NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
651842 |
6tvm   |
34475 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6tvm
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 3758
_Distance_constraint_stats_list.Viol_count 2264
_Distance_constraint_stats_list.Viol_total 1595.446
_Distance_constraint_stats_list.Viol_max 0.400
_Distance_constraint_stats_list.Viol_rms 0.0056
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0235
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 6 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 9 MET 0.065 0.021 20 0 "[ . 1 . 2 . 3]"
1 10 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 11 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 12 ARG 0.672 0.068 20 0 "[ . 1 . 2 . 3]"
1 13 LEU 2.701 0.126 30 0 "[ . 1 . 2 . 3]"
1 14 GLN 1.262 0.117 20 0 "[ . 1 . 2 . 3]"
1 15 ARG 0.636 0.065 10 0 "[ . 1 . 2 . 3]"
1 16 ILE 1.790 0.073 14 0 "[ . 1 . 2 . 3]"
1 17 HIS 0.288 0.037 14 0 "[ . 1 . 2 . 3]"
1 18 ALA 0.181 0.029 14 0 "[ . 1 . 2 . 3]"
1 19 GLU 0.685 0.062 25 0 "[ . 1 . 2 . 3]"
1 20 ILE 0.627 0.062 25 0 "[ . 1 . 2 . 3]"
1 21 LYS 1.107 0.076 23 0 "[ . 1 . 2 . 3]"
1 22 ASN 0.445 0.175 6 0 "[ . 1 . 2 . 3]"
1 23 SER 0.794 0.175 6 0 "[ . 1 . 2 . 3]"
1 24 LEU 2.077 0.076 23 0 "[ . 1 . 2 . 3]"
1 25 LYS 0.512 0.044 17 0 "[ . 1 . 2 . 3]"
1 26 ILE 3.326 0.120 25 0 "[ . 1 . 2 . 3]"
1 27 ASP 0.181 0.030 6 0 "[ . 1 . 2 . 3]"
1 28 ASN 3.084 0.120 25 0 "[ . 1 . 2 . 3]"
1 29 LEU 0.908 0.064 18 0 "[ . 1 . 2 . 3]"
1 30 ASP 0.192 0.030 28 0 "[ . 1 . 2 . 3]"
1 31 VAL 0.624 0.101 19 0 "[ . 1 . 2 . 3]"
1 32 ASN 0.554 0.056 3 0 "[ . 1 . 2 . 3]"
1 33 ARG 0.147 0.056 3 0 "[ . 1 . 2 . 3]"
1 34 CYS 0.000 0.000 17 0 "[ . 1 . 2 . 3]"
1 35 ILE 0.289 0.058 20 0 "[ . 1 . 2 . 3]"
1 36 GLU 0.032 0.025 19 0 "[ . 1 . 2 . 3]"
1 37 ALA 0.476 0.030 9 0 "[ . 1 . 2 . 3]"
1 38 LEU 0.014 0.012 7 0 "[ . 1 . 2 . 3]"
1 39 ASP 0.421 0.030 18 0 "[ . 1 . 2 . 3]"
1 40 GLU 0.442 0.121 16 0 "[ . 1 . 2 . 3]"
1 41 LEU 4.282 0.245 18 0 "[ . 1 . 2 . 3]"
1 42 ALA 1.185 0.069 18 0 "[ . 1 . 2 . 3]"
1 43 SER 0.735 0.245 18 0 "[ . 1 . 2 . 3]"
1 44 LEU 0.480 0.060 20 0 "[ . 1 . 2 . 3]"
1 45 GLN 0.010 0.010 30 0 "[ . 1 . 2 . 3]"
1 46 VAL 0.450 0.055 9 0 "[ . 1 . 2 . 3]"
1 47 THR 0.296 0.037 30 0 "[ . 1 . 2 . 3]"
1 48 MET 0.028 0.008 10 0 "[ . 1 . 2 . 3]"
1 49 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 50 GLN 0.070 0.020 18 0 "[ . 1 . 2 . 3]"
1 51 ALA 0.023 0.011 18 0 "[ . 1 . 2 . 3]"
1 52 GLN 0.022 0.011 10 0 "[ . 1 . 2 . 3]"
1 53 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 54 HIS 0.012 0.011 10 0 "[ . 1 . 2 . 3]"
1 55 THR 0.017 0.007 29 0 "[ . 1 . 2 . 3]"
1 56 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 57 MET 0.559 0.037 13 0 "[ . 1 . 2 . 3]"
1 58 ILE 0.196 0.022 29 0 "[ . 1 . 2 . 3]"
1 59 THR 0.002 0.002 4 0 "[ . 1 . 2 . 3]"
1 60 THR 0.015 0.006 8 0 "[ . 1 . 2 . 3]"
1 61 LEU 0.859 0.057 18 0 "[ . 1 . 2 . 3]"
1 62 LYS 0.374 0.160 19 0 "[ . 1 . 2 . 3]"
1 63 LYS 0.130 0.115 19 0 "[ . 1 . 2 . 3]"
1 64 ILE 0.054 0.016 14 0 "[ . 1 . 2 . 3]"
1 65 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 66 ARG 0.159 0.035 19 0 "[ . 1 . 2 . 3]"
1 67 PHE 1.085 0.082 11 0 "[ . 1 . 2 . 3]"
1 68 LYS 0.187 0.048 18 0 "[ . 1 . 2 . 3]"
1 69 VAL 0.705 0.175 19 0 "[ . 1 . 2 . 3]"
1 70 SER 1.208 0.175 19 0 "[ . 1 . 2 . 3]"
1 71 GLN 0.059 0.022 30 0 "[ . 1 . 2 . 3]"
1 72 VAL 0.225 0.061 20 0 "[ . 1 . 2 . 3]"
1 73 ILE 0.674 0.086 15 0 "[ . 1 . 2 . 3]"
1 74 MET 0.895 0.076 17 0 "[ . 1 . 2 . 3]"
1 75 GLU 1.035 0.264 17 0 "[ . 1 . 2 . 3]"
1 76 LYS 0.120 0.063 6 0 "[ . 1 . 2 . 3]"
1 77 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 78 THR 0.332 0.044 18 0 "[ . 1 . 2 . 3]"
1 79 MET 0.566 0.082 8 0 "[ . 1 . 2 . 3]"
1 80 LEU 0.590 0.071 16 0 "[ . 1 . 2 . 3]"
1 81 TYR 0.456 0.035 7 0 "[ . 1 . 2 . 3]"
1 82 ASN 0.866 0.148 5 0 "[ . 1 . 2 . 3]"
1 83 LYS 0.651 0.148 5 0 "[ . 1 . 2 . 3]"
1 84 PHE 0.560 0.050 14 0 "[ . 1 . 2 . 3]"
1 85 LYS 0.088 0.035 6 0 "[ . 1 . 2 . 3]"
1 86 ASN 0.038 0.017 11 0 "[ . 1 . 2 . 3]"
1 87 MET 0.089 0.041 9 0 "[ . 1 . 2 . 3]"
1 88 PHE 0.107 0.035 10 0 "[ . 1 . 2 . 3]"
1 89 LEU 0.059 0.021 28 0 "[ . 1 . 2 . 3]"
1 90 VAL 1.169 0.058 28 0 "[ . 1 . 2 . 3]"
1 91 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 92 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 93 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 94 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 95 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 96 VAL 0.482 0.096 13 0 "[ . 1 . 2 . 3]"
1 97 ILE 1.004 0.130 29 0 "[ . 1 . 2 . 3]"
1 98 THR 0.535 0.208 27 0 "[ . 1 . 2 . 3]"
1 99 GLN 0.346 0.208 27 0 "[ . 1 . 2 . 3]"
1 100 VAL 0.406 0.327 22 0 "[ . 1 . 2 . 3]"
1 101 LEU 0.440 0.327 22 0 "[ . 1 . 2 . 3]"
1 102 ASN 0.011 0.009 30 0 "[ . 1 . 2 . 3]"
1 103 LYS 0.171 0.045 7 0 "[ . 1 . 2 . 3]"
1 104 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 105 LEU 0.001 0.001 27 0 "[ . 1 . 2 . 3]"
1 106 ALA 0.216 0.045 7 0 "[ . 1 . 2 . 3]"
1 107 GLU 0.045 0.012 3 0 "[ . 1 . 2 . 3]"
1 108 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 109 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 110 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 111 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 112 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 113 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 114 ALA 0.026 0.013 24 0 "[ . 1 . 2 . 3]"
1 115 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 116 LYS 0.026 0.013 24 0 "[ . 1 . 2 . 3]"
2 6 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 9 MET 0.006 0.006 23 0 "[ . 1 . 2 . 3]"
2 10 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 11 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 12 ARG 0.196 0.030 20 0 "[ . 1 . 2 . 3]"
2 13 LEU 1.367 0.090 8 0 "[ . 1 . 2 . 3]"
2 14 GLN 1.121 0.119 20 0 "[ . 1 . 2 . 3]"
2 15 ARG 0.708 0.082 20 0 "[ . 1 . 2 . 3]"
2 16 ILE 0.918 0.087 18 0 "[ . 1 . 2 . 3]"
2 17 HIS 0.164 0.021 28 0 "[ . 1 . 2 . 3]"
2 18 ALA 0.223 0.042 25 0 "[ . 1 . 2 . 3]"
2 19 GLU 0.724 0.047 6 0 "[ . 1 . 2 . 3]"
2 20 ILE 0.286 0.031 14 0 "[ . 1 . 2 . 3]"
2 21 LYS 0.954 0.072 14 0 "[ . 1 . 2 . 3]"
2 22 ASN 0.401 0.188 18 0 "[ . 1 . 2 . 3]"
2 23 SER 0.551 0.188 18 0 "[ . 1 . 2 . 3]"
2 24 LEU 1.918 0.079 14 0 "[ . 1 . 2 . 3]"
2 25 LYS 0.593 0.050 28 0 "[ . 1 . 2 . 3]"
2 26 ILE 3.327 0.126 24 0 "[ . 1 . 2 . 3]"
2 27 ASP 0.189 0.029 5 0 "[ . 1 . 2 . 3]"
2 28 ASN 2.958 0.126 24 0 "[ . 1 . 2 . 3]"
2 29 LEU 1.148 0.079 14 0 "[ . 1 . 2 . 3]"
2 30 ASP 0.153 0.033 28 0 "[ . 1 . 2 . 3]"
2 31 VAL 0.533 0.050 28 0 "[ . 1 . 2 . 3]"
2 32 ASN 0.542 0.056 3 0 "[ . 1 . 2 . 3]"
2 33 ARG 0.120 0.056 3 0 "[ . 1 . 2 . 3]"
2 34 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 35 ILE 0.225 0.061 20 0 "[ . 1 . 2 . 3]"
2 36 GLU 0.004 0.002 5 0 "[ . 1 . 2 . 3]"
2 37 ALA 0.246 0.022 10 0 "[ . 1 . 2 . 3]"
2 38 LEU 0.002 0.002 9 0 "[ . 1 . 2 . 3]"
2 39 ASP 0.159 0.022 5 0 "[ . 1 . 2 . 3]"
2 40 GLU 0.354 0.115 16 0 "[ . 1 . 2 . 3]"
2 41 LEU 2.985 0.115 16 0 "[ . 1 . 2 . 3]"
2 42 ALA 1.124 0.082 8 0 "[ . 1 . 2 . 3]"
2 43 SER 0.750 0.094 21 0 "[ . 1 . 2 . 3]"
2 44 LEU 0.729 0.098 30 0 "[ . 1 . 2 . 3]"
2 45 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 46 VAL 0.634 0.098 30 0 "[ . 1 . 2 . 3]"
2 47 THR 0.215 0.020 29 0 "[ . 1 . 2 . 3]"
2 48 MET 0.040 0.010 10 0 "[ . 1 . 2 . 3]"
2 49 GLN 0.017 0.009 26 0 "[ . 1 . 2 . 3]"
2 50 GLN 0.047 0.014 30 0 "[ . 1 . 2 . 3]"
2 51 ALA 0.071 0.035 10 0 "[ . 1 . 2 . 3]"
2 52 GLN 0.031 0.021 10 0 "[ . 1 . 2 . 3]"
2 53 LYS 0.017 0.009 26 0 "[ . 1 . 2 . 3]"
2 54 HIS 0.023 0.021 10 0 "[ . 1 . 2 . 3]"
2 55 THR 0.025 0.011 23 0 "[ . 1 . 2 . 3]"
2 56 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 57 MET 0.584 0.032 20 0 "[ . 1 . 2 . 3]"
2 58 ILE 0.209 0.022 21 0 "[ . 1 . 2 . 3]"
2 59 THR 0.005 0.005 22 0 "[ . 1 . 2 . 3]"
2 60 THR 0.011 0.005 27 0 "[ . 1 . 2 . 3]"
2 61 LEU 0.426 0.050 14 0 "[ . 1 . 2 . 3]"
2 62 LYS 0.363 0.158 19 0 "[ . 1 . 2 . 3]"
2 63 LYS 0.119 0.113 19 0 "[ . 1 . 2 . 3]"
2 64 ILE 0.145 0.062 14 0 "[ . 1 . 2 . 3]"
2 65 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 66 ARG 0.259 0.062 14 0 "[ . 1 . 2 . 3]"
2 67 PHE 1.234 0.113 17 0 "[ . 1 . 2 . 3]"
2 68 LYS 0.169 0.049 18 0 "[ . 1 . 2 . 3]"
2 69 VAL 0.598 0.082 11 0 "[ . 1 . 2 . 3]"
2 70 SER 1.820 0.400 19 0 "[ . 1 . 2 . 3]"
2 71 GLN 0.128 0.097 17 0 "[ . 1 . 2 . 3]"
2 72 VAL 0.197 0.058 20 0 "[ . 1 . 2 . 3]"
2 73 ILE 1.090 0.400 19 0 "[ . 1 . 2 . 3]"
2 74 MET 0.999 0.076 11 0 "[ . 1 . 2 . 3]"
2 75 GLU 1.074 0.231 30 0 "[ . 1 . 2 . 3]"
2 76 LYS 0.073 0.058 6 0 "[ . 1 . 2 . 3]"
2 77 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 78 THR 0.313 0.043 5 0 "[ . 1 . 2 . 3]"
2 79 MET 0.793 0.167 21 0 "[ . 1 . 2 . 3]"
2 80 LEU 0.733 0.167 21 0 "[ . 1 . 2 . 3]"
2 81 TYR 0.812 0.067 27 0 "[ . 1 . 2 . 3]"
2 82 ASN 0.903 0.139 18 0 "[ . 1 . 2 . 3]"
2 83 LYS 0.625 0.139 18 0 "[ . 1 . 2 . 3]"
2 84 PHE 0.918 0.057 18 0 "[ . 1 . 2 . 3]"
2 85 LYS 0.186 0.067 27 0 "[ . 1 . 2 . 3]"
2 86 ASN 0.065 0.024 11 0 "[ . 1 . 2 . 3]"
2 87 MET 0.132 0.023 10 0 "[ . 1 . 2 . 3]"
2 88 PHE 0.131 0.023 10 0 "[ . 1 . 2 . 3]"
2 89 LEU 0.155 0.025 28 0 "[ . 1 . 2 . 3]"
2 90 VAL 1.194 0.064 28 0 "[ . 1 . 2 . 3]"
2 91 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 92 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 93 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 94 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 95 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 96 VAL 0.257 0.099 23 0 "[ . 1 . 2 . 3]"
2 97 ILE 0.780 0.128 28 0 "[ . 1 . 2 . 3]"
2 98 THR 0.654 0.253 23 0 "[ . 1 . 2 . 3]"
2 99 GLN 0.462 0.253 23 0 "[ . 1 . 2 . 3]"
2 100 VAL 0.365 0.081 22 0 "[ . 1 . 2 . 3]"
2 101 LEU 0.574 0.131 27 0 "[ . 1 . 2 . 3]"
2 102 ASN 0.145 0.131 27 0 "[ . 1 . 2 . 3]"
2 103 LYS 0.186 0.040 7 0 "[ . 1 . 2 . 3]"
2 104 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 105 LEU 0.005 0.005 27 0 "[ . 1 . 2 . 3]"
2 106 ALA 0.219 0.040 7 0 "[ . 1 . 2 . 3]"
2 107 GLU 0.028 0.008 27 0 "[ . 1 . 2 . 3]"
2 108 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 109 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 110 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 111 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 112 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 113 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 114 ALA 0.006 0.004 27 0 "[ . 1 . 2 . 3]"
2 115 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 116 LYS 0.006 0.004 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 86 ASN H 1 87 MET H . . 3.600 2.720 2.572 2.790 . 0 0 "[ . 1 . 2 . 3]" 1
2 2 86 ASN H 2 87 MET H . . 3.600 2.724 2.572 2.789 . 0 0 "[ . 1 . 2 . 3]" 1
3 1 87 MET H 1 88 PHE QD . . 4.920 4.359 3.828 4.883 . 0 0 "[ . 1 . 2 . 3]" 1
4 2 87 MET H 2 88 PHE QD . . 4.920 4.368 3.823 4.943 0.023 10 0 "[ . 1 . 2 . 3]" 1
5 1 88 PHE H 1 88 PHE QD . . 3.910 2.805 2.310 3.379 . 0 0 "[ . 1 . 2 . 3]" 1
6 2 88 PHE H 2 88 PHE QD . . 3.910 2.809 2.302 3.446 . 0 0 "[ . 1 . 2 . 3]" 1
7 1 87 MET H 1 88 PHE H . . 3.460 2.427 2.302 2.491 . 0 0 "[ . 1 . 2 . 3]" 1
8 2 87 MET H 2 88 PHE H . . 3.460 2.426 2.303 2.490 . 0 0 "[ . 1 . 2 . 3]" 1
9 1 88 PHE H 1 89 LEU H . . 3.340 2.543 2.412 2.669 . 0 0 "[ . 1 . 2 . 3]" 1
10 2 88 PHE H 2 89 LEU H . . 3.340 2.545 2.417 2.664 . 0 0 "[ . 1 . 2 . 3]" 1
11 1 89 LEU H 1 90 VAL H . . 3.510 2.369 2.286 2.646 . 0 0 "[ . 1 . 2 . 3]" 1
12 2 89 LEU H 2 90 VAL H . . 3.510 2.367 2.285 2.642 . 0 0 "[ . 1 . 2 . 3]" 1
13 1 88 PHE QD 1 89 LEU H . . 4.660 4.521 4.397 4.650 . 0 0 "[ . 1 . 2 . 3]" 1
14 2 88 PHE QD 2 89 LEU H . . 4.660 4.527 4.393 4.667 0.007 10 0 "[ . 1 . 2 . 3]" 1
15 1 107 GLU H 1 108 GLN H . . 3.970 2.839 2.472 2.974 . 0 0 "[ . 1 . 2 . 3]" 1
16 2 107 GLU H 2 108 GLN H . . 3.970 2.838 2.472 2.971 . 0 0 "[ . 1 . 2 . 3]" 1
17 1 80 LEU H 1 81 TYR H . . 3.840 2.534 2.466 2.636 . 0 0 "[ . 1 . 2 . 3]" 1
18 2 80 LEU H 2 81 TYR H . . 3.840 2.540 2.464 2.644 . 0 0 "[ . 1 . 2 . 3]" 1
19 1 39 ASP HB2 1 40 GLU H . . 4.190 3.710 2.751 4.116 . 0 0 "[ . 1 . 2 . 3]" 1
20 2 39 ASP HB2 2 40 GLU H . . 4.190 3.718 2.777 4.112 . 0 0 "[ . 1 . 2 . 3]" 1
21 1 39 ASP HB3 1 40 GLU H . . 4.190 2.729 2.413 3.184 . 0 0 "[ . 1 . 2 . 3]" 1
22 2 39 ASP HB3 2 40 GLU H . . 4.190 2.739 2.413 3.194 . 0 0 "[ . 1 . 2 . 3]" 1
23 1 97 ILE H 1 97 ILE HB . . 3.870 3.311 2.488 3.882 0.012 26 0 "[ . 1 . 2 . 3]" 1
24 2 97 ILE H 2 97 ILE HB . . 3.870 3.393 2.552 3.892 0.022 26 0 "[ . 1 . 2 . 3]" 1
25 1 97 ILE H 1 97 ILE HG12 . . 4.050 3.429 2.619 4.109 0.059 22 0 "[ . 1 . 2 . 3]" 1
26 2 97 ILE H 2 97 ILE HG12 . . 4.050 3.390 2.597 4.074 0.024 21 0 "[ . 1 . 2 . 3]" 1
27 1 97 ILE H 1 97 ILE HG13 . . 4.050 2.529 1.935 3.214 . 0 0 "[ . 1 . 2 . 3]" 1
28 2 97 ILE H 2 97 ILE HG13 . . 4.050 2.554 1.944 3.153 . 0 0 "[ . 1 . 2 . 3]" 1
29 1 105 LEU HB2 1 106 ALA H . . 4.340 2.899 2.529 3.730 . 0 0 "[ . 1 . 2 . 3]" 1
30 2 105 LEU HB2 2 106 ALA H . . 4.340 2.901 2.540 3.729 . 0 0 "[ . 1 . 2 . 3]" 1
31 1 105 LEU HG 1 106 ALA H . . 5.000 4.475 2.050 5.001 0.001 27 0 "[ . 1 . 2 . 3]" 1
32 2 105 LEU HG 2 106 ALA H . . 5.000 4.478 2.048 5.005 0.005 27 0 "[ . 1 . 2 . 3]" 1
33 1 105 LEU HB3 1 106 ALA H . . 4.340 3.559 2.719 4.091 . 0 0 "[ . 1 . 2 . 3]" 1
34 2 105 LEU HB3 2 106 ALA H . . 4.340 3.560 2.718 4.090 . 0 0 "[ . 1 . 2 . 3]" 1
35 1 90 VAL H 1 91 GLY H . . 3.920 3.309 2.324 3.543 . 0 0 "[ . 1 . 2 . 3]" 1
36 2 90 VAL H 2 91 GLY H . . 3.920 3.310 2.319 3.522 . 0 0 "[ . 1 . 2 . 3]" 1
37 1 113 GLU H 1 114 ALA H . . 5.020 2.708 2.450 2.788 . 0 0 "[ . 1 . 2 . 3]" 1
38 2 113 GLU H 2 114 ALA H . . 5.020 2.706 2.449 2.789 . 0 0 "[ . 1 . 2 . 3]" 1
39 1 112 GLU H 1 113 GLU H . . 5.120 2.789 2.562 3.004 . 0 0 "[ . 1 . 2 . 3]" 1
40 2 112 GLU H 2 113 GLU H . . 5.120 2.787 2.557 3.005 . 0 0 "[ . 1 . 2 . 3]" 1
41 1 106 ALA H 1 106 ALA MB . . 3.560 2.104 2.028 2.232 . 0 0 "[ . 1 . 2 . 3]" 1
42 2 106 ALA H 2 106 ALA MB . . 3.560 2.104 2.029 2.230 . 0 0 "[ . 1 . 2 . 3]" 1
43 1 103 LYS HA 1 106 ALA H . . 4.340 3.745 3.080 4.197 . 0 0 "[ . 1 . 2 . 3]" 1
44 2 103 LYS HA 2 106 ALA H . . 4.340 3.735 3.081 4.197 . 0 0 "[ . 1 . 2 . 3]" 1
45 1 114 ALA H 1 114 ALA MB . . 3.420 2.119 2.028 2.233 . 0 0 "[ . 1 . 2 . 3]" 1
46 2 114 ALA H 2 114 ALA MB . . 3.420 2.119 2.027 2.233 . 0 0 "[ . 1 . 2 . 3]" 1
47 1 113 GLU HB3 1 114 ALA H . . 4.740 3.173 2.718 3.807 . 0 0 "[ . 1 . 2 . 3]" 1
48 2 113 GLU HB3 2 114 ALA H . . 4.740 3.171 2.719 3.813 . 0 0 "[ . 1 . 2 . 3]" 1
49 1 112 GLU QG 1 113 GLU H . . 4.760 4.009 3.093 4.458 . 0 0 "[ . 1 . 2 . 3]" 1
50 2 112 GLU QG 2 113 GLU H . . 4.760 4.008 3.105 4.456 . 0 0 "[ . 1 . 2 . 3]" 1
51 1 113 GLU H 1 113 GLU QG . . 5.000 3.582 1.992 4.028 . 0 0 "[ . 1 . 2 . 3]" 1
52 2 113 GLU H 2 113 GLU QG . . 5.000 3.584 1.995 4.030 . 0 0 "[ . 1 . 2 . 3]" 1
53 1 109 ARG H 1 109 ARG HB2 . . 4.120 2.560 2.111 3.585 . 0 0 "[ . 1 . 2 . 3]" 1
54 2 109 ARG H 2 109 ARG HB2 . . 4.120 2.519 2.084 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
55 1 109 ARG H 1 109 ARG HB3 . . 4.120 2.901 2.390 3.602 . 0 0 "[ . 1 . 2 . 3]" 1
56 2 109 ARG H 2 109 ARG HB3 . . 4.120 2.926 2.389 3.590 . 0 0 "[ . 1 . 2 . 3]" 1
57 1 109 ARG H 1 109 ARG HG2 . . 4.720 3.784 1.941 4.663 . 0 0 "[ . 1 . 2 . 3]" 1
58 2 109 ARG H 2 109 ARG HG2 . . 4.720 3.848 2.180 4.664 . 0 0 "[ . 1 . 2 . 3]" 1
59 1 109 ARG H 1 109 ARG HG3 . . 4.720 3.899 2.304 4.645 . 0 0 "[ . 1 . 2 . 3]" 1
60 2 109 ARG H 2 109 ARG HG3 . . 4.720 3.905 1.943 4.625 . 0 0 "[ . 1 . 2 . 3]" 1
61 1 107 GLU H 1 107 GLU QB . . 3.040 2.242 2.061 2.588 . 0 0 "[ . 1 . 2 . 3]" 1
62 2 107 GLU H 2 107 GLU QB . . 3.040 2.241 2.061 2.596 . 0 0 "[ . 1 . 2 . 3]" 1
63 1 107 GLU H 1 107 GLU HG2 . . 4.230 3.210 1.952 4.050 . 0 0 "[ . 1 . 2 . 3]" 1
64 2 107 GLU H 2 107 GLU HG2 . . 4.230 3.212 1.944 4.052 . 0 0 "[ . 1 . 2 . 3]" 1
65 1 107 GLU H 1 107 GLU HG3 . . 4.230 3.103 2.360 3.677 . 0 0 "[ . 1 . 2 . 3]" 1
66 2 107 GLU H 2 107 GLU HG3 . . 4.230 3.104 2.361 3.682 . 0 0 "[ . 1 . 2 . 3]" 1
67 1 106 ALA MB 1 107 GLU H . . 3.480 2.723 2.315 2.821 . 0 0 "[ . 1 . 2 . 3]" 1
68 2 106 ALA MB 2 107 GLU H . . 3.480 2.724 2.317 2.815 . 0 0 "[ . 1 . 2 . 3]" 1
69 1 107 GLU QB 1 108 GLN H . . 3.670 2.459 2.257 3.350 . 0 0 "[ . 1 . 2 . 3]" 1
70 2 107 GLU QB 2 108 GLN H . . 3.670 2.459 2.274 3.346 . 0 0 "[ . 1 . 2 . 3]" 1
71 1 108 GLN H 1 108 GLN HG2 . . 5.250 4.264 2.874 4.668 . 0 0 "[ . 1 . 2 . 3]" 1
72 2 108 GLN H 2 108 GLN HG2 . . 5.250 4.290 2.919 4.668 . 0 0 "[ . 1 . 2 . 3]" 1
73 1 108 GLN H 1 108 GLN HG3 . . 5.250 4.030 2.887 4.535 . 0 0 "[ . 1 . 2 . 3]" 1
74 2 108 GLN H 2 108 GLN HG3 . . 5.250 4.037 2.887 4.536 . 0 0 "[ . 1 . 2 . 3]" 1
75 1 111 HIS HB2 1 112 GLU H . . 4.800 3.315 2.759 3.885 . 0 0 "[ . 1 . 2 . 3]" 1
76 2 111 HIS HB2 2 112 GLU H . . 4.800 3.314 2.762 3.890 . 0 0 "[ . 1 . 2 . 3]" 1
77 1 111 HIS HB3 1 112 GLU H . . 4.800 2.646 2.149 3.495 . 0 0 "[ . 1 . 2 . 3]" 1
78 2 111 HIS HB3 2 112 GLU H . . 4.800 2.643 2.147 3.475 . 0 0 "[ . 1 . 2 . 3]" 1
79 1 10 ASP H 1 10 ASP QB . . 3.520 2.303 2.159 2.624 . 0 0 "[ . 1 . 2 . 3]" 1
80 2 10 ASP H 2 10 ASP QB . . 3.520 2.302 2.151 2.630 . 0 0 "[ . 1 . 2 . 3]" 1
81 1 9 MET HB3 1 10 ASP H . . 4.360 2.689 2.540 2.796 . 0 0 "[ . 1 . 2 . 3]" 1
82 2 9 MET HB3 2 10 ASP H . . 4.360 2.688 2.541 2.765 . 0 0 "[ . 1 . 2 . 3]" 1
83 1 10 ASP H 1 11 SER H . . 3.990 2.507 2.478 2.587 . 0 0 "[ . 1 . 2 . 3]" 1
84 2 10 ASP H 2 11 SER H . . 3.990 2.508 2.480 2.575 . 0 0 "[ . 1 . 2 . 3]" 1
85 1 11 SER H 1 11 SER QB . . 3.400 2.201 2.054 2.734 . 0 0 "[ . 1 . 2 . 3]" 1
86 2 11 SER H 2 11 SER QB . . 3.400 2.200 2.054 2.734 . 0 0 "[ . 1 . 2 . 3]" 1
87 1 10 ASP QB 1 11 SER H . . 3.590 2.679 2.477 2.791 . 0 0 "[ . 1 . 2 . 3]" 1
88 2 10 ASP QB 2 11 SER H . . 3.590 2.689 2.515 2.857 . 0 0 "[ . 1 . 2 . 3]" 1
89 1 11 SER H 1 12 ARG QB . . 5.140 4.830 4.683 4.983 . 0 0 "[ . 1 . 2 . 3]" 1
90 2 11 SER H 2 12 ARG QB . . 5.140 4.848 4.704 4.960 . 0 0 "[ . 1 . 2 . 3]" 1
91 1 12 ARG H 1 13 LEU H . . 3.460 2.466 2.436 2.479 . 0 0 "[ . 1 . 2 . 3]" 1
92 2 12 ARG H 2 13 LEU H . . 3.460 2.473 2.433 2.487 . 0 0 "[ . 1 . 2 . 3]" 1
93 1 11 SER H 1 12 ARG H . . 3.490 2.611 2.545 2.758 . 0 0 "[ . 1 . 2 . 3]" 1
94 2 11 SER H 2 12 ARG H . . 3.490 2.607 2.550 2.732 . 0 0 "[ . 1 . 2 . 3]" 1
95 1 9 MET HA 1 12 ARG H . . 3.790 3.663 3.607 3.775 . 0 0 "[ . 1 . 2 . 3]" 1
96 2 9 MET HA 2 12 ARG H . . 3.790 3.651 3.605 3.768 . 0 0 "[ . 1 . 2 . 3]" 1
97 1 11 SER QB 1 12 ARG H . . 3.580 2.704 2.592 2.797 . 0 0 "[ . 1 . 2 . 3]" 1
98 2 11 SER QB 2 12 ARG H . . 3.580 2.698 2.586 2.817 . 0 0 "[ . 1 . 2 . 3]" 1
99 1 12 ARG H 1 12 ARG QD . . 4.570 4.082 3.670 4.232 . 0 0 "[ . 1 . 2 . 3]" 1
100 2 12 ARG H 2 12 ARG QD . . 4.570 4.077 3.642 4.219 . 0 0 "[ . 1 . 2 . 3]" 1
101 1 12 ARG H 1 12 ARG QB . . 3.170 2.548 2.461 2.611 . 0 0 "[ . 1 . 2 . 3]" 1
102 2 12 ARG H 2 12 ARG QB . . 3.170 2.569 2.465 2.670 . 0 0 "[ . 1 . 2 . 3]" 1
103 1 12 ARG H 1 12 ARG HG2 . . 3.740 2.113 1.957 2.261 . 0 0 "[ . 1 . 2 . 3]" 1
104 2 12 ARG H 2 12 ARG HG2 . . 3.890 2.072 1.945 2.246 . 0 0 "[ . 1 . 2 . 3]" 1
105 1 12 ARG H 1 12 ARG HG3 . . 3.890 3.181 2.943 3.369 . 0 0 "[ . 1 . 2 . 3]" 1
106 2 12 ARG H 2 12 ARG HG3 . . 3.890 3.144 2.780 3.368 . 0 0 "[ . 1 . 2 . 3]" 1
107 1 12 ARG H 1 13 LEU HB2 . . 4.600 4.325 4.228 4.446 . 0 0 "[ . 1 . 2 . 3]" 1
108 2 12 ARG H 2 13 LEU HB2 . . 4.600 4.361 4.231 4.493 . 0 0 "[ . 1 . 2 . 3]" 1
109 1 13 LEU H 1 13 LEU HB3 . . 3.850 3.395 3.226 3.538 . 0 0 "[ . 1 . 2 . 3]" 1
110 2 13 LEU H 2 13 LEU HB3 . . 3.850 3.434 3.253 3.546 . 0 0 "[ . 1 . 2 . 3]" 1
111 1 13 LEU H 1 13 LEU MD1 . . 4.030 3.379 2.657 3.936 . 0 0 "[ . 1 . 2 . 3]" 1
112 2 13 LEU H 2 13 LEU MD1 . . 4.030 3.428 2.679 3.865 . 0 0 "[ . 1 . 2 . 3]" 1
113 1 13 LEU H 1 13 LEU HB2 . . 3.700 2.127 2.045 2.254 . 0 0 "[ . 1 . 2 . 3]" 1
114 2 13 LEU H 2 13 LEU HB2 . . 3.700 2.158 2.044 2.278 . 0 0 "[ . 1 . 2 . 3]" 1
115 1 12 ARG HG3 1 13 LEU H . . 3.370 2.362 2.211 2.461 . 0 0 "[ . 1 . 2 . 3]" 1
116 1 12 ARG QB 1 13 LEU H . . 3.550 3.489 3.478 3.500 . 0 0 "[ . 1 . 2 . 3]" 1
117 2 12 ARG QB 2 13 LEU H . . 3.550 3.474 3.435 3.502 . 0 0 "[ . 1 . 2 . 3]" 1
118 1 19 GLU H 1 19 GLU QG . . 3.060 2.465 2.085 2.639 . 0 0 "[ . 1 . 2 . 3]" 1
119 2 19 GLU H 2 19 GLU QG . . 3.060 2.448 2.135 2.651 . 0 0 "[ . 1 . 2 . 3]" 1
120 1 9 MET HA 1 13 LEU H . . 4.580 4.167 4.023 4.311 . 0 0 "[ . 1 . 2 . 3]" 1
121 2 9 MET HA 2 13 LEU H . . 4.580 4.139 3.998 4.295 . 0 0 "[ . 1 . 2 . 3]" 1
122 1 10 ASP HA 1 13 LEU H . . 4.720 3.382 3.287 3.483 . 0 0 "[ . 1 . 2 . 3]" 1
123 2 10 ASP HA 2 13 LEU H . . 4.720 3.398 3.308 3.480 . 0 0 "[ . 1 . 2 . 3]" 1
124 1 13 LEU HB3 1 14 GLN H . . 4.160 3.081 2.731 3.605 . 0 0 "[ . 1 . 2 . 3]" 1
125 2 13 LEU HB3 2 14 GLN H . . 4.160 3.098 2.750 3.547 . 0 0 "[ . 1 . 2 . 3]" 1
126 1 13 LEU MD2 1 14 GLN H . . 4.840 4.599 4.456 4.863 0.023 26 0 "[ . 1 . 2 . 3]" 1
127 2 13 LEU MD2 2 14 GLN H . . 4.840 4.602 4.488 4.812 . 0 0 "[ . 1 . 2 . 3]" 1
128 1 13 LEU MD1 1 14 GLN H . . 4.840 4.527 4.422 4.798 . 0 0 "[ . 1 . 2 . 3]" 1
129 2 13 LEU MD1 2 14 GLN H . . 4.840 4.476 4.337 4.745 . 0 0 "[ . 1 . 2 . 3]" 1
130 1 13 LEU HB2 1 14 GLN H . . 3.980 2.871 2.635 3.233 . 0 0 "[ . 1 . 2 . 3]" 1
131 2 13 LEU HB2 2 14 GLN H . . 3.980 2.762 2.546 3.177 . 0 0 "[ . 1 . 2 . 3]" 1
132 1 12 ARG HG3 1 14 GLN H . . 5.500 4.847 4.689 5.004 . 0 0 "[ . 1 . 2 . 3]" 1
133 1 12 ARG QB 1 14 GLN H . . 5.460 5.287 5.060 5.364 . 0 0 "[ . 1 . 2 . 3]" 1
134 2 12 ARG QB 2 14 GLN H . . 5.460 5.326 5.076 5.372 . 0 0 "[ . 1 . 2 . 3]" 1
135 1 14 GLN H 1 14 GLN HB2 . . 3.760 3.561 3.489 3.590 . 0 0 "[ . 1 . 2 . 3]" 1
136 2 14 GLN H 2 14 GLN HB2 . . 3.760 3.566 3.502 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
137 1 14 GLN H 1 14 GLN HB3 . . 3.760 2.384 2.182 2.507 . 0 0 "[ . 1 . 2 . 3]" 1
138 2 14 GLN H 2 14 GLN HB3 . . 3.760 2.389 2.198 2.556 . 0 0 "[ . 1 . 2 . 3]" 1
139 1 14 GLN H 1 14 GLN HG2 . . 3.990 2.682 2.201 3.648 . 0 0 "[ . 1 . 2 . 3]" 1
140 2 14 GLN H 2 14 GLN HG2 . . 3.990 2.647 2.082 3.655 . 0 0 "[ . 1 . 2 . 3]" 1
141 1 14 GLN H 1 14 GLN HG3 . . 3.990 3.270 2.763 4.074 0.084 26 0 "[ . 1 . 2 . 3]" 1
142 2 14 GLN H 2 14 GLN HG3 . . 3.990 3.257 2.637 4.070 0.080 26 0 "[ . 1 . 2 . 3]" 1
143 1 10 ASP HA 1 14 GLN H . . 4.500 3.801 3.649 4.024 . 0 0 "[ . 1 . 2 . 3]" 1
144 2 10 ASP HA 2 14 GLN H . . 4.500 3.727 3.547 4.066 . 0 0 "[ . 1 . 2 . 3]" 1
145 1 12 ARG H 1 14 GLN H . . 4.410 4.148 3.919 4.299 . 0 0 "[ . 1 . 2 . 3]" 1
146 2 12 ARG H 2 14 GLN H . . 4.410 4.181 3.944 4.304 . 0 0 "[ . 1 . 2 . 3]" 1
147 1 14 GLN H 1 15 ARG H . . 3.290 2.660 2.505 2.754 . 0 0 "[ . 1 . 2 . 3]" 1
148 2 14 GLN H 2 15 ARG H . . 3.290 2.684 2.537 2.758 . 0 0 "[ . 1 . 2 . 3]" 1
149 1 14 GLN H 1 54 HIS HD2 . . 4.410 3.936 3.770 4.303 . 0 0 "[ . 1 . 2 . 3]" 1
150 2 14 GLN H 2 54 HIS HD2 . . 4.410 3.900 3.681 4.360 . 0 0 "[ . 1 . 2 . 3]" 1
151 1 13 LEU H 1 14 GLN H . . 3.370 2.586 2.451 2.755 . 0 0 "[ . 1 . 2 . 3]" 1
152 2 13 LEU H 2 14 GLN H . . 3.370 2.608 2.469 2.759 . 0 0 "[ . 1 . 2 . 3]" 1
153 1 15 ARG HB2 1 16 ILE H . . 3.970 3.194 2.644 3.799 . 0 0 "[ . 1 . 2 . 3]" 1
154 2 15 ARG HB2 2 16 ILE H . . 3.970 3.055 2.637 3.811 . 0 0 "[ . 1 . 2 . 3]" 1
155 1 15 ARG HB3 1 16 ILE H . . 3.970 3.471 2.952 4.020 0.050 26 0 "[ . 1 . 2 . 3]" 1
156 2 15 ARG HB3 2 16 ILE H . . 3.970 3.400 2.960 3.988 0.018 23 0 "[ . 1 . 2 . 3]" 1
157 1 15 ARG H 1 15 ARG HB2 . . 3.700 2.590 2.099 3.608 . 0 0 "[ . 1 . 2 . 3]" 1
158 2 15 ARG H 2 15 ARG HB2 . . 3.700 2.417 2.094 3.613 . 0 0 "[ . 1 . 2 . 3]" 1
159 1 15 ARG H 1 15 ARG HB3 . . 3.700 3.206 2.676 3.575 . 0 0 "[ . 1 . 2 . 3]" 1
160 2 15 ARG H 2 15 ARG HB3 . . 3.700 3.312 2.624 3.579 . 0 0 "[ . 1 . 2 . 3]" 1
161 1 15 ARG H 1 18 ALA MB . . 5.080 4.646 4.490 4.812 . 0 0 "[ . 1 . 2 . 3]" 1
162 2 15 ARG H 2 18 ALA MB . . 5.080 4.695 4.542 4.865 . 0 0 "[ . 1 . 2 . 3]" 1
163 1 15 ARG H 1 15 ARG HG2 . . 4.550 3.605 1.936 4.540 . 0 0 "[ . 1 . 2 . 3]" 1
164 2 15 ARG H 2 15 ARG HG2 . . 4.550 3.865 1.944 4.537 . 0 0 "[ . 1 . 2 . 3]" 1
165 1 15 ARG H 1 15 ARG HG3 . . 4.550 3.193 2.623 3.760 . 0 0 "[ . 1 . 2 . 3]" 1
166 2 15 ARG H 2 15 ARG HG3 . . 4.550 3.147 2.583 3.737 . 0 0 "[ . 1 . 2 . 3]" 1
167 1 14 GLN HB3 1 15 ARG H . . 4.270 3.904 3.567 4.049 . 0 0 "[ . 1 . 2 . 3]" 1
168 2 14 GLN HB3 2 15 ARG H . . 4.270 3.920 3.587 4.034 . 0 0 "[ . 1 . 2 . 3]" 1
169 1 14 GLN HG2 1 15 ARG H . . 4.880 3.005 2.149 3.886 . 0 0 "[ . 1 . 2 . 3]" 1
170 2 14 GLN HG2 2 15 ARG H . . 4.880 2.990 2.134 3.880 . 0 0 "[ . 1 . 2 . 3]" 1
171 1 15 ARG H 1 15 ARG HD2 . . 5.020 4.440 3.883 4.970 . 0 0 "[ . 1 . 2 . 3]" 1
172 2 15 ARG H 2 15 ARG HD2 . . 5.020 4.451 3.861 4.947 . 0 0 "[ . 1 . 2 . 3]" 1
173 1 15 ARG H 1 15 ARG HD3 . . 5.020 4.270 3.532 4.688 . 0 0 "[ . 1 . 2 . 3]" 1
174 2 15 ARG H 2 15 ARG HD3 . . 5.020 4.154 3.533 4.680 . 0 0 "[ . 1 . 2 . 3]" 1
175 1 12 ARG HA 1 15 ARG H . . 4.080 3.617 3.498 3.666 . 0 0 "[ . 1 . 2 . 3]" 1
176 2 12 ARG HA 2 15 ARG H . . 4.080 3.639 3.493 3.685 . 0 0 "[ . 1 . 2 . 3]" 1
177 1 15 ARG H 1 16 ILE H . . 3.430 2.466 2.428 2.530 . 0 0 "[ . 1 . 2 . 3]" 1
178 2 15 ARG H 2 16 ILE H . . 3.430 2.491 2.437 2.568 . 0 0 "[ . 1 . 2 . 3]" 1
179 1 16 ILE H 1 16 ILE MD . . 3.840 3.283 3.126 3.699 . 0 0 "[ . 1 . 2 . 3]" 1
180 2 16 ILE H 2 16 ILE MD . . 3.840 3.224 3.099 3.511 . 0 0 "[ . 1 . 2 . 3]" 1
181 1 16 ILE H 1 16 ILE HG13 . . 4.040 2.253 2.072 2.528 . 0 0 "[ . 1 . 2 . 3]" 1
182 2 16 ILE H 2 16 ILE HG13 . . 4.040 2.224 2.058 2.573 . 0 0 "[ . 1 . 2 . 3]" 1
183 1 16 ILE H 1 16 ILE HG12 . . 4.040 3.693 3.457 3.902 . 0 0 "[ . 1 . 2 . 3]" 1
184 2 16 ILE H 2 16 ILE HG12 . . 4.040 3.682 3.437 3.925 . 0 0 "[ . 1 . 2 . 3]" 1
185 1 16 ILE H 1 16 ILE HB . . 3.430 2.475 2.353 2.545 . 0 0 "[ . 1 . 2 . 3]" 1
186 2 16 ILE H 2 16 ILE HB . . 3.430 2.495 2.333 2.551 . 0 0 "[ . 1 . 2 . 3]" 1
187 1 12 ARG HG3 1 16 ILE H . . 5.500 5.521 5.476 5.568 0.068 20 0 "[ . 1 . 2 . 3]" 1
188 1 16 ILE H 1 37 ALA MB . . 5.500 5.378 5.302 5.490 . 0 0 "[ . 1 . 2 . 3]" 1
189 2 16 ILE H 2 37 ALA MB . . 5.500 5.319 5.212 5.499 . 0 0 "[ . 1 . 2 . 3]" 1
190 1 13 LEU HA 1 16 ILE H . . 4.050 3.301 3.155 3.431 . 0 0 "[ . 1 . 2 . 3]" 1
191 2 13 LEU HA 2 16 ILE H . . 4.050 3.311 3.159 3.434 . 0 0 "[ . 1 . 2 . 3]" 1
192 1 12 ARG HA 1 16 ILE H . . 4.780 4.431 4.126 4.778 . 0 0 "[ . 1 . 2 . 3]" 1
193 2 12 ARG HA 2 16 ILE H . . 4.780 4.443 4.122 4.788 0.008 21 0 "[ . 1 . 2 . 3]" 1
194 1 17 HIS H 1 17 HIS HB2 . . 3.530 2.672 2.565 2.730 . 0 0 "[ . 1 . 2 . 3]" 1
195 2 17 HIS H 2 17 HIS HB2 . . 3.530 2.664 2.568 2.731 . 0 0 "[ . 1 . 2 . 3]" 1
196 1 17 HIS H 1 17 HIS HB3 . . 3.530 2.430 2.380 2.529 . 0 0 "[ . 1 . 2 . 3]" 1
197 2 17 HIS H 2 17 HIS HB3 . . 3.530 2.433 2.377 2.522 . 0 0 "[ . 1 . 2 . 3]" 1
198 1 17 HIS H 1 18 ALA MB . . 4.910 4.198 4.135 4.270 . 0 0 "[ . 1 . 2 . 3]" 1
199 2 17 HIS H 2 18 ALA MB . . 4.910 4.213 4.150 4.268 . 0 0 "[ . 1 . 2 . 3]" 1
200 1 16 ILE HB 1 17 HIS H . . 3.810 2.653 2.578 2.762 . 0 0 "[ . 1 . 2 . 3]" 1
201 2 16 ILE HB 2 17 HIS H . . 3.810 2.661 2.574 2.776 . 0 0 "[ . 1 . 2 . 3]" 1
202 1 25 LYS HG2 1 27 ASP H . . 4.550 3.923 3.497 4.557 0.007 29 0 "[ . 1 . 2 . 3]" 1
203 2 25 LYS HG2 2 27 ASP H . . 4.550 3.884 3.522 4.522 . 0 0 "[ . 1 . 2 . 3]" 1
204 1 16 ILE MD 1 17 HIS H . . 4.950 4.379 4.218 4.743 . 0 0 "[ . 1 . 2 . 3]" 1
205 2 16 ILE MD 2 17 HIS H . . 4.950 4.342 4.197 4.568 . 0 0 "[ . 1 . 2 . 3]" 1
206 1 17 HIS H 1 20 ILE MD . . 5.230 4.382 4.036 4.610 . 0 0 "[ . 1 . 2 . 3]" 1
207 2 17 HIS H 2 20 ILE MD . . 5.230 4.365 4.014 4.595 . 0 0 "[ . 1 . 2 . 3]" 1
208 1 13 LEU HA 1 17 HIS H . . 4.590 4.314 4.010 4.596 0.006 21 0 "[ . 1 . 2 . 3]" 1
209 2 13 LEU HA 2 17 HIS H . . 4.590 4.342 3.946 4.608 0.018 21 0 "[ . 1 . 2 . 3]" 1
210 1 17 HIS H 1 18 ALA H . . 3.350 2.573 2.519 2.642 . 0 0 "[ . 1 . 2 . 3]" 1
211 2 17 HIS H 2 18 ALA H . . 3.350 2.587 2.530 2.677 . 0 0 "[ . 1 . 2 . 3]" 1
212 1 15 ARG HA 1 18 ALA H . . 3.970 3.446 3.344 3.545 . 0 0 "[ . 1 . 2 . 3]" 1
213 2 15 ARG HA 2 18 ALA H . . 3.970 3.457 3.360 3.560 . 0 0 "[ . 1 . 2 . 3]" 1
214 1 17 HIS HB2 1 18 ALA H . . 3.990 3.905 3.806 3.979 . 0 0 "[ . 1 . 2 . 3]" 1
215 2 17 HIS HB2 2 18 ALA H . . 3.990 3.904 3.787 3.986 . 0 0 "[ . 1 . 2 . 3]" 1
216 1 17 HIS HB3 1 18 ALA H . . 3.990 2.579 2.423 2.742 . 0 0 "[ . 1 . 2 . 3]" 1
217 2 17 HIS HB3 2 18 ALA H . . 3.990 2.578 2.395 2.739 . 0 0 "[ . 1 . 2 . 3]" 1
218 1 18 ALA H 1 19 GLU QG . . 4.660 4.568 4.243 4.678 0.018 21 0 "[ . 1 . 2 . 3]" 1
219 2 18 ALA H 2 19 GLU QG . . 4.660 4.534 4.233 4.672 0.012 11 0 "[ . 1 . 2 . 3]" 1
220 1 18 ALA H 1 18 ALA MB . . 2.830 2.147 2.037 2.244 . 0 0 "[ . 1 . 2 . 3]" 1
221 2 18 ALA H 2 18 ALA MB . . 2.830 2.146 2.036 2.244 . 0 0 "[ . 1 . 2 . 3]" 1
222 1 19 GLU H 1 20 ILE HB . . 5.490 5.037 4.956 5.079 . 0 0 "[ . 1 . 2 . 3]" 1
223 2 19 GLU H 2 20 ILE HB . . 5.490 5.033 5.002 5.076 . 0 0 "[ . 1 . 2 . 3]" 1
224 1 16 ILE HA 1 19 GLU H . . 4.200 3.753 3.644 3.873 . 0 0 "[ . 1 . 2 . 3]" 1
225 2 16 ILE HA 2 19 GLU H . . 4.200 3.713 3.606 3.865 . 0 0 "[ . 1 . 2 . 3]" 1
226 1 15 ARG HA 1 19 GLU H . . 4.610 3.671 3.590 3.776 . 0 0 "[ . 1 . 2 . 3]" 1
227 2 15 ARG HA 2 19 GLU H . . 4.610 3.726 3.600 3.847 . 0 0 "[ . 1 . 2 . 3]" 1
228 1 18 ALA H 1 19 GLU H . . 3.370 2.656 2.566 2.767 . 0 0 "[ . 1 . 2 . 3]" 1
229 2 18 ALA H 2 19 GLU H . . 3.370 2.643 2.558 2.757 . 0 0 "[ . 1 . 2 . 3]" 1
230 1 19 GLU H 1 21 LYS H . . 4.600 4.073 3.966 4.204 . 0 0 "[ . 1 . 2 . 3]" 1
231 2 19 GLU H 2 21 LYS H . . 4.600 4.085 3.981 4.186 . 0 0 "[ . 1 . 2 . 3]" 1
232 1 19 GLU H 1 20 ILE H . . 3.460 2.818 2.748 2.896 . 0 0 "[ . 1 . 2 . 3]" 1
233 2 19 GLU H 2 20 ILE H . . 3.460 2.813 2.748 2.895 . 0 0 "[ . 1 . 2 . 3]" 1
234 1 20 ILE H 1 21 LYS H . . 3.590 2.613 2.463 2.750 . 0 0 "[ . 1 . 2 . 3]" 1
235 2 20 ILE H 2 21 LYS H . . 3.590 2.617 2.460 2.756 . 0 0 "[ . 1 . 2 . 3]" 1
236 1 20 ILE H 1 22 ASN H . . 4.720 4.477 4.307 4.577 . 0 0 "[ . 1 . 2 . 3]" 1
237 2 20 ILE H 2 22 ASN H . . 4.720 4.464 4.284 4.575 . 0 0 "[ . 1 . 2 . 3]" 1
238 1 18 ALA H 1 20 ILE H . . 4.860 4.300 4.090 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
239 2 18 ALA H 2 20 ILE H . . 4.860 4.291 4.111 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
240 1 20 ILE H 1 23 SER H . . 5.330 4.659 4.578 4.702 . 0 0 "[ . 1 . 2 . 3]" 1
241 2 20 ILE H 2 23 SER H . . 5.330 4.655 4.590 4.696 . 0 0 "[ . 1 . 2 . 3]" 1
242 1 19 GLU QG 1 20 ILE H . . 4.240 4.180 4.004 4.302 0.062 25 0 "[ . 1 . 2 . 3]" 1
243 2 19 GLU QG 2 20 ILE H . . 4.240 4.174 4.011 4.261 0.021 30 0 "[ . 1 . 2 . 3]" 1
244 1 20 ILE H 1 20 ILE HB . . 3.230 2.537 2.480 2.598 . 0 0 "[ . 1 . 2 . 3]" 1
245 2 20 ILE H 2 20 ILE HB . . 3.230 2.537 2.494 2.595 . 0 0 "[ . 1 . 2 . 3]" 1
246 1 20 ILE H 1 21 LYS HB2 . . 5.500 4.688 4.372 4.925 . 0 0 "[ . 1 . 2 . 3]" 1
247 2 20 ILE H 2 21 LYS HB2 . . 5.500 4.694 4.415 4.933 . 0 0 "[ . 1 . 2 . 3]" 1
248 1 20 ILE H 1 21 LYS HB3 . . 5.500 5.136 4.839 5.542 0.042 14 0 "[ . 1 . 2 . 3]" 1
249 2 20 ILE H 2 21 LYS HB3 . . 5.500 5.135 4.861 5.531 0.031 14 0 "[ . 1 . 2 . 3]" 1
250 1 20 ILE H 1 37 ALA MB . . 3.990 3.548 3.413 3.799 . 0 0 "[ . 1 . 2 . 3]" 1
251 2 20 ILE H 2 37 ALA MB . . 3.990 3.543 3.386 3.720 . 0 0 "[ . 1 . 2 . 3]" 1
252 1 20 ILE H 1 20 ILE HG13 . . 4.170 2.118 1.959 2.268 . 0 0 "[ . 1 . 2 . 3]" 1
253 2 20 ILE H 2 20 ILE HG13 . . 4.170 2.117 1.967 2.274 . 0 0 "[ . 1 . 2 . 3]" 1
254 1 20 ILE H 1 20 ILE MD . . 3.370 3.292 3.173 3.369 . 0 0 "[ . 1 . 2 . 3]" 1
255 2 20 ILE H 2 20 ILE MD . . 3.370 3.291 3.202 3.369 . 0 0 "[ . 1 . 2 . 3]" 1
256 1 20 ILE MG 1 21 LYS H . . 3.660 3.612 3.487 3.668 0.008 22 0 "[ . 1 . 2 . 3]" 1
257 2 20 ILE MG 2 21 LYS H . . 3.660 3.599 3.545 3.664 0.004 18 0 "[ . 1 . 2 . 3]" 1
258 1 21 LYS H 1 21 LYS HB2 . . 3.800 2.297 2.078 2.474 . 0 0 "[ . 1 . 2 . 3]" 1
259 2 21 LYS H 2 21 LYS HB2 . . 3.800 2.297 2.084 2.474 . 0 0 "[ . 1 . 2 . 3]" 1
260 1 21 LYS H 1 21 LYS HB3 . . 3.800 2.779 2.573 3.146 . 0 0 "[ . 1 . 2 . 3]" 1
261 2 21 LYS H 2 21 LYS HB3 . . 3.800 2.780 2.573 3.124 . 0 0 "[ . 1 . 2 . 3]" 1
262 1 21 LYS H 1 24 LEU HB2 . . 5.500 5.011 4.878 5.188 . 0 0 "[ . 1 . 2 . 3]" 1
263 1 21 LYS H 1 60 THR MG . . 5.500 5.330 5.090 5.499 . 0 0 "[ . 1 . 2 . 3]" 1
264 2 21 LYS H 2 60 THR MG . . 5.500 5.321 5.179 5.496 . 0 0 "[ . 1 . 2 . 3]" 1
265 1 20 ILE HB 1 21 LYS H . . 3.570 2.791 2.740 2.902 . 0 0 "[ . 1 . 2 . 3]" 1
266 2 20 ILE HB 2 21 LYS H . . 3.570 2.773 2.723 2.875 . 0 0 "[ . 1 . 2 . 3]" 1
267 1 18 ALA HA 1 21 LYS H . . 4.200 3.331 3.151 3.503 . 0 0 "[ . 1 . 2 . 3]" 1
268 2 18 ALA HA 2 21 LYS H . . 4.200 3.333 3.177 3.510 . 0 0 "[ . 1 . 2 . 3]" 1
269 1 17 HIS HA 1 21 LYS H . . 5.140 4.584 4.225 4.850 . 0 0 "[ . 1 . 2 . 3]" 1
270 2 17 HIS HA 2 21 LYS H . . 5.140 4.588 4.214 4.865 . 0 0 "[ . 1 . 2 . 3]" 1
271 1 19 GLU HA 1 21 LYS H . . 5.500 4.266 4.169 4.386 . 0 0 "[ . 1 . 2 . 3]" 1
272 2 19 GLU HA 2 21 LYS H . . 5.500 4.284 4.189 4.400 . 0 0 "[ . 1 . 2 . 3]" 1
273 1 17 HIS HD2 1 21 LYS H . . 4.510 4.290 4.054 4.512 0.002 19 0 "[ . 1 . 2 . 3]" 1
274 2 17 HIS HD2 2 21 LYS H . . 4.510 4.302 4.038 4.514 0.004 15 0 "[ . 1 . 2 . 3]" 1
275 1 21 LYS H 1 22 ASN H . . 3.520 2.798 2.705 2.904 . 0 0 "[ . 1 . 2 . 3]" 1
276 2 21 LYS H 2 22 ASN H . . 3.520 2.800 2.689 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
277 1 20 ILE MG 1 22 ASN H . . 5.260 5.187 5.090 5.267 0.007 6 0 "[ . 1 . 2 . 3]" 1
278 2 20 ILE MG 2 22 ASN H . . 5.260 5.176 5.078 5.279 0.019 18 0 "[ . 1 . 2 . 3]" 1
279 1 21 LYS HG3 1 22 ASN H . . 4.930 4.839 4.462 4.936 0.006 5 0 "[ . 1 . 2 . 3]" 1
280 2 21 LYS HG3 2 22 ASN H . . 4.930 4.834 4.409 4.936 0.006 13 0 "[ . 1 . 2 . 3]" 1
281 1 21 LYS HG2 1 22 ASN H . . 4.930 4.062 3.605 4.547 . 0 0 "[ . 1 . 2 . 3]" 1
282 2 21 LYS HG2 2 22 ASN H . . 4.930 4.065 3.604 4.542 . 0 0 "[ . 1 . 2 . 3]" 1
283 1 21 LYS HB2 1 22 ASN H . . 4.020 3.573 3.159 3.777 . 0 0 "[ . 1 . 2 . 3]" 1
284 2 21 LYS HB2 2 22 ASN H . . 4.020 3.578 3.200 3.771 . 0 0 "[ . 1 . 2 . 3]" 1
285 1 21 LYS HB3 1 22 ASN H . . 4.020 2.383 2.305 2.522 . 0 0 "[ . 1 . 2 . 3]" 1
286 2 21 LYS HB3 2 22 ASN H . . 4.020 2.390 2.308 2.550 . 0 0 "[ . 1 . 2 . 3]" 1
287 1 18 ALA MB 1 22 ASN H . . 4.810 4.633 4.410 4.806 . 0 0 "[ . 1 . 2 . 3]" 1
288 2 18 ALA MB 2 22 ASN H . . 4.810 4.632 4.473 4.810 . 0 0 "[ . 1 . 2 . 3]" 1
289 1 22 ASN H 1 22 ASN HB2 . . 3.760 2.767 2.250 3.608 . 0 0 "[ . 1 . 2 . 3]" 1
290 2 22 ASN H 2 22 ASN HB2 . . 3.760 2.682 2.248 3.609 . 0 0 "[ . 1 . 2 . 3]" 1
291 1 22 ASN H 1 22 ASN HB3 . . 3.760 3.342 2.517 3.609 . 0 0 "[ . 1 . 2 . 3]" 1
292 2 22 ASN H 2 22 ASN HB3 . . 3.760 3.424 2.508 3.611 . 0 0 "[ . 1 . 2 . 3]" 1
293 1 22 ASN H 1 24 LEU H . . 4.640 3.930 3.860 4.042 . 0 0 "[ . 1 . 2 . 3]" 1
294 2 22 ASN H 2 24 LEU H . . 4.640 3.929 3.846 4.046 . 0 0 "[ . 1 . 2 . 3]" 1
295 1 18 ALA MB 1 22 ASN HD22 . . 4.450 3.689 2.942 4.472 0.022 28 0 "[ . 1 . 2 . 3]" 1
296 2 18 ALA MB 2 22 ASN HD22 . . 4.450 3.647 2.925 4.476 0.026 28 0 "[ . 1 . 2 . 3]" 1
297 1 23 SER H 1 23 SER HB2 . . 3.730 3.279 2.284 3.616 . 0 0 "[ . 1 . 2 . 3]" 1
298 2 23 SER H 2 23 SER HB2 . . 3.730 3.287 2.241 3.619 . 0 0 "[ . 1 . 2 . 3]" 1
299 1 23 SER H 1 23 SER HB3 . . 3.730 2.682 2.263 3.612 . 0 0 "[ . 1 . 2 . 3]" 1
300 2 23 SER H 2 23 SER HB3 . . 3.730 2.688 2.262 3.613 . 0 0 "[ . 1 . 2 . 3]" 1
301 1 20 ILE HA 1 23 SER H . . 4.360 3.302 3.160 3.434 . 0 0 "[ . 1 . 2 . 3]" 1
302 2 20 ILE HA 2 23 SER H . . 4.360 3.298 3.142 3.405 . 0 0 "[ . 1 . 2 . 3]" 1
303 1 22 ASN HB2 1 23 SER H . . 4.150 3.158 2.805 4.015 . 0 0 "[ . 1 . 2 . 3]" 1
304 2 22 ASN HB2 2 23 SER H . . 4.150 3.067 2.804 4.046 . 0 0 "[ . 1 . 2 . 3]" 1
305 1 22 ASN HB3 1 23 SER H . . 4.150 3.909 3.590 4.147 . 0 0 "[ . 1 . 2 . 3]" 1
306 2 22 ASN HB3 2 23 SER H . . 4.150 3.900 3.593 4.167 0.017 18 0 "[ . 1 . 2 . 3]" 1
307 1 23 SER H 1 25 LYS QE . . 5.500 5.282 5.072 5.544 0.044 17 0 "[ . 1 . 2 . 3]" 1
308 2 23 SER H 2 25 LYS QE . . 5.500 5.281 5.075 5.550 0.050 28 0 "[ . 1 . 2 . 3]" 1
309 1 62 LYS HA 1 64 ILE H . . 4.800 4.307 4.268 4.339 . 0 0 "[ . 1 . 2 . 3]" 1
310 2 62 LYS HA 2 64 ILE H . . 4.800 4.309 4.260 4.340 . 0 0 "[ . 1 . 2 . 3]" 1
311 1 23 SER H 1 25 LYS QD . . 5.140 4.577 4.367 5.067 . 0 0 "[ . 1 . 2 . 3]" 1
312 2 23 SER H 2 25 LYS QD . . 5.140 4.579 4.371 5.135 . 0 0 "[ . 1 . 2 . 3]" 1
313 1 64 ILE H 1 65 ARG QB . . 4.850 4.252 4.214 4.277 . 0 0 "[ . 1 . 2 . 3]" 1
314 2 64 ILE H 2 65 ARG QB . . 4.850 4.253 4.212 4.270 . 0 0 "[ . 1 . 2 . 3]" 1
315 1 23 SER H 1 24 LEU HB2 . . 4.500 4.473 4.318 4.557 0.057 25 0 "[ . 1 . 2 . 3]" 1
316 1 23 SER H 1 24 LEU H . . 3.310 2.503 2.425 2.551 . 0 0 "[ . 1 . 2 . 3]" 1
317 2 23 SER H 2 24 LEU H . . 3.310 2.501 2.425 2.541 . 0 0 "[ . 1 . 2 . 3]" 1
318 1 23 SER H 1 25 LYS H . . 4.530 4.381 4.203 4.476 . 0 0 "[ . 1 . 2 . 3]" 1
319 2 23 SER H 2 25 LYS H . . 4.530 4.379 4.198 4.466 . 0 0 "[ . 1 . 2 . 3]" 1
320 1 21 LYS H 1 23 SER H . . 4.670 3.859 3.791 3.914 . 0 0 "[ . 1 . 2 . 3]" 1
321 2 21 LYS H 2 23 SER H . . 4.670 3.867 3.775 3.929 . 0 0 "[ . 1 . 2 . 3]" 1
322 1 22 ASN H 1 23 SER H . . 3.360 2.484 2.447 2.545 . 0 0 "[ . 1 . 2 . 3]" 1
323 2 22 ASN H 2 23 SER H . . 3.360 2.485 2.442 2.537 . 0 0 "[ . 1 . 2 . 3]" 1
324 1 23 SER HB2 1 24 LEU H . . 4.920 4.072 2.952 4.484 . 0 0 "[ . 1 . 2 . 3]" 1
325 2 23 SER HB2 2 24 LEU H . . 4.920 4.065 2.921 4.497 . 0 0 "[ . 1 . 2 . 3]" 1
326 1 24 LEU H 1 25 LYS HA . . 5.300 4.472 4.356 4.689 . 0 0 "[ . 1 . 2 . 3]" 1
327 2 24 LEU H 2 25 LYS HA . . 5.300 4.473 4.355 4.694 . 0 0 "[ . 1 . 2 . 3]" 1
328 1 23 SER HB3 1 24 LEU H . . 4.920 4.063 3.762 4.312 . 0 0 "[ . 1 . 2 . 3]" 1
329 2 23 SER HB3 2 24 LEU H . . 4.920 4.069 3.692 4.313 . 0 0 "[ . 1 . 2 . 3]" 1
330 1 21 LYS HA 1 24 LEU H . . 4.430 3.770 3.532 3.922 . 0 0 "[ . 1 . 2 . 3]" 1
331 2 21 LYS HA 2 24 LEU H . . 4.430 3.762 3.542 3.926 . 0 0 "[ . 1 . 2 . 3]" 1
332 1 24 LEU H 1 24 LEU HB2 . . 3.520 2.440 2.273 2.544 . 0 0 "[ . 1 . 2 . 3]" 1
333 2 24 LEU H 2 24 LEU HB2 . . 3.870 2.443 2.273 2.554 . 0 0 "[ . 1 . 2 . 3]" 1
334 1 24 LEU H 1 24 LEU HB3 . . 3.870 3.653 3.549 3.721 . 0 0 "[ . 1 . 2 . 3]" 1
335 2 24 LEU H 2 24 LEU HB3 . . 3.870 3.655 3.549 3.728 . 0 0 "[ . 1 . 2 . 3]" 1
336 1 24 LEU H 1 24 LEU HG . . 3.920 3.182 2.946 3.377 . 0 0 "[ . 1 . 2 . 3]" 1
337 2 24 LEU H 2 24 LEU HG . . 3.920 3.172 2.894 3.388 . 0 0 "[ . 1 . 2 . 3]" 1
338 1 24 LEU H 1 25 LYS QD . . 4.160 3.880 3.216 4.186 0.026 4 0 "[ . 1 . 2 . 3]" 1
339 2 24 LEU H 2 25 LYS QD . . 4.160 3.899 3.228 4.194 0.034 30 0 "[ . 1 . 2 . 3]" 1
340 1 26 ILE MG 2 24 LEU H . . 5.150 4.515 4.307 4.671 . 0 0 "[ . 1 . 2 . 3]" 1
341 1 24 LEU H 2 26 ILE MG . . 5.150 4.512 4.334 4.680 . 0 0 "[ . 1 . 2 . 3]" 1
342 1 24 LEU HB3 1 25 LYS H . . 4.530 4.353 4.316 4.388 . 0 0 "[ . 1 . 2 . 3]" 1
343 2 24 LEU HB3 2 25 LYS H . . 4.560 4.355 4.316 4.392 . 0 0 "[ . 1 . 2 . 3]" 1
344 1 24 LEU HB2 1 25 LYS H . . 4.560 4.042 4.020 4.068 . 0 0 "[ . 1 . 2 . 3]" 1
345 2 24 LEU HB2 2 25 LYS H . . 4.560 4.041 4.019 4.068 . 0 0 "[ . 1 . 2 . 3]" 1
346 1 25 LYS H 1 25 LYS QD . . 3.970 3.080 2.751 3.337 . 0 0 "[ . 1 . 2 . 3]" 1
347 2 25 LYS H 2 25 LYS QD . . 3.970 3.090 2.763 3.361 . 0 0 "[ . 1 . 2 . 3]" 1
348 1 25 LYS H 1 25 LYS HB2 . . 3.700 2.079 2.068 2.133 . 0 0 "[ . 1 . 2 . 3]" 1
349 2 25 LYS H 2 25 LYS HB2 . . 3.700 2.079 2.069 2.141 . 0 0 "[ . 1 . 2 . 3]" 1
350 1 25 LYS H 1 25 LYS QE . . 4.870 4.593 4.213 4.866 . 0 0 "[ . 1 . 2 . 3]" 1
351 2 25 LYS H 2 25 LYS QE . . 4.870 4.577 4.243 4.879 0.009 8 0 "[ . 1 . 2 . 3]" 1
352 1 24 LEU HA 1 25 LYS H . . 3.400 2.969 2.963 2.975 . 0 0 "[ . 1 . 2 . 3]" 1
353 2 24 LEU HA 2 25 LYS H . . 3.400 2.969 2.962 2.975 . 0 0 "[ . 1 . 2 . 3]" 1
354 1 24 LEU H 1 25 LYS H . . 3.210 2.562 2.436 2.804 . 0 0 "[ . 1 . 2 . 3]" 1
355 2 24 LEU H 2 25 LYS H . . 3.210 2.564 2.434 2.806 . 0 0 "[ . 1 . 2 . 3]" 1
356 1 26 ILE H 1 26 ILE MG . . 3.410 1.870 1.837 1.902 . 0 0 "[ . 1 . 2 . 3]" 1
357 2 26 ILE H 2 26 ILE MG . . 3.410 1.866 1.834 1.898 . 0 0 "[ . 1 . 2 . 3]" 1
358 1 26 ILE H 1 26 ILE HB . . 3.170 2.736 2.719 2.754 . 0 0 "[ . 1 . 2 . 3]" 1
359 2 26 ILE H 2 26 ILE HB . . 3.170 2.739 2.716 2.771 . 0 0 "[ . 1 . 2 . 3]" 1
360 1 25 LYS HA 1 26 ILE H . . 3.010 2.476 2.450 2.492 . 0 0 "[ . 1 . 2 . 3]" 1
361 2 25 LYS HA 2 26 ILE H . . 3.010 2.479 2.451 2.496 . 0 0 "[ . 1 . 2 . 3]" 1
362 1 98 THR HA 1 99 GLN H . . 3.300 2.519 2.142 3.508 0.208 27 0 "[ . 1 . 2 . 3]" 1
363 2 98 THR HA 2 99 GLN H . . 3.300 2.576 2.142 3.553 0.253 23 0 "[ . 1 . 2 . 3]" 1
364 1 25 LYS H 1 26 ILE H . . 4.790 4.601 4.593 4.610 . 0 0 "[ . 1 . 2 . 3]" 1
365 2 25 LYS H 2 26 ILE H . . 4.790 4.600 4.590 4.611 . 0 0 "[ . 1 . 2 . 3]" 1
366 1 25 LYS HA 1 27 ASP H . . 4.600 4.466 4.399 4.530 . 0 0 "[ . 1 . 2 . 3]" 1
367 2 25 LYS HA 2 27 ASP H . . 4.600 4.473 4.419 4.551 . 0 0 "[ . 1 . 2 . 3]" 1
368 1 26 ILE HA 1 27 ASP H . . 3.550 3.529 3.522 3.538 . 0 0 "[ . 1 . 2 . 3]" 1
369 2 26 ILE HA 2 27 ASP H . . 3.550 3.530 3.520 3.541 . 0 0 "[ . 1 . 2 . 3]" 1
370 1 27 ASP H 1 27 ASP HB2 . . 3.690 3.282 2.579 3.670 . 0 0 "[ . 1 . 2 . 3]" 1
371 2 27 ASP H 2 27 ASP HB2 . . 3.690 3.281 2.574 3.671 . 0 0 "[ . 1 . 2 . 3]" 1
372 1 27 ASP H 1 27 ASP HB3 . . 3.690 2.665 2.346 2.864 . 0 0 "[ . 1 . 2 . 3]" 1
373 2 27 ASP H 2 27 ASP HB3 . . 3.690 2.665 2.343 2.863 . 0 0 "[ . 1 . 2 . 3]" 1
374 1 26 ILE HB 1 27 ASP H . . 4.060 3.924 3.887 3.955 . 0 0 "[ . 1 . 2 . 3]" 1
375 2 26 ILE HB 2 27 ASP H . . 4.060 3.924 3.886 3.962 . 0 0 "[ . 1 . 2 . 3]" 1
376 1 25 LYS HG3 1 27 ASP H . . 4.550 4.036 3.201 4.580 0.030 6 0 "[ . 1 . 2 . 3]" 1
377 2 25 LYS HG3 2 27 ASP H . . 4.550 4.062 3.222 4.579 0.029 5 0 "[ . 1 . 2 . 3]" 1
378 1 26 ILE HG13 1 27 ASP H . . 5.070 3.791 3.709 3.852 . 0 0 "[ . 1 . 2 . 3]" 1
379 2 26 ILE HG13 2 27 ASP H . . 5.070 3.781 3.690 3.837 . 0 0 "[ . 1 . 2 . 3]" 1
380 1 26 ILE MG 1 27 ASP H . . 3.500 1.950 1.871 2.082 . 0 0 "[ . 1 . 2 . 3]" 1
381 2 26 ILE MG 2 27 ASP H . . 3.500 1.949 1.863 2.090 . 0 0 "[ . 1 . 2 . 3]" 1
382 1 26 ILE H 1 27 ASP H . . 3.680 2.377 2.365 2.391 . 0 0 "[ . 1 . 2 . 3]" 1
383 2 26 ILE H 2 27 ASP H . . 3.680 2.378 2.364 2.402 . 0 0 "[ . 1 . 2 . 3]" 1
384 1 26 ILE MG 1 28 ASN H . . 4.380 3.825 3.743 3.912 . 0 0 "[ . 1 . 2 . 3]" 1
385 2 26 ILE MG 2 28 ASN H . . 4.380 3.821 3.727 3.920 . 0 0 "[ . 1 . 2 . 3]" 1
386 1 26 ILE MD 1 28 ASN H . . 5.500 5.603 5.556 5.620 0.120 25 0 "[ . 1 . 2 . 3]" 1
387 2 26 ILE MD 2 28 ASN H . . 5.500 5.599 5.553 5.626 0.126 24 0 "[ . 1 . 2 . 3]" 1
388 1 25 LYS HB2 1 28 ASN H . . 4.210 3.257 3.085 3.537 . 0 0 "[ . 1 . 2 . 3]" 1
389 2 25 LYS HB2 2 28 ASN H . . 4.210 3.263 3.122 3.539 . 0 0 "[ . 1 . 2 . 3]" 1
390 1 25 LYS HB3 1 28 ASN H . . 4.210 1.892 1.877 1.939 . 0 0 "[ . 1 . 2 . 3]" 1
391 2 25 LYS HB3 2 28 ASN H . . 4.210 1.891 1.875 1.925 . 0 0 "[ . 1 . 2 . 3]" 1
392 1 28 ASN H 1 29 LEU QB . . 4.520 4.366 4.319 4.392 . 0 0 "[ . 1 . 2 . 3]" 1
393 2 28 ASN H 2 29 LEU QB . . 4.520 4.369 4.312 4.406 . 0 0 "[ . 1 . 2 . 3]" 1
394 1 28 ASN H 1 28 ASN HB3 . . 3.730 3.003 2.672 3.667 . 0 0 "[ . 1 . 2 . 3]" 1
395 2 28 ASN H 2 28 ASN HB3 . . 3.730 3.002 2.670 3.667 . 0 0 "[ . 1 . 2 . 3]" 1
396 1 28 ASN H 1 28 ASN HB2 . . 3.730 2.598 2.383 2.828 . 0 0 "[ . 1 . 2 . 3]" 1
