NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
398643 |
1tmw   |
6071 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1tmw
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 2052
_Distance_constraint_stats_list.Viol_count 1562
_Distance_constraint_stats_list.Viol_total 1074.514
_Distance_constraint_stats_list.Viol_max 0.326
_Distance_constraint_stats_list.Viol_rms 0.0094
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0013
_Distance_constraint_stats_list.Viol_average_violations_only 0.0344
_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 1 ALA 0.194 0.058 9 0 "[ . 1 . 2]"
1 2 THR 0.368 0.058 9 0 "[ . 1 . 2]"
1 3 LYS 0.012 0.010 8 0 "[ . 1 . 2]"
1 4 ILE 0.046 0.025 2 0 "[ . 1 . 2]"
1 5 ASP 0.199 0.050 10 0 "[ . 1 . 2]"
1 6 LYS 0.386 0.066 16 0 "[ . 1 . 2]"
1 7 GLU 0.218 0.060 2 0 "[ . 1 . 2]"
1 8 ALA 0.110 0.026 20 0 "[ . 1 . 2]"
1 9 CYS 0.577 0.067 20 0 "[ . 1 . 2]"
1 10 ARG 0.608 0.068 16 0 "[ . 1 . 2]"
1 11 ALA 0.075 0.036 19 0 "[ . 1 . 2]"
1 12 ALA 0.007 0.007 3 0 "[ . 1 . 2]"
1 13 TYR 0.179 0.055 8 0 "[ . 1 . 2]"
1 14 ASN 1.073 0.089 7 0 "[ . 1 . 2]"
1 15 LEU 0.025 0.014 19 0 "[ . 1 . 2]"
1 16 VAL 0.066 0.055 8 0 "[ . 1 . 2]"
1 17 ARG 0.060 0.034 20 0 "[ . 1 . 2]"
1 18 ASP 0.493 0.066 4 0 "[ . 1 . 2]"
1 19 ASP 0.183 0.047 5 0 "[ . 1 . 2]"
1 20 GLY 0.188 0.066 4 0 "[ . 1 . 2]"
1 21 SER 0.944 0.065 6 0 "[ . 1 . 2]"
1 22 ALA 0.018 0.013 12 0 "[ . 1 . 2]"
1 23 VAL 0.744 0.049 16 0 "[ . 1 . 2]"
1 24 ILE 0.000 0.000 12 0 "[ . 1 . 2]"
1 25 TRP 3.321 0.128 11 0 "[ . 1 . 2]"
1 26 VAL 0.954 0.146 8 0 "[ . 1 . 2]"
1 27 THR 2.197 0.146 8 0 "[ . 1 . 2]"
1 28 PHE 1.295 0.120 11 0 "[ . 1 . 2]"
1 29 LYS 0.160 0.030 19 0 "[ . 1 . 2]"
1 30 TYR 0.232 0.037 14 0 "[ . 1 . 2]"
1 31 ASP 0.128 0.049 18 0 "[ . 1 . 2]"
1 32 GLY 0.013 0.013 17 0 "[ . 1 . 2]"
1 33 SER 0.070 0.027 16 0 "[ . 1 . 2]"
1 34 THR 0.122 0.049 18 0 "[ . 1 . 2]"
1 35 ILE 0.121 0.039 12 0 "[ . 1 . 2]"
1 36 VAL 0.227 0.042 3 0 "[ . 1 . 2]"
1 37 PRO 0.773 0.068 16 0 "[ . 1 . 2]"
1 38 GLY 2.303 0.166 15 0 "[ . 1 . 2]"
1 39 GLU 4.914 0.166 15 0 "[ . 1 . 2]"
1 40 GLN 1.226 0.067 5 0 "[ . 1 . 2]"
1 41 GLY 1.105 0.065 11 0 "[ . 1 . 2]"
1 42 ALA 0.012 0.012 8 0 "[ . 1 . 2]"
1 43 GLU 1.042 0.061 5 0 "[ . 1 . 2]"
1 44 TYR 1.643 0.064 9 0 "[ . 1 . 2]"
1 45 GLN 0.178 0.037 16 0 "[ . 1 . 2]"
1 46 HIS 0.677 0.039 1 0 "[ . 1 . 2]"
1 47 PHE 1.917 0.064 9 0 "[ . 1 . 2]"
1 48 ILE 0.046 0.037 16 0 "[ . 1 . 2]"
1 49 GLN 0.020 0.010 7 0 "[ . 1 . 2]"
1 50 GLN 0.360 0.138 9 0 "[ . 1 . 2]"
1 51 CYS 0.739 0.082 18 0 "[ . 1 . 2]"
1 52 THR 0.450 0.052 3 0 "[ . 1 . 2]"
1 53 ASP 0.772 0.089 13 0 "[ . 1 . 2]"
1 54 ASP 2.175 0.129 4 0 "[ . 1 . 2]"
1 55 VAL 1.420 0.326 7 0 "[ . 1 . 2]"
1 56 ARG 0.667 0.326 7 0 "[ . 1 . 2]"
1 57 LEU 0.336 0.050 18 0 "[ . 1 . 2]"
1 58 PHE 0.071 0.039 12 0 "[ . 1 . 2]"
1 59 ALA 0.323 0.063 8 0 "[ . 1 . 2]"
1 60 PHE 0.745 0.063 8 0 "[ . 1 . 2]"
1 61 VAL 0.056 0.022 16 0 "[ . 1 . 2]"
1 62 ARG 0.125 0.026 7 0 "[ . 1 . 2]"
1 63 PHE 0.050 0.020 13 0 "[ . 1 . 2]"
1 64 THR 0.128 0.044 14 0 "[ . 1 . 2]"
1 65 THR 0.150 0.038 10 0 "[ . 1 . 2]"
1 66 GLY 0.656 0.067 11 0 "[ . 1 . 2]"
1 67 ASP 0.840 0.075 20 0 "[ . 1 . 2]"
1 68 ALA 3.866 0.179 4 0 "[ . 1 . 2]"
1 69 MET 3.062 0.179 4 0 "[ . 1 . 2]"
1 70 SER 1.495 0.094 1 0 "[ . 1 . 2]"
1 71 LYS 0.379 0.031 3 0 "[ . 1 . 2]"
1 72 ARG 0.216 0.068 4 0 "[ . 1 . 2]"
1 73 SER 0.163 0.075 3 0 "[ . 1 . 2]"
1 74 LYS 0.002 0.001 8 0 "[ . 1 . 2]"
1 75 PHE 0.040 0.017 2 0 "[ . 1 . 2]"
1 76 ALA 0.169 0.033 16 0 "[ . 1 . 2]"
1 77 LEU 0.047 0.022 16 0 "[ . 1 . 2]"
1 78 ILE 0.058 0.019 20 0 "[ . 1 . 2]"
1 79 THR 0.026 0.012 11 0 "[ . 1 . 2]"
1 80 TRP 0.201 0.034 11 0 "[ . 1 . 2]"
1 81 ILE 0.648 0.050 18 0 "[ . 1 . 2]"
1 82 GLY 0.280 0.040 14 0 "[ . 1 . 2]"
1 83 GLU 3.368 0.208 7 0 "[ . 1 . 2]"
1 84 ASN 3.613 0.138 4 0 "[ . 1 . 2]"
1 85 VAL 5.892 0.208 7 0 "[ . 1 . 2]"
1 86 SER 0.426 0.078 5 0 "[ . 1 . 2]"
1 87 GLY 0.035 0.029 12 0 "[ . 1 . 2]"
1 88 LEU 0.198 0.071 12 0 "[ . 1 . 2]"
1 89 GLN 0.576 0.073 19 0 "[ . 1 . 2]"
1 90 ARG 0.066 0.029 12 0 "[ . 1 . 2]"
1 91 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 LYS 0.137 0.051 10 0 "[ . 1 . 2]"
1 93 THR 0.046 0.036 1 0 "[ . 1 . 2]"
1 94 GLY 0.061 0.025 19 0 "[ . 1 . 2]"
1 95 THR 0.103 0.028 4 0 "[ . 1 . 2]"
1 96 ASP 0.543 0.053 14 0 "[ . 1 . 2]"
1 97 LYS 0.209 0.039 1 0 "[ . 1 . 2]"
1 98 THR 0.705 0.053 14 0 "[ . 1 . 2]"
1 99 LEU 1.297 0.068 1 0 "[ . 1 . 2]"
1 100 VAL 0.046 0.018 10 0 "[ . 1 . 2]"
1 101 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 GLU 0.022 0.009 6 0 "[ . 1 . 2]"
1 103 VAL 0.243 0.089 4 0 "[ . 1 . 2]"
1 104 VAL 0.111 0.028 5 0 "[ . 1 . 2]"
1 105 GLN 0.173 0.035 15 0 "[ . 1 . 2]"
1 106 ASN 0.307 0.035 15 0 "[ . 1 . 2]"
1 107 PHE 0.225 0.030 3 0 "[ . 1 . 2]"
1 108 ALA 0.024 0.017 2 0 "[ . 1 . 2]"
1 109 LYS 0.039 0.026 14 0 "[ . 1 . 2]"
1 110 GLU 0.025 0.018 20 0 "[ . 1 . 2]"
1 111 PHE 0.445 0.049 14 0 "[ . 1 . 2]"
1 112 VAL 0.652 0.097 8 0 "[ . 1 . 2]"
1 113 ILE 0.535 0.064 10 0 "[ . 1 . 2]"
1 114 SER 0.256 0.064 10 0 "[ . 1 . 2]"
1 115 ASP 0.899 0.060 19 0 "[ . 1 . 2]"
1 116 ARG 0.292 0.071 19 0 "[ . 1 . 2]"
1 117 LYS 0.990 0.060 19 0 "[ . 1 . 2]"
1 118 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 LEU 0.764 0.069 14 0 "[ . 1 . 2]"
1 120 GLU 2.014 0.098 20 0 "[ . 1 . 2]"
1 121 GLU 1.154 0.098 20 0 "[ . 1 . 2]"
1 122 ASN 1.347 0.071 1 0 "[ . 1 . 2]"
1 123 PHE 0.879 0.071 1 0 "[ . 1 . 2]"
1 124 ILE 0.060 0.031 12 0 "[ . 1 . 2]"
1 125 LYS 0.268 0.044 14 0 "[ . 1 . 2]"
1 126 SER 0.155 0.024 18 0 "[ . 1 . 2]"
1 127 GLU 0.133 0.024 18 0 "[ . 1 . 2]"
1 128 LEU 0.228 0.021 17 0 "[ . 1 . 2]"
1 129 LYS 0.512 0.070 7 0 "[ . 1 . 2]"
1 130 LYS 0.067 0.030 8 0 "[ . 1 . 2]"
1 131 ALA 0.263 0.057 17 0 "[ . 1 . 2]"
1 132 GLY 0.006 0.006 12 0 "[ . 1 . 2]"
1 133 GLY 0.304 0.057 17 0 "[ . 1 . 2]"
1 134 ALA 1.067 0.105 9 0 "[ . 1 . 2]"
1 135 ASN 0.613 0.093 9 0 "[ . 1 . 2]"
1 136 TYR 1.783 0.105 9 0 "[ . 1 . 2]"
1 137 ASP 0.565 0.085 4 0 "[ . 1 . 2]"
1 138 ALA 0.592 0.069 6 0 "[ . 1 . 2]"
1 139 GLN 3.599 0.125 11 0 "[ . 1 . 2]"
1 140 THR 3.695 0.125 11 0 "[ . 1 . 2]"
1 141 GLU 0.055 0.028 4 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 1 ALA HA 1 2 THR H 0.000 . 3.500 2.570 2.145 3.558 0.058 9 0 "[ . 1 . 2]" 1
2 1 1 ALA MB 1 2 THR H 0.000 . 5.000 2.893 2.030 3.715 . 0 0 "[ . 1 . 2]" 1
3 1 1 ALA MB 1 3 LYS QE 0.000 . 6.000 4.275 2.416 5.995 . 0 0 "[ . 1 . 2]" 1
4 1 2 THR H 1 3 LYS H 0.000 . 6.000 4.283 3.700 4.563 . 0 0 "[ . 1 . 2]" 1
5 1 2 THR H 1 99 LEU MD1 0.000 . 6.000 4.543 3.507 5.226 . 0 0 "[ . 1 . 2]" 1
6 1 2 THR H 1 99 LEU MD2 0.000 . 6.000 5.451 4.253 6.055 0.055 1 0 "[ . 1 . 2]" 1
7 1 2 THR HA 1 3 LYS H 0.000 . 3.000 2.187 2.137 2.299 . 0 0 "[ . 1 . 2]" 1
8 1 2 THR HA 1 35 ILE H 0.000 . 6.000 5.786 5.428 6.026 0.026 9 0 "[ . 1 . 2]" 1
9 1 2 THR HA 1 92 LYS QD 0.000 . 6.000 5.432 4.426 5.999 . 0 0 "[ . 1 . 2]" 1
10 1 2 THR HB 1 3 LYS H 0.000 . 5.000 3.890 3.275 4.403 . 0 0 "[ . 1 . 2]" 1
11 1 2 THR HB 1 35 ILE MD 0.000 . 6.000 4.169 2.351 5.986 . 0 0 "[ . 1 . 2]" 1
12 1 2 THR HB 1 99 LEU QD 0.000 . 4.500 2.836 1.924 4.297 . 0 0 "[ . 1 . 2]" 1
13 1 2 THR MG 1 3 LYS H 0.000 . 4.500 3.260 2.259 3.919 . 0 0 "[ . 1 . 2]" 1
14 1 2 THR MG 1 30 TYR HE1 0.000 . 6.000 4.698 1.899 6.019 0.019 15 0 "[ . 1 . 2]" 1
15 1 2 THR MG 1 30 TYR HE2 0.000 . 6.000 4.827 2.372 5.877 . 0 0 "[ . 1 . 2]" 1
16 1 2 THR MG 1 30 TYR QE 0.000 . 5.000 3.919 1.898 4.968 . 0 0 "[ . 1 . 2]" 1
17 1 2 THR MG 1 33 SER QB 0.000 . 6.000 4.564 3.434 5.859 . 0 0 "[ . 1 . 2]" 1
18 1 2 THR MG 1 34 THR HA 0.000 . 6.000 4.363 3.193 5.824 . 0 0 "[ . 1 . 2]" 1
19 1 2 THR MG 1 35 ILE QG 0.000 . 6.000 3.397 2.526 4.809 . 0 0 "[ . 1 . 2]" 1
20 1 2 THR MG 1 35 ILE MD 0.000 . 4.500 2.988 2.047 4.120 . 0 0 "[ . 1 . 2]" 1
21 1 2 THR MG 1 35 ILE H 0.000 . 6.000 4.688 3.607 5.980 . 0 0 "[ . 1 . 2]" 1
22 1 2 THR MG 1 96 ASP HA 0.000 . 4.500 3.933 3.106 4.492 . 0 0 "[ . 1 . 2]" 1
23 1 2 THR MG 1 96 ASP HB3 0.000 . 6.000 4.830 4.411 5.702 . 0 0 "[ . 1 . 2]" 1
24 1 2 THR MG 1 96 ASP HB2 0.000 . 6.000 4.495 3.342 5.051 . 0 0 "[ . 1 . 2]" 1
25 1 2 THR MG 1 96 ASP H 0.000 . 5.000 4.374 3.598 5.003 0.003 3 0 "[ . 1 . 2]" 1
26 1 2 THR MG 1 99 LEU MD1 0.000 . 6.000 2.846 1.887 3.715 . 0 0 "[ . 1 . 2]" 1
27 1 2 THR MG 1 99 LEU MD2 0.000 . 6.000 4.636 3.639 5.502 . 0 0 "[ . 1 . 2]" 1
28 1 2 THR MG 1 99 LEU QD 0.000 . 4.500 2.817 1.882 3.654 . 0 0 "[ . 1 . 2]" 1
29 1 3 LYS H 1 3 LYS HB3 0.000 . 4.000 3.607 3.039 3.882 . 0 0 "[ . 1 . 2]" 1
30 1 3 LYS H 1 3 LYS HB2 0.000 . 4.000 2.484 2.164 2.867 . 0 0 "[ . 1 . 2]" 1
31 1 3 LYS H 1 3 LYS HG3 0.000 . 4.500 3.685 2.728 4.467 . 0 0 "[ . 1 . 2]" 1
32 1 3 LYS H 1 3 LYS HG2 0.000 . 4.500 3.822 2.445 4.502 0.002 5 0 "[ . 1 . 2]" 1
33 1 3 LYS H 1 3 LYS QD 0.000 . 6.000 4.187 2.312 4.981 . 0 0 "[ . 1 . 2]" 1
34 1 3 LYS H 1 4 ILE H 0.000 . 6.000 4.481 4.151 4.597 . 0 0 "[ . 1 . 2]" 1
35 1 3 LYS H 1 34 THR HA 0.000 . 4.000 2.981 2.403 3.608 . 0 0 "[ . 1 . 2]" 1
36 1 3 LYS H 1 34 THR HB 0.000 . 5.000 4.483 3.526 5.010 0.010 8 0 "[ . 1 . 2]" 1
37 1 3 LYS H 1 34 THR MG 0.000 . 6.000 4.889 2.937 5.771 . 0 0 "[ . 1 . 2]" 1
38 1 3 LYS H 1 34 THR H 0.000 . 6.000 4.935 4.312 5.643 . 0 0 "[ . 1 . 2]" 1
39 1 3 LYS H 1 35 ILE H 0.000 . 5.000 4.285 3.851 4.864 . 0 0 "[ . 1 . 2]" 1
40 1 3 LYS H 1 99 LEU QD 0.000 . 6.000 4.082 3.393 4.448 . 0 0 "[ . 1 . 2]" 1
41 1 3 LYS HA 1 4 ILE H 0.000 . 3.000 2.370 2.177 2.608 . 0 0 "[ . 1 . 2]" 1
42 1 3 LYS HA 1 99 LEU MD1 0.000 . 5.000 3.360 2.519 4.733 . 0 0 "[ . 1 . 2]" 1
43 1 3 LYS HA 1 99 LEU MD2 0.000 . 5.000 3.470 2.749 4.320 . 0 0 "[ . 1 . 2]" 1
44 1 3 LYS HA 1 99 LEU QD 0.000 . 4.500 2.999 2.359 3.774 . 0 0 "[ . 1 . 2]" 1
45 1 3 LYS HB3 1 4 ILE H 0.000 . 5.000 2.676 2.037 3.806 . 0 0 "[ . 1 . 2]" 1
46 1 3 LYS HB2 1 4 ILE H 0.000 . 5.000 3.846 3.070 4.498 . 0 0 "[ . 1 . 2]" 1
47 1 3 LYS QB 1 4 ILE H 0.000 . 4.000 2.623 2.021 3.613 . 0 0 "[ . 1 . 2]" 1
48 1 3 LYS QB 1 34 THR HA 0.000 . 5.000 3.207 2.593 4.388 . 0 0 "[ . 1 . 2]" 1
49 1 3 LYS QB 1 34 THR MG 0.000 . 6.000 4.037 2.217 5.079 . 0 0 "[ . 1 . 2]" 1
50 1 3 LYS QB 1 35 ILE H 0.000 . 5.000 4.287 3.923 4.995 . 0 0 "[ . 1 . 2]" 1
51 1 3 LYS QG 1 4 ILE H 0.000 . 5.000 3.727 2.217 4.527 . 0 0 "[ . 1 . 2]" 1
52 1 3 LYS QD 1 4 ILE H 0.000 . 5.000 3.808 2.394 4.852 . 0 0 "[ . 1 . 2]" 1
53 1 4 ILE H 1 4 ILE HB 0.000 . 4.000 3.092 2.710 3.331 . 0 0 "[ . 1 . 2]" 1
54 1 4 ILE H 1 4 ILE MG 0.000 . 3.000 2.028 1.955 2.347 . 0 0 "[ . 1 . 2]" 1
55 1 4 ILE H 1 5 ASP HA 0.000 . 6.000 4.877 4.658 5.253 . 0 0 "[ . 1 . 2]" 1
56 1 4 ILE H 1 5 ASP H 0.000 . 6.000 4.342 4.198 4.422 . 0 0 "[ . 1 . 2]" 1
57 1 4 ILE H 1 6 LYS H 0.000 . 6.000 5.645 5.234 6.025 0.025 2 0 "[ . 1 . 2]" 1
58 1 4 ILE HA 1 5 ASP H 0.000 . 3.000 2.158 2.142 2.181 . 0 0 "[ . 1 . 2]" 1
59 1 4 ILE HA 1 35 ILE MD 0.000 . 5.000 3.153 2.153 4.373 . 0 0 "[ . 1 . 2]" 1
60 1 4 ILE HA 1 35 ILE HG13 0.000 . 5.000 3.463 2.087 4.358 . 0 0 "[ . 1 . 2]" 1
61 1 4 ILE HA 1 35 ILE HG12 0.000 . 5.000 4.051 2.237 4.957 . 0 0 "[ . 1 . 2]" 1
62 1 4 ILE HA 1 35 ILE MG 0.000 . 6.000 4.038 3.746 4.425 . 0 0 "[ . 1 . 2]" 1
63 1 4 ILE HA 1 35 ILE H 0.000 . 4.000 2.299 1.940 2.940 . 0 0 "[ . 1 . 2]" 1
64 1 4 ILE HB 1 5 ASP H 0.000 . 6.000 4.224 4.138 4.369 . 0 0 "[ . 1 . 2]" 1
65 1 4 ILE MD 1 5 ASP H 0.000 . 5.000 4.122 3.706 4.337 . 0 0 "[ . 1 . 2]" 1
66 1 4 ILE MD 1 6 LYS HA 0.000 . 6.000 4.868 4.534 5.221 . 0 0 "[ . 1 . 2]" 1
67 1 4 ILE MD 1 6 LYS QG 0.000 . 6.000 4.899 4.282 5.980 . 0 0 "[ . 1 . 2]" 1
68 1 4 ILE MD 1 6 LYS H 0.000 . 6.000 5.802 5.533 6.003 0.003 12 0 "[ . 1 . 2]" 1
69 1 4 ILE MD 1 9 CYS HB3 0.000 . 5.000 4.237 3.775 5.010 0.010 12 0 "[ . 1 . 2]" 1
70 1 4 ILE MD 1 9 CYS HB2 0.000 . 5.000 3.860 3.136 4.642 . 0 0 "[ . 1 . 2]" 1
71 1 4 ILE MD 1 99 LEU QD 0.000 . 4.500 3.272 2.831 4.006 . 0 0 "[ . 1 . 2]" 1
72 1 4 ILE MD 1 99 LEU H 0.000 . 6.000 4.715 4.180 5.190 . 0 0 "[ . 1 . 2]" 1
73 1 4 ILE MD 1 100 VAL HA 0.000 . 4.000 2.361 2.013 2.788 . 0 0 "[ . 1 . 2]" 1
74 1 4 ILE MD 1 100 VAL H 0.000 . 4.500 3.245 2.724 3.755 . 0 0 "[ . 1 . 2]" 1
75 1 4 ILE QG 1 5 ASP H 0.000 . 4.000 2.504 2.306 2.834 . 0 0 "[ . 1 . 2]" 1
76 1 4 ILE QG 1 6 LYS HA 0.000 . 5.000 3.714 3.522 3.892 . 0 0 "[ . 1 . 2]" 1
77 1 4 ILE QG 1 6 LYS H 0.000 . 5.000 4.286 4.004 4.494 . 0 0 "[ . 1 . 2]" 1
78 1 4 ILE QG 1 35 ILE H 0.000 . 5.000 3.942 3.424 4.596 . 0 0 "[ . 1 . 2]" 1
79 1 4 ILE MG 1 6 LYS HA 0.000 . 6.000 4.168 3.912 4.488 . 0 0 "[ . 1 . 2]" 1
80 1 4 ILE MG 1 6 LYS QE 0.000 . 6.000 4.333 2.098 5.580 . 0 0 "[ . 1 . 2]" 1
81 1 4 ILE MG 1 6 LYS H 0.000 . 5.000 4.066 3.695 4.281 . 0 0 "[ . 1 . 2]" 1
82 1 4 ILE MG 1 99 LEU HA 0.000 . 5.000 3.630 3.248 4.196 . 0 0 "[ . 1 . 2]" 1
83 1 5 ASP H 1 5 ASP QB 0.000 . 3.500 2.277 2.189 2.473 . 0 0 "[ . 1 . 2]" 1
84 1 5 ASP H 1 6 LYS H 0.000 . 6.000 4.329 4.161 4.407 . 0 0 "[ . 1 . 2]" 1
85 1 5 ASP H 1 35 ILE HB 0.000 . 5.000 3.284 2.855 4.704 . 0 0 "[ . 1 . 2]" 1
86 1 5 ASP H 1 35 ILE H 0.000 . 4.500 3.251 2.748 3.652 . 0 0 "[ . 1 . 2]" 1
87 1 5 ASP H 1 36 VAL QG 0.000 . 5.000 3.789 2.695 4.981 . 0 0 "[ . 1 . 2]" 1
88 1 5 ASP HA 1 6 LYS H 0.000 . 3.000 2.151 2.130 2.214 . 0 0 "[ . 1 . 2]" 1
89 1 5 ASP HA 1 7 GLU H 0.000 . 5.000 3.769 3.605 3.972 . 0 0 "[ . 1 . 2]" 1
90 1 5 ASP HA 1 8 ALA H 0.000 . 6.000 4.351 4.176 4.549 . 0 0 "[ . 1 . 2]" 1
91 1 5 ASP HB3 1 6 LYS H 0.000 . 4.500 4.084 3.634 4.341 . 0 0 "[ . 1 . 2]" 1
92 1 5 ASP HB2 1 6 LYS H 0.000 . 4.500 4.503 4.454 4.550 0.050 10 0 "[ . 1 . 2]" 1
93 1 5 ASP QB 1 7 GLU H 0.000 . 6.000 4.002 3.385 4.340 . 0 0 "[ . 1 . 2]" 1
94 1 5 ASP HB3 1 8 ALA MB 0.000 . 5.000 2.254 1.984 2.602 . 0 0 "[ . 1 . 2]" 1
95 1 5 ASP HB2 1 8 ALA MB 0.000 . 5.000 3.114 2.315 3.808 . 0 0 "[ . 1 . 2]" 1
96 1 5 ASP QB 1 8 ALA MB 0.000 . 4.000 2.165 1.928 2.464 . 0 0 "[ . 1 . 2]" 1
97 1 5 ASP HB3 1 36 VAL QG 0.000 . 5.000 2.787 1.815 4.047 . 0 0 "[ . 1 . 2]" 1
98 1 5 ASP HB2 1 36 VAL QG 0.000 . 5.000 2.783 1.801 4.588 . 0 0 "[ . 1 . 2]" 1
99 1 6 LYS H 1 6 LYS HB3 0.000 . 3.500 3.366 2.552 3.566 0.066 16 0 "[ . 1 . 2]" 1
100 1 6 LYS H 1 6 LYS HB2 0.000 . 3.500 2.190 2.075 2.509 . 0 0 "[ . 1 . 2]" 1
101 1 6 LYS H 1 6 LYS QB 0.000 . 3.000 2.154 2.056 2.434 . 0 0 "[ . 1 . 2]" 1
102 1 6 LYS H 1 6 LYS HG3 0.000 . 4.500 3.478 2.145 4.415 . 0 0 "[ . 1 . 2]" 1
103 1 6 LYS H 1 6 LYS HG2 0.000 . 4.500 3.998 3.058 4.521 0.021 17 0 "[ . 1 . 2]" 1
104 1 6 LYS H 1 7 GLU QB 0.000 . 5.000 4.388 4.213 4.962 . 0 0 "[ . 1 . 2]" 1
105 1 6 LYS H 1 7 GLU H 0.000 . 3.500 2.637 2.484 2.771 . 0 0 "[ . 1 . 2]" 1
106 1 6 LYS H 1 8 ALA H 0.000 . 5.000 4.352 4.157 4.569 . 0 0 "[ . 1 . 2]" 1
107 1 6 LYS H 1 103 VAL QG 0.000 . 6.000 4.781 4.057 5.245 . 0 0 "[ . 1 . 2]" 1
108 1 6 LYS HA 1 7 GLU H 0.000 . 4.500 3.537 3.515 3.563 . 0 0 "[ . 1 . 2]" 1
109 1 6 LYS HA 1 8 ALA H 0.000 . 6.000 4.616 4.425 4.796 . 0 0 "[ . 1 . 2]" 1
110 1 6 LYS HA 1 9 CYS HB3 0.000 . 5.000 3.508 2.726 4.785 . 0 0 "[ . 1 . 2]" 1
111 1 6 LYS HA 1 9 CYS HB2 0.000 . 5.000 3.235 2.403 4.076 . 0 0 "[ . 1 . 2]" 1
112 1 6 LYS HA 1 9 CYS H 0.000 . 5.000 3.748 3.547 4.031 . 0 0 "[ . 1 . 2]" 1
113 1 6 LYS HA 1 10 ARG H 0.000 . 5.000 3.716 3.465 4.044 . 0 0 "[ . 1 . 2]" 1
114 1 6 LYS HA 1 103 VAL MG1 0.000 . 5.000 3.619 2.439 4.672 . 0 0 "[ . 1 . 2]" 1
115 1 6 LYS HA 1 103 VAL MG2 0.000 . 5.000 3.490 2.503 4.354 . 0 0 "[ . 1 . 2]" 1
116 1 6 LYS HA 1 103 VAL QG 0.000 . 4.000 2.965 2.427 3.486 . 0 0 "[ . 1 . 2]" 1
117 1 6 LYS HB3 1 7 GLU H 0.000 . 4.000 3.184 2.570 3.599 . 0 0 "[ . 1 . 2]" 1
118 1 6 LYS HB2 1 7 GLU H 0.000 . 4.000 3.017 2.572 3.826 . 0 0 "[ . 1 . 2]" 1
119 1 7 GLU H 1 7 GLU HB3 0.000 . 3.500 3.202 2.731 3.535 0.035 16 0 "[ . 1 . 2]" 1
120 1 7 GLU H 1 7 GLU HB2 0.000 . 3.500 2.249 2.053 3.560 0.060 2 0 "[ . 1 . 2]" 1
121 1 7 GLU H 1 7 GLU HG3 0.000 . 5.000 3.831 2.738 4.452 . 0 0 "[ . 1 . 2]" 1
122 1 7 GLU H 1 7 GLU HG2 0.000 . 5.000 4.024 2.184 4.670 . 0 0 "[ . 1 . 2]" 1
123 1 7 GLU H 1 7 GLU QG 0.000 . 4.000 3.418 2.166 3.993 . 0 0 "[ . 1 . 2]" 1
124 1 7 GLU H 1 8 ALA MB 0.000 . 6.000 4.434 4.275 4.528 . 0 0 "[ . 1 . 2]" 1
125 1 7 GLU H 1 8 ALA H 0.000 . 3.000 2.785 2.654 2.872 . 0 0 "[ . 1 . 2]" 1
126 1 7 GLU H 1 9 CYS H 0.000 . 4.500 4.380 4.172 4.527 0.027 8 0 "[ . 1 . 2]" 1
127 1 7 GLU H 1 10 ARG H 0.000 . 6.000 4.674 4.564 4.758 . 0 0 "[ . 1 . 2]" 1
128 1 7 GLU HA 1 8 ALA H 0.000 . 4.000 3.565 3.551 3.578 . 0 0 "[ . 1 . 2]" 1
129 1 7 GLU HA 1 9 CYS H 0.000 . 6.000 4.902 4.776 4.995 . 0 0 "[ . 1 . 2]" 1
130 1 7 GLU HA 1 10 ARG QB 0.000 . 4.000 2.868 2.342 3.286 . 0 0 "[ . 1 . 2]" 1
131 1 7 GLU HA 1 10 ARG QD 0.000 . 5.000 4.122 3.155 4.989 . 0 0 "[ . 1 . 2]" 1
132 1 7 GLU HA 1 10 ARG H 0.000 . 4.000 3.825 3.530 4.013 0.013 18 0 "[ . 1 . 2]" 1
133 1 7 GLU HA 1 11 ALA H 0.000 . 4.500 4.012 3.698 4.313 . 0 0 "[ . 1 . 2]" 1
134 1 7 GLU HB3 1 8 ALA H 0.000 . 4.500 2.853 2.270 4.032 . 0 0 "[ . 1 . 2]" 1
135 1 7 GLU HB2 1 8 ALA H 0.000 . 4.500 3.088 2.543 3.632 . 0 0 "[ . 1 . 2]" 1
136 1 7 GLU QB 1 8 ALA H 0.000 . 4.000 2.524 2.244 3.299 . 0 0 "[ . 1 . 2]" 1
137 1 8 ALA H 1 8 ALA MB 0.000 . 3.000 2.178 2.125 2.231 . 0 0 "[ . 1 . 2]" 1
138 1 8 ALA H 1 9 CYS QB 0.000 . 5.000 4.502 4.370 4.820 . 0 0 "[ . 1 . 2]" 1
139 1 8 ALA H 1 9 CYS H 0.000 . 3.500 2.782 2.638 2.902 . 0 0 "[ . 1 . 2]" 1
140 1 8 ALA H 1 10 ARG H 0.000 . 4.500 4.136 3.995 4.265 . 0 0 "[ . 1 . 2]" 1
141 1 8 ALA H 1 11 ALA H 0.000 . 6.000 4.683 4.565 4.907 . 0 0 "[ . 1 . 2]" 1
142 1 8 ALA H 1 37 PRO HD3 0.000 . 6.000 5.208 4.970 5.494 . 0 0 "[ . 1 . 2]" 1
143 1 8 ALA H 1 37 PRO HD2 0.000 . 6.000 4.928 4.778 5.135 . 0 0 "[ . 1 . 2]" 1
144 1 8 ALA H 1 37 PRO QD 0.000 . 4.500 4.494 4.452 4.526 0.026 20 0 "[ . 1 . 2]" 1
145 1 8 ALA HA 1 9 CYS H 0.000 . 4.500 3.571 3.562 3.576 . 0 0 "[ . 1 . 2]" 1
146 1 8 ALA HA 1 11 ALA H 0.000 . 4.000 3.575 3.422 3.826 . 0 0 "[ . 1 . 2]" 1
147 1 8 ALA MB 1 9 CYS H 0.000 . 3.500 2.297 2.157 2.443 . 0 0 "[ . 1 . 2]" 1
148 1 8 ALA MB 1 37 PRO QG 0.000 . 5.000 2.872 2.395 3.344 . 0 0 "[ . 1 . 2]" 1
149 1 9 CYS H 1 9 CYS HB3 0.000 . 3.500 3.097 2.573 3.567 0.067 20 0 "[ . 1 . 2]" 1
150 1 9 CYS H 1 9 CYS HB2 0.000 . 3.500 2.347 2.179 2.521 . 0 0 "[ . 1 . 2]" 1
151 1 9 CYS H 1 10 ARG QB 0.000 . 6.000 4.526 4.409 4.630 . 0 0 "[ . 1 . 2]" 1
152 1 9 CYS H 1 10 ARG H 0.000 . 3.500 2.793 2.705 2.882 . 0 0 "[ . 1 . 2]" 1
153 1 9 CYS H 1 11 ALA H 0.000 . 5.000 4.294 4.169 4.532 . 0 0 "[ . 1 . 2]" 1
154 1 9 CYS H 1 28 PHE QE 0.000 . 5.000 4.785 4.262 5.030 0.030 17 0 "[ . 1 . 2]" 1
155 1 9 CYS H 1 36 VAL HA 0.000 . 6.000 4.129 3.990 4.409 . 0 0 "[ . 1 . 2]" 1
156 1 9 CYS H 1 37 PRO HD3 0.000 . 6.000 3.255 3.082 3.410 . 0 0 "[ . 1 . 2]" 1
157 1 9 CYS H 1 37 PRO HD2 0.000 . 6.000 3.887 3.609 4.151 . 0 0 "[ . 1 . 2]" 1
158 1 9 CYS H 1 37 PRO QD 0.000 . 3.500 3.092 2.980 3.228 . 0 0 "[ . 1 . 2]" 1
159 1 9 CYS H 1 37 PRO QG 0.000 . 6.000 3.966 3.680 4.421 . 0 0 "[ . 1 . 2]" 1
160 1 9 CYS H 1 103 VAL MG1 0.000 . 6.000 5.131 4.540 5.915 . 0 0 "[ . 1 . 2]" 1
161 1 9 CYS H 1 103 VAL MG2 0.000 . 6.000 5.385 4.228 6.006 0.006 14 0 "[ . 1 . 2]" 1
162 1 9 CYS HA 1 10 ARG H 0.000 . 4.000 3.549 3.523 3.568 . 0 0 "[ . 1 . 2]" 1
163 1 9 CYS HA 1 12 ALA MB 0.000 . 4.000 3.038 2.630 3.319 . 0 0 "[ . 1 . 2]" 1
164 1 9 CYS HA 1 12 ALA H 0.000 . 4.000 3.748 3.592 3.879 . 0 0 "[ . 1 . 2]" 1
165 1 9 CYS HA 1 28 PHE QE 0.000 . 4.000 2.852 2.228 3.634 . 0 0 "[ . 1 . 2]" 1
166 1 9 CYS HA 1 28 PHE HZ 0.000 . 4.000 3.221 2.359 3.912 . 0 0 "[ . 1 . 2]" 1
167 1 9 CYS HA 1 37 PRO HA 0.000 . 5.000 4.982 4.873 5.021 0.021 8 0 "[ . 1 . 2]" 1
168 1 9 CYS HA 1 37 PRO QB 0.000 . 5.000 3.625 3.289 4.055 . 0 0 "[ . 1 . 2]" 1
169 1 9 CYS HA 1 37 PRO HG3 0.000 . 5.000 2.619 1.973 3.467 . 0 0 "[ . 1 . 2]" 1
170 1 9 CYS HA 1 37 PRO HG2 0.000 . 5.000 3.894 2.379 4.901 . 0 0 "[ . 1 . 2]" 1
171 1 9 CYS HA 1 37 PRO QG 0.000 . 4.000 2.573 1.917 3.400 . 0 0 "[ . 1 . 2]" 1
172 1 9 CYS HB3 1 10 ARG H 0.000 . 4.000 2.953 2.462 3.737 . 0 0 "[ . 1 . 2]" 1
173 1 9 CYS HB2 1 10 ARG H 0.000 . 4.000 3.245 2.626 3.930 . 0 0 "[ . 1 . 2]" 1
174 1 9 CYS QB 1 28 PHE QE 0.000 . 4.000 2.977 2.332 3.456 . 0 0 "[ . 1 . 2]" 1
175 1 9 CYS HB3 1 103 VAL QG 0.000 . 5.000 2.526 1.924 3.365 . 0 0 "[ . 1 . 2]" 1
176 1 9 CYS HB2 1 103 VAL QG 0.000 . 5.000 3.081 2.061 3.996 . 0 0 "[ . 1 . 2]" 1
177 1 9 CYS QB 1 104 VAL QG 0.000 . 5.000 3.994 3.135 4.755 . 0 0 "[ . 1 . 2]" 1
178 1 10 ARG H 1 10 ARG HB3 0.000 . 3.500 2.988 2.510 3.509 0.009 12 0 "[ . 1 . 2]" 1
179 1 10 ARG H 1 10 ARG HB2 0.000 . 3.500 2.273 2.092 2.532 . 0 0 "[ . 1 . 2]" 1
180 1 10 ARG H 1 10 ARG HD3 0.000 . 6.000 5.220 3.912 5.945 . 0 0 "[ . 1 . 2]" 1
181 1 10 ARG H 1 10 ARG HD2 0.000 . 6.000 4.797 3.891 5.848 . 0 0 "[ . 1 . 2]" 1
182 1 10 ARG H 1 10 ARG HG3 0.000 . 5.000 3.954 2.849 4.578 . 0 0 "[ . 1 . 2]" 1
183 1 10 ARG H 1 10 ARG HG2 0.000 . 5.000 4.340 3.452 4.641 . 0 0 "[ . 1 . 2]" 1
184 1 10 ARG H 1 10 ARG QG 0.000 . 4.500 3.635 2.783 4.039 . 0 0 "[ . 1 . 2]" 1
185 1 10 ARG H 1 11 ALA MB 0.000 . 6.000 4.297 4.201 4.414 . 0 0 "[ . 1 . 2]" 1
186 1 10 ARG H 1 11 ALA H 0.000 . 3.500 2.695 2.615 2.831 . 0 0 "[ . 1 . 2]" 1
187 1 10 ARG H 1 12 ALA H 0.000 . 5.000 4.321 4.162 4.511 . 0 0 "[ . 1 . 2]" 1
188 1 10 ARG H 1 13 TYR H 0.000 . 6.000 4.764 4.609 4.945 . 0 0 "[ . 1 . 2]" 1
189 1 10 ARG H 1 37 PRO QD 0.000 . 5.000 5.021 4.884 5.068 0.068 16 0 "[ . 1 . 2]" 1
190 1 10 ARG H 1 103 VAL MG1 0.000 . 6.000 4.712 3.692 6.006 0.006 12 0 "[ . 1 . 2]" 1
191 1 10 ARG H 1 103 VAL MG2 0.000 . 6.000 5.248 3.856 6.016 0.016 5 0 "[ . 1 . 2]" 1
192 1 10 ARG H 1 103 VAL QG 0.000 . 5.000 4.148 3.627 4.680 . 0 0 "[ . 1 . 2]" 1
193 1 10 ARG HA 1 11 ALA H 0.000 . 4.000 3.555 3.537 3.573 . 0 0 "[ . 1 . 2]" 1
194 1 10 ARG HA 1 12 ALA H 0.000 . 5.000 4.520 4.349 4.731 . 0 0 "[ . 1 . 2]" 1
195 1 10 ARG HA 1 13 TYR HB3 0.000 . 4.000 2.934 2.346 3.421 . 0 0 "[ . 1 . 2]" 1
196 1 10 ARG HA 1 13 TYR HB2 0.000 . 4.000 2.929 2.307 3.568 . 0 0 "[ . 1 . 2]" 1
197 1 10 ARG HA 1 13 TYR H 0.000 . 4.000 3.422 3.226 3.697 . 0 0 "[ . 1 . 2]" 1
198 1 10 ARG HA 1 14 ASN H 0.000 . 5.000 4.077 3.686 4.363 . 0 0 "[ . 1 . 2]" 1
199 1 10 ARG HA 1 104 VAL QG 0.000 . 6.000 5.120 4.386 5.983 . 0 0 "[ . 1 . 2]" 1
200 1 10 ARG HB3 1 11 ALA H 0.000 . 5.000 2.736 2.414 3.247 . 0 0 "[ . 1 . 2]" 1
201 1 10 ARG HB2 1 11 ALA H 0.000 . 5.000 3.393 2.718 3.906 . 0 0 "[ . 1 . 2]" 1
202 1 10 ARG QB 1 11 ALA H 0.000 . 3.500 2.560 2.384 2.688 . 0 0 "[ . 1 . 2]" 1
203 1 10 ARG QD 1 14 ASN HD21 0.000 . 6.000 4.206 2.110 5.395 . 0 0 "[ . 1 . 2]" 1
204 1 10 ARG QD 1 14 ASN HD22 0.000 . 6.000 4.075 2.183 5.827 . 0 0 "[ . 1 . 2]" 1
205 1 10 ARG QG 1 14 ASN HD21 0.000 . 5.000 3.426 2.447 4.643 . 0 0 "[ . 1 . 2]" 1
206 1 10 ARG QG 1 14 ASN HD22 0.000 . 5.000 3.570 2.135 4.964 . 0 0 "[ . 1 . 2]" 1
207 1 10 ARG QG 1 14 ASN QD 0.000 . 4.500 3.042 2.020 4.156 . 0 0 "[ . 1 . 2]" 1
208 1 11 ALA H 1 11 ALA MB 0.000 . 3.000 2.160 2.084 2.242 . 0 0 "[ . 1 . 2]" 1
209 1 11 ALA H 1 12 ALA H 0.000 . 3.000 2.846 2.786 2.932 . 0 0 "[ . 1 . 2]" 1
210 1 11 ALA H 1 13 TYR H 0.000 . 5.000 4.193 3.982 4.449 . 0 0 "[ . 1 . 2]" 1
211 1 11 ALA H 1 14 ASN QD 0.000 . 6.000 4.058 3.680 4.396 . 0 0 "[ . 1 . 2]" 1
212 1 11 ALA H 1 14 ASN H 0.000 . 6.000 4.944 4.695 5.252 . 0 0 "[ . 1 . 2]" 1
213 1 11 ALA HA 1 12 ALA H 0.000 . 4.500 3.561 3.547 3.572 . 0 0 "[ . 1 . 2]" 1
214 1 11 ALA HA 1 14 ASN H 0.000 . 4.000 3.807 3.540 4.036 0.036 19 0 "[ . 1 . 2]" 1
215 1 11 ALA HA 1 14 ASN HD21 0.000 . 4.500 3.047 2.286 3.758 . 0 0 "[ . 1 . 2]" 1
216 1 11 ALA HA 1 14 ASN HD22 0.000 . 4.500 3.298 1.882 4.502 0.002 20 0 "[ . 1 . 2]" 1
217 1 11 ALA MB 1 12 ALA H 0.000 . 4.000 2.458 2.313 2.606 . 0 0 "[ . 1 . 2]" 1
218 1 12 ALA H 1 12 ALA MB 0.000 . 3.000 2.178 2.068 2.252 . 0 0 "[ . 1 . 2]" 1
