Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
489659 | 2l51 RC | 17262 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l51
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 2410
_Distance_constraint_stats_list.Viol_count 9379
_Distance_constraint_stats_list.Viol_total 12936.237
_Distance_constraint_stats_list.Viol_max 1.850
_Distance_constraint_stats_list.Viol_rms 0.0439
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0060
_Distance_constraint_stats_list.Viol_average_violations_only 0.0460
_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 2 ASP 0.024 0.024 23 0 "[ . 1 . 2 . 3]"
1 3 CYS 0.177 0.055 3 0 "[ . 1 . 2 . 3]"
1 4 TYR 2.467 0.089 28 0 "[ . 1 . 2 . 3]"
1 5 THR 2.601 0.095 4 0 "[ . 1 . 2 . 3]"
1 6 GLU 4.524 0.239 27 0 "[ . 1 . 2 . 3]"
1 7 LEU 2.318 0.113 17 0 "[ . 1 . 2 . 3]"
1 8 GLU 2.090 0.113 17 0 "[ . 1 . 2 . 3]"
1 9 LYS 2.809 0.103 20 0 "[ . 1 . 2 . 3]"
1 10 ALA 3.616 0.109 28 0 "[ . 1 . 2 . 3]"
1 11 VAL 2.350 0.076 6 0 "[ . 1 . 2 . 3]"
1 12 ILE 2.611 0.089 28 0 "[ . 1 . 2 . 3]"
1 13 VAL 4.580 0.109 28 0 "[ . 1 . 2 . 3]"
1 14 LEU 5.253 0.060 12 0 "[ . 1 . 2 . 3]"
1 15 VAL 1.678 0.076 2 0 "[ . 1 . 2 . 3]"
1 16 GLU 0.144 0.042 13 0 "[ . 1 . 2 . 3]"
1 17 ASN 1.196 0.058 15 0 "[ . 1 . 2 . 3]"
1 18 PHE 40.554 1.782 2 30 [*+*********************-******]
1 19 TYR 0.642 0.095 22 0 "[ . 1 . 2 . 3]"
1 20 LYS 3.675 0.158 21 0 "[ . 1 . 2 . 3]"
1 21 TYR 40.298 1.782 2 30 [*+*********************-******]
1 22 VAL 0.556 0.095 22 0 "[ . 1 . 2 . 3]"
1 23 SER 0.030 0.030 21 0 "[ . 1 . 2 . 3]"
1 24 LYS 0.921 0.071 3 0 "[ . 1 . 2 . 3]"
1 25 TYR 0.059 0.025 19 0 "[ . 1 . 2 . 3]"
1 26 SER 0.034 0.015 5 0 "[ . 1 . 2 . 3]"
1 27 LEU 1.205 0.076 29 0 "[ . 1 . 2 . 3]"
1 28 VAL 1.355 0.076 29 0 "[ . 1 . 2 . 3]"
1 29 LYS 2.459 0.131 27 0 "[ . 1 . 2 . 3]"
1 30 ASN 1.623 0.131 27 0 "[ . 1 . 2 . 3]"
1 31 LYS 0.433 0.083 4 0 "[ . 1 . 2 . 3]"
1 32 ILE 0.513 0.077 12 0 "[ . 1 . 2 . 3]"
1 33 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 34 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 35 SER 2.750 0.291 6 0 "[ . 1 . 2 . 3]"
1 36 SER 0.071 0.017 15 0 "[ . 1 . 2 . 3]"
1 37 PHE 0.171 0.042 27 0 "[ . 1 . 2 . 3]"
1 38 ARG 4.202 0.291 6 0 "[ . 1 . 2 . 3]"
1 39 GLU 4.641 0.142 12 0 "[ . 1 . 2 . 3]"
1 40 MET 0.929 0.142 12 0 "[ . 1 . 2 . 3]"
1 41 LEU 7.830 0.411 13 0 "[ . 1 . 2 . 3]"
1 42 GLN 12.273 0.178 27 0 "[ . 1 . 2 . 3]"
1 43 LYS 6.858 0.154 3 0 "[ . 1 . 2 . 3]"
1 44 GLU 1.735 0.107 18 0 "[ . 1 . 2 . 3]"
1 45 LEU 2.203 0.098 25 0 "[ . 1 . 2 . 3]"
1 46 ASN 0.522 0.092 24 0 "[ . 1 . 2 . 3]"
1 47 HIS 0.379 0.077 6 0 "[ . 1 . 2 . 3]"
1 48 MET 3.057 0.074 17 0 "[ . 1 . 2 . 3]"
1 49 LEU 3.601 0.130 3 0 "[ . 1 . 2 . 3]"
1 50 SER 1.389 0.130 3 0 "[ . 1 . 2 . 3]"
1 51 ASP 0.683 0.079 15 0 "[ . 1 . 2 . 3]"
1 52 THR 3.500 0.121 30 0 "[ . 1 . 2 . 3]"
1 53 GLY 1.358 0.121 29 0 "[ . 1 . 2 . 3]"
1 54 ASN 1.539 0.095 7 0 "[ . 1 . 2 . 3]"
1 55 ARG 6.640 0.150 21 0 "[ . 1 . 2 . 3]"
1 56 LYS 5.388 0.139 16 0 "[ . 1 . 2 . 3]"
1 57 ALA 5.760 0.116 24 0 "[ . 1 . 2 . 3]"
1 58 ALA 5.891 0.098 15 0 "[ . 1 . 2 . 3]"
1 59 ASP 2.979 0.113 14 0 "[ . 1 . 2 . 3]"
1 60 LYS 5.463 0.089 2 0 "[ . 1 . 2 . 3]"
1 61 LEU 5.529 0.114 13 0 "[ . 1 . 2 . 3]"
1 62 ILE 6.616 0.114 13 0 "[ . 1 . 2 . 3]"
1 63 GLN 6.056 0.111 9 0 "[ . 1 . 2 . 3]"
1 64 ASN 0.263 0.043 12 0 "[ . 1 . 2 . 3]"
1 65 LEU 0.687 0.072 12 0 "[ . 1 . 2 . 3]"
1 66 ASP 0.169 0.066 11 0 "[ . 1 . 2 . 3]"
1 67 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 68 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 69 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 70 ASP 0.273 0.045 19 0 "[ . 1 . 2 . 3]"
1 71 GLY 0.273 0.045 19 0 "[ . 1 . 2 . 3]"
1 72 ARG 7.325 0.330 10 0 "[ . 1 . 2 . 3]"
1 73 ILE 0.451 0.066 11 0 "[ . 1 . 2 . 3]"
1 74 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 75 PHE 1.578 0.079 27 0 "[ . 1 . 2 . 3]"
1 76 ASP 0.155 0.035 10 0 "[ . 1 . 2 . 3]"
1 77 GLU 0.783 0.053 29 0 "[ . 1 . 2 . 3]"
1 78 TYR 5.489 0.411 13 0 "[ . 1 . 2 . 3]"
1 79 TRP 22.212 0.364 27 0 "[ . 1 . 2 . 3]"
1 80 THR 1.480 0.083 14 0 "[ . 1 . 2 . 3]"
1 81 LEU 0.342 0.053 15 0 "[ . 1 . 2 . 3]"
1 82 ILE 5.802 0.120 12 0 "[ . 1 . 2 . 3]"
1 83 GLY 0.516 0.046 5 0 "[ . 1 . 2 . 3]"
1 84 GLY 0.363 0.053 15 0 "[ . 1 . 2 . 3]"
1 85 ILE 2.861 0.059 2 0 "[ . 1 . 2 . 3]"
1 86 THR 2.380 0.097 22 0 "[ . 1 . 2 . 3]"
1 87 GLY 1.537 0.097 22 0 "[ . 1 . 2 . 3]"
1 88 PRO 0.892 0.082 27 0 "[ . 1 . 2 . 3]"
1 89 ILE 3.686 0.138 27 0 "[ . 1 . 2 . 3]"
1 90 ALA 1.189 0.065 3 0 "[ . 1 . 2 . 3]"
1 91 LYS 4.437 0.118 16 0 "[ . 1 . 2 . 3]"
1 92 LEU 4.759 0.110 26 0 "[ . 1 . 2 . 3]"
1 93 ILE 2.524 0.122 24 0 "[ . 1 . 2 . 3]"
1 94 HIS 3.099 0.107 20 0 "[ . 1 . 2 . 3]"
1 95 GLU 6.421 0.160 17 0 "[ . 1 . 2 . 3]"
1 96 GLN 11.842 0.160 17 0 "[ . 1 . 2 . 3]"
1 97 GLU 5.979 0.142 23 0 "[ . 1 . 2 . 3]"
1 98 GLN 8.307 0.103 28 0 "[ . 1 . 2 . 3]"
1 99 GLN 7.045 0.103 28 0 "[ . 1 . 2 . 3]"
1 100 SER 3.078 0.116 14 0 "[ . 1 . 2 . 3]"
1 101 SER 0.782 0.112 16 0 "[ . 1 . 2 . 3]"
1 102 SER 0.235 0.084 26 0 "[ . 1 . 2 . 3]"
2 2 ASP 0.022 0.020 23 0 "[ . 1 . 2 . 3]"
2 3 CYS 0.198 0.071 3 0 "[ . 1 . 2 . 3]"
2 4 TYR 2.747 0.071 12 0 "[ . 1 . 2 . 3]"
2 5 THR 2.780 0.110 4 0 "[ . 1 . 2 . 3]"
2 6 GLU 4.585 0.230 5 0 "[ . 1 . 2 . 3]"
2 7 LEU 2.362 0.110 17 0 "[ . 1 . 2 . 3]"
2 8 GLU 2.174 0.110 17 0 "[ . 1 . 2 . 3]"
2 9 LYS 3.044 0.105 29 0 "[ . 1 . 2 . 3]"
2 10 ALA 3.605 0.103 16 0 "[ . 1 . 2 . 3]"
2 11 VAL 2.337 0.076 9 0 "[ . 1 . 2 . 3]"
2 12 ILE 2.423 0.085 22 0 "[ . 1 . 2 . 3]"
2 13 VAL 4.888 0.103 16 0 "[ . 1 . 2 . 3]"
2 14 LEU 5.387 0.065 17 0 "[ . 1 . 2 . 3]"
2 15 VAL 1.857 0.085 22 0 "[ . 1 . 2 . 3]"
2 16 GLU 0.146 0.033 26 0 "[ . 1 . 2 . 3]"
2 17 ASN 1.036 0.065 17 0 "[ . 1 . 2 . 3]"
2 18 PHE 41.265 1.850 21 30 [********************+**-******]
2 19 TYR 0.741 0.123 22 0 "[ . 1 . 2 . 3]"
2 20 LYS 3.528 0.145 12 0 "[ . 1 . 2 . 3]"
2 21 TYR 41.132 1.850 21 30 [********************+**-******]
2 22 VAL 0.723 0.123 22 0 "[ . 1 . 2 . 3]"
2 23 SER 0.017 0.017 21 0 "[ . 1 . 2 . 3]"
2 24 LYS 0.690 0.059 3 0 "[ . 1 . 2 . 3]"
2 25 TYR 0.065 0.026 19 0 "[ . 1 . 2 . 3]"
2 26 SER 0.039 0.014 2 0 "[ . 1 . 2 . 3]"
2 27 LEU 1.304 0.079 3 0 "[ . 1 . 2 . 3]"
2 28 VAL 1.444 0.079 3 0 "[ . 1 . 2 . 3]"
2 29 LYS 2.510 0.115 22 0 "[ . 1 . 2 . 3]"
2 30 ASN 1.550 0.101 11 0 "[ . 1 . 2 . 3]"
2 31 LYS 0.482 0.075 12 0 "[ . 1 . 2 . 3]"
2 32 ILE 0.541 0.075 12 0 "[ . 1 . 2 . 3]"
2 33 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 34 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 35 SER 2.816 0.296 16 0 "[ . 1 . 2 . 3]"
2 36 SER 0.108 0.022 26 0 "[ . 1 . 2 . 3]"
2 37 PHE 0.236 0.036 26 0 "[ . 1 . 2 . 3]"
2 38 ARG 4.070 0.296 16 0 "[ . 1 . 2 . 3]"
2 39 GLU 5.102 0.157 26 0 "[ . 1 . 2 . 3]"
2 40 MET 0.940 0.148 12 0 "[ . 1 . 2 . 3]"
2 41 LEU 7.367 0.400 28 0 "[ . 1 . 2 . 3]"
2 42 GLN 11.267 0.153 14 0 "[ . 1 . 2 . 3]"
2 43 LYS 7.132 0.137 13 0 "[ . 1 . 2 . 3]"
2 44 GLU 1.864 0.117 18 0 "[ . 1 . 2 . 3]"
2 45 LEU 2.037 0.100 7 0 "[ . 1 . 2 . 3]"
2 46 ASN 0.444 0.063 1 0 "[ . 1 . 2 . 3]"
2 47 HIS 0.462 0.066 3 0 "[ . 1 . 2 . 3]"
2 48 MET 2.723 0.060 12 0 "[ . 1 . 2 . 3]"
2 49 LEU 3.637 0.113 22 0 "[ . 1 . 2 . 3]"
2 50 SER 1.261 0.113 22 0 "[ . 1 . 2 . 3]"
2 51 ASP 0.439 0.068 23 0 "[ . 1 . 2 . 3]"
2 52 THR 3.151 0.104 29 0 "[ . 1 . 2 . 3]"
2 53 GLY 1.293 0.104 29 0 "[ . 1 . 2 . 3]"
2 54 ASN 1.478 0.102 7 0 "[ . 1 . 2 . 3]"
2 55 ARG 5.536 0.099 26 0 "[ . 1 . 2 . 3]"
2 56 LYS 5.433 0.216 20 0 "[ . 1 . 2 . 3]"
2 57 ALA 5.573 0.131 17 0 "[ . 1 . 2 . 3]"
2 58 ALA 5.548 0.096 24 0 "[ . 1 . 2 . 3]"
2 59 ASP 2.990 0.124 14 0 "[ . 1 . 2 . 3]"
2 60 LYS 5.688 0.101 20 0 "[ . 1 . 2 . 3]"
2 61 LEU 5.550 0.111 14 0 "[ . 1 . 2 . 3]"
2 62 ILE 6.774 0.113 25 0 "[ . 1 . 2 . 3]"
2 63 GLN 6.007 0.096 22 0 "[ . 1 . 2 . 3]"
2 64 ASN 0.399 0.057 10 0 "[ . 1 . 2 . 3]"
2 65 LEU 0.845 0.076 12 0 "[ . 1 . 2 . 3]"
2 66 ASP 0.142 0.071 11 0 "[ . 1 . 2 . 3]"
2 67 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 68 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 69 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 70 ASP 0.339 0.061 18 0 "[ . 1 . 2 . 3]"
2 71 GLY 0.339 0.061 18 0 "[ . 1 . 2 . 3]"
2 72 ARG 7.061 0.327 15 0 "[ . 1 . 2 . 3]"
2 73 ILE 0.346 0.071 11 0 "[ . 1 . 2 . 3]"
2 74 SER 0.069 0.037 9 0 "[ . 1 . 2 . 3]"
2 75 PHE 1.696 0.082 27 0 "[ . 1 . 2 . 3]"
2 76 ASP 0.239 0.061 17 0 "[ . 1 . 2 . 3]"
2 77 GLU 0.826 0.084 25 0 "[ . 1 . 2 . 3]"
2 78 TYR 4.630 0.400 28 0 "[ . 1 . 2 . 3]"
2 79 TRP 22.140 0.364 27 0 "[ . 1 . 2 . 3]"
2 80 THR 1.346 0.082 15 0 "[ . 1 . 2 . 3]"
2 81 LEU 0.301 0.049 1 0 "[ . 1 . 2 . 3]"
2 82 ILE 5.848 0.122 12 0 "[ . 1 . 2 . 3]"
2 83 GLY 0.407 0.039 5 0 "[ . 1 . 2 . 3]"
2 84 GLY 0.321 0.049 1 0 "[ . 1 . 2 . 3]"
2 85 ILE 2.702 0.063 2 0 "[ . 1 . 2 . 3]"
2 86 THR 2.298 0.097 22 0 "[ . 1 . 2 . 3]"
2 87 GLY 1.532 0.097 22 0 "[ . 1 . 2 . 3]"
2 88 PRO 0.897 0.079 27 0 "[ . 1 . 2 . 3]"
2 89 ILE 3.567 0.135 27 0 "[ . 1 . 2 . 3]"
2 90 ALA 1.132 0.069 3 0 "[ . 1 . 2 . 3]"
2 91 LYS 4.724 0.136 16 0 "[ . 1 . 2 . 3]"
2 92 LEU 4.752 0.116 26 0 "[ . 1 . 2 . 3]"
2 93 ILE 2.731 0.100 21 0 "[ . 1 . 2 . 3]"
2 94 HIS 2.965 0.102 2 0 "[ . 1 . 2 . 3]"
2 95 GLU 6.360 0.167 7 0 "[ . 1 . 2 . 3]"
2 96 GLN 11.306 0.167 7 0 "[ . 1 . 2 . 3]"
2 97 GLU 5.581 0.127 2 0 "[ . 1 . 2 . 3]"
2 98 GLN 8.340 0.095 14 0 "[ . 1 . 2 . 3]"
2 99 GLN 7.213 0.095 14 0 "[ . 1 . 2 . 3]"
2 100 SER 3.382 0.131 16 0 "[ . 1 . 2 . 3]"
2 101 SER 0.671 0.131 16 0 "[ . 1 . 2 . 3]"
2 102 SER 0.101 0.054 27 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 60 LYS H 1 61 LEU H . . 3.510 2.732 2.533 2.909 . 0 0 "[ . 1 . 2 . 3]" 1
2 1 60 LYS H 1 60 LYS QD . . 4.590 4.423 4.171 4.597 0.007 18 0 "[ . 1 . 2 . 3]" 1
3 1 59 ASP H 1 60 LYS H . . 4.140 2.646 2.388 2.797 . 0 0 "[ . 1 . 2 . 3]" 1
4 1 24 LYS QB 1 25 TYR H . . 4.740 2.684 2.156 3.442 . 0 0 "[ . 1 . 2 . 3]" 1
5 1 25 TYR H 1 26 SER H . . 4.620 4.285 3.490 4.635 0.015 5 0 "[ . 1 . 2 . 3]" 1
6 1 24 LYS HG3 1 25 TYR H . . 5.500 4.267 2.336 5.275 . 0 0 "[ . 1 . 2 . 3]" 1
7 1 60 LYS QD 1 61 LEU H . . 4.270 3.148 2.802 3.343 . 0 0 "[ . 1 . 2 . 3]" 1
8 1 61 LEU H 1 61 LEU HB3 . . 3.910 3.545 3.501 3.634 . 0 0 "[ . 1 . 2 . 3]" 1
9 1 61 LEU H 1 62 ILE H . . 4.310 2.578 2.273 2.833 . 0 0 "[ . 1 . 2 . 3]" 1
10 1 61 LEU H 1 61 LEU HB2 . . 3.240 2.332 2.200 2.758 . 0 0 "[ . 1 . 2 . 3]" 1
11 1 60 LYS QB 1 61 LEU H . . 3.240 2.560 2.258 2.869 . 0 0 "[ . 1 . 2 . 3]" 1
12 1 93 ILE HA 1 96 GLN H . . 4.670 3.530 3.237 3.754 . 0 0 "[ . 1 . 2 . 3]" 1
13 1 96 GLN H 1 96 GLN HB3 . . 3.730 3.695 3.601 3.762 0.032 20 0 "[ . 1 . 2 . 3]" 1
14 1 95 GLU H 1 96 GLN H . . 3.880 2.719 1.970 2.989 . 0 0 "[ . 1 . 2 . 3]" 1
15 1 96 GLN H 1 96 GLN HG3 . . 3.500 2.393 1.965 2.936 . 0 0 "[ . 1 . 2 . 3]" 1
16 1 96 GLN H 1 96 GLN HG2 . . 3.810 2.528 2.001 3.388 . 0 0 "[ . 1 . 2 . 3]" 1
17 1 38 ARG H 1 38 ARG QG . . 4.860 3.775 2.472 4.156 . 0 0 "[ . 1 . 2 . 3]" 1
18 1 55 ARG HA 1 57 ALA H . . 4.650 4.194 3.825 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
19 1 56 LYS QB 1 57 ALA H . . 3.680 2.928 2.762 3.174 . 0 0 "[ . 1 . 2 . 3]" 1
20 1 54 ASN HA 1 57 ALA H . . 5.000 3.212 2.827 3.618 . 0 0 "[ . 1 . 2 . 3]" 1
21 1 56 LYS H 1 57 ALA H . . 3.900 2.752 2.518 2.957 . 0 0 "[ . 1 . 2 . 3]" 1
22 1 57 ALA H 1 58 ALA H . . 3.880 2.788 2.572 2.961 . 0 0 "[ . 1 . 2 . 3]" 1
23 1 54 ASN H 1 55 ARG H . . 3.750 2.730 2.524 3.021 . 0 0 "[ . 1 . 2 . 3]" 1
24 1 19 TYR H 1 20 LYS H . . 4.780 2.798 2.539 2.923 . 0 0 "[ . 1 . 2 . 3]" 1
25 1 19 TYR HB2 1 20 LYS H . . 5.500 2.875 2.509 3.435 . 0 0 "[ . 1 . 2 . 3]" 1
26 1 20 LYS H 1 20 LYS HB2 . . 3.780 2.384 2.032 2.791 . 0 0 "[ . 1 . 2 . 3]" 1
27 1 20 LYS H 1 20 LYS HG3 . . 5.180 3.659 2.260 4.487 . 0 0 "[ . 1 . 2 . 3]" 1
28 1 19 TYR HB3 1 20 LYS H . . 4.840 3.417 3.015 3.916 . 0 0 "[ . 1 . 2 . 3]" 1
29 1 20 LYS H 1 21 TYR H . . 4.330 2.953 2.639 3.263 . 0 0 "[ . 1 . 2 . 3]" 1
30 1 86 THR HB 1 87 GLY H . . 4.820 4.320 1.935 4.478 . 0 0 "[ . 1 . 2 . 3]" 1
31 1 86 THR H 1 87 GLY H . . 4.940 3.532 3.372 3.979 . 0 0 "[ . 1 . 2 . 3]" 1
32 1 40 MET QG 1 41 LEU H . . 4.840 3.659 2.198 4.150 . 0 0 "[ . 1 . 2 . 3]" 1
33 1 41 LEU H 1 41 LEU HG . . 5.290 2.475 2.146 3.625 . 0 0 "[ . 1 . 2 . 3]" 1
34 1 40 MET H 1 41 LEU H . . 4.680 2.950 2.775 3.221 . 0 0 "[ . 1 . 2 . 3]" 1
35 1 12 ILE H 1 12 ILE HB . . 3.860 2.409 2.177 2.683 . 0 0 "[ . 1 . 2 . 3]" 1
36 1 12 ILE H 1 12 ILE HG13 . . 4.790 2.258 2.020 3.604 . 0 0 "[ . 1 . 2 . 3]" 1
37 1 36 SER H 1 37 PHE H . . 3.630 2.591 2.232 3.086 . 0 0 "[ . 1 . 2 . 3]" 1
38 1 18 PHE H 1 19 TYR H . . 5.500 2.909 2.620 3.140 . 0 0 "[ . 1 . 2 . 3]" 1
39 1 89 ILE H 1 89 ILE HG13 . . 4.410 2.705 1.993 3.313 . 0 0 "[ . 1 . 2 . 3]" 1
40 1 100 SER QB 1 101 SER H . . 4.040 3.757 2.690 4.039 . 0 0 "[ . 1 . 2 . 3]" 1
41 1 44 GLU H 1 45 LEU H . . 4.770 2.739 1.887 3.144 . 0 0 "[ . 1 . 2 . 3]" 1
42 1 44 GLU HB2 1 45 LEU H . . 5.500 3.024 2.100 3.611 . 0 0 "[ . 1 . 2 . 3]" 1
43 1 44 GLU HG2 1 45 LEU H . . 5.500 4.937 4.142 5.557 0.057 3 0 "[ . 1 . 2 . 3]" 1
44 1 44 GLU HG3 1 45 LEU H . . 5.500 5.120 4.392 5.507 0.007 22 0 "[ . 1 . 2 . 3]" 1
45 1 43 LYS H 1 44 GLU H . . 5.010 2.708 2.451 3.139 . 0 0 "[ . 1 . 2 . 3]" 1
46 1 42 GLN H 1 43 LYS H . . 4.750 2.583 2.130 3.077 . 0 0 "[ . 1 . 2 . 3]" 1
47 1 42 GLN HG3 1 43 LYS H . . 5.440 5.009 4.609 5.422 . 0 0 "[ . 1 . 2 . 3]" 1
48 1 46 ASN H 1 46 ASN HB3 . . 4.120 2.629 2.178 3.800 . 0 0 "[ . 1 . 2 . 3]" 1
49 1 45 LEU MD2 1 46 ASN H . . 5.300 4.844 3.629 5.392 0.092 24 0 "[ . 1 . 2 . 3]" 1
50 1 46 ASN H 1 47 HIS H . . 5.030 2.875 2.300 3.807 . 0 0 "[ . 1 . 2 . 3]" 1
51 1 45 LEU HB2 1 46 ASN H . . 5.010 4.090 2.185 4.617 . 0 0 "[ . 1 . 2 . 3]" 1
52 1 97 GLU H 1 97 GLU QG . . 4.120 3.133 2.198 4.102 . 0 0 "[ . 1 . 2 . 3]" 1
53 1 97 GLU H 1 97 GLU HB3 . . 3.610 3.311 2.541 3.637 0.027 15 0 "[ . 1 . 2 . 3]" 1
54 1 71 GLY H 1 72 ARG H . . 4.500 2.480 2.311 2.636 . 0 0 "[ . 1 . 2 . 3]" 1
55 1 99 GLN H 1 99 GLN HG2 . . 3.900 3.828 3.635 3.922 0.022 28 0 "[ . 1 . 2 . 3]" 1
56 1 99 GLN H 1 99 GLN HB3 . . 3.750 3.626 3.551 3.678 . 0 0 "[ . 1 . 2 . 3]" 1
57 1 63 GLN HB2 1 63 GLN HE22 . . 4.790 4.477 3.550 4.883 0.093 30 0 "[ . 1 . 2 . 3]" 1
58 1 101 SER H 1 102 SER H . . 3.830 3.114 1.936 3.914 0.084 26 0 "[ . 1 . 2 . 3]" 1
59 1 55 ARG H 1 55 ARG HD2 . . 5.500 4.288 3.140 5.461 . 0 0 "[ . 1 . 2 . 3]" 1
60 1 54 ASN HB2 1 55 ARG H . . 5.130 3.696 2.830 4.243 . 0 0 "[ . 1 . 2 . 3]" 1
61 1 6 GLU H 1 7 LEU H . . 4.800 2.674 2.501 2.812 . 0 0 "[ . 1 . 2 . 3]" 1
62 1 5 THR HA 1 7 LEU H . . 5.480 4.122 3.851 4.485 . 0 0 "[ . 1 . 2 . 3]" 1
63 1 7 LEU H 1 7 LEU HG . . 4.620 4.527 4.416 4.585 . 0 0 "[ . 1 . 2 . 3]" 1
64 1 5 THR HB 1 7 LEU H . . 5.000 2.828 2.395 3.997 . 0 0 "[ . 1 . 2 . 3]" 1
65 1 7 LEU H 1 7 LEU MD1 . . 4.880 4.129 3.895 4.299 . 0 0 "[ . 1 . 2 . 3]" 1
66 1 3 CYS QB 1 4 TYR H . . 4.190 3.084 1.826 3.912 . 0 0 "[ . 1 . 2 . 3]" 1
67 1 4 TYR H 1 4 TYR HB3 . . 4.190 3.675 3.406 4.205 0.015 26 0 "[ . 1 . 2 . 3]" 1
68 1 84 GLY H 1 85 ILE H . . 4.930 2.735 2.537 2.878 . 0 0 "[ . 1 . 2 . 3]" 1
69 1 82 ILE HA 1 85 ILE H . . 4.780 2.897 2.566 3.537 . 0 0 "[ . 1 . 2 . 3]" 1
70 1 85 ILE H 1 85 ILE HG12 . . 5.150 3.586 3.405 3.772 . 0 0 "[ . 1 . 2 . 3]" 1
71 1 49 LEU H 1 49 LEU HG . . 4.620 3.300 1.984 4.563 . 0 0 "[ . 1 . 2 . 3]" 1
72 1 49 LEU H 1 49 LEU HB2 . . 3.910 3.168 2.067 3.984 0.074 27 0 "[ . 1 . 2 . 3]" 1
73 1 82 ILE H 1 82 ILE HG12 . . 5.050 4.423 4.323 4.533 . 0 0 "[ . 1 . 2 . 3]" 1
74 1 79 TRP HA 1 82 ILE H . . 4.790 3.664 3.504 3.822 . 0 0 "[ . 1 . 2 . 3]" 1
75 1 14 LEU H 1 15 VAL H . . 4.880 2.793 2.730 2.879 . 0 0 "[ . 1 . 2 . 3]" 1
76 1 10 ALA HA 1 14 LEU H . . 5.500 4.026 3.895 4.174 . 0 0 "[ . 1 . 2 . 3]" 1
77 1 14 LEU H 1 14 LEU HB2 . . 4.170 2.122 2.057 2.196 . 0 0 "[ . 1 . 2 . 3]" 1
78 1 14 LEU H 1 14 LEU HG . . 4.430 4.202 4.083 4.295 . 0 0 "[ . 1 . 2 . 3]" 1
79 1 8 GLU H 1 8 GLU HG2 . . 5.020 3.670 2.465 4.634 . 0 0 "[ . 1 . 2 . 3]" 1
80 1 7 LEU HB2 1 8 GLU H . . 4.440 3.719 3.520 3.863 . 0 0 "[ . 1 . 2 . 3]" 1
81 1 7 LEU H 1 8 GLU H . . 5.040 2.619 2.428 2.793 . 0 0 "[ . 1 . 2 . 3]" 1
82 1 8 GLU H 1 8 GLU HG3 . . 4.510 2.734 2.114 4.379 . 0 0 "[ . 1 . 2 . 3]" 1
83 1 98 GLN H 1 98 GLN HB2 . . 3.950 3.555 3.481 3.636 . 0 0 "[ . 1 . 2 . 3]" 1
84 1 63 GLN H 1 64 ASN H . . 4.790 2.644 2.183 2.934 . 0 0 "[ . 1 . 2 . 3]" 1
85 1 49 LEU HB2 1 50 SER H . . 5.450 3.262 1.945 4.696 . 0 0 "[ . 1 . 2 . 3]" 1
86 1 50 SER H 1 51 ASP H . . 5.110 2.987 2.024 4.276 . 0 0 "[ . 1 . 2 . 3]" 1
87 1 49 LEU HB3 1 50 SER H . . 5.500 3.932 2.793 4.526 . 0 0 "[ . 1 . 2 . 3]" 1
88 1 99 GLN HA 1 99 GLN HE21 . . 5.410 5.042 4.378 5.387 . 0 0 "[ . 1 . 2 . 3]" 1
89 1 13 VAL H 1 13 VAL HB . . 4.150 2.350 2.246 2.458 . 0 0 "[ . 1 . 2 . 3]" 1
90 1 13 VAL H 1 14 LEU H . . 4.250 2.833 2.708 2.963 . 0 0 "[ . 1 . 2 . 3]" 1
91 1 12 ILE HB 1 13 VAL H . . 4.390 2.855 2.608 3.003 . 0 0 "[ . 1 . 2 . 3]" 1
92 1 12 ILE HG13 1 13 VAL H . . 4.920 4.611 4.426 4.923 0.003 17 0 "[ . 1 . 2 . 3]" 1
93 1 16 GLU H 1 18 PHE H . . 5.500 4.197 3.998 4.390 . 0 0 "[ . 1 . 2 . 3]" 1
94 1 16 GLU H 1 16 GLU HG2 . . 4.540 4.349 3.636 4.545 0.005 26 0 "[ . 1 . 2 . 3]" 1
95 1 12 ILE HA 1 16 GLU H . . 5.430 3.981 3.655 4.758 . 0 0 "[ . 1 . 2 . 3]" 1
96 1 14 LEU H 1 16 GLU H . . 5.500 4.299 4.114 4.535 . 0 0 "[ . 1 . 2 . 3]" 1
97 1 16 GLU H 1 16 GLU HG3 . . 4.990 4.496 4.230 4.692 . 0 0 "[ . 1 . 2 . 3]" 1
98 1 12 ILE MG 1 16 GLU H . . 5.370 3.693 3.291 4.206 . 0 0 "[ . 1 . 2 . 3]" 1
99 1 62 ILE H 1 62 ILE HG12 . . 4.490 3.601 2.048 3.970 . 0 0 "[ . 1 . 2 . 3]" 1
100 1 61 LEU HB3 1 62 ILE H . . 5.010 3.309 3.091 3.763 . 0 0 "[ . 1 . 2 . 3]" 1
101 1 62 ILE H 1 62 ILE HG13 . . 4.540 2.395 2.133 3.691 . 0 0 "[ . 1 . 2 . 3]" 1
102 1 27 LEU MD1 1 28 VAL H . . 4.560 3.923 3.470 4.398 . 0 0 "[ . 1 . 2 . 3]" 1
103 1 27 LEU MD2 1 28 VAL H . . 4.500 3.235 1.771 4.151 . 0 0 "[ . 1 . 2 . 3]" 1
104 1 28 VAL H 1 28 VAL MG2 . . 4.390 3.107 1.844 3.955 . 0 0 "[ . 1 . 2 . 3]" 1
105 1 46 ASN HB3 1 47 HIS H . . 5.330 3.230 2.287 4.372 . 0 0 "[ . 1 . 2 . 3]" 1
106 1 45 LEU MD2 1 47 HIS H . . 5.500 4.850 2.762 5.577 0.077 6 0 "[ . 1 . 2 . 3]" 1
107 1 47 HIS H 1 48 MET H . . 4.810 2.690 2.015 4.313 . 0 0 "[ . 1 . 2 . 3]" 1
108 1 45 LEU HB2 1 47 HIS H . . 5.500 5.130 3.597 5.539 0.039 3 0 "[ . 1 . 2 . 3]" 1
109 1 27 LEU H 1 27 LEU HB2 . . 4.140 2.642 2.161 3.592 . 0 0 "[ . 1 . 2 . 3]" 1
110 1 73 ILE MD 1 74 SER H . . 5.150 4.412 3.764 5.083 . 0 0 "[ . 1 . 2 . 3]" 1
111 1 73 ILE H 1 74 SER H . . 5.220 4.206 3.807 4.486 . 0 0 "[ . 1 . 2 . 3]" 1
112 1 73 ILE HB 1 74 SER H . . 5.500 4.103 3.360 4.481 . 0 0 "[ . 1 . 2 . 3]" 1
113 1 50 SER HB3 1 51 ASP H . . 5.350 4.045 2.656 4.544 . 0 0 "[ . 1 . 2 . 3]" 1
114 1 91 LYS HG3 1 92 LEU H . . 5.500 4.830 1.962 5.403 . 0 0 "[ . 1 . 2 . 3]" 1
115 1 92 LEU H 1 93 ILE H . . 4.490 2.750 2.450 2.993 . 0 0 "[ . 1 . 2 . 3]" 1
116 1 92 LEU H 1 92 LEU HB2 . . 3.630 2.215 1.969 2.363 . 0 0 "[ . 1 . 2 . 3]" 1
117 1 90 ALA HA 1 92 LEU H . . 5.440 4.400 3.794 4.811 . 0 0 "[ . 1 . 2 . 3]" 1
118 1 67 ALA H 1 68 ASN H . . 4.630 2.448 2.102 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
119 1 93 ILE H 1 93 ILE HG12 . . 4.810 3.552 3.323 3.740 . 0 0 "[ . 1 . 2 . 3]" 1
120 1 91 LYS HA 1 93 ILE H . . 5.500 4.712 4.503 4.952 . 0 0 "[ . 1 . 2 . 3]" 1
121 1 91 LYS H 1 93 ILE H . . 5.100 4.284 4.076 4.409 . 0 0 "[ . 1 . 2 . 3]" 1
122 1 68 ASN HB3 1 69 HIS H . . 5.500 4.365 3.197 4.681 . 0 0 "[ . 1 . 2 . 3]" 1
123 1 68 ASN HB2 1 69 HIS H . . 5.320 3.802 2.917 4.637 . 0 0 "[ . 1 . 2 . 3]" 1
124 1 69 HIS H 1 70 ASP H . . 4.450 3.356 2.817 3.846 . 0 0 "[ . 1 . 2 . 3]" 1
125 1 70 ASP H 1 71 GLY H . . 4.410 2.382 2.167 2.506 . 0 0 "[ . 1 . 2 . 3]" 1
126 1 69 HIS HB3 1 70 ASP H . . 5.130 4.430 4.020 4.679 . 0 0 "[ . 1 . 2 . 3]" 1
127 1 70 ASP H 1 71 GLY HA2 . . 4.720 4.687 4.480 4.765 0.045 19 0 "[ . 1 . 2 . 3]" 1
128 1 9 LYS HB2 1 10 ALA H . . 4.490 2.940 2.446 3.320 . 0 0 "[ . 1 . 2 . 3]" 1
129 1 10 ALA H 1 11 VAL H . . 3.830 2.923 2.750 3.043 . 0 0 "[ . 1 . 2 . 3]" 1
130 1 9 LYS H 1 10 ALA H . . 4.410 3.111 2.920 3.274 . 0 0 "[ . 1 . 2 . 3]" 1
131 1 7 LEU MD2 1 10 ALA H . . 4.530 4.412 4.137 4.553 0.023 6 0 "[ . 1 . 2 . 3]" 1
132 1 84 GLY H 1 86 THR H . . 5.330 4.302 3.986 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
133 1 2 ASP QB 1 3 CYS H . . 4.140 3.079 2.070 3.996 . 0 0 "[ . 1 . 2 . 3]" 1
134 1 3 CYS H 1 3 CYS QB . . 3.740 2.886 2.215 3.559 . 0 0 "[ . 1 . 2 . 3]" 1
135 1 9 LYS H 1 9 LYS HD3 . . 4.330 4.337 3.387 4.431 0.101 4 0 "[ . 1 . 2 . 3]" 1
136 1 8 GLU HB2 1 9 LYS H . . 5.000 2.605 2.225 3.909 . 0 0 "[ . 1 . 2 . 3]" 1
137 1 8 GLU H 1 9 LYS H . . 4.720 3.068 2.842 3.221 . 0 0 "[ . 1 . 2 . 3]" 1
138 1 9 LYS H 1 9 LYS HD2 . . 4.410 3.767 3.159 4.434 0.024 20 0 "[ . 1 . 2 . 3]" 1
139 1 6 GLU HA 1 9 LYS H . . 5.160 3.315 2.923 3.734 . 0 0 "[ . 1 . 2 . 3]" 1
140 1 75 PHE H 1 76 ASP H . . 5.050 2.899 2.508 3.517 . 0 0 "[ . 1 . 2 . 3]" 1
141 1 76 ASP H 1 77 GLU H . . 4.840 2.684 2.396 3.272 . 0 0 "[ . 1 . 2 . 3]" 1
142 1 85 ILE MD 1 86 THR H . . 4.880 4.558 4.330 4.838 . 0 0 "[ . 1 . 2 . 3]" 1
143 1 92 LEU MD1 1 96 GLN HE22 . . 4.940 3.731 3.046 4.313 . 0 0 "[ . 1 . 2 . 3]" 1
144 1 96 GLN HB2 1 96 GLN HE22 . . 5.010 4.597 4.146 5.108 0.098 10 0 "[ . 1 . 2 . 3]" 1
145 1 96 GLN HA 1 96 GLN HE22 . . 5.300 5.150 4.326 5.386 0.086 26 0 "[ . 1 . 2 . 3]" 1
146 1 32 ILE H 1 32 ILE HG13 . . 5.500 3.456 2.089 4.717 . 0 0 "[ . 1 . 2 . 3]" 1
147 1 32 ILE H 1 32 ILE MD . . 5.500 3.573 1.723 4.810 . 0 0 "[ . 1 . 2 . 3]" 1
148 1 62 ILE HB 1 63 GLN H . . 3.990 2.979 2.689 3.356 . 0 0 "[ . 1 . 2 . 3]" 1
149 1 63 GLN H 1 63 GLN HG3 . . 4.390 4.229 2.705 4.447 0.057 4 0 "[ . 1 . 2 . 3]" 1
150 1 56 LYS H 1 58 ALA H . . 4.480 4.440 4.184 4.534 0.054 7 0 "[ . 1 . 2 . 3]" 1
151 1 17 ASN H 1 20 LYS H . . 5.500 4.848 4.602 5.292 . 0 0 "[ . 1 . 2 . 3]" 1
152 1 17 ASN H 1 18 PHE H . . 5.500 2.838 2.596 3.105 . 0 0 "[ . 1 . 2 . 3]" 1
153 1 14 LEU MD1 1 17 ASN H . . 5.080 5.026 4.581 5.130 0.050 2 0 "[ . 1 . 2 . 3]" 1
154 1 16 GLU HB3 1 17 ASN H . . 5.500 2.389 2.073 2.860 . 0 0 "[ . 1 . 2 . 3]" 1
155 1 16 GLU HG3 1 17 ASN H . . 5.500 4.590 3.800 5.149 . 0 0 "[ . 1 . 2 . 3]" 1
156 1 13 VAL HA 1 17 ASN H . . 5.500 4.238 3.651 4.797 . 0 0 "[ . 1 . 2 . 3]" 1
157 1 95 GLU H 1 95 GLU HG3 . . 4.440 4.072 3.616 4.441 0.001 18 0 "[ . 1 . 2 . 3]" 1
158 1 29 LYS H 1 29 LYS HB3 . . 4.030 3.642 2.986 4.048 0.018 30 0 "[ . 1 . 2 . 3]" 1
159 1 28 VAL H 1 29 LYS H . . 4.520 3.654 2.056 4.553 0.033 2 0 "[ . 1 . 2 . 3]" 1
160 1 28 VAL MG2 1 29 LYS H . . 4.270 3.801 2.210 4.270 . 11 0 "[ . 1 . 2 . 3]" 1
161 1 77 GLU H 1 77 GLU HG2 . . 4.460 4.167 3.320 4.513 0.053 28 0 "[ . 1 . 2 . 3]" 1
162 1 75 PHE HA 1 77 GLU H . . 5.500 4.690 4.032 5.240 . 0 0 "[ . 1 . 2 . 3]" 1
163 1 73 ILE MG 1 77 GLU H . . 5.300 4.112 3.615 5.308 0.008 12 0 "[ . 1 . 2 . 3]" 1
164 1 55 ARG HB3 1 58 ALA H . . 5.500 5.286 4.835 5.531 0.031 9 0 "[ . 1 . 2 . 3]" 1
165 1 58 ALA H 1 85 ILE MG . . 4.900 4.288 3.927 4.593 . 0 0 "[ . 1 . 2 . 3]" 1
166 1 39 GLU HB3 1 40 MET H . . 5.500 2.645 2.252 3.231 . 0 0 "[ . 1 . 2 . 3]" 1
167 1 39 GLU H 1 40 MET H . . 5.330 2.650 2.117 2.989 . 0 0 "[ . 1 . 2 . 3]" 1
168 1 4 TYR HB3 1 5 THR H . . 5.330 2.555 1.813 3.306 . 0 0 "[ . 1 . 2 . 3]" 1
169 1 90 ALA H 1 91 LYS H . . 5.100 2.824 2.593 3.016 . 0 0 "[ . 1 . 2 . 3]" 1
170 1 91 LYS H 1 92 LEU H . . 4.750 2.925 2.667 3.039 . 0 0 "[ . 1 . 2 . 3]" 1
171 1 81 LEU H 1 81 LEU HG . . 5.010 4.445 3.995 4.607 . 0 0 "[ . 1 . 2 . 3]" 1
172 1 81 LEU H 1 81 LEU MD2 . . 5.500 3.728 2.512 4.244 . 0 0 "[ . 1 . 2 . 3]" 1
173 1 31 LYS H 1 32 ILE H . . 4.280 3.785 2.536 4.357 0.077 12 0 "[ . 1 . 2 . 3]" 1
174 1 79 TRP H 1 80 THR H . . 5.360 2.864 2.730 3.049 . 0 0 "[ . 1 . 2 . 3]" 1
175 1 47 HIS HB2 1 48 MET H . . 4.300 2.963 2.246 3.837 . 0 0 "[ . 1 . 2 . 3]" 1
176 1 48 MET H 1 49 LEU H . . 4.300 2.884 2.418 3.442 . 0 0 "[ . 1 . 2 . 3]" 1
177 1 65 LEU H 1 66 ASP H . . 5.500 2.942 2.155 3.711 . 0 0 "[ . 1 . 2 . 3]" 1
178 1 29 LYS H 1 30 ASN H . . 3.250 2.925 2.531 3.324 0.074 11 0 "[ . 1 . 2 . 3]" 1
179 1 100 SER H 1 101 SER H . . 2.790 2.727 2.096 2.902 0.112 16 0 "[ . 1 . 2 . 3]" 1
180 1 99 GLN HB3 1 100 SER H . . 4.060 4.033 3.768 4.116 0.056 7 0 "[ . 1 . 2 . 3]" 1
181 1 98 GLN HA 1 100 SER H . . 4.140 3.989 3.687 4.205 0.065 28 0 "[ . 1 . 2 . 3]" 1
182 1 99 GLN H 1 100 SER H . . 3.530 2.223 2.016 2.391 . 0 0 "[ . 1 . 2 . 3]" 1
183 1 41 LEU H 1 42 GLN H . . 4.550 2.804 2.610 2.990 . 0 0 "[ . 1 . 2 . 3]" 1
184 1 41 LEU HB3 1 42 GLN H . . 4.520 3.887 3.150 4.337 . 0 0 "[ . 1 . 2 . 3]" 1
185 1 41 LEU HG 1 42 GLN H . . 5.320 4.756 4.533 5.426 0.106 14 0 "[ . 1 . 2 . 3]" 1
186 1 20 LYS HB2 1 21 TYR H . . 4.960 3.156 2.302 4.125 . 0 0 "[ . 1 . 2 . 3]" 1
187 1 55 ARG HB3 1 55 ARG HE . . 5.490 3.896 1.944 5.302 . 0 0 "[ . 1 . 2 . 3]" 1
188 1 55 ARG HB2 1 55 ARG HE . . 5.470 4.480 3.387 5.393 . 0 0 "[ . 1 . 2 . 3]" 1
189 1 93 ILE HA 1 96 GLN HE21 . . 5.200 5.162 4.556 5.322 0.122 24 0 "[ . 1 . 2 . 3]" 1
190 1 92 LEU MD1 1 96 GLN HE21 . . 4.820 3.562 2.670 4.566 . 0 0 "[ . 1 . 2 . 3]" 1
191 1 98 GLN HA 1 98 GLN HE21 . . 4.760 3.591 3.404 4.254 . 0 0 "[ . 1 . 2 . 3]" 1
192 1 54 ASN HD21 1 85 ILE MG . . 4.750 3.941 2.906 4.760 0.010 13 0 "[ . 1 . 2 . 3]" 1
193 1 54 ASN HD21 1 57 ALA MB . . 5.500 4.009 2.254 5.305 . 0 0 "[ . 1 . 2 . 3]" 1
194 1 56 LYS QG 1 57 ALA H . . 4.650 4.661 4.567 4.716 0.066 13 0 "[ . 1 . 2 . 3]" 1
195 1 54 ASN HD22 1 85 ILE MG . . 4.920 3.753 2.270 4.938 0.018 8 0 "[ . 1 . 2 . 3]" 1
196 1 47 HIS HB3 1 48 MET H . . 5.460 3.697 1.988 4.517 . 0 0 "[ . 1 . 2 . 3]" 1
197 1 79 TRP H 1 82 ILE H . . 5.500 5.335 5.066 5.511 0.011 8 0 "[ . 1 . 2 . 3]" 1
198 1 41 LEU MD2 1 44 GLU H . . 5.500 4.997 4.341 5.508 0.008 18 0 "[ . 1 . 2 . 3]" 1
199 1 31 LYS H 1 31 LYS HG2 . . 4.570 3.322 2.193 4.598 0.028 19 0 "[ . 1 . 2 . 3]" 1
200 1 42 GLN HE21 1 49 LEU MD2 . . 5.380 3.905 2.115 5.406 0.026 6 0 "[ . 1 . 2 . 3]" 1
201 1 42 GLN HE22 1 49 LEU MD2 . . 4.860 3.858 1.721 4.881 0.021 12 0 "[ . 1 . 2 . 3]" 1
202 1 53 GLY QA 1 56 LYS H . . 4.390 3.501 3.056 3.913 . 0 0 "[ . 1 . 2 . 3]" 1
203 1 74 SER H 1 75 PHE H . . 5.500 4.566 4.319 4.733 . 0 0 "[ . 1 . 2 . 3]" 1
204 1 78 TYR HB2 1 79 TRP H . . 4.940 3.694 3.365 3.952 . 0 0 "[ . 1 . 2 . 3]" 1
205 1 85 ILE H 1 86 THR H . . 4.000 2.278 2.099 2.482 . 0 0 "[ . 1 . 2 . 3]" 1
206 1 89 ILE MD 1 90 ALA H . . 4.710 3.832 2.729 4.609 . 0 0 "[ . 1 . 2 . 3]" 1
207 1 20 LYS HB3 1 21 TYR H . . 4.880 2.980 2.137 3.873 . 0 0 "[ . 1 . 2 . 3]" 1
208 1 101 SER QB 1 102 SER H . . 4.040 3.457 2.133 4.014 . 0 0 "[ . 1 . 2 . 3]" 1
209 1 63 GLN H 1 63 GLN HB3 . . 3.850 3.007 2.229 3.645 . 0 0 "[ . 1 . 2 . 3]" 1
210 1 63 GLN HB3 1 63 GLN HE22 . . 4.390 3.721 3.407 4.406 0.016 9 0 "[ . 1 . 2 . 3]" 1
211 1 58 ALA H 1 85 ILE MD . . 5.370 4.409 4.148 4.691 . 0 0 "[ . 1 . 2 . 3]" 1
212 1 92 LEU MD1 1 96 GLN H . . 5.500 3.732 3.332 4.142 . 0 0 "[ . 1 . 2 . 3]" 1
213 1 96 GLN HA 1 99 GLN H . . 3.910 3.677 3.174 4.006 0.096 1 0 "[ . 1 . 2 . 3]" 1
214 1 56 LYS H 1 56 LYS QG . . 3.910 3.533 3.309 3.787 . 0 0 "[ . 1 . 2 . 3]" 1