397 2 28 ASN H 2 28 ASN HB2 . . 3.730 2.596 2.381 2.825 . 0 0 "[ . 1 . 2 . 3]" 1
398 1 27 ASP HB3 1 28 ASN H . . 4.530 3.524 2.787 4.066 . 0 0 "[ . 1 . 2 . 3]" 1
399 2 27 ASP HB3 2 28 ASN H . . 4.530 3.523 2.787 4.073 . 0 0 "[ . 1 . 2 . 3]" 1
400 1 26 ILE HA 1 28 ASN H . . 4.870 4.620 4.521 4.657 . 0 0 "[ . 1 . 2 . 3]" 1
401 2 26 ILE HA 2 28 ASN H . . 4.870 4.623 4.528 4.659 . 0 0 "[ . 1 . 2 . 3]" 1
402 1 25 LYS HA 1 28 ASN H . . 5.040 4.590 4.545 4.625 . 0 0 "[ . 1 . 2 . 3]" 1
403 2 25 LYS HA 2 28 ASN H . . 5.040 4.594 4.555 4.625 . 0 0 "[ . 1 . 2 . 3]" 1
404 1 28 ASN H 1 29 LEU HA . . 5.350 4.446 4.353 4.507 . 0 0 "[ . 1 . 2 . 3]" 1
405 2 28 ASN H 2 29 LEU HA . . 5.350 4.449 4.356 4.508 . 0 0 "[ . 1 . 2 . 3]" 1
406 1 27 ASP H 1 28 ASN H . . 3.170 2.231 2.201 2.276 . 0 0 "[ . 1 . 2 . 3]" 1
407 2 27 ASP H 2 28 ASN H . . 3.170 2.232 2.202 2.273 . 0 0 "[ . 1 . 2 . 3]" 1
408 1 25 LYS H 1 28 ASN H . . 4.760 4.612 4.490 4.719 . 0 0 "[ . 1 . 2 . 3]" 1
409 2 25 LYS H 2 28 ASN H . . 4.760 4.614 4.521 4.713 . 0 0 "[ . 1 . 2 . 3]" 1
410 1 26 ILE H 1 28 ASN H . . 4.570 3.586 3.542 3.637 . 0 0 "[ . 1 . 2 . 3]" 1
411 2 26 ILE H 2 28 ASN H . . 4.570 3.583 3.546 3.619 . 0 0 "[ . 1 . 2 . 3]" 1
412 1 29 LEU H 1 30 ASP H . . 4.560 4.369 4.362 4.381 . 0 0 "[ . 1 . 2 . 3]" 1
413 2 29 LEU H 2 30 ASP H . . 4.560 4.368 4.362 4.372 . 0 0 "[ . 1 . 2 . 3]" 1
414 1 27 ASP H 1 29 LEU H . . 4.380 4.096 4.073 4.141 . 0 0 "[ . 1 . 2 . 3]" 1
415 2 27 ASP H 2 29 LEU H . . 4.380 4.099 4.068 4.128 . 0 0 "[ . 1 . 2 . 3]" 1
416 1 28 ASN H 1 29 LEU H . . 3.000 2.828 2.757 2.882 . 0 0 "[ . 1 . 2 . 3]" 1
417 2 28 ASN H 2 29 LEU H . . 3.000 2.831 2.755 2.878 . 0 0 "[ . 1 . 2 . 3]" 1
418 1 28 ASN HA 1 29 LEU H . . 3.030 2.846 2.837 2.851 . 0 0 "[ . 1 . 2 . 3]" 1
419 2 28 ASN HA 2 29 LEU H . . 3.030 2.846 2.836 2.851 . 0 0 "[ . 1 . 2 . 3]" 1
420 1 27 ASP HA 1 29 LEU H . . 4.560 3.894 3.823 4.014 . 0 0 "[ . 1 . 2 . 3]" 1
421 2 27 ASP HA 2 29 LEU H . . 4.560 3.891 3.825 4.009 . 0 0 "[ . 1 . 2 . 3]" 1
422 1 26 ILE HA 1 29 LEU H . . 4.540 4.367 4.180 4.469 . 0 0 "[ . 1 . 2 . 3]" 1
423 2 26 ILE HA 2 29 LEU H . . 4.540 4.372 4.174 4.446 . 0 0 "[ . 1 . 2 . 3]" 1
424 1 28 ASN HB2 1 29 LEU H . . 4.700 4.469 4.208 4.582 . 0 0 "[ . 1 . 2 . 3]" 1
425 2 28 ASN HB2 2 29 LEU H . . 4.700 4.469 4.208 4.583 . 0 0 "[ . 1 . 2 . 3]" 1
426 1 28 ASN HB3 1 29 LEU H . . 4.700 4.210 4.164 4.408 . 0 0 "[ . 1 . 2 . 3]" 1
427 2 28 ASN HB3 2 29 LEU H . . 4.700 4.210 4.166 4.409 . 0 0 "[ . 1 . 2 . 3]" 1
428 1 29 LEU H 1 29 LEU QB . . 2.720 2.215 2.187 2.231 . 0 0 "[ . 1 . 2 . 3]" 1
429 2 29 LEU H 2 29 LEU QB . . 2.720 2.216 2.188 2.230 . 0 0 "[ . 1 . 2 . 3]" 1
430 1 30 ASP H 1 32 ASN H . . 5.250 5.221 5.142 5.280 0.030 28 0 "[ . 1 . 2 . 3]" 1
431 2 30 ASP H 2 32 ASN H . . 5.250 5.220 5.152 5.283 0.033 28 0 "[ . 1 . 2 . 3]" 1
432 1 29 LEU HA 1 30 ASP H . . 3.110 2.156 2.152 2.159 . 0 0 "[ . 1 . 2 . 3]" 1
433 2 29 LEU HA 2 30 ASP H . . 3.110 2.156 2.155 2.158 . 0 0 "[ . 1 . 2 . 3]" 1
434 1 24 LEU HA 1 30 ASP H . . 4.510 3.359 3.207 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
435 2 24 LEU HA 2 30 ASP H . . 4.510 3.356 3.238 3.565 . 0 0 "[ . 1 . 2 . 3]" 1
436 1 30 ASP H 1 30 ASP HB2 . . 3.980 2.647 2.473 3.041 . 0 0 "[ . 1 . 2 . 3]" 1
437 2 30 ASP H 2 30 ASP HB2 . . 3.980 2.650 2.479 3.039 . 0 0 "[ . 1 . 2 . 3]" 1
438 1 30 ASP H 1 30 ASP HB3 . . 3.980 3.484 2.828 3.805 . 0 0 "[ . 1 . 2 . 3]" 1
439 2 30 ASP H 2 30 ASP HB3 . . 3.980 3.486 2.830 3.804 . 0 0 "[ . 1 . 2 . 3]" 1
440 1 29 LEU MD1 1 30 ASP H . . 4.970 3.361 3.252 3.453 . 0 0 "[ . 1 . 2 . 3]" 1
441 2 29 LEU MD1 2 30 ASP H . . 4.970 3.367 3.212 3.573 . 0 0 "[ . 1 . 2 . 3]" 1
442 1 31 VAL H 1 31 VAL MG1 . . 3.200 2.357 2.173 2.440 . 0 0 "[ . 1 . 2 . 3]" 1
443 2 31 VAL H 2 31 VAL MG1 . . 3.200 2.354 2.176 2.457 . 0 0 "[ . 1 . 2 . 3]" 1
444 1 29 LEU HG 1 31 VAL H . . 4.810 3.022 2.502 3.289 . 0 0 "[ . 1 . 2 . 3]" 1
445 2 29 LEU HG 2 31 VAL H . . 4.810 3.039 2.661 3.283 . 0 0 "[ . 1 . 2 . 3]" 1
446 1 30 ASP HA 1 31 VAL H . . 3.160 2.397 2.321 2.558 . 0 0 "[ . 1 . 2 . 3]" 1
447 2 30 ASP HA 2 31 VAL H . . 3.160 2.392 2.320 2.517 . 0 0 "[ . 1 . 2 . 3]" 1
448 1 31 VAL H 1 32 ASN H . . 3.390 2.727 2.626 2.802 . 0 0 "[ . 1 . 2 . 3]" 1
449 2 31 VAL H 2 32 ASN H . . 3.390 2.723 2.619 2.786 . 0 0 "[ . 1 . 2 . 3]" 1
450 1 30 ASP H 1 31 VAL H . . 4.360 3.440 3.174 3.575 . 0 0 "[ . 1 . 2 . 3]" 1
451 2 30 ASP H 2 31 VAL H . . 4.360 3.447 3.228 3.573 . 0 0 "[ . 1 . 2 . 3]" 1
452 1 32 ASN H 1 32 ASN HB2 . . 3.740 2.475 2.101 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
453 2 32 ASN H 2 32 ASN HB2 . . 3.740 2.473 2.100 3.590 . 0 0 "[ . 1 . 2 . 3]" 1
454 1 31 VAL MG1 1 32 ASN H . . 4.380 4.098 4.044 4.125 . 0 0 "[ . 1 . 2 . 3]" 1
455 2 31 VAL MG1 2 32 ASN H . . 4.380 4.097 4.045 4.135 . 0 0 "[ . 1 . 2 . 3]" 1
456 1 32 ASN H 1 35 ILE MD . . 4.440 4.086 3.920 4.329 . 0 0 "[ . 1 . 2 . 3]" 1
457 2 32 ASN H 2 35 ILE MD . . 4.440 4.090 3.931 4.284 . 0 0 "[ . 1 . 2 . 3]" 1
458 1 30 ASP HA 1 32 ASN H . . 4.260 3.273 3.234 3.298 . 0 0 "[ . 1 . 2 . 3]" 1
459 2 30 ASP HA 2 32 ASN H . . 4.260 3.272 3.238 3.299 . 0 0 "[ . 1 . 2 . 3]" 1
460 1 32 ASN H 1 32 ASN HD22 . . 4.690 4.163 3.111 4.693 0.003 20 0 "[ . 1 . 2 . 3]" 1
461 2 32 ASN H 2 32 ASN HD22 . . 4.690 4.108 3.111 4.693 0.003 16 0 "[ . 1 . 2 . 3]" 1
462 1 32 ASN H 1 34 CYS H . . 4.420 4.099 4.013 4.168 . 0 0 "[ . 1 . 2 . 3]" 1
463 2 32 ASN H 2 34 CYS H . . 4.420 4.099 4.046 4.168 . 0 0 "[ . 1 . 2 . 3]" 1
464 1 32 ASN H 1 32 ASN HD21 . . 4.690 3.398 2.036 4.445 . 0 0 "[ . 1 . 2 . 3]" 1
465 2 32 ASN H 2 32 ASN HD21 . . 4.690 3.269 2.044 4.444 . 0 0 "[ . 1 . 2 . 3]" 1
466 1 33 ARG H 1 33 ARG HG3 . . 4.760 3.895 3.115 4.337 . 0 0 "[ . 1 . 2 . 3]" 1
467 2 33 ARG H 2 33 ARG HG3 . . 4.760 3.893 3.110 4.337 . 0 0 "[ . 1 . 2 . 3]" 1
468 1 31 VAL HB 1 33 ARG H . . 5.500 5.409 5.269 5.503 0.003 6 0 "[ . 1 . 2 . 3]" 1
469 2 31 VAL HB 2 33 ARG H . . 5.500 5.409 5.271 5.493 . 0 0 "[ . 1 . 2 . 3]" 1
470 2 33 ARG H 2 36 GLU HB2 . . 5.500 5.321 5.130 5.502 0.002 19 0 "[ . 1 . 2 . 3]" 1
471 1 32 ASN HB2 1 33 ARG H . . 3.810 2.894 2.591 3.813 0.003 11 0 "[ . 1 . 2 . 3]" 1
472 2 32 ASN HB2 2 33 ARG H . . 3.810 2.896 2.598 3.812 0.002 11 0 "[ . 1 . 2 . 3]" 1
473 1 32 ASN HB3 1 33 ARG H . . 3.810 3.496 3.077 3.866 0.056 3 0 "[ . 1 . 2 . 3]" 1
474 2 32 ASN HB3 2 33 ARG H . . 3.810 3.494 3.074 3.866 0.056 3 0 "[ . 1 . 2 . 3]" 1
475 1 33 ARG H 1 33 ARG HD2 . . 5.200 3.848 2.250 5.198 . 0 0 "[ . 1 . 2 . 3]" 1
476 2 33 ARG H 2 33 ARG HD2 . . 5.200 3.844 2.215 5.196 . 0 0 "[ . 1 . 2 . 3]" 1
477 1 33 ARG H 1 34 CYS HB2 . . 5.500 4.616 4.462 4.744 . 0 0 "[ . 1 . 2 . 3]" 1
478 2 33 ARG H 2 34 CYS HB2 . . 5.500 4.614 4.476 4.722 . 0 0 "[ . 1 . 2 . 3]" 1
479 1 33 ARG H 1 34 CYS H . . 3.290 2.462 2.448 2.470 . 0 0 "[ . 1 . 2 . 3]" 1
480 2 33 ARG H 2 34 CYS H . . 3.290 2.462 2.450 2.468 . 0 0 "[ . 1 . 2 . 3]" 1
481 1 32 ASN H 1 33 ARG H . . 3.280 2.807 2.763 2.839 . 0 0 "[ . 1 . 2 . 3]" 1
482 2 32 ASN H 2 33 ARG H . . 3.280 2.808 2.778 2.829 . 0 0 "[ . 1 . 2 . 3]" 1
483 1 33 ARG H 1 33 ARG HD3 . . 5.200 4.139 2.897 5.068 . 0 0 "[ . 1 . 2 . 3]" 1
484 2 33 ARG H 2 33 ARG HD3 . . 5.200 4.137 2.896 5.069 . 0 0 "[ . 1 . 2 . 3]" 1
485 1 33 ARG H 1 34 CYS HB3 . . 5.500 4.848 4.717 5.045 . 0 0 "[ . 1 . 2 . 3]" 1
486 2 33 ARG H 2 34 CYS HB3 . . 5.500 4.849 4.737 4.999 . 0 0 "[ . 1 . 2 . 3]" 1
487 1 31 VAL HA 1 34 CYS H . . 4.120 3.019 2.990 3.066 . 0 0 "[ . 1 . 2 . 3]" 1
488 2 31 VAL HA 2 34 CYS H . . 4.120 3.016 2.992 3.057 . 0 0 "[ . 1 . 2 . 3]" 1
489 1 34 CYS H 1 34 CYS HB2 . . 3.560 2.375 2.234 2.477 . 0 0 "[ . 1 . 2 . 3]" 1
490 2 34 CYS H 2 34 CYS HB2 . . 3.560 2.373 2.261 2.461 . 0 0 "[ . 1 . 2 . 3]" 1
491 1 34 CYS H 1 34 CYS HB3 . . 3.560 2.693 2.579 2.869 . 0 0 "[ . 1 . 2 . 3]" 1
492 2 34 CYS H 2 34 CYS HB3 . . 3.560 2.695 2.598 2.831 . 0 0 "[ . 1 . 2 . 3]" 1
493 1 57 MET H 1 57 MET HB2 . . 3.710 2.508 2.258 2.645 . 0 0 "[ . 1 . 2 . 3]" 1
494 2 57 MET H 2 57 MET HB2 . . 3.710 2.496 2.237 2.664 . 0 0 "[ . 1 . 2 . 3]" 1
495 1 33 ARG HB2 1 34 CYS H . . 4.640 3.158 2.894 3.292 . 0 0 "[ . 1 . 2 . 3]" 1
496 2 33 ARG HB2 2 34 CYS H . . 4.640 3.157 2.888 3.295 . 0 0 "[ . 1 . 2 . 3]" 1
497 1 33 ARG HB3 1 34 CYS H . . 4.640 3.207 3.102 3.504 . 0 0 "[ . 1 . 2 . 3]" 1
498 2 33 ARG HB3 2 34 CYS H . . 4.640 3.210 3.100 3.480 . 0 0 "[ . 1 . 2 . 3]" 1
499 1 57 MET H 1 57 MET HB3 . . 3.710 2.545 2.407 2.824 . 0 0 "[ . 1 . 2 . 3]" 1
500 2 57 MET H 2 57 MET HB3 . . 3.710 2.558 2.389 2.853 . 0 0 "[ . 1 . 2 . 3]" 1
501 1 31 VAL MG2 1 34 CYS H . . 5.330 4.876 4.825 4.952 . 0 0 "[ . 1 . 2 . 3]" 1
502 2 31 VAL MG2 2 34 CYS H . . 5.330 4.873 4.821 4.919 . 0 0 "[ . 1 . 2 . 3]" 1
503 1 31 VAL MG1 1 34 CYS H . . 5.330 4.779 4.745 4.819 . 0 0 "[ . 1 . 2 . 3]" 1
504 2 31 VAL MG1 2 34 CYS H . . 5.330 4.778 4.726 4.842 . 0 0 "[ . 1 . 2 . 3]" 1
505 1 34 CYS H 1 35 ILE MD . . 4.420 4.263 4.082 4.420 0.000 17 0 "[ . 1 . 2 . 3]" 1
506 2 34 CYS H 2 35 ILE MD . . 4.420 4.262 4.058 4.412 . 0 0 "[ . 1 . 2 . 3]" 1
507 1 32 ASN HA 1 34 CYS H . . 4.530 4.418 4.353 4.476 . 0 0 "[ . 1 . 2 . 3]" 1
508 2 32 ASN HA 2 34 CYS H . . 4.530 4.417 4.349 4.472 . 0 0 "[ . 1 . 2 . 3]" 1
509 1 57 MET H 1 58 ILE H . . 3.430 2.779 2.672 2.914 . 0 0 "[ . 1 . 2 . 3]" 1
510 2 57 MET H 2 58 ILE H . . 3.430 2.785 2.674 2.921 . 0 0 "[ . 1 . 2 . 3]" 1
511 1 34 CYS H 1 35 ILE H . . 3.510 2.913 2.766 2.998 . 0 0 "[ . 1 . 2 . 3]" 1
512 2 34 CYS H 2 35 ILE H . . 3.510 2.917 2.774 2.997 . 0 0 "[ . 1 . 2 . 3]" 1
513 1 56 GLU H 1 57 MET H . . 4.660 2.769 2.681 2.848 . 0 0 "[ . 1 . 2 . 3]" 1
514 2 56 GLU H 2 57 MET H . . 4.660 2.768 2.657 2.852 . 0 0 "[ . 1 . 2 . 3]" 1
515 1 33 ARG H 1 35 ILE H . . 4.680 4.484 4.165 4.654 . 0 0 "[ . 1 . 2 . 3]" 1
516 2 33 ARG H 2 35 ILE H . . 4.680 4.490 4.182 4.652 . 0 0 "[ . 1 . 2 . 3]" 1
517 1 32 ASN HA 1 35 ILE H . . 4.320 4.055 3.915 4.174 . 0 0 "[ . 1 . 2 . 3]" 1
518 2 32 ASN HA 2 35 ILE H . . 4.320 4.058 3.921 4.172 . 0 0 "[ . 1 . 2 . 3]" 1
519 1 34 CYS HB2 1 35 ILE H . . 4.320 3.640 3.462 3.919 . 0 0 "[ . 1 . 2 . 3]" 1
520 2 34 CYS HB2 2 35 ILE H . . 4.320 3.636 3.465 3.904 . 0 0 "[ . 1 . 2 . 3]" 1
521 1 34 CYS HB3 1 35 ILE H . . 4.320 2.293 2.130 2.703 . 0 0 "[ . 1 . 2 . 3]" 1
522 2 34 CYS HB3 2 35 ILE H . . 4.320 2.284 2.129 2.682 . 0 0 "[ . 1 . 2 . 3]" 1
523 1 31 VAL HA 1 35 ILE H . . 4.700 4.304 4.201 4.472 . 0 0 "[ . 1 . 2 . 3]" 1
524 2 31 VAL HA 2 35 ILE H . . 4.700 4.307 4.213 4.483 . 0 0 "[ . 1 . 2 . 3]" 1
525 1 35 ILE H 1 35 ILE HB . . 3.330 2.574 2.501 2.637 . 0 0 "[ . 1 . 2 . 3]" 1
526 2 35 ILE H 2 35 ILE HB . . 3.330 2.575 2.503 2.637 . 0 0 "[ . 1 . 2 . 3]" 1
527 1 35 ILE H 1 35 ILE HG13 . . 4.020 2.296 2.166 2.488 . 0 0 "[ . 1 . 2 . 3]" 1
528 2 35 ILE H 2 35 ILE HG13 . . 4.020 2.293 2.143 2.503 . 0 0 "[ . 1 . 2 . 3]" 1
529 1 35 ILE H 1 35 ILE MD . . 3.370 2.596 2.443 2.715 . 0 0 "[ . 1 . 2 . 3]" 1
530 2 35 ILE H 2 35 ILE MD . . 3.370 2.591 2.439 2.747 . 0 0 "[ . 1 . 2 . 3]" 1
531 1 35 ILE MG 1 36 GLU H . . 3.580 3.377 3.242 3.583 0.003 19 0 "[ . 1 . 2 . 3]" 1
532 2 35 ILE MG 2 36 GLU H . . 3.580 3.395 3.267 3.579 . 0 0 "[ . 1 . 2 . 3]" 1
533 1 36 GLU H 1 37 ALA MB . . 4.530 4.378 4.184 4.467 . 0 0 "[ . 1 . 2 . 3]" 1
534 2 36 GLU H 2 37 ALA MB . . 4.530 4.381 4.208 4.463 . 0 0 "[ . 1 . 2 . 3]" 1
535 1 36 GLU H 1 36 GLU HB2 . . 3.650 2.508 2.387 2.603 . 0 0 "[ . 1 . 2 . 3]" 1
536 2 36 GLU H 2 36 GLU HB2 . . 3.310 2.508 2.383 2.604 . 0 0 "[ . 1 . 2 . 3]" 1
537 1 36 GLU H 1 36 GLU HB3 . . 3.650 3.590 3.577 3.594 . 0 0 "[ . 1 . 2 . 3]" 1
538 2 36 GLU H 2 36 GLU HB3 . . 3.650 3.590 3.576 3.594 . 0 0 "[ . 1 . 2 . 3]" 1
539 1 35 ILE HB 1 36 GLU H . . 3.600 2.506 2.377 2.772 . 0 0 "[ . 1 . 2 . 3]" 1
540 2 35 ILE HB 2 36 GLU H . . 3.600 2.526 2.408 2.789 . 0 0 "[ . 1 . 2 . 3]" 1
541 1 36 GLU H 1 36 GLU HG3 . . 3.770 3.027 2.787 3.282 . 0 0 "[ . 1 . 2 . 3]" 1
542 2 36 GLU H 2 36 GLU HG3 . . 3.770 3.028 2.786 3.276 . 0 0 "[ . 1 . 2 . 3]" 1
543 1 36 GLU H 1 36 GLU HG2 . . 3.770 2.382 2.117 2.718 . 0 0 "[ . 1 . 2 . 3]" 1
544 2 36 GLU H 2 36 GLU HG2 . . 3.770 2.381 2.119 2.703 . 0 0 "[ . 1 . 2 . 3]" 1
545 1 33 ARG HA 1 36 GLU H . . 3.730 3.448 3.214 3.593 . 0 0 "[ . 1 . 2 . 3]" 1
546 2 33 ARG HA 2 36 GLU H . . 3.730 3.437 3.219 3.569 . 0 0 "[ . 1 . 2 . 3]" 1
547 1 32 ASN HA 1 36 GLU H . . 5.370 4.724 4.531 5.061 . 0 0 "[ . 1 . 2 . 3]" 1
548 2 32 ASN HA 2 36 GLU H . . 5.370 4.738 4.565 5.010 . 0 0 "[ . 1 . 2 . 3]" 1
549 1 34 CYS H 1 36 GLU H . . 4.670 4.258 4.022 4.435 . 0 0 "[ . 1 . 2 . 3]" 1
550 2 34 CYS H 2 36 GLU H . . 4.670 4.239 4.008 4.407 . 0 0 "[ . 1 . 2 . 3]" 1
551 1 33 ARG H 1 36 GLU H . . 5.140 5.007 4.901 5.091 . 0 0 "[ . 1 . 2 . 3]" 1
552 2 33 ARG H 2 36 GLU H . . 5.140 5.000 4.892 5.089 . 0 0 "[ . 1 . 2 . 3]" 1
553 1 36 GLU H 1 37 ALA H . . 3.390 2.755 2.567 2.791 . 0 0 "[ . 1 . 2 . 3]" 1
554 2 36 GLU H 2 37 ALA H . . 3.390 2.758 2.596 2.793 . 0 0 "[ . 1 . 2 . 3]" 1
555 1 35 ILE H 1 36 GLU H . . 3.510 2.785 2.605 2.880 . 0 0 "[ . 1 . 2 . 3]" 1
556 2 35 ILE H 2 36 GLU H . . 3.510 2.781 2.609 2.870 . 0 0 "[ . 1 . 2 . 3]" 1
557 1 36 GLU H 1 39 ASP H . . 5.010 4.876 4.707 4.947 . 0 0 "[ . 1 . 2 . 3]" 1
558 2 36 GLU H 2 39 ASP H . . 5.010 4.878 4.734 4.947 . 0 0 "[ . 1 . 2 . 3]" 1
559 1 35 ILE MG 1 37 ALA H . . 4.950 4.785 4.695 4.935 . 0 0 "[ . 1 . 2 . 3]" 1
560 2 35 ILE MG 2 37 ALA H . . 4.950 4.804 4.723 4.954 0.004 30 0 "[ . 1 . 2 . 3]" 1
561 1 36 GLU HB2 1 37 ALA H . . 4.020 2.763 2.638 2.790 . 0 0 "[ . 1 . 2 . 3]" 1
562 2 36 GLU HB2 2 37 ALA H . . 3.630 2.744 2.632 2.779 . 0 0 "[ . 1 . 2 . 3]" 1
563 1 36 GLU HB3 1 37 ALA H . . 4.020 3.731 3.568 3.838 . 0 0 "[ . 1 . 2 . 3]" 1
564 2 36 GLU HB3 2 37 ALA H . . 4.020 3.716 3.564 3.815 . 0 0 "[ . 1 . 2 . 3]" 1
565 1 36 GLU HG3 1 37 ALA H . . 5.120 4.711 4.514 4.874 . 0 0 "[ . 1 . 2 . 3]" 1
566 2 36 GLU HG3 2 37 ALA H . . 5.120 4.698 4.516 4.853 . 0 0 "[ . 1 . 2 . 3]" 1
567 1 36 GLU HG2 1 37 ALA H . . 5.120 4.528 4.386 4.683 . 0 0 "[ . 1 . 2 . 3]" 1
568 2 36 GLU HG2 2 37 ALA H . . 5.120 4.523 4.384 4.691 . 0 0 "[ . 1 . 2 . 3]" 1
569 1 35 ILE HA 1 37 ALA H . . 4.950 4.113 4.003 4.250 . 0 0 "[ . 1 . 2 . 3]" 1
570 2 35 ILE HA 2 37 ALA H . . 4.950 4.130 4.033 4.266 . 0 0 "[ . 1 . 2 . 3]" 1
571 1 34 CYS HA 1 37 ALA H . . 4.190 3.637 3.337 3.822 . 0 0 "[ . 1 . 2 . 3]" 1
572 2 34 CYS HA 2 37 ALA H . . 4.190 3.636 3.372 3.814 . 0 0 "[ . 1 . 2 . 3]" 1
573 1 37 ALA H 1 38 LEU H . . 3.330 2.609 2.573 2.635 . 0 0 "[ . 1 . 2 . 3]" 1
574 2 37 ALA H 2 38 LEU H . . 3.330 2.603 2.553 2.653 . 0 0 "[ . 1 . 2 . 3]" 1
575 1 37 ALA H 1 39 ASP H . . 4.380 3.924 3.828 4.029 . 0 0 "[ . 1 . 2 . 3]" 1
576 2 37 ALA H 2 39 ASP H . . 4.380 3.930 3.846 4.008 . 0 0 "[ . 1 . 2 . 3]" 1
577 1 20 ILE MD 1 37 ALA H . . 4.990 4.521 4.174 4.858 . 0 0 "[ . 1 . 2 . 3]" 1
578 2 20 ILE MD 2 37 ALA H . . 4.990 4.497 4.166 4.759 . 0 0 "[ . 1 . 2 . 3]" 1
579 1 38 LEU H 1 38 LEU MD1 . . 4.170 3.291 2.571 3.650 . 0 0 "[ . 1 . 2 . 3]" 1
580 2 38 LEU H 2 38 LEU MD1 . . 4.170 3.294 2.576 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
581 1 20 ILE MD 1 38 LEU H . . 4.510 3.290 2.889 3.690 . 0 0 "[ . 1 . 2 . 3]" 1
582 2 20 ILE MD 2 38 LEU H . . 4.510 3.309 2.865 3.647 . 0 0 "[ . 1 . 2 . 3]" 1
583 1 38 LEU H 1 38 LEU HB3 . . 4.020 3.566 3.414 3.584 . 0 0 "[ . 1 . 2 . 3]" 1
584 2 38 LEU H 2 38 LEU HB3 . . 4.020 3.566 3.413 3.585 . 0 0 "[ . 1 . 2 . 3]" 1
585 1 38 LEU H 1 38 LEU HB2 . . 4.020 2.386 2.096 2.477 . 0 0 "[ . 1 . 2 . 3]" 1
586 2 38 LEU H 2 38 LEU HB2 . . 4.020 2.384 2.095 2.474 . 0 0 "[ . 1 . 2 . 3]" 1
587 1 35 ILE HA 1 38 LEU H . . 4.230 3.429 3.344 3.668 . 0 0 "[ . 1 . 2 . 3]" 1
588 2 35 ILE HA 2 38 LEU H . . 4.230 3.414 3.307 3.655 . 0 0 "[ . 1 . 2 . 3]" 1
589 1 38 LEU H 1 40 GLU H . . 4.810 4.380 4.119 4.548 . 0 0 "[ . 1 . 2 . 3]" 1
590 2 38 LEU H 2 40 GLU H . . 4.810 4.368 4.141 4.522 . 0 0 "[ . 1 . 2 . 3]" 1
591 1 36 GLU H 1 38 LEU H . . 4.970 4.491 4.348 4.560 . 0 0 "[ . 1 . 2 . 3]" 1
592 2 36 GLU H 2 38 LEU H . . 4.970 4.465 4.340 4.551 . 0 0 "[ . 1 . 2 . 3]" 1
593 1 35 ILE MG 1 39 ASP H . . 4.080 3.785 3.651 4.013 . 0 0 "[ . 1 . 2 . 3]" 1
594 2 35 ILE MG 2 39 ASP H . . 4.080 3.795 3.674 3.944 . 0 0 "[ . 1 . 2 . 3]" 1
595 1 38 LEU MD2 1 39 ASP H . . 4.880 4.804 4.711 4.874 . 0 0 "[ . 1 . 2 . 3]" 1
596 2 38 LEU MD2 2 39 ASP H . . 4.880 4.808 4.707 4.873 . 0 0 "[ . 1 . 2 . 3]" 1
597 1 47 THR MG 1 48 MET H . . 4.240 3.100 2.919 3.355 . 0 0 "[ . 1 . 2 . 3]" 1
598 2 47 THR MG 2 48 MET H . . 4.240 3.102 3.019 3.362 . 0 0 "[ . 1 . 2 . 3]" 1
599 1 38 LEU HB3 1 39 ASP H . . 4.240 3.544 3.219 3.664 . 0 0 "[ . 1 . 2 . 3]" 1
600 2 38 LEU HB3 2 39 ASP H . . 4.240 3.552 3.202 3.680 . 0 0 "[ . 1 . 2 . 3]" 1
601 1 38 LEU HB2 1 39 ASP H . . 4.240 2.733 2.535 3.088 . 0 0 "[ . 1 . 2 . 3]" 1
602 2 38 LEU HB2 2 39 ASP H . . 4.240 2.747 2.595 3.078 . 0 0 "[ . 1 . 2 . 3]" 1
603 1 39 ASP H 1 39 ASP HB2 . . 3.630 2.558 2.078 2.814 . 0 0 "[ . 1 . 2 . 3]" 1
604 2 39 ASP H 2 39 ASP HB2 . . 3.630 2.563 2.078 2.820 . 0 0 "[ . 1 . 2 . 3]" 1
605 1 39 ASP H 1 39 ASP HB3 . . 3.630 2.625 2.287 3.475 . 0 0 "[ . 1 . 2 . 3]" 1
606 2 39 ASP H 2 39 ASP HB3 . . 3.630 2.620 2.285 3.474 . 0 0 "[ . 1 . 2 . 3]" 1
607 1 35 ILE HA 1 39 ASP H . . 4.900 3.905 3.712 4.139 . 0 0 "[ . 1 . 2 . 3]" 1
608 2 35 ILE HA 2 39 ASP H . . 4.900 3.929 3.770 4.160 . 0 0 "[ . 1 . 2 . 3]" 1
609 1 36 GLU HA 1 39 ASP H . . 4.010 3.899 3.804 3.992 . 0 0 "[ . 1 . 2 . 3]" 1
610 2 36 GLU HA 2 39 ASP H . . 4.010 3.893 3.803 3.967 . 0 0 "[ . 1 . 2 . 3]" 1
611 1 38 LEU H 1 39 ASP H . . 3.600 2.794 2.743 2.845 . 0 0 "[ . 1 . 2 . 3]" 1
612 2 38 LEU H 2 39 ASP H . . 3.600 2.791 2.764 2.825 . 0 0 "[ . 1 . 2 . 3]" 1
613 1 39 ASP H 1 40 GLU H . . 3.470 2.714 2.583 2.822 . 0 0 "[ . 1 . 2 . 3]" 1
614 2 39 ASP H 2 40 GLU H . . 3.470 2.692 2.573 2.793 . 0 0 "[ . 1 . 2 . 3]" 1
615 1 48 MET H 1 50 GLN H . . 5.290 4.632 4.217 4.810 . 0 0 "[ . 1 . 2 . 3]" 1
616 2 48 MET H 2 50 GLN H . . 5.290 4.621 4.233 4.788 . 0 0 "[ . 1 . 2 . 3]" 1
617 1 96 VAL HA 1 97 ILE H . . 2.800 2.348 2.140 2.758 . 0 0 "[ . 1 . 2 . 3]" 1
618 2 96 VAL HA 2 97 ILE H . . 2.800 2.312 2.140 2.625 . 0 0 "[ . 1 . 2 . 3]" 1
619 1 37 ALA HA 1 40 GLU H . . 3.830 3.450 3.297 3.563 . 0 0 "[ . 1 . 2 . 3]" 1
620 2 37 ALA HA 2 40 GLU H . . 3.830 3.420 3.286 3.522 . 0 0 "[ . 1 . 2 . 3]" 1
621 1 40 GLU H 1 40 GLU QB . . 3.120 2.205 2.083 2.600 . 0 0 "[ . 1 . 2 . 3]" 1
622 2 40 GLU H 2 40 GLU QB . . 3.120 2.215 2.085 2.603 . 0 0 "[ . 1 . 2 . 3]" 1
623 1 96 VAL HB 1 97 ILE H . . 4.180 3.310 1.952 4.276 0.096 13 0 "[ . 1 . 2 . 3]" 1
624 2 96 VAL HB 2 97 ILE H . . 4.180 3.303 1.930 4.279 0.099 23 0 "[ . 1 . 2 . 3]" 1
625 1 113 GLU HB2 1 114 ALA H . . 4.740 3.170 2.219 3.923 . 0 0 "[ . 1 . 2 . 3]" 1
626 2 113 GLU HB2 2 114 ALA H . . 4.740 3.168 2.220 3.926 . 0 0 "[ . 1 . 2 . 3]" 1
627 1 97 ILE H 1 97 ILE MG . . 4.510 3.621 2.346 3.998 . 0 0 "[ . 1 . 2 . 3]" 1
628 2 97 ILE H 2 97 ILE MG . . 4.510 3.646 2.887 3.994 . 0 0 "[ . 1 . 2 . 3]" 1
629 1 16 ILE MD 1 40 GLU H . . 5.440 5.003 4.017 5.275 . 0 0 "[ . 1 . 2 . 3]" 1
630 2 16 ILE MD 2 40 GLU H . . 5.440 4.961 4.291 5.207 . 0 0 "[ . 1 . 2 . 3]" 1
631 1 38 LEU HA 1 41 LEU H . . 4.160 3.546 3.398 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
632 2 38 LEU HA 2 41 LEU H . . 4.160 3.584 3.460 3.671 . 0 0 "[ . 1 . 2 . 3]" 1
633 1 39 ASP HA 1 41 LEU H . . 4.800 4.603 4.498 4.767 . 0 0 "[ . 1 . 2 . 3]" 1
634 2 39 ASP HA 2 41 LEU H . . 4.800 4.617 4.503 4.766 . 0 0 "[ . 1 . 2 . 3]" 1
635 1 37 ALA HA 1 41 LEU H . . 4.600 4.345 4.234 4.459 . 0 0 "[ . 1 . 2 . 3]" 1
636 2 37 ALA HA 2 41 LEU H . . 4.600 4.333 4.225 4.452 . 0 0 "[ . 1 . 2 . 3]" 1
637 1 40 GLU HG2 1 41 LEU H . . 4.710 4.451 3.880 4.831 0.121 16 0 "[ . 1 . 2 . 3]" 1
638 2 40 GLU HG2 2 41 LEU H . . 4.710 4.381 3.869 4.712 0.002 10 0 "[ . 1 . 2 . 3]" 1
639 1 41 LEU H 1 41 LEU HB2 . . 3.640 2.278 2.152 2.522 . 0 0 "[ . 1 . 2 . 3]" 1
640 2 41 LEU H 2 41 LEU HB2 . . 3.640 2.282 2.158 2.546 . 0 0 "[ . 1 . 2 . 3]" 1
641 1 40 GLU QB 1 41 LEU H . . 3.590 2.443 2.347 2.556 . 0 0 "[ . 1 . 2 . 3]" 1
642 2 40 GLU QB 2 41 LEU H . . 3.590 2.417 2.332 2.526 . 0 0 "[ . 1 . 2 . 3]" 1
643 1 40 GLU HG3 1 41 LEU H . . 4.710 4.240 3.703 4.737 0.027 9 0 "[ . 1 . 2 . 3]" 1
644 2 40 GLU HG3 2 41 LEU H . . 4.710 4.249 3.696 4.825 0.115 16 0 "[ . 1 . 2 . 3]" 1
645 1 41 LEU H 1 41 LEU HB3 . . 3.640 2.765 2.486 2.937 . 0 0 "[ . 1 . 2 . 3]" 1
646 2 41 LEU H 2 41 LEU HB3 . . 3.640 2.761 2.461 2.927 . 0 0 "[ . 1 . 2 . 3]" 1
647 1 37 ALA MB 1 41 LEU H . . 4.900 4.594 4.501 4.685 . 0 0 "[ . 1 . 2 . 3]" 1
648 2 37 ALA MB 2 41 LEU H . . 4.900 4.581 4.505 4.695 . 0 0 "[ . 1 . 2 . 3]" 1
649 1 41 LEU H 1 42 ALA MB . . 5.190 4.458 4.273 4.522 . 0 0 "[ . 1 . 2 . 3]" 1
650 2 41 LEU H 2 42 ALA MB . . 5.190 4.460 4.289 4.528 . 0 0 "[ . 1 . 2 . 3]" 1
651 1 16 ILE MD 1 41 LEU H . . 3.970 3.481 2.702 3.740 . 0 0 "[ . 1 . 2 . 3]" 1
652 2 16 ILE MD 2 41 LEU H . . 3.970 3.472 2.874 3.669 . 0 0 "[ . 1 . 2 . 3]" 1
653 1 40 GLU H 1 41 LEU H . . 3.520 2.731 2.620 2.816 . 0 0 "[ . 1 . 2 . 3]" 1
654 2 40 GLU H 2 41 LEU H . . 3.520 2.747 2.630 2.825 . 0 0 "[ . 1 . 2 . 3]" 1
655 1 80 LEU MD1 2 42 ALA H . . 4.360 3.189 2.766 3.551 . 0 0 "[ . 1 . 2 . 3]" 1
656 1 42 ALA H 2 80 LEU MD1 . . 4.360 3.202 2.780 3.578 . 0 0 "[ . 1 . 2 . 3]" 1
657 1 42 ALA H 1 42 ALA MB . . 2.890 2.199 2.057 2.251 . 0 0 "[ . 1 . 2 . 3]" 1
658 2 42 ALA H 2 42 ALA MB . . 2.890 2.200 2.055 2.242 . 0 0 "[ . 1 . 2 . 3]" 1
659 1 9 MET HB2 1 10 ASP H . . 4.360 3.815 3.584 4.029 . 0 0 "[ . 1 . 2 . 3]" 1
660 2 9 MET HB2 2 10 ASP H . . 4.360 3.812 3.583 4.026 . 0 0 "[ . 1 . 2 . 3]" 1
661 1 40 GLU QB 1 42 ALA H . . 4.860 4.723 4.485 4.891 0.031 10 0 "[ . 1 . 2 . 3]" 1
662 2 40 GLU QB 2 42 ALA H . . 4.860 4.729 4.475 4.893 0.033 10 0 "[ . 1 . 2 . 3]" 1
663 1 79 MET ME 2 42 ALA H . . 5.430 5.071 4.477 5.512 0.082 8 0 "[ . 1 . 2 . 3]" 1
664 1 42 ALA H 2 79 MET ME . . 5.430 5.078 4.495 5.499 0.069 18 0 "[ . 1 . 2 . 3]" 1
665 1 38 LEU HA 1 42 ALA H . . 4.740 4.353 4.140 4.572 . 0 0 "[ . 1 . 2 . 3]" 1
666 2 38 LEU HA 2 42 ALA H . . 4.740 4.341 4.122 4.578 . 0 0 "[ . 1 . 2 . 3]" 1
667 1 42 ALA H 1 43 SER H . . 3.410 2.634 2.481 2.738 . 0 0 "[ . 1 . 2 . 3]" 1
668 2 42 ALA H 2 43 SER H . . 3.410 2.656 2.491 2.741 . 0 0 "[ . 1 . 2 . 3]" 1
669 1 41 LEU H 1 42 ALA H . . 3.520 2.834 2.667 2.933 . 0 0 "[ . 1 . 2 . 3]" 1
670 2 41 LEU H 2 42 ALA H . . 3.520 2.841 2.689 2.936 . 0 0 "[ . 1 . 2 . 3]" 1
671 1 40 GLU H 1 42 ALA H . . 4.600 4.267 3.963 4.534 . 0 0 "[ . 1 . 2 . 3]" 1
672 2 40 GLU H 2 42 ALA H . . 4.600 4.279 3.945 4.534 . 0 0 "[ . 1 . 2 . 3]" 1
673 1 42 ALA MB 1 43 SER H . . 3.480 2.729 2.564 2.950 . 0 0 "[ . 1 . 2 . 3]" 1
674 2 42 ALA MB 2 43 SER H . . 3.480 2.716 2.502 2.871 . 0 0 "[ . 1 . 2 . 3]" 1
675 1 41 LEU MD1 1 43 SER H . . 5.500 4.815 4.405 5.745 0.245 18 0 "[ . 1 . 2 . 3]" 1
676 2 41 LEU MD1 2 43 SER H . . 5.500 4.805 4.576 5.564 0.064 18 0 "[ . 1 . 2 . 3]" 1
677 1 41 LEU MD2 1 43 SER H . . 5.500 5.395 4.355 5.592 0.092 21 0 "[ . 1 . 2 . 3]" 1
678 2 41 LEU MD2 2 43 SER H . . 5.500 5.449 4.790 5.594 0.094 21 0 "[ . 1 . 2 . 3]" 1
679 1 43 SER H 1 44 LEU MD1 . . 5.500 5.209 4.809 5.426 . 0 0 "[ . 1 . 2 . 3]" 1
680 2 43 SER H 2 44 LEU MD1 . . 5.500 5.220 4.822 5.407 . 0 0 "[ . 1 . 2 . 3]" 1
681 1 43 SER H 1 44 LEU MD2 . . 5.500 5.075 3.602 5.520 0.020 29 0 "[ . 1 . 2 . 3]" 1
682 2 43 SER H 2 44 LEU MD2 . . 5.500 5.209 4.045 5.507 0.007 29 0 "[ . 1 . 2 . 3]" 1
683 1 43 SER H 1 44 LEU HG . . 5.300 4.253 3.363 4.552 . 0 0 "[ . 1 . 2 . 3]" 1
684 2 43 SER H 2 44 LEU HG . . 5.300 4.322 3.452 4.541 . 0 0 "[ . 1 . 2 . 3]" 1
685 1 43 SER H 1 43 SER HB2 . . 4.160 2.307 2.099 2.890 . 0 0 "[ . 1 . 2 . 3]" 1
686 2 43 SER H 2 43 SER HB2 . . 4.160 2.292 2.101 2.882 . 0 0 "[ . 1 . 2 . 3]" 1
687 1 43 SER H 1 43 SER HB3 . . 4.160 2.987 2.246 3.601 . 0 0 "[ . 1 . 2 . 3]" 1
688 2 43 SER H 2 43 SER HB3 . . 4.160 2.987 2.249 3.602 . 0 0 "[ . 1 . 2 . 3]" 1
689 1 45 GLN H 1 46 VAL H . . 4.900 3.523 2.777 3.907 . 0 0 "[ . 1 . 2 . 3]" 1
690 2 45 GLN H 2 46 VAL H . . 4.900 3.618 2.782 3.922 . 0 0 "[ . 1 . 2 . 3]" 1
691 1 45 GLN HA 1 46 VAL H . . 2.910 2.538 2.376 2.766 . 0 0 "[ . 1 . 2 . 3]" 1
692 2 45 GLN HA 2 46 VAL H . . 2.910 2.510 2.373 2.683 . 0 0 "[ . 1 . 2 . 3]" 1
693 1 46 VAL H 1 46 VAL MG1 . . 4.270 2.151 1.918 3.771 . 0 0 "[ . 1 . 2 . 3]" 1
694 2 46 VAL H 2 46 VAL MG1 . . 4.270 2.202 1.919 3.769 . 0 0 "[ . 1 . 2 . 3]" 1
695 1 44 LEU MD1 1 46 VAL H . . 5.500 5.024 4.429 5.484 . 0 0 "[ . 1 . 2 . 3]" 1
696 2 44 LEU MD1 2 46 VAL H . . 5.500 5.098 4.626 5.503 0.003 13 0 "[ . 1 . 2 . 3]" 1
697 1 44 LEU MD2 1 46 VAL H . . 5.500 5.166 4.739 5.504 0.004 27 0 "[ . 1 . 2 . 3]" 1
698 2 44 LEU MD2 2 46 VAL H . . 5.500 5.171 4.704 5.506 0.006 13 0 "[ . 1 . 2 . 3]" 1
699 1 9 MET ME 1 46 VAL H . . 4.560 3.155 2.830 3.619 . 0 0 "[ . 1 . 2 . 3]" 1
700 2 9 MET ME 2 46 VAL H . . 4.560 3.158 2.898 3.645 . 0 0 "[ . 1 . 2 . 3]" 1
701 1 46 VAL H 1 46 VAL HB . . 3.150 2.676 2.575 2.827 . 0 0 "[ . 1 . 2 . 3]" 1
702 2 46 VAL H 2 46 VAL HB . . 3.150 2.679 2.467 2.816 . 0 0 "[ . 1 . 2 . 3]" 1
703 1 9 MET ME 1 47 THR H . . 4.440 4.018 3.390 4.418 . 0 0 "[ . 1 . 2 . 3]" 1
704 2 9 MET ME 2 47 THR H . . 4.440 4.102 3.563 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
705 1 46 VAL HB 1 47 THR H . . 4.320 4.031 3.951 4.198 . 0 0 "[ . 1 . 2 . 3]" 1
706 2 46 VAL HB 2 47 THR H . . 4.320 4.032 3.953 4.195 . 0 0 "[ . 1 . 2 . 3]" 1
707 1 47 THR H 1 50 GLN HB3 . . 4.240 4.129 3.489 4.260 0.020 18 0 "[ . 1 . 2 . 3]" 1
708 2 47 THR H 2 50 GLN HB3 . . 4.240 4.128 3.341 4.254 0.014 30 0 "[ . 1 . 2 . 3]" 1
709 1 47 THR H 1 50 GLN HB2 . . 4.240 2.850 2.300 3.251 . 0 0 "[ . 1 . 2 . 3]" 1
710 2 47 THR H 2 50 GLN HB2 . . 4.240 2.857 2.326 3.260 . 0 0 "[ . 1 . 2 . 3]" 1
711 1 46 VAL HA 1 47 THR H . . 3.030 2.200 2.140 2.258 . 0 0 "[ . 1 . 2 . 3]" 1
712 2 46 VAL HA 2 47 THR H . . 3.030 2.196 2.139 2.229 . 0 0 "[ . 1 . 2 . 3]" 1
713 1 47 THR H 1 47 THR HG1 . . 4.830 4.546 4.387 4.670 . 0 0 "[ . 1 . 2 . 3]" 1
714 2 47 THR H 2 47 THR HG1 . . 4.830 4.546 4.386 4.687 . 0 0 "[ . 1 . 2 . 3]" 1
715 1 46 VAL H 1 47 THR H . . 4.590 4.590 4.485 4.627 0.037 30 0 "[ . 1 . 2 . 3]" 1
716 2 46 VAL H 2 47 THR H . . 4.590 4.589 4.484 4.610 0.020 29 0 "[ . 1 . 2 . 3]" 1
717 1 47 THR H 1 50 GLN H . . 4.280 3.681 3.410 4.091 . 0 0 "[ . 1 . 2 . 3]" 1
718 2 47 THR H 2 50 GLN H . . 4.280 3.688 3.398 4.098 . 0 0 "[ . 1 . 2 . 3]" 1
719 1 39 ASP H 1 41 LEU H . . 5.120 4.273 4.130 4.405 . 0 0 "[ . 1 . 2 . 3]" 1
720 2 39 ASP H 2 41 LEU H . . 5.120 4.288 4.142 4.430 . 0 0 "[ . 1 . 2 . 3]" 1
721 1 47 THR H 1 48 MET H . . 5.500 4.533 4.476 4.601 . 0 0 "[ . 1 . 2 . 3]" 1
722 2 47 THR H 2 48 MET H . . 5.500 4.534 4.480 4.605 . 0 0 "[ . 1 . 2 . 3]" 1
723 1 48 MET H 1 51 ALA H . . 5.500 4.685 4.589 4.845 . 0 0 "[ . 1 . 2 . 3]" 1
724 2 48 MET H 2 51 ALA H . . 5.500 4.683 4.601 4.852 . 0 0 "[ . 1 . 2 . 3]" 1
725 1 49 GLN H 1 49 GLN HG2 . . 4.050 3.332 2.578 3.982 . 0 0 "[ . 1 . 2 . 3]" 1
726 2 49 GLN H 2 49 GLN HG2 . . 4.050 3.331 2.580 3.980 . 0 0 "[ . 1 . 2 . 3]" 1
727 1 49 GLN H 1 49 GLN HG3 . . 4.050 2.487 1.948 3.538 . 0 0 "[ . 1 . 2 . 3]" 1
728 2 49 GLN H 2 49 GLN HG3 . . 4.050 2.486 1.951 3.535 . 0 0 "[ . 1 . 2 . 3]" 1
729 1 49 GLN H 1 51 ALA MB . . 5.020 4.459 4.303 4.710 . 0 0 "[ . 1 . 2 . 3]" 1
730 2 49 GLN H 2 51 ALA MB . . 5.020 4.462 4.307 4.703 . 0 0 "[ . 1 . 2 . 3]" 1
731 1 47 THR MG 1 49 GLN H . . 4.130 1.971 1.925 2.364 . 0 0 "[ . 1 . 2 . 3]" 1
732 2 47 THR MG 2 49 GLN H . . 4.130 1.974 1.925 2.364 . 0 0 "[ . 1 . 2 . 3]" 1
733 1 47 THR HA 1 49 GLN H . . 4.640 4.429 4.311 4.631 . 0 0 "[ . 1 . 2 . 3]" 1
734 2 47 THR HA 2 49 GLN H . . 4.640 4.429 4.332 4.619 . 0 0 "[ . 1 . 2 . 3]" 1
735 1 47 THR HG1 1 49 GLN H . . 4.780 2.786 2.139 3.346 . 0 0 "[ . 1 . 2 . 3]" 1
736 2 47 THR HG1 2 49 GLN H . . 4.780 2.782 2.144 3.336 . 0 0 "[ . 1 . 2 . 3]" 1
737 1 49 GLN H 1 50 GLN H . . 3.350 2.927 2.747 2.993 . 0 0 "[ . 1 . 2 . 3]" 1
738 2 49 GLN H 2 50 GLN H . . 3.350 2.922 2.747 2.993 . 0 0 "[ . 1 . 2 . 3]" 1
739 1 48 MET H 1 49 GLN H . . 4.050 2.726 2.577 2.874 . 0 0 "[ . 1 . 2 . 3]" 1
740 2 48 MET H 2 49 GLN H . . 4.050 2.724 2.595 2.849 . 0 0 "[ . 1 . 2 . 3]" 1
741 1 47 THR MG 1 49 GLN HE21 . . 4.880 3.168 2.115 4.593 . 0 0 "[ . 1 . 2 . 3]" 1
742 2 47 THR MG 2 49 GLN HE21 . . 4.880 3.181 2.135 4.578 . 0 0 "[ . 1 . 2 . 3]" 1
743 1 50 GLN H 1 50 GLN HB2 . . 3.760 2.136 2.069 2.268 . 0 0 "[ . 1 . 2 . 3]" 1
744 2 50 GLN H 2 50 GLN HB2 . . 3.760 2.136 2.069 2.280 . 0 0 "[ . 1 . 2 . 3]" 1
745 1 49 GLN HB2 1 50 GLN H . . 3.880 2.419 2.185 2.905 . 0 0 "[ . 1 . 2 . 3]" 1
746 2 49 GLN HB2 2 50 GLN H . . 3.880 2.427 2.193 2.906 . 0 0 "[ . 1 . 2 . 3]" 1
747 1 49 GLN HB3 1 50 GLN H . . 3.880 3.207 2.481 3.799 . 0 0 "[ . 1 . 2 . 3]" 1
748 2 49 GLN HB3 2 50 GLN H . . 3.880 3.217 2.486 3.786 . 0 0 "[ . 1 . 2 . 3]" 1
749 1 50 GLN H 1 50 GLN HB3 . . 3.760 3.420 3.211 3.544 . 0 0 "[ . 1 . 2 . 3]" 1
750 2 50 GLN H 2 50 GLN HB3 . . 3.760 3.417 3.210 3.549 . 0 0 "[ . 1 . 2 . 3]" 1
751 1 50 GLN H 1 51 ALA MB . . 4.550 4.196 4.067 4.293 . 0 0 "[ . 1 . 2 . 3]" 1
752 2 50 GLN H 2 51 ALA MB . . 4.550 4.193 4.067 4.289 . 0 0 "[ . 1 . 2 . 3]" 1
753 1 47 THR HG1 1 50 GLN H . . 4.830 4.588 3.734 4.832 0.002 3 0 "[ . 1 . 2 . 3]" 1
754 2 47 THR HG1 2 50 GLN H . . 4.830 4.576 3.696 4.832 0.002 6 0 "[ . 1 . 2 . 3]" 1
755 1 50 GLN H 1 51 ALA H . . 3.320 2.561 2.489 2.664 . 0 0 "[ . 1 . 2 . 3]" 1
756 2 50 GLN H 2 51 ALA H . . 3.320 2.558 2.491 2.641 . 0 0 "[ . 1 . 2 . 3]" 1
757 1 48 MET HA 1 51 ALA H . . 3.950 3.400 3.236 3.558 . 0 0 "[ . 1 . 2 . 3]" 1
758 2 48 MET HA 2 51 ALA H . . 3.950 3.394 3.241 3.577 . 0 0 "[ . 1 . 2 . 3]" 1
759 1 49 GLN H 1 51 ALA H . . 4.350 4.004 3.948 4.147 . 0 0 "[ . 1 . 2 . 3]" 1
760 2 49 GLN H 2 51 ALA H . . 4.350 4.006 3.954 4.139 . 0 0 "[ . 1 . 2 . 3]" 1
761 1 51 ALA H 1 54 HIS HB2 . . 5.500 5.148 4.712 5.478 . 0 0 "[ . 1 . 2 . 3]" 1
762 2 51 ALA H 2 54 HIS HB2 . . 5.500 5.183 4.753 5.502 0.002 13 0 "[ . 1 . 2 . 3]" 1
763 1 50 GLN HB2 1 51 ALA H . . 4.040 2.998 2.772 3.239 . 0 0 "[ . 1 . 2 . 3]" 1
764 2 50 GLN HB2 2 51 ALA H . . 4.040 3.001 2.762 3.240 . 0 0 "[ . 1 . 2 . 3]" 1
765 1 50 GLN HB3 1 51 ALA H . . 4.040 3.271 2.964 3.518 . 0 0 "[ . 1 . 2 . 3]" 1
766 2 50 GLN HB3 2 51 ALA H . . 4.040 3.268 2.958 3.543 . 0 0 "[ . 1 . 2 . 3]" 1
767 1 51 ALA MB 1 52 GLN H . . 3.500 2.474 2.318 2.656 . 0 0 "[ . 1 . 2 . 3]" 1
768 2 51 ALA MB 2 52 GLN H . . 3.500 2.473 2.319 2.655 . 0 0 "[ . 1 . 2 . 3]" 1
769 1 52 GLN H 1 52 GLN HB2 . . 3.720 2.292 2.091 2.677 . 0 0 "[ . 1 . 2 . 3]" 1
770 2 52 GLN H 2 52 GLN HB2 . . 3.720 2.291 2.093 2.669 . 0 0 "[ . 1 . 2 . 3]" 1
771 1 52 GLN H 1 52 GLN HB3 . . 3.720 3.531 3.384 3.588 . 0 0 "[ . 1 . 2 . 3]" 1
772 2 52 GLN H 2 52 GLN HB3 . . 3.720 3.531 3.388 3.589 . 0 0 "[ . 1 . 2 . 3]" 1
773 1 52 GLN H 1 52 GLN HG3 . . 3.790 2.983 2.413 3.578 . 0 0 "[ . 1 . 2 . 3]" 1
774 2 52 GLN H 2 52 GLN HG3 . . 3.790 2.984 2.413 3.569 . 0 0 "[ . 1 . 2 . 3]" 1
775 1 52 GLN H 1 52 GLN HG2 . . 3.790 3.218 2.321 3.721 . 0 0 "[ . 1 . 2 . 3]" 1
776 2 52 GLN H 2 52 GLN HG2 . . 3.790 3.219 2.334 3.728 . 0 0 "[ . 1 . 2 . 3]" 1
777 1 48 MET HA 1 52 GLN H . . 4.270 3.676 3.356 4.081 . 0 0 "[ . 1 . 2 . 3]" 1
778 2 48 MET HA 2 52 GLN H . . 4.270 3.690 3.378 4.136 . 0 0 "[ . 1 . 2 . 3]" 1
779 1 49 GLN HA 1 52 GLN H . . 4.570 3.945 3.690 4.140 . 0 0 "[ . 1 . 2 . 3]" 1
780 2 49 GLN HA 2 52 GLN H . . 4.570 3.949 3.711 4.131 . 0 0 "[ . 1 . 2 . 3]" 1
781 1 50 GLN H 1 52 GLN H . . 4.670 4.331 4.156 4.476 . 0 0 "[ . 1 . 2 . 3]" 1
782 2 50 GLN H 2 52 GLN H . . 4.670 4.330 4.168 4.496 . 0 0 "[ . 1 . 2 . 3]" 1
783 1 52 GLN H 1 53 LYS H . . 3.510 2.797 2.780 2.909 . 0 0 "[ . 1 . 2 . 3]" 1
784 2 52 GLN H 2 53 LYS H . . 3.510 2.791 2.770 2.896 . 0 0 "[ . 1 . 2 . 3]" 1
785 1 88 PHE HZ 2 52 GLN H . . 5.050 4.358 3.709 5.059 0.009 28 0 "[ . 1 . 2 . 3]" 1
786 1 52 GLN H 2 88 PHE HZ . . 5.050 4.386 3.827 5.052 0.002 28 0 "[ . 1 . 2 . 3]" 1
787 1 51 ALA H 1 52 GLN H . . 3.460 2.788 2.673 2.863 . 0 0 "[ . 1 . 2 . 3]" 1
788 2 51 ALA H 2 52 GLN H . . 3.460 2.791 2.689 2.866 . 0 0 "[ . 1 . 2 . 3]" 1
789 1 53 LYS H 1 53 LYS QB . . 3.090 2.271 2.063 2.484 . 0 0 "[ . 1 . 2 . 3]" 1
790 2 53 LYS H 2 53 LYS QB . . 3.090 2.272 2.062 2.482 . 0 0 "[ . 1 . 2 . 3]" 1
791 1 53 LYS H 1 53 LYS HG2 . . 4.070 2.915 2.198 3.896 . 0 0 "[ . 1 . 2 . 3]" 1
792 2 53 LYS H 2 53 LYS HG2 . . 4.070 2.912 2.206 3.908 . 0 0 "[ . 1 . 2 . 3]" 1
793 1 53 LYS H 1 53 LYS HG3 . . 4.070 3.516 2.763 3.988 . 0 0 "[ . 1 . 2 . 3]" 1
794 2 53 LYS H 2 53 LYS HG3 . . 4.070 3.515 2.775 3.989 . 0 0 "[ . 1 . 2 . 3]" 1
795 1 52 GLN HB2 1 53 LYS H . . 4.070 2.853 2.588 3.148 . 0 0 "[ . 1 . 2 . 3]" 1
796 2 52 GLN HB2 2 53 LYS H . . 4.070 2.865 2.607 3.144 . 0 0 "[ . 1 . 2 . 3]" 1
797 1 52 GLN HB3 1 53 LYS H . . 4.070 3.431 3.101 3.857 . 0 0 "[ . 1 . 2 . 3]" 1
798 2 52 GLN HB3 2 53 LYS H . . 4.070 3.445 3.123 3.854 . 0 0 "[ . 1 . 2 . 3]" 1
799 1 49 GLN HA 1 53 LYS H . . 5.220 5.034 4.650 5.219 . 0 0 "[ . 1 . 2 . 3]" 1
800 2 49 GLN HA 2 53 LYS H . . 5.220 5.047 4.680 5.229 0.009 26 0 "[ . 1 . 2 . 3]" 1
801 1 51 ALA HA 1 53 LYS H . . 4.780 4.168 4.067 4.585 . 0 0 "[ . 1 . 2 . 3]" 1
802 2 51 ALA HA 2 53 LYS H . . 4.780 4.153 4.051 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
803 1 50 GLN HA 1 53 LYS H . . 4.500 3.534 3.457 3.681 . 0 0 "[ . 1 . 2 . 3]" 1
804 2 50 GLN HA 2 53 LYS H . . 4.500 3.524 3.442 3.653 . 0 0 "[ . 1 . 2 . 3]" 1
805 1 51 ALA H 1 53 LYS H . . 4.680 4.186 4.067 4.448 . 0 0 "[ . 1 . 2 . 3]" 1
806 2 51 ALA H 2 53 LYS H . . 4.680 4.177 4.067 4.429 . 0 0 "[ . 1 . 2 . 3]" 1
807 1 54 HIS H 1 54 HIS HB3 . . 4.080 3.646 3.607 3.688 . 0 0 "[ . 1 . 2 . 3]" 1
808 2 54 HIS H 2 54 HIS HB3 . . 4.080 3.647 3.609 3.686 . 0 0 "[ . 1 . 2 . 3]" 1
809 1 54 HIS HB3 1 57 MET H . . 4.380 3.504 3.243 3.844 . 0 0 "[ . 1 . 2 . 3]" 1
810 2 54 HIS HB3 2 57 MET H . . 4.380 3.492 3.285 3.816 . 0 0 "[ . 1 . 2 . 3]" 1
811 1 54 HIS H 1 54 HIS HB2 . . 3.540 2.448 2.359 2.541 . 0 0 "[ . 1 . 2 . 3]" 1
812 2 54 HIS H 2 54 HIS HB2 . . 3.540 2.451 2.362 2.536 . 0 0 "[ . 1 . 2 . 3]" 1
813 1 53 LYS QB 1 54 HIS H . . 3.710 2.745 2.677 2.827 . 0 0 "[ . 1 . 2 . 3]" 1
814 2 53 LYS QB 2 54 HIS H . . 3.710 2.734 2.673 2.815 . 0 0 "[ . 1 . 2 . 3]" 1
815 1 51 ALA HA 1 54 HIS H . . 4.360 3.200 3.074 3.462 . 0 0 "[ . 1 . 2 . 3]" 1
816 2 51 ALA HA 2 54 HIS H . . 4.360 3.205 3.048 3.455 . 0 0 "[ . 1 . 2 . 3]" 1
817 1 52 GLN HA 1 54 HIS H . . 4.530 4.366 4.090 4.541 0.011 10 0 "[ . 1 . 2 . 3]" 1
818 2 52 GLN HA 2 54 HIS H . . 4.530 4.373 4.105 4.551 0.021 10 0 "[ . 1 . 2 . 3]" 1
819 1 53 LYS H 1 54 HIS H . . 3.080 2.493 2.328 2.775 . 0 0 "[ . 1 . 2 . 3]" 1
820 2 53 LYS H 2 54 HIS H . . 3.080 2.497 2.302 2.771 . 0 0 "[ . 1 . 2 . 3]" 1
821 1 54 HIS H 1 55 THR H . . 3.500 2.967 2.907 2.975 . 0 0 "[ . 1 . 2 . 3]" 1
822 2 54 HIS H 2 55 THR H . . 3.500 2.966 2.906 2.974 . 0 0 "[ . 1 . 2 . 3]" 1
823 1 54 HIS HA 1 55 THR H . . 3.550 2.855 2.853 2.856 . 0 0 "[ . 1 . 2 . 3]" 1
824 2 54 HIS HA 2 55 THR H . . 3.550 2.855 2.853 2.856 . 0 0 "[ . 1 . 2 . 3]" 1
825 1 53 LYS HA 1 55 THR H . . 4.030 3.674 3.654 3.774 . 0 0 "[ . 1 . 2 . 3]" 1
826 2 53 LYS HA 2 55 THR H . . 4.030 3.680 3.660 3.777 . 0 0 "[ . 1 . 2 . 3]" 1
827 1 55 THR H 1 55 THR MG . . 3.250 2.783 2.491 3.051 . 0 0 "[ . 1 . 2 . 3]" 1
828 2 55 THR H 2 55 THR MG . . 3.250 2.781 2.496 3.044 . 0 0 "[ . 1 . 2 . 3]" 1
829 1 54 HIS H 1 58 ILE MD . . 5.060 4.305 3.851 4.910 . 0 0 "[ . 1 . 2 . 3]" 1
830 2 54 HIS H 2 58 ILE MD . . 5.060 4.327 3.808 4.907 . 0 0 "[ . 1 . 2 . 3]" 1
831 1 57 MET H 1 58 ILE MD . . 5.500 4.429 3.748 5.187 . 0 0 "[ . 1 . 2 . 3]" 1
832 2 57 MET H 2 58 ILE MD . . 5.500 4.411 3.769 5.255 . 0 0 "[ . 1 . 2 . 3]" 1
833 1 58 ILE H 1 58 ILE MG . . 3.900 3.766 3.763 3.770 . 0 0 "[ . 1 . 2 . 3]" 1
834 2 58 ILE H 2 58 ILE MG . . 3.900 3.765 3.762 3.771 . 0 0 "[ . 1 . 2 . 3]" 1
835 1 58 ILE H 1 58 ILE HG13 . . 3.820 2.256 1.948 2.578 . 0 0 "[ . 1 . 2 . 3]" 1
836 2 58 ILE H 2 58 ILE HG13 . . 3.820 2.247 1.942 2.505 . 0 0 "[ . 1 . 2 . 3]" 1
837 1 58 ILE H 1 58 ILE MD . . 3.870 2.889 2.228 3.510 . 0 0 "[ . 1 . 2 . 3]" 1
838 2 58 ILE H 2 58 ILE MD . . 3.870 2.864 2.141 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
839 1 58 ILE H 1 58 ILE HB . . 3.340 2.555 2.510 2.641 . 0 0 "[ . 1 . 2 . 3]" 1
840 2 58 ILE H 2 58 ILE HB . . 3.340 2.564 2.509 2.656 . 0 0 "[ . 1 . 2 . 3]" 1
841 1 55 THR HA 1 58 ILE H . . 3.990 3.470 3.320 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
842 2 55 THR HA 2 58 ILE H . . 3.990 3.473 3.354 3.585 . 0 0 "[ . 1 . 2 . 3]" 1
843 1 58 ILE H 1 59 THR H . . 3.610 2.641 2.561 2.828 . 0 0 "[ . 1 . 2 . 3]" 1
844 2 58 ILE H 2 59 THR H . . 3.610 2.662 2.545 2.835 . 0 0 "[ . 1 . 2 . 3]" 1
845 1 59 THR H 1 60 THR H . . 3.760 2.748 2.684 2.815 . 0 0 "[ . 1 . 2 . 3]" 1
846 2 59 THR H 2 60 THR H . . 3.760 2.744 2.687 2.808 . 0 0 "[ . 1 . 2 . 3]" 1
847 1 59 THR H 1 59 THR HB . . 3.940 2.700 2.552 2.966 . 0 0 "[ . 1 . 2 . 3]" 1
848 2 59 THR H 2 59 THR HB . . 3.940 2.698 2.555 2.969 . 0 0 "[ . 1 . 2 . 3]" 1
849 1 58 ILE HB 1 59 THR H . . 3.970 2.636 2.487 2.755 . 0 0 "[ . 1 . 2 . 3]" 1
850 2 58 ILE HB 2 59 THR H . . 3.970 2.631 2.498 2.756 . 0 0 "[ . 1 . 2 . 3]" 1
851 1 57 MET HA 1 60 THR H . . 4.170 3.656 3.541 3.772 . 0 0 "[ . 1 . 2 . 3]" 1
852 2 57 MET HA 2 60 THR H . . 4.170 3.635 3.522 3.745 . 0 0 "[ . 1 . 2 . 3]" 1
853 1 59 THR HB 1 60 THR H . . 4.120 2.651 2.447 2.823 . 0 0 "[ . 1 . 2 . 3]" 1
854 2 59 THR HB 2 60 THR H . . 4.120 2.654 2.457 2.824 . 0 0 "[ . 1 . 2 . 3]" 1
855 1 60 THR H 1 60 THR HB . . 3.730 2.534 2.494 2.668 . 0 0 "[ . 1 . 2 . 3]" 1
856 2 60 THR H 2 60 THR HB . . 3.730 2.534 2.492 2.633 . 0 0 "[ . 1 . 2 . 3]" 1
857 1 58 ILE H 1 60 THR H . . 4.660 4.214 4.069 4.400 . 0 0 "[ . 1 . 2 . 3]" 1
858 2 58 ILE H 2 60 THR H . . 4.660 4.220 4.079 4.397 . 0 0 "[ . 1 . 2 . 3]" 1
859 1 61 LEU H 1 61 LEU MD2 . . 4.080 3.710 3.533 3.923 . 0 0 "[ . 1 . 2 . 3]" 1
860 2 61 LEU H 2 61 LEU MD2 . . 4.080 3.731 3.538 3.922 . 0 0 "[ . 1 . 2 . 3]" 1
861 1 61 LEU H 1 61 LEU MD1 . . 4.080 3.379 3.294 3.565 . 0 0 "[ . 1 . 2 . 3]" 1
862 2 61 LEU H 2 61 LEU MD1 . . 4.080 3.363 3.270 3.493 . 0 0 "[ . 1 . 2 . 3]" 1
863 1 61 LEU H 1 64 ILE MD . . 4.730 4.263 4.213 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
864 2 61 LEU H 2 64 ILE MD . . 4.730 4.264 4.216 4.324 . 0 0 "[ . 1 . 2 . 3]" 1
865 1 61 LEU H 1 61 LEU HB3 . . 4.030 3.575 3.560 3.585 . 0 0 "[ . 1 . 2 . 3]" 1
866 2 61 LEU H 2 61 LEU HB3 . . 4.030 3.574 3.559 3.587 . 0 0 "[ . 1 . 2 . 3]" 1
867 1 61 LEU H 1 61 LEU HG . . 4.030 2.400 2.226 2.601 . 0 0 "[ . 1 . 2 . 3]" 1
868 2 61 LEU H 2 61 LEU HG . . 4.030 2.410 2.240 2.600 . 0 0 "[ . 1 . 2 . 3]" 1
869 1 61 LEU H 1 61 LEU HB2 . . 4.030 2.410 2.333 2.492 . 0 0 "[ . 1 . 2 . 3]" 1
870 2 61 LEU H 2 61 LEU HB2 . . 4.030 2.407 2.334 2.488 . 0 0 "[ . 1 . 2 . 3]" 1
871 1 57 MET HA 1 61 LEU H . . 4.990 4.693 4.570 4.896 . 0 0 "[ . 1 . 2 . 3]" 1
872 2 57 MET HA 2 61 LEU H . . 4.990 4.663 4.494 4.892 . 0 0 "[ . 1 . 2 . 3]" 1
873 1 61 LEU H 1 62 LYS HA . . 5.500 5.344 5.282 5.401 . 0 0 "[ . 1 . 2 . 3]" 1
874 2 61 LEU H 2 62 LYS HA . . 5.500 5.342 5.270 5.406 . 0 0 "[ . 1 . 2 . 3]" 1
875 1 81 TYR QB 2 61 LEU H . . 5.500 5.401 5.155 5.527 0.027 5 0 "[ . 1 . 2 . 3]" 1
876 1 61 LEU H 2 81 TYR QB . . 5.500 5.397 5.077 5.550 0.050 27 0 "[ . 1 . 2 . 3]" 1
877 1 58 ILE HA 1 61 LEU H . . 4.180 3.341 3.130 3.546 . 0 0 "[ . 1 . 2 . 3]" 1
878 2 58 ILE HA 2 61 LEU H . . 4.180 3.348 3.152 3.539 . 0 0 "[ . 1 . 2 . 3]" 1
879 1 60 THR HB 1 61 LEU H . . 4.330 2.686 2.528 2.788 . 0 0 "[ . 1 . 2 . 3]" 1
880 2 60 THR HB 2 61 LEU H . . 4.330 2.676 2.567 2.774 . 0 0 "[ . 1 . 2 . 3]" 1
881 1 60 THR H 1 61 LEU H . . 3.680 2.613 2.408 2.769 . 0 0 "[ . 1 . 2 . 3]" 1
882 2 60 THR H 2 61 LEU H . . 3.680 2.613 2.413 2.745 . 0 0 "[ . 1 . 2 . 3]" 1
883 1 61 LEU MD1 1 62 LYS H . . 4.920 4.433 4.350 4.534 . 0 0 "[ . 1 . 2 . 3]" 1
884 2 61 LEU MD1 2 62 LYS H . . 4.920 4.428 4.357 4.527 . 0 0 "[ . 1 . 2 . 3]" 1
885 1 62 LYS H 1 62 LYS HB3 . . 3.430 2.541 2.286 2.934 . 0 0 "[ . 1 . 2 . 3]" 1
886 2 62 LYS H 2 62 LYS HB3 . . 3.430 2.542 2.286 2.940 . 0 0 "[ . 1 . 2 . 3]" 1
887 1 61 LEU HB3 1 62 LYS H . . 4.140 3.623 3.484 3.706 . 0 0 "[ . 1 . 2 . 3]" 1
888 2 61 LEU HB3 2 62 LYS H . . 4.140 3.623 3.495 3.698 . 0 0 "[ . 1 . 2 . 3]" 1
889 1 62 LYS H 1 62 LYS HB2 . . 3.430 2.599 2.226 3.590 0.160 19 0 "[ . 1 . 2 . 3]" 1
890 2 62 LYS H 2 62 LYS HB2 . . 3.430 2.598 2.225 3.588 0.158 19 0 "[ . 1 . 2 . 3]" 1
891 1 61 LEU HB2 1 62 LYS H . . 4.140 2.737 2.656 2.813 . 0 0 "[ . 1 . 2 . 3]" 1
892 2 61 LEU HB2 2 62 LYS H . . 4.140 2.741 2.644 2.814 . 0 0 "[ . 1 . 2 . 3]" 1
893 1 58 ILE HA 1 62 LYS H . . 5.070 4.719 4.479 4.959 . 0 0 "[ . 1 . 2 . 3]" 1
894 2 58 ILE HA 2 62 LYS H . . 5.070 4.697 4.439 4.957 . 0 0 "[ . 1 . 2 . 3]" 1
895 1 81 TYR QE 2 62 LYS H . . 4.960 4.742 4.346 4.962 0.002 3 0 "[ . 1 . 2 . 3]" 1
896 1 62 LYS H 2 81 TYR QE . . 4.960 4.744 4.426 4.964 0.004 4 0 "[ . 1 . 2 . 3]" 1
897 1 81 TYR QD 2 62 LYS H . . 4.210 3.872 3.131 4.245 0.035 7 0 "[ . 1 . 2 . 3]" 1
898 1 62 LYS H 2 81 TYR QD . . 4.210 3.911 3.191 4.254 0.044 21 0 "[ . 1 . 2 . 3]" 1
899 1 61 LEU H 1 62 LYS H . . 3.600 2.738 2.661 2.810 . 0 0 "[ . 1 . 2 . 3]" 1
900 2 61 LEU H 2 62 LYS H . . 3.600 2.736 2.648 2.816 . 0 0 "[ . 1 . 2 . 3]" 1
901 1 60 THR H 1 62 LYS H . . 5.090 4.183 4.107 4.261 . 0 0 "[ . 1 . 2 . 3]" 1
902 2 60 THR H 2 62 LYS H . . 5.090 4.171 4.088 4.272 . 0 0 "[ . 1 . 2 . 3]" 1
903 1 82 ASN H 1 84 PHE H . . 5.500 4.463 4.070 4.636 . 0 0 "[ . 1 . 2 . 3]" 1
904 2 82 ASN H 2 84 PHE H . . 5.500 4.461 4.068 4.624 . 0 0 "[ . 1 . 2 . 3]" 1
905 1 72 VAL H 1 72 VAL MG1 . . 3.850 2.061 1.912 3.757 . 0 0 "[ . 1 . 2 . 3]" 1
906 2 72 VAL H 2 72 VAL MG1 . . 3.850 2.061 1.913 3.756 . 0 0 "[ . 1 . 2 . 3]" 1
907 1 72 VAL H 1 72 VAL MG2 . . 3.850 3.640 1.908 3.766 . 0 0 "[ . 1 . 2 . 3]" 1
908 2 72 VAL H 2 72 VAL MG2 . . 3.850 3.640 1.907 3.766 . 0 0 "[ . 1 . 2 . 3]" 1
909 1 35 ILE MD 2 72 VAL H . . 5.500 5.318 5.021 5.454 . 0 0 "[ . 1 . 2 . 3]" 1
910 1 72 VAL H 2 35 ILE MD . . 5.500 5.323 5.140 5.446 . 0 0 "[ . 1 . 2 . 3]" 1
911 1 63 LYS H 1 64 ILE MG . . 4.490 4.221 4.170 4.258 . 0 0 "[ . 1 . 2 . 3]" 1
912 2 63 LYS H 2 64 ILE MG . . 4.490 4.227 4.173 4.270 . 0 0 "[ . 1 . 2 . 3]" 1
913 1 63 LYS H 1 63 LYS HG3 . . 4.030 3.219 2.487 4.005 . 0 0 "[ . 1 . 2 . 3]" 1
914 2 63 LYS H 2 63 LYS HG3 . . 4.030 3.193 2.378 4.009 . 0 0 "[ . 1 . 2 . 3]" 1
915 1 62 LYS HB3 1 63 LYS H . . 4.170 2.946 2.885 3.864 . 0 0 "[ . 1 . 2 . 3]" 1
916 2 62 LYS HB3 2 63 LYS H . . 4.170 2.947 2.890 3.857 . 0 0 "[ . 1 . 2 . 3]" 1
917 1 63 LYS H 1 63 LYS HG2 . . 4.030 3.089 2.256 4.029 . 0 0 "[ . 1 . 2 . 3]" 1
918 2 63 LYS H 2 63 LYS HG2 . . 4.030 3.060 2.238 4.019 . 0 0 "[ . 1 . 2 . 3]" 1
919 1 71 GLN HB2 1 72 VAL H . . 4.200 3.905 3.647 4.072 . 0 0 "[ . 1 . 2 . 3]" 1
920 2 71 GLN HB2 2 72 VAL H . . 4.200 3.907 3.712 4.072 . 0 0 "[ . 1 . 2 . 3]" 1
921 1 71 GLN HB3 1 72 VAL H . . 4.200 2.942 2.623 3.938 . 0 0 "[ . 1 . 2 . 3]" 1