219 1 12 ALA H 1 13 TYR QB 0.000 . 4.500 4.395 4.206 4.507 0.007 3 0 "[ . 1 . 2]" 1
220 1 12 ALA H 1 13 TYR H 0.000 . 3.500 2.682 2.497 2.804 . 0 0 "[ . 1 . 2]" 1
221 1 12 ALA H 1 14 ASN H 0.000 . 5.000 4.414 4.071 4.824 . 0 0 "[ . 1 . 2]" 1
222 1 12 ALA H 1 26 VAL QG 0.000 . 6.000 5.092 4.708 5.558 . 0 0 "[ . 1 . 2]" 1
223 1 12 ALA HA 1 13 TYR H 0.000 . 4.500 3.544 3.513 3.574 . 0 0 "[ . 1 . 2]" 1
224 1 12 ALA HA 1 15 LEU H 0.000 . 4.000 3.491 3.346 3.757 . 0 0 "[ . 1 . 2]" 1
225 1 12 ALA HA 1 15 LEU HB3 0.000 . 4.000 3.049 2.210 3.563 . 0 0 "[ . 1 . 2]" 1
226 1 12 ALA HA 1 15 LEU HB2 0.000 . 4.000 3.132 2.555 3.574 . 0 0 "[ . 1 . 2]" 1
227 1 12 ALA HA 1 16 VAL QG 0.000 . 6.000 3.722 3.264 4.349 . 0 0 "[ . 1 . 2]" 1
228 1 12 ALA HA 1 26 VAL QG 0.000 . 4.500 3.701 3.259 4.284 . 0 0 "[ . 1 . 2]" 1
229 1 12 ALA HA 1 40 GLN HE21 0.000 . 6.000 3.718 2.637 5.870 . 0 0 "[ . 1 . 2]" 1
230 1 12 ALA HA 1 40 GLN HE22 0.000 . 6.000 2.813 1.940 4.597 . 0 0 "[ . 1 . 2]" 1
231 1 12 ALA MB 1 13 TYR H 0.000 . 4.500 2.591 2.322 2.816 . 0 0 "[ . 1 . 2]" 1
232 1 12 ALA MB 1 26 VAL MG1 0.000 . 5.000 2.685 2.094 3.169 . 0 0 "[ . 1 . 2]" 1
233 1 12 ALA MB 1 26 VAL MG2 0.000 . 5.000 2.729 1.881 3.357 . 0 0 "[ . 1 . 2]" 1
234 1 12 ALA MB 1 26 VAL QG 0.000 . 4.000 2.336 1.854 2.736 . 0 0 "[ . 1 . 2]" 1
235 1 12 ALA MB 1 37 PRO HA 0.000 . 6.000 4.103 3.849 4.536 . 0 0 "[ . 1 . 2]" 1
236 1 12 ALA MB 1 37 PRO QB 0.000 . 4.000 2.091 1.879 2.442 . 0 0 "[ . 1 . 2]" 1
237 1 12 ALA MB 1 37 PRO QG 0.000 . 4.000 2.060 1.898 2.372 . 0 0 "[ . 1 . 2]" 1
238 1 13 TYR H 1 13 TYR HB3 0.000 . 4.000 2.829 2.643 3.013 . 0 0 "[ . 1 . 2]" 1
239 1 13 TYR H 1 13 TYR HB2 0.000 . 4.000 2.277 2.139 2.409 . 0 0 "[ . 1 . 2]" 1
240 1 13 TYR H 1 13 TYR QB 0.000 . 3.500 2.181 2.096 2.235 . 0 0 "[ . 1 . 2]" 1
241 1 13 TYR H 1 13 TYR HD1 0.000 . 5.000 4.841 4.209 5.027 0.027 13 0 "[ . 1 . 2]" 1
242 1 13 TYR H 1 13 TYR HD2 0.000 . 5.000 4.464 4.045 5.030 0.030 19 0 "[ . 1 . 2]" 1
243 1 13 TYR H 1 13 TYR QD 0.000 . 4.500 4.100 3.886 4.183 . 0 0 "[ . 1 . 2]" 1
244 1 13 TYR H 1 14 ASN H 0.000 . 3.500 2.851 2.708 2.993 . 0 0 "[ . 1 . 2]" 1
245 1 13 TYR H 1 14 ASN QD 0.000 . 6.000 4.721 4.326 5.496 . 0 0 "[ . 1 . 2]" 1
246 1 13 TYR H 1 15 LEU H 0.000 . 5.000 4.108 3.862 4.369 . 0 0 "[ . 1 . 2]" 1
247 1 13 TYR H 1 16 VAL H 0.000 . 6.000 4.785 4.595 4.966 . 0 0 "[ . 1 . 2]" 1
248 1 13 TYR HA 1 13 TYR QD 0.000 . 4.500 2.991 2.602 3.149 . 0 0 "[ . 1 . 2]" 1
249 1 13 TYR HA 1 13 TYR QE 0.000 . 6.000 4.565 4.380 4.709 . 0 0 "[ . 1 . 2]" 1
250 1 13 TYR HA 1 14 ASN H 0.000 . 4.500 3.567 3.528 3.592 . 0 0 "[ . 1 . 2]" 1
251 1 13 TYR HA 1 16 VAL QG 0.000 . 4.000 2.903 1.823 3.881 . 0 0 "[ . 1 . 2]" 1
252 1 13 TYR HA 1 16 VAL HB 0.000 . 4.500 3.421 2.692 4.555 0.055 8 0 "[ . 1 . 2]" 1
253 1 13 TYR HA 1 16 VAL H 0.000 . 4.000 3.688 3.405 4.011 0.011 13 0 "[ . 1 . 2]" 1
254 1 13 TYR HA 1 26 VAL QG 0.000 . 6.000 4.318 3.885 4.914 . 0 0 "[ . 1 . 2]" 1
255 1 13 TYR HA 1 104 VAL QG 0.000 . 6.000 4.871 4.527 5.342 . 0 0 "[ . 1 . 2]" 1
256 1 13 TYR HB3 1 14 ASN H 0.000 . 4.500 2.412 2.116 2.691 . 0 0 "[ . 1 . 2]" 1
257 1 13 TYR HB2 1 14 ASN H 0.000 . 4.500 3.581 3.315 3.810 . 0 0 "[ . 1 . 2]" 1
258 1 13 TYR QB 1 14 ASN H 0.000 . 4.000 2.375 2.097 2.637 . 0 0 "[ . 1 . 2]" 1
259 1 13 TYR QB 1 104 VAL QG 0.000 . 5.000 3.826 3.391 4.261 . 0 0 "[ . 1 . 2]" 1
260 1 13 TYR QD 1 14 ASN H 0.000 . 4.000 3.696 3.156 4.004 0.004 5 0 "[ . 1 . 2]" 1
261 1 13 TYR QD 1 104 VAL MG1 0.000 . 4.000 3.303 2.452 3.845 . 0 0 "[ . 1 . 2]" 1
262 1 13 TYR QD 1 104 VAL MG2 0.000 . 4.000 2.640 2.193 3.074 . 0 0 "[ . 1 . 2]" 1
263 1 13 TYR QE 1 17 ARG HD3 0.000 . 4.500 3.797 2.314 4.512 0.012 19 0 "[ . 1 . 2]" 1
264 1 13 TYR QE 1 17 ARG HD2 0.000 . 4.500 3.077 2.106 4.366 . 0 0 "[ . 1 . 2]" 1
265 1 13 TYR QE 1 104 VAL HA 0.000 . 5.000 3.507 2.130 4.764 . 0 0 "[ . 1 . 2]" 1
266 1 13 TYR QE 1 104 VAL MG1 0.000 . 5.000 2.012 1.816 2.703 . 0 0 "[ . 1 . 2]" 1
267 1 13 TYR QE 1 104 VAL MG2 0.000 . 5.000 2.851 1.932 3.953 . 0 0 "[ . 1 . 2]" 1
268 1 13 TYR QE 1 104 VAL QG 0.000 . 4.000 1.946 1.725 2.659 . 0 0 "[ . 1 . 2]" 1
269 1 13 TYR QE 1 105 GLN H 0.000 . 5.000 4.771 3.684 5.012 0.012 4 0 "[ . 1 . 2]" 1
270 1 14 ASN H 1 14 ASN HB3 0.000 . 3.500 3.144 2.432 3.542 0.042 20 0 "[ . 1 . 2]" 1
271 1 14 ASN H 1 14 ASN HB2 0.000 . 3.500 2.841 2.197 3.589 0.089 7 0 "[ . 1 . 2]" 1
272 1 14 ASN H 1 14 ASN HD21 0.000 . 5.000 3.000 2.422 3.728 . 0 0 "[ . 1 . 2]" 1
273 1 14 ASN H 1 14 ASN HD22 0.000 . 5.000 3.843 3.270 4.445 . 0 0 "[ . 1 . 2]" 1
274 1 14 ASN H 1 15 LEU HB3 0.000 . 6.000 5.287 4.777 5.560 . 0 0 "[ . 1 . 2]" 1
275 1 14 ASN H 1 15 LEU HB2 0.000 . 6.000 4.724 4.453 5.039 . 0 0 "[ . 1 . 2]" 1
276 1 14 ASN H 1 15 LEU QD 0.000 . 6.000 5.418 5.074 5.666 . 0 0 "[ . 1 . 2]" 1
277 1 14 ASN H 1 15 LEU H 0.000 . 3.500 2.681 2.534 2.806 . 0 0 "[ . 1 . 2]" 1
278 1 14 ASN H 1 16 VAL H 0.000 . 5.000 4.329 4.173 4.536 . 0 0 "[ . 1 . 2]" 1
279 1 14 ASN HA 1 15 LEU H 0.000 . 4.500 3.522 3.448 3.565 . 0 0 "[ . 1 . 2]" 1
280 1 14 ASN HA 1 16 VAL H 0.000 . 5.000 4.584 4.354 4.825 . 0 0 "[ . 1 . 2]" 1
281 1 14 ASN HA 1 17 ARG HB3 0.000 . 4.500 3.627 2.312 4.359 . 0 0 "[ . 1 . 2]" 1
282 1 14 ASN HA 1 17 ARG HB2 0.000 . 4.500 2.942 2.171 4.534 0.034 20 0 "[ . 1 . 2]" 1
283 1 14 ASN HA 1 17 ARG HD3 0.000 . 5.000 3.721 1.944 5.008 0.008 9 0 "[ . 1 . 2]" 1
284 1 14 ASN HA 1 17 ARG HD2 0.000 . 5.000 3.997 2.659 4.901 . 0 0 "[ . 1 . 2]" 1
285 1 14 ASN HA 1 17 ARG H 0.000 . 4.000 3.531 3.225 3.786 . 0 0 "[ . 1 . 2]" 1
286 1 14 ASN HA 1 18 ASP H 0.000 . 6.000 4.679 4.228 5.250 . 0 0 "[ . 1 . 2]" 1
287 1 14 ASN HB3 1 15 LEU H 0.000 . 4.500 3.719 3.189 4.264 . 0 0 "[ . 1 . 2]" 1
288 1 14 ASN HB2 1 15 LEU H 0.000 . 4.500 3.278 2.709 4.049 . 0 0 "[ . 1 . 2]" 1
289 1 14 ASN QD 1 15 LEU H 0.000 . 5.000 4.320 3.783 4.929 . 0 0 "[ . 1 . 2]" 1
290 1 15 LEU H 1 15 LEU HB3 0.000 . 3.000 2.823 2.433 3.011 0.011 15 0 "[ . 1 . 2]" 1
291 1 15 LEU H 1 15 LEU HB2 0.000 . 3.000 2.271 2.124 2.618 . 0 0 "[ . 1 . 2]" 1
292 1 15 LEU H 1 15 LEU HG 0.000 . 5.000 4.407 4.040 4.573 . 0 0 "[ . 1 . 2]" 1
293 1 15 LEU H 1 16 VAL QG 0.000 . 5.000 3.948 3.330 4.169 . 0 0 "[ . 1 . 2]" 1
294 1 15 LEU H 1 16 VAL H 0.000 . 3.500 2.642 2.436 2.775 . 0 0 "[ . 1 . 2]" 1
295 1 15 LEU H 1 17 ARG H 0.000 . 5.000 3.936 3.730 4.142 . 0 0 "[ . 1 . 2]" 1
296 1 15 LEU H 1 18 ASP H 0.000 . 6.000 5.056 4.724 5.439 . 0 0 "[ . 1 . 2]" 1
297 1 15 LEU HA 1 16 VAL H 0.000 . 4.000 3.555 3.540 3.571 . 0 0 "[ . 1 . 2]" 1
298 1 15 LEU HA 1 17 ARG H 0.000 . 6.000 4.317 4.032 4.632 . 0 0 "[ . 1 . 2]" 1
299 1 15 LEU HA 1 18 ASP QB 0.000 . 4.500 3.352 2.803 4.035 . 0 0 "[ . 1 . 2]" 1
300 1 15 LEU HA 1 18 ASP H 0.000 . 4.000 3.740 3.562 4.014 0.014 19 0 "[ . 1 . 2]" 1
301 1 15 LEU HB3 1 16 VAL H 0.000 . 4.000 2.560 2.414 2.786 . 0 0 "[ . 1 . 2]" 1
302 1 15 LEU HB2 1 16 VAL H 0.000 . 4.000 3.561 3.336 3.858 . 0 0 "[ . 1 . 2]" 1
303 1 15 LEU QB 1 23 VAL QG 0.000 . 6.000 3.594 3.062 4.558 . 0 0 "[ . 1 . 2]" 1
304 1 15 LEU HG 1 21 SER QB 0.000 . 6.000 4.505 2.693 5.958 . 0 0 "[ . 1 . 2]" 1
305 1 15 LEU QD 1 21 SER QB 0.000 . 4.500 3.339 2.336 4.368 . 0 0 "[ . 1 . 2]" 1
306 1 16 VAL H 1 16 VAL HB 0.000 . 4.000 2.640 2.472 3.618 . 0 0 "[ . 1 . 2]" 1
307 1 16 VAL H 1 16 VAL MG1 0.000 . 4.500 3.468 2.215 3.783 . 0 0 "[ . 1 . 2]" 1
308 1 16 VAL H 1 16 VAL MG2 0.000 . 4.500 2.352 1.967 3.768 . 0 0 "[ . 1 . 2]" 1
309 1 16 VAL H 1 17 ARG H 0.000 . 3.500 2.583 2.451 2.676 . 0 0 "[ . 1 . 2]" 1
310 1 16 VAL H 1 23 VAL QG 0.000 . 5.000 4.276 3.638 4.962 . 0 0 "[ . 1 . 2]" 1
311 1 16 VAL HA 1 17 ARG H 0.000 . 5.000 3.514 3.467 3.551 . 0 0 "[ . 1 . 2]" 1
312 1 16 VAL HA 1 18 ASP H 0.000 . 5.000 4.024 3.644 4.317 . 0 0 "[ . 1 . 2]" 1
313 1 16 VAL HA 1 23 VAL QG 0.000 . 4.500 2.920 1.818 3.878 . 0 0 "[ . 1 . 2]" 1
314 1 16 VAL HB 1 17 ARG H 0.000 . 4.500 3.034 2.601 4.071 . 0 0 "[ . 1 . 2]" 1
315 1 16 VAL HB 1 23 VAL QG 0.000 . 6.000 4.495 3.063 5.654 . 0 0 "[ . 1 . 2]" 1
316 1 16 VAL QG 1 17 ARG H 0.000 . 5.000 3.138 2.217 3.462 . 0 0 "[ . 1 . 2]" 1
317 1 16 VAL QG 1 23 VAL QG 0.000 . 4.000 2.500 1.888 3.198 . 0 0 "[ . 1 . 2]" 1
318 1 16 VAL QG 1 25 TRP HA 0.000 . 6.000 3.560 3.026 4.161 . 0 0 "[ . 1 . 2]" 1
319 1 16 VAL QG 1 26 VAL H 0.000 . 6.000 4.020 3.617 4.600 . 0 0 "[ . 1 . 2]" 1
320 1 16 VAL QG 1 40 GLN HE21 0.000 . 4.500 3.438 2.312 4.466 . 0 0 "[ . 1 . 2]" 1
321 1 16 VAL QG 1 40 GLN HE22 0.000 . 4.500 3.888 3.037 4.466 . 0 0 "[ . 1 . 2]" 1
322 1 17 ARG H 1 17 ARG HB3 0.000 . 4.000 3.106 2.382 3.589 . 0 0 "[ . 1 . 2]" 1
323 1 17 ARG H 1 17 ARG HB2 0.000 . 4.000 2.427 2.066 3.601 . 0 0 "[ . 1 . 2]" 1
324 1 17 ARG H 1 17 ARG HG3 0.000 . 5.000 3.579 2.828 4.423 . 0 0 "[ . 1 . 2]" 1
325 1 17 ARG H 1 17 ARG HG2 0.000 . 5.000 3.780 2.198 4.669 . 0 0 "[ . 1 . 2]" 1
326 1 17 ARG H 1 18 ASP QB 0.000 . 6.000 4.462 4.249 4.679 . 0 0 "[ . 1 . 2]" 1
327 1 17 ARG H 1 18 ASP H 0.000 . 3.500 2.705 2.553 2.818 . 0 0 "[ . 1 . 2]" 1
328 1 17 ARG HA 1 18 ASP H 0.000 . 4.000 3.505 3.344 3.542 . 0 0 "[ . 1 . 2]" 1
329 1 17 ARG HB3 1 18 ASP H 0.000 . 5.000 3.319 2.663 4.120 . 0 0 "[ . 1 . 2]" 1
330 1 17 ARG HB2 1 18 ASP H 0.000 . 5.000 3.444 2.738 4.233 . 0 0 "[ . 1 . 2]" 1
331 1 17 ARG HG3 1 18 ASP H 0.000 . 6.000 4.591 2.347 5.549 . 0 0 "[ . 1 . 2]" 1
332 1 17 ARG HG2 1 18 ASP H 0.000 . 6.000 4.531 2.795 5.482 . 0 0 "[ . 1 . 2]" 1
333 1 17 ARG QG 1 18 ASP H 0.000 . 5.000 4.041 2.288 4.659 . 0 0 "[ . 1 . 2]" 1
334 1 18 ASP H 1 18 ASP HB3 0.000 . 3.000 2.814 2.607 3.007 0.007 7 0 "[ . 1 . 2]" 1
335 1 18 ASP H 1 18 ASP HB2 0.000 . 3.000 2.336 2.187 2.510 . 0 0 "[ . 1 . 2]" 1
336 1 18 ASP H 1 19 ASP H 0.000 . 4.500 4.380 3.773 4.547 0.047 5 0 "[ . 1 . 2]" 1
337 1 18 ASP H 1 20 GLY H 0.000 . 6.000 5.022 3.456 5.699 . 0 0 "[ . 1 . 2]" 1
338 1 18 ASP HA 1 19 ASP H 0.000 . 3.000 2.186 2.136 2.435 . 0 0 "[ . 1 . 2]" 1
339 1 18 ASP HA 1 20 GLY H 0.000 . 4.000 3.840 3.285 4.066 0.066 4 0 "[ . 1 . 2]" 1
340 1 18 ASP QB 1 19 ASP H 0.000 . 4.500 3.790 3.616 4.011 . 0 0 "[ . 1 . 2]" 1
341 1 18 ASP QB 1 20 GLY H 0.000 . 5.000 3.365 2.760 4.189 . 0 0 "[ . 1 . 2]" 1
342 1 18 ASP QB 1 21 SER H 0.000 . 5.000 3.857 3.218 4.682 . 0 0 "[ . 1 . 2]" 1
343 1 18 ASP HB3 1 21 SER QB 0.000 . 5.000 3.308 1.910 3.700 . 0 0 "[ . 1 . 2]" 1
344 1 18 ASP HB2 1 21 SER QB 0.000 . 5.000 4.709 2.868 5.055 0.055 17 0 "[ . 1 . 2]" 1
345 1 18 ASP QB 1 21 SER QB 0.000 . 4.000 3.245 1.883 3.609 . 0 0 "[ . 1 . 2]" 1
346 1 19 ASP H 1 19 ASP HB3 0.000 . 4.000 3.339 2.790 3.998 . 0 0 "[ . 1 . 2]" 1
347 1 19 ASP H 1 19 ASP HB2 0.000 . 4.000 2.697 2.140 3.660 . 0 0 "[ . 1 . 2]" 1
348 1 19 ASP H 1 19 ASP QB 0.000 . 3.500 2.501 2.117 3.337 . 0 0 "[ . 1 . 2]" 1
349 1 19 ASP H 1 20 GLY QA 0.000 . 6.000 4.354 4.137 4.742 . 0 0 "[ . 1 . 2]" 1
350 1 19 ASP H 1 20 GLY H 0.000 . 4.000 2.871 2.496 3.140 . 0 0 "[ . 1 . 2]" 1
351 1 19 ASP H 1 21 SER H 0.000 . 6.000 5.064 4.380 5.595 . 0 0 "[ . 1 . 2]" 1
352 1 19 ASP HA 1 20 GLY H 0.000 . 4.000 2.999 2.784 3.544 . 0 0 "[ . 1 . 2]" 1
353 1 19 ASP HA 1 21 SER H 0.000 . 6.000 4.199 3.393 5.657 . 0 0 "[ . 1 . 2]" 1
354 1 19 ASP QB 1 20 GLY H 0.000 . 4.500 3.724 2.653 4.065 . 0 0 "[ . 1 . 2]" 1
355 1 20 GLY H 1 21 SER QB 0.000 . 5.000 3.952 3.343 4.867 . 0 0 "[ . 1 . 2]" 1
356 1 20 GLY H 1 21 SER H 0.000 . 3.500 2.512 2.063 3.481 . 0 0 "[ . 1 . 2]" 1
357 1 20 GLY HA3 1 21 SER H 0.000 . 4.500 3.324 2.909 3.569 . 0 0 "[ . 1 . 2]" 1
358 1 20 GLY HA2 1 21 SER H 0.000 . 4.500 3.047 2.290 3.539 . 0 0 "[ . 1 . 2]" 1
359 1 21 SER H 1 21 SER HB3 0.000 . 3.500 3.066 2.559 3.512 0.012 9 0 "[ . 1 . 2]" 1
360 1 21 SER H 1 21 SER HB2 0.000 . 3.500 2.704 2.182 3.565 0.065 6 0 "[ . 1 . 2]" 1
361 1 21 SER H 1 22 ALA H 0.000 . 5.000 3.612 2.219 4.601 . 0 0 "[ . 1 . 2]" 1
362 1 21 SER H 1 23 VAL HB 0.000 . 5.000 4.822 4.058 5.040 0.040 7 0 "[ . 1 . 2]" 1
363 1 21 SER H 1 23 VAL QG 0.000 . 6.000 4.347 3.006 5.035 . 0 0 "[ . 1 . 2]" 1
364 1 21 SER HA 1 22 ALA H 0.000 . 3.000 2.653 2.295 3.013 0.013 12 0 "[ . 1 . 2]" 1
365 1 21 SER HA 1 23 VAL H 0.000 . 4.500 4.457 4.058 4.549 0.049 16 0 "[ . 1 . 2]" 1
366 1 21 SER QB 1 22 ALA H 0.000 . 6.000 3.311 1.895 4.023 . 0 0 "[ . 1 . 2]" 1
367 1 21 SER QB 1 23 VAL MG1 0.000 . 6.000 4.291 2.270 5.414 . 0 0 "[ . 1 . 2]" 1
368 1 21 SER QB 1 23 VAL MG2 0.000 . 6.000 2.952 1.988 4.451 . 0 0 "[ . 1 . 2]" 1
369 1 21 SER QB 1 23 VAL QG 0.000 . 4.000 2.651 1.985 3.629 . 0 0 "[ . 1 . 2]" 1
370 1 21 SER QB 1 23 VAL H 0.000 . 4.500 3.466 2.292 4.425 . 0 0 "[ . 1 . 2]" 1
371 1 22 ALA H 1 22 ALA MB 0.000 . 3.500 2.518 2.109 2.901 . 0 0 "[ . 1 . 2]" 1
372 1 22 ALA H 1 23 VAL QG 0.000 . 5.000 3.787 3.233 4.353 . 0 0 "[ . 1 . 2]" 1
373 1 22 ALA H 1 23 VAL H 0.000 . 4.500 3.116 2.660 3.634 . 0 0 "[ . 1 . 2]" 1
374 1 22 ALA HA 1 23 VAL H 0.000 . 4.000 2.813 2.536 3.454 . 0 0 "[ . 1 . 2]" 1
375 1 22 ALA MB 1 23 VAL H 0.000 . 6.000 3.646 2.971 3.728 . 0 0 "[ . 1 . 2]" 1
376 1 23 VAL H 1 23 VAL HB 0.000 . 3.000 2.838 2.565 3.046 0.046 19 0 "[ . 1 . 2]" 1
377 1 23 VAL H 1 23 VAL QG 0.000 . 4.000 2.664 2.030 2.947 . 0 0 "[ . 1 . 2]" 1
378 1 23 VAL H 1 24 ILE H 0.000 . 6.000 4.147 3.738 4.499 . 0 0 "[ . 1 . 2]" 1
379 1 23 VAL HA 1 24 ILE MG 0.000 . 6.000 3.855 3.574 4.044 . 0 0 "[ . 1 . 2]" 1
380 1 23 VAL HA 1 24 ILE H 0.000 . 3.000 2.170 2.151 2.216 . 0 0 "[ . 1 . 2]" 1
381 1 23 VAL HA 1 25 TRP H 0.000 . 4.000 3.746 3.532 3.995 . 0 0 "[ . 1 . 2]" 1
382 1 23 VAL HA 1 42 ALA HA 0.000 . 4.000 3.449 3.134 3.998 . 0 0 "[ . 1 . 2]" 1
383 1 23 VAL HA 1 42 ALA MB 0.000 . 5.000 3.444 3.088 3.792 . 0 0 "[ . 1 . 2]" 1
384 1 23 VAL MG1 1 24 ILE H 0.000 . 6.000 3.063 2.508 4.074 . 0 0 "[ . 1 . 2]" 1
385 1 23 VAL MG2 1 24 ILE H 0.000 . 6.000 3.958 2.576 4.311 . 0 0 "[ . 1 . 2]" 1
386 1 23 VAL QG 1 24 ILE H 0.000 . 4.500 2.819 2.487 3.200 . 0 0 "[ . 1 . 2]" 1
387 1 23 VAL QG 1 25 TRP H 0.000 . 4.000 3.102 2.571 3.486 . 0 0 "[ . 1 . 2]" 1
388 1 23 VAL QG 1 40 GLN HA 0.000 . 5.000 3.025 2.494 3.529 . 0 0 "[ . 1 . 2]" 1
389 1 23 VAL QG 1 40 GLN HE21 0.000 . 6.000 3.237 1.836 4.804 . 0 0 "[ . 1 . 2]" 1
390 1 23 VAL QG 1 40 GLN HE22 0.000 . 6.000 3.785 2.691 4.729 . 0 0 "[ . 1 . 2]" 1
391 1 23 VAL QG 1 41 GLY H 0.000 . 4.500 3.331 2.893 3.852 . 0 0 "[ . 1 . 2]" 1
392 1 24 ILE H 1 24 ILE HG13 0.000 . 5.000 2.379 1.969 3.328 . 0 0 "[ . 1 . 2]" 1
393 1 24 ILE H 1 24 ILE HG12 0.000 . 5.000 2.857 2.311 3.284 . 0 0 "[ . 1 . 2]" 1
394 1 24 ILE H 1 24 ILE QG 0.000 . 4.000 2.157 1.948 2.416 . 0 0 "[ . 1 . 2]" 1
395 1 24 ILE H 1 25 TRP H 0.000 . 3.500 2.038 1.917 2.366 . 0 0 "[ . 1 . 2]" 1
396 1 24 ILE H 1 42 ALA HA 0.000 . 4.000 2.496 2.103 3.238 . 0 0 "[ . 1 . 2]" 1
397 1 24 ILE H 1 42 ALA MB 0.000 . 5.000 3.582 3.214 4.027 . 0 0 "[ . 1 . 2]" 1
398 1 24 ILE HA 1 25 TRP H 0.000 . 5.000 3.518 3.486 3.557 . 0 0 "[ . 1 . 2]" 1
399 1 24 ILE HA 1 62 ARG H 0.000 . 6.000 4.025 3.604 4.581 . 0 0 "[ . 1 . 2]" 1
400 1 24 ILE HB 1 25 TRP H 0.000 . 6.000 3.892 3.598 4.016 . 0 0 "[ . 1 . 2]" 1
401 1 24 ILE HB 1 62 ARG H 0.000 . 5.000 3.698 3.224 4.301 . 0 0 "[ . 1 . 2]" 1
402 1 24 ILE MD 1 25 TRP HD1 0.000 . 4.000 1.982 1.811 2.370 . 0 0 "[ . 1 . 2]" 1
403 1 24 ILE MD 1 25 TRP H 0.000 . 6.000 3.374 2.877 3.837 . 0 0 "[ . 1 . 2]" 1
404 1 24 ILE MD 1 25 TRP HE1 0.000 . 5.000 3.850 3.369 4.097 . 0 0 "[ . 1 . 2]" 1
405 1 24 ILE MD 1 42 ALA HA 0.000 . 5.000 3.293 2.258 3.621 . 0 0 "[ . 1 . 2]" 1
406 1 24 ILE MD 1 43 GLU H 0.000 . 6.000 4.821 3.919 5.204 . 0 0 "[ . 1 . 2]" 1
407 1 24 ILE MD 1 44 TYR HA 0.000 . 6.000 3.970 3.665 4.538 . 0 0 "[ . 1 . 2]" 1
408 1 24 ILE MD 1 44 TYR H 0.000 . 5.000 3.760 3.206 4.492 . 0 0 "[ . 1 . 2]" 1
409 1 24 ILE MD 1 44 TYR QB 0.000 . 5.000 3.234 2.643 3.884 . 0 0 "[ . 1 . 2]" 1
410 1 24 ILE MD 1 44 TYR QD 0.000 . 6.000 3.265 2.798 4.006 . 0 0 "[ . 1 . 2]" 1
411 1 24 ILE MD 1 61 VAL QG 0.000 . 4.000 2.279 1.808 3.411 . 0 0 "[ . 1 . 2]" 1
412 1 24 ILE MD 1 62 ARG H 0.000 . 5.000 4.203 3.511 5.000 0.000 12 0 "[ . 1 . 2]" 1
413 1 24 ILE QG 1 25 TRP HD1 0.000 . 4.000 2.328 1.956 2.686 . 0 0 "[ . 1 . 2]" 1
414 1 24 ILE QG 1 25 TRP HE1 0.000 . 4.500 3.984 3.720 4.213 . 0 0 "[ . 1 . 2]" 1
415 1 24 ILE QG 1 25 TRP H 0.000 . 4.500 2.012 1.904 2.123 . 0 0 "[ . 1 . 2]" 1
416 1 24 ILE HG13 1 42 ALA HA 0.000 . 4.000 2.653 2.214 3.627 . 0 0 "[ . 1 . 2]" 1
417 1 24 ILE HG12 1 42 ALA HA 0.000 . 4.000 1.895 1.734 2.024 . 0 0 "[ . 1 . 2]" 1
418 1 24 ILE QG 1 43 GLU H 0.000 . 5.000 4.319 4.011 4.582 . 0 0 "[ . 1 . 2]" 1
419 1 24 ILE MG 1 25 TRP H 0.000 . 6.000 3.993 3.785 4.092 . 0 0 "[ . 1 . 2]" 1
420 1 24 ILE MG 1 42 ALA HA 0.000 . 5.000 2.582 2.085 3.307 . 0 0 "[ . 1 . 2]" 1
421 1 25 TRP H 1 25 TRP HD1 0.000 . 5.000 3.274 3.085 3.466 . 0 0 "[ . 1 . 2]" 1
422 1 25 TRP H 1 25 TRP HE1 0.000 . 6.000 4.710 4.606 4.868 . 0 0 "[ . 1 . 2]" 1
423 1 25 TRP H 1 26 VAL HA 0.000 . 6.000 4.943 4.877 5.042 . 0 0 "[ . 1 . 2]" 1
424 1 25 TRP H 1 26 VAL H 0.000 . 6.000 4.457 4.416 4.495 . 0 0 "[ . 1 . 2]" 1
425 1 25 TRP H 1 41 GLY H 0.000 . 4.000 3.566 3.314 3.852 . 0 0 "[ . 1 . 2]" 1
426 1 25 TRP H 1 42 ALA HA 0.000 . 4.500 3.691 3.482 3.871 . 0 0 "[ . 1 . 2]" 1
427 1 25 TRP HE1 1 41 GLY QA 0.000 . 4.500 3.779 3.449 4.135 . 0 0 "[ . 1 . 2]" 1
428 1 25 TRP HE1 1 42 ALA H 0.000 . 5.000 4.808 4.619 5.000 . 9 0 "[ . 1 . 2]" 1
429 1 25 TRP HE1 1 43 GLU H 0.000 . 4.000 3.508 3.385 3.634 . 0 0 "[ . 1 . 2]" 1
430 1 25 TRP HE1 1 44 TYR HA 0.000 . 4.000 2.367 2.107 2.725 . 0 0 "[ . 1 . 2]" 1
431 1 25 TRP HE1 1 44 TYR QD 0.000 . 6.000 4.042 3.769 4.466 . 0 0 "[ . 1 . 2]" 1
432 1 25 TRP HE1 1 46 HIS HD2 0.000 . 6.000 5.874 5.508 6.021 0.021 9 0 "[ . 1 . 2]" 1
433 1 25 TRP HE1 1 46 HIS HB3 0.000 . 5.000 4.908 4.537 5.021 0.021 3 0 "[ . 1 . 2]" 1
434 1 25 TRP HE1 1 46 HIS HB2 0.000 . 5.000 3.629 3.259 3.801 . 0 0 "[ . 1 . 2]" 1
435 1 25 TRP HE1 1 46 HIS QB 0.000 . 4.000 3.538 3.195 3.694 . 0 0 "[ . 1 . 2]" 1
436 1 25 TRP HE1 1 47 PHE HB3 0.000 . 5.000 5.005 4.878 5.043 0.043 5 0 "[ . 1 . 2]" 1
437 1 25 TRP HE1 1 47 PHE HB2 0.000 . 5.000 3.941 3.459 4.278 . 0 0 "[ . 1 . 2]" 1
438 1 25 TRP HE1 1 47 PHE QB 0.000 . 4.500 3.795 3.401 4.052 . 0 0 "[ . 1 . 2]" 1
439 1 25 TRP HE1 1 47 PHE QD 0.000 . 6.000 5.303 4.110 5.991 . 0 0 "[ . 1 . 2]" 1
440 1 25 TRP HE1 1 47 PHE H 0.000 . 5.000 3.871 3.536 4.091 . 0 0 "[ . 1 . 2]" 1
441 1 25 TRP HA 1 26 VAL QG 0.000 . 6.000 3.198 3.092 3.341 . 0 0 "[ . 1 . 2]" 1
442 1 25 TRP HA 1 26 VAL H 0.000 . 3.000 2.330 2.296 2.379 . 0 0 "[ . 1 . 2]" 1
443 1 25 TRP HA 1 60 PHE QD 0.000 . 5.000 4.834 4.492 5.053 0.053 4 0 "[ . 1 . 2]" 1
444 1 25 TRP HA 1 61 VAL HA 0.000 . 4.000 2.247 2.025 2.490 . 0 0 "[ . 1 . 2]" 1
445 1 25 TRP HA 1 61 VAL QG 0.000 . 6.000 2.873 2.462 3.559 . 0 0 "[ . 1 . 2]" 1
446 1 25 TRP HA 1 62 ARG H 0.000 . 5.000 3.559 3.226 3.876 . 0 0 "[ . 1 . 2]" 1
447 1 25 TRP HB3 1 26 VAL H 0.000 . 5.000 3.886 3.830 3.964 . 0 0 "[ . 1 . 2]" 1
448 1 25 TRP HB2 1 26 VAL H 0.000 . 5.000 2.581 2.493 2.681 . 0 0 "[ . 1 . 2]" 1
449 1 25 TRP QB 1 26 VAL H 0.000 . 4.000 2.545 2.463 2.640 . 0 0 "[ . 1 . 2]" 1
450 1 25 TRP HB3 1 61 VAL QG 0.000 . 5.000 2.048 1.860 2.347 . 0 0 "[ . 1 . 2]" 1
451 1 25 TRP HB2 1 61 VAL QG 0.000 . 5.000 2.389 1.851 3.526 . 0 0 "[ . 1 . 2]" 1
452 1 25 TRP HD1 1 43 GLU H 0.000 . 5.000 4.887 4.718 5.011 0.011 17 0 "[ . 1 . 2]" 1
453 1 25 TRP HE3 1 26 VAL HA 0.000 . 4.500 2.441 2.257 2.551 . 0 0 "[ . 1 . 2]" 1
454 1 25 TRP HE3 1 26 VAL H 0.000 . 5.000 2.659 2.557 2.730 . 0 0 "[ . 1 . 2]" 1
455 1 25 TRP HE3 1 41 GLY H 0.000 . 5.000 4.112 3.931 4.342 . 0 0 "[ . 1 . 2]" 1
456 1 25 TRP HH2 1 27 THR H 0.000 . 5.000 5.043 5.026 5.071 0.071 14 0 "[ . 1 . 2]" 1
457 1 25 TRP HH2 1 39 GLU H 0.000 . 6.000 4.772 4.563 4.975 . 0 0 "[ . 1 . 2]" 1
458 1 25 TRP HH2 1 40 GLN HA 0.000 . 6.000 4.741 4.573 4.841 . 0 0 "[ . 1 . 2]" 1
459 1 25 TRP HH2 1 40 GLN H 0.000 . 4.500 4.512 4.421 4.544 0.044 2 0 "[ . 1 . 2]" 1
460 1 25 TRP HZ2 1 40 GLN HA 0.000 . 6.000 5.374 5.185 5.553 . 0 0 "[ . 1 . 2]" 1
461 1 25 TRP HZ2 1 41 GLY H 0.000 . 6.000 3.848 3.689 4.141 . 0 0 "[ . 1 . 2]" 1
462 1 25 TRP HZ2 1 42 ALA H 0.000 . 6.000 5.856 5.675 6.012 0.012 8 0 "[ . 1 . 2]" 1
463 1 25 TRP HZ2 1 43 GLU H 0.000 . 5.000 4.951 4.783 5.017 0.017 18 0 "[ . 1 . 2]" 1
464 1 25 TRP HZ2 1 46 HIS HB3 0.000 . 4.000 2.496 2.062 2.743 . 0 0 "[ . 1 . 2]" 1
465 1 25 TRP HZ2 1 46 HIS HB2 0.000 . 4.000 2.108 1.914 2.318 . 0 0 "[ . 1 . 2]" 1
466 1 25 TRP HZ3 1 27 THR H 0.000 . 4.000 2.821 2.728 2.942 . 0 0 "[ . 1 . 2]" 1
467 1 25 TRP HZ3 1 38 GLY H 0.000 . 6.000 5.401 5.288 5.521 . 0 0 "[ . 1 . 2]" 1
468 1 25 TRP HZ3 1 39 GLU H 0.000 . 4.000 4.075 4.027 4.128 0.128 11 0 "[ . 1 . 2]" 1
469 1 26 VAL H 1 26 VAL QG 0.000 . 4.000 2.354 2.124 2.777 . 0 0 "[ . 1 . 2]" 1
470 1 26 VAL H 1 27 THR H 0.000 . 6.000 4.389 4.363 4.431 . 0 0 "[ . 1 . 2]" 1
471 1 26 VAL H 1 28 PHE QD 0.000 . 6.000 5.062 4.834 5.567 . 0 0 "[ . 1 . 2]" 1
472 1 26 VAL H 1 28 PHE QE 0.000 . 6.000 5.056 4.402 6.039 0.039 10 0 "[ . 1 . 2]" 1
473 1 26 VAL H 1 60 PHE QB 0.000 . 6.000 3.404 2.788 5.191 . 0 0 "[ . 1 . 2]" 1
474 1 26 VAL H 1 60 PHE QD 0.000 . 6.000 4.759 4.411 5.220 . 0 0 "[ . 1 . 2]" 1
475 1 26 VAL H 1 60 PHE H 0.000 . 4.000 2.948 2.611 3.318 . 0 0 "[ . 1 . 2]" 1
476 1 26 VAL H 1 61 VAL HA 0.000 . 4.000 3.743 3.426 4.019 0.019 2 0 "[ . 1 . 2]" 1
477 1 26 VAL H 1 61 VAL QG 0.000 . 6.000 3.695 2.898 4.677 . 0 0 "[ . 1 . 2]" 1
478 1 26 VAL H 1 62 ARG H 0.000 . 6.000 5.563 5.129 5.978 . 0 0 "[ . 1 . 2]" 1
479 1 26 VAL HA 1 27 THR H 0.000 . 3.000 2.305 2.268 2.364 . 0 0 "[ . 1 . 2]" 1
480 1 26 VAL HA 1 40 GLN HA 0.000 . 4.000 2.447 2.255 2.647 . 0 0 "[ . 1 . 2]" 1
481 1 26 VAL HA 1 41 GLY H 0.000 . 4.000 3.967 3.844 4.065 0.065 11 0 "[ . 1 . 2]" 1
482 1 26 VAL HB 1 27 THR H 0.000 . 3.500 3.099 2.690 3.646 0.146 8 0 "[ . 1 . 2]" 1
483 1 26 VAL MG1 1 27 THR H 0.000 . 6.000 3.457 2.006 4.067 . 0 0 "[ . 1 . 2]" 1
484 1 26 VAL MG2 1 27 THR H 0.000 . 6.000 3.604 1.944 4.131 . 0 0 "[ . 1 . 2]" 1
485 1 26 VAL QG 1 27 THR H 0.000 . 5.000 2.907 1.939 3.411 . 0 0 "[ . 1 . 2]" 1
486 1 26 VAL QG 1 28 PHE QE 0.000 . 4.500 2.225 1.831 3.187 . 0 0 "[ . 1 . 2]" 1
487 1 26 VAL QG 1 40 GLN HA 0.000 . 5.000 2.738 2.310 3.727 . 0 0 "[ . 1 . 2]" 1
488 1 26 VAL QG 1 40 GLN QB 0.000 . 4.000 2.482 1.832 3.614 . 0 0 "[ . 1 . 2]" 1
489 1 26 VAL QG 1 40 GLN H 0.000 . 6.000 4.513 4.107 4.941 . 0 0 "[ . 1 . 2]" 1
490 1 26 VAL QG 1 41 GLY H 0.000 . 6.000 4.243 3.907 5.106 . 0 0 "[ . 1 . 2]" 1
491 1 26 VAL QG 1 60 PHE QB 0.000 . 4.500 2.392 1.731 4.450 . 0 0 "[ . 1 . 2]" 1
492 1 26 VAL QG 1 60 PHE H 0.000 . 5.000 3.352 2.716 4.465 . 0 0 "[ . 1 . 2]" 1
493 1 27 THR H 1 28 PHE QD 0.000 . 4.500 4.489 4.089 4.549 0.049 7 0 "[ . 1 . 2]" 1
494 1 27 THR H 1 28 PHE QE 0.000 . 6.000 5.315 4.980 5.660 . 0 0 "[ . 1 . 2]" 1
495 1 27 THR H 1 28 PHE H 0.000 . 6.000 4.498 4.119 4.613 . 0 0 "[ . 1 . 2]" 1
496 1 27 THR H 1 38 GLY H 0.000 . 5.000 2.808 2.634 2.972 . 0 0 "[ . 1 . 2]" 1
497 1 27 THR H 1 39 GLU HB3 0.000 . 5.000 4.636 3.980 4.906 . 0 0 "[ . 1 . 2]" 1
498 1 27 THR H 1 39 GLU HB2 0.000 . 5.000 3.940 3.551 4.560 . 0 0 "[ . 1 . 2]" 1
499 1 27 THR H 1 40 GLN HA 0.000 . 4.500 4.035 3.818 4.334 . 0 0 "[ . 1 . 2]" 1
500 1 27 THR H 1 41 GLY H 0.000 . 6.000 5.614 5.492 5.905 . 0 0 "[ . 1 . 2]" 1
501 1 27 THR HA 1 28 PHE H 0.000 . 3.500 2.390 2.077 2.546 . 0 0 "[ . 1 . 2]" 1
502 1 27 THR HA 1 57 LEU QD 0.000 . 6.000 4.224 2.983 5.608 . 0 0 "[ . 1 . 2]" 1
503 1 27 THR HA 1 59 ALA HA 0.000 . 4.000 2.662 2.110 3.206 . 0 0 "[ . 1 . 2]" 1
504 1 27 THR HA 1 59 ALA MB 0.000 . 6.000 3.291 2.159 4.016 . 0 0 "[ . 1 . 2]" 1
505 1 27 THR HA 1 60 PHE H 0.000 . 4.500 3.786 2.874 4.463 . 0 0 "[ . 1 . 2]" 1
506 1 27 THR HB 1 28 PHE H 0.000 . 4.000 3.404 2.572 4.120 0.120 11 0 "[ . 1 . 2]" 1
