NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
457356 |
2kqn   |
16607 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kqn
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 4076
_Distance_constraint_stats_list.Viol_count 4601
_Distance_constraint_stats_list.Viol_total 4577.334
_Distance_constraint_stats_list.Viol_max 0.462
_Distance_constraint_stats_list.Viol_rms 0.0153
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0028
_Distance_constraint_stats_list.Viol_average_violations_only 0.0497
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 ASP 1.026 0.113 9 0 "[ . 1 . 2]"
1 4 ILE 5.155 0.178 1 0 "[ . 1 . 2]"
1 5 GLN 2.411 0.188 13 0 "[ . 1 . 2]"
1 6 MET 2.933 0.164 17 0 "[ . 1 . 2]"
1 7 THR 0.753 0.087 10 0 "[ . 1 . 2]"
1 8 GLN 1.657 0.128 12 0 "[ . 1 . 2]"
1 9 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 PRO 0.188 0.066 11 0 "[ . 1 . 2]"
1 11 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 SER 0.748 0.109 16 0 "[ . 1 . 2]"
1 13 LEU 2.320 0.101 5 0 "[ . 1 . 2]"
1 14 SER 3.513 0.127 5 0 "[ . 1 . 2]"
1 15 ALA 1.416 0.139 14 0 "[ . 1 . 2]"
1 16 SER 1.237 0.225 10 0 "[ . 1 . 2]"
1 17 VAL 3.229 0.199 2 0 "[ . 1 . 2]"
1 18 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 ASP 0.802 0.085 1 0 "[ . 1 . 2]"
1 20 ARG 0.388 0.080 8 0 "[ . 1 . 2]"
1 21 VAL 0.304 0.080 8 0 "[ . 1 . 2]"
1 22 THR 0.766 0.101 2 0 "[ . 1 . 2]"
1 23 ILE 1.428 0.120 13 0 "[ . 1 . 2]"
1 24 THR 0.452 0.072 7 0 "[ . 1 . 2]"
1 25 CYS 1.755 0.136 1 0 "[ . 1 . 2]"
1 26 GLN 0.593 0.057 12 0 "[ . 1 . 2]"
1 27 ALA 0.552 0.087 10 0 "[ . 1 . 2]"
1 28 SER 2.411 0.188 13 0 "[ . 1 . 2]"
1 29 GLN 0.582 0.105 20 0 "[ . 1 . 2]"
1 30 ASP 2.279 0.178 1 0 "[ . 1 . 2]"
1 31 ILE 2.300 0.097 11 0 "[ . 1 . 2]"
1 32 ASN 0.151 0.080 10 0 "[ . 1 . 2]"
1 33 ASN 3.247 0.251 8 0 "[ . 1 . 2]"
1 34 TYR 0.939 0.097 11 0 "[ . 1 . 2]"
1 35 LEU 4.845 0.168 2 0 "[ . 1 . 2]"
1 36 ILE 4.170 0.160 8 0 "[ . 1 . 2]"
1 37 TRP 7.181 0.168 2 0 "[ . 1 . 2]"
1 38 TYR 10.963 0.240 11 0 "[ . 1 . 2]"
1 39 GLN 1.640 0.118 13 0 "[ . 1 . 2]"
1 40 GLN 1.474 0.131 12 0 "[ . 1 . 2]"
1 41 LYS 1.132 0.255 17 0 "[ . 1 . 2]"
1 42 PRO 0.197 0.075 3 0 "[ . 1 . 2]"
1 44 GLN 0.377 0.053 18 0 "[ . 1 . 2]"
1 45 ALA 1.081 0.137 18 0 "[ . 1 . 2]"
1 46 PRO 1.708 0.131 12 0 "[ . 1 . 2]"
1 47 LYS 4.029 0.123 4 0 "[ . 1 . 2]"
1 48 LEU 2.318 0.121 14 0 "[ . 1 . 2]"
1 49 LEU 1.524 0.159 11 0 "[ . 1 . 2]"
1 50 ILE 3.510 0.135 11 0 "[ . 1 . 2]"
1 51 TYR 6.172 0.114 11 0 "[ . 1 . 2]"
1 52 ASP 3.177 0.251 8 0 "[ . 1 . 2]"
1 53 ALA 1.061 0.143 4 0 "[ . 1 . 2]"
1 54 SER 0.719 0.079 20 0 "[ . 1 . 2]"
1 55 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 LEU 2.057 0.106 11 0 "[ . 1 . 2]"
1 57 GLU 0.920 0.101 14 0 "[ . 1 . 2]"
1 58 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 VAL 3.292 0.110 3 0 "[ . 1 . 2]"
1 61 PRO 0.051 0.019 6 0 "[ . 1 . 2]"
1 62 SER 0.105 0.028 12 0 "[ . 1 . 2]"
1 63 ARG 0.741 0.086 12 0 "[ . 1 . 2]"
1 64 PHE 3.513 0.172 2 0 "[ . 1 . 2]"
1 65 SER 2.686 0.135 11 0 "[ . 1 . 2]"
1 66 GLY 0.729 0.105 9 0 "[ . 1 . 2]"
1 67 SER 0.657 0.088 9 0 "[ . 1 . 2]"
1 68 GLY 0.636 0.079 20 0 "[ . 1 . 2]"
1 69 SER 1.318 0.125 2 0 "[ . 1 . 2]"
1 70 GLY 2.387 0.364 7 0 "[ . 1 . 2]"
1 71 THR 0.326 0.116 17 0 "[ . 1 . 2]"
1 72 GLU 2.134 0.364 7 0 "[ . 1 . 2]"
1 73 PHE 3.318 0.117 9 0 "[ . 1 . 2]"
1 74 THR 1.752 0.071 15 0 "[ . 1 . 2]"
1 75 PHE 3.350 0.076 11 0 "[ . 1 . 2]"
1 76 THR 3.499 0.092 1 0 "[ . 1 . 2]"
1 77 ILE 5.239 0.265 10 0 "[ . 1 . 2]"
1 78 SER 0.350 0.086 12 0 "[ . 1 . 2]"
1 79 SER 0.087 0.020 11 0 "[ . 1 . 2]"
1 80 LEU 4.801 0.265 10 0 "[ . 1 . 2]"
1 81 GLN 1.068 0.099 15 0 "[ . 1 . 2]"
1 82 PRO 0.965 0.107 8 0 "[ . 1 . 2]"
1 83 GLU 0.141 0.073 7 0 "[ . 1 . 2]"
1 84 ASP 0.926 0.114 19 0 "[ . 1 . 2]"
1 85 LEU 0.699 0.074 19 0 "[ . 1 . 2]"
1 86 ALA 1.302 0.132 16 0 "[ . 1 . 2]"
1 87 THR 1.484 0.168 5 0 "[ . 1 . 2]"
1 88 TYR 6.441 0.159 11 0 "[ . 1 . 2]"
1 89 TYR 1.985 0.249 4 0 "[ . 1 . 2]"
1 90 CYS 0.822 0.084 16 0 "[ . 1 . 2]"
1 91 GLN 11.886 0.263 7 0 "[ . 1 . 2]"
1 92 GLN 3.119 0.209 4 0 "[ . 1 . 2]"
1 93 TYR 3.389 0.263 7 0 "[ . 1 . 2]"
1 94 ASP 0.289 0.071 3 0 "[ . 1 . 2]"
1 95 ASN 0.212 0.039 17 0 "[ . 1 . 2]"
1 96 LEU 1.069 0.105 12 0 "[ . 1 . 2]"
1 97 PRO 0.958 0.124 11 0 "[ . 1 . 2]"
1 98 TYR 3.088 0.117 14 0 "[ . 1 . 2]"
1 99 THR 1.685 0.094 17 0 "[ . 1 . 2]"
1 100 PHE 5.212 0.191 18 0 "[ . 1 . 2]"
1 101 GLY 0.542 0.156 5 0 "[ . 1 . 2]"
1 102 GLN 1.770 0.249 4 0 "[ . 1 . 2]"
1 103 GLY 0.165 0.051 10 0 "[ . 1 . 2]"
1 104 THR 1.783 0.106 18 0 "[ . 1 . 2]"
1 105 LYS 3.288 0.168 5 0 "[ . 1 . 2]"
1 106 LEU 4.625 0.127 5 0 "[ . 1 . 2]"
1 107 GLU 2.436 0.139 11 0 "[ . 1 . 2]"
1 108 ILE 3.483 0.199 2 0 "[ . 1 . 2]"
1 109 LYS 2.507 0.144 5 0 "[ . 1 . 2]"
1 110 ARG 0.423 0.094 19 0 "[ . 1 . 2]"
2 3 ASP 0.863 0.138 9 0 "[ . 1 . 2]"
2 4 ILE 5.462 0.180 10 0 "[ . 1 . 2]"
2 5 GLN 2.602 0.170 16 0 "[ . 1 . 2]"
2 6 MET 3.114 0.171 17 0 "[ . 1 . 2]"
2 7 THR 0.645 0.056 17 0 "[ . 1 . 2]"
2 8 GLN 2.546 0.398 20 0 "[ . 1 . 2]"
2 9 SER 0.027 0.027 13 0 "[ . 1 . 2]"
2 10 PRO 0.068 0.027 12 0 "[ . 1 . 2]"
2 11 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 12 SER 0.872 0.134 14 0 "[ . 1 . 2]"
2 13 LEU 2.112 0.102 7 0 "[ . 1 . 2]"
2 14 SER 3.140 0.195 5 0 "[ . 1 . 2]"
2 15 ALA 1.092 0.138 2 0 "[ . 1 . 2]"
2 16 SER 1.132 0.128 9 0 "[ . 1 . 2]"
2 17 VAL 3.612 0.197 2 0 "[ . 1 . 2]"
2 18 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 19 ASP 0.699 0.102 1 0 "[ . 1 . 2]"
2 20 ARG 0.488 0.102 16 0 "[ . 1 . 2]"
2 21 VAL 0.391 0.102 16 0 "[ . 1 . 2]"
2 22 THR 0.870 0.083 2 0 "[ . 1 . 2]"
2 23 ILE 1.895 0.097 10 0 "[ . 1 . 2]"
2 24 THR 0.875 0.083 15 0 "[ . 1 . 2]"
2 25 CYS 1.795 0.138 6 0 "[ . 1 . 2]"
2 26 GLN 0.386 0.039 10 0 "[ . 1 . 2]"
2 27 ALA 0.653 0.056 17 0 "[ . 1 . 2]"
2 28 SER 2.517 0.170 16 0 "[ . 1 . 2]"
2 29 GLN 0.675 0.111 8 0 "[ . 1 . 2]"
2 30 ASP 2.539 0.180 10 0 "[ . 1 . 2]"
2 31 ILE 2.554 0.108 18 0 "[ . 1 . 2]"
2 32 ASN 0.212 0.091 10 0 "[ . 1 . 2]"
2 33 ASN 2.882 0.253 8 0 "[ . 1 . 2]"
2 34 TYR 0.937 0.081 18 0 "[ . 1 . 2]"
2 35 LEU 5.121 0.165 2 0 "[ . 1 . 2]"
2 36 ILE 4.129 0.194 9 0 "[ . 1 . 2]"
2 37 TRP 7.741 0.171 17 0 "[ . 1 . 2]"
2 38 TYR 9.950 0.248 9 0 "[ . 1 . 2]"
2 39 GLN 1.039 0.090 2 0 "[ . 1 . 2]"
2 40 GLN 1.733 0.205 2 0 "[ . 1 . 2]"
2 41 LYS 0.604 0.233 17 0 "[ . 1 . 2]"
2 42 PRO 0.076 0.034 3 0 "[ . 1 . 2]"
2 44 GLN 0.506 0.086 20 0 "[ . 1 . 2]"
2 45 ALA 1.344 0.156 5 0 "[ . 1 . 2]"
2 46 PRO 2.057 0.205 2 0 "[ . 1 . 2]"
2 47 LYS 3.776 0.123 9 0 "[ . 1 . 2]"
2 48 LEU 2.190 0.124 11 0 "[ . 1 . 2]"
2 49 LEU 1.707 0.150 3 0 "[ . 1 . 2]"
2 50 ILE 3.732 0.160 18 0 "[ . 1 . 2]"
2 51 TYR 6.643 0.131 4 0 "[ . 1 . 2]"
2 52 ASP 3.449 0.253 8 0 "[ . 1 . 2]"
2 53 ALA 1.346 0.194 9 0 "[ . 1 . 2]"
2 54 SER 0.490 0.072 12 0 "[ . 1 . 2]"
2 55 THR 0.010 0.010 2 0 "[ . 1 . 2]"
2 56 LEU 2.269 0.130 9 0 "[ . 1 . 2]"
2 57 GLU 0.905 0.077 9 0 "[ . 1 . 2]"
2 58 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 59 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 60 VAL 3.343 0.131 4 0 "[ . 1 . 2]"
2 61 PRO 0.120 0.029 11 0 "[ . 1 . 2]"
2 62 SER 0.118 0.057 15 0 "[ . 1 . 2]"
2 63 ARG 0.930 0.087 8 0 "[ . 1 . 2]"
2 64 PHE 3.515 0.163 17 0 "[ . 1 . 2]"
2 65 SER 2.543 0.160 18 0 "[ . 1 . 2]"
2 66 GLY 0.700 0.130 9 0 "[ . 1 . 2]"
2 67 SER 0.407 0.053 18 0 "[ . 1 . 2]"
2 68 GLY 0.480 0.072 12 0 "[ . 1 . 2]"
2 69 SER 1.220 0.140 8 0 "[ . 1 . 2]"
2 70 GLY 3.193 0.462 16 0 "[ . 1 . 2]"
2 71 THR 0.178 0.075 18 0 "[ . 1 . 2]"
2 72 GLU 3.215 0.462 16 0 "[ . 1 . 2]"
2 73 PHE 3.437 0.119 7 0 "[ . 1 . 2]"
2 74 THR 1.712 0.097 10 0 "[ . 1 . 2]"
2 75 PHE 3.537 0.073 15 0 "[ . 1 . 2]"
2 76 THR 3.236 0.090 18 0 "[ . 1 . 2]"
2 77 ILE 5.497 0.225 5 0 "[ . 1 . 2]"
2 78 SER 0.403 0.087 8 0 "[ . 1 . 2]"
2 79 SER 0.133 0.040 10 0 "[ . 1 . 2]"
2 80 LEU 4.694 0.206 16 0 "[ . 1 . 2]"
2 81 GLN 1.493 0.117 4 0 "[ . 1 . 2]"
2 82 PRO 1.270 0.128 8 0 "[ . 1 . 2]"
2 83 GLU 0.190 0.166 7 0 "[ . 1 . 2]"
2 84 ASP 1.648 0.225 5 0 "[ . 1 . 2]"
2 85 LEU 0.622 0.074 19 0 "[ . 1 . 2]"
2 86 ALA 0.907 0.117 13 0 "[ . 1 . 2]"
2 87 THR 1.413 0.134 15 0 "[ . 1 . 2]"
2 88 TYR 6.742 0.239 7 0 "[ . 1 . 2]"
2 89 TYR 2.196 0.167 15 0 "[ . 1 . 2]"
2 90 CYS 0.994 0.110 9 0 "[ . 1 . 2]"
2 91 GLN 10.562 0.248 9 0 "[ . 1 . 2]"
2 92 GLN 3.391 0.215 4 0 "[ . 1 . 2]"
2 93 TYR 2.531 0.136 5 0 "[ . 1 . 2]"
2 94 ASP 0.209 0.035 7 0 "[ . 1 . 2]"
2 95 ASN 0.305 0.046 1 0 "[ . 1 . 2]"
2 96 LEU 1.306 0.137 3 0 "[ . 1 . 2]"
2 97 PRO 1.155 0.099 15 0 "[ . 1 . 2]"
2 98 TYR 3.272 0.109 16 0 "[ . 1 . 2]"
2 99 THR 1.777 0.138 9 0 "[ . 1 . 2]"
2 100 PHE 5.223 0.213 9 0 "[ . 1 . 2]"
2 101 GLY 0.448 0.137 18 0 "[ . 1 . 2]"
2 102 GLN 1.915 0.167 15 0 "[ . 1 . 2]"
2 103 GLY 0.739 0.398 20 0 "[ . 1 . 2]"
2 104 THR 1.988 0.129 17 0 "[ . 1 . 2]"
2 105 LYS 3.125 0.199 4 0 "[ . 1 . 2]"
2 106 LEU 4.578 0.239 7 0 "[ . 1 . 2]"
2 107 GLU 1.812 0.132 19 0 "[ . 1 . 2]"
2 108 ILE 3.594 0.197 2 0 "[ . 1 . 2]"
2 109 LYS 2.466 0.168 4 0 "[ . 1 . 2]"
2 110 ARG 0.462 0.128 9 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 ASP HA 1 4 ILE HB . . 5.500 4.770 4.449 5.613 0.113 9 0 "[ . 1 . 2]" 1
2 1 3 ASP QB 1 97 PRO QB . . 4.500 4.155 3.765 4.418 . 0 0 "[ . 1 . 2]" 1
3 1 3 ASP QB 1 97 PRO HD2 . . 5.340 2.286 1.744 3.036 . 0 0 "[ . 1 . 2]" 1
4 1 3 ASP QB 1 97 PRO HD3 . . 5.340 3.333 2.582 3.989 . 0 0 "[ . 1 . 2]" 1
5 1 3 ASP QB 1 97 PRO QG . . 5.210 2.465 2.034 3.796 . 0 0 "[ . 1 . 2]" 1
6 1 3 ASP HB2 1 4 ILE H . . 4.650 2.641 2.177 3.325 . 0 0 "[ . 1 . 2]" 1
7 1 3 ASP HB2 1 97 PRO QB . . 5.200 4.571 4.195 4.951 . 0 0 "[ . 1 . 2]" 1
8 1 3 ASP HB2 1 99 THR MG . . 4.670 3.479 2.753 4.764 0.094 15 0 "[ . 1 . 2]" 1
9 1 3 ASP HB3 1 4 ILE H . . 4.650 3.629 1.674 4.090 . 0 0 "[ . 1 . 2]" 1
10 1 3 ASP HB3 1 97 PRO QB . . 5.200 4.796 4.250 5.245 0.045 4 0 "[ . 1 . 2]" 1
11 1 3 ASP HB3 1 99 THR MG . . 4.670 4.505 3.807 4.759 0.089 8 0 "[ . 1 . 2]" 1
12 1 4 ILE H 1 4 ILE HB . . 4.140 2.463 2.223 2.542 . 0 0 "[ . 1 . 2]" 1
13 1 4 ILE H 1 4 ILE MD . . 4.470 3.620 3.334 3.760 . 0 0 "[ . 1 . 2]" 1
14 1 4 ILE H 1 4 ILE HG12 . . 4.480 3.926 3.729 4.107 . 0 0 "[ . 1 . 2]" 1
15 1 4 ILE H 1 4 ILE HG13 . . 5.100 2.628 2.450 2.827 . 0 0 "[ . 1 . 2]" 1
16 1 4 ILE H 1 4 ILE MG . . 4.780 3.754 3.665 3.788 . 0 0 "[ . 1 . 2]" 1
17 1 4 ILE H 1 99 THR MG . . 4.760 3.794 3.434 4.217 . 0 0 "[ . 1 . 2]" 1
18 1 4 ILE HA 1 4 ILE MD . . 4.090 3.872 3.820 3.931 . 0 0 "[ . 1 . 2]" 1
19 1 4 ILE HA 1 28 SER H . . 5.500 3.826 3.355 4.647 . 0 0 "[ . 1 . 2]" 1
20 1 4 ILE HA 1 29 GLN HB3 . . 5.170 3.439 2.527 5.194 0.024 20 0 "[ . 1 . 2]" 1
21 1 4 ILE HA 1 99 THR MG . . 5.500 5.169 4.994 5.455 . 0 0 "[ . 1 . 2]" 1
22 1 4 ILE HB 1 4 ILE MD . . 3.660 2.360 2.272 2.419 . 0 0 "[ . 1 . 2]" 1
23 1 4 ILE HB 1 5 GLN H . . 5.500 4.361 4.277 4.417 . 0 0 "[ . 1 . 2]" 1
24 1 4 ILE HB 1 29 GLN H . . 5.500 5.041 4.620 5.504 0.004 3 0 "[ . 1 . 2]" 1
25 1 4 ILE HB 1 92 GLN HE21 . . 5.500 2.399 1.949 2.966 . 0 0 "[ . 1 . 2]" 1
26 1 4 ILE HB 1 92 GLN HE22 . . 5.360 2.748 2.389 3.315 . 0 0 "[ . 1 . 2]" 1
27 1 4 ILE HB 1 92 GLN HG2 . . 5.500 3.192 2.872 3.761 . 0 0 "[ . 1 . 2]" 1
28 1 4 ILE HB 1 92 GLN HG3 . . 5.380 4.098 3.803 4.613 . 0 0 "[ . 1 . 2]" 1
29 1 4 ILE HB 1 95 ASN HB3 . . 5.500 4.420 3.772 4.740 . 0 0 "[ . 1 . 2]" 1
30 1 4 ILE HB 1 99 THR H . . 5.340 4.554 4.176 4.903 . 0 0 "[ . 1 . 2]" 1
31 1 4 ILE MD 1 4 ILE MG . . 2.400 2.033 1.921 2.149 . 0 0 "[ . 1 . 2]" 1
32 1 4 ILE MD 1 29 GLN HB2 . . 4.810 4.512 2.976 4.820 0.010 3 0 "[ . 1 . 2]" 1
33 1 4 ILE MD 1 29 GLN HB3 . . 4.430 3.311 3.066 3.867 . 0 0 "[ . 1 . 2]" 1
34 1 4 ILE MD 1 29 GLN HE21 . . 4.780 2.991 2.380 4.592 . 0 0 "[ . 1 . 2]" 1
35 1 4 ILE MD 1 29 GLN HE22 . . 5.140 3.824 3.147 5.198 0.058 8 0 "[ . 1 . 2]" 1
36 1 4 ILE MD 1 29 GLN HG2 . . 4.320 3.935 3.287 4.415 0.095 8 0 "[ . 1 . 2]" 1
37 1 4 ILE MD 1 31 ILE HB . . 5.480 3.938 3.722 4.117 . 0 0 "[ . 1 . 2]" 1
38 1 4 ILE MD 1 92 GLN HE21 . . 5.500 2.083 1.688 3.450 . 0 0 "[ . 1 . 2]" 1
39 1 4 ILE MD 1 92 GLN HE22 . . 5.360 2.633 2.326 2.807 . 0 0 "[ . 1 . 2]" 1
40 1 4 ILE MD 1 93 TYR H . . 5.500 5.487 5.260 5.603 0.103 7 0 "[ . 1 . 2]" 1
41 1 4 ILE MD 1 94 ASP H . . 5.470 3.862 3.494 4.034 . 0 0 "[ . 1 . 2]" 1
42 1 4 ILE MD 1 94 ASP QB . . 5.280 2.807 2.323 3.157 . 0 0 "[ . 1 . 2]" 1
43 1 4 ILE MD 1 95 ASN H . . 4.790 2.606 2.230 2.890 . 0 0 "[ . 1 . 2]" 1
44 1 4 ILE MD 1 95 ASN HB2 . . 4.300 2.921 2.667 3.043 . 0 0 "[ . 1 . 2]" 1
45 1 4 ILE MD 1 95 ASN HB3 . . 3.890 1.918 1.787 2.036 . 0 0 "[ . 1 . 2]" 1
46 1 4 ILE MD 1 95 ASN HD21 . . 5.270 3.267 2.683 4.637 . 0 0 "[ . 1 . 2]" 1
47 1 4 ILE MD 1 95 ASN HD22 . . 5.500 4.517 4.124 4.988 . 0 0 "[ . 1 . 2]" 1
48 1 4 ILE MD 1 96 LEU H . . 4.870 4.894 4.688 4.975 0.105 12 0 "[ . 1 . 2]" 1
49 1 4 ILE MD 1 98 TYR QD . . 4.380 4.195 3.708 4.460 0.080 8 0 "[ . 1 . 2]" 1
50 1 4 ILE MD 1 98 TYR QE . . 5.150 4.517 4.067 4.779 . 0 0 "[ . 1 . 2]" 1
51 1 4 ILE HG12 1 4 ILE MG . . 3.410 2.219 2.152 2.290 . 0 0 "[ . 1 . 2]" 1
52 1 4 ILE HG12 1 5 GLN H . . 5.490 4.682 4.429 4.851 . 0 0 "[ . 1 . 2]" 1
53 1 4 ILE HG12 1 29 GLN HB3 . . 4.670 2.036 1.794 3.363 . 0 0 "[ . 1 . 2]" 1
54 1 4 ILE HG12 1 29 GLN HE21 . . 5.500 2.978 2.277 3.945 . 0 0 "[ . 1 . 2]" 1
55 1 4 ILE HG12 1 30 ASP HA . . 5.500 5.613 5.565 5.678 0.178 1 0 "[ . 1 . 2]" 1
56 1 4 ILE HG12 1 31 ILE HA . . 5.500 5.461 5.302 5.554 0.054 19 0 "[ . 1 . 2]" 1
57 1 4 ILE HG12 1 95 ASN HB2 . . 5.500 5.367 4.974 5.539 0.039 17 0 "[ . 1 . 2]" 1
58 1 4 ILE HG12 1 95 ASN HB3 . . 5.500 4.106 3.709 4.271 . 0 0 "[ . 1 . 2]" 1
59 1 4 ILE HG13 1 5 GLN H . . 5.190 4.957 4.860 5.107 . 0 0 "[ . 1 . 2]" 1
60 1 4 ILE HG13 1 29 GLN HB3 . . 5.150 3.285 2.797 4.703 . 0 0 "[ . 1 . 2]" 1
61 1 4 ILE MG 1 5 GLN H . . 4.310 3.093 2.785 3.202 . 0 0 "[ . 1 . 2]" 1
62 1 4 ILE MG 1 27 ALA HA . . 5.080 3.274 2.984 3.667 . 0 0 "[ . 1 . 2]" 1
63 1 4 ILE MG 1 27 ALA MB . . 3.740 2.188 2.021 2.530 . 0 0 "[ . 1 . 2]" 1
64 1 4 ILE MG 1 28 SER H . . 4.460 2.797 2.103 3.384 . 0 0 "[ . 1 . 2]" 1
65 1 4 ILE MG 1 29 GLN H . . 4.290 2.180 1.812 2.607 . 0 0 "[ . 1 . 2]" 1
66 1 4 ILE MG 1 29 GLN HB2 . . 4.800 4.033 2.846 4.441 . 0 0 "[ . 1 . 2]" 1
67 1 4 ILE MG 1 29 GLN HB3 . . 4.290 3.149 2.306 4.325 0.035 8 0 "[ . 1 . 2]" 1
68 1 4 ILE MG 1 30 ASP H . . 5.500 5.123 4.787 5.511 0.011 1 0 "[ . 1 . 2]" 1
69 1 4 ILE MG 1 31 ILE HB . . 5.480 4.674 4.266 5.029 . 0 0 "[ . 1 . 2]" 1
70 1 4 ILE MG 1 31 ILE MD . . 4.330 3.454 3.140 3.807 . 0 0 "[ . 1 . 2]" 1
71 1 4 ILE MG 1 31 ILE QG . . 5.500 4.265 4.059 4.481 . 0 0 "[ . 1 . 2]" 1
72 1 4 ILE MG 1 71 THR HA . . 5.500 5.240 5.038 5.487 . 0 0 "[ . 1 . 2]" 1
73 1 4 ILE MG 1 92 GLN HB2 . . 5.500 3.779 3.498 4.157 . 0 0 "[ . 1 . 2]" 1
74 1 4 ILE MG 1 92 GLN HB3 . . 5.470 3.908 3.703 4.343 . 0 0 "[ . 1 . 2]" 1
75 1 4 ILE MG 1 92 GLN HG2 . . 4.940 2.016 1.817 2.433 . 0 0 "[ . 1 . 2]" 1
76 1 4 ILE MG 1 92 GLN HG3 . . 5.230 3.118 2.885 3.579 . 0 0 "[ . 1 . 2]" 1
77 1 4 ILE MG 1 99 THR H . . 5.500 4.808 4.551 5.112 . 0 0 "[ . 1 . 2]" 1
78 1 4 ILE MG 1 99 THR MG . . 4.540 4.557 4.382 4.634 0.094 17 0 "[ . 1 . 2]" 1
79 1 5 GLN H 1 5 GLN HG2 . . 4.900 4.234 2.655 4.641 . 0 0 "[ . 1 . 2]" 1
80 1 5 GLN H 1 5 GLN QG . . 4.220 3.805 2.613 4.061 . 0 0 "[ . 1 . 2]" 1
81 1 5 GLN H 1 5 GLN HG3 . . 4.900 4.380 3.817 4.625 . 0 0 "[ . 1 . 2]" 1
82 1 5 GLN H 1 28 SER H . . 4.720 2.923 2.505 3.347 . 0 0 "[ . 1 . 2]" 1
83 1 5 GLN H 1 28 SER HA . . 5.000 4.415 3.997 5.010 0.010 3 0 "[ . 1 . 2]" 1
84 1 5 GLN H 1 28 SER QB . . 4.730 1.860 1.611 2.460 . 0 0 "[ . 1 . 2]" 1
85 1 5 GLN H 1 29 GLN H . . 5.500 3.898 3.465 4.180 . 0 0 "[ . 1 . 2]" 1
86 1 5 GLN HA 1 5 GLN HG2 . . 4.240 3.052 2.478 3.791 . 0 0 "[ . 1 . 2]" 1
87 1 5 GLN HA 1 5 GLN HG3 . . 4.240 3.076 2.413 3.751 . 0 0 "[ . 1 . 2]" 1
88 1 5 GLN HA 1 6 MET H . . 3.570 2.194 2.133 2.251 . 0 0 "[ . 1 . 2]" 1
89 1 5 GLN HA 1 28 SER H . . 5.500 4.599 4.413 4.795 . 0 0 "[ . 1 . 2]" 1
90 1 5 GLN QB 1 6 MET H . . 4.130 3.606 3.027 3.826 . 0 0 "[ . 1 . 2]" 1
91 1 5 GLN QB 1 28 SER QB . . 4.180 2.045 1.769 3.061 . 0 0 "[ . 1 . 2]" 1
92 1 5 GLN HB2 1 6 MET H . . 4.950 4.426 4.125 4.604 . 0 0 "[ . 1 . 2]" 1
93 1 5 GLN HB2 1 28 SER H . . 5.330 4.165 3.414 4.584 . 0 0 "[ . 1 . 2]" 1
94 1 5 GLN HB2 1 28 SER HA . . 5.000 4.923 3.826 5.156 0.156 16 0 "[ . 1 . 2]" 1
95 1 5 GLN HB3 1 6 MET H . . 4.950 3.834 3.113 4.193 . 0 0 "[ . 1 . 2]" 1
96 1 5 GLN HB3 1 28 SER H . . 5.330 3.494 2.298 4.557 . 0 0 "[ . 1 . 2]" 1
97 1 5 GLN HB3 1 28 SER HA . . 5.000 4.379 3.791 5.188 0.188 13 0 "[ . 1 . 2]" 1
98 1 5 GLN QG 1 6 MET H . . 4.760 3.432 2.719 4.429 . 0 0 "[ . 1 . 2]" 1
99 1 5 GLN QG 1 28 SER QB . . 5.140 3.840 3.197 4.967 . 0 0 "[ . 1 . 2]" 1
100 1 5 GLN QG 1 99 THR MG . . 4.990 4.230 3.165 4.941 . 0 0 "[ . 1 . 2]" 1
101 1 6 MET H 1 6 MET HG2 . . 3.910 2.754 2.489 3.083 . 0 0 "[ . 1 . 2]" 1
102 1 6 MET H 1 6 MET HG3 . . 4.360 4.026 3.584 4.232 . 0 0 "[ . 1 . 2]" 1
103 1 6 MET H 1 99 THR MG . . 5.200 3.797 3.400 4.240 . 0 0 "[ . 1 . 2]" 1
104 1 6 MET HA 1 6 MET ME . . 3.900 2.665 2.009 2.958 . 0 0 "[ . 1 . 2]" 1
105 1 6 MET HA 1 6 MET HG3 . . 4.230 3.742 3.697 3.792 . 0 0 "[ . 1 . 2]" 1
106 1 6 MET HA 1 7 THR HB . . 5.500 4.465 4.373 4.625 . 0 0 "[ . 1 . 2]" 1
107 1 6 MET QB 1 6 MET ME . . 3.710 2.158 2.050 2.534 . 0 0 "[ . 1 . 2]" 1
108 1 6 MET QB 1 27 ALA MB . . 5.290 4.679 4.428 5.144 . 0 0 "[ . 1 . 2]" 1
109 1 6 MET QB 1 99 THR H . . 5.500 4.999 4.559 5.504 0.004 20 0 "[ . 1 . 2]" 1
110 1 6 MET QB 1 99 THR HB . . 5.290 3.905 3.279 4.308 . 0 0 "[ . 1 . 2]" 1
111 1 6 MET QB 1 99 THR MG . . 5.040 4.765 4.421 4.997 . 0 0 "[ . 1 . 2]" 1
112 1 6 MET QB 1 100 PHE HA . . 5.500 3.719 3.327 4.258 . 0 0 "[ . 1 . 2]" 1
113 1 6 MET QB 1 101 GLY H . . 5.500 2.972 2.705 3.548 . 0 0 "[ . 1 . 2]" 1
114 1 6 MET ME 1 7 THR H . . 4.480 3.565 3.105 3.995 . 0 0 "[ . 1 . 2]" 1
115 1 6 MET ME 1 25 CYS HB2 . . 4.020 3.770 3.257 4.156 0.136 1 0 "[ . 1 . 2]" 1
116 1 6 MET ME 1 25 CYS HB3 . . 4.570 2.872 2.049 3.644 . 0 0 "[ . 1 . 2]" 1
117 1 6 MET ME 1 26 GLN H . . 4.450 3.596 3.217 3.875 . 0 0 "[ . 1 . 2]" 1
118 1 6 MET ME 1 31 ILE MD . . 3.690 3.048 2.588 3.502 . 0 0 "[ . 1 . 2]" 1
119 1 6 MET ME 1 35 LEU MD1 . . 4.190 3.052 1.832 3.721 . 0 0 "[ . 1 . 2]" 1
120 1 6 MET ME 1 35 LEU QD . . 3.330 1.886 1.800 1.984 . 0 0 "[ . 1 . 2]" 1
121 1 6 MET ME 1 35 LEU MD2 . . 4.190 2.241 1.804 3.055 . 0 0 "[ . 1 . 2]" 1
122 1 6 MET ME 1 37 TRP HZ2 . . 5.290 5.362 5.263 5.454 0.164 17 0 "[ . 1 . 2]" 1
123 1 6 MET ME 1 73 PHE H . . 5.500 5.072 4.758 5.506 0.006 14 0 "[ . 1 . 2]" 1
124 1 6 MET ME 1 73 PHE QD . . 4.690 2.839 2.554 3.132 . 0 0 "[ . 1 . 2]" 1
125 1 6 MET ME 1 90 CYS H . . 5.500 4.993 4.583 5.355 . 0 0 "[ . 1 . 2]" 1
126 1 6 MET ME 1 90 CYS HB2 . . 5.500 3.169 2.943 3.521 . 0 0 "[ . 1 . 2]" 1
127 1 6 MET ME 1 90 CYS HB3 . . 5.500 4.296 4.098 4.444 . 0 0 "[ . 1 . 2]" 1
128 1 6 MET ME 1 91 GLN H . . 4.750 4.708 4.468 4.849 0.099 17 0 "[ . 1 . 2]" 1
129 1 6 MET ME 1 92 GLN HA . . 5.130 4.765 4.448 4.977 . 0 0 "[ . 1 . 2]" 1
130 1 6 MET ME 1 101 GLY H . . 5.450 4.632 4.058 5.140 . 0 0 "[ . 1 . 2]" 1
131 1 6 MET HG2 1 7 THR H . . 5.390 5.104 4.782 5.227 . 0 0 "[ . 1 . 2]" 1
132 1 6 MET HG2 1 27 ALA MB . . 4.640 4.509 4.244 4.665 0.025 4 0 "[ . 1 . 2]" 1
133 1 6 MET HG2 1 101 GLY H . . 5.500 4.973 4.616 5.510 0.010 12 0 "[ . 1 . 2]" 1
134 1 6 MET HG3 1 91 GLN HA . . 5.500 3.118 2.503 4.066 . 0 0 "[ . 1 . 2]" 1
135 1 6 MET HG3 1 99 THR HB . . 5.500 4.945 3.650 5.518 0.018 16 0 "[ . 1 . 2]" 1
136 1 6 MET HG3 1 101 GLY H . . 5.390 3.901 3.549 4.377 . 0 0 "[ . 1 . 2]" 1
137 1 7 THR H 1 7 THR HB . . 4.020 2.425 2.358 2.538 . 0 0 "[ . 1 . 2]" 1
138 1 7 THR H 1 7 THR MG . . 4.780 3.750 3.722 3.812 . 0 0 "[ . 1 . 2]" 1
139 1 7 THR H 1 8 GLN H . . 5.230 4.368 4.222 4.499 . 0 0 "[ . 1 . 2]" 1
140 1 7 THR H 1 26 GLN H . . 4.260 3.015 2.627 3.239 . 0 0 "[ . 1 . 2]" 1
141 1 7 THR H 1 26 GLN HB2 . . 5.270 3.552 3.181 3.792 . 0 0 "[ . 1 . 2]" 1
142 1 7 THR H 1 26 GLN HB3 . . 5.080 4.719 4.400 4.931 . 0 0 "[ . 1 . 2]" 1
143 1 7 THR H 1 27 ALA HA . . 5.400 3.406 3.238 3.574 . 0 0 "[ . 1 . 2]" 1
144 1 7 THR H 1 27 ALA MB . . 5.500 4.733 4.432 4.899 . 0 0 "[ . 1 . 2]" 1
145 1 7 THR H 1 28 SER H . . 5.500 4.533 4.020 4.978 . 0 0 "[ . 1 . 2]" 1
146 1 7 THR HA 1 7 THR MG . . 3.600 2.405 2.359 2.461 . 0 0 "[ . 1 . 2]" 1
147 1 7 THR HB 1 8 GLN H . . 5.500 4.296 4.159 4.371 . 0 0 "[ . 1 . 2]" 1
148 1 7 THR HB 1 26 GLN H . . 5.200 3.146 2.609 3.462 . 0 0 "[ . 1 . 2]" 1
149 1 7 THR HB 1 26 GLN HA . . 5.500 4.792 4.436 4.931 . 0 0 "[ . 1 . 2]" 1
150 1 7 THR HB 1 26 GLN HB2 . . 4.360 2.180 1.998 2.384 . 0 0 "[ . 1 . 2]" 1
151 1 7 THR HB 1 26 GLN HB3 . . 4.210 3.744 3.552 3.973 . 0 0 "[ . 1 . 2]" 1
152 1 7 THR HB 1 26 GLN HG3 . . 5.060 4.063 3.859 4.434 . 0 0 "[ . 1 . 2]" 1
153 1 7 THR HB 1 27 ALA H . . 5.500 5.435 5.231 5.587 0.087 10 0 "[ . 1 . 2]" 1
154 1 7 THR MG 1 8 GLN H . . 4.310 2.974 2.689 3.116 . 0 0 "[ . 1 . 2]" 1
155 1 7 THR MG 1 9 SER QB . . 5.080 4.166 3.768 4.370 . 0 0 "[ . 1 . 2]" 1
156 1 7 THR MG 1 25 CYS HA . . 5.500 4.721 4.306 4.963 . 0 0 "[ . 1 . 2]" 1
157 1 7 THR MG 1 26 GLN H . . 5.070 3.981 3.699 4.125 . 0 0 "[ . 1 . 2]" 1
158 1 7 THR MG 1 26 GLN HB2 . . 4.360 3.332 3.117 3.533 . 0 0 "[ . 1 . 2]" 1
159 1 7 THR MG 1 26 GLN HE21 . . 5.500 3.664 2.664 5.438 . 0 0 "[ . 1 . 2]" 1
160 1 7 THR MG 1 26 GLN HE22 . . 5.500 4.080 3.246 4.956 . 0 0 "[ . 1 . 2]" 1
161 1 7 THR MG 1 26 GLN HG3 . . 4.140 4.163 4.053 4.197 0.057 12 0 "[ . 1 . 2]" 1
162 1 8 GLN H 1 8 GLN HG2 . . 4.780 4.514 4.401 4.572 . 0 0 "[ . 1 . 2]" 1
163 1 8 GLN H 1 8 GLN HG3 . . 5.500 4.521 3.573 4.706 . 0 0 "[ . 1 . 2]" 1
164 1 8 GLN H 1 9 SER H . . 5.450 4.419 4.338 4.473 . 0 0 "[ . 1 . 2]" 1
165 1 8 GLN H 1 102 GLN H . . 4.900 4.570 3.672 4.987 0.087 8 0 "[ . 1 . 2]" 1
166 1 8 GLN H 1 102 GLN HE21 . . 5.500 4.680 3.399 5.563 0.063 1 0 "[ . 1 . 2]" 1
167 1 8 GLN H 1 102 GLN HE22 . . 5.500 5.037 3.577 5.520 0.020 5 0 "[ . 1 . 2]" 1
168 1 8 GLN H 1 103 GLY H . . 5.500 3.446 2.937 4.187 . 0 0 "[ . 1 . 2]" 1
169 1 8 GLN HA 1 23 ILE MG . . 5.490 4.226 3.934 4.498 . 0 0 "[ . 1 . 2]" 1
170 1 8 GLN HA 1 26 GLN HG3 . . 5.500 4.501 4.133 5.099 . 0 0 "[ . 1 . 2]" 1
171 1 8 GLN HA 1 103 GLY H . . 5.500 5.047 4.560 5.541 0.041 20 0 "[ . 1 . 2]" 1
172 1 8 GLN HB2 1 9 SER H . . 5.280 4.191 4.132 4.346 . 0 0 "[ . 1 . 2]" 1
173 1 8 GLN HB2 1 89 TYR HA . . 5.500 4.327 4.078 4.988 . 0 0 "[ . 1 . 2]" 1
174 1 8 GLN HB2 1 90 CYS H . . 5.340 4.245 3.863 5.423 0.083 12 0 "[ . 1 . 2]" 1
175 1 8 GLN HB2 1 101 GLY QA . . 5.060 2.726 2.003 3.777 . 0 0 "[ . 1 . 2]" 1
176 1 8 GLN HB3 1 9 SER H . . 5.220 3.817 2.999 3.978 . 0 0 "[ . 1 . 2]" 1
177 1 8 GLN HB3 1 25 CYS HA . . 5.390 4.771 4.504 5.031 . 0 0 "[ . 1 . 2]" 1
178 1 8 GLN HB3 1 101 GLY QA . . 5.230 3.729 2.841 5.044 . 0 0 "[ . 1 . 2]" 1
179 1 8 GLN HB3 1 102 GLN H . . 4.690 4.534 3.591 4.817 0.127 18 0 "[ . 1 . 2]" 1
180 1 8 GLN HB3 1 103 GLY H . . 5.030 2.377 1.780 3.610 . 0 0 "[ . 1 . 2]" 1
181 1 8 GLN HE21 1 23 ILE MD . . 5.340 5.092 4.080 5.443 0.103 1 0 "[ . 1 . 2]" 1
182 1 8 GLN HE21 1 23 ILE MG . . 4.410 3.873 2.825 4.428 0.018 1 0 "[ . 1 . 2]" 1
183 1 8 GLN HE21 1 37 TRP HZ3 . . 5.500 5.016 4.468 5.470 . 0 0 "[ . 1 . 2]" 1
184 1 8 GLN HE21 1 89 TYR HA . . 5.240 3.232 2.323 3.665 . 0 0 "[ . 1 . 2]" 1
185 1 8 GLN HE21 1 90 CYS H . . 5.360 4.536 3.211 5.361 0.001 20 0 "[ . 1 . 2]" 1
186 1 8 GLN HE21 1 103 GLY H . . 5.500 2.605 2.155 3.602 . 0 0 "[ . 1 . 2]" 1
187 1 8 GLN HE21 1 103 GLY HA2 . . 5.500 4.529 4.091 5.503 0.003 1 0 "[ . 1 . 2]" 1
188 1 8 GLN HE21 1 103 GLY HA3 . . 5.500 3.700 3.288 4.604 . 0 0 "[ . 1 . 2]" 1
189 1 8 GLN HE21 1 104 THR H . . 4.940 2.280 1.725 3.399 . 0 0 "[ . 1 . 2]" 1
190 1 8 GLN HE21 1 104 THR HB . . 5.460 2.908 2.018 3.945 . 0 0 "[ . 1 . 2]" 1
191 1 8 GLN HE21 1 104 THR MG . . 5.500 4.352 3.418 5.334 . 0 0 "[ . 1 . 2]" 1
192 1 8 GLN HE22 1 23 ILE MD . . 5.500 4.424 3.884 4.626 . 0 0 "[ . 1 . 2]" 1
193 1 8 GLN HE22 1 23 ILE MG . . 4.730 3.747 3.043 4.208 . 0 0 "[ . 1 . 2]" 1
194 1 8 GLN HE22 1 88 TYR HA . . 5.500 4.669 4.463 4.913 . 0 0 "[ . 1 . 2]" 1
195 1 8 GLN HE22 1 88 TYR HB2 . . 5.500 4.079 3.748 4.459 . 0 0 "[ . 1 . 2]" 1
196 1 8 GLN HE22 1 89 TYR HA . . 4.560 1.987 1.697 2.135 . 0 0 "[ . 1 . 2]" 1
197 1 8 GLN HE22 1 90 CYS H . . 4.850 4.020 3.583 4.292 . 0 0 "[ . 1 . 2]" 1
198 1 8 GLN HE22 1 104 THR H . . 4.690 2.757 2.396 3.277 . 0 0 "[ . 1 . 2]" 1
199 1 8 GLN HE22 1 104 THR HB . . 5.430 2.658 2.384 3.118 . 0 0 "[ . 1 . 2]" 1
200 1 8 GLN HE22 1 104 THR MG . . 5.500 4.273 4.056 4.644 . 0 0 "[ . 1 . 2]" 1
201 1 8 GLN HG2 1 9 SER H . . 4.610 2.668 2.429 3.532 . 0 0 "[ . 1 . 2]" 1
202 1 8 GLN HG2 1 23 ILE MG . . 4.800 2.415 2.211 2.767 . 0 0 "[ . 1 . 2]" 1
203 1 8 GLN HG2 1 103 GLY H . . 4.980 4.607 4.080 5.027 0.047 1 0 "[ . 1 . 2]" 1
204 1 8 GLN HG2 1 104 THR H . . 5.500 4.342 3.557 5.455 . 0 0 "[ . 1 . 2]" 1
205 1 8 GLN HG3 1 9 SER H . . 4.870 3.309 2.985 4.487 . 0 0 "[ . 1 . 2]" 1
206 1 8 GLN HG3 1 23 ILE MG . . 4.950 2.798 2.498 4.179 . 0 0 "[ . 1 . 2]" 1
207 1 8 GLN HG3 1 24 THR H . . 5.500 4.283 3.718 5.568 0.068 18 0 "[ . 1 . 2]" 1
208 1 8 GLN HG3 1 25 CYS HA . . 4.760 3.026 2.653 3.364 . 0 0 "[ . 1 . 2]" 1
209 1 8 GLN HG3 1 37 TRP HH2 . . 4.460 3.572 3.092 4.588 0.128 12 0 "[ . 1 . 2]" 1
210 1 8 GLN HG3 1 90 CYS H . . 5.500 4.820 3.853 5.066 . 0 0 "[ . 1 . 2]" 1
211 1 8 GLN HG3 1 103 GLY H . . 5.460 4.974 4.048 5.511 0.051 10 0 "[ . 1 . 2]" 1
212 1 9 SER H 1 10 PRO HA . . 5.500 4.781 4.698 4.889 . 0 0 "[ . 1 . 2]" 1
213 1 9 SER H 1 23 ILE MG . . 4.900 3.446 3.071 3.673 . 0 0 "[ . 1 . 2]" 1
214 1 9 SER H 1 24 THR HB . . 5.440 3.684 3.139 4.737 . 0 0 "[ . 1 . 2]" 1
215 1 9 SER QB 1 10 PRO HA . . 4.510 2.212 2.019 2.445 . 0 0 "[ . 1 . 2]" 1
216 1 9 SER QB 1 10 PRO QB . . 5.340 3.631 3.511 3.849 . 0 0 "[ . 1 . 2]" 1
217 1 9 SER QB 1 24 THR H . . 4.750 3.927 3.491 4.197 . 0 0 "[ . 1 . 2]" 1
218 1 9 SER QB 1 24 THR HB . . 5.050 3.252 2.442 4.751 . 0 0 "[ . 1 . 2]" 1
219 1 10 PRO QB 1 12 SER H . . 4.600 2.655 2.352 2.817 . 0 0 "[ . 1 . 2]" 1
220 1 10 PRO QB 1 13 LEU MD1 . . 5.340 4.029 3.736 4.371 . 0 0 "[ . 1 . 2]" 1
221 1 10 PRO QB 1 13 LEU MD2 . . 5.160 3.916 3.397 4.195 . 0 0 "[ . 1 . 2]" 1
222 1 10 PRO HB2 1 12 SER H . . 5.470 2.677 2.375 2.843 . 0 0 "[ . 1 . 2]" 1
223 1 10 PRO HB3 1 12 SER H . . 5.470 4.398 3.797 4.595 . 0 0 "[ . 1 . 2]" 1
224 1 10 PRO HD2 1 13 LEU HB3 . . 5.000 4.199 3.372 4.703 . 0 0 "[ . 1 . 2]" 1
225 1 10 PRO HD2 1 13 LEU MD2 . . 4.400 2.593 2.070 3.010 . 0 0 "[ . 1 . 2]" 1
226 1 10 PRO HD2 1 23 ILE HA . . 4.540 3.029 2.517 3.591 . 0 0 "[ . 1 . 2]" 1
227 1 10 PRO HD2 1 23 ILE HG12 . . 5.500 3.234 2.779 3.600 . 0 0 "[ . 1 . 2]" 1
228 1 10 PRO HD2 1 23 ILE MG . . 4.410 3.252 2.829 3.652 . 0 0 "[ . 1 . 2]" 1
229 1 10 PRO HD2 1 24 THR H . . 5.500 4.060 3.545 4.579 . 0 0 "[ . 1 . 2]" 1
230 1 10 PRO HD3 1 13 LEU HB3 . . 4.970 4.714 4.167 5.036 0.066 11 0 "[ . 1 . 2]" 1
231 1 10 PRO HD3 1 23 ILE HA . . 4.830 3.243 2.584 3.626 . 0 0 "[ . 1 . 2]" 1
232 1 10 PRO HD3 1 23 ILE MG . . 4.990 4.195 3.417 4.787 . 0 0 "[ . 1 . 2]" 1
233 1 10 PRO HD3 1 24 THR H . . 5.500 3.976 3.340 4.438 . 0 0 "[ . 1 . 2]" 1
234 1 10 PRO HG2 1 12 SER H . . 5.500 3.452 3.037 4.555 . 0 0 "[ . 1 . 2]" 1
235 1 10 PRO HG2 1 13 LEU HB2 . . 5.370 4.184 3.642 4.638 . 0 0 "[ . 1 . 2]" 1
236 1 10 PRO HG2 1 13 LEU HB3 . . 5.280 2.537 2.220 2.970 . 0 0 "[ . 1 . 2]" 1
237 1 10 PRO HG2 1 13 LEU MD2 . . 4.320 2.260 2.016 3.066 . 0 0 "[ . 1 . 2]" 1
238 1 10 PRO HG2 1 23 ILE MG . . 5.500 5.055 4.487 5.486 . 0 0 "[ . 1 . 2]" 1
239 1 10 PRO HG2 1 104 THR MG . . 4.660 3.282 2.977 4.412 . 0 0 "[ . 1 . 2]" 1
240 1 10 PRO HG3 1 12 SER H . . 5.500 4.712 4.405 5.510 0.010 20 0 "[ . 1 . 2]" 1
241 1 11 SER QB 1 12 SER H . . 4.820 3.093 2.622 3.504 . 0 0 "[ . 1 . 2]" 1
242 1 12 SER H 1 13 LEU H . . 5.500 4.130 4.072 4.201 . 0 0 "[ . 1 . 2]" 1
243 1 12 SER H 1 104 THR HA . . 4.990 4.362 4.204 4.546 . 0 0 "[ . 1 . 2]" 1
244 1 12 SER H 1 104 THR MG . . 5.500 4.231 4.033 4.442 . 0 0 "[ . 1 . 2]" 1
245 1 12 SER H 1 105 LYS H . . 5.500 4.228 4.111 4.331 . 0 0 "[ . 1 . 2]" 1
246 1 12 SER HA 1 13 LEU H . . 3.520 2.207 2.129 2.275 . 0 0 "[ . 1 . 2]" 1
247 1 12 SER HA 1 13 LEU HB3 . . 5.490 4.456 4.403 4.516 . 0 0 "[ . 1 . 2]" 1
248 1 12 SER HA 1 104 THR HA . . 4.670 3.430 3.251 3.588 . 0 0 "[ . 1 . 2]" 1
249 1 12 SER HA 1 104 THR MG . . 3.550 3.116 2.865 3.275 . 0 0 "[ . 1 . 2]" 1
250 1 12 SER HA 1 105 LYS H . . 3.850 2.110 1.957 2.296 . 0 0 "[ . 1 . 2]" 1
251 1 12 SER HA 1 105 LYS HA . . 4.730 4.464 4.376 4.608 . 0 0 "[ . 1 . 2]" 1
252 1 12 SER HA 1 105 LYS HB2 . . 4.770 3.938 2.915 4.394 . 0 0 "[ . 1 . 2]" 1
253 1 12 SER HA 1 105 LYS HB3 . . 4.750 3.183 2.794 4.205 . 0 0 "[ . 1 . 2]" 1
254 1 12 SER QB 1 13 LEU H . . 3.720 2.910 2.739 3.047 . 0 0 "[ . 1 . 2]" 1
255 1 12 SER QB 1 104 THR HA . . 4.490 4.425 4.272 4.550 0.060 3 0 "[ . 1 . 2]" 1
256 1 12 SER QB 1 105 LYS H . . 4.540 3.023 2.822 3.166 . 0 0 "[ . 1 . 2]" 1
257 1 12 SER QB 1 105 LYS HB2 . . 4.730 3.069 2.198 3.429 . 0 0 "[ . 1 . 2]" 1
258 1 12 SER QB 1 105 LYS HB3 . . 4.140 2.353 1.934 3.744 . 0 0 "[ . 1 . 2]" 1
259 1 12 SER QB 1 105 LYS QD . . 5.180 4.310 3.153 5.043 . 0 0 "[ . 1 . 2]" 1
260 1 12 SER QB 1 105 LYS QE . . 4.890 4.580 2.919 4.999 0.109 16 0 "[ . 1 . 2]" 1
261 1 12 SER QB 1 105 LYS HG2 . . 5.110 4.134 3.527 4.995 . 0 0 "[ . 1 . 2]" 1
262 1 12 SER QB 1 107 GLU QG . . 5.240 3.746 3.190 4.549 . 0 0 "[ . 1 . 2]" 1
263 1 13 LEU H 1 13 LEU MD2 . . 4.620 1.968 1.830 2.096 . 0 0 "[ . 1 . 2]" 1
264 1 13 LEU H 1 13 LEU HG . . 5.210 3.672 3.547 3.762 . 0 0 "[ . 1 . 2]" 1
265 1 13 LEU H 1 105 LYS H . . 4.810 3.847 3.633 4.013 . 0 0 "[ . 1 . 2]" 1
266 1 13 LEU H 1 105 LYS HB3 . . 5.500 4.210 3.826 4.641 . 0 0 "[ . 1 . 2]" 1
267 1 13 LEU H 1 107 GLU QG . . 5.500 4.317 3.891 4.706 . 0 0 "[ . 1 . 2]" 1
268 1 13 LEU HA 1 13 LEU MD2 . . 4.220 3.550 3.496 3.579 . 0 0 "[ . 1 . 2]" 1
269 1 13 LEU HB2 1 13 LEU HG . . 2.880 2.431 2.391 2.457 . 0 0 "[ . 1 . 2]" 1
270 1 13 LEU HB2 1 14 SER H . . 4.970 2.878 2.730 3.128 . 0 0 "[ . 1 . 2]" 1
271 1 13 LEU HB3 1 14 SER H . . 5.080 4.002 3.919 4.116 . 0 0 "[ . 1 . 2]" 1
272 1 13 LEU MD1 1 22 THR H . . 4.750 2.872 2.622 3.338 . 0 0 "[ . 1 . 2]" 1
273 1 13 LEU MD1 1 22 THR HB . . 5.100 4.415 4.150 5.145 0.045 2 0 "[ . 1 . 2]" 1
274 1 13 LEU MD2 1 14 SER H . . 4.420 4.478 4.447 4.515 0.095 20 0 "[ . 1 . 2]" 1
275 1 13 LEU MD2 1 22 THR H . . 4.730 4.745 4.629 4.796 0.066 17 0 "[ . 1 . 2]" 1
276 1 13 LEU MD2 1 105 LYS HB3 . . 5.090 5.042 4.906 5.191 0.101 5 0 "[ . 1 . 2]" 1
277 1 13 LEU HG 1 14 SER H . . 4.520 3.996 3.833 4.319 . 0 0 "[ . 1 . 2]" 1
278 1 13 LEU HG 1 15 ALA H . . 5.130 4.771 4.153 5.063 . 0 0 "[ . 1 . 2]" 1
279 1 13 LEU HG 1 106 LEU HA . . 5.470 4.034 3.829 4.155 . 0 0 "[ . 1 . 2]" 1
280 1 13 LEU HG 1 107 GLU H . . 5.200 4.546 4.340 4.703 . 0 0 "[ . 1 . 2]" 1
281 1 14 SER H 1 106 LEU HA . . 5.500 5.489 5.304 5.591 0.091 20 0 "[ . 1 . 2]" 1
282 1 14 SER H 1 107 GLU QG . . 5.500 5.467 5.153 5.559 0.059 18 0 "[ . 1 . 2]" 1
283 1 14 SER HA 1 15 ALA H . . 3.350 2.122 2.062 2.181 . 0 0 "[ . 1 . 2]" 1
284 1 14 SER HA 1 15 ALA MB . . 4.680 3.883 3.828 3.968 . 0 0 "[ . 1 . 2]" 1
285 1 14 SER HA 1 106 LEU QD . . 5.010 3.288 2.889 3.814 . 0 0 "[ . 1 . 2]" 1
286 1 14 SER HA 1 107 GLU H . . 4.170 2.278 2.115 2.502 . 0 0 "[ . 1 . 2]" 1
287 1 14 SER HA 1 107 GLU HB2 . . 4.830 2.531 2.258 2.789 . 0 0 "[ . 1 . 2]" 1
288 1 14 SER HA 1 107 GLU HB3 . . 4.610 3.944 3.588 4.307 . 0 0 "[ . 1 . 2]" 1
289 1 14 SER HA 1 107 GLU QG . . 4.680 4.045 3.934 4.162 . 0 0 "[ . 1 . 2]" 1
290 1 14 SER HA 1 108 ILE HA . . 5.500 4.139 3.901 4.473 . 0 0 "[ . 1 . 2]" 1
291 1 14 SER QB 1 15 ALA H . . 4.390 3.014 2.824 3.243 . 0 0 "[ . 1 . 2]" 1
292 1 14 SER QB 1 15 ALA HA . . 4.450 4.142 3.942 4.321 . 0 0 "[ . 1 . 2]" 1
293 1 14 SER QB 1 106 LEU HA . . 5.490 5.522 5.226 5.617 0.127 5 0 "[ . 1 . 2]" 1
294 1 14 SER QB 1 106 LEU QD . . 4.860 4.678 4.290 4.912 0.052 9 0 "[ . 1 . 2]" 1
295 1 14 SER QB 1 107 GLU H . . 4.880 3.893 3.569 4.012 . 0 0 "[ . 1 . 2]" 1
296 1 14 SER QB 1 107 GLU HB2 . . 4.750 2.467 1.925 2.778 . 0 0 "[ . 1 . 2]" 1
297 1 14 SER QB 1 107 GLU HB3 . . 4.430 3.290 2.874 3.731 . 0 0 "[ . 1 . 2]" 1
298 1 14 SER QB 1 107 GLU QG . . 4.630 4.131 3.290 4.510 . 0 0 "[ . 1 . 2]" 1
299 1 14 SER QB 1 109 LYS H . . 5.240 3.470 3.229 3.767 . 0 0 "[ . 1 . 2]" 1
300 1 14 SER QB 1 109 LYS HB2 . . 5.360 4.553 4.260 4.852 . 0 0 "[ . 1 . 2]" 1
301 1 14 SER QB 1 109 LYS HB3 . . 5.010 4.454 4.243 4.837 . 0 0 "[ . 1 . 2]" 1
302 1 14 SER QB 1 109 LYS QD . . 4.370 3.923 2.722 4.413 0.043 19 0 "[ . 1 . 2]" 1
303 1 14 SER QB 1 109 LYS QE . . 5.050 3.538 2.157 4.402 . 0 0 "[ . 1 . 2]" 1
304 1 14 SER QB 1 109 LYS QG . . 4.240 2.304 2.042 2.605 . 0 0 "[ . 1 . 2]" 1
305 1 15 ALA H 1 80 LEU MD1 . . 5.500 4.857 4.507 5.464 . 0 0 "[ . 1 . 2]" 1
306 1 15 ALA H 1 80 LEU MD2 . . 4.730 4.447 3.505 4.807 0.077 2 0 "[ . 1 . 2]" 1
307 1 15 ALA H 1 106 LEU HA . . 5.180 4.991 4.269 5.215 0.035 3 0 "[ . 1 . 2]" 1
308 1 15 ALA H 1 106 LEU QD . . 4.170 3.218 2.626 3.770 . 0 0 "[ . 1 . 2]" 1
309 1 15 ALA H 1 107 GLU HB2 . . 5.500 4.106 3.959 4.263 . 0 0 "[ . 1 . 2]" 1
310 1 15 ALA H 1 107 GLU HB3 . . 5.500 4.948 4.624 5.156 . 0 0 "[ . 1 . 2]" 1
311 1 15 ALA H 1 107 GLU QG . . 5.500 5.505 5.263 5.592 0.092 16 0 "[ . 1 . 2]" 1
312 1 15 ALA H 1 108 ILE HA . . 4.570 2.814 2.503 3.271 . 0 0 "[ . 1 . 2]" 1
313 1 15 ALA H 1 109 LYS QE . . 5.320 4.676 3.928 5.459 0.139 14 0 "[ . 1 . 2]" 1
314 1 15 ALA H 1 109 LYS QG . . 5.180 3.352 2.690 3.775 . 0 0 "[ . 1 . 2]" 1
315 1 15 ALA HA 1 109 LYS QD . . 5.500 3.272 1.997 4.068 . 0 0 "[ . 1 . 2]" 1
316 1 15 ALA HA 1 109 LYS QE . . 4.550 2.878 1.812 4.006 . 0 0 "[ . 1 . 2]" 1
317 1 15 ALA MB 1 16 SER H . . 3.290 2.740 2.445 3.027 . 0 0 "[ . 1 . 2]" 1
318 1 15 ALA MB 1 19 ASP H . . 4.940 4.019 3.827 4.319 . 0 0 "[ . 1 . 2]" 1
319 1 15 ALA MB 1 19 ASP HB2 . . 3.830 2.204 1.915 3.430 . 0 0 "[ . 1 . 2]" 1
320 1 15 ALA MB 1 19 ASP HB3 . . 4.270 2.547 1.884 3.295 . 0 0 "[ . 1 . 2]" 1
321 1 15 ALA MB 1 21 VAL HB . . 4.790 4.365 4.171 4.483 . 0 0 "[ . 1 . 2]" 1
322 1 15 ALA MB 1 80 LEU MD2 . . 3.340 2.640 1.972 3.140 . 0 0 "[ . 1 . 2]" 1
323 1 15 ALA MB 1 106 LEU HA . . 5.500 5.287 4.605 5.531 0.031 18 0 "[ . 1 . 2]" 1
324 1 15 ALA MB 1 107 GLU H . . 5.500 4.636 4.295 4.874 . 0 0 "[ . 1 . 2]" 1
325 1 16 SER H 1 16 SER QB . . 3.630 2.573 2.301 2.997 . 0 0 "[ . 1 . 2]" 1
326 1 16 SER H 1 19 ASP H . . 5.480 4.015 3.649 4.518 . 0 0 "[ . 1 . 2]" 1
327 1 16 SER H 1 19 ASP HB2 . . 4.750 2.662 2.040 3.148 . 0 0 "[ . 1 . 2]" 1
328 1 16 SER H 1 19 ASP HB3 . . 5.110 3.738 2.505 4.277 . 0 0 "[ . 1 . 2]" 1
329 1 16 SER H 1 80 LEU MD1 . . 5.500 5.430 4.996 5.725 0.225 10 0 "[ . 1 . 2]" 1
330 1 16 SER H 1 80 LEU HG . . 5.370 4.571 4.220 4.962 . 0 0 "[ . 1 . 2]" 1
331 1 16 SER H 1 108 ILE MG . . 5.300 4.525 4.359 4.831 . 0 0 "[ . 1 . 2]" 1
332 1 16 SER H 1 109 LYS QD . . 5.500 3.478 2.790 4.729 . 0 0 "[ . 1 . 2]" 1
333 1 16 SER H 1 109 LYS QE . . 5.090 4.009 2.072 5.115 0.025 10 0 "[ . 1 . 2]" 1
334 1 16 SER HA 1 108 ILE MD . . 4.060 3.632 2.368 4.088 0.028 14 0 "[ . 1 . 2]" 1
335 1 16 SER HA 1 108 ILE HG12 . . 4.510 3.146 2.588 4.630 0.120 8 0 "[ . 1 . 2]" 1
336 1 16 SER HA 1 108 ILE HG13 . . 4.640 4.486 4.223 4.698 0.058 16 0 "[ . 1 . 2]" 1
337 1 16 SER HA 1 108 ILE MG . . 3.750 1.938 1.789 2.184 . 0 0 "[ . 1 . 2]" 1
338 1 16 SER HA 1 109 LYS HB2 . . 4.830 3.706 3.063 4.087 . 0 0 "[ . 1 . 2]" 1
339 1 16 SER QB 1 17 VAL H . . 3.890 2.993 2.405 3.361 . 0 0 "[ . 1 . 2]" 1
340 1 16 SER QB 1 109 LYS H . . 5.340 2.868 2.129 3.307 . 0 0 "[ . 1 . 2]" 1
341 1 16 SER QB 1 110 ARG H . . 5.340 5.181 4.571 5.434 0.094 19 0 "[ . 1 . 2]" 1
342 1 16 SER HB2 1 17 VAL H . . 4.590 3.354 2.442 3.975 . 0 0 "[ . 1 . 2]" 1
343 1 16 SER HB3 1 17 VAL H . . 4.590 3.633 3.464 3.776 . 0 0 "[ . 1 . 2]" 1
344 1 17 VAL H 1 17 VAL HB . . 3.680 2.743 2.620 3.610 . 0 0 "[ . 1 . 2]" 1
345 1 17 VAL H 1 17 VAL QG . . 3.450 1.858 1.751 1.923 . 0 0 "[ . 1 . 2]" 1
346 1 17 VAL H 1 18 GLY H . . 5.450 4.487 4.444 4.545 . 0 0 "[ . 1 . 2]" 1
347 1 17 VAL H 1 19 ASP H . . 5.500 4.619 4.526 4.723 . 0 0 "[ . 1 . 2]" 1
348 1 17 VAL H 1 108 ILE MD . . 4.470 3.083 2.127 3.391 . 0 0 "[ . 1 . 2]" 1
349 1 17 VAL H 1 108 ILE HG13 . . 4.990 5.015 4.406 5.124 0.134 3 0 "[ . 1 . 2]" 1
350 1 17 VAL H 1 108 ILE MG . . 3.910 2.489 2.166 2.875 . 0 0 "[ . 1 . 2]" 1
351 1 17 VAL HA 1 17 VAL MG1 . . 3.750 2.527 2.353 3.190 . 0 0 "[ . 1 . 2]" 1
352 1 17 VAL HA 1 17 VAL MG2 . . 3.750 2.494 2.370 3.235 . 0 0 "[ . 1 . 2]" 1
353 1 17 VAL HA 1 19 ASP H . . 4.930 3.498 3.186 3.658 . 0 0 "[ . 1 . 2]" 1
354 1 17 VAL HA 1 80 LEU HB2 . . 5.200 3.848 3.659 4.377 . 0 0 "[ . 1 . 2]" 1
355 1 17 VAL HA 1 80 LEU HB3 . . 4.850 2.152 1.971 2.750 . 0 0 "[ . 1 . 2]" 1
356 1 17 VAL HA 1 80 LEU MD2 . . 4.740 4.686 3.861 4.777 0.037 18 0 "[ . 1 . 2]" 1
357 1 17 VAL HA 1 80 LEU HG . . 5.500 3.931 2.799 4.199 . 0 0 "[ . 1 . 2]" 1
358 1 17 VAL HB 1 18 GLY H . . 5.500 4.118 3.054 4.248 . 0 0 "[ . 1 . 2]" 1
359 1 17 VAL HB 1 81 GLN HA . . 4.910 4.511 2.563 5.009 0.099 15 0 "[ . 1 . 2]" 1
360 1 17 VAL QG 1 18 GLY H . . 3.830 2.811 2.681 3.444 . 0 0 "[ . 1 . 2]" 1
361 1 17 VAL QG 1 19 ASP H . . 5.440 4.334 4.191 4.421 . 0 0 "[ . 1 . 2]" 1
362 1 17 VAL QG 1 80 LEU HG . . 5.110 4.555 4.221 5.175 0.065 11 0 "[ . 1 . 2]" 1
363 1 17 VAL QG 1 81 GLN H . . 5.440 4.077 3.870 4.633 . 0 0 "[ . 1 . 2]" 1
364 1 17 VAL QG 1 81 GLN HA . . 3.900 2.135 1.975 2.637 . 0 0 "[ . 1 . 2]" 1
365 1 17 VAL QG 1 81 GLN HB2 . . 5.440 4.528 4.405 4.962 . 0 0 "[ . 1 . 2]" 1
366 1 17 VAL QG 1 81 GLN QE . . 4.720 2.624 1.964 3.581 . 0 0 "[ . 1 . 2]" 1
367 1 17 VAL QG 1 81 GLN HG2 . . 5.440 4.307 3.937 5.019 . 0 0 "[ . 1 . 2]" 1
368 1 17 VAL QG 1 82 PRO HA . . 3.980 2.783 2.157 3.986 0.006 10 0 "[ . 1 . 2]" 1
369 1 17 VAL QG 1 82 PRO HB2 . . 4.700 4.058 3.680 4.642 . 0 0 "[ . 1 . 2]" 1
370 1 17 VAL QG 1 82 PRO HD3 . . 3.590 1.977 1.898 2.089 . 0 0 "[ . 1 . 2]" 1
371 1 17 VAL QG 1 82 PRO HG2 . . 4.170 3.522 2.976 4.123 . 0 0 "[ . 1 . 2]" 1
372 1 17 VAL QG 1 82 PRO HG3 . . 4.420 2.506 1.885 3.405 . 0 0 "[ . 1 . 2]" 1
373 1 17 VAL QG 1 83 GLU H . . 5.440 4.625 4.272 5.114 . 0 0 "[ . 1 . 2]" 1
374 1 17 VAL QG 1 108 ILE HB . . 4.720 4.598 4.221 4.919 0.199 2 0 "[ . 1 . 2]" 1
375 1 17 VAL MG1 1 18 GLY H . . 4.700 3.098 2.720 4.294 . 0 0 "[ . 1 . 2]" 1
376 1 17 VAL MG1 1 81 GLN HA . . 4.630 2.479 2.005 4.449 . 0 0 "[ . 1 . 2]" 1
377 1 17 VAL MG1 1 82 PRO HD2 . . 4.350 3.556 3.127 4.414 0.064 10 0 "[ . 1 . 2]" 1
378 1 17 VAL MG1 1 82 PRO HD3 . . 4.190 2.289 1.915 3.276 . 0 0 "[ . 1 . 2]" 1
379 1 17 VAL MG2 1 18 GLY H . . 4.700 3.894 2.788 4.192 . 0 0 "[ . 1 . 2]" 1
380 1 17 VAL MG2 1 81 GLN HA . . 4.630 2.967 2.029 4.059 . 0 0 "[ . 1 . 2]" 1
381 1 17 VAL MG2 1 82 PRO HD2 . . 4.350 3.689 3.176 4.457 0.107 8 0 "[ . 1 . 2]" 1
382 1 17 VAL MG2 1 82 PRO HD3 . . 4.190 2.397 1.927 3.110 . 0 0 "[ . 1 . 2]" 1
383 1 18 GLY H 1 19 ASP H . . 4.370 2.585 2.429 2.712 . 0 0 "[ . 1 . 2]" 1
384 1 18 GLY H 1 79 SER HA . . 5.200 3.965 3.682 4.233 . 0 0 "[ . 1 . 2]" 1
385 1 18 GLY H 1 80 LEU H . . 5.080 2.843 2.609 3.085 . 0 0 "[ . 1 . 2]" 1
386 1 18 GLY H 1 80 LEU HB2 . . 5.090 3.525 3.350 4.258 . 0 0 "[ . 1 . 2]" 1
387 1 18 GLY H 1 80 LEU HB3 . . 4.660 2.496 2.340 2.715 . 0 0 "[ . 1 . 2]" 1
388 1 18 GLY H 1 80 LEU MD1 . . 5.500 4.201 3.961 4.818 . 0 0 "[ . 1 . 2]" 1
389 1 18 GLY H 1 80 LEU MD2 . . 5.400 4.940 4.549 5.165 . 0 0 "[ . 1 . 2]" 1
390 1 18 GLY H 1 81 GLN QE . . 5.340 3.300 2.858 4.104 . 0 0 "[ . 1 . 2]" 1
391 1 18 GLY HA2 1 80 LEU H . . 5.500 3.800 3.484 4.116 . 0 0 "[ . 1 . 2]" 1
392 1 18 GLY HA2 1 80 LEU HB3 . . 5.100 4.727 4.558 4.925 . 0 0 "[ . 1 . 2]" 1
393 1 18 GLY HA2 1 81 GLN QE . . 5.340 3.773 3.246 4.188 . 0 0 "[ . 1 . 2]" 1
394 1 19 ASP H 1 19 ASP HB2 . . 4.180 2.410 2.247 2.580 . 0 0 "[ . 1 . 2]" 1
395 1 19 ASP H 1 19 ASP HB3 . . 4.200 3.523 2.492 3.671 . 0 0 "[ . 1 . 2]" 1
396 1 19 ASP H 1 79 SER HA . . 5.370 4.453 4.098 4.791 . 0 0 "[ . 1 . 2]" 1
397 1 19 ASP H 1 80 LEU H . . 4.880 3.273 3.096 3.466 . 0 0 "[ . 1 . 2]" 1
398 1 19 ASP H 1 80 LEU HB2 . . 5.100 3.195 2.902 4.055 . 0 0 "[ . 1 . 2]" 1
399 1 19 ASP H 1 80 LEU HB3 . . 4.520 2.919 2.667 3.171 . 0 0 "[ . 1 . 2]" 1
400 1 19 ASP H 1 80 LEU MD2 . . 4.820 4.779 3.817 4.883 0.063 9 0 "[ . 1 . 2]" 1
401 1 19 ASP HB2 1 20 ARG H . . 4.940 3.825 3.719 4.046 . 0 0 "[ . 1 . 2]" 1
402 1 19 ASP HB2 1 80 LEU MD2 . . 5.240 4.363 2.997 5.325 0.085 1 0 "[ . 1 . 2]" 1
403 1 19 ASP HB3 1 20 ARG H . . 4.510 2.619 2.405 3.630 . 0 0 "[ . 1 . 2]" 1
404 1 19 ASP HB3 1 80 LEU MD2 . . 5.470 4.853 3.867 5.474 0.004 18 0 "[ . 1 . 2]" 1
405 1 20 ARG H 1 20 ARG QD . . 4.850 4.516 3.975 4.858 0.008 17 0 "[ . 1 . 2]" 1
406 1 20 ARG H 1 20 ARG HG2 . . 5.500 4.248 3.769 4.440 . 0 0 "[ . 1 . 2]" 1
407 1 20 ARG H 1 20 ARG QG . . 4.760 3.664 2.602 4.028 . 0 0 "[ . 1 . 2]" 1
408 1 20 ARG H 1 20 ARG HG3 . . 5.500 4.124 2.648 4.659 . 0 0 "[ . 1 . 2]" 1
409 1 20 ARG HA 1 20 ARG QD . . 4.970 4.095 3.882 4.257 . 0 0 "[ . 1 . 2]" 1
410 1 20 ARG HA 1 76 THR MG . . 4.450 4.320 4.021 4.494 0.044 5 0 "[ . 1 . 2]" 1
411 1 20 ARG HA 1 77 ILE HB . . 5.500 3.821 3.588 4.066 . 0 0 "[ . 1 . 2]" 1
412 1 20 ARG HA 1 78 SER HA . . 4.690 3.685 3.251 4.088 . 0 0 "[ . 1 . 2]" 1
413 1 20 ARG HA 1 80 LEU H . . 5.500 3.854 3.454 4.154 . 0 0 "[ . 1 . 2]" 1
414 1 20 ARG QB 1 76 THR MG . . 4.720 3.892 2.746 4.382 . 0 0 "[ . 1 . 2]" 1
415 1 20 ARG HB2 1 21 VAL H . . 5.500 4.128 3.831 4.288 . 0 0 "[ . 1 . 2]" 1
416 1 20 ARG HB2 1 76 THR MG . . 5.430 4.638 4.194 4.969 . 0 0 "[ . 1 . 2]" 1