215 1 62 ILE HA 1 62 ILE MG . . 3.670 2.539 2.256 2.666 . 0 0 "[ . 1 . 2 . 3]" 1
216 1 62 ILE H 1 62 ILE MG . . 3.770 3.755 3.678 3.793 0.023 21 0 "[ . 1 . 2 . 3]" 1
217 1 72 ARG HB3 1 72 ARG HD3 . . 3.700 3.582 3.480 3.742 0.042 24 0 "[ . 1 . 2 . 3]" 1
218 1 72 ARG HD3 1 72 ARG QG . . 2.780 2.476 2.301 2.553 . 0 0 "[ . 1 . 2 . 3]" 1
219 1 72 ARG HB2 1 72 ARG HD3 . . 3.220 2.446 2.250 3.143 . 0 0 "[ . 1 . 2 . 3]" 1
220 1 72 ARG H 1 72 ARG HD3 . . 4.970 2.908 2.306 5.131 0.161 30 0 "[ . 1 . 2 . 3]" 1
221 1 99 GLN HE22 1 99 GLN HG3 . . 3.980 3.615 3.498 4.057 0.077 8 0 "[ . 1 . 2 . 3]" 1
222 1 99 GLN H 1 99 GLN HG3 . . 3.760 2.567 2.444 2.736 . 0 0 "[ . 1 . 2 . 3]" 1
223 1 99 GLN HG3 1 100 SER H . . 4.460 4.478 4.386 4.517 0.057 11 0 "[ . 1 . 2 . 3]" 1
224 1 7 LEU HB2 1 7 LEU MD2 . . 3.400 2.517 2.418 2.615 . 0 0 "[ . 1 . 2 . 3]" 1
225 1 7 LEU HB3 1 7 LEU MD2 . . 3.470 3.223 3.165 3.253 . 0 0 "[ . 1 . 2 . 3]" 1
226 1 7 LEU HA 1 7 LEU MD2 . . 3.410 2.131 2.033 2.236 . 0 0 "[ . 1 . 2 . 3]" 1
227 1 7 LEU H 1 7 LEU MD2 . . 4.500 4.138 3.983 4.282 . 0 0 "[ . 1 . 2 . 3]" 1
228 1 7 LEU MD2 1 8 GLU H . . 4.080 4.147 4.111 4.193 0.113 17 0 "[ . 1 . 2 . 3]" 1
229 1 95 GLU HA 1 98 GLN HG3 . . 3.860 3.555 2.456 3.895 0.035 14 0 "[ . 1 . 2 . 3]" 1
230 1 95 GLU HA 1 98 GLN HG2 . . 3.300 2.741 2.190 3.199 . 0 0 "[ . 1 . 2 . 3]" 1
231 1 95 GLU HA 1 95 GLU HG3 . . 3.420 2.250 2.095 2.484 . 0 0 "[ . 1 . 2 . 3]" 1
232 1 95 GLU HA 1 98 GLN H . . 4.530 3.805 3.354 4.159 . 0 0 "[ . 1 . 2 . 3]" 1
233 1 95 GLU HA 1 98 GLN HB3 . . 4.060 3.911 3.339 4.092 0.032 2 0 "[ . 1 . 2 . 3]" 1
234 1 4 TYR HB2 1 9 LYS HD2 . . 4.400 3.425 2.378 4.416 0.016 13 0 "[ . 1 . 2 . 3]" 1
235 1 92 LEU H 1 92 LEU HG . . 4.170 4.255 4.176 4.280 0.110 26 0 "[ . 1 . 2 . 3]" 1
236 1 92 LEU HA 1 92 LEU HG . . 3.810 3.719 3.666 3.762 . 0 0 "[ . 1 . 2 . 3]" 1
237 1 15 VAL H 1 15 VAL MG2 . . 3.900 3.053 2.303 3.915 0.015 11 0 "[ . 1 . 2 . 3]" 1
238 1 15 VAL MG2 1 16 GLU H . . 4.690 4.113 3.822 4.329 . 0 0 "[ . 1 . 2 . 3]" 1
239 1 15 VAL MG2 2 90 ALA HA . . 4.030 3.558 2.941 4.040 0.010 6 0 "[ . 1 . 2 . 3]" 1
240 1 15 VAL MG2 2 86 THR MG . . 4.600 2.253 1.926 3.174 . 0 0 "[ . 1 . 2 . 3]" 1
241 1 60 LYS HA 1 60 LYS QD . . 4.080 3.688 3.389 3.982 . 0 0 "[ . 1 . 2 . 3]" 1
242 1 60 LYS QB 1 60 LYS QD . . 2.480 2.444 2.231 2.523 0.043 13 0 "[ . 1 . 2 . 3]" 1
243 1 49 LEU MD1 1 51 ASP H . . 4.350 3.315 1.690 4.406 0.056 17 0 "[ . 1 . 2 . 3]" 1
244 1 49 LEU HB2 1 49 LEU MD1 . . 3.110 2.317 2.111 3.139 0.029 17 0 "[ . 1 . 2 . 3]" 1
245 1 49 LEU MD1 1 50 SER H . . 4.190 3.364 2.378 4.246 0.056 17 0 "[ . 1 . 2 . 3]" 1
246 1 49 LEU MD1 1 54 ASN HB3 . . 4.190 3.333 2.121 4.225 0.035 22 0 "[ . 1 . 2 . 3]" 1
247 1 49 LEU HA 1 49 LEU MD1 . . 3.670 2.966 1.938 3.722 0.052 21 0 "[ . 1 . 2 . 3]" 1
248 1 49 LEU MD1 1 54 ASN HB2 . . 4.190 3.971 3.051 4.255 0.065 29 0 "[ . 1 . 2 . 3]" 1
249 1 49 LEU H 1 49 LEU MD1 . . 3.810 3.505 2.736 3.861 0.051 16 0 "[ . 1 . 2 . 3]" 1
250 1 24 LYS HA 1 24 LYS HD2 . . 4.200 2.784 2.237 4.232 0.032 4 0 "[ . 1 . 2 . 3]" 1
251 1 12 ILE H 1 12 ILE MD . . 4.160 3.518 2.963 3.800 . 0 0 "[ . 1 . 2 . 3]" 1
252 1 51 ASP H 1 51 ASP QB . . 3.750 2.792 2.137 3.401 . 0 0 "[ . 1 . 2 . 3]" 1
253 1 51 ASP QB 1 52 THR H . . 4.060 2.780 1.783 3.562 . 0 0 "[ . 1 . 2 . 3]" 1
254 1 93 ILE HA 1 93 ILE HG13 . . 4.160 2.856 2.638 3.054 . 0 0 "[ . 1 . 2 . 3]" 1
255 1 93 ILE HA 1 96 GLN HB2 . . 4.240 3.070 2.458 3.534 . 0 0 "[ . 1 . 2 . 3]" 1
256 1 93 ILE HA 1 96 GLN HB3 . . 4.640 4.442 3.954 4.671 0.031 26 0 "[ . 1 . 2 . 3]" 1
257 1 93 ILE HA 1 93 ILE HG12 . . 4.100 2.568 2.478 2.665 . 0 0 "[ . 1 . 2 . 3]" 1
258 1 27 LEU H 1 27 LEU MD1 . . 4.570 3.772 3.418 4.575 0.005 16 0 "[ . 1 . 2 . 3]" 1
259 1 27 LEU HB3 1 27 LEU MD1 . . 2.620 2.380 2.332 2.469 . 0 0 "[ . 1 . 2 . 3]" 1
260 1 93 ILE HB 1 94 HIS H . . 4.800 2.399 2.287 2.497 . 0 0 "[ . 1 . 2 . 3]" 1
261 1 48 MET ME 2 12 ILE MD . . 3.610 3.284 2.138 3.621 0.011 25 0 "[ . 1 . 2 . 3]" 1
262 1 48 MET QB 1 48 MET ME . . 3.310 2.563 2.083 3.122 . 0 0 "[ . 1 . 2 . 3]" 1
263 1 48 MET ME 1 48 MET QG . . 3.220 2.144 2.035 2.323 . 0 0 "[ . 1 . 2 . 3]" 1
264 1 48 MET HA 1 48 MET ME . . 3.940 3.892 3.319 4.014 0.074 17 0 "[ . 1 . 2 . 3]" 1
265 1 48 MET ME 1 93 ILE MD . . 2.760 2.461 2.150 2.763 0.003 21 0 "[ . 1 . 2 . 3]" 1
266 1 48 MET ME 2 8 GLU HA . . 3.740 3.207 2.172 3.653 . 0 0 "[ . 1 . 2 . 3]" 1
267 1 85 ILE MG 1 86 THR H . . 3.930 3.540 3.249 3.745 . 0 0 "[ . 1 . 2 . 3]" 1
268 1 85 ILE HA 1 85 ILE MG . . 3.470 2.473 2.376 2.553 . 0 0 "[ . 1 . 2 . 3]" 1
269 1 29 LYS H 1 29 LYS HG3 . . 4.140 3.511 2.413 4.194 0.054 30 0 "[ . 1 . 2 . 3]" 1
270 1 29 LYS HA 1 29 LYS HG3 . . 3.900 3.671 3.289 3.864 . 0 0 "[ . 1 . 2 . 3]" 1
271 1 3 CYS HB3 1 4 TYR H . . 4.430 3.708 2.364 4.485 0.055 3 0 "[ . 1 . 2 . 3]" 1
272 1 65 LEU H 1 65 LEU MD1 . . 4.290 4.195 3.918 4.305 0.015 2 0 "[ . 1 . 2 . 3]" 1
273 1 65 LEU HA 1 65 LEU MD1 . . 3.590 2.484 2.029 3.662 0.072 12 0 "[ . 1 . 2 . 3]" 1
274 1 65 LEU HB3 1 65 LEU MD1 . . 3.140 2.397 2.247 2.674 . 0 0 "[ . 1 . 2 . 3]" 1
275 1 64 ASN HB2 1 65 LEU H . . 4.350 3.903 2.832 4.091 . 0 0 "[ . 1 . 2 . 3]" 1
276 1 64 ASN H 1 64 ASN HB2 . . 3.760 2.383 2.085 2.948 . 0 0 "[ . 1 . 2 . 3]" 1
277 1 76 ASP H 1 76 ASP HB2 . . 3.710 3.194 2.189 3.592 . 0 0 "[ . 1 . 2 . 3]" 1
278 1 76 ASP HB2 1 77 GLU H . . 4.520 3.539 2.405 4.252 . 0 0 "[ . 1 . 2 . 3]" 1
279 1 80 THR H 1 80 THR HB . . 4.150 2.482 2.292 3.299 . 0 0 "[ . 1 . 2 . 3]" 1
280 1 77 GLU HA 1 80 THR HB . . 4.650 4.418 3.730 4.703 0.053 29 0 "[ . 1 . 2 . 3]" 1
281 1 82 ILE MG 1 83 GLY H . . 4.340 2.949 2.548 3.243 . 0 0 "[ . 1 . 2 . 3]" 1
282 1 82 ILE HA 1 82 ILE MG . . 3.690 3.289 3.268 3.323 . 0 0 "[ . 1 . 2 . 3]" 1
283 1 82 ILE HG12 1 82 ILE MG . . 3.170 2.243 2.170 2.330 . 0 0 "[ . 1 . 2 . 3]" 1
284 1 82 ILE H 1 82 ILE MG . . 4.510 1.892 1.789 2.026 . 0 0 "[ . 1 . 2 . 3]" 1
285 1 48 MET QB 1 89 ILE MD . . 4.280 4.065 3.722 4.302 0.022 6 0 "[ . 1 . 2 . 3]" 1
286 1 43 LYS HA 1 43 LYS HG3 . . 3.940 2.706 2.145 3.961 0.021 10 0 "[ . 1 . 2 . 3]" 1
287 1 49 LEU MD2 1 55 ARG HA . . 5.500 3.952 2.745 5.347 . 0 0 "[ . 1 . 2 . 3]" 1
288 1 55 ARG HA 1 58 ALA H . . 4.100 3.370 3.057 3.658 . 0 0 "[ . 1 . 2 . 3]" 1
289 1 59 ASP HA 1 62 ILE H . . 3.760 3.576 3.248 3.775 0.015 12 0 "[ . 1 . 2 . 3]" 1
290 1 59 ASP HA 1 62 ILE MD . . 3.740 2.982 2.469 3.687 . 0 0 "[ . 1 . 2 . 3]" 1
291 1 58 ALA MB 1 59 ASP HA . . 4.140 4.048 3.830 4.155 0.015 2 0 "[ . 1 . 2 . 3]" 1
292 1 59 ASP HA 1 62 ILE HB . . 3.830 2.482 2.116 3.707 . 0 0 "[ . 1 . 2 . 3]" 1
293 1 59 ASP HA 1 61 LEU H . . 4.680 4.286 3.925 4.595 . 0 0 "[ . 1 . 2 . 3]" 1
294 1 98 GLN HG3 1 99 GLN HG3 . . 3.590 2.120 2.030 2.304 . 0 0 "[ . 1 . 2 . 3]" 1
295 1 98 GLN HA 1 98 GLN HG3 . . 3.850 3.642 3.617 3.666 . 0 0 "[ . 1 . 2 . 3]" 1
296 1 98 GLN H 1 98 GLN HG3 . . 3.490 3.141 2.550 3.466 . 0 0 "[ . 1 . 2 . 3]" 1
297 1 10 ALA MB 1 13 VAL HB . . 3.870 3.780 3.684 3.873 0.003 16 0 "[ . 1 . 2 . 3]" 1
298 1 10 ALA MB 1 13 VAL H . . 4.260 4.331 4.308 4.369 0.109 28 0 "[ . 1 . 2 . 3]" 1
299 1 10 ALA MB 1 14 LEU MD2 . . 3.630 3.654 3.553 3.685 0.055 27 0 "[ . 1 . 2 . 3]" 1
300 1 10 ALA H 1 10 ALA MB . . 3.400 2.197 2.139 2.262 . 0 0 "[ . 1 . 2 . 3]" 1
301 1 10 ALA MB 1 13 VAL MG2 . . 3.900 3.916 3.902 3.927 0.027 23 0 "[ . 1 . 2 . 3]" 1
302 1 7 LEU HA 1 10 ALA MB . . 3.710 2.541 2.117 2.907 . 0 0 "[ . 1 . 2 . 3]" 1
303 1 10 ALA MB 1 14 LEU H . . 4.830 4.645 4.495 4.806 . 0 0 "[ . 1 . 2 . 3]" 1
304 1 39 GLU H 1 39 GLU HG3 . . 4.870 4.533 4.133 4.809 . 0 0 "[ . 1 . 2 . 3]" 1
305 1 39 GLU HG3 1 40 MET H . . 4.520 4.496 4.080 4.662 0.142 12 0 "[ . 1 . 2 . 3]" 1
306 1 39 GLU HG3 1 43 LYS QE . . 4.300 4.107 3.195 4.333 0.033 3 0 "[ . 1 . 2 . 3]" 1
307 1 39 GLU HA 1 39 GLU HG3 . . 3.600 2.778 2.118 3.669 0.069 9 0 "[ . 1 . 2 . 3]" 1
308 1 13 VAL HB 1 14 LEU H . . 4.430 2.697 2.605 2.835 . 0 0 "[ . 1 . 2 . 3]" 1
309 1 9 LYS HA 1 9 LYS HD3 . . 4.300 3.696 3.423 4.315 0.015 20 0 "[ . 1 . 2 . 3]" 1
310 1 9 LYS HD3 1 9 LYS QG . . 2.480 2.142 2.105 2.274 . 0 0 "[ . 1 . 2 . 3]" 1
311 1 43 LYS H 1 43 LYS HG3 . . 3.870 3.099 2.471 3.801 . 0 0 "[ . 1 . 2 . 3]" 1
312 1 43 LYS QE 1 43 LYS HG3 . . 3.570 2.903 2.128 3.539 . 0 0 "[ . 1 . 2 . 3]" 1
313 1 43 LYS HG3 1 44 GLU H . . 4.940 4.637 4.358 5.014 0.074 26 0 "[ . 1 . 2 . 3]" 1
314 1 20 LYS HB3 1 20 LYS QD . . 3.090 2.579 2.041 3.203 0.113 26 0 "[ . 1 . 2 . 3]" 1
315 1 20 LYS H 1 20 LYS HB3 . . 3.730 3.135 2.390 3.685 . 0 0 "[ . 1 . 2 . 3]" 1
316 1 27 LEU HA 1 27 LEU HG . . 3.570 3.022 2.363 3.290 . 0 0 "[ . 1 . 2 . 3]" 1
317 1 62 ILE HA 1 62 ILE HG12 . . 3.690 2.538 2.323 3.691 0.001 21 0 "[ . 1 . 2 . 3]" 1
318 1 62 ILE HA 1 62 ILE MD . . 3.630 3.640 2.620 3.738 0.108 27 0 "[ . 1 . 2 . 3]" 1
319 1 62 ILE HA 1 65 LEU HB3 . . 4.490 4.371 3.678 4.558 0.068 16 0 "[ . 1 . 2 . 3]" 1
320 1 7 LEU HB2 1 7 LEU MD1 . . 3.360 3.232 3.194 3.265 . 0 0 "[ . 1 . 2 . 3]" 1
321 1 7 LEU HB3 1 7 LEU MD1 . . 3.160 2.316 2.234 2.410 . 0 0 "[ . 1 . 2 . 3]" 1
322 1 7 LEU MD1 1 8 GLU H . . 4.320 2.920 2.682 3.136 . 0 0 "[ . 1 . 2 . 3]" 1
323 1 99 GLN HA 1 99 GLN HG3 . . 3.260 3.035 2.772 3.233 . 0 0 "[ . 1 . 2 . 3]" 1
324 1 99 GLN HA 1 100 SER H . . 3.410 3.400 3.276 3.451 0.041 2 0 "[ . 1 . 2 . 3]" 1
325 1 99 GLN HA 1 99 GLN HB2 . . 3.020 3.037 3.028 3.042 0.022 24 0 "[ . 1 . 2 . 3]" 1
326 1 5 THR HB 1 6 GLU H . . 4.050 2.569 2.325 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
327 1 20 LYS HB3 1 20 LYS QE . . 3.670 3.057 2.040 3.784 0.114 5 0 "[ . 1 . 2 . 3]" 1
328 1 20 LYS QE 1 20 LYS HG2 . . 3.190 2.754 2.001 3.298 0.108 10 0 "[ . 1 . 2 . 3]" 1
329 1 20 LYS QE 1 20 LYS HG3 . . 3.650 2.618 1.988 3.368 . 0 0 "[ . 1 . 2 . 3]" 1
330 1 6 GLU H 1 6 GLU QB . . 3.720 2.477 2.258 2.729 . 0 0 "[ . 1 . 2 . 3]" 1
331 1 6 GLU QB 1 7 LEU H . . 4.290 3.781 3.558 3.934 . 0 0 "[ . 1 . 2 . 3]" 1
332 1 36 SER HA 1 39 GLU HB2 . . 4.180 3.306 2.549 4.144 . 0 0 "[ . 1 . 2 . 3]" 1
333 1 16 GLU HG2 1 17 ASN H . . 4.780 4.495 3.372 4.822 0.042 13 0 "[ . 1 . 2 . 3]" 1
334 1 97 GLU HA 1 98 GLN H . . 3.530 3.545 3.499 3.593 0.063 23 0 "[ . 1 . 2 . 3]" 1
335 1 29 LYS HA 1 29 LYS QD . . 3.390 2.607 2.173 3.473 0.083 7 0 "[ . 1 . 2 . 3]" 1
336 1 55 ARG HA 1 55 ARG HD2 . . 4.150 2.910 2.015 3.869 . 0 0 "[ . 1 . 2 . 3]" 1
337 1 55 ARG HB3 1 55 ARG HD2 . . 3.720 2.906 2.109 3.812 0.092 23 0 "[ . 1 . 2 . 3]" 1
338 1 49 LEU MD2 1 55 ARG HD2 . . 3.770 3.102 2.041 3.815 0.045 2 0 "[ . 1 . 2 . 3]" 1
339 1 42 GLN HB2 1 42 GLN HE21 . . 4.060 3.725 2.411 4.174 0.114 24 0 "[ . 1 . 2 . 3]" 1
340 1 42 GLN HB2 1 43 LYS H . . 3.460 3.057 2.473 3.346 . 0 0 "[ . 1 . 2 . 3]" 1
341 1 42 GLN H 1 42 GLN HB2 . . 4.090 2.308 2.093 2.781 . 0 0 "[ . 1 . 2 . 3]" 1
342 1 39 GLU HA 1 42 GLN HB2 . . 2.960 2.222 2.059 2.466 . 0 0 "[ . 1 . 2 . 3]" 1
343 1 93 ILE H 1 93 ILE MG . . 4.340 3.790 3.710 3.871 . 0 0 "[ . 1 . 2 . 3]" 1
344 1 93 ILE HG12 1 93 ILE MG . . 3.680 2.416 2.313 2.535 . 0 0 "[ . 1 . 2 . 3]" 1
345 1 55 ARG HB3 1 56 LYS H . . 3.800 3.573 2.663 3.856 0.056 15 0 "[ . 1 . 2 . 3]" 1
346 1 55 ARG H 1 55 ARG HB3 . . 3.750 3.563 2.860 3.729 . 0 0 "[ . 1 . 2 . 3]" 1
347 1 85 ILE HG13 1 86 THR H . . 4.080 4.081 3.881 4.131 0.051 23 0 "[ . 1 . 2 . 3]" 1
348 1 85 ILE H 1 85 ILE HG13 . . 4.460 2.377 2.194 2.546 . 0 0 "[ . 1 . 2 . 3]" 1
349 1 60 LYS QE 1 60 LYS HG3 . . 3.100 2.471 2.316 2.836 . 0 0 "[ . 1 . 2 . 3]" 1
350 1 91 LYS HA 1 91 LYS HG3 . . 3.790 3.523 2.538 3.708 . 0 0 "[ . 1 . 2 . 3]" 1
351 1 91 LYS H 1 91 LYS HG3 . . 3.880 3.627 2.266 3.908 0.028 14 0 "[ . 1 . 2 . 3]" 1
352 1 78 TYR HA 1 81 LEU QB . . 3.650 2.778 2.312 3.102 . 0 0 "[ . 1 . 2 . 3]" 1
353 1 78 TYR HA 1 81 LEU H . . 4.260 3.824 3.415 4.221 . 0 0 "[ . 1 . 2 . 3]" 1
354 1 73 ILE MG 1 78 TYR HA . . 3.780 2.788 2.113 3.714 . 0 0 "[ . 1 . 2 . 3]" 1
355 1 82 ILE HA 1 82 ILE HG13 . . 4.040 2.376 2.281 2.508 . 0 0 "[ . 1 . 2 . 3]" 1
356 1 82 ILE HA 1 85 ILE HB . . 4.120 2.951 2.579 3.624 . 0 0 "[ . 1 . 2 . 3]" 1
357 1 14 LEU MD2 1 15 VAL H . . 4.620 4.611 4.510 4.676 0.056 27 0 "[ . 1 . 2 . 3]" 1
358 1 14 LEU HB3 1 14 LEU MD2 . . 3.220 3.227 3.196 3.247 0.027 9 0 "[ . 1 . 2 . 3]" 1
359 1 11 VAL HA 1 14 LEU MD2 . . 4.350 3.948 3.701 4.218 . 0 0 "[ . 1 . 2 . 3]" 1
360 1 14 LEU MD2 1 82 ILE MG . . 3.930 3.962 3.934 3.990 0.060 12 0 "[ . 1 . 2 . 3]" 1
361 1 14 LEU HB2 1 14 LEU MD2 . . 3.670 2.380 2.314 2.432 . 0 0 "[ . 1 . 2 . 3]" 1
362 1 14 LEU H 1 14 LEU MD2 . . 3.960 2.723 2.568 2.893 . 0 0 "[ . 1 . 2 . 3]" 1
363 1 11 VAL HA 1 11 VAL MG1 . . 3.680 2.489 2.373 2.650 . 0 0 "[ . 1 . 2 . 3]" 1
364 1 11 VAL H 1 11 VAL MG1 . . 3.670 3.727 3.698 3.746 0.076 6 0 "[ . 1 . 2 . 3]" 1
365 1 89 ILE HG12 1 89 ILE MG . . 3.550 2.323 2.193 2.461 . 0 0 "[ . 1 . 2 . 3]" 1
366 1 89 ILE HA 1 89 ILE MG . . 3.400 2.217 2.154 2.307 . 0 0 "[ . 1 . 2 . 3]" 1
367 1 89 ILE HG13 1 89 ILE MG . . 3.520 2.937 2.404 3.277 . 0 0 "[ . 1 . 2 . 3]" 1
368 1 89 ILE MG 1 90 ALA H . . 4.150 4.187 4.166 4.215 0.065 3 0 "[ . 1 . 2 . 3]" 1
369 1 89 ILE H 1 89 ILE MG . . 3.620 2.274 2.081 2.636 . 0 0 "[ . 1 . 2 . 3]" 1
370 1 41 LEU HA 1 41 LEU MD1 . . 3.880 3.763 2.269 3.894 0.014 7 0 "[ . 1 . 2 . 3]" 1
371 1 56 LYS QB 1 56 LYS QG . . 2.400 2.002 1.973 2.035 . 0 0 "[ . 1 . 2 . 3]" 1
372 1 56 LYS QB 1 56 LYS QD . . 2.740 2.269 2.073 2.690 . 0 0 "[ . 1 . 2 . 3]" 1
373 1 56 LYS H 1 56 LYS QB . . 3.270 2.347 2.184 2.522 . 0 0 "[ . 1 . 2 . 3]" 1
374 1 53 GLY QA 1 56 LYS QB . . 3.780 3.247 2.582 3.805 0.025 29 0 "[ . 1 . 2 . 3]" 1
375 1 60 LYS HA 1 60 LYS HG3 . . 3.430 3.470 3.439 3.504 0.074 3 0 "[ . 1 . 2 . 3]" 1
376 1 60 LYS HA 1 63 GLN H . . 3.720 3.698 3.483 3.784 0.064 11 0 "[ . 1 . 2 . 3]" 1
377 1 60 LYS HA 1 60 LYS QB . . 2.520 2.354 2.288 2.426 . 0 0 "[ . 1 . 2 . 3]" 1
378 1 60 LYS HA 1 61 LEU H . . 3.540 3.516 3.446 3.560 0.020 14 0 "[ . 1 . 2 . 3]" 1
379 1 12 ILE HA 1 15 VAL MG2 . . 4.490 3.670 2.850 4.566 0.076 2 0 "[ . 1 . 2 . 3]" 1
380 1 12 ILE HA 1 12 ILE MD . . 4.590 3.787 2.252 3.920 . 0 0 "[ . 1 . 2 . 3]" 1
381 1 12 ILE HA 1 12 ILE HG13 . . 3.740 2.988 2.762 3.802 0.062 17 0 "[ . 1 . 2 . 3]" 1
382 1 12 ILE HA 1 15 VAL HB . . 4.180 2.918 2.106 4.231 0.051 15 0 "[ . 1 . 2 . 3]" 1
383 1 43 LYS H 1 43 LYS HB2 . . 4.170 2.379 2.107 3.015 . 0 0 "[ . 1 . 2 . 3]" 1
384 1 43 LYS HB2 1 44 GLU H . . 4.580 2.360 1.998 2.925 . 0 0 "[ . 1 . 2 . 3]" 1
385 1 64 ASN HB3 1 65 LEU H . . 5.010 2.830 2.457 3.743 . 0 0 "[ . 1 . 2 . 3]" 1
386 1 64 ASN H 1 64 ASN HB3 . . 4.180 2.565 2.227 3.696 . 0 0 "[ . 1 . 2 . 3]" 1
387 1 28 VAL H 1 28 VAL HB . . 3.860 3.002 2.279 3.833 . 0 0 "[ . 1 . 2 . 3]" 1
388 1 28 VAL HB 1 29 LYS H . . 4.240 3.931 3.237 4.269 0.029 21 0 "[ . 1 . 2 . 3]" 1
389 1 6 GLU H 1 6 GLU HG3 . . 4.060 3.941 3.681 4.100 0.040 26 0 "[ . 1 . 2 . 3]" 1
390 1 6 GLU HG3 1 7 LEU H . . 4.070 3.671 3.136 4.103 0.033 28 0 "[ . 1 . 2 . 3]" 1
391 1 91 LYS HA 1 91 LYS HB2 . . 2.950 2.887 2.323 3.007 0.057 18 0 "[ . 1 . 2 . 3]" 1
392 1 91 LYS HA 1 91 LYS HB3 . . 2.990 2.826 2.411 3.013 0.023 10 0 "[ . 1 . 2 . 3]" 1
393 1 3 CYS HB2 1 4 TYR H . . 4.430 3.487 1.876 4.450 0.020 6 0 "[ . 1 . 2 . 3]" 1
394 1 13 VAL MG2 2 6 GLU QB . . 3.880 3.448 2.742 3.801 . 0 0 "[ . 1 . 2 . 3]" 1
395 1 13 VAL H 1 13 VAL MG2 . . 4.320 2.395 2.279 2.527 . 0 0 "[ . 1 . 2 . 3]" 1
396 1 13 VAL MG2 2 6 GLU HG2 . . 3.860 3.836 3.107 3.920 0.060 14 0 "[ . 1 . 2 . 3]" 1
397 1 13 VAL MG2 1 14 LEU H . . 4.020 4.053 4.030 4.075 0.055 5 0 "[ . 1 . 2 . 3]" 1
398 1 49 LEU HG 1 50 SER H . . 4.480 4.354 3.005 4.610 0.130 3 0 "[ . 1 . 2 . 3]" 1
399 1 24 LYS H 1 24 LYS HG2 . . 5.020 4.206 1.989 4.816 . 0 0 "[ . 1 . 2 . 3]" 1
400 1 12 ILE H 1 12 ILE HG12 . . 3.990 3.396 2.100 3.724 . 0 0 "[ . 1 . 2 . 3]" 1
401 1 52 THR H 1 52 THR HB . . 3.920 2.374 2.014 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
402 1 52 THR HB 1 53 GLY H . . 3.920 3.568 2.163 4.041 0.121 29 0 "[ . 1 . 2 . 3]" 1
403 1 29 LYS HB3 1 29 LYS HG3 . . 3.000 2.663 2.440 3.013 0.013 13 0 "[ . 1 . 2 . 3]" 1
404 1 29 LYS HB3 1 30 ASN H . . 4.230 3.734 2.008 4.302 0.072 7 0 "[ . 1 . 2 . 3]" 1
405 1 27 LEU H 1 27 LEU HB3 . . 3.990 3.640 3.184 4.018 0.028 24 0 "[ . 1 . 2 . 3]" 1
406 1 96 GLN HE21 1 96 GLN HG2 . . 3.560 2.343 2.010 3.372 . 0 0 "[ . 1 . 2 . 3]" 1
407 1 96 GLN HA 1 96 GLN HG2 . . 3.550 2.621 2.262 2.780 . 0 0 "[ . 1 . 2 . 3]" 1
408 1 96 GLN HB2 1 96 GLN HG2 . . 3.010 2.972 2.851 3.019 0.009 14 0 "[ . 1 . 2 . 3]" 1
409 1 41 LEU HB3 1 41 LEU MD1 . . 3.230 2.287 2.007 2.412 . 0 0 "[ . 1 . 2 . 3]" 1
410 1 41 LEU H 1 41 LEU MD1 . . 4.270 3.703 3.447 3.963 . 0 0 "[ . 1 . 2 . 3]" 1
411 1 41 LEU MD1 1 42 GLN H . . 5.080 4.951 4.333 5.258 0.178 27 0 "[ . 1 . 2 . 3]" 1
412 1 91 LYS H 1 91 LYS HB3 . . 3.640 3.200 2.600 3.579 . 0 0 "[ . 1 . 2 . 3]" 1
413 1 65 LEU HB2 1 65 LEU MD2 . . 3.490 2.429 2.241 3.282 . 0 0 "[ . 1 . 2 . 3]" 1
414 1 65 LEU HA 1 65 LEU MD2 . . 3.590 2.270 2.078 2.775 . 0 0 "[ . 1 . 2 . 3]" 1
415 1 65 LEU HB3 1 65 LEU MD2 . . 3.510 3.223 2.553 3.267 . 0 0 "[ . 1 . 2 . 3]" 1
416 1 60 LYS HA 1 63 GLN HB2 . . 3.670 3.456 2.803 3.707 0.037 12 0 "[ . 1 . 2 . 3]" 1
417 1 63 GLN H 1 63 GLN HB2 . . 3.410 2.323 2.133 2.516 . 0 0 "[ . 1 . 2 . 3]" 1
418 1 63 GLN HB2 1 64 ASN H . . 3.900 3.562 2.748 3.926 0.026 14 0 "[ . 1 . 2 . 3]" 1
419 1 63 GLN HA 1 63 GLN HB2 . . 2.840 2.712 2.373 2.936 0.096 13 0 "[ . 1 . 2 . 3]" 1
420 1 63 GLN HB2 1 63 GLN HE21 . . 3.990 3.202 2.066 3.762 . 0 0 "[ . 1 . 2 . 3]" 1
421 1 72 ARG HA 1 72 ARG HD3 . . 3.640 3.489 2.218 3.716 0.076 1 0 "[ . 1 . 2 . 3]" 1
422 1 72 ARG HA 1 73 ILE H . . 3.430 2.195 2.050 2.450 . 0 0 "[ . 1 . 2 . 3]" 1
423 1 79 TRP HB2 1 80 THR H . . 5.230 3.203 2.993 3.439 . 0 0 "[ . 1 . 2 . 3]" 1
424 1 82 ILE HG12 1 83 GLY H . . 4.240 4.238 4.147 4.286 0.046 5 0 "[ . 1 . 2 . 3]" 1
425 1 58 ALA HA 1 85 ILE MD . . 3.700 3.038 2.728 3.418 . 0 0 "[ . 1 . 2 . 3]" 1
426 1 58 ALA HA 1 62 ILE MD . . 3.770 3.811 3.787 3.845 0.075 7 0 "[ . 1 . 2 . 3]" 1
427 1 58 ALA HA 1 61 LEU HB3 . . 4.100 4.136 4.064 4.198 0.098 15 0 "[ . 1 . 2 . 3]" 1
428 1 58 ALA HA 1 61 LEU HB2 . . 3.970 2.590 2.461 2.854 . 0 0 "[ . 1 . 2 . 3]" 1
429 1 58 ALA HA 1 60 LYS H . . 4.300 4.333 4.277 4.364 0.064 8 0 "[ . 1 . 2 . 3]" 1
430 1 58 ALA HA 1 61 LEU H . . 4.690 3.309 3.127 3.435 . 0 0 "[ . 1 . 2 . 3]" 1
431 1 39 GLU H 1 39 GLU HB2 . . 4.050 2.719 2.010 3.299 . 0 0 "[ . 1 . 2 . 3]" 1
432 1 39 GLU HA 1 39 GLU HB2 . . 2.980 2.449 2.215 2.907 . 0 0 "[ . 1 . 2 . 3]" 1
433 1 45 LEU MD2 2 8 GLU HG2 . . 4.430 2.724 2.059 4.454 0.024 9 0 "[ . 1 . 2 . 3]" 1
434 1 45 LEU HA 1 45 LEU MD2 . . 3.470 2.804 2.114 3.491 0.021 13 0 "[ . 1 . 2 . 3]" 1
435 1 45 LEU MD2 1 82 ILE MD . . 3.800 2.244 1.962 3.814 0.014 3 0 "[ . 1 . 2 . 3]" 1
436 1 45 LEU MD2 2 8 GLU HG3 . . 4.100 3.057 2.107 4.035 . 0 0 "[ . 1 . 2 . 3]" 1
437 1 45 LEU HB2 1 45 LEU MD2 . . 3.200 2.937 2.405 3.229 0.029 14 0 "[ . 1 . 2 . 3]" 1
438 1 45 LEU H 1 45 LEU MD2 . . 4.630 4.089 2.366 4.655 0.025 19 0 "[ . 1 . 2 . 3]" 1
439 1 45 LEU HB3 1 45 LEU MD2 . . 3.490 2.330 2.079 3.275 . 0 0 "[ . 1 . 2 . 3]" 1
440 1 50 SER HB2 1 51 ASP H . . 4.220 3.761 2.116 4.299 0.079 15 0 "[ . 1 . 2 . 3]" 1
441 1 50 SER H 1 50 SER HB2 . . 4.110 3.096 2.145 4.011 . 0 0 "[ . 1 . 2 . 3]" 1
442 1 16 GLU HA 1 16 GLU HG2 . . 3.820 2.589 2.319 3.830 0.010 26 0 "[ . 1 . 2 . 3]" 1
443 1 42 GLN HA 1 42 GLN HG2 . . 3.550 2.368 2.095 2.704 . 0 0 "[ . 1 . 2 . 3]" 1
444 1 42 GLN HE21 1 42 GLN HG2 . . 3.580 3.053 2.265 3.604 0.024 3 0 "[ . 1 . 2 . 3]" 1
445 1 42 GLN HG2 1 43 LYS H . . 5.120 4.948 4.562 5.171 0.051 29 0 "[ . 1 . 2 . 3]" 1
446 1 42 GLN HB3 1 42 GLN HG2 . . 2.850 2.769 2.436 2.969 0.119 17 0 "[ . 1 . 2 . 3]" 1
447 1 42 GLN H 1 42 GLN HG2 . . 3.560 3.340 2.780 3.685 0.125 24 0 "[ . 1 . 2 . 3]" 1
448 1 42 GLN HE22 1 42 GLN HG2 . . 3.870 3.830 3.535 3.998 0.128 4 0 "[ . 1 . 2 . 3]" 1
449 1 56 LYS H 1 56 LYS QD . . 3.680 2.155 1.907 2.496 . 0 0 "[ . 1 . 2 . 3]" 1
450 1 56 LYS QD 1 57 ALA H . . 4.290 4.314 4.034 4.406 0.116 24 0 "[ . 1 . 2 . 3]" 1
451 1 56 LYS HA 1 56 LYS QD . . 3.260 2.883 2.126 3.304 0.044 15 0 "[ . 1 . 2 . 3]" 1
452 1 53 GLY QA 1 56 LYS QD . . 3.780 3.182 2.196 3.826 0.046 16 0 "[ . 1 . 2 . 3]" 1
453 1 62 ILE HG12 1 62 ILE MG . . 3.310 2.379 2.263 3.135 . 0 0 "[ . 1 . 2 . 3]" 1
454 1 73 ILE HA 1 73 ILE MD . . 4.270 2.683 2.201 3.454 . 0 0 "[ . 1 . 2 . 3]" 1
455 1 73 ILE H 1 73 ILE MD . . 4.930 3.460 2.717 4.102 . 0 0 "[ . 1 . 2 . 3]" 1
456 1 72 ARG H 1 73 ILE MD . . 4.540 4.139 3.430 4.569 0.029 16 0 "[ . 1 . 2 . 3]" 1
457 1 4 TYR HB3 1 9 LYS HD2 . . 4.230 3.932 2.968 4.283 0.053 2 0 "[ . 1 . 2 . 3]" 1
458 1 92 LEU H 1 92 LEU MD1 . . 4.410 4.144 3.902 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
459 1 92 LEU HB3 1 92 LEU MD1 . . 3.210 2.290 2.222 2.374 . 0 0 "[ . 1 . 2 . 3]" 1
460 1 92 LEU HA 1 92 LEU MD1 . . 3.230 3.131 2.185 3.309 0.079 28 0 "[ . 1 . 2 . 3]" 1
461 1 92 LEU HB2 1 92 LEU MD1 . . 3.190 3.204 3.176 3.218 0.028 24 0 "[ . 1 . 2 . 3]" 1
462 1 15 VAL H 1 15 VAL MG1 . . 4.660 3.355 2.163 3.848 . 0 0 "[ . 1 . 2 . 3]" 1
463 1 15 VAL MG1 1 16 GLU H . . 4.700 3.126 2.443 3.641 . 0 0 "[ . 1 . 2 . 3]" 1
464 1 15 VAL MG1 2 90 ALA MB . . 3.820 2.580 2.126 3.616 . 0 0 "[ . 1 . 2 . 3]" 1
465 1 60 LYS QD 1 60 LYS QE . . 2.400 2.116 2.089 2.130 . 0 0 "[ . 1 . 2 . 3]" 1
466 1 69 HIS HB2 1 70 ASP H . . 4.720 4.455 4.113 4.663 . 0 0 "[ . 1 . 2 . 3]" 1
467 1 24 LYS QE 1 24 LYS HG2 . . 3.680 2.332 2.158 3.099 . 0 0 "[ . 1 . 2 . 3]" 1
468 1 24 LYS HA 1 24 LYS QE . . 4.380 4.225 3.835 4.432 0.052 11 0 "[ . 1 . 2 . 3]" 1
469 1 24 LYS QE 1 24 LYS HG3 . . 3.720 2.502 2.218 3.299 . 0 0 "[ . 1 . 2 . 3]" 1
470 1 24 LYS QB 1 24 LYS QE . . 3.610 3.552 2.297 3.681 0.071 3 0 "[ . 1 . 2 . 3]" 1
471 1 95 GLU H 1 95 GLU HB3 . . 3.780 3.141 2.365 3.363 . 0 0 "[ . 1 . 2 . 3]" 1
472 1 92 LEU HA 1 95 GLU HB3 . . 3.150 3.151 2.455 3.223 0.073 20 0 "[ . 1 . 2 . 3]" 1
473 1 95 GLU HB3 1 96 GLN H . . 3.750 2.579 2.409 3.052 . 0 0 "[ . 1 . 2 . 3]" 1
474 1 101 SER H 1 101 SER QB . . 3.390 2.647 2.184 3.440 0.050 8 0 "[ . 1 . 2 . 3]" 1
475 1 27 LEU HA 1 27 LEU MD2 . . 3.500 2.195 2.106 2.658 . 0 0 "[ . 1 . 2 . 3]" 1
476 1 27 LEU HB3 1 27 LEU MD2 . . 2.470 2.420 2.351 2.482 0.012 8 0 "[ . 1 . 2 . 3]" 1
477 1 27 LEU HB2 1 27 LEU MD2 . . 3.490 3.260 3.242 3.267 . 0 0 "[ . 1 . 2 . 3]" 1
478 1 93 ILE H 1 93 ILE HG13 . . 4.770 2.207 2.035 2.328 . 0 0 "[ . 1 . 2 . 3]" 1
479 1 82 ILE HA 1 85 ILE MD . . 4.030 2.396 2.158 2.759 . 0 0 "[ . 1 . 2 . 3]" 1
480 1 85 ILE HA 1 85 ILE MD . . 3.920 3.926 3.879 3.951 0.031 3 0 "[ . 1 . 2 . 3]" 1
481 1 61 LEU HB2 1 85 ILE MD . . 4.130 4.002 3.661 4.156 0.026 16 0 "[ . 1 . 2 . 3]" 1
482 1 85 ILE H 1 85 ILE MD . . 4.260 3.785 3.646 3.895 . 0 0 "[ . 1 . 2 . 3]" 1
483 1 85 ILE HB 1 85 ILE MD . . 3.590 2.482 2.388 2.597 . 0 0 "[ . 1 . 2 . 3]" 1
484 1 43 LYS HA 1 43 LYS HD3 . . 4.280 4.181 3.573 4.372 0.092 2 0 "[ . 1 . 2 . 3]" 1
485 1 43 LYS H 1 43 LYS HD3 . . 3.640 3.439 1.803 3.794 0.154 3 0 "[ . 1 . 2 . 3]" 1
486 1 41 LEU HA 1 41 LEU MD2 . . 3.640 2.121 2.005 2.389 . 0 0 "[ . 1 . 2 . 3]" 1
487 1 41 LEU HB3 1 41 LEU MD2 . . 3.390 2.515 2.357 3.272 . 0 0 "[ . 1 . 2 . 3]" 1
488 1 41 LEU H 1 41 LEU MD2 . . 3.880 3.327 2.151 3.823 . 0 0 "[ . 1 . 2 . 3]" 1
489 1 41 LEU MD2 1 42 GLN H . . 4.770 4.718 4.149 4.817 0.047 26 0 "[ . 1 . 2 . 3]" 1
490 1 41 LEU HB2 1 41 LEU MD2 . . 3.250 3.237 2.660 3.275 0.025 29 0 "[ . 1 . 2 . 3]" 1
491 1 36 SER H 1 36 SER HB3 . . 3.880 2.973 2.228 3.694 . 0 0 "[ . 1 . 2 . 3]" 1
492 1 76 ASP H 1 76 ASP HB3 . . 3.710 2.768 2.375 3.570 . 0 0 "[ . 1 . 2 . 3]" 1
493 1 76 ASP HB3 1 77 GLU H . . 4.120 3.788 2.577 4.155 0.035 10 0 "[ . 1 . 2 . 3]" 1
494 1 81 LEU HA 1 84 GLY H . . 4.280 4.155 3.759 4.333 0.053 15 0 "[ . 1 . 2 . 3]" 1
495 1 81 LEU HA 1 81 LEU MD1 . . 3.410 2.597 2.056 3.047 . 0 0 "[ . 1 . 2 . 3]" 1
496 1 82 ILE MD 1 82 ILE MG . . 3.110 2.118 2.053 2.216 . 0 0 "[ . 1 . 2 . 3]" 1
497 1 82 ILE HA 1 82 ILE MD . . 3.700 3.565 3.386 3.682 . 0 0 "[ . 1 . 2 . 3]" 1
498 1 41 LEU MD1 1 82 ILE MD . . 3.040 2.722 1.953 3.060 0.020 30 0 "[ . 1 . 2 . 3]" 1
499 1 82 ILE MD 1 85 ILE MD . . 3.150 2.762 2.413 3.150 . 0 0 "[ . 1 . 2 . 3]" 1
500 1 48 MET ME 1 82 ILE MD . . 3.780 3.649 3.032 3.799 0.019 1 0 "[ . 1 . 2 . 3]" 1
501 1 82 ILE H 1 82 ILE MD . . 4.340 4.398 4.372 4.460 0.120 12 0 "[ . 1 . 2 . 3]" 1
502 1 14 LEU HB3 1 14 LEU MD1 . . 3.540 2.435 2.393 2.484 . 0 0 "[ . 1 . 2 . 3]" 1
503 1 14 LEU H 1 14 LEU MD1 . . 4.260 4.087 4.017 4.180 . 0 0 "[ . 1 . 2 . 3]" 1
504 1 80 THR H 1 80 THR MG . . 3.690 2.392 2.087 3.554 . 0 0 "[ . 1 . 2 . 3]" 1
505 1 80 THR HA 1 80 THR MG . . 3.180 3.175 2.147 3.224 0.044 23 0 "[ . 1 . 2 . 3]" 1
506 1 48 MET HA 1 48 MET QG . . 3.560 2.659 2.262 3.021 . 0 0 "[ . 1 . 2 . 3]" 1
507 1 48 MET H 1 48 MET QG . . 4.430 4.055 3.811 4.436 0.006 29 0 "[ . 1 . 2 . 3]" 1
508 1 48 MET QG 1 89 ILE MD . . 3.200 2.376 2.001 2.830 . 0 0 "[ . 1 . 2 . 3]" 1
509 1 48 MET QG 1 49 LEU H . . 5.500 4.177 3.507 4.711 . 0 0 "[ . 1 . 2 . 3]" 1
510 1 89 ILE H 1 89 ILE HG12 . . 4.780 2.744 1.982 3.655 . 0 0 "[ . 1 . 2 . 3]" 1
511 1 40 MET HA 1 40 MET ME . . 5.500 4.549 3.819 5.262 . 0 0 "[ . 1 . 2 . 3]" 1
512 1 43 LYS H 1 43 LYS HB3 . . 4.040 3.559 3.415 3.830 . 0 0 "[ . 1 . 2 . 3]" 1
513 1 43 LYS HB3 1 44 GLU H . . 4.430 3.194 2.828 4.094 . 0 0 "[ . 1 . 2 . 3]" 1
514 1 48 MET HA 1 89 ILE MD . . 4.060 4.063 3.793 4.110 0.050 5 0 "[ . 1 . 2 . 3]" 1
515 1 55 ARG HB2 1 55 ARG HD2 . . 4.020 3.497 2.283 4.098 0.078 27 0 "[ . 1 . 2 . 3]" 1
516 1 55 ARG HB2 1 56 LYS H . . 3.760 2.979 2.455 3.789 0.029 10 0 "[ . 1 . 2 . 3]" 1
517 1 55 ARG H 1 55 ARG HB2 . . 3.800 2.554 2.165 2.826 . 0 0 "[ . 1 . 2 . 3]" 1
518 1 59 ASP H 1 59 ASP HB2 . . 4.020 2.303 2.091 2.515 . 0 0 "[ . 1 . 2 . 3]" 1
519 1 59 ASP HB2 1 60 LYS H . . 3.900 3.113 2.486 3.918 0.018 9 0 "[ . 1 . 2 . 3]" 1
520 1 56 LYS QG 1 59 ASP HB2 . . 4.250 3.663 3.233 4.253 0.003 8 0 "[ . 1 . 2 . 3]" 1
521 1 11 VAL HA 1 14 LEU H . . 4.220 3.835 3.640 4.105 . 0 0 "[ . 1 . 2 . 3]" 1
522 1 9 LYS HA 1 12 ILE MD . . 3.970 2.660 2.312 3.979 0.009 17 0 "[ . 1 . 2 . 3]" 1
523 1 9 LYS HA 1 9 LYS QG . . 3.910 2.856 2.130 3.108 . 0 0 "[ . 1 . 2 . 3]" 1
524 1 9 LYS HA 1 12 ILE H . . 4.560 3.353 2.959 3.663 . 0 0 "[ . 1 . 2 . 3]" 1
525 1 14 LEU HA 1 14 LEU MD2 . . 3.770 2.509 2.341 2.679 . 0 0 "[ . 1 . 2 . 3]" 1
526 1 14 LEU HA 1 14 LEU MD1 . . 3.580 2.051 1.998 2.108 . 0 0 "[ . 1 . 2 . 3]" 1
527 1 14 LEU HA 1 14 LEU HG . . 3.860 3.679 3.648 3.720 . 0 0 "[ . 1 . 2 . 3]" 1
528 1 9 LYS HB3 1 10 ALA H . . 4.000 3.740 3.295 4.049 0.049 6 0 "[ . 1 . 2 . 3]" 1
529 1 6 GLU HA 1 9 LYS HB3 . . 3.880 3.780 3.522 3.943 0.063 27 0 "[ . 1 . 2 . 3]" 1
530 1 9 LYS HB3 1 9 LYS QG . . 2.400 2.376 2.262 2.456 0.056 8 0 "[ . 1 . 2 . 3]" 1
531 1 17 ASN HA 1 20 LYS HB3 . . 4.230 3.233 2.048 4.288 0.058 15 0 "[ . 1 . 2 . 3]" 1
532 1 17 ASN HA 1 20 LYS H . . 4.030 3.395 2.748 3.957 . 0 0 "[ . 1 . 2 . 3]" 1
533 1 43 LYS HA 1 43 LYS HD2 . . 4.230 3.839 2.020 4.370 0.140 24 0 "[ . 1 . 2 . 3]" 1
534 1 39 GLU HG3 1 43 LYS HD2 . . 3.440 3.154 2.342 3.482 0.042 22 0 "[ . 1 . 2 . 3]" 1