507 1 27 THR HB 1 57 LEU MD1 0.000 . 6.000 4.644 2.482 5.973 . 0 0 "[ . 1 . 2]" 1
508 1 27 THR HB 1 57 LEU MD2 0.000 . 6.000 5.379 2.903 6.020 0.020 10 0 "[ . 1 . 2]" 1
509 1 27 THR MG 1 28 PHE H 0.000 . 6.000 2.424 1.920 4.282 . 0 0 "[ . 1 . 2]" 1
510 1 27 THR MG 1 47 PHE QD 0.000 . 5.000 3.824 2.590 4.878 . 0 0 "[ . 1 . 2]" 1
511 1 27 THR MG 1 47 PHE QE 0.000 . 4.000 3.115 1.992 4.038 0.038 15 0 "[ . 1 . 2]" 1
512 1 27 THR MG 1 47 PHE HZ 0.000 . 5.000 4.556 3.740 5.005 0.005 11 0 "[ . 1 . 2]" 1
513 1 27 THR MG 1 57 LEU QD 0.000 . 4.000 2.546 2.001 3.627 . 0 0 "[ . 1 . 2]" 1
514 1 27 THR MG 1 59 ALA MB 0.000 . 5.000 3.626 2.230 4.913 . 0 0 "[ . 1 . 2]" 1
515 1 28 PHE H 1 28 PHE QD 0.000 . 4.500 3.348 2.114 3.769 . 0 0 "[ . 1 . 2]" 1
516 1 28 PHE H 1 28 PHE QE 0.000 . 6.000 5.509 4.461 5.911 . 0 0 "[ . 1 . 2]" 1
517 1 28 PHE H 1 29 LYS H 0.000 . 6.000 3.848 3.591 4.468 . 0 0 "[ . 1 . 2]" 1
518 1 28 PHE H 1 57 LEU HA 0.000 . 6.000 5.705 5.261 6.036 0.036 20 0 "[ . 1 . 2]" 1
519 1 28 PHE H 1 57 LEU QB 0.000 . 5.000 3.840 3.152 4.838 . 0 0 "[ . 1 . 2]" 1
520 1 28 PHE H 1 57 LEU QD 0.000 . 6.000 3.572 2.608 4.839 . 0 0 "[ . 1 . 2]" 1
521 1 28 PHE H 1 58 PHE QB 0.000 . 6.000 3.855 3.174 4.338 . 0 0 "[ . 1 . 2]" 1
522 1 28 PHE H 1 58 PHE QD 0.000 . 6.000 5.437 4.749 5.950 . 0 0 "[ . 1 . 2]" 1
523 1 28 PHE H 1 58 PHE H 0.000 . 4.500 3.700 3.342 4.212 . 0 0 "[ . 1 . 2]" 1
524 1 28 PHE H 1 59 ALA HA 0.000 . 4.000 3.261 2.575 3.761 . 0 0 "[ . 1 . 2]" 1
525 1 28 PHE H 1 60 PHE QB 0.000 . 6.000 5.810 5.061 6.044 0.044 12 0 "[ . 1 . 2]" 1
526 1 28 PHE H 1 60 PHE H 0.000 . 6.000 5.142 4.279 5.533 . 0 0 "[ . 1 . 2]" 1
527 1 28 PHE HA 1 28 PHE QD 0.000 . 4.000 2.989 2.701 3.048 . 0 0 "[ . 1 . 2]" 1
528 1 28 PHE HA 1 29 LYS H 0.000 . 3.000 2.173 2.130 2.219 . 0 0 "[ . 1 . 2]" 1
529 1 28 PHE HA 1 35 ILE MG 0.000 . 6.000 4.211 3.859 5.277 . 0 0 "[ . 1 . 2]" 1
530 1 28 PHE HA 1 36 VAL H 0.000 . 6.000 4.445 4.100 4.630 . 0 0 "[ . 1 . 2]" 1
531 1 28 PHE HA 1 37 PRO HA 0.000 . 4.000 2.189 2.030 2.428 . 0 0 "[ . 1 . 2]" 1
532 1 28 PHE HA 1 38 GLY H 0.000 . 4.000 3.223 2.921 3.413 . 0 0 "[ . 1 . 2]" 1
533 1 28 PHE QB 1 29 LYS H 0.000 . 4.000 3.670 3.330 3.782 . 0 0 "[ . 1 . 2]" 1
534 1 28 PHE QB 1 35 ILE MG 0.000 . 5.000 3.199 2.089 3.718 . 0 0 "[ . 1 . 2]" 1
535 1 28 PHE QB 1 36 VAL H 0.000 . 5.000 4.821 3.634 5.042 0.042 3 0 "[ . 1 . 2]" 1
536 1 28 PHE QB 1 38 GLY H 0.000 . 6.000 4.875 4.723 5.013 . 0 0 "[ . 1 . 2]" 1
537 1 28 PHE QB 1 58 PHE H 0.000 . 5.000 3.236 2.712 3.718 . 0 0 "[ . 1 . 2]" 1
538 1 28 PHE QD 1 29 LYS H 0.000 . 4.500 4.471 4.301 4.530 0.030 19 0 "[ . 1 . 2]" 1
539 1 28 PHE QD 1 36 VAL H 0.000 . 5.000 4.447 3.798 5.021 0.021 20 0 "[ . 1 . 2]" 1
540 1 28 PHE QD 1 38 GLY H 0.000 . 4.500 4.027 3.184 4.349 . 0 0 "[ . 1 . 2]" 1
541 1 28 PHE QD 1 58 PHE H 0.000 . 6.000 5.286 4.767 5.746 . 0 0 "[ . 1 . 2]" 1
542 1 28 PHE QD 1 60 PHE H 0.000 . 5.000 3.837 3.210 4.978 . 0 0 "[ . 1 . 2]" 1
543 1 28 PHE QE 1 35 ILE MG 0.000 . 5.000 4.004 2.928 5.016 0.016 10 0 "[ . 1 . 2]" 1
544 1 28 PHE QE 1 38 GLY H 0.000 . 5.000 4.762 4.246 4.962 . 0 0 "[ . 1 . 2]" 1
545 1 28 PHE QE 1 60 PHE H 0.000 . 6.000 4.779 3.788 5.955 . 0 0 "[ . 1 . 2]" 1
546 1 29 LYS H 1 29 LYS HG3 0.000 . 4.500 3.338 2.043 3.960 . 0 0 "[ . 1 . 2]" 1
547 1 29 LYS H 1 29 LYS HG2 0.000 . 4.500 2.424 2.033 4.193 . 0 0 "[ . 1 . 2]" 1
548 1 29 LYS H 1 30 TYR H 0.000 . 6.000 4.446 4.378 4.502 . 0 0 "[ . 1 . 2]" 1
549 1 29 LYS H 1 35 ILE HA 0.000 . 6.000 5.135 4.768 5.619 . 0 0 "[ . 1 . 2]" 1
550 1 29 LYS H 1 35 ILE MG 0.000 . 6.000 4.142 3.738 5.128 . 0 0 "[ . 1 . 2]" 1
551 1 29 LYS H 1 36 VAL QG 0.000 . 5.000 3.636 3.268 4.670 . 0 0 "[ . 1 . 2]" 1
552 1 29 LYS H 1 36 VAL H 0.000 . 4.500 3.535 3.227 3.921 . 0 0 "[ . 1 . 2]" 1
553 1 29 LYS H 1 37 PRO HA 0.000 . 5.000 3.656 3.486 4.013 . 0 0 "[ . 1 . 2]" 1
554 1 29 LYS H 1 38 GLY H 0.000 . 4.500 4.285 3.979 4.500 . 0 0 "[ . 1 . 2]" 1
555 1 29 LYS HA 1 30 TYR H 0.000 . 3.000 2.452 2.205 2.629 . 0 0 "[ . 1 . 2]" 1
556 1 29 LYS HA 1 35 ILE MG 0.000 . 6.000 4.135 3.616 4.848 . 0 0 "[ . 1 . 2]" 1
557 1 29 LYS HA 1 57 LEU HA 0.000 . 4.500 3.606 3.158 4.269 . 0 0 "[ . 1 . 2]" 1
558 1 29 LYS HA 1 57 LEU QD 0.000 . 6.000 3.934 2.762 5.272 . 0 0 "[ . 1 . 2]" 1
559 1 29 LYS HA 1 58 PHE H 0.000 . 6.000 3.566 3.012 4.401 . 0 0 "[ . 1 . 2]" 1
560 1 29 LYS HB3 1 30 TYR H 0.000 . 4.000 3.621 2.739 4.007 0.007 18 0 "[ . 1 . 2]" 1
561 1 29 LYS HB2 1 30 TYR H 0.000 . 4.000 2.496 2.024 3.939 . 0 0 "[ . 1 . 2]" 1
562 1 29 LYS HG3 1 30 TYR H 0.000 . 6.000 3.888 3.127 4.953 . 0 0 "[ . 1 . 2]" 1
563 1 29 LYS HG2 1 30 TYR H 0.000 . 6.000 4.349 3.496 5.121 . 0 0 "[ . 1 . 2]" 1
564 1 29 LYS QG 1 36 VAL QG 0.000 . 5.000 3.304 2.352 5.021 0.021 16 0 "[ . 1 . 2]" 1
565 1 29 LYS QG 1 36 VAL H 0.000 . 6.000 4.315 3.557 5.823 . 0 0 "[ . 1 . 2]" 1
566 1 29 LYS QG 1 38 GLY H 0.000 . 6.000 4.868 4.278 5.408 . 0 0 "[ . 1 . 2]" 1
567 1 29 LYS QD 1 38 GLY QA 0.000 . 5.000 3.089 1.889 4.145 . 0 0 "[ . 1 . 2]" 1
568 1 29 LYS QD 1 38 GLY H 0.000 . 6.000 5.007 3.647 6.004 0.004 11 0 "[ . 1 . 2]" 1
569 1 30 TYR H 1 30 TYR HD1 0.000 . 5.000 3.479 2.206 5.028 0.028 12 0 "[ . 1 . 2]" 1
570 1 30 TYR H 1 30 TYR HD2 0.000 . 5.000 3.762 2.424 5.026 0.026 11 0 "[ . 1 . 2]" 1
571 1 30 TYR H 1 30 TYR QD 0.000 . 4.000 2.619 2.202 3.780 . 0 0 "[ . 1 . 2]" 1
572 1 30 TYR H 1 30 TYR QE 0.000 . 6.000 4.377 3.958 5.761 . 0 0 "[ . 1 . 2]" 1
573 1 30 TYR H 1 31 ASP H 0.000 . 5.000 4.423 4.230 4.576 . 0 0 "[ . 1 . 2]" 1
574 1 30 TYR H 1 57 LEU HA 0.000 . 6.000 5.005 4.273 5.784 . 0 0 "[ . 1 . 2]" 1
575 1 30 TYR HA 1 31 ASP QB 0.000 . 5.000 4.057 3.820 4.331 . 0 0 "[ . 1 . 2]" 1
576 1 30 TYR HA 1 31 ASP H 0.000 . 3.000 2.158 2.116 2.377 . 0 0 "[ . 1 . 2]" 1
577 1 30 TYR HA 1 35 ILE MG 0.000 . 6.000 3.735 2.841 4.351 . 0 0 "[ . 1 . 2]" 1
578 1 30 TYR HA 1 34 THR H 0.000 . 5.000 4.179 3.791 5.013 0.013 14 0 "[ . 1 . 2]" 1
579 1 30 TYR HA 1 36 VAL H 0.000 . 4.000 3.031 2.573 3.953 . 0 0 "[ . 1 . 2]" 1
580 1 30 TYR HB3 1 31 ASP H 0.000 . 5.000 3.914 2.498 4.314 . 0 0 "[ . 1 . 2]" 1
581 1 30 TYR HB2 1 31 ASP H 0.000 . 5.000 3.581 3.135 4.514 . 0 0 "[ . 1 . 2]" 1
582 1 30 TYR QB 1 34 THR H 0.000 . 4.500 3.317 2.570 4.521 0.021 2 0 "[ . 1 . 2]" 1
583 1 30 TYR QD 1 31 ASP H 0.000 . 4.500 3.959 2.664 4.537 0.037 14 0 "[ . 1 . 2]" 1
584 1 30 TYR QD 1 34 THR H 0.000 . 5.000 3.504 2.449 4.804 . 0 0 "[ . 1 . 2]" 1
585 1 30 TYR QE 1 33 SER QB 0.000 . 6.000 5.796 5.049 6.027 0.027 16 0 "[ . 1 . 2]" 1
586 1 30 TYR QE 1 35 ILE MD 0.000 . 6.000 4.946 3.390 6.000 . 0 0 "[ . 1 . 2]" 1
587 1 30 TYR QE 1 56 ARG HG3 0.000 . 6.000 3.995 2.899 5.461 . 0 0 "[ . 1 . 2]" 1
588 1 30 TYR QE 1 56 ARG HG2 0.000 . 6.000 4.222 2.674 5.574 . 0 0 "[ . 1 . 2]" 1
589 1 31 ASP H 1 31 ASP HB3 0.000 . 4.000 3.182 2.827 3.811 . 0 0 "[ . 1 . 2]" 1
590 1 31 ASP H 1 31 ASP HB2 0.000 . 4.000 2.538 2.228 3.694 . 0 0 "[ . 1 . 2]" 1
591 1 31 ASP H 1 32 GLY H 0.000 . 5.000 4.117 3.447 4.414 . 0 0 "[ . 1 . 2]" 1
592 1 31 ASP H 1 34 THR HB 0.000 . 6.000 5.338 4.791 5.757 . 0 0 "[ . 1 . 2]" 1
593 1 31 ASP H 1 34 THR H 0.000 . 4.500 3.170 2.496 4.167 . 0 0 "[ . 1 . 2]" 1
594 1 31 ASP H 1 34 THR MG 0.000 . 5.000 3.335 2.363 5.049 0.049 18 0 "[ . 1 . 2]" 1
595 1 31 ASP H 1 36 VAL QG 0.000 . 5.000 2.880 2.278 3.336 . 0 0 "[ . 1 . 2]" 1
596 1 31 ASP H 1 36 VAL H 0.000 . 5.000 4.176 3.813 4.674 . 0 0 "[ . 1 . 2]" 1
597 1 31 ASP HA 1 32 GLY H 0.000 . 3.000 2.242 2.146 3.013 0.013 17 0 "[ . 1 . 2]" 1
598 1 31 ASP HA 1 34 THR H 0.000 . 6.000 4.749 4.277 5.441 . 0 0 "[ . 1 . 2]" 1
599 1 31 ASP QB 1 32 GLY H 0.000 . 5.000 3.671 1.916 4.006 . 0 0 "[ . 1 . 2]" 1
600 1 31 ASP QB 1 34 THR MG 0.000 . 6.000 3.271 1.915 5.556 . 0 0 "[ . 1 . 2]" 1
601 1 31 ASP QB 1 34 THR H 0.000 . 6.000 4.212 3.329 4.970 . 0 0 "[ . 1 . 2]" 1
602 1 31 ASP HB3 1 36 VAL QG 0.000 . 5.000 3.548 2.054 4.437 . 0 0 "[ . 1 . 2]" 1
603 1 31 ASP HB2 1 36 VAL QG 0.000 . 5.000 2.676 1.689 4.522 . 0 0 "[ . 1 . 2]" 1
604 1 32 GLY H 1 33 SER H 0.000 . 4.500 3.602 2.546 4.066 . 0 0 "[ . 1 . 2]" 1
605 1 32 GLY HA3 1 33 SER H 0.000 . 4.000 2.699 2.340 3.551 . 0 0 "[ . 1 . 2]" 1
606 1 32 GLY HA2 1 33 SER H 0.000 . 4.000 3.378 2.327 3.563 . 0 0 "[ . 1 . 2]" 1
607 1 32 GLY QA 1 34 THR H 0.000 . 6.000 4.035 3.736 4.231 . 0 0 "[ . 1 . 2]" 1
608 1 33 SER H 1 34 THR H 0.000 . 4.000 2.221 1.852 2.722 . 0 0 "[ . 1 . 2]" 1
609 1 33 SER HA 1 34 THR H 0.000 . 4.500 2.992 2.682 3.546 . 0 0 "[ . 1 . 2]" 1
610 1 33 SER HB3 1 34 THR H 0.000 . 5.000 4.297 2.805 4.693 . 0 0 "[ . 1 . 2]" 1
611 1 33 SER HB2 1 34 THR H 0.000 . 5.000 4.232 3.209 4.634 . 0 0 "[ . 1 . 2]" 1
612 1 33 SER QB 1 34 THR H 0.000 . 4.500 3.776 2.731 4.060 . 0 0 "[ . 1 . 2]" 1
613 1 34 THR H 1 35 ILE H 0.000 . 6.000 4.274 3.861 4.543 . 0 0 "[ . 1 . 2]" 1
614 1 34 THR HA 1 35 ILE H 0.000 . 3.000 2.223 2.136 2.568 . 0 0 "[ . 1 . 2]" 1
615 1 34 THR HB 1 35 ILE H 0.000 . 6.000 3.825 2.095 4.258 . 0 0 "[ . 1 . 2]" 1
616 1 34 THR HB 1 36 VAL QG 0.000 . 6.000 4.703 3.086 5.772 . 0 0 "[ . 1 . 2]" 1
617 1 34 THR MG 1 35 ILE H 0.000 . 6.000 3.928 3.101 4.280 . 0 0 "[ . 1 . 2]" 1
618 1 35 ILE H 1 35 ILE HB 0.000 . 4.000 2.674 2.551 3.611 . 0 0 "[ . 1 . 2]" 1
619 1 35 ILE H 1 35 ILE QG 0.000 . 4.000 2.170 1.863 2.610 . 0 0 "[ . 1 . 2]" 1
620 1 35 ILE H 1 35 ILE MD 0.000 . 5.000 3.104 2.112 3.645 . 0 0 "[ . 1 . 2]" 1
621 1 35 ILE H 1 36 VAL QG 0.000 . 6.000 4.281 3.537 5.057 . 0 0 "[ . 1 . 2]" 1
622 1 35 ILE H 1 36 VAL H 0.000 . 6.000 4.543 4.353 4.598 . 0 0 "[ . 1 . 2]" 1
623 1 35 ILE HA 1 36 VAL QG 0.000 . 6.000 3.378 3.218 3.626 . 0 0 "[ . 1 . 2]" 1
624 1 35 ILE HA 1 36 VAL H 0.000 . 3.000 2.174 2.142 2.218 . 0 0 "[ . 1 . 2]" 1
625 1 35 ILE HB 1 36 VAL H 0.000 . 4.500 3.977 3.080 4.145 . 0 0 "[ . 1 . 2]" 1
626 1 35 ILE QG 1 36 VAL H 0.000 . 5.000 4.337 4.122 4.744 . 0 0 "[ . 1 . 2]" 1
627 1 35 ILE MG 1 36 VAL H 0.000 . 4.000 2.511 2.233 3.557 . 0 0 "[ . 1 . 2]" 1
628 1 35 ILE MD 1 58 PHE QE 0.000 . 5.000 4.268 2.880 5.039 0.039 12 0 "[ . 1 . 2]" 1
629 1 35 ILE MD 1 58 PHE HZ 0.000 . 6.000 5.326 4.489 5.995 . 0 0 "[ . 1 . 2]" 1
630 1 35 ILE MD 1 96 ASP HA 0.000 . 4.500 2.910 2.160 4.174 . 0 0 "[ . 1 . 2]" 1
631 1 35 ILE MD 1 96 ASP HB3 0.000 . 5.000 3.161 2.185 4.414 . 0 0 "[ . 1 . 2]" 1
632 1 35 ILE MD 1 96 ASP HB2 0.000 . 5.000 3.988 3.605 4.590 . 0 0 "[ . 1 . 2]" 1
633 1 35 ILE MD 1 99 LEU QB 0.000 . 6.000 2.866 2.011 4.749 . 0 0 "[ . 1 . 2]" 1
634 1 35 ILE MD 1 99 LEU QD 0.000 . 4.500 2.282 1.767 3.753 . 0 0 "[ . 1 . 2]" 1
635 1 36 VAL H 1 36 VAL QG 0.000 . 4.000 2.342 2.208 2.825 . 0 0 "[ . 1 . 2]" 1
636 1 36 VAL HB 1 37 PRO QD 0.000 . 4.000 2.712 1.878 3.783 . 0 0 "[ . 1 . 2]" 1
637 1 36 VAL QG 1 37 PRO QD 0.000 . 5.000 2.422 1.810 3.040 . 0 0 "[ . 1 . 2]" 1
638 1 37 PRO HA 1 38 GLY H 0.000 . 3.000 2.351 2.254 2.459 . 0 0 "[ . 1 . 2]" 1
639 1 37 PRO HB3 1 38 GLY H 0.000 . 5.000 3.333 2.823 3.600 . 0 0 "[ . 1 . 2]" 1
640 1 37 PRO HB2 1 38 GLY H 0.000 . 5.000 2.975 2.565 3.567 . 0 0 "[ . 1 . 2]" 1
641 1 37 PRO QB 1 38 GLY H 0.000 . 4.500 2.731 2.495 2.980 . 0 0 "[ . 1 . 2]" 1
642 1 38 GLY H 1 39 GLU H 0.000 . 4.000 4.115 4.071 4.166 0.166 15 0 "[ . 1 . 2]" 1
643 1 38 GLY HA3 1 39 GLU H 0.000 . 3.500 2.223 2.196 2.254 . 0 0 "[ . 1 . 2]" 1
644 1 38 GLY HA2 1 39 GLU H 0.000 . 3.500 2.883 2.778 2.959 . 0 0 "[ . 1 . 2]" 1
645 1 39 GLU H 1 39 GLU HB3 0.000 . 4.000 3.572 3.257 3.654 . 0 0 "[ . 1 . 2]" 1
646 1 39 GLU H 1 39 GLU HB2 0.000 . 4.000 2.436 2.085 2.643 . 0 0 "[ . 1 . 2]" 1
647 1 39 GLU H 1 39 GLU QB 0.000 . 3.500 2.396 2.062 2.585 . 0 0 "[ . 1 . 2]" 1
648 1 39 GLU H 1 39 GLU HG3 0.000 . 4.000 3.419 2.912 3.893 . 0 0 "[ . 1 . 2]" 1
649 1 39 GLU H 1 39 GLU HG2 0.000 . 4.000 3.844 3.476 3.972 . 0 0 "[ . 1 . 2]" 1
650 1 39 GLU H 1 40 GLN H 0.000 . 4.500 4.545 4.503 4.567 0.067 5 0 "[ . 1 . 2]" 1
651 1 39 GLU HA 1 40 GLN H 0.000 . 3.000 2.154 2.131 2.171 . 0 0 "[ . 1 . 2]" 1
652 1 39 GLU HB3 1 40 GLN H 0.000 . 4.500 3.123 2.963 3.484 . 0 0 "[ . 1 . 2]" 1
653 1 39 GLU HB2 1 40 GLN H 0.000 . 4.500 4.214 4.144 4.342 . 0 0 "[ . 1 . 2]" 1
654 1 39 GLU QB 1 46 HIS HD2 0.000 . 5.000 4.397 3.932 4.987 . 0 0 "[ . 1 . 2]" 1
655 1 39 GLU QG 1 40 GLN H 0.000 . 5.000 3.603 2.717 3.941 . 0 0 "[ . 1 . 2]" 1
656 1 39 GLU HG3 1 46 HIS HD2 0.000 . 5.000 4.939 4.519 5.039 0.039 1 0 "[ . 1 . 2]" 1
657 1 39 GLU HG2 1 46 HIS HD2 0.000 . 5.000 4.508 4.129 5.009 0.009 9 0 "[ . 1 . 2]" 1
658 1 40 GLN H 1 40 GLN HB3 0.000 . 4.000 3.777 2.934 3.922 . 0 0 "[ . 1 . 2]" 1
659 1 40 GLN H 1 40 GLN HB2 0.000 . 4.000 2.968 2.753 3.777 . 0 0 "[ . 1 . 2]" 1
660 1 40 GLN H 1 40 GLN HG3 0.000 . 5.000 2.944 2.410 4.727 . 0 0 "[ . 1 . 2]" 1
661 1 40 GLN H 1 40 GLN HG2 0.000 . 5.000 3.807 2.737 4.777 . 0 0 "[ . 1 . 2]" 1
662 1 40 GLN H 1 41 GLY H 0.000 . 6.000 3.861 3.724 4.108 . 0 0 "[ . 1 . 2]" 1
663 1 40 GLN HA 1 41 GLY H 0.000 . 3.000 2.209 2.163 2.259 . 0 0 "[ . 1 . 2]" 1
664 1 40 GLN HB3 1 41 GLY H 0.000 . 6.000 3.968 3.626 4.402 . 0 0 "[ . 1 . 2]" 1
665 1 40 GLN HB2 1 41 GLY H 0.000 . 6.000 4.341 3.879 4.655 . 0 0 "[ . 1 . 2]" 1
666 1 40 GLN QB 1 41 GLY H 0.000 . 4.500 3.666 3.427 3.958 . 0 0 "[ . 1 . 2]" 1
667 1 40 GLN QG 1 41 GLY H 0.000 . 5.000 4.429 3.458 4.600 . 0 0 "[ . 1 . 2]" 1
668 1 41 GLY H 1 42 ALA HA 0.000 . 6.000 4.969 4.844 5.026 . 0 0 "[ . 1 . 2]" 1
669 1 41 GLY H 1 42 ALA H 0.000 . 5.000 4.457 4.412 4.482 . 0 0 "[ . 1 . 2]" 1
670 1 41 GLY HA3 1 42 ALA H 0.000 . 3.500 2.723 2.677 2.782 . 0 0 "[ . 1 . 2]" 1
671 1 41 GLY HA2 1 42 ALA H 0.000 . 3.500 2.369 2.321 2.404 . 0 0 "[ . 1 . 2]" 1
672 1 41 GLY HA3 1 43 GLU H 0.000 . 4.000 3.268 3.201 3.383 . 0 0 "[ . 1 . 2]" 1
673 1 41 GLY HA2 1 43 GLU H 0.000 . 4.000 4.042 4.008 4.061 0.061 5 0 "[ . 1 . 2]" 1
674 1 42 ALA H 1 43 GLU HA 0.000 . 6.000 4.967 4.891 5.052 . 0 0 "[ . 1 . 2]" 1
675 1 42 ALA H 1 43 GLU QB 0.000 . 5.000 4.345 3.978 4.677 . 0 0 "[ . 1 . 2]" 1
676 1 42 ALA H 1 43 GLU QG 0.000 . 5.000 4.103 3.509 4.935 . 0 0 "[ . 1 . 2]" 1
677 1 42 ALA H 1 43 GLU H 0.000 . 4.500 2.294 2.236 2.368 . 0 0 "[ . 1 . 2]" 1
678 1 42 ALA HA 1 43 GLU H 0.000 . 4.500 3.444 3.393 3.477 . 0 0 "[ . 1 . 2]" 1
679 1 42 ALA MB 1 43 GLU H 0.000 . 5.000 3.007 2.894 3.124 . 0 0 "[ . 1 . 2]" 1
680 1 42 ALA MB 1 43 GLU QG 0.000 . 6.000 3.729 2.857 4.773 . 0 0 "[ . 1 . 2]" 1
681 1 43 GLU H 1 43 GLU HB3 0.000 . 4.000 3.353 2.703 3.764 . 0 0 "[ . 1 . 2]" 1
682 1 43 GLU H 1 43 GLU HB2 0.000 . 4.000 2.766 2.144 3.679 . 0 0 "[ . 1 . 2]" 1
683 1 43 GLU H 1 43 GLU HG3 0.000 . 4.000 3.366 2.449 3.925 . 0 0 "[ . 1 . 2]" 1
684 1 43 GLU H 1 43 GLU HG2 0.000 . 4.000 3.010 2.071 3.892 . 0 0 "[ . 1 . 2]" 1
685 1 43 GLU H 1 44 TYR H 0.000 . 6.000 4.408 4.298 4.497 . 0 0 "[ . 1 . 2]" 1
686 1 43 GLU H 1 46 HIS QB 0.000 . 6.000 4.760 4.311 5.002 . 0 0 "[ . 1 . 2]" 1
687 1 43 GLU H 1 46 HIS HD2 0.000 . 6.000 5.852 5.491 6.031 0.031 1 0 "[ . 1 . 2]" 1
688 1 43 GLU H 1 46 HIS H 0.000 . 6.000 5.268 4.830 5.460 . 0 0 "[ . 1 . 2]" 1
689 1 43 GLU HA 1 44 TYR H 0.000 . 3.000 2.163 2.141 2.183 . 0 0 "[ . 1 . 2]" 1
690 1 43 GLU HA 1 45 GLN H 0.000 . 5.000 3.616 3.482 3.781 . 0 0 "[ . 1 . 2]" 1
691 1 43 GLU HB3 1 44 TYR H 0.000 . 5.000 3.762 3.173 4.437 . 0 0 "[ . 1 . 2]" 1
692 1 43 GLU HB2 1 44 TYR H 0.000 . 5.000 4.089 3.279 4.548 . 0 0 "[ . 1 . 2]" 1
693 1 43 GLU QG 1 44 TYR H 0.000 . 6.000 4.211 3.631 4.646 . 0 0 "[ . 1 . 2]" 1
694 1 44 TYR H 1 44 TYR HB3 0.000 . 3.500 2.728 2.511 2.805 . 0 0 "[ . 1 . 2]" 1
695 1 44 TYR H 1 44 TYR HB2 0.000 . 3.500 2.402 2.332 2.574 . 0 0 "[ . 1 . 2]" 1
696 1 44 TYR H 1 44 TYR HD1 0.000 . 5.000 4.439 4.308 4.743 . 0 0 "[ . 1 . 2]" 1
697 1 44 TYR H 1 44 TYR HD2 0.000 . 5.000 4.958 4.694 5.027 0.027 4 0 "[ . 1 . 2]" 1
698 1 44 TYR H 1 45 GLN H 0.000 . 4.000 2.595 2.489 2.668 . 0 0 "[ . 1 . 2]" 1
699 1 44 TYR H 1 46 HIS H 0.000 . 5.000 4.590 4.478 4.687 . 0 0 "[ . 1 . 2]" 1
700 1 44 TYR HA 1 45 GLN H 0.000 . 4.500 3.447 3.419 3.475 . 0 0 "[ . 1 . 2]" 1
701 1 44 TYR HA 1 47 PHE QB 0.000 . 4.500 2.933 2.466 3.202 . 0 0 "[ . 1 . 2]" 1
702 1 44 TYR HA 1 47 PHE H 0.000 . 4.000 3.078 2.935 3.168 . 0 0 "[ . 1 . 2]" 1
703 1 44 TYR HB3 1 45 GLN H 0.000 . 4.500 3.169 3.046 3.278 . 0 0 "[ . 1 . 2]" 1
704 1 44 TYR HB2 1 45 GLN H 0.000 . 4.500 4.055 3.980 4.147 . 0 0 "[ . 1 . 2]" 1
705 1 44 TYR QB 1 48 ILE MD 0.000 . 5.000 3.238 2.741 4.105 . 0 0 "[ . 1 . 2]" 1
706 1 44 TYR QB 1 61 VAL QG 0.000 . 6.000 4.293 3.945 4.754 . 0 0 "[ . 1 . 2]" 1
707 1 44 TYR QD 1 45 GLN H 0.000 . 4.500 4.429 3.936 4.527 0.027 2 0 "[ . 1 . 2]" 1
708 1 44 TYR HD1 1 47 PHE H 0.000 . 5.000 5.036 5.017 5.051 0.051 6 0 "[ . 1 . 2]" 1
709 1 44 TYR HD2 1 47 PHE H 0.000 . 5.000 5.037 4.980 5.064 0.064 9 0 "[ . 1 . 2]" 1
710 1 44 TYR QD 1 47 PHE HB3 0.000 . 5.000 3.384 3.145 3.531 . 0 0 "[ . 1 . 2]" 1
711 1 44 TYR QD 1 47 PHE HB2 0.000 . 5.000 3.712 3.294 3.982 . 0 0 "[ . 1 . 2]" 1
712 1 44 TYR QD 1 48 ILE H 0.000 . 5.000 3.800 3.520 4.131 . 0 0 "[ . 1 . 2]" 1
713 1 44 TYR QD 1 48 ILE MD 0.000 . 4.000 2.148 1.961 3.561 . 0 0 "[ . 1 . 2]" 1
714 1 44 TYR QD 1 48 ILE QG 0.000 . 4.000 2.306 2.040 3.309 . 0 0 "[ . 1 . 2]" 1
715 1 44 TYR QD 1 61 VAL MG1 0.000 . 5.000 3.757 2.948 5.004 0.004 14 0 "[ . 1 . 2]" 1
716 1 44 TYR QD 1 61 VAL MG2 0.000 . 5.000 3.253 2.806 3.760 . 0 0 "[ . 1 . 2]" 1
717 1 44 TYR QD 1 120 GLU HA 0.000 . 5.000 4.138 2.998 4.976 . 0 0 "[ . 1 . 2]" 1
718 1 44 TYR HD1 1 121 GLU HA 0.000 . 6.000 5.520 4.993 5.884 . 0 0 "[ . 1 . 2]" 1
719 1 44 TYR HD2 1 121 GLU HA 0.000 . 6.000 4.947 4.292 5.876 . 0 0 "[ . 1 . 2]" 1
720 1 44 TYR QD 1 121 GLU H 0.000 . 4.000 3.261 2.483 3.748 . 0 0 "[ . 1 . 2]" 1
721 1 44 TYR QD 1 122 ASN H 0.000 . 6.000 5.639 5.107 5.965 . 0 0 "[ . 1 . 2]" 1
722 1 44 TYR QE 1 61 VAL QG 0.000 . 5.000 2.554 1.880 3.660 . 0 0 "[ . 1 . 2]" 1
723 1 45 GLN H 1 45 GLN HB3 0.000 . 3.500 3.222 2.857 3.528 0.028 20 0 "[ . 1 . 2]" 1
724 1 45 GLN H 1 45 GLN HB2 0.000 . 3.500 2.159 2.078 2.255 . 0 0 "[ . 1 . 2]" 1
725 1 45 GLN H 1 45 GLN HG3 0.000 . 5.000 3.970 3.150 4.518 . 0 0 "[ . 1 . 2]" 1
726 1 45 GLN H 1 45 GLN HG2 0.000 . 5.000 4.111 3.007 4.672 . 0 0 "[ . 1 . 2]" 1
727 1 45 GLN H 1 46 HIS QB 0.000 . 6.000 4.595 4.541 4.663 . 0 0 "[ . 1 . 2]" 1
728 1 45 GLN H 1 46 HIS H 0.000 . 3.500 2.840 2.810 2.891 . 0 0 "[ . 1 . 2]" 1
729 1 45 GLN H 1 47 PHE H 0.000 . 5.000 4.275 4.086 4.433 . 0 0 "[ . 1 . 2]" 1
730 1 45 GLN H 1 48 ILE H 0.000 . 6.000 4.972 4.816 5.240 . 0 0 "[ . 1 . 2]" 1
731 1 45 GLN HA 1 45 GLN HE21 0.000 . 6.000 3.549 2.252 4.702 . 0 0 "[ . 1 . 2]" 1
732 1 45 GLN HA 1 45 GLN HE22 0.000 . 6.000 4.620 3.282 5.810 . 0 0 "[ . 1 . 2]" 1
733 1 45 GLN QE 1 48 ILE MD 0.000 . 6.000 3.740 2.163 5.527 . 0 0 "[ . 1 . 2]" 1
734 1 45 GLN QE 1 48 ILE MG 0.000 . 6.000 4.927 3.212 6.037 0.037 16 0 "[ . 1 . 2]" 1
735 1 45 GLN HA 1 46 HIS H 0.000 . 4.000 3.529 3.514 3.545 . 0 0 "[ . 1 . 2]" 1
736 1 45 GLN HA 1 48 ILE H 0.000 . 4.000 3.558 3.370 3.796 . 0 0 "[ . 1 . 2]" 1
737 1 45 GLN HA 1 48 ILE MD 0.000 . 4.000 2.381 1.890 3.792 . 0 0 "[ . 1 . 2]" 1
738 1 45 GLN HA 1 48 ILE QG 0.000 . 6.000 3.398 1.935 3.950 . 0 0 "[ . 1 . 2]" 1
739 1 45 GLN HA 1 48 ILE MG 0.000 . 6.000 4.385 3.640 4.917 . 0 0 "[ . 1 . 2]" 1
740 1 45 GLN HB3 1 46 HIS H 0.000 . 4.000 2.939 2.617 3.327 . 0 0 "[ . 1 . 2]" 1
741 1 45 GLN HB2 1 46 HIS H 0.000 . 4.000 3.301 2.807 3.751 . 0 0 "[ . 1 . 2]" 1
742 1 45 GLN QG 1 46 HIS H 0.000 . 5.000 4.361 4.059 4.550 . 0 0 "[ . 1 . 2]" 1
743 1 46 HIS H 1 46 HIS HB3 0.000 . 3.500 3.484 3.450 3.513 0.013 20 0 "[ . 1 . 2]" 1
744 1 46 HIS H 1 46 HIS HB2 0.000 . 3.500 2.174 2.132 2.215 . 0 0 "[ . 1 . 2]" 1
745 1 46 HIS H 1 46 HIS HD2 0.000 . 5.000 4.996 4.870 5.028 0.028 9 0 "[ . 1 . 2]" 1
746 1 46 HIS H 1 46 HIS HE1 0.000 . 6.000 5.371 5.229 5.504 . 0 0 "[ . 1 . 2]" 1
747 1 46 HIS H 1 47 PHE QB 0.000 . 6.000 4.450 4.276 4.567 . 0 0 "[ . 1 . 2]" 1
748 1 46 HIS H 1 47 PHE H 0.000 . 3.500 2.672 2.567 2.762 . 0 0 "[ . 1 . 2]" 1
749 1 46 HIS H 1 48 ILE H 0.000 . 5.000 4.308 4.123 4.726 . 0 0 "[ . 1 . 2]" 1
750 1 46 HIS H 1 49 GLN H 0.000 . 6.000 4.833 4.716 4.936 . 0 0 "[ . 1 . 2]" 1
751 1 46 HIS HA 1 47 PHE H 0.000 . 4.500 3.544 3.504 3.570 . 0 0 "[ . 1 . 2]" 1
752 1 46 HIS HA 1 49 GLN HB3 0.000 . 4.000 3.287 2.447 4.010 0.010 7 0 "[ . 1 . 2]" 1
753 1 46 HIS HA 1 49 GLN HB2 0.000 . 4.000 3.214 2.316 3.658 . 0 0 "[ . 1 . 2]" 1
754 1 46 HIS HA 1 49 GLN HG3 0.000 . 6.000 5.351 3.612 5.926 . 0 0 "[ . 1 . 2]" 1
755 1 46 HIS HA 1 49 GLN HG2 0.000 . 6.000 5.083 4.267 6.006 0.006 18 0 "[ . 1 . 2]" 1
756 1 46 HIS HA 1 49 GLN QE 0.000 . 6.000 4.245 3.070 5.730 . 0 0 "[ . 1 . 2]" 1
757 1 46 HIS HA 1 49 GLN H 0.000 . 4.000 3.587 3.397 3.697 . 0 0 "[ . 1 . 2]" 1
758 1 46 HIS HA 1 50 GLN QE 0.000 . 6.000 3.860 2.855 5.959 . 0 0 "[ . 1 . 2]" 1
759 1 46 HIS HB3 1 47 PHE H 0.000 . 5.000 3.366 3.224 3.600 . 0 0 "[ . 1 . 2]" 1
760 1 46 HIS HB2 1 47 PHE H 0.000 . 5.000 2.926 2.836 3.066 . 0 0 "[ . 1 . 2]" 1
761 1 46 HIS QB 1 47 PHE H 0.000 . 4.000 2.755 2.672 2.905 . 0 0 "[ . 1 . 2]" 1
762 1 47 PHE H 1 47 PHE HB3 0.000 . 3.500 2.675 2.510 2.850 . 0 0 "[ . 1 . 2]" 1
763 1 47 PHE H 1 47 PHE HB2 0.000 . 3.500 2.425 2.233 2.581 . 0 0 "[ . 1 . 2]" 1
764 1 47 PHE H 1 47 PHE HD1 0.000 . 5.000 4.675 4.210 4.930 . 0 0 "[ . 1 . 2]" 1
765 1 47 PHE H 1 47 PHE HD2 0.000 . 5.000 4.692 4.296 5.011 0.011 11 0 "[ . 1 . 2]" 1
766 1 47 PHE H 1 48 ILE HG13 0.000 . 6.000 4.187 3.985 4.710 . 0 0 "[ . 1 . 2]" 1
767 1 47 PHE H 1 48 ILE HG12 0.000 . 6.000 5.717 3.867 6.009 0.009 10 0 "[ . 1 . 2]" 1
768 1 47 PHE H 1 48 ILE QG 0.000 . 5.000 4.054 3.698 4.347 . 0 0 "[ . 1 . 2]" 1
769 1 47 PHE H 1 48 ILE H 0.000 . 3.500 2.663 2.552 2.866 . 0 0 "[ . 1 . 2]" 1
770 1 47 PHE H 1 49 GLN H 0.000 . 5.000 4.079 3.812 4.248 . 0 0 "[ . 1 . 2]" 1
771 1 47 PHE HA 1 48 ILE H 0.000 . 4.500 3.550 3.526 3.581 . 0 0 "[ . 1 . 2]" 1
772 1 47 PHE HA 1 50 GLN H 0.000 . 4.000 3.545 3.194 3.975 . 0 0 "[ . 1 . 2]" 1
773 1 47 PHE HA 1 51 CYS H 0.000 . 4.500 4.003 3.437 4.544 0.044 9 0 "[ . 1 . 2]" 1
774 1 47 PHE HB3 1 48 ILE H 0.000 . 5.000 2.528 2.164 2.701 . 0 0 "[ . 1 . 2]" 1
775 1 47 PHE HB2 1 48 ILE H 0.000 . 5.000 3.738 3.571 3.924 . 0 0 "[ . 1 . 2]" 1
776 1 47 PHE QB 1 48 ILE H 0.000 . 4.000 2.488 2.146 2.639 . 0 0 "[ . 1 . 2]" 1
777 1 47 PHE QD 1 48 ILE H 0.000 . 4.500 3.650 3.233 4.119 . 0 0 "[ . 1 . 2]" 1
778 1 47 PHE QD 1 48 ILE HA 0.000 . 4.500 3.383 2.963 3.841 . 0 0 "[ . 1 . 2]" 1
779 1 47 PHE QD 1 59 ALA MB 0.000 . 5.000 3.676 3.452 4.100 . 0 0 "[ . 1 . 2]" 1
780 1 47 PHE QD 1 119 LEU QD 0.000 . 5.000 2.735 1.966 3.220 . 0 0 "[ . 1 . 2]" 1
781 1 47 PHE QE 1 48 ILE HA 0.000 . 6.000 5.023 4.514 5.735 . 0 0 "[ . 1 . 2]" 1
782 1 47 PHE QE 1 51 CYS QB 0.000 . 5.000 3.558 2.543 4.326 . 0 0 "[ . 1 . 2]" 1
783 1 47 PHE QE 1 51 CYS H 0.000 . 6.000 5.446 4.741 5.993 . 0 0 "[ . 1 . 2]" 1
784 1 47 PHE HZ 1 59 ALA H 0.000 . 6.000 4.803 4.038 5.097 . 0 0 "[ . 1 . 2]" 1
785 1 47 PHE HZ 1 59 ALA MB 0.000 . 4.500 1.946 1.758 2.204 . 0 0 "[ . 1 . 2]" 1
786 1 48 ILE H 1 48 ILE HB 0.000 . 4.000 2.677 2.591 3.628 . 0 0 "[ . 1 . 2]" 1
787 1 48 ILE H 1 48 ILE MD 0.000 . 5.000 3.288 2.771 3.689 . 0 0 "[ . 1 . 2]" 1
788 1 48 ILE H 1 48 ILE HG13 0.000 . 4.000 2.022 1.917 2.869 . 0 0 "[ . 1 . 2]" 1
789 1 48 ILE H 1 48 ILE HG12 0.000 . 4.000 3.333 2.033 3.592 . 0 0 "[ . 1 . 2]" 1
790 1 48 ILE H 1 49 GLN H 0.000 . 3.500 2.679 2.582 2.759 . 0 0 "[ . 1 . 2]" 1
791 1 48 ILE H 1 50 GLN H 0.000 . 5.000 4.214 3.918 4.616 . 0 0 "[ . 1 . 2]" 1
792 1 48 ILE HA 1 49 GLN H 0.000 . 5.000 3.532 3.466 3.555 . 0 0 "[ . 1 . 2]" 1
793 1 48 ILE HA 1 51 CYS QB 0.000 . 4.000 2.813 2.046 3.840 . 0 0 "[ . 1 . 2]" 1
794 1 48 ILE HA 1 51 CYS H 0.000 . 4.000 3.577 3.220 3.992 . 0 0 "[ . 1 . 2]" 1