417 1 20 ARG HB2 1 78 SER HA . . 5.500 4.030 3.385 5.062 . 0 0 "[ . 1 . 2]" 1
418 1 20 ARG HB3 1 21 VAL H . . 5.500 3.788 2.686 4.239 . 0 0 "[ . 1 . 2]" 1
419 1 20 ARG HB3 1 76 THR MG . . 5.430 4.295 2.783 5.005 . 0 0 "[ . 1 . 2]" 1
420 1 20 ARG HB3 1 78 SER HA . . 5.500 4.677 3.584 5.281 . 0 0 "[ . 1 . 2]" 1
421 1 20 ARG QD 1 21 VAL H . . 5.130 4.717 4.448 4.917 . 0 0 "[ . 1 . 2]" 1
422 1 20 ARG QD 1 76 THR MG . . 4.150 3.016 2.423 3.711 . 0 0 "[ . 1 . 2]" 1
423 1 20 ARG QD 1 78 SER HA . . 5.200 3.451 2.881 3.956 . 0 0 "[ . 1 . 2]" 1
424 1 20 ARG QG 1 21 VAL H . . 4.010 2.987 2.494 3.863 . 0 0 "[ . 1 . 2]" 1
425 1 20 ARG QG 1 78 SER H . . 5.340 4.407 4.071 4.898 . 0 0 "[ . 1 . 2]" 1
426 1 20 ARG QG 1 78 SER HA . . 4.300 2.270 1.899 2.653 . 0 0 "[ . 1 . 2]" 1
427 1 20 ARG QG 1 79 SER H . . 5.340 4.799 4.178 5.351 0.011 10 0 "[ . 1 . 2]" 1
428 1 20 ARG HG2 1 21 VAL H . . 4.740 3.286 2.701 4.066 . 0 0 "[ . 1 . 2]" 1
429 1 20 ARG HG3 1 21 VAL H . . 4.740 3.522 2.725 4.820 0.080 8 0 "[ . 1 . 2]" 1
430 1 21 VAL H 1 21 VAL HB . . 4.030 2.627 2.527 2.759 . 0 0 "[ . 1 . 2]" 1
431 1 21 VAL H 1 21 VAL MG1 . . 4.600 3.855 3.802 3.900 . 0 0 "[ . 1 . 2]" 1
432 1 21 VAL H 1 21 VAL QG . . 3.660 2.648 2.459 2.869 . 0 0 "[ . 1 . 2]" 1
433 1 21 VAL H 1 21 VAL MG2 . . 4.600 2.700 2.487 2.952 . 0 0 "[ . 1 . 2]" 1
434 1 21 VAL H 1 22 THR H . . 5.500 4.424 4.260 4.518 . 0 0 "[ . 1 . 2]" 1
435 1 21 VAL H 1 76 THR MG . . 3.700 3.526 3.059 3.714 0.014 15 0 "[ . 1 . 2]" 1
436 1 21 VAL H 1 77 ILE H . . 4.710 2.786 2.651 3.026 . 0 0 "[ . 1 . 2]" 1
437 1 21 VAL H 1 77 ILE HB . . 4.980 2.620 2.473 2.858 . 0 0 "[ . 1 . 2]" 1
438 1 21 VAL H 1 77 ILE MD . . 5.500 4.390 4.222 4.694 . 0 0 "[ . 1 . 2]" 1
439 1 21 VAL H 1 77 ILE HG13 . . 4.770 4.356 4.177 4.594 . 0 0 "[ . 1 . 2]" 1
440 1 21 VAL H 1 77 ILE MG . . 4.800 3.842 3.729 4.004 . 0 0 "[ . 1 . 2]" 1
441 1 21 VAL H 1 78 SER HA . . 5.500 4.426 4.055 4.720 . 0 0 "[ . 1 . 2]" 1
442 1 21 VAL H 1 80 LEU H . . 5.500 5.007 4.542 5.508 0.008 18 0 "[ . 1 . 2]" 1
443 1 21 VAL HA 1 22 THR H . . 3.420 2.191 2.120 2.248 . 0 0 "[ . 1 . 2]" 1
444 1 21 VAL HA 1 22 THR HB . . 5.460 4.556 4.398 4.695 . 0 0 "[ . 1 . 2]" 1
445 1 21 VAL HA 1 77 ILE HB . . 5.430 4.734 4.528 5.019 . 0 0 "[ . 1 . 2]" 1
446 1 21 VAL HB 1 22 THR H . . 4.760 4.090 3.990 4.258 . 0 0 "[ . 1 . 2]" 1
447 1 21 VAL HB 1 77 ILE H . . 4.940 2.925 2.419 3.382 . 0 0 "[ . 1 . 2]" 1
448 1 21 VAL HB 1 77 ILE HB . . 3.970 2.297 2.011 2.546 . 0 0 "[ . 1 . 2]" 1
449 1 21 VAL HB 1 77 ILE MD . . 4.220 2.643 2.449 3.106 . 0 0 "[ . 1 . 2]" 1
450 1 21 VAL HB 1 77 ILE HG13 . . 4.060 2.845 2.373 3.278 . 0 0 "[ . 1 . 2]" 1
451 1 21 VAL HB 1 77 ILE MG . . 4.740 3.860 3.685 4.109 . 0 0 "[ . 1 . 2]" 1
452 1 21 VAL QG 1 22 THR HA . . 5.440 3.439 3.278 3.610 . 0 0 "[ . 1 . 2]" 1
453 1 21 VAL QG 1 23 ILE H . . 5.160 3.673 3.512 4.061 . 0 0 "[ . 1 . 2]" 1
454 1 21 VAL QG 1 23 ILE HG13 . . 4.270 2.167 1.989 2.393 . 0 0 "[ . 1 . 2]" 1
455 1 21 VAL QG 1 77 ILE H . . 4.770 3.555 3.285 3.777 . 0 0 "[ . 1 . 2]" 1
456 1 21 VAL QG 1 77 ILE HB . . 3.560 2.882 2.172 3.319 . 0 0 "[ . 1 . 2]" 1
457 1 21 VAL QG 1 77 ILE MD . . 3.700 2.580 2.075 3.069 . 0 0 "[ . 1 . 2]" 1
458 1 21 VAL MG1 1 22 THR H . . 4.090 2.503 2.317 2.745 . 0 0 "[ . 1 . 2]" 1
459 1 21 VAL MG1 1 77 ILE H . . 5.500 3.811 3.517 4.057 . 0 0 "[ . 1 . 2]" 1
460 1 21 VAL MG1 1 77 ILE HB . . 4.120 3.927 3.657 4.124 0.004 11 0 "[ . 1 . 2]" 1
461 1 21 VAL MG2 1 22 THR H . . 4.090 3.907 3.735 4.052 . 0 0 "[ . 1 . 2]" 1
462 1 21 VAL MG2 1 77 ILE H . . 5.500 4.267 3.811 4.696 . 0 0 "[ . 1 . 2]" 1
463 1 21 VAL MG2 1 77 ILE HB . . 4.120 2.978 2.187 3.556 . 0 0 "[ . 1 . 2]" 1
464 1 22 THR H 1 22 THR HB . . 3.980 2.679 2.516 3.103 . 0 0 "[ . 1 . 2]" 1
465 1 22 THR H 1 22 THR MG . . 4.610 3.673 2.111 3.876 . 0 0 "[ . 1 . 2]" 1
466 1 22 THR H 1 23 ILE H . . 5.330 4.168 4.090 4.278 . 0 0 "[ . 1 . 2]" 1
467 1 22 THR H 1 76 THR HA . . 4.870 4.726 4.546 4.865 . 0 0 "[ . 1 . 2]" 1
468 1 22 THR H 1 77 ILE H . . 5.500 4.875 4.709 5.078 . 0 0 "[ . 1 . 2]" 1
469 1 22 THR HA 1 22 THR MG . . 3.720 2.465 2.330 3.232 . 0 0 "[ . 1 . 2]" 1
470 1 22 THR HA 1 75 PHE H . . 5.500 4.524 4.354 4.736 . 0 0 "[ . 1 . 2]" 1
471 1 22 THR HA 1 76 THR HA . . 4.090 2.416 2.194 2.657 . 0 0 "[ . 1 . 2]" 1
472 1 22 THR HA 1 76 THR MG . . 4.550 3.364 3.213 3.563 . 0 0 "[ . 1 . 2]" 1
473 1 22 THR HA 1 77 ILE H . . 5.180 3.751 3.509 4.054 . 0 0 "[ . 1 . 2]" 1
474 1 22 THR HB 1 23 ILE H . . 4.890 4.250 4.122 4.297 . 0 0 "[ . 1 . 2]" 1
475 1 22 THR MG 1 23 ILE H . . 3.880 3.001 2.849 3.981 0.101 2 0 "[ . 1 . 2]" 1
476 1 22 THR MG 1 24 THR H . . 4.970 4.577 4.171 5.007 0.037 15 0 "[ . 1 . 2]" 1
477 1 23 ILE H 1 23 ILE MD . . 4.970 4.018 3.940 4.160 . 0 0 "[ . 1 . 2]" 1
478 1 23 ILE H 1 23 ILE HG12 . . 5.430 3.861 3.784 3.984 . 0 0 "[ . 1 . 2]" 1
479 1 23 ILE H 1 23 ILE HG13 . . 4.750 2.756 2.659 2.937 . 0 0 "[ . 1 . 2]" 1
480 1 23 ILE H 1 23 ILE MG . . 4.630 3.816 3.790 3.845 . 0 0 "[ . 1 . 2]" 1
481 1 23 ILE H 1 24 THR H . . 5.130 4.399 4.298 4.467 . 0 0 "[ . 1 . 2]" 1
482 1 23 ILE H 1 74 THR HA . . 5.500 4.657 4.473 4.911 . 0 0 "[ . 1 . 2]" 1
483 1 23 ILE H 1 74 THR MG . . 4.170 3.671 3.445 4.065 . 0 0 "[ . 1 . 2]" 1
484 1 23 ILE H 1 75 PHE H . . 4.700 3.041 2.881 3.230 . 0 0 "[ . 1 . 2]" 1
485 1 23 ILE H 1 75 PHE HB2 . . 5.490 4.700 4.465 4.800 . 0 0 "[ . 1 . 2]" 1
486 1 23 ILE H 1 75 PHE HB3 . . 5.500 3.114 2.857 3.230 . 0 0 "[ . 1 . 2]" 1
487 1 23 ILE H 1 75 PHE QE . . 5.500 5.518 5.455 5.571 0.071 2 0 "[ . 1 . 2]" 1
488 1 23 ILE H 1 76 THR H . . 5.500 4.787 4.700 4.905 . 0 0 "[ . 1 . 2]" 1
489 1 23 ILE HA 1 23 ILE MD . . 4.760 3.891 3.868 3.946 . 0 0 "[ . 1 . 2]" 1
490 1 23 ILE HA 1 75 PHE H . . 5.500 4.759 4.697 4.838 . 0 0 "[ . 1 . 2]" 1
491 1 23 ILE HB 1 24 THR H . . 5.090 3.962 3.857 4.077 . 0 0 "[ . 1 . 2]" 1
492 1 23 ILE HB 1 75 PHE HB2 . . 5.040 3.595 3.408 3.766 . 0 0 "[ . 1 . 2]" 1
493 1 23 ILE HB 1 75 PHE HB3 . . 5.120 1.962 1.854 2.108 . 0 0 "[ . 1 . 2]" 1
494 1 23 ILE HB 1 75 PHE QE . . 4.980 4.564 4.329 4.771 . 0 0 "[ . 1 . 2]" 1
495 1 23 ILE HB 1 104 THR HB . . 5.500 5.371 5.223 5.531 0.031 11 0 "[ . 1 . 2]" 1
496 1 23 ILE MD 1 23 ILE MG . . 3.430 1.928 1.839 1.956 . 0 0 "[ . 1 . 2]" 1
497 1 23 ILE MD 1 37 TRP HZ3 . . 5.050 3.872 3.541 4.128 . 0 0 "[ . 1 . 2]" 1
498 1 23 ILE MD 1 75 PHE HB2 . . 5.500 4.648 4.422 4.899 . 0 0 "[ . 1 . 2]" 1
499 1 23 ILE MD 1 75 PHE QE . . 3.740 2.782 2.618 2.981 . 0 0 "[ . 1 . 2]" 1
500 1 23 ILE MD 1 75 PHE HZ . . 4.720 4.617 4.469 4.732 0.012 10 0 "[ . 1 . 2]" 1
501 1 23 ILE MD 1 88 TYR H . . 5.200 4.022 3.862 4.215 . 0 0 "[ . 1 . 2]" 1
502 1 23 ILE MD 1 88 TYR HA . . 4.750 4.711 4.509 4.870 0.120 13 0 "[ . 1 . 2]" 1
503 1 23 ILE MD 1 88 TYR HB2 . . 4.050 2.274 2.089 2.465 . 0 0 "[ . 1 . 2]" 1
504 1 23 ILE MD 1 88 TYR HB3 . . 4.610 2.960 2.710 3.189 . 0 0 "[ . 1 . 2]" 1
505 1 23 ILE MD 1 88 TYR QD . . 4.250 3.020 2.618 3.317 . 0 0 "[ . 1 . 2]" 1
506 1 23 ILE MD 1 89 TYR H . . 5.500 5.225 5.039 5.515 0.015 7 0 "[ . 1 . 2]" 1
507 1 23 ILE MD 1 104 THR H . . 5.500 5.423 5.134 5.536 0.036 9 0 "[ . 1 . 2]" 1
508 1 23 ILE MD 1 104 THR HB . . 3.940 2.996 2.816 3.145 . 0 0 "[ . 1 . 2]" 1
509 1 23 ILE MD 1 104 THR MG . . 3.400 2.145 1.952 2.331 . 0 0 "[ . 1 . 2]" 1
510 1 23 ILE HG12 1 23 ILE MG . . 3.530 2.413 2.383 2.447 . 0 0 "[ . 1 . 2]" 1
511 1 23 ILE HG12 1 75 PHE QE . . 5.500 5.476 5.321 5.513 0.013 17 0 "[ . 1 . 2]" 1
512 1 23 ILE HG13 1 23 ILE MG . . 3.570 3.200 3.189 3.214 . 0 0 "[ . 1 . 2]" 1
513 1 23 ILE HG13 1 75 PHE QE . . 4.590 4.257 4.100 4.335 . 0 0 "[ . 1 . 2]" 1
514 1 23 ILE MG 1 24 THR H . . 3.890 2.372 2.241 2.533 . 0 0 "[ . 1 . 2]" 1
515 1 23 ILE MG 1 37 TRP HE3 . . 4.710 4.305 3.972 4.714 0.004 10 0 "[ . 1 . 2]" 1
516 1 23 ILE MG 1 37 TRP HH2 . . 3.750 3.099 2.824 3.370 . 0 0 "[ . 1 . 2]" 1
517 1 23 ILE MG 1 37 TRP HZ3 . . 4.140 2.563 2.339 2.947 . 0 0 "[ . 1 . 2]" 1
518 1 23 ILE MG 1 75 PHE HB3 . . 3.990 3.283 3.110 3.451 . 0 0 "[ . 1 . 2]" 1
519 1 23 ILE MG 1 75 PHE QE . . 5.220 5.032 4.849 5.240 0.020 1 0 "[ . 1 . 2]" 1
520 1 23 ILE MG 1 88 TYR HB2 . . 5.440 3.522 3.355 3.842 . 0 0 "[ . 1 . 2]" 1
521 1 23 ILE MG 1 89 TYR HA . . 5.500 4.469 4.026 5.099 . 0 0 "[ . 1 . 2]" 1
522 1 23 ILE MG 1 104 THR H . . 5.500 4.768 4.327 5.129 . 0 0 "[ . 1 . 2]" 1
523 1 23 ILE MG 1 104 THR HB . . 4.940 2.774 2.622 2.985 . 0 0 "[ . 1 . 2]" 1
524 1 24 THR H 1 24 THR MG . . 4.060 3.759 2.975 3.921 . 0 0 "[ . 1 . 2]" 1
525 1 24 THR H 1 25 CYS H . . 5.110 4.328 4.232 4.413 . 0 0 "[ . 1 . 2]" 1
526 1 24 THR H 1 37 TRP HH2 . . 5.500 4.592 4.294 4.889 . 0 0 "[ . 1 . 2]" 1
527 1 24 THR H 1 74 THR HA . . 5.500 5.023 4.866 5.195 . 0 0 "[ . 1 . 2]" 1
528 1 24 THR HA 1 37 TRP HH2 . . 4.620 3.371 3.075 3.704 . 0 0 "[ . 1 . 2]" 1
529 1 24 THR HA 1 37 TRP HZ2 . . 4.630 4.504 4.162 4.698 0.068 10 0 "[ . 1 . 2]" 1
530 1 24 THR HA 1 74 THR H . . 5.500 4.927 4.788 5.058 . 0 0 "[ . 1 . 2]" 1
531 1 24 THR HA 1 74 THR HA . . 4.210 2.437 2.281 2.566 . 0 0 "[ . 1 . 2]" 1
532 1 24 THR HA 1 74 THR HB . . 5.500 5.381 5.203 5.533 0.033 9 0 "[ . 1 . 2]" 1
533 1 24 THR HA 1 74 THR MG . . 4.500 3.633 3.388 3.894 . 0 0 "[ . 1 . 2]" 1
534 1 24 THR HA 1 75 PHE H . . 4.810 3.178 2.922 3.383 . 0 0 "[ . 1 . 2]" 1
535 1 24 THR HB 1 25 CYS H . . 4.420 3.921 2.965 4.148 . 0 0 "[ . 1 . 2]" 1
536 1 24 THR HB 1 74 THR MG . . 5.270 4.999 4.541 5.282 0.012 12 0 "[ . 1 . 2]" 1
537 1 24 THR MG 1 25 CYS H . . 3.940 2.731 2.434 3.762 . 0 0 "[ . 1 . 2]" 1
538 1 24 THR MG 1 72 GLU QG . . 4.560 4.080 3.477 4.632 0.072 7 0 "[ . 1 . 2]" 1
539 1 24 THR MG 1 73 PHE H . . 5.130 3.431 2.956 4.757 . 0 0 "[ . 1 . 2]" 1
540 1 24 THR MG 1 74 THR H . . 5.500 4.729 4.481 5.064 . 0 0 "[ . 1 . 2]" 1
541 1 24 THR MG 1 74 THR HA . . 4.590 3.126 2.498 3.541 . 0 0 "[ . 1 . 2]" 1
542 1 25 CYS CB 1 90 CYS SG . . 3.100 3.047 3.026 3.082 . 0 0 "[ . 1 . 2]" 1
543 1 25 CYS H 1 37 TRP HH2 . . 4.550 2.861 2.517 3.101 . 0 0 "[ . 1 . 2]" 1
544 1 25 CYS H 1 37 TRP HZ2 . . 4.750 3.616 3.322 3.778 . 0 0 "[ . 1 . 2]" 1
545 1 25 CYS H 1 72 GLU HA . . 5.500 4.734 4.372 4.958 . 0 0 "[ . 1 . 2]" 1
546 1 25 CYS H 1 73 PHE H . . 4.900 3.028 2.842 3.230 . 0 0 "[ . 1 . 2]" 1
547 1 25 CYS H 1 73 PHE HB3 . . 5.500 4.358 4.130 4.570 . 0 0 "[ . 1 . 2]" 1
548 1 25 CYS H 1 74 THR H . . 5.500 4.867 4.755 4.989 . 0 0 "[ . 1 . 2]" 1
549 1 25 CYS H 1 74 THR HA . . 4.740 3.552 3.307 3.736 . 0 0 "[ . 1 . 2]" 1
550 1 25 CYS H 1 74 THR MG . . 5.420 5.117 4.909 5.298 . 0 0 "[ . 1 . 2]" 1
551 1 25 CYS HA 1 73 PHE H . . 5.500 4.880 4.694 5.038 . 0 0 "[ . 1 . 2]" 1
552 1 25 CYS HB2 1 26 GLN H . . 5.180 4.175 4.107 4.250 . 0 0 "[ . 1 . 2]" 1
553 1 25 CYS HB2 1 35 LEU MD1 . . 4.750 4.167 3.649 4.688 . 0 0 "[ . 1 . 2]" 1
554 1 25 CYS HB2 1 35 LEU QD . . 4.060 3.469 2.610 4.065 0.005 1 0 "[ . 1 . 2]" 1
555 1 25 CYS HB2 1 35 LEU MD2 . . 4.750 3.854 2.643 4.748 . 0 0 "[ . 1 . 2]" 1
556 1 25 CYS HB2 1 37 TRP HH2 . . 5.500 2.461 2.020 3.146 . 0 0 "[ . 1 . 2]" 1
557 1 25 CYS HB2 1 37 TRP HZ2 . . 4.000 3.348 2.971 3.800 . 0 0 "[ . 1 . 2]" 1
558 1 25 CYS HB2 1 73 PHE QD . . 4.780 3.920 2.296 4.854 0.074 4 0 "[ . 1 . 2]" 1
559 1 25 CYS HB2 1 90 CYS HB3 . . 5.500 3.464 2.766 4.247 . 0 0 "[ . 1 . 2]" 1
560 1 25 CYS HB3 1 26 GLN H . . 5.500 3.627 3.009 4.137 . 0 0 "[ . 1 . 2]" 1
561 1 25 CYS HB3 1 35 LEU MD1 . . 5.500 3.914 3.567 4.436 . 0 0 "[ . 1 . 2]" 1
562 1 25 CYS HB3 1 35 LEU QD . . 4.780 3.192 2.614 3.486 . 0 0 "[ . 1 . 2]" 1
563 1 25 CYS HB3 1 35 LEU MD2 . . 5.500 3.448 2.662 3.891 . 0 0 "[ . 1 . 2]" 1
564 1 25 CYS HB3 1 37 TRP HH2 . . 4.320 3.429 2.595 4.358 0.038 8 0 "[ . 1 . 2]" 1
565 1 25 CYS HB3 1 37 TRP HZ2 . . 4.620 3.712 2.698 4.683 0.063 8 0 "[ . 1 . 2]" 1
566 1 25 CYS HB3 1 90 CYS HB2 . . 5.500 3.905 3.399 4.574 . 0 0 "[ . 1 . 2]" 1
567 1 25 CYS HB3 1 90 CYS HB3 . . 5.500 3.956 3.304 4.606 . 0 0 "[ . 1 . 2]" 1
568 1 25 CYS SG 1 90 CYS CB . . 3.100 3.092 3.064 3.115 0.015 1 0 "[ . 1 . 2]" 1
569 1 25 CYS SG 1 90 CYS SG . . 2.100 2.036 2.027 2.044 . 0 0 "[ . 1 . 2]" 1
570 1 26 GLN H 1 26 GLN HG2 . . 4.890 3.921 3.842 4.093 . 0 0 "[ . 1 . 2]" 1
571 1 26 GLN H 1 26 GLN HG3 . . 4.910 2.851 2.745 3.040 . 0 0 "[ . 1 . 2]" 1
572 1 26 GLN HA 1 27 ALA MB . . 5.070 3.943 3.879 3.996 . 0 0 "[ . 1 . 2]" 1
573 1 26 GLN HA 1 71 THR HA . . 5.500 4.187 3.872 4.559 . 0 0 "[ . 1 . 2]" 1
574 1 26 GLN HA 1 72 GLU HA . . 4.420 2.834 2.479 3.255 . 0 0 "[ . 1 . 2]" 1
575 1 26 GLN HA 1 73 PHE H . . 5.140 3.623 3.366 4.059 . 0 0 "[ . 1 . 2]" 1
576 1 26 GLN HB2 1 26 GLN HE22 . . 5.500 4.019 3.490 4.499 . 0 0 "[ . 1 . 2]" 1
577 1 26 GLN HB2 1 27 ALA H . . 4.830 4.085 3.867 4.209 . 0 0 "[ . 1 . 2]" 1
578 1 26 GLN HB3 1 26 GLN QE . . 4.260 3.576 2.512 4.083 . 0 0 "[ . 1 . 2]" 1
579 1 26 GLN HB3 1 27 ALA H . . 5.010 3.211 2.881 3.397 . 0 0 "[ . 1 . 2]" 1
580 1 26 GLN HG2 1 27 ALA H . . 4.670 4.431 4.259 4.572 . 0 0 "[ . 1 . 2]" 1
581 1 26 GLN HG2 1 72 GLU HA . . 4.940 3.306 2.785 3.815 . 0 0 "[ . 1 . 2]" 1
582 1 26 GLN HG2 1 72 GLU HG2 . . 5.330 3.268 1.929 5.332 0.002 11 0 "[ . 1 . 2]" 1
583 1 26 GLN HG2 1 72 GLU QG . . 4.570 2.976 1.918 3.819 . 0 0 "[ . 1 . 2]" 1
584 1 26 GLN HG2 1 72 GLU HG3 . . 5.330 4.320 2.706 5.335 0.005 6 0 "[ . 1 . 2]" 1
585 1 26 GLN HG2 1 73 PHE H . . 5.500 4.241 3.678 4.928 . 0 0 "[ . 1 . 2]" 1
586 1 26 GLN HG3 1 72 GLU HA . . 5.360 4.518 4.039 4.876 . 0 0 "[ . 1 . 2]" 1
587 1 27 ALA H 1 28 SER H . . 5.500 4.487 4.412 4.561 . 0 0 "[ . 1 . 2]" 1
588 1 27 ALA H 1 29 GLN H . . 5.500 5.324 5.040 5.531 0.031 20 0 "[ . 1 . 2]" 1
589 1 27 ALA H 1 71 THR HA . . 4.640 2.617 2.309 2.981 . 0 0 "[ . 1 . 2]" 1
590 1 27 ALA H 1 71 THR MG . . 4.550 3.638 3.235 4.217 . 0 0 "[ . 1 . 2]" 1
591 1 27 ALA H 1 72 GLU H . . 5.500 4.803 4.551 5.073 . 0 0 "[ . 1 . 2]" 1
592 1 27 ALA HA 1 29 GLN H . . 5.240 3.940 3.609 4.237 . 0 0 "[ . 1 . 2]" 1
593 1 27 ALA MB 1 28 SER H . . 4.120 2.841 2.655 3.072 . 0 0 "[ . 1 . 2]" 1
594 1 27 ALA MB 1 29 GLN H . . 3.770 2.655 2.469 2.910 . 0 0 "[ . 1 . 2]" 1
595 1 27 ALA MB 1 30 ASP H . . 5.500 4.749 4.500 4.910 . 0 0 "[ . 1 . 2]" 1
596 1 27 ALA MB 1 30 ASP HA . . 5.130 3.324 2.920 3.633 . 0 0 "[ . 1 . 2]" 1
597 1 27 ALA MB 1 31 ILE H . . 4.960 3.979 3.722 4.490 . 0 0 "[ . 1 . 2]" 1
598 1 27 ALA MB 1 31 ILE HB . . 5.500 5.118 4.943 5.403 . 0 0 "[ . 1 . 2]" 1
599 1 27 ALA MB 1 31 ILE MD . . 3.840 2.908 2.694 3.276 . 0 0 "[ . 1 . 2]" 1
600 1 27 ALA MB 1 31 ILE QG . . 3.900 3.263 2.992 3.459 . 0 0 "[ . 1 . 2]" 1
601 1 27 ALA MB 1 31 ILE MG . . 3.780 2.881 2.752 3.125 . 0 0 "[ . 1 . 2]" 1
602 1 27 ALA MB 1 70 GLY HA2 . . 5.450 4.734 4.146 5.069 . 0 0 "[ . 1 . 2]" 1
603 1 27 ALA MB 1 71 THR H . . 5.500 4.411 2.607 4.670 . 0 0 "[ . 1 . 2]" 1
604 1 27 ALA MB 1 71 THR HA . . 3.710 1.987 1.827 2.123 . 0 0 "[ . 1 . 2]" 1
605 1 27 ALA MB 1 71 THR HB . . 3.760 3.602 3.280 3.842 0.082 17 0 "[ . 1 . 2]" 1
606 1 27 ALA MB 1 71 THR MG . . 3.450 2.535 2.063 3.156 . 0 0 "[ . 1 . 2]" 1
607 1 27 ALA MB 1 72 GLU H . . 5.110 4.916 4.644 5.123 0.013 1 0 "[ . 1 . 2]" 1
608 1 27 ALA MB 1 73 PHE QD . . 4.680 3.794 3.536 4.169 . 0 0 "[ . 1 . 2]" 1
609 1 27 ALA MB 1 73 PHE QE . . 5.490 2.492 1.976 2.968 . 0 0 "[ . 1 . 2]" 1
610 1 27 ALA MB 1 92 GLN HG2 . . 5.120 3.615 3.381 3.893 . 0 0 "[ . 1 . 2]" 1
611 1 28 SER H 1 29 GLN H . . 4.300 2.629 2.451 2.779 . 0 0 "[ . 1 . 2]" 1
612 1 29 GLN H 1 29 GLN HG2 . . 4.830 4.471 4.280 4.711 . 0 0 "[ . 1 . 2]" 1
613 1 29 GLN H 1 30 ASP H . . 5.260 4.320 4.223 4.401 . 0 0 "[ . 1 . 2]" 1
614 1 29 GLN H 1 71 THR MG . . 4.550 3.791 3.370 4.530 . 0 0 "[ . 1 . 2]" 1
615 1 29 GLN HA 1 29 GLN HG3 . . 3.940 2.607 2.489 2.698 . 0 0 "[ . 1 . 2]" 1
616 1 29 GLN HA 1 71 THR MG . . 4.510 3.416 3.046 4.061 . 0 0 "[ . 1 . 2]" 1
617 1 29 GLN HB2 1 30 ASP H . . 4.290 4.008 3.644 4.239 . 0 0 "[ . 1 . 2]" 1
618 1 29 GLN HB3 1 29 GLN HE21 . . 4.070 2.736 1.815 4.017 . 0 0 "[ . 1 . 2]" 1
619 1 29 GLN HB3 1 29 GLN HE22 . . 4.730 3.887 3.444 4.835 0.105 20 0 "[ . 1 . 2]" 1
620 1 29 GLN HB3 1 30 ASP H . . 4.540 3.683 2.402 4.092 . 0 0 "[ . 1 . 2]" 1
621 1 29 GLN HE21 1 95 ASN HD21 . . 5.500 3.959 2.591 5.528 0.028 1 0 "[ . 1 . 2]" 1
622 1 29 GLN HG2 1 30 ASP H . . 4.750 2.617 2.137 4.579 . 0 0 "[ . 1 . 2]" 1
623 1 29 GLN HG3 1 30 ASP H . . 4.410 2.896 2.560 4.132 . 0 0 "[ . 1 . 2]" 1
624 1 30 ASP H 1 30 ASP HB2 . . 3.930 3.000 2.417 3.725 . 0 0 "[ . 1 . 2]" 1
625 1 30 ASP H 1 30 ASP QB . . 3.450 2.465 2.244 2.817 . 0 0 "[ . 1 . 2]" 1
626 1 30 ASP H 1 30 ASP HB3 . . 3.930 2.962 2.474 3.703 . 0 0 "[ . 1 . 2]" 1
627 1 30 ASP H 1 31 ILE H . . 5.430 4.542 4.457 4.605 . 0 0 "[ . 1 . 2]" 1
628 1 30 ASP H 1 71 THR MG . . 4.150 3.300 3.026 3.962 . 0 0 "[ . 1 . 2]" 1
629 1 30 ASP HA 1 31 ILE MG . . 4.990 3.413 3.193 3.576 . 0 0 "[ . 1 . 2]" 1
630 1 30 ASP HA 1 32 ASN H . . 4.270 3.864 3.577 4.248 . 0 0 "[ . 1 . 2]" 1
631 1 30 ASP HA 1 71 THR MG . . 3.600 2.386 2.151 2.908 . 0 0 "[ . 1 . 2]" 1
632 1 30 ASP QB 1 32 ASN H . . 5.310 2.896 2.360 3.808 . 0 0 "[ . 1 . 2]" 1
633 1 30 ASP QB 1 71 THR MG . . 4.280 2.733 2.009 3.565 . 0 0 "[ . 1 . 2]" 1
634 1 31 ILE H 1 31 ILE MD . . 5.500 3.657 3.489 3.921 . 0 0 "[ . 1 . 2]" 1
635 1 31 ILE H 1 31 ILE QG . . 4.730 1.971 1.812 2.243 . 0 0 "[ . 1 . 2]" 1
636 1 31 ILE H 1 31 ILE MG . . 4.310 2.820 2.616 3.132 . 0 0 "[ . 1 . 2]" 1
637 1 31 ILE H 1 32 ASN H . . 4.100 2.345 2.119 2.726 . 0 0 "[ . 1 . 2]" 1
638 1 31 ILE H 1 70 GLY H . . 5.500 3.967 3.785 4.332 . 0 0 "[ . 1 . 2]" 1
639 1 31 ILE HA 1 34 TYR H . . 5.500 4.627 4.492 4.786 . 0 0 "[ . 1 . 2]" 1
640 1 31 ILE HA 1 94 ASP HB2 . . 5.500 3.064 2.639 3.373 . 0 0 "[ . 1 . 2]" 1
641 1 31 ILE HA 1 94 ASP HB3 . . 5.500 2.886 2.529 3.337 . 0 0 "[ . 1 . 2]" 1
642 1 31 ILE HB 1 32 ASN H . . 5.500 4.380 4.313 4.426 . 0 0 "[ . 1 . 2]" 1
643 1 31 ILE HB 1 34 TYR H . . 5.480 3.135 2.941 3.315 . 0 0 "[ . 1 . 2]" 1
644 1 31 ILE HB 1 34 TYR HB2 . . 4.730 2.872 2.550 3.097 . 0 0 "[ . 1 . 2]" 1
645 1 31 ILE HB 1 93 TYR H . . 5.500 4.380 4.071 5.168 . 0 0 "[ . 1 . 2]" 1
646 1 31 ILE HB 1 94 ASP H . . 5.250 3.648 3.446 3.891 . 0 0 "[ . 1 . 2]" 1
647 1 31 ILE HB 1 94 ASP HA . . 5.420 4.551 4.428 4.762 . 0 0 "[ . 1 . 2]" 1
648 1 31 ILE HB 1 94 ASP QB . . 4.750 2.093 2.002 2.292 . 0 0 "[ . 1 . 2]" 1
649 1 31 ILE MD 1 31 ILE MG . . 3.520 1.906 1.850 1.971 . 0 0 "[ . 1 . 2]" 1
650 1 31 ILE MD 1 32 ASN H . . 5.500 4.957 4.815 5.080 . 0 0 "[ . 1 . 2]" 1
651 1 31 ILE MD 1 34 TYR H . . 5.150 3.389 3.017 3.571 . 0 0 "[ . 1 . 2]" 1
652 1 31 ILE MD 1 35 LEU H . . 5.500 3.831 3.477 4.101 . 0 0 "[ . 1 . 2]" 1
653 1 31 ILE MD 1 35 LEU HA . . 5.300 3.022 2.858 3.204 . 0 0 "[ . 1 . 2]" 1
654 1 31 ILE MD 1 35 LEU HB2 . . 4.410 2.205 1.930 2.542 . 0 0 "[ . 1 . 2]" 1
655 1 31 ILE MD 1 35 LEU HB3 . . 5.040 3.639 3.331 4.014 . 0 0 "[ . 1 . 2]" 1
656 1 31 ILE MD 1 35 LEU QD . . 3.880 2.405 2.204 2.611 . 0 0 "[ . 1 . 2]" 1
657 1 31 ILE MD 1 53 ALA MB . . 5.490 4.173 3.581 4.685 . 0 0 "[ . 1 . 2]" 1
658 1 31 ILE MD 1 70 GLY H . . 5.500 4.021 3.744 4.279 . 0 0 "[ . 1 . 2]" 1
659 1 31 ILE MD 1 70 GLY HA2 . . 5.170 4.189 3.812 4.470 . 0 0 "[ . 1 . 2]" 1
660 1 31 ILE MD 1 73 PHE QD . . 4.540 3.741 3.646 3.884 . 0 0 "[ . 1 . 2]" 1
661 1 31 ILE MD 1 73 PHE QE . . 4.350 2.176 1.946 2.532 . 0 0 "[ . 1 . 2]" 1
662 1 31 ILE MD 1 92 GLN H . . 5.500 4.736 4.497 5.038 . 0 0 "[ . 1 . 2]" 1
663 1 31 ILE MD 1 92 GLN HA . . 4.990 3.322 3.038 3.647 . 0 0 "[ . 1 . 2]" 1
664 1 31 ILE MD 1 92 GLN HB2 . . 4.350 2.579 2.245 2.828 . 0 0 "[ . 1 . 2]" 1
665 1 31 ILE MD 1 92 GLN HB3 . . 4.420 2.079 1.898 2.318 . 0 0 "[ . 1 . 2]" 1
666 1 31 ILE MD 1 92 GLN HG3 . . 5.030 3.712 3.370 4.015 . 0 0 "[ . 1 . 2]" 1
667 1 31 ILE MD 1 93 TYR H . . 5.500 3.833 3.672 4.294 . 0 0 "[ . 1 . 2]" 1
668 1 31 ILE MD 1 94 ASP HB2 . . 5.500 4.082 3.943 4.361 . 0 0 "[ . 1 . 2]" 1
669 1 31 ILE MD 1 94 ASP HB3 . . 5.500 4.247 4.050 4.459 . 0 0 "[ . 1 . 2]" 1
670 1 31 ILE QG 1 32 ASN H . . 5.280 3.391 3.237 3.545 . 0 0 "[ . 1 . 2]" 1
671 1 31 ILE QG 1 70 GLY H . . 5.500 3.100 2.926 3.265 . 0 0 "[ . 1 . 2]" 1
672 1 31 ILE QG 1 73 PHE QD . . 4.730 4.767 4.701 4.821 0.091 2 0 "[ . 1 . 2]" 1
673 1 31 ILE QG 1 73 PHE QE . . 4.280 2.860 2.750 3.017 . 0 0 "[ . 1 . 2]" 1
674 1 31 ILE MG 1 32 ASN H . . 5.280 4.283 4.195 4.398 . 0 0 "[ . 1 . 2]" 1
675 1 31 ILE MG 1 34 TYR H . . 5.500 4.596 4.418 4.745 . 0 0 "[ . 1 . 2]" 1
676 1 31 ILE MG 1 34 TYR QD . . 4.570 4.594 4.432 4.667 0.097 11 0 "[ . 1 . 2]" 1
677 1 31 ILE MG 1 35 LEU QD . . 5.250 4.076 3.824 4.294 . 0 0 "[ . 1 . 2]" 1
678 1 31 ILE MG 1 70 GLY H . . 5.500 5.516 5.360 5.569 0.069 7 0 "[ . 1 . 2]" 1
679 1 31 ILE MG 1 92 GLN HB2 . . 5.430 2.216 2.000 2.437 . 0 0 "[ . 1 . 2]" 1
680 1 31 ILE MG 1 92 GLN HB3 . . 5.040 2.724 2.397 3.132 . 0 0 "[ . 1 . 2]" 1
681 1 31 ILE MG 1 92 GLN HG3 . . 5.500 3.648 3.520 3.948 . 0 0 "[ . 1 . 2]" 1
682 1 31 ILE MG 1 94 ASP H . . 5.310 3.389 3.143 3.720 . 0 0 "[ . 1 . 2]" 1
683 1 31 ILE MG 1 94 ASP HA . . 5.320 4.690 4.548 4.884 . 0 0 "[ . 1 . 2]" 1
684 1 31 ILE MG 1 94 ASP HB2 . . 4.480 3.081 2.711 3.347 . 0 0 "[ . 1 . 2]" 1
685 1 31 ILE MG 1 94 ASP QB . . 3.810 2.047 1.941 2.256 . 0 0 "[ . 1 . 2]" 1
686 1 31 ILE MG 1 94 ASP HB3 . . 4.480 2.079 1.966 2.299 . 0 0 "[ . 1 . 2]" 1
687 1 31 ILE MG 1 95 ASN H . . 4.850 3.655 3.339 3.955 . 0 0 "[ . 1 . 2]" 1
688 1 32 ASN H 1 33 ASN H . . 5.310 3.971 3.702 4.230 . 0 0 "[ . 1 . 2]" 1
689 1 32 ASN H 1 70 GLY H . . 4.660 4.141 3.821 4.624 . 0 0 "[ . 1 . 2]" 1
690 1 32 ASN H 1 70 GLY HA2 . . 5.400 2.649 2.317 3.628 . 0 0 "[ . 1 . 2]" 1
691 1 32 ASN H 1 70 GLY HA3 . . 5.150 3.869 3.459 4.506 . 0 0 "[ . 1 . 2]" 1
692 1 32 ASN HA 1 69 SER QB . . 4.900 4.414 3.948 4.980 0.080 10 0 "[ . 1 . 2]" 1
693 1 32 ASN HA 1 70 GLY H . . 5.030 3.994 3.568 4.790 . 0 0 "[ . 1 . 2]" 1
694 1 32 ASN HB2 1 33 ASN H . . 3.770 2.955 1.863 3.702 . 0 0 "[ . 1 . 2]" 1
695 1 32 ASN HB2 1 34 TYR H . . 5.040 4.231 3.094 5.050 0.010 10 0 "[ . 1 . 2]" 1
696 1 32 ASN HB2 1 34 TYR QD . . 4.970 3.662 2.477 4.728 . 0 0 "[ . 1 . 2]" 1
697 1 32 ASN HB2 1 34 TYR QE . . 5.100 3.251 2.462 4.238 . 0 0 "[ . 1 . 2]" 1
698 1 32 ASN HB3 1 33 ASN H . . 3.890 2.383 1.937 2.960 . 0 0 "[ . 1 . 2]" 1
699 1 32 ASN HB3 1 34 TYR H . . 5.180 3.788 3.217 4.593 . 0 0 "[ . 1 . 2]" 1
700 1 32 ASN HB3 1 34 TYR QD . . 4.960 3.560 2.636 4.516 . 0 0 "[ . 1 . 2]" 1
701 1 32 ASN HB3 1 34 TYR QE . . 3.880 3.182 2.464 3.910 0.030 9 0 "[ . 1 . 2]" 1
702 1 33 ASN H 1 34 TYR H . . 3.990 1.705 1.570 1.812 . 0 0 "[ . 1 . 2]" 1
703 1 33 ASN H 1 34 TYR QD . . 5.500 3.181 2.850 3.521 . 0 0 "[ . 1 . 2]" 1
704 1 33 ASN H 1 34 TYR QE . . 5.500 4.057 3.839 4.331 . 0 0 "[ . 1 . 2]" 1
705 1 33 ASN HA 1 53 ALA MB . . 4.320 3.156 2.844 3.515 . 0 0 "[ . 1 . 2]" 1
706 1 33 ASN HA 1 70 GLY H . . 5.500 2.588 1.953 3.072 . 0 0 "[ . 1 . 2]" 1
707 1 33 ASN QB 1 34 TYR H . . 5.010 3.887 3.303 4.047 . 0 0 "[ . 1 . 2]" 1
708 1 33 ASN QB 1 52 ASP HB3 . . 5.500 5.626 5.563 5.751 0.251 8 0 "[ . 1 . 2]" 1
709 1 33 ASN QB 1 53 ALA MB . . 3.810 2.895 2.336 3.909 0.099 8 0 "[ . 1 . 2]" 1
710 1 33 ASN QB 1 69 SER QB . . 4.840 3.141 2.711 4.552 . 0 0 "[ . 1 . 2]" 1
711 1 33 ASN QB 1 70 GLY H . . 5.500 4.019 3.535 4.662 . 0 0 "[ . 1 . 2]" 1
712 1 33 ASN QD 1 52 ASP HB2 . . 5.340 4.201 3.669 4.978 . 0 0 "[ . 1 . 2]" 1
713 1 33 ASN QD 1 69 SER QB . . 5.340 5.070 3.929 5.408 0.068 6 0 "[ . 1 . 2]" 1
714 1 33 ASN HD21 1 52 ASP HB3 . . 5.300 4.467 4.107 5.051 . 0 0 "[ . 1 . 2]" 1
715 1 33 ASN HD21 1 53 ALA MB . . 5.500 3.518 2.985 4.247 . 0 0 "[ . 1 . 2]" 1
716 1 33 ASN HD22 1 52 ASP HB3 . . 5.300 4.784 4.040 5.325 0.025 16 0 "[ . 1 . 2]" 1
717 1 33 ASN HD22 1 53 ALA MB . . 5.500 4.346 2.275 5.297 . 0 0 "[ . 1 . 2]" 1
718 1 34 TYR H 1 34 TYR HB2 . . 4.020 2.549 2.486 2.588 . 0 0 "[ . 1 . 2]" 1
719 1 34 TYR H 1 34 TYR QD . . 4.000 2.795 2.438 3.130 . 0 0 "[ . 1 . 2]" 1
720 1 34 TYR H 1 34 TYR QE . . 5.500 4.429 4.133 4.617 . 0 0 "[ . 1 . 2]" 1
721 1 34 TYR H 1 70 GLY H . . 5.500 4.677 4.468 4.973 . 0 0 "[ . 1 . 2]" 1
722 1 34 TYR H 1 73 PHE QE . . 5.500 4.792 4.572 5.052 . 0 0 "[ . 1 . 2]" 1
723 1 34 TYR H 1 93 TYR QE . . 5.500 5.437 5.275 5.589 0.089 10 0 "[ . 1 . 2]" 1
724 1 34 TYR HA 1 34 TYR QD . . 4.310 2.604 2.254 2.981 . 0 0 "[ . 1 . 2]" 1
725 1 34 TYR HA 1 34 TYR QE . . 5.500 4.596 4.424 4.761 . 0 0 "[ . 1 . 2]" 1
726 1 34 TYR HA 1 52 ASP H . . 5.500 4.122 3.801 4.810 . 0 0 "[ . 1 . 2]" 1
727 1 34 TYR HA 1 52 ASP HA . . 5.040 2.973 2.576 3.265 . 0 0 "[ . 1 . 2]" 1
728 1 34 TYR HA 1 93 TYR QE . . 4.520 3.154 2.707 3.386 . 0 0 "[ . 1 . 2]" 1
729 1 34 TYR HB2 1 35 LEU H . . 5.500 4.449 4.409 4.490 . 0 0 "[ . 1 . 2]" 1
730 1 34 TYR HB2 1 94 ASP HA . . 4.250 3.451 3.038 3.747 . 0 0 "[ . 1 . 2]" 1
731 1 34 TYR HB3 1 35 LEU H . . 5.500 4.108 3.999 4.176 . 0 0 "[ . 1 . 2]" 1
732 1 34 TYR HB3 1 92 GLN HA . . 5.500 4.721 3.979 4.965 . 0 0 "[ . 1 . 2]" 1
733 1 34 TYR HB3 1 93 TYR H . . 5.150 3.094 2.752 3.346 . 0 0 "[ . 1 . 2]" 1
734 1 34 TYR HB3 1 93 TYR QD . . 4.200 3.170 3.003 3.378 . 0 0 "[ . 1 . 2]" 1
735 1 34 TYR HB3 1 94 ASP H . . 5.500 4.076 3.489 4.459 . 0 0 "[ . 1 . 2]" 1
736 1 34 TYR HB3 1 94 ASP HA . . 5.260 4.048 3.589 4.364 . 0 0 "[ . 1 . 2]" 1
737 1 34 TYR HB3 1 94 ASP QB . . 5.340 3.709 3.135 3.957 . 0 0 "[ . 1 . 2]" 1
738 1 34 TYR QD 1 35 LEU H . . 5.290 4.629 4.292 4.936 . 0 0 "[ . 1 . 2]" 1
739 1 34 TYR QD 1 93 TYR H . . 5.500 4.857 4.641 5.075 . 0 0 "[ . 1 . 2]" 1
740 1 34 TYR QD 1 94 ASP H . . 4.710 4.567 4.339 4.731 0.021 9 0 "[ . 1 . 2]" 1
741 1 34 TYR QD 1 94 ASP HA . . 4.390 3.311 2.807 3.829 . 0 0 "[ . 1 . 2]" 1
742 1 34 TYR QD 1 94 ASP QB . . 4.200 2.220 1.977 2.639 . 0 0 "[ . 1 . 2]" 1
743 1 35 LEU H 1 35 LEU MD1 . . 5.330 4.165 4.038 4.327 . 0 0 "[ . 1 . 2]" 1
744 1 35 LEU H 1 35 LEU QD . . 4.690 3.800 3.710 3.933 . 0 0 "[ . 1 . 2]" 1
745 1 35 LEU H 1 35 LEU MD2 . . 5.330 4.386 4.290 4.574 . 0 0 "[ . 1 . 2]" 1
746 1 35 LEU H 1 36 ILE H . . 5.500 4.328 4.248 4.389 . 0 0 "[ . 1 . 2]" 1
747 1 35 LEU H 1 52 ASP H . . 5.120 3.522 3.164 4.267 . 0 0 "[ . 1 . 2]" 1
748 1 35 LEU H 1 52 ASP HA . . 4.910 3.131 2.840 3.544 . 0 0 "[ . 1 . 2]" 1
749 1 35 LEU H 1 53 ALA H . . 4.460 3.115 2.782 4.302 . 0 0 "[ . 1 . 2]" 1
750 1 35 LEU H 1 53 ALA HA . . 5.330 3.907 3.195 4.430 . 0 0 "[ . 1 . 2]" 1
751 1 35 LEU H 1 53 ALA MB . . 4.890 2.856 2.554 3.156 . 0 0 "[ . 1 . 2]" 1
752 1 35 LEU H 1 73 PHE QD . . 5.500 5.521 5.304 5.609 0.109 9 0 "[ . 1 . 2]" 1
753 1 35 LEU H 1 92 GLN HA . . 5.500 4.873 4.696 5.029 . 0 0 "[ . 1 . 2]" 1
754 1 35 LEU H 1 93 TYR QE . . 4.280 3.348 3.020 4.128 . 0 0 "[ . 1 . 2]" 1
755 1 35 LEU HA 1 35 LEU MD1 . . 4.600 2.709 2.001 3.144 . 0 0 "[ . 1 . 2]" 1
756 1 35 LEU HA 1 35 LEU QD . . 4.010 2.074 1.994 2.145 . 0 0 "[ . 1 . 2]" 1
757 1 35 LEU HA 1 35 LEU MD2 . . 4.600 2.734 2.097 3.865 . 0 0 "[ . 1 . 2]" 1
758 1 35 LEU HA 1 52 ASP H . . 5.500 5.215 4.887 5.555 0.055 3 0 "[ . 1 . 2]" 1
759 1 35 LEU HA 1 91 GLN H . . 5.500 4.449 4.269 4.728 . 0 0 "[ . 1 . 2]" 1
760 1 35 LEU HB2 1 36 ILE H . . 5.500 4.143 3.988 4.275 . 0 0 "[ . 1 . 2]" 1
761 1 35 LEU HB2 1 37 TRP HE1 . . 5.500 5.265 4.867 5.530 0.030 4 0 "[ . 1 . 2]" 1
762 1 35 LEU HB2 1 53 ALA HA . . 5.490 4.393 4.033 5.061 . 0 0 "[ . 1 . 2]" 1
763 1 35 LEU HB2 1 53 ALA MB . . 4.970 3.177 2.886 3.643 . 0 0 "[ . 1 . 2]" 1
764 1 35 LEU HB3 1 36 ILE H . . 5.010 3.932 3.746 4.045 . 0 0 "[ . 1 . 2]" 1
765 1 35 LEU HB3 1 37 TRP HE1 . . 5.270 3.900 3.445 4.184 . 0 0 "[ . 1 . 2]" 1
766 1 35 LEU HB3 1 53 ALA H . . 5.500 3.549 3.186 4.955 . 0 0 "[ . 1 . 2]" 1
767 1 35 LEU HB3 1 53 ALA HA . . 4.780 2.691 2.311 3.406 . 0 0 "[ . 1 . 2]" 1
768 1 35 LEU HB3 1 53 ALA MB . . 4.340 2.251 1.887 2.671 . 0 0 "[ . 1 . 2]" 1
769 1 35 LEU QD 1 36 ILE H . . 3.820 2.076 1.790 2.461 . 0 0 "[ . 1 . 2]" 1
770 1 35 LEU QD 1 37 TRP HA . . 4.850 3.769 3.414 4.362 . 0 0 "[ . 1 . 2]" 1
771 1 35 LEU QD 1 37 TRP HD1 . . 4.440 3.192 2.884 3.816 . 0 0 "[ . 1 . 2]" 1
772 1 35 LEU QD 1 37 TRP HE3 . . 5.190 4.447 4.168 4.751 . 0 0 "[ . 1 . 2]" 1
773 1 35 LEU QD 1 37 TRP HZ2 . . 4.150 2.967 2.463 3.249 . 0 0 "[ . 1 . 2]" 1
774 1 35 LEU QD 1 50 ILE MG . . 5.320 4.463 4.098 4.957 . 0 0 "[ . 1 . 2]" 1
775 1 35 LEU QD 1 53 ALA H . . 5.230 4.162 3.606 4.837 . 0 0 "[ . 1 . 2]" 1
776 1 35 LEU QD 1 53 ALA HA . . 5.310 3.038 2.601 3.923 . 0 0 "[ . 1 . 2]" 1
777 1 35 LEU QD 1 53 ALA MB . . 4.280 3.271 3.014 3.600 . 0 0 "[ . 1 . 2]" 1
778 1 35 LEU QD 1 73 PHE H . . 5.440 4.965 4.161 5.433 . 0 0 "[ . 1 . 2]" 1
779 1 35 LEU QD 1 73 PHE HB2 . . 4.990 3.097 2.380 3.490 . 0 0 "[ . 1 . 2]" 1
780 1 35 LEU QD 1 73 PHE HB3 . . 4.280 2.928 2.504 3.296 . 0 0 "[ . 1 . 2]" 1
781 1 35 LEU QD 1 73 PHE QD . . 5.440 2.931 2.451 3.257 . 0 0 "[ . 1 . 2]" 1
782 1 35 LEU QD 1 74 THR H . . 5.440 5.310 4.871 5.509 0.069 19 0 "[ . 1 . 2]" 1
783 1 35 LEU QD 1 91 GLN H . . 4.720 2.712 2.550 3.005 . 0 0 "[ . 1 . 2]" 1
784 1 35 LEU QD 1 92 GLN H . . 5.440 3.511 3.323 3.827 . 0 0 "[ . 1 . 2]" 1
785 1 35 LEU QD 1 92 GLN HA . . 4.530 2.779 2.546 3.040 . 0 0 "[ . 1 . 2]" 1
786 1 35 LEU QD 1 92 GLN HB2 . . 5.440 3.798 3.422 4.046 . 0 0 "[ . 1 . 2]" 1
787 1 35 LEU QD 1 93 TYR H . . 5.440 4.435 4.300 4.699 . 0 0 "[ . 1 . 2]" 1
788 1 35 LEU MD1 1 36 ILE H . . 4.360 2.251 2.034 2.484 . 0 0 "[ . 1 . 2]" 1
789 1 35 LEU MD1 1 37 TRP HE1 . . 4.590 3.020 2.072 4.716 0.126 13 0 "[ . 1 . 2]" 1
790 1 35 LEU MD1 1 53 ALA MB . . 4.940 3.834 3.242 4.700 . 0 0 "[ . 1 . 2]" 1
791 1 35 LEU MD1 1 73 PHE HB3 . . 5.090 3.813 2.864 5.101 0.011 13 0 "[ . 1 . 2]" 1
792 1 35 LEU MD1 1 90 CYS HA . . 5.020 3.373 2.906 3.659 . 0 0 "[ . 1 . 2]" 1
793 1 35 LEU MD1 1 90 CYS HB2 . . 4.290 2.023 1.802 2.441 . 0 0 "[ . 1 . 2]" 1
794 1 35 LEU MD1 1 90 CYS HB3 . . 4.510 2.953 2.472 3.450 . 0 0 "[ . 1 . 2]" 1
795 1 35 LEU MD2 1 36 ILE H . . 4.360 2.852 1.898 4.093 . 0 0 "[ . 1 . 2]" 1
796 1 35 LEU MD2 1 37 TRP HE1 . . 4.590 3.804 1.953 4.758 0.168 2 0 "[ . 1 . 2]" 1
797 1 35 LEU MD2 1 53 ALA MB . . 4.940 4.055 3.064 4.875 . 0 0 "[ . 1 . 2]" 1
798 1 35 LEU MD2 1 73 PHE HB3 . . 5.090 3.824 2.511 4.798 . 0 0 "[ . 1 . 2]" 1
799 1 35 LEU MD2 1 90 CYS HA . . 5.020 3.891 3.547 4.367 . 0 0 "[ . 1 . 2]" 1
800 1 35 LEU MD2 1 90 CYS HB2 . . 4.290 2.045 1.857 2.421 . 0 0 "[ . 1 . 2]" 1
801 1 35 LEU MD2 1 90 CYS HB3 . . 4.510 3.257 2.759 3.532 . 0 0 "[ . 1 . 2]" 1
802 1 35 LEU HG 1 36 ILE H . . 4.640 3.723 2.267 4.534 . 0 0 "[ . 1 . 2]" 1
803 1 35 LEU HG 1 90 CYS HB2 . . 5.500 3.367 2.470 3.845 . 0 0 "[ . 1 . 2]" 1
804 1 35 LEU HG 1 90 CYS HB3 . . 5.500 4.472 3.864 4.954 . 0 0 "[ . 1 . 2]" 1
805 1 35 LEU HG 1 91 GLN H . . 5.260 4.729 3.433 5.373 0.113 8 0 "[ . 1 . 2]" 1
806 1 36 ILE H 1 36 ILE MD . . 4.650 3.655 2.262 3.922 . 0 0 "[ . 1 . 2]" 1
807 1 36 ILE H 1 36 ILE HG12 . . 5.500 3.772 3.686 4.333 . 0 0 "[ . 1 . 2]" 1
808 1 36 ILE H 1 36 ILE QG . . 4.760 2.463 2.356 3.140 . 0 0 "[ . 1 . 2]" 1
809 1 36 ILE H 1 36 ILE HG13 . . 5.500 2.498 2.382 3.223 . 0 0 "[ . 1 . 2]" 1
810 1 36 ILE H 1 37 TRP H . . 5.500 4.356 4.253 4.431 . 0 0 "[ . 1 . 2]" 1
811 1 36 ILE H 1 38 TYR QE . . 5.040 4.615 4.396 4.997 . 0 0 "[ . 1 . 2]" 1
812 1 36 ILE H 1 53 ALA MB . . 5.500 5.516 5.270 5.643 0.143 4 0 "[ . 1 . 2]" 1
813 1 36 ILE H 1 92 GLN HA . . 5.140 3.322 3.031 3.562 . 0 0 "[ . 1 . 2]" 1
814 1 36 ILE HA 1 48 LEU QD . . 5.440 4.092 3.882 4.256 . 0 0 "[ . 1 . 2]" 1
815 1 36 ILE HA 1 51 TYR HA . . 4.850 2.040 1.949 2.156 . 0 0 "[ . 1 . 2]" 1
816 1 36 ILE HA 1 52 ASP H . . 5.500 3.703 3.478 3.971 . 0 0 "[ . 1 . 2]" 1
817 1 36 ILE HA 2 96 LEU MD2 . . 5.500 5.483 5.331 5.562 0.062 14 0 "[ . 1 . 2]" 1
818 1 36 ILE HB 1 37 TRP H . . 5.460 3.800 3.690 3.918 . 0 0 "[ . 1 . 2]" 1
819 1 36 ILE HB 1 38 TYR H . . 5.500 5.435 5.292 5.522 0.022 4 0 "[ . 1 . 2]" 1
820 1 36 ILE HB 1 38 TYR QE . . 4.000 2.434 2.079 3.029 . 0 0 "[ . 1 . 2]" 1
821 1 36 ILE HB 1 48 LEU QD . . 4.730 4.458 4.275 4.560 . 0 0 "[ . 1 . 2]" 1
822 1 36 ILE HB 1 51 TYR HA . . 5.500 4.721 4.447 4.895 . 0 0 "[ . 1 . 2]" 1
823 1 36 ILE HB 1 91 GLN H . . 4.560 3.102 2.974 3.338 . 0 0 "[ . 1 . 2]" 1
824 1 36 ILE HB 1 91 GLN HG2 . . 4.960 3.382 1.952 4.147 . 0 0 "[ . 1 . 2]" 1
825 1 36 ILE HB 1 91 GLN HG3 . . 5.020 3.285 2.033 5.078 0.058 18 0 "[ . 1 . 2]" 1
826 1 36 ILE HB 2 98 TYR QD . . 4.830 4.854 4.793 4.883 0.053 18 0 "[ . 1 . 2]" 1
827 1 36 ILE MD 1 37 TRP H . . 5.500 5.010 4.891 5.103 . 0 0 "[ . 1 . 2]" 1
828 1 36 ILE MD 1 51 TYR HA . . 5.070 4.578 4.242 4.816 . 0 0 "[ . 1 . 2]" 1
829 1 36 ILE MD 1 91 GLN H . . 5.250 4.429 3.670 4.646 . 0 0 "[ . 1 . 2]" 1
830 1 36 ILE MD 1 91 GLN HA . . 5.110 5.148 4.332 5.270 0.160 8 0 "[ . 1 . 2]" 1
831 1 36 ILE MD 1 91 GLN QE . . 4.390 3.408 2.250 4.177 . 0 0 "[ . 1 . 2]" 1
832 1 36 ILE MD 1 91 GLN HG3 . . 5.500 2.578 2.146 4.386 . 0 0 "[ . 1 . 2]" 1
833 1 36 ILE MD 1 92 GLN HA . . 5.090 4.160 2.763 4.480 . 0 0 "[ . 1 . 2]" 1
834 1 36 ILE MD 1 93 TYR H . . 5.500 4.233 3.185 4.735 . 0 0 "[ . 1 . 2]" 1
835 1 36 ILE MD 1 93 TYR HB2 . . 5.500 4.024 3.672 4.321 . 0 0 "[ . 1 . 2]" 1
836 1 36 ILE MD 1 93 TYR HB3 . . 5.110 2.824 2.254 3.170 . 0 0 "[ . 1 . 2]" 1
837 1 36 ILE MD 1 93 TYR QD . . 3.760 2.212 1.786 2.582 . 0 0 "[ . 1 . 2]" 1
838 1 36 ILE MD 1 93 TYR QE . . 3.760 3.150 2.863 3.334 . 0 0 "[ . 1 . 2]" 1
839 1 36 ILE MD 2 96 LEU QD . . 4.010 3.255 2.861 4.013 0.003 9 0 "[ . 1 . 2]" 1
840 1 36 ILE MD 2 98 TYR QE . . 4.340 2.335 2.028 2.920 . 0 0 "[ . 1 . 2]" 1
841 1 36 ILE QG 1 51 TYR HA . . 4.710 3.075 2.764 3.360 . 0 0 "[ . 1 . 2]" 1
842 1 36 ILE QG 1 51 TYR HB3 . . 5.340 3.318 3.036 3.833 . 0 0 "[ . 1 . 2]" 1
843 1 36 ILE QG 1 52 ASP H . . 5.340 3.223 2.691 3.541 . 0 0 "[ . 1 . 2]" 1
844 1 36 ILE QG 1 93 TYR QD . . 3.790 2.149 1.915 2.776 . 0 0 "[ . 1 . 2]" 1
845 1 36 ILE QG 1 93 TYR QE . . 3.400 2.334 2.062 2.731 . 0 0 "[ . 1 . 2]" 1
846 1 36 ILE QG 2 98 TYR QD . . 4.390 3.528 2.462 4.034 . 0 0 "[ . 1 . 2]" 1
847 1 36 ILE HG12 1 51 TYR HA . . 5.480 3.207 2.818 4.300 . 0 0 "[ . 1 . 2]" 1
848 1 36 ILE HG12 1 51 TYR HB2 . . 5.500 2.994 2.675 3.630 . 0 0 "[ . 1 . 2]" 1
849 1 36 ILE HG12 1 93 TYR QD . . 4.430 3.242 2.954 3.692 . 0 0 "[ . 1 . 2]" 1
850 1 36 ILE HG12 1 93 TYR QE . . 3.970 2.665 2.311 4.031 0.061 9 0 "[ . 1 . 2]" 1
851 1 36 ILE HG13 1 51 TYR HA . . 5.480 4.190 3.342 4.487 . 0 0 "[ . 1 . 2]" 1
852 1 36 ILE HG13 1 51 TYR HB2 . . 5.500 4.493 3.216 4.999 . 0 0 "[ . 1 . 2]" 1
853 1 36 ILE HG13 1 93 TYR QD . . 4.430 2.183 1.940 2.870 . 0 0 "[ . 1 . 2]" 1
854 1 36 ILE HG13 1 93 TYR QE . . 3.970 2.626 2.183 3.128 . 0 0 "[ . 1 . 2]" 1
855 1 36 ILE MG 1 37 TRP H . . 4.080 2.371 2.144 2.548 . 0 0 "[ . 1 . 2]" 1
856 1 36 ILE MG 1 37 TRP HA . . 5.240 3.912 3.736 4.036 . 0 0 "[ . 1 . 2]" 1
857 1 36 ILE MG 1 38 TYR H . . 5.500 4.477 4.240 4.623 . 0 0 "[ . 1 . 2]" 1
858 1 36 ILE MG 1 38 TYR QD . . 4.240 3.549 3.431 3.702 . 0 0 "[ . 1 . 2]" 1
859 1 36 ILE MG 1 38 TYR QE . . 3.730 2.812 2.671 2.881 . 0 0 "[ . 1 . 2]" 1
860 1 36 ILE MG 1 48 LEU H . . 5.500 5.322 5.048 5.511 0.011 10 0 "[ . 1 . 2]" 1
861 1 36 ILE MG 1 48 LEU HA . . 5.200 3.368 3.137 3.513 . 0 0 "[ . 1 . 2]" 1
862 1 36 ILE MG 1 48 LEU QB . . 5.240 3.475 3.253 3.652 . 0 0 "[ . 1 . 2]" 1
863 1 36 ILE MG 1 48 LEU MD1 . . 3.660 2.502 2.338 2.666 . 0 0 "[ . 1 . 2]" 1
864 1 36 ILE MG 1 48 LEU MD2 . . 3.660 2.637 2.421 2.926 . 0 0 "[ . 1 . 2]" 1
865 1 36 ILE MG 1 48 LEU HG . . 4.210 1.977 1.829 2.079 . 0 0 "[ . 1 . 2]" 1
866 1 36 ILE MG 1 50 ILE H . . 5.270 3.714 3.521 3.909 . 0 0 "[ . 1 . 2]" 1
867 1 36 ILE MG 1 50 ILE MG . . 4.940 4.802 4.596 4.946 0.006 18 0 "[ . 1 . 2]" 1
868 1 36 ILE MG 1 51 TYR H . . 5.030 4.416 4.167 4.635 . 0 0 "[ . 1 . 2]" 1
869 1 36 ILE MG 1 51 TYR HA . . 4.870 2.650 2.073 2.983 . 0 0 "[ . 1 . 2]" 1
870 1 36 ILE MG 1 51 TYR HB2 . . 5.500 3.168 2.867 3.559 . 0 0 "[ . 1 . 2]" 1
871 1 36 ILE MG 1 51 TYR HB3 . . 5.220 2.303 2.027 2.599 . 0 0 "[ . 1 . 2]" 1
872 1 36 ILE MG 1 51 TYR QD . . 4.780 3.968 3.812 4.198 . 0 0 "[ . 1 . 2]" 1
873 1 36 ILE MG 1 52 ASP H . . 5.500 4.185 3.577 4.617 . 0 0 "[ . 1 . 2]" 1
874 1 36 ILE MG 1 53 ALA H . . 5.500 5.168 4.888 5.539 0.039 4 0 "[ . 1 . 2]" 1
875 1 36 ILE MG 1 91 GLN HG2 . . 5.500 4.310 3.431 5.015 . 0 0 "[ . 1 . 2]" 1
876 1 36 ILE MG 2 96 LEU QD . . 5.360 3.805 3.436 4.083 . 0 0 "[ . 1 . 2]" 1
877 1 36 ILE MG 2 96 LEU MD2 . . 4.140 3.896 3.526 4.175 0.035 18 0 "[ . 1 . 2]" 1
878 1 36 ILE MG 2 98 TYR HB2 . . 5.500 3.868 3.605 4.096 . 0 0 "[ . 1 . 2]" 1
879 1 36 ILE MG 2 98 TYR HB3 . . 5.500 5.290 4.998 5.523 0.023 10 0 "[ . 1 . 2]" 1
880 1 36 ILE MG 2 98 TYR QD . . 3.600 3.629 3.430 3.692 0.092 19 0 "[ . 1 . 2]" 1
881 1 37 TRP H 1 37 TRP HD1 . . 4.770 2.976 2.800 3.068 . 0 0 "[ . 1 . 2]" 1
882 1 37 TRP H 1 37 TRP HE3 . . 5.500 5.517 5.472 5.542 0.042 3 0 "[ . 1 . 2]" 1
883 1 37 TRP H 1 38 TYR H . . 5.500 4.372 4.347 4.410 . 0 0 "[ . 1 . 2]" 1
884 1 37 TRP H 1 48 LEU QD . . 4.550 3.815 3.698 3.946 . 0 0 "[ . 1 . 2]" 1
885 1 37 TRP H 1 48 LEU HG . . 5.440 4.174 3.790 4.450 . 0 0 "[ . 1 . 2]" 1
886 1 37 TRP H 1 50 ILE H . . 4.760 2.838 2.592 2.979 . 0 0 "[ . 1 . 2]" 1
887 1 37 TRP H 1 50 ILE HB . . 4.640 3.281 2.974 3.516 . 0 0 "[ . 1 . 2]" 1
888 1 37 TRP H 1 50 ILE HG13 . . 5.500 5.036 4.639 5.335 . 0 0 "[ . 1 . 2]" 1
889 1 37 TRP H 1 51 TYR H . . 5.500 4.682 4.612 4.778 . 0 0 "[ . 1 . 2]" 1
890 1 37 TRP H 1 51 TYR HA . . 5.090 3.334 3.154 3.526 . 0 0 "[ . 1 . 2]" 1
891 1 37 TRP HA 1 37 TRP HD1 . . 4.910 4.125 4.024 4.201 . 0 0 "[ . 1 . 2]" 1
892 1 37 TRP HA 1 37 TRP HE3 . . 4.570 3.186 3.067 3.341 . 0 0 "[ . 1 . 2]" 1
893 1 37 TRP HA 1 38 TYR QE . . 4.850 4.771 4.547 4.899 0.049 18 0 "[ . 1 . 2]" 1
894 1 37 TRP HA 1 91 GLN H . . 5.080 3.671 3.510 3.913 . 0 0 "[ . 1 . 2]" 1
895 1 37 TRP HB2 1 48 LEU QD . . 5.150 4.774 4.616 4.920 . 0 0 "[ . 1 . 2]" 1
896 1 37 TRP HB2 1 50 ILE H . . 5.280 2.465 2.387 2.613 . 0 0 "[ . 1 . 2]" 1
897 1 37 TRP HB2 1 50 ILE HB . . 4.860 2.071 1.924 2.209 . 0 0 "[ . 1 . 2]" 1
898 1 37 TRP HB2 1 50 ILE MG . . 4.860 3.750 3.551 3.893 . 0 0 "[ . 1 . 2]" 1
899 1 37 TRP HB2 1 75 PHE QE . . 4.870 3.402 3.221 3.547 . 0 0 "[ . 1 . 2]" 1
900 1 37 TRP HB3 1 37 TRP HE3 . . 4.160 2.490 2.427 2.558 . 0 0 "[ . 1 . 2]" 1
901 1 37 TRP HB3 1 37 TRP HZ3 . . 5.080 4.886 4.843 4.938 . 0 0 "[ . 1 . 2]" 1
902 1 37 TRP HB3 1 50 ILE H . . 5.500 3.840 3.744 4.016 . 0 0 "[ . 1 . 2]" 1
903 1 37 TRP HB3 1 50 ILE HB . . 4.770 3.658 3.482 3.786 . 0 0 "[ . 1 . 2]" 1
904 1 37 TRP HB3 1 50 ILE MD . . 5.140 4.077 3.666 4.283 . 0 0 "[ . 1 . 2]" 1
905 1 37 TRP HB3 1 50 ILE MG . . 5.500 5.014 4.823 5.142 . 0 0 "[ . 1 . 2]" 1
906 1 37 TRP HB3 1 75 PHE QE . . 4.930 3.274 3.082 3.504 . 0 0 "[ . 1 . 2]" 1
907 1 37 TRP HD1 1 50 ILE H . . 5.500 4.244 4.072 4.405 . 0 0 "[ . 1 . 2]" 1
908 1 37 TRP HD1 1 50 ILE HB . . 3.640 2.229 1.921 2.436 . 0 0 "[ . 1 . 2]" 1
909 1 37 TRP HD1 1 50 ILE MD . . 4.330 3.620 3.187 3.959 . 0 0 "[ . 1 . 2]" 1
910 1 37 TRP HD1 1 50 ILE MG . . 3.400 2.587 2.454 2.733 . 0 0 "[ . 1 . 2]" 1
911 1 37 TRP HD1 1 51 TYR H . . 4.750 4.806 4.754 4.851 0.101 4 0 "[ . 1 . 2]" 1
912 1 37 TRP HD1 1 51 TYR HA . . 5.500 4.172 3.924 4.432 . 0 0 "[ . 1 . 2]" 1
913 1 37 TRP HD1 1 53 ALA H . . 5.500 4.361 4.159 4.963 . 0 0 "[ . 1 . 2]" 1
914 1 37 TRP HD1 1 75 PHE QE . . 4.930 4.955 4.930 4.982 0.052 1 0 "[ . 1 . 2]" 1
915 1 37 TRP HE1 1 50 ILE HB . . 5.500 4.507 4.314 4.698 . 0 0 "[ . 1 . 2]" 1
916 1 37 TRP HE1 1 50 ILE MG . . 5.500 3.915 3.725 4.105 . 0 0 "[ . 1 . 2]" 1
917 1 37 TRP HE1 1 73 PHE HB2 . . 5.500 4.283 4.108 4.536 . 0 0 "[ . 1 . 2]" 1
918 1 37 TRP HE1 1 73 PHE HB3 . . 5.500 3.054 2.698 3.319 . 0 0 "[ . 1 . 2]" 1
919 1 37 TRP HE1 1 74 THR H . . 5.500 5.009 4.620 5.523 0.023 14 0 "[ . 1 . 2]" 1
920 1 37 TRP HE3 1 38 TYR H . . 5.170 3.776 3.530 4.005 . 0 0 "[ . 1 . 2]" 1
921 1 37 TRP HE3 1 89 TYR H . . 4.730 3.849 3.528 4.171 . 0 0 "[ . 1 . 2]" 1
922 1 37 TRP HE3 1 89 TYR HA . . 4.840 4.167 3.856 4.884 0.044 4 0 "[ . 1 . 2]" 1
923 1 37 TRP HE3 1 90 CYS H . . 5.090 4.835 4.639 5.088 . 0 0 "[ . 1 . 2]" 1
924 1 37 TRP HE3 1 90 CYS HA . . 5.500 3.911 3.739 4.194 . 0 0 "[ . 1 . 2]" 1
925 1 37 TRP HE3 1 90 CYS HB2 . . 5.500 4.782 4.552 5.164 . 0 0 "[ . 1 . 2]" 1
926 1 37 TRP HE3 1 90 CYS HB3 . . 5.500 3.217 3.052 3.523 . 0 0 "[ . 1 . 2]" 1
927 1 37 TRP HH2 1 73 PHE HB3 . . 5.110 4.410 4.253 4.626 . 0 0 "[ . 1 . 2]" 1
928 1 37 TRP HH2 1 74 THR HA . . 4.770 4.202 3.986 4.593 . 0 0 "[ . 1 . 2]" 1
929 1 37 TRP HH2 1 75 PHE H . . 4.950 3.797 3.482 4.109 . 0 0 "[ . 1 . 2]" 1
930 1 37 TRP HH2 1 75 PHE HB3 . . 5.120 3.542 3.377 3.868 . 0 0 "[ . 1 . 2]" 1
931 1 37 TRP HZ2 1 73 PHE HB3 . . 4.270 2.193 2.021 2.434 . 0 0 "[ . 1 . 2]" 1
932 1 37 TRP HZ2 1 74 THR H . . 4.320 3.899 3.692 4.258 . 0 0 "[ . 1 . 2]" 1
933 1 37 TRP HZ2 1 74 THR HA . . 4.330 4.103 3.839 4.375 0.045 13 0 "[ . 1 . 2]" 1
934 1 37 TRP HZ2 1 75 PHE H . . 5.500 4.168 3.912 4.514 . 0 0 "[ . 1 . 2]" 1
935 1 37 TRP HZ2 1 75 PHE HB2 . . 4.350 3.299 3.191 3.545 . 0 0 "[ . 1 . 2]" 1
936 1 37 TRP HZ2 1 75 PHE HB3 . . 4.780 4.482 4.310 4.725 . 0 0 "[ . 1 . 2]" 1
937 1 37 TRP HZ3 1 90 CYS H . . 5.470 4.807 4.469 5.174 . 0 0 "[ . 1 . 2]" 1
938 1 37 TRP HZ3 1 90 CYS HA . . 5.500 5.029 4.786 5.482 . 0 0 "[ . 1 . 2]" 1
939 1 37 TRP HZ3 1 90 CYS HB2 . . 5.500 4.898 4.628 5.067 . 0 0 "[ . 1 . 2]" 1
940 1 37 TRP HZ3 1 90 CYS HB3 . . 5.500 3.211 2.960 3.452 . 0 0 "[ . 1 . 2]" 1
941 1 38 TYR H 1 38 TYR QD . . 4.620 2.777 2.516 2.937 . 0 0 "[ . 1 . 2]" 1
942 1 38 TYR H 1 38 TYR QE . . 5.360 4.711 4.502 4.934 . 0 0 "[ . 1 . 2]" 1
943 1 38 TYR H 1 39 GLN H . . 5.500 4.404 4.274 4.491 . 0 0 "[ . 1 . 2]" 1
944 1 38 TYR H 1 49 LEU QD . . 5.440 5.015 4.429 5.326 . 0 0 "[ . 1 . 2]" 1
945 1 38 TYR H 1 88 TYR HA . . 4.740 4.660 4.488 4.789 0.049 18 0 "[ . 1 . 2]" 1
946 1 38 TYR H 1 89 TYR H . . 4.620 3.037 2.815 3.177 . 0 0 "[ . 1 . 2]" 1