535 1 43 LYS H 1 43 LYS HD2 . . 4.180 3.138 2.405 4.124 . 0 0 "[ . 1 . 2 . 3]" 1
536 1 24 LYS HA 1 24 LYS HG2 . . 4.000 3.531 2.374 3.923 . 0 0 "[ . 1 . 2 . 3]" 1
537 1 24 LYS HA 1 24 LYS HG3 . . 3.720 3.062 2.245 3.765 0.045 19 0 "[ . 1 . 2 . 3]" 1
538 1 27 LEU HB2 1 28 VAL H . . 4.370 3.099 1.949 4.297 . 0 0 "[ . 1 . 2 . 3]" 1
539 1 62 ILE H 1 62 ILE MD . . 4.050 3.153 2.205 3.370 . 0 0 "[ . 1 . 2 . 3]" 1
540 1 28 VAL MG1 1 29 LYS H . . 3.450 2.329 1.795 3.469 0.019 23 0 "[ . 1 . 2 . 3]" 1
541 1 28 VAL HA 1 28 VAL MG1 . . 3.280 2.790 2.260 3.282 0.002 14 0 "[ . 1 . 2 . 3]" 1
542 1 95 GLU HA 1 95 GLU HG2 . . 3.600 3.482 2.645 3.602 0.002 14 0 "[ . 1 . 2 . 3]" 1
543 1 95 GLU H 1 95 GLU HG2 . . 4.440 4.268 4.022 4.482 0.042 14 0 "[ . 1 . 2 . 3]" 1
544 1 95 GLU HG2 1 96 GLN H . . 4.560 4.626 3.694 4.720 0.160 17 0 "[ . 1 . 2 . 3]" 1
545 1 95 GLU HB2 1 95 GLU HG2 . . 2.940 2.555 2.400 2.990 0.050 18 0 "[ . 1 . 2 . 3]" 1
546 1 32 ILE HB 1 32 ILE MD . . 3.730 2.545 2.166 3.276 . 0 0 "[ . 1 . 2 . 3]" 1
547 1 94 HIS HA 1 97 GLU H . . 4.330 3.369 2.263 3.961 . 0 0 "[ . 1 . 2 . 3]" 1
548 1 90 ALA HA 1 93 ILE HB . . 4.450 2.279 2.097 2.757 . 0 0 "[ . 1 . 2 . 3]" 1
549 1 90 ALA HA 1 93 ILE MD . . 3.660 2.120 2.064 2.256 . 0 0 "[ . 1 . 2 . 3]" 1
550 1 100 SER HA 1 101 SER H . . 3.420 2.948 2.409 3.429 0.009 28 0 "[ . 1 . 2 . 3]" 1
551 1 100 SER HA 1 100 SER QB . . 2.600 2.412 2.318 2.522 . 0 0 "[ . 1 . 2 . 3]" 1
552 1 35 SER HA 1 38 ARG H . . 3.710 3.731 3.040 4.001 0.291 6 0 "[ . 1 . 2 . 3]" 1
553 1 6 GLU HA 1 6 GLU HG3 . . 3.730 3.728 3.493 3.969 0.239 27 0 "[ . 1 . 2 . 3]" 1
554 1 6 GLU HA 1 6 GLU HG2 . . 3.770 3.761 3.575 3.834 0.064 12 0 "[ . 1 . 2 . 3]" 1
555 1 92 LEU HB3 1 93 ILE H . . 4.430 2.586 2.415 3.383 . 0 0 "[ . 1 . 2 . 3]" 1
556 1 92 LEU H 1 92 LEU HB3 . . 3.690 2.434 2.161 3.421 . 0 0 "[ . 1 . 2 . 3]" 1
557 1 49 LEU HB2 1 49 LEU MD2 . . 3.170 2.483 2.266 2.924 . 0 0 "[ . 1 . 2 . 3]" 1
558 1 49 LEU H 1 49 LEU MD2 . . 4.110 3.867 2.628 4.176 0.066 9 0 "[ . 1 . 2 . 3]" 1
559 1 97 GLU HB3 1 98 GLN H . . 3.480 3.061 1.958 3.565 0.085 4 0 "[ . 1 . 2 . 3]" 1
560 1 29 LYS QE 1 29 LYS HG3 . . 2.540 2.434 2.255 2.586 0.046 10 0 "[ . 1 . 2 . 3]" 1
561 1 29 LYS QD 1 29 LYS QE . . 2.400 2.097 2.021 2.134 . 0 0 "[ . 1 . 2 . 3]" 1
562 1 29 LYS HB3 1 29 LYS QE . . 3.810 2.290 2.019 3.410 . 0 0 "[ . 1 . 2 . 3]" 1
563 1 29 LYS HA 1 29 LYS QE . . 4.750 3.769 3.112 4.768 0.018 23 0 "[ . 1 . 2 . 3]" 1
564 1 29 LYS HB2 1 29 LYS QE . . 3.600 3.245 2.379 3.615 0.015 30 0 "[ . 1 . 2 . 3]" 1
565 1 93 ILE HA 1 93 ILE MD . . 3.850 3.846 3.779 3.878 0.028 11 0 "[ . 1 . 2 . 3]" 1
566 1 93 ILE HB 1 93 ILE MD . . 3.540 2.300 2.246 2.365 . 0 0 "[ . 1 . 2 . 3]" 1
567 1 93 ILE MD 1 93 ILE MG . . 2.830 2.079 2.041 2.139 . 0 0 "[ . 1 . 2 . 3]" 1
568 1 93 ILE H 1 93 ILE MD . . 4.140 3.433 3.201 3.692 . 0 0 "[ . 1 . 2 . 3]" 1
569 1 93 ILE MD 1 94 HIS H . . 4.300 4.340 4.290 4.365 0.065 18 0 "[ . 1 . 2 . 3]" 1
570 1 93 ILE MD 2 12 ILE HA . . 3.960 3.395 2.796 3.981 0.021 9 0 "[ . 1 . 2 . 3]" 1
571 1 63 GLN HB2 1 63 GLN HG3 . . 2.910 2.381 2.204 2.599 . 0 0 "[ . 1 . 2 . 3]" 1
572 1 63 GLN HE22 1 63 GLN HG3 . . 3.720 3.658 3.497 3.761 0.041 2 0 "[ . 1 . 2 . 3]" 1
573 1 63 GLN HA 1 63 GLN HG3 . . 3.450 3.169 2.319 3.552 0.102 22 0 "[ . 1 . 2 . 3]" 1
574 1 65 LEU HA 1 65 LEU HG . . 4.200 3.640 2.310 3.797 . 0 0 "[ . 1 . 2 . 3]" 1
575 1 91 LYS QE 1 91 LYS HG3 . . 3.350 3.357 3.311 3.416 0.066 10 0 "[ . 1 . 2 . 3]" 1
576 1 91 LYS HB2 1 91 LYS QE . . 3.700 3.506 2.089 3.736 0.036 15 0 "[ . 1 . 2 . 3]" 1
577 1 91 LYS HB3 1 91 LYS QE . . 2.810 2.675 2.068 2.841 0.031 21 0 "[ . 1 . 2 . 3]" 1
578 1 91 LYS QE 1 91 LYS HG2 . . 2.740 2.501 2.337 2.784 0.044 10 0 "[ . 1 . 2 . 3]" 1
579 1 74 SER HB2 1 76 ASP H . . 4.850 3.775 2.781 4.837 . 0 0 "[ . 1 . 2 . 3]" 1
580 1 74 SER HB2 1 75 PHE H . . 4.560 3.544 2.347 3.892 . 0 0 "[ . 1 . 2 . 3]" 1
581 1 82 ILE HB 1 83 GLY H . . 4.780 4.383 4.229 4.527 . 0 0 "[ . 1 . 2 . 3]" 1
582 1 48 MET ME 1 89 ILE MD . . 3.460 2.913 2.159 3.480 0.020 27 0 "[ . 1 . 2 . 3]" 1
583 1 89 ILE H 1 89 ILE MD . . 4.120 3.562 2.936 3.888 . 0 0 "[ . 1 . 2 . 3]" 1
584 1 35 SER H 1 35 SER HB2 . . 4.020 2.963 2.444 3.634 . 0 0 "[ . 1 . 2 . 3]" 1
585 1 49 LEU HB3 1 49 LEU MD1 . . 3.310 3.181 2.521 3.294 . 0 0 "[ . 1 . 2 . 3]" 1
586 1 49 LEU HB3 1 49 LEU MD2 . . 3.350 2.280 2.177 3.180 . 0 0 "[ . 1 . 2 . 3]" 1
587 1 57 ALA HA 1 59 ASP H . . 4.280 4.323 4.081 4.393 0.113 14 0 "[ . 1 . 2 . 3]" 1
588 1 57 ALA HA 1 60 LYS QB . . 3.430 3.068 2.676 3.448 0.018 2 0 "[ . 1 . 2 . 3]" 1
589 1 57 ALA HA 1 60 LYS H . . 4.080 3.711 3.441 4.028 . 0 0 "[ . 1 . 2 . 3]" 1
590 1 60 LYS QB 1 60 LYS HG3 . . 2.400 2.153 2.122 2.185 . 0 0 "[ . 1 . 2 . 3]" 1
591 1 60 LYS QB 1 60 LYS QE . . 3.610 2.466 1.925 3.632 0.022 10 0 "[ . 1 . 2 . 3]" 1
592 1 60 LYS H 1 60 LYS QB . . 3.350 2.197 2.060 2.321 . 0 0 "[ . 1 . 2 . 3]" 1
593 1 60 LYS QB 1 60 LYS HG2 . . 2.780 2.512 2.466 2.562 . 0 0 "[ . 1 . 2 . 3]" 1
594 1 8 GLU HA 2 45 LEU MD2 . . 4.210 2.806 2.183 4.219 0.009 3 0 "[ . 1 . 2 . 3]" 1
595 1 8 GLU HA 1 8 GLU HG3 . . 4.200 2.914 2.205 4.205 0.005 9 0 "[ . 1 . 2 . 3]" 1
596 1 8 GLU HA 1 11 VAL HB . . 4.230 2.952 2.534 3.256 . 0 0 "[ . 1 . 2 . 3]" 1
597 1 8 GLU HA 1 11 VAL H . . 4.570 3.598 3.150 3.788 . 0 0 "[ . 1 . 2 . 3]" 1
598 1 45 LEU H 1 45 LEU HG . . 4.440 3.367 2.378 4.533 0.093 5 0 "[ . 1 . 2 . 3]" 1
599 1 9 LYS H 1 9 LYS QG . . 4.730 2.260 2.149 2.522 . 0 0 "[ . 1 . 2 . 3]" 1
600 1 25 TYR H 1 25 TYR HB2 . . 4.160 2.563 2.156 3.540 . 0 0 "[ . 1 . 2 . 3]" 1
601 1 86 THR HA 1 86 THR MG . . 3.610 2.264 2.176 2.403 . 0 0 "[ . 1 . 2 . 3]" 1
602 1 86 THR MG 2 15 VAL MG1 . . 5.420 3.255 2.408 3.891 . 0 0 "[ . 1 . 2 . 3]" 1
603 1 86 THR MG 1 90 ALA MB . . 3.260 2.502 2.102 2.952 . 0 0 "[ . 1 . 2 . 3]" 1
604 1 86 THR H 1 86 THR MG . . 4.290 3.784 3.730 3.861 . 0 0 "[ . 1 . 2 . 3]" 1
605 1 86 THR MG 1 87 GLY H . . 4.750 3.931 2.197 4.088 . 0 0 "[ . 1 . 2 . 3]" 1
606 1 72 ARG HA 1 72 ARG QG . . 3.490 2.446 2.189 3.280 . 0 0 "[ . 1 . 2 . 3]" 1
607 1 72 ARG H 1 72 ARG QG . . 3.880 3.870 3.643 3.971 0.091 24 0 "[ . 1 . 2 . 3]" 1
608 1 61 LEU HG 1 62 ILE H . . 4.490 4.286 4.037 4.459 . 0 0 "[ . 1 . 2 . 3]" 1
609 1 61 LEU H 1 61 LEU HG . . 3.890 2.376 1.930 2.646 . 0 0 "[ . 1 . 2 . 3]" 1
610 1 99 GLN HB2 1 99 GLN HG3 . . 3.010 2.580 2.482 2.718 . 0 0 "[ . 1 . 2 . 3]" 1
611 1 99 GLN H 1 99 GLN HB2 . . 3.520 2.419 2.274 2.548 . 0 0 "[ . 1 . 2 . 3]" 1
612 1 99 GLN HB2 1 100 SER H . . 3.600 3.113 2.757 3.309 . 0 0 "[ . 1 . 2 . 3]" 1
613 1 99 GLN HB2 1 100 SER HA . . 4.870 4.801 4.276 4.939 0.069 18 0 "[ . 1 . 2 . 3]" 1
614 1 32 ILE MG 1 33 SER H . . 4.410 2.573 1.641 3.956 . 0 0 "[ . 1 . 2 . 3]" 1
615 1 85 ILE HA 1 85 ILE HG13 . . 3.420 3.154 3.056 3.272 . 0 0 "[ . 1 . 2 . 3]" 1
616 1 92 LEU HA 1 95 GLU H . . 3.850 3.431 3.201 3.614 . 0 0 "[ . 1 . 2 . 3]" 1
617 1 92 LEU HA 1 92 LEU MD2 . . 3.020 2.171 2.106 2.250 . 0 0 "[ . 1 . 2 . 3]" 1
618 1 12 ILE MD 1 12 ILE MG . . 3.150 2.096 2.038 2.275 . 0 0 "[ . 1 . 2 . 3]" 1
619 1 12 ILE MG 1 13 VAL H . . 4.260 3.349 3.077 3.656 . 0 0 "[ . 1 . 2 . 3]" 1
620 1 12 ILE MG 1 15 VAL H . . 4.580 4.319 3.872 4.585 0.005 30 0 "[ . 1 . 2 . 3]" 1
621 1 12 ILE HA 1 12 ILE MG . . 3.600 2.442 2.187 2.687 . 0 0 "[ . 1 . 2 . 3]" 1
622 1 12 ILE HG12 1 12 ILE MG . . 3.710 2.530 2.413 3.207 . 0 0 "[ . 1 . 2 . 3]" 1
623 1 12 ILE H 1 12 ILE MG . . 3.720 3.739 3.669 3.789 0.069 17 0 "[ . 1 . 2 . 3]" 1
624 1 52 THR H 1 52 THR MG . . 4.310 2.864 2.087 3.821 . 0 0 "[ . 1 . 2 . 3]" 1
625 1 52 THR HA 1 52 THR MG . . 3.170 2.981 2.314 3.242 0.072 21 0 "[ . 1 . 2 . 3]" 1
626 1 52 THR MG 1 53 GLY H . . 3.330 2.737 2.126 3.406 0.076 10 0 "[ . 1 . 2 . 3]" 1
627 1 92 LEU HB2 1 93 ILE H . . 4.430 3.786 3.164 3.957 . 0 0 "[ . 1 . 2 . 3]" 1
628 1 100 SER H 1 100 SER QB . . 3.280 3.051 2.599 3.396 0.116 14 0 "[ . 1 . 2 . 3]" 1
629 1 96 GLN HB2 1 96 GLN HE21 . . 4.510 3.870 2.633 4.517 0.007 10 0 "[ . 1 . 2 . 3]" 1
630 1 96 GLN H 1 96 GLN HB2 . . 3.570 2.934 2.476 3.097 . 0 0 "[ . 1 . 2 . 3]" 1
631 1 41 LEU HA 1 41 LEU HG . . 3.900 3.194 2.920 3.717 . 0 0 "[ . 1 . 2 . 3]" 1
632 1 97 GLU HB2 1 98 GLN H . . 3.400 2.998 2.468 3.486 0.086 14 0 "[ . 1 . 2 . 3]" 1
633 1 97 GLU H 1 97 GLU HB2 . . 3.630 2.344 2.078 2.509 . 0 0 "[ . 1 . 2 . 3]" 1
634 1 72 ARG HB2 1 73 ILE H . . 4.490 4.089 3.552 4.418 . 0 0 "[ . 1 . 2 . 3]" 1
635 1 72 ARG H 1 72 ARG HB2 . . 4.100 2.626 2.253 3.205 . 0 0 "[ . 1 . 2 . 3]" 1
636 1 76 ASP HA 1 79 TRP HB2 . . 4.250 2.719 2.032 3.385 . 0 0 "[ . 1 . 2 . 3]" 1
637 1 82 ILE HG13 1 85 ILE H . . 4.750 3.991 3.831 4.220 . 0 0 "[ . 1 . 2 . 3]" 1
638 1 82 ILE H 1 82 ILE HG13 . . 4.440 4.470 4.454 4.491 0.051 4 0 "[ . 1 . 2 . 3]" 1
639 1 5 THR MG 2 46 ASN HB3 . . 4.550 4.022 2.731 4.570 0.020 3 0 "[ . 1 . 2 . 3]" 1
640 1 5 THR H 1 5 THR MG . . 3.800 2.219 1.886 3.172 . 0 0 "[ . 1 . 2 . 3]" 1
641 1 5 THR MG 1 6 GLU H . . 3.810 3.857 3.817 3.905 0.095 4 0 "[ . 1 . 2 . 3]" 1
642 1 5 THR HA 1 5 THR MG . . 3.320 2.467 2.354 3.235 . 0 0 "[ . 1 . 2 . 3]" 1
643 1 5 THR MG 1 7 LEU H . . 4.400 4.135 2.707 4.410 0.010 26 0 "[ . 1 . 2 . 3]" 1
644 1 42 GLN HB3 1 42 GLN HE21 . . 4.190 3.362 1.884 4.250 0.060 24 0 "[ . 1 . 2 . 3]" 1
645 1 42 GLN HB3 1 43 LYS H . . 3.720 3.653 3.265 3.765 0.045 24 0 "[ . 1 . 2 . 3]" 1
646 1 39 GLU HA 1 42 GLN HB3 . . 3.660 3.720 3.670 3.763 0.103 8 0 "[ . 1 . 2 . 3]" 1
647 1 42 GLN HB3 1 42 GLN HE22 . . 4.630 3.943 3.418 4.644 0.014 24 0 "[ . 1 . 2 . 3]" 1
648 1 54 ASN H 1 54 ASN HB3 . . 4.150 3.100 2.617 3.624 . 0 0 "[ . 1 . 2 . 3]" 1
649 1 54 ASN HB3 1 55 ARG H . . 4.540 3.289 2.827 4.017 . 0 0 "[ . 1 . 2 . 3]" 1
650 1 54 ASN HB3 1 57 ALA MB . . 4.470 4.330 3.633 4.565 0.095 7 0 "[ . 1 . 2 . 3]" 1
651 1 58 ALA MB 1 85 ILE MG . . 2.940 2.967 2.904 2.999 0.059 2 0 "[ . 1 . 2 . 3]" 1
652 1 55 ARG HA 1 58 ALA MB . . 3.220 2.782 2.264 3.065 . 0 0 "[ . 1 . 2 . 3]" 1
653 1 58 ALA MB 1 59 ASP H . . 3.360 2.804 2.657 3.099 . 0 0 "[ . 1 . 2 . 3]" 1
654 1 55 ARG HD2 1 58 ALA MB . . 4.660 4.378 3.552 4.750 0.090 24 0 "[ . 1 . 2 . 3]" 1
655 1 58 ALA MB 1 85 ILE MD . . 3.060 2.099 1.998 2.349 . 0 0 "[ . 1 . 2 . 3]" 1
656 1 58 ALA MB 1 61 LEU H . . 4.630 4.572 4.359 4.675 0.045 2 0 "[ . 1 . 2 . 3]" 1
657 1 98 GLN HG2 1 99 GLN HG3 . . 3.480 3.547 3.533 3.577 0.097 1 0 "[ . 1 . 2 . 3]" 1
658 1 98 GLN H 1 98 GLN HG2 . . 3.490 3.383 3.201 3.543 0.053 29 0 "[ . 1 . 2 . 3]" 1
659 1 10 ALA HA 1 13 VAL HB . . 3.600 2.303 2.171 2.411 . 0 0 "[ . 1 . 2 . 3]" 1
660 1 10 ALA HA 1 13 VAL H . . 3.990 2.976 2.883 3.059 . 0 0 "[ . 1 . 2 . 3]" 1
661 1 36 SER HA 1 39 GLU HB3 . . 4.320 2.455 2.003 4.087 . 0 0 "[ . 1 . 2 . 3]" 1
662 1 39 GLU HA 1 39 GLU HB3 . . 2.990 3.000 2.890 3.032 0.042 2 0 "[ . 1 . 2 . 3]" 1
663 1 30 ASN H 1 30 ASN HB2 . . 3.760 2.985 2.397 3.845 0.085 4 0 "[ . 1 . 2 . 3]" 1
664 1 30 ASN HB2 1 30 ASN HD21 . . 3.600 2.622 2.216 3.379 . 0 0 "[ . 1 . 2 . 3]" 1
665 1 30 ASN HB2 1 30 ASN HD22 . . 3.860 3.661 3.504 3.921 0.061 23 0 "[ . 1 . 2 . 3]" 1
666 1 13 VAL HA 1 16 GLU H . . 4.640 3.456 3.154 3.785 . 0 0 "[ . 1 . 2 . 3]" 1
667 1 13 VAL HA 1 13 VAL MG2 . . 3.510 2.356 2.313 2.396 . 0 0 "[ . 1 . 2 . 3]" 1
668 1 9 LYS HA 1 9 LYS HD2 . . 4.270 2.297 2.027 4.373 0.103 20 0 "[ . 1 . 2 . 3]" 1
669 1 43 LYS HA 1 43 LYS HG2 . . 3.600 3.064 2.392 3.658 0.058 11 0 "[ . 1 . 2 . 3]" 1
670 1 43 LYS H 1 43 LYS HG2 . . 4.400 3.628 2.030 4.403 0.003 20 0 "[ . 1 . 2 . 3]" 1
671 1 43 LYS HG2 1 44 GLU H . . 4.760 4.618 3.730 4.867 0.107 18 0 "[ . 1 . 2 . 3]" 1
672 1 20 LYS HA 1 20 LYS HG2 . . 3.820 2.867 2.063 3.508 . 0 0 "[ . 1 . 2 . 3]" 1
673 1 20 LYS HA 1 20 LYS QD . . 3.490 3.354 2.163 3.648 0.158 21 0 "[ . 1 . 2 . 3]" 1
674 1 46 ASN H 1 46 ASN HB2 . . 4.030 2.716 2.250 3.677 . 0 0 "[ . 1 . 2 . 3]" 1
675 1 26 SER QB 1 27 LEU H . . 4.390 3.072 1.979 4.149 . 0 0 "[ . 1 . 2 . 3]" 1
676 1 26 SER H 1 26 SER QB . . 3.710 2.977 2.409 3.471 . 0 0 "[ . 1 . 2 . 3]" 1
677 1 56 LYS QE 1 56 LYS QG . . 2.490 2.219 1.923 2.525 0.035 12 0 "[ . 1 . 2 . 3]" 1
678 1 56 LYS QB 1 56 LYS QE . . 3.170 2.990 2.055 3.309 0.139 16 0 "[ . 1 . 2 . 3]" 1
679 1 56 LYS QD 1 56 LYS QE . . 2.400 2.040 1.974 2.124 . 0 0 "[ . 1 . 2 . 3]" 1
680 1 62 ILE H 1 62 ILE HB . . 4.180 2.354 2.217 2.878 . 0 0 "[ . 1 . 2 . 3]" 1
681 1 73 ILE MG 1 74 SER H . . 4.480 2.691 2.091 3.359 . 0 0 "[ . 1 . 2 . 3]" 1
682 1 73 ILE MD 1 73 ILE MG . . 3.540 2.450 2.063 3.286 . 0 0 "[ . 1 . 2 . 3]" 1
683 1 73 ILE H 1 73 ILE MG . . 4.590 3.906 3.719 4.004 . 0 0 "[ . 1 . 2 . 3]" 1
684 1 96 GLN HG3 1 97 GLU H . . 4.450 4.068 3.717 4.458 0.008 10 0 "[ . 1 . 2 . 3]" 1
685 1 81 LEU HA 1 81 LEU MD2 . . 4.090 2.418 2.075 3.922 . 0 0 "[ . 1 . 2 . 3]" 1
686 1 32 ILE HA 1 32 ILE MD . . 4.090 3.525 2.076 4.123 0.033 25 0 "[ . 1 . 2 . 3]" 1
687 1 32 ILE HG12 1 32 ILE MG . . 3.440 2.510 2.080 3.270 . 0 0 "[ . 1 . 2 . 3]" 1
688 1 89 ILE HA 1 89 ILE MD . . 3.910 3.894 3.680 4.048 0.138 27 0 "[ . 1 . 2 . 3]" 1
689 1 98 GLN HA 1 99 GLN H . . 3.510 3.401 3.261 3.486 . 0 0 "[ . 1 . 2 . 3]" 1
690 1 98 GLN HA 1 98 GLN HG2 . . 4.140 4.193 4.181 4.204 0.064 6 0 "[ . 1 . 2 . 3]" 1
691 1 2 ASP HA 1 3 CYS H . . 3.510 2.446 2.080 3.534 0.024 23 0 "[ . 1 . 2 . 3]" 1
692 1 92 LEU H 1 92 LEU MD2 . . 4.110 3.932 2.855 4.125 0.015 28 0 "[ . 1 . 2 . 3]" 1
693 1 92 LEU HB3 1 92 LEU MD2 . . 3.480 3.260 3.254 3.272 . 0 0 "[ . 1 . 2 . 3]" 1
694 1 92 LEU HB2 1 92 LEU MD2 . . 3.440 2.489 2.372 2.563 . 0 0 "[ . 1 . 2 . 3]" 1
695 1 36 SER HA 1 36 SER HB2 . . 3.010 2.686 2.228 3.027 0.017 15 0 "[ . 1 . 2 . 3]" 1
696 1 96 GLN HA 1 96 GLN HB3 . . 2.920 2.352 2.240 2.513 . 0 0 "[ . 1 . 2 . 3]" 1
697 1 102 SER H 1 102 SER QB . . 3.780 2.975 2.244 3.486 . 0 0 "[ . 1 . 2 . 3]" 1
698 1 29 LYS HG2 1 30 ASN H . . 4.780 4.673 4.415 4.911 0.131 27 0 "[ . 1 . 2 . 3]" 1
699 1 29 LYS H 1 29 LYS HG2 . . 4.160 2.642 2.108 3.490 . 0 0 "[ . 1 . 2 . 3]" 1
700 1 29 LYS QE 1 29 LYS HG2 . . 3.510 3.373 3.231 3.490 . 0 0 "[ . 1 . 2 . 3]" 1
701 1 29 LYS HA 1 29 LYS HG2 . . 3.910 2.698 2.159 3.238 . 0 0 "[ . 1 . 2 . 3]" 1
702 1 27 LEU H 1 27 LEU HG . . 3.790 2.464 1.922 3.812 0.022 8 0 "[ . 1 . 2 . 3]" 1
703 1 27 LEU HG 1 28 VAL H . . 4.580 4.449 3.718 4.619 0.039 25 0 "[ . 1 . 2 . 3]" 1
704 1 55 ARG QG 1 56 LYS H . . 4.680 4.232 3.808 4.632 . 0 0 "[ . 1 . 2 . 3]" 1
705 1 55 ARG H 1 55 ARG QG . . 4.230 2.699 2.135 4.131 . 0 0 "[ . 1 . 2 . 3]" 1
706 1 19 TYR HA 1 22 VAL MG2 . . 4.440 3.811 2.872 4.535 0.095 22 0 "[ . 1 . 2 . 3]" 1
707 1 55 ARG HA 1 55 ARG HD3 . . 3.720 3.281 2.353 3.820 0.100 15 0 "[ . 1 . 2 . 3]" 1
708 1 55 ARG HB3 1 55 ARG HD3 . . 3.720 3.360 2.238 3.789 0.069 21 0 "[ . 1 . 2 . 3]" 1
709 1 49 LEU MD2 1 55 ARG HD3 . . 3.860 2.856 2.032 3.900 0.040 23 0 "[ . 1 . 2 . 3]" 1
710 1 55 ARG HD3 1 58 ALA MB . . 5.120 4.691 3.234 5.172 0.052 14 0 "[ . 1 . 2 . 3]" 1
711 1 55 ARG H 1 55 ARG HD3 . . 4.750 4.364 2.693 4.829 0.079 27 0 "[ . 1 . 2 . 3]" 1
712 1 50 SER H 1 50 SER HB3 . . 4.070 3.372 2.302 4.018 . 0 0 "[ . 1 . 2 . 3]" 1
713 1 50 SER HA 1 50 SER HB3 . . 2.880 2.475 2.274 2.970 0.090 11 0 "[ . 1 . 2 . 3]" 1
714 1 91 LYS QD 1 91 LYS HG3 . . 2.400 2.148 2.136 2.195 . 0 0 "[ . 1 . 2 . 3]" 1
715 1 91 LYS HA 1 91 LYS QD . . 3.900 3.565 3.330 3.927 0.027 16 0 "[ . 1 . 2 . 3]" 1
716 1 91 LYS H 1 91 LYS QD . . 4.610 4.548 2.198 4.698 0.088 1 0 "[ . 1 . 2 . 3]" 1
717 1 91 LYS QD 1 91 LYS QE . . 2.400 2.106 2.029 2.130 . 0 0 "[ . 1 . 2 . 3]" 1
718 1 66 ASP H 1 66 ASP HB2 . . 4.210 2.516 2.125 3.098 . 0 0 "[ . 1 . 2 . 3]" 1
719 1 77 GLU HA 1 77 GLU HG3 . . 3.400 2.809 2.444 3.323 . 0 0 "[ . 1 . 2 . 3]" 1
720 1 89 ILE HG13 1 90 ALA H . . 4.610 3.189 2.807 3.702 . 0 0 "[ . 1 . 2 . 3]" 1
721 1 49 LEU HA 1 49 LEU MD2 . . 4.260 3.948 3.442 4.139 . 0 0 "[ . 1 . 2 . 3]" 1
722 1 56 LYS HA 1 56 LYS QG . . 3.420 2.260 2.141 2.460 . 0 0 "[ . 1 . 2 . 3]" 1
723 1 56 LYS HA 1 59 ASP H . . 4.120 3.060 2.765 3.293 . 0 0 "[ . 1 . 2 . 3]" 1
724 1 56 LYS HA 1 59 ASP HB2 . . 4.010 2.160 1.952 2.710 . 0 0 "[ . 1 . 2 . 3]" 1
725 1 59 ASP H 1 59 ASP HB3 . . 3.600 3.282 2.651 3.627 0.027 1 0 "[ . 1 . 2 . 3]" 1
726 1 59 ASP HB3 1 60 LYS H . . 3.870 3.150 2.406 3.680 . 0 0 "[ . 1 . 2 . 3]" 1
727 1 56 LYS HA 1 59 ASP HB3 . . 3.970 3.112 2.049 3.721 . 0 0 "[ . 1 . 2 . 3]" 1
728 1 11 VAL H 1 11 VAL HB . . 4.060 2.376 2.259 2.540 . 0 0 "[ . 1 . 2 . 3]" 1
729 1 9 LYS HD3 1 9 LYS QE . . 2.430 2.398 2.181 2.502 0.072 15 0 "[ . 1 . 2 . 3]" 1
730 1 9 LYS HB2 1 9 LYS QE . . 3.560 3.513 2.482 3.616 0.056 6 0 "[ . 1 . 2 . 3]" 1
731 1 9 LYS HB3 1 9 LYS QE . . 2.850 2.290 2.012 2.663 . 0 0 "[ . 1 . 2 . 3]" 1
732 1 9 LYS QE 1 9 LYS QG . . 3.390 2.400 2.172 2.985 . 0 0 "[ . 1 . 2 . 3]" 1
733 1 17 ASN HB3 2 7 LEU MD2 . . 4.200 3.437 2.776 4.209 0.009 1 0 "[ . 1 . 2 . 3]" 1
734 1 14 LEU HA 1 17 ASN HB3 . . 4.410 3.860 2.505 4.459 0.049 4 0 "[ . 1 . 2 . 3]" 1
735 1 17 ASN H 1 17 ASN HB3 . . 3.940 2.698 2.175 3.309 . 0 0 "[ . 1 . 2 . 3]" 1
736 1 43 LYS HA 1 43 LYS QE . . 4.800 4.334 2.395 4.845 0.045 14 0 "[ . 1 . 2 . 3]" 1
737 1 43 LYS HB2 1 43 LYS QE . . 4.340 3.689 2.433 4.248 . 0 0 "[ . 1 . 2 . 3]" 1
738 1 43 LYS HD3 1 43 LYS QE . . 2.730 2.281 2.094 2.555 . 0 0 "[ . 1 . 2 . 3]" 1
739 1 43 LYS HB3 1 43 LYS QE . . 3.660 3.371 2.282 3.735 0.075 12 0 "[ . 1 . 2 . 3]" 1
740 1 43 LYS QE 1 43 LYS HG2 . . 3.330 2.493 2.063 3.370 0.040 26 0 "[ . 1 . 2 . 3]" 1
741 1 24 LYS QB 1 24 LYS HD3 . . 3.260 2.596 2.284 3.206 . 0 0 "[ . 1 . 2 . 3]" 1
742 1 28 VAL HA 1 28 VAL MG2 . . 3.160 2.394 2.218 2.681 . 0 0 "[ . 1 . 2 . 3]" 1
743 1 95 GLU HG3 1 96 GLN H . . 4.570 4.625 4.585 4.679 0.109 20 0 "[ . 1 . 2 . 3]" 1
744 1 88 PRO HB2 1 89 ILE H . . 4.390 3.274 3.060 3.661 . 0 0 "[ . 1 . 2 . 3]" 1
745 1 6 GLU H 1 6 GLU HG2 . . 4.080 2.787 2.451 3.575 . 0 0 "[ . 1 . 2 . 3]" 1
746 1 6 GLU HG2 1 7 LEU H . . 4.240 2.961 2.413 3.632 . 0 0 "[ . 1 . 2 . 3]" 1
747 1 23 SER H 1 23 SER QB . . 3.080 2.464 2.173 3.110 0.030 21 0 "[ . 1 . 2 . 3]" 1
748 1 90 ALA MB 1 91 LYS H . . 3.890 2.894 2.575 3.145 . 0 0 "[ . 1 . 2 . 3]" 1
749 1 7 LEU HA 1 7 LEU MD1 . . 3.420 3.342 3.176 3.429 0.009 3 0 "[ . 1 . 2 . 3]" 1
750 1 7 LEU HA 1 10 ALA H . . 3.750 3.258 2.957 3.418 . 0 0 "[ . 1 . 2 . 3]" 1
751 1 7 LEU HA 1 7 LEU HG . . 3.780 3.755 3.688 3.794 0.014 19 0 "[ . 1 . 2 . 3]" 1
752 1 13 VAL H 1 13 VAL MG1 . . 3.910 3.772 3.707 3.827 . 0 0 "[ . 1 . 2 . 3]" 1
753 1 13 VAL MG1 2 6 GLU HG3 . . 3.220 2.508 2.053 3.257 0.037 26 0 "[ . 1 . 2 . 3]" 1
754 1 13 VAL HA 1 13 VAL MG1 . . 3.110 2.645 2.568 2.694 . 0 0 "[ . 1 . 2 . 3]" 1
755 1 13 VAL MG1 1 14 LEU H . . 3.730 3.169 2.922 3.410 . 0 0 "[ . 1 . 2 . 3]" 1
756 1 63 GLN HB2 1 63 GLN HG2 . . 2.940 2.684 2.444 3.015 0.075 7 0 "[ . 1 . 2 . 3]" 1
757 1 63 GLN HA 1 63 GLN HG2 . . 3.310 2.559 2.254 3.000 . 0 0 "[ . 1 . 2 . 3]" 1
758 1 60 LYS HA 1 60 LYS HG2 . . 3.490 2.421 2.189 2.716 . 0 0 "[ . 1 . 2 . 3]" 1
759 1 60 LYS QE 1 60 LYS HG2 . . 3.340 3.067 2.114 3.366 0.026 5 0 "[ . 1 . 2 . 3]" 1
760 1 52 THR HA 1 55 ARG HD2 . . 4.890 4.786 4.303 5.011 0.121 30 0 "[ . 1 . 2 . 3]" 1
761 1 52 THR HA 1 55 ARG HB3 . . 3.930 3.789 2.821 4.038 0.108 24 0 "[ . 1 . 2 . 3]" 1
762 1 89 ILE HB 1 89 ILE MD . . 3.710 2.275 2.164 2.419 . 0 0 "[ . 1 . 2 . 3]" 1
763 1 98 GLN HB3 1 99 GLN H . . 4.180 4.010 3.786 4.184 0.004 5 0 "[ . 1 . 2 . 3]" 1
764 1 24 LYS HA 1 24 LYS HD3 . . 4.090 3.116 2.184 4.127 0.037 6 0 "[ . 1 . 2 . 3]" 1
765 1 95 GLU H 1 95 GLU HB2 . . 3.810 2.016 1.916 2.597 . 0 0 "[ . 1 . 2 . 3]" 1
766 1 92 LEU HA 1 95 GLU HB2 . . 3.330 2.300 2.046 3.346 0.016 18 0 "[ . 1 . 2 . 3]" 1
767 1 91 LYS HA 1 91 LYS HG2 . . 4.090 2.459 2.024 4.155 0.065 11 0 "[ . 1 . 2 . 3]" 1
768 1 91 LYS H 1 91 LYS HG2 . . 3.730 3.403 2.789 3.848 0.118 16 0 "[ . 1 . 2 . 3]" 1
769 1 91 LYS QD 1 91 LYS HG2 . . 2.400 2.400 2.309 2.419 0.019 23 0 "[ . 1 . 2 . 3]" 1
770 1 67 ALA MB 1 68 ASN H . . 3.520 2.954 2.589 3.516 . 0 0 "[ . 1 . 2 . 3]" 1
771 1 67 ALA H 1 67 ALA MB . . 3.230 2.264 2.102 2.935 . 0 0 "[ . 1 . 2 . 3]" 1
772 1 85 ILE HB 1 86 THR H . . 4.380 2.545 2.245 2.787 . 0 0 "[ . 1 . 2 . 3]" 1
773 1 11 VAL MG2 2 82 ILE MG . . 3.710 3.219 2.815 3.441 . 0 0 "[ . 1 . 2 . 3]" 1
774 1 11 VAL HA 1 11 VAL MG2 . . 3.620 2.368 2.303 2.490 . 0 0 "[ . 1 . 2 . 3]" 1
775 1 8 GLU HA 1 11 VAL MG2 . . 3.630 3.400 2.855 3.645 0.015 14 0 "[ . 1 . 2 . 3]" 1
776 1 11 VAL H 1 11 VAL MG2 . . 3.440 2.248 2.075 2.470 . 0 0 "[ . 1 . 2 . 3]" 1
777 1 79 TRP HB3 1 80 THR H . . 4.370 2.879 2.639 3.149 . 0 0 "[ . 1 . 2 . 3]" 1
778 1 41 LEU HB2 1 42 GLN H . . 4.710 3.157 2.410 3.831 . 0 0 "[ . 1 . 2 . 3]" 1
779 1 45 LEU HB3 1 46 ASN H . . 4.740 4.174 2.721 4.476 . 0 0 "[ . 1 . 2 . 3]" 1
780 1 57 ALA MB 1 60 LYS QB . . 4.520 4.288 4.024 4.535 0.015 7 0 "[ . 1 . 2 . 3]" 1
781 1 57 ALA MB 1 58 ALA H . . 3.180 2.491 2.337 2.686 . 0 0 "[ . 1 . 2 . 3]" 1
782 1 57 ALA H 1 57 ALA MB . . 2.990 2.254 2.206 2.315 . 0 0 "[ . 1 . 2 . 3]" 1
783 1 61 LEU HA 1 61 LEU MD1 . . 3.990 3.880 3.823 3.940 . 0 0 "[ . 1 . 2 . 3]" 1
784 1 61 LEU HA 1 64 ASN HB3 . . 4.490 2.691 2.156 4.351 . 0 0 "[ . 1 . 2 . 3]" 1
785 1 61 LEU HA 1 61 LEU MD2 . . 3.500 2.061 2.002 2.135 . 0 0 "[ . 1 . 2 . 3]" 1
786 1 61 LEU HA 1 61 LEU HG . . 3.950 2.851 2.640 3.283 . 0 0 "[ . 1 . 2 . 3]" 1
787 1 61 LEU HA 1 64 ASN H . . 4.170 3.334 2.960 3.629 . 0 0 "[ . 1 . 2 . 3]" 1
788 1 94 HIS HB3 1 95 GLU H . . 4.780 2.796 2.471 4.196 . 0 0 "[ . 1 . 2 . 3]" 1
789 1 98 GLN HB2 1 99 GLN H . . 4.220 4.278 4.226 4.323 0.103 28 0 "[ . 1 . 2 . 3]" 1
790 1 39 GLU HA 1 42 GLN H . . 4.170 3.263 2.884 3.526 . 0 0 "[ . 1 . 2 . 3]" 1
791 1 45 LEU HA 1 45 LEU MD1 . . 4.240 3.555 2.222 3.991 . 0 0 "[ . 1 . 2 . 3]" 1
792 1 45 LEU HB2 1 45 LEU MD1 . . 3.470 2.301 2.042 3.259 . 0 0 "[ . 1 . 2 . 3]" 1
793 1 45 LEU H 1 45 LEU MD1 . . 4.380 3.256 2.191 4.395 0.015 3 0 "[ . 1 . 2 . 3]" 1
794 1 45 LEU HB3 1 45 LEU MD1 . . 3.420 2.747 2.152 3.197 . 0 0 "[ . 1 . 2 . 3]" 1
795 1 45 LEU MD1 1 46 ASN H . . 5.500 4.998 4.044 5.567 0.067 1 0 "[ . 1 . 2 . 3]" 1
796 1 42 GLN HA 1 42 GLN HG3 . . 3.540 3.321 2.741 3.635 0.095 6 0 "[ . 1 . 2 . 3]" 1
797 1 42 GLN H 1 42 GLN HG3 . . 3.780 3.265 2.402 3.889 0.109 21 0 "[ . 1 . 2 . 3]" 1
798 1 42 GLN HE22 1 42 GLN HG3 . . 4.050 3.747 3.446 4.098 0.048 20 0 "[ . 1 . 2 . 3]" 1
799 1 25 TYR H 1 25 TYR HB3 . . 3.940 3.283 2.496 3.965 0.025 19 0 "[ . 1 . 2 . 3]" 1
800 1 29 LYS HB2 1 30 ASN H . . 4.100 3.185 2.111 4.211 0.111 11 0 "[ . 1 . 2 . 3]" 1
801 1 29 LYS H 1 29 LYS HB2 . . 3.500 2.623 1.879 3.568 0.068 23 0 "[ . 1 . 2 . 3]" 1
802 1 45 LEU MD2 2 8 GLU HA . . 4.210 2.862 2.182 4.246 0.036 6 0 "[ . 1 . 2 . 3]" 1
803 1 10 ALA HA 1 13 VAL MG2 . . 3.620 2.784 2.710 2.846 . 0 0 "[ . 1 . 2 . 3]" 1
804 1 10 ALA HA 1 13 VAL MG1 . . 4.000 3.726 3.491 3.831 . 0 0 "[ . 1 . 2 . 3]" 1
805 1 11 VAL HA 1 14 LEU HB3 . . 4.420 4.392 4.076 4.468 0.048 24 0 "[ . 1 . 2 . 3]" 1
806 1 82 ILE MG 2 11 VAL MG2 . . 3.710 3.200 2.774 3.431 . 0 0 "[ . 1 . 2 . 3]" 1
807 1 6 GLU HG3 2 13 VAL MG1 . . 3.220 2.486 2.087 3.237 0.017 25 0 "[ . 1 . 2 . 3]" 1
808 1 6 GLU QB 2 13 VAL MG2 . . 3.880 3.438 2.751 3.821 . 0 0 "[ . 1 . 2 . 3]" 1
809 1 6 GLU HG2 2 13 VAL MG2 . . 3.860 3.831 3.234 3.908 0.048 26 0 "[ . 1 . 2 . 3]" 1
810 1 90 ALA HA 2 15 VAL MG2 . . 4.030 3.573 2.895 4.050 0.020 6 0 "[ . 1 . 2 . 3]" 1
811 1 86 THR MG 2 15 VAL MG2 . . 4.600 2.296 1.914 3.229 . 0 0 "[ . 1 . 2 . 3]" 1
812 1 15 VAL MG1 2 94 HIS H . . 4.340 3.500 2.868 4.343 0.003 21 0 "[ . 1 . 2 . 3]" 1
813 1 90 ALA MB 2 15 VAL MG1 . . 3.520 2.598 2.037 3.528 0.008 11 0 "[ . 1 . 2 . 3]" 1
814 1 17 ASN H 1 17 ASN HB2 . . 4.100 2.493 2.030 3.593 . 0 0 "[ . 1 . 2 . 3]" 1
815 1 7 LEU MD2 2 17 ASN HB3 . . 4.200 3.391 2.377 4.211 0.011 1 0 "[ . 1 . 2 . 3]" 1
816 1 27 LEU HB3 1 28 VAL H . . 4.640 2.055 1.796 3.470 . 0 0 "[ . 1 . 2 . 3]" 1
817 1 17 ASN HD21 1 40 MET ME . . 4.380 3.301 1.955 4.400 0.020 25 0 "[ . 1 . 2 . 3]" 1
818 1 8 GLU HG2 2 45 LEU MD2 . . 4.430 2.658 2.155 4.449 0.019 9 0 "[ . 1 . 2 . 3]" 1
819 1 8 GLU HG3 2 45 LEU MD2 . . 4.100 3.065 2.127 4.121 0.021 18 0 "[ . 1 . 2 . 3]" 1
820 1 12 ILE MD 2 48 MET ME . . 3.610 3.338 2.176 3.623 0.013 7 0 "[ . 1 . 2 . 3]" 1
821 1 8 GLU HA 2 48 MET ME . . 3.740 3.155 2.401 3.742 0.002 22 0 "[ . 1 . 2 . 3]" 1
822 1 48 MET ME 2 12 ILE H . . 4.490 4.027 3.195 4.481 . 0 0 "[ . 1 . 2 . 3]" 1
823 1 12 ILE H 2 48 MET ME . . 4.490 3.988 3.307 4.441 . 0 0 "[ . 1 . 2 . 3]" 1
824 1 52 THR HA 1 55 ARG HB2 . . 3.920 2.463 2.003 2.988 . 0 0 "[ . 1 . 2 . 3]" 1
825 1 52 THR MG 1 56 LYS QD . . 4.060 3.370 2.472 4.073 0.013 26 0 "[ . 1 . 2 . 3]" 1
826 1 72 ARG HB3 1 72 ARG HD2 . . 3.890 4.052 3.719 4.220 0.330 10 0 "[ . 1 . 2 . 3]" 1
827 1 72 ARG HB2 1 72 ARG HD2 . . 3.730 3.519 2.951 3.781 0.051 14 0 "[ . 1 . 2 . 3]" 1
828 1 72 ARG HA 1 72 ARG HD2 . . 3.880 3.441 2.554 3.959 0.079 18 0 "[ . 1 . 2 . 3]" 1
829 1 72 ARG H 1 72 ARG HD2 . . 4.930 3.816 3.136 4.939 0.009 24 0 "[ . 1 . 2 . 3]" 1
830 1 56 LYS QG 1 59 ASP HB3 . . 4.230 4.025 2.686 4.274 0.044 12 0 "[ . 1 . 2 . 3]" 1
831 1 61 LEU MD2 1 62 ILE H . . 4.460 4.543 4.513 4.574 0.114 13 0 "[ . 1 . 2 . 3]" 1
832 1 76 ASP HA 1 79 TRP HB3 . . 4.230 3.668 2.863 4.264 0.034 17 0 "[ . 1 . 2 . 3]" 1
833 1 80 THR HA 1 83 GLY H . . 4.290 3.457 2.871 3.888 . 0 0 "[ . 1 . 2 . 3]" 1
834 1 65 LEU MD1 1 80 THR MG . . 3.550 2.460 1.984 3.497 . 0 0 "[ . 1 . 2 . 3]" 1
835 1 61 LEU MD2 1 84 GLY HA3 . . 4.080 2.358 2.041 2.769 . 0 0 "[ . 1 . 2 . 3]" 1
836 1 15 VAL MG1 2 86 THR MG . . 5.420 3.274 2.431 3.841 . 0 0 "[ . 1 . 2 . 3]" 1
837 1 7 LEU MD1 1 11 VAL H . . 4.980 4.099 3.655 4.537 . 0 0 "[ . 1 . 2 . 3]" 1
838 1 13 VAL HA 1 16 GLU HB2 . . 5.100 3.197 2.289 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
839 1 30 ASN HB2 1 31 LYS H . . 4.660 4.004 2.641 4.640 . 0 0 "[ . 1 . 2 . 3]" 1
840 1 42 GLN HA 1 49 LEU MD2 . . 4.420 3.690 2.458 4.448 0.028 8 0 "[ . 1 . 2 . 3]" 1
841 1 39 GLU HA 1 39 GLU HG2 . . 3.660 3.203 2.818 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
842 1 39 GLU HG2 1 43 LYS QE . . 4.440 3.643 2.626 4.493 0.053 26 0 "[ . 1 . 2 . 3]" 1
843 1 46 ASN HB3 2 5 THR MG . . 4.550 3.970 2.871 4.565 0.015 3 0 "[ . 1 . 2 . 3]" 1
844 1 42 GLN HE21 1 55 ARG HD2 . . 4.180 3.978 2.596 4.330 0.150 21 0 "[ . 1 . 2 . 3]" 1
845 1 42 GLN HE21 1 55 ARG HD3 . . 4.180 3.674 2.485 4.278 0.098 12 0 "[ . 1 . 2 . 3]" 1
846 1 42 GLN HE22 1 55 ARG HD3 . . 4.540 3.397 2.500 4.520 . 0 0 "[ . 1 . 2 . 3]" 1
847 1 42 GLN HE22 1 55 ARG HD2 . . 4.490 3.616 1.988 4.524 0.034 13 0 "[ . 1 . 2 . 3]" 1
848 1 72 ARG QG 1 73 ILE H . . 5.310 3.805 3.158 4.207 . 0 0 "[ . 1 . 2 . 3]" 1
849 1 17 ASN HA 1 20 LYS HB2 . . 4.830 2.751 2.120 3.681 . 0 0 "[ . 1 . 2 . 3]" 1
850 1 20 LYS HB2 1 20 LYS QD . . 3.570 2.795 2.022 3.539 . 0 0 "[ . 1 . 2 . 3]" 1
851 1 20 LYS HB2 1 20 LYS QE . . 4.140 3.159 2.078 4.174 0.034 3 0 "[ . 1 . 2 . 3]" 1
852 1 12 ILE HA 2 93 ILE MD . . 3.960 3.431 2.749 3.982 0.022 13 0 "[ . 1 . 2 . 3]" 1
853 1 30 ASN HB3 1 31 LYS H . . 4.570 3.704 1.922 4.653 0.083 4 0 "[ . 1 . 2 . 3]" 1
854 1 60 LYS HA 1 63 GLN HB3 . . 5.500 3.650 2.652 5.036 . 0 0 "[ . 1 . 2 . 3]" 1
