Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
441528 | 2kay RC | 16034 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kay
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 2370
_Distance_constraint_stats_list.Viol_count 4438
_Distance_constraint_stats_list.Viol_total 4062.000
_Distance_constraint_stats_list.Viol_max 0.188
_Distance_constraint_stats_list.Viol_rms 0.0098
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0018
_Distance_constraint_stats_list.Viol_average_violations_only 0.0295
_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 MET 1.159 0.121 12 0 "[ . 1 . 2 . 3 ]"
1 2 GLU 1.012 0.102 7 0 "[ . 1 . 2 . 3 ]"
1 3 THR 1.258 0.121 12 0 "[ . 1 . 2 . 3 ]"
1 4 PRO 0.141 0.034 28 0 "[ . 1 . 2 . 3 ]"
1 5 LEU 0.144 0.031 16 0 "[ . 1 . 2 . 3 ]"
1 6 GLU 1.522 0.102 7 0 "[ . 1 . 2 . 3 ]"
1 7 LYS 1.367 0.162 22 0 "[ . 1 . 2 . 3 ]"
1 8 ALA 1.536 0.162 22 0 "[ . 1 . 2 . 3 ]"
1 9 LEU 0.349 0.065 4 0 "[ . 1 . 2 . 3 ]"
1 10 THR 0.383 0.061 24 0 "[ . 1 . 2 . 3 ]"
1 11 THR 0.520 0.043 28 0 "[ . 1 . 2 . 3 ]"
1 12 MET 1.609 0.101 10 0 "[ . 1 . 2 . 3 ]"
1 13 VAL 0.192 0.036 3 0 "[ . 1 . 2 . 3 ]"
1 14 THR 4.222 0.137 14 0 "[ . 1 . 2 . 3 ]"
1 15 THR 2.731 0.076 18 0 "[ . 1 . 2 . 3 ]"
1 16 PHE 3.968 0.137 14 0 "[ . 1 . 2 . 3 ]"
1 17 HIS 0.644 0.122 30 0 "[ . 1 . 2 . 3 ]"
1 18 LYS 0.366 0.041 13 0 "[ . 1 . 2 . 3 ]"
1 19 TYR 0.852 0.072 12 0 "[ . 1 . 2 . 3 ]"
1 20 SER 0.472 0.063 9 0 "[ . 1 . 2 . 3 ]"
1 21 GLY 0.045 0.037 6 0 "[ . 1 . 2 . 3 ]"
1 22 ARG 0.651 0.129 20 0 "[ . 1 . 2 . 3 ]"
1 23 GLU 0.339 0.129 20 0 "[ . 1 . 2 . 3 ]"
1 26 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 27 LEU 0.471 0.076 8 0 "[ . 1 . 2 . 3 ]"
1 28 THR 0.675 0.063 25 0 "[ . 1 . 2 . 3 ]"
1 29 LEU 1.090 0.123 24 0 "[ . 1 . 2 . 3 ]"
1 30 SER 0.342 0.123 24 0 "[ . 1 . 2 . 3 ]"
1 31 ARG 0.841 0.105 15 0 "[ . 1 . 2 . 3 ]"
1 32 LYS 4.143 0.119 15 0 "[ . 1 . 2 . 3 ]"
1 33 GLU 0.509 0.059 17 0 "[ . 1 . 2 . 3 ]"
1 34 LEU 1.184 0.119 15 0 "[ . 1 . 2 . 3 ]"
1 35 LYS 3.484 0.126 29 0 "[ . 1 . 2 . 3 ]"
1 36 GLU 2.660 0.135 6 0 "[ . 1 . 2 . 3 ]"
1 37 LEU 2.252 0.093 5 0 "[ . 1 . 2 . 3 ]"
1 38 ILE 3.723 0.118 9 0 "[ . 1 . 2 . 3 ]"
1 39 LYS 3.609 0.128 19 0 "[ . 1 . 2 . 3 ]"
1 40 LYS 2.768 0.135 6 0 "[ . 1 . 2 . 3 ]"
1 41 GLU 0.580 0.058 14 0 "[ . 1 . 2 . 3 ]"
1 42 LEU 0.921 0.065 31 0 "[ . 1 . 2 . 3 ]"
1 43 CYS 0.029 0.012 12 0 "[ . 1 . 2 . 3 ]"
1 44 LEU 1.065 0.055 13 0 "[ . 1 . 2 . 3 ]"
1 45 GLY 0.377 0.055 13 0 "[ . 1 . 2 . 3 ]"
1 46 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 47 MET 2.617 0.161 9 0 "[ . 1 . 2 . 3 ]"
1 48 LYS 1.546 0.161 9 0 "[ . 1 . 2 . 3 ]"
1 49 GLU 0.119 0.040 4 0 "[ . 1 . 2 . 3 ]"
1 50 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 51 SER 0.143 0.042 18 0 "[ . 1 . 2 . 3 ]"
1 52 ILE 0.670 0.040 4 0 "[ . 1 . 2 . 3 ]"
1 53 ASP 0.039 0.024 29 0 "[ . 1 . 2 . 3 ]"
1 54 ASP 1.188 0.108 10 0 "[ . 1 . 2 . 3 ]"
1 55 LEU 0.963 0.062 21 0 "[ . 1 . 2 . 3 ]"
1 56 MET 1.970 0.078 26 0 "[ . 1 . 2 . 3 ]"
1 57 LYS 1.528 0.108 10 0 "[ . 1 . 2 . 3 ]"
1 58 SER 1.697 0.085 31 0 "[ . 1 . 2 . 3 ]"
1 59 LEU 0.228 0.042 15 0 "[ . 1 . 2 . 3 ]"
1 60 ASP 0.154 0.056 7 0 "[ . 1 . 2 . 3 ]"
1 61 LYS 1.295 0.089 4 0 "[ . 1 . 2 . 3 ]"
1 62 ASN 0.728 0.089 4 0 "[ . 1 . 2 . 3 ]"
1 63 SER 1.295 0.119 23 0 "[ . 1 . 2 . 3 ]"
1 64 ASP 2.590 0.145 21 0 "[ . 1 . 2 . 3 ]"
1 65 GLN 4.978 0.171 13 0 "[ . 1 . 2 . 3 ]"
1 66 GLU 0.619 0.057 21 0 "[ . 1 . 2 . 3 ]"
1 67 ILE 0.792 0.060 10 0 "[ . 1 . 2 . 3 ]"
1 68 ASP 0.129 0.034 28 0 "[ . 1 . 2 . 3 ]"
1 69 PHE 0.464 0.064 15 0 "[ . 1 . 2 . 3 ]"
1 70 LYS 0.735 0.064 15 0 "[ . 1 . 2 . 3 ]"
1 71 GLU 0.261 0.048 17 0 "[ . 1 . 2 . 3 ]"
1 72 TYR 1.261 0.074 1 0 "[ . 1 . 2 . 3 ]"
1 73 SER 0.719 0.055 24 0 "[ . 1 . 2 . 3 ]"
1 74 VAL 0.606 0.050 23 0 "[ . 1 . 2 . 3 ]"
1 75 PHE 2.155 0.049 26 0 "[ . 1 . 2 . 3 ]"
1 76 LEU 0.488 0.076 28 0 "[ . 1 . 2 . 3 ]"
1 77 THR 0.896 0.076 28 0 "[ . 1 . 2 . 3 ]"
1 78 MET 0.495 0.034 11 0 "[ . 1 . 2 . 3 ]"
1 79 LEU 1.063 0.070 10 0 "[ . 1 . 2 . 3 ]"
1 80 CYS 1.521 0.070 10 0 "[ . 1 . 2 . 3 ]"
1 81 MET 1.083 0.084 28 0 "[ . 1 . 2 . 3 ]"
1 82 ALA 1.350 0.072 18 0 "[ . 1 . 2 . 3 ]"
1 83 TYR 0.315 0.025 23 0 "[ . 1 . 2 . 3 ]"
1 84 ASN 0.460 0.057 26 0 "[ . 1 . 2 . 3 ]"
1 85 ASP 0.677 0.072 18 0 "[ . 1 . 2 . 3 ]"
1 86 PHE 0.625 0.034 11 0 "[ . 1 . 2 . 3 ]"
1 87 PHE 1.094 0.120 16 0 "[ . 1 . 2 . 3 ]"
1 88 LEU 1.936 0.120 16 0 "[ . 1 . 2 . 3 ]"
1 89 GLU 2.459 0.125 12 0 "[ . 1 . 2 . 3 ]"
1 90 ASP 3.245 0.125 12 0 "[ . 1 . 2 . 3 ]"
1 91 ASN 3.376 0.099 27 0 "[ . 1 . 2 . 3 ]"
1 92 LYS 7.173 0.188 12 0 "[ . 1 . 2 . 3 ]"
2 1 MET 0.969 0.145 7 0 "[ . 1 . 2 . 3 ]"
2 2 GLU 0.787 0.106 29 0 "[ . 1 . 2 . 3 ]"
2 3 THR 1.207 0.145 7 0 "[ . 1 . 2 . 3 ]"
2 4 PRO 0.137 0.033 19 0 "[ . 1 . 2 . 3 ]"
2 5 LEU 0.234 0.037 12 0 "[ . 1 . 2 . 3 ]"
2 6 GLU 1.324 0.106 29 0 "[ . 1 . 2 . 3 ]"
2 7 LYS 1.506 0.122 30 0 "[ . 1 . 2 . 3 ]"
2 8 ALA 1.450 0.078 3 0 "[ . 1 . 2 . 3 ]"
2 9 LEU 0.495 0.069 12 0 "[ . 1 . 2 . 3 ]"
2 10 THR 0.369 0.038 14 0 "[ . 1 . 2 . 3 ]"
2 11 THR 0.423 0.039 22 0 "[ . 1 . 2 . 3 ]"
2 12 MET 1.340 0.060 21 0 "[ . 1 . 2 . 3 ]"
2 13 VAL 0.228 0.059 16 0 "[ . 1 . 2 . 3 ]"
2 14 THR 4.112 0.140 24 0 "[ . 1 . 2 . 3 ]"
2 15 THR 2.388 0.104 3 0 "[ . 1 . 2 . 3 ]"
2 16 PHE 4.081 0.140 24 0 "[ . 1 . 2 . 3 ]"
2 17 HIS 0.676 0.059 6 0 "[ . 1 . 2 . 3 ]"
2 18 LYS 0.330 0.045 13 0 "[ . 1 . 2 . 3 ]"
2 19 TYR 0.653 0.104 3 0 "[ . 1 . 2 . 3 ]"
2 20 SER 0.680 0.062 19 0 "[ . 1 . 2 . 3 ]"
2 21 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 22 ARG 0.399 0.061 15 0 "[ . 1 . 2 . 3 ]"
2 23 GLU 0.099 0.061 15 0 "[ . 1 . 2 . 3 ]"
2 26 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 27 LEU 0.657 0.079 11 0 "[ . 1 . 2 . 3 ]"
2 28 THR 1.088 0.077 16 0 "[ . 1 . 2 . 3 ]"
2 29 LEU 1.372 0.118 14 0 "[ . 1 . 2 . 3 ]"
2 30 SER 0.634 0.118 14 0 "[ . 1 . 2 . 3 ]"
2 31 ARG 0.856 0.092 29 0 "[ . 1 . 2 . 3 ]"
2 32 LYS 3.434 0.127 13 0 "[ . 1 . 2 . 3 ]"
2 33 GLU 0.615 0.127 13 0 "[ . 1 . 2 . 3 ]"
2 34 LEU 1.141 0.076 12 0 "[ . 1 . 2 . 3 ]"
2 35 LYS 3.523 0.128 31 0 "[ . 1 . 2 . 3 ]"
2 36 GLU 2.577 0.128 31 0 "[ . 1 . 2 . 3 ]"
2 37 LEU 2.281 0.096 26 0 "[ . 1 . 2 . 3 ]"
2 38 ILE 3.711 0.110 21 0 "[ . 1 . 2 . 3 ]"
2 39 LYS 3.540 0.112 9 0 "[ . 1 . 2 . 3 ]"
2 40 LYS 2.977 0.099 8 0 "[ . 1 . 2 . 3 ]"
2 41 GLU 0.908 0.099 8 0 "[ . 1 . 2 . 3 ]"
2 42 LEU 0.846 0.048 28 0 "[ . 1 . 2 . 3 ]"
2 43 CYS 0.015 0.012 19 0 "[ . 1 . 2 . 3 ]"
2 44 LEU 1.255 0.127 26 0 "[ . 1 . 2 . 3 ]"
2 45 GLY 0.484 0.127 26 0 "[ . 1 . 2 . 3 ]"
2 46 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 47 MET 2.895 0.151 22 0 "[ . 1 . 2 . 3 ]"
2 48 LYS 1.840 0.151 22 0 "[ . 1 . 2 . 3 ]"
2 49 GLU 0.017 0.009 28 0 "[ . 1 . 2 . 3 ]"
2 50 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 51 SER 0.138 0.060 17 0 "[ . 1 . 2 . 3 ]"
2 52 ILE 0.922 0.058 7 0 "[ . 1 . 2 . 3 ]"
2 53 ASP 0.069 0.030 3 0 "[ . 1 . 2 . 3 ]"
2 54 ASP 0.873 0.083 23 0 "[ . 1 . 2 . 3 ]"
2 55 LEU 1.084 0.045 5 0 "[ . 1 . 2 . 3 ]"
2 56 MET 1.912 0.084 13 0 "[ . 1 . 2 . 3 ]"
2 57 LYS 1.137 0.083 23 0 "[ . 1 . 2 . 3 ]"
2 58 SER 1.909 0.103 31 0 "[ . 1 . 2 . 3 ]"
2 59 LEU 0.254 0.057 26 0 "[ . 1 . 2 . 3 ]"
2 60 ASP 0.033 0.019 30 0 "[ . 1 . 2 . 3 ]"
2 61 LYS 0.998 0.095 25 0 "[ . 1 . 2 . 3 ]"
2 62 ASN 0.559 0.095 25 0 "[ . 1 . 2 . 3 ]"
2 63 SER 1.092 0.130 16 0 "[ . 1 . 2 . 3 ]"
2 64 ASP 2.521 0.121 30 0 "[ . 1 . 2 . 3 ]"
2 65 GLN 5.550 0.178 5 0 "[ . 1 . 2 . 3 ]"
2 66 GLU 0.750 0.085 20 0 "[ . 1 . 2 . 3 ]"
2 67 ILE 1.037 0.088 31 0 "[ . 1 . 2 . 3 ]"
2 68 ASP 0.470 0.088 31 0 "[ . 1 . 2 . 3 ]"
2 69 PHE 0.480 0.079 21 0 "[ . 1 . 2 . 3 ]"
2 70 LYS 0.980 0.084 28 0 "[ . 1 . 2 . 3 ]"
2 71 GLU 0.260 0.055 26 0 "[ . 1 . 2 . 3 ]"
2 72 TYR 1.347 0.058 3 0 "[ . 1 . 2 . 3 ]"
2 73 SER 0.562 0.054 17 0 "[ . 1 . 2 . 3 ]"
2 74 VAL 0.451 0.054 17 0 "[ . 1 . 2 . 3 ]"
2 75 PHE 2.122 0.068 10 0 "[ . 1 . 2 . 3 ]"
2 76 LEU 0.237 0.072 18 0 "[ . 1 . 2 . 3 ]"
2 77 THR 0.678 0.072 18 0 "[ . 1 . 2 . 3 ]"
2 78 MET 0.457 0.038 4 0 "[ . 1 . 2 . 3 ]"
2 79 LEU 1.088 0.069 16 0 "[ . 1 . 2 . 3 ]"
2 80 CYS 1.628 0.069 16 0 "[ . 1 . 2 . 3 ]"
2 81 MET 1.023 0.071 31 0 "[ . 1 . 2 . 3 ]"
2 82 ALA 1.720 0.079 8 0 "[ . 1 . 2 . 3 ]"
2 83 TYR 0.411 0.038 27 0 "[ . 1 . 2 . 3 ]"
2 84 ASN 0.362 0.023 26 0 "[ . 1 . 2 . 3 ]"
2 85 ASP 0.870 0.079 8 0 "[ . 1 . 2 . 3 ]"
2 86 PHE 0.832 0.091 22 0 "[ . 1 . 2 . 3 ]"
2 87 PHE 1.194 0.129 22 0 "[ . 1 . 2 . 3 ]"
2 88 LEU 2.139 0.067 22 0 "[ . 1 . 2 . 3 ]"
2 89 GLU 2.860 0.094 17 0 "[ . 1 . 2 . 3 ]"
2 90 ASP 3.111 0.094 17 0 "[ . 1 . 2 . 3 ]"
2 91 ASN 2.925 0.129 22 0 "[ . 1 . 2 . 3 ]"
2 92 LYS 5.964 0.184 18 0 "[ . 1 . 2 . 3 ]"
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 MET QB 1 2 GLU H . . 4.890 3.008 2.116 3.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
2 1 1 MET QB 1 3 THR H . . 5.500 5.481 4.089 5.621 0.121 12 0 "[ . 1 . 2 . 3 ]" 1
3 1 1 MET QG 1 2 GLU H . . 5.500 3.872 2.699 4.619 . 0 0 "[ . 1 . 2 . 3 ]" 1
4 1 2 GLU H 1 6 GLU QB . . 5.340 4.868 2.780 5.407 0.067 13 0 "[ . 1 . 2 . 3 ]" 1
5 1 2 GLU HA 1 3 THR MG . . 5.500 3.743 2.889 4.644 . 0 0 "[ . 1 . 2 . 3 ]" 1
6 1 2 GLU QB 1 3 THR H . . 4.200 2.279 1.649 3.083 . 0 0 "[ . 1 . 2 . 3 ]" 1
7 1 2 GLU QB 1 6 GLU H . . 4.670 4.548 3.896 4.772 0.102 7 0 "[ . 1 . 2 . 3 ]" 1
8 1 2 GLU QG 1 3 THR H . . 4.710 4.057 2.486 4.723 0.013 1 0 "[ . 1 . 2 . 3 ]" 1
9 1 3 THR H 1 3 THR MG . . 4.610 2.632 1.896 3.388 . 0 0 "[ . 1 . 2 . 3 ]" 1
10 1 3 THR H 1 6 GLU HB2 . . 5.500 3.310 2.406 4.594 . 0 0 "[ . 1 . 2 . 3 ]" 1
11 1 3 THR H 1 6 GLU QB . . 4.620 2.911 1.951 3.956 . 0 0 "[ . 1 . 2 . 3 ]" 1
12 1 3 THR H 1 6 GLU HB3 . . 5.500 3.819 1.977 5.521 0.021 21 0 "[ . 1 . 2 . 3 ]" 1
13 1 3 THR HA 1 4 PRO HG2 . . 5.500 4.674 4.431 5.084 . 0 0 "[ . 1 . 2 . 3 ]" 1
14 1 3 THR HA 1 4 PRO QG . . 4.830 4.204 4.036 4.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
15 1 3 THR HA 1 4 PRO HG3 . . 5.500 4.771 4.647 5.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
16 1 3 THR HB 1 4 PRO HD2 . . 4.950 2.197 1.935 3.777 . 0 0 "[ . 1 . 2 . 3 ]" 1
17 1 3 THR HB 1 4 PRO HD3 . . 4.950 3.615 2.994 4.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
18 1 3 THR MG 1 4 PRO HD2 . . 5.500 3.294 2.344 4.098 . 0 0 "[ . 1 . 2 . 3 ]" 1
19 1 3 THR MG 1 4 PRO QD . . 4.700 3.175 2.272 3.913 . 0 0 "[ . 1 . 2 . 3 ]" 1
20 1 3 THR MG 1 4 PRO HD3 . . 5.500 4.192 3.045 4.955 . 0 0 "[ . 1 . 2 . 3 ]" 1
21 1 3 THR MG 1 6 GLU QG . . 5.340 4.250 2.183 5.366 0.026 27 0 "[ . 1 . 2 . 3 ]" 1
22 1 3 THR MG 2 41 GLU HA . . 5.500 2.722 1.969 4.454 . 0 0 "[ . 1 . 2 . 3 ]" 1
23 1 4 PRO HA 1 7 LYS QB . . 3.660 2.504 2.070 3.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
24 1 4 PRO HA 1 7 LYS QD . . 4.980 3.760 2.306 5.014 0.034 28 0 "[ . 1 . 2 . 3 ]" 1
25 1 4 PRO HA 1 7 LYS QG . . 4.420 3.590 2.204 4.438 0.018 12 0 "[ . 1 . 2 . 3 ]" 1
26 1 4 PRO QB 1 5 LEU H . . 3.710 3.552 3.216 3.741 0.031 16 0 "[ . 1 . 2 . 3 ]" 1
27 1 4 PRO QB 2 11 THR MG . . 5.190 2.617 2.043 3.994 . 0 0 "[ . 1 . 2 . 3 ]" 1
28 1 4 PRO HD2 1 5 LEU H . . 5.500 2.912 2.461 3.202 . 0 0 "[ . 1 . 2 . 3 ]" 1
29 1 4 PRO HD3 1 5 LEU H . . 5.500 4.024 3.736 4.205 . 0 0 "[ . 1 . 2 . 3 ]" 1
30 1 4 PRO QG 1 5 LEU H . . 4.600 2.729 2.304 3.073 . 0 0 "[ . 1 . 2 . 3 ]" 1
31 1 4 PRO HG2 1 5 LEU H . . 5.500 2.762 2.320 3.127 . 0 0 "[ . 1 . 2 . 3 ]" 1
32 1 4 PRO HG3 1 5 LEU H . . 5.500 4.265 3.897 4.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
33 1 5 LEU H 1 6 GLU H . . 5.500 2.645 2.334 2.997 . 0 0 "[ . 1 . 2 . 3 ]" 1
34 1 5 LEU HA 1 5 LEU MD1 . . 4.740 2.799 2.054 3.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
35 1 5 LEU HA 1 5 LEU QD . . 3.690 2.226 1.944 3.110 . 0 0 "[ . 1 . 2 . 3 ]" 1
36 1 5 LEU HA 1 5 LEU MD2 . . 4.740 2.726 2.097 3.908 . 0 0 "[ . 1 . 2 . 3 ]" 1
37 1 5 LEU HA 1 5 LEU HG . . 3.850 3.172 2.288 3.779 . 0 0 "[ . 1 . 2 . 3 ]" 1
38 1 5 LEU HA 1 8 ALA MB . . 3.940 2.358 2.124 3.097 . 0 0 "[ . 1 . 2 . 3 ]" 1
39 1 5 LEU QD 1 6 GLU H . . 4.830 3.781 3.070 4.159 . 0 0 "[ . 1 . 2 . 3 ]" 1
40 1 5 LEU QD 1 8 ALA H . . 5.110 4.182 3.811 4.793 . 0 0 "[ . 1 . 2 . 3 ]" 1
41 1 5 LEU QD 1 8 ALA MB . . 5.440 2.723 2.104 3.782 . 0 0 "[ . 1 . 2 . 3 ]" 1
42 1 5 LEU QD 1 9 LEU H . . 5.440 3.784 3.111 4.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
43 1 5 LEU QD 1 9 LEU QD . . 4.070 2.671 2.052 4.079 0.009 5 0 "[ . 1 . 2 . 3 ]" 1
44 1 5 LEU QD 2 12 MET H . . 5.440 3.985 3.155 5.167 . 0 0 "[ . 1 . 2 . 3 ]" 1
45 1 5 LEU QD 2 12 MET ME . . 5.440 3.323 1.946 5.082 . 0 0 "[ . 1 . 2 . 3 ]" 1
46 1 5 LEU QD 2 15 THR HG1 . . 5.500 3.018 2.024 4.208 . 0 0 "[ . 1 . 2 . 3 ]" 1
47 1 5 LEU MD1 1 6 GLU H . . 5.500 4.426 3.180 5.157 . 0 0 "[ . 1 . 2 . 3 ]" 1
48 1 5 LEU MD1 2 12 MET HG2 . . 5.500 3.336 1.969 4.971 . 0 0 "[ . 1 . 2 . 3 ]" 1
49 1 5 LEU MD1 2 12 MET HG3 . . 5.500 3.728 2.061 5.210 . 0 0 "[ . 1 . 2 . 3 ]" 1
50 1 5 LEU MD2 1 6 GLU H . . 5.500 4.334 3.105 4.886 . 0 0 "[ . 1 . 2 . 3 ]" 1
51 1 5 LEU MD2 2 12 MET HG2 . . 5.500 3.755 2.151 5.511 0.011 31 0 "[ . 1 . 2 . 3 ]" 1
52 1 5 LEU MD2 2 12 MET HG3 . . 5.500 4.035 2.233 5.511 0.011 19 0 "[ . 1 . 2 . 3 ]" 1
53 1 5 LEU HG 1 6 GLU H . . 5.500 4.767 3.509 5.333 . 0 0 "[ . 1 . 2 . 3 ]" 1
54 1 6 GLU H 1 6 GLU QG . . 4.290 3.208 2.209 4.109 . 0 0 "[ . 1 . 2 . 3 ]" 1
55 1 6 GLU H 1 7 LYS H . . 4.480 2.782 2.529 3.028 . 0 0 "[ . 1 . 2 . 3 ]" 1
56 1 6 GLU H 1 8 ALA H . . 5.080 4.085 3.846 4.360 . 0 0 "[ . 1 . 2 . 3 ]" 1
57 1 6 GLU H 1 8 ALA MB . . 5.500 4.787 4.538 5.105 . 0 0 "[ . 1 . 2 . 3 ]" 1
58 1 6 GLU H 2 42 LEU QD . . 5.500 4.622 3.304 5.520 0.020 29 0 "[ . 1 . 2 . 3 ]" 1
59 1 6 GLU HA 1 8 ALA H . . 5.160 4.238 3.851 4.801 . 0 0 "[ . 1 . 2 . 3 ]" 1
60 1 6 GLU HA 1 9 LEU H . . 4.840 3.452 2.847 4.005 . 0 0 "[ . 1 . 2 . 3 ]" 1
61 1 6 GLU HA 1 9 LEU QB . . 3.950 2.884 2.328 4.006 0.056 3 0 "[ . 1 . 2 . 3 ]" 1
62 1 6 GLU HA 1 9 LEU QD . . 5.020 2.679 2.098 3.923 . 0 0 "[ . 1 . 2 . 3 ]" 1
63 1 6 GLU QB 2 42 LEU HA . . 5.500 4.596 2.762 5.548 0.048 28 0 "[ . 1 . 2 . 3 ]" 1
64 1 6 GLU QB 2 42 LEU QD . . 4.850 3.793 2.086 4.860 0.010 16 0 "[ . 1 . 2 . 3 ]" 1
65 1 6 GLU HB2 1 7 LYS H . . 4.840 3.230 2.387 4.114 . 0 0 "[ . 1 . 2 . 3 ]" 1
66 1 6 GLU HB3 1 7 LYS H . . 4.840 3.157 2.336 3.839 . 0 0 "[ . 1 . 2 . 3 ]" 1
67 1 6 GLU QG 1 7 LYS H . . 5.340 4.238 3.834 4.684 . 0 0 "[ . 1 . 2 . 3 ]" 1
68 1 6 GLU QG 2 42 LEU HA . . 5.500 3.631 2.539 5.410 . 0 0 "[ . 1 . 2 . 3 ]" 1
69 1 6 GLU QG 2 42 LEU QD . . 5.500 2.832 2.039 4.105 . 0 0 "[ . 1 . 2 . 3 ]" 1
70 1 6 GLU HG2 2 42 LEU MD1 . . 5.500 3.802 2.346 5.530 0.030 7 0 "[ . 1 . 2 . 3 ]" 1
71 1 6 GLU HG2 2 42 LEU MD2 . . 5.500 3.915 2.317 5.521 0.021 16 0 "[ . 1 . 2 . 3 ]" 1
72 1 6 GLU HG3 2 42 LEU MD1 . . 5.500 3.971 2.142 5.521 0.021 19 0 "[ . 1 . 2 . 3 ]" 1
73 1 6 GLU HG3 2 42 LEU MD2 . . 5.500 4.101 2.097 5.532 0.032 8 0 "[ . 1 . 2 . 3 ]" 1
74 1 7 LYS H 1 7 LYS QB . . 3.530 2.360 2.044 2.699 . 0 0 "[ . 1 . 2 . 3 ]" 1
75 1 7 LYS H 1 7 LYS QD . . 5.500 3.911 2.595 4.749 . 0 0 "[ . 1 . 2 . 3 ]" 1
76 1 7 LYS H 1 7 LYS QE . . 5.500 4.177 2.860 5.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
77 1 7 LYS H 1 8 ALA H . . 4.170 2.730 2.407 2.908 . 0 0 "[ . 1 . 2 . 3 ]" 1
78 1 7 LYS HA 1 7 LYS QD . . 4.780 3.664 2.162 4.309 . 0 0 "[ . 1 . 2 . 3 ]" 1
79 1 7 LYS HA 1 7 LYS QE . . 5.500 3.519 1.781 4.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
80 1 7 LYS HA 1 10 THR H . . 3.530 3.418 2.868 3.591 0.061 24 0 "[ . 1 . 2 . 3 ]" 1
81 1 7 LYS HA 1 10 THR HB . . 5.500 2.802 2.119 4.525 . 0 0 "[ . 1 . 2 . 3 ]" 1
82 1 7 LYS QB 1 7 LYS QD . . 3.330 2.355 2.102 2.576 . 0 0 "[ . 1 . 2 . 3 ]" 1
83 1 7 LYS QB 1 7 LYS QE . . 4.380 2.890 1.922 3.765 . 0 0 "[ . 1 . 2 . 3 ]" 1
84 1 7 LYS QB 1 8 ALA H . . 3.690 2.876 2.542 3.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
85 1 7 LYS QB 1 8 ALA HA . . 4.250 4.162 3.825 4.289 0.039 21 0 "[ . 1 . 2 . 3 ]" 1
86 1 7 LYS QB 1 8 ALA MB . . 4.070 4.009 3.669 4.103 0.033 19 0 "[ . 1 . 2 . 3 ]" 1
87 1 7 LYS QG 1 8 ALA H . . 4.280 4.239 3.795 4.442 0.162 22 0 "[ . 1 . 2 . 3 ]" 1
88 1 8 ALA H 1 8 ALA MB . . 3.560 2.251 2.179 2.306 . 0 0 "[ . 1 . 2 . 3 ]" 1
89 1 8 ALA H 1 9 LEU H . . 3.970 2.720 2.459 2.999 . 0 0 "[ . 1 . 2 . 3 ]" 1
90 1 8 ALA H 2 11 THR MG . . 5.500 4.798 4.086 5.526 0.026 22 0 "[ . 1 . 2 . 3 ]" 1
91 1 8 ALA HA 1 11 THR H . . 4.460 3.334 2.887 3.537 . 0 0 "[ . 1 . 2 . 3 ]" 1
92 1 8 ALA HA 1 11 THR HB . . 3.830 2.834 2.256 3.857 0.027 15 0 "[ . 1 . 2 . 3 ]" 1
93 1 8 ALA HA 1 11 THR MG . . 5.500 3.684 2.003 4.385 . 0 0 "[ . 1 . 2 . 3 ]" 1
94 1 8 ALA MB 1 9 LEU H . . 4.350 2.546 2.343 2.837 . 0 0 "[ . 1 . 2 . 3 ]" 1
95 1 8 ALA MB 1 9 LEU MD1 . . 5.500 4.590 3.988 5.366 . 0 0 "[ . 1 . 2 . 3 ]" 1
96 1 8 ALA MB 1 9 LEU MD2 . . 5.500 3.934 2.628 4.760 . 0 0 "[ . 1 . 2 . 3 ]" 1
97 1 8 ALA MB 1 10 THR H . . 5.080 4.626 4.451 4.891 . 0 0 "[ . 1 . 2 . 3 ]" 1
98 1 8 ALA MB 1 11 THR H . . 4.610 4.577 4.324 4.649 0.039 2 0 "[ . 1 . 2 . 3 ]" 1
99 1 8 ALA MB 2 11 THR HB . . 5.180 3.502 2.562 5.136 . 0 0 "[ . 1 . 2 . 3 ]" 1
100 1 8 ALA MB 2 11 THR MG . . 5.500 3.155 2.023 4.246 . 0 0 "[ . 1 . 2 . 3 ]" 1
101 1 8 ALA MB 2 12 MET QG . . 5.500 3.954 2.224 5.300 . 0 0 "[ . 1 . 2 . 3 ]" 1
102 1 9 LEU H 1 9 LEU QB . . 3.280 2.412 2.076 2.624 . 0 0 "[ . 1 . 2 . 3 ]" 1
103 1 9 LEU H 1 9 LEU MD1 . . 4.850 3.531 3.249 4.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
104 1 9 LEU H 1 9 LEU MD2 . . 4.850 3.417 2.223 4.006 . 0 0 "[ . 1 . 2 . 3 ]" 1
105 1 9 LEU H 1 9 LEU HG . . 3.650 2.331 2.020 3.715 0.065 4 0 "[ . 1 . 2 . 3 ]" 1
106 1 9 LEU HA 1 9 LEU QD . . 3.940 2.250 2.051 3.443 . 0 0 "[ . 1 . 2 . 3 ]" 1
107 1 9 LEU HA 1 9 LEU HG . . 4.200 3.126 2.590 3.719 . 0 0 "[ . 1 . 2 . 3 ]" 1
108 1 9 LEU QB 1 9 LEU MD1 . . 2.400 2.113 2.052 2.274 . 0 0 "[ . 1 . 2 . 3 ]" 1
109 1 9 LEU QB 1 9 LEU MD2 . . 2.400 2.322 2.069 2.426 0.026 4 0 "[ . 1 . 2 . 3 ]" 1
110 1 9 LEU QB 1 10 THR H . . 4.010 2.615 2.264 3.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
111 1 9 LEU QB 2 83 TYR QD . . 5.500 3.358 2.517 4.845 . 0 0 "[ . 1 . 2 . 3 ]" 1
112 1 9 LEU QB 2 83 TYR QE . . 5.500 3.594 2.119 5.530 0.030 27 0 "[ . 1 . 2 . 3 ]" 1
113 1 9 LEU QD 1 12 MET H . . 5.340 4.858 4.170 5.152 . 0 0 "[ . 1 . 2 . 3 ]" 1
114 1 9 LEU QD 2 12 MET ME . . 4.920 3.700 2.060 4.936 0.016 26 0 "[ . 1 . 2 . 3 ]" 1
115 1 9 LEU QD 2 12 MET QG . . 5.280 4.014 2.237 5.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
116 1 9 LEU QD 2 79 LEU QB . . 5.280 2.200 1.935 3.031 . 0 0 "[ . 1 . 2 . 3 ]" 1
117 1 9 LEU QD 2 79 LEU QD . . 4.850 2.298 1.966 3.023 . 0 0 "[ . 1 . 2 . 3 ]" 1
118 1 9 LEU QD 2 80 CYS H . . 5.280 3.270 2.558 4.398 . 0 0 "[ . 1 . 2 . 3 ]" 1
119 1 9 LEU QD 2 80 CYS HA . . 5.440 3.477 2.421 4.632 . 0 0 "[ . 1 . 2 . 3 ]" 1
120 1 9 LEU QD 2 80 CYS QB . . 4.850 3.236 2.068 4.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
121 1 9 LEU QD 2 83 TYR QE . . 5.500 3.278 2.117 4.897 . 0 0 "[ . 1 . 2 . 3 ]" 1
122 1 9 LEU MD1 1 10 THR H . . 5.500 4.356 2.504 4.957 . 0 0 "[ . 1 . 2 . 3 ]" 1
123 1 9 LEU MD2 1 10 THR H . . 5.500 4.735 4.299 4.926 . 0 0 "[ . 1 . 2 . 3 ]" 1
124 1 10 THR H 1 10 THR HB . . 4.050 2.814 2.161 3.669 . 0 0 "[ . 1 . 2 . 3 ]" 1
125 1 10 THR H 1 10 THR MG . . 4.620 3.489 2.364 3.835 . 0 0 "[ . 1 . 2 . 3 ]" 1
126 1 10 THR H 1 11 THR H . . 4.410 2.912 2.693 3.168 . 0 0 "[ . 1 . 2 . 3 ]" 1
127 1 10 THR H 1 13 VAL QG . . 4.980 4.511 3.997 4.987 0.007 24 0 "[ . 1 . 2 . 3 ]" 1
128 1 10 THR H 2 83 TYR QE . . 5.500 4.575 2.744 5.395 . 0 0 "[ . 1 . 2 . 3 ]" 1
129 1 10 THR HA 1 13 VAL H . . 5.220 3.521 2.998 3.865 . 0 0 "[ . 1 . 2 . 3 ]" 1
130 1 10 THR HB 1 11 THR H . . 3.780 2.911 2.302 3.787 0.007 17 0 "[ . 1 . 2 . 3 ]" 1
131 1 10 THR MG 1 11 THR H . . 4.830 3.594 2.467 4.327 . 0 0 "[ . 1 . 2 . 3 ]" 1
132 1 10 THR MG 1 12 MET H . . 5.470 5.232 4.498 5.507 0.037 2 0 "[ . 1 . 2 . 3 ]" 1
133 1 10 THR MG 2 83 TYR QD . . 5.500 3.674 2.294 5.333 . 0 0 "[ . 1 . 2 . 3 ]" 1
134 1 10 THR MG 2 83 TYR QE . . 5.500 3.895 2.488 5.507 0.007 11 0 "[ . 1 . 2 . 3 ]" 1
135 1 11 THR H 1 11 THR HB . . 3.900 2.536 2.091 2.791 . 0 0 "[ . 1 . 2 . 3 ]" 1
136 1 11 THR H 1 11 THR MG . . 4.700 3.597 2.574 3.837 . 0 0 "[ . 1 . 2 . 3 ]" 1
137 1 11 THR HA 1 14 THR H . . 5.150 3.393 2.854 3.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
138 1 11 THR HA 1 14 THR HB . . 4.120 2.526 2.139 2.880 . 0 0 "[ . 1 . 2 . 3 ]" 1
139 1 11 THR HA 1 14 THR MG . . 5.500 3.649 3.354 3.936 . 0 0 "[ . 1 . 2 . 3 ]" 1
140 1 11 THR HB 1 12 MET H . . 4.190 2.928 2.478 4.066 . 0 0 "[ . 1 . 2 . 3 ]" 1
141 1 11 THR HB 2 8 ALA MB . . 5.180 3.503 2.387 5.196 0.016 19 0 "[ . 1 . 2 . 3 ]" 1
142 1 11 THR MG 1 12 MET H . . 5.420 3.350 2.510 3.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
143 1 11 THR MG 1 14 THR H . . 5.500 4.784 4.403 5.094 . 0 0 "[ . 1 . 2 . 3 ]" 1
144 1 11 THR MG 1 14 THR HB . . 5.500 3.751 3.206 4.698 . 0 0 "[ . 1 . 2 . 3 ]" 1
145 1 11 THR MG 1 15 THR H . . 5.500 4.094 3.670 4.837 . 0 0 "[ . 1 . 2 . 3 ]" 1
146 1 11 THR MG 1 15 THR HG1 . . 5.500 4.641 3.180 5.512 0.012 29 0 "[ . 1 . 2 . 3 ]" 1
147 1 11 THR MG 2 4 PRO QB . . 5.190 2.901 2.140 4.495 . 0 0 "[ . 1 . 2 . 3 ]" 1
148 1 11 THR MG 2 8 ALA H . . 5.500 4.761 3.712 5.543 0.043 28 0 "[ . 1 . 2 . 3 ]" 1
149 1 11 THR MG 2 8 ALA MB . . 5.500 3.128 2.197 4.547 . 0 0 "[ . 1 . 2 . 3 ]" 1
150 1 12 MET H 1 12 MET ME . . 5.500 4.493 3.445 5.512 0.012 14 0 "[ . 1 . 2 . 3 ]" 1
151 1 12 MET H 1 12 MET HG2 . . 5.060 3.791 1.917 4.658 . 0 0 "[ . 1 . 2 . 3 ]" 1
152 1 12 MET H 1 12 MET QG . . 4.350 3.152 1.902 4.066 . 0 0 "[ . 1 . 2 . 3 ]" 1
153 1 12 MET H 1 12 MET HG3 . . 5.060 3.651 2.110 4.594 . 0 0 "[ . 1 . 2 . 3 ]" 1
154 1 12 MET H 1 13 VAL H . . 4.550 2.933 2.580 3.154 . 0 0 "[ . 1 . 2 . 3 ]" 1
155 1 12 MET H 2 5 LEU QD . . 5.440 3.836 2.902 5.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
156 1 12 MET HA 1 12 MET ME . . 4.010 3.679 2.068 4.111 0.101 10 0 "[ . 1 . 2 . 3 ]" 1
157 1 12 MET HA 1 15 THR H . . 4.060 3.741 3.458 4.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
158 1 12 MET HA 1 76 LEU QD . . 5.440 4.225 3.428 4.857 . 0 0 "[ . 1 . 2 . 3 ]" 1
159 1 12 MET QB 1 13 VAL H . . 5.500 2.530 2.136 3.638 . 0 0 "[ . 1 . 2 . 3 ]" 1
160 1 12 MET ME 1 73 SER HA . . 5.500 5.188 3.681 5.555 0.055 24 0 "[ . 1 . 2 . 3 ]" 1
161 1 12 MET ME 1 76 LEU QD . . 5.440 2.057 1.717 2.555 . 0 0 "[ . 1 . 2 . 3 ]" 1
162 1 12 MET ME 2 5 LEU QD . . 5.440 3.197 1.932 4.440 . 0 0 "[ . 1 . 2 . 3 ]" 1
163 1 12 MET ME 2 9 LEU QD . . 4.920 3.501 1.984 4.941 0.021 14 0 "[ . 1 . 2 . 3 ]" 1
164 1 12 MET QG 1 13 VAL H . . 5.170 4.023 2.532 4.434 . 0 0 "[ . 1 . 2 . 3 ]" 1
165 1 12 MET QG 1 15 THR MG . . 5.340 4.936 3.613 5.358 0.018 11 0 "[ . 1 . 2 . 3 ]" 1
166 1 12 MET QG 2 8 ALA MB . . 5.500 4.197 2.804 5.500 . 0 0 "[ . 1 . 2 . 3 ]" 1
167 1 12 MET QG 2 9 LEU QD . . 5.280 4.110 2.861 5.283 0.003 31 0 "[ . 1 . 2 . 3 ]" 1
168 1 12 MET QG 2 80 CYS QB . . 5.500 4.751 3.490 5.549 0.049 20 0 "[ . 1 . 2 . 3 ]" 1
169 1 12 MET HG2 2 5 LEU MD1 . . 5.500 3.741 2.086 5.537 0.037 12 0 "[ . 1 . 2 . 3 ]" 1
170 1 12 MET HG2 2 5 LEU MD2 . . 5.500 4.034 2.024 5.514 0.014 2 0 "[ . 1 . 2 . 3 ]" 1
171 1 12 MET HG3 2 5 LEU MD1 . . 5.500 3.863 2.291 5.520 0.020 20 0 "[ . 1 . 2 . 3 ]" 1
172 1 12 MET HG3 2 5 LEU MD2 . . 5.500 4.084 2.384 5.518 0.018 6 0 "[ . 1 . 2 . 3 ]" 1
173 1 13 VAL H 1 13 VAL HB . . 4.090 2.855 2.278 3.781 . 0 0 "[ . 1 . 2 . 3 ]" 1
174 1 13 VAL H 1 13 VAL QG . . 4.050 2.219 1.920 2.746 . 0 0 "[ . 1 . 2 . 3 ]" 1
175 1 13 VAL H 1 14 THR H . . 4.610 2.720 2.451 2.900 . 0 0 "[ . 1 . 2 . 3 ]" 1
176 1 13 VAL HA 1 16 PHE H . . 4.030 3.379 2.964 3.744 . 0 0 "[ . 1 . 2 . 3 ]" 1
177 1 13 VAL HA 1 16 PHE QB . . 4.980 2.312 2.058 2.638 . 0 0 "[ . 1 . 2 . 3 ]" 1
178 1 13 VAL HB 1 14 THR H . . 4.390 3.556 2.655 4.284 . 0 0 "[ . 1 . 2 . 3 ]" 1
179 1 13 VAL QG 1 14 THR H . . 4.990 2.904 2.363 3.467 . 0 0 "[ . 1 . 2 . 3 ]" 1
180 1 13 VAL QG 1 14 THR HA . . 5.040 3.483 3.238 3.784 . 0 0 "[ . 1 . 2 . 3 ]" 1
181 1 13 VAL QG 1 16 PHE H . . 4.570 4.415 4.050 4.606 0.036 3 0 "[ . 1 . 2 . 3 ]" 1
182 1 13 VAL QG 2 80 CYS HA . . 4.620 3.203 2.310 4.528 . 0 0 "[ . 1 . 2 . 3 ]" 1
183 1 13 VAL QG 2 80 CYS QB . . 5.280 3.595 2.290 5.250 . 0 0 "[ . 1 . 2 . 3 ]" 1
184 1 13 VAL QG 2 83 TYR QB . . 4.290 2.065 1.885 2.530 . 0 0 "[ . 1 . 2 . 3 ]" 1
185 1 13 VAL QG 2 83 TYR QD . . 5.500 3.273 2.069 4.000 . 0 0 "[ . 1 . 2 . 3 ]" 1
186 1 13 VAL QG 2 83 TYR QE . . 5.500 4.816 3.702 5.488 . 0 0 "[ . 1 . 2 . 3 ]" 1
187 1 13 VAL QG 2 84 ASN H . . 4.600 2.933 2.454 3.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
188 1 13 VAL QG 2 84 ASN QB . . 5.440 2.764 2.149 3.927 . 0 0 "[ . 1 . 2 . 3 ]" 1
189 1 13 VAL QG 2 84 ASN QD . . 5.500 3.905 1.864 5.212 . 0 0 "[ . 1 . 2 . 3 ]" 1
190 1 13 VAL QG 2 87 PHE H . . 5.440 4.004 3.557 5.043 . 0 0 "[ . 1 . 2 . 3 ]" 1
191 1 13 VAL QG 2 87 PHE QB . . 4.810 2.787 2.298 3.789 . 0 0 "[ . 1 . 2 . 3 ]" 1
192 1 13 VAL QG 2 87 PHE QD . . 5.440 3.404 2.351 4.587 . 0 0 "[ . 1 . 2 . 3 ]" 1
193 1 13 VAL MG1 1 16 PHE H . . 5.330 4.938 4.563 5.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
194 1 13 VAL MG1 2 80 CYS HA . . 5.500 4.353 2.745 5.445 . 0 0 "[ . 1 . 2 . 3 ]" 1
195 1 13 VAL MG1 2 83 TYR HB2 . . 5.500 3.435 2.100 5.181 . 0 0 "[ . 1 . 2 . 3 ]" 1
196 1 13 VAL MG1 2 83 TYR HB3 . . 5.500 2.664 2.114 3.742 . 0 0 "[ . 1 . 2 . 3 ]" 1
197 1 13 VAL MG1 2 83 TYR QD . . 5.500 3.914 2.079 4.935 . 0 0 "[ . 1 . 2 . 3 ]" 1
198 1 13 VAL MG1 2 84 ASN H . . 5.230 3.566 2.485 5.242 0.012 15 0 "[ . 1 . 2 . 3 ]" 1
199 1 13 VAL MG1 2 84 ASN HA . . 5.500 2.894 2.030 4.755 . 0 0 "[ . 1 . 2 . 3 ]" 1
200 1 13 VAL MG2 1 16 PHE H . . 5.330 5.013 4.365 5.341 0.011 21 0 "[ . 1 . 2 . 3 ]" 1
201 1 13 VAL MG2 2 80 CYS HA . . 5.500 3.821 2.317 5.522 0.022 23 0 "[ . 1 . 2 . 3 ]" 1
202 1 13 VAL MG2 2 83 TYR HB2 . . 5.500 3.079 2.088 4.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
203 1 13 VAL MG2 2 83 TYR HB3 . . 5.500 2.570 2.133 3.764 . 0 0 "[ . 1 . 2 . 3 ]" 1
204 1 13 VAL MG2 2 83 TYR QD . . 5.500 3.825 2.837 4.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
205 1 13 VAL MG2 2 84 ASN H . . 5.230 3.511 2.646 4.636 . 0 0 "[ . 1 . 2 . 3 ]" 1
206 1 13 VAL MG2 2 84 ASN HA . . 5.500 3.179 1.960 4.775 . 0 0 "[ . 1 . 2 . 3 ]" 1
207 1 14 THR H 1 14 THR HB . . 3.900 2.537 2.377 2.753 . 0 0 "[ . 1 . 2 . 3 ]" 1
208 1 14 THR H 1 14 THR MG . . 4.300 3.777 3.740 3.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
209 1 14 THR H 1 15 THR H . . 4.610 2.821 2.603 3.010 . 0 0 "[ . 1 . 2 . 3 ]" 1
210 1 14 THR HA 1 17 HIS H . . 3.950 3.860 3.479 4.072 0.122 30 0 "[ . 1 . 2 . 3 ]" 1
211 1 14 THR HA 1 17 HIS QB . . 4.790 3.518 3.150 4.067 . 0 0 "[ . 1 . 2 . 3 ]" 1
212 1 14 THR HB 1 15 THR H . . 4.090 2.263 2.059 2.641 . 0 0 "[ . 1 . 2 . 3 ]" 1