947 1 38 TYR H 1 90 CYS HA . . 5.500 3.353 3.062 3.603 . 0 0 "[ . 1 . 2]" 1
948 1 38 TYR H 1 91 GLN H . . 5.500 4.805 4.509 5.048 . 0 0 "[ . 1 . 2]" 1
949 1 38 TYR H 1 91 GLN HB3 . . 5.500 5.458 4.966 5.690 0.190 5 0 "[ . 1 . 2]" 1
950 1 38 TYR HA 1 38 TYR QD . . 3.920 2.962 2.810 3.066 . 0 0 "[ . 1 . 2]" 1
951 1 38 TYR HA 1 47 LYS HB3 . . 5.500 4.884 4.656 5.207 . 0 0 "[ . 1 . 2]" 1
952 1 38 TYR HA 1 48 LEU HA . . 5.070 2.629 2.559 2.716 . 0 0 "[ . 1 . 2]" 1
953 1 38 TYR HA 1 48 LEU QB . . 4.610 4.670 4.617 4.731 0.121 14 0 "[ . 1 . 2]" 1
954 1 38 TYR HA 1 49 LEU MD1 . . 5.490 4.677 3.679 5.161 . 0 0 "[ . 1 . 2]" 1
955 1 38 TYR HA 1 49 LEU QD . . 4.820 4.054 3.492 4.341 . 0 0 "[ . 1 . 2]" 1
956 1 38 TYR HA 1 49 LEU MD2 . . 5.490 4.526 4.311 4.786 . 0 0 "[ . 1 . 2]" 1
957 1 38 TYR HA 1 50 ILE H . . 5.500 4.241 4.033 4.452 . 0 0 "[ . 1 . 2]" 1
958 1 38 TYR HB2 1 39 GLN H . . 4.690 3.541 3.431 3.657 . 0 0 "[ . 1 . 2]" 1
959 1 38 TYR HB2 1 46 PRO HB2 . . 5.500 3.454 2.889 4.340 . 0 0 "[ . 1 . 2]" 1
960 1 38 TYR HB2 1 46 PRO HB3 . . 5.360 3.602 2.610 4.403 . 0 0 "[ . 1 . 2]" 1
961 1 38 TYR HB2 1 47 LYS H . . 5.370 4.857 4.615 5.001 . 0 0 "[ . 1 . 2]" 1
962 1 38 TYR HB2 1 89 TYR H . . 5.500 3.875 3.376 4.323 . 0 0 "[ . 1 . 2]" 1
963 1 38 TYR HB2 2 100 PHE QE . . 4.730 4.764 4.450 4.828 0.098 17 0 "[ . 1 . 2]" 1
964 1 38 TYR HB3 1 39 GLN H . . 5.490 2.441 2.306 2.600 . 0 0 "[ . 1 . 2]" 1
965 1 38 TYR HB3 1 46 PRO HB2 . . 5.500 2.603 2.072 3.470 . 0 0 "[ . 1 . 2]" 1
966 1 38 TYR HB3 1 46 PRO HB3 . . 5.440 3.195 2.277 3.923 . 0 0 "[ . 1 . 2]" 1
967 1 38 TYR HB3 1 47 LYS H . . 5.500 3.290 3.104 3.400 . 0 0 "[ . 1 . 2]" 1
968 1 38 TYR HB3 1 47 LYS HA . . 4.620 4.631 4.320 4.740 0.120 12 0 "[ . 1 . 2]" 1
969 1 38 TYR HB3 2 100 PHE QE . . 4.780 3.973 3.647 4.269 . 0 0 "[ . 1 . 2]" 1
970 1 38 TYR QD 1 39 GLN H . . 5.280 3.833 3.605 4.031 . 0 0 "[ . 1 . 2]" 1
971 1 38 TYR QD 1 46 PRO HB2 . . 4.400 3.183 2.766 3.480 . 0 0 "[ . 1 . 2]" 1
972 1 38 TYR QD 1 47 LYS H . . 4.040 4.022 3.777 4.117 0.077 9 0 "[ . 1 . 2]" 1
973 1 38 TYR QD 1 47 LYS QG . . 4.630 4.702 4.651 4.753 0.123 4 0 "[ . 1 . 2]" 1
974 1 38 TYR QD 1 48 LEU H . . 4.050 3.010 2.864 3.165 . 0 0 "[ . 1 . 2]" 1
975 1 38 TYR QD 1 48 LEU HA . . 4.840 2.240 1.923 2.513 . 0 0 "[ . 1 . 2]" 1
976 1 38 TYR QD 1 48 LEU QB . . 4.020 2.956 2.842 3.070 . 0 0 "[ . 1 . 2]" 1
977 1 38 TYR QD 1 48 LEU QD . . 4.290 4.073 3.935 4.189 . 0 0 "[ . 1 . 2]" 1
978 1 38 TYR QE 1 46 PRO HB2 . . 5.500 4.585 3.960 5.102 . 0 0 "[ . 1 . 2]" 1
979 1 38 TYR QE 1 48 LEU H . . 4.450 3.816 3.617 4.066 . 0 0 "[ . 1 . 2]" 1
980 1 38 TYR QE 1 48 LEU HA . . 5.500 3.262 3.091 3.454 . 0 0 "[ . 1 . 2]" 1
981 1 38 TYR QE 1 48 LEU QB . . 4.930 2.194 2.090 2.439 . 0 0 "[ . 1 . 2]" 1
982 1 38 TYR QE 1 48 LEU MD1 . . 4.620 2.973 2.800 3.203 . 0 0 "[ . 1 . 2]" 1
983 1 38 TYR QE 1 48 LEU QD . . 3.360 2.930 2.767 3.144 . 0 0 "[ . 1 . 2]" 1
984 1 38 TYR QE 1 48 LEU MD2 . . 4.620 4.442 4.216 4.610 . 0 0 "[ . 1 . 2]" 1
985 1 38 TYR QE 1 90 CYS HA . . 4.540 4.519 4.205 4.624 0.084 16 0 "[ . 1 . 2]" 1
986 1 38 TYR QE 1 91 GLN H . . 3.260 3.388 3.308 3.456 0.196 19 0 "[ . 1 . 2]" 1
987 1 38 TYR QE 1 91 GLN HB2 . . 5.500 3.031 1.998 4.105 . 0 0 "[ . 1 . 2]" 1
988 1 38 TYR QE 1 91 GLN HB3 . . 5.500 2.068 1.720 2.810 . 0 0 "[ . 1 . 2]" 1
989 1 38 TYR QE 1 91 GLN QE . . 4.460 4.227 3.298 4.700 0.240 11 0 "[ . 1 . 2]" 1
990 1 38 TYR QE 1 91 GLN HG2 . . 4.880 2.385 1.740 3.666 . 0 0 "[ . 1 . 2]" 1
991 1 38 TYR QE 1 91 GLN HG3 . . 3.780 3.017 1.924 4.011 0.231 18 0 "[ . 1 . 2]" 1
992 1 38 TYR QE 2 98 TYR HB2 . . 4.420 4.059 3.806 4.250 . 0 0 "[ . 1 . 2]" 1
993 1 39 GLN H 1 46 PRO HA . . 4.900 4.194 3.666 4.697 . 0 0 "[ . 1 . 2]" 1
994 1 39 GLN H 1 46 PRO HB3 . . 5.500 4.643 3.901 5.084 . 0 0 "[ . 1 . 2]" 1
995 1 39 GLN H 1 47 LYS HB2 . . 5.420 4.805 4.566 5.100 . 0 0 "[ . 1 . 2]" 1
996 1 39 GLN H 1 47 LYS HB3 . . 5.280 3.342 3.137 3.669 . 0 0 "[ . 1 . 2]" 1
997 1 39 GLN H 1 49 LEU MD1 . . 4.890 4.465 3.542 4.902 0.012 7 0 "[ . 1 . 2]" 1
998 1 39 GLN H 1 49 LEU QD . . 4.290 3.942 3.332 4.253 . 0 0 "[ . 1 . 2]" 1
999 1 39 GLN H 1 49 LEU MD2 . . 4.890 4.440 4.055 4.666 . 0 0 "[ . 1 . 2]" 1
1000 1 39 GLN H 1 88 TYR HA . . 5.500 5.080 4.782 5.421 . 0 0 "[ . 1 . 2]" 1
1001 1 39 GLN H 1 88 TYR QD . . 5.500 4.849 4.537 5.205 . 0 0 "[ . 1 . 2]" 1
1002 1 39 GLN HA 1 49 LEU QD . . 5.290 4.310 3.809 4.782 . 0 0 "[ . 1 . 2]" 1
1003 1 39 GLN HA 1 86 ALA MB . . 4.980 3.460 3.144 3.945 . 0 0 "[ . 1 . 2]" 1
1004 1 39 GLN HA 1 88 TYR HA . . 4.500 2.568 2.101 2.900 . 0 0 "[ . 1 . 2]" 1
1005 1 39 GLN HA 1 88 TYR QD . . 4.630 3.305 2.737 3.605 . 0 0 "[ . 1 . 2]" 1
1006 1 39 GLN HA 1 89 TYR H . . 5.250 3.742 3.219 4.096 . 0 0 "[ . 1 . 2]" 1
1007 1 39 GLN HB2 1 40 GLN H . . 5.250 3.434 2.811 4.310 . 0 0 "[ . 1 . 2]" 1
1008 1 39 GLN HB2 1 49 LEU QD . . 4.610 3.531 2.385 4.200 . 0 0 "[ . 1 . 2]" 1
1009 1 39 GLN HB2 1 86 ALA MB . . 5.500 2.567 1.988 4.371 . 0 0 "[ . 1 . 2]" 1
1010 1 39 GLN HB2 1 88 TYR HA . . 5.480 4.449 3.787 4.756 . 0 0 "[ . 1 . 2]" 1
1011 1 39 GLN HB2 1 88 TYR QD . . 5.500 3.860 2.821 4.307 . 0 0 "[ . 1 . 2]" 1
1012 1 39 GLN HB2 1 88 TYR QE . . 4.030 3.102 2.051 3.636 . 0 0 "[ . 1 . 2]" 1
1013 1 39 GLN HB3 1 40 GLN H . . 5.500 4.261 3.996 4.441 . 0 0 "[ . 1 . 2]" 1
1014 1 39 GLN HB3 1 49 LEU MD1 . . 4.700 3.260 2.057 4.142 . 0 0 "[ . 1 . 2]" 1
1015 1 39 GLN HB3 1 49 LEU QD . . 4.140 2.567 2.046 3.098 . 0 0 "[ . 1 . 2]" 1
1016 1 39 GLN HB3 1 49 LEU MD2 . . 4.700 3.162 2.434 3.956 . 0 0 "[ . 1 . 2]" 1
1017 1 39 GLN HB3 1 86 ALA MB . . 4.730 3.773 3.222 4.764 0.034 12 0 "[ . 1 . 2]" 1
1018 1 39 GLN HB3 1 88 TYR QD . . 4.310 3.322 2.521 4.428 0.118 13 0 "[ . 1 . 2]" 1
1019 1 39 GLN HB3 1 88 TYR QE . . 3.910 2.478 2.107 3.739 . 0 0 "[ . 1 . 2]" 1
1020 1 39 GLN QE 1 41 LYS QE . . 4.530 3.285 2.258 4.543 0.013 5 0 "[ . 1 . 2]" 1
1021 1 39 GLN QE 1 49 LEU QD . . 4.400 2.783 1.939 3.585 . 0 0 "[ . 1 . 2]" 1
1022 1 39 GLN QE 1 86 ALA MB . . 4.300 2.909 2.221 3.585 . 0 0 "[ . 1 . 2]" 1
1023 1 39 GLN QE 1 88 TYR QE . . 3.840 2.801 2.030 3.855 0.015 19 0 "[ . 1 . 2]" 1
1024 1 39 GLN QE 1 88 TYR HH . . 4.390 2.817 2.024 3.201 . 0 0 "[ . 1 . 2]" 1
1025 1 39 GLN HE21 1 88 TYR HH . . 5.090 3.015 2.178 3.848 . 0 0 "[ . 1 . 2]" 1
1026 1 39 GLN HE22 1 88 TYR HH . . 5.090 3.485 2.403 3.876 . 0 0 "[ . 1 . 2]" 1
1027 1 39 GLN QG 1 40 GLN H . . 4.870 3.903 3.144 4.239 . 0 0 "[ . 1 . 2]" 1
1028 1 39 GLN QG 1 49 LEU QD . . 5.390 2.992 2.137 3.860 . 0 0 "[ . 1 . 2]" 1
1029 1 39 GLN QG 1 86 ALA MB . . 3.340 3.218 2.163 3.423 0.083 6 0 "[ . 1 . 2]" 1
1030 1 39 GLN QG 1 88 TYR HH . . 5.500 5.186 4.026 5.590 0.090 17 0 "[ . 1 . 2]" 1
1031 1 40 GLN H 1 40 GLN HG2 . . 5.500 4.273 2.874 4.679 . 0 0 "[ . 1 . 2]" 1
1032 1 40 GLN H 1 40 GLN HG3 . . 5.500 4.517 4.037 4.745 . 0 0 "[ . 1 . 2]" 1
1033 1 40 GLN H 1 41 LYS H . . 4.960 4.133 3.981 4.309 . 0 0 "[ . 1 . 2]" 1
1034 1 40 GLN H 1 86 ALA HA . . 5.500 4.959 4.552 5.361 . 0 0 "[ . 1 . 2]" 1
1035 1 40 GLN H 1 86 ALA MB . . 4.170 2.754 2.424 3.096 . 0 0 "[ . 1 . 2]" 1
1036 1 40 GLN H 1 87 THR H . . 4.700 3.114 2.801 3.369 . 0 0 "[ . 1 . 2]" 1
1037 1 40 GLN H 1 87 THR HA . . 5.040 4.671 4.505 4.841 . 0 0 "[ . 1 . 2]" 1
1038 1 40 GLN H 1 87 THR HB . . 5.330 3.386 2.994 3.677 . 0 0 "[ . 1 . 2]" 1
1039 1 40 GLN H 1 87 THR MG . . 5.500 4.310 4.028 4.422 . 0 0 "[ . 1 . 2]" 1
1040 1 40 GLN H 1 88 TYR QD . . 5.500 4.779 4.494 5.011 . 0 0 "[ . 1 . 2]" 1
1041 1 40 GLN HA 1 46 PRO HA . . 4.480 2.574 1.976 3.729 . 0 0 "[ . 1 . 2]" 1
1042 1 40 GLN QB 1 41 LYS H . . 4.800 3.803 3.524 3.910 . 0 0 "[ . 1 . 2]" 1
1043 1 40 GLN QB 1 87 THR H . . 5.500 3.023 2.573 3.589 . 0 0 "[ . 1 . 2]" 1
1044 1 40 GLN QB 1 87 THR HB . . 5.260 2.036 1.820 2.513 . 0 0 "[ . 1 . 2]" 1
1045 1 40 GLN QB 1 87 THR MG . . 5.500 3.307 2.892 3.655 . 0 0 "[ . 1 . 2]" 1
1046 1 40 GLN QE 1 45 ALA HA . . 4.580 2.901 2.413 3.416 . 0 0 "[ . 1 . 2]" 1
1047 1 40 GLN QE 1 45 ALA MB . . 4.810 4.059 3.744 4.267 . 0 0 "[ . 1 . 2]" 1
1048 1 40 GLN QE 1 46 PRO QD . . 4.300 2.298 1.635 3.271 . 0 0 "[ . 1 . 2]" 1
1049 1 40 GLN QE 1 46 PRO QG . . 4.760 3.271 2.113 4.268 . 0 0 "[ . 1 . 2]" 1
1050 1 40 GLN HE21 1 45 ALA HA . . 5.380 3.844 3.048 5.064 . 0 0 "[ . 1 . 2]" 1
1051 1 40 GLN HE21 1 45 ALA MB . . 5.500 4.862 4.259 5.549 0.049 7 0 "[ . 1 . 2]" 1
1052 1 40 GLN HE21 1 46 PRO HB2 . . 5.500 4.620 3.900 5.613 0.113 1 0 "[ . 1 . 2]" 1
1053 1 40 GLN HE21 1 46 PRO HD2 . . 5.500 4.328 3.354 5.507 0.007 6 0 "[ . 1 . 2]" 1
1054 1 40 GLN HE21 1 46 PRO HD3 . . 5.500 2.944 1.663 4.318 . 0 0 "[ . 1 . 2]" 1
1055 1 40 GLN HE22 1 45 ALA HA . . 5.380 3.142 2.461 4.134 . 0 0 "[ . 1 . 2]" 1
1056 1 40 GLN HE22 1 45 ALA MB . . 5.500 4.473 3.912 5.313 . 0 0 "[ . 1 . 2]" 1
1057 1 40 GLN HE22 1 46 PRO HB2 . . 5.500 5.353 4.197 5.631 0.131 12 0 "[ . 1 . 2]" 1
1058 1 40 GLN HE22 1 46 PRO HD2 . . 5.500 4.222 3.391 4.751 . 0 0 "[ . 1 . 2]" 1
1059 1 40 GLN HE22 1 46 PRO HD3 . . 5.500 2.828 1.965 3.524 . 0 0 "[ . 1 . 2]" 1
1060 1 40 GLN QG 1 87 THR H . . 5.340 4.591 3.751 5.058 . 0 0 "[ . 1 . 2]" 1
1061 1 40 GLN QG 1 87 THR MG . . 5.340 4.075 3.386 4.932 . 0 0 "[ . 1 . 2]" 1
1062 1 40 GLN HG2 1 41 LYS H . . 5.500 4.583 3.532 5.082 . 0 0 "[ . 1 . 2]" 1
1063 1 40 GLN HG3 1 41 LYS H . . 5.500 4.566 3.170 5.542 0.042 3 0 "[ . 1 . 2]" 1
1064 1 41 LYS H 1 41 LYS HB2 . . 3.990 2.469 2.313 2.767 . 0 0 "[ . 1 . 2]" 1
1065 1 41 LYS H 1 41 LYS QD . . 5.320 3.896 2.185 4.887 . 0 0 "[ . 1 . 2]" 1
1066 1 41 LYS H 1 41 LYS QG . . 4.740 2.897 2.406 4.050 . 0 0 "[ . 1 . 2]" 1
1067 1 41 LYS H 1 42 PRO HD3 . . 5.500 4.502 4.265 5.042 . 0 0 "[ . 1 . 2]" 1
1068 1 41 LYS H 1 44 GLN H . . 5.500 4.518 4.035 4.917 . 0 0 "[ . 1 . 2]" 1
1069 1 41 LYS H 1 44 GLN QG . . 5.500 3.193 2.329 4.890 . 0 0 "[ . 1 . 2]" 1
1070 1 41 LYS H 1 46 PRO HA . . 5.500 3.718 2.898 5.303 . 0 0 "[ . 1 . 2]" 1
1071 1 41 LYS H 1 87 THR H . . 5.500 5.071 4.695 5.560 0.060 3 0 "[ . 1 . 2]" 1
1072 1 41 LYS HA 1 41 LYS QD . . 4.300 3.762 2.068 4.280 . 0 0 "[ . 1 . 2]" 1
1073 1 41 LYS HA 1 41 LYS HE2 . . 5.500 4.921 4.104 5.599 0.099 5 0 "[ . 1 . 2]" 1
1074 1 41 LYS HA 1 41 LYS HE3 . . 5.500 4.986 4.128 5.755 0.255 17 0 "[ . 1 . 2]" 1
1075 1 41 LYS HB2 1 42 PRO HD2 . . 5.300 4.523 4.029 4.908 . 0 0 "[ . 1 . 2]" 1
1076 1 41 LYS HB2 1 42 PRO HD3 . . 5.500 4.877 4.546 5.232 . 0 0 "[ . 1 . 2]" 1
1077 1 41 LYS HB2 1 44 GLN H . . 5.500 4.215 3.703 5.541 0.041 3 0 "[ . 1 . 2]" 1
1078 1 41 LYS HB2 1 44 GLN QG . . 4.780 2.637 1.944 4.056 . 0 0 "[ . 1 . 2]" 1
1079 1 41 LYS HB2 1 86 ALA MB . . 5.500 4.332 3.372 4.815 . 0 0 "[ . 1 . 2]" 1
1080 1 41 LYS HB3 1 42 PRO HD2 . . 4.280 3.422 2.695 4.355 0.075 3 0 "[ . 1 . 2]" 1
1081 1 41 LYS HB3 1 42 PRO HD3 . . 4.670 4.239 3.741 4.708 0.038 3 0 "[ . 1 . 2]" 1
1082 1 41 LYS QD 1 44 GLN HE21 . . 5.500 3.348 2.041 5.541 0.041 15 0 "[ . 1 . 2]" 1
1083 1 41 LYS QD 1 44 GLN QG . . 5.500 3.884 3.163 4.653 . 0 0 "[ . 1 . 2]" 1
1084 1 41 LYS QE 1 86 ALA MB . . 4.200 3.194 2.352 4.261 0.061 16 0 "[ . 1 . 2]" 1
1085 1 41 LYS HE2 1 86 ALA MB . . 4.890 3.614 2.555 5.022 0.132 16 0 "[ . 1 . 2]" 1
1086 1 41 LYS HE3 1 86 ALA MB . . 4.890 3.737 2.645 4.606 . 0 0 "[ . 1 . 2]" 1
1087 1 41 LYS QG 1 42 PRO HD2 . . 5.500 3.785 2.517 4.934 . 0 0 "[ . 1 . 2]" 1
1088 1 41 LYS QG 1 42 PRO HD3 . . 4.840 4.208 3.593 4.820 . 0 0 "[ . 1 . 2]" 1
1089 1 41 LYS QG 1 44 GLN HE21 . . 5.500 3.651 1.958 5.507 0.007 9 0 "[ . 1 . 2]" 1
1090 1 44 GLN H 1 44 GLN HB3 . . 4.150 3.034 2.415 3.269 . 0 0 "[ . 1 . 2]" 1
1091 1 44 GLN H 1 44 GLN QG . . 3.910 2.452 2.056 3.944 0.034 18 0 "[ . 1 . 2]" 1
1092 1 44 GLN H 1 45 ALA H . . 5.070 4.430 4.386 4.529 . 0 0 "[ . 1 . 2]" 1
1093 1 44 GLN HA 1 45 ALA MB . . 5.000 4.105 3.972 4.165 . 0 0 "[ . 1 . 2]" 1
1094 1 44 GLN HB2 1 45 ALA H . . 3.870 2.537 2.261 3.923 0.053 18 0 "[ . 1 . 2]" 1
1095 1 44 GLN HB3 1 45 ALA H . . 4.600 3.758 3.588 3.850 . 0 0 "[ . 1 . 2]" 1
1096 1 44 GLN HE22 1 47 LYS HD2 . . 5.500 4.600 3.052 5.550 0.050 17 0 "[ . 1 . 2]" 1
1097 1 44 GLN HE22 1 47 LYS HD3 . . 5.500 4.382 3.441 5.512 0.012 10 0 "[ . 1 . 2]" 1
1098 1 44 GLN QG 1 45 ALA H . . 4.820 3.290 2.083 3.560 . 0 0 "[ . 1 . 2]" 1
1099 1 45 ALA H 1 45 ALA MB . . 3.660 2.226 2.168 2.298 . 0 0 "[ . 1 . 2]" 1
1100 1 45 ALA H 1 46 PRO QD . . 5.350 4.440 4.390 4.486 . 0 0 "[ . 1 . 2]" 1
1101 1 45 ALA HA 1 46 PRO QG . . 5.110 4.063 3.914 4.219 . 0 0 "[ . 1 . 2]" 1
1102 1 45 ALA HA 2 89 TYR QE . . 4.010 3.741 2.875 4.045 0.035 3 0 "[ . 1 . 2]" 1
1103 1 45 ALA MB 1 46 PRO QD . . 4.040 2.033 1.866 2.213 . 0 0 "[ . 1 . 2]" 1
1104 1 45 ALA MB 1 46 PRO QG . . 4.390 3.556 3.188 3.932 . 0 0 "[ . 1 . 2]" 1
1105 1 45 ALA MB 2 89 TYR QE . . 3.670 3.483 2.454 3.757 0.087 8 0 "[ . 1 . 2]" 1
1106 1 45 ALA MB 2 100 PHE H . . 5.470 4.566 3.962 5.358 . 0 0 "[ . 1 . 2]" 1
1107 1 45 ALA MB 2 100 PHE HB2 . . 4.430 2.791 2.202 3.395 . 0 0 "[ . 1 . 2]" 1
1108 1 45 ALA MB 2 100 PHE HB3 . . 4.380 3.543 2.932 4.014 . 0 0 "[ . 1 . 2]" 1
1109 1 45 ALA MB 2 100 PHE QD . . 4.420 3.576 2.905 4.388 . 0 0 "[ . 1 . 2]" 1
1110 1 45 ALA MB 2 101 GLY H . . 5.500 5.320 4.803 5.637 0.137 18 0 "[ . 1 . 2]" 1
1111 1 45 ALA MB 2 102 GLN HA . . 4.290 3.154 2.094 4.055 . 0 0 "[ . 1 . 2]" 1
1112 1 45 ALA MB 2 102 GLN QB . . 5.340 2.064 1.738 3.284 . 0 0 "[ . 1 . 2]" 1
1113 1 45 ALA MB 2 102 GLN QG . . 5.420 2.959 1.972 4.204 . 0 0 "[ . 1 . 2]" 1
1114 1 46 PRO HB2 2 100 PHE QD . . 4.690 3.983 2.926 4.654 . 0 0 "[ . 1 . 2]" 1
1115 1 46 PRO HB2 2 100 PHE QE . . 4.690 2.829 2.070 3.345 . 0 0 "[ . 1 . 2]" 1
1116 1 46 PRO HB3 2 100 PHE QD . . 5.500 5.279 4.567 5.616 0.116 9 0 "[ . 1 . 2]" 1
1117 1 46 PRO HB3 2 100 PHE QE . . 5.180 4.354 3.552 4.756 . 0 0 "[ . 1 . 2]" 1
1118 1 46 PRO QD 2 100 PHE QD . . 5.350 3.649 3.171 4.157 . 0 0 "[ . 1 . 2]" 1
1119 1 46 PRO QG 1 47 LYS H . . 5.030 4.620 4.338 4.877 . 0 0 "[ . 1 . 2]" 1
1120 1 46 PRO QG 2 100 PHE HZ . . 4.550 3.518 3.143 4.088 . 0 0 "[ . 1 . 2]" 1
1121 1 46 PRO HG2 2 100 PHE QE . . 5.500 2.996 2.398 3.574 . 0 0 "[ . 1 . 2]" 1
1122 1 46 PRO HG2 2 100 PHE HZ . . 5.170 3.685 3.279 4.444 . 0 0 "[ . 1 . 2]" 1
1123 1 46 PRO HG3 2 100 PHE QE . . 5.500 4.197 3.777 4.772 . 0 0 "[ . 1 . 2]" 1
1124 1 46 PRO HG3 2 100 PHE HZ . . 5.170 4.559 3.932 5.201 0.031 4 0 "[ . 1 . 2]" 1
1125 1 47 LYS H 1 47 LYS QD . . 5.230 4.426 4.236 4.666 . 0 0 "[ . 1 . 2]" 1
1126 1 47 LYS HA 1 47 LYS HD2 . . 5.230 3.445 1.957 4.355 . 0 0 "[ . 1 . 2]" 1
1127 1 47 LYS HA 1 47 LYS HD3 . . 5.230 4.067 3.104 4.684 . 0 0 "[ . 1 . 2]" 1
1128 1 47 LYS HA 1 47 LYS HE2 . . 5.500 5.209 4.639 5.501 0.001 12 0 "[ . 1 . 2]" 1
1129 1 47 LYS HB2 1 47 LYS HD2 . . 2.830 2.622 2.416 2.877 0.047 4 0 "[ . 1 . 2]" 1
1130 1 47 LYS HB2 1 47 LYS HD3 . . 2.830 2.713 2.367 2.919 0.089 14 0 "[ . 1 . 2]" 1
1131 1 47 LYS HB2 1 47 LYS HE3 . . 4.510 4.388 4.260 4.542 0.032 17 0 "[ . 1 . 2]" 1
1132 1 47 LYS HB3 1 47 LYS HD2 . . 4.080 3.346 3.024 3.738 . 0 0 "[ . 1 . 2]" 1
1133 1 47 LYS HB3 1 47 LYS QD . . 3.360 2.716 2.243 3.317 . 0 0 "[ . 1 . 2]" 1
1134 1 47 LYS HB3 1 47 LYS HD3 . . 4.080 2.919 2.312 3.708 . 0 0 "[ . 1 . 2]" 1
1135 1 47 LYS HB3 1 47 LYS HE3 . . 5.500 4.664 4.590 4.822 . 0 0 "[ . 1 . 2]" 1
1136 1 47 LYS HE2 1 48 LEU H . . 5.500 5.077 4.569 5.441 . 0 0 "[ . 1 . 2]" 1
1137 1 47 LYS HE3 1 48 LEU H . . 5.500 4.654 3.278 5.510 0.010 15 0 "[ . 1 . 2]" 1
1138 1 47 LYS HE3 1 49 LEU QD . . 4.980 4.320 2.447 5.017 0.037 13 0 "[ . 1 . 2]" 1
1139 1 47 LYS HE3 1 57 GLU QG . . 5.340 4.536 2.766 5.362 0.022 20 0 "[ . 1 . 2]" 1
1140 1 47 LYS HE3 1 60 VAL MG2 . . 5.370 4.203 2.972 4.909 . 0 0 "[ . 1 . 2]" 1
1141 1 47 LYS QG 1 49 LEU QD . . 4.850 3.246 2.213 3.748 . 0 0 "[ . 1 . 2]" 1
1142 1 47 LYS HG2 1 48 LEU H . . 4.850 3.647 2.993 4.644 . 0 0 "[ . 1 . 2]" 1
1143 1 47 LYS HG3 1 48 LEU H . . 4.850 2.988 2.761 3.286 . 0 0 "[ . 1 . 2]" 1
1144 1 48 LEU H 1 48 LEU QB . . 3.790 2.193 2.163 2.218 . 0 0 "[ . 1 . 2]" 1
1145 1 48 LEU H 1 48 LEU MD1 . . 4.920 4.197 4.150 4.225 . 0 0 "[ . 1 . 2]" 1
1146 1 48 LEU H 1 48 LEU QD . . 4.290 3.734 3.682 3.753 . 0 0 "[ . 1 . 2]" 1
1147 1 48 LEU H 1 48 LEU MD2 . . 4.920 4.187 4.116 4.223 . 0 0 "[ . 1 . 2]" 1
1148 1 48 LEU H 1 48 LEU HG . . 5.310 4.489 4.434 4.521 . 0 0 "[ . 1 . 2]" 1
1149 1 48 LEU H 1 57 GLU QG . . 5.340 5.126 4.660 5.385 0.045 7 0 "[ . 1 . 2]" 1
1150 1 48 LEU HA 1 48 LEU MD1 . . 4.800 3.854 3.815 3.896 . 0 0 "[ . 1 . 2]" 1
1151 1 48 LEU HA 1 48 LEU QD . . 4.160 2.905 2.841 2.998 . 0 0 "[ . 1 . 2]" 1
1152 1 48 LEU HA 1 48 LEU MD2 . . 4.800 3.006 2.920 3.135 . 0 0 "[ . 1 . 2]" 1
1153 1 48 LEU HA 1 49 LEU HA . . 5.030 4.338 4.295 4.383 . 0 0 "[ . 1 . 2]" 1
1154 1 48 LEU HA 1 50 ILE H . . 5.220 4.070 3.846 4.282 . 0 0 "[ . 1 . 2]" 1
1155 1 48 LEU QD 1 50 ILE H . . 4.360 2.862 2.686 3.027 . 0 0 "[ . 1 . 2]" 1
1156 1 48 LEU QD 1 50 ILE HA . . 4.150 3.304 3.190 3.425 . 0 0 "[ . 1 . 2]" 1
1157 1 48 LEU QD 1 51 TYR H . . 4.200 3.431 3.189 3.599 . 0 0 "[ . 1 . 2]" 1
1158 1 48 LEU QD 1 51 TYR HA . . 5.440 3.546 3.224 3.754 . 0 0 "[ . 1 . 2]" 1
1159 1 48 LEU QD 1 51 TYR HB2 . . 4.400 3.246 2.929 3.543 . 0 0 "[ . 1 . 2]" 1
1160 1 48 LEU QD 1 51 TYR HB3 . . 3.770 1.962 1.773 2.210 . 0 0 "[ . 1 . 2]" 1
1161 1 48 LEU QD 1 51 TYR QD . . 3.180 1.832 1.768 1.882 . 0 0 "[ . 1 . 2]" 1
1162 1 48 LEU QD 1 51 TYR QE . . 3.340 3.368 3.296 3.452 0.112 3 0 "[ . 1 . 2]" 1
1163 1 48 LEU QD 1 52 ASP H . . 5.350 4.831 4.387 5.095 . 0 0 "[ . 1 . 2]" 1
1164 1 48 LEU QD 1 57 GLU H . . 4.850 3.656 3.440 3.798 . 0 0 "[ . 1 . 2]" 1
1165 1 48 LEU QD 1 57 GLU HA . . 5.200 3.942 3.586 4.140 . 0 0 "[ . 1 . 2]" 1
1166 1 48 LEU QD 1 57 GLU HB2 . . 4.460 2.081 1.876 2.188 . 0 0 "[ . 1 . 2]" 1
1167 1 48 LEU QD 1 57 GLU HB3 . . 3.740 2.972 2.551 3.254 . 0 0 "[ . 1 . 2]" 1
1168 1 48 LEU QD 1 57 GLU QG . . 3.990 2.545 1.995 2.974 . 0 0 "[ . 1 . 2]" 1
1169 1 48 LEU QD 1 58 THR H . . 5.440 5.046 4.683 5.295 . 0 0 "[ . 1 . 2]" 1
1170 1 48 LEU QD 1 60 VAL MG2 . . 4.980 3.671 3.305 3.890 . 0 0 "[ . 1 . 2]" 1
1171 1 48 LEU QD 2 96 LEU HA . . 5.300 4.300 4.027 4.604 . 0 0 "[ . 1 . 2]" 1
1172 1 48 LEU QD 2 96 LEU HB3 . . 5.100 4.305 4.010 4.713 . 0 0 "[ . 1 . 2]" 1
1173 1 48 LEU QD 2 96 LEU QD . . 4.280 2.900 2.595 3.346 . 0 0 "[ . 1 . 2]" 1
1174 1 48 LEU QD 2 96 LEU MD2 . . 4.150 2.940 2.625 3.409 . 0 0 "[ . 1 . 2]" 1
1175 1 48 LEU QD 2 97 PRO HA . . 4.460 2.936 2.612 3.319 . 0 0 "[ . 1 . 2]" 1
1176 1 48 LEU QD 2 97 PRO QB . . 4.090 2.201 2.029 2.413 . 0 0 "[ . 1 . 2]" 1
1177 1 48 LEU QD 2 97 PRO HD2 . . 5.440 5.382 5.177 5.501 0.061 15 0 "[ . 1 . 2]" 1
1178 1 48 LEU QD 2 97 PRO QG . . 4.850 3.746 3.548 3.882 . 0 0 "[ . 1 . 2]" 1
1179 1 48 LEU QD 2 98 TYR H . . 4.090 2.194 1.978 2.421 . 0 0 "[ . 1 . 2]" 1
1180 1 48 LEU QD 2 98 TYR HA . . 5.440 4.153 3.941 4.344 . 0 0 "[ . 1 . 2]" 1
1181 1 48 LEU QD 2 98 TYR HB2 . . 5.050 2.692 2.119 3.001 . 0 0 "[ . 1 . 2]" 1
1182 1 48 LEU QD 2 98 TYR HB3 . . 5.440 4.078 3.634 4.368 . 0 0 "[ . 1 . 2]" 1
1183 1 48 LEU QD 2 98 TYR QD . . 4.440 3.638 2.984 3.899 . 0 0 "[ . 1 . 2]" 1
1184 1 48 LEU MD1 1 51 TYR HB2 . . 5.130 3.654 3.118 4.071 . 0 0 "[ . 1 . 2]" 1
1185 1 48 LEU MD1 1 51 TYR HB3 . . 4.540 2.595 2.048 2.977 . 0 0 "[ . 1 . 2]" 1
1186 1 48 LEU MD1 2 97 PRO HA . . 5.500 2.982 2.643 3.389 . 0 0 "[ . 1 . 2]" 1
1187 1 48 LEU MD2 1 51 TYR HB2 . . 5.130 3.651 3.531 3.896 . 0 0 "[ . 1 . 2]" 1
1188 1 48 LEU MD2 1 51 TYR HB3 . . 4.540 2.038 1.913 2.289 . 0 0 "[ . 1 . 2]" 1
1189 1 48 LEU MD2 2 97 PRO HA . . 5.500 4.422 4.097 4.761 . 0 0 "[ . 1 . 2]" 1
1190 1 48 LEU HG 1 50 ILE H . . 4.710 4.262 3.778 4.512 . 0 0 "[ . 1 . 2]" 1
1191 1 48 LEU HG 1 51 TYR QD . . 4.760 4.221 4.085 4.307 . 0 0 "[ . 1 . 2]" 1
1192 1 49 LEU H 1 49 LEU MD1 . . 4.720 4.117 3.957 4.220 . 0 0 "[ . 1 . 2]" 1
1193 1 49 LEU H 1 49 LEU MD2 . . 4.720 4.128 3.608 4.391 . 0 0 "[ . 1 . 2]" 1
1194 1 49 LEU H 1 50 ILE H . . 4.070 2.204 2.107 2.313 . 0 0 "[ . 1 . 2]" 1
1195 1 49 LEU HA 1 49 LEU MD1 . . 4.450 2.573 1.983 3.839 . 0 0 "[ . 1 . 2]" 1
1196 1 49 LEU HA 1 49 LEU QD . . 3.490 2.022 1.960 2.069 . 0 0 "[ . 1 . 2]" 1
1197 1 49 LEU HA 1 49 LEU MD2 . . 4.450 3.300 1.966 3.891 . 0 0 "[ . 1 . 2]" 1
1198 1 49 LEU HA 1 57 GLU H . . 4.890 4.255 3.965 4.543 . 0 0 "[ . 1 . 2]" 1
1199 1 49 LEU HA 1 57 GLU HB2 . . 5.500 4.356 3.912 4.731 . 0 0 "[ . 1 . 2]" 1
1200 1 49 LEU HA 1 57 GLU HB3 . . 5.500 3.398 2.884 3.716 . 0 0 "[ . 1 . 2]" 1
1201 1 49 LEU HA 1 60 VAL MG1 . . 4.950 3.422 2.812 3.791 . 0 0 "[ . 1 . 2]" 1
1202 1 49 LEU HA 1 60 VAL MG2 . . 3.890 2.224 1.868 2.570 . 0 0 "[ . 1 . 2]" 1
1203 1 49 LEU QB 1 50 ILE H . . 4.270 2.325 2.144 2.553 . 0 0 "[ . 1 . 2]" 1
1204 1 49 LEU QB 1 75 PHE HZ . . 4.720 4.164 3.703 4.468 . 0 0 "[ . 1 . 2]" 1
1205 1 49 LEU QB 1 88 TYR QD . . 4.350 4.351 4.198 4.509 0.159 11 0 "[ . 1 . 2]" 1
1206 1 49 LEU QD 1 57 GLU QG . . 5.280 5.017 4.393 5.381 0.101 14 0 "[ . 1 . 2]" 1
1207 1 49 LEU QD 1 60 VAL H . . 5.440 4.967 4.864 5.135 . 0 0 "[ . 1 . 2]" 1
1208 1 49 LEU QD 1 60 VAL HB . . 5.210 4.088 3.932 4.358 . 0 0 "[ . 1 . 2]" 1
1209 1 49 LEU QD 1 60 VAL MG1 . . 3.780 2.059 1.904 2.406 . 0 0 "[ . 1 . 2]" 1
1210 1 49 LEU QD 1 60 VAL MG2 . . 3.670 1.994 1.872 2.276 . 0 0 "[ . 1 . 2]" 1
1211 1 49 LEU QD 1 64 PHE QD . . 3.940 2.733 2.412 3.338 . 0 0 "[ . 1 . 2]" 1
1212 1 49 LEU QD 1 64 PHE QE . . 3.810 3.028 2.707 3.699 . 0 0 "[ . 1 . 2]" 1
1213 1 49 LEU QD 1 75 PHE HZ . . 3.940 2.253 1.949 2.817 . 0 0 "[ . 1 . 2]" 1
1214 1 49 LEU QD 1 88 TYR QD . . 3.720 3.105 2.591 3.511 . 0 0 "[ . 1 . 2]" 1
1215 1 49 LEU QD 1 88 TYR QE . . 3.540 2.000 1.789 2.380 . 0 0 "[ . 1 . 2]" 1
1216 1 49 LEU MD1 1 60 VAL HA . . 5.500 3.907 3.124 5.508 0.008 16 0 "[ . 1 . 2]" 1
1217 1 49 LEU MD1 1 61 PRO HD2 . . 5.500 3.669 2.686 5.194 . 0 0 "[ . 1 . 2]" 1
1218 1 49 LEU MD1 1 64 PHE QE . . 4.450 3.393 3.023 3.938 . 0 0 "[ . 1 . 2]" 1
1219 1 49 LEU MD2 1 60 VAL HA . . 5.500 4.906 3.337 5.554 0.054 12 0 "[ . 1 . 2]" 1
1220 1 49 LEU MD2 1 61 PRO HD2 . . 5.500 4.474 3.279 5.093 . 0 0 "[ . 1 . 2]" 1
1221 1 49 LEU MD2 1 64 PHE QE . . 4.450 3.486 2.929 4.490 0.040 3 0 "[ . 1 . 2]" 1
1222 1 50 ILE H 1 50 ILE MD . . 4.600 4.191 4.047 4.293 . 0 0 "[ . 1 . 2]" 1
1223 1 50 ILE H 1 50 ILE HG12 . . 5.500 3.951 3.784 4.132 . 0 0 "[ . 1 . 2]" 1
1224 1 50 ILE H 1 50 ILE HG13 . . 5.500 2.955 2.800 3.140 . 0 0 "[ . 1 . 2]" 1
1225 1 50 ILE H 1 51 TYR H . . 5.500 4.297 4.219 4.333 . 0 0 "[ . 1 . 2]" 1
1226 1 50 ILE H 1 60 VAL MG2 . . 5.500 4.474 4.301 4.619 . 0 0 "[ . 1 . 2]" 1
1227 1 50 ILE HA 1 50 ILE MD . . 4.700 3.818 3.785 3.838 . 0 0 "[ . 1 . 2]" 1
1228 1 50 ILE HA 1 51 TYR QD . . 4.330 3.908 3.580 4.192 . 0 0 "[ . 1 . 2]" 1
1229 1 50 ILE HA 1 56 LEU HA . . 4.250 2.493 2.285 2.723 . 0 0 "[ . 1 . 2]" 1
1230 1 50 ILE HA 1 57 GLU H . . 4.960 2.839 2.702 3.079 . 0 0 "[ . 1 . 2]" 1
1231 1 50 ILE HB 1 50 ILE MD . . 3.550 2.453 2.403 2.489 . 0 0 "[ . 1 . 2]" 1
1232 1 50 ILE HB 1 50 ILE HG13 . . 2.840 2.435 2.402 2.501 . 0 0 "[ . 1 . 2]" 1
1233 1 50 ILE HB 1 75 PHE QE . . 4.040 3.706 3.408 4.057 0.017 7 0 "[ . 1 . 2]" 1
1234 1 50 ILE MD 1 50 ILE MG . . 2.400 1.860 1.814 1.898 . 0 0 "[ . 1 . 2]" 1
1235 1 50 ILE MD 1 51 TYR H . . 4.810 4.856 4.826 4.882 0.072 11 0 "[ . 1 . 2]" 1
1236 1 50 ILE MD 1 56 LEU HG . . 4.240 3.542 2.723 4.306 0.066 9 0 "[ . 1 . 2]" 1
1237 1 50 ILE MD 1 64 PHE HB2 . . 5.090 3.003 2.605 3.772 . 0 0 "[ . 1 . 2]" 1
1238 1 50 ILE MD 1 65 SER H . . 4.740 2.927 2.288 3.342 . 0 0 "[ . 1 . 2]" 1
1239 1 50 ILE MD 1 65 SER HA . . 3.960 2.657 2.352 3.284 . 0 0 "[ . 1 . 2]" 1
1240 1 50 ILE MD 1 65 SER QB . . 4.990 3.974 3.837 4.064 . 0 0 "[ . 1 . 2]" 1
1241 1 50 ILE MD 1 66 GLY H . . 4.060 2.510 2.326 2.830 . 0 0 "[ . 1 . 2]" 1
1242 1 50 ILE MD 1 66 GLY HA3 . . 4.550 2.571 1.914 2.870 . 0 0 "[ . 1 . 2]" 1
1243 1 50 ILE MD 1 67 SER H . . 5.380 4.917 4.382 5.215 . 0 0 "[ . 1 . 2]" 1
1244 1 50 ILE MD 1 75 PHE QE . . 3.640 2.189 2.046 2.416 . 0 0 "[ . 1 . 2]" 1
1245 1 50 ILE MD 1 75 PHE HZ . . 4.240 4.063 3.925 4.243 0.003 4 0 "[ . 1 . 2]" 1
1246 1 50 ILE HG12 1 51 TYR H . . 5.410 4.328 4.189 4.466 . 0 0 "[ . 1 . 2]" 1
1247 1 50 ILE HG12 1 56 LEU HA . . 4.820 2.733 2.424 3.155 . 0 0 "[ . 1 . 2]" 1
1248 1 50 ILE HG12 1 57 GLU H . . 5.500 3.929 3.700 4.270 . 0 0 "[ . 1 . 2]" 1
1249 1 50 ILE HG12 1 75 PHE QE . . 4.250 4.202 4.008 4.288 0.038 14 0 "[ . 1 . 2]" 1
1250 1 50 ILE HG13 1 51 TYR H . . 5.500 5.036 4.939 5.130 . 0 0 "[ . 1 . 2]" 1
1251 1 50 ILE HG13 1 56 LEU HA . . 5.300 4.228 3.887 4.651 . 0 0 "[ . 1 . 2]" 1
1252 1 50 ILE HG13 1 65 SER HA . . 5.450 5.316 4.888 5.585 0.135 11 0 "[ . 1 . 2]" 1
1253 1 50 ILE HG13 1 66 GLY H . . 5.500 5.513 5.309 5.605 0.105 9 0 "[ . 1 . 2]" 1
1254 1 50 ILE MG 1 51 TYR H . . 3.510 2.415 2.296 2.498 . 0 0 "[ . 1 . 2]" 1
1255 1 50 ILE MG 1 51 TYR QD . . 5.500 4.691 4.587 4.785 . 0 0 "[ . 1 . 2]" 1
1256 1 50 ILE MG 1 53 ALA H . . 5.080 3.537 3.109 3.881 . 0 0 "[ . 1 . 2]" 1
1257 1 50 ILE MG 1 54 SER H . . 4.650 3.616 2.650 4.121 . 0 0 "[ . 1 . 2]" 1
1258 1 50 ILE MG 1 54 SER QB . . 5.300 4.466 4.219 5.041 . 0 0 "[ . 1 . 2]" 1
1259 1 50 ILE MG 1 55 THR H . . 3.930 2.926 2.598 3.514 . 0 0 "[ . 1 . 2]" 1
1260 1 50 ILE MG 1 55 THR HA . . 5.350 3.945 3.681 4.340 . 0 0 "[ . 1 . 2]" 1
1261 1 50 ILE MG 1 55 THR HB . . 5.400 4.229 4.055 4.418 . 0 0 "[ . 1 . 2]" 1
1262 1 50 ILE MG 1 56 LEU HA . . 4.260 2.925 2.727 3.186 . 0 0 "[ . 1 . 2]" 1
1263 1 50 ILE MG 1 56 LEU HB3 . . 5.290 4.929 4.678 5.136 . 0 0 "[ . 1 . 2]" 1
1264 1 50 ILE MG 1 57 GLU H . . 4.900 4.375 4.132 4.566 . 0 0 "[ . 1 . 2]" 1
1265 1 50 ILE MG 1 65 SER QB . . 5.130 5.175 4.992 5.241 0.111 16 0 "[ . 1 . 2]" 1
1266 1 50 ILE MG 1 66 GLY HA2 . . 4.850 4.091 3.665 4.482 . 0 0 "[ . 1 . 2]" 1
1267 1 50 ILE MG 1 66 GLY HA3 . . 4.760 2.609 2.174 3.108 . 0 0 "[ . 1 . 2]" 1
1268 1 51 TYR H 1 51 TYR QD . . 3.930 3.167 2.944 3.334 . 0 0 "[ . 1 . 2]" 1
1269 1 51 TYR H 1 51 TYR QE . . 4.460 4.476 4.346 4.574 0.114 11 0 "[ . 1 . 2]" 1
1270 1 51 TYR H 1 54 SER H . . 5.500 5.077 3.914 5.552 0.052 7 0 "[ . 1 . 2]" 1
1271 1 51 TYR H 1 55 THR HB . . 4.750 3.564 3.355 3.833 . 0 0 "[ . 1 . 2]" 1
1272 1 51 TYR H 1 56 LEU HA . . 5.350 3.566 3.423 3.722 . 0 0 "[ . 1 . 2]" 1
1273 1 51 TYR H 1 56 LEU QD . . 5.380 4.562 4.231 4.843 . 0 0 "[ . 1 . 2]" 1
1274 1 51 TYR H 1 57 GLU H . . 5.500 4.085 3.947 4.225 . 0 0 "[ . 1 . 2]" 1
1275 1 51 TYR H 1 57 GLU HA . . 5.500 5.288 5.043 5.504 0.004 17 0 "[ . 1 . 2]" 1
1276 1 51 TYR H 1 60 VAL MG2 . . 5.500 5.570 5.533 5.610 0.110 3 0 "[ . 1 . 2]" 1
1277 1 51 TYR HA 1 51 TYR QD . . 4.250 3.771 3.731 3.806 . 0 0 "[ . 1 . 2]" 1
1278 1 51 TYR HA 1 53 ALA H . . 5.460 3.064 2.899 3.888 . 0 0 "[ . 1 . 2]" 1
1279 1 51 TYR HB2 1 52 ASP H . . 4.620 2.323 2.019 2.606 . 0 0 "[ . 1 . 2]" 1
1280 1 51 TYR HB2 1 53 ALA H . . 5.500 4.470 4.264 4.887 . 0 0 "[ . 1 . 2]" 1
1281 1 51 TYR HB2 2 96 LEU MD1 . . 5.350 3.348 2.772 3.712 . 0 0 "[ . 1 . 2]" 1
1282 1 51 TYR HB2 2 96 LEU QD . . 5.440 2.569 2.250 2.830 . 0 0 "[ . 1 . 2]" 1
1283 1 51 TYR HB2 2 96 LEU MD2 . . 4.860 2.686 2.281 3.026 . 0 0 "[ . 1 . 2]" 1
1284 1 51 TYR HB3 1 52 ASP H . . 5.030 3.709 3.527 3.885 . 0 0 "[ . 1 . 2]" 1
1285 1 51 TYR HB3 1 57 GLU HB2 . . 4.750 4.629 4.410 4.788 0.038 17 0 "[ . 1 . 2]" 1
1286 1 51 TYR HB3 2 96 LEU MD1 . . 5.440 4.449 3.879 4.946 . 0 0 "[ . 1 . 2]" 1
1287 1 51 TYR HB3 2 96 LEU QD . . 5.440 3.220 2.884 3.556 . 0 0 "[ . 1 . 2]" 1
1288 1 51 TYR HB3 2 96 LEU MD2 . . 4.800 3.308 2.975 3.675 . 0 0 "[ . 1 . 2]" 1
1289 1 51 TYR QD 1 52 ASP H . . 4.170 3.109 2.666 3.458 . 0 0 "[ . 1 . 2]" 1
1290 1 51 TYR QD 1 52 ASP HB3 . . 3.950 3.093 2.822 3.271 . 0 0 "[ . 1 . 2]" 1
1291 1 51 TYR QD 1 55 THR H . . 5.500 4.710 4.424 5.058 . 0 0 "[ . 1 . 2]" 1
1292 1 51 TYR QD 1 55 THR HB . . 5.500 3.215 2.771 3.625 . 0 0 "[ . 1 . 2]" 1
1293 1 51 TYR QD 1 55 THR MG . . 4.890 3.781 3.588 4.163 . 0 0 "[ . 1 . 2]" 1
1294 1 51 TYR QD 1 57 GLU H . . 5.500 3.981 3.714 4.384 . 0 0 "[ . 1 . 2]" 1
1295 1 51 TYR QD 1 57 GLU HB2 . . 4.130 2.487 2.219 2.679 . 0 0 "[ . 1 . 2]" 1
1296 1 51 TYR QD 1 57 GLU HB3 . . 4.290 4.147 3.880 4.322 0.032 18 0 "[ . 1 . 2]" 1
1297 1 51 TYR QD 2 96 LEU HB3 . . 4.820 4.126 3.467 4.500 . 0 0 "[ . 1 . 2]" 1
1298 1 51 TYR QD 2 96 LEU MD1 . . 4.250 2.370 2.074 2.756 . 0 0 "[ . 1 . 2]" 1
1299 1 51 TYR QD 2 96 LEU QD . . 3.500 2.299 1.984 2.654 . 0 0 "[ . 1 . 2]" 1
1300 1 51 TYR QD 2 96 LEU MD2 . . 4.250 3.130 2.514 3.594 . 0 0 "[ . 1 . 2]" 1
1301 1 51 TYR QE 1 52 ASP HB2 . . 5.220 3.459 3.199 3.816 . 0 0 "[ . 1 . 2]" 1
1302 1 51 TYR QE 1 52 ASP HB3 . . 4.110 4.119 3.888 4.205 0.095 3 0 "[ . 1 . 2]" 1
1303 1 51 TYR QE 1 55 THR MG . . 4.160 2.687 2.331 3.165 . 0 0 "[ . 1 . 2]" 1
1304 1 51 TYR QE 1 57 GLU H . . 4.890 4.051 3.768 4.469 . 0 0 "[ . 1 . 2]" 1
1305 1 51 TYR QE 1 57 GLU HA . . 3.630 2.091 1.913 2.644 . 0 0 "[ . 1 . 2]" 1
1306 1 51 TYR QE 1 57 GLU HB2 . . 3.770 2.773 2.360 3.235 . 0 0 "[ . 1 . 2]" 1
1307 1 51 TYR QE 1 57 GLU HB3 . . 5.500 4.189 3.841 4.499 . 0 0 "[ . 1 . 2]" 1
1308 1 51 TYR QE 1 58 THR H . . 5.390 3.716 3.266 4.137 . 0 0 "[ . 1 . 2]" 1
1309 1 51 TYR QE 2 96 LEU HB2 . . 5.500 4.524 3.697 5.216 . 0 0 "[ . 1 . 2]" 1
1310 1 51 TYR QE 2 96 LEU HB3 . . 5.500 3.903 2.929 4.426 . 0 0 "[ . 1 . 2]" 1
1311 1 51 TYR QE 2 96 LEU MD1 . . 4.260 2.745 2.379 3.376 . 0 0 "[ . 1 . 2]" 1
1312 1 51 TYR QE 2 96 LEU QD . . 3.690 2.701 2.358 3.278 . 0 0 "[ . 1 . 2]" 1
1313 1 51 TYR QE 2 96 LEU MD2 . . 4.670 4.057 3.617 4.450 . 0 0 "[ . 1 . 2]" 1
1314 1 51 TYR QE 2 97 PRO HA . . 5.500 4.656 3.979 5.079 . 0 0 "[ . 1 . 2]" 1
1315 1 51 TYR QE 2 97 PRO QB . . 4.180 3.541 2.474 3.965 . 0 0 "[ . 1 . 2]" 1
1316 1 51 TYR QE 2 97 PRO HD3 . . 4.890 4.867 3.918 4.963 0.073 10 0 "[ . 1 . 2]" 1
1317 1 52 ASP H 1 53 ALA H . . 4.540 2.588 2.433 3.446 . 0 0 "[ . 1 . 2]" 1
1318 1 52 ASP H 1 53 ALA HA . . 5.500 4.686 4.599 4.834 . 0 0 "[ . 1 . 2]" 1
1319 1 52 ASP H 1 93 TYR QE . . 4.170 2.771 2.480 3.707 . 0 0 "[ . 1 . 2]" 1
1320 1 52 ASP H 2 96 LEU MD1 . . 5.500 4.031 3.607 4.651 . 0 0 "[ . 1 . 2]" 1
1321 1 52 ASP H 2 96 LEU MD2 . . 5.500 4.059 3.276 4.518 . 0 0 "[ . 1 . 2]" 1
1322 1 52 ASP HA 1 53 ALA MB . . 5.500 3.952 3.761 4.229 . 0 0 "[ . 1 . 2]" 1
1323 1 52 ASP HA 1 93 TYR QE . . 4.770 3.600 2.887 4.576 . 0 0 "[ . 1 . 2]" 1
1324 1 52 ASP HB2 1 53 ALA H . . 5.500 4.375 3.625 4.563 . 0 0 "[ . 1 . 2]" 1
1325 1 52 ASP HB2 1 54 SER H . . 5.500 4.831 4.486 5.122 . 0 0 "[ . 1 . 2]" 1
1326 1 52 ASP HB2 1 55 THR H . . 4.830 4.420 4.229 4.743 . 0 0 "[ . 1 . 2]" 1
1327 1 52 ASP HB2 1 55 THR HB . . 4.980 3.392 3.065 3.983 . 0 0 "[ . 1 . 2]" 1
1328 1 52 ASP HB2 1 55 THR MG . . 5.500 4.357 4.024 5.088 . 0 0 "[ . 1 . 2]" 1
1329 1 52 ASP HB3 1 53 ALA H . . 5.500 3.694 2.258 3.981 . 0 0 "[ . 1 . 2]" 1
1330 1 52 ASP HB3 1 54 SER H . . 4.930 3.283 2.816 3.671 . 0 0 "[ . 1 . 2]" 1
1331 1 52 ASP HB3 1 55 THR H . . 3.800 2.782 2.601 3.048 . 0 0 "[ . 1 . 2]" 1
1332 1 53 ALA H 1 54 SER H . . 3.630 3.137 2.122 3.569 . 0 0 "[ . 1 . 2]" 1
1333 1 53 ALA MB 1 54 SER H . . 4.240 2.865 2.364 3.627 . 0 0 "[ . 1 . 2]" 1
1334 1 53 ALA MB 1 54 SER QB . . 5.340 3.686 3.078 4.172 . 0 0 "[ . 1 . 2]" 1
1335 1 53 ALA MB 1 68 GLY H . . 5.500 3.376 2.534 3.954 . 0 0 "[ . 1 . 2]" 1
1336 1 53 ALA MB 1 68 GLY QA . . 5.340 3.759 3.006 4.327 . 0 0 "[ . 1 . 2]" 1
1337 1 53 ALA MB 1 69 SER H . . 5.500 4.699 4.063 5.175 . 0 0 "[ . 1 . 2]" 1
1338 1 53 ALA MB 1 69 SER HA . . 5.370 3.445 2.801 4.432 . 0 0 "[ . 1 . 2]" 1
1339 1 53 ALA MB 1 69 SER QB . . 5.480 4.156 3.035 5.162 . 0 0 "[ . 1 . 2]" 1
1340 1 53 ALA MB 1 70 GLY H . . 5.500 4.592 4.338 5.261 . 0 0 "[ . 1 . 2]" 1
1341 1 53 ALA MB 1 73 PHE QD . . 4.150 2.194 1.932 2.519 . 0 0 "[ . 1 . 2]" 1
1342 1 53 ALA MB 1 73 PHE QE . . 4.980 2.492 2.079 3.338 . 0 0 "[ . 1 . 2]" 1
1343 1 54 SER H 1 55 THR H . . 3.670 2.216 1.735 2.419 . 0 0 "[ . 1 . 2]" 1
1344 1 54 SER H 1 55 THR HB . . 5.500 4.323 3.973 4.608 . 0 0 "[ . 1 . 2]" 1
1345 1 54 SER H 1 68 GLY H . . 5.500 5.468 4.833 5.579 0.079 20 0 "[ . 1 . 2]" 1
1346 1 55 THR H 1 55 THR HB . . 4.050 2.550 2.426 2.631 . 0 0 "[ . 1 . 2]" 1
1347 1 55 THR H 1 55 THR MG . . 4.560 3.803 3.702 3.841 . 0 0 "[ . 1 . 2]" 1
1348 1 55 THR H 1 56 LEU H . . 5.300 4.419 4.266 4.488 . 0 0 "[ . 1 . 2]" 1
1349 1 55 THR HA 1 55 THR MG . . 3.590 2.374 2.315 2.447 . 0 0 "[ . 1 . 2]" 1
1350 1 55 THR HA 1 56 LEU H . . 3.370 2.152 2.094 2.226 . 0 0 "[ . 1 . 2]" 1
1351 1 55 THR HB 1 56 LEU H . . 5.430 4.220 4.124 4.341 . 0 0 "[ . 1 . 2]" 1
1352 1 55 THR MG 1 56 LEU H . . 3.720 2.748 2.604 2.997 . 0 0 "[ . 1 . 2]" 1
1353 1 55 THR MG 1 56 LEU HA . . 5.500 4.070 3.949 4.196 . 0 0 "[ . 1 . 2]" 1
1354 1 55 THR MG 1 56 LEU HB2 . . 5.460 4.278 4.067 4.520 . 0 0 "[ . 1 . 2]" 1
1355 1 56 LEU H 1 56 LEU HB2 . . 3.780 2.421 2.352 2.486 . 0 0 "[ . 1 . 2]" 1
1356 1 56 LEU H 1 56 LEU HB3 . . 4.040 3.611 3.589 3.647 . 0 0 "[ . 1 . 2]" 1
1357 1 56 LEU H 1 56 LEU MD1 . . 4.820 2.979 2.228 3.892 . 0 0 "[ . 1 . 2]" 1
1358 1 56 LEU H 1 56 LEU QD . . 3.870 2.703 2.216 3.249 . 0 0 "[ . 1 . 2]" 1
1359 1 56 LEU H 1 56 LEU MD2 . . 4.820 3.753 3.283 4.071 . 0 0 "[ . 1 . 2]" 1
1360 1 56 LEU H 1 56 LEU HG . . 4.630 3.326 2.378 4.058 . 0 0 "[ . 1 . 2]" 1
1361 1 56 LEU H 1 57 GLU H . . 5.010 4.517 4.474 4.551 . 0 0 "[ . 1 . 2]" 1
1362 1 56 LEU HA 1 56 LEU MD1 . . 4.320 3.272 2.689 3.876 . 0 0 "[ . 1 . 2]" 1
1363 1 56 LEU HA 1 56 LEU QD . . 3.590 2.422 1.973 2.802 . 0 0 "[ . 1 . 2]" 1
1364 1 56 LEU HA 1 56 LEU MD2 . . 4.320 3.033 1.979 3.861 . 0 0 "[ . 1 . 2]" 1
1365 1 56 LEU HA 1 57 GLU HB2 . . 5.240 4.477 4.085 4.653 . 0 0 "[ . 1 . 2]" 1
1366 1 56 LEU HA 1 60 VAL MG2 . . 5.030 3.760 3.607 3.909 . 0 0 "[ . 1 . 2]" 1
1367 1 56 LEU HB2 1 57 GLU H . . 5.070 4.112 4.010 4.174 . 0 0 "[ . 1 . 2]" 1
1368 1 56 LEU HB2 1 60 VAL HB . . 4.860 3.907 3.655 4.149 . 0 0 "[ . 1 . 2]" 1
1369 1 56 LEU HB2 1 60 VAL MG1 . . 4.930 4.310 3.966 4.710 . 0 0 "[ . 1 . 2]" 1
1370 1 56 LEU HB3 1 57 GLU H . . 4.810 3.054 2.972 3.114 . 0 0 "[ . 1 . 2]" 1
1371 1 56 LEU HB3 1 60 VAL H . . 5.140 4.187 4.049 4.337 . 0 0 "[ . 1 . 2]" 1
1372 1 56 LEU HB3 1 60 VAL HB . . 4.150 2.240 2.042 2.440 . 0 0 "[ . 1 . 2]" 1
1373 1 56 LEU HB3 1 60 VAL MG1 . . 4.230 2.984 2.659 3.323 . 0 0 "[ . 1 . 2]" 1
1374 1 56 LEU HB3 1 60 VAL MG2 . . 3.900 3.526 3.280 3.676 . 0 0 "[ . 1 . 2]" 1
1375 1 56 LEU QD 1 57 GLU H . . 4.320 3.802 3.264 4.198 . 0 0 "[ . 1 . 2]" 1
1376 1 56 LEU QD 1 60 VAL H . . 5.200 4.588 4.269 4.713 . 0 0 "[ . 1 . 2]" 1
1377 1 56 LEU QD 1 60 VAL HB . . 4.110 2.907 2.752 3.078 . 0 0 "[ . 1 . 2]" 1
1378 1 56 LEU QD 1 60 VAL MG1 . . 3.680 2.104 1.915 2.414 . 0 0 "[ . 1 . 2]" 1
1379 1 56 LEU QD 1 62 SER H . . 5.440 4.056 3.754 4.459 . 0 0 "[ . 1 . 2]" 1
1380 1 56 LEU QD 1 62 SER HA . . 3.890 2.299 1.977 2.735 . 0 0 "[ . 1 . 2]" 1
1381 1 56 LEU QD 1 64 PHE HB3 . . 4.700 3.707 3.070 4.321 . 0 0 "[ . 1 . 2]" 1
1382 1 56 LEU QD 1 64 PHE QD . . 4.080 3.701 3.412 4.087 0.007 3 0 "[ . 1 . 2]" 1
1383 1 56 LEU QD 1 65 SER H . . 5.440 4.021 3.038 4.338 . 0 0 "[ . 1 . 2]" 1
1384 1 56 LEU QD 1 65 SER HA . . 4.610 2.364 1.963 2.702 . 0 0 "[ . 1 . 2]" 1
1385 1 56 LEU QD 1 65 SER QB . . 4.490 3.627 3.244 4.139 . 0 0 "[ . 1 . 2]" 1
1386 1 56 LEU QD 1 66 GLY H . . 4.630 3.428 3.041 4.178 . 0 0 "[ . 1 . 2]" 1
1387 1 56 LEU MD1 1 57 GLU H . . 5.500 4.705 4.472 4.911 . 0 0 "[ . 1 . 2]" 1
1388 1 56 LEU MD1 1 60 VAL HB . . 4.750 4.167 3.219 4.828 0.078 16 0 "[ . 1 . 2]" 1
1389 1 56 LEU MD1 1 64 PHE H . . 4.930 4.541 3.595 5.004 0.074 15 0 "[ . 1 . 2]" 1
1390 1 56 LEU MD1 1 64 PHE HB2 . . 5.020 3.953 3.179 4.376 . 0 0 "[ . 1 . 2]" 1
1391 1 56 LEU MD1 1 64 PHE HB3 . . 5.500 4.807 4.370 5.434 . 0 0 "[ . 1 . 2]" 1
1392 1 56 LEU MD1 1 66 GLY H . . 5.500 4.168 3.066 5.574 0.074 11 0 "[ . 1 . 2]" 1
1393 1 56 LEU MD2 1 57 GLU H . . 5.500 4.136 3.324 4.757 . 0 0 "[ . 1 . 2]" 1
1394 1 56 LEU MD2 1 60 VAL HB . . 4.750 3.027 2.857 3.373 . 0 0 "[ . 1 . 2]" 1
1395 1 56 LEU MD2 1 64 PHE H . . 4.930 3.674 3.129 4.343 . 0 0 "[ . 1 . 2]" 1
1396 1 56 LEU MD2 1 64 PHE HB2 . . 5.020 2.882 2.483 3.466 . 0 0 "[ . 1 . 2]" 1
1397 1 56 LEU MD2 1 64 PHE HB3 . . 5.500 3.897 3.137 4.722 . 0 0 "[ . 1 . 2]" 1
1398 1 56 LEU MD2 1 66 GLY H . . 5.500 4.524 3.333 5.449 . 0 0 "[ . 1 . 2]" 1
1399 1 56 LEU HG 1 57 GLU H . . 5.070 4.506 3.925 5.104 0.034 1 0 "[ . 1 . 2]" 1
1400 1 56 LEU HG 1 60 VAL HB . . 5.050 4.310 3.493 5.156 0.106 11 0 "[ . 1 . 2]" 1
1401 1 56 LEU HG 1 62 SER HA . . 5.500 4.968 4.582 5.523 0.023 9 0 "[ . 1 . 2]" 1
1402 1 57 GLU H 1 57 GLU HB2 . . 3.880 2.587 2.252 2.702 . 0 0 "[ . 1 . 2]" 1
1403 1 57 GLU H 1 57 GLU HB3 . . 4.180 2.403 2.271 2.575 . 0 0 "[ . 1 . 2]" 1
1404 1 57 GLU H 1 57 GLU HG2 . . 5.500 4.544 4.319 4.651 . 0 0 "[ . 1 . 2]" 1
1405 1 57 GLU H 1 57 GLU QG . . 4.810 3.967 3.891 4.038 . 0 0 "[ . 1 . 2]" 1
1406 1 57 GLU H 1 57 GLU HG3 . . 5.500 4.378 4.278 4.450 . 0 0 "[ . 1 . 2]" 1
1407 1 57 GLU H 1 58 THR H . . 5.500 4.582 4.503 4.641 . 0 0 "[ . 1 . 2]" 1
1408 1 57 GLU H 1 60 VAL H . . 5.500 4.692 4.495 5.153 . 0 0 "[ . 1 . 2]" 1
1409 1 57 GLU H 1 60 VAL HB . . 5.040 3.209 3.061 3.388 . 0 0 "[ . 1 . 2]" 1
1410 1 57 GLU H 1 60 VAL MG1 . . 5.500 3.568 3.446 3.687 . 0 0 "[ . 1 . 2]" 1
1411 1 57 GLU H 1 60 VAL MG2 . . 4.340 2.451 2.351 2.544 . 0 0 "[ . 1 . 2]" 1
1412 1 57 GLU HA 1 60 VAL MG2 . . 5.280 3.983 3.894 4.063 . 0 0 "[ . 1 . 2]" 1
1413 1 57 GLU HB2 1 58 THR H . . 4.900 3.976 3.816 4.340 . 0 0 "[ . 1 . 2]" 1
1414 1 57 GLU HB2 1 60 VAL MG2 . . 4.450 3.342 2.911 3.589 . 0 0 "[ . 1 . 2]" 1
1415 1 57 GLU HB3 1 58 THR H . . 4.990 3.901 3.772 4.016 . 0 0 "[ . 1 . 2]" 1
1416 1 57 GLU HB3 1 60 VAL H . . 5.500 4.277 3.834 4.883 . 0 0 "[ . 1 . 2]" 1
1417 1 57 GLU HB3 1 60 VAL MG1 . . 5.170 4.263 4.055 4.624 . 0 0 "[ . 1 . 2]" 1
1418 1 57 GLU HB3 1 60 VAL MG2 . . 3.990 2.034 1.873 2.321 . 0 0 "[ . 1 . 2]" 1
1419 1 57 GLU QG 1 58 THR H . . 4.290 2.683 2.450 3.436 . 0 0 "[ . 1 . 2]" 1
1420 1 57 GLU QG 1 60 VAL H . . 5.340 4.468 3.854 5.433 0.093 9 0 "[ . 1 . 2]" 1
1421 1 57 GLU QG 1 60 VAL MG2 . . 4.380 3.089 2.656 3.560 . 0 0 "[ . 1 . 2]" 1
1422 1 57 GLU HG2 1 58 THR H . . 5.090 3.852 3.093 4.046 . 0 0 "[ . 1 . 2]" 1
1423 1 57 GLU HG2 1 60 VAL MG2 . . 4.980 3.834 3.325 4.445 . 0 0 "[ . 1 . 2]" 1
1424 1 57 GLU HG3 1 58 THR H . . 5.090 2.890 2.480 4.497 . 0 0 "[ . 1 . 2]" 1
1425 1 57 GLU HG3 1 60 VAL MG2 . . 4.980 3.258 2.793 3.780 . 0 0 "[ . 1 . 2]" 1
1426 1 58 THR H 1 58 THR HB . . 3.790 2.657 2.491 3.573 . 0 0 "[ . 1 . 2]" 1
1427 1 58 THR H 1 58 THR MG . . 4.380 3.555 2.112 3.773 . 0 0 "[ . 1 . 2]" 1
1428 1 58 THR H 1 59 GLY H . . 5.500 4.467 4.422 4.523 . 0 0 "[ . 1 . 2]" 1
1429 1 58 THR H 1 60 VAL H . . 5.500 4.637 4.493 5.030 . 0 0 "[ . 1 . 2]" 1
1430 1 58 THR H 1 60 VAL MG2 . . 5.500 4.324 4.191 4.456 . 0 0 "[ . 1 . 2]" 1
1431 1 58 THR HA 1 60 VAL H . . 4.660 3.400 3.203 3.828 . 0 0 "[ . 1 . 2]" 1
1432 1 58 THR HB 1 59 GLY H . . 5.470 4.161 3.398 4.287 . 0 0 "[ . 1 . 2]" 1
1433 1 58 THR MG 1 59 GLY H . . 5.180 3.016 2.826 4.005 . 0 0 "[ . 1 . 2]" 1
1434 1 59 GLY H 1 60 VAL H . . 4.540 2.286 1.914 2.476 . 0 0 "[ . 1 . 2]" 1
1435 1 60 VAL H 1 60 VAL HB . . 3.810 2.502 2.406 2.620 . 0 0 "[ . 1 . 2]" 1
1436 1 60 VAL H 1 60 VAL MG1 . . 4.580 3.781 3.735 3.826 . 0 0 "[ . 1 . 2]" 1
1437 1 60 VAL H 1 60 VAL MG2 . . 3.580 2.335 2.171 2.697 . 0 0 "[ . 1 . 2]" 1
1438 1 60 VAL H 1 61 PRO HD2 . . 5.500 5.142 5.055 5.204 . 0 0 "[ . 1 . 2]" 1
1439 1 60 VAL H 1 61 PRO HD3 . . 5.500 4.386 4.259 4.575 . 0 0 "[ . 1 . 2]" 1
1440 1 60 VAL HA 1 61 PRO HD3 . . 3.730 2.005 1.948 2.067 . 0 0 "[ . 1 . 2]" 1
1441 1 60 VAL HA 1 61 PRO HG2 . . 4.860 4.381 4.334 4.422 . 0 0 "[ . 1 . 2]" 1
1442 1 60 VAL HA 1 61 PRO HG3 . . 4.860 4.181 4.113 4.242 . 0 0 "[ . 1 . 2]" 1
1443 1 60 VAL HB 1 61 PRO HD2 . . 5.290 4.655 4.558 4.779 . 0 0 "[ . 1 . 2]" 1
1444 1 60 VAL HB 1 61 PRO HD3 . . 5.500 4.817 4.759 4.871 . 0 0 "[ . 1 . 2]" 1
1445 1 60 VAL MG1 1 61 PRO HD2 . . 4.040 2.557 2.286 2.739 . 0 0 "[ . 1 . 2]" 1
1446 1 60 VAL MG1 1 61 PRO HD3 . . 4.330 3.494 3.377 3.597 . 0 0 "[ . 1 . 2]" 1
1447 1 60 VAL MG1 1 61 PRO HG2 . . 5.060 4.479 4.202 4.692 . 0 0 "[ . 1 . 2]" 1
1448 1 60 VAL MG1 1 61 PRO QG . . 4.370 4.136 3.916 4.286 . 0 0 "[ . 1 . 2]" 1
1449 1 60 VAL MG1 1 61 PRO HG3 . . 5.060 4.862 4.675 4.968 . 0 0 "[ . 1 . 2]" 1
1450 1 60 VAL MG1 1 64 PHE H . . 4.930 3.582 3.385 3.729 . 0 0 "[ . 1 . 2]" 1
1451 1 60 VAL MG1 1 64 PHE HB2 . . 4.720 2.418 2.196 2.619 . 0 0 "[ . 1 . 2]" 1
1452 1 60 VAL MG1 1 64 PHE HB3 . . 5.010 3.486 3.223 3.693 . 0 0 "[ . 1 . 2]" 1
1453 1 60 VAL MG1 1 64 PHE QD . . 3.530 2.290 2.126 2.555 . 0 0 "[ . 1 . 2]" 1
1454 1 60 VAL MG1 1 64 PHE QE . . 4.090 3.598 3.402 3.889 . 0 0 "[ . 1 . 2]" 1
1455 1 60 VAL MG1 1 65 SER H . . 5.500 5.468 4.936 5.574 0.074 16 0 "[ . 1 . 2]" 1
1456 1 60 VAL MG2 1 61 PRO HD2 . . 4.700 3.924 3.605 4.076 . 0 0 "[ . 1 . 2]" 1
1457 1 60 VAL MG2 1 61 PRO HD3 . . 4.820 3.987 3.838 4.133 . 0 0 "[ . 1 . 2]" 1
1458 1 61 PRO HA 1 62 SER H . . 3.550 2.221 2.145 2.296 . 0 0 "[ . 1 . 2]" 1
1459 1 61 PRO HA 1 63 ARG H . . 5.500 3.773 3.696 3.870 . 0 0 "[ . 1 . 2]" 1
1460 1 61 PRO HB2 1 63 ARG H . . 4.830 2.623 2.411 2.988 . 0 0 "[ . 1 . 2]" 1
1461 1 61 PRO HB2 1 64 PHE H . . 4.990 3.458 3.134 3.718 . 0 0 "[ . 1 . 2]" 1
1462 1 61 PRO HB2 1 64 PHE QD . . 5.030 2.831 2.517 3.089 . 0 0 "[ . 1 . 2]" 1
1463 1 61 PRO HB2 1 64 PHE QE . . 4.440 2.751 2.434 3.016 . 0 0 "[ . 1 . 2]" 1
1464 1 61 PRO HB2 1 64 PHE HZ . . 4.950 4.829 4.583 4.969 0.019 6 0 "[ . 1 . 2]" 1
1465 1 61 PRO HB3 1 62 SER H . . 4.670 3.232 3.000 3.514 . 0 0 "[ . 1 . 2]" 1
1466 1 61 PRO HB3 1 63 ARG H . . 5.500 3.267 3.179 3.379 . 0 0 "[ . 1 . 2]" 1
1467 1 61 PRO HB3 1 63 ARG HG3 . . 4.670 3.453 2.709 3.990 . 0 0 "[ . 1 . 2]" 1
1468 1 61 PRO HB3 1 64 PHE H . . 5.500 4.957 4.650 5.242 . 0 0 "[ . 1 . 2]" 1
