NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
397653 |
1sym   |
4001 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1sym
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 2420
_Distance_constraint_stats_list.Viol_count 3160
_Distance_constraint_stats_list.Viol_total 2847.600
_Distance_constraint_stats_list.Viol_max 0.252
_Distance_constraint_stats_list.Viol_rms 0.0143
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0029
_Distance_constraint_stats_list.Viol_average_violations_only 0.0451
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 GLU 2.290 0.192 6 0 "[ . 1 . 2]"
1 4 LEU 2.872 0.233 19 0 "[ . 1 . 2]"
1 5 GLU 2.775 0.171 9 0 "[ . 1 . 2]"
1 6 LYS 0.894 0.086 20 0 "[ . 1 . 2]"
1 7 ALA 0.297 0.094 9 0 "[ . 1 . 2]"
1 8 MET 4.501 0.245 2 0 "[ . 1 . 2]"
1 9 VAL 2.500 0.125 14 0 "[ . 1 . 2]"
1 10 ALA 1.056 0.094 9 0 "[ . 1 . 2]"
1 11 LEU 1.378 0.196 16 0 "[ . 1 . 2]"
1 12 ILE 0.457 0.170 20 0 "[ . 1 . 2]"
1 13 ASP 1.730 0.079 13 0 "[ . 1 . 2]"
1 14 VAL 3.710 0.189 6 0 "[ . 1 . 2]"
1 15 PHE 0.374 0.101 8 0 "[ . 1 . 2]"
1 16 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 GLN 0.341 0.052 2 0 "[ . 1 . 2]"
1 18 TYR 0.377 0.080 2 0 "[ . 1 . 2]"
1 19 SER 0.107 0.049 2 0 "[ . 1 . 2]"
1 20 GLY 0.652 0.082 4 0 "[ . 1 . 2]"
1 21 ARG 0.657 0.080 2 0 "[ . 1 . 2]"
1 22 GLU 0.818 0.082 10 0 "[ . 1 . 2]"
1 23 GLY 0.475 0.074 1 0 "[ . 1 . 2]"
1 24 ASP 1.385 0.183 19 0 "[ . 1 . 2]"
1 25 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 HIS 0.463 0.109 17 0 "[ . 1 . 2]"
1 27 LYS 0.523 0.062 13 0 "[ . 1 . 2]"
1 28 LEU 0.447 0.049 2 0 "[ . 1 . 2]"
1 29 LYS 0.703 0.127 11 0 "[ . 1 . 2]"
1 30 LYS 0.614 0.123 1 0 "[ . 1 . 2]"
1 31 SER 1.923 0.120 13 0 "[ . 1 . 2]"
1 32 GLU 3.066 0.126 9 0 "[ . 1 . 2]"
1 33 LEU 0.707 0.086 3 0 "[ . 1 . 2]"
1 34 LYS 2.679 0.110 4 0 "[ . 1 . 2]"
1 35 GLU 6.799 0.137 11 0 "[ . 1 . 2]"
1 36 LEU 5.344 0.206 19 0 "[ . 1 . 2]"
1 37 ILE 2.874 0.219 6 0 "[ . 1 . 2]"
1 38 ASN 1.081 0.110 4 0 "[ . 1 . 2]"
1 39 ASN 1.241 0.185 9 0 "[ . 1 . 2]"
1 40 GLU 0.361 0.105 2 0 "[ . 1 . 2]"
1 41 LEU 1.980 0.185 9 0 "[ . 1 . 2]"
1 42 SER 0.188 0.066 14 0 "[ . 1 . 2]"
1 43 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 PHE 0.083 0.035 15 0 "[ . 1 . 2]"
1 45 LEU 0.374 0.252 12 0 "[ . 1 . 2]"
1 46 GLU 1.003 0.076 14 0 "[ . 1 . 2]"
1 47 GLU 0.826 0.076 14 0 "[ . 1 . 2]"
1 48 ILE 0.711 0.252 12 0 "[ . 1 . 2]"
1 49 LYS 0.060 0.060 16 0 "[ . 1 . 2]"
1 50 GLU 0.250 0.060 16 0 "[ . 1 . 2]"
1 51 GLN 0.193 0.040 16 0 "[ . 1 . 2]"
1 52 GLU 0.435 0.052 13 0 "[ . 1 . 2]"
1 53 VAL 1.033 0.084 11 0 "[ . 1 . 2]"
1 54 VAL 2.721 0.126 16 0 "[ . 1 . 2]"
1 55 ASP 0.817 0.079 16 0 "[ . 1 . 2]"
1 56 LYS 1.691 0.088 16 0 "[ . 1 . 2]"
1 57 VAL 6.626 0.147 16 0 "[ . 1 . 2]"
1 58 MET 3.803 0.118 6 0 "[ . 1 . 2]"
1 59 GLU 2.652 0.118 6 0 "[ . 1 . 2]"
1 60 THR 1.454 0.147 16 0 "[ . 1 . 2]"
1 61 LEU 2.503 0.107 13 0 "[ . 1 . 2]"
1 62 ASP 0.937 0.088 13 0 "[ . 1 . 2]"
1 63 GLU 1.031 0.074 2 0 "[ . 1 . 2]"
1 64 ASP 2.032 0.076 1 0 "[ . 1 . 2]"
1 65 GLY 1.113 0.076 1 0 "[ . 1 . 2]"
1 66 ASP 0.852 0.120 13 0 "[ . 1 . 2]"
1 67 GLY 1.292 0.082 5 0 "[ . 1 . 2]"
1 68 GLU 0.027 0.026 7 0 "[ . 1 . 2]"
1 69 CYS 1.206 0.127 11 0 "[ . 1 . 2]"
1 70 ASP 1.197 0.091 13 0 "[ . 1 . 2]"
1 71 PHE 0.462 0.069 1 0 "[ . 1 . 2]"
1 72 GLN 1.316 0.099 2 0 "[ . 1 . 2]"
1 73 GLU 3.212 0.121 7 0 "[ . 1 . 2]"
1 74 PHE 1.344 0.092 2 0 "[ . 1 . 2]"
1 75 MET 4.010 0.196 16 0 "[ . 1 . 2]"
1 76 ALA 2.398 0.106 11 0 "[ . 1 . 2]"
1 77 PHE 0.404 0.050 2 0 "[ . 1 . 2]"
1 78 VAL 2.595 0.238 2 0 "[ . 1 . 2]"
1 79 SER 1.348 0.076 15 0 "[ . 1 . 2]"
1 80 MET 2.083 0.107 9 0 "[ . 1 . 2]"
1 81 VAL 5.129 0.219 6 0 "[ . 1 . 2]"
1 82 THR 1.203 0.186 20 0 "[ . 1 . 2]"
1 83 THR 0.045 0.026 10 0 "[ . 1 . 2]"
1 84 ALA 0.972 0.163 11 0 "[ . 1 . 2]"
1 85 CYS 0.181 0.049 11 0 "[ . 1 . 2]"
1 88 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 PHE 0.919 0.155 8 0 "[ . 1 . 2]"
1 90 GLU 1.334 0.145 5 0 "[ . 1 . 2]"
1 91 HIS 0.594 0.075 10 0 "[ . 1 . 2]"
1 92 GLU 0.125 0.079 16 0 "[ . 1 . 2]"
2 2 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 3 GLU 2.213 0.189 6 0 "[ . 1 . 2]"
2 4 LEU 2.964 0.206 19 0 "[ . 1 . 2]"
2 5 GLU 2.799 0.168 9 0 "[ . 1 . 2]"
2 6 LYS 0.893 0.088 20 0 "[ . 1 . 2]"
2 7 ALA 0.291 0.093 9 0 "[ . 1 . 2]"
2 8 MET 4.519 0.238 2 0 "[ . 1 . 2]"
2 9 VAL 2.493 0.127 14 0 "[ . 1 . 2]"
2 10 ALA 1.057 0.093 9 0 "[ . 1 . 2]"
2 11 LEU 1.380 0.197 16 0 "[ . 1 . 2]"
2 12 ILE 0.448 0.186 20 0 "[ . 1 . 2]"
2 13 ASP 1.737 0.078 13 0 "[ . 1 . 2]"
2 14 VAL 3.757 0.192 6 0 "[ . 1 . 2]"
2 15 PHE 0.375 0.102 8 0 "[ . 1 . 2]"
2 16 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
2 17 GLN 0.332 0.048 2 0 "[ . 1 . 2]"
2 18 TYR 0.369 0.078 2 0 "[ . 1 . 2]"
2 19 SER 0.102 0.049 2 0 "[ . 1 . 2]"
2 20 GLY 0.646 0.081 4 0 "[ . 1 . 2]"
2 21 ARG 0.658 0.078 2 0 "[ . 1 . 2]"
2 22 GLU 0.810 0.079 10 0 "[ . 1 . 2]"
2 23 GLY 0.497 0.076 1 0 "[ . 1 . 2]"
2 24 ASP 1.411 0.185 19 0 "[ . 1 . 2]"
2 25 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 26 HIS 0.458 0.109 17 0 "[ . 1 . 2]"
2 27 LYS 0.519 0.065 13 0 "[ . 1 . 2]"
2 28 LEU 0.451 0.049 2 0 "[ . 1 . 2]"
2 29 LYS 0.708 0.126 11 0 "[ . 1 . 2]"
2 30 LYS 0.621 0.123 1 0 "[ . 1 . 2]"
2 31 SER 1.910 0.121 13 0 "[ . 1 . 2]"
2 32 GLU 3.050 0.126 4 0 "[ . 1 . 2]"
2 33 LEU 0.722 0.086 3 0 "[ . 1 . 2]"
2 34 LYS 2.684 0.110 4 0 "[ . 1 . 2]"
2 35 GLU 6.816 0.137 11 0 "[ . 1 . 2]"
2 36 LEU 5.314 0.233 19 0 "[ . 1 . 2]"
2 37 ILE 2.890 0.219 6 0 "[ . 1 . 2]"
2 38 ASN 1.089 0.109 4 0 "[ . 1 . 2]"
2 39 ASN 1.262 0.185 9 0 "[ . 1 . 2]"
2 40 GLU 0.371 0.095 2 0 "[ . 1 . 2]"
2 41 LEU 1.985 0.185 9 0 "[ . 1 . 2]"
2 42 SER 0.192 0.066 14 0 "[ . 1 . 2]"
2 43 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
2 44 PHE 0.096 0.037 15 0 "[ . 1 . 2]"
2 45 LEU 0.372 0.252 12 0 "[ . 1 . 2]"
2 46 GLU 1.009 0.077 14 0 "[ . 1 . 2]"
2 47 GLU 0.834 0.077 14 0 "[ . 1 . 2]"
2 48 ILE 0.709 0.252 12 0 "[ . 1 . 2]"
2 49 LYS 0.060 0.060 16 0 "[ . 1 . 2]"
2 50 GLU 0.241 0.060 16 0 "[ . 1 . 2]"
2 51 GLN 0.190 0.042 16 0 "[ . 1 . 2]"
2 52 GLU 0.438 0.053 5 0 "[ . 1 . 2]"
2 53 VAL 1.033 0.084 11 0 "[ . 1 . 2]"
2 54 VAL 2.728 0.125 16 0 "[ . 1 . 2]"
2 55 ASP 0.836 0.082 16 0 "[ . 1 . 2]"
2 56 LYS 1.698 0.087 16 0 "[ . 1 . 2]"
2 57 VAL 6.632 0.148 16 0 "[ . 1 . 2]"
2 58 MET 3.824 0.115 6 0 "[ . 1 . 2]"
2 59 GLU 2.661 0.115 6 0 "[ . 1 . 2]"
2 60 THR 1.458 0.148 16 0 "[ . 1 . 2]"
2 61 LEU 2.530 0.108 13 0 "[ . 1 . 2]"
2 62 ASP 0.950 0.088 13 0 "[ . 1 . 2]"
2 63 GLU 1.041 0.073 17 0 "[ . 1 . 2]"
2 64 ASP 2.036 0.075 1 0 "[ . 1 . 2]"
2 65 GLY 1.105 0.075 1 0 "[ . 1 . 2]"
2 66 ASP 0.842 0.121 13 0 "[ . 1 . 2]"
2 67 GLY 1.288 0.084 8 0 "[ . 1 . 2]"
2 68 GLU 0.027 0.024 7 0 "[ . 1 . 2]"
2 69 CYS 1.195 0.126 11 0 "[ . 1 . 2]"
2 70 ASP 1.202 0.088 13 0 "[ . 1 . 2]"
2 71 PHE 0.452 0.070 1 0 "[ . 1 . 2]"
2 72 GLN 1.297 0.096 2 0 "[ . 1 . 2]"
2 73 GLU 3.191 0.120 7 0 "[ . 1 . 2]"
2 74 PHE 1.363 0.092 2 0 "[ . 1 . 2]"
2 75 MET 4.017 0.197 16 0 "[ . 1 . 2]"
2 76 ALA 2.362 0.107 11 0 "[ . 1 . 2]"
2 77 PHE 0.407 0.051 2 0 "[ . 1 . 2]"
2 78 VAL 2.625 0.245 2 0 "[ . 1 . 2]"
2 79 SER 1.328 0.073 15 0 "[ . 1 . 2]"
2 80 MET 2.103 0.106 9 0 "[ . 1 . 2]"
2 81 VAL 5.149 0.219 6 0 "[ . 1 . 2]"
2 82 THR 1.208 0.170 20 0 "[ . 1 . 2]"
2 83 THR 0.060 0.028 10 0 "[ . 1 . 2]"
2 84 ALA 0.976 0.164 11 0 "[ . 1 . 2]"
2 85 CYS 0.181 0.050 16 0 "[ . 1 . 2]"
2 88 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
2 89 PHE 0.913 0.154 8 0 "[ . 1 . 2]"
2 90 GLU 1.333 0.146 5 0 "[ . 1 . 2]"
2 91 HIS 0.594 0.074 10 0 "[ . 1 . 2]"
2 92 GLU 0.129 0.079 16 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 2 SER H 1 3 GLU H 1.800 . 6.000 4.458 4.313 4.562 . 0 0 "[ . 1 . 2]" 1
2 2 2 SER H 2 3 GLU H 1.800 . 6.000 4.459 4.311 4.563 . 0 0 "[ . 1 . 2]" 1
3 1 2 SER H 1 4 LEU H 1.800 . 6.000 5.425 5.063 5.975 . 0 0 "[ . 1 . 2]" 1
4 2 2 SER H 2 4 LEU H 1.800 . 6.000 5.425 5.061 5.977 . 0 0 "[ . 1 . 2]" 1
5 1 2 SER H 1 5 GLU QB 1.800 . 5.000 2.609 1.905 3.162 . 0 0 "[ . 1 . 2]" 1
6 2 2 SER H 2 5 GLU QB 1.800 . 5.000 2.609 1.907 3.163 . 0 0 "[ . 1 . 2]" 1
7 1 2 SER H 1 5 GLU QG 1.800 . 6.000 4.312 3.815 4.759 . 0 0 "[ . 1 . 2]" 1
8 2 2 SER H 2 5 GLU QG 1.800 . 6.000 4.312 3.819 4.760 . 0 0 "[ . 1 . 2]" 1
9 1 2 SER H 1 6 LYS H 1.800 . 6.000 3.390 2.885 3.820 . 0 0 "[ . 1 . 2]" 1
10 2 2 SER H 2 6 LYS H 1.800 . 6.000 3.390 2.887 3.817 . 0 0 "[ . 1 . 2]" 1
11 1 3 GLU H 1 3 GLU QB 1.800 . 3.900 2.354 2.094 2.658 . 0 0 "[ . 1 . 2]" 1
12 2 3 GLU H 2 3 GLU QB 1.800 . 3.900 2.354 2.094 2.657 . 0 0 "[ . 1 . 2]" 1
13 1 3 GLU H 1 3 GLU QG 1.800 . 4.500 3.097 1.864 4.095 . 0 0 "[ . 1 . 2]" 1
14 2 3 GLU H 2 3 GLU QG 1.800 . 4.500 3.096 1.864 4.094 . 0 0 "[ . 1 . 2]" 1
15 1 2 SER HA 1 3 GLU H 1.800 . 2.900 2.592 2.336 2.837 . 0 0 "[ . 1 . 2]" 1
16 2 2 SER HA 2 3 GLU H 1.800 . 2.900 2.592 2.334 2.838 . 0 0 "[ . 1 . 2]" 1
17 1 3 GLU H 1 5 GLU H 1.800 . 6.000 4.063 3.773 4.367 . 0 0 "[ . 1 . 2]" 1
18 2 3 GLU H 2 5 GLU H 1.800 . 6.000 4.063 3.770 4.366 . 0 0 "[ . 1 . 2]" 1
19 1 3 GLU H 1 6 LYS H 1.800 . 6.000 4.758 4.359 5.094 . 0 0 "[ . 1 . 2]" 1
20 2 3 GLU H 2 6 LYS H 1.800 . 6.000 4.758 4.356 5.096 . 0 0 "[ . 1 . 2]" 1
21 1 3 GLU HA 1 6 LYS QB 1.800 . 6.000 3.501 3.205 4.372 . 0 0 "[ . 1 . 2]" 1
22 2 3 GLU HA 2 6 LYS QB 1.800 . 6.000 3.502 3.204 4.370 . 0 0 "[ . 1 . 2]" 1
23 1 14 VAL QG 2 3 GLU H 1.800 . 7.900 3.673 2.487 4.157 . 0 0 "[ . 1 . 2]" 1
24 1 3 GLU H 2 14 VAL QG 1.800 . 7.900 3.670 2.491 4.177 . 0 0 "[ . 1 . 2]" 1
25 1 4 LEU HA 1 4 LEU MD1 1.800 . 4.800 2.142 1.894 2.420 . 0 0 "[ . 1 . 2]" 1
26 2 4 LEU HA 2 4 LEU MD1 1.800 . 4.800 2.143 1.895 2.422 . 0 0 "[ . 1 . 2]" 1
27 1 4 LEU H 1 4 LEU HB3 1.800 . 3.500 2.813 2.626 3.133 . 0 0 "[ . 1 . 2]" 1
28 2 4 LEU H 2 4 LEU HB3 1.800 . 3.500 2.812 2.625 3.129 . 0 0 "[ . 1 . 2]" 1
29 1 4 LEU H 1 4 LEU HB2 1.800 . 3.500 2.341 2.108 2.495 . 0 0 "[ . 1 . 2]" 1
30 2 4 LEU H 2 4 LEU HB2 1.800 . 3.500 2.341 2.105 2.495 . 0 0 "[ . 1 . 2]" 1
31 1 4 LEU H 1 4 LEU MD1 1.800 . 6.500 3.737 3.233 3.992 . 0 0 "[ . 1 . 2]" 1
32 2 4 LEU H 2 4 LEU MD1 1.800 . 6.500 3.737 3.234 3.991 . 0 0 "[ . 1 . 2]" 1
33 1 4 LEU H 1 4 LEU MD2 1.800 . 7.500 4.295 4.233 4.360 . 0 0 "[ . 1 . 2]" 1
34 2 4 LEU H 2 4 LEU MD2 1.800 . 7.500 4.295 4.235 4.358 . 0 0 "[ . 1 . 2]" 1
35 1 3 GLU H 1 4 LEU H 1.800 . 2.900 2.558 2.424 2.830 . 0 0 "[ . 1 . 2]" 1
36 2 3 GLU H 2 4 LEU H 1.800 . 2.900 2.558 2.426 2.829 . 0 0 "[ . 1 . 2]" 1
37 1 3 GLU HA 1 4 LEU H 1.800 . 5.000 3.557 3.510 3.586 . 0 0 "[ . 1 . 2]" 1
38 2 3 GLU HA 2 4 LEU H 1.800 . 5.000 3.557 3.512 3.586 . 0 0 "[ . 1 . 2]" 1
39 1 3 GLU QB 1 4 LEU H 1.800 . 4.500 2.479 2.061 2.809 . 0 0 "[ . 1 . 2]" 1
40 2 3 GLU QB 2 4 LEU H 1.800 . 4.500 2.479 2.060 2.808 . 0 0 "[ . 1 . 2]" 1
41 1 4 LEU HA 1 7 ALA MB 1.800 . 4.800 2.806 2.553 3.140 . 0 0 "[ . 1 . 2]" 1
42 2 4 LEU HA 2 7 ALA MB 1.800 . 4.800 2.806 2.553 3.139 . 0 0 "[ . 1 . 2]" 1
43 1 4 LEU MD1 1 8 MET ME 1.800 . 8.000 4.698 3.842 5.346 . 0 0 "[ . 1 . 2]" 1
44 2 4 LEU MD1 2 8 MET ME 1.800 . 8.000 4.697 3.841 5.348 . 0 0 "[ . 1 . 2]" 1
45 1 10 ALA MB 2 4 LEU MD1 1.800 . 8.000 5.297 5.124 5.394 . 0 0 "[ . 1 . 2]" 1
46 1 4 LEU MD1 2 10 ALA MB 1.800 . 8.000 5.300 5.159 5.374 . 0 0 "[ . 1 . 2]" 1
47 1 11 LEU HA 2 4 LEU MD1 1.800 . 6.500 3.011 2.724 3.277 . 0 0 "[ . 1 . 2]" 1
48 1 4 LEU MD1 2 11 LEU HA 1.800 . 6.500 3.014 2.736 3.282 . 0 0 "[ . 1 . 2]" 1
49 1 11 LEU HG 2 4 LEU MD1 1.800 . 6.500 2.357 1.826 3.084 . 0 0 "[ . 1 . 2]" 1
50 1 4 LEU MD1 2 11 LEU HG 1.800 . 6.500 2.360 1.848 3.087 . 0 0 "[ . 1 . 2]" 1
51 1 14 VAL QG 2 4 LEU H 1.800 . 6.200 2.500 2.052 2.810 . 0 0 "[ . 1 . 2]" 1
52 1 4 LEU H 2 14 VAL QG 1.800 . 6.200 2.500 2.087 2.783 . 0 0 "[ . 1 . 2]" 1
53 1 14 VAL HB 2 4 LEU MD1 1.800 . 6.500 2.853 2.498 3.587 . 0 0 "[ . 1 . 2]" 1
54 1 4 LEU MD1 2 14 VAL HB 1.800 . 6.500 2.857 2.482 3.587 . 0 0 "[ . 1 . 2]" 1
55 1 40 GLU QB 2 4 LEU MD2 1.800 . 7.500 2.198 1.695 4.259 0.105 2 0 "[ . 1 . 2]" 1
56 1 4 LEU MD2 2 40 GLU QB 1.800 . 7.500 2.204 1.705 4.265 0.095 2 0 "[ . 1 . 2]" 1
57 1 41 LEU HG 2 4 LEU MD2 1.800 . 6.500 2.867 1.793 5.210 0.007 12 0 "[ . 1 . 2]" 1
58 1 4 LEU MD2 2 41 LEU HG 1.800 . 6.500 2.865 1.802 5.245 . 0 0 "[ . 1 . 2]" 1
59 1 42 SER QB 2 4 LEU MD2 1.800 . 8.500 6.097 5.170 6.378 . 0 0 "[ . 1 . 2]" 1
60 1 4 LEU MD2 2 42 SER QB 1.800 . 8.500 6.095 5.183 6.386 . 0 0 "[ . 1 . 2]" 1
61 1 74 PHE QE 2 4 LEU MD1 1.800 . 8.900 3.029 2.442 3.723 . 0 0 "[ . 1 . 2]" 1
62 1 4 LEU MD1 2 74 PHE QE 1.800 . 8.900 3.026 2.440 3.742 . 0 0 "[ . 1 . 2]" 1
63 1 74 PHE HZ 2 4 LEU MD1 1.800 . 6.500 2.919 2.116 4.009 . 0 0 "[ . 1 . 2]" 1
64 1 4 LEU MD1 2 74 PHE HZ 1.800 . 6.500 2.917 2.112 4.003 . 0 0 "[ . 1 . 2]" 1
65 1 75 MET ME 2 4 LEU MD1 1.800 . 8.000 4.255 3.517 5.401 . 0 0 "[ . 1 . 2]" 1
66 1 4 LEU MD1 2 75 MET ME 1.800 . 8.000 4.254 3.497 5.399 . 0 0 "[ . 1 . 2]" 1
67 1 81 VAL MG2 2 4 LEU MD2 1.800 . 9.000 4.500 4.104 4.933 . 0 0 "[ . 1 . 2]" 1
68 1 4 LEU MD2 2 81 VAL MG2 1.800 . 9.000 4.495 4.122 4.943 . 0 0 "[ . 1 . 2]" 1
69 1 4 LEU H 1 5 GLU H 1.800 . 2.900 2.642 2.513 2.906 0.006 4 0 "[ . 1 . 2]" 1
70 2 4 LEU H 2 5 GLU H 1.800 . 2.900 2.643 2.513 2.909 0.009 4 0 "[ . 1 . 2]" 1
71 1 4 LEU HB2 1 5 GLU H 1.800 . 3.500 3.556 3.513 3.601 0.101 14 0 "[ . 1 . 2]" 1
72 2 4 LEU HB2 2 5 GLU H 1.800 . 3.500 3.557 3.514 3.601 0.101 14 0 "[ . 1 . 2]" 1
73 1 4 LEU MD2 1 5 GLU H 1.800 . 6.500 4.193 3.638 4.740 . 0 0 "[ . 1 . 2]" 1
74 2 4 LEU MD2 2 5 GLU H 1.800 . 6.500 4.194 3.638 4.743 . 0 0 "[ . 1 . 2]" 1
75 1 5 GLU H 1 6 LYS H 1.800 . 2.900 2.857 2.699 2.945 0.045 17 0 "[ . 1 . 2]" 1
76 2 5 GLU H 2 6 LYS H 1.800 . 2.900 2.857 2.696 2.943 0.043 17 0 "[ . 1 . 2]" 1
77 1 3 GLU HA 1 5 GLU H 1.800 . 5.000 4.798 4.306 5.058 0.058 7 0 "[ . 1 . 2]" 1
78 2 3 GLU HA 2 5 GLU H 1.800 . 5.000 4.798 4.303 5.053 0.053 7 0 "[ . 1 . 2]" 1
79 1 5 GLU HA 1 8 MET HB3 1.800 . 3.300 3.365 3.328 3.471 0.171 9 0 "[ . 1 . 2]" 1
80 2 5 GLU HA 2 8 MET HB3 1.800 . 3.300 3.365 3.329 3.468 0.168 9 0 "[ . 1 . 2]" 1
81 1 18 TYR QE 2 5 GLU H 1.800 . 8.400 7.094 6.759 7.691 . 0 0 "[ . 1 . 2]" 1
82 1 5 GLU H 2 18 TYR QE 1.800 . 8.400 7.095 6.787 7.721 . 0 0 "[ . 1 . 2]" 1
83 1 6 LYS H 1 6 LYS QB 1.800 . 3.900 2.238 2.045 2.615 . 0 0 "[ . 1 . 2]" 1
84 2 6 LYS H 2 6 LYS QB 1.800 . 3.900 2.238 2.046 2.615 . 0 0 "[ . 1 . 2]" 1
85 1 6 LYS H 1 6 LYS QD 1.800 . 4.300 3.633 3.187 3.986 . 0 0 "[ . 1 . 2]" 1
86 2 6 LYS H 2 6 LYS QD 1.800 . 4.300 3.633 3.185 3.986 . 0 0 "[ . 1 . 2]" 1
87 1 5 GLU HA 1 6 LYS H 1.800 . 6.000 3.574 3.534 3.595 . 0 0 "[ . 1 . 2]" 1
88 2 5 GLU HA 2 6 LYS H 1.800 . 6.000 3.573 3.532 3.596 . 0 0 "[ . 1 . 2]" 1
89 1 5 GLU QB 1 6 LYS H 1.800 . 6.000 2.470 2.009 2.848 . 0 0 "[ . 1 . 2]" 1
90 2 5 GLU QB 2 6 LYS H 1.800 . 6.000 2.471 2.008 2.848 . 0 0 "[ . 1 . 2]" 1
91 1 3 GLU HA 1 6 LYS H 1.800 . 5.000 4.038 3.844 4.393 . 0 0 "[ . 1 . 2]" 1
92 2 3 GLU HA 2 6 LYS H 1.800 . 5.000 4.038 3.843 4.392 . 0 0 "[ . 1 . 2]" 1
93 1 4 LEU HA 1 6 LYS H 1.800 . 6.000 4.666 4.014 5.404 . 0 0 "[ . 1 . 2]" 1
94 2 4 LEU HA 2 6 LYS H 1.800 . 6.000 4.666 4.014 5.405 . 0 0 "[ . 1 . 2]" 1
95 1 6 LYS HA 1 9 VAL HB 1.800 . 3.300 3.326 3.283 3.386 0.086 20 0 "[ . 1 . 2]" 1
96 2 6 LYS HA 2 9 VAL HB 1.800 . 3.300 3.325 3.282 3.388 0.088 20 0 "[ . 1 . 2]" 1
97 1 6 LYS H 1 9 VAL MG1 1.800 . 7.500 6.021 5.797 6.209 . 0 0 "[ . 1 . 2]" 1
98 2 6 LYS H 2 9 VAL MG1 1.800 . 7.500 6.021 5.794 6.208 . 0 0 "[ . 1 . 2]" 1
99 1 7 ALA H 1 7 ALA MB 1.800 . 4.000 2.247 2.160 2.287 . 0 0 "[ . 1 . 2]" 1
100 2 7 ALA H 2 7 ALA MB 1.800 . 4.000 2.248 2.162 2.288 . 0 0 "[ . 1 . 2]" 1
101 1 6 LYS H 1 7 ALA H 1.800 . 2.900 2.640 2.441 2.815 . 0 0 "[ . 1 . 2]" 1
102 2 6 LYS H 2 7 ALA H 1.800 . 2.900 2.640 2.440 2.813 . 0 0 "[ . 1 . 2]" 1
103 1 6 LYS HA 1 7 ALA H 1.800 . 5.000 3.548 3.510 3.591 . 0 0 "[ . 1 . 2]" 1
104 2 6 LYS HA 2 7 ALA H 1.800 . 5.000 3.549 3.508 3.590 . 0 0 "[ . 1 . 2]" 1
105 1 6 LYS QB 1 7 ALA H 1.800 . 3.900 2.820 2.361 3.557 . 0 0 "[ . 1 . 2]" 1
106 2 6 LYS QB 2 7 ALA H 1.800 . 3.900 2.820 2.360 3.556 . 0 0 "[ . 1 . 2]" 1
107 1 3 GLU HA 1 7 ALA H 1.800 . 6.000 3.979 3.381 4.497 . 0 0 "[ . 1 . 2]" 1
108 2 3 GLU HA 2 7 ALA H 1.800 . 6.000 3.979 3.383 4.496 . 0 0 "[ . 1 . 2]" 1
109 1 4 LEU HA 1 7 ALA H 1.800 . 5.000 3.602 3.170 4.072 . 0 0 "[ . 1 . 2]" 1
110 2 4 LEU HA 2 7 ALA H 1.800 . 5.000 3.603 3.170 4.069 . 0 0 "[ . 1 . 2]" 1
111 1 5 GLU H 1 7 ALA H 1.800 . 5.000 4.148 3.836 4.590 . 0 0 "[ . 1 . 2]" 1
112 2 5 GLU H 2 7 ALA H 1.800 . 5.000 4.148 3.836 4.588 . 0 0 "[ . 1 . 2]" 1
113 1 7 ALA HA 1 10 ALA MB 1.800 . 4.800 2.335 2.014 2.575 . 0 0 "[ . 1 . 2]" 1
114 2 7 ALA HA 2 10 ALA MB 1.800 . 4.800 2.334 2.012 2.574 . 0 0 "[ . 1 . 2]" 1
115 1 7 ALA HA 2 7 ALA MB 1.800 . 6.500 3.003 1.917 3.904 . 0 0 "[ . 1 . 2]" 1
116 1 7 ALA MB 2 7 ALA HA 1.800 . 6.500 3.006 1.917 3.905 . 0 0 "[ . 1 . 2]" 1
117 1 11 LEU HA 2 7 ALA MB 1.800 . 6.500 2.777 2.184 3.570 . 0 0 "[ . 1 . 2]" 1
118 1 7 ALA MB 2 11 LEU HA 1.800 . 6.500 2.774 2.183 3.572 . 0 0 "[ . 1 . 2]" 1
119 1 11 LEU QB 2 7 ALA MB 1.800 . 7.500 3.182 2.492 3.727 . 0 0 "[ . 1 . 2]" 1
120 1 7 ALA MB 2 11 LEU QB 1.800 . 7.500 3.177 2.507 3.725 . 0 0 "[ . 1 . 2]" 1
121 1 11 LEU HG 2 7 ALA MB 1.800 . 6.500 2.837 1.978 4.634 . 0 0 "[ . 1 . 2]" 1
122 1 7 ALA MB 2 11 LEU HG 1.800 . 6.500 2.832 1.944 4.650 . 0 0 "[ . 1 . 2]" 1
123 1 8 MET HA 1 8 MET ME 1.800 . 4.800 3.135 1.880 4.067 . 0 0 "[ . 1 . 2]" 1
124 2 8 MET HA 2 8 MET ME 1.800 . 4.800 3.134 1.876 4.067 . 0 0 "[ . 1 . 2]" 1
125 1 8 MET H 1 8 MET HB3 1.800 . 2.900 2.584 2.268 2.856 . 0 0 "[ . 1 . 2]" 1
126 2 8 MET H 2 8 MET HB3 1.800 . 2.900 2.584 2.270 2.854 . 0 0 "[ . 1 . 2]" 1
127 1 8 MET H 1 8 MET HB2 1.800 . 3.500 2.542 2.299 2.791 . 0 0 "[ . 1 . 2]" 1
128 2 8 MET H 2 8 MET HB2 1.800 . 3.500 2.542 2.299 2.792 . 0 0 "[ . 1 . 2]" 1
129 1 7 ALA H 1 8 MET H 1.800 . 2.900 2.843 2.746 2.912 0.012 17 0 "[ . 1 . 2]" 1
130 2 7 ALA H 2 8 MET H 1.800 . 2.900 2.843 2.747 2.912 0.012 17 0 "[ . 1 . 2]" 1
131 1 7 ALA HA 1 8 MET H 1.800 . 5.000 3.572 3.538 3.595 . 0 0 "[ . 1 . 2]" 1
132 2 7 ALA HA 2 8 MET H 1.800 . 5.000 3.572 3.540 3.597 . 0 0 "[ . 1 . 2]" 1
133 1 8 MET H 1 9 VAL MG1 1.800 . 7.500 6.180 6.118 6.231 . 0 0 "[ . 1 . 2]" 1
134 2 8 MET H 2 9 VAL MG1 1.800 . 7.500 6.181 6.119 6.231 . 0 0 "[ . 1 . 2]" 1
135 1 4 LEU HA 1 8 MET H 1.800 . 5.000 2.950 2.495 3.572 . 0 0 "[ . 1 . 2]" 1
136 2 4 LEU HA 2 8 MET H 1.800 . 5.000 2.950 2.495 3.572 . 0 0 "[ . 1 . 2]" 1
137 1 5 GLU HA 1 8 MET H 1.800 . 5.000 4.461 4.180 4.704 . 0 0 "[ . 1 . 2]" 1
138 2 5 GLU HA 2 8 MET H 1.800 . 5.000 4.461 4.182 4.702 . 0 0 "[ . 1 . 2]" 1
139 1 6 LYS H 1 8 MET H 1.800 . 5.000 4.757 4.287 5.054 0.054 9 0 "[ . 1 . 2]" 1
140 2 6 LYS H 2 8 MET H 1.800 . 5.000 4.757 4.291 5.050 0.050 13 0 "[ . 1 . 2]" 1
141 1 6 LYS HA 1 8 MET H 1.800 . 6.000 5.492 5.181 5.620 . 0 0 "[ . 1 . 2]" 1
142 2 6 LYS HA 2 8 MET H 1.800 . 6.000 5.493 5.184 5.623 . 0 0 "[ . 1 . 2]" 1
143 1 11 LEU QB 2 8 MET ME 1.800 . 7.500 4.984 4.360 5.579 . 0 0 "[ . 1 . 2]" 1
144 1 8 MET ME 2 11 LEU QB 1.800 . 7.500 4.986 4.351 5.577 . 0 0 "[ . 1 . 2]" 1
145 1 11 LEU MD1 2 8 MET ME 1.800 . 8.000 2.772 1.914 4.309 . 0 0 "[ . 1 . 2]" 1
146 1 8 MET ME 2 11 LEU MD1 1.800 . 8.000 2.775 1.908 4.295 . 0 0 "[ . 1 . 2]" 1
147 1 11 LEU MD2 2 8 MET ME 1.800 . 8.000 4.001 2.794 4.761 . 0 0 "[ . 1 . 2]" 1
148 1 8 MET ME 2 11 LEU MD2 1.800 . 8.000 4.002 2.763 4.778 . 0 0 "[ . 1 . 2]" 1
149 1 44 PHE QD 2 8 MET ME 1.800 . 9.900 6.767 6.186 7.456 . 0 0 "[ . 1 . 2]" 1
150 1 8 MET ME 2 44 PHE QD 1.800 . 9.900 6.770 6.182 7.456 . 0 0 "[ . 1 . 2]" 1
151 1 78 VAL MG2 2 8 MET ME 1.800 . 8.000 4.358 3.697 5.478 . 0 0 "[ . 1 . 2]" 1
152 1 8 MET ME 2 78 VAL MG2 1.800 . 8.000 4.357 3.709 5.489 . 0 0 "[ . 1 . 2]" 1
153 1 79 SER HA 2 8 MET ME 1.800 . 7.500 2.057 1.728 3.035 0.072 1 0 "[ . 1 . 2]" 1
154 1 8 MET ME 2 79 SER HA 1.800 . 7.500 2.054 1.734 3.016 0.066 1 0 "[ . 1 . 2]" 1
155 1 82 THR HB 2 8 MET ME 1.800 . 7.500 2.402 1.807 3.313 . 0 0 "[ . 1 . 2]" 1
156 1 8 MET ME 2 82 THR HB 1.800 . 7.500 2.403 1.808 3.324 . 0 0 "[ . 1 . 2]" 1
157 1 9 VAL H 1 9 VAL HB 1.800 . 2.900 2.676 2.569 2.769 . 0 0 "[ . 1 . 2]" 1
158 2 9 VAL H 2 9 VAL HB 1.800 . 2.900 2.676 2.569 2.770 . 0 0 "[ . 1 . 2]" 1
159 1 9 VAL H 1 9 VAL MG1 1.800 . 4.400 3.761 3.739 3.774 . 0 0 "[ . 1 . 2]" 1
160 2 9 VAL H 2 9 VAL MG1 1.800 . 4.400 3.761 3.738 3.774 . 0 0 "[ . 1 . 2]" 1
161 1 8 MET H 1 9 VAL H 1.800 . 2.900 2.991 2.936 3.025 0.125 14 0 "[ . 1 . 2]" 1
162 2 8 MET H 2 9 VAL H 1.800 . 2.900 2.991 2.938 3.027 0.127 14 0 "[ . 1 . 2]" 1
163 1 8 MET HB3 1 9 VAL H 1.800 . 6.000 2.337 2.185 2.483 . 0 0 "[ . 1 . 2]" 1
164 2 8 MET HB3 2 9 VAL H 1.800 . 6.000 2.337 2.184 2.485 . 0 0 "[ . 1 . 2]" 1
165 1 6 LYS HA 1 9 VAL H 1.800 . 5.000 4.460 4.267 4.637 . 0 0 "[ . 1 . 2]" 1
166 2 6 LYS HA 2 9 VAL H 1.800 . 5.000 4.460 4.266 4.636 . 0 0 "[ . 1 . 2]" 1
167 1 9 VAL HA 1 12 ILE HB 1.800 . 3.300 2.983 2.580 3.322 0.022 19 0 "[ . 1 . 2]" 1
168 2 9 VAL HA 2 12 ILE HB 1.800 . 3.300 2.983 2.581 3.321 0.021 19 0 "[ . 1 . 2]" 1
169 1 44 PHE HZ 2 9 VAL MG2 1.800 . 6.500 3.026 1.784 5.060 0.016 9 0 "[ . 1 . 2]" 1
170 1 9 VAL MG2 2 44 PHE HZ 1.800 . 6.500 3.024 1.790 5.067 0.010 9 0 "[ . 1 . 2]" 1
171 1 44 PHE QE 2 9 VAL MG2 1.800 . 8.900 2.535 1.823 3.628 . 0 0 "[ . 1 . 2]" 1
172 1 9 VAL MG2 2 44 PHE QE 1.800 . 8.900 2.533 1.789 3.634 0.011 17 0 "[ . 1 . 2]" 1
173 1 44 PHE HZ 2 9 VAL H 1.800 . 8.400 5.966 4.558 8.398 . 0 0 "[ . 1 . 2]" 1
174 1 9 VAL H 2 44 PHE HZ 1.800 . 8.400 5.964 4.555 8.402 0.002 6 0 "[ . 1 . 2]" 1
175 1 10 ALA H 1 10 ALA MB 1.800 . 4.000 2.187 2.058 2.263 . 0 0 "[ . 1 . 2]" 1
176 2 10 ALA H 2 10 ALA MB 1.800 . 4.000 2.187 2.057 2.265 . 0 0 "[ . 1 . 2]" 1
177 1 9 VAL H 1 10 ALA H 1.800 . 2.900 2.675 2.557 2.775 . 0 0 "[ . 1 . 2]" 1
178 2 9 VAL H 2 10 ALA H 1.800 . 2.900 2.676 2.558 2.775 . 0 0 "[ . 1 . 2]" 1
179 1 9 VAL HA 1 10 ALA H 1.800 . 5.000 3.532 3.490 3.559 . 0 0 "[ . 1 . 2]" 1
180 2 9 VAL HA 2 10 ALA H 1.800 . 5.000 3.532 3.492 3.561 . 0 0 "[ . 1 . 2]" 1
181 1 9 VAL HB 1 10 ALA H 1.800 . 2.900 2.804 2.646 2.920 0.020 13 0 "[ . 1 . 2]" 1
182 2 9 VAL HB 2 10 ALA H 1.800 . 2.900 2.804 2.645 2.920 0.020 13 0 "[ . 1 . 2]" 1
183 1 9 VAL MG1 1 10 ALA H 1.800 . 6.500 3.794 3.623 3.935 . 0 0 "[ . 1 . 2]" 1
184 2 9 VAL MG1 2 10 ALA H 1.800 . 6.500 3.794 3.623 3.935 . 0 0 "[ . 1 . 2]" 1
185 1 9 VAL MG2 1 10 ALA H 1.800 . 5.000 3.769 3.707 3.843 . 0 0 "[ . 1 . 2]" 1
186 2 9 VAL MG2 2 10 ALA H 1.800 . 5.000 3.769 3.707 3.844 . 0 0 "[ . 1 . 2]" 1
187 1 10 ALA H 1 11 LEU QB 1.800 . 6.000 4.375 4.276 4.493 . 0 0 "[ . 1 . 2]" 1
188 2 10 ALA H 2 11 LEU QB 1.800 . 6.000 4.375 4.276 4.494 . 0 0 "[ . 1 . 2]" 1
189 1 6 LYS HA 1 10 ALA H 1.800 . 6.000 4.008 3.808 4.191 . 0 0 "[ . 1 . 2]" 1
190 2 6 LYS HA 2 10 ALA H 1.800 . 6.000 4.007 3.806 4.191 . 0 0 "[ . 1 . 2]" 1
191 1 6 LYS QB 1 10 ALA H 1.800 . 7.000 5.115 4.880 5.266 . 0 0 "[ . 1 . 2]" 1
192 2 6 LYS QB 2 10 ALA H 1.800 . 7.000 5.113 4.880 5.265 . 0 0 "[ . 1 . 2]" 1
193 1 7 ALA H 1 10 ALA H 1.800 . 6.000 4.310 4.174 4.544 . 0 0 "[ . 1 . 2]" 1
194 2 7 ALA H 2 10 ALA H 1.800 . 6.000 4.309 4.173 4.545 . 0 0 "[ . 1 . 2]" 1
195 1 7 ALA HA 1 10 ALA H 1.800 . 3.500 3.453 3.250 3.594 0.094 9 0 "[ . 1 . 2]" 1
196 2 7 ALA HA 2 10 ALA H 1.800 . 3.500 3.453 3.250 3.593 0.093 9 0 "[ . 1 . 2]" 1
197 1 8 MET H 1 10 ALA H 1.800 . 5.000 4.079 3.852 4.246 . 0 0 "[ . 1 . 2]" 1
198 2 8 MET H 2 10 ALA H 1.800 . 5.000 4.080 3.853 4.247 . 0 0 "[ . 1 . 2]" 1
199 1 8 MET HB3 1 10 ALA H 1.800 . 6.000 4.725 4.503 4.840 . 0 0 "[ . 1 . 2]" 1
200 2 8 MET HB3 2 10 ALA H 1.800 . 6.000 4.726 4.503 4.838 . 0 0 "[ . 1 . 2]" 1
201 1 10 ALA H 1 12 ILE H 1.800 . 5.000 4.326 3.990 4.698 . 0 0 "[ . 1 . 2]" 1
202 2 10 ALA H 2 12 ILE H 1.800 . 5.000 4.325 3.986 4.694 . 0 0 "[ . 1 . 2]" 1
203 1 10 ALA H 1 13 ASP HB2 1.800 . 6.000 5.272 4.917 5.648 . 0 0 "[ . 1 . 2]" 1
204 2 10 ALA H 2 13 ASP HB2 1.800 . 6.000 5.272 4.917 5.648 . 0 0 "[ . 1 . 2]" 1
205 1 10 ALA HA 1 13 ASP HB2 1.800 . 3.300 2.687 2.419 2.974 . 0 0 "[ . 1 . 2]" 1
206 2 10 ALA HA 2 13 ASP HB2 1.800 . 3.300 2.687 2.420 2.974 . 0 0 "[ . 1 . 2]" 1
207 1 10 ALA HA 1 13 ASP HB3 1.800 . 3.300 3.329 3.178 3.361 0.061 16 0 "[ . 1 . 2]" 1
208 2 10 ALA HA 2 13 ASP HB3 1.800 . 3.300 3.329 3.178 3.360 0.060 16 0 "[ . 1 . 2]" 1
209 1 10 ALA MB 2 3 GLU QG 1.800 . 7.500 4.596 1.834 5.452 . 0 0 "[ . 1 . 2]" 1
210 1 3 GLU QG 2 10 ALA MB 1.800 . 7.500 4.596 1.839 5.444 . 0 0 "[ . 1 . 2]" 1
211 1 11 LEU HA 1 11 LEU MD2 1.800 . 4.300 2.629 2.187 3.071 . 0 0 "[ . 1 . 2]" 1
212 2 11 LEU HA 2 11 LEU MD2 1.800 . 4.300 2.629 2.188 3.072 . 0 0 "[ . 1 . 2]" 1
213 1 11 LEU H 1 11 LEU QB 1.800 . 3.900 2.081 2.064 2.105 . 0 0 "[ . 1 . 2]" 1
214 2 11 LEU H 2 11 LEU QB 1.800 . 3.900 2.081 2.065 2.106 . 0 0 "[ . 1 . 2]" 1
215 1 11 LEU H 1 11 LEU MD1 1.800 . 6.500 3.678 3.101 4.040 . 0 0 "[ . 1 . 2]" 1
216 2 11 LEU H 2 11 LEU MD1 1.800 . 6.500 3.678 3.098 4.040 . 0 0 "[ . 1 . 2]" 1
217 1 11 LEU H 1 11 LEU MD2 1.800 . 6.500 4.339 4.138 4.433 . 0 0 "[ . 1 . 2]" 1
218 2 11 LEU H 2 11 LEU MD2 1.800 . 6.500 4.338 4.137 4.434 . 0 0 "[ . 1 . 2]" 1
219 1 10 ALA H 1 11 LEU H 1.800 . 2.900 2.709 2.581 2.870 . 0 0 "[ . 1 . 2]" 1
220 2 10 ALA H 2 11 LEU H 1.800 . 2.900 2.709 2.580 2.869 . 0 0 "[ . 1 . 2]" 1
221 1 10 ALA HA 1 11 LEU H 1.800 . 6.000 3.552 3.521 3.586 . 0 0 "[ . 1 . 2]" 1
222 2 10 ALA HA 2 11 LEU H 1.800 . 6.000 3.552 3.519 3.586 . 0 0 "[ . 1 . 2]" 1
223 1 10 ALA MB 1 11 LEU H 1.800 . 4.000 2.598 2.338 2.765 . 0 0 "[ . 1 . 2]" 1
224 2 10 ALA MB 2 11 LEU H 1.800 . 4.000 2.598 2.338 2.764 . 0 0 "[ . 1 . 2]" 1
225 1 11 LEU H 1 12 ILE H 1.800 . 2.900 2.809 2.669 2.907 0.007 2 0 "[ . 1 . 2]" 1
226 2 11 LEU H 2 12 ILE H 1.800 . 2.900 2.808 2.668 2.904 0.004 2 0 "[ . 1 . 2]" 1
227 1 7 ALA HA 1 11 LEU H 1.800 . 6.000 4.359 3.986 4.649 . 0 0 "[ . 1 . 2]" 1
228 2 7 ALA HA 2 11 LEU H 1.800 . 6.000 4.358 3.983 4.645 . 0 0 "[ . 1 . 2]" 1
229 1 8 MET HA 1 11 LEU H 1.800 . 6.000 3.618 3.341 4.002 . 0 0 "[ . 1 . 2]" 1
230 2 8 MET HA 2 11 LEU H 1.800 . 6.000 3.619 3.343 4.002 . 0 0 "[ . 1 . 2]" 1
231 1 8 MET HA 1 11 LEU QB 1.800 . 4.300 3.019 2.730 3.393 . 0 0 "[ . 1 . 2]" 1
232 2 8 MET HA 2 11 LEU QB 1.800 . 4.300 3.020 2.731 3.393 . 0 0 "[ . 1 . 2]" 1
233 1 8 MET HA 1 11 LEU MD1 1.800 . 4.800 3.330 2.761 3.791 . 0 0 "[ . 1 . 2]" 1
234 2 8 MET HA 2 11 LEU MD1 1.800 . 4.800 3.330 2.761 3.791 . 0 0 "[ . 1 . 2]" 1
235 1 9 VAL HA 1 11 LEU H 1.800 . 6.000 4.220 3.997 4.687 . 0 0 "[ . 1 . 2]" 1
236 2 9 VAL HA 2 11 LEU H 1.800 . 6.000 4.220 3.996 4.687 . 0 0 "[ . 1 . 2]" 1
237 1 9 VAL H 1 11 LEU H 1.800 . 5.000 4.307 4.097 4.597 . 0 0 "[ . 1 . 2]" 1
238 2 9 VAL H 2 11 LEU H 1.800 . 5.000 4.307 4.096 4.596 . 0 0 "[ . 1 . 2]" 1
239 1 11 LEU H 1 13 ASP H 1.800 . 5.000 4.026 3.769 4.237 . 0 0 "[ . 1 . 2]" 1
240 2 11 LEU H 2 13 ASP H 1.800 . 5.000 4.027 3.771 4.239 . 0 0 "[ . 1 . 2]" 1
241 1 11 LEU HA 1 14 VAL HB 1.800 . 3.300 3.225 2.960 3.348 0.048 18 0 "[ . 1 . 2]" 1
242 2 11 LEU HA 2 14 VAL HB 1.800 . 3.300 3.225 2.959 3.350 0.050 18 0 "[ . 1 . 2]" 1
243 1 11 LEU MD2 1 14 VAL HB 1.800 . 6.500 3.213 2.617 4.718 . 0 0 "[ . 1 . 2]" 1
244 2 11 LEU MD2 2 14 VAL HB 1.800 . 6.500 3.214 2.620 4.720 . 0 0 "[ . 1 . 2]" 1
245 1 11 LEU H 1 14 VAL QG 1.800 . 8.900 4.812 4.489 5.318 . 0 0 "[ . 1 . 2]" 1
246 2 11 LEU H 2 14 VAL QG 1.800 . 8.900 4.812 4.490 5.320 . 0 0 "[ . 1 . 2]" 1
247 1 11 LEU MD1 1 14 VAL QG 1.800 . 7.700 4.589 4.384 4.725 . 0 0 "[ . 1 . 2]" 1
248 2 11 LEU MD1 2 14 VAL QG 1.800 . 7.700 4.589 4.388 4.725 . 0 0 "[ . 1 . 2]" 1
249 1 11 LEU MD2 1 14 VAL QG 1.800 . 9.400 3.088 2.636 3.608 . 0 0 "[ . 1 . 2]" 1
250 2 11 LEU MD2 2 14 VAL QG 1.800 . 9.400 3.089 2.635 3.608 . 0 0 "[ . 1 . 2]" 1
251 1 11 LEU MD2 1 74 PHE QE 1.800 . 8.900 2.851 2.069 3.672 . 0 0 "[ . 1 . 2]" 1
252 2 11 LEU MD2 2 74 PHE QE 1.800 . 8.900 2.850 2.067 3.673 . 0 0 "[ . 1 . 2]" 1
253 1 11 LEU MD2 1 74 PHE HZ 1.800 . 6.500 2.519 1.840 3.478 . 0 0 "[ . 1 . 2]" 1
254 2 11 LEU MD2 2 74 PHE HZ 1.800 . 6.500 2.519 1.839 3.479 . 0 0 "[ . 1 . 2]" 1
255 1 11 LEU MD2 1 75 MET HB2 1.800 . 7.500 5.482 4.702 6.126 . 0 0 "[ . 1 . 2]" 1
256 2 11 LEU MD2 2 75 MET HB2 1.800 . 7.500 5.481 4.699 6.126 . 0 0 "[ . 1 . 2]" 1
257 1 11 LEU MD2 1 78 VAL MG1 1.800 . 6.300 2.498 1.844 3.127 . 0 0 "[ . 1 . 2]" 1
258 2 11 LEU MD2 2 78 VAL MG1 1.800 . 6.300 2.499 1.845 3.126 . 0 0 "[ . 1 . 2]" 1
259 1 11 LEU MD2 1 78 VAL MG2 1.800 . 8.000 2.805 2.410 3.325 . 0 0 "[ . 1 . 2]" 1
260 2 11 LEU MD2 2 78 VAL MG2 1.800 . 8.000 2.805 2.410 3.325 . 0 0 "[ . 1 . 2]" 1
261 1 4 LEU HA 2 11 LEU MD2 1.800 . 6.500 3.827 3.341 4.448 . 0 0 "[ . 1 . 2]" 1
262 1 11 LEU MD2 2 4 LEU HA 1.800 . 6.500 3.832 3.349 4.448 . 0 0 "[ . 1 . 2]" 1
263 1 4 LEU MD2 2 11 LEU MD2 1.800 . 8.000 3.563 3.148 3.928 . 0 0 "[ . 1 . 2]" 1