213 1 14 THR HB 1 15 THR HG1 . . 5.500 5.165 3.685 5.576 0.076 18 0 "[ . 1 . 2 . 3 ]" 1
214 1 14 THR HB 1 15 THR MG . . 4.180 3.904 3.266 4.247 0.067 24 0 "[ . 1 . 2 . 3 ]" 1
215 1 14 THR HB 1 16 PHE H . . 4.490 4.574 4.507 4.627 0.137 14 0 "[ . 1 . 2 . 3 ]" 1
216 1 14 THR MG 1 15 THR H . . 5.150 3.348 3.171 3.684 . 0 0 "[ . 1 . 2 . 3 ]" 1
217 1 14 THR MG 2 87 PHE QD . . 5.500 5.339 4.672 5.519 0.019 17 0 "[ . 1 . 2 . 3 ]" 1
218 1 14 THR MG 2 87 PHE QE . . 5.500 4.130 3.024 4.910 . 0 0 "[ . 1 . 2 . 3 ]" 1
219 1 14 THR MG 2 87 PHE HZ . . 5.500 4.852 3.424 5.516 0.016 11 0 "[ . 1 . 2 . 3 ]" 1
220 1 15 THR H 1 15 THR HG1 . . 5.140 3.350 1.878 4.458 . 0 0 "[ . 1 . 2 . 3 ]" 1
221 1 15 THR H 1 16 PHE H . . 4.540 2.556 2.301 2.705 . 0 0 "[ . 1 . 2 . 3 ]" 1
222 1 15 THR HA 1 18 LYS H . . 3.780 3.511 2.692 3.819 0.039 13 0 "[ . 1 . 2 . 3 ]" 1
223 1 15 THR HA 1 18 LYS QB . . 3.380 2.553 2.032 3.383 0.003 30 0 "[ . 1 . 2 . 3 ]" 1
224 1 15 THR HA 1 19 TYR QD . . 5.500 3.375 2.168 4.639 . 0 0 "[ . 1 . 2 . 3 ]" 1
225 1 15 THR HA 1 19 TYR QE . . 4.000 3.836 3.214 4.072 0.072 12 0 "[ . 1 . 2 . 3 ]" 1
226 1 15 THR HG1 1 16 PHE H . . 5.500 3.595 2.083 5.301 . 0 0 "[ . 1 . 2 . 3 ]" 1
227 1 15 THR HG1 2 5 LEU QD . . 5.500 3.199 1.779 4.763 . 0 0 "[ . 1 . 2 . 3 ]" 1
228 1 15 THR MG 1 16 PHE H . . 5.290 3.533 2.325 4.230 . 0 0 "[ . 1 . 2 . 3 ]" 1
229 1 15 THR MG 1 18 LYS QB . . 4.530 4.206 3.441 4.571 0.041 13 0 "[ . 1 . 2 . 3 ]" 1
230 1 15 THR MG 1 19 TYR QD . . 5.500 3.320 2.774 3.874 . 0 0 "[ . 1 . 2 . 3 ]" 1
231 1 15 THR MG 1 19 TYR QE . . 5.500 2.843 2.121 4.049 . 0 0 "[ . 1 . 2 . 3 ]" 1
232 1 15 THR MG 1 37 LEU HA . . 5.500 5.485 5.063 5.544 0.044 9 0 "[ . 1 . 2 . 3 ]" 1
233 1 15 THR MG 1 37 LEU MD1 . . 5.500 3.698 2.191 5.108 . 0 0 "[ . 1 . 2 . 3 ]" 1
234 1 15 THR MG 1 37 LEU QD . . 4.610 3.188 2.157 4.491 . 0 0 "[ . 1 . 2 . 3 ]" 1
235 1 15 THR MG 1 37 LEU MD2 . . 5.500 3.997 2.815 5.509 0.009 6 0 "[ . 1 . 2 . 3 ]" 1
236 1 15 THR MG 1 72 TYR HH . . 5.500 4.624 2.683 5.542 0.042 13 0 "[ . 1 . 2 . 3 ]" 1
237 1 16 PHE H 1 16 PHE QB . . 3.680 2.292 2.164 2.361 . 0 0 "[ . 1 . 2 . 3 ]" 1
238 1 16 PHE H 1 16 PHE QD . . 4.890 4.195 3.977 4.310 . 0 0 "[ . 1 . 2 . 3 ]" 1
239 1 16 PHE HA 1 37 LEU QD . . 4.950 3.363 2.475 4.473 . 0 0 "[ . 1 . 2 . 3 ]" 1
240 1 16 PHE HA 1 72 TYR QE . . 5.340 4.498 3.778 5.259 . 0 0 "[ . 1 . 2 . 3 ]" 1
241 1 16 PHE QB 1 17 HIS H . . 4.370 2.518 2.284 2.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
242 1 16 PHE HB2 1 17 HIS H . . 4.990 3.845 3.484 4.046 . 0 0 "[ . 1 . 2 . 3 ]" 1
243 1 16 PHE HB3 1 17 HIS H . . 4.990 2.554 2.304 2.905 . 0 0 "[ . 1 . 2 . 3 ]" 1
244 1 16 PHE QD 1 17 HIS H . . 5.500 3.675 3.254 4.269 . 0 0 "[ . 1 . 2 . 3 ]" 1
245 1 16 PHE QE 1 27 LEU HA . . 5.500 3.603 2.286 5.500 0.000 9 0 "[ . 1 . 2 . 3 ]" 1
246 1 16 PHE QE 1 28 THR HA . . 5.040 3.952 2.564 5.103 0.063 25 0 "[ . 1 . 2 . 3 ]" 1
247 1 16 PHE QE 1 29 LEU H . . 5.500 4.245 2.617 5.253 . 0 0 "[ . 1 . 2 . 3 ]" 1
248 1 16 PHE QE 1 29 LEU MD1 . . 5.500 2.691 2.027 4.432 . 0 0 "[ . 1 . 2 . 3 ]" 1
249 1 16 PHE QE 1 29 LEU MD2 . . 5.500 3.411 2.002 4.271 . 0 0 "[ . 1 . 2 . 3 ]" 1
250 1 16 PHE QE 1 68 ASP HA . . 5.500 4.689 3.920 5.512 0.012 22 0 "[ . 1 . 2 . 3 ]" 1
251 1 16 PHE HZ 1 28 THR HA . . 5.500 3.396 2.758 4.601 . 0 0 "[ . 1 . 2 . 3 ]" 1
252 1 16 PHE HZ 1 29 LEU H . . 5.500 3.931 2.940 4.811 . 0 0 "[ . 1 . 2 . 3 ]" 1
253 1 16 PHE HZ 1 29 LEU MD1 . . 5.500 4.015 2.663 5.382 . 0 0 "[ . 1 . 2 . 3 ]" 1
254 1 16 PHE HZ 1 29 LEU QD . . 4.090 3.413 2.252 4.096 0.006 27 0 "[ . 1 . 2 . 3 ]" 1
255 1 16 PHE HZ 1 29 LEU MD2 . . 5.500 4.340 2.261 5.544 0.044 20 0 "[ . 1 . 2 . 3 ]" 1
256 1 16 PHE HZ 1 29 LEU HG . . 5.500 3.875 3.040 5.534 0.034 7 0 "[ . 1 . 2 . 3 ]" 1
257 1 16 PHE HZ 1 67 ILE HB . . 5.500 5.010 3.902 5.558 0.058 6 0 "[ . 1 . 2 . 3 ]" 1
258 1 16 PHE HZ 1 68 ASP HA . . 5.500 3.762 2.835 4.667 . 0 0 "[ . 1 . 2 . 3 ]" 1
259 1 16 PHE HZ 1 69 PHE H . . 5.500 3.476 2.759 4.720 . 0 0 "[ . 1 . 2 . 3 ]" 1
260 1 16 PHE HZ 1 69 PHE QD . . 5.500 3.947 2.978 4.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
261 1 16 PHE HZ 1 72 TYR QE . . 5.500 5.508 5.119 5.574 0.074 1 0 "[ . 1 . 2 . 3 ]" 1
262 1 17 HIS H 1 18 LYS H . . 4.280 2.760 2.539 2.890 . 0 0 "[ . 1 . 2 . 3 ]" 1
263 1 17 HIS HA 1 20 SER H . . 3.820 3.467 2.928 3.845 0.025 23 0 "[ . 1 . 2 . 3 ]" 1
264 1 17 HIS QB 1 18 LYS H . . 4.390 2.882 2.379 3.475 . 0 0 "[ . 1 . 2 . 3 ]" 1
265 1 17 HIS HB2 1 18 LYS H . . 5.090 3.287 2.412 4.058 . 0 0 "[ . 1 . 2 . 3 ]" 1
266 1 17 HIS HB3 1 18 LYS H . . 5.090 3.433 2.758 4.252 . 0 0 "[ . 1 . 2 . 3 ]" 1
267 1 17 HIS HE1 1 69 PHE QE . . 5.500 5.236 3.591 5.525 0.025 25 0 "[ . 1 . 2 . 3 ]" 1
268 1 18 LYS H 1 18 LYS QB . . 3.480 2.205 2.031 2.438 . 0 0 "[ . 1 . 2 . 3 ]" 1
269 1 18 LYS H 1 18 LYS QD . . 5.500 3.998 2.235 4.962 . 0 0 "[ . 1 . 2 . 3 ]" 1
270 1 18 LYS H 1 18 LYS HG2 . . 5.370 4.234 2.514 4.635 . 0 0 "[ . 1 . 2 . 3 ]" 1
271 1 18 LYS H 1 18 LYS QG . . 4.690 3.595 2.430 4.060 . 0 0 "[ . 1 . 2 . 3 ]" 1
272 1 18 LYS H 1 18 LYS HG3 . . 5.370 3.991 2.463 4.591 . 0 0 "[ . 1 . 2 . 3 ]" 1
273 1 18 LYS H 1 19 TYR H . . 4.090 2.804 2.423 3.164 . 0 0 "[ . 1 . 2 . 3 ]" 1
274 1 18 LYS HA 1 18 LYS QE . . 5.010 4.432 3.782 5.047 0.037 18 0 "[ . 1 . 2 . 3 ]" 1
275 1 18 LYS QB 1 18 LYS QE . . 4.400 3.184 1.914 3.948 . 0 0 "[ . 1 . 2 . 3 ]" 1
276 1 18 LYS QB 1 19 TYR H . . 4.310 2.682 2.203 3.272 . 0 0 "[ . 1 . 2 . 3 ]" 1
277 1 18 LYS QB 1 19 TYR QD . . 5.500 3.432 2.362 4.381 . 0 0 "[ . 1 . 2 . 3 ]" 1
278 1 18 LYS QG 1 19 TYR H . . 5.340 4.038 2.843 4.800 . 0 0 "[ . 1 . 2 . 3 ]" 1
279 1 19 TYR H 1 19 TYR QD . . 4.430 2.780 2.174 3.247 . 0 0 "[ . 1 . 2 . 3 ]" 1
280 1 19 TYR H 1 20 SER H . . 4.040 2.538 2.205 2.865 . 0 0 "[ . 1 . 2 . 3 ]" 1
281 1 19 TYR H 1 21 GLY H . . 4.970 4.133 3.568 4.979 0.009 17 0 "[ . 1 . 2 . 3 ]" 1
282 1 19 TYR HA 1 19 TYR QE . . 5.500 4.556 4.237 4.928 . 0 0 "[ . 1 . 2 . 3 ]" 1
283 1 19 TYR HA 1 22 ARG QD . . 4.840 3.718 2.094 4.871 0.031 19 0 "[ . 1 . 2 . 3 ]" 1
284 1 19 TYR HA 1 29 LEU QD . . 5.440 4.096 3.642 5.043 . 0 0 "[ . 1 . 2 . 3 ]" 1
285 1 19 TYR QB 1 29 LEU QD . . 4.850 2.277 1.949 3.318 . 0 0 "[ . 1 . 2 . 3 ]" 1
286 1 19 TYR QD 1 20 SER H . . 5.500 4.514 3.759 4.787 . 0 0 "[ . 1 . 2 . 3 ]" 1
287 1 19 TYR QD 1 29 LEU QD . . 5.500 3.791 3.180 4.784 . 0 0 "[ . 1 . 2 . 3 ]" 1
288 1 19 TYR QD 1 36 GLU QB . . 5.340 3.276 2.572 3.825 . 0 0 "[ . 1 . 2 . 3 ]" 1
289 1 19 TYR QD 1 36 GLU HG2 . . 5.500 4.016 2.580 5.555 0.055 17 0 "[ . 1 . 2 . 3 ]" 1
290 1 19 TYR QD 1 36 GLU HG3 . . 5.500 4.538 2.384 5.532 0.032 18 0 "[ . 1 . 2 . 3 ]" 1
291 1 19 TYR QD 1 37 LEU MD1 . . 5.500 3.030 2.133 5.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
292 1 19 TYR QD 1 37 LEU MD2 . . 5.500 3.806 2.430 4.945 . 0 0 "[ . 1 . 2 . 3 ]" 1
293 1 19 TYR QE 1 36 GLU HG2 . . 5.500 3.361 2.121 5.469 . 0 0 "[ . 1 . 2 . 3 ]" 1
294 1 19 TYR QE 1 36 GLU HG3 . . 5.500 3.564 2.082 4.849 . 0 0 "[ . 1 . 2 . 3 ]" 1
295 1 19 TYR QE 1 37 LEU HA . . 5.500 3.099 2.215 3.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
296 1 19 TYR QE 1 37 LEU MD1 . . 5.500 3.835 2.271 5.535 0.035 20 0 "[ . 1 . 2 . 3 ]" 1
297 1 19 TYR QE 1 37 LEU MD2 . . 5.500 4.294 2.395 5.508 0.008 1 0 "[ . 1 . 2 . 3 ]" 1
298 1 19 TYR QE 1 37 LEU HG . . 5.500 4.304 2.393 5.525 0.025 31 0 "[ . 1 . 2 . 3 ]" 1
299 1 19 TYR QE 1 40 LYS QD . . 5.500 3.642 2.085 5.501 0.001 27 0 "[ . 1 . 2 . 3 ]" 1
300 1 19 TYR QE 1 40 LYS HG2 . . 5.500 4.397 2.695 5.498 . 0 0 "[ . 1 . 2 . 3 ]" 1
301 1 19 TYR QE 1 40 LYS HG3 . . 5.500 3.515 2.240 5.005 . 0 0 "[ . 1 . 2 . 3 ]" 1
302 1 20 SER H 1 21 GLY H . . 3.880 2.770 2.496 3.439 . 0 0 "[ . 1 . 2 . 3 ]" 1
303 1 20 SER H 1 29 LEU QD . . 4.830 2.916 2.457 3.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
304 1 20 SER HA 1 28 THR H . . 5.310 4.830 3.957 5.363 0.053 21 0 "[ . 1 . 2 . 3 ]" 1
305 1 20 SER HA 1 29 LEU QD . . 4.330 2.281 1.920 3.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
306 1 20 SER QB 1 28 THR H . . 4.540 3.770 2.360 4.578 0.038 20 0 "[ . 1 . 2 . 3 ]" 1
307 1 20 SER QB 1 29 LEU QD . . 4.050 2.719 1.989 3.881 . 0 0 "[ . 1 . 2 . 3 ]" 1
308 1 20 SER HB2 1 28 THR H . . 5.150 4.297 2.379 5.181 0.031 20 0 "[ . 1 . 2 . 3 ]" 1
309 1 20 SER HB3 1 28 THR H . . 5.150 4.590 2.382 5.213 0.063 9 0 "[ . 1 . 2 . 3 ]" 1
310 1 21 GLY H 1 22 ARG H . . 4.360 2.846 2.504 4.397 0.037 6 0 "[ . 1 . 2 . 3 ]" 1
311 1 22 ARG H 1 22 ARG HB2 . . 3.890 2.449 2.018 3.015 . 0 0 "[ . 1 . 2 . 3 ]" 1
312 1 22 ARG H 1 22 ARG QB . . 3.540 2.318 2.002 2.916 . 0 0 "[ . 1 . 2 . 3 ]" 1
313 1 22 ARG H 1 22 ARG HB3 . . 3.890 3.201 2.257 3.875 . 0 0 "[ . 1 . 2 . 3 ]" 1
314 1 22 ARG H 1 22 ARG QD . . 4.670 4.084 2.442 4.707 0.037 2 0 "[ . 1 . 2 . 3 ]" 1
315 1 22 ARG H 1 22 ARG HG2 . . 4.560 3.812 2.431 4.566 0.006 15 0 "[ . 1 . 2 . 3 ]" 1
316 1 22 ARG H 1 22 ARG HG3 . . 4.560 4.005 2.952 4.589 0.029 7 0 "[ . 1 . 2 . 3 ]" 1
317 1 22 ARG H 1 23 GLU H . . 3.980 2.895 1.792 4.109 0.129 20 0 "[ . 1 . 2 . 3 ]" 1
318 1 22 ARG H 1 33 GLU QB . . 4.680 4.313 3.699 4.717 0.037 7 0 "[ . 1 . 2 . 3 ]" 1
319 1 22 ARG HA 1 22 ARG HD2 . . 5.500 3.737 2.177 4.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
320 1 22 ARG HA 1 22 ARG QD . . 4.390 3.238 2.030 4.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
321 1 22 ARG HA 1 22 ARG HD3 . . 5.500 3.786 2.053 5.094 . 0 0 "[ . 1 . 2 . 3 ]" 1
322 1 22 ARG HA 1 22 ARG QG . . 3.620 2.679 2.214 3.426 . 0 0 "[ . 1 . 2 . 3 ]" 1
323 1 22 ARG QB 1 23 GLU H . . 3.880 3.113 1.973 3.946 0.066 7 0 "[ . 1 . 2 . 3 ]" 1
324 1 22 ARG HB2 1 23 GLU H . . 4.750 3.780 2.654 4.618 . 0 0 "[ . 1 . 2 . 3 ]" 1
325 1 22 ARG HB3 1 23 GLU H . . 4.750 3.531 2.035 4.428 . 0 0 "[ . 1 . 2 . 3 ]" 1
326 1 23 GLU H 1 23 GLU HB2 . . 4.200 3.349 2.577 4.208 0.008 21 0 "[ . 1 . 2 . 3 ]" 1
327 1 23 GLU H 1 23 GLU QB . . 3.650 2.995 2.315 3.595 . 0 0 "[ . 1 . 2 . 3 ]" 1
328 1 23 GLU H 1 23 GLU HB3 . . 4.200 3.577 2.374 4.202 0.002 26 0 "[ . 1 . 2 . 3 ]" 1
329 1 23 GLU H 1 23 GLU QG . . 4.540 3.666 2.058 4.417 . 0 0 "[ . 1 . 2 . 3 ]" 1
330 1 26 LYS HA 1 28 THR H . . 5.240 3.810 2.671 4.932 . 0 0 "[ . 1 . 2 . 3 ]" 1
331 1 26 LYS QB 1 27 LEU H . . 4.500 3.447 2.481 4.083 . 0 0 "[ . 1 . 2 . 3 ]" 1
332 1 27 LEU H 1 27 LEU MD1 . . 5.010 4.045 2.376 4.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
333 1 27 LEU H 1 27 LEU MD2 . . 5.010 3.810 1.746 5.074 0.064 8 0 "[ . 1 . 2 . 3 ]" 1
334 1 27 LEU H 1 27 LEU HG . . 4.560 3.748 2.281 4.636 0.076 8 0 "[ . 1 . 2 . 3 ]" 1
335 1 27 LEU H 1 28 THR H . . 4.240 2.423 1.790 3.527 . 0 0 "[ . 1 . 2 . 3 ]" 1
336 1 27 LEU HA 1 27 LEU MD1 . . 4.440 3.242 2.088 4.113 . 0 0 "[ . 1 . 2 . 3 ]" 1
337 1 27 LEU HA 1 27 LEU QD . . 3.670 2.480 2.080 3.475 . 0 0 "[ . 1 . 2 . 3 ]" 1
338 1 27 LEU HA 1 27 LEU MD2 . . 4.440 3.206 2.130 4.120 . 0 0 "[ . 1 . 2 . 3 ]" 1
339 1 27 LEU HA 1 27 LEU HG . . 4.150 3.165 2.273 3.828 . 0 0 "[ . 1 . 2 . 3 ]" 1
340 1 27 LEU HA 1 28 THR MG . . 5.500 4.561 4.110 5.117 . 0 0 "[ . 1 . 2 . 3 ]" 1
341 1 27 LEU QB 1 28 THR H . . 4.410 3.144 2.264 4.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
342 1 27 LEU HB2 1 28 THR H . . 5.100 3.658 2.506 4.523 . 0 0 "[ . 1 . 2 . 3 ]" 1
343 1 27 LEU HB3 1 28 THR H . . 5.100 3.700 2.298 4.635 . 0 0 "[ . 1 . 2 . 3 ]" 1
344 1 27 LEU QD 1 28 THR H . . 4.460 3.953 2.289 4.489 0.029 16 0 "[ . 1 . 2 . 3 ]" 1
345 1 27 LEU MD1 1 28 THR H . . 5.500 4.570 2.401 5.242 . 0 0 "[ . 1 . 2 . 3 ]" 1
346 1 27 LEU MD2 1 28 THR H . . 5.500 4.580 2.295 5.404 . 0 0 "[ . 1 . 2 . 3 ]" 1
347 1 27 LEU HG 1 28 THR H . . 4.920 4.354 3.065 4.982 0.062 9 0 "[ . 1 . 2 . 3 ]" 1
348 1 28 THR H 1 28 THR MG . . 4.720 2.862 2.182 3.489 . 0 0 "[ . 1 . 2 . 3 ]" 1
349 1 28 THR HB 1 29 LEU H . . 5.500 2.707 2.154 3.190 . 0 0 "[ . 1 . 2 . 3 ]" 1
350 1 28 THR HB 1 66 GLU QB . . 4.170 2.467 1.967 3.913 . 0 0 "[ . 1 . 2 . 3 ]" 1
351 1 28 THR HB 1 66 GLU QG . . 4.960 3.707 2.560 4.735 . 0 0 "[ . 1 . 2 . 3 ]" 1
352 1 28 THR HB 1 67 ILE H . . 5.500 3.319 2.615 4.201 . 0 0 "[ . 1 . 2 . 3 ]" 1
353 1 28 THR MG 1 29 LEU H . . 5.210 3.612 2.682 4.090 . 0 0 "[ . 1 . 2 . 3 ]" 1
354 1 28 THR MG 1 66 GLU HA . . 5.500 4.608 3.941 5.520 0.020 13 0 "[ . 1 . 2 . 3 ]" 1
355 1 28 THR MG 1 66 GLU QB . . 4.300 2.698 2.183 3.961 . 0 0 "[ . 1 . 2 . 3 ]" 1
356 1 28 THR MG 1 66 GLU QG . . 5.340 3.722 2.592 4.941 . 0 0 "[ . 1 . 2 . 3 ]" 1
357 1 28 THR MG 1 67 ILE H . . 5.500 4.212 3.660 5.194 . 0 0 "[ . 1 . 2 . 3 ]" 1
358 1 28 THR MG 1 68 ASP H . . 5.500 3.694 2.848 4.873 . 0 0 "[ . 1 . 2 . 3 ]" 1
359 1 28 THR MG 1 68 ASP HA . . 4.670 2.462 2.023 3.615 . 0 0 "[ . 1 . 2 . 3 ]" 1
360 1 28 THR MG 1 68 ASP HB2 . . 4.950 3.398 2.180 4.960 0.010 11 0 "[ . 1 . 2 . 3 ]" 1
361 1 28 THR MG 1 68 ASP QB . . 4.330 3.140 2.157 4.332 0.002 11 0 "[ . 1 . 2 . 3 ]" 1
362 1 28 THR MG 1 68 ASP HB3 . . 4.950 4.082 3.143 4.956 0.006 29 0 "[ . 1 . 2 . 3 ]" 1
363 1 28 THR MG 1 69 PHE H . . 5.500 4.202 3.128 5.506 0.006 27 0 "[ . 1 . 2 . 3 ]" 1
364 1 29 LEU H 1 29 LEU MD1 . . 5.500 3.614 2.155 4.305 . 0 0 "[ . 1 . 2 . 3 ]" 1
365 1 29 LEU H 1 29 LEU MD2 . . 5.500 3.675 2.289 4.272 . 0 0 "[ . 1 . 2 . 3 ]" 1
366 1 29 LEU H 1 29 LEU HG . . 5.500 3.029 2.234 4.374 . 0 0 "[ . 1 . 2 . 3 ]" 1
367 1 29 LEU H 1 67 ILE H . . 5.500 2.999 2.598 3.795 . 0 0 "[ . 1 . 2 . 3 ]" 1
368 1 29 LEU H 1 67 ILE HB . . 5.500 3.012 2.507 3.893 . 0 0 "[ . 1 . 2 . 3 ]" 1
369 1 29 LEU QB 1 33 GLU QB . . 4.760 2.714 1.984 4.428 . 0 0 "[ . 1 . 2 . 3 ]" 1
370 1 29 LEU QB 1 37 LEU QD . . 5.280 3.931 3.380 5.148 . 0 0 "[ . 1 . 2 . 3 ]" 1
371 1 29 LEU QB 1 67 ILE HB . . 4.590 2.412 2.035 4.413 . 0 0 "[ . 1 . 2 . 3 ]" 1
372 1 29 LEU QD 1 30 SER H . . 5.440 4.017 3.412 4.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
373 1 29 LEU QD 1 33 GLU H . . 5.440 4.879 4.294 5.469 0.029 30 0 "[ . 1 . 2 . 3 ]" 1
374 1 29 LEU QD 1 33 GLU HA . . 5.440 4.232 3.578 5.475 0.035 15 0 "[ . 1 . 2 . 3 ]" 1
375 1 29 LEU QD 1 33 GLU QG . . 5.280 3.861 2.095 5.079 . 0 0 "[ . 1 . 2 . 3 ]" 1
376 1 29 LEU QD 1 34 LEU H . . 5.440 3.696 3.259 4.391 . 0 0 "[ . 1 . 2 . 3 ]" 1
377 1 29 LEU QD 1 34 LEU HA . . 5.440 2.673 2.148 3.220 . 0 0 "[ . 1 . 2 . 3 ]" 1
378 1 29 LEU QD 1 37 LEU QD . . 5.370 2.111 1.771 3.186 . 0 0 "[ . 1 . 2 . 3 ]" 1
379 1 29 LEU QD 1 67 ILE HB . . 5.440 3.093 2.016 3.782 . 0 0 "[ . 1 . 2 . 3 ]" 1
380 1 29 LEU MD1 1 34 LEU HA . . 5.500 3.061 2.272 4.881 . 0 0 "[ . 1 . 2 . 3 ]" 1
381 1 29 LEU MD1 1 72 TYR QE . . 5.500 3.295 2.240 5.445 . 0 0 "[ . 1 . 2 . 3 ]" 1
382 1 29 LEU MD2 1 34 LEU HA . . 5.500 3.506 2.253 5.398 . 0 0 "[ . 1 . 2 . 3 ]" 1
383 1 29 LEU MD2 1 72 TYR QE . . 5.500 4.336 2.243 5.197 . 0 0 "[ . 1 . 2 . 3 ]" 1
384 1 29 LEU HG 1 30 SER H . . 5.500 5.248 4.253 5.623 0.123 24 0 "[ . 1 . 2 . 3 ]" 1
385 1 29 LEU HG 1 67 ILE H . . 5.500 5.276 3.071 5.560 0.060 10 0 "[ . 1 . 2 . 3 ]" 1
386 1 29 LEU HG 1 67 ILE HB . . 4.940 4.024 2.040 4.988 0.048 6 0 "[ . 1 . 2 . 3 ]" 1
387 1 29 LEU HG 1 67 ILE MG . . 4.830 4.295 3.205 4.859 0.029 6 0 "[ . 1 . 2 . 3 ]" 1
388 1 29 LEU HG 1 72 TYR QD . . 5.350 4.843 4.260 5.286 . 0 0 "[ . 1 . 2 . 3 ]" 1
389 1 29 LEU HG 1 72 TYR QE . . 5.500 5.200 4.482 5.542 0.042 3 0 "[ . 1 . 2 . 3 ]" 1
390 1 30 SER H 1 33 GLU HG2 . . 5.500 4.093 2.762 4.957 . 0 0 "[ . 1 . 2 . 3 ]" 1
391 1 30 SER H 1 33 GLU QG . . 5.500 2.915 2.280 3.631 . 0 0 "[ . 1 . 2 . 3 ]" 1
392 1 30 SER H 1 33 GLU HG3 . . 5.500 3.095 2.301 4.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
393 1 30 SER HA 1 56 MET ME . . 5.500 3.736 2.680 4.793 . 0 0 "[ . 1 . 2 . 3 ]" 1
394 1 30 SER HA 1 66 GLU QG . . 5.150 3.467 1.908 4.734 . 0 0 "[ . 1 . 2 . 3 ]" 1
395 1 31 ARG H 1 31 ARG QG . . 5.130 3.824 2.174 4.279 . 0 0 "[ . 1 . 2 . 3 ]" 1
396 1 31 ARG H 1 32 LYS H . . 4.630 3.236 2.977 3.967 . 0 0 "[ . 1 . 2 . 3 ]" 1
397 1 31 ARG H 1 34 LEU H . . 5.460 4.875 4.659 5.124 . 0 0 "[ . 1 . 2 . 3 ]" 1
398 1 31 ARG H 1 56 MET ME . . 5.500 3.100 2.364 4.015 . 0 0 "[ . 1 . 2 . 3 ]" 1
399 1 31 ARG HA 1 31 ARG QB . . 2.770 2.383 2.091 2.554 . 0 0 "[ . 1 . 2 . 3 ]" 1
400 1 31 ARG HA 1 31 ARG QD . . 4.830 3.464 2.251 4.293 . 0 0 "[ . 1 . 2 . 3 ]" 1
401 1 31 ARG HA 1 31 ARG QG . . 3.190 2.570 2.127 3.295 0.105 15 0 "[ . 1 . 2 . 3 ]" 1
402 1 31 ARG HA 1 34 LEU QB . . 3.390 2.847 2.265 3.438 0.048 11 0 "[ . 1 . 2 . 3 ]" 1
403 1 31 ARG HA 1 34 LEU QD . . 4.590 3.718 2.634 4.603 0.013 28 0 "[ . 1 . 2 . 3 ]" 1
404 1 31 ARG HA 1 56 MET ME . . 5.500 2.509 2.035 2.991 . 0 0 "[ . 1 . 2 . 3 ]" 1
405 1 31 ARG QB 1 32 LYS H . . 3.490 2.879 2.342 3.548 0.058 15 0 "[ . 1 . 2 . 3 ]" 1
406 1 31 ARG QD 1 32 LYS H . . 5.500 4.812 3.166 5.542 0.042 31 0 "[ . 1 . 2 . 3 ]" 1
407 1 31 ARG QD 1 52 ILE MG . . 5.500 4.970 2.825 5.534 0.034 28 0 "[ . 1 . 2 . 3 ]" 1
408 1 31 ARG QD 1 56 MET ME . . 5.500 3.590 1.980 5.121 . 0 0 "[ . 1 . 2 . 3 ]" 1
409 1 31 ARG QG 1 32 LYS H . . 4.420 3.962 2.397 4.477 0.057 4 0 "[ . 1 . 2 . 3 ]" 1
410 1 32 LYS H 1 32 LYS QD . . 3.970 2.851 1.715 4.088 0.118 18 0 "[ . 1 . 2 . 3 ]" 1
411 1 32 LYS H 1 32 LYS QE . . 5.500 4.406 2.230 5.613 0.113 24 0 "[ . 1 . 2 . 3 ]" 1
412 1 32 LYS H 1 32 LYS QG . . 4.920 3.189 2.066 4.129 . 0 0 "[ . 1 . 2 . 3 ]" 1
413 1 32 LYS H 1 33 GLU H . . 4.320 2.479 2.097 2.913 . 0 0 "[ . 1 . 2 . 3 ]" 1
414 1 32 LYS H 1 33 GLU QB . . 5.500 4.523 3.557 5.149 . 0 0 "[ . 1 . 2 . 3 ]" 1
415 1 32 LYS HA 1 32 LYS QD . . 4.110 3.447 1.930 4.190 0.080 15 0 "[ . 1 . 2 . 3 ]" 1
416 1 32 LYS HA 1 32 LYS QE . . 5.070 4.519 3.570 5.130 0.060 10 0 "[ . 1 . 2 . 3 ]" 1
417 1 32 LYS HA 1 34 LEU H . . 4.710 4.429 3.908 4.741 0.031 13 0 "[ . 1 . 2 . 3 ]" 1
418 1 32 LYS QB 1 35 LYS H . . 5.500 4.950 4.430 5.382 . 0 0 "[ . 1 . 2 . 3 ]" 1
419 1 32 LYS QD 1 33 GLU H . . 4.660 3.736 3.039 4.715 0.055 18 0 "[ . 1 . 2 . 3 ]" 1
420 1 32 LYS QD 1 34 LEU H . . 5.500 5.432 4.846 5.619 0.119 15 0 "[ . 1 . 2 . 3 ]" 1
421 1 32 LYS QG 1 33 GLU H . . 5.500 3.750 1.748 4.745 . 0 0 "[ . 1 . 2 . 3 ]" 1
422 1 32 LYS QG 1 35 LYS H . . 5.190 5.213 4.940 5.288 0.098 13 0 "[ . 1 . 2 . 3 ]" 1
423 1 33 GLU H 1 33 GLU QG . . 4.400 2.310 1.885 3.875 . 0 0 "[ . 1 . 2 . 3 ]" 1
424 1 33 GLU H 1 34 LEU H . . 4.710 2.580 2.260 2.989 . 0 0 "[ . 1 . 2 . 3 ]" 1
425 1 33 GLU HA 1 36 GLU H . . 4.000 3.829 3.401 4.059 0.059 17 0 "[ . 1 . 2 . 3 ]" 1
426 1 33 GLU QB 1 34 LEU H . . 5.190 2.462 2.224 2.990 . 0 0 "[ . 1 . 2 . 3 ]" 1
427 1 33 GLU QG 1 34 LEU H . . 5.340 3.785 2.920 4.160 . 0 0 "[ . 1 . 2 . 3 ]" 1
428 1 34 LEU H 1 34 LEU QB . . 3.670 2.151 2.020 2.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
429 1 34 LEU H 1 34 LEU MD1 . . 5.010 4.139 3.900 4.322 . 0 0 "[ . 1 . 2 . 3 ]" 1
430 1 34 LEU H 1 34 LEU MD2 . . 5.010 4.139 3.671 4.386 . 0 0 "[ . 1 . 2 . 3 ]" 1
431 1 34 LEU H 1 34 LEU HG . . 5.150 4.425 3.898 4.522 . 0 0 "[ . 1 . 2 . 3 ]" 1
432 1 34 LEU H 1 35 LYS H . . 4.640 2.832 2.614 3.054 . 0 0 "[ . 1 . 2 . 3 ]" 1
433 1 34 LEU H 1 56 MET ME . . 5.330 4.714 3.835 5.350 0.020 15 0 "[ . 1 . 2 . 3 ]" 1
434 1 34 LEU HA 1 34 LEU QD . . 3.700 2.205 2.019 3.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
435 1 34 LEU HA 1 37 LEU H . . 4.570 3.410 3.034 3.824 . 0 0 "[ . 1 . 2 . 3 ]" 1
436 1 34 LEU HA 1 37 LEU QB . . 3.770 2.559 2.250 2.995 . 0 0 "[ . 1 . 2 . 3 ]" 1
437 1 34 LEU HA 1 37 LEU MD1 . . 5.500 4.117 2.385 5.521 0.021 27 0 "[ . 1 . 2 . 3 ]" 1
438 1 34 LEU HA 1 37 LEU QD . . 4.500 3.264 2.379 4.033 . 0 0 "[ . 1 . 2 . 3 ]" 1
439 1 34 LEU HA 1 37 LEU MD2 . . 5.500 4.038 2.662 5.395 . 0 0 "[ . 1 . 2 . 3 ]" 1
440 1 34 LEU QB 1 35 LYS H . . 5.500 2.588 2.368 2.883 . 0 0 "[ . 1 . 2 . 3 ]" 1
441 1 34 LEU QD 1 37 LEU H . . 5.440 4.436 3.769 5.087 . 0 0 "[ . 1 . 2 . 3 ]" 1
442 1 34 LEU QD 1 56 MET ME . . 4.550 2.783 2.020 3.761 . 0 0 "[ . 1 . 2 . 3 ]" 1
443 1 34 LEU QD 1 56 MET QG . . 5.230 3.029 1.906 4.726 . 0 0 "[ . 1 . 2 . 3 ]" 1
444 1 34 LEU QD 1 59 LEU QD . . 5.370 2.089 1.698 3.288 . 0 0 "[ . 1 . 2 . 3 ]" 1
445 1 34 LEU MD1 1 35 LYS H . . 4.850 4.237 2.784 4.862 0.012 21 0 "[ . 1 . 2 . 3 ]" 1
446 1 34 LEU MD2 1 35 LYS H . . 4.850 4.284 2.930 4.854 0.004 24 0 "[ . 1 . 2 . 3 ]" 1
447 1 34 LEU HG 1 35 LYS H . . 5.500 4.287 3.422 5.262 . 0 0 "[ . 1 . 2 . 3 ]" 1
448 1 34 LEU HG 1 38 ILE MD . . 4.920 2.953 2.021 4.726 . 0 0 "[ . 1 . 2 . 3 ]" 1
449 1 35 LYS H 1 35 LYS HB2 . . 3.810 2.673 2.200 3.691 . 0 0 "[ . 1 . 2 . 3 ]" 1
450 1 35 LYS H 1 35 LYS QB . . 3.290 2.254 2.001 2.667 . 0 0 "[ . 1 . 2 . 3 ]" 1
451 1 35 LYS H 1 35 LYS HB3 . . 3.810 2.615 2.127 3.617 . 0 0 "[ . 1 . 2 . 3 ]" 1
452 1 35 LYS H 1 35 LYS QD . . 4.740 4.268 3.490 4.748 0.008 30 0 "[ . 1 . 2 . 3 ]" 1
453 1 35 LYS H 1 35 LYS QE . . 5.410 4.536 3.774 5.418 0.008 3 0 "[ . 1 . 2 . 3 ]" 1
454 1 35 LYS H 1 35 LYS HG2 . . 4.940 4.091 2.402 4.536 . 0 0 "[ . 1 . 2 . 3 ]" 1
455 1 35 LYS H 1 35 LYS QG . . 4.320 3.460 2.020 4.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
456 1 35 LYS H 1 35 LYS HG3 . . 4.940 3.905 2.070 4.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
457 1 35 LYS H 1 36 GLU H . . 3.940 2.822 2.581 3.022 . 0 0 "[ . 1 . 2 . 3 ]" 1
458 1 35 LYS H 1 52 ILE MD . . 5.500 5.344 4.696 5.539 0.039 5 0 "[ . 1 . 2 . 3 ]" 1
459 1 35 LYS H 1 52 ILE MG . . 5.500 3.976 3.601 4.305 . 0 0 "[ . 1 . 2 . 3 ]" 1
460 1 35 LYS HA 1 35 LYS QD . . 4.450 4.123 2.234 4.466 0.016 22 0 "[ . 1 . 2 . 3 ]" 1
461 1 35 LYS HA 1 38 ILE HB . . 3.620 3.344 2.598 3.683 0.063 8 0 "[ . 1 . 2 . 3 ]" 1
462 1 35 LYS HA 1 38 ILE MD . . 4.950 2.602 2.222 3.321 . 0 0 "[ . 1 . 2 . 3 ]" 1
463 1 35 LYS HA 1 38 ILE MG . . 5.500 4.693 4.035 5.072 . 0 0 "[ . 1 . 2 . 3 ]" 1
464 1 35 LYS HA 1 52 ILE MD . . 4.490 2.929 2.289 3.533 . 0 0 "[ . 1 . 2 . 3 ]" 1
465 1 35 LYS HA 1 52 ILE MG . . 5.500 2.245 2.038 2.630 . 0 0 "[ . 1 . 2 . 3 ]" 1
466 1 35 LYS QB 1 35 LYS QE . . 3.740 2.480 1.958 3.671 . 0 0 "[ . 1 . 2 . 3 ]" 1
467 1 35 LYS QB 1 36 GLU H . . 3.740 2.804 2.299 3.833 0.093 15 0 "[ . 1 . 2 . 3 ]" 1
468 1 35 LYS QB 1 52 ILE MD . . 4.440 3.773 2.123 4.464 0.024 26 0 "[ . 1 . 2 . 3 ]" 1
469 1 35 LYS HB2 1 36 GLU H . . 4.300 3.793 2.440 4.300 0.000 15 0 "[ . 1 . 2 . 3 ]" 1
470 1 35 LYS HB3 1 36 GLU H . . 4.300 3.052 2.322 4.305 0.005 15 0 "[ . 1 . 2 . 3 ]" 1
471 1 35 LYS QD 1 36 GLU H . . 4.490 4.267 2.731 4.616 0.126 29 0 "[ . 1 . 2 . 3 ]" 1
472 1 35 LYS QD 1 52 ILE MD . . 5.500 4.345 2.479 5.505 0.005 16 0 "[ . 1 . 2 . 3 ]" 1
473 1 35 LYS QE 1 38 ILE MD . . 5.500 5.114 4.276 5.516 0.016 7 0 "[ . 1 . 2 . 3 ]" 1
474 1 35 LYS QE 1 52 ILE MD . . 5.500 3.742 1.988 5.300 . 0 0 "[ . 1 . 2 . 3 ]" 1
475 1 35 LYS QE 1 52 ILE MG . . 5.500 2.970 1.851 5.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
476 1 35 LYS QG 1 36 GLU H . . 4.520 3.589 2.444 4.379 . 0 0 "[ . 1 . 2 . 3 ]" 1
477 1 35 LYS HG2 1 36 GLU H . . 5.240 4.023 2.755 5.042 . 0 0 "[ . 1 . 2 . 3 ]" 1
478 1 35 LYS HG3 1 36 GLU H . . 5.240 4.371 2.528 5.265 0.025 7 0 "[ . 1 . 2 . 3 ]" 1
479 1 36 GLU H 1 36 GLU HB2 . . 3.890 2.500 2.206 3.152 . 0 0 "[ . 1 . 2 . 3 ]" 1
480 1 36 GLU H 1 36 GLU QB . . 3.200 2.286 2.160 2.490 . 0 0 "[ . 1 . 2 . 3 ]" 1
481 1 36 GLU H 1 36 GLU HB3 . . 3.890 2.732 2.334 3.554 . 0 0 "[ . 1 . 2 . 3 ]" 1
482 1 36 GLU H 1 36 GLU HG2 . . 4.880 4.597 4.169 4.852 . 0 0 "[ . 1 . 2 . 3 ]" 1
483 1 36 GLU H 1 36 GLU QG . . 4.270 4.032 3.553 4.221 . 0 0 "[ . 1 . 2 . 3 ]" 1
484 1 36 GLU H 1 36 GLU HG3 . . 4.880 4.465 3.850 4.663 . 0 0 "[ . 1 . 2 . 3 ]" 1
485 1 36 GLU H 1 37 LEU H . . 4.290 2.783 2.393 3.238 . 0 0 "[ . 1 . 2 . 3 ]" 1
486 1 36 GLU HA 1 40 LYS QG . . 4.950 3.925 3.027 5.001 0.051 22 0 "[ . 1 . 2 . 3 ]" 1
487 1 36 GLU QB 1 37 LEU H . . 3.940 2.729 2.235 3.669 . 0 0 "[ . 1 . 2 . 3 ]" 1
488 1 36 GLU HG2 1 40 LYS HG2 . . 5.500 4.797 2.597 5.635 0.135 6 0 "[ . 1 . 2 . 3 ]" 1
489 1 36 GLU HG2 1 40 LYS HG3 . . 5.500 4.325 2.166 5.559 0.059 26 0 "[ . 1 . 2 . 3 ]" 1
490 1 36 GLU HG3 1 40 LYS HG2 . . 5.500 4.089 2.810 5.527 0.027 2 0 "[ . 1 . 2 . 3 ]" 1
491 1 36 GLU HG3 1 40 LYS HG3 . . 5.500 3.723 2.276 5.079 . 0 0 "[ . 1 . 2 . 3 ]" 1
492 1 37 LEU H 1 37 LEU HB2 . . 4.090 2.484 2.165 3.159 . 0 0 "[ . 1 . 2 . 3 ]" 1
493 1 37 LEU H 1 37 LEU HB3 . . 4.090 2.482 2.201 3.568 . 0 0 "[ . 1 . 2 . 3 ]" 1
494 1 37 LEU H 1 37 LEU MD1 . . 4.910 4.193 3.639 4.449 . 0 0 "[ . 1 . 2 . 3 ]" 1
495 1 37 LEU H 1 37 LEU MD2 . . 4.910 4.217 3.953 4.367 . 0 0 "[ . 1 . 2 . 3 ]" 1
496 1 37 LEU H 1 37 LEU HG . . 5.350 4.350 2.838 4.597 . 0 0 "[ . 1 . 2 . 3 ]" 1
497 1 37 LEU H 1 38 ILE H . . 4.280 2.913 2.299 3.222 . 0 0 "[ . 1 . 2 . 3 ]" 1
498 1 37 LEU HA 1 37 LEU QD . . 4.200 2.570 2.148 3.182 . 0 0 "[ . 1 . 2 . 3 ]" 1
499 1 37 LEU HA 1 40 LYS QD . . 5.190 4.698 3.412 5.283 0.093 5 0 "[ . 1 . 2 . 3 ]" 1
500 1 37 LEU HA 1 40 LYS QG . . 4.800 3.846 2.391 4.811 0.011 22 0 "[ . 1 . 2 . 3 ]" 1
501 1 37 LEU HA 1 41 GLU H . . 5.100 4.069 3.539 5.088 . 0 0 "[ . 1 . 2 . 3 ]" 1
502 1 37 LEU QB 1 38 ILE H . . 4.770 2.373 2.148 2.591 . 0 0 "[ . 1 . 2 . 3 ]" 1
503 1 37 LEU QD 1 38 ILE H . . 4.460 3.224 2.585 3.970 . 0 0 "[ . 1 . 2 . 3 ]" 1
504 1 37 LEU QD 1 38 ILE HA . . 4.860 3.281 2.324 4.755 . 0 0 "[ . 1 . 2 . 3 ]" 1
505 1 37 LEU QD 1 40 LYS H . . 5.290 4.400 3.794 4.879 . 0 0 "[ . 1 . 2 . 3 ]" 1
506 1 37 LEU QD 1 41 GLU H . . 5.440 3.635 2.774 4.331 . 0 0 "[ . 1 . 2 . 3 ]" 1
507 1 37 LEU QD 1 72 TYR QE . . 5.440 2.319 1.995 2.695 . 0 0 "[ . 1 . 2 . 3 ]" 1
508 1 37 LEU QD 1 75 PHE QD . . 5.440 3.748 2.639 4.494 . 0 0 "[ . 1 . 2 . 3 ]" 1
509 1 37 LEU QD 1 75 PHE QE . . 5.440 2.851 2.096 3.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
510 1 37 LEU MD1 1 38 ILE H . . 5.200 4.092 2.635 4.583 . 0 0 "[ . 1 . 2 . 3 ]" 1
511 1 37 LEU MD1 1 75 PHE HZ . . 5.500 5.325 3.273 5.549 0.049 26 0 "[ . 1 . 2 . 3 ]" 1
512 1 37 LEU MD2 1 38 ILE H . . 5.200 3.534 2.616 4.587 . 0 0 "[ . 1 . 2 . 3 ]" 1
513 1 37 LEU MD2 1 75 PHE HZ . . 5.500 4.469 3.088 5.531 0.031 20 0 "[ . 1 . 2 . 3 ]" 1
514 1 38 ILE H 1 38 ILE HB . . 3.920 2.632 2.437 2.794 . 0 0 "[ . 1 . 2 . 3 ]" 1
515 1 38 ILE H 1 38 ILE MD . . 4.520 3.238 3.101 3.635 . 0 0 "[ . 1 . 2 . 3 ]" 1
516 1 38 ILE H 1 38 ILE QG . . 4.640 2.116 1.949 2.351 . 0 0 "[ . 1 . 2 . 3 ]" 1
517 1 38 ILE H 1 38 ILE MG . . 4.630 3.843 3.794 3.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
518 1 38 ILE HA 1 41 GLU H . . 4.860 3.580 3.193 4.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
519 1 38 ILE HA 1 41 GLU QB . . 4.620 2.928 2.126 4.335 . 0 0 "[ . 1 . 2 . 3 ]" 1
520 1 38 ILE HA 1 42 LEU H . . 5.500 3.500 2.987 4.651 . 0 0 "[ . 1 . 2 . 3 ]" 1
521 1 38 ILE HA 1 42 LEU QB . . 4.380 3.848 2.478 4.418 0.038 13 0 "[ . 1 . 2 . 3 ]" 1
522 1 38 ILE HA 1 42 LEU QD . . 4.660 3.573 2.438 4.725 0.065 31 0 "[ . 1 . 2 . 3 ]" 1
523 1 38 ILE HA 1 42 LEU HG . . 5.500 4.809 3.360 5.531 0.031 2 0 "[ . 1 . 2 . 3 ]" 1
524 1 38 ILE HB 1 75 PHE QE . . 5.500 5.227 4.936 5.524 0.024 8 0 "[ . 1 . 2 . 3 ]" 1