795 1 48 ILE HA 1 119 LEU MD1 0.000 . 6.000 3.682 2.418 5.436 . 0 0 "[ . 1 . 2]" 1
796 1 48 ILE HA 1 119 LEU MD2 0.000 . 6.000 3.989 2.138 5.338 . 0 0 "[ . 1 . 2]" 1
797 1 48 ILE HB 1 49 GLN H 0.000 . 4.000 2.694 2.420 3.917 . 0 0 "[ . 1 . 2]" 1
798 1 48 ILE MD 1 49 GLN H 0.000 . 6.000 4.353 3.936 4.817 . 0 0 "[ . 1 . 2]" 1
799 1 48 ILE MD 1 120 GLU HA 0.000 . 4.500 3.433 2.346 4.324 . 0 0 "[ . 1 . 2]" 1
800 1 48 ILE MD 1 121 GLU H 0.000 . 5.000 3.477 2.613 4.987 . 0 0 "[ . 1 . 2]" 1
801 1 48 ILE HG13 1 49 GLN H 0.000 . 6.000 4.059 2.455 4.234 . 0 0 "[ . 1 . 2]" 1
802 1 48 ILE HG12 1 49 GLN H 0.000 . 6.000 4.940 3.320 5.132 . 0 0 "[ . 1 . 2]" 1
803 1 48 ILE QG 1 49 GLN H 0.000 . 5.000 3.880 2.394 4.042 . 0 0 "[ . 1 . 2]" 1
804 1 48 ILE MG 1 49 GLN H 0.000 . 5.000 3.623 3.442 4.183 . 0 0 "[ . 1 . 2]" 1
805 1 48 ILE MG 1 49 GLN HA 0.000 . 6.000 3.746 3.557 5.472 . 0 0 "[ . 1 . 2]" 1
806 1 48 ILE MG 1 116 ARG HD3 0.000 . 6.000 4.116 1.959 5.829 . 0 0 "[ . 1 . 2]" 1
807 1 48 ILE MG 1 116 ARG HD2 0.000 . 6.000 3.859 2.069 5.888 . 0 0 "[ . 1 . 2]" 1
808 1 49 GLN H 1 49 GLN HB3 0.000 . 3.500 2.918 2.598 3.478 . 0 0 "[ . 1 . 2]" 1
809 1 49 GLN H 1 49 GLN HB2 0.000 . 3.500 2.252 2.089 2.443 . 0 0 "[ . 1 . 2]" 1
810 1 49 GLN H 1 49 GLN HG3 0.000 . 5.000 4.148 3.053 4.583 . 0 0 "[ . 1 . 2]" 1
811 1 49 GLN H 1 49 GLN HG2 0.000 . 5.000 4.478 3.650 4.672 . 0 0 "[ . 1 . 2]" 1
812 1 49 GLN H 1 49 GLN QE 0.000 . 5.000 4.483 3.094 5.004 0.004 18 0 "[ . 1 . 2]" 1
813 1 49 GLN H 1 50 GLN QB 0.000 . 6.000 4.475 3.955 5.310 . 0 0 "[ . 1 . 2]" 1
814 1 49 GLN H 1 50 GLN H 0.000 . 3.500 2.642 2.261 2.851 . 0 0 "[ . 1 . 2]" 1
815 1 49 GLN H 1 51 CYS H 0.000 . 5.000 4.008 3.804 4.178 . 0 0 "[ . 1 . 2]" 1
816 1 49 GLN HA 1 50 GLN H 0.000 . 4.500 3.542 3.472 3.581 . 0 0 "[ . 1 . 2]" 1
817 1 49 GLN HA 1 51 CYS H 0.000 . 6.000 4.418 3.920 4.776 . 0 0 "[ . 1 . 2]" 1
818 1 49 GLN HB3 1 50 GLN H 0.000 . 5.000 2.782 2.466 3.341 . 0 0 "[ . 1 . 2]" 1
819 1 49 GLN HB2 1 50 GLN H 0.000 . 5.000 3.555 2.786 3.833 . 0 0 "[ . 1 . 2]" 1
820 1 49 GLN QB 1 50 GLN H 0.000 . 4.000 2.646 2.435 3.005 . 0 0 "[ . 1 . 2]" 1
821 1 49 GLN QG 1 50 GLN H 0.000 . 5.000 4.141 3.652 4.583 . 0 0 "[ . 1 . 2]" 1
822 1 50 GLN H 1 50 GLN HB3 0.000 . 4.000 3.340 2.225 3.651 . 0 0 "[ . 1 . 2]" 1
823 1 50 GLN H 1 50 GLN HB2 0.000 . 4.000 2.295 2.096 3.701 . 0 0 "[ . 1 . 2]" 1
824 1 50 GLN H 1 50 GLN HG3 0.000 . 5.000 4.005 1.957 4.622 . 0 0 "[ . 1 . 2]" 1
825 1 50 GLN H 1 50 GLN HG2 0.000 . 5.000 4.105 2.443 4.516 . 0 0 "[ . 1 . 2]" 1
826 1 50 GLN H 1 51 CYS HB3 0.000 . 6.000 5.686 4.676 6.036 0.036 1 0 "[ . 1 . 2]" 1
827 1 50 GLN H 1 51 CYS HB2 0.000 . 6.000 4.551 4.042 5.973 . 0 0 "[ . 1 . 2]" 1
828 1 50 GLN H 1 51 CYS H 0.000 . 3.000 2.496 2.335 2.615 . 0 0 "[ . 1 . 2]" 1
829 1 50 GLN H 1 52 THR H 0.000 . 6.000 5.808 5.408 6.018 0.018 14 0 "[ . 1 . 2]" 1
830 1 50 GLN HA 1 50 GLN HE21 0.000 . 5.000 3.163 2.120 4.690 . 0 0 "[ . 1 . 2]" 1
831 1 50 GLN HA 1 50 GLN HE22 0.000 . 5.000 4.161 3.186 5.138 0.138 9 0 "[ . 1 . 2]" 1
832 1 50 GLN H 1 50 GLN HE21 0.000 . 4.500 3.361 2.697 4.169 . 0 0 "[ . 1 . 2]" 1
833 1 50 GLN H 1 50 GLN HE22 0.000 . 4.500 4.027 3.490 4.513 0.013 18 0 "[ . 1 . 2]" 1
834 1 50 GLN HA 1 51 CYS H 0.000 . 4.000 3.490 3.278 3.560 . 0 0 "[ . 1 . 2]" 1
835 1 50 GLN HA 1 52 THR H 0.000 . 5.000 4.488 4.003 4.707 . 0 0 "[ . 1 . 2]" 1
836 1 50 GLN HB3 1 51 CYS H 0.000 . 5.000 3.456 2.883 4.489 . 0 0 "[ . 1 . 2]" 1
837 1 50 GLN HB2 1 51 CYS H 0.000 . 5.000 3.264 2.905 4.330 . 0 0 "[ . 1 . 2]" 1
838 1 50 GLN QB 1 51 CYS H 0.000 . 4.500 2.951 2.677 3.924 . 0 0 "[ . 1 . 2]" 1
839 1 51 CYS H 1 51 CYS HB3 0.000 . 3.500 3.298 2.583 3.511 0.011 1 0 "[ . 1 . 2]" 1
840 1 51 CYS H 1 51 CYS HB2 0.000 . 3.500 2.343 2.090 3.582 0.082 18 0 "[ . 1 . 2]" 1
841 1 51 CYS H 1 52 THR H 0.000 . 4.000 3.993 3.763 4.052 0.052 3 0 "[ . 1 . 2]" 1
842 1 51 CYS H 1 57 LEU QD 0.000 . 6.000 4.823 4.320 5.660 . 0 0 "[ . 1 . 2]" 1
843 1 51 CYS H 1 119 LEU QD 0.000 . 6.000 4.466 4.113 4.982 . 0 0 "[ . 1 . 2]" 1
844 1 51 CYS HA 1 52 THR H 0.000 . 3.000 2.312 2.245 2.488 . 0 0 "[ . 1 . 2]" 1
845 1 51 CYS HA 1 55 VAL QG 0.000 . 5.000 3.944 2.846 5.011 0.011 10 0 "[ . 1 . 2]" 1
846 1 51 CYS HA 1 57 LEU MD1 0.000 . 6.000 3.801 2.648 4.827 . 0 0 "[ . 1 . 2]" 1
847 1 51 CYS HA 1 57 LEU MD2 0.000 . 6.000 3.963 2.535 6.013 0.013 9 0 "[ . 1 . 2]" 1
848 1 51 CYS HA 1 57 LEU QD 0.000 . 5.000 3.210 2.491 4.242 . 0 0 "[ . 1 . 2]" 1
849 1 51 CYS HA 1 57 LEU HG 0.000 . 6.000 5.015 4.460 5.905 . 0 0 "[ . 1 . 2]" 1
850 1 51 CYS HA 1 80 TRP HE1 0.000 . 5.000 3.413 2.994 4.442 . 0 0 "[ . 1 . 2]" 1
851 1 51 CYS HB3 1 52 THR H 0.000 . 5.000 4.216 4.098 4.657 . 0 0 "[ . 1 . 2]" 1
852 1 51 CYS HB2 1 52 THR H 0.000 . 5.000 4.584 4.136 4.679 . 0 0 "[ . 1 . 2]" 1
853 1 51 CYS QB 1 80 TRP HE1 0.000 . 5.000 3.825 3.090 4.844 . 0 0 "[ . 1 . 2]" 1
854 1 51 CYS HB3 1 119 LEU QD 0.000 . 4.000 2.435 1.849 2.895 . 0 0 "[ . 1 . 2]" 1
855 1 51 CYS HB2 1 119 LEU QD 0.000 . 4.000 2.871 2.342 3.669 . 0 0 "[ . 1 . 2]" 1
856 1 52 THR H 1 52 THR MG 0.000 . 4.000 3.035 2.522 3.744 . 0 0 "[ . 1 . 2]" 1
857 1 52 THR H 1 53 ASP H 0.000 . 6.000 4.556 4.461 4.633 . 0 0 "[ . 1 . 2]" 1
858 1 52 THR H 1 54 ASP H 0.000 . 6.000 4.404 3.946 4.742 . 0 0 "[ . 1 . 2]" 1
859 1 52 THR H 1 55 VAL QG 0.000 . 4.000 3.132 2.288 3.973 . 0 0 "[ . 1 . 2]" 1
860 1 52 THR H 1 57 LEU QD 0.000 . 5.000 4.107 3.264 4.863 . 0 0 "[ . 1 . 2]" 1
861 1 52 THR H 1 80 TRP HE1 0.000 . 4.000 3.250 2.460 4.013 0.013 4 0 "[ . 1 . 2]" 1
862 1 52 THR HA 1 53 ASP H 0.000 . 3.000 2.405 2.245 2.629 . 0 0 "[ . 1 . 2]" 1
863 1 52 THR HA 1 54 ASP H 0.000 . 5.000 4.407 3.962 4.760 . 0 0 "[ . 1 . 2]" 1
864 1 52 THR HB 1 53 ASP H 0.000 . 3.000 2.588 2.024 3.021 0.021 1 0 "[ . 1 . 2]" 1
865 1 52 THR MG 1 53 ASP H 0.000 . 5.000 3.342 2.482 3.726 . 0 0 "[ . 1 . 2]" 1
866 1 52 THR MG 1 54 ASP H 0.000 . 6.000 4.626 3.774 5.359 . 0 0 "[ . 1 . 2]" 1
867 1 53 ASP H 1 53 ASP HB3 0.000 . 3.500 3.147 2.681 3.589 0.089 13 0 "[ . 1 . 2]" 1
868 1 53 ASP H 1 53 ASP HB2 0.000 . 3.500 2.745 2.167 3.577 0.077 5 0 "[ . 1 . 2]" 1
869 1 53 ASP H 1 54 ASP H 0.000 . 4.000 3.307 2.683 3.817 . 0 0 "[ . 1 . 2]" 1
870 1 53 ASP H 1 55 VAL H 0.000 . 6.000 5.768 5.301 5.997 . 0 0 "[ . 1 . 2]" 1
871 1 53 ASP H 1 80 TRP HZ2 0.000 . 5.000 3.654 2.801 4.353 . 0 0 "[ . 1 . 2]" 1
872 1 53 ASP H 1 82 GLY QA 0.000 . 6.000 4.379 4.195 4.732 . 0 0 "[ . 1 . 2]" 1
873 1 53 ASP H 1 84 ASN QD 0.000 . 6.000 5.503 4.926 6.010 0.010 15 0 "[ . 1 . 2]" 1
874 1 53 ASP HA 1 54 ASP H 0.000 . 4.500 2.769 2.413 3.270 . 0 0 "[ . 1 . 2]" 1
875 1 53 ASP HA 1 55 VAL H 0.000 . 5.000 4.012 3.620 4.691 . 0 0 "[ . 1 . 2]" 1
876 1 53 ASP HA 1 80 TRP HE1 0.000 . 6.000 3.412 2.067 4.052 . 0 0 "[ . 1 . 2]" 1
877 1 53 ASP HA 1 82 GLY H 0.000 . 6.000 4.441 3.936 5.237 . 0 0 "[ . 1 . 2]" 1
878 1 53 ASP HA 1 82 GLY QA 0.000 . 4.000 2.023 1.748 2.593 . 0 0 "[ . 1 . 2]" 1
879 1 53 ASP HA 1 83 GLU H 0.000 . 4.000 3.256 2.409 3.802 . 0 0 "[ . 1 . 2]" 1
880 1 53 ASP QB 1 54 ASP H 0.000 . 6.000 3.859 3.633 4.015 . 0 0 "[ . 1 . 2]" 1
881 1 53 ASP HB3 1 83 GLU H 0.000 . 5.000 3.789 2.605 4.958 . 0 0 "[ . 1 . 2]" 1
882 1 53 ASP HB2 1 83 GLU H 0.000 . 5.000 4.255 2.690 5.043 0.043 17 0 "[ . 1 . 2]" 1
883 1 53 ASP QB 1 84 ASN H 0.000 . 4.500 3.759 3.174 4.282 . 0 0 "[ . 1 . 2]" 1
884 1 54 ASP H 1 54 ASP HB3 0.000 . 3.500 3.392 2.793 3.552 0.052 4 0 "[ . 1 . 2]" 1
885 1 54 ASP H 1 54 ASP HB2 0.000 . 3.500 3.325 3.039 3.629 0.129 4 0 "[ . 1 . 2]" 1
886 1 54 ASP H 1 55 VAL QG 0.000 . 4.000 2.576 2.351 3.306 . 0 0 "[ . 1 . 2]" 1
887 1 54 ASP H 1 55 VAL H 0.000 . 3.500 2.659 2.051 3.533 0.033 5 0 "[ . 1 . 2]" 1
888 1 54 ASP H 1 80 TRP HE1 0.000 . 6.000 3.765 3.041 4.298 . 0 0 "[ . 1 . 2]" 1
889 1 54 ASP H 1 82 GLY QA 0.000 . 5.000 2.622 2.017 3.497 . 0 0 "[ . 1 . 2]" 1
890 1 54 ASP H 1 84 ASN QD 0.000 . 6.000 4.708 4.078 5.232 . 0 0 "[ . 1 . 2]" 1
891 1 54 ASP HA 1 55 VAL H 0.000 . 4.000 2.653 2.335 2.940 . 0 0 "[ . 1 . 2]" 1
892 1 54 ASP HA 1 84 ASN H 0.000 . 4.000 2.698 2.118 3.615 . 0 0 "[ . 1 . 2]" 1
893 1 54 ASP HA 1 84 ASN HD21 0.000 . 5.000 3.117 2.135 3.726 . 0 0 "[ . 1 . 2]" 1
894 1 54 ASP HA 1 84 ASN HD22 0.000 . 5.000 4.347 2.185 5.030 0.030 6 0 "[ . 1 . 2]" 1
895 1 54 ASP HA 1 84 ASN QD 0.000 . 4.500 2.989 2.115 3.630 . 0 0 "[ . 1 . 2]" 1
896 1 54 ASP HA 1 85 VAL QG 0.000 . 5.000 4.375 3.338 5.024 0.024 15 0 "[ . 1 . 2]" 1
897 1 54 ASP HA 1 85 VAL H 0.000 . 6.000 4.485 3.538 5.283 . 0 0 "[ . 1 . 2]" 1
898 1 54 ASP HB3 1 55 VAL H 0.000 . 4.500 4.374 4.123 4.613 0.113 4 0 "[ . 1 . 2]" 1
899 1 54 ASP HB2 1 55 VAL H 0.000 . 4.500 4.426 4.195 4.582 0.082 17 0 "[ . 1 . 2]" 1
900 1 54 ASP QB 1 84 ASN H 0.000 . 5.000 4.218 3.479 5.033 0.033 19 0 "[ . 1 . 2]" 1
901 1 54 ASP QB 1 84 ASN QD 0.000 . 4.000 3.382 2.184 4.006 0.006 12 0 "[ . 1 . 2]" 1
902 1 55 VAL H 1 55 VAL QG 0.000 . 4.000 2.558 2.454 2.901 . 0 0 "[ . 1 . 2]" 1
903 1 55 VAL H 1 56 ARG H 0.000 . 6.000 4.307 4.151 4.395 . 0 0 "[ . 1 . 2]" 1
904 1 55 VAL H 1 80 TRP HD1 0.000 . 6.000 5.342 4.762 5.634 . 0 0 "[ . 1 . 2]" 1
905 1 55 VAL H 1 80 TRP HE1 0.000 . 4.500 4.382 4.146 4.534 0.034 11 0 "[ . 1 . 2]" 1
906 1 55 VAL H 1 82 GLY QA 0.000 . 4.500 1.853 1.710 2.042 . 0 0 "[ . 1 . 2]" 1
907 1 55 VAL H 1 82 GLY H 0.000 . 4.500 3.023 2.672 3.488 . 0 0 "[ . 1 . 2]" 1
908 1 55 VAL H 1 83 GLU H 0.000 . 6.000 4.735 4.254 5.045 . 0 0 "[ . 1 . 2]" 1
909 1 55 VAL H 1 84 ASN QD 0.000 . 6.000 5.078 4.444 5.659 . 0 0 "[ . 1 . 2]" 1
910 1 55 VAL H 1 85 VAL QG 0.000 . 6.000 3.354 2.439 4.267 . 0 0 "[ . 1 . 2]" 1
911 1 55 VAL HA 1 85 VAL QG 0.000 . 5.000 3.369 2.111 4.595 . 0 0 "[ . 1 . 2]" 1
912 1 55 VAL HA 1 56 ARG H 0.000 . 3.000 2.520 2.227 2.984 . 0 0 "[ . 1 . 2]" 1
913 1 55 VAL HB 1 56 ARG H 0.000 . 3.000 2.355 1.859 3.326 0.326 7 0 "[ . 1 . 2]" 1
914 1 55 VAL QG 1 56 ARG HA 0.000 . 6.000 4.173 3.071 4.372 . 0 0 "[ . 1 . 2]" 1
915 1 55 VAL MG1 1 56 ARG H 0.000 . 5.000 3.016 1.861 3.311 . 0 0 "[ . 1 . 2]" 1
916 1 55 VAL MG2 1 56 ARG H 0.000 . 5.000 3.687 1.856 4.165 . 0 0 "[ . 1 . 2]" 1
917 1 55 VAL QG 1 57 LEU QD 0.000 . 4.500 2.602 2.017 3.191 . 0 0 "[ . 1 . 2]" 1
918 1 55 VAL QG 1 57 LEU HG 0.000 . 5.000 3.925 3.294 4.839 . 0 0 "[ . 1 . 2]" 1
919 1 55 VAL QG 1 57 LEU H 0.000 . 6.000 4.724 3.692 5.339 . 0 0 "[ . 1 . 2]" 1
920 1 55 VAL QG 1 80 TRP HD1 0.000 . 5.000 3.426 2.353 4.202 . 0 0 "[ . 1 . 2]" 1
921 1 55 VAL QG 1 80 TRP HE1 0.000 . 4.500 3.007 1.947 4.166 . 0 0 "[ . 1 . 2]" 1
922 1 55 VAL QG 1 82 GLY QA 0.000 . 5.000 3.051 2.299 3.559 . 0 0 "[ . 1 . 2]" 1
923 1 55 VAL QG 1 82 GLY H 0.000 . 6.000 3.613 2.693 4.318 . 0 0 "[ . 1 . 2]" 1
924 1 56 ARG H 1 56 ARG HD3 0.000 . 5.000 3.882 1.963 5.015 0.015 11 0 "[ . 1 . 2]" 1
925 1 56 ARG H 1 56 ARG HD2 0.000 . 5.000 4.193 3.240 5.058 0.058 1 0 "[ . 1 . 2]" 1
926 1 56 ARG H 1 56 ARG HG3 0.000 . 5.000 2.939 1.842 4.367 . 0 0 "[ . 1 . 2]" 1
927 1 56 ARG H 1 56 ARG HG2 0.000 . 5.000 3.138 2.460 4.209 . 0 0 "[ . 1 . 2]" 1
928 1 56 ARG H 1 57 LEU H 0.000 . 6.000 4.049 2.992 4.522 . 0 0 "[ . 1 . 2]" 1
929 1 56 ARG H 1 80 TRP HD1 0.000 . 6.000 5.278 4.265 5.995 . 0 0 "[ . 1 . 2]" 1
930 1 56 ARG H 1 85 VAL QG 0.000 . 6.000 3.622 2.404 4.800 . 0 0 "[ . 1 . 2]" 1
931 1 56 ARG HA 1 57 LEU H 0.000 . 3.000 2.199 2.145 2.391 . 0 0 "[ . 1 . 2]" 1
932 1 56 ARG HA 1 57 LEU HG 0.000 . 6.000 3.838 3.322 4.406 . 0 0 "[ . 1 . 2]" 1
933 1 56 ARG HA 1 80 TRP HD1 0.000 . 5.000 4.052 3.587 4.627 . 0 0 "[ . 1 . 2]" 1
934 1 56 ARG HA 1 81 ILE HA 0.000 . 4.000 2.329 1.963 3.183 . 0 0 "[ . 1 . 2]" 1
935 1 56 ARG HA 1 81 ILE QG 0.000 . 5.000 3.833 3.093 5.024 0.024 1 0 "[ . 1 . 2]" 1
936 1 56 ARG HA 1 82 GLY H 0.000 . 4.000 2.778 2.443 3.068 . 0 0 "[ . 1 . 2]" 1
937 1 56 ARG HA 1 93 THR MG 0.000 . 6.000 4.551 3.226 5.695 . 0 0 "[ . 1 . 2]" 1
938 1 56 ARG HB3 1 57 LEU H 0.000 . 6.000 4.251 3.838 4.593 . 0 0 "[ . 1 . 2]" 1
939 1 56 ARG HB2 1 57 LEU H 0.000 . 6.000 3.496 2.935 4.218 . 0 0 "[ . 1 . 2]" 1
940 1 56 ARG QB 1 57 LEU H 0.000 . 4.000 3.334 2.871 3.883 . 0 0 "[ . 1 . 2]" 1
941 1 56 ARG HB3 1 82 GLY H 0.000 . 5.000 3.911 3.583 4.222 . 0 0 "[ . 1 . 2]" 1
942 1 56 ARG HB2 1 82 GLY H 0.000 . 5.000 4.872 4.443 5.040 0.040 14 0 "[ . 1 . 2]" 1
943 1 56 ARG HD3 1 85 VAL QG 0.000 . 6.000 3.325 1.829 4.422 . 0 0 "[ . 1 . 2]" 1
944 1 56 ARG HD2 1 85 VAL QG 0.000 . 6.000 3.446 1.871 4.703 . 0 0 "[ . 1 . 2]" 1
945 1 57 LEU H 1 57 LEU HG 0.000 . 3.500 2.470 1.995 3.252 . 0 0 "[ . 1 . 2]" 1
946 1 57 LEU H 1 57 LEU MD1 0.000 . 5.000 3.616 2.925 4.180 . 0 0 "[ . 1 . 2]" 1
947 1 57 LEU H 1 57 LEU MD2 0.000 . 5.000 3.724 2.921 4.103 . 0 0 "[ . 1 . 2]" 1
948 1 57 LEU H 1 58 PHE HA 0.000 . 6.000 4.737 4.646 4.933 . 0 0 "[ . 1 . 2]" 1
949 1 57 LEU H 1 58 PHE QD 0.000 . 6.000 5.137 4.378 5.769 . 0 0 "[ . 1 . 2]" 1
950 1 57 LEU H 1 58 PHE H 0.000 . 6.000 4.392 4.305 4.463 . 0 0 "[ . 1 . 2]" 1
951 1 57 LEU H 1 79 THR HA 0.000 . 6.000 5.454 5.097 5.945 . 0 0 "[ . 1 . 2]" 1
952 1 57 LEU H 1 80 TRP QB 0.000 . 5.000 3.158 2.757 3.467 . 0 0 "[ . 1 . 2]" 1
953 1 57 LEU H 1 80 TRP HD1 0.000 . 4.000 3.498 3.231 3.808 . 0 0 "[ . 1 . 2]" 1
954 1 57 LEU H 1 80 TRP HE1 0.000 . 6.000 5.706 5.515 6.008 0.008 10 0 "[ . 1 . 2]" 1
955 1 57 LEU H 1 80 TRP H 0.000 . 4.000 3.748 3.317 4.008 0.008 5 0 "[ . 1 . 2]" 1
956 1 57 LEU H 1 81 ILE HA 0.000 . 4.000 3.569 3.276 3.981 . 0 0 "[ . 1 . 2]" 1
957 1 57 LEU H 1 81 ILE HB 0.000 . 6.000 5.806 5.291 6.050 0.050 18 0 "[ . 1 . 2]" 1
958 1 57 LEU H 1 82 GLY H 0.000 . 6.000 4.289 4.025 4.567 . 0 0 "[ . 1 . 2]" 1
959 1 57 LEU H 1 93 THR MG 0.000 . 6.000 4.705 3.571 5.749 . 0 0 "[ . 1 . 2]" 1
960 1 57 LEU HA 1 58 PHE H 0.000 . 3.500 2.431 2.179 2.563 . 0 0 "[ . 1 . 2]" 1
961 1 57 LEU HB3 1 58 PHE H 0.000 . 4.500 3.399 2.239 3.977 . 0 0 "[ . 1 . 2]" 1
962 1 57 LEU HB2 1 58 PHE H 0.000 . 4.500 2.551 2.080 3.624 . 0 0 "[ . 1 . 2]" 1
963 1 57 LEU QB 1 58 PHE H 0.000 . 4.000 2.338 2.062 2.907 . 0 0 "[ . 1 . 2]" 1
964 1 57 LEU HG 1 58 PHE H 0.000 . 6.000 4.509 3.973 4.888 . 0 0 "[ . 1 . 2]" 1
965 1 57 LEU HG 1 80 TRP HD1 0.000 . 4.500 2.715 1.908 3.694 . 0 0 "[ . 1 . 2]" 1
966 1 57 LEU HG 1 80 TRP HE1 0.000 . 6.000 5.065 4.348 5.683 . 0 0 "[ . 1 . 2]" 1
967 1 57 LEU HG 1 80 TRP H 0.000 . 6.000 4.719 3.872 6.008 0.008 4 0 "[ . 1 . 2]" 1
968 1 57 LEU QD 1 58 PHE H 0.000 . 5.000 3.215 2.849 3.987 . 0 0 "[ . 1 . 2]" 1
969 1 57 LEU QD 1 58 PHE HA 0.000 . 6.000 3.981 3.283 5.309 . 0 0 "[ . 1 . 2]" 1
970 1 57 LEU QD 1 59 ALA MB 0.000 . 5.000 3.481 2.043 5.010 0.010 12 0 "[ . 1 . 2]" 1
971 1 57 LEU QD 1 80 TRP QB 0.000 . 4.500 2.675 1.895 3.767 . 0 0 "[ . 1 . 2]" 1
972 1 57 LEU MD1 1 80 TRP HD1 0.000 . 6.000 3.128 2.398 3.950 . 0 0 "[ . 1 . 2]" 1
973 1 57 LEU MD2 1 80 TRP HD1 0.000 . 6.000 3.313 2.195 5.012 . 0 0 "[ . 1 . 2]" 1
974 1 57 LEU QD 1 80 TRP HD1 0.000 . 4.500 2.660 2.156 3.307 . 0 0 "[ . 1 . 2]" 1
975 1 57 LEU QD 1 80 TRP H 0.000 . 6.000 3.891 2.914 5.247 . 0 0 "[ . 1 . 2]" 1
976 1 58 PHE H 1 58 PHE QD 0.000 . 4.000 2.733 2.027 3.412 . 0 0 "[ . 1 . 2]" 1
977 1 58 PHE H 1 58 PHE QE 0.000 . 6.000 4.754 4.174 5.274 . 0 0 "[ . 1 . 2]" 1
978 1 58 PHE H 1 59 ALA HA 0.000 . 6.000 5.111 4.917 5.418 . 0 0 "[ . 1 . 2]" 1
979 1 58 PHE H 1 59 ALA H 0.000 . 6.000 4.499 4.089 4.582 . 0 0 "[ . 1 . 2]" 1
980 1 58 PHE HA 1 59 ALA MB 0.000 . 6.000 3.784 3.698 4.128 . 0 0 "[ . 1 . 2]" 1
981 1 58 PHE HA 1 59 ALA H 0.000 . 3.000 2.444 2.197 2.604 . 0 0 "[ . 1 . 2]" 1
982 1 58 PHE HA 1 79 THR HA 0.000 . 4.000 2.364 2.120 2.755 . 0 0 "[ . 1 . 2]" 1
983 1 58 PHE HA 1 79 THR MG 0.000 . 6.000 3.161 2.552 4.688 . 0 0 "[ . 1 . 2]" 1
984 1 58 PHE HA 1 80 TRP H 0.000 . 4.000 2.810 2.457 3.074 . 0 0 "[ . 1 . 2]" 1
985 1 58 PHE QB 1 59 ALA H 0.000 . 4.000 2.416 2.068 3.631 . 0 0 "[ . 1 . 2]" 1
986 1 58 PHE QB 1 80 TRP H 0.000 . 6.000 4.841 4.502 5.183 . 0 0 "[ . 1 . 2]" 1
987 1 58 PHE QB 1 100 VAL MG1 0.000 . 5.000 3.842 3.212 4.445 . 0 0 "[ . 1 . 2]" 1
988 1 58 PHE QB 1 100 VAL MG2 0.000 . 5.000 3.609 2.934 4.015 . 0 0 "[ . 1 . 2]" 1
989 1 58 PHE QD 1 59 ALA H 0.000 . 5.000 3.702 3.110 4.565 . 0 0 "[ . 1 . 2]" 1
990 1 58 PHE QD 1 80 TRP H 0.000 . 6.000 4.610 3.299 5.079 . 0 0 "[ . 1 . 2]" 1
991 1 58 PHE QE 1 79 THR MG 0.000 . 4.500 2.688 1.926 3.795 . 0 0 "[ . 1 . 2]" 1
992 1 58 PHE QE 1 80 TRP H 0.000 . 6.000 5.786 4.896 6.017 0.017 2 0 "[ . 1 . 2]" 1
993 1 58 PHE QE 1 97 LYS HA 0.000 . 5.000 2.743 1.870 3.725 . 0 0 "[ . 1 . 2]" 1
994 1 58 PHE HZ 1 79 THR MG 0.000 . 6.000 3.705 2.867 5.285 . 0 0 "[ . 1 . 2]" 1
995 1 58 PHE HZ 1 93 THR HA 0.000 . 5.000 3.216 2.052 4.187 . 0 0 "[ . 1 . 2]" 1
996 1 58 PHE HZ 1 93 THR MG 0.000 . 5.000 3.389 2.463 4.830 . 0 0 "[ . 1 . 2]" 1
997 1 58 PHE HZ 1 96 ASP H 0.000 . 6.000 4.249 3.652 4.872 . 0 0 "[ . 1 . 2]" 1
998 1 58 PHE HZ 1 97 LYS HA 0.000 . 5.000 3.066 2.271 3.904 . 0 0 "[ . 1 . 2]" 1
999 1 58 PHE HZ 1 97 LYS H 0.000 . 4.000 2.749 2.221 3.516 . 0 0 "[ . 1 . 2]" 1
1000 1 59 ALA H 1 60 PHE QD 0.000 . 5.000 5.012 4.982 5.063 0.063 8 0 "[ . 1 . 2]" 1
1001 1 59 ALA H 1 60 PHE H 0.000 . 6.000 4.360 3.890 4.532 . 0 0 "[ . 1 . 2]" 1
1002 1 59 ALA H 1 78 ILE HB 0.000 . 5.000 4.243 3.856 4.679 . 0 0 "[ . 1 . 2]" 1
1003 1 59 ALA H 1 78 ILE MG 0.000 . 6.000 4.859 4.361 5.340 . 0 0 "[ . 1 . 2]" 1
1004 1 59 ALA H 1 78 ILE H 0.000 . 4.000 3.726 3.221 4.019 0.019 20 0 "[ . 1 . 2]" 1
1005 1 59 ALA H 1 79 THR HA 0.000 . 4.000 3.315 2.758 3.626 . 0 0 "[ . 1 . 2]" 1
1006 1 59 ALA H 1 80 TRP H 0.000 . 6.000 4.321 3.111 4.617 . 0 0 "[ . 1 . 2]" 1
1007 1 59 ALA HA 1 60 PHE H 0.000 . 3.000 2.334 2.139 2.498 . 0 0 "[ . 1 . 2]" 1
1008 1 59 ALA MB 1 60 PHE H 0.000 . 5.000 2.623 2.291 3.314 . 0 0 "[ . 1 . 2]" 1
1009 1 59 ALA MB 1 78 ILE MG 0.000 . 5.000 3.388 2.917 4.340 . 0 0 "[ . 1 . 2]" 1
1010 1 59 ALA MB 1 78 ILE H 0.000 . 6.000 3.324 2.776 4.732 . 0 0 "[ . 1 . 2]" 1
1011 1 60 PHE H 1 60 PHE QD 0.000 . 4.500 4.239 2.591 4.493 . 0 0 "[ . 1 . 2]" 1
1012 1 60 PHE H 1 61 VAL HA 0.000 . 6.000 4.788 4.586 5.002 . 0 0 "[ . 1 . 2]" 1
1013 1 60 PHE H 1 61 VAL H 0.000 . 6.000 4.154 3.867 4.503 . 0 0 "[ . 1 . 2]" 1
1014 1 60 PHE HA 1 60 PHE QD 0.000 . 4.000 2.995 2.585 3.720 . 0 0 "[ . 1 . 2]" 1
1015 1 60 PHE HA 1 61 VAL H 0.000 . 3.000 2.185 2.145 2.410 . 0 0 "[ . 1 . 2]" 1
1016 1 60 PHE HA 1 61 VAL QG 0.000 . 6.000 3.573 3.140 3.748 . 0 0 "[ . 1 . 2]" 1
1017 1 60 PHE HA 1 76 ALA H 0.000 . 6.000 4.856 4.324 5.288 . 0 0 "[ . 1 . 2]" 1
1018 1 60 PHE HA 1 77 LEU HA 0.000 . 4.000 2.777 2.298 2.989 . 0 0 "[ . 1 . 2]" 1
1019 1 60 PHE HA 1 77 LEU QD 0.000 . 6.000 4.093 2.972 5.027 . 0 0 "[ . 1 . 2]" 1
1020 1 60 PHE HA 1 78 ILE H 0.000 . 4.000 3.167 2.315 3.598 . 0 0 "[ . 1 . 2]" 1
1021 1 60 PHE QB 1 61 VAL H 0.000 . 6.000 3.591 2.432 3.875 . 0 0 "[ . 1 . 2]" 1
1022 1 60 PHE QB 1 77 LEU HA 0.000 . 6.000 4.104 1.729 4.668 . 0 0 "[ . 1 . 2]" 1
1023 1 60 PHE QB 1 78 ILE H 0.000 . 6.000 4.707 2.643 5.363 . 0 0 "[ . 1 . 2]" 1
1024 1 60 PHE QD 1 61 VAL H 0.000 . 4.000 3.503 2.692 3.968 . 0 0 "[ . 1 . 2]" 1
1025 1 60 PHE QD 1 76 ALA H 0.000 . 5.000 4.413 3.015 4.943 . 0 0 "[ . 1 . 2]" 1
1026 1 60 PHE QD 1 77 LEU QD 0.000 . 5.000 2.726 1.860 3.714 . 0 0 "[ . 1 . 2]" 1
1027 1 60 PHE QD 1 78 ILE H 0.000 . 6.000 4.647 3.962 5.385 . 0 0 "[ . 1 . 2]" 1
1028 1 60 PHE QD 1 104 VAL QG 0.000 . 6.000 3.821 3.241 4.335 . 0 0 "[ . 1 . 2]" 1
1029 1 60 PHE QE 1 61 VAL H 0.000 . 6.000 4.863 4.299 5.389 . 0 0 "[ . 1 . 2]" 1
1030 1 60 PHE QE 1 62 ARG H 0.000 . 6.000 5.848 4.775 6.026 0.026 7 0 "[ . 1 . 2]" 1
1031 1 60 PHE QE 1 76 ALA H 0.000 . 5.000 4.243 3.534 5.033 0.033 16 0 "[ . 1 . 2]" 1
1032 1 61 VAL H 1 61 VAL HB 0.000 . 3.500 2.976 2.737 3.403 . 0 0 "[ . 1 . 2]" 1
1033 1 61 VAL H 1 62 ARG H 0.000 . 6.000 4.359 4.237 4.449 . 0 0 "[ . 1 . 2]" 1
1034 1 61 VAL H 1 76 ALA MB 0.000 . 6.000 3.617 2.721 4.264 . 0 0 "[ . 1 . 2]" 1
1035 1 61 VAL H 1 76 ALA H 0.000 . 4.000 3.507 3.035 3.831 . 0 0 "[ . 1 . 2]" 1
1036 1 61 VAL H 1 77 LEU HA 0.000 . 4.000 3.801 3.497 4.022 0.022 16 0 "[ . 1 . 2]" 1
1037 1 61 VAL H 1 78 ILE MD 0.000 . 6.000 3.769 2.461 5.239 . 0 0 "[ . 1 . 2]" 1
1038 1 61 VAL H 1 78 ILE H 0.000 . 5.000 4.196 3.512 4.867 . 0 0 "[ . 1 . 2]" 1
1039 1 61 VAL HA 1 62 ARG H 0.000 . 3.000 2.201 2.142 2.294 . 0 0 "[ . 1 . 2]" 1
1040 1 61 VAL QG 1 62 ARG HA 0.000 . 6.000 3.767 3.388 4.051 . 0 0 "[ . 1 . 2]" 1
1041 1 61 VAL QG 1 62 ARG H 0.000 . 5.000 2.321 2.097 2.747 . 0 0 "[ . 1 . 2]" 1
1042 1 61 VAL QG 1 63 PHE HA 0.000 . 6.000 4.052 3.722 4.474 . 0 0 "[ . 1 . 2]" 1
1043 1 62 ARG H 1 62 ARG HG3 0.000 . 5.000 3.671 1.829 4.817 . 0 0 "[ . 1 . 2]" 1
1044 1 62 ARG H 1 62 ARG HG2 0.000 . 5.000 3.908 2.291 4.696 . 0 0 "[ . 1 . 2]" 1
1045 1 62 ARG H 1 63 PHE QD 0.000 . 5.000 4.825 4.455 5.020 0.020 13 0 "[ . 1 . 2]" 1
1046 1 62 ARG H 1 63 PHE QE 0.000 . 6.000 5.310 4.712 5.783 . 0 0 "[ . 1 . 2]" 1
1047 1 62 ARG HA 1 63 PHE H 0.000 . 3.000 2.186 2.147 2.321 . 0 0 "[ . 1 . 2]" 1
1048 1 62 ARG HA 1 74 LYS H 0.000 . 5.000 4.606 4.105 5.001 0.001 8 0 "[ . 1 . 2]" 1
1049 1 62 ARG HA 1 75 PHE HA 0.000 . 3.500 2.712 2.054 3.265 . 0 0 "[ . 1 . 2]" 1
1050 1 62 ARG HA 1 76 ALA H 0.000 . 4.000 3.509 3.088 3.861 . 0 0 "[ . 1 . 2]" 1
1051 1 62 ARG QB 1 63 PHE H 0.000 . 4.500 3.486 2.640 3.943 . 0 0 "[ . 1 . 2]" 1
1052 1 63 PHE H 1 63 PHE HB3 0.000 . 4.000 3.653 3.416 3.896 . 0 0 "[ . 1 . 2]" 1
1053 1 63 PHE H 1 63 PHE HB2 0.000 . 4.000 2.469 2.261 2.862 . 0 0 "[ . 1 . 2]" 1
1054 1 63 PHE H 1 63 PHE QD 0.000 . 4.000 2.939 2.277 3.678 . 0 0 "[ . 1 . 2]" 1
1055 1 63 PHE H 1 63 PHE QE 0.000 . 6.000 4.974 4.405 5.686 . 0 0 "[ . 1 . 2]" 1
1056 1 63 PHE H 1 64 THR H 0.000 . 6.000 4.517 4.403 4.590 . 0 0 "[ . 1 . 2]" 1
1057 1 63 PHE H 1 74 LYS QB 0.000 . 6.000 3.769 2.500 4.458 . 0 0 "[ . 1 . 2]" 1
1058 1 63 PHE H 1 73 SER HA 0.000 . 6.000 5.004 4.507 5.467 . 0 0 "[ . 1 . 2]" 1
1059 1 63 PHE H 1 74 LYS H 0.000 . 4.000 3.246 2.717 3.815 . 0 0 "[ . 1 . 2]" 1
1060 1 63 PHE H 1 75 PHE HA 0.000 . 4.000 3.627 3.076 3.974 . 0 0 "[ . 1 . 2]" 1
1061 1 63 PHE H 1 76 ALA H 0.000 . 6.000 4.542 3.900 5.342 . 0 0 "[ . 1 . 2]" 1
1062 1 63 PHE HA 1 64 THR H 0.000 . 3.000 2.312 2.196 2.498 . 0 0 "[ . 1 . 2]" 1
1063 1 63 PHE QB 1 64 THR H 0.000 . 4.000 2.642 2.169 3.137 . 0 0 "[ . 1 . 2]" 1
1064 1 63 PHE HB3 1 74 LYS H 0.000 . 6.000 4.724 3.924 5.657 . 0 0 "[ . 1 . 2]" 1
1065 1 63 PHE HB2 1 74 LYS H 0.000 . 6.000 3.983 3.125 4.951 . 0 0 "[ . 1 . 2]" 1
1066 1 63 PHE HB3 1 125 LYS HA 0.000 . 6.000 4.846 3.795 5.853 . 0 0 "[ . 1 . 2]" 1
1067 1 63 PHE HB2 1 125 LYS HA 0.000 . 6.000 5.170 3.756 5.901 . 0 0 "[ . 1 . 2]" 1
1068 1 63 PHE HB3 1 128 LEU QD 0.000 . 4.500 3.257 2.234 4.321 . 0 0 "[ . 1 . 2]" 1
1069 1 63 PHE HB2 1 128 LEU QD 0.000 . 4.500 2.438 1.842 3.236 . 0 0 "[ . 1 . 2]" 1
1070 1 63 PHE QD 1 64 THR H 0.000 . 4.000 3.570 2.713 3.992 . 0 0 "[ . 1 . 2]" 1
1071 1 63 PHE QD 1 128 LEU MD1 0.000 . 5.000 3.292 2.032 4.588 . 0 0 "[ . 1 . 2]" 1
1072 1 63 PHE QD 1 128 LEU MD2 0.000 . 5.000 2.820 1.938 4.025 . 0 0 "[ . 1 . 2]" 1
1073 1 63 PHE QD 1 128 LEU QD 0.000 . 4.500 2.488 1.915 3.155 . 0 0 "[ . 1 . 2]" 1
1074 1 63 PHE QE 1 125 LYS H 0.000 . 6.000 3.800 2.783 5.339 . 0 0 "[ . 1 . 2]" 1
1075 1 63 PHE HZ 1 125 LYS H 0.000 . 6.000 4.301 3.554 5.700 . 0 0 "[ . 1 . 2]" 1
1076 1 64 THR H 1 64 THR HB 0.000 . 3.500 3.170 2.793 3.511 0.011 1 0 "[ . 1 . 2]" 1
1077 1 64 THR H 1 65 THR H 0.000 . 6.000 4.103 3.722 4.510 . 0 0 "[ . 1 . 2]" 1
1078 1 64 THR H 1 65 THR MG 0.000 . 5.000 4.053 3.518 4.834 . 0 0 "[ . 1 . 2]" 1
1079 1 64 THR H 1 125 LYS QE 0.000 . 6.000 5.041 3.324 6.044 0.044 14 0 "[ . 1 . 2]" 1
1080 1 64 THR HA 1 65 THR H 0.000 . 3.000 2.161 2.133 2.207 . 0 0 "[ . 1 . 2]" 1
1081 1 64 THR HA 1 72 ARG H 0.000 . 4.500 4.412 3.947 4.514 0.014 17 0 "[ . 1 . 2]" 1
1082 1 64 THR HA 1 73 SER HA 0.000 . 3.500 2.209 1.973 2.623 . 0 0 "[ . 1 . 2]" 1