264 1 11 LEU MD2 2 4 LEU MD2 1.800 . 8.000 3.562 3.169 3.895 . 0 0 "[ . 1 . 2]" 1
265 1 7 ALA MB 2 11 LEU MD1 1.800 . 6.300 3.319 2.131 4.230 . 0 0 "[ . 1 . 2]" 1
266 1 11 LEU MD1 2 7 ALA MB 1.800 . 6.300 3.324 2.155 4.223 . 0 0 "[ . 1 . 2]" 1
267 1 11 LEU HG 2 11 LEU MD1 1.800 . 6.500 5.103 4.560 5.435 . 0 0 "[ . 1 . 2]" 1
268 1 11 LEU MD1 2 11 LEU HG 1.800 . 6.500 5.104 4.561 5.436 . 0 0 "[ . 1 . 2]" 1
269 1 12 ILE H 1 12 ILE HB 1.800 . 3.500 2.398 2.122 3.058 . 0 0 "[ . 1 . 2]" 1
270 2 12 ILE H 2 12 ILE HB 1.800 . 3.500 2.399 2.121 3.058 . 0 0 "[ . 1 . 2]" 1
271 1 11 LEU HA 1 12 ILE H 1.800 . 5.000 3.568 3.505 3.591 . 0 0 "[ . 1 . 2]" 1
272 2 11 LEU HA 2 12 ILE H 1.800 . 5.000 3.568 3.505 3.591 . 0 0 "[ . 1 . 2]" 1
273 1 9 VAL HA 1 12 ILE H 1.800 . 6.000 3.345 3.101 3.689 . 0 0 "[ . 1 . 2]" 1
274 2 9 VAL HA 2 12 ILE H 1.800 . 6.000 3.345 3.101 3.687 . 0 0 "[ . 1 . 2]" 1
275 1 10 ALA HA 1 12 ILE H 1.800 . 6.000 4.434 3.918 5.015 . 0 0 "[ . 1 . 2]" 1
276 2 10 ALA HA 2 12 ILE H 1.800 . 6.000 4.434 3.917 5.015 . 0 0 "[ . 1 . 2]" 1
277 1 13 ASP H 1 13 ASP HB3 1.800 . 2.900 2.803 2.693 2.927 0.027 19 0 "[ . 1 . 2]" 1
278 2 13 ASP H 2 13 ASP HB3 1.800 . 2.900 2.803 2.694 2.929 0.029 19 0 "[ . 1 . 2]" 1
279 1 13 ASP H 1 13 ASP HB2 1.800 . 3.500 2.313 2.216 2.396 . 0 0 "[ . 1 . 2]" 1
280 2 13 ASP H 2 13 ASP HB2 1.800 . 3.500 2.313 2.217 2.397 . 0 0 "[ . 1 . 2]" 1
281 1 12 ILE H 1 13 ASP H 1.800 . 2.900 2.719 2.472 2.813 . 0 0 "[ . 1 . 2]" 1
282 2 12 ILE H 2 13 ASP H 1.800 . 2.900 2.720 2.472 2.814 . 0 0 "[ . 1 . 2]" 1
283 1 12 ILE HA 1 13 ASP H 1.800 . 6.000 3.521 3.481 3.553 . 0 0 "[ . 1 . 2]" 1
284 2 12 ILE HA 2 13 ASP H 1.800 . 6.000 3.521 3.480 3.553 . 0 0 "[ . 1 . 2]" 1
285 1 12 ILE HB 1 13 ASP H 1.800 . 2.900 2.831 2.558 2.940 0.040 7 0 "[ . 1 . 2]" 1
286 2 12 ILE HB 2 13 ASP H 1.800 . 2.900 2.831 2.558 2.938 0.038 7 0 "[ . 1 . 2]" 1
287 1 12 ILE MG 1 13 ASP H 1.800 . 7.500 3.318 2.690 4.088 . 0 0 "[ . 1 . 2]" 1
288 2 12 ILE MG 2 13 ASP H 1.800 . 7.500 3.317 2.688 4.088 . 0 0 "[ . 1 . 2]" 1
289 1 13 ASP H 1 14 VAL QG 1.800 . 8.900 4.403 4.231 4.699 . 0 0 "[ . 1 . 2]" 1
290 2 13 ASP H 2 14 VAL QG 1.800 . 8.900 4.403 4.231 4.701 . 0 0 "[ . 1 . 2]" 1
291 1 9 VAL HA 1 13 ASP H 1.800 . 6.000 4.690 4.313 4.905 . 0 0 "[ . 1 . 2]" 1
292 2 9 VAL HA 2 13 ASP H 1.800 . 6.000 4.691 4.315 4.906 . 0 0 "[ . 1 . 2]" 1
293 1 10 ALA HA 1 13 ASP H 1.800 . 6.000 3.276 3.154 3.526 . 0 0 "[ . 1 . 2]" 1
294 2 10 ALA HA 2 13 ASP H 1.800 . 6.000 3.275 3.157 3.524 . 0 0 "[ . 1 . 2]" 1
295 1 11 LEU HA 1 13 ASP H 1.800 . 6.000 4.055 3.786 4.286 . 0 0 "[ . 1 . 2]" 1
296 2 11 LEU HA 2 13 ASP H 1.800 . 6.000 4.055 3.786 4.287 . 0 0 "[ . 1 . 2]" 1
297 1 14 VAL H 1 14 VAL HB 1.800 . 2.900 2.469 2.052 2.645 . 0 0 "[ . 1 . 2]" 1
298 2 14 VAL H 2 14 VAL HB 1.800 . 2.900 2.469 2.055 2.646 . 0 0 "[ . 1 . 2]" 1
299 1 14 VAL H 1 14 VAL QG 1.800 . 5.600 2.362 2.041 2.923 . 0 0 "[ . 1 . 2]" 1
300 2 14 VAL H 2 14 VAL QG 1.800 . 5.600 2.362 2.041 2.925 . 0 0 "[ . 1 . 2]" 1
301 1 13 ASP H 1 14 VAL H 1.800 . 2.900 2.819 2.606 2.924 0.024 13 0 "[ . 1 . 2]" 1
302 2 13 ASP H 2 14 VAL H 1.800 . 2.900 2.818 2.606 2.924 0.024 13 0 "[ . 1 . 2]" 1
303 1 13 ASP HA 1 14 VAL H 1.800 . 6.000 3.577 3.565 3.589 . 0 0 "[ . 1 . 2]" 1
304 2 13 ASP HA 2 14 VAL H 1.800 . 6.000 3.577 3.565 3.589 . 0 0 "[ . 1 . 2]" 1
305 1 13 ASP HB3 1 14 VAL H 1.800 . 3.500 2.312 2.144 2.532 . 0 0 "[ . 1 . 2]" 1
306 2 13 ASP HB3 2 14 VAL H 1.800 . 3.500 2.312 2.143 2.530 . 0 0 "[ . 1 . 2]" 1
307 1 13 ASP HB2 1 14 VAL H 1.800 . 3.500 3.541 3.492 3.579 0.079 13 0 "[ . 1 . 2]" 1
308 2 13 ASP HB2 2 14 VAL H 1.800 . 3.500 3.541 3.491 3.578 0.078 13 0 "[ . 1 . 2]" 1
309 1 13 ASP QB 1 14 VAL MG1 1.800 . 7.500 5.124 4.831 5.234 . 0 0 "[ . 1 . 2]" 1
310 2 13 ASP QB 2 14 VAL MG1 1.800 . 7.500 5.124 4.835 5.232 . 0 0 "[ . 1 . 2]" 1
311 1 14 VAL H 1 15 PHE H 1.800 . 2.900 2.872 2.762 2.930 0.030 16 0 "[ . 1 . 2]" 1
312 2 14 VAL H 2 15 PHE H 1.800 . 2.900 2.872 2.761 2.929 0.029 16 0 "[ . 1 . 2]" 1
313 1 14 VAL MG2 1 15 PHE HA 1.800 . 6.500 5.382 4.907 5.456 . 0 0 "[ . 1 . 2]" 1
314 2 14 VAL MG2 2 15 PHE HA 1.800 . 6.500 5.381 4.903 5.453 . 0 0 "[ . 1 . 2]" 1
315 1 10 ALA HA 1 14 VAL H 1.800 . 6.000 4.645 4.385 4.775 . 0 0 "[ . 1 . 2]" 1
316 2 10 ALA HA 2 14 VAL H 1.800 . 6.000 4.644 4.385 4.776 . 0 0 "[ . 1 . 2]" 1
317 1 11 LEU HA 1 14 VAL H 1.800 . 3.500 3.347 3.128 3.526 0.026 3 0 "[ . 1 . 2]" 1
318 2 11 LEU HA 2 14 VAL H 1.800 . 3.500 3.348 3.130 3.528 0.028 3 0 "[ . 1 . 2]" 1
319 1 12 ILE H 1 14 VAL H 1.800 . 5.000 4.518 4.235 4.754 . 0 0 "[ . 1 . 2]" 1
320 2 12 ILE H 2 14 VAL H 1.800 . 5.000 4.518 4.237 4.755 . 0 0 "[ . 1 . 2]" 1
321 1 12 ILE HA 1 14 VAL H 1.800 . 6.000 4.603 4.265 4.848 . 0 0 "[ . 1 . 2]" 1
322 2 12 ILE HA 2 14 VAL H 1.800 . 6.000 4.603 4.268 4.849 . 0 0 "[ . 1 . 2]" 1
323 1 14 VAL HA 1 17 GLN HB3 1.800 . 3.300 3.103 2.438 3.335 0.035 3 0 "[ . 1 . 2]" 1
324 2 14 VAL HA 2 17 GLN HB3 1.800 . 3.300 3.103 2.440 3.338 0.038 3 0 "[ . 1 . 2]" 1
325 1 14 VAL HA 1 17 GLN HB2 1.800 . 5.000 2.430 1.854 3.663 . 0 0 "[ . 1 . 2]" 1
326 2 14 VAL HA 2 17 GLN HB2 1.800 . 5.000 2.430 1.854 3.666 . 0 0 "[ . 1 . 2]" 1
327 1 14 VAL MG1 1 17 GLN HB3 1.800 . 7.500 3.593 2.913 4.547 . 0 0 "[ . 1 . 2]" 1
328 2 14 VAL MG1 2 17 GLN HB3 1.800 . 7.500 3.594 2.914 4.552 . 0 0 "[ . 1 . 2]" 1
329 1 14 VAL MG2 1 17 GLN HG2 1.800 . 6.500 5.041 4.305 5.314 . 0 0 "[ . 1 . 2]" 1
330 2 14 VAL MG2 2 17 GLN HG2 1.800 . 6.500 5.042 4.308 5.315 . 0 0 "[ . 1 . 2]" 1
331 1 14 VAL MG2 1 18 TYR QD 1.800 . 7.200 4.331 2.933 5.576 . 0 0 "[ . 1 . 2]" 1
332 2 14 VAL MG2 2 18 TYR QD 1.800 . 7.200 4.331 2.935 5.576 . 0 0 "[ . 1 . 2]" 1
333 1 14 VAL MG1 1 18 TYR QD 1.800 . 8.900 2.401 1.866 3.906 . 0 0 "[ . 1 . 2]" 1
334 2 14 VAL MG1 2 18 TYR QD 1.800 . 8.900 2.401 1.865 3.908 . 0 0 "[ . 1 . 2]" 1
335 1 14 VAL MG2 1 36 LEU HA 1.800 . 7.500 6.126 6.081 6.182 . 0 0 "[ . 1 . 2]" 1
336 2 14 VAL MG2 2 36 LEU HA 1.800 . 7.500 6.126 6.080 6.178 . 0 0 "[ . 1 . 2]" 1
337 1 14 VAL MG2 1 36 LEU MD1 1.800 . 6.300 3.441 3.085 3.836 . 0 0 "[ . 1 . 2]" 1
338 2 14 VAL MG2 2 36 LEU MD1 1.800 . 6.300 3.441 3.087 3.835 . 0 0 "[ . 1 . 2]" 1
339 1 14 VAL MG2 1 36 LEU MD2 1.800 . 8.000 4.357 4.137 4.610 . 0 0 "[ . 1 . 2]" 1
340 2 14 VAL MG2 2 36 LEU MD2 1.800 . 8.000 4.357 4.137 4.610 . 0 0 "[ . 1 . 2]" 1
341 1 14 VAL MG2 1 74 PHE HZ 1.800 . 6.500 4.515 3.438 5.241 . 0 0 "[ . 1 . 2]" 1
342 2 14 VAL MG2 2 74 PHE HZ 1.800 . 6.500 4.515 3.436 5.241 . 0 0 "[ . 1 . 2]" 1
343 1 3 GLU QB 2 14 VAL MG1 1.800 . 4.800 3.244 3.107 3.386 . 0 0 "[ . 1 . 2]" 1
344 1 14 VAL MG1 2 3 GLU QB 1.800 . 4.800 3.247 3.113 3.386 . 0 0 "[ . 1 . 2]" 1
345 1 3 GLU QB 2 14 VAL MG2 1.800 . 6.500 1.697 1.608 1.829 0.192 6 0 "[ . 1 . 2]" 1
346 1 14 VAL MG2 2 3 GLU QB 1.800 . 6.500 1.700 1.611 1.817 0.189 6 0 "[ . 1 . 2]" 1
347 1 3 GLU QG 2 14 VAL MG1 1.800 . 5.800 4.179 3.987 4.377 . 0 0 "[ . 1 . 2]" 1
348 1 14 VAL MG1 2 3 GLU QG 1.800 . 5.800 4.184 3.991 4.376 . 0 0 "[ . 1 . 2]" 1
349 1 4 LEU HA 2 14 VAL MG1 1.800 . 6.500 3.993 3.290 4.508 . 0 0 "[ . 1 . 2]" 1
350 1 14 VAL MG1 2 4 LEU HA 1.800 . 6.500 3.995 3.292 4.522 . 0 0 "[ . 1 . 2]" 1
351 1 4 LEU QB 2 14 VAL MG1 1.800 . 6.500 2.755 2.190 3.508 . 0 0 "[ . 1 . 2]" 1
352 1 14 VAL MG1 2 4 LEU QB 1.800 . 6.500 2.754 2.156 3.532 . 0 0 "[ . 1 . 2]" 1
353 1 4 LEU QB 2 14 VAL MG2 1.800 . 6.500 2.567 2.156 3.233 . 0 0 "[ . 1 . 2]" 1
354 1 14 VAL MG2 2 4 LEU QB 1.800 . 6.500 2.562 2.166 3.253 . 0 0 "[ . 1 . 2]" 1
355 1 4 LEU MD1 2 14 VAL MG1 1.800 . 6.300 2.176 1.705 2.900 0.095 3 0 "[ . 1 . 2]" 1
356 1 14 VAL MG1 2 4 LEU MD1 1.800 . 6.300 2.174 1.679 2.857 0.121 3 0 "[ . 1 . 2]" 1
357 1 4 LEU MD1 2 14 VAL MG2 1.800 . 6.300 2.388 1.920 3.290 . 0 0 "[ . 1 . 2]" 1
358 1 14 VAL MG2 2 4 LEU MD1 1.800 . 6.300 2.383 1.929 3.292 . 0 0 "[ . 1 . 2]" 1
359 1 4 LEU MD2 2 14 VAL MG2 1.800 . 8.000 4.105 3.864 4.426 . 0 0 "[ . 1 . 2]" 1
360 1 14 VAL MG2 2 4 LEU MD2 1.800 . 8.000 4.100 3.871 4.429 . 0 0 "[ . 1 . 2]" 1
361 1 7 ALA MB 2 14 VAL MG1 1.800 . 8.000 5.185 4.692 5.514 . 0 0 "[ . 1 . 2]" 1
362 1 14 VAL MG1 2 7 ALA MB 1.800 . 8.000 5.187 4.701 5.517 . 0 0 "[ . 1 . 2]" 1
363 1 15 PHE H 1 15 PHE HB3 1.800 . 3.500 2.889 2.638 3.164 . 0 0 "[ . 1 . 2]" 1
364 2 15 PHE H 2 15 PHE HB3 1.800 . 3.500 2.889 2.639 3.162 . 0 0 "[ . 1 . 2]" 1
365 1 15 PHE H 1 15 PHE HB2 1.800 . 2.900 2.297 2.138 2.530 . 0 0 "[ . 1 . 2]" 1
366 2 15 PHE H 2 15 PHE HB2 1.800 . 2.900 2.296 2.140 2.530 . 0 0 "[ . 1 . 2]" 1
367 1 15 PHE H 1 15 PHE QD 1.800 . 8.400 3.966 3.562 4.203 . 0 0 "[ . 1 . 2]" 1
368 2 15 PHE H 2 15 PHE QD 1.800 . 8.400 3.966 3.561 4.205 . 0 0 "[ . 1 . 2]" 1
369 1 14 VAL HA 1 15 PHE H 1.800 . 5.000 3.547 3.516 3.579 . 0 0 "[ . 1 . 2]" 1
370 2 14 VAL HA 2 15 PHE H 1.800 . 5.000 3.547 3.518 3.578 . 0 0 "[ . 1 . 2]" 1
371 1 14 VAL HB 1 15 PHE H 1.800 . 2.900 2.734 2.413 3.001 0.101 8 0 "[ . 1 . 2]" 1
372 2 14 VAL HB 2 15 PHE H 1.800 . 2.900 2.734 2.413 3.002 0.102 8 0 "[ . 1 . 2]" 1
373 1 14 VAL MG2 1 15 PHE H 1.800 . 4.800 3.977 3.838 4.077 . 0 0 "[ . 1 . 2]" 1
374 2 14 VAL MG2 2 15 PHE H 1.800 . 4.800 3.976 3.839 4.076 . 0 0 "[ . 1 . 2]" 1
375 1 15 PHE H 1 16 HIS H 1.800 . 5.000 2.830 2.649 3.123 . 0 0 "[ . 1 . 2]" 1
376 2 15 PHE H 2 16 HIS H 1.800 . 5.000 2.831 2.650 3.123 . 0 0 "[ . 1 . 2]" 1
377 1 11 LEU HA 1 15 PHE H 1.800 . 5.000 4.738 3.799 4.992 . 0 0 "[ . 1 . 2]" 1
378 2 11 LEU HA 2 15 PHE H 1.800 . 5.000 4.737 3.799 4.992 . 0 0 "[ . 1 . 2]" 1
379 1 12 ILE HA 1 15 PHE H 1.800 . 5.000 3.508 3.230 3.844 . 0 0 "[ . 1 . 2]" 1
380 2 12 ILE HA 2 15 PHE H 1.800 . 5.000 3.508 3.231 3.845 . 0 0 "[ . 1 . 2]" 1
381 1 12 ILE HA 1 15 PHE HB3 1.800 . 5.000 3.628 2.494 4.226 . 0 0 "[ . 1 . 2]" 1
382 2 12 ILE HA 2 15 PHE HB3 1.800 . 5.000 3.628 2.495 4.227 . 0 0 "[ . 1 . 2]" 1
383 1 13 ASP H 1 15 PHE H 1.800 . 6.000 4.146 3.956 4.320 . 0 0 "[ . 1 . 2]" 1
384 2 13 ASP H 2 15 PHE H 1.800 . 6.000 4.146 3.957 4.321 . 0 0 "[ . 1 . 2]" 1
385 1 15 PHE H 1 17 GLN H 1.800 . 5.000 3.897 3.662 4.553 . 0 0 "[ . 1 . 2]" 1
386 2 15 PHE H 2 17 GLN H 1.800 . 5.000 3.898 3.667 4.555 . 0 0 "[ . 1 . 2]" 1
387 1 15 PHE HA 1 18 TYR QB 1.800 . 7.000 3.784 2.902 6.283 . 0 0 "[ . 1 . 2]" 1
388 2 15 PHE HA 2 18 TYR QB 1.800 . 7.000 3.783 2.902 6.288 . 0 0 "[ . 1 . 2]" 1
389 1 15 PHE QD 1 36 LEU MD1 1.800 . 8.900 5.662 4.607 6.354 . 0 0 "[ . 1 . 2]" 1
390 2 15 PHE QD 2 36 LEU MD1 1.800 . 8.900 5.661 4.608 6.354 . 0 0 "[ . 1 . 2]" 1
391 1 15 PHE H 1 36 LEU MD2 1.800 . 7.500 5.888 4.956 6.146 . 0 0 "[ . 1 . 2]" 1
392 2 15 PHE H 2 36 LEU MD2 1.800 . 7.500 5.888 4.955 6.146 . 0 0 "[ . 1 . 2]" 1
393 1 15 PHE HA 1 36 LEU MD2 1.800 . 6.500 4.703 3.671 5.195 . 0 0 "[ . 1 . 2]" 1
394 2 15 PHE HA 2 36 LEU MD2 1.800 . 6.500 4.703 3.672 5.193 . 0 0 "[ . 1 . 2]" 1
395 1 15 PHE QD 1 71 PHE QB 1.800 . 9.400 3.631 2.557 4.585 . 0 0 "[ . 1 . 2]" 1
396 2 15 PHE QD 2 71 PHE QB 1.800 . 9.400 3.632 2.559 4.583 . 0 0 "[ . 1 . 2]" 1
397 1 15 PHE QD 1 71 PHE QD 1.800 . 9.800 4.586 2.222 6.217 . 0 0 "[ . 1 . 2]" 1
398 2 15 PHE QD 2 71 PHE QD 1.800 . 9.800 4.586 2.224 6.214 . 0 0 "[ . 1 . 2]" 1
399 1 15 PHE H 1 74 PHE QD 1.800 . 8.400 5.956 5.184 6.713 . 0 0 "[ . 1 . 2]" 1
400 2 15 PHE H 2 74 PHE QD 1.800 . 8.400 5.956 5.182 6.714 . 0 0 "[ . 1 . 2]" 1
401 1 15 PHE H 1 74 PHE HZ 1.800 . 5.000 4.105 3.069 5.030 0.030 6 0 "[ . 1 . 2]" 1
402 2 15 PHE H 2 74 PHE HZ 1.800 . 5.000 4.105 3.068 5.032 0.032 6 0 "[ . 1 . 2]" 1
403 1 4 LEU MD1 2 15 PHE H 1.800 . 7.500 4.835 3.842 5.351 . 0 0 "[ . 1 . 2]" 1
404 1 15 PHE H 2 4 LEU MD1 1.800 . 7.500 4.832 3.801 5.357 . 0 0 "[ . 1 . 2]" 1
405 1 88 PHE HZ 2 15 PHE QD 1.800 . 7.400 4.401 2.309 6.229 . 0 0 "[ . 1 . 2]" 1
406 1 15 PHE QD 2 88 PHE HZ 1.800 . 7.400 4.400 2.258 6.287 . 0 0 "[ . 1 . 2]" 1
407 1 16 HIS H 1 16 HIS HB3 1.800 . 3.500 2.702 2.096 3.471 . 0 0 "[ . 1 . 2]" 1
408 2 16 HIS H 2 16 HIS HB3 1.800 . 3.500 2.702 2.098 3.471 . 0 0 "[ . 1 . 2]" 1
409 1 16 HIS H 1 16 HIS HB2 1.800 . 3.500 2.511 2.139 3.312 . 0 0 "[ . 1 . 2]" 1
410 2 16 HIS H 2 16 HIS HB2 1.800 . 3.500 2.511 2.139 3.313 . 0 0 "[ . 1 . 2]" 1
411 1 15 PHE HA 1 16 HIS H 1.800 . 6.000 3.570 3.538 3.592 . 0 0 "[ . 1 . 2]" 1
412 2 15 PHE HA 2 16 HIS H 1.800 . 6.000 3.570 3.538 3.594 . 0 0 "[ . 1 . 2]" 1
413 1 15 PHE HB2 1 16 HIS H 1.800 . 6.000 3.558 3.115 4.010 . 0 0 "[ . 1 . 2]" 1
414 2 15 PHE HB2 2 16 HIS H 1.800 . 6.000 3.558 3.116 4.007 . 0 0 "[ . 1 . 2]" 1
415 1 15 PHE QD 1 16 HIS H 1.800 . 8.400 3.886 3.052 4.545 . 0 0 "[ . 1 . 2]" 1
416 2 15 PHE QD 2 16 HIS H 1.800 . 8.400 3.886 3.051 4.545 . 0 0 "[ . 1 . 2]" 1
417 1 12 ILE HA 1 16 HIS H 1.800 . 6.000 4.788 4.186 5.107 . 0 0 "[ . 1 . 2]" 1
418 2 12 ILE HA 2 16 HIS H 1.800 . 6.000 4.789 4.188 5.110 . 0 0 "[ . 1 . 2]" 1
419 1 14 VAL HA 1 16 HIS H 1.800 . 6.000 4.507 3.988 5.245 . 0 0 "[ . 1 . 2]" 1
420 2 14 VAL HA 2 16 HIS H 1.800 . 6.000 4.507 3.990 5.244 . 0 0 "[ . 1 . 2]" 1
421 1 17 GLN H 1 17 GLN HB3 1.800 . 3.500 3.027 2.399 3.497 . 0 0 "[ . 1 . 2]" 1
422 2 17 GLN H 2 17 GLN HB3 1.800 . 3.500 3.027 2.399 3.497 . 0 0 "[ . 1 . 2]" 1
423 1 17 GLN H 1 17 GLN HB2 1.800 . 2.900 2.301 2.109 2.922 0.022 1 0 "[ . 1 . 2]" 1
424 2 17 GLN H 2 17 GLN HB2 1.800 . 2.900 2.301 2.108 2.922 0.022 1 0 "[ . 1 . 2]" 1
425 1 16 HIS H 1 17 GLN H 1.800 . 3.500 2.609 2.452 2.863 . 0 0 "[ . 1 . 2]" 1
426 2 16 HIS H 2 17 GLN H 1.800 . 3.500 2.608 2.452 2.863 . 0 0 "[ . 1 . 2]" 1
427 1 16 HIS HA 1 17 GLN H 1.800 . 5.000 3.403 3.187 3.570 . 0 0 "[ . 1 . 2]" 1
428 2 16 HIS HA 2 17 GLN H 1.800 . 5.000 3.402 3.186 3.567 . 0 0 "[ . 1 . 2]" 1
429 1 16 HIS HB3 1 17 GLN H 1.800 . 6.000 3.270 2.373 3.803 . 0 0 "[ . 1 . 2]" 1
430 2 16 HIS HB3 2 17 GLN H 1.800 . 6.000 3.270 2.373 3.804 . 0 0 "[ . 1 . 2]" 1
431 1 16 HIS HB2 1 17 GLN H 1.800 . 6.000 4.067 3.473 4.584 . 0 0 "[ . 1 . 2]" 1
432 2 16 HIS HB2 2 17 GLN H 1.800 . 6.000 4.066 3.472 4.584 . 0 0 "[ . 1 . 2]" 1
433 1 17 GLN H 1 18 TYR QB 1.800 . 6.000 4.580 4.124 5.444 . 0 0 "[ . 1 . 2]" 1
434 2 17 GLN H 2 18 TYR QB 1.800 . 6.000 4.580 4.122 5.444 . 0 0 "[ . 1 . 2]" 1
435 1 14 VAL HA 1 17 GLN H 1.800 . 5.000 3.339 3.079 3.657 . 0 0 "[ . 1 . 2]" 1
436 2 14 VAL HA 2 17 GLN H 1.800 . 5.000 3.339 3.079 3.657 . 0 0 "[ . 1 . 2]" 1
437 1 14 VAL QG 1 17 GLN H 1.800 . 8.400 3.952 3.798 4.255 . 0 0 "[ . 1 . 2]" 1
438 2 14 VAL QG 2 17 GLN H 1.800 . 8.400 3.952 3.798 4.256 . 0 0 "[ . 1 . 2]" 1
439 1 18 TYR H 1 18 TYR QB 1.800 . 3.900 2.445 2.227 3.314 . 0 0 "[ . 1 . 2]" 1
440 2 18 TYR H 2 18 TYR QB 1.800 . 3.900 2.445 2.228 3.316 . 0 0 "[ . 1 . 2]" 1
441 1 17 GLN H 1 18 TYR H 1.800 . 2.900 2.549 2.161 2.904 0.004 19 0 "[ . 1 . 2]" 1
442 2 17 GLN H 2 18 TYR H 1.800 . 2.900 2.549 2.163 2.904 0.004 19 0 "[ . 1 . 2]" 1
443 1 17 GLN HA 1 18 TYR H 1.800 . 5.000 3.554 3.466 3.591 . 0 0 "[ . 1 . 2]" 1
444 2 17 GLN HA 2 18 TYR H 1.800 . 5.000 3.554 3.463 3.589 . 0 0 "[ . 1 . 2]" 1
445 1 17 GLN HB3 1 18 TYR H 1.800 . 3.500 2.621 1.963 3.489 . 0 0 "[ . 1 . 2]" 1
446 2 17 GLN HB3 2 18 TYR H 1.800 . 3.500 2.621 1.963 3.492 . 0 0 "[ . 1 . 2]" 1
447 1 17 GLN HB2 1 18 TYR H 1.800 . 3.500 3.347 2.788 3.540 0.040 3 0 "[ . 1 . 2]" 1
448 2 17 GLN HB2 2 18 TYR H 1.800 . 3.500 3.347 2.786 3.539 0.039 3 0 "[ . 1 . 2]" 1
449 1 17 GLN HB2 1 18 TYR QD 1.800 . 7.400 3.812 2.802 4.875 . 0 0 "[ . 1 . 2]" 1
450 2 17 GLN HB2 2 18 TYR QD 1.800 . 7.400 3.813 2.803 4.877 . 0 0 "[ . 1 . 2]" 1
451 1 17 GLN HG2 1 18 TYR H 1.800 . 5.000 4.570 2.416 5.052 0.052 2 0 "[ . 1 . 2]" 1
452 2 17 GLN HG2 2 18 TYR H 1.800 . 5.000 4.569 2.414 5.048 0.048 2 0 "[ . 1 . 2]" 1
453 1 18 TYR H 1 19 SER H 1.800 . 3.500 2.586 1.960 3.185 . 0 0 "[ . 1 . 2]" 1
454 2 18 TYR H 2 19 SER H 1.800 . 3.500 2.586 1.963 3.184 . 0 0 "[ . 1 . 2]" 1
455 1 18 TYR H 1 19 SER HA 1.800 . 6.000 5.096 4.034 5.618 . 0 0 "[ . 1 . 2]" 1
456 2 18 TYR H 2 19 SER HA 1.800 . 6.000 5.095 4.033 5.614 . 0 0 "[ . 1 . 2]" 1
457 1 18 TYR H 1 19 SER QB 1.800 . 7.000 4.230 3.739 4.832 . 0 0 "[ . 1 . 2]" 1
458 2 18 TYR H 2 19 SER QB 1.800 . 7.000 4.230 3.740 4.829 . 0 0 "[ . 1 . 2]" 1
459 1 14 VAL HA 1 18 TYR H 1.800 . 5.000 4.195 3.315 4.656 . 0 0 "[ . 1 . 2]" 1
460 2 14 VAL HA 2 18 TYR H 1.800 . 5.000 4.194 3.315 4.658 . 0 0 "[ . 1 . 2]" 1
461 1 14 VAL QG 1 18 TYR H 1.800 . 8.900 3.606 2.914 4.202 . 0 0 "[ . 1 . 2]" 1
462 2 14 VAL QG 2 18 TYR H 1.800 . 8.900 3.606 2.913 4.202 . 0 0 "[ . 1 . 2]" 1
463 1 16 HIS HA 1 18 TYR H 1.800 . 6.000 4.618 3.842 5.786 . 0 0 "[ . 1 . 2]" 1
464 2 16 HIS HA 2 18 TYR H 1.800 . 6.000 4.618 3.841 5.787 . 0 0 "[ . 1 . 2]" 1
465 1 18 TYR H 1 21 ARG H 1.800 . 6.000 5.510 4.731 6.080 0.080 2 0 "[ . 1 . 2]" 1
466 2 18 TYR H 2 21 ARG H 1.800 . 6.000 5.509 4.728 6.078 0.078 2 0 "[ . 1 . 2]" 1
467 1 18 TYR QB 1 28 LEU QD 1.800 . 7.700 2.599 1.835 4.501 . 0 0 "[ . 1 . 2]" 1
468 2 18 TYR QB 2 28 LEU QD 1.800 . 7.700 2.599 1.835 4.504 . 0 0 "[ . 1 . 2]" 1
469 1 18 TYR H 1 36 LEU MD2 1.800 . 6.500 4.546 3.938 5.251 . 0 0 "[ . 1 . 2]" 1
470 2 18 TYR H 2 36 LEU MD2 1.800 . 6.500 4.546 3.939 5.252 . 0 0 "[ . 1 . 2]" 1
471 1 18 TYR QB 1 36 LEU MD2 1.800 . 7.500 2.986 2.050 5.208 . 0 0 "[ . 1 . 2]" 1
472 2 18 TYR QB 2 36 LEU MD2 1.800 . 7.500 2.986 2.050 5.212 . 0 0 "[ . 1 . 2]" 1
473 1 18 TYR HA 1 19 SER H 1.800 . 5.000 3.422 2.508 3.593 . 0 0 "[ . 1 . 2]" 1
474 2 18 TYR HA 2 19 SER H 1.800 . 5.000 3.422 2.507 3.592 . 0 0 "[ . 1 . 2]" 1
475 1 18 TYR QB 1 19 SER H 1.800 . 6.000 2.757 1.942 4.033 . 0 0 "[ . 1 . 2]" 1
476 2 18 TYR QB 2 19 SER H 1.800 . 6.000 2.757 1.941 4.034 . 0 0 "[ . 1 . 2]" 1
477 1 16 HIS HA 1 19 SER H 1.800 . 5.000 3.976 3.092 4.939 . 0 0 "[ . 1 . 2]" 1
478 2 16 HIS HA 2 19 SER H 1.800 . 5.000 3.976 3.092 4.942 . 0 0 "[ . 1 . 2]" 1
479 1 19 SER H 1 28 LEU QD 1.800 . 8.400 3.364 2.270 4.549 . 0 0 "[ . 1 . 2]" 1
480 2 19 SER H 2 28 LEU QD 1.800 . 8.400 3.364 2.269 4.549 . 0 0 "[ . 1 . 2]" 1
481 1 20 GLY H 1 20 GLY HA3 1.800 . 2.900 2.445 2.347 2.875 . 0 0 "[ . 1 . 2]" 1
482 2 20 GLY H 2 20 GLY HA3 1.800 . 2.900 2.446 2.348 2.871 . 0 0 "[ . 1 . 2]" 1
483 1 20 GLY H 1 20 GLY HA2 1.800 . 2.900 2.911 2.775 2.982 0.082 4 0 "[ . 1 . 2]" 1
484 2 20 GLY H 2 20 GLY HA2 1.800 . 2.900 2.911 2.773 2.981 0.081 4 0 "[ . 1 . 2]" 1
485 1 19 SER H 1 20 GLY H 1.800 . 5.000 2.586 1.875 3.642 . 0 0 "[ . 1 . 2]" 1
486 2 19 SER H 2 20 GLY H 1.800 . 5.000 2.586 1.875 3.641 . 0 0 "[ . 1 . 2]" 1
487 1 19 SER QB 1 20 GLY H 1.800 . 6.000 3.118 2.272 3.990 . 0 0 "[ . 1 . 2]" 1
488 2 19 SER QB 2 20 GLY H 1.800 . 6.000 3.118 2.271 3.989 . 0 0 "[ . 1 . 2]" 1
489 1 20 GLY H 1 21 ARG QB 1.800 . 6.000 4.507 3.802 5.022 . 0 0 "[ . 1 . 2]" 1
490 2 20 GLY H 2 21 ARG QB 1.800 . 6.000 4.507 3.802 5.025 . 0 0 "[ . 1 . 2]" 1
491 1 16 HIS HA 1 20 GLY H 1.800 . 5.000 3.848 2.866 4.959 . 0 0 "[ . 1 . 2]" 1
492 2 16 HIS HA 2 20 GLY H 1.800 . 5.000 3.848 2.867 4.960 . 0 0 "[ . 1 . 2]" 1
493 1 18 TYR H 1 20 GLY H 1.800 . 5.000 3.982 3.185 5.021 0.021 6 0 "[ . 1 . 2]" 1
494 2 18 TYR H 2 20 GLY H 1.800 . 5.000 3.981 3.182 5.020 0.020 6 0 "[ . 1 . 2]" 1
495 1 18 TYR QB 1 20 GLY H 1.800 . 6.000 4.557 4.041 5.305 . 0 0 "[ . 1 . 2]" 1
496 2 18 TYR QB 2 20 GLY H 1.800 . 6.000 4.557 4.042 5.304 . 0 0 "[ . 1 . 2]" 1
497 1 21 ARG H 1 21 ARG QB 1.800 . 3.900 2.602 2.161 3.296 . 0 0 "[ . 1 . 2]" 1
498 2 21 ARG H 2 21 ARG QB 1.800 . 3.900 2.602 2.161 3.297 . 0 0 "[ . 1 . 2]" 1
499 1 21 ARG H 1 21 ARG HG3 1.800 . 3.500 2.640 1.896 3.504 0.004 18 0 "[ . 1 . 2]" 1
500 2 21 ARG H 2 21 ARG HG3 1.800 . 3.500 2.640 1.896 3.504 0.004 18 0 "[ . 1 . 2]" 1
501 1 20 GLY H 1 21 ARG H 1.800 . 5.000 2.600 1.867 3.695 . 0 0 "[ . 1 . 2]" 1
502 2 20 GLY H 2 21 ARG H 1.800 . 5.000 2.600 1.867 3.698 . 0 0 "[ . 1 . 2]" 1
503 1 20 GLY HA2 1 21 ARG H 1.800 . 5.000 3.313 2.506 3.588 . 0 0 "[ . 1 . 2]" 1
504 2 20 GLY HA2 2 21 ARG H 1.800 . 5.000 3.313 2.505 3.589 . 0 0 "[ . 1 . 2]" 1
505 1 18 TYR HA 1 21 ARG H 1.800 . 5.000 4.180 3.429 5.011 0.011 7 0 "[ . 1 . 2]" 1
506 2 18 TYR HA 2 21 ARG H 1.800 . 5.000 4.180 3.429 5.014 0.014 7 0 "[ . 1 . 2]" 1
507 1 18 TYR HA 1 21 ARG QB 1.800 . 6.000 4.226 2.851 5.146 . 0 0 "[ . 1 . 2]" 1
508 2 18 TYR HA 2 21 ARG QB 1.800 . 6.000 4.226 2.852 5.148 . 0 0 "[ . 1 . 2]" 1
509 1 18 TYR HA 1 21 ARG QD 1.800 . 6.000 3.501 2.243 5.159 . 0 0 "[ . 1 . 2]" 1
510 2 18 TYR HA 2 21 ARG QD 1.800 . 6.000 3.501 2.245 5.158 . 0 0 "[ . 1 . 2]" 1
511 1 22 GLU H 1 22 GLU HB3 1.800 . 3.500 3.219 2.589 3.582 0.082 10 0 "[ . 1 . 2]" 1
512 2 22 GLU H 2 22 GLU HB3 1.800 . 3.500 3.219 2.589 3.579 0.079 10 0 "[ . 1 . 2]" 1
513 1 22 GLU H 1 22 GLU QG 1.800 . 4.500 3.193 1.866 4.120 . 0 0 "[ . 1 . 2]" 1
514 2 22 GLU H 2 22 GLU QG 1.800 . 4.500 3.193 1.866 4.119 . 0 0 "[ . 1 . 2]" 1
515 1 21 ARG H 1 22 GLU H 1.800 . 5.000 3.083 1.801 4.386 . 0 0 "[ . 1 . 2]" 1
516 2 21 ARG H 2 22 GLU H 1.800 . 5.000 3.082 1.802 4.386 . 0 0 "[ . 1 . 2]" 1
517 1 21 ARG HA 1 22 GLU H 1.800 . 3.500 3.292 2.287 3.570 0.070 1 0 "[ . 1 . 2]" 1
518 2 21 ARG HA 2 22 GLU H 1.800 . 3.500 3.292 2.290 3.570 0.070 1 0 "[ . 1 . 2]" 1
519 1 21 ARG QB 1 22 GLU H 1.800 . 6.000 2.798 1.752 4.012 0.048 14 0 "[ . 1 . 2]" 1
520 2 21 ARG QB 2 22 GLU H 1.800 . 6.000 2.799 1.752 4.011 0.048 14 0 "[ . 1 . 2]" 1
521 1 23 GLY H 1 23 GLY HA2 1.800 . 2.900 2.646 2.345 2.946 0.046 10 0 "[ . 1 . 2]" 1
522 2 23 GLY H 2 23 GLY HA2 1.800 . 2.900 2.646 2.347 2.947 0.047 10 0 "[ . 1 . 2]" 1
523 1 22 GLU H 1 23 GLY H 1.800 . 6.000 3.864 2.335 4.704 . 0 0 "[ . 1 . 2]" 1
524 2 22 GLU H 2 23 GLY H 1.800 . 6.000 3.863 2.333 4.703 . 0 0 "[ . 1 . 2]" 1
525 1 22 GLU HB3 1 23 GLY H 1.800 . 3.500 2.459 1.865 3.477 . 0 0 "[ . 1 . 2]" 1
526 2 22 GLU HB3 2 23 GLY H 1.800 . 3.500 2.459 1.867 3.477 . 0 0 "[ . 1 . 2]" 1
527 1 22 GLU HB2 1 23 GLY H 1.800 . 3.500 2.828 1.873 3.509 0.009 15 0 "[ . 1 . 2]" 1
528 2 22 GLU HB2 2 23 GLY H 1.800 . 3.500 2.829 1.875 3.512 0.012 15 0 "[ . 1 . 2]" 1
529 1 22 GLU QG 1 23 GLY H 1.800 . 4.500 2.963 1.857 4.105 . 0 0 "[ . 1 . 2]" 1
530 2 22 GLU QG 2 23 GLY H 1.800 . 4.500 2.963 1.858 4.104 . 0 0 "[ . 1 . 2]" 1
531 1 24 ASP H 1 24 ASP HB3 1.800 . 3.500 3.271 2.334 3.683 0.183 19 0 "[ . 1 . 2]" 1
532 2 24 ASP H 2 24 ASP HB3 1.800 . 3.500 3.271 2.335 3.685 0.185 19 0 "[ . 1 . 2]" 1
533 1 24 ASP H 1 24 ASP HB2 1.800 . 3.500 2.853 2.148 3.592 0.092 19 0 "[ . 1 . 2]" 1
534 2 24 ASP H 2 24 ASP HB2 1.800 . 3.500 2.854 2.147 3.593 0.093 19 0 "[ . 1 . 2]" 1
535 1 23 GLY H 1 24 ASP H 1.800 . 6.000 3.830 2.187 4.668 . 0 0 "[ . 1 . 2]" 1
536 2 23 GLY H 2 24 ASP H 1.800 . 6.000 3.830 2.186 4.670 . 0 0 "[ . 1 . 2]" 1
537 1 23 GLY HA3 1 24 ASP H 1.800 . 2.900 2.468 2.182 2.923 0.023 10 0 "[ . 1 . 2]" 1
538 2 23 GLY HA3 2 24 ASP H 1.800 . 2.900 2.468 2.181 2.925 0.025 10 0 "[ . 1 . 2]" 1
539 1 23 GLY HA2 1 24 ASP H 1.800 . 3.500 3.214 2.601 3.574 0.074 1 0 "[ . 1 . 2]" 1
540 2 23 GLY HA2 2 24 ASP H 1.800 . 3.500 3.215 2.600 3.576 0.076 1 0 "[ . 1 . 2]" 1
541 1 24 ASP H 1 27 LYS HG3 1.800 . 6.000 4.717 3.182 5.687 . 0 0 "[ . 1 . 2]" 1
542 2 24 ASP H 2 27 LYS HG3 1.800 . 6.000 4.718 3.181 5.689 . 0 0 "[ . 1 . 2]" 1
543 1 24 ASP H 1 27 LYS HG2 1.800 . 6.000 4.802 2.290 5.945 . 0 0 "[ . 1 . 2]" 1
544 2 24 ASP H 2 27 LYS HG2 1.800 . 6.000 4.803 2.290 5.948 . 0 0 "[ . 1 . 2]" 1
545 1 24 ASP HA 1 25 LYS H 1.800 . 5.000 2.960 2.249 3.590 . 0 0 "[ . 1 . 2]" 1
546 2 24 ASP HA 2 25 LYS H 1.800 . 5.000 2.959 2.248 3.588 . 0 0 "[ . 1 . 2]" 1
547 1 24 ASP HB3 1 25 LYS H 1.800 . 5.000 2.912 1.836 4.362 . 0 0 "[ . 1 . 2]" 1
548 2 24 ASP HB3 2 25 LYS H 1.800 . 5.000 2.912 1.835 4.363 . 0 0 "[ . 1 . 2]" 1
549 1 24 ASP HB2 1 25 LYS H 1.800 . 5.000 3.381 2.145 4.421 . 0 0 "[ . 1 . 2]" 1
550 2 24 ASP HB2 2 25 LYS H 1.800 . 5.000 3.381 2.144 4.420 . 0 0 "[ . 1 . 2]" 1
551 1 25 LYS H 1 27 LYS H 1.800 . 6.000 3.720 2.201 4.675 . 0 0 "[ . 1 . 2]" 1
552 2 25 LYS H 2 27 LYS H 1.800 . 6.000 3.721 2.201 4.675 . 0 0 "[ . 1 . 2]" 1
553 1 26 HIS H 1 26 HIS HB2 1.800 . 3.300 3.096 2.606 3.409 0.109 17 0 "[ . 1 . 2]" 1
554 2 26 HIS H 2 26 HIS HB2 1.800 . 3.300 3.096 2.606 3.409 0.109 17 0 "[ . 1 . 2]" 1
555 1 25 LYS H 1 26 HIS H 1.800 . 6.000 2.991 1.802 4.584 . 0 0 "[ . 1 . 2]" 1
556 2 25 LYS H 2 26 HIS H 1.800 . 6.000 2.991 1.802 4.583 . 0 0 "[ . 1 . 2]" 1
557 1 25 LYS HA 1 26 HIS H 1.800 . 6.000 2.977 2.192 3.586 . 0 0 "[ . 1 . 2]" 1
558 2 25 LYS HA 2 26 HIS H 1.800 . 6.000 2.977 2.194 3.583 . 0 0 "[ . 1 . 2]" 1
559 1 25 LYS QB 1 26 HIS H 1.800 . 6.000 3.267 1.890 3.852 . 0 0 "[ . 1 . 2]" 1
560 2 25 LYS QB 2 26 HIS H 1.800 . 6.000 3.268 1.891 3.853 . 0 0 "[ . 1 . 2]" 1
561 1 26 HIS H 1 27 LYS H 1.800 . 2.900 2.273 1.835 2.930 0.030 20 0 "[ . 1 . 2]" 1
562 2 26 HIS H 2 27 LYS H 1.800 . 2.900 2.272 1.837 2.928 0.028 20 0 "[ . 1 . 2]" 1
563 1 26 HIS H 1 27 LYS HG2 1.800 . 6.000 3.734 2.277 5.531 . 0 0 "[ . 1 . 2]" 1
564 2 26 HIS H 2 27 LYS HG2 1.800 . 6.000 3.734 2.276 5.530 . 0 0 "[ . 1 . 2]" 1
565 1 15 PHE QE 1 26 HIS H 1.800 . 8.400 4.490 2.881 6.124 . 0 0 "[ . 1 . 2]" 1
566 2 15 PHE QE 2 26 HIS H 1.800 . 8.400 4.490 2.882 6.121 . 0 0 "[ . 1 . 2]" 1
567 1 19 SER HA 1 26 HIS H 1.800 . 6.000 5.758 4.478 6.027 0.027 17 0 "[ . 1 . 2]" 1
568 2 19 SER HA 2 26 HIS H 1.800 . 6.000 5.757 4.479 6.023 0.023 17 0 "[ . 1 . 2]" 1
569 1 27 LYS H 1 27 LYS QB 1.800 . 3.900 3.086 2.779 3.323 . 0 0 "[ . 1 . 2]" 1
570 2 27 LYS H 2 27 LYS QB 1.800 . 3.900 3.085 2.780 3.324 . 0 0 "[ . 1 . 2]" 1
571 1 26 HIS HA 1 27 LYS H 1.800 . 6.000 3.085 2.740 3.259 . 0 0 "[ . 1 . 2]" 1
572 2 26 HIS HA 2 27 LYS H 1.800 . 6.000 3.085 2.738 3.258 . 0 0 "[ . 1 . 2]" 1
573 1 26 HIS HB3 1 27 LYS H 1.800 . 6.000 4.191 3.645 4.664 . 0 0 "[ . 1 . 2]" 1
574 2 26 HIS HB3 2 27 LYS H 1.800 . 6.000 4.191 3.645 4.665 . 0 0 "[ . 1 . 2]" 1
575 1 26 HIS HB2 1 27 LYS H 1.800 . 5.000 4.195 3.753 4.632 . 0 0 "[ . 1 . 2]" 1
576 2 26 HIS HB2 2 27 LYS H 1.800 . 5.000 4.195 3.752 4.633 . 0 0 "[ . 1 . 2]" 1
577 1 27 LYS H 1 28 LEU QD 1.800 . 8.900 4.526 3.427 5.625 . 0 0 "[ . 1 . 2]" 1
578 2 27 LYS H 2 28 LEU QD 1.800 . 8.900 4.525 3.427 5.624 . 0 0 "[ . 1 . 2]" 1
579 1 24 ASP HB3 1 27 LYS H 1.800 . 6.000 4.340 2.563 5.772 . 0 0 "[ . 1 . 2]" 1
580 2 24 ASP HB3 2 27 LYS H 1.800 . 6.000 4.340 2.564 5.768 . 0 0 "[ . 1 . 2]" 1
581 1 24 ASP HB2 1 27 LYS QB 1.800 . 6.000 4.158 1.906 5.350 . 0 0 "[ . 1 . 2]" 1
582 2 24 ASP HB2 2 27 LYS QB 1.800 . 6.000 4.159 1.906 5.350 . 0 0 "[ . 1 . 2]" 1
583 1 25 LYS HA 1 27 LYS H 1.800 . 6.000 3.922 3.007 4.646 . 0 0 "[ . 1 . 2]" 1
584 2 25 LYS HA 2 27 LYS H 1.800 . 6.000 3.923 3.006 4.644 . 0 0 "[ . 1 . 2]" 1
585 1 19 SER HA 1 27 LYS H 1.800 . 6.000 4.844 3.998 5.298 . 0 0 "[ . 1 . 2]" 1
586 2 19 SER HA 2 27 LYS H 1.800 . 6.000 4.844 3.999 5.298 . 0 0 "[ . 1 . 2]" 1
587 1 19 SER QB 1 27 LYS H 1.800 . 6.000 3.821 3.075 4.208 . 0 0 "[ . 1 . 2]" 1
588 2 19 SER QB 2 27 LYS H 1.800 . 6.000 3.820 3.074 4.205 . 0 0 "[ . 1 . 2]" 1
589 1 27 LYS HA 1 70 ASP HA 1.800 . 3.300 3.234 2.980 3.362 0.062 13 0 "[ . 1 . 2]" 1
590 2 27 LYS HA 2 70 ASP HA 1.800 . 3.300 3.235 2.982 3.365 0.065 13 0 "[ . 1 . 2]" 1
591 1 15 PHE HZ 1 27 LYS H 1.800 . 6.000 4.338 3.661 5.706 . 0 0 "[ . 1 . 2]" 1
592 2 15 PHE HZ 2 27 LYS H 1.800 . 6.000 4.338 3.660 5.705 . 0 0 "[ . 1 . 2]" 1
593 1 15 PHE QE 1 27 LYS H 1.800 . 8.400 3.725 2.860 5.002 . 0 0 "[ . 1 . 2]" 1
594 2 15 PHE QE 2 27 LYS H 1.800 . 8.400 3.724 2.860 5.001 . 0 0 "[ . 1 . 2]" 1
595 1 28 LEU H 1 28 LEU HB2 1.800 . 3.500 2.422 2.206 2.888 . 0 0 "[ . 1 . 2]" 1
596 2 28 LEU H 2 28 LEU HB2 1.800 . 3.500 2.421 2.207 2.886 . 0 0 "[ . 1 . 2]" 1
597 1 28 LEU H 1 28 LEU QD 1.800 . 6.700 3.503 2.911 3.915 . 0 0 "[ . 1 . 2]" 1
598 2 28 LEU H 2 28 LEU QD 1.800 . 6.700 3.503 2.912 3.913 . 0 0 "[ . 1 . 2]" 1
599 1 27 LYS H 1 28 LEU H 1.800 . 6.000 4.317 4.171 4.455 . 0 0 "[ . 1 . 2]" 1
600 2 27 LYS H 2 28 LEU H 1.800 . 6.000 4.317 4.174 4.455 . 0 0 "[ . 1 . 2]" 1
601 1 27 LYS HA 1 28 LEU H 1.800 . 2.900 2.256 2.178 2.468 . 0 0 "[ . 1 . 2]" 1
602 2 27 LYS HA 2 28 LEU H 1.800 . 2.900 2.256 2.179 2.470 . 0 0 "[ . 1 . 2]" 1
603 1 27 LYS QB 1 28 LEU H 1.800 . 3.900 3.019 2.474 3.356 . 0 0 "[ . 1 . 2]" 1
604 2 27 LYS QB 2 28 LEU H 1.800 . 3.900 3.019 2.474 3.353 . 0 0 "[ . 1 . 2]" 1
605 1 28 LEU QD 1 32 GLU HA 1.800 . 8.900 4.252 3.917 4.706 . 0 0 "[ . 1 . 2]" 1
606 2 28 LEU QD 2 32 GLU HA 1.800 . 8.900 4.252 3.918 4.706 . 0 0 "[ . 1 . 2]" 1
607 1 28 LEU QD 1 32 GLU HB3 1.800 . 7.900 2.231 1.753 3.055 0.047 9 0 "[ . 1 . 2]" 1
608 2 28 LEU QD 2 32 GLU HB3 1.800 . 7.900 2.231 1.753 3.056 0.047 9 0 "[ . 1 . 2]" 1
609 1 28 LEU QD 1 32 GLU HB2 1.800 . 7.900 3.445 2.649 4.280 . 0 0 "[ . 1 . 2]" 1
610 2 28 LEU QD 2 32 GLU HB2 1.800 . 7.900 3.445 2.648 4.280 . 0 0 "[ . 1 . 2]" 1
611 1 28 LEU QD 1 32 GLU QG 1.800 . 8.900 2.457 1.776 3.120 0.024 19 0 "[ . 1 . 2]" 1
612 2 28 LEU QD 2 32 GLU QG 1.800 . 8.900 2.457 1.776 3.119 0.024 19 0 "[ . 1 . 2]" 1
613 1 28 LEU QD 1 33 LEU HA 1.800 . 6.200 2.951 1.952 3.640 . 0 0 "[ . 1 . 2]" 1
614 2 28 LEU QD 2 33 LEU HA 1.800 . 6.200 2.951 1.950 3.640 . 0 0 "[ . 1 . 2]" 1