525 1 38 ILE MD 1 39 LYS H . . 5.200 4.141 3.838 4.431 . 0 0 "[ . 1 . 2 . 3 ]" 1
526 1 38 ILE MD 1 39 LYS HA . . 5.500 5.573 5.534 5.618 0.118 9 0 "[ . 1 . 2 . 3 ]" 1
527 1 38 ILE MD 1 47 MET ME . . 4.770 4.027 2.632 4.650 . 0 0 "[ . 1 . 2 . 3 ]" 1
528 1 38 ILE MD 1 47 MET HG2 . . 5.500 4.603 3.392 5.514 0.014 10 0 "[ . 1 . 2 . 3 ]" 1
529 1 38 ILE MD 1 47 MET HG3 . . 5.500 4.282 3.098 4.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
530 1 38 ILE MD 1 52 ILE MD . . 5.440 2.816 1.921 4.122 . 0 0 "[ . 1 . 2 . 3 ]" 1
531 1 38 ILE MD 1 56 MET HA . . 4.390 4.385 4.009 4.466 0.076 12 0 "[ . 1 . 2 . 3 ]" 1
532 1 38 ILE MD 1 75 PHE QD . . 5.500 4.628 4.199 5.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
533 1 38 ILE MD 1 75 PHE QE . . 5.170 3.873 3.348 4.331 . 0 0 "[ . 1 . 2 . 3 ]" 1
534 1 38 ILE MD 1 75 PHE HZ . . 5.500 4.201 3.267 5.048 . 0 0 "[ . 1 . 2 . 3 ]" 1
535 1 38 ILE QG 1 42 LEU QB . . 5.500 4.930 3.847 5.513 0.013 17 0 "[ . 1 . 2 . 3 ]" 1
536 1 38 ILE QG 1 75 PHE QE . . 5.500 2.916 2.378 3.330 . 0 0 "[ . 1 . 2 . 3 ]" 1
537 1 38 ILE QG 1 75 PHE HZ . . 5.500 2.602 2.186 3.400 . 0 0 "[ . 1 . 2 . 3 ]" 1
538 1 38 ILE MG 1 39 LYS H . . 4.590 3.349 3.013 3.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
539 1 38 ILE MG 1 39 LYS HA . . 5.280 3.218 2.947 3.818 . 0 0 "[ . 1 . 2 . 3 ]" 1
540 1 38 ILE MG 1 47 MET ME . . 4.950 3.058 2.157 4.106 . 0 0 "[ . 1 . 2 . 3 ]" 1
541 1 38 ILE MG 1 47 MET HG2 . . 5.500 2.416 1.987 3.826 . 0 0 "[ . 1 . 2 . 3 ]" 1
542 1 38 ILE MG 1 47 MET HG3 . . 5.500 2.694 1.966 4.112 . 0 0 "[ . 1 . 2 . 3 ]" 1
543 1 38 ILE MG 1 52 ILE MD . . 5.500 2.822 2.095 5.005 . 0 0 "[ . 1 . 2 . 3 ]" 1
544 1 38 ILE MG 1 75 PHE QD . . 5.500 4.831 4.235 5.513 0.013 12 0 "[ . 1 . 2 . 3 ]" 1
545 1 38 ILE MG 1 75 PHE QE . . 5.500 3.091 2.441 3.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
546 1 38 ILE MG 1 75 PHE HZ . . 5.500 2.582 2.111 3.661 . 0 0 "[ . 1 . 2 . 3 ]" 1
547 1 39 LYS H 1 39 LYS QB . . 3.640 2.231 1.929 2.775 . 0 0 "[ . 1 . 2 . 3 ]" 1
548 1 39 LYS H 1 39 LYS QD . . 4.320 4.001 2.885 4.448 0.128 19 0 "[ . 1 . 2 . 3 ]" 1
549 1 39 LYS H 1 39 LYS QE . . 5.500 4.858 3.711 5.621 0.121 13 0 "[ . 1 . 2 . 3 ]" 1
550 1 39 LYS H 1 39 LYS QG . . 4.880 3.157 2.020 4.085 . 0 0 "[ . 1 . 2 . 3 ]" 1
551 1 39 LYS HA 1 39 LYS QB . . 2.790 2.397 2.108 2.568 . 0 0 "[ . 1 . 2 . 3 ]" 1
552 1 39 LYS HA 1 39 LYS QD . . 3.920 3.125 2.037 4.010 0.090 26 0 "[ . 1 . 2 . 3 ]" 1
553 1 39 LYS HA 1 41 GLU H . . 5.180 4.544 3.891 5.203 0.023 14 0 "[ . 1 . 2 . 3 ]" 1
554 1 40 LYS H 1 40 LYS HB2 . . 3.940 2.413 2.073 2.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
555 1 40 LYS H 1 40 LYS QB . . 3.400 2.376 2.033 2.738 . 0 0 "[ . 1 . 2 . 3 ]" 1
556 1 40 LYS H 1 40 LYS HB3 . . 3.940 3.582 2.728 3.811 . 0 0 "[ . 1 . 2 . 3 ]" 1
557 1 40 LYS H 1 40 LYS QD . . 4.360 3.990 2.956 4.471 0.111 14 0 "[ . 1 . 2 . 3 ]" 1
558 1 40 LYS H 1 40 LYS HG2 . . 4.600 3.356 2.307 4.504 . 0 0 "[ . 1 . 2 . 3 ]" 1
559 1 40 LYS H 1 40 LYS QG . . 4.020 2.903 2.284 4.002 . 0 0 "[ . 1 . 2 . 3 ]" 1
560 1 40 LYS H 1 40 LYS HG3 . . 4.600 3.622 2.638 4.581 . 0 0 "[ . 1 . 2 . 3 ]" 1
561 1 40 LYS H 1 41 GLU H . . 4.330 2.259 1.877 2.692 . 0 0 "[ . 1 . 2 . 3 ]" 1
562 1 40 LYS H 1 42 LEU H . . 4.610 3.997 3.429 4.647 0.037 8 0 "[ . 1 . 2 . 3 ]" 1
563 1 40 LYS HA 1 40 LYS QD . . 4.020 2.917 2.042 4.078 0.058 6 0 "[ . 1 . 2 . 3 ]" 1
564 1 40 LYS HA 1 40 LYS QE . . 4.620 4.069 1.973 4.750 0.130 30 0 "[ . 1 . 2 . 3 ]" 1
565 1 40 LYS HA 1 40 LYS HG2 . . 3.960 2.838 2.261 3.800 . 0 0 "[ . 1 . 2 . 3 ]" 1
566 1 40 LYS HA 1 40 LYS HG3 . . 3.960 3.462 2.538 3.954 . 0 0 "[ . 1 . 2 . 3 ]" 1
567 1 40 LYS QB 1 41 GLU H . . 4.100 2.646 2.069 3.126 . 0 0 "[ . 1 . 2 . 3 ]" 1
568 1 40 LYS HB2 1 41 GLU H . . 4.790 2.773 2.092 3.698 . 0 0 "[ . 1 . 2 . 3 ]" 1
569 1 40 LYS HB3 1 41 GLU H . . 4.790 3.539 2.722 4.210 . 0 0 "[ . 1 . 2 . 3 ]" 1
570 1 40 LYS QD 1 41 GLU H . . 4.830 4.801 4.471 4.888 0.058 14 0 "[ . 1 . 2 . 3 ]" 1
571 1 40 LYS QG 1 41 GLU H . . 4.820 4.226 3.734 4.831 0.011 26 0 "[ . 1 . 2 . 3 ]" 1
572 1 40 LYS HG2 1 41 GLU H . . 5.500 4.759 4.012 5.521 0.021 29 0 "[ . 1 . 2 . 3 ]" 1
573 1 40 LYS HG3 1 41 GLU H . . 5.500 4.827 4.152 5.527 0.027 22 0 "[ . 1 . 2 . 3 ]" 1
574 1 41 GLU H 1 42 LEU H . . 4.380 2.739 2.307 3.658 . 0 0 "[ . 1 . 2 . 3 ]" 1
575 1 41 GLU H 1 42 LEU QD . . 5.440 4.535 3.606 5.425 . 0 0 "[ . 1 . 2 . 3 ]" 1
576 1 41 GLU HA 2 3 THR MG . . 5.500 2.611 1.949 4.714 . 0 0 "[ . 1 . 2 . 3 ]" 1
577 1 41 GLU QB 1 42 LEU H . . 4.300 2.445 1.785 3.676 . 0 0 "[ . 1 . 2 . 3 ]" 1
578 1 41 GLU QB 1 42 LEU QB . . 4.390 3.805 3.124 4.415 0.025 12 0 "[ . 1 . 2 . 3 ]" 1
579 1 41 GLU QB 1 42 LEU MD1 . . 5.500 4.269 2.210 5.497 . 0 0 "[ . 1 . 2 . 3 ]" 1
580 1 41 GLU QB 1 42 LEU QD . . 4.290 2.818 1.942 3.943 . 0 0 "[ . 1 . 2 . 3 ]" 1
581 1 41 GLU QB 1 42 LEU MD2 . . 5.500 3.082 1.946 5.115 . 0 0 "[ . 1 . 2 . 3 ]" 1
582 1 42 LEU H 1 42 LEU MD1 . . 4.670 3.941 2.511 4.339 . 0 0 "[ . 1 . 2 . 3 ]" 1
583 1 42 LEU H 1 42 LEU QD . . 4.440 2.876 1.997 3.838 . 0 0 "[ . 1 . 2 . 3 ]" 1
584 1 42 LEU H 1 42 LEU MD2 . . 4.670 3.108 2.004 4.393 . 0 0 "[ . 1 . 2 . 3 ]" 1
585 1 42 LEU H 1 42 LEU HG . . 5.500 3.643 2.263 5.226 . 0 0 "[ . 1 . 2 . 3 ]" 1
586 1 42 LEU H 1 44 LEU QD . . 5.440 4.913 4.437 5.482 0.042 5 0 "[ . 1 . 2 . 3 ]" 1
587 1 42 LEU HA 1 42 LEU MD1 . . 4.160 2.860 2.096 3.920 . 0 0 "[ . 1 . 2 . 3 ]" 1
588 1 42 LEU HA 1 42 LEU QD . . 3.470 2.125 1.905 2.735 . 0 0 "[ . 1 . 2 . 3 ]" 1
589 1 42 LEU HA 1 42 LEU MD2 . . 4.160 2.480 2.086 3.799 . 0 0 "[ . 1 . 2 . 3 ]" 1
590 1 42 LEU HA 2 6 GLU QB . . 5.500 4.793 3.176 5.565 0.065 2 0 "[ . 1 . 2 . 3 ]" 1
591 1 42 LEU HA 2 6 GLU QG . . 5.500 3.697 2.148 5.481 . 0 0 "[ . 1 . 2 . 3 ]" 1
592 1 42 LEU QD 1 44 LEU H . . 5.440 4.177 2.357 5.028 . 0 0 "[ . 1 . 2 . 3 ]" 1
593 1 42 LEU QD 1 75 PHE QD . . 5.200 4.598 3.776 5.206 0.006 22 0 "[ . 1 . 2 . 3 ]" 1
594 1 42 LEU QD 1 75 PHE QE . . 5.440 3.133 2.297 4.017 . 0 0 "[ . 1 . 2 . 3 ]" 1
595 1 42 LEU QD 1 75 PHE HZ . . 4.860 2.746 1.914 3.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
596 1 42 LEU QD 1 79 LEU QD . . 4.830 1.882 1.729 2.249 . 0 0 "[ . 1 . 2 . 3 ]" 1
597 1 42 LEU QD 2 6 GLU H . . 5.500 4.679 3.385 5.514 0.014 23 0 "[ . 1 . 2 . 3 ]" 1
598 1 42 LEU QD 2 6 GLU QB . . 4.850 3.726 2.269 4.674 . 0 0 "[ . 1 . 2 . 3 ]" 1
599 1 42 LEU QD 2 6 GLU QG . . 5.500 2.712 1.997 4.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
600 1 42 LEU MD1 1 83 TYR QE . . 5.500 4.099 2.387 5.519 0.019 13 0 "[ . 1 . 2 . 3 ]" 1
601 1 42 LEU MD1 2 6 GLU HG2 . . 5.500 4.274 2.286 5.539 0.039 30 0 "[ . 1 . 2 . 3 ]" 1
602 1 42 LEU MD1 2 6 GLU HG3 . . 5.500 4.206 2.241 5.532 0.032 20 0 "[ . 1 . 2 . 3 ]" 1
603 1 42 LEU MD2 1 83 TYR QE . . 5.500 4.328 3.168 5.503 0.003 28 0 "[ . 1 . 2 . 3 ]" 1
604 1 42 LEU MD2 2 6 GLU HG2 . . 5.500 3.588 2.104 5.538 0.038 31 0 "[ . 1 . 2 . 3 ]" 1
605 1 42 LEU MD2 2 6 GLU HG3 . . 5.500 3.636 2.201 5.521 0.021 17 0 "[ . 1 . 2 . 3 ]" 1
606 1 43 CYS QB 1 44 LEU H . . 4.040 3.434 2.187 4.052 0.012 12 0 "[ . 1 . 2 . 3 ]" 1
607 1 43 CYS QB 1 44 LEU QD . . 4.850 4.141 2.943 4.854 0.004 9 0 "[ . 1 . 2 . 3 ]" 1
608 1 44 LEU H 1 44 LEU HB2 . . 4.110 3.221 2.171 4.061 . 0 0 "[ . 1 . 2 . 3 ]" 1
609 1 44 LEU H 1 44 LEU QB . . 3.530 2.643 2.149 3.389 . 0 0 "[ . 1 . 2 . 3 ]" 1
610 1 44 LEU H 1 44 LEU HB3 . . 4.110 3.192 2.207 4.124 0.014 31 0 "[ . 1 . 2 . 3 ]" 1
611 1 44 LEU H 1 44 LEU MD1 . . 5.400 3.259 1.795 4.270 . 0 0 "[ . 1 . 2 . 3 ]" 1
612 1 44 LEU H 1 44 LEU QD . . 4.670 2.275 1.757 3.330 . 0 0 "[ . 1 . 2 . 3 ]" 1
613 1 44 LEU H 1 44 LEU MD2 . . 5.400 2.929 1.760 4.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
614 1 44 LEU H 1 44 LEU HG . . 4.820 3.277 1.929 4.663 . 0 0 "[ . 1 . 2 . 3 ]" 1
615 1 44 LEU HA 1 44 LEU HB2 . . 2.990 2.688 2.276 3.037 0.047 28 0 "[ . 1 . 2 . 3 ]" 1
616 1 44 LEU HA 1 44 LEU QB . . 2.440 2.259 2.124 2.479 0.039 31 0 "[ . 1 . 2 . 3 ]" 1
617 1 44 LEU HA 1 44 LEU HB3 . . 2.990 2.482 2.279 2.643 . 0 0 "[ . 1 . 2 . 3 ]" 1
618 1 44 LEU HA 1 44 LEU QD . . 3.740 2.989 2.028 3.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
619 1 44 LEU HA 1 44 LEU HG . . 3.800 3.391 2.487 3.806 0.006 11 0 "[ . 1 . 2 . 3 ]" 1
620 1 44 LEU QB 1 44 LEU QD . . 2.490 1.967 1.896 2.096 . 0 0 "[ . 1 . 2 . 3 ]" 1
621 1 44 LEU QB 1 45 GLY H . . 4.400 2.954 1.818 4.099 . 0 0 "[ . 1 . 2 . 3 ]" 1
622 1 44 LEU HB2 1 44 LEU MD1 . . 3.520 2.449 2.190 3.262 . 0 0 "[ . 1 . 2 . 3 ]" 1
623 1 44 LEU HB2 1 44 LEU MD2 . . 3.520 2.864 2.174 3.289 . 0 0 "[ . 1 . 2 . 3 ]" 1
624 1 44 LEU HB3 1 44 LEU MD1 . . 3.520 2.734 2.268 3.276 . 0 0 "[ . 1 . 2 . 3 ]" 1
625 1 44 LEU HB3 1 44 LEU MD2 . . 3.520 2.466 2.174 3.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
626 1 44 LEU QD 1 79 LEU QD . . 4.750 4.144 2.290 4.771 0.021 14 0 "[ . 1 . 2 . 3 ]" 1
627 1 44 LEU MD1 1 45 GLY H . . 4.980 4.202 2.063 5.035 0.055 13 0 "[ . 1 . 2 . 3 ]" 1
628 1 44 LEU MD2 1 45 GLY H . . 4.980 3.973 2.138 5.006 0.026 23 0 "[ . 1 . 2 . 3 ]" 1
629 1 44 LEU HG 1 45 GLY H . . 4.780 4.174 3.251 4.832 0.052 23 0 "[ . 1 . 2 . 3 ]" 1
630 1 46 GLU QB 1 47 MET H . . 4.120 3.089 1.938 4.031 . 0 0 "[ . 1 . 2 . 3 ]" 1
631 1 47 MET H 1 47 MET ME . . 5.130 4.476 2.744 5.164 0.034 31 0 "[ . 1 . 2 . 3 ]" 1
632 1 47 MET H 1 47 MET HG2 . . 4.920 4.117 1.915 5.034 0.114 20 0 "[ . 1 . 2 . 3 ]" 1
633 1 47 MET H 1 47 MET HG3 . . 4.920 4.249 3.185 4.941 0.021 20 0 "[ . 1 . 2 . 3 ]" 1
634 1 47 MET HA 1 47 MET ME . . 4.410 3.116 2.117 4.407 . 0 0 "[ . 1 . 2 . 3 ]" 1
635 1 47 MET HA 1 48 LYS H . . 3.300 2.337 1.998 3.374 0.074 24 0 "[ . 1 . 2 . 3 ]" 1
636 1 47 MET QB 1 48 LYS H . . 4.300 3.699 2.726 4.033 . 0 0 "[ . 1 . 2 . 3 ]" 1
637 1 47 MET QB 1 52 ILE MD . . 4.830 3.074 1.959 4.704 . 0 0 "[ . 1 . 2 . 3 ]" 1
638 1 47 MET QB 1 52 ILE QG . . 4.680 3.509 2.028 4.708 0.028 18 0 "[ . 1 . 2 . 3 ]" 1
639 1 47 MET ME 1 48 LYS H . . 5.210 4.666 3.066 5.245 0.035 23 0 "[ . 1 . 2 . 3 ]" 1
640 1 47 MET ME 1 51 SER HA . . 5.500 4.919 4.082 5.542 0.042 18 0 "[ . 1 . 2 . 3 ]" 1
641 1 47 MET ME 1 52 ILE H . . 5.500 4.942 3.022 5.519 0.019 19 0 "[ . 1 . 2 . 3 ]" 1
642 1 47 MET ME 1 52 ILE HA . . 5.500 3.879 2.185 4.796 . 0 0 "[ . 1 . 2 . 3 ]" 1
643 1 47 MET ME 1 52 ILE MD . . 5.500 4.178 2.651 5.365 . 0 0 "[ . 1 . 2 . 3 ]" 1
644 1 47 MET ME 1 52 ILE MG . . 5.500 4.925 3.750 5.521 0.021 28 0 "[ . 1 . 2 . 3 ]" 1
645 1 47 MET ME 1 75 PHE QD . . 5.500 5.382 4.143 5.534 0.034 6 0 "[ . 1 . 2 . 3 ]" 1
646 1 47 MET ME 1 75 PHE QE . . 5.500 4.059 3.230 4.640 . 0 0 "[ . 1 . 2 . 3 ]" 1
647 1 47 MET ME 1 79 LEU QD . . 4.360 4.073 3.174 4.378 0.018 18 0 "[ . 1 . 2 . 3 ]" 1
648 1 47 MET QG 1 48 LYS H . . 4.780 4.212 3.419 4.789 0.009 17 0 "[ . 1 . 2 . 3 ]" 1
649 1 47 MET QG 1 52 ILE MD . . 5.190 2.918 2.026 4.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
650 1 47 MET QG 1 52 ILE MG . . 5.340 4.628 3.496 5.349 0.009 13 0 "[ . 1 . 2 . 3 ]" 1
651 1 47 MET QG 1 79 LEU QD . . 5.280 4.979 4.109 5.319 0.039 22 0 "[ . 1 . 2 . 3 ]" 1
652 1 47 MET HG2 1 48 LYS H . . 5.500 5.309 4.468 5.661 0.161 9 0 "[ . 1 . 2 . 3 ]" 1
653 1 47 MET HG3 1 48 LYS H . . 5.500 4.511 3.484 5.611 0.111 10 0 "[ . 1 . 2 . 3 ]" 1
654 1 48 LYS H 1 48 LYS QD . . 5.500 3.646 1.842 4.979 . 0 0 "[ . 1 . 2 . 3 ]" 1
655 1 48 LYS H 1 48 LYS QG . . 4.780 3.128 1.920 4.111 . 0 0 "[ . 1 . 2 . 3 ]" 1
656 1 48 LYS HA 1 48 LYS QG . . 4.010 2.544 2.097 3.525 . 0 0 "[ . 1 . 2 . 3 ]" 1
657 1 49 GLU H 1 49 GLU HG2 . . 5.180 3.316 2.037 4.651 . 0 0 "[ . 1 . 2 . 3 ]" 1
658 1 49 GLU H 1 49 GLU HG3 . . 5.180 3.667 2.155 4.604 . 0 0 "[ . 1 . 2 . 3 ]" 1
659 1 49 GLU HA 1 52 ILE HB . . 5.500 3.119 2.213 4.115 . 0 0 "[ . 1 . 2 . 3 ]" 1
660 1 49 GLU HA 1 52 ILE MD . . 4.980 3.226 2.108 5.020 0.040 4 0 "[ . 1 . 2 . 3 ]" 1
661 1 49 GLU HA 1 52 ILE HG12 . . 5.500 4.481 2.038 5.526 0.026 23 0 "[ . 1 . 2 . 3 ]" 1
662 1 49 GLU HA 1 52 ILE QG . . 4.770 3.434 1.907 4.310 . 0 0 "[ . 1 . 2 . 3 ]" 1
663 1 49 GLU HA 1 52 ILE HG13 . . 5.500 3.630 2.294 4.500 . 0 0 "[ . 1 . 2 . 3 ]" 1
664 1 49 GLU HA 1 52 ILE MG . . 5.340 4.259 3.356 5.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
665 1 49 GLU QB 1 50 SER H . . 4.660 2.729 1.938 3.529 . 0 0 "[ . 1 . 2 . 3 ]" 1
666 1 51 SER HA 1 53 ASP H . . 4.790 4.211 3.401 4.814 0.024 29 0 "[ . 1 . 2 . 3 ]" 1
667 1 51 SER HA 1 54 ASP H . . 5.500 3.708 2.972 4.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
668 1 52 ILE H 1 52 ILE MD . . 5.500 3.696 3.166 4.242 . 0 0 "[ . 1 . 2 . 3 ]" 1
669 1 52 ILE H 1 52 ILE HG12 . . 5.330 3.353 2.191 4.159 . 0 0 "[ . 1 . 2 . 3 ]" 1
670 1 52 ILE H 1 52 ILE HG13 . . 5.330 2.847 1.807 3.916 . 0 0 "[ . 1 . 2 . 3 ]" 1
671 1 52 ILE H 1 52 ILE MG . . 3.940 3.763 3.694 3.879 . 0 0 "[ . 1 . 2 . 3 ]" 1
672 1 52 ILE H 1 53 ASP H . . 4.300 2.533 2.099 2.953 . 0 0 "[ . 1 . 2 . 3 ]" 1
673 1 52 ILE HA 1 52 ILE MD . . 4.490 3.400 2.246 4.026 . 0 0 "[ . 1 . 2 . 3 ]" 1
674 1 52 ILE HA 1 55 LEU H . . 4.340 3.379 2.875 3.909 . 0 0 "[ . 1 . 2 . 3 ]" 1
675 1 52 ILE HA 1 55 LEU HB2 . . 5.500 3.148 2.189 3.939 . 0 0 "[ . 1 . 2 . 3 ]" 1
676 1 52 ILE HA 1 55 LEU QB . . 3.790 2.244 2.029 2.711 . 0 0 "[ . 1 . 2 . 3 ]" 1
677 1 52 ILE HA 1 55 LEU HB3 . . 5.500 2.419 2.062 3.531 . 0 0 "[ . 1 . 2 . 3 ]" 1
678 1 52 ILE HA 1 55 LEU QD . . 4.810 3.048 2.444 3.855 . 0 0 "[ . 1 . 2 . 3 ]" 1
679 1 52 ILE HB 1 53 ASP H . . 4.260 2.986 2.654 3.335 . 0 0 "[ . 1 . 2 . 3 ]" 1
680 1 52 ILE MD 1 53 ASP H . . 5.160 4.956 4.413 5.164 0.004 18 0 "[ . 1 . 2 . 3 ]" 1
681 1 52 ILE HG12 1 53 ASP H . . 5.500 4.996 4.258 5.439 . 0 0 "[ . 1 . 2 . 3 ]" 1
682 1 52 ILE HG13 1 53 ASP H . . 5.500 4.734 4.066 5.293 . 0 0 "[ . 1 . 2 . 3 ]" 1
683 1 52 ILE MG 1 53 ASP H . . 5.080 3.527 3.177 4.155 . 0 0 "[ . 1 . 2 . 3 ]" 1
684 1 52 ILE MG 1 53 ASP HA . . 5.500 3.436 3.059 4.196 . 0 0 "[ . 1 . 2 . 3 ]" 1
685 1 52 ILE MG 1 56 MET QG . . 5.500 4.178 2.254 5.366 . 0 0 "[ . 1 . 2 . 3 ]" 1
686 1 53 ASP H 1 53 ASP HB2 . . 4.040 2.324 2.048 2.618 . 0 0 "[ . 1 . 2 . 3 ]" 1
687 1 53 ASP H 1 53 ASP HB3 . . 4.040 3.118 2.422 3.674 . 0 0 "[ . 1 . 2 . 3 ]" 1
688 1 53 ASP H 1 54 ASP H . . 4.160 2.652 2.297 2.961 . 0 0 "[ . 1 . 2 . 3 ]" 1
689 1 53 ASP HA 1 56 MET H . . 4.870 3.366 2.809 3.986 . 0 0 "[ . 1 . 2 . 3 ]" 1
690 1 53 ASP HA 1 56 MET QB . . 5.220 2.798 2.053 4.319 . 0 0 "[ . 1 . 2 . 3 ]" 1
691 1 53 ASP HA 1 56 MET QG . . 4.940 3.614 2.079 4.847 . 0 0 "[ . 1 . 2 . 3 ]" 1
692 1 53 ASP HB2 1 54 ASP H . . 5.500 3.490 2.830 4.177 . 0 0 "[ . 1 . 2 . 3 ]" 1
693 1 53 ASP HB3 1 54 ASP H . . 5.500 3.174 2.278 3.982 . 0 0 "[ . 1 . 2 . 3 ]" 1
694 1 54 ASP H 1 54 ASP HB2 . . 3.530 2.475 2.107 2.765 . 0 0 "[ . 1 . 2 . 3 ]" 1
695 1 54 ASP H 1 54 ASP HB3 . . 3.530 2.821 2.508 3.549 0.019 12 0 "[ . 1 . 2 . 3 ]" 1
696 1 54 ASP HA 1 57 LYS H . . 3.480 3.239 2.695 3.527 0.047 24 0 "[ . 1 . 2 . 3 ]" 1
697 1 54 ASP HA 1 57 LYS QB . . 3.070 2.316 1.977 3.088 0.018 4 0 "[ . 1 . 2 . 3 ]" 1
698 1 54 ASP HA 1 57 LYS QE . . 4.640 3.170 1.861 4.712 0.072 13 0 "[ . 1 . 2 . 3 ]" 1
699 1 54 ASP HA 1 58 SER H . . 4.550 4.188 3.652 4.566 0.016 26 0 "[ . 1 . 2 . 3 ]" 1
700 1 54 ASP QB 1 57 LYS QB . . 5.340 4.222 3.812 4.631 . 0 0 "[ . 1 . 2 . 3 ]" 1
701 1 54 ASP HB2 1 55 LEU H . . 3.880 3.776 3.157 3.942 0.062 21 0 "[ . 1 . 2 . 3 ]" 1
702 1 54 ASP HB2 1 57 LYS QD . . 5.500 4.665 3.558 5.608 0.108 10 0 "[ . 1 . 2 . 3 ]" 1
703 1 54 ASP HB3 1 55 LEU H . . 3.880 2.871 2.519 3.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
704 1 54 ASP HB3 1 57 LYS QD . . 5.500 5.013 4.008 5.597 0.097 20 0 "[ . 1 . 2 . 3 ]" 1
705 1 55 LEU H 1 55 LEU QB . . 3.460 2.177 2.064 2.264 . 0 0 "[ . 1 . 2 . 3 ]" 1
706 1 55 LEU H 1 55 LEU MD1 . . 4.670 4.163 3.563 4.399 . 0 0 "[ . 1 . 2 . 3 ]" 1
707 1 55 LEU H 1 55 LEU QD . . 3.710 3.637 2.550 3.747 0.037 28 0 "[ . 1 . 2 . 3 ]" 1
708 1 55 LEU H 1 55 LEU MD2 . . 4.670 4.085 2.571 4.341 . 0 0 "[ . 1 . 2 . 3 ]" 1
709 1 55 LEU H 1 55 LEU HG . . 4.910 4.410 3.826 4.568 . 0 0 "[ . 1 . 2 . 3 ]" 1
710 1 55 LEU H 1 56 MET H . . 4.210 2.840 2.647 3.020 . 0 0 "[ . 1 . 2 . 3 ]" 1
711 1 55 LEU HA 1 55 LEU QD . . 3.890 2.314 1.974 3.181 . 0 0 "[ . 1 . 2 . 3 ]" 1
712 1 55 LEU HA 1 59 LEU QD . . 5.440 3.929 2.904 4.434 . 0 0 "[ . 1 . 2 . 3 ]" 1
713 1 55 LEU QB 1 56 MET H . . 4.020 2.592 2.299 2.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
714 1 55 LEU HB2 1 56 MET H . . 5.500 3.834 2.872 4.146 . 0 0 "[ . 1 . 2 . 3 ]" 1
715 1 55 LEU HB3 1 56 MET H . . 5.500 2.656 2.320 3.196 . 0 0 "[ . 1 . 2 . 3 ]" 1
716 1 55 LEU QD 1 56 MET H . . 4.430 3.652 2.881 4.186 . 0 0 "[ . 1 . 2 . 3 ]" 1
717 1 55 LEU QD 1 58 SER H . . 5.100 4.318 3.897 4.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
718 1 55 LEU QD 1 58 SER QB . . 4.510 3.051 2.224 4.235 . 0 0 "[ . 1 . 2 . 3 ]" 1
719 1 55 LEU QD 1 59 LEU QD . . 4.790 2.197 1.840 3.172 . 0 0 "[ . 1 . 2 . 3 ]" 1
720 1 55 LEU QD 1 59 LEU HG . . 5.440 3.173 2.103 4.705 . 0 0 "[ . 1 . 2 . 3 ]" 1
721 1 55 LEU QD 1 75 PHE QD . . 4.750 2.453 2.141 3.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
722 1 55 LEU QD 1 75 PHE HZ . . 3.910 3.860 3.449 3.939 0.029 15 0 "[ . 1 . 2 . 3 ]" 1
723 1 55 LEU QD 1 78 MET ME . . 4.200 2.517 1.980 3.791 . 0 0 "[ . 1 . 2 . 3 ]" 1
724 1 55 LEU MD1 1 56 MET H . . 5.030 4.340 2.964 4.866 . 0 0 "[ . 1 . 2 . 3 ]" 1
725 1 55 LEU MD1 1 75 PHE QD . . 5.500 2.830 2.222 3.832 . 0 0 "[ . 1 . 2 . 3 ]" 1
726 1 55 LEU MD1 1 75 PHE QE . . 5.500 3.037 2.119 4.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
727 1 55 LEU MD1 1 78 MET ME . . 5.130 2.951 2.017 4.944 . 0 0 "[ . 1 . 2 . 3 ]" 1
728 1 55 LEU MD2 1 56 MET H . . 5.030 4.125 2.905 4.701 . 0 0 "[ . 1 . 2 . 3 ]" 1
729 1 55 LEU MD2 1 75 PHE QD . . 5.500 3.013 2.177 4.490 . 0 0 "[ . 1 . 2 . 3 ]" 1
730 1 55 LEU MD2 1 75 PHE QE . . 5.500 2.694 2.210 4.322 . 0 0 "[ . 1 . 2 . 3 ]" 1
731 1 55 LEU MD2 1 78 MET ME . . 5.130 3.699 2.006 5.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
732 1 55 LEU HG 1 56 MET H . . 5.400 4.228 3.223 5.126 . 0 0 "[ . 1 . 2 . 3 ]" 1
733 1 55 LEU HG 1 59 LEU QD . . 5.440 3.032 2.102 4.543 . 0 0 "[ . 1 . 2 . 3 ]" 1
734 1 55 LEU HG 1 75 PHE QD . . 5.500 4.175 3.417 4.971 . 0 0 "[ . 1 . 2 . 3 ]" 1
735 1 56 MET H 1 56 MET QB . . 3.680 2.265 2.028 2.583 . 0 0 "[ . 1 . 2 . 3 ]" 1
736 1 56 MET H 1 56 MET ME . . 5.500 5.224 4.442 5.578 0.078 26 0 "[ . 1 . 2 . 3 ]" 1
737 1 56 MET H 1 56 MET QG . . 4.370 3.460 2.248 4.065 . 0 0 "[ . 1 . 2 . 3 ]" 1
738 1 56 MET H 1 57 LYS H . . 4.380 2.889 2.547 3.031 . 0 0 "[ . 1 . 2 . 3 ]" 1
739 1 56 MET H 1 58 SER H . . 4.230 4.120 3.873 4.260 0.030 31 0 "[ . 1 . 2 . 3 ]" 1
740 1 56 MET HA 1 56 MET ME . . 3.870 3.563 2.373 3.925 0.055 22 0 "[ . 1 . 2 . 3 ]" 1
741 1 56 MET HA 1 59 LEU QD . . 4.610 2.873 2.088 3.945 . 0 0 "[ . 1 . 2 . 3 ]" 1
742 1 56 MET HA 1 67 ILE MD . . 3.770 3.395 2.759 3.788 0.018 21 0 "[ . 1 . 2 . 3 ]" 1
743 1 56 MET QB 1 56 MET ME . . 4.040 3.039 2.019 3.695 . 0 0 "[ . 1 . 2 . 3 ]" 1
744 1 56 MET QB 1 57 LYS H . . 4.280 2.734 2.208 3.690 . 0 0 "[ . 1 . 2 . 3 ]" 1
745 1 56 MET ME 1 65 GLN H . . 5.500 4.555 3.221 5.518 0.018 11 0 "[ . 1 . 2 . 3 ]" 1
746 1 56 MET ME 1 65 GLN HA . . 5.500 3.115 1.962 5.191 . 0 0 "[ . 1 . 2 . 3 ]" 1
747 1 56 MET ME 1 67 ILE H . . 5.500 3.946 3.122 5.136 . 0 0 "[ . 1 . 2 . 3 ]" 1
748 1 56 MET ME 1 67 ILE MD . . 4.980 2.172 1.847 3.267 . 0 0 "[ . 1 . 2 . 3 ]" 1
749 1 56 MET ME 1 67 ILE HG12 . . 5.500 2.676 2.082 4.162 . 0 0 "[ . 1 . 2 . 3 ]" 1
750 1 56 MET ME 1 67 ILE QG . . 4.830 2.432 2.043 3.743 . 0 0 "[ . 1 . 2 . 3 ]" 1
751 1 56 MET ME 1 67 ILE HG13 . . 5.500 3.100 2.132 4.243 . 0 0 "[ . 1 . 2 . 3 ]" 1
752 1 56 MET QG 1 57 LYS H . . 4.930 3.420 2.035 4.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
753 1 57 LYS H 1 57 LYS QB . . 3.340 2.134 1.918 2.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
754 1 57 LYS H 1 57 LYS QD . . 4.860 3.907 2.759 4.670 . 0 0 "[ . 1 . 2 . 3 ]" 1
755 1 57 LYS H 1 57 LYS QG . . 4.630 3.535 2.071 4.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
756 1 57 LYS HA 1 57 LYS QD . . 4.810 4.032 3.664 4.414 . 0 0 "[ . 1 . 2 . 3 ]" 1
757 1 57 LYS HA 1 60 ASP H . . 4.740 3.668 2.844 4.140 . 0 0 "[ . 1 . 2 . 3 ]" 1
758 1 57 LYS QB 1 58 SER H . . 3.400 2.936 2.555 3.320 . 0 0 "[ . 1 . 2 . 3 ]" 1
759 1 57 LYS QB 1 58 SER QB . . 4.340 4.254 3.683 4.402 0.062 29 0 "[ . 1 . 2 . 3 ]" 1
760 1 57 LYS QD 1 58 SER H . . 4.840 3.960 2.680 4.900 0.060 10 0 "[ . 1 . 2 . 3 ]" 1
761 1 57 LYS QG 1 58 SER H . . 5.020 4.140 2.948 4.521 . 0 0 "[ . 1 . 2 . 3 ]" 1
762 1 58 SER H 1 58 SER HB2 . . 3.420 2.367 2.064 2.758 . 0 0 "[ . 1 . 2 . 3 ]" 1
763 1 58 SER H 1 58 SER HB3 . . 3.420 2.969 2.371 3.505 0.085 31 0 "[ . 1 . 2 . 3 ]" 1
764 1 58 SER H 1 59 LEU H . . 3.760 2.526 2.177 2.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
765 1 58 SER H 1 60 ASP H . . 4.670 4.091 3.624 4.710 0.040 19 0 "[ . 1 . 2 . 3 ]" 1
766 1 58 SER QB 1 78 MET ME . . 3.450 3.008 2.130 3.484 0.034 11 0 "[ . 1 . 2 . 3 ]" 1
767 1 58 SER HB2 1 59 LEU H . . 4.050 3.575 2.732 4.057 0.007 15 0 "[ . 1 . 2 . 3 ]" 1
768 1 58 SER HB3 1 59 LEU H . . 4.050 3.239 2.687 4.038 . 0 0 "[ . 1 . 2 . 3 ]" 1
769 1 59 LEU H 1 59 LEU QB . . 3.680 2.338 1.871 2.678 . 0 0 "[ . 1 . 2 . 3 ]" 1
770 1 59 LEU H 1 59 LEU MD1 . . 4.820 3.486 2.280 4.231 . 0 0 "[ . 1 . 2 . 3 ]" 1
771 1 59 LEU H 1 59 LEU QD . . 4.110 2.837 2.265 3.266 . 0 0 "[ . 1 . 2 . 3 ]" 1
772 1 59 LEU H 1 59 LEU MD2 . . 4.820 3.360 2.552 4.265 . 0 0 "[ . 1 . 2 . 3 ]" 1
773 1 59 LEU H 1 59 LEU HG . . 4.170 3.065 1.937 4.212 0.042 15 0 "[ . 1 . 2 . 3 ]" 1
774 1 59 LEU H 1 60 ASP H . . 4.050 2.557 2.351 2.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
775 1 59 LEU H 1 67 ILE MD . . 5.500 4.227 3.724 4.885 . 0 0 "[ . 1 . 2 . 3 ]" 1
776 1 59 LEU HA 1 59 LEU QD . . 3.730 2.280 2.007 2.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
777 1 59 LEU HA 1 67 ILE MD . . 5.500 4.344 3.768 5.527 0.027 25 0 "[ . 1 . 2 . 3 ]" 1
778 1 59 LEU QB 1 60 ASP H . . 3.810 2.573 2.243 3.066 . 0 0 "[ . 1 . 2 . 3 ]" 1
779 1 59 LEU QB 1 67 ILE MD . . 4.450 2.222 1.925 3.207 . 0 0 "[ . 1 . 2 . 3 ]" 1
780 1 59 LEU QB 1 67 ILE MG . . 5.260 2.912 2.214 4.076 . 0 0 "[ . 1 . 2 . 3 ]" 1
781 1 59 LEU HB2 1 60 ASP H . . 4.600 2.687 2.267 3.286 . 0 0 "[ . 1 . 2 . 3 ]" 1
782 1 59 LEU HB2 1 67 ILE MD . . 5.500 2.603 2.127 3.644 . 0 0 "[ . 1 . 2 . 3 ]" 1
783 1 59 LEU HB3 1 60 ASP H . . 4.600 3.455 2.833 4.201 . 0 0 "[ . 1 . 2 . 3 ]" 1
784 1 59 LEU HB3 1 67 ILE MD . . 5.500 2.588 1.995 4.004 . 0 0 "[ . 1 . 2 . 3 ]" 1
785 1 59 LEU QD 1 60 ASP H . . 4.740 4.018 3.735 4.318 . 0 0 "[ . 1 . 2 . 3 ]" 1
786 1 59 LEU QD 1 67 ILE MD . . 5.440 2.913 2.061 3.770 . 0 0 "[ . 1 . 2 . 3 ]" 1
787 1 59 LEU QD 1 67 ILE MG . . 5.440 2.715 1.965 3.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
788 1 59 LEU QD 1 72 TYR HA . . 5.440 2.817 1.904 4.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
789 1 59 LEU QD 1 75 PHE H . . 4.470 2.810 2.020 3.577 . 0 0 "[ . 1 . 2 . 3 ]" 1
790 1 59 LEU QD 1 75 PHE HA . . 4.690 2.562 2.006 3.720 . 0 0 "[ . 1 . 2 . 3 ]" 1
791 1 59 LEU QD 1 75 PHE QB . . 4.290 1.896 1.786 2.041 . 0 0 "[ . 1 . 2 . 3 ]" 1
792 1 59 LEU QD 1 75 PHE HZ . . 5.440 4.848 4.103 5.469 0.029 15 0 "[ . 1 . 2 . 3 ]" 1
793 1 59 LEU QD 1 78 MET ME . . 5.440 2.591 1.929 4.024 . 0 0 "[ . 1 . 2 . 3 ]" 1
794 1 59 LEU MD1 1 60 ASP H . . 5.410 4.489 4.112 4.928 . 0 0 "[ . 1 . 2 . 3 ]" 1
795 1 59 LEU MD1 1 75 PHE H . . 5.300 3.756 2.054 5.142 . 0 0 "[ . 1 . 2 . 3 ]" 1
796 1 59 LEU MD1 1 75 PHE HA . . 5.500 3.559 2.304 4.581 . 0 0 "[ . 1 . 2 . 3 ]" 1
797 1 59 LEU MD1 1 75 PHE HB2 . . 5.500 2.233 2.001 3.007 . 0 0 "[ . 1 . 2 . 3 ]" 1
798 1 59 LEU MD1 1 75 PHE HB3 . . 5.500 3.409 2.235 4.062 . 0 0 "[ . 1 . 2 . 3 ]" 1
799 1 59 LEU MD1 1 75 PHE QD . . 5.500 2.953 2.112 3.951 . 0 0 "[ . 1 . 2 . 3 ]" 1
800 1 59 LEU MD1 1 75 PHE QE . . 5.500 4.136 3.240 5.525 0.025 15 0 "[ . 1 . 2 . 3 ]" 1
801 1 59 LEU MD2 1 60 ASP H . . 5.410 4.553 4.270 4.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
802 1 59 LEU MD2 1 75 PHE H . . 5.300 3.121 2.274 4.335 . 0 0 "[ . 1 . 2 . 3 ]" 1
803 1 59 LEU MD2 1 75 PHE HA . . 5.500 2.932 2.018 4.311 . 0 0 "[ . 1 . 2 . 3 ]" 1
804 1 59 LEU MD2 1 75 PHE HB2 . . 5.500 2.138 2.000 2.282 . 0 0 "[ . 1 . 2 . 3 ]" 1
805 1 59 LEU MD2 1 75 PHE HB3 . . 5.500 3.349 2.152 3.631 . 0 0 "[ . 1 . 2 . 3 ]" 1
806 1 59 LEU MD2 1 75 PHE QD . . 5.500 2.807 2.189 3.611 . 0 0 "[ . 1 . 2 . 3 ]" 1
807 1 59 LEU MD2 1 75 PHE QE . . 5.500 4.413 3.467 5.068 . 0 0 "[ . 1 . 2 . 3 ]" 1
808 1 60 ASP H 1 60 ASP HB2 . . 3.860 2.434 2.232 2.862 . 0 0 "[ . 1 . 2 . 3 ]" 1
809 1 60 ASP H 1 60 ASP QB . . 3.620 2.236 2.097 2.385 . 0 0 "[ . 1 . 2 . 3 ]" 1
810 1 60 ASP H 1 60 ASP HB3 . . 3.860 2.662 2.458 3.527 . 0 0 "[ . 1 . 2 . 3 ]" 1
811 1 60 ASP H 1 67 ILE MD . . 4.630 3.053 2.559 3.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
812 1 60 ASP HA 1 62 ASN H . . 4.650 3.691 3.208 4.215 . 0 0 "[ . 1 . 2 . 3 ]" 1
813 1 60 ASP HA 1 67 ILE MD . . 4.940 2.861 2.034 4.231 . 0 0 "[ . 1 . 2 . 3 ]" 1
814 1 60 ASP QB 1 67 ILE MD . . 4.120 2.285 1.993 4.079 . 0 0 "[ . 1 . 2 . 3 ]" 1
815 1 60 ASP HB2 1 61 LYS H . . 4.740 4.423 3.899 4.660 . 0 0 "[ . 1 . 2 . 3 ]" 1
816 1 60 ASP HB2 1 63 SER HA . . 5.500 4.780 3.339 5.556 0.056 7 0 "[ . 1 . 2 . 3 ]" 1
817 1 60 ASP HB2 1 67 ILE MD . . 4.880 2.315 2.008 4.359 . 0 0 "[ . 1 . 2 . 3 ]" 1
818 1 60 ASP HB3 1 61 LYS H . . 4.740 4.185 2.953 4.514 . 0 0 "[ . 1 . 2 . 3 ]" 1
819 1 60 ASP HB3 1 63 SER HA . . 5.500 3.534 2.147 4.698 . 0 0 "[ . 1 . 2 . 3 ]" 1
820 1 60 ASP HB3 1 67 ILE MD . . 4.880 3.662 3.346 4.912 0.032 20 0 "[ . 1 . 2 . 3 ]" 1
821 1 61 LYS H 1 61 LYS QB . . 3.480 2.314 1.906 2.719 . 0 0 "[ . 1 . 2 . 3 ]" 1
822 1 61 LYS H 1 61 LYS QD . . 4.990 3.345 1.792 4.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
823 1 61 LYS H 1 61 LYS HG2 . . 4.660 3.901 2.060 4.680 0.020 20 0 "[ . 1 . 2 . 3 ]" 1
824 1 61 LYS H 1 61 LYS QG . . 3.950 3.302 1.934 3.991 0.041 11 0 "[ . 1 . 2 . 3 ]" 1
825 1 61 LYS H 1 61 LYS HG3 . . 4.660 3.787 1.945 4.558 . 0 0 "[ . 1 . 2 . 3 ]" 1
826 1 61 LYS H 1 62 ASN H . . 3.720 2.658 1.989 3.255 . 0 0 "[ . 1 . 2 . 3 ]" 1
827 1 61 LYS H 1 63 SER H . . 5.240 4.185 3.607 4.763 . 0 0 "[ . 1 . 2 . 3 ]" 1
828 1 61 LYS H 1 71 GLU QG . . 4.810 2.991 2.049 4.827 0.017 5 0 "[ . 1 . 2 . 3 ]" 1
829 1 61 LYS HA 1 61 LYS QD . . 3.970 3.128 2.050 4.048 0.078 5 0 "[ . 1 . 2 . 3 ]" 1
830 1 61 LYS HA 1 61 LYS QE . . 4.870 3.808 1.948 4.909 0.039 22 0 "[ . 1 . 2 . 3 ]" 1
831 1 61 LYS HA 1 61 LYS QG . . 3.670 2.480 2.211 3.188 . 0 0 "[ . 1 . 2 . 3 ]" 1
832 1 61 LYS QB 1 62 ASN H . . 3.670 3.140 2.396 3.683 0.013 20 0 "[ . 1 . 2 . 3 ]" 1
833 1 61 LYS QB 1 63 SER H . . 5.500 4.949 4.448 5.521 0.021 12 0 "[ . 1 . 2 . 3 ]" 1