855 1 99 GLN HG2 1 100 SER H . . 5.500 5.229 5.095 5.320 . 0 0 "[ . 1 . 2 . 3]" 1
856 1 82 ILE MD 1 85 ILE H . . 5.500 5.356 5.181 5.514 0.014 26 0 "[ . 1 . 2 . 3]" 1
857 1 92 LEU MD2 1 96 GLN H . . 5.500 4.074 3.474 5.518 0.018 10 0 "[ . 1 . 2 . 3]" 1
858 1 58 ALA HA 1 61 LEU MD1 . . 3.770 2.198 2.095 2.322 . 0 0 "[ . 1 . 2 . 3]" 1
859 1 15 VAL MG1 2 93 ILE H . . 5.200 4.869 4.326 5.226 0.026 21 0 "[ . 1 . 2 . 3]" 1
860 1 93 ILE H 2 15 VAL MG1 . . 5.200 4.876 4.299 5.230 0.030 22 0 "[ . 1 . 2 . 3]" 1
861 1 94 HIS H 2 15 VAL MG1 . . 4.340 3.572 2.940 4.360 0.020 21 0 "[ . 1 . 2 . 3]" 1
862 1 34 LYS HA 1 37 PHE QB . . 4.060 2.426 1.946 3.536 . 0 0 "[ . 1 . 2 . 3]" 1
863 1 21 TYR H 1 40 MET ME . . 5.500 4.313 3.212 5.505 0.005 20 0 "[ . 1 . 2 . 3]" 1
864 1 63 GLN HB3 1 63 GLN HE21 . . 3.910 2.630 1.997 3.885 . 0 0 "[ . 1 . 2 . 3]" 1
865 1 91 LYS HA 1 94 HIS H . . 4.150 3.845 3.513 4.137 . 0 0 "[ . 1 . 2 . 3]" 1
866 1 57 ALA MB 1 85 ILE HA . . 3.910 3.753 3.139 3.962 0.052 17 0 "[ . 1 . 2 . 3]" 1
867 1 86 THR MG 1 90 ALA HA . . 4.000 3.404 2.834 3.913 . 0 0 "[ . 1 . 2 . 3]" 1
868 1 41 LEU HA 1 44 GLU HB2 . . 3.910 3.296 2.297 3.983 0.073 3 0 "[ . 1 . 2 . 3]" 1
869 1 89 ILE H 1 90 ALA H . . 4.530 2.664 2.280 2.900 . 0 0 "[ . 1 . 2 . 3]" 1
870 1 16 GLU HB2 1 17 ASN H . . 5.500 3.697 2.993 4.099 . 0 0 "[ . 1 . 2 . 3]" 1
871 1 20 LYS HA 1 20 LYS QE . . 4.800 4.361 2.384 4.862 0.062 4 0 "[ . 1 . 2 . 3]" 1
872 1 98 GLN HB2 1 98 GLN HE22 . . 4.740 3.551 3.398 3.696 . 0 0 "[ . 1 . 2 . 3]" 1
873 1 17 ASN HB2 2 7 LEU MD2 . . 4.830 3.511 2.496 4.417 . 0 0 "[ . 1 . 2 . 3]" 1
874 1 55 ARG H 1 57 ALA H . . 5.370 4.221 3.788 4.464 . 0 0 "[ . 1 . 2 . 3]" 1
875 1 38 ARG HA 1 41 LEU HB3 . . 4.610 4.587 4.239 4.681 0.071 1 0 "[ . 1 . 2 . 3]" 1
876 1 35 SER H 1 36 SER H . . 4.780 2.727 2.502 2.966 . 0 0 "[ . 1 . 2 . 3]" 1
877 1 24 LYS H 1 24 LYS HD2 . . 5.150 4.265 2.008 5.195 0.045 1 0 "[ . 1 . 2 . 3]" 1
878 1 12 ILE HB 1 12 ILE MD . . 3.280 2.486 2.341 3.286 0.006 17 0 "[ . 1 . 2 . 3]" 1
879 1 51 ASP QB 1 53 GLY H . . 4.880 3.459 1.685 4.902 0.022 22 0 "[ . 1 . 2 . 3]" 1
880 1 48 MET ME 1 85 ILE MG . . 3.890 3.918 3.897 3.940 0.050 25 0 "[ . 1 . 2 . 3]" 1
881 1 85 ILE HG13 1 85 ILE MG . . 3.520 3.234 3.201 3.269 . 0 0 "[ . 1 . 2 . 3]" 1
882 1 85 ILE HG12 1 85 ILE MG . . 3.620 2.406 2.301 2.532 . 0 0 "[ . 1 . 2 . 3]" 1
883 1 31 LYS QE 1 31 LYS HG3 . . 3.580 2.577 2.249 3.305 . 0 0 "[ . 1 . 2 . 3]" 1
884 1 31 LYS H 1 31 LYS QD . . 4.450 3.931 2.044 4.479 0.029 21 0 "[ . 1 . 2 . 3]" 1
885 1 72 ARG HB2 1 72 ARG HE . . 5.300 3.774 2.433 4.722 . 0 0 "[ . 1 . 2 . 3]" 1
886 1 76 ASP HA 1 79 TRP H . . 5.380 3.303 2.446 3.873 . 0 0 "[ . 1 . 2 . 3]" 1
887 1 58 ALA MB 1 61 LEU MD1 . . 3.590 3.460 2.958 3.602 0.012 9 0 "[ . 1 . 2 . 3]" 1
888 1 63 GLN HA 1 63 GLN HE22 . . 5.500 4.719 3.456 5.611 0.111 9 0 "[ . 1 . 2 . 3]" 1
889 1 9 LYS HB2 1 9 LYS HD2 . . 4.000 3.818 3.650 3.896 . 0 0 "[ . 1 . 2 . 3]" 1
890 1 96 GLN HA 1 96 GLN HG3 . . 3.750 3.595 2.986 3.806 0.056 10 0 "[ . 1 . 2 . 3]" 1
891 1 82 ILE MD 2 7 LEU MD1 . . 4.530 3.148 2.505 3.605 . 0 0 "[ . 1 . 2 . 3]" 1
892 1 98 GLN HA 1 98 GLN HE22 . . 5.090 5.060 4.887 5.124 0.034 5 0 "[ . 1 . 2 . 3]" 1
893 1 36 SER HB2 1 37 PHE H . . 5.490 3.711 2.767 4.367 . 0 0 "[ . 1 . 2 . 3]" 1
894 1 85 ILE MG 1 86 THR HA . . 4.880 3.634 3.372 3.962 . 0 0 "[ . 1 . 2 . 3]" 1
895 1 88 PRO HD2 1 89 ILE H . . 5.290 3.042 2.938 3.302 . 0 0 "[ . 1 . 2 . 3]" 1
896 1 29 LYS QD 1 29 LYS HG2 . . 2.480 2.175 2.125 2.198 . 0 0 "[ . 1 . 2 . 3]" 1
897 1 55 ARG HA 1 55 ARG QG . . 3.470 2.722 2.113 3.282 . 0 0 "[ . 1 . 2 . 3]" 1
898 1 60 LYS HG3 1 61 LEU H . . 5.070 4.912 4.716 5.095 0.025 4 0 "[ . 1 . 2 . 3]" 1
899 1 74 SER HB3 1 76 ASP H . . 5.340 3.453 2.655 4.782 . 0 0 "[ . 1 . 2 . 3]" 1
900 1 96 GLN HE21 1 96 GLN HG3 . . 3.280 3.352 3.113 3.427 0.147 14 0 "[ . 1 . 2 . 3]" 1
901 1 96 GLN HA 1 96 GLN HE21 . . 3.880 3.653 2.578 3.935 0.055 28 0 "[ . 1 . 2 . 3]" 1
902 1 96 GLN HB3 1 96 GLN HE21 . . 4.170 2.733 1.787 3.936 . 0 0 "[ . 1 . 2 . 3]" 1
903 1 56 LYS HA 1 56 LYS QE . . 4.910 4.233 1.943 4.909 . 0 0 "[ . 1 . 2 . 3]" 1
904 1 61 LEU HA 1 64 ASN HB2 . . 3.900 3.481 2.186 3.943 0.043 12 0 "[ . 1 . 2 . 3]" 1
905 1 82 ILE HG13 1 82 ILE MG . . 3.320 3.201 3.162 3.235 . 0 0 "[ . 1 . 2 . 3]" 1
906 1 3 CYS H 1 4 TYR H . . 4.230 2.919 1.874 4.274 0.044 21 0 "[ . 1 . 2 . 3]" 1
907 1 56 LYS QB 1 59 ASP H . . 4.850 4.685 4.280 4.858 0.008 28 0 "[ . 1 . 2 . 3]" 1
908 1 75 PHE HB2 1 76 ASP H . . 4.670 2.550 2.206 3.190 . 0 0 "[ . 1 . 2 . 3]" 1
909 1 61 LEU MD1 1 84 GLY HA3 . . 4.220 2.473 2.153 2.806 . 0 0 "[ . 1 . 2 . 3]" 1
910 1 90 ALA MB 1 91 LYS HA . . 4.740 4.130 3.903 4.271 . 0 0 "[ . 1 . 2 . 3]" 1
911 1 17 ASN HA 1 20 LYS QD . . 5.250 3.979 2.036 5.264 0.014 2 0 "[ . 1 . 2 . 3]" 1
912 1 27 LEU H 1 28 VAL H . . 4.430 4.378 3.716 4.506 0.076 29 0 "[ . 1 . 2 . 3]" 1
913 1 27 LEU H 1 27 LEU MD2 . . 4.490 3.369 2.800 4.363 . 0 0 "[ . 1 . 2 . 3]" 1
914 1 94 HIS HB2 1 95 GLU H . . 4.800 4.025 3.839 4.639 . 0 0 "[ . 1 . 2 . 3]" 1
915 1 15 VAL H 1 16 GLU H . . 5.500 2.435 2.116 2.790 . 0 0 "[ . 1 . 2 . 3]" 1
916 1 16 GLU H 1 17 ASN H . . 5.220 2.984 2.638 3.299 . 0 0 "[ . 1 . 2 . 3]" 1
917 1 61 LEU HB2 1 62 ILE H . . 3.990 2.397 2.288 2.618 . 0 0 "[ . 1 . 2 . 3]" 1
918 1 60 LYS H 1 62 ILE H . . 5.300 4.384 4.226 4.551 . 0 0 "[ . 1 . 2 . 3]" 1
919 1 10 ALA MB 1 13 VAL MG1 . . 4.500 4.412 4.267 4.517 0.017 1 0 "[ . 1 . 2 . 3]" 1
920 1 63 GLN H 1 63 GLN HG2 . . 4.490 3.929 2.814 4.501 0.011 29 0 "[ . 1 . 2 . 3]" 1
921 1 60 LYS HG2 1 61 LEU H . . 4.240 4.270 3.881 4.329 0.089 2 0 "[ . 1 . 2 . 3]" 1
922 1 98 GLN H 1 98 GLN HB3 . . 4.070 2.302 2.186 2.429 . 0 0 "[ . 1 . 2 . 3]" 1
923 1 98 GLN HB3 1 98 GLN HE22 . . 5.010 4.908 4.736 5.010 . 8 0 "[ . 1 . 2 . 3]" 1
924 1 96 GLN HG2 1 97 GLU H . . 4.530 4.592 4.443 4.672 0.142 23 0 "[ . 1 . 2 . 3]" 1
925 1 65 LEU H 1 65 LEU MD2 . . 4.630 3.496 2.467 4.362 . 0 0 "[ . 1 . 2 . 3]" 1
926 1 85 ILE H 1 85 ILE MG . . 4.480 3.869 3.831 3.898 . 0 0 "[ . 1 . 2 . 3]" 1
927 1 61 LEU MD1 1 85 ILE H . . 4.510 2.825 2.588 3.135 . 0 0 "[ . 1 . 2 . 3]" 1
928 1 44 GLU H 1 46 ASN H . . 5.410 4.776 4.272 5.392 . 0 0 "[ . 1 . 2 . 3]" 1
929 1 43 LYS HD2 1 44 GLU H . . 5.310 4.962 4.520 5.407 0.097 24 0 "[ . 1 . 2 . 3]" 1
930 1 47 HIS H 1 49 LEU H . . 5.500 4.385 3.241 5.259 . 0 0 "[ . 1 . 2 . 3]" 1
931 1 49 LEU H 1 50 SER H . . 4.890 4.124 2.508 4.632 . 0 0 "[ . 1 . 2 . 3]" 1
932 1 54 ASN HB2 1 57 ALA MB . . 5.050 4.763 4.078 5.076 0.026 28 0 "[ . 1 . 2 . 3]" 1
933 1 54 ASN HD22 1 57 ALA MB . . 4.590 4.124 2.872 4.624 0.034 9 0 "[ . 1 . 2 . 3]" 1
934 1 45 LEU MD1 1 82 ILE MD . . 3.720 2.048 1.858 3.291 . 0 0 "[ . 1 . 2 . 3]" 1
935 1 13 VAL HA 1 16 GLU HB3 . . 4.690 2.876 2.294 3.588 . 0 0 "[ . 1 . 2 . 3]" 1
936 1 27 LEU HA 1 27 LEU MD1 . . 4.070 3.863 3.736 3.917 . 0 0 "[ . 1 . 2 . 3]" 1
937 1 31 LYS HA 1 31 LYS QD . . 5.010 3.068 2.051 4.517 . 0 0 "[ . 1 . 2 . 3]" 1
938 1 62 ILE MG 1 63 GLN H . . 3.900 3.427 2.904 3.930 0.030 21 0 "[ . 1 . 2 . 3]" 1
939 1 4 TYR HB2 1 5 THR H . . 5.500 3.845 2.422 4.326 . 0 0 "[ . 1 . 2 . 3]" 1
940 1 91 LYS HB2 1 91 LYS QD . . 3.540 3.186 2.407 3.380 . 0 0 "[ . 1 . 2 . 3]" 1
941 1 91 LYS H 1 91 LYS HB2 . . 4.040 2.102 1.860 3.682 . 0 0 "[ . 1 . 2 . 3]" 1
942 1 37 PHE H 1 38 ARG H . . 5.500 2.854 2.651 3.094 . 0 0 "[ . 1 . 2 . 3]" 1
943 1 46 ASN HA 1 46 ASN HD22 . . 5.500 4.608 4.257 5.124 . 0 0 "[ . 1 . 2 . 3]" 1
944 1 28 VAL H 1 28 VAL MG1 . . 4.050 3.140 1.968 4.080 0.030 20 0 "[ . 1 . 2 . 3]" 1
945 1 66 ASP H 1 67 ALA H . . 5.390 3.003 2.345 4.044 . 0 0 "[ . 1 . 2 . 3]" 1
946 1 29 LYS HG3 1 30 ASN H . . 5.500 5.089 4.416 5.614 0.114 14 0 "[ . 1 . 2 . 3]" 1
947 1 15 VAL HA 1 18 PHE HB3 . . 4.810 2.454 2.168 3.387 . 0 0 "[ . 1 . 2 . 3]" 1
948 1 40 MET HA 1 43 LYS H . . 5.500 3.423 3.065 3.859 . 0 0 "[ . 1 . 2 . 3]" 1
949 1 29 LYS H 1 29 LYS QD . . 4.470 4.011 3.350 4.510 0.040 27 0 "[ . 1 . 2 . 3]" 1
950 1 77 GLU H 1 77 GLU HG3 . . 5.060 3.696 2.487 4.573 . 0 0 "[ . 1 . 2 . 3]" 1
951 1 77 GLU H 1 78 TYR H . . 5.500 2.759 2.303 3.068 . 0 0 "[ . 1 . 2 . 3]" 1
952 1 62 ILE MD 1 63 GLN H . . 5.070 4.780 4.432 5.073 0.003 13 0 "[ . 1 . 2 . 3]" 1
953 1 17 ASN H 2 7 LEU MD2 . . 5.260 4.246 3.522 4.963 . 0 0 "[ . 1 . 2 . 3]" 1
954 1 13 VAL MG1 2 6 GLU QB . . 3.870 3.679 2.989 3.879 0.009 17 0 "[ . 1 . 2 . 3]" 1
955 1 88 PRO HD3 1 89 ILE H . . 5.500 4.099 4.016 4.253 . 0 0 "[ . 1 . 2 . 3]" 1
956 1 56 LYS QD 1 56 LYS QG . . 2.400 2.087 2.040 2.140 . 0 0 "[ . 1 . 2 . 3]" 1
957 1 20 LYS H 1 20 LYS HG2 . . 5.080 3.697 2.046 4.609 . 0 0 "[ . 1 . 2 . 3]" 1
958 1 72 ARG HB3 1 72 ARG HE . . 5.280 4.391 3.693 5.235 . 0 0 "[ . 1 . 2 . 3]" 1
959 1 44 GLU H 1 44 GLU HG3 . . 5.500 3.594 2.381 4.260 . 0 0 "[ . 1 . 2 . 3]" 1
960 1 44 GLU H 1 44 GLU HG2 . . 5.500 3.189 2.035 4.582 . 0 0 "[ . 1 . 2 . 3]" 1
961 1 48 MET ME 2 11 VAL MG1 . . 3.450 2.174 1.889 2.923 . 0 0 "[ . 1 . 2 . 3]" 1
962 1 90 ALA HA 1 93 ILE H . . 5.320 3.165 2.672 3.579 . 0 0 "[ . 1 . 2 . 3]" 1
963 1 96 GLN HB3 1 96 GLN HE22 . . 5.500 3.684 3.284 4.171 . 0 0 "[ . 1 . 2 . 3]" 1
964 1 16 GLU HA 1 19 TYR HB3 . . 5.500 4.818 4.004 5.488 . 0 0 "[ . 1 . 2 . 3]" 1
965 1 91 LYS HA 1 91 LYS QE . . 4.640 2.423 1.829 4.499 . 0 0 "[ . 1 . 2 . 3]" 1
966 1 6 GLU HG3 2 13 VAL MG2 . . 3.110 2.578 2.255 3.159 0.049 5 0 "[ . 1 . 2 . 3]" 1
967 1 29 LYS HB3 1 29 LYS QD . . 3.200 2.734 2.253 3.059 . 0 0 "[ . 1 . 2 . 3]" 1
968 1 77 GLU HA 1 77 GLU HG2 . . 3.980 2.774 2.356 3.222 . 0 0 "[ . 1 . 2 . 3]" 1
969 1 39 GLU H 1 39 GLU HG2 . . 4.290 4.282 3.951 4.427 0.137 26 0 "[ . 1 . 2 . 3]" 1
970 1 39 GLU HG2 1 43 LYS HD2 . . 4.100 2.757 2.098 4.143 0.043 12 0 "[ . 1 . 2 . 3]" 1
971 1 31 LYS H 1 31 LYS HG3 . . 4.920 4.029 1.799 4.929 0.009 15 0 "[ . 1 . 2 . 3]" 1
972 1 15 VAL HA 1 18 PHE HB2 . . 3.420 3.233 2.639 3.446 0.026 20 0 "[ . 1 . 2 . 3]" 1
973 1 75 PHE HB3 1 76 ASP H . . 5.320 3.611 2.772 3.876 . 0 0 "[ . 1 . 2 . 3]" 1
974 1 42 GLN HA 1 44 GLU H . . 5.390 4.745 3.788 5.419 0.029 27 0 "[ . 1 . 2 . 3]" 1
975 1 42 GLN HA 1 45 LEU HB3 . . 5.320 4.910 3.375 5.366 0.046 20 0 "[ . 1 . 2 . 3]" 1
976 1 42 GLN HA 1 42 GLN HE21 . . 5.420 4.090 1.828 5.275 . 0 0 "[ . 1 . 2 . 3]" 1
977 1 82 ILE H 1 83 GLY H . . 4.980 2.625 2.266 2.800 . 0 0 "[ . 1 . 2 . 3]" 1
978 1 54 ASN HA 1 57 ALA MB . . 4.010 2.698 2.147 3.273 . 0 0 "[ . 1 . 2 . 3]" 1
979 1 61 LEU HB2 1 61 LEU MD1 . . 3.470 2.252 2.154 2.298 . 0 0 "[ . 1 . 2 . 3]" 1
980 1 61 LEU HB2 1 61 LEU MD2 . . 3.490 3.185 3.135 3.244 . 0 0 "[ . 1 . 2 . 3]" 1
981 1 39 GLU H 1 39 GLU HB3 . . 3.690 2.383 1.981 3.177 . 0 0 "[ . 1 . 2 . 3]" 1
982 1 63 GLN HA 1 63 GLN HE21 . . 4.980 4.105 2.806 4.985 0.005 10 0 "[ . 1 . 2 . 3]" 1
983 1 92 LEU H 1 95 GLU H . . 5.100 4.823 4.603 5.106 0.006 21 0 "[ . 1 . 2 . 3]" 1
984 1 27 LEU HB2 1 27 LEU MD1 . . 3.380 2.312 2.274 2.357 . 0 0 "[ . 1 . 2 . 3]" 1
985 1 81 LEU H 1 81 LEU MD1 . . 5.500 4.225 3.484 4.369 . 0 0 "[ . 1 . 2 . 3]" 1
986 1 32 ILE H 1 32 ILE HG12 . . 5.500 3.801 1.887 4.691 . 0 0 "[ . 1 . 2 . 3]" 1
987 1 52 THR MG 1 56 LYS H . . 4.900 4.678 3.899 4.961 0.061 4 0 "[ . 1 . 2 . 3]" 1
988 1 39 GLU HB2 1 40 MET H . . 5.500 3.925 3.265 4.331 . 0 0 "[ . 1 . 2 . 3]" 1
989 1 60 LYS H 1 60 LYS HG3 . . 4.730 4.563 4.463 4.679 . 0 0 "[ . 1 . 2 . 3]" 1
990 1 60 LYS H 1 60 LYS HG2 . . 4.520 4.397 4.311 4.470 . 0 0 "[ . 1 . 2 . 3]" 1
991 1 57 ALA MB 1 60 LYS H . . 5.000 4.836 4.618 5.008 0.008 16 0 "[ . 1 . 2 . 3]" 1
992 1 60 LYS H 1 63 GLN H . . 5.230 4.792 4.678 5.259 0.029 16 0 "[ . 1 . 2 . 3]" 1
993 1 61 LEU H 1 61 LEU MD1 . . 4.110 3.341 3.143 3.569 . 0 0 "[ . 1 . 2 . 3]" 1
994 1 61 LEU H 1 61 LEU MD2 . . 4.110 3.620 2.808 3.890 . 0 0 "[ . 1 . 2 . 3]" 1
995 1 12 ILE MG 1 15 VAL MG1 . . 3.980 3.478 2.629 3.991 0.011 18 0 "[ . 1 . 2 . 3]" 1
996 1 90 ALA HA 2 15 VAL MG1 . . 3.910 3.169 2.257 3.790 . 0 0 "[ . 1 . 2 . 3]" 1
997 1 60 LYS HA 1 60 LYS QE . . 4.650 4.450 3.811 4.687 0.037 2 0 "[ . 1 . 2 . 3]" 1
998 1 45 LEU HB2 1 82 ILE MD . . 4.470 4.242 3.178 4.568 0.098 25 0 "[ . 1 . 2 . 3]" 1
999 1 85 ILE HA 1 85 ILE HG12 . . 4.130 2.609 2.522 2.696 . 0 0 "[ . 1 . 2 . 3]" 1
1000 1 65 LEU H 1 65 LEU HG . . 4.620 4.430 4.033 4.672 0.052 18 0 "[ . 1 . 2 . 3]" 1
1001 1 91 LYS HB3 1 91 LYS QD . . 3.380 2.388 2.199 3.434 0.054 11 0 "[ . 1 . 2 . 3]" 1
1002 1 4 TYR H 1 5 THR H . . 5.500 4.589 3.895 4.725 . 0 0 "[ . 1 . 2 . 3]" 1
1003 1 64 ASN H 1 65 LEU H . . 5.480 2.686 2.080 3.031 . 0 0 "[ . 1 . 2 . 3]" 1
1004 1 15 VAL MG1 2 93 ILE HB . . 3.490 2.851 2.306 3.388 . 0 0 "[ . 1 . 2 . 3]" 1
1005 1 64 ASN HA 1 64 ASN HD21 . . 4.760 2.793 2.013 4.157 . 0 0 "[ . 1 . 2 . 3]" 1
1006 1 9 LYS HA 1 12 ILE MG . . 4.610 3.537 2.943 3.889 . 0 0 "[ . 1 . 2 . 3]" 1
1007 1 9 LYS HA 1 12 ILE HB . . 4.730 2.214 2.033 2.540 . 0 0 "[ . 1 . 2 . 3]" 1
1008 1 82 ILE HG13 1 83 GLY H . . 4.770 4.741 4.634 4.787 0.017 11 0 "[ . 1 . 2 . 3]" 1
1009 1 62 ILE MD 1 62 ILE MG . . 3.310 2.179 2.103 2.379 . 0 0 "[ . 1 . 2 . 3]" 1
1010 1 13 VAL MG1 2 6 GLU HG2 . . 3.460 3.285 2.323 3.481 0.021 1 0 "[ . 1 . 2 . 3]" 1
1011 1 11 VAL HB 1 12 ILE H . . 5.070 2.619 2.436 2.847 . 0 0 "[ . 1 . 2 . 3]" 1
1012 1 48 MET ME 2 11 VAL HB . . 3.790 2.902 2.224 3.428 . 0 0 "[ . 1 . 2 . 3]" 1
1013 1 20 LYS H 1 20 LYS QD . . 4.730 4.105 2.697 4.732 0.002 21 0 "[ . 1 . 2 . 3]" 1
1014 1 98 GLN HB2 1 98 GLN HE21 . . 4.240 2.638 1.989 2.904 . 0 0 "[ . 1 . 2 . 3]" 1
1015 1 66 ASP HB2 1 73 ILE MD . . 4.870 3.318 2.149 4.327 . 0 0 "[ . 1 . 2 . 3]" 1
1016 1 42 GLN HB2 1 42 GLN HE22 . . 5.500 4.612 3.519 5.101 . 0 0 "[ . 1 . 2 . 3]" 1
1017 1 48 MET ME 1 86 THR MG . . 4.470 2.848 2.190 3.821 . 0 0 "[ . 1 . 2 . 3]" 1
1018 1 24 LYS H 1 24 LYS HD3 . . 5.070 4.105 2.754 5.073 0.003 4 0 "[ . 1 . 2 . 3]" 1
1019 1 47 HIS HE1 2 5 THR H . . 5.380 4.065 3.260 5.364 . 0 0 "[ . 1 . 2 . 3]" 1
1020 1 95 GLU HB2 1 96 GLN H . . 4.330 2.967 2.637 3.967 . 0 0 "[ . 1 . 2 . 3]" 1
1021 1 96 GLN HB2 1 97 GLU H . . 4.940 2.608 2.051 3.018 . 0 0 "[ . 1 . 2 . 3]" 1
1022 1 96 GLN HB3 1 97 GLU H . . 4.820 3.775 2.946 4.113 . 0 0 "[ . 1 . 2 . 3]" 1
1023 1 97 GLU H 2 12 ILE MG . . 4.910 4.764 4.264 4.956 0.046 8 0 "[ . 1 . 2 . 3]" 1
1024 1 57 ALA MB 1 59 ASP H . . 4.380 4.403 4.337 4.457 0.077 15 0 "[ . 1 . 2 . 3]" 1
1025 1 62 ILE H 1 64 ASN H . . 5.490 4.268 3.918 4.611 . 0 0 "[ . 1 . 2 . 3]" 1
1026 1 10 ALA H 2 13 VAL MG2 . . 5.150 4.596 4.169 4.951 . 0 0 "[ . 1 . 2 . 3]" 1
1027 1 13 VAL MG2 2 10 ALA H . . 5.140 4.609 4.247 5.057 . 0 0 "[ . 1 . 2 . 3]" 1
1028 1 25 TYR HB2 1 26 SER H . . 5.350 4.263 3.314 4.641 . 0 0 "[ . 1 . 2 . 3]" 1
1029 1 59 ASP HA 1 63 GLN H . . 5.270 4.031 3.592 5.126 . 0 0 "[ . 1 . 2 . 3]" 1
1030 1 61 LEU HA 1 63 GLN H . . 5.500 4.311 3.858 4.643 . 0 0 "[ . 1 . 2 . 3]" 1
1031 1 48 MET QB 1 49 LEU H . . 5.200 3.102 2.423 4.030 . 0 0 "[ . 1 . 2 . 3]" 1
1032 1 66 ASP HB2 1 67 ALA H . . 5.360 4.391 3.496 4.643 . 0 0 "[ . 1 . 2 . 3]" 1
1033 1 18 PHE HZ 1 75 PHE H . . 5.360 4.145 3.131 5.212 . 0 0 "[ . 1 . 2 . 3]" 1
1034 1 28 VAL MG1 1 30 ASN H . . 4.450 3.509 1.760 4.475 0.025 16 0 "[ . 1 . 2 . 3]" 1
1035 1 41 LEU HA 1 45 LEU H . . 5.140 3.553 2.919 4.018 . 0 0 "[ . 1 . 2 . 3]" 1
1036 1 4 TYR QD 1 5 THR H . . 4.970 3.871 2.734 4.295 . 0 0 "[ . 1 . 2 . 3]" 1
1037 1 4 TYR HA 1 4 TYR QD . . 4.210 2.353 2.086 2.907 . 0 0 "[ . 1 . 2 . 3]" 1
1038 1 4 TYR QD 2 47 HIS HB2 . . 4.950 3.292 2.440 4.400 . 0 0 "[ . 1 . 2 . 3]" 1
1039 1 47 HIS HB2 2 4 TYR QD . . 4.950 3.304 2.366 4.566 . 0 0 "[ . 1 . 2 . 3]" 1
1040 1 4 TYR HA 1 4 TYR QE . . 5.250 4.468 4.323 4.707 . 0 0 "[ . 1 . 2 . 3]" 1
1041 1 4 TYR QE 2 47 HIS HB2 . . 5.240 3.095 2.417 3.764 . 0 0 "[ . 1 . 2 . 3]" 1
1042 1 47 HIS HB2 2 4 TYR QE . . 5.240 3.153 2.374 4.627 . 0 0 "[ . 1 . 2 . 3]" 1
1043 1 4 TYR QD 2 47 HIS HB3 . . 5.290 3.694 2.799 5.148 . 0 0 "[ . 1 . 2 . 3]" 1
1044 1 47 HIS HB3 2 4 TYR QD . . 5.290 3.638 2.774 4.717 . 0 0 "[ . 1 . 2 . 3]" 1
1045 1 4 TYR QE 2 47 HIS HB3 . . 4.930 2.786 2.236 3.787 . 0 0 "[ . 1 . 2 . 3]" 1
1046 1 47 HIS HB3 2 4 TYR QE . . 4.930 2.722 2.172 4.171 . 0 0 "[ . 1 . 2 . 3]" 1
1047 1 79 TRP HA 1 79 TRP HD1 . . 4.350 2.491 2.354 2.665 . 0 0 "[ . 1 . 2 . 3]" 1
1048 1 21 TYR QD 1 22 VAL HA . . 4.770 3.469 2.586 4.216 . 0 0 "[ . 1 . 2 . 3]" 1
1049 1 47 HIS HA 1 47 HIS HD2 . . 4.580 3.081 2.697 4.073 . 0 0 "[ . 1 . 2 . 3]" 1
1050 1 79 TRP HD1 2 79 TRP HH2 . . 4.860 3.970 3.844 4.150 . 0 0 "[ . 1 . 2 . 3]" 1
1051 1 25 TYR H 1 25 TYR QD . . 4.570 3.511 2.131 4.535 . 0 0 "[ . 1 . 2 . 3]" 1
1052 1 79 TRP H 1 79 TRP HD1 . . 5.410 3.594 3.108 3.990 . 0 0 "[ . 1 . 2 . 3]" 1
1053 1 4 TYR QE 2 48 MET QB . . 5.500 4.363 3.384 5.511 0.011 27 0 "[ . 1 . 2 . 3]" 1
1054 1 48 MET QB 2 4 TYR QE . . 5.500 4.510 3.539 5.509 0.009 28 0 "[ . 1 . 2 . 3]" 1
1055 1 4 TYR QD 2 48 MET ME . . 4.830 4.729 4.211 4.858 0.028 5 0 "[ . 1 . 2 . 3]" 1
1056 1 4 TYR QE 2 48 MET ME . . 4.490 4.209 3.459 4.521 0.031 19 0 "[ . 1 . 2 . 3]" 1
1057 1 47 HIS HE1 2 5 THR MG . . 3.790 2.939 2.051 3.826 0.036 4 0 "[ . 1 . 2 . 3]" 1
1058 1 46 ASN HD22 1 47 HIS HE1 . . 5.210 4.579 2.711 5.243 0.033 5 0 "[ . 1 . 2 . 3]" 1
1059 1 46 ASN HD21 1 47 HIS HE1 . . 5.500 3.439 2.788 4.579 . 0 0 "[ . 1 . 2 . 3]" 1
1060 1 4 TYR QD 1 5 THR MG . . 4.910 4.946 4.907 4.970 0.060 29 0 "[ . 1 . 2 . 3]" 1
1061 1 4 TYR QD 1 9 LYS HD2 . . 4.990 3.596 2.334 5.008 0.018 20 0 "[ . 1 . 2 . 3]" 1
1062 1 4 TYR QE 1 12 ILE MG . . 5.160 5.087 4.520 5.199 0.039 15 0 "[ . 1 . 2 . 3]" 1
1063 1 4 TYR QE 1 12 ILE HG13 . . 5.430 4.529 3.317 5.270 . 0 0 "[ . 1 . 2 . 3]" 1
1064 1 4 TYR QD 1 12 ILE HG13 . . 4.540 4.278 2.767 4.629 0.089 28 0 "[ . 1 . 2 . 3]" 1
1065 1 4 TYR QD 1 12 ILE MD . . 4.470 2.374 2.045 3.228 . 0 0 "[ . 1 . 2 . 3]" 1
1066 1 4 TYR QE 1 12 ILE MD . . 4.300 2.372 2.113 3.213 . 0 0 "[ . 1 . 2 . 3]" 1
1067 1 25 TYR HA 1 25 TYR QD . . 4.050 2.676 2.203 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
1068 1 19 TYR QE 2 91 LYS H . . 5.500 4.592 4.008 5.048 . 0 0 "[ . 1 . 2 . 3]" 1
1069 1 91 LYS H 2 19 TYR QE . . 5.500 4.623 3.893 4.984 . 0 0 "[ . 1 . 2 . 3]" 1
1070 1 19 TYR QD 1 20 LYS H . . 5.500 4.592 4.329 4.942 . 0 0 "[ . 1 . 2 . 3]" 1
1071 1 18 PHE QD 1 19 TYR QD . . 4.440 3.323 2.459 4.094 . 0 0 "[ . 1 . 2 . 3]" 1
1072 1 16 GLU HA 1 19 TYR QD . . 5.090 3.821 2.296 5.089 . 0 0 "[ . 1 . 2 . 3]" 1
1073 1 19 TYR QD 2 91 LYS HA . . 5.500 5.350 4.453 5.557 0.057 8 0 "[ . 1 . 2 . 3]" 1
1074 1 91 LYS HA 2 19 TYR QD . . 5.500 5.381 4.658 5.550 0.050 8 0 "[ . 1 . 2 . 3]" 1
1075 1 19 TYR QE 2 91 LYS HA . . 4.620 3.622 2.870 3.893 . 0 0 "[ . 1 . 2 . 3]" 1
1076 1 91 LYS HA 2 19 TYR QE . . 4.620 3.644 2.759 3.917 . 0 0 "[ . 1 . 2 . 3]" 1
1077 1 80 THR HA 2 79 TRP HE3 . . 4.400 3.593 3.110 4.104 . 0 0 "[ . 1 . 2 . 3]" 1
1078 1 79 TRP HA 1 79 TRP HE3 . . 4.890 4.676 4.493 4.782 . 0 0 "[ . 1 . 2 . 3]" 1
1079 1 19 TYR QE 2 90 ALA HA . . 5.000 4.203 3.540 4.944 . 0 0 "[ . 1 . 2 . 3]" 1
1080 1 90 ALA HA 2 19 TYR QE . . 5.000 4.170 3.615 4.876 . 0 0 "[ . 1 . 2 . 3]" 1
1081 1 19 TYR HA 1 19 TYR QD . . 4.510 2.724 2.239 3.153 . 0 0 "[ . 1 . 2 . 3]" 1
1082 1 19 TYR HA 1 19 TYR QE . . 5.300 4.518 4.247 4.692 . 0 0 "[ . 1 . 2 . 3]" 1
1083 1 15 VAL MG1 1 19 TYR QE . . 3.740 2.763 2.080 3.759 0.019 15 0 "[ . 1 . 2 . 3]" 1
1084 1 15 VAL MG1 1 19 TYR QD . . 4.150 2.672 2.070 4.014 . 0 0 "[ . 1 . 2 . 3]" 1
1085 1 15 VAL MG2 1 19 TYR QE . . 4.890 3.600 2.159 4.670 . 0 0 "[ . 1 . 2 . 3]" 1
1086 1 19 TYR QE 2 90 ALA MB . . 3.780 2.644 2.214 3.284 . 0 0 "[ . 1 . 2 . 3]" 1
1087 1 90 ALA MB 2 19 TYR QE . . 3.780 2.619 2.201 3.309 . 0 0 "[ . 1 . 2 . 3]" 1
1088 1 21 TYR QE 1 22 VAL MG2 . . 4.510 4.167 3.276 4.555 0.045 5 0 "[ . 1 . 2 . 3]" 1
1089 1 18 PHE QE 1 19 TYR QE . . 4.960 4.192 2.970 4.965 0.005 10 0 "[ . 1 . 2 . 3]" 1
1090 1 18 PHE QE 1 19 TYR QD . . 4.990 4.506 3.518 5.007 0.017 12 0 "[ . 1 . 2 . 3]" 1
1091 1 4 TYR HA 1 5 THR MG . . 4.750 3.608 3.288 3.974 . 0 0 "[ . 1 . 2 . 3]" 1
1092 1 13 VAL MG2 2 7 LEU H . . 5.280 5.146 4.899 5.291 0.011 24 0 "[ . 1 . 2 . 3]" 1
1093 1 7 LEU H 2 13 VAL MG2 . . 5.280 5.144 4.817 5.290 0.010 20 0 "[ . 1 . 2 . 3]" 1
1094 1 13 VAL MG2 2 6 GLU HG3 . . 3.110 2.609 2.368 3.163 0.053 5 0 "[ . 1 . 2 . 3]" 1
1095 1 6 GLU QB 2 13 VAL MG1 . . 3.870 3.688 2.987 3.892 0.022 24 0 "[ . 1 . 2 . 3]" 1
1096 1 6 GLU HG2 2 13 VAL MG1 . . 3.460 3.336 2.299 3.493 0.033 19 0 "[ . 1 . 2 . 3]" 1
1097 1 7 LEU MD1 2 82 ILE MD . . 4.530 3.137 2.370 3.608 . 0 0 "[ . 1 . 2 . 3]" 1
1098 1 7 LEU MD2 2 17 ASN HB2 . . 4.830 3.454 2.440 4.320 . 0 0 "[ . 1 . 2 . 3]" 1
1099 1 9 LYS HD2 1 12 ILE MD . . 4.990 2.743 2.134 5.001 0.011 20 0 "[ . 1 . 2 . 3]" 1
1100 1 10 ALA MB 1 11 VAL H . . 4.270 2.607 2.478 2.696 . 0 0 "[ . 1 . 2 . 3]" 1
1101 1 13 VAL MG1 2 11 VAL H . . 5.480 4.711 4.275 5.127 . 0 0 "[ . 1 . 2 . 3]" 1
1102 1 14 LEU MD2 2 11 VAL H . . 5.320 3.291 2.922 3.541 . 0 0 "[ . 1 . 2 . 3]" 1
1103 1 11 VAL H 2 14 LEU MD2 . . 5.330 3.290 2.933 3.747 . 0 0 "[ . 1 . 2 . 3]" 1
1104 1 11 VAL HB 2 48 MET ME . . 3.790 2.834 2.306 3.376 . 0 0 "[ . 1 . 2 . 3]" 1
1105 1 79 TRP HA 1 82 ILE MG . . 4.760 2.738 2.563 2.933 . 0 0 "[ . 1 . 2 . 3]" 1
1106 1 10 ALA HA 1 14 LEU MD2 . . 5.500 4.205 3.856 4.481 . 0 0 "[ . 1 . 2 . 3]" 1
1107 1 11 VAL MG1 2 48 MET ME . . 3.450 2.132 1.861 2.819 . 0 0 "[ . 1 . 2 . 3]" 1
1108 1 48 MET ME 2 11 VAL MG2 . . 4.350 3.315 2.631 3.698 . 0 0 "[ . 1 . 2 . 3]" 1
1109 1 11 VAL MG2 2 48 MET ME . . 4.350 3.246 2.481 3.696 . 0 0 "[ . 1 . 2 . 3]" 1
1110 1 11 VAL MG1 1 12 ILE MD . . 4.630 4.530 3.440 4.650 0.020 26 0 "[ . 1 . 2 . 3]" 1
1111 1 12 ILE MD 2 93 ILE MG . . 4.320 2.589 1.982 3.047 . 0 0 "[ . 1 . 2 . 3]" 1
1112 1 93 ILE MG 2 12 ILE MD . . 4.320 2.656 2.002 3.209 . 0 0 "[ . 1 . 2 . 3]" 1
1113 1 11 VAL H 2 13 VAL MG1 . . 5.480 4.696 4.262 5.012 . 0 0 "[ . 1 . 2 . 3]" 1
1114 1 15 VAL HB 1 16 GLU H . . 4.920 3.301 2.686 4.374 . 0 0 "[ . 1 . 2 . 3]" 1
1115 1 15 VAL MG1 2 90 ALA HA . . 3.910 3.164 2.397 3.818 . 0 0 "[ . 1 . 2 . 3]" 1
1116 1 93 ILE HB 2 15 VAL MG1 . . 3.490 2.854 2.285 3.456 . 0 0 "[ . 1 . 2 . 3]" 1
1117 1 11 VAL MG1 1 12 ILE HA . . 4.770 3.618 3.491 3.926 . 0 0 "[ . 1 . 2 . 3]" 1
1118 1 7 LEU MD2 2 14 LEU H . . 5.100 4.028 3.677 4.494 . 0 0 "[ . 1 . 2 . 3]" 1
1119 1 14 LEU H 2 7 LEU MD2 . . 5.100 4.015 3.689 4.364 . 0 0 "[ . 1 . 2 . 3]" 1
1120 1 62 ILE MG 1 63 GLN HA . . 4.480 3.781 3.425 4.281 . 0 0 "[ . 1 . 2 . 3]" 1
1121 1 17 ASN HA 1 20 LYS HG2 . . 5.410 4.143 2.053 5.425 0.015 17 0 "[ . 1 . 2 . 3]" 1
1122 1 5 THR HA 1 6 GLU QB . . 5.220 4.377 4.199 4.770 . 0 0 "[ . 1 . 2 . 3]" 1
1123 1 18 PHE HA 1 18 PHE QE . . 4.990 4.675 4.424 5.011 0.021 3 0 "[ . 1 . 2 . 3]" 1
1124 1 18 PHE HA 1 18 PHE QD . . 4.430 2.667 2.264 3.192 . 0 0 "[ . 1 . 2 . 3]" 1
1125 1 17 ASN HA 1 20 LYS QE . . 5.350 3.291 1.757 5.227 . 0 0 "[ . 1 . 2 . 3]" 1
1126 1 21 TYR QE 1 22 VAL HA . . 4.760 4.313 3.293 4.787 0.027 2 0 "[ . 1 . 2 . 3]" 1
1127 1 66 ASP HB3 1 73 ILE MD . . 4.680 3.775 2.934 4.679 . 0 0 "[ . 1 . 2 . 3]" 1
1128 1 66 ASP HA 1 73 ILE MD . . 5.080 4.658 3.835 5.146 0.066 11 0 "[ . 1 . 2 . 3]" 1
1129 1 13 VAL MG1 2 10 ALA H . . 4.970 3.607 3.328 4.301 . 0 0 "[ . 1 . 2 . 3]" 1
1130 1 10 ALA H 2 13 VAL MG1 . . 4.970 3.596 3.343 4.235 . 0 0 "[ . 1 . 2 . 3]" 1
1131 1 52 THR MG 1 56 LYS QE . . 4.890 2.875 2.034 3.943 . 0 0 "[ . 1 . 2 . 3]" 1
1132 1 47 HIS H 1 47 HIS HD2 . . 5.310 4.395 2.014 4.958 . 0 0 "[ . 1 . 2 . 3]" 1
1133 1 69 HIS HA 1 69 HIS HD2 . . 5.130 3.390 2.290 4.905 . 0 0 "[ . 1 . 2 . 3]" 1
1134 1 41 LEU HB2 1 82 ILE MD . . 4.950 4.805 4.247 5.010 0.060 1 0 "[ . 1 . 2 . 3]" 1
1135 1 41 LEU MD2 1 82 ILE MD . . 4.040 2.160 1.978 3.876 . 0 0 "[ . 1 . 2 . 3]" 1
1136 1 82 ILE MD 1 85 ILE HG13 . . 4.950 4.724 4.341 4.955 0.005 27 0 "[ . 1 . 2 . 3]" 1
1137 1 40 MET ME 1 78 TYR QE . . 4.670 2.607 2.148 3.092 . 0 0 "[ . 1 . 2 . 3]" 1
1138 1 40 MET HA 1 43 LYS HB2 . . 5.010 3.091 2.317 3.976 . 0 0 "[ . 1 . 2 . 3]" 1
1139 1 18 PHE QD 1 21 TYR H . . 4.280 5.609 5.028 6.062 1.782 2 30 [*+*********************-******] 1
1140 1 75 PHE H 1 75 PHE QD . . 5.130 2.620 2.219 3.294 . 0 0 "[ . 1 . 2 . 3]" 1
1141 1 75 PHE QD 1 76 ASP H . . 5.050 3.962 3.313 4.715 . 0 0 "[ . 1 . 2 . 3]" 1
1142 1 75 PHE HA 1 75 PHE QD . . 4.290 2.711 2.344 2.932 . 0 0 "[ . 1 . 2 . 3]" 1
1143 1 49 LEU MD1 1 54 ASN H . . 5.350 4.792 3.677 5.383 0.033 24 0 "[ . 1 . 2 . 3]" 1
1144 1 18 PHE HZ 1 75 PHE HA . . 5.220 4.319 3.733 5.260 0.040 14 0 "[ . 1 . 2 . 3]" 1
1145 1 38 ARG QD 1 55 ARG HB2 . . 5.220 5.129 4.320 5.318 0.098 30 0 "[ . 1 . 2 . 3]" 1
1146 1 38 ARG QD 1 55 ARG HB3 . . 5.410 3.803 3.037 5.011 . 0 0 "[ . 1 . 2 . 3]" 1
1147 1 17 ASN HB2 2 7 LEU HG . . 4.430 4.124 3.215 4.458 0.028 16 0 "[ . 1 . 2 . 3]" 1
1148 1 7 LEU HG 2 17 ASN HB2 . . 4.430 4.083 2.827 4.449 0.019 10 0 "[ . 1 . 2 . 3]" 1
1149 1 93 ILE MG 2 12 ILE HA . . 3.500 2.597 2.217 3.072 . 0 0 "[ . 1 . 2 . 3]" 1
1150 1 12 ILE HA 2 93 ILE MG . . 3.500 2.596 2.223 2.964 . 0 0 "[ . 1 . 2 . 3]" 1
1151 1 59 ASP HA 1 62 ILE MG . . 4.450 3.639 3.234 4.489 0.039 16 0 "[ . 1 . 2 . 3]" 1
1152 1 75 PHE HA 1 75 PHE QE . . 4.810 4.642 4.305 4.826 0.016 15 0 "[ . 1 . 2 . 3]" 1
1153 1 18 PHE QE 1 75 PHE QD . . 5.170 3.377 2.397 4.177 . 0 0 "[ . 1 . 2 . 3]" 1
1154 1 18 PHE QD 1 75 PHE QD . . 3.890 3.279 2.454 3.908 0.018 18 0 "[ . 1 . 2 . 3]" 1
1155 1 75 PHE QD 2 87 GLY HA2 . . 4.400 2.562 2.225 3.040 . 0 0 "[ . 1 . 2 . 3]" 1
1156 1 75 PHE QE 2 87 GLY HA2 . . 4.250 3.595 2.404 4.256 0.006 15 0 "[ . 1 . 2 . 3]" 1
1157 1 75 PHE QD 2 86 THR MG . . 4.800 4.360 3.977 4.820 0.020 27 0 "[ . 1 . 2 . 3]" 1
1158 1 75 PHE QD 2 90 ALA MB . . 4.750 3.103 2.813 3.611 . 0 0 "[ . 1 . 2 . 3]" 1
1159 1 15 VAL MG2 1 75 PHE QD . . 5.120 2.829 2.143 3.884 . 0 0 "[ . 1 . 2 . 3]" 1
1160 1 79 TRP HZ3 2 82 ILE MD . . 5.450 4.600 4.305 5.038 . 0 0 "[ . 1 . 2 . 3]" 1
1161 1 79 TRP HZ3 2 82 ILE MG . . 4.100 1.985 1.924 2.050 . 0 0 "[ . 1 . 2 . 3]" 1
1162 1 79 TRP HZ3 2 82 ILE HG13 . . 5.500 5.377 4.933 5.525 0.025 8 0 "[ . 1 . 2 . 3]" 1
1163 1 11 VAL MG2 1 79 TRP HZ3 . . 5.500 4.549 4.150 4.999 . 0 0 "[ . 1 . 2 . 3]" 1
1164 1 79 TRP HZ3 2 14 LEU MD1 . . 5.120 3.713 3.460 4.070 . 0 0 "[ . 1 . 2 . 3]" 1
1165 1 79 TRP HZ3 2 14 LEU MD2 . . 4.950 4.949 4.862 5.001 0.051 3 0 "[ . 1 . 2 . 3]" 1
1166 1 79 TRP HZ3 2 80 THR H . . 5.500 5.039 4.894 5.272 . 0 0 "[ . 1 . 2 . 3]" 1
1167 1 83 GLY H 2 79 TRP HZ3 . . 5.310 2.935 2.703 3.201 . 0 0 "[ . 1 . 2 . 3]" 1
1168 1 11 VAL MG2 1 79 TRP HH2 . . 4.500 2.710 2.257 3.106 . 0 0 "[ . 1 . 2 . 3]" 1
1169 1 79 TRP HH2 2 82 ILE MG . . 4.050 2.279 2.201 2.366 . 0 0 "[ . 1 . 2 . 3]" 1
1170 1 78 TYR QE 1 82 ILE MG . . 4.270 3.551 2.435 4.292 0.022 28 0 "[ . 1 . 2 . 3]" 1
1171 1 73 ILE MG 1 78 TYR QE . . 4.130 3.636 3.018 4.181 0.051 27 0 "[ . 1 . 2 . 3]" 1
1172 1 79 TRP HZ2 2 82 ILE MG . . 4.440 4.281 4.157 4.461 0.021 4 0 "[ . 1 . 2 . 3]" 1
1173 1 79 TRP HZ2 2 14 LEU MD2 . . 4.020 2.917 2.699 3.128 . 0 0 "[ . 1 . 2 . 3]" 1
1174 1 14 LEU MD1 1 78 TYR QE . . 4.460 3.672 2.127 4.462 0.002 21 0 "[ . 1 . 2 . 3]" 1
1175 1 79 TRP HZ2 2 14 LEU HB2 . . 4.850 4.851 4.719 4.897 0.047 1 0 "[ . 1 . 2 . 3]" 1