1469 1 61 PRO HB3 1 64 PHE QE . . 5.210 4.125 3.801 4.361 . 0 0 "[ . 1 . 2]" 1
1470 1 61 PRO HD2 1 64 PHE H . . 5.500 4.734 4.500 4.954 . 0 0 "[ . 1 . 2]" 1
1471 1 61 PRO HD2 1 64 PHE QD . . 4.250 2.546 2.314 2.870 . 0 0 "[ . 1 . 2]" 1
1472 1 61 PRO HD2 1 64 PHE QE . . 4.740 2.214 2.052 2.611 . 0 0 "[ . 1 . 2]" 1
1473 1 61 PRO HD3 1 64 PHE QD . . 4.700 4.207 3.992 4.448 . 0 0 "[ . 1 . 2]" 1
1474 1 61 PRO HD3 1 64 PHE QE . . 5.040 3.704 3.605 4.001 . 0 0 "[ . 1 . 2]" 1
1475 1 61 PRO QG 1 62 SER H . . 5.030 4.565 4.448 4.688 . 0 0 "[ . 1 . 2]" 1
1476 1 61 PRO QG 1 64 PHE QD . . 4.330 3.696 3.383 3.932 . 0 0 "[ . 1 . 2]" 1
1477 1 61 PRO QG 1 64 PHE QE . . 4.360 2.276 2.064 2.547 . 0 0 "[ . 1 . 2]" 1
1478 1 62 SER H 1 63 ARG H . . 4.870 2.654 2.575 2.755 . 0 0 "[ . 1 . 2]" 1
1479 1 62 SER H 1 63 ARG HG3 . . 5.500 4.317 3.629 5.528 0.028 12 0 "[ . 1 . 2]" 1
1480 1 62 SER H 1 64 PHE H . . 5.500 4.561 4.413 4.631 . 0 0 "[ . 1 . 2]" 1
1481 1 62 SER HA 1 64 PHE H . . 5.280 3.682 3.571 3.844 . 0 0 "[ . 1 . 2]" 1
1482 1 62 SER QB 1 64 PHE H . . 5.340 4.785 4.697 4.962 . 0 0 "[ . 1 . 2]" 1
1483 1 62 SER HB2 1 63 ARG H . . 5.500 3.386 3.094 4.313 . 0 0 "[ . 1 . 2]" 1
1484 1 62 SER HB3 1 63 ARG H . . 5.500 4.171 3.421 4.249 . 0 0 "[ . 1 . 2]" 1
1485 1 63 ARG H 1 63 ARG QD . . 5.340 3.941 3.094 4.310 . 0 0 "[ . 1 . 2]" 1
1486 1 63 ARG H 1 63 ARG HG2 . . 5.160 3.151 2.002 3.721 . 0 0 "[ . 1 . 2]" 1
1487 1 63 ARG H 1 63 ARG HG3 . . 4.890 2.495 1.883 3.627 . 0 0 "[ . 1 . 2]" 1
1488 1 63 ARG H 1 64 PHE H . . 4.290 2.647 2.562 2.805 . 0 0 "[ . 1 . 2]" 1
1489 1 63 ARG HA 1 77 ILE MG . . 5.500 4.517 4.133 5.075 . 0 0 "[ . 1 . 2]" 1
1490 1 63 ARG HA 1 78 SER QB . . 5.470 2.418 2.067 3.462 . 0 0 "[ . 1 . 2]" 1
1491 1 63 ARG HA 1 79 SER H . . 5.500 3.798 3.195 4.506 . 0 0 "[ . 1 . 2]" 1
1492 1 63 ARG HB2 1 77 ILE MG . . 5.110 3.534 2.867 4.148 . 0 0 "[ . 1 . 2]" 1
1493 1 63 ARG HB2 1 78 SER H . . 5.160 4.533 4.243 4.720 . 0 0 "[ . 1 . 2]" 1
1494 1 63 ARG HB2 1 79 SER H . . 5.500 4.122 3.836 4.356 . 0 0 "[ . 1 . 2]" 1
1495 1 63 ARG HB2 1 81 GLN HG3 . . 5.490 5.195 4.248 5.562 0.072 10 0 "[ . 1 . 2]" 1
1496 1 63 ARG HB3 1 78 SER HA . . 5.420 5.294 4.674 5.506 0.086 12 0 "[ . 1 . 2]" 1
1497 1 63 ARG QD 1 77 ILE MG . . 4.830 3.929 3.604 4.360 . 0 0 "[ . 1 . 2]" 1
1498 1 63 ARG QD 1 79 SER HA . . 5.340 4.571 4.348 4.996 . 0 0 "[ . 1 . 2]" 1
1499 1 63 ARG QD 1 79 SER QB . . 4.920 2.199 1.867 2.865 . 0 0 "[ . 1 . 2]" 1
1500 1 63 ARG QD 1 81 GLN HG2 . . 4.760 3.039 2.288 4.298 . 0 0 "[ . 1 . 2]" 1
1501 1 63 ARG HD2 1 77 ILE MG . . 5.480 4.534 3.688 5.530 0.050 4 0 "[ . 1 . 2]" 1
1502 1 63 ARG HD2 1 81 GLN HG2 . . 5.500 3.433 2.382 5.098 . 0 0 "[ . 1 . 2]" 1
1503 1 63 ARG HD2 1 81 GLN HG3 . . 5.500 3.801 3.147 5.405 . 0 0 "[ . 1 . 2]" 1
1504 1 63 ARG HD3 1 77 ILE MG . . 5.480 4.696 3.888 5.534 0.054 6 0 "[ . 1 . 2]" 1
1505 1 63 ARG HD3 1 81 GLN HG2 . . 5.500 3.632 2.391 5.029 . 0 0 "[ . 1 . 2]" 1
1506 1 63 ARG HD3 1 81 GLN HG3 . . 5.500 3.984 2.726 5.507 0.007 3 0 "[ . 1 . 2]" 1
1507 1 63 ARG HG2 1 78 SER QB . . 5.500 3.767 2.487 5.297 . 0 0 "[ . 1 . 2]" 1
1508 1 64 PHE H 1 64 PHE HB2 . . 4.080 2.492 2.466 2.555 . 0 0 "[ . 1 . 2]" 1
1509 1 64 PHE H 1 64 PHE QD . . 4.410 2.418 2.167 2.712 . 0 0 "[ . 1 . 2]" 1
1510 1 64 PHE H 1 64 PHE HZ . . 5.500 5.623 5.595 5.672 0.172 2 0 "[ . 1 . 2]" 1
1511 1 64 PHE H 1 65 SER H . . 5.060 4.497 4.410 4.538 . 0 0 "[ . 1 . 2]" 1
1512 1 64 PHE H 1 77 ILE MG . . 5.500 4.548 4.265 4.882 . 0 0 "[ . 1 . 2]" 1
1513 1 64 PHE HA 1 64 PHE QD . . 4.160 2.727 2.470 2.963 . 0 0 "[ . 1 . 2]" 1
1514 1 64 PHE HA 1 77 ILE HA . . 4.510 2.540 2.354 2.716 . 0 0 "[ . 1 . 2]" 1
1515 1 64 PHE HA 1 77 ILE HB . . 5.500 5.371 5.230 5.578 0.078 9 0 "[ . 1 . 2]" 1
1516 1 64 PHE HA 1 77 ILE MG . . 5.500 3.567 3.362 3.750 . 0 0 "[ . 1 . 2]" 1
1517 1 64 PHE HA 1 78 SER H . . 5.410 3.566 3.344 3.927 . 0 0 "[ . 1 . 2]" 1
1518 1 64 PHE HB2 1 65 SER H . . 5.050 3.885 3.270 4.117 . 0 0 "[ . 1 . 2]" 1
1519 1 64 PHE HB3 1 65 SER H . . 4.680 2.940 2.281 3.325 . 0 0 "[ . 1 . 2]" 1
1520 1 64 PHE HB3 1 75 PHE HZ . . 4.680 3.453 3.013 3.937 . 0 0 "[ . 1 . 2]" 1
1521 1 64 PHE QD 1 65 SER H . . 4.690 3.999 3.658 4.286 . 0 0 "[ . 1 . 2]" 1
1522 1 64 PHE QD 1 75 PHE HZ . . 4.310 2.403 2.152 2.805 . 0 0 "[ . 1 . 2]" 1
1523 1 64 PHE QD 1 77 ILE HA . . 4.250 3.583 3.433 3.797 . 0 0 "[ . 1 . 2]" 1
1524 1 64 PHE QD 1 77 ILE MG . . 3.490 3.292 3.022 3.503 0.013 17 0 "[ . 1 . 2]" 1
1525 1 64 PHE QE 1 77 ILE HA . . 4.800 4.773 4.542 4.839 0.039 8 0 "[ . 1 . 2]" 1
1526 1 64 PHE QE 1 77 ILE MD . . 4.280 2.313 2.128 2.541 . 0 0 "[ . 1 . 2]" 1
1527 1 64 PHE QE 1 77 ILE HG12 . . 5.000 2.771 2.466 3.022 . 0 0 "[ . 1 . 2]" 1
1528 1 64 PHE QE 1 77 ILE HG13 . . 4.400 4.196 3.916 4.417 0.017 3 0 "[ . 1 . 2]" 1
1529 1 64 PHE QE 1 77 ILE MG . . 3.630 2.999 2.749 3.318 . 0 0 "[ . 1 . 2]" 1
1530 1 64 PHE QE 1 88 TYR HH . . 5.170 2.987 2.487 3.649 . 0 0 "[ . 1 . 2]" 1
1531 1 64 PHE HZ 1 77 ILE MG . . 4.420 3.984 3.682 4.363 . 0 0 "[ . 1 . 2]" 1
1532 1 64 PHE HZ 1 84 ASP HB2 . . 5.200 3.678 2.924 4.532 . 0 0 "[ . 1 . 2]" 1
1533 1 64 PHE HZ 1 84 ASP HB3 . . 5.250 2.950 2.064 3.704 . 0 0 "[ . 1 . 2]" 1
1534 1 64 PHE HZ 1 88 TYR HH . . 5.360 4.014 2.933 4.950 . 0 0 "[ . 1 . 2]" 1
1535 1 65 SER H 1 66 GLY H . . 5.200 4.001 2.018 4.321 . 0 0 "[ . 1 . 2]" 1
1536 1 65 SER H 1 75 PHE QE . . 4.600 4.329 3.943 4.620 0.020 1 0 "[ . 1 . 2]" 1
1537 1 65 SER H 1 75 PHE HZ . . 5.500 5.096 4.694 5.553 0.053 9 0 "[ . 1 . 2]" 1
1538 1 65 SER H 1 77 ILE HA . . 5.130 3.699 3.331 4.694 . 0 0 "[ . 1 . 2]" 1
1539 1 65 SER H 1 77 ILE HG12 . . 5.460 4.680 4.381 5.451 . 0 0 "[ . 1 . 2]" 1
1540 1 65 SER HA 1 66 GLY HA2 . . 5.500 4.494 4.357 5.373 . 0 0 "[ . 1 . 2]" 1
1541 1 65 SER QB 1 66 GLY H . . 3.770 2.816 2.359 3.131 . 0 0 "[ . 1 . 2]" 1
1542 1 65 SER QB 1 66 GLY HA2 . . 5.500 4.118 3.876 4.444 . 0 0 "[ . 1 . 2]" 1
1543 1 65 SER QB 1 67 SER H . . 4.950 4.607 3.276 5.038 0.088 9 0 "[ . 1 . 2]" 1
1544 1 65 SER QB 1 76 THR H . . 5.500 3.749 3.382 4.420 . 0 0 "[ . 1 . 2]" 1
1545 1 66 GLY H 1 67 SER H . . 5.190 3.848 2.399 4.324 . 0 0 "[ . 1 . 2]" 1
1546 1 66 GLY H 1 76 THR H . . 5.500 4.626 2.788 4.949 . 0 0 "[ . 1 . 2]" 1
1547 1 66 GLY HA2 1 75 PHE HA . . 4.610 2.230 1.893 2.627 . 0 0 "[ . 1 . 2]" 1
1548 1 66 GLY HA2 1 76 THR H . . 5.310 3.358 3.057 3.615 . 0 0 "[ . 1 . 2]" 1
1549 1 66 GLY HA3 1 75 PHE HA . . 4.610 3.562 2.988 4.151 . 0 0 "[ . 1 . 2]" 1
1550 1 67 SER H 1 68 GLY H . . 5.500 4.305 4.164 4.536 . 0 0 "[ . 1 . 2]" 1
1551 1 67 SER HB2 1 68 GLY H . . 4.400 3.530 2.777 4.234 . 0 0 "[ . 1 . 2]" 1
1552 1 67 SER HB3 1 68 GLY H . . 4.400 3.747 2.526 4.246 . 0 0 "[ . 1 . 2]" 1
1553 1 68 GLY H 1 69 SER H . . 5.130 4.308 4.220 4.361 . 0 0 "[ . 1 . 2]" 1
1554 1 68 GLY H 1 73 PHE HA . . 5.370 4.525 4.408 4.712 . 0 0 "[ . 1 . 2]" 1
1555 1 68 GLY QA 1 73 PHE H . . 5.340 4.483 4.346 4.646 . 0 0 "[ . 1 . 2]" 1
1556 1 68 GLY QA 1 73 PHE HA . . 4.240 1.963 1.836 2.304 . 0 0 "[ . 1 . 2]" 1
1557 1 68 GLY QA 1 73 PHE QD . . 5.340 2.856 2.048 3.734 . 0 0 "[ . 1 . 2]" 1
1558 1 68 GLY QA 1 74 THR H . . 5.180 2.960 2.661 3.201 . 0 0 "[ . 1 . 2]" 1
1559 1 68 GLY HA2 1 73 PHE HA . . 5.000 3.533 2.735 4.057 . 0 0 "[ . 1 . 2]" 1
1560 1 68 GLY HA3 1 73 PHE HA . . 5.000 1.974 1.844 2.317 . 0 0 "[ . 1 . 2]" 1
1561 1 69 SER H 1 70 GLY H . . 4.840 4.161 3.387 4.314 . 0 0 "[ . 1 . 2]" 1
1562 1 69 SER H 1 71 THR H . . 5.500 4.487 4.070 5.616 0.116 17 0 "[ . 1 . 2]" 1
1563 1 69 SER H 1 73 PHE HA . . 5.120 3.752 3.236 4.074 . 0 0 "[ . 1 . 2]" 1
1564 1 69 SER H 1 73 PHE QD . . 4.780 3.860 3.430 4.167 . 0 0 "[ . 1 . 2]" 1
1565 1 69 SER H 1 73 PHE QE . . 5.500 4.004 3.464 4.243 . 0 0 "[ . 1 . 2]" 1
1566 1 69 SER HA 1 73 PHE QD . . 4.300 3.595 2.602 4.083 . 0 0 "[ . 1 . 2]" 1
1567 1 69 SER HA 1 73 PHE QE . . 4.930 2.254 1.989 2.745 . 0 0 "[ . 1 . 2]" 1
1568 1 69 SER QB 1 70 GLY H . . 4.090 2.862 2.229 3.679 . 0 0 "[ . 1 . 2]" 1
1569 1 69 SER QB 1 70 GLY HA3 . . 5.350 3.988 3.781 4.573 . 0 0 "[ . 1 . 2]" 1
1570 1 69 SER QB 1 72 GLU H . . 5.500 5.419 4.971 5.625 0.125 2 0 "[ . 1 . 2]" 1
1571 1 69 SER QB 1 73 PHE QD . . 5.310 4.978 4.225 5.387 0.077 17 0 "[ . 1 . 2]" 1
1572 1 70 GLY H 1 71 THR H . . 5.230 4.017 3.587 4.230 . 0 0 "[ . 1 . 2]" 1
1573 1 70 GLY H 1 72 GLU H . . 5.500 4.898 4.432 5.350 . 0 0 "[ . 1 . 2]" 1
1574 1 70 GLY H 1 73 PHE QD . . 4.860 4.778 4.110 4.933 0.073 6 0 "[ . 1 . 2]" 1
1575 1 70 GLY H 1 73 PHE QE . . 4.750 2.922 2.253 3.239 . 0 0 "[ . 1 . 2]" 1
1576 1 70 GLY HA2 1 72 GLU H . . 5.150 5.078 4.339 5.514 0.364 7 0 "[ . 1 . 2]" 1
1577 1 70 GLY HA3 1 71 THR MG . . 5.500 3.574 3.391 4.095 . 0 0 "[ . 1 . 2]" 1
1578 1 70 GLY HA3 1 72 GLU H . . 5.480 4.164 3.829 4.682 . 0 0 "[ . 1 . 2]" 1
1579 1 71 THR H 1 71 THR MG . . 4.520 2.956 2.740 3.255 . 0 0 "[ . 1 . 2]" 1
1580 1 71 THR H 1 72 GLU H . . 3.580 2.174 1.882 3.489 . 0 0 "[ . 1 . 2]" 1
1581 1 71 THR HA 1 71 THR MG . . 3.350 2.272 2.211 2.310 . 0 0 "[ . 1 . 2]" 1
1582 1 71 THR HB 1 72 GLU H . . 4.990 3.930 3.389 4.220 . 0 0 "[ . 1 . 2]" 1
1583 1 71 THR MG 1 72 GLU H . . 5.060 4.246 3.996 4.393 . 0 0 "[ . 1 . 2]" 1
1584 1 72 GLU H 1 72 GLU HG2 . . 5.240 4.069 3.727 4.511 . 0 0 "[ . 1 . 2]" 1
1585 1 72 GLU H 1 72 GLU QG . . 4.570 3.070 2.664 4.127 . 0 0 "[ . 1 . 2]" 1
1586 1 72 GLU H 1 72 GLU HG3 . . 5.240 3.216 2.723 4.781 . 0 0 "[ . 1 . 2]" 1
1587 1 72 GLU H 1 73 PHE H . . 4.410 4.260 4.124 4.401 . 0 0 "[ . 1 . 2]" 1
1588 1 72 GLU HB2 1 73 PHE H . . 5.330 4.227 4.138 4.330 . 0 0 "[ . 1 . 2]" 1
1589 1 72 GLU HB3 1 73 PHE H . . 5.330 3.422 3.148 4.158 . 0 0 "[ . 1 . 2]" 1
1590 1 72 GLU HG2 1 73 PHE H . . 5.340 4.243 2.894 5.263 . 0 0 "[ . 1 . 2]" 1
1591 1 72 GLU HG3 1 73 PHE H . . 5.340 4.832 2.988 5.205 . 0 0 "[ . 1 . 2]" 1
1592 1 73 PHE HB2 1 74 THR H . . 5.310 4.042 3.873 4.150 . 0 0 "[ . 1 . 2]" 1
1593 1 73 PHE HB3 1 74 THR H . . 4.750 3.166 2.874 3.419 . 0 0 "[ . 1 . 2]" 1
1594 1 73 PHE QE 1 92 GLN HG2 . . 5.500 5.554 5.497 5.617 0.117 9 0 "[ . 1 . 2]" 1
1595 1 74 THR H 1 74 THR HB . . 4.100 2.617 2.573 2.677 . 0 0 "[ . 1 . 2]" 1
1596 1 74 THR HB 1 75 PHE HA . . 4.740 4.700 4.501 4.787 0.047 11 0 "[ . 1 . 2]" 1
1597 1 74 THR HB 1 76 THR H . . 5.500 5.534 5.261 5.571 0.071 15 0 "[ . 1 . 2]" 1
1598 1 74 THR MG 1 75 PHE H . . 3.940 2.703 2.337 2.927 . 0 0 "[ . 1 . 2]" 1
1599 1 75 PHE H 1 76 THR H . . 5.460 4.277 4.165 4.355 . 0 0 "[ . 1 . 2]" 1
1600 1 75 PHE HA 1 76 THR HB . . 4.360 4.415 4.394 4.436 0.076 11 0 "[ . 1 . 2]" 1
1601 1 75 PHE HB2 1 76 THR H . . 5.500 4.265 4.227 4.368 . 0 0 "[ . 1 . 2]" 1
1602 1 75 PHE HB3 1 76 THR H . . 5.440 4.232 4.168 4.362 . 0 0 "[ . 1 . 2]" 1
1603 1 75 PHE QE 1 76 THR H . . 5.290 4.810 4.613 5.208 . 0 0 "[ . 1 . 2]" 1
1604 1 75 PHE QE 1 77 ILE HG12 . . 4.620 2.911 2.631 3.338 . 0 0 "[ . 1 . 2]" 1
1605 1 75 PHE HZ 1 77 ILE MD . . 4.420 3.540 3.191 3.880 . 0 0 "[ . 1 . 2]" 1
1606 1 75 PHE HZ 1 77 ILE HG12 . . 3.970 3.418 3.132 3.777 . 0 0 "[ . 1 . 2]" 1
1607 1 75 PHE HZ 1 88 TYR HB3 . . 4.980 5.003 4.847 5.055 0.075 7 0 "[ . 1 . 2]" 1
1608 1 75 PHE HZ 1 88 TYR QD . . 4.460 3.436 3.141 3.728 . 0 0 "[ . 1 . 2]" 1
1609 1 76 THR H 1 76 THR HB . . 3.940 2.600 2.496 2.652 . 0 0 "[ . 1 . 2]" 1
1610 1 76 THR H 1 76 THR MG . . 4.670 3.832 3.768 3.857 . 0 0 "[ . 1 . 2]" 1
1611 1 76 THR H 1 77 ILE HA . . 4.640 4.706 4.676 4.732 0.092 1 0 "[ . 1 . 2]" 1
1612 1 76 THR HB 1 77 ILE H . . 5.500 4.179 4.049 4.244 . 0 0 "[ . 1 . 2]" 1
1613 1 76 THR MG 1 77 ILE H . . 3.590 2.735 2.631 2.855 . 0 0 "[ . 1 . 2]" 1
1614 1 76 THR MG 1 77 ILE HA . . 4.940 3.698 3.538 3.829 . 0 0 "[ . 1 . 2]" 1
1615 1 76 THR MG 1 78 SER H . . 4.700 3.575 3.335 3.794 . 0 0 "[ . 1 . 2]" 1
1616 1 76 THR MG 1 78 SER HA . . 4.210 3.113 2.854 3.319 . 0 0 "[ . 1 . 2]" 1
1617 1 76 THR MG 1 79 SER H . . 5.500 5.361 5.178 5.515 0.015 18 0 "[ . 1 . 2]" 1
1618 1 77 ILE H 1 77 ILE MD . . 4.820 3.958 3.824 4.084 . 0 0 "[ . 1 . 2]" 1
1619 1 77 ILE H 1 77 ILE HG12 . . 5.450 3.718 3.603 3.822 . 0 0 "[ . 1 . 2]" 1
1620 1 77 ILE H 1 77 ILE HG13 . . 4.850 2.603 2.433 2.769 . 0 0 "[ . 1 . 2]" 1
1621 1 77 ILE H 1 77 ILE MG . . 4.540 3.845 3.815 3.886 . 0 0 "[ . 1 . 2]" 1
1622 1 77 ILE H 1 78 SER H . . 5.450 4.258 4.174 4.375 . 0 0 "[ . 1 . 2]" 1
1623 1 77 ILE HA 1 77 ILE MD . . 4.780 3.912 3.875 3.942 . 0 0 "[ . 1 . 2]" 1
1624 1 77 ILE HB 1 80 LEU MD2 . . 3.190 3.014 2.764 3.455 0.265 10 0 "[ . 1 . 2]" 1
1625 1 77 ILE MD 1 78 SER H . . 5.500 5.335 5.255 5.383 . 0 0 "[ . 1 . 2]" 1
1626 1 77 ILE MD 1 79 SER H . . 5.330 5.263 5.080 5.350 0.020 11 0 "[ . 1 . 2]" 1
1627 1 77 ILE MD 1 80 LEU HA . . 5.500 3.302 3.100 3.620 . 0 0 "[ . 1 . 2]" 1
1628 1 77 ILE MD 1 80 LEU MD1 . . 3.370 3.420 2.108 3.543 0.173 7 0 "[ . 1 . 2]" 1
1629 1 77 ILE MD 1 84 ASP HA . . 5.500 5.218 3.830 5.614 0.114 19 0 "[ . 1 . 2]" 1
1630 1 77 ILE MD 1 84 ASP HB2 . . 5.050 3.890 3.122 4.475 . 0 0 "[ . 1 . 2]" 1
1631 1 77 ILE MD 1 84 ASP HB3 . . 4.890 3.224 1.984 3.756 . 0 0 "[ . 1 . 2]" 1
1632 1 77 ILE MD 1 88 TYR QD . . 4.910 4.027 3.789 4.483 . 0 0 "[ . 1 . 2]" 1
1633 1 77 ILE MD 1 88 TYR HH . . 4.930 2.920 2.369 3.322 . 0 0 "[ . 1 . 2]" 1
1634 1 77 ILE MD 1 106 LEU HB2 . . 5.500 4.528 4.205 4.908 . 0 0 "[ . 1 . 2]" 1
1635 1 77 ILE MG 1 78 SER H . . 4.150 2.958 2.775 3.028 . 0 0 "[ . 1 . 2]" 1
1636 1 77 ILE MG 1 78 SER HA . . 5.500 4.294 4.116 4.431 . 0 0 "[ . 1 . 2]" 1
1637 1 77 ILE MG 1 78 SER QB . . 5.500 4.075 3.870 4.496 . 0 0 "[ . 1 . 2]" 1
1638 1 77 ILE MG 1 79 SER H . . 3.930 2.237 2.052 2.345 . 0 0 "[ . 1 . 2]" 1
1639 1 77 ILE MG 1 79 SER HA . . 4.300 3.621 3.494 3.762 . 0 0 "[ . 1 . 2]" 1
1640 1 77 ILE MG 1 79 SER QB . . 5.500 4.000 3.897 4.104 . 0 0 "[ . 1 . 2]" 1
1641 1 77 ILE MG 1 80 LEU H . . 4.840 3.225 3.068 3.395 . 0 0 "[ . 1 . 2]" 1
1642 1 77 ILE MG 1 80 LEU HA . . 3.900 2.148 2.006 2.347 . 0 0 "[ . 1 . 2]" 1
1643 1 77 ILE MG 1 80 LEU HB2 . . 5.090 3.582 2.618 3.848 . 0 0 "[ . 1 . 2]" 1
1644 1 77 ILE MG 1 80 LEU HB3 . . 5.200 4.462 3.841 4.718 . 0 0 "[ . 1 . 2]" 1
1645 1 77 ILE MG 1 80 LEU HG . . 5.040 4.757 4.406 4.992 . 0 0 "[ . 1 . 2]" 1
1646 1 77 ILE MG 1 81 GLN H . . 4.550 3.536 3.194 3.848 . 0 0 "[ . 1 . 2]" 1
1647 1 77 ILE MG 1 81 GLN QE . . 5.340 4.795 3.957 5.303 . 0 0 "[ . 1 . 2]" 1
1648 1 77 ILE MG 1 84 ASP HB3 . . 5.350 4.117 3.176 4.675 . 0 0 "[ . 1 . 2]" 1
1649 1 78 SER H 1 79 SER H . . 4.490 2.678 2.449 2.800 . 0 0 "[ . 1 . 2]" 1
1650 1 78 SER QB 1 79 SER H . . 5.500 2.721 2.501 3.354 . 0 0 "[ . 1 . 2]" 1
1651 1 79 SER H 1 80 LEU H . . 4.980 3.857 3.660 3.947 . 0 0 "[ . 1 . 2]" 1
1652 1 79 SER HA 1 80 LEU H . . 3.470 2.110 2.047 2.176 . 0 0 "[ . 1 . 2]" 1
1653 1 79 SER QB 1 80 LEU H . . 4.490 3.641 3.351 3.948 . 0 0 "[ . 1 . 2]" 1
1654 1 79 SER QB 1 81 GLN HE21 . . 5.500 3.300 2.071 4.104 . 0 0 "[ . 1 . 2]" 1
1655 1 79 SER QB 1 81 GLN HE22 . . 5.500 3.795 2.517 4.866 . 0 0 "[ . 1 . 2]" 1
1656 1 80 LEU H 1 80 LEU HB2 . . 3.910 2.122 2.035 2.493 . 0 0 "[ . 1 . 2]" 1
1657 1 80 LEU H 1 80 LEU HB3 . . 4.070 2.772 2.359 2.873 . 0 0 "[ . 1 . 2]" 1
1658 1 80 LEU H 1 80 LEU MD1 . . 4.910 4.261 4.088 4.305 . 0 0 "[ . 1 . 2]" 1
1659 1 80 LEU H 1 80 LEU MD2 . . 4.990 3.633 3.477 4.045 . 0 0 "[ . 1 . 2]" 1
1660 1 80 LEU HA 1 80 LEU MD1 . . 4.050 2.449 2.104 2.576 . 0 0 "[ . 1 . 2]" 1
1661 1 80 LEU HA 1 81 GLN HG2 . . 5.060 3.975 3.686 4.251 . 0 0 "[ . 1 . 2]" 1
1662 1 80 LEU HA 1 84 ASP HB2 . . 5.500 3.952 3.170 4.741 . 0 0 "[ . 1 . 2]" 1
1663 1 80 LEU HB2 1 80 LEU MD1 . . 3.360 3.172 2.474 3.223 . 0 0 "[ . 1 . 2]" 1
1664 1 80 LEU HB2 1 81 GLN H . . 5.500 4.449 4.219 4.560 . 0 0 "[ . 1 . 2]" 1
1665 1 80 LEU HB3 1 80 LEU MD2 . . 3.290 3.111 2.424 3.163 . 0 0 "[ . 1 . 2]" 1
1666 1 80 LEU HB3 1 81 GLN H . . 5.070 3.922 3.729 4.130 . 0 0 "[ . 1 . 2]" 1
1667 1 80 LEU HB3 1 108 ILE MD . . 4.380 4.306 3.621 4.437 0.057 5 0 "[ . 1 . 2]" 1
1668 1 80 LEU MD1 1 81 GLN H . . 4.170 2.110 1.881 2.384 . 0 0 "[ . 1 . 2]" 1
1669 1 80 LEU MD1 1 84 ASP H . . 4.940 3.733 3.419 4.224 . 0 0 "[ . 1 . 2]" 1
1670 1 80 LEU MD1 1 84 ASP HB2 . . 4.110 2.714 1.995 3.593 . 0 0 "[ . 1 . 2]" 1
1671 1 80 LEU MD1 1 84 ASP HB3 . . 4.200 3.703 3.124 4.236 0.036 3 0 "[ . 1 . 2]" 1
1672 1 80 LEU MD1 1 88 TYR HH . . 5.500 4.599 3.683 5.342 . 0 0 "[ . 1 . 2]" 1
1673 1 80 LEU MD2 1 81 GLN H . . 4.470 3.434 3.096 4.458 . 0 0 "[ . 1 . 2]" 1
1674 1 80 LEU MD2 1 84 ASP HB2 . . 5.500 3.858 2.574 5.017 . 0 0 "[ . 1 . 2]" 1
1675 1 80 LEU MD2 1 85 LEU HA . . 5.500 4.387 3.987 4.697 . 0 0 "[ . 1 . 2]" 1
1676 1 80 LEU MD2 1 88 TYR HH . . 5.500 4.385 3.499 5.406 . 0 0 "[ . 1 . 2]" 1
1677 1 80 LEU MD2 1 106 LEU HB3 . . 4.880 4.754 4.451 4.937 0.057 10 0 "[ . 1 . 2]" 1
1678 1 80 LEU HG 1 81 GLN H . . 5.310 4.682 3.498 4.966 . 0 0 "[ . 1 . 2]" 1
1679 1 81 GLN H 1 81 GLN HE21 . . 5.500 3.804 3.281 4.639 . 0 0 "[ . 1 . 2]" 1
1680 1 81 GLN H 1 81 GLN HE22 . . 5.500 5.309 4.840 5.544 0.044 16 0 "[ . 1 . 2]" 1
1681 1 81 GLN H 1 81 GLN HG2 . . 5.200 2.918 2.703 3.138 . 0 0 "[ . 1 . 2]" 1
1682 1 81 GLN H 1 81 GLN HG3 . . 5.020 4.146 4.017 4.294 . 0 0 "[ . 1 . 2]" 1
1683 1 81 GLN H 1 82 PRO HD3 . . 5.500 4.936 4.770 5.184 . 0 0 "[ . 1 . 2]" 1
1684 1 81 GLN H 1 83 GLU H . . 5.500 5.165 4.673 5.500 0.000 19 0 "[ . 1 . 2]" 1
1685 1 81 GLN H 1 84 ASP H . . 5.230 3.855 3.451 4.157 . 0 0 "[ . 1 . 2]" 1
1686 1 81 GLN H 1 84 ASP HB2 . . 4.830 2.503 2.031 2.990 . 0 0 "[ . 1 . 2]" 1
1687 1 81 GLN H 1 84 ASP HB3 . . 5.500 3.863 3.451 4.283 . 0 0 "[ . 1 . 2]" 1
1688 1 81 GLN H 1 108 ILE MD . . 5.500 4.507 3.939 4.853 . 0 0 "[ . 1 . 2]" 1
1689 1 81 GLN HA 1 81 GLN HE21 . . 5.500 2.645 2.336 4.064 . 0 0 "[ . 1 . 2]" 1
1690 1 81 GLN HA 1 81 GLN QE . . 4.710 2.534 2.282 3.617 . 0 0 "[ . 1 . 2]" 1
1691 1 81 GLN HA 1 81 GLN HE22 . . 5.500 3.354 3.156 4.056 . 0 0 "[ . 1 . 2]" 1
1692 1 81 GLN HA 1 82 PRO HG2 . . 5.500 4.648 4.559 4.761 . 0 0 "[ . 1 . 2]" 1
1693 1 81 GLN HA 1 82 PRO HG3 . . 5.440 4.381 4.066 4.700 . 0 0 "[ . 1 . 2]" 1
1694 1 81 GLN HA 1 83 GLU H . . 5.500 4.520 4.262 4.767 . 0 0 "[ . 1 . 2]" 1
1695 1 81 GLN HB2 1 82 PRO HD2 . . 4.410 3.734 3.506 4.058 . 0 0 "[ . 1 . 2]" 1
1696 1 81 GLN HB2 1 82 PRO HD3 . . 4.670 4.511 4.222 4.740 0.070 9 0 "[ . 1 . 2]" 1
1697 1 81 GLN HB2 1 83 GLU H . . 5.500 3.737 3.227 4.072 . 0 0 "[ . 1 . 2]" 1
1698 1 81 GLN HB3 1 81 GLN HE22 . . 5.500 4.405 4.308 4.740 . 0 0 "[ . 1 . 2]" 1
1699 1 81 GLN HB3 1 82 PRO HD2 . . 5.050 2.194 1.953 2.529 . 0 0 "[ . 1 . 2]" 1
1700 1 81 GLN HB3 1 82 PRO HD3 . . 5.080 3.264 2.920 3.523 . 0 0 "[ . 1 . 2]" 1
1701 1 81 GLN HB3 1 83 GLU H . . 5.260 3.252 2.934 3.504 . 0 0 "[ . 1 . 2]" 1
1702 1 81 GLN HB3 1 84 ASP H . . 5.250 4.034 3.470 4.249 . 0 0 "[ . 1 . 2]" 1
1703 1 81 GLN HG3 1 82 PRO HD2 . . 5.260 4.439 4.065 4.781 . 0 0 "[ . 1 . 2]" 1
1704 1 82 PRO HA 1 84 ASP H . . 5.430 3.925 3.756 4.101 . 0 0 "[ . 1 . 2]" 1
1705 1 82 PRO HA 1 85 LEU H . . 5.500 4.345 3.827 4.898 . 0 0 "[ . 1 . 2]" 1
1706 1 82 PRO HA 1 108 ILE HB . . 5.500 5.091 4.383 5.529 0.029 8 0 "[ . 1 . 2]" 1
1707 1 82 PRO HA 1 108 ILE MD . . 3.900 2.154 1.871 2.806 . 0 0 "[ . 1 . 2]" 1
1708 1 82 PRO HA 1 108 ILE HG13 . . 5.390 4.340 2.311 4.911 . 0 0 "[ . 1 . 2]" 1
1709 1 82 PRO HA 1 108 ILE MG . . 5.060 4.076 3.572 4.793 . 0 0 "[ . 1 . 2]" 1
1710 1 82 PRO HD2 1 83 GLU H . . 4.780 2.999 2.524 3.354 . 0 0 "[ . 1 . 2]" 1
1711 1 82 PRO HD3 1 83 GLU H . . 5.370 4.139 3.884 4.323 . 0 0 "[ . 1 . 2]" 1
1712 1 82 PRO HG2 1 108 ILE MD . . 5.300 5.126 4.737 5.395 0.095 8 0 "[ . 1 . 2]" 1
1713 1 82 PRO HG3 1 83 GLU H . . 5.290 4.371 3.965 4.697 . 0 0 "[ . 1 . 2]" 1
1714 1 83 GLU H 1 83 GLU QG . . 3.740 2.301 1.829 2.889 . 0 0 "[ . 1 . 2]" 1
1715 1 83 GLU H 1 84 ASP H . . 4.370 2.537 2.418 2.692 . 0 0 "[ . 1 . 2]" 1
1716 1 83 GLU H 1 85 LEU H . . 5.500 4.356 4.118 4.635 . 0 0 "[ . 1 . 2]" 1
1717 1 83 GLU HA 1 85 LEU H . . 5.100 3.507 3.210 3.748 . 0 0 "[ . 1 . 2]" 1
1718 1 83 GLU HA 1 85 LEU QB . . 5.340 4.212 3.829 4.571 . 0 0 "[ . 1 . 2]" 1
1719 1 83 GLU QB 1 85 LEU H . . 5.340 4.584 4.398 4.911 . 0 0 "[ . 1 . 2]" 1
1720 1 83 GLU HB2 1 84 ASP H . . 5.500 3.640 3.185 4.276 . 0 0 "[ . 1 . 2]" 1
1721 1 83 GLU HB3 1 84 ASP H . . 5.500 4.220 3.943 4.478 . 0 0 "[ . 1 . 2]" 1
1722 1 83 GLU HG2 1 84 ASP H . . 5.340 4.596 3.348 5.290 . 0 0 "[ . 1 . 2]" 1
1723 1 83 GLU HG3 1 84 ASP H . . 5.340 4.298 2.488 5.413 0.073 7 0 "[ . 1 . 2]" 1
1724 1 84 ASP H 1 84 ASP HB2 . . 4.150 2.488 2.416 2.566 . 0 0 "[ . 1 . 2]" 1
1725 1 84 ASP H 1 85 LEU H . . 3.890 2.486 2.307 2.681 . 0 0 "[ . 1 . 2]" 1
1726 1 84 ASP H 1 85 LEU QB . . 5.040 4.078 3.923 4.232 . 0 0 "[ . 1 . 2]" 1
1727 1 84 ASP H 1 88 TYR HH . . 5.500 5.338 5.098 5.517 0.017 15 0 "[ . 1 . 2]" 1
1728 1 84 ASP H 1 108 ILE MD . . 5.060 4.056 3.505 4.765 . 0 0 "[ . 1 . 2]" 1
1729 1 84 ASP HB2 1 85 LEU H . . 5.290 3.781 3.098 4.032 . 0 0 "[ . 1 . 2]" 1
1730 1 84 ASP HB2 1 88 TYR HH . . 4.990 3.776 3.225 4.159 . 0 0 "[ . 1 . 2]" 1
1731 1 84 ASP HB2 1 108 ILE MD . . 5.500 4.654 4.036 5.237 . 0 0 "[ . 1 . 2]" 1
1732 1 84 ASP HB3 1 85 LEU H . . 5.380 4.311 4.080 4.397 . 0 0 "[ . 1 . 2]" 1
1733 1 84 ASP HB3 1 88 TYR HH . . 5.070 2.276 1.839 2.786 . 0 0 "[ . 1 . 2]" 1
1734 1 85 LEU H 1 85 LEU QB . . 3.360 2.206 2.164 2.242 . 0 0 "[ . 1 . 2]" 1
1735 1 85 LEU H 1 85 LEU MD1 . . 5.110 4.176 4.085 4.230 . 0 0 "[ . 1 . 2]" 1
1736 1 85 LEU H 1 85 LEU QD . . 4.470 3.728 3.682 3.769 . 0 0 "[ . 1 . 2]" 1
1737 1 85 LEU H 1 85 LEU MD2 . . 5.110 4.194 4.100 4.258 . 0 0 "[ . 1 . 2]" 1
1738 1 85 LEU H 1 85 LEU HG . . 4.490 4.484 4.382 4.518 0.028 8 0 "[ . 1 . 2]" 1
1739 1 85 LEU H 1 86 ALA H . . 5.070 4.492 4.430 4.552 . 0 0 "[ . 1 . 2]" 1
1740 1 85 LEU H 1 88 TYR HH . . 5.500 5.060 4.673 5.553 0.053 16 0 "[ . 1 . 2]" 1
1741 1 85 LEU H 1 108 ILE MD . . 4.480 3.692 3.093 4.510 0.030 8 0 "[ . 1 . 2]" 1
1742 1 85 LEU H 1 108 ILE HG13 . . 5.500 4.808 4.177 5.509 0.009 8 0 "[ . 1 . 2]" 1
1743 1 85 LEU HA 1 85 LEU MD1 . . 4.410 3.403 2.098 3.926 . 0 0 "[ . 1 . 2]" 1
1744 1 85 LEU HA 1 85 LEU MD2 . . 4.410 3.176 2.164 3.909 . 0 0 "[ . 1 . 2]" 1
1745 1 85 LEU HA 1 86 ALA H . . 3.470 2.210 2.114 2.289 . 0 0 "[ . 1 . 2]" 1
1746 1 85 LEU HA 1 88 TYR QE . . 4.490 3.744 3.434 4.107 . 0 0 "[ . 1 . 2]" 1
1747 1 85 LEU HA 1 106 LEU HB2 . . 5.310 5.153 4.701 5.384 0.074 19 0 "[ . 1 . 2]" 1
1748 1 85 LEU HA 1 106 LEU HB3 . . 5.010 3.677 3.119 3.979 . 0 0 "[ . 1 . 2]" 1
1749 1 85 LEU HA 1 106 LEU QD . . 4.100 2.291 1.905 3.183 . 0 0 "[ . 1 . 2]" 1
1750 1 85 LEU QB 1 108 ILE MD . . 4.140 2.452 2.109 3.287 . 0 0 "[ . 1 . 2]" 1
1751 1 85 LEU QD 1 86 ALA H . . 4.040 2.574 2.324 2.715 . 0 0 "[ . 1 . 2]" 1
1752 1 85 LEU QD 1 106 LEU HB3 . . 5.440 3.783 3.043 4.468 . 0 0 "[ . 1 . 2]" 1
1753 1 85 LEU QD 1 107 GLU HA . . 4.110 2.276 1.902 2.612 . 0 0 "[ . 1 . 2]" 1
1754 1 85 LEU QD 1 107 GLU HB2 . . 5.420 4.416 4.145 4.676 . 0 0 "[ . 1 . 2]" 1
1755 1 85 LEU QD 1 107 GLU HB3 . . 5.200 3.574 3.141 3.970 . 0 0 "[ . 1 . 2]" 1
1756 1 85 LEU QD 1 107 GLU QG . . 4.770 3.334 2.638 4.021 . 0 0 "[ . 1 . 2]" 1
1757 1 85 LEU QD 1 108 ILE H . . 3.870 2.287 1.869 2.769 . 0 0 "[ . 1 . 2]" 1
1758 1 85 LEU MD1 1 107 GLU QG . . 5.460 4.061 3.427 4.897 . 0 0 "[ . 1 . 2]" 1
1759 1 85 LEU MD1 1 108 ILE H . . 4.660 2.424 1.875 4.593 . 0 0 "[ . 1 . 2]" 1
1760 1 85 LEU MD2 1 107 GLU QG . . 5.460 3.804 2.742 5.500 0.040 1 0 "[ . 1 . 2]" 1
1761 1 85 LEU MD2 1 108 ILE H . . 4.660 3.540 2.515 4.148 . 0 0 "[ . 1 . 2]" 1
1762 1 85 LEU HG 1 86 ALA H . . 5.270 3.686 3.206 4.932 . 0 0 "[ . 1 . 2]" 1
1763 1 85 LEU HG 1 107 GLU HA . . 4.580 2.859 1.913 4.590 0.010 20 0 "[ . 1 . 2]" 1
1764 1 85 LEU HG 1 108 ILE MD . . 5.410 4.071 3.595 4.784 . 0 0 "[ . 1 . 2]" 1
1765 1 86 ALA H 1 88 TYR QE . . 4.990 2.988 2.540 3.620 . 0 0 "[ . 1 . 2]" 1
1766 1 86 ALA H 1 88 TYR HH . . 5.500 4.614 4.183 5.264 . 0 0 "[ . 1 . 2]" 1
1767 1 86 ALA H 1 106 LEU H . . 4.800 3.986 3.660 4.491 . 0 0 "[ . 1 . 2]" 1
1768 1 86 ALA H 1 106 LEU HB2 . . 4.630 4.155 3.792 4.434 . 0 0 "[ . 1 . 2]" 1
1769 1 86 ALA H 1 106 LEU HB3 . . 4.380 2.499 2.143 2.703 . 0 0 "[ . 1 . 2]" 1
1770 1 86 ALA H 1 106 LEU QD . . 4.400 2.588 2.209 3.265 . 0 0 "[ . 1 . 2]" 1
1771 1 86 ALA H 1 106 LEU HG . . 4.620 3.993 3.639 4.738 0.118 9 0 "[ . 1 . 2]" 1
1772 1 86 ALA MB 1 87 THR H . . 3.230 2.218 1.997 2.468 . 0 0 "[ . 1 . 2]" 1
1773 1 86 ALA MB 1 87 THR HA . . 4.990 4.102 4.044 4.163 . 0 0 "[ . 1 . 2]" 1
1774 1 86 ALA MB 1 88 TYR HH . . 4.070 3.681 3.206 4.091 0.021 13 0 "[ . 1 . 2]" 1
1775 1 87 THR H 1 87 THR HB . . 4.160 2.471 2.280 2.568 . 0 0 "[ . 1 . 2]" 1
1776 1 87 THR H 1 88 TYR H . . 5.500 4.436 4.312 4.566 . 0 0 "[ . 1 . 2]" 1
1777 1 87 THR H 1 105 LYS QD . . 5.340 4.781 4.164 5.508 0.168 5 0 "[ . 1 . 2]" 1
1778 1 87 THR H 1 106 LEU H . . 5.500 4.880 4.559 5.150 . 0 0 "[ . 1 . 2]" 1
1779 1 87 THR HA 1 88 TYR QD . . 5.180 3.779 3.332 4.170 . 0 0 "[ . 1 . 2]" 1
1780 1 87 THR HA 1 105 LYS HA . . 3.950 2.553 2.221 2.823 . 0 0 "[ . 1 . 2]" 1
1781 1 87 THR HA 1 105 LYS QD . . 5.340 3.183 2.579 4.475 . 0 0 "[ . 1 . 2]" 1
1782 1 87 THR HA 1 105 LYS HG2 . . 5.500 4.762 2.961 5.590 0.090 13 0 "[ . 1 . 2]" 1
1783 1 87 THR HA 1 105 LYS HG3 . . 5.480 4.672 3.261 5.495 0.015 19 0 "[ . 1 . 2]" 1
1784 1 87 THR HA 1 106 LEU H . . 4.000 2.718 2.282 2.967 . 0 0 "[ . 1 . 2]" 1
1785 1 87 THR HB 1 88 TYR H . . 5.500 4.202 4.032 4.300 . 0 0 "[ . 1 . 2]" 1
1786 1 87 THR HB 1 89 TYR QE . . 4.020 3.674 2.389 4.062 0.042 17 0 "[ . 1 . 2]" 1
1787 1 87 THR MG 1 88 TYR H . . 4.050 2.833 2.515 3.058 . 0 0 "[ . 1 . 2]" 1
1788 1 87 THR MG 1 89 TYR QD . . 5.500 2.576 2.185 3.667 . 0 0 "[ . 1 . 2]" 1
1789 1 87 THR MG 1 89 TYR QE . . 3.730 3.398 2.632 3.765 0.035 8 0 "[ . 1 . 2]" 1
1790 1 87 THR MG 1 104 THR H . . 4.240 3.989 3.634 4.289 0.049 13 0 "[ . 1 . 2]" 1
1791 1 87 THR MG 1 104 THR MG . . 4.920 4.711 4.497 4.940 0.020 18 0 "[ . 1 . 2]" 1
1792 1 87 THR MG 1 105 LYS H . . 5.360 4.567 4.068 4.870 . 0 0 "[ . 1 . 2]" 1
1793 1 87 THR MG 1 105 LYS HA . . 4.530 2.693 2.121 2.994 . 0 0 "[ . 1 . 2]" 1
1794 1 87 THR MG 1 105 LYS HB2 . . 5.190 3.715 2.737 4.661 . 0 0 "[ . 1 . 2]" 1
1795 1 87 THR MG 1 105 LYS HB3 . . 5.500 4.711 4.020 5.106 . 0 0 "[ . 1 . 2]" 1
1796 1 87 THR MG 1 105 LYS QD . . 5.060 3.153 1.936 4.589 . 0 0 "[ . 1 . 2]" 1
1797 1 87 THR MG 1 105 LYS HG2 . . 5.500 4.032 2.088 5.254 . 0 0 "[ . 1 . 2]" 1
1798 1 87 THR MG 1 105 LYS HG3 . . 5.500 4.274 2.665 5.142 . 0 0 "[ . 1 . 2]" 1
1799 1 87 THR MG 1 106 LEU H . . 5.230 4.148 3.768 4.463 . 0 0 "[ . 1 . 2]" 1
1800 1 88 TYR H 1 88 TYR QD . . 4.040 2.849 2.494 3.145 . 0 0 "[ . 1 . 2]" 1
1801 1 88 TYR H 1 89 TYR H . . 5.490 4.438 4.392 4.494 . 0 0 "[ . 1 . 2]" 1
1802 1 88 TYR H 1 104 THR H . . 4.850 4.790 4.307 4.910 0.060 19 0 "[ . 1 . 2]" 1
1803 1 88 TYR H 1 104 THR HB . . 4.840 3.833 3.648 4.113 . 0 0 "[ . 1 . 2]" 1
1804 1 88 TYR H 1 104 THR MG . . 4.700 3.775 3.371 4.062 . 0 0 "[ . 1 . 2]" 1
1805 1 88 TYR H 1 105 LYS HA . . 4.790 3.343 2.979 3.501 . 0 0 "[ . 1 . 2]" 1
1806 1 88 TYR HA 1 89 TYR HA . . 5.140 4.285 4.207 4.358 . 0 0 "[ . 1 . 2]" 1
1807 1 88 TYR HA 1 89 TYR QD . . 4.160 3.997 2.643 4.253 0.093 13 0 "[ . 1 . 2]" 1
1808 1 88 TYR HB2 1 89 TYR H . . 5.430 4.035 3.955 4.136 . 0 0 "[ . 1 . 2]" 1
1809 1 88 TYR HB2 1 104 THR HB . . 5.080 3.466 3.376 3.593 . 0 0 "[ . 1 . 2]" 1
1810 1 88 TYR HB2 1 104 THR MG . . 4.730 3.462 3.067 3.758 . 0 0 "[ . 1 . 2]" 1
1811 1 88 TYR HB3 1 89 TYR H . . 4.370 2.889 2.760 3.031 . 0 0 "[ . 1 . 2]" 1
1812 1 88 TYR HB3 1 104 THR HB . . 5.230 4.550 4.286 4.789 . 0 0 "[ . 1 . 2]" 1
1813 1 88 TYR HB3 1 104 THR MG . . 5.110 4.730 4.287 5.065 . 0 0 "[ . 1 . 2]" 1
1814 1 88 TYR QD 1 88 TYR HH . . 4.440 4.286 4.239 4.371 . 0 0 "[ . 1 . 2]" 1
1815 1 88 TYR QD 1 104 THR HB . . 5.010 5.051 4.861 5.116 0.106 18 0 "[ . 1 . 2]" 1
1816 1 88 TYR QD 1 106 LEU H . . 5.500 3.715 3.331 3.991 . 0 0 "[ . 1 . 2]" 1
1817 1 88 TYR QD 1 106 LEU HB2 . . 4.390 2.461 2.200 2.657 . 0 0 "[ . 1 . 2]" 1
1818 1 88 TYR QD 1 106 LEU HB3 . . 4.450 2.813 2.421 3.106 . 0 0 "[ . 1 . 2]" 1
1819 1 88 TYR QD 1 106 LEU MD1 . . 3.960 3.961 2.856 4.074 0.114 4 0 "[ . 1 . 2]" 1
1820 1 88 TYR QD 1 106 LEU QD . . 3.450 3.046 2.741 3.543 0.093 2 0 "[ . 1 . 2]" 1
1821 1 88 TYR QD 1 106 LEU MD2 . . 3.960 3.262 2.789 3.980 0.020 19 0 "[ . 1 . 2]" 1
1822 1 88 TYR QD 1 106 LEU HG . . 4.950 4.469 3.103 5.003 0.053 16 0 "[ . 1 . 2]" 1
1823 1 88 TYR QE 1 106 LEU HB2 . . 4.120 3.408 2.910 3.787 . 0 0 "[ . 1 . 2]" 1
1824 1 88 TYR QE 1 106 LEU QD . . 3.480 2.098 1.715 2.657 . 0 0 "[ . 1 . 2]" 1
1825 1 88 TYR HH 1 106 LEU QD . . 4.360 3.292 2.700 4.367 0.007 19 0 "[ . 1 . 2]" 1
1826 1 89 TYR H 1 89 TYR QD . . 4.600 3.427 2.200 3.701 . 0 0 "[ . 1 . 2]" 1
1827 1 89 TYR H 1 90 CYS H . . 5.500 4.307 4.256 4.353 . 0 0 "[ . 1 . 2]" 1
1828 1 89 TYR HA 1 103 GLY H . . 5.500 4.827 4.284 5.341 . 0 0 "[ . 1 . 2]" 1
1829 1 89 TYR HA 1 104 THR H . . 5.500 4.563 4.322 4.954 . 0 0 "[ . 1 . 2]" 1
1830 1 89 TYR HA 1 104 THR HB . . 5.260 4.428 4.112 4.751 . 0 0 "[ . 1 . 2]" 1
1831 1 89 TYR QB 1 90 CYS H . . 4.460 2.117 1.888 2.348 . 0 0 "[ . 1 . 2]" 1
1832 1 89 TYR QB 1 101 GLY H . . 5.340 2.887 2.180 3.402 . 0 0 "[ . 1 . 2]" 1
1833 1 89 TYR QB 1 102 GLN QE . . 5.180 5.158 4.756 5.429 0.249 4 0 "[ . 1 . 2]" 1
1834 1 89 TYR HB2 1 90 CYS H . . 5.130 2.234 1.902 3.375 . 0 0 "[ . 1 . 2]" 1
1835 1 89 TYR HB3 1 90 CYS H . . 5.130 3.316 2.341 3.673 . 0 0 "[ . 1 . 2]" 1
1836 1 89 TYR QD 1 100 PHE HB3 . . 3.630 2.690 1.827 3.619 . 0 0 "[ . 1 . 2]" 1
1837 1 89 TYR QD 1 101 GLY H . . 5.220 3.961 3.134 4.501 . 0 0 "[ . 1 . 2]" 1
1838 1 89 TYR QE 2 45 ALA HA . . 4.010 3.656 2.508 4.066 0.056 3 0 "[ . 1 . 2]" 1
1839 1 89 TYR QE 2 45 ALA MB . . 3.670 3.465 2.211 3.769 0.099 12 0 "[ . 1 . 2]" 1
1840 1 90 CYS H 1 91 GLN H . . 5.500 4.370 4.312 4.506 . 0 0 "[ . 1 . 2]" 1
1841 1 90 CYS H 1 100 PHE HB3 . . 5.500 4.087 3.692 4.725 . 0 0 "[ . 1 . 2]" 1
1842 1 90 CYS H 1 101 GLY H . . 5.080 2.488 1.993 2.703 . 0 0 "[ . 1 . 2]" 1
1843 1 90 CYS H 1 101 GLY QA . . 5.500 3.094 2.485 3.512 . 0 0 "[ . 1 . 2]" 1
1844 1 90 CYS HB2 1 91 GLN H . . 4.850 3.057 2.646 3.310 . 0 0 "[ . 1 . 2]" 1
1845 1 90 CYS HB3 1 91 GLN H . . 5.040 4.054 3.944 4.159 . 0 0 "[ . 1 . 2]" 1
1846 1 91 GLN H 1 91 GLN QE . . 5.460 5.404 4.646 5.705 0.245 9 0 "[ . 1 . 2]" 1
1847 1 91 GLN H 1 91 GLN HG2 . . 5.080 4.093 2.880 4.683 . 0 0 "[ . 1 . 2]" 1
1848 1 91 GLN H 1 91 GLN HG3 . . 5.250 3.756 2.891 4.540 . 0 0 "[ . 1 . 2]" 1
1849 1 91 GLN H 1 92 GLN H . . 5.500 4.259 4.150 4.357 . 0 0 "[ . 1 . 2]" 1
1850 1 91 GLN HA 1 100 PHE HA . . 4.560 2.672 2.365 3.001 . 0 0 "[ . 1 . 2]" 1
1851 1 91 GLN HA 1 100 PHE HB3 . . 5.410 4.739 4.372 5.224 . 0 0 "[ . 1 . 2]" 1
1852 1 91 GLN HA 1 101 GLY H . . 5.500 3.760 3.383 4.115 . 0 0 "[ . 1 . 2]" 1
1853 1 91 GLN HB2 1 92 GLN H . . 5.210 3.735 3.103 4.325 . 0 0 "[ . 1 . 2]" 1
1854 1 91 GLN HB2 1 98 TYR HB3 . . 5.500 4.664 3.502 5.617 0.117 14 0 "[ . 1 . 2]" 1
1855 1 91 GLN HB3 1 92 GLN H . . 4.690 4.237 3.992 4.469 . 0 0 "[ . 1 . 2]" 1
1856 1 91 GLN QE 1 93 TYR H . . 5.500 5.174 4.397 5.763 0.263 7 0 "[ . 1 . 2]" 1
1857 1 91 GLN QE 1 93 TYR HB3 . . 4.900 3.651 2.536 4.701 . 0 0 "[ . 1 . 2]" 1
1858 1 91 GLN QE 1 98 TYR HB2 . . 5.500 2.762 2.037 3.947 . 0 0 "[ . 1 . 2]" 1
1859 1 91 GLN QE 1 98 TYR HB3 . . 5.480 2.099 1.609 3.610 . 0 0 "[ . 1 . 2]" 1
1860 1 91 GLN QE 1 99 THR H . . 5.500 4.322 2.219 5.562 0.062 18 0 "[ . 1 . 2]" 1
1861 1 91 GLN HG2 1 92 GLN H . . 5.340 4.562 2.991 5.134 . 0 0 "[ . 1 . 2]" 1
1862 1 91 GLN HG2 1 100 PHE QE . . 5.500 3.254 2.403 5.049 . 0 0 "[ . 1 . 2]" 1
1863 1 91 GLN HG3 1 93 TYR H . . 5.500 5.112 4.412 5.628 0.128 18 0 "[ . 1 . 2]" 1
1864 1 91 GLN HG3 1 100 PHE QD . . 4.580 4.595 4.223 4.722 0.142 14 0 "[ . 1 . 2]" 1
1865 1 92 GLN H 1 92 GLN HE22 . . 5.500 4.666 4.234 4.861 . 0 0 "[ . 1 . 2]" 1
1866 1 92 GLN H 1 92 GLN HG2 . . 4.830 3.757 3.672 3.865 . 0 0 "[ . 1 . 2]" 1
1867 1 92 GLN H 1 92 GLN HG3 . . 4.610 2.275 2.163 2.400 . 0 0 "[ . 1 . 2]" 1
1868 1 92 GLN H 1 93 TYR H . . 5.500 4.488 4.119 4.603 . 0 0 "[ . 1 . 2]" 1
1869 1 92 GLN H 1 99 THR H . . 5.090 3.417 3.187 3.771 . 0 0 "[ . 1 . 2]" 1
1870 1 92 GLN HA 1 92 GLN HE21 . . 5.500 5.093 5.001 5.432 . 0 0 "[ . 1 . 2]" 1
1871 1 92 GLN HA 1 92 GLN HE22 . . 5.500 5.592 5.543 5.709 0.209 4 0 "[ . 1 . 2]" 1
1872 1 92 GLN HA 1 93 TYR QD . . 5.500 3.206 2.845 3.606 . 0 0 "[ . 1 . 2]" 1
1873 1 92 GLN HA 1 94 ASP H . . 5.360 3.970 3.608 4.172 . 0 0 "[ . 1 . 2]" 1
1874 1 92 GLN HB2 1 93 TYR H . . 4.850 2.768 2.600 3.435 . 0 0 "[ . 1 . 2]" 1
1875 1 92 GLN HB2 1 94 ASP H . . 5.500 2.663 2.428 2.880 . 0 0 "[ . 1 . 2]" 1
1876 1 92 GLN HB3 1 93 TYR H . . 5.500 3.701 3.575 3.878 . 0 0 "[ . 1 . 2]" 1
1877 1 92 GLN HB3 1 94 ASP H . . 5.500 4.331 4.079 4.569 . 0 0 "[ . 1 . 2]" 1
1878 1 92 GLN HE21 1 95 ASN H . . 4.970 3.207 2.519 4.923 . 0 0 "[ . 1 . 2]" 1
1879 1 92 GLN HE21 1 98 TYR HA . . 5.370 3.879 2.429 4.452 . 0 0 "[ . 1 . 2]" 1
1880 1 92 GLN HE21 1 99 THR MG . . 5.500 5.167 3.517 5.540 0.040 16 0 "[ . 1 . 2]" 1
1881 1 92 GLN HE22 1 95 ASN H . . 5.500 3.073 2.438 3.840 . 0 0 "[ . 1 . 2]" 1
1882 1 92 GLN HE22 1 99 THR H . . 4.430 3.581 2.991 3.967 . 0 0 "[ . 1 . 2]" 1
1883 1 92 GLN HE22 1 99 THR MG . . 4.800 4.461 3.798 4.658 . 0 0 "[ . 1 . 2]" 1
1884 1 92 GLN HG3 1 99 THR H . . 4.850 3.653 3.181 4.026 . 0 0 "[ . 1 . 2]" 1
1885 1 93 TYR H 1 93 TYR QD . . 3.920 2.566 1.755 2.773 . 0 0 "[ . 1 . 2]" 1
1886 1 93 TYR H 1 94 ASP H . . 4.410 2.417 2.233 2.842 . 0 0 "[ . 1 . 2]" 1
1887 1 93 TYR H 1 95 ASN H . . 5.500 4.841 4.671 5.256 . 0 0 "[ . 1 . 2]" 1
1888 1 93 TYR HA 1 93 TYR QD . . 4.240 3.747 3.702 3.775 . 0 0 "[ . 1 . 2]" 1
1889 1 93 TYR HA 1 98 TYR QD . . 3.770 2.952 2.665 3.131 . 0 0 "[ . 1 . 2]" 1
1890 1 93 TYR HA 1 98 TYR QE . . 4.240 2.831 2.644 3.057 . 0 0 "[ . 1 . 2]" 1
1891 1 93 TYR HB2 1 98 TYR QE . . 4.360 3.691 3.414 3.913 . 0 0 "[ . 1 . 2]" 1
1892 1 93 TYR HB3 1 94 ASP H . . 5.500 4.567 4.507 4.618 . 0 0 "[ . 1 . 2]" 1
1893 1 93 TYR HB3 1 98 TYR QD . . 4.370 4.394 4.249 4.449 0.079 16 0 "[ . 1 . 2]" 1
1894 1 93 TYR HB3 2 98 TYR QE . . 4.290 3.101 2.824 3.530 . 0 0 "[ . 1 . 2]" 1
1895 1 93 TYR QD 1 94 ASP H . . 4.430 4.409 4.250 4.501 0.071 3 0 "[ . 1 . 2]" 1
1896 1 93 TYR QD 2 96 LEU MD1 . . 5.110 4.990 4.676 5.135 0.025 1 0 "[ . 1 . 2]" 1
1897 1 93 TYR QD 2 96 LEU QD . . 4.380 4.040 3.749 4.285 . 0 0 "[ . 1 . 2]" 1
1898 1 93 TYR QD 2 96 LEU MD2 . . 5.110 4.272 3.947 4.596 . 0 0 "[ . 1 . 2]" 1
1899 1 93 TYR QD 2 98 TYR QE . . 4.010 2.893 2.627 3.011 . 0 0 "[ . 1 . 2]" 1
1900 1 93 TYR QE 2 96 LEU MD1 . . 4.650 3.449 3.067 3.678 . 0 0 "[ . 1 . 2]" 1
1901 1 93 TYR QE 2 96 LEU QD . . 3.760 3.057 2.816 3.323 . 0 0 "[ . 1 . 2]" 1
1902 1 93 TYR QE 2 96 LEU MD2 . . 4.330 3.432 3.019 3.825 . 0 0 "[ . 1 . 2]" 1
1903 1 93 TYR QE 2 98 TYR QE . . 3.400 3.417 3.242 3.474 0.074 7 0 "[ . 1 . 2]" 1
1904 1 94 ASP H 1 95 ASN H . . 3.950 2.524 2.360 2.694 . 0 0 "[ . 1 . 2]" 1
1905 1 94 ASP H 1 98 TYR QD . . 5.500 3.967 3.665 4.377 . 0 0 "[ . 1 . 2]" 1
1906 1 94 ASP H 1 98 TYR QE . . 5.500 3.537 3.305 3.780 . 0 0 "[ . 1 . 2]" 1
1907 1 94 ASP QB 1 95 ASN HA . . 5.320 4.588 4.493 4.698 . 0 0 "[ . 1 . 2]" 1
1908 1 95 ASN H 1 95 ASN HB3 . . 4.010 2.849 2.722 2.943 . 0 0 "[ . 1 . 2]" 1
1909 1 95 ASN H 1 98 TYR QD . . 4.530 3.294 3.038 3.519 . 0 0 "[ . 1 . 2]" 1
1910 1 95 ASN H 1 98 TYR QE . . 4.780 2.540 2.329 2.852 . 0 0 "[ . 1 . 2]" 1
1911 1 95 ASN HA 1 96 LEU HA . . 5.500 4.351 4.297 4.387 . 0 0 "[ . 1 . 2]" 1
1912 1 95 ASN HA 1 96 LEU HB2 . . 5.500 4.485 4.364 4.587 . 0 0 "[ . 1 . 2]" 1
1913 1 95 ASN HB2 1 96 LEU H . . 4.270 4.037 3.900 4.199 . 0 0 "[ . 1 . 2]" 1
1914 1 95 ASN HB3 1 96 LEU H . . 4.060 3.910 3.734 4.080 0.020 1 0 "[ . 1 . 2]" 1
1915 1 95 ASN HD21 1 96 LEU H . . 5.500 4.402 3.243 5.143 . 0 0 "[ . 1 . 2]" 1
1916 1 95 ASN HD22 1 96 LEU H . . 5.460 4.208 3.421 4.842 . 0 0 "[ . 1 . 2]" 1
1917 1 96 LEU H 1 96 LEU HB2 . . 4.000 2.356 2.318 2.417 . 0 0 "[ . 1 . 2]" 1
1918 1 96 LEU H 1 96 LEU MD1 . . 4.630 3.625 3.459 3.729 . 0 0 "[ . 1 . 2]" 1
1919 1 96 LEU H 1 96 LEU MD2 . . 4.770 3.772 3.667 3.888 . 0 0 "[ . 1 . 2]" 1
1920 1 96 LEU H 1 96 LEU HG . . 4.290 2.691 2.561 2.871 . 0 0 "[ . 1 . 2]" 1
1921 1 96 LEU H 1 97 PRO HA . . 5.500 4.782 4.664 4.907 . 0 0 "[ . 1 . 2]" 1
1922 1 96 LEU H 1 98 TYR QE . . 5.450 3.657 3.485 3.830 . 0 0 "[ . 1 . 2]" 1
1923 1 96 LEU HA 1 96 LEU MD2 . . 3.950 2.108 2.072 2.148 . 0 0 "[ . 1 . 2]" 1
1924 1 96 LEU HA 1 98 TYR H . . 4.630 3.104 2.959 3.225 . 0 0 "[ . 1 . 2]" 1
1925 1 96 LEU HA 1 98 TYR QD . . 3.960 3.176 2.962 3.365 . 0 0 "[ . 1 . 2]" 1
1926 1 96 LEU HA 2 48 LEU QD . . 5.300 4.262 3.815 4.658 . 0 0 "[ . 1 . 2]" 1
1927 1 96 LEU HB2 1 97 PRO HA . . 5.110 3.862 3.758 3.945 . 0 0 "[ . 1 . 2]" 1
1928 1 96 LEU HB2 2 51 TYR QE . . 5.500 4.521 3.961 4.994 . 0 0 "[ . 1 . 2]" 1
1929 1 96 LEU HB3 1 97 PRO HA . . 4.870 2.382 2.221 2.481 . 0 0 "[ . 1 . 2]" 1
1930 1 96 LEU HB3 1 97 PRO QB . . 5.500 3.733 3.466 3.946 . 0 0 "[ . 1 . 2]" 1
1931 1 96 LEU HB3 2 48 LEU QD . . 5.100 4.218 3.663 4.653 . 0 0 "[ . 1 . 2]" 1
1932 1 96 LEU HB3 2 51 TYR QD . . 4.820 4.071 3.535 4.398 . 0 0 "[ . 1 . 2]" 1
1933 1 96 LEU HB3 2 51 TYR QE . . 5.500 3.916 3.257 4.379 . 0 0 "[ . 1 . 2]" 1
1934 1 96 LEU QD 2 36 ILE MD . . 4.010 3.223 2.963 3.674 . 0 0 "[ . 1 . 2]" 1
1935 1 96 LEU QD 2 36 ILE MG . . 5.360 3.721 3.537 4.072 . 0 0 "[ . 1 . 2]" 1
1936 1 96 LEU QD 2 48 LEU QD . . 4.280 2.849 2.425 3.193 . 0 0 "[ . 1 . 2]" 1
1937 1 96 LEU QD 2 51 TYR HB2 . . 5.440 2.504 2.244 2.725 . 0 0 "[ . 1 . 2]" 1
1938 1 96 LEU QD 2 51 TYR HB3 . . 5.440 3.167 2.787 3.400 . 0 0 "[ . 1 . 2]" 1
1939 1 96 LEU QD 2 51 TYR QD . . 3.500 2.275 1.935 2.588 . 0 0 "[ . 1 . 2]" 1
1940 1 96 LEU QD 2 51 TYR QE . . 3.690 2.751 2.301 2.973 . 0 0 "[ . 1 . 2]" 1
1941 1 96 LEU QD 2 93 TYR QD . . 4.380 4.054 3.772 4.258 . 0 0 "[ . 1 . 2]" 1
1942 1 96 LEU QD 2 93 TYR QE . . 3.760 3.070 2.577 3.367 . 0 0 "[ . 1 . 2]" 1
1943 1 96 LEU MD1 1 97 PRO HA . . 5.460 4.110 3.944 4.294 . 0 0 "[ . 1 . 2]" 1
1944 1 96 LEU MD1 2 51 TYR HB2 . . 5.350 3.233 2.884 3.537 . 0 0 "[ . 1 . 2]" 1
1945 1 96 LEU MD1 2 51 TYR HB3 . . 5.440 4.341 3.711 4.727 . 0 0 "[ . 1 . 2]" 1
1946 1 96 LEU MD1 2 51 TYR QD . . 4.250 2.336 1.996 2.716 . 0 0 "[ . 1 . 2]" 1
1947 1 96 LEU MD1 2 51 TYR QE . . 4.260 2.794 2.324 3.030 . 0 0 "[ . 1 . 2]" 1
1948 1 96 LEU MD1 2 52 ASP H . . 5.500 3.896 3.391 4.340 . 0 0 "[ . 1 . 2]" 1
1949 1 96 LEU MD1 2 93 TYR QD . . 5.110 4.993 4.506 5.140 0.030 14 0 "[ . 1 . 2]" 1
1950 1 96 LEU MD1 2 93 TYR QE . . 4.650 3.447 2.721 3.716 . 0 0 "[ . 1 . 2]" 1
1951 1 96 LEU MD2 1 97 PRO HA . . 4.320 2.471 2.299 2.664 . 0 0 "[ . 1 . 2]" 1
1952 1 96 LEU MD2 1 97 PRO QB . . 5.500 3.817 3.566 4.063 . 0 0 "[ . 1 . 2]" 1
1953 1 96 LEU MD2 1 98 TYR H . . 4.140 2.722 2.474 2.985 . 0 0 "[ . 1 . 2]" 1
1954 1 96 LEU MD2 1 98 TYR HA . . 5.500 4.252 4.056 4.521 . 0 0 "[ . 1 . 2]" 1
1955 1 96 LEU MD2 1 98 TYR QD . . 4.200 2.974 2.867 3.143 . 0 0 "[ . 1 . 2]" 1
1956 1 96 LEU MD2 1 98 TYR QE . . 4.360 2.732 2.677 2.792 . 0 0 "[ . 1 . 2]" 1
1957 1 96 LEU MD2 2 36 ILE HA . . 5.500 5.427 5.222 5.542 0.042 20 0 "[ . 1 . 2]" 1
1958 1 96 LEU MD2 2 36 ILE MG . . 4.140 3.812 3.624 4.171 0.031 18 0 "[ . 1 . 2]" 1
1959 1 96 LEU MD2 2 48 LEU QD . . 4.150 2.889 2.447 3.246 . 0 0 "[ . 1 . 2]" 1
1960 1 96 LEU MD2 2 51 TYR HB2 . . 4.860 2.627 2.287 2.974 . 0 0 "[ . 1 . 2]" 1
1961 1 96 LEU MD2 2 51 TYR HB3 . . 4.800 3.257 2.852 3.500 . 0 0 "[ . 1 . 2]" 1
1962 1 96 LEU MD2 2 51 TYR QD . . 4.250 3.169 2.602 3.456 . 0 0 "[ . 1 . 2]" 1
1963 1 96 LEU MD2 2 51 TYR QE . . 4.670 4.128 3.694 4.404 . 0 0 "[ . 1 . 2]" 1
1964 1 96 LEU MD2 2 52 ASP H . . 5.500 3.931 3.193 4.648 . 0 0 "[ . 1 . 2]" 1
1965 1 96 LEU MD2 2 93 TYR QD . . 5.110 4.292 4.026 4.544 . 0 0 "[ . 1 . 2]" 1
1966 1 96 LEU MD2 2 93 TYR QE . . 4.330 3.466 3.098 3.852 . 0 0 "[ . 1 . 2]" 1
1967 1 96 LEU HG 1 97 PRO HA . . 5.500 4.376 4.190 4.545 . 0 0 "[ . 1 . 2]" 1
1968 1 96 LEU HG 1 98 TYR QE . . 4.380 3.404 3.189 3.723 . 0 0 "[ . 1 . 2]" 1
1969 1 97 PRO HA 2 48 LEU MD1 . . 5.500 2.924 2.417 3.369 . 0 0 "[ . 1 . 2]" 1
1970 1 97 PRO HA 2 48 LEU QD . . 4.460 2.883 2.396 3.311 . 0 0 "[ . 1 . 2]" 1
1971 1 97 PRO HA 2 48 LEU MD2 . . 5.500 4.402 3.949 4.871 . 0 0 "[ . 1 . 2]" 1
1972 1 97 PRO HA 2 51 TYR QE . . 5.500 4.666 4.134 5.088 . 0 0 "[ . 1 . 2]" 1
1973 1 97 PRO QB 1 99 THR MG . . 4.940 3.264 2.596 3.776 . 0 0 "[ . 1 . 2]" 1
1974 1 97 PRO QB 2 48 LEU QD . . 4.090 2.204 2.025 2.421 . 0 0 "[ . 1 . 2]" 1
1975 1 97 PRO QB 2 51 TYR QE . . 4.180 3.577 2.498 4.026 . 0 0 "[ . 1 . 2]" 1
1976 1 97 PRO HD2 2 48 LEU QD . . 5.440 5.375 5.038 5.564 0.124 11 0 "[ . 1 . 2]" 1
1977 1 97 PRO HD3 2 51 TYR QE . . 4.890 4.883 4.636 4.966 0.076 6 0 "[ . 1 . 2]" 1
1978 1 97 PRO QG 1 99 THR MG . . 3.950 2.988 2.323 3.968 0.018 9 0 "[ . 1 . 2]" 1
1979 1 97 PRO QG 2 48 LEU QD . . 4.850 3.759 3.576 4.002 . 0 0 "[ . 1 . 2]" 1
1980 1 98 TYR H 1 98 TYR QD . . 4.130 3.335 3.235 3.423 . 0 0 "[ . 1 . 2]" 1
1981 1 98 TYR H 2 48 LEU QD . . 4.090 2.188 1.898 2.405 . 0 0 "[ . 1 . 2]" 1
1982 1 98 TYR HA 1 98 TYR QD . . 3.440 2.111 2.020 2.193 . 0 0 "[ . 1 . 2]" 1
1983 1 98 TYR HA 2 48 LEU QD . . 5.440 4.171 3.970 4.475 . 0 0 "[ . 1 . 2]" 1
1984 1 98 TYR HB2 1 99 THR H . . 5.500 4.078 3.784 4.395 . 0 0 "[ . 1 . 2]" 1
1985 1 98 TYR HB2 2 36 ILE MG . . 5.500 3.865 3.659 4.057 . 0 0 "[ . 1 . 2]" 1
1986 1 98 TYR HB2 2 38 TYR QE . . 4.420 3.992 3.603 4.350 . 0 0 "[ . 1 . 2]" 1
1987 1 98 TYR HB2 2 48 LEU QD . . 5.050 2.740 2.219 3.166 . 0 0 "[ . 1 . 2]" 1
1988 1 98 TYR HB3 1 99 THR H . . 5.300 3.179 2.636 3.821 . 0 0 "[ . 1 . 2]" 1
1989 1 98 TYR HB3 2 36 ILE MG . . 5.500 5.303 5.091 5.517 0.017 12 0 "[ . 1 . 2]" 1
1990 1 98 TYR HB3 2 48 LEU QD . . 5.440 4.124 3.660 4.564 . 0 0 "[ . 1 . 2]" 1