834 1 61 LYS QD 1 62 ASN H . . 4.900 4.747 4.080 4.989 0.089 4 0 "[ . 1 . 2 . 3 ]" 1
835 1 61 LYS QD 1 71 GLU QG . . 5.340 3.536 2.247 5.388 0.048 17 0 "[ . 1 . 2 . 3 ]" 1
836 1 61 LYS QE 1 74 VAL MG1 . . 5.500 3.500 1.921 5.406 . 0 0 "[ . 1 . 2 . 3 ]" 1
837 1 61 LYS QE 1 74 VAL MG2 . . 5.500 3.288 2.050 5.504 0.004 28 0 "[ . 1 . 2 . 3 ]" 1
838 1 61 LYS QG 1 62 ASN H . . 5.060 4.611 3.930 5.073 0.013 3 0 "[ . 1 . 2 . 3 ]" 1
839 1 62 ASN H 1 62 ASN QD . . 4.570 3.808 2.992 4.400 . 0 0 "[ . 1 . 2 . 3 ]" 1
840 1 62 ASN H 1 63 SER H . . 3.660 2.321 1.899 2.853 . 0 0 "[ . 1 . 2 . 3 ]" 1
841 1 62 ASN H 1 64 ASP H . . 5.240 4.162 3.498 5.248 0.008 31 0 "[ . 1 . 2 . 3 ]" 1
842 1 62 ASN HA 1 62 ASN QD . . 4.440 3.659 2.273 4.445 0.005 1 0 "[ . 1 . 2 . 3 ]" 1
843 1 63 SER H 1 63 SER QB . . 3.280 3.142 2.822 3.399 0.119 23 0 "[ . 1 . 2 . 3 ]" 1
844 1 63 SER H 1 64 ASP H . . 4.250 2.741 1.940 3.554 . 0 0 "[ . 1 . 2 . 3 ]" 1
845 1 63 SER HA 1 63 SER QB . . 2.450 2.381 2.313 2.468 0.018 30 0 "[ . 1 . 2 . 3 ]" 1
846 1 63 SER QB 1 64 ASP H . . 3.940 3.946 3.751 4.020 0.080 21 0 "[ . 1 . 2 . 3 ]" 1
847 1 64 ASP H 1 65 GLN H . . 3.880 2.554 1.795 3.929 0.049 20 0 "[ . 1 . 2 . 3 ]" 1
848 1 64 ASP H 1 65 GLN HA . . 4.200 4.249 3.948 4.345 0.145 21 0 "[ . 1 . 2 . 3 ]" 1
849 1 64 ASP H 1 66 GLU H . . 4.490 3.934 3.278 4.547 0.057 21 0 "[ . 1 . 2 . 3 ]" 1
850 1 65 GLN H 1 65 GLN QB . . 3.220 3.168 2.815 3.391 0.171 13 0 "[ . 1 . 2 . 3 ]" 1
851 1 65 GLN H 1 65 GLN QG . . 3.520 3.233 2.368 3.661 0.141 22 0 "[ . 1 . 2 . 3 ]" 1
852 1 65 GLN H 1 66 GLU H . . 3.990 2.405 1.740 3.191 . 0 0 "[ . 1 . 2 . 3 ]" 1
853 1 65 GLN HA 1 65 GLN QB . . 2.620 2.401 2.121 2.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
854 1 65 GLN HA 1 65 GLN QE . . 5.340 4.573 3.298 5.320 . 0 0 "[ . 1 . 2 . 3 ]" 1
855 1 65 GLN HA 1 65 GLN HG2 . . 3.880 2.878 2.074 3.749 . 0 0 "[ . 1 . 2 . 3 ]" 1
856 1 65 GLN HA 1 65 GLN QG . . 3.190 2.551 2.054 3.299 0.109 17 0 "[ . 1 . 2 . 3 ]" 1
857 1 65 GLN HA 1 65 GLN HG3 . . 3.880 3.073 2.311 3.853 . 0 0 "[ . 1 . 2 . 3 ]" 1
858 1 65 GLN QB 1 65 GLN QE . . 3.260 2.516 1.900 3.276 0.016 16 0 "[ . 1 . 2 . 3 ]" 1
859 1 65 GLN QB 1 66 GLU H . . 3.840 3.670 2.986 3.893 0.053 31 0 "[ . 1 . 2 . 3 ]" 1
860 1 65 GLN HB2 1 66 GLU H . . 4.450 4.116 3.085 4.452 0.002 15 0 "[ . 1 . 2 . 3 ]" 1
861 1 65 GLN HB3 1 66 GLU H . . 4.450 4.180 3.433 4.471 0.021 20 0 "[ . 1 . 2 . 3 ]" 1
862 1 66 GLU H 1 66 GLU HG2 . . 4.520 3.510 2.329 4.369 . 0 0 "[ . 1 . 2 . 3 ]" 1
863 1 66 GLU H 1 66 GLU QG . . 4.200 3.122 2.283 3.506 . 0 0 "[ . 1 . 2 . 3 ]" 1
864 1 66 GLU H 1 66 GLU HG3 . . 4.520 3.750 2.826 4.369 . 0 0 "[ . 1 . 2 . 3 ]" 1
865 1 66 GLU HA 1 66 GLU HG2 . . 4.100 2.743 2.218 3.799 . 0 0 "[ . 1 . 2 . 3 ]" 1
866 1 66 GLU HA 1 66 GLU QG . . 3.330 2.629 2.078 3.383 0.053 7 0 "[ . 1 . 2 . 3 ]" 1
867 1 66 GLU HA 1 66 GLU HG3 . . 4.100 3.550 2.397 3.906 . 0 0 "[ . 1 . 2 . 3 ]" 1
868 1 66 GLU QG 1 67 ILE H . . 5.320 4.184 3.144 4.802 . 0 0 "[ . 1 . 2 . 3 ]" 1
869 1 67 ILE H 1 67 ILE MD . . 5.500 3.467 2.507 4.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
870 1 67 ILE H 1 67 ILE HG12 . . 5.500 2.831 2.181 4.317 . 0 0 "[ . 1 . 2 . 3 ]" 1
871 1 67 ILE H 1 67 ILE HG13 . . 5.500 3.711 2.636 4.090 . 0 0 "[ . 1 . 2 . 3 ]" 1
872 1 67 ILE HA 1 67 ILE MD . . 4.490 2.574 2.127 3.746 . 0 0 "[ . 1 . 2 . 3 ]" 1
873 1 67 ILE MD 1 68 ASP H . . 5.210 4.272 3.683 5.244 0.034 28 0 "[ . 1 . 2 . 3 ]" 1
874 1 67 ILE QG 1 68 ASP H . . 5.340 4.727 3.836 5.091 . 0 0 "[ . 1 . 2 . 3 ]" 1
875 1 67 ILE MG 1 68 ASP H . . 4.990 3.301 2.944 3.597 . 0 0 "[ . 1 . 2 . 3 ]" 1
876 1 67 ILE MG 1 69 PHE HA . . 5.500 4.232 3.834 4.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
877 1 67 ILE MG 1 71 GLU H . . 4.770 3.852 3.566 4.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
878 1 67 ILE MG 1 71 GLU QB . . 5.500 2.150 1.944 2.805 . 0 0 "[ . 1 . 2 . 3 ]" 1
879 1 67 ILE MG 1 72 TYR H . . 4.790 2.328 2.015 2.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
880 1 67 ILE MG 1 72 TYR HA . . 5.120 2.539 2.201 2.954 . 0 0 "[ . 1 . 2 . 3 ]" 1
881 1 67 ILE MG 1 72 TYR HB2 . . 5.500 2.106 1.979 2.328 . 0 0 "[ . 1 . 2 . 3 ]" 1
882 1 67 ILE MG 1 72 TYR QB . . 5.060 2.085 1.950 2.299 . 0 0 "[ . 1 . 2 . 3 ]" 1
883 1 67 ILE MG 1 72 TYR HB3 . . 5.500 3.365 2.933 3.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
884 1 67 ILE MG 1 72 TYR QD . . 5.500 2.761 2.065 3.575 . 0 0 "[ . 1 . 2 . 3 ]" 1
885 1 68 ASP HA 1 70 LYS H . . 5.500 4.358 3.789 4.674 . 0 0 "[ . 1 . 2 . 3 ]" 1
886 1 68 ASP QB 1 70 LYS H . . 5.340 3.301 1.884 3.988 . 0 0 "[ . 1 . 2 . 3 ]" 1
887 1 68 ASP HB2 1 69 PHE H . . 4.540 3.789 2.491 4.200 . 0 0 "[ . 1 . 2 . 3 ]" 1
888 1 68 ASP HB3 1 69 PHE H . . 4.540 3.674 2.601 4.215 . 0 0 "[ . 1 . 2 . 3 ]" 1
889 1 69 PHE H 1 69 PHE QD . . 5.500 3.691 2.081 4.201 . 0 0 "[ . 1 . 2 . 3 ]" 1
890 1 69 PHE H 1 70 LYS H . . 4.510 2.927 2.694 3.112 . 0 0 "[ . 1 . 2 . 3 ]" 1
891 1 69 PHE HA 1 72 TYR H . . 4.640 3.489 3.276 3.940 . 0 0 "[ . 1 . 2 . 3 ]" 1
892 1 69 PHE HA 1 72 TYR QB . . 4.260 2.259 2.089 2.765 . 0 0 "[ . 1 . 2 . 3 ]" 1
893 1 69 PHE HA 1 72 TYR QD . . 5.430 3.305 2.549 4.052 . 0 0 "[ . 1 . 2 . 3 ]" 1
894 1 69 PHE HB2 1 70 LYS H . . 4.490 3.529 2.461 4.236 . 0 0 "[ . 1 . 2 . 3 ]" 1
895 1 69 PHE HB3 1 70 LYS H . . 4.490 2.982 2.667 3.423 . 0 0 "[ . 1 . 2 . 3 ]" 1
896 1 69 PHE QD 1 70 LYS H . . 5.490 4.381 3.631 4.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
897 1 69 PHE QD 1 70 LYS HA . . 5.500 4.510 3.323 5.564 0.064 15 0 "[ . 1 . 2 . 3 ]" 1
898 1 69 PHE QD 1 72 TYR QD . . 5.500 3.314 2.336 4.163 . 0 0 "[ . 1 . 2 . 3 ]" 1
899 1 69 PHE QD 1 72 TYR QE . . 5.500 4.779 3.602 5.546 0.046 14 0 "[ . 1 . 2 . 3 ]" 1
900 1 69 PHE QD 2 81 MET HA . . 5.500 3.854 3.185 4.630 . 0 0 "[ . 1 . 2 . 3 ]" 1
901 1 69 PHE QD 2 81 MET ME . . 5.500 3.735 2.178 5.373 . 0 0 "[ . 1 . 2 . 3 ]" 1
902 1 69 PHE QD 2 81 MET HG2 . . 5.500 3.247 2.417 4.797 . 0 0 "[ . 1 . 2 . 3 ]" 1
903 1 69 PHE QD 2 81 MET HG3 . . 5.500 3.691 2.528 5.176 . 0 0 "[ . 1 . 2 . 3 ]" 1
904 1 69 PHE QE 1 72 TYR QE . . 5.500 3.885 2.788 5.434 . 0 0 "[ . 1 . 2 . 3 ]" 1
905 1 69 PHE QE 2 81 MET H . . 5.500 4.522 3.053 5.515 0.015 29 0 "[ . 1 . 2 . 3 ]" 1
906 1 69 PHE QE 2 81 MET HA . . 5.500 3.801 2.130 5.168 . 0 0 "[ . 1 . 2 . 3 ]" 1
907 1 69 PHE QE 2 81 MET HG2 . . 5.500 4.175 2.460 5.510 0.010 28 0 "[ . 1 . 2 . 3 ]" 1
908 1 69 PHE QE 2 81 MET QG . . 5.500 3.765 2.161 4.905 . 0 0 "[ . 1 . 2 . 3 ]" 1
909 1 69 PHE QE 2 81 MET HG3 . . 5.500 4.505 2.298 5.519 0.019 4 0 "[ . 1 . 2 . 3 ]" 1
910 1 69 PHE QE 2 84 ASN H . . 5.500 4.601 3.628 5.514 0.014 22 0 "[ . 1 . 2 . 3 ]" 1
911 1 70 LYS H 1 70 LYS QB . . 3.400 2.405 2.038 2.630 . 0 0 "[ . 1 . 2 . 3 ]" 1
912 1 70 LYS H 1 70 LYS QD . . 5.140 3.661 1.767 4.637 . 0 0 "[ . 1 . 2 . 3 ]" 1
913 1 70 LYS H 1 70 LYS QE . . 5.110 3.719 1.782 5.131 0.021 2 0 "[ . 1 . 2 . 3 ]" 1
914 1 70 LYS H 1 70 LYS QG . . 4.410 2.827 1.855 4.083 . 0 0 "[ . 1 . 2 . 3 ]" 1
915 1 70 LYS H 1 71 GLU H . . 4.120 2.601 2.293 2.866 . 0 0 "[ . 1 . 2 . 3 ]" 1
916 1 70 LYS H 2 81 MET ME . . 5.500 4.011 2.785 5.519 0.019 31 0 "[ . 1 . 2 . 3 ]" 1
917 1 70 LYS HA 2 81 MET ME . . 5.500 4.431 2.003 5.513 0.013 14 0 "[ . 1 . 2 . 3 ]" 1
918 1 70 LYS HA 2 81 MET HG2 . . 5.500 5.319 4.344 5.564 0.064 22 0 "[ . 1 . 2 . 3 ]" 1
919 1 70 LYS HA 2 81 MET HG3 . . 5.500 5.079 4.668 5.476 . 0 0 "[ . 1 . 2 . 3 ]" 1
920 1 70 LYS QB 1 71 GLU H . . 5.070 3.206 2.577 3.936 . 0 0 "[ . 1 . 2 . 3 ]" 1
921 1 70 LYS QD 2 81 MET ME . . 5.230 3.329 2.228 5.233 0.003 28 0 "[ . 1 . 2 . 3 ]" 1
922 1 70 LYS QD 2 81 MET QG . . 5.340 4.825 2.964 5.387 0.047 28 0 "[ . 1 . 2 . 3 ]" 1
923 1 70 LYS QE 1 71 GLU H . . 5.500 4.727 3.488 5.543 0.043 13 0 "[ . 1 . 2 . 3 ]" 1
924 1 70 LYS QG 1 71 GLU H . . 5.500 3.937 2.510 4.902 . 0 0 "[ . 1 . 2 . 3 ]" 1
925 1 70 LYS QG 2 81 MET ME . . 5.500 3.510 2.254 5.508 0.008 16 0 "[ . 1 . 2 . 3 ]" 1
926 1 71 GLU H 1 71 GLU HG2 . . 5.500 3.756 3.021 4.322 . 0 0 "[ . 1 . 2 . 3 ]" 1
927 1 71 GLU H 1 71 GLU QG . . 4.780 2.614 2.241 3.076 . 0 0 "[ . 1 . 2 . 3 ]" 1
928 1 71 GLU H 1 71 GLU HG3 . . 5.500 2.669 2.310 3.148 . 0 0 "[ . 1 . 2 . 3 ]" 1
929 1 71 GLU H 1 72 TYR H . . 4.790 2.453 2.112 3.012 . 0 0 "[ . 1 . 2 . 3 ]" 1
930 1 71 GLU HA 1 74 VAL H . . 5.500 3.992 3.394 4.780 . 0 0 "[ . 1 . 2 . 3 ]" 1
931 1 71 GLU HA 1 74 VAL MG1 . . 5.500 4.292 2.791 5.524 0.024 13 0 "[ . 1 . 2 . 3 ]" 1
932 1 71 GLU HA 1 74 VAL QG . . 4.530 3.215 2.339 4.112 . 0 0 "[ . 1 . 2 . 3 ]" 1
933 1 71 GLU HA 1 74 VAL MG2 . . 5.500 3.870 2.345 5.535 0.035 14 0 "[ . 1 . 2 . 3 ]" 1
934 1 71 GLU QG 1 72 TYR H . . 5.500 4.087 3.772 4.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
935 1 72 TYR H 1 72 TYR QD . . 5.500 4.108 3.905 4.187 . 0 0 "[ . 1 . 2 . 3 ]" 1
936 1 72 TYR H 1 73 SER H . . 4.450 3.024 2.878 3.204 . 0 0 "[ . 1 . 2 . 3 ]" 1
937 1 72 TYR HA 1 75 PHE H . . 5.500 3.444 3.071 4.019 . 0 0 "[ . 1 . 2 . 3 ]" 1
938 1 72 TYR HA 1 75 PHE QD . . 5.500 4.624 3.464 5.497 . 0 0 "[ . 1 . 2 . 3 ]" 1
939 1 72 TYR QB 1 73 SER H . . 4.650 2.732 2.360 2.969 . 0 0 "[ . 1 . 2 . 3 ]" 1
940 1 72 TYR QE 1 75 PHE QD . . 5.500 2.936 2.326 4.078 . 0 0 "[ . 1 . 2 . 3 ]" 1
941 1 72 TYR HH 1 76 LEU QD . . 5.440 3.124 2.087 4.422 . 0 0 "[ . 1 . 2 . 3 ]" 1
942 1 73 SER H 1 73 SER HB2 . . 3.990 2.697 2.151 3.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
943 1 73 SER H 1 73 SER HB3 . . 3.990 3.171 2.372 3.673 . 0 0 "[ . 1 . 2 . 3 ]" 1
944 1 73 SER H 1 74 VAL H . . 4.460 2.896 2.638 3.120 . 0 0 "[ . 1 . 2 . 3 ]" 1
945 1 73 SER H 1 74 VAL QG . . 4.330 4.222 3.843 4.380 0.050 23 0 "[ . 1 . 2 . 3 ]" 1
946 1 73 SER HA 1 76 LEU H . . 5.500 3.483 2.879 4.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
947 1 73 SER HA 1 76 LEU QB . . 5.340 2.962 2.224 4.673 . 0 0 "[ . 1 . 2 . 3 ]" 1
948 1 73 SER HA 1 76 LEU QD . . 5.440 2.707 2.089 4.232 . 0 0 "[ . 1 . 2 . 3 ]" 1
949 1 73 SER HA 1 76 LEU HG . . 5.500 3.643 2.271 5.418 . 0 0 "[ . 1 . 2 . 3 ]" 1
950 1 73 SER HA 2 77 THR MG . . 5.500 4.603 3.332 5.518 0.018 4 0 "[ . 1 . 2 . 3 ]" 1
951 1 73 SER QB 1 74 VAL H . . 4.360 3.158 2.540 3.922 . 0 0 "[ . 1 . 2 . 3 ]" 1
952 1 73 SER HB2 2 77 THR MG . . 5.500 2.983 2.100 3.676 . 0 0 "[ . 1 . 2 . 3 ]" 1
953 1 73 SER HB3 2 77 THR MG . . 5.500 3.011 2.230 3.696 . 0 0 "[ . 1 . 2 . 3 ]" 1
954 1 74 VAL H 1 74 VAL HB . . 3.920 2.768 2.282 3.800 . 0 0 "[ . 1 . 2 . 3 ]" 1
955 1 74 VAL H 1 74 VAL MG1 . . 4.650 3.044 2.223 3.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
956 1 74 VAL H 1 74 VAL QG . . 3.770 2.268 2.051 2.501 . 0 0 "[ . 1 . 2 . 3 ]" 1
957 1 74 VAL H 1 74 VAL MG2 . . 4.650 2.788 2.149 3.818 . 0 0 "[ . 1 . 2 . 3 ]" 1
958 1 74 VAL H 1 76 LEU H . . 5.230 4.451 4.133 5.043 . 0 0 "[ . 1 . 2 . 3 ]" 1
959 1 74 VAL HA 1 77 THR H . . 4.080 3.346 3.054 3.798 . 0 0 "[ . 1 . 2 . 3 ]" 1
960 1 74 VAL HA 1 77 THR HB . . 3.980 2.419 2.060 2.979 . 0 0 "[ . 1 . 2 . 3 ]" 1
961 1 74 VAL HA 1 77 THR HG1 . . 5.500 2.813 2.378 4.049 . 0 0 "[ . 1 . 2 . 3 ]" 1
962 1 74 VAL HA 1 77 THR MG . . 4.380 3.761 3.301 4.227 . 0 0 "[ . 1 . 2 . 3 ]" 1
963 1 74 VAL HB 1 75 PHE H . . 4.140 3.543 2.681 4.171 0.031 27 0 "[ . 1 . 2 . 3 ]" 1
964 1 74 VAL QG 1 75 PHE H . . 4.060 2.908 2.032 3.536 . 0 0 "[ . 1 . 2 . 3 ]" 1
965 1 74 VAL QG 1 75 PHE HA . . 5.440 3.546 2.904 3.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
966 1 74 VAL QG 1 77 THR HB . . 5.440 3.410 2.953 4.043 . 0 0 "[ . 1 . 2 . 3 ]" 1
967 1 74 VAL QG 1 77 THR HG1 . . 5.440 4.083 3.550 4.724 . 0 0 "[ . 1 . 2 . 3 ]" 1
968 1 74 VAL QG 1 78 MET H . . 5.400 3.999 3.632 4.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
969 1 74 VAL QG 1 78 MET ME . . 4.630 2.822 2.010 4.196 . 0 0 "[ . 1 . 2 . 3 ]" 1
970 1 74 VAL QG 1 78 MET QG . . 4.850 3.307 2.519 4.860 0.010 24 0 "[ . 1 . 2 . 3 ]" 1
971 1 74 VAL MG1 1 75 PHE H . . 4.950 3.375 2.039 4.225 . 0 0 "[ . 1 . 2 . 3 ]" 1
972 1 74 VAL MG2 1 75 PHE H . . 4.950 3.745 2.580 4.290 . 0 0 "[ . 1 . 2 . 3 ]" 1
973 1 75 PHE H 1 75 PHE QD . . 5.200 4.178 3.987 4.252 . 0 0 "[ . 1 . 2 . 3 ]" 1
974 1 75 PHE H 1 76 LEU H . . 4.270 2.745 2.573 2.952 . 0 0 "[ . 1 . 2 . 3 ]" 1
975 1 75 PHE HA 1 75 PHE QE . . 5.500 4.623 4.487 4.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
976 1 75 PHE HA 1 78 MET H . . 5.430 3.621 3.237 3.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
977 1 75 PHE QB 1 76 LEU H . . 3.710 2.252 1.969 2.535 . 0 0 "[ . 1 . 2 . 3 ]" 1
978 1 75 PHE HB2 1 76 LEU H . . 4.240 3.691 3.521 3.913 . 0 0 "[ . 1 . 2 . 3 ]" 1
979 1 75 PHE HB3 1 76 LEU H . . 4.240 2.273 1.979 2.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
980 1 75 PHE QD 1 76 LEU H . . 5.050 3.523 2.915 4.063 . 0 0 "[ . 1 . 2 . 3 ]" 1
981 1 75 PHE QD 1 76 LEU QD . . 5.440 2.705 2.169 3.720 . 0 0 "[ . 1 . 2 . 3 ]" 1
982 1 75 PHE QD 1 78 MET H . . 5.500 5.290 4.788 5.505 0.005 8 0 "[ . 1 . 2 . 3 ]" 1
983 1 75 PHE QD 1 78 MET QB . . 5.340 4.035 3.253 5.364 0.024 27 0 "[ . 1 . 2 . 3 ]" 1
984 1 75 PHE QD 1 78 MET ME . . 5.230 3.305 2.448 4.294 . 0 0 "[ . 1 . 2 . 3 ]" 1
985 1 75 PHE QD 1 78 MET QG . . 5.340 4.992 3.175 5.366 0.026 14 0 "[ . 1 . 2 . 3 ]" 1
986 1 75 PHE QD 1 79 LEU QD . . 3.150 3.107 2.780 3.172 0.022 30 0 "[ . 1 . 2 . 3 ]" 1
987 1 75 PHE QE 1 76 LEU QD . . 5.440 3.598 2.759 4.337 . 0 0 "[ . 1 . 2 . 3 ]" 1
988 1 75 PHE QE 1 78 MET ME . . 5.500 4.853 3.770 5.528 0.028 28 0 "[ . 1 . 2 . 3 ]" 1
989 1 75 PHE QE 1 79 LEU MD1 . . 5.500 2.958 2.409 4.717 . 0 0 "[ . 1 . 2 . 3 ]" 1
990 1 75 PHE QE 1 79 LEU MD2 . . 5.500 3.044 2.277 4.000 . 0 0 "[ . 1 . 2 . 3 ]" 1
991 1 75 PHE HZ 1 76 LEU QD . . 5.440 5.050 3.992 5.466 0.026 20 0 "[ . 1 . 2 . 3 ]" 1
992 1 75 PHE HZ 1 79 LEU QD . . 3.220 2.861 2.364 3.249 0.029 10 0 "[ . 1 . 2 . 3 ]" 1
993 1 76 LEU H 1 76 LEU MD1 . . 4.630 3.475 1.787 3.898 . 0 0 "[ . 1 . 2 . 3 ]" 1
994 1 76 LEU H 1 76 LEU MD2 . . 4.630 2.816 1.709 3.974 . 0 0 "[ . 1 . 2 . 3 ]" 1
995 1 76 LEU H 1 76 LEU HG . . 4.000 2.640 1.970 3.941 . 0 0 "[ . 1 . 2 . 3 ]" 1
996 1 76 LEU HA 1 76 LEU MD1 . . 4.790 3.413 2.082 4.139 . 0 0 "[ . 1 . 2 . 3 ]" 1
997 1 76 LEU HA 1 76 LEU QD . . 3.960 2.277 2.022 3.393 . 0 0 "[ . 1 . 2 . 3 ]" 1
998 1 76 LEU HA 1 76 LEU MD2 . . 4.790 2.529 2.119 3.805 . 0 0 "[ . 1 . 2 . 3 ]" 1
999 1 76 LEU HA 1 79 LEU H . . 5.500 3.554 3.024 3.953 . 0 0 "[ . 1 . 2 . 3 ]" 1
1000 1 76 LEU HA 1 79 LEU QD . . 5.000 2.935 2.454 4.416 . 0 0 "[ . 1 . 2 . 3 ]" 1
1001 1 76 LEU QB 1 77 THR H . . 4.360 2.698 2.374 3.703 . 0 0 "[ . 1 . 2 . 3 ]" 1
1002 1 76 LEU QD 1 77 THR H . . 4.730 4.006 3.230 4.321 . 0 0 "[ . 1 . 2 . 3 ]" 1
1003 1 76 LEU QD 1 79 LEU H . . 5.440 4.916 4.468 5.443 0.003 20 0 "[ . 1 . 2 . 3 ]" 1
1004 1 76 LEU QD 1 79 LEU QD . . 5.370 3.056 2.131 4.647 . 0 0 "[ . 1 . 2 . 3 ]" 1
1005 1 76 LEU QD 1 79 LEU HG . . 5.440 4.591 3.727 5.445 0.005 28 0 "[ . 1 . 2 . 3 ]" 1
1006 1 76 LEU MD1 1 77 THR H . . 5.500 4.560 3.471 5.003 . 0 0 "[ . 1 . 2 . 3 ]" 1
1007 1 76 LEU MD2 1 77 THR H . . 5.500 4.506 3.748 5.073 . 0 0 "[ . 1 . 2 . 3 ]" 1
1008 1 76 LEU HG 1 77 THR H . . 4.810 4.417 2.313 4.886 0.076 28 0 "[ . 1 . 2 . 3 ]" 1
1009 1 77 THR H 1 77 THR HB . . 3.910 2.612 2.358 2.739 . 0 0 "[ . 1 . 2 . 3 ]" 1
1010 1 77 THR H 1 77 THR HG1 . . 4.670 2.223 1.916 3.604 . 0 0 "[ . 1 . 2 . 3 ]" 1
1011 1 77 THR H 1 77 THR MG . . 4.150 3.801 3.765 3.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
1012 1 77 THR HA 1 80 CYS H . . 4.380 3.636 3.292 3.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
1013 1 77 THR HA 1 80 CYS HB2 . . 4.590 3.384 2.541 4.644 0.054 19 0 "[ . 1 . 2 . 3 ]" 1
1014 1 77 THR HA 1 80 CYS QB . . 3.770 2.850 2.519 3.534 . 0 0 "[ . 1 . 2 . 3 ]" 1
1015 1 77 THR HA 1 80 CYS HB3 . . 4.590 3.704 2.586 4.624 0.034 13 0 "[ . 1 . 2 . 3 ]" 1
1016 1 77 THR HB 1 78 MET H . . 4.290 2.532 2.283 2.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
1017 1 77 THR HG1 1 78 MET H . . 5.110 4.169 3.926 4.849 . 0 0 "[ . 1 . 2 . 3 ]" 1
1018 1 77 THR MG 1 78 MET H . . 4.870 3.403 3.141 3.707 . 0 0 "[ . 1 . 2 . 3 ]" 1
1019 1 77 THR MG 1 80 CYS H . . 4.990 4.956 4.677 5.032 0.042 8 0 "[ . 1 . 2 . 3 ]" 1
1020 1 77 THR MG 1 80 CYS HB2 . . 5.500 4.779 3.310 5.525 0.025 14 0 "[ . 1 . 2 . 3 ]" 1
1021 1 77 THR MG 1 80 CYS HB3 . . 5.500 4.743 3.842 5.519 0.019 13 0 "[ . 1 . 2 . 3 ]" 1
1022 1 77 THR MG 1 81 MET H . . 5.470 4.132 3.873 4.439 . 0 0 "[ . 1 . 2 . 3 ]" 1
1023 1 77 THR MG 1 81 MET ME . . 5.330 4.171 2.038 5.177 . 0 0 "[ . 1 . 2 . 3 ]" 1
1024 1 77 THR MG 1 81 MET HG2 . . 5.500 3.850 2.829 4.381 . 0 0 "[ . 1 . 2 . 3 ]" 1
1025 1 77 THR MG 1 81 MET HG3 . . 5.500 2.840 2.475 3.455 . 0 0 "[ . 1 . 2 . 3 ]" 1
1026 1 77 THR MG 2 73 SER HA . . 5.500 4.373 3.551 4.855 . 0 0 "[ . 1 . 2 . 3 ]" 1
1027 1 77 THR MG 2 73 SER HB2 . . 5.500 2.870 2.118 3.704 . 0 0 "[ . 1 . 2 . 3 ]" 1
1028 1 77 THR MG 2 73 SER HB3 . . 5.500 2.841 2.126 3.655 . 0 0 "[ . 1 . 2 . 3 ]" 1
1029 1 78 MET H 1 78 MET HB2 . . 4.080 2.611 2.264 3.666 . 0 0 "[ . 1 . 2 . 3 ]" 1
1030 1 78 MET H 1 78 MET QB . . 3.570 2.415 2.180 2.665 . 0 0 "[ . 1 . 2 . 3 ]" 1
1031 1 78 MET H 1 78 MET HB3 . . 4.080 3.376 2.402 3.674 . 0 0 "[ . 1 . 2 . 3 ]" 1
1032 1 78 MET H 1 78 MET ME . . 4.580 3.882 3.365 4.609 0.029 22 0 "[ . 1 . 2 . 3 ]" 1
1033 1 78 MET H 1 78 MET HG2 . . 4.620 3.466 2.130 4.481 . 0 0 "[ . 1 . 2 . 3 ]" 1
1034 1 78 MET H 1 78 MET QG . . 3.920 2.519 2.105 3.939 0.019 8 0 "[ . 1 . 2 . 3 ]" 1
1035 1 78 MET H 1 78 MET HG3 . . 4.620 2.764 2.236 4.418 . 0 0 "[ . 1 . 2 . 3 ]" 1
1036 1 78 MET HA 1 78 MET ME . . 5.500 4.498 4.138 4.730 . 0 0 "[ . 1 . 2 . 3 ]" 1
1037 1 78 MET QB 1 79 LEU H . . 4.300 2.724 2.406 3.692 . 0 0 "[ . 1 . 2 . 3 ]" 1
1038 1 78 MET QB 1 82 ALA MB . . 5.340 4.480 3.995 5.188 . 0 0 "[ . 1 . 2 . 3 ]" 1
1039 1 78 MET HB2 1 79 LEU H . . 4.950 2.960 2.459 4.067 . 0 0 "[ . 1 . 2 . 3 ]" 1
1040 1 78 MET HB3 1 79 LEU H . . 4.950 3.529 2.538 4.233 . 0 0 "[ . 1 . 2 . 3 ]" 1
1041 1 78 MET QG 1 79 LEU H . . 4.770 3.936 2.280 4.529 . 0 0 "[ . 1 . 2 . 3 ]" 1
1042 1 79 LEU H 1 79 LEU MD1 . . 4.960 3.638 3.292 4.298 . 0 0 "[ . 1 . 2 . 3 ]" 1
1043 1 79 LEU H 1 79 LEU MD2 . . 4.960 3.355 2.351 3.770 . 0 0 "[ . 1 . 2 . 3 ]" 1
1044 1 79 LEU H 1 79 LEU HG . . 4.580 2.658 2.103 4.406 . 0 0 "[ . 1 . 2 . 3 ]" 1
1045 1 79 LEU H 1 80 CYS H . . 4.410 2.796 2.685 2.934 . 0 0 "[ . 1 . 2 . 3 ]" 1
1046 1 79 LEU H 1 80 CYS QB . . 5.010 4.605 4.295 4.876 . 0 0 "[ . 1 . 2 . 3 ]" 1
1047 1 79 LEU HA 1 79 LEU QD . . 4.240 2.113 1.959 2.246 . 0 0 "[ . 1 . 2 . 3 ]" 1
1048 1 79 LEU HA 1 82 ALA MB . . 4.500 2.656 2.370 3.086 . 0 0 "[ . 1 . 2 . 3 ]" 1
1049 1 79 LEU QB 1 82 ALA MB . . 5.100 4.190 3.747 4.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
1050 1 79 LEU QB 2 9 LEU QD . . 5.280 2.080 1.890 2.358 . 0 0 "[ . 1 . 2 . 3 ]" 1
1051 1 79 LEU HB2 1 80 CYS H . . 4.410 2.658 2.388 3.417 . 0 0 "[ . 1 . 2 . 3 ]" 1
1052 1 79 LEU HB3 1 80 CYS H . . 4.410 3.442 2.497 3.773 . 0 0 "[ . 1 . 2 . 3 ]" 1
1053 1 79 LEU QD 1 81 MET H . . 5.440 5.380 5.026 5.470 0.030 17 0 "[ . 1 . 2 . 3 ]" 1
1054 1 79 LEU QD 1 82 ALA MB . . 5.440 3.359 2.761 3.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
1055 1 79 LEU QD 2 9 LEU QD . . 4.850 2.304 1.951 2.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
1056 1 79 LEU MD1 1 80 CYS H . . 5.500 4.477 3.955 4.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
1057 1 79 LEU MD1 1 83 TYR QE . . 5.500 4.186 2.243 5.517 0.017 21 0 "[ . 1 . 2 . 3 ]" 1
1058 1 79 LEU MD2 1 80 CYS H . . 5.500 4.730 4.199 4.900 . 0 0 "[ . 1 . 2 . 3 ]" 1
1059 1 79 LEU MD2 1 83 TYR QE . . 5.500 4.098 2.669 5.505 0.005 10 0 "[ . 1 . 2 . 3 ]" 1
1060 1 79 LEU HG 1 80 CYS H . . 4.790 4.555 4.043 4.860 0.070 10 0 "[ . 1 . 2 . 3 ]" 1
1061 1 80 CYS H 1 80 CYS HG . . 4.700 3.778 2.148 4.640 . 0 0 "[ . 1 . 2 . 3 ]" 1
1062 1 80 CYS H 1 81 MET H . . 4.080 2.803 2.652 3.010 . 0 0 "[ . 1 . 2 . 3 ]" 1
1063 1 80 CYS H 2 9 LEU QD . . 5.280 2.980 2.515 3.642 . 0 0 "[ . 1 . 2 . 3 ]" 1
1064 1 80 CYS HA 1 82 ALA H . . 4.320 4.334 4.260 4.360 0.040 1 0 "[ . 1 . 2 . 3 ]" 1
1065 1 80 CYS HA 1 83 TYR H . . 4.150 3.367 2.954 3.864 . 0 0 "[ . 1 . 2 . 3 ]" 1
1066 1 80 CYS HA 2 9 LEU QD . . 5.440 3.298 2.228 4.423 . 0 0 "[ . 1 . 2 . 3 ]" 1
1067 1 80 CYS HA 2 13 VAL MG1 . . 5.500 4.337 2.522 5.524 0.024 24 0 "[ . 1 . 2 . 3 ]" 1
1068 1 80 CYS HA 2 13 VAL QG . . 4.620 3.015 2.359 4.453 . 0 0 "[ . 1 . 2 . 3 ]" 1
1069 1 80 CYS HA 2 13 VAL MG2 . . 5.500 3.677 2.368 5.255 . 0 0 "[ . 1 . 2 . 3 ]" 1
1070 1 80 CYS QB 1 81 MET H . . 3.810 2.870 2.584 3.619 . 0 0 "[ . 1 . 2 . 3 ]" 1
1071 1 80 CYS QB 2 9 LEU QD . . 4.850 3.031 2.084 4.017 . 0 0 "[ . 1 . 2 . 3 ]" 1
1072 1 80 CYS QB 2 12 MET QG . . 5.500 4.784 3.833 5.556 0.056 13 0 "[ . 1 . 2 . 3 ]" 1
1073 1 80 CYS QB 2 13 VAL QG . . 5.280 3.468 2.594 4.827 . 0 0 "[ . 1 . 2 . 3 ]" 1
1074 1 80 CYS HB2 1 81 MET H . . 4.460 3.485 2.639 4.138 . 0 0 "[ . 1 . 2 . 3 ]" 1
1075 1 80 CYS HB3 1 81 MET H . . 4.460 3.354 2.821 3.995 . 0 0 "[ . 1 . 2 . 3 ]" 1
1076 1 81 MET H 1 81 MET QB . . 3.690 2.391 2.250 2.487 . 0 0 "[ . 1 . 2 . 3 ]" 1
1077 1 81 MET H 1 81 MET ME . . 5.500 4.753 3.366 5.110 . 0 0 "[ . 1 . 2 . 3 ]" 1
1078 1 81 MET H 1 81 MET HG2 . . 4.610 3.468 2.323 3.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
1079 1 81 MET H 1 81 MET QG . . 4.010 2.510 2.283 2.727 . 0 0 "[ . 1 . 2 . 3 ]" 1
1080 1 81 MET H 1 81 MET HG3 . . 4.610 2.709 2.400 3.660 . 0 0 "[ . 1 . 2 . 3 ]" 1
1081 1 81 MET H 1 82 ALA H . . 4.210 2.716 2.597 2.863 . 0 0 "[ . 1 . 2 . 3 ]" 1
1082 1 81 MET H 1 82 ALA MB . . 5.300 4.394 4.266 4.528 . 0 0 "[ . 1 . 2 . 3 ]" 1
1083 1 81 MET H 2 69 PHE QE . . 5.500 4.463 3.210 5.490 . 0 0 "[ . 1 . 2 . 3 ]" 1
1084 1 81 MET HA 1 81 MET ME . . 4.140 3.581 2.013 4.216 0.076 20 0 "[ . 1 . 2 . 3 ]" 1
1085 1 81 MET HA 1 84 ASN H . . 4.320 3.427 3.201 3.708 . 0 0 "[ . 1 . 2 . 3 ]" 1
1086 1 81 MET HA 1 84 ASN QB . . 5.190 2.718 2.129 3.208 . 0 0 "[ . 1 . 2 . 3 ]" 1
1087 1 81 MET HA 2 69 PHE QD . . 5.500 3.956 3.445 4.720 . 0 0 "[ . 1 . 2 . 3 ]" 1
1088 1 81 MET HA 2 69 PHE QE . . 5.500 3.802 2.275 5.242 . 0 0 "[ . 1 . 2 . 3 ]" 1
1089 1 81 MET HB2 1 82 ALA H . . 4.320 2.864 2.604 3.307 . 0 0 "[ . 1 . 2 . 3 ]" 1
1090 1 81 MET HB3 1 82 ALA H . . 4.320 3.669 3.282 4.070 . 0 0 "[ . 1 . 2 . 3 ]" 1
1091 1 81 MET ME 2 69 PHE QD . . 5.500 3.945 2.744 5.507 0.007 9 0 "[ . 1 . 2 . 3 ]" 1
1092 1 81 MET ME 2 70 LYS H . . 5.500 4.282 2.357 5.521 0.021 20 0 "[ . 1 . 2 . 3 ]" 1
1093 1 81 MET ME 2 70 LYS HA . . 5.500 4.808 3.423 5.529 0.029 18 0 "[ . 1 . 2 . 3 ]" 1
1094 1 81 MET ME 2 70 LYS QD . . 5.230 2.976 2.144 4.876 . 0 0 "[ . 1 . 2 . 3 ]" 1
1095 1 81 MET ME 2 70 LYS QG . . 5.500 3.642 2.239 5.277 . 0 0 "[ . 1 . 2 . 3 ]" 1
1096 1 81 MET QG 1 82 ALA H . . 4.660 4.316 4.085 4.437 . 0 0 "[ . 1 . 2 . 3 ]" 1
1097 1 81 MET QG 2 69 PHE QE . . 5.500 3.662 2.233 4.854 . 0 0 "[ . 1 . 2 . 3 ]" 1
1098 1 81 MET QG 2 70 LYS QD . . 5.340 4.409 2.906 5.380 0.040 17 0 "[ . 1 . 2 . 3 ]" 1
1099 1 81 MET HG2 1 82 ALA H . . 5.410 5.069 4.451 5.313 . 0 0 "[ . 1 . 2 . 3 ]" 1
1100 1 81 MET HG2 2 69 PHE QD . . 5.500 3.207 2.396 4.090 . 0 0 "[ . 1 . 2 . 3 ]" 1
1101 1 81 MET HG2 2 69 PHE QE . . 5.500 4.079 2.252 5.511 0.011 9 0 "[ . 1 . 2 . 3 ]" 1
1102 1 81 MET HG2 2 70 LYS HA . . 5.500 5.394 4.545 5.584 0.084 28 0 "[ . 1 . 2 . 3 ]" 1
1103 1 81 MET HG3 1 82 ALA H . . 5.410 4.699 4.499 5.012 . 0 0 "[ . 1 . 2 . 3 ]" 1
1104 1 81 MET HG3 2 69 PHE QD . . 5.500 3.705 2.574 5.230 . 0 0 "[ . 1 . 2 . 3 ]" 1
1105 1 81 MET HG3 2 69 PHE QE . . 5.500 4.395 2.596 5.505 0.005 23 0 "[ . 1 . 2 . 3 ]" 1
1106 1 81 MET HG3 2 70 LYS HA . . 5.500 5.232 4.286 5.529 0.029 14 0 "[ . 1 . 2 . 3 ]" 1
1107 1 82 ALA H 1 82 ALA MB . . 3.600 2.236 2.208 2.280 . 0 0 "[ . 1 . 2 . 3 ]" 1
1108 1 82 ALA H 1 83 TYR H . . 4.100 2.743 2.544 2.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
1109 1 82 ALA HA 1 85 ASP H . . 4.210 3.456 3.183 3.684 . 0 0 "[ . 1 . 2 . 3 ]" 1
1110 1 82 ALA HA 1 85 ASP HB2 . . 4.070 3.298 2.475 4.017 . 0 0 "[ . 1 . 2 . 3 ]" 1
1111 1 82 ALA HA 1 85 ASP HB3 . . 4.070 3.613 2.986 4.142 0.072 18 0 "[ . 1 . 2 . 3 ]" 1
1112 1 82 ALA MB 1 83 TYR H . . 4.280 2.597 2.392 2.722 . 0 0 "[ . 1 . 2 . 3 ]" 1
1113 1 82 ALA MB 1 83 TYR QB . . 5.340 4.226 4.030 4.471 . 0 0 "[ . 1 . 2 . 3 ]" 1
1114 1 82 ALA MB 1 83 TYR QD . . 5.500 3.679 2.440 4.455 . 0 0 "[ . 1 . 2 . 3 ]" 1
1115 1 82 ALA MB 1 84 ASN H . . 5.030 4.498 4.334 4.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
1116 1 82 ALA MB 1 85 ASP H . . 5.500 4.701 4.465 4.892 . 0 0 "[ . 1 . 2 . 3 ]" 1
1117 1 82 ALA MB 1 85 ASP QB . . 5.340 4.126 3.904 4.421 . 0 0 "[ . 1 . 2 . 3 ]" 1
1118 1 82 ALA MB 1 86 PHE QD . . 5.500 4.091 3.921 4.318 . 0 0 "[ . 1 . 2 . 3 ]" 1
1119 1 82 ALA MB 1 86 PHE QE . . 5.500 5.480 5.140 5.523 0.023 29 0 "[ . 1 . 2 . 3 ]" 1
1120 1 83 TYR H 1 83 TYR QB . . 3.610 2.233 2.068 2.569 . 0 0 "[ . 1 . 2 . 3 ]" 1
1121 1 83 TYR H 1 83 TYR QD . . 4.820 2.909 2.247 3.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
1122 1 83 TYR H 1 83 TYR QE . . 5.500 4.931 4.383 5.509 0.009 13 0 "[ . 1 . 2 . 3 ]" 1
1123 1 83 TYR HA 1 83 TYR QE . . 5.500 4.422 4.258 4.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
1124 1 83 TYR HA 1 86 PHE QB . . 3.780 2.254 2.038 2.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
1125 1 83 TYR HA 1 86 PHE QD . . 5.330 3.529 3.151 3.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
1126 1 83 TYR HA 1 86 PHE QE . . 5.500 5.483 5.139 5.525 0.025 23 0 "[ . 1 . 2 . 3 ]" 1
1127 1 83 TYR QB 1 84 ASN H . . 3.870 3.046 2.843 3.323 . 0 0 "[ . 1 . 2 . 3 ]" 1
1128 1 83 TYR QB 1 86 PHE QD . . 5.340 5.210 5.039 5.345 0.005 31 0 "[ . 1 . 2 . 3 ]" 1
1129 1 83 TYR QB 2 13 VAL QG . . 4.290 2.049 1.882 2.311 . 0 0 "[ . 1 . 2 . 3 ]" 1
1130 1 83 TYR HB2 1 84 ASN H . . 4.630 3.256 2.942 3.758 . 0 0 "[ . 1 . 2 . 3 ]" 1
1131 1 83 TYR HB2 2 13 VAL MG1 . . 5.500 3.422 2.262 4.529 . 0 0 "[ . 1 . 2 . 3 ]" 1
1132 1 83 TYR HB2 2 13 VAL MG2 . . 5.500 2.945 2.153 4.604 . 0 0 "[ . 1 . 2 . 3 ]" 1
1133 1 83 TYR HB3 1 84 ASN H . . 4.630 3.710 3.313 3.987 . 0 0 "[ . 1 . 2 . 3 ]" 1
1134 1 83 TYR HB3 2 13 VAL MG1 . . 5.500 2.765 2.113 3.718 . 0 0 "[ . 1 . 2 . 3 ]" 1
1135 1 83 TYR HB3 2 13 VAL MG2 . . 5.500 2.560 2.094 4.063 . 0 0 "[ . 1 . 2 . 3 ]" 1
1136 1 83 TYR QD 1 84 ASN H . . 5.500 4.778 4.534 4.974 . 0 0 "[ . 1 . 2 . 3 ]" 1
1137 1 83 TYR QD 2 9 LEU QB . . 5.500 3.197 2.353 5.291 . 0 0 "[ . 1 . 2 . 3 ]" 1
1138 1 83 TYR QD 2 10 THR MG . . 5.500 3.318 2.316 4.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
1139 1 83 TYR QD 2 13 VAL MG1 . . 5.500 4.087 2.519 5.242 . 0 0 "[ . 1 . 2 . 3 ]" 1
1140 1 83 TYR QD 2 13 VAL QG . . 5.500 3.424 2.497 3.751 . 0 0 "[ . 1 . 2 . 3 ]" 1
1141 1 83 TYR QD 2 13 VAL MG2 . . 5.500 3.902 2.868 5.305 . 0 0 "[ . 1 . 2 . 3 ]" 1
1142 1 83 TYR QE 2 9 LEU QB . . 5.500 3.489 2.296 5.520 0.020 13 0 "[ . 1 . 2 . 3 ]" 1