1176 1 79 TRP HD1 1 82 ILE MG . . 5.040 3.897 3.606 4.090 . 0 0 "[ . 1 . 2 . 3]" 1
1177 1 14 LEU MD1 1 79 TRP HD1 . . 4.890 2.914 2.669 3.291 . 0 0 "[ . 1 . 2 . 3]" 1
1178 1 14 LEU MD2 1 79 TRP HD1 . . 5.050 4.875 4.654 5.029 . 0 0 "[ . 1 . 2 . 3]" 1
1179 1 79 TRP H 1 79 TRP HE3 . . 5.500 5.535 5.503 5.580 0.080 14 0 "[ . 1 . 2 . 3]" 1
1180 1 79 TRP HE3 2 83 GLY H . . 5.500 2.816 2.613 3.470 . 0 0 "[ . 1 . 2 . 3]" 1
1181 1 14 LEU MD1 1 82 ILE MG . . 4.100 2.557 2.366 2.770 . 0 0 "[ . 1 . 2 . 3]" 1
1182 1 61 LEU MD2 1 84 GLY H . . 4.040 3.658 3.324 4.049 0.009 22 0 "[ . 1 . 2 . 3]" 1
1183 1 80 THR H 2 79 TRP HE3 . . 4.520 4.463 4.035 4.603 0.083 14 0 "[ . 1 . 2 . 3]" 1
1184 1 92 LEU MD2 1 93 ILE H . . 5.220 4.532 4.234 4.813 . 0 0 "[ . 1 . 2 . 3]" 1
1185 1 8 GLU HA 1 12 ILE MD . . 5.500 4.305 3.743 4.955 . 0 0 "[ . 1 . 2 . 3]" 1
1186 1 18 PHE HA 1 21 TYR QD . . 5.270 4.153 2.742 5.319 0.049 14 0 "[ . 1 . 2 . 3]" 1
1187 1 97 GLU H 1 98 GLN H . . 3.810 2.808 2.547 3.223 . 0 0 "[ . 1 . 2 . 3]" 1
1188 1 79 TRP HZ2 2 79 TRP HD1 . . 5.240 5.561 5.532 5.604 0.364 27 0 "[ . 1 . 2 . 3]" 1
1189 1 79 TRP HD1 2 79 TRP HZ2 . . 5.240 5.559 5.526 5.588 0.348 14 0 "[ . 1 . 2 . 3]" 1
1190 1 79 TRP HH2 2 79 TRP HD1 . . 4.860 3.971 3.807 4.143 . 0 0 "[ . 1 . 2 . 3]" 1
1191 1 83 GLY H 2 79 TRP HE3 . . 5.500 2.820 2.627 3.473 . 0 0 "[ . 1 . 2 . 3]" 1
1192 1 18 PHE HZ 1 22 VAL MG1 . . 4.550 3.921 2.784 4.562 0.012 24 0 "[ . 1 . 2 . 3]" 1
1193 1 18 PHE HZ 1 73 ILE MG . . 5.080 3.961 2.400 5.103 0.023 28 0 "[ . 1 . 2 . 3]" 1
1194 1 18 PHE HZ 1 22 VAL MG2 . . 4.960 3.237 2.787 4.004 . 0 0 "[ . 1 . 2 . 3]" 1
1195 1 73 ILE MD 1 78 TYR QD . . 5.010 4.419 3.612 5.015 0.005 13 0 "[ . 1 . 2 . 3]" 1
1196 1 21 TYR QD 1 22 VAL MG2 . . 4.220 3.026 2.220 4.244 0.024 20 0 "[ . 1 . 2 . 3]" 1
1197 1 41 LEU MD1 1 78 TYR QD . . 4.720 4.785 3.894 5.131 0.411 13 0 "[ . 1 . 2 . 3]" 1
1198 1 41 LEU MD2 1 78 TYR QD . . 4.070 4.089 3.966 4.139 0.069 11 0 "[ . 1 . 2 . 3]" 1
1199 1 73 ILE MG 1 78 TYR QD . . 4.320 2.128 1.962 2.359 . 0 0 "[ . 1 . 2 . 3]" 1
1200 1 79 TRP HZ2 2 14 LEU HG . . 4.760 3.125 2.882 3.328 . 0 0 "[ . 1 . 2 . 3]" 1
1201 1 79 TRP HH2 2 14 LEU HG . . 5.500 2.328 2.194 2.683 . 0 0 "[ . 1 . 2 . 3]" 1
1202 1 79 TRP HH2 2 14 LEU HB3 . . 5.500 4.474 4.254 4.959 . 0 0 "[ . 1 . 2 . 3]" 1
1203 1 14 LEU HB2 1 79 TRP HD1 . . 5.500 4.611 3.923 5.288 . 0 0 "[ . 1 . 2 . 3]" 1
1204 1 14 LEU HB3 1 79 TRP HD1 . . 5.500 3.219 2.522 3.880 . 0 0 "[ . 1 . 2 . 3]" 1
1205 1 11 VAL MG2 1 79 TRP HZ2 . . 5.500 2.832 2.503 3.316 . 0 0 "[ . 1 . 2 . 3]" 1
1206 1 11 VAL MG1 1 79 TRP HZ2 . . 5.500 3.633 3.149 4.100 . 0 0 "[ . 1 . 2 . 3]" 1
1207 1 37 PHE QE 1 82 ILE MG . . 4.750 4.589 3.837 4.792 0.042 27 0 "[ . 1 . 2 . 3]" 1
1208 1 11 VAL MG1 1 79 TRP HH2 . . 5.500 4.191 3.556 4.562 . 0 0 "[ . 1 . 2 . 3]" 1
1209 1 14 LEU MD1 2 79 TRP HH2 . . 4.210 2.354 2.154 2.834 . 0 0 "[ . 1 . 2 . 3]" 1
1210 1 14 LEU MD2 2 79 TRP HH2 . . 3.990 2.867 2.811 2.951 . 0 0 "[ . 1 . 2 . 3]" 1
1211 1 82 ILE HB 2 79 TRP HH2 . . 5.250 5.254 5.179 5.280 0.030 26 0 "[ . 1 . 2 . 3]" 1
1212 1 11 VAL HA 1 79 TRP HH2 . . 5.500 4.330 3.773 4.579 . 0 0 "[ . 1 . 2 . 3]" 1
1213 1 11 VAL HA 1 79 TRP HZ2 . . 5.190 2.660 2.194 3.032 . 0 0 "[ . 1 . 2 . 3]" 1
1214 1 41 LEU MD1 1 78 TYR QE . . 4.960 3.812 2.404 4.511 . 0 0 "[ . 1 . 2 . 3]" 1
1215 1 41 LEU MD2 1 78 TYR QE . . 4.280 2.545 2.076 3.054 . 0 0 "[ . 1 . 2 . 3]" 1
1216 1 73 ILE HB 1 78 TYR QD . . 4.740 3.363 2.236 4.732 . 0 0 "[ . 1 . 2 . 3]" 1
1217 1 40 MET ME 1 78 TYR QD . . 4.330 4.193 3.717 4.354 0.024 15 0 "[ . 1 . 2 . 3]" 1
1218 1 78 TYR QE 1 81 LEU QB . . 5.300 4.877 4.349 5.105 . 0 0 "[ . 1 . 2 . 3]" 1
1219 1 78 TYR QD 1 81 LEU QB . . 5.090 4.086 3.655 4.351 . 0 0 "[ . 1 . 2 . 3]" 1
1220 1 21 TYR HA 1 21 TYR QD . . 4.530 2.735 2.358 3.178 . 0 0 "[ . 1 . 2 . 3]" 1
1221 1 15 VAL MG2 1 18 PHE QD . . 4.300 3.774 2.175 4.322 0.022 19 0 "[ . 1 . 2 . 3]" 1
1222 1 15 VAL MG2 1 75 PHE QE . . 4.170 3.539 2.093 4.190 0.020 26 0 "[ . 1 . 2 . 3]" 1
1223 1 94 HIS HD2 2 16 GLU HA . . 5.070 4.203 2.755 5.091 0.021 21 0 "[ . 1 . 2 . 3]" 1
1224 1 5 THR H 2 47 HIS HE1 . . 5.380 4.043 3.097 5.228 . 0 0 "[ . 1 . 2 . 3]" 1
1225 1 47 HIS HE1 2 4 TYR HA . . 4.950 3.659 2.687 4.917 . 0 0 "[ . 1 . 2 . 3]" 1
1226 1 4 TYR HA 2 47 HIS HE1 . . 4.950 3.681 2.573 4.900 . 0 0 "[ . 1 . 2 . 3]" 1
1227 1 5 THR MG 2 47 HIS HE1 . . 3.790 2.883 2.139 3.832 0.042 4 0 "[ . 1 . 2 . 3]" 1
1228 1 14 LEU MD2 2 79 TRP HZ3 . . 4.950 4.957 4.891 5.000 0.050 3 0 "[ . 1 . 2 . 3]" 1
1229 1 14 LEU MD1 2 79 TRP HZ3 . . 5.120 3.725 3.479 4.017 . 0 0 "[ . 1 . 2 . 3]" 1
1230 1 14 LEU HG 2 79 TRP HH2 . . 5.500 2.361 2.185 2.781 . 0 0 "[ . 1 . 2 . 3]" 1
1231 1 14 LEU HB3 2 79 TRP HH2 . . 5.500 4.501 4.279 4.891 . 0 0 "[ . 1 . 2 . 3]" 1
1232 1 14 LEU MD1 2 79 TRP HZ2 . . 4.720 4.004 3.752 4.404 . 0 0 "[ . 1 . 2 . 3]" 1
1233 1 14 LEU MD2 2 79 TRP HZ2 . . 4.020 2.875 2.664 3.128 . 0 0 "[ . 1 . 2 . 3]" 1
1234 1 82 ILE MG 2 79 TRP HZ2 . . 4.440 4.255 4.147 4.435 . 0 0 "[ . 1 . 2 . 3]" 1
1235 1 82 ILE MG 2 79 TRP HH2 . . 4.050 2.277 2.182 2.447 . 0 0 "[ . 1 . 2 . 3]" 1
1236 1 82 ILE MG 2 79 TRP HZ3 . . 4.100 1.982 1.905 2.031 . 0 0 "[ . 1 . 2 . 3]" 1
1237 1 14 LEU HG 2 79 TRP HZ2 . . 4.760 3.093 2.910 3.330 . 0 0 "[ . 1 . 2 . 3]" 1
1238 1 14 LEU HB3 2 79 TRP HZ2 . . 5.500 5.349 5.201 5.510 0.010 15 0 "[ . 1 . 2 . 3]" 1
1239 1 14 LEU HB2 2 79 TRP HZ2 . . 4.850 4.839 4.704 4.884 0.034 27 0 "[ . 1 . 2 . 3]" 1
1240 1 82 ILE HB 2 79 TRP HZ3 . . 4.800 4.611 4.400 4.726 . 0 0 "[ . 1 . 2 . 3]" 1
1241 1 79 TRP HZ3 2 82 ILE HB . . 4.800 4.621 4.470 4.721 . 0 0 "[ . 1 . 2 . 3]" 1
1242 1 79 TRP HH2 2 14 LEU MD1 . . 4.210 2.382 2.153 2.879 . 0 0 "[ . 1 . 2 . 3]" 1
1243 1 79 TRP HH2 2 14 LEU MD2 . . 3.990 2.871 2.788 2.978 . 0 0 "[ . 1 . 2 . 3]" 1
1244 1 79 TRP HH2 2 82 ILE HB . . 5.250 5.259 5.192 5.280 0.030 15 0 "[ . 1 . 2 . 3]" 1
1245 1 79 TRP HZ2 2 14 LEU MD1 . . 4.720 4.049 3.771 4.392 . 0 0 "[ . 1 . 2 . 3]" 1
1246 1 79 TRP HZ2 2 14 LEU HB3 . . 5.500 5.372 5.206 5.502 0.002 18 0 "[ . 1 . 2 . 3]" 1
1247 1 32 ILE MG 1 78 TYR QE . . 4.600 4.162 3.069 4.645 0.045 26 0 "[ . 1 . 2 . 3]" 1
1248 1 48 MET ME 2 4 TYR QD . . 4.830 4.734 4.215 4.855 0.025 26 0 "[ . 1 . 2 . 3]" 1
1249 1 48 MET ME 2 4 TYR QE . . 4.490 4.284 3.488 4.531 0.041 28 0 "[ . 1 . 2 . 3]" 1
1250 1 90 ALA MB 2 75 PHE QD . . 4.750 3.097 2.863 3.768 . 0 0 "[ . 1 . 2 . 3]" 1
1251 1 86 THR MG 2 75 PHE QD . . 4.800 4.391 3.970 4.829 0.029 27 0 "[ . 1 . 2 . 3]" 1
1252 1 75 PHE QD 2 86 THR HB . . 5.490 5.449 5.082 5.553 0.063 14 0 "[ . 1 . 2 . 3]" 1
1253 1 86 THR HB 2 75 PHE QD . . 5.490 5.478 5.284 5.537 0.047 14 0 "[ . 1 . 2 . 3]" 1
1254 1 87 GLY HA2 2 75 PHE QE . . 4.250 3.608 2.362 4.223 . 0 0 "[ . 1 . 2 . 3]" 1
1255 1 87 GLY HA2 2 75 PHE QD . . 4.400 2.613 2.266 2.924 . 0 0 "[ . 1 . 2 . 3]" 1
1256 1 75 PHE QD 2 87 GLY H . . 5.500 5.023 4.222 5.310 . 0 0 "[ . 1 . 2 . 3]" 1
1257 1 87 GLY H 2 75 PHE QD . . 5.500 5.035 4.257 5.284 . 0 0 "[ . 1 . 2 . 3]" 1
1258 1 79 TRP HZ3 2 83 GLY H . . 5.310 2.937 2.620 3.235 . 0 0 "[ . 1 . 2 . 3]" 1
1259 1 79 TRP HE3 2 80 THR HA . . 4.400 3.561 3.051 4.096 . 0 0 "[ . 1 . 2 . 3]" 1
1260 1 19 TYR QE 1 75 PHE QD . . 4.840 4.380 3.797 4.854 0.014 18 0 "[ . 1 . 2 . 3]" 1
1261 1 73 ILE MD 1 78 TYR QE . . 5.500 4.884 3.854 5.528 0.028 11 0 "[ . 1 . 2 . 3]" 1
1262 1 82 ILE MD 2 79 TRP HZ3 . . 5.450 4.600 4.277 4.998 . 0 0 "[ . 1 . 2 . 3]" 1
1263 1 82 ILE HG13 2 79 TRP HZ3 . . 5.500 5.398 4.832 5.536 0.036 15 0 "[ . 1 . 2 . 3]" 1
1264 1 79 TRP HZ3 2 80 THR HA . . 5.500 5.046 4.641 5.341 . 0 0 "[ . 1 . 2 . 3]" 1
1265 1 80 THR HA 2 79 TRP HZ3 . . 5.500 5.057 4.709 5.431 . 0 0 "[ . 1 . 2 . 3]" 1
1266 1 80 THR H 2 79 TRP HZ3 . . 5.500 5.044 4.871 5.260 . 0 0 "[ . 1 . 2 . 3]" 1
1267 1 79 TRP HE3 2 80 THR H . . 4.520 4.446 4.038 4.602 0.082 15 0 "[ . 1 . 2 . 3]" 1
1268 1 91 LYS HB2 1 92 LEU H . . 4.430 3.071 2.538 3.934 . 0 0 "[ . 1 . 2 . 3]" 1
1269 1 41 LEU MD2 1 45 LEU H . . 4.870 4.712 4.007 4.909 0.039 4 0 "[ . 1 . 2 . 3]" 1
1270 1 48 MET H 1 49 LEU MD1 . . 5.500 5.263 4.253 5.556 0.056 10 0 "[ . 1 . 2 . 3]" 1
1271 1 61 LEU MD1 1 84 GLY H . . 4.240 3.390 2.871 3.775 . 0 0 "[ . 1 . 2 . 3]" 1
1272 1 81 LEU MD1 1 84 GLY H . . 5.500 5.028 4.301 5.514 0.014 11 0 "[ . 1 . 2 . 3]" 1
1273 1 11 VAL MG1 1 14 LEU HB2 . . 5.320 4.389 4.071 4.748 . 0 0 "[ . 1 . 2 . 3]" 1
1274 1 92 LEU MD2 1 96 GLN HE21 . . 5.290 4.838 3.392 5.325 0.035 28 0 "[ . 1 . 2 . 3]" 1
1275 1 15 VAL HA 1 18 PHE QD . . 5.000 3.750 3.164 4.790 . 0 0 "[ . 1 . 2 . 3]" 1
1276 1 93 ILE MD 2 15 VAL MG1 . . 3.760 2.903 2.073 3.613 . 0 0 "[ . 1 . 2 . 3]" 1
1277 1 15 VAL MG1 2 93 ILE MD . . 3.760 2.964 2.085 3.772 0.012 27 0 "[ . 1 . 2 . 3]" 1
1278 1 94 HIS HA 1 97 GLU HB2 . . 5.500 2.783 2.185 3.524 . 0 0 "[ . 1 . 2 . 3]" 1
1279 1 7 LEU MD2 2 17 ASN H . . 5.260 4.225 3.714 4.820 . 0 0 "[ . 1 . 2 . 3]" 1
1280 1 79 TRP HA 1 82 ILE HB . . 5.500 5.442 5.201 5.525 0.025 16 0 "[ . 1 . 2 . 3]" 1
1281 1 12 ILE MG 2 97 GLU H . . 4.910 4.720 4.221 4.957 0.047 14 0 "[ . 1 . 2 . 3]" 1
1282 1 97 GLU QG 2 12 ILE MG . . 5.410 3.067 2.038 5.413 0.003 20 0 "[ . 1 . 2 . 3]" 1
1283 1 12 ILE MG 2 97 GLU QG . . 5.410 3.083 1.988 5.327 . 0 0 "[ . 1 . 2 . 3]" 1
1284 1 16 GLU HA 2 94 HIS HD2 . . 5.080 4.081 2.266 5.085 0.005 21 0 "[ . 1 . 2 . 3]" 1
1285 1 94 HIS HD2 1 97 GLU H . . 5.500 5.535 4.968 5.607 0.107 20 0 "[ . 1 . 2 . 3]" 1
1286 1 75 PHE QE 2 91 LYS HA . . 5.410 5.219 4.388 5.459 0.049 27 0 "[ . 1 . 2 . 3]" 1
1287 1 91 LYS HA 2 75 PHE QE . . 5.410 5.249 4.453 5.456 0.046 27 0 "[ . 1 . 2 . 3]" 1
1288 1 75 PHE QE 2 90 ALA MB . . 4.050 2.650 2.264 3.205 . 0 0 "[ . 1 . 2 . 3]" 1
1289 1 90 ALA MB 2 75 PHE QE . . 4.050 2.640 2.214 3.185 . 0 0 "[ . 1 . 2 . 3]" 1
1290 1 34 LYS HA 1 37 PHE H . . 5.500 3.344 2.569 4.302 . 0 0 "[ . 1 . 2 . 3]" 1
1291 1 35 SER HA 1 38 ARG QB . . 3.830 3.527 2.539 3.875 0.045 12 0 "[ . 1 . 2 . 3]" 1
1292 1 36 SER HA 1 39 GLU H . . 5.050 3.079 2.768 3.617 . 0 0 "[ . 1 . 2 . 3]" 1
1293 1 14 LEU HA 1 17 ASN H . . 5.050 3.872 3.356 4.230 . 0 0 "[ . 1 . 2 . 3]" 1
1294 1 15 VAL HA 1 18 PHE H . . 5.050 3.344 2.776 3.888 . 0 0 "[ . 1 . 2 . 3]" 1
1295 1 52 THR MG 1 55 ARG H . . 5.410 4.757 4.330 5.163 . 0 0 "[ . 1 . 2 . 3]" 1
1296 1 86 THR MG 1 87 GLY HA2 . . 3.980 4.027 3.894 4.077 0.097 22 0 "[ . 1 . 2 . 3]" 1
1297 1 75 PHE QD 2 88 PRO HD3 . . 4.800 4.818 4.432 4.879 0.079 27 0 "[ . 1 . 2 . 3]" 1
1298 1 88 PRO HD3 2 75 PHE QD . . 4.800 4.830 4.799 4.882 0.082 27 0 "[ . 1 . 2 . 3]" 1
1299 2 60 LYS H 2 61 LEU H . . 3.510 2.737 2.595 2.900 . 0 0 "[ . 1 . 2 . 3]" 1
1300 2 60 LYS H 2 60 LYS QD . . 4.590 4.429 4.174 4.602 0.012 27 0 "[ . 1 . 2 . 3]" 1
1301 2 59 ASP H 2 60 LYS H . . 4.140 2.659 2.485 2.820 . 0 0 "[ . 1 . 2 . 3]" 1
1302 2 24 LYS QB 2 25 TYR H . . 4.740 2.704 2.154 4.017 . 0 0 "[ . 1 . 2 . 3]" 1
1303 2 25 TYR H 2 26 SER H . . 4.620 4.261 3.429 4.634 0.014 2 0 "[ . 1 . 2 . 3]" 1
1304 2 24 LYS HG3 2 25 TYR H . . 5.500 4.233 1.898 5.294 . 0 0 "[ . 1 . 2 . 3]" 1
1305 2 60 LYS QD 2 61 LEU H . . 4.270 3.167 3.031 3.324 . 0 0 "[ . 1 . 2 . 3]" 1
1306 2 61 LEU H 2 61 LEU HB3 . . 3.910 3.547 3.485 3.629 . 0 0 "[ . 1 . 2 . 3]" 1
1307 2 61 LEU H 2 62 ILE H . . 4.310 2.565 2.374 2.817 . 0 0 "[ . 1 . 2 . 3]" 1
1308 2 61 LEU H 2 61 LEU HB2 . . 3.240 2.338 2.168 2.748 . 0 0 "[ . 1 . 2 . 3]" 1
1309 2 60 LYS QB 2 61 LEU H . . 3.240 2.559 2.314 2.840 . 0 0 "[ . 1 . 2 . 3]" 1
1310 2 93 ILE HA 2 96 GLN H . . 4.670 3.527 3.246 3.799 . 0 0 "[ . 1 . 2 . 3]" 1
1311 2 96 GLN H 2 96 GLN HB3 . . 3.730 3.690 3.574 3.755 0.025 17 0 "[ . 1 . 2 . 3]" 1
1312 2 95 GLU H 2 96 GLN H . . 3.880 2.707 2.044 3.007 . 0 0 "[ . 1 . 2 . 3]" 1
1313 2 96 GLN H 2 96 GLN HG3 . . 3.500 2.373 1.896 2.719 . 0 0 "[ . 1 . 2 . 3]" 1
1314 2 96 GLN H 2 96 GLN HG2 . . 3.810 2.473 2.074 2.855 . 0 0 "[ . 1 . 2 . 3]" 1
1315 2 38 ARG H 2 38 ARG QG . . 4.860 3.776 2.649 4.087 . 0 0 "[ . 1 . 2 . 3]" 1
1316 2 55 ARG HA 2 57 ALA H . . 4.650 4.185 3.776 4.542 . 0 0 "[ . 1 . 2 . 3]" 1
1317 2 56 LYS QB 2 57 ALA H . . 3.680 2.941 2.731 3.126 . 0 0 "[ . 1 . 2 . 3]" 1
1318 2 54 ASN HA 2 57 ALA H . . 5.000 3.211 2.720 3.663 . 0 0 "[ . 1 . 2 . 3]" 1
1319 2 56 LYS H 2 57 ALA H . . 3.900 2.752 2.499 2.992 . 0 0 "[ . 1 . 2 . 3]" 1
1320 2 57 ALA H 2 58 ALA H . . 3.880 2.799 2.622 3.001 . 0 0 "[ . 1 . 2 . 3]" 1
1321 2 54 ASN H 2 55 ARG H . . 3.750 2.702 2.511 2.971 . 0 0 "[ . 1 . 2 . 3]" 1
1322 2 19 TYR H 2 20 LYS H . . 4.780 2.799 2.677 2.979 . 0 0 "[ . 1 . 2 . 3]" 1
1323 2 19 TYR HB2 2 20 LYS H . . 5.500 2.844 2.575 3.544 . 0 0 "[ . 1 . 2 . 3]" 1
1324 2 20 LYS H 2 20 LYS HB2 . . 3.780 2.357 1.989 2.792 . 0 0 "[ . 1 . 2 . 3]" 1
1325 2 20 LYS H 2 20 LYS HG3 . . 5.180 3.681 2.251 4.458 . 0 0 "[ . 1 . 2 . 3]" 1
1326 2 19 TYR HB3 2 20 LYS H . . 4.840 3.414 2.945 4.117 . 0 0 "[ . 1 . 2 . 3]" 1
1327 2 20 LYS H 2 21 TYR H . . 4.330 2.959 2.578 3.124 . 0 0 "[ . 1 . 2 . 3]" 1
1328 2 86 THR HB 2 87 GLY H . . 4.820 4.320 1.834 4.477 . 0 0 "[ . 1 . 2 . 3]" 1
1329 2 86 THR H 2 87 GLY H . . 4.940 3.537 3.329 3.967 . 0 0 "[ . 1 . 2 . 3]" 1
1330 2 40 MET QG 2 41 LEU H . . 4.840 3.724 2.147 4.227 . 0 0 "[ . 1 . 2 . 3]" 1
1331 2 41 LEU H 2 41 LEU HG . . 5.290 2.452 2.143 3.795 . 0 0 "[ . 1 . 2 . 3]" 1
1332 2 40 MET H 2 41 LEU H . . 4.680 2.930 2.682 3.158 . 0 0 "[ . 1 . 2 . 3]" 1
1333 2 12 ILE H 2 12 ILE HB . . 3.860 2.399 2.204 2.714 . 0 0 "[ . 1 . 2 . 3]" 1
1334 2 12 ILE H 2 12 ILE HG13 . . 4.790 2.263 2.025 3.602 . 0 0 "[ . 1 . 2 . 3]" 1
1335 2 36 SER H 2 37 PHE H . . 3.630 2.599 2.199 3.065 . 0 0 "[ . 1 . 2 . 3]" 1
1336 2 18 PHE H 2 19 TYR H . . 5.500 2.889 2.697 3.161 . 0 0 "[ . 1 . 2 . 3]" 1
1337 2 89 ILE H 2 89 ILE HG13 . . 4.410 2.701 1.952 3.279 . 0 0 "[ . 1 . 2 . 3]" 1
1338 2 100 SER QB 2 101 SER H . . 4.040 3.742 2.625 4.047 0.007 10 0 "[ . 1 . 2 . 3]" 1
1339 2 44 GLU H 2 45 LEU H . . 4.770 2.714 2.025 3.005 . 0 0 "[ . 1 . 2 . 3]" 1
1340 2 44 GLU HB2 2 45 LEU H . . 5.500 3.039 2.198 3.521 . 0 0 "[ . 1 . 2 . 3]" 1
1341 2 44 GLU HG2 2 45 LEU H . . 5.500 4.956 4.119 5.584 0.084 9 0 "[ . 1 . 2 . 3]" 1
1342 2 44 GLU HG3 2 45 LEU H . . 5.500 5.118 4.497 5.512 0.012 2 0 "[ . 1 . 2 . 3]" 1
1343 2 43 LYS H 2 44 GLU H . . 5.010 2.721 2.448 3.128 . 0 0 "[ . 1 . 2 . 3]" 1
1344 2 42 GLN H 2 43 LYS H . . 4.750 2.562 2.179 3.037 . 0 0 "[ . 1 . 2 . 3]" 1
1345 2 42 GLN HG3 2 43 LYS H . . 5.440 4.986 4.525 5.469 0.029 4 0 "[ . 1 . 2 . 3]" 1
1346 2 46 ASN H 2 46 ASN HB3 . . 4.120 2.578 2.189 3.791 . 0 0 "[ . 1 . 2 . 3]" 1
1347 2 45 LEU MD2 2 46 ASN H . . 5.300 4.823 3.348 5.345 0.045 24 0 "[ . 1 . 2 . 3]" 1
1348 2 46 ASN H 2 47 HIS H . . 5.030 2.860 2.051 3.623 . 0 0 "[ . 1 . 2 . 3]" 1
1349 2 45 LEU HB2 2 46 ASN H . . 5.010 4.139 2.241 4.617 . 0 0 "[ . 1 . 2 . 3]" 1
1350 2 97 GLU H 2 97 GLU QG . . 4.120 3.228 2.246 4.094 . 0 0 "[ . 1 . 2 . 3]" 1
1351 2 97 GLU H 2 97 GLU HB3 . . 3.610 3.260 2.448 3.636 0.026 27 0 "[ . 1 . 2 . 3]" 1
1352 2 71 GLY H 2 72 ARG H . . 4.500 2.477 2.290 2.829 . 0 0 "[ . 1 . 2 . 3]" 1
1353 2 99 GLN H 2 99 GLN HG2 . . 3.900 3.831 3.594 3.936 0.036 28 0 "[ . 1 . 2 . 3]" 1
1354 2 99 GLN H 2 99 GLN HB3 . . 3.750 3.621 3.545 3.684 . 0 0 "[ . 1 . 2 . 3]" 1
1355 2 63 GLN HB2 2 63 GLN HE22 . . 4.790 4.480 3.552 4.877 0.087 2 0 "[ . 1 . 2 . 3]" 1
1356 2 101 SER H 2 102 SER H . . 3.830 2.950 2.229 3.884 0.054 27 0 "[ . 1 . 2 . 3]" 1
1357 2 55 ARG H 2 55 ARG HD2 . . 5.500 4.222 3.228 5.180 . 0 0 "[ . 1 . 2 . 3]" 1
1358 2 54 ASN HB2 2 55 ARG H . . 5.130 3.697 2.787 4.190 . 0 0 "[ . 1 . 2 . 3]" 1
1359 2 6 GLU H 2 7 LEU H . . 4.800 2.653 2.462 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
1360 2 5 THR HA 2 7 LEU H . . 5.480 4.136 3.890 4.373 . 0 0 "[ . 1 . 2 . 3]" 1
1361 2 7 LEU H 2 7 LEU HG . . 4.620 4.523 4.468 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
1362 2 5 THR HB 2 7 LEU H . . 5.000 2.862 2.561 4.085 . 0 0 "[ . 1 . 2 . 3]" 1
1363 2 7 LEU H 2 7 LEU MD1 . . 4.880 4.124 3.890 4.263 . 0 0 "[ . 1 . 2 . 3]" 1
1364 2 3 CYS QB 2 4 TYR H . . 4.190 3.099 1.841 3.951 . 0 0 "[ . 1 . 2 . 3]" 1
1365 2 4 TYR H 2 4 TYR HB3 . . 4.190 3.672 3.431 4.204 0.014 26 0 "[ . 1 . 2 . 3]" 1
1366 2 84 GLY H 2 85 ILE H . . 4.930 2.737 2.584 2.866 . 0 0 "[ . 1 . 2 . 3]" 1
1367 2 82 ILE HA 2 85 ILE H . . 4.780 2.900 2.506 3.585 . 0 0 "[ . 1 . 2 . 3]" 1
1368 2 85 ILE H 2 85 ILE HG12 . . 5.150 3.593 3.458 3.709 . 0 0 "[ . 1 . 2 . 3]" 1
1369 2 49 LEU H 2 49 LEU HG . . 4.620 3.231 1.965 4.571 . 0 0 "[ . 1 . 2 . 3]" 1
1370 2 49 LEU H 2 49 LEU HB2 . . 3.910 3.256 2.095 3.986 0.076 20 0 "[ . 1 . 2 . 3]" 1
1371 2 82 ILE H 2 82 ILE HG12 . . 5.050 4.420 4.331 4.536 . 0 0 "[ . 1 . 2 . 3]" 1
1372 2 79 TRP HA 2 82 ILE H . . 4.790 3.662 3.529 3.874 . 0 0 "[ . 1 . 2 . 3]" 1
1373 2 14 LEU H 2 15 VAL H . . 4.880 2.796 2.711 2.917 . 0 0 "[ . 1 . 2 . 3]" 1
1374 2 10 ALA HA 2 14 LEU H . . 5.500 4.027 3.887 4.172 . 0 0 "[ . 1 . 2 . 3]" 1
1375 2 14 LEU H 2 14 LEU HB2 . . 4.170 2.133 2.068 2.220 . 0 0 "[ . 1 . 2 . 3]" 1
1376 2 14 LEU H 2 14 LEU HG . . 4.430 4.201 4.080 4.327 . 0 0 "[ . 1 . 2 . 3]" 1
1377 2 8 GLU H 2 8 GLU HG2 . . 5.020 3.745 2.464 4.596 . 0 0 "[ . 1 . 2 . 3]" 1
1378 2 7 LEU HB2 2 8 GLU H . . 4.440 3.718 3.467 3.896 . 0 0 "[ . 1 . 2 . 3]" 1
1379 2 7 LEU H 2 8 GLU H . . 5.040 2.623 2.459 2.865 . 0 0 "[ . 1 . 2 . 3]" 1
1380 2 8 GLU H 2 8 GLU HG3 . . 4.510 2.800 2.151 4.401 . 0 0 "[ . 1 . 2 . 3]" 1
1381 2 98 GLN H 2 98 GLN HB2 . . 3.950 3.557 3.480 3.627 . 0 0 "[ . 1 . 2 . 3]" 1
1382 2 63 GLN H 2 64 ASN H . . 4.790 2.659 2.417 2.887 . 0 0 "[ . 1 . 2 . 3]" 1
1383 2 49 LEU HB2 2 50 SER H . . 5.450 3.233 2.022 4.717 . 0 0 "[ . 1 . 2 . 3]" 1
1384 2 50 SER H 2 51 ASP H . . 5.110 2.811 1.821 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
1385 2 49 LEU HB3 2 50 SER H . . 5.500 3.893 2.486 4.474 . 0 0 "[ . 1 . 2 . 3]" 1
1386 2 99 GLN HA 2 99 GLN HE21 . . 5.410 5.036 4.500 5.380 . 0 0 "[ . 1 . 2 . 3]" 1
1387 2 13 VAL H 2 13 VAL HB . . 4.150 2.350 2.279 2.434 . 0 0 "[ . 1 . 2 . 3]" 1
1388 2 13 VAL H 2 14 LEU H . . 4.250 2.847 2.701 2.946 . 0 0 "[ . 1 . 2 . 3]" 1
1389 2 12 ILE HB 2 13 VAL H . . 4.390 2.843 2.623 2.968 . 0 0 "[ . 1 . 2 . 3]" 1
1390 2 12 ILE HG13 2 13 VAL H . . 4.920 4.615 4.428 4.931 0.011 17 0 "[ . 1 . 2 . 3]" 1
1391 2 16 GLU H 2 18 PHE H . . 5.500 4.184 4.000 4.393 . 0 0 "[ . 1 . 2 . 3]" 1
1392 2 16 GLU H 2 16 GLU HG2 . . 4.540 4.351 3.605 4.524 . 0 0 "[ . 1 . 2 . 3]" 1
1393 2 12 ILE HA 2 16 GLU H . . 5.430 3.953 3.644 4.592 . 0 0 "[ . 1 . 2 . 3]" 1
1394 2 14 LEU H 2 16 GLU H . . 5.500 4.295 4.103 4.503 . 0 0 "[ . 1 . 2 . 3]" 1
1395 2 16 GLU H 2 16 GLU HG3 . . 4.990 4.470 4.069 4.635 . 0 0 "[ . 1 . 2 . 3]" 1
1396 2 12 ILE MG 2 16 GLU H . . 5.370 3.670 3.221 4.003 . 0 0 "[ . 1 . 2 . 3]" 1
1397 2 62 ILE H 2 62 ILE HG12 . . 4.490 3.621 2.211 4.046 . 0 0 "[ . 1 . 2 . 3]" 1
1398 2 61 LEU HB3 2 62 ILE H . . 5.010 3.321 3.109 3.752 . 0 0 "[ . 1 . 2 . 3]" 1
1399 2 62 ILE H 2 62 ILE HG13 . . 4.540 2.442 2.168 3.667 . 0 0 "[ . 1 . 2 . 3]" 1
1400 2 27 LEU MD1 2 28 VAL H . . 4.560 3.966 3.435 4.479 . 0 0 "[ . 1 . 2 . 3]" 1
1401 2 27 LEU MD2 2 28 VAL H . . 4.500 3.181 1.744 4.104 . 0 0 "[ . 1 . 2 . 3]" 1
1402 2 28 VAL H 2 28 VAL MG2 . . 4.390 3.112 1.863 3.978 . 0 0 "[ . 1 . 2 . 3]" 1
1403 2 46 ASN HB3 2 47 HIS H . . 5.330 3.221 2.435 4.335 . 0 0 "[ . 1 . 2 . 3]" 1
1404 2 45 LEU MD2 2 47 HIS H . . 5.500 4.810 2.795 5.520 0.020 6 0 "[ . 1 . 2 . 3]" 1
1405 2 47 HIS H 2 48 MET H . . 4.810 2.672 1.932 4.323 . 0 0 "[ . 1 . 2 . 3]" 1
1406 2 45 LEU HB2 2 47 HIS H . . 5.500 5.213 3.952 5.566 0.066 3 0 "[ . 1 . 2 . 3]" 1
1407 2 27 LEU H 2 27 LEU HB2 . . 4.140 2.639 2.131 3.589 . 0 0 "[ . 1 . 2 . 3]" 1
1408 2 73 ILE MD 2 74 SER H . . 5.150 4.392 3.804 5.095 . 0 0 "[ . 1 . 2 . 3]" 1
1409 2 73 ILE H 2 74 SER H . . 5.220 4.213 3.846 4.482 . 0 0 "[ . 1 . 2 . 3]" 1
1410 2 73 ILE HB 2 74 SER H . . 5.500 4.112 3.464 4.424 . 0 0 "[ . 1 . 2 . 3]" 1
1411 2 50 SER HB3 2 51 ASP H . . 5.350 4.025 2.613 4.539 . 0 0 "[ . 1 . 2 . 3]" 1
1412 2 91 LYS HG3 2 92 LEU H . . 5.500 4.837 1.989 5.364 . 0 0 "[ . 1 . 2 . 3]" 1
1413 2 92 LEU H 2 93 ILE H . . 4.490 2.731 2.433 2.945 . 0 0 "[ . 1 . 2 . 3]" 1
1414 2 92 LEU H 2 92 LEU HB2 . . 3.630 2.204 1.983 2.389 . 0 0 "[ . 1 . 2 . 3]" 1
1415 2 90 ALA HA 2 92 LEU H . . 5.440 4.378 3.749 4.871 . 0 0 "[ . 1 . 2 . 3]" 1
1416 2 67 ALA H 2 68 ASN H . . 4.630 2.482 2.114 3.247 . 0 0 "[ . 1 . 2 . 3]" 1
1417 2 93 ILE H 2 93 ILE HG12 . . 4.810 3.548 3.312 3.771 . 0 0 "[ . 1 . 2 . 3]" 1
1418 2 91 LYS HA 2 93 ILE H . . 5.500 4.731 4.540 4.926 . 0 0 "[ . 1 . 2 . 3]" 1
1419 2 91 LYS H 2 93 ILE H . . 5.100 4.277 4.043 4.482 . 0 0 "[ . 1 . 2 . 3]" 1
1420 2 68 ASN HB3 2 69 HIS H . . 5.500 4.372 3.949 4.674 . 0 0 "[ . 1 . 2 . 3]" 1
1421 2 68 ASN HB2 2 69 HIS H . . 5.320 3.762 2.911 4.602 . 0 0 "[ . 1 . 2 . 3]" 1
1422 2 69 HIS H 2 70 ASP H . . 4.450 3.362 2.661 3.951 . 0 0 "[ . 1 . 2 . 3]" 1
1423 2 70 ASP H 2 71 GLY H . . 4.410 2.389 2.215 2.534 . 0 0 "[ . 1 . 2 . 3]" 1
1424 2 69 HIS HB3 2 70 ASP H . . 5.130 4.398 4.030 4.682 . 0 0 "[ . 1 . 2 . 3]" 1
1425 2 70 ASP H 2 71 GLY HA2 . . 4.720 4.687 4.492 4.781 0.061 18 0 "[ . 1 . 2 . 3]" 1
1426 2 9 LYS HB2 2 10 ALA H . . 4.490 2.939 2.443 3.265 . 0 0 "[ . 1 . 2 . 3]" 1
1427 2 10 ALA H 2 11 VAL H . . 3.830 2.920 2.722 3.142 . 0 0 "[ . 1 . 2 . 3]" 1
1428 2 9 LYS H 2 10 ALA H . . 4.410 3.117 2.923 3.275 . 0 0 "[ . 1 . 2 . 3]" 1
1429 2 7 LEU MD2 2 10 ALA H . . 4.530 4.390 4.160 4.545 0.015 5 0 "[ . 1 . 2 . 3]" 1
1430 2 84 GLY H 2 86 THR H . . 5.330 4.301 4.080 4.695 . 0 0 "[ . 1 . 2 . 3]" 1
1431 2 2 ASP QB 2 3 CYS H . . 4.140 3.044 1.932 3.946 . 0 0 "[ . 1 . 2 . 3]" 1
1432 2 3 CYS H 2 3 CYS QB . . 3.740 2.857 2.217 3.557 . 0 0 "[ . 1 . 2 . 3]" 1
1433 2 9 LYS H 2 9 LYS HD3 . . 4.330 4.340 3.515 4.435 0.105 29 0 "[ . 1 . 2 . 3]" 1
1434 2 8 GLU HB2 2 9 LYS H . . 5.000 2.677 2.273 3.907 . 0 0 "[ . 1 . 2 . 3]" 1
1435 2 8 GLU H 2 9 LYS H . . 4.720 3.076 2.811 3.282 . 0 0 "[ . 1 . 2 . 3]" 1
1436 2 9 LYS H 2 9 LYS HD2 . . 4.410 3.759 3.321 4.487 0.077 20 0 "[ . 1 . 2 . 3]" 1
1437 2 6 GLU HA 2 9 LYS H . . 5.160 3.307 2.987 3.717 . 0 0 "[ . 1 . 2 . 3]" 1
1438 2 75 PHE H 2 76 ASP H . . 5.050 2.901 2.454 3.303 . 0 0 "[ . 1 . 2 . 3]" 1
1439 2 76 ASP H 2 77 GLU H . . 4.840 2.638 2.411 3.125 . 0 0 "[ . 1 . 2 . 3]" 1
1440 2 85 ILE MD 2 86 THR H . . 4.880 4.564 4.308 4.825 . 0 0 "[ . 1 . 2 . 3]" 1
1441 2 92 LEU MD1 2 96 GLN HE22 . . 4.940 3.679 3.100 4.274 . 0 0 "[ . 1 . 2 . 3]" 1
1442 2 96 GLN HB2 2 96 GLN HE22 . . 5.010 4.630 3.965 5.077 0.067 10 0 "[ . 1 . 2 . 3]" 1
1443 2 96 GLN HA 2 96 GLN HE22 . . 5.300 5.162 4.706 5.375 0.075 23 0 "[ . 1 . 2 . 3]" 1
1444 2 32 ILE H 2 32 ILE HG13 . . 5.500 3.453 1.915 4.747 . 0 0 "[ . 1 . 2 . 3]" 1
1445 2 32 ILE H 2 32 ILE MD . . 5.500 3.556 1.760 4.929 . 0 0 "[ . 1 . 2 . 3]" 1
1446 2 62 ILE HB 2 63 GLN H . . 3.990 2.958 2.611 3.285 . 0 0 "[ . 1 . 2 . 3]" 1
1447 2 63 GLN H 2 63 GLN HG3 . . 4.390 4.234 2.756 4.441 0.051 4 0 "[ . 1 . 2 . 3]" 1
1448 2 56 LYS H 2 58 ALA H . . 4.480 4.436 4.158 4.512 0.032 4 0 "[ . 1 . 2 . 3]" 1
1449 2 17 ASN H 2 20 LYS H . . 5.500 4.847 4.582 5.231 . 0 0 "[ . 1 . 2 . 3]" 1
1450 2 17 ASN H 2 18 PHE H . . 5.500 2.856 2.544 3.111 . 0 0 "[ . 1 . 2 . 3]" 1
1451 2 14 LEU MD1 2 17 ASN H . . 5.080 5.042 4.617 5.145 0.065 17 0 "[ . 1 . 2 . 3]" 1
1452 2 16 GLU HB3 2 17 ASN H . . 5.500 2.358 2.128 2.642 . 0 0 "[ . 1 . 2 . 3]" 1
1453 2 16 GLU HG3 2 17 ASN H . . 5.500 4.605 4.242 5.080 . 0 0 "[ . 1 . 2 . 3]" 1
1454 2 13 VAL HA 2 17 ASN H . . 5.500 4.187 3.608 4.659 . 0 0 "[ . 1 . 2 . 3]" 1
1455 2 95 GLU H 2 95 GLU HG3 . . 4.440 4.100 3.663 4.439 . 0 0 "[ . 1 . 2 . 3]" 1
1456 2 29 LYS H 2 29 LYS HB3 . . 4.030 3.651 2.891 4.046 0.016 30 0 "[ . 1 . 2 . 3]" 1
1457 2 28 VAL H 2 29 LYS H . . 4.520 3.648 2.091 4.549 0.029 22 0 "[ . 1 . 2 . 3]" 1
1458 2 28 VAL MG2 2 29 LYS H . . 4.270 3.864 2.228 4.280 0.010 13 0 "[ . 1 . 2 . 3]" 1
1459 2 77 GLU H 2 77 GLU HG2 . . 4.460 4.153 3.310 4.544 0.084 25 0 "[ . 1 . 2 . 3]" 1
1460 2 75 PHE HA 2 77 GLU H . . 5.500 4.702 4.034 5.312 . 0 0 "[ . 1 . 2 . 3]" 1
1461 2 73 ILE MG 2 77 GLU H . . 5.300 4.136 3.712 5.308 0.008 12 0 "[ . 1 . 2 . 3]" 1
1462 2 55 ARG HB3 2 58 ALA H . . 5.500 5.266 4.689 5.524 0.024 22 0 "[ . 1 . 2 . 3]" 1
1463 2 58 ALA H 2 85 ILE MG . . 4.900 4.247 3.799 4.538 . 0 0 "[ . 1 . 2 . 3]" 1
1464 2 39 GLU HB3 2 40 MET H . . 5.500 2.673 2.245 3.920 . 0 0 "[ . 1 . 2 . 3]" 1
1465 2 39 GLU H 2 40 MET H . . 5.330 2.673 2.090 3.231 . 0 0 "[ . 1 . 2 . 3]" 1
1466 2 4 TYR HB3 2 5 THR H . . 5.330 2.558 1.808 3.390 . 0 0 "[ . 1 . 2 . 3]" 1
1467 2 90 ALA H 2 91 LYS H . . 5.100 2.819 2.649 3.011 . 0 0 "[ . 1 . 2 . 3]" 1
1468 2 91 LYS H 2 92 LEU H . . 4.750 2.912 2.632 3.038 . 0 0 "[ . 1 . 2 . 3]" 1
1469 2 81 LEU H 2 81 LEU HG . . 5.010 4.445 4.008 4.659 . 0 0 "[ . 1 . 2 . 3]" 1
1470 2 81 LEU H 2 81 LEU MD2 . . 5.500 3.736 2.522 4.241 . 0 0 "[ . 1 . 2 . 3]" 1
1471 2 31 LYS H 2 32 ILE H . . 4.280 3.775 2.552 4.355 0.075 12 0 "[ . 1 . 2 . 3]" 1
1472 2 79 TRP H 2 80 THR H . . 5.360 2.857 2.702 3.009 . 0 0 "[ . 1 . 2 . 3]" 1
1473 2 47 HIS HB2 2 48 MET H . . 4.300 2.934 1.891 3.816 . 0 0 "[ . 1 . 2 . 3]" 1
1474 2 48 MET H 2 49 LEU H . . 4.300 2.890 2.366 3.491 . 0 0 "[ . 1 . 2 . 3]" 1
1475 2 65 LEU H 2 66 ASP H . . 5.500 2.894 2.165 3.643 . 0 0 "[ . 1 . 2 . 3]" 1
1476 2 29 LYS H 2 30 ASN H . . 3.250 2.909 2.351 3.309 0.059 23 0 "[ . 1 . 2 . 3]" 1
1477 2 100 SER H 2 101 SER H . . 2.790 2.720 1.995 2.921 0.131 16 0 "[ . 1 . 2 . 3]" 1
1478 2 99 GLN HB3 2 100 SER H . . 4.060 4.011 3.701 4.139 0.079 4 0 "[ . 1 . 2 . 3]" 1
1479 2 98 GLN HA 2 100 SER H . . 4.140 3.996 3.753 4.193 0.053 28 0 "[ . 1 . 2 . 3]" 1
1480 2 99 GLN H 2 100 SER H . . 3.530 2.226 2.080 2.346 . 0 0 "[ . 1 . 2 . 3]" 1
1481 2 41 LEU H 2 42 GLN H . . 4.550 2.791 2.588 2.984 . 0 0 "[ . 1 . 2 . 3]" 1
1482 2 41 LEU HB3 2 42 GLN H . . 4.520 3.917 3.125 4.353 . 0 0 "[ . 1 . 2 . 3]" 1
1483 2 41 LEU HG 2 42 GLN H . . 5.320 4.741 4.562 5.473 0.153 14 0 "[ . 1 . 2 . 3]" 1
1484 2 20 LYS HB2 2 21 TYR H . . 4.960 3.167 2.171 4.050 . 0 0 "[ . 1 . 2 . 3]" 1
1485 2 55 ARG HB3 2 55 ARG HE . . 5.490 3.948 1.823 5.295 . 0 0 "[ . 1 . 2 . 3]" 1
1486 2 55 ARG HB2 2 55 ARG HE . . 5.470 4.481 3.394 5.375 . 0 0 "[ . 1 . 2 . 3]" 1
1487 2 93 ILE HA 2 96 GLN HE21 . . 5.200 5.193 4.472 5.300 0.100 21 0 "[ . 1 . 2 . 3]" 1
1488 2 92 LEU MD1 2 96 GLN HE21 . . 4.820 3.463 2.320 4.772 . 0 0 "[ . 1 . 2 . 3]" 1
1489 2 98 GLN HA 2 98 GLN HE21 . . 4.760 3.570 3.410 4.251 . 0 0 "[ . 1 . 2 . 3]" 1
1490 2 54 ASN HD21 2 85 ILE MG . . 4.750 3.916 2.705 4.761 0.011 13 0 "[ . 1 . 2 . 3]" 1
1491 2 54 ASN HD21 2 57 ALA MB . . 5.500 3.851 2.201 5.289 . 0 0 "[ . 1 . 2 . 3]" 1
1492 2 56 LYS QG 2 57 ALA H . . 4.650 4.660 4.541 4.703 0.053 21 0 "[ . 1 . 2 . 3]" 1
1493 2 54 ASN HD22 2 85 ILE MG . . 4.920 3.867 2.224 4.932 0.012 12 0 "[ . 1 . 2 . 3]" 1
1494 2 47 HIS HB3 2 48 MET H . . 5.460 3.744 2.053 4.539 . 0 0 "[ . 1 . 2 . 3]" 1
1495 2 79 TRP H 2 82 ILE H . . 5.500 5.329 5.020 5.500 . 18 0 "[ . 1 . 2 . 3]" 1
1496 2 41 LEU MD2 2 44 GLU H . . 5.500 5.061 4.661 5.522 0.022 18 0 "[ . 1 . 2 . 3]" 1
1497 2 31 LYS H 2 31 LYS HG2 . . 4.570 3.345 2.221 4.580 0.010 12 0 "[ . 1 . 2 . 3]" 1
