NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
505983 |
1wep   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wep
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 28
_Distance_constraint_stats_list.Viol_count 332
_Distance_constraint_stats_list.Viol_total 95.771
_Distance_constraint_stats_list.Viol_max 0.055
_Distance_constraint_stats_list.Viol_rms 0.0109
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0086
_Distance_constraint_stats_list.Viol_average_violations_only 0.0144
_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 15 CYS 0.556 0.047 6 0 "[ . 1 . 2]"
1 17 CYS 1.236 0.055 12 0 "[ . 1 . 2]"
1 30 CYS 0.930 0.042 17 0 "[ . 1 . 2]"
1 33 CYS 0.417 0.025 20 0 "[ . 1 . 2]"
1 38 HIS 0.615 0.033 7 0 "[ . 1 . 2]"
1 41 CYS 0.870 0.042 12 0 "[ . 1 . 2]"
1 57 CYS 0.395 0.021 20 0 "[ . 1 . 2]"
1 60 CYS 1.250 0.042 17 0 "[ . 1 . 2]"
2 1 ZN 1.991 0.055 12 0 "[ . 1 . 2]"
3 1 ZN 1.318 0.036 17 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 15 CYS SG 2 1 ZN ZN . 2.330 2.330 2.312 2.283 2.334 0.047 6 0 "[ . 1 . 2]" 1
2 1 17 CYS SG 2 1 ZN ZN . 2.330 2.330 2.301 2.275 2.321 0.055 12 0 "[ . 1 . 2]" 1
3 1 41 CYS SG 2 1 ZN ZN . 2.330 2.330 2.312 2.288 2.333 0.042 12 0 "[ . 1 . 2]" 1
4 1 38 HIS ND1 2 1 ZN ZN . 2.330 2.330 2.318 2.307 2.328 0.023 7 0 "[ . 1 . 2]" 1
5 1 15 CYS CB 2 1 ZN ZN . 3.250 3.510 3.425 3.248 3.537 0.027 6 0 "[ . 1 . 2]" 1
6 1 17 CYS CB 2 1 ZN ZN . 3.250 3.510 3.508 3.342 3.532 0.022 11 0 "[ . 1 . 2]" 1
7 1 38 HIS CG 2 1 ZN ZN . 3.250 3.510 3.273 3.231 3.453 0.019 14 0 "[ . 1 . 2]" 1
8 1 41 CYS CB 2 1 ZN ZN . 3.250 3.510 3.302 3.237 3.512 0.013 18 0 "[ . 1 . 2]" 1
9 1 15 CYS SG 1 17 CYS SG . 3.200 4.000 3.709 3.434 4.015 0.015 14 0 "[ . 1 . 2]" 1
10 1 15 CYS SG 1 38 HIS ND1 . 3.200 4.000 3.357 3.198 3.599 0.002 5 0 "[ . 1 . 2]" 1
11 1 15 CYS SG 1 41 CYS SG . 3.200 4.000 3.863 3.313 4.007 0.007 2 0 "[ . 1 . 2]" 1
12 1 17 CYS SG 1 38 HIS ND1 . 3.200 4.000 3.689 3.402 4.033 0.033 7 0 "[ . 1 . 2]" 1
13 1 17 CYS SG 1 41 CYS SG . 3.200 4.000 3.815 3.196 4.034 0.034 12 0 "[ . 1 . 2]" 1
14 1 38 HIS ND1 1 41 CYS SG . 3.200 4.000 3.990 3.847 4.022 0.022 16 0 "[ . 1 . 2]" 1
15 1 30 CYS SG 3 1 ZN ZN . 2.330 2.330 2.314 2.301 2.325 0.029 11 0 "[ . 1 . 2]" 1
16 1 33 CYS SG 3 1 ZN ZN . 2.330 2.330 2.324 2.305 2.339 0.025 20 0 "[ . 1 . 2]" 1
17 1 57 CYS SG 3 1 ZN ZN . 2.330 2.330 2.320 2.309 2.328 0.021 20 0 "[ . 1 . 2]" 1
18 1 60 CYS SG 3 1 ZN ZN . 2.330 2.330 2.314 2.294 2.326 0.036 17 0 "[ . 1 . 2]" 1
19 1 30 CYS CB 3 1 ZN ZN . 3.250 3.510 3.417 3.273 3.530 0.020 7 0 "[ . 1 . 2]" 1
20 1 33 CYS CB 3 1 ZN ZN . 3.250 3.510 3.387 3.264 3.510 0.000 3 0 "[ . 1 . 2]" 1
21 1 57 CYS CB 3 1 ZN ZN . 3.250 3.510 3.282 3.248 3.331 0.002 15 0 "[ . 1 . 2]" 1
22 1 60 CYS CB 3 1 ZN ZN . 3.250 3.510 3.516 3.457 3.544 0.034 13 0 "[ . 1 . 2]" 1
23 1 30 CYS SG 1 33 CYS SG . 3.200 4.000 3.712 3.348 4.003 0.003 6 0 "[ . 1 . 2]" 1
24 1 30 CYS SG 1 57 CYS SG . 3.200 4.000 3.933 3.865 4.001 0.001 18 0 "[ . 1 . 2]" 1
25 1 30 CYS SG 1 60 CYS SG . 3.200 4.000 4.026 4.011 4.042 0.042 17 0 "[ . 1 . 2]" 1
26 1 33 CYS SG 1 57 CYS SG . 3.200 4.000 3.978 3.866 4.021 0.021 11 0 "[ . 1 . 2]" 1
27 1 33 CYS SG 1 60 CYS SG . 3.200 4.000 3.671 3.179 4.004 0.021 13 0 "[ . 1 . 2]" 1
28 1 57 CYS SG 1 60 CYS SG . 3.200 4.000 3.201 3.194 3.229 0.006 9 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 1690
_Distance_constraint_stats_list.Viol_count 1345
_Distance_constraint_stats_list.Viol_total 859.922
_Distance_constraint_stats_list.Viol_max 0.401
_Distance_constraint_stats_list.Viol_rms 0.0101
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0013
_Distance_constraint_stats_list.Viol_average_violations_only 0.0320
_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 8 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ALA 0.978 0.270 12 0 "[ . 1 . 2]"
1 10 LEU 1.364 0.270 12 0 "[ . 1 . 2]"
1 11 VAL 0.913 0.401 15 0 "[ . 1 . 2]"
1 12 PRO 1.041 0.152 15 0 "[ . 1 . 2]"
1 13 VAL 3.243 0.193 13 0 "[ . 1 . 2]"
1 14 TYR 4.085 0.143 13 0 "[ . 1 . 2]"
1 15 CYS 0.136 0.031 16 0 "[ . 1 . 2]"
1 16 LEU 1.238 0.072 16 0 "[ . 1 . 2]"
1 17 CYS 0.408 0.065 14 0 "[ . 1 . 2]"
1 18 ARG 0.697 0.064 19 0 "[ . 1 . 2]"
1 19 GLN 1.937 0.193 13 0 "[ . 1 . 2]"
1 20 PRO 2.614 0.401 15 0 "[ . 1 . 2]"
1 21 TYR 2.093 0.292 19 0 "[ . 1 . 2]"
1 22 ASN 0.501 0.243 9 0 "[ . 1 . 2]"
1 23 VAL 0.642 0.227 20 0 "[ . 1 . 2]"
1 24 ASN 0.754 0.243 9 0 "[ . 1 . 2]"
1 25 HIS 0.637 0.185 9 0 "[ . 1 . 2]"
1 26 PHE 0.845 0.185 19 0 "[ . 1 . 2]"
1 27 MET 3.226 0.108 9 0 "[ . 1 . 2]"
1 28 ILE 2.714 0.158 1 0 "[ . 1 . 2]"
1 29 GLU 0.844 0.158 1 0 "[ . 1 . 2]"
1 30 CYS 0.127 0.039 3 0 "[ . 1 . 2]"
1 31 GLY 1.333 0.067 13 0 "[ . 1 . 2]"
1 32 LEU 1.148 0.082 14 0 "[ . 1 . 2]"
1 33 CYS 0.224 0.042 17 0 "[ . 1 . 2]"
1 34 GLN 0.989 0.062 4 0 "[ . 1 . 2]"
1 35 ASP 0.203 0.103 13 0 "[ . 1 . 2]"
1 36 TRP 1.114 0.102 9 0 "[ . 1 . 2]"
1 37 PHE 0.454 0.097 16 0 "[ . 1 . 2]"
1 38 HIS 0.359 0.103 19 0 "[ . 1 . 2]"
1 39 GLY 0.843 0.121 18 0 "[ . 1 . 2]"
1 40 SER 0.024 0.024 13 0 "[ . 1 . 2]"
1 41 CYS 0.390 0.072 16 0 "[ . 1 . 2]"
1 42 VAL 0.263 0.033 7 0 "[ . 1 . 2]"
1 43 GLY 0.025 0.024 13 0 "[ . 1 . 2]"
1 44 ILE 0.899 0.087 16 0 "[ . 1 . 2]"
1 45 GLU 0.942 0.104 5 0 "[ . 1 . 2]"
1 46 GLU 0.283 0.043 3 0 "[ . 1 . 2]"
1 47 GLU 0.124 0.055 3 0 "[ . 1 . 2]"
1 48 ASN 0.113 0.042 5 0 "[ . 1 . 2]"
1 49 ALA 0.229 0.030 20 0 "[ . 1 . 2]"
1 50 VAL 0.413 0.096 20 0 "[ . 1 . 2]"
1 51 ASP 0.100 0.061 19 0 "[ . 1 . 2]"