922 2 71 GLN HB3 2 72 VAL H . . 4.200 2.943 2.635 3.923 . 0 0 "[ . 1 . 2 . 3]" 1
923 1 62 LYS HB2 1 63 LYS H . . 4.170 3.990 3.669 4.170 . 10 0 "[ . 1 . 2 . 3]" 1
924 2 62 LYS HB2 2 63 LYS H . . 4.170 3.989 3.663 4.169 . 0 0 "[ . 1 . 2 . 3]" 1
925 1 72 VAL H 1 72 VAL HB . . 3.270 2.600 2.465 2.690 . 0 0 "[ . 1 . 2 . 3]" 1
926 2 72 VAL H 2 72 VAL HB . . 3.270 2.600 2.464 2.692 . 0 0 "[ . 1 . 2 . 3]" 1
927 1 61 LEU H 1 63 LYS H . . 4.490 4.022 3.978 4.064 . 0 0 "[ . 1 . 2 . 3]" 1
928 2 61 LEU H 2 63 LYS H . . 4.490 4.023 3.991 4.064 . 0 0 "[ . 1 . 2 . 3]" 1
929 1 62 LYS H 1 63 LYS H . . 3.420 2.438 2.427 2.450 . 0 0 "[ . 1 . 2 . 3]" 1
930 2 62 LYS H 2 63 LYS H . . 3.420 2.438 2.431 2.449 . 0 0 "[ . 1 . 2 . 3]" 1
931 1 63 LYS H 1 64 ILE H . . 3.410 2.472 2.459 2.489 . 0 0 "[ . 1 . 2 . 3]" 1
932 2 63 LYS H 2 64 ILE H . . 3.410 2.474 2.461 2.493 . 0 0 "[ . 1 . 2 . 3]" 1
933 1 72 VAL H 1 73 ILE H . . 3.550 2.758 2.643 2.845 . 0 0 "[ . 1 . 2 . 3]" 1
934 2 72 VAL H 2 73 ILE H . . 3.550 2.757 2.611 2.838 . 0 0 "[ . 1 . 2 . 3]" 1
935 1 64 ILE H 1 64 ILE MG . . 3.330 2.499 2.473 2.536 . 0 0 "[ . 1 . 2 . 3]" 1
936 2 64 ILE H 2 64 ILE MG . . 3.330 2.503 2.468 2.540 . 0 0 "[ . 1 . 2 . 3]" 1
937 1 64 ILE H 1 64 ILE MD . . 3.930 3.614 3.594 3.627 . 0 0 "[ . 1 . 2 . 3]" 1
938 2 64 ILE H 2 64 ILE MD . . 3.930 3.613 3.601 3.625 . 0 0 "[ . 1 . 2 . 3]" 1
939 1 64 ILE H 1 64 ILE HG13 . . 3.590 2.969 2.936 3.006 . 0 0 "[ . 1 . 2 . 3]" 1
940 2 64 ILE H 2 64 ILE HG13 . . 3.590 2.965 2.926 3.012 . 0 0 "[ . 1 . 2 . 3]" 1
941 1 64 ILE H 1 64 ILE HG12 . . 3.590 1.947 1.919 1.972 . 0 0 "[ . 1 . 2 . 3]" 1
942 2 64 ILE H 2 64 ILE HG12 . . 3.590 1.945 1.926 1.973 . 0 0 "[ . 1 . 2 . 3]" 1
943 1 61 LEU HA 1 64 ILE H . . 4.100 3.562 3.534 3.606 . 0 0 "[ . 1 . 2 . 3]" 1
944 2 61 LEU HA 2 64 ILE H . . 4.100 3.561 3.536 3.602 . 0 0 "[ . 1 . 2 . 3]" 1
945 1 64 ILE H 1 66 ARG H . . 4.820 4.548 4.491 4.599 . 0 0 "[ . 1 . 2 . 3]" 1
946 2 64 ILE H 2 66 ARG H . . 4.820 4.557 4.499 4.593 . 0 0 "[ . 1 . 2 . 3]" 1
947 1 64 ILE H 1 65 ARG H . . 3.630 2.602 2.581 2.614 . 0 0 "[ . 1 . 2 . 3]" 1
948 2 64 ILE H 2 65 ARG H . . 3.630 2.605 2.580 2.619 . 0 0 "[ . 1 . 2 . 3]" 1
949 1 63 LYS H 1 65 ARG H . . 4.820 3.865 3.847 3.877 . 0 0 "[ . 1 . 2 . 3]" 1
950 2 63 LYS H 2 65 ARG H . . 4.820 3.866 3.854 3.876 . 0 0 "[ . 1 . 2 . 3]" 1
951 1 65 ARG H 1 65 ARG HD2 . . 5.030 4.127 3.858 4.353 . 0 0 "[ . 1 . 2 . 3]" 1
952 2 65 ARG H 2 65 ARG HD2 . . 5.030 4.133 3.861 4.355 . 0 0 "[ . 1 . 2 . 3]" 1
953 1 65 ARG H 1 65 ARG HD3 . . 5.030 4.280 4.089 4.825 . 0 0 "[ . 1 . 2 . 3]" 1
954 2 65 ARG H 2 65 ARG HD3 . . 5.030 4.278 4.092 4.826 . 0 0 "[ . 1 . 2 . 3]" 1
955 1 62 LYS HA 1 65 ARG H . . 4.700 3.751 3.702 3.776 . 0 0 "[ . 1 . 2 . 3]" 1
956 2 62 LYS HA 2 65 ARG H . . 4.700 3.755 3.720 3.780 . 0 0 "[ . 1 . 2 . 3]" 1
957 1 65 ARG H 1 65 ARG HG2 . . 4.250 2.703 2.674 2.893 . 0 0 "[ . 1 . 2 . 3]" 1
958 2 65 ARG H 2 65 ARG HG2 . . 4.250 2.701 2.673 2.904 . 0 0 "[ . 1 . 2 . 3]" 1
959 1 65 ARG H 1 65 ARG QB . . 3.830 2.282 2.211 2.295 . 0 0 "[ . 1 . 2 . 3]" 1
960 2 65 ARG H 2 65 ARG QB . . 3.830 2.282 2.207 2.304 . 0 0 "[ . 1 . 2 . 3]" 1
961 1 64 ILE HG12 1 65 ARG H . . 4.420 3.532 3.466 3.558 . 0 0 "[ . 1 . 2 . 3]" 1
962 2 64 ILE HG12 2 65 ARG H . . 4.420 3.539 3.509 3.554 . 0 0 "[ . 1 . 2 . 3]" 1
963 1 64 ILE HG13 1 65 ARG H . . 4.420 3.154 3.072 3.181 . 0 0 "[ . 1 . 2 . 3]" 1
964 2 64 ILE HG13 2 65 ARG H . . 4.420 3.160 3.141 3.188 . 0 0 "[ . 1 . 2 . 3]" 1
965 1 64 ILE MG 1 65 ARG H . . 4.320 4.212 4.196 4.220 . 0 0 "[ . 1 . 2 . 3]" 1
966 2 64 ILE MG 2 65 ARG H . . 4.320 4.214 4.198 4.223 . 0 0 "[ . 1 . 2 . 3]" 1
967 1 64 ILE MD 1 65 ARG H . . 4.950 4.604 4.541 4.622 . 0 0 "[ . 1 . 2 . 3]" 1
968 2 64 ILE MD 2 65 ARG H . . 4.950 4.609 4.593 4.627 . 0 0 "[ . 1 . 2 . 3]" 1
969 1 66 ARG H 1 66 ARG HB2 . . 3.840 3.793 3.761 3.810 . 0 0 "[ . 1 . 2 . 3]" 1
970 2 66 ARG H 2 66 ARG HB2 . . 3.840 3.795 3.770 3.824 . 0 0 "[ . 1 . 2 . 3]" 1
971 1 65 ARG HG2 1 66 ARG H . . 4.440 2.153 2.042 2.307 . 0 0 "[ . 1 . 2 . 3]" 1
972 2 65 ARG HG2 2 66 ARG H . . 4.440 2.145 2.031 2.305 . 0 0 "[ . 1 . 2 . 3]" 1
973 1 65 ARG QB 1 66 ARG H . . 4.190 3.426 3.373 3.443 . 0 0 "[ . 1 . 2 . 3]" 1
974 2 65 ARG QB 2 66 ARG H . . 4.190 3.422 3.353 3.447 . 0 0 "[ . 1 . 2 . 3]" 1
975 1 66 ARG H 1 66 ARG HB3 . . 3.840 2.965 2.909 3.103 . 0 0 "[ . 1 . 2 . 3]" 1
976 2 66 ARG H 2 66 ARG HB3 . . 3.840 2.976 2.904 3.101 . 0 0 "[ . 1 . 2 . 3]" 1
977 1 65 ARG HG3 1 66 ARG H . . 4.440 3.146 2.999 3.278 . 0 0 "[ . 1 . 2 . 3]" 1
978 2 65 ARG HG3 2 66 ARG H . . 4.440 3.134 3.010 3.259 . 0 0 "[ . 1 . 2 . 3]" 1
979 1 66 ARG H 1 66 ARG HG3 . . 4.180 2.235 1.997 2.436 . 0 0 "[ . 1 . 2 . 3]" 1
980 2 66 ARG H 2 66 ARG HG3 . . 4.180 2.218 2.002 2.389 . 0 0 "[ . 1 . 2 . 3]" 1
981 1 64 ILE MG 1 66 ARG H . . 5.500 5.456 5.438 5.516 0.016 14 0 "[ . 1 . 2 . 3]" 1
982 2 64 ILE MG 2 66 ARG H . . 5.500 5.462 5.439 5.562 0.062 14 0 "[ . 1 . 2 . 3]" 1
983 1 66 ARG H 1 66 ARG QD . . 4.330 4.094 3.866 4.319 . 0 0 "[ . 1 . 2 . 3]" 1
984 2 66 ARG H 2 66 ARG QD . . 4.330 4.040 3.485 4.324 . 0 0 "[ . 1 . 2 . 3]" 1
985 1 64 ILE HA 1 66 ARG H . . 4.210 4.005 3.973 4.104 . 0 0 "[ . 1 . 2 . 3]" 1
986 2 64 ILE HA 2 66 ARG H . . 4.210 4.011 3.981 4.170 . 0 0 "[ . 1 . 2 . 3]" 1
987 1 65 ARG H 1 66 ARG H . . 3.580 2.416 2.357 2.487 . 0 0 "[ . 1 . 2 . 3]" 1
988 2 65 ARG H 2 66 ARG H . . 3.580 2.418 2.362 2.442 . 0 0 "[ . 1 . 2 . 3]" 1
989 1 64 ILE MG 1 67 PHE H . . 5.010 4.919 4.828 4.990 . 0 0 "[ . 1 . 2 . 3]" 1
990 2 64 ILE MG 2 67 PHE H . . 5.010 4.924 4.847 5.029 0.019 14 0 "[ . 1 . 2 . 3]" 1
991 1 66 ARG HB3 1 67 PHE H . . 4.480 4.119 4.042 4.514 0.034 19 0 "[ . 1 . 2 . 3]" 1
992 2 66 ARG HB3 2 67 PHE H . . 4.480 4.122 4.038 4.526 0.046 19 0 "[ . 1 . 2 . 3]" 1
993 1 66 ARG HB2 1 67 PHE H . . 4.480 4.187 4.053 4.515 0.035 19 0 "[ . 1 . 2 . 3]" 1
994 2 66 ARG HB2 2 67 PHE H . . 4.480 4.182 4.055 4.517 0.037 14 0 "[ . 1 . 2 . 3]" 1
995 1 67 PHE H 1 67 PHE HB2 . . 3.430 2.935 2.771 3.106 . 0 0 "[ . 1 . 2 . 3]" 1
996 2 67 PHE H 2 67 PHE HB2 . . 3.430 2.948 2.775 3.296 . 0 0 "[ . 1 . 2 . 3]" 1
997 1 67 PHE H 1 67 PHE HB3 . . 3.430 2.238 2.185 2.342 . 0 0 "[ . 1 . 2 . 3]" 1
998 2 67 PHE H 2 67 PHE HB3 . . 3.430 2.234 2.149 2.334 . 0 0 "[ . 1 . 2 . 3]" 1
999 1 64 ILE HA 1 67 PHE H . . 3.950 3.209 3.055 3.246 . 0 0 "[ . 1 . 2 . 3]" 1
1000 2 64 ILE HA 2 67 PHE H . . 3.950 3.219 3.101 3.250 . 0 0 "[ . 1 . 2 . 3]" 1
1001 1 65 ARG HA 1 67 PHE H . . 4.750 4.616 4.180 4.690 . 0 0 "[ . 1 . 2 . 3]" 1
1002 2 65 ARG HA 2 67 PHE H . . 4.750 4.629 4.213 4.690 . 0 0 "[ . 1 . 2 . 3]" 1
1003 1 66 ARG H 1 67 PHE H . . 3.250 1.885 1.833 2.403 . 0 0 "[ . 1 . 2 . 3]" 1
1004 2 66 ARG H 2 67 PHE H . . 3.250 1.880 1.830 2.406 . 0 0 "[ . 1 . 2 . 3]" 1
1005 1 65 ARG H 1 67 PHE H . . 4.780 3.433 3.370 3.764 . 0 0 "[ . 1 . 2 . 3]" 1
1006 2 65 ARG H 2 67 PHE H . . 4.780 3.429 3.367 3.724 . 0 0 "[ . 1 . 2 . 3]" 1
1007 1 66 ARG HG2 1 67 PHE H . . 5.500 4.173 3.894 5.056 . 0 0 "[ . 1 . 2 . 3]" 1
1008 2 66 ARG HG2 2 67 PHE H . . 5.500 4.189 3.890 5.079 . 0 0 "[ . 1 . 2 . 3]" 1
1009 1 66 ARG HG3 1 67 PHE H . . 5.500 2.486 2.296 3.552 . 0 0 "[ . 1 . 2 . 3]" 1
1010 2 66 ARG HG3 2 67 PHE H . . 5.500 2.497 2.281 3.578 . 0 0 "[ . 1 . 2 . 3]" 1
1011 1 68 LYS H 1 68 LYS QG . . 4.420 3.608 2.754 4.312 . 0 0 "[ . 1 . 2 . 3]" 1
1012 2 68 LYS H 2 68 LYS QG . . 4.420 3.591 2.544 4.259 . 0 0 "[ . 1 . 2 . 3]" 1
1013 1 68 LYS H 1 69 VAL H . . 4.370 4.110 4.011 4.297 . 0 0 "[ . 1 . 2 . 3]" 1
1014 2 68 LYS H 2 69 VAL H . . 4.370 4.118 4.051 4.311 . 0 0 "[ . 1 . 2 . 3]" 1
1015 1 69 VAL H 1 74 MET ME . . 4.780 4.409 3.860 4.782 0.002 8 0 "[ . 1 . 2 . 3]" 1
1016 2 69 VAL H 2 74 MET ME . . 4.780 4.399 3.490 4.796 0.016 17 0 "[ . 1 . 2 . 3]" 1
1017 1 68 LYS HB2 1 69 VAL H . . 4.630 3.612 2.653 4.089 . 0 0 "[ . 1 . 2 . 3]" 1
1018 2 68 LYS HB2 2 69 VAL H . . 4.630 3.592 1.981 4.097 . 0 0 "[ . 1 . 2 . 3]" 1
1019 1 68 LYS HB3 1 69 VAL H . . 4.630 4.194 3.964 4.321 . 0 0 "[ . 1 . 2 . 3]" 1
1020 2 68 LYS HB3 2 69 VAL H . . 4.630 4.162 3.514 4.254 . 0 0 "[ . 1 . 2 . 3]" 1
1021 1 68 LYS QD 1 69 VAL H . . 5.120 4.565 3.519 5.137 0.017 18 0 "[ . 1 . 2 . 3]" 1
1022 2 68 LYS QD 2 69 VAL H . . 5.120 4.607 3.868 5.134 0.014 18 0 "[ . 1 . 2 . 3]" 1
1023 1 69 VAL H 1 69 VAL HB . . 3.700 2.932 2.382 3.615 . 0 0 "[ . 1 . 2 . 3]" 1
1024 2 69 VAL H 2 69 VAL HB . . 3.700 2.962 2.375 3.625 . 0 0 "[ . 1 . 2 . 3]" 1
1025 1 69 VAL H 1 69 VAL MG1 . . 4.000 2.238 1.891 2.595 . 0 0 "[ . 1 . 2 . 3]" 1
1026 2 69 VAL H 2 69 VAL MG1 . . 4.000 2.283 1.916 2.589 . 0 0 "[ . 1 . 2 . 3]" 1
1027 1 69 VAL MG2 1 70 SER H . . 3.990 2.897 1.957 4.067 0.077 15 0 "[ . 1 . 2 . 3]" 1
1028 2 69 VAL MG2 2 70 SER H . . 3.990 2.995 1.960 4.071 0.081 19 0 "[ . 1 . 2 . 3]" 1
1029 1 69 VAL MG1 1 70 SER H . . 3.990 3.786 3.398 4.165 0.175 19 0 "[ . 1 . 2 . 3]" 1
1030 2 69 VAL MG1 2 70 SER H . . 3.990 3.716 2.402 4.028 0.038 15 0 "[ . 1 . 2 . 3]" 1
1031 1 31 VAL MG2 2 70 SER H . . 4.980 4.158 3.879 5.081 0.101 19 0 "[ . 1 . 2 . 3]" 1
1032 1 70 SER H 2 31 VAL MG2 . . 4.980 4.101 3.516 4.457 . 0 0 "[ . 1 . 2 . 3]" 1
1033 1 70 SER H 1 73 ILE MD . . 5.170 2.387 1.975 3.014 . 0 0 "[ . 1 . 2 . 3]" 1
1034 2 70 SER H 2 73 ILE MD . . 5.170 2.438 1.981 4.797 . 0 0 "[ . 1 . 2 . 3]" 1
1035 1 31 VAL MG1 2 70 SER H . . 4.980 2.480 2.204 3.955 . 0 0 "[ . 1 . 2 . 3]" 1
1036 1 70 SER H 2 31 VAL MG1 . . 4.980 2.426 2.197 2.818 . 0 0 "[ . 1 . 2 . 3]" 1
1037 1 69 VAL HB 1 70 SER H . . 4.350 3.720 2.577 4.350 0.000 19 0 "[ . 1 . 2 . 3]" 1
1038 2 69 VAL HB 2 70 SER H . . 4.350 3.675 2.611 4.213 . 0 0 "[ . 1 . 2 . 3]" 1
1039 1 70 SER H 1 73 ILE HB . . 4.460 3.493 2.740 4.012 . 0 0 "[ . 1 . 2 . 3]" 1
1040 2 70 SER H 2 73 ILE HB . . 4.460 3.513 2.872 4.860 0.400 19 0 "[ . 1 . 2 . 3]" 1
1041 1 70 SER H 1 70 SER HB2 . . 3.940 2.505 2.112 2.899 . 0 0 "[ . 1 . 2 . 3]" 1
1042 2 70 SER H 2 70 SER HB2 . . 3.940 2.537 2.131 3.181 . 0 0 "[ . 1 . 2 . 3]" 1
1043 1 69 VAL HA 1 70 SER H . . 3.540 2.190 2.148 2.335 . 0 0 "[ . 1 . 2 . 3]" 1
1044 2 69 VAL HA 2 70 SER H . . 3.540 2.234 2.149 3.367 . 0 0 "[ . 1 . 2 . 3]" 1
1045 1 70 SER H 1 70 SER HB3 . . 3.940 2.711 2.409 3.519 . 0 0 "[ . 1 . 2 . 3]" 1
1046 2 70 SER H 2 70 SER HB3 . . 3.940 2.746 2.411 3.811 . 0 0 "[ . 1 . 2 . 3]" 1
1047 1 73 ILE H 1 73 ILE MD . . 4.150 3.515 3.190 3.650 . 0 0 "[ . 1 . 2 . 3]" 1
1048 2 73 ILE H 2 73 ILE MD . . 4.150 3.518 3.188 3.877 . 0 0 "[ . 1 . 2 . 3]" 1
1049 1 72 VAL MG1 1 73 ILE H . . 4.160 2.146 1.996 3.541 . 0 0 "[ . 1 . 2 . 3]" 1
1050 2 72 VAL MG1 2 73 ILE H . . 4.160 2.146 1.998 3.540 . 0 0 "[ . 1 . 2 . 3]" 1
1051 1 73 ILE H 1 73 ILE HG13 . . 4.440 2.257 2.056 2.459 . 0 0 "[ . 1 . 2 . 3]" 1
1052 2 73 ILE H 2 73 ILE HG13 . . 4.440 2.258 2.032 2.469 . 0 0 "[ . 1 . 2 . 3]" 1
1053 1 73 ILE H 1 73 ILE HB . . 3.580 2.476 2.392 2.550 . 0 0 "[ . 1 . 2 . 3]" 1
1054 2 73 ILE H 2 73 ILE HB . . 3.580 2.478 2.388 2.563 . 0 0 "[ . 1 . 2 . 3]" 1
1055 1 70 SER HB2 1 73 ILE H . . 4.780 4.465 3.297 4.794 0.014 12 0 "[ . 1 . 2 . 3]" 1
1056 2 70 SER HB2 2 73 ILE H . . 4.780 4.460 3.180 4.805 0.025 14 0 "[ . 1 . 2 . 3]" 1
1057 1 70 SER HB3 1 73 ILE H . . 4.780 3.041 2.621 3.697 . 0 0 "[ . 1 . 2 . 3]" 1
1058 2 70 SER HB3 2 73 ILE H . . 4.780 3.038 2.619 3.691 . 0 0 "[ . 1 . 2 . 3]" 1
1059 1 73 ILE MG 1 74 MET H . . 3.940 3.217 2.999 3.369 . 0 0 "[ . 1 . 2 . 3]" 1
1060 2 73 ILE MG 2 74 MET H . . 3.940 3.216 2.943 3.504 . 0 0 "[ . 1 . 2 . 3]" 1
1061 1 73 ILE MD 1 74 MET H . . 4.930 4.411 4.242 4.663 . 0 0 "[ . 1 . 2 . 3]" 1
1062 2 73 ILE MD 2 74 MET H . . 4.930 4.410 4.239 4.887 . 0 0 "[ . 1 . 2 . 3]" 1
1063 1 74 MET H 1 74 MET HG3 . . 3.540 2.454 2.098 3.411 . 0 0 "[ . 1 . 2 . 3]" 1
1064 2 74 MET H 2 74 MET HG3 . . 3.540 2.444 2.096 3.390 . 0 0 "[ . 1 . 2 . 3]" 1
1065 1 74 MET H 1 74 MET HB2 . . 4.010 2.722 2.404 3.593 . 0 0 "[ . 1 . 2 . 3]" 1
1066 2 74 MET H 2 74 MET HB2 . . 4.010 2.725 2.405 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
1067 1 73 ILE HB 1 74 MET H . . 3.750 2.454 2.327 2.718 . 0 0 "[ . 1 . 2 . 3]" 1
1068 2 73 ILE HB 2 74 MET H . . 3.750 2.449 2.322 2.786 . 0 0 "[ . 1 . 2 . 3]" 1
1069 1 74 MET H 1 76 LYS QB . . 5.500 5.086 4.677 5.303 . 0 0 "[ . 1 . 2 . 3]" 1
1070 2 74 MET H 2 76 LYS QB . . 5.500 5.094 4.731 5.310 . 0 0 "[ . 1 . 2 . 3]" 1
1071 1 74 MET H 1 74 MET HG2 . . 3.540 2.942 1.933 3.341 . 0 0 "[ . 1 . 2 . 3]" 1
1072 2 74 MET H 2 74 MET HG2 . . 3.540 2.944 1.942 3.460 . 0 0 "[ . 1 . 2 . 3]" 1
1073 1 71 GLN HA 1 74 MET H . . 3.780 3.367 3.135 3.611 . 0 0 "[ . 1 . 2 . 3]" 1
1074 2 71 GLN HA 2 74 MET H . . 3.780 3.371 3.119 3.612 . 0 0 "[ . 1 . 2 . 3]" 1
1075 1 72 VAL HA 1 74 MET H . . 5.150 4.795 4.542 4.915 . 0 0 "[ . 1 . 2 . 3]" 1
1076 2 72 VAL HA 2 74 MET H . . 5.150 4.801 4.409 4.911 . 0 0 "[ . 1 . 2 . 3]" 1
1077 1 70 SER HA 1 74 MET H . . 5.500 5.466 5.182 5.576 0.076 17 0 "[ . 1 . 2 . 3]" 1
1078 2 70 SER HA 2 74 MET H . . 5.500 5.465 5.212 5.576 0.076 11 0 "[ . 1 . 2 . 3]" 1
1079 1 72 VAL H 1 74 MET H . . 4.600 4.361 4.169 4.510 . 0 0 "[ . 1 . 2 . 3]" 1
1080 2 72 VAL H 2 74 MET H . . 4.600 4.365 4.106 4.550 . 0 0 "[ . 1 . 2 . 3]" 1
1081 1 73 ILE H 1 74 MET H . . 3.440 2.631 2.505 2.814 . 0 0 "[ . 1 . 2 . 3]" 1
1082 2 73 ILE H 2 74 MET H . . 3.440 2.632 2.478 2.802 . 0 0 "[ . 1 . 2 . 3]" 1
1083 1 74 MET H 1 75 GLU H . . 3.560 2.682 2.582 2.807 . 0 0 "[ . 1 . 2 . 3]" 1
1084 2 74 MET H 2 75 GLU H . . 3.560 2.683 2.549 2.792 . 0 0 "[ . 1 . 2 . 3]" 1
1085 1 75 GLU H 1 75 GLU HB2 . . 3.780 2.529 2.085 3.611 . 0 0 "[ . 1 . 2 . 3]" 1
1086 2 75 GLU H 2 75 GLU HB2 . . 3.780 2.563 2.075 3.604 . 0 0 "[ . 1 . 2 . 3]" 1
1087 1 75 GLU H 1 75 GLU HB3 . . 3.780 3.098 2.150 3.543 . 0 0 "[ . 1 . 2 . 3]" 1
1088 2 75 GLU H 2 75 GLU HB3 . . 3.780 3.072 2.137 3.544 . 0 0 "[ . 1 . 2 . 3]" 1
1089 1 71 GLN QG 1 75 GLU H . . 4.800 3.982 3.420 4.822 0.022 30 0 "[ . 1 . 2 . 3]" 1
1090 2 71 GLN QG 2 75 GLU H . . 4.800 3.990 3.341 4.897 0.097 17 0 "[ . 1 . 2 . 3]" 1
1091 1 75 GLU H 1 76 LYS QB . . 4.840 4.329 4.194 4.503 . 0 0 "[ . 1 . 2 . 3]" 1
1092 2 75 GLU H 2 76 LYS QB . . 4.840 4.331 4.237 4.490 . 0 0 "[ . 1 . 2 . 3]" 1
1093 1 72 VAL HA 1 75 GLU H . . 4.080 3.742 3.509 3.978 . 0 0 "[ . 1 . 2 . 3]" 1
1094 2 72 VAL HA 2 75 GLU H . . 4.080 3.746 3.540 3.972 . 0 0 "[ . 1 . 2 . 3]" 1
1095 1 72 VAL H 1 75 GLU H . . 4.860 4.732 4.639 4.888 0.028 23 0 "[ . 1 . 2 . 3]" 1
1096 2 72 VAL H 2 75 GLU H . . 4.860 4.734 4.624 4.853 . 0 0 "[ . 1 . 2 . 3]" 1
1097 1 73 ILE H 1 75 GLU H . . 4.630 3.929 3.834 4.216 . 0 0 "[ . 1 . 2 . 3]" 1
1098 2 73 ILE H 2 75 GLU H . . 4.630 3.926 3.819 4.208 . 0 0 "[ . 1 . 2 . 3]" 1
1099 1 75 GLU HB2 1 76 LYS H . . 3.960 3.141 2.480 4.023 0.063 6 0 "[ . 1 . 2 . 3]" 1
1100 2 75 GLU HB2 2 76 LYS H . . 3.960 3.154 2.478 4.018 0.058 6 0 "[ . 1 . 2 . 3]" 1
1101 1 75 GLU HB3 1 76 LYS H . . 3.960 3.149 2.531 3.971 0.011 22 0 "[ . 1 . 2 . 3]" 1
1102 2 75 GLU HB3 2 76 LYS H . . 3.960 3.156 2.592 3.975 0.015 23 0 "[ . 1 . 2 . 3]" 1
1103 1 76 LYS H 1 76 LYS QB . . 3.570 2.149 2.070 2.331 . 0 0 "[ . 1 . 2 . 3]" 1
1104 2 76 LYS H 2 76 LYS QB . . 3.570 2.150 2.069 2.339 . 0 0 "[ . 1 . 2 . 3]" 1
1105 1 76 LYS H 1 76 LYS HG2 . . 4.290 4.117 3.561 4.288 . 0 0 "[ . 1 . 2 . 3]" 1
1106 2 76 LYS H 2 76 LYS HG2 . . 4.290 4.116 3.559 4.290 . 25 0 "[ . 1 . 2 . 3]" 1
1107 1 76 LYS H 1 76 LYS HG3 . . 4.290 3.020 2.436 3.272 . 0 0 "[ . 1 . 2 . 3]" 1
1108 2 76 LYS H 2 76 LYS HG3 . . 4.290 3.017 2.416 3.274 . 0 0 "[ . 1 . 2 . 3]" 1
1109 1 72 VAL HA 1 76 LYS H . . 4.550 4.045 3.832 4.215 . 0 0 "[ . 1 . 2 . 3]" 1
1110 2 72 VAL HA 2 76 LYS H . . 4.550 4.049 3.842 4.221 . 0 0 "[ . 1 . 2 . 3]" 1
1111 1 73 ILE HA 1 76 LYS H . . 4.520 3.522 3.328 3.741 . 0 0 "[ . 1 . 2 . 3]" 1
1112 2 73 ILE HA 2 76 LYS H . . 4.520 3.523 3.319 3.663 . 0 0 "[ . 1 . 2 . 3]" 1
1113 1 75 GLU H 1 76 LYS H . . 3.340 2.599 2.462 2.702 . 0 0 "[ . 1 . 2 . 3]" 1
1114 2 75 GLU H 2 76 LYS H . . 3.340 2.602 2.484 2.688 . 0 0 "[ . 1 . 2 . 3]" 1
1115 1 77 SER H 1 77 SER HB2 . . 3.960 3.580 3.572 3.587 . 0 0 "[ . 1 . 2 . 3]" 1
1116 2 77 SER H 2 77 SER HB2 . . 3.960 3.581 3.570 3.587 . 0 0 "[ . 1 . 2 . 3]" 1
1117 1 77 SER H 1 77 SER HB3 . . 3.960 2.407 2.360 2.447 . 0 0 "[ . 1 . 2 . 3]" 1
1118 2 77 SER H 2 77 SER HB3 . . 3.960 2.407 2.352 2.448 . 0 0 "[ . 1 . 2 . 3]" 1
1119 1 76 LYS QB 1 77 SER H . . 4.030 2.724 2.617 2.816 . 0 0 "[ . 1 . 2 . 3]" 1
1120 2 76 LYS QB 2 77 SER H . . 4.030 2.728 2.645 2.824 . 0 0 "[ . 1 . 2 . 3]" 1
1121 1 76 LYS HG2 1 77 SER H . . 5.230 5.106 5.005 5.196 . 0 0 "[ . 1 . 2 . 3]" 1
1122 2 76 LYS HG2 2 77 SER H . . 5.230 5.109 5.019 5.189 . 0 0 "[ . 1 . 2 . 3]" 1
1123 1 76 LYS HG3 1 77 SER H . . 5.230 4.813 4.515 4.942 . 0 0 "[ . 1 . 2 . 3]" 1
1124 2 76 LYS HG3 2 77 SER H . . 5.230 4.814 4.523 4.945 . 0 0 "[ . 1 . 2 . 3]" 1
1125 1 38 LEU MD1 2 77 SER H . . 4.940 3.433 3.072 4.867 . 0 0 "[ . 1 . 2 . 3]" 1
1126 1 77 SER H 2 38 LEU MD1 . . 4.940 3.427 3.068 4.768 . 0 0 "[ . 1 . 2 . 3]" 1
1127 1 38 LEU MD2 2 77 SER H . . 4.940 3.710 2.573 4.510 . 0 0 "[ . 1 . 2 . 3]" 1
1128 1 77 SER H 2 38 LEU MD2 . . 4.940 3.645 2.508 4.393 . 0 0 "[ . 1 . 2 . 3]" 1
1129 1 64 ILE MD 2 77 SER H . . 5.210 3.922 3.862 3.980 . 0 0 "[ . 1 . 2 . 3]" 1
1130 1 77 SER H 2 64 ILE MD . . 5.210 3.926 3.857 3.984 . 0 0 "[ . 1 . 2 . 3]" 1
1131 1 76 LYS HA 1 78 THR H . . 4.720 4.503 4.285 4.642 . 0 0 "[ . 1 . 2 . 3]" 1
1132 2 76 LYS HA 2 78 THR H . . 4.720 4.514 4.335 4.627 . 0 0 "[ . 1 . 2 . 3]" 1
1133 1 75 GLU HA 1 78 THR H . . 3.980 3.757 3.662 3.893 . 0 0 "[ . 1 . 2 . 3]" 1
1134 2 75 GLU HA 2 78 THR H . . 3.980 3.757 3.664 3.897 . 0 0 "[ . 1 . 2 . 3]" 1
1135 1 78 THR H 1 78 THR HB . . 3.910 2.631 2.568 2.698 . 0 0 "[ . 1 . 2 . 3]" 1
1136 2 78 THR H 2 78 THR HB . . 3.910 2.629 2.554 2.713 . 0 0 "[ . 1 . 2 . 3]" 1
1137 1 78 THR H 1 79 MET QB . . 4.630 4.503 4.448 4.559 . 0 0 "[ . 1 . 2 . 3]" 1
1138 2 78 THR H 2 79 MET QB . . 4.630 4.505 4.438 4.565 . 0 0 "[ . 1 . 2 . 3]" 1
1139 1 78 THR H 1 78 THR HG1 . . 4.200 2.527 2.048 3.509 . 0 0 "[ . 1 . 2 . 3]" 1
1140 2 78 THR H 2 78 THR HG1 . . 4.200 2.530 2.050 3.580 . 0 0 "[ . 1 . 2 . 3]" 1
1141 1 78 THR H 1 79 MET H . . 3.550 2.827 2.775 2.886 . 0 0 "[ . 1 . 2 . 3]" 1
1142 2 78 THR H 2 79 MET H . . 3.550 2.828 2.768 2.915 . 0 0 "[ . 1 . 2 . 3]" 1
1143 1 77 SER H 1 78 THR H . . 3.550 2.814 2.716 2.882 . 0 0 "[ . 1 . 2 . 3]" 1
1144 2 77 SER H 2 78 THR H . . 3.550 2.816 2.723 2.878 . 0 0 "[ . 1 . 2 . 3]" 1
1145 1 78 THR MG 1 79 MET H . . 3.770 3.458 3.250 3.601 . 0 0 "[ . 1 . 2 . 3]" 1
1146 2 78 THR MG 2 79 MET H . . 3.770 3.456 3.253 3.606 . 0 0 "[ . 1 . 2 . 3]" 1
1147 1 79 MET H 1 79 MET QB . . 3.050 2.193 2.129 2.250 . 0 0 "[ . 1 . 2 . 3]" 1
1148 2 79 MET H 2 79 MET QB . . 3.050 2.193 2.128 2.250 . 0 0 "[ . 1 . 2 . 3]" 1
1149 1 79 MET H 1 79 MET HG2 . . 4.580 4.479 4.382 4.573 . 0 0 "[ . 1 . 2 . 3]" 1
1150 2 79 MET H 2 79 MET HG2 . . 4.580 4.466 4.131 4.572 . 0 0 "[ . 1 . 2 . 3]" 1
1151 1 79 MET H 1 79 MET HG3 . . 4.580 4.294 4.110 4.557 . 0 0 "[ . 1 . 2 . 3]" 1
1152 2 79 MET H 2 79 MET HG3 . . 4.580 4.303 4.101 4.552 . 0 0 "[ . 1 . 2 . 3]" 1
1153 1 78 THR HB 1 79 MET H . . 4.350 2.518 2.216 2.784 . 0 0 "[ . 1 . 2 . 3]" 1
1154 2 78 THR HB 2 79 MET H . . 4.350 2.522 2.228 2.780 . 0 0 "[ . 1 . 2 . 3]" 1
1155 1 75 GLU HA 1 79 MET H . . 5.120 4.741 4.589 4.930 . 0 0 "[ . 1 . 2 . 3]" 1
1156 2 75 GLU HA 2 79 MET H . . 5.120 4.740 4.626 4.930 . 0 0 "[ . 1 . 2 . 3]" 1
1157 1 80 LEU H 1 80 LEU HB3 . . 3.800 3.582 3.515 3.604 . 0 0 "[ . 1 . 2 . 3]" 1
1158 2 80 LEU H 2 80 LEU HB3 . . 3.800 3.584 3.516 3.605 . 0 0 "[ . 1 . 2 . 3]" 1
1159 1 80 LEU H 1 80 LEU MD2 . . 3.870 3.036 1.923 3.752 . 0 0 "[ . 1 . 2 . 3]" 1
1160 2 80 LEU H 2 80 LEU MD2 . . 3.870 3.015 1.973 3.522 . 0 0 "[ . 1 . 2 . 3]" 1
1161 1 80 LEU H 1 80 LEU MD1 . . 3.870 3.641 2.197 3.884 0.014 17 0 "[ . 1 . 2 . 3]" 1
1162 2 80 LEU H 2 80 LEU MD1 . . 3.870 3.704 3.350 3.892 0.022 3 0 "[ . 1 . 2 . 3]" 1
1163 1 80 LEU H 1 80 LEU HB2 . . 3.800 2.450 2.216 2.680 . 0 0 "[ . 1 . 2 . 3]" 1
1164 2 80 LEU H 2 80 LEU HB2 . . 3.800 2.453 2.216 2.682 . 0 0 "[ . 1 . 2 . 3]" 1
1165 1 80 LEU H 1 80 LEU HG . . 3.910 2.651 1.992 3.981 0.071 16 0 "[ . 1 . 2 . 3]" 1
1166 2 80 LEU H 2 80 LEU HG . . 3.910 2.604 1.986 3.965 0.055 16 0 "[ . 1 . 2 . 3]" 1
1167 1 79 MET QB 1 80 LEU H . . 3.500 2.474 2.300 2.646 . 0 0 "[ . 1 . 2 . 3]" 1
1168 2 79 MET QB 2 80 LEU H . . 3.500 2.473 2.300 2.679 . 0 0 "[ . 1 . 2 . 3]" 1
1169 1 80 LEU H 1 81 TYR QB . . 4.530 4.263 4.210 4.355 . 0 0 "[ . 1 . 2 . 3]" 1
1170 2 80 LEU H 2 81 TYR QB . . 4.530 4.267 4.203 4.354 . 0 0 "[ . 1 . 2 . 3]" 1
1171 1 78 THR HB 1 80 LEU H . . 5.500 5.127 4.734 5.372 . 0 0 "[ . 1 . 2 . 3]" 1
1172 2 78 THR HB 2 80 LEU H . . 5.500 5.134 4.701 5.359 . 0 0 "[ . 1 . 2 . 3]" 1
1173 1 78 THR HB 1 81 TYR H . . 5.500 5.420 5.218 5.521 0.021 6 0 "[ . 1 . 2 . 3]" 1
1174 2 78 THR HB 2 81 TYR H . . 5.500 5.434 5.199 5.528 0.028 19 0 "[ . 1 . 2 . 3]" 1
1175 1 81 TYR H 1 81 TYR QB . . 3.410 2.241 2.216 2.254 . 0 0 "[ . 1 . 2 . 3]" 1
1176 2 81 TYR H 2 81 TYR QB . . 3.410 2.242 2.227 2.255 . 0 0 "[ . 1 . 2 . 3]" 1
1177 1 61 LEU HB2 2 81 TYR H . . 5.300 4.704 4.581 4.921 . 0 0 "[ . 1 . 2 . 3]" 1
1178 1 81 TYR H 2 61 LEU HB2 . . 5.300 4.720 4.537 4.866 . 0 0 "[ . 1 . 2 . 3]" 1
1179 1 79 MET QB 1 81 TYR H . . 5.500 4.619 4.456 4.758 . 0 0 "[ . 1 . 2 . 3]" 1
1180 2 79 MET QB 2 81 TYR H . . 5.500 4.625 4.464 4.878 . 0 0 "[ . 1 . 2 . 3]" 1
1181 1 80 LEU HB2 1 81 TYR H . . 4.430 2.660 2.520 2.866 . 0 0 "[ . 1 . 2 . 3]" 1
1182 2 80 LEU HB2 2 81 TYR H . . 4.430 2.645 2.504 2.758 . 0 0 "[ . 1 . 2 . 3]" 1
1183 1 80 LEU MD2 1 81 TYR H . . 5.500 4.490 3.735 4.726 . 0 0 "[ . 1 . 2 . 3]" 1
1184 2 80 LEU MD2 2 81 TYR H . . 5.500 4.483 3.818 4.661 . 0 0 "[ . 1 . 2 . 3]" 1
1185 1 61 LEU MD2 2 81 TYR H . . 4.990 3.710 3.446 4.000 . 0 0 "[ . 1 . 2 . 3]" 1
1186 1 81 TYR H 2 61 LEU MD2 . . 4.990 3.707 3.392 3.975 . 0 0 "[ . 1 . 2 . 3]" 1
1187 1 80 LEU MD1 1 81 TYR H . . 5.500 4.577 4.093 4.699 . 0 0 "[ . 1 . 2 . 3]" 1
1188 2 80 LEU MD1 2 81 TYR H . . 5.500 4.593 4.409 4.733 . 0 0 "[ . 1 . 2 . 3]" 1
1189 1 61 LEU MD1 2 81 TYR H . . 4.990 3.653 3.308 3.810 . 0 0 "[ . 1 . 2 . 3]" 1
1190 1 81 TYR H 2 61 LEU MD1 . . 4.990 3.688 3.458 3.862 . 0 0 "[ . 1 . 2 . 3]" 1
1191 1 61 LEU HB3 2 81 TYR H . . 5.300 3.611 3.477 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
1192 1 81 TYR H 2 61 LEU HB3 . . 5.300 3.631 3.501 3.799 . 0 0 "[ . 1 . 2 . 3]" 1
1193 1 80 LEU HB3 1 81 TYR H . . 4.430 3.666 3.307 3.922 . 0 0 "[ . 1 . 2 . 3]" 1
1194 2 80 LEU HB3 2 81 TYR H . . 4.430 3.661 3.331 3.912 . 0 0 "[ . 1 . 2 . 3]" 1
1195 1 81 TYR H 1 81 TYR QD . . 4.230 4.183 4.126 4.195 . 0 0 "[ . 1 . 2 . 3]" 1
1196 2 81 TYR H 2 81 TYR QD . . 4.230 4.184 4.147 4.197 . 0 0 "[ . 1 . 2 . 3]" 1
1197 1 81 TYR H 1 83 LYS H . . 4.910 4.007 3.818 4.219 . 0 0 "[ . 1 . 2 . 3]" 1
1198 2 81 TYR H 2 83 LYS H . . 4.910 4.011 3.823 4.183 . 0 0 "[ . 1 . 2 . 3]" 1
1199 1 78 THR MG 1 82 ASN H . . 4.490 3.591 3.344 3.820 . 0 0 "[ . 1 . 2 . 3]" 1
1200 2 78 THR MG 2 82 ASN H . . 4.490 3.589 3.383 3.841 . 0 0 "[ . 1 . 2 . 3]" 1
1201 1 81 TYR QB 1 82 ASN H . . 3.470 2.371 2.140 2.683 . 0 0 "[ . 1 . 2 . 3]" 1
1202 2 81 TYR QB 2 82 ASN H . . 3.470 2.364 2.106 2.687 . 0 0 "[ . 1 . 2 . 3]" 1
1203 1 82 ASN H 1 82 ASN HB2 . . 3.790 2.499 2.090 3.586 . 0 0 "[ . 1 . 2 . 3]" 1
1204 2 82 ASN H 2 82 ASN HB2 . . 3.790 2.515 2.089 3.580 . 0 0 "[ . 1 . 2 . 3]" 1
1205 1 82 ASN H 1 82 ASN HB3 . . 3.790 3.406 2.652 3.602 . 0 0 "[ . 1 . 2 . 3]" 1
1206 2 82 ASN H 2 82 ASN HB3 . . 3.790 3.363 2.338 3.594 . 0 0 "[ . 1 . 2 . 3]" 1
1207 1 79 MET HA 1 82 ASN H . . 4.360 4.039 3.803 4.298 . 0 0 "[ . 1 . 2 . 3]" 1
1208 2 79 MET HA 2 82 ASN H . . 4.360 4.046 3.781 4.307 . 0 0 "[ . 1 . 2 . 3]" 1
1209 1 80 LEU HA 1 82 ASN H . . 4.950 4.667 4.306 4.992 0.042 7 0 "[ . 1 . 2 . 3]" 1
1210 2 80 LEU HA 2 82 ASN H . . 4.950 4.667 4.314 4.992 0.042 15 0 "[ . 1 . 2 . 3]" 1
1211 1 82 ASN H 1 83 LYS H . . 3.420 2.620 2.494 2.742 . 0 0 "[ . 1 . 2 . 3]" 1
1212 2 82 ASN H 2 83 LYS H . . 3.420 2.624 2.494 2.720 . 0 0 "[ . 1 . 2 . 3]" 1
1213 1 82 ASN H 1 82 ASN HD21 . . 4.860 3.647 2.554 4.609 . 0 0 "[ . 1 . 2 . 3]" 1
1214 2 82 ASN H 2 82 ASN HD21 . . 4.860 3.581 2.103 4.634 . 0 0 "[ . 1 . 2 . 3]" 1
1215 1 81 TYR QD 1 82 ASN H . . 3.880 3.323 2.362 3.883 0.003 22 0 "[ . 1 . 2 . 3]" 1
1216 2 81 TYR QD 2 82 ASN H . . 3.880 3.374 2.340 3.887 0.007 19 0 "[ . 1 . 2 . 3]" 1
1217 1 82 ASN H 1 82 ASN HD22 . . 4.860 4.285 3.382 4.738 . 0 0 "[ . 1 . 2 . 3]" 1
1218 2 82 ASN H 2 82 ASN HD22 . . 4.860 4.288 3.428 4.740 . 0 0 "[ . 1 . 2 . 3]" 1
1219 1 80 LEU H 1 82 ASN H . . 4.650 4.400 4.053 4.679 0.029 16 0 "[ . 1 . 2 . 3]" 1
1220 2 80 LEU H 2 82 ASN H . . 4.650 4.399 4.045 4.673 0.023 18 0 "[ . 1 . 2 . 3]" 1
1221 1 81 TYR H 1 82 ASN H . . 3.450 2.863 2.610 2.994 . 0 0 "[ . 1 . 2 . 3]" 1
1222 2 81 TYR H 2 82 ASN H . . 3.450 2.869 2.595 3.039 . 0 0 "[ . 1 . 2 . 3]" 1
1223 1 82 ASN HB2 1 83 LYS H . . 3.990 2.966 2.599 3.806 . 0 0 "[ . 1 . 2 . 3]" 1
1224 2 82 ASN HB2 2 83 LYS H . . 3.990 3.014 2.679 3.989 . 0 0 "[ . 1 . 2 . 3]" 1
1225 1 83 LYS H 1 86 ASN QB . . 5.500 5.081 4.714 5.503 0.003 27 0 "[ . 1 . 2 . 3]" 1
1226 2 83 LYS H 2 86 ASN QB . . 5.500 5.069 4.716 5.503 0.003 27 0 "[ . 1 . 2 . 3]" 1
1227 1 82 ASN HB3 1 83 LYS H . . 3.990 3.594 2.871 4.138 0.148 5 0 "[ . 1 . 2 . 3]" 1
1228 2 82 ASN HB3 2 83 LYS H . . 3.990 3.578 2.867 4.129 0.139 18 0 "[ . 1 . 2 . 3]" 1
1229 1 79 MET HA 1 83 LYS H . . 4.670 4.271 4.058 4.466 . 0 0 "[ . 1 . 2 . 3]" 1
1230 2 79 MET HA 2 83 LYS H . . 4.670 4.286 4.070 4.541 . 0 0 "[ . 1 . 2 . 3]" 1
1231 1 81 TYR HA 1 83 LYS H . . 4.720 4.434 4.296 4.724 0.004 8 0 "[ . 1 . 2 . 3]" 1
1232 2 81 TYR HA 2 83 LYS H . . 4.720 4.426 4.271 4.721 0.001 1 0 "[ . 1 . 2 . 3]" 1
1233 1 80 LEU HA 1 83 LYS H . . 3.800 3.430 3.244 3.637 . 0 0 "[ . 1 . 2 . 3]" 1
1234 2 80 LEU HA 2 83 LYS H . . 3.800 3.428 3.264 3.621 . 0 0 "[ . 1 . 2 . 3]" 1
1235 1 83 LYS H 1 83 LYS HB2 . . 3.320 2.355 2.157 2.643 . 0 0 "[ . 1 . 2 . 3]" 1
1236 2 83 LYS H 2 83 LYS HB2 . . 3.320 2.353 2.158 2.625 . 0 0 "[ . 1 . 2 . 3]" 1
1237 1 83 LYS H 1 83 LYS HB3 . . 3.320 2.716 2.409 2.973 . 0 0 "[ . 1 . 2 . 3]" 1
1238 2 83 LYS H 2 83 LYS HB3 . . 3.320 2.718 2.422 2.973 . 0 0 "[ . 1 . 2 . 3]" 1
1239 1 80 LEU H 1 83 LYS H . . 4.890 4.689 4.601 4.761 . 0 0 "[ . 1 . 2 . 3]" 1
1240 2 80 LEU H 2 83 LYS H . . 4.890 4.691 4.605 4.756 . 0 0 "[ . 1 . 2 . 3]" 1
1241 1 83 LYS H 1 84 PHE H . . 3.400 2.858 2.564 2.918 . 0 0 "[ . 1 . 2 . 3]" 1
1242 2 83 LYS H 2 84 PHE H . . 3.400 2.853 2.567 2.911 . 0 0 "[ . 1 . 2 . 3]" 1
1243 1 61 LEU MD2 1 62 LYS H . . 4.920 4.828 4.743 4.878 . 0 0 "[ . 1 . 2 . 3]" 1
1244 2 61 LEU MD2 2 62 LYS H . . 4.920 4.835 4.771 4.882 . 0 0 "[ . 1 . 2 . 3]" 1
1245 1 83 LYS HB2 1 84 PHE H . . 3.960 3.644 3.410 3.915 . 0 0 "[ . 1 . 2 . 3]" 1
1246 2 83 LYS HB2 2 84 PHE H . . 3.960 3.645 3.419 3.903 . 0 0 "[ . 1 . 2 . 3]" 1
1247 1 83 LYS HB3 1 84 PHE H . . 3.960 2.395 2.280 2.688 . 0 0 "[ . 1 . 2 . 3]" 1
1248 2 83 LYS HB3 2 84 PHE H . . 3.960 2.397 2.283 2.689 . 0 0 "[ . 1 . 2 . 3]" 1
1249 1 81 TYR HA 1 84 PHE H . . 4.280 3.880 3.607 4.057 . 0 0 "[ . 1 . 2 . 3]" 1
1250 2 81 TYR HA 2 84 PHE H . . 4.280 3.868 3.606 3.991 . 0 0 "[ . 1 . 2 . 3]" 1
1251 1 80 LEU HA 1 84 PHE H . . 4.440 4.118 3.814 4.443 0.003 14 0 "[ . 1 . 2 . 3]" 1
1252 2 80 LEU HA 2 84 PHE H . . 4.440 4.131 3.808 4.393 . 0 0 "[ . 1 . 2 . 3]" 1
1253 1 84 PHE H 1 84 PHE QD . . 4.000 3.128 2.596 3.330 . 0 0 "[ . 1 . 2 . 3]" 1
1254 2 84 PHE H 2 84 PHE QD . . 4.000 3.007 2.493 3.332 . 0 0 "[ . 1 . 2 . 3]" 1
1255 1 84 PHE H 1 85 LYS H . . 3.330 2.537 2.468 2.700 . 0 0 "[ . 1 . 2 . 3]" 1
1256 2 84 PHE H 2 85 LYS H . . 3.330 2.543 2.467 2.729 . 0 0 "[ . 1 . 2 . 3]" 1
1257 1 85 LYS H 1 85 LYS HB2 . . 4.010 2.448 2.066 3.541 . 0 0 "[ . 1 . 2 . 3]" 1
1258 2 85 LYS H 2 85 LYS HB2 . . 4.010 2.450 2.064 3.541 . 0 0 "[ . 1 . 2 . 3]" 1
1259 1 85 LYS H 1 85 LYS HB3 . . 4.010 2.711 2.274 3.557 . 0 0 "[ . 1 . 2 . 3]" 1
1260 2 85 LYS H 2 85 LYS HB3 . . 4.010 2.709 2.274 3.555 . 0 0 "[ . 1 . 2 . 3]" 1
1261 1 85 LYS H 1 85 LYS QG . . 4.130 3.779 2.595 4.011 . 0 0 "[ . 1 . 2 . 3]" 1
1262 2 85 LYS H 2 85 LYS QG . . 4.130 3.780 2.594 4.011 . 0 0 "[ . 1 . 2 . 3]" 1
1263 1 58 ILE MG 2 85 LYS H . . 4.860 4.089 3.764 4.386 . 0 0 "[ . 1 . 2 . 3]" 1
1264 1 85 LYS H 2 58 ILE MG . . 4.860 4.096 3.773 4.317 . 0 0 "[ . 1 . 2 . 3]" 1
1265 1 84 PHE HB2 1 85 LYS H . . 4.080 2.730 2.490 2.853 . 0 0 "[ . 1 . 2 . 3]" 1
1266 2 84 PHE HB2 2 85 LYS H . . 4.080 2.719 2.477 2.877 . 0 0 "[ . 1 . 2 . 3]" 1
1267 1 84 PHE HB3 1 85 LYS H . . 4.080 3.602 3.227 3.777 . 0 0 "[ . 1 . 2 . 3]" 1
1268 2 84 PHE HB3 2 85 LYS H . . 4.080 3.589 3.245 3.779 . 0 0 "[ . 1 . 2 . 3]" 1
1269 1 82 ASN HA 1 85 LYS H . . 4.010 3.330 3.215 3.737 . 0 0 "[ . 1 . 2 . 3]" 1
1270 2 82 ASN HA 2 85 LYS H . . 4.010 3.338 3.187 3.733 . 0 0 "[ . 1 . 2 . 3]" 1
1271 1 81 TYR HA 1 85 LYS H . . 4.410 4.257 3.696 4.423 0.013 16 0 "[ . 1 . 2 . 3]" 1
1272 2 81 TYR HA 2 85 LYS H . . 4.410 4.257 3.699 4.477 0.067 27 0 "[ . 1 . 2 . 3]" 1
1273 1 83 LYS H 1 85 LYS H . . 4.530 4.054 3.958 4.330 . 0 0 "[ . 1 . 2 . 3]" 1
1274 2 83 LYS H 2 85 LYS H . . 4.530 4.066 3.949 4.312 . 0 0 "[ . 1 . 2 . 3]" 1
1275 1 85 LYS H 1 87 MET H . . 4.750 4.165 4.001 4.434 . 0 0 "[ . 1 . 2 . 3]" 1
1276 2 85 LYS H 2 87 MET H . . 4.750 4.171 4.012 4.459 . 0 0 "[ . 1 . 2 . 3]" 1
1277 1 84 PHE QD 1 85 LYS H . . 4.730 4.412 4.107 4.559 . 0 0 "[ . 1 . 2 . 3]" 1
1278 2 84 PHE QD 2 85 LYS H . . 4.730 4.361 4.016 4.579 . 0 0 "[ . 1 . 2 . 3]" 1
1279 1 85 LYS H 1 86 ASN H . . 3.480 2.785 2.590 2.964 . 0 0 "[ . 1 . 2 . 3]" 1
1280 2 85 LYS H 2 86 ASN H . . 3.480 2.787 2.583 2.965 . 0 0 "[ . 1 . 2 . 3]" 1
1281 1 85 LYS HB2 1 86 ASN H . . 4.220 3.670 2.530 4.049 . 0 0 "[ . 1 . 2 . 3]" 1
1282 2 85 LYS HB2 2 86 ASN H . . 4.220 3.673 2.534 4.049 . 0 0 "[ . 1 . 2 . 3]" 1
1283 1 85 LYS QG 1 86 ASN H . . 4.270 3.684 2.258 4.268 . 0 0 "[ . 1 . 2 . 3]" 1
1284 2 85 LYS QG 2 86 ASN H . . 4.270 3.680 2.256 4.269 . 0 0 "[ . 1 . 2 . 3]" 1
1285 1 85 LYS HB3 1 86 ASN H . . 4.220 2.655 2.234 3.819 . 0 0 "[ . 1 . 2 . 3]" 1
1286 2 85 LYS HB3 2 86 ASN H . . 4.220 2.653 2.236 3.817 . 0 0 "[ . 1 . 2 . 3]" 1
1287 1 86 ASN H 1 86 ASN QB . . 3.000 2.149 2.051 2.393 . 0 0 "[ . 1 . 2 . 3]" 1
1288 2 86 ASN H 2 86 ASN QB . . 3.000 2.149 2.050 2.414 . 0 0 "[ . 1 . 2 . 3]" 1
1289 1 82 ASN HA 1 86 ASN H . . 4.210 3.835 3.544 4.207 . 0 0 "[ . 1 . 2 . 3]" 1
1290 2 82 ASN HA 2 86 ASN H . . 4.210 3.835 3.514 4.191 . 0 0 "[ . 1 . 2 . 3]" 1
1291 1 83 LYS HA 1 86 ASN H . . 4.270 3.932 3.579 4.169 . 0 0 "[ . 1 . 2 . 3]" 1
1292 2 83 LYS HA 2 86 ASN H . . 4.270 3.927 3.559 4.174 . 0 0 "[ . 1 . 2 . 3]" 1
1293 1 84 PHE HA 1 86 ASN H . . 4.780 4.369 4.081 4.705 . 0 0 "[ . 1 . 2 . 3]" 1
1294 2 84 PHE HA 2 86 ASN H . . 4.780 4.373 4.088 4.697 . 0 0 "[ . 1 . 2 . 3]" 1
1295 1 86 ASN QB 1 87 MET H . . 3.690 2.742 2.559 2.848 . 0 0 "[ . 1 . 2 . 3]" 1
1296 2 86 ASN QB 2 87 MET H . . 3.690 2.738 2.568 2.846 . 0 0 "[ . 1 . 2 . 3]" 1
1297 1 87 MET H 1 87 MET HG2 . . 3.920 3.083 1.996 3.407 . 0 0 "[ . 1 . 2 . 3]" 1
1298 2 87 MET H 2 87 MET HG2 . . 3.920 3.062 1.984 3.402 . 0 0 "[ . 1 . 2 . 3]" 1
1299 1 87 MET H 1 87 MET HG3 . . 3.920 2.599 1.975 2.953 . 0 0 "[ . 1 . 2 . 3]" 1
1300 2 87 MET H 2 87 MET HG3 . . 3.920 2.639 2.298 3.054 . 0 0 "[ . 1 . 2 . 3]" 1
1301 1 87 MET H 1 87 MET HB2 . . 3.860 2.534 2.312 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
1302 2 87 MET H 2 87 MET HB2 . . 3.860 2.561 2.310 3.603 . 0 0 "[ . 1 . 2 . 3]" 1
1303 1 87 MET H 1 87 MET HB3 . . 3.860 3.544 2.743 3.639 . 0 0 "[ . 1 . 2 . 3]" 1
1304 2 87 MET H 2 87 MET HB3 . . 3.860 3.512 2.641 3.638 . 0 0 "[ . 1 . 2 . 3]" 1
1305 1 85 LYS HA 1 87 MET H . . 4.550 4.182 3.940 4.519 . 0 0 "[ . 1 . 2 . 3]" 1
1306 2 85 LYS HA 2 87 MET H . . 4.550 4.184 3.928 4.549 . 0 0 "[ . 1 . 2 . 3]" 1
1307 1 84 PHE HA 1 87 MET H . . 4.060 3.433 3.265 3.682 . 0 0 "[ . 1 . 2 . 3]" 1
1308 2 84 PHE HA 2 87 MET H . . 4.060 3.440 3.259 3.689 . 0 0 "[ . 1 . 2 . 3]" 1
1309 1 87 MET HB2 1 88 PHE H . . 4.160 2.866 2.738 3.763 . 0 0 "[ . 1 . 2 . 3]" 1
1310 2 87 MET HB2 2 88 PHE H . . 4.160 2.900 2.737 3.868 . 0 0 "[ . 1 . 2 . 3]" 1
1311 1 87 MET HB3 1 88 PHE H . . 4.160 3.810 3.622 4.066 . 0 0 "[ . 1 . 2 . 3]" 1
1312 2 87 MET HB3 2 88 PHE H . . 4.160 3.807 3.626 4.064 . 0 0 "[ . 1 . 2 . 3]" 1
1313 2 88 PHE H 2 89 LEU HB3 . . 5.220 5.006 4.834 5.238 0.018 28 0 "[ . 1 . 2 . 3]" 1
1314 1 88 PHE H 1 89 LEU HG . . 4.800 4.027 3.715 4.671 . 0 0 "[ . 1 . 2 . 3]" 1
1315 2 88 PHE H 2 89 LEU HG . . 4.800 4.031 3.728 4.623 . 0 0 "[ . 1 . 2 . 3]" 1
1316 1 86 ASN QB 1 88 PHE H . . 4.960 4.665 4.481 4.758 . 0 0 "[ . 1 . 2 . 3]" 1
1317 2 86 ASN QB 2 88 PHE H . . 4.960 4.663 4.473 4.732 . 0 0 "[ . 1 . 2 . 3]" 1
1318 1 87 MET HG2 1 88 PHE H . . 4.890 4.691 3.011 4.893 0.003 26 0 "[ . 1 . 2 . 3]" 1
1319 2 87 MET HG2 2 88 PHE H . . 4.890 4.629 2.852 4.892 0.002 29 0 "[ . 1 . 2 . 3]" 1
1320 1 87 MET HG3 1 88 PHE H . . 4.890 4.256 2.175 4.695 . 0 0 "[ . 1 . 2 . 3]" 1
1321 2 87 MET HG3 2 88 PHE H . . 4.890 4.206 2.179 4.702 . 0 0 "[ . 1 . 2 . 3]" 1
1322 1 88 PHE H 1 88 PHE HB2 . . 3.590 2.207 2.119 2.352 . 0 0 "[ . 1 . 2 . 3]" 1
1323 2 88 PHE H 2 88 PHE HB2 . . 3.590 2.201 2.106 2.329 . 0 0 "[ . 1 . 2 . 3]" 1
1324 1 88 PHE H 1 88 PHE HB3 . . 3.590 3.496 3.381 3.575 . 0 0 "[ . 1 . 2 . 3]" 1
1325 2 88 PHE H 2 88 PHE HB3 . . 3.590 3.491 3.381 3.569 . 0 0 "[ . 1 . 2 . 3]" 1
1326 1 84 PHE HA 1 88 PHE H . . 4.940 4.312 4.063 4.646 . 0 0 "[ . 1 . 2 . 3]" 1
1327 2 84 PHE HA 2 88 PHE H . . 4.940 4.309 4.046 4.664 . 0 0 "[ . 1 . 2 . 3]" 1
1328 1 85 LYS HA 1 88 PHE H . . 4.340 3.226 2.994 3.381 . 0 0 "[ . 1 . 2 . 3]" 1
1329 2 85 LYS HA 2 88 PHE H . . 4.340 3.221 2.991 3.363 . 0 0 "[ . 1 . 2 . 3]" 1
1330 1 86 ASN H 1 88 PHE H . . 4.660 4.071 3.904 4.170 . 0 0 "[ . 1 . 2 . 3]" 1
1331 2 86 ASN H 2 88 PHE H . . 4.660 4.069 3.894 4.165 . 0 0 "[ . 1 . 2 . 3]" 1
1332 1 89 LEU H 1 89 LEU HB2 . . 3.650 3.617 3.570 3.638 . 0 0 "[ . 1 . 2 . 3]" 1
1333 2 89 LEU H 2 89 LEU HB3 . . 3.150 2.669 2.375 2.851 . 0 0 "[ . 1 . 2 . 3]" 1
1334 1 89 LEU H 1 89 LEU HG . . 3.330 2.110 1.829 2.635 . 0 0 "[ . 1 . 2 . 3]" 1
1335 2 89 LEU H 2 89 LEU HG . . 3.330 2.113 1.837 2.600 . 0 0 "[ . 1 . 2 . 3]" 1
1336 1 89 LEU H 1 89 LEU HB3 . . 3.650 2.671 2.352 2.850 . 0 0 "[ . 1 . 2 . 3]" 1
1337 2 89 LEU H 2 89 LEU HB2 . . 3.650 3.618 3.574 3.638 . 0 0 "[ . 1 . 2 . 3]" 1
1338 1 48 MET ME 2 89 LEU H . . 5.500 5.058 4.559 5.501 0.001 8 0 "[ . 1 . 2 . 3]" 1
1339 1 89 LEU H 2 48 MET ME . . 5.500 5.080 4.616 5.493 . 0 0 "[ . 1 . 2 . 3]" 1
1340 1 88 PHE HB2 1 89 LEU H . . 4.000 2.906 2.765 3.088 . 0 0 "[ . 1 . 2 . 3]" 1
1341 2 88 PHE HB2 2 89 LEU H . . 4.000 2.914 2.785 3.092 . 0 0 "[ . 1 . 2 . 3]" 1
1342 1 88 PHE HB3 1 89 LEU H . . 4.000 3.428 3.252 3.627 . 0 0 "[ . 1 . 2 . 3]" 1
1343 2 88 PHE HB3 2 89 LEU H . . 4.000 3.418 3.212 3.611 . 0 0 "[ . 1 . 2 . 3]" 1
1344 1 86 ASN HA 1 89 LEU H . . 3.910 3.676 3.474 3.927 0.017 11 0 "[ . 1 . 2 . 3]" 1
1345 2 86 ASN HA 2 89 LEU H . . 3.910 3.682 3.481 3.934 0.024 11 0 "[ . 1 . 2 . 3]" 1
1346 1 79 MET H 1 80 LEU H . . 3.510 2.863 2.762 2.931 . 0 0 "[ . 1 . 2 . 3]" 1
1347 2 79 MET H 2 80 LEU H . . 3.510 2.865 2.747 2.943 . 0 0 "[ . 1 . 2 . 3]" 1
1348 1 77 SER H 1 79 MET H . . 4.660 4.297 4.086 4.628 . 0 0 "[ . 1 . 2 . 3]" 1
1349 2 77 SER H 2 79 MET H . . 4.660 4.289 4.087 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
1350 1 79 MET H 1 81 TYR H . . 4.970 4.107 3.936 4.252 . 0 0 "[ . 1 . 2 . 3]" 1
1351 2 79 MET H 2 81 TYR H . . 4.970 4.116 3.943 4.390 . 0 0 "[ . 1 . 2 . 3]" 1
1352 1 89 LEU H 1 89 LEU MD1 . . 4.010 3.601 3.439 3.975 . 0 0 "[ . 1 . 2 . 3]" 1
1353 2 89 LEU H 2 89 LEU MD2 . . 3.930 3.132 2.756 3.213 . 0 0 "[ . 1 . 2 . 3]" 1
1354 1 89 LEU H 1 89 LEU MD2 . . 4.010 3.130 2.745 3.213 . 0 0 "[ . 1 . 2 . 3]" 1
1355 2 89 LEU H 2 89 LEU MD1 . . 4.010 3.602 3.442 3.966 . 0 0 "[ . 1 . 2 . 3]" 1
1356 1 90 VAL H 1 90 VAL QG . . 2.880 2.630 2.199 2.719 . 0 0 "[ . 1 . 2 . 3]" 1
1357 2 90 VAL H 2 90 VAL QG . . 2.880 2.645 2.199 2.875 . 0 0 "[ . 1 . 2 . 3]" 1
1358 2 89 LEU MD1 2 90 VAL H . . 3.870 2.592 2.012 3.103 . 0 0 "[ . 1 . 2 . 3]" 1
1359 1 89 LEU HB2 1 90 VAL H . . 4.120 3.803 3.168 4.035 . 0 0 "[ . 1 . 2 . 3]" 1
1360 2 89 LEU HB3 2 90 VAL H . . 4.000 3.929 3.798 4.013 0.013 29 0 "[ . 1 . 2 . 3]" 1
1361 1 89 LEU HB3 1 90 VAL H . . 4.120 3.927 3.796 4.025 . 0 0 "[ . 1 . 2 . 3]" 1
1362 2 89 LEU HB2 2 90 VAL H . . 4.120 3.810 3.190 4.030 . 0 0 "[ . 1 . 2 . 3]" 1
1363 1 90 VAL H 1 90 VAL HB . . 3.500 3.486 2.714 3.558 0.058 28 0 "[ . 1 . 2 . 3]" 1
1364 2 90 VAL H 2 90 VAL HB . . 3.500 3.471 2.701 3.564 0.064 28 0 "[ . 1 . 2 . 3]" 1
1365 1 86 ASN HA 1 90 VAL H . . 5.170 3.838 3.300 4.806 . 0 0 "[ . 1 . 2 . 3]" 1
1366 2 86 ASN HA 2 90 VAL H . . 5.170 3.849 3.291 4.819 . 0 0 "[ . 1 . 2 . 3]" 1
1367 1 88 PHE HA 1 90 VAL H . . 5.500 4.588 4.269 5.132 . 0 0 "[ . 1 . 2 . 3]" 1
1368 2 88 PHE HA 2 90 VAL H . . 5.500 4.580 4.269 5.107 . 0 0 "[ . 1 . 2 . 3]" 1
1369 1 88 PHE H 1 90 VAL H . . 4.580 3.937 3.856 4.423 . 0 0 "[ . 1 . 2 . 3]" 1
1370 2 88 PHE H 2 90 VAL H . . 4.580 3.934 3.850 4.393 . 0 0 "[ . 1 . 2 . 3]" 1
1371 1 90 VAL HA 1 91 GLY H . . 3.180 2.328 2.196 2.931 . 0 0 "[ . 1 . 2 . 3]" 1
1372 2 90 VAL HA 2 91 GLY H . . 3.180 2.330 2.201 2.931 . 0 0 "[ . 1 . 2 . 3]" 1
1373 1 90 VAL HB 1 91 GLY H . . 4.770 4.494 4.452 4.657 . 0 0 "[ . 1 . 2 . 3]" 1
1374 2 90 VAL HB 2 91 GLY H . . 4.770 4.496 4.458 4.658 . 0 0 "[ . 1 . 2 . 3]" 1
1375 1 90 VAL QG 1 91 GLY H . . 3.740 3.277 3.069 3.447 . 0 0 "[ . 1 . 2 . 3]" 1
1376 2 90 VAL QG 2 91 GLY H . . 3.740 3.276 3.095 3.448 . 0 0 "[ . 1 . 2 . 3]" 1
1377 1 92 GLU H 1 92 GLU HG2 . . 5.500 4.202 1.958 5.114 . 0 0 "[ . 1 . 2 . 3]" 1
1378 2 92 GLU H 2 92 GLU HG2 . . 5.500 4.202 2.402 5.115 . 0 0 "[ . 1 . 2 . 3]" 1
1379 1 92 GLU H 1 92 GLU HG3 . . 5.500 3.815 1.986 5.273 . 0 0 "[ . 1 . 2 . 3]" 1
1380 2 92 GLU H 2 92 GLU HG3 . . 5.500 3.802 1.990 5.277 . 0 0 "[ . 1 . 2 . 3]" 1
1381 1 17 HIS HD2 1 20 ILE H . . 5.220 4.876 4.469 5.176 . 0 0 "[ . 1 . 2 . 3]" 1
1382 2 17 HIS HD2 2 20 ILE H . . 5.220 4.896 4.578 5.201 . 0 0 "[ . 1 . 2 . 3]" 1
1383 1 95 SER HA 1 96 VAL H . . 3.100 2.354 2.139 2.852 . 0 0 "[ . 1 . 2 . 3]" 1
1384 2 95 SER HA 2 96 VAL H . . 3.100 2.427 2.139 2.861 . 0 0 "[ . 1 . 2 . 3]" 1
1385 1 95 SER HB2 1 96 VAL H . . 5.190 3.909 1.986 4.655 . 0 0 "[ . 1 . 2 . 3]" 1
1386 2 95 SER HB2 2 96 VAL H . . 5.190 3.849 2.040 4.651 . 0 0 "[ . 1 . 2 . 3]" 1
1387 1 95 SER HB3 1 96 VAL H . . 5.190 3.794 2.325 4.660 . 0 0 "[ . 1 . 2 . 3]" 1
1388 2 95 SER HB3 2 96 VAL H . . 5.190 3.692 2.297 4.661 . 0 0 "[ . 1 . 2 . 3]" 1
1389 1 95 SER H 1 96 VAL H . . 5.030 4.078 2.486 4.627 . 0 0 "[ . 1 . 2 . 3]" 1
1390 2 95 SER H 2 96 VAL H . . 5.030 4.071 2.346 4.605 . 0 0 "[ . 1 . 2 . 3]" 1
1391 1 99 GLN H 1 100 VAL H . . 5.500 3.954 2.710 4.630 . 0 0 "[ . 1 . 2 . 3]" 1
1392 2 99 GLN H 2 100 VAL H . . 5.500 4.005 2.158 4.630 . 0 0 "[ . 1 . 2 . 3]" 1
1393 1 99 GLN HA 1 100 VAL H . . 3.100 2.351 2.139 2.852 . 0 0 "[ . 1 . 2 . 3]" 1
1394 2 99 GLN HA 2 100 VAL H . . 3.100 2.356 2.140 2.795 . 0 0 "[ . 1 . 2 . 3]" 1
1395 1 97 ILE HB 1 98 THR H . . 4.290 3.223 1.866 4.311 0.021 13 0 "[ . 1 . 2 . 3]" 1
1396 2 97 ILE HB 2 98 THR H . . 4.290 3.324 1.903 4.350 0.060 5 0 "[ . 1 . 2 . 3]" 1
1397 1 98 THR H 1 98 THR MG . . 4.790 3.451 2.149 4.051 . 0 0 "[ . 1 . 2 . 3]" 1
1398 2 98 THR H 2 98 THR MG . . 4.790 3.408 2.135 4.051 . 0 0 "[ . 1 . 2 . 3]" 1
1399 1 97 ILE MG 1 98 THR H . . 4.020 3.267 1.880 4.068 0.048 30 0 "[ . 1 . 2 . 3]" 1
1400 2 97 ILE MG 2 98 THR H . . 4.020 3.096 1.915 4.059 0.039 18 0 "[ . 1 . 2 . 3]" 1
1401 1 100 VAL H 1 101 LEU H . . 4.620 4.023 2.092 4.614 . 0 0 "[ . 1 . 2 . 3]" 1
1402 2 100 VAL H 2 101 LEU H . . 4.620 3.993 2.834 4.619 . 0 0 "[ . 1 . 2 . 3]" 1
1403 1 101 LEU H 1 102 ASN H . . 4.480 3.063 1.935 4.489 0.009 30 0 "[ . 1 . 2 . 3]" 1
1404 2 101 LEU H 2 102 ASN H . . 4.480 3.124 1.899 4.611 0.131 27 0 "[ . 1 . 2 . 3]" 1
1405 1 100 VAL HA 1 101 LEU H . . 3.050 2.353 2.141 2.836 . 0 0 "[ . 1 . 2 . 3]" 1
1406 2 100 VAL HA 2 101 LEU H . . 3.050 2.347 2.140 2.678 . 0 0 "[ . 1 . 2 . 3]" 1
1407 1 100 VAL HB 1 101 LEU H . . 4.270 3.535 1.948 4.597 0.327 22 0 "[ . 1 . 2 . 3]" 1
1408 2 100 VAL HB 2 101 LEU H . . 4.270 3.631 1.945 4.351 0.081 22 0 "[ . 1 . 2 . 3]" 1
1409 1 101 LEU H 1 101 LEU HB2 . . 3.970 2.601 2.064 3.125 . 0 0 "[ . 1 . 2 . 3]" 1
1410 2 101 LEU H 2 101 LEU HB2 . . 3.970 2.666 2.064 3.111 . 0 0 "[ . 1 . 2 . 3]" 1
1411 1 101 LEU H 1 101 LEU HB3 . . 3.970 3.654 3.357 3.989 0.019 26 0 "[ . 1 . 2 . 3]" 1
1412 2 101 LEU H 2 101 LEU HB3 . . 3.970 3.684 3.356 3.992 0.022 27 0 "[ . 1 . 2 . 3]" 1
1413 1 101 LEU H 1 101 LEU HG . . 4.370 3.941 2.436 4.373 0.003 4 0 "[ . 1 . 2 . 3]" 1
1414 2 101 LEU H 2 101 LEU HG . . 4.370 3.982 2.483 4.402 0.032 27 0 "[ . 1 . 2 . 3]" 1
1415 1 100 VAL MG1 1 101 LEU H . . 4.870 3.436 1.932 4.269 . 0 0 "[ . 1 . 2 . 3]" 1
1416 2 100 VAL MG1 2 101 LEU H . . 4.870 3.454 1.913 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
1417 1 100 VAL MG2 1 101 LEU H . . 4.870 3.842 2.531 4.326 . 0 0 "[ . 1 . 2 . 3]" 1
1418 2 100 VAL MG2 2 101 LEU H . . 4.870 3.801 2.350 4.358 . 0 0 "[ . 1 . 2 . 3]" 1
1419 1 105 LEU H 1 106 ALA H . . 3.900 2.583 2.484 2.727 . 0 0 "[ . 1 . 2 . 3]" 1
1420 2 105 LEU H 2 106 ALA H . . 3.900 2.580 2.485 2.720 . 0 0 "[ . 1 . 2 . 3]" 1
1421 1 112 GLU H 1 112 GLU QG . . 4.950 3.015 1.959 4.038 . 0 0 "[ . 1 . 2 . 3]" 1
1422 2 112 GLU H 2 112 GLU QG . . 4.950 3.006 1.955 4.041 . 0 0 "[ . 1 . 2 . 3]" 1
1423 1 44 LEU H 1 44 LEU MD2 . . 4.490 3.440 3.249 3.673 . 0 0 "[ . 1 . 2 . 3]" 1
1424 2 44 LEU H 2 44 LEU MD2 . . 4.490 3.466 3.246 3.784 . 0 0 "[ . 1 . 2 . 3]" 1
1425 1 44 LEU H 1 44 LEU HB3 . . 3.720 3.594 3.544 3.780 0.060 20 0 "[ . 1 . 2 . 3]" 1
1426 2 44 LEU H 2 44 LEU HB3 . . 3.720 3.586 3.548 3.755 0.035 20 0 "[ . 1 . 2 . 3]" 1
1427 1 42 ALA MB 1 44 LEU H . . 4.570 4.511 4.277 4.602 0.032 21 0 "[ . 1 . 2 . 3]" 1
1428 2 42 ALA MB 2 44 LEU H . . 4.570 4.532 4.280 4.599 0.029 21 0 "[ . 1 . 2 . 3]" 1
1429 1 44 LEU H 1 44 LEU HB2 . . 3.720 2.408 2.286 2.686 . 0 0 "[ . 1 . 2 . 3]" 1
1430 2 44 LEU H 2 44 LEU HB2 . . 3.720 2.401 2.295 2.611 . 0 0 "[ . 1 . 2 . 3]" 1
1431 1 44 LEU H 1 44 LEU HG . . 3.340 2.530 2.361 2.955 . 0 0 "[ . 1 . 2 . 3]" 1
1432 2 44 LEU H 2 44 LEU HG . . 3.340 2.489 2.336 3.001 . 0 0 "[ . 1 . 2 . 3]" 1
1433 1 42 ALA HA 1 44 LEU H . . 4.400 4.252 3.520 4.408 0.008 14 0 "[ . 1 . 2 . 3]" 1
1434 2 42 ALA HA 2 44 LEU H . . 4.400 4.323 3.554 4.425 0.025 9 0 "[ . 1 . 2 . 3]" 1
1435 1 41 LEU HA 1 44 LEU H . . 4.420 3.515 3.187 4.109 . 0 0 "[ . 1 . 2 . 3]" 1
1436 2 41 LEU HA 2 44 LEU H . . 4.420 3.414 3.200 4.000 . 0 0 "[ . 1 . 2 . 3]" 1
1437 1 43 SER H 1 44 LEU H . . 3.140 2.542 2.390 2.808 . 0 0 "[ . 1 . 2 . 3]" 1
1438 2 43 SER H 2 44 LEU H . . 3.140 2.503 2.396 2.796 . 0 0 "[ . 1 . 2 . 3]" 1
1439 1 44 LEU H 1 45 GLN H . . 5.020 4.167 1.950 4.631 . 0 0 "[ . 1 . 2 . 3]" 1
1440 2 44 LEU H 2 45 GLN H . . 5.020 4.387 2.736 4.628 . 0 0 "[ . 1 . 2 . 3]" 1