1498 2 42 GLN HE21 2 49 LEU MD2 . . 5.380 3.719 2.181 5.411 0.031 6 0 "[ . 1 . 2 . 3]" 1
1499 2 42 GLN HE22 2 49 LEU MD2 . . 4.860 3.789 1.714 4.867 0.007 3 0 "[ . 1 . 2 . 3]" 1
1500 2 53 GLY QA 2 56 LYS H . . 4.390 3.465 3.008 3.827 . 0 0 "[ . 1 . 2 . 3]" 1
1501 2 74 SER H 2 75 PHE H . . 5.500 4.561 4.295 4.700 . 0 0 "[ . 1 . 2 . 3]" 1
1502 2 78 TYR HB2 2 79 TRP H . . 4.940 3.700 3.382 3.991 . 0 0 "[ . 1 . 2 . 3]" 1
1503 2 85 ILE H 2 86 THR H . . 4.000 2.271 2.140 2.442 . 0 0 "[ . 1 . 2 . 3]" 1
1504 2 89 ILE MD 2 90 ALA H . . 4.710 3.826 2.525 4.648 . 0 0 "[ . 1 . 2 . 3]" 1
1505 2 20 LYS HB3 2 21 TYR H . . 4.880 2.885 2.050 3.826 . 0 0 "[ . 1 . 2 . 3]" 1
1506 2 101 SER QB 2 102 SER H . . 4.040 3.561 2.519 3.972 . 0 0 "[ . 1 . 2 . 3]" 1
1507 2 63 GLN H 2 63 GLN HB3 . . 3.850 3.037 2.360 3.621 . 0 0 "[ . 1 . 2 . 3]" 1
1508 2 63 GLN HB3 2 63 GLN HE22 . . 4.390 3.751 3.480 4.417 0.027 9 0 "[ . 1 . 2 . 3]" 1
1509 2 58 ALA H 2 85 ILE MD . . 5.370 4.396 4.041 4.657 . 0 0 "[ . 1 . 2 . 3]" 1
1510 2 92 LEU MD1 2 96 GLN H . . 5.500 3.726 3.278 4.143 . 0 0 "[ . 1 . 2 . 3]" 1
1511 2 96 GLN HA 2 99 GLN H . . 3.910 3.667 3.153 3.997 0.087 1 0 "[ . 1 . 2 . 3]" 1
1512 2 56 LYS H 2 56 LYS QG . . 3.910 3.527 3.290 3.813 . 0 0 "[ . 1 . 2 . 3]" 1
1513 2 62 ILE HA 2 62 ILE MG . . 3.670 2.540 2.286 2.646 . 0 0 "[ . 1 . 2 . 3]" 1
1514 2 62 ILE H 2 62 ILE MG . . 3.770 3.764 3.702 3.794 0.024 13 0 "[ . 1 . 2 . 3]" 1
1515 2 72 ARG HB3 2 72 ARG HD3 . . 3.700 3.573 3.488 3.739 0.039 15 0 "[ . 1 . 2 . 3]" 1
1516 2 72 ARG HD3 2 72 ARG QG . . 2.780 2.485 2.366 2.554 . 0 0 "[ . 1 . 2 . 3]" 1
1517 2 72 ARG HB2 2 72 ARG HD3 . . 3.220 2.411 2.238 3.173 . 0 0 "[ . 1 . 2 . 3]" 1
1518 2 72 ARG H 2 72 ARG HD3 . . 4.970 2.859 2.258 5.099 0.129 30 0 "[ . 1 . 2 . 3]" 1
1519 2 99 GLN HE22 2 99 GLN HG3 . . 3.980 3.616 3.491 4.045 0.065 8 0 "[ . 1 . 2 . 3]" 1
1520 2 99 GLN H 2 99 GLN HG3 . . 3.760 2.575 2.426 2.676 . 0 0 "[ . 1 . 2 . 3]" 1
1521 2 99 GLN HG3 2 100 SER H . . 4.460 4.481 4.390 4.519 0.059 6 0 "[ . 1 . 2 . 3]" 1
1522 2 7 LEU HB2 2 7 LEU MD2 . . 3.400 2.508 2.386 2.619 . 0 0 "[ . 1 . 2 . 3]" 1
1523 2 7 LEU HB3 2 7 LEU MD2 . . 3.470 3.221 3.177 3.256 . 0 0 "[ . 1 . 2 . 3]" 1
1524 2 7 LEU HA 2 7 LEU MD2 . . 3.410 2.133 2.038 2.229 . 0 0 "[ . 1 . 2 . 3]" 1
1525 2 7 LEU H 2 7 LEU MD2 . . 4.500 4.136 3.971 4.262 . 0 0 "[ . 1 . 2 . 3]" 1
1526 2 7 LEU MD2 2 8 GLU H . . 4.080 4.149 4.123 4.190 0.110 17 0 "[ . 1 . 2 . 3]" 1
1527 2 95 GLU HA 2 98 GLN HG3 . . 3.860 3.528 2.388 3.910 0.050 14 0 "[ . 1 . 2 . 3]" 1
1528 2 95 GLU HA 2 98 GLN HG2 . . 3.300 2.720 2.186 3.125 . 0 0 "[ . 1 . 2 . 3]" 1
1529 2 95 GLU HA 2 95 GLU HG3 . . 3.420 2.270 2.137 2.719 . 0 0 "[ . 1 . 2 . 3]" 1
1530 2 95 GLU HA 2 98 GLN H . . 4.530 3.804 3.469 4.404 . 0 0 "[ . 1 . 2 . 3]" 1
1531 2 95 GLU HA 2 98 GLN HB3 . . 4.060 3.918 3.434 4.104 0.044 2 0 "[ . 1 . 2 . 3]" 1
1532 2 4 TYR HB2 2 9 LYS HD2 . . 4.400 3.442 2.604 4.424 0.024 13 0 "[ . 1 . 2 . 3]" 1
1533 2 92 LEU H 2 92 LEU HG . . 4.170 4.256 4.178 4.286 0.116 26 0 "[ . 1 . 2 . 3]" 1
1534 2 92 LEU HA 2 92 LEU HG . . 3.810 3.718 3.641 3.752 . 0 0 "[ . 1 . 2 . 3]" 1
1535 2 15 VAL H 2 15 VAL MG2 . . 3.900 3.094 2.413 3.904 0.004 15 0 "[ . 1 . 2 . 3]" 1
1536 2 15 VAL MG2 2 16 GLU H . . 4.690 4.106 3.811 4.278 . 0 0 "[ . 1 . 2 . 3]" 1
1537 2 60 LYS HA 2 60 LYS QD . . 4.080 3.694 3.366 3.949 . 0 0 "[ . 1 . 2 . 3]" 1
1538 2 60 LYS QB 2 60 LYS QD . . 2.480 2.443 2.222 2.522 0.042 19 0 "[ . 1 . 2 . 3]" 1
1539 2 49 LEU MD1 2 51 ASP H . . 4.350 3.338 1.793 4.389 0.039 17 0 "[ . 1 . 2 . 3]" 1
1540 2 49 LEU HB2 2 49 LEU MD1 . . 3.110 2.343 2.115 3.182 0.072 13 0 "[ . 1 . 2 . 3]" 1
1541 2 49 LEU MD1 2 50 SER H . . 4.190 3.396 2.404 4.255 0.065 17 0 "[ . 1 . 2 . 3]" 1
1542 2 49 LEU MD1 2 54 ASN HB3 . . 4.190 3.316 2.231 4.218 0.028 19 0 "[ . 1 . 2 . 3]" 1
1543 2 49 LEU HA 2 49 LEU MD1 . . 3.670 3.034 1.962 3.718 0.048 22 0 "[ . 1 . 2 . 3]" 1
1544 2 49 LEU MD1 2 54 ASN HB2 . . 4.190 3.894 2.725 4.222 0.032 28 0 "[ . 1 . 2 . 3]" 1
1545 2 49 LEU H 2 49 LEU MD1 . . 3.810 3.543 2.587 3.862 0.052 9 0 "[ . 1 . 2 . 3]" 1
1546 2 24 LYS HA 2 24 LYS HD2 . . 4.200 2.724 2.222 4.240 0.040 4 0 "[ . 1 . 2 . 3]" 1
1547 2 12 ILE H 2 12 ILE MD . . 4.160 3.488 2.854 3.754 . 0 0 "[ . 1 . 2 . 3]" 1
1548 2 51 ASP H 2 51 ASP QB . . 3.750 2.810 2.106 3.316 . 0 0 "[ . 1 . 2 . 3]" 1
1549 2 51 ASP QB 2 52 THR H . . 4.060 2.841 1.837 3.457 . 0 0 "[ . 1 . 2 . 3]" 1
1550 2 93 ILE HA 2 93 ILE HG13 . . 4.160 2.860 2.549 3.052 . 0 0 "[ . 1 . 2 . 3]" 1
1551 2 93 ILE HA 2 96 GLN HB2 . . 4.240 3.116 2.680 3.437 . 0 0 "[ . 1 . 2 . 3]" 1
1552 2 93 ILE HA 2 96 GLN HB3 . . 4.640 4.484 4.149 4.659 0.019 26 0 "[ . 1 . 2 . 3]" 1
1553 2 93 ILE HA 2 93 ILE HG12 . . 4.100 2.560 2.453 2.611 . 0 0 "[ . 1 . 2 . 3]" 1
1554 2 27 LEU H 2 27 LEU MD1 . . 4.570 3.775 3.457 4.461 . 0 0 "[ . 1 . 2 . 3]" 1
1555 2 27 LEU HB3 2 27 LEU MD1 . . 2.620 2.384 2.340 2.499 . 0 0 "[ . 1 . 2 . 3]" 1
1556 2 93 ILE HB 2 94 HIS H . . 4.800 2.395 2.231 2.514 . 0 0 "[ . 1 . 2 . 3]" 1
1557 2 48 MET QB 2 48 MET ME . . 3.310 2.581 2.063 3.188 . 0 0 "[ . 1 . 2 . 3]" 1
1558 2 48 MET ME 2 48 MET QG . . 3.220 2.148 2.040 2.311 . 0 0 "[ . 1 . 2 . 3]" 1
1559 2 48 MET HA 2 48 MET ME . . 3.940 3.893 3.322 4.000 0.060 12 0 "[ . 1 . 2 . 3]" 1
1560 2 48 MET ME 2 93 ILE MD . . 2.760 2.481 2.173 2.765 0.005 6 0 "[ . 1 . 2 . 3]" 1
1561 2 85 ILE MG 2 86 THR H . . 3.930 3.556 3.191 3.843 . 0 0 "[ . 1 . 2 . 3]" 1
1562 2 85 ILE HA 2 85 ILE MG . . 3.470 2.460 2.370 2.559 . 0 0 "[ . 1 . 2 . 3]" 1
1563 2 29 LYS H 2 29 LYS HG3 . . 4.140 3.424 2.371 4.255 0.115 22 0 "[ . 1 . 2 . 3]" 1
1564 2 29 LYS HA 2 29 LYS HG3 . . 3.900 3.648 3.275 3.898 . 0 0 "[ . 1 . 2 . 3]" 1
1565 2 3 CYS HB3 2 4 TYR H . . 4.430 3.715 2.158 4.501 0.071 3 0 "[ . 1 . 2 . 3]" 1
1566 2 65 LEU H 2 65 LEU MD1 . . 4.290 4.198 3.910 4.302 0.012 19 0 "[ . 1 . 2 . 3]" 1
1567 2 65 LEU HA 2 65 LEU MD1 . . 3.590 2.407 2.019 3.666 0.076 12 0 "[ . 1 . 2 . 3]" 1
1568 2 65 LEU HB3 2 65 LEU MD1 . . 3.140 2.417 2.313 2.678 . 0 0 "[ . 1 . 2 . 3]" 1
1569 2 64 ASN HB2 2 65 LEU H . . 4.350 3.888 2.990 4.043 . 0 0 "[ . 1 . 2 . 3]" 1
1570 2 64 ASN H 2 64 ASN HB2 . . 3.760 2.422 2.091 2.984 . 0 0 "[ . 1 . 2 . 3]" 1
1571 2 76 ASP H 2 76 ASP HB2 . . 3.710 3.161 1.961 3.607 . 0 0 "[ . 1 . 2 . 3]" 1
1572 2 76 ASP HB2 2 77 GLU H . . 4.520 3.664 2.766 4.249 . 0 0 "[ . 1 . 2 . 3]" 1
1573 2 80 THR H 2 80 THR HB . . 4.150 2.474 2.277 3.635 . 0 0 "[ . 1 . 2 . 3]" 1
1574 2 77 GLU HA 2 80 THR HB . . 4.650 4.433 4.070 4.687 0.037 9 0 "[ . 1 . 2 . 3]" 1
1575 2 82 ILE MG 2 83 GLY H . . 4.340 2.947 2.540 3.135 . 0 0 "[ . 1 . 2 . 3]" 1
1576 2 82 ILE HA 2 82 ILE MG . . 3.690 3.289 3.265 3.310 . 0 0 "[ . 1 . 2 . 3]" 1
1577 2 82 ILE HG12 2 82 ILE MG . . 3.170 2.241 2.185 2.333 . 0 0 "[ . 1 . 2 . 3]" 1
1578 2 82 ILE H 2 82 ILE MG . . 4.510 1.882 1.774 2.017 . 0 0 "[ . 1 . 2 . 3]" 1
1579 2 48 MET QB 2 89 ILE MD . . 4.280 4.076 3.787 4.314 0.034 15 0 "[ . 1 . 2 . 3]" 1
1580 2 43 LYS HA 2 43 LYS HG3 . . 3.940 2.707 2.135 3.957 0.017 10 0 "[ . 1 . 2 . 3]" 1
1581 2 49 LEU MD2 2 55 ARG HA . . 5.500 4.112 3.150 5.465 . 0 0 "[ . 1 . 2 . 3]" 1
1582 2 55 ARG HA 2 58 ALA H . . 4.100 3.386 3.051 3.757 . 0 0 "[ . 1 . 2 . 3]" 1
1583 2 59 ASP HA 2 62 ILE H . . 3.760 3.601 3.179 3.781 0.021 26 0 "[ . 1 . 2 . 3]" 1
1584 2 59 ASP HA 2 62 ILE MD . . 3.740 3.002 2.329 3.748 0.008 16 0 "[ . 1 . 2 . 3]" 1
1585 2 58 ALA MB 2 59 ASP HA . . 4.140 4.037 3.860 4.152 0.012 21 0 "[ . 1 . 2 . 3]" 1
1586 2 59 ASP HA 2 62 ILE HB . . 3.830 2.550 2.132 3.491 . 0 0 "[ . 1 . 2 . 3]" 1
1587 2 59 ASP HA 2 61 LEU H . . 4.680 4.268 3.697 4.503 . 0 0 "[ . 1 . 2 . 3]" 1
1588 2 98 GLN HG3 2 99 GLN HG3 . . 3.590 2.125 2.042 2.296 . 0 0 "[ . 1 . 2 . 3]" 1
1589 2 98 GLN HA 2 98 GLN HG3 . . 3.850 3.644 3.622 3.670 . 0 0 "[ . 1 . 2 . 3]" 1
1590 2 98 GLN H 2 98 GLN HG3 . . 3.490 3.155 2.519 3.426 . 0 0 "[ . 1 . 2 . 3]" 1
1591 2 10 ALA MB 2 13 VAL HB . . 3.870 3.775 3.665 3.879 0.009 7 0 "[ . 1 . 2 . 3]" 1
1592 2 10 ALA MB 2 13 VAL H . . 4.260 4.334 4.295 4.363 0.103 16 0 "[ . 1 . 2 . 3]" 1
1593 2 10 ALA MB 2 14 LEU MD2 . . 3.630 3.657 3.636 3.686 0.056 4 0 "[ . 1 . 2 . 3]" 1
1594 2 10 ALA H 2 10 ALA MB . . 3.400 2.194 2.139 2.249 . 0 0 "[ . 1 . 2 . 3]" 1
1595 2 10 ALA MB 2 13 VAL MG2 . . 3.900 3.915 3.902 3.934 0.034 16 0 "[ . 1 . 2 . 3]" 1
1596 2 7 LEU HA 2 10 ALA MB . . 3.710 2.518 2.203 2.867 . 0 0 "[ . 1 . 2 . 3]" 1
1597 2 10 ALA MB 2 14 LEU H . . 4.830 4.650 4.492 4.789 . 0 0 "[ . 1 . 2 . 3]" 1
1598 2 39 GLU H 2 39 GLU HG3 . . 4.870 4.504 4.126 4.800 . 0 0 "[ . 1 . 2 . 3]" 1
1599 2 39 GLU HG3 2 40 MET H . . 4.520 4.454 3.658 4.668 0.148 12 0 "[ . 1 . 2 . 3]" 1
1600 2 39 GLU HG3 2 43 LYS QE . . 4.300 4.073 3.242 4.327 0.027 13 0 "[ . 1 . 2 . 3]" 1
1601 2 39 GLU HA 2 39 GLU HG3 . . 3.600 2.851 2.109 3.684 0.084 9 0 "[ . 1 . 2 . 3]" 1
1602 2 13 VAL HB 2 14 LEU H . . 4.430 2.700 2.616 2.855 . 0 0 "[ . 1 . 2 . 3]" 1
1603 2 9 LYS HA 2 9 LYS HD3 . . 4.300 3.704 3.441 4.315 0.015 20 0 "[ . 1 . 2 . 3]" 1
1604 2 9 LYS HD3 2 9 LYS QG . . 2.480 2.145 2.111 2.292 . 0 0 "[ . 1 . 2 . 3]" 1
1605 2 43 LYS H 2 43 LYS HG3 . . 3.870 3.123 2.604 3.940 0.070 27 0 "[ . 1 . 2 . 3]" 1
1606 2 43 LYS QE 2 43 LYS HG3 . . 3.570 2.905 1.989 3.538 . 0 0 "[ . 1 . 2 . 3]" 1
1607 2 43 LYS HG3 2 44 GLU H . . 4.940 4.640 4.390 4.982 0.042 11 0 "[ . 1 . 2 . 3]" 1
1608 2 20 LYS HB3 2 20 LYS QD . . 3.090 2.560 2.069 3.147 0.057 26 0 "[ . 1 . 2 . 3]" 1
1609 2 20 LYS H 2 20 LYS HB3 . . 3.730 3.077 2.177 3.671 . 0 0 "[ . 1 . 2 . 3]" 1
1610 2 27 LEU HA 2 27 LEU HG . . 3.570 3.004 2.402 3.296 . 0 0 "[ . 1 . 2 . 3]" 1
1611 2 62 ILE HA 2 62 ILE HG12 . . 3.690 2.588 2.345 3.694 0.004 16 0 "[ . 1 . 2 . 3]" 1
1612 2 62 ILE HA 2 62 ILE MD . . 3.630 3.619 2.493 3.743 0.113 25 0 "[ . 1 . 2 . 3]" 1
1613 2 62 ILE HA 2 65 LEU HB3 . . 4.490 4.452 4.050 4.540 0.050 18 0 "[ . 1 . 2 . 3]" 1
1614 2 7 LEU HB2 2 7 LEU MD1 . . 3.360 3.237 3.192 3.273 . 0 0 "[ . 1 . 2 . 3]" 1
1615 2 7 LEU HB3 2 7 LEU MD1 . . 3.160 2.319 2.228 2.380 . 0 0 "[ . 1 . 2 . 3]" 1
1616 2 7 LEU MD1 2 8 GLU H . . 4.320 2.901 2.664 3.081 . 0 0 "[ . 1 . 2 . 3]" 1
1617 2 99 GLN HA 2 99 GLN HG3 . . 3.260 3.016 2.747 3.227 . 0 0 "[ . 1 . 2 . 3]" 1
1618 2 99 GLN HA 2 100 SER H . . 3.410 3.396 3.267 3.456 0.046 2 0 "[ . 1 . 2 . 3]" 1
1619 2 99 GLN HA 2 99 GLN HB2 . . 3.020 3.037 3.029 3.043 0.023 8 0 "[ . 1 . 2 . 3]" 1
1620 2 5 THR HB 2 6 GLU H . . 4.050 2.556 2.362 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
1621 2 20 LYS HB3 2 20 LYS QE . . 3.670 3.032 2.014 3.760 0.090 13 0 "[ . 1 . 2 . 3]" 1
1622 2 20 LYS QE 2 20 LYS HG2 . . 3.190 2.755 2.010 3.297 0.107 24 0 "[ . 1 . 2 . 3]" 1
1623 2 20 LYS QE 2 20 LYS HG3 . . 3.650 2.640 1.991 3.346 . 0 0 "[ . 1 . 2 . 3]" 1
1624 2 6 GLU H 2 6 GLU QB . . 3.720 2.490 2.238 2.684 . 0 0 "[ . 1 . 2 . 3]" 1
1625 2 6 GLU QB 2 7 LEU H . . 4.290 3.775 3.578 3.953 . 0 0 "[ . 1 . 2 . 3]" 1
1626 2 36 SER HA 2 39 GLU HB2 . . 4.180 3.302 2.487 4.202 0.022 26 0 "[ . 1 . 2 . 3]" 1
1627 2 16 GLU HG2 2 17 ASN H . . 4.780 4.468 3.983 4.813 0.033 26 0 "[ . 1 . 2 . 3]" 1
1628 2 97 GLU HA 2 98 GLN H . . 3.530 3.541 3.473 3.587 0.057 23 0 "[ . 1 . 2 . 3]" 1
1629 2 29 LYS HA 2 29 LYS QD . . 3.390 2.736 2.176 3.466 0.076 7 0 "[ . 1 . 2 . 3]" 1
1630 2 55 ARG HA 2 55 ARG HD2 . . 4.150 2.796 2.144 3.788 . 0 0 "[ . 1 . 2 . 3]" 1
1631 2 55 ARG HB3 2 55 ARG HD2 . . 3.720 2.932 2.117 3.683 . 0 0 "[ . 1 . 2 . 3]" 1
1632 2 49 LEU MD2 2 55 ARG HD2 . . 3.770 3.217 1.984 3.812 0.042 2 0 "[ . 1 . 2 . 3]" 1
1633 2 42 GLN HB2 2 42 GLN HE21 . . 4.060 3.765 2.545 4.128 0.068 17 0 "[ . 1 . 2 . 3]" 1
1634 2 42 GLN HB2 2 43 LYS H . . 3.460 3.057 2.609 3.400 . 0 0 "[ . 1 . 2 . 3]" 1
1635 2 42 GLN H 2 42 GLN HB2 . . 4.090 2.365 2.086 2.591 . 0 0 "[ . 1 . 2 . 3]" 1
1636 2 39 GLU HA 2 42 GLN HB2 . . 2.960 2.196 2.055 2.401 . 0 0 "[ . 1 . 2 . 3]" 1
1637 2 93 ILE H 2 93 ILE MG . . 4.340 3.794 3.708 3.857 . 0 0 "[ . 1 . 2 . 3]" 1
1638 2 93 ILE HG12 2 93 ILE MG . . 3.680 2.422 2.343 2.531 . 0 0 "[ . 1 . 2 . 3]" 1
1639 2 55 ARG HB3 2 56 LYS H . . 3.800 3.570 2.642 3.848 0.048 15 0 "[ . 1 . 2 . 3]" 1
1640 2 55 ARG H 2 55 ARG HB3 . . 3.750 3.552 2.846 3.737 . 0 0 "[ . 1 . 2 . 3]" 1
1641 2 85 ILE HG13 2 86 THR H . . 4.080 4.086 3.915 4.129 0.049 23 0 "[ . 1 . 2 . 3]" 1
1642 2 85 ILE H 2 85 ILE HG13 . . 4.460 2.384 2.237 2.485 . 0 0 "[ . 1 . 2 . 3]" 1
1643 2 60 LYS QE 2 60 LYS HG3 . . 3.100 2.483 2.307 2.822 . 0 0 "[ . 1 . 2 . 3]" 1
1644 2 91 LYS HA 2 91 LYS HG3 . . 3.790 3.522 2.518 3.730 . 0 0 "[ . 1 . 2 . 3]" 1
1645 2 91 LYS H 2 91 LYS HG3 . . 3.880 3.655 2.328 3.909 0.029 12 0 "[ . 1 . 2 . 3]" 1
1646 2 78 TYR HA 2 81 LEU QB . . 3.650 2.769 2.222 3.057 . 0 0 "[ . 1 . 2 . 3]" 1
1647 2 78 TYR HA 2 81 LEU H . . 4.260 3.815 3.478 4.215 . 0 0 "[ . 1 . 2 . 3]" 1
1648 2 73 ILE MG 2 78 TYR HA . . 3.780 2.747 2.153 3.783 0.003 12 0 "[ . 1 . 2 . 3]" 1
1649 2 82 ILE HA 2 82 ILE HG13 . . 4.040 2.389 2.294 2.508 . 0 0 "[ . 1 . 2 . 3]" 1
1650 2 82 ILE HA 2 85 ILE HB . . 4.120 2.976 2.561 4.032 . 0 0 "[ . 1 . 2 . 3]" 1
1651 2 14 LEU MD2 2 15 VAL H . . 4.620 4.612 4.505 4.673 0.053 4 0 "[ . 1 . 2 . 3]" 1
1652 2 14 LEU HB3 2 14 LEU MD2 . . 3.220 3.228 3.195 3.241 0.021 6 0 "[ . 1 . 2 . 3]" 1
1653 2 11 VAL HA 2 14 LEU MD2 . . 4.350 3.955 3.629 4.271 . 0 0 "[ . 1 . 2 . 3]" 1
1654 2 14 LEU MD2 2 82 ILE MG . . 3.930 3.958 3.864 3.994 0.064 4 0 "[ . 1 . 2 . 3]" 1
1655 2 14 LEU HB2 2 14 LEU MD2 . . 3.670 2.378 2.309 2.422 . 0 0 "[ . 1 . 2 . 3]" 1
1656 2 14 LEU H 2 14 LEU MD2 . . 3.960 2.712 2.549 2.893 . 0 0 "[ . 1 . 2 . 3]" 1
1657 2 11 VAL HA 2 11 VAL MG1 . . 3.680 2.498 2.352 2.654 . 0 0 "[ . 1 . 2 . 3]" 1
1658 2 11 VAL H 2 11 VAL MG1 . . 3.670 3.728 3.698 3.746 0.076 9 0 "[ . 1 . 2 . 3]" 1
1659 2 89 ILE HG12 2 89 ILE MG . . 3.550 2.321 2.198 2.469 . 0 0 "[ . 1 . 2 . 3]" 1
1660 2 89 ILE HA 2 89 ILE MG . . 3.400 2.217 2.164 2.309 . 0 0 "[ . 1 . 2 . 3]" 1
1661 2 89 ILE HG13 2 89 ILE MG . . 3.520 2.942 2.403 3.279 . 0 0 "[ . 1 . 2 . 3]" 1
1662 2 89 ILE MG 2 90 ALA H . . 4.150 4.187 4.167 4.219 0.069 3 0 "[ . 1 . 2 . 3]" 1
1663 2 89 ILE H 2 89 ILE MG . . 3.620 2.282 2.135 2.684 . 0 0 "[ . 1 . 2 . 3]" 1
1664 2 41 LEU HA 2 41 LEU MD1 . . 3.880 3.769 2.180 3.889 0.009 8 0 "[ . 1 . 2 . 3]" 1
1665 2 56 LYS QB 2 56 LYS QG . . 2.400 1.998 1.972 2.030 . 0 0 "[ . 1 . 2 . 3]" 1
1666 2 56 LYS QB 2 56 LYS QD . . 2.740 2.251 2.084 2.669 . 0 0 "[ . 1 . 2 . 3]" 1
1667 2 56 LYS H 2 56 LYS QB . . 3.270 2.336 2.134 2.523 . 0 0 "[ . 1 . 2 . 3]" 1
1668 2 53 GLY QA 2 56 LYS QB . . 3.780 3.195 2.427 3.803 0.023 28 0 "[ . 1 . 2 . 3]" 1
1669 2 60 LYS HA 2 60 LYS HG3 . . 3.430 3.471 3.439 3.505 0.075 3 0 "[ . 1 . 2 . 3]" 1
1670 2 60 LYS HA 2 63 GLN H . . 3.720 3.719 3.514 3.805 0.085 3 0 "[ . 1 . 2 . 3]" 1
1671 2 60 LYS HA 2 60 LYS QB . . 2.520 2.360 2.298 2.417 . 0 0 "[ . 1 . 2 . 3]" 1
1672 2 60 LYS HA 2 61 LEU H . . 3.540 3.514 3.443 3.553 0.013 28 0 "[ . 1 . 2 . 3]" 1
1673 2 12 ILE HA 2 15 VAL MG2 . . 4.490 3.729 2.942 4.575 0.085 22 0 "[ . 1 . 2 . 3]" 1
1674 2 12 ILE HA 2 12 ILE MD . . 4.590 3.790 2.272 3.926 . 0 0 "[ . 1 . 2 . 3]" 1
1675 2 12 ILE HA 2 12 ILE HG13 . . 3.740 2.953 2.752 3.795 0.055 17 0 "[ . 1 . 2 . 3]" 1
1676 2 12 ILE HA 2 15 VAL HB . . 4.180 2.938 2.186 4.234 0.054 15 0 "[ . 1 . 2 . 3]" 1
1677 2 43 LYS H 2 43 LYS HB2 . . 4.170 2.397 2.075 3.086 . 0 0 "[ . 1 . 2 . 3]" 1
1678 2 43 LYS HB2 2 44 GLU H . . 4.580 2.359 2.065 2.989 . 0 0 "[ . 1 . 2 . 3]" 1
1679 2 64 ASN HB3 2 65 LEU H . . 5.010 2.766 2.496 3.840 . 0 0 "[ . 1 . 2 . 3]" 1
1680 2 64 ASN H 2 64 ASN HB3 . . 4.180 2.543 2.236 3.695 . 0 0 "[ . 1 . 2 . 3]" 1
1681 2 28 VAL H 2 28 VAL HB . . 3.860 3.013 2.270 3.822 . 0 0 "[ . 1 . 2 . 3]" 1
1682 2 28 VAL HB 2 29 LYS H . . 4.240 3.943 3.212 4.273 0.033 21 0 "[ . 1 . 2 . 3]" 1
1683 2 6 GLU H 2 6 GLU HG3 . . 4.060 3.940 3.715 4.086 0.026 17 0 "[ . 1 . 2 . 3]" 1
1684 2 6 GLU HG3 2 7 LEU H . . 4.070 3.685 3.142 4.101 0.031 3 0 "[ . 1 . 2 . 3]" 1
1685 2 91 LYS HA 2 91 LYS HB2 . . 2.950 2.874 2.325 3.008 0.058 18 0 "[ . 1 . 2 . 3]" 1
1686 2 91 LYS HA 2 91 LYS HB3 . . 2.990 2.841 2.420 3.014 0.024 16 0 "[ . 1 . 2 . 3]" 1
1687 2 3 CYS HB2 2 4 TYR H . . 4.430 3.509 1.883 4.434 0.004 6 0 "[ . 1 . 2 . 3]" 1
1688 2 13 VAL H 2 13 VAL MG2 . . 4.320 2.398 2.276 2.540 . 0 0 "[ . 1 . 2 . 3]" 1
1689 2 13 VAL MG2 2 14 LEU H . . 4.020 4.056 4.034 4.075 0.055 28 0 "[ . 1 . 2 . 3]" 1
1690 2 49 LEU HG 2 50 SER H . . 4.480 4.409 3.967 4.593 0.113 22 0 "[ . 1 . 2 . 3]" 1
1691 2 24 LYS H 2 24 LYS HG2 . . 5.020 4.157 1.951 4.834 . 0 0 "[ . 1 . 2 . 3]" 1
1692 2 12 ILE H 2 12 ILE HG12 . . 3.990 3.431 2.089 3.717 . 0 0 "[ . 1 . 2 . 3]" 1
1693 2 52 THR H 2 52 THR HB . . 3.920 2.390 2.053 2.821 . 0 0 "[ . 1 . 2 . 3]" 1
1694 2 52 THR HB 2 53 GLY H . . 3.920 3.566 2.283 4.024 0.104 29 0 "[ . 1 . 2 . 3]" 1
1695 2 29 LYS HB3 2 29 LYS HG3 . . 3.000 2.700 2.393 3.014 0.014 19 0 "[ . 1 . 2 . 3]" 1
1696 2 29 LYS HB3 2 30 ASN H . . 4.230 3.688 1.937 4.309 0.079 19 0 "[ . 1 . 2 . 3]" 1
1697 2 27 LEU H 2 27 LEU HB3 . . 3.990 3.640 3.140 4.023 0.033 24 0 "[ . 1 . 2 . 3]" 1
1698 2 96 GLN HE21 2 96 GLN HG2 . . 3.560 2.313 2.004 3.352 . 0 0 "[ . 1 . 2 . 3]" 1
1699 2 96 GLN HA 2 96 GLN HG2 . . 3.550 2.638 2.379 2.886 . 0 0 "[ . 1 . 2 . 3]" 1
1700 2 96 GLN HB2 2 96 GLN HG2 . . 3.010 2.978 2.892 3.013 0.003 4 0 "[ . 1 . 2 . 3]" 1
1701 2 41 LEU HB3 2 41 LEU MD1 . . 3.230 2.287 2.132 2.389 . 0 0 "[ . 1 . 2 . 3]" 1
1702 2 41 LEU H 2 41 LEU MD1 . . 4.270 3.673 3.456 4.027 . 0 0 "[ . 1 . 2 . 3]" 1
1703 2 41 LEU MD1 2 42 GLN H . . 5.080 4.950 4.387 5.212 0.132 20 0 "[ . 1 . 2 . 3]" 1
1704 2 91 LYS H 2 91 LYS HB3 . . 3.640 3.171 2.712 3.576 . 0 0 "[ . 1 . 2 . 3]" 1
1705 2 65 LEU HB2 2 65 LEU MD2 . . 3.490 2.424 2.226 3.283 . 0 0 "[ . 1 . 2 . 3]" 1
1706 2 65 LEU HA 2 65 LEU MD2 . . 3.590 2.297 2.070 2.710 . 0 0 "[ . 1 . 2 . 3]" 1
1707 2 65 LEU HB3 2 65 LEU MD2 . . 3.510 3.225 2.568 3.292 . 0 0 "[ . 1 . 2 . 3]" 1
1708 2 60 LYS HA 2 63 GLN HB2 . . 3.670 3.462 2.872 3.711 0.041 10 0 "[ . 1 . 2 . 3]" 1
1709 2 63 GLN H 2 63 GLN HB2 . . 3.410 2.281 2.133 2.533 . 0 0 "[ . 1 . 2 . 3]" 1
1710 2 63 GLN HB2 2 64 ASN H . . 3.900 3.576 2.743 3.935 0.035 2 0 "[ . 1 . 2 . 3]" 1
1711 2 63 GLN HA 2 63 GLN HB2 . . 2.840 2.737 2.440 2.936 0.096 22 0 "[ . 1 . 2 . 3]" 1
1712 2 63 GLN HB2 2 63 GLN HE21 . . 3.990 3.223 2.111 3.749 . 0 0 "[ . 1 . 2 . 3]" 1
1713 2 72 ARG HA 2 72 ARG HD3 . . 3.640 3.545 2.344 3.717 0.077 5 0 "[ . 1 . 2 . 3]" 1
1714 2 72 ARG HA 2 73 ILE H . . 3.430 2.188 2.083 2.416 . 0 0 "[ . 1 . 2 . 3]" 1
1715 2 79 TRP HB2 2 80 THR H . . 5.230 3.230 2.998 3.464 . 0 0 "[ . 1 . 2 . 3]" 1
1716 2 82 ILE HG12 2 83 GLY H . . 4.240 4.233 4.046 4.279 0.039 5 0 "[ . 1 . 2 . 3]" 1
1717 2 58 ALA HA 2 85 ILE MD . . 3.700 3.067 2.618 3.565 . 0 0 "[ . 1 . 2 . 3]" 1
1718 2 58 ALA HA 2 62 ILE MD . . 3.770 3.809 3.777 3.834 0.064 4 0 "[ . 1 . 2 . 3]" 1
1719 2 58 ALA HA 2 61 LEU HB3 . . 4.100 4.134 3.989 4.182 0.082 3 0 "[ . 1 . 2 . 3]" 1
1720 2 58 ALA HA 2 61 LEU HB2 . . 3.970 2.595 2.367 2.779 . 0 0 "[ . 1 . 2 . 3]" 1
1721 2 58 ALA HA 2 60 LYS H . . 4.300 4.333 4.217 4.371 0.071 24 0 "[ . 1 . 2 . 3]" 1
1722 2 58 ALA HA 2 61 LEU H . . 4.690 3.291 3.042 3.451 . 0 0 "[ . 1 . 2 . 3]" 1
1723 2 39 GLU H 2 39 GLU HB2 . . 4.050 2.728 1.990 3.493 . 0 0 "[ . 1 . 2 . 3]" 1
1724 2 39 GLU HA 2 39 GLU HB2 . . 2.980 2.432 2.177 2.915 . 0 0 "[ . 1 . 2 . 3]" 1
1725 2 45 LEU HA 2 45 LEU MD2 . . 3.470 2.728 2.108 3.462 . 0 0 "[ . 1 . 2 . 3]" 1
1726 2 45 LEU MD2 2 82 ILE MD . . 3.800 2.265 1.953 3.822 0.022 3 0 "[ . 1 . 2 . 3]" 1
1727 2 45 LEU HB2 2 45 LEU MD2 . . 3.200 2.985 2.483 3.228 0.028 14 0 "[ . 1 . 2 . 3]" 1
1728 2 45 LEU H 2 45 LEU MD2 . . 4.630 4.105 2.438 4.634 0.004 13 0 "[ . 1 . 2 . 3]" 1
1729 2 45 LEU HB3 2 45 LEU MD2 . . 3.490 2.335 2.115 3.265 . 0 0 "[ . 1 . 2 . 3]" 1
1730 2 50 SER HB2 2 51 ASP H . . 4.220 3.633 2.032 4.288 0.068 23 0 "[ . 1 . 2 . 3]" 1
1731 2 50 SER H 2 50 SER HB2 . . 4.110 3.063 2.211 3.985 . 0 0 "[ . 1 . 2 . 3]" 1
1732 2 16 GLU HA 2 16 GLU HG2 . . 3.820 2.536 2.315 3.584 . 0 0 "[ . 1 . 2 . 3]" 1
1733 2 42 GLN HA 2 42 GLN HG2 . . 3.550 2.367 2.086 3.194 . 0 0 "[ . 1 . 2 . 3]" 1
1734 2 42 GLN HE21 2 42 GLN HG2 . . 3.580 3.046 2.279 3.603 0.023 4 0 "[ . 1 . 2 . 3]" 1
1735 2 42 GLN HG2 2 43 LYS H . . 5.120 4.964 4.600 5.170 0.050 22 0 "[ . 1 . 2 . 3]" 1
1736 2 42 GLN HB3 2 42 GLN HG2 . . 2.850 2.771 2.375 2.964 0.114 17 0 "[ . 1 . 2 . 3]" 1
1737 2 42 GLN H 2 42 GLN HG2 . . 3.560 3.358 2.440 3.646 0.086 26 0 "[ . 1 . 2 . 3]" 1
1738 2 42 GLN HE22 2 42 GLN HG2 . . 3.870 3.827 3.520 3.980 0.110 10 0 "[ . 1 . 2 . 3]" 1
1739 2 56 LYS H 2 56 LYS QD . . 3.680 2.159 1.887 2.552 . 0 0 "[ . 1 . 2 . 3]" 1
1740 2 56 LYS QD 2 57 ALA H . . 4.290 4.308 4.055 4.421 0.131 17 0 "[ . 1 . 2 . 3]" 1
1741 2 56 LYS HA 2 56 LYS QD . . 3.260 2.854 2.071 3.318 0.058 15 0 "[ . 1 . 2 . 3]" 1
1742 2 53 GLY QA 2 56 LYS QD . . 3.780 3.136 2.187 3.823 0.043 2 0 "[ . 1 . 2 . 3]" 1
1743 2 62 ILE HG12 2 62 ILE MG . . 3.310 2.372 2.145 3.129 . 0 0 "[ . 1 . 2 . 3]" 1
1744 2 73 ILE HA 2 73 ILE MD . . 4.270 2.656 2.162 3.428 . 0 0 "[ . 1 . 2 . 3]" 1
1745 2 73 ILE H 2 73 ILE MD . . 4.930 3.448 2.735 4.143 . 0 0 "[ . 1 . 2 . 3]" 1
1746 2 72 ARG H 2 73 ILE MD . . 4.540 4.164 3.382 4.552 0.012 20 0 "[ . 1 . 2 . 3]" 1
1747 2 4 TYR HB3 2 9 LYS HD2 . . 4.230 4.001 2.861 4.301 0.071 12 0 "[ . 1 . 2 . 3]" 1
1748 2 92 LEU H 2 92 LEU MD1 . . 4.410 4.156 3.890 4.292 . 0 0 "[ . 1 . 2 . 3]" 1
1749 2 92 LEU HB3 2 92 LEU MD1 . . 3.210 2.298 2.197 2.379 . 0 0 "[ . 1 . 2 . 3]" 1
1750 2 92 LEU HA 2 92 LEU MD1 . . 3.230 3.075 2.193 3.325 0.095 9 0 "[ . 1 . 2 . 3]" 1
1751 2 92 LEU HB2 2 92 LEU MD1 . . 3.190 3.206 3.149 3.218 0.028 12 0 "[ . 1 . 2 . 3]" 1
1752 2 15 VAL H 2 15 VAL MG1 . . 4.660 3.310 2.186 3.833 . 0 0 "[ . 1 . 2 . 3]" 1
1753 2 15 VAL MG1 2 16 GLU H . . 4.700 3.105 2.451 3.633 . 0 0 "[ . 1 . 2 . 3]" 1
1754 2 60 LYS QD 2 60 LYS QE . . 2.400 2.114 2.009 2.131 . 0 0 "[ . 1 . 2 . 3]" 1
1755 2 69 HIS HB2 2 70 ASP H . . 4.720 4.450 4.008 4.660 . 0 0 "[ . 1 . 2 . 3]" 1
1756 2 24 LYS QE 2 24 LYS HG2 . . 3.680 2.349 2.186 3.216 . 0 0 "[ . 1 . 2 . 3]" 1
1757 2 24 LYS HA 2 24 LYS QE . . 4.380 4.210 3.780 4.420 0.040 11 0 "[ . 1 . 2 . 3]" 1
1758 2 24 LYS QE 2 24 LYS HG3 . . 3.720 2.519 2.246 3.300 . 0 0 "[ . 1 . 2 . 3]" 1
1759 2 24 LYS QB 2 24 LYS QE . . 3.610 3.531 2.230 3.669 0.059 3 0 "[ . 1 . 2 . 3]" 1
1760 2 95 GLU H 2 95 GLU HB3 . . 3.780 3.093 2.220 3.361 . 0 0 "[ . 1 . 2 . 3]" 1
1761 2 92 LEU HA 2 95 GLU HB3 . . 3.150 3.140 2.133 3.216 0.066 7 0 "[ . 1 . 2 . 3]" 1
1762 2 95 GLU HB3 2 96 GLN H . . 3.750 2.566 2.397 2.820 . 0 0 "[ . 1 . 2 . 3]" 1
1763 2 101 SER H 2 101 SER QB . . 3.390 2.588 2.187 3.435 0.045 8 0 "[ . 1 . 2 . 3]" 1
1764 2 27 LEU HA 2 27 LEU MD2 . . 3.500 2.192 2.112 2.621 . 0 0 "[ . 1 . 2 . 3]" 1
1765 2 27 LEU HB3 2 27 LEU MD2 . . 2.470 2.416 2.320 2.487 0.017 15 0 "[ . 1 . 2 . 3]" 1
1766 2 27 LEU HB2 2 27 LEU MD2 . . 3.490 3.259 3.243 3.268 . 0 0 "[ . 1 . 2 . 3]" 1
1767 2 93 ILE H 2 93 ILE HG13 . . 4.770 2.207 2.025 2.391 . 0 0 "[ . 1 . 2 . 3]" 1
1768 2 82 ILE HA 2 85 ILE MD . . 4.030 2.403 2.131 2.779 . 0 0 "[ . 1 . 2 . 3]" 1
1769 2 85 ILE HA 2 85 ILE MD . . 3.920 3.928 3.900 3.946 0.026 4 0 "[ . 1 . 2 . 3]" 1
1770 2 61 LEU HB2 2 85 ILE MD . . 4.130 4.025 3.807 4.160 0.030 15 0 "[ . 1 . 2 . 3]" 1
1771 2 85 ILE H 2 85 ILE MD . . 4.260 3.790 3.659 3.899 . 0 0 "[ . 1 . 2 . 3]" 1
1772 2 85 ILE HB 2 85 ILE MD . . 3.590 2.479 2.393 2.570 . 0 0 "[ . 1 . 2 . 3]" 1
1773 2 43 LYS HA 2 43 LYS HD3 . . 4.280 4.179 3.694 4.370 0.090 2 0 "[ . 1 . 2 . 3]" 1
1774 2 43 LYS H 2 43 LYS HD3 . . 3.640 3.421 1.783 3.759 0.119 15 0 "[ . 1 . 2 . 3]" 1
1775 2 41 LEU HA 2 41 LEU MD2 . . 3.640 2.143 2.023 2.562 . 0 0 "[ . 1 . 2 . 3]" 1
1776 2 41 LEU HB3 2 41 LEU MD2 . . 3.390 2.509 2.396 3.278 . 0 0 "[ . 1 . 2 . 3]" 1
1777 2 41 LEU H 2 41 LEU MD2 . . 3.880 3.336 2.267 3.772 . 0 0 "[ . 1 . 2 . 3]" 1
1778 2 41 LEU MD2 2 42 GLN H . . 4.770 4.722 4.259 4.826 0.056 11 0 "[ . 1 . 2 . 3]" 1
1779 2 41 LEU HB2 2 41 LEU MD2 . . 3.250 3.235 2.575 3.270 0.020 22 0 "[ . 1 . 2 . 3]" 1
1780 2 36 SER H 2 36 SER HB3 . . 3.880 2.995 2.257 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
1781 2 76 ASP H 2 76 ASP HB3 . . 3.710 2.699 2.416 3.569 . 0 0 "[ . 1 . 2 . 3]" 1
1782 2 76 ASP HB3 2 77 GLU H . . 4.120 3.730 2.622 4.179 0.059 25 0 "[ . 1 . 2 . 3]" 1
1783 2 81 LEU HA 2 84 GLY H . . 4.280 4.155 3.800 4.329 0.049 1 0 "[ . 1 . 2 . 3]" 1
1784 2 81 LEU HA 2 81 LEU MD1 . . 3.410 2.608 2.057 3.050 . 0 0 "[ . 1 . 2 . 3]" 1
1785 2 82 ILE MD 2 82 ILE MG . . 3.110 2.122 2.057 2.253 . 0 0 "[ . 1 . 2 . 3]" 1
1786 2 82 ILE HA 2 82 ILE MD . . 3.700 3.562 3.391 3.658 . 0 0 "[ . 1 . 2 . 3]" 1
1787 2 41 LEU MD1 2 82 ILE MD . . 3.040 2.766 1.900 3.067 0.027 6 0 "[ . 1 . 2 . 3]" 1
1788 2 82 ILE MD 2 85 ILE MD . . 3.150 2.733 2.370 3.034 . 0 0 "[ . 1 . 2 . 3]" 1
1789 2 48 MET ME 2 82 ILE MD . . 3.780 3.628 3.124 3.801 0.021 15 0 "[ . 1 . 2 . 3]" 1
1790 2 82 ILE H 2 82 ILE MD . . 4.340 4.397 4.361 4.462 0.122 12 0 "[ . 1 . 2 . 3]" 1
1791 2 14 LEU HB3 2 14 LEU MD1 . . 3.540 2.434 2.401 2.486 . 0 0 "[ . 1 . 2 . 3]" 1
1792 2 14 LEU H 2 14 LEU MD1 . . 4.260 4.085 3.975 4.174 . 0 0 "[ . 1 . 2 . 3]" 1
1793 2 80 THR H 2 80 THR MG . . 3.690 2.383 2.125 2.701 . 0 0 "[ . 1 . 2 . 3]" 1
1794 2 80 THR HA 2 80 THR MG . . 3.180 3.177 2.209 3.224 0.044 19 0 "[ . 1 . 2 . 3]" 1
1795 2 48 MET HA 2 48 MET QG . . 3.560 2.663 2.266 3.031 . 0 0 "[ . 1 . 2 . 3]" 1
1796 2 48 MET H 2 48 MET QG . . 4.430 4.051 3.847 4.436 0.006 8 0 "[ . 1 . 2 . 3]" 1
1797 2 48 MET QG 2 89 ILE MD . . 3.200 2.380 2.050 2.746 . 0 0 "[ . 1 . 2 . 3]" 1
1798 2 48 MET QG 2 49 LEU H . . 5.500 4.241 3.464 4.711 . 0 0 "[ . 1 . 2 . 3]" 1
1799 2 89 ILE H 2 89 ILE HG12 . . 4.780 2.738 1.986 3.631 . 0 0 "[ . 1 . 2 . 3]" 1
1800 2 40 MET HA 2 40 MET ME . . 5.500 4.596 4.021 5.249 . 0 0 "[ . 1 . 2 . 3]" 1
1801 2 43 LYS H 2 43 LYS HB3 . . 4.040 3.568 3.418 3.851 . 0 0 "[ . 1 . 2 . 3]" 1
1802 2 43 LYS HB3 2 44 GLU H . . 4.430 3.200 2.680 4.155 . 0 0 "[ . 1 . 2 . 3]" 1
1803 2 48 MET HA 2 89 ILE MD . . 4.060 4.028 3.699 4.105 0.045 30 0 "[ . 1 . 2 . 3]" 1
1804 2 55 ARG HB2 2 55 ARG HD2 . . 4.020 3.456 2.247 4.053 0.033 6 0 "[ . 1 . 2 . 3]" 1
1805 2 55 ARG HB2 2 56 LYS H . . 3.760 3.001 2.402 3.792 0.032 23 0 "[ . 1 . 2 . 3]" 1
1806 2 55 ARG H 2 55 ARG HB2 . . 3.800 2.564 2.194 2.839 . 0 0 "[ . 1 . 2 . 3]" 1
1807 2 59 ASP H 2 59 ASP HB2 . . 4.020 2.324 1.999 2.601 . 0 0 "[ . 1 . 2 . 3]" 1
1808 2 59 ASP HB2 2 60 LYS H . . 3.900 3.123 2.481 3.906 0.006 27 0 "[ . 1 . 2 . 3]" 1
1809 2 56 LYS QG 2 59 ASP HB2 . . 4.250 3.623 2.839 4.257 0.007 27 0 "[ . 1 . 2 . 3]" 1
1810 2 11 VAL HA 2 14 LEU H . . 4.220 3.844 3.665 4.029 . 0 0 "[ . 1 . 2 . 3]" 1
1811 2 9 LYS HA 2 12 ILE MD . . 3.970 2.629 2.283 3.979 0.009 17 0 "[ . 1 . 2 . 3]" 1
1812 2 9 LYS HA 2 9 LYS QG . . 3.910 2.865 2.122 3.055 . 0 0 "[ . 1 . 2 . 3]" 1
1813 2 9 LYS HA 2 12 ILE H . . 4.560 3.385 3.008 3.722 . 0 0 "[ . 1 . 2 . 3]" 1
1814 2 14 LEU HA 2 14 LEU MD2 . . 3.770 2.515 2.338 2.709 . 0 0 "[ . 1 . 2 . 3]" 1