1991 1 98 TYR QD 1 99 THR H . . 4.950 4.012 3.852 4.220 . 0 0 "[ . 1 . 2]" 1
1992 1 98 TYR QD 2 36 ILE HB . . 4.830 4.771 4.200 4.891 0.061 14 0 "[ . 1 . 2]" 1
1993 1 98 TYR QD 2 36 ILE QG . . 4.390 3.423 2.368 3.834 . 0 0 "[ . 1 . 2]" 1
1994 1 98 TYR QD 2 36 ILE MG . . 3.600 3.632 3.505 3.704 0.104 1 0 "[ . 1 . 2]" 1
1995 1 98 TYR QD 2 48 LEU QD . . 4.440 3.683 3.296 4.015 . 0 0 "[ . 1 . 2]" 1
1996 1 98 TYR QE 2 36 ILE MD . . 4.340 2.287 2.095 2.527 . 0 0 "[ . 1 . 2]" 1
1997 1 98 TYR QE 2 93 TYR HB3 . . 4.290 3.129 2.926 3.351 . 0 0 "[ . 1 . 2]" 1
1998 1 98 TYR QE 2 93 TYR QD . . 4.010 2.860 2.670 3.010 . 0 0 "[ . 1 . 2]" 1
1999 1 98 TYR QE 2 93 TYR QE . . 3.400 3.404 3.151 3.512 0.112 7 0 "[ . 1 . 2]" 1
2000 1 99 THR H 1 99 THR MG . . 4.410 2.748 2.471 3.082 . 0 0 "[ . 1 . 2]" 1
2001 1 99 THR H 1 100 PHE H . . 5.440 4.428 4.279 4.559 . 0 0 "[ . 1 . 2]" 1
2002 1 99 THR HA 1 99 THR MG . . 3.730 2.411 2.284 2.462 . 0 0 "[ . 1 . 2]" 1
2003 1 99 THR HB 1 100 PHE H . . 4.470 2.987 2.784 3.135 . 0 0 "[ . 1 . 2]" 1
2004 1 99 THR MG 1 100 PHE H . . 4.470 3.956 3.789 4.055 . 0 0 "[ . 1 . 2]" 1
2005 1 100 PHE H 1 100 PHE QD . . 4.110 2.476 2.248 2.708 . 0 0 "[ . 1 . 2]" 1
2006 1 100 PHE H 1 100 PHE QE . . 4.190 4.320 4.259 4.381 0.191 18 0 "[ . 1 . 2]" 1
2007 1 100 PHE H 2 45 ALA MB . . 5.470 4.416 3.565 5.176 . 0 0 "[ . 1 . 2]" 1
2008 1 100 PHE HB2 1 101 GLY H . . 5.180 3.898 3.642 3.997 . 0 0 "[ . 1 . 2]" 1
2009 1 100 PHE HB2 2 45 ALA MB . . 4.430 2.580 1.889 3.281 . 0 0 "[ . 1 . 2]" 1
2010 1 100 PHE HB3 1 101 GLY H . . 4.880 2.984 2.671 3.106 . 0 0 "[ . 1 . 2]" 1
2011 1 100 PHE HB3 2 45 ALA MB . . 4.380 3.287 2.645 3.883 . 0 0 "[ . 1 . 2]" 1
2012 1 100 PHE QD 2 45 ALA MB . . 4.420 3.405 2.659 4.023 . 0 0 "[ . 1 . 2]" 1
2013 1 100 PHE QD 2 46 PRO HB2 . . 4.690 4.147 3.329 4.691 0.001 19 0 "[ . 1 . 2]" 1
2014 1 100 PHE QD 2 46 PRO HB3 . . 5.500 5.402 4.936 5.587 0.087 18 0 "[ . 1 . 2]" 1
2015 1 100 PHE QD 2 46 PRO QD . . 5.350 3.647 2.987 4.357 . 0 0 "[ . 1 . 2]" 1
2016 1 100 PHE QE 2 38 TYR HB2 . . 4.730 4.764 4.506 4.881 0.151 8 0 "[ . 1 . 2]" 1
2017 1 100 PHE QE 2 38 TYR HB3 . . 4.780 3.944 3.659 4.155 . 0 0 "[ . 1 . 2]" 1
2018 1 100 PHE QE 2 46 PRO HB2 . . 4.690 2.940 2.217 3.619 . 0 0 "[ . 1 . 2]" 1
2019 1 100 PHE QE 2 46 PRO HB3 . . 5.180 4.490 3.797 5.016 . 0 0 "[ . 1 . 2]" 1
2020 1 100 PHE QE 2 46 PRO HG2 . . 5.500 2.952 2.317 3.671 . 0 0 "[ . 1 . 2]" 1
2021 1 100 PHE QE 2 46 PRO HG3 . . 5.500 4.193 3.750 4.958 . 0 0 "[ . 1 . 2]" 1
2022 1 100 PHE HZ 2 46 PRO HG2 . . 5.170 3.575 3.275 4.300 . 0 0 "[ . 1 . 2]" 1
2023 1 100 PHE HZ 2 46 PRO QG . . 4.550 3.427 3.126 3.948 . 0 0 "[ . 1 . 2]" 1
2024 1 100 PHE HZ 2 46 PRO HG3 . . 5.170 4.497 3.945 5.178 0.008 14 0 "[ . 1 . 2]" 1
2025 1 101 GLY H 1 102 GLN H . . 5.360 4.170 3.830 4.623 . 0 0 "[ . 1 . 2]" 1
2026 1 101 GLY H 2 45 ALA MB . . 5.500 5.186 4.450 5.656 0.156 5 0 "[ . 1 . 2]" 1
2027 1 101 GLY QA 1 103 GLY H . . 5.010 3.245 3.049 3.632 . 0 0 "[ . 1 . 2]" 1
2028 1 102 GLN H 1 102 GLN QE . . 5.340 2.144 1.615 2.531 . 0 0 "[ . 1 . 2]" 1
2029 1 102 GLN H 1 102 GLN QG . . 4.330 2.905 1.982 3.626 . 0 0 "[ . 1 . 2]" 1
2030 1 102 GLN H 1 103 GLY H . . 4.460 2.600 1.542 3.163 . 0 0 "[ . 1 . 2]" 1
2031 1 102 GLN HA 1 102 GLN QE . . 5.340 4.041 3.719 4.129 . 0 0 "[ . 1 . 2]" 1
2032 1 102 GLN HA 2 45 ALA MB . . 4.290 3.424 2.146 4.139 . 0 0 "[ . 1 . 2]" 1
2033 1 102 GLN QB 2 45 ALA MB . . 5.340 2.031 1.798 3.242 . 0 0 "[ . 1 . 2]" 1
2034 1 102 GLN QG 1 103 GLY H . . 5.290 4.061 3.629 4.784 . 0 0 "[ . 1 . 2]" 1
2035 1 102 GLN QG 2 45 ALA MB . . 5.420 2.731 1.831 3.669 . 0 0 "[ . 1 . 2]" 1
2036 1 103 GLY H 1 104 THR H . . 5.230 2.857 2.466 3.083 . 0 0 "[ . 1 . 2]" 1
2037 1 104 THR H 1 104 THR HB . . 4.010 2.770 2.558 2.903 . 0 0 "[ . 1 . 2]" 1
2038 1 104 THR H 1 105 LYS H . . 5.470 4.257 4.133 4.398 . 0 0 "[ . 1 . 2]" 1
2039 1 104 THR HA 1 104 THR MG . . 3.460 2.342 2.293 2.387 . 0 0 "[ . 1 . 2]" 1
2040 1 104 THR HB 1 105 LYS H . . 5.500 4.166 4.027 4.258 . 0 0 "[ . 1 . 2]" 1
2041 1 104 THR MG 1 105 LYS H . . 4.060 2.677 2.456 2.787 . 0 0 "[ . 1 . 2]" 1
2042 1 105 LYS H 1 105 LYS HB2 . . 4.160 2.785 2.373 3.049 . 0 0 "[ . 1 . 2]" 1
2043 1 105 LYS H 1 105 LYS HB3 . . 4.120 2.796 2.500 3.689 . 0 0 "[ . 1 . 2]" 1
2044 1 105 LYS H 1 105 LYS QD . . 5.340 4.282 3.073 4.678 . 0 0 "[ . 1 . 2]" 1
2045 1 105 LYS H 1 105 LYS HG2 . . 5.500 4.644 4.031 4.809 . 0 0 "[ . 1 . 2]" 1
2046 1 105 LYS H 1 105 LYS HG3 . . 5.120 4.477 3.292 4.852 . 0 0 "[ . 1 . 2]" 1
2047 1 105 LYS H 1 106 LEU H . . 5.050 4.362 4.210 4.422 . 0 0 "[ . 1 . 2]" 1
2048 1 105 LYS HA 1 105 LYS QD . . 4.520 2.462 2.068 3.758 . 0 0 "[ . 1 . 2]" 1
2049 1 105 LYS HA 1 105 LYS QE . . 5.340 3.614 2.735 4.735 . 0 0 "[ . 1 . 2]" 1
2050 1 105 LYS HA 1 106 LEU HB2 . . 5.500 4.425 4.274 4.590 . 0 0 "[ . 1 . 2]" 1
2051 1 105 LYS HA 1 106 LEU HB3 . . 5.400 4.556 4.387 4.729 . 0 0 "[ . 1 . 2]" 1
2052 1 105 LYS HB2 1 105 LYS QD . . 3.170 2.971 2.420 3.288 0.118 14 0 "[ . 1 . 2]" 1
2053 1 105 LYS HB3 1 105 LYS QD . . 3.490 3.100 2.243 3.517 0.027 9 0 "[ . 1 . 2]" 1
2054 1 105 LYS HB3 1 105 LYS QE . . 4.640 3.690 3.382 4.187 . 0 0 "[ . 1 . 2]" 1
2055 1 105 LYS HB3 1 106 LEU H . . 5.090 3.938 3.034 4.189 . 0 0 "[ . 1 . 2]" 1
2056 1 105 LYS HB3 1 106 LEU HA . . 5.400 4.745 4.416 5.028 . 0 0 "[ . 1 . 2]" 1
2057 1 105 LYS QE 1 105 LYS HG2 . . 3.720 2.534 2.207 3.001 . 0 0 "[ . 1 . 2]" 1
2058 1 105 LYS QE 1 105 LYS HG3 . . 3.620 2.983 2.253 3.526 . 0 0 "[ . 1 . 2]" 1
2059 1 105 LYS HG2 1 106 LEU H . . 4.990 4.297 3.323 4.996 0.006 3 0 "[ . 1 . 2]" 1
2060 1 105 LYS HG2 1 107 GLU QG . . 4.950 4.247 3.139 5.044 0.094 16 0 "[ . 1 . 2]" 1
2061 1 105 LYS HG3 1 106 LEU H . . 5.430 3.758 2.945 4.987 . 0 0 "[ . 1 . 2]" 1
2062 1 106 LEU H 1 106 LEU HB3 . . 4.180 2.464 2.389 2.573 . 0 0 "[ . 1 . 2]" 1
2063 1 106 LEU H 1 106 LEU QD . . 4.400 3.756 3.673 3.819 . 0 0 "[ . 1 . 2]" 1
2064 1 106 LEU H 1 106 LEU HG . . 5.200 4.491 4.313 4.788 . 0 0 "[ . 1 . 2]" 1
2065 1 106 LEU H 1 107 GLU H . . 5.160 4.393 4.230 4.542 . 0 0 "[ . 1 . 2]" 1
2066 1 106 LEU HA 1 106 LEU QD . . 3.700 2.132 1.989 3.041 . 0 0 "[ . 1 . 2]" 1
2067 1 106 LEU HA 1 107 GLU H . . 3.470 2.113 2.001 2.237 . 0 0 "[ . 1 . 2]" 1
2068 1 106 LEU HA 1 107 GLU HB2 . . 5.200 4.416 4.151 4.610 . 0 0 "[ . 1 . 2]" 1
2069 1 106 LEU HA 1 107 GLU QG . . 5.500 3.731 3.434 4.002 . 0 0 "[ . 1 . 2]" 1
2070 1 106 LEU HB2 1 107 GLU H . . 4.860 4.186 4.024 4.323 . 0 0 "[ . 1 . 2]" 1
2071 1 106 LEU HB3 1 107 GLU H . . 4.930 4.067 3.908 4.210 . 0 0 "[ . 1 . 2]" 1
2072 1 106 LEU QD 1 107 GLU H . . 3.890 2.398 2.035 2.704 . 0 0 "[ . 1 . 2]" 1
2073 1 106 LEU HG 1 107 GLU H . . 5.160 3.287 2.606 4.835 . 0 0 "[ . 1 . 2]" 1
2074 1 107 GLU H 1 107 GLU QG . . 4.210 2.984 2.769 3.220 . 0 0 "[ . 1 . 2]" 1
2075 1 107 GLU H 1 108 ILE H . . 5.460 4.388 4.288 4.443 . 0 0 "[ . 1 . 2]" 1
2076 1 107 GLU HA 1 108 ILE HB . . 5.040 4.601 4.485 4.985 . 0 0 "[ . 1 . 2]" 1
2077 1 107 GLU HB2 1 108 ILE H . . 4.280 3.704 3.386 4.076 . 0 0 "[ . 1 . 2]" 1
2078 1 107 GLU HB3 1 108 ILE H . . 4.590 2.569 2.142 3.027 . 0 0 "[ . 1 . 2]" 1
2079 1 107 GLU HB3 1 109 LYS H . . 5.290 5.339 5.161 5.429 0.139 11 0 "[ . 1 . 2]" 1
2080 1 107 GLU QG 1 108 ILE H . . 4.650 4.065 3.755 4.520 . 0 0 "[ . 1 . 2]" 1
2081 1 108 ILE H 1 108 ILE HB . . 3.650 2.507 2.417 2.660 . 0 0 "[ . 1 . 2]" 1
2082 1 108 ILE H 1 108 ILE MD . . 4.590 4.074 3.637 4.280 . 0 0 "[ . 1 . 2]" 1
2083 1 108 ILE H 1 108 ILE HG12 . . 4.730 3.939 2.533 4.326 . 0 0 "[ . 1 . 2]" 1
2084 1 108 ILE H 1 108 ILE HG13 . . 4.540 3.258 2.929 3.997 . 0 0 "[ . 1 . 2]" 1
2085 1 108 ILE H 1 108 ILE MG . . 4.460 3.753 3.690 3.849 . 0 0 "[ . 1 . 2]" 1
2086 1 108 ILE H 1 109 LYS H . . 4.960 4.366 4.280 4.456 . 0 0 "[ . 1 . 2]" 1
2087 1 108 ILE HA 1 109 LYS H . . 3.500 2.076 1.917 2.195 . 0 0 "[ . 1 . 2]" 1
2088 1 108 ILE HA 1 109 LYS QG . . 5.180 3.784 3.398 4.014 . 0 0 "[ . 1 . 2]" 1
2089 1 108 ILE HB 1 108 ILE MD . . 3.510 2.569 2.375 3.237 . 0 0 "[ . 1 . 2]" 1
2090 1 108 ILE HB 1 109 LYS H . . 4.820 4.242 4.064 4.418 . 0 0 "[ . 1 . 2]" 1
2091 1 108 ILE MD 1 108 ILE MG . . 2.460 1.938 1.899 1.998 . 0 0 "[ . 1 . 2]" 1
2092 1 108 ILE HG12 1 108 ILE MG . . 3.570 2.511 2.282 3.195 . 0 0 "[ . 1 . 2]" 1
2093 1 108 ILE HG12 1 109 LYS H . . 5.340 4.050 3.742 4.998 . 0 0 "[ . 1 . 2]" 1
2094 1 108 ILE HG13 1 108 ILE MG . . 3.620 3.104 2.430 3.243 . 0 0 "[ . 1 . 2]" 1
2095 1 108 ILE MG 1 109 LYS H . . 4.190 2.671 2.412 2.895 . 0 0 "[ . 1 . 2]" 1
2096 1 108 ILE MG 1 110 ARG H . . 5.260 4.174 3.518 4.673 . 0 0 "[ . 1 . 2]" 1
2097 1 108 ILE MG 1 110 ARG HA . . 5.300 3.878 3.163 5.223 . 0 0 "[ . 1 . 2]" 1
2098 1 109 LYS H 1 109 LYS HB2 . . 3.870 2.574 2.360 2.763 . 0 0 "[ . 1 . 2]" 1
2099 1 109 LYS H 1 109 LYS HB3 . . 4.030 3.640 3.565 3.694 . 0 0 "[ . 1 . 2]" 1
2100 1 109 LYS H 1 109 LYS QD . . 5.290 3.915 3.585 4.227 . 0 0 "[ . 1 . 2]" 1
2101 1 109 LYS H 1 109 LYS QG . . 4.210 2.315 2.091 2.503 . 0 0 "[ . 1 . 2]" 1
2102 1 109 LYS H 1 110 ARG H . . 5.500 4.450 4.209 4.645 . 0 0 "[ . 1 . 2]" 1
2103 1 109 LYS HA 1 109 LYS QD . . 4.030 4.025 3.941 4.128 0.098 2 0 "[ . 1 . 2]" 1
2104 1 109 LYS HA 1 109 LYS QG . . 3.970 2.503 2.317 2.631 . 0 0 "[ . 1 . 2]" 1
2105 1 109 LYS HA 1 110 ARG H . . 3.120 2.143 1.991 2.317 . 0 0 "[ . 1 . 2]" 1
2106 1 109 LYS HB2 1 109 LYS QD . . 2.400 2.351 2.264 2.544 0.144 5 0 "[ . 1 . 2]" 1
2107 1 109 LYS HB2 1 110 ARG H . . 5.060 4.144 3.697 4.379 . 0 0 "[ . 1 . 2]" 1
2108 1 109 LYS HB3 1 109 LYS QD . . 3.100 2.404 2.248 2.925 . 0 0 "[ . 1 . 2]" 1
2109 1 109 LYS HB3 1 110 ARG H . . 4.000 3.279 2.612 3.664 . 0 0 "[ . 1 . 2]" 1
2110 1 109 LYS QD 1 110 ARG H . . 5.500 5.239 4.492 5.581 0.081 17 0 "[ . 1 . 2]" 1
2111 1 109 LYS QG 1 110 ARG H . . 4.590 4.192 3.898 4.446 . 0 0 "[ . 1 . 2]" 1
2112 1 110 ARG H 1 110 ARG QD . . 5.500 4.326 2.445 5.492 . 0 0 "[ . 1 . 2]" 1
2113 1 110 ARG H 1 110 ARG QG . . 4.330 3.352 1.983 4.288 . 0 0 "[ . 1 . 2]" 1
2114 1 110 ARG HA 1 110 ARG QD . . 4.840 3.528 1.975 4.279 . 0 0 "[ . 1 . 2]" 1
2115 1 110 ARG HA 1 110 ARG QG . . 4.010 2.676 2.434 3.347 . 0 0 "[ . 1 . 2]" 1
2116 2 3 ASP HA 2 4 ILE HB . . 5.500 4.636 4.453 5.602 0.102 9 0 "[ . 1 . 2]" 1
2117 2 3 ASP QB 2 97 PRO QB . . 4.500 3.977 3.063 4.429 . 0 0 "[ . 1 . 2]" 1
2118 2 3 ASP QB 2 97 PRO HD2 . . 5.340 2.270 1.885 2.885 . 0 0 "[ . 1 . 2]" 1
2119 2 3 ASP QB 2 97 PRO HD3 . . 5.340 3.317 2.450 3.758 . 0 0 "[ . 1 . 2]" 1
2120 2 3 ASP QB 2 97 PRO QG . . 5.210 2.309 1.940 3.656 . 0 0 "[ . 1 . 2]" 1
2121 2 3 ASP HB2 2 4 ILE H . . 4.650 2.731 2.089 4.415 . 0 0 "[ . 1 . 2]" 1
2122 2 3 ASP HB2 2 97 PRO QB . . 5.200 4.395 3.686 4.891 . 0 0 "[ . 1 . 2]" 1
2123 2 3 ASP HB2 2 99 THR MG . . 4.670 3.372 2.188 4.808 0.138 9 0 "[ . 1 . 2]" 1
2124 2 3 ASP HB3 2 4 ILE H . . 4.650 3.755 1.778 4.391 . 0 0 "[ . 1 . 2]" 1
2125 2 3 ASP HB3 2 97 PRO QB . . 5.200 4.596 3.274 5.299 0.099 15 0 "[ . 1 . 2]" 1
2126 2 3 ASP HB3 2 99 THR MG . . 4.670 4.467 3.277 4.768 0.098 12 0 "[ . 1 . 2]" 1
2127 2 4 ILE H 2 4 ILE HB . . 4.140 2.460 2.227 2.539 . 0 0 "[ . 1 . 2]" 1
2128 2 4 ILE H 2 4 ILE MD . . 4.470 3.579 3.250 3.747 . 0 0 "[ . 1 . 2]" 1
2129 2 4 ILE H 2 4 ILE HG12 . . 4.480 3.982 3.762 4.198 . 0 0 "[ . 1 . 2]" 1
2130 2 4 ILE H 2 4 ILE HG13 . . 5.100 2.676 2.370 2.922 . 0 0 "[ . 1 . 2]" 1
2131 2 4 ILE H 2 4 ILE MG . . 4.780 3.753 3.664 3.784 . 0 0 "[ . 1 . 2]" 1
2132 2 4 ILE H 2 99 THR MG . . 4.760 3.732 3.084 4.153 . 0 0 "[ . 1 . 2]" 1
2133 2 4 ILE HA 2 4 ILE MD . . 4.090 3.869 3.828 3.918 . 0 0 "[ . 1 . 2]" 1
2134 2 4 ILE HA 2 28 SER H . . 5.500 3.818 3.111 4.492 . 0 0 "[ . 1 . 2]" 1
2135 2 4 ILE HA 2 29 GLN HB3 . . 5.170 3.611 2.553 5.212 0.042 20 0 "[ . 1 . 2]" 1
2136 2 4 ILE HA 2 99 THR MG . . 5.500 5.124 4.836 5.514 0.014 17 0 "[ . 1 . 2]" 1
2137 2 4 ILE HB 2 4 ILE MD . . 3.660 2.347 2.280 2.395 . 0 0 "[ . 1 . 2]" 1
2138 2 4 ILE HB 2 5 GLN H . . 5.500 4.363 4.260 4.413 . 0 0 "[ . 1 . 2]" 1
2139 2 4 ILE HB 2 29 GLN H . . 5.500 4.980 4.759 5.515 0.015 17 0 "[ . 1 . 2]" 1
2140 2 4 ILE HB 2 92 GLN HE21 . . 5.500 2.425 2.043 2.785 . 0 0 "[ . 1 . 2]" 1
2141 2 4 ILE HB 2 92 GLN HE22 . . 5.360 2.764 2.434 3.358 . 0 0 "[ . 1 . 2]" 1
2142 2 4 ILE HB 2 92 GLN HG2 . . 5.500 3.137 2.569 3.744 . 0 0 "[ . 1 . 2]" 1
2143 2 4 ILE HB 2 92 GLN HG3 . . 5.380 4.027 3.594 4.612 . 0 0 "[ . 1 . 2]" 1
2144 2 4 ILE HB 2 95 ASN HB3 . . 5.500 4.485 3.982 4.872 . 0 0 "[ . 1 . 2]" 1
2145 2 4 ILE HB 2 99 THR H . . 5.340 4.575 4.393 4.887 . 0 0 "[ . 1 . 2]" 1
2146 2 4 ILE MD 2 4 ILE MG . . 2.400 2.075 1.955 2.229 . 0 0 "[ . 1 . 2]" 1
2147 2 4 ILE MD 2 29 GLN HB2 . . 4.810 4.455 2.994 4.830 0.020 7 0 "[ . 1 . 2]" 1
2148 2 4 ILE MD 2 29 GLN HB3 . . 4.430 3.253 2.803 3.769 . 0 0 "[ . 1 . 2]" 1
2149 2 4 ILE MD 2 29 GLN HE21 . . 4.780 3.192 2.354 4.571 . 0 0 "[ . 1 . 2]" 1
2150 2 4 ILE MD 2 29 GLN HE22 . . 5.140 4.020 3.292 4.672 . 0 0 "[ . 1 . 2]" 1
2151 2 4 ILE MD 2 29 GLN HG2 . . 4.320 3.874 3.247 4.379 0.059 8 0 "[ . 1 . 2]" 1
2152 2 4 ILE MD 2 31 ILE HB . . 5.480 3.925 3.764 4.010 . 0 0 "[ . 1 . 2]" 1
2153 2 4 ILE MD 2 92 GLN HE21 . . 5.500 2.072 1.613 3.410 . 0 0 "[ . 1 . 2]" 1
2154 2 4 ILE MD 2 92 GLN HE22 . . 5.360 2.631 2.354 2.897 . 0 0 "[ . 1 . 2]" 1
2155 2 4 ILE MD 2 93 TYR H . . 5.500 5.462 5.328 5.555 0.055 8 0 "[ . 1 . 2]" 1
2156 2 4 ILE MD 2 94 ASP H . . 5.470 3.895 3.714 4.064 . 0 0 "[ . 1 . 2]" 1
2157 2 4 ILE MD 2 94 ASP QB . . 5.280 2.897 2.455 3.233 . 0 0 "[ . 1 . 2]" 1
2158 2 4 ILE MD 2 95 ASN H . . 4.790 2.644 2.368 2.801 . 0 0 "[ . 1 . 2]" 1
2159 2 4 ILE MD 2 95 ASN HB2 . . 4.300 2.951 2.737 3.169 . 0 0 "[ . 1 . 2]" 1
2160 2 4 ILE MD 2 95 ASN HB3 . . 3.890 1.925 1.773 2.184 . 0 0 "[ . 1 . 2]" 1
2161 2 4 ILE MD 2 95 ASN HD21 . . 5.270 3.172 2.538 4.537 . 0 0 "[ . 1 . 2]" 1
2162 2 4 ILE MD 2 95 ASN HD22 . . 5.500 4.454 4.025 5.076 . 0 0 "[ . 1 . 2]" 1
2163 2 4 ILE MD 2 96 LEU H . . 4.870 4.907 4.783 5.007 0.137 3 0 "[ . 1 . 2]" 1
2164 2 4 ILE MD 2 98 TYR QD . . 4.380 4.190 3.835 4.419 0.039 20 0 "[ . 1 . 2]" 1
2165 2 4 ILE MD 2 98 TYR QE . . 5.150 4.573 4.340 4.927 . 0 0 "[ . 1 . 2]" 1
2166 2 4 ILE HG12 2 4 ILE MG . . 3.410 2.199 2.113 2.295 . 0 0 "[ . 1 . 2]" 1
2167 2 4 ILE HG12 2 5 GLN H . . 5.490 4.659 4.429 4.853 . 0 0 "[ . 1 . 2]" 1
2168 2 4 ILE HG12 2 29 GLN HB3 . . 4.670 2.049 1.799 3.349 . 0 0 "[ . 1 . 2]" 1
2169 2 4 ILE HG12 2 29 GLN HE21 . . 5.500 3.260 2.200 5.074 . 0 0 "[ . 1 . 2]" 1
2170 2 4 ILE HG12 2 30 ASP HA . . 5.500 5.625 5.564 5.680 0.180 10 0 "[ . 1 . 2]" 1
2171 2 4 ILE HG12 2 31 ILE HA . . 5.500 5.481 5.078 5.584 0.084 18 0 "[ . 1 . 2]" 1
2172 2 4 ILE HG12 2 95 ASN HB2 . . 5.500 5.404 5.011 5.546 0.046 11 0 "[ . 1 . 2]" 1
2173 2 4 ILE HG12 2 95 ASN HB3 . . 5.500 4.146 3.825 4.526 . 0 0 "[ . 1 . 2]" 1
2174 2 4 ILE HG13 2 5 GLN H . . 5.190 4.916 4.758 5.089 . 0 0 "[ . 1 . 2]" 1
2175 2 4 ILE HG13 2 29 GLN HB3 . . 5.150 3.217 2.748 4.717 . 0 0 "[ . 1 . 2]" 1
2176 2 4 ILE MG 2 5 GLN H . . 4.310 3.040 2.714 3.213 . 0 0 "[ . 1 . 2]" 1
2177 2 4 ILE MG 2 27 ALA HA . . 5.080 3.165 2.788 3.486 . 0 0 "[ . 1 . 2]" 1
2178 2 4 ILE MG 2 27 ALA MB . . 3.740 2.164 1.932 2.452 . 0 0 "[ . 1 . 2]" 1
2179 2 4 ILE MG 2 28 SER H . . 4.460 2.626 2.151 3.253 . 0 0 "[ . 1 . 2]" 1
2180 2 4 ILE MG 2 29 GLN H . . 4.290 2.130 1.889 2.504 . 0 0 "[ . 1 . 2]" 1
2181 2 4 ILE MG 2 29 GLN HB2 . . 4.800 4.079 2.803 4.606 . 0 0 "[ . 1 . 2]" 1
2182 2 4 ILE MG 2 29 GLN HB3 . . 4.290 3.267 2.428 4.325 0.035 8 0 "[ . 1 . 2]" 1
2183 2 4 ILE MG 2 30 ASP H . . 5.500 5.240 4.950 5.525 0.025 2 0 "[ . 1 . 2]" 1
2184 2 4 ILE MG 2 31 ILE HB . . 5.480 4.759 4.295 5.135 . 0 0 "[ . 1 . 2]" 1
2185 2 4 ILE MG 2 31 ILE MD . . 4.330 3.470 3.201 3.896 . 0 0 "[ . 1 . 2]" 1
2186 2 4 ILE MG 2 31 ILE QG . . 5.500 4.307 4.088 4.560 . 0 0 "[ . 1 . 2]" 1
2187 2 4 ILE MG 2 71 THR HA . . 5.500 5.294 4.973 5.478 . 0 0 "[ . 1 . 2]" 1
2188 2 4 ILE MG 2 92 GLN HB2 . . 5.500 3.846 3.495 4.342 . 0 0 "[ . 1 . 2]" 1
2189 2 4 ILE MG 2 92 GLN HB3 . . 5.470 3.940 3.632 4.211 . 0 0 "[ . 1 . 2]" 1
2190 2 4 ILE MG 2 92 GLN HG2 . . 4.940 2.045 1.843 2.440 . 0 0 "[ . 1 . 2]" 1
2191 2 4 ILE MG 2 92 GLN HG3 . . 5.230 3.123 2.862 3.610 . 0 0 "[ . 1 . 2]" 1
2192 2 4 ILE MG 2 99 THR H . . 5.500 4.836 4.497 5.377 . 0 0 "[ . 1 . 2]" 1
2193 2 4 ILE MG 2 99 THR MG . . 4.540 4.552 4.409 4.629 0.089 18 0 "[ . 1 . 2]" 1
2194 2 5 GLN H 2 5 GLN HG2 . . 4.900 4.175 2.731 4.596 . 0 0 "[ . 1 . 2]" 1
2195 2 5 GLN H 2 5 GLN QG . . 4.220 3.693 2.404 4.028 . 0 0 "[ . 1 . 2]" 1
2196 2 5 GLN H 2 5 GLN HG3 . . 4.900 4.220 2.439 4.591 . 0 0 "[ . 1 . 2]" 1
2197 2 5 GLN H 2 28 SER H . . 4.720 2.953 2.373 3.366 . 0 0 "[ . 1 . 2]" 1
2198 2 5 GLN H 2 28 SER HA . . 5.000 4.413 4.065 4.953 . 0 0 "[ . 1 . 2]" 1
2199 2 5 GLN H 2 28 SER QB . . 4.730 1.990 1.643 2.932 . 0 0 "[ . 1 . 2]" 1
2200 2 5 GLN H 2 29 GLN H . . 5.500 3.998 3.489 4.278 . 0 0 "[ . 1 . 2]" 1
2201 2 5 GLN HA 2 5 GLN HG2 . . 4.240 2.981 2.467 3.747 . 0 0 "[ . 1 . 2]" 1
2202 2 5 GLN HA 2 5 GLN HG3 . . 4.240 3.067 2.467 3.769 . 0 0 "[ . 1 . 2]" 1
2203 2 5 GLN HA 2 6 MET H . . 3.570 2.197 2.140 2.253 . 0 0 "[ . 1 . 2]" 1
2204 2 5 GLN HA 2 28 SER H . . 5.500 4.671 4.440 4.927 . 0 0 "[ . 1 . 2]" 1
2205 2 5 GLN QB 2 6 MET H . . 4.130 3.572 3.044 3.895 . 0 0 "[ . 1 . 2]" 1
2206 2 5 GLN QB 2 28 SER QB . . 4.180 2.240 1.710 3.312 . 0 0 "[ . 1 . 2]" 1
2207 2 5 GLN HB2 2 6 MET H . . 4.950 4.414 4.160 4.635 . 0 0 "[ . 1 . 2]" 1
2208 2 5 GLN HB2 2 28 SER H . . 5.330 4.125 3.015 4.742 . 0 0 "[ . 1 . 2]" 1
2209 2 5 GLN HB2 2 28 SER HA . . 5.000 4.818 3.729 5.170 0.170 16 0 "[ . 1 . 2]" 1
2210 2 5 GLN HB3 2 6 MET H . . 4.950 3.786 3.130 4.230 . 0 0 "[ . 1 . 2]" 1
2211 2 5 GLN HB3 2 28 SER H . . 5.330 3.688 2.672 4.665 . 0 0 "[ . 1 . 2]" 1
2212 2 5 GLN HB3 2 28 SER HA . . 5.000 4.505 3.896 5.166 0.166 8 0 "[ . 1 . 2]" 1
2213 2 5 GLN QG 2 6 MET H . . 4.760 3.528 2.662 4.383 . 0 0 "[ . 1 . 2]" 1
2214 2 5 GLN QG 2 28 SER QB . . 5.140 4.001 3.060 5.179 0.039 14 0 "[ . 1 . 2]" 1
2215 2 5 GLN QG 2 99 THR MG . . 4.990 4.236 3.093 5.075 0.085 17 0 "[ . 1 . 2]" 1
2216 2 6 MET H 2 6 MET HG2 . . 3.910 2.814 2.446 3.904 . 0 0 "[ . 1 . 2]" 1
2217 2 6 MET H 2 6 MET HG3 . . 4.360 3.991 3.080 4.220 . 0 0 "[ . 1 . 2]" 1
2218 2 6 MET H 2 99 THR MG . . 5.200 3.874 3.415 4.398 . 0 0 "[ . 1 . 2]" 1
2219 2 6 MET HA 2 6 MET ME . . 3.900 2.762 2.358 3.627 . 0 0 "[ . 1 . 2]" 1
2220 2 6 MET HA 2 6 MET HG3 . . 4.230 3.710 3.208 3.788 . 0 0 "[ . 1 . 2]" 1
2221 2 6 MET HA 2 7 THR HB . . 5.500 4.438 4.284 4.559 . 0 0 "[ . 1 . 2]" 1
2222 2 6 MET QB 2 6 MET ME . . 3.710 2.121 1.999 2.292 . 0 0 "[ . 1 . 2]" 1
2223 2 6 MET QB 2 27 ALA MB . . 5.290 4.674 4.089 4.865 . 0 0 "[ . 1 . 2]" 1
2224 2 6 MET QB 2 99 THR H . . 5.500 5.031 4.625 5.527 0.027 14 0 "[ . 1 . 2]" 1
2225 2 6 MET QB 2 99 THR HB . . 5.290 4.012 3.262 4.511 . 0 0 "[ . 1 . 2]" 1
2226 2 6 MET QB 2 99 THR MG . . 5.040 4.806 4.542 5.052 0.012 8 0 "[ . 1 . 2]" 1
2227 2 6 MET QB 2 100 PHE HA . . 5.500 3.772 3.420 4.149 . 0 0 "[ . 1 . 2]" 1
2228 2 6 MET QB 2 101 GLY H . . 5.500 3.083 2.621 3.544 . 0 0 "[ . 1 . 2]" 1
2229 2 6 MET ME 2 7 THR H . . 4.480 3.651 3.198 4.475 . 0 0 "[ . 1 . 2]" 1
2230 2 6 MET ME 2 25 CYS HB2 . . 4.020 3.735 3.277 4.158 0.138 6 0 "[ . 1 . 2]" 1
2231 2 6 MET ME 2 25 CYS HB3 . . 4.570 2.839 2.022 3.937 . 0 0 "[ . 1 . 2]" 1
2232 2 6 MET ME 2 26 GLN H . . 4.450 3.593 3.157 4.443 . 0 0 "[ . 1 . 2]" 1
2233 2 6 MET ME 2 31 ILE MD . . 3.690 3.068 2.593 3.636 . 0 0 "[ . 1 . 2]" 1
2234 2 6 MET ME 2 35 LEU MD1 . . 4.190 2.974 1.812 3.845 . 0 0 "[ . 1 . 2]" 1
2235 2 6 MET ME 2 35 LEU QD . . 3.330 1.894 1.772 2.080 . 0 0 "[ . 1 . 2]" 1
2236 2 6 MET ME 2 35 LEU MD2 . . 4.190 2.320 1.779 3.030 . 0 0 "[ . 1 . 2]" 1
2237 2 6 MET ME 2 37 TRP HZ2 . . 5.290 5.363 5.267 5.461 0.171 17 0 "[ . 1 . 2]" 1
2238 2 6 MET ME 2 73 PHE H . . 5.500 5.110 4.682 5.602 0.102 17 0 "[ . 1 . 2]" 1
2239 2 6 MET ME 2 73 PHE QD . . 4.690 2.915 2.642 3.371 . 0 0 "[ . 1 . 2]" 1
2240 2 6 MET ME 2 90 CYS H . . 5.500 4.858 3.908 5.246 . 0 0 "[ . 1 . 2]" 1
2241 2 6 MET ME 2 90 CYS HB2 . . 5.500 3.154 2.217 3.477 . 0 0 "[ . 1 . 2]" 1
2242 2 6 MET ME 2 90 CYS HB3 . . 5.500 4.267 3.575 4.703 . 0 0 "[ . 1 . 2]" 1
2243 2 6 MET ME 2 91 GLN H . . 4.750 4.625 3.347 4.798 0.048 7 0 "[ . 1 . 2]" 1
2244 2 6 MET ME 2 92 GLN HA . . 5.130 4.689 4.243 5.086 . 0 0 "[ . 1 . 2]" 1
2245 2 6 MET ME 2 101 GLY H . . 5.450 4.600 3.397 5.459 0.009 20 0 "[ . 1 . 2]" 1
2246 2 6 MET HG2 2 7 THR H . . 5.390 5.056 4.274 5.181 . 0 0 "[ . 1 . 2]" 1
2247 2 6 MET HG2 2 27 ALA MB . . 4.640 4.474 2.610 4.678 0.038 13 0 "[ . 1 . 2]" 1
2248 2 6 MET HG2 2 101 GLY H . . 5.500 5.075 4.715 5.541 0.041 17 0 "[ . 1 . 2]" 1
2249 2 6 MET HG3 2 91 GLN HA . . 5.500 3.193 2.613 4.809 . 0 0 "[ . 1 . 2]" 1
2250 2 6 MET HG3 2 99 THR HB . . 5.500 4.995 3.821 5.532 0.032 9 0 "[ . 1 . 2]" 1
2251 2 6 MET HG3 2 101 GLY H . . 5.390 4.030 3.610 5.237 . 0 0 "[ . 1 . 2]" 1
2252 2 7 THR H 2 7 THR HB . . 4.020 2.426 2.371 2.510 . 0 0 "[ . 1 . 2]" 1
2253 2 7 THR H 2 7 THR MG . . 4.780 3.746 3.709 3.790 . 0 0 "[ . 1 . 2]" 1
2254 2 7 THR H 2 8 GLN H . . 5.230 4.365 4.255 4.536 . 0 0 "[ . 1 . 2]" 1
2255 2 7 THR H 2 26 GLN H . . 4.260 3.031 2.849 3.241 . 0 0 "[ . 1 . 2]" 1
2256 2 7 THR H 2 26 GLN HB2 . . 5.270 3.467 3.162 3.862 . 0 0 "[ . 1 . 2]" 1
2257 2 7 THR H 2 26 GLN HB3 . . 5.080 4.664 4.435 5.010 . 0 0 "[ . 1 . 2]" 1
2258 2 7 THR H 2 27 ALA HA . . 5.400 3.454 3.296 3.610 . 0 0 "[ . 1 . 2]" 1
2259 2 7 THR H 2 27 ALA MB . . 5.500 4.775 4.580 4.932 . 0 0 "[ . 1 . 2]" 1
2260 2 7 THR H 2 28 SER H . . 5.500 4.581 4.116 4.987 . 0 0 "[ . 1 . 2]" 1
2261 2 7 THR HA 2 7 THR MG . . 3.600 2.398 2.354 2.435 . 0 0 "[ . 1 . 2]" 1
2262 2 7 THR HB 2 8 GLN H . . 5.500 4.272 4.070 4.359 . 0 0 "[ . 1 . 2]" 1
2263 2 7 THR HB 2 26 GLN H . . 5.200 3.194 2.802 3.510 . 0 0 "[ . 1 . 2]" 1
2264 2 7 THR HB 2 26 GLN HA . . 5.500 4.795 4.557 5.038 . 0 0 "[ . 1 . 2]" 1
2265 2 7 THR HB 2 26 GLN HB2 . . 4.360 2.119 1.887 2.390 . 0 0 "[ . 1 . 2]" 1
2266 2 7 THR HB 2 26 GLN HB3 . . 4.210 3.689 3.471 3.972 . 0 0 "[ . 1 . 2]" 1
2267 2 7 THR HB 2 26 GLN HG3 . . 5.060 4.011 3.587 4.288 . 0 0 "[ . 1 . 2]" 1
2268 2 7 THR HB 2 27 ALA H . . 5.500 5.457 5.076 5.556 0.056 17 0 "[ . 1 . 2]" 1
2269 2 7 THR MG 2 8 GLN H . . 4.310 2.942 2.615 3.142 . 0 0 "[ . 1 . 2]" 1
2270 2 7 THR MG 2 9 SER QB . . 5.080 4.205 3.384 4.756 . 0 0 "[ . 1 . 2]" 1
2271 2 7 THR MG 2 25 CYS HA . . 5.500 4.794 4.412 5.124 . 0 0 "[ . 1 . 2]" 1
2272 2 7 THR MG 2 26 GLN H . . 5.070 4.048 3.770 4.191 . 0 0 "[ . 1 . 2]" 1
2273 2 7 THR MG 2 26 GLN HB2 . . 4.360 3.332 3.150 3.491 . 0 0 "[ . 1 . 2]" 1
2274 2 7 THR MG 2 26 GLN HE21 . . 5.500 3.551 2.709 5.330 . 0 0 "[ . 1 . 2]" 1
2275 2 7 THR MG 2 26 GLN HE22 . . 5.500 3.906 3.206 5.013 . 0 0 "[ . 1 . 2]" 1
2276 2 7 THR MG 2 26 GLN HG3 . . 4.140 4.145 3.992 4.179 0.039 10 0 "[ . 1 . 2]" 1
2277 2 8 GLN H 2 8 GLN HG2 . . 4.780 4.523 4.413 4.569 . 0 0 "[ . 1 . 2]" 1
2278 2 8 GLN H 2 8 GLN HG3 . . 5.500 4.480 3.601 4.678 . 0 0 "[ . 1 . 2]" 1
2279 2 8 GLN H 2 9 SER H . . 5.450 4.411 4.345 4.490 . 0 0 "[ . 1 . 2]" 1
2280 2 8 GLN H 2 102 GLN H . . 4.900 4.537 2.676 4.963 0.063 17 0 "[ . 1 . 2]" 1
2281 2 8 GLN H 2 102 GLN HE21 . . 5.500 4.367 3.172 5.534 0.034 8 0 "[ . 1 . 2]" 1
2282 2 8 GLN H 2 102 GLN HE22 . . 5.500 4.808 3.171 5.642 0.142 7 0 "[ . 1 . 2]" 1
2283 2 8 GLN H 2 103 GLY H . . 5.500 3.603 2.890 4.630 . 0 0 "[ . 1 . 2]" 1
2284 2 8 GLN HA 2 23 ILE MG . . 5.490 4.163 3.898 4.355 . 0 0 "[ . 1 . 2]" 1
2285 2 8 GLN HA 2 26 GLN HG3 . . 5.500 4.487 4.029 5.174 . 0 0 "[ . 1 . 2]" 1
2286 2 8 GLN HA 2 103 GLY H . . 5.500 5.148 4.734 5.521 0.021 3 0 "[ . 1 . 2]" 1
2287 2 8 GLN HB2 2 9 SER H . . 5.280 4.200 4.094 4.309 . 0 0 "[ . 1 . 2]" 1
2288 2 8 GLN HB2 2 89 TYR HA . . 5.500 4.399 3.987 5.030 . 0 0 "[ . 1 . 2]" 1
2289 2 8 GLN HB2 2 90 CYS H . . 5.340 4.322 3.827 5.441 0.101 11 0 "[ . 1 . 2]" 1
2290 2 8 GLN HB2 2 101 GLY QA . . 5.060 2.678 1.979 3.713 . 0 0 "[ . 1 . 2]" 1
2291 2 8 GLN HB3 2 9 SER H . . 5.220 3.796 2.919 4.079 . 0 0 "[ . 1 . 2]" 1
2292 2 8 GLN HB3 2 25 CYS HA . . 5.390 4.801 4.552 5.071 . 0 0 "[ . 1 . 2]" 1
2293 2 8 GLN HB3 2 101 GLY QA . . 5.230 3.695 2.922 5.027 . 0 0 "[ . 1 . 2]" 1
2294 2 8 GLN HB3 2 102 GLN H . . 4.690 4.485 2.754 4.798 0.108 9 0 "[ . 1 . 2]" 1
2295 2 8 GLN HB3 2 103 GLY H . . 5.030 2.511 2.024 3.685 . 0 0 "[ . 1 . 2]" 1
2296 2 8 GLN HE21 2 23 ILE MD . . 5.340 4.883 3.672 5.375 0.035 7 0 "[ . 1 . 2]" 1
2297 2 8 GLN HE21 2 23 ILE MG . . 4.410 3.698 2.119 4.354 . 0 0 "[ . 1 . 2]" 1
2298 2 8 GLN HE21 2 37 TRP HZ3 . . 5.500 4.889 3.393 5.471 . 0 0 "[ . 1 . 2]" 1
2299 2 8 GLN HE21 2 89 TYR HA . . 5.240 3.209 2.200 3.801 . 0 0 "[ . 1 . 2]" 1
2300 2 8 GLN HE21 2 90 CYS H . . 5.360 4.553 3.193 5.377 0.017 12 0 "[ . 1 . 2]" 1
2301 2 8 GLN HE21 2 103 GLY H . . 5.500 2.809 2.252 4.288 . 0 0 "[ . 1 . 2]" 1
2302 2 8 GLN HE21 2 103 GLY HA2 . . 5.500 4.767 4.080 5.898 0.398 20 0 "[ . 1 . 2]" 1
2303 2 8 GLN HE21 2 103 GLY HA3 . . 5.500 3.935 3.337 4.770 . 0 0 "[ . 1 . 2]" 1
2304 2 8 GLN HE21 2 104 THR H . . 4.940 2.424 1.941 3.723 . 0 0 "[ . 1 . 2]" 1
2305 2 8 GLN HE21 2 104 THR HB . . 5.460 2.785 1.953 4.045 . 0 0 "[ . 1 . 2]" 1
2306 2 8 GLN HE21 2 104 THR MG . . 5.500 4.202 3.382 5.417 . 0 0 "[ . 1 . 2]" 1
2307 2 8 GLN HE22 2 23 ILE MD . . 5.500 4.357 3.929 4.777 . 0 0 "[ . 1 . 2]" 1
2308 2 8 GLN HE22 2 23 ILE MG . . 4.730 3.722 3.019 4.331 . 0 0 "[ . 1 . 2]" 1
2309 2 8 GLN HE22 2 88 TYR HA . . 5.500 4.687 4.325 4.987 . 0 0 "[ . 1 . 2]" 1
2310 2 8 GLN HE22 2 88 TYR HB2 . . 5.500 4.081 3.576 4.655 . 0 0 "[ . 1 . 2]" 1
2311 2 8 GLN HE22 2 89 TYR HA . . 4.560 1.959 1.668 2.343 . 0 0 "[ . 1 . 2]" 1
2312 2 8 GLN HE22 2 90 CYS H . . 4.850 3.990 3.728 4.211 . 0 0 "[ . 1 . 2]" 1
2313 2 8 GLN HE22 2 104 THR H . . 4.690 2.832 2.568 3.263 . 0 0 "[ . 1 . 2]" 1
2314 2 8 GLN HE22 2 104 THR HB . . 5.430 2.620 2.337 3.227 . 0 0 "[ . 1 . 2]" 1
2315 2 8 GLN HE22 2 104 THR MG . . 5.500 4.229 4.017 4.735 . 0 0 "[ . 1 . 2]" 1
2316 2 8 GLN HG2 2 9 SER H . . 4.610 2.741 2.413 3.505 . 0 0 "[ . 1 . 2]" 1
2317 2 8 GLN HG2 2 23 ILE MG . . 4.800 2.400 2.181 2.901 . 0 0 "[ . 1 . 2]" 1
2318 2 8 GLN HG2 2 103 GLY H . . 4.980 4.649 4.194 4.982 0.002 13 0 "[ . 1 . 2]" 1
2319 2 8 GLN HG2 2 104 THR H . . 5.500 4.445 3.879 5.505 0.005 14 0 "[ . 1 . 2]" 1
2320 2 8 GLN HG3 2 9 SER H . . 4.870 3.395 3.050 4.442 . 0 0 "[ . 1 . 2]" 1
2321 2 8 GLN HG3 2 23 ILE MG . . 4.950 2.872 2.469 4.319 . 0 0 "[ . 1 . 2]" 1
2322 2 8 GLN HG3 2 24 THR H . . 5.500 4.454 3.779 5.580 0.080 20 0 "[ . 1 . 2]" 1
2323 2 8 GLN HG3 2 25 CYS HA . . 4.760 3.020 2.726 3.492 . 0 0 "[ . 1 . 2]" 1
2324 2 8 GLN HG3 2 37 TRP HH2 . . 4.460 3.660 3.109 4.613 0.153 14 0 "[ . 1 . 2]" 1
2325 2 8 GLN HG3 2 90 CYS H . . 5.500 4.707 4.047 5.093 . 0 0 "[ . 1 . 2]" 1
2326 2 8 GLN HG3 2 103 GLY H . . 5.460 5.003 4.169 5.520 0.060 13 0 "[ . 1 . 2]" 1
2327 2 9 SER H 2 10 PRO HA . . 5.500 4.770 4.690 4.875 . 0 0 "[ . 1 . 2]" 1
2328 2 9 SER H 2 23 ILE MG . . 4.900 3.382 3.013 3.747 . 0 0 "[ . 1 . 2]" 1
2329 2 9 SER H 2 24 THR HB . . 5.440 3.697 3.240 4.619 . 0 0 "[ . 1 . 2]" 1
2330 2 9 SER QB 2 10 PRO HA . . 4.510 2.224 2.056 2.479 . 0 0 "[ . 1 . 2]" 1
2331 2 9 SER QB 2 10 PRO QB . . 5.340 3.651 3.476 3.892 . 0 0 "[ . 1 . 2]" 1
2332 2 9 SER QB 2 24 THR H . . 4.750 3.885 3.412 4.777 0.027 13 0 "[ . 1 . 2]" 1
2333 2 9 SER QB 2 24 THR HB . . 5.050 3.254 2.524 4.527 . 0 0 "[ . 1 . 2]" 1
2334 2 10 PRO QB 2 12 SER H . . 4.600 2.614 2.456 2.786 . 0 0 "[ . 1 . 2]" 1
2335 2 10 PRO QB 2 13 LEU MD1 . . 5.340 4.003 3.717 4.364 . 0 0 "[ . 1 . 2]" 1
2336 2 10 PRO QB 2 13 LEU MD2 . . 5.160 3.874 3.160 4.254 . 0 0 "[ . 1 . 2]" 1
2337 2 10 PRO HB2 2 12 SER H . . 5.470 2.636 2.483 2.811 . 0 0 "[ . 1 . 2]" 1
2338 2 10 PRO HB3 2 12 SER H . . 5.470 4.325 3.895 4.565 . 0 0 "[ . 1 . 2]" 1
2339 2 10 PRO HD2 2 13 LEU HB3 . . 5.000 4.091 3.336 4.606 . 0 0 "[ . 1 . 2]" 1
2340 2 10 PRO HD2 2 13 LEU MD2 . . 4.400 2.553 2.169 2.952 . 0 0 "[ . 1 . 2]" 1
2341 2 10 PRO HD2 2 23 ILE HA . . 4.540 3.056 2.729 3.538 . 0 0 "[ . 1 . 2]" 1
2342 2 10 PRO HD2 2 23 ILE HG12 . . 5.500 3.195 2.911 3.382 . 0 0 "[ . 1 . 2]" 1
2343 2 10 PRO HD2 2 23 ILE MG . . 4.410 3.220 2.865 3.541 . 0 0 "[ . 1 . 2]" 1
2344 2 10 PRO HD2 2 24 THR H . . 5.500 4.115 3.660 4.633 . 0 0 "[ . 1 . 2]" 1
2345 2 10 PRO HD3 2 13 LEU HB3 . . 4.970 4.670 4.362 4.997 0.027 12 0 "[ . 1 . 2]" 1
2346 2 10 PRO HD3 2 23 ILE HA . . 4.830 3.130 2.540 3.514 . 0 0 "[ . 1 . 2]" 1
2347 2 10 PRO HD3 2 23 ILE MG . . 4.990 4.073 3.371 4.580 . 0 0 "[ . 1 . 2]" 1
2348 2 10 PRO HD3 2 24 THR H . . 5.500 3.907 3.422 4.340 . 0 0 "[ . 1 . 2]" 1
2349 2 10 PRO HG2 2 12 SER H . . 5.500 3.546 2.827 4.606 . 0 0 "[ . 1 . 2]" 1
2350 2 10 PRO HG2 2 13 LEU HB2 . . 5.370 4.092 3.458 4.507 . 0 0 "[ . 1 . 2]" 1
2351 2 10 PRO HG2 2 13 LEU HB3 . . 5.280 2.483 2.214 2.849 . 0 0 "[ . 1 . 2]" 1
2352 2 10 PRO HG2 2 13 LEU MD2 . . 4.320 2.345 2.008 3.151 . 0 0 "[ . 1 . 2]" 1
2353 2 10 PRO HG2 2 23 ILE MG . . 5.500 5.046 4.623 5.521 0.021 2 0 "[ . 1 . 2]" 1
2354 2 10 PRO HG2 2 104 THR MG . . 4.660 3.413 2.875 4.504 . 0 0 "[ . 1 . 2]" 1
2355 2 10 PRO HG3 2 12 SER H . . 5.500 4.776 4.262 5.506 0.006 2 0 "[ . 1 . 2]" 1
2356 2 11 SER QB 2 12 SER H . . 4.820 3.075 2.648 3.672 . 0 0 "[ . 1 . 2]" 1
2357 2 12 SER H 2 13 LEU H . . 5.500 4.131 4.060 4.210 . 0 0 "[ . 1 . 2]" 1
2358 2 12 SER H 2 104 THR HA . . 4.990 4.378 4.235 4.503 . 0 0 "[ . 1 . 2]" 1
2359 2 12 SER H 2 104 THR MG . . 5.500 4.199 4.027 4.416 . 0 0 "[ . 1 . 2]" 1
2360 2 12 SER H 2 105 LYS H . . 5.500 4.272 4.179 4.428 . 0 0 "[ . 1 . 2]" 1
2361 2 12 SER HA 2 13 LEU H . . 3.520 2.212 2.134 2.299 . 0 0 "[ . 1 . 2]" 1
2362 2 12 SER HA 2 13 LEU HB3 . . 5.490 4.457 4.378 4.551 . 0 0 "[ . 1 . 2]" 1
2363 2 12 SER HA 2 104 THR HA . . 4.670 3.431 3.074 3.685 . 0 0 "[ . 1 . 2]" 1
2364 2 12 SER HA 2 104 THR MG . . 3.550 3.112 2.913 3.477 . 0 0 "[ . 1 . 2]" 1
2365 2 12 SER HA 2 105 LYS H . . 3.850 2.125 1.873 2.405 . 0 0 "[ . 1 . 2]" 1
2366 2 12 SER HA 2 105 LYS HA . . 4.730 4.490 4.367 4.659 . 0 0 "[ . 1 . 2]" 1
2367 2 12 SER HA 2 105 LYS HB2 . . 4.770 4.015 2.879 4.556 . 0 0 "[ . 1 . 2]" 1
2368 2 12 SER HA 2 105 LYS HB3 . . 4.750 3.127 2.734 4.081 . 0 0 "[ . 1 . 2]" 1
2369 2 12 SER QB 2 13 LEU H . . 3.720 2.917 2.759 2.995 . 0 0 "[ . 1 . 2]" 1
2370 2 12 SER QB 2 104 THR HA . . 4.490 4.422 4.106 4.577 0.087 7 0 "[ . 1 . 2]" 1
2371 2 12 SER QB 2 105 LYS H . . 4.540 3.081 2.691 3.341 . 0 0 "[ . 1 . 2]" 1
2372 2 12 SER QB 2 105 LYS HB2 . . 4.730 3.208 1.995 3.970 . 0 0 "[ . 1 . 2]" 1
2373 2 12 SER QB 2 105 LYS HB3 . . 4.140 2.355 1.982 3.329 . 0 0 "[ . 1 . 2]" 1
2374 2 12 SER QB 2 105 LYS QD . . 5.180 4.264 3.295 5.081 . 0 0 "[ . 1 . 2]" 1
2375 2 12 SER QB 2 105 LYS QE . . 4.890 4.712 2.235 5.024 0.134 14 0 "[ . 1 . 2]" 1
2376 2 12 SER QB 2 105 LYS HG2 . . 5.110 4.086 3.593 5.116 0.006 4 0 "[ . 1 . 2]" 1
2377 2 12 SER QB 2 107 GLU QG . . 5.240 3.715 3.134 4.138 . 0 0 "[ . 1 . 2]" 1
2378 2 13 LEU H 2 13 LEU MD2 . . 4.620 1.966 1.861 2.068 . 0 0 "[ . 1 . 2]" 1
2379 2 13 LEU H 2 13 LEU HG . . 5.210 3.670 3.586 3.756 . 0 0 "[ . 1 . 2]" 1
2380 2 13 LEU H 2 105 LYS H . . 4.810 3.824 3.542 4.062 . 0 0 "[ . 1 . 2]" 1
2381 2 13 LEU H 2 105 LYS HB3 . . 5.500 4.190 3.918 4.581 . 0 0 "[ . 1 . 2]" 1
2382 2 13 LEU H 2 107 GLU QG . . 5.500 4.272 3.762 4.657 . 0 0 "[ . 1 . 2]" 1
2383 2 13 LEU HA 2 13 LEU MD2 . . 4.220 3.543 3.511 3.576 . 0 0 "[ . 1 . 2]" 1
2384 2 13 LEU HB2 2 13 LEU HG . . 2.880 2.429 2.404 2.452 . 0 0 "[ . 1 . 2]" 1
2385 2 13 LEU HB2 2 14 SER H . . 4.970 2.886 2.722 3.107 . 0 0 "[ . 1 . 2]" 1
2386 2 13 LEU HB3 2 14 SER H . . 5.080 3.993 3.919 4.062 . 0 0 "[ . 1 . 2]" 1
2387 2 13 LEU MD1 2 22 THR H . . 4.750 2.783 2.111 3.158 . 0 0 "[ . 1 . 2]" 1
2388 2 13 LEU MD1 2 22 THR HB . . 5.100 4.457 3.719 5.164 0.064 13 0 "[ . 1 . 2]" 1
2389 2 13 LEU MD2 2 14 SER H . . 4.420 4.484 4.456 4.522 0.102 7 0 "[ . 1 . 2]" 1
2390 2 13 LEU MD2 2 22 THR H . . 4.730 4.699 4.127 4.800 0.070 10 0 "[ . 1 . 2]" 1
2391 2 13 LEU MD2 2 105 LYS HB3 . . 5.090 5.021 4.816 5.142 0.052 17 0 "[ . 1 . 2]" 1
2392 2 13 LEU HG 2 14 SER H . . 4.520 4.029 3.844 4.289 . 0 0 "[ . 1 . 2]" 1
2393 2 13 LEU HG 2 15 ALA H . . 5.130 4.846 4.456 5.126 . 0 0 "[ . 1 . 2]" 1
2394 2 13 LEU HG 2 106 LEU HA . . 5.470 4.032 3.780 4.289 . 0 0 "[ . 1 . 2]" 1
2395 2 13 LEU HG 2 107 GLU H . . 5.200 4.553 4.259 4.858 . 0 0 "[ . 1 . 2]" 1
2396 2 14 SER H 2 106 LEU HA . . 5.500 5.471 5.311 5.551 0.051 8 0 "[ . 1 . 2]" 1
2397 2 14 SER H 2 107 GLU QG . . 5.500 5.399 5.090 5.549 0.049 19 0 "[ . 1 . 2]" 1
2398 2 14 SER HA 2 15 ALA H . . 3.350 2.136 2.041 2.191 . 0 0 "[ . 1 . 2]" 1
2399 2 14 SER HA 2 15 ALA MB . . 4.680 3.884 3.837 3.930 . 0 0 "[ . 1 . 2]" 1
2400 2 14 SER HA 2 106 LEU QD . . 5.010 3.179 2.739 3.554 . 0 0 "[ . 1 . 2]" 1
2401 2 14 SER HA 2 107 GLU H . . 4.170 2.282 2.141 2.433 . 0 0 "[ . 1 . 2]" 1
2402 2 14 SER HA 2 107 GLU HB2 . . 4.830 2.478 2.095 2.843 . 0 0 "[ . 1 . 2]" 1
2403 2 14 SER HA 2 107 GLU HB3 . . 4.610 3.910 3.609 4.374 . 0 0 "[ . 1 . 2]" 1
2404 2 14 SER HA 2 107 GLU QG . . 4.680 4.008 3.775 4.147 . 0 0 "[ . 1 . 2]" 1
2405 2 14 SER HA 2 108 ILE HA . . 5.500 4.125 3.800 4.489 . 0 0 "[ . 1 . 2]" 1
2406 2 14 SER QB 2 15 ALA H . . 4.390 3.004 2.858 3.211 . 0 0 "[ . 1 . 2]" 1
2407 2 14 SER QB 2 15 ALA HA . . 4.450 4.129 3.975 4.328 . 0 0 "[ . 1 . 2]" 1
2408 2 14 SER QB 2 106 LEU HA . . 5.490 5.527 5.345 5.685 0.195 5 0 "[ . 1 . 2]" 1
2409 2 14 SER QB 2 106 LEU QD . . 4.860 4.595 4.194 4.874 0.014 3 0 "[ . 1 . 2]" 1
2410 2 14 SER QB 2 107 GLU H . . 4.880 3.910 3.739 4.080 . 0 0 "[ . 1 . 2]" 1
2411 2 14 SER QB 2 107 GLU HB2 . . 4.750 2.443 2.023 2.741 . 0 0 "[ . 1 . 2]" 1
2412 2 14 SER QB 2 107 GLU HB3 . . 4.430 3.286 2.855 3.834 . 0 0 "[ . 1 . 2]" 1
2413 2 14 SER QB 2 107 GLU QG . . 4.630 4.084 3.317 4.545 . 0 0 "[ . 1 . 2]" 1
2414 2 14 SER QB 2 109 LYS H . . 5.240 3.464 3.032 3.885 . 0 0 "[ . 1 . 2]" 1
2415 2 14 SER QB 2 109 LYS HB2 . . 5.360 4.498 4.163 4.870 . 0 0 "[ . 1 . 2]" 1
2416 2 14 SER QB 2 109 LYS HB3 . . 5.010 4.423 4.011 5.157 0.147 7 0 "[ . 1 . 2]" 1
2417 2 14 SER QB 2 109 LYS QD . . 4.370 3.836 2.181 4.327 . 0 0 "[ . 1 . 2]" 1
2418 2 14 SER QB 2 109 LYS QE . . 5.050 3.378 1.911 4.635 . 0 0 "[ . 1 . 2]" 1
2419 2 14 SER QB 2 109 LYS QG . . 4.240 2.295 1.959 3.169 . 0 0 "[ . 1 . 2]" 1
2420 2 15 ALA H 2 80 LEU MD1 . . 5.500 4.839 4.493 5.179 . 0 0 "[ . 1 . 2]" 1
2421 2 15 ALA H 2 80 LEU MD2 . . 4.730 4.512 3.893 4.775 0.045 10 0 "[ . 1 . 2]" 1
2422 2 15 ALA H 2 106 LEU HA . . 5.180 5.049 4.627 5.224 0.044 17 0 "[ . 1 . 2]" 1
2423 2 15 ALA H 2 106 LEU QD . . 4.170 3.157 2.724 3.606 . 0 0 "[ . 1 . 2]" 1
2424 2 15 ALA H 2 107 GLU HB2 . . 5.500 4.063 3.742 4.292 . 0 0 "[ . 1 . 2]" 1
2425 2 15 ALA H 2 107 GLU HB3 . . 5.500 4.922 4.694 5.198 . 0 0 "[ . 1 . 2]" 1
2426 2 15 ALA H 2 107 GLU QG . . 5.500 5.491 5.303 5.563 0.063 18 0 "[ . 1 . 2]" 1
2427 2 15 ALA H 2 108 ILE HA . . 4.570 2.777 2.568 3.145 . 0 0 "[ . 1 . 2]" 1
2428 2 15 ALA H 2 109 LYS QE . . 5.320 4.623 3.801 5.458 0.138 2 0 "[ . 1 . 2]" 1
2429 2 15 ALA H 2 109 LYS QG . . 5.180 3.389 2.634 5.208 0.028 7 0 "[ . 1 . 2]" 1
2430 2 15 ALA HA 2 109 LYS QD . . 5.500 3.173 2.070 4.046 . 0 0 "[ . 1 . 2]" 1
2431 2 15 ALA HA 2 109 LYS QE . . 4.550 2.927 1.881 4.214 . 0 0 "[ . 1 . 2]" 1
2432 2 15 ALA MB 2 16 SER H . . 3.290 2.786 2.532 3.204 . 0 0 "[ . 1 . 2]" 1
2433 2 15 ALA MB 2 19 ASP H . . 4.940 3.932 3.721 4.144 . 0 0 "[ . 1 . 2]" 1
2434 2 15 ALA MB 2 19 ASP HB2 . . 3.830 2.067 1.903 3.561 . 0 0 "[ . 1 . 2]" 1
2435 2 15 ALA MB 2 19 ASP HB3 . . 4.270 2.531 2.065 2.887 . 0 0 "[ . 1 . 2]" 1
2436 2 15 ALA MB 2 21 VAL HB . . 4.790 4.390 4.283 4.556 . 0 0 "[ . 1 . 2]" 1
2437 2 15 ALA MB 2 80 LEU MD2 . . 3.340 2.653 1.989 3.058 . 0 0 "[ . 1 . 2]" 1
2438 2 15 ALA MB 2 106 LEU HA . . 5.500 5.308 4.925 5.529 0.029 15 0 "[ . 1 . 2]" 1
2439 2 15 ALA MB 2 107 GLU H . . 5.500 4.614 4.394 4.926 . 0 0 "[ . 1 . 2]" 1
2440 2 16 SER H 2 16 SER QB . . 3.630 2.521 2.245 2.870 . 0 0 "[ . 1 . 2]" 1
2441 2 16 SER H 2 19 ASP H . . 5.480 3.971 3.695 4.342 . 0 0 "[ . 1 . 2]" 1
2442 2 16 SER H 2 19 ASP HB2 . . 4.750 2.641 2.287 3.085 . 0 0 "[ . 1 . 2]" 1
2443 2 16 SER H 2 19 ASP HB3 . . 5.110 3.727 2.107 4.259 . 0 0 "[ . 1 . 2]" 1
2444 2 16 SER H 2 80 LEU MD1 . . 5.500 5.436 5.298 5.524 0.024 18 0 "[ . 1 . 2]" 1
2445 2 16 SER H 2 80 LEU HG . . 5.370 4.586 4.185 4.876 . 0 0 "[ . 1 . 2]" 1
2446 2 16 SER H 2 108 ILE MG . . 5.300 4.523 4.305 4.896 . 0 0 "[ . 1 . 2]" 1
2447 2 16 SER H 2 109 LYS QD . . 5.500 3.397 2.342 4.564 . 0 0 "[ . 1 . 2]" 1
2448 2 16 SER H 2 109 LYS QE . . 5.090 4.075 2.023 5.157 0.067 20 0 "[ . 1 . 2]" 1
2449 2 16 SER HA 2 108 ILE MD . . 4.060 3.664 2.446 4.109 0.049 20 0 "[ . 1 . 2]" 1
2450 2 16 SER HA 2 108 ILE HG12 . . 4.510 3.192 2.614 4.630 0.120 11 0 "[ . 1 . 2]" 1
2451 2 16 SER HA 2 108 ILE HG13 . . 4.640 4.533 4.240 4.681 0.041 8 0 "[ . 1 . 2]" 1
2452 2 16 SER HA 2 108 ILE MG . . 3.750 1.947 1.845 2.251 . 0 0 "[ . 1 . 2]" 1
2453 2 16 SER HA 2 109 LYS HB2 . . 4.830 3.676 2.942 4.280 . 0 0 "[ . 1 . 2]" 1
2454 2 16 SER QB 2 17 VAL H . . 3.890 3.014 2.366 3.465 . 0 0 "[ . 1 . 2]" 1
2455 2 16 SER QB 2 109 LYS H . . 5.340 2.966 2.252 3.750 . 0 0 "[ . 1 . 2]" 1
2456 2 16 SER QB 2 110 ARG H . . 5.340 5.251 4.640 5.468 0.128 9 0 "[ . 1 . 2]" 1
2457 2 16 SER HB2 2 17 VAL H . . 4.590 3.413 2.395 4.117 . 0 0 "[ . 1 . 2]" 1
2458 2 16 SER HB3 2 17 VAL H . . 4.590 3.624 2.644 3.887 . 0 0 "[ . 1 . 2]" 1
2459 2 17 VAL H 2 17 VAL HB . . 3.680 2.786 2.624 3.601 . 0 0 "[ . 1 . 2]" 1
2460 2 17 VAL H 2 17 VAL QG . . 3.450 1.861 1.769 1.937 . 0 0 "[ . 1 . 2]" 1
2461 2 17 VAL H 2 18 GLY H . . 5.450 4.488 4.467 4.522 . 0 0 "[ . 1 . 2]" 1
2462 2 17 VAL H 2 19 ASP H . . 5.500 4.605 4.507 4.703 . 0 0 "[ . 1 . 2]" 1
2463 2 17 VAL H 2 108 ILE MD . . 4.470 3.093 2.256 3.402 . 0 0 "[ . 1 . 2]" 1
2464 2 17 VAL H 2 108 ILE HG13 . . 4.990 5.038 4.419 5.128 0.138 1 0 "[ . 1 . 2]" 1
2465 2 17 VAL H 2 108 ILE MG . . 3.910 2.516 2.100 2.939 . 0 0 "[ . 1 . 2]" 1
2466 2 17 VAL HA 2 17 VAL MG1 . . 3.750 2.486 2.373 3.194 . 0 0 "[ . 1 . 2]" 1
2467 2 17 VAL HA 2 17 VAL MG2 . . 3.750 2.533 2.386 3.237 . 0 0 "[ . 1 . 2]" 1
2468 2 17 VAL HA 2 19 ASP H . . 4.930 3.483 3.301 3.607 . 0 0 "[ . 1 . 2]" 1
2469 2 17 VAL HA 2 80 LEU HB2 . . 5.200 3.799 3.614 4.065 . 0 0 "[ . 1 . 2]" 1
2470 2 17 VAL HA 2 80 LEU HB3 . . 4.850 2.095 1.901 2.329 . 0 0 "[ . 1 . 2]" 1
2471 2 17 VAL HA 2 80 LEU MD2 . . 4.740 4.696 4.475 4.795 0.055 7 0 "[ . 1 . 2]" 1
2472 2 17 VAL HA 2 80 LEU HG . . 5.500 3.966 3.486 4.167 . 0 0 "[ . 1 . 2]" 1
2473 2 17 VAL HB 2 18 GLY H . . 5.500 4.088 3.295 4.226 . 0 0 "[ . 1 . 2]" 1
2474 2 17 VAL HB 2 81 GLN HA . . 4.910 4.554 2.810 5.027 0.117 4 0 "[ . 1 . 2]" 1
2475 2 17 VAL QG 2 18 GLY H . . 3.830 2.850 2.681 3.536 . 0 0 "[ . 1 . 2]" 1
2476 2 17 VAL QG 2 19 ASP H . . 5.440 4.342 4.236 4.451 . 0 0 "[ . 1 . 2]" 1
2477 2 17 VAL QG 2 80 LEU HG . . 5.110 4.541 4.033 5.135 0.025 2 0 "[ . 1 . 2]" 1
2478 2 17 VAL QG 2 81 GLN H . . 5.440 4.053 3.846 4.500 . 0 0 "[ . 1 . 2]" 1
2479 2 17 VAL QG 2 81 GLN HA . . 3.900 2.167 1.940 3.083 . 0 0 "[ . 1 . 2]" 1
2480 2 17 VAL QG 2 81 GLN HB2 . . 5.440 4.544 4.341 5.005 . 0 0 "[ . 1 . 2]" 1
2481 2 17 VAL QG 2 81 GLN QE . . 4.720 2.708 2.129 4.290 . 0 0 "[ . 1 . 2]" 1
2482 2 17 VAL QG 2 81 GLN HG2 . . 5.440 4.333 3.981 5.477 0.037 8 0 "[ . 1 . 2]" 1
2483 2 17 VAL QG 2 82 PRO HA . . 3.980 2.678 2.188 4.030 0.050 10 0 "[ . 1 . 2]" 1
2484 2 17 VAL QG 2 82 PRO HB2 . . 4.700 3.927 3.489 4.537 . 0 0 "[ . 1 . 2]" 1
2485 2 17 VAL QG 2 82 PRO HD3 . . 3.590 1.956 1.823 2.203 . 0 0 "[ . 1 . 2]" 1
2486 2 17 VAL QG 2 82 PRO HG2 . . 4.170 3.482 2.934 3.990 . 0 0 "[ . 1 . 2]" 1
2487 2 17 VAL QG 2 82 PRO HG3 . . 4.420 2.482 1.922 3.164 . 0 0 "[ . 1 . 2]" 1
2488 2 17 VAL QG 2 83 GLU H . . 5.440 4.557 4.300 5.088 . 0 0 "[ . 1 . 2]" 1
2489 2 17 VAL QG 2 108 ILE HB . . 4.720 4.576 4.234 4.917 0.197 2 0 "[ . 1 . 2]" 1
2490 2 17 VAL MG1 2 18 GLY H . . 4.700 3.092 2.721 4.310 . 0 0 "[ . 1 . 2]" 1
2491 2 17 VAL MG1 2 81 GLN HA . . 4.630 2.412 1.974 4.411 . 0 0 "[ . 1 . 2]" 1
2492 2 17 VAL MG1 2 82 PRO HD2 . . 4.350 3.478 3.109 4.419 0.069 10 0 "[ . 1 . 2]" 1
2493 2 17 VAL MG1 2 82 PRO HD3 . . 4.190 2.177 1.918 3.251 . 0 0 "[ . 1 . 2]" 1
2494 2 17 VAL MG2 2 18 GLY H . . 4.700 3.958 2.758 4.179 . 0 0 "[ . 1 . 2]" 1
2495 2 17 VAL MG2 2 81 GLN HA . . 4.630 3.151 2.092 4.550 . 0 0 "[ . 1 . 2]" 1
2496 2 17 VAL MG2 2 82 PRO HD2 . . 4.350 3.775 3.047 4.478 0.128 8 0 "[ . 1 . 2]" 1
2497 2 17 VAL MG2 2 82 PRO HD3 . . 4.190 2.502 1.867 3.142 . 0 0 "[ . 1 . 2]" 1
2498 2 18 GLY H 2 19 ASP H . . 4.370 2.572 2.471 2.691 . 0 0 "[ . 1 . 2]" 1
2499 2 18 GLY H 2 79 SER HA . . 5.200 3.955 3.679 4.272 . 0 0 "[ . 1 . 2]" 1
2500 2 18 GLY H 2 80 LEU H . . 5.080 2.837 2.687 3.099 . 0 0 "[ . 1 . 2]" 1
2501 2 18 GLY H 2 80 LEU HB2 . . 5.090 3.471 3.226 3.606 . 0 0 "[ . 1 . 2]" 1
2502 2 18 GLY H 2 80 LEU HB3 . . 4.660 2.458 2.216 2.614 . 0 0 "[ . 1 . 2]" 1
2503 2 18 GLY H 2 80 LEU MD1 . . 5.500 4.136 3.877 4.307 . 0 0 "[ . 1 . 2]" 1
2504 2 18 GLY H 2 80 LEU MD2 . . 5.400 4.936 4.752 5.029 . 0 0 "[ . 1 . 2]" 1
2505 2 18 GLY H 2 81 GLN QE . . 5.340 3.361 2.923 4.196 . 0 0 "[ . 1 . 2]" 1
2506 2 18 GLY HA2 2 80 LEU H . . 5.500 3.782 3.435 4.003 . 0 0 "[ . 1 . 2]" 1
2507 2 18 GLY HA2 2 80 LEU HB3 . . 5.100 4.709 4.453 4.886 . 0 0 "[ . 1 . 2]" 1
2508 2 18 GLY HA2 2 81 GLN QE . . 5.340 3.822 3.357 4.215 . 0 0 "[ . 1 . 2]" 1
2509 2 19 ASP H 2 19 ASP HB2 . . 4.180 2.401 2.313 2.550 . 0 0 "[ . 1 . 2]" 1
2510 2 19 ASP H 2 19 ASP HB3 . . 4.200 3.576 2.452 3.674 . 0 0 "[ . 1 . 2]" 1
2511 2 19 ASP H 2 79 SER HA . . 5.370 4.403 4.044 4.919 . 0 0 "[ . 1 . 2]" 1