1 52 ILE 1.778 0.082 16 0 "[ . 1 . 2]"
1 53 ASP 2.359 0.096 6 0 "[ . 1 . 2]"
1 54 ILE 2.440 0.100 16 0 "[ . 1 . 2]"
1 55 TYR 1.407 0.067 13 0 "[ . 1 . 2]"
1 56 HIS 1.379 0.061 7 0 "[ . 1 . 2]"
1 57 CYS 0.882 0.109 13 0 "[ . 1 . 2]"
1 58 PRO 0.686 0.051 3 0 "[ . 1 . 2]"
1 59 ASP 2.764 0.133 12 0 "[ . 1 . 2]"
1 60 CYS 4.046 0.133 12 0 "[ . 1 . 2]"
1 61 GLU 0.733 0.051 3 0 "[ . 1 . 2]"
1 62 ALA 0.980 0.090 16 0 "[ . 1 . 2]"
1 63 VAL 0.927 0.058 1 0 "[ . 1 . 2]"
1 64 PHE 0.979 0.051 5 0 "[ . 1 . 2]"
1 65 GLY 0.534 0.090 16 0 "[ . 1 . 2]"
1 66 PRO 1.354 0.103 15 0 "[ . 1 . 2]"
1 67 SER 1.352 0.103 15 0 "[ . 1 . 2]"
1 68 ILE 0.456 0.063 10 0 "[ . 1 . 2]"
1 69 MET 1.516 0.187 10 0 "[ . 1 . 2]"
1 70 LYS 6.280 0.380 20 0 "[ . 1 . 2]"
1 71 ASN 2.357 0.313 17 0 "[ . 1 . 2]"
1 72 TRP 4.972 0.380 20 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 29 GLU H 1 29 GLU HB3 . . 3.380 2.713 2.627 2.840 . 0 0 "[ . 1 . 2]" 2
2 1 29 GLU H 1 29 GLU HB2 . . 3.820 3.165 3.023 3.313 . 0 0 "[ . 1 . 2]" 2
3 1 29 GLU HG3 1 36 TRP HE1 . . 4.310 3.249 2.640 3.816 . 0 0 "[ . 1 . 2]" 2
4 1 55 TYR H 1 55 TYR HB2 . . 3.600 2.904 2.806 3.023 . 0 0 "[ . 1 . 2]" 2
5 1 15 CYS HB3 1 16 LEU H . . 4.500 3.088 2.798 3.404 . 0 0 "[ . 1 . 2]" 2
6 1 53 ASP H 1 69 MET HA . . 3.750 1.983 1.865 2.146 . 0 0 "[ . 1 . 2]" 2
7 1 27 MET H 1 27 MET HB2 . . 3.710 2.736 2.559 2.956 . 0 0 "[ . 1 . 2]" 2
8 1 27 MET H 1 27 MET HB3 . . 3.930 3.755 3.637 3.901 . 0 0 "[ . 1 . 2]" 2
9 1 69 MET H 1 69 MET HG3 . . 3.840 3.364 3.101 3.938 0.098 10 0 "[ . 1 . 2]" 2
10 1 69 MET H 1 69 MET HB3 . . 3.900 3.775 3.686 3.833 . 0 0 "[ . 1 . 2]" 2
11 1 26 PHE QD 1 27 MET H . . 3.900 2.833 1.898 3.388 . 0 0 "[ . 1 . 2]" 2
12 1 26 PHE HA 1 27 MET H . . 3.140 2.275 2.222 2.343 . 0 0 "[ . 1 . 2]" 2
13 1 56 HIS H 1 67 SER H . . 5.060 4.673 4.455 4.968 . 0 0 "[ . 1 . 2]" 2
14 1 56 HIS H 1 68 ILE H . . 5.490 4.840 4.533 5.127 . 0 0 "[ . 1 . 2]" 2
15 1 56 HIS H 1 67 SER HG . . 4.140 3.306 1.893 4.154 0.014 15 0 "[ . 1 . 2]" 2
16 1 55 TYR HA 1 56 HIS H . . 3.280 2.201 2.168 2.236 . 0 0 "[ . 1 . 2]" 2
17 1 55 TYR HB2 1 56 HIS H . . 4.170 3.855 3.823 3.896 . 0 0 "[ . 1 . 2]" 2
18 1 56 HIS H 1 56 HIS HB2 . . 3.690 2.468 2.397 2.497 . 0 0 "[ . 1 . 2]" 2
19 1 56 HIS H 1 56 HIS HB3 . . 4.200 3.651 3.563 3.688 . 0 0 "[ . 1 . 2]" 2
20 1 52 ILE MG 1 56 HIS H . . 4.130 3.853 3.646 4.013 . 0 0 "[ . 1 . 2]" 2
21 1 56 HIS HB3 1 57 CYS H . . 4.310 3.687 3.609 3.764 . 0 0 "[ . 1 . 2]" 2
22 1 57 CYS H 1 57 CYS HB2 . . 4.020 3.559 3.555 3.569 . 0 0 "[ . 1 . 2]" 2
23 1 45 GLU HB2 1 46 GLU H . . 4.230 4.005 3.808 4.240 0.010 18 0 "[ . 1 . 2]" 2
24 1 60 CYS H 1 61 GLU H . . 3.450 2.194 2.141 2.270 . 0 0 "[ . 1 . 2]" 2
25 1 57 CYS H 1 60 CYS H . . 4.260 4.295 4.205 4.369 0.109 13 0 "[ . 1 . 2]" 2
26 1 59 ASP H 1 60 CYS H . . 3.480 2.004 1.975 2.046 . 0 0 "[ . 1 . 2]" 2
27 1 60 CYS H 1 60 CYS HB2 . . 2.950 2.481 2.426 2.523 . 0 0 "[ . 1 . 2]" 2
28 1 44 ILE HA 1 45 GLU H . . 3.090 2.183 2.140 2.278 . 0 0 "[ . 1 . 2]" 2
29 1 38 HIS H 1 38 HIS HB2 . . 4.030 2.431 2.382 2.512 . 0 0 "[ . 1 . 2]" 2
30 1 37 PHE HB3 1 38 HIS H . . 4.150 2.509 2.199 3.121 . 0 0 "[ . 1 . 2]" 2
31 1 15 CYS HB2 1 38 HIS H . . 4.000 3.539 2.483 4.002 0.002 19 0 "[ . 1 . 2]" 2
32 1 25 HIS HA 1 26 PHE H . . 3.350 2.344 2.140 3.535 0.185 19 0 "[ . 1 . 2]" 2
33 1 67 SER HB2 1 68 ILE H . . 4.100 3.325 2.801 4.026 . 0 0 "[ . 1 . 2]" 2
34 1 54 ILE HB 1 68 ILE H . . 3.620 2.793 2.499 3.026 . 0 0 "[ . 1 . 2]" 2
35 1 47 GLU H 1 49 ALA H . . 4.560 4.045 3.887 4.203 . 0 0 "[ . 1 . 2]" 2
36 1 45 GLU HB3 1 49 ALA H . . 5.500 4.931 4.661 5.132 . 0 0 "[ . 1 . 2]" 2
37 1 48 ASN H 1 49 ALA H . . 3.080 2.265 2.171 2.354 . 0 0 "[ . 1 . 2]" 2
38 1 49 ALA H 1 50 VAL H . . 3.370 2.908 2.703 3.017 . 0 0 "[ . 1 . 2]" 2
39 1 48 ASN HB3 1 49 ALA H . . 4.270 3.706 3.489 3.957 . 0 0 "[ . 1 . 2]" 2
40 1 48 ASN HB2 1 49 ALA H . . 4.270 2.889 2.689 3.021 . 0 0 "[ . 1 . 2]" 2
41 1 22 ASN HA 1 23 VAL H . . 3.420 2.218 2.139 2.436 . 0 0 "[ . 1 . 2]" 2
42 1 58 PRO HA 1 61 GLU H . . 4.010 3.718 3.648 3.791 . 0 0 "[ . 1 . 2]" 2
43 1 61 GLU H 1 61 GLU HB2 . . 3.270 2.671 2.574 2.733 . 0 0 "[ . 1 . 2]" 2
44 1 31 GLY H 1 32 LEU H . . 3.850 2.909 2.796 3.018 . 0 0 "[ . 1 . 2]" 2
45 1 30 CYS HB3 1 32 LEU H . . 4.360 3.382 3.336 3.469 . 0 0 "[ . 1 . 2]" 2
46 1 20 PRO HG2 1 21 TYR H . . 3.510 1.817 1.745 1.856 . 0 0 "[ . 1 . 2]" 2
47 1 10 LEU HB2 1 11 VAL H . . 4.500 3.804 2.226 4.523 0.023 11 0 "[ . 1 . 2]" 2
48 1 10 LEU HG 1 11 VAL H . . 5.060 4.617 3.843 5.065 0.005 10 0 "[ . 1 . 2]" 2
49 1 10 LEU H 1 11 VAL H . . 4.670 4.339 4.132 4.596 . 0 0 "[ . 1 . 2]" 2
50 1 21 TYR H 1 21 TYR HB2 . . 3.950 3.649 3.402 3.773 . 0 0 "[ . 1 . 2]" 2
51 1 52 ILE H 1 52 ILE HB . . 3.080 2.489 2.446 2.569 . 0 0 "[ . 1 . 2]" 2
52 1 51 ASP H 1 52 ILE H . . 3.370 2.126 2.039 2.185 . 0 0 "[ . 1 . 2]" 2
53 1 49 ALA HA 1 52 ILE H . . 3.750 2.947 2.841 3.229 . 0 0 "[ . 1 . 2]" 2
54 1 51 ASP HB2 1 52 ILE H . . 4.330 3.222 3.003 4.083 . 0 0 "[ . 1 . 2]" 2
55 1 52 ILE H 1 52 ILE HG13 . . 3.250 2.310 2.139 2.538 . 0 0 "[ . 1 . 2]" 2
56 1 10 LEU H 1 10 LEU HB2 . . 3.830 3.015 2.234 3.812 . 0 0 "[ . 1 . 2]" 2
57 1 72 TRP H 1 72 TRP HD1 . . 4.400 2.770 1.942 3.825 . 0 0 "[ . 1 . 2]" 2
58 1 71 ASN HA 1 72 TRP H . . 3.550 2.801 2.463 3.546 . 0 0 "[ . 1 . 2]" 2
59 1 72 TRP H 1 72 TRP HB3 . . 3.880 3.580 3.275 3.967 0.087 1 0 "[ . 1 . 2]" 2
60 1 72 TRP H 1 72 TRP HB2 . . 3.880 3.092 2.454 4.019 0.139 11 0 "[ . 1 . 2]" 2