615 1 28 LEU QD 1 33 LEU HB2 1.800 . 7.900 2.889 1.892 3.744 . 0 0 "[ . 1 . 2]" 1
616 2 28 LEU QD 2 33 LEU HB2 1.800 . 7.900 2.889 1.892 3.744 . 0 0 "[ . 1 . 2]" 1
617 1 15 PHE HZ 1 28 LEU H 1.800 . 5.000 3.153 2.245 4.561 . 0 0 "[ . 1 . 2]" 1
618 2 15 PHE HZ 2 28 LEU H 1.800 . 5.000 3.152 2.247 4.562 . 0 0 "[ . 1 . 2]" 1
619 1 18 TYR QD 1 28 LEU QD 1.800 . 10.300 3.666 2.896 4.077 . 0 0 "[ . 1 . 2]" 1
620 2 18 TYR QD 2 28 LEU QD 1.800 . 10.300 3.667 2.897 4.078 . 0 0 "[ . 1 . 2]" 1
621 1 19 SER HA 1 28 LEU QD 1.800 . 7.900 3.014 1.751 4.296 0.049 2 0 "[ . 1 . 2]" 1
622 2 19 SER HA 2 28 LEU QD 1.800 . 7.900 3.014 1.751 4.297 0.049 2 0 "[ . 1 . 2]" 1
623 1 28 LEU H 1 68 GLU HA 1.800 . 6.000 4.983 3.935 5.506 . 0 0 "[ . 1 . 2]" 1
624 2 28 LEU H 2 68 GLU HA 1.800 . 6.000 4.982 3.937 5.506 . 0 0 "[ . 1 . 2]" 1
625 1 28 LEU H 1 69 CYS H 1.800 . 3.500 3.224 2.303 3.530 0.030 11 0 "[ . 1 . 2]" 1
626 2 28 LEU H 2 69 CYS H 1.800 . 3.500 3.224 2.304 3.530 0.030 11 0 "[ . 1 . 2]" 1
627 1 28 LEU HA 1 69 CYS H 1.800 . 5.000 4.530 4.112 4.740 . 0 0 "[ . 1 . 2]" 1
628 2 28 LEU HA 2 69 CYS H 1.800 . 5.000 4.530 4.111 4.738 . 0 0 "[ . 1 . 2]" 1
629 1 28 LEU H 1 69 CYS HA 1.800 . 6.000 4.928 4.480 5.152 . 0 0 "[ . 1 . 2]" 1
630 2 28 LEU H 2 69 CYS HA 1.800 . 6.000 4.929 4.481 5.153 . 0 0 "[ . 1 . 2]" 1
631 1 28 LEU QD 1 69 CYS HB2 1.800 . 8.900 3.919 3.206 4.783 . 0 0 "[ . 1 . 2]" 1
632 2 28 LEU QD 2 69 CYS HB2 1.800 . 8.900 3.919 3.204 4.783 . 0 0 "[ . 1 . 2]" 1
633 1 28 LEU H 1 70 ASP HA 1.800 . 5.000 3.679 3.240 4.012 . 0 0 "[ . 1 . 2]" 1
634 2 28 LEU H 2 70 ASP HA 1.800 . 5.000 3.679 3.243 4.012 . 0 0 "[ . 1 . 2]" 1
635 1 28 LEU QD 1 74 PHE QD 1.800 . 11.300 3.047 2.394 3.843 . 0 0 "[ . 1 . 2]" 1
636 2 28 LEU QD 2 74 PHE QD 1.800 . 11.300 3.047 2.395 3.844 . 0 0 "[ . 1 . 2]" 1
637 1 28 LEU QD 1 74 PHE QE 1.800 . 11.300 3.638 2.414 4.378 . 0 0 "[ . 1 . 2]" 1
638 2 28 LEU QD 2 74 PHE QE 1.800 . 11.300 3.638 2.414 4.378 . 0 0 "[ . 1 . 2]" 1
639 1 29 LYS H 1 29 LYS HB2 1.800 . 3.500 2.723 2.140 2.864 . 0 0 "[ . 1 . 2]" 1
640 2 29 LYS H 2 29 LYS HB2 1.800 . 3.500 2.723 2.140 2.864 . 0 0 "[ . 1 . 2]" 1
641 1 29 LYS H 1 29 LYS QG 1.800 . 4.500 3.804 3.239 4.093 . 0 0 "[ . 1 . 2]" 1
642 2 29 LYS H 2 29 LYS QG 1.800 . 4.500 3.803 3.239 4.093 . 0 0 "[ . 1 . 2]" 1
643 1 28 LEU H 1 29 LYS H 1.800 . 6.000 4.327 4.206 4.469 . 0 0 "[ . 1 . 2]" 1
644 2 28 LEU H 2 29 LYS H 1.800 . 6.000 4.327 4.207 4.471 . 0 0 "[ . 1 . 2]" 1
645 1 28 LEU HA 1 29 LYS H 1.800 . 2.900 2.825 2.243 2.923 0.023 4 0 "[ . 1 . 2]" 1
646 2 28 LEU HA 2 29 LYS H 1.800 . 2.900 2.825 2.243 2.922 0.022 4 0 "[ . 1 . 2]" 1
647 1 28 LEU HB2 1 29 LYS H 1.800 . 6.000 3.531 3.422 4.427 . 0 0 "[ . 1 . 2]" 1
648 2 28 LEU HB2 2 29 LYS H 1.800 . 6.000 3.530 3.422 4.427 . 0 0 "[ . 1 . 2]" 1
649 1 28 LEU QD 1 29 LYS H 1.800 . 6.900 2.141 1.756 3.620 0.044 7 0 "[ . 1 . 2]" 1
650 2 28 LEU QD 2 29 LYS H 1.800 . 6.900 2.141 1.755 3.622 0.045 7 0 "[ . 1 . 2]" 1
651 1 29 LYS H 1 30 LYS H 1.800 . 6.000 4.398 4.175 4.584 . 0 0 "[ . 1 . 2]" 1
652 2 29 LYS H 2 30 LYS H 1.800 . 6.000 4.397 4.174 4.583 . 0 0 "[ . 1 . 2]" 1
653 1 29 LYS H 1 32 GLU HB3 1.800 . 5.000 2.833 2.383 3.190 . 0 0 "[ . 1 . 2]" 1
654 2 29 LYS H 2 32 GLU HB3 1.800 . 5.000 2.833 2.381 3.190 . 0 0 "[ . 1 . 2]" 1
655 1 29 LYS H 1 32 GLU HB2 1.800 . 6.000 4.044 3.380 4.595 . 0 0 "[ . 1 . 2]" 1
656 2 29 LYS H 2 32 GLU HB2 1.800 . 6.000 4.045 3.380 4.595 . 0 0 "[ . 1 . 2]" 1
657 1 29 LYS H 1 32 GLU QG 1.800 . 6.000 4.523 4.033 4.986 . 0 0 "[ . 1 . 2]" 1
658 2 29 LYS H 2 32 GLU QG 1.800 . 6.000 4.523 4.031 4.984 . 0 0 "[ . 1 . 2]" 1
659 1 29 LYS H 1 32 GLU H 1.800 . 6.000 3.835 3.473 4.134 . 0 0 "[ . 1 . 2]" 1
660 2 29 LYS H 2 32 GLU H 1.800 . 6.000 3.835 3.473 4.135 . 0 0 "[ . 1 . 2]" 1
661 1 29 LYS H 1 33 LEU H 1.800 . 6.000 3.761 3.285 4.373 . 0 0 "[ . 1 . 2]" 1
662 2 29 LYS H 2 33 LEU H 1.800 . 6.000 3.761 3.287 4.373 . 0 0 "[ . 1 . 2]" 1
663 1 29 LYS H 1 33 LEU HA 1.800 . 6.000 4.922 4.406 5.811 . 0 0 "[ . 1 . 2]" 1
664 2 29 LYS H 2 33 LEU HA 1.800 . 6.000 4.921 4.408 5.811 . 0 0 "[ . 1 . 2]" 1
665 1 29 LYS HA 1 68 GLU HA 1.800 . 2.900 2.193 1.817 2.926 0.026 7 0 "[ . 1 . 2]" 1
666 2 29 LYS HA 2 68 GLU HA 1.800 . 2.900 2.192 1.815 2.924 0.024 7 0 "[ . 1 . 2]" 1
667 1 30 LYS H 1 30 LYS QB 1.800 . 3.900 2.585 2.107 2.888 . 0 0 "[ . 1 . 2]" 1
668 2 30 LYS H 2 30 LYS QB 1.800 . 3.900 2.585 2.106 2.890 . 0 0 "[ . 1 . 2]" 1
669 1 30 LYS H 1 30 LYS QG 1.800 . 4.500 2.095 1.677 4.003 0.123 1 0 "[ . 1 . 2]" 1
670 2 30 LYS H 2 30 LYS QG 1.800 . 4.500 2.095 1.677 4.003 0.123 1 0 "[ . 1 . 2]" 1
671 1 30 LYS H 1 30 LYS HD2 1.800 . 4.300 3.885 2.497 4.320 0.020 14 0 "[ . 1 . 2]" 1
672 2 30 LYS H 2 30 LYS HD2 1.800 . 4.300 3.885 2.498 4.319 0.019 14 0 "[ . 1 . 2]" 1
673 1 29 LYS HA 1 30 LYS H 1.800 . 2.900 2.449 2.210 2.692 . 0 0 "[ . 1 . 2]" 1
674 2 29 LYS HA 2 30 LYS H 1.800 . 2.900 2.449 2.211 2.692 . 0 0 "[ . 1 . 2]" 1
675 1 30 LYS H 1 32 GLU H 1.800 . 6.000 4.189 3.862 4.646 . 0 0 "[ . 1 . 2]" 1
676 2 30 LYS H 2 32 GLU H 1.800 . 6.000 4.188 3.862 4.643 . 0 0 "[ . 1 . 2]" 1
677 1 30 LYS H 1 32 GLU HB3 1.800 . 6.000 5.826 5.597 6.024 0.024 4 0 "[ . 1 . 2]" 1
678 2 30 LYS H 2 32 GLU HB3 1.800 . 6.000 5.825 5.596 6.023 0.023 4 0 "[ . 1 . 2]" 1
679 1 30 LYS H 1 33 LEU H 1.800 . 6.000 4.574 4.380 4.833 . 0 0 "[ . 1 . 2]" 1
680 2 30 LYS H 2 33 LEU H 1.800 . 6.000 4.572 4.383 4.828 . 0 0 "[ . 1 . 2]" 1
681 1 30 LYS H 1 33 LEU HB3 1.800 . 5.000 4.689 4.426 5.016 0.016 8 0 "[ . 1 . 2]" 1
682 2 30 LYS H 2 33 LEU HB3 1.800 . 5.000 4.688 4.424 5.017 0.017 8 0 "[ . 1 . 2]" 1
683 1 30 LYS HA 1 33 LEU HB3 1.800 . 3.300 2.258 1.892 2.620 . 0 0 "[ . 1 . 2]" 1
684 2 30 LYS HA 2 33 LEU HB3 1.800 . 3.300 2.258 1.893 2.619 . 0 0 "[ . 1 . 2]" 1
685 1 30 LYS HA 1 33 LEU HB2 1.800 . 5.000 3.475 3.189 3.802 . 0 0 "[ . 1 . 2]" 1
686 2 30 LYS HA 2 33 LEU HB2 1.800 . 5.000 3.474 3.188 3.803 . 0 0 "[ . 1 . 2]" 1
687 1 30 LYS H 1 33 LEU MD2 1.800 . 7.500 5.267 4.924 5.661 . 0 0 "[ . 1 . 2]" 1
688 2 30 LYS H 2 33 LEU MD2 1.800 . 7.500 5.267 4.924 5.661 . 0 0 "[ . 1 . 2]" 1
689 1 30 LYS H 1 61 LEU MD2 1.800 . 7.500 4.654 4.250 5.055 . 0 0 "[ . 1 . 2]" 1
690 2 30 LYS H 2 61 LEU MD2 1.800 . 7.500 4.654 4.248 5.055 . 0 0 "[ . 1 . 2]" 1
691 1 30 LYS HA 1 61 LEU MD2 1.800 . 6.500 2.462 2.114 2.981 . 0 0 "[ . 1 . 2]" 1
692 2 30 LYS HA 2 61 LEU MD2 1.800 . 6.500 2.462 2.115 2.980 . 0 0 "[ . 1 . 2]" 1
693 1 30 LYS H 1 68 GLU H 1.800 . 6.000 5.026 4.250 5.620 . 0 0 "[ . 1 . 2]" 1
694 2 30 LYS H 2 68 GLU H 1.800 . 6.000 5.026 4.249 5.618 . 0 0 "[ . 1 . 2]" 1
695 1 30 LYS H 1 68 GLU HA 1.800 . 5.000 3.787 2.576 4.438 . 0 0 "[ . 1 . 2]" 1
696 2 30 LYS H 2 68 GLU HA 1.800 . 5.000 3.788 2.576 4.439 . 0 0 "[ . 1 . 2]" 1
697 1 31 SER H 1 31 SER QB 1.800 . 3.900 2.340 2.078 2.911 . 0 0 "[ . 1 . 2]" 1
698 2 31 SER H 2 31 SER QB 1.800 . 3.900 2.340 2.079 2.911 . 0 0 "[ . 1 . 2]" 1
699 1 30 LYS H 1 31 SER H 1.800 . 3.500 2.520 2.246 2.977 . 0 0 "[ . 1 . 2]" 1
700 2 30 LYS H 2 31 SER H 1.800 . 3.500 2.520 2.247 2.975 . 0 0 "[ . 1 . 2]" 1
701 1 30 LYS QB 1 31 SER H 1.800 . 4.500 3.102 2.727 3.659 . 0 0 "[ . 1 . 2]" 1
702 2 30 LYS QB 2 31 SER H 1.800 . 4.500 3.103 2.727 3.659 . 0 0 "[ . 1 . 2]" 1
703 1 30 LYS QG 1 31 SER H 1.800 . 4.500 3.382 2.030 3.951 . 0 0 "[ . 1 . 2]" 1
704 2 30 LYS QG 2 31 SER H 1.800 . 4.500 3.382 2.030 3.949 . 0 0 "[ . 1 . 2]" 1
705 1 30 LYS HD3 1 31 SER H 1.800 . 5.000 4.751 3.395 5.061 0.061 5 0 "[ . 1 . 2]" 1
706 2 30 LYS HD3 2 31 SER H 1.800 . 5.000 4.750 3.396 5.063 0.063 5 0 "[ . 1 . 2]" 1
707 1 31 SER H 1 32 GLU H 1.800 . 2.900 2.491 2.421 2.671 . 0 0 "[ . 1 . 2]" 1
708 2 31 SER H 2 32 GLU H 1.800 . 2.900 2.490 2.420 2.667 . 0 0 "[ . 1 . 2]" 1
709 1 31 SER H 1 32 GLU HB3 1.800 . 6.000 4.987 4.717 5.201 . 0 0 "[ . 1 . 2]" 1
710 2 31 SER H 2 32 GLU HB3 1.800 . 6.000 4.986 4.714 5.200 . 0 0 "[ . 1 . 2]" 1
711 1 29 LYS H 1 31 SER H 1.800 . 5.000 4.896 4.607 5.069 0.069 13 0 "[ . 1 . 2]" 1
712 2 29 LYS H 2 31 SER H 1.800 . 5.000 4.896 4.606 5.068 0.068 13 0 "[ . 1 . 2]" 1
713 1 29 LYS HA 1 31 SER H 1.800 . 6.000 4.150 3.774 4.501 . 0 0 "[ . 1 . 2]" 1
714 2 29 LYS HA 2 31 SER H 1.800 . 6.000 4.150 3.773 4.501 . 0 0 "[ . 1 . 2]" 1
715 1 29 LYS HB3 1 31 SER H 1.800 . 3.500 2.386 2.133 2.563 . 0 0 "[ . 1 . 2]" 1
716 2 29 LYS HB3 2 31 SER H 1.800 . 3.500 2.387 2.132 2.564 . 0 0 "[ . 1 . 2]" 1
717 1 29 LYS QE 1 31 SER H 1.800 . 6.000 4.137 3.076 5.057 . 0 0 "[ . 1 . 2]" 1
718 2 29 LYS QE 2 31 SER H 1.800 . 6.000 4.137 3.079 5.060 . 0 0 "[ . 1 . 2]" 1
719 1 31 SER H 1 34 LYS HB3 1.800 . 6.000 5.837 5.493 5.983 . 0 0 "[ . 1 . 2]" 1
720 2 31 SER H 2 34 LYS HB3 1.800 . 6.000 5.836 5.493 5.984 . 0 0 "[ . 1 . 2]" 1
721 1 31 SER H 1 61 LEU MD2 1.800 . 7.500 4.423 4.025 4.783 . 0 0 "[ . 1 . 2]" 1
722 2 31 SER H 2 61 LEU MD2 1.800 . 7.500 4.424 4.027 4.784 . 0 0 "[ . 1 . 2]" 1
723 1 31 SER H 1 65 GLY QA 1.800 . 6.000 4.062 3.248 5.097 . 0 0 "[ . 1 . 2]" 1
724 2 31 SER H 2 65 GLY QA 1.800 . 6.000 4.062 3.250 5.097 . 0 0 "[ . 1 . 2]" 1
725 1 31 SER H 1 65 GLY H 1.800 . 6.000 5.686 4.962 6.033 0.033 13 0 "[ . 1 . 2]" 1
726 2 31 SER H 2 65 GLY H 1.800 . 6.000 5.686 4.962 6.034 0.034 13 0 "[ . 1 . 2]" 1
727 1 31 SER H 1 66 ASP H 1.800 . 6.000 5.657 4.924 6.120 0.120 13 0 "[ . 1 . 2]" 1
728 2 31 SER H 2 66 ASP H 1.800 . 6.000 5.657 4.925 6.121 0.121 13 0 "[ . 1 . 2]" 1
729 1 32 GLU H 1 32 GLU HB3 1.800 . 2.900 2.718 2.459 2.909 0.009 9 0 "[ . 1 . 2]" 1
730 2 32 GLU H 2 32 GLU HB3 1.800 . 2.900 2.719 2.460 2.907 0.007 9 0 "[ . 1 . 2]" 1
731 1 32 GLU H 1 32 GLU HB2 1.800 . 3.500 2.491 2.346 2.707 . 0 0 "[ . 1 . 2]" 1
732 2 32 GLU H 2 32 GLU HB2 1.800 . 3.500 2.492 2.346 2.708 . 0 0 "[ . 1 . 2]" 1
733 1 32 GLU H 1 32 GLU QG 1.800 . 4.500 4.008 3.919 4.072 . 0 0 "[ . 1 . 2]" 1
734 2 32 GLU H 2 32 GLU QG 1.800 . 4.500 4.008 3.920 4.071 . 0 0 "[ . 1 . 2]" 1
735 1 31 SER HA 1 32 GLU H 1.800 . 5.000 3.553 3.498 3.582 . 0 0 "[ . 1 . 2]" 1
736 2 31 SER HA 2 32 GLU H 1.800 . 5.000 3.553 3.497 3.582 . 0 0 "[ . 1 . 2]" 1
737 1 31 SER QB 1 32 GLU H 1.800 . 6.000 2.837 2.524 3.419 . 0 0 "[ . 1 . 2]" 1
738 2 31 SER QB 2 32 GLU H 1.800 . 6.000 2.836 2.524 3.418 . 0 0 "[ . 1 . 2]" 1
739 1 32 GLU H 1 33 LEU HB2 1.800 . 5.000 4.898 4.802 5.028 0.028 16 0 "[ . 1 . 2]" 1
740 2 32 GLU H 2 33 LEU HB2 1.800 . 5.000 4.898 4.803 5.028 0.028 16 0 "[ . 1 . 2]" 1
741 1 28 LEU QD 1 32 GLU H 1.800 . 7.400 4.013 3.645 4.545 . 0 0 "[ . 1 . 2]" 1
742 2 28 LEU QD 2 32 GLU H 1.800 . 7.400 4.013 3.643 4.547 . 0 0 "[ . 1 . 2]" 1
743 1 29 LYS HA 1 32 GLU H 1.800 . 6.000 4.666 4.429 5.058 . 0 0 "[ . 1 . 2]" 1
744 2 29 LYS HA 2 32 GLU H 1.800 . 6.000 4.666 4.426 5.063 . 0 0 "[ . 1 . 2]" 1
745 1 29 LYS HB3 1 32 GLU H 1.800 . 5.000 2.632 2.156 3.409 . 0 0 "[ . 1 . 2]" 1
746 2 29 LYS HB3 2 32 GLU H 1.800 . 5.000 2.631 2.157 3.408 . 0 0 "[ . 1 . 2]" 1
747 1 29 LYS HB2 1 32 GLU H 1.800 . 3.500 3.127 2.513 3.486 . 0 0 "[ . 1 . 2]" 1
748 2 29 LYS HB2 2 32 GLU H 1.800 . 3.500 3.128 2.513 3.486 . 0 0 "[ . 1 . 2]" 1
749 1 29 LYS QD 1 32 GLU H 1.800 . 6.000 4.392 3.925 4.961 . 0 0 "[ . 1 . 2]" 1
750 2 29 LYS QD 2 32 GLU H 1.800 . 6.000 4.391 3.924 4.960 . 0 0 "[ . 1 . 2]" 1
751 1 32 GLU H 1 34 LYS HB3 1.800 . 6.000 5.641 5.451 5.911 . 0 0 "[ . 1 . 2]" 1
752 2 32 GLU H 2 34 LYS HB3 1.800 . 6.000 5.641 5.452 5.915 . 0 0 "[ . 1 . 2]" 1
753 1 32 GLU H 1 35 GLU H 1.800 . 6.000 4.811 4.643 4.985 . 0 0 "[ . 1 . 2]" 1
754 2 32 GLU H 2 35 GLU H 1.800 . 6.000 4.810 4.644 4.985 . 0 0 "[ . 1 . 2]" 1
755 1 32 GLU HA 1 35 GLU HB3 1.800 . 3.300 3.366 3.327 3.426 0.126 4 0 "[ . 1 . 2]" 1
756 2 32 GLU HA 2 35 GLU HB3 1.800 . 3.300 3.366 3.327 3.426 0.126 4 0 "[ . 1 . 2]" 1
757 1 32 GLU H 1 36 LEU HB2 1.800 . 6.000 6.080 6.029 6.126 0.126 9 0 "[ . 1 . 2]" 1
758 2 32 GLU H 2 36 LEU HB2 1.800 . 6.000 6.079 6.032 6.125 0.125 9 0 "[ . 1 . 2]" 1
759 1 33 LEU HA 1 33 LEU MD1 1.800 . 4.200 1.935 1.811 2.127 . 0 0 "[ . 1 . 2]" 1
760 2 33 LEU HA 2 33 LEU MD1 1.800 . 4.200 1.935 1.810 2.127 . 0 0 "[ . 1 . 2]" 1
761 1 33 LEU H 1 33 LEU HB2 1.800 . 2.900 2.858 2.773 2.943 0.043 13 0 "[ . 1 . 2]" 1
762 2 33 LEU H 2 33 LEU HB2 1.800 . 2.900 2.859 2.773 2.944 0.044 13 0 "[ . 1 . 2]" 1
763 1 33 LEU H 1 33 LEU MD2 1.800 . 6.500 4.311 4.208 4.371 . 0 0 "[ . 1 . 2]" 1
764 2 33 LEU H 2 33 LEU MD2 1.800 . 6.500 4.312 4.208 4.370 . 0 0 "[ . 1 . 2]" 1
765 1 32 GLU H 1 33 LEU H 1.800 . 2.900 2.339 2.194 2.479 . 0 0 "[ . 1 . 2]" 1
766 2 32 GLU H 2 33 LEU H 1.800 . 2.900 2.339 2.192 2.479 . 0 0 "[ . 1 . 2]" 1
767 1 32 GLU HB3 1 33 LEU H 1.800 . 3.500 3.090 2.970 3.196 . 0 0 "[ . 1 . 2]" 1
768 2 32 GLU HB3 2 33 LEU H 1.800 . 3.500 3.090 2.972 3.197 . 0 0 "[ . 1 . 2]" 1
769 1 32 GLU HB2 1 33 LEU H 1.800 . 5.000 3.955 3.745 4.144 . 0 0 "[ . 1 . 2]" 1
770 2 32 GLU HB2 2 33 LEU H 1.800 . 5.000 3.956 3.745 4.143 . 0 0 "[ . 1 . 2]" 1
771 1 32 GLU QG 1 33 LEU H 1.800 . 6.000 4.196 3.818 4.386 . 0 0 "[ . 1 . 2]" 1
772 2 32 GLU QG 2 33 LEU H 1.800 . 6.000 4.196 3.819 4.387 . 0 0 "[ . 1 . 2]" 1
773 1 33 LEU H 1 34 LYS HB2 1.800 . 5.000 4.427 4.270 4.681 . 0 0 "[ . 1 . 2]" 1
774 2 33 LEU H 2 34 LYS HB2 1.800 . 5.000 4.427 4.272 4.681 . 0 0 "[ . 1 . 2]" 1
775 1 28 LEU HB3 1 33 LEU H 1.800 . 5.000 4.787 4.530 5.045 0.045 4 0 "[ . 1 . 2]" 1
776 2 28 LEU HB3 2 33 LEU H 1.800 . 5.000 4.787 4.530 5.046 0.046 4 0 "[ . 1 . 2]" 1
777 1 28 LEU QD 1 33 LEU H 1.800 . 6.900 3.389 3.000 4.087 . 0 0 "[ . 1 . 2]" 1
778 2 28 LEU QD 2 33 LEU H 1.800 . 6.900 3.389 2.998 4.085 . 0 0 "[ . 1 . 2]" 1
779 1 28 LEU QD 1 33 LEU MD1 1.800 . 8.200 3.206 2.173 3.958 . 0 0 "[ . 1 . 2]" 1
780 2 28 LEU QD 2 33 LEU MD1 1.800 . 8.200 3.206 2.172 3.956 . 0 0 "[ . 1 . 2]" 1
781 1 30 LYS HA 1 33 LEU H 1.800 . 3.500 3.386 3.224 3.563 0.063 1 0 "[ . 1 . 2]" 1
782 2 30 LYS HA 2 33 LEU H 1.800 . 3.500 3.386 3.223 3.562 0.062 1 0 "[ . 1 . 2]" 1
783 1 30 LYS HA 1 33 LEU MD2 1.800 . 6.500 3.148 2.746 3.550 . 0 0 "[ . 1 . 2]" 1
784 2 30 LYS HA 2 33 LEU MD2 1.800 . 6.500 3.148 2.746 3.549 . 0 0 "[ . 1 . 2]" 1
785 1 31 SER H 1 33 LEU H 1.800 . 6.000 3.593 3.391 3.820 . 0 0 "[ . 1 . 2]" 1
786 2 31 SER H 2 33 LEU H 1.800 . 6.000 3.592 3.393 3.819 . 0 0 "[ . 1 . 2]" 1
787 1 31 SER HA 1 33 LEU H 1.800 . 6.000 4.060 3.851 4.198 . 0 0 "[ . 1 . 2]" 1
788 2 31 SER HA 2 33 LEU H 1.800 . 6.000 4.060 3.852 4.199 . 0 0 "[ . 1 . 2]" 1
789 1 33 LEU H 1 36 LEU H 1.800 . 6.000 4.343 4.125 4.494 . 0 0 "[ . 1 . 2]" 1
790 2 33 LEU H 2 36 LEU H 1.800 . 6.000 4.342 4.122 4.492 . 0 0 "[ . 1 . 2]" 1
791 1 33 LEU MD1 1 36 LEU HB2 1.800 . 6.500 2.897 2.725 3.058 . 0 0 "[ . 1 . 2]" 1
792 2 33 LEU MD1 2 36 LEU HB2 1.800 . 6.500 2.897 2.727 3.058 . 0 0 "[ . 1 . 2]" 1
793 1 33 LEU MD1 1 37 ILE MD 1.800 . 6.300 2.504 1.998 3.001 . 0 0 "[ . 1 . 2]" 1
794 2 33 LEU MD1 2 37 ILE MD 1.800 . 6.300 2.504 1.998 3.002 . 0 0 "[ . 1 . 2]" 1
795 1 33 LEU MD2 1 37 ILE MD 1.800 . 6.000 3.293 2.962 3.608 . 0 0 "[ . 1 . 2]" 1
796 2 33 LEU MD2 2 37 ILE MD 1.800 . 6.000 3.292 2.960 3.605 . 0 0 "[ . 1 . 2]" 1
797 1 33 LEU H 1 61 LEU MD1 1.800 . 7.500 5.370 4.861 5.786 . 0 0 "[ . 1 . 2]" 1
798 2 33 LEU H 2 61 LEU MD1 1.800 . 7.500 5.370 4.862 5.788 . 0 0 "[ . 1 . 2]" 1
799 1 33 LEU MD2 1 61 LEU MD1 1.800 . 8.000 3.357 2.778 3.975 . 0 0 "[ . 1 . 2]" 1
800 2 33 LEU MD2 2 61 LEU MD1 1.800 . 8.000 3.358 2.779 3.975 . 0 0 "[ . 1 . 2]" 1
801 1 33 LEU H 1 61 LEU MD2 1.800 . 7.500 3.800 3.521 4.017 . 0 0 "[ . 1 . 2]" 1
802 2 33 LEU H 2 61 LEU MD2 1.800 . 7.500 3.800 3.523 4.020 . 0 0 "[ . 1 . 2]" 1
803 1 33 LEU MD2 1 61 LEU MD2 1.800 . 6.300 2.621 1.906 3.380 . 0 0 "[ . 1 . 2]" 1
804 2 33 LEU MD2 2 61 LEU MD2 1.800 . 6.300 2.621 1.906 3.380 . 0 0 "[ . 1 . 2]" 1
805 1 33 LEU MD2 1 61 LEU HG 1.800 . 6.500 3.456 2.905 4.246 . 0 0 "[ . 1 . 2]" 1
806 2 33 LEU MD2 2 61 LEU HG 1.800 . 6.500 3.456 2.906 4.246 . 0 0 "[ . 1 . 2]" 1
807 1 33 LEU MD1 1 74 PHE HA 1.800 . 6.500 2.642 2.176 3.265 . 0 0 "[ . 1 . 2]" 1
808 2 33 LEU MD1 2 74 PHE HA 1.800 . 6.500 2.642 2.175 3.264 . 0 0 "[ . 1 . 2]" 1
809 1 33 LEU MD2 1 74 PHE HA 1.800 . 6.500 2.351 1.890 3.021 . 0 0 "[ . 1 . 2]" 1
810 2 33 LEU MD2 2 74 PHE HA 1.800 . 6.500 2.351 1.891 3.022 . 0 0 "[ . 1 . 2]" 1
811 1 33 LEU MD1 1 74 PHE QD 1.800 . 8.900 1.862 1.714 2.339 0.086 3 0 "[ . 1 . 2]" 1
812 2 33 LEU MD1 2 74 PHE QD 1.800 . 8.900 1.862 1.714 2.337 0.086 3 0 "[ . 1 . 2]" 1
813 1 33 LEU MD2 1 77 PHE HB3 1.800 . 6.500 2.736 1.895 3.353 . 0 0 "[ . 1 . 2]" 1
814 2 33 LEU MD2 2 77 PHE HB3 1.800 . 6.500 2.736 1.895 3.352 . 0 0 "[ . 1 . 2]" 1
815 1 33 LEU MD2 1 77 PHE HB2 1.800 . 6.500 2.868 2.182 3.541 . 0 0 "[ . 1 . 2]" 1
816 2 33 LEU MD2 2 77 PHE HB2 1.800 . 6.500 2.868 2.181 3.541 . 0 0 "[ . 1 . 2]" 1
817 1 33 LEU MD2 1 77 PHE QD 1.800 . 8.900 2.473 1.860 3.291 . 0 0 "[ . 1 . 2]" 1
818 2 33 LEU MD2 2 77 PHE QD 1.800 . 8.900 2.473 1.861 3.290 . 0 0 "[ . 1 . 2]" 1
819 1 34 LYS H 1 34 LYS HB3 1.800 . 2.900 2.855 2.680 2.939 0.039 13 0 "[ . 1 . 2]" 1
820 2 34 LYS H 2 34 LYS HB3 1.800 . 2.900 2.855 2.680 2.939 0.039 13 0 "[ . 1 . 2]" 1
821 1 33 LEU H 1 34 LYS H 1.800 . 2.900 2.389 2.288 2.534 . 0 0 "[ . 1 . 2]" 1
822 2 33 LEU H 2 34 LYS H 1.800 . 2.900 2.389 2.287 2.533 . 0 0 "[ . 1 . 2]" 1
823 1 33 LEU HA 1 34 LYS H 1.800 . 5.000 3.540 3.497 3.577 . 0 0 "[ . 1 . 2]" 1
824 2 33 LEU HA 2 34 LYS H 1.800 . 5.000 3.540 3.495 3.576 . 0 0 "[ . 1 . 2]" 1
825 1 33 LEU HB3 1 34 LYS H 1.800 . 2.900 2.598 2.263 2.823 . 0 0 "[ . 1 . 2]" 1
826 2 33 LEU HB3 2 34 LYS H 1.800 . 2.900 2.598 2.262 2.824 . 0 0 "[ . 1 . 2]" 1
827 1 33 LEU HG 1 34 LYS H 1.800 . 3.500 3.400 3.221 3.517 0.017 5 0 "[ . 1 . 2]" 1
828 2 33 LEU HG 2 34 LYS H 1.800 . 3.500 3.400 3.224 3.519 0.019 5 0 "[ . 1 . 2]" 1
829 1 33 LEU MD2 1 34 LYS H 1.800 . 6.500 4.310 4.100 4.505 . 0 0 "[ . 1 . 2]" 1
830 2 33 LEU MD2 2 34 LYS H 1.800 . 6.500 4.310 4.101 4.506 . 0 0 "[ . 1 . 2]" 1
831 1 34 LYS H 1 35 GLU HA 1.800 . 6.000 5.329 5.241 5.433 . 0 0 "[ . 1 . 2]" 1
832 2 34 LYS H 2 35 GLU HA 1.800 . 6.000 5.329 5.239 5.431 . 0 0 "[ . 1 . 2]" 1
833 1 30 LYS HA 1 34 LYS H 1.800 . 5.000 3.735 3.494 4.073 . 0 0 "[ . 1 . 2]" 1
834 2 30 LYS HA 2 34 LYS H 1.800 . 5.000 3.734 3.494 4.069 . 0 0 "[ . 1 . 2]" 1
835 1 30 LYS QB 1 34 LYS H 1.800 . 6.000 4.597 4.346 5.089 . 0 0 "[ . 1 . 2]" 1
836 2 30 LYS QB 2 34 LYS H 1.800 . 6.000 4.596 4.348 5.088 . 0 0 "[ . 1 . 2]" 1
837 1 31 SER HA 1 34 LYS H 1.800 . 3.500 3.506 3.367 3.553 0.053 14 0 "[ . 1 . 2]" 1
838 2 31 SER HA 2 34 LYS H 1.800 . 3.500 3.505 3.366 3.552 0.052 14 0 "[ . 1 . 2]" 1
839 1 31 SER HA 1 34 LYS HB3 1.800 . 3.300 3.328 3.106 3.360 0.060 7 0 "[ . 1 . 2]" 1
840 2 31 SER HA 2 34 LYS HB3 1.800 . 3.300 3.327 3.107 3.359 0.059 7 0 "[ . 1 . 2]" 1
841 1 31 SER HA 1 34 LYS HB2 1.800 . 6.000 3.195 2.957 3.522 . 0 0 "[ . 1 . 2]" 1
842 2 31 SER HA 2 34 LYS HB2 1.800 . 6.000 3.195 2.959 3.523 . 0 0 "[ . 1 . 2]" 1
843 1 32 GLU H 1 34 LYS H 1.800 . 5.000 4.055 3.811 4.470 . 0 0 "[ . 1 . 2]" 1
844 2 32 GLU H 2 34 LYS H 1.800 . 5.000 4.055 3.810 4.472 . 0 0 "[ . 1 . 2]" 1
845 1 32 GLU HB3 1 34 LYS H 1.800 . 6.000 5.288 5.106 5.597 . 0 0 "[ . 1 . 2]" 1
846 2 32 GLU HB3 2 34 LYS H 1.800 . 6.000 5.288 5.106 5.600 . 0 0 "[ . 1 . 2]" 1
847 1 28 LEU QD 1 34 LYS H 1.800 . 8.400 5.048 4.452 5.700 . 0 0 "[ . 1 . 2]" 1
848 2 28 LEU QD 2 34 LYS H 1.800 . 8.400 5.048 4.452 5.699 . 0 0 "[ . 1 . 2]" 1
849 1 34 LYS H 1 61 LEU HA 1.800 . 6.000 5.492 5.141 5.995 . 0 0 "[ . 1 . 2]" 1
850 2 34 LYS H 2 61 LEU HA 1.800 . 6.000 5.493 5.141 5.997 . 0 0 "[ . 1 . 2]" 1
851 1 34 LYS H 1 61 LEU MD1 1.800 . 5.000 3.610 3.072 3.962 . 0 0 "[ . 1 . 2]" 1
852 2 34 LYS H 2 61 LEU MD1 1.800 . 5.000 3.610 3.072 3.964 . 0 0 "[ . 1 . 2]" 1
853 1 34 LYS H 1 61 LEU MD2 1.800 . 6.500 2.393 2.052 2.915 . 0 0 "[ . 1 . 2]" 1
854 2 34 LYS H 2 61 LEU MD2 1.800 . 6.500 2.393 2.053 2.917 . 0 0 "[ . 1 . 2]" 1
855 1 34 LYS HA 1 61 LEU MD1 1.800 . 6.500 1.994 1.809 2.545 . 0 0 "[ . 1 . 2]" 1
856 2 34 LYS HA 2 61 LEU MD1 1.800 . 6.500 1.994 1.809 2.546 . 0 0 "[ . 1 . 2]" 1
857 1 35 GLU H 1 35 GLU HG3 1.800 . 3.500 3.310 2.776 3.584 0.084 7 0 "[ . 1 . 2]" 1
858 2 35 GLU H 2 35 GLU HG3 1.800 . 3.500 3.310 2.776 3.584 0.084 7 0 "[ . 1 . 2]" 1
859 1 35 GLU H 1 35 GLU HG2 1.800 . 3.500 2.985 2.474 3.575 0.075 2 0 "[ . 1 . 2]" 1
860 2 35 GLU H 2 35 GLU HG2 1.800 . 3.500 2.985 2.475 3.578 0.078 2 0 "[ . 1 . 2]" 1
861 1 34 LYS H 1 35 GLU H 1.800 . 2.900 2.656 2.542 2.795 . 0 0 "[ . 1 . 2]" 1
862 2 34 LYS H 2 35 GLU H 1.800 . 2.900 2.656 2.539 2.794 . 0 0 "[ . 1 . 2]" 1
863 1 34 LYS HA 1 35 GLU H 1.800 . 5.000 3.532 3.500 3.559 . 0 0 "[ . 1 . 2]" 1
864 2 34 LYS HA 2 35 GLU H 1.800 . 5.000 3.532 3.504 3.556 . 0 0 "[ . 1 . 2]" 1
865 1 34 LYS HB3 1 35 GLU H 1.800 . 3.500 2.568 2.392 2.814 . 0 0 "[ . 1 . 2]" 1
866 2 34 LYS HB3 2 35 GLU H 1.800 . 3.500 2.568 2.394 2.815 . 0 0 "[ . 1 . 2]" 1
867 1 34 LYS HB2 1 35 GLU H 1.800 . 3.500 3.572 3.537 3.610 0.110 4 0 "[ . 1 . 2]" 1
868 2 34 LYS HB2 2 35 GLU H 1.800 . 3.500 3.572 3.535 3.610 0.110 4 0 "[ . 1 . 2]" 1
869 1 34 LYS HG2 1 35 GLU H 1.800 . 5.000 4.417 4.080 4.865 . 0 0 "[ . 1 . 2]" 1
870 2 34 LYS HG2 2 35 GLU H 1.800 . 5.000 4.418 4.080 4.865 . 0 0 "[ . 1 . 2]" 1
871 1 35 GLU H 1 36 LEU HB2 1.800 . 6.000 4.225 4.058 4.360 . 0 0 "[ . 1 . 2]" 1
872 2 35 GLU H 2 36 LEU HB2 1.800 . 6.000 4.224 4.059 4.360 . 0 0 "[ . 1 . 2]" 1
873 1 31 SER HA 1 35 GLU H 1.800 . 6.000 4.288 3.940 4.549 . 0 0 "[ . 1 . 2]" 1
874 2 31 SER HA 2 35 GLU H 1.800 . 6.000 4.287 3.939 4.548 . 0 0 "[ . 1 . 2]" 1
875 1 32 GLU HA 1 35 GLU H 1.800 . 5.000 3.433 3.323 3.608 . 0 0 "[ . 1 . 2]" 1
876 2 32 GLU HA 2 35 GLU H 1.800 . 5.000 3.433 3.323 3.608 . 0 0 "[ . 1 . 2]" 1
877 1 32 GLU HA 1 35 GLU HB2 1.800 . 5.000 4.366 2.248 4.760 . 0 0 "[ . 1 . 2]" 1
878 2 32 GLU HA 2 35 GLU HB2 1.800 . 5.000 4.366 2.248 4.758 . 0 0 "[ . 1 . 2]" 1
879 1 33 LEU H 1 35 GLU H 1.800 . 6.000 3.844 3.507 4.097 . 0 0 "[ . 1 . 2]" 1
880 2 33 LEU H 2 35 GLU H 1.800 . 6.000 3.843 3.506 4.097 . 0 0 "[ . 1 . 2]" 1
881 1 33 LEU HA 1 35 GLU H 1.800 . 6.000 4.281 4.111 4.431 . 0 0 "[ . 1 . 2]" 1
882 2 33 LEU HA 2 35 GLU H 1.800 . 6.000 4.281 4.109 4.431 . 0 0 "[ . 1 . 2]" 1
883 1 35 GLU H 1 37 ILE HG12 1.800 . 6.000 6.033 6.009 6.055 0.055 19 0 "[ . 1 . 2]" 1
884 2 35 GLU H 2 37 ILE HG12 1.800 . 6.000 6.033 6.010 6.055 0.055 19 0 "[ . 1 . 2]" 1
885 1 35 GLU H 1 37 ILE MD 1.800 . 7.500 5.932 5.666 6.204 . 0 0 "[ . 1 . 2]" 1
886 2 35 GLU H 2 37 ILE MD 1.800 . 7.500 5.933 5.668 6.204 . 0 0 "[ . 1 . 2]" 1
887 1 35 GLU H 1 38 ASN HB3 1.800 . 6.000 5.244 4.762 5.502 . 0 0 "[ . 1 . 2]" 1
888 2 35 GLU H 2 38 ASN HB3 1.800 . 6.000 5.243 4.762 5.504 . 0 0 "[ . 1 . 2]" 1
889 1 18 TYR QE 1 35 GLU H 1.800 . 8.400 7.003 6.155 7.722 . 0 0 "[ . 1 . 2]" 1
890 2 18 TYR QE 2 35 GLU H 1.800 . 8.400 7.004 6.157 7.726 . 0 0 "[ . 1 . 2]" 1
891 1 35 GLU H 1 61 LEU MD1 1.800 . 7.500 4.909 4.613 5.301 . 0 0 "[ . 1 . 2]" 1
892 2 35 GLU H 2 61 LEU MD1 1.800 . 7.500 4.910 4.614 5.302 . 0 0 "[ . 1 . 2]" 1
893 1 36 LEU HA 1 36 LEU MD1 1.800 . 7.500 2.171 1.920 2.514 . 0 0 "[ . 1 . 2]" 1
894 2 36 LEU HA 2 36 LEU MD1 1.800 . 7.500 2.171 1.920 2.515 . 0 0 "[ . 1 . 2]" 1
895 1 36 LEU H 1 36 LEU HB3 1.800 . 3.500 3.128 2.967 3.205 . 0 0 "[ . 1 . 2]" 1
896 2 36 LEU H 2 36 LEU HB3 1.800 . 3.500 3.128 2.966 3.204 . 0 0 "[ . 1 . 2]" 1
897 1 36 LEU H 1 36 LEU HB2 1.800 . 2.900 2.109 2.075 2.187 . 0 0 "[ . 1 . 2]" 1
898 2 36 LEU H 2 36 LEU HB2 1.800 . 2.900 2.109 2.075 2.186 . 0 0 "[ . 1 . 2]" 1
899 1 35 GLU H 1 36 LEU H 1.800 . 2.900 2.421 2.292 2.512 . 0 0 "[ . 1 . 2]" 1
900 2 35 GLU H 2 36 LEU H 1.800 . 2.900 2.420 2.292 2.512 . 0 0 "[ . 1 . 2]" 1
901 1 35 GLU HA 1 36 LEU H 1.800 . 3.500 3.500 3.472 3.527 0.027 7 0 "[ . 1 . 2]" 1
902 2 35 GLU HA 2 36 LEU H 1.800 . 3.500 3.501 3.473 3.526 0.026 7 0 "[ . 1 . 2]" 1
903 1 35 GLU HB3 1 36 LEU H 1.800 . 3.500 3.564 3.272 3.637 0.137 11 0 "[ . 1 . 2]" 1
904 2 35 GLU HB3 2 36 LEU H 1.800 . 3.500 3.564 3.271 3.637 0.137 11 0 "[ . 1 . 2]" 1
905 1 35 GLU HG3 1 36 LEU H 1.800 . 5.000 2.475 1.910 5.065 0.065 4 0 "[ . 1 . 2]" 1
906 2 35 GLU HG3 2 36 LEU H 1.800 . 5.000 2.475 1.909 5.065 0.065 4 0 "[ . 1 . 2]" 1
907 1 35 GLU HG2 1 36 LEU H 1.800 . 5.000 2.963 2.069 4.847 . 0 0 "[ . 1 . 2]" 1
908 2 35 GLU HG2 2 36 LEU H 1.800 . 5.000 2.962 2.070 4.846 . 0 0 "[ . 1 . 2]" 1
909 1 36 LEU H 1 37 ILE H 1.800 . 2.900 2.845 2.708 2.972 0.072 6 0 "[ . 1 . 2]" 1
910 2 36 LEU H 2 37 ILE H 1.800 . 2.900 2.845 2.708 2.974 0.074 6 0 "[ . 1 . 2]" 1
911 1 36 LEU MD1 1 37 ILE HA 1.800 . 4.800 3.642 3.281 3.853 . 0 0 "[ . 1 . 2]" 1
912 2 36 LEU MD1 2 37 ILE HA 1.800 . 4.800 3.642 3.281 3.854 . 0 0 "[ . 1 . 2]" 1
913 1 36 LEU MD1 1 37 ILE MG 1.800 . 8.000 4.629 4.091 4.941 . 0 0 "[ . 1 . 2]" 1
914 2 36 LEU MD1 2 37 ILE MG 1.800 . 8.000 4.630 4.090 4.938 . 0 0 "[ . 1 . 2]" 1
915 1 36 LEU MD1 1 37 ILE MD 1.800 . 8.000 5.025 4.431 5.257 . 0 0 "[ . 1 . 2]" 1
916 2 36 LEU MD1 2 37 ILE MD 1.800 . 8.000 5.026 4.431 5.257 . 0 0 "[ . 1 . 2]" 1
917 1 33 LEU HA 1 36 LEU H 1.800 . 3.500 3.166 3.034 3.294 . 0 0 "[ . 1 . 2]" 1
918 2 33 LEU HA 2 36 LEU H 1.800 . 3.500 3.166 3.034 3.296 . 0 0 "[ . 1 . 2]" 1
919 1 33 LEU HA 1 36 LEU HB3 1.800 . 5.000 2.939 2.699 3.089 . 0 0 "[ . 1 . 2]" 1
920 2 33 LEU HA 2 36 LEU HB3 1.800 . 5.000 2.938 2.697 3.088 . 0 0 "[ . 1 . 2]" 1
921 1 33 LEU HA 1 36 LEU HB2 1.800 . 5.000 2.029 1.866 2.166 . 0 0 "[ . 1 . 2]" 1
922 2 33 LEU HA 2 36 LEU HB2 1.800 . 5.000 2.029 1.868 2.166 . 0 0 "[ . 1 . 2]" 1
923 1 33 LEU HA 1 36 LEU MD2 1.800 . 6.500 3.706 3.416 3.879 . 0 0 "[ . 1 . 2]" 1
924 2 33 LEU HA 2 36 LEU MD2 1.800 . 6.500 3.706 3.415 3.879 . 0 0 "[ . 1 . 2]" 1
925 1 33 LEU MD1 1 36 LEU MD1 1.800 . 6.300 3.905 3.407 4.192 . 0 0 "[ . 1 . 2]" 1
926 2 33 LEU MD1 2 36 LEU MD1 1.800 . 6.300 3.905 3.408 4.191 . 0 0 "[ . 1 . 2]" 1
927 1 33 LEU MD1 1 36 LEU MD2 1.800 . 6.300 4.191 3.977 4.274 . 0 0 "[ . 1 . 2]" 1
928 2 33 LEU MD1 2 36 LEU MD2 1.800 . 6.300 4.192 3.978 4.274 . 0 0 "[ . 1 . 2]" 1
929 1 34 LYS H 1 36 LEU H 1.800 . 5.000 3.916 3.710 4.128 . 0 0 "[ . 1 . 2]" 1
930 2 34 LYS H 2 36 LEU H 1.800 . 5.000 3.916 3.709 4.129 . 0 0 "[ . 1 . 2]" 1
931 1 34 LYS HB3 1 36 LEU H 1.800 . 6.000 4.820 4.587 5.011 . 0 0 "[ . 1 . 2]" 1
932 2 34 LYS HB3 2 36 LEU H 1.800 . 6.000 4.820 4.589 5.013 . 0 0 "[ . 1 . 2]" 1
933 1 33 LEU MD1 1 36 LEU H 1.800 . 7.500 4.034 3.854 4.269 . 0 0 "[ . 1 . 2]" 1
934 2 33 LEU MD1 2 36 LEU H 1.800 . 7.500 4.034 3.854 4.270 . 0 0 "[ . 1 . 2]" 1
935 1 36 LEU H 1 38 ASN H 1.800 . 6.000 4.527 4.363 4.826 . 0 0 "[ . 1 . 2]" 1
936 2 36 LEU H 2 38 ASN H 1.800 . 6.000 4.528 4.364 4.828 . 0 0 "[ . 1 . 2]" 1
937 1 36 LEU HA 1 39 ASN HB2 1.800 . 6.000 4.422 2.762 5.483 . 0 0 "[ . 1 . 2]" 1
938 2 36 LEU HA 2 39 ASN HB2 1.800 . 6.000 4.422 2.763 5.486 . 0 0 "[ . 1 . 2]" 1
939 1 36 LEU MD1 1 40 GLU QB 1.800 . 7.500 3.051 2.188 4.290 . 0 0 "[ . 1 . 2]" 1
940 2 36 LEU MD1 2 40 GLU QB 1.800 . 7.500 3.051 2.186 4.290 . 0 0 "[ . 1 . 2]" 1
941 1 36 LEU MD1 1 40 GLU HG2 1.800 . 6.500 3.799 2.314 5.460 . 0 0 "[ . 1 . 2]" 1
942 2 36 LEU MD1 2 40 GLU HG2 1.800 . 6.500 3.799 2.313 5.460 . 0 0 "[ . 1 . 2]" 1
943 1 18 TYR QD 1 36 LEU H 1.800 . 8.400 5.876 4.330 7.084 . 0 0 "[ . 1 . 2]" 1
944 2 18 TYR QD 2 36 LEU H 1.800 . 8.400 5.876 4.333 7.086 . 0 0 "[ . 1 . 2]" 1
945 1 18 TYR QD 1 36 LEU MD1 1.800 . 9.900 4.167 3.554 5.789 . 0 0 "[ . 1 . 2]" 1
946 2 18 TYR QD 2 36 LEU MD1 1.800 . 9.900 4.167 3.555 5.792 . 0 0 "[ . 1 . 2]" 1
947 1 18 TYR QD 1 36 LEU MD2 1.800 . 9.900 2.673 1.891 3.667 . 0 0 "[ . 1 . 2]" 1
948 2 18 TYR QD 2 36 LEU MD2 1.800 . 9.900 2.673 1.891 3.669 . 0 0 "[ . 1 . 2]" 1
949 1 18 TYR QE 1 36 LEU H 1.800 . 7.400 5.535 4.592 6.197 . 0 0 "[ . 1 . 2]" 1
950 2 18 TYR QE 2 36 LEU H 1.800 . 7.400 5.535 4.594 6.193 . 0 0 "[ . 1 . 2]" 1
951 1 18 TYR QE 1 36 LEU MD1 1.800 . 9.900 3.496 2.867 4.442 . 0 0 "[ . 1 . 2]" 1
952 2 18 TYR QE 2 36 LEU MD1 1.800 . 9.900 3.496 2.866 4.445 . 0 0 "[ . 1 . 2]" 1
953 1 28 LEU QD 1 36 LEU MD2 1.800 . 7.200 2.934 2.218 3.510 . 0 0 "[ . 1 . 2]" 1
954 2 28 LEU QD 2 36 LEU MD2 1.800 . 7.200 2.933 2.217 3.508 . 0 0 "[ . 1 . 2]" 1
955 1 36 LEU MD1 1 74 PHE QE 1.800 . 8.900 2.526 1.912 3.453 . 0 0 "[ . 1 . 2]" 1
956 2 36 LEU MD1 2 74 PHE QE 1.800 . 8.900 2.526 1.912 3.452 . 0 0 "[ . 1 . 2]" 1
957 1 36 LEU MD2 1 74 PHE QE 1.800 . 8.900 3.740 3.201 4.411 . 0 0 "[ . 1 . 2]" 1
958 2 36 LEU MD2 2 74 PHE QE 1.800 . 8.900 3.741 3.203 4.409 . 0 0 "[ . 1 . 2]" 1
959 1 36 LEU MD1 1 74 PHE HZ 1.800 . 6.500 3.433 1.869 4.967 . 0 0 "[ . 1 . 2]" 1
960 2 36 LEU MD1 2 74 PHE HZ 1.800 . 6.500 3.433 1.869 4.968 . 0 0 "[ . 1 . 2]" 1
961 1 36 LEU MD2 1 74 PHE HZ 1.800 . 7.500 4.779 3.322 6.036 . 0 0 "[ . 1 . 2]" 1
962 2 36 LEU MD2 2 74 PHE HZ 1.800 . 7.500 4.779 3.322 6.037 . 0 0 "[ . 1 . 2]" 1
963 1 4 LEU MD1 2 36 LEU MD1 1.800 . 8.000 2.079 1.738 2.622 0.062 9 0 "[ . 1 . 2]" 1