2512 2 19 ASP H 2 80 LEU H . . 4.880 3.237 3.008 3.543 . 0 0 "[ . 1 . 2]" 1
2513 2 19 ASP H 2 80 LEU HB2 . . 5.100 3.130 2.956 3.259 . 0 0 "[ . 1 . 2]" 1
2514 2 19 ASP H 2 80 LEU HB3 . . 4.520 2.912 2.719 3.059 . 0 0 "[ . 1 . 2]" 1
2515 2 19 ASP H 2 80 LEU MD2 . . 4.820 4.833 4.558 4.891 0.071 9 0 "[ . 1 . 2]" 1
2516 2 19 ASP HB2 2 20 ARG H . . 4.940 3.817 3.681 4.148 . 0 0 "[ . 1 . 2]" 1
2517 2 19 ASP HB2 2 80 LEU MD2 . . 5.240 4.379 4.028 5.342 0.102 1 0 "[ . 1 . 2]" 1
2518 2 19 ASP HB3 2 20 ARG H . . 4.510 2.575 2.408 3.844 . 0 0 "[ . 1 . 2]" 1
2519 2 19 ASP HB3 2 80 LEU MD2 . . 5.470 4.969 3.881 5.469 . 0 0 "[ . 1 . 2]" 1
2520 2 20 ARG H 2 20 ARG QD . . 4.850 4.500 3.941 4.804 . 0 0 "[ . 1 . 2]" 1
2521 2 20 ARG H 2 20 ARG HG2 . . 5.500 4.245 3.732 4.459 . 0 0 "[ . 1 . 2]" 1
2522 2 20 ARG H 2 20 ARG QG . . 4.760 3.648 2.522 4.009 . 0 0 "[ . 1 . 2]" 1
2523 2 20 ARG H 2 20 ARG HG3 . . 5.500 4.103 2.564 4.598 . 0 0 "[ . 1 . 2]" 1
2524 2 20 ARG HA 2 20 ARG QD . . 4.970 4.126 3.894 4.268 . 0 0 "[ . 1 . 2]" 1
2525 2 20 ARG HA 2 76 THR MG . . 4.450 4.308 3.999 4.498 0.048 6 0 "[ . 1 . 2]" 1
2526 2 20 ARG HA 2 77 ILE HB . . 5.500 3.844 3.616 4.323 . 0 0 "[ . 1 . 2]" 1
2527 2 20 ARG HA 2 78 SER HA . . 4.690 3.644 3.084 4.010 . 0 0 "[ . 1 . 2]" 1
2528 2 20 ARG HA 2 80 LEU H . . 5.500 3.820 3.543 4.124 . 0 0 "[ . 1 . 2]" 1
2529 2 20 ARG QB 2 76 THR MG . . 4.720 3.876 2.935 4.563 . 0 0 "[ . 1 . 2]" 1
2530 2 20 ARG HB2 2 21 VAL H . . 5.500 4.085 3.812 4.297 . 0 0 "[ . 1 . 2]" 1
2531 2 20 ARG HB2 2 76 THR MG . . 5.430 4.611 4.394 5.084 . 0 0 "[ . 1 . 2]" 1
2532 2 20 ARG HB2 2 78 SER HA . . 5.500 3.984 2.842 5.509 0.009 8 0 "[ . 1 . 2]" 1
2533 2 20 ARG HB3 2 21 VAL H . . 5.500 3.760 2.685 4.267 . 0 0 "[ . 1 . 2]" 1
2534 2 20 ARG HB3 2 76 THR MG . . 5.430 4.290 2.978 5.162 . 0 0 "[ . 1 . 2]" 1
2535 2 20 ARG HB3 2 78 SER HA . . 5.500 4.627 3.656 5.508 0.008 9 0 "[ . 1 . 2]" 1
2536 2 20 ARG QD 2 21 VAL H . . 5.130 4.685 4.438 5.205 0.075 14 0 "[ . 1 . 2]" 1
2537 2 20 ARG QD 2 76 THR MG . . 4.150 2.999 2.323 4.191 0.041 14 0 "[ . 1 . 2]" 1
2538 2 20 ARG QD 2 78 SER HA . . 5.200 3.540 2.766 4.235 . 0 0 "[ . 1 . 2]" 1
2539 2 20 ARG QG 2 21 VAL H . . 4.010 2.936 2.470 3.934 . 0 0 "[ . 1 . 2]" 1
2540 2 20 ARG QG 2 78 SER H . . 5.340 4.456 4.039 4.981 . 0 0 "[ . 1 . 2]" 1
2541 2 20 ARG QG 2 78 SER HA . . 4.300 2.341 1.961 2.876 . 0 0 "[ . 1 . 2]" 1
2542 2 20 ARG QG 2 79 SER H . . 5.340 4.866 4.469 5.262 . 0 0 "[ . 1 . 2]" 1
2543 2 20 ARG HG2 2 21 VAL H . . 4.740 3.252 2.558 4.162 . 0 0 "[ . 1 . 2]" 1
2544 2 20 ARG HG3 2 21 VAL H . . 4.740 3.441 2.674 4.842 0.102 16 0 "[ . 1 . 2]" 1
2545 2 21 VAL H 2 21 VAL HB . . 4.030 2.632 2.539 2.734 . 0 0 "[ . 1 . 2]" 1
2546 2 21 VAL H 2 21 VAL MG1 . . 4.600 3.859 3.820 3.918 . 0 0 "[ . 1 . 2]" 1
2547 2 21 VAL H 2 21 VAL QG . . 3.660 2.659 2.441 2.803 . 0 0 "[ . 1 . 2]" 1
2548 2 21 VAL H 2 21 VAL MG2 . . 4.600 2.711 2.468 2.875 . 0 0 "[ . 1 . 2]" 1
2549 2 21 VAL H 2 22 THR H . . 5.500 4.415 4.255 4.515 . 0 0 "[ . 1 . 2]" 1
2550 2 21 VAL H 2 76 THR MG . . 3.700 3.474 3.075 3.715 0.015 3 0 "[ . 1 . 2]" 1
2551 2 21 VAL H 2 77 ILE H . . 4.710 2.783 2.625 3.031 . 0 0 "[ . 1 . 2]" 1
2552 2 21 VAL H 2 77 ILE HB . . 4.980 2.681 2.450 2.917 . 0 0 "[ . 1 . 2]" 1
2553 2 21 VAL H 2 77 ILE MD . . 5.500 4.460 4.117 4.810 . 0 0 "[ . 1 . 2]" 1
2554 2 21 VAL H 2 77 ILE HG13 . . 4.770 4.404 4.176 4.772 0.002 3 0 "[ . 1 . 2]" 1
2555 2 21 VAL H 2 77 ILE MG . . 4.800 3.883 3.726 4.170 . 0 0 "[ . 1 . 2]" 1
2556 2 21 VAL H 2 78 SER HA . . 5.500 4.353 4.069 4.813 . 0 0 "[ . 1 . 2]" 1
2557 2 21 VAL H 2 80 LEU H . . 5.500 5.003 4.741 5.516 0.016 14 0 "[ . 1 . 2]" 1
2558 2 21 VAL HA 2 22 THR H . . 3.420 2.207 2.127 2.252 . 0 0 "[ . 1 . 2]" 1
2559 2 21 VAL HA 2 22 THR HB . . 5.460 4.550 4.383 4.676 . 0 0 "[ . 1 . 2]" 1
2560 2 21 VAL HA 2 77 ILE HB . . 5.430 4.732 4.531 4.962 . 0 0 "[ . 1 . 2]" 1
2561 2 21 VAL HB 2 22 THR H . . 4.760 4.089 3.921 4.279 . 0 0 "[ . 1 . 2]" 1
2562 2 21 VAL HB 2 77 ILE H . . 4.940 2.820 2.098 3.440 . 0 0 "[ . 1 . 2]" 1
2563 2 21 VAL HB 2 77 ILE HB . . 3.970 2.277 2.040 2.509 . 0 0 "[ . 1 . 2]" 1
2564 2 21 VAL HB 2 77 ILE MD . . 4.220 2.705 2.343 3.094 . 0 0 "[ . 1 . 2]" 1
2565 2 21 VAL HB 2 77 ILE HG13 . . 4.060 2.815 2.365 3.361 . 0 0 "[ . 1 . 2]" 1
2566 2 21 VAL HB 2 77 ILE MG . . 4.740 3.860 3.634 4.041 . 0 0 "[ . 1 . 2]" 1
2567 2 21 VAL QG 2 22 THR HA . . 5.440 3.396 3.284 3.524 . 0 0 "[ . 1 . 2]" 1
2568 2 21 VAL QG 2 23 ILE H . . 5.160 3.678 3.525 3.903 . 0 0 "[ . 1 . 2]" 1
2569 2 21 VAL QG 2 23 ILE HG13 . . 4.270 2.182 1.980 2.420 . 0 0 "[ . 1 . 2]" 1
2570 2 21 VAL QG 2 77 ILE H . . 4.770 3.494 3.098 3.786 . 0 0 "[ . 1 . 2]" 1
2571 2 21 VAL QG 2 77 ILE HB . . 3.560 2.821 2.170 3.335 . 0 0 "[ . 1 . 2]" 1
2572 2 21 VAL QG 2 77 ILE MD . . 3.700 2.534 1.992 2.972 . 0 0 "[ . 1 . 2]" 1
2573 2 21 VAL MG1 2 22 THR H . . 4.090 2.512 2.295 2.838 . 0 0 "[ . 1 . 2]" 1
2574 2 21 VAL MG1 2 77 ILE H . . 5.500 3.748 3.383 4.026 . 0 0 "[ . 1 . 2]" 1
2575 2 21 VAL MG1 2 77 ILE HB . . 4.120 3.894 3.666 4.123 0.003 9 0 "[ . 1 . 2]" 1
2576 2 21 VAL MG2 2 22 THR H . . 4.090 3.928 3.814 4.079 . 0 0 "[ . 1 . 2]" 1
2577 2 21 VAL MG2 2 77 ILE H . . 5.500 4.191 3.595 4.703 . 0 0 "[ . 1 . 2]" 1
2578 2 21 VAL MG2 2 77 ILE HB . . 4.120 2.909 2.186 3.553 . 0 0 "[ . 1 . 2]" 1
2579 2 22 THR H 2 22 THR HB . . 3.980 2.734 2.525 3.188 . 0 0 "[ . 1 . 2]" 1
2580 2 22 THR H 2 22 THR MG . . 4.610 3.617 2.250 3.875 . 0 0 "[ . 1 . 2]" 1
2581 2 22 THR H 2 23 ILE H . . 5.330 4.146 4.049 4.238 . 0 0 "[ . 1 . 2]" 1
2582 2 22 THR H 2 76 THR HA . . 4.870 4.691 4.567 4.811 . 0 0 "[ . 1 . 2]" 1
2583 2 22 THR H 2 77 ILE H . . 5.500 4.864 4.748 5.003 . 0 0 "[ . 1 . 2]" 1
2584 2 22 THR HA 2 22 THR MG . . 3.720 2.517 2.355 3.237 . 0 0 "[ . 1 . 2]" 1
2585 2 22 THR HA 2 75 PHE H . . 5.500 4.496 4.284 4.631 . 0 0 "[ . 1 . 2]" 1
2586 2 22 THR HA 2 76 THR HA . . 4.090 2.391 2.125 2.627 . 0 0 "[ . 1 . 2]" 1
2587 2 22 THR HA 2 76 THR MG . . 4.550 3.374 3.063 3.661 . 0 0 "[ . 1 . 2]" 1
2588 2 22 THR HA 2 77 ILE H . . 5.180 3.744 3.448 4.110 . 0 0 "[ . 1 . 2]" 1
2589 2 22 THR HB 2 23 ILE H . . 4.890 4.253 4.169 4.302 . 0 0 "[ . 1 . 2]" 1
2590 2 22 THR MG 2 23 ILE H . . 3.880 3.024 2.733 3.963 0.083 2 0 "[ . 1 . 2]" 1
2591 2 22 THR MG 2 24 THR H . . 4.970 4.594 4.295 5.053 0.083 15 0 "[ . 1 . 2]" 1
2592 2 23 ILE H 2 23 ILE MD . . 4.970 4.000 3.907 4.102 . 0 0 "[ . 1 . 2]" 1
2593 2 23 ILE H 2 23 ILE HG12 . . 5.430 3.850 3.779 3.944 . 0 0 "[ . 1 . 2]" 1
2594 2 23 ILE H 2 23 ILE HG13 . . 4.750 2.734 2.623 2.868 . 0 0 "[ . 1 . 2]" 1
2595 2 23 ILE H 2 23 ILE MG . . 4.630 3.819 3.759 3.865 . 0 0 "[ . 1 . 2]" 1
2596 2 23 ILE H 2 24 THR H . . 5.130 4.397 4.331 4.454 . 0 0 "[ . 1 . 2]" 1
2597 2 23 ILE H 2 74 THR HA . . 5.500 4.595 4.312 4.878 . 0 0 "[ . 1 . 2]" 1
2598 2 23 ILE H 2 74 THR MG . . 4.170 3.728 3.258 4.267 0.097 10 0 "[ . 1 . 2]" 1
2599 2 23 ILE H 2 75 PHE H . . 4.700 3.004 2.782 3.199 . 0 0 "[ . 1 . 2]" 1
2600 2 23 ILE H 2 75 PHE HB2 . . 5.490 4.676 4.487 5.003 . 0 0 "[ . 1 . 2]" 1
2601 2 23 ILE H 2 75 PHE HB3 . . 5.500 3.095 2.896 3.458 . 0 0 "[ . 1 . 2]" 1
2602 2 23 ILE H 2 75 PHE QE . . 5.500 5.517 5.408 5.569 0.069 5 0 "[ . 1 . 2]" 1
2603 2 23 ILE H 2 76 THR H . . 5.500 4.795 4.726 4.900 . 0 0 "[ . 1 . 2]" 1
2604 2 23 ILE HA 2 23 ILE MD . . 4.760 3.891 3.862 3.922 . 0 0 "[ . 1 . 2]" 1
2605 2 23 ILE HA 2 75 PHE H . . 5.500 4.746 4.646 4.877 . 0 0 "[ . 1 . 2]" 1
2606 2 23 ILE HB 2 24 THR H . . 5.090 3.955 3.854 4.073 . 0 0 "[ . 1 . 2]" 1
2607 2 23 ILE HB 2 75 PHE HB2 . . 5.040 3.593 3.436 3.725 . 0 0 "[ . 1 . 2]" 1
2608 2 23 ILE HB 2 75 PHE HB3 . . 5.120 1.974 1.895 2.102 . 0 0 "[ . 1 . 2]" 1
2609 2 23 ILE HB 2 75 PHE QE . . 4.980 4.638 4.426 4.839 . 0 0 "[ . 1 . 2]" 1
2610 2 23 ILE HB 2 104 THR HB . . 5.500 5.411 5.194 5.532 0.032 1 0 "[ . 1 . 2]" 1
2611 2 23 ILE MD 2 23 ILE MG . . 3.430 1.929 1.886 1.950 . 0 0 "[ . 1 . 2]" 1
2612 2 23 ILE MD 2 37 TRP HZ3 . . 5.050 3.785 3.412 4.116 . 0 0 "[ . 1 . 2]" 1
2613 2 23 ILE MD 2 75 PHE HB2 . . 5.500 4.597 4.403 4.787 . 0 0 "[ . 1 . 2]" 1
2614 2 23 ILE MD 2 75 PHE QE . . 3.740 2.825 2.627 2.909 . 0 0 "[ . 1 . 2]" 1
2615 2 23 ILE MD 2 75 PHE HZ . . 4.720 4.657 4.467 4.737 0.017 13 0 "[ . 1 . 2]" 1
2616 2 23 ILE MD 2 88 TYR H . . 5.200 4.007 3.768 4.317 . 0 0 "[ . 1 . 2]" 1
2617 2 23 ILE MD 2 88 TYR HA . . 4.750 4.685 4.436 4.844 0.094 1 0 "[ . 1 . 2]" 1
2618 2 23 ILE MD 2 88 TYR HB2 . . 4.050 2.275 2.077 2.504 . 0 0 "[ . 1 . 2]" 1
2619 2 23 ILE MD 2 88 TYR HB3 . . 4.610 2.938 2.578 3.179 . 0 0 "[ . 1 . 2]" 1
2620 2 23 ILE MD 2 88 TYR QD . . 4.250 2.940 2.090 3.297 . 0 0 "[ . 1 . 2]" 1
2621 2 23 ILE MD 2 89 TYR H . . 5.500 5.159 4.802 5.379 . 0 0 "[ . 1 . 2]" 1
2622 2 23 ILE MD 2 104 THR H . . 5.500 5.431 5.074 5.538 0.038 10 0 "[ . 1 . 2]" 1
2623 2 23 ILE MD 2 104 THR HB . . 3.940 2.995 2.798 3.214 . 0 0 "[ . 1 . 2]" 1
2624 2 23 ILE MD 2 104 THR MG . . 3.400 2.121 1.990 2.331 . 0 0 "[ . 1 . 2]" 1
2625 2 23 ILE HG12 2 23 ILE MG . . 3.530 2.406 2.370 2.455 . 0 0 "[ . 1 . 2]" 1
2626 2 23 ILE HG12 2 75 PHE QE . . 5.500 5.482 5.358 5.532 0.032 3 0 "[ . 1 . 2]" 1
2627 2 23 ILE HG13 2 23 ILE MG . . 3.570 3.199 3.180 3.215 . 0 0 "[ . 1 . 2]" 1
2628 2 23 ILE HG13 2 75 PHE QE . . 4.590 4.252 4.137 4.312 . 0 0 "[ . 1 . 2]" 1
2629 2 23 ILE MG 2 24 THR H . . 3.890 2.375 2.244 2.581 . 0 0 "[ . 1 . 2]" 1
2630 2 23 ILE MG 2 37 TRP HE3 . . 4.710 4.390 4.083 4.693 . 0 0 "[ . 1 . 2]" 1
2631 2 23 ILE MG 2 37 TRP HH2 . . 3.750 3.091 2.760 3.539 . 0 0 "[ . 1 . 2]" 1
2632 2 23 ILE MG 2 37 TRP HZ3 . . 4.140 2.617 2.294 2.982 . 0 0 "[ . 1 . 2]" 1
2633 2 23 ILE MG 2 75 PHE HB3 . . 3.990 3.347 3.084 3.554 . 0 0 "[ . 1 . 2]" 1
2634 2 23 ILE MG 2 75 PHE QE . . 5.220 5.114 4.903 5.243 0.023 14 0 "[ . 1 . 2]" 1
2635 2 23 ILE MG 2 88 TYR HB2 . . 5.440 3.586 3.325 3.916 . 0 0 "[ . 1 . 2]" 1
2636 2 23 ILE MG 2 89 TYR HA . . 5.500 4.406 3.870 5.130 . 0 0 "[ . 1 . 2]" 1
2637 2 23 ILE MG 2 104 THR H . . 5.500 4.819 4.568 5.068 . 0 0 "[ . 1 . 2]" 1
2638 2 23 ILE MG 2 104 THR HB . . 4.940 2.836 2.566 3.011 . 0 0 "[ . 1 . 2]" 1
2639 2 24 THR H 2 24 THR MG . . 4.060 3.734 2.888 3.912 . 0 0 "[ . 1 . 2]" 1
2640 2 24 THR H 2 25 CYS H . . 5.110 4.333 4.259 4.373 . 0 0 "[ . 1 . 2]" 1
2641 2 24 THR H 2 37 TRP HH2 . . 5.500 4.647 4.340 4.915 . 0 0 "[ . 1 . 2]" 1
2642 2 24 THR H 2 74 THR HA . . 5.500 5.005 4.833 5.222 . 0 0 "[ . 1 . 2]" 1
2643 2 24 THR HA 2 37 TRP HH2 . . 4.620 3.480 3.323 3.797 . 0 0 "[ . 1 . 2]" 1
2644 2 24 THR HA 2 37 TRP HZ2 . . 4.630 4.547 4.313 4.711 0.081 17 0 "[ . 1 . 2]" 1
2645 2 24 THR HA 2 74 THR H . . 5.500 4.919 4.765 5.119 . 0 0 "[ . 1 . 2]" 1
2646 2 24 THR HA 2 74 THR HA . . 4.210 2.448 2.219 2.599 . 0 0 "[ . 1 . 2]" 1
2647 2 24 THR HA 2 74 THR HB . . 5.500 5.301 4.446 5.541 0.041 11 0 "[ . 1 . 2]" 1
2648 2 24 THR HA 2 74 THR MG . . 4.500 3.548 2.636 3.950 . 0 0 "[ . 1 . 2]" 1
2649 2 24 THR HA 2 75 PHE H . . 4.810 3.231 2.999 3.453 . 0 0 "[ . 1 . 2]" 1
2650 2 24 THR HB 2 25 CYS H . . 4.420 3.918 2.974 4.237 . 0 0 "[ . 1 . 2]" 1
2651 2 24 THR HB 2 74 THR MG . . 5.270 4.915 4.025 5.292 0.022 6 0 "[ . 1 . 2]" 1
2652 2 24 THR MG 2 25 CYS H . . 3.940 2.731 2.446 3.833 . 0 0 "[ . 1 . 2]" 1
2653 2 24 THR MG 2 72 GLU QG . . 4.560 4.023 3.506 4.633 0.073 7 0 "[ . 1 . 2]" 1
2654 2 24 THR MG 2 73 PHE H . . 5.130 3.448 2.951 5.132 0.002 19 0 "[ . 1 . 2]" 1
2655 2 24 THR MG 2 74 THR H . . 5.500 4.807 4.512 5.339 . 0 0 "[ . 1 . 2]" 1
2656 2 24 THR MG 2 74 THR HA . . 4.590 3.253 2.522 3.811 . 0 0 "[ . 1 . 2]" 1
2657 2 25 CYS CB 2 90 CYS SG . . 3.100 3.038 3.011 3.072 . 0 0 "[ . 1 . 2]" 1
2658 2 25 CYS H 2 37 TRP HH2 . . 4.550 3.004 2.735 3.454 . 0 0 "[ . 1 . 2]" 1
2659 2 25 CYS H 2 37 TRP HZ2 . . 4.750 3.693 3.330 3.877 . 0 0 "[ . 1 . 2]" 1
2660 2 25 CYS H 2 72 GLU HA . . 5.500 4.661 4.367 4.956 . 0 0 "[ . 1 . 2]" 1
2661 2 25 CYS H 2 73 PHE H . . 4.900 2.970 2.651 3.219 . 0 0 "[ . 1 . 2]" 1
2662 2 25 CYS H 2 73 PHE HB3 . . 5.500 4.347 4.083 4.800 . 0 0 "[ . 1 . 2]" 1
2663 2 25 CYS H 2 74 THR H . . 5.500 4.867 4.761 4.960 . 0 0 "[ . 1 . 2]" 1
2664 2 25 CYS H 2 74 THR HA . . 4.740 3.563 3.388 3.787 . 0 0 "[ . 1 . 2]" 1
2665 2 25 CYS H 2 74 THR MG . . 5.420 5.010 3.914 5.396 . 0 0 "[ . 1 . 2]" 1
2666 2 25 CYS HA 2 73 PHE H . . 5.500 4.848 4.629 5.068 . 0 0 "[ . 1 . 2]" 1
2667 2 25 CYS HB2 2 26 GLN H . . 5.180 4.163 3.939 4.246 . 0 0 "[ . 1 . 2]" 1
2668 2 25 CYS HB2 2 35 LEU MD1 . . 4.750 4.180 3.649 4.662 . 0 0 "[ . 1 . 2]" 1
2669 2 25 CYS HB2 2 35 LEU QD . . 4.060 3.437 2.679 4.072 0.012 17 0 "[ . 1 . 2]" 1
2670 2 25 CYS HB2 2 35 LEU MD2 . . 4.750 3.772 2.721 4.697 . 0 0 "[ . 1 . 2]" 1
2671 2 25 CYS HB2 2 37 TRP HH2 . . 5.500 2.501 2.006 3.237 . 0 0 "[ . 1 . 2]" 1
2672 2 25 CYS HB2 2 37 TRP HZ2 . . 4.000 3.296 3.030 3.683 . 0 0 "[ . 1 . 2]" 1
2673 2 25 CYS HB2 2 73 PHE QD . . 4.780 3.778 2.263 4.832 0.052 1 0 "[ . 1 . 2]" 1
2674 2 25 CYS HB2 2 90 CYS HB3 . . 5.500 3.556 2.790 4.230 . 0 0 "[ . 1 . 2]" 1
2675 2 25 CYS HB3 2 26 GLN H . . 5.500 3.592 2.727 4.136 . 0 0 "[ . 1 . 2]" 1
2676 2 25 CYS HB3 2 35 LEU MD1 . . 5.500 3.939 3.657 4.588 . 0 0 "[ . 1 . 2]" 1
2677 2 25 CYS HB3 2 35 LEU QD . . 4.780 3.204 2.446 3.547 . 0 0 "[ . 1 . 2]" 1
2678 2 25 CYS HB3 2 35 LEU MD2 . . 5.500 3.450 2.481 4.035 . 0 0 "[ . 1 . 2]" 1
2679 2 25 CYS HB3 2 37 TRP HH2 . . 4.320 3.510 2.580 4.393 0.073 14 0 "[ . 1 . 2]" 1
2680 2 25 CYS HB3 2 37 TRP HZ2 . . 4.620 3.766 2.639 4.706 0.086 2 0 "[ . 1 . 2]" 1
2681 2 25 CYS HB3 2 90 CYS HB2 . . 5.500 3.959 3.585 4.471 . 0 0 "[ . 1 . 2]" 1
2682 2 25 CYS HB3 2 90 CYS HB3 . . 5.500 4.038 3.391 4.555 . 0 0 "[ . 1 . 2]" 1
2683 2 25 CYS SG 2 90 CYS CB . . 3.100 3.090 3.058 3.122 0.022 1 0 "[ . 1 . 2]" 1
2684 2 25 CYS SG 2 90 CYS SG . . 2.100 2.035 2.026 2.045 . 0 0 "[ . 1 . 2]" 1
2685 2 26 GLN H 2 26 GLN HG2 . . 4.890 3.927 3.853 4.136 . 0 0 "[ . 1 . 2]" 1
2686 2 26 GLN H 2 26 GLN HG3 . . 4.910 2.847 2.748 3.153 . 0 0 "[ . 1 . 2]" 1
2687 2 26 GLN HA 2 27 ALA MB . . 5.070 3.950 3.809 4.009 . 0 0 "[ . 1 . 2]" 1
2688 2 26 GLN HA 2 71 THR HA . . 5.500 4.091 2.892 4.535 . 0 0 "[ . 1 . 2]" 1
2689 2 26 GLN HA 2 72 GLU HA . . 4.420 2.910 2.465 3.668 . 0 0 "[ . 1 . 2]" 1
2690 2 26 GLN HA 2 73 PHE H . . 5.140 3.699 3.409 4.140 . 0 0 "[ . 1 . 2]" 1
2691 2 26 GLN HB2 2 26 GLN HE22 . . 5.500 4.009 3.468 4.498 . 0 0 "[ . 1 . 2]" 1
2692 2 26 GLN HB2 2 27 ALA H . . 4.830 4.077 3.858 4.196 . 0 0 "[ . 1 . 2]" 1
2693 2 26 GLN HB3 2 26 GLN QE . . 4.260 3.583 2.543 4.110 . 0 0 "[ . 1 . 2]" 1
2694 2 26 GLN HB3 2 27 ALA H . . 5.010 3.207 2.833 3.432 . 0 0 "[ . 1 . 2]" 1
2695 2 26 GLN HG2 2 27 ALA H . . 4.670 4.448 4.190 4.625 . 0 0 "[ . 1 . 2]" 1
2696 2 26 GLN HG2 2 72 GLU HA . . 4.940 3.426 3.013 3.904 . 0 0 "[ . 1 . 2]" 1
2697 2 26 GLN HG2 2 72 GLU HG2 . . 5.330 3.218 2.030 5.064 . 0 0 "[ . 1 . 2]" 1
2698 2 26 GLN HG2 2 72 GLU QG . . 4.570 2.992 2.019 4.049 . 0 0 "[ . 1 . 2]" 1
2699 2 26 GLN HG2 2 72 GLU HG3 . . 5.330 4.345 2.736 5.336 0.006 12 0 "[ . 1 . 2]" 1
2700 2 26 GLN HG2 2 73 PHE H . . 5.500 4.390 3.882 5.016 . 0 0 "[ . 1 . 2]" 1
2701 2 26 GLN HG3 2 72 GLU HA . . 5.360 4.573 4.161 4.883 . 0 0 "[ . 1 . 2]" 1
2702 2 27 ALA H 2 28 SER H . . 5.500 4.476 4.390 4.559 . 0 0 "[ . 1 . 2]" 1
2703 2 27 ALA H 2 29 GLN H . . 5.500 5.385 4.938 5.554 0.054 8 0 "[ . 1 . 2]" 1
2704 2 27 ALA H 2 71 THR HA . . 4.640 2.567 1.937 2.862 . 0 0 "[ . 1 . 2]" 1
2705 2 27 ALA H 2 71 THR MG . . 4.550 3.563 2.707 3.957 . 0 0 "[ . 1 . 2]" 1
2706 2 27 ALA H 2 72 GLU H . . 5.500 4.851 4.583 5.098 . 0 0 "[ . 1 . 2]" 1
2707 2 27 ALA HA 2 29 GLN H . . 5.240 4.005 3.662 4.199 . 0 0 "[ . 1 . 2]" 1
2708 2 27 ALA MB 2 28 SER H . . 4.120 2.844 2.640 3.028 . 0 0 "[ . 1 . 2]" 1
2709 2 27 ALA MB 2 29 GLN H . . 3.770 2.737 2.518 2.956 . 0 0 "[ . 1 . 2]" 1
2710 2 27 ALA MB 2 30 ASP H . . 5.500 4.816 4.611 5.200 . 0 0 "[ . 1 . 2]" 1
2711 2 27 ALA MB 2 30 ASP HA . . 5.130 3.388 2.981 3.927 . 0 0 "[ . 1 . 2]" 1
2712 2 27 ALA MB 2 31 ILE H . . 4.960 3.867 3.461 4.245 . 0 0 "[ . 1 . 2]" 1
2713 2 27 ALA MB 2 31 ILE HB . . 5.500 5.051 4.601 5.514 0.014 17 0 "[ . 1 . 2]" 1
2714 2 27 ALA MB 2 31 ILE MD . . 3.840 2.860 2.480 3.305 . 0 0 "[ . 1 . 2]" 1
2715 2 27 ALA MB 2 31 ILE QG . . 3.900 3.199 2.877 3.671 . 0 0 "[ . 1 . 2]" 1
2716 2 27 ALA MB 2 31 ILE MG . . 3.780 2.820 2.390 3.180 . 0 0 "[ . 1 . 2]" 1
2717 2 27 ALA MB 2 70 GLY HA2 . . 5.450 4.674 4.256 5.028 . 0 0 "[ . 1 . 2]" 1
2718 2 27 ALA MB 2 71 THR H . . 5.500 4.359 2.763 4.659 . 0 0 "[ . 1 . 2]" 1
2719 2 27 ALA MB 2 71 THR HA . . 3.710 2.045 1.883 2.370 . 0 0 "[ . 1 . 2]" 1
2720 2 27 ALA MB 2 71 THR HB . . 3.760 3.696 3.531 3.793 0.033 14 0 "[ . 1 . 2]" 1
2721 2 27 ALA MB 2 71 THR MG . . 3.450 2.567 2.058 3.028 . 0 0 "[ . 1 . 2]" 1
2722 2 27 ALA MB 2 72 GLU H . . 5.110 4.969 4.677 5.125 0.015 16 0 "[ . 1 . 2]" 1
2723 2 27 ALA MB 2 73 PHE QD . . 4.680 3.826 3.568 4.125 . 0 0 "[ . 1 . 2]" 1
2724 2 27 ALA MB 2 73 PHE QE . . 5.490 2.527 1.985 2.999 . 0 0 "[ . 1 . 2]" 1
2725 2 27 ALA MB 2 92 GLN HG2 . . 5.120 3.576 3.241 3.834 . 0 0 "[ . 1 . 2]" 1
2726 2 28 SER H 2 29 GLN H . . 4.300 2.644 2.472 2.821 . 0 0 "[ . 1 . 2]" 1
2727 2 29 GLN H 2 29 GLN HG2 . . 4.830 4.470 4.326 4.594 . 0 0 "[ . 1 . 2]" 1
2728 2 29 GLN H 2 30 ASP H . . 5.260 4.332 4.222 4.422 . 0 0 "[ . 1 . 2]" 1
2729 2 29 GLN H 2 71 THR MG . . 4.550 3.915 3.166 4.387 . 0 0 "[ . 1 . 2]" 1
2730 2 29 GLN HA 2 29 GLN HG3 . . 3.940 2.614 2.526 2.681 . 0 0 "[ . 1 . 2]" 1
2731 2 29 GLN HA 2 71 THR MG . . 4.510 3.555 3.105 3.807 . 0 0 "[ . 1 . 2]" 1
2732 2 29 GLN HB2 2 30 ASP H . . 4.290 4.010 3.643 4.155 . 0 0 "[ . 1 . 2]" 1
2733 2 29 GLN HB3 2 29 GLN HE21 . . 4.070 2.752 1.832 4.023 . 0 0 "[ . 1 . 2]" 1
2734 2 29 GLN HB3 2 29 GLN HE22 . . 4.730 3.894 3.456 4.841 0.111 8 0 "[ . 1 . 2]" 1
2735 2 29 GLN HB3 2 30 ASP H . . 4.540 3.728 2.422 4.079 . 0 0 "[ . 1 . 2]" 1
2736 2 29 GLN HE21 2 95 ASN HD21 . . 5.500 3.845 2.486 5.546 0.046 1 0 "[ . 1 . 2]" 1
2737 2 29 GLN HG2 2 30 ASP H . . 4.750 2.750 2.324 4.592 . 0 0 "[ . 1 . 2]" 1
2738 2 29 GLN HG3 2 30 ASP H . . 4.410 2.923 2.593 4.197 . 0 0 "[ . 1 . 2]" 1
2739 2 30 ASP H 2 30 ASP HB2 . . 3.930 2.762 2.480 3.725 . 0 0 "[ . 1 . 2]" 1
2740 2 30 ASP H 2 30 ASP QB . . 3.450 2.378 2.239 2.768 . 0 0 "[ . 1 . 2]" 1
2741 2 30 ASP H 2 30 ASP HB3 . . 3.930 2.821 2.439 3.670 . 0 0 "[ . 1 . 2]" 1
2742 2 30 ASP H 2 31 ILE H . . 5.430 4.525 4.444 4.588 . 0 0 "[ . 1 . 2]" 1
2743 2 30 ASP H 2 71 THR MG . . 4.150 3.405 2.936 3.661 . 0 0 "[ . 1 . 2]" 1
2744 2 30 ASP HA 2 31 ILE MG . . 4.990 3.449 3.285 3.591 . 0 0 "[ . 1 . 2]" 1
2745 2 30 ASP HA 2 32 ASN H . . 4.270 3.778 3.465 3.982 . 0 0 "[ . 1 . 2]" 1
2746 2 30 ASP HA 2 71 THR MG . . 3.600 2.395 2.106 2.765 . 0 0 "[ . 1 . 2]" 1
2747 2 30 ASP QB 2 32 ASN H . . 5.310 3.246 2.353 3.767 . 0 0 "[ . 1 . 2]" 1
2748 2 30 ASP QB 2 71 THR MG . . 4.280 2.734 1.953 3.577 . 0 0 "[ . 1 . 2]" 1
2749 2 31 ILE H 2 31 ILE MD . . 5.500 3.651 3.504 3.857 . 0 0 "[ . 1 . 2]" 1
2750 2 31 ILE H 2 31 ILE QG . . 4.730 1.964 1.805 2.200 . 0 0 "[ . 1 . 2]" 1
2751 2 31 ILE H 2 31 ILE MG . . 4.310 2.752 2.502 2.963 . 0 0 "[ . 1 . 2]" 1
2752 2 31 ILE H 2 32 ASN H . . 4.100 2.380 1.989 2.699 . 0 0 "[ . 1 . 2]" 1
2753 2 31 ILE H 2 70 GLY H . . 5.500 4.091 3.838 4.332 . 0 0 "[ . 1 . 2]" 1
2754 2 31 ILE HA 2 34 TYR H . . 5.500 4.634 4.492 4.746 . 0 0 "[ . 1 . 2]" 1
2755 2 31 ILE HA 2 94 ASP HB2 . . 5.500 3.126 2.707 3.517 . 0 0 "[ . 1 . 2]" 1
2756 2 31 ILE HA 2 94 ASP HB3 . . 5.500 2.875 2.539 3.344 . 0 0 "[ . 1 . 2]" 1
2757 2 31 ILE HB 2 32 ASN H . . 5.500 4.382 4.317 4.456 . 0 0 "[ . 1 . 2]" 1
2758 2 31 ILE HB 2 34 TYR H . . 5.480 3.146 2.908 3.396 . 0 0 "[ . 1 . 2]" 1
2759 2 31 ILE HB 2 34 TYR HB2 . . 4.730 2.873 2.736 3.027 . 0 0 "[ . 1 . 2]" 1
2760 2 31 ILE HB 2 93 TYR H . . 5.500 4.353 4.068 4.626 . 0 0 "[ . 1 . 2]" 1
2761 2 31 ILE HB 2 94 ASP H . . 5.250 3.631 3.344 3.843 . 0 0 "[ . 1 . 2]" 1
2762 2 31 ILE HB 2 94 ASP HA . . 5.420 4.561 4.277 4.781 . 0 0 "[ . 1 . 2]" 1
2763 2 31 ILE HB 2 94 ASP QB . . 4.750 2.088 1.886 2.239 . 0 0 "[ . 1 . 2]" 1
2764 2 31 ILE MD 2 31 ILE MG . . 3.520 1.908 1.849 1.998 . 0 0 "[ . 1 . 2]" 1
2765 2 31 ILE MD 2 32 ASN H . . 5.500 4.940 4.665 5.080 . 0 0 "[ . 1 . 2]" 1
2766 2 31 ILE MD 2 34 TYR H . . 5.150 3.412 2.972 3.702 . 0 0 "[ . 1 . 2]" 1
2767 2 31 ILE MD 2 35 LEU H . . 5.500 3.855 3.438 4.130 . 0 0 "[ . 1 . 2]" 1
2768 2 31 ILE MD 2 35 LEU HA . . 5.300 3.073 2.906 3.258 . 0 0 "[ . 1 . 2]" 1
2769 2 31 ILE MD 2 35 LEU HB2 . . 4.410 2.248 1.916 2.531 . 0 0 "[ . 1 . 2]" 1
2770 2 31 ILE MD 2 35 LEU HB3 . . 5.040 3.686 3.264 3.979 . 0 0 "[ . 1 . 2]" 1
2771 2 31 ILE MD 2 35 LEU QD . . 3.880 2.449 2.277 2.656 . 0 0 "[ . 1 . 2]" 1
2772 2 31 ILE MD 2 53 ALA MB . . 5.490 4.215 3.543 4.655 . 0 0 "[ . 1 . 2]" 1
2773 2 31 ILE MD 2 70 GLY H . . 5.500 3.968 3.519 4.209 . 0 0 "[ . 1 . 2]" 1
2774 2 31 ILE MD 2 70 GLY HA2 . . 5.170 4.129 3.824 4.373 . 0 0 "[ . 1 . 2]" 1
2775 2 31 ILE MD 2 73 PHE QD . . 4.540 3.755 3.662 3.879 . 0 0 "[ . 1 . 2]" 1
2776 2 31 ILE MD 2 73 PHE QE . . 4.350 2.154 1.937 2.408 . 0 0 "[ . 1 . 2]" 1
2777 2 31 ILE MD 2 92 GLN H . . 5.500 4.718 4.505 5.050 . 0 0 "[ . 1 . 2]" 1
2778 2 31 ILE MD 2 92 GLN HA . . 4.990 3.306 3.096 3.730 . 0 0 "[ . 1 . 2]" 1
2779 2 31 ILE MD 2 92 GLN HB2 . . 4.350 2.536 2.283 2.932 . 0 0 "[ . 1 . 2]" 1
2780 2 31 ILE MD 2 92 GLN HB3 . . 4.420 2.067 1.903 2.434 . 0 0 "[ . 1 . 2]" 1
2781 2 31 ILE MD 2 92 GLN HG3 . . 5.030 3.702 3.497 4.366 . 0 0 "[ . 1 . 2]" 1
2782 2 31 ILE MD 2 93 TYR H . . 5.500 3.765 3.464 4.097 . 0 0 "[ . 1 . 2]" 1
2783 2 31 ILE MD 2 94 ASP HB2 . . 5.500 4.064 3.833 4.299 . 0 0 "[ . 1 . 2]" 1
2784 2 31 ILE MD 2 94 ASP HB3 . . 5.500 4.198 3.971 4.439 . 0 0 "[ . 1 . 2]" 1
2785 2 31 ILE QG 2 32 ASN H . . 5.280 3.365 3.077 3.525 . 0 0 "[ . 1 . 2]" 1
2786 2 31 ILE QG 2 70 GLY H . . 5.500 3.066 2.922 3.232 . 0 0 "[ . 1 . 2]" 1
2787 2 31 ILE QG 2 73 PHE QD . . 4.730 4.770 4.733 4.838 0.108 18 0 "[ . 1 . 2]" 1
2788 2 31 ILE QG 2 73 PHE QE . . 4.280 2.839 2.760 2.966 . 0 0 "[ . 1 . 2]" 1
2789 2 31 ILE MG 2 32 ASN H . . 5.280 4.278 4.197 4.360 . 0 0 "[ . 1 . 2]" 1
2790 2 31 ILE MG 2 34 TYR H . . 5.500 4.609 4.400 4.797 . 0 0 "[ . 1 . 2]" 1
2791 2 31 ILE MG 2 34 TYR QD . . 4.570 4.598 4.474 4.651 0.081 18 0 "[ . 1 . 2]" 1
2792 2 31 ILE MG 2 35 LEU QD . . 5.250 4.145 3.820 4.459 . 0 0 "[ . 1 . 2]" 1
2793 2 31 ILE MG 2 70 GLY H . . 5.500 5.509 5.408 5.575 0.075 14 0 "[ . 1 . 2]" 1
2794 2 31 ILE MG 2 92 GLN HB2 . . 5.430 2.234 2.039 2.623 . 0 0 "[ . 1 . 2]" 1
2795 2 31 ILE MG 2 92 GLN HB3 . . 5.040 2.768 2.410 3.248 . 0 0 "[ . 1 . 2]" 1
2796 2 31 ILE MG 2 92 GLN HG3 . . 5.500 3.673 3.476 3.908 . 0 0 "[ . 1 . 2]" 1
2797 2 31 ILE MG 2 94 ASP H . . 5.310 3.405 3.239 3.720 . 0 0 "[ . 1 . 2]" 1
2798 2 31 ILE MG 2 94 ASP HA . . 5.320 4.731 4.600 4.911 . 0 0 "[ . 1 . 2]" 1
2799 2 31 ILE MG 2 94 ASP HB2 . . 4.480 3.154 2.876 3.504 . 0 0 "[ . 1 . 2]" 1
2800 2 31 ILE MG 2 94 ASP QB . . 3.810 2.081 1.946 2.289 . 0 0 "[ . 1 . 2]" 1
2801 2 31 ILE MG 2 94 ASP HB3 . . 4.480 2.113 1.967 2.363 . 0 0 "[ . 1 . 2]" 1
2802 2 31 ILE MG 2 95 ASN H . . 4.850 3.609 3.410 4.152 . 0 0 "[ . 1 . 2]" 1
2803 2 32 ASN H 2 33 ASN H . . 5.310 3.965 3.713 4.247 . 0 0 "[ . 1 . 2]" 1
2804 2 32 ASN H 2 70 GLY H . . 4.660 4.162 3.815 4.530 . 0 0 "[ . 1 . 2]" 1
2805 2 32 ASN H 2 70 GLY HA2 . . 5.400 2.622 2.302 3.419 . 0 0 "[ . 1 . 2]" 1
2806 2 32 ASN H 2 70 GLY HA3 . . 5.150 3.757 3.374 4.137 . 0 0 "[ . 1 . 2]" 1
2807 2 32 ASN HA 2 69 SER QB . . 4.900 4.469 3.830 4.991 0.091 10 0 "[ . 1 . 2]" 1
2808 2 32 ASN HA 2 70 GLY H . . 5.030 3.994 3.594 4.528 . 0 0 "[ . 1 . 2]" 1
2809 2 32 ASN HB2 2 33 ASN H . . 3.770 2.789 2.025 3.693 . 0 0 "[ . 1 . 2]" 1
2810 2 32 ASN HB2 2 34 TYR H . . 5.040 4.095 3.273 5.053 0.013 10 0 "[ . 1 . 2]" 1
2811 2 32 ASN HB2 2 34 TYR QD . . 4.970 3.474 2.608 4.534 . 0 0 "[ . 1 . 2]" 1
2812 2 32 ASN HB2 2 34 TYR QE . . 5.100 3.122 2.289 4.006 . 0 0 "[ . 1 . 2]" 1
2813 2 32 ASN HB3 2 33 ASN H . . 3.890 2.525 1.916 3.160 . 0 0 "[ . 1 . 2]" 1
2814 2 32 ASN HB3 2 34 TYR H . . 5.180 4.012 3.108 4.724 . 0 0 "[ . 1 . 2]" 1
2815 2 32 ASN HB3 2 34 TYR QD . . 4.960 3.764 2.553 4.618 . 0 0 "[ . 1 . 2]" 1
2816 2 32 ASN HB3 2 34 TYR QE . . 3.880 3.347 2.530 3.904 0.024 17 0 "[ . 1 . 2]" 1
2817 2 33 ASN H 2 34 TYR H . . 3.990 1.732 1.570 1.964 . 0 0 "[ . 1 . 2]" 1
2818 2 33 ASN H 2 34 TYR QD . . 5.500 3.037 2.694 3.393 . 0 0 "[ . 1 . 2]" 1
2819 2 33 ASN H 2 34 TYR QE . . 5.500 3.983 3.762 4.332 . 0 0 "[ . 1 . 2]" 1
2820 2 33 ASN HA 2 53 ALA MB . . 4.320 3.117 2.616 3.512 . 0 0 "[ . 1 . 2]" 1
2821 2 33 ASN HA 2 70 GLY H . . 5.500 2.596 1.927 3.064 . 0 0 "[ . 1 . 2]" 1
2822 2 33 ASN QB 2 34 TYR H . . 5.010 3.850 3.204 4.067 . 0 0 "[ . 1 . 2]" 1
2823 2 33 ASN QB 2 52 ASP HB3 . . 5.500 5.616 5.559 5.753 0.253 8 0 "[ . 1 . 2]" 1
2824 2 33 ASN QB 2 53 ALA MB . . 3.810 2.848 2.298 3.872 0.062 3 0 "[ . 1 . 2]" 1
2825 2 33 ASN QB 2 69 SER QB . . 4.840 3.213 2.550 4.470 . 0 0 "[ . 1 . 2]" 1
2826 2 33 ASN QB 2 70 GLY H . . 5.500 4.101 3.641 4.887 . 0 0 "[ . 1 . 2]" 1
2827 2 33 ASN QD 2 52 ASP HB2 . . 5.340 4.385 3.833 5.227 . 0 0 "[ . 1 . 2]" 1
2828 2 33 ASN QD 2 69 SER QB . . 5.340 5.105 4.191 5.415 0.075 10 0 "[ . 1 . 2]" 1
2829 2 33 ASN HD21 2 52 ASP HB3 . . 5.300 4.567 4.016 5.139 . 0 0 "[ . 1 . 2]" 1
2830 2 33 ASN HD21 2 53 ALA MB . . 5.500 3.560 2.710 4.366 . 0 0 "[ . 1 . 2]" 1
2831 2 33 ASN HD22 2 52 ASP HB3 . . 5.300 4.966 3.988 5.350 0.050 18 0 "[ . 1 . 2]" 1
2832 2 33 ASN HD22 2 53 ALA MB . . 5.500 4.347 1.921 5.377 . 0 0 "[ . 1 . 2]" 1
2833 2 34 TYR H 2 34 TYR HB2 . . 4.020 2.550 2.515 2.584 . 0 0 "[ . 1 . 2]" 1
2834 2 34 TYR H 2 34 TYR QD . . 4.000 2.646 2.299 3.026 . 0 0 "[ . 1 . 2]" 1
2835 2 34 TYR H 2 34 TYR QE . . 5.500 4.368 4.133 4.554 . 0 0 "[ . 1 . 2]" 1
2836 2 34 TYR H 2 70 GLY H . . 5.500 4.663 4.429 4.871 . 0 0 "[ . 1 . 2]" 1
2837 2 34 TYR H 2 73 PHE QE . . 5.500 4.828 4.604 5.044 . 0 0 "[ . 1 . 2]" 1
2838 2 34 TYR H 2 93 TYR QE . . 5.500 5.393 5.263 5.529 0.029 15 0 "[ . 1 . 2]" 1
2839 2 34 TYR HA 2 34 TYR QD . . 4.310 2.708 2.440 2.978 . 0 0 "[ . 1 . 2]" 1
2840 2 34 TYR HA 2 34 TYR QE . . 5.500 4.631 4.473 4.788 . 0 0 "[ . 1 . 2]" 1
2841 2 34 TYR HA 2 52 ASP H . . 5.500 4.393 3.939 4.989 . 0 0 "[ . 1 . 2]" 1
2842 2 34 TYR HA 2 52 ASP HA . . 5.040 3.126 2.490 3.633 . 0 0 "[ . 1 . 2]" 1
2843 2 34 TYR HA 2 93 TYR QE . . 4.520 3.017 2.766 3.424 . 0 0 "[ . 1 . 2]" 1
2844 2 34 TYR HB2 2 35 LEU H . . 5.500 4.459 4.422 4.494 . 0 0 "[ . 1 . 2]" 1
2845 2 34 TYR HB2 2 94 ASP HA . . 4.250 3.366 3.048 3.872 . 0 0 "[ . 1 . 2]" 1
2846 2 34 TYR HB3 2 35 LEU H . . 5.500 4.102 3.948 4.182 . 0 0 "[ . 1 . 2]" 1
2847 2 34 TYR HB3 2 92 GLN HA . . 5.500 4.697 4.335 5.016 . 0 0 "[ . 1 . 2]" 1
2848 2 34 TYR HB3 2 93 TYR H . . 5.150 2.994 2.513 3.254 . 0 0 "[ . 1 . 2]" 1
2849 2 34 TYR HB3 2 93 TYR QD . . 4.200 3.129 2.859 3.284 . 0 0 "[ . 1 . 2]" 1
2850 2 34 TYR HB3 2 94 ASP H . . 5.500 3.953 3.575 4.358 . 0 0 "[ . 1 . 2]" 1
2851 2 34 TYR HB3 2 94 ASP HA . . 5.260 3.932 3.603 4.487 . 0 0 "[ . 1 . 2]" 1
2852 2 34 TYR HB3 2 94 ASP QB . . 5.340 3.608 3.411 3.970 . 0 0 "[ . 1 . 2]" 1
2853 2 34 TYR QD 2 35 LEU H . . 5.290 4.696 4.444 4.950 . 0 0 "[ . 1 . 2]" 1
2854 2 34 TYR QD 2 93 TYR H . . 5.500 4.820 4.441 5.047 . 0 0 "[ . 1 . 2]" 1
2855 2 34 TYR QD 2 94 ASP H . . 4.710 4.598 4.213 4.744 0.034 5 0 "[ . 1 . 2]" 1
2856 2 34 TYR QD 2 94 ASP HA . . 4.390 3.410 2.801 3.713 . 0 0 "[ . 1 . 2]" 1
2857 2 34 TYR QD 2 94 ASP QB . . 4.200 2.202 2.023 2.478 . 0 0 "[ . 1 . 2]" 1
2858 2 35 LEU H 2 35 LEU MD1 . . 5.330 4.177 4.044 4.324 . 0 0 "[ . 1 . 2]" 1
2859 2 35 LEU H 2 35 LEU QD . . 4.690 3.808 3.711 3.935 . 0 0 "[ . 1 . 2]" 1
2860 2 35 LEU H 2 35 LEU MD2 . . 5.330 4.391 4.282 4.548 . 0 0 "[ . 1 . 2]" 1
2861 2 35 LEU H 2 36 ILE H . . 5.500 4.350 4.302 4.387 . 0 0 "[ . 1 . 2]" 1
2862 2 35 LEU H 2 52 ASP H . . 5.120 3.727 3.300 4.389 . 0 0 "[ . 1 . 2]" 1
2863 2 35 LEU H 2 52 ASP HA . . 4.910 3.217 2.490 3.827 . 0 0 "[ . 1 . 2]" 1
2864 2 35 LEU H 2 53 ALA H . . 4.460 3.392 2.808 4.317 . 0 0 "[ . 1 . 2]" 1
2865 2 35 LEU H 2 53 ALA HA . . 5.330 3.859 2.751 4.503 . 0 0 "[ . 1 . 2]" 1
2866 2 35 LEU H 2 53 ALA MB . . 4.890 2.785 2.528 3.266 . 0 0 "[ . 1 . 2]" 1
2867 2 35 LEU H 2 73 PHE QD . . 5.500 5.521 5.334 5.585 0.085 12 0 "[ . 1 . 2]" 1
2868 2 35 LEU H 2 92 GLN HA . . 5.500 4.826 4.709 5.012 . 0 0 "[ . 1 . 2]" 1
2869 2 35 LEU H 2 93 TYR QE . . 4.280 3.150 2.825 3.647 . 0 0 "[ . 1 . 2]" 1
2870 2 35 LEU HA 2 35 LEU MD1 . . 4.600 2.667 2.000 3.149 . 0 0 "[ . 1 . 2]" 1
2871 2 35 LEU HA 2 35 LEU QD . . 4.010 2.082 1.993 2.164 . 0 0 "[ . 1 . 2]" 1
2872 2 35 LEU HA 2 35 LEU MD2 . . 4.600 2.828 2.093 3.862 . 0 0 "[ . 1 . 2]" 1
2873 2 35 LEU HA 2 52 ASP H . . 5.500 5.300 4.905 5.575 0.075 9 0 "[ . 1 . 2]" 1
2874 2 35 LEU HA 2 91 GLN H . . 5.500 4.433 4.215 4.677 . 0 0 "[ . 1 . 2]" 1
2875 2 35 LEU HB2 2 36 ILE H . . 5.500 4.129 3.868 4.292 . 0 0 "[ . 1 . 2]" 1
2876 2 35 LEU HB2 2 37 TRP HE1 . . 5.500 5.309 4.980 5.531 0.031 8 0 "[ . 1 . 2]" 1
2877 2 35 LEU HB2 2 53 ALA HA . . 5.490 4.372 3.632 5.000 . 0 0 "[ . 1 . 2]" 1
2878 2 35 LEU HB2 2 53 ALA MB . . 4.970 3.222 2.934 3.775 . 0 0 "[ . 1 . 2]" 1
2879 2 35 LEU HB3 2 36 ILE H . . 5.010 3.917 3.684 4.085 . 0 0 "[ . 1 . 2]" 1
2880 2 35 LEU HB3 2 37 TRP HE1 . . 5.270 3.967 3.604 4.212 . 0 0 "[ . 1 . 2]" 1
2881 2 35 LEU HB3 2 53 ALA H . . 5.500 3.756 3.137 4.897 . 0 0 "[ . 1 . 2]" 1
2882 2 35 LEU HB3 2 53 ALA HA . . 4.780 2.683 2.027 3.324 . 0 0 "[ . 1 . 2]" 1
2883 2 35 LEU HB3 2 53 ALA MB . . 4.340 2.293 1.928 2.929 . 0 0 "[ . 1 . 2]" 1
2884 2 35 LEU QD 2 36 ILE H . . 3.820 2.085 1.853 2.440 . 0 0 "[ . 1 . 2]" 1
2885 2 35 LEU QD 2 37 TRP HA . . 4.850 3.817 3.463 4.360 . 0 0 "[ . 1 . 2]" 1
2886 2 35 LEU QD 2 37 TRP HD1 . . 4.440 3.243 2.863 3.808 . 0 0 "[ . 1 . 2]" 1
2887 2 35 LEU QD 2 37 TRP HE3 . . 5.190 4.476 4.245 4.765 . 0 0 "[ . 1 . 2]" 1
2888 2 35 LEU QD 2 37 TRP HZ2 . . 4.150 2.939 2.554 3.265 . 0 0 "[ . 1 . 2]" 1
2889 2 35 LEU QD 2 50 ILE MG . . 5.320 4.515 4.194 5.010 . 0 0 "[ . 1 . 2]" 1
2890 2 35 LEU QD 2 53 ALA H . . 5.230 4.299 3.508 5.294 0.064 9 0 "[ . 1 . 2]" 1
2891 2 35 LEU QD 2 53 ALA HA . . 5.310 3.068 2.494 3.717 . 0 0 "[ . 1 . 2]" 1
2892 2 35 LEU QD 2 53 ALA MB . . 4.280 3.305 2.971 3.754 . 0 0 "[ . 1 . 2]" 1
2893 2 35 LEU QD 2 73 PHE H . . 5.440 4.930 4.328 5.389 . 0 0 "[ . 1 . 2]" 1
2894 2 35 LEU QD 2 73 PHE HB2 . . 4.990 3.068 2.517 3.565 . 0 0 "[ . 1 . 2]" 1
2895 2 35 LEU QD 2 73 PHE HB3 . . 4.280 2.891 2.456 3.216 . 0 0 "[ . 1 . 2]" 1
2896 2 35 LEU QD 2 73 PHE QD . . 5.440 2.898 2.525 3.263 . 0 0 "[ . 1 . 2]" 1
2897 2 35 LEU QD 2 74 THR H . . 5.440 5.258 4.873 5.524 0.084 6 0 "[ . 1 . 2]" 1
2898 2 35 LEU QD 2 91 GLN H . . 4.720 2.712 2.535 2.987 . 0 0 "[ . 1 . 2]" 1
2899 2 35 LEU QD 2 92 GLN H . . 5.440 3.501 3.245 3.797 . 0 0 "[ . 1 . 2]" 1
2900 2 35 LEU QD 2 92 GLN HA . . 4.530 2.761 2.477 3.116 . 0 0 "[ . 1 . 2]" 1
2901 2 35 LEU QD 2 92 GLN HB2 . . 5.440 3.819 3.504 4.108 . 0 0 "[ . 1 . 2]" 1
2902 2 35 LEU QD 2 93 TYR H . . 5.440 4.431 4.298 4.699 . 0 0 "[ . 1 . 2]" 1
2903 2 35 LEU MD1 2 36 ILE H . . 4.360 2.235 1.942 2.459 . 0 0 "[ . 1 . 2]" 1
2904 2 35 LEU MD1 2 37 TRP HE1 . . 4.590 3.157 2.069 4.727 0.137 13 0 "[ . 1 . 2]" 1
2905 2 35 LEU MD1 2 53 ALA MB . . 4.940 3.916 3.188 4.959 0.019 9 0 "[ . 1 . 2]" 1
2906 2 35 LEU MD1 2 73 PHE HB3 . . 5.090 3.875 3.063 5.026 . 0 0 "[ . 1 . 2]" 1
2907 2 35 LEU MD1 2 90 CYS HA . . 5.020 3.386 3.080 3.706 . 0 0 "[ . 1 . 2]" 1
2908 2 35 LEU MD1 2 90 CYS HB2 . . 4.290 2.015 1.804 2.474 . 0 0 "[ . 1 . 2]" 1
2909 2 35 LEU MD1 2 90 CYS HB3 . . 4.510 2.986 2.617 3.486 . 0 0 "[ . 1 . 2]" 1
2910 2 35 LEU MD2 2 36 ILE H . . 4.360 2.922 1.993 4.076 . 0 0 "[ . 1 . 2]" 1
2911 2 35 LEU MD2 2 37 TRP HE1 . . 4.590 3.674 2.042 4.755 0.165 2 0 "[ . 1 . 2]" 1
2912 2 35 LEU MD2 2 53 ALA MB . . 4.940 4.039 3.020 4.873 . 0 0 "[ . 1 . 2]" 1
2913 2 35 LEU MD2 2 73 PHE HB3 . . 5.090 3.696 2.463 4.611 . 0 0 "[ . 1 . 2]" 1
2914 2 35 LEU MD2 2 90 CYS HA . . 5.020 3.879 3.566 4.344 . 0 0 "[ . 1 . 2]" 1
2915 2 35 LEU MD2 2 90 CYS HB2 . . 4.290 2.012 1.847 2.348 . 0 0 "[ . 1 . 2]" 1
2916 2 35 LEU MD2 2 90 CYS HB3 . . 4.510 3.205 2.823 3.479 . 0 0 "[ . 1 . 2]" 1
2917 2 35 LEU HG 2 36 ILE H . . 4.640 3.589 2.094 4.575 . 0 0 "[ . 1 . 2]" 1
2918 2 35 LEU HG 2 90 CYS HB2 . . 5.500 3.291 2.401 3.851 . 0 0 "[ . 1 . 2]" 1
2919 2 35 LEU HG 2 90 CYS HB3 . . 5.500 4.443 3.852 4.751 . 0 0 "[ . 1 . 2]" 1
2920 2 35 LEU HG 2 91 GLN H . . 5.260 4.630 3.311 5.392 0.132 5 0 "[ . 1 . 2]" 1
2921 2 36 ILE H 2 36 ILE MD . . 4.650 3.528 2.195 3.887 . 0 0 "[ . 1 . 2]" 1
2922 2 36 ILE H 2 36 ILE HG12 . . 5.500 3.872 3.720 4.463 . 0 0 "[ . 1 . 2]" 1
2923 2 36 ILE H 2 36 ILE QG . . 4.760 2.602 2.386 3.540 . 0 0 "[ . 1 . 2]" 1
2924 2 36 ILE H 2 36 ILE HG13 . . 5.500 2.650 2.415 3.714 . 0 0 "[ . 1 . 2]" 1
2925 2 36 ILE H 2 37 TRP H . . 5.500 4.373 4.312 4.458 . 0 0 "[ . 1 . 2]" 1
2926 2 36 ILE H 2 38 TYR QE . . 5.040 4.578 4.188 4.966 . 0 0 "[ . 1 . 2]" 1
2927 2 36 ILE H 2 53 ALA MB . . 5.500 5.514 5.305 5.694 0.194 9 0 "[ . 1 . 2]" 1
2928 2 36 ILE H 2 92 GLN HA . . 5.140 3.346 3.161 3.608 . 0 0 "[ . 1 . 2]" 1
2929 2 36 ILE HA 2 48 LEU QD . . 5.440 4.147 3.958 4.337 . 0 0 "[ . 1 . 2]" 1
2930 2 36 ILE HA 2 51 TYR HA . . 4.850 2.046 1.993 2.163 . 0 0 "[ . 1 . 2]" 1
2931 2 36 ILE HA 2 52 ASP H . . 5.500 3.590 3.206 4.021 . 0 0 "[ . 1 . 2]" 1
2932 2 36 ILE HB 2 37 TRP H . . 5.460 3.770 3.649 3.858 . 0 0 "[ . 1 . 2]" 1
2933 2 36 ILE HB 2 38 TYR H . . 5.500 5.448 5.217 5.537 0.037 19 0 "[ . 1 . 2]" 1
2934 2 36 ILE HB 2 38 TYR QE . . 4.000 2.402 2.026 2.796 . 0 0 "[ . 1 . 2]" 1
2935 2 36 ILE HB 2 48 LEU QD . . 4.730 4.442 4.223 4.584 . 0 0 "[ . 1 . 2]" 1
2936 2 36 ILE HB 2 51 TYR HA . . 5.500 4.660 4.465 4.822 . 0 0 "[ . 1 . 2]" 1
2937 2 36 ILE HB 2 91 GLN H . . 4.560 3.146 2.954 3.628 . 0 0 "[ . 1 . 2]" 1
2938 2 36 ILE HB 2 91 GLN HG2 . . 4.960 3.381 1.973 4.164 . 0 0 "[ . 1 . 2]" 1
2939 2 36 ILE HB 2 91 GLN HG3 . . 5.020 3.047 2.004 3.960 . 0 0 "[ . 1 . 2]" 1
2940 2 36 ILE MD 2 37 TRP H . . 5.500 4.979 4.884 5.087 . 0 0 "[ . 1 . 2]" 1
2941 2 36 ILE MD 2 51 TYR HA . . 5.070 4.526 4.207 4.790 . 0 0 "[ . 1 . 2]" 1
2942 2 36 ILE MD 2 91 GLN H . . 5.250 4.364 3.688 4.672 . 0 0 "[ . 1 . 2]" 1
2943 2 36 ILE MD 2 91 GLN HA . . 5.110 5.124 4.544 5.289 0.179 8 0 "[ . 1 . 2]" 1
2944 2 36 ILE MD 2 91 GLN QE . . 4.390 3.517 1.991 4.479 0.089 20 0 "[ . 1 . 2]" 1
2945 2 36 ILE MD 2 91 GLN HG3 . . 5.500 2.336 2.003 2.746 . 0 0 "[ . 1 . 2]" 1
2946 2 36 ILE MD 2 92 GLN HA . . 5.090 4.093 2.910 4.384 . 0 0 "[ . 1 . 2]" 1
2947 2 36 ILE MD 2 93 TYR H . . 5.500 4.222 3.524 4.561 . 0 0 "[ . 1 . 2]" 1
2948 2 36 ILE MD 2 93 TYR HB2 . . 5.500 3.972 3.574 4.519 . 0 0 "[ . 1 . 2]" 1
2949 2 36 ILE MD 2 93 TYR HB3 . . 5.110 2.797 2.462 3.318 . 0 0 "[ . 1 . 2]" 1
2950 2 36 ILE MD 2 93 TYR QD . . 3.760 2.325 1.739 2.664 . 0 0 "[ . 1 . 2]" 1
2951 2 36 ILE MD 2 93 TYR QE . . 3.760 3.196 2.091 3.592 . 0 0 "[ . 1 . 2]" 1
2952 2 36 ILE QG 2 51 TYR HA . . 4.710 3.056 2.733 3.365 . 0 0 "[ . 1 . 2]" 1
2953 2 36 ILE QG 2 51 TYR HB3 . . 5.340 3.371 2.887 3.812 . 0 0 "[ . 1 . 2]" 1
2954 2 36 ILE QG 2 52 ASP H . . 5.340 3.057 2.556 3.498 . 0 0 "[ . 1 . 2]" 1
2955 2 36 ILE QG 2 93 TYR QD . . 3.790 2.292 1.960 3.691 . 0 0 "[ . 1 . 2]" 1
2956 2 36 ILE QG 2 93 TYR QE . . 3.400 2.459 2.209 3.011 . 0 0 "[ . 1 . 2]" 1
2957 2 36 ILE HG12 2 51 TYR HA . . 5.480 3.301 2.896 4.447 . 0 0 "[ . 1 . 2]" 1
2958 2 36 ILE HG12 2 51 TYR HB2 . . 5.500 3.082 2.799 3.686 . 0 0 "[ . 1 . 2]" 1
2959 2 36 ILE HG12 2 93 TYR QD . . 4.430 3.386 3.096 4.205 . 0 0 "[ . 1 . 2]" 1
2960 2 36 ILE HG12 2 93 TYR QE . . 3.970 2.910 2.480 3.999 0.029 13 0 "[ . 1 . 2]" 1
2961 2 36 ILE HG13 2 51 TYR HA . . 5.480 4.084 2.779 4.510 . 0 0 "[ . 1 . 2]" 1
2962 2 36 ILE HG13 2 51 TYR HB2 . . 5.500 4.361 2.737 4.875 . 0 0 "[ . 1 . 2]" 1
2963 2 36 ILE HG13 2 93 TYR QD . . 4.430 2.350 1.981 4.087 . 0 0 "[ . 1 . 2]" 1
2964 2 36 ILE HG13 2 93 TYR QE . . 3.970 2.708 2.452 3.117 . 0 0 "[ . 1 . 2]" 1
2965 2 36 ILE MG 2 37 TRP H . . 4.080 2.315 2.183 2.437 . 0 0 "[ . 1 . 2]" 1
2966 2 36 ILE MG 2 37 TRP HA . . 5.240 3.899 3.780 4.035 . 0 0 "[ . 1 . 2]" 1
2967 2 36 ILE MG 2 38 TYR H . . 5.500 4.487 4.315 4.714 . 0 0 "[ . 1 . 2]" 1
2968 2 36 ILE MG 2 38 TYR QD . . 4.240 3.568 3.442 3.737 . 0 0 "[ . 1 . 2]" 1
2969 2 36 ILE MG 2 38 TYR QE . . 3.730 2.838 2.693 2.919 . 0 0 "[ . 1 . 2]" 1
2970 2 36 ILE MG 2 48 LEU H . . 5.500 5.343 5.145 5.512 0.012 12 0 "[ . 1 . 2]" 1
2971 2 36 ILE MG 2 48 LEU HA . . 5.200 3.394 3.167 3.589 . 0 0 "[ . 1 . 2]" 1
2972 2 36 ILE MG 2 48 LEU QB . . 5.240 3.490 3.339 3.668 . 0 0 "[ . 1 . 2]" 1
2973 2 36 ILE MG 2 48 LEU MD1 . . 3.660 2.495 2.372 2.670 . 0 0 "[ . 1 . 2]" 1
2974 2 36 ILE MG 2 48 LEU MD2 . . 3.660 2.649 2.377 3.026 . 0 0 "[ . 1 . 2]" 1
2975 2 36 ILE MG 2 48 LEU HG . . 4.210 1.987 1.855 2.125 . 0 0 "[ . 1 . 2]" 1
2976 2 36 ILE MG 2 50 ILE H . . 5.270 3.721 3.530 3.947 . 0 0 "[ . 1 . 2]" 1
2977 2 36 ILE MG 2 50 ILE MG . . 4.940 4.774 4.589 4.903 . 0 0 "[ . 1 . 2]" 1
2978 2 36 ILE MG 2 51 TYR H . . 5.030 4.358 4.072 4.521 . 0 0 "[ . 1 . 2]" 1
2979 2 36 ILE MG 2 51 TYR HA . . 4.870 2.514 2.139 2.991 . 0 0 "[ . 1 . 2]" 1
2980 2 36 ILE MG 2 51 TYR HB2 . . 5.500 3.094 2.749 3.478 . 0 0 "[ . 1 . 2]" 1
2981 2 36 ILE MG 2 51 TYR HB3 . . 5.220 2.282 1.942 2.528 . 0 0 "[ . 1 . 2]" 1
2982 2 36 ILE MG 2 51 TYR QD . . 4.780 3.952 3.674 4.204 . 0 0 "[ . 1 . 2]" 1
2983 2 36 ILE MG 2 52 ASP H . . 5.500 4.000 3.467 4.627 . 0 0 "[ . 1 . 2]" 1
2984 2 36 ILE MG 2 53 ALA H . . 5.500 5.201 4.780 5.561 0.061 20 0 "[ . 1 . 2]" 1
2985 2 36 ILE MG 2 91 GLN HG2 . . 5.500 4.274 3.443 4.852 . 0 0 "[ . 1 . 2]" 1
2986 2 37 TRP H 2 37 TRP HD1 . . 4.770 3.002 2.868 3.171 . 0 0 "[ . 1 . 2]" 1
2987 2 37 TRP H 2 37 TRP HE3 . . 5.500 5.508 5.470 5.543 0.043 16 0 "[ . 1 . 2]" 1
2988 2 37 TRP H 2 38 TYR H . . 5.500 4.372 4.316 4.419 . 0 0 "[ . 1 . 2]" 1
2989 2 37 TRP H 2 48 LEU QD . . 4.550 3.809 3.599 3.988 . 0 0 "[ . 1 . 2]" 1
2990 2 37 TRP H 2 48 LEU HG . . 5.440 4.137 3.851 4.358 . 0 0 "[ . 1 . 2]" 1
2991 2 37 TRP H 2 50 ILE H . . 4.760 2.880 2.629 3.045 . 0 0 "[ . 1 . 2]" 1
2992 2 37 TRP H 2 50 ILE HB . . 4.640 3.333 2.871 3.573 . 0 0 "[ . 1 . 2]" 1
2993 2 37 TRP H 2 50 ILE HG13 . . 5.500 5.082 4.735 5.407 . 0 0 "[ . 1 . 2]" 1
2994 2 37 TRP H 2 51 TYR H . . 5.500 4.679 4.562 4.791 . 0 0 "[ . 1 . 2]" 1
2995 2 37 TRP H 2 51 TYR HA . . 5.090 3.274 3.081 3.526 . 0 0 "[ . 1 . 2]" 1
2996 2 37 TRP HA 2 37 TRP HD1 . . 4.910 4.128 4.037 4.219 . 0 0 "[ . 1 . 2]" 1
2997 2 37 TRP HA 2 37 TRP HE3 . . 4.570 3.153 3.016 3.264 . 0 0 "[ . 1 . 2]" 1
2998 2 37 TRP HA 2 38 TYR QE . . 4.850 4.761 4.573 4.901 0.051 11 0 "[ . 1 . 2]" 1
2999 2 37 TRP HA 2 91 GLN H . . 5.080 3.687 3.425 3.958 . 0 0 "[ . 1 . 2]" 1
3000 2 37 TRP HB2 2 48 LEU QD . . 5.150 4.750 4.497 4.900 . 0 0 "[ . 1 . 2]" 1
3001 2 37 TRP HB2 2 50 ILE H . . 5.280 2.444 2.190 2.564 . 0 0 "[ . 1 . 2]" 1
3002 2 37 TRP HB2 2 50 ILE HB . . 4.860 2.075 1.889 2.414 . 0 0 "[ . 1 . 2]" 1
3003 2 37 TRP HB2 2 50 ILE MG . . 4.860 3.750 3.607 4.052 . 0 0 "[ . 1 . 2]" 1
3004 2 37 TRP HB2 2 75 PHE QE . . 4.870 3.434 3.251 3.591 . 0 0 "[ . 1 . 2]" 1
3005 2 37 TRP HB3 2 37 TRP HE3 . . 4.160 2.497 2.429 2.569 . 0 0 "[ . 1 . 2]" 1
3006 2 37 TRP HB3 2 37 TRP HZ3 . . 5.080 4.888 4.840 4.945 . 0 0 "[ . 1 . 2]" 1
3007 2 37 TRP HB3 2 50 ILE H . . 5.500 3.803 3.679 3.976 . 0 0 "[ . 1 . 2]" 1
3008 2 37 TRP HB3 2 50 ILE HB . . 4.770 3.651 3.525 3.943 . 0 0 "[ . 1 . 2]" 1
3009 2 37 TRP HB3 2 50 ILE MD . . 5.140 4.069 3.641 4.430 . 0 0 "[ . 1 . 2]" 1
3010 2 37 TRP HB3 2 50 ILE MG . . 5.500 5.013 4.884 5.299 . 0 0 "[ . 1 . 2]" 1
3011 2 37 TRP HB3 2 75 PHE QE . . 4.930 3.279 3.130 3.518 . 0 0 "[ . 1 . 2]" 1
3012 2 37 TRP HD1 2 50 ILE H . . 5.500 4.251 3.843 4.416 . 0 0 "[ . 1 . 2]" 1
3013 2 37 TRP HD1 2 50 ILE HB . . 3.640 2.255 2.017 2.586 . 0 0 "[ . 1 . 2]" 1
3014 2 37 TRP HD1 2 50 ILE MD . . 4.330 3.640 3.100 4.038 . 0 0 "[ . 1 . 2]" 1
3015 2 37 TRP HD1 2 50 ILE MG . . 3.400 2.611 2.450 2.876 . 0 0 "[ . 1 . 2]" 1
3016 2 37 TRP HD1 2 51 TYR H . . 4.750 4.817 4.780 4.869 0.119 17 0 "[ . 1 . 2]" 1
3017 2 37 TRP HD1 2 51 TYR HA . . 5.500 4.191 3.887 4.465 . 0 0 "[ . 1 . 2]" 1
3018 2 37 TRP HD1 2 53 ALA H . . 5.500 4.451 4.029 4.925 . 0 0 "[ . 1 . 2]" 1
3019 2 37 TRP HD1 2 75 PHE QE . . 4.930 4.963 4.940 4.998 0.068 2 0 "[ . 1 . 2]" 1
3020 2 37 TRP HE1 2 50 ILE HB . . 5.500 4.535 4.265 4.773 . 0 0 "[ . 1 . 2]" 1
3021 2 37 TRP HE1 2 50 ILE MG . . 5.500 3.961 3.741 4.133 . 0 0 "[ . 1 . 2]" 1
3022 2 37 TRP HE1 2 73 PHE HB2 . . 5.500 4.342 3.996 4.679 . 0 0 "[ . 1 . 2]" 1
3023 2 37 TRP HE1 2 73 PHE HB3 . . 5.500 3.102 2.825 3.412 . 0 0 "[ . 1 . 2]" 1
3024 2 37 TRP HE1 2 74 THR H . . 5.500 5.007 4.671 5.448 . 0 0 "[ . 1 . 2]" 1
3025 2 37 TRP HE3 2 38 TYR H . . 5.170 3.727 3.529 3.942 . 0 0 "[ . 1 . 2]" 1
3026 2 37 TRP HE3 2 89 TYR H . . 4.730 3.806 3.622 4.042 . 0 0 "[ . 1 . 2]" 1
3027 2 37 TRP HE3 2 89 TYR HA . . 4.840 4.131 3.898 4.864 0.024 7 0 "[ . 1 . 2]" 1
3028 2 37 TRP HE3 2 90 CYS H . . 5.090 4.791 4.616 5.046 . 0 0 "[ . 1 . 2]" 1
3029 2 37 TRP HE3 2 90 CYS HA . . 5.500 3.877 3.668 4.006 . 0 0 "[ . 1 . 2]" 1
3030 2 37 TRP HE3 2 90 CYS HB2 . . 5.500 4.753 4.514 5.065 . 0 0 "[ . 1 . 2]" 1
3031 2 37 TRP HE3 2 90 CYS HB3 . . 5.500 3.202 2.896 3.519 . 0 0 "[ . 1 . 2]" 1
3032 2 37 TRP HH2 2 73 PHE HB3 . . 5.110 4.409 4.144 4.741 . 0 0 "[ . 1 . 2]" 1
3033 2 37 TRP HH2 2 74 THR HA . . 4.770 4.224 3.740 4.718 . 0 0 "[ . 1 . 2]" 1
3034 2 37 TRP HH2 2 75 PHE H . . 4.950 3.783 3.378 4.168 . 0 0 "[ . 1 . 2]" 1