1083 1 64 THR HA 1 73 SER QB 0.000 . 6.000 3.970 3.149 4.787 . 0 0 "[ . 1 . 2]" 1
1084 1 64 THR HA 1 74 LYS H 0.000 . 4.500 3.399 2.730 3.695 . 0 0 "[ . 1 . 2]" 1
1085 1 64 THR MG 1 65 THR H 0.000 . 5.000 3.553 2.384 4.299 . 0 0 "[ . 1 . 2]" 1
1086 1 64 THR MG 1 66 GLY H 0.000 . 6.000 4.432 3.393 5.301 . 0 0 "[ . 1 . 2]" 1
1087 1 64 THR MG 1 72 ARG H 0.000 . 6.000 4.177 2.522 5.688 . 0 0 "[ . 1 . 2]" 1
1088 1 64 THR MG 1 73 SER QB 0.000 . 6.000 3.715 2.071 5.346 . 0 0 "[ . 1 . 2]" 1
1089 1 65 THR H 1 65 THR MG 0.000 . 4.500 2.895 2.068 3.208 . 0 0 "[ . 1 . 2]" 1
1090 1 65 THR H 1 66 GLY H 0.000 . 6.000 4.105 3.763 4.550 . 0 0 "[ . 1 . 2]" 1
1091 1 65 THR H 1 71 LYS HA 0.000 . 6.000 4.916 4.500 5.371 . 0 0 "[ . 1 . 2]" 1
1092 1 65 THR H 1 72 ARG QB 0.000 . 6.000 3.584 2.506 4.768 . 0 0 "[ . 1 . 2]" 1
1093 1 65 THR H 1 72 ARG H 0.000 . 4.000 3.297 2.885 3.830 . 0 0 "[ . 1 . 2]" 1
1094 1 65 THR H 1 73 SER HA 0.000 . 4.000 3.656 3.162 3.966 . 0 0 "[ . 1 . 2]" 1
1095 1 65 THR H 1 74 LYS H 0.000 . 6.000 4.818 4.140 5.148 . 0 0 "[ . 1 . 2]" 1
1096 1 65 THR HA 1 66 GLY H 0.000 . 3.000 2.214 2.134 2.261 . 0 0 "[ . 1 . 2]" 1
1097 1 65 THR HA 1 72 ARG H 0.000 . 6.000 4.779 4.513 5.188 . 0 0 "[ . 1 . 2]" 1
1098 1 65 THR HB 1 66 GLY H 0.000 . 4.000 3.825 2.947 4.038 0.038 10 0 "[ . 1 . 2]" 1
1099 1 65 THR MG 1 72 ARG H 0.000 . 6.000 5.178 3.378 5.818 . 0 0 "[ . 1 . 2]" 1
1100 1 65 THR MG 1 73 SER HA 0.000 . 6.000 5.404 4.390 5.825 . 0 0 "[ . 1 . 2]" 1
1101 1 65 THR MG 1 129 LYS HA 0.000 . 5.000 3.838 2.447 4.927 . 0 0 "[ . 1 . 2]" 1
1102 1 66 GLY H 1 67 ASP H 0.000 . 6.000 4.358 4.227 4.430 . 0 0 "[ . 1 . 2]" 1
1103 1 66 GLY HA3 1 67 ASP H 0.000 . 3.000 2.819 2.581 3.054 0.054 5 0 "[ . 1 . 2]" 1
1104 1 66 GLY HA2 1 67 ASP H 0.000 . 3.000 2.334 2.120 2.541 . 0 0 "[ . 1 . 2]" 1
1105 1 66 GLY HA3 1 70 SER H 0.000 . 4.500 4.113 3.697 4.567 0.067 11 0 "[ . 1 . 2]" 1
1106 1 66 GLY HA2 1 70 SER H 0.000 . 4.500 4.025 3.569 4.550 0.050 11 0 "[ . 1 . 2]" 1
1107 1 66 GLY HA3 1 71 LYS HA 0.000 . 4.500 1.893 1.712 2.203 . 0 0 "[ . 1 . 2]" 1
1108 1 66 GLY HA2 1 71 LYS HA 0.000 . 4.500 2.973 1.953 3.514 . 0 0 "[ . 1 . 2]" 1
1109 1 66 GLY QA 1 71 LYS HA 0.000 . 4.000 1.852 1.692 2.055 . 0 0 "[ . 1 . 2]" 1
1110 1 66 GLY HA3 1 72 ARG H 0.000 . 4.000 3.231 2.880 3.974 . 0 0 "[ . 1 . 2]" 1
1111 1 66 GLY HA2 1 72 ARG H 0.000 . 4.000 3.744 3.236 3.983 . 0 0 "[ . 1 . 2]" 1
1112 1 67 ASP H 1 67 ASP HB3 0.000 . 3.500 3.243 2.804 3.575 0.075 20 0 "[ . 1 . 2]" 1
1113 1 67 ASP H 1 67 ASP HB2 0.000 . 3.500 3.040 2.228 3.548 0.048 19 0 "[ . 1 . 2]" 1
1114 1 67 ASP H 1 68 ALA H 0.000 . 6.000 3.592 3.209 4.521 . 0 0 "[ . 1 . 2]" 1
1115 1 67 ASP H 1 69 MET H 0.000 . 6.000 3.217 2.635 4.271 . 0 0 "[ . 1 . 2]" 1
1116 1 67 ASP H 1 70 SER QB 0.000 . 6.000 4.041 2.406 4.831 . 0 0 "[ . 1 . 2]" 1
1117 1 67 ASP H 1 70 SER H 0.000 . 4.000 2.657 2.379 3.175 . 0 0 "[ . 1 . 2]" 1
1118 1 67 ASP H 1 71 LYS HA 0.000 . 4.000 3.992 3.677 4.031 0.031 3 0 "[ . 1 . 2]" 1
1119 1 67 ASP H 1 71 LYS QB 0.000 . 6.000 4.803 4.017 5.407 . 0 0 "[ . 1 . 2]" 1
1120 1 67 ASP H 1 72 ARG H 0.000 . 6.000 5.528 5.199 5.891 . 0 0 "[ . 1 . 2]" 1
1121 1 67 ASP HA 1 68 ALA H 0.000 . 3.000 2.361 2.174 2.652 . 0 0 "[ . 1 . 2]" 1
1122 1 67 ASP HB3 1 68 ALA H 0.000 . 5.000 4.028 2.529 4.441 . 0 0 "[ . 1 . 2]" 1
1123 1 67 ASP HB2 1 68 ALA H 0.000 . 5.000 4.401 3.359 4.675 . 0 0 "[ . 1 . 2]" 1
1124 1 67 ASP QB 1 68 ALA H 0.000 . 4.000 3.687 2.494 4.022 0.022 13 0 "[ . 1 . 2]" 1
1125 1 67 ASP QB 1 69 MET H 0.000 . 5.000 4.160 2.303 5.013 0.013 8 0 "[ . 1 . 2]" 1
1126 1 67 ASP QB 1 70 SER H 0.000 . 5.000 4.349 3.161 4.938 . 0 0 "[ . 1 . 2]" 1
1127 1 68 ALA H 1 69 MET H 0.000 . 5.000 2.932 2.612 3.182 . 0 0 "[ . 1 . 2]" 1
1128 1 68 ALA HA 1 69 MET H 0.000 . 3.000 2.828 2.475 3.160 0.160 5 0 "[ . 1 . 2]" 1
1129 1 68 ALA HA 1 70 SER H 0.000 . 4.500 4.523 4.247 4.594 0.094 1 0 "[ . 1 . 2]" 1
1130 1 68 ALA MB 1 69 MET H 0.000 . 3.500 3.615 3.431 3.679 0.179 4 0 "[ . 1 . 2]" 1
1131 1 68 ALA MB 1 70 SER H 0.000 . 6.000 4.910 3.331 5.180 . 0 0 "[ . 1 . 2]" 1
1132 1 69 MET H 1 69 MET HB3 0.000 . 4.000 3.307 2.834 3.489 . 0 0 "[ . 1 . 2]" 1
1133 1 69 MET H 1 69 MET HB2 0.000 . 4.000 3.881 3.377 4.094 0.094 12 0 "[ . 1 . 2]" 1
1134 1 69 MET H 1 69 MET HG3 0.000 . 5.000 3.606 2.544 4.817 . 0 0 "[ . 1 . 2]" 1
1135 1 69 MET H 1 69 MET HG2 0.000 . 5.000 3.240 2.115 5.005 0.005 8 0 "[ . 1 . 2]" 1
1136 1 69 MET H 1 70 SER QB 0.000 . 5.000 4.505 3.589 4.868 . 0 0 "[ . 1 . 2]" 1
1137 1 69 MET H 1 70 SER H 0.000 . 3.000 1.977 1.805 2.595 . 0 0 "[ . 1 . 2]" 1
1138 1 69 MET HA 1 70 SER H 0.000 . 4.000 3.485 3.086 3.563 . 0 0 "[ . 1 . 2]" 1
1139 1 69 MET HB3 1 70 SER H 0.000 . 5.000 3.812 2.468 4.611 . 0 0 "[ . 1 . 2]" 1
1140 1 69 MET HB2 1 70 SER H 0.000 . 5.000 3.955 3.787 4.600 . 0 0 "[ . 1 . 2]" 1
1141 1 69 MET HG3 1 70 SER H 0.000 . 4.000 2.865 1.901 4.032 0.032 15 0 "[ . 1 . 2]" 1
1142 1 69 MET HG2 1 70 SER H 0.000 . 4.000 3.065 2.108 3.998 . 0 0 "[ . 1 . 2]" 1
1143 1 70 SER H 1 70 SER HB3 0.000 . 4.000 3.540 2.950 3.947 . 0 0 "[ . 1 . 2]" 1
1144 1 70 SER H 1 70 SER HB2 0.000 . 4.000 3.131 2.410 3.945 . 0 0 "[ . 1 . 2]" 1
1145 1 70 SER H 1 71 LYS QB 0.000 . 5.000 4.652 4.244 5.010 0.010 17 0 "[ . 1 . 2]" 1
1146 1 70 SER H 1 71 LYS H 0.000 . 6.000 3.607 3.203 4.396 . 0 0 "[ . 1 . 2]" 1
1147 1 70 SER HA 1 71 LYS H 0.000 . 3.000 2.301 2.129 2.505 . 0 0 "[ . 1 . 2]" 1
1148 1 70 SER HB3 1 71 LYS H 0.000 . 5.000 4.039 2.508 4.570 . 0 0 "[ . 1 . 2]" 1
1149 1 70 SER HB2 1 71 LYS H 0.000 . 5.000 4.398 3.880 4.672 . 0 0 "[ . 1 . 2]" 1
1150 1 70 SER QB 1 71 LYS H 0.000 . 4.500 3.688 2.479 4.041 . 0 0 "[ . 1 . 2]" 1
1151 1 71 LYS H 1 71 LYS HB3 0.000 . 4.000 3.067 2.595 3.581 . 0 0 "[ . 1 . 2]" 1
1152 1 71 LYS H 1 71 LYS HB2 0.000 . 4.000 3.148 2.145 3.934 . 0 0 "[ . 1 . 2]" 1
1153 1 71 LYS H 1 71 LYS HG3 0.000 . 4.500 3.350 1.965 4.484 . 0 0 "[ . 1 . 2]" 1
1154 1 71 LYS H 1 71 LYS HG2 0.000 . 4.500 3.159 1.916 4.510 0.010 7 0 "[ . 1 . 2]" 1
1155 1 71 LYS H 1 71 LYS QG 0.000 . 4.000 2.675 1.906 4.004 0.004 15 0 "[ . 1 . 2]" 1
1156 1 71 LYS H 1 72 ARG H 0.000 . 6.000 4.357 4.132 4.570 . 0 0 "[ . 1 . 2]" 1
1157 1 71 LYS HA 1 72 ARG H 0.000 . 3.000 2.177 2.144 2.243 . 0 0 "[ . 1 . 2]" 1
1158 1 71 LYS HB3 1 72 ARG H 0.000 . 5.000 4.089 3.525 4.439 . 0 0 "[ . 1 . 2]" 1
1159 1 71 LYS HB2 1 72 ARG H 0.000 . 5.000 3.829 2.772 4.621 . 0 0 "[ . 1 . 2]" 1
1160 1 71 LYS QB 1 72 ARG H 0.000 . 4.000 3.413 2.721 3.975 . 0 0 "[ . 1 . 2]" 1
1161 1 71 LYS QG 1 72 ARG H 0.000 . 6.000 3.994 2.456 4.506 . 0 0 "[ . 1 . 2]" 1
1162 1 72 ARG H 1 72 ARG HB3 0.000 . 3.500 3.176 2.696 3.522 0.022 9 0 "[ . 1 . 2]" 1
1163 1 72 ARG H 1 72 ARG HB2 0.000 . 3.500 2.789 2.292 3.568 0.068 4 0 "[ . 1 . 2]" 1
1164 1 72 ARG H 1 72 ARG QD 0.000 . 6.000 4.628 3.987 5.209 . 0 0 "[ . 1 . 2]" 1
1165 1 72 ARG H 1 72 ARG HG3 0.000 . 5.000 4.214 2.147 4.747 . 0 0 "[ . 1 . 2]" 1
1166 1 72 ARG H 1 72 ARG HG2 0.000 . 5.000 4.271 2.060 4.823 . 0 0 "[ . 1 . 2]" 1
1167 1 72 ARG H 1 73 SER H 0.000 . 6.000 4.323 3.953 4.554 . 0 0 "[ . 1 . 2]" 1
1168 1 72 ARG HA 1 73 SER H 0.000 . 3.000 2.250 2.146 2.551 . 0 0 "[ . 1 . 2]" 1
1169 1 72 ARG QB 1 73 SER H 0.000 . 4.000 3.341 2.559 3.960 . 0 0 "[ . 1 . 2]" 1
1170 1 73 SER H 1 73 SER HB3 0.000 . 3.500 2.987 2.337 3.508 0.008 7 0 "[ . 1 . 2]" 1
1171 1 73 SER H 1 73 SER HB2 0.000 . 3.500 2.975 2.284 3.575 0.075 3 0 "[ . 1 . 2]" 1
1172 1 73 SER H 1 74 LYS H 0.000 . 6.000 4.504 4.194 4.607 . 0 0 "[ . 1 . 2]" 1
1173 1 73 SER HA 1 74 LYS H 0.000 . 3.000 2.243 2.153 2.461 . 0 0 "[ . 1 . 2]" 1
1174 1 73 SER HB3 1 74 LYS H 0.000 . 5.000 3.687 2.949 4.128 . 0 0 "[ . 1 . 2]" 1
1175 1 73 SER HB2 1 74 LYS H 0.000 . 5.000 3.754 2.352 4.481 . 0 0 "[ . 1 . 2]" 1
1176 1 73 SER QB 1 74 LYS H 0.000 . 4.000 3.210 2.308 3.749 . 0 0 "[ . 1 . 2]" 1
1177 1 74 LYS H 1 74 LYS HG3 0.000 . 5.000 3.821 3.037 4.563 . 0 0 "[ . 1 . 2]" 1
1178 1 74 LYS H 1 74 LYS HG2 0.000 . 5.000 4.193 3.216 4.978 . 0 0 "[ . 1 . 2]" 1
1179 1 74 LYS H 1 75 PHE QD 0.000 . 6.000 4.996 4.021 5.552 . 0 0 "[ . 1 . 2]" 1
1180 1 74 LYS H 1 75 PHE QE 0.000 . 6.000 5.533 4.765 5.999 . 0 0 "[ . 1 . 2]" 1
1181 1 74 LYS H 1 128 LEU QD 0.000 . 6.000 4.361 3.615 4.965 . 0 0 "[ . 1 . 2]" 1
1182 1 74 LYS HA 1 75 PHE H 0.000 . 3.000 2.263 2.144 2.402 . 0 0 "[ . 1 . 2]" 1
1183 1 74 LYS HA 1 108 ALA MB 0.000 . 5.000 3.280 2.544 3.718 . 0 0 "[ . 1 . 2]" 1
1184 1 74 LYS QB 1 75 PHE H 0.000 . 5.000 2.858 2.435 3.353 . 0 0 "[ . 1 . 2]" 1
1185 1 74 LYS QB 1 128 LEU HA 0.000 . 6.000 5.569 4.752 6.000 0.000 9 0 "[ . 1 . 2]" 1
1186 1 74 LYS QB 1 128 LEU QD 0.000 . 5.000 2.297 1.987 2.727 . 0 0 "[ . 1 . 2]" 1
1187 1 74 LYS QG 1 75 PHE H 0.000 . 5.000 3.721 2.290 4.252 . 0 0 "[ . 1 . 2]" 1
1188 1 75 PHE H 1 75 PHE QD 0.000 . 4.000 2.633 2.223 3.585 . 0 0 "[ . 1 . 2]" 1
1189 1 75 PHE H 1 75 PHE QE 0.000 . 6.000 4.522 4.194 5.420 . 0 0 "[ . 1 . 2]" 1
1190 1 75 PHE H 1 76 ALA H 0.000 . 6.000 4.482 4.314 4.608 . 0 0 "[ . 1 . 2]" 1
1191 1 75 PHE H 1 107 PHE HA 0.000 . 6.000 4.319 3.666 5.616 . 0 0 "[ . 1 . 2]" 1
1192 1 75 PHE H 1 108 ALA H 0.000 . 4.500 3.435 2.590 4.138 . 0 0 "[ . 1 . 2]" 1
1193 1 75 PHE H 1 108 ALA MB 0.000 . 4.000 2.208 1.937 2.796 . 0 0 "[ . 1 . 2]" 1
1194 1 75 PHE H 1 128 LEU MD1 0.000 . 6.000 5.448 4.301 6.011 0.011 2 0 "[ . 1 . 2]" 1
1195 1 75 PHE H 1 128 LEU MD2 0.000 . 6.000 4.605 3.031 5.964 . 0 0 "[ . 1 . 2]" 1
1196 1 75 PHE HA 1 76 ALA H 0.000 . 3.000 2.235 2.142 2.486 . 0 0 "[ . 1 . 2]" 1
1197 1 75 PHE QB 1 76 ALA H 0.000 . 4.500 2.938 2.235 3.403 . 0 0 "[ . 1 . 2]" 1
1198 1 75 PHE QD 1 76 ALA H 0.000 . 6.000 4.172 3.557 4.698 . 0 0 "[ . 1 . 2]" 1
1199 1 75 PHE QD 1 108 ALA MB 0.000 . 6.000 3.679 2.007 4.541 . 0 0 "[ . 1 . 2]" 1
1200 1 75 PHE QD 1 108 ALA H 0.000 . 4.500 3.963 3.066 4.517 0.017 2 0 "[ . 1 . 2]" 1
1201 1 76 ALA H 1 77 LEU QD 0.000 . 6.000 5.315 3.709 5.995 . 0 0 "[ . 1 . 2]" 1
1202 1 76 ALA H 1 77 LEU H 0.000 . 6.000 4.178 3.804 4.441 . 0 0 "[ . 1 . 2]" 1
1203 1 76 ALA H 1 128 LEU MD1 0.000 . 6.000 4.675 3.758 6.013 0.013 15 0 "[ . 1 . 2]" 1
1204 1 76 ALA H 1 128 LEU MD2 0.000 . 6.000 4.546 3.680 6.003 0.003 18 0 "[ . 1 . 2]" 1
1205 1 76 ALA HA 1 77 LEU H 0.000 . 3.000 2.154 2.130 2.205 . 0 0 "[ . 1 . 2]" 1
1206 1 76 ALA HA 1 107 PHE QB 0.000 . 6.000 4.188 3.169 4.959 . 0 0 "[ . 1 . 2]" 1
1207 1 76 ALA HA 1 107 PHE QD 0.000 . 6.000 5.434 4.689 5.983 . 0 0 "[ . 1 . 2]" 1
1208 1 76 ALA HA 1 108 ALA MB 0.000 . 6.000 3.914 3.756 4.100 . 0 0 "[ . 1 . 2]" 1
1209 1 76 ALA HA 1 108 ALA H 0.000 . 5.000 3.933 3.229 4.499 . 0 0 "[ . 1 . 2]" 1
1210 1 76 ALA HA 1 109 LYS H 0.000 . 4.000 2.809 2.342 3.209 . 0 0 "[ . 1 . 2]" 1
1211 1 76 ALA HA 1 110 GLU HA 0.000 . 4.500 4.187 3.919 4.501 0.001 15 0 "[ . 1 . 2]" 1
1212 1 76 ALA HA 1 111 PHE H 0.000 . 6.000 5.907 5.586 6.031 0.031 3 0 "[ . 1 . 2]" 1
1213 1 76 ALA MB 1 77 LEU H 0.000 . 5.000 3.177 2.883 3.434 . 0 0 "[ . 1 . 2]" 1
1214 1 76 ALA MB 1 78 ILE MD 0.000 . 5.000 2.985 1.935 3.740 . 0 0 "[ . 1 . 2]" 1
1215 1 76 ALA MB 1 111 PHE QD 0.000 . 6.000 4.910 4.444 5.603 . 0 0 "[ . 1 . 2]" 1
1216 1 76 ALA MB 1 111 PHE QE 0.000 . 4.500 3.603 2.990 4.406 . 0 0 "[ . 1 . 2]" 1
1217 1 76 ALA MB 1 124 ILE MG 0.000 . 5.000 2.950 2.326 3.685 . 0 0 "[ . 1 . 2]" 1
1218 1 76 ALA MB 1 128 LEU QD 0.000 . 5.000 1.843 1.664 2.176 . 0 0 "[ . 1 . 2]" 1
1219 1 77 LEU H 1 77 LEU HB3 0.000 . 4.000 2.944 2.441 3.536 . 0 0 "[ . 1 . 2]" 1
1220 1 77 LEU H 1 77 LEU HB2 0.000 . 4.000 2.682 2.151 3.670 . 0 0 "[ . 1 . 2]" 1
1221 1 77 LEU H 1 77 LEU HG 0.000 . 4.500 3.956 2.187 4.521 0.021 15 0 "[ . 1 . 2]" 1
1222 1 77 LEU H 1 78 ILE H 0.000 . 6.000 4.286 3.899 4.566 . 0 0 "[ . 1 . 2]" 1
1223 1 77 LEU H 1 109 LYS H 0.000 . 5.000 3.879 3.618 4.347 . 0 0 "[ . 1 . 2]" 1
1224 1 77 LEU H 1 110 GLU HA 0.000 . 4.000 2.660 2.386 3.051 . 0 0 "[ . 1 . 2]" 1
1225 1 77 LEU H 1 111 PHE QD 0.000 . 6.000 5.445 5.061 5.933 . 0 0 "[ . 1 . 2]" 1
1226 1 77 LEU H 1 111 PHE QE 0.000 . 6.000 5.315 4.718 5.788 . 0 0 "[ . 1 . 2]" 1
1227 1 77 LEU H 1 111 PHE H 0.000 . 5.000 4.377 4.131 4.795 . 0 0 "[ . 1 . 2]" 1
1228 1 77 LEU HA 1 78 ILE HB 0.000 . 6.000 4.786 4.626 5.049 . 0 0 "[ . 1 . 2]" 1
1229 1 77 LEU HA 1 78 ILE H 0.000 . 3.000 2.174 2.141 2.269 . 0 0 "[ . 1 . 2]" 1
1230 1 77 LEU QB 1 78 ILE H 0.000 . 5.000 3.688 3.171 4.033 . 0 0 "[ . 1 . 2]" 1
1231 1 77 LEU QB 1 110 GLU HA 0.000 . 5.000 2.964 2.085 4.448 . 0 0 "[ . 1 . 2]" 1
1232 1 77 LEU QB 1 111 PHE H 0.000 . 6.000 4.002 3.068 5.271 . 0 0 "[ . 1 . 2]" 1
1233 1 77 LEU QD 1 78 ILE H 0.000 . 6.000 3.405 2.203 4.519 . 0 0 "[ . 1 . 2]" 1
1234 1 77 LEU QD 1 100 VAL QG 0.000 . 5.000 2.420 1.739 3.357 . 0 0 "[ . 1 . 2]" 1
1235 1 77 LEU MD1 1 101 LYS HA 0.000 . 6.000 4.260 3.513 5.792 . 0 0 "[ . 1 . 2]" 1
1236 1 77 LEU MD2 1 101 LYS HA 0.000 . 6.000 5.174 3.387 5.964 . 0 0 "[ . 1 . 2]" 1
1237 1 77 LEU QD 1 104 VAL H 0.000 . 6.000 5.112 4.441 5.844 . 0 0 "[ . 1 . 2]" 1
1238 1 77 LEU QD 1 104 VAL QG 0.000 . 5.000 2.991 2.125 3.621 . 0 0 "[ . 1 . 2]" 1
1239 1 77 LEU QD 1 110 GLU HA 0.000 . 6.000 3.782 2.966 4.503 . 0 0 "[ . 1 . 2]" 1
1240 1 77 LEU QD 1 110 GLU HB3 0.000 . 5.000 2.739 1.832 3.261 . 0 0 "[ . 1 . 2]" 1
1241 1 77 LEU QD 1 110 GLU HB2 0.000 . 5.000 2.757 1.939 3.739 . 0 0 "[ . 1 . 2]" 1
1242 1 77 LEU QD 1 110 GLU QG 0.000 . 6.000 3.766 2.955 4.333 . 0 0 "[ . 1 . 2]" 1
1243 1 78 ILE H 1 78 ILE HB 0.000 . 3.500 2.692 2.586 2.990 . 0 0 "[ . 1 . 2]" 1
1244 1 78 ILE H 1 78 ILE HG13 0.000 . 5.000 2.843 2.111 3.824 . 0 0 "[ . 1 . 2]" 1
1245 1 78 ILE H 1 78 ILE HG12 0.000 . 5.000 3.600 2.231 4.247 . 0 0 "[ . 1 . 2]" 1
1246 1 78 ILE H 1 78 ILE QG 0.000 . 4.000 2.513 2.088 2.948 . 0 0 "[ . 1 . 2]" 1
1247 1 78 ILE H 1 79 THR H 0.000 . 6.000 4.349 4.017 4.575 . 0 0 "[ . 1 . 2]" 1
1248 1 78 ILE HA 1 79 THR H 0.000 . 3.000 2.172 2.125 2.330 . 0 0 "[ . 1 . 2]" 1
1249 1 78 ILE HA 1 111 PHE H 0.000 . 4.000 3.176 2.558 3.768 . 0 0 "[ . 1 . 2]" 1
1250 1 78 ILE HA 1 124 ILE MD 0.000 . 6.000 5.202 4.265 6.016 0.016 18 0 "[ . 1 . 2]" 1
1251 1 78 ILE MD 1 124 ILE MG 0.000 . 4.000 2.154 1.804 2.969 . 0 0 "[ . 1 . 2]" 1
1252 1 78 ILE MD 1 124 ILE H 0.000 . 6.000 5.437 4.999 6.013 0.013 12 0 "[ . 1 . 2]" 1
1253 1 78 ILE MG 1 79 THR H 0.000 . 5.000 2.678 2.006 3.262 . 0 0 "[ . 1 . 2]" 1
1254 1 78 ILE MG 1 80 TRP H 0.000 . 6.000 4.205 3.704 4.787 . 0 0 "[ . 1 . 2]" 1
1255 1 78 ILE MG 1 111 PHE QD 0.000 . 5.000 3.663 2.754 4.961 . 0 0 "[ . 1 . 2]" 1
1256 1 78 ILE MG 1 111 PHE QE 0.000 . 5.000 3.251 2.073 4.257 . 0 0 "[ . 1 . 2]" 1
1257 1 78 ILE MG 1 111 PHE H 0.000 . 6.000 4.526 3.258 5.242 . 0 0 "[ . 1 . 2]" 1
1258 1 79 THR H 1 79 THR HB 0.000 . 4.000 2.874 2.475 3.663 . 0 0 "[ . 1 . 2]" 1
1259 1 79 THR H 1 80 TRP H 0.000 . 6.000 4.350 4.181 4.568 . 0 0 "[ . 1 . 2]" 1
1260 1 79 THR H 1 111 PHE QB 0.000 . 6.000 5.279 4.850 5.680 . 0 0 "[ . 1 . 2]" 1
1261 1 79 THR H 1 111 PHE QD 0.000 . 5.000 4.676 3.824 5.002 0.002 2 0 "[ . 1 . 2]" 1
1262 1 79 THR H 1 111 PHE QE 0.000 . 6.000 5.594 4.970 5.958 . 0 0 "[ . 1 . 2]" 1
1263 1 79 THR H 1 111 PHE H 0.000 . 5.000 3.868 3.570 4.302 . 0 0 "[ . 1 . 2]" 1
1264 1 79 THR H 1 112 VAL HA 0.000 . 4.000 2.652 2.167 3.338 . 0 0 "[ . 1 . 2]" 1
1265 1 79 THR H 1 112 VAL QG 0.000 . 6.000 3.704 3.220 4.292 . 0 0 "[ . 1 . 2]" 1
1266 1 79 THR H 1 113 ILE MD 0.000 . 6.000 4.582 3.418 5.981 . 0 0 "[ . 1 . 2]" 1
1267 1 79 THR H 1 113 ILE H 0.000 . 5.000 3.840 3.279 4.313 . 0 0 "[ . 1 . 2]" 1
1268 1 79 THR HA 1 80 TRP H 0.000 . 3.000 2.168 2.144 2.220 . 0 0 "[ . 1 . 2]" 1
1269 1 79 THR HB 1 80 TRP H 0.000 . 5.000 4.069 3.558 4.394 . 0 0 "[ . 1 . 2]" 1
1270 1 79 THR HB 1 112 VAL HA 0.000 . 5.000 2.526 1.898 4.633 . 0 0 "[ . 1 . 2]" 1
1271 1 79 THR HB 1 112 VAL QG 0.000 . 4.500 2.225 1.787 3.823 . 0 0 "[ . 1 . 2]" 1
1272 1 79 THR MG 1 80 TRP H 0.000 . 5.000 3.125 2.475 4.232 . 0 0 "[ . 1 . 2]" 1
1273 1 79 THR MG 1 97 LYS HE3 0.000 . 5.000 3.708 2.111 4.640 . 0 0 "[ . 1 . 2]" 1
1274 1 79 THR MG 1 97 LYS HE2 0.000 . 5.000 4.177 2.869 5.012 0.012 11 0 "[ . 1 . 2]" 1
1275 1 80 TRP H 1 80 TRP HD1 0.000 . 6.000 4.892 4.759 5.084 . 0 0 "[ . 1 . 2]" 1
1276 1 80 TRP H 1 81 ILE H 0.000 . 6.000 4.498 4.362 4.574 . 0 0 "[ . 1 . 2]" 1
1277 1 80 TRP HE1 1 82 GLY QA 0.000 . 4.500 3.075 2.712 3.343 . 0 0 "[ . 1 . 2]" 1
1278 1 80 TRP HE1 1 82 GLY H 0.000 . 4.500 3.737 3.386 4.108 . 0 0 "[ . 1 . 2]" 1
1279 1 80 TRP HE1 1 83 GLU H 0.000 . 6.000 5.650 5.087 6.003 0.003 16 0 "[ . 1 . 2]" 1
1280 1 80 TRP HA 1 80 TRP HE3 0.000 . 4.000 2.359 2.066 2.634 . 0 0 "[ . 1 . 2]" 1
1281 1 80 TRP HA 1 81 ILE H 0.000 . 3.000 2.178 2.128 2.218 . 0 0 "[ . 1 . 2]" 1
1282 1 80 TRP HA 1 112 VAL HA 0.000 . 5.000 4.796 4.597 4.991 . 0 0 "[ . 1 . 2]" 1
1283 1 80 TRP HA 1 112 VAL QG 0.000 . 6.000 3.982 3.297 5.159 . 0 0 "[ . 1 . 2]" 1
1284 1 80 TRP HA 1 113 ILE HB 0.000 . 5.000 3.700 2.936 4.382 . 0 0 "[ . 1 . 2]" 1
1285 1 80 TRP HA 1 113 ILE MG 0.000 . 6.000 4.696 3.924 5.215 . 0 0 "[ . 1 . 2]" 1
1286 1 80 TRP HA 1 113 ILE H 0.000 . 4.000 3.253 3.025 3.546 . 0 0 "[ . 1 . 2]" 1
1287 1 80 TRP QB 1 81 ILE H 0.000 . 5.000 3.660 3.547 3.796 . 0 0 "[ . 1 . 2]" 1
1288 1 80 TRP HD1 1 81 ILE H 0.000 . 6.000 4.608 4.250 5.064 . 0 0 "[ . 1 . 2]" 1
1289 1 80 TRP HD1 1 82 GLY H 0.000 . 5.000 3.808 3.313 4.181 . 0 0 "[ . 1 . 2]" 1
1290 1 80 TRP HE3 1 81 ILE H 0.000 . 4.500 3.201 2.656 3.558 . 0 0 "[ . 1 . 2]" 1
1291 1 80 TRP HE3 1 113 ILE H 0.000 . 6.000 4.058 3.583 4.410 . 0 0 "[ . 1 . 2]" 1
1292 1 80 TRP HE3 1 113 ILE HB 0.000 . 4.000 2.741 2.181 3.467 . 0 0 "[ . 1 . 2]" 1
1293 1 80 TRP HE3 1 113 ILE MG 0.000 . 5.000 3.185 2.489 3.967 . 0 0 "[ . 1 . 2]" 1
1294 1 80 TRP HE3 1 115 ASP H 0.000 . 6.000 4.439 3.862 5.537 . 0 0 "[ . 1 . 2]" 1
1295 1 80 TRP HE3 1 119 LEU QD 0.000 . 5.000 2.605 2.042 3.448 . 0 0 "[ . 1 . 2]" 1
1296 1 80 TRP HH2 1 115 ASP HA 0.000 . 4.500 3.070 2.561 3.649 . 0 0 "[ . 1 . 2]" 1
1297 1 80 TRP HH2 1 115 ASP H 0.000 . 6.000 3.894 3.240 5.099 . 0 0 "[ . 1 . 2]" 1
1298 1 80 TRP HH2 1 116 ARG H 0.000 . 4.000 3.377 2.976 3.754 . 0 0 "[ . 1 . 2]" 1
1299 1 80 TRP HH2 1 117 LYS H 0.000 . 6.000 5.687 5.003 6.020 0.020 7 0 "[ . 1 . 2]" 1
1300 1 80 TRP HZ2 1 82 GLY QA 0.000 . 4.500 3.215 2.706 3.443 . 0 0 "[ . 1 . 2]" 1
1301 1 80 TRP HZ2 1 82 GLY H 0.000 . 6.000 5.176 4.638 5.700 . 0 0 "[ . 1 . 2]" 1
1302 1 80 TRP HZ2 1 83 GLU H 0.000 . 5.000 4.768 4.288 5.016 0.016 20 0 "[ . 1 . 2]" 1
1303 1 80 TRP HZ2 1 116 ARG H 0.000 . 6.000 5.406 4.877 5.889 . 0 0 "[ . 1 . 2]" 1
1304 1 80 TRP HZ3 1 81 ILE H 0.000 . 6.000 4.530 3.963 4.937 . 0 0 "[ . 1 . 2]" 1
1305 1 80 TRP HZ3 1 113 ILE MG 0.000 . 4.500 2.325 1.836 3.324 . 0 0 "[ . 1 . 2]" 1
1306 1 80 TRP HZ3 1 114 SER H 0.000 . 6.000 3.887 3.483 4.489 . 0 0 "[ . 1 . 2]" 1
1307 1 80 TRP HZ3 1 115 ASP H 0.000 . 5.000 2.525 1.867 3.695 . 0 0 "[ . 1 . 2]" 1
1308 1 80 TRP HZ3 1 116 ARG HA 0.000 . 5.000 3.886 2.852 4.521 . 0 0 "[ . 1 . 2]" 1
1309 1 80 TRP HZ3 1 116 ARG H 0.000 . 5.000 4.388 3.882 4.852 . 0 0 "[ . 1 . 2]" 1
1310 1 80 TRP HZ3 1 119 LEU MD1 0.000 . 6.000 3.601 2.583 5.054 . 0 0 "[ . 1 . 2]" 1
1311 1 80 TRP HZ3 1 119 LEU MD2 0.000 . 6.000 3.554 2.388 5.243 . 0 0 "[ . 1 . 2]" 1
1312 1 80 TRP HZ3 1 119 LEU QD 0.000 . 4.500 2.760 2.383 3.270 . 0 0 "[ . 1 . 2]" 1
1313 1 81 ILE H 1 81 ILE HG13 0.000 . 4.500 3.559 2.606 4.537 0.037 17 0 "[ . 1 . 2]" 1
1314 1 81 ILE H 1 81 ILE HG12 0.000 . 4.500 4.137 2.551 4.528 0.028 13 0 "[ . 1 . 2]" 1
1315 1 81 ILE H 1 81 ILE MG 0.000 . 4.000 3.136 1.918 3.977 . 0 0 "[ . 1 . 2]" 1
1316 1 81 ILE H 1 82 GLY H 0.000 . 6.000 3.808 3.568 4.052 . 0 0 "[ . 1 . 2]" 1
1317 1 81 ILE H 1 112 VAL QG 0.000 . 6.000 4.140 3.382 5.447 . 0 0 "[ . 1 . 2]" 1
1318 1 81 ILE H 1 113 ILE HB 0.000 . 6.000 4.863 4.174 5.190 . 0 0 "[ . 1 . 2]" 1
1319 1 81 ILE H 1 113 ILE MG 0.000 . 6.000 5.085 4.336 5.546 . 0 0 "[ . 1 . 2]" 1
1320 1 81 ILE H 1 113 ILE H 0.000 . 4.500 4.171 3.556 4.450 . 0 0 "[ . 1 . 2]" 1
1321 1 81 ILE H 1 114 SER HA 0.000 . 4.000 3.223 2.921 3.535 . 0 0 "[ . 1 . 2]" 1
1322 1 81 ILE H 1 119 LEU QD 0.000 . 6.000 4.868 4.253 5.829 . 0 0 "[ . 1 . 2]" 1
1323 1 81 ILE HA 1 82 GLY H 0.000 . 3.000 2.220 2.159 2.320 . 0 0 "[ . 1 . 2]" 1
1324 1 81 ILE HA 1 93 THR MG 0.000 . 6.000 4.438 3.885 5.205 . 0 0 "[ . 1 . 2]" 1
1325 1 81 ILE HB 1 82 GLY H 0.000 . 5.000 4.422 4.060 4.584 . 0 0 "[ . 1 . 2]" 1
1326 1 81 ILE QG 1 82 GLY H 0.000 . 4.500 3.985 3.156 4.461 . 0 0 "[ . 1 . 2]" 1
1327 1 81 ILE MG 1 82 GLY H 0.000 . 6.000 3.679 3.061 4.259 . 0 0 "[ . 1 . 2]" 1
1328 1 81 ILE MD 1 82 GLY H 0.000 . 6.000 5.245 4.684 5.597 . 0 0 "[ . 1 . 2]" 1
1329 1 81 ILE MD 1 90 ARG HA 0.000 . 5.000 3.885 2.979 5.013 0.013 9 0 "[ . 1 . 2]" 1
1330 1 81 ILE MD 1 90 ARG QB 0.000 . 6.000 4.838 3.804 6.009 0.009 9 0 "[ . 1 . 2]" 1
1331 1 81 ILE MD 1 93 THR H 0.000 . 6.000 5.421 4.755 6.036 0.036 1 0 "[ . 1 . 2]" 1
1332 1 81 ILE MD 1 94 GLY H 0.000 . 6.000 5.623 4.760 6.025 0.025 19 0 "[ . 1 . 2]" 1
1333 1 82 GLY H 1 83 GLU H 0.000 . 5.000 4.366 3.884 4.548 . 0 0 "[ . 1 . 2]" 1
1334 1 82 GLY H 1 85 VAL MG1 0.000 . 6.000 4.203 2.532 5.648 . 0 0 "[ . 1 . 2]" 1
1335 1 82 GLY H 1 85 VAL MG2 0.000 . 6.000 3.775 2.138 5.002 . 0 0 "[ . 1 . 2]" 1
1336 1 82 GLY H 1 85 VAL QG 0.000 . 4.500 3.183 2.133 4.328 . 0 0 "[ . 1 . 2]" 1
1337 1 82 GLY H 1 85 VAL H 0.000 . 6.000 5.576 4.289 6.014 0.014 6 0 "[ . 1 . 2]" 1
1338 1 82 GLY HA3 1 83 GLU H 0.000 . 4.500 3.304 3.131 3.525 . 0 0 "[ . 1 . 2]" 1
1339 1 82 GLY HA2 1 83 GLU H 0.000 . 4.500 2.141 2.103 2.389 . 0 0 "[ . 1 . 2]" 1
1340 1 82 GLY QA 1 83 GLU H 0.000 . 3.500 2.116 2.078 2.353 . 0 0 "[ . 1 . 2]" 1
1341 1 82 GLY QA 1 84 ASN H 0.000 . 4.500 3.595 3.281 4.273 . 0 0 "[ . 1 . 2]" 1
1342 1 83 GLU H 1 83 GLU HB3 0.000 . 4.000 3.631 2.870 3.878 . 0 0 "[ . 1 . 2]" 1
1343 1 83 GLU H 1 83 GLU HB2 0.000 . 4.000 2.666 2.329 3.585 . 0 0 "[ . 1 . 2]" 1
1344 1 83 GLU H 1 83 GLU HG3 0.000 . 4.500 3.118 2.198 4.094 . 0 0 "[ . 1 . 2]" 1
1345 1 83 GLU H 1 83 GLU HG2 0.000 . 4.500 2.961 2.109 4.420 . 0 0 "[ . 1 . 2]" 1
1346 1 83 GLU H 1 84 ASN H 0.000 . 4.000 3.374 3.098 4.015 0.015 19 0 "[ . 1 . 2]" 1
1347 1 83 GLU H 1 84 ASN QD 0.000 . 6.000 4.595 4.132 5.443 . 0 0 "[ . 1 . 2]" 1
1348 1 83 GLU H 1 85 VAL QG 0.000 . 6.000 4.102 3.261 4.699 . 0 0 "[ . 1 . 2]" 1
1349 1 83 GLU H 1 85 VAL H 0.000 . 6.000 4.753 4.200 5.025 . 0 0 "[ . 1 . 2]" 1
1350 1 83 GLU HA 1 84 ASN H 0.000 . 4.000 3.560 3.530 3.587 . 0 0 "[ . 1 . 2]" 1
1351 1 83 GLU HA 1 85 VAL H 0.000 . 5.000 3.585 3.341 3.976 . 0 0 "[ . 1 . 2]" 1
1352 1 83 GLU HB3 1 84 ASN H 0.000 . 4.500 3.229 2.039 4.293 . 0 0 "[ . 1 . 2]" 1
1353 1 83 GLU HB2 1 84 ASN H 0.000 . 4.500 2.690 2.119 3.519 . 0 0 "[ . 1 . 2]" 1
1354 1 83 GLU QB 1 85 VAL H 0.000 . 4.000 4.161 4.064 4.208 0.208 7 0 "[ . 1 . 2]" 1
1355 1 83 GLU QG 1 84 ASN H 0.000 . 4.500 4.138 2.399 4.561 0.061 17 0 "[ . 1 . 2]" 1
1356 1 84 ASN H 1 84 ASN HB3 0.000 . 3.500 3.505 2.739 3.596 0.096 4 0 "[ . 1 . 2]" 1
1357 1 84 ASN H 1 84 ASN HB2 0.000 . 3.500 2.354 2.206 3.562 0.062 19 0 "[ . 1 . 2]" 1
1358 1 84 ASN H 1 84 ASN HD21 0.000 . 4.500 2.095 1.873 2.440 . 0 0 "[ . 1 . 2]" 1
1359 1 84 ASN H 1 84 ASN HD22 0.000 . 4.500 3.635 3.087 3.914 . 0 0 "[ . 1 . 2]" 1
1360 1 84 ASN H 1 85 VAL MG1 0.000 . 6.000 5.078 3.995 6.119 0.119 18 0 "[ . 1 . 2]" 1
1361 1 84 ASN H 1 85 VAL MG2 0.000 . 6.000 4.541 3.813 6.028 0.028 14 0 "[ . 1 . 2]" 1
1362 1 84 ASN H 1 85 VAL QG 0.000 . 5.000 3.955 3.515 4.408 . 0 0 "[ . 1 . 2]" 1
1363 1 84 ASN H 1 85 VAL H 0.000 . 3.500 3.189 2.782 3.393 . 0 0 "[ . 1 . 2]" 1
1364 1 84 ASN HA 1 84 ASN HD22 0.000 . 5.000 3.929 3.565 5.047 0.047 19 0 "[ . 1 . 2]" 1
1365 1 84 ASN HD21 1 85 VAL H 0.000 . 6.000 4.841 4.549 5.467 . 0 0 "[ . 1 . 2]" 1