964 1 36 LEU MD1 2 4 LEU MD1 1.800 . 8.000 2.080 1.731 2.632 0.069 9 0 "[ . 1 . 2]" 1
965 1 4 LEU MD2 2 36 LEU MD1 1.800 . 6.300 1.769 1.567 2.227 0.233 19 0 "[ . 1 . 2]" 1
966 1 36 LEU MD1 2 4 LEU MD2 1.800 . 6.300 1.768 1.594 2.164 0.206 19 0 "[ . 1 . 2]" 1
967 1 37 ILE HA 1 37 ILE MG 1.800 . 4.800 2.158 2.078 2.230 . 0 0 "[ . 1 . 2]" 1
968 2 37 ILE HA 2 37 ILE MG 1.800 . 4.800 2.158 2.078 2.230 . 0 0 "[ . 1 . 2]" 1
969 1 37 ILE HA 1 37 ILE MD 1.800 . 6.500 3.728 3.553 3.793 . 0 0 "[ . 1 . 2]" 1
970 2 37 ILE HA 2 37 ILE MD 1.800 . 6.500 3.728 3.553 3.792 . 0 0 "[ . 1 . 2]" 1
971 1 37 ILE H 1 37 ILE HB 1.800 . 2.900 2.913 2.832 2.958 0.058 19 0 "[ . 1 . 2]" 1
972 2 37 ILE H 2 37 ILE HB 1.800 . 2.900 2.914 2.831 2.959 0.059 19 0 "[ . 1 . 2]" 1
973 1 37 ILE H 1 37 ILE MG 1.800 . 6.500 3.713 3.688 3.746 . 0 0 "[ . 1 . 2]" 1
974 2 37 ILE H 2 37 ILE MG 1.800 . 6.500 3.713 3.690 3.745 . 0 0 "[ . 1 . 2]" 1
975 1 37 ILE H 1 37 ILE MD 1.800 . 6.500 3.589 3.564 3.667 . 0 0 "[ . 1 . 2]" 1
976 2 37 ILE H 2 37 ILE MD 1.800 . 6.500 3.590 3.566 3.667 . 0 0 "[ . 1 . 2]" 1
977 1 36 LEU HA 1 37 ILE H 1.800 . 5.000 3.564 3.539 3.579 . 0 0 "[ . 1 . 2]" 1
978 2 36 LEU HA 2 37 ILE H 1.800 . 5.000 3.564 3.540 3.579 . 0 0 "[ . 1 . 2]" 1
979 1 36 LEU HB2 1 37 ILE H 1.800 . 3.500 3.344 3.189 3.464 . 0 0 "[ . 1 . 2]" 1
980 2 36 LEU HB2 2 37 ILE H 1.800 . 3.500 3.344 3.191 3.465 . 0 0 "[ . 1 . 2]" 1
981 1 36 LEU MD1 1 37 ILE H 1.800 . 6.500 3.796 3.490 3.969 . 0 0 "[ . 1 . 2]" 1
982 2 36 LEU MD1 2 37 ILE H 1.800 . 6.500 3.796 3.488 3.966 . 0 0 "[ . 1 . 2]" 1
983 1 36 LEU MD2 1 37 ILE H 1.800 . 6.500 4.550 4.475 4.633 . 0 0 "[ . 1 . 2]" 1
984 2 36 LEU MD2 2 37 ILE H 1.800 . 6.500 4.551 4.471 4.635 . 0 0 "[ . 1 . 2]" 1
985 1 37 ILE MG 1 38 ASN HA 1.800 . 6.500 4.181 3.906 4.326 . 0 0 "[ . 1 . 2]" 1
986 2 37 ILE MG 2 38 ASN HA 1.800 . 6.500 4.182 3.906 4.328 . 0 0 "[ . 1 . 2]" 1
987 1 33 LEU HA 1 37 ILE H 1.800 . 5.000 4.180 4.023 4.331 . 0 0 "[ . 1 . 2]" 1
988 2 33 LEU HA 2 37 ILE H 1.800 . 5.000 4.179 4.023 4.328 . 0 0 "[ . 1 . 2]" 1
989 1 33 LEU HG 1 37 ILE H 1.800 . 6.000 4.573 4.145 4.984 . 0 0 "[ . 1 . 2]" 1
990 2 33 LEU HG 2 37 ILE H 1.800 . 6.000 4.573 4.148 4.983 . 0 0 "[ . 1 . 2]" 1
991 1 33 LEU HG 1 37 ILE MD 1.800 . 6.500 2.840 2.688 3.179 . 0 0 "[ . 1 . 2]" 1
992 2 33 LEU HG 2 37 ILE MD 1.800 . 6.500 2.840 2.689 3.178 . 0 0 "[ . 1 . 2]" 1
993 1 33 LEU MD1 1 37 ILE H 1.800 . 5.000 3.449 3.056 3.777 . 0 0 "[ . 1 . 2]" 1
994 2 33 LEU MD1 2 37 ILE H 1.800 . 5.000 3.449 3.057 3.776 . 0 0 "[ . 1 . 2]" 1
995 1 34 LYS HA 1 37 ILE H 1.800 . 5.000 3.772 3.600 3.932 . 0 0 "[ . 1 . 2]" 1
996 2 34 LYS HA 2 37 ILE H 1.800 . 5.000 3.772 3.601 3.935 . 0 0 "[ . 1 . 2]" 1
997 1 34 LYS HA 1 37 ILE HB 1.800 . 5.000 4.067 3.720 4.289 . 0 0 "[ . 1 . 2]" 1
998 2 34 LYS HA 2 37 ILE HB 1.800 . 5.000 4.067 3.721 4.288 . 0 0 "[ . 1 . 2]" 1
999 1 35 GLU H 1 37 ILE H 1.800 . 6.000 4.198 4.102 4.301 . 0 0 "[ . 1 . 2]" 1
1000 2 35 GLU H 2 37 ILE H 1.800 . 6.000 4.197 4.099 4.301 . 0 0 "[ . 1 . 2]" 1
1001 1 37 ILE H 1 39 ASN H 1.800 . 5.000 3.921 3.623 4.543 . 0 0 "[ . 1 . 2]" 1
1002 2 37 ILE H 2 39 ASN H 1.800 . 5.000 3.921 3.624 4.542 . 0 0 "[ . 1 . 2]" 1
1003 1 37 ILE MG 1 41 LEU HG 1.800 . 8.500 3.454 1.750 4.603 0.050 2 0 "[ . 1 . 2]" 1
1004 2 37 ILE MG 2 41 LEU HG 1.800 . 8.500 3.454 1.749 4.603 0.051 2 0 "[ . 1 . 2]" 1
1005 1 37 ILE MD 1 57 VAL MG2 1.800 . 6.300 3.370 2.871 3.868 . 0 0 "[ . 1 . 2]" 1
1006 2 37 ILE MD 2 57 VAL MG2 1.800 . 6.300 3.371 2.869 3.868 . 0 0 "[ . 1 . 2]" 1
1007 1 37 ILE MG 1 57 VAL MG2 1.800 . 8.000 4.188 3.329 4.702 . 0 0 "[ . 1 . 2]" 1
1008 2 37 ILE MG 2 57 VAL MG2 1.800 . 8.000 4.188 3.329 4.703 . 0 0 "[ . 1 . 2]" 1
1009 1 37 ILE MD 1 61 LEU MD2 1.800 . 8.000 3.957 3.283 4.367 . 0 0 "[ . 1 . 2]" 1
1010 2 37 ILE MD 2 61 LEU MD2 1.800 . 8.000 3.957 3.285 4.366 . 0 0 "[ . 1 . 2]" 1
1011 1 37 ILE MD 1 77 PHE HB3 1.800 . 7.500 2.896 2.364 3.280 . 0 0 "[ . 1 . 2]" 1
1012 2 37 ILE MD 2 77 PHE HB3 1.800 . 7.500 2.896 2.362 3.282 . 0 0 "[ . 1 . 2]" 1
1013 1 37 ILE MD 1 77 PHE HB2 1.800 . 6.500 4.300 3.805 4.750 . 0 0 "[ . 1 . 2]" 1
1014 2 37 ILE MD 2 77 PHE HB2 1.800 . 6.500 4.300 3.802 4.751 . 0 0 "[ . 1 . 2]" 1
1015 1 37 ILE MD 1 78 VAL HA 1.800 . 6.500 2.746 1.966 4.152 . 0 0 "[ . 1 . 2]" 1
1016 2 37 ILE MD 2 78 VAL HA 1.800 . 6.500 2.745 1.965 4.150 . 0 0 "[ . 1 . 2]" 1
1017 1 37 ILE MG 1 81 VAL MG2 1.800 . 6.300 1.743 1.581 1.927 0.219 6 0 "[ . 1 . 2]" 1
1018 2 37 ILE MG 2 81 VAL MG2 1.800 . 6.300 1.743 1.581 1.925 0.219 6 0 "[ . 1 . 2]" 1
1019 1 4 LEU MD2 2 37 ILE MG 1.800 . 8.000 3.467 2.845 4.357 . 0 0 "[ . 1 . 2]" 1
1020 1 37 ILE MG 2 4 LEU MD2 1.800 . 8.000 3.472 2.839 4.375 . 0 0 "[ . 1 . 2]" 1
1021 1 38 ASN H 1 38 ASN HB3 1.800 . 2.900 2.680 2.435 2.907 0.007 18 0 "[ . 1 . 2]" 1
1022 2 38 ASN H 2 38 ASN HB3 1.800 . 2.900 2.680 2.435 2.908 0.008 18 0 "[ . 1 . 2]" 1
1023 1 38 ASN H 1 38 ASN HB2 1.800 . 3.500 2.436 2.220 2.688 . 0 0 "[ . 1 . 2]" 1
1024 2 38 ASN H 2 38 ASN HB2 1.800 . 3.500 2.436 2.222 2.689 . 0 0 "[ . 1 . 2]" 1
1025 1 38 ASN H 1 38 ASN HD22 1.800 . 6.000 5.771 5.409 5.909 . 0 0 "[ . 1 . 2]" 1
1026 2 38 ASN H 2 38 ASN HD22 1.800 . 6.000 5.771 5.410 5.912 . 0 0 "[ . 1 . 2]" 1
1027 1 37 ILE H 1 38 ASN H 1.800 . 2.900 2.653 2.558 2.792 . 0 0 "[ . 1 . 2]" 1
1028 2 37 ILE H 2 38 ASN H 1.800 . 2.900 2.653 2.558 2.793 . 0 0 "[ . 1 . 2]" 1
1029 1 37 ILE HA 1 38 ASN H 1.800 . 5.000 3.578 3.553 3.589 . 0 0 "[ . 1 . 2]" 1
1030 2 37 ILE HA 2 38 ASN H 1.800 . 5.000 3.578 3.553 3.590 . 0 0 "[ . 1 . 2]" 1
1031 1 37 ILE HB 1 38 ASN H 1.800 . 3.500 2.243 2.056 2.445 . 0 0 "[ . 1 . 2]" 1
1032 2 37 ILE HB 2 38 ASN H 1.800 . 3.500 2.243 2.055 2.447 . 0 0 "[ . 1 . 2]" 1
1033 1 37 ILE HG13 1 38 ASN H 1.800 . 3.500 3.324 3.231 3.508 0.008 9 0 "[ . 1 . 2]" 1
1034 2 37 ILE HG13 2 38 ASN H 1.800 . 3.500 3.323 3.231 3.511 0.011 9 0 "[ . 1 . 2]" 1
1035 1 37 ILE HG12 1 38 ASN H 1.800 . 5.000 4.219 4.102 4.336 . 0 0 "[ . 1 . 2]" 1
1036 2 37 ILE HG12 2 38 ASN H 1.800 . 5.000 4.219 4.102 4.336 . 0 0 "[ . 1 . 2]" 1
1037 1 37 ILE MG 1 38 ASN H 1.800 . 5.000 3.705 3.520 3.865 . 0 0 "[ . 1 . 2]" 1
1038 2 37 ILE MG 2 38 ASN H 1.800 . 5.000 3.706 3.520 3.866 . 0 0 "[ . 1 . 2]" 1
1039 1 37 ILE MD 1 38 ASN H 1.800 . 6.500 4.283 4.127 4.482 . 0 0 "[ . 1 . 2]" 1
1040 2 37 ILE MD 2 38 ASN H 1.800 . 6.500 4.284 4.126 4.480 . 0 0 "[ . 1 . 2]" 1
1041 1 38 ASN H 1 39 ASN H 1.800 . 2.900 2.821 2.693 2.943 0.043 14 0 "[ . 1 . 2]" 1
1042 2 38 ASN H 2 39 ASN H 1.800 . 2.900 2.821 2.694 2.943 0.043 14 0 "[ . 1 . 2]" 1
1043 1 38 ASN H 1 39 ASN HB3 1.800 . 6.000 5.128 4.781 5.513 . 0 0 "[ . 1 . 2]" 1
1044 2 38 ASN H 2 39 ASN HB3 1.800 . 6.000 5.129 4.778 5.512 . 0 0 "[ . 1 . 2]" 1
1045 1 34 LYS HA 1 38 ASN H 1.800 . 6.000 4.100 3.746 4.299 . 0 0 "[ . 1 . 2]" 1
1046 2 34 LYS HA 2 38 ASN H 1.800 . 6.000 4.100 3.746 4.298 . 0 0 "[ . 1 . 2]" 1
1047 1 34 LYS HG2 1 38 ASN H 1.800 . 6.000 4.548 4.038 4.928 . 0 0 "[ . 1 . 2]" 1
1048 2 34 LYS HG2 2 38 ASN H 1.800 . 6.000 4.548 4.037 4.931 . 0 0 "[ . 1 . 2]" 1
1049 1 35 GLU H 1 38 ASN H 1.800 . 6.000 4.893 4.659 5.033 . 0 0 "[ . 1 . 2]" 1
1050 2 35 GLU H 2 38 ASN H 1.800 . 6.000 4.893 4.659 5.033 . 0 0 "[ . 1 . 2]" 1
1051 1 35 GLU HA 1 38 ASN H 1.800 . 3.500 3.512 3.399 3.610 0.110 4 0 "[ . 1 . 2]" 1
1052 2 35 GLU HA 2 38 ASN H 1.800 . 3.500 3.512 3.399 3.609 0.109 4 0 "[ . 1 . 2]" 1
1053 1 35 GLU HA 1 38 ASN HB3 1.800 . 5.000 2.796 2.477 2.993 . 0 0 "[ . 1 . 2]" 1
1054 2 35 GLU HA 2 38 ASN HB3 1.800 . 5.000 2.796 2.478 2.991 . 0 0 "[ . 1 . 2]" 1
1055 1 35 GLU HA 1 38 ASN HB2 1.800 . 6.000 4.096 3.627 4.384 . 0 0 "[ . 1 . 2]" 1
1056 2 35 GLU HA 2 38 ASN HB2 1.800 . 6.000 4.097 3.626 4.383 . 0 0 "[ . 1 . 2]" 1
1057 1 38 ASN H 1 40 GLU H 1.800 . 6.000 4.717 3.763 5.348 . 0 0 "[ . 1 . 2]" 1
1058 2 38 ASN H 2 40 GLU H 1.800 . 6.000 4.718 3.763 5.345 . 0 0 "[ . 1 . 2]" 1
1059 1 38 ASN H 1 41 LEU MD1 1.800 . 7.500 5.989 5.599 6.412 . 0 0 "[ . 1 . 2]" 1
1060 2 38 ASN H 2 41 LEU MD1 1.800 . 7.500 5.989 5.599 6.410 . 0 0 "[ . 1 . 2]" 1
1061 1 38 ASN H 1 61 LEU MD1 1.800 . 7.500 4.940 4.521 5.521 . 0 0 "[ . 1 . 2]" 1
1062 2 38 ASN H 2 61 LEU MD1 1.800 . 7.500 4.940 4.520 5.520 . 0 0 "[ . 1 . 2]" 1
1063 1 38 ASN H 1 81 VAL MG1 1.800 . 7.500 6.050 5.775 6.138 . 0 0 "[ . 1 . 2]" 1
1064 2 38 ASN H 2 81 VAL MG1 1.800 . 7.500 6.051 5.776 6.142 . 0 0 "[ . 1 . 2]" 1
1065 1 4 LEU MD2 2 38 ASN HA 1.800 . 7.500 6.216 5.965 6.349 . 0 0 "[ . 1 . 2]" 1
1066 1 38 ASN HA 2 4 LEU MD2 1.800 . 7.500 6.218 5.960 6.344 . 0 0 "[ . 1 . 2]" 1
1067 1 39 ASN H 1 39 ASN HB3 1.800 . 2.900 2.712 2.351 2.922 0.022 16 0 "[ . 1 . 2]" 1
1068 2 39 ASN H 2 39 ASN HB3 1.800 . 2.900 2.712 2.350 2.922 0.022 16 0 "[ . 1 . 2]" 1
1069 1 39 ASN H 1 39 ASN HB2 1.800 . 2.900 2.698 2.300 2.925 0.025 20 0 "[ . 1 . 2]" 1
1070 2 39 ASN H 2 39 ASN HB2 1.800 . 2.900 2.698 2.302 2.923 0.023 20 0 "[ . 1 . 2]" 1
1071 1 38 ASN HA 1 39 ASN H 1.800 . 5.000 3.408 3.282 3.591 . 0 0 "[ . 1 . 2]" 1
1072 2 38 ASN HA 2 39 ASN H 1.800 . 5.000 3.409 3.282 3.592 . 0 0 "[ . 1 . 2]" 1
1073 1 38 ASN HB3 1 39 ASN H 1.800 . 3.500 3.084 1.949 3.590 0.090 19 0 "[ . 1 . 2]" 1
1074 2 38 ASN HB3 2 39 ASN H 1.800 . 3.500 3.084 1.952 3.589 0.089 19 0 "[ . 1 . 2]" 1
1075 1 35 GLU HA 1 39 ASN H 1.800 . 5.000 3.366 2.030 4.356 . 0 0 "[ . 1 . 2]" 1
1076 2 35 GLU HA 2 39 ASN H 1.800 . 5.000 3.366 2.031 4.356 . 0 0 "[ . 1 . 2]" 1
1077 1 36 LEU HA 1 39 ASN H 1.800 . 5.000 4.337 3.772 5.009 0.009 5 0 "[ . 1 . 2]" 1
1078 2 36 LEU HA 2 39 ASN H 1.800 . 5.000 4.337 3.771 5.010 0.010 5 0 "[ . 1 . 2]" 1
1079 1 39 ASN H 1 40 GLU H 1.800 . 3.500 2.631 2.195 3.111 . 0 0 "[ . 1 . 2]" 1
1080 2 39 ASN H 2 40 GLU H 1.800 . 3.500 2.631 2.194 3.111 . 0 0 "[ . 1 . 2]" 1
1081 1 39 ASN HB3 1 40 GLU H 1.800 . 3.500 2.310 1.834 3.071 . 0 0 "[ . 1 . 2]" 1
1082 2 39 ASN HB3 2 40 GLU H 1.800 . 3.500 2.310 1.834 3.071 . 0 0 "[ . 1 . 2]" 1
1083 1 39 ASN HD22 1 40 GLU H 1.800 . 5.000 4.905 4.084 5.037 0.037 4 0 "[ . 1 . 2]" 1
1084 2 39 ASN HD22 2 40 GLU H 1.800 . 5.000 4.906 4.082 5.038 0.038 4 0 "[ . 1 . 2]" 1
1085 1 39 ASN H 1 41 LEU HG 1.800 . 7.000 6.667 5.627 7.185 0.185 9 0 "[ . 1 . 2]" 1
1086 2 39 ASN H 2 41 LEU HG 1.800 . 7.000 6.667 5.627 7.185 0.185 9 0 "[ . 1 . 2]" 1
1087 1 36 LEU HA 1 40 GLU H 1.800 . 5.000 3.776 3.057 4.709 . 0 0 "[ . 1 . 2]" 1
1088 2 36 LEU HA 2 40 GLU H 1.800 . 5.000 3.776 3.056 4.711 . 0 0 "[ . 1 . 2]" 1
1089 1 36 LEU MD1 1 40 GLU H 1.800 . 6.500 3.920 3.212 4.640 . 0 0 "[ . 1 . 2]" 1
1090 2 36 LEU MD1 2 40 GLU H 1.800 . 6.500 3.920 3.210 4.639 . 0 0 "[ . 1 . 2]" 1
1091 1 37 ILE HA 1 40 GLU H 1.800 . 5.000 4.187 3.678 4.772 . 0 0 "[ . 1 . 2]" 1
1092 2 37 ILE HA 2 40 GLU H 1.800 . 5.000 4.188 3.678 4.774 . 0 0 "[ . 1 . 2]" 1
1093 1 37 ILE H 1 40 GLU H 1.800 . 6.000 4.832 4.323 5.375 . 0 0 "[ . 1 . 2]" 1
1094 2 37 ILE H 2 40 GLU H 1.800 . 6.000 4.832 4.324 5.378 . 0 0 "[ . 1 . 2]" 1
1095 1 4 LEU MD2 2 40 GLU H 1.800 . 6.500 3.746 2.994 4.318 . 0 0 "[ . 1 . 2]" 1
1096 1 40 GLU H 2 4 LEU MD2 1.800 . 6.500 3.745 2.961 4.326 . 0 0 "[ . 1 . 2]" 1
1097 1 41 LEU HA 1 41 LEU MD2 1.800 . 4.800 2.439 1.776 3.766 0.024 18 0 "[ . 1 . 2]" 1
1098 2 41 LEU HA 2 41 LEU MD2 1.800 . 4.800 2.439 1.775 3.763 0.025 18 0 "[ . 1 . 2]" 1
1099 1 41 LEU H 1 41 LEU HB3 1.800 . 3.500 3.382 2.234 3.623 0.123 2 0 "[ . 1 . 2]" 1
1100 2 41 LEU H 2 41 LEU HB3 1.800 . 3.500 3.383 2.236 3.626 0.126 2 0 "[ . 1 . 2]" 1
1101 1 41 LEU H 1 41 LEU MD1 1.800 . 6.500 3.749 1.852 4.681 . 0 0 "[ . 1 . 2]" 1
1102 2 41 LEU H 2 41 LEU MD1 1.800 . 6.500 3.750 1.853 4.681 . 0 0 "[ . 1 . 2]" 1
1103 1 40 GLU H 1 41 LEU H 1.800 . 3.500 2.696 1.895 3.145 . 0 0 "[ . 1 . 2]" 1
1104 2 40 GLU H 2 41 LEU H 1.800 . 3.500 2.696 1.894 3.146 . 0 0 "[ . 1 . 2]" 1
1105 1 40 GLU HA 1 41 LEU H 1.800 . 6.000 3.426 2.834 3.596 . 0 0 "[ . 1 . 2]" 1
1106 2 40 GLU HA 2 41 LEU H 1.800 . 6.000 3.427 2.832 3.598 . 0 0 "[ . 1 . 2]" 1
1107 1 40 GLU QB 1 41 LEU H 1.800 . 4.500 2.641 1.818 4.027 . 0 0 "[ . 1 . 2]" 1
1108 2 40 GLU QB 2 41 LEU H 1.800 . 4.500 2.640 1.818 4.027 . 0 0 "[ . 1 . 2]" 1
1109 1 41 LEU H 1 42 SER QB 1.800 . 7.000 4.239 3.454 5.786 . 0 0 "[ . 1 . 2]" 1
1110 2 41 LEU H 2 42 SER QB 1.800 . 7.000 4.239 3.453 5.785 . 0 0 "[ . 1 . 2]" 1
1111 1 36 LEU MD1 1 41 LEU H 1.800 . 6.500 4.594 3.815 5.340 . 0 0 "[ . 1 . 2]" 1
1112 2 36 LEU MD1 2 41 LEU H 1.800 . 6.500 4.594 3.814 5.340 . 0 0 "[ . 1 . 2]" 1
1113 1 36 LEU MD1 1 41 LEU MD1 1.800 . 8.000 4.718 4.196 5.537 . 0 0 "[ . 1 . 2]" 1
1114 2 36 LEU MD1 2 41 LEU MD1 1.800 . 8.000 4.719 4.199 5.535 . 0 0 "[ . 1 . 2]" 1
1115 1 37 ILE HA 1 41 LEU H 1.800 . 5.000 3.347 2.755 4.013 . 0 0 "[ . 1 . 2]" 1
1116 2 37 ILE HA 2 41 LEU H 1.800 . 5.000 3.347 2.753 4.013 . 0 0 "[ . 1 . 2]" 1
1117 1 37 ILE HA 1 41 LEU MD1 1.800 . 4.800 3.355 2.804 3.903 . 0 0 "[ . 1 . 2]" 1
1118 2 37 ILE HA 2 41 LEU MD1 1.800 . 4.800 3.355 2.807 3.904 . 0 0 "[ . 1 . 2]" 1
1119 1 37 ILE MG 1 41 LEU MD1 1.800 . 6.300 2.596 2.192 3.823 . 0 0 "[ . 1 . 2]" 1
1120 2 37 ILE MG 2 41 LEU MD1 1.800 . 6.300 2.596 2.192 3.823 . 0 0 "[ . 1 . 2]" 1
1121 1 38 ASN HA 1 41 LEU H 1.800 . 6.000 4.618 4.104 5.296 . 0 0 "[ . 1 . 2]" 1
1122 2 38 ASN HA 2 41 LEU H 1.800 . 6.000 4.619 4.102 5.302 . 0 0 "[ . 1 . 2]" 1
1123 1 41 LEU MD2 1 44 PHE QE 1.800 . 8.900 4.026 1.804 6.065 . 0 0 "[ . 1 . 2]" 1
1124 2 41 LEU MD2 2 44 PHE QE 1.800 . 8.900 4.026 1.805 6.065 . 0 0 "[ . 1 . 2]" 1
1125 1 41 LEU MD1 1 78 VAL HA 1.800 . 4.800 3.885 3.490 4.095 . 0 0 "[ . 1 . 2]" 1
1126 2 41 LEU MD1 2 78 VAL HA 1.800 . 4.800 3.884 3.488 4.091 . 0 0 "[ . 1 . 2]" 1
1127 1 41 LEU MD1 1 78 VAL HB 1.800 . 6.500 4.939 4.121 5.313 . 0 0 "[ . 1 . 2]" 1
1128 2 41 LEU MD1 2 78 VAL HB 1.800 . 6.500 4.939 4.118 5.313 . 0 0 "[ . 1 . 2]" 1
1129 1 41 LEU MD1 1 78 VAL MG1 1.800 . 6.300 2.370 1.727 2.707 0.073 6 0 "[ . 1 . 2]" 1
1130 2 41 LEU MD1 2 78 VAL MG1 1.800 . 6.300 2.370 1.727 2.707 0.073 6 0 "[ . 1 . 2]" 1
1131 1 41 LEU MD1 1 78 VAL MG2 1.800 . 8.000 3.946 3.448 4.330 . 0 0 "[ . 1 . 2]" 1
1132 2 41 LEU MD1 2 78 VAL MG2 1.800 . 8.000 3.946 3.447 4.332 . 0 0 "[ . 1 . 2]" 1
1133 1 41 LEU MD1 1 81 VAL MG2 1.800 . 8.000 2.890 2.434 3.442 . 0 0 "[ . 1 . 2]" 1
1134 2 41 LEU MD1 2 81 VAL MG2 1.800 . 8.000 2.890 2.435 3.442 . 0 0 "[ . 1 . 2]" 1
1135 1 41 LEU MD2 1 81 VAL MG2 1.800 . 8.000 4.124 1.674 5.329 0.126 9 0 "[ . 1 . 2]" 1
1136 2 41 LEU MD2 2 81 VAL MG2 1.800 . 8.000 4.124 1.674 5.330 0.126 17 0 "[ . 1 . 2]" 1
1137 1 41 LEU MD1 1 81 VAL HB 1.800 . 6.500 4.283 3.689 4.711 . 0 0 "[ . 1 . 2]" 1
1138 2 41 LEU MD1 2 81 VAL HB 1.800 . 6.500 4.283 3.690 4.713 . 0 0 "[ . 1 . 2]" 1
1139 1 9 VAL MG1 2 41 LEU MD1 1.800 . 8.000 5.409 5.352 5.523 . 0 0 "[ . 1 . 2]" 1
1140 1 41 LEU MD1 2 9 VAL MG1 1.800 . 8.000 5.412 5.361 5.506 . 0 0 "[ . 1 . 2]" 1
1141 1 42 SER H 1 42 SER QB 1.800 . 3.900 2.659 2.074 3.384 . 0 0 "[ . 1 . 2]" 1
1142 2 42 SER H 2 42 SER QB 1.800 . 3.900 2.659 2.077 3.381 . 0 0 "[ . 1 . 2]" 1
1143 1 41 LEU H 1 42 SER H 1.800 . 3.500 2.999 1.793 3.566 0.066 14 0 "[ . 1 . 2]" 1
1144 2 41 LEU H 2 42 SER H 1.800 . 3.500 2.999 1.794 3.566 0.066 14 0 "[ . 1 . 2]" 1
1145 1 41 LEU HA 1 42 SER H 1.800 . 5.000 3.498 3.330 3.577 . 0 0 "[ . 1 . 2]" 1
1146 2 41 LEU HA 2 42 SER H 1.800 . 5.000 3.498 3.330 3.577 . 0 0 "[ . 1 . 2]" 1
1147 1 41 LEU HG 1 42 SER H 1.800 . 6.000 4.363 1.943 5.669 . 0 0 "[ . 1 . 2]" 1
1148 2 41 LEU HG 2 42 SER H 1.800 . 6.000 4.363 1.942 5.670 . 0 0 "[ . 1 . 2]" 1
1149 1 41 LEU MD2 1 42 SER H 1.800 . 7.500 3.935 2.407 4.722 . 0 0 "[ . 1 . 2]" 1
1150 2 41 LEU MD2 2 42 SER H 1.800 . 7.500 3.935 2.408 4.723 . 0 0 "[ . 1 . 2]" 1
1151 1 38 ASN HA 1 42 SER H 1.800 . 6.000 3.266 2.391 5.996 . 0 0 "[ . 1 . 2]" 1
1152 2 38 ASN HA 2 42 SER H 1.800 . 6.000 3.267 2.390 5.996 . 0 0 "[ . 1 . 2]" 1
1153 1 40 GLU H 1 42 SER H 1.800 . 6.000 4.753 3.183 5.897 . 0 0 "[ . 1 . 2]" 1
1154 2 40 GLU H 2 42 SER H 1.800 . 6.000 4.753 3.181 5.895 . 0 0 "[ . 1 . 2]" 1
1155 1 42 SER H 1 81 VAL MG2 1.800 . 7.500 5.889 4.554 6.199 . 0 0 "[ . 1 . 2]" 1
1156 2 42 SER H 2 81 VAL MG2 1.800 . 7.500 5.888 4.551 6.195 . 0 0 "[ . 1 . 2]" 1
1157 1 4 LEU MD2 2 42 SER H 1.800 . 6.500 5.080 4.303 5.473 . 0 0 "[ . 1 . 2]" 1
1158 1 42 SER H 2 4 LEU MD2 1.800 . 6.500 5.082 4.319 5.443 . 0 0 "[ . 1 . 2]" 1
1159 1 42 SER HA 1 43 HIS H 1.800 . 6.000 2.997 2.261 3.571 . 0 0 "[ . 1 . 2]" 1
1160 2 42 SER HA 2 43 HIS H 1.800 . 6.000 2.997 2.259 3.571 . 0 0 "[ . 1 . 2]" 1
1161 1 42 SER QB 1 43 HIS H 1.800 . 6.000 3.594 2.574 4.073 . 0 0 "[ . 1 . 2]" 1
1162 2 42 SER QB 2 43 HIS H 1.800 . 6.000 3.594 2.575 4.075 . 0 0 "[ . 1 . 2]" 1
1163 1 43 HIS H 1 44 PHE H 1.800 . 3.500 2.468 1.820 3.000 . 0 0 "[ . 1 . 2]" 1
1164 2 43 HIS H 2 44 PHE H 1.800 . 3.500 2.468 1.823 3.002 . 0 0 "[ . 1 . 2]" 1
1165 1 41 LEU HA 1 43 HIS H 1.800 . 6.000 4.069 3.349 5.531 . 0 0 "[ . 1 . 2]" 1
1166 2 41 LEU HA 2 43 HIS H 1.800 . 6.000 4.069 3.348 5.530 . 0 0 "[ . 1 . 2]" 1
1167 1 44 PHE H 1 44 PHE QD 1.800 . 7.400 2.914 2.322 4.174 . 0 0 "[ . 1 . 2]" 1
1168 2 44 PHE H 2 44 PHE QD 1.800 . 7.400 2.914 2.323 4.172 . 0 0 "[ . 1 . 2]" 1
1169 1 41 LEU HA 1 44 PHE H 1.800 . 6.000 5.048 3.196 6.035 0.035 15 0 "[ . 1 . 2]" 1
1170 2 41 LEU HA 2 44 PHE H 1.800 . 6.000 5.048 3.196 6.037 0.037 15 0 "[ . 1 . 2]" 1
1171 1 41 LEU MD2 1 44 PHE QD 1.800 . 8.900 4.406 2.257 6.081 . 0 0 "[ . 1 . 2]" 1
1172 2 41 LEU MD2 2 44 PHE QD 1.800 . 8.900 4.406 2.257 6.082 . 0 0 "[ . 1 . 2]" 1
1173 1 9 VAL MG2 2 44 PHE QD 1.800 . 9.900 3.907 2.958 5.024 . 0 0 "[ . 1 . 2]" 1
1174 1 44 PHE QD 2 9 VAL MG2 1.800 . 9.900 3.909 2.956 5.028 . 0 0 "[ . 1 . 2]" 1
1175 1 45 LEU H 1 45 LEU HB2 1.800 . 3.500 2.610 2.085 3.287 . 0 0 "[ . 1 . 2]" 1
1176 2 45 LEU H 2 45 LEU HB2 1.800 . 3.500 2.609 2.084 3.288 . 0 0 "[ . 1 . 2]" 1
1177 1 45 LEU QD 1 48 ILE MD 1.800 . 8.200 2.356 1.548 4.385 0.252 12 0 "[ . 1 . 2]" 1
1178 2 45 LEU QD 2 48 ILE MD 1.800 . 8.200 2.357 1.548 4.387 0.252 12 0 "[ . 1 . 2]" 1
1179 1 45 LEU QD 1 48 ILE HG12 1.800 . 8.400 3.127 1.818 4.247 . 0 0 "[ . 1 . 2]" 1
1180 2 45 LEU QD 2 48 ILE HG12 1.800 . 8.400 3.128 1.819 4.248 . 0 0 "[ . 1 . 2]" 1
1181 1 45 LEU QD 1 48 ILE HG13 1.800 . 8.400 3.379 1.880 4.903 . 0 0 "[ . 1 . 2]" 1
1182 2 45 LEU QD 2 48 ILE HG13 1.800 . 8.400 3.380 1.879 4.907 . 0 0 "[ . 1 . 2]" 1
1183 1 45 LEU QD 1 54 VAL MG1 1.800 . 9.400 3.152 1.727 4.160 0.073 11 0 "[ . 1 . 2]" 1
1184 2 45 LEU QD 2 54 VAL MG1 1.800 . 9.400 3.152 1.728 4.160 0.072 11 0 "[ . 1 . 2]" 1
1185 1 45 LEU QD 1 58 MET ME 1.800 . 9.900 4.092 2.708 5.344 . 0 0 "[ . 1 . 2]" 1
1186 2 45 LEU QD 2 58 MET ME 1.800 . 9.900 4.091 2.707 5.343 . 0 0 "[ . 1 . 2]" 1
1187 1 46 GLU H 1 46 GLU QB 1.800 . 3.900 3.002 2.526 3.460 . 0 0 "[ . 1 . 2]" 1
1188 2 46 GLU H 2 46 GLU QB 1.800 . 3.900 3.001 2.527 3.459 . 0 0 "[ . 1 . 2]" 1
1189 1 46 GLU H 1 46 GLU HG3 1.800 . 3.500 2.936 1.894 3.499 . 0 0 "[ . 1 . 2]" 1
1190 2 46 GLU H 2 46 GLU HG3 1.800 . 3.500 2.935 1.895 3.496 . 0 0 "[ . 1 . 2]" 1
1191 1 46 GLU H 1 46 GLU HG2 1.800 . 3.500 2.947 1.843 3.513 0.013 2 0 "[ . 1 . 2]" 1
1192 2 46 GLU H 2 46 GLU HG2 1.800 . 3.500 2.947 1.841 3.514 0.014 2 0 "[ . 1 . 2]" 1
1193 1 45 LEU HA 1 46 GLU H 1.800 . 5.000 2.508 2.191 3.569 . 0 0 "[ . 1 . 2]" 1
1194 2 45 LEU HA 2 46 GLU H 1.800 . 5.000 2.508 2.191 3.570 . 0 0 "[ . 1 . 2]" 1
1195 1 45 LEU HB3 1 46 GLU H 1.800 . 6.000 3.797 1.806 4.322 . 0 0 "[ . 1 . 2]" 1
1196 2 45 LEU HB3 2 46 GLU H 1.800 . 6.000 3.798 1.808 4.323 . 0 0 "[ . 1 . 2]" 1
1197 1 45 LEU HB2 1 46 GLU H 1.800 . 6.000 4.331 2.168 4.689 . 0 0 "[ . 1 . 2]" 1
1198 2 45 LEU HB2 2 46 GLU H 1.800 . 6.000 4.331 2.170 4.691 . 0 0 "[ . 1 . 2]" 1
1199 1 45 LEU QD 1 46 GLU H 1.800 . 8.900 3.669 2.089 4.586 . 0 0 "[ . 1 . 2]" 1
1200 2 45 LEU QD 2 46 GLU H 1.800 . 8.900 3.669 2.089 4.586 . 0 0 "[ . 1 . 2]" 1
1201 1 46 GLU H 1 48 ILE HB 1.800 . 6.000 5.595 4.073 6.068 0.068 16 0 "[ . 1 . 2]" 1
1202 2 46 GLU H 2 48 ILE HB 1.800 . 6.000 5.595 4.074 6.068 0.068 16 0 "[ . 1 . 2]" 1
1203 1 47 GLU H 1 47 GLU QG 1.800 . 3.900 2.983 1.851 3.667 . 0 0 "[ . 1 . 2]" 1
1204 2 47 GLU H 2 47 GLU QG 1.800 . 3.900 2.983 1.852 3.667 . 0 0 "[ . 1 . 2]" 1
1205 1 46 GLU H 1 47 GLU H 1.800 . 2.900 2.315 1.849 2.919 0.019 4 0 "[ . 1 . 2]" 1
1206 2 46 GLU H 2 47 GLU H 1.800 . 2.900 2.315 1.850 2.919 0.019 4 0 "[ . 1 . 2]" 1
1207 1 46 GLU HA 1 47 GLU H 1.800 . 3.500 3.461 3.032 3.576 0.076 14 0 "[ . 1 . 2]" 1
1208 2 46 GLU HA 2 47 GLU H 1.800 . 3.500 3.461 3.033 3.577 0.077 14 0 "[ . 1 . 2]" 1
1209 1 46 GLU QB 1 47 GLU H 1.800 . 6.000 2.792 1.825 4.023 . 0 0 "[ . 1 . 2]" 1
1210 2 46 GLU QB 2 47 GLU H 1.800 . 6.000 2.791 1.824 4.022 . 0 0 "[ . 1 . 2]" 1
1211 1 47 GLU H 1 48 ILE H 1.800 . 3.500 2.252 1.859 3.430 . 0 0 "[ . 1 . 2]" 1
1212 2 47 GLU H 2 48 ILE H 1.800 . 3.500 2.252 1.860 3.429 . 0 0 "[ . 1 . 2]" 1
1213 1 45 LEU HA 1 47 GLU H 1.800 . 5.000 4.196 3.122 4.917 . 0 0 "[ . 1 . 2]" 1
1214 2 45 LEU HA 2 47 GLU H 1.800 . 5.000 4.197 3.122 4.916 . 0 0 "[ . 1 . 2]" 1
1215 1 45 LEU QD 1 47 GLU H 1.800 . 8.400 4.832 3.344 6.060 . 0 0 "[ . 1 . 2]" 1
1216 2 45 LEU QD 2 47 GLU H 1.800 . 8.400 4.832 3.343 6.060 . 0 0 "[ . 1 . 2]" 1
1217 1 48 ILE HA 1 48 ILE MG 1.800 . 4.800 2.362 2.112 3.054 . 0 0 "[ . 1 . 2]" 1
1218 2 48 ILE HA 2 48 ILE MG 1.800 . 4.800 2.362 2.110 3.054 . 0 0 "[ . 1 . 2]" 1
1219 1 45 LEU HA 1 48 ILE MD 1.800 . 6.500 3.979 1.954 5.469 . 0 0 "[ . 1 . 2]" 1
1220 2 45 LEU HA 2 48 ILE MD 1.800 . 6.500 3.979 1.952 5.470 . 0 0 "[ . 1 . 2]" 1
1221 1 45 LEU QD 1 48 ILE MG 1.800 . 9.400 3.878 3.000 4.994 . 0 0 "[ . 1 . 2]" 1
1222 2 45 LEU QD 2 48 ILE MG 1.800 . 9.400 3.879 3.000 4.996 . 0 0 "[ . 1 . 2]" 1
1223 1 48 ILE MG 1 51 GLN HA 1.800 . 4.800 2.586 1.998 3.247 . 0 0 "[ . 1 . 2]" 1
1224 2 48 ILE MG 2 51 GLN HA 1.800 . 4.800 2.585 1.998 3.247 . 0 0 "[ . 1 . 2]" 1
1225 1 48 ILE MG 1 51 GLN HB3 1.800 . 6.500 4.791 4.157 5.372 . 0 0 "[ . 1 . 2]" 1
1226 2 48 ILE MG 2 51 GLN HB3 1.800 . 6.500 4.791 4.155 5.373 . 0 0 "[ . 1 . 2]" 1
1227 1 48 ILE MG 1 51 GLN HB2 1.800 . 6.500 3.766 2.969 4.525 . 0 0 "[ . 1 . 2]" 1
1228 2 48 ILE MG 2 51 GLN HB2 1.800 . 6.500 3.767 2.968 4.523 . 0 0 "[ . 1 . 2]" 1
1229 1 48 ILE MG 1 51 GLN QG 1.800 . 7.500 3.794 3.063 4.959 . 0 0 "[ . 1 . 2]" 1
1230 2 48 ILE MG 2 51 GLN QG 1.800 . 7.500 3.794 3.061 4.959 . 0 0 "[ . 1 . 2]" 1
1231 1 48 ILE MG 1 54 VAL HB 1.800 . 6.500 2.708 2.225 3.711 . 0 0 "[ . 1 . 2]" 1
1232 2 48 ILE MG 2 54 VAL HB 1.800 . 6.500 2.707 2.224 3.711 . 0 0 "[ . 1 . 2]" 1
1233 1 48 ILE MD 1 54 VAL HB 1.800 . 6.500 4.007 2.948 5.024 . 0 0 "[ . 1 . 2]" 1
1234 2 48 ILE MD 2 54 VAL HB 1.800 . 6.500 4.007 2.950 5.025 . 0 0 "[ . 1 . 2]" 1
1235 1 48 ILE MG 1 54 VAL MG1 1.800 . 6.300 3.060 2.283 4.024 . 0 0 "[ . 1 . 2]" 1
1236 2 48 ILE MG 2 54 VAL MG1 1.800 . 6.300 3.060 2.283 4.024 . 0 0 "[ . 1 . 2]" 1
1237 1 48 ILE MG 1 54 VAL MG2 1.800 . 5.700 2.223 1.739 3.417 0.061 3 0 "[ . 1 . 2]" 1
1238 2 48 ILE MG 2 54 VAL MG2 1.800 . 5.700 2.223 1.737 3.417 0.063 3 0 "[ . 1 . 2]" 1
1239 1 48 ILE MD 1 54 VAL MG1 1.800 . 6.300 3.063 2.247 4.051 . 0 0 "[ . 1 . 2]" 1
1240 2 48 ILE MD 2 54 VAL MG1 1.800 . 6.300 3.063 2.246 4.051 . 0 0 "[ . 1 . 2]" 1
1241 1 48 ILE MD 1 54 VAL MG2 1.800 . 6.300 3.408 1.975 4.190 . 0 0 "[ . 1 . 2]" 1
1242 2 48 ILE MD 2 54 VAL MG2 1.800 . 6.300 3.408 1.974 4.189 . 0 0 "[ . 1 . 2]" 1
1243 1 48 ILE MG 1 84 ALA MB 1.800 . 6.300 2.997 1.637 4.291 0.163 11 0 "[ . 1 . 2]" 1
1244 2 48 ILE MG 2 84 ALA MB 1.800 . 6.300 2.997 1.636 4.291 0.164 11 0 "[ . 1 . 2]" 1
1245 1 50 GLU H 1 50 GLU HB3 1.800 . 3.500 3.460 3.143 3.536 0.036 1 0 "[ . 1 . 2]" 1
1246 2 50 GLU H 2 50 GLU HB3 1.800 . 3.500 3.459 3.146 3.533 0.033 1 0 "[ . 1 . 2]" 1
1247 1 50 GLU H 1 50 GLU HB2 1.800 . 3.500 2.235 2.167 2.672 . 0 0 "[ . 1 . 2]" 1
1248 2 50 GLU H 2 50 GLU HB2 1.800 . 3.500 2.235 2.168 2.673 . 0 0 "[ . 1 . 2]" 1
1249 1 49 LYS H 1 50 GLU H 1.800 . 2.900 2.334 2.054 2.960 0.060 16 0 "[ . 1 . 2]" 1
1250 2 49 LYS H 2 50 GLU H 1.800 . 2.900 2.334 2.055 2.960 0.060 16 0 "[ . 1 . 2]" 1
1251 1 49 LYS HA 1 50 GLU H 1.800 . 5.000 3.543 3.457 3.586 . 0 0 "[ . 1 . 2]" 1
1252 2 49 LYS HA 2 50 GLU H 1.800 . 5.000 3.543 3.458 3.586 . 0 0 "[ . 1 . 2]" 1
1253 1 49 LYS QB 1 50 GLU H 1.800 . 4.500 2.598 1.845 3.095 . 0 0 "[ . 1 . 2]" 1
1254 2 49 LYS QB 2 50 GLU H 1.800 . 4.500 2.598 1.843 3.094 . 0 0 "[ . 1 . 2]" 1
1255 1 49 LYS QG 1 50 GLU H 1.800 . 6.000 4.070 3.262 4.558 . 0 0 "[ . 1 . 2]" 1
1256 2 49 LYS QG 2 50 GLU H 1.800 . 6.000 4.070 3.263 4.557 . 0 0 "[ . 1 . 2]" 1
1257 1 48 ILE HA 1 50 GLU H 1.800 . 5.000 3.901 3.469 4.992 . 0 0 "[ . 1 . 2]" 1
1258 2 48 ILE HA 2 50 GLU H 1.800 . 5.000 3.902 3.469 4.993 . 0 0 "[ . 1 . 2]" 1
1259 1 48 ILE MG 1 50 GLU H 1.800 . 4.400 3.041 1.925 3.514 . 0 0 "[ . 1 . 2]" 1
1260 2 48 ILE MG 2 50 GLU H 1.800 . 4.400 3.041 1.924 3.513 . 0 0 "[ . 1 . 2]" 1
1261 1 50 GLU H 1 53 VAL H 1.800 . 6.000 5.219 5.023 5.454 . 0 0 "[ . 1 . 2]" 1
1262 2 50 GLU H 2 53 VAL H 1.800 . 6.000 5.217 5.025 5.452 . 0 0 "[ . 1 . 2]" 1
1263 1 50 GLU H 1 54 VAL MG2 1.800 . 6.500 4.132 1.805 4.840 . 0 0 "[ . 1 . 2]" 1
1264 2 50 GLU H 2 54 VAL MG2 1.800 . 6.500 4.132 1.807 4.838 . 0 0 "[ . 1 . 2]" 1
1265 1 50 GLU H 1 84 ALA MB 1.800 . 5.000 3.081 2.211 3.716 . 0 0 "[ . 1 . 2]" 1
1266 2 50 GLU H 2 84 ALA MB 1.800 . 5.000 3.081 2.209 3.714 . 0 0 "[ . 1 . 2]" 1
1267 1 51 GLN H 1 51 GLN HB3 1.800 . 2.900 2.689 2.445 2.914 0.014 20 0 "[ . 1 . 2]" 1
1268 2 51 GLN H 2 51 GLN HB3 1.800 . 2.900 2.688 2.445 2.914 0.014 20 0 "[ . 1 . 2]" 1
1269 1 51 GLN H 1 51 GLN HB2 1.800 . 2.900 2.446 2.235 2.680 . 0 0 "[ . 1 . 2]" 1
1270 2 51 GLN H 2 51 GLN HB2 1.800 . 2.900 2.446 2.235 2.681 . 0 0 "[ . 1 . 2]" 1
1271 1 50 GLU H 1 51 GLN H 1.800 . 6.000 3.778 3.507 4.106 . 0 0 "[ . 1 . 2]" 1
1272 2 50 GLU H 2 51 GLN H 1.800 . 6.000 3.777 3.505 4.106 . 0 0 "[ . 1 . 2]" 1
1273 1 50 GLU HA 1 51 GLN H 1.800 . 6.000 2.468 2.217 2.598 . 0 0 "[ . 1 . 2]" 1
1274 2 50 GLU HA 2 51 GLN H 1.800 . 6.000 2.468 2.215 2.596 . 0 0 "[ . 1 . 2]" 1
1275 1 51 GLN H 1 52 GLU H 1.800 . 2.900 2.736 2.626 2.868 . 0 0 "[ . 1 . 2]" 1
1276 2 51 GLN H 2 52 GLU H 1.800 . 2.900 2.736 2.626 2.865 . 0 0 "[ . 1 . 2]" 1
1277 1 48 ILE MG 1 51 GLN H 1.800 . 7.500 3.566 2.959 4.063 . 0 0 "[ . 1 . 2]" 1
1278 2 48 ILE MG 2 51 GLN H 1.800 . 7.500 3.567 2.959 4.064 . 0 0 "[ . 1 . 2]" 1
1279 1 51 GLN H 1 53 VAL H 1.800 . 6.000 4.393 4.176 4.928 . 0 0 "[ . 1 . 2]" 1
1280 2 51 GLN H 2 53 VAL H 1.800 . 6.000 4.392 4.177 4.926 . 0 0 "[ . 1 . 2]" 1
1281 1 51 GLN HA 1 54 VAL HB 1.800 . 3.300 3.271 3.154 3.340 0.040 16 0 "[ . 1 . 2]" 1
1282 2 51 GLN HA 2 54 VAL HB 1.800 . 3.300 3.271 3.156 3.342 0.042 16 0 "[ . 1 . 2]" 1
1283 1 52 GLU H 1 52 GLU QB 1.800 . 3.900 2.170 2.094 2.334 . 0 0 "[ . 1 . 2]" 1
1284 2 52 GLU H 2 52 GLU QB 1.800 . 3.900 2.170 2.092 2.333 . 0 0 "[ . 1 . 2]" 1
1285 1 52 GLU H 1 52 GLU QG 1.800 . 4.500 3.545 2.571 4.028 . 0 0 "[ . 1 . 2]" 1
1286 2 52 GLU H 2 52 GLU QG 1.800 . 4.500 3.545 2.571 4.026 . 0 0 "[ . 1 . 2]" 1
1287 1 51 GLN HA 1 52 GLU H 1.800 . 3.500 3.484 3.465 3.524 0.024 16 0 "[ . 1 . 2]" 1
1288 2 51 GLN HA 2 52 GLU H 1.800 . 3.500 3.484 3.465 3.523 0.023 16 0 "[ . 1 . 2]" 1
1289 1 52 GLU H 1 53 VAL H 1.800 . 2.900 2.499 2.435 2.794 . 0 0 "[ . 1 . 2]" 1
1290 2 52 GLU H 2 53 VAL H 1.800 . 2.900 2.499 2.434 2.794 . 0 0 "[ . 1 . 2]" 1
1291 1 52 GLU H 1 53 VAL MG1 1.800 . 7.500 5.778 5.736 5.941 . 0 0 "[ . 1 . 2]" 1
1292 2 52 GLU H 2 53 VAL MG1 1.800 . 7.500 5.778 5.733 5.942 . 0 0 "[ . 1 . 2]" 1
1293 1 48 ILE MG 1 52 GLU H 1.800 . 7.500 4.964 4.649 5.445 . 0 0 "[ . 1 . 2]" 1
1294 2 48 ILE MG 2 52 GLU H 1.800 . 7.500 4.964 4.648 5.445 . 0 0 "[ . 1 . 2]" 1
1295 1 52 GLU H 1 54 VAL H 1.800 . 6.000 4.260 4.027 4.463 . 0 0 "[ . 1 . 2]" 1
1296 2 52 GLU H 2 54 VAL H 1.800 . 6.000 4.261 4.026 4.466 . 0 0 "[ . 1 . 2]" 1
1297 1 52 GLU H 1 55 ASP H 1.800 . 6.000 4.446 4.283 4.549 . 0 0 "[ . 1 . 2]" 1
1298 2 52 GLU H 2 55 ASP H 1.800 . 6.000 4.446 4.281 4.545 . 0 0 "[ . 1 . 2]" 1
1299 1 52 GLU HA 1 55 ASP QB 1.800 . 3.700 2.383 2.194 2.667 . 0 0 "[ . 1 . 2]" 1
1300 2 52 GLU HA 2 55 ASP QB 1.800 . 3.700 2.384 2.197 2.666 . 0 0 "[ . 1 . 2]" 1
1301 1 53 VAL H 1 53 VAL HB 1.800 . 2.900 2.496 2.397 2.805 . 0 0 "[ . 1 . 2]" 1
1302 2 53 VAL H 2 53 VAL HB 1.800 . 2.900 2.496 2.398 2.806 . 0 0 "[ . 1 . 2]" 1
1303 1 53 VAL H 1 53 VAL MG1 1.800 . 4.400 3.765 3.747 3.779 . 0 0 "[ . 1 . 2]" 1
1304 2 53 VAL H 2 53 VAL MG1 1.800 . 4.400 3.765 3.749 3.778 . 0 0 "[ . 1 . 2]" 1
1305 1 53 VAL H 1 53 VAL MG2 1.800 . 5.000 2.207 1.820 2.532 . 0 0 "[ . 1 . 2]" 1
1306 2 53 VAL H 2 53 VAL MG2 1.800 . 5.000 2.207 1.819 2.533 . 0 0 "[ . 1 . 2]" 1
1307 1 52 GLU HA 1 53 VAL H 1.800 . 5.000 3.548 3.505 3.609 . 0 0 "[ . 1 . 2]" 1
1308 2 52 GLU HA 2 53 VAL H 1.800 . 5.000 3.547 3.506 3.608 . 0 0 "[ . 1 . 2]" 1
1309 1 52 GLU QB 1 53 VAL H 1.800 . 4.500 2.711 2.178 2.895 . 0 0 "[ . 1 . 2]" 1