3035 2 37 TRP HH2 2 75 PHE HB3 . . 5.120 3.529 3.341 3.674 . 0 0 "[ . 1 . 2]" 1
3036 2 37 TRP HZ2 2 73 PHE HB3 . . 4.270 2.206 2.008 2.461 . 0 0 "[ . 1 . 2]" 1
3037 2 37 TRP HZ2 2 74 THR H . . 4.320 3.919 3.610 4.320 . 0 0 "[ . 1 . 2]" 1
3038 2 37 TRP HZ2 2 74 THR HA . . 4.330 4.090 3.725 4.371 0.041 9 0 "[ . 1 . 2]" 1
3039 2 37 TRP HZ2 2 75 PHE H . . 5.500 4.125 3.764 4.441 . 0 0 "[ . 1 . 2]" 1
3040 2 37 TRP HZ2 2 75 PHE HB2 . . 4.350 3.285 3.128 3.424 . 0 0 "[ . 1 . 2]" 1
3041 2 37 TRP HZ2 2 75 PHE HB3 . . 4.780 4.453 4.311 4.692 . 0 0 "[ . 1 . 2]" 1
3042 2 37 TRP HZ3 2 90 CYS H . . 5.470 4.691 4.279 4.987 . 0 0 "[ . 1 . 2]" 1
3043 2 37 TRP HZ3 2 90 CYS HA . . 5.500 4.962 4.467 5.245 . 0 0 "[ . 1 . 2]" 1
3044 2 37 TRP HZ3 2 90 CYS HB2 . . 5.500 4.850 4.680 5.049 . 0 0 "[ . 1 . 2]" 1
3045 2 37 TRP HZ3 2 90 CYS HB3 . . 5.500 3.156 2.987 3.352 . 0 0 "[ . 1 . 2]" 1
3046 2 38 TYR H 2 38 TYR QD . . 4.620 2.788 2.566 3.030 . 0 0 "[ . 1 . 2]" 1
3047 2 38 TYR H 2 38 TYR QE . . 5.360 4.723 4.525 4.967 . 0 0 "[ . 1 . 2]" 1
3048 2 38 TYR H 2 39 GLN H . . 5.500 4.403 4.305 4.469 . 0 0 "[ . 1 . 2]" 1
3049 2 38 TYR H 2 49 LEU QD . . 5.440 4.994 4.722 5.381 . 0 0 "[ . 1 . 2]" 1
3050 2 38 TYR H 2 88 TYR HA . . 4.740 4.652 4.503 4.774 0.034 12 0 "[ . 1 . 2]" 1
3051 2 38 TYR H 2 89 TYR H . . 4.620 3.045 2.881 3.275 . 0 0 "[ . 1 . 2]" 1
3052 2 38 TYR H 2 90 CYS HA . . 5.500 3.371 3.050 3.810 . 0 0 "[ . 1 . 2]" 1
3053 2 38 TYR H 2 91 GLN H . . 5.500 4.821 4.578 5.072 . 0 0 "[ . 1 . 2]" 1
3054 2 38 TYR H 2 91 GLN HB3 . . 5.500 5.466 4.961 5.651 0.151 10 0 "[ . 1 . 2]" 1
3055 2 38 TYR HA 2 38 TYR QD . . 3.920 2.960 2.768 3.091 . 0 0 "[ . 1 . 2]" 1
3056 2 38 TYR HA 2 47 LYS HB3 . . 5.500 4.892 4.582 5.115 . 0 0 "[ . 1 . 2]" 1
3057 2 38 TYR HA 2 48 LEU HA . . 5.070 2.616 2.523 2.732 . 0 0 "[ . 1 . 2]" 1
3058 2 38 TYR HA 2 48 LEU QB . . 4.610 4.660 4.618 4.712 0.102 15 0 "[ . 1 . 2]" 1
3059 2 38 TYR HA 2 49 LEU MD1 . . 5.490 4.607 3.950 5.230 . 0 0 "[ . 1 . 2]" 1
3060 2 38 TYR HA 2 49 LEU QD . . 4.820 4.034 3.692 4.382 . 0 0 "[ . 1 . 2]" 1
3061 2 38 TYR HA 2 49 LEU MD2 . . 5.490 4.544 4.293 4.723 . 0 0 "[ . 1 . 2]" 1
3062 2 38 TYR HA 2 50 ILE H . . 5.500 4.261 3.866 4.757 . 0 0 "[ . 1 . 2]" 1
3063 2 38 TYR HB2 2 39 GLN H . . 4.690 3.548 3.362 3.676 . 0 0 "[ . 1 . 2]" 1
3064 2 38 TYR HB2 2 46 PRO HB2 . . 5.500 3.279 2.706 3.864 . 0 0 "[ . 1 . 2]" 1
3065 2 38 TYR HB2 2 46 PRO HB3 . . 5.360 3.583 2.719 4.150 . 0 0 "[ . 1 . 2]" 1
3066 2 38 TYR HB2 2 47 LYS H . . 5.370 4.912 4.702 5.143 . 0 0 "[ . 1 . 2]" 1
3067 2 38 TYR HB2 2 89 TYR H . . 5.500 3.889 3.591 4.201 . 0 0 "[ . 1 . 2]" 1
3068 2 38 TYR HB3 2 39 GLN H . . 5.490 2.447 2.299 2.614 . 0 0 "[ . 1 . 2]" 1
3069 2 38 TYR HB3 2 46 PRO HB2 . . 5.500 2.411 1.890 2.919 . 0 0 "[ . 1 . 2]" 1
3070 2 38 TYR HB3 2 46 PRO HB3 . . 5.440 3.151 2.244 3.685 . 0 0 "[ . 1 . 2]" 1
3071 2 38 TYR HB3 2 47 LYS H . . 5.500 3.339 3.183 3.517 . 0 0 "[ . 1 . 2]" 1
3072 2 38 TYR HB3 2 47 LYS HA . . 4.620 4.631 4.519 4.692 0.072 12 0 "[ . 1 . 2]" 1
3073 2 38 TYR QD 2 39 GLN H . . 5.280 3.839 3.719 3.965 . 0 0 "[ . 1 . 2]" 1
3074 2 38 TYR QD 2 46 PRO HB2 . . 4.400 3.134 2.841 3.346 . 0 0 "[ . 1 . 2]" 1
3075 2 38 TYR QD 2 47 LYS H . . 4.040 4.060 3.979 4.127 0.087 9 0 "[ . 1 . 2]" 1
3076 2 38 TYR QD 2 47 LYS QG . . 4.630 4.692 4.588 4.753 0.123 9 0 "[ . 1 . 2]" 1
3077 2 38 TYR QD 2 48 LEU H . . 4.050 3.014 2.912 3.121 . 0 0 "[ . 1 . 2]" 1
3078 2 38 TYR QD 2 48 LEU HA . . 4.840 2.249 2.031 2.501 . 0 0 "[ . 1 . 2]" 1
3079 2 38 TYR QD 2 48 LEU QB . . 4.020 2.956 2.847 3.084 . 0 0 "[ . 1 . 2]" 1
3080 2 38 TYR QD 2 48 LEU QD . . 4.290 4.068 3.944 4.160 . 0 0 "[ . 1 . 2]" 1
3081 2 38 TYR QE 2 46 PRO HB2 . . 5.500 4.628 4.129 4.998 . 0 0 "[ . 1 . 2]" 1
3082 2 38 TYR QE 2 48 LEU H . . 4.450 3.816 3.548 4.091 . 0 0 "[ . 1 . 2]" 1
3083 2 38 TYR QE 2 48 LEU HA . . 5.500 3.271 3.103 3.522 . 0 0 "[ . 1 . 2]" 1
3084 2 38 TYR QE 2 48 LEU QB . . 4.930 2.191 2.031 2.365 . 0 0 "[ . 1 . 2]" 1
3085 2 38 TYR QE 2 48 LEU MD1 . . 4.620 2.954 2.722 3.120 . 0 0 "[ . 1 . 2]" 1
3086 2 38 TYR QE 2 48 LEU QD . . 3.360 2.912 2.693 3.063 . 0 0 "[ . 1 . 2]" 1
3087 2 38 TYR QE 2 48 LEU MD2 . . 4.620 4.440 4.128 4.652 0.032 8 0 "[ . 1 . 2]" 1
3088 2 38 TYR QE 2 90 CYS HA . . 4.540 4.534 4.277 4.650 0.110 9 0 "[ . 1 . 2]" 1
3089 2 38 TYR QE 2 91 GLN H . . 3.260 3.388 3.315 3.477 0.217 4 0 "[ . 1 . 2]" 1
3090 2 38 TYR QE 2 91 GLN HB2 . . 5.500 3.117 1.926 4.233 . 0 0 "[ . 1 . 2]" 1
3091 2 38 TYR QE 2 91 GLN HB3 . . 5.500 2.149 1.715 2.992 . 0 0 "[ . 1 . 2]" 1
3092 2 38 TYR QE 2 91 GLN QE . . 4.460 4.318 3.974 4.708 0.248 9 0 "[ . 1 . 2]" 1
3093 2 38 TYR QE 2 91 GLN HG2 . . 4.880 2.154 1.741 2.618 . 0 0 "[ . 1 . 2]" 1
3094 2 38 TYR QE 2 91 GLN HG3 . . 3.780 2.858 1.936 3.611 . 0 0 "[ . 1 . 2]" 1
3095 2 39 GLN H 2 46 PRO HA . . 4.900 4.155 3.399 4.487 . 0 0 "[ . 1 . 2]" 1
3096 2 39 GLN H 2 46 PRO HB3 . . 5.500 4.523 3.444 5.157 . 0 0 "[ . 1 . 2]" 1
3097 2 39 GLN H 2 47 LYS HB2 . . 5.420 4.823 4.531 5.141 . 0 0 "[ . 1 . 2]" 1
3098 2 39 GLN H 2 47 LYS HB3 . . 5.280 3.388 3.023 3.791 . 0 0 "[ . 1 . 2]" 1
3099 2 39 GLN H 2 49 LEU MD1 . . 4.890 4.408 3.714 4.932 0.042 8 0 "[ . 1 . 2]" 1
3100 2 39 GLN H 2 49 LEU QD . . 4.290 3.920 3.474 4.289 . 0 0 "[ . 1 . 2]" 1
3101 2 39 GLN H 2 49 LEU MD2 . . 4.890 4.450 4.114 4.714 . 0 0 "[ . 1 . 2]" 1
3102 2 39 GLN H 2 88 TYR HA . . 5.500 5.069 4.784 5.463 . 0 0 "[ . 1 . 2]" 1
3103 2 39 GLN H 2 88 TYR QD . . 5.500 4.848 4.334 5.176 . 0 0 "[ . 1 . 2]" 1
3104 2 39 GLN HA 2 49 LEU QD . . 5.290 4.311 3.839 4.874 . 0 0 "[ . 1 . 2]" 1
3105 2 39 GLN HA 2 86 ALA MB . . 4.980 3.430 2.913 3.894 . 0 0 "[ . 1 . 2]" 1
3106 2 39 GLN HA 2 88 TYR HA . . 4.500 2.553 2.164 3.026 . 0 0 "[ . 1 . 2]" 1
3107 2 39 GLN HA 2 88 TYR QD . . 4.630 3.322 2.627 3.915 . 0 0 "[ . 1 . 2]" 1
3108 2 39 GLN HA 2 89 TYR H . . 5.250 3.738 3.268 4.189 . 0 0 "[ . 1 . 2]" 1
3109 2 39 GLN HB2 2 40 GLN H . . 5.250 3.346 2.883 4.285 . 0 0 "[ . 1 . 2]" 1
3110 2 39 GLN HB2 2 49 LEU QD . . 4.610 3.639 2.238 4.252 . 0 0 "[ . 1 . 2]" 1
3111 2 39 GLN HB2 2 86 ALA MB . . 5.500 2.365 2.008 4.446 . 0 0 "[ . 1 . 2]" 1
3112 2 39 GLN HB2 2 88 TYR HA . . 5.480 4.410 3.577 5.134 . 0 0 "[ . 1 . 2]" 1
3113 2 39 GLN HB2 2 88 TYR QD . . 5.500 3.907 2.864 4.572 . 0 0 "[ . 1 . 2]" 1
3114 2 39 GLN HB2 2 88 TYR QE . . 4.030 3.280 2.089 3.940 . 0 0 "[ . 1 . 2]" 1
3115 2 39 GLN HB3 2 40 GLN H . . 5.500 4.254 4.039 4.367 . 0 0 "[ . 1 . 2]" 1
3116 2 39 GLN HB3 2 49 LEU MD1 . . 4.700 3.144 1.961 4.328 . 0 0 "[ . 1 . 2]" 1
3117 2 39 GLN HB3 2 49 LEU QD . . 4.140 2.503 1.951 3.052 . 0 0 "[ . 1 . 2]" 1
3118 2 39 GLN HB3 2 49 LEU MD2 . . 4.700 3.220 2.370 4.157 . 0 0 "[ . 1 . 2]" 1
3119 2 39 GLN HB3 2 86 ALA MB . . 4.730 3.686 3.205 4.792 0.062 2 0 "[ . 1 . 2]" 1
3120 2 39 GLN HB3 2 88 TYR QD . . 4.310 3.124 2.223 4.400 0.090 2 0 "[ . 1 . 2]" 1
3121 2 39 GLN HB3 2 88 TYR QE . . 3.910 2.459 2.161 3.729 . 0 0 "[ . 1 . 2]" 1
3122 2 39 GLN QE 2 41 LYS QE . . 4.530 2.883 1.833 4.139 . 0 0 "[ . 1 . 2]" 1
3123 2 39 GLN QE 2 49 LEU QD . . 4.400 2.808 1.960 3.513 . 0 0 "[ . 1 . 2]" 1
3124 2 39 GLN QE 2 86 ALA MB . . 4.300 2.833 2.014 3.582 . 0 0 "[ . 1 . 2]" 1
3125 2 39 GLN QE 2 88 TYR QE . . 3.840 2.986 2.046 3.856 0.016 19 0 "[ . 1 . 2]" 1
3126 2 39 GLN QE 2 88 TYR HH . . 4.390 2.784 2.120 3.177 . 0 0 "[ . 1 . 2]" 1
3127 2 39 GLN HE21 2 88 TYR HH . . 5.090 3.053 2.289 3.985 . 0 0 "[ . 1 . 2]" 1
3128 2 39 GLN HE22 2 88 TYR HH . . 5.090 3.366 2.283 3.877 . 0 0 "[ . 1 . 2]" 1
3129 2 39 GLN QG 2 40 GLN H . . 4.870 3.977 3.126 4.197 . 0 0 "[ . 1 . 2]" 1
3130 2 39 GLN QG 2 49 LEU QD . . 5.390 2.908 2.396 3.503 . 0 0 "[ . 1 . 2]" 1
3131 2 39 GLN QG 2 86 ALA MB . . 3.340 3.310 2.406 3.429 0.089 8 0 "[ . 1 . 2]" 1
3132 2 39 GLN QG 2 88 TYR HH . . 5.500 5.192 4.019 5.561 0.061 17 0 "[ . 1 . 2]" 1
3133 2 40 GLN H 2 40 GLN HG2 . . 5.500 4.345 3.340 4.759 . 0 0 "[ . 1 . 2]" 1
3134 2 40 GLN H 2 40 GLN HG3 . . 5.500 4.550 4.323 4.738 . 0 0 "[ . 1 . 2]" 1
3135 2 40 GLN H 2 41 LYS H . . 4.960 4.143 4.005 4.261 . 0 0 "[ . 1 . 2]" 1
3136 2 40 GLN H 2 86 ALA HA . . 5.500 4.933 4.460 5.279 . 0 0 "[ . 1 . 2]" 1
3137 2 40 GLN H 2 86 ALA MB . . 4.170 2.715 2.278 3.146 . 0 0 "[ . 1 . 2]" 1
3138 2 40 GLN H 2 87 THR H . . 4.700 3.100 2.936 3.480 . 0 0 "[ . 1 . 2]" 1
3139 2 40 GLN H 2 87 THR HA . . 5.040 4.658 4.553 4.806 . 0 0 "[ . 1 . 2]" 1
3140 2 40 GLN H 2 87 THR HB . . 5.330 3.341 2.913 3.669 . 0 0 "[ . 1 . 2]" 1
3141 2 40 GLN H 2 87 THR MG . . 5.500 4.289 4.071 4.537 . 0 0 "[ . 1 . 2]" 1
3142 2 40 GLN H 2 88 TYR QD . . 5.500 4.820 4.351 5.227 . 0 0 "[ . 1 . 2]" 1
3143 2 40 GLN HA 2 46 PRO HA . . 4.480 2.450 2.032 3.701 . 0 0 "[ . 1 . 2]" 1
3144 2 40 GLN QB 2 41 LYS H . . 4.800 3.821 3.603 3.933 . 0 0 "[ . 1 . 2]" 1
3145 2 40 GLN QB 2 87 THR H . . 5.500 3.043 2.609 3.624 . 0 0 "[ . 1 . 2]" 1
3146 2 40 GLN QB 2 87 THR HB . . 5.260 2.029 1.827 2.325 . 0 0 "[ . 1 . 2]" 1
3147 2 40 GLN QB 2 87 THR MG . . 5.500 3.294 3.074 3.656 . 0 0 "[ . 1 . 2]" 1
3148 2 40 GLN QE 2 45 ALA HA . . 4.580 2.897 2.422 3.523 . 0 0 "[ . 1 . 2]" 1
3149 2 40 GLN QE 2 45 ALA MB . . 4.810 4.070 3.752 4.425 . 0 0 "[ . 1 . 2]" 1
3150 2 40 GLN QE 2 46 PRO QD . . 4.300 2.325 1.644 3.236 . 0 0 "[ . 1 . 2]" 1
3151 2 40 GLN QE 2 46 PRO QG . . 4.760 3.325 2.210 4.189 . 0 0 "[ . 1 . 2]" 1
3152 2 40 GLN HE21 2 45 ALA HA . . 5.380 3.830 3.152 4.546 . 0 0 "[ . 1 . 2]" 1
3153 2 40 GLN HE21 2 45 ALA MB . . 5.500 4.849 4.231 5.568 0.068 20 0 "[ . 1 . 2]" 1
3154 2 40 GLN HE21 2 46 PRO HB2 . . 5.500 4.590 3.902 5.606 0.106 7 0 "[ . 1 . 2]" 1
3155 2 40 GLN HE21 2 46 PRO HD2 . . 5.500 4.273 3.414 5.503 0.003 7 0 "[ . 1 . 2]" 1
3156 2 40 GLN HE21 2 46 PRO HD3 . . 5.500 2.890 1.658 4.474 . 0 0 "[ . 1 . 2]" 1
3157 2 40 GLN HE22 2 45 ALA HA . . 5.380 3.139 2.457 4.751 . 0 0 "[ . 1 . 2]" 1
3158 2 40 GLN HE22 2 45 ALA MB . . 5.500 4.492 4.013 5.564 0.064 6 0 "[ . 1 . 2]" 1
3159 2 40 GLN HE22 2 46 PRO HB2 . . 5.500 5.417 4.832 5.705 0.205 2 0 "[ . 1 . 2]" 1
3160 2 40 GLN HE22 2 46 PRO HD2 . . 5.500 4.275 3.480 5.050 . 0 0 "[ . 1 . 2]" 1
3161 2 40 GLN HE22 2 46 PRO HD3 . . 5.500 2.934 2.069 3.657 . 0 0 "[ . 1 . 2]" 1
3162 2 40 GLN QG 2 87 THR H . . 5.340 4.646 4.069 5.181 . 0 0 "[ . 1 . 2]" 1
3163 2 40 GLN QG 2 87 THR MG . . 5.340 4.128 3.712 4.940 . 0 0 "[ . 1 . 2]" 1
3164 2 40 GLN HG2 2 41 LYS H . . 5.500 4.571 3.766 5.109 . 0 0 "[ . 1 . 2]" 1
3165 2 40 GLN HG3 2 41 LYS H . . 5.500 4.558 3.478 5.506 0.006 16 0 "[ . 1 . 2]" 1
3166 2 41 LYS H 2 41 LYS HB2 . . 3.990 2.471 2.229 2.761 . 0 0 "[ . 1 . 2]" 1
3167 2 41 LYS H 2 41 LYS QD . . 5.320 3.881 2.425 4.863 . 0 0 "[ . 1 . 2]" 1
3168 2 41 LYS H 2 41 LYS QG . . 4.740 2.895 2.324 4.043 . 0 0 "[ . 1 . 2]" 1
3169 2 41 LYS H 2 42 PRO HD3 . . 5.500 4.479 4.308 4.801 . 0 0 "[ . 1 . 2]" 1
3170 2 41 LYS H 2 44 GLN H . . 5.500 4.587 4.318 5.081 . 0 0 "[ . 1 . 2]" 1
3171 2 41 LYS H 2 44 GLN QG . . 5.500 3.303 2.554 4.700 . 0 0 "[ . 1 . 2]" 1
3172 2 41 LYS H 2 46 PRO HA . . 5.500 3.573 2.867 5.291 . 0 0 "[ . 1 . 2]" 1
3173 2 41 LYS H 2 87 THR H . . 5.500 5.090 4.713 5.546 0.046 19 0 "[ . 1 . 2]" 1
3174 2 41 LYS HA 2 41 LYS QD . . 4.300 3.740 2.055 4.242 . 0 0 "[ . 1 . 2]" 1
3175 2 41 LYS HA 2 41 LYS HE2 . . 5.500 4.765 1.818 5.372 . 0 0 "[ . 1 . 2]" 1
3176 2 41 LYS HA 2 41 LYS HE3 . . 5.500 4.973 2.894 5.733 0.233 17 0 "[ . 1 . 2]" 1
3177 2 41 LYS HB2 2 42 PRO HD2 . . 5.300 4.533 4.225 4.993 . 0 0 "[ . 1 . 2]" 1
3178 2 41 LYS HB2 2 42 PRO HD3 . . 5.500 4.821 4.438 5.265 . 0 0 "[ . 1 . 2]" 1
3179 2 41 LYS HB2 2 44 GLN H . . 5.500 4.245 3.653 5.521 0.021 3 0 "[ . 1 . 2]" 1
3180 2 41 LYS HB2 2 44 GLN QG . . 4.780 2.670 1.972 3.952 . 0 0 "[ . 1 . 2]" 1
3181 2 41 LYS HB2 2 86 ALA MB . . 5.500 4.312 2.723 5.242 . 0 0 "[ . 1 . 2]" 1
3182 2 41 LYS HB3 2 42 PRO HD2 . . 4.280 3.384 2.812 4.314 0.034 3 0 "[ . 1 . 2]" 1
3183 2 41 LYS HB3 2 42 PRO HD3 . . 4.670 4.153 3.712 4.700 0.030 3 0 "[ . 1 . 2]" 1
3184 2 41 LYS QD 2 44 GLN HE21 . . 5.500 3.358 2.080 5.576 0.076 15 0 "[ . 1 . 2]" 1
3185 2 41 LYS QD 2 44 GLN QG . . 5.500 3.957 3.181 4.819 . 0 0 "[ . 1 . 2]" 1
3186 2 41 LYS QE 2 86 ALA MB . . 4.200 2.821 1.935 4.078 . 0 0 "[ . 1 . 2]" 1
3187 2 41 LYS HE2 2 86 ALA MB . . 4.890 3.227 2.363 5.007 0.117 13 0 "[ . 1 . 2]" 1
3188 2 41 LYS HE3 2 86 ALA MB . . 4.890 3.377 1.956 4.467 . 0 0 "[ . 1 . 2]" 1
3189 2 41 LYS QG 2 42 PRO HD2 . . 5.500 3.859 2.289 5.011 . 0 0 "[ . 1 . 2]" 1
3190 2 41 LYS QG 2 42 PRO HD3 . . 4.840 4.133 3.333 4.795 . 0 0 "[ . 1 . 2]" 1
3191 2 41 LYS QG 2 44 GLN HE21 . . 5.500 3.768 2.953 5.429 . 0 0 "[ . 1 . 2]" 1
3192 2 44 GLN H 2 44 GLN HB3 . . 4.150 3.062 2.419 3.311 . 0 0 "[ . 1 . 2]" 1
3193 2 44 GLN H 2 44 GLN QG . . 3.910 2.458 2.155 3.947 0.037 18 0 "[ . 1 . 2]" 1
3194 2 44 GLN H 2 45 ALA H . . 5.070 4.427 4.364 4.511 . 0 0 "[ . 1 . 2]" 1
3195 2 44 GLN HA 2 45 ALA MB . . 5.000 4.122 4.015 4.171 . 0 0 "[ . 1 . 2]" 1
3196 2 44 GLN HB2 2 45 ALA H . . 3.870 2.544 2.291 3.905 0.035 9 0 "[ . 1 . 2]" 1
3197 2 44 GLN HB3 2 45 ALA H . . 4.600 3.749 3.606 3.845 . 0 0 "[ . 1 . 2]" 1
3198 2 44 GLN HE22 2 47 LYS HD2 . . 5.500 4.498 2.839 5.578 0.078 9 0 "[ . 1 . 2]" 1
3199 2 44 GLN HE22 2 47 LYS HD3 . . 5.500 4.450 3.443 5.586 0.086 20 0 "[ . 1 . 2]" 1
3200 2 44 GLN QG 2 45 ALA H . . 4.820 3.311 2.066 3.698 . 0 0 "[ . 1 . 2]" 1
3201 2 45 ALA H 2 45 ALA MB . . 3.660 2.232 2.181 2.276 . 0 0 "[ . 1 . 2]" 1
3202 2 45 ALA H 2 46 PRO QD . . 5.350 4.429 4.358 4.488 . 0 0 "[ . 1 . 2]" 1
3203 2 45 ALA HA 2 46 PRO QG . . 5.110 4.029 3.757 4.198 . 0 0 "[ . 1 . 2]" 1
3204 2 45 ALA MB 2 46 PRO QD . . 4.040 2.043 1.878 2.374 . 0 0 "[ . 1 . 2]" 1
3205 2 45 ALA MB 2 46 PRO QG . . 4.390 3.513 3.108 4.042 . 0 0 "[ . 1 . 2]" 1
3206 2 46 PRO QG 2 47 LYS H . . 5.030 4.636 4.366 4.885 . 0 0 "[ . 1 . 2]" 1
3207 2 47 LYS H 2 47 LYS QD . . 5.230 4.440 4.283 4.726 . 0 0 "[ . 1 . 2]" 1
3208 2 47 LYS HA 2 47 LYS HD2 . . 5.230 3.540 1.996 4.346 . 0 0 "[ . 1 . 2]" 1
3209 2 47 LYS HA 2 47 LYS HD3 . . 5.230 4.146 3.145 4.676 . 0 0 "[ . 1 . 2]" 1
3210 2 47 LYS HA 2 47 LYS HE2 . . 5.500 5.188 4.641 5.500 . 12 0 "[ . 1 . 2]" 1
3211 2 47 LYS HB2 2 47 LYS HD2 . . 2.830 2.601 2.439 2.865 0.035 7 0 "[ . 1 . 2]" 1
3212 2 47 LYS HB2 2 47 LYS HD3 . . 2.830 2.740 2.403 2.910 0.080 15 0 "[ . 1 . 2]" 1
3213 2 47 LYS HB2 2 47 LYS HE3 . . 4.510 4.359 4.283 4.545 0.035 3 0 "[ . 1 . 2]" 1
3214 2 47 LYS HB3 2 47 LYS HD2 . . 4.080 3.324 3.088 3.729 . 0 0 "[ . 1 . 2]" 1
3215 2 47 LYS HB3 2 47 LYS QD . . 3.360 2.673 2.306 3.299 . 0 0 "[ . 1 . 2]" 1
3216 2 47 LYS HB3 2 47 LYS HD3 . . 4.080 2.860 2.378 3.738 . 0 0 "[ . 1 . 2]" 1
3217 2 47 LYS HB3 2 47 LYS HE3 . . 5.500 4.648 4.581 4.757 . 0 0 "[ . 1 . 2]" 1
3218 2 47 LYS HE2 2 48 LEU H . . 5.500 4.996 4.504 5.341 . 0 0 "[ . 1 . 2]" 1
3219 2 47 LYS HE3 2 48 LEU H . . 5.500 4.779 3.299 5.299 . 0 0 "[ . 1 . 2]" 1
3220 2 47 LYS HE3 2 49 LEU QD . . 4.980 4.395 3.119 5.026 0.046 6 0 "[ . 1 . 2]" 1
3221 2 47 LYS HE3 2 57 GLU QG . . 5.340 4.698 3.165 5.382 0.042 12 0 "[ . 1 . 2]" 1
3222 2 47 LYS HE3 2 60 VAL MG2 . . 5.370 4.315 2.997 4.978 . 0 0 "[ . 1 . 2]" 1
3223 2 47 LYS QG 2 49 LEU QD . . 4.850 3.188 2.231 3.896 . 0 0 "[ . 1 . 2]" 1
3224 2 47 LYS HG2 2 48 LEU H . . 4.850 3.528 2.938 4.464 . 0 0 "[ . 1 . 2]" 1
3225 2 47 LYS HG3 2 48 LEU H . . 4.850 2.924 2.724 3.125 . 0 0 "[ . 1 . 2]" 1
3226 2 48 LEU H 2 48 LEU QB . . 3.790 2.189 2.157 2.227 . 0 0 "[ . 1 . 2]" 1
3227 2 48 LEU H 2 48 LEU MD1 . . 4.920 4.189 4.147 4.246 . 0 0 "[ . 1 . 2]" 1
3228 2 48 LEU H 2 48 LEU QD . . 4.290 3.724 3.671 3.765 . 0 0 "[ . 1 . 2]" 1
3229 2 48 LEU H 2 48 LEU MD2 . . 4.920 4.171 4.096 4.225 . 0 0 "[ . 1 . 2]" 1
3230 2 48 LEU H 2 48 LEU HG . . 5.310 4.482 4.445 4.550 . 0 0 "[ . 1 . 2]" 1
3231 2 48 LEU H 2 57 GLU QG . . 5.340 5.131 4.594 5.388 0.048 16 0 "[ . 1 . 2]" 1
3232 2 48 LEU HA 2 48 LEU MD1 . . 4.800 3.851 3.823 3.912 . 0 0 "[ . 1 . 2]" 1
3233 2 48 LEU HA 2 48 LEU QD . . 4.160 2.904 2.784 2.989 . 0 0 "[ . 1 . 2]" 1
3234 2 48 LEU HA 2 48 LEU MD2 . . 4.800 3.005 2.850 3.116 . 0 0 "[ . 1 . 2]" 1
3235 2 48 LEU HA 2 49 LEU HA . . 5.030 4.342 4.312 4.374 . 0 0 "[ . 1 . 2]" 1
3236 2 48 LEU HA 2 50 ILE H . . 5.220 4.077 3.926 4.337 . 0 0 "[ . 1 . 2]" 1
3237 2 48 LEU QD 2 50 ILE H . . 4.360 2.874 2.597 3.097 . 0 0 "[ . 1 . 2]" 1
3238 2 48 LEU QD 2 50 ILE HA . . 4.150 3.287 3.120 3.443 . 0 0 "[ . 1 . 2]" 1
3239 2 48 LEU QD 2 51 TYR H . . 4.200 3.394 3.144 3.613 . 0 0 "[ . 1 . 2]" 1
3240 2 48 LEU QD 2 51 TYR HA . . 5.440 3.485 3.178 3.779 . 0 0 "[ . 1 . 2]" 1
3241 2 48 LEU QD 2 51 TYR HB2 . . 4.400 3.192 2.829 3.562 . 0 0 "[ . 1 . 2]" 1
3242 2 48 LEU QD 2 51 TYR HB3 . . 3.770 1.927 1.711 2.190 . 0 0 "[ . 1 . 2]" 1
3243 2 48 LEU QD 2 51 TYR QD . . 3.180 1.826 1.779 1.887 . 0 0 "[ . 1 . 2]" 1
3244 2 48 LEU QD 2 51 TYR QE . . 3.340 3.368 3.292 3.409 0.069 2 0 "[ . 1 . 2]" 1
3245 2 48 LEU QD 2 52 ASP H . . 5.350 4.725 4.284 5.133 . 0 0 "[ . 1 . 2]" 1
3246 2 48 LEU QD 2 57 GLU H . . 4.850 3.625 3.374 3.812 . 0 0 "[ . 1 . 2]" 1
3247 2 48 LEU QD 2 57 GLU HA . . 5.200 3.942 3.725 4.250 . 0 0 "[ . 1 . 2]" 1
3248 2 48 LEU QD 2 57 GLU HB2 . . 4.460 2.066 1.940 2.250 . 0 0 "[ . 1 . 2]" 1
3249 2 48 LEU QD 2 57 GLU HB3 . . 3.740 2.946 2.524 3.144 . 0 0 "[ . 1 . 2]" 1
3250 2 48 LEU QD 2 57 GLU QG . . 3.990 2.525 1.926 2.873 . 0 0 "[ . 1 . 2]" 1
3251 2 48 LEU QD 2 58 THR H . . 5.440 5.038 4.627 5.273 . 0 0 "[ . 1 . 2]" 1
3252 2 48 LEU QD 2 60 VAL MG2 . . 4.980 3.657 3.341 3.874 . 0 0 "[ . 1 . 2]" 1
3253 2 48 LEU MD1 2 51 TYR HB2 . . 5.130 3.578 2.996 4.230 . 0 0 "[ . 1 . 2]" 1
3254 2 48 LEU MD1 2 51 TYR HB3 . . 4.540 2.524 1.991 3.117 . 0 0 "[ . 1 . 2]" 1
3255 2 48 LEU MD2 2 51 TYR HB2 . . 5.130 3.624 3.454 3.834 . 0 0 "[ . 1 . 2]" 1
3256 2 48 LEU MD2 2 51 TYR HB3 . . 4.540 2.013 1.844 2.238 . 0 0 "[ . 1 . 2]" 1
3257 2 48 LEU HG 2 50 ILE H . . 4.710 4.257 3.958 4.691 . 0 0 "[ . 1 . 2]" 1
3258 2 48 LEU HG 2 51 TYR QD . . 4.760 4.189 4.049 4.268 . 0 0 "[ . 1 . 2]" 1
3259 2 49 LEU H 2 49 LEU MD1 . . 4.720 4.105 3.948 4.240 . 0 0 "[ . 1 . 2]" 1
3260 2 49 LEU H 2 49 LEU MD2 . . 4.720 4.057 3.522 4.383 . 0 0 "[ . 1 . 2]" 1
3261 2 49 LEU H 2 50 ILE H . . 4.070 2.219 2.139 2.452 . 0 0 "[ . 1 . 2]" 1
3262 2 49 LEU HA 2 49 LEU MD1 . . 4.450 2.749 2.005 3.831 . 0 0 "[ . 1 . 2]" 1
3263 2 49 LEU HA 2 49 LEU QD . . 3.490 2.016 1.967 2.055 . 0 0 "[ . 1 . 2]" 1
3264 2 49 LEU HA 2 49 LEU MD2 . . 4.450 3.115 1.973 3.879 . 0 0 "[ . 1 . 2]" 1
3265 2 49 LEU HA 2 57 GLU H . . 4.890 4.242 3.833 4.577 . 0 0 "[ . 1 . 2]" 1
3266 2 49 LEU HA 2 57 GLU HB2 . . 5.500 4.385 3.862 4.936 . 0 0 "[ . 1 . 2]" 1
3267 2 49 LEU HA 2 57 GLU HB3 . . 5.500 3.424 2.911 3.784 . 0 0 "[ . 1 . 2]" 1
3268 2 49 LEU HA 2 60 VAL MG1 . . 4.950 3.394 2.840 3.809 . 0 0 "[ . 1 . 2]" 1
3269 2 49 LEU HA 2 60 VAL MG2 . . 3.890 2.200 1.796 2.569 . 0 0 "[ . 1 . 2]" 1
3270 2 49 LEU QB 2 50 ILE H . . 4.270 2.332 2.153 2.616 . 0 0 "[ . 1 . 2]" 1
3271 2 49 LEU QB 2 75 PHE HZ . . 4.720 4.117 3.608 4.408 . 0 0 "[ . 1 . 2]" 1
3272 2 49 LEU QB 2 88 TYR QD . . 4.350 4.369 4.167 4.500 0.150 3 0 "[ . 1 . 2]" 1
3273 2 49 LEU QD 2 57 GLU QG . . 5.280 5.043 4.493 5.342 0.062 8 0 "[ . 1 . 2]" 1
3274 2 49 LEU QD 2 60 VAL H . . 5.440 4.964 4.793 5.189 . 0 0 "[ . 1 . 2]" 1
3275 2 49 LEU QD 2 60 VAL HB . . 5.210 4.109 3.910 4.418 . 0 0 "[ . 1 . 2]" 1
3276 2 49 LEU QD 2 60 VAL MG1 . . 3.780 2.085 1.872 2.500 . 0 0 "[ . 1 . 2]" 1
3277 2 49 LEU QD 2 60 VAL MG2 . . 3.670 2.018 1.860 2.339 . 0 0 "[ . 1 . 2]" 1
3278 2 49 LEU QD 2 64 PHE QD . . 3.940 2.806 2.352 3.292 . 0 0 "[ . 1 . 2]" 1
3279 2 49 LEU QD 2 64 PHE QE . . 3.810 3.084 2.579 3.587 . 0 0 "[ . 1 . 2]" 1
3280 2 49 LEU QD 2 75 PHE HZ . . 3.940 2.299 1.924 2.854 . 0 0 "[ . 1 . 2]" 1
3281 2 49 LEU QD 2 88 TYR QD . . 3.720 3.067 2.456 3.492 . 0 0 "[ . 1 . 2]" 1
3282 2 49 LEU QD 2 88 TYR QE . . 3.540 2.043 1.805 2.447 . 0 0 "[ . 1 . 2]" 1
3283 2 49 LEU MD1 2 60 VAL HA . . 5.500 4.133 3.164 5.529 0.029 11 0 "[ . 1 . 2]" 1
3284 2 49 LEU MD1 2 61 PRO HD2 . . 5.500 3.926 3.130 5.206 . 0 0 "[ . 1 . 2]" 1
3285 2 49 LEU MD1 2 64 PHE QE . . 4.450 3.451 3.000 4.035 . 0 0 "[ . 1 . 2]" 1
3286 2 49 LEU MD2 2 60 VAL HA . . 5.500 4.698 3.291 5.565 0.065 9 0 "[ . 1 . 2]" 1
3287 2 49 LEU MD2 2 61 PRO HD2 . . 5.500 4.420 3.352 5.088 . 0 0 "[ . 1 . 2]" 1
3288 2 49 LEU MD2 2 64 PHE QE . . 4.450 3.596 2.811 4.467 0.017 3 0 "[ . 1 . 2]" 1
3289 2 50 ILE H 2 50 ILE MD . . 4.600 4.165 4.064 4.275 . 0 0 "[ . 1 . 2]" 1
3290 2 50 ILE H 2 50 ILE HG12 . . 5.500 3.945 3.747 4.119 . 0 0 "[ . 1 . 2]" 1
3291 2 50 ILE H 2 50 ILE HG13 . . 5.500 2.930 2.734 3.126 . 0 0 "[ . 1 . 2]" 1
3292 2 50 ILE H 2 51 TYR H . . 5.500 4.286 4.236 4.325 . 0 0 "[ . 1 . 2]" 1
3293 2 50 ILE H 2 60 VAL MG2 . . 5.500 4.460 4.263 4.634 . 0 0 "[ . 1 . 2]" 1
3294 2 50 ILE HA 2 50 ILE MD . . 4.700 3.815 3.784 3.834 . 0 0 "[ . 1 . 2]" 1
3295 2 50 ILE HA 2 51 TYR QD . . 4.330 3.980 3.634 4.360 0.030 16 0 "[ . 1 . 2]" 1
3296 2 50 ILE HA 2 56 LEU HA . . 4.250 2.445 2.191 2.679 . 0 0 "[ . 1 . 2]" 1
3297 2 50 ILE HA 2 57 GLU H . . 4.960 2.828 2.661 3.030 . 0 0 "[ . 1 . 2]" 1
3298 2 50 ILE HB 2 50 ILE MD . . 3.550 2.442 2.403 2.481 . 0 0 "[ . 1 . 2]" 1
3299 2 50 ILE HB 2 50 ILE HG13 . . 2.840 2.440 2.407 2.503 . 0 0 "[ . 1 . 2]" 1
3300 2 50 ILE HB 2 75 PHE QE . . 4.040 3.702 3.337 4.059 0.019 9 0 "[ . 1 . 2]" 1
3301 2 50 ILE MD 2 50 ILE MG . . 2.400 1.853 1.814 1.907 . 0 0 "[ . 1 . 2]" 1
3302 2 50 ILE MD 2 51 TYR H . . 4.810 4.863 4.842 4.887 0.077 13 0 "[ . 1 . 2]" 1
3303 2 50 ILE MD 2 56 LEU HG . . 4.240 3.460 2.702 4.318 0.078 11 0 "[ . 1 . 2]" 1
3304 2 50 ILE MD 2 64 PHE HB2 . . 5.090 2.981 2.555 3.231 . 0 0 "[ . 1 . 2]" 1
3305 2 50 ILE MD 2 65 SER H . . 4.740 2.962 2.154 3.507 . 0 0 "[ . 1 . 2]" 1
3306 2 50 ILE MD 2 65 SER HA . . 3.960 2.674 2.467 3.174 . 0 0 "[ . 1 . 2]" 1
3307 2 50 ILE MD 2 65 SER QB . . 4.990 3.985 3.897 4.043 . 0 0 "[ . 1 . 2]" 1
3308 2 50 ILE MD 2 66 GLY H . . 4.060 2.475 2.178 2.842 . 0 0 "[ . 1 . 2]" 1
3309 2 50 ILE MD 2 66 GLY HA3 . . 4.550 2.471 1.957 2.753 . 0 0 "[ . 1 . 2]" 1
3310 2 50 ILE MD 2 67 SER H . . 5.380 4.842 4.420 5.194 . 0 0 "[ . 1 . 2]" 1
3311 2 50 ILE MD 2 75 PHE QE . . 3.640 2.177 2.040 2.327 . 0 0 "[ . 1 . 2]" 1
3312 2 50 ILE MD 2 75 PHE HZ . . 4.240 4.070 3.961 4.210 . 0 0 "[ . 1 . 2]" 1
3313 2 50 ILE HG12 2 51 TYR H . . 5.410 4.326 4.239 4.481 . 0 0 "[ . 1 . 2]" 1
3314 2 50 ILE HG12 2 56 LEU HA . . 4.820 2.712 2.452 3.075 . 0 0 "[ . 1 . 2]" 1
3315 2 50 ILE HG12 2 57 GLU H . . 5.500 3.920 3.600 4.271 . 0 0 "[ . 1 . 2]" 1
3316 2 50 ILE HG12 2 75 PHE QE . . 4.250 4.217 4.015 4.284 0.034 7 0 "[ . 1 . 2]" 1
3317 2 50 ILE HG13 2 51 TYR H . . 5.500 5.023 4.946 5.149 . 0 0 "[ . 1 . 2]" 1
3318 2 50 ILE HG13 2 56 LEU HA . . 5.300 4.190 3.848 4.635 . 0 0 "[ . 1 . 2]" 1
3319 2 50 ILE HG13 2 65 SER HA . . 5.450 5.350 5.034 5.586 0.136 11 0 "[ . 1 . 2]" 1
3320 2 50 ILE HG13 2 66 GLY H . . 5.500 5.464 5.187 5.589 0.089 9 0 "[ . 1 . 2]" 1
3321 2 50 ILE MG 2 51 TYR H . . 3.510 2.428 2.337 2.496 . 0 0 "[ . 1 . 2]" 1
3322 2 50 ILE MG 2 51 TYR QD . . 5.500 4.713 4.592 4.774 . 0 0 "[ . 1 . 2]" 1
3323 2 50 ILE MG 2 53 ALA H . . 5.080 3.546 3.174 3.910 . 0 0 "[ . 1 . 2]" 1
3324 2 50 ILE MG 2 54 SER H . . 4.650 3.451 2.693 3.926 . 0 0 "[ . 1 . 2]" 1
3325 2 50 ILE MG 2 54 SER QB . . 5.300 4.418 3.940 4.882 . 0 0 "[ . 1 . 2]" 1
3326 2 50 ILE MG 2 55 THR H . . 3.930 2.991 2.558 3.561 . 0 0 "[ . 1 . 2]" 1
3327 2 50 ILE MG 2 55 THR HA . . 5.350 3.927 3.643 4.218 . 0 0 "[ . 1 . 2]" 1
3328 2 50 ILE MG 2 55 THR HB . . 5.400 4.265 3.982 4.545 . 0 0 "[ . 1 . 2]" 1
3329 2 50 ILE MG 2 56 LEU HA . . 4.260 2.879 2.706 3.072 . 0 0 "[ . 1 . 2]" 1
3330 2 50 ILE MG 2 56 LEU HB3 . . 5.290 4.872 4.678 5.023 . 0 0 "[ . 1 . 2]" 1
3331 2 50 ILE MG 2 57 GLU H . . 4.900 4.361 4.105 4.641 . 0 0 "[ . 1 . 2]" 1
3332 2 50 ILE MG 2 65 SER QB . . 5.130 5.186 5.032 5.290 0.160 18 0 "[ . 1 . 2]" 1
3333 2 50 ILE MG 2 66 GLY HA2 . . 4.850 4.083 3.362 4.380 . 0 0 "[ . 1 . 2]" 1
3334 2 50 ILE MG 2 66 GLY HA3 . . 4.760 2.597 2.045 2.922 . 0 0 "[ . 1 . 2]" 1
3335 2 51 TYR H 2 51 TYR QD . . 3.930 3.216 3.023 3.376 . 0 0 "[ . 1 . 2]" 1
3336 2 51 TYR H 2 51 TYR QE . . 4.460 4.493 4.414 4.555 0.095 9 0 "[ . 1 . 2]" 1
3337 2 51 TYR H 2 54 SER H . . 5.500 4.852 3.907 5.510 0.010 16 0 "[ . 1 . 2]" 1
3338 2 51 TYR H 2 55 THR HB . . 4.750 3.595 3.397 3.781 . 0 0 "[ . 1 . 2]" 1
3339 2 51 TYR H 2 56 LEU HA . . 5.350 3.521 3.369 3.618 . 0 0 "[ . 1 . 2]" 1
3340 2 51 TYR H 2 56 LEU QD . . 5.380 4.544 4.203 4.764 . 0 0 "[ . 1 . 2]" 1
3341 2 51 TYR H 2 57 GLU H . . 5.500 4.068 3.958 4.170 . 0 0 "[ . 1 . 2]" 1
3342 2 51 TYR H 2 57 GLU HA . . 5.500 5.287 4.920 5.510 0.010 17 0 "[ . 1 . 2]" 1
3343 2 51 TYR H 2 60 VAL MG2 . . 5.500 5.574 5.521 5.631 0.131 4 0 "[ . 1 . 2]" 1
3344 2 51 TYR HA 2 51 TYR QD . . 4.250 3.764 3.726 3.787 . 0 0 "[ . 1 . 2]" 1
3345 2 51 TYR HA 2 53 ALA H . . 5.460 3.219 2.869 3.850 . 0 0 "[ . 1 . 2]" 1
3346 2 51 TYR HB2 2 52 ASP H . . 4.620 2.260 2.033 2.455 . 0 0 "[ . 1 . 2]" 1
3347 2 51 TYR HB2 2 53 ALA H . . 5.500 4.541 4.284 4.858 . 0 0 "[ . 1 . 2]" 1
3348 2 51 TYR HB3 2 52 ASP H . . 5.030 3.645 3.520 3.722 . 0 0 "[ . 1 . 2]" 1
3349 2 51 TYR HB3 2 57 GLU HB2 . . 4.750 4.578 4.311 4.758 0.008 19 0 "[ . 1 . 2]" 1
3350 2 51 TYR QD 2 52 ASP H . . 4.170 3.090 2.742 3.516 . 0 0 "[ . 1 . 2]" 1
3351 2 51 TYR QD 2 52 ASP HB3 . . 3.950 3.031 2.723 3.288 . 0 0 "[ . 1 . 2]" 1
3352 2 51 TYR QD 2 55 THR H . . 5.500 4.575 4.174 4.871 . 0 0 "[ . 1 . 2]" 1
3353 2 51 TYR QD 2 55 THR HB . . 5.500 3.129 2.852 3.461 . 0 0 "[ . 1 . 2]" 1
3354 2 51 TYR QD 2 55 THR MG . . 4.890 3.819 3.621 4.171 . 0 0 "[ . 1 . 2]" 1
3355 2 51 TYR QD 2 57 GLU H . . 5.500 4.013 3.827 4.275 . 0 0 "[ . 1 . 2]" 1
3356 2 51 TYR QD 2 57 GLU HB2 . . 4.130 2.458 2.099 2.695 . 0 0 "[ . 1 . 2]" 1
3357 2 51 TYR QD 2 57 GLU HB3 . . 4.290 4.120 3.754 4.315 0.025 9 0 "[ . 1 . 2]" 1
3358 2 51 TYR QE 2 52 ASP HB2 . . 5.220 3.439 3.036 4.165 . 0 0 "[ . 1 . 2]" 1
3359 2 51 TYR QE 2 52 ASP HB3 . . 4.110 4.112 3.719 4.200 0.090 2 0 "[ . 1 . 2]" 1
3360 2 51 TYR QE 2 55 THR MG . . 4.160 2.675 2.387 3.068 . 0 0 "[ . 1 . 2]" 1
3361 2 51 TYR QE 2 57 GLU H . . 4.890 4.101 3.835 4.430 . 0 0 "[ . 1 . 2]" 1
3362 2 51 TYR QE 2 57 GLU HA . . 3.630 2.128 1.860 2.470 . 0 0 "[ . 1 . 2]" 1
3363 2 51 TYR QE 2 57 GLU HB2 . . 3.770 2.775 2.289 3.400 . 0 0 "[ . 1 . 2]" 1
3364 2 51 TYR QE 2 57 GLU HB3 . . 5.500 4.192 3.840 4.508 . 0 0 "[ . 1 . 2]" 1
3365 2 51 TYR QE 2 58 THR H . . 5.390 3.717 3.272 3.983 . 0 0 "[ . 1 . 2]" 1
3366 2 52 ASP H 2 53 ALA H . . 4.540 2.734 2.455 3.432 . 0 0 "[ . 1 . 2]" 1
3367 2 52 ASP H 2 53 ALA HA . . 5.500 4.716 4.623 4.817 . 0 0 "[ . 1 . 2]" 1
3368 2 52 ASP H 2 93 TYR QE . . 4.170 2.794 2.440 3.461 . 0 0 "[ . 1 . 2]" 1
3369 2 52 ASP HA 2 53 ALA MB . . 5.500 3.987 3.757 4.251 . 0 0 "[ . 1 . 2]" 1
3370 2 52 ASP HA 2 93 TYR QE . . 4.770 3.291 2.186 3.960 . 0 0 "[ . 1 . 2]" 1
3371 2 52 ASP HB2 2 53 ALA H . . 5.500 4.257 3.607 4.490 . 0 0 "[ . 1 . 2]" 1
3372 2 52 ASP HB2 2 54 SER H . . 5.500 4.799 4.524 5.159 . 0 0 "[ . 1 . 2]" 1
3373 2 52 ASP HB2 2 55 THR H . . 4.830 4.394 3.934 4.840 0.010 2 0 "[ . 1 . 2]" 1
3374 2 52 ASP HB2 2 55 THR HB . . 4.980 3.468 2.771 4.369 . 0 0 "[ . 1 . 2]" 1
3375 2 52 ASP HB2 2 55 THR MG . . 5.500 4.453 3.785 5.428 . 0 0 "[ . 1 . 2]" 1
3376 2 52 ASP HB3 2 53 ALA H . . 5.500 3.474 2.181 4.097 . 0 0 "[ . 1 . 2]" 1
3377 2 52 ASP HB3 2 54 SER H . . 4.930 3.219 2.787 3.613 . 0 0 "[ . 1 . 2]" 1
3378 2 52 ASP HB3 2 55 THR H . . 3.800 2.798 2.190 3.338 . 0 0 "[ . 1 . 2]" 1
3379 2 53 ALA H 2 54 SER H . . 3.630 2.834 2.058 3.528 . 0 0 "[ . 1 . 2]" 1
3380 2 53 ALA MB 2 54 SER H . . 4.240 2.998 2.141 3.634 . 0 0 "[ . 1 . 2]" 1
3381 2 53 ALA MB 2 54 SER QB . . 5.340 3.732 3.005 4.346 . 0 0 "[ . 1 . 2]" 1
3382 2 53 ALA MB 2 68 GLY H . . 5.500 3.242 2.039 4.177 . 0 0 "[ . 1 . 2]" 1
3383 2 53 ALA MB 2 68 GLY QA . . 5.340 3.678 2.804 4.680 . 0 0 "[ . 1 . 2]" 1
3384 2 53 ALA MB 2 69 SER H . . 5.500 4.620 4.148 5.407 . 0 0 "[ . 1 . 2]" 1
3385 2 53 ALA MB 2 69 SER HA . . 5.370 3.387 2.691 3.740 . 0 0 "[ . 1 . 2]" 1
3386 2 53 ALA MB 2 69 SER QB . . 5.480 4.025 2.826 4.542 . 0 0 "[ . 1 . 2]" 1
3387 2 53 ALA MB 2 70 GLY H . . 5.500 4.524 3.987 4.870 . 0 0 "[ . 1 . 2]" 1
3388 2 53 ALA MB 2 73 PHE QD . . 4.150 2.325 1.962 2.847 . 0 0 "[ . 1 . 2]" 1
3389 2 53 ALA MB 2 73 PHE QE . . 4.980 2.458 2.060 3.687 . 0 0 "[ . 1 . 2]" 1
3390 2 54 SER H 2 55 THR H . . 3.670 2.113 1.661 2.464 . 0 0 "[ . 1 . 2]" 1
3391 2 54 SER H 2 55 THR HB . . 5.500 4.254 3.812 4.440 . 0 0 "[ . 1 . 2]" 1
3392 2 54 SER H 2 68 GLY H . . 5.500 5.440 5.053 5.572 0.072 12 0 "[ . 1 . 2]" 1
3393 2 55 THR H 2 55 THR HB . . 4.050 2.543 2.461 2.619 . 0 0 "[ . 1 . 2]" 1
3394 2 55 THR H 2 55 THR MG . . 4.560 3.787 3.713 3.838 . 0 0 "[ . 1 . 2]" 1
3395 2 55 THR H 2 56 LEU H . . 5.300 4.428 4.358 4.484 . 0 0 "[ . 1 . 2]" 1
3396 2 55 THR HA 2 55 THR MG . . 3.590 2.357 2.287 2.456 . 0 0 "[ . 1 . 2]" 1
3397 2 55 THR HA 2 56 LEU H . . 3.370 2.155 2.116 2.196 . 0 0 "[ . 1 . 2]" 1
3398 2 55 THR HB 2 56 LEU H . . 5.430 4.214 4.132 4.325 . 0 0 "[ . 1 . 2]" 1
3399 2 55 THR MG 2 56 LEU H . . 3.720 2.764 2.698 2.907 . 0 0 "[ . 1 . 2]" 1
3400 2 55 THR MG 2 56 LEU HA . . 5.500 4.119 3.985 4.258 . 0 0 "[ . 1 . 2]" 1
3401 2 55 THR MG 2 56 LEU HB2 . . 5.460 4.293 4.129 4.496 . 0 0 "[ . 1 . 2]" 1
3402 2 56 LEU H 2 56 LEU HB2 . . 3.780 2.416 2.358 2.477 . 0 0 "[ . 1 . 2]" 1
3403 2 56 LEU H 2 56 LEU HB3 . . 4.040 3.610 3.586 3.648 . 0 0 "[ . 1 . 2]" 1
3404 2 56 LEU H 2 56 LEU MD1 . . 4.820 2.889 2.229 3.825 . 0 0 "[ . 1 . 2]" 1
3405 2 56 LEU H 2 56 LEU QD . . 3.870 2.654 2.218 3.213 . 0 0 "[ . 1 . 2]" 1
3406 2 56 LEU H 2 56 LEU MD2 . . 4.820 3.786 3.319 4.102 . 0 0 "[ . 1 . 2]" 1
3407 2 56 LEU H 2 56 LEU HG . . 4.630 3.378 2.400 4.075 . 0 0 "[ . 1 . 2]" 1
3408 2 56 LEU H 2 57 GLU H . . 5.010 4.521 4.498 4.555 . 0 0 "[ . 1 . 2]" 1
3409 2 56 LEU HA 2 56 LEU MD1 . . 4.320 3.221 2.673 3.904 . 0 0 "[ . 1 . 2]" 1
3410 2 56 LEU HA 2 56 LEU QD . . 3.590 2.461 1.992 2.782 . 0 0 "[ . 1 . 2]" 1
3411 2 56 LEU HA 2 56 LEU MD2 . . 4.320 3.124 1.999 3.857 . 0 0 "[ . 1 . 2]" 1
3412 2 56 LEU HA 2 57 GLU HB2 . . 5.240 4.460 4.092 4.632 . 0 0 "[ . 1 . 2]" 1
3413 2 56 LEU HA 2 60 VAL MG2 . . 5.030 3.788 3.684 3.937 . 0 0 "[ . 1 . 2]" 1
3414 2 56 LEU HB2 2 57 GLU H . . 5.070 4.110 4.040 4.175 . 0 0 "[ . 1 . 2]" 1
3415 2 56 LEU HB2 2 60 VAL HB . . 4.860 3.926 3.784 4.187 . 0 0 "[ . 1 . 2]" 1
3416 2 56 LEU HB2 2 60 VAL MG1 . . 4.930 4.322 4.051 4.543 . 0 0 "[ . 1 . 2]" 1
3417 2 56 LEU HB3 2 57 GLU H . . 4.810 3.047 2.963 3.141 . 0 0 "[ . 1 . 2]" 1
3418 2 56 LEU HB3 2 60 VAL H . . 5.140 4.212 4.097 4.425 . 0 0 "[ . 1 . 2]" 1
3419 2 56 LEU HB3 2 60 VAL HB . . 4.150 2.256 2.110 2.460 . 0 0 "[ . 1 . 2]" 1
3420 2 56 LEU HB3 2 60 VAL MG1 . . 4.230 3.002 2.752 3.207 . 0 0 "[ . 1 . 2]" 1
3421 2 56 LEU HB3 2 60 VAL MG2 . . 3.900 3.544 3.378 3.678 . 0 0 "[ . 1 . 2]" 1
3422 2 56 LEU QD 2 57 GLU H . . 4.320 3.838 3.289 4.172 . 0 0 "[ . 1 . 2]" 1
3423 2 56 LEU QD 2 60 VAL H . . 5.200 4.625 4.495 4.783 . 0 0 "[ . 1 . 2]" 1
3424 2 56 LEU QD 2 60 VAL HB . . 4.110 2.917 2.700 3.050 . 0 0 "[ . 1 . 2]" 1
3425 2 56 LEU QD 2 60 VAL MG1 . . 3.680 2.138 1.980 2.428 . 0 0 "[ . 1 . 2]" 1
3426 2 56 LEU QD 2 62 SER H . . 5.440 4.083 3.737 4.338 . 0 0 "[ . 1 . 2]" 1
3427 2 56 LEU QD 2 62 SER HA . . 3.890 2.327 2.011 2.581 . 0 0 "[ . 1 . 2]" 1
3428 2 56 LEU QD 2 64 PHE HB3 . . 4.700 3.686 2.941 4.341 . 0 0 "[ . 1 . 2]" 1
3429 2 56 LEU QD 2 64 PHE QD . . 4.080 3.666 3.251 4.089 0.009 13 0 "[ . 1 . 2]" 1
3430 2 56 LEU QD 2 65 SER H . . 5.440 4.020 2.875 4.345 . 0 0 "[ . 1 . 2]" 1
3431 2 56 LEU QD 2 65 SER HA . . 4.610 2.354 2.003 2.773 . 0 0 "[ . 1 . 2]" 1
3432 2 56 LEU QD 2 65 SER QB . . 4.490 3.662 3.298 4.247 . 0 0 "[ . 1 . 2]" 1
3433 2 56 LEU QD 2 66 GLY H . . 4.630 3.356 2.571 4.220 . 0 0 "[ . 1 . 2]" 1
3434 2 56 LEU MD1 2 57 GLU H . . 5.500 4.697 4.415 4.990 . 0 0 "[ . 1 . 2]" 1
3435 2 56 LEU MD1 2 60 VAL HB . . 4.750 4.269 3.427 4.859 0.109 16 0 "[ . 1 . 2]" 1
3436 2 56 LEU MD1 2 64 PHE H . . 4.930 4.585 3.344 5.011 0.081 15 0 "[ . 1 . 2]" 1
3437 2 56 LEU MD1 2 64 PHE HB2 . . 5.020 3.953 3.048 4.586 . 0 0 "[ . 1 . 2]" 1
3438 2 56 LEU MD1 2 64 PHE HB3 . . 5.500 4.762 4.197 5.483 . 0 0 "[ . 1 . 2]" 1
3439 2 56 LEU MD1 2 66 GLY H . . 5.500 4.036 2.585 5.630 0.130 9 0 "[ . 1 . 2]" 1
3440 2 56 LEU MD2 2 57 GLU H . . 5.500 4.190 3.351 4.738 . 0 0 "[ . 1 . 2]" 1
3441 2 56 LEU MD2 2 60 VAL HB . . 4.750 3.022 2.715 3.263 . 0 0 "[ . 1 . 2]" 1
3442 2 56 LEU MD2 2 64 PHE H . . 4.930 3.598 3.028 4.363 . 0 0 "[ . 1 . 2]" 1
3443 2 56 LEU MD2 2 64 PHE HB2 . . 5.020 2.822 2.259 3.365 . 0 0 "[ . 1 . 2]" 1
3444 2 56 LEU MD2 2 64 PHE HB3 . . 5.500 3.874 2.997 4.638 . 0 0 "[ . 1 . 2]" 1
3445 2 56 LEU MD2 2 66 GLY H . . 5.500 4.543 3.388 5.398 . 0 0 "[ . 1 . 2]" 1
3446 2 56 LEU HG 2 57 GLU H . . 5.070 4.441 3.827 5.114 0.044 17 0 "[ . 1 . 2]" 1
3447 2 56 LEU HG 2 60 VAL HB . . 5.050 4.243 3.537 5.149 0.099 11 0 "[ . 1 . 2]" 1
3448 2 56 LEU HG 2 62 SER HA . . 5.500 5.022 4.623 5.365 . 0 0 "[ . 1 . 2]" 1
3449 2 57 GLU H 2 57 GLU HB2 . . 3.880 2.584 2.289 2.708 . 0 0 "[ . 1 . 2]" 1
3450 2 57 GLU H 2 57 GLU HB3 . . 4.180 2.413 2.320 2.607 . 0 0 "[ . 1 . 2]" 1
3451 2 57 GLU H 2 57 GLU HG2 . . 5.500 4.551 4.351 4.698 . 0 0 "[ . 1 . 2]" 1
3452 2 57 GLU H 2 57 GLU QG . . 4.810 3.977 3.916 4.083 . 0 0 "[ . 1 . 2]" 1
3453 2 57 GLU H 2 57 GLU HG3 . . 5.500 4.391 4.317 4.490 . 0 0 "[ . 1 . 2]" 1
3454 2 57 GLU H 2 58 THR H . . 5.500 4.579 4.541 4.627 . 0 0 "[ . 1 . 2]" 1
3455 2 57 GLU H 2 60 VAL H . . 5.500 4.672 4.494 5.043 . 0 0 "[ . 1 . 2]" 1
3456 2 57 GLU H 2 60 VAL HB . . 5.040 3.209 2.950 3.536 . 0 0 "[ . 1 . 2]" 1
3457 2 57 GLU H 2 60 VAL MG1 . . 5.500 3.590 3.399 3.930 . 0 0 "[ . 1 . 2]" 1
3458 2 57 GLU H 2 60 VAL MG2 . . 4.340 2.478 2.366 2.612 . 0 0 "[ . 1 . 2]" 1
3459 2 57 GLU HA 2 60 VAL MG2 . . 5.280 4.017 3.893 4.284 . 0 0 "[ . 1 . 2]" 1
3460 2 57 GLU HB2 2 58 THR H . . 4.900 3.976 3.873 4.252 . 0 0 "[ . 1 . 2]" 1
3461 2 57 GLU HB2 2 60 VAL MG2 . . 4.450 3.379 2.908 3.878 . 0 0 "[ . 1 . 2]" 1
3462 2 57 GLU HB3 2 58 THR H . . 4.990 3.881 3.728 3.977 . 0 0 "[ . 1 . 2]" 1
3463 2 57 GLU HB3 2 60 VAL H . . 5.500 4.254 3.819 4.754 . 0 0 "[ . 1 . 2]" 1
3464 2 57 GLU HB3 2 60 VAL MG1 . . 5.170 4.299 3.971 4.798 . 0 0 "[ . 1 . 2]" 1
3465 2 57 GLU HB3 2 60 VAL MG2 . . 3.990 2.073 1.821 2.546 . 0 0 "[ . 1 . 2]" 1
3466 2 57 GLU QG 2 58 THR H . . 4.290 2.664 2.434 3.137 . 0 0 "[ . 1 . 2]" 1
3467 2 57 GLU QG 2 60 VAL H . . 5.340 4.480 4.006 5.417 0.077 9 0 "[ . 1 . 2]" 1
3468 2 57 GLU QG 2 60 VAL MG2 . . 4.380 3.145 2.821 3.654 . 0 0 "[ . 1 . 2]" 1
3469 2 57 GLU HG2 2 58 THR H . . 5.090 3.830 3.181 4.107 . 0 0 "[ . 1 . 2]" 1
3470 2 57 GLU HG2 2 60 VAL MG2 . . 4.980 3.896 3.421 4.442 . 0 0 "[ . 1 . 2]" 1
3471 2 57 GLU HG3 2 58 THR H . . 5.090 2.876 2.462 4.383 . 0 0 "[ . 1 . 2]" 1
3472 2 57 GLU HG3 2 60 VAL MG2 . . 4.980 3.320 2.959 3.887 . 0 0 "[ . 1 . 2]" 1
3473 2 58 THR H 2 58 THR HB . . 3.790 2.801 2.460 3.598 . 0 0 "[ . 1 . 2]" 1
3474 2 58 THR H 2 58 THR MG . . 4.380 3.371 2.257 3.761 . 0 0 "[ . 1 . 2]" 1
3475 2 58 THR H 2 59 GLY H . . 5.500 4.477 4.440 4.564 . 0 0 "[ . 1 . 2]" 1
3476 2 58 THR H 2 60 VAL H . . 5.500 4.613 4.492 4.954 . 0 0 "[ . 1 . 2]" 1
3477 2 58 THR H 2 60 VAL MG2 . . 5.500 4.341 4.207 4.581 . 0 0 "[ . 1 . 2]" 1
3478 2 58 THR HA 2 60 VAL H . . 4.660 3.370 3.196 3.571 . 0 0 "[ . 1 . 2]" 1
3479 2 58 THR HB 2 59 GLY H . . 5.470 4.038 3.333 4.320 . 0 0 "[ . 1 . 2]" 1
3480 2 58 THR MG 2 59 GLY H . . 5.180 3.134 2.763 3.915 . 0 0 "[ . 1 . 2]" 1
3481 2 59 GLY H 2 60 VAL H . . 4.540 2.306 2.031 2.590 . 0 0 "[ . 1 . 2]" 1
3482 2 60 VAL H 2 60 VAL HB . . 3.810 2.512 2.456 2.616 . 0 0 "[ . 1 . 2]" 1
3483 2 60 VAL H 2 60 VAL MG1 . . 4.580 3.781 3.742 3.820 . 0 0 "[ . 1 . 2]" 1
3484 2 60 VAL H 2 60 VAL MG2 . . 3.580 2.296 2.129 2.661 . 0 0 "[ . 1 . 2]" 1
3485 2 60 VAL H 2 61 PRO HD2 . . 5.500 5.129 5.057 5.234 . 0 0 "[ . 1 . 2]" 1
3486 2 60 VAL H 2 61 PRO HD3 . . 5.500 4.364 4.203 4.504 . 0 0 "[ . 1 . 2]" 1
3487 2 60 VAL HA 2 61 PRO HD3 . . 3.730 2.014 1.950 2.064 . 0 0 "[ . 1 . 2]" 1
3488 2 60 VAL HA 2 61 PRO HG2 . . 4.860 4.379 4.342 4.424 . 0 0 "[ . 1 . 2]" 1
3489 2 60 VAL HA 2 61 PRO HG3 . . 4.860 4.191 4.122 4.252 . 0 0 "[ . 1 . 2]" 1
3490 2 60 VAL HB 2 61 PRO HD2 . . 5.290 4.666 4.511 4.778 . 0 0 "[ . 1 . 2]" 1
3491 2 60 VAL HB 2 61 PRO HD3 . . 5.500 4.822 4.767 4.868 . 0 0 "[ . 1 . 2]" 1
3492 2 60 VAL MG1 2 61 PRO HD2 . . 4.040 2.601 2.373 2.820 . 0 0 "[ . 1 . 2]" 1
3493 2 60 VAL MG1 2 61 PRO HD3 . . 4.330 3.524 3.420 3.636 . 0 0 "[ . 1 . 2]" 1
3494 2 60 VAL MG1 2 61 PRO HG2 . . 5.060 4.517 4.247 4.754 . 0 0 "[ . 1 . 2]" 1
3495 2 60 VAL MG1 2 61 PRO QG . . 4.370 4.168 3.965 4.338 . 0 0 "[ . 1 . 2]" 1
3496 2 60 VAL MG1 2 61 PRO HG3 . . 5.060 4.894 4.752 5.008 . 0 0 "[ . 1 . 2]" 1
3497 2 60 VAL MG1 2 64 PHE H . . 4.930 3.586 3.396 3.708 . 0 0 "[ . 1 . 2]" 1
3498 2 60 VAL MG1 2 64 PHE HB2 . . 4.720 2.413 2.183 2.603 . 0 0 "[ . 1 . 2]" 1
3499 2 60 VAL MG1 2 64 PHE HB3 . . 5.010 3.467 3.191 3.694 . 0 0 "[ . 1 . 2]" 1
3500 2 60 VAL MG1 2 64 PHE QD . . 3.530 2.318 2.119 2.572 . 0 0 "[ . 1 . 2]" 1
3501 2 60 VAL MG1 2 64 PHE QE . . 4.090 3.594 3.241 3.937 . 0 0 "[ . 1 . 2]" 1
3502 2 60 VAL MG1 2 65 SER H . . 5.500 5.478 4.976 5.569 0.069 16 0 "[ . 1 . 2]" 1
3503 2 60 VAL MG2 2 61 PRO HD2 . . 4.700 3.965 3.725 4.176 . 0 0 "[ . 1 . 2]" 1
3504 2 60 VAL MG2 2 61 PRO HD3 . . 4.820 4.020 3.928 4.165 . 0 0 "[ . 1 . 2]" 1
3505 2 61 PRO HA 2 62 SER H . . 3.550 2.227 2.142 2.310 . 0 0 "[ . 1 . 2]" 1
3506 2 61 PRO HA 2 63 ARG H . . 5.500 3.792 3.623 3.931 . 0 0 "[ . 1 . 2]" 1
3507 2 61 PRO HB2 2 63 ARG H . . 4.830 2.625 2.412 3.017 . 0 0 "[ . 1 . 2]" 1
3508 2 61 PRO HB2 2 64 PHE H . . 4.990 3.496 3.274 3.749 . 0 0 "[ . 1 . 2]" 1
3509 2 61 PRO HB2 2 64 PHE QD . . 5.030 2.816 2.450 3.150 . 0 0 "[ . 1 . 2]" 1
3510 2 61 PRO HB2 2 64 PHE QE . . 4.440 2.694 2.165 3.015 . 0 0 "[ . 1 . 2]" 1
3511 2 61 PRO HB2 2 64 PHE HZ . . 4.950 4.816 4.446 4.979 0.029 11 0 "[ . 1 . 2]" 1
3512 2 61 PRO HB3 2 62 SER H . . 4.670 3.197 2.980 3.308 . 0 0 "[ . 1 . 2]" 1
3513 2 61 PRO HB3 2 63 ARG H . . 5.500 3.263 3.074 3.419 . 0 0 "[ . 1 . 2]" 1
3514 2 61 PRO HB3 2 63 ARG HG3 . . 4.670 3.437 2.662 4.221 . 0 0 "[ . 1 . 2]" 1
3515 2 61 PRO HB3 2 64 PHE H . . 5.500 4.985 4.655 5.226 . 0 0 "[ . 1 . 2]" 1
3516 2 61 PRO HB3 2 64 PHE QE . . 5.210 4.092 3.609 4.414 . 0 0 "[ . 1 . 2]" 1
3517 2 61 PRO HD2 2 64 PHE H . . 5.500 4.755 4.430 5.105 . 0 0 "[ . 1 . 2]" 1
3518 2 61 PRO HD2 2 64 PHE QD . . 4.250 2.608 2.189 2.967 . 0 0 "[ . 1 . 2]" 1
3519 2 61 PRO HD2 2 64 PHE QE . . 4.740 2.201 1.993 2.424 . 0 0 "[ . 1 . 2]" 1
3520 2 61 PRO HD3 2 64 PHE QD . . 4.700 4.248 3.890 4.554 . 0 0 "[ . 1 . 2]" 1
3521 2 61 PRO HD3 2 64 PHE QE . . 5.040 3.708 3.546 3.906 . 0 0 "[ . 1 . 2]" 1
3522 2 61 PRO QG 2 62 SER H . . 5.030 4.545 4.430 4.600 . 0 0 "[ . 1 . 2]" 1
3523 2 61 PRO QG 2 64 PHE QD . . 4.330 3.737 3.507 4.143 . 0 0 "[ . 1 . 2]" 1
3524 2 61 PRO QG 2 64 PHE QE . . 4.360 2.296 2.128 2.746 . 0 0 "[ . 1 . 2]" 1
3525 2 62 SER H 2 63 ARG H . . 4.870 2.645 2.547 2.743 . 0 0 "[ . 1 . 2]" 1
3526 2 62 SER H 2 63 ARG HG3 . . 5.500 4.368 3.676 5.557 0.057 15 0 "[ . 1 . 2]" 1
3527 2 62 SER H 2 64 PHE H . . 5.500 4.559 4.430 4.680 . 0 0 "[ . 1 . 2]" 1
3528 2 62 SER HA 2 64 PHE H . . 5.280 3.669 3.484 3.790 . 0 0 "[ . 1 . 2]" 1
3529 2 62 SER QB 2 64 PHE H . . 5.340 4.783 4.697 4.865 . 0 0 "[ . 1 . 2]" 1
3530 2 62 SER HB2 2 63 ARG H . . 5.500 3.414 3.022 4.232 . 0 0 "[ . 1 . 2]" 1
3531 2 62 SER HB3 2 63 ARG H . . 5.500 4.151 3.287 4.304 . 0 0 "[ . 1 . 2]" 1
3532 2 63 ARG H 2 63 ARG QD . . 5.340 3.919 3.253 4.234 . 0 0 "[ . 1 . 2]" 1
3533 2 63 ARG H 2 63 ARG HG2 . . 5.160 3.083 2.072 3.671 . 0 0 "[ . 1 . 2]" 1
3534 2 63 ARG H 2 63 ARG HG3 . . 4.890 2.524 1.906 3.693 . 0 0 "[ . 1 . 2]" 1
3535 2 63 ARG H 2 64 PHE H . . 4.290 2.671 2.568 2.804 . 0 0 "[ . 1 . 2]" 1
3536 2 63 ARG HA 2 77 ILE MG . . 5.500 4.545 4.233 5.117 . 0 0 "[ . 1 . 2]" 1
3537 2 63 ARG HA 2 78 SER QB . . 5.470 2.476 2.114 3.644 . 0 0 "[ . 1 . 2]" 1
3538 2 63 ARG HA 2 79 SER H . . 5.500 3.823 3.075 4.367 . 0 0 "[ . 1 . 2]" 1
3539 2 63 ARG HB2 2 77 ILE MG . . 5.110 3.548 3.252 3.932 . 0 0 "[ . 1 . 2]" 1
3540 2 63 ARG HB2 2 78 SER H . . 5.160 4.567 4.163 4.713 . 0 0 "[ . 1 . 2]" 1
3541 2 63 ARG HB2 2 79 SER H . . 5.500 4.164 3.803 4.407 . 0 0 "[ . 1 . 2]" 1
3542 2 63 ARG HB2 2 81 GLN HG3 . . 5.490 4.988 3.979 5.542 0.052 16 0 "[ . 1 . 2]" 1
3543 2 63 ARG HB3 2 78 SER HA . . 5.420 5.355 4.685 5.507 0.087 8 0 "[ . 1 . 2]" 1
3544 2 63 ARG QD 2 77 ILE MG . . 4.830 3.938 3.434 4.256 . 0 0 "[ . 1 . 2]" 1
3545 2 63 ARG QD 2 79 SER HA . . 5.340 4.664 4.189 5.371 0.031 19 0 "[ . 1 . 2]" 1
3546 2 63 ARG QD 2 79 SER QB . . 4.920 2.312 1.888 4.116 . 0 0 "[ . 1 . 2]" 1
3547 2 63 ARG QD 2 81 GLN HG2 . . 4.760 3.066 2.263 4.227 . 0 0 "[ . 1 . 2]" 1
3548 2 63 ARG HD2 2 77 ILE MG . . 5.480 4.627 3.887 5.534 0.054 4 0 "[ . 1 . 2]" 1
3549 2 63 ARG HD2 2 81 GLN HG2 . . 5.500 3.547 2.322 4.823 . 0 0 "[ . 1 . 2]" 1
3550 2 63 ARG HD2 2 81 GLN HG3 . . 5.500 3.754 2.731 5.189 . 0 0 "[ . 1 . 2]" 1
3551 2 63 ARG HD3 2 77 ILE MG . . 5.480 4.590 3.600 5.558 0.078 1 0 "[ . 1 . 2]" 1
3552 2 63 ARG HD3 2 81 GLN HG2 . . 5.500 3.609 2.426 5.437 . 0 0 "[ . 1 . 2]" 1
3553 2 63 ARG HD3 2 81 GLN HG3 . . 5.500 3.968 2.640 5.534 0.034 12 0 "[ . 1 . 2]" 1
3554 2 63 ARG HG2 2 78 SER QB . . 5.500 3.888 2.181 4.978 . 0 0 "[ . 1 . 2]" 1
3555 2 64 PHE H 2 64 PHE HB2 . . 4.080 2.488 2.436 2.539 . 0 0 "[ . 1 . 2]" 1
3556 2 64 PHE H 2 64 PHE QD . . 4.410 2.349 2.030 2.575 . 0 0 "[ . 1 . 2]" 1