1143 1 83 TYR QE 2 9 LEU QD . . 5.500 3.425 2.249 4.721 . 0 0 "[ . 1 . 2 . 3 ]" 1
1144 1 83 TYR QE 2 10 THR H . . 5.500 4.498 2.831 5.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
1145 1 83 TYR QE 2 10 THR MG . . 5.500 3.689 2.114 5.501 0.001 26 0 "[ . 1 . 2 . 3 ]" 1
1146 1 83 TYR QE 2 13 VAL QG . . 5.500 4.989 4.222 5.342 . 0 0 "[ . 1 . 2 . 3 ]" 1
1147 1 84 ASN H 1 84 ASN QD . . 5.340 4.388 3.891 4.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
1148 1 84 ASN H 1 85 ASP H . . 4.080 2.684 2.459 2.936 . 0 0 "[ . 1 . 2 . 3 ]" 1
1149 1 84 ASN H 1 86 PHE H . . 4.800 4.140 3.912 4.346 . 0 0 "[ . 1 . 2 . 3 ]" 1
1150 1 84 ASN H 2 13 VAL MG1 . . 5.230 3.430 2.436 4.901 . 0 0 "[ . 1 . 2 . 3 ]" 1
1151 1 84 ASN H 2 13 VAL QG . . 4.600 2.775 2.409 3.231 . 0 0 "[ . 1 . 2 . 3 ]" 1
1152 1 84 ASN H 2 13 VAL MG2 . . 5.230 3.254 2.602 4.511 . 0 0 "[ . 1 . 2 . 3 ]" 1
1153 1 84 ASN H 2 69 PHE QE . . 5.500 4.678 4.068 5.505 0.005 5 0 "[ . 1 . 2 . 3 ]" 1
1154 1 84 ASN HA 1 87 PHE QD . . 5.500 4.331 2.683 5.061 . 0 0 "[ . 1 . 2 . 3 ]" 1
1155 1 84 ASN HA 2 13 VAL MG1 . . 5.500 2.712 2.013 4.104 . 0 0 "[ . 1 . 2 . 3 ]" 1
1156 1 84 ASN HA 2 13 VAL MG2 . . 5.500 3.009 1.994 3.769 . 0 0 "[ . 1 . 2 . 3 ]" 1
1157 1 84 ASN QB 1 85 ASP H . . 3.910 2.559 2.259 2.799 . 0 0 "[ . 1 . 2 . 3 ]" 1
1158 1 84 ASN QB 1 88 LEU QD . . 4.070 4.061 3.631 4.127 0.057 26 0 "[ . 1 . 2 . 3 ]" 1
1159 1 84 ASN QB 2 13 VAL QG . . 5.440 2.568 2.049 3.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
1160 1 84 ASN HB2 1 85 ASP H . . 4.560 3.802 3.018 4.048 . 0 0 "[ . 1 . 2 . 3 ]" 1
1161 1 84 ASN HB3 1 85 ASP H . . 4.560 2.611 2.278 2.967 . 0 0 "[ . 1 . 2 . 3 ]" 1
1162 1 84 ASN QD 1 88 LEU QD . . 4.840 2.740 1.771 4.840 . 0 0 "[ . 1 . 2 . 3 ]" 1
1163 1 84 ASN QD 2 13 VAL QG . . 5.500 3.791 1.704 4.982 . 0 0 "[ . 1 . 2 . 3 ]" 1
1164 1 85 ASP H 1 85 ASP HB2 . . 3.780 2.253 2.027 2.460 . 0 0 "[ . 1 . 2 . 3 ]" 1
1165 1 85 ASP H 1 85 ASP QB . . 3.580 2.143 2.011 2.285 . 0 0 "[ . 1 . 2 . 3 ]" 1
1166 1 85 ASP H 1 85 ASP HB3 . . 3.780 2.897 2.395 3.496 . 0 0 "[ . 1 . 2 . 3 ]" 1
1167 1 85 ASP H 1 86 PHE HB2 . . 5.370 4.410 4.126 4.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
1168 1 85 ASP H 1 86 PHE HB3 . . 5.370 5.101 4.658 5.392 0.022 12 0 "[ . 1 . 2 . 3 ]" 1
1169 1 85 ASP H 1 88 LEU QD . . 5.280 4.267 3.991 4.602 . 0 0 "[ . 1 . 2 . 3 ]" 1
1170 1 85 ASP HA 1 87 PHE H . . 4.530 4.443 4.250 4.559 0.029 10 0 "[ . 1 . 2 . 3 ]" 1
1171 1 85 ASP HA 1 88 LEU H . . 4.370 3.374 3.025 3.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
1172 1 85 ASP HA 1 88 LEU QB . . 4.560 2.754 2.202 3.410 . 0 0 "[ . 1 . 2 . 3 ]" 1
1173 1 85 ASP HA 1 88 LEU MD1 . . 5.330 2.362 2.149 2.914 . 0 0 "[ . 1 . 2 . 3 ]" 1
1174 1 85 ASP HA 1 88 LEU QD . . 4.050 2.355 2.146 2.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
1175 1 85 ASP HA 1 88 LEU MD2 . . 5.330 4.746 3.664 5.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
1176 1 85 ASP HB2 1 86 PHE H . . 4.140 3.436 2.687 3.744 . 0 0 "[ . 1 . 2 . 3 ]" 1
1177 1 85 ASP HB3 1 86 PHE H . . 4.140 2.845 2.303 4.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
1178 1 86 PHE H 1 86 PHE HB2 . . 3.710 2.051 1.987 2.234 . 0 0 "[ . 1 . 2 . 3 ]" 1
1179 1 86 PHE H 1 86 PHE HB3 . . 3.710 2.915 2.464 3.280 . 0 0 "[ . 1 . 2 . 3 ]" 1
1180 1 86 PHE H 1 86 PHE QD . . 5.400 3.872 3.366 4.100 . 0 0 "[ . 1 . 2 . 3 ]" 1
1181 1 86 PHE H 1 87 PHE H . . 4.050 2.908 2.783 3.032 . 0 0 "[ . 1 . 2 . 3 ]" 1
1182 1 86 PHE HA 1 86 PHE QE . . 4.880 4.600 4.384 4.893 0.013 29 0 "[ . 1 . 2 . 3 ]" 1
1183 1 86 PHE HA 1 89 GLU H . . 3.940 3.604 3.399 3.920 . 0 0 "[ . 1 . 2 . 3 ]" 1
1184 1 86 PHE HA 1 89 GLU QB . . 3.700 3.065 2.704 3.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
1185 1 86 PHE HA 1 89 GLU QG . . 4.640 4.127 3.339 4.674 0.034 11 0 "[ . 1 . 2 . 3 ]" 1
1186 1 86 PHE QB 1 87 PHE H . . 3.770 2.435 2.265 2.614 . 0 0 "[ . 1 . 2 . 3 ]" 1
1187 1 86 PHE QD 1 87 PHE H . . 5.500 4.136 3.750 4.411 . 0 0 "[ . 1 . 2 . 3 ]" 1
1188 1 86 PHE QD 1 87 PHE HA . . 5.500 4.097 3.481 4.945 . 0 0 "[ . 1 . 2 . 3 ]" 1
1189 1 86 PHE QD 1 90 ASP QB . . 5.080 3.609 2.247 4.788 . 0 0 "[ . 1 . 2 . 3 ]" 1
1190 1 87 PHE H 1 87 PHE HB2 . . 3.880 2.441 2.253 2.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
1191 1 87 PHE H 1 87 PHE HB3 . . 3.880 2.457 2.207 3.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
1192 1 87 PHE H 1 87 PHE QD . . 5.430 4.117 3.102 4.225 . 0 0 "[ . 1 . 2 . 3 ]" 1
1193 1 87 PHE H 1 88 LEU H . . 4.370 2.769 2.552 2.939 . 0 0 "[ . 1 . 2 . 3 ]" 1
1194 1 87 PHE H 1 89 GLU H . . 4.790 4.201 3.919 4.382 . 0 0 "[ . 1 . 2 . 3 ]" 1
1195 1 87 PHE H 2 13 VAL QG . . 5.440 4.050 3.743 4.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
1196 1 87 PHE HA 1 87 PHE QE . . 5.500 4.768 4.510 4.956 . 0 0 "[ . 1 . 2 . 3 ]" 1
1197 1 87 PHE HA 1 90 ASP HB2 . . 4.390 3.210 2.192 4.393 0.003 15 0 "[ . 1 . 2 . 3 ]" 1
1198 1 87 PHE HA 1 90 ASP QB . . 3.810 2.515 2.139 3.463 . 0 0 "[ . 1 . 2 . 3 ]" 1
1199 1 87 PHE HA 1 90 ASP HB3 . . 4.390 3.026 2.176 4.396 0.006 19 0 "[ . 1 . 2 . 3 ]" 1
1200 1 87 PHE HA 1 91 ASN H . . 4.270 3.915 3.129 4.304 0.034 10 0 "[ . 1 . 2 . 3 ]" 1
1201 1 87 PHE HA 1 91 ASN HD21 . . 5.500 4.277 2.973 5.358 . 0 0 "[ . 1 . 2 . 3 ]" 1
1202 1 87 PHE HA 1 91 ASN HD22 . . 5.500 4.905 3.575 5.575 0.075 27 0 "[ . 1 . 2 . 3 ]" 1
1203 1 87 PHE QB 1 88 LEU H . . 3.700 2.907 2.725 3.220 . 0 0 "[ . 1 . 2 . 3 ]" 1
1204 1 87 PHE QB 2 13 VAL QG . . 4.810 2.886 2.391 4.869 0.059 16 0 "[ . 1 . 2 . 3 ]" 1
1205 1 87 PHE HB2 1 88 LEU H . . 4.290 4.070 2.789 4.268 . 0 0 "[ . 1 . 2 . 3 ]" 1
1206 1 87 PHE HB3 1 88 LEU H . . 4.290 3.010 2.771 3.924 . 0 0 "[ . 1 . 2 . 3 ]" 1
1207 1 87 PHE QD 1 88 LEU H . . 5.140 3.804 3.118 4.297 . 0 0 "[ . 1 . 2 . 3 ]" 1
1208 1 87 PHE QD 1 88 LEU MD1 . . 5.500 4.400 2.717 4.935 . 0 0 "[ . 1 . 2 . 3 ]" 1
1209 1 87 PHE QD 1 88 LEU MD2 . . 5.500 3.308 2.478 5.189 . 0 0 "[ . 1 . 2 . 3 ]" 1
1210 1 87 PHE QD 1 88 LEU HG . . 5.500 3.208 2.487 4.097 . 0 0 "[ . 1 . 2 . 3 ]" 1
1211 1 87 PHE QD 1 91 ASN QD . . 5.310 3.793 2.953 4.949 . 0 0 "[ . 1 . 2 . 3 ]" 1
1212 1 87 PHE QD 2 13 VAL QG . . 5.440 3.494 2.553 4.220 . 0 0 "[ . 1 . 2 . 3 ]" 1
1213 1 87 PHE QD 2 14 THR MG . . 5.500 5.374 4.354 5.521 0.021 16 0 "[ . 1 . 2 . 3 ]" 1
1214 1 87 PHE QE 1 88 LEU HG . . 5.500 5.146 4.164 5.620 0.120 16 0 "[ . 1 . 2 . 3 ]" 1
1215 1 87 PHE QE 2 14 THR MG . . 5.500 4.230 2.731 4.913 . 0 0 "[ . 1 . 2 . 3 ]" 1
1216 1 87 PHE HZ 2 14 THR MG . . 5.500 4.965 3.402 5.518 0.018 23 0 "[ . 1 . 2 . 3 ]" 1
1217 1 88 LEU H 1 88 LEU HB2 . . 4.090 2.362 2.246 2.517 . 0 0 "[ . 1 . 2 . 3 ]" 1
1218 1 88 LEU H 1 88 LEU QB . . 3.550 2.331 2.222 2.473 . 0 0 "[ . 1 . 2 . 3 ]" 1
1219 1 88 LEU H 1 88 LEU HB3 . . 4.090 3.587 3.533 3.633 . 0 0 "[ . 1 . 2 . 3 ]" 1
1220 1 88 LEU H 1 88 LEU MD1 . . 4.640 3.454 2.284 3.799 . 0 0 "[ . 1 . 2 . 3 ]" 1
1221 1 88 LEU H 1 88 LEU MD2 . . 4.640 3.788 3.394 4.164 . 0 0 "[ . 1 . 2 . 3 ]" 1
1222 1 88 LEU H 1 88 LEU HG . . 4.260 2.646 2.297 3.893 . 0 0 "[ . 1 . 2 . 3 ]" 1
1223 1 88 LEU H 1 89 GLU H . . 3.840 2.524 2.316 2.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
1224 1 88 LEU H 1 89 GLU QB . . 5.230 4.462 4.254 4.639 . 0 0 "[ . 1 . 2 . 3 ]" 1
1225 1 88 LEU H 1 90 ASP H . . 4.070 3.996 3.732 4.114 0.044 11 0 "[ . 1 . 2 . 3 ]" 1
1226 1 88 LEU HA 1 88 LEU QD . . 3.720 2.202 2.080 2.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
1227 1 88 LEU HA 1 89 GLU QG . . 5.150 5.169 4.979 5.209 0.059 2 0 "[ . 1 . 2 . 3 ]" 1
1228 1 88 LEU HA 1 90 ASP H . . 4.640 4.061 3.422 4.659 0.019 12 0 "[ . 1 . 2 . 3 ]" 1
1229 1 88 LEU HA 1 91 ASN H . . 4.400 3.852 3.074 4.402 0.002 29 0 "[ . 1 . 2 . 3 ]" 1
1230 1 88 LEU HA 1 91 ASN QB . . 4.390 3.651 2.273 4.458 0.068 3 0 "[ . 1 . 2 . 3 ]" 1
1231 1 88 LEU QB 1 89 GLU H . . 3.940 3.098 2.686 3.306 . 0 0 "[ . 1 . 2 . 3 ]" 1
1232 1 88 LEU HB2 1 89 GLU H . . 4.120 3.228 2.776 3.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
1233 1 88 LEU HB3 1 89 GLU H . . 4.120 4.004 3.576 4.155 0.035 15 0 "[ . 1 . 2 . 3 ]" 1
1234 1 88 LEU QD 1 89 GLU QG . . 5.280 4.789 4.434 5.106 . 0 0 "[ . 1 . 2 . 3 ]" 1
1235 1 88 LEU MD1 1 89 GLU H . . 5.170 4.912 4.236 5.179 0.009 15 0 "[ . 1 . 2 . 3 ]" 1
1236 1 88 LEU MD2 1 89 GLU H . . 5.170 4.929 4.735 5.185 0.015 27 0 "[ . 1 . 2 . 3 ]" 1
1237 1 88 LEU HG 1 89 GLU H . . 5.070 4.728 4.367 5.133 0.063 27 0 "[ . 1 . 2 . 3 ]" 1
1238 1 89 GLU H 1 89 GLU QB . . 3.040 2.321 2.156 2.461 . 0 0 "[ . 1 . 2 . 3 ]" 1
1239 1 89 GLU H 1 89 GLU HG2 . . 4.280 3.037 2.523 3.836 . 0 0 "[ . 1 . 2 . 3 ]" 1
1240 1 89 GLU H 1 89 GLU QG . . 3.870 2.922 2.480 3.363 . 0 0 "[ . 1 . 2 . 3 ]" 1
1241 1 89 GLU H 1 89 GLU HG3 . . 4.280 4.046 2.688 4.289 0.009 18 0 "[ . 1 . 2 . 3 ]" 1
1242 1 89 GLU H 1 90 ASP H . . 3.480 2.376 2.148 2.765 . 0 0 "[ . 1 . 2 . 3 ]" 1
1243 1 89 GLU HA 1 89 GLU HG2 . . 4.090 2.780 2.276 3.203 . 0 0 "[ . 1 . 2 . 3 ]" 1
1244 1 89 GLU HA 1 89 GLU HG3 . . 4.090 3.611 2.755 3.726 . 0 0 "[ . 1 . 2 . 3 ]" 1
1245 1 89 GLU HA 1 90 ASP H . . 3.350 3.368 3.264 3.475 0.125 12 0 "[ . 1 . 2 . 3 ]" 1
1246 1 89 GLU HA 1 90 ASP HA . . 5.070 4.720 4.477 4.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
1247 1 89 GLU QB 1 90 ASP H . . 3.410 3.203 2.697 3.462 0.052 27 0 "[ . 1 . 2 . 3 ]" 1
1248 1 90 ASP H 1 90 ASP HB2 . . 3.490 2.606 2.179 2.985 . 0 0 "[ . 1 . 2 . 3 ]" 1
1249 1 90 ASP H 1 90 ASP QB . . 2.940 2.242 2.028 2.430 . 0 0 "[ . 1 . 2 . 3 ]" 1
1250 1 90 ASP H 1 90 ASP HB3 . . 3.490 2.701 2.170 3.552 0.062 25 0 "[ . 1 . 2 . 3 ]" 1
1251 1 90 ASP HA 1 92 LYS H . . 5.500 3.920 3.618 4.374 . 0 0 "[ . 1 . 2 . 3 ]" 1
1252 1 90 ASP QB 1 91 ASN QD . . 4.690 2.761 2.063 4.127 . 0 0 "[ . 1 . 2 . 3 ]" 1
1253 1 90 ASP QB 1 92 LYS H . . 4.500 4.535 4.303 4.594 0.094 8 0 "[ . 1 . 2 . 3 ]" 1
1254 1 91 ASN H 1 91 ASN HB2 . . 3.570 2.405 2.101 3.547 . 0 0 "[ . 1 . 2 . 3 ]" 1
1255 1 91 ASN H 1 91 ASN QB . . 2.940 2.226 2.083 2.386 . 0 0 "[ . 1 . 2 . 3 ]" 1
1256 1 91 ASN H 1 91 ASN HB3 . . 3.570 3.366 2.241 3.586 0.016 16 0 "[ . 1 . 2 . 3 ]" 1
1257 1 91 ASN H 1 91 ASN QD . . 4.250 2.504 1.682 2.981 . 0 0 "[ . 1 . 2 . 3 ]" 1
1258 1 91 ASN H 1 92 LYS H . . 3.330 3.013 2.563 3.383 0.053 19 0 "[ . 1 . 2 . 3 ]" 1
1259 1 91 ASN HA 1 92 LYS H . . 3.340 2.869 2.379 3.375 0.035 24 0 "[ . 1 . 2 . 3 ]" 1
1260 1 91 ASN QB 1 92 LYS H . . 3.720 3.727 3.179 3.819 0.099 27 0 "[ . 1 . 2 . 3 ]" 1
1261 1 91 ASN HB2 1 92 LYS H . . 4.250 4.122 3.339 4.321 0.071 3 0 "[ . 1 . 2 . 3 ]" 1
1262 1 91 ASN HB3 1 92 LYS H . . 4.250 4.266 3.990 4.330 0.080 21 0 "[ . 1 . 2 . 3 ]" 1
1263 1 92 LYS H 1 92 LYS HB2 . . 3.470 2.853 2.203 3.658 0.188 12 0 "[ . 1 . 2 . 3 ]" 1
1264 1 92 LYS H 1 92 LYS QB . . 3.000 2.322 1.870 3.005 0.005 12 0 "[ . 1 . 2 . 3 ]" 1
1265 1 92 LYS H 1 92 LYS HB3 . . 3.470 2.892 1.919 3.569 0.099 19 0 "[ . 1 . 2 . 3 ]" 1
1266 1 92 LYS H 1 92 LYS QD . . 3.970 3.713 2.031 4.089 0.119 24 0 "[ . 1 . 2 . 3 ]" 1
1267 1 92 LYS H 1 92 LYS QG . . 3.640 2.643 1.787 3.810 0.170 24 0 "[ . 1 . 2 . 3 ]" 1
1268 2 1 MET QB 2 2 GLU H . . 4.890 2.729 1.847 3.995 . 0 0 "[ . 1 . 2 . 3 ]" 1
1269 2 1 MET QB 2 3 THR H . . 5.500 5.442 4.221 5.645 0.145 7 0 "[ . 1 . 2 . 3 ]" 1
1270 2 1 MET QG 2 2 GLU H . . 5.500 3.823 2.152 4.900 . 0 0 "[ . 1 . 2 . 3 ]" 1
1271 2 2 GLU H 2 6 GLU QB . . 5.340 4.958 2.866 5.389 0.049 21 0 "[ . 1 . 2 . 3 ]" 1
1272 2 2 GLU HA 2 3 THR MG . . 5.500 3.793 2.923 4.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
1273 2 2 GLU QB 2 3 THR H . . 4.200 2.323 1.589 3.742 . 0 0 "[ . 1 . 2 . 3 ]" 1
1274 2 2 GLU QB 2 6 GLU H . . 4.670 4.509 4.015 4.776 0.106 29 0 "[ . 1 . 2 . 3 ]" 1
1275 2 2 GLU QG 2 3 THR H . . 4.710 3.950 2.555 4.733 0.023 19 0 "[ . 1 . 2 . 3 ]" 1
1276 2 3 THR H 2 3 THR MG . . 4.610 2.548 1.994 3.253 . 0 0 "[ . 1 . 2 . 3 ]" 1
1277 2 3 THR H 2 6 GLU HB2 . . 5.500 3.407 2.291 5.503 0.003 17 0 "[ . 1 . 2 . 3 ]" 1
1278 2 3 THR H 2 6 GLU QB . . 4.620 3.042 2.229 4.642 0.022 17 0 "[ . 1 . 2 . 3 ]" 1
1279 2 3 THR H 2 6 GLU HB3 . . 5.500 4.077 2.289 5.524 0.024 24 0 "[ . 1 . 2 . 3 ]" 1
1280 2 3 THR HA 2 4 PRO HG2 . . 5.500 4.633 4.452 5.054 . 0 0 "[ . 1 . 2 . 3 ]" 1
1281 2 3 THR HA 2 4 PRO QG . . 4.830 4.182 4.029 4.481 . 0 0 "[ . 1 . 2 . 3 ]" 1
1282 2 3 THR HA 2 4 PRO HG3 . . 5.500 4.766 4.603 5.007 . 0 0 "[ . 1 . 2 . 3 ]" 1
1283 2 3 THR HB 2 4 PRO HD2 . . 4.950 2.320 1.938 3.663 . 0 0 "[ . 1 . 2 . 3 ]" 1
1284 2 3 THR HB 2 4 PRO HD3 . . 4.950 3.753 3.088 4.837 . 0 0 "[ . 1 . 2 . 3 ]" 1
1285 2 3 THR MG 2 4 PRO HD2 . . 5.500 3.276 2.416 4.051 . 0 0 "[ . 1 . 2 . 3 ]" 1
1286 2 3 THR MG 2 4 PRO QD . . 4.700 3.163 2.304 3.861 . 0 0 "[ . 1 . 2 . 3 ]" 1
1287 2 3 THR MG 2 4 PRO HD3 . . 5.500 4.200 2.909 4.907 . 0 0 "[ . 1 . 2 . 3 ]" 1
1288 2 3 THR MG 2 6 GLU QG . . 5.340 4.302 2.353 5.416 0.076 17 0 "[ . 1 . 2 . 3 ]" 1
1289 2 4 PRO HA 2 7 LYS QB . . 3.660 2.489 2.134 3.670 0.010 22 0 "[ . 1 . 2 . 3 ]" 1
1290 2 4 PRO HA 2 7 LYS QD . . 4.980 3.819 2.242 5.013 0.033 19 0 "[ . 1 . 2 . 3 ]" 1
1291 2 4 PRO HA 2 7 LYS QG . . 4.420 3.407 2.060 4.421 0.001 15 0 "[ . 1 . 2 . 3 ]" 1
1292 2 4 PRO QB 2 5 LEU H . . 3.710 3.595 3.350 3.727 0.017 20 0 "[ . 1 . 2 . 3 ]" 1
1293 2 4 PRO HD2 2 5 LEU H . . 5.500 3.048 2.672 3.563 . 0 0 "[ . 1 . 2 . 3 ]" 1
1294 2 4 PRO HD3 2 5 LEU H . . 5.500 4.102 3.925 4.367 . 0 0 "[ . 1 . 2 . 3 ]" 1
1295 2 4 PRO QG 2 5 LEU H . . 4.600 2.842 2.535 3.218 . 0 0 "[ . 1 . 2 . 3 ]" 1
1296 2 4 PRO HG2 2 5 LEU H . . 5.500 2.880 2.558 3.276 . 0 0 "[ . 1 . 2 . 3 ]" 1
1297 2 4 PRO HG3 2 5 LEU H . . 5.500 4.376 4.138 4.709 . 0 0 "[ . 1 . 2 . 3 ]" 1
1298 2 5 LEU H 2 6 GLU H . . 5.500 2.667 2.416 2.952 . 0 0 "[ . 1 . 2 . 3 ]" 1
1299 2 5 LEU HA 2 5 LEU MD1 . . 4.740 2.845 2.097 3.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
1300 2 5 LEU HA 2 5 LEU QD . . 3.690 2.287 1.938 3.119 . 0 0 "[ . 1 . 2 . 3 ]" 1
1301 2 5 LEU HA 2 5 LEU MD2 . . 4.740 2.676 2.074 3.940 . 0 0 "[ . 1 . 2 . 3 ]" 1
1302 2 5 LEU HA 2 5 LEU HG . . 3.850 3.210 2.264 3.859 0.009 13 0 "[ . 1 . 2 . 3 ]" 1
1303 2 5 LEU HA 2 8 ALA MB . . 3.940 2.448 2.112 3.115 . 0 0 "[ . 1 . 2 . 3 ]" 1
1304 2 5 LEU QD 2 6 GLU H . . 4.830 3.628 2.893 4.230 . 0 0 "[ . 1 . 2 . 3 ]" 1
1305 2 5 LEU QD 2 8 ALA H . . 5.110 4.151 3.421 4.769 . 0 0 "[ . 1 . 2 . 3 ]" 1
1306 2 5 LEU QD 2 8 ALA MB . . 5.440 2.861 2.083 4.003 . 0 0 "[ . 1 . 2 . 3 ]" 1
1307 2 5 LEU QD 2 9 LEU H . . 5.440 3.906 3.089 5.440 . 0 0 "[ . 1 . 2 . 3 ]" 1
1308 2 5 LEU QD 2 9 LEU QD . . 4.070 2.652 1.938 4.086 0.016 20 0 "[ . 1 . 2 . 3 ]" 1
1309 2 5 LEU MD1 2 6 GLU H . . 5.500 4.308 2.936 5.100 . 0 0 "[ . 1 . 2 . 3 ]" 1
1310 2 5 LEU MD2 2 6 GLU H . . 5.500 4.237 3.035 4.915 . 0 0 "[ . 1 . 2 . 3 ]" 1
1311 2 5 LEU HG 2 6 GLU H . . 5.500 4.754 3.371 5.451 . 0 0 "[ . 1 . 2 . 3 ]" 1
1312 2 6 GLU H 2 6 GLU QG . . 4.290 3.063 1.955 4.047 . 0 0 "[ . 1 . 2 . 3 ]" 1
1313 2 6 GLU H 2 7 LYS H . . 4.480 2.805 2.633 3.044 . 0 0 "[ . 1 . 2 . 3 ]" 1
1314 2 6 GLU H 2 8 ALA H . . 5.080 4.134 3.897 4.334 . 0 0 "[ . 1 . 2 . 3 ]" 1
1315 2 6 GLU H 2 8 ALA MB . . 5.500 4.833 4.618 5.042 . 0 0 "[ . 1 . 2 . 3 ]" 1
1316 2 6 GLU HA 2 8 ALA H . . 5.160 4.207 3.717 4.561 . 0 0 "[ . 1 . 2 . 3 ]" 1
1317 2 6 GLU HA 2 9 LEU H . . 4.840 3.423 2.983 3.911 . 0 0 "[ . 1 . 2 . 3 ]" 1
1318 2 6 GLU HA 2 9 LEU QB . . 3.950 2.828 2.144 3.687 . 0 0 "[ . 1 . 2 . 3 ]" 1
1319 2 6 GLU HA 2 9 LEU QD . . 5.020 2.618 2.165 3.752 . 0 0 "[ . 1 . 2 . 3 ]" 1
1320 2 6 GLU HB2 2 7 LYS H . . 4.840 3.186 2.408 4.117 . 0 0 "[ . 1 . 2 . 3 ]" 1
1321 2 6 GLU HB3 2 7 LYS H . . 4.840 3.222 2.264 3.911 . 0 0 "[ . 1 . 2 . 3 ]" 1
1322 2 6 GLU QG 2 7 LYS H . . 5.340 4.219 3.873 4.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
1323 2 7 LYS H 2 7 LYS QB . . 3.530 2.343 2.029 2.705 . 0 0 "[ . 1 . 2 . 3 ]" 1
1324 2 7 LYS H 2 7 LYS QD . . 5.500 3.917 2.458 4.714 . 0 0 "[ . 1 . 2 . 3 ]" 1
1325 2 7 LYS H 2 7 LYS QE . . 5.500 4.265 2.910 5.622 0.122 30 0 "[ . 1 . 2 . 3 ]" 1
1326 2 7 LYS H 2 8 ALA H . . 4.170 2.730 2.447 2.943 . 0 0 "[ . 1 . 2 . 3 ]" 1
1327 2 7 LYS HA 2 7 LYS QD . . 4.780 3.420 2.051 4.106 . 0 0 "[ . 1 . 2 . 3 ]" 1
1328 2 7 LYS HA 2 7 LYS QE . . 5.500 3.658 1.786 4.984 . 0 0 "[ . 1 . 2 . 3 ]" 1
1329 2 7 LYS HA 2 10 THR H . . 3.530 3.337 2.973 3.568 0.038 14 0 "[ . 1 . 2 . 3 ]" 1
1330 2 7 LYS HA 2 10 THR HB . . 5.500 2.926 2.083 4.440 . 0 0 "[ . 1 . 2 . 3 ]" 1
1331 2 7 LYS QB 2 7 LYS QD . . 3.330 2.369 2.160 3.111 . 0 0 "[ . 1 . 2 . 3 ]" 1
1332 2 7 LYS QB 2 7 LYS QE . . 4.380 3.258 1.949 3.858 . 0 0 "[ . 1 . 2 . 3 ]" 1
1333 2 7 LYS QB 2 8 ALA H . . 3.690 2.886 2.503 3.139 . 0 0 "[ . 1 . 2 . 3 ]" 1
1334 2 7 LYS QB 2 8 ALA HA . . 4.250 4.208 3.973 4.279 0.029 17 0 "[ . 1 . 2 . 3 ]" 1
1335 2 7 LYS QB 2 8 ALA MB . . 4.070 4.028 3.752 4.120 0.050 27 0 "[ . 1 . 2 . 3 ]" 1
1336 2 7 LYS QG 2 8 ALA H . . 4.280 4.229 3.684 4.358 0.078 3 0 "[ . 1 . 2 . 3 ]" 1
1337 2 8 ALA H 2 8 ALA MB . . 3.560 2.246 2.152 2.338 . 0 0 "[ . 1 . 2 . 3 ]" 1
1338 2 8 ALA H 2 9 LEU H . . 3.970 2.691 2.481 2.889 . 0 0 "[ . 1 . 2 . 3 ]" 1
1339 2 8 ALA HA 2 11 THR H . . 4.460 3.325 2.778 3.501 . 0 0 "[ . 1 . 2 . 3 ]" 1
1340 2 8 ALA HA 2 11 THR HB . . 3.830 2.748 2.239 3.853 0.023 25 0 "[ . 1 . 2 . 3 ]" 1
1341 2 8 ALA HA 2 11 THR MG . . 5.500 3.678 2.069 4.385 . 0 0 "[ . 1 . 2 . 3 ]" 1
1342 2 8 ALA MB 2 9 LEU H . . 4.350 2.579 2.376 2.912 . 0 0 "[ . 1 . 2 . 3 ]" 1
1343 2 8 ALA MB 2 9 LEU MD1 . . 5.500 4.325 2.475 5.523 0.023 13 0 "[ . 1 . 2 . 3 ]" 1
1344 2 8 ALA MB 2 9 LEU MD2 . . 5.500 3.991 2.366 5.190 . 0 0 "[ . 1 . 2 . 3 ]" 1
1345 2 8 ALA MB 2 10 THR H . . 5.080 4.642 4.463 4.995 . 0 0 "[ . 1 . 2 . 3 ]" 1
1346 2 8 ALA MB 2 11 THR H . . 4.610 4.574 4.144 4.649 0.039 22 0 "[ . 1 . 2 . 3 ]" 1
1347 2 9 LEU H 2 9 LEU QB . . 3.280 2.374 1.966 2.609 . 0 0 "[ . 1 . 2 . 3 ]" 1
1348 2 9 LEU H 2 9 LEU MD1 . . 4.850 3.356 1.973 4.056 . 0 0 "[ . 1 . 2 . 3 ]" 1
1349 2 9 LEU H 2 9 LEU MD2 . . 4.850 3.410 1.948 4.049 . 0 0 "[ . 1 . 2 . 3 ]" 1
1350 2 9 LEU H 2 9 LEU HG . . 3.650 2.624 2.060 3.719 0.069 12 0 "[ . 1 . 2 . 3 ]" 1
1351 2 9 LEU HA 2 9 LEU QD . . 3.940 2.293 1.952 3.262 . 0 0 "[ . 1 . 2 . 3 ]" 1
1352 2 9 LEU HA 2 9 LEU HG . . 4.200 3.063 2.279 3.908 . 0 0 "[ . 1 . 2 . 3 ]" 1
1353 2 9 LEU QB 2 9 LEU MD1 . . 2.400 2.148 2.063 2.374 . 0 0 "[ . 1 . 2 . 3 ]" 1
1354 2 9 LEU QB 2 9 LEU MD2 . . 2.400 2.292 2.060 2.430 0.030 12 0 "[ . 1 . 2 . 3 ]" 1
1355 2 9 LEU QB 2 10 THR H . . 4.010 2.596 2.270 3.765 . 0 0 "[ . 1 . 2 . 3 ]" 1
1356 2 9 LEU QD 2 12 MET H . . 5.340 4.848 4.341 5.348 0.008 3 0 "[ . 1 . 2 . 3 ]" 1
1357 2 9 LEU MD1 2 10 THR H . . 5.500 4.404 3.001 4.805 . 0 0 "[ . 1 . 2 . 3 ]" 1
1358 2 9 LEU MD2 2 10 THR H . . 5.500 4.703 3.936 4.926 . 0 0 "[ . 1 . 2 . 3 ]" 1
1359 2 10 THR H 2 10 THR HB . . 4.050 2.911 2.511 3.679 . 0 0 "[ . 1 . 2 . 3 ]" 1
1360 2 10 THR H 2 10 THR MG . . 4.620 3.538 2.391 3.851 . 0 0 "[ . 1 . 2 . 3 ]" 1
1361 2 10 THR H 2 11 THR H . . 4.410 2.889 2.718 3.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
1362 2 10 THR H 2 13 VAL QG . . 4.980 4.572 3.960 4.994 0.014 19 0 "[ . 1 . 2 . 3 ]" 1
1363 2 10 THR HA 2 13 VAL H . . 5.220 3.550 3.209 3.890 . 0 0 "[ . 1 . 2 . 3 ]" 1
1364 2 10 THR HB 2 11 THR H . . 3.780 2.759 2.296 3.783 0.003 12 0 "[ . 1 . 2 . 3 ]" 1
1365 2 10 THR MG 2 11 THR H . . 4.830 3.711 3.319 4.269 . 0 0 "[ . 1 . 2 . 3 ]" 1
1366 2 10 THR MG 2 12 MET H . . 5.470 5.312 5.030 5.500 0.030 5 0 "[ . 1 . 2 . 3 ]" 1
1367 2 11 THR H 2 11 THR HB . . 3.900 2.545 2.339 2.789 . 0 0 "[ . 1 . 2 . 3 ]" 1
1368 2 11 THR H 2 11 THR MG . . 4.700 3.626 2.647 3.840 . 0 0 "[ . 1 . 2 . 3 ]" 1
1369 2 11 THR HA 2 14 THR H . . 5.150 3.360 2.729 3.707 . 0 0 "[ . 1 . 2 . 3 ]" 1
1370 2 11 THR HA 2 14 THR HB . . 4.120 2.571 2.194 3.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
1371 2 11 THR HA 2 14 THR MG . . 5.500 3.675 3.320 4.221 . 0 0 "[ . 1 . 2 . 3 ]" 1
1372 2 11 THR HB 2 12 MET H . . 4.190 2.880 2.340 4.135 . 0 0 "[ . 1 . 2 . 3 ]" 1
1373 2 11 THR MG 2 12 MET H . . 5.420 3.378 2.532 3.910 . 0 0 "[ . 1 . 2 . 3 ]" 1
1374 2 11 THR MG 2 14 THR H . . 5.500 4.712 4.252 5.119 . 0 0 "[ . 1 . 2 . 3 ]" 1
1375 2 11 THR MG 2 14 THR HB . . 5.500 3.685 3.084 4.586 . 0 0 "[ . 1 . 2 . 3 ]" 1
1376 2 11 THR MG 2 15 THR H . . 5.500 4.091 3.550 4.801 . 0 0 "[ . 1 . 2 . 3 ]" 1
1377 2 11 THR MG 2 15 THR HG1 . . 5.500 4.584 3.231 5.529 0.029 29 0 "[ . 1 . 2 . 3 ]" 1
1378 2 12 MET H 2 12 MET ME . . 5.500 4.643 3.838 5.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
1379 2 12 MET H 2 12 MET HG2 . . 5.060 3.900 2.224 4.590 . 0 0 "[ . 1 . 2 . 3 ]" 1
1380 2 12 MET H 2 12 MET QG . . 4.350 3.177 2.013 3.973 . 0 0 "[ . 1 . 2 . 3 ]" 1
1381 2 12 MET H 2 12 MET HG3 . . 5.060 3.576 2.038 4.616 . 0 0 "[ . 1 . 2 . 3 ]" 1
1382 2 12 MET H 2 13 VAL H . . 4.550 2.945 2.627 3.128 . 0 0 "[ . 1 . 2 . 3 ]" 1
1383 2 12 MET HA 2 12 MET ME . . 4.010 3.864 2.490 4.070 0.060 21 0 "[ . 1 . 2 . 3 ]" 1
1384 2 12 MET HA 2 15 THR H . . 4.060 3.708 3.358 4.083 0.023 3 0 "[ . 1 . 2 . 3 ]" 1
1385 2 12 MET HA 2 76 LEU QD . . 5.440 4.390 3.652 5.248 . 0 0 "[ . 1 . 2 . 3 ]" 1
1386 2 12 MET QB 2 13 VAL H . . 5.500 2.511 2.332 2.822 . 0 0 "[ . 1 . 2 . 3 ]" 1
1387 2 12 MET ME 2 73 SER HA . . 5.500 5.118 3.733 5.539 0.039 16 0 "[ . 1 . 2 . 3 ]" 1
1388 2 12 MET ME 2 76 LEU QD . . 5.440 2.062 1.800 2.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
1389 2 12 MET QG 2 13 VAL H . . 5.170 4.206 3.534 4.647 . 0 0 "[ . 1 . 2 . 3 ]" 1
1390 2 12 MET QG 2 15 THR MG . . 5.340 5.002 3.768 5.374 0.034 31 0 "[ . 1 . 2 . 3 ]" 1
1391 2 13 VAL H 2 13 VAL HB . . 4.090 2.837 2.268 3.769 . 0 0 "[ . 1 . 2 . 3 ]" 1
1392 2 13 VAL H 2 13 VAL QG . . 4.050 2.217 1.952 2.811 . 0 0 "[ . 1 . 2 . 3 ]" 1
1393 2 13 VAL H 2 14 THR H . . 4.610 2.721 2.461 2.885 . 0 0 "[ . 1 . 2 . 3 ]" 1
1394 2 13 VAL HA 2 16 PHE H . . 4.030 3.342 2.866 3.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
1395 2 13 VAL HA 2 16 PHE QB . . 4.980 2.258 2.057 2.672 . 0 0 "[ . 1 . 2 . 3 ]" 1
1396 2 13 VAL HB 2 14 THR H . . 4.390 3.521 2.593 4.303 . 0 0 "[ . 1 . 2 . 3 ]" 1
1397 2 13 VAL QG 2 14 THR H . . 4.990 2.982 2.372 3.460 . 0 0 "[ . 1 . 2 . 3 ]" 1
1398 2 13 VAL QG 2 14 THR HA . . 5.040 3.476 3.032 3.906 . 0 0 "[ . 1 . 2 . 3 ]" 1
1399 2 13 VAL QG 2 16 PHE H . . 4.570 4.394 4.046 4.610 0.040 13 0 "[ . 1 . 2 . 3 ]" 1
1400 2 13 VAL MG1 2 16 PHE H . . 5.330 4.911 4.388 5.305 . 0 0 "[ . 1 . 2 . 3 ]" 1
1401 2 13 VAL MG2 2 16 PHE H . . 5.330 4.995 4.490 5.297 . 0 0 "[ . 1 . 2 . 3 ]" 1
1402 2 14 THR H 2 14 THR HB . . 3.900 2.536 2.342 2.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
1403 2 14 THR H 2 14 THR MG . . 4.300 3.773 3.725 3.815 . 0 0 "[ . 1 . 2 . 3 ]" 1
1404 2 14 THR H 2 15 THR H . . 4.610 2.764 2.471 2.927 . 0 0 "[ . 1 . 2 . 3 ]" 1
1405 2 14 THR HA 2 17 HIS H . . 3.950 3.843 3.094 3.994 0.044 25 0 "[ . 1 . 2 . 3 ]" 1
1406 2 14 THR HA 2 17 HIS QB . . 4.790 3.544 2.390 4.086 . 0 0 "[ . 1 . 2 . 3 ]" 1
1407 2 14 THR HB 2 15 THR H . . 4.090 2.324 2.036 2.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
1408 2 14 THR HB 2 15 THR HG1 . . 5.500 5.031 3.848 5.580 0.080 29 0 "[ . 1 . 2 . 3 ]" 1
1409 2 14 THR HB 2 15 THR MG . . 4.180 3.849 3.169 4.221 0.041 29 0 "[ . 1 . 2 . 3 ]" 1
1410 2 14 THR HB 2 16 PHE H . . 4.490 4.584 4.520 4.630 0.140 24 0 "[ . 1 . 2 . 3 ]" 1
1411 2 14 THR MG 2 15 THR H . . 5.150 3.432 3.256 3.781 . 0 0 "[ . 1 . 2 . 3 ]" 1
1412 2 15 THR H 2 15 THR HG1 . . 5.140 3.069 1.945 4.452 . 0 0 "[ . 1 . 2 . 3 ]" 1
1413 2 15 THR H 2 16 PHE H . . 4.540 2.517 2.256 2.668 . 0 0 "[ . 1 . 2 . 3 ]" 1
1414 2 15 THR HA 2 18 LYS H . . 3.780 3.562 3.042 3.825 0.045 13 0 "[ . 1 . 2 . 3 ]" 1
1415 2 15 THR HA 2 18 LYS QB . . 3.380 2.573 2.138 3.382 0.002 26 0 "[ . 1 . 2 . 3 ]" 1
1416 2 15 THR HA 2 19 TYR QD . . 5.500 3.433 2.336 4.716 . 0 0 "[ . 1 . 2 . 3 ]" 1
1417 2 15 THR HA 2 19 TYR QE . . 4.000 3.759 3.205 4.104 0.104 3 0 "[ . 1 . 2 . 3 ]" 1
1418 2 15 THR HG1 2 16 PHE H . . 5.500 3.262 2.088 5.110 . 0 0 "[ . 1 . 2 . 3 ]" 1
1419 2 15 THR MG 2 16 PHE H . . 5.290 3.740 2.284 4.330 . 0 0 "[ . 1 . 2 . 3 ]" 1
1420 2 15 THR MG 2 18 LYS QB . . 4.530 4.156 3.435 4.567 0.037 3 0 "[ . 1 . 2 . 3 ]" 1
1421 2 15 THR MG 2 19 TYR QD . . 5.500 3.391 2.413 4.105 . 0 0 "[ . 1 . 2 . 3 ]" 1
1422 2 15 THR MG 2 19 TYR QE . . 5.500 2.647 2.047 4.358 . 0 0 "[ . 1 . 2 . 3 ]" 1
1423 2 15 THR MG 2 37 LEU HA . . 5.500 5.437 4.935 5.557 0.057 31 0 "[ . 1 . 2 . 3 ]" 1
1424 2 15 THR MG 2 37 LEU MD1 . . 5.500 3.801 2.834 5.187 . 0 0 "[ . 1 . 2 . 3 ]" 1
1425 2 15 THR MG 2 37 LEU QD . . 4.610 3.419 2.127 4.483 . 0 0 "[ . 1 . 2 . 3 ]" 1
1426 2 15 THR MG 2 37 LEU MD2 . . 5.500 4.485 2.134 5.510 0.010 28 0 "[ . 1 . 2 . 3 ]" 1
1427 2 15 THR MG 2 72 TYR HH . . 5.500 4.976 2.753 5.558 0.058 25 0 "[ . 1 . 2 . 3 ]" 1
1428 2 16 PHE H 2 16 PHE QB . . 3.680 2.297 2.188 2.375 . 0 0 "[ . 1 . 2 . 3 ]" 1
1429 2 16 PHE H 2 16 PHE QD . . 4.890 4.187 3.968 4.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
1430 2 16 PHE HA 2 37 LEU QD . . 4.950 3.304 2.319 4.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
1431 2 16 PHE HA 2 72 TYR QE . . 5.340 4.560 3.691 5.355 0.015 4 0 "[ . 1 . 2 . 3 ]" 1
1432 2 16 PHE QB 2 17 HIS H . . 4.370 2.499 2.195 2.832 . 0 0 "[ . 1 . 2 . 3 ]" 1
1433 2 16 PHE HB2 2 17 HIS H . . 4.990 3.824 3.274 4.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
1434 2 16 PHE HB3 2 17 HIS H . . 4.990 2.534 2.215 2.892 . 0 0 "[ . 1 . 2 . 3 ]" 1
1435 2 16 PHE QD 2 17 HIS H . . 5.500 3.626 3.142 4.064 . 0 0 "[ . 1 . 2 . 3 ]" 1
1436 2 16 PHE QE 2 27 LEU HA . . 5.500 3.796 2.205 5.363 . 0 0 "[ . 1 . 2 . 3 ]" 1
1437 2 16 PHE QE 2 28 THR HA . . 5.040 4.038 2.113 4.725 . 0 0 "[ . 1 . 2 . 3 ]" 1
1438 2 16 PHE QE 2 29 LEU H . . 5.500 4.379 2.961 5.144 . 0 0 "[ . 1 . 2 . 3 ]" 1
1439 2 16 PHE QE 2 29 LEU MD1 . . 5.500 3.080 2.033 4.692 . 0 0 "[ . 1 . 2 . 3 ]" 1
1440 2 16 PHE QE 2 29 LEU MD2 . . 5.500 3.200 2.071 4.376 . 0 0 "[ . 1 . 2 . 3 ]" 1
1441 2 16 PHE QE 2 68 ASP HA . . 5.500 4.620 3.057 5.336 . 0 0 "[ . 1 . 2 . 3 ]" 1
1442 2 16 PHE HZ 2 28 THR HA . . 5.500 3.571 2.701 4.496 . 0 0 "[ . 1 . 2 . 3 ]" 1
1443 2 16 PHE HZ 2 29 LEU H . . 5.500 4.058 3.492 4.873 . 0 0 "[ . 1 . 2 . 3 ]" 1
1444 2 16 PHE HZ 2 29 LEU MD1 . . 5.500 4.372 2.935 5.514 0.014 14 0 "[ . 1 . 2 . 3 ]" 1
1445 2 16 PHE HZ 2 29 LEU QD . . 4.090 3.379 2.434 4.109 0.019 20 0 "[ . 1 . 2 . 3 ]" 1
1446 2 16 PHE HZ 2 29 LEU MD2 . . 5.500 4.045 2.446 5.196 . 0 0 "[ . 1 . 2 . 3 ]" 1
1447 2 16 PHE HZ 2 29 LEU HG . . 5.500 4.051 3.048 5.505 0.005 23 0 "[ . 1 . 2 . 3 ]" 1
1448 2 16 PHE HZ 2 67 ILE HB . . 5.500 5.174 3.953 5.532 0.032 9 0 "[ . 1 . 2 . 3 ]" 1
1449 2 16 PHE HZ 2 68 ASP HA . . 5.500 3.707 2.511 4.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
1450 2 16 PHE HZ 2 69 PHE H . . 5.500 3.485 2.925 4.638 . 0 0 "[ . 1 . 2 . 3 ]" 1