1310 2 52 GLU QB 2 53 VAL H 1.800 . 4.500 2.711 2.178 2.895 . 0 0 "[ . 1 . 2]" 1
1311 1 52 GLU QB 1 53 VAL MG1 1.800 . 7.500 5.097 4.811 5.265 . 0 0 "[ . 1 . 2]" 1
1312 2 52 GLU QB 2 53 VAL MG1 1.800 . 7.500 5.098 4.813 5.269 . 0 0 "[ . 1 . 2]" 1
1313 1 52 GLU QG 1 53 VAL H 1.800 . 6.000 4.322 3.909 4.560 . 0 0 "[ . 1 . 2]" 1
1314 2 52 GLU QG 2 53 VAL H 1.800 . 6.000 4.322 3.908 4.560 . 0 0 "[ . 1 . 2]" 1
1315 1 53 VAL H 1 54 VAL MG2 1.800 . 6.500 4.425 4.097 4.636 . 0 0 "[ . 1 . 2]" 1
1316 2 53 VAL H 2 54 VAL MG2 1.800 . 6.500 4.426 4.099 4.636 . 0 0 "[ . 1 . 2]" 1
1317 1 50 GLU HB3 1 53 VAL MG1 1.800 . 4.800 3.516 3.398 3.772 . 0 0 "[ . 1 . 2]" 1
1318 2 50 GLU HB3 2 53 VAL MG1 1.800 . 4.800 3.516 3.399 3.773 . 0 0 "[ . 1 . 2]" 1
1319 1 50 GLU HB2 1 53 VAL MG1 1.800 . 4.800 3.947 3.741 4.008 . 0 0 "[ . 1 . 2]" 1
1320 2 50 GLU HB2 2 53 VAL MG1 1.800 . 4.800 3.947 3.741 4.004 . 0 0 "[ . 1 . 2]" 1
1321 1 50 GLU QG 1 53 VAL MG1 1.800 . 5.800 4.008 3.857 4.192 . 0 0 "[ . 1 . 2]" 1
1322 2 50 GLU QG 2 53 VAL MG1 1.800 . 5.800 4.008 3.857 4.194 . 0 0 "[ . 1 . 2]" 1
1323 1 51 GLN HB3 1 53 VAL H 1.800 . 6.000 5.285 5.093 5.566 . 0 0 "[ . 1 . 2]" 1
1324 2 51 GLN HB3 2 53 VAL H 1.800 . 6.000 5.285 5.091 5.566 . 0 0 "[ . 1 . 2]" 1
1325 1 53 VAL H 1 55 ASP QB 1.800 . 7.000 4.672 4.485 4.975 . 0 0 "[ . 1 . 2]" 1
1326 2 53 VAL H 2 55 ASP QB 1.800 . 7.000 4.672 4.486 4.975 . 0 0 "[ . 1 . 2]" 1
1327 1 53 VAL H 1 56 LYS H 1.800 . 6.000 4.530 4.376 4.983 . 0 0 "[ . 1 . 2]" 1
1328 2 53 VAL H 2 56 LYS H 1.800 . 6.000 4.530 4.376 4.984 . 0 0 "[ . 1 . 2]" 1
1329 1 53 VAL HA 1 56 LYS QB 1.800 . 4.300 2.853 2.492 3.796 . 0 0 "[ . 1 . 2]" 1
1330 2 53 VAL HA 2 56 LYS QB 1.800 . 4.300 2.853 2.492 3.794 . 0 0 "[ . 1 . 2]" 1
1331 1 53 VAL MG1 1 80 MET HA 1.800 . 6.500 2.934 2.555 3.678 . 0 0 "[ . 1 . 2]" 1
1332 2 53 VAL MG1 2 80 MET HA 1.800 . 6.500 2.934 2.556 3.676 . 0 0 "[ . 1 . 2]" 1
1333 1 53 VAL MG1 1 81 VAL HA 1.800 . 6.500 2.950 2.665 3.479 . 0 0 "[ . 1 . 2]" 1
1334 2 53 VAL MG1 2 81 VAL HA 1.800 . 6.500 2.951 2.667 3.478 . 0 0 "[ . 1 . 2]" 1
1335 1 53 VAL H 1 84 ALA MB 1.800 . 6.500 3.920 3.621 4.554 . 0 0 "[ . 1 . 2]" 1
1336 2 53 VAL H 2 84 ALA MB 1.800 . 6.500 3.920 3.620 4.555 . 0 0 "[ . 1 . 2]" 1
1337 1 53 VAL MG1 1 84 ALA MB 1.800 . 8.000 2.178 1.772 2.760 0.028 7 0 "[ . 1 . 2]" 1
1338 2 53 VAL MG1 2 84 ALA MB 1.800 . 8.000 2.178 1.771 2.760 0.029 7 0 "[ . 1 . 2]" 1
1339 1 76 ALA MB 2 53 VAL MG1 1.800 . 9.000 6.097 5.874 6.223 . 0 0 "[ . 1 . 2]" 1
1340 1 53 VAL MG1 2 76 ALA MB 1.800 . 9.000 6.096 5.886 6.211 . 0 0 "[ . 1 . 2]" 1
1341 1 54 VAL H 1 54 VAL HB 1.800 . 2.900 2.463 2.367 2.580 . 0 0 "[ . 1 . 2]" 1
1342 2 54 VAL H 2 54 VAL HB 1.800 . 2.900 2.463 2.366 2.581 . 0 0 "[ . 1 . 2]" 1
1343 1 54 VAL H 1 54 VAL MG2 1.800 . 4.400 2.334 2.101 2.569 . 0 0 "[ . 1 . 2]" 1
1344 2 54 VAL H 2 54 VAL MG2 1.800 . 4.400 2.334 2.102 2.569 . 0 0 "[ . 1 . 2]" 1
1345 1 53 VAL H 1 54 VAL H 1.800 . 2.900 2.730 2.589 2.968 0.068 16 0 "[ . 1 . 2]" 1
1346 2 53 VAL H 2 54 VAL H 1.800 . 2.900 2.730 2.588 2.968 0.068 16 0 "[ . 1 . 2]" 1
1347 1 53 VAL HA 1 54 VAL H 1.800 . 5.000 3.576 3.553 3.588 . 0 0 "[ . 1 . 2]" 1
1348 2 53 VAL HA 2 54 VAL H 1.800 . 5.000 3.576 3.553 3.587 . 0 0 "[ . 1 . 2]" 1
1349 1 53 VAL HB 1 54 VAL H 1.800 . 2.900 2.394 2.078 2.675 . 0 0 "[ . 1 . 2]" 1
1350 2 53 VAL HB 2 54 VAL H 1.800 . 2.900 2.394 2.077 2.676 . 0 0 "[ . 1 . 2]" 1
1351 1 53 VAL MG2 1 54 VAL H 1.800 . 5.000 3.790 3.456 3.984 . 0 0 "[ . 1 . 2]" 1
1352 2 53 VAL MG2 2 54 VAL H 1.800 . 5.000 3.790 3.456 3.984 . 0 0 "[ . 1 . 2]" 1
1353 1 54 VAL MG1 1 55 ASP HA 1.800 . 6.500 3.595 3.388 3.829 . 0 0 "[ . 1 . 2]" 1
1354 2 54 VAL MG1 2 55 ASP HA 1.800 . 6.500 3.595 3.388 3.828 . 0 0 "[ . 1 . 2]" 1
1355 1 51 GLN HA 1 54 VAL H 1.800 . 5.000 3.834 3.627 4.692 . 0 0 "[ . 1 . 2]" 1
1356 2 51 GLN HA 2 54 VAL H 1.800 . 5.000 3.834 3.627 4.693 . 0 0 "[ . 1 . 2]" 1
1357 1 51 GLN HA 1 54 VAL MG2 1.800 . 6.500 4.099 3.750 4.577 . 0 0 "[ . 1 . 2]" 1
1358 2 51 GLN HA 2 54 VAL MG2 1.800 . 6.500 4.099 3.751 4.578 . 0 0 "[ . 1 . 2]" 1
1359 1 52 GLU HA 1 54 VAL H 1.800 . 6.000 4.778 4.592 5.057 . 0 0 "[ . 1 . 2]" 1
1360 2 52 GLU HA 2 54 VAL H 1.800 . 6.000 4.778 4.592 5.057 . 0 0 "[ . 1 . 2]" 1
1361 1 54 VAL HA 1 57 VAL HB 1.800 . 5.000 4.929 4.796 5.022 0.022 13 0 "[ . 1 . 2]" 1
1362 2 54 VAL HA 2 57 VAL HB 1.800 . 5.000 4.930 4.797 5.021 0.021 13 0 "[ . 1 . 2]" 1
1363 1 54 VAL H 1 57 VAL MG1 1.800 . 7.500 5.558 5.141 5.918 . 0 0 "[ . 1 . 2]" 1
1364 2 54 VAL H 2 57 VAL MG1 1.800 . 7.500 5.558 5.140 5.918 . 0 0 "[ . 1 . 2]" 1
1365 1 54 VAL MG1 1 58 MET QG 1.800 . 5.800 3.812 3.162 4.228 . 0 0 "[ . 1 . 2]" 1
1366 2 54 VAL MG1 2 58 MET QG 1.800 . 5.800 3.812 3.160 4.229 . 0 0 "[ . 1 . 2]" 1
1367 1 45 LEU HG 1 54 VAL MG2 1.800 . 6.500 4.681 3.837 5.232 . 0 0 "[ . 1 . 2]" 1
1368 2 45 LEU HG 2 54 VAL MG2 1.800 . 6.500 4.681 3.836 5.232 . 0 0 "[ . 1 . 2]" 1
1369 1 48 ILE HG13 1 54 VAL MG2 1.800 . 7.500 4.474 2.691 5.808 . 0 0 "[ . 1 . 2]" 1
1370 2 48 ILE HG13 2 54 VAL MG2 1.800 . 7.500 4.474 2.689 5.811 . 0 0 "[ . 1 . 2]" 1
1371 1 54 VAL H 1 84 ALA MB 1.800 . 6.500 2.952 2.714 3.448 . 0 0 "[ . 1 . 2]" 1
1372 2 54 VAL H 2 84 ALA MB 1.800 . 6.500 2.952 2.712 3.449 . 0 0 "[ . 1 . 2]" 1
1373 1 54 VAL MG2 1 84 ALA MB 1.800 . 5.800 1.848 1.686 2.136 0.114 3 0 "[ . 1 . 2]" 1
1374 2 54 VAL MG2 2 84 ALA MB 1.800 . 5.800 1.848 1.687 2.137 0.113 3 0 "[ . 1 . 2]" 1
1375 1 55 ASP H 1 55 ASP QB 1.800 . 3.900 2.310 2.119 2.432 . 0 0 "[ . 1 . 2]" 1
1376 2 55 ASP H 2 55 ASP QB 1.800 . 3.900 2.310 2.120 2.431 . 0 0 "[ . 1 . 2]" 1
1377 1 54 VAL H 1 55 ASP H 1.800 . 2.900 2.525 2.421 2.769 . 0 0 "[ . 1 . 2]" 1
1378 2 54 VAL H 2 55 ASP H 1.800 . 2.900 2.525 2.421 2.770 . 0 0 "[ . 1 . 2]" 1
1379 1 54 VAL HA 1 55 ASP H 1.800 . 3.500 3.509 3.481 3.533 0.033 5 0 "[ . 1 . 2]" 1
1380 2 54 VAL HA 2 55 ASP H 1.800 . 3.500 3.509 3.483 3.533 0.033 5 0 "[ . 1 . 2]" 1
1381 1 54 VAL HB 1 55 ASP H 1.800 . 2.900 2.879 2.734 2.979 0.079 16 0 "[ . 1 . 2]" 1
1382 2 54 VAL HB 2 55 ASP H 1.800 . 2.900 2.879 2.731 2.982 0.082 16 0 "[ . 1 . 2]" 1
1383 1 51 GLN HA 1 55 ASP H 1.800 . 5.000 3.781 3.617 4.101 . 0 0 "[ . 1 . 2]" 1
1384 2 51 GLN HA 2 55 ASP H 1.800 . 5.000 3.781 3.618 4.101 . 0 0 "[ . 1 . 2]" 1
1385 1 52 GLU HA 1 55 ASP H 1.800 . 3.500 3.517 3.453 3.552 0.052 13 0 "[ . 1 . 2]" 1
1386 2 52 GLU HA 2 55 ASP H 1.800 . 3.500 3.517 3.454 3.553 0.053 5 0 "[ . 1 . 2]" 1
1387 1 53 VAL H 1 55 ASP H 1.800 . 5.000 3.795 3.682 3.887 . 0 0 "[ . 1 . 2]" 1
1388 2 53 VAL H 2 55 ASP H 1.800 . 5.000 3.795 3.681 3.890 . 0 0 "[ . 1 . 2]" 1
1389 1 53 VAL HA 1 55 ASP H 1.800 . 5.000 4.347 3.996 4.533 . 0 0 "[ . 1 . 2]" 1
1390 2 53 VAL HA 2 55 ASP H 1.800 . 5.000 4.347 3.996 4.534 . 0 0 "[ . 1 . 2]" 1
1391 1 55 ASP H 1 58 MET H 1.800 . 6.000 4.671 4.518 4.835 . 0 0 "[ . 1 . 2]" 1
1392 2 55 ASP H 2 58 MET H 1.800 . 6.000 4.672 4.521 4.834 . 0 0 "[ . 1 . 2]" 1
1393 1 55 ASP H 1 58 MET HB3 1.800 . 5.000 4.848 4.697 5.016 0.016 12 0 "[ . 1 . 2]" 1
1394 2 55 ASP H 2 58 MET HB3 1.800 . 5.000 4.848 4.699 5.016 0.016 12 0 "[ . 1 . 2]" 1
1395 1 55 ASP HA 1 58 MET HB3 1.800 . 3.300 2.536 2.103 2.885 . 0 0 "[ . 1 . 2]" 1
1396 2 55 ASP HA 2 58 MET HB3 1.800 . 3.300 2.537 2.102 2.885 . 0 0 "[ . 1 . 2]" 1
1397 1 55 ASP HA 1 58 MET HB2 1.800 . 5.000 3.766 3.317 4.185 . 0 0 "[ . 1 . 2]" 1
1398 2 55 ASP HA 2 58 MET HB2 1.800 . 5.000 3.766 3.318 4.182 . 0 0 "[ . 1 . 2]" 1
1399 1 55 ASP H 1 58 MET QG 1.800 . 7.000 6.232 6.193 6.270 . 0 0 "[ . 1 . 2]" 1
1400 2 55 ASP H 2 58 MET QG 1.800 . 7.000 6.233 6.192 6.271 . 0 0 "[ . 1 . 2]" 1
1401 1 56 LYS H 1 56 LYS QB 1.800 . 3.900 2.275 2.110 2.666 . 0 0 "[ . 1 . 2]" 1
1402 2 56 LYS H 2 56 LYS QB 1.800 . 3.900 2.276 2.112 2.666 . 0 0 "[ . 1 . 2]" 1
1403 1 56 LYS H 1 56 LYS QG 1.800 . 4.500 3.724 1.880 4.077 . 0 0 "[ . 1 . 2]" 1
1404 2 56 LYS H 2 56 LYS QG 1.800 . 4.500 3.725 1.881 4.080 . 0 0 "[ . 1 . 2]" 1
1405 1 56 LYS H 1 56 LYS QD 1.800 . 4.500 3.999 3.402 4.170 . 0 0 "[ . 1 . 2]" 1
1406 2 56 LYS H 2 56 LYS QD 1.800 . 4.500 3.999 3.404 4.168 . 0 0 "[ . 1 . 2]" 1
1407 1 55 ASP H 1 56 LYS H 1.800 . 2.900 2.429 2.355 2.634 . 0 0 "[ . 1 . 2]" 1
1408 2 55 ASP H 2 56 LYS H 1.800 . 2.900 2.428 2.356 2.634 . 0 0 "[ . 1 . 2]" 1
1409 1 55 ASP HA 1 56 LYS H 1.800 . 5.000 3.469 3.432 3.560 . 0 0 "[ . 1 . 2]" 1
1410 2 55 ASP HA 2 56 LYS H 1.800 . 5.000 3.469 3.432 3.559 . 0 0 "[ . 1 . 2]" 1
1411 1 55 ASP QB 1 56 LYS H 1.800 . 3.900 2.976 2.735 3.131 . 0 0 "[ . 1 . 2]" 1
1412 2 55 ASP QB 2 56 LYS H 1.800 . 3.900 2.977 2.736 3.130 . 0 0 "[ . 1 . 2]" 1
1413 1 56 LYS H 1 57 VAL MG1 1.800 . 6.500 4.453 4.155 4.752 . 0 0 "[ . 1 . 2]" 1
1414 2 56 LYS H 2 57 VAL MG1 1.800 . 6.500 4.453 4.155 4.753 . 0 0 "[ . 1 . 2]" 1
1415 1 52 GLU HA 1 56 LYS H 1.800 . 5.000 3.938 3.713 4.483 . 0 0 "[ . 1 . 2]" 1
1416 2 52 GLU HA 2 56 LYS H 1.800 . 5.000 3.939 3.712 4.483 . 0 0 "[ . 1 . 2]" 1
1417 1 53 VAL HA 1 56 LYS H 1.800 . 3.500 3.539 3.505 3.584 0.084 11 0 "[ . 1 . 2]" 1
1418 2 53 VAL HA 2 56 LYS H 1.800 . 3.500 3.539 3.504 3.584 0.084 11 0 "[ . 1 . 2]" 1
1419 1 54 VAL H 1 56 LYS H 1.800 . 6.000 3.912 3.730 4.480 . 0 0 "[ . 1 . 2]" 1
1420 2 54 VAL H 2 56 LYS H 1.800 . 6.000 3.911 3.728 4.481 . 0 0 "[ . 1 . 2]" 1
1421 1 54 VAL HA 1 56 LYS H 1.800 . 6.000 3.977 3.847 4.316 . 0 0 "[ . 1 . 2]" 1
1422 2 54 VAL HA 2 56 LYS H 1.800 . 6.000 3.977 3.848 4.317 . 0 0 "[ . 1 . 2]" 1
1423 1 56 LYS H 1 58 MET H 1.800 . 6.000 3.794 3.578 4.181 . 0 0 "[ . 1 . 2]" 1
1424 2 56 LYS H 2 58 MET H 1.800 . 6.000 3.794 3.577 4.182 . 0 0 "[ . 1 . 2]" 1
1425 1 56 LYS HA 1 59 GLU QB 1.800 . 3.700 2.539 2.291 3.377 . 0 0 "[ . 1 . 2]" 1
1426 2 56 LYS HA 2 59 GLU QB 1.800 . 3.700 2.539 2.291 3.378 . 0 0 "[ . 1 . 2]" 1
1427 1 57 VAL H 1 57 VAL HB 1.800 . 3.500 3.591 3.571 3.611 0.111 3 0 "[ . 1 . 2]" 1
1428 2 57 VAL H 2 57 VAL HB 1.800 . 3.500 3.592 3.571 3.614 0.114 3 0 "[ . 1 . 2]" 1
1429 1 57 VAL H 1 57 VAL MG1 1.800 . 4.400 2.475 2.157 2.823 . 0 0 "[ . 1 . 2]" 1
1430 2 57 VAL H 2 57 VAL MG1 1.800 . 4.400 2.475 2.157 2.824 . 0 0 "[ . 1 . 2]" 1
1431 1 57 VAL H 1 57 VAL MG2 1.800 . 5.000 1.809 1.780 1.855 0.020 4 0 "[ . 1 . 2]" 1
1432 2 57 VAL H 2 57 VAL MG2 1.800 . 5.000 1.809 1.781 1.855 0.019 4 0 "[ . 1 . 2]" 1
1433 1 56 LYS H 1 57 VAL H 1.800 . 2.900 2.567 2.419 2.807 . 0 0 "[ . 1 . 2]" 1
1434 2 56 LYS H 2 57 VAL H 1.800 . 2.900 2.567 2.418 2.810 . 0 0 "[ . 1 . 2]" 1
1435 1 56 LYS HA 1 57 VAL H 1.800 . 5.000 3.585 3.549 3.608 . 0 0 "[ . 1 . 2]" 1
1436 2 56 LYS HA 2 57 VAL H 1.800 . 5.000 3.585 3.548 3.607 . 0 0 "[ . 1 . 2]" 1
1437 1 56 LYS QB 1 57 VAL H 1.800 . 3.900 2.558 2.331 3.415 . 0 0 "[ . 1 . 2]" 1
1438 2 56 LYS QB 2 57 VAL H 1.800 . 3.900 2.558 2.331 3.414 . 0 0 "[ . 1 . 2]" 1
1439 1 56 LYS QB 1 57 VAL MG1 1.800 . 7.500 3.268 2.786 3.891 . 0 0 "[ . 1 . 2]" 1
1440 2 56 LYS QB 2 57 VAL MG1 1.800 . 7.500 3.269 2.787 3.891 . 0 0 "[ . 1 . 2]" 1
1441 1 56 LYS QG 1 57 VAL H 1.800 . 6.000 3.700 1.809 4.363 . 0 0 "[ . 1 . 2]" 1
1442 2 56 LYS QG 2 57 VAL H 1.800 . 6.000 3.700 1.810 4.363 . 0 0 "[ . 1 . 2]" 1
1443 1 56 LYS QE 1 57 VAL MG1 1.800 . 7.500 4.132 3.084 5.440 . 0 0 "[ . 1 . 2]" 1
1444 2 56 LYS QE 2 57 VAL MG1 1.800 . 7.500 4.132 3.082 5.439 . 0 0 "[ . 1 . 2]" 1
1445 1 57 VAL H 1 58 MET QG 1.800 . 7.000 6.183 5.976 6.294 . 0 0 "[ . 1 . 2]" 1
1446 2 57 VAL H 2 58 MET QG 1.800 . 7.000 6.184 5.975 6.297 . 0 0 "[ . 1 . 2]" 1
1447 1 53 VAL HA 1 57 VAL H 1.800 . 5.000 4.243 3.944 4.643 . 0 0 "[ . 1 . 2]" 1
1448 2 53 VAL HA 2 57 VAL H 1.800 . 5.000 4.243 3.945 4.644 . 0 0 "[ . 1 . 2]" 1
1449 1 54 VAL H 1 57 VAL H 1.800 . 6.000 5.007 4.830 5.268 . 0 0 "[ . 1 . 2]" 1
1450 2 54 VAL H 2 57 VAL H 1.800 . 6.000 5.007 4.829 5.269 . 0 0 "[ . 1 . 2]" 1
1451 1 54 VAL HA 1 57 VAL H 1.800 . 3.500 3.573 3.542 3.626 0.126 16 0 "[ . 1 . 2]" 1
1452 2 54 VAL HA 2 57 VAL H 1.800 . 3.500 3.572 3.545 3.625 0.125 16 0 "[ . 1 . 2]" 1
1453 1 54 VAL HA 1 57 VAL MG1 1.800 . 6.500 4.088 3.641 4.504 . 0 0 "[ . 1 . 2]" 1
1454 2 54 VAL HA 2 57 VAL MG1 1.800 . 6.500 4.088 3.641 4.502 . 0 0 "[ . 1 . 2]" 1
1455 1 55 ASP H 1 57 VAL H 1.800 . 6.000 4.355 4.156 4.537 . 0 0 "[ . 1 . 2]" 1
1456 2 55 ASP H 2 57 VAL H 1.800 . 6.000 4.355 4.156 4.535 . 0 0 "[ . 1 . 2]" 1
1457 1 55 ASP QB 1 57 VAL H 1.800 . 7.000 5.131 4.966 5.308 . 0 0 "[ . 1 . 2]" 1
1458 2 55 ASP QB 2 57 VAL H 1.800 . 7.000 5.132 4.970 5.308 . 0 0 "[ . 1 . 2]" 1
1459 1 57 VAL HA 1 60 THR HB 1.800 . 5.000 3.562 3.173 4.069 . 0 0 "[ . 1 . 2]" 1
1460 2 57 VAL HA 2 60 THR HB 1.800 . 5.000 3.562 3.172 4.071 . 0 0 "[ . 1 . 2]" 1
1461 1 37 ILE MD 1 57 VAL MG1 1.800 . 8.000 3.993 3.489 4.700 . 0 0 "[ . 1 . 2]" 1
1462 2 37 ILE MD 2 57 VAL MG1 1.800 . 8.000 3.994 3.491 4.698 . 0 0 "[ . 1 . 2]" 1
1463 1 57 VAL MG1 1 77 PHE HA 1.800 . 6.500 2.633 2.151 3.152 . 0 0 "[ . 1 . 2]" 1
1464 2 57 VAL MG1 2 77 PHE HA 1.800 . 6.500 2.633 2.153 3.154 . 0 0 "[ . 1 . 2]" 1
1465 1 57 VAL MG1 1 77 PHE QE 1.800 . 8.900 2.744 1.852 3.150 . 0 0 "[ . 1 . 2]" 1
1466 2 57 VAL MG1 2 77 PHE QE 1.800 . 8.900 2.744 1.853 3.150 . 0 0 "[ . 1 . 2]" 1
1467 1 57 VAL MG1 1 80 MET HA 1.800 . 6.500 5.166 4.661 5.403 . 0 0 "[ . 1 . 2]" 1
1468 2 57 VAL MG1 2 80 MET HA 1.800 . 6.500 5.165 4.659 5.404 . 0 0 "[ . 1 . 2]" 1
1469 1 57 VAL MG1 1 80 MET HB3 1.800 . 6.500 3.567 2.787 4.274 . 0 0 "[ . 1 . 2]" 1
1470 2 57 VAL MG1 2 80 MET HB3 1.800 . 6.500 3.567 2.787 4.273 . 0 0 "[ . 1 . 2]" 1
1471 1 57 VAL MG1 1 80 MET HB2 1.800 . 6.500 2.771 2.219 3.606 . 0 0 "[ . 1 . 2]" 1
1472 2 57 VAL MG1 2 80 MET HB2 1.800 . 6.500 2.771 2.217 3.604 . 0 0 "[ . 1 . 2]" 1
1473 1 57 VAL MG1 1 80 MET HG3 1.800 . 6.500 3.090 2.271 3.840 . 0 0 "[ . 1 . 2]" 1
1474 2 57 VAL MG1 2 80 MET HG3 1.800 . 6.500 3.090 2.272 3.839 . 0 0 "[ . 1 . 2]" 1
1475 1 57 VAL MG1 1 81 VAL HA 1.800 . 6.500 4.850 4.287 5.308 . 0 0 "[ . 1 . 2]" 1
1476 2 57 VAL MG1 2 81 VAL HA 1.800 . 6.500 4.849 4.283 5.308 . 0 0 "[ . 1 . 2]" 1
1477 1 57 VAL H 1 81 VAL MG1 1.800 . 7.500 4.297 4.041 4.546 . 0 0 "[ . 1 . 2]" 1
1478 2 57 VAL H 2 81 VAL MG1 1.800 . 7.500 4.297 4.041 4.546 . 0 0 "[ . 1 . 2]" 1
1479 1 58 MET H 1 58 MET HB3 1.800 . 2.900 2.629 2.496 2.758 . 0 0 "[ . 1 . 2]" 1
1480 2 58 MET H 2 58 MET HB3 1.800 . 2.900 2.629 2.496 2.758 . 0 0 "[ . 1 . 2]" 1
1481 1 58 MET H 1 58 MET HB2 1.800 . 3.500 2.463 2.326 2.592 . 0 0 "[ . 1 . 2]" 1
1482 2 58 MET H 2 58 MET HB2 1.800 . 3.500 2.463 2.326 2.593 . 0 0 "[ . 1 . 2]" 1
1483 1 58 MET H 1 58 MET QG 1.800 . 4.500 4.035 3.975 4.082 . 0 0 "[ . 1 . 2]" 1
1484 2 58 MET H 2 58 MET QG 1.800 . 4.500 4.035 3.975 4.083 . 0 0 "[ . 1 . 2]" 1
1485 1 57 VAL H 1 58 MET H 1.800 . 2.900 2.501 2.263 2.716 . 0 0 "[ . 1 . 2]" 1
1486 2 57 VAL H 2 58 MET H 1.800 . 2.900 2.501 2.263 2.716 . 0 0 "[ . 1 . 2]" 1
1487 1 57 VAL HA 1 58 MET H 1.800 . 5.000 3.529 3.477 3.569 . 0 0 "[ . 1 . 2]" 1
1488 2 57 VAL HA 2 58 MET H 1.800 . 5.000 3.529 3.479 3.569 . 0 0 "[ . 1 . 2]" 1
1489 1 57 VAL HB 1 58 MET H 1.800 . 3.500 3.541 3.495 3.590 0.090 11 0 "[ . 1 . 2]" 1
1490 2 57 VAL HB 2 58 MET H 1.800 . 3.500 3.542 3.492 3.589 0.089 11 0 "[ . 1 . 2]" 1
1491 1 57 VAL MG1 1 58 MET H 1.800 . 5.000 3.933 3.771 4.069 . 0 0 "[ . 1 . 2]" 1
1492 2 57 VAL MG1 2 58 MET H 1.800 . 5.000 3.933 3.772 4.069 . 0 0 "[ . 1 . 2]" 1
1493 1 57 VAL MG2 1 58 MET H 1.800 . 5.000 1.798 1.753 1.837 0.047 16 0 "[ . 1 . 2]" 1
1494 2 57 VAL MG2 2 58 MET H 1.800 . 5.000 1.797 1.753 1.837 0.047 16 0 "[ . 1 . 2]" 1
1495 1 57 VAL MG2 1 58 MET ME 1.800 . 6.300 3.209 2.617 4.007 . 0 0 "[ . 1 . 2]" 1
1496 2 57 VAL MG2 2 58 MET ME 1.800 . 6.300 3.209 2.615 4.008 . 0 0 "[ . 1 . 2]" 1
1497 1 58 MET H 1 59 GLU QB 1.800 . 7.000 4.366 4.226 4.650 . 0 0 "[ . 1 . 2]" 1
1498 2 58 MET H 2 59 GLU QB 1.800 . 7.000 4.366 4.227 4.651 . 0 0 "[ . 1 . 2]" 1
1499 1 54 VAL HA 1 58 MET H 1.800 . 5.000 3.608 3.200 4.030 . 0 0 "[ . 1 . 2]" 1
1500 2 54 VAL HA 2 58 MET H 1.800 . 5.000 3.607 3.197 4.031 . 0 0 "[ . 1 . 2]" 1
1501 1 54 VAL MG1 1 58 MET H 1.800 . 6.500 3.695 3.285 3.939 . 0 0 "[ . 1 . 2]" 1
1502 2 54 VAL MG1 2 58 MET H 1.800 . 6.500 3.695 3.285 3.938 . 0 0 "[ . 1 . 2]" 1
1503 1 54 VAL MG1 1 58 MET ME 1.800 . 6.300 2.707 2.222 3.204 . 0 0 "[ . 1 . 2]" 1
1504 2 54 VAL MG1 2 58 MET ME 1.800 . 6.300 2.707 2.223 3.203 . 0 0 "[ . 1 . 2]" 1
1505 1 55 ASP HA 1 58 MET H 1.800 . 5.000 3.706 3.245 4.115 . 0 0 "[ . 1 . 2]" 1
1506 2 55 ASP HA 2 58 MET H 1.800 . 5.000 3.706 3.245 4.114 . 0 0 "[ . 1 . 2]" 1
1507 1 58 MET HA 1 61 LEU HB3 1.800 . 3.300 3.373 3.346 3.407 0.107 13 0 "[ . 1 . 2]" 1
1508 2 58 MET HA 2 61 LEU HB3 1.800 . 3.300 3.374 3.347 3.408 0.108 13 0 "[ . 1 . 2]" 1
1509 1 58 MET HA 1 61 LEU HB2 1.800 . 6.000 2.080 2.002 2.167 . 0 0 "[ . 1 . 2]" 1
1510 2 58 MET HA 2 61 LEU HB2 1.800 . 6.000 2.080 2.001 2.166 . 0 0 "[ . 1 . 2]" 1
1511 1 58 MET H 1 61 LEU MD1 1.800 . 7.500 3.971 3.864 4.079 . 0 0 "[ . 1 . 2]" 1
1512 2 58 MET H 2 61 LEU MD1 1.800 . 7.500 3.972 3.864 4.079 . 0 0 "[ . 1 . 2]" 1
1513 1 58 MET ME 1 61 LEU MD1 1.800 . 9.000 2.635 1.898 3.410 . 0 0 "[ . 1 . 2]" 1
1514 2 58 MET ME 2 61 LEU MD1 1.800 . 9.000 2.635 1.898 3.410 . 0 0 "[ . 1 . 2]" 1
1515 1 34 LYS HA 1 58 MET ME 1.800 . 6.500 4.152 3.691 4.940 . 0 0 "[ . 1 . 2]" 1
1516 2 34 LYS HA 2 58 MET ME 1.800 . 6.500 4.152 3.689 4.939 . 0 0 "[ . 1 . 2]" 1
1517 1 34 LYS HG3 1 58 MET ME 1.800 . 6.500 3.638 2.354 4.723 . 0 0 "[ . 1 . 2]" 1
1518 2 34 LYS HG3 2 58 MET ME 1.800 . 6.500 3.638 2.355 4.725 . 0 0 "[ . 1 . 2]" 1
1519 1 34 LYS HG2 1 58 MET ME 1.800 . 6.500 3.350 2.628 3.978 . 0 0 "[ . 1 . 2]" 1
1520 2 34 LYS HG2 2 58 MET ME 1.800 . 6.500 3.350 2.628 3.978 . 0 0 "[ . 1 . 2]" 1
1521 1 37 ILE HB 1 58 MET ME 1.800 . 6.500 3.984 3.596 4.179 . 0 0 "[ . 1 . 2]" 1
1522 2 37 ILE HB 2 58 MET ME 1.800 . 6.500 3.984 3.595 4.179 . 0 0 "[ . 1 . 2]" 1
1523 1 37 ILE MD 1 58 MET ME 1.800 . 6.300 3.724 3.354 4.101 . 0 0 "[ . 1 . 2]" 1
1524 2 37 ILE MD 2 58 MET ME 1.800 . 6.300 3.724 3.353 4.103 . 0 0 "[ . 1 . 2]" 1
1525 1 37 ILE MG 1 58 MET ME 1.800 . 6.300 4.158 3.989 4.260 . 0 0 "[ . 1 . 2]" 1
1526 2 37 ILE MG 2 58 MET ME 1.800 . 6.300 4.158 3.989 4.260 . 0 0 "[ . 1 . 2]" 1
1527 1 38 ASN HA 1 58 MET ME 1.800 . 6.500 5.144 4.499 5.396 . 0 0 "[ . 1 . 2]" 1
1528 2 38 ASN HA 2 58 MET ME 1.800 . 6.500 5.143 4.497 5.393 . 0 0 "[ . 1 . 2]" 1
1529 1 58 MET H 1 81 VAL MG1 1.800 . 7.500 4.259 4.138 4.348 . 0 0 "[ . 1 . 2]" 1
1530 2 58 MET H 2 81 VAL MG1 1.800 . 7.500 4.259 4.137 4.347 . 0 0 "[ . 1 . 2]" 1
1531 1 58 MET ME 1 81 VAL MG1 1.800 . 8.000 3.537 3.103 4.431 . 0 0 "[ . 1 . 2]" 1
1532 2 58 MET ME 2 81 VAL MG1 1.800 . 8.000 3.537 3.103 4.431 . 0 0 "[ . 1 . 2]" 1
1533 1 59 GLU H 1 59 GLU QB 1.800 . 3.900 2.187 2.079 2.631 . 0 0 "[ . 1 . 2]" 1
1534 2 59 GLU H 2 59 GLU QB 1.800 . 3.900 2.187 2.078 2.631 . 0 0 "[ . 1 . 2]" 1
1535 1 59 GLU H 1 59 GLU HG3 1.800 . 3.500 3.229 2.856 3.547 0.047 19 0 "[ . 1 . 2]" 1
1536 2 59 GLU H 2 59 GLU HG3 1.800 . 3.500 3.229 2.857 3.545 0.045 19 0 "[ . 1 . 2]" 1
1537 1 58 MET H 1 59 GLU H 1.800 . 2.900 2.526 2.430 2.634 . 0 0 "[ . 1 . 2]" 1
1538 2 58 MET H 2 59 GLU H 1.800 . 2.900 2.526 2.431 2.634 . 0 0 "[ . 1 . 2]" 1
1539 1 58 MET HB3 1 59 GLU H 1.800 . 2.900 2.960 2.923 3.018 0.118 6 0 "[ . 1 . 2]" 1
1540 2 58 MET HB3 2 59 GLU H 1.800 . 2.900 2.960 2.922 3.015 0.115 6 0 "[ . 1 . 2]" 1
1541 1 58 MET QG 1 59 GLU H 1.800 . 6.000 4.059 3.834 4.220 . 0 0 "[ . 1 . 2]" 1
1542 2 58 MET QG 2 59 GLU H 1.800 . 6.000 4.060 3.835 4.218 . 0 0 "[ . 1 . 2]" 1
1543 1 55 ASP HA 1 59 GLU H 1.800 . 6.000 3.747 3.506 3.995 . 0 0 "[ . 1 . 2]" 1
1544 2 55 ASP HA 2 59 GLU H 1.800 . 6.000 3.747 3.505 3.996 . 0 0 "[ . 1 . 2]" 1
1545 1 55 ASP QB 1 59 GLU H 1.800 . 6.000 4.973 4.574 5.355 . 0 0 "[ . 1 . 2]" 1
1546 2 55 ASP QB 2 59 GLU H 1.800 . 6.000 4.973 4.575 5.353 . 0 0 "[ . 1 . 2]" 1
1547 1 56 LYS HA 1 59 GLU H 1.800 . 3.500 3.541 3.407 3.588 0.088 16 0 "[ . 1 . 2]" 1
1548 2 56 LYS HA 2 59 GLU H 1.800 . 3.500 3.541 3.405 3.587 0.087 16 0 "[ . 1 . 2]" 1
1549 1 57 VAL HA 1 59 GLU H 1.800 . 6.000 3.964 3.789 4.080 . 0 0 "[ . 1 . 2]" 1
1550 2 57 VAL HA 2 59 GLU H 1.800 . 6.000 3.964 3.792 4.080 . 0 0 "[ . 1 . 2]" 1
1551 1 59 GLU HA 1 62 ASP QB 1.800 . 3.700 3.388 3.269 3.432 . 0 0 "[ . 1 . 2]" 1
1552 2 59 GLU HA 2 62 ASP QB 1.800 . 3.700 3.389 3.267 3.436 . 0 0 "[ . 1 . 2]" 1
1553 1 59 GLU H 1 81 VAL MG1 1.800 . 7.500 6.315 6.277 6.363 . 0 0 "[ . 1 . 2]" 1
1554 2 59 GLU H 2 81 VAL MG1 1.800 . 7.500 6.314 6.278 6.361 . 0 0 "[ . 1 . 2]" 1
1555 1 60 THR H 1 60 THR HA 1.800 . 2.900 2.871 2.842 2.906 0.006 11 0 "[ . 1 . 2]" 1
1556 2 60 THR H 2 60 THR HA 1.800 . 2.900 2.870 2.840 2.908 0.008 11 0 "[ . 1 . 2]" 1
1557 1 60 THR H 1 60 THR HG1 1.800 . 4.400 2.612 1.994 3.132 . 0 0 "[ . 1 . 2]" 1
1558 2 60 THR H 2 60 THR HG1 1.800 . 4.400 2.612 1.995 3.132 . 0 0 "[ . 1 . 2]" 1
1559 1 59 GLU H 1 60 THR H 1.800 . 2.900 2.665 2.494 2.781 . 0 0 "[ . 1 . 2]" 1
1560 2 59 GLU H 2 60 THR H 1.800 . 2.900 2.665 2.494 2.779 . 0 0 "[ . 1 . 2]" 1
1561 1 59 GLU HA 1 60 THR H 1.800 . 5.000 3.596 3.576 3.610 . 0 0 "[ . 1 . 2]" 1
1562 2 59 GLU HA 2 60 THR H 1.800 . 5.000 3.596 3.576 3.611 . 0 0 "[ . 1 . 2]" 1
1563 1 59 GLU QB 1 60 THR H 1.800 . 3.900 2.522 2.409 3.366 . 0 0 "[ . 1 . 2]" 1
1564 2 59 GLU QB 2 60 THR H 1.800 . 3.900 2.522 2.412 3.365 . 0 0 "[ . 1 . 2]" 1
1565 1 60 THR H 1 61 LEU H 1.800 . 2.900 2.539 2.395 2.625 . 0 0 "[ . 1 . 2]" 1
1566 2 60 THR H 2 61 LEU H 1.800 . 2.900 2.540 2.394 2.625 . 0 0 "[ . 1 . 2]" 1
1567 1 60 THR H 1 61 LEU HB3 1.800 . 6.000 5.936 5.788 6.006 0.006 3 0 "[ . 1 . 2]" 1
1568 2 60 THR H 2 61 LEU HB3 1.800 . 6.000 5.937 5.785 6.008 0.008 3 0 "[ . 1 . 2]" 1
1569 1 60 THR H 1 61 LEU HG 1.800 . 5.000 4.935 4.738 5.038 0.038 15 0 "[ . 1 . 2]" 1
1570 2 60 THR H 2 61 LEU HG 1.800 . 5.000 4.936 4.741 5.039 0.039 15 0 "[ . 1 . 2]" 1
1571 1 60 THR H 1 61 LEU MD1 1.800 . 7.500 5.338 5.140 5.451 . 0 0 "[ . 1 . 2]" 1
1572 2 60 THR H 2 61 LEU MD1 1.800 . 7.500 5.338 5.138 5.452 . 0 0 "[ . 1 . 2]" 1
1573 1 60 THR H 1 61 LEU MD2 1.800 . 7.500 5.881 5.712 6.015 . 0 0 "[ . 1 . 2]" 1
1574 2 60 THR H 2 61 LEU MD2 1.800 . 7.500 5.882 5.715 6.012 . 0 0 "[ . 1 . 2]" 1
1575 1 56 LYS HA 1 60 THR H 1.800 . 5.000 4.133 3.769 4.491 . 0 0 "[ . 1 . 2]" 1
1576 2 56 LYS HA 2 60 THR H 1.800 . 5.000 4.133 3.770 4.493 . 0 0 "[ . 1 . 2]" 1
1577 1 56 LYS QG 1 60 THR H 1.800 . 6.000 4.718 4.187 5.379 . 0 0 "[ . 1 . 2]" 1
1578 2 56 LYS QG 2 60 THR H 1.800 . 6.000 4.718 4.187 5.380 . 0 0 "[ . 1 . 2]" 1
1579 1 57 VAL HA 1 60 THR H 1.800 . 3.500 3.565 3.529 3.647 0.147 16 0 "[ . 1 . 2]" 1
1580 2 57 VAL HA 2 60 THR H 1.800 . 3.500 3.565 3.527 3.648 0.148 16 0 "[ . 1 . 2]" 1
1581 1 57 VAL MG2 1 60 THR H 1.800 . 7.500 5.207 5.128 5.307 . 0 0 "[ . 1 . 2]" 1
1582 2 57 VAL MG2 2 60 THR H 1.800 . 7.500 5.206 5.129 5.309 . 0 0 "[ . 1 . 2]" 1
1583 1 57 VAL HA 1 60 THR MG 1.800 . 6.500 4.807 4.556 5.064 . 0 0 "[ . 1 . 2]" 1
1584 2 57 VAL HA 2 60 THR MG 1.800 . 6.500 4.806 4.555 5.064 . 0 0 "[ . 1 . 2]" 1
1585 1 60 THR H 1 62 ASP QB 1.800 . 7.000 5.624 5.534 5.770 . 0 0 "[ . 1 . 2]" 1
1586 2 60 THR H 2 62 ASP QB 1.800 . 7.000 5.624 5.533 5.772 . 0 0 "[ . 1 . 2]" 1
1587 1 60 THR HA 1 63 GLU QB 1.800 . 4.300 2.039 1.840 2.328 . 0 0 "[ . 1 . 2]" 1
1588 2 60 THR HA 2 63 GLU QB 1.800 . 4.300 2.039 1.840 2.326 . 0 0 "[ . 1 . 2]" 1
1589 1 60 THR MG 1 63 GLU QB 1.800 . 7.500 3.083 2.676 3.549 . 0 0 "[ . 1 . 2]" 1
1590 2 60 THR MG 2 63 GLU QB 1.800 . 7.500 3.083 2.675 3.550 . 0 0 "[ . 1 . 2]" 1
1591 1 30 LYS QB 1 60 THR MG 1.800 . 7.500 4.664 3.790 5.245 . 0 0 "[ . 1 . 2]" 1
1592 2 30 LYS QB 2 60 THR MG 1.800 . 7.500 4.665 3.792 5.245 . 0 0 "[ . 1 . 2]" 1
1593 1 60 THR H 1 77 PHE HZ 1.800 . 6.000 4.815 4.078 5.639 . 0 0 "[ . 1 . 2]" 1
1594 2 60 THR H 2 77 PHE HZ 1.800 . 6.000 4.815 4.078 5.640 . 0 0 "[ . 1 . 2]" 1
1595 1 60 THR MG 1 77 PHE HZ 1.800 . 6.500 3.520 2.885 4.145 . 0 0 "[ . 1 . 2]" 1
1596 2 60 THR MG 2 77 PHE HZ 1.800 . 6.500 3.519 2.886 4.147 . 0 0 "[ . 1 . 2]" 1
1597 1 61 LEU HA 1 61 LEU MD2 1.800 . 4.300 1.982 1.837 2.130 . 0 0 "[ . 1 . 2]" 1
1598 2 61 LEU HA 2 61 LEU MD2 1.800 . 4.300 1.983 1.837 2.131 . 0 0 "[ . 1 . 2]" 1
1599 1 61 LEU H 1 61 LEU HB2 1.800 . 3.500 2.142 2.121 2.213 . 0 0 "[ . 1 . 2]" 1
1600 2 61 LEU H 2 61 LEU HB2 1.800 . 3.500 2.142 2.121 2.214 . 0 0 "[ . 1 . 2]" 1
1601 1 61 LEU H 1 61 LEU HG 1.800 . 2.900 2.892 2.660 2.944 0.044 19 0 "[ . 1 . 2]" 1
1602 2 61 LEU H 2 61 LEU HG 1.800 . 2.900 2.892 2.660 2.943 0.043 19 0 "[ . 1 . 2]" 1
1603 1 61 LEU H 1 61 LEU MD1 1.800 . 5.000 3.736 3.640 3.854 . 0 0 "[ . 1 . 2]" 1
1604 2 61 LEU H 2 61 LEU MD1 1.800 . 5.000 3.736 3.640 3.853 . 0 0 "[ . 1 . 2]" 1
1605 1 61 LEU H 1 61 LEU MD2 1.800 . 5.000 3.905 3.804 4.010 . 0 0 "[ . 1 . 2]" 1
1606 2 61 LEU H 2 61 LEU MD2 1.800 . 5.000 3.906 3.803 4.008 . 0 0 "[ . 1 . 2]" 1
1607 1 60 THR HA 1 61 LEU H 1.800 . 5.000 3.472 3.434 3.512 . 0 0 "[ . 1 . 2]" 1
1608 2 60 THR HA 2 61 LEU H 1.800 . 5.000 3.472 3.432 3.512 . 0 0 "[ . 1 . 2]" 1
1609 1 60 THR HB 1 61 LEU H 1.800 . 3.500 2.897 2.649 3.114 . 0 0 "[ . 1 . 2]" 1
1610 2 60 THR HB 2 61 LEU H 1.800 . 3.500 2.897 2.649 3.112 . 0 0 "[ . 1 . 2]" 1
1611 1 60 THR MG 1 61 LEU H 1.800 . 5.000 3.974 3.586 4.226 . 0 0 "[ . 1 . 2]" 1
1612 2 60 THR MG 2 61 LEU H 1.800 . 5.000 3.974 3.584 4.222 . 0 0 "[ . 1 . 2]" 1
1613 1 61 LEU H 1 62 ASP QB 1.800 . 7.000 4.538 4.431 4.724 . 0 0 "[ . 1 . 2]" 1
1614 2 61 LEU H 2 62 ASP QB 1.800 . 7.000 4.538 4.430 4.725 . 0 0 "[ . 1 . 2]" 1
1615 1 57 VAL HA 1 61 LEU H 1.800 . 6.000 4.113 3.825 4.372 . 0 0 "[ . 1 . 2]" 1
1616 2 57 VAL HA 2 61 LEU H 1.800 . 6.000 4.113 3.825 4.371 . 0 0 "[ . 1 . 2]" 1
1617 1 57 VAL MG2 1 61 LEU H 1.800 . 7.500 5.245 5.094 5.400 . 0 0 "[ . 1 . 2]" 1
1618 2 57 VAL MG2 2 61 LEU H 1.800 . 7.500 5.245 5.092 5.400 . 0 0 "[ . 1 . 2]" 1
1619 1 57 VAL MG2 1 61 LEU MD1 1.800 . 6.300 3.331 3.068 3.576 . 0 0 "[ . 1 . 2]" 1
1620 2 57 VAL MG2 2 61 LEU MD1 1.800 . 6.300 3.332 3.068 3.577 . 0 0 "[ . 1 . 2]" 1
1621 1 57 VAL MG2 1 61 LEU MD2 1.800 . 8.000 5.451 5.212 5.558 . 0 0 "[ . 1 . 2]" 1
1622 2 57 VAL MG2 2 61 LEU MD2 1.800 . 8.000 5.451 5.211 5.558 . 0 0 "[ . 1 . 2]" 1
1623 1 58 MET HA 1 61 LEU H 1.800 . 5.000 3.479 3.349 3.611 . 0 0 "[ . 1 . 2]" 1
1624 2 58 MET HA 2 61 LEU H 1.800 . 5.000 3.479 3.348 3.608 . 0 0 "[ . 1 . 2]" 1
1625 1 58 MET HA 1 61 LEU MD1 1.800 . 6.500 2.322 1.858 2.620 . 0 0 "[ . 1 . 2]" 1
1626 2 58 MET HA 2 61 LEU MD1 1.800 . 6.500 2.322 1.858 2.619 . 0 0 "[ . 1 . 2]" 1
1627 1 59 GLU HA 1 61 LEU H 1.800 . 5.000 4.081 3.870 4.361 . 0 0 "[ . 1 . 2]" 1
1628 2 59 GLU HA 2 61 LEU H 1.800 . 5.000 4.081 3.868 4.363 . 0 0 "[ . 1 . 2]" 1
1629 1 34 LYS HB3 1 61 LEU MD1 1.800 . 6.500 3.952 3.497 4.344 . 0 0 "[ . 1 . 2]" 1
1630 2 34 LYS HB3 2 61 LEU MD1 1.800 . 6.500 3.952 3.497 4.345 . 0 0 "[ . 1 . 2]" 1
1631 1 34 LYS HB2 1 61 LEU MD1 1.800 . 6.500 3.002 2.359 3.464 . 0 0 "[ . 1 . 2]" 1
1632 2 34 LYS HB2 2 61 LEU MD1 1.800 . 6.500 3.002 2.359 3.463 . 0 0 "[ . 1 . 2]" 1
1633 1 37 ILE MD 1 61 LEU MD1 1.800 . 6.300 2.613 1.726 3.073 0.074 20 0 "[ . 1 . 2]" 1
1634 2 37 ILE MD 2 61 LEU MD1 1.800 . 6.300 2.613 1.727 3.073 0.073 20 0 "[ . 1 . 2]" 1
1635 1 61 LEU H 1 77 PHE HZ 1.800 . 6.000 5.258 4.413 6.009 0.009 5 0 "[ . 1 . 2]" 1
1636 2 61 LEU H 2 77 PHE HZ 1.800 . 6.000 5.257 4.414 6.011 0.011 5 0 "[ . 1 . 2]" 1
1637 1 62 ASP H 1 62 ASP QB 1.800 . 3.900 2.140 2.069 2.257 . 0 0 "[ . 1 . 2]" 1
1638 2 62 ASP H 2 62 ASP QB 1.800 . 3.900 2.139 2.068 2.257 . 0 0 "[ . 1 . 2]" 1
1639 1 61 LEU H 1 62 ASP H 1.800 . 2.900 2.755 2.691 2.896 . 0 0 "[ . 1 . 2]" 1
1640 2 61 LEU H 2 62 ASP H 1.800 . 2.900 2.755 2.691 2.895 . 0 0 "[ . 1 . 2]" 1
1641 1 61 LEU HA 1 62 ASP H 1.800 . 5.000 3.572 3.566 3.578 . 0 0 "[ . 1 . 2]" 1
1642 2 61 LEU HA 2 62 ASP H 1.800 . 5.000 3.572 3.566 3.578 . 0 0 "[ . 1 . 2]" 1
1643 1 61 LEU HB3 1 62 ASP H 1.800 . 2.900 2.911 2.755 2.954 0.054 15 0 "[ . 1 . 2]" 1
1644 2 61 LEU HB3 2 62 ASP H 1.800 . 2.900 2.911 2.755 2.955 0.055 15 0 "[ . 1 . 2]" 1
1645 1 61 LEU HB2 1 62 ASP H 1.800 . 3.500 2.540 2.387 2.610 . 0 0 "[ . 1 . 2]" 1
1646 2 61 LEU HB2 2 62 ASP H 1.800 . 3.500 2.540 2.388 2.607 . 0 0 "[ . 1 . 2]" 1
1647 1 61 LEU HG 1 62 ASP H 1.800 . 5.000 4.626 4.545 4.667 . 0 0 "[ . 1 . 2]" 1
1648 2 61 LEU HG 2 62 ASP H 1.800 . 5.000 4.626 4.545 4.666 . 0 0 "[ . 1 . 2]" 1
1649 1 61 LEU MD1 1 62 ASP H 1.800 . 6.500 4.368 4.231 4.432 . 0 0 "[ . 1 . 2]" 1
1650 2 61 LEU MD1 2 62 ASP H 1.800 . 6.500 4.368 4.230 4.430 . 0 0 "[ . 1 . 2]" 1
1651 1 61 LEU MD2 1 62 ASP H 1.800 . 7.500 4.379 4.302 4.431 . 0 0 "[ . 1 . 2]" 1
1652 2 61 LEU MD2 2 62 ASP H 1.800 . 7.500 4.380 4.302 4.434 . 0 0 "[ . 1 . 2]" 1
1653 1 58 MET HA 1 62 ASP H 1.800 . 5.000 3.847 3.571 4.011 . 0 0 "[ . 1 . 2]" 1
1654 2 58 MET HA 2 62 ASP H 1.800 . 5.000 3.846 3.570 4.009 . 0 0 "[ . 1 . 2]" 1
1655 1 58 MET QG 1 62 ASP H 1.800 . 7.000 3.871 3.542 4.117 . 0 0 "[ . 1 . 2]" 1