3557 2 64 PHE H 2 64 PHE HZ . . 5.500 5.620 5.582 5.663 0.163 17 0 "[ . 1 . 2]" 1
3558 2 64 PHE H 2 65 SER H . . 5.060 4.484 4.169 4.564 . 0 0 "[ . 1 . 2]" 1
3559 2 64 PHE H 2 77 ILE MG . . 5.500 4.547 4.289 4.766 . 0 0 "[ . 1 . 2]" 1
3560 2 64 PHE HA 2 64 PHE QD . . 4.160 2.770 2.538 2.970 . 0 0 "[ . 1 . 2]" 1
3561 2 64 PHE HA 2 77 ILE HA . . 4.510 2.500 2.261 2.717 . 0 0 "[ . 1 . 2]" 1
3562 2 64 PHE HA 2 77 ILE HB . . 5.500 5.333 5.127 5.511 0.011 9 0 "[ . 1 . 2]" 1
3563 2 64 PHE HA 2 77 ILE MG . . 5.500 3.530 3.277 3.762 . 0 0 "[ . 1 . 2]" 1
3564 2 64 PHE HA 2 78 SER H . . 5.410 3.519 3.244 3.862 . 0 0 "[ . 1 . 2]" 1
3565 2 64 PHE HB2 2 65 SER H . . 5.050 3.890 3.271 4.334 . 0 0 "[ . 1 . 2]" 1
3566 2 64 PHE HB3 2 65 SER H . . 4.680 2.949 2.322 3.771 . 0 0 "[ . 1 . 2]" 1
3567 2 64 PHE HB3 2 75 PHE HZ . . 4.680 3.511 2.921 3.952 . 0 0 "[ . 1 . 2]" 1
3568 2 64 PHE QD 2 65 SER H . . 4.690 4.008 3.641 4.446 . 0 0 "[ . 1 . 2]" 1
3569 2 64 PHE QD 2 75 PHE HZ . . 4.310 2.413 2.050 2.705 . 0 0 "[ . 1 . 2]" 1
3570 2 64 PHE QD 2 77 ILE HA . . 4.250 3.584 3.219 3.828 . 0 0 "[ . 1 . 2]" 1
3571 2 64 PHE QD 2 77 ILE MG . . 3.490 3.284 3.035 3.496 0.006 17 0 "[ . 1 . 2]" 1
3572 2 64 PHE QE 2 77 ILE HA . . 4.800 4.763 4.522 4.853 0.053 8 0 "[ . 1 . 2]" 1
3573 2 64 PHE QE 2 77 ILE MD . . 4.280 2.294 2.075 2.440 . 0 0 "[ . 1 . 2]" 1
3574 2 64 PHE QE 2 77 ILE HG12 . . 5.000 2.759 2.476 3.070 . 0 0 "[ . 1 . 2]" 1
3575 2 64 PHE QE 2 77 ILE HG13 . . 4.400 4.178 3.899 4.446 0.046 2 0 "[ . 1 . 2]" 1
3576 2 64 PHE QE 2 77 ILE MG . . 3.630 2.981 2.623 3.239 . 0 0 "[ . 1 . 2]" 1
3577 2 64 PHE QE 2 88 TYR HH . . 5.170 3.077 2.641 3.518 . 0 0 "[ . 1 . 2]" 1
3578 2 64 PHE HZ 2 77 ILE MG . . 4.420 3.927 3.632 4.173 . 0 0 "[ . 1 . 2]" 1
3579 2 64 PHE HZ 2 84 ASP HB2 . . 5.200 3.376 2.900 3.866 . 0 0 "[ . 1 . 2]" 1
3580 2 64 PHE HZ 2 84 ASP HB3 . . 5.250 2.857 1.977 3.683 . 0 0 "[ . 1 . 2]" 1
3581 2 64 PHE HZ 2 88 TYR HH . . 5.360 4.130 3.202 4.968 . 0 0 "[ . 1 . 2]" 1
3582 2 65 SER H 2 66 GLY H . . 5.200 3.992 1.957 4.411 . 0 0 "[ . 1 . 2]" 1
3583 2 65 SER H 2 75 PHE QE . . 4.600 4.359 3.880 4.637 0.037 2 0 "[ . 1 . 2]" 1
3584 2 65 SER H 2 75 PHE HZ . . 5.500 5.136 4.579 5.440 . 0 0 "[ . 1 . 2]" 1
3585 2 65 SER H 2 77 ILE HA . . 5.130 3.630 3.180 4.703 . 0 0 "[ . 1 . 2]" 1
3586 2 65 SER H 2 77 ILE HG12 . . 5.460 4.659 4.311 5.262 . 0 0 "[ . 1 . 2]" 1
3587 2 65 SER HA 2 66 GLY HA2 . . 5.500 4.497 4.320 5.373 . 0 0 "[ . 1 . 2]" 1
3588 2 65 SER QB 2 66 GLY H . . 3.770 2.841 2.411 3.172 . 0 0 "[ . 1 . 2]" 1
3589 2 65 SER QB 2 66 GLY HA2 . . 5.500 4.113 3.897 4.445 . 0 0 "[ . 1 . 2]" 1
3590 2 65 SER QB 2 67 SER H . . 4.950 4.390 3.330 5.003 0.053 18 0 "[ . 1 . 2]" 1
3591 2 65 SER QB 2 76 THR H . . 5.500 3.650 2.984 4.319 . 0 0 "[ . 1 . 2]" 1
3592 2 66 GLY H 2 67 SER H . . 5.190 3.684 2.698 4.318 . 0 0 "[ . 1 . 2]" 1
3593 2 66 GLY H 2 76 THR H . . 5.500 4.561 2.513 5.057 . 0 0 "[ . 1 . 2]" 1
3594 2 66 GLY HA2 2 75 PHE HA . . 4.610 2.163 1.836 2.742 . 0 0 "[ . 1 . 2]" 1
3595 2 66 GLY HA2 2 76 THR H . . 5.310 3.294 2.904 3.793 . 0 0 "[ . 1 . 2]" 1
3596 2 66 GLY HA3 2 75 PHE HA . . 4.610 3.465 2.925 4.292 . 0 0 "[ . 1 . 2]" 1
3597 2 67 SER H 2 68 GLY H . . 5.500 4.344 4.126 4.552 . 0 0 "[ . 1 . 2]" 1
3598 2 67 SER HB2 2 68 GLY H . . 4.400 3.572 2.836 4.114 . 0 0 "[ . 1 . 2]" 1
3599 2 67 SER HB3 2 68 GLY H . . 4.400 3.649 2.660 4.260 . 0 0 "[ . 1 . 2]" 1
3600 2 68 GLY H 2 69 SER H . . 5.130 4.312 4.219 4.373 . 0 0 "[ . 1 . 2]" 1
3601 2 68 GLY H 2 73 PHE HA . . 5.370 4.517 4.283 4.788 . 0 0 "[ . 1 . 2]" 1
3602 2 68 GLY QA 2 73 PHE H . . 5.340 4.467 4.229 4.647 . 0 0 "[ . 1 . 2]" 1
3603 2 68 GLY QA 2 73 PHE HA . . 4.240 1.919 1.788 2.189 . 0 0 "[ . 1 . 2]" 1
3604 2 68 GLY QA 2 73 PHE QD . . 5.340 2.675 1.952 3.680 . 0 0 "[ . 1 . 2]" 1
3605 2 68 GLY QA 2 74 THR H . . 5.180 2.898 2.572 3.164 . 0 0 "[ . 1 . 2]" 1
3606 2 68 GLY HA2 2 73 PHE HA . . 5.000 3.321 2.237 3.897 . 0 0 "[ . 1 . 2]" 1
3607 2 68 GLY HA3 2 73 PHE HA . . 5.000 1.936 1.842 2.200 . 0 0 "[ . 1 . 2]" 1
3608 2 69 SER H 2 70 GLY H . . 4.840 4.128 3.797 4.328 . 0 0 "[ . 1 . 2]" 1
3609 2 69 SER H 2 71 THR H . . 5.500 4.505 3.831 5.575 0.075 18 0 "[ . 1 . 2]" 1
3610 2 69 SER H 2 73 PHE HA . . 5.120 3.604 3.049 4.044 . 0 0 "[ . 1 . 2]" 1
3611 2 69 SER H 2 73 PHE QD . . 4.780 3.724 2.708 4.152 . 0 0 "[ . 1 . 2]" 1
3612 2 69 SER H 2 73 PHE QE . . 5.500 3.948 3.561 4.381 . 0 0 "[ . 1 . 2]" 1
3613 2 69 SER HA 2 73 PHE QD . . 4.300 3.635 2.560 4.113 . 0 0 "[ . 1 . 2]" 1
3614 2 69 SER HA 2 73 PHE QE . . 4.930 2.329 1.996 3.207 . 0 0 "[ . 1 . 2]" 1
3615 2 69 SER QB 2 70 GLY H . . 4.090 2.955 2.603 3.835 . 0 0 "[ . 1 . 2]" 1
3616 2 69 SER QB 2 70 GLY HA3 . . 5.350 3.995 3.772 4.648 . 0 0 "[ . 1 . 2]" 1
3617 2 69 SER QB 2 72 GLU H . . 5.500 5.484 5.230 5.640 0.140 8 0 "[ . 1 . 2]" 1
3618 2 69 SER QB 2 73 PHE QD . . 5.310 4.946 4.187 5.319 0.009 16 0 "[ . 1 . 2]" 1
3619 2 70 GLY H 2 71 THR H . . 5.230 3.953 3.262 4.218 . 0 0 "[ . 1 . 2]" 1
3620 2 70 GLY H 2 72 GLU H . . 5.500 4.939 4.126 5.478 . 0 0 "[ . 1 . 2]" 1
3621 2 70 GLY H 2 73 PHE QD . . 4.860 4.733 3.864 4.901 0.041 19 0 "[ . 1 . 2]" 1
3622 2 70 GLY H 2 73 PHE QE . . 4.750 2.935 1.946 3.295 . 0 0 "[ . 1 . 2]" 1
3623 2 70 GLY HA2 2 72 GLU H . . 5.150 5.090 4.014 5.612 0.462 16 0 "[ . 1 . 2]" 1
3624 2 70 GLY HA3 2 71 THR MG . . 5.500 3.589 3.423 3.909 . 0 0 "[ . 1 . 2]" 1
3625 2 70 GLY HA3 2 72 GLU H . . 5.480 4.229 3.769 4.559 . 0 0 "[ . 1 . 2]" 1
3626 2 71 THR H 2 71 THR MG . . 4.520 2.989 2.762 3.254 . 0 0 "[ . 1 . 2]" 1
3627 2 71 THR H 2 72 GLU H . . 3.580 2.218 1.931 3.111 . 0 0 "[ . 1 . 2]" 1
3628 2 71 THR HA 2 71 THR MG . . 3.350 2.278 2.189 2.383 . 0 0 "[ . 1 . 2]" 1
3629 2 71 THR HB 2 72 GLU H . . 4.990 3.908 3.449 4.284 . 0 0 "[ . 1 . 2]" 1
3630 2 71 THR MG 2 72 GLU H . . 5.060 4.232 4.023 4.386 . 0 0 "[ . 1 . 2]" 1
3631 2 72 GLU H 2 72 GLU HG2 . . 5.240 4.050 3.819 4.535 . 0 0 "[ . 1 . 2]" 1
3632 2 72 GLU H 2 72 GLU QG . . 4.570 3.013 2.675 4.138 . 0 0 "[ . 1 . 2]" 1
3633 2 72 GLU H 2 72 GLU HG3 . . 5.240 3.144 2.730 4.777 . 0 0 "[ . 1 . 2]" 1
3634 2 72 GLU H 2 73 PHE H . . 4.410 4.241 3.978 4.399 . 0 0 "[ . 1 . 2]" 1
3635 2 72 GLU HB2 2 73 PHE H . . 5.330 4.239 4.087 4.426 . 0 0 "[ . 1 . 2]" 1
3636 2 72 GLU HB3 2 73 PHE H . . 5.330 3.446 3.045 4.189 . 0 0 "[ . 1 . 2]" 1
3637 2 72 GLU HG2 2 73 PHE H . . 5.340 4.220 3.200 4.748 . 0 0 "[ . 1 . 2]" 1
3638 2 72 GLU HG3 2 73 PHE H . . 5.340 4.865 3.162 5.202 . 0 0 "[ . 1 . 2]" 1
3639 2 73 PHE HB2 2 74 THR H . . 5.310 4.040 3.857 4.151 . 0 0 "[ . 1 . 2]" 1
3640 2 73 PHE HB3 2 74 THR H . . 4.750 3.155 2.953 3.351 . 0 0 "[ . 1 . 2]" 1
3641 2 73 PHE QE 2 92 GLN HG2 . . 5.500 5.564 5.460 5.619 0.119 7 0 "[ . 1 . 2]" 1
3642 2 74 THR H 2 74 THR HB . . 4.100 2.735 2.559 3.744 . 0 0 "[ . 1 . 2]" 1
3643 2 74 THR HB 2 75 PHE HA . . 4.740 4.683 4.416 4.795 0.055 9 0 "[ . 1 . 2]" 1
3644 2 74 THR HB 2 76 THR H . . 5.500 5.504 5.158 5.569 0.069 15 0 "[ . 1 . 2]" 1
3645 2 74 THR MG 2 75 PHE H . . 3.940 2.794 2.446 3.357 . 0 0 "[ . 1 . 2]" 1
3646 2 75 PHE H 2 76 THR H . . 5.460 4.298 4.181 4.376 . 0 0 "[ . 1 . 2]" 1
3647 2 75 PHE HA 2 76 THR HB . . 4.360 4.412 4.393 4.433 0.073 6 0 "[ . 1 . 2]" 1
3648 2 75 PHE HB2 2 76 THR H . . 5.500 4.258 4.205 4.338 . 0 0 "[ . 1 . 2]" 1
3649 2 75 PHE HB3 2 76 THR H . . 5.440 4.232 4.167 4.300 . 0 0 "[ . 1 . 2]" 1
3650 2 75 PHE QE 2 76 THR H . . 5.290 4.772 4.624 4.942 . 0 0 "[ . 1 . 2]" 1
3651 2 75 PHE QE 2 77 ILE HG12 . . 4.620 2.976 2.676 3.206 . 0 0 "[ . 1 . 2]" 1
3652 2 75 PHE HZ 2 77 ILE MD . . 4.420 3.479 3.074 3.781 . 0 0 "[ . 1 . 2]" 1
3653 2 75 PHE HZ 2 77 ILE HG12 . . 3.970 3.359 3.057 3.731 . 0 0 "[ . 1 . 2]" 1
3654 2 75 PHE HZ 2 88 TYR HB3 . . 4.980 5.004 4.942 5.053 0.073 15 0 "[ . 1 . 2]" 1
3655 2 75 PHE HZ 2 88 TYR QD . . 4.460 3.426 3.207 3.873 . 0 0 "[ . 1 . 2]" 1
3656 2 76 THR H 2 76 THR HB . . 3.940 2.608 2.551 2.652 . 0 0 "[ . 1 . 2]" 1
3657 2 76 THR H 2 76 THR MG . . 4.670 3.833 3.791 3.858 . 0 0 "[ . 1 . 2]" 1
3658 2 76 THR H 2 77 ILE HA . . 4.640 4.705 4.685 4.730 0.090 18 0 "[ . 1 . 2]" 1
3659 2 76 THR HB 2 77 ILE H . . 5.500 4.196 4.068 4.293 . 0 0 "[ . 1 . 2]" 1
3660 2 76 THR MG 2 77 ILE H . . 3.590 2.758 2.590 2.896 . 0 0 "[ . 1 . 2]" 1
3661 2 76 THR MG 2 77 ILE HA . . 4.940 3.695 3.570 3.832 . 0 0 "[ . 1 . 2]" 1
3662 2 76 THR MG 2 78 SER H . . 4.700 3.545 3.370 3.703 . 0 0 "[ . 1 . 2]" 1
3663 2 76 THR MG 2 78 SER HA . . 4.210 3.079 2.869 3.361 . 0 0 "[ . 1 . 2]" 1
3664 2 76 THR MG 2 79 SER H . . 5.500 5.351 5.173 5.504 0.004 9 0 "[ . 1 . 2]" 1
3665 2 77 ILE H 2 77 ILE MD . . 4.820 3.965 3.857 4.076 . 0 0 "[ . 1 . 2]" 1
3666 2 77 ILE H 2 77 ILE HG12 . . 5.450 3.718 3.641 3.793 . 0 0 "[ . 1 . 2]" 1
3667 2 77 ILE H 2 77 ILE HG13 . . 4.850 2.607 2.479 2.711 . 0 0 "[ . 1 . 2]" 1
3668 2 77 ILE H 2 77 ILE MG . . 4.540 3.844 3.823 3.870 . 0 0 "[ . 1 . 2]" 1
3669 2 77 ILE H 2 78 SER H . . 5.450 4.257 4.161 4.357 . 0 0 "[ . 1 . 2]" 1
3670 2 77 ILE HA 2 77 ILE MD . . 4.780 3.917 3.875 3.953 . 0 0 "[ . 1 . 2]" 1
3671 2 77 ILE HB 2 80 LEU MD2 . . 3.190 2.993 2.761 3.238 0.048 4 0 "[ . 1 . 2]" 1
3672 2 77 ILE MD 2 78 SER H . . 5.500 5.348 5.279 5.415 . 0 0 "[ . 1 . 2]" 1
3673 2 77 ILE MD 2 79 SER H . . 5.330 5.283 5.121 5.370 0.040 10 0 "[ . 1 . 2]" 1
3674 2 77 ILE MD 2 80 LEU HA . . 5.500 3.245 2.990 3.448 . 0 0 "[ . 1 . 2]" 1
3675 2 77 ILE MD 2 80 LEU MD1 . . 3.370 3.490 3.442 3.576 0.206 16 0 "[ . 1 . 2]" 1
3676 2 77 ILE MD 2 84 ASP HA . . 5.500 5.473 4.946 5.725 0.225 5 0 "[ . 1 . 2]" 1
3677 2 77 ILE MD 2 84 ASP HB2 . . 5.050 3.988 3.439 4.651 . 0 0 "[ . 1 . 2]" 1
3678 2 77 ILE MD 2 84 ASP HB3 . . 4.890 3.455 2.917 3.826 . 0 0 "[ . 1 . 2]" 1
3679 2 77 ILE MD 2 88 TYR QD . . 4.910 4.013 3.683 4.273 . 0 0 "[ . 1 . 2]" 1
3680 2 77 ILE MD 2 88 TYR HH . . 4.930 2.999 2.467 3.350 . 0 0 "[ . 1 . 2]" 1
3681 2 77 ILE MD 2 106 LEU HB2 . . 5.500 4.590 4.181 5.178 . 0 0 "[ . 1 . 2]" 1
3682 2 77 ILE MG 2 78 SER H . . 4.150 2.970 2.903 3.040 . 0 0 "[ . 1 . 2]" 1
3683 2 77 ILE MG 2 78 SER HA . . 5.500 4.299 4.213 4.364 . 0 0 "[ . 1 . 2]" 1
3684 2 77 ILE MG 2 78 SER QB . . 5.500 4.072 3.890 4.659 . 0 0 "[ . 1 . 2]" 1
3685 2 77 ILE MG 2 79 SER H . . 3.930 2.259 2.063 2.428 . 0 0 "[ . 1 . 2]" 1
3686 2 77 ILE MG 2 79 SER HA . . 4.300 3.613 3.486 3.747 . 0 0 "[ . 1 . 2]" 1
3687 2 77 ILE MG 2 79 SER QB . . 5.500 4.015 3.836 4.384 . 0 0 "[ . 1 . 2]" 1
3688 2 77 ILE MG 2 80 LEU H . . 4.840 3.221 3.086 3.349 . 0 0 "[ . 1 . 2]" 1
3689 2 77 ILE MG 2 80 LEU HA . . 3.900 2.120 2.026 2.258 . 0 0 "[ . 1 . 2]" 1
3690 2 77 ILE MG 2 80 LEU HB2 . . 5.090 3.648 3.372 3.823 . 0 0 "[ . 1 . 2]" 1
3691 2 77 ILE MG 2 80 LEU HB3 . . 5.200 4.490 4.295 4.611 . 0 0 "[ . 1 . 2]" 1
3692 2 77 ILE MG 2 80 LEU HG . . 5.040 4.785 4.570 5.059 0.019 4 0 "[ . 1 . 2]" 1
3693 2 77 ILE MG 2 81 GLN H . . 4.550 3.470 3.093 3.632 . 0 0 "[ . 1 . 2]" 1
3694 2 77 ILE MG 2 81 GLN QE . . 5.340 4.779 3.981 5.319 . 0 0 "[ . 1 . 2]" 1
3695 2 77 ILE MG 2 84 ASP HB3 . . 5.350 4.400 3.648 4.845 . 0 0 "[ . 1 . 2]" 1
3696 2 78 SER H 2 79 SER H . . 4.490 2.703 2.573 2.835 . 0 0 "[ . 1 . 2]" 1
3697 2 78 SER QB 2 79 SER H . . 5.500 2.689 2.496 3.513 . 0 0 "[ . 1 . 2]" 1
3698 2 79 SER H 2 80 LEU H . . 4.980 3.873 3.810 3.958 . 0 0 "[ . 1 . 2]" 1
3699 2 79 SER HA 2 80 LEU H . . 3.470 2.109 2.053 2.212 . 0 0 "[ . 1 . 2]" 1
3700 2 79 SER QB 2 80 LEU H . . 4.490 3.620 3.353 3.896 . 0 0 "[ . 1 . 2]" 1
3701 2 79 SER QB 2 81 GLN HE21 . . 5.500 3.303 2.342 4.464 . 0 0 "[ . 1 . 2]" 1
3702 2 79 SER QB 2 81 GLN HE22 . . 5.500 3.799 2.972 5.242 . 0 0 "[ . 1 . 2]" 1
3703 2 80 LEU H 2 80 LEU HB2 . . 3.910 2.113 2.021 2.239 . 0 0 "[ . 1 . 2]" 1
3704 2 80 LEU H 2 80 LEU HB3 . . 4.070 2.804 2.728 2.888 . 0 0 "[ . 1 . 2]" 1
3705 2 80 LEU H 2 80 LEU MD1 . . 4.910 4.285 4.255 4.316 . 0 0 "[ . 1 . 2]" 1
3706 2 80 LEU H 2 80 LEU MD2 . . 4.990 3.615 3.483 3.801 . 0 0 "[ . 1 . 2]" 1
3707 2 80 LEU HA 2 80 LEU MD1 . . 4.050 2.506 2.390 2.626 . 0 0 "[ . 1 . 2]" 1
3708 2 80 LEU HA 2 81 GLN HG2 . . 5.060 3.934 3.649 4.138 . 0 0 "[ . 1 . 2]" 1
3709 2 80 LEU HA 2 84 ASP HB2 . . 5.500 4.333 3.542 5.510 0.010 5 0 "[ . 1 . 2]" 1
3710 2 80 LEU HB2 2 80 LEU MD1 . . 3.360 3.214 3.206 3.226 . 0 0 "[ . 1 . 2]" 1
3711 2 80 LEU HB2 2 81 GLN H . . 5.500 4.431 4.334 4.573 . 0 0 "[ . 1 . 2]" 1
3712 2 80 LEU HB3 2 80 LEU MD2 . . 3.290 3.147 3.124 3.161 . 0 0 "[ . 1 . 2]" 1
3713 2 80 LEU HB3 2 81 GLN H . . 5.070 3.888 3.752 4.066 . 0 0 "[ . 1 . 2]" 1
3714 2 80 LEU HB3 2 108 ILE MD . . 4.380 4.293 3.563 4.457 0.077 19 0 "[ . 1 . 2]" 1
3715 2 80 LEU MD1 2 81 GLN H . . 4.170 2.054 1.873 2.354 . 0 0 "[ . 1 . 2]" 1
3716 2 80 LEU MD1 2 84 ASP H . . 4.940 3.842 3.591 4.270 . 0 0 "[ . 1 . 2]" 1
3717 2 80 LEU MD1 2 84 ASP HB2 . . 4.110 3.124 2.475 4.120 0.010 5 0 "[ . 1 . 2]" 1
3718 2 80 LEU MD1 2 84 ASP HB3 . . 4.200 4.013 3.494 4.269 0.069 8 0 "[ . 1 . 2]" 1
3719 2 80 LEU MD1 2 88 TYR HH . . 5.500 4.774 3.829 5.485 . 0 0 "[ . 1 . 2]" 1
3720 2 80 LEU MD2 2 81 GLN H . . 4.470 3.278 2.946 3.490 . 0 0 "[ . 1 . 2]" 1
3721 2 80 LEU MD2 2 84 ASP HB2 . . 5.500 4.100 3.238 4.958 . 0 0 "[ . 1 . 2]" 1
3722 2 80 LEU MD2 2 85 LEU HA . . 5.500 4.346 3.938 4.705 . 0 0 "[ . 1 . 2]" 1
3723 2 80 LEU MD2 2 88 TYR HH . . 5.500 4.443 3.574 5.300 . 0 0 "[ . 1 . 2]" 1
3724 2 80 LEU MD2 2 106 LEU HB3 . . 4.880 4.686 4.010 4.887 0.007 3 0 "[ . 1 . 2]" 1
3725 2 80 LEU HG 2 81 GLN H . . 5.310 4.690 4.518 4.962 . 0 0 "[ . 1 . 2]" 1
3726 2 81 GLN H 2 81 GLN HE21 . . 5.500 3.854 3.380 4.684 . 0 0 "[ . 1 . 2]" 1
3727 2 81 GLN H 2 81 GLN HE22 . . 5.500 5.351 4.952 5.544 0.044 16 0 "[ . 1 . 2]" 1
3728 2 81 GLN H 2 81 GLN HG2 . . 5.200 2.927 2.600 3.134 . 0 0 "[ . 1 . 2]" 1
3729 2 81 GLN H 2 81 GLN HG3 . . 5.020 4.143 3.955 4.267 . 0 0 "[ . 1 . 2]" 1
3730 2 81 GLN H 2 82 PRO HD3 . . 5.500 4.904 4.704 5.159 . 0 0 "[ . 1 . 2]" 1
3731 2 81 GLN H 2 83 GLU H . . 5.500 5.243 4.869 5.518 0.018 20 0 "[ . 1 . 2]" 1
3732 2 81 GLN H 2 84 ASP H . . 5.230 4.001 3.624 4.316 . 0 0 "[ . 1 . 2]" 1
3733 2 81 GLN H 2 84 ASP HB2 . . 4.830 2.747 2.334 3.689 . 0 0 "[ . 1 . 2]" 1
3734 2 81 GLN H 2 84 ASP HB3 . . 5.500 4.072 3.635 4.618 . 0 0 "[ . 1 . 2]" 1
3735 2 81 GLN H 2 108 ILE MD . . 5.500 4.569 4.178 4.946 . 0 0 "[ . 1 . 2]" 1
3736 2 81 GLN HA 2 81 GLN HE21 . . 5.500 2.620 2.164 4.200 . 0 0 "[ . 1 . 2]" 1
3737 2 81 GLN HA 2 81 GLN QE . . 4.710 2.511 2.123 3.699 . 0 0 "[ . 1 . 2]" 1
3738 2 81 GLN HA 2 81 GLN HE22 . . 5.500 3.346 3.077 4.108 . 0 0 "[ . 1 . 2]" 1
3739 2 81 GLN HA 2 82 PRO HG2 . . 5.500 4.607 4.379 4.740 . 0 0 "[ . 1 . 2]" 1
3740 2 81 GLN HA 2 82 PRO HG3 . . 5.440 4.355 4.029 4.720 . 0 0 "[ . 1 . 2]" 1
3741 2 81 GLN HA 2 83 GLU H . . 5.500 4.497 4.180 4.862 . 0 0 "[ . 1 . 2]" 1
3742 2 81 GLN HB2 2 82 PRO HD2 . . 4.410 3.790 3.491 4.188 . 0 0 "[ . 1 . 2]" 1
3743 2 81 GLN HB2 2 82 PRO HD3 . . 4.670 4.537 4.202 4.787 0.117 8 0 "[ . 1 . 2]" 1
3744 2 81 GLN HB2 2 83 GLU H . . 5.500 3.845 3.486 4.240 . 0 0 "[ . 1 . 2]" 1
3745 2 81 GLN HB3 2 81 GLN HE22 . . 5.500 4.373 4.268 4.739 . 0 0 "[ . 1 . 2]" 1
3746 2 81 GLN HB3 2 82 PRO HD2 . . 5.050 2.258 1.967 2.656 . 0 0 "[ . 1 . 2]" 1
3747 2 81 GLN HB3 2 82 PRO HD3 . . 5.080 3.317 2.867 3.810 . 0 0 "[ . 1 . 2]" 1
3748 2 81 GLN HB3 2 83 GLU H . . 5.260 3.266 2.870 3.635 . 0 0 "[ . 1 . 2]" 1
3749 2 81 GLN HB3 2 84 ASP H . . 5.250 3.999 3.683 4.407 . 0 0 "[ . 1 . 2]" 1
3750 2 81 GLN HG3 2 82 PRO HD2 . . 5.260 4.499 4.060 4.911 . 0 0 "[ . 1 . 2]" 1
3751 2 82 PRO HA 2 84 ASP H . . 5.430 3.940 3.795 4.137 . 0 0 "[ . 1 . 2]" 1
3752 2 82 PRO HA 2 85 LEU H . . 5.500 4.323 3.786 4.811 . 0 0 "[ . 1 . 2]" 1
3753 2 82 PRO HA 2 108 ILE HB . . 5.500 5.202 4.828 5.575 0.075 8 0 "[ . 1 . 2]" 1
3754 2 82 PRO HA 2 108 ILE MD . . 3.900 2.118 1.898 2.504 . 0 0 "[ . 1 . 2]" 1
3755 2 82 PRO HA 2 108 ILE HG13 . . 5.390 4.363 3.082 4.879 . 0 0 "[ . 1 . 2]" 1
3756 2 82 PRO HA 2 108 ILE MG . . 5.060 4.192 3.823 4.553 . 0 0 "[ . 1 . 2]" 1
3757 2 82 PRO HD2 2 83 GLU H . . 4.780 2.941 2.682 3.303 . 0 0 "[ . 1 . 2]" 1
3758 2 82 PRO HD3 2 83 GLU H . . 5.370 4.097 3.943 4.256 . 0 0 "[ . 1 . 2]" 1
3759 2 82 PRO HG2 2 108 ILE MD . . 5.300 5.118 4.534 5.410 0.110 8 0 "[ . 1 . 2]" 1
3760 2 82 PRO HG3 2 83 GLU H . . 5.290 4.319 3.950 4.642 . 0 0 "[ . 1 . 2]" 1
3761 2 83 GLU H 2 83 GLU QG . . 3.740 2.259 1.854 2.916 . 0 0 "[ . 1 . 2]" 1
3762 2 83 GLU H 2 84 ASP H . . 4.370 2.539 2.360 2.790 . 0 0 "[ . 1 . 2]" 1
3763 2 83 GLU H 2 85 LEU H . . 5.500 4.384 4.122 4.628 . 0 0 "[ . 1 . 2]" 1
3764 2 83 GLU HA 2 85 LEU H . . 5.100 3.606 3.142 4.091 . 0 0 "[ . 1 . 2]" 1
3765 2 83 GLU HA 2 85 LEU QB . . 5.340 4.316 3.678 4.962 . 0 0 "[ . 1 . 2]" 1
3766 2 83 GLU QB 2 85 LEU H . . 5.340 4.637 4.325 5.068 . 0 0 "[ . 1 . 2]" 1
3767 2 83 GLU HB2 2 84 ASP H . . 5.500 3.593 2.903 4.384 . 0 0 "[ . 1 . 2]" 1
3768 2 83 GLU HB3 2 84 ASP H . . 5.500 4.206 3.936 4.569 . 0 0 "[ . 1 . 2]" 1
3769 2 83 GLU HG2 2 84 ASP H . . 5.340 4.590 3.057 5.218 . 0 0 "[ . 1 . 2]" 1
3770 2 83 GLU HG3 2 84 ASP H . . 5.340 4.245 2.832 5.506 0.166 7 0 "[ . 1 . 2]" 1
3771 2 84 ASP H 2 84 ASP HB2 . . 4.150 2.461 2.370 2.629 . 0 0 "[ . 1 . 2]" 1
3772 2 84 ASP H 2 85 LEU H . . 3.890 2.496 2.278 2.651 . 0 0 "[ . 1 . 2]" 1
3773 2 84 ASP H 2 85 LEU QB . . 5.040 4.097 3.967 4.245 . 0 0 "[ . 1 . 2]" 1
3774 2 84 ASP H 2 88 TYR HH . . 5.500 5.368 5.075 5.538 0.038 16 0 "[ . 1 . 2]" 1
3775 2 84 ASP H 2 108 ILE MD . . 5.060 4.232 3.797 4.704 . 0 0 "[ . 1 . 2]" 1
3776 2 84 ASP HB2 2 85 LEU H . . 5.290 3.810 3.100 4.160 . 0 0 "[ . 1 . 2]" 1
3777 2 84 ASP HB2 2 88 TYR HH . . 4.990 3.736 3.261 4.217 . 0 0 "[ . 1 . 2]" 1
3778 2 84 ASP HB2 2 108 ILE MD . . 5.500 5.017 4.457 5.542 0.042 5 0 "[ . 1 . 2]" 1
3779 2 84 ASP HB3 2 85 LEU H . . 5.380 4.269 3.837 4.412 . 0 0 "[ . 1 . 2]" 1
3780 2 84 ASP HB3 2 88 TYR HH . . 5.070 2.243 1.804 2.940 . 0 0 "[ . 1 . 2]" 1
3781 2 85 LEU H 2 85 LEU QB . . 3.360 2.204 2.159 2.235 . 0 0 "[ . 1 . 2]" 1
3782 2 85 LEU H 2 85 LEU MD1 . . 5.110 4.174 4.030 4.233 . 0 0 "[ . 1 . 2]" 1
3783 2 85 LEU H 2 85 LEU QD . . 4.470 3.731 3.675 3.773 . 0 0 "[ . 1 . 2]" 1
3784 2 85 LEU H 2 85 LEU MD2 . . 5.110 4.203 4.097 4.268 . 0 0 "[ . 1 . 2]" 1
3785 2 85 LEU H 2 85 LEU HG . . 4.490 4.479 4.356 4.524 0.034 4 0 "[ . 1 . 2]" 1
3786 2 85 LEU H 2 86 ALA H . . 5.070 4.512 4.471 4.607 . 0 0 "[ . 1 . 2]" 1
3787 2 85 LEU H 2 88 TYR HH . . 5.500 5.096 4.243 5.537 0.037 6 0 "[ . 1 . 2]" 1
3788 2 85 LEU H 2 108 ILE MD . . 4.480 3.808 3.230 4.484 0.004 8 0 "[ . 1 . 2]" 1
3789 2 85 LEU H 2 108 ILE HG13 . . 5.500 4.997 4.358 5.517 0.017 14 0 "[ . 1 . 2]" 1
3790 2 85 LEU HA 2 85 LEU MD1 . . 4.410 3.403 2.084 3.921 . 0 0 "[ . 1 . 2]" 1
3791 2 85 LEU HA 2 85 LEU MD2 . . 4.410 3.177 2.228 3.913 . 0 0 "[ . 1 . 2]" 1
3792 2 85 LEU HA 2 86 ALA H . . 3.470 2.211 2.151 2.292 . 0 0 "[ . 1 . 2]" 1
3793 2 85 LEU HA 2 88 TYR QE . . 4.490 3.785 3.256 4.247 . 0 0 "[ . 1 . 2]" 1
3794 2 85 LEU HA 2 106 LEU HB2 . . 5.310 5.110 3.668 5.384 0.074 19 0 "[ . 1 . 2]" 1
3795 2 85 LEU HA 2 106 LEU HB3 . . 5.010 3.688 2.764 3.949 . 0 0 "[ . 1 . 2]" 1
3796 2 85 LEU HA 2 106 LEU QD . . 4.100 2.351 1.930 3.938 . 0 0 "[ . 1 . 2]" 1
3797 2 85 LEU QB 2 108 ILE MD . . 4.140 2.534 2.086 3.521 . 0 0 "[ . 1 . 2]" 1
3798 2 85 LEU QD 2 86 ALA H . . 4.040 2.553 2.288 2.748 . 0 0 "[ . 1 . 2]" 1
3799 2 85 LEU QD 2 106 LEU HB3 . . 5.440 3.668 2.348 4.389 . 0 0 "[ . 1 . 2]" 1
3800 2 85 LEU QD 2 107 GLU HA . . 4.110 2.294 1.941 2.622 . 0 0 "[ . 1 . 2]" 1
3801 2 85 LEU QD 2 107 GLU HB2 . . 5.420 4.454 4.174 4.840 . 0 0 "[ . 1 . 2]" 1
3802 2 85 LEU QD 2 107 GLU HB3 . . 5.200 3.659 3.161 4.151 . 0 0 "[ . 1 . 2]" 1
3803 2 85 LEU QD 2 107 GLU QG . . 4.770 3.438 2.783 4.172 . 0 0 "[ . 1 . 2]" 1
3804 2 85 LEU QD 2 108 ILE H . . 3.870 2.346 2.097 2.790 . 0 0 "[ . 1 . 2]" 1
3805 2 85 LEU MD1 2 107 GLU QG . . 5.460 4.149 3.375 5.031 . 0 0 "[ . 1 . 2]" 1
3806 2 85 LEU MD1 2 108 ILE H . . 4.660 2.535 2.111 4.517 . 0 0 "[ . 1 . 2]" 1
3807 2 85 LEU MD2 2 107 GLU QG . . 5.460 3.870 2.907 5.468 0.008 1 0 "[ . 1 . 2]" 1
3808 2 85 LEU MD2 2 108 ILE H . . 4.660 3.553 2.236 4.416 . 0 0 "[ . 1 . 2]" 1
3809 2 85 LEU HG 2 86 ALA H . . 5.270 3.635 2.758 5.056 . 0 0 "[ . 1 . 2]" 1
3810 2 85 LEU HG 2 107 GLU HA . . 4.580 2.986 2.010 4.527 . 0 0 "[ . 1 . 2]" 1
3811 2 85 LEU HG 2 108 ILE MD . . 5.410 4.093 3.400 5.107 . 0 0 "[ . 1 . 2]" 1
3812 2 86 ALA H 2 88 TYR QE . . 4.990 3.108 2.509 3.836 . 0 0 "[ . 1 . 2]" 1
3813 2 86 ALA H 2 88 TYR HH . . 5.500 4.610 3.599 5.321 . 0 0 "[ . 1 . 2]" 1
3814 2 86 ALA H 2 106 LEU H . . 4.800 4.022 3.676 4.469 . 0 0 "[ . 1 . 2]" 1
3815 2 86 ALA H 2 106 LEU HB2 . . 4.630 4.086 2.539 4.559 . 0 0 "[ . 1 . 2]" 1
3816 2 86 ALA H 2 106 LEU HB3 . . 4.380 2.546 2.217 3.059 . 0 0 "[ . 1 . 2]" 1
3817 2 86 ALA H 2 106 LEU QD . . 4.400 2.635 2.092 3.863 . 0 0 "[ . 1 . 2]" 1
3818 2 86 ALA H 2 106 LEU HG . . 4.620 3.990 3.674 4.662 0.042 10 0 "[ . 1 . 2]" 1
3819 2 86 ALA MB 2 87 THR H . . 3.230 2.196 2.047 2.371 . 0 0 "[ . 1 . 2]" 1
3820 2 86 ALA MB 2 87 THR HA . . 4.990 4.105 4.042 4.177 . 0 0 "[ . 1 . 2]" 1
3821 2 86 ALA MB 2 88 TYR HH . . 4.070 3.692 3.271 4.084 0.014 12 0 "[ . 1 . 2]" 1
3822 2 87 THR H 2 87 THR HB . . 4.160 2.468 2.375 2.558 . 0 0 "[ . 1 . 2]" 1
3823 2 87 THR H 2 88 TYR H . . 5.500 4.450 4.362 4.561 . 0 0 "[ . 1 . 2]" 1
3824 2 87 THR H 2 105 LYS QD . . 5.340 4.775 4.210 5.456 0.116 5 0 "[ . 1 . 2]" 1
3825 2 87 THR H 2 106 LEU H . . 5.500 4.861 4.600 5.299 . 0 0 "[ . 1 . 2]" 1
3826 2 87 THR HA 2 88 TYR QD . . 5.180 3.871 3.441 4.469 . 0 0 "[ . 1 . 2]" 1
3827 2 87 THR HA 2 105 LYS HA . . 3.950 2.518 2.161 2.943 . 0 0 "[ . 1 . 2]" 1
3828 2 87 THR HA 2 105 LYS QD . . 5.340 3.172 2.598 4.267 . 0 0 "[ . 1 . 2]" 1
3829 2 87 THR HA 2 105 LYS HG2 . . 5.500 4.860 3.163 5.634 0.134 15 0 "[ . 1 . 2]" 1
3830 2 87 THR HA 2 105 LYS HG3 . . 5.480 4.599 2.613 5.508 0.028 7 0 "[ . 1 . 2]" 1
3831 2 87 THR HA 2 106 LEU H . . 4.000 2.713 2.310 3.008 . 0 0 "[ . 1 . 2]" 1
3832 2 87 THR HB 2 88 TYR H . . 5.500 4.197 4.003 4.319 . 0 0 "[ . 1 . 2]" 1
3833 2 87 THR HB 2 89 TYR QE . . 4.020 3.625 3.135 4.043 0.023 8 0 "[ . 1 . 2]" 1
3834 2 87 THR MG 2 88 TYR H . . 4.050 2.836 2.525 3.069 . 0 0 "[ . 1 . 2]" 1
3835 2 87 THR MG 2 89 TYR QD . . 5.500 2.532 2.065 3.853 . 0 0 "[ . 1 . 2]" 1
3836 2 87 THR MG 2 89 TYR QE . . 3.730 3.286 2.730 3.755 0.025 6 0 "[ . 1 . 2]" 1
3837 2 87 THR MG 2 104 THR H . . 4.240 3.935 3.343 4.281 0.041 1 0 "[ . 1 . 2]" 1
3838 2 87 THR MG 2 104 THR MG . . 4.920 4.663 4.333 4.936 0.016 18 0 "[ . 1 . 2]" 1
3839 2 87 THR MG 2 105 LYS H . . 5.360 4.538 4.217 5.026 . 0 0 "[ . 1 . 2]" 1
3840 2 87 THR MG 2 105 LYS HA . . 4.530 2.695 2.202 3.044 . 0 0 "[ . 1 . 2]" 1
3841 2 87 THR MG 2 105 LYS HB2 . . 5.190 3.626 2.511 4.810 . 0 0 "[ . 1 . 2]" 1
3842 2 87 THR MG 2 105 LYS HB3 . . 5.500 4.733 4.052 5.101 . 0 0 "[ . 1 . 2]" 1
3843 2 87 THR MG 2 105 LYS QD . . 5.060 3.126 2.033 4.540 . 0 0 "[ . 1 . 2]" 1
3844 2 87 THR MG 2 105 LYS HG2 . . 5.500 4.235 2.495 5.115 . 0 0 "[ . 1 . 2]" 1
3845 2 87 THR MG 2 105 LYS HG3 . . 5.500 4.351 3.044 4.962 . 0 0 "[ . 1 . 2]" 1
3846 2 87 THR MG 2 106 LEU H . . 5.230 4.159 3.727 4.460 . 0 0 "[ . 1 . 2]" 1
3847 2 88 TYR H 2 88 TYR QD . . 4.040 2.886 2.536 3.226 . 0 0 "[ . 1 . 2]" 1
3848 2 88 TYR H 2 89 TYR H . . 5.490 4.436 4.341 4.551 . 0 0 "[ . 1 . 2]" 1
3849 2 88 TYR H 2 104 THR H . . 4.850 4.823 4.375 4.916 0.066 19 0 "[ . 1 . 2]" 1
3850 2 88 TYR H 2 104 THR HB . . 4.840 3.790 3.458 4.119 . 0 0 "[ . 1 . 2]" 1
3851 2 88 TYR H 2 104 THR MG . . 4.700 3.739 3.366 4.117 . 0 0 "[ . 1 . 2]" 1
3852 2 88 TYR H 2 105 LYS HA . . 4.790 3.343 2.800 3.563 . 0 0 "[ . 1 . 2]" 1
3853 2 88 TYR HA 2 89 TYR HA . . 5.140 4.294 4.230 4.456 . 0 0 "[ . 1 . 2]" 1
3854 2 88 TYR HA 2 89 TYR QD . . 4.160 4.162 3.864 4.252 0.092 2 0 "[ . 1 . 2]" 1
3855 2 88 TYR HB2 2 89 TYR H . . 5.430 4.007 3.882 4.163 . 0 0 "[ . 1 . 2]" 1
3856 2 88 TYR HB2 2 104 THR HB . . 5.080 3.474 3.093 3.687 . 0 0 "[ . 1 . 2]" 1
3857 2 88 TYR HB2 2 104 THR MG . . 4.730 3.449 3.181 3.801 . 0 0 "[ . 1 . 2]" 1
3858 2 88 TYR HB3 2 89 TYR H . . 4.370 2.868 2.746 3.082 . 0 0 "[ . 1 . 2]" 1
3859 2 88 TYR HB3 2 104 THR HB . . 5.230 4.576 4.332 4.937 . 0 0 "[ . 1 . 2]" 1
3860 2 88 TYR HB3 2 104 THR MG . . 5.110 4.721 4.385 5.119 0.009 5 0 "[ . 1 . 2]" 1
3861 2 88 TYR QD 2 88 TYR HH . . 4.440 4.296 4.248 4.353 . 0 0 "[ . 1 . 2]" 1
3862 2 88 TYR QD 2 104 THR HB . . 5.010 5.010 4.398 5.139 0.129 17 0 "[ . 1 . 2]" 1
3863 2 88 TYR QD 2 106 LEU H . . 5.500 3.769 3.423 4.626 . 0 0 "[ . 1 . 2]" 1
3864 2 88 TYR QD 2 106 LEU HB2 . . 4.390 2.450 2.148 3.485 . 0 0 "[ . 1 . 2]" 1
3865 2 88 TYR QD 2 106 LEU HB3 . . 4.450 2.927 2.272 4.643 0.193 7 0 "[ . 1 . 2]" 1
3866 2 88 TYR QD 2 106 LEU MD1 . . 3.960 3.999 3.822 4.050 0.090 8 0 "[ . 1 . 2]" 1
3867 2 88 TYR QD 2 106 LEU QD . . 3.450 3.046 1.771 3.554 0.104 2 0 "[ . 1 . 2]" 1
3868 2 88 TYR QD 2 106 LEU MD2 . . 3.960 3.235 1.773 4.014 0.054 12 0 "[ . 1 . 2]" 1
3869 2 88 TYR QD 2 106 LEU HG . . 4.950 4.302 2.954 5.034 0.084 5 0 "[ . 1 . 2]" 1
3870 2 88 TYR QE 2 106 LEU HB2 . . 4.120 3.253 2.536 3.841 . 0 0 "[ . 1 . 2]" 1
3871 2 88 TYR QE 2 106 LEU QD . . 3.480 2.101 1.714 2.603 . 0 0 "[ . 1 . 2]" 1
3872 2 88 TYR HH 2 106 LEU QD . . 4.360 3.575 2.809 4.599 0.239 7 0 "[ . 1 . 2]" 1
3873 2 89 TYR H 2 89 TYR QD . . 4.600 3.530 3.269 3.636 . 0 0 "[ . 1 . 2]" 1
3874 2 89 TYR H 2 90 CYS H . . 5.500 4.301 4.263 4.344 . 0 0 "[ . 1 . 2]" 1
3875 2 89 TYR HA 2 103 GLY H . . 5.500 4.902 4.213 5.598 0.098 7 0 "[ . 1 . 2]" 1
3876 2 89 TYR HA 2 104 THR H . . 5.500 4.610 4.450 4.838 . 0 0 "[ . 1 . 2]" 1
3877 2 89 TYR HA 2 104 THR HB . . 5.260 4.352 4.022 4.820 . 0 0 "[ . 1 . 2]" 1
3878 2 89 TYR QB 2 90 CYS H . . 4.460 2.107 1.989 2.525 . 0 0 "[ . 1 . 2]" 1
3879 2 89 TYR QB 2 101 GLY H . . 5.340 2.725 2.207 3.135 . 0 0 "[ . 1 . 2]" 1
3880 2 89 TYR QB 2 102 GLN QE . . 5.180 5.190 4.898 5.347 0.167 15 0 "[ . 1 . 2]" 1
3881 2 89 TYR HB2 2 90 CYS H . . 5.130 2.223 2.005 3.629 . 0 0 "[ . 1 . 2]" 1
3882 2 89 TYR HB3 2 90 CYS H . . 5.130 3.292 2.414 3.513 . 0 0 "[ . 1 . 2]" 1
3883 2 89 TYR QD 2 100 PHE HB3 . . 3.630 2.756 2.308 3.648 0.018 7 0 "[ . 1 . 2]" 1
3884 2 89 TYR QD 2 101 GLY H . . 5.220 3.868 3.163 4.492 . 0 0 "[ . 1 . 2]" 1
3885 2 90 CYS H 2 91 GLN H . . 5.500 4.364 4.305 4.437 . 0 0 "[ . 1 . 2]" 1
3886 2 90 CYS H 2 100 PHE HB3 . . 5.500 4.113 3.632 4.622 . 0 0 "[ . 1 . 2]" 1
3887 2 90 CYS H 2 101 GLY H . . 5.080 2.437 2.036 2.819 . 0 0 "[ . 1 . 2]" 1
3888 2 90 CYS H 2 101 GLY QA . . 5.500 2.934 2.433 3.455 . 0 0 "[ . 1 . 2]" 1
3889 2 90 CYS HB2 2 91 GLN H . . 4.850 3.068 2.759 3.275 . 0 0 "[ . 1 . 2]" 1
3890 2 90 CYS HB3 2 91 GLN H . . 5.040 4.069 3.982 4.180 . 0 0 "[ . 1 . 2]" 1
3891 2 91 GLN H 2 91 GLN QE . . 5.460 5.261 4.271 5.567 0.107 15 0 "[ . 1 . 2]" 1
3892 2 91 GLN H 2 91 GLN HG2 . . 5.080 4.103 2.823 4.712 . 0 0 "[ . 1 . 2]" 1
3893 2 91 GLN H 2 91 GLN HG3 . . 5.250 3.633 2.871 4.305 . 0 0 "[ . 1 . 2]" 1
3894 2 91 GLN H 2 92 GLN H . . 5.500 4.268 4.169 4.350 . 0 0 "[ . 1 . 2]" 1
3895 2 91 GLN HA 2 100 PHE HA . . 4.560 2.610 2.316 2.910 . 0 0 "[ . 1 . 2]" 1
3896 2 91 GLN HA 2 100 PHE HB3 . . 5.410 4.692 4.416 5.128 . 0 0 "[ . 1 . 2]" 1
3897 2 91 GLN HA 2 101 GLY H . . 5.500 3.739 3.304 3.996 . 0 0 "[ . 1 . 2]" 1
3898 2 91 GLN HB2 2 92 GLN H . . 5.210 3.702 3.072 4.389 . 0 0 "[ . 1 . 2]" 1
3899 2 91 GLN HB2 2 98 TYR HB3 . . 5.500 4.667 3.277 5.609 0.109 16 0 "[ . 1 . 2]" 1
3900 2 91 GLN HB3 2 92 GLN H . . 4.690 4.246 4.123 4.465 . 0 0 "[ . 1 . 2]" 1
3901 2 91 GLN QE 2 93 TYR H . . 5.500 5.039 3.974 5.636 0.136 5 0 "[ . 1 . 2]" 1
3902 2 91 GLN QE 2 93 TYR HB3 . . 4.900 3.626 2.269 4.958 0.058 20 0 "[ . 1 . 2]" 1
3903 2 91 GLN QE 2 98 TYR HB2 . . 5.500 2.722 2.067 3.415 . 0 0 "[ . 1 . 2]" 1
3904 2 91 GLN QE 2 98 TYR HB3 . . 5.480 1.958 1.574 2.821 . 0 0 "[ . 1 . 2]" 1
3905 2 91 GLN QE 2 99 THR H . . 5.500 3.922 1.986 5.271 . 0 0 "[ . 1 . 2]" 1
3906 2 91 GLN HG2 2 92 GLN H . . 5.340 4.824 4.543 5.110 . 0 0 "[ . 1 . 2]" 1
3907 2 91 GLN HG2 2 100 PHE QE . . 5.500 2.963 2.453 4.136 . 0 0 "[ . 1 . 2]" 1
3908 2 91 GLN HG3 2 93 TYR H . . 5.500 5.077 4.320 5.584 0.084 1 0 "[ . 1 . 2]" 1
3909 2 91 GLN HG3 2 100 PHE QD . . 4.580 4.620 4.323 4.739 0.159 15 0 "[ . 1 . 2]" 1
3910 2 92 GLN H 2 92 GLN HE22 . . 5.500 4.670 4.363 4.921 . 0 0 "[ . 1 . 2]" 1
3911 2 92 GLN H 2 92 GLN HG2 . . 4.830 3.755 3.667 3.863 . 0 0 "[ . 1 . 2]" 1
3912 2 92 GLN H 2 92 GLN HG3 . . 4.610 2.277 2.157 2.412 . 0 0 "[ . 1 . 2]" 1
3913 2 92 GLN H 2 93 TYR H . . 5.500 4.512 4.464 4.580 . 0 0 "[ . 1 . 2]" 1
3914 2 92 GLN H 2 99 THR H . . 5.090 3.329 3.119 3.550 . 0 0 "[ . 1 . 2]" 1
3915 2 92 GLN HA 2 92 GLN HE21 . . 5.500 5.093 4.998 5.445 . 0 0 "[ . 1 . 2]" 1
3916 2 92 GLN HA 2 92 GLN HE22 . . 5.500 5.591 5.544 5.715 0.215 4 0 "[ . 1 . 2]" 1
3917 2 92 GLN HA 2 93 TYR QD . . 5.500 3.116 2.825 3.384 . 0 0 "[ . 1 . 2]" 1
3918 2 92 GLN HA 2 94 ASP H . . 5.360 3.994 3.796 4.176 . 0 0 "[ . 1 . 2]" 1
3919 2 92 GLN HB2 2 93 TYR H . . 4.850 2.735 2.614 3.017 . 0 0 "[ . 1 . 2]" 1
3920 2 92 GLN HB2 2 94 ASP H . . 5.500 2.681 2.505 2.928 . 0 0 "[ . 1 . 2]" 1
3921 2 92 GLN HB3 2 93 TYR H . . 5.500 3.682 3.570 3.898 . 0 0 "[ . 1 . 2]" 1
3922 2 92 GLN HB3 2 94 ASP H . . 5.500 4.353 4.180 4.615 . 0 0 "[ . 1 . 2]" 1
3923 2 92 GLN HE21 2 95 ASN H . . 4.970 3.216 2.766 4.772 . 0 0 "[ . 1 . 2]" 1
3924 2 92 GLN HE21 2 98 TYR HA . . 5.370 3.836 2.126 4.420 . 0 0 "[ . 1 . 2]" 1
3925 2 92 GLN HE21 2 99 THR MG . . 5.500 5.169 3.361 5.556 0.056 13 0 "[ . 1 . 2]" 1
3926 2 92 GLN HE22 2 95 ASN H . . 5.500 3.130 2.664 3.854 . 0 0 "[ . 1 . 2]" 1
3927 2 92 GLN HE22 2 99 THR H . . 4.430 3.588 2.982 4.034 . 0 0 "[ . 1 . 2]" 1
3928 2 92 GLN HE22 2 99 THR MG . . 4.800 4.458 3.890 4.793 . 0 0 "[ . 1 . 2]" 1
3929 2 92 GLN HG3 2 99 THR H . . 4.850 3.619 3.096 3.995 . 0 0 "[ . 1 . 2]" 1
3930 2 93 TYR H 2 93 TYR QD . . 3.920 2.487 2.238 2.756 . 0 0 "[ . 1 . 2]" 1
3931 2 93 TYR H 2 94 ASP H . . 4.410 2.384 2.223 2.554 . 0 0 "[ . 1 . 2]" 1
3932 2 93 TYR H 2 95 ASN H . . 5.500 4.803 4.633 4.972 . 0 0 "[ . 1 . 2]" 1
3933 2 93 TYR HA 2 93 TYR QD . . 4.240 3.747 3.722 3.780 . 0 0 "[ . 1 . 2]" 1
3934 2 93 TYR HA 2 98 TYR QD . . 3.770 2.929 2.498 3.203 . 0 0 "[ . 1 . 2]" 1
3935 2 93 TYR HA 2 98 TYR QE . . 4.240 2.811 2.541 3.052 . 0 0 "[ . 1 . 2]" 1
3936 2 93 TYR HB2 2 98 TYR QE . . 4.360 3.679 3.424 3.943 . 0 0 "[ . 1 . 2]" 1
3937 2 93 TYR HB3 2 94 ASP H . . 5.500 4.561 4.502 4.616 . 0 0 "[ . 1 . 2]" 1
3938 2 93 TYR HB3 2 98 TYR QD . . 4.370 4.399 4.254 4.471 0.101 6 0 "[ . 1 . 2]" 1
3939 2 93 TYR QD 2 94 ASP H . . 4.430 4.391 4.276 4.465 0.035 7 0 "[ . 1 . 2]" 1
3940 2 94 ASP H 2 95 ASN H . . 3.950 2.508 2.299 2.661 . 0 0 "[ . 1 . 2]" 1
3941 2 94 ASP H 2 98 TYR QD . . 5.500 3.960 3.577 4.378 . 0 0 "[ . 1 . 2]" 1
3942 2 94 ASP H 2 98 TYR QE . . 5.500 3.523 3.312 3.759 . 0 0 "[ . 1 . 2]" 1
3943 2 94 ASP QB 2 95 ASN HA . . 5.320 4.569 4.471 4.634 . 0 0 "[ . 1 . 2]" 1
3944 2 95 ASN H 2 95 ASN HB3 . . 4.010 2.824 2.660 3.001 . 0 0 "[ . 1 . 2]" 1
3945 2 95 ASN H 2 98 TYR QD . . 4.530 3.327 3.107 3.613 . 0 0 "[ . 1 . 2]" 1
3946 2 95 ASN H 2 98 TYR QE . . 4.780 2.595 2.267 2.811 . 0 0 "[ . 1 . 2]" 1
3947 2 95 ASN HA 2 96 LEU HA . . 5.500 4.360 4.299 4.393 . 0 0 "[ . 1 . 2]" 1
3948 2 95 ASN HA 2 96 LEU HB2 . . 5.500 4.465 4.366 4.566 . 0 0 "[ . 1 . 2]" 1
3949 2 95 ASN HB2 2 96 LEU H . . 4.270 4.057 3.992 4.212 . 0 0 "[ . 1 . 2]" 1
3950 2 95 ASN HB3 2 96 LEU H . . 4.060 3.926 3.659 4.071 0.011 1 0 "[ . 1 . 2]" 1
3951 2 95 ASN HD21 2 96 LEU H . . 5.500 4.521 3.591 5.175 . 0 0 "[ . 1 . 2]" 1
3952 2 95 ASN HD22 2 96 LEU H . . 5.460 4.312 3.831 4.873 . 0 0 "[ . 1 . 2]" 1
3953 2 96 LEU H 2 96 LEU HB2 . . 4.000 2.348 2.322 2.405 . 0 0 "[ . 1 . 2]" 1
3954 2 96 LEU H 2 96 LEU MD1 . . 4.630 3.620 3.513 3.737 . 0 0 "[ . 1 . 2]" 1
3955 2 96 LEU H 2 96 LEU MD2 . . 4.770 3.791 3.636 3.925 . 0 0 "[ . 1 . 2]" 1
3956 2 96 LEU H 2 96 LEU HG . . 4.290 2.704 2.551 2.873 . 0 0 "[ . 1 . 2]" 1
3957 2 96 LEU H 2 97 PRO HA . . 5.500 4.781 4.682 4.898 . 0 0 "[ . 1 . 2]" 1
3958 2 96 LEU H 2 98 TYR QE . . 5.450 3.676 3.440 3.922 . 0 0 "[ . 1 . 2]" 1
3959 2 96 LEU HA 2 96 LEU MD2 . . 3.950 2.117 2.085 2.149 . 0 0 "[ . 1 . 2]" 1
3960 2 96 LEU HA 2 98 TYR H . . 4.630 3.118 2.966 3.216 . 0 0 "[ . 1 . 2]" 1
3961 2 96 LEU HA 2 98 TYR QD . . 3.960 3.197 2.889 3.446 . 0 0 "[ . 1 . 2]" 1
3962 2 96 LEU HB2 2 97 PRO HA . . 5.110 3.872 3.764 3.989 . 0 0 "[ . 1 . 2]" 1
3963 2 96 LEU HB3 2 97 PRO HA . . 4.870 2.395 2.250 2.532 . 0 0 "[ . 1 . 2]" 1
3964 2 96 LEU HB3 2 97 PRO QB . . 5.500 3.744 3.551 3.938 . 0 0 "[ . 1 . 2]" 1
3965 2 96 LEU MD1 2 97 PRO HA . . 5.460 4.111 3.917 4.312 . 0 0 "[ . 1 . 2]" 1
3966 2 96 LEU MD2 2 97 PRO HA . . 4.320 2.448 2.290 2.707 . 0 0 "[ . 1 . 2]" 1
3967 2 96 LEU MD2 2 97 PRO QB . . 5.500 3.785 3.592 4.066 . 0 0 "[ . 1 . 2]" 1
3968 2 96 LEU MD2 2 98 TYR H . . 4.140 2.728 2.417 3.085 . 0 0 "[ . 1 . 2]" 1
3969 2 96 LEU MD2 2 98 TYR HA . . 5.500 4.273 4.049 4.478 . 0 0 "[ . 1 . 2]" 1
3970 2 96 LEU MD2 2 98 TYR QD . . 4.200 2.985 2.853 3.139 . 0 0 "[ . 1 . 2]" 1
3971 2 96 LEU MD2 2 98 TYR QE . . 4.360 2.734 2.631 2.805 . 0 0 "[ . 1 . 2]" 1
3972 2 96 LEU HG 2 97 PRO HA . . 5.500 4.355 4.222 4.573 . 0 0 "[ . 1 . 2]" 1
3973 2 96 LEU HG 2 98 TYR QE . . 4.380 3.386 3.022 3.720 . 0 0 "[ . 1 . 2]" 1
3974 2 97 PRO QB 2 99 THR MG . . 4.940 3.299 2.870 3.731 . 0 0 "[ . 1 . 2]" 1
3975 2 97 PRO QG 2 99 THR MG . . 3.950 3.139 2.514 4.021 0.071 9 0 "[ . 1 . 2]" 1
3976 2 98 TYR H 2 98 TYR QD . . 4.130 3.323 3.252 3.389 . 0 0 "[ . 1 . 2]" 1
3977 2 98 TYR HA 2 98 TYR QD . . 3.440 2.127 2.027 2.256 . 0 0 "[ . 1 . 2]" 1
3978 2 98 TYR HB2 2 99 THR H . . 5.500 4.012 3.750 4.185 . 0 0 "[ . 1 . 2]" 1
3979 2 98 TYR HB3 2 99 THR H . . 5.300 3.064 2.626 3.367 . 0 0 "[ . 1 . 2]" 1
3980 2 98 TYR QD 2 99 THR H . . 4.950 4.017 3.842 4.197 . 0 0 "[ . 1 . 2]" 1
3981 2 99 THR H 2 99 THR MG . . 4.410 2.820 2.633 3.197 . 0 0 "[ . 1 . 2]" 1
3982 2 99 THR H 2 100 PHE H . . 5.440 4.402 4.258 4.470 . 0 0 "[ . 1 . 2]" 1
3983 2 99 THR HA 2 99 THR MG . . 3.730 2.427 2.261 2.525 . 0 0 "[ . 1 . 2]" 1
3984 2 99 THR HB 2 100 PHE H . . 4.470 2.937 2.688 3.159 . 0 0 "[ . 1 . 2]" 1
3985 2 99 THR MG 2 100 PHE H . . 4.470 3.949 3.701 4.201 . 0 0 "[ . 1 . 2]" 1
3986 2 100 PHE H 2 100 PHE QD . . 4.110 2.459 2.293 2.759 . 0 0 "[ . 1 . 2]" 1
3987 2 100 PHE H 2 100 PHE QE . . 4.190 4.311 4.262 4.403 0.213 9 0 "[ . 1 . 2]" 1
3988 2 100 PHE HB2 2 101 GLY H . . 5.180 3.845 3.593 4.005 . 0 0 "[ . 1 . 2]" 1
3989 2 100 PHE HB3 2 101 GLY H . . 4.880 2.915 2.548 3.111 . 0 0 "[ . 1 . 2]" 1
3990 2 101 GLY H 2 102 GLN H . . 5.360 4.182 3.897 4.773 . 0 0 "[ . 1 . 2]" 1
3991 2 101 GLY QA 2 103 GLY H . . 5.010 3.290 3.085 3.984 . 0 0 "[ . 1 . 2]" 1
3992 2 102 GLN H 2 102 GLN QE . . 5.340 2.152 1.743 2.544 . 0 0 "[ . 1 . 2]" 1
3993 2 102 GLN H 2 102 GLN QG . . 4.330 2.832 1.886 3.605 . 0 0 "[ . 1 . 2]" 1
3994 2 102 GLN H 2 103 GLY H . . 4.460 2.591 1.566 3.152 . 0 0 "[ . 1 . 2]" 1
3995 2 102 GLN HA 2 102 GLN QE . . 5.340 4.005 3.138 4.128 . 0 0 "[ . 1 . 2]" 1
3996 2 102 GLN QG 2 103 GLY H . . 5.290 4.020 3.693 4.576 . 0 0 "[ . 1 . 2]" 1
3997 2 103 GLY H 2 104 THR H . . 5.230 2.763 2.388 3.043 . 0 0 "[ . 1 . 2]" 1
3998 2 104 THR H 2 104 THR HB . . 4.010 2.772 2.599 2.914 . 0 0 "[ . 1 . 2]" 1
3999 2 104 THR H 2 105 LYS H . . 5.470 4.280 4.131 4.454 . 0 0 "[ . 1 . 2]" 1
4000 2 104 THR HA 2 104 THR MG . . 3.460 2.335 2.267 2.394 . 0 0 "[ . 1 . 2]" 1
4001 2 104 THR HB 2 105 LYS H . . 5.500 4.129 3.958 4.208 . 0 0 "[ . 1 . 2]" 1
4002 2 104 THR MG 2 105 LYS H . . 4.060 2.626 2.305 2.800 . 0 0 "[ . 1 . 2]" 1
4003 2 105 LYS H 2 105 LYS HB2 . . 4.160 2.833 2.278 3.243 . 0 0 "[ . 1 . 2]" 1
4004 2 105 LYS H 2 105 LYS HB3 . . 4.120 2.753 2.465 3.617 . 0 0 "[ . 1 . 2]" 1
4005 2 105 LYS H 2 105 LYS QD . . 5.340 4.264 2.705 4.876 . 0 0 "[ . 1 . 2]" 1
4006 2 105 LYS H 2 105 LYS HG2 . . 5.500 4.646 4.352 4.843 . 0 0 "[ . 1 . 2]" 1
4007 2 105 LYS H 2 105 LYS HG3 . . 5.120 4.563 4.316 4.960 . 0 0 "[ . 1 . 2]" 1
4008 2 105 LYS H 2 106 LEU H . . 5.050 4.344 4.123 4.425 . 0 0 "[ . 1 . 2]" 1
4009 2 105 LYS HA 2 105 LYS QD . . 4.520 2.468 2.077 3.921 . 0 0 "[ . 1 . 2]" 1
4010 2 105 LYS HA 2 105 LYS QE . . 5.340 3.655 2.847 4.577 . 0 0 "[ . 1 . 2]" 1
4011 2 105 LYS HA 2 106 LEU HB2 . . 5.500 4.435 4.052 4.595 . 0 0 "[ . 1 . 2]" 1
4012 2 105 LYS HA 2 106 LEU HB3 . . 5.400 4.608 4.379 5.463 0.063 7 0 "[ . 1 . 2]" 1
4013 2 105 LYS HB2 2 105 LYS QD . . 3.170 2.906 2.383 3.369 0.199 4 0 "[ . 1 . 2]" 1
4014 2 105 LYS HB3 2 105 LYS QD . . 3.490 3.112 2.341 3.516 0.026 9 0 "[ . 1 . 2]" 1
4015 2 105 LYS HB3 2 105 LYS QE . . 4.640 3.663 2.002 4.489 . 0 0 "[ . 1 . 2]" 1
4016 2 105 LYS HB3 2 106 LEU H . . 5.090 3.991 3.131 4.259 . 0 0 "[ . 1 . 2]" 1
4017 2 105 LYS HB3 2 106 LEU HA . . 5.400 4.752 4.266 5.072 . 0 0 "[ . 1 . 2]" 1
4018 2 105 LYS QE 2 105 LYS HG2 . . 3.720 2.489 2.245 3.506 . 0 0 "[ . 1 . 2]" 1
4019 2 105 LYS QE 2 105 LYS HG3 . . 3.620 2.959 2.289 3.535 . 0 0 "[ . 1 . 2]" 1
4020 2 105 LYS HG2 2 106 LEU H . . 4.990 4.246 2.899 5.028 0.038 5 0 "[ . 1 . 2]" 1
4021 2 105 LYS HG2 2 107 GLU QG . . 4.950 4.134 2.952 5.013 0.063 7 0 "[ . 1 . 2]" 1
4022 2 105 LYS HG3 2 106 LEU H . . 5.430 3.629 2.678 5.082 . 0 0 "[ . 1 . 2]" 1
4023 2 106 LEU H 2 106 LEU HB3 . . 4.180 2.507 2.325 3.403 . 0 0 "[ . 1 . 2]" 1
4024 2 106 LEU H 2 106 LEU QD . . 4.400 3.711 2.864 3.847 . 0 0 "[ . 1 . 2]" 1
4025 2 106 LEU H 2 106 LEU HG . . 5.200 4.496 4.240 4.811 . 0 0 "[ . 1 . 2]" 1
4026 2 106 LEU H 2 107 GLU H . . 5.160 4.414 4.237 4.518 . 0 0 "[ . 1 . 2]" 1
4027 2 106 LEU HA 2 106 LEU QD . . 3.700 2.085 1.914 2.178 . 0 0 "[ . 1 . 2]" 1
4028 2 106 LEU HA 2 107 GLU H . . 3.470 2.129 1.980 2.259 . 0 0 "[ . 1 . 2]" 1
4029 2 106 LEU HA 2 107 GLU HB2 . . 5.200 4.414 4.176 4.665 . 0 0 "[ . 1 . 2]" 1
4030 2 106 LEU HA 2 107 GLU QG . . 5.500 3.702 3.438 3.918 . 0 0 "[ . 1 . 2]" 1
4031 2 106 LEU HB2 2 107 GLU H . . 4.860 4.161 4.035 4.308 . 0 0 "[ . 1 . 2]" 1
4032 2 106 LEU HB3 2 107 GLU H . . 4.930 4.009 3.220 4.204 . 0 0 "[ . 1 . 2]" 1
4033 2 106 LEU QD 2 107 GLU H . . 3.890 2.302 1.906 2.558 . 0 0 "[ . 1 . 2]" 1
4034 2 106 LEU HG 2 107 GLU H . . 5.160 3.404 2.500 4.835 . 0 0 "[ . 1 . 2]" 1
4035 2 107 GLU H 2 107 GLU QG . . 4.210 2.986 2.837 3.206 . 0 0 "[ . 1 . 2]" 1
4036 2 107 GLU H 2 108 ILE H . . 5.460 4.388 4.307 4.460 . 0 0 "[ . 1 . 2]" 1
4037 2 107 GLU HA 2 108 ILE HB . . 5.040 4.604 4.478 4.966 . 0 0 "[ . 1 . 2]" 1
4038 2 107 GLU HB2 2 108 ILE H . . 4.280 3.705 3.400 3.972 . 0 0 "[ . 1 . 2]" 1
4039 2 107 GLU HB3 2 108 ILE H . . 4.590 2.587 2.220 2.960 . 0 0 "[ . 1 . 2]" 1
4040 2 107 GLU HB3 2 109 LYS H . . 5.290 5.337 5.207 5.422 0.132 19 0 "[ . 1 . 2]" 1
4041 2 107 GLU QG 2 108 ILE H . . 4.650 4.097 3.814 4.495 . 0 0 "[ . 1 . 2]" 1
4042 2 108 ILE H 2 108 ILE HB . . 3.650 2.501 2.352 2.654 . 0 0 "[ . 1 . 2]" 1
4043 2 108 ILE H 2 108 ILE MD . . 4.590 4.081 3.635 4.295 . 0 0 "[ . 1 . 2]" 1
4044 2 108 ILE H 2 108 ILE HG12 . . 4.730 3.940 2.553 4.334 . 0 0 "[ . 1 . 2]" 1
4045 2 108 ILE H 2 108 ILE HG13 . . 4.540 3.260 2.982 3.942 . 0 0 "[ . 1 . 2]" 1
4046 2 108 ILE H 2 108 ILE MG . . 4.460 3.752 3.686 3.831 . 0 0 "[ . 1 . 2]" 1
4047 2 108 ILE H 2 109 LYS H . . 4.960 4.375 4.265 4.499 . 0 0 "[ . 1 . 2]" 1
4048 2 108 ILE HA 2 109 LYS H . . 3.500 2.093 1.962 2.231 . 0 0 "[ . 1 . 2]" 1
4049 2 108 ILE HA 2 109 LYS QG . . 5.180 3.862 3.401 5.029 . 0 0 "[ . 1 . 2]" 1
4050 2 108 ILE HB 2 108 ILE MD . . 3.510 2.576 2.415 3.249 . 0 0 "[ . 1 . 2]" 1
4051 2 108 ILE HB 2 109 LYS H . . 4.820 4.246 4.078 4.349 . 0 0 "[ . 1 . 2]" 1
4052 2 108 ILE MD 2 108 ILE MG . . 2.460 1.943 1.910 1.982 . 0 0 "[ . 1 . 2]" 1
4053 2 108 ILE HG12 2 108 ILE MG . . 3.570 2.513 2.281 3.194 . 0 0 "[ . 1 . 2]" 1
4054 2 108 ILE HG12 2 109 LYS H . . 5.340 4.058 3.626 5.003 . 0 0 "[ . 1 . 2]" 1
4055 2 108 ILE HG13 2 108 ILE MG . . 3.620 3.104 2.401 3.244 . 0 0 "[ . 1 . 2]" 1
4056 2 108 ILE MG 2 109 LYS H . . 4.190 2.666 2.320 2.860 . 0 0 "[ . 1 . 2]" 1
4057 2 108 ILE MG 2 110 ARG H . . 5.260 4.150 3.445 4.934 . 0 0 "[ . 1 . 2]" 1
4058 2 108 ILE MG 2 110 ARG HA . . 5.300 3.982 3.014 5.263 . 0 0 "[ . 1 . 2]" 1
4059 2 109 LYS H 2 109 LYS HB2 . . 3.870 2.563 2.414 2.732 . 0 0 "[ . 1 . 2]" 1
4060 2 109 LYS H 2 109 LYS HB3 . . 4.030 3.647 3.567 3.709 . 0 0 "[ . 1 . 2]" 1
4061 2 109 LYS H 2 109 LYS QD . . 5.290 3.843 2.162 4.249 . 0 0 "[ . 1 . 2]" 1
4062 2 109 LYS H 2 109 LYS QG . . 4.210 2.397 2.133 3.431 . 0 0 "[ . 1 . 2]" 1
4063 2 109 LYS H 2 110 ARG H . . 5.500 4.431 4.222 4.610 . 0 0 "[ . 1 . 2]" 1
4064 2 109 LYS HA 2 109 LYS QD . . 4.030 3.990 3.218 4.144 0.114 17 0 "[ . 1 . 2]" 1
4065 2 109 LYS HA 2 109 LYS QG . . 3.970 2.492 2.341 2.613 . 0 0 "[ . 1 . 2]" 1
4066 2 109 LYS HA 2 110 ARG H . . 3.120 2.133 2.057 2.271 . 0 0 "[ . 1 . 2]" 1
4067 2 109 LYS HB2 2 109 LYS QD . . 2.400 2.356 2.204 2.568 0.168 4 0 "[ . 1 . 2]" 1
4068 2 109 LYS HB2 2 110 ARG H . . 5.060 4.147 3.763 4.360 . 0 0 "[ . 1 . 2]" 1
4069 2 109 LYS HB3 2 109 LYS QD . . 3.100 2.432 2.231 3.211 0.111 7 0 "[ . 1 . 2]" 1
4070 2 109 LYS HB3 2 110 ARG H . . 4.000 3.274 2.647 3.651 . 0 0 "[ . 1 . 2]" 1
4071 2 109 LYS QD 2 110 ARG H . . 5.500 5.220 4.549 5.512 0.012 20 0 "[ . 1 . 2]" 1
4072 2 109 LYS QG 2 110 ARG H . . 4.590 4.168 3.784 4.409 . 0 0 "[ . 1 . 2]" 1
4073 2 110 ARG H 2 110 ARG QD . . 5.500 4.348 2.213 5.439 . 0 0 "[ . 1 . 2]" 1
4074 2 110 ARG H 2 110 ARG QG . . 4.330 3.655 2.312 4.362 0.032 20 0 "[ . 1 . 2]" 1
4075 2 110 ARG HA 2 110 ARG QD . . 4.840 3.471 1.989 4.281 . 0 0 "[ . 1 . 2]" 1
4076 2 110 ARG HA 2 110 ARG QG . . 4.010 2.649 2.446 3.340 . 0 0 "[ . 1 . 2]" 1
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