1451 2 16 PHE HZ 2 69 PHE QD . . 5.500 3.972 3.279 4.842 . 0 0 "[ . 1 . 2 . 3 ]" 1
1452 2 16 PHE HZ 2 72 TYR QE . . 5.500 5.492 4.982 5.558 0.058 3 0 "[ . 1 . 2 . 3 ]" 1
1453 2 17 HIS H 2 18 LYS H . . 4.280 2.772 2.647 2.959 . 0 0 "[ . 1 . 2 . 3 ]" 1
1454 2 17 HIS HA 2 20 SER H . . 3.820 3.443 2.892 3.879 0.059 6 0 "[ . 1 . 2 . 3 ]" 1
1455 2 17 HIS QB 2 18 LYS H . . 4.390 2.924 2.414 3.518 . 0 0 "[ . 1 . 2 . 3 ]" 1
1456 2 17 HIS HB2 2 18 LYS H . . 5.090 3.367 2.458 4.106 . 0 0 "[ . 1 . 2 . 3 ]" 1
1457 2 17 HIS HB3 2 18 LYS H . . 5.090 3.433 2.709 4.116 . 0 0 "[ . 1 . 2 . 3 ]" 1
1458 2 17 HIS HE1 2 69 PHE QE . . 5.500 5.234 3.315 5.556 0.056 31 0 "[ . 1 . 2 . 3 ]" 1
1459 2 18 LYS H 2 18 LYS QB . . 3.480 2.226 1.960 2.386 . 0 0 "[ . 1 . 2 . 3 ]" 1
1460 2 18 LYS H 2 18 LYS QD . . 5.500 4.233 2.681 4.995 . 0 0 "[ . 1 . 2 . 3 ]" 1
1461 2 18 LYS H 2 18 LYS HG2 . . 5.370 4.080 2.424 4.552 . 0 0 "[ . 1 . 2 . 3 ]" 1
1462 2 18 LYS H 2 18 LYS QG . . 4.690 3.433 2.273 4.019 . 0 0 "[ . 1 . 2 . 3 ]" 1
1463 2 18 LYS H 2 18 LYS HG3 . . 5.370 3.870 2.300 4.577 . 0 0 "[ . 1 . 2 . 3 ]" 1
1464 2 18 LYS H 2 19 TYR H . . 4.090 2.768 2.405 2.999 . 0 0 "[ . 1 . 2 . 3 ]" 1
1465 2 18 LYS HA 2 18 LYS QE . . 5.010 4.425 3.104 5.044 0.034 20 0 "[ . 1 . 2 . 3 ]" 1
1466 2 18 LYS QB 2 18 LYS QE . . 4.400 3.135 1.928 3.915 . 0 0 "[ . 1 . 2 . 3 ]" 1
1467 2 18 LYS QB 2 19 TYR H . . 4.310 2.685 2.243 3.217 . 0 0 "[ . 1 . 2 . 3 ]" 1
1468 2 18 LYS QB 2 19 TYR QD . . 5.500 3.552 2.364 4.503 . 0 0 "[ . 1 . 2 . 3 ]" 1
1469 2 18 LYS QG 2 19 TYR H . . 5.340 3.992 3.107 4.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
1470 2 19 TYR H 2 19 TYR QD . . 4.430 2.882 2.321 3.406 . 0 0 "[ . 1 . 2 . 3 ]" 1
1471 2 19 TYR H 2 20 SER H . . 4.040 2.530 2.245 2.882 . 0 0 "[ . 1 . 2 . 3 ]" 1
1472 2 19 TYR H 2 21 GLY H . . 4.970 4.104 3.604 4.676 . 0 0 "[ . 1 . 2 . 3 ]" 1
1473 2 19 TYR HA 2 19 TYR QE . . 5.500 4.540 4.308 4.833 . 0 0 "[ . 1 . 2 . 3 ]" 1
1474 2 19 TYR HA 2 22 ARG QD . . 4.840 3.888 2.142 4.875 0.035 4 0 "[ . 1 . 2 . 3 ]" 1
1475 2 19 TYR HA 2 29 LEU QD . . 5.440 4.127 3.547 5.468 0.028 29 0 "[ . 1 . 2 . 3 ]" 1
1476 2 19 TYR QB 2 29 LEU QD . . 4.850 2.350 1.932 3.562 . 0 0 "[ . 1 . 2 . 3 ]" 1
1477 2 19 TYR QD 2 20 SER H . . 5.500 4.542 4.121 4.893 . 0 0 "[ . 1 . 2 . 3 ]" 1
1478 2 19 TYR QD 2 29 LEU QD . . 5.500 3.816 3.287 4.889 . 0 0 "[ . 1 . 2 . 3 ]" 1
1479 2 19 TYR QD 2 36 GLU QB . . 5.340 3.411 2.768 4.161 . 0 0 "[ . 1 . 2 . 3 ]" 1
1480 2 19 TYR QD 2 36 GLU HG2 . . 5.500 3.840 2.366 5.445 . 0 0 "[ . 1 . 2 . 3 ]" 1
1481 2 19 TYR QD 2 36 GLU HG3 . . 5.500 4.364 2.390 5.524 0.024 27 0 "[ . 1 . 2 . 3 ]" 1
1482 2 19 TYR QD 2 37 LEU MD1 . . 5.500 2.807 2.021 4.647 . 0 0 "[ . 1 . 2 . 3 ]" 1
1483 2 19 TYR QD 2 37 LEU MD2 . . 5.500 3.845 2.123 4.641 . 0 0 "[ . 1 . 2 . 3 ]" 1
1484 2 19 TYR QE 2 36 GLU HG2 . . 5.500 3.337 2.342 4.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
1485 2 19 TYR QE 2 36 GLU HG3 . . 5.500 3.543 2.216 4.974 . 0 0 "[ . 1 . 2 . 3 ]" 1
1486 2 19 TYR QE 2 37 LEU HA . . 5.500 3.106 2.389 3.887 . 0 0 "[ . 1 . 2 . 3 ]" 1
1487 2 19 TYR QE 2 37 LEU MD1 . . 5.500 3.676 2.487 5.516 0.016 13 0 "[ . 1 . 2 . 3 ]" 1
1488 2 19 TYR QE 2 37 LEU MD2 . . 5.500 4.529 2.264 5.275 . 0 0 "[ . 1 . 2 . 3 ]" 1
1489 2 19 TYR QE 2 37 LEU HG . . 5.500 4.407 2.567 5.522 0.022 16 0 "[ . 1 . 2 . 3 ]" 1
1490 2 19 TYR QE 2 40 LYS QD . . 5.500 3.849 2.108 5.027 . 0 0 "[ . 1 . 2 . 3 ]" 1
1491 2 19 TYR QE 2 40 LYS HG2 . . 5.500 4.246 2.482 5.520 0.020 6 0 "[ . 1 . 2 . 3 ]" 1
1492 2 19 TYR QE 2 40 LYS HG3 . . 5.500 3.423 2.193 4.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
1493 2 20 SER H 2 21 GLY H . . 3.880 2.709 2.422 3.032 . 0 0 "[ . 1 . 2 . 3 ]" 1
1494 2 20 SER H 2 29 LEU QD . . 4.830 3.005 2.626 4.119 . 0 0 "[ . 1 . 2 . 3 ]" 1
1495 2 20 SER HA 2 28 THR H . . 5.310 4.747 3.762 5.317 0.007 20 0 "[ . 1 . 2 . 3 ]" 1
1496 2 20 SER HA 2 29 LEU QD . . 4.330 2.362 1.978 3.717 . 0 0 "[ . 1 . 2 . 3 ]" 1
1497 2 20 SER QB 2 28 THR H . . 4.540 3.573 2.546 4.601 0.061 28 0 "[ . 1 . 2 . 3 ]" 1
1498 2 20 SER QB 2 29 LEU QD . . 4.050 2.772 1.912 4.062 0.012 3 0 "[ . 1 . 2 . 3 ]" 1
1499 2 20 SER HB2 2 28 THR H . . 5.150 4.328 2.565 5.207 0.057 28 0 "[ . 1 . 2 . 3 ]" 1
1500 2 20 SER HB3 2 28 THR H . . 5.150 4.313 2.655 5.212 0.062 19 0 "[ . 1 . 2 . 3 ]" 1
1501 2 21 GLY H 2 22 ARG H . . 4.360 2.708 2.370 3.044 . 0 0 "[ . 1 . 2 . 3 ]" 1
1502 2 22 ARG H 2 22 ARG HB2 . . 3.890 2.406 2.051 3.607 . 0 0 "[ . 1 . 2 . 3 ]" 1
1503 2 22 ARG H 2 22 ARG QB . . 3.540 2.238 2.010 2.540 . 0 0 "[ . 1 . 2 . 3 ]" 1
1504 2 22 ARG H 2 22 ARG HB3 . . 3.890 3.044 2.072 3.724 . 0 0 "[ . 1 . 2 . 3 ]" 1
1505 2 22 ARG H 2 22 ARG QD . . 4.670 4.178 2.441 4.690 0.020 28 0 "[ . 1 . 2 . 3 ]" 1
1506 2 22 ARG H 2 22 ARG HG2 . . 4.560 3.826 2.569 4.571 0.011 6 0 "[ . 1 . 2 . 3 ]" 1
1507 2 22 ARG H 2 22 ARG HG3 . . 4.560 3.918 2.453 4.563 0.003 1 0 "[ . 1 . 2 . 3 ]" 1
1508 2 22 ARG H 2 23 GLU H . . 3.980 2.833 2.373 4.041 0.061 15 0 "[ . 1 . 2 . 3 ]" 1
1509 2 22 ARG H 2 33 GLU QB . . 4.680 4.273 3.127 4.713 0.033 2 0 "[ . 1 . 2 . 3 ]" 1
1510 2 22 ARG HA 2 22 ARG HD2 . . 5.500 3.835 2.099 4.865 . 0 0 "[ . 1 . 2 . 3 ]" 1
1511 2 22 ARG HA 2 22 ARG QD . . 4.390 3.236 2.062 4.366 . 0 0 "[ . 1 . 2 . 3 ]" 1
1512 2 22 ARG HA 2 22 ARG HD3 . . 5.500 3.681 2.442 5.203 . 0 0 "[ . 1 . 2 . 3 ]" 1
1513 2 22 ARG HA 2 22 ARG QG . . 3.620 2.609 2.246 3.497 . 0 0 "[ . 1 . 2 . 3 ]" 1
1514 2 22 ARG QB 2 23 GLU H . . 3.880 2.815 1.843 3.894 0.014 16 0 "[ . 1 . 2 . 3 ]" 1
1515 2 22 ARG HB2 2 23 GLU H . . 4.750 3.529 1.992 4.538 . 0 0 "[ . 1 . 2 . 3 ]" 1
1516 2 22 ARG HB3 2 23 GLU H . . 4.750 3.162 1.988 4.295 . 0 0 "[ . 1 . 2 . 3 ]" 1
1517 2 23 GLU H 2 23 GLU HB2 . . 4.200 3.181 2.580 4.165 . 0 0 "[ . 1 . 2 . 3 ]" 1
1518 2 23 GLU H 2 23 GLU QB . . 3.650 2.889 2.389 3.581 . 0 0 "[ . 1 . 2 . 3 ]" 1
1519 2 23 GLU H 2 23 GLU HB3 . . 4.200 3.498 2.652 4.177 . 0 0 "[ . 1 . 2 . 3 ]" 1
1520 2 23 GLU H 2 23 GLU QG . . 4.540 3.673 2.550 4.564 0.024 8 0 "[ . 1 . 2 . 3 ]" 1
1521 2 26 LYS HA 2 28 THR H . . 5.240 3.864 2.500 4.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
1522 2 26 LYS QB 2 27 LEU H . . 4.500 3.173 1.882 4.019 . 0 0 "[ . 1 . 2 . 3 ]" 1
1523 2 27 LEU H 2 27 LEU MD1 . . 5.010 3.992 1.940 4.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
1524 2 27 LEU H 2 27 LEU MD2 . . 5.010 3.802 1.771 5.047 0.037 6 0 "[ . 1 . 2 . 3 ]" 1
1525 2 27 LEU H 2 27 LEU HG . . 4.560 3.968 2.568 4.639 0.079 11 0 "[ . 1 . 2 . 3 ]" 1
1526 2 27 LEU H 2 28 THR H . . 4.240 2.502 1.795 3.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
1527 2 27 LEU HA 2 27 LEU MD1 . . 4.440 3.124 2.117 4.122 . 0 0 "[ . 1 . 2 . 3 ]" 1
1528 2 27 LEU HA 2 27 LEU QD . . 3.670 2.633 2.106 3.435 . 0 0 "[ . 1 . 2 . 3 ]" 1
1529 2 27 LEU HA 2 27 LEU MD2 . . 4.440 3.488 2.135 3.933 . 0 0 "[ . 1 . 2 . 3 ]" 1
1530 2 27 LEU HA 2 27 LEU HG . . 4.150 3.124 2.271 3.797 . 0 0 "[ . 1 . 2 . 3 ]" 1
1531 2 27 LEU HA 2 28 THR MG . . 5.500 4.623 4.289 5.514 0.014 15 0 "[ . 1 . 2 . 3 ]" 1
1532 2 27 LEU QB 2 28 THR H . . 4.410 3.211 2.320 4.158 . 0 0 "[ . 1 . 2 . 3 ]" 1
1533 2 27 LEU HB2 2 28 THR H . . 5.100 3.963 2.426 4.647 . 0 0 "[ . 1 . 2 . 3 ]" 1
1534 2 27 LEU HB3 2 28 THR H . . 5.100 3.597 2.342 4.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
1535 2 27 LEU QD 2 28 THR H . . 4.460 3.743 2.085 4.464 0.004 25 0 "[ . 1 . 2 . 3 ]" 1
1536 2 27 LEU MD1 2 28 THR H . . 5.500 4.686 4.132 5.476 . 0 0 "[ . 1 . 2 . 3 ]" 1
1537 2 27 LEU MD2 2 28 THR H . . 5.500 4.223 2.089 5.550 0.050 13 0 "[ . 1 . 2 . 3 ]" 1
1538 2 27 LEU HG 2 28 THR H . . 4.920 4.218 3.062 4.997 0.077 16 0 "[ . 1 . 2 . 3 ]" 1
1539 2 28 THR H 2 28 THR MG . . 4.720 2.879 2.328 3.687 . 0 0 "[ . 1 . 2 . 3 ]" 1
1540 2 28 THR HB 2 29 LEU H . . 5.500 2.731 2.341 3.471 . 0 0 "[ . 1 . 2 . 3 ]" 1
1541 2 28 THR HB 2 66 GLU QB . . 4.170 2.547 1.957 4.240 0.070 19 0 "[ . 1 . 2 . 3 ]" 1
1542 2 28 THR HB 2 66 GLU QG . . 4.960 3.801 2.073 4.681 . 0 0 "[ . 1 . 2 . 3 ]" 1
1543 2 28 THR HB 2 67 ILE H . . 5.500 3.421 2.344 4.601 . 0 0 "[ . 1 . 2 . 3 ]" 1
1544 2 28 THR MG 2 29 LEU H . . 5.210 3.573 2.840 4.024 . 0 0 "[ . 1 . 2 . 3 ]" 1
1545 2 28 THR MG 2 66 GLU HA . . 5.500 4.718 3.727 5.526 0.026 26 0 "[ . 1 . 2 . 3 ]" 1
1546 2 28 THR MG 2 66 GLU QB . . 4.300 2.803 2.088 4.308 0.008 18 0 "[ . 1 . 2 . 3 ]" 1
1547 2 28 THR MG 2 66 GLU QG . . 5.340 3.992 2.533 4.923 . 0 0 "[ . 1 . 2 . 3 ]" 1
1548 2 28 THR MG 2 67 ILE H . . 5.500 4.247 3.175 5.353 . 0 0 "[ . 1 . 2 . 3 ]" 1
1549 2 28 THR MG 2 68 ASP H . . 5.500 3.826 2.970 4.862 . 0 0 "[ . 1 . 2 . 3 ]" 1
1550 2 28 THR MG 2 68 ASP HA . . 4.670 2.523 2.013 3.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
1551 2 28 THR MG 2 68 ASP HB2 . . 4.950 3.413 2.289 4.968 0.018 2 0 "[ . 1 . 2 . 3 ]" 1
1552 2 28 THR MG 2 68 ASP QB . . 4.330 3.124 2.264 4.101 . 0 0 "[ . 1 . 2 . 3 ]" 1
1553 2 28 THR MG 2 68 ASP HB3 . . 4.950 3.968 2.870 4.957 0.007 27 0 "[ . 1 . 2 . 3 ]" 1
1554 2 28 THR MG 2 69 PHE H . . 5.500 4.252 3.371 5.318 . 0 0 "[ . 1 . 2 . 3 ]" 1
1555 2 29 LEU H 2 29 LEU MD1 . . 5.500 3.797 2.059 4.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
1556 2 29 LEU H 2 29 LEU MD2 . . 5.500 3.487 1.932 4.237 . 0 0 "[ . 1 . 2 . 3 ]" 1
1557 2 29 LEU H 2 29 LEU HG . . 5.500 3.215 2.194 4.576 . 0 0 "[ . 1 . 2 . 3 ]" 1
1558 2 29 LEU H 2 67 ILE H . . 5.500 3.027 2.540 3.741 . 0 0 "[ . 1 . 2 . 3 ]" 1
1559 2 29 LEU H 2 67 ILE HB . . 5.500 3.223 2.445 4.227 . 0 0 "[ . 1 . 2 . 3 ]" 1
1560 2 29 LEU QB 2 33 GLU QB . . 4.760 2.753 1.901 4.316 . 0 0 "[ . 1 . 2 . 3 ]" 1
1561 2 29 LEU QB 2 37 LEU QD . . 5.280 3.922 3.253 4.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
1562 2 29 LEU QB 2 67 ILE HB . . 4.590 2.586 2.015 4.606 0.016 22 0 "[ . 1 . 2 . 3 ]" 1
1563 2 29 LEU QD 2 30 SER H . . 5.440 3.906 2.974 4.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
1564 2 29 LEU QD 2 33 GLU H . . 5.440 4.721 3.713 5.482 0.042 22 0 "[ . 1 . 2 . 3 ]" 1
1565 2 29 LEU QD 2 33 GLU HA . . 5.440 4.181 3.684 5.076 . 0 0 "[ . 1 . 2 . 3 ]" 1
1566 2 29 LEU QD 2 33 GLU QG . . 5.280 3.959 3.045 4.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
1567 2 29 LEU QD 2 34 LEU H . . 5.440 3.449 2.431 4.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
1568 2 29 LEU QD 2 34 LEU HA . . 5.440 2.563 2.060 3.295 . 0 0 "[ . 1 . 2 . 3 ]" 1
1569 2 29 LEU QD 2 37 LEU QD . . 5.370 2.080 1.767 2.932 . 0 0 "[ . 1 . 2 . 3 ]" 1
1570 2 29 LEU QD 2 67 ILE HB . . 5.440 3.123 2.012 3.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
1571 2 29 LEU MD1 2 34 LEU HA . . 5.500 2.752 2.062 3.818 . 0 0 "[ . 1 . 2 . 3 ]" 1
1572 2 29 LEU MD1 2 72 TYR QE . . 5.500 3.518 2.386 5.344 . 0 0 "[ . 1 . 2 . 3 ]" 1
1573 2 29 LEU MD2 2 34 LEU HA . . 5.500 3.826 2.481 5.153 . 0 0 "[ . 1 . 2 . 3 ]" 1
1574 2 29 LEU MD2 2 72 TYR QE . . 5.500 4.362 2.850 5.192 . 0 0 "[ . 1 . 2 . 3 ]" 1
1575 2 29 LEU HG 2 30 SER H . . 5.500 5.338 4.828 5.618 0.118 14 0 "[ . 1 . 2 . 3 ]" 1
1576 2 29 LEU HG 2 67 ILE H . . 5.500 5.184 3.696 5.582 0.082 23 0 "[ . 1 . 2 . 3 ]" 1
1577 2 29 LEU HG 2 67 ILE HB . . 4.940 3.864 2.145 4.754 . 0 0 "[ . 1 . 2 . 3 ]" 1
1578 2 29 LEU HG 2 67 ILE MG . . 4.830 4.074 2.952 4.833 0.003 15 0 "[ . 1 . 2 . 3 ]" 1
1579 2 29 LEU HG 2 72 TYR QD . . 5.350 4.567 3.152 5.377 0.027 17 0 "[ . 1 . 2 . 3 ]" 1
1580 2 29 LEU HG 2 72 TYR QE . . 5.500 5.034 3.390 5.545 0.045 5 0 "[ . 1 . 2 . 3 ]" 1
1581 2 30 SER H 2 33 GLU HG2 . . 5.500 4.108 3.085 4.923 . 0 0 "[ . 1 . 2 . 3 ]" 1
1582 2 30 SER H 2 33 GLU QG . . 5.500 2.827 2.289 3.675 . 0 0 "[ . 1 . 2 . 3 ]" 1
1583 2 30 SER H 2 33 GLU HG3 . . 5.500 2.886 2.311 3.816 . 0 0 "[ . 1 . 2 . 3 ]" 1
1584 2 30 SER HA 2 56 MET ME . . 5.500 3.825 2.349 5.238 . 0 0 "[ . 1 . 2 . 3 ]" 1
1585 2 30 SER HA 2 66 GLU QG . . 5.150 3.264 2.134 5.178 0.028 24 0 "[ . 1 . 2 . 3 ]" 1
1586 2 31 ARG H 2 31 ARG QG . . 5.130 3.799 2.063 4.108 . 0 0 "[ . 1 . 2 . 3 ]" 1
1587 2 31 ARG H 2 32 LYS H . . 4.630 3.215 2.969 3.516 . 0 0 "[ . 1 . 2 . 3 ]" 1
1588 2 31 ARG H 2 34 LEU H . . 5.460 4.881 4.649 5.117 . 0 0 "[ . 1 . 2 . 3 ]" 1
1589 2 31 ARG H 2 56 MET ME . . 5.500 3.103 2.280 4.161 . 0 0 "[ . 1 . 2 . 3 ]" 1
1590 2 31 ARG HA 2 31 ARG QB . . 2.770 2.366 2.090 2.507 . 0 0 "[ . 1 . 2 . 3 ]" 1
1591 2 31 ARG HA 2 31 ARG QD . . 4.830 3.518 2.207 4.483 . 0 0 "[ . 1 . 2 . 3 ]" 1
1592 2 31 ARG HA 2 31 ARG QG . . 3.190 2.568 2.173 3.282 0.092 29 0 "[ . 1 . 2 . 3 ]" 1
1593 2 31 ARG HA 2 34 LEU QB . . 3.390 2.831 2.165 3.466 0.076 12 0 "[ . 1 . 2 . 3 ]" 1
1594 2 31 ARG HA 2 34 LEU QD . . 4.590 3.642 2.279 4.600 0.010 24 0 "[ . 1 . 2 . 3 ]" 1
1595 2 31 ARG HA 2 56 MET ME . . 5.500 2.515 1.903 3.286 . 0 0 "[ . 1 . 2 . 3 ]" 1
1596 2 31 ARG QB 2 32 LYS H . . 3.490 2.929 2.391 3.534 0.044 29 0 "[ . 1 . 2 . 3 ]" 1
1597 2 31 ARG QD 2 32 LYS H . . 5.500 5.016 3.288 5.546 0.046 28 0 "[ . 1 . 2 . 3 ]" 1
1598 2 31 ARG QD 2 52 ILE MG . . 5.500 4.867 2.637 5.545 0.045 6 0 "[ . 1 . 2 . 3 ]" 1
1599 2 31 ARG QD 2 56 MET ME . . 5.500 3.469 2.053 5.044 . 0 0 "[ . 1 . 2 . 3 ]" 1
1600 2 31 ARG QG 2 32 LYS H . . 4.420 3.920 2.454 4.470 0.050 4 0 "[ . 1 . 2 . 3 ]" 1
1601 2 32 LYS H 2 32 LYS QD . . 3.970 3.052 1.982 4.062 0.092 2 0 "[ . 1 . 2 . 3 ]" 1
1602 2 32 LYS H 2 32 LYS QE . . 5.500 4.430 1.980 5.566 0.066 13 0 "[ . 1 . 2 . 3 ]" 1
1603 2 32 LYS H 2 32 LYS QG . . 4.920 3.271 1.908 4.181 . 0 0 "[ . 1 . 2 . 3 ]" 1
1604 2 32 LYS H 2 33 GLU H . . 4.320 2.460 2.097 2.971 . 0 0 "[ . 1 . 2 . 3 ]" 1
1605 2 32 LYS H 2 33 GLU QB . . 5.500 4.569 4.000 5.050 . 0 0 "[ . 1 . 2 . 3 ]" 1
1606 2 32 LYS HA 2 32 LYS QD . . 4.110 3.471 1.888 4.153 0.043 7 0 "[ . 1 . 2 . 3 ]" 1
1607 2 32 LYS HA 2 32 LYS QE . . 5.070 4.568 3.643 5.184 0.114 10 0 "[ . 1 . 2 . 3 ]" 1
1608 2 32 LYS HA 2 34 LEU H . . 4.710 4.384 3.800 4.723 0.013 16 0 "[ . 1 . 2 . 3 ]" 1
1609 2 32 LYS QB 2 35 LYS H . . 5.500 4.882 4.621 5.270 . 0 0 "[ . 1 . 2 . 3 ]" 1
1610 2 32 LYS QD 2 33 GLU H . . 4.660 3.704 2.827 4.787 0.127 13 0 "[ . 1 . 2 . 3 ]" 1
1611 2 32 LYS QD 2 34 LEU H . . 5.500 5.417 4.859 5.574 0.074 11 0 "[ . 1 . 2 . 3 ]" 1
1612 2 32 LYS QG 2 33 GLU H . . 5.500 3.791 1.828 4.829 . 0 0 "[ . 1 . 2 . 3 ]" 1
1613 2 32 LYS QG 2 35 LYS H . . 5.190 5.191 4.775 5.296 0.106 27 0 "[ . 1 . 2 . 3 ]" 1
1614 2 33 GLU H 2 33 GLU QG . . 4.400 2.182 1.786 2.655 . 0 0 "[ . 1 . 2 . 3 ]" 1
1615 2 33 GLU H 2 34 LEU H . . 4.710 2.622 2.314 3.131 . 0 0 "[ . 1 . 2 . 3 ]" 1
1616 2 33 GLU HA 2 36 GLU H . . 4.000 3.867 3.526 4.032 0.032 12 0 "[ . 1 . 2 . 3 ]" 1
1617 2 33 GLU QB 2 34 LEU H . . 5.190 2.452 2.189 3.384 . 0 0 "[ . 1 . 2 . 3 ]" 1
1618 2 33 GLU QG 2 34 LEU H . . 5.340 3.824 2.637 4.217 . 0 0 "[ . 1 . 2 . 3 ]" 1
1619 2 34 LEU H 2 34 LEU QB . . 3.670 2.147 2.014 2.401 . 0 0 "[ . 1 . 2 . 3 ]" 1
1620 2 34 LEU H 2 34 LEU MD1 . . 5.010 4.081 3.272 4.349 . 0 0 "[ . 1 . 2 . 3 ]" 1
1621 2 34 LEU H 2 34 LEU MD2 . . 5.010 4.113 3.710 4.467 . 0 0 "[ . 1 . 2 . 3 ]" 1
1622 2 34 LEU H 2 34 LEU HG . . 5.150 4.300 2.468 4.514 . 0 0 "[ . 1 . 2 . 3 ]" 1
1623 2 34 LEU H 2 35 LYS H . . 4.640 2.856 2.673 3.123 . 0 0 "[ . 1 . 2 . 3 ]" 1
1624 2 34 LEU H 2 56 MET ME . . 5.330 4.899 3.892 5.371 0.041 6 0 "[ . 1 . 2 . 3 ]" 1
1625 2 34 LEU HA 2 34 LEU QD . . 3.700 2.201 1.993 3.148 . 0 0 "[ . 1 . 2 . 3 ]" 1
1626 2 34 LEU HA 2 37 LEU H . . 4.570 3.340 2.924 3.664 . 0 0 "[ . 1 . 2 . 3 ]" 1
1627 2 34 LEU HA 2 37 LEU QB . . 3.770 2.417 2.150 2.780 . 0 0 "[ . 1 . 2 . 3 ]" 1
1628 2 34 LEU HA 2 37 LEU MD1 . . 5.500 4.154 3.097 5.475 . 0 0 "[ . 1 . 2 . 3 ]" 1
1629 2 34 LEU HA 2 37 LEU QD . . 4.500 3.154 2.801 3.673 . 0 0 "[ . 1 . 2 . 3 ]" 1
1630 2 34 LEU HA 2 37 LEU MD2 . . 5.500 3.715 2.817 5.217 . 0 0 "[ . 1 . 2 . 3 ]" 1
1631 2 34 LEU QB 2 35 LYS H . . 5.500 2.568 2.397 2.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
1632 2 34 LEU QD 2 37 LEU H . . 5.440 4.483 3.974 5.100 . 0 0 "[ . 1 . 2 . 3 ]" 1
1633 2 34 LEU QD 2 56 MET ME . . 4.550 2.826 1.941 4.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
1634 2 34 LEU QD 2 56 MET QG . . 5.230 3.001 1.877 4.818 . 0 0 "[ . 1 . 2 . 3 ]" 1
1635 2 34 LEU QD 2 59 LEU QD . . 5.370 2.046 1.784 2.899 . 0 0 "[ . 1 . 2 . 3 ]" 1
1636 2 34 LEU MD1 2 35 LYS H . . 4.850 4.342 3.197 4.896 0.046 16 0 "[ . 1 . 2 . 3 ]" 1
1637 2 34 LEU MD2 2 35 LYS H . . 4.850 4.302 2.795 4.855 0.005 9 0 "[ . 1 . 2 . 3 ]" 1
1638 2 34 LEU HG 2 35 LYS H . . 5.500 4.272 3.531 5.179 . 0 0 "[ . 1 . 2 . 3 ]" 1
1639 2 34 LEU HG 2 38 ILE MD . . 4.920 3.060 2.018 4.937 0.017 18 0 "[ . 1 . 2 . 3 ]" 1
1640 2 35 LYS H 2 35 LYS HB2 . . 3.810 2.666 2.090 3.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
1641 2 35 LYS H 2 35 LYS QB . . 3.290 2.298 2.072 2.657 . 0 0 "[ . 1 . 2 . 3 ]" 1
1642 2 35 LYS H 2 35 LYS HB3 . . 3.810 2.761 2.250 3.687 . 0 0 "[ . 1 . 2 . 3 ]" 1
1643 2 35 LYS H 2 35 LYS QD . . 4.740 4.331 2.800 4.751 0.011 17 0 "[ . 1 . 2 . 3 ]" 1
1644 2 35 LYS H 2 35 LYS QE . . 5.410 4.525 3.779 5.454 0.044 13 0 "[ . 1 . 2 . 3 ]" 1
1645 2 35 LYS H 2 35 LYS HG2 . . 4.940 3.840 2.013 4.504 . 0 0 "[ . 1 . 2 . 3 ]" 1
1646 2 35 LYS H 2 35 LYS QG . . 4.320 3.318 2.002 4.024 . 0 0 "[ . 1 . 2 . 3 ]" 1
1647 2 35 LYS H 2 35 LYS HG3 . . 4.940 3.813 2.270 4.563 . 0 0 "[ . 1 . 2 . 3 ]" 1
1648 2 35 LYS H 2 36 GLU H . . 3.940 2.809 2.480 3.028 . 0 0 "[ . 1 . 2 . 3 ]" 1
1649 2 35 LYS H 2 52 ILE MD . . 5.500 5.322 4.731 5.558 0.058 7 0 "[ . 1 . 2 . 3 ]" 1
1650 2 35 LYS H 2 52 ILE MG . . 5.500 4.014 3.561 4.718 . 0 0 "[ . 1 . 2 . 3 ]" 1
1651 2 35 LYS HA 2 35 LYS QD . . 4.450 3.959 2.275 4.423 . 0 0 "[ . 1 . 2 . 3 ]" 1
1652 2 35 LYS HA 2 38 ILE HB . . 3.620 3.347 2.801 3.689 0.069 10 0 "[ . 1 . 2 . 3 ]" 1
1653 2 35 LYS HA 2 38 ILE MD . . 4.950 2.589 2.021 3.247 . 0 0 "[ . 1 . 2 . 3 ]" 1
1654 2 35 LYS HA 2 38 ILE MG . . 5.500 4.693 4.320 4.982 . 0 0 "[ . 1 . 2 . 3 ]" 1
1655 2 35 LYS HA 2 52 ILE MD . . 4.490 2.910 2.201 3.404 . 0 0 "[ . 1 . 2 . 3 ]" 1
1656 2 35 LYS HA 2 52 ILE MG . . 5.500 2.409 1.939 3.082 . 0 0 "[ . 1 . 2 . 3 ]" 1
1657 2 35 LYS QB 2 35 LYS QE . . 3.740 2.515 1.927 3.759 0.019 9 0 "[ . 1 . 2 . 3 ]" 1
1658 2 35 LYS QB 2 36 GLU H . . 3.740 2.761 2.157 3.813 0.073 7 0 "[ . 1 . 2 . 3 ]" 1
1659 2 35 LYS QB 2 52 ILE MD . . 4.440 3.807 2.382 4.457 0.017 23 0 "[ . 1 . 2 . 3 ]" 1
1660 2 35 LYS HB2 2 36 GLU H . . 4.300 3.626 2.192 4.306 0.006 7 0 "[ . 1 . 2 . 3 ]" 1
1661 2 35 LYS HB3 2 36 GLU H . . 4.300 3.091 2.571 4.318 0.018 27 0 "[ . 1 . 2 . 3 ]" 1
1662 2 35 LYS QD 2 36 GLU H . . 4.490 4.416 2.981 4.618 0.128 31 0 "[ . 1 . 2 . 3 ]" 1
1663 2 35 LYS QD 2 52 ILE MD . . 5.500 4.277 2.296 5.500 . 0 0 "[ . 1 . 2 . 3 ]" 1
1664 2 35 LYS QE 2 38 ILE MD . . 5.500 5.042 4.235 5.543 0.043 13 0 "[ . 1 . 2 . 3 ]" 1
1665 2 35 LYS QE 2 52 ILE MD . . 5.500 3.866 2.004 5.517 0.017 12 0 "[ . 1 . 2 . 3 ]" 1
1666 2 35 LYS QE 2 52 ILE MG . . 5.500 2.779 1.865 4.613 . 0 0 "[ . 1 . 2 . 3 ]" 1
1667 2 35 LYS QG 2 36 GLU H . . 4.520 3.620 2.591 4.489 . 0 0 "[ . 1 . 2 . 3 ]" 1
1668 2 35 LYS HG2 2 36 GLU H . . 5.240 4.081 2.881 5.044 . 0 0 "[ . 1 . 2 . 3 ]" 1
1669 2 35 LYS HG3 2 36 GLU H . . 5.240 4.348 2.791 5.253 0.013 15 0 "[ . 1 . 2 . 3 ]" 1
1670 2 36 GLU H 2 36 GLU HB2 . . 3.890 2.495 2.170 2.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
1671 2 36 GLU H 2 36 GLU QB . . 3.200 2.256 2.007 2.458 . 0 0 "[ . 1 . 2 . 3 ]" 1
1672 2 36 GLU H 2 36 GLU HB3 . . 3.890 2.684 2.069 3.347 . 0 0 "[ . 1 . 2 . 3 ]" 1
1673 2 36 GLU H 2 36 GLU HG2 . . 4.880 4.597 4.344 4.878 . 0 0 "[ . 1 . 2 . 3 ]" 1
1674 2 36 GLU H 2 36 GLU QG . . 4.270 4.031 3.765 4.232 . 0 0 "[ . 1 . 2 . 3 ]" 1
1675 2 36 GLU H 2 36 GLU HG3 . . 4.880 4.462 4.127 4.642 . 0 0 "[ . 1 . 2 . 3 ]" 1
1676 2 36 GLU H 2 37 LEU H . . 4.290 2.810 2.324 3.263 . 0 0 "[ . 1 . 2 . 3 ]" 1
1677 2 36 GLU HA 2 40 LYS QG . . 4.950 4.073 3.276 5.011 0.061 30 0 "[ . 1 . 2 . 3 ]" 1
1678 2 36 GLU QB 2 37 LEU H . . 3.940 2.587 2.122 3.220 . 0 0 "[ . 1 . 2 . 3 ]" 1
1679 2 36 GLU HG2 2 40 LYS HG2 . . 5.500 4.765 2.689 5.590 0.090 9 0 "[ . 1 . 2 . 3 ]" 1
1680 2 36 GLU HG2 2 40 LYS HG3 . . 5.500 4.353 2.230 5.595 0.095 29 0 "[ . 1 . 2 . 3 ]" 1
1681 2 36 GLU HG3 2 40 LYS HG2 . . 5.500 3.982 2.565 5.519 0.019 7 0 "[ . 1 . 2 . 3 ]" 1
1682 2 36 GLU HG3 2 40 LYS HG3 . . 5.500 3.730 2.557 4.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
1683 2 37 LEU H 2 37 LEU HB2 . . 4.090 2.497 2.148 2.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
1684 2 37 LEU H 2 37 LEU HB3 . . 4.090 2.412 2.128 2.867 . 0 0 "[ . 1 . 2 . 3 ]" 1
1685 2 37 LEU H 2 37 LEU MD1 . . 4.910 4.216 4.023 4.367 . 0 0 "[ . 1 . 2 . 3 ]" 1
1686 2 37 LEU H 2 37 LEU MD2 . . 4.910 4.207 3.984 4.346 . 0 0 "[ . 1 . 2 . 3 ]" 1
1687 2 37 LEU H 2 37 LEU HG . . 5.350 4.405 4.178 4.549 . 0 0 "[ . 1 . 2 . 3 ]" 1
1688 2 37 LEU H 2 38 ILE H . . 4.280 2.977 2.582 3.230 . 0 0 "[ . 1 . 2 . 3 ]" 1
1689 2 37 LEU HA 2 37 LEU QD . . 4.200 2.645 2.183 3.189 . 0 0 "[ . 1 . 2 . 3 ]" 1
1690 2 37 LEU HA 2 40 LYS QD . . 5.190 4.877 3.669 5.286 0.096 26 0 "[ . 1 . 2 . 3 ]" 1
1691 2 37 LEU HA 2 40 LYS QG . . 4.800 3.847 2.831 4.822 0.022 6 0 "[ . 1 . 2 . 3 ]" 1
1692 2 37 LEU HA 2 41 GLU H . . 5.100 3.885 3.503 4.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
1693 2 37 LEU QB 2 38 ILE H . . 4.770 2.455 2.243 2.747 . 0 0 "[ . 1 . 2 . 3 ]" 1
1694 2 37 LEU QD 2 38 ILE H . . 4.460 3.207 2.688 3.880 . 0 0 "[ . 1 . 2 . 3 ]" 1
1695 2 37 LEU QD 2 38 ILE HA . . 4.860 3.290 2.377 4.172 . 0 0 "[ . 1 . 2 . 3 ]" 1
1696 2 37 LEU QD 2 40 LYS H . . 5.290 4.438 3.624 5.034 . 0 0 "[ . 1 . 2 . 3 ]" 1
1697 2 37 LEU QD 2 41 GLU H . . 5.440 3.604 2.763 4.698 . 0 0 "[ . 1 . 2 . 3 ]" 1
1698 2 37 LEU QD 2 72 TYR QE . . 5.440 2.267 1.968 3.085 . 0 0 "[ . 1 . 2 . 3 ]" 1
1699 2 37 LEU QD 2 75 PHE QD . . 5.440 3.586 2.234 4.757 . 0 0 "[ . 1 . 2 . 3 ]" 1
1700 2 37 LEU QD 2 75 PHE QE . . 5.440 2.734 2.088 4.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
1701 2 37 LEU MD1 2 38 ILE H . . 5.200 4.185 2.722 4.673 . 0 0 "[ . 1 . 2 . 3 ]" 1
1702 2 37 LEU MD1 2 75 PHE HZ . . 5.500 5.333 3.599 5.568 0.068 10 0 "[ . 1 . 2 . 3 ]" 1
1703 2 37 LEU MD2 2 38 ILE H . . 5.200 3.475 2.728 4.244 . 0 0 "[ . 1 . 2 . 3 ]" 1
1704 2 37 LEU MD2 2 75 PHE HZ . . 5.500 4.350 3.050 5.529 0.029 22 0 "[ . 1 . 2 . 3 ]" 1
1705 2 38 ILE H 2 38 ILE HB . . 3.920 2.639 2.491 2.773 . 0 0 "[ . 1 . 2 . 3 ]" 1
1706 2 38 ILE H 2 38 ILE MD . . 4.520 3.272 3.023 3.597 . 0 0 "[ . 1 . 2 . 3 ]" 1
1707 2 38 ILE H 2 38 ILE QG . . 4.640 2.140 1.902 2.362 . 0 0 "[ . 1 . 2 . 3 ]" 1
1708 2 38 ILE H 2 38 ILE MG . . 4.630 3.848 3.808 3.887 . 0 0 "[ . 1 . 2 . 3 ]" 1
1709 2 38 ILE HA 2 41 GLU H . . 4.860 3.610 3.304 3.988 . 0 0 "[ . 1 . 2 . 3 ]" 1
1710 2 38 ILE HA 2 41 GLU QB . . 4.620 3.110 2.069 4.452 . 0 0 "[ . 1 . 2 . 3 ]" 1
1711 2 38 ILE HA 2 42 LEU H . . 5.500 3.481 2.829 4.595 . 0 0 "[ . 1 . 2 . 3 ]" 1
1712 2 38 ILE HA 2 42 LEU QB . . 4.380 3.698 2.406 4.344 . 0 0 "[ . 1 . 2 . 3 ]" 1
1713 2 38 ILE HA 2 42 LEU QD . . 4.660 3.477 2.425 4.667 0.007 4 0 "[ . 1 . 2 . 3 ]" 1
1714 2 38 ILE HA 2 42 LEU HG . . 5.500 4.970 3.953 5.533 0.033 9 0 "[ . 1 . 2 . 3 ]" 1
1715 2 38 ILE HB 2 75 PHE QE . . 5.500 5.220 4.844 5.500 0.000 29 0 "[ . 1 . 2 . 3 ]" 1
1716 2 38 ILE MD 2 39 LYS H . . 5.200 4.128 3.730 4.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
1717 2 38 ILE MD 2 39 LYS HA . . 5.500 5.575 5.517 5.610 0.110 21 0 "[ . 1 . 2 . 3 ]" 1
1718 2 38 ILE MD 2 47 MET ME . . 4.770 3.832 2.729 4.769 . 0 0 "[ . 1 . 2 . 3 ]" 1
1719 2 38 ILE MD 2 47 MET HG2 . . 5.500 4.767 3.377 5.523 0.023 23 0 "[ . 1 . 2 . 3 ]" 1
1720 2 38 ILE MD 2 47 MET HG3 . . 5.500 4.248 2.789 4.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
1721 2 38 ILE MD 2 52 ILE MD . . 5.440 2.589 1.936 3.752 . 0 0 "[ . 1 . 2 . 3 ]" 1
1722 2 38 ILE MD 2 56 MET HA . . 4.390 4.403 4.170 4.474 0.084 13 0 "[ . 1 . 2 . 3 ]" 1
1723 2 38 ILE MD 2 75 PHE QD . . 5.500 4.698 4.191 5.169 . 0 0 "[ . 1 . 2 . 3 ]" 1
1724 2 38 ILE MD 2 75 PHE QE . . 5.170 3.883 3.070 4.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
1725 2 38 ILE MD 2 75 PHE HZ . . 5.500 4.165 2.974 4.661 . 0 0 "[ . 1 . 2 . 3 ]" 1
1726 2 38 ILE QG 2 42 LEU QB . . 5.500 4.873 3.659 5.522 0.022 16 0 "[ . 1 . 2 . 3 ]" 1
1727 2 38 ILE QG 2 75 PHE QE . . 5.500 2.895 2.572 3.145 . 0 0 "[ . 1 . 2 . 3 ]" 1
1728 2 38 ILE QG 2 75 PHE HZ . . 5.500 2.546 2.190 3.029 . 0 0 "[ . 1 . 2 . 3 ]" 1
1729 2 38 ILE MG 2 39 LYS H . . 4.590 3.360 3.028 3.702 . 0 0 "[ . 1 . 2 . 3 ]" 1
1730 2 38 ILE MG 2 39 LYS HA . . 5.280 3.256 2.918 3.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
1731 2 38 ILE MG 2 47 MET ME . . 4.950 2.889 2.073 4.064 . 0 0 "[ . 1 . 2 . 3 ]" 1
1732 2 38 ILE MG 2 47 MET HG2 . . 5.500 2.565 1.980 3.770 . 0 0 "[ . 1 . 2 . 3 ]" 1
1733 2 38 ILE MG 2 47 MET HG3 . . 5.500 2.621 1.945 3.828 . 0 0 "[ . 1 . 2 . 3 ]" 1
1734 2 38 ILE MG 2 52 ILE MD . . 5.500 2.706 2.068 4.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
1735 2 38 ILE MG 2 75 PHE QD . . 5.500 4.870 4.431 5.416 . 0 0 "[ . 1 . 2 . 3 ]" 1
1736 2 38 ILE MG 2 75 PHE QE . . 5.500 3.107 2.585 3.692 . 0 0 "[ . 1 . 2 . 3 ]" 1
1737 2 38 ILE MG 2 75 PHE HZ . . 5.500 2.546 2.111 3.065 . 0 0 "[ . 1 . 2 . 3 ]" 1
1738 2 39 LYS H 2 39 LYS QB . . 3.640 2.228 1.937 2.598 . 0 0 "[ . 1 . 2 . 3 ]" 1
1739 2 39 LYS H 2 39 LYS QD . . 4.320 4.003 2.781 4.408 0.088 8 0 "[ . 1 . 2 . 3 ]" 1
1740 2 39 LYS H 2 39 LYS QE . . 5.500 4.689 3.426 5.612 0.112 9 0 "[ . 1 . 2 . 3 ]" 1
1741 2 39 LYS H 2 39 LYS QG . . 4.880 3.178 2.205 4.031 . 0 0 "[ . 1 . 2 . 3 ]" 1
1742 2 39 LYS HA 2 39 LYS QB . . 2.790 2.398 2.064 2.548 . 0 0 "[ . 1 . 2 . 3 ]" 1
1743 2 39 LYS HA 2 39 LYS QD . . 3.920 3.483 2.103 4.013 0.093 12 0 "[ . 1 . 2 . 3 ]" 1
1744 2 39 LYS HA 2 41 GLU H . . 5.180 4.702 3.968 5.187 0.007 11 0 "[ . 1 . 2 . 3 ]" 1
1745 2 40 LYS H 2 40 LYS HB2 . . 3.940 2.450 2.067 3.095 . 0 0 "[ . 1 . 2 . 3 ]" 1
1746 2 40 LYS H 2 40 LYS QB . . 3.400 2.390 2.032 2.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
1747 2 40 LYS H 2 40 LYS HB3 . . 3.940 3.521 2.430 3.874 . 0 0 "[ . 1 . 2 . 3 ]" 1
1748 2 40 LYS H 2 40 LYS QD . . 4.360 3.967 2.844 4.442 0.082 27 0 "[ . 1 . 2 . 3 ]" 1
1749 2 40 LYS H 2 40 LYS HG2 . . 4.600 3.406 2.398 4.531 . 0 0 "[ . 1 . 2 . 3 ]" 1
1750 2 40 LYS H 2 40 LYS QG . . 4.020 3.032 2.278 4.050 0.030 2 0 "[ . 1 . 2 . 3 ]" 1
1751 2 40 LYS H 2 40 LYS HG3 . . 4.600 3.817 2.538 4.583 . 0 0 "[ . 1 . 2 . 3 ]" 1
1752 2 40 LYS H 2 41 GLU H . . 4.330 2.288 1.972 2.680 . 0 0 "[ . 1 . 2 . 3 ]" 1
1753 2 40 LYS H 2 42 LEU H . . 4.610 3.869 2.931 4.615 0.005 28 0 "[ . 1 . 2 . 3 ]" 1
1754 2 40 LYS HA 2 40 LYS QD . . 4.020 2.798 2.011 3.985 . 0 0 "[ . 1 . 2 . 3 ]" 1
1755 2 40 LYS HA 2 40 LYS QE . . 4.620 3.957 1.945 4.686 0.066 7 0 "[ . 1 . 2 . 3 ]" 1
1756 2 40 LYS HA 2 40 LYS HG2 . . 3.960 2.934 2.345 3.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