1441 1 42 ALA H 1 44 LEU H . . 4.580 4.144 3.937 4.447 . 0 0 "[ . 1 . 2 . 3]" 1
1442 2 42 ALA H 2 44 LEU H . . 4.580 4.129 3.947 4.332 . 0 0 "[ . 1 . 2 . 3]" 1
1443 1 48 MET ME 1 52 GLN HE22 . . 4.480 3.675 2.741 4.405 . 0 0 "[ . 1 . 2 . 3]" 1
1444 2 48 MET ME 2 52 GLN HE22 . . 4.480 3.660 2.729 4.481 0.001 10 0 "[ . 1 . 2 . 3]" 1
1445 1 17 HIS H 1 17 HIS HD2 . . 5.060 4.990 4.944 5.038 . 0 0 "[ . 1 . 2 . 3]" 1
1446 2 17 HIS H 2 17 HIS HD2 . . 5.060 4.987 4.940 5.038 . 0 0 "[ . 1 . 2 . 3]" 1
1447 1 57 MET H 1 57 MET ME . . 4.340 4.072 3.958 4.328 . 0 0 "[ . 1 . 2 . 3]" 1
1448 2 57 MET H 2 57 MET ME . . 4.340 4.081 3.944 4.348 0.008 26 0 "[ . 1 . 2 . 3]" 1
1449 1 55 THR H 1 56 GLU H . . 4.320 2.720 2.634 2.821 . 0 0 "[ . 1 . 2 . 3]" 1
1450 2 55 THR H 2 56 GLU H . . 4.320 2.726 2.642 2.821 . 0 0 "[ . 1 . 2 . 3]" 1
1451 2 88 PHE H 2 89 LEU MD2 . . 4.940 4.511 4.058 4.706 . 0 0 "[ . 1 . 2 . 3]" 1
1452 1 85 LYS HA 1 89 LEU H . . 4.390 3.950 3.696 4.204 . 0 0 "[ . 1 . 2 . 3]" 1
1453 2 85 LYS HA 2 89 LEU H . . 4.390 3.940 3.698 4.204 . 0 0 "[ . 1 . 2 . 3]" 1
1454 1 87 MET H 1 89 LEU H . . 4.090 3.999 3.917 4.091 0.001 28 0 "[ . 1 . 2 . 3]" 1
1455 2 87 MET H 2 89 LEU H . . 4.090 3.998 3.918 4.091 0.001 28 0 "[ . 1 . 2 . 3]" 1
1456 1 81 TYR QD 2 61 LEU H . . 5.400 5.292 4.971 5.406 0.006 3 0 "[ . 1 . 2 . 3]" 1
1457 1 61 LEU H 2 81 TYR QD . . 5.400 5.298 4.767 5.420 0.020 19 0 "[ . 1 . 2 . 3]" 1
1458 1 37 ALA H 1 40 GLU H . . 5.190 4.860 4.657 5.051 . 0 0 "[ . 1 . 2 . 3]" 1
1459 2 37 ALA H 2 40 GLU H . . 5.190 4.855 4.692 5.024 . 0 0 "[ . 1 . 2 . 3]" 1
1460 1 40 GLU H 1 43 SER H . . 5.500 4.830 4.674 5.004 . 0 0 "[ . 1 . 2 . 3]" 1
1461 2 40 GLU H 2 43 SER H . . 5.500 4.825 4.683 4.999 . 0 0 "[ . 1 . 2 . 3]" 1
1462 1 9 MET ME 1 9 MET HG2 . . 3.490 2.813 2.400 3.221 . 0 0 "[ . 1 . 2 . 3]" 1
1463 2 9 MET ME 2 9 MET HG2 . . 3.490 2.811 2.402 3.220 . 0 0 "[ . 1 . 2 . 3]" 1
1464 1 9 MET ME 1 9 MET HG3 . . 3.490 2.265 2.034 2.644 . 0 0 "[ . 1 . 2 . 3]" 1
1465 2 9 MET ME 2 9 MET HG3 . . 3.490 2.265 2.035 2.641 . 0 0 "[ . 1 . 2 . 3]" 1
1466 1 9 MET ME 1 46 VAL MG1 . . 4.160 3.597 3.164 4.032 . 0 0 "[ . 1 . 2 . 3]" 1
1467 2 9 MET ME 2 46 VAL MG1 . . 4.160 3.605 3.091 4.078 . 0 0 "[ . 1 . 2 . 3]" 1
1468 1 9 MET ME 1 46 VAL MG2 . . 4.160 3.069 1.863 3.648 . 0 0 "[ . 1 . 2 . 3]" 1
1469 2 9 MET ME 2 46 VAL MG2 . . 4.160 3.139 1.935 3.686 . 0 0 "[ . 1 . 2 . 3]" 1
1470 1 9 MET ME 1 44 LEU MD1 . . 3.710 2.844 2.514 3.416 . 0 0 "[ . 1 . 2 . 3]" 1
1471 2 9 MET ME 2 44 LEU MD1 . . 3.710 2.831 2.432 3.364 . 0 0 "[ . 1 . 2 . 3]" 1
1472 1 9 MET ME 1 44 LEU MD2 . . 3.710 2.591 1.947 3.731 0.021 20 0 "[ . 1 . 2 . 3]" 1
1473 2 9 MET ME 2 44 LEU MD2 . . 3.710 2.459 1.947 3.129 . 0 0 "[ . 1 . 2 . 3]" 1
1474 1 9 MET ME 1 13 LEU MD1 . . 4.030 3.041 2.218 3.725 . 0 0 "[ . 1 . 2 . 3]" 1
1475 2 9 MET ME 2 13 LEU MD1 . . 4.030 3.011 2.072 3.679 . 0 0 "[ . 1 . 2 . 3]" 1
1476 1 9 MET ME 1 13 LEU MD2 . . 4.030 3.593 2.779 4.030 0.000 3 0 "[ . 1 . 2 . 3]" 1
1477 2 9 MET ME 2 13 LEU MD2 . . 4.030 3.581 2.601 4.026 . 0 0 "[ . 1 . 2 . 3]" 1
1478 1 9 MET ME 1 46 VAL HA . . 3.230 2.296 1.914 2.659 . 0 0 "[ . 1 . 2 . 3]" 1
1479 2 9 MET ME 2 46 VAL HA . . 3.230 2.374 1.981 2.808 . 0 0 "[ . 1 . 2 . 3]" 1
1480 1 9 MET HA 1 12 ARG QB . . 4.150 3.872 3.773 4.054 . 0 0 "[ . 1 . 2 . 3]" 1
1481 2 9 MET HA 2 12 ARG QB . . 4.150 3.886 3.791 4.126 . 0 0 "[ . 1 . 2 . 3]" 1
1482 1 11 SER QB 1 12 ARG QB . . 4.910 3.985 3.832 4.256 . 0 0 "[ . 1 . 2 . 3]" 1
1483 2 11 SER QB 2 12 ARG QB . . 4.910 3.999 3.828 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
1484 1 12 ARG HA 1 12 ARG HG2 . . 4.070 3.790 3.725 3.821 . 0 0 "[ . 1 . 2 . 3]" 1
1485 2 12 ARG HA 2 12 ARG HG2 . . 4.210 3.776 3.716 3.807 . 0 0 "[ . 1 . 2 . 3]" 1
1486 1 12 ARG HG3 1 44 LEU MD2 . . 4.770 3.839 3.352 4.568 . 0 0 "[ . 1 . 2 . 3]" 1
1487 1 12 ARG HA 1 12 ARG HG3 . . 4.210 3.717 3.682 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
1488 2 12 ARG HA 2 12 ARG HG3 . . 4.210 3.730 3.690 3.791 . 0 0 "[ . 1 . 2 . 3]" 1
1489 1 10 ASP HA 1 13 LEU HB2 . . 4.890 2.491 2.257 2.627 . 0 0 "[ . 1 . 2 . 3]" 1
1490 2 10 ASP HA 2 13 LEU HB2 . . 4.890 2.491 2.282 2.640 . 0 0 "[ . 1 . 2 . 3]" 1
1491 1 13 LEU MD2 1 46 VAL MG2 . . 4.410 2.863 1.952 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
1492 2 13 LEU MD2 2 46 VAL MG2 . . 4.410 2.909 1.887 4.063 . 0 0 "[ . 1 . 2 . 3]" 1
1493 1 13 LEU HA 1 13 LEU MD2 . . 4.220 2.875 1.971 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
1494 2 13 LEU HA 2 13 LEU MD2 . . 4.220 2.704 2.006 3.783 . 0 0 "[ . 1 . 2 . 3]" 1
1495 1 13 LEU MD2 1 41 LEU HA . . 5.500 4.394 3.337 5.626 0.126 30 0 "[ . 1 . 2 . 3]" 1
1496 2 13 LEU MD2 2 41 LEU HA . . 5.500 4.038 3.231 5.517 0.017 11 0 "[ . 1 . 2 . 3]" 1
1497 1 10 ASP HA 1 13 LEU MD2 . . 5.500 4.173 2.647 5.147 . 0 0 "[ . 1 . 2 . 3]" 1
1498 2 10 ASP HA 2 13 LEU MD2 . . 5.500 4.383 2.668 5.169 . 0 0 "[ . 1 . 2 . 3]" 1
1499 1 13 LEU H 1 13 LEU MD2 . . 4.030 3.898 3.660 4.077 0.047 1 0 "[ . 1 . 2 . 3]" 1
1500 2 13 LEU H 2 13 LEU MD2 . . 4.030 3.894 3.635 4.101 0.071 26 0 "[ . 1 . 2 . 3]" 1
1501 1 13 LEU HA 1 13 LEU HG . . 4.230 2.744 2.483 3.000 . 0 0 "[ . 1 . 2 . 3]" 1
1502 2 13 LEU HA 2 13 LEU HG . . 4.230 2.752 2.529 2.996 . 0 0 "[ . 1 . 2 . 3]" 1
1503 1 13 LEU H 1 13 LEU HG . . 4.630 3.645 2.804 4.467 . 0 0 "[ . 1 . 2 . 3]" 1
1504 2 13 LEU H 2 13 LEU HG . . 4.630 3.415 2.710 4.462 . 0 0 "[ . 1 . 2 . 3]" 1
1505 1 13 LEU HG 1 14 GLN H . . 5.140 4.828 4.639 5.107 . 0 0 "[ . 1 . 2 . 3]" 1
1506 2 13 LEU HG 2 14 GLN H . . 5.140 4.760 4.552 5.108 . 0 0 "[ . 1 . 2 . 3]" 1
1507 1 13 LEU HA 1 13 LEU MD1 . . 4.220 3.038 1.973 3.810 . 0 0 "[ . 1 . 2 . 3]" 1
1508 2 13 LEU HA 2 13 LEU MD1 . . 4.220 3.257 1.990 3.839 . 0 0 "[ . 1 . 2 . 3]" 1
1509 1 13 LEU MD1 1 41 LEU HA . . 5.500 4.674 3.443 5.607 0.107 10 0 "[ . 1 . 2 . 3]" 1
1510 2 13 LEU MD1 2 41 LEU HA . . 5.500 4.877 3.411 5.590 0.090 8 0 "[ . 1 . 2 . 3]" 1
1511 1 10 ASP HA 1 13 LEU MD1 . . 5.500 3.630 2.976 4.416 . 0 0 "[ . 1 . 2 . 3]" 1
1512 2 10 ASP HA 2 13 LEU MD1 . . 5.500 3.432 2.511 4.378 . 0 0 "[ . 1 . 2 . 3]" 1
1513 1 14 GLN HB2 1 15 ARG H . . 4.270 4.017 3.854 4.162 . 0 0 "[ . 1 . 2 . 3]" 1
1514 2 14 GLN HB2 2 15 ARG H . . 4.270 4.001 3.707 4.160 . 0 0 "[ . 1 . 2 . 3]" 1
1515 1 14 GLN HG3 1 15 ARG H . . 4.880 2.448 2.038 3.337 . 0 0 "[ . 1 . 2 . 3]" 1
1516 2 14 GLN HG3 2 15 ARG H . . 4.880 2.411 1.963 3.283 . 0 0 "[ . 1 . 2 . 3]" 1
1517 1 14 GLN HA 1 14 GLN HG2 . . 4.120 3.906 3.655 4.237 0.117 20 0 "[ . 1 . 2 . 3]" 1
1518 2 14 GLN HA 2 14 GLN HG2 . . 4.120 3.909 3.665 4.239 0.119 20 0 "[ . 1 . 2 . 3]" 1
1519 1 14 GLN HA 1 14 GLN HG3 . . 4.120 3.655 3.522 3.739 . 0 0 "[ . 1 . 2 . 3]" 1
1520 2 14 GLN HA 2 14 GLN HG3 . . 4.120 3.663 3.546 3.757 . 0 0 "[ . 1 . 2 . 3]" 1
1521 1 15 ARG HA 1 15 ARG HG2 . . 4.040 3.007 2.247 3.774 . 0 0 "[ . 1 . 2 . 3]" 1
1522 2 15 ARG HA 2 15 ARG HG2 . . 4.040 2.859 2.247 3.778 . 0 0 "[ . 1 . 2 . 3]" 1
1523 1 15 ARG HA 1 15 ARG HG3 . . 4.040 2.837 2.175 3.762 . 0 0 "[ . 1 . 2 . 3]" 1
1524 2 15 ARG HA 2 15 ARG HG3 . . 4.040 2.703 2.174 3.765 . 0 0 "[ . 1 . 2 . 3]" 1
1525 1 16 ILE HA 1 19 GLU QG . . 4.050 3.256 3.043 3.479 . 0 0 "[ . 1 . 2 . 3]" 1
1526 2 16 ILE HA 2 19 GLU QG . . 4.050 3.202 2.992 3.455 . 0 0 "[ . 1 . 2 . 3]" 1
1527 1 16 ILE HA 1 20 ILE MD . . 5.000 4.052 3.774 4.500 . 0 0 "[ . 1 . 2 . 3]" 1
1528 2 16 ILE HA 2 20 ILE MD . . 5.000 4.058 3.741 4.534 . 0 0 "[ . 1 . 2 . 3]" 1
1529 1 13 LEU HA 1 16 ILE HB . . 3.930 2.826 2.495 3.140 . 0 0 "[ . 1 . 2 . 3]" 1
1530 2 13 LEU HA 2 16 ILE HB . . 3.930 2.882 2.429 3.168 . 0 0 "[ . 1 . 2 . 3]" 1
1531 1 16 ILE HG13 1 16 ILE MG . . 3.740 3.161 3.137 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
1532 2 16 ILE HG13 2 16 ILE MG . . 3.740 3.152 3.128 3.198 . 0 0 "[ . 1 . 2 . 3]" 1
1533 1 16 ILE MD 1 16 ILE MG . . 3.010 2.353 1.910 2.461 . 0 0 "[ . 1 . 2 . 3]" 1
1534 2 16 ILE MD 2 16 ILE MG . . 3.010 2.388 2.057 2.494 . 0 0 "[ . 1 . 2 . 3]" 1
1535 1 16 ILE HG12 1 16 ILE MG . . 3.740 2.243 2.108 2.418 . 0 0 "[ . 1 . 2 . 3]" 1
1536 2 16 ILE HG12 2 16 ILE MG . . 3.740 2.227 2.086 2.360 . 0 0 "[ . 1 . 2 . 3]" 1
1537 1 16 ILE MG 1 37 ALA MB . . 3.120 2.048 1.908 2.238 . 0 0 "[ . 1 . 2 . 3]" 1
1538 2 16 ILE MG 2 37 ALA MB . . 3.120 1.947 1.865 2.100 . 0 0 "[ . 1 . 2 . 3]" 1
1539 1 16 ILE MG 1 41 LEU HB3 . . 4.020 3.847 3.434 4.036 0.016 10 0 "[ . 1 . 2 . 3]" 1
1540 2 16 ILE MG 2 41 LEU HB3 . . 4.020 3.906 3.318 4.054 0.034 23 0 "[ . 1 . 2 . 3]" 1
1541 1 16 ILE MG 1 41 LEU HG . . 4.570 3.647 2.874 4.615 0.045 21 0 "[ . 1 . 2 . 3]" 1
1542 2 16 ILE MG 2 41 LEU HG . . 4.570 3.863 3.652 4.657 0.087 18 0 "[ . 1 . 2 . 3]" 1
1543 1 16 ILE MG 1 19 GLU QG . . 4.970 4.784 4.645 4.932 . 0 0 "[ . 1 . 2 . 3]" 1
1544 2 16 ILE MG 2 19 GLU QG . . 4.970 4.712 4.546 4.863 . 0 0 "[ . 1 . 2 . 3]" 1
1545 1 16 ILE MG 1 41 LEU HB2 . . 4.020 2.348 2.043 2.543 . 0 0 "[ . 1 . 2 . 3]" 1
1546 2 16 ILE MG 2 41 LEU HB2 . . 4.020 2.443 2.005 2.606 . 0 0 "[ . 1 . 2 . 3]" 1
1547 1 16 ILE MG 1 40 GLU QB . . 4.370 3.096 2.755 3.324 . 0 0 "[ . 1 . 2 . 3]" 1
1548 2 16 ILE MG 2 40 GLU QB . . 4.370 2.975 2.677 3.235 . 0 0 "[ . 1 . 2 . 3]" 1
1549 1 16 ILE MG 1 41 LEU HA . . 4.180 3.633 3.476 3.892 . 0 0 "[ . 1 . 2 . 3]" 1
1550 2 16 ILE MG 2 41 LEU HA . . 4.180 3.745 3.588 4.043 . 0 0 "[ . 1 . 2 . 3]" 1
1551 1 16 ILE MG 1 38 LEU HA . . 4.430 3.703 3.550 3.814 . 0 0 "[ . 1 . 2 . 3]" 1
1552 2 16 ILE MG 2 38 LEU HA . . 4.430 3.716 3.540 3.954 . 0 0 "[ . 1 . 2 . 3]" 1
1553 1 13 LEU HA 1 16 ILE MG . . 4.680 4.150 3.847 4.379 . 0 0 "[ . 1 . 2 . 3]" 1
1554 2 13 LEU HA 2 16 ILE MG . . 4.680 4.200 3.778 4.462 . 0 0 "[ . 1 . 2 . 3]" 1
1555 1 16 ILE HA 1 16 ILE MG . . 3.480 2.414 2.318 2.508 . 0 0 "[ . 1 . 2 . 3]" 1
1556 2 16 ILE HA 2 16 ILE MG . . 3.480 2.397 2.315 2.507 . 0 0 "[ . 1 . 2 . 3]" 1
1557 1 16 ILE MG 1 37 ALA HA . . 4.180 2.992 2.752 3.269 . 0 0 "[ . 1 . 2 . 3]" 1
1558 2 16 ILE MG 2 37 ALA HA . . 4.180 2.834 2.506 3.196 . 0 0 "[ . 1 . 2 . 3]" 1
1559 1 16 ILE MG 1 17 HIS HA . . 4.360 3.362 3.162 3.589 . 0 0 "[ . 1 . 2 . 3]" 1
1560 2 16 ILE MG 2 17 HIS HA . . 4.360 3.399 3.134 3.596 . 0 0 "[ . 1 . 2 . 3]" 1
1561 1 16 ILE H 1 16 ILE MG . . 3.830 3.751 3.716 3.765 . 0 0 "[ . 1 . 2 . 3]" 1
1562 2 16 ILE H 2 16 ILE MG . . 3.830 3.755 3.707 3.766 . 0 0 "[ . 1 . 2 . 3]" 1
1563 1 16 ILE MG 1 41 LEU H . . 4.160 3.054 2.902 3.220 . 0 0 "[ . 1 . 2 . 3]" 1
1564 2 16 ILE MG 2 41 LEU H . . 4.160 3.019 2.830 3.172 . 0 0 "[ . 1 . 2 . 3]" 1
1565 1 16 ILE MG 1 17 HIS H . . 3.840 3.352 3.098 3.474 . 0 0 "[ . 1 . 2 . 3]" 1
1566 2 16 ILE MG 2 17 HIS H . . 3.840 3.399 3.094 3.557 . 0 0 "[ . 1 . 2 . 3]" 1
1567 1 16 ILE MG 1 20 ILE H . . 4.490 4.400 4.159 4.524 0.034 6 0 "[ . 1 . 2 . 3]" 1
1568 2 16 ILE MG 2 20 ILE H . . 4.490 4.354 4.054 4.519 0.029 18 0 "[ . 1 . 2 . 3]" 1
1569 1 12 ARG HG3 1 16 ILE MD . . 4.070 3.145 2.923 3.768 . 0 0 "[ . 1 . 2 . 3]" 1
1570 1 13 LEU HG 1 16 ILE MD . . 4.520 3.532 2.841 4.387 . 0 0 "[ . 1 . 2 . 3]" 1
1571 2 13 LEU HG 2 16 ILE MD . . 4.520 3.531 2.815 4.081 . 0 0 "[ . 1 . 2 . 3]" 1
1572 1 16 ILE HB 1 16 ILE MD . . 3.300 2.148 2.092 2.399 . 0 0 "[ . 1 . 2 . 3]" 1
1573 2 16 ILE HB 2 16 ILE MD . . 3.300 2.133 2.080 2.359 . 0 0 "[ . 1 . 2 . 3]" 1
1574 1 16 ILE MD 1 40 GLU QB . . 3.750 2.667 1.819 3.091 . 0 0 "[ . 1 . 2 . 3]" 1
1575 2 16 ILE MD 2 40 GLU QB . . 3.750 2.588 1.893 3.060 . 0 0 "[ . 1 . 2 . 3]" 1
1576 1 16 ILE MD 1 40 GLU HG3 . . 4.050 3.407 2.478 4.041 . 0 0 "[ . 1 . 2 . 3]" 1
1577 2 16 ILE MD 2 40 GLU HG3 . . 4.050 3.348 2.290 4.050 0.000 5 0 "[ . 1 . 2 . 3]" 1
1578 1 12 ARG QB 1 16 ILE MD . . 4.000 3.100 2.538 3.879 . 0 0 "[ . 1 . 2 . 3]" 1
1579 2 12 ARG QB 2 16 ILE MD . . 4.000 3.071 2.513 3.974 . 0 0 "[ . 1 . 2 . 3]" 1
1580 1 16 ILE MD 1 40 GLU HG2 . . 4.050 2.868 2.124 4.068 0.018 14 0 "[ . 1 . 2 . 3]" 1
1581 2 16 ILE MD 2 40 GLU HG2 . . 4.050 2.713 1.984 4.073 0.023 9 0 "[ . 1 . 2 . 3]" 1
1582 1 16 ILE MD 1 41 LEU HA . . 3.570 2.914 2.438 3.249 . 0 0 "[ . 1 . 2 . 3]" 1
1583 2 16 ILE MD 2 41 LEU HA . . 3.570 2.986 2.416 3.337 . 0 0 "[ . 1 . 2 . 3]" 1
1584 1 13 LEU HA 1 16 ILE MD . . 3.760 2.111 1.958 2.912 . 0 0 "[ . 1 . 2 . 3]" 1
1585 2 13 LEU HA 2 16 ILE MD . . 3.760 2.053 1.903 2.653 . 0 0 "[ . 1 . 2 . 3]" 1
1586 1 16 ILE HA 1 16 ILE MD . . 4.250 3.848 3.772 3.879 . 0 0 "[ . 1 . 2 . 3]" 1
1587 2 16 ILE HA 2 16 ILE MD . . 4.250 3.855 3.796 3.881 . 0 0 "[ . 1 . 2 . 3]" 1
1588 1 16 ILE MD 1 37 ALA HA . . 4.860 4.792 4.027 4.886 0.026 26 0 "[ . 1 . 2 . 3]" 1
1589 2 16 ILE MD 2 37 ALA HA . . 4.860 4.724 4.236 4.872 0.012 18 0 "[ . 1 . 2 . 3]" 1
1590 1 18 ALA MB 1 19 GLU H . . 3.330 2.602 2.406 2.734 . 0 0 "[ . 1 . 2 . 3]" 1
1591 2 18 ALA MB 2 19 GLU H . . 3.330 2.610 2.439 2.738 . 0 0 "[ . 1 . 2 . 3]" 1
1592 1 18 ALA MB 1 20 ILE H . . 4.770 4.604 4.414 4.771 0.001 21 0 "[ . 1 . 2 . 3]" 1
1593 2 18 ALA MB 2 20 ILE H . . 4.770 4.605 4.434 4.769 . 0 0 "[ . 1 . 2 . 3]" 1
1594 1 18 ALA MB 1 21 LYS H . . 4.820 4.439 4.311 4.537 . 0 0 "[ . 1 . 2 . 3]" 1
1595 2 18 ALA MB 2 21 LYS H . . 4.820 4.448 4.338 4.542 . 0 0 "[ . 1 . 2 . 3]" 1
1596 1 18 ALA MB 1 22 ASN HD21 . . 4.450 3.784 3.287 4.476 0.026 30 0 "[ . 1 . 2 . 3]" 1
1597 2 18 ALA MB 2 22 ASN HD21 . . 4.450 3.855 3.303 4.492 0.042 25 0 "[ . 1 . 2 . 3]" 1
1598 1 15 ARG HA 1 18 ALA MB . . 3.400 2.523 2.313 2.757 . 0 0 "[ . 1 . 2 . 3]" 1
1599 2 15 ARG HA 2 18 ALA MB . . 3.400 2.573 2.362 2.801 . 0 0 "[ . 1 . 2 . 3]" 1
1600 1 18 ALA MB 1 19 GLU QG . . 4.170 3.554 3.113 3.766 . 0 0 "[ . 1 . 2 . 3]" 1
1601 2 18 ALA MB 2 19 GLU QG . . 4.170 3.546 3.162 3.732 . 0 0 "[ . 1 . 2 . 3]" 1
1602 1 19 GLU QG 1 37 ALA MB . . 4.020 3.996 3.700 4.050 0.030 9 0 "[ . 1 . 2 . 3]" 1
1603 2 19 GLU QG 2 37 ALA MB . . 4.020 4.004 3.654 4.042 0.022 10 0 "[ . 1 . 2 . 3]" 1
1604 1 20 ILE HA 1 34 CYS HA . . 4.470 2.972 2.819 3.297 . 0 0 "[ . 1 . 2 . 3]" 1
1605 2 20 ILE HA 2 34 CYS HA . . 4.470 2.964 2.815 3.174 . 0 0 "[ . 1 . 2 . 3]" 1
1606 1 17 HIS HD2 1 20 ILE HB . . 4.570 3.432 3.024 3.725 . 0 0 "[ . 1 . 2 . 3]" 1
1607 2 17 HIS HD2 2 20 ILE HB . . 4.570 3.464 3.154 3.688 . 0 0 "[ . 1 . 2 . 3]" 1
1608 1 17 HIS HA 1 20 ILE HB . . 4.520 3.332 3.007 3.528 . 0 0 "[ . 1 . 2 . 3]" 1
1609 2 17 HIS HA 2 20 ILE HB . . 4.520 3.346 3.129 3.510 . 0 0 "[ . 1 . 2 . 3]" 1
1610 1 20 ILE H 1 20 ILE HG12 . . 4.170 3.582 3.407 3.731 . 0 0 "[ . 1 . 2 . 3]" 1
1611 2 20 ILE H 2 20 ILE HG12 . . 4.170 3.582 3.418 3.726 . 0 0 "[ . 1 . 2 . 3]" 1
1612 1 20 ILE HA 1 20 ILE MG . . 3.390 2.310 2.286 2.354 . 0 0 "[ . 1 . 2 . 3]" 1
1613 2 20 ILE HA 2 20 ILE MG . . 3.390 2.310 2.291 2.325 . 0 0 "[ . 1 . 2 . 3]" 1
1614 1 20 ILE MG 1 21 LYS HA . . 4.060 3.624 3.495 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
1615 2 20 ILE MG 2 21 LYS HA . . 4.060 3.615 3.560 3.670 . 0 0 "[ . 1 . 2 . 3]" 1
1616 1 17 HIS HA 1 20 ILE MG . . 4.750 4.614 4.266 4.787 0.037 14 0 "[ . 1 . 2 . 3]" 1
1617 2 17 HIS HA 2 20 ILE MG . . 4.750 4.623 4.378 4.771 0.021 28 0 "[ . 1 . 2 . 3]" 1
1618 1 20 ILE HB 1 20 ILE MD . . 3.250 2.171 2.128 2.314 . 0 0 "[ . 1 . 2 . 3]" 1
1619 2 20 ILE HB 2 20 ILE MD . . 3.250 2.171 2.124 2.327 . 0 0 "[ . 1 . 2 . 3]" 1
1620 1 20 ILE MD 1 60 THR MG . . 4.310 4.196 3.953 4.316 0.006 8 0 "[ . 1 . 2 . 3]" 1
1621 2 20 ILE MD 2 60 THR MG . . 4.310 4.194 4.009 4.315 0.005 27 0 "[ . 1 . 2 . 3]" 1
1622 1 16 ILE MG 1 20 ILE MD . . 3.170 2.196 1.921 2.585 . 0 0 "[ . 1 . 2 . 3]" 1
1623 2 16 ILE MG 2 20 ILE MD . . 3.170 2.165 1.924 2.587 . 0 0 "[ . 1 . 2 . 3]" 1
1624 1 20 ILE HA 1 20 ILE MD . . 4.100 3.882 3.860 3.886 . 0 0 "[ . 1 . 2 . 3]" 1
1625 2 20 ILE HA 2 20 ILE MD . . 4.100 3.882 3.876 3.885 . 0 0 "[ . 1 . 2 . 3]" 1
1626 1 20 ILE MD 1 38 LEU HA . . 4.170 3.399 3.177 3.623 . 0 0 "[ . 1 . 2 . 3]" 1
1627 2 20 ILE MD 2 38 LEU HA . . 4.170 3.428 3.133 3.663 . 0 0 "[ . 1 . 2 . 3]" 1
1628 1 17 HIS HA 1 20 ILE MD . . 3.750 2.654 2.114 3.081 . 0 0 "[ . 1 . 2 . 3]" 1
1629 2 17 HIS HA 2 20 ILE MD . . 3.750 2.650 2.121 3.083 . 0 0 "[ . 1 . 2 . 3]" 1
1630 1 17 HIS HD2 1 20 ILE MD . . 4.280 3.564 2.873 4.183 . 0 0 "[ . 1 . 2 . 3]" 1
1631 2 17 HIS HD2 2 20 ILE MD . . 4.280 3.573 2.897 4.175 . 0 0 "[ . 1 . 2 . 3]" 1
1632 1 20 ILE MD 1 21 LYS H . . 4.490 4.481 4.433 4.514 0.024 22 0 "[ . 1 . 2 . 3]" 1
1633 2 20 ILE MD 2 21 LYS H . . 4.490 4.468 4.367 4.497 0.007 11 0 "[ . 1 . 2 . 3]" 1
1634 1 21 LYS HA 1 21 LYS HG2 . . 3.940 2.808 2.313 3.372 . 0 0 "[ . 1 . 2 . 3]" 1
1635 2 21 LYS HA 2 21 LYS HG2 . . 3.940 2.833 2.307 3.369 . 0 0 "[ . 1 . 2 . 3]" 1
1636 1 21 LYS HA 1 21 LYS HG3 . . 3.940 2.581 2.352 3.429 . 0 0 "[ . 1 . 2 . 3]" 1
1637 2 21 LYS HA 2 21 LYS HG3 . . 3.940 2.563 2.073 3.430 . 0 0 "[ . 1 . 2 . 3]" 1
1638 1 21 LYS H 1 21 LYS HG2 . . 4.560 4.509 4.357 4.565 0.005 3 0 "[ . 1 . 2 . 3]" 1
1639 2 21 LYS H 2 21 LYS HG2 . . 4.560 4.516 4.363 4.622 0.062 14 0 "[ . 1 . 2 . 3]" 1
1640 1 21 LYS H 1 21 LYS HG3 . . 4.560 4.263 3.791 4.505 . 0 0 "[ . 1 . 2 . 3]" 1
1641 2 21 LYS H 2 21 LYS HG3 . . 4.560 4.266 3.952 4.510 . 0 0 "[ . 1 . 2 . 3]" 1
1642 1 21 LYS HA 1 21 LYS HD2 . . 5.010 4.521 3.794 4.846 . 0 0 "[ . 1 . 2 . 3]" 1
1643 2 21 LYS HA 2 21 LYS HD2 . . 5.010 4.528 3.802 4.845 . 0 0 "[ . 1 . 2 . 3]" 1
1644 1 21 LYS HA 1 21 LYS HD3 . . 5.010 4.574 3.919 4.837 . 0 0 "[ . 1 . 2 . 3]" 1
1645 2 21 LYS HA 2 21 LYS HD3 . . 5.010 4.491 3.923 4.836 . 0 0 "[ . 1 . 2 . 3]" 1
1646 1 73 ILE MD 2 24 LEU MD2 . . 4.310 2.537 2.327 2.676 . 0 0 "[ . 1 . 2 . 3]" 1
1647 1 24 LEU MD2 2 73 ILE MD . . 4.310 2.551 2.334 2.716 . 0 0 "[ . 1 . 2 . 3]" 1
1648 1 73 ILE MG 2 24 LEU MD2 . . 3.690 2.979 2.823 3.150 . 0 0 "[ . 1 . 2 . 3]" 1
1649 1 24 LEU MD2 2 73 ILE MG . . 3.690 2.979 2.794 3.159 . 0 0 "[ . 1 . 2 . 3]" 1
1650 1 24 LEU HB2 1 24 LEU MD2 . . 3.580 3.183 3.178 3.195 . 0 0 "[ . 1 . 2 . 3]" 1
1651 2 24 LEU HB2 2 24 LEU MD2 . . 3.580 3.183 3.177 3.195 . 0 0 "[ . 1 . 2 . 3]" 1
1652 1 24 LEU HB3 1 24 LEU MD2 . . 3.450 2.362 2.345 2.387 . 0 0 "[ . 1 . 2 . 3]" 1
1653 2 24 LEU HB3 2 24 LEU MD2 . . 3.580 2.361 2.339 2.381 . 0 0 "[ . 1 . 2 . 3]" 1
1654 1 26 ILE HB 2 24 LEU MD2 . . 5.220 4.522 4.376 4.702 . 0 0 "[ . 1 . 2 . 3]" 1
1655 1 24 LEU MD2 2 26 ILE HB . . 5.220 4.515 4.298 4.686 . 0 0 "[ . 1 . 2 . 3]" 1
1656 1 24 LEU MD2 1 64 ILE HB . . 5.500 4.696 4.513 4.984 . 0 0 "[ . 1 . 2 . 3]" 1
1657 2 24 LEU MD2 2 64 ILE HB . . 5.500 4.706 4.500 4.879 . 0 0 "[ . 1 . 2 . 3]" 1
1658 1 24 LEU HA 1 24 LEU MD2 . . 4.020 1.954 1.942 2.065 . 0 0 "[ . 1 . 2 . 3]" 1
1659 2 24 LEU HA 2 24 LEU MD2 . . 4.020 1.955 1.941 2.056 . 0 0 "[ . 1 . 2 . 3]" 1
1660 1 24 LEU MD2 1 67 PHE QD . . 4.700 4.355 3.856 4.641 . 0 0 "[ . 1 . 2 . 3]" 1
1661 2 24 LEU MD2 2 67 PHE QD . . 4.700 4.444 4.138 4.704 0.004 21 0 "[ . 1 . 2 . 3]" 1
1662 1 24 LEU MD2 1 67 PHE QE . . 4.450 3.099 2.460 3.434 . 0 0 "[ . 1 . 2 . 3]" 1
1663 2 24 LEU MD2 2 67 PHE QE . . 4.450 3.181 2.789 3.491 . 0 0 "[ . 1 . 2 . 3]" 1
1664 1 24 LEU H 1 24 LEU MD2 . . 4.500 3.890 3.771 4.001 . 0 0 "[ . 1 . 2 . 3]" 1
1665 2 24 LEU H 2 24 LEU MD2 . . 4.500 3.885 3.714 4.051 . 0 0 "[ . 1 . 2 . 3]" 1
1666 1 20 ILE MG 1 24 LEU MD1 . . 3.960 1.855 1.803 2.038 . 0 0 "[ . 1 . 2 . 3]" 1
1667 2 20 ILE MG 2 24 LEU MD1 . . 3.960 1.863 1.805 2.028 . 0 0 "[ . 1 . 2 . 3]" 1
1668 1 24 LEU MD1 1 64 ILE MG . . 4.440 2.146 1.999 2.334 . 0 0 "[ . 1 . 2 . 3]" 1
1669 2 24 LEU MD1 2 64 ILE MG . . 4.440 2.147 1.997 2.237 . 0 0 "[ . 1 . 2 . 3]" 1
1670 1 24 LEU HB2 1 24 LEU MD1 . . 3.580 2.352 2.286 2.412 . 0 0 "[ . 1 . 2 . 3]" 1
1671 2 24 LEU HB2 2 24 LEU MD1 . . 3.580 2.347 2.259 2.415 . 0 0 "[ . 1 . 2 . 3]" 1
1672 1 24 LEU HB3 1 24 LEU MD1 . . 3.450 2.349 2.283 2.404 . 0 0 "[ . 1 . 2 . 3]" 1
1673 2 24 LEU HB3 2 24 LEU MD1 . . 3.580 2.353 2.279 2.424 . 0 0 "[ . 1 . 2 . 3]" 1
1674 1 26 ILE HB 2 24 LEU MD1 . . 5.220 3.098 3.022 3.158 . 0 0 "[ . 1 . 2 . 3]" 1
1675 1 24 LEU MD1 2 26 ILE HB . . 5.220 3.088 2.972 3.167 . 0 0 "[ . 1 . 2 . 3]" 1
1676 1 21 LYS HA 1 24 LEU MD1 . . 5.500 3.618 3.475 3.808 . 0 0 "[ . 1 . 2 . 3]" 1
1677 2 21 LYS HA 2 24 LEU MD1 . . 5.500 3.610 3.476 3.788 . 0 0 "[ . 1 . 2 . 3]" 1
1678 1 24 LEU HA 1 24 LEU MD1 . . 4.020 3.815 3.801 3.822 . 0 0 "[ . 1 . 2 . 3]" 1
1679 2 24 LEU HA 2 24 LEU MD1 . . 4.020 3.816 3.807 3.824 . 0 0 "[ . 1 . 2 . 3]" 1
1680 1 24 LEU H 1 24 LEU MD1 . . 4.500 4.112 3.933 4.220 . 0 0 "[ . 1 . 2 . 3]" 1
1681 2 24 LEU H 2 24 LEU MD1 . . 4.500 4.108 3.930 4.208 . 0 0 "[ . 1 . 2 . 3]" 1
1682 1 24 LEU MD1 1 67 PHE QD . . 4.700 3.914 3.297 4.334 . 0 0 "[ . 1 . 2 . 3]" 1
1683 2 24 LEU MD1 2 67 PHE QD . . 4.700 4.015 3.669 4.226 . 0 0 "[ . 1 . 2 . 3]" 1
1684 1 24 LEU MD1 1 67 PHE QE . . 4.450 3.583 3.116 4.087 . 0 0 "[ . 1 . 2 . 3]" 1
1685 2 24 LEU MD1 2 67 PHE QE . . 4.450 3.650 3.204 4.068 . 0 0 "[ . 1 . 2 . 3]" 1
1686 1 25 LYS H 1 25 LYS HB3 . . 3.700 3.247 3.040 3.328 . 0 0 "[ . 1 . 2 . 3]" 1
1687 2 25 LYS H 2 25 LYS HB3 . . 3.700 3.244 3.033 3.322 . 0 0 "[ . 1 . 2 . 3]" 1
1688 1 53 LYS QB 1 54 HIS HE1 . . 3.920 3.734 3.434 3.888 . 0 0 "[ . 1 . 2 . 3]" 1
1689 2 53 LYS QB 2 54 HIS HE1 . . 3.920 3.726 3.429 3.909 . 0 0 "[ . 1 . 2 . 3]" 1
1690 1 25 LYS H 1 25 LYS HG2 . . 4.700 4.447 4.200 4.595 . 0 0 "[ . 1 . 2 . 3]" 1
1691 2 25 LYS H 2 25 LYS HG2 . . 4.700 4.468 4.205 4.590 . 0 0 "[ . 1 . 2 . 3]" 1
1692 1 25 LYS H 1 25 LYS HG3 . . 4.700 4.171 3.836 4.431 . 0 0 "[ . 1 . 2 . 3]" 1
1693 2 25 LYS H 2 25 LYS HG3 . . 4.700 4.154 3.853 4.433 . 0 0 "[ . 1 . 2 . 3]" 1
1694 1 25 LYS HA 1 25 LYS HG2 . . 4.180 3.430 3.203 3.597 . 0 0 "[ . 1 . 2 . 3]" 1
1695 2 25 LYS HA 2 25 LYS HG2 . . 4.180 3.422 3.210 3.597 . 0 0 "[ . 1 . 2 . 3]" 1
1696 1 25 LYS HA 1 25 LYS HG3 . . 4.180 2.284 2.021 2.581 . 0 0 "[ . 1 . 2 . 3]" 1
1697 2 25 LYS HA 2 25 LYS HG3 . . 4.180 2.256 2.022 2.569 . 0 0 "[ . 1 . 2 . 3]" 1
1698 1 22 ASN HA 1 25 LYS QD . . 4.100 1.989 1.896 2.312 . 0 0 "[ . 1 . 2 . 3]" 1
1699 2 22 ASN HA 2 25 LYS QD . . 4.100 1.984 1.894 2.355 . 0 0 "[ . 1 . 2 . 3]" 1
1700 1 25 LYS HA 1 26 ILE HB . . 4.600 4.559 4.545 4.572 . 0 0 "[ . 1 . 2 . 3]" 1
1701 2 25 LYS HA 2 26 ILE HB . . 4.600 4.562 4.542 4.582 . 0 0 "[ . 1 . 2 . 3]" 1
1702 1 24 LEU HB3 2 26 ILE HB . . 3.790 2.704 2.576 2.850 . 0 0 "[ . 1 . 2 . 3]" 1
1703 1 26 ILE HG12 1 26 ILE MG . . 3.570 2.451 2.419 2.471 . 0 0 "[ . 1 . 2 . 3]" 1
1704 2 26 ILE HG12 2 26 ILE MG . . 3.570 2.452 2.420 2.472 . 0 0 "[ . 1 . 2 . 3]" 1
1705 1 26 ILE HG13 1 26 ILE MG . . 3.570 2.271 2.226 2.331 . 0 0 "[ . 1 . 2 . 3]" 1
1706 2 26 ILE HG13 2 26 ILE MG . . 3.570 2.270 2.217 2.333 . 0 0 "[ . 1 . 2 . 3]" 1
1707 1 26 ILE MG 1 27 ASP HB3 . . 4.550 3.065 2.629 3.632 . 0 0 "[ . 1 . 2 . 3]" 1
1708 2 26 ILE MG 2 27 ASP HB3 . . 4.550 3.065 2.637 3.615 . 0 0 "[ . 1 . 2 . 3]" 1
1709 1 26 ILE HA 1 26 ILE MG . . 3.290 3.195 3.188 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
1710 2 26 ILE HA 2 26 ILE MG . . 3.290 3.195 3.186 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
1711 1 25 LYS HA 1 26 ILE MG . . 4.200 4.038 3.984 4.083 . 0 0 "[ . 1 . 2 . 3]" 1
1712 2 25 LYS HA 2 26 ILE MG . . 4.200 4.035 3.987 4.078 . 0 0 "[ . 1 . 2 . 3]" 1
1713 1 26 ILE MG 1 27 ASP HA . . 4.180 3.521 3.433 3.608 . 0 0 "[ . 1 . 2 . 3]" 1
1714 2 26 ILE MG 2 27 ASP HA . . 4.180 3.525 3.430 3.633 . 0 0 "[ . 1 . 2 . 3]" 1
1715 1 26 ILE H 1 26 ILE HG13 . . 4.840 4.435 4.423 4.448 . 0 0 "[ . 1 . 2 . 3]" 1
1716 2 26 ILE H 2 26 ILE HG13 . . 4.840 4.433 4.411 4.444 . 0 0 "[ . 1 . 2 . 3]" 1
1717 1 26 ILE H 1 26 ILE HG12 . . 4.840 4.726 4.721 4.727 . 0 0 "[ . 1 . 2 . 3]" 1
1718 2 26 ILE H 2 26 ILE HG12 . . 4.840 4.726 4.722 4.729 . 0 0 "[ . 1 . 2 . 3]" 1
1719 1 26 ILE HG12 1 27 ASP H . . 5.070 4.826 4.754 4.874 . 0 0 "[ . 1 . 2 . 3]" 1
1720 2 26 ILE HG12 2 27 ASP H . . 5.070 4.819 4.732 4.877 . 0 0 "[ . 1 . 2 . 3]" 1
1721 1 26 ILE HB 1 26 ILE MD . . 3.640 2.417 2.403 2.425 . 0 0 "[ . 1 . 2 . 3]" 1
1722 2 26 ILE HB 2 26 ILE MD . . 3.640 2.420 2.400 2.435 . 0 0 "[ . 1 . 2 . 3]" 1
1723 1 26 ILE HA 1 26 ILE MD . . 3.640 1.937 1.916 1.961 . 0 0 "[ . 1 . 2 . 3]" 1
1724 2 26 ILE HA 2 26 ILE MD . . 3.640 1.932 1.911 1.961 . 0 0 "[ . 1 . 2 . 3]" 1
1725 1 26 ILE H 1 26 ILE MD . . 4.590 4.109 4.099 4.120 . 0 0 "[ . 1 . 2 . 3]" 1
1726 2 26 ILE H 2 26 ILE MD . . 4.590 4.110 4.103 4.123 . 0 0 "[ . 1 . 2 . 3]" 1
1727 1 27 ASP HB2 1 28 ASN H . . 4.530 3.930 3.806 4.150 . 0 0 "[ . 1 . 2 . 3]" 1
1728 2 27 ASP HB2 2 28 ASN H . . 4.530 3.930 3.818 4.129 . 0 0 "[ . 1 . 2 . 3]" 1
1729 1 26 ILE MG 1 27 ASP HB2 . . 4.550 3.625 2.577 4.280 . 0 0 "[ . 1 . 2 . 3]" 1
1730 2 26 ILE MG 2 27 ASP HB2 . . 4.550 3.625 2.573 4.280 . 0 0 "[ . 1 . 2 . 3]" 1
1731 1 36 GLU HA 1 39 ASP HB2 . . 4.350 3.709 2.850 4.331 . 0 0 "[ . 1 . 2 . 3]" 1
1732 2 36 GLU HA 2 39 ASP HB2 . . 4.350 3.733 2.832 4.346 . 0 0 "[ . 1 . 2 . 3]" 1
1733 1 29 LEU QB 1 30 ASP H . . 4.060 3.915 3.908 3.922 . 0 0 "[ . 1 . 2 . 3]" 1
1734 2 29 LEU QB 2 30 ASP H . . 4.060 3.916 3.907 3.924 . 0 0 "[ . 1 . 2 . 3]" 1
1735 1 26 ILE HA 1 29 LEU QB . . 4.070 3.324 3.112 3.467 . 0 0 "[ . 1 . 2 . 3]" 1
1736 2 26 ILE HA 2 29 LEU QB . . 4.070 3.329 3.106 3.453 . 0 0 "[ . 1 . 2 . 3]" 1
1737 1 29 LEU QB 1 31 VAL MG1 . . 5.410 4.490 4.281 4.718 . 0 0 "[ . 1 . 2 . 3]" 1
1738 2 29 LEU QB 2 31 VAL MG1 . . 5.410 4.504 4.271 4.802 . 0 0 "[ . 1 . 2 . 3]" 1
1739 1 29 LEU QB 1 31 VAL MG2 . . 5.410 5.134 4.587 5.413 0.003 14 0 "[ . 1 . 2 . 3]" 1
1740 2 29 LEU QB 2 31 VAL MG2 . . 5.410 5.159 4.762 5.421 0.011 14 0 "[ . 1 . 2 . 3]" 1
1741 1 29 LEU H 1 29 LEU HG . . 4.710 4.507 4.472 4.536 . 0 0 "[ . 1 . 2 . 3]" 1
1742 2 29 LEU H 2 29 LEU HG . . 4.710 4.506 4.481 4.536 . 0 0 "[ . 1 . 2 . 3]" 1
1743 1 29 LEU HG 1 30 ASP H . . 4.690 3.470 3.403 3.523 . 0 0 "[ . 1 . 2 . 3]" 1
1744 2 29 LEU HG 2 30 ASP H . . 4.690 3.470 3.404 3.538 . 0 0 "[ . 1 . 2 . 3]" 1
1745 1 29 LEU QB 1 29 LEU MD1 . . 3.040 2.107 2.047 2.179 . 0 0 "[ . 1 . 2 . 3]" 1
1746 2 29 LEU QB 2 29 LEU MD1 . . 3.040 2.105 2.037 2.176 . 0 0 "[ . 1 . 2 . 3]" 1
1747 1 29 LEU HA 1 29 LEU MD1 . . 3.960 2.369 2.201 2.498 . 0 0 "[ . 1 . 2 . 3]" 1
1748 2 29 LEU HA 2 29 LEU MD1 . . 3.960 2.373 2.207 2.509 . 0 0 "[ . 1 . 2 . 3]" 1
1749 1 26 ILE HA 1 29 LEU MD1 . . 4.510 3.393 3.096 3.710 . 0 0 "[ . 1 . 2 . 3]" 1
1750 2 26 ILE HA 2 29 LEU MD1 . . 4.510 3.394 3.100 3.684 . 0 0 "[ . 1 . 2 . 3]" 1
1751 1 67 PHE QE 2 29 LEU MD1 . . 4.200 2.142 1.878 2.659 . 0 0 "[ . 1 . 2 . 3]" 1
1752 1 29 LEU MD1 2 67 PHE QE . . 4.200 2.118 1.881 2.612 . 0 0 "[ . 1 . 2 . 3]" 1
1753 1 29 LEU H 1 29 LEU MD1 . . 4.310 3.943 3.856 4.018 . 0 0 "[ . 1 . 2 . 3]" 1
1754 2 29 LEU H 2 29 LEU MD1 . . 4.310 3.945 3.860 4.026 . 0 0 "[ . 1 . 2 . 3]" 1
1755 1 29 LEU HA 1 29 LEU MD2 . . 3.960 3.912 3.874 3.948 . 0 0 "[ . 1 . 2 . 3]" 1
1756 2 29 LEU HA 2 29 LEU MD2 . . 3.960 3.912 3.877 3.938 . 0 0 "[ . 1 . 2 . 3]" 1
1757 1 26 ILE HA 1 29 LEU MD2 . . 4.510 4.477 4.339 4.556 0.046 30 0 "[ . 1 . 2 . 3]" 1
1758 2 26 ILE HA 2 29 LEU MD2 . . 4.510 4.490 4.348 4.578 0.068 23 0 "[ . 1 . 2 . 3]" 1
1759 1 29 LEU QB 1 29 LEU MD2 . . 3.040 2.091 2.046 2.100 . 0 0 "[ . 1 . 2 . 3]" 1
1760 2 29 LEU QB 2 29 LEU MD2 . . 3.040 2.091 2.047 2.101 . 0 0 "[ . 1 . 2 . 3]" 1
1761 1 67 PHE QD 2 29 LEU MD2 . . 4.670 2.001 1.922 2.231 . 0 0 "[ . 1 . 2 . 3]" 1
1762 1 29 LEU MD2 2 67 PHE QD . . 4.670 1.980 1.934 2.178 . 0 0 "[ . 1 . 2 . 3]" 1
1763 1 29 LEU H 1 29 LEU MD2 . . 4.310 4.232 4.206 4.256 . 0 0 "[ . 1 . 2 . 3]" 1
1764 2 29 LEU H 2 29 LEU MD2 . . 4.310 4.232 4.205 4.254 . 0 0 "[ . 1 . 2 . 3]" 1
1765 1 29 LEU MD2 1 30 ASP H . . 4.970 4.868 4.824 4.904 . 0 0 "[ . 1 . 2 . 3]" 1
1766 2 29 LEU MD2 2 30 ASP H . . 4.970 4.868 4.819 4.908 . 0 0 "[ . 1 . 2 . 3]" 1
1767 1 31 VAL HB 1 32 ASN H . . 3.810 3.788 3.647 3.855 0.045 28 0 "[ . 1 . 2 . 3]" 1
1768 2 31 VAL HB 2 32 ASN H . . 3.810 3.794 3.708 3.860 0.050 28 0 "[ . 1 . 2 . 3]" 1
1769 1 31 VAL H 1 31 VAL HB . . 3.990 3.606 3.599 3.615 . 0 0 "[ . 1 . 2 . 3]" 1
1770 2 31 VAL H 2 31 VAL HB . . 3.990 3.607 3.599 3.615 . 0 0 "[ . 1 . 2 . 3]" 1
1771 1 31 VAL H 1 31 VAL MG2 . . 3.200 2.052 1.903 2.198 . 0 0 "[ . 1 . 2 . 3]" 1
1772 2 31 VAL H 2 31 VAL MG2 . . 3.200 2.054 1.919 2.196 . 0 0 "[ . 1 . 2 . 3]" 1
1773 1 31 VAL MG2 1 32 ASN H . . 4.380 2.089 1.936 2.248 . 0 0 "[ . 1 . 2 . 3]" 1
1774 2 31 VAL MG2 2 32 ASN H . . 4.380 2.095 1.930 2.250 . 0 0 "[ . 1 . 2 . 3]" 1
1775 1 30 ASP HA 1 31 VAL MG2 . . 5.110 3.617 3.543 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
1776 2 30 ASP HA 2 31 VAL MG2 . . 5.110 3.617 3.549 3.665 . 0 0 "[ . 1 . 2 . 3]" 1
1777 1 30 ASP HA 1 31 VAL MG1 . . 5.110 4.380 4.236 4.617 . 0 0 "[ . 1 . 2 . 3]" 1
1778 2 30 ASP HA 2 31 VAL MG1 . . 5.110 4.370 4.240 4.533 . 0 0 "[ . 1 . 2 . 3]" 1
1779 1 70 SER HB2 2 31 VAL MG2 . . 6.320 3.505 3.134 3.822 . 0 0 "[ . 1 . 2 . 3]" 1
1780 1 31 VAL MG2 2 70 SER HB2 . . 6.320 3.524 3.131 3.834 . 0 0 "[ . 1 . 2 . 3]" 1
1781 1 70 SER HB2 2 31 VAL MG1 . . 6.320 3.351 2.913 3.860 . 0 0 "[ . 1 . 2 . 3]" 1
1782 1 31 VAL MG1 2 70 SER HB2 . . 6.320 3.350 2.911 3.816 . 0 0 "[ . 1 . 2 . 3]" 1
1783 1 31 VAL HA 1 31 VAL MG2 . . 3.280 3.187 3.177 3.200 . 0 0 "[ . 1 . 2 . 3]" 1
1784 2 31 VAL HA 2 31 VAL MG2 . . 3.280 3.187 3.177 3.199 . 0 0 "[ . 1 . 2 . 3]" 1
1785 1 31 VAL HA 1 31 VAL MG1 . . 3.280 2.200 2.161 2.296 . 0 0 "[ . 1 . 2 . 3]" 1
1786 2 31 VAL HA 2 31 VAL MG1 . . 3.280 2.201 2.160 2.294 . 0 0 "[ . 1 . 2 . 3]" 1
1787 1 29 LEU HG 1 31 VAL MG2 . . 4.900 3.770 2.934 4.205 . 0 0 "[ . 1 . 2 . 3]" 1
1788 2 29 LEU HG 2 31 VAL MG2 . . 4.900 3.794 3.214 4.199 . 0 0 "[ . 1 . 2 . 3]" 1
1789 1 29 LEU HG 1 31 VAL MG1 . . 4.900 2.687 2.450 3.016 . 0 0 "[ . 1 . 2 . 3]" 1
1790 2 29 LEU HG 2 31 VAL MG1 . . 4.900 2.698 2.400 3.026 . 0 0 "[ . 1 . 2 . 3]" 1
1791 1 32 ASN H 1 32 ASN HB3 . . 3.740 3.427 2.396 3.593 . 0 0 "[ . 1 . 2 . 3]" 1
1792 2 32 ASN H 2 32 ASN HB3 . . 3.740 3.426 2.396 3.592 . 0 0 "[ . 1 . 2 . 3]" 1
1793 1 33 ARG H 1 33 ARG HG2 . . 4.760 4.328 3.282 4.602 . 0 0 "[ . 1 . 2 . 3]" 1
1794 2 33 ARG H 2 33 ARG HG2 . . 4.760 4.326 3.282 4.603 . 0 0 "[ . 1 . 2 . 3]" 1
1795 1 35 ILE HA 1 35 ILE MG . . 3.290 2.331 2.295 2.393 . 0 0 "[ . 1 . 2 . 3]" 1
1796 2 35 ILE HA 2 35 ILE MG . . 3.290 2.331 2.293 2.392 . 0 0 "[ . 1 . 2 . 3]" 1
1797 1 73 ILE MD 2 35 ILE MD . . 3.730 3.015 2.659 3.303 . 0 0 "[ . 1 . 2 . 3]" 1
1798 1 35 ILE MD 2 73 ILE MD . . 3.730 3.006 2.680 3.159 . 0 0 "[ . 1 . 2 . 3]" 1
1799 1 72 VAL MG1 2 35 ILE MD . . 3.560 2.401 2.262 2.979 . 0 0 "[ . 1 . 2 . 3]" 1
1800 1 35 ILE MD 2 72 VAL MG1 . . 3.560 2.401 2.237 3.044 . 0 0 "[ . 1 . 2 . 3]" 1
1801 1 72 VAL MG2 2 35 ILE MD . . 3.560 3.051 2.666 3.583 0.023 20 0 "[ . 1 . 2 . 3]" 1
1802 1 35 ILE MD 2 72 VAL MG2 . . 3.560 3.042 2.652 3.579 0.019 20 0 "[ . 1 . 2 . 3]" 1
1803 1 35 ILE HB 1 35 ILE MD . . 3.180 2.076 1.991 2.189 . 0 0 "[ . 1 . 2 . 3]" 1
1804 2 35 ILE HB 2 35 ILE MD . . 3.180 2.076 1.991 2.183 . 0 0 "[ . 1 . 2 . 3]" 1
1805 1 31 VAL HB 1 35 ILE MD . . 4.350 2.803 2.423 3.293 . 0 0 "[ . 1 . 2 . 3]" 1
1806 2 31 VAL HB 2 35 ILE MD . . 4.350 2.809 2.439 3.342 . 0 0 "[ . 1 . 2 . 3]" 1
1807 1 73 ILE HB 2 35 ILE MD . . 5.180 5.141 4.939 5.189 0.009 18 0 "[ . 1 . 2 . 3]" 1
1808 1 35 ILE MD 2 73 ILE HB . . 5.180 5.135 4.932 5.191 0.011 19 0 "[ . 1 . 2 . 3]" 1
1809 1 35 ILE HA 1 35 ILE MD . . 3.900 3.776 3.675 3.818 . 0 0 "[ . 1 . 2 . 3]" 1
1810 2 35 ILE HA 2 35 ILE MD . . 3.900 3.775 3.663 3.833 . 0 0 "[ . 1 . 2 . 3]" 1
1811 1 32 ASN HA 1 35 ILE MD . . 3.590 2.414 2.127 2.633 . 0 0 "[ . 1 . 2 . 3]" 1
1812 2 32 ASN HA 2 35 ILE MD . . 3.590 2.418 2.170 2.639 . 0 0 "[ . 1 . 2 . 3]" 1
1813 1 35 ILE MD 1 36 GLU H . . 4.700 3.837 3.663 4.093 . 0 0 "[ . 1 . 2 . 3]" 1
1814 2 35 ILE MD 2 36 GLU H . . 4.700 3.847 3.681 4.092 . 0 0 "[ . 1 . 2 . 3]" 1
1815 1 73 ILE H 2 35 ILE MD . . 4.540 4.454 4.249 4.545 0.005 5 0 "[ . 1 . 2 . 3]" 1
1816 1 35 ILE MD 2 73 ILE H . . 4.540 4.447 4.211 4.545 0.005 6 0 "[ . 1 . 2 . 3]" 1
1817 1 35 ILE HG12 1 35 ILE MG . . 3.490 2.067 1.959 2.162 . 0 0 "[ . 1 . 2 . 3]" 1
1818 2 35 ILE HG12 2 35 ILE MG . . 3.490 2.068 1.966 2.161 . 0 0 "[ . 1 . 2 . 3]" 1
1819 1 35 ILE H 1 35 ILE HG12 . . 4.020 3.738 3.654 3.869 . 0 0 "[ . 1 . 2 . 3]" 1
1820 2 35 ILE H 2 35 ILE HG12 . . 4.020 3.735 3.655 3.864 . 0 0 "[ . 1 . 2 . 3]" 1
1821 1 76 LYS HE2 2 35 ILE MG . . 4.000 3.400 1.989 3.845 . 0 0 "[ . 1 . 2 . 3]" 1
1822 1 35 ILE MG 2 76 LYS HE2 . . 4.000 3.394 1.983 3.847 . 0 0 "[ . 1 . 2 . 3]" 1
1823 1 35 ILE MG 1 36 GLU HA . . 3.930 3.461 3.309 3.635 . 0 0 "[ . 1 . 2 . 3]" 1
1824 2 35 ILE MG 2 36 GLU HA . . 3.930 3.471 3.324 3.648 . 0 0 "[ . 1 . 2 . 3]" 1
1825 1 35 ILE MG 1 39 ASP HA . . 4.900 4.768 4.514 4.928 0.028 19 0 "[ . 1 . 2 . 3]" 1
1826 2 35 ILE MG 2 39 ASP HA . . 4.900 4.781 4.562 4.901 0.001 16 0 "[ . 1 . 2 . 3]" 1
1827 1 76 LYS HE3 2 35 ILE MG . . 4.000 2.368 1.928 3.221 . 0 0 "[ . 1 . 2 . 3]" 1
1828 1 35 ILE MG 2 76 LYS HE3 . . 4.000 2.363 1.936 3.267 . 0 0 "[ . 1 . 2 . 3]" 1
1829 1 76 LYS HD2 2 35 ILE MG . . 4.060 2.768 2.134 3.156 . 0 0 "[ . 1 . 2 . 3]" 1
1830 1 35 ILE MG 2 76 LYS HD2 . . 4.060 2.756 2.150 3.156 . 0 0 "[ . 1 . 2 . 3]" 1
1831 1 76 LYS HD3 2 35 ILE MG . . 4.060 2.693 2.282 3.141 . 0 0 "[ . 1 . 2 . 3]" 1
1832 1 35 ILE MG 2 76 LYS HD3 . . 4.060 2.690 2.281 3.167 . 0 0 "[ . 1 . 2 . 3]" 1
1833 1 35 ILE H 1 35 ILE MG . . 3.980 3.765 3.763 3.767 . 0 0 "[ . 1 . 2 . 3]" 1
1834 2 35 ILE H 2 35 ILE MG . . 3.980 3.765 3.762 3.767 . 0 0 "[ . 1 . 2 . 3]" 1
1835 2 33 ARG HA 2 36 GLU HB2 . . 3.720 2.645 2.485 2.837 . 0 0 "[ . 1 . 2 . 3]" 1
1836 1 33 ARG HA 1 36 GLU HG3 . . 4.190 2.552 2.121 2.808 . 0 0 "[ . 1 . 2 . 3]" 1
1837 2 33 ARG HA 2 36 GLU HG3 . . 4.190 2.492 2.078 2.723 . 0 0 "[ . 1 . 2 . 3]" 1
1838 1 33 ARG HA 1 36 GLU HG2 . . 4.190 3.847 3.417 4.188 . 0 0 "[ . 1 . 2 . 3]" 1
1839 2 33 ARG HA 2 36 GLU HG2 . . 4.190 3.795 3.369 4.134 . 0 0 "[ . 1 . 2 . 3]" 1
1840 1 37 ALA H 1 37 ALA MB . . 2.910 2.095 2.065 2.207 . 0 0 "[ . 1 . 2 . 3]" 1
1841 2 37 ALA H 2 37 ALA MB . . 2.910 2.094 2.064 2.228 . 0 0 "[ . 1 . 2 . 3]" 1
1842 1 37 ALA MB 1 38 LEU H . . 3.460 2.477 2.297 2.523 . 0 0 "[ . 1 . 2 . 3]" 1
1843 2 37 ALA MB 2 38 LEU H . . 3.460 2.491 2.322 2.562 . 0 0 "[ . 1 . 2 . 3]" 1
1844 1 37 ALA MB 1 39 ASP H . . 4.430 4.368 4.308 4.460 0.030 18 0 "[ . 1 . 2 . 3]" 1
1845 2 37 ALA MB 2 39 ASP H . . 4.430 4.367 4.310 4.442 0.012 21 0 "[ . 1 . 2 . 3]" 1
1846 1 37 ALA MB 1 40 GLU H . . 4.790 4.555 4.407 4.660 . 0 0 "[ . 1 . 2 . 3]" 1
1847 2 37 ALA MB 2 40 GLU H . . 4.790 4.536 4.396 4.632 . 0 0 "[ . 1 . 2 . 3]" 1
1848 1 40 GLU H 1 42 ALA MB . . 5.220 4.938 4.701 5.096 . 0 0 "[ . 1 . 2 . 3]" 1
1849 2 40 GLU H 2 42 ALA MB . . 5.220 4.926 4.671 5.093 . 0 0 "[ . 1 . 2 . 3]" 1
1850 1 39 ASP HA 1 42 ALA MB . . 3.010 2.974 2.721 3.034 0.024 18 0 "[ . 1 . 2 . 3]" 1
1851 2 39 ASP HA 2 42 ALA MB . . 3.010 2.941 2.760 3.032 0.022 5 0 "[ . 1 . 2 . 3]" 1
1852 1 34 CYS HA 1 37 ALA MB . . 3.520 2.867 2.626 3.064 . 0 0 "[ . 1 . 2 . 3]" 1
1853 2 34 CYS HA 2 37 ALA MB . . 3.520 2.895 2.645 3.097 . 0 0 "[ . 1 . 2 . 3]" 1
1854 1 16 ILE HA 1 37 ALA MB . . 4.060 3.072 2.904 3.226 . 0 0 "[ . 1 . 2 . 3]" 1
1855 2 16 ILE HA 2 37 ALA MB . . 4.060 3.024 2.841 3.250 . 0 0 "[ . 1 . 2 . 3]" 1
1856 1 83 LYS QE 2 42 ALA MB . . 5.500 4.880 3.930 5.408 . 0 0 "[ . 1 . 2 . 3]" 1
1857 1 42 ALA MB 2 83 LYS QE . . 5.500 4.864 3.840 5.325 . 0 0 "[ . 1 . 2 . 3]" 1
1858 1 20 ILE HG12 1 37 ALA MB . . 3.550 2.193 2.108 2.475 . 0 0 "[ . 1 . 2 . 3]" 1
1859 2 20 ILE HG12 2 37 ALA MB . . 3.550 2.183 2.092 2.314 . 0 0 "[ . 1 . 2 . 3]" 1
1860 1 80 LEU HG 2 42 ALA MB . . 4.200 3.879 3.517 4.214 0.014 8 0 "[ . 1 . 2 . 3]" 1
1861 1 42 ALA MB 2 80 LEU HG . . 4.200 3.869 3.491 4.191 . 0 0 "[ . 1 . 2 . 3]" 1
1862 1 80 LEU MD2 2 42 ALA MB . . 3.310 2.206 1.897 3.189 . 0 0 "[ . 1 . 2 . 3]" 1
1863 1 42 ALA MB 2 80 LEU MD2 . . 3.310 2.137 1.881 2.761 . 0 0 "[ . 1 . 2 . 3]" 1
1864 1 20 ILE HG13 1 37 ALA MB . . 3.550 2.129 2.018 2.290 . 0 0 "[ . 1 . 2 . 3]" 1
1865 2 20 ILE HG13 2 37 ALA MB . . 3.550 2.124 1.997 2.209 . 0 0 "[ . 1 . 2 . 3]" 1
1866 1 80 LEU MD1 2 42 ALA MB . . 3.310 3.123 2.083 3.338 0.028 5 0 "[ . 1 . 2 . 3]" 1
1867 1 42 ALA MB 2 80 LEU MD1 . . 3.310 3.168 2.352 3.346 0.036 8 0 "[ . 1 . 2 . 3]" 1
1868 1 20 ILE MD 1 37 ALA MB . . 3.200 1.985 1.891 2.176 . 0 0 "[ . 1 . 2 . 3]" 1
1869 2 20 ILE MD 2 37 ALA MB . . 3.200 1.961 1.889 2.137 . 0 0 "[ . 1 . 2 . 3]" 1
1870 1 37 ALA MB 1 38 LEU MD2 . . 5.190 4.286 3.876 4.898 . 0 0 "[ . 1 . 2 . 3]" 1
1871 2 37 ALA MB 2 38 LEU MD2 . . 5.190 4.298 3.892 4.928 . 0 0 "[ . 1 . 2 . 3]" 1
1872 1 80 LEU HA 1 80 LEU MD2 . . 4.590 2.278 1.969 3.822 . 0 0 "[ . 1 . 2 . 3]" 1
1873 2 80 LEU HA 2 80 LEU MD2 . . 4.590 2.210 1.965 2.983 . 0 0 "[ . 1 . 2 . 3]" 1
1874 1 38 LEU HA 2 80 LEU MD2 . . 5.090 4.455 3.807 4.779 . 0 0 "[ . 1 . 2 . 3]" 1
1875 1 80 LEU MD2 2 38 LEU HA . . 5.090 4.365 2.668 4.746 . 0 0 "[ . 1 . 2 . 3]" 1
1876 1 42 ALA H 2 80 LEU MD2 . . 4.360 3.038 2.626 3.932 . 0 0 "[ . 1 . 2 . 3]" 1
1877 1 80 LEU MD2 2 42 ALA H . . 4.360 3.024 2.631 4.093 . 0 0 "[ . 1 . 2 . 3]" 1
1878 1 41 LEU H 1 41 LEU MD1 . . 4.230 4.226 4.109 4.333 0.103 18 0 "[ . 1 . 2 . 3]" 1
1879 2 41 LEU H 2 41 LEU MD1 . . 4.230 4.220 4.072 4.261 0.031 17 0 "[ . 1 . 2 . 3]" 1
1880 1 84 PHE HZ 2 41 LEU MD1 . . 4.380 2.066 1.877 2.368 . 0 0 "[ . 1 . 2 . 3]" 1
1881 1 41 LEU MD1 2 84 PHE HZ . . 4.380 2.104 1.894 2.917 . 0 0 "[ . 1 . 2 . 3]" 1
1882 1 84 PHE QD 2 41 LEU MD1 . . 5.430 4.074 3.880 5.037 . 0 0 "[ . 1 . 2 . 3]" 1
1883 1 41 LEU MD1 2 84 PHE QD . . 5.430 4.035 3.803 5.006 . 0 0 "[ . 1 . 2 . 3]" 1
1884 1 84 PHE HZ 2 41 LEU MD2 . . 4.380 2.854 2.223 3.402 . 0 0 "[ . 1 . 2 . 3]" 1
1885 1 41 LEU MD2 2 84 PHE HZ . . 4.380 2.847 2.151 3.464 . 0 0 "[ . 1 . 2 . 3]" 1
1886 1 84 PHE QD 2 41 LEU MD2 . . 5.430 5.263 3.997 5.457 0.027 9 0 "[ . 1 . 2 . 3]" 1
1887 1 41 LEU MD2 2 84 PHE QD . . 5.430 5.323 4.031 5.477 0.047 9 0 "[ . 1 . 2 . 3]" 1
1888 1 41 LEU H 1 41 LEU MD2 . . 4.230 3.814 3.545 4.195 . 0 0 "[ . 1 . 2 . 3]" 1
1889 2 41 LEU H 2 41 LEU MD2 . . 4.230 3.800 3.546 4.204 . 0 0 "[ . 1 . 2 . 3]" 1
1890 1 38 LEU HA 1 38 LEU MD2 . . 4.480 2.365 1.971 3.787 . 0 0 "[ . 1 . 2 . 3]" 1
1891 2 38 LEU HA 2 38 LEU MD2 . . 4.480 2.364 1.971 3.786 . 0 0 "[ . 1 . 2 . 3]" 1
1892 1 77 SER HB3 2 38 LEU MD2 . . 5.980 3.258 2.845 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
1893 1 38 LEU MD2 2 77 SER HB3 . . 5.980 3.295 2.865 3.711 . 0 0 "[ . 1 . 2 . 3]" 1
1894 1 38 LEU H 1 38 LEU MD2 . . 4.170 3.751 3.456 4.071 . 0 0 "[ . 1 . 2 . 3]" 1
1895 2 38 LEU H 2 38 LEU MD2 . . 4.170 3.755 3.467 4.079 . 0 0 "[ . 1 . 2 . 3]" 1
1896 1 38 LEU H 1 38 LEU HG . . 4.410 2.509 2.249 4.225 . 0 0 "[ . 1 . 2 . 3]" 1
1897 2 38 LEU H 2 38 LEU HG . . 4.410 2.515 2.257 4.226 . 0 0 "[ . 1 . 2 . 3]" 1
1898 1 37 ALA MB 1 38 LEU MD1 . . 5.190 4.312 3.080 4.627 . 0 0 "[ . 1 . 2 . 3]" 1
1899 2 37 ALA MB 2 38 LEU MD1 . . 5.190 4.328 3.102 4.661 . 0 0 "[ . 1 . 2 . 3]" 1
1900 1 76 LYS QB 2 38 LEU MD1 . . 4.260 2.322 2.034 4.046 . 0 0 "[ . 1 . 2 . 3]" 1
1901 1 38 LEU MD1 2 76 LYS QB . . 4.260 2.350 2.057 4.077 . 0 0 "[ . 1 . 2 . 3]" 1
1902 1 38 LEU HA 1 38 LEU MD1 . . 4.480 3.805 2.055 3.895 . 0 0 "[ . 1 . 2 . 3]" 1
1903 2 38 LEU HA 2 38 LEU MD1 . . 4.480 3.804 2.057 3.895 . 0 0 "[ . 1 . 2 . 3]" 1
1904 1 77 SER HB2 2 38 LEU MD1 . . 5.980 4.528 4.018 5.127 . 0 0 "[ . 1 . 2 . 3]" 1
1905 1 38 LEU MD1 2 77 SER HB2 . . 5.980 4.493 3.984 5.025 . 0 0 "[ . 1 . 2 . 3]" 1
1906 1 77 SER HB3 2 38 LEU MD1 . . 5.980 3.368 2.965 3.928 . 0 0 "[ . 1 . 2 . 3]" 1
1907 1 38 LEU MD1 2 77 SER HB3 . . 5.980 3.350 2.963 4.082 . 0 0 "[ . 1 . 2 . 3]" 1
1908 1 38 LEU MD1 1 39 ASP H . . 4.880 4.450 4.108 4.678 . 0 0 "[ . 1 . 2 . 3]" 1
1909 2 38 LEU MD1 2 39 ASP H . . 4.880 4.463 4.151 4.701 . 0 0 "[ . 1 . 2 . 3]" 1
1910 1 44 LEU HB3 1 44 LEU MD2 . . 3.640 2.343 2.176 2.478 . 0 0 "[ . 1 . 2 . 3]" 1
1911 2 44 LEU HB3 2 44 LEU MD2 . . 3.640 2.316 2.153 2.423 . 0 0 "[ . 1 . 2 . 3]" 1
1912 1 80 LEU HB2 2 61 LEU MD1 . . 5.290 2.569 2.197 2.952 . 0 0 "[ . 1 . 2 . 3]" 1
1913 1 61 LEU MD1 2 80 LEU HB2 . . 5.290 2.542 2.217 2.950 . 0 0 "[ . 1 . 2 . 3]" 1
1914 1 44 LEU HB2 1 44 LEU MD2 . . 3.640 3.185 3.167 3.195 . 0 0 "[ . 1 . 2 . 3]" 1
1915 2 44 LEU HB2 2 44 LEU MD2 . . 3.640 3.186 3.168 3.194 . 0 0 "[ . 1 . 2 . 3]" 1
1916 1 12 ARG QD 1 44 LEU MD2 . . 4.130 2.114 1.842 3.640 . 0 0 "[ . 1 . 2 . 3]" 1
1917 2 12 ARG QD 2 44 LEU MD2 . . 4.130 2.060 1.840 2.641 . 0 0 "[ . 1 . 2 . 3]" 1
1918 1 44 LEU HA 1 44 LEU MD2 . . 4.300 2.073 1.945 2.334 . 0 0 "[ . 1 . 2 . 3]" 1
1919 2 44 LEU HA 2 44 LEU MD2 . . 4.300 2.106 1.959 2.363 . 0 0 "[ . 1 . 2 . 3]" 1
1920 1 41 LEU HA 1 44 LEU HG . . 4.470 3.201 1.994 3.643 . 0 0 "[ . 1 . 2 . 3]" 1
1921 2 41 LEU HA 2 44 LEU HG . . 4.470 3.368 2.224 3.872 . 0 0 "[ . 1 . 2 . 3]" 1
1922 1 44 LEU HB3 1 44 LEU MD1 . . 3.640 2.335 2.123 2.524 . 0 0 "[ . 1 . 2 . 3]" 1
1923 2 44 LEU HB3 2 44 LEU MD1 . . 3.640 2.359 2.158 2.522 . 0 0 "[ . 1 . 2 . 3]" 1
1924 1 12 ARG HG3 1 44 LEU MD1 . . 4.770 2.636 2.197 3.136 . 0 0 "[ . 1 . 2 . 3]" 1
1925 1 44 LEU HB2 1 44 LEU MD1 . . 3.640 2.357 2.142 2.540 . 0 0 "[ . 1 . 2 . 3]" 1
1926 2 44 LEU HB2 2 44 LEU MD1 . . 3.640 2.334 2.145 2.504 . 0 0 "[ . 1 . 2 . 3]" 1
1927 1 12 ARG QD 1 44 LEU MD1 . . 4.130 2.263 1.821 3.464 . 0 0 "[ . 1 . 2 . 3]" 1
1928 2 12 ARG QD 2 44 LEU MD1 . . 4.130 2.211 1.871 2.759 . 0 0 "[ . 1 . 2 . 3]" 1
1929 1 44 LEU HA 1 44 LEU MD1 . . 4.300 3.827 3.729 3.910 . 0 0 "[ . 1 . 2 . 3]" 1
1930 2 44 LEU HA 2 44 LEU MD1 . . 4.300 3.844 3.776 3.922 . 0 0 "[ . 1 . 2 . 3]" 1
1931 1 44 LEU H 1 44 LEU MD1 . . 4.490 3.759 3.521 4.216 . 0 0 "[ . 1 . 2 . 3]" 1
1932 2 44 LEU H 2 44 LEU MD1 . . 4.490 3.706 3.525 4.218 . 0 0 "[ . 1 . 2 . 3]" 1
1933 1 84 PHE QE 2 46 VAL HB . . 4.710 4.238 2.002 4.719 0.009 30 0 "[ . 1 . 2 . 3]" 1
1934 1 46 VAL HB 2 84 PHE QE . . 4.710 4.253 2.142 4.705 . 0 0 "[ . 1 . 2 . 3]" 1
1935 1 13 LEU MD2 1 46 VAL MG1 . . 4.410 3.226 1.989 3.953 . 0 0 "[ . 1 . 2 . 3]" 1
1936 2 13 LEU MD2 2 46 VAL MG1 . . 4.410 3.170 2.571 3.470 . 0 0 "[ . 1 . 2 . 3]" 1
1937 1 13 LEU MD1 1 46 VAL MG1 . . 4.410 3.317 1.902 4.210 . 0 0 "[ . 1 . 2 . 3]" 1
1938 2 13 LEU MD1 2 46 VAL MG1 . . 4.410 3.242 1.920 3.980 . 0 0 "[ . 1 . 2 . 3]" 1
1939 1 13 LEU MD1 1 46 VAL MG2 . . 4.410 2.746 1.948 3.739 . 0 0 "[ . 1 . 2 . 3]" 1
1940 2 13 LEU MD1 2 46 VAL MG2 . . 4.410 2.596 1.938 3.660 . 0 0 "[ . 1 . 2 . 3]" 1
1941 1 84 PHE QE 2 46 VAL MG1 . . 4.450 1.987 1.882 2.393 . 0 0 "[ . 1 . 2 . 3]" 1
1942 1 46 VAL MG1 2 84 PHE QE . . 4.450 1.984 1.880 2.396 . 0 0 "[ . 1 . 2 . 3]" 1
1943 1 47 THR H 1 47 THR MG . . 3.120 2.078 2.004 2.204 . 0 0 "[ . 1 . 2 . 3]" 1
1944 2 47 THR H 2 47 THR MG . . 3.120 2.079 2.002 2.206 . 0 0 "[ . 1 . 2 . 3]" 1
1945 1 47 THR MG 1 50 GLN H . . 4.420 1.998 1.867 2.153 . 0 0 "[ . 1 . 2 . 3]" 1
1946 2 47 THR MG 2 50 GLN H . . 4.420 1.990 1.842 2.123 . 0 0 "[ . 1 . 2 . 3]" 1
1947 1 47 THR MG 1 49 GLN HE22 . . 4.880 4.123 3.039 4.840 . 0 0 "[ . 1 . 2 . 3]" 1
1948 2 47 THR MG 2 49 GLN HE22 . . 4.880 4.133 3.053 4.838 . 0 0 "[ . 1 . 2 . 3]" 1
1949 1 47 THR HA 1 47 THR MG . . 3.270 3.201 3.188 3.206 . 0 0 "[ . 1 . 2 . 3]" 1
1950 2 47 THR HA 2 47 THR MG . . 3.270 3.201 3.188 3.206 . 0 0 "[ . 1 . 2 . 3]" 1