61 1 71 ASN HB2 1 72 TRP H . . 5.210 4.362 3.263 4.653 . 0 0 "[ . 1 . 2]" 2
62 1 71 ASN HB3 1 72 TRP H . . 5.210 4.206 2.511 4.660 . 0 0 "[ . 1 . 2]" 2
63 1 53 ASP H 1 70 LYS H . . 3.910 2.283 2.029 2.618 . 0 0 "[ . 1 . 2]" 2
64 1 69 MET HA 1 70 LYS H . . 3.270 2.221 2.175 2.337 . 0 0 "[ . 1 . 2]" 2
65 1 51 ASP HA 1 70 LYS H . . 4.360 3.848 3.496 4.102 . 0 0 "[ . 1 . 2]" 2
66 1 53 ASP HA 1 70 LYS H . . 4.680 4.024 3.853 4.209 . 0 0 "[ . 1 . 2]" 2
67 1 53 ASP HB3 1 70 LYS H . . 4.220 4.082 3.873 4.281 0.061 10 0 "[ . 1 . 2]" 2
68 1 69 MET HB3 1 70 LYS H . . 3.720 2.961 2.596 3.144 . 0 0 "[ . 1 . 2]" 2
69 1 70 LYS H 1 70 LYS HG3 . . 3.520 2.246 1.821 2.577 . 0 0 "[ . 1 . 2]" 2
70 1 43 GLY H 1 44 ILE H . . 3.500 2.134 1.996 2.265 . 0 0 "[ . 1 . 2]" 2
71 1 39 GLY HA3 1 44 ILE H . . 3.750 3.191 2.875 3.540 . 0 0 "[ . 1 . 2]" 2
72 1 39 GLY HA2 1 44 ILE H . . 4.060 2.329 2.036 2.728 . 0 0 "[ . 1 . 2]" 2
73 1 44 ILE H 1 44 ILE HB . . 3.560 2.599 2.548 2.646 . 0 0 "[ . 1 . 2]" 2
74 1 44 ILE H 1 44 ILE HG12 . . 4.220 4.176 4.059 4.242 0.022 19 0 "[ . 1 . 2]" 2
75 1 17 CYS H 1 18 ARG H . . 3.450 2.675 2.580 2.865 . 0 0 "[ . 1 . 2]" 2
76 1 41 CYS H 1 41 CYS HB2 . . 3.250 2.380 2.269 2.508 . 0 0 "[ . 1 . 2]" 2
77 1 40 SER H 1 41 CYS H . . 4.040 2.352 2.285 2.429 . 0 0 "[ . 1 . 2]" 2
78 1 38 HIS HB2 1 41 CYS H . . 3.430 2.528 2.379 2.685 . 0 0 "[ . 1 . 2]" 2
79 1 38 HIS HB3 1 41 CYS H . . 3.340 2.993 2.664 3.230 . 0 0 "[ . 1 . 2]" 2
80 1 35 ASP HA 1 36 TRP H . . 3.310 2.431 2.154 2.672 . 0 0 "[ . 1 . 2]" 2
81 1 27 MET HA 1 28 ILE H . . 3.190 2.268 2.152 2.387 . 0 0 "[ . 1 . 2]" 2
82 1 27 MET HB2 1 28 ILE H . . 4.330 4.103 3.848 4.408 0.078 9 0 "[ . 1 . 2]" 2
83 1 27 MET ME 1 28 ILE H . . 4.440 3.903 3.037 4.451 0.011 14 0 "[ . 1 . 2]" 2
84 1 61 GLU H 1 62 ALA H . . 3.760 2.706 2.675 2.750 . 0 0 "[ . 1 . 2]" 2
85 1 60 CYS HA 1 62 ALA H . . 3.900 3.581 3.387 3.776 . 0 0 "[ . 1 . 2]" 2
86 1 32 LEU H 1 33 CYS H . . 3.320 1.974 1.818 2.081 . 0 0 "[ . 1 . 2]" 2
87 1 32 LEU HB3 1 33 CYS H . . 3.870 3.659 3.500 3.912 0.042 17 0 "[ . 1 . 2]" 2
88 1 32 LEU HG 1 33 CYS H . . 4.270 4.205 4.119 4.281 0.011 9 0 "[ . 1 . 2]" 2
89 1 32 LEU MD1 1 33 CYS H . . 4.760 4.437 4.253 4.692 . 0 0 "[ . 1 . 2]" 2
90 1 14 TYR H 1 14 TYR HB2 . . 4.000 2.912 2.748 2.984 . 0 0 "[ . 1 . 2]" 2
91 1 13 VAL MG1 1 14 TYR H . . 4.370 3.750 3.643 3.932 . 0 0 "[ . 1 . 2]" 2
92 1 25 HIS H 1 25 HIS HB3 . . 3.930 3.675 3.560 3.851 . 0 0 "[ . 1 . 2]" 2
93 1 25 HIS H 1 25 HIS HB2 . . 3.930 2.552 2.382 2.830 . 0 0 "[ . 1 . 2]" 2
94 1 18 ARG H 1 19 GLN H . . 3.690 2.689 2.514 2.964 . 0 0 "[ . 1 . 2]" 2
95 1 19 GLN H 1 19 GLN HB2 . . 3.710 2.622 2.511 2.841 . 0 0 "[ . 1 . 2]" 2
96 1 19 GLN H 1 19 GLN HB3 . . 3.850 3.756 3.697 3.856 0.006 13 0 "[ . 1 . 2]" 2
97 1 30 CYS HA 1 31 GLY H . . 3.410 2.152 2.144 2.165 . 0 0 "[ . 1 . 2]" 2
98 1 24 ASN H 1 25 HIS H . . 3.720 2.645 2.018 3.065 . 0 0 "[ . 1 . 2]" 2
99 1 24 ASN H 1 24 ASN HB3 . . 3.990 3.613 3.535 4.090 0.100 9 0 "[ . 1 . 2]" 2
100 1 64 PHE H 1 64 PHE QD . . 3.600 2.313 2.114 2.550 . 0 0 "[ . 1 . 2]" 2
101 1 64 PHE H 1 64 PHE HB3 . . 3.700 3.557 3.546 3.565 . 0 0 "[ . 1 . 2]" 2
102 1 14 TYR HB2 1 15 CYS H . . 4.100 2.507 1.949 2.830 . 0 0 "[ . 1 . 2]" 2
103 1 37 PHE H 1 37 PHE QD . . 3.830 2.861 2.448 3.210 . 0 0 "[ . 1 . 2]" 2
104 1 45 GLU HB3 1 47 GLU H . . 3.810 2.662 2.452 3.029 . 0 0 "[ . 1 . 2]" 2
105 1 53 ASP H 1 54 ILE H . . 3.500 2.717 2.594 2.787 . 0 0 "[ . 1 . 2]" 2
106 1 54 ILE H 1 68 ILE H . . 4.010 3.644 3.382 3.850 . 0 0 "[ . 1 . 2]" 2
107 1 52 ILE HA 1 54 ILE H . . 4.100 3.774 3.594 3.895 . 0 0 "[ . 1 . 2]" 2
108 1 54 ILE H 1 68 ILE HB . . 3.390 2.476 2.338 2.642 . 0 0 "[ . 1 . 2]" 2
109 1 54 ILE H 1 54 ILE HB . . 3.410 2.842 2.801 2.954 . 0 0 "[ . 1 . 2]" 2
110 1 54 ILE H 1 54 ILE HG13 . . 3.850 2.956 2.896 3.076 . 0 0 "[ . 1 . 2]" 2
111 1 54 ILE H 1 68 ILE MG . . 3.700 3.620 3.503 3.720 0.020 2 0 "[ . 1 . 2]" 2
112 1 53 ASP HB2 1 54 ILE H . . 3.680 3.525 3.467 3.590 . 0 0 "[ . 1 . 2]" 2
113 1 36 TRP HA 1 37 PHE H . . 3.460 2.254 2.188 2.378 . 0 0 "[ . 1 . 2]" 2
114 1 36 TRP HB3 1 37 PHE H . . 3.580 2.861 2.492 3.104 . 0 0 "[ . 1 . 2]" 2
115 1 16 LEU H 1 17 CYS H . . 3.730 2.404 2.301 2.551 . 0 0 "[ . 1 . 2]" 2
116 1 15 CYS HB3 1 17 CYS H . . 3.740 2.626 2.333 2.840 . 0 0 "[ . 1 . 2]" 2
117 1 17 CYS H 1 17 CYS HB3 . . 3.750 3.017 2.763 3.609 . 0 0 "[ . 1 . 2]" 2
118 1 17 CYS H 1 17 CYS HB2 . . 3.750 3.346 2.544 3.620 . 0 0 "[ . 1 . 2]" 2
119 1 32 LEU H 1 34 GLN H . . 4.100 2.623 2.537 2.705 . 0 0 "[ . 1 . 2]" 2
120 1 33 CYS H 1 34 GLN H . . 3.270 2.002 1.919 2.097 . 0 0 "[ . 1 . 2]" 2
121 1 34 GLN H 1 34 GLN HG2 . . 4.250 3.567 3.142 4.312 0.062 3 0 "[ . 1 . 2]" 2
122 1 34 GLN H 1 35 ASP H . . 3.360 2.694 2.582 2.865 . 0 0 "[ . 1 . 2]" 2
123 1 48 ASN H 1 50 VAL H . . 4.560 4.306 4.077 4.497 . 0 0 "[ . 1 . 2]" 2
124 1 47 GLU HB2 1 48 ASN H . . 4.390 3.978 3.745 4.075 . 0 0 "[ . 1 . 2]" 2
125 1 47 GLU H 1 48 ASN H . . 3.630 2.621 2.483 2.720 . 0 0 "[ . 1 . 2]" 2
126 1 48 ASN H 1 48 ASN HB3 . . 3.720 3.589 3.498 3.650 . 0 0 "[ . 1 . 2]" 2
127 1 47 GLU HG2 1 48 ASN H . . 4.100 2.617 2.142 3.331 . 0 0 "[ . 1 . 2]" 2
128 1 47 GLU HG3 1 48 ASN H . . 4.100 2.889 2.036 4.099 . 0 0 "[ . 1 . 2]" 2
129 1 45 GLU HB2 1 48 ASN H . . 3.920 3.083 2.717 3.264 . 0 0 "[ . 1 . 2]" 2
130 1 63 VAL H 1 64 PHE H . . 3.240 2.049 1.965 2.125 . 0 0 "[ . 1 . 2]" 2
131 1 63 VAL H 1 65 GLY H . . 3.980 3.198 3.099 3.375 . 0 0 "[ . 1 . 2]" 2