1757 2 40 LYS HA 2 40 LYS HG3 . . 3.960 3.523 2.663 3.998 0.038 23 0 "[ . 1 . 2 . 3 ]" 1
1758 2 40 LYS QB 2 41 GLU H . . 4.100 2.631 2.107 3.050 . 0 0 "[ . 1 . 2 . 3 ]" 1
1759 2 40 LYS HB2 2 41 GLU H . . 4.790 2.836 2.130 4.020 . 0 0 "[ . 1 . 2 . 3 ]" 1
1760 2 40 LYS HB3 2 41 GLU H . . 4.790 3.460 2.692 4.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
1761 2 40 LYS QD 2 41 GLU H . . 4.830 4.694 3.664 4.929 0.099 8 0 "[ . 1 . 2 . 3 ]" 1
1762 2 40 LYS QG 2 41 GLU H . . 4.820 4.223 3.209 4.834 0.014 25 0 "[ . 1 . 2 . 3 ]" 1
1763 2 40 LYS HG2 2 41 GLU H . . 5.500 4.719 3.310 5.358 . 0 0 "[ . 1 . 2 . 3 ]" 1
1764 2 40 LYS HG3 2 41 GLU H . . 5.500 4.863 3.705 5.500 . 0 0 "[ . 1 . 2 . 3 ]" 1
1765 2 41 GLU H 2 42 LEU H . . 4.380 2.672 2.118 3.556 . 0 0 "[ . 1 . 2 . 3 ]" 1
1766 2 41 GLU H 2 42 LEU QD . . 5.440 4.416 3.609 5.439 . 0 0 "[ . 1 . 2 . 3 ]" 1
1767 2 41 GLU QB 2 42 LEU H . . 4.300 2.735 1.969 3.820 . 0 0 "[ . 1 . 2 . 3 ]" 1
1768 2 41 GLU QB 2 42 LEU QB . . 4.390 4.015 3.376 4.432 0.042 9 0 "[ . 1 . 2 . 3 ]" 1
1769 2 41 GLU QB 2 42 LEU MD1 . . 5.500 4.502 2.334 5.545 0.045 23 0 "[ . 1 . 2 . 3 ]" 1
1770 2 41 GLU QB 2 42 LEU QD . . 4.290 2.803 1.941 4.328 0.038 14 0 "[ . 1 . 2 . 3 ]" 1
1771 2 41 GLU QB 2 42 LEU MD2 . . 5.500 3.043 1.948 5.060 . 0 0 "[ . 1 . 2 . 3 ]" 1
1772 2 42 LEU H 2 42 LEU MD1 . . 4.670 4.061 2.252 4.448 . 0 0 "[ . 1 . 2 . 3 ]" 1
1773 2 42 LEU H 2 42 LEU QD . . 4.440 2.879 2.178 3.851 . 0 0 "[ . 1 . 2 . 3 ]" 1
1774 2 42 LEU H 2 42 LEU MD2 . . 4.670 3.109 2.191 4.666 . 0 0 "[ . 1 . 2 . 3 ]" 1
1775 2 42 LEU H 2 42 LEU HG . . 5.500 4.100 2.813 5.407 . 0 0 "[ . 1 . 2 . 3 ]" 1
1776 2 42 LEU H 2 44 LEU QD . . 5.440 4.963 4.589 5.456 0.016 14 0 "[ . 1 . 2 . 3 ]" 1
1777 2 42 LEU HA 2 42 LEU MD1 . . 4.160 2.493 2.094 3.919 . 0 0 "[ . 1 . 2 . 3 ]" 1
1778 2 42 LEU HA 2 42 LEU QD . . 3.470 2.138 1.947 3.070 . 0 0 "[ . 1 . 2 . 3 ]" 1
1779 2 42 LEU HA 2 42 LEU MD2 . . 4.160 2.646 2.114 3.779 . 0 0 "[ . 1 . 2 . 3 ]" 1
1780 2 42 LEU QD 2 44 LEU H . . 5.440 4.023 3.262 4.947 . 0 0 "[ . 1 . 2 . 3 ]" 1
1781 2 42 LEU QD 2 75 PHE QD . . 5.200 4.642 4.021 5.218 0.018 9 0 "[ . 1 . 2 . 3 ]" 1
1782 2 42 LEU QD 2 75 PHE QE . . 5.440 3.223 2.300 4.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
1783 2 42 LEU QD 2 75 PHE HZ . . 4.860 2.746 2.041 3.812 . 0 0 "[ . 1 . 2 . 3 ]" 1
1784 2 42 LEU QD 2 79 LEU QD . . 4.830 1.869 1.718 2.191 . 0 0 "[ . 1 . 2 . 3 ]" 1
1785 2 42 LEU MD1 2 83 TYR QE . . 5.500 3.719 2.234 5.392 . 0 0 "[ . 1 . 2 . 3 ]" 1
1786 2 42 LEU MD2 2 83 TYR QE . . 5.500 4.352 2.856 5.508 0.008 26 0 "[ . 1 . 2 . 3 ]" 1
1787 2 43 CYS QB 2 44 LEU H . . 4.040 3.301 2.121 4.052 0.012 19 0 "[ . 1 . 2 . 3 ]" 1
1788 2 43 CYS QB 2 44 LEU QD . . 4.850 3.999 2.770 4.853 0.003 9 0 "[ . 1 . 2 . 3 ]" 1
1789 2 44 LEU H 2 44 LEU HB2 . . 4.110 3.101 2.121 3.919 . 0 0 "[ . 1 . 2 . 3 ]" 1
1790 2 44 LEU H 2 44 LEU QB . . 3.530 2.547 2.100 3.293 . 0 0 "[ . 1 . 2 . 3 ]" 1
1791 2 44 LEU H 2 44 LEU HB3 . . 4.110 3.163 2.157 4.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
1792 2 44 LEU H 2 44 LEU MD1 . . 5.400 3.352 1.657 4.240 . 0 0 "[ . 1 . 2 . 3 ]" 1
1793 2 44 LEU H 2 44 LEU QD . . 4.670 2.297 1.656 3.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
1794 2 44 LEU H 2 44 LEU MD2 . . 5.400 2.861 1.796 4.543 . 0 0 "[ . 1 . 2 . 3 ]" 1
1795 2 44 LEU H 2 44 LEU HG . . 4.820 3.331 1.912 4.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
1796 2 44 LEU HA 2 44 LEU HB2 . . 2.990 2.721 2.302 3.036 0.046 20 0 "[ . 1 . 2 . 3 ]" 1
1797 2 44 LEU HA 2 44 LEU QB . . 2.440 2.295 2.136 2.501 0.061 6 0 "[ . 1 . 2 . 3 ]" 1
1798 2 44 LEU HA 2 44 LEU HB3 . . 2.990 2.519 2.345 2.691 . 0 0 "[ . 1 . 2 . 3 ]" 1
1799 2 44 LEU HA 2 44 LEU QD . . 3.740 2.877 2.062 3.483 . 0 0 "[ . 1 . 2 . 3 ]" 1
1800 2 44 LEU HA 2 44 LEU HG . . 3.800 3.315 2.106 3.809 0.009 18 0 "[ . 1 . 2 . 3 ]" 1
1801 2 44 LEU QB 2 44 LEU QD . . 2.490 1.975 1.908 2.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
1802 2 44 LEU QB 2 45 GLY H . . 4.400 3.005 1.720 4.066 . 0 0 "[ . 1 . 2 . 3 ]" 1
1803 2 44 LEU HB2 2 44 LEU MD1 . . 3.520 2.458 2.192 3.253 . 0 0 "[ . 1 . 2 . 3 ]" 1
1804 2 44 LEU HB2 2 44 LEU MD2 . . 3.520 2.894 2.330 3.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
1805 2 44 LEU HB3 2 44 LEU MD1 . . 3.520 2.694 2.291 3.292 . 0 0 "[ . 1 . 2 . 3 ]" 1
1806 2 44 LEU HB3 2 44 LEU MD2 . . 3.520 2.489 2.163 3.284 . 0 0 "[ . 1 . 2 . 3 ]" 1
1807 2 44 LEU QD 2 79 LEU QD . . 4.750 4.074 1.996 4.759 0.009 28 0 "[ . 1 . 2 . 3 ]" 1
1808 2 44 LEU MD1 2 45 GLY H . . 4.980 4.395 2.451 5.009 0.029 15 0 "[ . 1 . 2 . 3 ]" 1
1809 2 44 LEU MD2 2 45 GLY H . . 4.980 3.915 2.143 4.995 0.015 20 0 "[ . 1 . 2 . 3 ]" 1
1810 2 44 LEU HG 2 45 GLY H . . 4.780 4.130 2.994 4.907 0.127 26 0 "[ . 1 . 2 . 3 ]" 1
1811 2 46 GLU QB 2 47 MET H . . 4.120 3.369 2.004 4.100 . 0 0 "[ . 1 . 2 . 3 ]" 1
1812 2 47 MET H 2 47 MET ME . . 5.130 4.588 3.020 5.174 0.044 20 0 "[ . 1 . 2 . 3 ]" 1
1813 2 47 MET H 2 47 MET HG2 . . 4.920 3.871 1.854 4.706 . 0 0 "[ . 1 . 2 . 3 ]" 1
1814 2 47 MET H 2 47 MET HG3 . . 4.920 4.238 3.310 4.798 . 0 0 "[ . 1 . 2 . 3 ]" 1
1815 2 47 MET HA 2 47 MET ME . . 4.410 3.142 2.407 4.207 . 0 0 "[ . 1 . 2 . 3 ]" 1
1816 2 47 MET HA 2 48 LYS H . . 3.300 2.452 2.056 3.391 0.091 7 0 "[ . 1 . 2 . 3 ]" 1
1817 2 47 MET QB 2 48 LYS H . . 4.300 3.577 2.311 4.042 . 0 0 "[ . 1 . 2 . 3 ]" 1
1818 2 47 MET QB 2 52 ILE MD . . 4.830 3.010 2.067 4.306 . 0 0 "[ . 1 . 2 . 3 ]" 1
1819 2 47 MET QB 2 52 ILE QG . . 4.680 3.640 2.197 4.719 0.039 6 0 "[ . 1 . 2 . 3 ]" 1
1820 2 47 MET ME 2 48 LYS H . . 5.210 4.667 2.916 5.249 0.039 13 0 "[ . 1 . 2 . 3 ]" 1
1821 2 47 MET ME 2 51 SER HA . . 5.500 4.934 3.964 5.560 0.060 17 0 "[ . 1 . 2 . 3 ]" 1
1822 2 47 MET ME 2 52 ILE H . . 5.500 4.848 3.469 5.539 0.039 13 0 "[ . 1 . 2 . 3 ]" 1
1823 2 47 MET ME 2 52 ILE HA . . 5.500 3.889 2.529 4.874 . 0 0 "[ . 1 . 2 . 3 ]" 1
1824 2 47 MET ME 2 52 ILE MD . . 5.500 3.793 2.393 5.214 . 0 0 "[ . 1 . 2 . 3 ]" 1
1825 2 47 MET ME 2 52 ILE MG . . 5.500 4.944 3.839 5.517 0.017 29 0 "[ . 1 . 2 . 3 ]" 1
1826 2 47 MET ME 2 75 PHE QD . . 5.500 5.365 4.114 5.521 0.021 18 0 "[ . 1 . 2 . 3 ]" 1
1827 2 47 MET ME 2 75 PHE QE . . 5.500 3.979 3.515 4.542 . 0 0 "[ . 1 . 2 . 3 ]" 1
1828 2 47 MET ME 2 79 LEU QD . . 4.360 4.040 3.094 4.381 0.021 14 0 "[ . 1 . 2 . 3 ]" 1
1829 2 47 MET QG 2 48 LYS H . . 4.780 4.166 3.065 4.778 . 0 0 "[ . 1 . 2 . 3 ]" 1
1830 2 47 MET QG 2 52 ILE MD . . 5.190 2.757 2.096 3.973 . 0 0 "[ . 1 . 2 . 3 ]" 1
1831 2 47 MET QG 2 52 ILE MG . . 5.340 4.845 3.870 5.383 0.043 7 0 "[ . 1 . 2 . 3 ]" 1
1832 2 47 MET QG 2 79 LEU QD . . 5.280 5.009 4.122 5.308 0.028 25 0 "[ . 1 . 2 . 3 ]" 1
1833 2 47 MET HG2 2 48 LYS H . . 5.500 5.159 3.742 5.651 0.151 22 0 "[ . 1 . 2 . 3 ]" 1
1834 2 47 MET HG3 2 48 LYS H . . 5.500 4.548 3.105 5.608 0.108 28 0 "[ . 1 . 2 . 3 ]" 1
1835 2 48 LYS H 2 48 LYS QD . . 5.500 3.735 1.914 5.129 . 0 0 "[ . 1 . 2 . 3 ]" 1
1836 2 48 LYS H 2 48 LYS QG . . 4.780 2.977 1.809 4.392 . 0 0 "[ . 1 . 2 . 3 ]" 1
1837 2 48 LYS HA 2 48 LYS QG . . 4.010 2.585 2.209 3.405 . 0 0 "[ . 1 . 2 . 3 ]" 1
1838 2 49 GLU H 2 49 GLU HG2 . . 5.180 3.357 2.004 4.639 . 0 0 "[ . 1 . 2 . 3 ]" 1
1839 2 49 GLU H 2 49 GLU HG3 . . 5.180 3.816 2.703 4.533 . 0 0 "[ . 1 . 2 . 3 ]" 1
1840 2 49 GLU HA 2 52 ILE HB . . 5.500 2.972 2.006 4.052 . 0 0 "[ . 1 . 2 . 3 ]" 1
1841 2 49 GLU HA 2 52 ILE MD . . 4.980 3.496 2.161 4.989 0.009 28 0 "[ . 1 . 2 . 3 ]" 1
1842 2 49 GLU HA 2 52 ILE HG12 . . 5.500 4.024 2.319 5.505 0.005 10 0 "[ . 1 . 2 . 3 ]" 1
1843 2 49 GLU HA 2 52 ILE QG . . 4.770 3.140 2.083 4.331 . 0 0 "[ . 1 . 2 . 3 ]" 1
1844 2 49 GLU HA 2 52 ILE HG13 . . 5.500 3.364 2.288 4.542 . 0 0 "[ . 1 . 2 . 3 ]" 1
1845 2 49 GLU HA 2 52 ILE MG . . 5.340 4.110 3.165 4.932 . 0 0 "[ . 1 . 2 . 3 ]" 1
1846 2 49 GLU QB 2 50 SER H . . 4.660 2.733 2.031 4.066 . 0 0 "[ . 1 . 2 . 3 ]" 1
1847 2 51 SER HA 2 53 ASP H . . 4.790 4.225 3.692 4.815 0.025 4 0 "[ . 1 . 2 . 3 ]" 1
1848 2 51 SER HA 2 54 ASP H . . 5.500 3.594 2.694 4.369 . 0 0 "[ . 1 . 2 . 3 ]" 1
1849 2 52 ILE H 2 52 ILE MD . . 5.500 3.730 3.278 4.192 . 0 0 "[ . 1 . 2 . 3 ]" 1
1850 2 52 ILE H 2 52 ILE HG12 . . 5.330 3.124 2.061 4.242 . 0 0 "[ . 1 . 2 . 3 ]" 1
1851 2 52 ILE H 2 52 ILE HG13 . . 5.330 3.107 2.197 3.966 . 0 0 "[ . 1 . 2 . 3 ]" 1
1852 2 52 ILE H 2 52 ILE MG . . 3.940 3.759 3.515 3.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
1853 2 52 ILE H 2 53 ASP H . . 4.300 2.533 2.039 3.058 . 0 0 "[ . 1 . 2 . 3 ]" 1
1854 2 52 ILE HA 2 52 ILE MD . . 4.490 3.078 2.100 3.911 . 0 0 "[ . 1 . 2 . 3 ]" 1
1855 2 52 ILE HA 2 55 LEU H . . 4.340 3.456 2.915 3.982 . 0 0 "[ . 1 . 2 . 3 ]" 1
1856 2 52 ILE HA 2 55 LEU HB2 . . 5.500 3.236 2.150 3.963 . 0 0 "[ . 1 . 2 . 3 ]" 1
1857 2 52 ILE HA 2 55 LEU QB . . 3.790 2.350 2.038 2.731 . 0 0 "[ . 1 . 2 . 3 ]" 1
1858 2 52 ILE HA 2 55 LEU HB3 . . 5.500 2.606 2.060 3.874 . 0 0 "[ . 1 . 2 . 3 ]" 1
1859 2 52 ILE HA 2 55 LEU QD . . 4.810 3.280 2.668 4.414 . 0 0 "[ . 1 . 2 . 3 ]" 1
1860 2 52 ILE HB 2 53 ASP H . . 4.260 2.890 2.522 3.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
1861 2 52 ILE MD 2 53 ASP H . . 5.160 4.892 4.396 5.190 0.030 3 0 "[ . 1 . 2 . 3 ]" 1
1862 2 52 ILE HG12 2 53 ASP H . . 5.500 4.841 4.298 5.345 . 0 0 "[ . 1 . 2 . 3 ]" 1
1863 2 52 ILE HG13 2 53 ASP H . . 5.500 4.821 4.255 5.514 0.014 12 0 "[ . 1 . 2 . 3 ]" 1
1864 2 52 ILE MG 2 53 ASP H . . 5.080 3.429 2.997 4.057 . 0 0 "[ . 1 . 2 . 3 ]" 1
1865 2 52 ILE MG 2 53 ASP HA . . 5.500 3.406 2.879 4.209 . 0 0 "[ . 1 . 2 . 3 ]" 1
1866 2 52 ILE MG 2 56 MET QG . . 5.500 3.997 2.317 5.337 . 0 0 "[ . 1 . 2 . 3 ]" 1
1867 2 53 ASP H 2 53 ASP HB2 . . 4.040 2.324 2.083 2.681 . 0 0 "[ . 1 . 2 . 3 ]" 1
1868 2 53 ASP H 2 53 ASP HB3 . . 4.040 3.112 2.542 3.668 . 0 0 "[ . 1 . 2 . 3 ]" 1
1869 2 53 ASP H 2 54 ASP H . . 4.160 2.663 2.347 3.086 . 0 0 "[ . 1 . 2 . 3 ]" 1
1870 2 53 ASP HA 2 56 MET H . . 4.870 3.421 2.986 4.030 . 0 0 "[ . 1 . 2 . 3 ]" 1
1871 2 53 ASP HA 2 56 MET QB . . 5.220 2.735 2.039 4.298 . 0 0 "[ . 1 . 2 . 3 ]" 1
1872 2 53 ASP HA 2 56 MET QG . . 4.940 3.489 2.087 4.941 0.001 10 0 "[ . 1 . 2 . 3 ]" 1
1873 2 53 ASP HB2 2 54 ASP H . . 5.500 3.493 2.576 4.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
1874 2 53 ASP HB3 2 54 ASP H . . 5.500 3.190 2.116 4.157 . 0 0 "[ . 1 . 2 . 3 ]" 1
1875 2 54 ASP H 2 54 ASP HB2 . . 3.530 2.518 2.178 3.536 0.006 5 0 "[ . 1 . 2 . 3 ]" 1
1876 2 54 ASP H 2 54 ASP HB3 . . 3.530 2.878 2.533 3.546 0.016 28 0 "[ . 1 . 2 . 3 ]" 1
1877 2 54 ASP HA 2 57 LYS H . . 3.480 3.231 2.647 3.499 0.019 23 0 "[ . 1 . 2 . 3 ]" 1
1878 2 54 ASP HA 2 57 LYS QB . . 3.070 2.380 2.048 3.117 0.047 5 0 "[ . 1 . 2 . 3 ]" 1
1879 2 54 ASP HA 2 57 LYS QE . . 4.640 3.348 1.742 4.416 . 0 0 "[ . 1 . 2 . 3 ]" 1
1880 2 54 ASP HA 2 58 SER H . . 4.550 4.126 3.563 4.583 0.033 25 0 "[ . 1 . 2 . 3 ]" 1
1881 2 54 ASP QB 2 57 LYS QB . . 5.340 4.242 3.875 4.578 . 0 0 "[ . 1 . 2 . 3 ]" 1
1882 2 54 ASP HB2 2 55 LEU H . . 3.880 3.730 3.028 3.923 0.043 30 0 "[ . 1 . 2 . 3 ]" 1
1883 2 54 ASP HB2 2 57 LYS QD . . 5.500 4.598 3.851 5.539 0.039 21 0 "[ . 1 . 2 . 3 ]" 1
1884 2 54 ASP HB3 2 55 LEU H . . 3.880 2.956 2.490 3.925 0.045 5 0 "[ . 1 . 2 . 3 ]" 1
1885 2 54 ASP HB3 2 57 LYS QD . . 5.500 4.982 3.817 5.583 0.083 23 0 "[ . 1 . 2 . 3 ]" 1
1886 2 55 LEU H 2 55 LEU QB . . 3.460 2.181 2.037 2.282 . 0 0 "[ . 1 . 2 . 3 ]" 1
1887 2 55 LEU H 2 55 LEU MD1 . . 4.670 4.193 3.944 4.423 . 0 0 "[ . 1 . 2 . 3 ]" 1
1888 2 55 LEU H 2 55 LEU QD . . 3.710 3.554 2.387 3.748 0.038 30 0 "[ . 1 . 2 . 3 ]" 1
1889 2 55 LEU H 2 55 LEU MD2 . . 4.670 3.930 2.407 4.340 . 0 0 "[ . 1 . 2 . 3 ]" 1
1890 2 55 LEU H 2 55 LEU HG . . 4.910 4.420 3.963 4.558 . 0 0 "[ . 1 . 2 . 3 ]" 1
1891 2 55 LEU H 2 56 MET H . . 4.210 2.816 2.672 2.981 . 0 0 "[ . 1 . 2 . 3 ]" 1
1892 2 55 LEU HA 2 55 LEU QD . . 3.890 2.392 1.935 3.198 . 0 0 "[ . 1 . 2 . 3 ]" 1
1893 2 55 LEU HA 2 59 LEU QD . . 5.440 3.890 2.643 4.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
1894 2 55 LEU QB 2 56 MET H . . 4.020 2.610 2.429 2.906 . 0 0 "[ . 1 . 2 . 3 ]" 1
1895 2 55 LEU HB2 2 56 MET H . . 5.500 3.771 2.907 4.083 . 0 0 "[ . 1 . 2 . 3 ]" 1
1896 2 55 LEU HB3 2 56 MET H . . 5.500 2.705 2.460 3.424 . 0 0 "[ . 1 . 2 . 3 ]" 1
1897 2 55 LEU QD 2 56 MET H . . 4.430 3.532 2.782 4.189 . 0 0 "[ . 1 . 2 . 3 ]" 1
1898 2 55 LEU QD 2 58 SER H . . 5.100 4.379 3.979 4.811 . 0 0 "[ . 1 . 2 . 3 ]" 1
1899 2 55 LEU QD 2 58 SER QB . . 4.510 3.232 2.285 4.257 . 0 0 "[ . 1 . 2 . 3 ]" 1
1900 2 55 LEU QD 2 59 LEU QD . . 4.790 2.142 1.822 3.298 . 0 0 "[ . 1 . 2 . 3 ]" 1
1901 2 55 LEU QD 2 59 LEU HG . . 5.440 3.137 2.118 4.449 . 0 0 "[ . 1 . 2 . 3 ]" 1
1902 2 55 LEU QD 2 75 PHE QD . . 4.750 2.398 2.067 3.022 . 0 0 "[ . 1 . 2 . 3 ]" 1
1903 2 55 LEU QD 2 75 PHE HZ . . 3.910 3.908 3.511 3.952 0.042 18 0 "[ . 1 . 2 . 3 ]" 1
1904 2 55 LEU QD 2 78 MET ME . . 4.200 2.605 1.908 3.617 . 0 0 "[ . 1 . 2 . 3 ]" 1
1905 2 55 LEU MD1 2 56 MET H . . 5.030 4.293 2.891 4.942 . 0 0 "[ . 1 . 2 . 3 ]" 1
1906 2 55 LEU MD1 2 75 PHE QD . . 5.500 2.707 2.127 3.990 . 0 0 "[ . 1 . 2 . 3 ]" 1
1907 2 55 LEU MD1 2 75 PHE QE . . 5.500 2.836 2.085 3.971 . 0 0 "[ . 1 . 2 . 3 ]" 1
1908 2 55 LEU MD1 2 78 MET ME . . 5.130 2.965 1.980 4.808 . 0 0 "[ . 1 . 2 . 3 ]" 1
1909 2 55 LEU MD2 2 56 MET H . . 5.030 4.063 2.810 4.886 . 0 0 "[ . 1 . 2 . 3 ]" 1
1910 2 55 LEU MD2 2 75 PHE QD . . 5.500 3.088 2.185 4.813 . 0 0 "[ . 1 . 2 . 3 ]" 1
1911 2 55 LEU MD2 2 75 PHE QE . . 5.500 2.954 2.094 4.215 . 0 0 "[ . 1 . 2 . 3 ]" 1
1912 2 55 LEU MD2 2 78 MET ME . . 5.130 3.622 2.057 4.920 . 0 0 "[ . 1 . 2 . 3 ]" 1
1913 2 55 LEU HG 2 56 MET H . . 5.400 4.450 3.358 5.371 . 0 0 "[ . 1 . 2 . 3 ]" 1
1914 2 55 LEU HG 2 59 LEU QD . . 5.440 3.297 2.168 4.553 . 0 0 "[ . 1 . 2 . 3 ]" 1
1915 2 55 LEU HG 2 75 PHE QD . . 5.500 4.176 3.145 5.500 0.000 13 0 "[ . 1 . 2 . 3 ]" 1
1916 2 56 MET H 2 56 MET QB . . 3.680 2.247 2.054 2.487 . 0 0 "[ . 1 . 2 . 3 ]" 1
1917 2 56 MET H 2 56 MET ME . . 5.500 5.155 4.363 5.561 0.061 10 0 "[ . 1 . 2 . 3 ]" 1
1918 2 56 MET H 2 56 MET QG . . 4.370 3.404 2.484 3.985 . 0 0 "[ . 1 . 2 . 3 ]" 1
1919 2 56 MET H 2 57 LYS H . . 4.380 2.901 2.686 3.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
1920 2 56 MET H 2 58 SER H . . 4.230 4.126 3.911 4.283 0.053 28 0 "[ . 1 . 2 . 3 ]" 1
1921 2 56 MET HA 2 56 MET ME . . 3.870 3.534 2.221 3.913 0.043 30 0 "[ . 1 . 2 . 3 ]" 1
1922 2 56 MET HA 2 59 LEU QD . . 4.610 2.865 2.272 3.752 . 0 0 "[ . 1 . 2 . 3 ]" 1
1923 2 56 MET HA 2 67 ILE MD . . 3.770 3.296 2.714 3.795 0.025 18 0 "[ . 1 . 2 . 3 ]" 1
1924 2 56 MET QB 2 56 MET ME . . 4.040 2.904 2.042 3.693 . 0 0 "[ . 1 . 2 . 3 ]" 1
1925 2 56 MET QB 2 57 LYS H . . 4.280 2.695 2.204 3.733 . 0 0 "[ . 1 . 2 . 3 ]" 1
1926 2 56 MET ME 2 65 GLN H . . 5.500 4.536 3.252 5.526 0.026 14 0 "[ . 1 . 2 . 3 ]" 1
1927 2 56 MET ME 2 65 GLN HA . . 5.500 3.125 2.095 5.042 . 0 0 "[ . 1 . 2 . 3 ]" 1
1928 2 56 MET ME 2 67 ILE H . . 5.500 4.197 3.058 5.433 . 0 0 "[ . 1 . 2 . 3 ]" 1
1929 2 56 MET ME 2 67 ILE MD . . 4.980 2.208 1.928 3.056 . 0 0 "[ . 1 . 2 . 3 ]" 1
1930 2 56 MET ME 2 67 ILE HG12 . . 5.500 3.029 2.043 4.598 . 0 0 "[ . 1 . 2 . 3 ]" 1
1931 2 56 MET ME 2 67 ILE QG . . 4.830 2.592 2.006 3.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
1932 2 56 MET ME 2 67 ILE HG13 . . 5.500 3.122 2.252 4.363 . 0 0 "[ . 1 . 2 . 3 ]" 1
1933 2 56 MET QG 2 57 LYS H . . 4.930 3.440 2.227 4.512 . 0 0 "[ . 1 . 2 . 3 ]" 1
1934 2 57 LYS H 2 57 LYS QB . . 3.340 2.158 1.985 2.701 . 0 0 "[ . 1 . 2 . 3 ]" 1
1935 2 57 LYS H 2 57 LYS QD . . 4.860 3.819 2.030 4.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
1936 2 57 LYS H 2 57 LYS QG . . 4.630 3.468 1.947 4.019 . 0 0 "[ . 1 . 2 . 3 ]" 1
1937 2 57 LYS HA 2 57 LYS QD . . 4.810 4.063 3.187 4.409 . 0 0 "[ . 1 . 2 . 3 ]" 1
1938 2 57 LYS HA 2 60 ASP H . . 4.740 3.634 3.059 4.126 . 0 0 "[ . 1 . 2 . 3 ]" 1
1939 2 57 LYS QB 2 58 SER H . . 3.400 2.859 2.438 3.236 . 0 0 "[ . 1 . 2 . 3 ]" 1
1940 2 57 LYS QB 2 58 SER QB . . 4.340 4.229 3.706 4.391 0.051 30 0 "[ . 1 . 2 . 3 ]" 1
1941 2 57 LYS QD 2 58 SER H . . 4.840 4.249 2.569 4.892 0.052 31 0 "[ . 1 . 2 . 3 ]" 1
1942 2 57 LYS QG 2 58 SER H . . 5.020 4.044 2.818 4.637 . 0 0 "[ . 1 . 2 . 3 ]" 1
1943 2 58 SER H 2 58 SER HB2 . . 3.420 2.391 2.142 3.511 0.091 28 0 "[ . 1 . 2 . 3 ]" 1
1944 2 58 SER H 2 58 SER HB3 . . 3.420 3.002 2.266 3.523 0.103 31 0 "[ . 1 . 2 . 3 ]" 1
1945 2 58 SER H 2 59 LEU H . . 3.760 2.567 2.241 2.891 . 0 0 "[ . 1 . 2 . 3 ]" 1
1946 2 58 SER H 2 60 ASP H . . 4.670 4.096 3.797 4.511 . 0 0 "[ . 1 . 2 . 3 ]" 1
1947 2 58 SER QB 2 78 MET ME . . 3.450 3.045 2.081 3.468 0.018 17 0 "[ . 1 . 2 . 3 ]" 1
1948 2 58 SER HB2 2 59 LEU H . . 4.050 3.510 2.661 4.101 0.051 26 0 "[ . 1 . 2 . 3 ]" 1
1949 2 58 SER HB3 2 59 LEU H . . 4.050 3.301 2.494 4.056 0.006 2 0 "[ . 1 . 2 . 3 ]" 1
1950 2 59 LEU H 2 59 LEU QB . . 3.680 2.355 1.958 2.730 . 0 0 "[ . 1 . 2 . 3 ]" 1
1951 2 59 LEU H 2 59 LEU MD1 . . 4.820 3.484 2.402 4.275 . 0 0 "[ . 1 . 2 . 3 ]" 1
1952 2 59 LEU H 2 59 LEU QD . . 4.110 2.853 2.383 3.343 . 0 0 "[ . 1 . 2 . 3 ]" 1
1953 2 59 LEU H 2 59 LEU MD2 . . 4.820 3.334 2.698 4.169 . 0 0 "[ . 1 . 2 . 3 ]" 1
1954 2 59 LEU H 2 59 LEU HG . . 4.170 3.032 2.096 4.227 0.057 26 0 "[ . 1 . 2 . 3 ]" 1
1955 2 59 LEU H 2 60 ASP H . . 4.050 2.531 2.293 2.793 . 0 0 "[ . 1 . 2 . 3 ]" 1
1956 2 59 LEU H 2 67 ILE MD . . 5.500 4.275 3.898 4.967 . 0 0 "[ . 1 . 2 . 3 ]" 1
1957 2 59 LEU HA 2 59 LEU QD . . 3.730 2.329 2.021 3.402 . 0 0 "[ . 1 . 2 . 3 ]" 1
1958 2 59 LEU HA 2 67 ILE MD . . 5.500 4.413 3.752 5.517 0.017 3 0 "[ . 1 . 2 . 3 ]" 1
1959 2 59 LEU QB 2 60 ASP H . . 3.810 2.597 2.168 3.699 . 0 0 "[ . 1 . 2 . 3 ]" 1
1960 2 59 LEU QB 2 67 ILE MD . . 4.450 2.287 1.878 4.354 . 0 0 "[ . 1 . 2 . 3 ]" 1
1961 2 59 LEU QB 2 67 ILE MG . . 5.260 3.067 2.117 4.209 . 0 0 "[ . 1 . 2 . 3 ]" 1
1962 2 59 LEU HB2 2 60 ASP H . . 4.600 2.725 2.202 4.204 . 0 0 "[ . 1 . 2 . 3 ]" 1
1963 2 59 LEU HB2 2 67 ILE MD . . 5.500 2.678 2.091 4.646 . 0 0 "[ . 1 . 2 . 3 ]" 1
1964 2 59 LEU HB3 2 60 ASP H . . 4.600 3.465 2.654 4.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
1965 2 59 LEU HB3 2 67 ILE MD . . 5.500 2.661 1.973 5.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
1966 2 59 LEU QD 2 60 ASP H . . 4.740 3.922 2.951 4.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
1967 2 59 LEU QD 2 67 ILE MD . . 5.440 2.657 1.915 4.033 . 0 0 "[ . 1 . 2 . 3 ]" 1
1968 2 59 LEU QD 2 67 ILE MG . . 5.440 2.776 1.970 3.645 . 0 0 "[ . 1 . 2 . 3 ]" 1
1969 2 59 LEU QD 2 72 TYR HA . . 5.440 2.932 1.945 4.134 . 0 0 "[ . 1 . 2 . 3 ]" 1
1970 2 59 LEU QD 2 75 PHE H . . 4.470 2.792 1.900 3.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
1971 2 59 LEU QD 2 75 PHE HA . . 4.690 2.528 2.053 3.741 . 0 0 "[ . 1 . 2 . 3 ]" 1
1972 2 59 LEU QD 2 75 PHE QB . . 4.290 1.911 1.810 2.123 . 0 0 "[ . 1 . 2 . 3 ]" 1
1973 2 59 LEU QD 2 75 PHE HZ . . 5.440 4.834 4.251 5.459 0.019 28 0 "[ . 1 . 2 . 3 ]" 1
1974 2 59 LEU QD 2 78 MET ME . . 5.440 2.608 1.948 4.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
1975 2 59 LEU MD1 2 60 ASP H . . 5.410 4.347 3.034 5.032 . 0 0 "[ . 1 . 2 . 3 ]" 1
1976 2 59 LEU MD1 2 75 PHE H . . 5.300 3.672 2.317 4.300 . 0 0 "[ . 1 . 2 . 3 ]" 1
1977 2 59 LEU MD1 2 75 PHE HA . . 5.500 3.509 2.171 4.699 . 0 0 "[ . 1 . 2 . 3 ]" 1
1978 2 59 LEU MD1 2 75 PHE HB2 . . 5.500 2.237 1.977 2.959 . 0 0 "[ . 1 . 2 . 3 ]" 1
1979 2 59 LEU MD1 2 75 PHE HB3 . . 5.500 3.429 2.925 4.193 . 0 0 "[ . 1 . 2 . 3 ]" 1
1980 2 59 LEU MD1 2 75 PHE QD . . 5.500 3.027 2.236 3.986 . 0 0 "[ . 1 . 2 . 3 ]" 1
1981 2 59 LEU MD1 2 75 PHE QE . . 5.500 4.262 3.203 5.474 . 0 0 "[ . 1 . 2 . 3 ]" 1
1982 2 59 LEU MD2 2 60 ASP H . . 5.410 4.498 4.002 4.968 . 0 0 "[ . 1 . 2 . 3 ]" 1
1983 2 59 LEU MD2 2 75 PHE H . . 5.300 3.110 1.904 4.545 . 0 0 "[ . 1 . 2 . 3 ]" 1
1984 2 59 LEU MD2 2 75 PHE HA . . 5.500 2.936 2.063 4.198 . 0 0 "[ . 1 . 2 . 3 ]" 1
1985 2 59 LEU MD2 2 75 PHE HB2 . . 5.500 2.168 2.035 2.329 . 0 0 "[ . 1 . 2 . 3 ]" 1
1986 2 59 LEU MD2 2 75 PHE HB3 . . 5.500 3.320 2.089 3.626 . 0 0 "[ . 1 . 2 . 3 ]" 1
1987 2 59 LEU MD2 2 75 PHE QD . . 5.500 2.786 2.111 3.898 . 0 0 "[ . 1 . 2 . 3 ]" 1
1988 2 59 LEU MD2 2 75 PHE QE . . 5.500 4.326 3.397 5.500 . 0 0 "[ . 1 . 2 . 3 ]" 1
1989 2 60 ASP H 2 60 ASP HB2 . . 3.860 2.443 2.126 2.951 . 0 0 "[ . 1 . 2 . 3 ]" 1
1990 2 60 ASP H 2 60 ASP QB . . 3.620 2.220 2.033 2.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
1991 2 60 ASP H 2 60 ASP HB3 . . 3.860 2.604 2.446 3.426 . 0 0 "[ . 1 . 2 . 3 ]" 1
1992 2 60 ASP H 2 67 ILE MD . . 4.630 3.129 2.497 3.640 . 0 0 "[ . 1 . 2 . 3 ]" 1
1993 2 60 ASP HA 2 62 ASN H . . 4.650 3.617 2.934 4.181 . 0 0 "[ . 1 . 2 . 3 ]" 1
1994 2 60 ASP HA 2 67 ILE MD . . 4.940 3.163 2.268 4.068 . 0 0 "[ . 1 . 2 . 3 ]" 1
1995 2 60 ASP QB 2 67 ILE MD . . 4.120 2.296 2.035 3.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
1996 2 60 ASP HB2 2 61 LYS H . . 4.740 4.467 3.959 4.678 . 0 0 "[ . 1 . 2 . 3 ]" 1
1997 2 60 ASP HB2 2 63 SER HA . . 5.500 4.863 3.497 5.508 0.008 16 0 "[ . 1 . 2 . 3 ]" 1
1998 2 60 ASP HB2 2 67 ILE MD . . 4.880 2.322 2.048 4.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
1999 2 60 ASP HB3 2 61 LYS H . . 4.740 4.257 3.242 4.540 . 0 0 "[ . 1 . 2 . 3 ]" 1
2000 2 60 ASP HB3 2 63 SER HA . . 5.500 3.595 2.505 4.572 . 0 0 "[ . 1 . 2 . 3 ]" 1
2001 2 60 ASP HB3 2 67 ILE MD . . 4.880 3.714 3.398 4.899 0.019 30 0 "[ . 1 . 2 . 3 ]" 1
2002 2 61 LYS H 2 61 LYS QB . . 3.480 2.345 1.990 2.724 . 0 0 "[ . 1 . 2 . 3 ]" 1
2003 2 61 LYS H 2 61 LYS QD . . 4.990 3.231 1.921 4.618 . 0 0 "[ . 1 . 2 . 3 ]" 1
2004 2 61 LYS H 2 61 LYS HG2 . . 4.660 3.806 2.067 4.670 0.010 2 0 "[ . 1 . 2 . 3 ]" 1
2005 2 61 LYS H 2 61 LYS QG . . 3.950 3.211 1.877 3.967 0.017 2 0 "[ . 1 . 2 . 3 ]" 1
2006 2 61 LYS H 2 61 LYS HG3 . . 4.660 3.703 1.892 4.471 . 0 0 "[ . 1 . 2 . 3 ]" 1
2007 2 61 LYS H 2 62 ASN H . . 3.720 2.678 1.849 3.173 . 0 0 "[ . 1 . 2 . 3 ]" 1
2008 2 61 LYS H 2 63 SER H . . 5.240 4.176 3.327 4.598 . 0 0 "[ . 1 . 2 . 3 ]" 1
2009 2 61 LYS H 2 71 GLU QG . . 4.810 3.091 1.816 4.809 . 0 0 "[ . 1 . 2 . 3 ]" 1
2010 2 61 LYS HA 2 61 LYS QD . . 3.970 3.194 2.049 4.059 0.089 28 0 "[ . 1 . 2 . 3 ]" 1
2011 2 61 LYS HA 2 61 LYS QE . . 4.870 3.866 1.969 4.917 0.047 24 0 "[ . 1 . 2 . 3 ]" 1
2012 2 61 LYS HA 2 61 LYS QG . . 3.670 2.560 2.274 3.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
2013 2 61 LYS QB 2 62 ASN H . . 3.670 3.136 2.576 3.724 0.054 12 0 "[ . 1 . 2 . 3 ]" 1
2014 2 61 LYS QB 2 63 SER H . . 5.500 4.903 4.504 5.384 . 0 0 "[ . 1 . 2 . 3 ]" 1
2015 2 61 LYS QD 2 62 ASN H . . 4.900 4.692 2.782 4.995 0.095 25 0 "[ . 1 . 2 . 3 ]" 1
2016 2 61 LYS QD 2 71 GLU QG . . 5.340 3.781 2.242 5.352 0.012 3 0 "[ . 1 . 2 . 3 ]" 1
2017 2 61 LYS QE 2 74 VAL MG1 . . 5.500 3.394 1.953 5.500 . 19 0 "[ . 1 . 2 . 3 ]" 1
2018 2 61 LYS QE 2 74 VAL MG2 . . 5.500 3.167 1.895 5.382 . 0 0 "[ . 1 . 2 . 3 ]" 1
2019 2 61 LYS QG 2 62 ASN H . . 5.060 4.521 3.090 5.056 . 0 0 "[ . 1 . 2 . 3 ]" 1
2020 2 62 ASN H 2 62 ASN QD . . 4.570 3.738 3.009 4.519 . 0 0 "[ . 1 . 2 . 3 ]" 1
2021 2 62 ASN H 2 63 SER H . . 3.660 2.359 1.925 2.670 . 0 0 "[ . 1 . 2 . 3 ]" 1
2022 2 62 ASN H 2 64 ASP H . . 5.240 4.127 3.544 5.273 0.033 30 0 "[ . 1 . 2 . 3 ]" 1
2023 2 62 ASN HA 2 62 ASN QD . . 4.440 3.679 2.168 4.435 . 0 0 "[ . 1 . 2 . 3 ]" 1
2024 2 63 SER H 2 63 SER QB . . 3.280 3.157 2.874 3.410 0.130 16 0 "[ . 1 . 2 . 3 ]" 1
2025 2 63 SER H 2 64 ASP H . . 4.250 2.757 1.991 3.407 . 0 0 "[ . 1 . 2 . 3 ]" 1
2026 2 63 SER HA 2 63 SER QB . . 2.450 2.373 2.274 2.475 0.025 25 0 "[ . 1 . 2 . 3 ]" 1
2027 2 63 SER QB 2 64 ASP H . . 3.940 3.926 3.783 4.003 0.063 5 0 "[ . 1 . 2 . 3 ]" 1
2028 2 64 ASP H 2 65 GLN H . . 3.880 2.495 2.082 3.888 0.008 30 0 "[ . 1 . 2 . 3 ]" 1
2029 2 64 ASP H 2 65 GLN HA . . 4.200 4.264 4.204 4.321 0.121 30 0 "[ . 1 . 2 . 3 ]" 1
2030 2 64 ASP H 2 66 GLU H . . 4.490 4.038 3.414 4.541 0.051 20 0 "[ . 1 . 2 . 3 ]" 1
2031 2 65 GLN H 2 65 GLN QB . . 3.220 3.246 2.994 3.398 0.178 5 0 "[ . 1 . 2 . 3 ]" 1
2032 2 65 GLN H 2 65 GLN QG . . 3.520 2.985 2.116 3.595 0.075 12 0 "[ . 1 . 2 . 3 ]" 1
2033 2 65 GLN H 2 66 GLU H . . 3.990 2.501 1.771 3.262 . 0 0 "[ . 1 . 2 . 3 ]" 1
2034 2 65 GLN HA 2 65 GLN QB . . 2.620 2.358 2.126 2.588 . 0 0 "[ . 1 . 2 . 3 ]" 1
2035 2 65 GLN HA 2 65 GLN QE . . 5.340 4.639 3.860 5.389 0.049 30 0 "[ . 1 . 2 . 3 ]" 1
2036 2 65 GLN HA 2 65 GLN HG2 . . 3.880 3.021 2.304 3.792 . 0 0 "[ . 1 . 2 . 3 ]" 1
2037 2 65 GLN HA 2 65 GLN QG . . 3.190 2.654 2.091 3.305 0.115 5 0 "[ . 1 . 2 . 3 ]" 1
2038 2 65 GLN HA 2 65 GLN HG3 . . 3.880 3.077 2.268 3.892 0.012 11 0 "[ . 1 . 2 . 3 ]" 1
2039 2 65 GLN QB 2 65 GLN QE . . 3.260 2.598 1.863 3.305 0.045 28 0 "[ . 1 . 2 . 3 ]" 1
2040 2 65 GLN QB 2 66 GLU H . . 3.840 3.586 2.691 3.925 0.085 20 0 "[ . 1 . 2 . 3 ]" 1
2041 2 65 GLN HB2 2 66 GLU H . . 4.450 3.955 2.753 4.472 0.022 28 0 "[ . 1 . 2 . 3 ]" 1
2042 2 65 GLN HB3 2 66 GLU H . . 4.450 4.194 3.049 4.459 0.009 1 0 "[ . 1 . 2 . 3 ]" 1
2043 2 66 GLU H 2 66 GLU HG2 . . 4.520 3.695 2.591 4.553 0.033 18 0 "[ . 1 . 2 . 3 ]" 1
2044 2 66 GLU H 2 66 GLU QG . . 4.200 3.231 2.541 4.024 . 0 0 "[ . 1 . 2 . 3 ]" 1
2045 2 66 GLU H 2 66 GLU HG3 . . 4.520 3.732 2.672 4.514 . 0 0 "[ . 1 . 2 . 3 ]" 1
2046 2 66 GLU HA 2 66 GLU HG2 . . 4.100 2.605 2.278 3.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
2047 2 66 GLU HA 2 66 GLU QG . . 3.330 2.478 2.215 2.945 . 0 0 "[ . 1 . 2 . 3 ]" 1
2048 2 66 GLU HA 2 66 GLU HG3 . . 4.100 3.457 2.339 3.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
2049 2 66 GLU QG 2 67 ILE H . . 5.320 4.037 2.210 4.724 . 0 0 "[ . 1 . 2 . 3 ]" 1
2050 2 67 ILE H 2 67 ILE MD . . 5.500 3.589 2.424 4.168 . 0 0 "[ . 1 . 2 . 3 ]" 1
2051 2 67 ILE H 2 67 ILE HG12 . . 5.500 3.210 2.160 4.333 . 0 0 "[ . 1 . 2 . 3 ]" 1
2052 2 67 ILE H 2 67 ILE HG13 . . 5.500 3.491 2.355 4.232 . 0 0 "[ . 1 . 2 . 3 ]" 1
2053 2 67 ILE HA 2 67 ILE MD . . 4.490 2.919 2.144 3.840 . 0 0 "[ . 1 . 2 . 3 ]" 1
2054 2 67 ILE MD 2 68 ASP H . . 5.210 4.553 3.726 5.298 0.088 31 0 "[ . 1 . 2 . 3 ]" 1
2055 2 67 ILE QG 2 68 ASP H . . 5.340 4.525 3.688 5.124 . 0 0 "[ . 1 . 2 . 3 ]" 1
2056 2 67 ILE MG 2 68 ASP H . . 4.990 3.267 2.917 3.798 . 0 0 "[ . 1 . 2 . 3 ]" 1
2057 2 67 ILE MG 2 69 PHE HA . . 5.500 4.283 3.434 4.736 . 0 0 "[ . 1 . 2 . 3 ]" 1
2058 2 67 ILE MG 2 71 GLU H . . 4.770 3.823 3.532 4.173 . 0 0 "[ . 1 . 2 . 3 ]" 1
2059 2 67 ILE MG 2 71 GLU QB . . 5.500 2.098 1.952 2.538 . 0 0 "[ . 1 . 2 . 3 ]" 1
2060 2 67 ILE MG 2 72 TYR H . . 4.790 2.372 2.067 2.882 . 0 0 "[ . 1 . 2 . 3 ]" 1
2061 2 67 ILE MG 2 72 TYR HA . . 5.120 2.594 2.242 3.078 . 0 0 "[ . 1 . 2 . 3 ]" 1
2062 2 67 ILE MG 2 72 TYR HB2 . . 5.500 2.114 2.002 2.415 . 0 0 "[ . 1 . 2 . 3 ]" 1
2063 2 67 ILE MG 2 72 TYR QB . . 5.060 2.093 1.979 2.389 . 0 0 "[ . 1 . 2 . 3 ]" 1