1951 1 47 THR MG 1 49 GLN HB2 . . 4.520 1.979 1.885 2.222 . 0 0 "[ . 1 . 2 . 3]" 1
1952 2 47 THR MG 2 49 GLN HB2 . . 4.520 1.982 1.888 2.211 . 0 0 "[ . 1 . 2 . 3]" 1
1953 1 47 THR MG 1 49 GLN HB3 . . 4.520 3.329 2.783 3.696 . 0 0 "[ . 1 . 2 . 3]" 1
1954 2 47 THR MG 2 49 GLN HB3 . . 4.520 3.329 2.784 3.683 . 0 0 "[ . 1 . 2 . 3]" 1
1955 1 63 LYS H 1 63 LYS HB2 . . 3.680 2.329 2.127 2.517 . 0 0 "[ . 1 . 2 . 3]" 1
1956 2 63 LYS H 2 63 LYS HB2 . . 3.680 2.341 2.131 2.528 . 0 0 "[ . 1 . 2 . 3]" 1
1957 1 48 MET HA 1 48 MET HG2 . . 4.010 2.880 2.037 3.817 . 0 0 "[ . 1 . 2 . 3]" 1
1958 2 48 MET HA 2 48 MET HG2 . . 4.010 2.924 2.037 3.816 . 0 0 "[ . 1 . 2 . 3]" 1
1959 1 48 MET HA 1 48 MET HG3 . . 4.010 3.018 2.505 3.611 . 0 0 "[ . 1 . 2 . 3]" 1
1960 2 48 MET HA 2 48 MET HG3 . . 4.010 3.007 2.506 3.438 . 0 0 "[ . 1 . 2 . 3]" 1
1961 1 48 MET HA 1 48 MET ME . . 4.430 4.010 3.412 4.227 . 0 0 "[ . 1 . 2 . 3]" 1
1962 2 48 MET HA 2 48 MET ME . . 4.430 4.013 3.408 4.226 . 0 0 "[ . 1 . 2 . 3]" 1
1963 1 88 PHE HA 2 48 MET ME . . 4.020 2.178 1.894 2.661 . 0 0 "[ . 1 . 2 . 3]" 1
1964 1 48 MET ME 2 88 PHE HA . . 4.020 2.161 1.899 2.647 . 0 0 "[ . 1 . 2 . 3]" 1
1965 1 48 MET ME 1 52 GLN HE21 . . 4.480 3.326 2.372 4.381 . 0 0 "[ . 1 . 2 . 3]" 1
1966 2 48 MET ME 2 52 GLN HE21 . . 4.480 3.289 2.353 4.431 . 0 0 "[ . 1 . 2 . 3]" 1
1967 1 88 PHE HE1 2 48 MET ME . . 4.330 3.443 2.094 4.340 0.010 10 0 "[ . 1 . 2 . 3]" 1
1968 1 48 MET ME 2 88 PHE HE1 . . 4.330 3.473 2.188 4.338 0.008 10 0 "[ . 1 . 2 . 3]" 1
1969 1 48 MET ME 1 51 ALA MB . . 4.520 4.065 3.393 4.523 0.003 13 0 "[ . 1 . 2 . 3]" 1
1970 2 48 MET ME 2 51 ALA MB . . 4.520 4.051 3.471 4.520 . 0 0 "[ . 1 . 2 . 3]" 1
1971 1 48 MET ME 1 52 GLN HG3 . . 4.100 2.657 1.976 4.029 . 0 0 "[ . 1 . 2 . 3]" 1
1972 2 48 MET ME 2 52 GLN HG3 . . 4.100 2.619 1.951 3.694 . 0 0 "[ . 1 . 2 . 3]" 1
1973 1 48 MET ME 1 52 GLN HG2 . . 4.100 2.534 1.991 3.300 . 0 0 "[ . 1 . 2 . 3]" 1
1974 2 48 MET ME 2 52 GLN HG2 . . 4.100 2.508 1.974 3.327 . 0 0 "[ . 1 . 2 . 3]" 1
1975 1 49 GLN HA 1 49 GLN HG2 . . 3.880 2.483 2.089 3.024 . 0 0 "[ . 1 . 2 . 3]" 1
1976 2 49 GLN HA 2 49 GLN HG2 . . 3.880 2.483 2.088 3.022 . 0 0 "[ . 1 . 2 . 3]" 1
1977 1 49 GLN HA 1 49 GLN HG3 . . 3.880 3.100 2.530 3.548 . 0 0 "[ . 1 . 2 . 3]" 1
1978 2 49 GLN HA 2 49 GLN HG3 . . 3.880 3.101 2.534 3.549 . 0 0 "[ . 1 . 2 . 3]" 1
1979 1 51 ALA H 1 51 ALA MB . . 3.050 2.168 2.027 2.234 . 0 0 "[ . 1 . 2 . 3]" 1
1980 2 51 ALA H 2 51 ALA MB . . 3.050 2.169 2.027 2.234 . 0 0 "[ . 1 . 2 . 3]" 1
1981 1 51 ALA MB 1 54 HIS H . . 4.570 4.361 4.306 4.461 . 0 0 "[ . 1 . 2 . 3]" 1
1982 2 51 ALA MB 2 54 HIS H . . 4.570 4.367 4.308 4.462 . 0 0 "[ . 1 . 2 . 3]" 1
1983 1 84 PHE QD 2 51 ALA MB . . 3.800 2.809 2.259 3.541 . 0 0 "[ . 1 . 2 . 3]" 1
1984 1 51 ALA MB 2 84 PHE QD . . 3.800 2.626 2.192 3.354 . 0 0 "[ . 1 . 2 . 3]" 1
1985 1 84 PHE QE 2 51 ALA MB . . 3.990 2.996 2.215 3.871 . 0 0 "[ . 1 . 2 . 3]" 1
1986 1 51 ALA MB 2 84 PHE QE . . 3.990 2.805 2.156 3.691 . 0 0 "[ . 1 . 2 . 3]" 1
1987 1 48 MET HA 1 51 ALA MB . . 3.320 2.123 1.971 2.422 . 0 0 "[ . 1 . 2 . 3]" 1
1988 2 48 MET HA 2 51 ALA MB . . 3.320 2.122 1.971 2.418 . 0 0 "[ . 1 . 2 . 3]" 1
1989 1 51 ALA MB 1 52 GLN HA . . 4.220 3.743 3.628 3.801 . 0 0 "[ . 1 . 2 . 3]" 1
1990 2 51 ALA MB 2 52 GLN HA . . 4.220 3.743 3.630 3.800 . 0 0 "[ . 1 . 2 . 3]" 1
1991 1 51 ALA MB 1 52 GLN HG2 . . 4.990 4.158 3.329 4.715 . 0 0 "[ . 1 . 2 . 3]" 1
1992 2 51 ALA MB 2 52 GLN HG2 . . 4.990 4.155 3.319 4.717 . 0 0 "[ . 1 . 2 . 3]" 1
1993 1 51 ALA MB 1 54 HIS HB2 . . 5.160 4.224 4.092 4.356 . 0 0 "[ . 1 . 2 . 3]" 1
1994 2 51 ALA MB 2 54 HIS HB2 . . 5.160 4.247 4.104 4.381 . 0 0 "[ . 1 . 2 . 3]" 1
1995 1 48 MET HG2 1 51 ALA MB . . 5.020 4.040 3.057 5.022 0.002 1 0 "[ . 1 . 2 . 3]" 1
1996 2 48 MET HG2 2 51 ALA MB . . 5.020 4.071 3.060 5.029 0.009 28 0 "[ . 1 . 2 . 3]" 1
1997 1 48 MET HG3 1 51 ALA MB . . 5.020 4.201 3.231 5.018 . 0 0 "[ . 1 . 2 . 3]" 1
1998 2 48 MET HG3 2 51 ALA MB . . 5.020 4.171 3.169 4.970 . 0 0 "[ . 1 . 2 . 3]" 1
1999 1 51 ALA MB 1 52 GLN HG3 . . 4.990 4.248 3.676 4.794 . 0 0 "[ . 1 . 2 . 3]" 1
2000 2 51 ALA MB 2 52 GLN HG3 . . 4.990 4.243 3.667 4.769 . 0 0 "[ . 1 . 2 . 3]" 1
2001 1 54 HIS HB3 1 58 ILE H . . 4.800 4.478 4.231 4.758 . 0 0 "[ . 1 . 2 . 3]" 1
2002 2 54 HIS HB3 2 58 ILE H . . 4.800 4.488 4.219 4.709 . 0 0 "[ . 1 . 2 . 3]" 1
2003 1 54 HIS H 1 55 THR MG . . 4.540 4.261 3.912 4.541 0.001 3 0 "[ . 1 . 2 . 3]" 1
2004 2 54 HIS H 2 55 THR MG . . 4.540 4.265 3.919 4.541 0.001 3 0 "[ . 1 . 2 . 3]" 1
2005 1 88 PHE QD 2 55 THR MG . . 4.730 4.170 3.809 4.692 . 0 0 "[ . 1 . 2 . 3]" 1
2006 1 55 THR MG 2 88 PHE QD . . 4.730 4.171 3.794 4.686 . 0 0 "[ . 1 . 2 . 3]" 1
2007 1 88 PHE HE1 2 55 THR MG . . 4.460 3.552 2.295 4.225 . 0 0 "[ . 1 . 2 . 3]" 1
2008 1 55 THR MG 2 88 PHE HE1 . . 4.460 3.609 2.522 4.291 . 0 0 "[ . 1 . 2 . 3]" 1
2009 1 88 PHE HZ 2 55 THR MG . . 4.330 2.178 1.882 3.076 . 0 0 "[ . 1 . 2 . 3]" 1
2010 1 55 THR MG 2 88 PHE HZ . . 4.330 2.138 1.888 3.069 . 0 0 "[ . 1 . 2 . 3]" 1
2011 1 55 THR HA 1 55 THR MG . . 3.150 2.154 1.983 2.258 . 0 0 "[ . 1 . 2 . 3]" 1
2012 2 55 THR HA 2 55 THR MG . . 3.150 2.154 1.981 2.255 . 0 0 "[ . 1 . 2 . 3]" 1
2013 1 55 THR MG 1 58 ILE MD . . 3.810 2.831 2.500 3.154 . 0 0 "[ . 1 . 2 . 3]" 1
2014 2 55 THR MG 2 58 ILE MD . . 3.810 2.823 2.432 3.081 . 0 0 "[ . 1 . 2 . 3]" 1
2015 1 74 MET ME 1 74 MET HG2 . . 3.730 3.025 2.308 3.253 . 0 0 "[ . 1 . 2 . 3]" 1
2016 2 74 MET ME 2 74 MET HG2 . . 3.730 3.023 2.305 3.256 . 0 0 "[ . 1 . 2 . 3]" 1
2017 1 79 MET ME 1 79 MET HG2 . . 3.900 2.302 2.005 2.648 . 0 0 "[ . 1 . 2 . 3]" 1
2018 2 79 MET ME 2 79 MET HG2 . . 3.900 2.304 2.004 2.673 . 0 0 "[ . 1 . 2 . 3]" 1
2019 1 58 ILE HA 1 61 LEU HG . . 5.220 3.213 2.888 3.556 . 0 0 "[ . 1 . 2 . 3]" 1
2020 2 58 ILE HA 2 61 LEU HG . . 5.220 3.274 3.002 3.529 . 0 0 "[ . 1 . 2 . 3]" 1
2021 1 55 THR HA 1 58 ILE HB . . 3.990 3.135 2.891 3.476 . 0 0 "[ . 1 . 2 . 3]" 1
2022 2 55 THR HA 2 58 ILE HB . . 3.990 3.165 2.866 3.483 . 0 0 "[ . 1 . 2 . 3]" 1
2023 1 55 THR MG 1 58 ILE HB . . 4.440 4.192 3.725 4.444 0.004 29 0 "[ . 1 . 2 . 3]" 1
2024 2 55 THR MG 2 58 ILE HB . . 4.440 4.204 3.731 4.451 0.011 23 0 "[ . 1 . 2 . 3]" 1
2025 1 58 ILE HA 1 58 ILE HG12 . . 4.120 2.968 2.622 3.314 . 0 0 "[ . 1 . 2 . 3]" 1
2026 2 58 ILE HA 2 58 ILE HG12 . . 4.120 2.978 2.600 3.347 . 0 0 "[ . 1 . 2 . 3]" 1
2027 1 58 ILE H 1 58 ILE HG12 . . 3.820 3.661 3.228 3.830 0.010 29 0 "[ . 1 . 2 . 3]" 1
2028 2 58 ILE H 2 58 ILE HG12 . . 3.820 3.644 3.109 3.827 0.007 18 0 "[ . 1 . 2 . 3]" 1
2029 1 58 ILE HA 1 58 ILE HG13 . . 4.120 2.625 2.352 3.099 . 0 0 "[ . 1 . 2 . 3]" 1
2030 2 58 ILE HA 2 58 ILE HG13 . . 4.120 2.625 2.377 3.193 . 0 0 "[ . 1 . 2 . 3]" 1
2031 1 58 ILE HA 1 58 ILE MD . . 4.040 3.812 3.636 3.884 . 0 0 "[ . 1 . 2 . 3]" 1
2032 2 58 ILE HA 2 58 ILE MD . . 4.040 3.806 3.623 3.887 . 0 0 "[ . 1 . 2 . 3]" 1
2033 1 84 PHE HB2 2 58 ILE MD . . 4.240 3.606 2.651 4.157 . 0 0 "[ . 1 . 2 . 3]" 1
2034 1 58 ILE MD 2 84 PHE HB2 . . 4.240 3.600 2.635 4.171 . 0 0 "[ . 1 . 2 . 3]" 1
2035 1 84 PHE HB3 2 58 ILE MD . . 4.240 2.629 1.978 3.247 . 0 0 "[ . 1 . 2 . 3]" 1
2036 1 58 ILE MD 2 84 PHE HB3 . . 4.240 2.615 1.951 3.194 . 0 0 "[ . 1 . 2 . 3]" 1
2037 1 58 ILE HB 1 58 ILE MD . . 3.490 2.124 2.023 2.433 . 0 0 "[ . 1 . 2 . 3]" 1
2038 2 58 ILE HB 2 58 ILE MD . . 3.490 2.124 2.031 2.463 . 0 0 "[ . 1 . 2 . 3]" 1
2039 1 52 GLN HA 1 58 ILE MD . . 4.710 4.191 3.568 4.670 . 0 0 "[ . 1 . 2 . 3]" 1
2040 2 52 GLN HA 2 58 ILE MD . . 4.710 4.182 3.560 4.660 . 0 0 "[ . 1 . 2 . 3]" 1
2041 1 55 THR HA 1 58 ILE MD . . 3.670 1.973 1.878 2.335 . 0 0 "[ . 1 . 2 . 3]" 1
2042 2 55 THR HA 2 58 ILE MD . . 3.670 1.974 1.880 2.343 . 0 0 "[ . 1 . 2 . 3]" 1
2043 1 51 ALA HA 1 58 ILE MD . . 4.440 3.422 2.906 4.083 . 0 0 "[ . 1 . 2 . 3]" 1
2044 2 51 ALA HA 2 58 ILE MD . . 4.440 3.450 2.893 4.126 . 0 0 "[ . 1 . 2 . 3]" 1
2045 1 48 MET ME 1 58 ILE MD . . 5.500 5.382 4.971 5.505 0.005 28 0 "[ . 1 . 2 . 3]" 1
2046 2 48 MET ME 2 58 ILE MD . . 5.500 5.367 4.982 5.503 0.003 28 0 "[ . 1 . 2 . 3]" 1
2047 1 57 MET ME 1 58 ILE MD . . 4.070 3.726 2.846 4.076 0.006 6 0 "[ . 1 . 2 . 3]" 1
2048 2 57 MET ME 2 58 ILE MD . . 4.070 3.744 2.871 4.082 0.012 9 0 "[ . 1 . 2 . 3]" 1
2049 1 51 ALA MB 1 58 ILE MD . . 3.500 2.643 2.275 3.149 . 0 0 "[ . 1 . 2 . 3]" 1
2050 2 51 ALA MB 2 58 ILE MD . . 3.500 2.658 2.279 3.158 . 0 0 "[ . 1 . 2 . 3]" 1
2051 1 88 PHE QD 2 58 ILE MD . . 4.340 3.898 3.220 4.344 0.004 19 0 "[ . 1 . 2 . 3]" 1
2052 1 58 ILE MD 2 88 PHE QD . . 4.340 3.900 3.225 4.342 0.002 19 0 "[ . 1 . 2 . 3]" 1
2053 1 84 PHE QD 2 58 ILE MD . . 3.990 3.272 2.546 3.716 . 0 0 "[ . 1 . 2 . 3]" 1
2054 1 58 ILE MD 2 84 PHE QD . . 3.990 3.209 2.466 3.707 . 0 0 "[ . 1 . 2 . 3]" 1
2055 1 88 PHE HZ 2 58 ILE MD . . 3.980 2.462 1.917 3.297 . 0 0 "[ . 1 . 2 . 3]" 1
2056 1 58 ILE MD 2 88 PHE HZ . . 3.980 2.535 1.924 3.558 . 0 0 "[ . 1 . 2 . 3]" 1
2057 1 52 GLN H 1 58 ILE MD . . 5.240 4.850 4.526 5.094 . 0 0 "[ . 1 . 2 . 3]" 1
2058 2 52 GLN H 2 58 ILE MD . . 5.240 4.857 4.463 5.110 . 0 0 "[ . 1 . 2 . 3]" 1
2059 1 58 ILE MD 1 59 THR H . . 5.500 4.149 3.862 4.584 . 0 0 "[ . 1 . 2 . 3]" 1
2060 2 58 ILE MD 2 59 THR H . . 5.500 4.136 3.810 4.614 . 0 0 "[ . 1 . 2 . 3]" 1
2061 1 58 ILE HA 1 58 ILE MG . . 3.250 2.344 2.267 2.401 . 0 0 "[ . 1 . 2 . 3]" 1
2062 2 58 ILE HA 2 58 ILE MG . . 3.250 2.342 2.261 2.398 . 0 0 "[ . 1 . 2 . 3]" 1
2063 1 84 PHE HB2 2 58 ILE MG . . 4.360 2.594 2.317 2.852 . 0 0 "[ . 1 . 2 . 3]" 1
2064 1 58 ILE MG 2 84 PHE HB2 . . 4.360 2.559 2.264 2.813 . 0 0 "[ . 1 . 2 . 3]" 1
2065 1 84 PHE HB3 2 58 ILE MG . . 4.360 2.950 2.297 3.431 . 0 0 "[ . 1 . 2 . 3]" 1
2066 1 58 ILE MG 2 84 PHE HB3 . . 4.360 2.901 2.296 3.409 . 0 0 "[ . 1 . 2 . 3]" 1
2067 1 58 ILE MG 1 61 LEU HG . . 5.180 4.675 4.369 4.902 . 0 0 "[ . 1 . 2 . 3]" 1
2068 2 58 ILE MG 2 61 LEU HG . . 5.180 4.736 4.488 4.936 . 0 0 "[ . 1 . 2 . 3]" 1
2069 1 58 ILE HG12 1 58 ILE MG . . 3.620 2.175 1.963 2.392 . 0 0 "[ . 1 . 2 . 3]" 1
2070 2 58 ILE HG12 2 58 ILE MG . . 3.620 2.176 1.967 2.397 . 0 0 "[ . 1 . 2 . 3]" 1
2071 1 58 ILE HG13 1 58 ILE MG . . 3.620 3.070 2.872 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
2072 2 58 ILE HG13 2 58 ILE MG . . 3.620 3.065 2.847 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
2073 1 58 ILE MD 1 58 ILE MG . . 2.980 2.542 1.928 2.947 . 0 0 "[ . 1 . 2 . 3]" 1
2074 2 58 ILE MD 2 58 ILE MG . . 2.980 2.552 1.904 2.974 . 0 0 "[ . 1 . 2 . 3]" 1
2075 1 85 LYS HA 2 58 ILE MG . . 4.950 4.455 4.186 4.782 . 0 0 "[ . 1 . 2 . 3]" 1
2076 1 58 ILE MG 2 85 LYS HA . . 4.950 4.488 4.217 4.789 . 0 0 "[ . 1 . 2 . 3]" 1
2077 1 55 THR HA 1 58 ILE MG . . 4.720 4.410 4.192 4.727 0.007 29 0 "[ . 1 . 2 . 3]" 1
2078 2 55 THR HA 2 58 ILE MG . . 4.720 4.433 4.189 4.729 0.009 29 0 "[ . 1 . 2 . 3]" 1
2079 1 81 TYR QE 2 58 ILE MG . . 3.710 3.311 2.420 3.732 0.022 21 0 "[ . 1 . 2 . 3]" 1
2080 1 58 ILE MG 2 81 TYR QE . . 3.710 3.287 2.544 3.732 0.022 29 0 "[ . 1 . 2 . 3]" 1
2081 1 84 PHE QD 2 58 ILE MG . . 3.960 2.809 1.973 3.329 . 0 0 "[ . 1 . 2 . 3]" 1
2082 1 58 ILE MG 2 84 PHE QD . . 3.960 2.871 2.048 3.250 . 0 0 "[ . 1 . 2 . 3]" 1
2083 1 81 TYR QD 2 58 ILE MG . . 3.470 2.603 1.988 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
2084 1 58 ILE MG 2 81 TYR QD . . 3.470 2.576 2.152 3.175 . 0 0 "[ . 1 . 2 . 3]" 1
2085 1 84 PHE QE 2 58 ILE MG . . 5.150 4.466 3.687 4.816 . 0 0 "[ . 1 . 2 . 3]" 1
2086 1 58 ILE MG 2 84 PHE QE . . 5.150 4.453 3.637 4.751 . 0 0 "[ . 1 . 2 . 3]" 1
2087 1 88 PHE HZ 2 58 ILE MG . . 5.500 4.716 3.919 5.452 . 0 0 "[ . 1 . 2 . 3]" 1
2088 1 58 ILE MG 2 88 PHE HZ . . 5.500 4.747 3.978 5.499 . 0 0 "[ . 1 . 2 . 3]" 1
2089 1 58 ILE MG 1 61 LEU H . . 4.650 4.363 4.159 4.535 . 0 0 "[ . 1 . 2 . 3]" 1
2090 2 58 ILE MG 2 61 LEU H . . 4.650 4.382 4.181 4.567 . 0 0 "[ . 1 . 2 . 3]" 1
2091 1 58 ILE MG 1 62 LYS H . . 4.900 4.231 3.922 4.502 . 0 0 "[ . 1 . 2 . 3]" 1
2092 2 58 ILE MG 2 62 LYS H . . 4.900 4.229 3.941 4.513 . 0 0 "[ . 1 . 2 . 3]" 1
2093 1 84 PHE H 2 58 ILE MG . . 5.280 4.410 4.151 4.593 . 0 0 "[ . 1 . 2 . 3]" 1
2094 1 58 ILE MG 2 84 PHE H . . 5.280 4.379 4.059 4.606 . 0 0 "[ . 1 . 2 . 3]" 1
2095 1 58 ILE MG 1 59 THR H . . 4.210 3.501 3.363 3.704 . 0 0 "[ . 1 . 2 . 3]" 1
2096 2 58 ILE MG 2 59 THR H . . 4.210 3.501 3.340 3.711 . 0 0 "[ . 1 . 2 . 3]" 1
2097 1 88 PHE QD 2 58 ILE MG . . 4.600 4.184 3.218 4.609 0.009 13 0 "[ . 1 . 2 . 3]" 1
2098 1 58 ILE MG 2 88 PHE QD . . 4.600 4.203 3.271 4.607 0.007 9 0 "[ . 1 . 2 . 3]" 1
2099 1 59 THR H 1 59 THR MG . . 3.960 3.746 3.652 3.768 . 0 0 "[ . 1 . 2 . 3]" 1
2100 2 59 THR H 2 59 THR MG . . 3.960 3.746 3.650 3.768 . 0 0 "[ . 1 . 2 . 3]" 1
2101 1 59 THR MG 1 60 THR H . . 4.020 3.677 3.386 4.017 . 0 0 "[ . 1 . 2 . 3]" 1
2102 2 59 THR MG 2 60 THR H . . 4.020 3.677 3.388 4.003 . 0 0 "[ . 1 . 2 . 3]" 1
2103 1 59 THR HA 1 59 THR MG . . 2.980 2.272 2.044 2.402 . 0 0 "[ . 1 . 2 . 3]" 1
2104 2 59 THR HA 2 59 THR MG . . 2.980 2.272 2.045 2.402 . 0 0 "[ . 1 . 2 . 3]" 1
2105 1 52 GLN HA 1 55 THR MG . . 3.450 2.312 2.052 2.466 . 0 0 "[ . 1 . 2 . 3]" 1
2106 2 52 GLN HA 2 55 THR MG . . 3.450 2.293 2.037 2.449 . 0 0 "[ . 1 . 2 . 3]" 1
2107 1 59 THR MG 1 63 LYS QE . . 4.170 3.008 1.870 4.167 . 0 0 "[ . 1 . 2 . 3]" 1
2108 2 59 THR MG 2 63 LYS QE . . 4.170 2.896 1.868 4.165 . 0 0 "[ . 1 . 2 . 3]" 1
2109 1 59 THR MG 1 63 LYS QD . . 4.990 4.085 2.979 4.992 0.002 4 0 "[ . 1 . 2 . 3]" 1
2110 2 59 THR MG 2 63 LYS QD . . 4.990 4.083 2.974 4.995 0.005 22 0 "[ . 1 . 2 . 3]" 1
2111 1 60 THR H 1 60 THR MG . . 3.990 3.768 3.759 3.778 . 0 0 "[ . 1 . 2 . 3]" 1
2112 2 60 THR H 2 60 THR MG . . 3.990 3.768 3.764 3.778 . 0 0 "[ . 1 . 2 . 3]" 1
2113 1 60 THR MG 1 61 LEU H . . 3.970 3.573 3.435 3.647 . 0 0 "[ . 1 . 2 . 3]" 1
2114 2 60 THR MG 2 61 LEU H . . 3.970 3.567 3.444 3.636 . 0 0 "[ . 1 . 2 . 3]" 1
2115 1 60 THR MG 1 64 ILE H . . 4.560 3.543 3.408 3.730 . 0 0 "[ . 1 . 2 . 3]" 1
2116 2 60 THR MG 2 64 ILE H . . 4.560 3.558 3.391 3.760 . 0 0 "[ . 1 . 2 . 3]" 1
2117 1 17 HIS HD2 1 60 THR MG . . 3.560 3.226 2.912 3.497 . 0 0 "[ . 1 . 2 . 3]" 1
2118 2 17 HIS HD2 2 60 THR MG . . 3.560 3.236 2.885 3.506 . 0 0 "[ . 1 . 2 . 3]" 1
2119 1 60 THR HA 1 60 THR MG . . 3.280 2.334 2.289 2.385 . 0 0 "[ . 1 . 2 . 3]" 1
2120 2 60 THR HA 2 60 THR MG . . 3.280 2.333 2.289 2.400 . 0 0 "[ . 1 . 2 . 3]" 1
2121 1 57 MET HA 1 60 THR MG . . 4.880 4.600 4.380 4.861 . 0 0 "[ . 1 . 2 . 3]" 1
2122 2 57 MET HA 2 60 THR MG . . 4.880 4.576 4.386 4.871 . 0 0 "[ . 1 . 2 . 3]" 1
2123 1 60 THR MG 1 63 LYS QD . . 5.500 4.704 3.416 5.504 0.004 12 0 "[ . 1 . 2 . 3]" 1
2124 2 60 THR MG 2 63 LYS QD . . 5.500 4.709 3.474 5.501 0.001 12 0 "[ . 1 . 2 . 3]" 1
2125 1 60 THR MG 1 64 ILE MG . . 2.890 2.235 2.068 2.339 . 0 0 "[ . 1 . 2 . 3]" 1
2126 2 60 THR MG 2 64 ILE MG . . 2.890 2.255 2.074 2.393 . 0 0 "[ . 1 . 2 . 3]" 1
2127 1 60 THR MG 1 64 ILE MD . . 3.470 3.284 3.103 3.375 . 0 0 "[ . 1 . 2 . 3]" 1
2128 2 60 THR MG 2 64 ILE MD . . 3.470 3.287 3.112 3.375 . 0 0 "[ . 1 . 2 . 3]" 1
2129 1 81 TYR HA 2 61 LEU MD1 . . 4.500 2.889 2.728 3.126 . 0 0 "[ . 1 . 2 . 3]" 1
2130 1 61 LEU MD1 2 81 TYR HA . . 4.500 2.858 2.631 3.155 . 0 0 "[ . 1 . 2 . 3]" 1
2131 1 61 LEU HA 1 61 LEU MD1 . . 4.150 3.884 3.845 3.910 . 0 0 "[ . 1 . 2 . 3]" 1
2132 2 61 LEU HA 2 61 LEU MD1 . . 4.150 3.883 3.846 3.901 . 0 0 "[ . 1 . 2 . 3]" 1
2133 1 58 ILE HA 1 61 LEU MD1 . . 4.770 1.973 1.907 2.084 . 0 0 "[ . 1 . 2 . 3]" 1
2134 2 58 ILE HA 2 61 LEU MD1 . . 4.770 1.974 1.904 2.108 . 0 0 "[ . 1 . 2 . 3]" 1
2135 1 80 LEU HB3 2 61 LEU MD2 . . 5.290 3.145 2.874 3.365 . 0 0 "[ . 1 . 2 . 3]" 1
2136 1 61 LEU MD2 2 80 LEU HB3 . . 5.290 3.165 2.882 3.408 . 0 0 "[ . 1 . 2 . 3]" 1
2137 1 58 ILE HA 1 61 LEU MD2 . . 4.770 4.324 4.204 4.441 . 0 0 "[ . 1 . 2 . 3]" 1
2138 2 58 ILE HA 2 61 LEU MD2 . . 4.770 4.353 4.232 4.436 . 0 0 "[ . 1 . 2 . 3]" 1
2139 1 81 TYR HA 2 61 LEU MD2 . . 4.500 4.495 4.392 4.523 0.023 14 0 "[ . 1 . 2 . 3]" 1
2140 1 61 LEU MD2 2 81 TYR HA . . 4.500 4.502 4.440 4.538 0.038 18 0 "[ . 1 . 2 . 3]" 1
2141 1 61 LEU HA 1 61 LEU MD2 . . 4.150 2.247 2.064 2.511 . 0 0 "[ . 1 . 2 . 3]" 1
2142 2 61 LEU HA 2 61 LEU MD2 . . 4.150 2.264 2.135 2.512 . 0 0 "[ . 1 . 2 . 3]" 1
2143 1 81 TYR QD 2 62 LYS HB3 . . 4.820 4.375 2.099 4.800 . 0 0 "[ . 1 . 2 . 3]" 1
2144 1 62 LYS HB3 2 81 TYR QD . . 4.820 4.431 3.457 4.824 0.004 30 0 "[ . 1 . 2 . 3]" 1
2145 1 63 LYS H 1 63 LYS HB3 . . 3.680 3.553 3.421 3.608 . 0 0 "[ . 1 . 2 . 3]" 1
2146 2 63 LYS H 2 63 LYS HB3 . . 3.680 3.558 3.425 3.608 . 0 0 "[ . 1 . 2 . 3]" 1
2147 1 65 ARG H 1 65 ARG HG3 . . 4.250 3.949 3.928 3.985 . 0 0 "[ . 1 . 2 . 3]" 1
2148 2 65 ARG H 2 65 ARG HG3 . . 4.250 3.946 3.923 3.992 . 0 0 "[ . 1 . 2 . 3]" 1
2149 1 64 ILE H 1 64 ILE HB . . 4.150 3.618 3.615 3.623 . 0 0 "[ . 1 . 2 . 3]" 1
2150 2 64 ILE H 2 64 ILE HB . . 4.150 3.618 3.615 3.621 . 0 0 "[ . 1 . 2 . 3]" 1
2151 1 64 ILE HB 1 65 ARG H . . 4.630 4.235 4.202 4.252 . 0 0 "[ . 1 . 2 . 3]" 1
2152 2 64 ILE HB 2 65 ARG H . . 4.630 4.237 4.225 4.251 . 0 0 "[ . 1 . 2 . 3]" 1
2153 1 24 LEU MD1 1 64 ILE HB . . 5.500 3.572 3.391 3.857 . 0 0 "[ . 1 . 2 . 3]" 1
2154 2 24 LEU MD1 2 64 ILE HB . . 5.500 3.578 3.393 3.715 . 0 0 "[ . 1 . 2 . 3]" 1
2155 1 77 SER HA 2 64 ILE MD . . 4.570 2.993 2.899 3.118 . 0 0 "[ . 1 . 2 . 3]" 1
2156 1 64 ILE MD 2 77 SER HA . . 4.570 2.984 2.893 3.123 . 0 0 "[ . 1 . 2 . 3]" 1
2157 1 61 LEU HA 1 64 ILE MD . . 3.750 2.002 1.939 2.036 . 0 0 "[ . 1 . 2 . 3]" 1
2158 2 61 LEU HA 2 64 ILE MD . . 3.750 2.003 1.951 2.033 . 0 0 "[ . 1 . 2 . 3]" 1
2159 1 77 SER HB2 2 64 ILE MD . . 4.070 1.962 1.939 2.019 . 0 0 "[ . 1 . 2 . 3]" 1
2160 1 64 ILE MD 2 77 SER HB2 . . 4.070 1.960 1.934 2.014 . 0 0 "[ . 1 . 2 . 3]" 1
2161 1 77 SER HB3 2 64 ILE MD . . 4.070 2.019 1.986 2.054 . 0 0 "[ . 1 . 2 . 3]" 1
2162 1 64 ILE MD 2 77 SER HB3 . . 4.070 2.016 1.979 2.055 . 0 0 "[ . 1 . 2 . 3]" 1
2163 1 64 ILE HA 1 64 ILE MD . . 4.300 4.181 4.180 4.182 . 0 0 "[ . 1 . 2 . 3]" 1
2164 2 64 ILE HA 2 64 ILE MD . . 4.300 4.181 4.180 4.182 . 0 0 "[ . 1 . 2 . 3]" 1
2165 1 64 ILE HB 1 64 ILE MD . . 3.430 2.410 2.393 2.442 . 0 0 "[ . 1 . 2 . 3]" 1
2166 2 64 ILE HB 2 64 ILE MD . . 3.430 2.410 2.396 2.434 . 0 0 "[ . 1 . 2 . 3]" 1
2167 1 38 LEU HG 1 64 ILE MD . . 4.360 4.225 3.985 4.372 0.012 7 0 "[ . 1 . 2 . 3]" 1
2168 2 38 LEU HG 2 64 ILE MD . . 4.360 4.228 3.981 4.362 0.002 9 0 "[ . 1 . 2 . 3]" 1
2169 1 64 ILE MD 1 65 ARG QB . . 5.210 4.862 4.807 4.911 . 0 0 "[ . 1 . 2 . 3]" 1
2170 2 64 ILE MD 2 65 ARG QB . . 5.210 4.869 4.813 4.900 . 0 0 "[ . 1 . 2 . 3]" 1
2171 1 76 LYS QB 2 64 ILE MD . . 5.500 4.802 4.712 4.899 . 0 0 "[ . 1 . 2 . 3]" 1
2172 1 64 ILE MD 2 76 LYS QB . . 5.500 4.796 4.679 4.877 . 0 0 "[ . 1 . 2 . 3]" 1
2173 1 64 ILE MD 1 64 ILE MG . . 3.080 1.919 1.908 1.930 . 0 0 "[ . 1 . 2 . 3]" 1
2174 2 64 ILE MD 2 64 ILE MG . . 3.080 1.920 1.909 1.929 . 0 0 "[ . 1 . 2 . 3]" 1
2175 1 64 ILE MG 1 67 PHE QD . . 4.380 3.539 3.237 3.969 . 0 0 "[ . 1 . 2 . 3]" 1
2176 2 64 ILE MG 2 67 PHE QD . . 4.380 3.597 3.326 3.895 . 0 0 "[ . 1 . 2 . 3]" 1
2177 1 64 ILE MG 1 67 PHE QE . . 4.970 4.454 4.215 4.838 . 0 0 "[ . 1 . 2 . 3]" 1
2178 2 64 ILE MG 2 67 PHE QE . . 4.970 4.465 4.273 4.808 . 0 0 "[ . 1 . 2 . 3]" 1
2179 1 64 ILE MG 1 67 PHE HB2 . . 4.770 4.058 3.786 4.158 . 0 0 "[ . 1 . 2 . 3]" 1
2180 2 64 ILE MG 2 67 PHE HB2 . . 4.770 4.084 3.871 4.254 . 0 0 "[ . 1 . 2 . 3]" 1
2181 1 64 ILE MG 1 67 PHE HB3 . . 4.770 3.543 3.513 3.650 . 0 0 "[ . 1 . 2 . 3]" 1
2182 2 64 ILE MG 2 67 PHE HB3 . . 4.770 3.531 3.496 3.623 . 0 0 "[ . 1 . 2 . 3]" 1
2183 1 64 ILE HA 1 64 ILE MG . . 3.150 2.280 2.259 2.293 . 0 0 "[ . 1 . 2 . 3]" 1
2184 2 64 ILE HA 2 64 ILE MG . . 3.150 2.278 2.267 2.290 . 0 0 "[ . 1 . 2 . 3]" 1
2185 1 64 ILE HG12 1 64 ILE MG . . 3.570 2.331 2.324 2.340 . 0 0 "[ . 1 . 2 . 3]" 1
2186 2 64 ILE HG12 2 64 ILE MG . . 3.570 2.330 2.324 2.340 . 0 0 "[ . 1 . 2 . 3]" 1
2187 1 64 ILE HG13 1 64 ILE MG . . 3.570 3.186 3.185 3.187 . 0 0 "[ . 1 . 2 . 3]" 1
2188 2 64 ILE HG13 2 64 ILE MG . . 3.570 3.186 3.185 3.187 . 0 0 "[ . 1 . 2 . 3]" 1
2189 1 20 ILE MG 1 24 LEU MD2 . . 3.960 3.202 2.953 3.403 . 0 0 "[ . 1 . 2 . 3]" 1
2190 2 20 ILE MG 2 24 LEU MD2 . . 3.960 3.204 2.951 3.394 . 0 0 "[ . 1 . 2 . 3]" 1
2191 1 24 LEU MD2 1 64 ILE MG . . 4.440 3.795 3.632 3.955 . 0 0 "[ . 1 . 2 . 3]" 1
2192 2 24 LEU MD2 2 64 ILE MG . . 4.440 3.800 3.614 3.993 . 0 0 "[ . 1 . 2 . 3]" 1
2193 1 73 ILE H 1 73 ILE HG12 . . 4.440 3.591 3.378 3.847 . 0 0 "[ . 1 . 2 . 3]" 1
2194 2 73 ILE H 2 73 ILE HG12 . . 4.440 3.581 3.311 3.852 . 0 0 "[ . 1 . 2 . 3]" 1
2195 1 66 ARG H 1 66 ARG HG2 . . 4.180 3.436 3.208 3.535 . 0 0 "[ . 1 . 2 . 3]" 1
2196 2 66 ARG H 2 66 ARG HG2 . . 4.180 3.459 3.207 3.543 . 0 0 "[ . 1 . 2 . 3]" 1
2197 1 9 MET HA 1 12 ARG HG3 . . 4.120 3.229 3.127 3.436 . 0 0 "[ . 1 . 2 . 3]" 1
2198 1 67 PHE HA 1 67 PHE QD . . 4.260 2.925 2.502 3.115 . 0 0 "[ . 1 . 2 . 3]" 1
2199 2 67 PHE HA 2 67 PHE QD . . 4.260 3.000 2.822 3.146 . 0 0 "[ . 1 . 2 . 3]" 1
2200 1 88 PHE HA 1 88 PHE QD . . 3.770 2.566 2.066 3.024 . 0 0 "[ . 1 . 2 . 3]" 1
2201 2 88 PHE HA 2 88 PHE QD . . 3.770 2.576 2.054 3.020 . 0 0 "[ . 1 . 2 . 3]" 1
2202 1 64 ILE HA 1 67 PHE QD . . 4.720 2.828 2.478 3.491 . 0 0 "[ . 1 . 2 . 3]" 1
2203 2 64 ILE HA 2 67 PHE QD . . 4.720 2.838 2.514 3.326 . 0 0 "[ . 1 . 2 . 3]" 1
2204 1 26 ILE HA 2 67 PHE QD . . 4.850 3.373 3.116 3.790 . 0 0 "[ . 1 . 2 . 3]" 1
2205 1 67 PHE QD 2 26 ILE HA . . 4.850 3.482 3.049 3.892 . 0 0 "[ . 1 . 2 . 3]" 1
2206 1 85 LYS HA 1 88 PHE QD . . 5.100 3.297 1.995 4.081 . 0 0 "[ . 1 . 2 . 3]" 1
2207 2 85 LYS HA 2 88 PHE QD . . 5.100 3.327 1.994 4.097 . 0 0 "[ . 1 . 2 . 3]" 1
2208 1 84 PHE HA 1 88 PHE QD . . 4.820 4.088 3.605 4.684 . 0 0 "[ . 1 . 2 . 3]" 1
2209 2 84 PHE HA 2 88 PHE QD . . 4.820 4.065 3.500 4.697 . 0 0 "[ . 1 . 2 . 3]" 1
2210 1 48 MET ME 2 88 PHE QD . . 4.370 2.801 1.914 3.445 . 0 0 "[ . 1 . 2 . 3]" 1
2211 1 88 PHE QD 2 48 MET ME . . 4.370 2.795 1.918 3.782 . 0 0 "[ . 1 . 2 . 3]" 1
2212 1 29 LEU MD1 2 67 PHE QD . . 4.670 2.033 1.923 2.217 . 0 0 "[ . 1 . 2 . 3]" 1
2213 1 67 PHE QD 2 29 LEU MD1 . . 4.670 2.021 1.923 2.199 . 0 0 "[ . 1 . 2 . 3]" 1
2214 1 68 LYS HA 1 68 LYS QG . . 3.710 2.895 2.511 3.339 . 0 0 "[ . 1 . 2 . 3]" 1
2215 2 68 LYS HA 2 68 LYS QG . . 3.710 2.888 2.482 3.340 . 0 0 "[ . 1 . 2 . 3]" 1
2216 1 67 PHE QE 2 69 VAL HB . . 4.630 3.043 1.963 4.712 0.082 11 0 "[ . 1 . 2 . 3]" 1
2217 1 69 VAL HB 2 67 PHE QE . . 4.630 2.946 1.958 4.704 0.074 17 0 "[ . 1 . 2 . 3]" 1
2218 1 69 VAL H 1 69 VAL MG2 . . 4.000 3.105 1.910 3.779 . 0 0 "[ . 1 . 2 . 3]" 1
2219 2 69 VAL H 2 69 VAL MG2 . . 4.000 3.056 1.926 3.894 . 0 0 "[ . 1 . 2 . 3]" 1
2220 1 67 PHE QD 2 69 VAL MG1 . . 4.310 2.265 1.864 2.836 . 0 0 "[ . 1 . 2 . 3]" 1
2221 1 69 VAL MG1 2 67 PHE QD . . 4.310 2.251 1.868 2.845 . 0 0 "[ . 1 . 2 . 3]" 1
2222 1 67 PHE QE 2 69 VAL MG1 . . 3.750 2.716 1.845 3.677 . 0 0 "[ . 1 . 2 . 3]" 1
2223 1 69 VAL MG1 2 67 PHE QE . . 3.750 2.731 1.844 3.619 . 0 0 "[ . 1 . 2 . 3]" 1
2224 1 67 PHE QD 2 69 VAL MG2 . . 4.310 3.098 2.389 3.559 . 0 0 "[ . 1 . 2 . 3]" 1
2225 1 69 VAL MG2 2 67 PHE QD . . 4.310 3.125 2.041 3.567 . 0 0 "[ . 1 . 2 . 3]" 1
2226 1 67 PHE QE 2 69 VAL MG2 . . 3.750 3.358 3.000 3.807 0.057 11 0 "[ . 1 . 2 . 3]" 1
2227 1 69 VAL MG2 2 67 PHE QE . . 3.750 3.333 3.027 3.863 0.113 17 0 "[ . 1 . 2 . 3]" 1
2228 1 69 VAL HA 1 69 VAL MG2 . . 3.350 2.617 2.176 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
2229 2 69 VAL HA 2 69 VAL MG2 . . 3.350 2.640 2.176 3.186 . 0 0 "[ . 1 . 2 . 3]" 1
2230 1 69 VAL HA 1 69 VAL MG1 . . 3.350 2.848 2.173 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
2231 2 69 VAL HA 2 69 VAL MG1 . . 3.350 2.818 2.208 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
2232 1 72 VAL HB 1 73 ILE H . . 4.080 3.857 2.373 3.990 . 0 0 "[ . 1 . 2 . 3]" 1
2233 2 72 VAL HB 2 73 ILE H . . 4.080 3.857 2.363 4.005 . 0 0 "[ . 1 . 2 . 3]" 1
2234 1 35 ILE MD 2 72 VAL HB . . 4.480 4.347 3.049 4.487 0.007 17 0 "[ . 1 . 2 . 3]" 1
2235 1 72 VAL HB 2 35 ILE MD . . 4.480 4.352 3.035 4.486 0.006 8 0 "[ . 1 . 2 . 3]" 1
2236 1 46 VAL H 1 46 VAL MG2 . . 4.270 3.589 1.941 3.782 . 0 0 "[ . 1 . 2 . 3]" 1
2237 2 46 VAL H 2 46 VAL MG2 . . 4.270 3.534 1.931 3.783 . 0 0 "[ . 1 . 2 . 3]" 1
2238 1 72 VAL MG2 1 73 ILE H . . 4.160 3.490 3.364 3.870 . 0 0 "[ . 1 . 2 . 3]" 1
2239 2 72 VAL MG2 2 73 ILE H . . 4.160 3.491 3.368 3.869 . 0 0 "[ . 1 . 2 . 3]" 1
2240 1 72 VAL HA 1 72 VAL MG2 . . 3.260 2.351 2.275 2.418 . 0 0 "[ . 1 . 2 . 3]" 1
2241 2 72 VAL HA 2 72 VAL MG2 . . 3.260 2.351 2.277 2.421 . 0 0 "[ . 1 . 2 . 3]" 1
2242 1 72 VAL HA 1 72 VAL MG1 . . 3.260 3.144 2.381 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
2243 2 72 VAL HA 2 72 VAL MG1 . . 3.260 3.144 2.380 3.201 . 0 0 "[ . 1 . 2 . 3]" 1
2244 1 35 ILE HG12 2 72 VAL MG2 . . 5.070 2.282 1.990 4.148 . 0 0 "[ . 1 . 2 . 3]" 1
2245 1 72 VAL MG2 2 35 ILE HG12 . . 5.070 2.289 2.031 4.157 . 0 0 "[ . 1 . 2 . 3]" 1
2246 1 35 ILE HG12 2 72 VAL MG1 . . 5.070 2.596 1.998 2.872 . 0 0 "[ . 1 . 2 . 3]" 1
2247 1 72 VAL MG1 2 35 ILE HG12 . . 5.070 2.595 2.075 2.868 . 0 0 "[ . 1 . 2 . 3]" 1
2248 1 73 ILE HA 1 77 SER H . . 5.500 3.910 3.780 4.142 . 0 0 "[ . 1 . 2 . 3]" 1
2249 2 73 ILE HA 2 77 SER H . . 5.500 3.918 3.808 4.098 . 0 0 "[ . 1 . 2 . 3]" 1
2250 1 73 ILE HA 1 73 ILE HG12 . . 4.080 2.581 2.500 2.780 . 0 0 "[ . 1 . 2 . 3]" 1
2251 2 73 ILE HA 2 73 ILE HG12 . . 4.080 2.581 2.365 2.782 . 0 0 "[ . 1 . 2 . 3]" 1
2252 1 73 ILE HA 1 76 LYS QB . . 4.380 2.704 2.278 3.095 . 0 0 "[ . 1 . 2 . 3]" 1
2253 2 73 ILE HA 2 76 LYS QB . . 4.380 2.710 2.277 2.941 . 0 0 "[ . 1 . 2 . 3]" 1
2254 1 73 ILE HA 1 73 ILE HG13 . . 4.080 2.884 2.622 2.990 . 0 0 "[ . 1 . 2 . 3]" 1
2255 2 73 ILE HA 2 73 ILE HG13 . . 4.080 2.891 2.618 3.200 . 0 0 "[ . 1 . 2 . 3]" 1
2256 1 31 VAL HA 2 73 ILE MD . . 3.370 2.507 2.386 2.616 . 0 0 "[ . 1 . 2 . 3]" 1
2257 1 73 ILE MD 2 31 VAL HA . . 3.370 2.515 2.391 2.643 . 0 0 "[ . 1 . 2 . 3]" 1
2258 1 70 SER HB2 1 73 ILE MD . . 4.130 3.514 2.590 4.128 . 0 0 "[ . 1 . 2 . 3]" 1
2259 2 70 SER HB2 2 73 ILE MD . . 4.130 3.512 2.403 4.135 0.005 9 0 "[ . 1 . 2 . 3]" 1
2260 1 69 VAL HA 1 73 ILE MD . . 4.640 3.048 2.543 3.357 . 0 0 "[ . 1 . 2 . 3]" 1
2261 2 69 VAL HA 2 73 ILE MD . . 4.640 3.028 2.639 3.357 . 0 0 "[ . 1 . 2 . 3]" 1
2262 1 70 SER HB3 1 73 ILE MD . . 4.130 3.183 2.701 4.138 0.008 4 0 "[ . 1 . 2 . 3]" 1
2263 2 70 SER HB3 2 73 ILE MD . . 4.130 3.193 2.802 4.131 0.001 29 0 "[ . 1 . 2 . 3]" 1
2264 1 34 CYS HB2 2 73 ILE MD . . 4.140 2.933 2.603 3.235 . 0 0 "[ . 1 . 2 . 3]" 1
2265 1 73 ILE MD 2 34 CYS HB2 . . 4.140 2.925 2.730 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
2266 1 34 CYS HB3 2 73 ILE MD . . 4.140 2.110 1.883 2.389 . 0 0 "[ . 1 . 2 . 3]" 1
2267 1 73 ILE MD 2 34 CYS HB3 . . 4.140 2.111 1.967 2.492 . 0 0 "[ . 1 . 2 . 3]" 1
2268 1 73 ILE HB 1 73 ILE MD . . 3.580 2.371 2.282 2.404 . 0 0 "[ . 1 . 2 . 3]" 1
2269 2 73 ILE HB 2 73 ILE MD . . 3.580 2.373 2.242 2.566 . 0 0 "[ . 1 . 2 . 3]" 1
2270 1 31 VAL HB 2 73 ILE MD . . 3.810 1.931 1.880 2.031 . 0 0 "[ . 1 . 2 . 3]" 1
2271 1 73 ILE MD 2 31 VAL HB . . 3.810 1.930 1.878 2.030 . 0 0 "[ . 1 . 2 . 3]" 1
2272 1 24 LEU MD1 2 73 ILE MD . . 4.310 3.822 3.471 3.976 . 0 0 "[ . 1 . 2 . 3]" 1
2273 1 73 ILE MD 2 24 LEU MD1 . . 4.310 3.812 3.552 4.040 . 0 0 "[ . 1 . 2 . 3]" 1
2274 1 34 CYS H 2 73 ILE MD . . 4.700 4.098 3.768 4.348 . 0 0 "[ . 1 . 2 . 3]" 1
2275 1 73 ILE MD 2 34 CYS H . . 4.700 4.096 3.782 4.414 . 0 0 "[ . 1 . 2 . 3]" 1
2276 1 67 PHE QE 2 73 ILE MD . . 5.000 4.920 4.564 5.071 0.071 11 0 "[ . 1 . 2 . 3]" 1
2277 1 73 ILE MD 2 67 PHE QE . . 5.000 4.942 4.610 5.064 0.064 15 0 "[ . 1 . 2 . 3]" 1
2278 1 35 ILE H 2 73 ILE MD . . 4.130 3.661 3.307 3.963 . 0 0 "[ . 1 . 2 . 3]" 1
2279 1 73 ILE MD 2 35 ILE H . . 4.130 3.656 3.212 4.140 0.010 6 0 "[ . 1 . 2 . 3]" 1
2280 1 73 ILE H 1 73 ILE MG . . 4.300 3.759 3.734 3.768 . 0 0 "[ . 1 . 2 . 3]" 1
2281 2 73 ILE H 2 73 ILE MG . . 4.300 3.759 3.733 3.769 . 0 0 "[ . 1 . 2 . 3]" 1
2282 1 67 PHE QD 2 73 ILE MG . . 4.980 4.830 4.545 5.004 0.024 20 0 "[ . 1 . 2 . 3]" 1
2283 1 73 ILE MG 2 67 PHE QD . . 4.980 4.872 4.577 5.009 0.029 5 0 "[ . 1 . 2 . 3]" 1
2284 1 67 PHE QE 2 73 ILE MG . . 5.260 5.098 4.517 5.290 0.030 14 0 "[ . 1 . 2 . 3]" 1
2285 1 73 ILE MG 2 67 PHE QE . . 5.260 5.112 4.568 5.346 0.086 15 0 "[ . 1 . 2 . 3]" 1
2286 1 73 ILE MG 1 76 LYS H . . 5.380 4.742 4.505 4.979 . 0 0 "[ . 1 . 2 . 3]" 1
2287 2 73 ILE MG 2 76 LYS H . . 5.380 4.744 4.498 4.921 . 0 0 "[ . 1 . 2 . 3]" 1
2288 1 73 ILE MG 1 77 SER H . . 5.500 3.911 3.729 4.166 . 0 0 "[ . 1 . 2 . 3]" 1
2289 2 73 ILE MG 2 77 SER H . . 5.500 3.916 3.756 4.104 . 0 0 "[ . 1 . 2 . 3]" 1
2290 1 73 ILE HA 1 73 ILE MG . . 3.410 2.410 2.382 2.460 . 0 0 "[ . 1 . 2 . 3]" 1
2291 2 73 ILE HA 2 73 ILE MG . . 3.410 2.408 2.371 2.460 . 0 0 "[ . 1 . 2 . 3]" 1
2292 1 64 ILE HB 2 73 ILE MG . . 3.630 3.037 2.980 3.091 . 0 0 "[ . 1 . 2 . 3]" 1
2293 1 73 ILE MG 2 64 ILE HB . . 3.630 3.033 2.971 3.091 . 0 0 "[ . 1 . 2 . 3]" 1
2294 1 73 ILE MD 1 73 ILE MG . . 2.930 1.964 1.917 2.257 . 0 0 "[ . 1 . 2 . 3]" 1
2295 2 73 ILE MD 2 73 ILE MG . . 2.930 1.968 1.872 2.263 . 0 0 "[ . 1 . 2 . 3]" 1
2296 1 35 ILE HG13 1 35 ILE MG . . 3.490 3.014 2.961 3.060 . 0 0 "[ . 1 . 2 . 3]" 1
2297 2 35 ILE HG13 2 35 ILE MG . . 3.490 3.013 2.950 3.064 . 0 0 "[ . 1 . 2 . 3]" 1
2298 1 64 ILE MD 2 73 ILE MG . . 3.620 2.586 2.426 2.748 . 0 0 "[ . 1 . 2 . 3]" 1
2299 1 73 ILE MG 2 64 ILE MD . . 3.620 2.583 2.416 2.757 . 0 0 "[ . 1 . 2 . 3]" 1
2300 1 24 LEU MD1 2 73 ILE MG . . 3.690 3.184 3.022 3.285 . 0 0 "[ . 1 . 2 . 3]" 1
2301 1 73 ILE MG 2 24 LEU MD1 . . 3.690 3.182 3.061 3.295 . 0 0 "[ . 1 . 2 . 3]" 1
2302 1 74 MET H 1 74 MET HB3 . . 4.010 3.387 2.489 3.592 . 0 0 "[ . 1 . 2 . 3]" 1
2303 2 74 MET H 2 74 MET HB3 . . 4.010 3.388 2.497 3.595 . 0 0 "[ . 1 . 2 . 3]" 1
2304 1 74 MET HB3 1 75 GLU H . . 4.260 3.804 3.409 4.069 . 0 0 "[ . 1 . 2 . 3]" 1
2305 2 74 MET HB3 2 75 GLU H . . 4.260 3.811 3.457 4.070 . 0 0 "[ . 1 . 2 . 3]" 1
2306 1 74 MET HB2 1 75 GLU H . . 4.260 2.961 2.396 3.877 . 0 0 "[ . 1 . 2 . 3]" 1
2307 2 74 MET HB2 2 75 GLU H . . 4.260 2.962 2.355 3.871 . 0 0 "[ . 1 . 2 . 3]" 1
2308 1 78 THR H 1 78 THR MG . . 3.880 3.764 3.754 3.768 . 0 0 "[ . 1 . 2 . 3]" 1
2309 2 78 THR H 2 78 THR MG . . 3.880 3.764 3.751 3.768 . 0 0 "[ . 1 . 2 . 3]" 1
2310 1 78 THR MG 1 82 ASN HD21 . . 3.820 2.716 1.958 3.864 0.044 18 0 "[ . 1 . 2 . 3]" 1
2311 2 78 THR MG 2 82 ASN HD21 . . 3.820 2.625 1.960 3.863 0.043 5 0 "[ . 1 . 2 . 3]" 1
2312 1 78 THR MG 1 81 TYR QD . . 4.790 3.116 2.815 3.533 . 0 0 "[ . 1 . 2 . 3]" 1
2313 2 78 THR MG 2 81 TYR QD . . 4.790 3.131 2.800 3.818 . 0 0 "[ . 1 . 2 . 3]" 1
2314 1 78 THR MG 1 82 ASN HD22 . . 3.820 2.637 1.977 3.428 . 0 0 "[ . 1 . 2 . 3]" 1
2315 2 78 THR MG 2 82 ASN HD22 . . 3.820 2.653 1.991 3.835 0.015 30 0 "[ . 1 . 2 . 3]" 1
2316 1 78 THR MG 1 79 MET HA . . 4.090 3.538 3.371 3.697 . 0 0 "[ . 1 . 2 . 3]" 1
2317 2 78 THR MG 2 79 MET HA . . 4.090 3.535 3.373 3.699 . 0 0 "[ . 1 . 2 . 3]" 1
2318 1 75 GLU HA 1 78 THR MG . . 4.790 4.687 4.521 4.825 0.035 18 0 "[ . 1 . 2 . 3]" 1
2319 2 75 GLU HA 2 78 THR MG . . 4.790 4.693 4.532 4.796 0.006 11 0 "[ . 1 . 2 . 3]" 1
2320 1 78 THR HA 1 78 THR MG . . 3.070 2.331 2.266 2.401 . 0 0 "[ . 1 . 2 . 3]" 1
2321 2 78 THR HA 2 78 THR MG . . 3.070 2.332 2.261 2.404 . 0 0 "[ . 1 . 2 . 3]" 1
2322 1 78 THR MG 1 81 TYR QB . . 4.240 3.317 3.070 3.548 . 0 0 "[ . 1 . 2 . 3]" 1
2323 2 78 THR MG 2 81 TYR QB . . 4.240 3.323 3.074 3.692 . 0 0 "[ . 1 . 2 . 3]" 1
2324 1 78 THR MG 1 79 MET QB . . 4.490 4.436 4.294 4.495 0.005 2 0 "[ . 1 . 2 . 3]" 1
2325 2 78 THR MG 2 79 MET QB . . 4.490 4.433 4.287 4.497 0.007 15 0 "[ . 1 . 2 . 3]" 1
2326 1 78 THR HA 1 79 MET QB . . 5.230 5.193 5.173 5.216 . 0 0 "[ . 1 . 2 . 3]" 1
2327 2 78 THR HA 2 79 MET QB . . 5.230 5.193 5.176 5.217 . 0 0 "[ . 1 . 2 . 3]" 1
2328 1 61 LEU MD2 2 80 LEU HB2 . . 5.290 2.276 1.990 2.411 . 0 0 "[ . 1 . 2 . 3]" 1
2329 1 80 LEU HB2 2 61 LEU MD2 . . 5.290 2.261 1.993 2.461 . 0 0 "[ . 1 . 2 . 3]" 1
2330 1 80 LEU HA 1 80 LEU HG . . 4.160 3.283 2.568 3.709 . 0 0 "[ . 1 . 2 . 3]" 1
2331 2 80 LEU HA 2 80 LEU HG . . 4.160 3.306 3.064 3.709 . 0 0 "[ . 1 . 2 . 3]" 1
2332 1 42 ALA HA 2 80 LEU MD1 . . 4.190 3.747 1.960 4.211 0.021 21 0 "[ . 1 . 2 . 3]" 1
2333 1 80 LEU MD1 2 42 ALA HA . . 4.190 3.737 1.965 4.235 0.045 18 0 "[ . 1 . 2 . 3]" 1
2334 1 80 LEU HA 1 80 LEU MD1 . . 4.590 3.485 1.939 3.923 . 0 0 "[ . 1 . 2 . 3]" 1
2335 2 80 LEU HA 2 80 LEU MD1 . . 4.590 3.530 1.935 3.924 . 0 0 "[ . 1 . 2 . 3]" 1
2336 1 101 LEU HA 1 101 LEU MD2 . . 4.140 2.811 2.097 3.799 . 0 0 "[ . 1 . 2 . 3]" 1
2337 2 101 LEU HA 2 101 LEU MD2 . . 4.140 2.821 2.100 3.776 . 0 0 "[ . 1 . 2 . 3]" 1
2338 1 61 LEU HB2 2 81 TYR QD . . 4.510 3.426 3.104 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
2339 1 81 TYR QD 2 61 LEU HB2 . . 4.510 3.436 3.247 3.571 . 0 0 "[ . 1 . 2 . 3]" 1
2340 1 62 LYS HB2 2 81 TYR QD . . 4.820 2.981 2.076 4.034 . 0 0 "[ . 1 . 2 . 3]" 1
2341 1 81 TYR QD 2 62 LYS HB2 . . 4.820 2.943 2.108 3.388 . 0 0 "[ . 1 . 2 . 3]" 1
2342 1 81 TYR QD 1 85 LYS HD2 . . 5.500 4.854 3.207 5.505 0.005 7 0 "[ . 1 . 2 . 3]" 1
2343 2 81 TYR QD 2 85 LYS HD2 . . 5.500 4.930 3.242 5.504 0.004 18 0 "[ . 1 . 2 . 3]" 1
2344 1 61 LEU HB3 2 81 TYR QD . . 4.510 4.055 3.806 4.182 . 0 0 "[ . 1 . 2 . 3]" 1
2345 1 81 TYR QD 2 61 LEU HB3 . . 4.510 4.052 3.633 4.243 . 0 0 "[ . 1 . 2 . 3]" 1
2346 1 81 TYR QD 1 85 LYS HD3 . . 5.500 4.197 3.471 5.331 . 0 0 "[ . 1 . 2 . 3]" 1
2347 2 81 TYR QD 2 85 LYS HD3 . . 5.500 4.289 3.501 5.365 . 0 0 "[ . 1 . 2 . 3]" 1
2348 1 81 TYR HA 1 81 TYR QD . . 3.720 2.462 1.994 3.065 . 0 0 "[ . 1 . 2 . 3]" 1
2349 2 81 TYR HA 2 81 TYR QD . . 3.720 2.417 1.986 3.052 . 0 0 "[ . 1 . 2 . 3]" 1
2350 1 83 LYS QE 1 83 LYS HG3 . . 3.560 3.172 2.746 3.413 . 0 0 "[ . 1 . 2 . 3]" 1
2351 2 83 LYS QE 2 83 LYS HG3 . . 3.560 3.172 2.744 3.415 . 0 0 "[ . 1 . 2 . 3]" 1
2352 1 83 LYS QE 1 83 LYS HG2 . . 3.560 2.109 1.976 2.361 . 0 0 "[ . 1 . 2 . 3]" 1
2353 2 83 LYS QE 2 83 LYS HG2 . . 3.560 2.109 1.977 2.363 . 0 0 "[ . 1 . 2 . 3]" 1
2354 1 83 LYS QE 1 87 MET ME . . 4.230 3.546 2.920 4.105 . 0 0 "[ . 1 . 2 . 3]" 1
2355 2 83 LYS QE 2 87 MET ME . . 4.230 3.513 2.949 4.156 . 0 0 "[ . 1 . 2 . 3]" 1
2356 1 84 PHE HA 1 84 PHE QD . . 3.740 2.195 1.954 2.657 . 0 0 "[ . 1 . 2 . 3]" 1
2357 2 84 PHE HA 2 84 PHE QD . . 3.740 2.322 1.967 2.738 . 0 0 "[ . 1 . 2 . 3]" 1
2358 1 61 LEU HG 2 84 PHE QD . . 5.500 5.467 5.221 5.557 0.057 18 0 "[ . 1 . 2 . 3]" 1
2359 1 84 PHE QD 2 61 LEU HG . . 5.500 5.426 5.168 5.550 0.050 14 0 "[ . 1 . 2 . 3]" 1
2360 1 83 LYS HB2 1 84 PHE QD . . 5.500 5.388 4.856 5.549 0.049 5 0 "[ . 1 . 2 . 3]" 1
2361 2 83 LYS HB2 2 84 PHE QD . . 5.500 5.306 4.623 5.538 0.038 27 0 "[ . 1 . 2 . 3]" 1
2362 1 83 LYS HB3 1 84 PHE QD . . 5.500 3.978 3.502 4.317 . 0 0 "[ . 1 . 2 . 3]" 1
2363 2 83 LYS HB3 2 84 PHE QD . . 5.500 3.892 3.373 4.309 . 0 0 "[ . 1 . 2 . 3]" 1
2364 1 41 LEU HG 2 84 PHE QE . . 5.280 3.507 3.090 4.425 . 0 0 "[ . 1 . 2 . 3]" 1
2365 1 84 PHE QE 2 41 LEU HG . . 5.280 3.414 3.040 3.963 . 0 0 "[ . 1 . 2 . 3]" 1
2366 1 46 VAL MG2 2 84 PHE QE . . 4.450 3.168 1.905 3.964 . 0 0 "[ . 1 . 2 . 3]" 1
2367 1 84 PHE QE 2 46 VAL MG2 . . 4.450 3.269 2.556 4.065 . 0 0 "[ . 1 . 2 . 3]" 1
2368 1 85 LYS HA 1 85 LYS QG . . 3.690 2.386 2.029 3.312 . 0 0 "[ . 1 . 2 . 3]" 1
2369 2 85 LYS HA 2 85 LYS QG . . 3.690 2.387 2.032 3.311 . 0 0 "[ . 1 . 2 . 3]" 1
2370 1 82 ASN HA 1 85 LYS QG . . 4.180 3.874 1.975 4.181 0.001 7 0 "[ . 1 . 2 . 3]" 1
2371 2 82 ASN HA 2 85 LYS QG . . 4.180 3.890 1.976 4.187 0.007 7 0 "[ . 1 . 2 . 3]" 1
2372 1 81 TYR QE 1 85 LYS HD2 . . 4.580 3.528 2.616 4.329 . 0 0 "[ . 1 . 2 . 3]" 1
2373 2 81 TYR QE 2 85 LYS HD2 . . 4.580 3.651 2.754 4.493 . 0 0 "[ . 1 . 2 . 3]" 1
2374 1 81 TYR QE 1 85 LYS HD3 . . 4.580 3.333 2.123 4.429 . 0 0 "[ . 1 . 2 . 3]" 1
2375 2 81 TYR QE 2 85 LYS HD3 . . 4.580 3.464 2.294 4.540 . 0 0 "[ . 1 . 2 . 3]" 1
2376 1 83 LYS HA 1 86 ASN QB . . 4.050 3.274 2.690 3.720 . 0 0 "[ . 1 . 2 . 3]" 1
2377 2 83 LYS HA 2 86 ASN QB . . 4.050 3.256 2.686 3.735 . 0 0 "[ . 1 . 2 . 3]" 1
2378 1 87 MET HA 1 87 MET HG3 . . 4.100 3.425 3.291 3.714 . 0 0 "[ . 1 . 2 . 3]" 1
2379 2 87 MET HA 2 87 MET HG3 . . 4.100 3.433 3.300 3.719 . 0 0 "[ . 1 . 2 . 3]" 1
2380 1 87 MET HA 1 87 MET HG2 . . 4.100 2.484 2.241 3.770 . 0 0 "[ . 1 . 2 . 3]" 1
2381 2 87 MET HA 2 87 MET HG2 . . 4.100 2.519 2.240 3.788 . 0 0 "[ . 1 . 2 . 3]" 1
2382 2 86 ASN HA 2 89 LEU HB3 . . 4.720 4.366 4.024 4.733 0.013 28 0 "[ . 1 . 2 . 3]" 1
2383 2 85 LYS HA 2 89 LEU HB3 . . 5.500 4.880 4.217 5.525 0.025 28 0 "[ . 1 . 2 . 3]" 1
2384 1 86 ASN HA 1 89 LEU HG . . 4.390 2.314 2.056 3.370 . 0 0 "[ . 1 . 2 . 3]" 1
2385 2 86 ASN HA 2 89 LEU HG . . 4.390 2.321 2.067 3.371 . 0 0 "[ . 1 . 2 . 3]" 1
2386 2 86 ASN H 2 89 LEU MD2 . . 5.070 3.584 3.240 4.004 . 0 0 "[ . 1 . 2 . 3]" 1
2387 2 89 LEU MD2 2 90 VAL H . . 5.410 3.848 3.597 3.959 . 0 0 "[ . 1 . 2 . 3]" 1
2388 1 86 ASN HA 1 89 LEU MD1 . . 4.400 2.968 2.492 4.287 . 0 0 "[ . 1 . 2 . 3]" 1
2389 2 86 ASN HA 2 89 LEU MD2 . . 3.920 2.005 1.895 2.226 . 0 0 "[ . 1 . 2 . 3]" 1
2390 2 89 LEU HA 2 89 LEU MD2 . . 4.260 4.053 3.919 4.105 . 0 0 "[ . 1 . 2 . 3]" 1
2391 2 86 ASN QB 2 89 LEU MD2 . . 4.460 3.748 3.380 3.923 . 0 0 "[ . 1 . 2 . 3]" 1
2392 2 89 LEU HB3 2 89 LEU MD2 . . 3.180 2.109 1.966 2.201 . 0 0 "[ . 1 . 2 . 3]" 1
2393 1 86 ASN HA 1 89 LEU MD2 . . 4.400 2.003 1.927 2.193 . 0 0 "[ . 1 . 2 . 3]" 1
2394 2 86 ASN HA 2 89 LEU MD1 . . 4.400 2.975 2.480 4.235 . 0 0 "[ . 1 . 2 . 3]" 1
2395 2 89 LEU HB3 2 89 LEU MD1 . . 3.650 3.118 3.032 3.132 . 0 0 "[ . 1 . 2 . 3]" 1
2396 2 89 LEU HB2 2 89 LEU MD1 . . 3.420 2.089 1.918 2.179 . 0 0 "[ . 1 . 2 . 3]" 1
2397 1 89 LEU H 1 90 VAL QG . . 4.630 3.885 3.502 4.620 . 0 0 "[ . 1 . 2 . 3]" 1
2398 2 89 LEU H 2 90 VAL QG . . 4.630 3.892 3.495 4.617 . 0 0 "[ . 1 . 2 . 3]" 1
2399 1 90 VAL HA 1 90 VAL QG . . 3.190 2.075 2.044 2.203 . 0 0 "[ . 1 . 2 . 3]" 1
2400 2 90 VAL HA 2 90 VAL QG . . 3.190 2.083 2.044 2.331 . 0 0 "[ . 1 . 2 . 3]" 1
2401 1 96 VAL HA 1 96 VAL MG2 . . 3.650 2.951 2.164 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
2402 2 96 VAL HA 2 96 VAL MG2 . . 3.650 2.906 2.343 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
2403 1 96 VAL HA 1 96 VAL MG1 . . 3.650 2.335 2.019 3.185 . 0 0 "[ . 1 . 2 . 3]" 1
2404 2 96 VAL HA 2 96 VAL MG1 . . 3.650 2.361 1.975 3.185 . 0 0 "[ . 1 . 2 . 3]" 1
2405 1 97 ILE HA 1 97 ILE MG . . 3.460 2.271 1.962 2.395 . 0 0 "[ . 1 . 2 . 3]" 1
2406 2 97 ILE HA 2 97 ILE MG . . 3.460 2.246 1.973 2.374 . 0 0 "[ . 1 . 2 . 3]" 1
2407 1 97 ILE HG12 1 97 ILE MG . . 3.630 2.231 1.981 2.430 . 0 0 "[ . 1 . 2 . 3]" 1
2408 2 97 ILE HG12 2 97 ILE MG . . 3.630 2.223 1.982 2.422 . 0 0 "[ . 1 . 2 . 3]" 1
2409 1 97 ILE HG13 1 97 ILE MG . . 3.630 3.074 2.712 3.204 . 0 0 "[ . 1 . 2 . 3]" 1
2410 2 97 ILE HG13 2 97 ILE MG . . 3.630 3.069 2.714 3.204 . 0 0 "[ . 1 . 2 . 3]" 1
2411 1 97 ILE HA 1 97 ILE MD . . 4.030 3.860 3.444 4.160 0.130 29 0 "[ . 1 . 2 . 3]" 1
2412 2 97 ILE HA 2 97 ILE MD . . 4.030 3.871 3.446 4.158 0.128 28 0 "[ . 1 . 2 . 3]" 1
2413 1 101 LEU HA 1 101 LEU MD1 . . 4.140 3.199 2.061 3.931 . 0 0 "[ . 1 . 2 . 3]" 1
2414 2 101 LEU HA 2 101 LEU MD1 . . 4.140 3.175 2.024 3.932 . 0 0 "[ . 1 . 2 . 3]" 1
2415 1 114 ALA MB 1 116 LYS H . . 4.670 4.574 4.306 4.683 0.013 24 0 "[ . 1 . 2 . 3]" 1
2416 2 114 ALA MB 2 116 LYS H . . 4.670 4.573 4.306 4.674 0.004 27 0 "[ . 1 . 2 . 3]" 1
2417 1 103 LYS HA 1 106 ALA MB . . 3.270 2.515 1.965 3.272 0.002 29 0 "[ . 1 . 2 . 3]" 1
2418 2 103 LYS HA 2 106 ALA MB . . 3.270 2.507 1.968 3.254 . 0 0 "[ . 1 . 2 . 3]" 1
2419 1 106 ALA MB 1 107 GLU HG2 . . 4.930 4.176 3.682 4.741 . 0 0 "[ . 1 . 2 . 3]" 1
2420 2 106 ALA MB 2 107 GLU HG2 . . 4.930 4.175 3.651 4.743 . 0 0 "[ . 1 . 2 . 3]" 1
2421 1 106 ALA MB 1 107 GLU HG3 . . 4.930 4.478 3.686 4.932 0.002 4 0 "[ . 1 . 2 . 3]" 1
2422 2 106 ALA MB 2 107 GLU HG3 . . 4.930 4.477 3.689 4.917 . 0 0 "[ . 1 . 2 . 3]" 1
2423 1 106 ALA MB 1 107 GLU QB . . 4.420 4.304 3.803 4.432 0.012 3 0 "[ . 1 . 2 . 3]" 1
2424 2 106 ALA MB 2 107 GLU QB . . 4.420 4.303 3.805 4.428 0.008 27 0 "[ . 1 . 2 . 3]" 1
2425 1 103 LYS HB2 1 106 ALA MB . . 4.740 4.382 2.865 4.744 0.004 27 0 "[ . 1 . 2 . 3]" 1
2426 2 103 LYS HB2 2 106 ALA MB . . 4.740 4.405 2.823 4.735 . 0 0 "[ . 1 . 2 . 3]" 1
2427 1 103 LYS HB3 1 106 ALA MB . . 4.740 4.459 2.886 4.753 0.013 19 0 "[ . 1 . 2 . 3]" 1
2428 2 103 LYS HB3 2 106 ALA MB . . 4.740 4.444 2.882 4.741 0.001 8 0 "[ . 1 . 2 . 3]" 1
2429 1 98 THR HA 1 98 THR MG . . 3.370 2.264 1.978 3.199 . 0 0 "[ . 1 . 2 . 3]" 1
2430 2 98 THR HA 2 98 THR MG . . 3.370 2.267 1.971 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
2431 1 88 PHE QD 2 51 ALA MB . . 4.680 4.109 3.286 4.693 0.013 29 0 "[ . 1 . 2 . 3]" 1
2432 1 51 ALA MB 2 88 PHE QD . . 4.680 4.105 3.328 4.691 0.011 18 0 "[ . 1 . 2 . 3]" 1
2433 1 20 ILE HA 1 37 ALA MB . . 4.430 3.731 3.622 3.827 . 0 0 "[ . 1 . 2 . 3]" 1
2434 2 20 ILE HA 2 37 ALA MB . . 4.430 3.736 3.614 3.840 . 0 0 "[ . 1 . 2 . 3]" 1
2435 1 25 LYS HA 1 26 ILE MD . . 5.500 5.468 5.445 5.491 . 0 0 "[ . 1 . 2 . 3]" 1
2436 2 25 LYS HA 2 26 ILE MD . . 5.500 5.471 5.452 5.509 0.009 14 0 "[ . 1 . 2 . 3]" 1
2437 1 20 ILE H 1 20 ILE MG . . 3.960 3.765 3.757 3.769 . 0 0 "[ . 1 . 2 . 3]" 1
2438 2 20 ILE H 2 20 ILE MG . . 3.960 3.765 3.763 3.768 . 0 0 "[ . 1 . 2 . 3]" 1
2439 1 17 HIS HD2 1 20 ILE MG . . 4.700 4.238 3.705 4.517 . 0 0 "[ . 1 . 2 . 3]" 1
2440 2 17 HIS HD2 2 20 ILE MG . . 4.700 4.270 3.875 4.496 . 0 0 "[ . 1 . 2 . 3]" 1
2441 1 20 ILE MG 1 24 LEU H . . 5.130 4.151 3.785 4.460 . 0 0 "[ . 1 . 2 . 3]" 1
2442 2 20 ILE MG 2 24 LEU H . . 5.130 4.147 3.760 4.399 . 0 0 "[ . 1 . 2 . 3]" 1
2443 1 20 ILE MG 1 24 LEU HG . . 4.980 2.101 1.942 2.266 . 0 0 "[ . 1 . 2 . 3]" 1
2444 2 20 ILE MG 2 24 LEU HG . . 4.980 2.105 1.948 2.272 . 0 0 "[ . 1 . 2 . 3]" 1
2445 1 24 LEU HG 1 64 ILE MG . . 5.500 4.631 4.428 4.857 . 0 0 "[ . 1 . 2 . 3]" 1
2446 2 24 LEU HG 2 64 ILE MG . . 5.500 4.638 4.423 4.755 . 0 0 "[ . 1 . 2 . 3]" 1
2447 1 84 PHE QD 2 46 VAL MG1 . . 5.420 3.774 3.361 4.093 . 0 0 "[ . 1 . 2 . 3]" 1
2448 1 46 VAL MG1 2 84 PHE QD . . 5.420 3.785 3.625 4.099 . 0 0 "[ . 1 . 2 . 3]" 1
2449 1 84 PHE QD 2 46 VAL MG2 . . 5.420 4.706 4.181 5.124 . 0 0 "[ . 1 . 2 . 3]" 1
2450 1 46 VAL MG2 2 84 PHE QD . . 5.420 4.636 3.588 5.304 . 0 0 "[ . 1 . 2 . 3]" 1
2451 1 63 LYS H 1 63 LYS QD . . 4.340 4.152 3.658 4.349 0.009 4 0 "[ . 1 . 2 . 3]" 1
2452 2 63 LYS H 2 63 LYS QD . . 4.340 4.151 3.665 4.340 . 0 0 "[ . 1 . 2 . 3]" 1
2453 1 68 LYS H 1 68 LYS QD . . 5.390 4.576 3.488 5.312 . 0 0 "[ . 1 . 2 . 3]" 1
2454 2 68 LYS H 2 68 LYS QD . . 5.390 4.635 3.116 5.306 . 0 0 "[ . 1 . 2 . 3]" 1
2455 1 114 ALA MB 1 115 ASN HA . . 4.450 3.824 3.719 3.942 . 0 0 "[ . 1 . 2 . 3]" 1
2456 2 114 ALA MB 2 115 ASN HA . . 4.450 3.825 3.718 3.941 . 0 0 "[ . 1 . 2 . 3]" 1
2457 1 71 GLN QG 1 72 VAL H . . 4.380 3.633 2.211 4.214 . 0 0 "[ . 1 . 2 . 3]" 1
2458 2 71 GLN QG 2 72 VAL H . . 4.380 3.617 2.184 4.148 . 0 0 "[ . 1 . 2 . 3]" 1
2459 1 71 GLN HA 1 71 GLN QG . . 3.880 2.577 2.146 3.457 . 0 0 "[ . 1 . 2 . 3]" 1