132 1 62 ALA H 1 63 VAL H . . 3.320 2.554 2.372 2.674 . 0 0 "[ . 1 . 2]" 2
133 1 60 CYS HA 1 63 VAL H . . 4.020 3.752 3.561 3.837 . 0 0 "[ . 1 . 2]" 2
134 1 27 MET HA 1 39 GLY H . . 4.050 3.045 2.371 3.891 . 0 0 "[ . 1 . 2]" 2
135 1 40 SER H 1 40 SER HB2 . . 3.660 2.748 2.214 3.633 . 0 0 "[ . 1 . 2]" 2
136 1 38 HIS HB3 1 40 SER H . . 4.110 2.588 2.516 2.650 . 0 0 "[ . 1 . 2]" 2
137 1 50 VAL H 1 52 ILE H . . 4.110 4.076 3.977 4.143 0.033 20 0 "[ . 1 . 2]" 2
138 1 48 ASN HA 1 50 VAL H . . 4.540 4.366 4.074 4.542 0.002 5 0 "[ . 1 . 2]" 2
139 1 49 ALA MB 1 50 VAL H . . 3.500 2.504 2.287 2.690 . 0 0 "[ . 1 . 2]" 2
140 1 67 SER H 1 67 SER HG . . 4.380 3.119 2.108 4.349 . 0 0 "[ . 1 . 2]" 2
141 1 66 PRO HA 1 67 SER H . . 3.170 2.445 2.360 2.512 . 0 0 "[ . 1 . 2]" 2
142 1 56 HIS HB2 1 67 SER H . . 4.170 3.682 3.552 3.971 . 0 0 "[ . 1 . 2]" 2
143 1 66 PRO HB3 1 67 SER H . . 3.700 3.399 3.323 3.507 . 0 0 "[ . 1 . 2]" 2
144 1 67 SER H 1 67 SER HB3 . . 3.960 3.006 2.239 3.671 . 0 0 "[ . 1 . 2]" 2
145 1 45 GLU HB3 1 48 ASN HD22 . . 4.950 4.562 3.877 4.947 . 0 0 "[ . 1 . 2]" 2
146 1 45 GLU HB2 1 48 ASN HD22 . . 4.780 3.179 2.287 3.560 . 0 0 "[ . 1 . 2]" 2
147 1 45 GLU HB3 1 48 ASN HD21 . . 4.950 3.927 3.002 4.653 . 0 0 "[ . 1 . 2]" 2
148 1 42 VAL H 1 43 GLY H . . 3.370 2.172 2.012 2.278 . 0 0 "[ . 1 . 2]" 2
149 1 40 SER HA 1 43 GLY H . . 3.900 3.620 3.418 3.924 0.024 13 0 "[ . 1 . 2]" 2
150 1 64 PHE H 1 65 GLY H . . 3.380 2.559 2.453 2.656 . 0 0 "[ . 1 . 2]" 2
151 1 41 CYS HB3 1 42 VAL H . . 3.930 3.788 3.524 3.961 0.031 14 0 "[ . 1 . 2]" 2
152 1 41 CYS HB2 1 42 VAL H . . 3.800 2.917 2.807 3.052 . 0 0 "[ . 1 . 2]" 2
153 1 70 LYS HB3 1 72 TRP H . . 4.870 3.302 2.652 4.869 . 0 0 "[ . 1 . 2]" 2
154 1 70 LYS HB2 1 72 TRP H . . 4.800 3.414 2.958 3.988 . 0 0 "[ . 1 . 2]" 2
155 1 71 ASN H 1 72 TRP H . . 4.500 2.842 1.803 3.492 . 0 0 "[ . 1 . 2]" 2
156 1 53 ASP HB2 1 71 ASN H . . 4.810 4.662 4.377 4.819 0.009 1 0 "[ . 1 . 2]" 2
157 1 68 ILE HG13 1 69 MET H . . 5.200 4.989 4.810 5.151 . 0 0 "[ . 1 . 2]" 2
158 1 56 HIS HB2 1 68 ILE H . . 4.970 4.649 4.442 4.828 . 0 0 "[ . 1 . 2]" 2
159 1 55 TYR HA 1 68 ILE H . . 4.560 4.359 3.964 4.559 . 0 0 "[ . 1 . 2]" 2
160 1 68 ILE H 1 69 MET H . . 4.700 4.625 4.591 4.637 . 0 0 "[ . 1 . 2]" 2
161 1 63 VAL HB 1 65 GLY H . . 5.500 4.912 4.842 4.996 . 0 0 "[ . 1 . 2]" 2
162 1 61 GLU HB2 1 65 GLY H . . 4.950 4.212 4.100 4.405 . 0 0 "[ . 1 . 2]" 2
163 1 61 GLU HG2 1 65 GLY H . . 4.960 4.229 3.759 4.569 . 0 0 "[ . 1 . 2]" 2
164 1 64 PHE HB3 1 65 GLY H . . 4.430 3.285 3.188 3.344 . 0 0 "[ . 1 . 2]" 2
165 1 64 PHE HB2 1 65 GLY H . . 4.630 2.539 2.431 2.607 . 0 0 "[ . 1 . 2]" 2
166 1 62 ALA H 1 65 GLY H . . 4.720 4.470 4.317 4.543 . 0 0 "[ . 1 . 2]" 2
167 1 64 PHE QD 1 65 GLY H . . 4.630 4.220 4.163 4.290 . 0 0 "[ . 1 . 2]" 2
168 1 60 CYS HB2 1 64 PHE H . . 4.960 4.888 4.798 4.987 0.027 15 0 "[ . 1 . 2]" 2
169 1 23 VAL MG2 1 24 ASN HD21 . . 5.500 4.723 4.073 5.499 . 0 0 "[ . 1 . 2]" 2
170 1 61 GLU HA 1 63 VAL H . . 4.770 3.430 3.339 3.623 . 0 0 "[ . 1 . 2]" 2
171 1 60 CYS H 1 62 ALA H . . 4.410 3.863 3.822 3.946 . 0 0 "[ . 1 . 2]" 2
172 1 62 ALA H 1 63 VAL HA . . 5.280 5.172 5.047 5.247 . 0 0 "[ . 1 . 2]" 2
173 1 56 HIS HB3 1 61 GLU H . . 4.340 3.567 3.483 3.665 . 0 0 "[ . 1 . 2]" 2
174 1 59 ASP H 1 61 GLU H . . 4.910 3.423 3.312 3.506 . 0 0 "[ . 1 . 2]" 2
175 1 61 GLU H 1 65 GLY H . . 5.230 4.496 4.444 4.556 . 0 0 "[ . 1 . 2]" 2
176 1 58 PRO HG2 1 59 ASP H . . 4.130 3.504 3.434 3.608 . 0 0 "[ . 1 . 2]" 2
177 1 58 PRO HD2 1 59 ASP H . . 4.530 3.146 3.091 3.230 . 0 0 "[ . 1 . 2]" 2
178 1 57 CYS HA 1 59 ASP H . . 5.070 3.867 3.860 3.878 . 0 0 "[ . 1 . 2]" 2
179 1 32 LEU MD1 1 57 CYS H . . 5.340 3.879 3.578 4.259 . 0 0 "[ . 1 . 2]" 2
180 1 32 LEU HG 1 57 CYS H . . 5.500 4.704 4.526 4.890 . 0 0 "[ . 1 . 2]" 2
181 1 57 CYS H 1 58 PRO HD2 . . 4.780 4.729 4.715 4.738 . 0 0 "[ . 1 . 2]" 2
182 1 57 CYS H 1 58 PRO HD3 . . 5.280 5.025 5.005 5.039 . 0 0 "[ . 1 . 2]" 2
183 1 56 HIS HD2 1 57 CYS H . . 4.670 4.446 4.269 4.583 . 0 0 "[ . 1 . 2]" 2
184 1 37 PHE QE 1 57 CYS H . . 4.970 4.767 4.516 4.972 0.002 7 0 "[ . 1 . 2]" 2
185 1 56 HIS H 1 57 CYS H . . 5.330 4.177 4.124 4.225 . 0 0 "[ . 1 . 2]" 2
186 1 57 CYS H 1 59 ASP H . . 5.500 4.587 4.498 4.647 . 0 0 "[ . 1 . 2]" 2
187 1 54 ILE HB 1 55 TYR H . . 4.690 4.389 4.332 4.442 . 0 0 "[ . 1 . 2]" 2
188 1 55 TYR H 1 56 HIS H . . 4.900 4.595 4.571 4.624 . 0 0 "[ . 1 . 2]" 2
189 1 31 GLY H 1 55 TYR H . . 4.560 3.732 3.604 3.934 . 0 0 "[ . 1 . 2]" 2
190 1 54 ILE H 1 55 TYR H . . 3.980 3.853 3.700 3.953 . 0 0 "[ . 1 . 2]" 2
191 1 28 ILE MG 1 52 ILE H . . 5.500 5.446 5.282 5.550 0.050 18 0 "[ . 1 . 2]" 2
192 1 49 ALA MB 1 52 ILE H . . 4.270 4.119 4.039 4.248 . 0 0 "[ . 1 . 2]" 2
193 1 51 ASP HB3 1 52 ILE H . . 4.330 3.827 3.572 4.021 . 0 0 "[ . 1 . 2]" 2
194 1 52 ILE H 1 69 MET HA . . 5.040 4.963 4.618 5.061 0.021 20 0 "[ . 1 . 2]" 2
195 1 52 ILE H 1 70 LYS H . . 5.130 4.758 4.285 5.018 . 0 0 "[ . 1 . 2]" 2
196 1 52 ILE H 1 53 ASP H . . 4.860 4.220 4.075 4.292 . 0 0 "[ . 1 . 2]" 2
197 1 51 ASP H 1 52 ILE HG13 . . 4.160 3.593 3.212 3.692 . 0 0 "[ . 1 . 2]" 2
198 1 51 ASP H 1 52 ILE HB . . 4.670 4.360 4.252 4.419 . 0 0 "[ . 1 . 2]" 2
199 1 49 ALA MB 1 51 ASP H . . 4.840 4.102 4.039 4.186 . 0 0 "[ . 1 . 2]" 2
200 1 50 VAL H 1 51 ASP H . . 3.360 2.770 2.675 2.837 . 0 0 "[ . 1 . 2]" 2
201 1 28 ILE MG 1 49 ALA H . . 5.450 4.994 4.615 5.456 0.006 20 0 "[ . 1 . 2]" 2