1656 2 58 MET QG 2 62 ASP H 1.800 . 7.000 3.870 3.540 4.116 . 0 0 "[ . 1 . 2]" 1
1657 1 59 GLU H 1 62 ASP H 1.800 . 6.000 4.664 4.556 4.741 . 0 0 "[ . 1 . 2]" 1
1658 2 59 GLU H 2 62 ASP H 1.800 . 6.000 4.665 4.554 4.740 . 0 0 "[ . 1 . 2]" 1
1659 1 59 GLU HA 1 62 ASP H 1.800 . 3.500 3.516 3.400 3.588 0.088 13 0 "[ . 1 . 2]" 1
1660 2 59 GLU HA 2 62 ASP H 1.800 . 3.500 3.516 3.403 3.588 0.088 13 0 "[ . 1 . 2]" 1
1661 1 59 GLU HG2 1 62 ASP H 1.800 . 6.000 5.710 5.426 5.971 . 0 0 "[ . 1 . 2]" 1
1662 2 59 GLU HG2 2 62 ASP H 1.800 . 6.000 5.710 5.422 5.968 . 0 0 "[ . 1 . 2]" 1
1663 1 60 THR H 1 62 ASP H 1.800 . 6.000 4.506 4.349 4.622 . 0 0 "[ . 1 . 2]" 1
1664 2 60 THR H 2 62 ASP H 1.800 . 6.000 4.506 4.346 4.623 . 0 0 "[ . 1 . 2]" 1
1665 1 62 ASP H 1 63 GLU QB 1.800 . 5.000 4.216 4.129 4.342 . 0 0 "[ . 1 . 2]" 1
1666 2 62 ASP H 2 63 GLU QB 1.800 . 5.000 4.216 4.126 4.342 . 0 0 "[ . 1 . 2]" 1
1667 1 63 GLU H 1 63 GLU QB 1.800 . 3.900 2.244 2.109 2.315 . 0 0 "[ . 1 . 2]" 1
1668 2 63 GLU H 2 63 GLU QB 1.800 . 3.900 2.244 2.109 2.316 . 0 0 "[ . 1 . 2]" 1
1669 1 63 GLU H 1 63 GLU QG 1.800 . 4.500 3.919 3.643 4.074 . 0 0 "[ . 1 . 2]" 1
1670 2 63 GLU H 2 63 GLU QG 1.800 . 4.500 3.919 3.643 4.076 . 0 0 "[ . 1 . 2]" 1
1671 1 62 ASP H 1 63 GLU H 1.800 . 2.900 2.526 2.482 2.585 . 0 0 "[ . 1 . 2]" 1
1672 2 62 ASP H 2 63 GLU H 1.800 . 2.900 2.526 2.481 2.585 . 0 0 "[ . 1 . 2]" 1
1673 1 62 ASP HA 1 63 GLU H 1.800 . 5.000 3.355 3.286 3.433 . 0 0 "[ . 1 . 2]" 1
1674 2 62 ASP HA 2 63 GLU H 1.800 . 5.000 3.355 3.286 3.433 . 0 0 "[ . 1 . 2]" 1
1675 1 62 ASP QB 1 63 GLU H 1.800 . 4.500 3.289 3.134 3.408 . 0 0 "[ . 1 . 2]" 1
1676 2 62 ASP QB 2 63 GLU H 1.800 . 4.500 3.288 3.134 3.408 . 0 0 "[ . 1 . 2]" 1
1677 1 63 GLU H 1 64 ASP H 1.800 . 2.900 2.616 2.443 2.903 0.003 9 0 "[ . 1 . 2]" 1
1678 2 63 GLU H 2 64 ASP H 1.800 . 2.900 2.616 2.443 2.903 0.003 9 0 "[ . 1 . 2]" 1
1679 1 59 GLU HA 1 63 GLU H 1.800 . 5.000 4.248 3.889 4.497 . 0 0 "[ . 1 . 2]" 1
1680 2 59 GLU HA 2 63 GLU H 1.800 . 5.000 4.249 3.890 4.496 . 0 0 "[ . 1 . 2]" 1
1681 1 60 THR HA 1 63 GLU H 1.800 . 3.500 3.321 3.187 3.517 0.017 13 0 "[ . 1 . 2]" 1
1682 2 60 THR HA 2 63 GLU H 1.800 . 3.500 3.321 3.185 3.518 0.018 13 0 "[ . 1 . 2]" 1
1683 1 60 THR MG 1 63 GLU H 1.800 . 7.500 4.484 4.243 4.697 . 0 0 "[ . 1 . 2]" 1
1684 2 60 THR MG 2 63 GLU H 1.800 . 7.500 4.484 4.242 4.698 . 0 0 "[ . 1 . 2]" 1
1685 1 61 LEU H 1 63 GLU H 1.800 . 5.000 3.573 3.412 3.663 . 0 0 "[ . 1 . 2]" 1
1686 2 61 LEU H 2 63 GLU H 1.800 . 5.000 3.573 3.407 3.663 . 0 0 "[ . 1 . 2]" 1
1687 1 61 LEU HA 1 63 GLU H 1.800 . 6.000 3.936 3.844 4.090 . 0 0 "[ . 1 . 2]" 1
1688 2 61 LEU HA 2 63 GLU H 1.800 . 6.000 3.935 3.843 4.087 . 0 0 "[ . 1 . 2]" 1
1689 1 64 ASP H 1 64 ASP QB 1.800 . 3.900 2.498 2.110 3.027 . 0 0 "[ . 1 . 2]" 1
1690 2 64 ASP H 2 64 ASP QB 1.800 . 3.900 2.498 2.111 3.026 . 0 0 "[ . 1 . 2]" 1
1691 1 63 GLU HA 1 64 ASP H 1.800 . 3.500 3.551 3.507 3.574 0.074 2 0 "[ . 1 . 2]" 1
1692 2 63 GLU HA 2 64 ASP H 1.800 . 3.500 3.551 3.503 3.573 0.073 17 0 "[ . 1 . 2]" 1
1693 1 63 GLU QB 1 64 ASP H 1.800 . 4.500 2.453 1.934 2.812 . 0 0 "[ . 1 . 2]" 1
1694 2 63 GLU QB 2 64 ASP H 1.800 . 4.500 2.454 1.936 2.813 . 0 0 "[ . 1 . 2]" 1
1695 1 63 GLU QG 1 64 ASP H 1.800 . 6.000 3.720 2.653 4.331 . 0 0 "[ . 1 . 2]" 1
1696 2 63 GLU QG 2 64 ASP H 1.800 . 6.000 3.720 2.651 4.334 . 0 0 "[ . 1 . 2]" 1
1697 1 61 LEU HA 1 64 ASP H 1.800 . 5.000 4.249 3.861 4.581 . 0 0 "[ . 1 . 2]" 1
1698 2 61 LEU HA 2 64 ASP H 1.800 . 5.000 4.249 3.860 4.583 . 0 0 "[ . 1 . 2]" 1
1699 1 61 LEU MD2 1 64 ASP H 1.800 . 7.500 5.379 4.993 5.781 . 0 0 "[ . 1 . 2]" 1
1700 2 61 LEU MD2 2 64 ASP H 1.800 . 7.500 5.378 4.992 5.783 . 0 0 "[ . 1 . 2]" 1
1701 1 64 ASP H 1 65 GLY H 1.800 . 3.500 2.548 2.032 2.890 . 0 0 "[ . 1 . 2]" 1
1702 2 64 ASP H 2 65 GLY H 1.800 . 3.500 2.548 2.032 2.887 . 0 0 "[ . 1 . 2]" 1
1703 1 64 ASP HA 1 65 GLY H 1.800 . 3.500 3.348 2.573 3.576 0.076 1 0 "[ . 1 . 2]" 1
1704 2 64 ASP HA 2 65 GLY H 1.800 . 3.500 3.348 2.574 3.575 0.075 1 0 "[ . 1 . 2]" 1
1705 1 64 ASP QB 1 65 GLY H 1.800 . 6.000 2.710 2.102 4.062 . 0 0 "[ . 1 . 2]" 1
1706 2 64 ASP QB 2 65 GLY H 1.800 . 6.000 2.710 2.101 4.062 . 0 0 "[ . 1 . 2]" 1
1707 1 62 ASP HA 1 65 GLY H 1.800 . 6.000 4.392 3.581 4.824 . 0 0 "[ . 1 . 2]" 1
1708 2 62 ASP HA 2 65 GLY H 1.800 . 6.000 4.392 3.582 4.823 . 0 0 "[ . 1 . 2]" 1
1709 1 63 GLU H 1 65 GLY H 1.800 . 5.000 4.322 4.000 4.660 . 0 0 "[ . 1 . 2]" 1
1710 2 63 GLU H 2 65 GLY H 1.800 . 5.000 4.322 4.003 4.657 . 0 0 "[ . 1 . 2]" 1
1711 1 63 GLU HA 1 65 GLY H 1.800 . 6.000 5.463 4.624 5.801 . 0 0 "[ . 1 . 2]" 1
1712 2 63 GLU HA 2 65 GLY H 1.800 . 6.000 5.464 4.625 5.800 . 0 0 "[ . 1 . 2]" 1
1713 1 63 GLU QB 1 65 GLY H 1.800 . 7.000 4.667 4.163 5.133 . 0 0 "[ . 1 . 2]" 1
1714 2 63 GLU QB 2 65 GLY H 1.800 . 7.000 4.668 4.165 5.136 . 0 0 "[ . 1 . 2]" 1
1715 1 30 LYS QB 1 65 GLY H 1.800 . 7.000 3.157 2.002 4.265 . 0 0 "[ . 1 . 2]" 1
1716 2 30 LYS QB 2 65 GLY H 1.800 . 7.000 3.157 2.003 4.267 . 0 0 "[ . 1 . 2]" 1
1717 1 66 ASP H 1 66 ASP HB3 1.800 . 2.900 2.808 2.517 3.009 0.109 12 0 "[ . 1 . 2]" 1
1718 2 66 ASP H 2 66 ASP HB3 1.800 . 2.900 2.808 2.516 3.007 0.107 12 0 "[ . 1 . 2]" 1
1719 1 66 ASP H 1 66 ASP HB2 1.800 . 2.900 2.805 2.503 2.975 0.075 12 0 "[ . 1 . 2]" 1
1720 2 66 ASP H 2 66 ASP HB2 1.800 . 2.900 2.805 2.502 2.973 0.073 1 0 "[ . 1 . 2]" 1
1721 1 65 GLY H 1 66 ASP H 1.800 . 3.500 2.994 2.651 3.472 . 0 0 "[ . 1 . 2]" 1
1722 2 65 GLY H 2 66 ASP H 1.800 . 3.500 2.994 2.650 3.472 . 0 0 "[ . 1 . 2]" 1
1723 1 65 GLY QA 1 66 ASP H 1.800 . 4.500 2.789 2.607 2.939 . 0 0 "[ . 1 . 2]" 1
1724 2 65 GLY QA 2 66 ASP H 1.800 . 4.500 2.789 2.608 2.940 . 0 0 "[ . 1 . 2]" 1
1725 1 64 ASP H 1 66 ASP H 1.800 . 6.000 4.871 4.302 5.379 . 0 0 "[ . 1 . 2]" 1
1726 2 64 ASP H 2 66 ASP H 1.800 . 6.000 4.872 4.302 5.383 . 0 0 "[ . 1 . 2]" 1
1727 1 64 ASP HA 1 66 ASP H 1.800 . 5.000 3.663 3.011 4.035 . 0 0 "[ . 1 . 2]" 1
1728 2 64 ASP HA 2 66 ASP H 1.800 . 5.000 3.664 3.013 4.035 . 0 0 "[ . 1 . 2]" 1
1729 1 67 GLY H 1 67 GLY HA3 1.800 . 2.900 2.483 2.375 2.670 . 0 0 "[ . 1 . 2]" 1
1730 2 67 GLY H 2 67 GLY HA3 1.800 . 2.900 2.483 2.375 2.670 . 0 0 "[ . 1 . 2]" 1
1731 1 67 GLY H 1 67 GLY HA2 1.800 . 2.900 2.964 2.933 2.982 0.082 5 0 "[ . 1 . 2]" 1
1732 2 67 GLY H 2 67 GLY HA2 1.800 . 2.900 2.964 2.934 2.984 0.084 8 0 "[ . 1 . 2]" 1
1733 1 66 ASP HA 1 67 GLY H 1.800 . 5.000 2.875 2.318 3.532 . 0 0 "[ . 1 . 2]" 1
1734 2 66 ASP HA 2 67 GLY H 1.800 . 5.000 2.876 2.318 3.534 . 0 0 "[ . 1 . 2]" 1
1735 1 66 ASP HB3 1 67 GLY H 1.800 . 5.000 4.020 2.849 4.408 . 0 0 "[ . 1 . 2]" 1
1736 2 66 ASP HB3 2 67 GLY H 1.800 . 5.000 4.020 2.849 4.410 . 0 0 "[ . 1 . 2]" 1
1737 1 66 ASP HB2 1 67 GLY H 1.800 . 5.000 4.502 3.766 4.690 . 0 0 "[ . 1 . 2]" 1
1738 2 66 ASP HB2 2 67 GLY H 1.800 . 5.000 4.502 3.766 4.689 . 0 0 "[ . 1 . 2]" 1
1739 1 65 GLY H 1 67 GLY H 1.800 . 5.000 4.162 3.236 4.973 . 0 0 "[ . 1 . 2]" 1
1740 2 65 GLY H 2 67 GLY H 1.800 . 5.000 4.162 3.235 4.974 . 0 0 "[ . 1 . 2]" 1
1741 1 30 LYS QB 1 67 GLY H 1.800 . 6.000 3.260 2.199 4.490 . 0 0 "[ . 1 . 2]" 1
1742 2 30 LYS QB 2 67 GLY H 1.800 . 6.000 3.260 2.199 4.489 . 0 0 "[ . 1 . 2]" 1
1743 1 30 LYS QG 1 67 GLY H 1.800 . 7.000 2.618 1.783 5.482 0.017 2 0 "[ . 1 . 2]" 1
1744 2 30 LYS QG 2 67 GLY H 1.800 . 7.000 2.617 1.782 5.482 0.018 2 0 "[ . 1 . 2]" 1
1745 1 68 GLU H 1 68 GLU QB 1.800 . 3.900 2.654 2.277 3.117 . 0 0 "[ . 1 . 2]" 1
1746 2 68 GLU H 2 68 GLU QB 1.800 . 3.900 2.654 2.277 3.120 . 0 0 "[ . 1 . 2]" 1
1747 1 68 GLU H 1 68 GLU HG3 1.800 . 3.500 2.759 1.874 3.454 . 0 0 "[ . 1 . 2]" 1
1748 2 68 GLU H 2 68 GLU HG3 1.800 . 3.500 2.759 1.878 3.456 . 0 0 "[ . 1 . 2]" 1
1749 1 67 GLY H 1 68 GLU H 1.800 . 5.000 4.487 4.294 4.626 . 0 0 "[ . 1 . 2]" 1
1750 2 67 GLY H 2 68 GLU H 1.800 . 5.000 4.487 4.295 4.626 . 0 0 "[ . 1 . 2]" 1
1751 1 67 GLY HA3 1 68 GLU H 1.800 . 2.900 2.650 2.406 2.878 . 0 0 "[ . 1 . 2]" 1
1752 2 67 GLY HA3 2 68 GLU H 1.800 . 2.900 2.650 2.406 2.880 . 0 0 "[ . 1 . 2]" 1
1753 1 67 GLY HA2 1 68 GLU H 1.800 . 2.900 2.575 2.371 2.842 . 0 0 "[ . 1 . 2]" 1
1754 2 67 GLY HA2 2 68 GLU H 1.800 . 2.900 2.575 2.371 2.841 . 0 0 "[ . 1 . 2]" 1
1755 1 68 GLU H 1 69 CYS H 1.800 . 6.000 4.503 4.367 4.639 . 0 0 "[ . 1 . 2]" 1
1756 2 68 GLU H 2 69 CYS H 1.800 . 6.000 4.503 4.367 4.640 . 0 0 "[ . 1 . 2]" 1
1757 1 68 GLU H 1 69 CYS HA 1.800 . 6.000 5.012 4.821 5.449 . 0 0 "[ . 1 . 2]" 1
1758 2 68 GLU H 2 69 CYS HA 1.800 . 6.000 5.012 4.822 5.449 . 0 0 "[ . 1 . 2]" 1
1759 1 29 LYS HA 1 68 GLU H 1.800 . 6.000 4.684 4.285 5.102 . 0 0 "[ . 1 . 2]" 1
1760 2 29 LYS HA 2 68 GLU H 1.800 . 6.000 4.683 4.284 5.097 . 0 0 "[ . 1 . 2]" 1
1761 1 30 LYS QE 1 68 GLU H 1.800 . 7.000 4.580 3.103 6.368 . 0 0 "[ . 1 . 2]" 1
1762 2 30 LYS QE 2 68 GLU H 1.800 . 7.000 4.579 3.103 6.368 . 0 0 "[ . 1 . 2]" 1
1763 1 69 CYS H 1 69 CYS HB2 1.800 . 2.900 2.542 2.251 2.955 0.055 11 0 "[ . 1 . 2]" 1
1764 2 69 CYS H 2 69 CYS HB2 1.800 . 2.900 2.542 2.248 2.955 0.055 11 0 "[ . 1 . 2]" 1
1765 1 68 GLU HA 1 69 CYS H 1.800 . 2.900 2.267 2.189 2.467 . 0 0 "[ . 1 . 2]" 1
1766 2 68 GLU HA 2 69 CYS H 1.800 . 2.900 2.267 2.189 2.468 . 0 0 "[ . 1 . 2]" 1
1767 1 68 GLU QB 1 69 CYS H 1.800 . 4.500 2.962 2.356 3.309 . 0 0 "[ . 1 . 2]" 1
1768 2 68 GLU QB 2 69 CYS H 1.800 . 4.500 2.962 2.355 3.308 . 0 0 "[ . 1 . 2]" 1
1769 1 68 GLU HG3 1 69 CYS H 1.800 . 5.000 4.504 3.732 5.001 0.001 8 0 "[ . 1 . 2]" 1
1770 2 68 GLU HG3 2 69 CYS H 1.800 . 5.000 4.504 3.730 5.003 0.003 8 0 "[ . 1 . 2]" 1
1771 1 68 GLU HG2 1 69 CYS H 1.800 . 6.000 4.624 3.910 5.511 . 0 0 "[ . 1 . 2]" 1
1772 2 68 GLU HG2 2 69 CYS H 1.800 . 6.000 4.624 3.909 5.514 . 0 0 "[ . 1 . 2]" 1
1773 1 27 LYS HA 1 69 CYS H 1.800 . 5.000 4.921 4.448 5.043 0.043 11 0 "[ . 1 . 2]" 1
1774 2 27 LYS HA 2 69 CYS H 1.800 . 5.000 4.920 4.450 5.040 0.040 11 0 "[ . 1 . 2]" 1
1775 1 27 LYS QB 1 69 CYS H 1.800 . 7.000 4.148 3.609 4.656 . 0 0 "[ . 1 . 2]" 1
1776 2 27 LYS QB 2 69 CYS H 1.800 . 7.000 4.148 3.608 4.657 . 0 0 "[ . 1 . 2]" 1
1777 1 28 LEU HB3 1 69 CYS H 1.800 . 5.000 3.769 2.962 4.769 . 0 0 "[ . 1 . 2]" 1
1778 2 28 LEU HB3 2 69 CYS H 1.800 . 5.000 3.769 2.961 4.771 . 0 0 "[ . 1 . 2]" 1
1779 1 28 LEU HB2 1 69 CYS H 1.800 . 6.000 4.352 3.445 5.221 . 0 0 "[ . 1 . 2]" 1
1780 2 28 LEU HB2 2 69 CYS H 1.800 . 6.000 4.351 3.445 5.223 . 0 0 "[ . 1 . 2]" 1
1781 1 28 LEU QD 1 69 CYS H 1.800 . 9.400 4.666 4.249 5.461 . 0 0 "[ . 1 . 2]" 1
1782 2 28 LEU QD 2 69 CYS H 1.800 . 9.400 4.666 4.247 5.463 . 0 0 "[ . 1 . 2]" 1
1783 1 29 LYS H 1 69 CYS H 1.800 . 6.000 3.951 3.515 4.445 . 0 0 "[ . 1 . 2]" 1
1784 2 29 LYS H 2 69 CYS H 1.800 . 6.000 3.950 3.515 4.446 . 0 0 "[ . 1 . 2]" 1
1785 1 29 LYS HA 1 69 CYS H 1.800 . 5.000 2.580 2.280 3.004 . 0 0 "[ . 1 . 2]" 1
1786 2 29 LYS HA 2 69 CYS H 1.800 . 5.000 2.580 2.280 3.002 . 0 0 "[ . 1 . 2]" 1
1787 1 29 LYS HB3 1 69 CYS H 1.800 . 6.000 5.278 4.732 5.688 . 0 0 "[ . 1 . 2]" 1
1788 2 29 LYS HB3 2 69 CYS H 1.800 . 6.000 5.278 4.733 5.685 . 0 0 "[ . 1 . 2]" 1
1789 1 29 LYS HB2 1 69 CYS H 1.800 . 5.000 4.993 4.751 5.127 0.127 11 0 "[ . 1 . 2]" 1
1790 2 29 LYS HB2 2 69 CYS H 1.800 . 5.000 4.993 4.752 5.126 0.126 11 0 "[ . 1 . 2]" 1
1791 1 30 LYS H 1 69 CYS H 1.800 . 6.000 4.463 3.451 5.317 . 0 0 "[ . 1 . 2]" 1
1792 2 30 LYS H 2 69 CYS H 1.800 . 6.000 4.463 3.451 5.317 . 0 0 "[ . 1 . 2]" 1
1793 1 70 ASP H 1 70 ASP HB2 1.800 . 3.500 2.562 2.294 2.959 . 0 0 "[ . 1 . 2]" 1
1794 2 70 ASP H 2 70 ASP HB2 1.800 . 3.500 2.562 2.295 2.959 . 0 0 "[ . 1 . 2]" 1
1795 1 69 CYS H 1 70 ASP H 1.800 . 6.000 4.524 4.386 4.598 . 0 0 "[ . 1 . 2]" 1
1796 2 69 CYS H 2 70 ASP H 1.800 . 6.000 4.525 4.386 4.599 . 0 0 "[ . 1 . 2]" 1
1797 1 69 CYS HA 1 70 ASP H 1.800 . 2.900 2.495 2.333 2.715 . 0 0 "[ . 1 . 2]" 1
1798 2 69 CYS HA 2 70 ASP H 1.800 . 2.900 2.495 2.333 2.713 . 0 0 "[ . 1 . 2]" 1
1799 1 69 CYS HB3 1 70 ASP H 1.800 . 3.500 2.502 2.134 2.937 . 0 0 "[ . 1 . 2]" 1
1800 2 69 CYS HB3 2 70 ASP H 1.800 . 3.500 2.502 2.135 2.937 . 0 0 "[ . 1 . 2]" 1
1801 1 70 ASP H 1 72 GLN H 1.800 . 6.000 5.097 4.441 5.410 . 0 0 "[ . 1 . 2]" 1
1802 2 70 ASP H 2 72 GLN H 1.800 . 6.000 5.097 4.440 5.407 . 0 0 "[ . 1 . 2]" 1
1803 1 70 ASP H 1 73 GLU H 1.800 . 5.000 3.594 3.289 3.823 . 0 0 "[ . 1 . 2]" 1
1804 2 70 ASP H 2 73 GLU H 1.800 . 5.000 3.593 3.292 3.822 . 0 0 "[ . 1 . 2]" 1
1805 1 70 ASP H 1 73 GLU HA 1.800 . 6.000 4.938 4.803 5.390 . 0 0 "[ . 1 . 2]" 1
1806 2 70 ASP H 2 73 GLU HA 1.800 . 6.000 4.938 4.802 5.390 . 0 0 "[ . 1 . 2]" 1
1807 1 70 ASP H 1 73 GLU HB3 1.800 . 2.900 2.937 2.909 2.991 0.091 13 0 "[ . 1 . 2]" 1
1808 2 70 ASP H 2 73 GLU HB3 1.800 . 2.900 2.937 2.909 2.988 0.088 13 0 "[ . 1 . 2]" 1
1809 1 70 ASP H 1 73 GLU HB2 1.800 . 5.000 2.248 1.859 4.124 . 0 0 "[ . 1 . 2]" 1
1810 2 70 ASP H 2 73 GLU HB2 1.800 . 5.000 2.248 1.859 4.122 . 0 0 "[ . 1 . 2]" 1
1811 1 70 ASP H 1 73 GLU HG3 1.800 . 5.000 3.284 2.747 3.893 . 0 0 "[ . 1 . 2]" 1
1812 2 70 ASP H 2 73 GLU HG3 1.800 . 5.000 3.284 2.747 3.895 . 0 0 "[ . 1 . 2]" 1
1813 1 70 ASP H 1 73 GLU HG2 1.800 . 5.000 4.099 1.869 4.869 . 0 0 "[ . 1 . 2]" 1
1814 2 70 ASP H 2 73 GLU HG2 1.800 . 5.000 4.099 1.868 4.873 . 0 0 "[ . 1 . 2]" 1
1815 1 27 LYS QB 1 70 ASP H 1.800 . 7.000 5.953 5.501 6.283 . 0 0 "[ . 1 . 2]" 1
1816 2 27 LYS QB 2 70 ASP H 1.800 . 7.000 5.954 5.498 6.284 . 0 0 "[ . 1 . 2]" 1
1817 1 71 PHE H 1 71 PHE QD 1.800 . 7.400 2.589 1.846 4.195 . 0 0 "[ . 1 . 2]" 1
1818 2 71 PHE H 2 71 PHE QD 1.800 . 7.400 2.589 1.846 4.195 . 0 0 "[ . 1 . 2]" 1
1819 1 70 ASP H 1 71 PHE H 1.800 . 6.000 4.459 4.207 4.593 . 0 0 "[ . 1 . 2]" 1
1820 2 70 ASP H 2 71 PHE H 1.800 . 6.000 4.459 4.206 4.592 . 0 0 "[ . 1 . 2]" 1
1821 1 70 ASP HA 1 71 PHE H 1.800 . 3.500 2.651 2.335 2.937 . 0 0 "[ . 1 . 2]" 1
1822 2 70 ASP HA 2 71 PHE H 1.800 . 3.500 2.650 2.334 2.938 . 0 0 "[ . 1 . 2]" 1
1823 1 70 ASP HB3 1 71 PHE H 1.800 . 3.500 2.174 1.844 2.822 . 0 0 "[ . 1 . 2]" 1
1824 2 70 ASP HB3 2 71 PHE H 1.800 . 3.500 2.174 1.845 2.820 . 0 0 "[ . 1 . 2]" 1
1825 1 70 ASP HB2 1 71 PHE H 1.800 . 3.500 3.237 2.417 3.569 0.069 1 0 "[ . 1 . 2]" 1
1826 2 70 ASP HB2 2 71 PHE H 1.800 . 3.500 3.238 2.417 3.570 0.070 1 0 "[ . 1 . 2]" 1
1827 1 71 PHE HA 1 74 PHE HB3 1.800 . 5.000 3.269 2.894 3.460 . 0 0 "[ . 1 . 2]" 1
1828 2 71 PHE HA 2 74 PHE HB3 1.800 . 5.000 3.269 2.894 3.461 . 0 0 "[ . 1 . 2]" 1
1829 1 71 PHE HA 1 74 PHE HB2 1.800 . 5.000 4.919 4.489 5.064 0.064 19 0 "[ . 1 . 2]" 1
1830 2 71 PHE HA 2 74 PHE HB2 1.800 . 5.000 4.920 4.490 5.065 0.065 19 0 "[ . 1 . 2]" 1
1831 1 15 PHE HZ 1 71 PHE H 1.800 . 6.000 3.963 2.700 4.790 . 0 0 "[ . 1 . 2]" 1
1832 2 15 PHE HZ 2 71 PHE H 1.800 . 6.000 3.963 2.700 4.787 . 0 0 "[ . 1 . 2]" 1
1833 1 72 GLN H 1 72 GLN QB 1.800 . 3.900 2.389 2.114 3.046 . 0 0 "[ . 1 . 2]" 1
1834 2 72 GLN H 2 72 GLN QB 1.800 . 3.900 2.389 2.114 3.047 . 0 0 "[ . 1 . 2]" 1
1835 1 72 GLN H 1 72 GLN HG3 1.800 . 3.500 2.786 2.009 3.525 0.025 13 0 "[ . 1 . 2]" 1
1836 2 72 GLN H 2 72 GLN HG3 1.800 . 3.500 2.786 2.008 3.523 0.023 13 0 "[ . 1 . 2]" 1
1837 1 72 GLN H 1 72 GLN HG2 1.800 . 3.500 3.111 1.838 3.561 0.061 15 0 "[ . 1 . 2]" 1
1838 2 72 GLN H 2 72 GLN HG2 1.800 . 3.500 3.111 1.836 3.561 0.061 15 0 "[ . 1 . 2]" 1
1839 1 71 PHE H 1 72 GLN H 1.800 . 3.500 2.479 2.251 2.854 . 0 0 "[ . 1 . 2]" 1
1840 2 71 PHE H 2 72 GLN H 1.800 . 3.500 2.479 2.252 2.854 . 0 0 "[ . 1 . 2]" 1
1841 1 71 PHE HA 1 72 GLN H 1.800 . 5.000 3.540 3.485 3.584 . 0 0 "[ . 1 . 2]" 1
1842 2 71 PHE HA 2 72 GLN H 1.800 . 5.000 3.540 3.484 3.586 . 0 0 "[ . 1 . 2]" 1
1843 1 71 PHE QB 1 72 GLN H 1.800 . 3.900 3.166 2.373 3.601 . 0 0 "[ . 1 . 2]" 1
1844 2 71 PHE QB 2 72 GLN H 1.800 . 3.900 3.167 2.373 3.602 . 0 0 "[ . 1 . 2]" 1
1845 1 71 PHE QD 1 72 GLN H 1.800 . 7.400 2.931 1.886 4.242 . 0 0 "[ . 1 . 2]" 1
1846 2 71 PHE QD 2 72 GLN H 1.800 . 7.400 2.931 1.887 4.242 . 0 0 "[ . 1 . 2]" 1
1847 1 70 ASP HA 1 72 GLN H 1.800 . 6.000 4.599 4.035 5.178 . 0 0 "[ . 1 . 2]" 1
1848 2 70 ASP HA 2 72 GLN H 1.800 . 6.000 4.599 4.035 5.180 . 0 0 "[ . 1 . 2]" 1
1849 1 72 GLN HA 1 75 MET HB3 1.800 . 3.300 3.315 3.113 3.399 0.099 2 0 "[ . 1 . 2]" 1
1850 2 72 GLN HA 2 75 MET HB3 1.800 . 3.300 3.315 3.111 3.396 0.096 2 0 "[ . 1 . 2]" 1
1851 1 72 GLN HA 1 75 MET HB2 1.800 . 5.000 2.272 2.039 2.571 . 0 0 "[ . 1 . 2]" 1
1852 2 72 GLN HA 2 75 MET HB2 1.800 . 5.000 2.272 2.039 2.572 . 0 0 "[ . 1 . 2]" 1
1853 1 83 THR MG 2 72 GLN H 1.800 . 6.500 4.034 2.715 4.853 . 0 0 "[ . 1 . 2]" 1
1854 1 72 GLN H 2 83 THR MG 1.800 . 6.500 4.041 2.780 4.913 . 0 0 "[ . 1 . 2]" 1
1855 1 89 PHE QE 2 72 GLN H 1.800 . 8.400 6.610 4.784 7.625 . 0 0 "[ . 1 . 2]" 1
1856 1 72 GLN H 2 89 PHE QE 1.800 . 8.400 6.614 4.775 7.621 . 0 0 "[ . 1 . 2]" 1
1857 1 73 GLU H 1 73 GLU HB3 1.800 . 3.500 3.306 2.276 3.519 0.019 17 0 "[ . 1 . 2]" 1
1858 2 73 GLU H 2 73 GLU HB3 1.800 . 3.500 3.306 2.275 3.520 0.020 17 0 "[ . 1 . 2]" 1
1859 1 73 GLU H 1 73 GLU HB2 1.800 . 3.500 2.376 2.081 3.569 0.069 2 0 "[ . 1 . 2]" 1
1860 2 73 GLU H 2 73 GLU HB2 1.800 . 3.500 2.376 2.082 3.568 0.068 2 0 "[ . 1 . 2]" 1
1861 1 73 GLU H 1 73 GLU HG3 1.800 . 3.500 3.413 2.751 3.621 0.121 7 0 "[ . 1 . 2]" 1
1862 2 73 GLU H 2 73 GLU HG3 1.800 . 3.500 3.413 2.752 3.620 0.120 7 0 "[ . 1 . 2]" 1
1863 1 73 GLU H 1 73 GLU HG2 1.800 . 3.500 3.388 2.708 3.606 0.106 2 0 "[ . 1 . 2]" 1
1864 2 73 GLU H 2 73 GLU HG2 1.800 . 3.500 3.388 2.705 3.603 0.103 2 0 "[ . 1 . 2]" 1
1865 1 72 GLN H 1 73 GLU H 1.800 . 2.900 2.461 2.307 2.642 . 0 0 "[ . 1 . 2]" 1
1866 2 72 GLN H 2 73 GLU H 1.800 . 2.900 2.461 2.308 2.643 . 0 0 "[ . 1 . 2]" 1
1867 1 72 GLN HA 1 73 GLU H 1.800 . 5.000 3.483 3.388 3.575 . 0 0 "[ . 1 . 2]" 1
1868 2 72 GLN HA 2 73 GLU H 1.800 . 5.000 3.482 3.388 3.576 . 0 0 "[ . 1 . 2]" 1
1869 1 72 GLN QB 1 73 GLU H 1.800 . 3.900 3.135 2.462 3.622 . 0 0 "[ . 1 . 2]" 1
1870 2 72 GLN QB 2 73 GLU H 1.800 . 3.900 3.135 2.460 3.623 . 0 0 "[ . 1 . 2]" 1
1871 1 73 GLU H 1 74 PHE HB3 1.800 . 6.000 4.457 4.334 4.748 . 0 0 "[ . 1 . 2]" 1
1872 2 73 GLU H 2 74 PHE HB3 1.800 . 6.000 4.457 4.335 4.751 . 0 0 "[ . 1 . 2]" 1
1873 1 69 CYS HA 1 73 GLU H 1.800 . 6.000 5.996 5.624 6.050 0.050 12 0 "[ . 1 . 2]" 1
1874 2 69 CYS HA 2 73 GLU H 1.800 . 6.000 5.995 5.625 6.047 0.047 12 0 "[ . 1 . 2]" 1
1875 1 70 ASP HB2 1 73 GLU H 1.800 . 6.000 2.586 2.250 3.654 . 0 0 "[ . 1 . 2]" 1
1876 2 70 ASP HB2 2 73 GLU H 1.800 . 6.000 2.586 2.247 3.653 . 0 0 "[ . 1 . 2]" 1
1877 1 71 PHE HA 1 73 GLU H 1.800 . 6.000 4.140 3.861 4.886 . 0 0 "[ . 1 . 2]" 1
1878 2 71 PHE HA 2 73 GLU H 1.800 . 6.000 4.141 3.859 4.888 . 0 0 "[ . 1 . 2]" 1
1879 1 74 PHE H 1 74 PHE HB3 1.800 . 2.900 2.139 2.066 2.315 . 0 0 "[ . 1 . 2]" 1
1880 2 74 PHE H 2 74 PHE HB3 1.800 . 2.900 2.139 2.067 2.315 . 0 0 "[ . 1 . 2]" 1
1881 1 74 PHE H 1 74 PHE HB2 1.800 . 3.500 3.121 2.814 3.429 . 0 0 "[ . 1 . 2]" 1
1882 2 74 PHE H 2 74 PHE HB2 1.800 . 3.500 3.121 2.813 3.431 . 0 0 "[ . 1 . 2]" 1
1883 1 74 PHE H 1 74 PHE QD 1.800 . 5.900 3.588 2.990 4.118 . 0 0 "[ . 1 . 2]" 1
1884 2 74 PHE H 2 74 PHE QD 1.800 . 5.900 3.587 2.990 4.119 . 0 0 "[ . 1 . 2]" 1
1885 1 73 GLU H 1 74 PHE H 1.800 . 2.900 2.648 2.416 2.936 0.036 15 0 "[ . 1 . 2]" 1
1886 2 73 GLU H 2 74 PHE H 1.800 . 2.900 2.648 2.416 2.938 0.038 15 0 "[ . 1 . 2]" 1
1887 1 73 GLU HA 1 74 PHE H 1.800 . 5.000 3.577 3.526 3.589 . 0 0 "[ . 1 . 2]" 1
1888 2 73 GLU HA 2 74 PHE H 1.800 . 5.000 3.577 3.529 3.588 . 0 0 "[ . 1 . 2]" 1
1889 1 73 GLU HB3 1 74 PHE H 1.800 . 3.500 2.991 2.587 3.592 0.092 2 0 "[ . 1 . 2]" 1
1890 2 73 GLU HB3 2 74 PHE H 1.800 . 3.500 2.991 2.587 3.592 0.092 2 0 "[ . 1 . 2]" 1
1891 1 73 GLU HB2 1 74 PHE H 1.800 . 5.000 2.785 2.385 4.056 . 0 0 "[ . 1 . 2]" 1
1892 2 73 GLU HB2 2 74 PHE H 1.800 . 5.000 2.785 2.384 4.056 . 0 0 "[ . 1 . 2]" 1
1893 1 73 GLU HG3 1 74 PHE H 1.800 . 6.000 4.342 1.843 4.853 . 0 0 "[ . 1 . 2]" 1
1894 2 73 GLU HG3 2 74 PHE H 1.800 . 6.000 4.342 1.843 4.853 . 0 0 "[ . 1 . 2]" 1
1895 1 69 CYS HB2 1 74 PHE H 1.800 . 5.000 4.700 3.992 5.027 0.027 7 0 "[ . 1 . 2]" 1
1896 2 69 CYS HB2 2 74 PHE H 1.800 . 5.000 4.700 3.992 5.029 0.029 7 0 "[ . 1 . 2]" 1
1897 1 71 PHE HA 1 74 PHE H 1.800 . 5.000 3.769 3.517 4.097 . 0 0 "[ . 1 . 2]" 1
1898 2 71 PHE HA 2 74 PHE H 1.800 . 5.000 3.770 3.518 4.097 . 0 0 "[ . 1 . 2]" 1
1899 1 72 GLN H 1 74 PHE H 1.800 . 5.000 4.435 4.145 4.875 . 0 0 "[ . 1 . 2]" 1
1900 2 72 GLN H 2 74 PHE H 1.800 . 5.000 4.434 4.143 4.874 . 0 0 "[ . 1 . 2]" 1
1901 1 72 GLN HA 1 74 PHE H 1.800 . 6.000 4.861 4.425 5.197 . 0 0 "[ . 1 . 2]" 1
1902 2 72 GLN HA 2 74 PHE H 1.800 . 6.000 4.861 4.424 5.196 . 0 0 "[ . 1 . 2]" 1
1903 1 72 GLN QB 1 74 PHE H 1.800 . 7.000 5.273 4.834 5.842 . 0 0 "[ . 1 . 2]" 1
1904 2 72 GLN QB 2 74 PHE H 1.800 . 7.000 5.273 4.834 5.842 . 0 0 "[ . 1 . 2]" 1
1905 1 74 PHE HA 1 77 PHE HB3 1.800 . 3.300 3.308 3.222 3.350 0.050 2 0 "[ . 1 . 2]" 1
1906 2 74 PHE HA 2 77 PHE HB3 1.800 . 3.300 3.308 3.222 3.351 0.051 2 0 "[ . 1 . 2]" 1
1907 1 74 PHE HA 1 77 PHE HB2 1.800 . 5.000 2.209 2.025 2.431 . 0 0 "[ . 1 . 2]" 1
1908 2 74 PHE HA 2 77 PHE HB2 1.800 . 5.000 2.209 2.026 2.431 . 0 0 "[ . 1 . 2]" 1
1909 1 15 PHE QE 1 74 PHE H 1.800 . 7.400 4.356 3.600 5.232 . 0 0 "[ . 1 . 2]" 1
1910 2 15 PHE QE 2 74 PHE H 1.800 . 7.400 4.357 3.598 5.234 . 0 0 "[ . 1 . 2]" 1
1911 1 15 PHE HZ 1 74 PHE H 1.800 . 6.000 5.417 4.186 6.007 0.007 7 0 "[ . 1 . 2]" 1
1912 2 15 PHE HZ 2 74 PHE H 1.800 . 6.000 5.418 4.185 6.011 0.011 7 0 "[ . 1 . 2]" 1
1913 1 28 LEU QD 1 74 PHE H 1.800 . 9.400 5.154 4.640 5.880 . 0 0 "[ . 1 . 2]" 1
1914 2 28 LEU QD 2 74 PHE H 1.800 . 9.400 5.155 4.642 5.880 . 0 0 "[ . 1 . 2]" 1
1915 1 28 LEU HB3 1 74 PHE H 1.800 . 6.000 5.684 5.104 6.011 0.011 3 0 "[ . 1 . 2]" 1
1916 2 28 LEU HB3 2 74 PHE H 1.800 . 6.000 5.685 5.104 6.015 0.015 3 0 "[ . 1 . 2]" 1
1917 1 28 LEU HB2 1 74 PHE H 1.800 . 6.000 5.206 4.505 5.861 . 0 0 "[ . 1 . 2]" 1
1918 2 28 LEU HB2 2 74 PHE H 1.800 . 6.000 5.206 4.506 5.862 . 0 0 "[ . 1 . 2]" 1
1919 1 33 LEU MD1 1 74 PHE H 1.800 . 7.500 4.853 4.436 5.599 . 0 0 "[ . 1 . 2]" 1
1920 2 33 LEU MD1 2 74 PHE H 1.800 . 7.500 4.853 4.438 5.596 . 0 0 "[ . 1 . 2]" 1
1921 1 75 MET HA 1 75 MET ME 1.800 . 4.800 2.331 1.760 3.388 0.040 17 0 "[ . 1 . 2]" 1
1922 2 75 MET HA 2 75 MET ME 1.800 . 4.800 2.331 1.760 3.386 0.040 17 0 "[ . 1 . 2]" 1
1923 1 75 MET H 1 75 MET HB3 1.800 . 3.500 3.326 3.053 3.518 0.018 19 0 "[ . 1 . 2]" 1
1924 2 75 MET H 2 75 MET HB3 1.800 . 3.500 3.326 3.053 3.519 0.019 19 0 "[ . 1 . 2]" 1
1925 1 75 MET H 1 75 MET HB2 1.800 . 2.900 2.128 2.089 2.196 . 0 0 "[ . 1 . 2]" 1
1926 2 75 MET H 2 75 MET HB2 1.800 . 2.900 2.128 2.090 2.197 . 0 0 "[ . 1 . 2]" 1
1927 1 75 MET H 1 75 MET QG 1.800 . 4.500 3.413 2.705 4.041 . 0 0 "[ . 1 . 2]" 1
1928 2 75 MET H 2 75 MET QG 1.800 . 4.500 3.412 2.704 4.042 . 0 0 "[ . 1 . 2]" 1
1929 1 75 MET H 1 75 MET ME 1.800 . 6.500 4.504 3.709 5.151 . 0 0 "[ . 1 . 2]" 1
1930 2 75 MET H 2 75 MET ME 1.800 . 6.500 4.504 3.709 5.151 . 0 0 "[ . 1 . 2]" 1
1931 1 74 PHE H 1 75 MET H 1.800 . 2.900 2.598 2.368 2.764 . 0 0 "[ . 1 . 2]" 1
1932 2 74 PHE H 2 75 MET H 1.800 . 2.900 2.597 2.365 2.764 . 0 0 "[ . 1 . 2]" 1
1933 1 74 PHE HA 1 75 MET H 1.800 . 6.000 3.465 3.431 3.507 . 0 0 "[ . 1 . 2]" 1
1934 2 74 PHE HA 2 75 MET H 1.800 . 6.000 3.464 3.430 3.507 . 0 0 "[ . 1 . 2]" 1
1935 1 74 PHE HB3 1 75 MET H 1.800 . 3.500 3.312 3.092 3.517 0.017 12 0 "[ . 1 . 2]" 1
1936 2 74 PHE HB3 2 75 MET H 1.800 . 3.500 3.313 3.094 3.518 0.018 12 0 "[ . 1 . 2]" 1
1937 1 74 PHE HB2 1 75 MET H 1.800 . 5.000 4.334 4.253 4.415 . 0 0 "[ . 1 . 2]" 1
1938 2 74 PHE HB2 2 75 MET H 1.800 . 5.000 4.335 4.253 4.417 . 0 0 "[ . 1 . 2]" 1
1939 1 74 PHE QD 1 75 MET H 1.800 . 5.900 2.985 2.278 4.150 . 0 0 "[ . 1 . 2]" 1
1940 2 74 PHE QD 2 75 MET H 1.800 . 5.900 2.985 2.279 4.149 . 0 0 "[ . 1 . 2]" 1
1941 1 75 MET H 1 76 ALA H 1.800 . 2.900 2.662 2.517 2.850 . 0 0 "[ . 1 . 2]" 1
1942 2 75 MET H 2 76 ALA H 1.800 . 2.900 2.662 2.518 2.852 . 0 0 "[ . 1 . 2]" 1
1943 1 75 MET ME 1 76 ALA HA 1.800 . 6.500 4.872 3.642 5.392 . 0 0 "[ . 1 . 2]" 1
1944 2 75 MET ME 2 76 ALA HA 1.800 . 6.500 4.873 3.640 5.394 . 0 0 "[ . 1 . 2]" 1
1945 1 71 PHE HA 1 75 MET H 1.800 . 5.000 4.201 3.982 4.656 . 0 0 "[ . 1 . 2]" 1
1946 2 71 PHE HA 2 75 MET H 1.800 . 5.000 4.202 3.983 4.655 . 0 0 "[ . 1 . 2]" 1
1947 1 71 PHE QD 1 75 MET H 1.800 . 8.400 5.536 4.232 6.530 . 0 0 "[ . 1 . 2]" 1
1948 2 71 PHE QD 2 75 MET H 1.800 . 8.400 5.536 4.232 6.530 . 0 0 "[ . 1 . 2]" 1
1949 1 72 GLN HA 1 75 MET H 1.800 . 3.500 3.482 3.300 3.571 0.071 16 0 "[ . 1 . 2]" 1
1950 2 72 GLN HA 2 75 MET H 1.800 . 3.500 3.483 3.299 3.571 0.071 16 0 "[ . 1 . 2]" 1
1951 1 73 GLU H 1 75 MET H 1.800 . 6.000 3.558 3.366 3.797 . 0 0 "[ . 1 . 2]" 1
1952 2 73 GLU H 2 75 MET H 1.800 . 6.000 3.558 3.368 3.798 . 0 0 "[ . 1 . 2]" 1
1953 1 73 GLU HA 1 75 MET H 1.800 . 6.000 3.942 3.722 4.220 . 0 0 "[ . 1 . 2]" 1
1954 2 73 GLU HA 2 75 MET H 1.800 . 6.000 3.942 3.722 4.220 . 0 0 "[ . 1 . 2]" 1
1955 1 73 GLU HB3 1 75 MET H 1.800 . 6.000 4.877 4.630 5.344 . 0 0 "[ . 1 . 2]" 1
1956 2 73 GLU HB3 2 75 MET H 1.800 . 6.000 4.876 4.629 5.340 . 0 0 "[ . 1 . 2]" 1
1957 1 75 MET H 1 77 PHE H 1.800 . 5.000 3.527 3.386 3.697 . 0 0 "[ . 1 . 2]" 1
1958 2 75 MET H 2 77 PHE H 1.800 . 5.000 3.528 3.387 3.697 . 0 0 "[ . 1 . 2]" 1
1959 1 75 MET HA 1 78 VAL HB 1.800 . 3.300 3.274 2.808 3.371 0.071 17 0 "[ . 1 . 2]" 1
1960 2 75 MET HA 2 78 VAL HB 1.800 . 3.300 3.274 2.809 3.371 0.071 17 0 "[ . 1 . 2]" 1
1961 1 75 MET ME 1 78 VAL MG1 1.800 . 6.300 3.803 3.324 4.150 . 0 0 "[ . 1 . 2]" 1
1962 2 75 MET ME 2 78 VAL MG1 1.800 . 6.300 3.803 3.323 4.151 . 0 0 "[ . 1 . 2]" 1
1963 1 75 MET H 1 78 VAL MG2 1.800 . 7.500 4.709 4.368 4.985 . 0 0 "[ . 1 . 2]" 1
1964 2 75 MET H 2 78 VAL MG2 1.800 . 7.500 4.708 4.369 4.987 . 0 0 "[ . 1 . 2]" 1
1965 1 75 MET ME 1 78 VAL MG2 1.800 . 8.000 3.694 2.536 4.656 . 0 0 "[ . 1 . 2]" 1
1966 2 75 MET ME 2 78 VAL MG2 1.800 . 8.000 3.694 2.534 4.656 . 0 0 "[ . 1 . 2]" 1
1967 1 11 LEU MD1 1 75 MET ME 1.800 . 6.300 2.185 1.604 3.341 0.196 16 0 "[ . 1 . 2]" 1
1968 2 11 LEU MD1 2 75 MET ME 1.800 . 6.300 2.185 1.603 3.341 0.197 16 0 "[ . 1 . 2]" 1
1969 1 11 LEU MD2 1 75 MET H 1.800 . 7.500 5.688 5.094 6.114 . 0 0 "[ . 1 . 2]" 1
1970 2 11 LEU MD2 2 75 MET H 1.800 . 7.500 5.688 5.093 6.115 . 0 0 "[ . 1 . 2]" 1
1971 1 11 LEU MD2 1 75 MET ME 1.800 . 6.300 2.111 1.637 3.616 0.163 13 0 "[ . 1 . 2]" 1
1972 2 11 LEU MD2 2 75 MET ME 1.800 . 6.300 2.112 1.637 3.616 0.163 13 0 "[ . 1 . 2]" 1
1973 1 11 LEU HA 1 75 MET ME 1.800 . 7.500 4.571 3.853 6.068 . 0 0 "[ . 1 . 2]" 1
1974 2 11 LEU HA 2 75 MET ME 1.800 . 7.500 4.571 3.854 6.069 . 0 0 "[ . 1 . 2]" 1
1975 1 28 LEU QD 1 75 MET H 1.800 . 9.400 6.012 5.469 6.781 . 0 0 "[ . 1 . 2]" 1
1976 2 28 LEU QD 2 75 MET H 1.800 . 9.400 6.013 5.470 6.781 . 0 0 "[ . 1 . 2]" 1
1977 1 8 MET ME 2 75 MET ME 1.800 . 6.300 4.031 3.462 4.266 . 0 0 "[ . 1 . 2]" 1
1978 1 75 MET ME 2 8 MET ME 1.800 . 6.300 4.032 3.457 4.263 . 0 0 "[ . 1 . 2]" 1
1979 1 11 LEU MD1 2 75 MET ME 1.800 . 8.000 4.139 3.002 5.204 . 0 0 "[ . 1 . 2]" 1
1980 1 75 MET ME 2 11 LEU MD1 1.800 . 8.000 4.142 3.002 5.198 . 0 0 "[ . 1 . 2]" 1
1981 1 79 SER QB 2 75 MET ME 1.800 . 6.500 3.212 1.828 4.228 . 0 0 "[ . 1 . 2]" 1
1982 1 75 MET ME 2 79 SER QB 1.800 . 6.500 3.208 1.828 4.215 . 0 0 "[ . 1 . 2]" 1
1983 1 76 ALA H 1 76 ALA MB 1.800 . 4.000 2.211 2.064 2.263 . 0 0 "[ . 1 . 2]" 1
1984 2 76 ALA H 2 76 ALA MB 1.800 . 4.000 2.212 2.065 2.264 . 0 0 "[ . 1 . 2]" 1
1985 1 75 MET HA 1 76 ALA H 1.800 . 5.000 3.575 3.553 3.587 . 0 0 "[ . 1 . 2]" 1
1986 2 75 MET HA 2 76 ALA H 1.800 . 5.000 3.575 3.551 3.588 . 0 0 "[ . 1 . 2]" 1
1987 1 75 MET HB3 1 76 ALA H 1.800 . 2.900 2.673 2.078 2.948 0.048 11 0 "[ . 1 . 2]" 1
1988 2 75 MET HB3 2 76 ALA H 1.800 . 2.900 2.673 2.077 2.948 0.048 11 0 "[ . 1 . 2]" 1
1989 1 75 MET HB2 1 76 ALA H 1.800 . 2.900 2.825 2.475 3.006 0.106 17 0 "[ . 1 . 2]" 1
1990 2 75 MET HB2 2 76 ALA H 1.800 . 2.900 2.826 2.473 3.006 0.106 17 0 "[ . 1 . 2]" 1
1991 1 75 MET QG 1 76 ALA H 1.800 . 6.000 4.234 3.851 4.450 . 0 0 "[ . 1 . 2]" 1
1992 2 75 MET QG 2 76 ALA H 1.800 . 6.000 4.234 3.850 4.449 . 0 0 "[ . 1 . 2]" 1
1993 1 76 ALA H 1 77 PHE HB3 1.800 . 6.000 5.863 5.690 6.004 0.004 17 0 "[ . 1 . 2]" 1
1994 2 76 ALA H 2 77 PHE HB3 1.800 . 6.000 5.864 5.692 6.005 0.005 17 0 "[ . 1 . 2]" 1
1995 1 72 GLN HA 1 76 ALA H 1.800 . 6.000 3.823 3.405 4.141 . 0 0 "[ . 1 . 2]" 1
1996 2 72 GLN HA 2 76 ALA H 1.800 . 6.000 3.823 3.405 4.140 . 0 0 "[ . 1 . 2]" 1
1997 1 72 GLN QB 1 76 ALA H 1.800 . 7.000 4.573 4.224 4.854 . 0 0 "[ . 1 . 2]" 1
1998 2 72 GLN QB 2 76 ALA H 1.800 . 7.000 4.573 4.220 4.855 . 0 0 "[ . 1 . 2]" 1
1999 1 72 GLN QG 1 76 ALA H 1.800 . 7.000 5.434 5.054 5.845 . 0 0 "[ . 1 . 2]" 1
2000 2 72 GLN QG 2 76 ALA H 1.800 . 7.000 5.434 5.053 5.846 . 0 0 "[ . 1 . 2]" 1
2001 1 73 GLU HA 1 76 ALA H 1.800 . 3.500 3.556 3.504 3.606 0.106 11 0 "[ . 1 . 2]" 1
2002 2 73 GLU HA 2 76 ALA H 1.800 . 3.500 3.555 3.502 3.607 0.107 11 0 "[ . 1 . 2]" 1
