]" 1
1392 1 133 ALA HA 1 142 ARG QB . . 3.880 2.195 1.975 3.236 . 0 0 "[ . 1 . 2]" 1
1393 1 133 ALA MB 1 134 VAL H . . 3.400 2.966 2.914 3.282 . 0 0 "[ . 1 . 2]" 1
1394 1 133 ALA MB 1 140 ILE HB . . 4.940 3.812 3.274 4.350 . 0 0 "[ . 1 . 2]" 1
1395 1 133 ALA MB 1 140 ILE MG . . 2.780 1.799 1.715 2.080 . 0 0 "[ . 1 . 2]" 1
1396 1 134 VAL H 1 134 VAL HB . . 3.440 2.572 2.475 2.630 . 0 0 "[ . 1 . 2]" 1
1397 1 134 VAL H 1 134 VAL QG . . 3.190 2.323 2.142 2.537 . 0 0 "[ . 1 . 2]" 1
1398 1 134 VAL H 1 135 THR H . . 4.620 4.491 4.272 4.589 . 0 0 "[ . 1 . 2]" 1
1399 1 134 VAL H 1 141 THR H . . 3.530 3.173 2.829 3.357 . 0 0 "[ . 1 . 2]" 1
1400 1 134 VAL H 1 141 THR HB . . 5.500 5.136 4.722 5.323 . 0 0 "[ . 1 . 2]" 1
1401 1 134 VAL H 1 142 ARG HA . . 3.920 3.785 3.583 3.960 0.040 19 0 "[ . 1 . 2]" 1
1402 1 134 VAL H 1 142 ARG QB . . 3.840 3.190 2.718 3.646 . 0 0 "[ . 1 . 2]" 1
1403 1 134 VAL HA 1 134 VAL MG1 . . 3.340 2.320 2.226 2.386 . 0 0 "[ . 1 . 2]" 1
1404 1 134 VAL HA 1 134 VAL QG . . 2.850 2.092 2.050 2.147 . 0 0 "[ . 1 . 2]" 1
1405 1 134 VAL HA 1 134 VAL MG2 . . 3.340 2.383 2.311 2.462 . 0 0 "[ . 1 . 2]" 1
1406 1 134 VAL HA 1 135 THR H . . 2.860 2.165 2.140 2.233 . 0 0 "[ . 1 . 2]" 1
1407 1 134 VAL HB 1 135 THR H . . 4.330 4.104 3.852 4.304 . 0 0 "[ . 1 . 2]" 1
1408 1 134 VAL HB 1 135 THR HA . . 5.280 4.857 4.693 5.018 . 0 0 "[ . 1 . 2]" 1
1409 1 134 VAL HB 1 136 ALA MB . . 4.830 4.614 4.352 4.850 0.020 5 0 "[ . 1 . 2]" 1
1410 1 134 VAL HB 1 141 THR H . . 4.030 3.509 3.045 3.718 . 0 0 "[ . 1 . 2]" 1
1411 1 134 VAL HB 1 141 THR HB . . 5.230 4.638 4.075 5.186 . 0 0 "[ . 1 . 2]" 1
1412 1 134 VAL QG 1 135 THR H . . 3.070 2.519 2.001 2.987 . 0 0 "[ . 1 . 2]" 1
1413 1 134 VAL QG 1 136 ALA HA . . 4.890 4.638 4.542 4.776 . 0 0 "[ . 1 . 2]" 1
1414 1 135 THR H 1 135 THR HB . . 3.170 2.709 2.601 2.826 . 0 0 "[ . 1 . 2]" 1
1415 1 135 THR H 1 135 THR MG . . 3.870 3.842 3.769 3.887 0.017 11 0 "[ . 1 . 2]" 1
1416 1 135 THR H 1 141 THR H . . 4.970 4.893 4.808 4.978 0.008 16 0 "[ . 1 . 2]" 1
1417 1 135 THR HA 1 135 THR MG . . 3.260 2.240 2.133 2.327 . 0 0 "[ . 1 . 2]" 1
1418 1 135 THR HA 1 136 ALA H . . 2.780 2.162 2.149 2.175 . 0 0 "[ . 1 . 2]" 1
1419 1 135 THR HA 1 139 VAL H . . 4.820 4.364 4.235 4.423 . 0 0 "[ . 1 . 2]" 1