202 1 46 GLU H 1 49 ALA H . . 5.020 4.643 4.559 4.787 . 0 0 "[ . 1 . 2]" 2
203 1 45 GLU H 1 48 ASN H . . 4.550 4.004 3.660 4.313 . 0 0 "[ . 1 . 2]" 2
204 1 46 GLU H 1 48 ASN H . . 4.710 4.076 3.953 4.192 . 0 0 "[ . 1 . 2]" 2
205 1 45 GLU HB2 1 48 ASN HD21 . . 4.780 2.368 1.895 2.946 . 0 0 "[ . 1 . 2]" 2
206 1 45 GLU H 1 48 ASN HD21 . . 5.140 2.861 2.090 3.636 . 0 0 "[ . 1 . 2]" 2
207 1 45 GLU H 1 48 ASN HD22 . . 5.140 4.311 3.274 4.985 . 0 0 "[ . 1 . 2]" 2
208 1 46 GLU H 1 47 GLU H . . 3.760 2.708 2.584 2.838 . 0 0 "[ . 1 . 2]" 2
209 1 42 VAL H 1 44 ILE H . . 4.210 3.861 3.744 4.004 . 0 0 "[ . 1 . 2]" 2
210 1 39 GLY HA2 1 42 VAL H . . 4.390 3.591 3.427 3.728 . 0 0 "[ . 1 . 2]" 2
211 1 38 HIS HB2 1 42 VAL H . . 4.510 4.175 3.985 4.321 . 0 0 "[ . 1 . 2]" 2
212 1 42 VAL H 1 43 GLY HA2 . . 4.890 4.419 4.318 4.500 . 0 0 "[ . 1 . 2]" 2
213 1 40 SER H 1 42 VAL H . . 4.770 3.790 3.566 3.933 . 0 0 "[ . 1 . 2]" 2
214 1 41 CYS H 1 42 VAL MG2 . . 4.170 3.811 3.561 4.027 . 0 0 "[ . 1 . 2]" 2
215 1 41 CYS H 1 42 VAL MG1 . . 4.100 3.937 3.723 4.074 . 0 0 "[ . 1 . 2]" 2
216 1 41 CYS H 1 43 GLY H . . 4.310 3.845 3.528 4.127 . 0 0 "[ . 1 . 2]" 2
217 1 38 HIS HB2 1 40 SER H . . 3.810 3.480 3.260 3.684 . 0 0 "[ . 1 . 2]" 2
218 1 26 PHE QD 1 39 GLY H . . 4.380 2.521 1.881 3.765 . 0 0 "[ . 1 . 2]" 2
219 1 39 GLY H 1 40 SER H . . 4.250 2.717 2.458 2.878 . 0 0 "[ . 1 . 2]" 2
220 1 38 HIS HB3 1 39 GLY H . . 4.420 3.051 2.449 3.446 . 0 0 "[ . 1 . 2]" 2
221 1 27 MET HG2 1 39 GLY H . . 5.090 3.923 3.436 4.373 . 0 0 "[ . 1 . 2]" 2
222 1 38 HIS H 1 42 VAL MG2 . . 5.190 4.345 3.985 4.829 . 0 0 "[ . 1 . 2]" 2
223 1 27 MET ME 1 38 HIS H . . 4.320 3.293 2.744 3.934 . 0 0 "[ . 1 . 2]" 2
224 1 15 CYS HA 1 38 HIS H . . 4.530 4.200 3.861 4.412 . 0 0 "[ . 1 . 2]" 2
225 1 15 CYS HB3 1 38 HIS H . . 4.770 4.453 3.733 4.708 . 0 0 "[ . 1 . 2]" 2
226 1 37 PHE QD 1 38 HIS H . . 4.600 3.951 3.716 4.325 . 0 0 "[ . 1 . 2]" 2
227 1 38 HIS H 1 41 CYS H . . 4.980 4.084 3.900 4.464 . 0 0 "[ . 1 . 2]" 2
228 1 28 ILE MD 1 37 PHE H . . 4.690 2.813 2.121 3.651 . 0 0 "[ . 1 . 2]" 2
229 1 29 GLU HA 1 37 PHE H . . 4.350 4.073 3.810 4.355 0.005 16 0 "[ . 1 . 2]" 2
230 1 30 CYS H 1 34 GLN H . . 4.840 4.443 4.128 4.734 . 0 0 "[ . 1 . 2]" 2
231 1 30 CYS HB2 1 34 GLN H . . 4.790 4.706 4.595 4.829 0.039 3 0 "[ . 1 . 2]" 2
232 1 34 GLN H 1 35 ASP HB2 . . 4.770 4.677 4.558 4.786 0.016 7 0 "[ . 1 . 2]" 2
233 1 32 LEU MD2 1 33 CYS H . . 4.740 4.614 4.524 4.675 . 0 0 "[ . 1 . 2]" 2
234 1 30 CYS HB2 1 33 CYS H . . 4.300 4.212 4.084 4.314 0.014 4 0 "[ . 1 . 2]" 2
235 1 33 CYS H 1 34 GLN HA . . 4.230 4.218 4.152 4.262 0.032 16 0 "[ . 1 . 2]" 2
236 1 31 GLY H 1 56 HIS HD2 . . 4.490 3.024 2.773 3.173 . 0 0 "[ . 1 . 2]" 2
237 1 30 CYS H 1 35 ASP H . . 4.690 2.932 2.637 3.160 . 0 0 "[ . 1 . 2]" 2
238 1 30 CYS H 1 37 PHE QD . . 4.400 3.739 3.498 4.076 . 0 0 "[ . 1 . 2]" 2
239 1 30 CYS H 1 37 PHE QE . . 4.150 3.716 3.247 4.081 . 0 0 "[ . 1 . 2]" 2
240 1 30 CYS H 1 34 GLN HA . . 4.350 4.024 3.687 4.340 . 0 0 "[ . 1 . 2]" 2
241 1 28 ILE MD 1 29 GLU H . . 4.560 4.005 3.433 4.601 0.041 1 0 "[ . 1 . 2]" 2
242 1 29 GLU H 1 29 GLU HG2 . . 4.640 4.493 4.407 4.605 . 0 0 "[ . 1 . 2]" 2
243 1 29 GLU H 1 36 TRP HZ3 . . 5.080 4.701 4.317 4.968 . 0 0 "[ . 1 . 2]" 2
244 1 29 GLU H 1 30 CYS H . . 4.610 4.257 4.127 4.350 . 0 0 "[ . 1 . 2]" 2
245 1 28 ILE H 1 29 GLU H . . 4.850 4.442 4.372 4.530 . 0 0 "[ . 1 . 2]" 2
246 1 26 PHE HB2 1 27 MET H . . 4.260 3.675 3.482 3.830 . 0 0 "[ . 1 . 2]" 2
247 1 26 PHE HB3 1 27 MET H . . 4.260 4.096 3.901 4.218 . 0 0 "[ . 1 . 2]" 2
248 1 26 PHE H 1 27 MET H . . 4.760 4.600 4.285 4.650 . 0 0 "[ . 1 . 2]" 2
249 1 27 MET H 1 28 ILE H . . 4.690 4.339 4.094 4.410 . 0 0 "[ . 1 . 2]" 2
250 1 26 PHE H 1 26 PHE QD . . 4.560 3.958 3.585 4.282 . 0 0 "[ . 1 . 2]" 2
251 1 25 HIS HD2 1 26 PHE H . . 5.210 4.415 3.656 5.167 . 0 0 "[ . 1 . 2]" 2
252 1 23 VAL HB 1 24 ASN H . . 4.730 3.900 2.133 4.492 . 0 0 "[ . 1 . 2]" 2
253 1 24 ASN H 1 24 ASN HD21 . . 4.750 3.426 1.833 4.575 . 0 0 "[ . 1 . 2]" 2
254 1 24 ASN H 1 24 ASN HD22 . . 4.750 3.888 2.939 4.753 0.003 9 0 "[ . 1 . 2]" 2
255 1 22 ASN HB2 1 23 VAL H . . 5.040 4.420 4.039 4.572 . 0 0 "[ . 1 . 2]" 2
256 1 21 TYR HB3 1 22 ASN H . . 4.640 3.986 3.618 4.226 . 0 0 "[ . 1 . 2]" 2
257 1 21 TYR HB2 1 22 ASN H . . 4.710 3.861 3.625 4.446 . 0 0 "[ . 1 . 2]" 2
258 1 21 TYR QD 1 22 ASN H . . 4.470 2.932 2.462 3.306 . 0 0 "[ . 1 . 2]" 2
259 1 21 TYR H 1 22 ASN H . . 5.170 4.205 3.798 4.344 . 0 0 "[ . 1 . 2]" 2
260 1 17 CYS HB2 1 19 GLN H . . 5.500 4.284 3.198 4.932 . 0 0 "[ . 1 . 2]" 2
261 1 17 CYS HB3 1 19 GLN H . . 5.500 5.147 4.484 5.554 0.054 4 0 "[ . 1 . 2]" 2
262 1 18 ARG HD3 1 19 GLN H . . 5.500 5.172 4.829 5.511 0.011 3 0 "[ . 1 . 2]" 2
263 1 13 VAL HA 1 19 GLN H . . 4.720 4.404 3.963 4.612 . 0 0 "[ . 1 . 2]" 2
264 1 19 GLN H 1 38 HIS HE1 . . 4.940 4.562 4.217 4.985 0.045 9 0 "[ . 1 . 2]" 2
265 1 17 CYS H 1 19 GLN H . . 4.450 3.911 3.712 4.143 . 0 0 "[ . 1 . 2]" 2
266 1 13 VAL MG1 1 18 ARG H . . 5.460 4.630 4.484 4.791 . 0 0 "[ . 1 . 2]" 2
267 1 13 VAL MG2 1 18 ARG H . . 5.500 4.258 3.745 4.449 . 0 0 "[ . 1 . 2]" 2
268 1 18 ARG H 1 19 GLN HG2 . . 4.530 4.206 3.778 4.500 . 0 0 "[ . 1 . 2]" 2
269 1 15 CYS HB3 1 18 ARG H . . 4.600 3.541 3.255 3.933 . 0 0 "[ . 1 . 2]" 2
270 1 16 LEU HA 1 18 ARG H . . 4.820 3.337 3.252 3.487 . 0 0 "[ . 1 . 2]" 2
271 1 16 LEU H 1 18 ARG H . . 4.810 4.120 3.945 4.341 . 0 0 "[ . 1 . 2]" 2
272 1 16 LEU HB2 1 17 CYS H . . 4.020 3.053 2.894 3.270 . 0 0 "[ . 1 . 2]" 2