2460 2 71 GLN HA 2 71 GLN QG . . 3.880 2.596 2.146 3.429 . 0 0 "[ . 1 . 2 . 3]" 1
2461 1 29 LEU MD2 2 67 PHE QE . . 4.200 3.690 3.554 3.923 . 0 0 "[ . 1 . 2 . 3]" 1
2462 1 67 PHE QE 2 29 LEU MD2 . . 4.200 3.698 3.558 3.972 . 0 0 "[ . 1 . 2 . 3]" 1
2463 1 26 ILE MD 2 67 PHE QE . . 4.440 2.930 2.869 3.008 . 0 0 "[ . 1 . 2 . 3]" 1
2464 1 67 PHE QE 2 26 ILE MD . . 4.440 2.942 2.870 3.009 . 0 0 "[ . 1 . 2 . 3]" 1
2465 1 51 ALA MB 2 88 PHE HZ . . 4.120 3.405 2.390 4.123 0.003 30 0 "[ . 1 . 2 . 3]" 1
2466 1 88 PHE HZ 2 51 ALA MB . . 4.120 3.323 2.058 4.120 . 0 0 "[ . 1 . 2 . 3]" 1
2467 1 52 GLN HA 2 88 PHE HZ . . 4.290 2.667 2.001 3.658 . 0 0 "[ . 1 . 2 . 3]" 1
2468 1 88 PHE HZ 2 52 GLN HA . . 4.290 2.702 1.995 3.658 . 0 0 "[ . 1 . 2 . 3]" 1
2469 1 46 VAL HB 2 84 PHE HZ . . 5.080 4.608 3.197 5.087 0.007 21 0 "[ . 1 . 2 . 3]" 1
2470 1 84 PHE HZ 2 46 VAL HB . . 5.080 4.589 3.126 5.086 0.006 21 0 "[ . 1 . 2 . 3]" 1
2471 1 52 GLN HA 2 88 PHE HE1 . . 4.620 3.431 2.289 4.629 0.009 10 0 "[ . 1 . 2 . 3]" 1
2472 1 88 PHE HE1 2 52 GLN HA . . 4.620 3.396 2.303 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
2473 1 51 ALA MB 2 88 PHE HE1 . . 4.130 2.758 1.970 4.034 . 0 0 "[ . 1 . 2 . 3]" 1
2474 1 88 PHE HE1 2 51 ALA MB . . 4.130 2.835 1.961 4.165 0.035 10 0 "[ . 1 . 2 . 3]" 1
2475 1 58 ILE MD 2 88 PHE HE1 . . 4.280 3.060 1.984 4.286 0.006 8 0 "[ . 1 . 2 . 3]" 1
2476 1 88 PHE HE1 2 58 ILE MD . . 4.280 3.094 1.940 4.282 0.002 14 0 "[ . 1 . 2 . 3]" 1
2477 1 25 LYS HA 1 25 LYS QD . . 4.400 2.825 2.088 3.576 . 0 0 "[ . 1 . 2 . 3]" 1
2478 2 25 LYS HA 2 25 LYS QD . . 4.400 2.884 2.101 3.588 . 0 0 "[ . 1 . 2 . 3]" 1
2479 1 13 LEU HA 1 57 MET ME . . 4.230 3.971 3.721 4.230 . 0 0 "[ . 1 . 2 . 3]" 1
2480 2 13 LEU HA 2 57 MET ME . . 4.230 4.031 3.815 4.250 0.020 18 0 "[ . 1 . 2 . 3]" 1
2481 1 54 HIS HB3 1 57 MET ME . . 3.890 2.208 1.942 2.716 . 0 0 "[ . 1 . 2 . 3]" 1
2482 2 54 HIS HB3 2 57 MET ME . . 3.890 2.234 1.948 2.699 . 0 0 "[ . 1 . 2 . 3]" 1
2483 1 54 HIS HB2 1 57 MET ME . . 3.920 2.812 2.478 3.244 . 0 0 "[ . 1 . 2 . 3]" 1
2484 2 54 HIS HB2 2 57 MET ME . . 3.920 2.812 2.422 3.273 . 0 0 "[ . 1 . 2 . 3]" 1
2485 1 57 MET HB2 1 57 MET ME . . 3.460 2.798 2.432 3.143 . 0 0 "[ . 1 . 2 . 3]" 1
2486 2 57 MET HB2 2 57 MET ME . . 3.460 2.785 2.399 3.112 . 0 0 "[ . 1 . 2 . 3]" 1
2487 1 41 LEU MD1 1 57 MET ME . . 3.330 3.220 1.861 3.360 0.030 13 0 "[ . 1 . 2 . 3]" 1
2488 2 41 LEU MD1 2 57 MET ME . . 3.330 3.177 1.852 3.362 0.032 20 0 "[ . 1 . 2 . 3]" 1
2489 1 41 LEU MD2 1 57 MET ME . . 3.330 2.018 1.884 3.109 . 0 0 "[ . 1 . 2 . 3]" 1
2490 2 41 LEU MD2 2 57 MET ME . . 3.330 2.038 1.892 3.333 0.003 18 0 "[ . 1 . 2 . 3]" 1
2491 1 16 ILE MD 1 57 MET ME . . 4.870 4.163 3.264 4.880 0.010 14 0 "[ . 1 . 2 . 3]" 1
2492 2 16 ILE MD 2 57 MET ME . . 4.870 4.222 3.328 4.879 0.009 9 0 "[ . 1 . 2 . 3]" 1
2493 1 13 LEU HB3 1 57 MET ME . . 3.560 2.933 2.363 3.351 . 0 0 "[ . 1 . 2 . 3]" 1
2494 2 13 LEU HB3 2 57 MET ME . . 3.560 2.872 2.337 3.347 . 0 0 "[ . 1 . 2 . 3]" 1
2495 1 13 LEU MD2 1 57 MET ME . . 3.590 2.042 1.790 2.547 . 0 0 "[ . 1 . 2 . 3]" 1
2496 2 13 LEU MD2 2 57 MET ME . . 3.590 2.061 1.824 2.588 . 0 0 "[ . 1 . 2 . 3]" 1
2497 1 13 LEU MD1 1 57 MET ME . . 3.590 2.914 2.372 3.530 . 0 0 "[ . 1 . 2 . 3]" 1
2498 2 13 LEU MD1 2 57 MET ME . . 3.590 2.977 2.441 3.529 . 0 0 "[ . 1 . 2 . 3]" 1
2499 1 57 MET ME 1 58 ILE HA . . 4.760 4.642 4.246 4.778 0.018 19 0 "[ . 1 . 2 . 3]" 1
2500 2 57 MET ME 2 58 ILE HA . . 4.760 4.649 4.314 4.780 0.020 18 0 "[ . 1 . 2 . 3]" 1
2501 1 17 HIS HA 1 57 MET ME . . 5.500 5.481 5.312 5.519 0.019 15 0 "[ . 1 . 2 . 3]" 1
2502 2 17 HIS HA 2 57 MET ME . . 5.500 5.479 5.353 5.510 0.010 27 0 "[ . 1 . 2 . 3]" 1
2503 1 84 PHE QE 2 57 MET ME . . 4.360 3.255 2.724 3.703 . 0 0 "[ . 1 . 2 . 3]" 1
2504 1 57 MET ME 2 84 PHE QE . . 4.360 3.363 2.792 3.696 . 0 0 "[ . 1 . 2 . 3]" 1
2505 1 84 PHE HZ 2 57 MET ME . . 4.600 3.094 2.422 3.494 . 0 0 "[ . 1 . 2 . 3]" 1
2506 1 57 MET ME 2 84 PHE HZ . . 4.600 3.071 2.447 3.414 . 0 0 "[ . 1 . 2 . 3]" 1
2507 1 57 MET ME 1 58 ILE H . . 4.580 3.893 3.459 4.137 . 0 0 "[ . 1 . 2 . 3]" 1
2508 2 57 MET ME 2 58 ILE H . . 4.580 3.889 3.426 4.128 . 0 0 "[ . 1 . 2 . 3]" 1
2509 1 54 HIS HD2 1 57 MET ME . . 4.260 3.571 2.800 3.988 . 0 0 "[ . 1 . 2 . 3]" 1
2510 2 54 HIS HD2 2 57 MET ME . . 4.260 3.617 2.787 4.217 . 0 0 "[ . 1 . 2 . 3]" 1
2511 1 84 PHE QD 2 57 MET ME . . 5.090 4.623 4.294 4.969 . 0 0 "[ . 1 . 2 . 3]" 1
2512 1 57 MET ME 2 84 PHE QD . . 5.090 4.694 4.327 4.950 . 0 0 "[ . 1 . 2 . 3]" 1
2513 1 14 GLN H 1 57 MET ME . . 5.500 5.460 5.128 5.537 0.037 13 0 "[ . 1 . 2 . 3]" 1
2514 2 14 GLN H 2 57 MET ME . . 5.500 5.419 5.035 5.529 0.029 9 0 "[ . 1 . 2 . 3]" 1
2515 1 17 HIS H 1 57 MET ME . . 5.200 5.009 4.769 5.216 0.016 9 0 "[ . 1 . 2 . 3]" 1
2516 2 17 HIS H 2 57 MET ME . . 5.200 5.039 4.830 5.191 . 0 0 "[ . 1 . 2 . 3]" 1
2517 1 57 MET HA 1 57 MET ME . . 4.960 4.409 4.300 4.488 . 0 0 "[ . 1 . 2 . 3]" 1
2518 2 57 MET HA 2 57 MET ME . . 4.960 4.409 4.302 4.485 . 0 0 "[ . 1 . 2 . 3]" 1
2519 1 13 LEU HG 1 57 MET ME . . 4.310 3.143 1.922 4.316 0.006 16 0 "[ . 1 . 2 . 3]" 1
2520 2 13 LEU HG 2 57 MET ME . . 4.310 3.516 1.955 4.341 0.031 16 0 "[ . 1 . 2 . 3]" 1
2521 1 57 MET HB3 1 57 MET ME . . 3.460 2.003 1.944 2.215 . 0 0 "[ . 1 . 2 . 3]" 1
2522 2 57 MET HB3 2 57 MET ME . . 3.460 2.015 1.942 2.248 . 0 0 "[ . 1 . 2 . 3]" 1
2523 1 47 THR H 2 87 MET ME . . 5.360 4.723 4.346 5.140 . 0 0 "[ . 1 . 2 . 3]" 1
2524 1 87 MET ME 2 47 THR H . . 5.360 4.728 4.188 5.131 . 0 0 "[ . 1 . 2 . 3]" 1
2525 1 51 ALA H 2 87 MET ME . . 5.500 4.401 3.961 5.292 . 0 0 "[ . 1 . 2 . 3]" 1
2526 1 87 MET ME 2 51 ALA H . . 5.500 4.385 3.962 5.274 . 0 0 "[ . 1 . 2 . 3]" 1
2527 1 48 MET H 2 87 MET ME . . 4.890 3.180 2.795 3.892 . 0 0 "[ . 1 . 2 . 3]" 1
2528 1 87 MET ME 2 48 MET H . . 4.890 3.187 2.799 3.902 . 0 0 "[ . 1 . 2 . 3]" 1
2529 1 46 VAL H 2 87 MET ME . . 5.470 5.242 4.532 5.483 0.013 29 0 "[ . 1 . 2 . 3]" 1
2530 1 87 MET ME 2 46 VAL H . . 5.470 5.252 4.562 5.484 0.014 29 0 "[ . 1 . 2 . 3]" 1
2531 1 87 MET H 1 87 MET ME . . 4.840 3.994 3.583 4.277 . 0 0 "[ . 1 . 2 . 3]" 1
2532 2 87 MET H 2 87 MET ME . . 4.840 3.992 3.549 4.281 . 0 0 "[ . 1 . 2 . 3]" 1
2533 1 87 MET ME 1 88 PHE QD . . 5.100 4.441 3.431 5.102 0.002 29 0 "[ . 1 . 2 . 3]" 1
2534 2 87 MET ME 2 88 PHE QD . . 5.100 4.485 3.731 5.098 . 0 0 "[ . 1 . 2 . 3]" 1
2535 1 84 PHE QD 1 87 MET ME . . 3.630 2.385 1.937 3.179 . 0 0 "[ . 1 . 2 . 3]" 1
2536 2 84 PHE QD 2 87 MET ME . . 3.630 2.495 1.975 3.595 . 0 0 "[ . 1 . 2 . 3]" 1
2537 1 84 PHE QE 1 87 MET ME . . 4.040 3.206 2.718 3.755 . 0 0 "[ . 1 . 2 . 3]" 1
2538 2 84 PHE QE 2 87 MET ME . . 4.040 3.290 2.741 4.057 0.017 9 0 "[ . 1 . 2 . 3]" 1
2539 1 47 THR HA 2 87 MET ME . . 4.130 3.063 2.606 3.690 . 0 0 "[ . 1 . 2 . 3]" 1
2540 1 87 MET ME 2 47 THR HA . . 4.130 3.089 2.687 3.694 . 0 0 "[ . 1 . 2 . 3]" 1
2541 1 84 PHE HA 1 87 MET ME . . 3.690 2.621 2.137 3.101 . 0 0 "[ . 1 . 2 . 3]" 1
2542 2 84 PHE HA 2 87 MET ME . . 3.690 2.655 2.243 3.132 . 0 0 "[ . 1 . 2 . 3]" 1
2543 1 70 SER HA 1 74 MET ME . . 3.740 3.542 3.220 3.737 . 0 0 "[ . 1 . 2 . 3]" 1
2544 2 70 SER HA 2 74 MET ME . . 3.740 3.526 3.224 3.751 0.011 17 0 "[ . 1 . 2 . 3]" 1
2545 1 87 MET HA 1 87 MET ME . . 4.540 4.445 4.193 4.549 0.009 29 0 "[ . 1 . 2 . 3]" 1
2546 2 87 MET HA 2 87 MET ME . . 4.540 4.436 4.005 4.556 0.016 29 0 "[ . 1 . 2 . 3]" 1
2547 1 48 MET HA 2 87 MET ME . . 3.620 2.565 2.122 3.627 0.007 23 0 "[ . 1 . 2 . 3]" 1
2548 1 87 MET ME 2 48 MET HA . . 3.620 2.545 2.180 3.625 0.005 23 0 "[ . 1 . 2 . 3]" 1
2549 1 87 MET ME 1 87 MET HG2 . . 3.590 3.298 2.206 3.398 . 0 0 "[ . 1 . 2 . 3]" 1
2550 2 87 MET ME 2 87 MET HG2 . . 3.590 3.275 2.218 3.398 . 0 0 "[ . 1 . 2 . 3]" 1
2551 1 87 MET ME 1 87 MET HG3 . . 3.590 2.474 2.265 3.358 . 0 0 "[ . 1 . 2 . 3]" 1
2552 2 87 MET ME 2 87 MET HG3 . . 3.590 2.498 2.262 3.385 . 0 0 "[ . 1 . 2 . 3]" 1
2553 1 51 ALA MB 2 87 MET ME . . 3.380 2.711 2.178 3.383 0.003 19 0 "[ . 1 . 2 . 3]" 1
2554 1 87 MET ME 2 51 ALA MB . . 3.380 2.691 2.203 3.383 0.003 19 0 "[ . 1 . 2 . 3]" 1
2555 1 46 VAL MG1 2 87 MET ME . . 4.520 3.200 2.693 3.649 . 0 0 "[ . 1 . 2 . 3]" 1
2556 1 87 MET ME 2 46 VAL MG1 . . 4.520 3.201 2.342 3.602 . 0 0 "[ . 1 . 2 . 3]" 1
2557 1 46 VAL MG2 2 87 MET ME . . 4.520 3.846 3.215 4.527 0.007 8 0 "[ . 1 . 2 . 3]" 1
2558 1 87 MET ME 2 46 VAL MG2 . . 4.520 3.885 3.340 4.561 0.041 9 0 "[ . 1 . 2 . 3]" 1
2559 1 71 GLN HA 1 74 MET ME . . 3.200 2.441 2.031 2.850 . 0 0 "[ . 1 . 2 . 3]" 1
2560 2 71 GLN HA 2 74 MET ME . . 3.200 2.440 1.979 2.835 . 0 0 "[ . 1 . 2 . 3]" 1
2561 1 9 MET ME 1 12 ARG QD . . 4.100 2.903 2.431 4.104 0.004 20 0 "[ . 1 . 2 . 3]" 1
2562 2 9 MET ME 2 12 ARG QD . . 4.100 2.880 2.430 3.614 . 0 0 "[ . 1 . 2 . 3]" 1
2563 1 74 MET ME 1 74 MET HG3 . . 3.730 2.312 1.988 3.380 . 0 0 "[ . 1 . 2 . 3]" 1
2564 2 74 MET ME 2 74 MET HG3 . . 3.730 2.311 1.987 3.381 . 0 0 "[ . 1 . 2 . 3]" 1
2565 1 68 LYS QG 1 74 MET ME . . 4.180 3.771 3.209 4.228 0.048 18 0 "[ . 1 . 2 . 3]" 1
2566 2 68 LYS QG 2 74 MET ME . . 4.180 3.781 3.206 4.229 0.049 18 0 "[ . 1 . 2 . 3]" 1
2567 1 9 MET ME 1 45 GLN H . . 4.340 3.239 2.209 4.350 0.010 30 0 "[ . 1 . 2 . 3]" 1
2568 2 9 MET ME 2 45 GLN H . . 4.340 3.124 2.234 4.127 . 0 0 "[ . 1 . 2 . 3]" 1
2569 1 42 ALA MB 2 79 MET ME . . 3.340 2.463 1.970 2.989 . 0 0 "[ . 1 . 2 . 3]" 1
2570 1 79 MET ME 2 42 ALA MB . . 3.340 2.499 1.975 3.028 . 0 0 "[ . 1 . 2 . 3]" 1
2571 1 79 MET ME 1 83 LYS HD2 . . 5.010 3.341 2.190 4.885 . 0 0 "[ . 1 . 2 . 3]" 1
2572 2 79 MET ME 2 83 LYS HD2 . . 5.010 3.405 2.218 4.787 . 0 0 "[ . 1 . 2 . 3]" 1
2573 1 79 MET ME 1 83 LYS HD3 . . 5.010 3.042 2.225 4.180 . 0 0 "[ . 1 . 2 . 3]" 1
2574 2 79 MET ME 2 83 LYS HD3 . . 5.010 3.112 2.229 4.293 . 0 0 "[ . 1 . 2 . 3]" 1
2575 1 79 MET ME 1 79 MET HG3 . . 3.900 2.917 2.232 3.359 . 0 0 "[ . 1 . 2 . 3]" 1
2576 2 79 MET ME 2 79 MET HG3 . . 3.900 2.915 2.212 3.359 . 0 0 "[ . 1 . 2 . 3]" 1
2577 1 79 MET HA 1 79 MET ME . . 4.480 4.196 3.830 4.481 0.001 20 0 "[ . 1 . 2 . 3]" 1
2578 2 79 MET HA 2 79 MET ME . . 4.480 4.207 3.829 4.611 0.131 21 0 "[ . 1 . 2 . 3]" 1
2579 1 42 ALA HA 2 79 MET ME . . 4.320 3.567 2.943 3.994 . 0 0 "[ . 1 . 2 . 3]" 1
2580 1 79 MET ME 2 42 ALA HA . . 4.320 3.532 2.887 3.874 . 0 0 "[ . 1 . 2 . 3]" 1
2581 1 79 MET ME 1 80 LEU HA . . 4.700 3.454 2.694 4.018 . 0 0 "[ . 1 . 2 . 3]" 1
2582 2 79 MET ME 2 80 LEU HA . . 4.700 3.485 2.688 4.237 . 0 0 "[ . 1 . 2 . 3]" 1
2583 1 79 MET ME 1 80 LEU H . . 4.620 4.159 3.660 4.578 . 0 0 "[ . 1 . 2 . 3]" 1
2584 2 79 MET ME 2 80 LEU H . . 4.620 4.174 3.646 4.787 0.167 21 0 "[ . 1 . 2 . 3]" 1
2585 1 68 LYS HA 1 68 LYS QD . . 4.550 4.087 3.768 4.360 . 0 0 "[ . 1 . 2 . 3]" 1
2586 2 68 LYS HA 2 68 LYS QD . . 4.550 4.126 3.942 4.359 . 0 0 "[ . 1 . 2 . 3]" 1
2587 1 16 ILE MD 1 41 LEU HG . . 5.490 4.538 3.204 5.180 . 0 0 "[ . 1 . 2 . 3]" 1
2588 2 16 ILE MD 2 41 LEU HG . . 5.490 4.662 3.895 5.228 . 0 0 "[ . 1 . 2 . 3]" 1
2589 1 83 LYS QE 1 84 PHE QE . . 4.670 3.285 2.306 4.516 . 0 0 "[ . 1 . 2 . 3]" 1
2590 2 83 LYS QE 2 84 PHE QE . . 4.670 3.445 2.327 4.476 . 0 0 "[ . 1 . 2 . 3]" 1
2591 1 36 GLU HA 1 39 ASP HB3 . . 4.350 3.334 2.856 4.338 . 0 0 "[ . 1 . 2 . 3]" 1
2592 2 36 GLU HA 2 39 ASP HB3 . . 4.350 3.356 2.913 4.352 0.002 5 0 "[ . 1 . 2 . 3]" 1
2593 1 50 GLN HA 1 50 GLN HG2 . . 4.060 3.290 2.350 3.610 . 0 0 "[ . 1 . 2 . 3]" 1
2594 2 50 GLN HA 2 50 GLN HG2 . . 4.060 3.289 2.341 3.609 . 0 0 "[ . 1 . 2 . 3]" 1
2595 1 50 GLN HA 1 50 GLN HG3 . . 4.060 2.799 2.107 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
2596 2 50 GLN HA 2 50 GLN HG3 . . 4.060 2.798 2.107 3.645 . 0 0 "[ . 1 . 2 . 3]" 1
2597 1 21 LYS HA 1 24 LEU MD2 . . 5.500 5.529 5.473 5.576 0.076 23 0 "[ . 1 . 2 . 3]" 1
2598 2 21 LYS HA 2 24 LEU MD2 . . 5.500 5.521 5.433 5.572 0.072 14 0 "[ . 1 . 2 . 3]" 1
2599 1 55 THR HB 1 58 ILE MD . . 4.840 3.981 3.687 4.311 . 0 0 "[ . 1 . 2 . 3]" 1
2600 2 55 THR HB 2 58 ILE MD . . 4.840 3.965 3.661 4.224 . 0 0 "[ . 1 . 2 . 3]" 1
2601 1 72 VAL MG1 2 35 ILE HG13 . . 5.070 3.188 2.899 3.477 . 0 0 "[ . 1 . 2 . 3]" 1
2602 1 35 ILE HG13 2 72 VAL MG1 . . 5.070 3.197 2.964 3.555 . 0 0 "[ . 1 . 2 . 3]" 1
2603 1 72 VAL MG2 2 35 ILE HG13 . . 5.070 3.576 3.233 5.131 0.061 20 0 "[ . 1 . 2 . 3]" 1
2604 1 35 ILE HG13 2 72 VAL MG2 . . 5.070 3.575 3.231 5.128 0.058 20 0 "[ . 1 . 2 . 3]" 1
2605 1 42 ALA HA 2 80 LEU MD2 . . 4.190 2.648 2.249 4.091 . 0 0 "[ . 1 . 2 . 3]" 1
2606 1 80 LEU MD2 2 42 ALA HA . . 4.190 2.709 2.241 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
2607 2 89 LEU MD1 2 90 VAL HA . . 4.610 3.153 2.642 3.877 . 0 0 "[ . 1 . 2 . 3]" 1
2608 1 38 LEU HA 2 80 LEU MD1 . . 5.090 3.023 2.590 4.904 . 0 0 "[ . 1 . 2 . 3]" 1
2609 1 80 LEU MD1 2 38 LEU HA . . 5.090 3.059 2.565 4.920 . 0 0 "[ . 1 . 2 . 3]" 1
2610 1 41 LEU HA 1 41 LEU HG . . 4.210 3.637 2.850 3.700 . 0 0 "[ . 1 . 2 . 3]" 1
2611 2 41 LEU HA 2 41 LEU HG . . 4.210 3.638 2.906 3.699 . 0 0 "[ . 1 . 2 . 3]" 1
2612 1 76 LYS QB 2 38 LEU MD2 . . 4.260 2.907 1.808 3.671 . 0 0 "[ . 1 . 2 . 3]" 1
2613 1 38 LEU MD2 2 76 LYS QB . . 4.260 2.977 1.817 3.753 . 0 0 "[ . 1 . 2 . 3]" 1
2614 1 6 GLU H 1 6 GLU QB . . 3.230 2.801 2.045 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
2615 1 6 GLU HA 1 6 GLU QG . . 3.710 2.250 1.999 3.383 . 0 0 "[ . 1 . 2 . 3]" 1
2616 1 9 MET HA 1 13 LEU QD . . 5.440 3.993 3.383 4.496 . 0 0 "[ . 1 . 2 . 3]" 1
2617 1 9 MET QB 1 9 MET ME . . 4.220 3.479 2.879 3.712 . 0 0 "[ . 1 . 2 . 3]" 1
2618 1 9 MET QB 1 10 ASP H . . 3.730 2.637 2.496 2.747 . 0 0 "[ . 1 . 2 . 3]" 1
2619 1 9 MET QB 1 13 LEU QD . . 4.660 3.848 3.519 4.120 . 0 0 "[ . 1 . 2 . 3]" 1
2620 1 9 MET ME 1 9 MET QG . . 3.030 2.148 1.998 2.232 . 0 0 "[ . 1 . 2 . 3]" 1
2621 1 9 MET QG 1 13 LEU HG . . 5.040 3.916 2.763 5.049 0.009 8 0 "[ . 1 . 2 . 3]" 1
2622 1 9 MET QG 1 13 LEU QD . . 3.380 2.513 2.136 2.736 . 0 0 "[ . 1 . 2 . 3]" 1
2623 1 9 MET QG 1 46 VAL HA . . 4.950 3.912 3.459 4.444 . 0 0 "[ . 1 . 2 . 3]" 1
2624 1 9 MET ME 1 13 LEU QD . . 3.540 2.873 2.142 3.397 . 0 0 "[ . 1 . 2 . 3]" 1
2625 1 9 MET ME 1 41 LEU QD . . 4.840 4.371 3.776 4.815 . 0 0 "[ . 1 . 2 . 3]" 1
2626 1 9 MET ME 1 44 LEU QB . . 3.900 2.198 1.906 2.714 . 0 0 "[ . 1 . 2 . 3]" 1
2627 1 9 MET ME 1 44 LEU QD . . 3.110 2.352 1.902 2.926 . 0 0 "[ . 1 . 2 . 3]" 1
2628 1 9 MET ME 1 46 VAL QG . . 3.570 2.892 1.851 3.388 . 0 0 "[ . 1 . 2 . 3]" 1
2629 1 10 ASP HA 1 13 LEU QD . . 3.970 3.107 2.606 3.263 . 0 0 "[ . 1 . 2 . 3]" 1
2630 1 12 ARG QB 1 44 LEU QD . . 3.990 3.085 2.647 3.695 . 0 0 "[ . 1 . 2 . 3]" 1
2631 1 12 ARG HG2 1 44 LEU QD . . 5.440 3.658 3.342 4.294 . 0 0 "[ . 1 . 2 . 3]" 1
2632 1 12 ARG HG3 1 44 LEU QD . . 3.930 2.587 2.179 3.084 . 0 0 "[ . 1 . 2 . 3]" 1
2633 1 12 ARG QD 1 44 LEU QD . . 3.500 1.916 1.680 3.158 . 0 0 "[ . 1 . 2 . 3]" 1
2634 1 13 LEU HA 1 13 LEU QD . . 2.970 2.115 1.964 2.298 . 0 0 "[ . 1 . 2 . 3]" 1
2635 1 13 LEU HA 1 41 LEU QD . . 4.510 3.641 3.359 4.518 0.008 18 0 "[ . 1 . 2 . 3]" 1
2636 1 13 LEU HA 1 44 LEU QD . . 4.720 3.387 3.110 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
2637 1 13 LEU HG 1 41 LEU QD . . 4.290 3.356 2.314 4.106 . 0 0 "[ . 1 . 2 . 3]" 1
2638 1 13 LEU HG 1 44 LEU QD . . 4.660 3.219 2.378 4.283 . 0 0 "[ . 1 . 2 . 3]" 1
2639 1 13 LEU QD 1 14 GLN H . . 4.260 4.061 3.977 4.229 . 0 0 "[ . 1 . 2 . 3]" 1
2640 1 13 LEU QD 1 16 ILE H . . 4.780 4.588 4.317 4.829 0.049 20 0 "[ . 1 . 2 . 3]" 1
2641 1 13 LEU QD 1 16 ILE HB . . 4.060 3.555 3.064 3.996 . 0 0 "[ . 1 . 2 . 3]" 1
2642 1 13 LEU QD 1 16 ILE MG . . 4.240 3.866 3.498 4.283 0.043 30 0 "[ . 1 . 2 . 3]" 1
2643 1 13 LEU QD 1 16 ILE MD . . 3.320 2.193 1.878 2.705 . 0 0 "[ . 1 . 2 . 3]" 1
2644 1 13 LEU QD 1 41 LEU HA . . 4.260 3.462 3.312 3.929 . 0 0 "[ . 1 . 2 . 3]" 1
2645 1 13 LEU QD 1 41 LEU HG . . 4.430 4.162 2.620 4.469 0.039 8 0 "[ . 1 . 2 . 3]" 1
2646 1 13 LEU QD 1 41 LEU QD . . 2.800 2.062 1.801 2.552 . 0 0 "[ . 1 . 2 . 3]" 1
2647 1 13 LEU QD 1 44 LEU QB . . 4.270 3.014 2.753 3.500 . 0 0 "[ . 1 . 2 . 3]" 1
2648 1 13 LEU QD 1 44 LEU QD . . 3.100 1.929 1.783 2.362 . 0 0 "[ . 1 . 2 . 3]" 1
2649 1 13 LEU QD 1 46 VAL HA . . 5.440 4.159 3.489 4.686 . 0 0 "[ . 1 . 2 . 3]" 1
2650 1 13 LEU QD 1 46 VAL HB . . 4.790 2.760 2.477 3.794 . 0 0 "[ . 1 . 2 . 3]" 1
2651 1 13 LEU QD 1 46 VAL QG . . 3.200 2.094 1.606 2.391 . 0 0 "[ . 1 . 2 . 3]" 1
2652 1 13 LEU QD 1 47 THR H . . 5.440 5.002 4.575 5.386 . 0 0 "[ . 1 . 2 . 3]" 1
2653 1 13 LEU QD 1 50 GLN HA . . 5.200 4.740 4.348 5.002 . 0 0 "[ . 1 . 2 . 3]" 1
2654 1 13 LEU QD 1 50 GLN QB . . 4.120 2.881 2.568 3.213 . 0 0 "[ . 1 . 2 . 3]" 1
2655 1 13 LEU QD 1 50 GLN QG . . 4.780 3.448 2.452 4.198 . 0 0 "[ . 1 . 2 . 3]" 1
2656 1 13 LEU QD 1 51 ALA H . . 5.440 4.772 4.550 4.951 . 0 0 "[ . 1 . 2 . 3]" 1
2657 1 13 LEU QD 1 54 HIS HB2 . . 5.050 2.966 2.593 3.268 . 0 0 "[ . 1 . 2 . 3]" 1
2658 1 13 LEU QD 1 54 HIS HD2 . . 4.430 3.374 3.226 3.832 . 0 0 "[ . 1 . 2 . 3]" 1
2659 1 13 LEU QD 1 54 HIS HE1 . . 3.930 2.790 2.531 3.253 . 0 0 "[ . 1 . 2 . 3]" 1
2660 1 13 LEU QD 1 57 MET ME . . 2.970 1.998 1.754 2.469 . 0 0 "[ . 1 . 2 . 3]" 1
2661 1 13 LEU QD 2 84 PHE QE . . 5.250 4.168 3.867 4.731 . 0 0 "[ . 1 . 2 . 3]" 1
2662 1 13 LEU QD 2 84 PHE HZ . . 5.440 3.864 3.336 4.566 . 0 0 "[ . 1 . 2 . 3]" 1
2663 1 14 GLN H 1 14 GLN QB . . 3.100 2.349 2.161 2.461 . 0 0 "[ . 1 . 2 . 3]" 1
2664 1 14 GLN H 1 14 GLN QG . . 3.320 2.443 2.170 2.880 . 0 0 "[ . 1 . 2 . 3]" 1
2665 1 14 GLN HA 1 14 GLN QG . . 3.590 3.348 3.226 3.445 . 0 0 "[ . 1 . 2 . 3]" 1
2666 1 14 GLN QB 1 15 ARG H . . 3.720 3.516 3.365 3.577 . 0 0 "[ . 1 . 2 . 3]" 1
2667 1 14 GLN QG 1 15 ARG H . . 4.220 2.208 2.030 2.326 . 0 0 "[ . 1 . 2 . 3]" 1
2668 1 14 GLN QG 1 15 ARG HA . . 4.610 3.301 3.028 3.493 . 0 0 "[ . 1 . 2 . 3]" 1
2669 1 14 GLN QG 1 18 ALA MB . . 5.270 4.398 3.652 4.770 . 0 0 "[ . 1 . 2 . 3]" 1
2670 1 15 ARG H 1 15 ARG QB . . 3.110 2.287 2.077 2.687 . 0 0 "[ . 1 . 2 . 3]" 1
2671 1 15 ARG H 1 15 ARG QG . . 3.750 2.807 1.907 3.589 . 0 0 "[ . 1 . 2 . 3]" 1
2672 1 15 ARG H 1 15 ARG QD . . 4.370 3.847 3.411 4.262 . 0 0 "[ . 1 . 2 . 3]" 1
2673 1 15 ARG QB 1 16 ILE HA . . 4.270 3.954 3.756 4.335 0.065 10 0 "[ . 1 . 2 . 3]" 1
2674 1 15 ARG QB 1 18 ALA MB . . 4.960 4.236 3.916 4.528 . 0 0 "[ . 1 . 2 . 3]" 1
2675 1 15 ARG QB 1 19 GLU QG . . 3.270 3.095 2.930 3.243 . 0 0 "[ . 1 . 2 . 3]" 1
2676 1 15 ARG QG 1 16 ILE H . . 5.090 3.725 2.074 4.489 . 0 0 "[ . 1 . 2 . 3]" 1
2677 1 15 ARG QG 1 19 GLU H . . 5.340 4.994 4.521 5.369 0.029 9 0 "[ . 1 . 2 . 3]" 1
2678 1 15 ARG QG 1 19 GLU QG . . 4.140 3.704 3.019 4.189 0.049 23 0 "[ . 1 . 2 . 3]" 1
2679 1 16 ILE H 1 16 ILE QG . . 3.400 2.233 2.056 2.498 . 0 0 "[ . 1 . 2 . 3]" 1
2680 1 16 ILE HA 1 16 ILE QG . . 3.660 2.400 2.292 2.449 . 0 0 "[ . 1 . 2 . 3]" 1
2681 1 16 ILE HA 1 19 GLU QB . . 4.640 2.769 2.542 3.095 . 0 0 "[ . 1 . 2 . 3]" 1
2682 1 16 ILE MG 1 20 ILE QG . . 4.240 3.301 3.040 3.543 . 0 0 "[ . 1 . 2 . 3]" 1
2683 1 16 ILE MG 1 40 GLU QG . . 4.550 4.141 3.699 4.559 0.009 14 0 "[ . 1 . 2 . 3]" 1
2684 1 16 ILE MG 1 41 LEU QB . . 3.500 2.328 2.028 2.516 . 0 0 "[ . 1 . 2 . 3]" 1
2685 1 16 ILE MG 1 44 LEU QD . . 4.710 3.903 3.501 4.188 . 0 0 "[ . 1 . 2 . 3]" 1
2686 1 16 ILE MD 1 40 GLU QG . . 3.320 2.661 2.089 3.393 0.073 14 0 "[ . 1 . 2 . 3]" 1
2687 1 16 ILE MD 1 41 LEU QB . . 4.330 3.369 2.583 3.824 . 0 0 "[ . 1 . 2 . 3]" 1
2688 1 16 ILE MD 1 41 LEU QD . . 3.380 2.521 1.944 3.255 . 0 0 "[ . 1 . 2 . 3]" 1
2689 1 17 HIS QB 1 18 ALA H . . 3.310 2.544 2.397 2.695 . 0 0 "[ . 1 . 2 . 3]" 1
2690 1 17 HIS QB 1 18 ALA MB . . 4.440 3.871 3.761 3.940 . 0 0 "[ . 1 . 2 . 3]" 1
2691 1 17 HIS QB 1 57 MET ME . . 4.030 3.853 3.644 4.034 0.004 22 0 "[ . 1 . 2 . 3]" 1
2692 1 18 ALA HA 1 21 LYS QE . . 4.250 3.190 2.396 4.279 0.029 14 0 "[ . 1 . 2 . 3]" 1
2693 1 18 ALA MB 1 21 LYS QE . . 5.340 3.879 3.106 5.103 . 0 0 "[ . 1 . 2 . 3]" 1
2694 1 19 GLU H 1 19 GLU QB . . 3.650 2.319 2.239 2.513 . 0 0 "[ . 1 . 2 . 3]" 1
2695 1 20 ILE H 1 20 ILE QG . . 3.560 2.103 1.948 2.250 . 0 0 "[ . 1 . 2 . 3]" 1
2696 1 20 ILE HA 1 20 ILE QG . . 3.640 2.454 2.416 2.464 . 0 0 "[ . 1 . 2 . 3]" 1
2697 1 20 ILE HA 1 23 SER QB . . 4.590 2.749 2.139 3.233 . 0 0 "[ . 1 . 2 . 3]" 1
2698 1 20 ILE MG 1 24 LEU QD . . 3.170 1.843 1.795 2.020 . 0 0 "[ . 1 . 2 . 3]" 1
2699 1 20 ILE MG 1 34 CYS QB . . 4.420 3.078 2.721 3.479 . 0 0 "[ . 1 . 2 . 3]" 1
2700 1 20 ILE QG 1 37 ALA MB . . 2.970 1.923 1.878 2.111 . 0 0 "[ . 1 . 2 . 3]" 1
2701 1 20 ILE MD 1 38 LEU QD . . 3.180 2.702 1.999 3.088 . 0 0 "[ . 1 . 2 . 3]" 1
2702 1 21 LYS H 1 21 LYS QB . . 3.290 2.184 2.051 2.245 . 0 0 "[ . 1 . 2 . 3]" 1
2703 1 21 LYS HA 1 21 LYS QG . . 3.450 2.335 2.211 2.465 . 0 0 "[ . 1 . 2 . 3]" 1
2704 1 21 LYS HA 1 21 LYS QD . . 4.380 4.035 3.540 4.220 . 0 0 "[ . 1 . 2 . 3]" 1
2705 1 21 LYS HA 1 24 LEU QD . . 4.190 3.573 3.439 3.746 . 0 0 "[ . 1 . 2 . 3]" 1
2706 1 21 LYS QB 1 21 LYS QE . . 4.000 2.213 1.919 3.264 . 0 0 "[ . 1 . 2 . 3]" 1
2707 1 21 LYS QB 1 60 THR MG . . 5.320 4.698 4.413 5.031 . 0 0 "[ . 1 . 2 . 3]" 1
2708 1 21 LYS QG 1 22 ASN H . . 4.200 3.860 3.475 4.193 . 0 0 "[ . 1 . 2 . 3]" 1
2709 1 21 LYS QG 1 24 LEU H . . 5.310 4.998 4.815 5.222 . 0 0 "[ . 1 . 2 . 3]" 1
2710 1 22 ASN H 1 22 ASN QB . . 3.120 2.473 2.226 2.728 . 0 0 "[ . 1 . 2 . 3]" 1
2711 1 22 ASN H 1 22 ASN QD . . 4.420 2.675 1.965 3.708 . 0 0 "[ . 1 . 2 . 3]" 1
2712 1 22 ASN H 1 23 SER QB . . 4.820 4.451 4.293 4.733 . 0 0 "[ . 1 . 2 . 3]" 1
2713 1 22 ASN HA 1 25 LYS QG . . 4.770 3.752 3.526 4.132 . 0 0 "[ . 1 . 2 . 3]" 1
2714 1 22 ASN QB 1 23 SER H . . 3.580 3.006 2.734 3.583 0.003 11 0 "[ . 1 . 2 . 3]" 1
2715 1 22 ASN QB 1 23 SER QB . . 4.820 4.259 3.827 4.995 0.175 6 0 "[ . 1 . 2 . 3]" 1
2716 1 22 ASN QB 1 25 LYS QD . . 4.740 3.454 2.793 3.924 . 0 0 "[ . 1 . 2 . 3]" 1
2717 1 23 SER H 1 23 SER QB . . 3.260 2.344 2.238 2.575 . 0 0 "[ . 1 . 2 . 3]" 1
2718 1 23 SER QB 1 24 LEU H . . 4.280 3.571 2.882 3.844 . 0 0 "[ . 1 . 2 . 3]" 1
2719 1 23 SER QB 1 24 LEU QD . . 4.250 4.028 3.563 4.264 0.014 15 0 "[ . 1 . 2 . 3]" 1
2720 1 23 SER QB 1 30 ASP H . . 5.160 3.859 3.707 4.038 . 0 0 "[ . 1 . 2 . 3]" 1
2721 1 23 SER QB 1 34 CYS H . . 4.020 3.019 2.761 3.347 . 0 0 "[ . 1 . 2 . 3]" 1
2722 1 24 LEU H 1 24 LEU QD . . 3.840 3.553 3.429 3.651 . 0 0 "[ . 1 . 2 . 3]" 1
2723 1 24 LEU H 1 29 LEU QD . . 5.440 4.811 4.666 4.970 . 0 0 "[ . 1 . 2 . 3]" 1
2724 1 24 LEU HA 1 24 LEU QD . . 2.910 1.949 1.936 2.057 . 0 0 "[ . 1 . 2 . 3]" 1
2725 1 24 LEU HA 1 29 LEU QD . . 3.270 2.426 2.236 2.635 . 0 0 "[ . 1 . 2 . 3]" 1
2726 1 24 LEU HA 1 31 VAL QG . . 4.550 4.047 3.726 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
2727 1 24 LEU HB2 1 24 LEU QD . . 3.060 2.293 2.239 2.343 . 0 0 "[ . 1 . 2 . 3]" 1
2728 1 24 LEU QD 1 25 LYS H . . 4.820 4.337 4.316 4.349 . 0 0 "[ . 1 . 2 . 3]" 1
2729 1 24 LEU QD 1 29 LEU HA . . 5.430 4.362 4.297 4.449 . 0 0 "[ . 1 . 2 . 3]" 1
2730 1 24 LEU QD 1 29 LEU QB . . 5.380 5.026 4.910 5.147 . 0 0 "[ . 1 . 2 . 3]" 1
2731 1 24 LEU QD 1 29 LEU HG . . 4.170 4.192 4.167 4.234 0.064 18 0 "[ . 1 . 2 . 3]" 1
2732 1 24 LEU QD 1 29 LEU QD . . 3.070 2.610 2.438 2.779 . 0 0 "[ . 1 . 2 . 3]" 1
2733 1 24 LEU QD 1 30 ASP H . . 4.580 4.059 3.860 4.263 . 0 0 "[ . 1 . 2 . 3]" 1
2734 1 24 LEU QD 1 31 VAL HA . . 4.390 2.752 2.483 2.972 . 0 0 "[ . 1 . 2 . 3]" 1
2735 1 24 LEU QD 1 31 VAL QG . . 3.730 2.512 2.253 2.692 . 0 0 "[ . 1 . 2 . 3]" 1
2736 1 24 LEU QD 1 34 CYS HA . . 5.000 3.999 3.781 4.210 . 0 0 "[ . 1 . 2 . 3]" 1
2737 1 24 LEU QD 1 34 CYS QB . . 3.780 2.345 1.972 2.586 . 0 0 "[ . 1 . 2 . 3]" 1
2738 1 24 LEU QD 1 60 THR MG . . 4.140 3.559 3.426 3.662 . 0 0 "[ . 1 . 2 . 3]" 1
2739 1 24 LEU QD 1 64 ILE HA . . 4.750 4.247 4.070 4.477 . 0 0 "[ . 1 . 2 . 3]" 1
2740 1 24 LEU QD 1 64 ILE HB . . 4.430 3.468 3.300 3.734 . 0 0 "[ . 1 . 2 . 3]" 1
2741 1 24 LEU QD 1 64 ILE MG . . 3.380 2.134 1.991 2.318 . 0 0 "[ . 1 . 2 . 3]" 1
2742 1 24 LEU QD 1 67 PHE QE . . 3.540 2.915 2.373 3.119 . 0 0 "[ . 1 . 2 . 3]" 1
2743 1 24 LEU QD 2 26 ILE HB . . 4.190 3.038 2.921 3.108 . 0 0 "[ . 1 . 2 . 3]" 1
2744 1 24 LEU QD 2 26 ILE MG . . 4.140 3.034 2.869 3.177 . 0 0 "[ . 1 . 2 . 3]" 1
2745 1 24 LEU QD 2 69 VAL QG . . 3.730 2.451 1.944 3.158 . 0 0 "[ . 1 . 2 . 3]" 1
2746 1 24 LEU QD 2 73 ILE HB . . 4.950 4.411 4.225 4.547 . 0 0 "[ . 1 . 2 . 3]" 1
2747 1 24 LEU QD 2 73 ILE MG . . 3.170 2.732 2.619 2.850 . 0 0 "[ . 1 . 2 . 3]" 1
2748 1 24 LEU QD 2 73 ILE MD . . 3.290 2.515 2.309 2.673 . 0 0 "[ . 1 . 2 . 3]" 1
2749 1 25 LYS H 1 25 LYS QB . . 3.170 2.056 2.046 2.093 . 0 0 "[ . 1 . 2 . 3]" 1
2750 1 25 LYS H 1 25 LYS QG . . 4.030 3.800 3.649 4.002 . 0 0 "[ . 1 . 2 . 3]" 1
2751 1 25 LYS H 1 28 ASN QB . . 4.470 3.944 3.794 4.113 . 0 0 "[ . 1 . 2 . 3]" 1
2752 1 25 LYS H 1 29 LEU QD . . 4.270 3.824 3.726 3.979 . 0 0 "[ . 1 . 2 . 3]" 1
2753 1 25 LYS HA 1 25 LYS QG . . 3.620 2.250 2.002 2.525 . 0 0 "[ . 1 . 2 . 3]" 1
2754 1 25 LYS QB 1 26 ILE H . . 4.220 2.583 2.463 2.824 . 0 0 "[ . 1 . 2 . 3]" 1
2755 1 25 LYS QB 1 27 ASP H . . 4.230 2.717 2.579 3.027 . 0 0 "[ . 1 . 2 . 3]" 1
2756 1 25 LYS QB 1 28 ASN H . . 3.640 1.880 1.867 1.922 . 0 0 "[ . 1 . 2 . 3]" 1
2757 1 25 LYS QB 1 28 ASN QB . . 3.740 2.324 2.192 2.478 . 0 0 "[ . 1 . 2 . 3]" 1
2758 1 25 LYS QB 1 28 ASN QD . . 5.180 3.803 3.223 4.642 . 0 0 "[ . 1 . 2 . 3]" 1
2759 1 25 LYS QG 1 26 ILE H . . 3.760 2.578 2.006 2.754 . 0 0 "[ . 1 . 2 . 3]" 1
2760 1 25 LYS QG 1 27 ASP H . . 3.850 3.433 3.010 3.684 . 0 0 "[ . 1 . 2 . 3]" 1
2761 1 25 LYS QG 1 28 ASN H . . 4.710 3.411 2.994 3.613 . 0 0 "[ . 1 . 2 . 3]" 1
2762 1 25 LYS QD 1 28 ASN QB . . 5.080 3.680 2.899 4.323 . 0 0 "[ . 1 . 2 . 3]" 1
2763 1 25 LYS QD 1 28 ASN QD . . 5.340 4.500 3.372 5.307 . 0 0 "[ . 1 . 2 . 3]" 1
2764 1 26 ILE H 1 26 ILE QG . . 4.110 4.066 4.060 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
2765 1 26 ILE HA 1 29 LEU QD . . 3.870 3.294 3.035 3.551 . 0 0 "[ . 1 . 2 . 3]" 1
2766 1 26 ILE HB 2 24 LEU QB . . 3.730 2.501 2.477 2.531 . 0 0 "[ . 1 . 2 . 3]" 1
2767 1 26 ILE HB 2 24 LEU QD . . 4.190 3.047 2.974 3.101 . 0 0 "[ . 1 . 2 . 3]" 1
2768 1 26 ILE QG 1 26 ILE MG . . 3.040 2.092 2.070 2.113 . 0 0 "[ . 1 . 2 . 3]" 1
2769 1 26 ILE MG 1 27 ASP QB . . 3.930 2.713 2.522 2.873 . 0 0 "[ . 1 . 2 . 3]" 1
2770 1 26 ILE MG 2 24 LEU QD . . 4.140 3.024 2.863 3.184 . 0 0 "[ . 1 . 2 . 3]" 1
2771 1 26 ILE QG 1 27 ASP H . . 4.360 3.660 3.585 3.715 . 0 0 "[ . 1 . 2 . 3]" 1
2772 1 28 ASN H 1 28 ASN QB . . 3.240 2.417 2.352 2.496 . 0 0 "[ . 1 . 2 . 3]" 1
2773 1 28 ASN QB 1 29 LEU H . . 3.970 3.847 3.830 3.868 . 0 0 "[ . 1 . 2 . 3]" 1
2774 1 29 LEU HA 1 29 LEU QD . . 3.120 2.350 2.189 2.472 . 0 0 "[ . 1 . 2 . 3]" 1
2775 1 29 LEU QB 1 29 LEU QD . . 2.650 1.869 1.845 1.894 . 0 0 "[ . 1 . 2 . 3]" 1
2776 1 29 LEU QB 1 31 VAL QG . . 4.690 4.220 3.950 4.424 . 0 0 "[ . 1 . 2 . 3]" 1
2777 1 29 LEU HG 1 31 VAL QG . . 3.860 2.630 2.378 2.950 . 0 0 "[ . 1 . 2 . 3]" 1
2778 1 29 LEU QD 1 30 ASP H . . 3.540 3.304 3.208 3.381 . 0 0 "[ . 1 . 2 . 3]" 1
2779 1 29 LEU QD 1 31 VAL H . . 4.520 3.634 3.182 3.862 . 0 0 "[ . 1 . 2 . 3]" 1
2780 1 29 LEU QD 1 67 PHE QE . . 4.620 3.625 3.404 3.825 . 0 0 "[ . 1 . 2 . 3]" 1
2781 1 29 LEU QD 2 67 PHE H . . 4.940 4.234 4.184 4.471 . 0 0 "[ . 1 . 2 . 3]" 1
2782 1 29 LEU QD 2 67 PHE QD . . 3.890 1.782 1.721 1.914 . 0 0 "[ . 1 . 2 . 3]" 1
2783 1 29 LEU QD 2 67 PHE QE . . 3.480 2.105 1.874 2.576 . 0 0 "[ . 1 . 2 . 3]" 1
2784 1 30 ASP HA 1 31 VAL QG . . 4.280 3.454 3.402 3.496 . 0 0 "[ . 1 . 2 . 3]" 1
2785 1 31 VAL H 1 31 VAL QG . . 2.770 1.927 1.833 2.006 . 0 0 "[ . 1 . 2 . 3]" 1
2786 1 31 VAL HA 1 34 CYS QB . . 4.260 2.364 2.246 2.492 . 0 0 "[ . 1 . 2 . 3]" 1
2787 1 31 VAL QG 1 32 ASN H . . 3.390 2.083 1.933 2.237 . 0 0 "[ . 1 . 2 . 3]" 1
2788 1 31 VAL QG 1 32 ASN HA . . 4.220 3.369 3.189 3.486 . 0 0 "[ . 1 . 2 . 3]" 1
2789 1 31 VAL QG 1 34 CYS H . . 4.690 4.299 4.282 4.331 . 0 0 "[ . 1 . 2 . 3]" 1
2790 1 31 VAL QG 1 34 CYS QB . . 5.280 3.315 3.228 3.394 . 0 0 "[ . 1 . 2 . 3]" 1
2791 1 31 VAL QG 1 35 ILE H . . 5.440 4.672 4.537 4.835 . 0 0 "[ . 1 . 2 . 3]" 1
2792 1 31 VAL QG 1 67 PHE QE . . 4.800 4.700 4.110 4.848 0.048 14 0 "[ . 1 . 2 . 3]" 1
2793 1 31 VAL QG 2 69 VAL QG . . 3.560 2.925 2.575 3.231 . 0 0 "[ . 1 . 2 . 3]" 1
2794 1 31 VAL QG 2 70 SER QB . . 3.940 2.857 2.631 3.151 . 0 0 "[ . 1 . 2 . 3]" 1
2795 1 31 VAL MG1 2 70 SER HB3 . . 6.320 3.872 3.342 4.942 . 0 0 "[ . 1 . 2 . 3]" 1
2796 1 31 VAL MG2 2 70 SER HB3 . . 6.320 4.160 3.794 4.991 . 0 0 "[ . 1 . 2 . 3]" 1
2797 1 32 ASN H 1 32 ASN QB . . 3.040 2.324 2.082 2.624 . 0 0 "[ . 1 . 2 . 3]" 1
2798 1 32 ASN H 1 32 ASN QD . . 3.970 3.205 2.027 3.995 0.025 3 0 "[ . 1 . 2 . 3]" 1
2799 1 33 ARG H 1 33 ARG QB . . 3.140 2.087 2.068 2.188 . 0 0 "[ . 1 . 2 . 3]" 1
2800 1 33 ARG H 1 33 ARG QG . . 4.040 3.587 3.044 3.914 . 0 0 "[ . 1 . 2 . 3]" 1
2801 1 33 ARG H 1 33 ARG QD . . 4.530 3.428 2.217 4.510 . 0 0 "[ . 1 . 2 . 3]" 1
2802 1 33 ARG H 1 36 GLU QB . . 5.340 5.153 4.981 5.365 0.025 19 0 "[ . 1 . 2 . 3]" 1
2803 1 33 ARG H 1 36 GLU QG . . 4.720 4.594 4.286 4.723 0.003 19 0 "[ . 1 . 2 . 3]" 1
2804 1 33 ARG HA 1 33 ARG QG . . 3.620 2.160 2.004 2.410 . 0 0 "[ . 1 . 2 . 3]" 1
2805 1 33 ARG HA 1 36 GLU QB . . 3.660 2.615 2.475 2.846 . 0 0 "[ . 1 . 2 . 3]" 1
2806 1 33 ARG HA 1 36 GLU QG . . 3.420 2.514 2.107 2.754 . 0 0 "[ . 1 . 2 . 3]" 1
2807 1 33 ARG QB 1 34 CYS H . . 3.890 2.825 2.758 2.872 . 0 0 "[ . 1 . 2 . 3]" 1
2808 1 34 CYS QB 1 35 ILE H . . 3.640 2.269 2.114 2.657 . 0 0 "[ . 1 . 2 . 3]" 1
2809 1 34 CYS QB 1 35 ILE MD . . 4.740 3.455 3.149 3.760 . 0 0 "[ . 1 . 2 . 3]" 1
2810 1 34 CYS QB 2 73 ILE MG . . 4.250 3.326 3.102 3.519 . 0 0 "[ . 1 . 2 . 3]" 1
2811 1 34 CYS QB 2 73 ILE MD . . 3.510 2.063 1.842 2.314 . 0 0 "[ . 1 . 2 . 3]" 1
2812 1 35 ILE H 1 38 LEU QB . . 5.340 4.916 4.709 5.076 . 0 0 "[ . 1 . 2 . 3]" 1
2813 1 35 ILE H 2 72 VAL QG . . 5.440 4.636 4.454 5.306 . 0 0 "[ . 1 . 2 . 3]" 1
2814 1 35 ILE HA 1 35 ILE QG . . 3.600 2.374 2.284 2.406 . 0 0 "[ . 1 . 2 . 3]" 1
2815 1 35 ILE HA 1 38 LEU QB . . 3.960 2.548 2.383 2.751 . 0 0 "[ . 1 . 2 . 3]" 1
2816 1 35 ILE HA 1 38 LEU QD . . 3.530 2.535 2.125 3.215 . 0 0 "[ . 1 . 2 . 3]" 1
2817 1 35 ILE MG 1 36 GLU QG . . 4.560 3.720 3.510 3.894 . 0 0 "[ . 1 . 2 . 3]" 1
2818 1 35 ILE MG 1 38 LEU QB . . 4.140 3.517 3.332 3.904 . 0 0 "[ . 1 . 2 . 3]" 1
2819 1 35 ILE MG 2 76 LYS QE . . 3.240 2.195 1.921 2.602 . 0 0 "[ . 1 . 2 . 3]" 1
2820 1 35 ILE QG 2 72 VAL QG . . 2.960 2.014 1.888 2.241 . 0 0 "[ . 1 . 2 . 3]" 1
2821 1 35 ILE QG 2 73 ILE QG . . 4.750 2.177 2.035 2.310 . 0 0 "[ . 1 . 2 . 3]" 1
2822 1 35 ILE QG 2 73 ILE MD . . 4.720 3.216 2.951 3.503 . 0 0 "[ . 1 . 2 . 3]" 1
2823 1 35 ILE MD 2 72 VAL QG . . 2.890 2.311 2.190 2.884 . 0 0 "[ . 1 . 2 . 3]" 1
2824 1 35 ILE MD 2 73 ILE QG . . 3.740 2.736 2.607 2.835 . 0 0 "[ . 1 . 2 . 3]" 1
2825 1 36 GLU H 1 36 GLU QB . . 3.070 2.462 2.353 2.545 . 0 0 "[ . 1 . 2 . 3]" 1
2826 1 36 GLU H 1 36 GLU QG . . 3.210 2.287 2.086 2.503 . 0 0 "[ . 1 . 2 . 3]" 1
2827 1 36 GLU HA 1 39 ASP QB . . 3.750 2.937 2.802 3.095 . 0 0 "[ . 1 . 2 . 3]" 1
2828 1 36 GLU QB 1 37 ALA H . . 3.380 2.693 2.586 2.727 . 0 0 "[ . 1 . 2 . 3]" 1
2829 1 37 ALA H 1 38 LEU QD . . 5.440 4.620 4.238 4.899 . 0 0 "[ . 1 . 2 . 3]" 1
2830 1 37 ALA MB 1 38 LEU QD . . 4.520 3.791 3.049 4.011 . 0 0 "[ . 1 . 2 . 3]" 1
2831 1 38 LEU H 1 38 LEU QB . . 3.140 2.352 2.078 2.435 . 0 0 "[ . 1 . 2 . 3]" 1
2832 1 38 LEU H 1 38 LEU QD . . 3.630 3.071 2.537 3.225 . 0 0 "[ . 1 . 2 . 3]" 1
2833 1 38 LEU HA 1 38 LEU QD . . 3.060 2.287 1.965 2.682 . 0 0 "[ . 1 . 2 . 3]" 1
2834 1 38 LEU HA 1 41 LEU QB . . 4.240 2.833 2.571 3.054 . 0 0 "[ . 1 . 2 . 3]" 1
2835 1 38 LEU HA 1 41 LEU QD . . 4.660 4.270 3.575 4.470 . 0 0 "[ . 1 . 2 . 3]" 1
2836 1 38 LEU HA 2 80 LEU QD . . 4.420 2.838 2.573 4.027 . 0 0 "[ . 1 . 2 . 3]" 1
2837 1 38 LEU QB 1 38 LEU QD . . 2.860 1.864 1.764 1.940 . 0 0 "[ . 1 . 2 . 3]" 1
2838 1 38 LEU QB 1 39 ASP H . . 3.710 2.643 2.477 2.805 . 0 0 "[ . 1 . 2 . 3]" 1
2839 1 38 LEU QB 2 76 LYS QB . . 4.560 2.588 2.499 2.674 . 0 0 "[ . 1 . 2 . 3]" 1
2840 1 38 LEU QB 2 80 LEU QD . . 4.140 2.755 2.264 3.403 . 0 0 "[ . 1 . 2 . 3]" 1
2841 1 38 LEU QD 1 41 LEU QB . . 4.330 3.655 3.339 4.091 . 0 0 "[ . 1 . 2 . 3]" 1
2842 1 38 LEU QD 1 42 ALA H . . 5.440 5.143 4.834 5.387 . 0 0 "[ . 1 . 2 . 3]" 1
2843 1 38 LEU QD 1 42 ALA MB . . 5.440 4.815 4.608 5.157 . 0 0 "[ . 1 . 2 . 3]" 1
2844 1 38 LEU QD 1 61 LEU QB . . 5.280 4.202 4.046 4.495 . 0 0 "[ . 1 . 2 . 3]" 1
2845 1 38 LEU QD 1 61 LEU QD . . 2.900 2.091 1.826 2.414 . 0 0 "[ . 1 . 2 . 3]" 1
2846 1 38 LEU QD 1 64 ILE HB . . 5.440 4.594 4.346 4.784 . 0 0 "[ . 1 . 2 . 3]" 1
2847 1 38 LEU QD 1 64 ILE QG . . 4.540 4.025 3.862 4.167 . 0 0 "[ . 1 . 2 . 3]" 1
2848 1 38 LEU QD 1 64 ILE MD . . 3.460 2.423 2.227 2.596 . 0 0 "[ . 1 . 2 . 3]" 1
2849 1 38 LEU QD 2 73 ILE H . . 5.440 4.859 4.647 5.074 . 0 0 "[ . 1 . 2 . 3]" 1
2850 1 38 LEU QD 2 73 ILE HA . . 3.630 2.655 2.507 2.832 . 0 0 "[ . 1 . 2 . 3]" 1
2851 1 38 LEU QD 2 73 ILE QG . . 4.300 2.970 2.661 3.558 . 0 0 "[ . 1 . 2 . 3]" 1
2852 1 38 LEU QD 2 73 ILE MD . . 4.780 3.855 3.250 4.321 . 0 0 "[ . 1 . 2 . 3]" 1
2853 1 38 LEU QD 2 74 MET HA . . 5.180 4.828 4.634 4.932 . 0 0 "[ . 1 . 2 . 3]" 1
2854 1 38 LEU QD 2 76 LYS H . . 4.410 4.046 3.757 4.314 . 0 0 "[ . 1 . 2 . 3]" 1
2855 1 38 LEU QD 2 76 LYS HA . . 4.850 4.272 3.880 4.582 . 0 0 "[ . 1 . 2 . 3]" 1
2856 1 38 LEU QD 2 76 LYS QB . . 3.320 2.194 1.814 2.467 . 0 0 "[ . 1 . 2 . 3]" 1
2857 1 38 LEU QD 2 76 LYS QG . . 4.800 3.730 3.355 3.987 . 0 0 "[ . 1 . 2 . 3]" 1
2858 1 38 LEU QD 2 76 LYS QD . . 4.350 2.823 2.317 3.198 . 0 0 "[ . 1 . 2 . 3]" 1
2859 1 38 LEU QD 2 77 SER H . . 3.870 3.101 2.563 3.355 . 0 0 "[ . 1 . 2 . 3]" 1
2860 1 38 LEU QD 2 77 SER HA . . 4.400 2.418 2.094 2.640 . 0 0 "[ . 1 . 2 . 3]" 1
2861 1 38 LEU QD 2 77 SER QB . . 3.600 2.793 2.653 2.890 . 0 0 "[ . 1 . 2 . 3]" 1
2862 1 38 LEU MD2 2 77 SER HB2 . . 5.980 3.756 3.491 4.064 . 0 0 "[ . 1 . 2 . 3]" 1
2863 1 38 LEU QD 2 80 LEU HG . . 5.440 3.279 2.729 3.885 . 0 0 "[ . 1 . 2 . 3]" 1
2864 1 38 LEU QD 2 80 LEU QD . . 2.910 2.019 1.789 2.811 . 0 0 "[ . 1 . 2 . 3]" 1
2865 1 39 ASP H 1 39 ASP QB . . 3.150 2.178 2.058 2.256 . 0 0 "[ . 1 . 2 . 3]" 1
2866 1 39 ASP QB 1 40 GLU H . . 3.650 2.611 2.378 2.832 . 0 0 "[ . 1 . 2 . 3]" 1
2867 1 39 ASP QB 1 42 ALA MB . . 4.600 4.566 4.440 4.626 0.026 18 0 "[ . 1 . 2 . 3]" 1
2868 1 40 GLU H 1 40 GLU QG . . 4.430 3.895 1.979 4.059 . 0 0 "[ . 1 . 2 . 3]" 1
2869 1 40 GLU H 1 41 LEU QB . . 4.900 4.405 4.327 4.483 . 0 0 "[ . 1 . 2 . 3]" 1
2870 1 40 GLU HA 1 40 GLU QG . . 3.440 2.476 2.175 3.111 . 0 0 "[ . 1 . 2 . 3]" 1
2871 1 40 GLU QG 1 41 LEU H . . 4.140 3.844 3.484 4.164 0.024 14 0 "[ . 1 . 2 . 3]" 1
2872 1 41 LEU H 1 44 LEU QD . . 4.660 4.196 3.879 4.491 . 0 0 "[ . 1 . 2 . 3]" 1
2873 1 41 LEU HA 1 41 LEU QD . . 3.060 1.947 1.876 2.461 . 0 0 "[ . 1 . 2 . 3]" 1
2874 1 41 LEU HA 1 44 LEU QB . . 4.650 2.795 2.563 3.253 . 0 0 "[ . 1 . 2 . 3]" 1
2875 1 41 LEU HA 1 44 LEU QD . . 3.540 2.469 1.945 2.839 . 0 0 "[ . 1 . 2 . 3]" 1
2876 1 41 LEU QB 1 41 LEU QD . . 2.850 1.975 1.870 2.058 . 0 0 "[ . 1 . 2 . 3]" 1
2877 1 41 LEU QB 1 42 ALA H . . 4.270 2.455 2.228 2.679 . 0 0 "[ . 1 . 2 . 3]" 1
2878 1 41 LEU QB 1 42 ALA MB . . 4.640 3.736 3.638 3.879 . 0 0 "[ . 1 . 2 . 3]" 1
2879 1 41 LEU QB 2 80 LEU QD . . 4.390 2.081 1.839 2.969 . 0 0 "[ . 1 . 2 . 3]" 1
2880 1 41 LEU HG 1 44 LEU QD . . 5.440 4.955 3.095 5.415 . 0 0 "[ . 1 . 2 . 3]" 1
2881 1 41 LEU HG 2 80 LEU QD . . 4.120 2.770 2.127 3.913 . 0 0 "[ . 1 . 2 . 3]" 1
2882 1 41 LEU QD 1 42 ALA H . . 4.620 3.217 2.879 3.543 . 0 0 "[ . 1 . 2 . 3]" 1
2883 1 41 LEU QD 1 42 ALA HA . . 5.440 2.983 2.684 3.811 . 0 0 "[ . 1 . 2 . 3]" 1
2884 1 41 LEU QD 1 44 LEU H . . 4.480 3.988 3.646 4.519 0.039 21 0 "[ . 1 . 2 . 3]" 1
2885 1 41 LEU QD 1 44 LEU QB . . 4.280 2.809 2.358 3.228 . 0 0 "[ . 1 . 2 . 3]" 1
2886 1 41 LEU QD 1 44 LEU HG . . 4.810 3.995 2.835 4.651 . 0 0 "[ . 1 . 2 . 3]" 1
2887 1 41 LEU QD 1 44 LEU QD . . 3.260 2.537 1.844 2.878 . 0 0 "[ . 1 . 2 . 3]" 1
2888 1 41 LEU QD 1 46 VAL HB . . 4.220 3.881 3.321 4.175 . 0 0 "[ . 1 . 2 . 3]" 1
2889 1 41 LEU QD 1 57 MET ME . . 2.880 1.955 1.847 2.368 . 0 0 "[ . 1 . 2 . 3]" 1
2890 1 41 LEU QD 1 61 LEU QD . . 3.420 3.078 2.382 3.379 . 0 0 "[ . 1 . 2 . 3]" 1
2891 1 41 LEU QD 2 80 LEU QB . . 4.260 2.801 2.104 3.687 . 0 0 "[ . 1 . 2 . 3]" 1
2892 1 41 LEU QD 2 84 PHE QD . . 4.320 3.895 3.701 4.016 . 0 0 "[ . 1 . 2 . 3]" 1
2893 1 41 LEU QD 2 84 PHE QE . . 3.800 2.013 1.918 2.300 . 0 0 "[ . 1 . 2 . 3]" 1
2894 1 41 LEU QD 2 84 PHE HZ . . 3.510 2.009 1.836 2.333 . 0 0 "[ . 1 . 2 . 3]" 1
2895 1 42 ALA H 2 80 LEU QD . . 3.590 2.738 2.449 3.094 . 0 0 "[ . 1 . 2 . 3]" 1
2896 1 42 ALA HA 2 80 LEU QD . . 3.070 2.361 1.954 2.585 . 0 0 "[ . 1 . 2 . 3]" 1
2897 1 42 ALA MB 2 80 LEU QD . . 2.820 2.068 1.871 2.360 . 0 0 "[ . 1 . 2 . 3]" 1
2898 1 43 SER H 1 43 SER QB . . 3.610 2.202 2.076 2.438 . 0 0 "[ . 1 . 2 . 3]" 1
2899 1 43 SER H 1 44 LEU QB . . 4.570 4.466 4.281 4.571 0.001 26 0 "[ . 1 . 2 . 3]" 1
2900 1 43 SER H 2 80 LEU QD . . 4.930 4.497 4.377 4.649 . 0 0 "[ . 1 . 2 . 3]" 1
2901 1 44 LEU H 1 44 LEU QB . . 3.260 2.374 2.259 2.632 . 0 0 "[ . 1 . 2 . 3]" 1
2902 1 44 LEU H 1 44 LEU QD . . 3.280 3.173 3.071 3.315 0.035 18 0 "[ . 1 . 2 . 3]" 1
2903 1 44 LEU H 1 46 VAL QG . . 5.140 5.057 4.512 5.195 0.055 9 0 "[ . 1 . 2 . 3]" 1
2904 1 44 LEU HA 1 44 LEU QD . . 3.010 2.064 1.939 2.317 . 0 0 "[ . 1 . 2 . 3]" 1
2905 1 44 LEU QB 1 44 LEU QD . . 2.790 1.928 1.854 1.953 . 0 0 "[ . 1 . 2 . 3]" 1
2906 1 44 LEU QB 1 46 VAL H . . 4.110 3.264 2.858 3.681 . 0 0 "[ . 1 . 2 . 3]" 1
2907 1 44 LEU QB 1 46 VAL QG . . 3.650 3.244 2.486 3.620 . 0 0 "[ . 1 . 2 . 3]" 1
2908 1 44 LEU QD 1 45 GLN H . . 4.670 3.519 2.968 4.171 . 0 0 "[ . 1 . 2 . 3]" 1
2909 1 44 LEU QD 1 46 VAL QG . . 4.970 3.840 3.184 4.241 . 0 0 "[ . 1 . 2 . 3]" 1
2910 1 44 LEU QD 1 57 MET ME . . 5.290 4.467 3.867 4.969 . 0 0 "[ . 1 . 2 . 3]" 1
2911 1 45 GLN HA 1 45 GLN QG . . 3.720 2.303 2.137 2.703 . 0 0 "[ . 1 . 2 . 3]" 1
2912 1 45 GLN QG 1 46 VAL H . . 4.710 4.238 3.881 4.648 . 0 0 "[ . 1 . 2 . 3]" 1
2913 1 46 VAL H 1 46 VAL QG . . 3.060 1.964 1.912 2.129 . 0 0 "[ . 1 . 2 . 3]" 1
2914 1 46 VAL HA 1 50 GLN QB . . 4.680 3.717 3.192 4.298 . 0 0 "[ . 1 . 2 . 3]" 1
2915 1 46 VAL QG 1 47 THR H . . 3.430 2.222 1.953 2.716 . 0 0 "[ . 1 . 2 . 3]" 1
2916 1 46 VAL QG 1 47 THR HB . . 4.730 4.381 4.083 4.729 . 0 0 "[ . 1 . 2 . 3]" 1
2917 1 46 VAL QG 1 47 THR MG . . 4.240 3.205 2.721 3.545 . 0 0 "[ . 1 . 2 . 3]" 1
2918 1 46 VAL QG 1 50 GLN H . . 4.290 3.491 3.232 4.038 . 0 0 "[ . 1 . 2 . 3]" 1
2919 1 46 VAL QG 1 50 GLN QB . . 3.270 1.894 1.722 2.321 . 0 0 "[ . 1 . 2 . 3]" 1
2920 1 46 VAL QG 1 50 GLN QG . . 4.000 3.169 2.861 3.620 . 0 0 "[ . 1 . 2 . 3]" 1
2921 1 46 VAL QG 1 51 ALA H . . 3.700 2.660 2.293 3.018 . 0 0 "[ . 1 . 2 . 3]" 1
2922 1 46 VAL QG 1 51 ALA MB . . 3.180 2.478 2.040 2.983 . 0 0 "[ . 1 . 2 . 3]" 1
2923 1 46 VAL QG 1 54 HIS HB2 . . 4.760 4.010 3.386 4.385 . 0 0 "[ . 1 . 2 . 3]" 1
2924 1 46 VAL QG 1 58 ILE MD . . 4.780 4.454 4.060 4.783 0.003 4 0 "[ . 1 . 2 . 3]" 1
2925 1 46 VAL QG 2 84 PHE QD . . 4.540 3.613 3.231 3.889 . 0 0 "[ . 1 . 2 . 3]" 1
2926 1 46 VAL QG 2 84 PHE QE . . 3.730 1.948 1.805 2.302 . 0 0 "[ . 1 . 2 . 3]" 1
2927 1 46 VAL QG 2 84 PHE HZ . . 4.240 2.430 1.940 2.768 . 0 0 "[ . 1 . 2 . 3]" 1
2928 1 46 VAL QG 2 87 MET ME . . 3.840 3.045 2.593 3.443 . 0 0 "[ . 1 . 2 . 3]" 1
2929 1 47 THR H 1 50 GLN QB . . 3.540 2.799 2.276 3.153 . 0 0 "[ . 1 . 2 . 3]" 1
2930 1 47 THR H 1 50 GLN QG . . 4.500 4.223 3.587 4.504 0.004 18 0 "[ . 1 . 2 . 3]" 1
2931 1 47 THR MG 1 49 GLN QB . . 3.880 1.964 1.861 2.205 . 0 0 "[ . 1 . 2 . 3]" 1
2932 1 47 THR MG 1 49 GLN QG . . 4.580 2.849 2.000 3.628 . 0 0 "[ . 1 . 2 . 3]" 1
2933 1 47 THR MG 1 49 GLN QE . . 4.090 3.024 2.100 3.956 . 0 0 "[ . 1 . 2 . 3]" 1
2934 1 47 THR MG 1 50 GLN QB . . 4.810 2.561 1.977 2.923 . 0 0 "[ . 1 . 2 . 3]" 1
2935 1 48 MET H 1 48 MET QB . . 3.620 2.169 2.056 2.248 . 0 0 "[ . 1 . 2 . 3]" 1
2936 1 48 MET HA 1 52 GLN QG . . 4.800 4.126 3.695 4.735 . 0 0 "[ . 1 . 2 . 3]" 1
2937 1 48 MET QB 1 49 GLN H . . 3.110 2.663 2.454 2.739 . 0 0 "[ . 1 . 2 . 3]" 1
2938 1 48 MET QB 1 51 ALA MB . . 4.540 3.971 3.795 4.291 . 0 0 "[ . 1 . 2 . 3]" 1
2939 1 48 MET QB 2 87 MET ME . . 3.940 3.288 2.600 3.940 . 9 0 "[ . 1 . 2 . 3]" 1
2940 1 48 MET ME 1 48 MET QG . . 3.500 2.162 2.016 2.232 . 0 0 "[ . 1 . 2 . 3]" 1
2941 1 48 MET QG 1 51 ALA MB . . 4.320 3.419 3.005 4.100 . 0 0 "[ . 1 . 2 . 3]" 1
2942 1 48 MET ME 1 52 GLN QG . . 3.540 2.267 1.767 3.114 . 0 0 "[ . 1 . 2 . 3]" 1
2943 1 48 MET ME 2 88 PHE QB . . 5.010 3.792 3.483 4.179 . 0 0 "[ . 1 . 2 . 3]" 1
2944 1 49 GLN H 1 49 GLN QB . . 3.010 2.408 2.047 2.622 . 0 0 "[ . 1 . 2 . 3]" 1
2945 1 49 GLN H 1 49 GLN QG . . 3.460 2.397 1.937 3.310 . 0 0 "[ . 1 . 2 . 3]" 1
2946 1 49 GLN HA 1 52 GLN QG . . 4.980 3.672 2.683 4.416 . 0 0 "[ . 1 . 2 . 3]" 1
2947 1 49 GLN HA 1 52 GLN QE . . 4.620 3.822 2.090 4.605 . 0 0 "[ . 1 . 2 . 3]" 1
2948 1 49 GLN QB 1 49 GLN QE . . 3.870 2.805 2.161 3.435 . 0 0 "[ . 1 . 2 . 3]" 1
2949 1 49 GLN QB 1 51 ALA H . . 4.890 4.417 4.327 4.675 . 0 0 "[ . 1 . 2 . 3]" 1
2950 1 50 GLN H 1 50 GLN QB . . 3.070 2.116 2.050 2.243 . 0 0 "[ . 1 . 2 . 3]" 1
2951 1 50 GLN H 1 50 GLN QG . . 4.130 3.449 2.657 3.887 . 0 0 "[ . 1 . 2 . 3]" 1
2952 1 50 GLN QB 1 51 ALA H . . 3.420 2.763 2.614 2.814 . 0 0 "[ . 1 . 2 . 3]" 1
2953 1 50 GLN QB 1 51 ALA MB . . 5.170 3.970 3.875 4.028 . 0 0 "[ . 1 . 2 . 3]" 1
2954 1 50 GLN QB 1 54 HIS HE1 . . 4.730 3.581 3.263 4.281 . 0 0 "[ . 1 . 2 . 3]" 1
2955 1 50 GLN QG 1 51 ALA H . . 5.340 4.520 4.322 4.610 . 0 0 "[ . 1 . 2 . 3]" 1
2956 1 51 ALA MB 1 52 GLN QG . . 4.390 3.687 3.191 4.157 . 0 0 "[ . 1 . 2 . 3]" 1
2957 1 51 ALA MB 2 87 MET QB . . 5.340 4.059 3.509 4.718 . 0 0 "[ . 1 . 2 . 3]" 1
2958 1 52 GLN H 1 52 GLN QB . . 3.110 2.264 2.072 2.606 . 0 0 "[ . 1 . 2 . 3]" 1
2959 1 52 GLN H 1 52 GLN QG . . 3.270 2.703 2.145 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
2960 1 52 GLN HA 1 52 GLN QG . . 3.590 2.187 2.012 2.478 . 0 0 "[ . 1 . 2 . 3]" 1
2961 1 52 GLN QB 1 55 THR MG . . 4.300 3.734 3.421 3.926 . 0 0 "[ . 1 . 2 . 3]" 1
2962 1 52 GLN QG 1 53 LYS H . . 4.760 4.308 3.917 4.498 . 0 0 "[ . 1 . 2 . 3]" 1
2963 1 52 GLN QG 1 55 THR MG . . 4.880 3.658 3.141 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
2964 1 53 LYS H 1 53 LYS QG . . 3.500 2.705 2.160 3.372 . 0 0 "[ . 1 . 2 . 3]" 1
2965 1 53 LYS HA 1 53 LYS QG . . 3.620 2.494 2.058 2.834 . 0 0 "[ . 1 . 2 . 3]" 1
2966 1 53 LYS QG 1 54 HIS H . . 4.840 4.276 4.012 4.532 . 0 0 "[ . 1 . 2 . 3]" 1
2967 1 54 HIS HA 1 57 MET QB . . 4.810 3.883 3.679 4.155 . 0 0 "[ . 1 . 2 . 3]" 1
2968 1 54 HIS HB3 1 57 MET QB . . 4.530 2.459 2.209 2.705 . 0 0 "[ . 1 . 2 . 3]" 1
2969 1 55 THR H 1 56 GLU QB . . 5.180 4.389 4.292 4.489 . 0 0 "[ . 1 . 2 . 3]" 1
2970 1 55 THR HA 1 58 ILE QG . . 4.650 3.587 2.672 4.227 . 0 0 "[ . 1 . 2 . 3]" 1
2971 1 56 GLU HA 1 56 GLU QG . . 3.690 2.176 2.000 2.359 . 0 0 "[ . 1 . 2 . 3]" 1
2972 1 56 GLU QB 1 57 MET H . . 3.420 2.595 2.392 2.765 . 0 0 "[ . 1 . 2 . 3]" 1
2973 1 56 GLU QB 1 58 ILE H . . 5.290 4.673 4.490 4.922 . 0 0 "[ . 1 . 2 . 3]" 1