2003 1 73 GLU HA 1 76 ALA MB 1.800 . 4.200 3.176 2.892 3.341 . 0 0 "[ . 1 . 2]" 1
2004 2 73 GLU HA 2 76 ALA MB 1.800 . 4.200 3.176 2.892 3.341 . 0 0 "[ . 1 . 2]" 1
2005 1 74 PHE H 1 76 ALA H 1.800 . 6.000 4.604 4.133 4.947 . 0 0 "[ . 1 . 2]" 1
2006 2 74 PHE H 2 76 ALA H 1.800 . 6.000 4.604 4.132 4.947 . 0 0 "[ . 1 . 2]" 1
2007 1 74 PHE QD 1 76 ALA H 1.800 . 8.400 5.319 4.852 5.872 . 0 0 "[ . 1 . 2]" 1
2008 2 74 PHE QD 2 76 ALA H 1.800 . 8.400 5.320 4.854 5.872 . 0 0 "[ . 1 . 2]" 1
2009 1 76 ALA H 1 78 VAL H 1.800 . 6.000 4.341 4.100 4.602 . 0 0 "[ . 1 . 2]" 1
2010 2 76 ALA H 2 78 VAL H 1.800 . 6.000 4.341 4.100 4.603 . 0 0 "[ . 1 . 2]" 1
2011 1 76 ALA H 1 78 VAL MG2 1.800 . 7.500 5.417 5.142 5.722 . 0 0 "[ . 1 . 2]" 1
2012 2 76 ALA H 2 78 VAL MG2 1.800 . 7.500 5.417 5.143 5.719 . 0 0 "[ . 1 . 2]" 1
2013 1 76 ALA HA 1 79 SER QB 1.800 . 4.300 3.130 2.504 3.859 . 0 0 "[ . 1 . 2]" 1
2014 2 76 ALA HA 2 79 SER QB 1.800 . 4.300 3.129 2.503 3.858 . 0 0 "[ . 1 . 2]" 1
2015 1 77 PHE H 1 77 PHE HB3 1.800 . 3.500 3.372 3.249 3.462 . 0 0 "[ . 1 . 2]" 1
2016 2 77 PHE H 2 77 PHE HB3 1.800 . 3.500 3.373 3.249 3.462 . 0 0 "[ . 1 . 2]" 1
2017 1 77 PHE H 1 77 PHE HB2 1.800 . 3.500 2.126 2.104 2.158 . 0 0 "[ . 1 . 2]" 1
2018 2 77 PHE H 2 77 PHE HB2 1.800 . 3.500 2.126 2.105 2.159 . 0 0 "[ . 1 . 2]" 1
2019 1 77 PHE H 1 77 PHE QD 1.800 . 5.900 3.039 2.677 3.682 . 0 0 "[ . 1 . 2]" 1
2020 2 77 PHE H 2 77 PHE QD 1.800 . 5.900 3.039 2.677 3.684 . 0 0 "[ . 1 . 2]" 1
2021 1 76 ALA H 1 77 PHE H 1.800 . 2.900 2.553 2.452 2.694 . 0 0 "[ . 1 . 2]" 1
2022 2 76 ALA H 2 77 PHE H 1.800 . 2.900 2.553 2.451 2.694 . 0 0 "[ . 1 . 2]" 1
2023 1 76 ALA HA 1 77 PHE H 1.800 . 5.000 3.424 3.384 3.464 . 0 0 "[ . 1 . 2]" 1
2024 2 76 ALA HA 2 77 PHE H 1.800 . 5.000 3.424 3.384 3.464 . 0 0 "[ . 1 . 2]" 1
2025 1 76 ALA MB 1 77 PHE H 1.800 . 3.900 2.995 2.872 3.119 . 0 0 "[ . 1 . 2]" 1
2026 2 76 ALA MB 2 77 PHE H 1.800 . 3.900 2.995 2.873 3.117 . 0 0 "[ . 1 . 2]" 1
2027 1 77 PHE H 1 78 VAL MG2 1.800 . 6.500 4.093 3.900 4.261 . 0 0 "[ . 1 . 2]" 1
2028 2 77 PHE H 2 78 VAL MG2 1.800 . 6.500 4.093 3.900 4.262 . 0 0 "[ . 1 . 2]" 1
2029 1 73 GLU HA 1 77 PHE H 1.800 . 5.000 4.197 4.072 4.389 . 0 0 "[ . 1 . 2]" 1
2030 2 73 GLU HA 2 77 PHE H 1.800 . 5.000 4.196 4.069 4.388 . 0 0 "[ . 1 . 2]" 1
2031 1 74 PHE HA 1 77 PHE H 1.800 . 5.000 3.489 3.326 3.630 . 0 0 "[ . 1 . 2]" 1
2032 2 74 PHE HA 2 77 PHE H 1.800 . 5.000 3.489 3.328 3.631 . 0 0 "[ . 1 . 2]" 1
2033 1 75 MET HA 1 77 PHE H 1.800 . 5.000 3.923 3.763 4.077 . 0 0 "[ . 1 . 2]" 1
2034 2 75 MET HA 2 77 PHE H 1.800 . 5.000 3.923 3.766 4.078 . 0 0 "[ . 1 . 2]" 1
2035 1 77 PHE HA 1 80 MET HB3 1.800 . 5.000 4.732 4.284 4.969 . 0 0 "[ . 1 . 2]" 1
2036 2 77 PHE HA 2 80 MET HB3 1.800 . 5.000 4.733 4.283 4.971 . 0 0 "[ . 1 . 2]" 1
2037 1 33 LEU MD2 1 77 PHE H 1.800 . 7.500 4.671 3.944 5.271 . 0 0 "[ . 1 . 2]" 1
2038 2 33 LEU MD2 2 77 PHE H 1.800 . 7.500 4.671 3.944 5.270 . 0 0 "[ . 1 . 2]" 1
2039 1 78 VAL H 1 78 VAL HB 1.800 . 2.900 2.435 2.369 2.520 . 0 0 "[ . 1 . 2]" 1
2040 2 78 VAL H 2 78 VAL HB 1.800 . 2.900 2.434 2.368 2.518 . 0 0 "[ . 1 . 2]" 1
2041 1 78 VAL H 1 78 VAL MG1 1.800 . 5.000 3.756 3.730 3.772 . 0 0 "[ . 1 . 2]" 1
2042 2 78 VAL H 2 78 VAL MG1 1.800 . 5.000 3.755 3.729 3.769 . 0 0 "[ . 1 . 2]" 1
2043 1 78 VAL H 1 78 VAL MG2 1.800 . 4.400 2.330 2.036 2.525 . 0 0 "[ . 1 . 2]" 1
2044 2 78 VAL H 2 78 VAL MG2 1.800 . 4.400 2.330 2.037 2.526 . 0 0 "[ . 1 . 2]" 1
2045 1 77 PHE H 1 78 VAL H 1.800 . 2.900 2.453 2.399 2.513 . 0 0 "[ . 1 . 2]" 1
2046 2 77 PHE H 2 78 VAL H 1.800 . 2.900 2.453 2.398 2.515 . 0 0 "[ . 1 . 2]" 1
2047 1 77 PHE HA 1 78 VAL H 1.800 . 6.000 3.545 3.511 3.575 . 0 0 "[ . 1 . 2]" 1
2048 2 77 PHE HA 2 78 VAL H 1.800 . 6.000 3.546 3.509 3.577 . 0 0 "[ . 1 . 2]" 1
2049 1 77 PHE HB3 1 78 VAL H 1.800 . 3.500 3.119 2.770 3.377 . 0 0 "[ . 1 . 2]" 1
2050 2 77 PHE HB3 2 78 VAL H 1.800 . 3.500 3.119 2.767 3.377 . 0 0 "[ . 1 . 2]" 1
2051 1 77 PHE HB2 1 78 VAL H 1.800 . 3.500 3.023 2.822 3.240 . 0 0 "[ . 1 . 2]" 1
2052 2 77 PHE HB2 2 78 VAL H 1.800 . 3.500 3.023 2.822 3.237 . 0 0 "[ . 1 . 2]" 1
2053 1 77 PHE QD 1 78 VAL H 1.800 . 7.400 4.567 4.489 4.650 . 0 0 "[ . 1 . 2]" 1
2054 2 77 PHE QD 2 78 VAL H 1.800 . 7.400 4.566 4.486 4.648 . 0 0 "[ . 1 . 2]" 1
2055 1 74 PHE HA 1 78 VAL H 1.800 . 6.000 4.080 3.864 4.385 . 0 0 "[ . 1 . 2]" 1
2056 2 74 PHE HA 2 78 VAL H 1.800 . 6.000 4.080 3.864 4.381 . 0 0 "[ . 1 . 2]" 1
2057 1 74 PHE QD 1 78 VAL H 1.800 . 8.400 4.802 4.051 5.131 . 0 0 "[ . 1 . 2]" 1
2058 2 74 PHE QD 2 78 VAL H 1.800 . 8.400 4.802 4.051 5.132 . 0 0 "[ . 1 . 2]" 1
2059 1 74 PHE QD 1 78 VAL MG2 1.800 . 8.900 2.959 2.599 3.446 . 0 0 "[ . 1 . 2]" 1
2060 2 74 PHE QD 2 78 VAL MG2 1.800 . 8.900 2.959 2.602 3.447 . 0 0 "[ . 1 . 2]" 1
2061 1 74 PHE QE 1 78 VAL H 1.800 . 8.400 5.414 4.682 5.694 . 0 0 "[ . 1 . 2]" 1
2062 2 74 PHE QE 2 78 VAL H 1.800 . 8.400 5.414 4.679 5.697 . 0 0 "[ . 1 . 2]" 1
2063 1 74 PHE QE 1 78 VAL MG2 1.800 . 8.900 2.652 1.902 3.106 . 0 0 "[ . 1 . 2]" 1
2064 2 74 PHE QE 2 78 VAL MG2 1.800 . 8.900 2.652 1.902 3.106 . 0 0 "[ . 1 . 2]" 1
2065 1 74 PHE HZ 1 78 VAL MG2 1.800 . 6.500 3.419 2.878 4.130 . 0 0 "[ . 1 . 2]" 1
2066 2 74 PHE HZ 2 78 VAL MG2 1.800 . 6.500 3.419 2.879 4.132 . 0 0 "[ . 1 . 2]" 1
2067 1 75 MET HA 1 78 VAL H 1.800 . 3.500 3.518 3.331 3.570 0.070 13 0 "[ . 1 . 2]" 1
2068 2 75 MET HA 2 78 VAL H 1.800 . 3.500 3.518 3.331 3.569 0.069 13 0 "[ . 1 . 2]" 1
2069 1 75 MET HA 1 78 VAL MG1 1.800 . 6.500 4.609 4.145 4.724 . 0 0 "[ . 1 . 2]" 1
2070 2 75 MET HA 2 78 VAL MG1 1.800 . 6.500 4.609 4.143 4.722 . 0 0 "[ . 1 . 2]" 1
2071 1 75 MET HA 1 78 VAL MG2 1.800 . 4.800 3.250 2.660 3.564 . 0 0 "[ . 1 . 2]" 1
2072 2 75 MET HA 2 78 VAL MG2 1.800 . 4.800 3.250 2.659 3.563 . 0 0 "[ . 1 . 2]" 1
2073 1 75 MET HB2 1 78 VAL H 1.800 . 6.000 5.675 5.413 5.805 . 0 0 "[ . 1 . 2]" 1
2074 2 75 MET HB2 2 78 VAL H 1.800 . 6.000 5.675 5.413 5.806 . 0 0 "[ . 1 . 2]" 1
2075 1 76 ALA HA 1 78 VAL H 1.800 . 5.000 4.355 4.115 4.658 . 0 0 "[ . 1 . 2]" 1
2076 2 76 ALA HA 2 78 VAL H 1.800 . 5.000 4.356 4.116 4.660 . 0 0 "[ . 1 . 2]" 1
2077 1 78 VAL H 1 79 SER QB 1.800 . 7.000 4.805 4.484 5.195 . 0 0 "[ . 1 . 2]" 1
2078 2 78 VAL H 2 79 SER QB 1.800 . 7.000 4.805 4.484 5.193 . 0 0 "[ . 1 . 2]" 1
2079 1 78 VAL HA 1 81 VAL HB 1.800 . 5.000 4.899 4.555 5.035 0.035 13 0 "[ . 1 . 2]" 1
2080 2 78 VAL HA 2 81 VAL HB 1.800 . 5.000 4.899 4.555 5.035 0.035 13 0 "[ . 1 . 2]" 1
2081 1 11 LEU MD1 1 78 VAL H 1.800 . 7.500 5.533 4.898 6.089 . 0 0 "[ . 1 . 2]" 1
2082 2 11 LEU MD1 2 78 VAL H 1.800 . 7.500 5.533 4.898 6.090 . 0 0 "[ . 1 . 2]" 1
2083 1 33 LEU MD1 1 78 VAL H 1.800 . 6.500 4.137 3.480 4.714 . 0 0 "[ . 1 . 2]" 1
2084 2 33 LEU MD1 2 78 VAL H 1.800 . 6.500 4.137 3.479 4.716 . 0 0 "[ . 1 . 2]" 1
2085 1 33 LEU MD1 1 78 VAL MG2 1.800 . 8.000 2.681 1.985 3.132 . 0 0 "[ . 1 . 2]" 1
2086 2 33 LEU MD1 2 78 VAL MG2 1.800 . 8.000 2.681 1.985 3.129 . 0 0 "[ . 1 . 2]" 1
2087 1 37 ILE MD 1 78 VAL H 1.800 . 6.500 4.242 3.694 5.264 . 0 0 "[ . 1 . 2]" 1
2088 2 37 ILE MD 2 78 VAL H 1.800 . 6.500 4.242 3.693 5.263 . 0 0 "[ . 1 . 2]" 1
2089 1 37 ILE MD 1 78 VAL MG2 1.800 . 8.000 3.028 2.140 4.100 . 0 0 "[ . 1 . 2]" 1
2090 2 37 ILE MD 2 78 VAL MG2 1.800 . 8.000 3.028 2.139 4.098 . 0 0 "[ . 1 . 2]" 1
2091 1 4 LEU HG 2 78 VAL MG1 1.800 . 6.500 3.031 2.493 3.663 . 0 0 "[ . 1 . 2]" 1
2092 1 78 VAL MG1 2 4 LEU HG 1.800 . 6.500 3.036 2.488 3.662 . 0 0 "[ . 1 . 2]" 1
2093 1 4 LEU MD1 2 78 VAL MG1 1.800 . 6.300 2.545 2.063 3.042 . 0 0 "[ . 1 . 2]" 1
2094 1 78 VAL MG1 2 4 LEU MD1 1.800 . 6.300 2.550 2.114 3.024 . 0 0 "[ . 1 . 2]" 1
2095 1 4 LEU MD1 2 78 VAL MG2 1.800 . 8.000 2.712 2.343 3.027 . 0 0 "[ . 1 . 2]" 1
2096 1 78 VAL MG2 2 4 LEU MD1 1.800 . 8.000 2.717 2.343 3.028 . 0 0 "[ . 1 . 2]" 1
2097 1 4 LEU MD2 2 78 VAL MG2 1.800 . 6.300 2.540 2.180 3.070 . 0 0 "[ . 1 . 2]" 1
2098 1 78 VAL MG2 2 4 LEU MD2 1.800 . 6.300 2.544 2.180 3.059 . 0 0 "[ . 1 . 2]" 1
2099 1 8 MET ME 2 78 VAL MG1 1.800 . 6.300 2.271 1.555 3.474 0.245 2 0 "[ . 1 . 2]" 1
2100 1 78 VAL MG1 2 8 MET ME 1.800 . 6.300 2.271 1.562 3.461 0.238 2 0 "[ . 1 . 2]" 1
2101 1 79 SER H 1 79 SER QB 1.800 . 3.900 2.610 2.280 2.945 . 0 0 "[ . 1 . 2]" 1
2102 2 79 SER H 2 79 SER QB 1.800 . 3.900 2.610 2.280 2.944 . 0 0 "[ . 1 . 2]" 1
2103 1 78 VAL H 1 79 SER H 1.800 . 2.900 2.548 2.478 2.668 . 0 0 "[ . 1 . 2]" 1
2104 2 78 VAL H 2 79 SER H 1.800 . 2.900 2.548 2.478 2.668 . 0 0 "[ . 1 . 2]" 1
2105 1 78 VAL HA 1 79 SER H 1.800 . 5.000 3.503 3.491 3.522 . 0 0 "[ . 1 . 2]" 1
2106 2 78 VAL HA 2 79 SER H 1.800 . 5.000 3.504 3.491 3.523 . 0 0 "[ . 1 . 2]" 1
2107 1 78 VAL HB 1 79 SER H 1.800 . 2.900 2.915 2.857 2.937 0.037 10 0 "[ . 1 . 2]" 1
2108 2 78 VAL HB 2 79 SER H 1.800 . 2.900 2.915 2.855 2.939 0.039 10 0 "[ . 1 . 2]" 1
2109 1 78 VAL MG1 1 79 SER H 1.800 . 5.000 3.647 3.534 3.761 . 0 0 "[ . 1 . 2]" 1
2110 2 78 VAL MG1 2 79 SER H 1.800 . 5.000 3.648 3.534 3.761 . 0 0 "[ . 1 . 2]" 1
2111 1 78 VAL MG2 1 79 SER H 1.800 . 5.000 3.997 3.906 4.061 . 0 0 "[ . 1 . 2]" 1
2112 2 78 VAL MG2 2 79 SER H 1.800 . 5.000 3.997 3.908 4.061 . 0 0 "[ . 1 . 2]" 1
2113 1 79 SER H 1 80 MET H 1.800 . 2.900 2.599 2.474 2.823 . 0 0 "[ . 1 . 2]" 1
2114 2 79 SER H 2 80 MET H 1.800 . 2.900 2.599 2.474 2.825 . 0 0 "[ . 1 . 2]" 1
2115 1 79 SER H 1 80 MET HG2 1.800 . 5.000 4.189 3.467 4.872 . 0 0 "[ . 1 . 2]" 1
2116 2 79 SER H 2 80 MET HG2 1.800 . 5.000 4.190 3.464 4.872 . 0 0 "[ . 1 . 2]" 1
2117 1 75 MET ME 1 79 SER H 1.800 . 6.500 4.624 3.859 5.013 . 0 0 "[ . 1 . 2]" 1
2118 2 75 MET ME 2 79 SER H 1.800 . 6.500 4.625 3.857 5.010 . 0 0 "[ . 1 . 2]" 1
2119 1 76 ALA HA 1 79 SER H 1.800 . 3.500 3.426 3.316 3.526 0.026 16 0 "[ . 1 . 2]" 1
2120 2 76 ALA HA 2 79 SER H 1.800 . 3.500 3.425 3.315 3.524 0.024 16 0 "[ . 1 . 2]" 1
2121 1 76 ALA H 1 79 SER H 1.800 . 5.000 5.017 4.922 5.076 0.076 15 0 "[ . 1 . 2]" 1
2122 2 76 ALA H 2 79 SER H 1.800 . 5.000 5.017 4.921 5.073 0.073 15 0 "[ . 1 . 2]" 1
2123 1 76 ALA MB 1 79 SER H 1.800 . 6.500 4.612 4.487 4.710 . 0 0 "[ . 1 . 2]" 1
2124 2 76 ALA MB 2 79 SER H 1.800 . 6.500 4.612 4.487 4.708 . 0 0 "[ . 1 . 2]" 1
2125 1 77 PHE H 1 79 SER H 1.800 . 5.000 3.816 3.656 3.928 . 0 0 "[ . 1 . 2]" 1
2126 2 77 PHE H 2 79 SER H 1.800 . 5.000 3.815 3.655 3.927 . 0 0 "[ . 1 . 2]" 1
2127 1 80 MET H 1 80 MET HB3 1.800 . 3.500 3.435 2.749 3.598 0.098 17 0 "[ . 1 . 2]" 1
2128 2 80 MET H 2 80 MET HB3 1.800 . 3.500 3.435 2.749 3.602 0.102 17 0 "[ . 1 . 2]" 1
2129 1 80 MET H 1 80 MET HG3 1.800 . 2.900 2.602 1.835 3.007 0.107 9 0 "[ . 1 . 2]" 1
2130 2 80 MET H 2 80 MET HG3 1.800 . 2.900 2.601 1.836 3.006 0.106 9 0 "[ . 1 . 2]" 1
2131 1 79 SER QB 1 80 MET H 1.800 . 6.000 2.693 2.242 3.386 . 0 0 "[ . 1 . 2]" 1
2132 2 79 SER QB 2 80 MET H 1.800 . 6.000 2.692 2.242 3.386 . 0 0 "[ . 1 . 2]" 1
2133 1 79 SER HA 1 80 MET H 1.800 . 5.000 3.569 3.489 3.598 . 0 0 "[ . 1 . 2]" 1
2134 2 79 SER HA 2 80 MET H 1.800 . 5.000 3.569 3.489 3.599 . 0 0 "[ . 1 . 2]" 1
2135 1 80 MET H 1 81 VAL MG1 1.800 . 6.500 4.661 4.350 5.165 . 0 0 "[ . 1 . 2]" 1
2136 2 80 MET H 2 81 VAL MG1 1.800 . 6.500 4.662 4.350 5.164 . 0 0 "[ . 1 . 2]" 1
2137 1 76 ALA HA 1 80 MET H 1.800 . 5.000 4.150 3.620 4.625 . 0 0 "[ . 1 . 2]" 1
2138 2 76 ALA HA 2 80 MET H 1.800 . 5.000 4.149 3.619 4.623 . 0 0 "[ . 1 . 2]" 1
2139 1 77 PHE HA 1 80 MET H 1.800 . 6.000 3.633 3.432 3.930 . 0 0 "[ . 1 . 2]" 1
2140 2 77 PHE HA 2 80 MET H 1.800 . 6.000 3.633 3.431 3.930 . 0 0 "[ . 1 . 2]" 1
2141 1 77 PHE HA 1 80 MET ME 1.800 . 4.800 3.536 2.838 4.063 . 0 0 "[ . 1 . 2]" 1
2142 2 77 PHE HA 2 80 MET ME 1.800 . 4.800 3.536 2.840 4.063 . 0 0 "[ . 1 . 2]" 1
2143 1 77 PHE HB3 1 80 MET H 1.800 . 6.000 5.639 5.209 6.027 0.027 2 0 "[ . 1 . 2]" 1
2144 2 77 PHE HB3 2 80 MET H 1.800 . 6.000 5.639 5.208 6.026 0.026 2 0 "[ . 1 . 2]" 1
2145 1 77 PHE QD 1 80 MET ME 1.800 . 9.400 3.854 2.851 4.670 . 0 0 "[ . 1 . 2]" 1
2146 2 77 PHE QD 2 80 MET ME 1.800 . 9.400 3.854 2.853 4.670 . 0 0 "[ . 1 . 2]" 1
2147 1 78 VAL H 1 80 MET H 1.800 . 6.000 4.387 4.072 4.881 . 0 0 "[ . 1 . 2]" 1
2148 2 78 VAL H 2 80 MET H 1.800 . 6.000 4.388 4.072 4.883 . 0 0 "[ . 1 . 2]" 1
2149 1 78 VAL HA 1 80 MET H 1.800 . 6.000 4.713 4.069 5.355 . 0 0 "[ . 1 . 2]" 1
2150 2 78 VAL HA 2 80 MET H 1.800 . 6.000 4.715 4.067 5.359 . 0 0 "[ . 1 . 2]" 1
2151 1 78 VAL MG2 1 80 MET H 1.800 . 7.500 5.663 5.243 6.142 . 0 0 "[ . 1 . 2]" 1
2152 2 78 VAL MG2 2 80 MET H 1.800 . 7.500 5.664 5.242 6.146 . 0 0 "[ . 1 . 2]" 1
2153 1 80 MET HA 1 83 THR HB 1.800 . 6.000 4.449 3.020 5.250 . 0 0 "[ . 1 . 2]" 1
2154 2 80 MET HA 2 83 THR HB 1.800 . 6.000 4.448 3.020 5.252 . 0 0 "[ . 1 . 2]" 1
2155 1 53 VAL MG2 1 80 MET ME 1.800 . 8.000 4.371 3.127 5.403 . 0 0 "[ . 1 . 2]" 1
2156 2 53 VAL MG2 2 80 MET ME 1.800 . 8.000 4.371 3.127 5.403 . 0 0 "[ . 1 . 2]" 1
2157 1 57 VAL MG1 1 80 MET ME 1.800 . 6.300 2.789 1.753 3.558 0.047 9 0 "[ . 1 . 2]" 1
2158 2 57 VAL MG1 2 80 MET ME 1.800 . 6.300 2.789 1.753 3.558 0.047 9 0 "[ . 1 . 2]" 1
2159 1 57 VAL MG2 1 80 MET ME 1.800 . 8.000 4.434 3.050 5.363 . 0 0 "[ . 1 . 2]" 1
2160 2 57 VAL MG2 2 80 MET ME 1.800 . 8.000 4.434 3.051 5.364 . 0 0 "[ . 1 . 2]" 1
2161 1 72 GLN HE21 2 80 MET H 1.800 . 6.000 5.476 4.553 5.985 . 0 0 "[ . 1 . 2]" 1
2162 1 80 MET H 2 72 GLN HE21 1.800 . 6.000 5.472 4.579 6.003 0.003 9 0 "[ . 1 . 2]" 1
2163 1 72 GLN HE22 2 80 MET H 1.800 . 6.000 5.685 4.790 6.050 0.050 6 0 "[ . 1 . 2]" 1
2164 1 80 MET H 2 72 GLN HE22 1.800 . 6.000 5.679 4.791 6.051 0.051 6 0 "[ . 1 . 2]" 1
2165 1 81 VAL HA 1 81 VAL MG1 1.800 . 4.200 2.226 2.063 2.399 . 0 0 "[ . 1 . 2]" 1
2166 2 81 VAL HA 2 81 VAL MG1 1.800 . 4.200 2.226 2.064 2.400 . 0 0 "[ . 1 . 2]" 1
2167 1 81 VAL H 1 81 VAL HB 1.800 . 3.500 3.584 3.533 3.628 0.128 2 0 "[ . 1 . 2]" 1
2168 2 81 VAL H 2 81 VAL HB 1.800 . 3.500 3.584 3.534 3.630 0.130 2 0 "[ . 1 . 2]" 1
2169 1 81 VAL H 1 81 VAL MG1 1.800 . 4.400 2.501 2.033 2.997 . 0 0 "[ . 1 . 2]" 1
2170 2 81 VAL H 2 81 VAL MG1 1.800 . 4.400 2.501 2.032 2.996 . 0 0 "[ . 1 . 2]" 1
2171 1 81 VAL H 1 81 VAL MG2 1.800 . 5.000 1.802 1.742 1.863 0.058 9 0 "[ . 1 . 2]" 1
2172 2 81 VAL H 2 81 VAL MG2 1.800 . 5.000 1.803 1.743 1.862 0.057 9 0 "[ . 1 . 2]" 1
2173 1 80 MET H 1 81 VAL H 1.800 . 2.900 2.837 2.673 2.944 0.044 2 0 "[ . 1 . 2]" 1
2174 2 80 MET H 2 81 VAL H 1.800 . 2.900 2.838 2.675 2.944 0.044 2 0 "[ . 1 . 2]" 1
2175 1 80 MET HA 1 81 VAL H 1.800 . 5.000 3.567 3.528 3.589 . 0 0 "[ . 1 . 2]" 1
2176 2 80 MET HA 2 81 VAL H 1.800 . 5.000 3.568 3.530 3.587 . 0 0 "[ . 1 . 2]" 1
2177 1 80 MET HB3 1 81 VAL H 1.800 . 5.000 3.790 3.380 4.282 . 0 0 "[ . 1 . 2]" 1
2178 2 80 MET HB3 2 81 VAL H 1.800 . 5.000 3.791 3.379 4.285 . 0 0 "[ . 1 . 2]" 1
2179 1 80 MET HB2 1 81 VAL H 1.800 . 3.500 2.697 2.372 3.542 0.042 9 0 "[ . 1 . 2]" 1
2180 2 80 MET HB2 2 81 VAL H 1.800 . 3.500 2.697 2.373 3.543 0.043 9 0 "[ . 1 . 2]" 1
2181 1 80 MET HB2 1 81 VAL MG1 1.800 . 6.500 3.328 2.772 4.156 . 0 0 "[ . 1 . 2]" 1
2182 2 80 MET HB2 2 81 VAL MG1 1.800 . 6.500 3.328 2.775 4.156 . 0 0 "[ . 1 . 2]" 1
2183 1 80 MET HG3 1 81 VAL H 1.800 . 5.000 3.733 1.977 4.690 . 0 0 "[ . 1 . 2]" 1
2184 2 80 MET HG3 2 81 VAL H 1.800 . 5.000 3.732 1.975 4.689 . 0 0 "[ . 1 . 2]" 1
2185 1 80 MET HG2 1 81 VAL H 1.800 . 5.000 4.071 2.721 4.597 . 0 0 "[ . 1 . 2]" 1
2186 2 80 MET HG2 2 81 VAL H 1.800 . 5.000 4.071 2.720 4.595 . 0 0 "[ . 1 . 2]" 1
2187 1 80 MET ME 1 81 VAL MG1 1.800 . 8.000 5.001 3.601 5.416 . 0 0 "[ . 1 . 2]" 1
2188 2 80 MET ME 2 81 VAL MG1 1.800 . 8.000 5.002 3.602 5.417 . 0 0 "[ . 1 . 2]" 1
2189 1 81 VAL H 1 82 THR HB 1.800 . 6.000 5.141 4.872 5.494 . 0 0 "[ . 1 . 2]" 1
2190 2 81 VAL H 2 82 THR HB 1.800 . 6.000 5.140 4.871 5.490 . 0 0 "[ . 1 . 2]" 1
2191 1 77 PHE HA 1 81 VAL H 1.800 . 6.000 4.361 4.117 4.614 . 0 0 "[ . 1 . 2]" 1
2192 2 77 PHE HA 2 81 VAL H 1.800 . 6.000 4.360 4.115 4.610 . 0 0 "[ . 1 . 2]" 1
2193 1 77 PHE HA 1 81 VAL MG1 1.800 . 6.500 4.402 3.714 4.946 . 0 0 "[ . 1 . 2]" 1
2194 2 77 PHE HA 2 81 VAL MG1 1.800 . 6.500 4.401 3.715 4.946 . 0 0 "[ . 1 . 2]" 1
2195 1 78 VAL HA 1 81 VAL H 1.800 . 5.000 3.888 3.659 4.049 . 0 0 "[ . 1 . 2]" 1
2196 2 78 VAL HA 2 81 VAL H 1.800 . 5.000 3.889 3.660 4.049 . 0 0 "[ . 1 . 2]" 1
2197 1 78 VAL MG1 1 81 VAL H 1.800 . 7.500 4.916 4.702 5.164 . 0 0 "[ . 1 . 2]" 1
2198 2 78 VAL MG1 2 81 VAL H 1.800 . 7.500 4.917 4.704 5.162 . 0 0 "[ . 1 . 2]" 1
2199 1 79 SER H 1 81 VAL H 1.800 . 6.000 4.185 3.822 4.418 . 0 0 "[ . 1 . 2]" 1
2200 2 79 SER H 2 81 VAL H 1.800 . 6.000 4.186 3.823 4.419 . 0 0 "[ . 1 . 2]" 1
2201 1 79 SER HA 1 81 VAL H 1.800 . 6.000 4.472 4.073 4.697 . 0 0 "[ . 1 . 2]" 1
2202 2 79 SER HA 2 81 VAL H 1.800 . 6.000 4.471 4.071 4.697 . 0 0 "[ . 1 . 2]" 1
2203 1 81 VAL H 1 83 THR MG 1.800 . 7.500 5.577 4.142 6.340 . 0 0 "[ . 1 . 2]" 1
2204 2 81 VAL H 2 83 THR MG 1.800 . 7.500 5.577 4.141 6.340 . 0 0 "[ . 1 . 2]" 1
2205 1 81 VAL HA 1 84 ALA MB 1.800 . 4.800 2.341 1.990 2.641 . 0 0 "[ . 1 . 2]" 1
2206 2 81 VAL HA 2 84 ALA MB 1.800 . 4.800 2.341 1.991 2.641 . 0 0 "[ . 1 . 2]" 1
2207 1 81 VAL MG1 1 84 ALA MB 1.800 . 8.000 3.617 3.227 4.066 . 0 0 "[ . 1 . 2]" 1
2208 2 81 VAL MG1 2 84 ALA MB 1.800 . 8.000 3.618 3.227 4.067 . 0 0 "[ . 1 . 2]" 1
2209 1 37 ILE MG 1 81 VAL MG1 1.800 . 6.300 2.554 1.952 3.010 . 0 0 "[ . 1 . 2]" 1
2210 2 37 ILE MG 2 81 VAL MG1 1.800 . 6.300 2.554 1.953 3.009 . 0 0 "[ . 1 . 2]" 1
2211 1 37 ILE MD 1 81 VAL MG1 1.800 . 6.300 2.418 1.974 2.898 . 0 0 "[ . 1 . 2]" 1
2212 2 37 ILE MD 2 81 VAL MG1 1.800 . 6.300 2.418 1.974 2.896 . 0 0 "[ . 1 . 2]" 1
2213 1 41 LEU MD1 1 81 VAL MG1 1.800 . 8.000 4.945 4.577 5.299 . 0 0 "[ . 1 . 2]" 1
2214 2 41 LEU MD1 2 81 VAL MG1 1.800 . 8.000 4.945 4.578 5.297 . 0 0 "[ . 1 . 2]" 1
2215 1 53 VAL MG2 1 81 VAL MG1 1.800 . 8.000 5.475 5.400 5.538 . 0 0 "[ . 1 . 2]" 1
2216 2 53 VAL MG2 2 81 VAL MG1 1.800 . 8.000 5.477 5.400 5.540 . 0 0 "[ . 1 . 2]" 1
2217 1 57 VAL MG2 1 81 VAL MG1 1.800 . 6.300 1.774 1.678 1.880 0.122 10 0 "[ . 1 . 2]" 1
2218 2 57 VAL MG2 2 81 VAL MG1 1.800 . 6.300 1.774 1.679 1.881 0.121 10 0 "[ . 1 . 2]" 1
2219 1 61 LEU MD1 1 81 VAL MG1 1.800 . 8.000 4.034 3.840 4.295 . 0 0 "[ . 1 . 2]" 1
2220 2 61 LEU MD1 2 81 VAL MG1 1.800 . 8.000 4.033 3.839 4.296 . 0 0 "[ . 1 . 2]" 1
2221 1 82 THR H 1 82 THR HB 1.800 . 3.500 2.769 2.603 2.949 . 0 0 "[ . 1 . 2]" 1
2222 2 82 THR H 2 82 THR HB 1.800 . 3.500 2.769 2.603 2.947 . 0 0 "[ . 1 . 2]" 1
2223 1 82 THR H 1 82 THR MG 1.800 . 5.000 3.747 3.670 3.782 . 0 0 "[ . 1 . 2]" 1
2224 2 82 THR H 2 82 THR MG 1.800 . 5.000 3.747 3.671 3.783 . 0 0 "[ . 1 . 2]" 1
2225 1 81 VAL H 1 82 THR H 1.800 . 2.900 2.637 2.483 2.758 . 0 0 "[ . 1 . 2]" 1
2226 2 81 VAL H 2 82 THR H 1.800 . 2.900 2.636 2.481 2.757 . 0 0 "[ . 1 . 2]" 1
2227 1 81 VAL HA 1 82 THR H 1.800 . 5.000 3.571 3.552 3.591 . 0 0 "[ . 1 . 2]" 1
2228 2 81 VAL HA 2 82 THR H 1.800 . 5.000 3.571 3.551 3.590 . 0 0 "[ . 1 . 2]" 1
2229 1 81 VAL HB 1 82 THR H 1.800 . 3.500 3.508 3.421 3.565 0.065 3 0 "[ . 1 . 2]" 1
2230 2 81 VAL HB 2 82 THR H 1.800 . 3.500 3.508 3.422 3.564 0.064 3 0 "[ . 1 . 2]" 1
2231 1 81 VAL MG2 1 82 THR H 1.800 . 5.000 1.846 1.761 2.255 0.039 17 0 "[ . 1 . 2]" 1
2232 2 81 VAL MG2 2 82 THR H 1.800 . 5.000 1.846 1.760 2.256 0.040 17 0 "[ . 1 . 2]" 1
2233 1 82 THR H 1 83 THR H 1.800 . 2.900 2.633 2.561 2.744 . 0 0 "[ . 1 . 2]" 1
2234 2 82 THR H 2 83 THR H 1.800 . 2.900 2.634 2.563 2.743 . 0 0 "[ . 1 . 2]" 1
2235 1 78 VAL HA 1 82 THR H 1.800 . 5.000 4.087 3.819 4.461 . 0 0 "[ . 1 . 2]" 1
2236 2 78 VAL HA 2 82 THR H 1.800 . 5.000 4.087 3.819 4.461 . 0 0 "[ . 1 . 2]" 1
2237 1 79 SER HA 1 82 THR H 1.800 . 3.500 3.481 3.316 3.541 0.041 15 0 "[ . 1 . 2]" 1
2238 2 79 SER HA 2 82 THR H 1.800 . 3.500 3.480 3.316 3.540 0.040 15 0 "[ . 1 . 2]" 1
2239 1 80 MET H 1 82 THR H 1.800 . 5.000 4.280 3.953 4.572 . 0 0 "[ . 1 . 2]" 1
2240 2 80 MET H 2 82 THR H 1.800 . 5.000 4.281 3.951 4.572 . 0 0 "[ . 1 . 2]" 1
2241 1 80 MET HA 1 82 THR H 1.800 . 5.000 4.701 4.502 4.930 . 0 0 "[ . 1 . 2]" 1
2242 2 80 MET HA 2 82 THR H 1.800 . 5.000 4.702 4.504 4.928 . 0 0 "[ . 1 . 2]" 1
2243 1 44 PHE QE 1 82 THR MG 1.800 . 9.400 2.970 2.052 4.219 . 0 0 "[ . 1 . 2]" 1
2244 2 44 PHE QE 2 82 THR MG 1.800 . 9.400 2.970 2.053 4.219 . 0 0 "[ . 1 . 2]" 1
2245 1 8 MET ME 2 82 THR MG 1.800 . 6.300 2.685 2.091 3.382 . 0 0 "[ . 1 . 2]" 1
2246 1 82 THR MG 2 8 MET ME 1.800 . 6.300 2.682 2.068 3.380 . 0 0 "[ . 1 . 2]" 1
2247 1 8 MET HB2 2 82 THR MG 1.800 . 6.500 4.404 3.952 5.009 . 0 0 "[ . 1 . 2]" 1
2248 1 82 THR MG 2 8 MET HB2 1.800 . 6.500 4.407 3.972 5.022 . 0 0 "[ . 1 . 2]" 1
2249 1 9 VAL HB 2 82 THR MG 1.800 . 6.500 5.428 5.283 5.501 . 0 0 "[ . 1 . 2]" 1
2250 1 82 THR MG 2 9 VAL HB 1.800 . 6.500 5.433 5.314 5.510 . 0 0 "[ . 1 . 2]" 1
2251 1 9 VAL MG1 2 82 THR MG 1.800 . 6.300 4.075 3.861 4.240 . 0 0 "[ . 1 . 2]" 1
2252 1 82 THR MG 2 9 VAL MG1 1.800 . 6.300 4.080 3.875 4.244 . 0 0 "[ . 1 . 2]" 1
2253 1 12 ILE MD 2 82 THR MG 1.800 . 8.000 2.073 1.630 3.168 0.170 20 0 "[ . 1 . 2]" 1
2254 1 82 THR MG 2 12 ILE MD 1.800 . 8.000 2.072 1.614 3.203 0.186 20 0 "[ . 1 . 2]" 1
2255 1 83 THR H 1 83 THR MG 1.800 . 5.000 3.075 2.032 3.885 . 0 0 "[ . 1 . 2]" 1
2256 2 83 THR H 2 83 THR MG 1.800 . 5.000 3.075 2.031 3.884 . 0 0 "[ . 1 . 2]" 1
2257 1 82 THR HB 1 83 THR H 1.800 . 5.000 3.359 3.170 3.634 . 0 0 "[ . 1 . 2]" 1
2258 2 82 THR HB 2 83 THR H 1.800 . 5.000 3.360 3.172 3.635 . 0 0 "[ . 1 . 2]" 1
2259 1 82 THR HA 1 83 THR H 1.800 . 5.000 3.375 3.271 3.421 . 0 0 "[ . 1 . 2]" 1
2260 2 82 THR HA 2 83 THR H 1.800 . 5.000 3.375 3.274 3.419 . 0 0 "[ . 1 . 2]" 1
2261 1 82 THR MG 1 83 THR H 1.800 . 6.500 4.150 3.999 4.312 . 0 0 "[ . 1 . 2]" 1
2262 2 82 THR MG 2 83 THR H 1.800 . 6.500 4.150 3.999 4.314 . 0 0 "[ . 1 . 2]" 1
2263 1 79 SER HA 1 83 THR H 1.800 . 5.000 4.445 4.098 4.772 . 0 0 "[ . 1 . 2]" 1
2264 2 79 SER HA 2 83 THR H 1.800 . 5.000 4.445 4.097 4.771 . 0 0 "[ . 1 . 2]" 1
2265 1 79 SER QB 1 83 THR H 1.800 . 6.000 5.153 4.831 5.349 . 0 0 "[ . 1 . 2]" 1
2266 2 79 SER QB 2 83 THR H 1.800 . 6.000 5.153 4.830 5.348 . 0 0 "[ . 1 . 2]" 1
2267 1 80 MET HA 1 83 THR H 1.800 . 5.000 3.798 3.455 4.096 . 0 0 "[ . 1 . 2]" 1
2268 2 80 MET HA 2 83 THR H 1.800 . 5.000 3.798 3.454 4.097 . 0 0 "[ . 1 . 2]" 1
2269 1 81 VAL H 1 83 THR H 1.800 . 5.000 3.853 3.624 4.031 . 0 0 "[ . 1 . 2]" 1
2270 2 81 VAL H 2 83 THR H 1.800 . 5.000 3.853 3.622 4.033 . 0 0 "[ . 1 . 2]" 1
2271 1 81 VAL HA 1 83 THR H 1.800 . 5.000 3.627 3.543 3.759 . 0 0 "[ . 1 . 2]" 1
2272 2 81 VAL HA 2 83 THR H 1.800 . 5.000 3.627 3.545 3.762 . 0 0 "[ . 1 . 2]" 1
2273 1 81 VAL HB 1 83 THR H 1.800 . 5.000 4.928 4.856 5.026 0.026 10 0 "[ . 1 . 2]" 1
2274 2 81 VAL HB 2 83 THR H 1.800 . 5.000 4.928 4.856 5.028 0.028 10 0 "[ . 1 . 2]" 1
2275 1 83 THR H 1 84 ALA MB 1.800 . 6.500 3.695 3.529 3.837 . 0 0 "[ . 1 . 2]" 1
2276 2 83 THR H 2 84 ALA MB 1.800 . 6.500 3.695 3.528 3.834 . 0 0 "[ . 1 . 2]" 1
2277 1 15 PHE QD 2 83 THR MG 1.800 . 10.400 5.854 4.955 7.181 . 0 0 "[ . 1 . 2]" 1
2278 1 83 THR MG 2 15 PHE QD 1.800 . 10.400 5.854 4.982 7.159 . 0 0 "[ . 1 . 2]" 1
2279 1 71 PHE QD 2 83 THR MG 1.800 . 7.200 2.886 1.775 4.750 0.025 2 0 "[ . 1 . 2]" 1
2280 1 83 THR MG 2 71 PHE QD 1.800 . 7.200 2.881 1.787 4.730 0.013 2 0 "[ . 1 . 2]" 1
2281 1 84 ALA H 1 84 ALA MB 1.800 . 4.000 2.172 2.050 2.319 . 0 0 "[ . 1 . 2]" 1
2282 2 84 ALA H 2 84 ALA MB 1.800 . 4.000 2.172 2.052 2.319 . 0 0 "[ . 1 . 2]" 1
2283 1 83 THR H 1 84 ALA H 1.800 . 2.900 2.044 1.861 2.310 . 0 0 "[ . 1 . 2]" 1
2284 2 83 THR H 2 84 ALA H 1.800 . 2.900 2.044 1.864 2.311 . 0 0 "[ . 1 . 2]" 1
2285 1 83 THR HA 1 84 ALA H 1.800 . 5.000 3.330 3.006 3.536 . 0 0 "[ . 1 . 2]" 1
2286 2 83 THR HA 2 84 ALA H 1.800 . 5.000 3.330 3.007 3.536 . 0 0 "[ . 1 . 2]" 1
2287 1 83 THR HB 1 84 ALA H 1.800 . 5.000 3.990 3.055 4.621 . 0 0 "[ . 1 . 2]" 1
2288 2 83 THR HB 2 84 ALA H 1.800 . 5.000 3.989 3.054 4.622 . 0 0 "[ . 1 . 2]" 1
2289 1 83 THR MG 1 84 ALA H 1.800 . 6.500 4.127 3.322 4.440 . 0 0 "[ . 1 . 2]" 1
2290 2 83 THR MG 2 84 ALA H 1.800 . 6.500 4.126 3.321 4.440 . 0 0 "[ . 1 . 2]" 1
2291 1 84 ALA H 1 85 CYS HB2 1.800 . 6.000 5.150 4.242 6.021 0.021 10 0 "[ . 1 . 2]" 1
2292 2 84 ALA H 2 85 CYS HB2 1.800 . 6.000 5.149 4.245 6.016 0.016 10 0 "[ . 1 . 2]" 1
2293 1 80 MET HA 1 84 ALA H 1.800 . 5.000 4.573 4.126 4.937 . 0 0 "[ . 1 . 2]" 1
2294 2 80 MET HA 2 84 ALA H 1.800 . 5.000 4.573 4.124 4.936 . 0 0 "[ . 1 . 2]" 1
2295 1 80 MET HB2 1 84 ALA H 1.800 . 6.000 5.779 5.257 6.037 0.037 8 0 "[ . 1 . 2]" 1
2296 2 80 MET HB2 2 84 ALA H 1.800 . 6.000 5.779 5.252 6.038 0.038 8 0 "[ . 1 . 2]" 1
2297 1 80 MET HB2 1 84 ALA MB 1.800 . 6.500 4.804 4.233 5.270 . 0 0 "[ . 1 . 2]" 1
2298 2 80 MET HB2 2 84 ALA MB 1.800 . 6.500 4.804 4.231 5.270 . 0 0 "[ . 1 . 2]" 1
2299 1 81 VAL HA 1 84 ALA H 1.800 . 3.500 3.116 2.851 3.469 . 0 0 "[ . 1 . 2]" 1
2300 2 81 VAL HA 2 84 ALA H 1.800 . 3.500 3.116 2.851 3.471 . 0 0 "[ . 1 . 2]" 1
2301 1 81 VAL MG2 1 84 ALA H 1.800 . 7.500 4.805 4.653 4.956 . 0 0 "[ . 1 . 2]" 1
2302 2 81 VAL MG2 2 84 ALA H 1.800 . 7.500 4.806 4.654 4.957 . 0 0 "[ . 1 . 2]" 1
2303 1 82 THR H 1 84 ALA H 1.800 . 5.000 4.077 3.936 4.299 . 0 0 "[ . 1 . 2]" 1
2304 2 82 THR H 2 84 ALA H 1.800 . 5.000 4.078 3.938 4.300 . 0 0 "[ . 1 . 2]" 1
2305 1 82 THR HA 1 84 ALA H 1.800 . 5.000 4.145 3.724 4.572 . 0 0 "[ . 1 . 2]" 1
2306 2 82 THR HA 2 84 ALA H 1.800 . 5.000 4.146 3.725 4.571 . 0 0 "[ . 1 . 2]" 1
2307 1 50 GLU HB2 1 84 ALA MB 1.800 . 4.800 2.142 1.743 2.709 0.057 16 0 "[ . 1 . 2]" 1
2308 2 50 GLU HB2 2 84 ALA MB 1.800 . 4.800 2.142 1.743 2.708 0.057 16 0 "[ . 1 . 2]" 1
2309 1 50 GLU HG2 1 84 ALA MB 1.800 . 6.500 4.267 3.623 4.867 . 0 0 "[ . 1 . 2]" 1
2310 2 50 GLU HG2 2 84 ALA MB 1.800 . 6.500 4.267 3.623 4.866 . 0 0 "[ . 1 . 2]" 1
2311 1 53 VAL HA 1 84 ALA MB 1.800 . 6.500 4.476 4.111 5.134 . 0 0 "[ . 1 . 2]" 1
2312 2 53 VAL HA 2 84 ALA MB 1.800 . 6.500 4.476 4.113 5.135 . 0 0 "[ . 1 . 2]" 1
2313 1 53 VAL HB 1 84 ALA H 1.800 . 5.000 4.906 4.550 5.036 0.036 16 0 "[ . 1 . 2]" 1
2314 2 53 VAL HB 2 84 ALA H 1.800 . 5.000 4.907 4.551 5.037 0.037 16 0 "[ . 1 . 2]" 1
2315 1 53 VAL HB 1 84 ALA MB 1.800 . 4.800 1.983 1.778 2.616 0.022 17 0 "[ . 1 . 2]" 1
2316 2 53 VAL HB 2 84 ALA MB 1.800 . 4.800 1.983 1.778 2.617 0.022 17 0 "[ . 1 . 2]" 1
2317 1 53 VAL MG2 1 84 ALA H 1.800 . 6.500 5.076 4.448 5.310 . 0 0 "[ . 1 . 2]" 1
2318 2 53 VAL MG2 2 84 ALA H 1.800 . 6.500 5.076 4.447 5.311 . 0 0 "[ . 1 . 2]" 1
2319 1 53 VAL MG2 1 84 ALA MB 1.800 . 5.700 2.993 2.414 3.661 . 0 0 "[ . 1 . 2]" 1
2320 2 53 VAL MG2 2 84 ALA MB 1.800 . 5.700 2.994 2.413 3.661 . 0 0 "[ . 1 . 2]" 1
2321 1 54 VAL HA 1 84 ALA MB 1.800 . 4.800 3.874 3.601 4.082 . 0 0 "[ . 1 . 2]" 1
2322 2 54 VAL HA 2 84 ALA MB 1.800 . 4.800 3.874 3.600 4.081 . 0 0 "[ . 1 . 2]" 1
2323 1 54 VAL HB 1 84 ALA MB 1.800 . 4.800 3.810 3.611 4.082 . 0 0 "[ . 1 . 2]" 1
2324 2 54 VAL HB 2 84 ALA MB 1.800 . 4.800 3.810 3.612 4.080 . 0 0 "[ . 1 . 2]" 1
2325 1 84 ALA H 1 85 CYS H 1.800 . 3.500 2.976 2.340 3.500 . 0 0 "[ . 1 . 2]" 1
2326 2 84 ALA H 2 85 CYS H 1.800 . 3.500 2.976 2.342 3.499 . 0 0 "[ . 1 . 2]" 1
2327 1 84 ALA HA 1 85 CYS H 1.800 . 6.000 3.253 2.614 3.598 . 0 0 "[ . 1 . 2]" 1
2328 2 84 ALA HA 2 85 CYS H 1.800 . 6.000 3.253 2.612 3.600 . 0 0 "[ . 1 . 2]" 1
2329 1 84 ALA MB 1 85 CYS H 1.800 . 6.500 2.941 1.909 3.735 . 0 0 "[ . 1 . 2]" 1
2330 2 84 ALA MB 2 85 CYS H 1.800 . 6.500 2.940 1.909 3.734 . 0 0 "[ . 1 . 2]" 1
2331 1 82 THR HA 1 85 CYS H 1.800 . 6.000 5.310 3.927 6.049 0.049 11 0 "[ . 1 . 2]" 1
2332 2 82 THR HA 2 85 CYS H 1.800 . 6.000 5.311 3.924 6.050 0.050 16 0 "[ . 1 . 2]" 1
2333 1 81 VAL HA 1 85 CYS H 1.800 . 6.000 5.198 3.338 6.018 0.018 8 0 "[ . 1 . 2]" 1
2334 2 81 VAL HA 2 85 CYS H 1.800 . 6.000 5.197 3.336 6.019 0.019 8 0 "[ . 1 . 2]" 1
2335 1 83 THR H 1 85 CYS H 1.800 . 6.000 4.549 3.731 5.072 . 0 0 "[ . 1 . 2]" 1
2336 2 83 THR H 2 85 CYS H 1.800 . 6.000 4.549 3.730 5.071 . 0 0 "[ . 1 . 2]" 1
2337 1 83 THR MG 1 88 PHE QD 1.800 . 8.900 4.608 2.815 6.554 . 0 0 "[ . 1 . 2]" 1
2338 2 83 THR MG 2 88 PHE QD 1.800 . 8.900 4.608 2.816 6.555 . 0 0 "[ . 1 . 2]" 1
2339 1 15 PHE HB2 2 88 PHE QE 1.800 . 7.400 5.799 2.556 6.803 . 0 0 "[ . 1 . 2]" 1
2340 1 88 PHE QE 2 15 PHE HB2 1.800 . 7.400 5.799 2.641 6.848 . 0 0 "[ . 1 . 2]" 1
2341 1 15 PHE QD 2 88 PHE QE 1.800 . 9.800 4.263 2.887 5.780 . 0 0 "[ . 1 . 2]" 1
2342 1 88 PHE QE 2 15 PHE QD 1.800 . 9.800 4.262 2.907 5.746 . 0 0 "[ . 1 . 2]" 1
2343 1 26 HIS HB2 2 88 PHE QE 1.800 . 7.400 5.068 2.242 6.652 . 0 0 "[ . 1 . 2]" 1
2344 1 88 PHE QE 2 26 HIS HB2 1.800 . 7.400 5.057 2.172 6.680 . 0 0 "[ . 1 . 2]" 1
2345 1 71 PHE QB 2 88 PHE QE 1.800 . 8.400 2.842 1.809 4.064 . 0 0 "[ . 1 . 2]" 1
2346 1 88 PHE QE 2 71 PHE QB 1.800 . 8.400 2.833 1.807 4.075 . 0 0 "[ . 1 . 2]" 1
2347 1 71 PHE QD 2 88 PHE QD 1.800 . 9.800 4.349 3.260 5.764 . 0 0 "[ . 1 . 2]" 1
2348 1 88 PHE QD 2 71 PHE QD 1.800 . 9.800 4.342 3.305 5.736 . 0 0 "[ . 1 . 2]" 1