273 1 16 LEU HG 1 17 CYS H . . 4.010 3.999 3.895 4.075 0.065 14 0 "[ . 1 . 2]" 2
274 1 17 CYS H 1 19 GLN HG2 . . 4.960 4.421 4.309 4.581 . 0 0 "[ . 1 . 2]" 2
275 1 16 LEU H 1 37 PHE QE . . 4.730 3.777 3.472 4.376 . 0 0 "[ . 1 . 2]" 2
276 1 16 LEU H 1 37 PHE QD . . 4.170 2.676 2.448 3.118 . 0 0 "[ . 1 . 2]" 2
277 1 14 TYR QD 1 15 CYS H . . 4.360 3.290 3.074 3.962 . 0 0 "[ . 1 . 2]" 2
278 1 14 TYR H 1 15 CYS H . . 4.470 2.031 1.822 2.461 . 0 0 "[ . 1 . 2]" 2
279 1 15 CYS H 1 36 TRP H . . 5.350 4.906 4.413 5.335 . 0 0 "[ . 1 . 2]" 2
280 1 15 CYS H 1 16 LEU H . . 4.940 4.597 4.542 4.643 . 0 0 "[ . 1 . 2]" 2
281 1 14 TYR H 1 18 ARG HA . . 5.330 4.784 4.296 5.247 . 0 0 "[ . 1 . 2]" 2
282 1 13 VAL H 1 14 TYR H . . 4.840 4.579 4.507 4.621 . 0 0 "[ . 1 . 2]" 2
283 1 9 ALA MB 1 11 VAL H . . 5.500 4.851 4.229 5.447 . 0 0 "[ . 1 . 2]" 2
284 1 23 VAL MG2 1 25 HIS H . . 5.500 5.108 4.383 5.558 0.058 9 0 "[ . 1 . 2]" 2
285 1 25 HIS H 1 25 HIS HD2 . . 4.870 4.004 2.705 4.858 . 0 0 "[ . 1 . 2]" 2
286 1 25 HIS H 1 26 PHE H . . 5.010 4.380 2.804 4.591 . 0 0 "[ . 1 . 2]" 2
287 1 22 ASN H 1 23 VAL H . . 4.980 4.004 3.592 4.559 . 0 0 "[ . 1 . 2]" 2
288 1 21 TYR QE 1 22 ASN H . . 5.040 3.878 3.442 4.219 . 0 0 "[ . 1 . 2]" 2
289 1 30 CYS HA 1 32 LEU H . . 4.310 3.718 3.637 3.793 . 0 0 "[ . 1 . 2]" 2
290 1 32 LEU H 1 33 CYS HA . . 4.920 4.590 4.537 4.640 . 0 0 "[ . 1 . 2]" 2
291 1 38 HIS H 1 41 CYS HB2 . . 3.960 2.804 2.407 3.434 . 0 0 "[ . 1 . 2]" 2
292 1 38 HIS H 1 38 HIS HB3 . . 4.130 3.620 3.589 3.649 . 0 0 "[ . 1 . 2]" 2
293 1 18 ARG HA 1 18 ARG HD2 . . 3.840 2.622 2.316 2.967 . 0 0 "[ . 1 . 2]" 2
294 1 32 LEU HB2 1 33 CYS H . . 3.450 2.542 2.380 2.790 . 0 0 "[ . 1 . 2]" 2
295 1 32 LEU HB2 1 32 LEU MD2 . . 3.510 3.187 3.178 3.195 . 0 0 "[ . 1 . 2]" 2
296 1 32 LEU HB2 1 32 LEU MD1 . . 3.180 2.318 2.189 2.435 . 0 0 "[ . 1 . 2]" 2
297 1 32 LEU H 1 32 LEU HB2 . . 3.420 2.686 2.625 2.751 . 0 0 "[ . 1 . 2]" 2
298 1 32 LEU H 1 32 LEU HB3 . . 3.790 3.797 3.763 3.826 0.036 15 0 "[ . 1 . 2]" 2
299 1 53 ASP H 1 53 ASP HB3 . . 3.420 2.918 2.805 2.977 . 0 0 "[ . 1 . 2]" 2
300 1 53 ASP HB3 1 54 ILE H . . 3.250 2.558 2.443 2.729 . 0 0 "[ . 1 . 2]" 2
301 1 53 ASP HB3 1 54 ILE HG13 . . 3.680 2.427 2.345 2.562 . 0 0 "[ . 1 . 2]" 2
302 1 53 ASP HB3 1 68 ILE MG . . 3.130 2.588 2.240 2.896 . 0 0 "[ . 1 . 2]" 2
303 1 53 ASP HB2 1 54 ILE HG13 . . 4.620 4.155 4.078 4.253 . 0 0 "[ . 1 . 2]" 2
304 1 53 ASP HB2 1 70 LYS HB2 . . 4.920 4.012 3.908 4.182 . 0 0 "[ . 1 . 2]" 2
305 1 53 ASP HB2 1 70 LYS HG2 . . 3.360 2.257 2.009 2.472 . 0 0 "[ . 1 . 2]" 2
306 1 53 ASP H 1 53 ASP HB2 . . 3.470 2.209 2.166 2.308 . 0 0 "[ . 1 . 2]" 2
307 1 16 LEU H 1 16 LEU HB2 . . 3.450 2.755 2.719 2.816 . 0 0 "[ . 1 . 2]" 2
308 1 16 LEU H 1 16 LEU HB3 . . 3.710 3.599 3.577 3.621 . 0 0 "[ . 1 . 2]" 2
309 1 16 LEU HB3 1 16 LEU MD1 . . 3.170 2.554 2.466 2.672 . 0 0 "[ . 1 . 2]" 2
310 1 28 ILE H 1 28 ILE HB . . 3.710 3.280 2.884 3.575 . 0 0 "[ . 1 . 2]" 2
311 1 28 ILE HB 1 28 ILE MD . . 2.980 2.254 2.084 2.423 . 0 0 "[ . 1 . 2]" 2
312 1 70 LYS HB3 1 70 LYS HE2 . . 5.490 4.498 4.371 4.605 . 0 0 "[ . 1 . 2]" 2
313 1 70 LYS HB3 1 70 LYS HE3 . . 5.490 4.434 4.270 4.688 . 0 0 "[ . 1 . 2]" 2
314 1 70 LYS HE2 1 70 LYS HG3 . . 3.620 2.769 2.370 3.258 . 0 0 "[ . 1 . 2]" 2
315 1 70 LYS HE3 1 70 LYS HG3 . . 3.620 2.389 2.239 2.559 . 0 0 "[ . 1 . 2]" 2
316 1 10 LEU H 1 10 LEU HB3 . . 3.830 3.341 2.487 3.824 . 0 0 "[ . 1 . 2]" 2
317 1 37 PHE H 1 37 PHE HB3 . . 4.190 3.922 3.843 4.006 . 0 0 "[ . 1 . 2]" 2
318 1 35 ASP H 1 35 ASP HB2 . . 3.380 2.412 2.288 2.546 . 0 0 "[ . 1 . 2]" 2
319 1 35 ASP HB2 1 37 PHE HZ . . 3.830 3.013 2.498 3.510 . 0 0 "[ . 1 . 2]" 2
320 1 35 ASP HB3 1 37 PHE HZ . . 4.100 2.974 2.552 3.438 . 0 0 "[ . 1 . 2]" 2
321 1 35 ASP HB2 1 37 PHE QE . . 3.510 2.057 1.979 2.276 . 0 0 "[ . 1 . 2]" 2
322 1 35 ASP HB3 1 37 PHE QE . . 3.910 2.523 2.100 2.941 . 0 0 "[ . 1 . 2]" 2
323 1 37 PHE H 1 37 PHE HB2 . . 3.540 2.899 2.751 3.060 . 0 0 "[ . 1 . 2]" 2
324 1 51 ASP H 1 51 ASP HB3 . . 3.740 3.554 2.925 3.649 . 0 0 "[ . 1 . 2]" 2
325 1 59 ASP HB3 1 60 CYS H . . 4.160 3.061 2.985 3.121 . 0 0 "[ . 1 . 2]" 2
326 1 59 ASP H 1 59 ASP HB3 . . 3.790 2.727 2.316 2.911 . 0 0 "[ . 1 . 2]" 2
327 1 59 ASP HB2 1 60 CYS H . . 4.160 3.925 3.773 4.270 0.110 12 0 "[ . 1 . 2]" 2
328 1 59 ASP H 1 59 ASP HB2 . . 3.790 2.813 2.556 3.390 . 0 0 "[ . 1 . 2]" 2
329 1 51 ASP H 1 51 ASP HB2 . . 3.740 2.353 2.269 2.590 . 0 0 "[ . 1 . 2]" 2
330 1 64 PHE H 1 64 PHE HB2 . . 3.520 2.290 2.264 2.318 . 0 0 "[ . 1 . 2]" 2
331 1 54 ILE HB 1 68 ILE HB . . 2.640 2.001 1.953 2.100 . 0 0 "[ . 1 . 2]" 2
332 1 54 ILE HB 1 68 ILE HG13 . . 3.140 2.735 2.414 3.088 . 0 0 "[ . 1 . 2]" 2
333 1 42 VAL MG2 1 44 ILE HB . . 3.450 2.400 2.222 2.521 . 0 0 "[ . 1 . 2]" 2
334 1 39 GLY HA3 1 44 ILE HB . . 4.030 3.578 3.196 3.986 . 0 0 "[ . 1 . 2]" 2
335 1 26 PHE H 1 26 PHE HB3 . . 3.740 2.295 2.126 3.117 . 0 0 "[ . 1 . 2]" 2
336 1 44 ILE MG 1 48 ASN HB3 . . 4.010 3.630 3.130 4.004 . 0 0 "[ . 1 . 2]" 2
337 1 26 PHE H 1 26 PHE HB2 . . 3.740 2.992 2.741 3.725 . 0 0 "[ . 1 . 2]" 2
338 1 14 TYR QE 1 21 TYR HB2 . . 3.710 3.416 2.521 3.717 0.007 20 0 "[ . 1 . 2]" 2
339 1 48 ASN H 1 48 ASN HB2 . . 3.340 2.364 2.211 2.630 . 0 0 "[ . 1 . 2]" 2
340 1 21 TYR H 1 21 TYR HB3 . . 3.390 3.111 3.060 3.307 . 0 0 "[ . 1 . 2]" 2
341 1 49 ALA HA 1 52 ILE HB . . 3.650 2.407 2.217 2.844 . 0 0 "[ . 1 . 2]" 2