1420 1 135 THR HA 1 140 ILE HG12 . . 4.660 2.974 2.351 3.894 . 0 0 "[ . 1 . 2]" 1
1421 1 135 THR HA 1 140 ILE QG . . 4.040 2.860 2.327 3.324 . 0 0 "[ . 1 . 2]" 1
1422 1 135 THR HA 1 140 ILE HG13 . . 4.660 4.121 2.748 4.576 . 0 0 "[ . 1 . 2]" 1
1423 1 135 THR HA 1 140 ILE MG . . 3.850 3.060 2.347 3.780 . 0 0 "[ . 1 . 2]" 1
1424 1 135 THR HB 1 136 ALA H . . 4.050 4.012 3.937 4.055 0.005 11 0 "[ . 1 . 2]" 1
1425 1 135 THR HB 1 140 ILE HA . . 5.470 5.088 4.863 5.471 0.001 20 0 "[ . 1 . 2]" 1
1426 1 135 THR HB 1 140 ILE QG . . 5.200 4.362 3.917 5.054 . 0 0 "[ . 1 . 2]" 1
1427 1 135 THR MG 1 136 ALA H . . 3.160 2.450 2.240 2.726 . 0 0 "[ . 1 . 2]" 1
1428 1 135 THR MG 1 136 ALA HA . . 3.970 3.637 3.519 3.813 . 0 0 "[ . 1 . 2]" 1
1429 1 135 THR MG 1 137 LYS H . . 4.550 4.468 4.263 4.551 0.001 7 0 "[ . 1 . 2]" 1
1430 1 135 THR MG 1 138 GLU H . . 3.950 3.519 3.402 3.585 . 0 0 "[ . 1 . 2]" 1
1431 1 135 THR MG 1 138 GLU HA . . 3.870 3.370 3.304 3.427 . 0 0 "[ . 1 . 2]" 1
1432 1 135 THR MG 1 139 VAL H . . 3.780 3.143 3.015 3.381 . 0 0 "[ . 1 . 2]" 1
1433 1 136 ALA H 1 136 ALA MB . . 3.020 2.763 2.757 2.768 . 0 0 "[ . 1 . 2]" 1
1434 1 136 ALA H 1 137 LYS QB . . 5.190 4.774 4.699 4.836 . 0 0 "[ . 1 . 2]" 1
1435 1 136 ALA H 1 139 VAL H . . 3.200 2.730 2.678 2.765 . 0 0 "[ . 1 . 2]" 1
1436 1 136 ALA H 1 139 VAL HB . . 4.290 3.899 3.712 4.058 . 0 0 "[ . 1 . 2]" 1
1437 1 136 ALA H 1 140 ILE H . . 4.900 4.597 4.317 4.863 . 0 0 "[ . 1 . 2]" 1
1438 1 136 ALA H 1 141 THR H . . 4.820 4.745 4.591 4.849 0.029 10 0 "[ . 1 . 2]" 1
1439 1 136 ALA HA 1 137 LYS H . . 3.370 2.163 2.143 2.173 . 0 0 "[ . 1 . 2]" 1
1440 1 136 ALA HA 1 137 LYS HA . . 4.410 4.370 4.364 4.374 . 0 0 "[ . 1 . 2]" 1
1441 1 136 ALA HA 1 137 LYS QB . . 4.610 4.374 4.322 4.437 . 0 0 "[ . 1 . 2]" 1
1442 1 136 ALA HA 1 137 LYS QD . . 4.460 3.467 3.329 3.628 . 0 0 "[ . 1 . 2]" 1
1443 1 136 ALA MB 1 137 LYS H . . 3.400 3.055 3.002 3.188 . 0 0 "[ . 1 . 2]" 1
1444 1 136 ALA MB 1 139 VAL H . . 4.240 4.131 4.067 4.208 . 0 0 "[ . 1 . 2]" 1
1445 1 136 ALA MB 1 139 VAL HB . . 3.960 3.974 3.918 4.002 0.042 19 0 "[ . 1 . 2]" 1
1446 1 137 LYS H 1 137 LYS QB . . 3.580 3.204 3.172 3.263 . 0 0 "[ . 1 . 2]" 1
1447 1 137 LYS H 1 137 LYS QD . . 4.360 2.448 2.210 2.581 . 0 0 "[ . 1 . 2]" 1