1815 2 14 LEU HA 2 14 LEU MD1 . . 3.580 2.051 1.976 2.089 . 0 0 "[ . 1 . 2 . 3]" 1
1816 2 14 LEU HA 2 14 LEU HG . . 3.860 3.678 3.643 3.710 . 0 0 "[ . 1 . 2 . 3]" 1
1817 2 9 LYS HB3 2 10 ALA H . . 4.000 3.734 3.238 4.031 0.031 21 0 "[ . 1 . 2 . 3]" 1
1818 2 6 GLU HA 2 9 LYS HB3 . . 3.880 3.781 3.506 3.935 0.055 3 0 "[ . 1 . 2 . 3]" 1
1819 2 9 LYS HB3 2 9 LYS QG . . 2.400 2.374 2.284 2.459 0.059 8 0 "[ . 1 . 2 . 3]" 1
1820 2 17 ASN HA 2 20 LYS HB3 . . 4.230 3.116 2.006 4.289 0.059 15 0 "[ . 1 . 2 . 3]" 1
1821 2 17 ASN HA 2 20 LYS H . . 4.030 3.405 2.825 3.968 . 0 0 "[ . 1 . 2 . 3]" 1
1822 2 43 LYS HA 2 43 LYS HD2 . . 4.230 3.849 2.218 4.367 0.137 13 0 "[ . 1 . 2 . 3]" 1
1823 2 39 GLU HG3 2 43 LYS HD2 . . 3.440 3.084 2.083 3.520 0.080 22 0 "[ . 1 . 2 . 3]" 1
1824 2 43 LYS H 2 43 LYS HD2 . . 4.180 3.102 2.077 3.873 . 0 0 "[ . 1 . 2 . 3]" 1
1825 2 24 LYS HA 2 24 LYS HG2 . . 4.000 3.564 2.366 3.896 . 0 0 "[ . 1 . 2 . 3]" 1
1826 2 24 LYS HA 2 24 LYS HG3 . . 3.720 3.084 2.243 3.766 0.046 19 0 "[ . 1 . 2 . 3]" 1
1827 2 27 LEU HB2 2 28 VAL H . . 4.370 3.180 2.010 4.319 . 0 0 "[ . 1 . 2 . 3]" 1
1828 2 62 ILE H 2 62 ILE MD . . 4.050 3.106 2.063 3.391 . 0 0 "[ . 1 . 2 . 3]" 1
1829 2 28 VAL MG1 2 29 LYS H . . 3.450 2.357 1.805 3.474 0.024 23 0 "[ . 1 . 2 . 3]" 1
1830 2 28 VAL HA 2 28 VAL MG1 . . 3.280 2.777 2.265 3.278 . 0 0 "[ . 1 . 2 . 3]" 1
1831 2 95 GLU HA 2 95 GLU HG2 . . 3.600 3.494 2.646 3.609 0.009 4 0 "[ . 1 . 2 . 3]" 1
1832 2 95 GLU H 2 95 GLU HG2 . . 4.440 4.278 3.978 4.490 0.050 16 0 "[ . 1 . 2 . 3]" 1
1833 2 95 GLU HG2 2 96 GLN H . . 4.560 4.598 3.710 4.727 0.167 7 0 "[ . 1 . 2 . 3]" 1
1834 2 95 GLU HB2 2 95 GLU HG2 . . 2.940 2.567 2.402 2.995 0.055 18 0 "[ . 1 . 2 . 3]" 1
1835 2 32 ILE HB 2 32 ILE MD . . 3.730 2.555 2.203 3.280 . 0 0 "[ . 1 . 2 . 3]" 1
1836 2 94 HIS HA 2 97 GLU H . . 4.330 3.362 2.308 3.833 . 0 0 "[ . 1 . 2 . 3]" 1
1837 2 90 ALA HA 2 93 ILE HB . . 4.450 2.238 2.033 2.691 . 0 0 "[ . 1 . 2 . 3]" 1
1838 2 90 ALA HA 2 93 ILE MD . . 3.660 2.118 2.036 2.219 . 0 0 "[ . 1 . 2 . 3]" 1
1839 2 100 SER HA 2 101 SER H . . 3.420 2.974 2.537 3.378 . 0 0 "[ . 1 . 2 . 3]" 1
1840 2 100 SER HA 2 100 SER QB . . 2.600 2.391 2.152 2.490 . 0 0 "[ . 1 . 2 . 3]" 1
1841 2 35 SER HA 2 38 ARG H . . 3.710 3.730 3.348 4.006 0.296 16 0 "[ . 1 . 2 . 3]" 1
1842 2 6 GLU HA 2 6 GLU HG3 . . 3.730 3.746 3.597 3.960 0.230 5 0 "[ . 1 . 2 . 3]" 1
1843 2 6 GLU HA 2 6 GLU HG2 . . 3.770 3.748 3.589 3.821 0.051 18 0 "[ . 1 . 2 . 3]" 1
1844 2 92 LEU HB3 2 93 ILE H . . 4.430 2.589 2.421 3.208 . 0 0 "[ . 1 . 2 . 3]" 1
1845 2 92 LEU H 2 92 LEU HB3 . . 3.690 2.469 2.167 3.413 . 0 0 "[ . 1 . 2 . 3]" 1
1846 2 49 LEU HB2 2 49 LEU MD2 . . 3.170 2.523 2.256 2.815 . 0 0 "[ . 1 . 2 . 3]" 1
1847 2 49 LEU H 2 49 LEU MD2 . . 4.110 3.791 2.610 4.163 0.053 30 0 "[ . 1 . 2 . 3]" 1
1848 2 97 GLU HB3 2 98 GLN H . . 3.480 2.995 1.996 3.564 0.084 4 0 "[ . 1 . 2 . 3]" 1
1849 2 29 LYS QE 2 29 LYS HG3 . . 2.540 2.442 2.235 2.592 0.052 27 0 "[ . 1 . 2 . 3]" 1
1850 2 29 LYS QD 2 29 LYS QE . . 2.400 2.095 2.023 2.135 . 0 0 "[ . 1 . 2 . 3]" 1
1851 2 29 LYS HB3 2 29 LYS QE . . 3.810 2.332 1.958 3.416 . 0 0 "[ . 1 . 2 . 3]" 1
1852 2 29 LYS HA 2 29 LYS QE . . 4.750 3.832 2.514 4.771 0.021 23 0 "[ . 1 . 2 . 3]" 1
1853 2 29 LYS HB2 2 29 LYS QE . . 3.600 3.158 2.404 3.616 0.016 22 0 "[ . 1 . 2 . 3]" 1
1854 2 93 ILE HA 2 93 ILE MD . . 3.850 3.843 3.727 3.886 0.036 11 0 "[ . 1 . 2 . 3]" 1
1855 2 93 ILE HB 2 93 ILE MD . . 3.540 2.296 2.205 2.374 . 0 0 "[ . 1 . 2 . 3]" 1
1856 2 93 ILE MD 2 93 ILE MG . . 2.830 2.074 2.025 2.114 . 0 0 "[ . 1 . 2 . 3]" 1
1857 2 93 ILE H 2 93 ILE MD . . 4.140 3.451 3.211 3.657 . 0 0 "[ . 1 . 2 . 3]" 1
1858 2 93 ILE MD 2 94 HIS H . . 4.300 4.338 4.198 4.372 0.072 18 0 "[ . 1 . 2 . 3]" 1
1859 2 63 GLN HB2 2 63 GLN HG3 . . 2.910 2.392 2.190 2.586 . 0 0 "[ . 1 . 2 . 3]" 1
1860 2 63 GLN HE22 2 63 GLN HG3 . . 3.720 3.665 3.514 3.781 0.061 13 0 "[ . 1 . 2 . 3]" 1
1861 2 63 GLN HA 2 63 GLN HG3 . . 3.450 3.161 2.246 3.541 0.091 22 0 "[ . 1 . 2 . 3]" 1
1862 2 65 LEU HA 2 65 LEU HG . . 4.200 3.641 2.331 3.758 . 0 0 "[ . 1 . 2 . 3]" 1
1863 2 91 LYS QE 2 91 LYS HG3 . . 3.350 3.353 3.311 3.419 0.069 26 0 "[ . 1 . 2 . 3]" 1
1864 2 91 LYS HB2 2 91 LYS QE . . 3.700 3.509 1.974 3.731 0.031 14 0 "[ . 1 . 2 . 3]" 1
1865 2 91 LYS HB3 2 91 LYS QE . . 2.810 2.701 2.184 2.877 0.067 11 0 "[ . 1 . 2 . 3]" 1
1866 2 91 LYS QE 2 91 LYS HG2 . . 2.740 2.491 2.371 2.784 0.044 10 0 "[ . 1 . 2 . 3]" 1
1867 2 74 SER HB2 2 76 ASP H . . 4.850 3.789 3.105 4.887 0.037 9 0 "[ . 1 . 2 . 3]" 1
1868 2 74 SER HB2 2 75 PHE H . . 4.560 3.547 2.349 3.875 . 0 0 "[ . 1 . 2 . 3]" 1
1869 2 82 ILE HB 2 83 GLY H . . 4.780 4.386 4.266 4.472 . 0 0 "[ . 1 . 2 . 3]" 1
1870 2 48 MET ME 2 89 ILE MD . . 3.460 2.948 2.166 3.482 0.022 27 0 "[ . 1 . 2 . 3]" 1
1871 2 89 ILE H 2 89 ILE MD . . 4.120 3.563 2.906 3.995 . 0 0 "[ . 1 . 2 . 3]" 1
1872 2 35 SER H 2 35 SER HB2 . . 4.020 2.951 2.430 3.669 . 0 0 "[ . 1 . 2 . 3]" 1
1873 2 49 LEU HB3 2 49 LEU MD1 . . 3.310 3.139 2.397 3.262 . 0 0 "[ . 1 . 2 . 3]" 1
1874 2 49 LEU HB3 2 49 LEU MD2 . . 3.350 2.316 2.178 3.219 . 0 0 "[ . 1 . 2 . 3]" 1
1875 2 57 ALA HA 2 59 ASP H . . 4.280 4.330 4.283 4.404 0.124 14 0 "[ . 1 . 2 . 3]" 1
1876 2 57 ALA HA 2 60 LYS QB . . 3.430 3.154 2.768 3.447 0.017 21 0 "[ . 1 . 2 . 3]" 1
1877 2 57 ALA HA 2 60 LYS H . . 4.080 3.786 3.386 4.045 . 0 0 "[ . 1 . 2 . 3]" 1
1878 2 60 LYS QB 2 60 LYS HG3 . . 2.400 2.153 2.127 2.182 . 0 0 "[ . 1 . 2 . 3]" 1
1879 2 60 LYS QB 2 60 LYS QE . . 3.610 2.457 1.918 3.638 0.028 10 0 "[ . 1 . 2 . 3]" 1
1880 2 60 LYS H 2 60 LYS QB . . 3.350 2.189 2.064 2.300 . 0 0 "[ . 1 . 2 . 3]" 1
1881 2 60 LYS QB 2 60 LYS HG2 . . 2.780 2.515 2.451 2.561 . 0 0 "[ . 1 . 2 . 3]" 1
1882 2 8 GLU HA 2 8 GLU HG3 . . 4.200 2.877 2.210 4.204 0.004 9 0 "[ . 1 . 2 . 3]" 1
1883 2 8 GLU HA 2 11 VAL HB . . 4.230 2.946 2.593 3.385 . 0 0 "[ . 1 . 2 . 3]" 1
1884 2 8 GLU HA 2 11 VAL H . . 4.570 3.596 3.249 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
1885 2 45 LEU H 2 45 LEU HG . . 4.440 3.349 2.410 4.533 0.093 5 0 "[ . 1 . 2 . 3]" 1
1886 2 9 LYS H 2 9 LYS QG . . 4.730 2.262 2.153 2.516 . 0 0 "[ . 1 . 2 . 3]" 1
1887 2 25 TYR H 2 25 TYR HB2 . . 4.160 2.555 2.185 3.460 . 0 0 "[ . 1 . 2 . 3]" 1
1888 2 86 THR HA 2 86 THR MG . . 3.610 2.270 2.195 2.446 . 0 0 "[ . 1 . 2 . 3]" 1
1889 2 86 THR MG 2 90 ALA MB . . 3.260 2.428 2.036 2.739 . 0 0 "[ . 1 . 2 . 3]" 1
1890 2 86 THR H 2 86 THR MG . . 4.290 3.787 3.737 3.858 . 0 0 "[ . 1 . 2 . 3]" 1
1891 2 86 THR MG 2 87 GLY H . . 4.750 3.934 2.310 4.129 . 0 0 "[ . 1 . 2 . 3]" 1
1892 2 72 ARG HA 2 72 ARG QG . . 3.490 2.450 2.119 3.267 . 0 0 "[ . 1 . 2 . 3]" 1
1893 2 72 ARG H 2 72 ARG QG . . 3.880 3.863 3.600 3.959 0.079 15 0 "[ . 1 . 2 . 3]" 1
1894 2 61 LEU HG 2 62 ILE H . . 4.490 4.275 4.019 4.440 . 0 0 "[ . 1 . 2 . 3]" 1
1895 2 61 LEU H 2 61 LEU HG . . 3.890 2.371 1.928 2.625 . 0 0 "[ . 1 . 2 . 3]" 1
1896 2 99 GLN HB2 2 99 GLN HG3 . . 3.010 2.577 2.490 2.711 . 0 0 "[ . 1 . 2 . 3]" 1
1897 2 99 GLN H 2 99 GLN HB2 . . 3.520 2.403 2.247 2.541 . 0 0 "[ . 1 . 2 . 3]" 1
1898 2 99 GLN HB2 2 100 SER H . . 3.600 3.099 2.748 3.329 . 0 0 "[ . 1 . 2 . 3]" 1
1899 2 99 GLN HB2 2 100 SER HA . . 4.870 4.828 4.546 4.942 0.072 18 0 "[ . 1 . 2 . 3]" 1
1900 2 32 ILE MG 2 33 SER H . . 4.410 2.639 1.669 3.783 . 0 0 "[ . 1 . 2 . 3]" 1
1901 2 85 ILE HA 2 85 ILE HG13 . . 3.420 3.155 3.066 3.251 . 0 0 "[ . 1 . 2 . 3]" 1
1902 2 92 LEU HA 2 95 GLU H . . 3.850 3.421 3.241 3.625 . 0 0 "[ . 1 . 2 . 3]" 1
1903 2 92 LEU HA 2 92 LEU MD2 . . 3.020 2.166 2.114 2.253 . 0 0 "[ . 1 . 2 . 3]" 1
1904 2 12 ILE MD 2 12 ILE MG . . 3.150 2.103 2.045 2.304 . 0 0 "[ . 1 . 2 . 3]" 1
1905 2 12 ILE MG 2 13 VAL H . . 4.260 3.331 3.041 3.615 . 0 0 "[ . 1 . 2 . 3]" 1
1906 2 12 ILE MG 2 15 VAL H . . 4.580 4.317 3.991 4.529 . 0 0 "[ . 1 . 2 . 3]" 1
1907 2 12 ILE HA 2 12 ILE MG . . 3.600 2.445 2.184 2.626 . 0 0 "[ . 1 . 2 . 3]" 1
1908 2 12 ILE HG12 2 12 ILE MG . . 3.710 2.510 2.372 3.214 . 0 0 "[ . 1 . 2 . 3]" 1
1909 2 12 ILE H 2 12 ILE MG . . 3.720 3.736 3.654 3.788 0.068 17 0 "[ . 1 . 2 . 3]" 1
1910 2 52 THR H 2 52 THR MG . . 4.310 2.832 1.988 3.806 . 0 0 "[ . 1 . 2 . 3]" 1
1911 2 52 THR HA 2 52 THR MG . . 3.170 2.973 2.310 3.244 0.074 26 0 "[ . 1 . 2 . 3]" 1
1912 2 52 THR MG 2 53 GLY H . . 3.330 2.722 2.246 3.381 0.051 1 0 "[ . 1 . 2 . 3]" 1
1913 2 92 LEU HB2 2 93 ILE H . . 4.430 3.755 3.021 3.971 . 0 0 "[ . 1 . 2 . 3]" 1
1914 2 100 SER H 2 100 SER QB . . 3.280 3.116 2.792 3.402 0.122 14 0 "[ . 1 . 2 . 3]" 1
1915 2 96 GLN HB2 2 96 GLN HE21 . . 4.510 3.918 2.551 4.521 0.011 24 0 "[ . 1 . 2 . 3]" 1
1916 2 96 GLN H 2 96 GLN HB2 . . 3.570 2.949 2.735 3.123 . 0 0 "[ . 1 . 2 . 3]" 1
1917 2 41 LEU HA 2 41 LEU HG . . 3.900 3.189 2.874 3.687 . 0 0 "[ . 1 . 2 . 3]" 1
1918 2 97 GLU HB2 2 98 GLN H . . 3.400 3.037 2.465 3.494 0.094 21 0 "[ . 1 . 2 . 3]" 1
1919 2 97 GLU H 2 97 GLU HB2 . . 3.630 2.344 2.067 2.502 . 0 0 "[ . 1 . 2 . 3]" 1
1920 2 72 ARG HB2 2 73 ILE H . . 4.490 4.081 3.683 4.415 . 0 0 "[ . 1 . 2 . 3]" 1
1921 2 72 ARG H 2 72 ARG HB2 . . 4.100 2.663 2.286 3.296 . 0 0 "[ . 1 . 2 . 3]" 1
1922 2 76 ASP HA 2 79 TRP HB2 . . 4.250 2.726 2.020 3.615 . 0 0 "[ . 1 . 2 . 3]" 1
1923 2 82 ILE HG13 2 85 ILE H . . 4.750 3.981 3.714 4.215 . 0 0 "[ . 1 . 2 . 3]" 1
1924 2 82 ILE H 2 82 ILE HG13 . . 4.440 4.472 4.450 4.491 0.051 4 0 "[ . 1 . 2 . 3]" 1
1925 2 5 THR H 2 5 THR MG . . 3.800 2.182 1.950 3.214 . 0 0 "[ . 1 . 2 . 3]" 1
1926 2 5 THR MG 2 6 GLU H . . 3.810 3.859 3.758 3.920 0.110 4 0 "[ . 1 . 2 . 3]" 1
1927 2 5 THR HA 2 5 THR MG . . 3.320 2.475 2.334 3.231 . 0 0 "[ . 1 . 2 . 3]" 1
1928 2 5 THR MG 2 7 LEU H . . 4.400 4.152 2.822 4.404 0.004 15 0 "[ . 1 . 2 . 3]" 1
1929 2 42 GLN HB3 2 42 GLN HE21 . . 4.190 3.199 1.899 4.232 0.042 29 0 "[ . 1 . 2 . 3]" 1
1930 2 42 GLN HB3 2 43 LYS H . . 3.720 3.683 3.251 3.796 0.076 26 0 "[ . 1 . 2 . 3]" 1
1931 2 39 GLU HA 2 42 GLN HB3 . . 3.660 3.722 3.685 3.783 0.123 23 0 "[ . 1 . 2 . 3]" 1
1932 2 42 GLN HB3 2 42 GLN HE22 . . 4.630 3.914 3.422 4.520 . 0 0 "[ . 1 . 2 . 3]" 1
1933 2 54 ASN H 2 54 ASN HB3 . . 4.150 3.123 2.601 3.645 . 0 0 "[ . 1 . 2 . 3]" 1
1934 2 54 ASN HB3 2 55 ARG H . . 4.540 3.340 2.636 4.397 . 0 0 "[ . 1 . 2 . 3]" 1
1935 2 54 ASN HB3 2 57 ALA MB . . 4.470 4.323 3.447 4.572 0.102 7 0 "[ . 1 . 2 . 3]" 1
1936 2 58 ALA MB 2 85 ILE MG . . 2.940 2.967 2.947 3.003 0.063 2 0 "[ . 1 . 2 . 3]" 1
1937 2 55 ARG HA 2 58 ALA MB . . 3.220 2.854 2.467 3.198 . 0 0 "[ . 1 . 2 . 3]" 1
1938 2 58 ALA MB 2 59 ASP H . . 3.360 2.816 2.680 2.941 . 0 0 "[ . 1 . 2 . 3]" 1
1939 2 55 ARG HD2 2 58 ALA MB . . 4.660 4.368 3.736 4.756 0.096 24 0 "[ . 1 . 2 . 3]" 1
1940 2 58 ALA MB 2 85 ILE MD . . 3.060 2.089 1.953 2.283 . 0 0 "[ . 1 . 2 . 3]" 1
1941 2 58 ALA MB 2 61 LEU H . . 4.630 4.550 4.285 4.670 0.040 20 0 "[ . 1 . 2 . 3]" 1
1942 2 98 GLN HG2 2 99 GLN HG3 . . 3.480 3.547 3.528 3.575 0.095 14 0 "[ . 1 . 2 . 3]" 1
1943 2 98 GLN H 2 98 GLN HG2 . . 3.490 3.383 3.193 3.528 0.038 29 0 "[ . 1 . 2 . 3]" 1
1944 2 10 ALA HA 2 13 VAL HB . . 3.600 2.295 2.178 2.395 . 0 0 "[ . 1 . 2 . 3]" 1
1945 2 10 ALA HA 2 13 VAL H . . 3.990 2.975 2.872 3.106 . 0 0 "[ . 1 . 2 . 3]" 1
1946 2 36 SER HA 2 39 GLU HB3 . . 4.320 2.419 2.008 3.824 . 0 0 "[ . 1 . 2 . 3]" 1
1947 2 39 GLU HA 2 39 GLU HB3 . . 2.990 2.992 2.698 3.028 0.038 2 0 "[ . 1 . 2 . 3]" 1
1948 2 30 ASN H 2 30 ASN HB2 . . 3.760 2.972 2.441 3.846 0.086 4 0 "[ . 1 . 2 . 3]" 1
1949 2 30 ASN HB2 2 30 ASN HD21 . . 3.600 2.643 2.231 3.520 . 0 0 "[ . 1 . 2 . 3]" 1
1950 2 30 ASN HB2 2 30 ASN HD22 . . 3.860 3.669 3.517 3.956 0.096 23 0 "[ . 1 . 2 . 3]" 1
1951 2 13 VAL HA 2 16 GLU H . . 4.640 3.445 3.202 3.784 . 0 0 "[ . 1 . 2 . 3]" 1
1952 2 13 VAL HA 2 13 VAL MG2 . . 3.510 2.352 2.311 2.398 . 0 0 "[ . 1 . 2 . 3]" 1
1953 2 9 LYS HA 2 9 LYS HD2 . . 4.270 2.296 2.022 4.348 0.078 20 0 "[ . 1 . 2 . 3]" 1
1954 2 43 LYS HA 2 43 LYS HG2 . . 3.600 3.089 2.626 3.670 0.070 26 0 "[ . 1 . 2 . 3]" 1
1955 2 43 LYS H 2 43 LYS HG2 . . 4.400 3.630 2.031 4.391 . 0 0 "[ . 1 . 2 . 3]" 1
1956 2 43 LYS HG2 2 44 GLU H . . 4.760 4.608 3.784 4.877 0.117 18 0 "[ . 1 . 2 . 3]" 1
1957 2 20 LYS HA 2 20 LYS HG2 . . 3.820 2.853 2.066 3.620 . 0 0 "[ . 1 . 2 . 3]" 1
1958 2 20 LYS HA 2 20 LYS QD . . 3.490 3.431 2.493 3.635 0.145 12 0 "[ . 1 . 2 . 3]" 1
1959 2 46 ASN H 2 46 ASN HB2 . . 4.030 2.716 2.313 3.727 . 0 0 "[ . 1 . 2 . 3]" 1
1960 2 26 SER QB 2 27 LEU H . . 4.390 3.058 1.985 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
1961 2 26 SER H 2 26 SER QB . . 3.710 2.981 2.313 3.539 . 0 0 "[ . 1 . 2 . 3]" 1
1962 2 56 LYS QE 2 56 LYS QG . . 2.490 2.212 1.907 2.529 0.039 12 0 "[ . 1 . 2 . 3]" 1
1963 2 56 LYS QB 2 56 LYS QE . . 3.170 3.053 2.057 3.386 0.216 20 0 "[ . 1 . 2 . 3]" 1
1964 2 56 LYS QD 2 56 LYS QE . . 2.400 2.029 1.970 2.126 . 0 0 "[ . 1 . 2 . 3]" 1
1965 2 62 ILE H 2 62 ILE HB . . 4.180 2.364 2.213 2.892 . 0 0 "[ . 1 . 2 . 3]" 1
1966 2 73 ILE MG 2 74 SER H . . 4.480 2.684 2.010 3.220 . 0 0 "[ . 1 . 2 . 3]" 1
1967 2 73 ILE MD 2 73 ILE MG . . 3.540 2.451 2.089 3.283 . 0 0 "[ . 1 . 2 . 3]" 1
1968 2 73 ILE H 2 73 ILE MG . . 4.590 3.890 3.619 3.998 . 0 0 "[ . 1 . 2 . 3]" 1
1969 2 96 GLN HG3 2 97 GLU H . . 4.450 4.054 3.653 4.417 . 0 0 "[ . 1 . 2 . 3]" 1
1970 2 81 LEU HA 2 81 LEU MD2 . . 4.090 2.388 2.081 3.903 . 0 0 "[ . 1 . 2 . 3]" 1
1971 2 32 ILE HA 2 32 ILE MD . . 4.090 3.524 2.078 4.149 0.059 25 0 "[ . 1 . 2 . 3]" 1
1972 2 32 ILE HG12 2 32 ILE MG . . 3.440 2.508 2.087 3.252 . 0 0 "[ . 1 . 2 . 3]" 1
1973 2 89 ILE HA 2 89 ILE MD . . 3.910 3.895 3.681 4.045 0.135 27 0 "[ . 1 . 2 . 3]" 1
1974 2 98 GLN HA 2 99 GLN H . . 3.510 3.396 3.283 3.517 0.007 1 0 "[ . 1 . 2 . 3]" 1
1975 2 98 GLN HA 2 98 GLN HG2 . . 4.140 4.194 4.180 4.206 0.066 29 0 "[ . 1 . 2 . 3]" 1
1976 2 2 ASP HA 2 3 CYS H . . 3.510 2.512 2.105 3.530 0.020 23 0 "[ . 1 . 2 . 3]" 1
1977 2 92 LEU H 2 92 LEU MD2 . . 4.110 3.900 2.862 4.125 0.015 9 0 "[ . 1 . 2 . 3]" 1
1978 2 92 LEU HB3 2 92 LEU MD2 . . 3.480 3.261 3.252 3.276 . 0 0 "[ . 1 . 2 . 3]" 1
1979 2 92 LEU HB2 2 92 LEU MD2 . . 3.440 2.476 2.370 2.609 . 0 0 "[ . 1 . 2 . 3]" 1
1980 2 36 SER HA 2 36 SER HB2 . . 3.010 2.691 2.213 3.026 0.016 30 0 "[ . 1 . 2 . 3]" 1
1981 2 96 GLN HA 2 96 GLN HB3 . . 2.920 2.345 2.221 2.422 . 0 0 "[ . 1 . 2 . 3]" 1
1982 2 102 SER H 2 102 SER QB . . 3.780 3.007 2.301 3.542 . 0 0 "[ . 1 . 2 . 3]" 1
1983 2 29 LYS HG2 2 30 ASN H . . 4.780 4.651 4.303 4.873 0.093 12 0 "[ . 1 . 2 . 3]" 1
1984 2 29 LYS H 2 29 LYS HG2 . . 4.160 2.676 2.017 3.962 . 0 0 "[ . 1 . 2 . 3]" 1
1985 2 29 LYS QE 2 29 LYS HG2 . . 3.510 3.376 3.233 3.483 . 0 0 "[ . 1 . 2 . 3]" 1
1986 2 29 LYS HA 2 29 LYS HG2 . . 3.910 2.672 2.152 3.297 . 0 0 "[ . 1 . 2 . 3]" 1
1987 2 27 LEU H 2 27 LEU HG . . 3.790 2.482 1.887 3.827 0.037 8 0 "[ . 1 . 2 . 3]" 1
1988 2 27 LEU HG 2 28 VAL H . . 4.580 4.446 3.655 4.625 0.045 24 0 "[ . 1 . 2 . 3]" 1
1989 2 55 ARG QG 2 56 LYS H . . 4.680 4.209 3.823 4.566 . 0 0 "[ . 1 . 2 . 3]" 1
1990 2 55 ARG H 2 55 ARG QG . . 4.230 2.743 2.168 4.137 . 0 0 "[ . 1 . 2 . 3]" 1
1991 2 19 TYR HA 2 22 VAL MG2 . . 4.440 3.788 2.269 4.563 0.123 22 0 "[ . 1 . 2 . 3]" 1
1992 2 55 ARG HA 2 55 ARG HD3 . . 3.720 3.213 2.223 3.773 0.053 7 0 "[ . 1 . 2 . 3]" 1
1993 2 55 ARG HB3 2 55 ARG HD3 . . 3.720 3.417 2.253 3.796 0.076 9 0 "[ . 1 . 2 . 3]" 1
1994 2 49 LEU MD2 2 55 ARG HD3 . . 3.860 2.964 2.028 3.936 0.076 6 0 "[ . 1 . 2 . 3]" 1
1995 2 55 ARG HD3 2 58 ALA MB . . 5.120 4.684 3.297 5.185 0.065 28 0 "[ . 1 . 2 . 3]" 1
1996 2 55 ARG H 2 55 ARG HD3 . . 4.750 4.339 3.324 4.816 0.066 9 0 "[ . 1 . 2 . 3]" 1
1997 2 50 SER H 2 50 SER HB3 . . 4.070 3.421 2.341 4.013 . 0 0 "[ . 1 . 2 . 3]" 1
1998 2 50 SER HA 2 50 SER HB3 . . 2.880 2.459 2.290 2.972 0.092 11 0 "[ . 1 . 2 . 3]" 1
1999 2 91 LYS QD 2 91 LYS HG3 . . 2.400 2.148 2.137 2.203 . 0 0 "[ . 1 . 2 . 3]" 1
2000 2 91 LYS HA 2 91 LYS QD . . 3.900 3.578 3.332 3.923 0.023 16 0 "[ . 1 . 2 . 3]" 1
2001 2 91 LYS H 2 91 LYS QD . . 4.610 4.554 2.233 4.695 0.085 27 0 "[ . 1 . 2 . 3]" 1
2002 2 91 LYS QD 2 91 LYS QE . . 2.400 2.106 2.030 2.131 . 0 0 "[ . 1 . 2 . 3]" 1
2003 2 66 ASP H 2 66 ASP HB2 . . 4.210 2.543 2.109 3.163 . 0 0 "[ . 1 . 2 . 3]" 1
2004 2 77 GLU HA 2 77 GLU HG3 . . 3.400 2.822 2.453 3.366 . 0 0 "[ . 1 . 2 . 3]" 1
2005 2 89 ILE HG13 2 90 ALA H . . 4.610 3.163 2.771 3.774 . 0 0 "[ . 1 . 2 . 3]" 1
2006 2 49 LEU HA 2 49 LEU MD2 . . 4.260 3.949 3.305 4.145 . 0 0 "[ . 1 . 2 . 3]" 1
2007 2 56 LYS HA 2 56 LYS QG . . 3.420 2.264 2.144 2.455 . 0 0 "[ . 1 . 2 . 3]" 1
2008 2 56 LYS HA 2 59 ASP H . . 4.120 3.011 2.707 3.291 . 0 0 "[ . 1 . 2 . 3]" 1
2009 2 56 LYS HA 2 59 ASP HB2 . . 4.010 2.165 1.981 2.613 . 0 0 "[ . 1 . 2 . 3]" 1
2010 2 59 ASP H 2 59 ASP HB3 . . 3.600 3.238 2.510 3.646 0.046 20 0 "[ . 1 . 2 . 3]" 1
2011 2 59 ASP HB3 2 60 LYS H . . 3.870 3.092 2.385 3.778 . 0 0 "[ . 1 . 2 . 3]" 1
2012 2 56 LYS HA 2 59 ASP HB3 . . 3.970 3.050 2.131 3.731 . 0 0 "[ . 1 . 2 . 3]" 1
2013 2 11 VAL H 2 11 VAL HB . . 4.060 2.371 2.252 2.599 . 0 0 "[ . 1 . 2 . 3]" 1
2014 2 9 LYS HD3 2 9 LYS QE . . 2.430 2.386 2.175 2.480 0.050 25 0 "[ . 1 . 2 . 3]" 1
2015 2 9 LYS HB2 2 9 LYS QE . . 3.560 3.520 2.532 3.621 0.061 3 0 "[ . 1 . 2 . 3]" 1
2016 2 9 LYS HB3 2 9 LYS QE . . 2.850 2.288 1.989 2.674 . 0 0 "[ . 1 . 2 . 3]" 1
2017 2 9 LYS QE 2 9 LYS QG . . 3.390 2.391 2.151 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
2018 2 14 LEU HA 2 17 ASN HB3 . . 4.410 3.844 2.578 4.447 0.037 4 0 "[ . 1 . 2 . 3]" 1
2019 2 17 ASN H 2 17 ASN HB3 . . 3.940 2.722 2.183 3.435 . 0 0 "[ . 1 . 2 . 3]" 1
2020 2 43 LYS HA 2 43 LYS QE . . 4.800 4.249 2.193 4.818 0.018 28 0 "[ . 1 . 2 . 3]" 1
2021 2 43 LYS HB2 2 43 LYS QE . . 4.340 3.650 2.306 4.206 . 0 0 "[ . 1 . 2 . 3]" 1
2022 2 43 LYS HD3 2 43 LYS QE . . 2.730 2.266 2.077 2.551 . 0 0 "[ . 1 . 2 . 3]" 1
2023 2 43 LYS HB3 2 43 LYS QE . . 3.660 3.364 2.287 3.746 0.086 12 0 "[ . 1 . 2 . 3]" 1
2024 2 43 LYS QE 2 43 LYS HG2 . . 3.330 2.545 2.054 3.387 0.057 26 0 "[ . 1 . 2 . 3]" 1
2025 2 24 LYS QB 2 24 LYS HD3 . . 3.260 2.622 2.286 3.192 . 0 0 "[ . 1 . 2 . 3]" 1
2026 2 28 VAL HA 2 28 VAL MG2 . . 3.160 2.411 2.221 2.687 . 0 0 "[ . 1 . 2 . 3]" 1
2027 2 95 GLU HG3 2 96 GLN H . . 4.570 4.623 4.575 4.673 0.103 6 0 "[ . 1 . 2 . 3]" 1
2028 2 88 PRO HB2 2 89 ILE H . . 4.390 3.296 3.046 3.733 . 0 0 "[ . 1 . 2 . 3]" 1
2029 2 6 GLU H 2 6 GLU HG2 . . 4.080 2.781 2.474 3.489 . 0 0 "[ . 1 . 2 . 3]" 1
2030 2 6 GLU HG2 2 7 LEU H . . 4.240 2.917 2.340 3.595 . 0 0 "[ . 1 . 2 . 3]" 1
2031 2 23 SER H 2 23 SER QB . . 3.080 2.467 2.191 3.097 0.017 21 0 "[ . 1 . 2 . 3]" 1
2032 2 90 ALA MB 2 91 LYS H . . 3.890 2.899 2.634 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
2033 2 7 LEU HA 2 7 LEU MD1 . . 3.420 3.336 3.143 3.426 0.006 8 0 "[ . 1 . 2 . 3]" 1
2034 2 7 LEU HA 2 10 ALA H . . 3.750 3.234 2.907 3.440 . 0 0 "[ . 1 . 2 . 3]" 1
2035 2 7 LEU HA 2 7 LEU HG . . 3.780 3.764 3.713 3.798 0.018 19 0 "[ . 1 . 2 . 3]" 1
2036 2 13 VAL H 2 13 VAL MG1 . . 3.910 3.773 3.730 3.830 . 0 0 "[ . 1 . 2 . 3]" 1
2037 2 13 VAL HA 2 13 VAL MG1 . . 3.110 2.650 2.565 2.720 . 0 0 "[ . 1 . 2 . 3]" 1
2038 2 13 VAL MG1 2 14 LEU H . . 3.730 3.157 2.900 3.478 . 0 0 "[ . 1 . 2 . 3]" 1
2039 2 63 GLN HB2 2 63 GLN HG2 . . 2.940 2.672 2.451 3.011 0.071 6 0 "[ . 1 . 2 . 3]" 1
2040 2 63 GLN HA 2 63 GLN HG2 . . 3.310 2.551 2.281 3.130 . 0 0 "[ . 1 . 2 . 3]" 1
2041 2 60 LYS HA 2 60 LYS HG2 . . 3.490 2.424 2.161 2.705 . 0 0 "[ . 1 . 2 . 3]" 1
2042 2 60 LYS QE 2 60 LYS HG2 . . 3.340 3.075 2.124 3.427 0.087 7 0 "[ . 1 . 2 . 3]" 1
2043 2 52 THR HA 2 55 ARG HD2 . . 4.890 4.776 4.401 4.967 0.077 29 0 "[ . 1 . 2 . 3]" 1
2044 2 52 THR HA 2 55 ARG HB3 . . 3.930 3.797 2.936 3.992 0.062 17 0 "[ . 1 . 2 . 3]" 1
2045 2 89 ILE HB 2 89 ILE MD . . 3.710 2.272 2.172 2.443 . 0 0 "[ . 1 . 2 . 3]" 1
2046 2 98 GLN HB3 2 99 GLN H . . 4.180 4.016 3.860 4.187 0.007 5 0 "[ . 1 . 2 . 3]" 1
2047 2 24 LYS HA 2 24 LYS HD3 . . 4.090 3.065 2.163 4.100 0.010 14 0 "[ . 1 . 2 . 3]" 1
2048 2 95 GLU H 2 95 GLU HB2 . . 3.810 2.021 1.917 2.590 . 0 0 "[ . 1 . 2 . 3]" 1
2049 2 92 LEU HA 2 95 GLU HB2 . . 3.330 2.313 2.086 3.351 0.021 11 0 "[ . 1 . 2 . 3]" 1
2050 2 91 LYS HA 2 91 LYS HG2 . . 4.090 2.456 2.016 4.165 0.075 11 0 "[ . 1 . 2 . 3]" 1
2051 2 91 LYS H 2 91 LYS HG2 . . 3.730 3.453 2.768 3.866 0.136 16 0 "[ . 1 . 2 . 3]" 1
2052 2 91 LYS QD 2 91 LYS HG2 . . 2.400 2.403 2.315 2.423 0.023 8 0 "[ . 1 . 2 . 3]" 1
2053 2 67 ALA MB 2 68 ASN H . . 3.520 2.926 2.534 3.494 . 0 0 "[ . 1 . 2 . 3]" 1
2054 2 67 ALA H 2 67 ALA MB . . 3.230 2.254 2.165 2.935 . 0 0 "[ . 1 . 2 . 3]" 1
2055 2 85 ILE HB 2 86 THR H . . 4.380 2.559 2.248 2.855 . 0 0 "[ . 1 . 2 . 3]" 1
2056 2 11 VAL HA 2 11 VAL MG2 . . 3.620 2.367 2.246 2.507 . 0 0 "[ . 1 . 2 . 3]" 1
2057 2 8 GLU HA 2 11 VAL MG2 . . 3.630 3.401 2.617 3.642 0.012 14 0 "[ . 1 . 2 . 3]" 1
2058 2 11 VAL H 2 11 VAL MG2 . . 3.440 2.242 1.998 2.402 . 0 0 "[ . 1 . 2 . 3]" 1
2059 2 79 TRP HB3 2 80 THR H . . 4.370 2.862 2.642 3.121 . 0 0 "[ . 1 . 2 . 3]" 1
2060 2 41 LEU HB2 2 42 GLN H . . 4.710 3.187 2.493 3.682 . 0 0 "[ . 1 . 2 . 3]" 1
2061 2 45 LEU HB3 2 46 ASN H . . 4.740 4.219 2.763 4.525 . 0 0 "[ . 1 . 2 . 3]" 1
2062 2 57 ALA MB 2 60 LYS QB . . 4.520 4.358 4.009 4.525 0.005 16 0 "[ . 1 . 2 . 3]" 1
2063 2 57 ALA MB 2 58 ALA H . . 3.180 2.506 2.377 2.690 . 0 0 "[ . 1 . 2 . 3]" 1
2064 2 57 ALA H 2 57 ALA MB . . 2.990 2.243 2.185 2.308 . 0 0 "[ . 1 . 2 . 3]" 1
2065 2 61 LEU HA 2 61 LEU MD1 . . 3.990 3.885 3.815 3.938 . 0 0 "[ . 1 . 2 . 3]" 1
2066 2 61 LEU HA 2 64 ASN HB3 . . 4.490 2.684 2.212 4.129 . 0 0 "[ . 1 . 2 . 3]" 1
2067 2 61 LEU HA 2 61 LEU MD2 . . 3.500 2.061 2.005 2.151 . 0 0 "[ . 1 . 2 . 3]" 1
2068 2 61 LEU HA 2 61 LEU HG . . 3.950 2.872 2.580 3.297 . 0 0 "[ . 1 . 2 . 3]" 1
2069 2 61 LEU HA 2 64 ASN H . . 4.170 3.372 2.969 3.702 . 0 0 "[ . 1 . 2 . 3]" 1
2070 2 94 HIS HB3 2 95 GLU H . . 4.780 2.813 2.405 4.239 . 0 0 "[ . 1 . 2 . 3]" 1
2071 2 98 GLN HB2 2 99 GLN H . . 4.220 4.280 4.227 4.310 0.090 28 0 "[ . 1 . 2 . 3]" 1
2072 2 39 GLU HA 2 42 GLN H . . 4.170 3.220 2.639 3.539 . 0 0 "[ . 1 . 2 . 3]" 1
2073 2 45 LEU HA 2 45 LEU MD1 . . 4.240 3.585 2.177 3.992 . 0 0 "[ . 1 . 2 . 3]" 1
2074 2 45 LEU HB2 2 45 LEU MD1 . . 3.470 2.292 2.047 3.219 . 0 0 "[ . 1 . 2 . 3]" 1
2075 2 45 LEU H 2 45 LEU MD1 . . 4.380 3.336 2.280 4.391 0.011 5 0 "[ . 1 . 2 . 3]" 1
2076 2 45 LEU HB3 2 45 LEU MD1 . . 3.420 2.712 2.154 3.177 . 0 0 "[ . 1 . 2 . 3]" 1
2077 2 45 LEU MD1 2 46 ASN H . . 5.500 5.066 4.042 5.563 0.063 1 0 "[ . 1 . 2 . 3]" 1
2078 2 42 GLN HA 2 42 GLN HG3 . . 3.540 3.344 2.598 3.628 0.088 9 0 "[ . 1 . 2 . 3]" 1
2079 2 42 GLN H 2 42 GLN HG3 . . 3.780 3.255 2.365 3.857 0.077 10 0 "[ . 1 . 2 . 3]" 1
2080 2 42 GLN HE22 2 42 GLN HG3 . . 4.050 3.792 3.465 4.097 0.047 19 0 "[ . 1 . 2 . 3]" 1
2081 2 25 TYR H 2 25 TYR HB3 . . 3.940 3.335 2.492 3.966 0.026 19 0 "[ . 1 . 2 . 3]" 1
2082 2 29 LYS HB2 2 30 ASN H . . 4.100 3.106 2.028 4.201 0.101 11 0 "[ . 1 . 2 . 3]" 1
2083 2 29 LYS H 2 29 LYS HB2 . . 3.500 2.654 1.961 3.563 0.063 23 0 "[ . 1 . 2 . 3]" 1
2084 2 10 ALA HA 2 13 VAL MG2 . . 3.620 2.789 2.698 2.857 . 0 0 "[ . 1 . 2 . 3]" 1
2085 2 10 ALA HA 2 13 VAL MG1 . . 4.000 3.721 3.608 3.861 . 0 0 "[ . 1 . 2 . 3]" 1
2086 2 11 VAL HA 2 14 LEU HB3 . . 4.420 4.424 4.263 4.457 0.037 7 0 "[ . 1 . 2 . 3]" 1
2087 2 17 ASN H 2 17 ASN HB2 . . 4.100 2.465 1.990 3.569 . 0 0 "[ . 1 . 2 . 3]" 1
2088 2 27 LEU HB3 2 28 VAL H . . 4.640 2.110 1.795 3.506 . 0 0 "[ . 1 . 2 . 3]" 1
2089 2 17 ASN HD21 2 40 MET ME . . 4.380 3.139 1.981 4.398 0.018 29 0 "[ . 1 . 2 . 3]" 1
2090 2 52 THR HA 2 55 ARG HB2 . . 3.920 2.460 2.151 2.884 . 0 0 "[ . 1 . 2 . 3]" 1
2091 2 52 THR MG 2 56 LYS QD . . 4.060 3.360 2.215 4.082 0.022 17 0 "[ . 1 . 2 . 3]" 1
2092 2 72 ARG HB3 2 72 ARG HD2 . . 3.890 4.049 3.757 4.217 0.327 15 0 "[ . 1 . 2 . 3]" 1
2093 2 72 ARG HB2 2 72 ARG HD2 . . 3.730 3.513 3.141 3.791 0.061 14 0 "[ . 1 . 2 . 3]" 1
2094 2 72 ARG HA 2 72 ARG HD2 . . 3.880 3.447 2.504 3.976 0.096 13 0 "[ . 1 . 2 . 3]" 1
2095 2 72 ARG H 2 72 ARG HD2 . . 4.930 3.736 3.199 4.879 . 0 0 "[ . 1 . 2 . 3]" 1
2096 2 56 LYS QG 2 59 ASP HB3 . . 4.230 3.939 2.685 4.280 0.050 12 0 "[ . 1 . 2 . 3]" 1
2097 2 61 LEU MD2 2 62 ILE H . . 4.460 4.544 4.518 4.571 0.111 14 0 "[ . 1 . 2 . 3]" 1
2098 2 76 ASP HA 2 79 TRP HB3 . . 4.230 3.636 3.072 4.291 0.061 17 0 "[ . 1 . 2 . 3]" 1
2099 2 80 THR HA 2 83 GLY H . . 4.290 3.462 2.827 3.975 . 0 0 "[ . 1 . 2 . 3]" 1
2100 2 65 LEU MD1 2 80 THR MG . . 3.550 2.364 1.991 3.578 0.028 30 0 "[ . 1 . 2 . 3]" 1
2101 2 61 LEU MD2 2 84 GLY HA3 . . 4.080 2.369 2.093 2.775 . 0 0 "[ . 1 . 2 . 3]" 1
2102 2 7 LEU MD1 2 11 VAL H . . 4.980 4.033 3.642 4.558 . 0 0 "[ . 1 . 2 . 3]" 1
2103 2 13 VAL HA 2 16 GLU HB2 . . 5.100 3.145 2.300 3.757 . 0 0 "[ . 1 . 2 . 3]" 1
2104 2 30 ASN HB2 2 31 LYS H . . 4.660 3.996 2.757 4.679 0.019 15 0 "[ . 1 . 2 . 3]" 1
2105 2 42 GLN HA 2 49 LEU MD2 . . 4.420 3.646 2.352 4.462 0.042 5 0 "[ . 1 . 2 . 3]" 1
2106 2 39 GLU HA 2 39 GLU HG2 . . 3.660 3.209 2.737 3.723 0.063 15 0 "[ . 1 . 2 . 3]" 1
2107 2 39 GLU HG2 2 43 LYS QE . . 4.440 3.685 2.636 4.490 0.050 26 0 "[ . 1 . 2 . 3]" 1
2108 2 42 GLN HE21 2 55 ARG HD2 . . 4.180 3.907 2.548 4.265 0.085 15 0 "[ . 1 . 2 . 3]" 1
2109 2 42 GLN HE21 2 55 ARG HD3 . . 4.180 3.622 2.577 4.279 0.099 26 0 "[ . 1 . 2 . 3]" 1
2110 2 42 GLN HE22 2 55 ARG HD3 . . 4.540 3.374 2.326 4.587 0.047 21 0 "[ . 1 . 2 . 3]" 1
2111 2 42 GLN HE22 2 55 ARG HD2 . . 4.490 3.477 2.102 4.523 0.033 14 0 "[ . 1 . 2 . 3]" 1
2112 2 72 ARG QG 2 73 ILE H . . 5.310 3.855 3.046 4.327 . 0 0 "[ . 1 . 2 . 3]" 1
2113 2 17 ASN HA 2 20 LYS HB2 . . 4.830 2.755 2.081 3.717 . 0 0 "[ . 1 . 2 . 3]" 1
2114 2 20 LYS HB2 2 20 LYS QD . . 3.570 2.753 2.029 3.580 0.010 8 0 "[ . 1 . 2 . 3]" 1
2115 2 20 LYS HB2 2 20 LYS QE . . 4.140 3.153 2.039 4.178 0.038 13 0 "[ . 1 . 2 . 3]" 1
2116 2 30 ASN HB3 2 31 LYS H . . 4.570 3.707 1.921 4.637 0.067 4 0 "[ . 1 . 2 . 3]" 1
2117 2 60 LYS HA 2 63 GLN HB3 . . 5.500 3.694 2.656 4.716 . 0 0 "[ . 1 . 2 . 3]" 1
2118 2 99 GLN HG2 2 100 SER H . . 5.500 5.214 5.076 5.332 . 0 0 "[ . 1 . 2 . 3]" 1
2119 2 82 ILE MD 2 85 ILE H . . 5.500 5.350 5.133 5.513 0.013 3 0 "[ . 1 . 2 . 3]" 1
2120 2 92 LEU MD2 2 96 GLN H . . 5.500 4.196 3.396 5.522 0.022 10 0 "[ . 1 . 2 . 3]" 1
2121 2 58 ALA HA 2 61 LEU MD1 . . 3.770 2.186 2.001 2.350 . 0 0 "[ . 1 . 2 . 3]" 1
2122 2 34 LYS HA 2 37 PHE QB . . 4.060 2.406 2.050 3.319 . 0 0 "[ . 1 . 2 . 3]" 1
2123 2 21 TYR H 2 40 MET ME . . 5.500 4.258 3.432 5.396 . 0 0 "[ . 1 . 2 . 3]" 1
2124 2 63 GLN HB3 2 63 GLN HE21 . . 3.910 2.647 1.953 3.918 0.008 9 0 "[ . 1 . 2 . 3]" 1
2125 2 91 LYS HA 2 94 HIS H . . 4.150 3.870 3.617 4.171 0.021 14 0 "[ . 1 . 2 . 3]" 1
2126 2 57 ALA MB 2 85 ILE HA . . 3.910 3.689 3.048 3.949 0.039 22 0 "[ . 1 . 2 . 3]" 1
2127 2 86 THR MG 2 90 ALA HA . . 4.000 3.361 2.740 3.874 . 0 0 "[ . 1 . 2 . 3]" 1
2128 2 41 LEU HA 2 44 GLU HB2 . . 3.910 3.404 2.318 3.952 0.042 20 0 "[ . 1 . 2 . 3]" 1
2129 2 89 ILE H 2 90 ALA H . . 4.530 2.662 2.284 2.843 . 0 0 "[ . 1 . 2 . 3]" 1
2130 2 16 GLU HB2 2 17 ASN H . . 5.500 3.670 2.852 3.957 . 0 0 "[ . 1 . 2 . 3]" 1