342 1 28 ILE MG 1 52 ILE HB . . 4.220 3.707 3.635 3.775 . 0 0 "[ . 1 . 2]" 2
343 1 24 ASN HB3 1 25 HIS H . . 4.470 3.809 2.924 4.461 . 0 0 "[ . 1 . 2]" 2
344 1 45 GLU H 1 48 ASN HB2 . . 4.040 2.737 2.389 3.035 . 0 0 "[ . 1 . 2]" 2
345 1 24 ASN H 1 24 ASN HB2 . . 3.990 2.664 2.254 3.670 . 0 0 "[ . 1 . 2]" 2
346 1 24 ASN HB2 1 25 HIS H . . 4.470 2.818 2.272 4.294 . 0 0 "[ . 1 . 2]" 2
347 1 55 TYR H 1 55 TYR HB3 . . 3.700 2.237 2.191 2.287 . 0 0 "[ . 1 . 2]" 2
348 1 68 ILE H 1 68 ILE HB . . 3.450 2.677 2.640 2.712 . 0 0 "[ . 1 . 2]" 2
349 1 45 GLU HA 1 45 GLU HG3 . . 3.490 3.060 2.334 3.594 0.104 5 0 "[ . 1 . 2]" 2
350 1 45 GLU HA 1 45 GLU HG2 . . 3.490 2.922 2.349 3.516 0.026 11 0 "[ . 1 . 2]" 2
351 1 61 GLU HG2 1 66 PRO HA . . 4.710 4.566 4.380 4.701 . 0 0 "[ . 1 . 2]" 2
352 1 61 GLU H 1 61 GLU HG2 . . 4.450 4.349 4.299 4.425 . 0 0 "[ . 1 . 2]" 2
353 1 61 GLU HA 1 61 GLU HG2 . . 3.920 3.166 2.949 3.406 . 0 0 "[ . 1 . 2]" 2
354 1 46 GLU HA 1 46 GLU HG3 . . 3.720 2.723 2.250 3.700 . 0 0 "[ . 1 . 2]" 2
355 1 34 GLN H 1 34 GLN HG3 . . 4.250 3.183 2.837 3.401 . 0 0 "[ . 1 . 2]" 2
356 1 34 GLN HA 1 34 GLN HG2 . . 3.730 2.492 2.258 3.559 . 0 0 "[ . 1 . 2]" 2
357 1 29 GLU HG2 1 34 GLN HA . . 3.400 2.858 2.573 3.360 . 0 0 "[ . 1 . 2]" 2
358 1 13 VAL HB 1 18 ARG HA . . 3.410 2.573 2.089 3.042 . 0 0 "[ . 1 . 2]" 2
359 1 13 VAL HB 1 14 TYR H . . 3.360 2.649 2.339 3.222 . 0 0 "[ . 1 . 2]" 2
360 1 13 VAL HB 1 19 GLN H . . 3.540 2.744 2.364 2.985 . 0 0 "[ . 1 . 2]" 2
361 1 19 GLN H 1 19 GLN HG2 . . 3.560 2.951 2.760 3.217 . 0 0 "[ . 1 . 2]" 2
362 1 19 GLN HE22 1 19 GLN HG2 . . 3.660 3.457 3.437 3.479 . 0 0 "[ . 1 . 2]" 2
363 1 19 GLN HA 1 19 GLN HG2 . . 3.390 3.259 3.146 3.354 . 0 0 "[ . 1 . 2]" 2
364 1 17 CYS HB3 1 19 GLN HG2 . . 4.120 3.673 2.598 4.150 0.030 15 0 "[ . 1 . 2]" 2
365 1 17 CYS HB2 1 19 GLN HG2 . . 4.120 2.512 2.087 2.862 . 0 0 "[ . 1 . 2]" 2
366 1 63 VAL HB 1 64 PHE H . . 3.370 2.402 2.327 2.506 . 0 0 "[ . 1 . 2]" 2
367 1 63 VAL HB 1 64 PHE QD . . 3.410 2.612 2.384 2.748 . 0 0 "[ . 1 . 2]" 2
368 1 63 VAL H 1 63 VAL HB . . 3.280 2.840 2.783 2.866 . 0 0 "[ . 1 . 2]" 2
369 1 66 PRO HB2 1 67 SER H . . 3.360 2.504 2.343 2.716 . 0 0 "[ . 1 . 2]" 2
370 1 70 LYS H 1 70 LYS HB2 . . 3.260 2.550 2.397 2.911 . 0 0 "[ . 1 . 2]" 2
371 1 70 LYS H 1 70 LYS HB3 . . 3.710 3.586 3.527 3.597 . 0 0 "[ . 1 . 2]" 2
372 1 70 LYS HB3 1 70 LYS HG2 . . 2.950 2.557 2.387 2.653 . 0 0 "[ . 1 . 2]" 2
373 1 70 LYS HB3 1 70 LYS HD3 . . 2.870 2.671 2.438 3.013 0.143 18 0 "[ . 1 . 2]" 2
374 1 42 VAL HB 1 55 TYR HH . . 3.510 2.322 1.988 2.852 . 0 0 "[ . 1 . 2]" 2
375 1 27 MET H 1 27 MET HG3 . . 4.560 3.882 3.548 4.428 . 0 0 "[ . 1 . 2]" 2
376 1 27 MET HG3 1 38 HIS HD2 . . 4.020 2.136 1.985 2.788 . 0 0 "[ . 1 . 2]" 2
377 1 27 MET HA 1 27 MET HG3 . . 3.870 3.073 2.819 3.676 . 0 0 "[ . 1 . 2]" 2
378 1 69 MET H 1 69 MET HG2 . . 3.840 3.645 2.804 3.843 0.003 14 0 "[ . 1 . 2]" 2
379 1 20 PRO HB2 1 21 TYR H . . 4.010 2.756 2.630 2.815 . 0 0 "[ . 1 . 2]" 2
380 1 11 VAL MG2 1 20 PRO HB2 . . 4.330 2.520 1.996 3.534 . 0 0 "[ . 1 . 2]" 2
381 1 13 VAL MG1 1 20 PRO HB2 . . 4.680 4.611 4.495 4.707 0.027 4 0 "[ . 1 . 2]" 2
382 1 11 VAL H 1 11 VAL HB . . 3.420 2.968 2.584 3.480 0.060 16 0 "[ . 1 . 2]" 2
383 1 11 VAL HB 1 12 PRO HD2 . . 4.220 3.630 3.414 3.892 . 0 0 "[ . 1 . 2]" 2
384 1 20 PRO HB3 1 21 TYR H . . 4.000 3.809 3.739 3.842 . 0 0 "[ . 1 . 2]" 2
385 1 27 MET HA 1 27 MET HG2 . . 3.870 2.308 2.187 2.484 . 0 0 "[ . 1 . 2]" 2
386 1 12 PRO HB3 1 13 VAL H . . 3.860 3.575 3.359 3.995 0.135 15 0 "[ . 1 . 2]" 2
387 1 12 PRO HB2 1 13 VAL H . . 3.850 2.833 2.422 3.524 . 0 0 "[ . 1 . 2]" 2
388 1 12 PRO HB2 1 14 TYR QE . . 4.430 4.312 3.735 4.469 0.039 2 0 "[ . 1 . 2]" 2
389 1 58 PRO HB3 1 59 ASP H . . 4.630 4.546 4.528 4.572 . 0 0 "[ . 1 . 2]" 2
390 1 23 VAL H 1 23 VAL HB . . 3.560 2.585 2.244 2.972 . 0 0 "[ . 1 . 2]" 2
391 1 58 PRO HB2 1 59 ASP H . . 4.120 4.042 4.008 4.090 . 0 0 "[ . 1 . 2]" 2
392 1 30 CYS HB3 1 57 CYS HB3 . . 4.020 3.323 3.066 3.559 . 0 0 "[ . 1 . 2]" 2
393 1 30 CYS H 1 30 CYS HB3 . . 3.530 2.424 2.363 2.505 . 0 0 "[ . 1 . 2]" 2
394 1 30 CYS HB3 1 35 ASP H . . 3.930 2.102 1.879 2.444 . 0 0 "[ . 1 . 2]" 2
395 1 30 CYS HB3 1 34 GLN H . . 3.990 3.056 2.906 3.159 . 0 0 "[ . 1 . 2]" 2
396 1 30 CYS HB3 1 37 PHE QE . . 3.560 3.207 2.868 3.545 . 0 0 "[ . 1 . 2]" 2
397 1 33 CYS H 1 33 CYS HB3 . . 4.060 3.283 2.955 3.785 . 0 0 "[ . 1 . 2]" 2
398 1 30 CYS H 1 30 CYS HB2 . . 3.630 2.681 2.569 2.770 . 0 0 "[ . 1 . 2]" 2
399 1 30 CYS HB2 1 37 PHE QE . . 3.540 2.983 2.537 3.336 . 0 0 "[ . 1 . 2]" 2
400 1 33 CYS H 1 33 CYS HB2 . . 4.060 3.381 2.662 3.761 . 0 0 "[ . 1 . 2]" 2
401 1 50 VAL HB 1 51 ASP H . . 4.300 4.141 4.065 4.293 . 0 0 "[ . 1 . 2]" 2
402 1 50 VAL H 1 50 VAL HB . . 3.070 2.480 2.408 2.648 . 0 0 "[ . 1 . 2]" 2
403 1 69 MET HB2 1 70 LYS H . . 4.120 4.031 3.733 4.163 0.043 16 0 "[ . 1 . 2]" 2
404 1 69 MET H 1 69 MET HB2 . . 3.590 2.638 2.488 2.734 . 0 0 "[ . 1 . 2]" 2
405 1 45 GLU HB3 1 46 GLU H . . 3.610 2.790 2.474 3.120 . 0 0 "[ . 1 . 2]" 2
406 1 45 GLU H 1 45 GLU HB3 . . 3.800 3.595 3.470 3.732 . 0 0 "[ . 1 . 2]" 2
407 1 45 GLU H 1 45 GLU HB2 . . 3.560 2.356 2.187 2.575 . 0 0 "[ . 1 . 2]" 2
408 1 41 CYS H 1 41 CYS HB3 . . 3.630 3.587 3.545 3.644 0.014 8 0 "[ . 1 . 2]" 2
409 1 60 CYS HB3 1 61 GLU H . . 4.090 3.840 3.756 3.917 . 0 0 "[ . 1 . 2]" 2
410 1 60 CYS H 1 60 CYS HB3 . . 3.780 3.652 3.633 3.674 . 0 0 "[ . 1 . 2]" 2
411 1 32 LEU MD1 1 60 CYS HB3 . . 3.630 1.885 1.789 1.973 . 0 0 "[ . 1 . 2]" 2