2064 2 67 ILE MG 2 72 TYR HB3 . . 5.500 3.376 2.952 3.790 . 0 0 "[ . 1 . 2 . 3 ]" 1
2065 2 67 ILE MG 2 72 TYR QD . . 5.500 2.839 2.148 3.428 . 0 0 "[ . 1 . 2 . 3 ]" 1
2066 2 68 ASP HA 2 70 LYS H . . 5.500 4.344 3.606 4.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
2067 2 68 ASP QB 2 70 LYS H . . 5.340 3.328 1.674 3.930 . 0 0 "[ . 1 . 2 . 3 ]" 1
2068 2 68 ASP HB2 2 69 PHE H . . 4.540 3.548 2.397 4.279 . 0 0 "[ . 1 . 2 . 3 ]" 1
2069 2 68 ASP HB3 2 69 PHE H . . 4.540 3.705 2.521 4.150 . 0 0 "[ . 1 . 2 . 3 ]" 1
2070 2 69 PHE H 2 69 PHE QD . . 5.500 3.713 2.004 4.161 . 0 0 "[ . 1 . 2 . 3 ]" 1
2071 2 69 PHE H 2 70 LYS H . . 4.510 2.919 2.707 3.137 . 0 0 "[ . 1 . 2 . 3 ]" 1
2072 2 69 PHE HA 2 72 TYR H . . 4.640 3.502 3.113 3.988 . 0 0 "[ . 1 . 2 . 3 ]" 1
2073 2 69 PHE HA 2 72 TYR QB . . 4.260 2.259 1.998 2.808 . 0 0 "[ . 1 . 2 . 3 ]" 1
2074 2 69 PHE HA 2 72 TYR QD . . 5.430 3.292 2.345 4.138 . 0 0 "[ . 1 . 2 . 3 ]" 1
2075 2 69 PHE HB2 2 70 LYS H . . 4.490 3.562 2.562 4.051 . 0 0 "[ . 1 . 2 . 3 ]" 1
2076 2 69 PHE HB3 2 70 LYS H . . 4.490 2.999 2.418 3.454 . 0 0 "[ . 1 . 2 . 3 ]" 1
2077 2 69 PHE QD 2 70 LYS H . . 5.490 4.422 3.642 4.787 . 0 0 "[ . 1 . 2 . 3 ]" 1
2078 2 69 PHE QD 2 70 LYS HA . . 5.500 4.459 3.176 5.579 0.079 21 0 "[ . 1 . 2 . 3 ]" 1
2079 2 69 PHE QD 2 72 TYR QD . . 5.500 3.390 2.498 4.632 . 0 0 "[ . 1 . 2 . 3 ]" 1
2080 2 69 PHE QD 2 72 TYR QE . . 5.500 4.900 3.948 5.518 0.018 10 0 "[ . 1 . 2 . 3 ]" 1
2081 2 69 PHE QE 2 72 TYR QE . . 5.500 4.028 2.779 5.396 . 0 0 "[ . 1 . 2 . 3 ]" 1
2082 2 70 LYS H 2 70 LYS QB . . 3.400 2.373 2.021 2.659 . 0 0 "[ . 1 . 2 . 3 ]" 1
2083 2 70 LYS H 2 70 LYS QD . . 5.140 3.460 1.770 4.660 . 0 0 "[ . 1 . 2 . 3 ]" 1
2084 2 70 LYS H 2 70 LYS QE . . 5.110 3.632 1.901 4.783 . 0 0 "[ . 1 . 2 . 3 ]" 1
2085 2 70 LYS H 2 70 LYS QG . . 4.410 3.196 1.923 4.082 . 0 0 "[ . 1 . 2 . 3 ]" 1
2086 2 70 LYS H 2 71 GLU H . . 4.120 2.570 2.328 2.977 . 0 0 "[ . 1 . 2 . 3 ]" 1
2087 2 70 LYS QB 2 71 GLU H . . 5.070 3.046 2.509 4.004 . 0 0 "[ . 1 . 2 . 3 ]" 1
2088 2 70 LYS QE 2 71 GLU H . . 5.500 4.850 4.186 5.555 0.055 26 0 "[ . 1 . 2 . 3 ]" 1
2089 2 70 LYS QG 2 71 GLU H . . 5.500 4.296 3.089 4.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
2090 2 71 GLU H 2 71 GLU HG2 . . 5.500 3.771 3.056 4.210 . 0 0 "[ . 1 . 2 . 3 ]" 1
2091 2 71 GLU H 2 71 GLU QG . . 4.780 2.623 2.153 3.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
2092 2 71 GLU H 2 71 GLU HG3 . . 5.500 2.678 2.184 3.122 . 0 0 "[ . 1 . 2 . 3 ]" 1
2093 2 71 GLU H 2 72 TYR H . . 4.790 2.443 2.083 2.820 . 0 0 "[ . 1 . 2 . 3 ]" 1
2094 2 71 GLU HA 2 74 VAL H . . 5.500 4.005 3.439 4.602 . 0 0 "[ . 1 . 2 . 3 ]" 1
2095 2 71 GLU HA 2 74 VAL MG1 . . 5.500 4.714 2.144 5.527 0.027 26 0 "[ . 1 . 2 . 3 ]" 1
2096 2 71 GLU HA 2 74 VAL QG . . 4.530 3.190 2.141 4.223 . 0 0 "[ . 1 . 2 . 3 ]" 1
2097 2 71 GLU HA 2 74 VAL MG2 . . 5.500 3.672 2.474 5.547 0.047 20 0 "[ . 1 . 2 . 3 ]" 1
2098 2 71 GLU QG 2 72 TYR H . . 5.500 4.099 3.742 4.386 . 0 0 "[ . 1 . 2 . 3 ]" 1
2099 2 72 TYR H 2 72 TYR QD . . 5.500 4.111 3.945 4.193 . 0 0 "[ . 1 . 2 . 3 ]" 1
2100 2 72 TYR H 2 73 SER H . . 4.450 3.043 2.801 3.213 . 0 0 "[ . 1 . 2 . 3 ]" 1
2101 2 72 TYR HA 2 75 PHE H . . 5.500 3.366 3.032 3.817 . 0 0 "[ . 1 . 2 . 3 ]" 1
2102 2 72 TYR HA 2 75 PHE QD . . 5.500 4.624 3.308 5.219 . 0 0 "[ . 1 . 2 . 3 ]" 1
2103 2 72 TYR QB 2 73 SER H . . 4.650 2.799 2.392 3.065 . 0 0 "[ . 1 . 2 . 3 ]" 1
2104 2 72 TYR QE 2 75 PHE QD . . 5.500 2.826 2.176 4.139 . 0 0 "[ . 1 . 2 . 3 ]" 1
2105 2 72 TYR HH 2 76 LEU QD . . 5.440 3.092 2.362 4.121 . 0 0 "[ . 1 . 2 . 3 ]" 1
2106 2 73 SER H 2 73 SER HB2 . . 3.990 3.042 2.166 3.672 . 0 0 "[ . 1 . 2 . 3 ]" 1
2107 2 73 SER H 2 73 SER HB3 . . 3.990 2.799 2.363 3.641 . 0 0 "[ . 1 . 2 . 3 ]" 1
2108 2 73 SER H 2 74 VAL H . . 4.460 2.876 2.645 3.150 . 0 0 "[ . 1 . 2 . 3 ]" 1
2109 2 73 SER H 2 74 VAL QG . . 4.330 4.236 3.979 4.384 0.054 17 0 "[ . 1 . 2 . 3 ]" 1
2110 2 73 SER HA 2 76 LEU H . . 5.500 3.362 2.805 4.644 . 0 0 "[ . 1 . 2 . 3 ]" 1
2111 2 73 SER HA 2 76 LEU QB . . 5.340 2.805 2.341 4.086 . 0 0 "[ . 1 . 2 . 3 ]" 1
2112 2 73 SER HA 2 76 LEU QD . . 5.440 2.647 2.199 4.416 . 0 0 "[ . 1 . 2 . 3 ]" 1
2113 2 73 SER HA 2 76 LEU HG . . 5.500 3.322 2.348 5.508 0.008 17 0 "[ . 1 . 2 . 3 ]" 1
2114 2 73 SER QB 2 74 VAL H . . 4.360 3.341 2.759 3.865 . 0 0 "[ . 1 . 2 . 3 ]" 1
2115 2 74 VAL H 2 74 VAL HB . . 3.920 2.544 2.274 3.754 . 0 0 "[ . 1 . 2 . 3 ]" 1
2116 2 74 VAL H 2 74 VAL MG1 . . 4.650 3.418 2.249 3.875 . 0 0 "[ . 1 . 2 . 3 ]" 1
2117 2 74 VAL H 2 74 VAL QG . . 3.770 2.260 2.082 2.497 . 0 0 "[ . 1 . 2 . 3 ]" 1
2118 2 74 VAL H 2 74 VAL MG2 . . 4.650 2.637 2.108 3.845 . 0 0 "[ . 1 . 2 . 3 ]" 1
2119 2 74 VAL H 2 76 LEU H . . 5.230 4.397 4.048 4.739 . 0 0 "[ . 1 . 2 . 3 ]" 1
2120 2 74 VAL HA 2 77 THR H . . 4.080 3.415 3.067 3.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
2121 2 74 VAL HA 2 77 THR HB . . 3.980 2.515 2.073 3.020 . 0 0 "[ . 1 . 2 . 3 ]" 1
2122 2 74 VAL HA 2 77 THR HG1 . . 5.500 2.998 2.298 4.926 . 0 0 "[ . 1 . 2 . 3 ]" 1
2123 2 74 VAL HA 2 77 THR MG . . 4.380 3.825 3.390 4.382 0.002 27 0 "[ . 1 . 2 . 3 ]" 1
2124 2 74 VAL HB 2 75 PHE H . . 4.140 3.190 2.514 4.180 0.040 15 0 "[ . 1 . 2 . 3 ]" 1
2125 2 74 VAL QG 2 75 PHE H . . 4.060 3.100 2.230 3.600 . 0 0 "[ . 1 . 2 . 3 ]" 1
2126 2 74 VAL QG 2 75 PHE HA . . 5.440 3.597 3.135 4.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
2127 2 74 VAL QG 2 77 THR HB . . 5.440 3.398 2.871 3.888 . 0 0 "[ . 1 . 2 . 3 ]" 1
2128 2 74 VAL QG 2 77 THR HG1 . . 5.440 4.183 3.609 5.447 0.007 31 0 "[ . 1 . 2 . 3 ]" 1
2129 2 74 VAL QG 2 78 MET H . . 5.400 3.905 3.598 4.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
2130 2 74 VAL QG 2 78 MET ME . . 4.630 2.687 1.995 4.235 . 0 0 "[ . 1 . 2 . 3 ]" 1
2131 2 74 VAL QG 2 78 MET QG . . 4.850 3.127 2.541 4.774 . 0 0 "[ . 1 . 2 . 3 ]" 1
2132 2 74 VAL MG1 2 75 PHE H . . 4.950 3.339 2.241 4.067 . 0 0 "[ . 1 . 2 . 3 ]" 1
2133 2 74 VAL MG2 2 75 PHE H . . 4.950 3.994 2.712 4.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
2134 2 75 PHE H 2 75 PHE QD . . 5.200 4.199 4.053 4.259 . 0 0 "[ . 1 . 2 . 3 ]" 1
2135 2 75 PHE H 2 76 LEU H . . 4.270 2.745 2.562 3.079 . 0 0 "[ . 1 . 2 . 3 ]" 1
2136 2 75 PHE HA 2 75 PHE QE . . 5.500 4.617 4.414 4.880 . 0 0 "[ . 1 . 2 . 3 ]" 1
2137 2 75 PHE HA 2 78 MET H . . 5.430 3.641 3.195 4.040 . 0 0 "[ . 1 . 2 . 3 ]" 1
2138 2 75 PHE QB 2 76 LEU H . . 3.710 2.279 2.035 2.544 . 0 0 "[ . 1 . 2 . 3 ]" 1
2139 2 75 PHE HB2 2 76 LEU H . . 4.240 3.705 3.556 3.961 . 0 0 "[ . 1 . 2 . 3 ]" 1
2140 2 75 PHE HB3 2 76 LEU H . . 4.240 2.300 2.047 2.576 . 0 0 "[ . 1 . 2 . 3 ]" 1
2141 2 75 PHE QD 2 76 LEU H . . 5.050 3.618 3.084 4.032 . 0 0 "[ . 1 . 2 . 3 ]" 1
2142 2 75 PHE QD 2 76 LEU QD . . 5.440 2.869 2.211 3.982 . 0 0 "[ . 1 . 2 . 3 ]" 1
2143 2 75 PHE QD 2 78 MET H . . 5.500 5.267 4.793 5.533 0.033 30 0 "[ . 1 . 2 . 3 ]" 1
2144 2 75 PHE QD 2 78 MET QB . . 5.340 4.000 3.160 5.317 . 0 0 "[ . 1 . 2 . 3 ]" 1
2145 2 75 PHE QD 2 78 MET ME . . 5.230 3.357 2.457 4.300 . 0 0 "[ . 1 . 2 . 3 ]" 1
2146 2 75 PHE QD 2 78 MET QG . . 5.340 4.930 2.879 5.372 0.032 27 0 "[ . 1 . 2 . 3 ]" 1
2147 2 75 PHE QD 2 79 LEU QD . . 3.150 3.091 2.639 3.188 0.038 7 0 "[ . 1 . 2 . 3 ]" 1
2148 2 75 PHE QE 2 76 LEU QD . . 5.440 3.658 2.900 4.437 . 0 0 "[ . 1 . 2 . 3 ]" 1
2149 2 75 PHE QE 2 78 MET ME . . 5.500 4.897 3.571 5.507 0.007 15 0 "[ . 1 . 2 . 3 ]" 1
2150 2 75 PHE QE 2 79 LEU MD1 . . 5.500 3.130 2.429 4.930 . 0 0 "[ . 1 . 2 . 3 ]" 1
2151 2 75 PHE QE 2 79 LEU MD2 . . 5.500 2.921 2.164 3.736 . 0 0 "[ . 1 . 2 . 3 ]" 1
2152 2 75 PHE HZ 2 76 LEU QD . . 5.440 5.088 3.984 5.453 0.013 27 0 "[ . 1 . 2 . 3 ]" 1
2153 2 75 PHE HZ 2 79 LEU QD . . 3.220 2.912 2.455 3.253 0.033 15 0 "[ . 1 . 2 . 3 ]" 1
2154 2 76 LEU H 2 76 LEU MD1 . . 4.630 3.557 3.055 3.761 . 0 0 "[ . 1 . 2 . 3 ]" 1
2155 2 76 LEU H 2 76 LEU MD2 . . 4.630 2.995 1.875 3.517 . 0 0 "[ . 1 . 2 . 3 ]" 1
2156 2 76 LEU H 2 76 LEU HG . . 4.000 2.279 1.916 3.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
2157 2 76 LEU HA 2 76 LEU MD1 . . 4.790 3.719 2.183 3.950 . 0 0 "[ . 1 . 2 . 3 ]" 1
2158 2 76 LEU HA 2 76 LEU QD . . 3.960 2.171 2.096 2.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
2159 2 76 LEU HA 2 76 LEU MD2 . . 4.790 2.274 2.105 3.344 . 0 0 "[ . 1 . 2 . 3 ]" 1
2160 2 76 LEU HA 2 79 LEU H . . 5.500 3.606 3.207 3.906 . 0 0 "[ . 1 . 2 . 3 ]" 1
2161 2 76 LEU HA 2 79 LEU QD . . 5.000 3.011 2.228 4.580 . 0 0 "[ . 1 . 2 . 3 ]" 1
2162 2 76 LEU QB 2 77 THR H . . 4.360 2.610 2.382 3.034 . 0 0 "[ . 1 . 2 . 3 ]" 1
2163 2 76 LEU QD 2 77 THR H . . 4.730 4.088 3.554 4.336 . 0 0 "[ . 1 . 2 . 3 ]" 1
2164 2 76 LEU QD 2 79 LEU H . . 5.440 4.936 4.530 5.278 . 0 0 "[ . 1 . 2 . 3 ]" 1
2165 2 76 LEU QD 2 79 LEU QD . . 5.370 3.032 2.080 4.655 . 0 0 "[ . 1 . 2 . 3 ]" 1
2166 2 76 LEU QD 2 79 LEU HG . . 5.440 4.476 3.466 5.383 . 0 0 "[ . 1 . 2 . 3 ]" 1
2167 2 76 LEU MD1 2 77 THR H . . 5.500 4.585 4.318 4.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
2168 2 76 LEU MD2 2 77 THR H . . 5.500 4.630 3.696 4.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
2169 2 76 LEU HG 2 77 THR H . . 4.810 4.388 4.003 4.882 0.072 18 0 "[ . 1 . 2 . 3 ]" 1
2170 2 77 THR H 2 77 THR HB . . 3.910 2.583 2.268 2.720 . 0 0 "[ . 1 . 2 . 3 ]" 1
2171 2 77 THR H 2 77 THR HG1 . . 4.670 2.287 1.977 3.695 . 0 0 "[ . 1 . 2 . 3 ]" 1
2172 2 77 THR H 2 77 THR MG . . 4.150 3.786 3.711 3.849 . 0 0 "[ . 1 . 2 . 3 ]" 1
2173 2 77 THR HA 2 80 CYS H . . 4.380 3.655 3.380 3.903 . 0 0 "[ . 1 . 2 . 3 ]" 1
2174 2 77 THR HA 2 80 CYS HB2 . . 4.590 3.312 2.546 4.611 0.021 29 0 "[ . 1 . 2 . 3 ]" 1
2175 2 77 THR HA 2 80 CYS QB . . 3.770 2.889 2.524 3.404 . 0 0 "[ . 1 . 2 . 3 ]" 1
2176 2 77 THR HA 2 80 CYS HB3 . . 4.590 3.827 2.681 4.614 0.024 8 0 "[ . 1 . 2 . 3 ]" 1
2177 2 77 THR HB 2 78 MET H . . 4.290 2.523 2.303 2.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
2178 2 77 THR HG1 2 78 MET H . . 5.110 4.209 3.916 5.075 . 0 0 "[ . 1 . 2 . 3 ]" 1
2179 2 77 THR MG 2 78 MET H . . 4.870 3.385 3.174 3.655 . 0 0 "[ . 1 . 2 . 3 ]" 1
2180 2 77 THR MG 2 80 CYS H . . 4.990 4.982 4.828 5.030 0.040 27 0 "[ . 1 . 2 . 3 ]" 1
2181 2 77 THR MG 2 80 CYS HB2 . . 5.500 4.749 3.752 5.518 0.018 29 0 "[ . 1 . 2 . 3 ]" 1
2182 2 77 THR MG 2 80 CYS HB3 . . 5.500 4.871 4.079 5.516 0.016 20 0 "[ . 1 . 2 . 3 ]" 1
2183 2 77 THR MG 2 81 MET H . . 5.470 4.176 3.979 4.503 . 0 0 "[ . 1 . 2 . 3 ]" 1
2184 2 77 THR MG 2 81 MET ME . . 5.330 3.810 2.013 5.305 . 0 0 "[ . 1 . 2 . 3 ]" 1
2185 2 77 THR MG 2 81 MET HG2 . . 5.500 3.954 2.723 5.436 . 0 0 "[ . 1 . 2 . 3 ]" 1
2186 2 77 THR MG 2 81 MET HG3 . . 5.500 2.972 2.326 4.729 . 0 0 "[ . 1 . 2 . 3 ]" 1
2187 2 78 MET H 2 78 MET HB2 . . 4.080 2.612 2.286 3.685 . 0 0 "[ . 1 . 2 . 3 ]" 1
2188 2 78 MET H 2 78 MET QB . . 3.570 2.414 2.129 2.626 . 0 0 "[ . 1 . 2 . 3 ]" 1
2189 2 78 MET H 2 78 MET HB3 . . 4.080 3.373 2.364 3.649 . 0 0 "[ . 1 . 2 . 3 ]" 1
2190 2 78 MET H 2 78 MET ME . . 4.580 3.814 3.283 4.618 0.038 4 0 "[ . 1 . 2 . 3 ]" 1
2191 2 78 MET H 2 78 MET HG2 . . 4.620 3.386 2.168 4.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
2192 2 78 MET H 2 78 MET QG . . 3.920 2.518 2.141 3.939 0.019 26 0 "[ . 1 . 2 . 3 ]" 1
2193 2 78 MET H 2 78 MET HG3 . . 4.620 2.792 2.217 4.458 . 0 0 "[ . 1 . 2 . 3 ]" 1
2194 2 78 MET HA 2 78 MET ME . . 5.500 4.496 4.040 4.740 . 0 0 "[ . 1 . 2 . 3 ]" 1
2195 2 78 MET QB 2 79 LEU H . . 4.300 2.728 2.440 3.609 . 0 0 "[ . 1 . 2 . 3 ]" 1
2196 2 78 MET QB 2 82 ALA MB . . 5.340 4.517 3.984 5.350 0.010 30 0 "[ . 1 . 2 . 3 ]" 1
2197 2 78 MET HB2 2 79 LEU H . . 4.950 2.967 2.496 4.003 . 0 0 "[ . 1 . 2 . 3 ]" 1
2198 2 78 MET HB3 2 79 LEU H . . 4.950 3.535 2.534 4.146 . 0 0 "[ . 1 . 2 . 3 ]" 1
2199 2 78 MET QG 2 79 LEU H . . 4.770 3.939 2.346 4.555 . 0 0 "[ . 1 . 2 . 3 ]" 1
2200 2 79 LEU H 2 79 LEU MD1 . . 4.960 3.692 3.196 4.299 . 0 0 "[ . 1 . 2 . 3 ]" 1
2201 2 79 LEU H 2 79 LEU MD2 . . 4.960 3.331 2.311 3.614 . 0 0 "[ . 1 . 2 . 3 ]" 1
2202 2 79 LEU H 2 79 LEU HG . . 4.580 2.769 2.169 4.485 . 0 0 "[ . 1 . 2 . 3 ]" 1
2203 2 79 LEU H 2 80 CYS H . . 4.410 2.801 2.684 2.926 . 0 0 "[ . 1 . 2 . 3 ]" 1
2204 2 79 LEU H 2 80 CYS QB . . 5.010 4.617 4.403 4.899 . 0 0 "[ . 1 . 2 . 3 ]" 1
2205 2 79 LEU HA 2 79 LEU QD . . 4.240 2.102 1.929 2.219 . 0 0 "[ . 1 . 2 . 3 ]" 1
2206 2 79 LEU HA 2 82 ALA MB . . 4.500 2.710 2.398 3.095 . 0 0 "[ . 1 . 2 . 3 ]" 1
2207 2 79 LEU QB 2 82 ALA MB . . 5.100 4.258 3.954 4.655 . 0 0 "[ . 1 . 2 . 3 ]" 1
2208 2 79 LEU HB2 2 80 CYS H . . 4.410 2.654 2.367 3.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
2209 2 79 LEU HB3 2 80 CYS H . . 4.410 3.348 2.527 3.673 . 0 0 "[ . 1 . 2 . 3 ]" 1
2210 2 79 LEU QD 2 81 MET H . . 5.440 5.358 4.826 5.465 0.025 17 0 "[ . 1 . 2 . 3 ]" 1
2211 2 79 LEU QD 2 82 ALA MB . . 5.440 3.385 2.764 4.006 . 0 0 "[ . 1 . 2 . 3 ]" 1
2212 2 79 LEU MD1 2 80 CYS H . . 5.500 4.416 3.898 4.616 . 0 0 "[ . 1 . 2 . 3 ]" 1
2213 2 79 LEU MD1 2 83 TYR QE . . 5.500 4.026 2.399 5.499 . 0 0 "[ . 1 . 2 . 3 ]" 1
2214 2 79 LEU MD2 2 80 CYS H . . 5.500 4.714 4.224 4.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
2215 2 79 LEU MD2 2 83 TYR QE . . 5.500 4.082 2.613 5.513 0.013 22 0 "[ . 1 . 2 . 3 ]" 1
2216 2 79 LEU HG 2 80 CYS H . . 4.790 4.559 4.188 4.859 0.069 16 0 "[ . 1 . 2 . 3 ]" 1
2217 2 80 CYS H 2 80 CYS HG . . 4.700 3.724 2.104 4.704 0.004 13 0 "[ . 1 . 2 . 3 ]" 1
2218 2 80 CYS H 2 81 MET H . . 4.080 2.812 2.619 2.929 . 0 0 "[ . 1 . 2 . 3 ]" 1
2219 2 80 CYS HA 2 82 ALA H . . 4.320 4.336 4.233 4.366 0.046 1 0 "[ . 1 . 2 . 3 ]" 1
2220 2 80 CYS HA 2 83 TYR H . . 4.150 3.320 3.036 3.612 . 0 0 "[ . 1 . 2 . 3 ]" 1
2221 2 80 CYS QB 2 81 MET H . . 3.810 2.907 2.649 3.622 . 0 0 "[ . 1 . 2 . 3 ]" 1
2222 2 80 CYS HB2 2 81 MET H . . 4.460 3.439 2.744 4.147 . 0 0 "[ . 1 . 2 . 3 ]" 1
2223 2 80 CYS HB3 2 81 MET H . . 4.460 3.435 2.756 3.995 . 0 0 "[ . 1 . 2 . 3 ]" 1
2224 2 81 MET H 2 81 MET QB . . 3.690 2.378 2.206 2.512 . 0 0 "[ . 1 . 2 . 3 ]" 1
2225 2 81 MET H 2 81 MET ME . . 5.500 4.551 2.991 5.034 . 0 0 "[ . 1 . 2 . 3 ]" 1
2226 2 81 MET H 2 81 MET HG2 . . 4.610 3.478 2.370 4.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
2227 2 81 MET H 2 81 MET QG . . 4.010 2.543 2.346 3.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
2228 2 81 MET H 2 81 MET HG3 . . 4.610 2.752 2.435 3.781 . 0 0 "[ . 1 . 2 . 3 ]" 1
2229 2 81 MET H 2 82 ALA H . . 4.210 2.706 2.571 2.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
2230 2 81 MET H 2 82 ALA MB . . 5.300 4.394 4.285 4.514 . 0 0 "[ . 1 . 2 . 3 ]" 1
2231 2 81 MET HA 2 81 MET ME . . 4.140 3.586 2.069 4.211 0.071 31 0 "[ . 1 . 2 . 3 ]" 1
2232 2 81 MET HA 2 84 ASN H . . 4.320 3.331 2.896 3.827 . 0 0 "[ . 1 . 2 . 3 ]" 1
2233 2 81 MET HA 2 84 ASN QB . . 5.190 2.693 2.269 3.174 . 0 0 "[ . 1 . 2 . 3 ]" 1
2234 2 81 MET HB2 2 82 ALA H . . 4.320 2.923 2.681 3.195 . 0 0 "[ . 1 . 2 . 3 ]" 1
2235 2 81 MET HB3 2 82 ALA H . . 4.320 3.695 3.320 3.948 . 0 0 "[ . 1 . 2 . 3 ]" 1
2236 2 81 MET QG 2 82 ALA H . . 4.660 4.335 4.227 4.612 . 0 0 "[ . 1 . 2 . 3 ]" 1
2237 2 81 MET HG2 2 82 ALA H . . 5.410 5.067 4.520 5.383 . 0 0 "[ . 1 . 2 . 3 ]" 1
2238 2 81 MET HG3 2 82 ALA H . . 5.410 4.735 4.530 5.143 . 0 0 "[ . 1 . 2 . 3 ]" 1
2239 2 82 ALA H 2 82 ALA MB . . 3.600 2.243 2.221 2.270 . 0 0 "[ . 1 . 2 . 3 ]" 1
2240 2 82 ALA H 2 83 TYR H . . 4.100 2.703 2.497 2.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
2241 2 82 ALA HA 2 85 ASP H . . 4.210 3.476 3.277 3.727 . 0 0 "[ . 1 . 2 . 3 ]" 1
2242 2 82 ALA HA 2 85 ASP HB2 . . 4.070 3.254 2.473 4.083 0.013 13 0 "[ . 1 . 2 . 3 ]" 1
2243 2 82 ALA HA 2 85 ASP HB3 . . 4.070 3.740 2.908 4.149 0.079 8 0 "[ . 1 . 2 . 3 ]" 1
2244 2 82 ALA MB 2 83 TYR H . . 4.280 2.634 2.376 2.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
2245 2 82 ALA MB 2 83 TYR QB . . 5.340 4.219 3.889 4.509 . 0 0 "[ . 1 . 2 . 3 ]" 1
2246 2 82 ALA MB 2 83 TYR QD . . 5.500 3.568 2.440 4.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
2247 2 82 ALA MB 2 84 ASN H . . 5.030 4.522 4.277 4.686 . 0 0 "[ . 1 . 2 . 3 ]" 1
2248 2 82 ALA MB 2 85 ASP H . . 5.500 4.713 4.411 4.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
2249 2 82 ALA MB 2 85 ASP QB . . 5.340 4.134 3.853 4.713 . 0 0 "[ . 1 . 2 . 3 ]" 1
2250 2 82 ALA MB 2 86 PHE QD . . 5.500 4.109 3.936 4.341 . 0 0 "[ . 1 . 2 . 3 ]" 1
2251 2 82 ALA MB 2 86 PHE QE . . 5.500 5.496 5.082 5.534 0.034 13 0 "[ . 1 . 2 . 3 ]" 1
2252 2 83 TYR H 2 83 TYR QB . . 3.610 2.215 2.014 2.433 . 0 0 "[ . 1 . 2 . 3 ]" 1
2253 2 83 TYR H 2 83 TYR QD . . 4.820 2.857 2.229 3.583 . 0 0 "[ . 1 . 2 . 3 ]" 1
2254 2 83 TYR H 2 83 TYR QE . . 5.500 4.929 4.544 5.538 0.038 27 0 "[ . 1 . 2 . 3 ]" 1
2255 2 83 TYR HA 2 83 TYR QE . . 5.500 4.431 4.135 4.643 . 0 0 "[ . 1 . 2 . 3 ]" 1
2256 2 83 TYR HA 2 86 PHE QB . . 3.780 2.209 2.045 2.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
2257 2 83 TYR HA 2 86 PHE QD . . 5.330 3.441 2.482 3.867 . 0 0 "[ . 1 . 2 . 3 ]" 1
2258 2 83 TYR HA 2 86 PHE QE . . 5.500 5.439 4.641 5.527 0.027 9 0 "[ . 1 . 2 . 3 ]" 1
2259 2 83 TYR QB 2 84 ASN H . . 3.870 3.061 2.831 3.306 . 0 0 "[ . 1 . 2 . 3 ]" 1
2260 2 83 TYR QB 2 86 PHE QD . . 5.340 5.088 4.054 5.349 0.009 17 0 "[ . 1 . 2 . 3 ]" 1
2261 2 83 TYR HB2 2 84 ASN H . . 4.630 3.279 2.923 3.857 . 0 0 "[ . 1 . 2 . 3 ]" 1
2262 2 83 TYR HB3 2 84 ASN H . . 4.630 3.710 3.424 4.114 . 0 0 "[ . 1 . 2 . 3 ]" 1
2263 2 83 TYR QD 2 84 ASN H . . 5.500 4.770 4.542 4.945 . 0 0 "[ . 1 . 2 . 3 ]" 1
2264 2 84 ASN H 2 84 ASN QD . . 5.340 4.362 4.003 4.684 . 0 0 "[ . 1 . 2 . 3 ]" 1
2265 2 84 ASN H 2 85 ASP H . . 4.080 2.690 2.429 2.950 . 0 0 "[ . 1 . 2 . 3 ]" 1
2266 2 84 ASN H 2 86 PHE H . . 4.800 4.099 3.725 4.420 . 0 0 "[ . 1 . 2 . 3 ]" 1
2267 2 84 ASN HA 2 87 PHE QD . . 5.500 4.468 3.766 4.967 . 0 0 "[ . 1 . 2 . 3 ]" 1
2268 2 84 ASN QB 2 85 ASP H . . 3.910 2.517 2.234 2.743 . 0 0 "[ . 1 . 2 . 3 ]" 1
2269 2 84 ASN QB 2 88 LEU QD . . 4.070 4.036 3.358 4.093 0.023 26 0 "[ . 1 . 2 . 3 ]" 1
2270 2 84 ASN HB2 2 85 ASP H . . 4.560 3.797 3.519 3.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
2271 2 84 ASN HB3 2 85 ASP H . . 4.560 2.557 2.255 2.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
2272 2 84 ASN QD 2 88 LEU QD . . 4.840 2.854 1.777 4.545 . 0 0 "[ . 1 . 2 . 3 ]" 1
2273 2 85 ASP H 2 85 ASP HB2 . . 3.780 2.240 1.998 2.459 . 0 0 "[ . 1 . 2 . 3 ]" 1
2274 2 85 ASP H 2 85 ASP QB . . 3.580 2.153 1.983 2.360 . 0 0 "[ . 1 . 2 . 3 ]" 1
2275 2 85 ASP H 2 85 ASP HB3 . . 3.780 2.996 2.471 3.536 . 0 0 "[ . 1 . 2 . 3 ]" 1
2276 2 85 ASP H 2 86 PHE HB2 . . 5.370 4.441 3.963 4.906 . 0 0 "[ . 1 . 2 . 3 ]" 1
2277 2 85 ASP H 2 86 PHE HB3 . . 5.370 5.075 4.404 5.379 0.009 5 0 "[ . 1 . 2 . 3 ]" 1
2278 2 85 ASP H 2 88 LEU QD . . 5.280 4.214 3.976 4.377 . 0 0 "[ . 1 . 2 . 3 ]" 1
2279 2 85 ASP HA 2 87 PHE H . . 4.530 4.413 3.527 4.558 0.028 19 0 "[ . 1 . 2 . 3 ]" 1
2280 2 85 ASP HA 2 88 LEU H . . 4.370 3.311 2.683 3.677 . 0 0 "[ . 1 . 2 . 3 ]" 1
2281 2 85 ASP HA 2 88 LEU QB . . 4.560 2.630 2.059 3.179 . 0 0 "[ . 1 . 2 . 3 ]" 1
2282 2 85 ASP HA 2 88 LEU MD1 . . 5.330 2.427 2.124 4.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
2283 2 85 ASP HA 2 88 LEU QD . . 4.050 2.331 2.119 2.800 . 0 0 "[ . 1 . 2 . 3 ]" 1
2284 2 85 ASP HA 2 88 LEU MD2 . . 5.330 4.664 2.171 5.142 . 0 0 "[ . 1 . 2 . 3 ]" 1
2285 2 85 ASP HB2 2 86 PHE H . . 4.140 3.375 2.481 3.941 . 0 0 "[ . 1 . 2 . 3 ]" 1
2286 2 85 ASP HB3 2 86 PHE H . . 4.140 3.016 2.348 3.848 . 0 0 "[ . 1 . 2 . 3 ]" 1
2287 2 86 PHE H 2 86 PHE HB2 . . 3.710 2.062 1.987 2.328 . 0 0 "[ . 1 . 2 . 3 ]" 1
2288 2 86 PHE H 2 86 PHE HB3 . . 3.710 2.868 2.267 3.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
2289 2 86 PHE H 2 86 PHE QD . . 5.400 3.919 3.636 4.093 . 0 0 "[ . 1 . 2 . 3 ]" 1
2290 2 86 PHE H 2 87 PHE H . . 4.050 2.866 2.698 2.997 . 0 0 "[ . 1 . 2 . 3 ]" 1
2291 2 86 PHE HA 2 86 PHE QE . . 4.880 4.586 4.295 4.735 . 0 0 "[ . 1 . 2 . 3 ]" 1
2292 2 86 PHE HA 2 89 GLU H . . 3.940 3.592 3.161 3.947 0.007 29 0 "[ . 1 . 2 . 3 ]" 1
2293 2 86 PHE HA 2 89 GLU QB . . 3.700 3.218 2.411 3.791 0.091 22 0 "[ . 1 . 2 . 3 ]" 1
2294 2 86 PHE HA 2 89 GLU QG . . 4.640 3.856 1.968 4.660 0.020 29 0 "[ . 1 . 2 . 3 ]" 1
2295 2 86 PHE QB 2 87 PHE H . . 3.770 2.443 2.218 3.085 . 0 0 "[ . 1 . 2 . 3 ]" 1
2296 2 86 PHE QD 2 87 PHE H . . 5.500 4.167 3.816 4.718 . 0 0 "[ . 1 . 2 . 3 ]" 1
2297 2 86 PHE QD 2 87 PHE HA . . 5.500 4.180 3.687 5.005 . 0 0 "[ . 1 . 2 . 3 ]" 1
2298 2 86 PHE QD 2 90 ASP QB . . 5.080 3.878 2.217 5.048 . 0 0 "[ . 1 . 2 . 3 ]" 1
2299 2 87 PHE H 2 87 PHE HB2 . . 3.880 2.415 2.233 2.770 . 0 0 "[ . 1 . 2 . 3 ]" 1
2300 2 87 PHE H 2 87 PHE HB3 . . 3.880 2.442 2.245 2.579 . 0 0 "[ . 1 . 2 . 3 ]" 1
2301 2 87 PHE H 2 87 PHE QD . . 5.430 4.150 4.039 4.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
2302 2 87 PHE H 2 88 LEU H . . 4.370 2.735 2.323 2.917 . 0 0 "[ . 1 . 2 . 3 ]" 1
2303 2 87 PHE H 2 89 GLU H . . 4.790 4.237 3.957 4.442 . 0 0 "[ . 1 . 2 . 3 ]" 1
2304 2 87 PHE HA 2 87 PHE QE . . 5.500 4.751 4.597 4.922 . 0 0 "[ . 1 . 2 . 3 ]" 1
2305 2 87 PHE HA 2 90 ASP HB2 . . 4.390 3.245 2.297 4.254 . 0 0 "[ . 1 . 2 . 3 ]" 1
2306 2 87 PHE HA 2 90 ASP QB . . 3.810 2.548 2.141 2.952 . 0 0 "[ . 1 . 2 . 3 ]" 1
2307 2 87 PHE HA 2 90 ASP HB3 . . 4.390 2.978 2.199 4.407 0.017 31 0 "[ . 1 . 2 . 3 ]" 1
2308 2 87 PHE HA 2 91 ASN H . . 4.270 4.006 3.194 4.399 0.129 22 0 "[ . 1 . 2 . 3 ]" 1
2309 2 87 PHE HA 2 91 ASN HD21 . . 5.500 4.249 2.829 5.148 . 0 0 "[ . 1 . 2 . 3 ]" 1
2310 2 87 PHE HA 2 91 ASN HD22 . . 5.500 4.977 3.447 5.553 0.053 7 0 "[ . 1 . 2 . 3 ]" 1
2311 2 87 PHE QB 2 88 LEU H . . 3.700 2.970 2.719 3.422 . 0 0 "[ . 1 . 2 . 3 ]" 1
2312 2 87 PHE HB2 2 88 LEU H . . 4.290 4.126 3.932 4.319 0.029 22 0 "[ . 1 . 2 . 3 ]" 1
2313 2 87 PHE HB3 2 88 LEU H . . 4.290 3.048 2.772 3.588 . 0 0 "[ . 1 . 2 . 3 ]" 1
2314 2 87 PHE QD 2 88 LEU H . . 5.140 3.913 3.155 4.562 . 0 0 "[ . 1 . 2 . 3 ]" 1
2315 2 87 PHE QD 2 88 LEU MD1 . . 5.500 4.545 2.715 4.968 . 0 0 "[ . 1 . 2 . 3 ]" 1
2316 2 87 PHE QD 2 88 LEU MD2 . . 5.500 3.324 2.169 5.236 . 0 0 "[ . 1 . 2 . 3 ]" 1
2317 2 87 PHE QD 2 88 LEU HG . . 5.500 3.388 2.603 4.924 . 0 0 "[ . 1 . 2 . 3 ]" 1
2318 2 87 PHE QD 2 91 ASN QD . . 5.310 3.741 2.478 4.621 . 0 0 "[ . 1 . 2 . 3 ]" 1
2319 2 87 PHE QE 2 88 LEU HG . . 5.500 5.331 4.320 5.524 0.024 31 0 "[ . 1 . 2 . 3 ]" 1
2320 2 88 LEU H 2 88 LEU HB2 . . 4.090 2.355 2.162 2.467 . 0 0 "[ . 1 . 2 . 3 ]" 1
2321 2 88 LEU H 2 88 LEU QB . . 3.550 2.325 2.142 2.431 . 0 0 "[ . 1 . 2 . 3 ]" 1
2322 2 88 LEU H 2 88 LEU HB3 . . 4.090 3.592 3.480 3.669 . 0 0 "[ . 1 . 2 . 3 ]" 1
2323 2 88 LEU H 2 88 LEU MD1 . . 4.640 3.537 2.651 3.801 . 0 0 "[ . 1 . 2 . 3 ]" 1
2324 2 88 LEU H 2 88 LEU MD2 . . 4.640 3.803 2.409 4.293 . 0 0 "[ . 1 . 2 . 3 ]" 1
2325 2 88 LEU H 2 88 LEU HG . . 4.260 2.754 2.454 4.195 . 0 0 "[ . 1 . 2 . 3 ]" 1
2326 2 88 LEU H 2 89 GLU H . . 3.840 2.536 2.259 2.772 . 0 0 "[ . 1 . 2 . 3 ]" 1
2327 2 88 LEU H 2 89 GLU QB . . 5.230 4.533 4.072 4.855 . 0 0 "[ . 1 . 2 . 3 ]" 1
2328 2 88 LEU H 2 90 ASP H . . 4.070 3.968 3.730 4.120 0.050 1 0 "[ . 1 . 2 . 3 ]" 1
2329 2 88 LEU HA 2 88 LEU QD . . 3.720 2.159 2.068 2.775 . 0 0 "[ . 1 . 2 . 3 ]" 1
2330 2 88 LEU HA 2 89 GLU QG . . 5.150 5.164 4.954 5.215 0.065 23 0 "[ . 1 . 2 . 3 ]" 1
2331 2 88 LEU HA 2 90 ASP H . . 4.640 3.937 3.279 4.626 . 0 0 "[ . 1 . 2 . 3 ]" 1
2332 2 88 LEU HA 2 91 ASN H . . 4.400 3.622 2.582 4.416 0.016 18 0 "[ . 1 . 2 . 3 ]" 1
2333 2 88 LEU HA 2 91 ASN QB . . 4.390 3.427 2.063 4.455 0.065 21 0 "[ . 1 . 2 . 3 ]" 1
2334 2 88 LEU QB 2 89 GLU H . . 3.940 3.112 2.639 3.373 . 0 0 "[ . 1 . 2 . 3 ]" 1
2335 2 88 LEU HB2 2 89 GLU H . . 4.120 3.254 2.745 3.560 . 0 0 "[ . 1 . 2 . 3 ]" 1
2336 2 88 LEU HB3 2 89 GLU H . . 4.120 3.978 3.423 4.186 0.066 13 0 "[ . 1 . 2 . 3 ]" 1
2337 2 88 LEU QD 2 89 GLU QG . . 5.280 4.886 4.420 5.347 0.067 22 0 "[ . 1 . 2 . 3 ]" 1
2338 2 88 LEU MD1 2 89 GLU H . . 5.170 4.969 4.447 5.185 0.015 31 0 "[ . 1 . 2 . 3 ]" 1
2339 2 88 LEU MD2 2 89 GLU H . . 5.170 4.915 4.208 5.157 . 0 0 "[ . 1 . 2 . 3 ]" 1
2340 2 88 LEU HG 2 89 GLU H . . 5.070 4.791 4.505 5.128 0.058 25 0 "[ . 1 . 2 . 3 ]" 1
2341 2 89 GLU H 2 89 GLU QB . . 3.040 2.364 2.130 2.903 . 0 0 "[ . 1 . 2 . 3 ]" 1
2342 2 89 GLU H 2 89 GLU HG2 . . 4.280 2.992 2.084 3.987 . 0 0 "[ . 1 . 2 . 3 ]" 1
2343 2 89 GLU H 2 89 GLU QG . . 3.870 2.791 2.038 3.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
2344 2 89 GLU H 2 89 GLU HG3 . . 4.280 3.788 2.193 4.290 0.010 24 0 "[ . 1 . 2 . 3 ]" 1
2345 2 89 GLU H 2 90 ASP H . . 3.480 2.396 2.184 2.718 . 0 0 "[ . 1 . 2 . 3 ]" 1
2346 2 89 GLU HA 2 89 GLU HG2 . . 4.090 2.811 2.412 3.775 . 0 0 "[ . 1 . 2 . 3 ]" 1
2347 2 89 GLU HA 2 89 GLU HG3 . . 4.090 3.597 2.905 3.816 . 0 0 "[ . 1 . 2 . 3 ]" 1
2348 2 89 GLU HA 2 90 ASP H . . 3.350 3.364 3.195 3.444 0.094 17 0 "[ . 1 . 2 . 3 ]" 1
2349 2 89 GLU HA 2 90 ASP HA . . 5.070 4.725 4.578 4.910 . 0 0 "[ . 1 . 2 . 3 ]" 1
2350 2 89 GLU QB 2 90 ASP H . . 3.410 3.224 2.674 3.489 0.079 8 0 "[ . 1 . 2 . 3 ]" 1
2351 2 90 ASP H 2 90 ASP HB2 . . 3.490 2.588 2.126 2.968 . 0 0 "[ . 1 . 2 . 3 ]" 1
2352 2 90 ASP H 2 90 ASP QB . . 2.940 2.212 2.070 2.390 . 0 0 "[ . 1 . 2 . 3 ]" 1
2353 2 90 ASP H 2 90 ASP HB3 . . 3.490 2.626 2.176 3.540 0.050 17 0 "[ . 1 . 2 . 3 ]" 1
2354 2 90 ASP HA 2 92 LYS H . . 5.500 3.993 3.568 4.680 . 0 0 "[ . 1 . 2 . 3 ]" 1
2355 2 90 ASP QB 2 91 ASN QD . . 4.690 2.610 1.712 3.727 . 0 0 "[ . 1 . 2 . 3 ]" 1
2356 2 90 ASP QB 2 92 LYS H . . 4.500 4.531 4.318 4.591 0.091 16 0 "[ . 1 . 2 . 3 ]" 1
2357 2 91 ASN H 2 91 ASN HB2 . . 3.570 2.346 2.029 3.576 0.006 7 0 "[ . 1 . 2 . 3 ]" 1
2358 2 91 ASN H 2 91 ASN QB . . 2.940 2.242 2.012 2.432 . 0 0 "[ . 1 . 2 . 3 ]" 1
2359 2 91 ASN H 2 91 ASN HB3 . . 3.570 3.454 2.032 3.610 0.040 17 0 "[ . 1 . 2 . 3 ]" 1
2360 2 91 ASN H 2 91 ASN QD . . 4.250 2.493 1.935 2.954 . 0 0 "[ . 1 . 2 . 3 ]" 1
2361 2 91 ASN H 2 92 LYS H . . 3.330 2.929 2.414 3.352 0.022 16 0 "[ . 1 . 2 . 3 ]" 1
2362 2 91 ASN HA 2 92 LYS H . . 3.340 2.968 2.461 3.417 0.077 27 0 "[ . 1 . 2 . 3 ]" 1
2363 2 91 ASN QB 2 92 LYS H . . 3.720 3.653 3.227 3.803 0.083 19 0 "[ . 1 . 2 . 3 ]" 1
2364 2 91 ASN HB2 2 92 LYS H . . 4.250 4.008 3.463 4.338 0.088 21 0 "[ . 1 . 2 . 3 ]" 1
2365 2 91 ASN HB3 2 92 LYS H . . 4.250 4.232 3.854 4.328 0.078 31 0 "[ . 1 . 2 . 3 ]" 1
2366 2 92 LYS H 2 92 LYS HB2 . . 3.470 2.840 2.009 3.624 0.154 9 0 "[ . 1 . 2 . 3 ]" 1
2367 2 92 LYS H 2 92 LYS QB . . 3.000 2.335 1.900 2.875 . 0 0 "[ . 1 . 2 . 3 ]" 1
2368 2 92 LYS H 2 92 LYS HB3 . . 3.470 2.934 1.991 3.594 0.124 27 0 "[ . 1 . 2 . 3 ]" 1
2369 2 92 LYS H 2 92 LYS QD . . 3.970 3.807 2.563 4.060 0.090 15 0 "[ . 1 . 2 . 3 ]" 1
2370 2 92 LYS H 2 92 LYS QG . . 3.640 2.676 1.827 3.824 0.184 18 0 "[ . 1 . 2 . 3 ]" 1
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