1448 1 137 LYS H 1 138 GLU H . . 3.860 2.883 2.805 2.944 . 0 0 "[ . 1 . 2]" 1
1449 1 137 LYS H 1 138 GLU HA . . 5.180 5.092 5.028 5.135 . 0 0 "[ . 1 . 2]" 1
1450 1 137 LYS H 1 139 VAL HB . . 5.500 5.458 5.416 5.501 0.001 16 0 "[ . 1 . 2]" 1
1451 1 137 LYS HA 1 137 LYS QB . . 2.580 2.440 2.406 2.455 . 0 0 "[ . 1 . 2]" 1
1452 1 137 LYS HA 1 137 LYS HD2 . . 4.700 3.345 2.980 4.118 . 0 0 "[ . 1 . 2]" 1
1453 1 137 LYS HA 1 137 LYS QD . . 3.950 3.150 2.899 3.329 . 0 0 "[ . 1 . 2]" 1
1454 1 137 LYS HA 1 137 LYS HD3 . . 4.700 4.040 3.340 4.413 . 0 0 "[ . 1 . 2]" 1
1455 1 137 LYS HA 1 137 LYS HE2 . . 5.500 4.923 3.900 5.475 . 0 0 "[ . 1 . 2]" 1
1456 1 137 LYS HA 1 137 LYS QE . . 4.810 4.340 3.791 4.648 . 0 0 "[ . 1 . 2]" 1
1457 1 137 LYS HA 1 137 LYS HE3 . . 5.500 4.979 4.564 5.398 . 0 0 "[ . 1 . 2]" 1
1458 1 137 LYS HA 1 137 LYS QG . . 2.920 2.248 2.194 2.297 . 0 0 "[ . 1 . 2]" 1
1459 1 137 LYS HA 1 138 GLU H . . 3.300 2.681 2.631 2.754 . 0 0 "[ . 1 . 2]" 1
1460 1 137 LYS HA 1 138 GLU HG3 . . 3.780 3.379 3.320 3.447 . 0 0 "[ . 1 . 2]" 1
1461 1 137 LYS HA 1 139 VAL H . . 4.300 4.262 4.220 4.302 0.002 20 0 "[ . 1 . 2]" 1
1462 1 137 LYS QB 1 137 LYS QD . . 2.600 2.170 2.070 2.403 . 0 0 "[ . 1 . 2]" 1
1463 1 137 LYS QB 1 137 LYS QE . . 4.210 3.471 2.105 3.784 . 0 0 "[ . 1 . 2]" 1
1464 1 137 LYS QB 1 139 VAL H . . 4.230 3.697 3.552 3.761 . 0 0 "[ . 1 . 2]" 1
1465 1 137 LYS HB2 1 137 LYS HE2 . . 5.500 4.040 2.157 4.574 . 0 0 "[ . 1 . 2]" 1
1466 1 137 LYS HB2 1 137 LYS HE3 . . 5.500 4.437 3.277 4.722 . 0 0 "[ . 1 . 2]" 1
1467 1 137 LYS HB2 1 138 GLU H . . 5.320 4.370 4.313 4.404 . 0 0 "[ . 1 . 2]" 1
1468 1 137 LYS HB3 1 137 LYS HE2 . . 5.500 4.546 3.520 5.421 . 0 0 "[ . 1 . 2]" 1
1469 1 137 LYS HB3 1 137 LYS HE3 . . 5.500 4.959 3.928 5.476 . 0 0 "[ . 1 . 2]" 1
1470 1 137 LYS HB3 1 138 GLU H . . 5.320 4.371 4.354 4.396 . 0 0 "[ . 1 . 2]" 1
1471 1 137 LYS QD 1 139 VAL H . . 5.340 5.015 4.868 5.175 . 0 0 "[ . 1 . 2]" 1
1472 1 137 LYS QG 1 138 GLU HG3 . . 5.170 4.944 4.882 5.097 . 0 0 "[ . 1 . 2]" 1
1473 1 138 GLU H 1 138 GLU HG2 . . 3.580 2.844 2.761 2.961 . 0 0 "[ . 1 . 2]" 1
1474 1 138 GLU H 1 138 GLU HG3 . . 3.750 3.160 3.065 3.262 . 0 0 "[ . 1 . 2]" 1
1475 1 138 GLU H 1 139 VAL H . . 3.250 2.709 2.639 2.744 . 0 0 "[ . 1 . 2]" 1