2349 1 71 PHE QD 2 88 PHE QE 1.800 . 8.100 3.136 2.068 4.469 . 0 0 "[ . 1 . 2]" 1
2350 1 88 PHE QE 2 71 PHE QD 1.800 . 8.100 3.130 2.062 4.464 . 0 0 "[ . 1 . 2]" 1
2351 1 71 PHE QE 2 88 PHE QD 1.800 . 9.800 4.819 2.773 6.607 . 0 0 "[ . 1 . 2]" 1
2352 1 88 PHE QD 2 71 PHE QE 1.800 . 9.800 4.809 2.783 6.608 . 0 0 "[ . 1 . 2]" 1
2353 1 72 GLN HA 2 88 PHE QE 1.800 . 8.400 6.335 4.544 7.240 . 0 0 "[ . 1 . 2]" 1
2354 1 88 PHE QE 2 72 GLN HA 1.800 . 8.400 6.332 4.551 7.241 . 0 0 "[ . 1 . 2]" 1
2355 1 89 PHE H 1 89 PHE HB2 1.800 . 3.500 3.067 2.360 3.655 0.155 8 0 "[ . 1 . 2]" 1
2356 2 89 PHE H 2 89 PHE HB2 1.800 . 3.500 3.067 2.361 3.654 0.154 8 0 "[ . 1 . 2]" 1
2357 1 89 PHE H 1 89 PHE QD 1.800 . 5.300 2.952 1.948 3.861 . 0 0 "[ . 1 . 2]" 1
2358 2 89 PHE H 2 89 PHE QD 1.800 . 5.300 2.953 1.950 3.860 . 0 0 "[ . 1 . 2]" 1
2359 1 88 PHE HA 1 89 PHE H 1.800 . 5.000 2.999 2.232 3.570 . 0 0 "[ . 1 . 2]" 1
2360 2 88 PHE HA 2 89 PHE H 1.800 . 5.000 2.998 2.233 3.571 . 0 0 "[ . 1 . 2]" 1
2361 1 88 PHE QB 1 89 PHE H 1.800 . 6.000 3.009 1.804 4.085 . 0 0 "[ . 1 . 2]" 1
2362 2 88 PHE QB 2 89 PHE H 1.800 . 6.000 3.009 1.806 4.086 . 0 0 "[ . 1 . 2]" 1
2363 1 88 PHE QD 1 89 PHE H 1.800 . 8.400 3.149 1.862 4.422 . 0 0 "[ . 1 . 2]" 1
2364 2 88 PHE QD 2 89 PHE H 1.800 . 8.400 3.149 1.862 4.421 . 0 0 "[ . 1 . 2]" 1
2365 1 88 PHE QE 1 89 PHE QE 1.800 . 8.100 2.660 1.859 3.591 . 0 0 "[ . 1 . 2]" 1
2366 2 88 PHE QE 2 89 PHE QE 1.800 . 8.100 2.660 1.860 3.591 . 0 0 "[ . 1 . 2]" 1
2367 1 89 PHE H 1 90 GLU HA 1.800 . 6.000 4.942 4.096 5.617 . 0 0 "[ . 1 . 2]" 1
2368 2 89 PHE H 2 90 GLU HA 1.800 . 6.000 4.941 4.098 5.614 . 0 0 "[ . 1 . 2]" 1
2369 1 89 PHE H 1 90 GLU HB3 1.800 . 6.000 5.638 4.862 6.109 0.109 5 0 "[ . 1 . 2]" 1
2370 2 89 PHE H 2 90 GLU HB3 1.800 . 6.000 5.638 4.864 6.107 0.107 5 0 "[ . 1 . 2]" 1
2371 1 12 ILE MG 2 89 PHE H 1.800 . 7.500 4.369 2.860 5.731 . 0 0 "[ . 1 . 2]" 1
2372 1 89 PHE H 2 12 ILE MG 1.800 . 7.500 4.369 2.833 5.733 . 0 0 "[ . 1 . 2]" 1
2373 1 15 PHE QD 2 89 PHE QE 1.800 . 8.100 2.828 1.898 4.859 . 0 0 "[ . 1 . 2]" 1
2374 1 89 PHE QE 2 15 PHE QD 1.800 . 8.100 2.824 1.889 4.865 . 0 0 "[ . 1 . 2]" 1
2375 1 26 HIS HB2 2 89 PHE QE 1.800 . 8.400 5.885 3.574 7.685 . 0 0 "[ . 1 . 2]" 1
2376 1 89 PHE QE 2 26 HIS HB2 1.800 . 8.400 5.882 3.594 7.690 . 0 0 "[ . 1 . 2]" 1
2377 1 71 PHE QE 2 89 PHE QE 1.800 . 7.500 4.686 2.518 6.048 . 0 0 "[ . 1 . 2]" 1
2378 1 89 PHE QE 2 71 PHE QE 1.800 . 7.500 4.681 2.515 6.054 . 0 0 "[ . 1 . 2]" 1
2379 1 75 MET ME 2 89 PHE QE 1.800 . 8.900 6.244 5.582 6.828 . 0 0 "[ . 1 . 2]" 1
2380 1 89 PHE QE 2 75 MET ME 1.800 . 8.900 6.244 5.581 6.849 . 0 0 "[ . 1 . 2]" 1
2381 1 90 GLU H 1 90 GLU HB2 1.800 . 2.900 2.632 2.127 3.045 0.145 5 0 "[ . 1 . 2]" 1
2382 2 90 GLU H 2 90 GLU HB2 1.800 . 2.900 2.632 2.131 3.046 0.146 5 0 "[ . 1 . 2]" 1
2383 1 89 PHE H 1 90 GLU H 1.800 . 5.000 2.901 1.828 4.198 . 0 0 "[ . 1 . 2]" 1
2384 2 89 PHE H 2 90 GLU H 1.800 . 5.000 2.900 1.828 4.196 . 0 0 "[ . 1 . 2]" 1
2385 1 89 PHE HA 1 90 GLU H 1.800 . 3.500 2.874 2.238 3.561 0.061 14 0 "[ . 1 . 2]" 1
2386 2 89 PHE HA 2 90 GLU H 1.800 . 3.500 2.875 2.235 3.559 0.059 14 0 "[ . 1 . 2]" 1
2387 1 89 PHE HB3 1 90 GLU H 1.800 . 5.000 4.127 2.900 4.645 . 0 0 "[ . 1 . 2]" 1
2388 2 89 PHE HB3 2 90 GLU H 1.800 . 5.000 4.127 2.903 4.644 . 0 0 "[ . 1 . 2]" 1
2389 1 89 PHE HB2 1 90 GLU H 1.800 . 5.000 3.843 1.849 4.498 . 0 0 "[ . 1 . 2]" 1
2390 2 89 PHE HB2 2 90 GLU H 1.800 . 5.000 3.843 1.848 4.497 . 0 0 "[ . 1 . 2]" 1
2391 1 89 PHE QD 1 90 GLU H 1.800 . 7.400 4.494 3.886 4.970 . 0 0 "[ . 1 . 2]" 1
2392 2 89 PHE QD 2 90 GLU H 1.800 . 7.400 4.495 3.885 4.965 . 0 0 "[ . 1 . 2]" 1
2393 1 90 GLU H 1 91 HIS H 1.800 . 6.000 2.888 1.907 4.583 . 0 0 "[ . 1 . 2]" 1
2394 2 90 GLU H 2 91 HIS H 1.800 . 6.000 2.888 1.908 4.584 . 0 0 "[ . 1 . 2]" 1
2395 1 90 GLU H 1 91 HIS HB3 1.800 . 6.000 5.297 4.034 6.033 0.033 3 0 "[ . 1 . 2]" 1
2396 2 90 GLU H 2 91 HIS HB3 1.800 . 6.000 5.297 4.037 6.035 0.035 3 0 "[ . 1 . 2]" 1
2397 1 88 PHE QB 1 90 GLU H 1.800 . 7.000 4.848 3.302 5.961 . 0 0 "[ . 1 . 2]" 1
2398 2 88 PHE QB 2 90 GLU H 1.800 . 7.000 4.847 3.304 5.960 . 0 0 "[ . 1 . 2]" 1
2399 1 88 PHE QD 1 90 GLU H 1.800 . 8.400 5.299 4.222 6.968 . 0 0 "[ . 1 . 2]" 1
2400 2 88 PHE QD 2 90 GLU H 1.800 . 8.400 5.299 4.219 6.968 . 0 0 "[ . 1 . 2]" 1
2401 1 44 PHE QD 1 90 GLU H 1.800 . 8.400 6.236 4.597 7.658 . 0 0 "[ . 1 . 2]" 1
2402 2 44 PHE QD 2 90 GLU H 1.800 . 8.400 6.235 4.595 7.658 . 0 0 "[ . 1 . 2]" 1
2403 1 90 GLU HA 1 91 HIS H 1.800 . 3.500 3.154 2.202 3.575 0.075 10 0 "[ . 1 . 2]" 1
2404 2 90 GLU HA 2 91 HIS H 1.800 . 3.500 3.154 2.201 3.574 0.074 10 0 "[ . 1 . 2]" 1
2405 1 89 PHE H 1 91 HIS H 1.800 . 6.000 5.146 3.997 6.045 0.045 18 0 "[ . 1 . 2]" 1
2406 2 89 PHE H 2 91 HIS H 1.800 . 6.000 5.145 3.998 6.045 0.045 18 0 "[ . 1 . 2]" 1
2407 1 89 PHE QD 1 91 HIS H 1.800 . 8.400 5.967 4.642 7.273 . 0 0 "[ . 1 . 2]" 1
2408 2 89 PHE QD 2 91 HIS H 1.800 . 8.400 5.966 4.643 7.273 . 0 0 "[ . 1 . 2]" 1
2409 1 92 GLU H 1 92 GLU HB2 1.800 . 3.500 2.773 2.129 3.579 0.079 16 0 "[ . 1 . 2]" 1
2410 2 92 GLU H 2 92 GLU HB2 1.800 . 3.500 2.773 2.129 3.579 0.079 16 0 "[ . 1 . 2]" 1
2411 1 90 GLU H 1 92 GLU H 1.800 . 6.000 4.711 3.025 5.982 . 0 0 "[ . 1 . 2]" 1
2412 2 90 GLU H 2 92 GLU H 1.800 . 6.000 4.712 3.027 5.978 . 0 0 "[ . 1 . 2]" 1
2413 1 91 HIS H 1 92 GLU H 1.800 . 5.000 2.803 1.871 4.490 . 0 0 "[ . 1 . 2]" 1
2414 2 91 HIS H 2 92 GLU H 1.800 . 5.000 2.803 1.872 4.492 . 0 0 "[ . 1 . 2]" 1
2415 1 91 HIS HA 1 92 GLU H 1.800 . 3.500 3.023 2.245 3.539 0.039 14 0 "[ . 1 . 2]" 1
2416 2 91 HIS HA 2 92 GLU H 1.800 . 3.500 3.023 2.245 3.543 0.043 14 0 "[ . 1 . 2]" 1
2417 1 91 HIS HB3 1 92 GLU H 1.800 . 6.000 4.036 2.993 4.669 . 0 0 "[ . 1 . 2]" 1
2418 2 91 HIS HB3 2 92 GLU H 1.800 . 6.000 4.036 2.992 4.669 . 0 0 "[ . 1 . 2]" 1
2419 1 91 HIS HB2 1 92 GLU H 1.800 . 6.000 4.178 2.124 4.674 . 0 0 "[ . 1 . 2]" 1
2420 2 91 HIS HB2 2 92 GLU H 1.800 . 6.000 4.178 2.125 4.675 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 208
_Distance_constraint_stats_list.Viol_count 244
_Distance_constraint_stats_list.Viol_total 246.200
_Distance_constraint_stats_list.Viol_max 1.554
_Distance_constraint_stats_list.Viol_rms 0.0465
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0030
_Distance_constraint_stats_list.Viol_average_violations_only 0.0505
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.102 0.025 10 0 "[ . 1 . 2]"
1 3 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 GLU 0.069 0.025 10 0 "[ . 1 . 2]"
1 6 LYS 0.034 0.017 4 0 "[ . 1 . 2]"
1 7 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 MET 0.893 0.094 10 0 "[ . 1 . 2]"
1 9 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 LEU 0.128 0.069 19 0 "[ . 1 . 2]"
1 12 ILE 1.074 0.094 10 0 "[ . 1 . 2]"
1 13 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 PHE 0.128 0.069 19 0 "[ . 1 . 2]"
1 16 HIS 0.181 0.083 19 0 "[ . 1 . 2]"
1 17 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 SER 0.198 0.033 6 0 "[ . 1 . 2]"
1 27 LYS 0.198 0.033 6 0 "[ . 1 . 2]"
1 28 LEU 0.044 0.044 11 0 "[ . 1 . 2]"
1 29 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 LYS 0.266 0.098 13 0 "[ . 1 . 2]"
1 31 SER 0.005 0.004 9 0 "[ . 1 . 2]"
1 32 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 GLU 0.005 0.004 9 0 "[ . 1 . 2]"
1 36 LEU 0.417 0.090 2 0 "[ . 1 . 2]"
1 37 ILE 0.017 0.017 16 0 "[ . 1 . 2]"
1 38 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 GLU 0.417 0.090 2 0 "[ . 1 . 2]"
1 41 LEU 0.017 0.017 16 0 "[ . 1 . 2]"
1 50 GLU 3.090 1.554 16 1 "[ . 1 .+ 2]"
1 51 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 VAL 3.090 1.554 16 1 "[ . 1 .+ 2]"
1 54 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 THR 0.350 0.055 13 0 "[ . 1 . 2]"
1 61 LEU 0.332 0.121 13 0 "[ . 1 . 2]"
1 62 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 ASP 0.350 0.055 13 0 "[ . 1 . 2]"
1 65 GLY 0.332 0.121 13 0 "[ . 1 . 2]"
1 67 GLY 0.266 0.098 13 0 "[ . 1 . 2]"
1 69 CYS 0.044 0.044 11 0 "[ . 1 . 2]"
1 70 ASP 0.053 0.018 11 0 "[ . 1 . 2]"
1 71 PHE 0.016 0.016 15 0 "[ . 1 . 2]"
1 72 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 PHE 0.053 0.018 11 0 "[ . 1 . 2]"
1 75 MET 0.016 0.016 15 0 "[ . 1 . 2]"
1 76 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 PHE 0.068 0.027 20 0 "[ . 1 . 2]"
1 78 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 VAL 0.068 0.027 20 0 "[ . 1 . 2]"
1 82 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 2 SER 0.099 0.025 10 0 "[ . 1 . 2]"
2 3 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 4 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 5 GLU 0.070 0.025 10 0 "[ . 1 . 2]"
2 6 LYS 0.029 0.017 4 0 "[ . 1 . 2]"
2 7 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 8 MET 0.895 0.094 10 0 "[ . 1 . 2]"
2 9 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 10 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 11 LEU 0.128 0.070 19 0 "[ . 1 . 2]"
2 12 ILE 1.076 0.094 10 0 "[ . 1 . 2]"
2 13 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 14 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 15 PHE 0.128 0.070 19 0 "[ . 1 . 2]"
2 16 HIS 0.182 0.084 19 0 "[ . 1 . 2]"
2 17 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
2 18 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
2 19 SER 0.188 0.033 6 0 "[ . 1 . 2]"
2 27 LYS 0.188 0.033 6 0 "[ . 1 . 2]"
2 28 LEU 0.043 0.043 11 0 "[ . 1 . 2]"
2 29 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 30 LYS 0.254 0.097 13 0 "[ . 1 . 2]"
2 31 SER 0.006 0.006 9 0 "[ . 1 . 2]"
2 32 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 33 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 34 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 35 GLU 0.006 0.006 9 0 "[ . 1 . 2]"
2 36 LEU 0.420 0.090 2 0 "[ . 1 . 2]"
2 37 ILE 0.019 0.019 16 0 "[ . 1 . 2]"
2 38 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 39 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 40 GLU 0.420 0.090 2 0 "[ . 1 . 2]"
2 41 LEU 0.019 0.019 16 0 "[ . 1 . 2]"
2 50 GLU 3.095 1.554 16 1 "[ . 1 .+ 2]"
2 51 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
2 52 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 53 VAL 3.095 1.554 16 1 "[ . 1 .+ 2]"
2 54 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 55 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 56 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 57 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 58 MET 0.000 0.000 . 0 "[ . 1 . 2]"
2 59 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 60 THR 0.349 0.056 13 0 "[ . 1 . 2]"
2 61 LEU 0.329 0.119 13 0 "[ . 1 . 2]"
2 62 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 63 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 64 ASP 0.349 0.056 13 0 "[ . 1 . 2]"
2 65 GLY 0.329 0.119 13 0 "[ . 1 . 2]"
2 67 GLY 0.254 0.097 13 0 "[ . 1 . 2]"
2 69 CYS 0.043 0.043 11 0 "[ . 1 . 2]"
2 70 ASP 0.055 0.017 11 0 "[ . 1 . 2]"
2 71 PHE 0.017 0.017 15 0 "[ . 1 . 2]"
2 72 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
2 73 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 74 PHE 0.055 0.017 11 0 "[ . 1 . 2]"
2 75 MET 0.017 0.017 15 0 "[ . 1 . 2]"
2 76 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 77 PHE 0.071 0.028 20 0 "[ . 1 . 2]"
2 78 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 79 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 80 MET 0.000 0.000 . 0 "[ . 1 . 2]"
2 81 VAL 0.071 0.028 20 0 "[ . 1 . 2]"
2 82 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 83 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 84 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 SER O 1 6 LYS H 1.500 . 2.800 2.460 2.111 2.777 . 0 0 "[ . 1 . 2]" 2
2 2 2 SER O 2 6 LYS H 1.500 . 2.800 2.460 2.109 2.778 . 0 0 "[ . 1 . 2]" 2
3 1 2 SER O 1 6 LYS N 2.400 2.400 3.500 3.322 3.011 3.517 0.017 4 0 "[ . 1 . 2]" 2
4 2 2 SER O 2 6 LYS N 2.400 2.400 3.500 3.321 3.009 3.517 0.017 4 0 "[ . 1 . 2]" 2
5 1 3 GLU O 1 7 ALA H 1.500 . 2.800 2.187 2.062 2.646 . 0 0 "[ . 1 . 2]" 2
6 2 3 GLU O 2 7 ALA H 1.500 . 2.800 2.188 2.061 2.646 . 0 0 "[ . 1 . 2]" 2
7 1 3 GLU O 1 7 ALA N 2.400 2.400 3.500 3.044 2.891 3.484 . 0 0 "[ . 1 . 2]" 2
8 2 3 GLU O 2 7 ALA N 2.400 2.400 3.500 3.044 2.889 3.482 . 0 0 "[ . 1 . 2]" 2
9 1 4 LEU O 1 8 MET H 1.500 . 2.800 2.057 2.016 2.102 . 0 0 "[ . 1 . 2]" 2
10 2 4 LEU O 2 8 MET H 1.500 . 2.800 2.057 2.015 2.102 . 0 0 "[ . 1 . 2]" 2
11 1 4 LEU O 1 8 MET N 2.400 2.400 3.500 2.724 2.570 2.917 . 0 0 "[ . 1 . 2]" 2
12 2 4 LEU O 2 8 MET N 2.400 2.400 3.500 2.724 2.567 2.919 . 0 0 "[ . 1 . 2]" 2
13 1 5 GLU O 1 9 VAL H 1.500 . 2.800 2.385 2.046 2.736 . 0 0 "[ . 1 . 2]" 2
14 2 5 GLU O 2 9 VAL H 1.500 . 2.800 2.385 2.048 2.735 . 0 0 "[ . 1 . 2]" 2
15 1 5 GLU O 1 9 VAL N 2.400 2.400 3.500 3.141 2.789 3.474 . 0 0 "[ . 1 . 2]" 2
16 2 5 GLU O 2 9 VAL N 2.400 2.400 3.500 3.141 2.788 3.473 . 0 0 "[ . 1 . 2]" 2
17 1 6 LYS O 1 10 ALA H 1.500 . 2.800 2.404 2.137 2.705 . 0 0 "[ . 1 . 2]" 2
18 2 6 LYS O 2 10 ALA H 1.500 . 2.800 2.404 2.136 2.707 . 0 0 "[ . 1 . 2]" 2
19 1 6 LYS O 1 10 ALA N 2.400 2.400 3.500 3.103 2.872 3.383 . 0 0 "[ . 1 . 2]" 2
20 2 6 LYS O 2 10 ALA N 2.400 2.400 3.500 3.102 2.870 3.383 . 0 0 "[ . 1 . 2]" 2
21 1 7 ALA O 1 11 LEU H 1.500 . 2.800 2.148 2.069 2.328 . 0 0 "[ . 1 . 2]" 2
22 2 7 ALA O 2 11 LEU H 1.500 . 2.800 2.147 2.068 2.328 . 0 0 "[ . 1 . 2]" 2
23 1 7 ALA O 1 11 LEU N 2.400 2.400 3.500 3.039 2.932 3.198 . 0 0 "[ . 1 . 2]" 2
24 2 7 ALA O 2 11 LEU N 2.400 2.400 3.500 3.038 2.931 3.198 . 0 0 "[ . 1 . 2]" 2
25 1 8 MET O 1 12 ILE H 1.500 . 2.800 2.616 2.451 2.725 . 0 0 "[ . 1 . 2]" 2
26 2 8 MET O 2 12 ILE H 1.500 . 2.800 2.616 2.450 2.725 . 0 0 "[ . 1 . 2]" 2
27 1 8 MET O 1 12 ILE N 2.400 2.400 3.500 3.536 3.391 3.594 0.094 10 0 "[ . 1 . 2]" 2
28 2 8 MET O 2 12 ILE N 2.400 2.400 3.500 3.536 3.389 3.594 0.094 10 0 "[ . 1 . 2]" 2
29 1 9 VAL O 1 13 ASP H 1.500 . 2.800 2.423 2.088 2.693 . 0 0 "[ . 1 . 2]" 2
30 2 9 VAL O 2 13 ASP H 1.500 . 2.800 2.423 2.089 2.693 . 0 0 "[ . 1 . 2]" 2
31 1 9 VAL O 1 13 ASP N 2.400 2.400 3.500 3.277 2.943 3.487 . 0 0 "[ . 1 . 2]" 2
32 2 9 VAL O 2 13 ASP N 2.400 2.400 3.500 3.276 2.942 3.488 . 0 0 "[ . 1 . 2]" 2
33 1 10 ALA O 1 14 VAL H 1.500 . 2.800 2.345 2.205 2.474 . 0 0 "[ . 1 . 2]" 2
34 2 10 ALA O 2 14 VAL H 1.500 . 2.800 2.344 2.204 2.473 . 0 0 "[ . 1 . 2]" 2
35 1 10 ALA O 1 14 VAL N 2.400 2.400 3.500 3.253 3.147 3.397 . 0 0 "[ . 1 . 2]" 2
36 2 10 ALA O 2 14 VAL N 2.400 2.400 3.500 3.253 3.145 3.398 . 0 0 "[ . 1 . 2]" 2
37 1 11 LEU O 1 15 PHE H 1.500 . 2.800 2.491 2.070 2.683 . 0 0 "[ . 1 . 2]" 2
38 2 11 LEU O 2 15 PHE H 1.500 . 2.800 2.491 2.071 2.683 . 0 0 "[ . 1 . 2]" 2
39 1 11 LEU O 1 15 PHE N 2.400 2.400 3.500 3.389 2.990 3.569 0.069 19 0 "[ . 1 . 2]" 2
40 2 11 LEU O 2 15 PHE N 2.400 2.400 3.500 3.390 2.992 3.570 0.070 19 0 "[ . 1 . 2]" 2
41 1 12 ILE O 1 16 HIS H 1.500 . 2.800 2.505 2.095 2.703 . 0 0 "[ . 1 . 2]" 2
42 2 12 ILE O 2 16 HIS H 1.500 . 2.800 2.505 2.095 2.704 . 0 0 "[ . 1 . 2]" 2
43 1 12 ILE O 1 16 HIS N 2.400 2.400 3.500 3.400 3.014 3.583 0.083 19 0 "[ . 1 . 2]" 2
44 2 12 ILE O 2 16 HIS N 2.400 2.400 3.500 3.400 3.015 3.584 0.084 19 0 "[ . 1 . 2]" 2
45 1 13 ASP O 1 17 GLN H 1.500 . 2.800 2.313 2.098 2.624 . 0 0 "[ . 1 . 2]" 2
46 2 13 ASP O 2 17 GLN H 1.500 . 2.800 2.313 2.098 2.624 . 0 0 "[ . 1 . 2]" 2
47 1 13 ASP O 1 17 GLN N 2.400 2.400 3.500 3.023 2.628 3.332 . 0 0 "[ . 1 . 2]" 2
48 2 13 ASP O 2 17 GLN N 2.400 2.400 3.500 3.023 2.627 3.332 . 0 0 "[ . 1 . 2]" 2
49 1 14 VAL O 1 18 TYR H 1.500 . 2.800 2.194 2.080 2.659 . 0 0 "[ . 1 . 2]" 2
50 2 14 VAL O 2 18 TYR H 1.500 . 2.800 2.194 2.079 2.659 . 0 0 "[ . 1 . 2]" 2
51 1 14 VAL O 1 18 TYR N 2.400 2.400 3.500 3.077 2.763 3.490 . 0 0 "[ . 1 . 2]" 2
52 2 14 VAL O 2 18 TYR N 2.400 2.400 3.500 3.077 2.763 3.490 . 0 0 "[ . 1 . 2]" 2
53 1 19 SER OG 1 27 LYS H 1.500 . 2.800 2.686 2.336 2.828 0.028 7 0 "[ . 1 . 2]" 2
54 2 19 SER OG 2 27 LYS H 1.500 . 2.800 2.686 2.338 2.825 0.025 7 0 "[ . 1 . 2]" 2
55 1 19 SER OG 1 27 LYS N 2.400 2.400 3.500 3.352 2.982 3.533 0.033 6 0 "[ . 1 . 2]" 2
56 2 19 SER OG 2 27 LYS N 2.400 2.400 3.500 3.351 2.981 3.533 0.033 6 0 "[ . 1 . 2]" 2
57 1 29 LYS O 1 33 LEU H 1.500 . 2.800 2.174 2.008 2.594 . 0 0 "[ . 1 . 2]" 2
58 2 29 LYS O 2 33 LEU H 1.500 . 2.800 2.174 2.007 2.596 . 0 0 "[ . 1 . 2]" 2
59 1 29 LYS O 1 33 LEU N 2.400 2.400 3.500 2.907 2.764 3.269 . 0 0 "[ . 1 . 2]" 2
60 2 29 LYS O 2 33 LEU N 2.400 2.400 3.500 2.907 2.767 3.271 . 0 0 "[ . 1 . 2]" 2
61 1 30 LYS O 1 34 LYS H 1.500 . 2.800 2.096 2.052 2.210 . 0 0 "[ . 1 . 2]" 2
62 2 30 LYS O 2 34 LYS H 1.500 . 2.800 2.095 2.050 2.212 . 0 0 "[ . 1 . 2]" 2
63 1 30 LYS O 1 34 LYS N 2.400 2.400 3.500 2.983 2.866 3.153 . 0 0 "[ . 1 . 2]" 2
64 2 30 LYS O 2 34 LYS N 2.400 2.400 3.500 2.982 2.865 3.151 . 0 0 "[ . 1 . 2]" 2
65 1 31 SER O 1 35 GLU H 1.500 . 2.800 2.417 2.078 2.676 . 0 0 "[ . 1 . 2]" 2
66 2 31 SER O 2 35 GLU H 1.500 . 2.800 2.417 2.076 2.675 . 0 0 "[ . 1 . 2]" 2
67 1 31 SER O 1 35 GLU N 2.400 2.400 3.500 3.323 2.953 3.504 0.004 9 0 "[ . 1 . 2]" 2
68 2 31 SER O 2 35 GLU N 2.400 2.400 3.500 3.322 2.952 3.506 0.006 9 0 "[ . 1 . 2]" 2
69 1 32 GLU O 1 36 LEU H 1.500 . 2.800 2.073 2.042 2.110 . 0 0 "[ . 1 . 2]" 2
70 2 32 GLU O 2 36 LEU H 1.500 . 2.800 2.072 2.041 2.110 . 0 0 "[ . 1 . 2]" 2
71 1 32 GLU O 1 36 LEU N 2.400 2.400 3.500 2.881 2.777 2.988 . 0 0 "[ . 1 . 2]" 2
72 2 32 GLU O 2 36 LEU N 2.400 2.400 3.500 2.881 2.776 2.989 . 0 0 "[ . 1 . 2]" 2
73 1 33 LEU O 1 37 ILE H 1.500 . 2.800 2.172 2.076 2.358 . 0 0 "[ . 1 . 2]" 2
74 2 33 LEU O 2 37 ILE H 1.500 . 2.800 2.171 2.076 2.356 . 0 0 "[ . 1 . 2]" 2
75 1 33 LEU O 1 37 ILE N 2.400 2.400 3.500 3.090 3.001 3.247 . 0 0 "[ . 1 . 2]" 2
76 2 33 LEU O 2 37 ILE N 2.400 2.400 3.500 3.090 2.998 3.245 . 0 0 "[ . 1 . 2]" 2
77 1 34 LYS O 1 38 ASN H 1.500 . 2.800 2.137 2.011 2.333 . 0 0 "[ . 1 . 2]" 2
78 2 34 LYS O 2 38 ASN H 1.500 . 2.800 2.137 2.011 2.333 . 0 0 "[ . 1 . 2]" 2
79 1 34 LYS O 1 38 ASN N 2.400 2.400 3.500 3.061 2.896 3.276 . 0 0 "[ . 1 . 2]" 2
80 2 34 LYS O 2 38 ASN N 2.400 2.400 3.500 3.061 2.896 3.277 . 0 0 "[ . 1 . 2]" 2
81 1 35 GLU O 1 39 ASN H 1.500 . 2.800 2.107 2.032 2.308 . 0 0 "[ . 1 . 2]" 2
82 2 35 GLU O 2 39 ASN H 1.500 . 2.800 2.107 2.030 2.308 . 0 0 "[ . 1 . 2]" 2
83 1 35 GLU O 1 39 ASN N 2.400 2.400 3.500 2.608 2.461 2.868 . 0 0 "[ . 1 . 2]" 2
84 2 35 GLU O 2 39 ASN N 2.400 2.400 3.500 2.608 2.463 2.867 . 0 0 "[ . 1 . 2]" 2
85 1 36 LEU O 1 40 GLU H 1.500 . 2.800 2.610 2.302 2.866 0.066 6 0 "[ . 1 . 2]" 2
86 2 36 LEU O 2 40 GLU H 1.500 . 2.800 2.611 2.302 2.864 0.064 6 0 "[ . 1 . 2]" 2
87 1 36 LEU O 1 40 GLU N 2.400 2.400 3.500 3.397 3.165 3.590 0.090 2 0 "[ . 1 . 2]" 2
88 2 36 LEU O 2 40 GLU N 2.400 2.400 3.500 3.398 3.168 3.590 0.090 2 0 "[ . 1 . 2]" 2
89 1 37 ILE O 1 41 LEU H 1.500 . 2.800 2.390 2.002 2.817 0.017 16 0 "[ . 1 . 2]" 2
90 2 37 ILE O 2 41 LEU H 1.500 . 2.800 2.390 2.000 2.819 0.019 16 0 "[ . 1 . 2]" 2
91 1 37 ILE O 1 41 LEU N 2.400 2.400 3.500 2.919 2.609 3.334 . 0 0 "[ . 1 . 2]" 2
92 2 37 ILE O 2 41 LEU N 2.400 2.400 3.500 2.918 2.609 3.334 . 0 0 "[ . 1 . 2]" 2
93 1 50 GLU O 1 54 VAL H 1.500 . 2.800 2.202 2.059 2.352 . 0 0 "[ . 1 . 2]" 2
94 2 50 GLU O 2 54 VAL H 1.500 . 2.800 2.202 2.058 2.354 . 0 0 "[ . 1 . 2]" 2
95 1 50 GLU O 1 54 VAL N 2.400 2.400 3.500 3.144 2.753 3.281 . 0 0 "[ . 1 . 2]" 2
96 2 50 GLU O 2 54 VAL N 2.400 2.400 3.500 3.143 2.752 3.282 . 0 0 "[ . 1 . 2]" 2
97 1 51 GLN O 1 55 ASP H 1.500 . 2.800 2.212 2.092 2.691 . 0 0 "[ . 1 . 2]" 2
98 2 51 GLN O 2 55 ASP H 1.500 . 2.800 2.212 2.092 2.693 . 0 0 "[ . 1 . 2]" 2
99 1 51 GLN O 1 55 ASP N 2.400 2.400 3.500 2.955 2.879 3.251 . 0 0 "[ . 1 . 2]" 2
100 2 51 GLN O 2 55 ASP N 2.400 2.400 3.500 2.956 2.879 3.252 . 0 0 "[ . 1 . 2]" 2
101 1 52 GLU O 1 56 LYS H 1.500 . 2.800 2.126 2.072 2.294 . 0 0 "[ . 1 . 2]" 2
102 2 52 GLU O 2 56 LYS H 1.500 . 2.800 2.127 2.072 2.293 . 0 0 "[ . 1 . 2]" 2
103 1 52 GLU O 1 56 LYS N 2.400 2.400 3.500 2.808 2.666 3.126 . 0 0 "[ . 1 . 2]" 2
104 2 52 GLU O 2 56 LYS N 2.400 2.400 3.500 2.808 2.665 3.127 . 0 0 "[ . 1 . 2]" 2
105 1 53 VAL O 1 57 VAL H 1.500 . 2.800 2.278 2.100 2.505 . 0 0 "[ . 1 . 2]" 2
106 2 53 VAL O 2 57 VAL H 1.500 . 2.800 2.278 2.101 2.505 . 0 0 "[ . 1 . 2]" 2
107 1 53 VAL O 1 57 VAL N 2.400 2.400 3.500 3.240 3.077 3.424 . 0 0 "[ . 1 . 2]" 2
108 2 53 VAL O 2 57 VAL N 2.400 2.400 3.500 3.240 3.078 3.424 . 0 0 "[ . 1 . 2]" 2
109 1 54 VAL O 1 58 MET H 1.500 . 2.800 2.087 2.052 2.115 . 0 0 "[ . 1 . 2]" 2
110 2 54 VAL O 2 58 MET H 1.500 . 2.800 2.087 2.050 2.115 . 0 0 "[ . 1 . 2]" 2
111 1 54 VAL O 1 58 MET N 2.400 2.400 3.500 2.930 2.842 2.990 . 0 0 "[ . 1 . 2]" 2
112 2 54 VAL O 2 58 MET N 2.400 2.400 3.500 2.930 2.843 2.990 . 0 0 "[ . 1 . 2]" 2
113 1 55 ASP O 1 59 GLU H 1.500 . 2.800 2.337 2.086 2.582 . 0 0 "[ . 1 . 2]" 2
114 2 55 ASP O 2 59 GLU H 1.500 . 2.800 2.338 2.084 2.585 . 0 0 "[ . 1 . 2]" 2
115 1 55 ASP O 1 59 GLU N 2.400 2.400 3.500 2.965 2.746 3.139 . 0 0 "[ . 1 . 2]" 2
116 2 55 ASP O 2 59 GLU N 2.400 2.400 3.500 2.965 2.743 3.141 . 0 0 "[ . 1 . 2]" 2
117 1 56 LYS O 1 60 THR H 1.500 . 2.800 2.222 2.085 2.419 . 0 0 "[ . 1 . 2]" 2
118 2 56 LYS O 2 60 THR H 1.500 . 2.800 2.222 2.084 2.420 . 0 0 "[ . 1 . 2]" 2
119 1 56 LYS O 1 60 THR N 2.400 2.400 3.500 3.193 3.065 3.388 . 0 0 "[ . 1 . 2]" 2
120 2 56 LYS O 2 60 THR N 2.400 2.400 3.500 3.193 3.065 3.388 . 0 0 "[ . 1 . 2]" 2
121 1 57 VAL O 1 61 LEU H 1.500 . 2.800 2.142 2.065 2.316 . 0 0 "[ . 1 . 2]" 2
122 2 57 VAL O 2 61 LEU H 1.500 . 2.800 2.141 2.064 2.318 . 0 0 "[ . 1 . 2]" 2
123 1 57 VAL O 1 61 LEU N 2.400 2.400 3.500 2.963 2.872 3.073 . 0 0 "[ . 1 . 2]" 2
124 2 57 VAL O 2 61 LEU N 2.400 2.400 3.500 2.963 2.870 3.074 . 0 0 "[ . 1 . 2]" 2
125 1 58 MET O 1 62 ASP H 1.500 . 2.800 2.059 2.012 2.085 . 0 0 "[ . 1 . 2]" 2
126 2 58 MET O 2 62 ASP H 1.500 . 2.800 2.059 2.011 2.086 . 0 0 "[ . 1 . 2]" 2
127 1 58 MET O 1 62 ASP N 2.400 2.400 3.500 3.015 2.967 3.046 . 0 0 "[ . 1 . 2]" 2
128 2 58 MET O 2 62 ASP N 2.400 2.400 3.500 3.015 2.966 3.046 . 0 0 "[ . 1 . 2]" 2
129 1 59 GLU O 1 63 GLU H 1.500 . 2.800 2.108 2.057 2.241 . 0 0 "[ . 1 . 2]" 2
130 2 59 GLU O 2 63 GLU H 1.500 . 2.800 2.108 2.059 2.240 . 0 0 "[ . 1 . 2]" 2
131 1 59 GLU O 1 63 GLU N 2.400 2.400 3.500 2.701 2.565 2.852 . 0 0 "[ . 1 . 2]" 2
132 2 59 GLU O 2 63 GLU N 2.400 2.400 3.500 2.701 2.565 2.853 . 0 0 "[ . 1 . 2]" 2
133 1 70 ASP O 1 74 PHE H 1.500 . 2.800 2.280 2.044 2.602 . 0 0 "[ . 1 . 2]" 2
134 2 70 ASP O 2 74 PHE H 1.500 . 2.800 2.280 2.045 2.602 . 0 0 "[ . 1 . 2]" 2
135 1 70 ASP O 1 74 PHE N 2.400 2.400 3.500 3.227 2.945 3.518 0.018 11 0 "[ . 1 . 2]" 2
136 2 70 ASP O 2 74 PHE N 2.400 2.400 3.500 3.228 2.946 3.517 0.017 11 0 "[ . 1 . 2]" 2
137 1 71 PHE O 1 75 MET H 1.500 . 2.800 2.400 2.069 2.816 0.016 15 0 "[ . 1 . 2]" 2
138 2 71 PHE O 2 75 MET H 1.500 . 2.800 2.400 2.068 2.817 0.017 15 0 "[ . 1 . 2]" 2
139 1 71 PHE O 1 75 MET N 2.400 2.400 3.500 3.120 2.834 3.469 . 0 0 "[ . 1 . 2]" 2
140 2 71 PHE O 2 75 MET N 2.400 2.400 3.500 3.120 2.833 3.468 . 0 0 "[ . 1 . 2]" 2
141 1 72 GLN O 1 76 ALA H 1.500 . 2.800 2.084 2.042 2.152 . 0 0 "[ . 1 . 2]" 2
142 2 72 GLN O 2 76 ALA H 1.500 . 2.800 2.084 2.041 2.150 . 0 0 "[ . 1 . 2]" 2
143 1 72 GLN O 1 76 ALA N 2.400 2.400 3.500 3.040 2.956 3.114 . 0 0 "[ . 1 . 2]" 2
144 2 72 GLN O 2 76 ALA N 2.400 2.400 3.500 3.039 2.953 3.112 . 0 0 "[ . 1 . 2]" 2
145 1 73 GLU O 1 77 PHE H 1.500 . 2.800 2.111 2.028 2.303 . 0 0 "[ . 1 . 2]" 2
146 2 73 GLU O 2 77 PHE H 1.500 . 2.800 2.111 2.028 2.301 . 0 0 "[ . 1 . 2]" 2
147 1 73 GLU O 1 77 PHE N 2.400 2.400 3.500 2.867 2.791 2.995 . 0 0 "[ . 1 . 2]" 2
148 2 73 GLU O 2 77 PHE N 2.400 2.400 3.500 2.867 2.791 2.993 . 0 0 "[ . 1 . 2]" 2
149 1 74 PHE O 1 78 VAL H 1.500 . 2.800 2.288 2.102 2.592 . 0 0 "[ . 1 . 2]" 2
150 2 74 PHE O 2 78 VAL H 1.500 . 2.800 2.288 2.103 2.592 . 0 0 "[ . 1 . 2]" 2
151 1 74 PHE O 1 78 VAL N 2.400 2.400 3.500 3.150 2.899 3.402 . 0 0 "[ . 1 . 2]" 2
152 2 74 PHE O 2 78 VAL N 2.400 2.400 3.500 3.150 2.899 3.403 . 0 0 "[ . 1 . 2]" 2
153 1 75 MET O 1 79 SER H 1.500 . 2.800 2.447 2.212 2.608 . 0 0 "[ . 1 . 2]" 2
154 2 75 MET O 2 79 SER H 1.500 . 2.800 2.447 2.211 2.607 . 0 0 "[ . 1 . 2]" 2
155 1 75 MET O 1 79 SER N 2.400 2.400 3.500 3.313 3.099 3.446 . 0 0 "[ . 1 . 2]" 2
156 2 75 MET O 2 79 SER N 2.400 2.400 3.500 3.313 3.099 3.444 . 0 0 "[ . 1 . 2]" 2
157 1 76 ALA O 1 80 MET H 1.500 . 2.800 2.389 2.097 2.744 . 0 0 "[ . 1 . 2]" 2
158 2 76 ALA O 2 80 MET H 1.500 . 2.800 2.389 2.097 2.741 . 0 0 "[ . 1 . 2]" 2
159 1 76 ALA O 1 80 MET N 2.400 2.400 3.500 3.318 3.039 3.495 . 0 0 "[ . 1 . 2]" 2
160 2 76 ALA O 2 80 MET N 2.400 2.400 3.500 3.317 3.038 3.492 . 0 0 "[ . 1 . 2]" 2
161 1 77 PHE O 1 81 VAL H 1.500 . 2.800 2.505 2.309 2.614 . 0 0 "[ . 1 . 2]" 2
162 2 77 PHE O 2 81 VAL H 1.500 . 2.800 2.505 2.309 2.613 . 0 0 "[ . 1 . 2]" 2
163 1 77 PHE O 1 81 VAL N 2.400 2.400 3.500 3.458 3.288 3.527 0.027 20 0 "[ . 1 . 2]" 2
164 2 77 PHE O 2 81 VAL N 2.400 2.400 3.500 3.458 3.286 3.528 0.028 20 0 "[ . 1 . 2]" 2
165 1 78 VAL O 1 82 THR H 1.500 . 2.800 2.271 2.102 2.568 . 0 0 "[ . 1 . 2]" 2
166 2 78 VAL O 2 82 THR H 1.500 . 2.800 2.270 2.103 2.566 . 0 0 "[ . 1 . 2]" 2
167 1 78 VAL O 1 82 THR N 2.400 2.400 3.500 3.172 3.011 3.434 . 0 0 "[ . 1 . 2]" 2
168 2 78 VAL O 2 82 THR N 2.400 2.400 3.500 3.171 3.011 3.433 . 0 0 "[ . 1 . 2]" 2
169 1 79 SER O 1 83 THR H 1.500 . 2.800 2.437 2.086 2.745 . 0 0 "[ . 1 . 2]" 2
170 2 79 SER O 2 83 THR H 1.500 . 2.800 2.437 2.086 2.748 . 0 0 "[ . 1 . 2]" 2
171 1 79 SER O 1 83 THR N 2.400 2.400 3.500 3.030 2.673 3.366 . 0 0 "[ . 1 . 2]" 2
172 2 79 SER O 2 83 THR N 2.400 2.400 3.500 3.029 2.673 3.367 . 0 0 "[ . 1 . 2]" 2
173 1 80 MET O 1 84 ALA H 1.500 . 2.800 2.392 2.094 2.759 . 0 0 "[ . 1 . 2]" 2
174 2 80 MET O 2 84 ALA H 1.500 . 2.800 2.392 2.093 2.758 . 0 0 "[ . 1 . 2]" 2
175 1 80 MET O 1 84 ALA N 2.400 2.400 3.500 2.874 2.574 3.312 . 0 0 "[ . 1 . 2]" 2
176 2 80 MET O 2 84 ALA N 2.400 2.400 3.500 2.874 2.575 3.312 . 0 0 "[ . 1 . 2]" 2
177 1 28 LEU O 1 69 CYS H 1.500 . 2.800 2.128 2.009 2.371 . 0 0 "[ . 1 . 2]" 2
178 2 28 LEU O 2 69 CYS H 1.500 . 2.800 2.128 2.010 2.371 . 0 0 "[ . 1 . 2]" 2
179 1 28 LEU O 1 69 CYS N 2.400 2.400 3.500 3.036 2.607 3.242 . 0 0 "[ . 1 . 2]" 2
180 2 28 LEU O 2 69 CYS N 2.400 2.400 3.500 3.036 2.608 3.241 . 0 0 "[ . 1 . 2]" 2
181 1 28 LEU H 1 69 CYS O 1.500 . 2.800 2.337 2.090 2.773 . 0 0 "[ . 1 . 2]" 2
182 2 28 LEU H 2 69 CYS O 1.500 . 2.800 2.337 2.090 2.771 . 0 0 "[ . 1 . 2]" 2
183 1 28 LEU N 1 69 CYS O 2.400 2.400 3.500 3.172 2.932 3.544 0.044 11 0 "[ . 1 . 2]" 2
184 2 28 LEU N 2 69 CYS O 2.400 2.400 3.500 3.172 2.929 3.543 0.043 11 0 "[ . 1 . 2]" 2
185 1 30 LYS H 1 67 GLY O 1.500 . 2.800 2.521 2.109 2.814 0.014 13 0 "[ . 1 . 2]" 2
186 2 30 LYS H 2 67 GLY O 1.500 . 2.800 2.520 2.109 2.813 0.013 13 0 "[ . 1 . 2]" 2
187 1 30 LYS N 1 67 GLY O 2.400 2.400 3.500 3.354 3.003 3.598 0.098 13 0 "[ . 1 . 2]" 2
188 2 30 LYS N 2 67 GLY O 2.400 2.400 3.500 3.353 3.004 3.597 0.097 13 0 "[ . 1 . 2]" 2
189 1 2 SER OG 1 5 GLU H 1.500 . 2.800 2.265 2.082 2.599 . 0 0 "[ . 1 . 2]" 2
190 2 2 SER OG 2 5 GLU H 1.500 . 2.800 2.264 2.082 2.599 . 0 0 "[ . 1 . 2]" 2
191 1 2 SER OG 1 5 GLU N 2.400 2.400 3.500 3.136 2.832 3.433 . 0 0 "[ . 1 . 2]" 2
192 2 2 SER OG 2 5 GLU N 2.400 2.400 3.500 3.135 2.829 3.433 . 0 0 "[ . 1 . 2]" 2
193 1 2 SER H 1 5 GLU OE1 1.500 . 2.800 2.530 2.144 2.806 0.006 11 0 "[ . 1 . 2]" 2
194 2 2 SER H 2 5 GLU OE1 1.500 . 2.800 2.529 2.147 2.807 0.007 11 0 "[ . 1 . 2]" 2
195 1 2 SER N 1 5 GLU OE1 2.400 2.400 3.500 3.379 3.048 3.525 0.025 10 0 "[ . 1 . 2]" 2
196 2 2 SER N 2 5 GLU OE1 2.400 2.400 3.500 3.379 3.046 3.525 0.025 10 0 "[ . 1 . 2]" 2
197 1 50 GLU OE1 1 53 VAL H 1.500 . 2.800 2.772 2.244 4.196 1.396 16 1 "[ . 1 .+ 2]" 2
198 2 50 GLU OE1 2 53 VAL H 1.500 . 2.800 2.771 2.243 4.197 1.397 16 1 "[ . 1 .+ 2]" 2
199 1 50 GLU OE1 1 53 VAL N 2.400 2.400 3.500 3.541 3.080 5.054 1.554 16 1 "[ . 1 .+ 2]" 2
200 2 50 GLU OE1 2 53 VAL N 2.400 2.400 3.500 3.541 3.081 5.054 1.554 16 1 "[ . 1 .+ 2]" 2
201 1 60 THR O 1 64 ASP H 1.500 . 2.800 2.557 2.286 2.773 . 0 0 "[ . 1 . 2]" 2
202 2 60 THR O 2 64 ASP H 1.500 . 2.800 2.557 2.286 2.772 . 0 0 "[ . 1 . 2]" 2
203 1 60 THR O 1 64 ASP N 2.400 2.400 3.500 3.464 3.227 3.555 0.055 13 0 "[ . 1 . 2]" 2
204 2 60 THR O 2 64 ASP N 2.400 2.400 3.500 3.464 3.225 3.556 0.056 13 0 "[ . 1 . 2]" 2
205 1 61 LEU O 1 65 GLY H 1.500 . 2.800 2.779 2.629 2.838 0.038 5 0 "[ . 1 . 2]" 2
206 2 61 LEU O 2 65 GLY H 1.500 . 2.800 2.779 2.627 2.835 0.035 5 0 "[ . 1 . 2]" 2
207 1 61 LEU O 1 65 GLY N 2.400 2.400 3.500 3.233 2.858 3.621 0.121 13 0 "[ . 1 . 2]" 2
208 2 61 LEU O 2 65 GLY N 2.400 2.400 3.500 3.233 2.858 3.619 0.119 13 0 "[ . 1 . 2]" 2
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