2131 2 20 LYS HA 2 20 LYS QE . . 4.800 4.376 2.174 4.894 0.094 27 0 "[ . 1 . 2 . 3]" 1
2132 2 98 GLN HB2 2 98 GLN HE22 . . 4.740 3.550 3.426 3.669 . 0 0 "[ . 1 . 2 . 3]" 1
2133 2 55 ARG H 2 57 ALA H . . 5.370 4.202 3.816 4.550 . 0 0 "[ . 1 . 2 . 3]" 1
2134 2 38 ARG HA 2 41 LEU HB3 . . 4.610 4.589 4.163 4.681 0.071 1 0 "[ . 1 . 2 . 3]" 1
2135 2 35 SER H 2 36 SER H . . 4.780 2.735 2.361 3.004 . 0 0 "[ . 1 . 2 . 3]" 1
2136 2 24 LYS H 2 24 LYS HD2 . . 5.150 4.294 2.334 5.186 0.036 1 0 "[ . 1 . 2 . 3]" 1
2137 2 12 ILE HB 2 12 ILE MD . . 3.280 2.464 2.318 3.288 0.008 17 0 "[ . 1 . 2 . 3]" 1
2138 2 51 ASP QB 2 53 GLY H . . 4.880 3.356 1.802 4.871 . 0 0 "[ . 1 . 2 . 3]" 1
2139 2 48 MET ME 2 85 ILE MG . . 3.890 3.915 3.897 3.938 0.048 29 0 "[ . 1 . 2 . 3]" 1
2140 2 85 ILE HG13 2 85 ILE MG . . 3.520 3.232 3.203 3.250 . 0 0 "[ . 1 . 2 . 3]" 1
2141 2 85 ILE HG12 2 85 ILE MG . . 3.620 2.399 2.315 2.463 . 0 0 "[ . 1 . 2 . 3]" 1
2142 2 31 LYS QE 2 31 LYS HG3 . . 3.580 2.573 2.275 3.290 . 0 0 "[ . 1 . 2 . 3]" 1
2143 2 31 LYS H 2 31 LYS QD . . 4.450 3.887 1.992 4.518 0.068 10 0 "[ . 1 . 2 . 3]" 1
2144 2 72 ARG HB2 2 72 ARG HE . . 5.300 3.829 2.300 4.726 . 0 0 "[ . 1 . 2 . 3]" 1
2145 2 76 ASP HA 2 79 TRP H . . 5.380 3.263 2.495 3.826 . 0 0 "[ . 1 . 2 . 3]" 1
2146 2 58 ALA MB 2 61 LEU MD1 . . 3.590 3.433 2.951 3.600 0.010 28 0 "[ . 1 . 2 . 3]" 1
2147 2 63 GLN HA 2 63 GLN HE22 . . 5.500 4.639 3.223 5.593 0.093 9 0 "[ . 1 . 2 . 3]" 1
2148 2 9 LYS HB2 2 9 LYS HD2 . . 4.000 3.816 3.632 3.918 . 0 0 "[ . 1 . 2 . 3]" 1
2149 2 96 GLN HA 2 96 GLN HG3 . . 3.750 3.626 3.318 3.800 0.050 8 0 "[ . 1 . 2 . 3]" 1
2150 2 98 GLN HA 2 98 GLN HE22 . . 5.090 5.058 4.925 5.125 0.035 5 0 "[ . 1 . 2 . 3]" 1
2151 2 36 SER HB2 2 37 PHE H . . 5.490 3.706 2.723 4.521 . 0 0 "[ . 1 . 2 . 3]" 1
2152 2 85 ILE MG 2 86 THR HA . . 4.880 3.659 3.371 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
2153 2 88 PRO HD2 2 89 ILE H . . 5.290 3.037 2.859 3.347 . 0 0 "[ . 1 . 2 . 3]" 1
2154 2 29 LYS QD 2 29 LYS HG2 . . 2.480 2.173 2.121 2.209 . 0 0 "[ . 1 . 2 . 3]" 1
2155 2 55 ARG HA 2 55 ARG QG . . 3.470 2.790 2.097 3.159 . 0 0 "[ . 1 . 2 . 3]" 1
2156 2 60 LYS HG3 2 61 LEU H . . 5.070 4.921 4.768 5.061 . 0 0 "[ . 1 . 2 . 3]" 1
2157 2 74 SER HB3 2 76 ASP H . . 5.340 3.440 2.711 4.946 . 0 0 "[ . 1 . 2 . 3]" 1
2158 2 96 GLN HE21 2 96 GLN HG3 . . 3.280 3.340 3.175 3.414 0.134 5 0 "[ . 1 . 2 . 3]" 1
2159 2 96 GLN HA 2 96 GLN HE21 . . 3.880 3.673 2.970 3.954 0.074 9 0 "[ . 1 . 2 . 3]" 1
2160 2 96 GLN HB3 2 96 GLN HE21 . . 4.170 2.795 1.786 3.810 . 0 0 "[ . 1 . 2 . 3]" 1
2161 2 56 LYS HA 2 56 LYS QE . . 4.910 4.219 1.857 4.900 . 0 0 "[ . 1 . 2 . 3]" 1
2162 2 61 LEU HA 2 64 ASN HB2 . . 3.900 3.501 2.230 3.957 0.057 10 0 "[ . 1 . 2 . 3]" 1
2163 2 82 ILE HG13 2 82 ILE MG . . 3.320 3.203 3.166 3.238 . 0 0 "[ . 1 . 2 . 3]" 1
2164 2 3 CYS H 2 4 TYR H . . 4.230 2.870 1.887 4.258 0.028 30 0 "[ . 1 . 2 . 3]" 1
2165 2 56 LYS QB 2 59 ASP H . . 4.850 4.664 4.450 4.861 0.011 28 0 "[ . 1 . 2 . 3]" 1
2166 2 75 PHE HB2 2 76 ASP H . . 4.670 2.554 2.246 3.392 . 0 0 "[ . 1 . 2 . 3]" 1
2167 2 61 LEU MD1 2 84 GLY HA3 . . 4.220 2.464 2.209 2.729 . 0 0 "[ . 1 . 2 . 3]" 1
2168 2 90 ALA MB 2 91 LYS HA . . 4.740 4.142 3.922 4.359 . 0 0 "[ . 1 . 2 . 3]" 1
2169 2 17 ASN HA 2 20 LYS QD . . 5.250 3.817 2.107 5.259 0.009 2 0 "[ . 1 . 2 . 3]" 1
2170 2 27 LEU H 2 28 VAL H . . 4.430 4.380 3.792 4.509 0.079 3 0 "[ . 1 . 2 . 3]" 1
2171 2 27 LEU H 2 27 LEU MD2 . . 4.490 3.394 2.780 4.356 . 0 0 "[ . 1 . 2 . 3]" 1
2172 2 94 HIS HB2 2 95 GLU H . . 4.800 4.026 3.790 4.619 . 0 0 "[ . 1 . 2 . 3]" 1
2173 2 15 VAL H 2 16 GLU H . . 5.500 2.420 2.138 2.703 . 0 0 "[ . 1 . 2 . 3]" 1
2174 2 16 GLU H 2 17 ASN H . . 5.220 3.003 2.795 3.311 . 0 0 "[ . 1 . 2 . 3]" 1
2175 2 61 LEU HB2 2 62 ILE H . . 3.990 2.394 2.267 2.625 . 0 0 "[ . 1 . 2 . 3]" 1
2176 2 60 LYS H 2 62 ILE H . . 5.300 4.403 4.186 4.718 . 0 0 "[ . 1 . 2 . 3]" 1
2177 2 10 ALA MB 2 13 VAL MG1 . . 4.500 4.405 4.237 4.510 0.010 19 0 "[ . 1 . 2 . 3]" 1
2178 2 63 GLN H 2 63 GLN HG2 . . 4.490 3.926 2.851 4.509 0.019 25 0 "[ . 1 . 2 . 3]" 1
2179 2 60 LYS HG2 2 61 LEU H . . 4.240 4.277 4.134 4.341 0.101 20 0 "[ . 1 . 2 . 3]" 1
2180 2 98 GLN H 2 98 GLN HB3 . . 4.070 2.308 2.216 2.455 . 0 0 "[ . 1 . 2 . 3]" 1
2181 2 98 GLN HB3 2 98 GLN HE22 . . 5.010 4.908 4.788 4.998 . 0 0 "[ . 1 . 2 . 3]" 1
2182 2 96 GLN HG2 2 97 GLU H . . 4.530 4.584 4.479 4.657 0.127 2 0 "[ . 1 . 2 . 3]" 1
2183 2 65 LEU H 2 65 LEU MD2 . . 4.630 3.404 2.451 4.362 . 0 0 "[ . 1 . 2 . 3]" 1
2184 2 85 ILE H 2 85 ILE MG . . 4.480 3.872 3.852 3.891 . 0 0 "[ . 1 . 2 . 3]" 1
2185 2 61 LEU MD1 2 85 ILE H . . 4.510 2.830 2.616 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
2186 2 44 GLU H 2 46 ASN H . . 5.410 4.786 4.292 5.376 . 0 0 "[ . 1 . 2 . 3]" 1
2187 2 43 LYS HD2 2 44 GLU H . . 5.310 4.958 4.512 5.394 0.084 9 0 "[ . 1 . 2 . 3]" 1
2188 2 47 HIS H 2 49 LEU H . . 5.500 4.384 3.431 5.426 . 0 0 "[ . 1 . 2 . 3]" 1
2189 2 49 LEU H 2 50 SER H . . 4.890 4.152 2.436 4.505 . 0 0 "[ . 1 . 2 . 3]" 1
2190 2 54 ASN HB2 2 57 ALA MB . . 5.050 4.793 4.207 5.085 0.035 15 0 "[ . 1 . 2 . 3]" 1
2191 2 54 ASN HD22 2 57 ALA MB . . 4.590 4.070 2.983 4.620 0.030 8 0 "[ . 1 . 2 . 3]" 1
2192 2 45 LEU MD1 2 82 ILE MD . . 3.720 2.031 1.846 3.295 . 0 0 "[ . 1 . 2 . 3]" 1
2193 2 13 VAL HA 2 16 GLU HB3 . . 4.690 2.822 2.265 3.775 . 0 0 "[ . 1 . 2 . 3]" 1
2194 2 27 LEU HA 2 27 LEU MD1 . . 4.070 3.864 3.761 3.923 . 0 0 "[ . 1 . 2 . 3]" 1
2195 2 31 LYS HA 2 31 LYS QD . . 5.010 3.074 2.027 4.537 . 0 0 "[ . 1 . 2 . 3]" 1
2196 2 62 ILE MG 2 63 GLN H . . 3.900 3.425 3.147 3.906 0.006 21 0 "[ . 1 . 2 . 3]" 1
2197 2 4 TYR HB2 2 5 THR H . . 5.500 3.822 2.374 4.356 . 0 0 "[ . 1 . 2 . 3]" 1
2198 2 91 LYS HB2 2 91 LYS QD . . 3.540 3.183 2.397 3.382 . 0 0 "[ . 1 . 2 . 3]" 1
2199 2 91 LYS H 2 91 LYS HB2 . . 4.040 2.090 1.853 3.712 . 0 0 "[ . 1 . 2 . 3]" 1
2200 2 37 PHE H 2 38 ARG H . . 5.500 2.839 2.538 3.170 . 0 0 "[ . 1 . 2 . 3]" 1
2201 2 46 ASN HA 2 46 ASN HD22 . . 5.500 4.615 4.201 5.056 . 0 0 "[ . 1 . 2 . 3]" 1
2202 2 28 VAL H 2 28 VAL MG1 . . 4.050 3.135 1.899 4.092 0.042 20 0 "[ . 1 . 2 . 3]" 1
2203 2 66 ASP H 2 67 ALA H . . 5.390 2.964 2.124 3.997 . 0 0 "[ . 1 . 2 . 3]" 1
2204 2 29 LYS HG3 2 30 ASN H . . 5.500 4.978 4.165 5.587 0.087 28 0 "[ . 1 . 2 . 3]" 1
2205 2 15 VAL HA 2 18 PHE HB3 . . 4.810 2.418 2.141 2.722 . 0 0 "[ . 1 . 2 . 3]" 1
2206 2 40 MET HA 2 43 LYS H . . 5.500 3.399 2.944 4.076 . 0 0 "[ . 1 . 2 . 3]" 1
2207 2 29 LYS H 2 29 LYS QD . . 4.470 4.053 3.309 4.499 0.029 17 0 "[ . 1 . 2 . 3]" 1
2208 2 77 GLU H 2 77 GLU HG3 . . 5.060 3.675 2.374 4.571 . 0 0 "[ . 1 . 2 . 3]" 1
2209 2 77 GLU H 2 78 TYR H . . 5.500 2.754 2.318 3.094 . 0 0 "[ . 1 . 2 . 3]" 1
2210 2 62 ILE MD 2 63 GLN H . . 5.070 4.744 4.191 5.029 . 0 0 "[ . 1 . 2 . 3]" 1
2211 2 88 PRO HD3 2 89 ILE H . . 5.500 4.097 3.958 4.280 . 0 0 "[ . 1 . 2 . 3]" 1
2212 2 56 LYS QD 2 56 LYS QG . . 2.400 2.093 2.038 2.144 . 0 0 "[ . 1 . 2 . 3]" 1
2213 2 20 LYS H 2 20 LYS HG2 . . 5.080 3.786 2.068 4.660 . 0 0 "[ . 1 . 2 . 3]" 1
2214 2 72 ARG HB3 2 72 ARG HE . . 5.280 4.476 3.461 5.233 . 0 0 "[ . 1 . 2 . 3]" 1
2215 2 44 GLU H 2 44 GLU HG3 . . 5.500 3.579 2.387 4.296 . 0 0 "[ . 1 . 2 . 3]" 1
2216 2 44 GLU H 2 44 GLU HG2 . . 5.500 3.201 1.978 4.503 . 0 0 "[ . 1 . 2 . 3]" 1
2217 2 90 ALA HA 2 93 ILE H . . 5.320 3.146 2.617 3.525 . 0 0 "[ . 1 . 2 . 3]" 1
2218 2 96 GLN HB3 2 96 GLN HE22 . . 5.500 3.707 3.243 4.153 . 0 0 "[ . 1 . 2 . 3]" 1
2219 2 16 GLU HA 2 19 TYR HB3 . . 5.500 4.836 4.289 5.431 . 0 0 "[ . 1 . 2 . 3]" 1
2220 2 91 LYS HA 2 91 LYS QE . . 4.640 2.447 1.845 4.509 . 0 0 "[ . 1 . 2 . 3]" 1
2221 2 29 LYS HB3 2 29 LYS QD . . 3.200 2.678 2.267 3.144 . 0 0 "[ . 1 . 2 . 3]" 1
2222 2 77 GLU HA 2 77 GLU HG2 . . 3.980 2.781 2.368 3.144 . 0 0 "[ . 1 . 2 . 3]" 1
2223 2 39 GLU H 2 39 GLU HG2 . . 4.290 4.253 3.214 4.447 0.157 26 0 "[ . 1 . 2 . 3]" 1
2224 2 39 GLU HG2 2 43 LYS HD2 . . 4.100 2.802 2.049 4.137 0.037 12 0 "[ . 1 . 2 . 3]" 1
2225 2 31 LYS H 2 31 LYS HG3 . . 4.920 4.015 1.820 4.950 0.030 17 0 "[ . 1 . 2 . 3]" 1
2226 2 15 VAL HA 2 18 PHE HB2 . . 3.420 3.239 2.490 3.453 0.033 10 0 "[ . 1 . 2 . 3]" 1
2227 2 75 PHE HB3 2 76 ASP H . . 5.320 3.629 2.807 3.914 . 0 0 "[ . 1 . 2 . 3]" 1
2228 2 42 GLN HA 2 44 GLU H . . 5.390 4.798 3.898 5.419 0.029 15 0 "[ . 1 . 2 . 3]" 1
2229 2 42 GLN HA 2 45 LEU HB3 . . 5.320 4.781 3.179 5.355 0.035 28 0 "[ . 1 . 2 . 3]" 1
2230 2 42 GLN HA 2 42 GLN HE21 . . 5.420 3.977 1.843 5.283 . 0 0 "[ . 1 . 2 . 3]" 1
2231 2 82 ILE H 2 83 GLY H . . 4.980 2.623 2.253 2.864 . 0 0 "[ . 1 . 2 . 3]" 1
2232 2 54 ASN HA 2 57 ALA MB . . 4.010 2.694 2.147 3.362 . 0 0 "[ . 1 . 2 . 3]" 1
2233 2 61 LEU HB2 2 61 LEU MD1 . . 3.470 2.247 2.153 2.296 . 0 0 "[ . 1 . 2 . 3]" 1
2234 2 61 LEU HB2 2 61 LEU MD2 . . 3.490 3.186 3.146 3.237 . 0 0 "[ . 1 . 2 . 3]" 1
2235 2 39 GLU H 2 39 GLU HB3 . . 3.690 2.354 2.018 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
2236 2 63 GLN HA 2 63 GLN HE21 . . 4.980 4.009 2.639 4.998 0.018 17 0 "[ . 1 . 2 . 3]" 1
2237 2 92 LEU H 2 95 GLU H . . 5.100 4.828 4.714 5.099 . 0 0 "[ . 1 . 2 . 3]" 1
2238 2 27 LEU HB2 2 27 LEU MD1 . . 3.380 2.310 2.261 2.356 . 0 0 "[ . 1 . 2 . 3]" 1
2239 2 81 LEU H 2 81 LEU MD1 . . 5.500 4.229 3.357 4.350 . 0 0 "[ . 1 . 2 . 3]" 1
2240 2 32 ILE H 2 32 ILE HG12 . . 5.500 3.803 2.385 4.529 . 0 0 "[ . 1 . 2 . 3]" 1
2241 2 52 THR MG 2 56 LYS H . . 4.900 4.673 3.880 4.948 0.048 9 0 "[ . 1 . 2 . 3]" 1
2242 2 39 GLU HB2 2 40 MET H . . 5.500 3.957 3.267 4.422 . 0 0 "[ . 1 . 2 . 3]" 1
2243 2 60 LYS H 2 60 LYS HG3 . . 4.730 4.552 4.467 4.628 . 0 0 "[ . 1 . 2 . 3]" 1
2244 2 60 LYS H 2 60 LYS HG2 . . 4.520 4.393 4.308 4.478 . 0 0 "[ . 1 . 2 . 3]" 1
2245 2 57 ALA MB 2 60 LYS H . . 5.000 4.893 4.613 5.034 0.034 14 0 "[ . 1 . 2 . 3]" 1
2246 2 60 LYS H 2 63 GLN H . . 5.230 4.803 4.657 5.193 . 0 0 "[ . 1 . 2 . 3]" 1
2247 2 61 LEU H 2 61 LEU MD1 . . 4.110 3.358 3.167 3.566 . 0 0 "[ . 1 . 2 . 3]" 1
2248 2 61 LEU H 2 61 LEU MD2 . . 4.110 3.605 2.772 3.885 . 0 0 "[ . 1 . 2 . 3]" 1
2249 2 12 ILE MG 2 15 VAL MG1 . . 3.980 3.474 2.820 3.991 0.011 18 0 "[ . 1 . 2 . 3]" 1
2250 2 60 LYS HA 2 60 LYS QE . . 4.650 4.461 3.758 4.675 0.025 20 0 "[ . 1 . 2 . 3]" 1
2251 2 45 LEU HB2 2 82 ILE MD . . 4.470 4.261 3.146 4.570 0.100 7 0 "[ . 1 . 2 . 3]" 1
2252 2 85 ILE HA 2 85 ILE HG12 . . 4.130 2.613 2.544 2.676 . 0 0 "[ . 1 . 2 . 3]" 1
2253 2 65 LEU H 2 65 LEU HG . . 4.620 4.405 3.993 4.696 0.076 16 0 "[ . 1 . 2 . 3]" 1
2254 2 91 LYS HB3 2 91 LYS QD . . 3.380 2.380 2.197 3.432 0.052 21 0 "[ . 1 . 2 . 3]" 1
2255 2 4 TYR H 2 5 THR H . . 5.500 4.595 4.025 4.731 . 0 0 "[ . 1 . 2 . 3]" 1
2256 2 64 ASN H 2 65 LEU H . . 5.480 2.654 2.021 3.025 . 0 0 "[ . 1 . 2 . 3]" 1
2257 2 64 ASN HA 2 64 ASN HD21 . . 4.760 2.832 2.012 4.210 . 0 0 "[ . 1 . 2 . 3]" 1
2258 2 9 LYS HA 2 12 ILE MG . . 4.610 3.516 3.121 3.849 . 0 0 "[ . 1 . 2 . 3]" 1
2259 2 9 LYS HA 2 12 ILE HB . . 4.730 2.219 2.018 2.518 . 0 0 "[ . 1 . 2 . 3]" 1
2260 2 82 ILE HG13 2 83 GLY H . . 4.770 4.726 4.600 4.790 0.020 3 0 "[ . 1 . 2 . 3]" 1
2261 2 62 ILE MD 2 62 ILE MG . . 3.310 2.210 2.093 3.223 . 0 0 "[ . 1 . 2 . 3]" 1
2262 2 11 VAL HB 2 12 ILE H . . 5.070 2.598 2.440 2.809 . 0 0 "[ . 1 . 2 . 3]" 1
2263 2 20 LYS H 2 20 LYS QD . . 4.730 4.161 2.736 4.697 . 0 0 "[ . 1 . 2 . 3]" 1
2264 2 98 GLN HB2 2 98 GLN HE21 . . 4.240 2.650 2.136 2.838 . 0 0 "[ . 1 . 2 . 3]" 1
2265 2 66 ASP HB2 2 73 ILE MD . . 4.870 3.243 2.099 4.154 . 0 0 "[ . 1 . 2 . 3]" 1
2266 2 42 GLN HB2 2 42 GLN HE22 . . 5.500 4.643 3.445 5.086 . 0 0 "[ . 1 . 2 . 3]" 1
2267 2 48 MET ME 2 86 THR MG . . 4.470 2.853 2.305 3.567 . 0 0 "[ . 1 . 2 . 3]" 1
2268 2 24 LYS H 2 24 LYS HD3 . . 5.070 4.026 2.062 5.037 . 0 0 "[ . 1 . 2 . 3]" 1
2269 2 95 GLU HB2 2 96 GLN H . . 4.330 3.013 2.575 3.998 . 0 0 "[ . 1 . 2 . 3]" 1
2270 2 96 GLN HB2 2 97 GLU H . . 4.940 2.642 2.231 2.952 . 0 0 "[ . 1 . 2 . 3]" 1
2271 2 96 GLN HB3 2 97 GLU H . . 4.820 3.832 3.438 4.109 . 0 0 "[ . 1 . 2 . 3]" 1
2272 2 57 ALA MB 2 59 ASP H . . 4.380 4.400 4.332 4.433 0.053 19 0 "[ . 1 . 2 . 3]" 1
2273 2 62 ILE H 2 64 ASN H . . 5.490 4.274 3.885 4.622 . 0 0 "[ . 1 . 2 . 3]" 1
2274 2 25 TYR HB2 2 26 SER H . . 5.350 4.275 3.296 4.709 . 0 0 "[ . 1 . 2 . 3]" 1
2275 2 59 ASP HA 2 63 GLN H . . 5.270 4.041 3.585 4.738 . 0 0 "[ . 1 . 2 . 3]" 1
2276 2 61 LEU HA 2 63 GLN H . . 5.500 4.325 4.088 4.592 . 0 0 "[ . 1 . 2 . 3]" 1
2277 2 48 MET QB 2 49 LEU H . . 5.200 3.188 2.309 3.969 . 0 0 "[ . 1 . 2 . 3]" 1
2278 2 66 ASP HB2 2 67 ALA H . . 5.360 4.407 3.476 4.634 . 0 0 "[ . 1 . 2 . 3]" 1
2279 2 18 PHE HZ 2 75 PHE H . . 5.360 4.095 3.327 5.269 . 0 0 "[ . 1 . 2 . 3]" 1
2280 2 28 VAL MG1 2 30 ASN H . . 4.450 3.564 1.772 4.469 0.019 5 0 "[ . 1 . 2 . 3]" 1
2281 2 41 LEU HA 2 45 LEU H . . 5.140 3.580 2.749 4.073 . 0 0 "[ . 1 . 2 . 3]" 1
2282 2 4 TYR QD 2 5 THR H . . 4.970 3.945 2.904 4.146 . 0 0 "[ . 1 . 2 . 3]" 1
2283 2 4 TYR HA 2 4 TYR QD . . 4.210 2.305 2.086 3.020 . 0 0 "[ . 1 . 2 . 3]" 1
2284 2 4 TYR HA 2 4 TYR QE . . 5.250 4.463 4.315 4.604 . 0 0 "[ . 1 . 2 . 3]" 1
2285 2 79 TRP HA 2 79 TRP HD1 . . 4.350 2.479 2.314 2.585 . 0 0 "[ . 1 . 2 . 3]" 1
2286 2 21 TYR QD 2 22 VAL HA . . 4.770 3.476 2.330 4.107 . 0 0 "[ . 1 . 2 . 3]" 1
2287 2 47 HIS HA 2 47 HIS HD2 . . 4.580 3.090 2.712 4.110 . 0 0 "[ . 1 . 2 . 3]" 1
2288 2 25 TYR H 2 25 TYR QD . . 4.570 3.427 1.988 4.505 . 0 0 "[ . 1 . 2 . 3]" 1
2289 2 79 TRP H 2 79 TRP HD1 . . 5.410 3.635 3.169 3.961 . 0 0 "[ . 1 . 2 . 3]" 1
2290 2 46 ASN HD22 2 47 HIS HE1 . . 5.210 4.576 2.631 5.245 0.035 5 0 "[ . 1 . 2 . 3]" 1
2291 2 46 ASN HD21 2 47 HIS HE1 . . 5.500 3.407 2.832 4.602 . 0 0 "[ . 1 . 2 . 3]" 1
2292 2 4 TYR QD 2 5 THR MG . . 4.910 4.946 4.830 4.973 0.063 17 0 "[ . 1 . 2 . 3]" 1
2293 2 4 TYR QD 2 9 LYS HD2 . . 4.990 3.588 2.742 5.015 0.025 20 0 "[ . 1 . 2 . 3]" 1
2294 2 4 TYR QE 2 12 ILE MG . . 5.160 5.048 4.272 5.202 0.042 11 0 "[ . 1 . 2 . 3]" 1
2295 2 4 TYR QE 2 12 ILE HG13 . . 5.430 4.608 3.845 5.037 . 0 0 "[ . 1 . 2 . 3]" 1
2296 2 4 TYR QD 2 12 ILE HG13 . . 4.540 4.292 3.188 4.587 0.047 11 0 "[ . 1 . 2 . 3]" 1
2297 2 4 TYR QD 2 12 ILE MD . . 4.470 2.278 2.040 3.122 . 0 0 "[ . 1 . 2 . 3]" 1
2298 2 4 TYR QE 2 12 ILE MD . . 4.300 2.358 2.082 2.874 . 0 0 "[ . 1 . 2 . 3]" 1
2299 2 25 TYR HA 2 25 TYR QD . . 4.050 2.742 2.322 3.139 . 0 0 "[ . 1 . 2 . 3]" 1
2300 2 19 TYR QD 2 20 LYS H . . 5.500 4.572 4.301 4.971 . 0 0 "[ . 1 . 2 . 3]" 1
2301 2 18 PHE QD 2 19 TYR QD . . 4.440 3.327 2.440 4.328 . 0 0 "[ . 1 . 2 . 3]" 1
2302 2 16 GLU HA 2 19 TYR QD . . 5.090 3.780 2.857 5.097 0.007 18 0 "[ . 1 . 2 . 3]" 1
2303 2 79 TRP HA 2 79 TRP HE3 . . 4.890 4.690 4.533 4.840 . 0 0 "[ . 1 . 2 . 3]" 1
2304 2 19 TYR HA 2 19 TYR QD . . 4.510 2.705 2.141 3.109 . 0 0 "[ . 1 . 2 . 3]" 1
2305 2 19 TYR HA 2 19 TYR QE . . 5.300 4.532 4.264 4.779 . 0 0 "[ . 1 . 2 . 3]" 1
2306 2 15 VAL MG1 2 19 TYR QE . . 3.740 2.785 2.095 3.764 0.024 22 0 "[ . 1 . 2 . 3]" 1
2307 2 15 VAL MG1 2 19 TYR QD . . 4.150 2.740 2.117 3.849 . 0 0 "[ . 1 . 2 . 3]" 1
2308 2 15 VAL MG2 2 19 TYR QE . . 4.890 3.547 2.107 4.694 . 0 0 "[ . 1 . 2 . 3]" 1
2309 2 21 TYR QE 2 22 VAL MG2 . . 4.510 4.223 3.431 4.577 0.067 5 0 "[ . 1 . 2 . 3]" 1
2310 2 18 PHE QE 2 19 TYR QE . . 4.960 4.130 2.740 4.955 . 0 0 "[ . 1 . 2 . 3]" 1
2311 2 18 PHE QE 2 19 TYR QD . . 4.990 4.460 3.469 5.002 0.012 22 0 "[ . 1 . 2 . 3]" 1
2312 2 4 TYR HA 2 5 THR MG . . 4.750 3.586 3.317 3.918 . 0 0 "[ . 1 . 2 . 3]" 1
2313 2 9 LYS HD2 2 12 ILE MD . . 4.990 2.767 2.143 5.011 0.021 20 0 "[ . 1 . 2 . 3]" 1
2314 2 10 ALA MB 2 11 VAL H . . 4.270 2.608 2.503 2.748 . 0 0 "[ . 1 . 2 . 3]" 1
2315 2 79 TRP HA 2 82 ILE MG . . 4.760 2.718 2.468 2.882 . 0 0 "[ . 1 . 2 . 3]" 1
2316 2 10 ALA HA 2 14 LEU MD2 . . 5.500 4.193 4.000 4.413 . 0 0 "[ . 1 . 2 . 3]" 1
2317 2 11 VAL MG1 2 12 ILE MD . . 4.630 4.506 3.319 4.648 0.018 9 0 "[ . 1 . 2 . 3]" 1
2318 2 15 VAL HB 2 16 GLU H . . 4.920 3.336 2.661 4.277 . 0 0 "[ . 1 . 2 . 3]" 1
2319 2 11 VAL MG1 2 12 ILE HA . . 4.770 3.606 3.456 3.874 . 0 0 "[ . 1 . 2 . 3]" 1
2320 2 62 ILE MG 2 63 GLN HA . . 4.480 3.732 3.239 4.140 . 0 0 "[ . 1 . 2 . 3]" 1
2321 2 17 ASN HA 2 20 LYS HG2 . . 5.410 4.128 2.113 5.411 0.001 29 0 "[ . 1 . 2 . 3]" 1
2322 2 5 THR HA 2 6 GLU QB . . 5.220 4.372 4.205 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
2323 2 18 PHE HA 2 18 PHE QE . . 4.990 4.714 4.446 5.002 0.012 9 0 "[ . 1 . 2 . 3]" 1
2324 2 18 PHE HA 2 18 PHE QD . . 4.430 2.693 2.218 3.168 . 0 0 "[ . 1 . 2 . 3]" 1
2325 2 17 ASN HA 2 20 LYS QE . . 5.350 3.191 1.750 4.806 . 0 0 "[ . 1 . 2 . 3]" 1
2326 2 21 TYR QE 2 22 VAL HA . . 4.760 4.366 3.523 4.799 0.039 11 0 "[ . 1 . 2 . 3]" 1
2327 2 66 ASP HB3 2 73 ILE MD . . 4.680 3.733 2.991 4.683 0.003 26 0 "[ . 1 . 2 . 3]" 1
2328 2 66 ASP HA 2 73 ILE MD . . 5.080 4.619 3.932 5.151 0.071 11 0 "[ . 1 . 2 . 3]" 1
2329 2 52 THR MG 2 56 LYS QE . . 4.890 2.975 1.996 4.278 . 0 0 "[ . 1 . 2 . 3]" 1
2330 2 47 HIS H 2 47 HIS HD2 . . 5.310 4.370 2.182 4.782 . 0 0 "[ . 1 . 2 . 3]" 1
2331 2 69 HIS HA 2 69 HIS HD2 . . 5.130 3.507 2.332 4.889 . 0 0 "[ . 1 . 2 . 3]" 1
2332 2 41 LEU HB2 2 82 ILE MD . . 4.950 4.814 4.176 5.002 0.052 14 0 "[ . 1 . 2 . 3]" 1
2333 2 41 LEU MD2 2 82 ILE MD . . 4.040 2.164 1.961 3.862 . 0 0 "[ . 1 . 2 . 3]" 1
2334 2 82 ILE MD 2 85 ILE HG13 . . 4.950 4.700 4.342 4.952 0.002 22 0 "[ . 1 . 2 . 3]" 1
2335 2 40 MET ME 2 78 TYR QE . . 4.670 2.579 2.016 3.071 . 0 0 "[ . 1 . 2 . 3]" 1
2336 2 40 MET HA 2 43 LYS HB2 . . 5.010 3.112 2.428 4.221 . 0 0 "[ . 1 . 2 . 3]" 1
2337 2 18 PHE QD 2 21 TYR H . . 4.280 5.633 4.986 6.130 1.850 21 30 [********************+**-******] 1
2338 2 75 PHE H 2 75 PHE QD . . 5.130 2.620 2.240 3.535 . 0 0 "[ . 1 . 2 . 3]" 1
2339 2 75 PHE QD 2 76 ASP H . . 5.050 3.947 3.373 4.757 . 0 0 "[ . 1 . 2 . 3]" 1
2340 2 75 PHE HA 2 75 PHE QD . . 4.290 2.725 2.491 2.977 . 0 0 "[ . 1 . 2 . 3]" 1
2341 2 49 LEU MD1 2 54 ASN H . . 5.350 4.738 3.835 5.375 0.025 12 0 "[ . 1 . 2 . 3]" 1
2342 2 18 PHE HZ 2 75 PHE HA . . 5.220 4.303 3.566 5.264 0.044 9 0 "[ . 1 . 2 . 3]" 1
2343 2 38 ARG QD 2 55 ARG HB2 . . 5.220 5.175 4.740 5.311 0.091 13 0 "[ . 1 . 2 . 3]" 1
2344 2 38 ARG QD 2 55 ARG HB3 . . 5.410 3.910 3.209 5.003 . 0 0 "[ . 1 . 2 . 3]" 1
2345 2 59 ASP HA 2 62 ILE MG . . 4.450 3.721 3.301 4.482 0.032 16 0 "[ . 1 . 2 . 3]" 1
2346 2 75 PHE HA 2 75 PHE QE . . 4.810 4.648 4.297 4.837 0.027 30 0 "[ . 1 . 2 . 3]" 1
2347 2 18 PHE QE 2 75 PHE QD . . 5.170 3.340 2.346 4.038 . 0 0 "[ . 1 . 2 . 3]" 1
2348 2 18 PHE QD 2 75 PHE QD . . 3.890 3.284 2.395 3.912 0.022 18 0 "[ . 1 . 2 . 3]" 1
2349 2 15 VAL MG2 2 75 PHE QD . . 5.120 2.804 2.113 3.925 . 0 0 "[ . 1 . 2 . 3]" 1
2350 2 11 VAL MG2 2 79 TRP HZ3 . . 5.500 4.553 4.176 4.848 . 0 0 "[ . 1 . 2 . 3]" 1
2351 2 11 VAL MG2 2 79 TRP HH2 . . 4.500 2.727 2.290 3.022 . 0 0 "[ . 1 . 2 . 3]" 1
2352 2 78 TYR QE 2 82 ILE MG . . 4.270 3.645 2.454 4.289 0.019 28 0 "[ . 1 . 2 . 3]" 1
2353 2 73 ILE MG 2 78 TYR QE . . 4.130 3.650 3.240 4.150 0.020 17 0 "[ . 1 . 2 . 3]" 1
2354 2 14 LEU MD1 2 78 TYR QE . . 4.460 3.630 2.100 4.469 0.009 1 0 "[ . 1 . 2 . 3]" 1
2355 2 79 TRP HD1 2 82 ILE MG . . 5.040 3.865 3.502 4.088 . 0 0 "[ . 1 . 2 . 3]" 1
2356 2 14 LEU MD1 2 79 TRP HD1 . . 4.890 2.913 2.599 3.214 . 0 0 "[ . 1 . 2 . 3]" 1
2357 2 14 LEU MD2 2 79 TRP HD1 . . 5.050 4.848 4.627 5.010 . 0 0 "[ . 1 . 2 . 3]" 1
2358 2 79 TRP H 2 79 TRP HE3 . . 5.500 5.537 5.501 5.577 0.077 14 0 "[ . 1 . 2 . 3]" 1
2359 2 14 LEU MD1 2 82 ILE MG . . 4.100 2.524 2.355 2.704 . 0 0 "[ . 1 . 2 . 3]" 1
2360 2 61 LEU MD2 2 84 GLY H . . 4.040 3.684 3.249 4.057 0.017 14 0 "[ . 1 . 2 . 3]" 1
2361 2 92 LEU MD2 2 93 ILE H . . 5.220 4.563 4.166 4.830 . 0 0 "[ . 1 . 2 . 3]" 1
2362 2 8 GLU HA 2 12 ILE MD . . 5.500 4.242 3.658 4.890 . 0 0 "[ . 1 . 2 . 3]" 1
2363 2 18 PHE HA 2 21 TYR QD . . 5.270 4.206 3.055 5.325 0.055 3 0 "[ . 1 . 2 . 3]" 1
2364 2 97 GLU H 2 98 GLN H . . 3.810 2.793 2.547 3.105 . 0 0 "[ . 1 . 2 . 3]" 1
2365 2 18 PHE HZ 2 22 VAL MG1 . . 4.550 4.056 3.023 4.563 0.013 24 0 "[ . 1 . 2 . 3]" 1
2366 2 18 PHE HZ 2 73 ILE MG . . 5.080 4.078 2.282 5.094 0.014 28 0 "[ . 1 . 2 . 3]" 1
2367 2 18 PHE HZ 2 22 VAL MG2 . . 4.960 3.328 2.696 4.795 . 0 0 "[ . 1 . 2 . 3]" 1
2368 2 73 ILE MD 2 78 TYR QD . . 5.010 4.367 3.008 5.027 0.017 9 0 "[ . 1 . 2 . 3]" 1
2369 2 21 TYR QD 2 22 VAL MG2 . . 4.220 3.041 2.351 4.238 0.018 28 0 "[ . 1 . 2 . 3]" 1
2370 2 41 LEU MD1 2 78 TYR QD . . 4.720 4.727 4.009 5.120 0.400 28 0 "[ . 1 . 2 . 3]" 1
2371 2 41 LEU MD2 2 78 TYR QD . . 4.070 4.063 3.242 4.142 0.072 11 0 "[ . 1 . 2 . 3]" 1
2372 2 73 ILE MG 2 78 TYR QD . . 4.320 2.138 1.964 2.360 . 0 0 "[ . 1 . 2 . 3]" 1
2373 2 14 LEU HB2 2 79 TRP HD1 . . 5.500 4.521 3.851 5.147 . 0 0 "[ . 1 . 2 . 3]" 1
2374 2 14 LEU HB3 2 79 TRP HD1 . . 5.500 3.130 2.495 3.712 . 0 0 "[ . 1 . 2 . 3]" 1
2375 2 11 VAL MG2 2 79 TRP HZ2 . . 5.500 2.823 2.443 3.341 . 0 0 "[ . 1 . 2 . 3]" 1
2376 2 11 VAL MG1 2 79 TRP HZ2 . . 5.500 3.651 3.114 4.103 . 0 0 "[ . 1 . 2 . 3]" 1
2377 2 37 PHE QE 2 82 ILE MG . . 4.750 4.617 3.685 4.786 0.036 26 0 "[ . 1 . 2 . 3]" 1
2378 2 11 VAL MG1 2 79 TRP HH2 . . 5.500 4.210 3.513 4.608 . 0 0 "[ . 1 . 2 . 3]" 1
2379 2 11 VAL HA 2 79 TRP HH2 . . 5.500 4.344 3.865 4.659 . 0 0 "[ . 1 . 2 . 3]" 1
2380 2 11 VAL HA 2 79 TRP HZ2 . . 5.190 2.654 2.174 3.089 . 0 0 "[ . 1 . 2 . 3]" 1
2381 2 41 LEU MD1 2 78 TYR QE . . 4.960 3.789 2.506 4.522 . 0 0 "[ . 1 . 2 . 3]" 1
2382 2 41 LEU MD2 2 78 TYR QE . . 4.280 2.540 2.085 3.052 . 0 0 "[ . 1 . 2 . 3]" 1
2383 2 73 ILE HB 2 78 TYR QD . . 4.740 3.338 2.284 4.735 . 0 0 "[ . 1 . 2 . 3]" 1
2384 2 40 MET ME 2 78 TYR QD . . 4.330 4.187 3.740 4.356 0.026 26 0 "[ . 1 . 2 . 3]" 1
2385 2 78 TYR QE 2 81 LEU QB . . 5.300 4.917 4.134 5.123 . 0 0 "[ . 1 . 2 . 3]" 1
2386 2 78 TYR QD 2 81 LEU QB . . 5.090 4.080 3.479 4.355 . 0 0 "[ . 1 . 2 . 3]" 1
2387 2 21 TYR HA 2 21 TYR QD . . 4.530 2.706 2.312 3.176 . 0 0 "[ . 1 . 2 . 3]" 1
2388 2 15 VAL MG2 2 18 PHE QD . . 4.300 3.674 2.111 4.324 0.024 3 0 "[ . 1 . 2 . 3]" 1
2389 2 15 VAL MG2 2 75 PHE QE . . 4.170 3.543 2.057 4.185 0.015 24 0 "[ . 1 . 2 . 3]" 1
2390 2 32 ILE MG 2 78 TYR QE . . 4.600 4.202 2.796 4.669 0.069 17 0 "[ . 1 . 2 . 3]" 1
2391 2 19 TYR QE 2 75 PHE QD . . 4.840 4.384 3.826 4.867 0.027 18 0 "[ . 1 . 2 . 3]" 1
2392 2 73 ILE MD 2 78 TYR QE . . 5.500 4.862 3.653 5.529 0.029 11 0 "[ . 1 . 2 . 3]" 1
2393 2 91 LYS HB2 2 92 LEU H . . 4.430 3.108 2.447 3.843 . 0 0 "[ . 1 . 2 . 3]" 1
2394 2 41 LEU MD2 2 45 LEU H . . 4.870 4.771 4.074 4.908 0.038 23 0 "[ . 1 . 2 . 3]" 1
2395 2 48 MET H 2 49 LEU MD1 . . 5.500 5.312 4.188 5.545 0.045 7 0 "[ . 1 . 2 . 3]" 1
2396 2 61 LEU MD1 2 84 GLY H . . 4.240 3.364 2.832 3.841 . 0 0 "[ . 1 . 2 . 3]" 1
2397 2 81 LEU MD1 2 84 GLY H . . 5.500 5.010 4.243 5.515 0.015 26 0 "[ . 1 . 2 . 3]" 1
2398 2 11 VAL MG1 2 14 LEU HB2 . . 5.320 4.409 4.137 4.679 . 0 0 "[ . 1 . 2 . 3]" 1
2399 2 92 LEU MD2 2 96 GLN HE21 . . 5.290 4.840 3.710 5.337 0.047 9 0 "[ . 1 . 2 . 3]" 1
2400 2 15 VAL HA 2 18 PHE QD . . 5.000 3.690 2.894 4.231 . 0 0 "[ . 1 . 2 . 3]" 1
2401 2 94 HIS HA 2 97 GLU HB2 . . 5.500 2.819 2.182 3.745 . 0 0 "[ . 1 . 2 . 3]" 1
2402 2 79 TRP HA 2 82 ILE HB . . 5.500 5.436 5.216 5.517 0.017 10 0 "[ . 1 . 2 . 3]" 1
2403 2 94 HIS HD2 2 97 GLU H . . 5.500 5.513 4.780 5.602 0.102 2 0 "[ . 1 . 2 . 3]" 1
2404 2 34 LYS HA 2 37 PHE H . . 5.500 3.375 2.716 4.123 . 0 0 "[ . 1 . 2 . 3]" 1
2405 2 35 SER HA 2 38 ARG QB . . 3.830 3.506 2.784 3.889 0.059 12 0 "[ . 1 . 2 . 3]" 1
2406 2 36 SER HA 2 39 GLU H . . 5.050 2.987 2.306 3.678 . 0 0 "[ . 1 . 2 . 3]" 1
2407 2 14 LEU HA 2 17 ASN H . . 5.050 3.880 3.394 4.230 . 0 0 "[ . 1 . 2 . 3]" 1
2408 2 15 VAL HA 2 18 PHE H . . 5.050 3.320 2.524 3.922 . 0 0 "[ . 1 . 2 . 3]" 1
2409 2 52 THR MG 2 55 ARG H . . 5.410 4.714 4.240 5.036 . 0 0 "[ . 1 . 2 . 3]" 1
2410 2 86 THR MG 2 87 GLY HA2 . . 3.980 4.030 3.966 4.077 0.097 22 0 "[ . 1 . 2 . 3]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 22
_Distance_constraint_stats_list.Viol_count 88
_Distance_constraint_stats_list.Viol_total 143.391
_Distance_constraint_stats_list.Viol_max 0.239
_Distance_constraint_stats_list.Viol_rms 0.0259
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0072
_Distance_constraint_stats_list.Viol_average_violations_only 0.0543
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 22 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 25 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 27 LEU 0.317 0.120 5 0 "[ . 1 . 2 . 3]"
1 31 LYS 0.910 0.217 10 0 "[ . 1 . 2 . 3]"
1 66 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 68 ASN 0.099 0.029 9 0 "[ . 1 . 2 . 3]"
1 70 ASP 0.102 0.058 26 0 "[ . 1 . 2 . 3]"
1 72 ARG 0.064 0.038 27 0 "[ . 1 . 2 . 3]"
1 77 GLU 0.812 0.200 26 0 "[ . 1 . 2 . 3]"
2 22 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 25 TYR 0.062 0.062 19 0 "[ . 1 . 2 . 3]"
2 27 LEU 0.289 0.116 5 0 "[ . 1 . 2 . 3]"
2 31 LYS 0.877 0.239 10 0 "[ . 1 . 2 . 3]"
2 66 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 68 ASN 0.163 0.077 18 0 "[ . 1 . 2 . 3]"
2 70 ASP 0.163 0.048 26 0 "[ . 1 . 2 . 3]"
2 72 ARG 0.115 0.055 8 0 "[ . 1 . 2 . 3]"
2 77 GLU 0.805 0.238 26 0 "[ . 1 . 2 . 3]"
3 1 CA 1.227 0.217 10 0 "[ . 1 . 2 . 3]"
4 1 CA 1.077 0.200 26 0 "[ . 1 . 2 . 3]"
5 1 CA 1.229 0.239 10 0 "[ . 1 . 2 . 3]"
6 1 CA 1.246 0.238 26 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 22 VAL O 3 1 CA CA . . 3.000 2.116 2.008 2.512 . 0 0 "[ . 1 . 2 . 3]" 2
2 1 25 TYR O 3 1 CA CA . . 3.000 2.118 1.974 2.860 . 0 0 "[ . 1 . 2 . 3]" 2
3 1 27 LEU O 3 1 CA CA . . 3.000 2.201 1.945 3.120 0.120 5 0 "[ . 1 . 2 . 3]" 2
4 1 31 LYS O 3 1 CA CA . . 3.000 2.517 2.001 3.217 0.217 10 0 "[ . 1 . 2 . 3]" 2
5 1 66 ASP OD1 4 1 CA CA . . 3.000 1.951 1.922 1.992 . 0 0 "[ . 1 . 2 . 3]" 2
6 1 68 ASN OD1 4 1 CA CA . . 3.000 2.361 2.064 3.029 0.029 9 0 "[ . 1 . 2 . 3]" 2
7 1 70 ASP OD1 4 1 CA CA . . 3.000 2.265 2.007 3.058 0.058 26 0 "[ . 1 . 2 . 3]" 2
8 1 70 ASP OD2 4 1 CA CA . . 3.000 2.042 1.946 2.148 . 0 0 "[ . 1 . 2 . 3]" 2
9 1 72 ARG O 4 1 CA CA . . 3.000 2.203 2.054 3.038 0.038 27 0 "[ . 1 . 2 . 3]" 2
10 1 77 GLU OE1 4 1 CA CA . . 3.000 2.452 1.887 3.147 0.147 30 0 "[ . 1 . 2 . 3]" 2
11 1 77 GLU OE2 4 1 CA CA . . 3.000 1.999 1.888 3.200 0.200 26 0 "[ . 1 . 2 . 3]" 2
12 2 22 VAL O 5 1 CA CA . . 3.000 2.132 2.006 2.725 . 0 0 "[ . 1 . 2 . 3]" 2
13 2 25 TYR O 5 1 CA CA . . 3.000 2.110 1.981 3.062 0.062 19 0 "[ . 1 . 2 . 3]" 2
14 2 27 LEU O 5 1 CA CA . . 3.000 2.206 1.954 3.116 0.116 5 0 "[ . 1 . 2 . 3]" 2
15 2 31 LYS O 5 1 CA CA . . 3.000 2.557 1.986 3.239 0.239 10 0 "[ . 1 . 2 . 3]" 2
16 2 66 ASP OD1 6 1 CA CA . . 3.000 1.953 1.922 1.985 . 0 0 "[ . 1 . 2 . 3]" 2
17 2 68 ASN OD1 6 1 CA CA . . 3.000 2.361 2.037 3.077 0.077 18 0 "[ . 1 . 2 . 3]" 2
18 2 70 ASP OD1 6 1 CA CA . . 3.000 2.318 2.027 3.048 0.048 26 0 "[ . 1 . 2 . 3]" 2
19 2 70 ASP OD2 6 1 CA CA . . 3.000 2.028 1.941 2.191 . 0 0 "[ . 1 . 2 . 3]" 2
20 2 72 ARG O 6 1 CA CA . . 3.000 2.240 2.024 3.055 0.055 8 0 "[ . 1 . 2 . 3]" 2
21 2 77 GLU OE1 6 1 CA CA . . 3.000 2.496 1.940 3.238 0.238 26 0 "[ . 1 . 2 . 3]" 2
22 2 77 GLU OE2 6 1 CA CA . . 3.000 1.947 1.891 2.001 . 0 0 "[ . 1 . 2 . 3]" 2
stop_
save_