1476 1 138 GLU H 1 139 VAL MG2 . . 4.700 4.448 4.373 4.592 . 0 0 "[ . 1 . 2]" 1
1477 1 138 GLU HA 1 138 GLU QB . . 2.480 2.294 2.286 2.299 . 0 0 "[ . 1 . 2]" 1
1478 1 138 GLU HA 1 138 GLU HG2 . . 3.790 2.584 2.566 2.611 . 0 0 "[ . 1 . 2]" 1
1479 1 138 GLU HA 1 138 GLU HG3 . . 4.250 3.511 3.444 3.572 . 0 0 "[ . 1 . 2]" 1
1480 1 138 GLU HA 1 139 VAL H . . 3.380 2.980 2.941 3.054 . 0 0 "[ . 1 . 2]" 1
1481 1 138 GLU QB 1 139 VAL MG2 . . 4.280 3.035 2.932 3.113 . 0 0 "[ . 1 . 2]" 1
1482 1 138 GLU HG3 1 139 VAL MG2 . . 4.720 4.704 4.662 4.727 0.007 18 0 "[ . 1 . 2]" 1
1483 1 139 VAL H 1 139 VAL HB . . 2.960 2.781 2.714 2.818 . 0 0 "[ . 1 . 2]" 1
1484 1 139 VAL H 1 139 VAL MG2 . . 3.200 2.961 2.825 3.121 . 0 0 "[ . 1 . 2]" 1
1485 1 139 VAL H 1 140 ILE H . . 4.380 4.241 4.138 4.352 . 0 0 "[ . 1 . 2]" 1
1486 1 139 VAL H 1 140 ILE HA . . 5.320 4.695 4.610 4.778 . 0 0 "[ . 1 . 2]" 1
1487 1 139 VAL H 1 140 ILE QG . . 5.340 4.450 4.272 4.643 . 0 0 "[ . 1 . 2]" 1
1488 1 139 VAL HA 1 139 VAL MG1 . . 3.130 2.319 2.269 2.360 . 0 0 "[ . 1 . 2]" 1
1489 1 139 VAL HA 1 139 VAL MG2 . . 3.210 2.365 2.249 2.431 . 0 0 "[ . 1 . 2]" 1
1490 1 139 VAL HA 1 140 ILE H . . 3.110 2.153 2.141 2.187 . 0 0 "[ . 1 . 2]" 1
1491 1 139 VAL HB 1 140 ILE H . . 4.520 4.185 4.028 4.282 . 0 0 "[ . 1 . 2]" 1
1492 1 139 VAL MG1 1 140 ILE H . . 3.130 2.524 2.303 2.787 . 0 0 "[ . 1 . 2]" 1
1493 1 140 ILE H 1 140 ILE HB . . 3.510 2.680 2.504 2.825 . 0 0 "[ . 1 . 2]" 1
1494 1 140 ILE H 1 140 ILE HG12 . . 4.150 3.375 3.011 4.144 . 0 0 "[ . 1 . 2]" 1
1495 1 140 ILE H 1 140 ILE QG . . 3.530 2.204 1.972 2.976 . 0 0 "[ . 1 . 2]" 1
1496 1 140 ILE H 1 140 ILE HG13 . . 4.150 2.235 1.999 3.050 . 0 0 "[ . 1 . 2]" 1
1497 1 140 ILE HA 1 140 ILE HG12 . . 4.120 2.686 2.590 3.334 . 0 0 "[ . 1 . 2]" 1
1498 1 140 ILE HA 1 140 ILE QG . . 3.550 2.524 2.293 2.642 . 0 0 "[ . 1 . 2]" 1
1499 1 140 ILE HA 1 140 ILE HG13 . . 4.120 3.187 2.336 3.395 . 0 0 "[ . 1 . 2]" 1
1500 1 140 ILE HA 1 140 ILE MG . . 3.370 2.306 2.220 2.386 . 0 0 "[ . 1 . 2]" 1
1501 1 140 ILE HA 1 141 THR H . . 3.100 2.224 2.175 2.287 . 0 0 "[ . 1 . 2]" 1
1502 1 140 ILE MG 1 141 THR H . . 3.090 2.192 1.948 2.433 . 0 0 "[ . 1 . 2]" 1