2974 1 57 MET H 1 57 MET QB . . 3.170 2.232 2.172 2.248 . 0 0 "[ . 1 . 2 . 3]" 1
2975 1 57 MET QB 1 57 MET ME . . 2.950 1.957 1.895 2.135 . 0 0 "[ . 1 . 2 . 3]" 1
2976 1 57 MET QB 1 58 ILE H . . 3.780 2.561 2.221 2.751 . 0 0 "[ . 1 . 2 . 3]" 1
2977 1 57 MET ME 1 57 MET QG . . 3.230 2.448 2.362 2.555 . 0 0 "[ . 1 . 2 . 3]" 1
2978 1 57 MET QG 1 58 ILE H . . 4.440 3.652 3.232 4.151 . 0 0 "[ . 1 . 2 . 3]" 1
2979 1 57 MET QG 1 58 ILE HA . . 4.800 3.728 3.348 4.600 . 0 0 "[ . 1 . 2 . 3]" 1
2980 1 57 MET QG 1 58 ILE MD . . 5.340 4.884 4.277 5.314 . 0 0 "[ . 1 . 2 . 3]" 1
2981 1 57 MET ME 1 58 ILE QG . . 4.140 3.285 2.947 3.563 . 0 0 "[ . 1 . 2 . 3]" 1
2982 1 57 MET ME 1 61 LEU QD . . 4.200 3.690 3.510 3.980 . 0 0 "[ . 1 . 2 . 3]" 1
2983 1 58 ILE HA 1 61 LEU QB . . 4.560 2.825 2.499 3.007 . 0 0 "[ . 1 . 2 . 3]" 1
2984 1 58 ILE HA 1 61 LEU QD . . 3.600 1.970 1.905 2.080 . 0 0 "[ . 1 . 2 . 3]" 1
2985 1 58 ILE QG 1 58 ILE MG . . 3.010 2.131 1.938 2.329 . 0 0 "[ . 1 . 2 . 3]" 1
2986 1 58 ILE MG 1 61 LEU QD . . 3.650 2.663 2.377 2.865 . 0 0 "[ . 1 . 2 . 3]" 1
2987 1 58 ILE MG 1 62 LYS QB . . 5.340 3.924 3.587 4.213 . 0 0 "[ . 1 . 2 . 3]" 1
2988 1 58 ILE MG 2 84 PHE QB . . 3.760 2.387 2.116 2.687 . 0 0 "[ . 1 . 2 . 3]" 1
2989 1 58 ILE QG 2 84 PHE QB . . 4.370 2.574 2.194 3.385 . 0 0 "[ . 1 . 2 . 3]" 1
2990 1 58 ILE QG 2 84 PHE QD . . 3.800 2.570 1.963 3.089 . 0 0 "[ . 1 . 2 . 3]" 1
2991 1 58 ILE MD 2 84 PHE QB . . 3.550 2.551 1.902 3.097 . 0 0 "[ . 1 . 2 . 3]" 1
2992 1 59 THR MG 1 63 LYS QB . . 4.880 4.381 3.893 4.752 . 0 0 "[ . 1 . 2 . 3]" 1
2993 1 59 THR MG 1 63 LYS QG . . 4.450 2.997 2.632 3.573 . 0 0 "[ . 1 . 2 . 3]" 1
2994 1 60 THR MG 1 61 LEU QD . . 4.750 4.093 3.919 4.320 . 0 0 "[ . 1 . 2 . 3]" 1
2995 1 60 THR MG 1 63 LYS QB . . 3.750 2.970 2.800 3.151 . 0 0 "[ . 1 . 2 . 3]" 1
2996 1 60 THR MG 1 63 LYS QG . . 5.340 4.252 3.776 4.860 . 0 0 "[ . 1 . 2 . 3]" 1
2997 1 61 LEU H 1 61 LEU QB . . 3.480 2.374 2.304 2.448 . 0 0 "[ . 1 . 2 . 3]" 1
2998 1 61 LEU H 1 61 LEU QD . . 3.570 3.130 3.084 3.207 . 0 0 "[ . 1 . 2 . 3]" 1
2999 1 61 LEU H 1 64 ILE QG . . 4.870 4.104 4.062 4.138 . 0 0 "[ . 1 . 2 . 3]" 1
3000 1 61 LEU HA 1 61 LEU QD . . 3.080 2.233 2.056 2.480 . 0 0 "[ . 1 . 2 . 3]" 1
3001 1 61 LEU HA 1 64 ILE QG . . 4.040 1.989 1.962 2.053 . 0 0 "[ . 1 . 2 . 3]" 1
3002 1 61 LEU QB 1 63 LYS H . . 5.230 4.563 4.506 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
3003 1 61 LEU QB 2 77 SER QB . . 4.610 3.054 2.899 3.155 . 0 0 "[ . 1 . 2 . 3]" 1
3004 1 61 LEU QB 2 81 TYR H . . 4.570 3.501 3.393 3.660 . 0 0 "[ . 1 . 2 . 3]" 1
3005 1 61 LEU QB 2 81 TYR HA . . 4.510 3.205 3.070 3.370 . 0 0 "[ . 1 . 2 . 3]" 1
3006 1 61 LEU QB 2 81 TYR QB . . 4.690 2.523 2.256 2.679 . 0 0 "[ . 1 . 2 . 3]" 1
3007 1 61 LEU QD 1 62 LYS H . . 4.330 4.099 4.041 4.145 . 0 0 "[ . 1 . 2 . 3]" 1
3008 1 61 LEU QD 1 63 LYS H . . 5.440 5.384 5.337 5.431 . 0 0 "[ . 1 . 2 . 3]" 1
3009 1 61 LEU QD 1 64 ILE QG . . 4.270 3.380 3.299 3.455 . 0 0 "[ . 1 . 2 . 3]" 1
3010 1 61 LEU QD 1 64 ILE MD . . 2.840 1.980 1.920 2.088 . 0 0 "[ . 1 . 2 . 3]" 1
3011 1 61 LEU QD 2 77 SER H . . 4.870 4.618 4.324 4.817 . 0 0 "[ . 1 . 2 . 3]" 1
3012 1 61 LEU QD 2 77 SER QB . . 4.010 2.785 2.407 3.025 . 0 0 "[ . 1 . 2 . 3]" 1
3013 1 61 LEU QD 2 78 THR H . . 5.440 4.978 4.672 5.173 . 0 0 "[ . 1 . 2 . 3]" 1
3014 1 61 LEU QD 2 80 LEU H . . 4.500 3.823 3.591 3.990 . 0 0 "[ . 1 . 2 . 3]" 1
3015 1 61 LEU QD 2 80 LEU QB . . 3.200 1.921 1.802 1.990 . 0 0 "[ . 1 . 2 . 3]" 1
3016 1 61 LEU MD1 2 80 LEU HB3 . . 5.290 2.290 2.052 2.538 . 0 0 "[ . 1 . 2 . 3]" 1
3017 1 61 LEU QD 2 80 LEU QD . . 3.120 2.231 1.863 3.012 . 0 0 "[ . 1 . 2 . 3]" 1
3018 1 61 LEU QD 2 81 TYR H . . 4.300 3.274 3.046 3.450 . 0 0 "[ . 1 . 2 . 3]" 1
3019 1 61 LEU QD 2 81 TYR HA . . 3.670 2.827 2.614 3.092 . 0 0 "[ . 1 . 2 . 3]" 1
3020 1 61 LEU QD 2 81 TYR QB . . 4.740 3.341 3.127 3.468 . 0 0 "[ . 1 . 2 . 3]" 1
3021 1 61 LEU QD 2 81 TYR QD . . 5.110 3.740 3.437 4.095 . 0 0 "[ . 1 . 2 . 3]" 1
3022 1 61 LEU QD 2 84 PHE QD . . 4.240 2.654 2.501 2.770 . 0 0 "[ . 1 . 2 . 3]" 1
3023 1 61 LEU QD 2 84 PHE QE . . 3.890 2.546 2.189 2.990 . 0 0 "[ . 1 . 2 . 3]" 1
3024 1 62 LYS H 1 62 LYS QG . . 4.420 3.924 2.496 4.037 . 0 0 "[ . 1 . 2 . 3]" 1
3025 1 62 LYS QB 1 63 LYS H . . 3.430 2.868 2.819 3.545 0.115 19 0 "[ . 1 . 2 . 3]" 1
3026 1 62 LYS QB 2 81 TYR QE . . 4.570 2.690 2.064 3.081 . 0 0 "[ . 1 . 2 . 3]" 1
3027 1 62 LYS QE 1 62 LYS QG . . 3.150 2.124 1.957 2.436 . 0 0 "[ . 1 . 2 . 3]" 1
3028 1 63 LYS H 1 63 LYS QB . . 3.200 2.298 2.108 2.472 . 0 0 "[ . 1 . 2 . 3]" 1
3029 1 63 LYS H 1 63 LYS QG . . 3.540 2.642 2.222 3.123 . 0 0 "[ . 1 . 2 . 3]" 1
3030 1 63 LYS HA 1 63 LYS QG . . 3.640 2.462 2.224 2.753 . 0 0 "[ . 1 . 2 . 3]" 1
3031 1 63 LYS QB 1 64 ILE H . . 3.900 2.724 2.669 2.810 . 0 0 "[ . 1 . 2 . 3]" 1
3032 1 64 ILE HB 1 67 PHE QB . . 4.450 4.005 3.750 4.093 . 0 0 "[ . 1 . 2 . 3]" 1
3033 1 64 ILE QG 1 64 ILE MG . . 3.110 2.276 2.270 2.284 . 0 0 "[ . 1 . 2 . 3]" 1
3034 1 64 ILE MG 1 67 PHE QB . . 4.080 3.331 3.263 3.383 . 0 0 "[ . 1 . 2 . 3]" 1
3035 1 64 ILE QG 1 65 ARG H . . 3.620 2.946 2.876 2.966 . 0 0 "[ . 1 . 2 . 3]" 1
3036 1 64 ILE QG 2 73 ILE MG . . 4.970 3.828 3.722 3.930 . 0 0 "[ . 1 . 2 . 3]" 1
3037 1 64 ILE QG 2 77 SER QB . . 4.070 2.149 2.113 2.216 . 0 0 "[ . 1 . 2 . 3]" 1
3038 1 64 ILE MD 2 80 LEU QD . . 5.160 4.399 4.087 5.173 0.013 3 0 "[ . 1 . 2 . 3]" 1
3039 1 65 ARG H 1 65 ARG QG . . 3.400 2.659 2.632 2.827 . 0 0 "[ . 1 . 2 . 3]" 1
3040 1 65 ARG H 1 65 ARG QD . . 4.330 3.727 3.669 3.973 . 0 0 "[ . 1 . 2 . 3]" 1
3041 1 65 ARG H 1 67 PHE QB . . 5.130 4.029 3.986 4.150 . 0 0 "[ . 1 . 2 . 3]" 1
3042 1 65 ARG QG 1 66 ARG H . . 3.770 2.118 2.010 2.251 . 0 0 "[ . 1 . 2 . 3]" 1
3043 1 65 ARG QG 1 66 ARG QB . . 3.980 2.466 2.392 2.565 . 0 0 "[ . 1 . 2 . 3]" 1
3044 1 65 ARG QG 1 67 PHE H . . 5.340 3.824 3.761 4.149 . 0 0 "[ . 1 . 2 . 3]" 1
3045 1 65 ARG QD 1 66 ARG QB . . 4.520 3.974 3.711 4.161 . 0 0 "[ . 1 . 2 . 3]" 1
3046 1 66 ARG H 1 66 ARG QB . . 3.220 2.865 2.820 2.966 . 0 0 "[ . 1 . 2 . 3]" 1
3047 1 66 ARG H 1 66 ARG QG . . 3.550 2.206 1.984 2.370 . 0 0 "[ . 1 . 2 . 3]" 1
3048 1 66 ARG HA 1 66 ARG QG . . 3.590 3.410 3.371 3.428 . 0 0 "[ . 1 . 2 . 3]" 1
3049 1 66 ARG QG 1 67 PHE H . . 4.660 2.467 2.282 3.485 . 0 0 "[ . 1 . 2 . 3]" 1
3050 1 67 PHE H 2 29 LEU QD . . 4.940 4.227 4.154 4.487 . 0 0 "[ . 1 . 2 . 3]" 1
3051 1 67 PHE QD 2 29 LEU QD . . 3.890 1.787 1.721 1.888 . 0 0 "[ . 1 . 2 . 3]" 1
3052 1 67 PHE QE 2 29 LEU QD . . 3.480 2.128 1.871 2.621 . 0 0 "[ . 1 . 2 . 3]" 1
3053 1 68 LYS H 1 68 LYS QB . . 3.680 3.072 2.915 3.261 . 0 0 "[ . 1 . 2 . 3]" 1
3054 1 68 LYS HA 1 69 VAL QG . . 4.700 3.656 3.324 4.011 . 0 0 "[ . 1 . 2 . 3]" 1
3055 1 68 LYS QB 1 69 VAL H . . 4.060 3.369 2.615 3.711 . 0 0 "[ . 1 . 2 . 3]" 1
3056 1 69 VAL H 1 69 VAL QG . . 3.090 2.015 1.847 2.386 . 0 0 "[ . 1 . 2 . 3]" 1
3057 1 69 VAL QG 1 70 SER HA . . 5.240 3.994 3.681 4.404 . 0 0 "[ . 1 . 2 . 3]" 1
3058 1 69 VAL QG 1 74 MET ME . . 3.710 2.215 1.893 2.674 . 0 0 "[ . 1 . 2 . 3]" 1
3059 1 69 VAL QG 2 24 LEU QD . . 3.730 2.476 1.876 3.064 . 0 0 "[ . 1 . 2 . 3]" 1
3060 1 69 VAL QG 2 31 VAL QG . . 3.560 2.945 2.775 3.235 . 0 0 "[ . 1 . 2 . 3]" 1
3061 1 70 SER H 1 70 SER QB . . 3.450 2.251 2.089 2.336 . 0 0 "[ . 1 . 2 . 3]" 1
3062 1 70 SER H 1 72 VAL QG . . 5.440 4.110 3.766 5.296 . 0 0 "[ . 1 . 2 . 3]" 1
3063 1 70 SER H 1 73 ILE QG . . 5.070 3.720 3.050 4.382 . 0 0 "[ . 1 . 2 . 3]" 1
3064 1 70 SER QB 1 72 VAL QG . . 3.810 2.059 1.872 3.073 . 0 0 "[ . 1 . 2 . 3]" 1
3065 1 70 SER QB 1 73 ILE H . . 4.010 2.952 2.599 3.200 . 0 0 "[ . 1 . 2 . 3]" 1
3066 1 70 SER QB 1 73 ILE HB . . 4.220 3.828 3.316 4.044 . 0 0 "[ . 1 . 2 . 3]" 1
3067 1 70 SER QB 1 73 ILE MD . . 3.560 2.829 2.501 3.226 . 0 0 "[ . 1 . 2 . 3]" 1
3068 1 70 SER QB 1 74 MET H . . 5.020 4.708 4.456 4.910 . 0 0 "[ . 1 . 2 . 3]" 1
3069 1 70 SER QB 2 31 VAL QG . . 3.940 2.850 2.641 3.146 . 0 0 "[ . 1 . 2 . 3]" 1
3070 1 70 SER HB3 2 31 VAL MG1 . . 6.320 3.866 3.339 5.055 . 0 0 "[ . 1 . 2 . 3]" 1
3071 1 70 SER HB3 2 31 VAL MG2 . . 6.320 4.148 3.756 4.980 . 0 0 "[ . 1 . 2 . 3]" 1
3072 1 71 GLN HA 1 74 MET QB . . 4.020 2.806 2.256 3.929 . 0 0 "[ . 1 . 2 . 3]" 1
3073 1 71 GLN HA 1 74 MET QG . . 4.400 2.878 1.935 3.348 . 0 0 "[ . 1 . 2 . 3]" 1
3074 1 71 GLN QB 1 72 VAL H . . 3.650 2.830 2.583 3.495 . 0 0 "[ . 1 . 2 . 3]" 1
3075 1 71 GLN QG 1 72 VAL QG . . 5.000 4.483 3.366 5.006 0.006 23 0 "[ . 1 . 2 . 3]" 1
3076 1 72 VAL H 1 72 VAL QG . . 2.980 1.931 1.903 2.179 . 0 0 "[ . 1 . 2 . 3]" 1
3077 1 72 VAL H 1 74 MET QG . . 5.340 5.073 4.183 5.346 0.006 23 0 "[ . 1 . 2 . 3]" 1
3078 1 72 VAL HA 1 75 GLU QB . . 4.120 2.946 2.302 4.089 . 0 0 "[ . 1 . 2 . 3]" 1
3079 1 72 VAL HA 1 76 LYS QD . . 5.070 4.549 3.978 4.975 . 0 0 "[ . 1 . 2 . 3]" 1
3080 1 72 VAL QG 1 73 ILE H . . 3.650 2.111 1.982 3.212 . 0 0 "[ . 1 . 2 . 3]" 1
3081 1 72 VAL QG 1 73 ILE HA . . 4.470 3.078 2.989 3.546 . 0 0 "[ . 1 . 2 . 3]" 1
3082 1 72 VAL QG 1 76 LYS H . . 4.610 3.951 3.680 4.233 . 0 0 "[ . 1 . 2 . 3]" 1
3083 1 72 VAL QG 1 76 LYS QD . . 3.520 2.351 1.928 2.681 . 0 0 "[ . 1 . 2 . 3]" 1
3084 1 72 VAL QG 1 76 LYS QE . . 3.130 2.700 2.007 3.080 . 0 0 "[ . 1 . 2 . 3]" 1
3085 1 72 VAL QG 2 35 ILE H . . 5.440 4.632 4.457 5.244 . 0 0 "[ . 1 . 2 . 3]" 1
3086 1 72 VAL QG 2 35 ILE QG . . 2.960 2.023 1.920 2.172 . 0 0 "[ . 1 . 2 . 3]" 1
3087 1 72 VAL QG 2 35 ILE MD . . 2.890 2.313 2.198 2.839 . 0 0 "[ . 1 . 2 . 3]" 1
3088 1 73 ILE H 1 73 ILE QG . . 3.840 2.234 2.039 2.427 . 0 0 "[ . 1 . 2 . 3]" 1
3089 1 73 ILE H 2 38 LEU QD . . 5.440 4.816 4.606 4.960 . 0 0 "[ . 1 . 2 . 3]" 1
3090 1 73 ILE HA 2 38 LEU QD . . 3.630 2.613 2.445 2.753 . 0 0 "[ . 1 . 2 . 3]" 1
3091 1 73 ILE HB 2 24 LEU QD . . 4.950 4.406 4.225 4.526 . 0 0 "[ . 1 . 2 . 3]" 1
3092 1 73 ILE MG 1 77 SER QB . . 4.700 3.097 2.899 3.395 . 0 0 "[ . 1 . 2 . 3]" 1
3093 1 73 ILE MG 2 24 LEU QD . . 3.170 2.731 2.646 2.818 . 0 0 "[ . 1 . 2 . 3]" 1
3094 1 73 ILE MG 2 34 CYS QB . . 4.250 3.330 3.213 3.446 . 0 0 "[ . 1 . 2 . 3]" 1
3095 1 73 ILE MG 2 64 ILE QG . . 4.970 3.825 3.714 3.951 . 0 0 "[ . 1 . 2 . 3]" 1
3096 1 73 ILE QG 1 74 MET H . . 5.090 4.014 3.932 4.164 . 0 0 "[ . 1 . 2 . 3]" 1
3097 1 73 ILE QG 2 35 ILE QG . . 4.750 2.191 2.055 2.336 . 0 0 "[ . 1 . 2 . 3]" 1
3098 1 73 ILE QG 2 35 ILE MD . . 3.740 2.744 2.631 2.819 . 0 0 "[ . 1 . 2 . 3]" 1
3099 1 73 ILE QG 2 38 LEU QD . . 4.300 2.925 2.619 3.291 . 0 0 "[ . 1 . 2 . 3]" 1
3100 1 73 ILE MD 2 24 LEU QD . . 3.290 2.501 2.302 2.640 . 0 0 "[ . 1 . 2 . 3]" 1
3101 1 73 ILE MD 2 34 CYS QB . . 3.510 2.063 1.930 2.399 . 0 0 "[ . 1 . 2 . 3]" 1
3102 1 73 ILE MD 2 35 ILE QG . . 4.720 3.222 2.778 3.548 . 0 0 "[ . 1 . 2 . 3]" 1
3103 1 73 ILE MD 2 38 LEU QD . . 4.780 3.844 3.474 4.110 . 0 0 "[ . 1 . 2 . 3]" 1
3104 1 74 MET H 1 74 MET QB . . 3.410 2.474 2.369 2.573 . 0 0 "[ . 1 . 2 . 3]" 1
3105 1 74 MET H 1 74 MET QG . . 3.040 2.172 1.919 2.400 . 0 0 "[ . 1 . 2 . 3]" 1
3106 1 74 MET HA 2 38 LEU QD . . 5.180 4.819 4.623 4.933 . 0 0 "[ . 1 . 2 . 3]" 1
3107 1 74 MET ME 1 74 MET QG . . 2.990 2.089 1.967 2.402 . 0 0 "[ . 1 . 2 . 3]" 1
3108 1 74 MET QG 1 75 GLU H . . 4.170 3.701 1.978 4.143 . 0 0 "[ . 1 . 2 . 3]" 1
3109 1 75 GLU H 1 75 GLU QB . . 3.150 2.193 2.061 2.521 . 0 0 "[ . 1 . 2 . 3]" 1
3110 1 75 GLU H 1 75 GLU QG . . 3.530 3.006 2.094 3.794 0.264 17 0 "[ . 1 . 2 . 3]" 1
3111 1 75 GLU HA 1 75 GLU QG . . 3.700 2.537 2.038 3.447 . 0 0 "[ . 1 . 2 . 3]" 1
3112 1 76 LYS H 1 76 LYS QG . . 3.510 2.947 2.405 3.175 . 0 0 "[ . 1 . 2 . 3]" 1
3113 1 76 LYS H 1 76 LYS QD . . 4.810 3.774 3.302 4.192 . 0 0 "[ . 1 . 2 . 3]" 1
3114 1 76 LYS H 2 38 LEU QD . . 4.410 4.010 3.699 4.327 . 0 0 "[ . 1 . 2 . 3]" 1
3115 1 76 LYS HA 2 38 LEU QD . . 4.850 4.235 3.882 4.551 . 0 0 "[ . 1 . 2 . 3]" 1
3116 1 76 LYS QB 1 76 LYS QD . . 3.490 2.106 1.986 2.130 . 0 0 "[ . 1 . 2 . 3]" 1
3117 1 76 LYS QB 2 38 LEU QB . . 4.560 2.570 2.469 2.691 . 0 0 "[ . 1 . 2 . 3]" 1
3118 1 76 LYS QB 2 38 LEU QD . . 3.320 2.160 1.806 2.430 . 0 0 "[ . 1 . 2 . 3]" 1
3119 1 76 LYS QG 1 77 SER H . . 4.560 4.403 4.227 4.475 . 0 0 "[ . 1 . 2 . 3]" 1
3120 1 76 LYS QG 2 38 LEU QD . . 4.800 3.690 3.354 3.932 . 0 0 "[ . 1 . 2 . 3]" 1
3121 1 76 LYS QD 2 38 LEU QD . . 4.350 2.774 2.314 3.145 . 0 0 "[ . 1 . 2 . 3]" 1
3122 1 76 LYS QE 2 35 ILE MG . . 3.240 2.201 1.914 2.592 . 0 0 "[ . 1 . 2 . 3]" 1
3123 1 77 SER H 2 38 LEU QD . . 3.870 3.074 2.499 3.297 . 0 0 "[ . 1 . 2 . 3]" 1
3124 1 77 SER H 2 61 LEU QD . . 4.870 4.606 4.326 4.784 . 0 0 "[ . 1 . 2 . 3]" 1
3125 1 77 SER HA 2 38 LEU QD . . 4.400 2.408 2.090 2.593 . 0 0 "[ . 1 . 2 . 3]" 1
3126 1 77 SER QB 1 80 LEU H . . 5.340 5.027 4.924 5.101 . 0 0 "[ . 1 . 2 . 3]" 1
3127 1 77 SER QB 1 81 TYR H . . 5.340 4.660 4.539 4.767 . 0 0 "[ . 1 . 2 . 3]" 1
3128 1 77 SER QB 2 38 LEU QD . . 3.600 2.786 2.666 2.886 . 0 0 "[ . 1 . 2 . 3]" 1
3129 1 77 SER HB2 2 38 LEU MD2 . . 5.980 3.747 3.526 4.029 . 0 0 "[ . 1 . 2 . 3]" 1
3130 1 77 SER QB 2 61 LEU QB . . 4.610 3.047 2.907 3.159 . 0 0 "[ . 1 . 2 . 3]" 1
3131 1 77 SER QB 2 61 LEU QD . . 4.010 2.773 2.413 2.953 . 0 0 "[ . 1 . 2 . 3]" 1
3132 1 77 SER QB 2 64 ILE QG . . 4.070 2.152 2.106 2.198 . 0 0 "[ . 1 . 2 . 3]" 1
3133 1 78 THR H 2 61 LEU QD . . 5.440 4.970 4.669 5.162 . 0 0 "[ . 1 . 2 . 3]" 1
3134 1 78 THR MG 1 82 ASN QD . . 3.330 2.263 1.822 2.824 . 0 0 "[ . 1 . 2 . 3]" 1
3135 1 79 MET H 1 79 MET QG . . 4.010 3.897 3.784 3.986 . 0 0 "[ . 1 . 2 . 3]" 1
3136 1 79 MET H 1 80 LEU QB . . 5.340 4.874 4.677 5.058 . 0 0 "[ . 1 . 2 . 3]" 1
3137 1 79 MET H 1 80 LEU QD . . 5.440 4.653 3.545 5.094 . 0 0 "[ . 1 . 2 . 3]" 1
3138 1 79 MET HA 1 79 MET QG . . 3.650 2.633 2.280 3.252 . 0 0 "[ . 1 . 2 . 3]" 1
3139 1 79 MET QB 1 80 LEU QD . . 4.770 3.121 1.947 3.722 . 0 0 "[ . 1 . 2 . 3]" 1
3140 1 79 MET ME 1 79 MET QG . . 3.350 2.132 1.983 2.328 . 0 0 "[ . 1 . 2 . 3]" 1
3141 1 79 MET ME 1 80 LEU QD . . 3.480 2.277 1.937 2.743 . 0 0 "[ . 1 . 2 . 3]" 1
3142 1 79 MET ME 1 83 LYS QD . . 4.270 2.761 2.021 3.866 . 0 0 "[ . 1 . 2 . 3]" 1
3143 1 80 LEU H 1 80 LEU QB . . 3.250 2.409 2.194 2.610 . 0 0 "[ . 1 . 2 . 3]" 1
3144 1 80 LEU H 2 61 LEU QD . . 4.500 3.818 3.563 4.020 . 0 0 "[ . 1 . 2 . 3]" 1
3145 1 80 LEU HA 1 80 LEU QD . . 3.230 2.082 1.907 2.342 . 0 0 "[ . 1 . 2 . 3]" 1
3146 1 80 LEU QB 1 81 TYR H . . 3.820 2.598 2.482 2.744 . 0 0 "[ . 1 . 2 . 3]" 1
3147 1 80 LEU QB 1 81 TYR HA . . 4.420 3.844 3.799 3.879 . 0 0 "[ . 1 . 2 . 3]" 1
3148 1 80 LEU QB 1 84 PHE QD . . 4.340 3.497 2.854 4.040 . 0 0 "[ . 1 . 2 . 3]" 1
3149 1 80 LEU QB 1 84 PHE QE . . 4.620 2.929 2.276 3.728 . 0 0 "[ . 1 . 2 . 3]" 1
3150 1 80 LEU QB 2 41 LEU QD . . 4.260 2.830 2.079 3.442 . 0 0 "[ . 1 . 2 . 3]" 1
3151 1 80 LEU QB 2 61 LEU QD . . 3.200 1.921 1.790 2.010 . 0 0 "[ . 1 . 2 . 3]" 1
3152 1 80 LEU HB3 2 61 LEU MD1 . . 5.290 2.301 2.006 2.530 . 0 0 "[ . 1 . 2 . 3]" 1
3153 1 80 LEU HG 2 38 LEU QD . . 5.440 3.323 2.789 4.409 . 0 0 "[ . 1 . 2 . 3]" 1
3154 1 80 LEU QD 1 81 TYR H . . 4.540 4.021 3.571 4.175 . 0 0 "[ . 1 . 2 . 3]" 1
3155 1 80 LEU QD 1 83 LYS H . . 5.440 4.748 4.331 5.034 . 0 0 "[ . 1 . 2 . 3]" 1
3156 1 80 LEU QD 1 83 LYS QB . . 4.300 3.291 2.884 3.653 . 0 0 "[ . 1 . 2 . 3]" 1
3157 1 80 LEU QD 1 83 LYS QD . . 3.750 2.754 2.196 3.479 . 0 0 "[ . 1 . 2 . 3]" 1
3158 1 80 LEU QD 1 83 LYS QE . . 4.310 3.190 2.246 3.875 . 0 0 "[ . 1 . 2 . 3]" 1
3159 1 80 LEU QD 1 84 PHE QD . . 4.980 4.330 3.823 4.722 . 0 0 "[ . 1 . 2 . 3]" 1
3160 1 80 LEU QD 1 84 PHE QE . . 4.190 3.341 2.949 3.756 . 0 0 "[ . 1 . 2 . 3]" 1
3161 1 80 LEU QD 1 84 PHE HZ . . 4.740 4.094 3.577 4.739 . 0 0 "[ . 1 . 2 . 3]" 1
3162 1 80 LEU QD 2 38 LEU HA . . 4.420 2.816 2.548 3.971 . 0 0 "[ . 1 . 2 . 3]" 1
3163 1 80 LEU QD 2 38 LEU QB . . 4.140 2.775 2.305 3.413 . 0 0 "[ . 1 . 2 . 3]" 1
3164 1 80 LEU QD 2 38 LEU QD . . 2.910 2.007 1.813 2.688 . 0 0 "[ . 1 . 2 . 3]" 1
3165 1 80 LEU QD 2 41 LEU QB . . 4.390 2.081 1.837 3.228 . 0 0 "[ . 1 . 2 . 3]" 1
3166 1 80 LEU QD 2 41 LEU HG . . 4.120 2.738 2.096 4.066 . 0 0 "[ . 1 . 2 . 3]" 1
3167 1 80 LEU QD 2 42 ALA H . . 3.590 2.721 2.453 3.156 . 0 0 "[ . 1 . 2 . 3]" 1
3168 1 80 LEU QD 2 42 ALA HA . . 3.070 2.392 1.961 3.073 0.003 16 0 "[ . 1 . 2 . 3]" 1
3169 1 80 LEU QD 2 42 ALA MB . . 2.820 2.089 1.887 2.347 . 0 0 "[ . 1 . 2 . 3]" 1
3170 1 80 LEU QD 2 43 SER H . . 4.930 4.511 4.426 4.811 . 0 0 "[ . 1 . 2 . 3]" 1
3171 1 80 LEU QD 2 61 LEU QD . . 3.120 2.224 1.877 3.016 . 0 0 "[ . 1 . 2 . 3]" 1
3172 1 80 LEU QD 2 64 ILE MD . . 5.160 4.392 4.122 5.168 0.008 17 0 "[ . 1 . 2 . 3]" 1
3173 1 81 TYR H 2 61 LEU QB . . 4.570 3.518 3.391 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
3174 1 81 TYR H 2 61 LEU QD . . 4.300 3.291 3.128 3.476 . 0 0 "[ . 1 . 2 . 3]" 1
3175 1 81 TYR HA 2 61 LEU QB . . 4.510 3.214 3.136 3.344 . 0 0 "[ . 1 . 2 . 3]" 1
3176 1 81 TYR HA 2 61 LEU QD . . 3.670 2.856 2.707 3.063 . 0 0 "[ . 1 . 2 . 3]" 1
3177 1 81 TYR QB 2 61 LEU QB . . 4.690 2.534 2.240 2.701 . 0 0 "[ . 1 . 2 . 3]" 1
3178 1 81 TYR QB 2 61 LEU QD . . 4.740 3.355 3.112 3.516 . 0 0 "[ . 1 . 2 . 3]" 1
3179 1 81 TYR QD 1 85 LYS QD . . 4.660 3.905 3.103 4.655 . 0 0 "[ . 1 . 2 . 3]" 1
3180 1 81 TYR QD 2 61 LEU QD . . 5.110 3.778 3.523 4.039 . 0 0 "[ . 1 . 2 . 3]" 1
3181 1 81 TYR QE 2 62 LYS QB . . 4.570 2.661 2.010 3.120 . 0 0 "[ . 1 . 2 . 3]" 1
3182 1 82 ASN H 1 82 ASN QB . . 3.140 2.345 2.068 2.685 . 0 0 "[ . 1 . 2 . 3]" 1
3183 1 82 ASN H 1 82 ASN QD . . 4.110 3.412 2.527 4.109 . 0 0 "[ . 1 . 2 . 3]" 1
3184 1 82 ASN H 1 83 LYS QB . . 5.140 4.334 4.221 4.458 . 0 0 "[ . 1 . 2 . 3]" 1
3185 1 82 ASN H 1 85 LYS QB . . 5.030 4.435 4.166 5.065 0.035 6 0 "[ . 1 . 2 . 3]" 1
3186 1 82 ASN HA 1 85 LYS QB . . 3.920 2.224 1.973 3.468 . 0 0 "[ . 1 . 2 . 3]" 1
3187 1 82 ASN QB 1 83 LYS H . . 3.500 2.806 2.552 3.503 0.003 16 0 "[ . 1 . 2 . 3]" 1
3188 1 83 LYS H 1 83 LYS QG . . 4.400 3.903 3.761 3.970 . 0 0 "[ . 1 . 2 . 3]" 1
3189 1 83 LYS H 1 83 LYS QD . . 4.760 4.387 4.284 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
3190 1 83 LYS H 1 84 PHE QB . . 5.340 4.795 4.466 4.960 . 0 0 "[ . 1 . 2 . 3]" 1
3191 1 83 LYS HA 1 83 LYS QG . . 3.620 2.395 2.270 2.571 . 0 0 "[ . 1 . 2 . 3]" 1
3192 1 83 LYS QB 1 84 PHE QD . . 4.620 3.879 3.435 4.169 . 0 0 "[ . 1 . 2 . 3]" 1
3193 1 83 LYS QB 1 84 PHE QE . . 5.340 4.458 3.928 4.966 . 0 0 "[ . 1 . 2 . 3]" 1
3194 1 83 LYS QB 1 85 LYS H . . 5.060 4.530 4.394 4.887 . 0 0 "[ . 1 . 2 . 3]" 1
3195 1 83 LYS QE 1 83 LYS QG . . 3.060 2.079 1.955 2.320 . 0 0 "[ . 1 . 2 . 3]" 1
3196 1 83 LYS QG 1 84 PHE H . . 4.150 3.691 3.042 4.154 0.004 6 0 "[ . 1 . 2 . 3]" 1
3197 1 83 LYS QG 1 87 MET ME . . 4.410 3.884 2.893 4.408 . 0 0 "[ . 1 . 2 . 3]" 1
3198 1 84 PHE H 1 84 PHE QB . . 3.340 2.337 2.198 2.452 . 0 0 "[ . 1 . 2 . 3]" 1
3199 1 84 PHE HA 1 87 MET QG . . 4.160 2.963 2.149 3.513 . 0 0 "[ . 1 . 2 . 3]" 1
3200 1 84 PHE QB 1 85 LYS H . . 3.510 2.650 2.412 2.728 . 0 0 "[ . 1 . 2 . 3]" 1
3201 1 84 PHE QB 1 87 MET ME . . 4.670 3.956 3.176 4.354 . 0 0 "[ . 1 . 2 . 3]" 1
3202 1 84 PHE QB 2 58 ILE MG . . 3.760 2.422 2.109 2.719 . 0 0 "[ . 1 . 2 . 3]" 1
3203 1 84 PHE QB 2 58 ILE QG . . 4.370 2.555 2.166 3.363 . 0 0 "[ . 1 . 2 . 3]" 1
3204 1 84 PHE QB 2 58 ILE MD . . 3.550 2.564 1.952 3.135 . 0 0 "[ . 1 . 2 . 3]" 1
3205 1 84 PHE QD 1 87 MET QB . . 5.340 3.920 3.319 5.179 . 0 0 "[ . 1 . 2 . 3]" 1
3206 1 84 PHE QD 2 41 LEU QD . . 4.320 3.899 3.797 4.081 . 0 0 "[ . 1 . 2 . 3]" 1
3207 1 84 PHE QD 2 46 VAL QG . . 4.540 3.621 3.291 3.933 . 0 0 "[ . 1 . 2 . 3]" 1
3208 1 84 PHE QD 2 58 ILE QG . . 3.800 2.423 1.922 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
3209 1 84 PHE QD 2 61 LEU QD . . 4.240 2.638 2.471 2.773 . 0 0 "[ . 1 . 2 . 3]" 1
3210 1 84 PHE QE 2 13 LEU QD . . 5.250 4.217 3.900 4.728 . 0 0 "[ . 1 . 2 . 3]" 1
3211 1 84 PHE QE 2 41 LEU QD . . 3.800 2.067 1.933 2.527 . 0 0 "[ . 1 . 2 . 3]" 1
3212 1 84 PHE QE 2 46 VAL QG . . 3.730 1.963 1.853 2.289 . 0 0 "[ . 1 . 2 . 3]" 1
3213 1 84 PHE QE 2 61 LEU QD . . 3.890 2.545 2.178 2.990 . 0 0 "[ . 1 . 2 . 3]" 1
3214 1 84 PHE HZ 2 13 LEU QD . . 5.440 3.827 3.277 4.558 . 0 0 "[ . 1 . 2 . 3]" 1
3215 1 84 PHE HZ 2 41 LEU QD . . 3.510 1.995 1.860 2.284 . 0 0 "[ . 1 . 2 . 3]" 1
3216 1 84 PHE HZ 2 46 VAL QG . . 4.240 2.405 1.944 2.753 . 0 0 "[ . 1 . 2 . 3]" 1
3217 1 85 LYS H 1 85 LYS QB . . 3.280 2.207 2.046 2.289 . 0 0 "[ . 1 . 2 . 3]" 1
3218 1 85 LYS HA 1 89 LEU QB . . 5.340 4.763 4.209 5.361 0.021 28 0 "[ . 1 . 2 . 3]" 1
3219 1 85 LYS QB 1 85 LYS QD . . 3.340 2.092 1.961 2.252 . 0 0 "[ . 1 . 2 . 3]" 1
3220 1 85 LYS QB 1 85 LYS QE . . 4.270 3.209 2.127 3.663 . 0 0 "[ . 1 . 2 . 3]" 1
3221 1 85 LYS QB 1 86 ASN H . . 3.640 2.548 2.216 3.494 . 0 0 "[ . 1 . 2 . 3]" 1
3222 1 86 ASN H 1 86 ASN QD . . 4.350 3.763 2.228 4.315 . 0 0 "[ . 1 . 2 . 3]" 1
3223 1 86 ASN H 1 89 LEU QD . . 5.020 3.530 3.249 4.024 . 0 0 "[ . 1 . 2 . 3]" 1
3224 1 86 ASN HA 1 89 LEU QB . . 4.610 4.077 3.860 4.420 . 0 0 "[ . 1 . 2 . 3]" 1
3225 1 86 ASN HA 1 89 LEU QD . . 3.660 1.961 1.901 2.082 . 0 0 "[ . 1 . 2 . 3]" 1
3226 1 86 ASN QB 1 89 LEU QD . . 4.430 3.484 3.150 3.782 . 0 0 "[ . 1 . 2 . 3]" 1
3227 1 86 ASN QD 1 89 LEU QD . . 4.800 3.506 2.254 4.288 . 0 0 "[ . 1 . 2 . 3]" 1
3228 1 87 MET H 1 87 MET QB . . 3.190 2.435 2.285 2.681 . 0 0 "[ . 1 . 2 . 3]" 1
3229 1 87 MET H 1 87 MET QG . . 3.310 2.434 1.941 2.748 . 0 0 "[ . 1 . 2 . 3]" 1
3230 1 87 MET H 1 88 PHE QB . . 4.770 4.242 4.034 4.422 . 0 0 "[ . 1 . 2 . 3]" 1
3231 1 87 MET HA 1 87 MET QG . . 3.410 2.412 2.213 3.332 . 0 0 "[ . 1 . 2 . 3]" 1
3232 1 87 MET QB 1 88 PHE H . . 3.550 2.780 2.680 3.469 . 0 0 "[ . 1 . 2 . 3]" 1
3233 1 87 MET QB 1 89 LEU H . . 5.340 4.759 4.710 5.080 . 0 0 "[ . 1 . 2 . 3]" 1
3234 1 87 MET QB 2 51 ALA MB . . 5.340 4.046 3.517 4.717 . 0 0 "[ . 1 . 2 . 3]" 1
3235 1 87 MET ME 2 46 VAL QG . . 3.840 3.046 2.335 3.464 . 0 0 "[ . 1 . 2 . 3]" 1
3236 1 87 MET ME 2 48 MET QB . . 3.940 3.275 2.644 3.940 . 8 0 "[ . 1 . 2 . 3]" 1
3237 1 88 PHE H 1 88 PHE QB . . 3.090 2.184 2.098 2.322 . 0 0 "[ . 1 . 2 . 3]" 1
3238 1 88 PHE H 1 89 LEU QB . . 5.080 4.795 4.663 4.981 . 0 0 "[ . 1 . 2 . 3]" 1
3239 1 88 PHE H 1 89 LEU QD . . 4.900 4.269 3.912 4.509 . 0 0 "[ . 1 . 2 . 3]" 1
3240 1 88 PHE QB 1 89 LEU H . . 3.480 2.751 2.684 2.820 . 0 0 "[ . 1 . 2 . 3]" 1
3241 1 88 PHE QB 1 89 LEU QB . . 4.590 3.902 3.774 4.069 . 0 0 "[ . 1 . 2 . 3]" 1
3242 1 88 PHE QB 1 89 LEU QD . . 4.540 4.119 3.736 4.468 . 0 0 "[ . 1 . 2 . 3]" 1
3243 1 88 PHE QB 2 48 MET ME . . 5.010 3.798 3.513 4.275 . 0 0 "[ . 1 . 2 . 3]" 1
3244 1 89 LEU H 1 89 LEU QB . . 2.970 2.603 2.322 2.752 . 0 0 "[ . 1 . 2 . 3]" 1
3245 1 89 LEU HA 1 89 LEU QD . . 4.230 3.352 3.261 3.451 . 0 0 "[ . 1 . 2 . 3]" 1
3246 1 89 LEU QB 1 89 LEU QD . . 2.780 1.819 1.736 1.879 . 0 0 "[ . 1 . 2 . 3]" 1
3247 1 89 LEU QB 1 90 VAL H . . 3.610 3.434 3.018 3.481 . 0 0 "[ . 1 . 2 . 3]" 1
3248 1 89 LEU QD 1 90 VAL H . . 3.790 2.540 2.011 2.963 . 0 0 "[ . 1 . 2 . 3]" 1
3249 1 89 LEU QD 1 90 VAL HA . . 4.580 3.126 2.640 3.841 . 0 0 "[ . 1 . 2 . 3]" 1
3250 1 92 GLU H 1 92 GLU QB . . 3.340 2.700 2.104 3.325 . 0 0 "[ . 1 . 2 . 3]" 1
3251 1 92 GLU QB 1 93 GLY H . . 4.050 3.082 1.943 3.997 . 0 0 "[ . 1 . 2 . 3]" 1
3252 1 94 ASP H 1 94 ASP QB . . 3.690 2.691 2.168 3.286 . 0 0 "[ . 1 . 2 . 3]" 1
3253 1 95 SER QB 1 96 VAL H . . 4.430 3.287 1.976 4.038 . 0 0 "[ . 1 . 2 . 3]" 1
3254 1 96 VAL QG 1 97 ILE H . . 4.150 3.095 1.886 3.723 . 0 0 "[ . 1 . 2 . 3]" 1
3255 1 97 ILE H 1 97 ILE QG . . 3.460 2.452 1.907 3.105 . 0 0 "[ . 1 . 2 . 3]" 1
3256 1 97 ILE QG 1 97 ILE MG . . 3.060 2.180 1.940 2.360 . 0 0 "[ . 1 . 2 . 3]" 1
3257 1 97 ILE QG 1 98 THR H . . 4.540 3.900 1.915 4.470 . 0 0 "[ . 1 . 2 . 3]" 1
3258 1 100 VAL QG 1 101 LEU H . . 4.040 3.068 1.928 3.735 . 0 0 "[ . 1 . 2 . 3]" 1
3259 1 101 LEU H 1 101 LEU QB . . 3.180 2.541 2.046 3.018 . 0 0 "[ . 1 . 2 . 3]" 1
3260 1 101 LEU H 1 101 LEU QD . . 4.480 3.329 2.324 4.137 . 0 0 "[ . 1 . 2 . 3]" 1
3261 1 101 LEU HA 1 101 LEU QD . . 3.200 2.469 1.936 2.970 . 0 0 "[ . 1 . 2 . 3]" 1
3262 1 103 LYS QB 1 106 ALA MB . . 4.120 3.898 2.818 4.165 0.045 7 0 "[ . 1 . 2 . 3]" 1
3263 1 104 SER H 1 104 SER QB . . 3.600 2.272 2.049 2.909 . 0 0 "[ . 1 . 2 . 3]" 1
3264 1 105 LEU HA 1 105 LEU QD . . 3.560 2.484 1.974 3.402 . 0 0 "[ . 1 . 2 . 3]" 1
3265 1 106 ALA MB 1 107 GLU QG . . 4.080 3.793 3.478 3.999 . 0 0 "[ . 1 . 2 . 3]" 1
3266 1 107 GLU H 1 107 GLU QG . . 3.560 2.755 1.931 3.298 . 0 0 "[ . 1 . 2 . 3]" 1
3267 1 108 GLN H 1 108 GLN QB . . 3.630 2.149 2.052 2.292 . 0 0 "[ . 1 . 2 . 3]" 1
3268 1 108 GLN H 1 108 GLN QG . . 4.490 3.655 2.674 4.060 . 0 0 "[ . 1 . 2 . 3]" 1
3269 1 108 GLN QB 1 109 ARG H . . 4.070 2.604 2.156 2.802 . 0 0 "[ . 1 . 2 . 3]" 1
3270 1 109 ARG H 1 109 ARG QB . . 3.510 2.284 2.092 2.635 . 0 0 "[ . 1 . 2 . 3]" 1
3271 1 110 GLN H 1 110 GLN QG . . 5.070 3.558 2.486 4.046 . 0 0 "[ . 1 . 2 . 3]" 1
3272 1 111 HIS QB 1 112 GLU H . . 4.230 2.502 2.130 2.814 . 0 0 "[ . 1 . 2 . 3]" 1
3273 1 112 GLU QB 1 113 GLU H . . 3.830 2.378 2.136 2.778 . 0 0 "[ . 1 . 2 . 3]" 1
3274 1 113 GLU H 1 113 GLU QB . . 3.560 2.171 2.053 2.559 . 0 0 "[ . 1 . 2 . 3]" 1
3275 1 113 GLU QB 1 114 ALA H . . 4.060 2.727 2.194 2.805 . 0 0 "[ . 1 . 2 . 3]" 1
3276 2 6 GLU H 2 6 GLU QB . . 3.230 2.768 2.044 3.203 . 0 0 "[ . 1 . 2 . 3]" 1
3277 2 6 GLU HA 2 6 GLU QG . . 3.710 2.250 1.999 3.382 . 0 0 "[ . 1 . 2 . 3]" 1
3278 2 9 MET HA 2 12 ARG QG . . 4.040 2.004 1.955 2.161 . 0 0 "[ . 1 . 2 . 3]" 1
3279 2 9 MET HA 2 13 LEU QD . . 5.440 3.950 3.468 4.269 . 0 0 "[ . 1 . 2 . 3]" 1
3280 2 9 MET QB 2 9 MET ME . . 4.220 3.479 2.882 3.711 . 0 0 "[ . 1 . 2 . 3]" 1
3281 2 9 MET QB 2 10 ASP H . . 3.730 2.636 2.497 2.706 . 0 0 "[ . 1 . 2 . 3]" 1
3282 2 9 MET QB 2 13 LEU QD . . 4.660 3.721 3.313 4.115 . 0 0 "[ . 1 . 2 . 3]" 1
3283 2 9 MET ME 2 9 MET QG . . 3.030 2.148 1.998 2.232 . 0 0 "[ . 1 . 2 . 3]" 1
3284 2 9 MET QG 2 13 LEU HG . . 5.040 3.644 2.687 5.046 0.006 23 0 "[ . 1 . 2 . 3]" 1
3285 2 9 MET QG 2 13 LEU QD . . 3.380 2.396 1.884 2.614 . 0 0 "[ . 1 . 2 . 3]" 1
3286 2 9 MET QG 2 46 VAL HA . . 4.950 3.886 3.484 4.423 . 0 0 "[ . 1 . 2 . 3]" 1
3287 2 9 MET ME 2 13 LEU QD . . 3.540 2.847 1.995 3.341 . 0 0 "[ . 1 . 2 . 3]" 1
3288 2 9 MET ME 2 41 LEU QD . . 4.840 4.376 3.739 4.822 . 0 0 "[ . 1 . 2 . 3]" 1
3289 2 9 MET ME 2 44 LEU QB . . 3.900 2.155 1.883 2.551 . 0 0 "[ . 1 . 2 . 3]" 1
3290 2 9 MET ME 2 44 LEU QD . . 3.110 2.279 1.905 2.742 . 0 0 "[ . 1 . 2 . 3]" 1
3291 2 9 MET ME 2 46 VAL QG . . 3.570 2.936 1.916 3.417 . 0 0 "[ . 1 . 2 . 3]" 1
3292 2 10 ASP HA 2 13 LEU QD . . 3.970 3.030 2.503 3.264 . 0 0 "[ . 1 . 2 . 3]" 1
3293 2 12 ARG H 2 12 ARG QG . . 3.390 2.045 1.928 2.214 . 0 0 "[ . 1 . 2 . 3]" 1
3294 2 12 ARG HA 2 12 ARG QG . . 3.680 3.343 3.337 3.344 . 0 0 "[ . 1 . 2 . 3]" 1
3295 2 12 ARG QB 2 44 LEU QD . . 3.990 3.014 2.643 3.499 . 0 0 "[ . 1 . 2 . 3]" 1
3296 2 12 ARG QG 2 13 LEU H . . 3.330 2.191 2.116 2.235 . 0 0 "[ . 1 . 2 . 3]" 1
3297 2 12 ARG QG 2 14 GLN H . . 5.340 4.459 4.334 4.562 . 0 0 "[ . 1 . 2 . 3]" 1
3298 2 12 ARG QG 2 16 ILE H . . 5.340 5.328 5.254 5.370 0.030 20 0 "[ . 1 . 2 . 3]" 1
3299 2 12 ARG QG 2 16 ILE MD . . 4.000 3.151 2.992 3.458 . 0 0 "[ . 1 . 2 . 3]" 1
3300 2 12 ARG QG 2 44 LEU QD . . 3.820 2.507 2.129 3.115 . 0 0 "[ . 1 . 2 . 3]" 1
3301 2 12 ARG QD 2 44 LEU QD . . 3.500 1.861 1.652 2.384 . 0 0 "[ . 1 . 2 . 3]" 1
3302 2 13 LEU HA 2 13 LEU QD . . 2.970 2.148 1.983 2.417 . 0 0 "[ . 1 . 2 . 3]" 1
3303 2 13 LEU HA 2 41 LEU QD . . 4.510 3.615 3.315 4.081 . 0 0 "[ . 1 . 2 . 3]" 1
3304 2 13 LEU HA 2 44 LEU QD . . 4.720 3.369 3.069 3.937 . 0 0 "[ . 1 . 2 . 3]" 1
3305 2 13 LEU HG 2 41 LEU QD . . 4.290 3.483 2.366 4.120 . 0 0 "[ . 1 . 2 . 3]" 1
3306 2 13 LEU HG 2 44 LEU QD . . 4.660 3.057 2.301 4.372 . 0 0 "[ . 1 . 2 . 3]" 1
3307 2 13 LEU QD 2 14 GLN H . . 4.260 4.039 3.995 4.202 . 0 0 "[ . 1 . 2 . 3]" 1
3308 2 13 LEU QD 2 16 ILE H . . 4.780 4.629 4.366 4.797 0.017 20 0 "[ . 1 . 2 . 3]" 1
3309 2 13 LEU QD 2 16 ILE HB . . 4.060 3.578 3.176 4.009 . 0 0 "[ . 1 . 2 . 3]" 1
3310 2 13 LEU QD 2 16 ILE MG . . 4.240 3.905 3.564 4.265 0.025 1 0 "[ . 1 . 2 . 3]" 1
3311 2 13 LEU QD 2 16 ILE MD . . 3.320 2.263 1.890 2.930 . 0 0 "[ . 1 . 2 . 3]" 1
3312 2 13 LEU QD 2 41 LEU HA . . 4.260 3.360 3.211 3.723 . 0 0 "[ . 1 . 2 . 3]" 1
3313 2 13 LEU QD 2 41 LEU HG . . 4.430 4.087 3.370 4.443 0.013 1 0 "[ . 1 . 2 . 3]" 1
3314 2 13 LEU QD 2 41 LEU QD . . 2.800 1.959 1.758 2.577 . 0 0 "[ . 1 . 2 . 3]" 1
3315 2 13 LEU QD 2 44 LEU QB . . 4.270 2.967 2.714 3.392 . 0 0 "[ . 1 . 2 . 3]" 1
3316 2 13 LEU QD 2 44 LEU QD . . 3.100 1.977 1.793 2.585 . 0 0 "[ . 1 . 2 . 3]" 1
3317 2 13 LEU QD 2 46 VAL HA . . 5.440 4.075 3.355 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
3318 2 13 LEU QD 2 46 VAL HB . . 4.790 2.731 2.385 4.161 . 0 0 "[ . 1 . 2 . 3]" 1
3319 2 13 LEU QD 2 46 VAL QG . . 3.200 2.071 1.593 2.343 . 0 0 "[ . 1 . 2 . 3]" 1
3320 2 13 LEU QD 2 47 THR H . . 5.440 4.957 4.416 5.382 . 0 0 "[ . 1 . 2 . 3]" 1
3321 2 13 LEU QD 2 50 GLN HA . . 5.200 4.787 4.411 5.071 . 0 0 "[ . 1 . 2 . 3]" 1
3322 2 13 LEU QD 2 50 GLN QB . . 4.120 2.903 2.642 3.210 . 0 0 "[ . 1 . 2 . 3]" 1
3323 2 13 LEU QD 2 50 GLN QG . . 4.780 3.403 2.463 4.146 . 0 0 "[ . 1 . 2 . 3]" 1
3324 2 13 LEU QD 2 51 ALA H . . 5.440 4.831 4.621 5.027 . 0 0 "[ . 1 . 2 . 3]" 1
3325 2 13 LEU QD 2 54 HIS HB2 . . 5.050 3.160 2.621 3.576 . 0 0 "[ . 1 . 2 . 3]" 1
3326 2 13 LEU QD 2 54 HIS HD2 . . 4.430 3.541 3.325 3.986 . 0 0 "[ . 1 . 2 . 3]" 1
3327 2 13 LEU QD 2 54 HIS HE1 . . 3.930 2.813 2.423 3.332 . 0 0 "[ . 1 . 2 . 3]" 1
3328 2 13 LEU QD 2 57 MET ME . . 2.970 2.016 1.811 2.516 . 0 0 "[ . 1 . 2 . 3]" 1
3329 2 14 GLN H 2 14 GLN QB . . 3.100 2.354 2.177 2.504 . 0 0 "[ . 1 . 2 . 3]" 1
3330 2 14 GLN H 2 14 GLN QG . . 3.320 2.413 2.060 2.845 . 0 0 "[ . 1 . 2 . 3]" 1
3331 2 14 GLN HA 2 14 GLN QG . . 3.590 3.353 3.234 3.448 . 0 0 "[ . 1 . 2 . 3]" 1
3332 2 14 GLN QB 2 15 ARG H . . 3.720 3.520 3.377 3.583 . 0 0 "[ . 1 . 2 . 3]" 1
3333 2 14 GLN QG 2 15 ARG H . . 4.220 2.212 1.956 2.302 . 0 0 "[ . 1 . 2 . 3]" 1
3334 2 14 GLN QG 2 15 ARG HA . . 4.610 3.295 3.038 3.675 . 0 0 "[ . 1 . 2 . 3]" 1
3335 2 14 GLN QG 2 18 ALA MB . . 5.270 4.457 3.755 4.890 . 0 0 "[ . 1 . 2 . 3]" 1
3336 2 15 ARG H 2 15 ARG QB . . 3.110 2.232 2.074 2.644 . 0 0 "[ . 1 . 2 . 3]" 1
3337 2 15 ARG H 2 15 ARG QG . . 3.750 2.891 1.922 3.571 . 0 0 "[ . 1 . 2 . 3]" 1
3338 2 15 ARG H 2 15 ARG QD . . 4.370 3.784 3.412 4.247 . 0 0 "[ . 1 . 2 . 3]" 1
3339 2 15 ARG QB 2 16 ILE HA . . 4.270 3.900 3.759 4.352 0.082 20 0 "[ . 1 . 2 . 3]" 1
3340 2 15 ARG QB 2 18 ALA MB . . 4.960 4.295 3.961 4.555 . 0 0 "[ . 1 . 2 . 3]" 1
3341 2 15 ARG QB 2 19 GLU QG . . 3.270 3.121 2.916 3.278 0.008 20 0 "[ . 1 . 2 . 3]" 1
3342 2 15 ARG QG 2 16 ILE H . . 5.090 4.009 2.096 4.482 . 0 0 "[ . 1 . 2 . 3]" 1
3343 2 15 ARG QG 2 19 GLU H . . 5.340 5.057 4.538 5.379 0.039 14 0 "[ . 1 . 2 . 3]" 1
3344 2 15 ARG QG 2 19 GLU QG . . 4.140 3.781 3.046 4.187 0.047 6 0 "[ . 1 . 2 . 3]" 1
3345 2 16 ILE H 2 16 ILE QG . . 3.400 2.206 2.043 2.541 . 0 0 "[ . 1 . 2 . 3]" 1
3346 2 16 ILE HA 2 16 ILE QG . . 3.660 2.413 2.312 2.453 . 0 0 "[ . 1 . 2 . 3]" 1
3347 2 16 ILE HA 2 19 GLU QB . . 4.640 2.726 2.513 3.019 . 0 0 "[ . 1 . 2 . 3]" 1
3348 2 16 ILE MG 2 20 ILE QG . . 4.240 3.239 2.930 3.539 . 0 0 "[ . 1 . 2 . 3]" 1
3349 2 16 ILE MG 2 40 GLU QG . . 4.550 4.036 3.601 4.497 . 0 0 "[ . 1 . 2 . 3]" 1
3350 2 16 ILE MG 2 41 LEU QB . . 3.500 2.419 1.989 2.576 . 0 0 "[ . 1 . 2 . 3]" 1
3351 2 16 ILE MG 2 44 LEU QD . . 4.710 4.017 3.716 4.260 . 0 0 "[ . 1 . 2 . 3]" 1
3352 2 16 ILE MD 2 40 GLU QG . . 3.320 2.537 1.964 3.326 0.006 16 0 "[ . 1 . 2 . 3]" 1
3353 2 16 ILE MD 2 41 LEU QB . . 4.330 3.392 2.612 3.839 . 0 0 "[ . 1 . 2 . 3]" 1
3354 2 16 ILE MD 2 41 LEU QD . . 3.380 2.583 2.101 3.380 . 0 0 "[ . 1 . 2 . 3]" 1
3355 2 17 HIS QB 2 18 ALA H . . 3.310 2.543 2.371 2.692 . 0 0 "[ . 1 . 2 . 3]" 1
3356 2 17 HIS QB 2 18 ALA MB . . 4.440 3.863 3.750 3.958 . 0 0 "[ . 1 . 2 . 3]" 1
3357 2 17 HIS QB 2 57 MET ME . . 4.030 3.858 3.575 4.032 0.002 30 0 "[ . 1 . 2 . 3]" 1
3358 2 18 ALA HA 2 21 LYS QE . . 4.250 3.212 2.420 4.282 0.032 14 0 "[ . 1 . 2 . 3]" 1
3359 2 18 ALA MB 2 21 LYS QE . . 5.340 3.747 2.848 4.675 . 0 0 "[ . 1 . 2 . 3]" 1
3360 2 19 GLU H 2 19 GLU QB . . 3.650 2.326 2.242 2.490 . 0 0 "[ . 1 . 2 . 3]" 1
3361 2 20 ILE H 2 20 ILE QG . . 3.560 2.102 1.956 2.255 . 0 0 "[ . 1 . 2 . 3]" 1
3362 2 20 ILE HA 2 20 ILE QG . . 3.640 2.454 2.443 2.461 . 0 0 "[ . 1 . 2 . 3]" 1
3363 2 20 ILE HA 2 23 SER QB . . 4.590 2.756 2.077 3.268 . 0 0 "[ . 1 . 2 . 3]" 1
3364 2 20 ILE MG 2 24 LEU QD . . 3.170 1.851 1.797 2.011 . 0 0 "[ . 1 . 2 . 3]" 1
3365 2 20 ILE MG 2 34 CYS QB . . 4.420 3.080 2.765 3.432 . 0 0 "[ . 1 . 2 . 3]" 1
3366 2 20 ILE QG 2 37 ALA MB . . 2.970 1.916 1.869 2.011 . 0 0 "[ . 1 . 2 . 3]" 1
3367 2 20 ILE MD 2 38 LEU QD . . 3.180 2.755 2.049 3.158 . 0 0 "[ . 1 . 2 . 3]" 1
3368 2 21 LYS H 2 21 LYS QB . . 3.290 2.184 2.055 2.245 . 0 0 "[ . 1 . 2 . 3]" 1
3369 2 21 LYS H 2 24 LEU QB . . 5.340 4.882 4.736 5.080 . 0 0 "[ . 1 . 2 . 3]" 1
3370 2 21 LYS HA 2 21 LYS QG . . 3.450 2.327 2.045 2.464 . 0 0 "[ . 1 . 2 . 3]" 1
3371 2 21 LYS HA 2 21 LYS QD . . 4.380 3.997 3.547 4.182 . 0 0 "[ . 1 . 2 . 3]" 1
3372 2 21 LYS HA 2 24 LEU QD . . 4.190 3.565 3.439 3.729 . 0 0 "[ . 1 . 2 . 3]" 1
3373 2 21 LYS QB 2 21 LYS QE . . 4.000 2.202 1.919 3.093 . 0 0 "[ . 1 . 2 . 3]" 1
3374 2 21 LYS QB 2 60 THR MG . . 5.320 4.685 4.412 4.997 . 0 0 "[ . 1 . 2 . 3]" 1
3375 2 21 LYS QG 2 22 ASN H . . 4.200 3.861 3.475 4.142 . 0 0 "[ . 1 . 2 . 3]" 1
3376 2 21 LYS QG 2 24 LEU H . . 5.310 4.993 4.826 5.197 . 0 0 "[ . 1 . 2 . 3]" 1
3377 2 22 ASN H 2 22 ASN QB . . 3.120 2.469 2.225 2.711 . 0 0 "[ . 1 . 2 . 3]" 1
3378 2 22 ASN H 2 22 ASN QD . . 4.420 2.745 1.972 3.641 . 0 0 "[ . 1 . 2 . 3]" 1
3379 2 22 ASN H 2 23 SER QB . . 4.820 4.464 4.304 4.728 . 0 0 "[ . 1 . 2 . 3]" 1
3380 2 22 ASN HA 2 25 LYS QG . . 4.770 3.774 3.468 4.188 . 0 0 "[ . 1 . 2 . 3]" 1
3381 2 22 ASN QB 2 23 SER H . . 3.580 2.936 2.733 3.585 0.005 28 0 "[ . 1 . 2 . 3]" 1
3382 2 22 ASN QB 2 23 SER QB . . 4.820 4.192 3.809 5.008 0.188 18 0 "[ . 1 . 2 . 3]" 1
3383 2 22 ASN QB 2 25 LYS QD . . 4.740 3.421 2.781 4.036 . 0 0 "[ . 1 . 2 . 3]" 1
3384 2 23 SER H 2 23 SER QB . . 3.260 2.354 2.218 2.576 . 0 0 "[ . 1 . 2 . 3]" 1
3385 2 23 SER H 2 24 LEU QB . . 4.400 4.355 4.222 4.425 0.025 21 0 "[ . 1 . 2 . 3]" 1
3386 2 23 SER QB 2 24 LEU H . . 4.280 3.570 2.841 3.850 . 0 0 "[ . 1 . 2 . 3]" 1
3387 2 23 SER QB 2 24 LEU QD . . 4.250 4.017 3.484 4.262 0.012 20 0 "[ . 1 . 2 . 3]" 1
3388 2 23 SER QB 2 30 ASP H . . 5.160 3.857 3.691 4.036 . 0 0 "[ . 1 . 2 . 3]" 1
3389 2 23 SER QB 2 34 CYS H . . 4.020 3.007 2.756 3.370 . 0 0 "[ . 1 . 2 . 3]" 1
3390 2 24 LEU H 2 24 LEU QB . . 3.270 2.409 2.248 2.513 . 0 0 "[ . 1 . 2 . 3]" 1
3391 2 24 LEU H 2 24 LEU QD . . 3.840 3.549 3.406 3.667 . 0 0 "[ . 1 . 2 . 3]" 1
3392 2 24 LEU H 2 29 LEU QD . . 5.440 4.819 4.659 5.035 . 0 0 "[ . 1 . 2 . 3]" 1
3393 2 24 LEU HA 2 24 LEU QD . . 2.910 1.950 1.936 2.048 . 0 0 "[ . 1 . 2 . 3]" 1
3394 2 24 LEU HA 2 29 LEU QD . . 3.270 2.432 2.251 2.600 . 0 0 "[ . 1 . 2 . 3]" 1
3395 2 24 LEU HA 2 31 VAL QG . . 4.550 4.044 3.678 4.303 . 0 0 "[ . 1 . 2 . 3]" 1
3396 2 24 LEU QB 2 24 LEU QD . . 2.720 1.942 1.930 1.947 . 0 0 "[ . 1 . 2 . 3]" 1
3397 2 24 LEU QD 2 25 LYS H . . 4.820 4.337 4.315 4.353 . 0 0 "[ . 1 . 2 . 3]" 1
3398 2 24 LEU QD 2 29 LEU HA . . 5.430 4.364 4.306 4.456 . 0 0 "[ . 1 . 2 . 3]" 1
3399 2 24 LEU QD 2 29 LEU QB . . 5.380 5.033 4.907 5.164 . 0 0 "[ . 1 . 2 . 3]" 1
3400 2 24 LEU QD 2 29 LEU HG . . 4.170 4.196 4.158 4.249 0.079 14 0 "[ . 1 . 2 . 3]" 1
3401 2 24 LEU QD 2 29 LEU QD . . 3.070 2.622 2.415 2.759 . 0 0 "[ . 1 . 2 . 3]" 1
3402 2 24 LEU QD 2 30 ASP H . . 4.580 4.056 3.863 4.247 . 0 0 "[ . 1 . 2 . 3]" 1
3403 2 24 LEU QD 2 31 VAL HA . . 4.390 2.743 2.522 2.955 . 0 0 "[ . 1 . 2 . 3]" 1
3404 2 24 LEU QD 2 31 VAL QG . . 3.730 2.505 2.232 2.703 . 0 0 "[ . 1 . 2 . 3]" 1
3405 2 24 LEU QD 2 34 CYS HA . . 5.000 3.986 3.781 4.173 . 0 0 "[ . 1 . 2 . 3]" 1
3406 2 24 LEU QD 2 34 CYS QB . . 3.780 2.337 1.947 2.587 . 0 0 "[ . 1 . 2 . 3]" 1
3407 2 24 LEU QD 2 60 THR MG . . 4.140 3.579 3.482 3.681 . 0 0 "[ . 1 . 2 . 3]" 1
3408 2 24 LEU QD 2 64 ILE HA . . 4.750 4.256 4.093 4.360 . 0 0 "[ . 1 . 2 . 3]" 1
3409 2 24 LEU QD 2 64 ILE HB . . 4.430 3.474 3.302 3.606 . 0 0 "[ . 1 . 2 . 3]" 1
3410 2 24 LEU QD 2 64 ILE MG . . 3.380 2.136 1.989 2.226 . 0 0 "[ . 1 . 2 . 3]" 1
3411 2 24 LEU QD 2 67 PHE QE . . 3.540 2.983 2.688 3.217 . 0 0 "[ . 1 . 2 . 3]" 1
3412 2 25 LYS H 2 25 LYS QB . . 3.170 2.055 2.046 2.100 . 0 0 "[ . 1 . 2 . 3]" 1
3413 2 25 LYS H 2 25 LYS QG . . 4.030 3.800 3.660 4.007 . 0 0 "[ . 1 . 2 . 3]" 1
3414 2 25 LYS H 2 28 ASN QB . . 4.470 3.939 3.811 4.085 . 0 0 "[ . 1 . 2 . 3]" 1
3415 2 25 LYS H 2 29 LEU QD . . 4.270 3.832 3.706 4.025 . 0 0 "[ . 1 . 2 . 3]" 1
3416 2 25 LYS HA 2 25 LYS QG . . 3.620 2.224 2.002 2.514 . 0 0 "[ . 1 . 2 . 3]" 1
3417 2 25 LYS QB 2 26 ILE H . . 4.220 2.581 2.499 2.816 . 0 0 "[ . 1 . 2 . 3]" 1
3418 2 25 LYS QB 2 27 ASP H . . 4.230 2.722 2.594 3.028 . 0 0 "[ . 1 . 2 . 3]" 1
3419 2 25 LYS QB 2 28 ASN H . . 3.640 1.879 1.863 1.910 . 0 0 "[ . 1 . 2 . 3]" 1
3420 2 25 LYS QB 2 28 ASN QB . . 3.740 2.324 2.198 2.431 . 0 0 "[ . 1 . 2 . 3]" 1
3421 2 25 LYS QB 2 28 ASN QD . . 5.180 3.801 3.223 4.594 . 0 0 "[ . 1 . 2 . 3]" 1
3422 2 25 LYS QG 2 26 ILE H . . 3.760 2.570 1.994 2.784 . 0 0 "[ . 1 . 2 . 3]" 1
3423 2 25 LYS QG 2 27 ASP H . . 3.850 3.432 3.020 3.635 . 0 0 "[ . 1 . 2 . 3]" 1
3424 2 25 LYS QG 2 28 ASN H . . 4.710 3.406 3.007 3.575 . 0 0 "[ . 1 . 2 . 3]" 1
3425 2 25 LYS QD 2 28 ASN QB . . 5.080 3.643 2.951 4.361 . 0 0 "[ . 1 . 2 . 3]" 1
3426 2 25 LYS QD 2 28 ASN QD . . 5.340 4.483 3.365 5.325 . 0 0 "[ . 1 . 2 . 3]" 1
3427 2 26 ILE H 2 26 ILE QG . . 4.110 4.065 4.053 4.072 . 0 0 "[ . 1 . 2 . 3]" 1
3428 2 26 ILE HA 2 29 LEU QD . . 3.870 3.296 3.039 3.536 . 0 0 "[ . 1 . 2 . 3]" 1
3429 2 26 ILE QG 2 26 ILE MG . . 3.040 2.091 2.067 2.114 . 0 0 "[ . 1 . 2 . 3]" 1
3430 2 26 ILE MG 2 27 ASP QB . . 3.930 2.713 2.518 2.872 . 0 0 "[ . 1 . 2 . 3]" 1
3431 2 26 ILE QG 2 27 ASP H . . 4.360 3.651 3.567 3.699 . 0 0 "[ . 1 . 2 . 3]" 1
3432 2 28 ASN H 2 28 ASN QB . . 3.240 2.416 2.351 2.494 . 0 0 "[ . 1 . 2 . 3]" 1
3433 2 28 ASN QB 2 29 LEU H . . 3.970 3.847 3.830 3.869 . 0 0 "[ . 1 . 2 . 3]" 1
3434 2 29 LEU HA 2 29 LEU QD . . 3.120 2.354 2.195 2.482 . 0 0 "[ . 1 . 2 . 3]" 1
3435 2 29 LEU QB 2 29 LEU QD . . 2.650 1.869 1.839 1.897 . 0 0 "[ . 1 . 2 . 3]" 1
3436 2 29 LEU QB 2 31 VAL QG . . 4.690 4.236 4.034 4.496 . 0 0 "[ . 1 . 2 . 3]" 1
3437 2 29 LEU HG 2 31 VAL QG . . 3.860 2.642 2.370 2.947 . 0 0 "[ . 1 . 2 . 3]" 1
3438 2 29 LEU QD 2 30 ASP H . . 3.540 3.309 3.172 3.482 . 0 0 "[ . 1 . 2 . 3]" 1
3439 2 29 LEU QD 2 31 VAL H . . 4.520 3.647 3.356 3.862 . 0 0 "[ . 1 . 2 . 3]" 1
3440 2 29 LEU QD 2 67 PHE QE . . 4.620 3.663 3.497 3.810 . 0 0 "[ . 1 . 2 . 3]" 1
3441 2 30 ASP HA 2 31 VAL QG . . 4.280 3.452 3.404 3.491 . 0 0 "[ . 1 . 2 . 3]" 1
3442 2 31 VAL H 2 31 VAL QG . . 2.770 1.928 1.846 1.995 . 0 0 "[ . 1 . 2 . 3]" 1
3443 2 31 VAL HA 2 34 CYS QB . . 4.260 2.365 2.239 2.472 . 0 0 "[ . 1 . 2 . 3]" 1
3444 2 31 VAL QG 2 32 ASN H . . 3.390 2.089 1.926 2.239 . 0 0 "[ . 1 . 2 . 3]" 1
3445 2 31 VAL QG 2 32 ASN HA . . 4.220 3.364 3.187 3.497 . 0 0 "[ . 1 . 2 . 3]" 1
3446 2 31 VAL QG 2 34 CYS H . . 4.690 4.297 4.279 4.322 . 0 0 "[ . 1 . 2 . 3]" 1
3447 2 31 VAL QG 2 34 CYS QB . . 5.280 3.314 3.261 3.398 . 0 0 "[ . 1 . 2 . 3]" 1
3448 2 31 VAL QG 2 35 ILE H . . 5.440 4.668 4.537 4.838 . 0 0 "[ . 1 . 2 . 3]" 1
3449 2 31 VAL QG 2 67 PHE QE . . 4.800 4.726 4.089 4.840 0.040 18 0 "[ . 1 . 2 . 3]" 1
3450 2 32 ASN H 2 32 ASN QB . . 3.040 2.323 2.081 2.624 . 0 0 "[ . 1 . 2 . 3]" 1
3451 2 32 ASN H 2 32 ASN QD . . 3.970 3.093 2.034 3.995 0.025 3 0 "[ . 1 . 2 . 3]" 1
3452 2 33 ARG H 2 33 ARG QB . . 3.140 2.087 2.069 2.193 . 0 0 "[ . 1 . 2 . 3]" 1
3453 2 33 ARG H 2 33 ARG QG . . 4.040 3.585 3.039 3.914 . 0 0 "[ . 1 . 2 . 3]" 1
3454 2 33 ARG H 2 33 ARG QD . . 4.530 3.425 2.184 4.511 . 0 0 "[ . 1 . 2 . 3]" 1
3455 2 33 ARG H 2 36 GLU QG . . 4.720 4.563 4.302 4.706 . 0 0 "[ . 1 . 2 . 3]" 1
3456 2 33 ARG HA 2 33 ARG QG . . 3.620 2.161 2.003 2.411 . 0 0 "[ . 1 . 2 . 3]" 1
3457 2 33 ARG HA 2 36 GLU QG . . 3.420 2.457 2.065 2.672 . 0 0 "[ . 1 . 2 . 3]" 1
3458 2 33 ARG QB 2 34 CYS H . . 3.890 2.826 2.755 2.867 . 0 0 "[ . 1 . 2 . 3]" 1
3459 2 34 CYS QB 2 35 ILE H . . 3.640 2.261 2.114 2.638 . 0 0 "[ . 1 . 2 . 3]" 1
3460 2 34 CYS QB 2 35 ILE MD . . 4.740 3.449 3.093 3.801 . 0 0 "[ . 1 . 2 . 3]" 1
3461 2 35 ILE H 2 38 LEU QB . . 5.340 4.896 4.656 5.047 . 0 0 "[ . 1 . 2 . 3]" 1
3462 2 35 ILE HA 2 35 ILE QG . . 3.600 2.373 2.280 2.411 . 0 0 "[ . 1 . 2 . 3]" 1
3463 2 35 ILE HA 2 38 LEU QB . . 3.960 2.516 2.344 2.743 . 0 0 "[ . 1 . 2 . 3]" 1
3464 2 35 ILE HA 2 38 LEU QD . . 3.530 2.489 2.074 3.138 . 0 0 "[ . 1 . 2 . 3]" 1
3465 2 35 ILE MG 2 36 GLU QG . . 4.560 3.748 3.582 3.924 . 0 0 "[ . 1 . 2 . 3]" 1
3466 2 35 ILE MG 2 38 LEU QB . . 4.140 3.476 3.262 3.815 . 0 0 "[ . 1 . 2 . 3]" 1
3467 2 36 GLU H 2 36 GLU QG . . 3.210 2.286 2.086 2.508 . 0 0 "[ . 1 . 2 . 3]" 1
3468 2 36 GLU HA 2 39 ASP QB . . 3.750 2.958 2.792 3.119 . 0 0 "[ . 1 . 2 . 3]" 1
3469 2 37 ALA H 2 38 LEU QD . . 5.440 4.615 4.227 4.907 . 0 0 "[ . 1 . 2 . 3]" 1
3470 2 37 ALA MB 2 38 LEU QD . . 4.520 3.804 3.071 4.024 . 0 0 "[ . 1 . 2 . 3]" 1
3471 2 38 LEU H 2 38 LEU QB . . 3.140 2.349 2.077 2.432 . 0 0 "[ . 1 . 2 . 3]" 1
3472 2 38 LEU H 2 38 LEU QD . . 3.630 3.074 2.541 3.225 . 0 0 "[ . 1 . 2 . 3]" 1
3473 2 38 LEU HA 2 38 LEU QD . . 3.060 2.286 1.965 2.683 . 0 0 "[ . 1 . 2 . 3]" 1
3474 2 38 LEU HA 2 41 LEU QB . . 4.240 2.884 2.683 3.108 . 0 0 "[ . 1 . 2 . 3]" 1
3475 2 38 LEU HA 2 41 LEU QD . . 4.660 4.295 3.590 4.621 . 0 0 "[ . 1 . 2 . 3]" 1
3476 2 38 LEU QB 2 38 LEU QD . . 2.860 1.864 1.765 1.940 . 0 0 "[ . 1 . 2 . 3]" 1
3477 2 38 LEU QB 2 39 ASP H . . 3.710 2.656 2.532 2.794 . 0 0 "[ . 1 . 2 . 3]" 1
3478 2 38 LEU QD 2 41 LEU QB . . 4.330 3.706 3.363 4.260 . 0 0 "[ . 1 . 2 . 3]" 1
3479 2 38 LEU QD 2 42 ALA H . . 5.440 5.135 4.846 5.378 . 0 0 "[ . 1 . 2 . 3]" 1
3480 2 38 LEU QD 2 42 ALA MB . . 5.440 4.800 4.610 5.139 . 0 0 "[ . 1 . 2 . 3]" 1
3481 2 38 LEU QD 2 61 LEU QB . . 5.280 4.223 4.059 4.586 . 0 0 "[ . 1 . 2 . 3]" 1
3482 2 38 LEU QD 2 61 LEU QD . . 2.900 2.114 1.849 2.539 . 0 0 "[ . 1 . 2 . 3]" 1
3483 2 38 LEU QD 2 64 ILE HB . . 5.440 4.616 4.325 4.849 . 0 0 "[ . 1 . 2 . 3]" 1
3484 2 38 LEU QD 2 64 ILE QG . . 4.540 4.042 3.862 4.196 . 0 0 "[ . 1 . 2 . 3]" 1
3485 2 38 LEU QD 2 64 ILE MD . . 3.460 2.444 2.222 2.627 . 0 0 "[ . 1 . 2 . 3]" 1
3486 2 39 ASP H 2 39 ASP QB . . 3.150 2.177 2.058 2.255 . 0 0 "[ . 1 . 2 . 3]" 1
3487 2 39 ASP QB 2 40 GLU H . . 3.650 2.620 2.378 2.833 . 0 0 "[ . 1 . 2 . 3]" 1
3488 2 39 ASP QB 2 42 ALA MB . . 4.600 4.538 4.376 4.611 0.011 8 0 "[ . 1 . 2 . 3]" 1
3489 2 40 GLU H 2 40 GLU QG . . 4.430 3.873 2.008 4.058 . 0 0 "[ . 1 . 2 . 3]" 1
3490 2 40 GLU H 2 41 LEU QB . . 4.900 4.417 4.346 4.488 . 0 0 "[ . 1 . 2 . 3]" 1
3491 2 40 GLU HA 2 40 GLU QG . . 3.440 2.492 2.181 3.131 . 0 0 "[ . 1 . 2 . 3]" 1