1366 1 84 ASN HD22 1 85 VAL H 0.000 . 6.000 6.072 5.802 6.138 0.138 4 0 "[ . 1 . 2]" 1
1367 1 84 ASN HA 1 85 VAL H 0.000 . 4.000 2.925 2.617 3.462 . 0 0 "[ . 1 . 2]" 1
1368 1 84 ASN HA 1 86 SER HA 0.000 . 6.000 5.799 5.385 6.023 0.023 7 0 "[ . 1 . 2]" 1
1369 1 84 ASN HB3 1 85 VAL H 0.000 . 5.000 4.242 3.680 4.688 . 0 0 "[ . 1 . 2]" 1
1370 1 84 ASN HB2 1 85 VAL H 0.000 . 5.000 4.034 3.072 4.402 . 0 0 "[ . 1 . 2]" 1
1371 1 85 VAL H 1 85 VAL MG1 0.000 . 4.500 3.069 1.909 3.793 . 0 0 "[ . 1 . 2]" 1
1372 1 85 VAL H 1 85 VAL MG2 0.000 . 4.500 2.547 1.932 3.863 . 0 0 "[ . 1 . 2]" 1
1373 1 85 VAL H 1 85 VAL QG 0.000 . 3.500 2.066 1.905 2.877 . 0 0 "[ . 1 . 2]" 1
1374 1 85 VAL H 1 86 SER H 0.000 . 4.500 4.428 4.275 4.578 0.078 5 0 "[ . 1 . 2]" 1
1375 1 85 VAL HA 1 86 SER H 0.000 . 3.000 2.177 2.145 2.225 . 0 0 "[ . 1 . 2]" 1
1376 1 85 VAL HB 1 86 SER H 0.000 . 5.000 3.954 3.054 4.481 . 0 0 "[ . 1 . 2]" 1
1377 1 85 VAL QG 1 86 SER H 0.000 . 4.000 2.914 2.208 3.626 . 0 0 "[ . 1 . 2]" 1
1378 1 85 VAL QG 1 89 GLN H 0.000 . 5.000 4.063 3.500 5.030 0.030 15 0 "[ . 1 . 2]" 1
1379 1 85 VAL QG 1 89 GLN HE21 0.000 . 6.000 5.043 2.937 5.673 . 0 0 "[ . 1 . 2]" 1
1380 1 85 VAL QG 1 89 GLN HE22 0.000 . 6.000 5.612 4.343 6.034 0.034 19 0 "[ . 1 . 2]" 1
1381 1 85 VAL QG 1 89 GLN HG3 0.000 . 5.000 3.716 3.108 4.206 . 0 0 "[ . 1 . 2]" 1
1382 1 85 VAL QG 1 89 GLN HG2 0.000 . 5.000 3.500 2.125 4.863 . 0 0 "[ . 1 . 2]" 1
1383 1 85 VAL MG1 1 90 ARG H 0.000 . 6.000 3.694 2.377 5.296 . 0 0 "[ . 1 . 2]" 1
1384 1 85 VAL MG2 1 90 ARG H 0.000 . 6.000 4.325 2.446 5.863 . 0 0 "[ . 1 . 2]" 1
1385 1 85 VAL QG 1 90 ARG H 0.000 . 5.000 3.079 2.372 4.165 . 0 0 "[ . 1 . 2]" 1
1386 1 85 VAL QG 1 90 ARG HD3 0.000 . 5.000 3.852 2.784 4.781 . 0 0 "[ . 1 . 2]" 1
1387 1 85 VAL QG 1 90 ARG HD2 0.000 . 5.000 4.174 3.075 4.858 . 0 0 "[ . 1 . 2]" 1
1388 1 86 SER H 1 86 SER HB3 0.000 . 4.000 3.246 2.498 3.591 . 0 0 "[ . 1 . 2]" 1
1389 1 86 SER H 1 86 SER HB2 0.000 . 4.000 2.501 2.133 3.602 . 0 0 "[ . 1 . 2]" 1
1390 1 86 SER H 1 86 SER QB 0.000 . 3.500 2.322 2.104 2.856 . 0 0 "[ . 1 . 2]" 1
1391 1 86 SER H 1 87 GLY H 0.000 . 5.000 4.617 4.543 4.655 . 0 0 "[ . 1 . 2]" 1
1392 1 86 SER H 1 88 LEU H 0.000 . 6.000 5.427 5.100 6.008 0.008 5 0 "[ . 1 . 2]" 1
1393 1 86 SER H 1 89 GLN HB3 0.000 . 4.500 3.866 3.095 4.350 . 0 0 "[ . 1 . 2]" 1
1394 1 86 SER H 1 89 GLN HB2 0.000 . 4.500 2.690 2.227 3.118 . 0 0 "[ . 1 . 2]" 1
1395 1 86 SER HA 1 87 GLY H 0.000 . 3.500 2.436 2.316 2.613 . 0 0 "[ . 1 . 2]" 1
1396 1 86 SER HA 1 88 LEU H 0.000 . 5.000 4.621 4.394 5.006 0.006 12 0 "[ . 1 . 2]" 1
1397 1 86 SER HA 1 89 GLN H 0.000 . 6.000 4.714 4.533 4.854 . 0 0 "[ . 1 . 2]" 1
1398 1 86 SER QB 1 87 GLY H 0.000 . 4.000 2.570 2.121 3.251 . 0 0 "[ . 1 . 2]" 1
1399 1 87 GLY H 1 88 LEU QB 0.000 . 6.000 4.653 4.460 5.261 . 0 0 "[ . 1 . 2]" 1
1400 1 87 GLY H 1 88 LEU QD 0.000 . 6.000 5.117 3.677 5.808 . 0 0 "[ . 1 . 2]" 1
1401 1 87 GLY H 1 88 LEU H 0.000 . 3.500 2.903 2.803 3.050 . 0 0 "[ . 1 . 2]" 1
1402 1 87 GLY H 1 89 GLN H 0.000 . 5.000 4.277 3.957 4.483 . 0 0 "[ . 1 . 2]" 1
1403 1 87 GLY HA3 1 88 LEU H 0.000 . 4.500 2.748 2.564 2.881 . 0 0 "[ . 1 . 2]" 1
1404 1 87 GLY HA2 1 88 LEU H 0.000 . 4.500 3.562 3.533 3.578 . 0 0 "[ . 1 . 2]" 1
1405 1 87 GLY QA 1 88 LEU H 0.000 . 4.000 2.661 2.510 2.760 . 0 0 "[ . 1 . 2]" 1
1406 1 87 GLY QA 1 88 LEU QD 0.000 . 6.000 4.468 3.508 5.129 . 0 0 "[ . 1 . 2]" 1
1407 1 87 GLY QA 1 90 ARG HB3 0.000 . 4.000 3.447 2.918 4.029 0.029 12 0 "[ . 1 . 2]" 1
1408 1 87 GLY QA 1 90 ARG HB2 0.000 . 4.000 2.852 2.059 3.974 . 0 0 "[ . 1 . 2]" 1
1409 1 87 GLY QA 1 90 ARG H 0.000 . 4.000 3.424 3.196 3.925 . 0 0 "[ . 1 . 2]" 1
1410 1 88 LEU H 1 88 LEU HB3 0.000 . 3.500 3.098 2.583 3.571 0.071 12 0 "[ . 1 . 2]" 1
1411 1 88 LEU H 1 88 LEU HB2 0.000 . 3.500 2.279 2.059 3.559 0.059 1 0 "[ . 1 . 2]" 1
1412 1 88 LEU H 1 88 LEU QD 0.000 . 5.000 3.165 2.071 3.726 . 0 0 "[ . 1 . 2]" 1
1413 1 88 LEU H 1 89 GLN QB 0.000 . 5.000 4.559 4.167 4.940 . 0 0 "[ . 1 . 2]" 1
1414 1 88 LEU H 1 89 GLN QG 0.000 . 6.000 5.265 3.735 6.018 0.018 6 0 "[ . 1 . 2]" 1
1415 1 88 LEU H 1 89 GLN H 0.000 . 3.500 2.711 2.480 2.821 . 0 0 "[ . 1 . 2]" 1
1416 1 88 LEU H 1 90 ARG H 0.000 . 5.000 4.136 3.994 4.325 . 0 0 "[ . 1 . 2]" 1
1417 1 88 LEU H 1 91 ALA H 0.000 . 6.000 5.050 4.716 5.492 . 0 0 "[ . 1 . 2]" 1
1418 1 88 LEU HA 1 89 GLN H 0.000 . 4.000 3.539 3.501 3.563 . 0 0 "[ . 1 . 2]" 1
1419 1 88 LEU HA 1 91 ALA MB 0.000 . 4.500 3.139 2.734 3.630 . 0 0 "[ . 1 . 2]" 1
1420 1 88 LEU HA 1 91 ALA H 0.000 . 4.000 3.653 3.407 3.949 . 0 0 "[ . 1 . 2]" 1
1421 1 88 LEU HB3 1 89 GLN H 0.000 . 4.000 2.957 2.452 4.012 0.012 1 0 "[ . 1 . 2]" 1
1422 1 88 LEU HB2 1 89 GLN H 0.000 . 4.000 3.313 2.667 3.906 . 0 0 "[ . 1 . 2]" 1
1423 1 89 GLN H 1 89 GLN HB3 0.000 . 3.500 3.495 3.342 3.573 0.073 19 0 "[ . 1 . 2]" 1
1424 1 89 GLN H 1 89 GLN HB2 0.000 . 3.500 2.279 2.076 2.732 . 0 0 "[ . 1 . 2]" 1
1425 1 89 GLN H 1 89 GLN HG3 0.000 . 5.000 3.750 3.191 4.149 . 0 0 "[ . 1 . 2]" 1
1426 1 89 GLN H 1 89 GLN HG2 0.000 . 5.000 3.486 1.826 4.487 . 0 0 "[ . 1 . 2]" 1
1427 1 89 GLN H 1 90 ARG H 0.000 . 3.500 2.625 2.543 2.756 . 0 0 "[ . 1 . 2]" 1
1428 1 89 GLN H 1 91 ALA H 0.000 . 5.000 4.308 4.091 4.606 . 0 0 "[ . 1 . 2]" 1
1429 1 89 GLN HA 1 89 GLN HE21 0.000 . 5.000 3.377 2.063 4.776 . 0 0 "[ . 1 . 2]" 1
1430 1 89 GLN HA 1 89 GLN HE22 0.000 . 5.000 4.184 3.046 5.010 0.010 6 0 "[ . 1 . 2]" 1
1431 1 89 GLN H 1 89 GLN HE21 0.000 . 5.000 3.664 2.583 4.904 . 0 0 "[ . 1 . 2]" 1
1432 1 89 GLN H 1 89 GLN HE22 0.000 . 5.000 4.285 3.220 5.005 0.005 10 0 "[ . 1 . 2]" 1
1433 1 89 GLN HA 1 90 ARG H 0.000 . 4.500 3.529 3.513 3.548 . 0 0 "[ . 1 . 2]" 1
1434 1 89 GLN HA 1 91 ALA H 0.000 . 6.000 4.395 4.035 4.648 . 0 0 "[ . 1 . 2]" 1
1435 1 89 GLN HA 1 92 LYS H 0.000 . 4.000 3.325 3.036 3.516 . 0 0 "[ . 1 . 2]" 1
1436 1 89 GLN HA 1 92 LYS QB 0.000 . 4.000 2.389 1.940 2.698 . 0 0 "[ . 1 . 2]" 1
1437 1 89 GLN HA 1 93 THR H 0.000 . 5.000 4.310 3.770 4.809 . 0 0 "[ . 1 . 2]" 1
1438 1 89 GLN HB3 1 90 ARG H 0.000 . 5.000 3.460 3.134 3.804 . 0 0 "[ . 1 . 2]" 1
1439 1 89 GLN HB2 1 90 ARG H 0.000 . 5.000 2.851 2.488 3.221 . 0 0 "[ . 1 . 2]" 1
1440 1 89 GLN QB 1 90 ARG H 0.000 . 4.000 2.700 2.451 2.873 . 0 0 "[ . 1 . 2]" 1
1441 1 89 GLN QG 1 90 ARG H 0.000 . 6.000 4.364 3.640 4.614 . 0 0 "[ . 1 . 2]" 1
1442 1 90 ARG H 1 90 ARG HB3 0.000 . 3.500 3.011 2.545 3.510 0.010 13 0 "[ . 1 . 2]" 1
1443 1 90 ARG H 1 90 ARG HB2 0.000 . 3.500 2.218 2.073 2.495 . 0 0 "[ . 1 . 2]" 1
1444 1 90 ARG H 1 90 ARG HG3 0.000 . 5.000 4.084 3.292 4.540 . 0 0 "[ . 1 . 2]" 1
1445 1 90 ARG H 1 90 ARG HG2 0.000 . 5.000 4.176 2.983 4.662 . 0 0 "[ . 1 . 2]" 1
1446 1 90 ARG H 1 90 ARG QD 0.000 . 6.000 4.318 3.228 4.683 . 0 0 "[ . 1 . 2]" 1
1447 1 90 ARG H 1 91 ALA MB 0.000 . 5.000 4.419 4.314 4.589 . 0 0 "[ . 1 . 2]" 1
1448 1 90 ARG H 1 91 ALA H 0.000 . 3.500 2.773 2.654 2.944 . 0 0 "[ . 1 . 2]" 1
1449 1 90 ARG H 1 92 LYS H 0.000 . 5.000 4.092 3.876 4.222 . 0 0 "[ . 1 . 2]" 1
1450 1 90 ARG HA 1 91 ALA H 0.000 . 4.500 3.550 3.501 3.571 . 0 0 "[ . 1 . 2]" 1
1451 1 90 ARG HB3 1 91 ALA H 0.000 . 4.000 2.705 2.339 3.372 . 0 0 "[ . 1 . 2]" 1
1452 1 90 ARG HB2 1 91 ALA H 0.000 . 4.000 3.396 2.565 3.888 . 0 0 "[ . 1 . 2]" 1
1453 1 90 ARG HA 1 93 THR H 0.000 . 5.000 3.762 3.533 4.036 . 0 0 "[ . 1 . 2]" 1
1454 1 91 ALA H 1 91 ALA MB 0.000 . 3.000 2.193 2.110 2.272 . 0 0 "[ . 1 . 2]" 1
1455 1 91 ALA H 1 92 LYS H 0.000 . 3.500 2.587 2.355 2.765 . 0 0 "[ . 1 . 2]" 1
1456 1 91 ALA H 1 92 LYS QB 0.000 . 5.000 4.301 4.002 4.565 . 0 0 "[ . 1 . 2]" 1
1457 1 91 ALA H 1 93 THR H 0.000 . 5.000 4.276 3.959 4.618 . 0 0 "[ . 1 . 2]" 1
1458 1 91 ALA HA 1 92 LYS H 0.000 . 4.000 3.530 3.499 3.556 . 0 0 "[ . 1 . 2]" 1
1459 1 91 ALA HA 1 94 GLY H 0.000 . 4.000 3.481 3.362 3.645 . 0 0 "[ . 1 . 2]" 1
1460 1 91 ALA MB 1 92 LYS H 0.000 . 4.000 2.651 2.522 2.855 . 0 0 "[ . 1 . 2]" 1
1461 1 92 LYS H 1 92 LYS HB3 0.000 . 3.500 3.260 2.761 3.551 0.051 10 0 "[ . 1 . 2]" 1
1462 1 92 LYS H 1 92 LYS HB2 0.000 . 3.500 2.175 2.075 2.339 . 0 0 "[ . 1 . 2]" 1
1463 1 92 LYS H 1 92 LYS HG3 0.000 . 5.000 3.747 2.706 4.465 . 0 0 "[ . 1 . 2]" 1
1464 1 92 LYS H 1 92 LYS HG2 0.000 . 5.000 4.024 2.689 4.660 . 0 0 "[ . 1 . 2]" 1
1465 1 92 LYS H 1 92 LYS QD 0.000 . 6.000 3.922 2.996 4.545 . 0 0 "[ . 1 . 2]" 1
1466 1 92 LYS H 1 93 THR H 0.000 . 3.500 2.785 2.691 2.892 . 0 0 "[ . 1 . 2]" 1
1467 1 92 LYS H 1 94 GLY H 0.000 . 5.000 4.298 4.049 4.590 . 0 0 "[ . 1 . 2]" 1
1468 1 92 LYS HA 1 93 THR H 0.000 . 4.500 3.551 3.526 3.580 . 0 0 "[ . 1 . 2]" 1
1469 1 92 LYS HA 1 95 THR H 0.000 . 4.000 3.555 3.312 3.762 . 0 0 "[ . 1 . 2]" 1
1470 1 92 LYS HB3 1 93 THR H 0.000 . 4.000 2.960 2.479 3.569 . 0 0 "[ . 1 . 2]" 1
1471 1 92 LYS HB2 1 93 THR H 0.000 . 4.000 3.133 2.504 3.753 . 0 0 "[ . 1 . 2]" 1
1472 1 92 LYS QG 1 93 THR H 0.000 . 5.000 4.269 3.851 4.454 . 0 0 "[ . 1 . 2]" 1
1473 1 93 THR H 1 93 THR HB 0.000 . 4.000 2.940 2.549 3.585 . 0 0 "[ . 1 . 2]" 1
1474 1 93 THR H 1 94 GLY H 0.000 . 3.500 2.782 2.650 2.929 . 0 0 "[ . 1 . 2]" 1
1475 1 93 THR H 1 95 THR H 0.000 . 5.000 4.444 4.234 4.641 . 0 0 "[ . 1 . 2]" 1
1476 1 93 THR HA 1 94 GLY H 0.000 . 4.500 3.551 3.523 3.579 . 0 0 "[ . 1 . 2]" 1
1477 1 93 THR HA 1 96 ASP HB3 0.000 . 5.000 3.795 2.466 4.565 . 0 0 "[ . 1 . 2]" 1
1478 1 93 THR HA 1 96 ASP HB2 0.000 . 5.000 2.598 2.107 3.277 . 0 0 "[ . 1 . 2]" 1
1479 1 93 THR HA 1 96 ASP QB 0.000 . 4.000 2.514 2.094 2.927 . 0 0 "[ . 1 . 2]" 1
1480 1 93 THR HA 1 96 ASP H 0.000 . 4.000 3.574 3.314 3.884 . 0 0 "[ . 1 . 2]" 1
1481 1 93 THR HB 1 94 GLY H 0.000 . 5.000 2.910 2.356 4.070 . 0 0 "[ . 1 . 2]" 1
1482 1 93 THR MG 1 94 GLY H 0.000 . 6.000 3.703 2.178 4.284 . 0 0 "[ . 1 . 2]" 1
1483 1 94 GLY H 1 95 THR H 0.000 . 3.500 2.794 2.737 2.915 . 0 0 "[ . 1 . 2]" 1
1484 1 94 GLY H 1 96 ASP H 0.000 . 5.000 4.118 3.923 4.285 . 0 0 "[ . 1 . 2]" 1
1485 1 94 GLY HA3 1 95 THR H 0.000 . 5.000 2.736 2.672 2.785 . 0 0 "[ . 1 . 2]" 1
1486 1 94 GLY HA2 1 95 THR H 0.000 . 5.000 3.568 3.553 3.584 . 0 0 "[ . 1 . 2]" 1
1487 1 94 GLY QA 1 95 THR H 0.000 . 4.000 2.652 2.600 2.690 . 0 0 "[ . 1 . 2]" 1
1488 1 94 GLY QA 1 97 LYS QB 0.000 . 4.000 2.972 2.674 3.501 . 0 0 "[ . 1 . 2]" 1
1489 1 94 GLY QA 1 97 LYS H 0.000 . 4.000 3.592 3.368 3.857 . 0 0 "[ . 1 . 2]" 1
1490 1 95 THR H 1 95 THR HB 0.000 . 3.500 3.184 2.555 3.528 0.028 4 0 "[ . 1 . 2]" 1
1491 1 95 THR H 1 96 ASP QB 0.000 . 6.000 4.458 4.249 4.761 . 0 0 "[ . 1 . 2]" 1
1492 1 95 THR H 1 96 ASP H 0.000 . 3.000 2.627 2.508 2.719 . 0 0 "[ . 1 . 2]" 1
1493 1 95 THR H 1 97 LYS H 0.000 . 5.000 4.147 3.982 4.363 . 0 0 "[ . 1 . 2]" 1
1494 1 95 THR HA 1 96 ASP H 0.000 . 4.500 3.539 3.501 3.563 . 0 0 "[ . 1 . 2]" 1
1495 1 95 THR HA 1 98 THR H 0.000 . 4.000 3.551 3.353 3.696 . 0 0 "[ . 1 . 2]" 1
1496 1 95 THR HB 1 96 ASP H 0.000 . 5.000 3.162 2.441 4.119 . 0 0 "[ . 1 . 2]" 1
1497 1 95 THR MG 1 96 ASP H 0.000 . 6.000 3.850 2.104 4.205 . 0 0 "[ . 1 . 2]" 1
1498 1 96 ASP H 1 97 LYS QB 0.000 . 6.000 4.412 4.293 4.486 . 0 0 "[ . 1 . 2]" 1
1499 1 96 ASP H 1 97 LYS H 0.000 . 3.500 2.694 2.567 2.773 . 0 0 "[ . 1 . 2]" 1
1500 1 96 ASP H 1 98 THR H 0.000 . 6.000 4.148 4.028 4.252 . 0 0 "[ . 1 . 2]" 1
1501 1 96 ASP HA 1 98 THR H 0.000 . 4.000 4.027 4.004 4.053 0.053 14 0 "[ . 1 . 2]" 1
1502 1 96 ASP HA 1 97 LYS H 0.000 . 4.500 3.533 3.502 3.549 . 0 0 "[ . 1 . 2]" 1
1503 1 96 ASP HA 1 99 LEU MD1 0.000 . 6.000 2.051 1.813 2.833 . 0 0 "[ . 1 . 2]" 1
1504 1 96 ASP HA 1 99 LEU MD2 0.000 . 6.000 4.441 4.080 4.806 . 0 0 "[ . 1 . 2]" 1
1505 1 96 ASP HA 1 99 LEU QD 0.000 . 4.500 2.046 1.811 2.814 . 0 0 "[ . 1 . 2]" 1
1506 1 96 ASP HA 1 99 LEU HG 0.000 . 4.500 3.316 2.578 3.851 . 0 0 "[ . 1 . 2]" 1
1507 1 96 ASP HA 1 99 LEU H 0.000 . 4.500 3.254 3.063 3.502 . 0 0 "[ . 1 . 2]" 1
1508 1 96 ASP HB3 1 97 LYS H 0.000 . 5.000 3.352 2.570 3.805 . 0 0 "[ . 1 . 2]" 1
1509 1 96 ASP HB2 1 97 LYS H 0.000 . 5.000 3.002 2.722 3.810 . 0 0 "[ . 1 . 2]" 1
1510 1 97 LYS H 1 97 LYS HB3 0.000 . 3.000 2.814 2.563 3.039 0.039 1 0 "[ . 1 . 2]" 1
1511 1 97 LYS H 1 97 LYS HB2 0.000 . 3.000 2.283 2.112 2.507 . 0 0 "[ . 1 . 2]" 1
1512 1 97 LYS H 1 97 LYS HG3 0.000 . 5.000 4.295 4.056 4.499 . 0 0 "[ . 1 . 2]" 1
1513 1 97 LYS H 1 97 LYS HG2 0.000 . 5.000 4.474 3.966 4.669 . 0 0 "[ . 1 . 2]" 1
1514 1 97 LYS H 1 97 LYS QD 0.000 . 6.000 4.443 3.739 4.793 . 0 0 "[ . 1 . 2]" 1
1515 1 97 LYS H 1 98 THR HB 0.000 . 5.000 5.006 4.988 5.029 0.029 12 0 "[ . 1 . 2]" 1
1516 1 97 LYS H 1 98 THR H 0.000 . 3.500 2.688 2.637 2.762 . 0 0 "[ . 1 . 2]" 1
1517 1 97 LYS H 1 99 LEU H 0.000 . 6.000 4.284 4.052 4.437 . 0 0 "[ . 1 . 2]" 1
1518 1 97 LYS HA 1 98 THR H 0.000 . 4.500 3.506 3.492 3.517 . 0 0 "[ . 1 . 2]" 1
1519 1 97 LYS HA 1 99 LEU H 0.000 . 6.000 4.539 4.410 4.787 . 0 0 "[ . 1 . 2]" 1
1520 1 97 LYS HA 1 100 VAL H 0.000 . 4.500 3.732 3.529 3.952 . 0 0 "[ . 1 . 2]" 1
1521 1 97 LYS HA 1 100 VAL HB 0.000 . 4.000 3.341 2.821 4.005 0.005 7 0 "[ . 1 . 2]" 1
1522 1 97 LYS HA 1 100 VAL MG1 0.000 . 6.000 3.990 1.896 4.768 . 0 0 "[ . 1 . 2]" 1
1523 1 97 LYS HA 1 100 VAL MG2 0.000 . 6.000 3.430 2.893 4.470 . 0 0 "[ . 1 . 2]" 1
1524 1 97 LYS HA 1 100 VAL QG 0.000 . 4.500 2.874 1.894 3.459 . 0 0 "[ . 1 . 2]" 1
1525 1 97 LYS HB3 1 98 THR H 0.000 . 4.000 2.851 2.714 2.973 . 0 0 "[ . 1 . 2]" 1
1526 1 97 LYS HB2 1 98 THR H 0.000 . 4.000 3.789 3.571 3.946 . 0 0 "[ . 1 . 2]" 1
1527 1 98 THR H 1 98 THR HB 0.000 . 3.500 2.549 2.483 2.604 . 0 0 "[ . 1 . 2]" 1
1528 1 98 THR H 1 99 LEU QB 0.000 . 5.000 4.522 4.262 4.715 . 0 0 "[ . 1 . 2]" 1
1529 1 98 THR H 1 99 LEU HG 0.000 . 4.500 4.290 3.912 4.510 0.010 15 0 "[ . 1 . 2]" 1
1530 1 98 THR H 1 99 LEU QD 0.000 . 6.000 4.457 4.145 4.767 . 0 0 "[ . 1 . 2]" 1
1531 1 98 THR H 1 99 LEU H 0.000 . 3.000 2.547 2.372 2.655 . 0 0 "[ . 1 . 2]" 1
1532 1 98 THR H 1 100 VAL QG 0.000 . 6.000 4.655 3.919 5.102 . 0 0 "[ . 1 . 2]" 1
1533 1 98 THR H 1 100 VAL H 0.000 . 4.500 4.188 4.067 4.415 . 0 0 "[ . 1 . 2]" 1
1534 1 98 THR HA 1 99 LEU H 0.000 . 5.000 3.545 3.509 3.564 . 0 0 "[ . 1 . 2]" 1
1535 1 98 THR HA 1 100 VAL H 0.000 . 6.000 4.626 4.401 4.798 . 0 0 "[ . 1 . 2]" 1
1536 1 98 THR HA 1 101 LYS HB3 0.000 . 5.000 3.219 2.654 3.905 . 0 0 "[ . 1 . 2]" 1
1537 1 98 THR HA 1 101 LYS HB2 0.000 . 5.000 2.813 2.291 3.528 . 0 0 "[ . 1 . 2]" 1
1538 1 98 THR HA 1 101 LYS QB 0.000 . 4.000 2.542 2.261 2.694 . 0 0 "[ . 1 . 2]" 1
1539 1 98 THR HA 1 101 LYS H 0.000 . 4.500 3.503 3.397 3.598 . 0 0 "[ . 1 . 2]" 1
1540 1 98 THR HA 1 102 GLU H 0.000 . 6.000 4.259 4.024 4.508 . 0 0 "[ . 1 . 2]" 1
1541 1 98 THR HB 1 99 LEU H 0.000 . 4.500 2.680 2.428 3.947 . 0 0 "[ . 1 . 2]" 1
1542 1 98 THR MG 1 101 LYS H 0.000 . 6.000 4.794 4.653 5.052 . 0 0 "[ . 1 . 2]" 1
1543 1 98 THR MG 1 102 GLU H 0.000 . 6.000 4.340 4.041 5.028 . 0 0 "[ . 1 . 2]" 1
1544 1 99 LEU H 1 99 LEU HB3 0.000 . 3.500 3.559 3.532 3.568 0.068 1 0 "[ . 1 . 2]" 1
1545 1 99 LEU H 1 99 LEU HB2 0.000 . 3.500 2.479 2.281 2.629 . 0 0 "[ . 1 . 2]" 1
1546 1 99 LEU H 1 99 LEU QD 0.000 . 5.000 3.010 2.763 3.227 . 0 0 "[ . 1 . 2]" 1
1547 1 99 LEU H 1 100 VAL QG 0.000 . 6.000 4.038 3.778 4.238 . 0 0 "[ . 1 . 2]" 1
1548 1 99 LEU H 1 100 VAL H 0.000 . 3.500 2.758 2.640 2.901 . 0 0 "[ . 1 . 2]" 1
1549 1 99 LEU H 1 101 LYS H 0.000 . 6.000 4.036 3.918 4.228 . 0 0 "[ . 1 . 2]" 1
1550 1 99 LEU HA 1 100 VAL H 0.000 . 4.500 3.562 3.546 3.575 . 0 0 "[ . 1 . 2]" 1
1551 1 99 LEU HA 1 102 GLU QB 0.000 . 4.000 3.018 2.773 3.345 . 0 0 "[ . 1 . 2]" 1
1552 1 99 LEU HA 1 102 GLU H 0.000 . 4.000 3.638 3.480 3.799 . 0 0 "[ . 1 . 2]" 1
1553 1 99 LEU HB3 1 100 VAL H 0.000 . 4.000 3.479 3.177 3.716 . 0 0 "[ . 1 . 2]" 1
1554 1 99 LEU HB2 1 100 VAL H 0.000 . 4.000 2.446 2.337 2.630 . 0 0 "[ . 1 . 2]" 1
1555 1 99 LEU QB 1 100 VAL QG 0.000 . 6.000 3.099 2.826 3.839 . 0 0 "[ . 1 . 2]" 1
1556 1 99 LEU QD 1 100 VAL H 0.000 . 6.000 3.896 3.691 4.067 . 0 0 "[ . 1 . 2]" 1
1557 1 100 VAL H 1 100 VAL HB 0.000 . 3.500 2.597 2.501 2.654 . 0 0 "[ . 1 . 2]" 1
1558 1 100 VAL H 1 100 VAL QG 0.000 . 4.000 2.097 1.997 2.218 . 0 0 "[ . 1 . 2]" 1
1559 1 100 VAL H 1 101 LYS QB 0.000 . 6.000 4.352 4.252 4.449 . 0 0 "[ . 1 . 2]" 1
1560 1 100 VAL H 1 101 LYS H 0.000 . 3.500 2.641 2.563 2.729 . 0 0 "[ . 1 . 2]" 1
1561 1 100 VAL H 1 102 GLU H 0.000 . 5.000 4.225 4.071 4.400 . 0 0 "[ . 1 . 2]" 1
1562 1 100 VAL H 1 103 VAL H 0.000 . 6.000 4.954 4.793 5.168 . 0 0 "[ . 1 . 2]" 1
1563 1 100 VAL HA 1 101 LYS H 0.000 . 4.500 3.529 3.501 3.562 . 0 0 "[ . 1 . 2]" 1
1564 1 100 VAL HA 1 102 GLU H 0.000 . 5.000 4.314 4.142 4.468 . 0 0 "[ . 1 . 2]" 1
1565 1 100 VAL HA 1 103 VAL H 0.000 . 4.500 3.453 3.222 3.645 . 0 0 "[ . 1 . 2]" 1
1566 1 100 VAL HA 1 103 VAL MG1 0.000 . 4.500 3.552 1.838 4.504 0.004 8 0 "[ . 1 . 2]" 1
1567 1 100 VAL HA 1 103 VAL MG2 0.000 . 4.500 3.206 2.093 4.518 0.018 10 0 "[ . 1 . 2]" 1
1568 1 100 VAL HB 1 101 LYS H 0.000 . 5.000 2.969 2.512 4.046 . 0 0 "[ . 1 . 2]" 1
1569 1 100 VAL MG1 1 101 LYS H 0.000 . 6.000 3.378 2.183 3.817 . 0 0 "[ . 1 . 2]" 1
1570 1 100 VAL MG2 1 101 LYS H 0.000 . 6.000 3.801 3.739 3.849 . 0 0 "[ . 1 . 2]" 1
1571 1 100 VAL QG 1 101 LYS HA 0.000 . 6.000 3.542 3.027 3.821 . 0 0 "[ . 1 . 2]" 1
1572 1 100 VAL QG 1 103 VAL QG 0.000 . 6.000 3.127 2.536 3.717 . 0 0 "[ . 1 . 2]" 1
1573 1 101 LYS H 1 101 LYS HB3 0.000 . 3.500 3.006 2.609 3.475 . 0 0 "[ . 1 . 2]" 1
1574 1 101 LYS H 1 101 LYS HB2 0.000 . 3.500 2.225 2.066 2.445 . 0 0 "[ . 1 . 2]" 1
1575 1 101 LYS H 1 102 GLU H 0.000 . 3.500 2.679 2.560 2.825 . 0 0 "[ . 1 . 2]" 1
1576 1 101 LYS H 1 103 VAL H 0.000 . 5.000 4.224 3.995 4.522 . 0 0 "[ . 1 . 2]" 1
1577 1 101 LYS H 1 104 VAL H 0.000 . 6.000 4.673 4.474 4.919 . 0 0 "[ . 1 . 2]" 1
1578 1 101 LYS HA 1 102 GLU H 0.000 . 4.500 3.537 3.508 3.559 . 0 0 "[ . 1 . 2]" 1
1579 1 101 LYS HA 1 104 VAL HB 0.000 . 5.000 3.720 3.005 4.444 . 0 0 "[ . 1 . 2]" 1
1580 1 101 LYS HA 1 104 VAL H 0.000 . 4.000 3.541 3.285 3.826 . 0 0 "[ . 1 . 2]" 1
1581 1 101 LYS HB3 1 102 GLU H 0.000 . 5.000 2.828 2.510 3.413 . 0 0 "[ . 1 . 2]" 1
1582 1 101 LYS HB2 1 102 GLU H 0.000 . 5.000 3.451 2.851 3.885 . 0 0 "[ . 1 . 2]" 1
1583 1 101 LYS QB 1 102 GLU H 0.000 . 4.000 2.647 2.468 2.847 . 0 0 "[ . 1 . 2]" 1
1584 1 102 GLU H 1 102 GLU HB3 0.000 . 3.500 3.146 2.541 3.509 0.009 6 0 "[ . 1 . 2]" 1
1585 1 102 GLU H 1 102 GLU HB2 0.000 . 3.500 2.197 2.091 2.519 . 0 0 "[ . 1 . 2]" 1
1586 1 102 GLU H 1 102 GLU HG3 0.000 . 5.000 3.960 2.867 4.561 . 0 0 "[ . 1 . 2]" 1
1587 1 102 GLU H 1 102 GLU HG2 0.000 . 5.000 4.179 2.948 4.657 . 0 0 "[ . 1 . 2]" 1
1588 1 102 GLU H 1 103 VAL QG 0.000 . 6.000 3.871 3.533 4.065 . 0 0 "[ . 1 . 2]" 1
1589 1 102 GLU H 1 103 VAL H 0.000 . 3.000 2.661 2.524 2.765 . 0 0 "[ . 1 . 2]" 1
1590 1 102 GLU H 1 104 VAL H 0.000 . 4.500 4.079 3.861 4.324 . 0 0 "[ . 1 . 2]" 1
1591 1 102 GLU HA 1 103 VAL H 0.000 . 4.000 3.544 3.503 3.582 . 0 0 "[ . 1 . 2]" 1
1592 1 102 GLU HA 1 105 GLN HE21 0.000 . 5.000 3.294 2.052 4.545 . 0 0 "[ . 1 . 2]" 1
1593 1 102 GLU HA 1 105 GLN HE22 0.000 . 5.000 3.898 2.330 5.006 0.006 20 0 "[ . 1 . 2]" 1
1594 1 102 GLU HA 1 105 GLN QE 0.000 . 4.500 3.088 1.972 4.220 . 0 0 "[ . 1 . 2]" 1
1595 1 102 GLU HB3 1 103 VAL H 0.000 . 4.000 2.901 2.302 3.513 . 0 0 "[ . 1 . 2]" 1
1596 1 102 GLU HB2 1 103 VAL H 0.000 . 4.000 3.261 2.612 3.730 . 0 0 "[ . 1 . 2]" 1
1597 1 102 GLU QG 1 103 VAL H 0.000 . 6.000 4.309 3.797 4.629 . 0 0 "[ . 1 . 2]" 1
1598 1 103 VAL H 1 103 VAL HB 0.000 . 3.500 2.713 2.551 3.589 0.089 4 0 "[ . 1 . 2]" 1
1599 1 103 VAL H 1 103 VAL MG1 0.000 . 4.000 3.141 1.987 3.793 . 0 0 "[ . 1 . 2]" 1
1600 1 103 VAL H 1 103 VAL MG2 0.000 . 4.000 2.618 1.957 3.827 . 0 0 "[ . 1 . 2]" 1
1601 1 103 VAL H 1 104 VAL H 0.000 . 3.000 2.570 2.259 2.766 . 0 0 "[ . 1 . 2]" 1
1602 1 103 VAL HA 1 104 VAL H 0.000 . 5.000 3.542 3.505 3.572 . 0 0 "[ . 1 . 2]" 1
1603 1 103 VAL HA 1 105 GLN QE 0.000 . 6.000 4.488 2.935 5.726 . 0 0 "[ . 1 . 2]" 1
1604 1 103 VAL QG 1 104 VAL H 0.000 . 5.000 2.784 1.962 3.346 . 0 0 "[ . 1 . 2]" 1
1605 1 104 VAL H 1 104 VAL HB 0.000 . 3.000 2.695 2.585 2.810 . 0 0 "[ . 1 . 2]" 1
1606 1 104 VAL H 1 105 GLN QG 0.000 . 5.000 4.420 3.816 5.018 0.018 16 0 "[ . 1 . 2]" 1
1607 1 104 VAL H 1 105 GLN H 0.000 . 6.000 4.042 3.617 4.302 . 0 0 "[ . 1 . 2]" 1
1608 1 104 VAL H 1 106 ASN H 0.000 . 6.000 5.858 5.552 6.023 0.023 6 0 "[ . 1 . 2]" 1
1609 1 104 VAL H 1 107 PHE QD 0.000 . 6.000 5.432 5.056 5.736 . 0 0 "[ . 1 . 2]" 1
1610 1 104 VAL HA 1 105 GLN QG 0.000 . 5.000 4.501 3.945 5.028 0.028 5 0 "[ . 1 . 2]" 1
1611 1 104 VAL HA 1 105 GLN H 0.000 . 3.000 2.195 2.131 2.384 . 0 0 "[ . 1 . 2]" 1
1612 1 104 VAL HB 1 105 GLN H 0.000 . 6.000 4.373 4.216 4.453 . 0 0 "[ . 1 . 2]" 1
1613 1 104 VAL MG1 1 105 GLN H 0.000 . 6.000 3.185 2.686 3.653 . 0 0 "[ . 1 . 2]" 1
1614 1 104 VAL MG2 1 105 GLN H 0.000 . 6.000 4.257 4.144 4.348 . 0 0 "[ . 1 . 2]" 1
1615 1 104 VAL MG1 1 106 ASN H 0.000 . 6.000 3.140 2.263 3.986 . 0 0 "[ . 1 . 2]" 1
1616 1 104 VAL MG2 1 106 ASN H 0.000 . 6.000 5.130 4.606 5.466 . 0 0 "[ . 1 . 2]" 1
1617 1 104 VAL QG 1 106 ASN H 0.000 . 5.000 3.111 2.258 3.894 . 0 0 "[ . 1 . 2]" 1
1618 1 104 VAL QG 1 107 PHE QD 0.000 . 5.000 2.681 1.953 3.496 . 0 0 "[ . 1 . 2]" 1
1619 1 105 GLN H 1 105 GLN HB3 0.000 . 4.000 3.549 3.006 3.725 . 0 0 "[ . 1 . 2]" 1
1620 1 105 GLN H 1 105 GLN HB2 0.000 . 4.000 2.452 2.276 3.695 . 0 0 "[ . 1 . 2]" 1
1621 1 105 GLN H 1 105 GLN HG3 0.000 . 5.000 3.425 2.591 3.920 . 0 0 "[ . 1 . 2]" 1
1622 1 105 GLN H 1 105 GLN HG2 0.000 . 5.000 3.919 1.927 4.781 . 0 0 "[ . 1 . 2]" 1
1623 1 105 GLN H 1 105 GLN HE21 0.000 . 6.000 4.188 2.279 5.368 . 0 0 "[ . 1 . 2]" 1
1624 1 105 GLN H 1 105 GLN HE22 0.000 . 6.000 5.250 3.673 6.012 0.012 8 0 "[ . 1 . 2]" 1
1625 1 105 GLN H 1 106 ASN H 0.000 . 4.000 2.159 2.049 2.473 . 0 0 "[ . 1 . 2]" 1
1626 1 105 GLN HA 1 105 GLN QE 0.000 . 5.000 4.135 2.990 4.861 . 0 0 "[ . 1 . 2]" 1
1627 1 105 GLN HA 1 106 ASN H 0.000 . 4.000 3.486 3.261 3.537 . 0 0 "[ . 1 . 2]" 1
1628 1 105 GLN HB3 1 106 ASN H 0.000 . 4.000 3.735 3.283 4.031 0.031 16 0 "[ . 1 . 2]" 1
1629 1 105 GLN HB2 1 106 ASN H 0.000 . 4.000 3.092 2.729 3.828 . 0 0 "[ . 1 . 2]" 1
1630 1 105 GLN QB 1 106 ASN HD21 0.000 . 6.000 4.057 2.987 5.302 . 0 0 "[ . 1 . 2]" 1
1631 1 105 GLN QB 1 106 ASN HD22 0.000 . 6.000 4.707 3.840 6.035 0.035 15 0 "[ . 1 . 2]" 1
1632 1 105 GLN QB 1 106 ASN QD 0.000 . 4.500 3.757 2.889 4.516 0.016 7 0 "[ . 1 . 2]" 1
1633 1 106 ASN H 1 106 ASN HB3 0.000 . 4.000 3.419 2.853 3.726 . 0 0 "[ . 1 . 2]" 1
1634 1 106 ASN H 1 106 ASN HB2 0.000 . 4.000 2.345 2.128 3.625 . 0 0 "[ . 1 . 2]" 1
1635 1 106 ASN H 1 107 PHE QD 0.000 . 5.000 4.087 3.533 4.417 . 0 0 "[ . 1 . 2]" 1
1636 1 106 ASN H 1 107 PHE QE 0.000 . 6.000 5.298 4.549 6.005 0.005 1 0 "[ . 1 . 2]" 1
1637 1 106 ASN H 1 107 PHE H 0.000 . 4.000 3.963 3.799 4.030 0.030 3 0 "[ . 1 . 2]" 1
1638 1 106 ASN HA 1 106 ASN QD 0.000 . 4.500 3.169 2.269 4.096 . 0 0 "[ . 1 . 2]" 1
1639 1 106 ASN HA 1 107 PHE H 0.000 . 3.000 2.319 2.209 2.420 . 0 0 "[ . 1 . 2]" 1
1640 1 106 ASN HB3 1 107 PHE H 0.000 . 5.000 4.196 3.932 4.533 . 0 0 "[ . 1 . 2]" 1
1641 1 106 ASN HB2 1 107 PHE H 0.000 . 5.000 4.565 4.080 4.685 . 0 0 "[ . 1 . 2]" 1
1642 1 107 PHE H 1 107 PHE HD1 0.000 . 4.000 3.834 3.369 4.022 0.022 4 0 "[ . 1 . 2]" 1
1643 1 107 PHE H 1 107 PHE HD2 0.000 . 4.000 3.378 3.186 3.639 . 0 0 "[ . 1 . 2]" 1
1644 1 107 PHE H 1 107 PHE QE 0.000 . 5.000 4.294 4.119 4.407 . 0 0 "[ . 1 . 2]" 1
1645 1 107 PHE H 1 108 ALA H 0.000 . 6.000 4.437 4.363 4.491 . 0 0 "[ . 1 . 2]" 1
1646 1 107 PHE HA 1 108 ALA MB 0.000 . 6.000 3.951 3.858 4.112 . 0 0 "[ . 1 . 2]" 1
1647 1 107 PHE HA 1 108 ALA H 0.000 . 4.000 2.456 2.259 2.626 . 0 0 "[ . 1 . 2]" 1
1648 1 107 PHE HA 1 109 LYS H 0.000 . 6.000 4.696 4.258 5.148 . 0 0 "[ . 1 . 2]" 1