1503 1 140 ILE MG 1 141 THR HA . . 5.030 3.594 3.284 3.874 . 0 0 "[ . 1 . 2]" 1
1504 1 141 THR H 1 141 THR HB . . 4.000 3.796 3.721 3.899 . 0 0 "[ . 1 . 2]" 1
1505 1 141 THR H 1 141 THR MG . . 3.700 3.389 3.084 3.570 . 0 0 "[ . 1 . 2]" 1
1506 1 141 THR H 1 142 ARG H . . 4.620 4.359 4.337 4.380 . 0 0 "[ . 1 . 2]" 1
1507 1 141 THR H 1 142 ARG QB . . 4.790 4.294 4.185 4.485 . 0 0 "[ . 1 . 2]" 1
1508 1 141 THR HA 1 141 THR MG . . 3.030 2.140 2.015 2.284 . 0 0 "[ . 1 . 2]" 1
1509 1 141 THR HA 1 142 ARG H . . 3.310 2.238 2.229 2.245 . 0 0 "[ . 1 . 2]" 1
1510 1 141 THR HB 1 142 ARG H . . 3.450 2.887 2.831 2.937 . 0 0 "[ . 1 . 2]" 1
1511 1 141 THR MG 1 142 ARG H . . 4.100 3.542 3.320 3.830 . 0 0 "[ . 1 . 2]" 1
1512 1 142 ARG H 1 142 ARG HB2 . . 3.980 3.453 2.925 4.009 0.029 3 0 "[ . 1 . 2]" 1
1513 1 142 ARG H 1 142 ARG QB . . 3.460 2.930 2.808 3.280 . 0 0 "[ . 1 . 2]" 1
1514 1 142 ARG H 1 142 ARG HB3 . . 3.980 3.210 2.955 3.624 . 0 0 "[ . 1 . 2]" 1
1515 1 142 ARG H 1 143 THR H . . 4.450 4.198 4.073 4.372 . 0 0 "[ . 1 . 2]" 1
1516 1 142 ARG HA 1 143 THR H . . 3.070 2.273 2.152 2.609 . 0 0 "[ . 1 . 2]" 1
1517 1 142 ARG QB 1 143 THR H . . 3.690 3.284 2.040 3.725 0.035 5 0 "[ . 1 . 2]" 1
1518 1 142 ARG QB 1 144 VAL H . . 5.340 5.212 4.705 5.408 0.068 5 0 "[ . 1 . 2]" 1
1519 1 143 THR H 1 143 THR HB . . 3.570 3.082 2.643 3.577 0.007 4 0 "[ . 1 . 2]" 1
1520 1 143 THR H 1 143 THR MG . . 3.890 2.409 1.877 3.825 . 0 0 "[ . 1 . 2]" 1
1521 1 143 THR H 1 144 VAL H . . 4.460 4.383 4.199 4.481 0.021 6 0 "[ . 1 . 2]" 1
1522 1 143 THR H 1 144 VAL HA . . 5.130 5.050 4.715 5.207 0.077 5 0 "[ . 1 . 2]" 1
1523 1 143 THR H 1 144 VAL QG . . 4.530 4.317 3.759 4.560 0.030 19 0 "[ . 1 . 2]" 1
1524 1 143 THR HA 1 143 THR MG . . 3.590 2.887 2.070 3.203 . 0 0 "[ . 1 . 2]" 1
1525 1 143 THR HA 1 144 VAL H . . 3.140 2.145 2.141 2.155 . 0 0 "[ . 1 . 2]" 1
1526 1 143 THR HA 1 144 VAL QG . . 4.250 3.589 3.424 3.759 . 0 0 "[ . 1 . 2]" 1
1527 1 143 THR HB 1 144 VAL H . . 4.370 4.062 3.432 4.256 . 0 0 "[ . 1 . 2]" 1
1528 1 143 THR MG 1 144 VAL H . . 4.370 3.849 2.674 4.154 . 0 0 "[ . 1 . 2]" 1
1529 1 144 VAL H 1 144 VAL HB . . 3.760 2.569 2.518 2.646 . 0 0 "[ . 1 . 2]" 1
1530 1 144 VAL H 1 144 VAL QG . . 3.660 2.520 2.328 2.633 . 0 0 "[ . 1 . 2]" 1