3492 2 40 GLU QG 2 41 LEU H . . 4.140 3.813 3.475 4.131 . 0 0 "[ . 1 . 2 . 3]" 1
3493 2 41 LEU H 2 44 LEU QD . . 4.660 4.223 3.837 4.446 . 0 0 "[ . 1 . 2 . 3]" 1
3494 2 41 LEU HA 2 41 LEU QD . . 3.060 1.961 1.873 2.586 . 0 0 "[ . 1 . 2 . 3]" 1
3495 2 41 LEU HA 2 44 LEU QB . . 4.650 2.730 2.530 2.956 . 0 0 "[ . 1 . 2 . 3]" 1
3496 2 41 LEU HA 2 44 LEU QD . . 3.540 2.552 1.967 2.857 . 0 0 "[ . 1 . 2 . 3]" 1
3497 2 41 LEU QB 2 41 LEU QD . . 2.850 1.973 1.825 2.062 . 0 0 "[ . 1 . 2 . 3]" 1
3498 2 41 LEU QB 2 42 ALA H . . 4.270 2.434 2.221 2.702 . 0 0 "[ . 1 . 2 . 3]" 1
3499 2 41 LEU QB 2 42 ALA MB . . 4.640 3.737 3.631 3.943 . 0 0 "[ . 1 . 2 . 3]" 1
3500 2 41 LEU HG 2 44 LEU QD . . 5.440 5.097 4.265 5.459 0.019 30 0 "[ . 1 . 2 . 3]" 1
3501 2 41 LEU QD 2 42 ALA H . . 4.620 3.223 3.000 3.534 . 0 0 "[ . 1 . 2 . 3]" 1
3502 2 41 LEU QD 2 42 ALA HA . . 5.440 3.008 2.766 3.820 . 0 0 "[ . 1 . 2 . 3]" 1
3503 2 41 LEU QD 2 44 LEU H . . 4.480 4.000 3.540 4.522 0.042 21 0 "[ . 1 . 2 . 3]" 1
3504 2 41 LEU QD 2 44 LEU QB . . 4.280 2.844 2.199 3.307 . 0 0 "[ . 1 . 2 . 3]" 1
3505 2 41 LEU QD 2 44 LEU HG . . 4.810 4.162 3.130 4.737 . 0 0 "[ . 1 . 2 . 3]" 1
3506 2 41 LEU QD 2 44 LEU QD . . 3.260 2.658 1.923 3.266 0.006 18 0 "[ . 1 . 2 . 3]" 1
3507 2 41 LEU QD 2 46 VAL HB . . 4.220 3.886 3.261 4.249 0.029 18 0 "[ . 1 . 2 . 3]" 1
3508 2 41 LEU QD 2 57 MET ME . . 2.880 1.935 1.837 2.074 . 0 0 "[ . 1 . 2 . 3]" 1
3509 2 41 LEU QD 2 61 LEU QD . . 3.420 3.108 2.380 3.394 . 0 0 "[ . 1 . 2 . 3]" 1
3510 2 43 SER H 2 43 SER QB . . 3.610 2.191 2.077 2.436 . 0 0 "[ . 1 . 2 . 3]" 1
3511 2 43 SER H 2 44 LEU QB . . 4.570 4.472 4.306 4.594 0.024 30 0 "[ . 1 . 2 . 3]" 1
3512 2 44 LEU H 2 44 LEU QB . . 3.260 2.367 2.268 2.565 . 0 0 "[ . 1 . 2 . 3]" 1
3513 2 44 LEU H 2 44 LEU QD . . 3.280 3.174 3.048 3.334 0.054 20 0 "[ . 1 . 2 . 3]" 1
3514 2 44 LEU H 2 46 VAL QG . . 5.140 5.056 4.475 5.238 0.098 30 0 "[ . 1 . 2 . 3]" 1
3515 2 44 LEU HA 2 44 LEU QD . . 3.010 2.096 1.953 2.344 . 0 0 "[ . 1 . 2 . 3]" 1
3516 2 44 LEU QB 2 44 LEU QD . . 2.790 1.923 1.855 1.953 . 0 0 "[ . 1 . 2 . 3]" 1
3517 2 44 LEU QB 2 46 VAL H . . 4.110 3.325 3.011 3.710 . 0 0 "[ . 1 . 2 . 3]" 1
3518 2 44 LEU QB 2 46 VAL QG . . 3.650 3.238 2.467 3.558 . 0 0 "[ . 1 . 2 . 3]" 1
3519 2 44 LEU QD 2 45 GLN H . . 4.670 3.496 2.867 4.171 . 0 0 "[ . 1 . 2 . 3]" 1
3520 2 44 LEU QD 2 46 VAL QG . . 4.970 3.860 3.182 4.226 . 0 0 "[ . 1 . 2 . 3]" 1
3521 2 44 LEU QD 2 57 MET ME . . 5.290 4.583 4.121 5.055 . 0 0 "[ . 1 . 2 . 3]" 1
3522 2 45 GLN HA 2 45 GLN QG . . 3.720 2.303 2.135 2.704 . 0 0 "[ . 1 . 2 . 3]" 1
3523 2 45 GLN QG 2 46 VAL H . . 4.710 4.204 3.883 4.648 . 0 0 "[ . 1 . 2 . 3]" 1
3524 2 46 VAL H 2 46 VAL QG . . 3.060 1.963 1.913 2.166 . 0 0 "[ . 1 . 2 . 3]" 1
3525 2 46 VAL HA 2 50 GLN QB . . 4.680 3.711 3.201 4.183 . 0 0 "[ . 1 . 2 . 3]" 1
3526 2 46 VAL QG 2 47 THR H . . 3.430 2.233 2.005 2.719 . 0 0 "[ . 1 . 2 . 3]" 1
3527 2 46 VAL QG 2 47 THR HB . . 4.730 4.391 4.166 4.727 . 0 0 "[ . 1 . 2 . 3]" 1
3528 2 46 VAL QG 2 47 THR MG . . 4.240 3.205 2.730 3.520 . 0 0 "[ . 1 . 2 . 3]" 1
3529 2 46 VAL QG 2 50 GLN H . . 4.290 3.495 3.230 4.145 . 0 0 "[ . 1 . 2 . 3]" 1
3530 2 46 VAL QG 2 50 GLN QB . . 3.270 1.900 1.722 2.503 . 0 0 "[ . 1 . 2 . 3]" 1
3531 2 46 VAL QG 2 50 GLN QG . . 4.000 3.176 2.777 3.696 . 0 0 "[ . 1 . 2 . 3]" 1
3532 2 46 VAL QG 2 51 ALA H . . 3.700 2.663 2.264 3.048 . 0 0 "[ . 1 . 2 . 3]" 1
3533 2 46 VAL QG 2 51 ALA MB . . 3.180 2.484 2.030 3.072 . 0 0 "[ . 1 . 2 . 3]" 1
3534 2 46 VAL QG 2 54 HIS HB2 . . 4.760 4.025 3.400 4.405 . 0 0 "[ . 1 . 2 . 3]" 1
3535 2 46 VAL QG 2 58 ILE MD . . 4.780 4.484 4.045 4.788 0.008 13 0 "[ . 1 . 2 . 3]" 1
3536 2 47 THR H 2 50 GLN QB . . 3.540 2.803 2.302 3.162 . 0 0 "[ . 1 . 2 . 3]" 1
3537 2 47 THR H 2 50 GLN QG . . 4.500 4.223 3.562 4.501 0.001 30 0 "[ . 1 . 2 . 3]" 1
3538 2 47 THR MG 2 49 GLN QB . . 3.880 1.966 1.865 2.194 . 0 0 "[ . 1 . 2 . 3]" 1
3539 2 47 THR MG 2 49 GLN QG . . 4.580 2.855 2.006 3.637 . 0 0 "[ . 1 . 2 . 3]" 1
3540 2 47 THR MG 2 49 GLN QE . . 4.090 3.036 2.119 3.938 . 0 0 "[ . 1 . 2 . 3]" 1
3541 2 47 THR MG 2 50 GLN QB . . 4.810 2.549 1.973 2.872 . 0 0 "[ . 1 . 2 . 3]" 1
3542 2 48 MET H 2 48 MET QB . . 3.620 2.175 2.057 2.249 . 0 0 "[ . 1 . 2 . 3]" 1
3543 2 48 MET HA 2 52 GLN QG . . 4.800 4.146 3.698 4.801 0.001 29 0 "[ . 1 . 2 . 3]" 1
3544 2 48 MET QB 2 49 GLN H . . 3.110 2.662 2.463 2.738 . 0 0 "[ . 1 . 2 . 3]" 1
3545 2 48 MET QB 2 51 ALA MB . . 4.540 3.967 3.823 4.287 . 0 0 "[ . 1 . 2 . 3]" 1
3546 2 48 MET ME 2 48 MET QG . . 3.500 2.162 2.016 2.232 . 0 0 "[ . 1 . 2 . 3]" 1
3547 2 48 MET QG 2 51 ALA MB . . 4.320 3.421 3.009 4.084 . 0 0 "[ . 1 . 2 . 3]" 1
3548 2 48 MET ME 2 52 GLN QG . . 3.540 2.237 1.754 2.946 . 0 0 "[ . 1 . 2 . 3]" 1
3549 2 49 GLN H 2 49 GLN QB . . 3.010 2.408 2.047 2.621 . 0 0 "[ . 1 . 2 . 3]" 1
3550 2 49 GLN H 2 49 GLN QG . . 3.460 2.397 1.940 3.307 . 0 0 "[ . 1 . 2 . 3]" 1
3551 2 49 GLN HA 2 52 GLN QG . . 4.980 3.683 2.718 4.431 . 0 0 "[ . 1 . 2 . 3]" 1
3552 2 49 GLN HA 2 52 GLN QE . . 4.620 3.835 2.086 4.614 . 0 0 "[ . 1 . 2 . 3]" 1
3553 2 49 GLN QB 2 49 GLN QE . . 3.870 2.806 2.164 3.435 . 0 0 "[ . 1 . 2 . 3]" 1
3554 2 49 GLN QB 2 51 ALA H . . 4.890 4.424 4.334 4.667 . 0 0 "[ . 1 . 2 . 3]" 1
3555 2 50 GLN H 2 50 GLN QB . . 3.070 2.115 2.050 2.254 . 0 0 "[ . 1 . 2 . 3]" 1
3556 2 50 GLN H 2 50 GLN QG . . 4.130 3.455 2.649 3.884 . 0 0 "[ . 1 . 2 . 3]" 1
3557 2 50 GLN QB 2 51 ALA H . . 3.420 2.764 2.610 2.806 . 0 0 "[ . 1 . 2 . 3]" 1
3558 2 50 GLN QB 2 51 ALA MB . . 5.170 3.972 3.879 4.031 . 0 0 "[ . 1 . 2 . 3]" 1
3559 2 50 GLN QB 2 54 HIS HE1 . . 4.730 3.605 3.261 4.333 . 0 0 "[ . 1 . 2 . 3]" 1
3560 2 50 GLN QG 2 51 ALA H . . 5.340 4.520 4.315 4.605 . 0 0 "[ . 1 . 2 . 3]" 1
3561 2 51 ALA MB 2 52 GLN QG . . 4.390 3.684 3.181 4.141 . 0 0 "[ . 1 . 2 . 3]" 1
3562 2 52 GLN H 2 52 GLN QB . . 3.110 2.263 2.075 2.600 . 0 0 "[ . 1 . 2 . 3]" 1
3563 2 52 GLN H 2 52 GLN QG . . 3.270 2.703 2.155 3.197 . 0 0 "[ . 1 . 2 . 3]" 1
3564 2 52 GLN HA 2 52 GLN QG . . 3.590 2.188 2.013 2.475 . 0 0 "[ . 1 . 2 . 3]" 1
3565 2 52 GLN QB 2 55 THR MG . . 4.300 3.716 3.414 3.905 . 0 0 "[ . 1 . 2 . 3]" 1
3566 2 52 GLN QG 2 53 LYS H . . 4.760 4.313 3.922 4.497 . 0 0 "[ . 1 . 2 . 3]" 1
3567 2 52 GLN QG 2 55 THR MG . . 4.880 3.636 3.127 4.045 . 0 0 "[ . 1 . 2 . 3]" 1
3568 2 53 LYS H 2 53 LYS QG . . 3.500 2.703 2.168 3.374 . 0 0 "[ . 1 . 2 . 3]" 1
3569 2 53 LYS HA 2 53 LYS QG . . 3.620 2.495 2.059 2.836 . 0 0 "[ . 1 . 2 . 3]" 1
3570 2 53 LYS QG 2 54 HIS H . . 4.840 4.271 4.011 4.527 . 0 0 "[ . 1 . 2 . 3]" 1
3571 2 54 HIS HA 2 57 MET QB . . 4.810 3.886 3.661 4.144 . 0 0 "[ . 1 . 2 . 3]" 1
3572 2 54 HIS HB3 2 57 MET QB . . 4.530 2.454 2.198 2.673 . 0 0 "[ . 1 . 2 . 3]" 1
3573 2 55 THR H 2 56 GLU QB . . 5.180 4.394 4.300 4.495 . 0 0 "[ . 1 . 2 . 3]" 1
3574 2 55 THR HA 2 58 ILE QG . . 4.650 3.581 2.571 4.167 . 0 0 "[ . 1 . 2 . 3]" 1
3575 2 56 GLU HA 2 56 GLU QG . . 3.690 2.176 1.999 2.359 . 0 0 "[ . 1 . 2 . 3]" 1
3576 2 56 GLU QB 2 57 MET H . . 3.420 2.609 2.401 2.800 . 0 0 "[ . 1 . 2 . 3]" 1
3577 2 56 GLU QB 2 58 ILE H . . 5.290 4.702 4.508 4.959 . 0 0 "[ . 1 . 2 . 3]" 1
3578 2 57 MET H 2 57 MET QB . . 3.170 2.229 2.160 2.249 . 0 0 "[ . 1 . 2 . 3]" 1
3579 2 57 MET QB 2 57 MET ME . . 2.950 1.965 1.895 2.153 . 0 0 "[ . 1 . 2 . 3]" 1
3580 2 57 MET QB 2 58 ILE H . . 3.780 2.534 2.192 2.749 . 0 0 "[ . 1 . 2 . 3]" 1
3581 2 57 MET ME 2 57 MET QG . . 3.230 2.450 2.360 2.554 . 0 0 "[ . 1 . 2 . 3]" 1
3582 2 57 MET QG 2 58 ILE H . . 4.440 3.647 3.158 4.220 . 0 0 "[ . 1 . 2 . 3]" 1
3583 2 57 MET QG 2 58 ILE HA . . 4.800 3.747 3.290 4.657 . 0 0 "[ . 1 . 2 . 3]" 1
3584 2 57 MET QG 2 58 ILE MD . . 5.340 4.885 4.238 5.337 . 0 0 "[ . 1 . 2 . 3]" 1
3585 2 57 MET ME 2 58 ILE QG . . 4.140 3.313 2.978 3.624 . 0 0 "[ . 1 . 2 . 3]" 1
3586 2 57 MET ME 2 61 LEU QD . . 4.200 3.657 3.452 3.979 . 0 0 "[ . 1 . 2 . 3]" 1
3587 2 58 ILE HA 2 61 LEU QB . . 4.560 2.812 2.486 2.997 . 0 0 "[ . 1 . 2 . 3]" 1
3588 2 58 ILE HA 2 61 LEU QD . . 3.600 1.971 1.902 2.103 . 0 0 "[ . 1 . 2 . 3]" 1
3589 2 58 ILE QG 2 58 ILE MG . . 3.010 2.131 1.940 2.333 . 0 0 "[ . 1 . 2 . 3]" 1
3590 2 58 ILE MG 2 61 LEU QD . . 3.650 2.704 2.365 2.850 . 0 0 "[ . 1 . 2 . 3]" 1
3591 2 58 ILE MG 2 62 LYS QB . . 5.340 3.900 3.565 4.224 . 0 0 "[ . 1 . 2 . 3]" 1
3592 2 59 THR MG 2 63 LYS QB . . 4.880 4.388 3.921 4.772 . 0 0 "[ . 1 . 2 . 3]" 1
3593 2 59 THR MG 2 63 LYS QG . . 4.450 2.974 2.567 3.584 . 0 0 "[ . 1 . 2 . 3]" 1
3594 2 60 THR MG 2 61 LEU QD . . 4.750 4.103 3.952 4.308 . 0 0 "[ . 1 . 2 . 3]" 1
3595 2 60 THR MG 2 63 LYS QB . . 3.750 2.982 2.807 3.190 . 0 0 "[ . 1 . 2 . 3]" 1
3596 2 60 THR MG 2 63 LYS QG . . 5.340 4.232 3.812 4.791 . 0 0 "[ . 1 . 2 . 3]" 1
3597 2 61 LEU H 2 61 LEU QB . . 3.480 2.371 2.304 2.444 . 0 0 "[ . 1 . 2 . 3]" 1
3598 2 61 LEU H 2 61 LEU QD . . 3.570 3.128 3.082 3.194 . 0 0 "[ . 1 . 2 . 3]" 1
3599 2 61 LEU H 2 64 ILE QG . . 4.870 4.105 4.068 4.139 . 0 0 "[ . 1 . 2 . 3]" 1
3600 2 61 LEU HA 2 61 LEU QD . . 3.080 2.249 2.126 2.481 . 0 0 "[ . 1 . 2 . 3]" 1
3601 2 61 LEU HA 2 64 ILE QG . . 4.040 1.989 1.965 2.036 . 0 0 "[ . 1 . 2 . 3]" 1
3602 2 61 LEU QB 2 63 LYS H . . 5.230 4.565 4.511 4.590 . 0 0 "[ . 1 . 2 . 3]" 1
3603 2 61 LEU QD 2 62 LYS H . . 4.330 4.098 4.052 4.148 . 0 0 "[ . 1 . 2 . 3]" 1
3604 2 61 LEU QD 2 63 LYS H . . 5.440 5.389 5.344 5.425 . 0 0 "[ . 1 . 2 . 3]" 1
3605 2 61 LEU QD 2 64 ILE QG . . 4.270 3.386 3.319 3.475 . 0 0 "[ . 1 . 2 . 3]" 1
3606 2 61 LEU QD 2 64 ILE MD . . 2.840 1.977 1.918 2.083 . 0 0 "[ . 1 . 2 . 3]" 1
3607 2 62 LYS H 2 62 LYS QG . . 4.420 3.920 2.513 4.037 . 0 0 "[ . 1 . 2 . 3]" 1
3608 2 62 LYS QB 2 63 LYS H . . 3.430 2.869 2.819 3.543 0.113 19 0 "[ . 1 . 2 . 3]" 1
3609 2 62 LYS QE 2 62 LYS QG . . 3.150 2.125 1.933 2.420 . 0 0 "[ . 1 . 2 . 3]" 1
3610 2 63 LYS H 2 63 LYS QB . . 3.200 2.310 2.111 2.481 . 0 0 "[ . 1 . 2 . 3]" 1
3611 2 63 LYS H 2 63 LYS QG . . 3.540 2.618 2.204 3.118 . 0 0 "[ . 1 . 2 . 3]" 1
3612 2 63 LYS HA 2 63 LYS QG . . 3.640 2.469 2.224 2.758 . 0 0 "[ . 1 . 2 . 3]" 1
3613 2 63 LYS QB 2 64 ILE H . . 3.900 2.718 2.673 2.785 . 0 0 "[ . 1 . 2 . 3]" 1
3614 2 64 ILE HB 2 67 PHE QB . . 4.450 4.034 3.851 4.096 . 0 0 "[ . 1 . 2 . 3]" 1
3615 2 64 ILE QG 2 64 ILE MG . . 3.110 2.276 2.270 2.284 . 0 0 "[ . 1 . 2 . 3]" 1
3616 2 64 ILE MG 2 67 PHE QB . . 4.080 3.331 3.261 3.429 . 0 0 "[ . 1 . 2 . 3]" 1
3617 2 64 ILE QG 2 65 ARG H . . 3.620 2.951 2.934 2.971 . 0 0 "[ . 1 . 2 . 3]" 1
3618 2 65 ARG H 2 65 ARG QG . . 3.400 2.657 2.631 2.838 . 0 0 "[ . 1 . 2 . 3]" 1
3619 2 65 ARG H 2 65 ARG QD . . 4.330 3.729 3.659 3.972 . 0 0 "[ . 1 . 2 . 3]" 1
3620 2 65 ARG H 2 67 PHE QB . . 5.130 4.013 3.967 4.094 . 0 0 "[ . 1 . 2 . 3]" 1
3621 2 65 ARG QG 2 66 ARG H . . 3.770 2.110 2.001 2.250 . 0 0 "[ . 1 . 2 . 3]" 1
3622 2 65 ARG QG 2 66 ARG QB . . 3.980 2.463 2.360 2.562 . 0 0 "[ . 1 . 2 . 3]" 1
3623 2 65 ARG QG 2 67 PHE H . . 5.340 3.809 3.730 4.151 . 0 0 "[ . 1 . 2 . 3]" 1
3624 2 65 ARG QD 2 66 ARG QB . . 4.520 3.984 3.708 4.166 . 0 0 "[ . 1 . 2 . 3]" 1
3625 2 66 ARG H 2 66 ARG QB . . 3.220 2.874 2.817 2.965 . 0 0 "[ . 1 . 2 . 3]" 1
3626 2 66 ARG H 2 66 ARG QG . . 3.550 2.192 1.989 2.337 . 0 0 "[ . 1 . 2 . 3]" 1
3627 2 66 ARG HA 2 66 ARG QG . . 3.590 3.414 3.372 3.433 . 0 0 "[ . 1 . 2 . 3]" 1
3628 2 66 ARG QG 2 67 PHE H . . 4.660 2.477 2.266 3.510 . 0 0 "[ . 1 . 2 . 3]" 1
3629 2 68 LYS H 2 68 LYS QB . . 3.680 3.064 2.867 3.260 . 0 0 "[ . 1 . 2 . 3]" 1
3630 2 68 LYS HA 2 69 VAL QG . . 4.700 3.662 3.368 4.132 . 0 0 "[ . 1 . 2 . 3]" 1
3631 2 68 LYS QB 2 69 VAL H . . 4.060 3.341 1.970 3.692 . 0 0 "[ . 1 . 2 . 3]" 1
3632 2 69 VAL H 2 69 VAL QG . . 3.090 2.047 1.870 2.395 . 0 0 "[ . 1 . 2 . 3]" 1
3633 2 69 VAL QG 2 70 SER HA . . 5.240 4.002 3.686 4.397 . 0 0 "[ . 1 . 2 . 3]" 1
3634 2 69 VAL QG 2 74 MET ME . . 3.710 2.222 1.891 2.716 . 0 0 "[ . 1 . 2 . 3]" 1
3635 2 70 SER H 2 70 SER QB . . 3.450 2.278 2.107 3.030 . 0 0 "[ . 1 . 2 . 3]" 1
3636 2 70 SER H 2 72 VAL QG . . 5.440 4.126 3.761 5.293 . 0 0 "[ . 1 . 2 . 3]" 1
3637 2 70 SER H 2 73 ILE QG . . 5.070 3.742 3.086 5.181 0.111 19 0 "[ . 1 . 2 . 3]" 1
3638 2 70 SER QB 2 72 VAL QG . . 3.810 2.051 1.872 3.068 . 0 0 "[ . 1 . 2 . 3]" 1
3639 2 70 SER QB 2 73 ILE H . . 4.010 2.949 2.597 3.198 . 0 0 "[ . 1 . 2 . 3]" 1
3640 2 70 SER QB 2 73 ILE HB . . 4.220 3.828 3.350 4.061 . 0 0 "[ . 1 . 2 . 3]" 1
3641 2 70 SER QB 2 73 ILE MD . . 3.560 2.835 2.383 3.225 . 0 0 "[ . 1 . 2 . 3]" 1
3642 2 70 SER QB 2 74 MET H . . 5.020 4.707 4.469 4.939 . 0 0 "[ . 1 . 2 . 3]" 1
3643 2 71 GLN HA 2 74 MET QB . . 4.020 2.809 2.254 3.961 . 0 0 "[ . 1 . 2 . 3]" 1
3644 2 71 GLN HA 2 74 MET QG . . 4.400 2.887 1.929 3.368 . 0 0 "[ . 1 . 2 . 3]" 1
3645 2 71 GLN QB 2 72 VAL H . . 3.650 2.832 2.592 3.494 . 0 0 "[ . 1 . 2 . 3]" 1
3646 2 71 GLN QG 2 72 VAL QG . . 5.000 4.467 3.382 4.942 . 0 0 "[ . 1 . 2 . 3]" 1
3647 2 72 VAL H 2 72 VAL QG . . 2.980 1.932 1.902 2.178 . 0 0 "[ . 1 . 2 . 3]" 1
3648 2 72 VAL H 2 74 MET QG . . 5.340 5.073 4.133 5.347 0.007 15 0 "[ . 1 . 2 . 3]" 1
3649 2 72 VAL HA 2 75 GLU QB . . 4.120 2.947 2.342 4.006 . 0 0 "[ . 1 . 2 . 3]" 1
3650 2 72 VAL HA 2 76 LYS QD . . 5.070 4.557 3.980 4.973 . 0 0 "[ . 1 . 2 . 3]" 1
3651 2 72 VAL QG 2 73 ILE H . . 3.650 2.112 1.983 3.211 . 0 0 "[ . 1 . 2 . 3]" 1
3652 2 72 VAL QG 2 73 ILE HA . . 4.470 3.078 2.997 3.548 . 0 0 "[ . 1 . 2 . 3]" 1
3653 2 72 VAL QG 2 76 LYS H . . 4.610 3.953 3.653 4.231 . 0 0 "[ . 1 . 2 . 3]" 1
3654 2 72 VAL QG 2 76 LYS QD . . 3.520 2.363 1.926 2.681 . 0 0 "[ . 1 . 2 . 3]" 1
3655 2 72 VAL QG 2 76 LYS QE . . 3.130 2.712 2.123 3.121 . 0 0 "[ . 1 . 2 . 3]" 1
3656 2 73 ILE H 2 73 ILE QG . . 3.840 2.234 2.016 2.437 . 0 0 "[ . 1 . 2 . 3]" 1
3657 2 73 ILE MG 2 77 SER QB . . 4.700 3.101 2.916 3.341 . 0 0 "[ . 1 . 2 . 3]" 1
3658 2 73 ILE QG 2 74 MET H . . 5.090 4.010 3.931 4.120 . 0 0 "[ . 1 . 2 . 3]" 1
3659 2 74 MET H 2 74 MET QB . . 3.410 2.477 2.370 2.573 . 0 0 "[ . 1 . 2 . 3]" 1
3660 2 74 MET H 2 74 MET QG . . 3.040 2.164 1.926 2.401 . 0 0 "[ . 1 . 2 . 3]" 1
3661 2 74 MET ME 2 74 MET QG . . 2.990 2.088 1.966 2.406 . 0 0 "[ . 1 . 2 . 3]" 1
3662 2 74 MET QG 2 75 GLU H . . 4.170 3.699 1.987 4.147 . 0 0 "[ . 1 . 2 . 3]" 1
3663 2 75 GLU H 2 75 GLU QB . . 3.150 2.201 2.053 2.528 . 0 0 "[ . 1 . 2 . 3]" 1
3664 2 75 GLU H 2 75 GLU QG . . 3.530 2.995 2.071 3.761 0.231 30 0 "[ . 1 . 2 . 3]" 1
3665 2 75 GLU HA 2 75 GLU QG . . 3.700 2.551 2.037 3.440 . 0 0 "[ . 1 . 2 . 3]" 1
3666 2 76 LYS H 2 76 LYS QG . . 3.510 2.944 2.386 3.177 . 0 0 "[ . 1 . 2 . 3]" 1
3667 2 76 LYS H 2 76 LYS QD . . 4.810 3.771 3.301 4.167 . 0 0 "[ . 1 . 2 . 3]" 1
3668 2 76 LYS QB 2 76 LYS QD . . 3.490 2.106 1.986 2.129 . 0 0 "[ . 1 . 2 . 3]" 1
3669 2 76 LYS QG 2 77 SER H . . 4.560 4.405 4.236 4.478 . 0 0 "[ . 1 . 2 . 3]" 1
3670 2 77 SER QB 2 80 LEU H . . 5.340 5.027 4.916 5.138 . 0 0 "[ . 1 . 2 . 3]" 1
3671 2 77 SER QB 2 81 TYR H . . 5.340 4.652 4.527 4.785 . 0 0 "[ . 1 . 2 . 3]" 1
3672 2 78 THR MG 2 82 ASN QD . . 3.330 2.243 1.834 2.833 . 0 0 "[ . 1 . 2 . 3]" 1
3673 2 79 MET H 2 79 MET QG . . 4.010 3.895 3.778 3.986 . 0 0 "[ . 1 . 2 . 3]" 1
3674 2 79 MET H 2 80 LEU QB . . 5.340 4.876 4.676 5.041 . 0 0 "[ . 1 . 2 . 3]" 1
3675 2 79 MET H 2 80 LEU QD . . 5.440 4.690 3.628 5.086 . 0 0 "[ . 1 . 2 . 3]" 1
3676 2 79 MET HA 2 79 MET QG . . 3.650 2.616 2.280 3.237 . 0 0 "[ . 1 . 2 . 3]" 1
3677 2 79 MET QB 2 80 LEU QD . . 4.770 3.153 1.986 3.725 . 0 0 "[ . 1 . 2 . 3]" 1
3678 2 79 MET ME 2 79 MET QG . . 3.350 2.131 1.982 2.329 . 0 0 "[ . 1 . 2 . 3]" 1
3679 2 79 MET ME 2 80 LEU QD . . 3.480 2.292 1.955 2.941 . 0 0 "[ . 1 . 2 . 3]" 1
3680 2 79 MET ME 2 83 LYS QD . . 4.270 2.821 2.119 3.950 . 0 0 "[ . 1 . 2 . 3]" 1
3681 2 80 LEU H 2 80 LEU QB . . 3.250 2.412 2.194 2.611 . 0 0 "[ . 1 . 2 . 3]" 1
3682 2 80 LEU HA 2 80 LEU QD . . 3.230 2.068 1.905 2.306 . 0 0 "[ . 1 . 2 . 3]" 1
3683 2 80 LEU QB 2 81 TYR H . . 3.820 2.585 2.447 2.689 . 0 0 "[ . 1 . 2 . 3]" 1
3684 2 80 LEU QB 2 81 TYR HA . . 4.420 3.842 3.794 3.882 . 0 0 "[ . 1 . 2 . 3]" 1
3685 2 80 LEU QB 2 84 PHE QD . . 4.340 3.380 2.943 4.105 . 0 0 "[ . 1 . 2 . 3]" 1
3686 2 80 LEU QB 2 84 PHE QE . . 4.620 2.752 2.149 3.573 . 0 0 "[ . 1 . 2 . 3]" 1
3687 2 80 LEU QD 2 81 TYR H . . 4.540 4.027 3.647 4.172 . 0 0 "[ . 1 . 2 . 3]" 1
3688 2 80 LEU QD 2 83 LYS H . . 5.440 4.738 4.337 5.068 . 0 0 "[ . 1 . 2 . 3]" 1
3689 2 80 LEU QD 2 83 LYS QB . . 4.300 3.273 2.837 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
3690 2 80 LEU QD 2 83 LYS QD . . 3.750 2.724 2.217 3.498 . 0 0 "[ . 1 . 2 . 3]" 1
3691 2 80 LEU QD 2 83 LYS QE . . 4.310 3.150 2.088 3.786 . 0 0 "[ . 1 . 2 . 3]" 1
3692 2 80 LEU QD 2 84 PHE QD . . 4.980 4.246 3.565 4.679 . 0 0 "[ . 1 . 2 . 3]" 1
3693 2 80 LEU QD 2 84 PHE QE . . 4.190 3.212 2.810 3.703 . 0 0 "[ . 1 . 2 . 3]" 1
3694 2 80 LEU QD 2 84 PHE HZ . . 4.740 4.069 3.614 4.669 . 0 0 "[ . 1 . 2 . 3]" 1
3695 2 81 TYR QD 2 85 LYS QD . . 4.660 3.976 3.133 4.656 . 0 0 "[ . 1 . 2 . 3]" 1
3696 2 82 ASN H 2 82 ASN QB . . 3.140 2.324 2.066 2.682 . 0 0 "[ . 1 . 2 . 3]" 1
3697 2 82 ASN H 2 82 ASN QD . . 4.110 3.360 2.093 4.110 . 6 0 "[ . 1 . 2 . 3]" 1
3698 2 82 ASN H 2 83 LYS QB . . 5.140 4.339 4.233 4.443 . 0 0 "[ . 1 . 2 . 3]" 1
3699 2 82 ASN H 2 85 LYS QB . . 5.030 4.450 4.204 5.068 0.038 6 0 "[ . 1 . 2 . 3]" 1
3700 2 82 ASN HA 2 85 LYS QB . . 3.920 2.241 1.975 3.471 . 0 0 "[ . 1 . 2 . 3]" 1
3701 2 82 ASN QB 2 83 LYS H . . 3.500 2.836 2.578 3.486 . 0 0 "[ . 1 . 2 . 3]" 1
3702 2 83 LYS H 2 83 LYS QG . . 4.400 3.904 3.761 3.969 . 0 0 "[ . 1 . 2 . 3]" 1
3703 2 83 LYS H 2 83 LYS QD . . 4.760 4.389 4.281 4.554 . 0 0 "[ . 1 . 2 . 3]" 1
3704 2 83 LYS H 2 84 PHE QB . . 5.340 4.789 4.477 4.965 . 0 0 "[ . 1 . 2 . 3]" 1
3705 2 83 LYS HA 2 83 LYS QG . . 3.620 2.393 2.269 2.566 . 0 0 "[ . 1 . 2 . 3]" 1
3706 2 83 LYS QB 2 84 PHE QD . . 4.620 3.798 3.295 4.162 . 0 0 "[ . 1 . 2 . 3]" 1
3707 2 83 LYS QB 2 84 PHE QE . . 5.340 4.402 3.817 4.969 . 0 0 "[ . 1 . 2 . 3]" 1
3708 2 83 LYS QB 2 85 LYS H . . 5.060 4.542 4.411 4.885 . 0 0 "[ . 1 . 2 . 3]" 1
3709 2 83 LYS QE 2 83 LYS QG . . 3.060 2.079 1.956 2.322 . 0 0 "[ . 1 . 2 . 3]" 1
3710 2 83 LYS QG 2 84 PHE H . . 4.150 3.703 3.098 4.154 0.004 6 0 "[ . 1 . 2 . 3]" 1
3711 2 83 LYS QG 2 87 MET ME . . 4.410 3.846 2.977 4.405 . 0 0 "[ . 1 . 2 . 3]" 1
3712 2 84 PHE H 2 84 PHE QB . . 3.340 2.337 2.186 2.465 . 0 0 "[ . 1 . 2 . 3]" 1
3713 2 84 PHE HA 2 87 MET QG . . 4.160 2.952 1.978 3.520 . 0 0 "[ . 1 . 2 . 3]" 1
3714 2 84 PHE QB 2 85 LYS H . . 3.510 2.639 2.408 2.784 . 0 0 "[ . 1 . 2 . 3]" 1
3715 2 84 PHE QB 2 87 MET ME . . 4.670 4.015 3.484 4.686 0.016 9 0 "[ . 1 . 2 . 3]" 1
3716 2 84 PHE QD 2 87 MET QB . . 5.340 3.991 3.350 5.282 . 0 0 "[ . 1 . 2 . 3]" 1
3717 2 85 LYS H 2 85 LYS QB . . 3.280 2.207 2.043 2.283 . 0 0 "[ . 1 . 2 . 3]" 1
3718 2 85 LYS QB 2 85 LYS QD . . 3.340 2.093 1.985 2.250 . 0 0 "[ . 1 . 2 . 3]" 1
3719 2 85 LYS QB 2 85 LYS QE . . 4.270 3.199 2.128 3.664 . 0 0 "[ . 1 . 2 . 3]" 1
3720 2 85 LYS QB 2 86 ASN H . . 3.640 2.548 2.218 3.494 . 0 0 "[ . 1 . 2 . 3]" 1
3721 2 86 ASN H 2 86 ASN QD . . 4.350 3.904 2.213 4.328 . 0 0 "[ . 1 . 2 . 3]" 1
3722 2 86 ASN QD 2 89 LEU MD2 . . 4.850 3.846 2.465 4.851 0.001 27 0 "[ . 1 . 2 . 3]" 1
3723 2 87 MET H 2 87 MET QB . . 3.190 2.430 2.283 2.674 . 0 0 "[ . 1 . 2 . 3]" 1
3724 2 87 MET H 2 87 MET QG . . 3.310 2.440 1.948 2.747 . 0 0 "[ . 1 . 2 . 3]" 1
3725 2 87 MET H 2 88 PHE QB . . 4.770 4.235 4.039 4.385 . 0 0 "[ . 1 . 2 . 3]" 1
3726 2 87 MET HA 2 87 MET QG . . 3.410 2.435 2.212 3.339 . 0 0 "[ . 1 . 2 . 3]" 1
3727 2 87 MET QB 2 88 PHE H . . 3.550 2.804 2.684 3.512 . 0 0 "[ . 1 . 2 . 3]" 1
3728 2 87 MET QB 2 89 LEU H . . 5.340 4.770 4.707 5.154 . 0 0 "[ . 1 . 2 . 3]" 1
3729 2 88 PHE H 2 88 PHE QB . . 3.090 2.178 2.087 2.300 . 0 0 "[ . 1 . 2 . 3]" 1
3730 2 88 PHE QB 2 89 LEU H . . 3.480 2.753 2.694 2.823 . 0 0 "[ . 1 . 2 . 3]" 1
3731 2 88 PHE QB 2 89 LEU HB3 . . 4.710 4.019 3.881 4.214 . 0 0 "[ . 1 . 2 . 3]" 1
3732 2 88 PHE QB 2 89 LEU MD2 . . 4.580 4.282 3.846 4.597 0.017 11 0 "[ . 1 . 2 . 3]" 1
3733 2 92 GLU H 2 92 GLU QB . . 3.340 2.722 2.105 3.304 . 0 0 "[ . 1 . 2 . 3]" 1
3734 2 92 GLU QB 2 93 GLY H . . 4.050 3.086 1.941 3.997 . 0 0 "[ . 1 . 2 . 3]" 1
3735 2 94 ASP H 2 94 ASP QB . . 3.690 2.647 2.079 3.248 . 0 0 "[ . 1 . 2 . 3]" 1
3736 2 95 SER QB 2 96 VAL H . . 4.430 3.195 2.028 4.033 . 0 0 "[ . 1 . 2 . 3]" 1
3737 2 96 VAL QG 2 97 ILE H . . 4.150 2.977 1.925 3.723 . 0 0 "[ . 1 . 2 . 3]" 1
3738 2 97 ILE H 2 97 ILE QG . . 3.460 2.454 1.912 3.053 . 0 0 "[ . 1 . 2 . 3]" 1
3739 2 97 ILE QG 2 97 ILE MG . . 3.060 2.172 1.940 2.354 . 0 0 "[ . 1 . 2 . 3]" 1
3740 2 97 ILE QG 2 98 THR H . . 4.540 4.063 1.900 4.473 . 0 0 "[ . 1 . 2 . 3]" 1
3741 2 100 VAL QG 2 101 LEU H . . 4.040 3.038 1.909 3.708 . 0 0 "[ . 1 . 2 . 3]" 1
3742 2 101 LEU H 2 101 LEU QB . . 3.180 2.598 2.046 2.982 . 0 0 "[ . 1 . 2 . 3]" 1
3743 2 101 LEU H 2 101 LEU QD . . 4.480 3.325 1.997 4.153 . 0 0 "[ . 1 . 2 . 3]" 1
3744 2 101 LEU HA 2 101 LEU QD . . 3.200 2.445 1.932 2.962 . 0 0 "[ . 1 . 2 . 3]" 1
3745 2 103 LYS QB 2 106 ALA MB . . 4.120 3.910 2.779 4.160 0.040 7 0 "[ . 1 . 2 . 3]" 1
3746 2 104 SER H 2 104 SER QB . . 3.600 2.274 2.050 2.908 . 0 0 "[ . 1 . 2 . 3]" 1
3747 2 105 LEU HA 2 105 LEU QD . . 3.560 2.485 1.971 3.403 . 0 0 "[ . 1 . 2 . 3]" 1
3748 2 106 ALA MB 2 107 GLU QG . . 4.080 3.793 3.481 4.001 . 0 0 "[ . 1 . 2 . 3]" 1
3749 2 107 GLU H 2 107 GLU QG . . 3.560 2.756 1.923 3.299 . 0 0 "[ . 1 . 2 . 3]" 1
3750 2 108 GLN H 2 108 GLN QB . . 3.630 2.149 2.052 2.291 . 0 0 "[ . 1 . 2 . 3]" 1
3751 2 108 GLN H 2 108 GLN QG . . 4.490 3.675 2.688 4.059 . 0 0 "[ . 1 . 2 . 3]" 1
3752 2 108 GLN QB 2 109 ARG H . . 4.070 2.608 2.159 2.798 . 0 0 "[ . 1 . 2 . 3]" 1
3753 2 109 ARG H 2 109 ARG QB . . 3.510 2.259 2.062 2.642 . 0 0 "[ . 1 . 2 . 3]" 1
3754 2 110 GLN H 2 110 GLN QG . . 5.070 3.558 2.483 4.047 . 0 0 "[ . 1 . 2 . 3]" 1
3755 2 111 HIS QB 2 112 GLU H . . 4.230 2.500 2.128 2.800 . 0 0 "[ . 1 . 2 . 3]" 1
3756 2 112 GLU QB 2 113 GLU H . . 3.830 2.382 2.141 2.775 . 0 0 "[ . 1 . 2 . 3]" 1
3757 2 113 GLU H 2 113 GLU QB . . 3.560 2.167 2.056 2.558 . 0 0 "[ . 1 . 2 . 3]" 1
3758 2 113 GLU QB 2 114 ALA H . . 4.060 2.728 2.195 2.811 . 0 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 119
_Distance_constraint_stats_list.Viol_count 2284
_Distance_constraint_stats_list.Viol_total 9260.707
_Distance_constraint_stats_list.Viol_max 0.428
_Distance_constraint_stats_list.Viol_rms 0.0889
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0865
_Distance_constraint_stats_list.Viol_average_violations_only 0.1352
_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 9 MET 4.098 0.144 29 0 "[ . 1 . 2 . 3]"
1 10 ASP 2.357 0.125 13 0 "[ . 1 . 2 . 3]"
1 13 LEU 5.018 0.230 21 0 "[ . 1 . 2 . 3]"
1 14 GLN 3.619 0.159 29 0 "[ . 1 . 2 . 3]"
1 16 ILE 9.247 0.236 14 0 "[ . 1 . 2 . 3]"
1 17 HIS 2.299 0.129 30 0 "[ . 1 . 2 . 3]"
1 21 LYS 7.360 0.188 23 0 "[ . 1 . 2 . 3]"
1 24 LEU 8.651 0.298 6 0 "[ . 1 . 2 . 3]"
1 25 LYS 13.577 0.244 25 0 "[ . 1 . 2 . 3]"
1 26 ILE 11.880 0.200 30 0 "[ . 1 . 2 . 3]"
1 27 ASP 12.603 0.198 30 0 "[ . 1 . 2 . 3]"
1 29 LEU 4.482 0.212 18 0 "[ . 1 . 2 . 3]"
1 31 VAL 1.738 0.147 16 0 "[ . 1 . 2 . 3]"
1 34 CYS 4.179 0.187 19 0 "[ . 1 . 2 . 3]"
1 35 ILE 3.940 0.177 19 0 "[ . 1 . 2 . 3]"
1 37 ALA 0.041 0.027 21 0 "[ . 1 . 2 . 3]"
1 38 LEU 13.541 0.175 15 0 "[ . 1 . 2 . 3]"
1 40 GLU 0.255 0.075 19 0 "[ . 1 . 2 . 3]"
1 41 LEU 7.047 0.236 14 0 "[ . 1 . 2 . 3]"
1 42 ALA 0.096 0.096 17 0 "[ . 1 . 2 . 3]"
1 46 VAL 1.054 0.115 13 0 "[ . 1 . 2 . 3]"
1 48 MET 2.712 0.107 8 0 "[ . 1 . 2 . 3]"
1 50 GLN 4.770 0.144 29 0 "[ . 1 . 2 . 3]"
1 51 ALA 0.475 0.108 16 0 "[ . 1 . 2 . 3]"
1 54 HIS 5.649 0.230 21 0 "[ . 1 . 2 . 3]"
1 57 MET 5.918 0.159 29 0 "[ . 1 . 2 . 3]"
1 58 ILE 4.380 0.133 25 0 "[ . 1 . 2 . 3]"
1 60 THR 3.088 0.140 14 0 "[ . 1 . 2 . 3]"
1 61 LEU 3.075 0.124 19 0 "[ . 1 . 2 . 3]"
1 62 LYS 13.559 0.282 7 0 "[ . 1 . 2 . 3]"
1 63 LYS 7.114 0.169 25 0 "[ . 1 . 2 . 3]"
1 64 ILE 28.220 0.428 6 0 "[ . 1 . 2 . 3]"
1 65 ARG 11.260 0.299 6 0 "[ . 1 . 2 . 3]"
1 66 ARG 6.780 0.306 17 0 "[ . 1 . 2 . 3]"
1 67 PHE 18.925 0.339 25 0 "[ . 1 . 2 . 3]"
1 68 LYS 8.282 0.333 4 0 "[ . 1 . 2 . 3]"
1 69 VAL 14.244 0.334 3 0 "[ . 1 . 2 . 3]"
1 70 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 72 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 73 ILE 18.888 0.274 18 0 "[ . 1 . 2 . 3]"
1 74 MET 12.990 0.301 14 0 "[ . 1 . 2 . 3]"
1 75 GLU 0.039 0.021 17 0 "[ . 1 . 2 . 3]"
1 76 LYS 2.432 0.133 20 0 "[ . 1 . 2 . 3]"
1 77 SER 18.394 0.407 6 0 "[ . 1 . 2 . 3]"
1 78 THR 8.074 0.184 23 0 "[ . 1 . 2 . 3]"
1 80 LEU 6.034 0.158 14 0 "[ . 1 . 2 . 3]"
1 81 TYR 8.423 0.254 30 0 "[ . 1 . 2 . 3]"
1 84 PHE 2.134 0.112 18 0 "[ . 1 . 2 . 3]"
1 87 MET 1.177 0.124 10 0 "[ . 1 . 2 . 3]"
1 88 PHE 1.209 0.103 8 0 "[ . 1 . 2 . 3]"
2 21 LYS 7.079 0.163 30 0 "[ . 1 . 2 . 3]"
2 24 LEU 9.117 0.249 18 0 "[ . 1 . 2 . 3]"
2 25 LYS 13.774 0.244 25 0 "[ . 1 . 2 . 3]"
2 26 ILE 11.579 0.206 16 0 "[ . 1 . 2 . 3]"
2 27 ASP 12.687 0.200 22 0 "[ . 1 . 2 . 3]"
2 29 LEU 4.834 0.265 14 0 "[ . 1 . 2 . 3]"
2 31 VAL 1.852 0.148 19 0 "[ . 1 . 2 . 3]"
2 34 CYS 4.155 0.159 21 0 "[ . 1 . 2 . 3]"
2 35 ILE 4.288 0.166 20 0 "[ . 1 . 2 . 3]"
2 38 LEU 8.300 0.158 14 0 "[ . 1 . 2 . 3]"
2 41 LEU 1.659 0.145 18 0 "[ . 1 . 2 . 3]"
2 42 ALA 0.144 0.066 17 0 "[ . 1 . 2 . 3]"
2 48 MET 2.386 0.124 10 0 "[ . 1 . 2 . 3]"
2 51 ALA 0.683 0.088 16 0 "[ . 1 . 2 . 3]"
2 58 ILE 4.274 0.136 16 0 "[ . 1 . 2 . 3]"
2 60 THR 3.333 0.121 16 0 "[ . 1 . 2 . 3]"
2 61 LEU 3.099 0.120 18 0 "[ . 1 . 2 . 3]"
2 62 LYS 13.405 0.254 30 0 "[ . 1 . 2 . 3]"
2 63 LYS 7.246 0.166 29 0 "[ . 1 . 2 . 3]"
2 64 ILE 27.714 0.407 6 0 "[ . 1 . 2 . 3]"
2 65 ARG 11.255 0.274 18 0 "[ . 1 . 2 . 3]"
2 66 ARG 6.696 0.301 14 0 "[ . 1 . 2 . 3]"
2 67 PHE 19.628 0.334 3 0 "[ . 1 . 2 . 3]"
2 68 LYS 7.822 0.327 19 0 "[ . 1 . 2 . 3]"
2 69 VAL 13.670 0.339 25 0 "[ . 1 . 2 . 3]"
2 70 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 72 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 73 ILE 19.167 0.299 6 0 "[ . 1 . 2 . 3]"
2 74 MET 13.037 0.306 17 0 "[ . 1 . 2 . 3]"
2 75 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 76 LYS 2.856 0.147 6 0 "[ . 1 . 2 . 3]"
2 77 SER 18.679 0.428 6 0 "[ . 1 . 2 . 3]"
2 78 THR 8.208 0.192 23 0 "[ . 1 . 2 . 3]"
2 80 LEU 6.233 0.175 15 0 "[ . 1 . 2 . 3]"
2 81 TYR 8.695 0.282 7 0 "[ . 1 . 2 . 3]"
2 84 PHE 1.783 0.120 29 0 "[ . 1 . 2 . 3]"
2 87 MET 1.196 0.107 28 0 "[ . 1 . 2 . 3]"
2 88 PHE 1.516 0.107 8 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 9 MET CA 1 46 VAL CA . . 7.790 7.821 7.775 7.905 0.115 13 0 "[ . 1 . 2 . 3]" 2
2 1 9 MET CA 1 50 GLN CA . . 7.730 7.831 7.730 7.874 0.144 29 0 "[ . 1 . 2 . 3]" 2
3 1 10 ASP CA 1 50 GLN CA . . 7.150 7.204 7.099 7.275 0.125 13 0 "[ . 1 . 2 . 3]" 2
4 1 13 LEU CA 1 41 LEU CA . . 7.460 7.380 7.338 7.428 . 0 0 "[ . 1 . 2 . 3]" 2
5 1 14 GLN CA 1 54 HIS CA . . 7.720 7.669 7.637 7.704 . 0 0 "[ . 1 . 2 . 3]" 2
6 1 16 ILE CA 1 40 GLU CA . . 7.650 7.641 7.553 7.725 0.075 19 0 "[ . 1 . 2 . 3]" 2
7 1 21 LYS CA 2 25 LYS CA . . 7.850 7.979 7.864 8.038 0.188 23 0 "[ . 1 . 2 . 3]" 2
8 1 25 LYS CA 2 21 LYS CA . . 7.850 7.972 7.861 8.013 0.163 30 0 "[ . 1 . 2 . 3]" 2
9 1 25 LYS CA 2 24 LEU CA . . 7.700 7.795 7.723 7.839 0.139 20 0 "[ . 1 . 2 . 3]" 2
10 1 24 LEU CA 2 25 LYS CA . . 7.700 7.791 7.698 7.830 0.130 17 0 "[ . 1 . 2 . 3]" 2
11 1 25 LYS CA 2 25 LYS CA . . 6.270 6.462 6.410 6.514 0.244 25 0 "[ . 1 . 2 . 3]" 2
12 1 26 ILE CA 2 21 LYS CA . . 6.550 6.448 6.403 6.495 . 0 0 "[ . 1 . 2 . 3]" 2
13 1 21 LYS CA 2 26 ILE CA . . 6.550 6.447 6.378 6.511 . 0 0 "[ . 1 . 2 . 3]" 2
14 1 26 ILE CA 2 24 LEU CA . . 6.510 6.459 6.428 6.484 . 0 0 "[ . 1 . 2 . 3]" 2
15 1 24 LEU CA 2 26 ILE CA . . 6.510 6.452 6.410 6.484 . 0 0 "[ . 1 . 2 . 3]" 2
16 1 26 ILE CA 2 25 LYS CA . . 7.140 7.186 7.134 7.259 0.119 16 0 "[ . 1 . 2 . 3]" 2
17 1 25 LYS CA 2 26 ILE CA . . 7.140 7.183 7.131 7.274 0.134 19 0 "[ . 1 . 2 . 3]" 2
18 1 27 ASP CA 2 21 LYS CA . . 7.610 7.724 7.598 7.771 0.161 30 0 "[ . 1 . 2 . 3]" 2
19 1 21 LYS CA 2 27 ASP CA . . 7.610 7.726 7.606 7.777 0.167 16 0 "[ . 1 . 2 . 3]" 2
20 1 27 ASP CA 2 60 THR CA . . 5.710 5.759 5.697 5.818 0.108 29 0 "[ . 1 . 2 . 3]" 2
21 1 60 THR CA 2 27 ASP CA . . 5.710 5.760 5.701 5.850 0.140 14 0 "[ . 1 . 2 . 3]" 2
22 1 29 LEU CA 2 67 PHE CA . . 7.040 7.189 7.137 7.252 0.212 18 0 "[ . 1 . 2 . 3]" 2
23 1 67 PHE CA 2 29 LEU CA . . 7.040 7.201 7.154 7.305 0.265 14 0 "[ . 1 . 2 . 3]" 2
24 1 31 VAL CA 2 73 ILE CA . . 7.540 7.596 7.519 7.687 0.147 16 0 "[ . 1 . 2 . 3]" 2
25 1 73 ILE CA 2 31 VAL CA . . 7.540 7.599 7.518 7.688 0.148 19 0 "[ . 1 . 2 . 3]" 2
26 1 34 CYS CA 2 73 ILE CA . . 6.940 7.079 7.048 7.127 0.187 19 0 "[ . 1 . 2 . 3]" 2
27 1 73 ILE CA 2 34 CYS CA . . 6.940 7.078 7.044 7.099 0.159 21 0 "[ . 1 . 2 . 3]" 2
28 1 35 ILE CA 2 76 LYS CA . . 7.800 7.799 7.746 7.915 0.115 6 0 "[ . 1 . 2 . 3]" 2
29 1 76 LYS CA 2 35 ILE CA . . 7.800 7.806 7.766 7.899 0.099 7 0 "[ . 1 . 2 . 3]" 2
30 1 38 LEU CA 2 73 ILE CA . . 7.860 7.945 7.852 8.007 0.147 14 0 "[ . 1 . 2 . 3]" 2
31 1 73 ILE CA 2 38 LEU CA . . 7.860 7.925 7.842 7.996 0.136 15 0 "[ . 1 . 2 . 3]" 2
32 1 38 LEU CA 2 76 LYS CA . . 6.800 6.883 6.791 6.947 0.147 6 0 "[ . 1 . 2 . 3]" 2
33 1 76 LYS CA 2 38 LEU CA . . 6.800 6.863 6.782 6.933 0.133 20 0 "[ . 1 . 2 . 3]" 2
34 1 38 LEU CA 2 77 SER CA . . 7.100 7.103 7.043 7.181 0.081 12 0 "[ . 1 . 2 . 3]" 2
35 1 77 SER CA 2 38 LEU CA . . 7.100 7.089 7.048 7.171 0.071 9 0 "[ . 1 . 2 . 3]" 2
36 1 38 LEU CA 2 80 LEU CA . . 7.810 7.956 7.927 7.985 0.175 15 0 "[ . 1 . 2 . 3]" 2
37 1 80 LEU CA 2 38 LEU CA . . 7.810 7.951 7.908 7.968 0.158 14 0 "[ . 1 . 2 . 3]" 2
38 1 41 LEU CA 2 80 LEU CA . . 7.780 7.835 7.739 7.941 0.161 21 0 "[ . 1 . 2 . 3]" 2
39 1 80 LEU CA 2 41 LEU CA . . 7.780 7.828 7.715 7.925 0.145 18 0 "[ . 1 . 2 . 3]" 2
40 1 42 ALA CA 2 80 LEU CA . . 6.690 6.680 6.646 6.786 0.096 17 0 "[ . 1 . 2 . 3]" 2
41 1 80 LEU CA 2 42 ALA CA . . 6.690 6.684 6.624 6.756 0.066 17 0 "[ . 1 . 2 . 3]" 2
42 1 48 MET CA 2 87 MET CA . . 6.380 6.418 6.362 6.487 0.107 28 0 "[ . 1 . 2 . 3]" 2
43 1 87 MET CA 2 48 MET CA . . 6.380 6.418 6.371 6.504 0.124 10 0 "[ . 1 . 2 . 3]" 2
44 1 51 ALA CA 2 84 PHE CA . . 7.360 7.370 7.341 7.468 0.108 16 0 "[ . 1 . 2 . 3]" 2
45 1 84 PHE CA 2 51 ALA CA . . 7.360 7.380 7.342 7.448 0.088 16 0 "[ . 1 . 2 . 3]" 2
46 1 58 ILE CA 2 81 TYR CA . . 6.140 6.242 6.137 6.273 0.133 25 0 "[ . 1 . 2 . 3]" 2
47 1 81 TYR CA 2 58 ILE CA . . 6.140 6.234 6.139 6.276 0.136 16 0 "[ . 1 . 2 . 3]" 2
48 1 58 ILE CA 2 84 PHE CA . . 7.230 7.271 7.206 7.350 0.120 29 0 "[ . 1 . 2 . 3]" 2
49 1 84 PHE CA 2 58 ILE CA . . 7.230 7.275 7.214 7.342 0.112 18 0 "[ . 1 . 2 . 3]" 2
50 1 60 THR CA 2 26 ILE CA . . 7.380 7.432 7.379 7.488 0.108 18 0 "[ . 1 . 2 . 3]" 2
51 1 26 ILE CA 2 60 THR CA . . 7.380 7.441 7.376 7.501 0.121 16 0 "[ . 1 . 2 . 3]" 2
52 1 61 LEU CA 2 77 SER CA . . 5.200 5.302 5.279 5.324 0.124 19 0 "[ . 1 . 2 . 3]" 2
53 1 77 SER CA 2 61 LEU CA . . 5.200 5.303 5.282 5.320 0.120 18 0 "[ . 1 . 2 . 3]" 2
54 1 61 LEU CA 2 78 THR CA . . 7.160 7.093 7.065 7.110 . 0 0 "[ . 1 . 2 . 3]" 2
55 1 78 THR CA 2 61 LEU CA . . 7.160 7.095 7.076 7.111 . 0 0 "[ . 1 . 2 . 3]" 2
56 1 61 LEU CA 2 80 LEU CA . . 7.330 7.280 7.253 7.305 . 0 0 "[ . 1 . 2 . 3]" 2
57 1 80 LEU CA 2 61 LEU CA . . 7.330 7.284 7.241 7.333 0.003 20 0 "[ . 1 . 2 . 3]" 2
58 1 61 LEU CA 2 81 TYR CA . . 5.880 5.816 5.770 5.870 . 0 0 "[ . 1 . 2 . 3]" 2
59 1 81 TYR CA 2 61 LEU CA . . 5.880 5.828 5.788 5.876 . 0 0 "[ . 1 . 2 . 3]" 2
60 1 62 LYS CA 2 78 THR CA . . 6.960 7.094 7.062 7.130 0.170 23 0 "[ . 1 . 2 . 3]" 2
61 1 78 THR CA 2 62 LYS CA . . 6.960 7.092 7.073 7.110 0.150 13 0 "[ . 1 . 2 . 3]" 2
62 1 62 LYS CA 2 81 TYR CA . . 6.040 6.227 6.187 6.322 0.282 7 0 "[ . 1 . 2 . 3]" 2
63 1 81 TYR CA 2 62 LYS CA . . 6.040 6.227 6.176 6.294 0.254 30 0 "[ . 1 . 2 . 3]" 2
64 1 63 LYS CA 2 26 ILE CA . . 7.160 7.298 7.242 7.329 0.169 25 0 "[ . 1 . 2 . 3]" 2
65 1 26 ILE CA 2 63 LYS CA . . 7.160 7.300 7.243 7.326 0.166 29 0 "[ . 1 . 2 . 3]" 2
66 1 63 LYS CA 2 27 ASP CA . . 6.630 6.729 6.648 6.765 0.135 25 0 "[ . 1 . 2 . 3]" 2
67 1 27 ASP CA 2 63 LYS CA . . 6.630 6.732 6.667 6.769 0.139 29 0 "[ . 1 . 2 . 3]" 2
68 1 64 ILE CA 2 26 ILE CA . . 6.710 6.862 6.796 6.916 0.206 16 0 "[ . 1 . 2 . 3]" 2
69 1 26 ILE CA 2 64 ILE CA . . 6.710 6.859 6.817 6.910 0.200 30 0 "[ . 1 . 2 . 3]" 2
70 1 64 ILE CA 2 27 ASP CA . . 7.900 8.057 8.011 8.100 0.200 22 0 "[ . 1 . 2 . 3]" 2
71 1 27 ASP CA 2 64 ILE CA . . 7.900 8.054 8.034 8.098 0.198 30 0 "[ . 1 . 2 . 3]" 2
72 1 65 ARG CA 2 73 ILE CA . . 7.870 8.106 8.075 8.169 0.299 6 0 "[ . 1 . 2 . 3]" 2
73 1 73 ILE CA 2 65 ARG CA . . 7.870 8.107 8.071 8.144 0.274 18 0 "[ . 1 . 2 . 3]" 2
74 1 66 ARG CA 2 74 MET CA . . 7.390 7.616 7.578 7.696 0.306 17 0 "[ . 1 . 2 . 3]" 2
75 1 74 MET CA 2 66 ARG CA . . 7.390 7.613 7.573 7.691 0.301 14 0 "[ . 1 . 2 . 3]" 2
76 1 67 PHE CA 2 26 ILE CA . . 7.060 6.889 6.831 6.936 . 0 0 "[ . 1 . 2 . 3]" 2
77 1 26 ILE CA 2 67 PHE CA . . 7.060 6.884 6.826 6.979 . 0 0 "[ . 1 . 2 . 3]" 2
78 1 67 PHE CA 2 68 LYS CA . . 7.810 8.069 7.935 8.137 0.327 19 0 "[ . 1 . 2 . 3]" 2
79 1 68 LYS CA 2 67 PHE CA . . 7.810 8.085 8.003 8.143 0.333 4 0 "[ . 1 . 2 . 3]" 2
80 1 68 LYS CA 2 68 LYS CA . . 5.950 5.625 5.542 5.755 . 0 0 "[ . 1 . 2 . 3]" 2
81 1 68 LYS CA 2 69 VAL CA . . 6.890 6.825 6.750 6.923 0.033 25 0 "[ . 1 . 2 . 3]" 2
82 1 69 VAL CA 2 68 LYS CA . . 6.890 6.826 6.779 6.938 0.048 25 0 "[ . 1 . 2 . 3]" 2
83 1 69 VAL CA 2 24 LEU CA . . 7.650 7.859 7.815 7.899 0.249 18 0 "[ . 1 . 2 . 3]" 2
84 1 24 LEU CA 2 69 VAL CA . . 7.650 7.845 7.586 7.948 0.298 6 0 "[ . 1 . 2 . 3]" 2
85 1 69 VAL CA 2 64 ILE CA . . 7.640 7.661 7.558 7.811 0.171 15 0 "[ . 1 . 2 . 3]" 2
86 1 64 ILE CA 2 69 VAL CA . . 7.640 7.676 7.593 7.940 0.300 14 0 "[ . 1 . 2 . 3]" 2
87 1 69 VAL CA 2 67 PHE CA . . 7.270 7.499 7.241 7.604 0.334 3 0 "[ . 1 . 2 . 3]" 2
88 1 67 PHE CA 2 69 VAL CA . . 7.270 7.480 7.265 7.609 0.339 25 0 "[ . 1 . 2 . 3]" 2
89 1 70 SER CA 2 31 VAL CA . . 7.420 7.342 7.267 7.383 . 0 0 "[ . 1 . 2 . 3]" 2
90 1 31 VAL CA 2 70 SER CA . . 7.420 7.348 7.282 7.393 . 0 0 "[ . 1 . 2 . 3]" 2
91 1 72 VAL CA 2 35 ILE CA . . 7.640 7.606 7.547 7.631 . 0 0 "[ . 1 . 2 . 3]" 2
92 1 35 ILE CA 2 72 VAL CA . . 7.640 7.601 7.538 7.631 . 0 0 "[ . 1 . 2 . 3]" 2
93 1 73 ILE CA 2 35 ILE CA . . 6.000 6.127 6.099 6.166 0.166 20 0 "[ . 1 . 2 . 3]" 2
94 1 35 ILE CA 2 73 ILE CA . . 6.000 6.119 6.001 6.177 0.177 19 0 "[ . 1 . 2 . 3]" 2
95 1 73 ILE CA 2 64 ILE CA . . 7.870 7.818 7.742 7.875 0.005 18 0 "[ . 1 . 2 . 3]" 2
96 1 64 ILE CA 2 73 ILE CA . . 7.870 7.819 7.773 7.903 0.033 6 0 "[ . 1 . 2 . 3]" 2
97 1 74 MET CA 2 64 ILE CA . . 6.050 6.260 6.192 6.325 0.275 23 0 "[ . 1 . 2 . 3]" 2
98 1 64 ILE CA 2 74 MET CA . . 6.050 6.259 6.204 6.313 0.263 20 0 "[ . 1 . 2 . 3]" 2
99 1 74 MET CA 2 65 ARG CA . . 5.100 4.923 4.886 4.969 . 0 0 "[ . 1 . 2 . 3]" 2
100 1 65 ARG CA 2 74 MET CA . . 5.100 4.921 4.885 4.979 . 0 0 "[ . 1 . 2 . 3]" 2
101 1 75 GLU CA 2 65 ARG CA . . 7.750 7.688 7.610 7.771 0.021 17 0 "[ . 1 . 2 . 3]" 2
102 1 65 ARG CA 2 75 GLU CA . . 7.750 7.689 7.644 7.735 . 0 0 "[ . 1 . 2 . 3]" 2
103 1 77 SER CA 2 62 LYS CA . . 6.970 7.098 7.077 7.125 0.155 16 0 "[ . 1 . 2 . 3]" 2
104 1 62 LYS CA 2 77 SER CA . . 6.970 7.100 7.081 7.124 0.154 29 0 "[ . 1 . 2 . 3]" 2
105 1 77 SER CA 2 64 ILE CA . . 6.570 6.947 6.907 6.977 0.407 6 0 "[ . 1 . 2 . 3]" 2
106 1 64 ILE CA 2 77 SER CA . . 6.570 6.945 6.914 6.998 0.428 6 0 "[ . 1 . 2 . 3]" 2
107 1 77 SER CA 2 65 ARG CA . . 6.870 6.570 6.541 6.594 . 0 0 "[ . 1 . 2 . 3]" 2
108 1 65 ARG CA 2 77 SER CA . . 6.870 6.568 6.534 6.593 . 0 0 "[ . 1 . 2 . 3]" 2
109 1 78 THR CA 2 65 ARG CA . . 6.710 6.847 6.814 6.894 0.184 23 0 "[ . 1 . 2 . 3]" 2
110 1 65 ARG CA 2 78 THR CA . . 6.710 6.849 6.814 6.902 0.192 23 0 "[ . 1 . 2 . 3]" 2
111 1 88 PHE CA 2 48 MET CA . . 7.290 7.328 7.263 7.393 0.103 8 0 "[ . 1 . 2 . 3]" 2
112 1 48 MET CA 2 88 PHE CA . . 7.290 7.339 7.270 7.397 0.107 8 0 "[ . 1 . 2 . 3]" 2
113 1 10 ASP CA 1 54 HIS CA . . 7.810 7.828 7.790 7.909 0.099 27 0 "[ . 1 . 2 . 3]" 2
114 1 13 LEU CA 1 54 HIS CA . . 7.490 7.657 7.593 7.720 0.230 21 0 "[ . 1 . 2 . 3]" 2
115 1 14 GLN CA 1 57 MET CA . . 7.810 7.931 7.869 7.969 0.159 29 0 "[ . 1 . 2 . 3]" 2
116 1 16 ILE CA 1 37 ALA CA . . 5.450 5.422 5.395 5.477 0.027 21 0 "[ . 1 . 2 . 3]" 2
117 1 16 ILE CA 1 38 LEU CA . . 7.410 7.532 7.402 7.583 0.173 14 0 "[ . 1 . 2 . 3]" 2
118 1 16 ILE CA 1 41 LEU CA . . 6.960 7.136 7.032 7.196 0.236 14 0 "[ . 1 . 2 . 3]" 2
119 1 17 HIS CA 1 57 MET CA . . 5.680 5.755 5.656 5.809 0.129 30 0 "[ . 1 . 2 . 3]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 42
_Distance_constraint_stats_list.Viol_count 28
_Distance_constraint_stats_list.Viol_total 3.123
_Distance_constraint_stats_list.Viol_max 0.011
_Distance_constraint_stats_list.Viol_rms 0.0007
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0037
_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 51 ALA 0.044 0.009 22 0 "[ . 1 . 2 . 3]"
1 52 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 53 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 54 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 55 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 56 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 57 MET 0.004 0.003 27 0 "[ . 1 . 2 . 3]"
1 58 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 59 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 60 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 61 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 62 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 63 LYS 0.012 0.011 17 0 "[ . 1 . 2 . 3]"
1 68 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 69 VAL 0.005 0.005 29 0 "[ . 1 . 2 . 3]"
1 82 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 83 LYS 0.008 0.005 3 0 "[ . 1 . 2 . 3]"
1 84 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 85 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 86 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 88 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 104 SER 0.020 0.006 18 0 "[ . 1 . 2 . 3]"
1 117 THR 0.001 0.001 12 0 "[ . 1 . 2 . 3]"
2 51 ALA 0.006 0.005 21 0 "[ . 1 . 2 . 3]"
2 52 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 53 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 54 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 55 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 56 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 57 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 58 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 59 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 60 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 61 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 62 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 63 LYS 0.006 0.006 18 0 "[ . 1 . 2 . 3]"
2 68 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 69 VAL 0.001 0.001 12 0 "[ . 1 . 2 . 3]"
2 82 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 83 LYS 0.017 0.009 7 0 "[ . 1 . 2 . 3]"
2 84 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 85 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 86 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 88 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
2 104 SER 0.078 0.011 17 0 "[ . 1 . 2 . 3]"
2 117 THR 0.005 0.005 29 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 51 ALA H 2 104 SER H . . 15.000 14.866 13.462 15.009 0.009 22 0 "[ . 1 . 2 . 3]" 3
2 1 52 GLN H 2 104 SER H . . 15.000 12.630 11.095 13.169 . 0 0 "[ . 1 . 2 . 3]" 3
3 1 53 LYS H 2 104 SER H . . 15.000 13.876 12.513 14.649 . 0 0 "[ . 1 . 2 . 3]" 3
4 1 54 HIS H 2 104 SER H . . 15.000 14.144 12.797 14.923 . 0 0 "[ . 1 . 2 . 3]" 3
5 1 55 THR H 2 104 SER H . . 15.000 12.319 10.840 13.275 . 0 0 "[ . 1 . 2 . 3]" 3
6 1 56 GLU H 2 104 SER H . . 15.000 12.806 11.049 13.808 . 0 0 "[ . 1 . 2 . 3]" 3
7 1 57 MET H 2 104 SER H . . 15.000 14.296 12.615 15.003 0.003 27 0 "[ . 1 . 2 . 3]" 3
8 1 58 ILE H 2 104 SER H . . 15.000 12.638 11.432 13.272 . 0 0 "[ . 1 . 2 . 3]" 3
9 1 59 THR H 2 104 SER H . . 15.000 11.441 10.112 12.110 . 0 0 "[ . 1 . 2 . 3]" 3
10 1 60 THR H 2 104 SER H . . 15.000 13.716 12.394 14.417 . 0 0 "[ . 1 . 2 . 3]" 3
11 1 61 LEU H 2 104 SER H . . 15.000 14.370 13.283 14.932 . 0 0 "[ . 1 . 2 . 3]" 3
12 1 62 LYS H 2 104 SER H . . 15.000 13.102 12.023 13.689 . 0 0 "[ . 1 . 2 . 3]" 3
13 1 63 LYS H 2 104 SER H . . 15.000 14.422 13.250 15.011 0.011 17 0 "[ . 1 . 2 . 3]" 3
14 2 82 ASN H 2 104 SER H . . 15.000 14.077 12.561 14.646 . 0 0 "[ . 1 . 2 . 3]" 3
15 2 83 LYS H 2 104 SER H . . 15.000 14.499 13.002 15.009 0.009 7 0 "[ . 1 . 2 . 3]" 3
16 2 84 PHE H 2 104 SER H . . 15.000 12.835 11.529 13.330 . 0 0 "[ . 1 . 2 . 3]" 3
17 2 85 LYS H 2 104 SER H . . 15.000 10.584 9.130 11.149 . 0 0 "[ . 1 . 2 . 3]" 3
18 2 86 ASN H 2 104 SER H . . 15.000 11.110 9.400 12.177 . 0 0 "[ . 1 . 2 . 3]" 3
19 2 88 PHE H 2 104 SER H . . 15.000 8.901 7.333 10.045 . 0 0 "[ . 1 . 2 . 3]" 3
20 1 68 LYS H 2 117 THR H . . 15.000 9.971 6.934 12.632 . 0 0 "[ . 1 . 2 . 3]" 3
21 1 69 VAL H 2 117 THR H . . 15.000 12.670 10.098 15.005 0.005 29 0 "[ . 1 . 2 . 3]" 3
22 1 104 SER H 2 51 ALA H . . 15.000 14.849 13.482 15.005 0.005 21 0 "[ . 1 . 2 . 3]" 3
23 1 104 SER H 2 52 GLN H . . 15.000 12.615 11.122 13.121 . 0 0 "[ . 1 . 2 . 3]" 3
24 1 104 SER H 2 53 LYS H . . 15.000 13.873 12.502 14.585 . 0 0 "[ . 1 . 2 . 3]" 3
25 1 104 SER H 2 54 HIS H . . 15.000 14.148 12.792 14.864 . 0 0 "[ . 1 . 2 . 3]" 3
26 1 104 SER H 2 55 THR H . . 15.000 12.317 10.823 13.211 . 0 0 "[ . 1 . 2 . 3]" 3
27 1 104 SER H 2 56 GLU H . . 15.000 12.793 10.991 13.743 . 0 0 "[ . 1 . 2 . 3]" 3
28 1 104 SER H 2 57 MET H . . 15.000 14.253 12.554 14.988 . 0 0 "[ . 1 . 2 . 3]" 3
29 1 104 SER H 2 58 ILE H . . 15.000 12.605 11.398 13.212 . 0 0 "[ . 1 . 2 . 3]" 3
30 1 104 SER H 2 59 THR H . . 15.000 11.411 10.090 12.125 . 0 0 "[ . 1 . 2 . 3]" 3
31 1 104 SER H 2 60 THR H . . 15.000 13.696 12.357 14.373 . 0 0 "[ . 1 . 2 . 3]" 3
32 1 104 SER H 2 61 LEU H . . 15.000 14.368 13.260 14.972 . 0 0 "[ . 1 . 2 . 3]" 3
33 1 104 SER H 2 62 LYS H . . 15.000 13.103 12.025 13.686 . 0 0 "[ . 1 . 2 . 3]" 3
34 1 104 SER H 2 63 LYS H . . 15.000 14.423 13.248 15.006 0.006 18 0 "[ . 1 . 2 . 3]" 3
35 1 82 ASN H 1 104 SER H . . 15.000 14.078 12.672 14.672 . 0 0 "[ . 1 . 2 . 3]" 3
36 1 83 LYS H 1 104 SER H . . 15.000 14.507 13.103 15.005 0.005 3 0 "[ . 1 . 2 . 3]" 3
37 1 84 PHE H 1 104 SER H . . 15.000 12.848 11.598 13.337 . 0 0 "[ . 1 . 2 . 3]" 3
38 1 85 LYS H 1 104 SER H . . 15.000 10.606 9.211 11.145 . 0 0 "[ . 1 . 2 . 3]" 3
39 1 86 ASN H 1 104 SER H . . 15.000 11.119 9.492 12.243 . 0 0 "[ . 1 . 2 . 3]" 3
40 1 88 PHE H 1 104 SER H . . 15.000 8.903 7.286 10.098 . 0 0 "[ . 1 . 2 . 3]" 3
41 1 117 THR H 2 68 LYS H . . 15.000 10.002 6.936 12.812 . 0 0 "[ . 1 . 2 . 3]" 3
42 1 117 THR H 2 69 VAL H . . 15.000 12.673 10.128 15.001 0.001 12 0 "[ . 1 . 2 . 3]" 3
stop_
save_
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