1649 1 107 PHE HB3 1 108 ALA H 0.000 . 5.000 3.686 3.420 3.892 . 0 0 "[ . 1 . 2]" 1
1650 1 107 PHE HB2 1 108 ALA H 0.000 . 5.000 2.370 2.059 2.818 . 0 0 "[ . 1 . 2]" 1
1651 1 107 PHE QB 1 108 ALA H 0.000 . 4.500 2.341 2.043 2.755 . 0 0 "[ . 1 . 2]" 1
1652 1 107 PHE QB 1 109 LYS H 0.000 . 5.000 3.402 3.045 3.779 . 0 0 "[ . 1 . 2]" 1
1653 1 107 PHE QD 1 108 ALA H 0.000 . 5.000 3.293 2.707 3.822 . 0 0 "[ . 1 . 2]" 1
1654 1 107 PHE QD 1 109 LYS H 0.000 . 4.000 3.523 2.827 3.934 . 0 0 "[ . 1 . 2]" 1
1655 1 107 PHE QD 1 110 GLU H 0.000 . 5.000 4.647 4.096 4.940 . 0 0 "[ . 1 . 2]" 1
1656 1 108 ALA H 1 109 LYS H 0.000 . 4.000 2.377 2.198 2.667 . 0 0 "[ . 1 . 2]" 1
1657 1 108 ALA HA 1 109 LYS H 0.000 . 5.000 3.573 3.552 3.583 . 0 0 "[ . 1 . 2]" 1
1658 1 108 ALA MB 1 109 LYS H 0.000 . 5.000 2.369 2.175 2.549 . 0 0 "[ . 1 . 2]" 1
1659 1 108 ALA MB 1 128 LEU QD 0.000 . 6.000 3.247 2.652 4.474 . 0 0 "[ . 1 . 2]" 1
1660 1 109 LYS H 1 110 GLU H 0.000 . 6.000 4.324 4.060 4.437 . 0 0 "[ . 1 . 2]" 1
1661 1 109 LYS HA 1 110 GLU H 0.000 . 3.000 2.261 2.144 2.506 . 0 0 "[ . 1 . 2]" 1
1662 1 109 LYS HB3 1 110 GLU H 0.000 . 5.000 3.550 2.828 4.100 . 0 0 "[ . 1 . 2]" 1
1663 1 109 LYS HB2 1 110 GLU H 0.000 . 5.000 3.872 2.229 4.505 . 0 0 "[ . 1 . 2]" 1
1664 1 109 LYS QB 1 110 GLU H 0.000 . 4.000 3.140 2.210 3.803 . 0 0 "[ . 1 . 2]" 1
1665 1 109 LYS QG 1 110 GLU H 0.000 . 4.000 3.015 2.225 3.975 . 0 0 "[ . 1 . 2]" 1
1666 1 109 LYS QG 1 110 GLU HA 0.000 . 6.000 4.610 3.547 5.640 . 0 0 "[ . 1 . 2]" 1
1667 1 109 LYS HD3 1 111 PHE HZ 0.000 . 6.000 5.159 4.054 6.026 0.026 14 0 "[ . 1 . 2]" 1
1668 1 109 LYS HD2 1 111 PHE HZ 0.000 . 6.000 5.209 4.456 5.892 . 0 0 "[ . 1 . 2]" 1
1669 1 109 LYS QD 1 128 LEU HA 0.000 . 5.000 3.249 1.951 4.602 . 0 0 "[ . 1 . 2]" 1
1670 1 109 LYS QD 1 128 LEU H 0.000 . 6.000 4.799 3.954 5.799 . 0 0 "[ . 1 . 2]" 1
1671 1 110 GLU H 1 110 GLU HG3 0.000 . 3.500 2.780 2.139 3.214 . 0 0 "[ . 1 . 2]" 1
1672 1 110 GLU H 1 110 GLU HG2 0.000 . 3.500 2.665 2.276 3.269 . 0 0 "[ . 1 . 2]" 1
1673 1 110 GLU H 1 111 PHE QD 0.000 . 4.000 3.568 3.047 4.018 0.018 20 0 "[ . 1 . 2]" 1
1674 1 110 GLU H 1 111 PHE H 0.000 . 6.000 4.261 4.101 4.423 . 0 0 "[ . 1 . 2]" 1
1675 1 110 GLU HA 1 111 PHE QD 0.000 . 4.000 3.603 3.167 3.988 . 0 0 "[ . 1 . 2]" 1
1676 1 110 GLU HA 1 111 PHE H 0.000 . 3.000 2.190 2.146 2.289 . 0 0 "[ . 1 . 2]" 1
1677 1 110 GLU HB3 1 111 PHE H 0.000 . 4.500 4.095 3.893 4.212 . 0 0 "[ . 1 . 2]" 1
1678 1 110 GLU HB2 1 111 PHE H 0.000 . 4.500 3.185 2.747 3.498 . 0 0 "[ . 1 . 2]" 1
1679 1 110 GLU QB 1 111 PHE H 0.000 . 4.000 3.077 2.697 3.327 . 0 0 "[ . 1 . 2]" 1
1680 1 110 GLU QG 1 111 PHE H 0.000 . 5.000 4.215 3.808 4.438 . 0 0 "[ . 1 . 2]" 1
1681 1 111 PHE H 1 111 PHE HD1 0.000 . 4.500 3.514 2.857 4.278 . 0 0 "[ . 1 . 2]" 1
1682 1 111 PHE H 1 111 PHE HD2 0.000 . 4.500 3.951 3.335 4.460 . 0 0 "[ . 1 . 2]" 1
1683 1 111 PHE H 1 111 PHE QD 0.000 . 4.000 3.178 2.826 3.385 . 0 0 "[ . 1 . 2]" 1
1684 1 111 PHE H 1 111 PHE HE1 0.000 . 6.000 4.818 4.328 5.448 . 0 0 "[ . 1 . 2]" 1
1685 1 111 PHE H 1 111 PHE HE2 0.000 . 6.000 5.144 4.625 5.584 . 0 0 "[ . 1 . 2]" 1
1686 1 111 PHE H 1 112 VAL H 0.000 . 6.000 4.384 4.335 4.430 . 0 0 "[ . 1 . 2]" 1
1687 1 111 PHE HA 1 112 VAL H 0.000 . 3.000 2.381 2.256 2.527 . 0 0 "[ . 1 . 2]" 1
1688 1 111 PHE HB3 1 112 VAL H 0.000 . 4.500 3.610 3.429 3.904 . 0 0 "[ . 1 . 2]" 1
1689 1 111 PHE HB2 1 112 VAL H 0.000 . 4.500 2.444 2.163 2.776 . 0 0 "[ . 1 . 2]" 1
1690 1 111 PHE QB 1 112 VAL H 0.000 . 4.000 2.406 2.141 2.720 . 0 0 "[ . 1 . 2]" 1
1691 1 111 PHE QD 1 112 VAL H 0.000 . 4.000 3.739 3.522 3.913 . 0 0 "[ . 1 . 2]" 1
1692 1 111 PHE QD 1 113 ILE MD 0.000 . 4.000 2.746 2.055 3.600 . 0 0 "[ . 1 . 2]" 1
1693 1 111 PHE QD 1 124 ILE MG 0.000 . 6.000 4.911 4.503 5.524 . 0 0 "[ . 1 . 2]" 1
1694 1 111 PHE QE 1 112 VAL H 0.000 . 6.000 5.926 5.752 6.049 0.049 14 0 "[ . 1 . 2]" 1
1695 1 111 PHE QE 1 124 ILE MG 0.000 . 5.000 3.198 2.721 3.846 . 0 0 "[ . 1 . 2]" 1
1696 1 111 PHE QE 1 127 GLU QG 0.000 . 5.000 3.137 2.461 4.067 . 0 0 "[ . 1 . 2]" 1
1697 1 111 PHE QE 1 128 LEU QD 0.000 . 5.000 3.141 2.299 4.467 . 0 0 "[ . 1 . 2]" 1
1698 1 111 PHE QE 1 128 LEU H 0.000 . 5.000 4.890 4.365 5.021 0.021 17 0 "[ . 1 . 2]" 1
1699 1 111 PHE HZ 1 124 ILE HB 0.000 . 6.000 4.822 4.377 5.281 . 0 0 "[ . 1 . 2]" 1
1700 1 111 PHE HZ 1 124 ILE H 0.000 . 6.000 5.431 4.788 6.031 0.031 12 0 "[ . 1 . 2]" 1
1701 1 111 PHE HZ 1 124 ILE MD 0.000 . 6.000 3.864 2.191 5.029 . 0 0 "[ . 1 . 2]" 1
1702 1 111 PHE HZ 1 124 ILE MG 0.000 . 4.000 2.188 1.837 2.906 . 0 0 "[ . 1 . 2]" 1
1703 1 111 PHE HZ 1 127 GLU QG 0.000 . 4.500 3.607 2.869 4.385 . 0 0 "[ . 1 . 2]" 1
1704 1 111 PHE HZ 1 128 LEU H 0.000 . 5.000 4.835 4.495 5.020 0.020 9 0 "[ . 1 . 2]" 1
1705 1 112 VAL H 1 112 VAL HB 0.000 . 3.500 3.006 2.612 3.597 0.097 8 0 "[ . 1 . 2]" 1
1706 1 112 VAL H 1 113 ILE MD 0.000 . 6.000 5.162 3.870 5.874 . 0 0 "[ . 1 . 2]" 1
1707 1 112 VAL H 1 113 ILE HG13 0.000 . 6.000 4.902 4.194 6.033 0.033 15 0 "[ . 1 . 2]" 1
1708 1 112 VAL H 1 113 ILE HG12 0.000 . 6.000 5.166 4.380 5.855 . 0 0 "[ . 1 . 2]" 1
1709 1 112 VAL H 1 113 ILE QG 0.000 . 5.000 4.301 4.079 4.556 . 0 0 "[ . 1 . 2]" 1
1710 1 112 VAL H 1 113 ILE H 0.000 . 6.000 4.520 4.425 4.594 . 0 0 "[ . 1 . 2]" 1
1711 1 112 VAL HA 1 113 ILE H 0.000 . 3.000 2.246 2.165 2.366 . 0 0 "[ . 1 . 2]" 1
1712 1 112 VAL HB 1 113 ILE H 0.000 . 5.000 3.634 2.457 4.104 . 0 0 "[ . 1 . 2]" 1
1713 1 112 VAL QG 1 113 ILE HA 0.000 . 6.000 3.616 3.255 4.020 . 0 0 "[ . 1 . 2]" 1
1714 1 112 VAL QG 1 113 ILE H 0.000 . 5.000 2.489 2.095 3.319 . 0 0 "[ . 1 . 2]" 1
1715 1 113 ILE H 1 113 ILE HB 0.000 . 3.500 2.808 2.686 2.891 . 0 0 "[ . 1 . 2]" 1
1716 1 113 ILE H 1 113 ILE MD 0.000 . 4.500 3.930 3.453 4.271 . 0 0 "[ . 1 . 2]" 1
1717 1 113 ILE H 1 113 ILE HG13 0.000 . 5.000 3.229 2.689 4.317 . 0 0 "[ . 1 . 2]" 1
1718 1 113 ILE H 1 113 ILE HG12 0.000 . 5.000 3.789 2.767 4.370 . 0 0 "[ . 1 . 2]" 1
1719 1 113 ILE H 1 113 ILE QG 0.000 . 4.000 2.836 2.643 3.012 . 0 0 "[ . 1 . 2]" 1
1720 1 113 ILE H 1 114 SER H 0.000 . 6.000 4.383 4.272 4.465 . 0 0 "[ . 1 . 2]" 1
1721 1 113 ILE HA 1 114 SER H 0.000 . 3.000 2.221 2.161 2.291 . 0 0 "[ . 1 . 2]" 1
1722 1 113 ILE HA 1 115 ASP H 0.000 . 4.000 3.897 3.681 4.017 0.017 12 0 "[ . 1 . 2]" 1
1723 1 113 ILE HB 1 114 SER H 0.000 . 5.000 3.900 3.708 4.121 . 0 0 "[ . 1 . 2]" 1
1724 1 113 ILE HB 1 115 ASP H 0.000 . 5.000 4.131 3.559 4.764 . 0 0 "[ . 1 . 2]" 1
1725 1 113 ILE MD 1 118 GLU QB 0.000 . 5.000 2.866 1.987 4.092 . 0 0 "[ . 1 . 2]" 1
1726 1 113 ILE MD 1 123 PHE QB 0.000 . 6.000 4.659 4.048 5.579 . 0 0 "[ . 1 . 2]" 1
1727 1 113 ILE HG13 1 114 SER H 0.000 . 5.000 4.968 4.697 5.064 0.064 10 0 "[ . 1 . 2]" 1
1728 1 113 ILE HG12 1 114 SER H 0.000 . 5.000 4.557 4.303 4.993 . 0 0 "[ . 1 . 2]" 1
1729 1 113 ILE HG13 1 115 ASP H 0.000 . 6.000 5.734 5.244 6.039 0.039 14 0 "[ . 1 . 2]" 1
1730 1 113 ILE HG12 1 115 ASP H 0.000 . 6.000 5.343 4.919 6.038 0.038 20 0 "[ . 1 . 2]" 1
1731 1 113 ILE MG 1 114 SER H 0.000 . 4.500 2.147 1.942 2.393 . 0 0 "[ . 1 . 2]" 1
1732 1 113 ILE MG 1 115 ASP HA 0.000 . 6.000 4.164 3.954 4.289 . 0 0 "[ . 1 . 2]" 1
1733 1 113 ILE MG 1 115 ASP QB 0.000 . 6.000 3.376 2.786 4.220 . 0 0 "[ . 1 . 2]" 1
1734 1 113 ILE MG 1 115 ASP H 0.000 . 4.000 1.973 1.842 2.200 . 0 0 "[ . 1 . 2]" 1
1735 1 113 ILE MG 1 118 GLU HA 0.000 . 6.000 3.916 3.699 4.213 . 0 0 "[ . 1 . 2]" 1
1736 1 113 ILE MG 1 118 GLU QB 0.000 . 4.500 1.889 1.744 2.242 . 0 0 "[ . 1 . 2]" 1
1737 1 113 ILE MG 1 118 GLU H 0.000 . 5.000 3.551 3.106 3.918 . 0 0 "[ . 1 . 2]" 1
1738 1 113 ILE MG 1 119 LEU H 0.000 . 6.000 2.643 2.126 3.341 . 0 0 "[ . 1 . 2]" 1
1739 1 113 ILE MG 1 119 LEU QB 0.000 . 5.000 2.665 1.962 4.285 . 0 0 "[ . 1 . 2]" 1
1740 1 113 ILE MG 1 119 LEU QD 0.000 . 6.000 3.149 2.606 3.685 . 0 0 "[ . 1 . 2]" 1
1741 1 114 SER H 1 115 ASP HA 0.000 . 6.000 4.711 4.539 4.906 . 0 0 "[ . 1 . 2]" 1
1742 1 114 SER H 1 115 ASP HB3 0.000 . 6.000 4.238 3.835 4.707 . 0 0 "[ . 1 . 2]" 1
1743 1 114 SER H 1 115 ASP HB2 0.000 . 6.000 4.605 3.809 5.680 . 0 0 "[ . 1 . 2]" 1
1744 1 114 SER H 1 115 ASP H 0.000 . 3.500 2.204 1.924 2.566 . 0 0 "[ . 1 . 2]" 1
1745 1 114 SER HA 1 115 ASP H 0.000 . 4.500 3.146 2.902 3.505 . 0 0 "[ . 1 . 2]" 1
1746 1 114 SER QB 1 115 ASP H 0.000 . 6.000 3.547 2.838 4.036 . 0 0 "[ . 1 . 2]" 1
1747 1 115 ASP H 1 115 ASP HB3 0.000 . 4.000 2.929 2.499 3.539 . 0 0 "[ . 1 . 2]" 1
1748 1 115 ASP H 1 115 ASP HB2 0.000 . 4.000 3.359 2.604 4.007 0.007 19 0 "[ . 1 . 2]" 1
1749 1 115 ASP H 1 116 ARG H 0.000 . 6.000 4.384 4.251 4.578 . 0 0 "[ . 1 . 2]" 1
1750 1 115 ASP H 1 117 LYS H 0.000 . 6.000 5.272 4.907 5.655 . 0 0 "[ . 1 . 2]" 1
1751 1 115 ASP H 1 118 GLU QB 0.000 . 6.000 3.278 2.839 3.903 . 0 0 "[ . 1 . 2]" 1
1752 1 115 ASP HA 1 116 ARG QB 0.000 . 6.000 4.166 4.021 4.465 . 0 0 "[ . 1 . 2]" 1
1753 1 115 ASP HA 1 116 ARG H 0.000 . 3.000 2.216 2.172 2.301 . 0 0 "[ . 1 . 2]" 1
1754 1 115 ASP HA 1 117 LYS H 0.000 . 4.000 4.035 3.987 4.060 0.060 19 0 "[ . 1 . 2]" 1
1755 1 115 ASP HA 1 118 GLU H 0.000 . 6.000 4.718 4.364 5.255 . 0 0 "[ . 1 . 2]" 1
1756 1 115 ASP HB3 1 116 ARG H 0.000 . 5.000 3.982 3.867 4.130 . 0 0 "[ . 1 . 2]" 1
1757 1 115 ASP HB2 1 116 ARG H 0.000 . 5.000 3.666 2.675 4.214 . 0 0 "[ . 1 . 2]" 1
1758 1 115 ASP QB 1 116 ARG H 0.000 . 4.500 3.311 2.629 3.674 . 0 0 "[ . 1 . 2]" 1
1759 1 115 ASP HB3 1 117 LYS H 0.000 . 5.000 3.982 3.614 4.454 . 0 0 "[ . 1 . 2]" 1
1760 1 115 ASP HB2 1 117 LYS H 0.000 . 5.000 3.953 2.595 4.748 . 0 0 "[ . 1 . 2]" 1
1761 1 115 ASP HB3 1 118 GLU H 0.000 . 5.000 3.292 2.386 4.883 . 0 0 "[ . 1 . 2]" 1
1762 1 115 ASP HB2 1 118 GLU H 0.000 . 5.000 4.006 3.613 4.226 . 0 0 "[ . 1 . 2]" 1
1763 1 115 ASP QB 1 118 GLU H 0.000 . 4.500 2.900 2.369 3.814 . 0 0 "[ . 1 . 2]" 1
1764 1 116 ARG H 1 116 ARG HB3 0.000 . 3.500 3.033 2.504 3.524 0.024 7 0 "[ . 1 . 2]" 1
1765 1 116 ARG H 1 116 ARG HB2 0.000 . 3.500 2.457 2.065 3.571 0.071 19 0 "[ . 1 . 2]" 1
1766 1 116 ARG H 1 116 ARG QD 0.000 . 6.000 4.108 3.382 4.913 . 0 0 "[ . 1 . 2]" 1
1767 1 116 ARG H 1 116 ARG HG3 0.000 . 5.000 3.566 2.217 4.388 . 0 0 "[ . 1 . 2]" 1
1768 1 116 ARG H 1 116 ARG HG2 0.000 . 5.000 3.962 2.155 4.675 . 0 0 "[ . 1 . 2]" 1
1769 1 116 ARG H 1 116 ARG QG 0.000 . 4.500 3.260 2.075 3.943 . 0 0 "[ . 1 . 2]" 1
1770 1 116 ARG H 1 117 LYS QB 0.000 . 6.000 4.406 4.242 4.541 . 0 0 "[ . 1 . 2]" 1
1771 1 116 ARG H 1 117 LYS H 0.000 . 3.500 2.666 2.554 2.751 . 0 0 "[ . 1 . 2]" 1
1772 1 116 ARG H 1 118 GLU H 0.000 . 5.000 4.395 4.062 4.844 . 0 0 "[ . 1 . 2]" 1
1773 1 116 ARG H 1 119 LEU H 0.000 . 6.000 4.735 4.600 4.994 . 0 0 "[ . 1 . 2]" 1
1774 1 116 ARG HA 1 117 LYS H 0.000 . 5.000 3.513 3.459 3.538 . 0 0 "[ . 1 . 2]" 1
1775 1 116 ARG HA 1 119 LEU H 0.000 . 5.000 3.368 3.151 3.691 . 0 0 "[ . 1 . 2]" 1
1776 1 116 ARG HA 1 119 LEU QD 0.000 . 4.000 2.536 1.782 3.376 . 0 0 "[ . 1 . 2]" 1
1777 1 116 ARG QG 1 117 LYS H 0.000 . 6.000 3.945 1.938 4.580 . 0 0 "[ . 1 . 2]" 1
1778 1 116 ARG QD 1 119 LEU QD 0.000 . 6.000 4.316 2.605 5.981 . 0 0 "[ . 1 . 2]" 1
1779 1 117 LYS H 1 117 LYS HB3 0.000 . 3.000 2.829 2.454 3.010 0.010 15 0 "[ . 1 . 2]" 1
1780 1 117 LYS H 1 117 LYS HB2 0.000 . 3.000 2.299 2.138 2.584 . 0 0 "[ . 1 . 2]" 1
1781 1 117 LYS H 1 117 LYS HG3 0.000 . 4.500 4.364 3.999 4.511 0.011 19 0 "[ . 1 . 2]" 1
1782 1 117 LYS H 1 117 LYS HG2 0.000 . 4.500 4.431 4.145 4.532 0.032 19 0 "[ . 1 . 2]" 1
1783 1 117 LYS H 1 117 LYS QD 0.000 . 6.000 4.363 3.398 4.768 . 0 0 "[ . 1 . 2]" 1
1784 1 117 LYS H 1 118 GLU QB 0.000 . 5.000 4.537 4.228 4.764 . 0 0 "[ . 1 . 2]" 1
1785 1 117 LYS H 1 118 GLU QG 0.000 . 6.000 4.980 4.117 5.970 . 0 0 "[ . 1 . 2]" 1
1786 1 117 LYS H 1 118 GLU H 0.000 . 3.000 2.666 2.434 2.861 . 0 0 "[ . 1 . 2]" 1
1787 1 117 LYS H 1 119 LEU H 0.000 . 5.000 3.881 3.703 4.114 . 0 0 "[ . 1 . 2]" 1
1788 1 117 LYS H 1 120 GLU H 0.000 . 6.000 4.784 4.597 4.981 . 0 0 "[ . 1 . 2]" 1
1789 1 117 LYS HA 1 119 LEU H 0.000 . 5.000 4.307 4.082 4.571 . 0 0 "[ . 1 . 2]" 1
1790 1 117 LYS HA 1 120 GLU QG 0.000 . 5.000 4.716 3.915 5.022 0.022 12 0 "[ . 1 . 2]" 1
1791 1 117 LYS HA 1 120 GLU H 0.000 . 4.000 3.625 3.401 3.850 . 0 0 "[ . 1 . 2]" 1
1792 1 117 LYS HB3 1 118 GLU H 0.000 . 4.500 2.552 2.201 2.928 . 0 0 "[ . 1 . 2]" 1
1793 1 117 LYS HB2 1 118 GLU H 0.000 . 4.500 3.590 3.301 3.951 . 0 0 "[ . 1 . 2]" 1
1794 1 117 LYS QB 1 118 GLU H 0.000 . 4.000 2.498 2.180 2.801 . 0 0 "[ . 1 . 2]" 1
1795 1 117 LYS QG 1 118 GLU H 0.000 . 5.000 4.087 3.588 4.558 . 0 0 "[ . 1 . 2]" 1
1796 1 118 GLU H 1 118 GLU HB3 0.000 . 4.000 3.534 3.431 3.612 . 0 0 "[ . 1 . 2]" 1
1797 1 118 GLU H 1 118 GLU HB2 0.000 . 4.000 2.284 2.128 2.566 . 0 0 "[ . 1 . 2]" 1
1798 1 118 GLU H 1 118 GLU QB 0.000 . 3.500 2.257 2.108 2.515 . 0 0 "[ . 1 . 2]" 1
1799 1 118 GLU H 1 118 GLU HG3 0.000 . 4.500 3.028 2.134 4.054 . 0 0 "[ . 1 . 2]" 1
1800 1 118 GLU H 1 118 GLU HG2 0.000 . 4.500 3.659 2.824 4.304 . 0 0 "[ . 1 . 2]" 1
1801 1 118 GLU H 1 118 GLU QG 0.000 . 4.000 2.858 2.111 3.661 . 0 0 "[ . 1 . 2]" 1
1802 1 118 GLU H 1 119 LEU QB 0.000 . 5.000 4.307 4.142 4.903 . 0 0 "[ . 1 . 2]" 1
1803 1 118 GLU H 1 119 LEU H 0.000 . 3.500 2.528 2.430 2.647 . 0 0 "[ . 1 . 2]" 1
1804 1 118 GLU H 1 120 GLU H 0.000 . 4.500 4.019 3.791 4.177 . 0 0 "[ . 1 . 2]" 1
1805 1 118 GLU HA 1 119 LEU H 0.000 . 5.000 3.499 3.460 3.553 . 0 0 "[ . 1 . 2]" 1
1806 1 118 GLU HA 1 120 GLU H 0.000 . 5.000 4.013 3.651 4.175 . 0 0 "[ . 1 . 2]" 1
1807 1 118 GLU HA 1 123 PHE QD 0.000 . 4.500 3.034 2.613 3.522 . 0 0 "[ . 1 . 2]" 1
1808 1 118 GLU QB 1 119 LEU H 0.000 . 5.000 2.848 2.541 3.018 . 0 0 "[ . 1 . 2]" 1
1809 1 119 LEU H 1 119 LEU HG 0.000 . 4.000 3.532 2.142 4.069 0.069 14 0 "[ . 1 . 2]" 1
1810 1 119 LEU H 1 119 LEU QD 0.000 . 5.000 3.468 2.006 3.762 . 0 0 "[ . 1 . 2]" 1
1811 1 119 LEU H 1 120 GLU HB3 0.000 . 5.000 5.017 4.945 5.066 0.066 8 0 "[ . 1 . 2]" 1
1812 1 119 LEU H 1 120 GLU HB2 0.000 . 5.000 4.521 4.125 4.957 . 0 0 "[ . 1 . 2]" 1
1813 1 119 LEU H 1 120 GLU QB 0.000 . 4.500 4.202 3.945 4.442 . 0 0 "[ . 1 . 2]" 1
1814 1 119 LEU H 1 120 GLU H 0.000 . 3.500 2.513 2.283 2.791 . 0 0 "[ . 1 . 2]" 1
1815 1 119 LEU HA 1 120 GLU H 0.000 . 5.000 3.457 3.313 3.520 . 0 0 "[ . 1 . 2]" 1
1816 1 119 LEU HA 1 124 ILE MD 0.000 . 4.500 2.929 2.008 3.817 . 0 0 "[ . 1 . 2]" 1
1817 1 119 LEU HB3 1 120 GLU H 0.000 . 6.000 3.426 2.989 4.227 . 0 0 "[ . 1 . 2]" 1
1818 1 119 LEU HB2 1 120 GLU H 0.000 . 6.000 3.831 2.911 4.488 . 0 0 "[ . 1 . 2]" 1
1819 1 119 LEU QB 1 120 GLU H 0.000 . 5.000 3.140 2.759 3.827 . 0 0 "[ . 1 . 2]" 1
1820 1 119 LEU QD 1 120 GLU H 0.000 . 6.000 3.768 2.244 4.229 . 0 0 "[ . 1 . 2]" 1
1821 1 119 LEU HG 1 120 GLU H 0.000 . 6.000 4.255 2.573 5.411 . 0 0 "[ . 1 . 2]" 1
1822 1 120 GLU H 1 120 GLU HB3 0.000 . 3.500 2.746 2.540 2.906 . 0 0 "[ . 1 . 2]" 1
1823 1 120 GLU H 1 120 GLU HB2 0.000 . 3.500 2.286 2.120 2.479 . 0 0 "[ . 1 . 2]" 1
1824 1 120 GLU H 1 120 GLU HG3 0.000 . 4.500 4.275 4.035 4.435 . 0 0 "[ . 1 . 2]" 1
1825 1 120 GLU H 1 120 GLU HG2 0.000 . 4.500 4.507 4.426 4.579 0.079 16 0 "[ . 1 . 2]" 1
1826 1 120 GLU H 1 120 GLU QG 0.000 . 4.000 3.901 3.771 4.002 0.002 20 0 "[ . 1 . 2]" 1
1827 1 120 GLU H 1 121 GLU H 0.000 . 4.500 4.558 4.517 4.598 0.098 20 0 "[ . 1 . 2]" 1
1828 1 120 GLU H 1 122 ASN H 0.000 . 6.000 5.527 5.306 5.767 . 0 0 "[ . 1 . 2]" 1
1829 1 120 GLU H 1 123 PHE HB3 0.000 . 6.000 3.872 3.416 4.247 . 0 0 "[ . 1 . 2]" 1
1830 1 120 GLU H 1 123 PHE HB2 0.000 . 6.000 4.277 3.760 4.574 . 0 0 "[ . 1 . 2]" 1
1831 1 120 GLU H 1 123 PHE QD 0.000 . 6.000 5.244 4.770 5.591 . 0 0 "[ . 1 . 2]" 1
1832 1 120 GLU H 1 123 PHE H 0.000 . 6.000 4.655 4.394 4.914 . 0 0 "[ . 1 . 2]" 1
1833 1 120 GLU HA 1 121 GLU H 0.000 . 3.000 2.164 2.141 2.264 . 0 0 "[ . 1 . 2]" 1
1834 1 120 GLU HA 1 122 ASN H 0.000 . 5.000 4.058 3.937 4.362 . 0 0 "[ . 1 . 2]" 1
1835 1 120 GLU HA 1 124 ILE MD 0.000 . 6.000 4.480 3.634 5.535 . 0 0 "[ . 1 . 2]" 1
1836 1 120 GLU QB 1 121 GLU H 0.000 . 4.500 3.614 3.289 3.769 . 0 0 "[ . 1 . 2]" 1
1837 1 120 GLU QB 1 123 PHE QB 0.000 . 5.000 2.803 2.208 3.190 . 0 0 "[ . 1 . 2]" 1
1838 1 120 GLU HB3 1 123 PHE H 0.000 . 5.000 2.732 2.453 3.009 . 0 0 "[ . 1 . 2]" 1
1839 1 120 GLU HB2 1 123 PHE H 0.000 . 5.000 4.427 4.184 4.669 . 0 0 "[ . 1 . 2]" 1
1840 1 120 GLU QB 1 123 PHE H 0.000 . 4.500 2.708 2.437 2.974 . 0 0 "[ . 1 . 2]" 1
1841 1 120 GLU HG3 1 121 GLU H 0.000 . 5.000 3.142 2.007 3.710 . 0 0 "[ . 1 . 2]" 1
1842 1 120 GLU HG2 1 121 GLU H 0.000 . 5.000 2.912 2.290 4.287 . 0 0 "[ . 1 . 2]" 1
1843 1 120 GLU QG 1 121 GLU H 0.000 . 4.500 2.504 1.999 2.798 . 0 0 "[ . 1 . 2]" 1
1844 1 120 GLU QG 1 122 ASN H 0.000 . 4.500 2.168 1.953 2.674 . 0 0 "[ . 1 . 2]" 1
1845 1 121 GLU H 1 121 GLU HB3 0.000 . 4.000 2.808 2.494 3.229 . 0 0 "[ . 1 . 2]" 1
1846 1 121 GLU H 1 121 GLU HB2 0.000 . 4.000 2.349 2.058 3.603 . 0 0 "[ . 1 . 2]" 1
1847 1 121 GLU H 1 122 ASN QB 0.000 . 6.000 4.677 4.457 5.318 . 0 0 "[ . 1 . 2]" 1
1848 1 121 GLU H 1 122 ASN H 0.000 . 4.000 2.859 2.793 2.945 . 0 0 "[ . 1 . 2]" 1
1849 1 121 GLU H 1 123 PHE H 0.000 . 6.000 4.402 4.193 4.570 . 0 0 "[ . 1 . 2]" 1
1850 1 121 GLU HA 1 122 ASN H 0.000 . 4.500 3.529 3.504 3.558 . 0 0 "[ . 1 . 2]" 1
1851 1 121 GLU HA 1 123 PHE H 0.000 . 5.000 4.286 4.108 4.463 . 0 0 "[ . 1 . 2]" 1
1852 1 121 GLU HA 1 124 ILE H 0.000 . 4.500 3.370 3.135 3.733 . 0 0 "[ . 1 . 2]" 1
1853 1 121 GLU HA 1 124 ILE HB 0.000 . 4.000 2.714 2.338 3.318 . 0 0 "[ . 1 . 2]" 1
1854 1 121 GLU HA 1 124 ILE MG 0.000 . 6.000 4.102 3.827 4.584 . 0 0 "[ . 1 . 2]" 1
1855 1 121 GLU HA 1 124 ILE MD 0.000 . 5.000 2.844 1.858 4.556 . 0 0 "[ . 1 . 2]" 1
1856 1 121 GLU HA 1 125 LYS H 0.000 . 6.000 3.751 3.425 4.334 . 0 0 "[ . 1 . 2]" 1
1857 1 121 GLU HB3 1 122 ASN H 0.000 . 4.500 2.833 2.528 4.093 . 0 0 "[ . 1 . 2]" 1
1858 1 121 GLU HB2 1 122 ASN H 0.000 . 4.500 3.788 3.262 3.983 . 0 0 "[ . 1 . 2]" 1
1859 1 121 GLU QB 1 122 ASN H 0.000 . 4.000 2.739 2.486 3.564 . 0 0 "[ . 1 . 2]" 1
1860 1 121 GLU QB 1 122 ASN QD 0.000 . 6.000 4.363 3.289 5.565 . 0 0 "[ . 1 . 2]" 1
1861 1 121 GLU HG3 1 125 LYS QE 0.000 . 6.000 5.066 3.155 5.996 . 0 0 "[ . 1 . 2]" 1
1862 1 121 GLU HG2 1 125 LYS QE 0.000 . 6.000 4.457 2.597 5.596 . 0 0 "[ . 1 . 2]" 1
1863 1 121 GLU QG 1 125 LYS H 0.000 . 5.000 3.964 3.458 4.996 . 0 0 "[ . 1 . 2]" 1
1864 1 122 ASN H 1 122 ASN HB3 0.000 . 3.500 3.382 2.811 3.541 0.041 14 0 "[ . 1 . 2]" 1
1865 1 122 ASN H 1 122 ASN HB2 0.000 . 3.500 2.308 2.074 3.559 0.059 8 0 "[ . 1 . 2]" 1
1866 1 122 ASN H 1 122 ASN QB 0.000 . 3.000 2.208 2.052 2.792 . 0 0 "[ . 1 . 2]" 1
1867 1 122 ASN H 1 122 ASN QD 0.000 . 5.000 3.269 2.273 4.310 . 0 0 "[ . 1 . 2]" 1
1868 1 122 ASN H 1 123 PHE HB3 0.000 . 5.000 5.030 4.940 5.071 0.071 1 0 "[ . 1 . 2]" 1
1869 1 122 ASN H 1 123 PHE HB2 0.000 . 5.000 4.968 4.812 5.033 0.033 18 0 "[ . 1 . 2]" 1
1870 1 122 ASN H 1 123 PHE H 0.000 . 3.500 2.694 2.643 2.741 . 0 0 "[ . 1 . 2]" 1
1871 1 122 ASN H 1 124 ILE H 0.000 . 5.000 4.252 4.098 4.448 . 0 0 "[ . 1 . 2]" 1
1872 1 122 ASN H 1 125 LYS H 0.000 . 6.000 4.792 4.658 5.016 . 0 0 "[ . 1 . 2]" 1
1873 1 122 ASN HA 1 122 ASN HD22 0.000 . 5.000 3.933 3.414 5.061 0.061 8 0 "[ . 1 . 2]" 1
1874 1 122 ASN H 1 122 ASN HD21 0.000 . 5.000 3.431 2.290 4.761 . 0 0 "[ . 1 . 2]" 1
1875 1 122 ASN H 1 122 ASN HD22 0.000 . 5.000 4.451 3.523 4.926 . 0 0 "[ . 1 . 2]" 1
1876 1 122 ASN HA 1 123 PHE H 0.000 . 4.500 3.528 3.487 3.548 . 0 0 "[ . 1 . 2]" 1
1877 1 122 ASN HA 1 125 LYS H 0.000 . 4.000 3.837 3.608 4.004 0.004 5 0 "[ . 1 . 2]" 1
1878 1 122 ASN HA 1 125 LYS HB3 0.000 . 4.000 3.563 2.807 4.023 0.023 7 0 "[ . 1 . 2]" 1
1879 1 122 ASN HA 1 125 LYS HB2 0.000 . 4.000 3.379 2.593 3.796 . 0 0 "[ . 1 . 2]" 1
1880 1 122 ASN HB3 1 123 PHE H 0.000 . 4.500 3.268 2.842 4.229 . 0 0 "[ . 1 . 2]" 1
1881 1 122 ASN HB2 1 123 PHE H 0.000 . 4.500 2.964 2.568 3.630 . 0 0 "[ . 1 . 2]" 1
1882 1 122 ASN QB 1 123 PHE H 0.000 . 4.000 2.727 2.484 3.418 . 0 0 "[ . 1 . 2]" 1
1883 1 123 PHE H 1 123 PHE HB3 0.000 . 3.500 2.612 2.549 2.699 . 0 0 "[ . 1 . 2]" 1
1884 1 123 PHE H 1 123 PHE HB2 0.000 . 3.500 2.448 2.346 2.529 . 0 0 "[ . 1 . 2]" 1
1885 1 123 PHE H 1 123 PHE HD1 0.000 . 5.000 4.735 4.564 4.848 . 0 0 "[ . 1 . 2]" 1
1886 1 123 PHE H 1 123 PHE HD2 0.000 . 5.000 4.644 4.494 4.812 . 0 0 "[ . 1 . 2]" 1
1887 1 123 PHE H 1 124 ILE H 0.000 . 3.500 2.636 2.480 2.834 . 0 0 "[ . 1 . 2]" 1
1888 1 123 PHE H 1 125 LYS H 0.000 . 5.000 4.184 4.011 4.456 . 0 0 "[ . 1 . 2]" 1
1889 1 123 PHE HA 1 124 ILE H 0.000 . 4.500 3.558 3.544 3.573 . 0 0 "[ . 1 . 2]" 1
1890 1 123 PHE HA 1 126 SER HB3 0.000 . 4.500 3.222 2.750 4.048 . 0 0 "[ . 1 . 2]" 1
1891 1 123 PHE HA 1 126 SER HB2 0.000 . 4.500 3.461 2.891 3.920 . 0 0 "[ . 1 . 2]" 1
1892 1 123 PHE HA 1 126 SER H 0.000 . 4.000 3.603 3.435 3.772 . 0 0 "[ . 1 . 2]" 1
1893 1 123 PHE HB3 1 124 ILE H 0.000 . 4.000 2.444 2.345 2.590 . 0 0 "[ . 1 . 2]" 1
1894 1 123 PHE HB2 1 124 ILE H 0.000 . 4.000 3.720 3.617 3.789 . 0 0 "[ . 1 . 2]" 1
1895 1 123 PHE QD 1 124 ILE H 0.000 . 4.000 3.428 3.060 3.661 . 0 0 "[ . 1 . 2]" 1
1896 1 123 PHE QD 1 127 GLU H 0.000 . 5.000 4.369 3.953 4.810 . 0 0 "[ . 1 . 2]" 1
1897 1 123 PHE QE 1 124 ILE H 0.000 . 6.000 5.667 5.331 5.896 . 0 0 "[ . 1 . 2]" 1
1898 1 124 ILE H 1 124 ILE HB 0.000 . 3.500 2.658 2.618 2.733 . 0 0 "[ . 1 . 2]" 1
1899 1 124 ILE H 1 124 ILE HG13 0.000 . 4.500 2.414 1.878 3.550 . 0 0 "[ . 1 . 2]" 1
1900 1 124 ILE H 1 124 ILE HG12 0.000 . 4.500 2.945 1.903 3.554 . 0 0 "[ . 1 . 2]" 1
1901 1 124 ILE H 1 124 ILE QG 0.000 . 4.000 1.933 1.869 1.982 . 0 0 "[ . 1 . 2]" 1
1902 1 124 ILE H 1 125 LYS QB 0.000 . 5.000 4.455 4.367 4.539 . 0 0 "[ . 1 . 2]" 1
1903 1 124 ILE H 1 125 LYS H 0.000 . 4.000 2.786 2.683 2.859 . 0 0 "[ . 1 . 2]" 1
1904 1 124 ILE H 1 126 SER H 0.000 . 5.000 4.187 4.031 4.402 . 0 0 "[ . 1 . 2]" 1
1905 1 124 ILE HA 1 125 LYS H 0.000 . 5.000 3.558 3.531 3.572 . 0 0 "[ . 1 . 2]" 1
1906 1 124 ILE HA 1 126 SER H 0.000 . 5.000 4.364 4.175 4.584 . 0 0 "[ . 1 . 2]" 1
1907 1 124 ILE HA 1 127 GLU QB 0.000 . 4.000 2.792 2.560 3.230 . 0 0 "[ . 1 . 2]" 1
1908 1 124 ILE HA 1 127 GLU H 0.000 . 4.000 3.499 3.221 3.739 . 0 0 "[ . 1 . 2]" 1
1909 1 124 ILE HA 1 128 LEU H 0.000 . 6.000 4.046 3.663 4.514 . 0 0 "[ . 1 . 2]" 1
1910 1 124 ILE HB 1 125 LYS H 0.000 . 4.000 2.460 2.212 2.715 . 0 0 "[ . 1 . 2]" 1
1911 1 124 ILE MG 1 125 LYS H 0.000 . 5.000 3.476 3.235 3.647 . 0 0 "[ . 1 . 2]" 1
1912 1 124 ILE MG 1 128 LEU QD 0.000 . 4.000 2.436 1.824 3.276 . 0 0 "[ . 1 . 2]" 1
1913 1 124 ILE MG 1 128 LEU HG 0.000 . 6.000 4.639 3.066 5.895 . 0 0 "[ . 1 . 2]" 1
1914 1 125 LYS H 1 125 LYS HG3 0.000 . 4.500 3.976 3.116 4.485 . 0 0 "[ . 1 . 2]" 1
1915 1 125 LYS H 1 125 LYS HG2 0.000 . 4.500 4.382 3.822 4.533 0.033 17 0 "[ . 1 . 2]" 1
1916 1 125 LYS H 1 125 LYS HB3 0.000 . 3.500 2.990 2.481 3.440 . 0 0 "[ . 1 . 2]" 1
1917 1 125 LYS H 1 125 LYS HB2 0.000 . 3.500 2.202 2.052 2.515 . 0 0 "[ . 1 . 2]" 1
1918 1 125 LYS H 1 126 SER QB 0.000 . 5.000 4.511 4.359 4.608 . 0 0 "[ . 1 . 2]" 1
1919 1 125 LYS H 1 126 SER H 0.000 . 3.500 2.751 2.610 2.858 . 0 0 "[ . 1 . 2]" 1
1920 1 125 LYS H 1 127 GLU H 0.000 . 5.000 4.289 4.154 4.475 . 0 0 "[ . 1 . 2]" 1
1921 1 125 LYS HA 1 126 SER H 0.000 . 4.000 3.538 3.513 3.568 . 0 0 "[ . 1 . 2]" 1
1922 1 125 LYS HA 1 127 GLU H 0.000 . 6.000 4.585 4.447 4.762 . 0 0 "[ . 1 . 2]" 1
1923 1 125 LYS HA 1 128 LEU MD1 0.000 . 4.500 3.840 2.029 4.503 0.003 12 0 "[ . 1 . 2]" 1
1924 1 125 LYS HA 1 128 LEU MD2 0.000 . 4.500 3.950 1.970 4.512 0.012 1 0 "[ . 1 . 2]" 1
1925 1 125 LYS HA 1 128 LEU HB3 0.000 . 5.000 3.882 2.953 4.695 . 0 0 "[ . 1 . 2]" 1
1926 1 125 LYS HA 1 128 LEU HB2 0.000 . 5.000 3.311 2.160 5.012 0.012 19 0 "[ . 1 . 2]" 1
1927 1 125 LYS HA 1 128 LEU H 0.000 . 4.000 3.696 3.284 3.902 . 0 0 "[ . 1 . 2]" 1