1531 1 144 VAL H 1 145 LYS H . . 4.550 4.485 4.389 4.530 . 0 0 "[ . 1 . 2]" 1
1532 1 144 VAL HA 1 145 LYS H . . 3.250 2.193 2.147 2.244 . 0 0 "[ . 1 . 2]" 1
1533 1 144 VAL HB 1 145 LYS HA . . 5.060 4.694 4.583 4.768 . 0 0 "[ . 1 . 2]" 1
1534 1 144 VAL QG 1 145 LYS H . . 3.470 2.355 2.030 2.629 . 0 0 "[ . 1 . 2]" 1
1535 1 144 VAL QG 1 145 LYS HA . . 4.610 3.462 3.362 3.665 . 0 0 "[ . 1 . 2]" 1
1536 1 145 LYS H 1 146 VAL QG . . 5.380 4.382 3.888 5.310 . 0 0 "[ . 1 . 2]" 1
1537 1 145 LYS HA 1 145 LYS HE2 . . 5.500 4.854 4.475 5.167 . 0 0 "[ . 1 . 2]" 1
1538 1 145 LYS HA 1 145 LYS HE3 . . 5.500 4.665 4.236 5.081 . 0 0 "[ . 1 . 2]" 1
1539 1 145 LYS HA 1 145 LYS HG2 . . 4.060 3.843 3.813 3.874 . 0 0 "[ . 1 . 2]" 1
1540 1 145 LYS HA 1 145 LYS HG3 . . 4.060 3.120 2.773 3.441 . 0 0 "[ . 1 . 2]" 1
1541 1 145 LYS HA 1 146 VAL H . . 3.130 2.153 2.142 2.182 . 0 0 "[ . 1 . 2]" 1
1542 1 145 LYS QB 1 145 LYS QE . . 4.140 3.318 2.850 3.778 . 0 0 "[ . 1 . 2]" 1
1543 1 145 LYS QB 1 146 VAL QG . . 4.850 4.682 4.556 4.816 . 0 0 "[ . 1 . 2]" 1
1544 1 145 LYS HD2 1 146 VAL H . . 4.540 2.860 2.239 3.508 . 0 0 "[ . 1 . 2]" 1
1545 1 145 LYS HD3 1 146 VAL H . . 4.490 3.278 2.425 4.087 . 0 0 "[ . 1 . 2]" 1
1546 1 145 LYS QE 1 145 LYS QG . . 3.280 2.353 2.214 2.417 . 0 0 "[ . 1 . 2]" 1
1547 1 145 LYS QG 1 146 VAL H . . 3.960 3.044 2.420 3.459 . 0 0 "[ . 1 . 2]" 1
1548 1 145 LYS HG2 1 146 VAL H . . 4.580 4.494 4.148 4.602 0.022 17 0 "[ . 1 . 2]" 1
1549 1 145 LYS HG3 1 146 VAL H . . 4.580 3.105 2.437 3.577 . 0 0 "[ . 1 . 2]" 1
1550 1 146 VAL H 1 146 VAL HB . . 3.650 2.566 2.477 2.781 . 0 0 "[ . 1 . 2]" 1
1551 1 146 VAL H 1 146 VAL QG . . 3.470 2.452 1.989 2.660 . 0 0 "[ . 1 . 2]" 1
1552 1 146 VAL H 1 147 THR MG . . 4.790 4.285 3.781 4.792 0.002 3 0 "[ . 1 . 2]" 1
1553 1 146 VAL HA 1 147 THR H . . 3.320 2.150 2.139 2.181 . 0 0 "[ . 1 . 2]" 1
1554 1 146 VAL HB 1 147 THR H . . 4.610 4.315 4.193 4.379 . 0 0 "[ . 1 . 2]" 1
1555 1 146 VAL HB 1 147 THR MG . . 5.500 5.216 4.811 5.515 0.015 3 0 "[ . 1 . 2]" 1
1556 1 146 VAL QG 1 147 THR H . . 3.440 2.666 2.327 2.975 . 0 0 "[ . 1 . 2]" 1
1557 1 146 VAL QG 1 148 ASN HA . . 4.590 4.206 3.928 4.602 0.012 11 0 "[ . 1 . 2]" 1
1558 1 147 THR H 1 147 THR MG . . 3.650 2.707 1.985 3.490 . 0 0 "[ . 1 . 2]" 1
1559 1 147 THR HA 1 148 ASN H . . 3.130 2.162 2.141 2.239 . 0 0 "[ . 1 . 2]" 1
1560 1 148 ASN H 1 148 ASN HB2 . . 3.900 2.694 2.390 2.846 . 0 0 "[ . 1 . 2]" 1
1561 1 148 ASN H 1 148 ASN HB3 . . 3.860 3.614 3.562 3.712 . 0 0 "[ . 1 . 2]" 1
1562 1 148 ASN H 1 148 ASN QD . . 4.200 2.757 1.886 3.493 . 0 0 "[ . 1 . 2]" 1
1563 1 148 ASN HA 1 149 VAL H . . 3.510 2.466 2.187 2.567 . 0 0 "[ . 1 . 2]" 1
1564 1 148 ASN HA 1 149 VAL QG . . 4.390 3.637 3.388 4.146 . 0 0 "[ . 1 . 2]" 1
1565 1 148 ASN HB2 1 149 VAL H . . 4.160 3.270 2.921 3.904 . 0 0 "[ . 1 . 2]" 1
1566 1 148 ASN HB3 1 149 VAL H . . 4.450 2.456 2.136 3.163 . 0 0 "[ . 1 . 2]" 1
1567 1 149 VAL H 1 149 VAL HB . . 4.070 2.715 2.530 3.668 . 0 0 "[ . 1 . 2]" 1
1568 1 149 VAL H 1 150 GLY H . . 4.530 4.420 4.270 4.555 0.025 17 0 "[ . 1 . 2]" 1
1569 1 149 VAL HA 1 149 VAL MG1 . . 3.390 2.614 2.156 3.203 . 0 0 "[ . 1 . 2]" 1
1570 1 149 VAL HA 1 149 VAL QG . . 2.950 2.131 2.034 2.319 . 0 0 "[ . 1 . 2]" 1
1571 1 149 VAL HA 1 149 VAL MG2 . . 3.390 2.368 2.164 3.182 . 0 0 "[ . 1 . 2]" 1
1572 1 149 VAL HA 1 150 GLY H . . 3.210 2.165 2.144 2.250 . 0 0 "[ . 1 . 2]" 1
1573 1 150 GLY QA 1 151 ARG H . . 3.410 2.381 2.109 2.791 . 0 0 "[ . 1 . 2]" 1
1574 1 150 GLY QA 1 151 ARG HA . . 4.190 3.979 3.929 4.075 . 0 0 "[ . 1 . 2]" 1
1575 1 151 ARG H 1 151 ARG QB . . 3.590 2.367 2.086 3.124 . 0 0 "[ . 1 . 2]" 1
1576 1 151 ARG H 1 151 ARG HG2 . . 4.420 3.776 2.684 4.369 . 0 0 "[ . 1 . 2]" 1
1577 1 151 ARG H 1 151 ARG QG . . 3.850 3.227 2.077 3.822 . 0 0 "[ . 1 . 2]" 1
1578 1 151 ARG H 1 151 ARG HG3 . . 4.420 3.672 2.088 4.323 . 0 0 "[ . 1 . 2]" 1
1579 1 151 ARG H 1 152 PRO HD2 . . 4.840 4.769 4.719 4.809 . 0 0 "[ . 1 . 2]" 1
1580 1 151 ARG HA 1 151 ARG HD2 . . 4.720 3.929 2.592 4.780 0.060 7 0 "[ . 1 . 2]" 1
1581 1 151 ARG HA 1 151 ARG QD . . 4.030 3.346 1.977 4.242 0.212 7 0 "[ . 1 . 2]" 1
1582 1 151 ARG HA 1 151 ARG HD3 . . 4.720 3.769 1.998 4.746 0.026 5 0 "[ . 1 . 2]" 1
1583 1 151 ARG HA 1 151 ARG HG2 . . 4.250 2.747 2.126 4.212 . 0 0 "[ . 1 . 2]" 1
1584 1 151 ARG HA 1 151 ARG QG . . 3.600 2.428 2.093 3.418 . 0 0 "[ . 1 . 2]" 1
1585 1 151 ARG HA 1 151 ARG HG3 . . 4.250 3.201 2.284 3.666 . 0 0 "[ . 1 . 2]" 1
1586 1 151 ARG HA 1 152 PRO HD2 . . 3.170 2.495 2.407 2.511 . 0 0 "[ . 1 . 2]" 1