1928 1 125 LYS HA 1 129 LYS H 0.000 . 5.000 4.232 3.869 4.889 . 0 0 "[ . 1 . 2]" 1
1929 1 125 LYS HB3 1 126 SER H 0.000 . 4.000 2.805 2.479 3.141 . 0 0 "[ . 1 . 2]" 1
1930 1 125 LYS HB2 1 126 SER H 0.000 . 4.000 3.504 2.983 3.867 . 0 0 "[ . 1 . 2]" 1
1931 1 125 LYS QG 1 126 SER H 0.000 . 6.000 4.204 3.455 4.480 . 0 0 "[ . 1 . 2]" 1
1932 1 126 SER H 1 126 SER HB3 0.000 . 3.000 2.740 2.537 3.021 0.021 19 0 "[ . 1 . 2]" 1
1933 1 126 SER H 1 126 SER HB2 0.000 . 3.000 2.382 2.149 2.571 . 0 0 "[ . 1 . 2]" 1
1934 1 126 SER H 1 127 GLU HB3 0.000 . 5.000 4.953 4.870 5.024 0.024 18 0 "[ . 1 . 2]" 1
1935 1 126 SER H 1 127 GLU HB2 0.000 . 5.000 4.866 4.495 5.024 0.024 1 0 "[ . 1 . 2]" 1
1936 1 126 SER H 1 127 GLU H 0.000 . 3.500 2.638 2.480 2.748 . 0 0 "[ . 1 . 2]" 1
1937 1 126 SER H 1 128 LEU H 0.000 . 5.000 4.194 3.844 4.525 . 0 0 "[ . 1 . 2]" 1
1938 1 126 SER HA 1 127 GLU H 0.000 . 4.500 3.551 3.534 3.572 . 0 0 "[ . 1 . 2]" 1
1939 1 126 SER HA 1 129 LYS HB3 0.000 . 5.000 3.140 2.550 4.305 . 0 0 "[ . 1 . 2]" 1
1940 1 126 SER HA 1 129 LYS HB2 0.000 . 5.000 3.393 2.367 4.464 . 0 0 "[ . 1 . 2]" 1
1941 1 126 SER HA 1 129 LYS QD 0.000 . 6.000 4.333 3.321 5.386 . 0 0 "[ . 1 . 2]" 1
1942 1 126 SER HA 1 129 LYS H 0.000 . 4.000 3.554 3.388 3.952 . 0 0 "[ . 1 . 2]" 1
1943 1 126 SER HB3 1 127 GLU H 0.000 . 5.000 2.559 2.428 2.778 . 0 0 "[ . 1 . 2]" 1
1944 1 126 SER HB2 1 127 GLU H 0.000 . 5.000 3.680 3.481 3.870 . 0 0 "[ . 1 . 2]" 1
1945 1 126 SER QB 1 127 GLU H 0.000 . 4.500 2.511 2.389 2.675 . 0 0 "[ . 1 . 2]" 1
1946 1 127 GLU H 1 127 GLU QB 0.000 . 3.000 2.221 2.145 2.255 . 0 0 "[ . 1 . 2]" 1
1947 1 127 GLU H 1 128 LEU H 0.000 . 3.500 2.748 2.532 2.857 . 0 0 "[ . 1 . 2]" 1
1948 1 127 GLU H 1 129 LYS H 0.000 . 5.000 4.117 3.820 4.588 . 0 0 "[ . 1 . 2]" 1
1949 1 127 GLU HA 1 128 LEU H 0.000 . 4.500 3.554 3.504 3.580 . 0 0 "[ . 1 . 2]" 1
1950 1 127 GLU HB3 1 128 LEU H 0.000 . 5.000 2.504 2.267 2.807 . 0 0 "[ . 1 . 2]" 1
1951 1 127 GLU HB2 1 128 LEU H 0.000 . 5.000 3.743 3.564 3.918 . 0 0 "[ . 1 . 2]" 1
1952 1 127 GLU QB 1 128 LEU H 0.000 . 4.000 2.467 2.247 2.747 . 0 0 "[ . 1 . 2]" 1
1953 1 128 LEU H 1 128 LEU HB3 0.000 . 4.000 3.130 2.632 3.598 . 0 0 "[ . 1 . 2]" 1
1954 1 128 LEU H 1 128 LEU HB2 0.000 . 4.000 2.318 2.061 3.608 . 0 0 "[ . 1 . 2]" 1
1955 1 128 LEU H 1 128 LEU QB 0.000 . 3.000 2.176 2.040 2.653 . 0 0 "[ . 1 . 2]" 1
1956 1 128 LEU H 1 128 LEU MD1 0.000 . 5.000 3.243 2.450 4.297 . 0 0 "[ . 1 . 2]" 1
1957 1 128 LEU H 1 128 LEU MD2 0.000 . 5.000 4.070 2.994 4.431 . 0 0 "[ . 1 . 2]" 1
1958 1 128 LEU H 1 128 LEU HG 0.000 . 4.500 3.851 1.947 4.462 . 0 0 "[ . 1 . 2]" 1
1959 1 128 LEU H 1 129 LYS H 0.000 . 3.500 2.672 2.559 2.874 . 0 0 "[ . 1 . 2]" 1
1960 1 128 LEU H 1 130 LYS H 0.000 . 5.000 4.334 4.012 4.771 . 0 0 "[ . 1 . 2]" 1
1961 1 128 LEU HA 1 129 LYS H 0.000 . 4.500 3.523 3.467 3.569 . 0 0 "[ . 1 . 2]" 1
1962 1 128 LEU HA 1 131 ALA H 0.000 . 5.000 4.027 3.351 4.785 . 0 0 "[ . 1 . 2]" 1
1963 1 128 LEU HB3 1 129 LYS H 0.000 . 4.500 3.153 2.509 4.234 . 0 0 "[ . 1 . 2]" 1
1964 1 128 LEU HB2 1 129 LYS H 0.000 . 4.500 3.369 2.525 3.993 . 0 0 "[ . 1 . 2]" 1
1965 1 128 LEU MD1 1 129 LYS H 0.000 . 6.000 4.424 2.832 5.052 . 0 0 "[ . 1 . 2]" 1
1966 1 128 LEU MD2 1 129 LYS H 0.000 . 6.000 4.462 3.488 5.042 . 0 0 "[ . 1 . 2]" 1
1967 1 129 LYS H 1 129 LYS HB3 0.000 . 3.000 2.715 2.438 3.010 0.010 14 0 "[ . 1 . 2]" 1
1968 1 129 LYS H 1 129 LYS HB2 0.000 . 3.000 2.385 2.135 2.667 . 0 0 "[ . 1 . 2]" 1
1969 1 129 LYS H 1 129 LYS HG3 0.000 . 4.500 4.437 4.281 4.541 0.041 17 0 "[ . 1 . 2]" 1
1970 1 129 LYS H 1 129 LYS HG2 0.000 . 4.500 4.412 3.997 4.570 0.070 7 0 "[ . 1 . 2]" 1
1971 1 129 LYS H 1 129 LYS HD3 0.000 . 5.000 4.875 3.948 5.014 0.014 18 0 "[ . 1 . 2]" 1
1972 1 129 LYS H 1 129 LYS HD2 0.000 . 5.000 4.792 3.517 5.016 0.016 17 0 "[ . 1 . 2]" 1
1973 1 129 LYS H 1 129 LYS QE 0.000 . 6.000 5.866 4.986 6.024 0.024 20 0 "[ . 1 . 2]" 1
1974 1 129 LYS H 1 130 LYS H 0.000 . 3.000 2.685 2.370 2.993 . 0 0 "[ . 1 . 2]" 1
1975 1 129 LYS H 1 131 ALA H 0.000 . 5.000 4.398 3.989 4.963 . 0 0 "[ . 1 . 2]" 1
1976 1 129 LYS HA 1 130 LYS H 0.000 . 4.000 3.524 3.093 3.588 . 0 0 "[ . 1 . 2]" 1
1977 1 129 LYS HB3 1 130 LYS H 0.000 . 5.000 2.652 2.208 3.989 . 0 0 "[ . 1 . 2]" 1
1978 1 129 LYS HB2 1 130 LYS H 0.000 . 5.000 3.747 3.292 4.295 . 0 0 "[ . 1 . 2]" 1
1979 1 129 LYS QB 1 130 LYS H 0.000 . 4.500 2.588 2.176 3.673 . 0 0 "[ . 1 . 2]" 1
1980 1 129 LYS QG 1 130 LYS H 0.000 . 6.000 3.973 3.270 4.890 . 0 0 "[ . 1 . 2]" 1
1981 1 130 LYS H 1 130 LYS HB3 0.000 . 3.500 3.423 2.929 3.530 0.030 8 0 "[ . 1 . 2]" 1
1982 1 130 LYS H 1 130 LYS HB2 0.000 . 3.500 2.182 2.068 2.338 . 0 0 "[ . 1 . 2]" 1
1983 1 130 LYS H 1 130 LYS HG3 0.000 . 4.500 3.626 2.958 4.268 . 0 0 "[ . 1 . 2]" 1
1984 1 130 LYS H 1 130 LYS HG2 0.000 . 4.500 3.857 2.776 4.415 . 0 0 "[ . 1 . 2]" 1
1985 1 130 LYS H 1 130 LYS QD 0.000 . 6.000 4.043 2.541 4.754 . 0 0 "[ . 1 . 2]" 1
1986 1 130 LYS H 1 131 ALA H 0.000 . 3.500 2.680 2.166 2.947 . 0 0 "[ . 1 . 2]" 1
1987 1 130 LYS H 1 132 GLY H 0.000 . 6.000 4.984 3.906 6.006 0.006 12 0 "[ . 1 . 2]" 1
1988 1 130 LYS HA 1 131 ALA H 0.000 . 4.000 3.559 3.492 3.584 . 0 0 "[ . 1 . 2]" 1
1989 1 130 LYS HA 1 132 GLY H 0.000 . 5.000 4.510 3.700 4.976 . 0 0 "[ . 1 . 2]" 1
1990 1 130 LYS HB3 1 131 ALA H 0.000 . 3.500 2.935 1.996 3.508 0.008 10 0 "[ . 1 . 2]" 1
1991 1 130 LYS HB2 1 131 ALA H 0.000 . 3.500 2.792 2.280 3.205 . 0 0 "[ . 1 . 2]" 1
1992 1 131 ALA H 1 131 ALA MB 0.000 . 3.000 2.675 2.228 2.892 . 0 0 "[ . 1 . 2]" 1
1993 1 131 ALA H 1 132 GLY H 0.000 . 4.500 3.009 2.690 4.125 . 0 0 "[ . 1 . 2]" 1
1994 1 131 ALA H 1 133 GLY H 0.000 . 5.000 4.815 4.350 5.057 0.057 17 0 "[ . 1 . 2]" 1
1995 1 131 ALA HA 1 132 GLY H 0.000 . 3.000 2.713 2.253 2.921 . 0 0 "[ . 1 . 2]" 1
1996 1 131 ALA HA 1 133 GLY H 0.000 . 5.000 4.381 3.206 5.046 0.046 9 0 "[ . 1 . 2]" 1
1997 1 131 ALA MB 1 132 GLY H 0.000 . 4.000 3.686 3.590 3.734 . 0 0 "[ . 1 . 2]" 1
1998 1 131 ALA MB 1 133 GLY H 0.000 . 6.000 4.612 3.325 5.455 . 0 0 "[ . 1 . 2]" 1
1999 1 132 GLY QA 1 133 GLY H 0.000 . 3.500 2.663 2.482 2.866 . 0 0 "[ . 1 . 2]" 1
2000 1 133 GLY QA 1 134 ALA H 0.000 . 3.000 2.279 2.114 2.872 . 0 0 "[ . 1 . 2]" 1
2001 1 133 GLY QA 1 135 ASN H 0.000 . 6.000 3.530 3.031 4.112 . 0 0 "[ . 1 . 2]" 1
2002 1 133 GLY H 1 135 ASN HD21 0.000 . 6.000 5.435 3.272 6.011 0.011 16 0 "[ . 1 . 2]" 1
2003 1 133 GLY H 1 135 ASN HD22 0.000 . 6.000 5.194 2.419 6.038 0.038 4 0 "[ . 1 . 2]" 1
2004 1 134 ALA H 1 134 ALA MB 0.000 . 3.500 2.717 2.256 2.997 . 0 0 "[ . 1 . 2]" 1
2005 1 134 ALA H 1 136 TYR H 0.000 . 3.500 3.450 2.948 3.605 0.105 9 0 "[ . 1 . 2]" 1
2006 1 134 ALA HA 1 135 ASN H 0.000 . 3.000 2.975 2.806 3.051 0.051 4 0 "[ . 1 . 2]" 1
2007 1 134 ALA MB 1 135 ASN H 0.000 . 4.000 3.612 3.542 3.701 . 0 0 "[ . 1 . 2]" 1
2008 1 134 ALA MB 1 136 TYR H 0.000 . 6.000 4.416 3.229 5.040 . 0 0 "[ . 1 . 2]" 1
2009 1 135 ASN H 1 135 ASN HB3 0.000 . 4.000 3.770 3.244 4.028 0.028 15 0 "[ . 1 . 2]" 1
2010 1 135 ASN H 1 135 ASN HB2 0.000 . 4.000 3.627 2.902 3.986 . 0 0 "[ . 1 . 2]" 1
2011 1 135 ASN H 1 135 ASN HD21 0.000 . 6.000 3.280 2.659 5.032 . 0 0 "[ . 1 . 2]" 1
2012 1 135 ASN H 1 135 ASN HD22 0.000 . 6.000 3.948 3.436 4.875 . 0 0 "[ . 1 . 2]" 1
2013 1 135 ASN H 1 136 TYR QB 0.000 . 6.000 3.880 3.346 4.534 . 0 0 "[ . 1 . 2]" 1
2014 1 135 ASN H 1 136 TYR H 0.000 . 4.500 2.315 1.898 2.911 . 0 0 "[ . 1 . 2]" 1
2015 1 135 ASN HA 1 136 TYR H 0.000 . 3.000 2.908 2.698 3.093 0.093 9 0 "[ . 1 . 2]" 1
2016 1 135 ASN HA 1 137 ASP H 0.000 . 4.500 3.895 3.289 4.520 0.020 13 0 "[ . 1 . 2]" 1
2017 1 135 ASN HB3 1 136 TYR H 0.000 . 5.000 4.529 4.379 4.682 . 0 0 "[ . 1 . 2]" 1
2018 1 135 ASN HB2 1 136 TYR H 0.000 . 5.000 4.316 3.964 4.487 . 0 0 "[ . 1 . 2]" 1
2019 1 136 TYR H 1 136 TYR HB3 0.000 . 3.000 2.868 2.297 3.023 0.023 4 0 "[ . 1 . 2]" 1
2020 1 136 TYR H 1 136 TYR HB2 0.000 . 3.000 2.296 2.141 2.912 . 0 0 "[ . 1 . 2]" 1
2021 1 136 TYR H 1 136 TYR QD 0.000 . 4.000 4.015 3.962 4.078 0.078 17 0 "[ . 1 . 2]" 1
2022 1 136 TYR H 1 137 ASP H 0.000 . 3.500 2.768 2.393 3.526 0.026 4 0 "[ . 1 . 2]" 1
2023 1 136 TYR HB3 1 137 ASP H 0.000 . 4.500 2.734 2.097 4.300 . 0 0 "[ . 1 . 2]" 1
2024 1 136 TYR HB2 1 137 ASP H 0.000 . 4.500 3.678 3.194 4.585 0.085 4 0 "[ . 1 . 2]" 1
2025 1 136 TYR QD 1 137 ASP H 0.000 . 4.500 3.952 2.889 4.488 . 0 0 "[ . 1 . 2]" 1
2026 1 136 TYR QD 1 138 ALA H 0.000 . 6.000 5.835 5.428 6.025 0.025 15 0 "[ . 1 . 2]" 1
2027 1 137 ASP H 1 137 ASP HB3 0.000 . 3.000 2.715 2.418 3.024 0.024 18 0 "[ . 1 . 2]" 1
2028 1 137 ASP H 1 137 ASP HB2 0.000 . 3.000 2.600 2.148 3.029 0.029 17 0 "[ . 1 . 2]" 1
2029 1 137 ASP HA 1 138 ALA H 0.000 . 3.000 2.326 2.204 2.789 . 0 0 "[ . 1 . 2]" 1
2030 1 137 ASP HA 1 139 GLN H 0.000 . 4.500 4.100 3.276 4.493 . 0 0 "[ . 1 . 2]" 1
2031 1 137 ASP HB3 1 138 ALA H 0.000 . 4.000 3.554 2.436 4.023 0.023 13 0 "[ . 1 . 2]" 1
2032 1 137 ASP HB2 1 138 ALA H 0.000 . 4.000 3.974 3.617 4.069 0.069 6 0 "[ . 1 . 2]" 1
2033 1 138 ALA H 1 138 ALA HA 0.000 . 3.000 2.833 2.269 2.951 . 0 0 "[ . 1 . 2]" 1
2034 1 138 ALA H 1 138 ALA MB 0.000 . 3.500 2.654 2.247 2.937 . 0 0 "[ . 1 . 2]" 1
2035 1 138 ALA H 1 139 GLN H 0.000 . 3.500 2.219 1.885 2.640 . 0 0 "[ . 1 . 2]" 1
2036 1 138 ALA H 1 139 GLN QG 0.000 . 6.000 5.074 4.166 5.825 . 0 0 "[ . 1 . 2]" 1
2037 1 138 ALA H 1 139 GLN QE 0.000 . 6.000 5.514 4.006 6.008 0.008 12 0 "[ . 1 . 2]" 1
2038 1 138 ALA H 1 140 THR H 0.000 . 4.000 3.350 2.341 4.065 0.065 12 0 "[ . 1 . 2]" 1
2039 1 138 ALA H 1 141 GLU QB 0.000 . 6.000 5.400 4.055 6.028 0.028 4 0 "[ . 1 . 2]" 1
2040 1 138 ALA MB 1 139 GLN H 0.000 . 4.000 2.792 2.083 3.673 . 0 0 "[ . 1 . 2]" 1
2041 1 139 GLN H 1 139 GLN QB 0.000 . 3.000 2.506 2.140 3.041 0.041 3 0 "[ . 1 . 2]" 1
2042 1 139 GLN H 1 139 GLN QG 0.000 . 4.000 3.584 2.914 4.025 0.025 9 0 "[ . 1 . 2]" 1
2043 1 139 GLN H 1 140 THR H 0.000 . 3.500 2.336 1.985 2.647 . 0 0 "[ . 1 . 2]" 1
2044 1 139 GLN HA 1 139 GLN HE21 0.000 . 6.000 4.087 2.074 5.057 . 0 0 "[ . 1 . 2]" 1
2045 1 139 GLN HA 1 139 GLN HE22 0.000 . 6.000 5.223 3.547 5.993 . 0 0 "[ . 1 . 2]" 1
2046 1 139 GLN HA 1 140 THR H 0.000 . 3.000 3.081 3.057 3.123 0.123 14 0 "[ . 1 . 2]" 1
2047 1 139 GLN QB 1 140 THR H 0.000 . 3.500 3.594 3.547 3.625 0.125 11 0 "[ . 1 . 2]" 1
2048 1 139 GLN QG 1 140 THR H 0.000 . 5.000 4.653 4.526 4.897 . 0 0 "[ . 1 . 2]" 1
2049 1 140 THR H 1 140 THR MG 0.000 . 4.000 3.193 1.982 4.009 0.009 13 0 "[ . 1 . 2]" 1
2050 1 140 THR MG 1 141 GLU H 0.000 . 5.000 3.712 2.008 4.416 . 0 0 "[ . 1 . 2]" 1
2051 1 141 GLU H 1 141 GLU QB 0.000 . 3.000 2.542 2.064 2.959 . 0 0 "[ . 1 . 2]" 1
2052 1 141 GLU H 1 141 GLU QG 0.000 . 3.500 2.584 1.986 3.513 0.013 16 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 124
_Distance_constraint_stats_list.Viol_count 161
_Distance_constraint_stats_list.Viol_total 122.221
_Distance_constraint_stats_list.Viol_max 0.125
_Distance_constraint_stats_list.Viol_rms 0.0130
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0025
_Distance_constraint_stats_list.Viol_average_violations_only 0.0380
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ALA 0.012 0.011 13 0 "[ . 1 . 2]"
1 9 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 ALA 0.036 0.035 8 0 "[ . 1 . 2]"
1 12 ALA 0.012 0.011 13 0 "[ . 1 . 2]"
1 13 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 LEU 0.036 0.035 8 0 "[ . 1 . 2]"
1 16 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 TRP 0.032 0.016 7 0 "[ . 1 . 2]"
1 26 VAL 0.000 0.000 20 0 "[ . 1 . 2]"
1 27 THR 2.644 0.125 16 0 "[ . 1 . 2]"
1 28 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 ASP 0.348 0.051 6 0 "[ . 1 . 2]"
1 34 THR 0.348 0.051 6 0 "[ . 1 . 2]"
1 35 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 GLY 2.644 0.125 16 0 "[ . 1 . 2]"
1 41 GLY 0.032 0.016 7 0 "[ . 1 . 2]"
1 43 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 GLN 0.012 0.012 2 0 "[ . 1 . 2]"
1 46 HIS 0.048 0.036 13 0 "[ . 1 . 2]"
1 47 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 GLN 0.012 0.012 2 0 "[ . 1 . 2]"
1 50 GLN 0.048 0.036 13 0 "[ . 1 . 2]"
1 51 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 VAL 1.574 0.121 15 0 "[ . 1 . 2]"
1 57 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 PHE 0.000 0.000 20 0 "[ . 1 . 2]"
1 61 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 GLY 2.172 0.121 15 0 "[ . 1 . 2]"
1 85 VAL 0.598 0.078 4 0 "[ . 1 . 2]"
1 88 LEU 0.041 0.018 20 0 "[ . 1 . 2]"
1 91 ALA 0.259 0.040 3 0 "[ . 1 . 2]"
1 92 LYS 0.041 0.018 20 0 "[ . 1 . 2]"
1 93 THR 0.011 0.011 5 0 "[ . 1 . 2]"
1 95 THR 0.312 0.040 3 0 "[ . 1 . 2]"
1 96 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 LYS 0.070 0.037 10 0 "[ . 1 . 2]"
1 98 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 LEU 0.213 0.040 4 0 "[ . 1 . 2]"
1 100 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 LYS 0.059 0.037 10 0 "[ . 1 . 2]"
1 102 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 VAL 0.160 0.040 4 0 "[ . 1 . 2]"
1 104 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 ASP 0.106 0.020 4 0 "[ . 1 . 2]"
1 116 ARG 0.119 0.022 20 0 "[ . 1 . 2]"
1 118 GLU 0.106 0.020 4 0 "[ . 1 . 2]"
1 119 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 GLU 0.119 0.022 20 0 "[ . 1 . 2]"
1 123 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 GLU 0.000 0.000 . 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 5 ASP H 1 35 ILE O 2.000 . 2.700 2.193 1.920 2.390 . 0 0 "[ . 1 . 2]" 2
2 1 5 ASP N 1 35 ILE O 3.000 2.400 3.700 3.120 2.874 3.345 . 0 0 "[ . 1 . 2]" 2
3 1 5 ASP O 1 9 CYS H 1.800 . 2.400 2.067 1.822 2.358 . 0 0 "[ . 1 . 2]" 2
4 1 5 ASP O 1 9 CYS N 2.700 2.400 3.300 3.025 2.782 3.287 . 0 0 "[ . 1 . 2]" 2
5 1 6 LYS O 1 10 ARG H 1.800 . 2.400 1.904 1.720 2.192 . 0 0 "[ . 1 . 2]" 2
6 1 6 LYS O 1 10 ARG N 2.700 2.400 3.300 2.814 2.680 3.042 . 0 0 "[ . 1 . 2]" 2
7 1 7 GLU O 1 11 ALA H 1.800 . 2.400 1.994 1.844 2.167 . 0 0 "[ . 1 . 2]" 2
8 1 7 GLU O 1 11 ALA N 2.700 2.400 3.300 2.912 2.757 3.120 . 0 0 "[ . 1 . 2]" 2
9 1 8 ALA O 1 12 ALA H 1.800 . 2.400 2.134 2.007 2.353 . 0 0 "[ . 1 . 2]" 2
10 1 8 ALA O 1 12 ALA N 2.700 2.400 3.300 3.092 2.955 3.311 0.011 13 0 "[ . 1 . 2]" 2
11 1 9 CYS O 1 13 TYR H 1.800 . 2.400 2.133 1.844 2.289 . 0 0 "[ . 1 . 2]" 2
12 1 9 CYS O 1 13 TYR N 2.700 2.400 3.300 3.044 2.798 3.240 . 0 0 "[ . 1 . 2]" 2
13 1 10 ARG O 1 14 ASN H 1.800 . 2.400 2.025 1.788 2.312 . 0 0 "[ . 1 . 2]" 2
14 1 10 ARG O 1 14 ASN N 2.700 2.400 3.300 2.973 2.743 3.264 . 0 0 "[ . 1 . 2]" 2
15 1 11 ALA O 1 15 LEU H 1.800 . 2.400 2.237 1.865 2.435 0.035 8 0 "[ . 1 . 2]" 2
16 1 11 ALA O 1 15 LEU N 2.700 2.400 3.300 3.112 2.754 3.301 0.001 1 0 "[ . 1 . 2]" 2
17 1 12 ALA O 1 16 VAL H 1.800 . 2.400 1.936 1.732 2.223 . 0 0 "[ . 1 . 2]" 2
18 1 12 ALA O 1 16 VAL N 2.700 2.400 3.300 2.885 2.695 3.166 . 0 0 "[ . 1 . 2]" 2
19 1 13 TYR O 1 17 ARG H 1.800 . 2.400 2.083 1.841 2.368 . 0 0 "[ . 1 . 2]" 2
20 1 13 TYR O 1 17 ARG N 2.700 2.400 3.300 2.949 2.686 3.280 . 0 0 "[ . 1 . 2]" 2
21 1 25 TRP H 1 41 GLY O 2.000 . 2.700 2.437 2.193 2.626 . 0 0 "[ . 1 . 2]" 2
22 1 25 TRP N 1 41 GLY O 3.000 2.400 3.700 3.385 3.159 3.550 . 0 0 "[ . 1 . 2]" 2
23 1 25 TRP HE1 1 43 GLU O 2.000 . 2.700 1.910 1.740 2.055 . 0 0 "[ . 1 . 2]" 2
24 1 25 TRP NE1 1 43 GLU O 3.000 2.400 3.700 2.852 2.707 3.008 . 0 0 "[ . 1 . 2]" 2
25 1 26 VAL H 1 60 PHE O 2.000 . 2.700 1.979 1.685 2.422 . 0 0 "[ . 1 . 2]" 2
26 1 26 VAL N 1 60 PHE O 3.000 2.400 3.700 2.874 2.610 3.349 . 0 0 "[ . 1 . 2]" 2
27 1 27 THR H 1 38 GLY O 2.000 . 2.700 2.804 2.787 2.825 0.125 16 0 "[ . 1 . 2]" 2
28 1 27 THR N 1 38 GLY O 3.000 2.400 3.700 3.728 3.708 3.751 0.051 11 0 "[ . 1 . 2]" 2
29 1 28 PHE H 1 58 PHE O 2.000 . 2.700 2.274 1.952 2.538 . 0 0 "[ . 1 . 2]" 2
30 1 28 PHE N 1 58 PHE O 3.000 2.400 3.700 3.013 2.592 3.298 . 0 0 "[ . 1 . 2]" 2
31 1 29 LYS H 1 36 VAL O 2.000 . 2.700 2.159 1.979 2.328 . 0 0 "[ . 1 . 2]" 2
32 1 29 LYS N 1 36 VAL O 3.000 2.400 3.700 2.976 2.742 3.202 . 0 0 "[ . 1 . 2]" 2
33 1 31 ASP H 1 34 THR O 2.000 . 2.700 2.001 1.723 2.305 . 0 0 "[ . 1 . 2]" 2
34 1 31 ASP N 1 34 THR O 3.000 2.400 3.700 2.834 2.660 3.091 . 0 0 "[ . 1 . 2]" 2
35 1 31 ASP O 1 34 THR H 2.000 . 2.700 2.706 2.532 2.751 0.051 6 0 "[ . 1 . 2]" 2
36 1 31 ASP O 1 34 THR N 3.000 2.400 3.700 3.477 3.372 3.701 0.001 2 0 "[ . 1 . 2]" 2
37 1 3 LYS O 1 35 ILE H 2.000 . 2.700 1.995 1.724 2.363 . 0 0 "[ . 1 . 2]" 2
38 1 3 LYS O 1 35 ILE N 3.000 2.400 3.700 2.892 2.672 3.152 . 0 0 "[ . 1 . 2]" 2
39 1 29 LYS O 1 36 VAL H 2.000 . 2.700 1.972 1.711 2.396 . 0 0 "[ . 1 . 2]" 2
40 1 29 LYS O 1 36 VAL N 3.000 2.400 3.700 2.910 2.688 3.245 . 0 0 "[ . 1 . 2]" 2
41 1 27 THR O 1 38 GLY H 2.000 . 2.700 1.794 1.621 2.325 . 0 0 "[ . 1 . 2]" 2
42 1 27 THR O 1 38 GLY N 3.000 2.400 3.700 2.531 2.493 2.589 . 0 0 "[ . 1 . 2]" 2
43 1 25 TRP O 1 41 GLY H 2.000 . 2.700 2.660 2.488 2.716 0.016 7 0 "[ . 1 . 2]" 2
44 1 25 TRP O 1 41 GLY N 3.000 2.400 3.700 3.361 3.265 3.517 . 0 0 "[ . 1 . 2]" 2
45 1 44 TYR O 1 47 PHE H 1.800 . 2.400 2.038 1.923 2.184 . 0 0 "[ . 1 . 2]" 2
46 1 44 TYR O 1 47 PHE N 2.700 2.400 3.300 2.705 2.652 2.750 . 0 0 "[ . 1 . 2]" 2
47 1 44 TYR O 1 48 ILE H 1.800 . 2.400 2.143 2.008 2.360 . 0 0 "[ . 1 . 2]" 2
48 1 44 TYR O 1 48 ILE N 2.700 2.400 3.300 3.083 2.965 3.275 . 0 0 "[ . 1 . 2]" 2
49 1 45 GLN O 1 49 GLN H 1.800 . 2.400 2.128 1.990 2.412 0.012 2 0 "[ . 1 . 2]" 2
50 1 45 GLN O 1 49 GLN N 2.700 2.400 3.300 3.035 2.884 3.171 . 0 0 "[ . 1 . 2]" 2
51 1 46 HIS O 1 50 GLN H 1.800 . 2.400 2.134 1.818 2.403 0.003 13 0 "[ . 1 . 2]" 2
52 1 46 HIS O 1 50 GLN N 2.700 2.400 3.300 3.027 2.744 3.336 0.036 13 0 "[ . 1 . 2]" 2
53 1 47 PHE O 1 51 CYS H 1.800 . 2.400 1.982 1.727 2.275 . 0 0 "[ . 1 . 2]" 2
54 1 47 PHE O 1 51 CYS N 2.700 2.400 3.300 2.819 2.661 3.025 . 0 0 "[ . 1 . 2]" 2
55 1 55 VAL H 1 82 GLY O 2.000 . 2.700 2.777 2.726 2.821 0.121 15 0 "[ . 1 . 2]" 2
56 1 55 VAL N 1 82 GLY O 3.000 2.400 3.700 3.569 3.382 3.731 0.031 17 0 "[ . 1 . 2]" 2
57 1 57 LEU H 1 80 TRP O 2.000 . 2.700 2.097 1.791 2.436 . 0 0 "[ . 1 . 2]" 2
58 1 57 LEU N 1 80 TRP O 3.000 2.400 3.700 2.986 2.729 3.396 . 0 0 "[ . 1 . 2]" 2
59 1 28 PHE O 1 58 PHE H 2.000 . 2.700 1.962 1.687 2.478 . 0 0 "[ . 1 . 2]" 2
60 1 28 PHE O 1 58 PHE N 3.000 2.400 3.700 2.854 2.620 3.397 . 0 0 "[ . 1 . 2]" 2
61 1 59 ALA H 1 78 ILE O 2.000 . 2.700 2.253 1.781 2.643 . 0 0 "[ . 1 . 2]" 2
62 1 59 ALA N 1 78 ILE O 3.000 2.400 3.700 2.835 2.585 3.449 . 0 0 "[ . 1 . 2]" 2
63 1 26 VAL O 1 60 PHE H 2.000 . 2.700 2.172 1.827 2.700 0.000 20 0 "[ . 1 . 2]" 2
64 1 26 VAL O 1 60 PHE N 3.000 2.400 3.700 3.018 2.746 3.446 . 0 0 "[ . 1 . 2]" 2
65 1 61 VAL H 1 76 ALA O 2.000 . 2.700 2.256 1.993 2.584 . 0 0 "[ . 1 . 2]" 2
66 1 61 VAL N 1 76 ALA O 3.000 2.400 3.700 3.201 2.884 3.558 . 0 0 "[ . 1 . 2]" 2
67 1 24 ILE O 1 62 ARG H 2.000 . 2.700 2.172 1.794 2.504 . 0 0 "[ . 1 . 2]" 2
68 1 24 ILE O 1 62 ARG N 3.000 2.400 3.700 3.112 2.761 3.456 . 0 0 "[ . 1 . 2]" 2
69 1 63 PHE H 1 74 LYS O 2.000 . 2.700 2.111 1.761 2.685 . 0 0 "[ . 1 . 2]" 2
70 1 63 PHE N 1 74 LYS O 3.000 2.400 3.700 2.975 2.714 3.305 . 0 0 "[ . 1 . 2]" 2
71 1 61 VAL O 1 76 ALA H 2.000 . 2.700 2.390 1.891 2.677 . 0 0 "[ . 1 . 2]" 2
72 1 61 VAL O 1 76 ALA N 3.000 2.400 3.700 3.181 2.773 3.639 . 0 0 "[ . 1 . 2]" 2
73 1 77 LEU H 1 109 LYS O 2.000 . 2.700 2.037 1.769 2.440 . 0 0 "[ . 1 . 2]" 2
74 1 77 LEU N 1 109 LYS O 3.000 2.400 3.700 2.952 2.732 3.345 . 0 0 "[ . 1 . 2]" 2
75 1 59 ALA O 1 78 ILE H 2.000 . 2.700 2.360 1.834 2.666 . 0 0 "[ . 1 . 2]" 2
76 1 59 ALA O 1 78 ILE N 3.000 2.400 3.700 3.131 2.681 3.396 . 0 0 "[ . 1 . 2]" 2
77 1 79 THR H 1 111 PHE O 2.000 . 2.700 2.155 1.683 2.593 . 0 0 "[ . 1 . 2]" 2
78 1 79 THR N 1 111 PHE O 3.000 2.400 3.700 3.084 2.652 3.561 . 0 0 "[ . 1 . 2]" 2
79 1 57 LEU O 1 80 TRP H 2.000 . 2.700 2.056 1.779 2.456 . 0 0 "[ . 1 . 2]" 2
80 1 57 LEU O 1 80 TRP N 3.000 2.400 3.700 2.880 2.622 3.310 . 0 0 "[ . 1 . 2]" 2
81 1 52 THR O 1 80 TRP HE1 2.000 . 2.700 1.862 1.652 2.438 . 0 0 "[ . 1 . 2]" 2
82 1 52 THR O 1 80 TRP NE1 3.000 2.400 3.700 2.764 2.623 3.373 . 0 0 "[ . 1 . 2]" 2
83 1 81 ILE H 1 113 ILE O 2.000 . 2.700 2.485 2.120 2.653 . 0 0 "[ . 1 . 2]" 2
84 1 81 ILE N 1 113 ILE O 3.000 2.400 3.700 3.366 2.957 3.576 . 0 0 "[ . 1 . 2]" 2
85 1 55 VAL O 1 82 GLY H 2.000 . 2.700 1.848 1.622 2.295 . 0 0 "[ . 1 . 2]" 2
86 1 55 VAL O 1 82 GLY N 3.000 2.400 3.700 2.612 2.461 2.901 . 0 0 "[ . 1 . 2]" 2
87 1 82 GLY O 1 85 VAL H 2.000 . 2.700 2.501 1.643 2.778 0.078 4 0 "[ . 1 . 2]" 2
88 1 82 GLY O 1 85 VAL N 3.000 2.400 3.700 2.916 2.565 3.067 . 0 0 "[ . 1 . 2]" 2
89 1 88 LEU O 1 92 LYS H 1.800 . 2.400 2.232 1.832 2.408 0.008 2 0 "[ . 1 . 2]" 2
90 1 88 LEU O 1 92 LYS N 2.700 2.400 3.300 3.132 2.771 3.318 0.018 20 0 "[ . 1 . 2]" 2
91 1 91 ALA O 1 95 THR H 1.800 . 2.400 2.320 2.094 2.409 0.009 4 0 "[ . 1 . 2]" 2
92 1 91 ALA O 1 95 THR N 2.700 2.400 3.300 3.270 3.067 3.340 0.040 3 0 "[ . 1 . 2]" 2
93 1 92 LYS O 1 96 ASP H 1.800 . 2.400 1.878 1.698 2.201 . 0 0 "[ . 1 . 2]" 2
94 1 92 LYS O 1 96 ASP N 2.700 2.400 3.300 2.815 2.658 3.135 . 0 0 "[ . 1 . 2]" 2
95 1 93 THR O 1 97 LYS H 1.800 . 2.400 2.039 1.814 2.411 0.011 5 0 "[ . 1 . 2]" 2
96 1 93 THR O 1 97 LYS N 2.700 2.400 3.300 2.923 2.684 3.278 . 0 0 "[ . 1 . 2]" 2
97 1 95 THR O 1 99 LEU H 1.800 . 2.400 2.350 2.261 2.403 0.003 15 0 "[ . 1 . 2]" 2
98 1 95 THR O 1 99 LEU N 2.700 2.400 3.300 3.265 3.186 3.319 0.019 19 0 "[ . 1 . 2]" 2
99 1 96 ASP O 1 100 VAL H 1.800 . 2.400 2.019 1.781 2.289 . 0 0 "[ . 1 . 2]" 2
100 1 96 ASP O 1 100 VAL N 2.700 2.400 3.300 2.991 2.756 3.260 . 0 0 "[ . 1 . 2]" 2
101 1 97 LYS O 1 101 LYS H 1.800 . 2.400 2.244 2.085 2.437 0.037 10 0 "[ . 1 . 2]" 2
102 1 97 LYS O 1 101 LYS N 2.700 2.400 3.300 3.085 2.924 3.313 0.013 14 0 "[ . 1 . 2]" 2
103 1 98 THR O 1 102 GLU H 1.800 . 2.400 2.173 1.995 2.344 . 0 0 "[ . 1 . 2]" 2
104 1 98 THR O 1 102 GLU N 2.700 2.400 3.300 3.060 2.881 3.255 . 0 0 "[ . 1 . 2]" 2
105 1 99 LEU O 1 103 VAL H 1.800 . 2.400 2.329 2.116 2.422 0.022 20 0 "[ . 1 . 2]" 2
106 1 99 LEU O 1 103 VAL N 2.700 2.400 3.300 3.249 3.083 3.340 0.040 4 0 "[ . 1 . 2]" 2
107 1 100 VAL O 1 104 VAL H 1.800 . 2.400 1.877 1.671 2.208 . 0 0 "[ . 1 . 2]" 2
108 1 100 VAL O 1 104 VAL N 2.700 2.400 3.300 2.790 2.598 3.146 . 0 0 "[ . 1 . 2]" 2
109 1 75 PHE O 1 109 LYS H 2.000 . 2.700 2.466 2.165 2.668 . 0 0 "[ . 1 . 2]" 2
110 1 75 PHE O 1 109 LYS N 3.000 2.400 3.700 3.361 3.112 3.583 . 0 0 "[ . 1 . 2]" 2
111 1 77 LEU O 1 111 PHE H 2.000 . 2.700 2.317 1.938 2.630 . 0 0 "[ . 1 . 2]" 2
112 1 77 LEU O 1 111 PHE N 3.000 2.400 3.700 3.197 2.878 3.478 . 0 0 "[ . 1 . 2]" 2
113 1 79 THR O 1 113 ILE H 2.000 . 2.700 1.946 1.655 2.484 . 0 0 "[ . 1 . 2]" 2
114 1 79 THR O 1 113 ILE N 3.000 2.400 3.700 2.893 2.620 3.447 . 0 0 "[ . 1 . 2]" 2
115 1 115 ASP OD1 1 118 GLU H 1.800 . 2.400 2.227 1.878 2.420 0.020 4 0 "[ . 1 . 2]" 2
116 1 115 ASP OD1 1 118 GLU N 2.700 2.400 3.300 3.062 2.687 3.284 . 0 0 "[ . 1 . 2]" 2
117 1 115 ASP O 1 119 LEU H 1.800 . 2.400 2.121 1.799 2.363 . 0 0 "[ . 1 . 2]" 2
118 1 115 ASP O 1 119 LEU N 2.700 2.400 3.300 2.968 2.669 3.267 . 0 0 "[ . 1 . 2]" 2
119 1 116 ARG O 1 120 GLU H 1.800 . 2.400 2.319 2.021 2.422 0.022 20 0 "[ . 1 . 2]" 2
120 1 116 ARG O 1 120 GLU N 2.700 2.400 3.300 3.025 2.753 3.202 . 0 0 "[ . 1 . 2]" 2
121 1 120 GLU O 1 124 ILE H 1.800 . 2.400 2.125 1.921 2.322 . 0 0 "[ . 1 . 2]" 2
122 1 120 GLU O 1 124 ILE N 2.700 2.400 3.300 3.085 2.894 3.279 . 0 0 "[ . 1 . 2]" 2
123 1 123 PHE O 1 127 GLU H 1.800 . 2.400 2.031 1.788 2.327 . 0 0 "[ . 1 . 2]" 2
124 1 123 PHE O 1 127 GLU N 2.700 2.400 3.300 2.975 2.735 3.276 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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