1587 1 151 ARG HA 1 152 PRO HD3 . . 3.160 2.341 2.301 2.348 . 0 0 "[ . 1 . 2]" 1
1588 1 151 ARG QB 1 151 ARG QD . . 2.840 2.193 1.959 2.630 . 0 0 "[ . 1 . 2]" 1
1589 1 151 ARG QB 1 152 PRO HD3 . . 3.780 3.372 3.199 3.528 . 0 0 "[ . 1 . 2]" 1
1590 1 151 ARG HB2 1 152 PRO HD2 . . 3.800 3.358 1.970 3.648 . 0 0 "[ . 1 . 2]" 1
1591 1 151 ARG HB3 1 152 PRO HD2 . . 3.800 2.241 1.983 3.581 . 0 0 "[ . 1 . 2]" 1
1592 1 151 ARG HD2 1 152 PRO HD2 . . 4.480 3.425 1.995 4.390 . 0 0 "[ . 1 . 2]" 1
1593 1 151 ARG HD3 1 152 PRO HD2 . . 4.480 3.447 2.030 4.508 0.028 7 0 "[ . 1 . 2]" 1
1594 1 151 ARG QG 1 152 PRO HD2 . . 4.510 2.876 1.981 4.107 . 0 0 "[ . 1 . 2]" 1
1595 1 151 ARG HG2 1 152 PRO HD2 . . 5.330 3.282 2.539 4.771 . 0 0 "[ . 1 . 2]" 1
1596 1 151 ARG HG3 1 152 PRO HD2 . . 5.330 3.658 2.008 4.664 . 0 0 "[ . 1 . 2]" 1
1597 1 152 PRO HA 1 153 SER H . . 2.780 2.538 2.223 2.662 . 0 0 "[ . 1 . 2]" 1
1598 1 152 PRO HB2 1 153 SER H . . 3.870 2.300 2.023 3.143 . 0 0 "[ . 1 . 2]" 1
1599 1 152 PRO HB3 1 153 SER H . . 3.870 3.311 3.189 3.750 . 0 0 "[ . 1 . 2]" 1
1600 1 153 SER H 1 153 SER QB . . 3.640 2.779 2.225 3.363 . 0 0 "[ . 1 . 2]" 1
1601 1 153 SER HA 1 154 MET H . . 2.990 2.449 2.186 3.009 0.019 16 0 "[ . 1 . 2]" 1
1602 1 153 SER HB2 1 154 MET H . . 4.240 3.200 1.951 4.205 . 0 0 "[ . 1 . 2]" 1
1603 1 153 SER HB3 1 154 MET H . . 4.240 3.550 1.975 4.256 0.016 16 0 "[ . 1 . 2]" 1
1604 1 154 MET H 1 154 MET QG . . 3.660 2.781 2.071 3.814 0.154 15 0 "[ . 1 . 2]" 1
1605 1 154 MET HA 1 154 MET QB . . 2.550 2.262 2.179 2.524 . 0 0 "[ . 1 . 2]" 1
1606 1 154 MET HA 1 154 MET QG . . 3.480 3.042 2.174 3.420 . 0 0 "[ . 1 . 2]" 1
1607 1 154 MET HA 1 155 ALA H . . 3.280 2.387 2.140 2.650 . 0 0 "[ . 1 . 2]" 1
1608 1 154 MET QB 1 155 ALA HA . . 5.340 4.314 3.818 4.975 . 0 0 "[ . 1 . 2]" 1
1609 1 155 ALA H 1 155 ALA MB . . 3.170 2.617 2.259 2.892 . 0 0 "[ . 1 . 2]" 1
1610 1 155 ALA H 1 156 GLU H . . 3.940 3.805 3.445 3.941 0.001 20 0 "[ . 1 . 2]" 1
1611 1 155 ALA HA 1 156 GLU H . . 2.850 2.229 2.142 2.461 . 0 0 "[ . 1 . 2]" 1
1612 1 155 ALA HA 1 156 GLU QB . . 4.480 4.255 3.823 4.479 . 0 0 "[ . 1 . 2]" 1
1613 1 156 GLU H 1 156 GLU QB . . 3.620 2.478 2.192 3.376 . 0 0 "[ . 1 . 2]" 1
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