412 1 47 GLU H 1 47 GLU HB3 . . 3.650 2.517 2.383 2.746 . 0 0 "[ . 1 . 2]" 2
413 1 47 GLU HA 1 47 GLU HB3 . . 3.020 2.464 2.339 2.529 . 0 0 "[ . 1 . 2]" 2
414 1 61 GLU H 1 61 GLU HB3 . . 3.250 2.385 2.331 2.473 . 0 0 "[ . 1 . 2]" 2
415 1 61 GLU HB3 1 62 ALA H . . 3.520 3.136 2.931 3.344 . 0 0 "[ . 1 . 2]" 2
416 1 47 GLU H 1 47 GLU HB2 . . 3.650 3.587 3.571 3.605 . 0 0 "[ . 1 . 2]" 2
417 1 57 CYS H 1 57 CYS HB3 . . 3.090 2.317 2.304 2.357 . 0 0 "[ . 1 . 2]" 2
418 1 37 PHE QD 1 57 CYS HB3 . . 4.360 3.806 3.581 4.267 . 0 0 "[ . 1 . 2]" 2
419 1 47 GLU HA 1 47 GLU HB2 . . 3.020 2.433 2.372 2.572 . 0 0 "[ . 1 . 2]" 2
420 1 30 CYS HB2 1 57 CYS HB3 . . 3.560 2.138 1.988 2.307 . 0 0 "[ . 1 . 2]" 2
421 1 46 GLU HB3 1 47 GLU H . . 3.330 2.684 2.390 2.930 . 0 0 "[ . 1 . 2]" 2
422 1 46 GLU H 1 46 GLU HB3 . . 3.270 2.599 2.382 2.878 . 0 0 "[ . 1 . 2]" 2
423 1 70 LYS HB3 1 70 LYS HD2 . . 2.840 2.552 2.308 2.922 0.082 20 0 "[ . 1 . 2]" 2
424 1 46 GLU HB2 1 47 GLU H . . 4.120 3.876 3.601 4.006 . 0 0 "[ . 1 . 2]" 2
425 1 46 GLU H 1 46 GLU HB2 . . 3.190 2.463 2.219 2.689 . 0 0 "[ . 1 . 2]" 2
426 1 57 CYS HB2 1 58 PRO HD3 . . 3.860 3.282 3.239 3.313 . 0 0 "[ . 1 . 2]" 2
427 1 27 MET H 1 28 ILE HG13 . . 4.940 4.583 4.085 4.889 . 0 0 "[ . 1 . 2]" 2
428 1 28 ILE HG13 1 29 GLU H . . 5.350 4.658 4.557 4.768 . 0 0 "[ . 1 . 2]" 2
429 1 28 ILE HG12 1 44 ILE MG . . 3.130 2.594 2.175 2.976 . 0 0 "[ . 1 . 2]" 2
430 1 28 ILE HG12 1 29 GLU H . . 4.680 4.630 4.464 4.838 0.158 1 0 "[ . 1 . 2]" 2
431 1 16 LEU H 1 16 LEU HG . . 3.640 1.886 1.842 1.933 . 0 0 "[ . 1 . 2]" 2
432 1 16 LEU HG 1 37 PHE QD . . 4.000 2.317 2.097 2.517 . 0 0 "[ . 1 . 2]" 2
433 1 16 LEU HA 1 16 LEU HG . . 4.000 3.174 3.098 3.220 . 0 0 "[ . 1 . 2]" 2
434 1 13 VAL MG1 1 20 PRO HG3 . . 4.220 4.111 3.990 4.217 . 0 0 "[ . 1 . 2]" 2
435 1 52 ILE HA 1 52 ILE HG12 . . 3.260 2.576 2.499 2.648 . 0 0 "[ . 1 . 2]" 2
436 1 52 ILE H 1 52 ILE HG12 . . 3.850 3.619 3.474 3.852 0.002 10 0 "[ . 1 . 2]" 2
437 1 52 ILE HG12 1 52 ILE MG . . 2.520 2.281 2.211 2.511 . 0 0 "[ . 1 . 2]" 2
438 1 49 ALA HA 1 52 ILE HG13 . . 3.460 2.763 2.292 2.948 . 0 0 "[ . 1 . 2]" 2
439 1 52 ILE HG13 1 52 ILE MG . . 3.320 3.193 3.183 3.200 . 0 0 "[ . 1 . 2]" 2
440 1 68 ILE H 1 68 ILE HG12 . . 3.580 1.939 1.862 2.035 . 0 0 "[ . 1 . 2]" 2
441 1 54 ILE HB 1 68 ILE HG12 . . 3.380 2.348 2.056 2.566 . 0 0 "[ . 1 . 2]" 2
442 1 68 ILE HA 1 68 ILE HG13 . . 3.890 3.785 3.741 3.830 . 0 0 "[ . 1 . 2]" 2
443 1 68 ILE HG13 1 68 ILE MG . . 2.870 2.302 2.265 2.416 . 0 0 "[ . 1 . 2]" 2
444 1 68 ILE H 1 68 ILE HG13 . . 3.640 3.505 3.441 3.586 . 0 0 "[ . 1 . 2]" 2
445 1 10 LEU H 1 10 LEU HG . . 3.800 2.842 1.899 3.800 . 0 0 "[ . 1 . 2]" 2
446 1 44 ILE H 1 44 ILE HG13 . . 3.330 3.047 2.871 3.168 . 0 0 "[ . 1 . 2]" 2
447 1 44 ILE HA 1 44 ILE HG13 . . 3.800 2.852 2.787 2.951 . 0 0 "[ . 1 . 2]" 2
448 1 44 ILE HB 1 44 ILE HG13 . . 2.650 2.506 2.447 2.549 . 0 0 "[ . 1 . 2]" 2
449 1 42 VAL MG2 1 44 ILE HG13 . . 2.710 2.136 2.011 2.502 . 0 0 "[ . 1 . 2]" 2
450 1 44 ILE HA 1 44 ILE HG12 . . 3.560 2.520 2.416 2.622 . 0 0 "[ . 1 . 2]" 2
451 1 44 ILE HG12 1 44 ILE MG . . 3.240 2.365 2.227 2.456 . 0 0 "[ . 1 . 2]" 2
452 1 54 ILE HG13 1 68 ILE HB . . 3.410 2.651 2.432 2.891 . 0 0 "[ . 1 . 2]" 2
453 1 32 LEU H 1 32 LEU HG . . 3.480 2.975 2.876 3.091 . 0 0 "[ . 1 . 2]" 2
454 1 32 LEU HA 1 32 LEU HG . . 3.530 3.191 3.109 3.336 . 0 0 "[ . 1 . 2]" 2
455 1 70 LYS H 1 70 LYS HG2 . . 3.300 3.058 2.411 3.376 0.076 20 0 "[ . 1 . 2]" 2
456 1 53 ASP HA 1 70 LYS HG2 . . 4.260 2.318 1.991 2.667 . 0 0 "[ . 1 . 2]" 2
457 1 16 LEU H 1 16 LEU MD1 . . 3.520 3.244 3.101 3.345 . 0 0 "[ . 1 . 2]" 2
458 1 16 LEU MD1 1 17 CYS H . . 4.880 4.382 4.169 4.529 . 0 0 "[ . 1 . 2]" 2
459 1 16 LEU MD1 1 37 PHE QD . . 3.990 3.443 3.203 3.764 . 0 0 "[ . 1 . 2]" 2
460 1 53 ASP HA 1 70 LYS HG3 . . 3.740 2.757 2.424 3.534 . 0 0 "[ . 1 . 2]" 2
461 1 70 LYS HA 1 70 LYS HG3 . . 3.540 3.318 3.050 3.582 0.042 17 0 "[ . 1 . 2]" 2
462 1 53 ASP HB2 1 70 LYS HG3 . . 3.860 2.876 2.372 3.202 . 0 0 "[ . 1 . 2]" 2
463 1 32 LEU H 1 32 LEU MD1 . . 4.160 4.102 4.020 4.242 0.082 14 0 "[ . 1 . 2]" 2
464 1 32 LEU MD1 1 64 PHE H . . 4.340 4.026 3.804 4.303 . 0 0 "[ . 1 . 2]" 2
465 1 32 LEU MD1 1 56 HIS HE1 . . 3.480 3.076 2.714 3.291 . 0 0 "[ . 1 . 2]" 2
466 1 32 LEU MD1 1 64 PHE QD . . 3.180 2.688 2.451 2.889 . 0 0 "[ . 1 . 2]" 2
467 1 32 LEU MD1 1 56 HIS HD2 . . 4.050 3.237 2.921 3.585 . 0 0 "[ . 1 . 2]" 2
468 1 32 LEU HA 1 32 LEU MD1 . . 4.100 3.877 3.802 3.916 . 0 0 "[ . 1 . 2]" 2
469 1 32 LEU MD1 1 64 PHE HB2 . . 3.520 2.478 2.231 2.823 . 0 0 "[ . 1 . 2]" 2
470 1 32 LEU MD1 1 60 CYS HB2 . . 3.100 2.159 1.949 2.556 . 0 0 "[ . 1 . 2]" 2
471 1 32 LEU MD1 1 64 PHE HB3 . . 3.310 2.838 2.494 3.218 . 0 0 "[ . 1 . 2]" 2
472 1 32 LEU HB3 1 32 LEU MD1 . . 3.240 2.355 2.181 2.468 . 0 0 "[ . 1 . 2]" 2
473 1 16 LEU H 1 16 LEU MD2 . . 3.520 3.291 3.174 3.418 . 0 0 "[ . 1 . 2]" 2
474 1 16 LEU MD2 1 37 PHE QD . . 3.990 3.184 2.886 3.448 . 0 0 "[ . 1 . 2]" 2
475 1 16 LEU MD2 1 58 PRO HG2 . . 3.730 2.761 2.564 2.889 . 0 0 "[ . 1 . 2]" 2
476 1 16 LEU HB3 1 16 LEU MD2 . . 3.170 2.169 2.056 2.277 . 0 0 "[ . 1 . 2]" 2
477 1 16 LEU MD2 1 37 PHE QE . . 4.420 2.175 1.924 2.606 . 0 0 "[ . 1 . 2]" 2
478 1 42 VAL H 1 42 VAL MG1 . . 3.100 2.406 2.217 2.576 . 0 0 "[ . 1 . 2]" 2
479 1 42 VAL HA 1 42 VAL MG1 . . 3.060 2.456 2.391 2.575 . 0 0 "[ . 1 . 2]" 2
480 1 42 VAL MG1 1 58 PRO HD2 . . 3.950 3.077 2.753 3.508 . 0 0 "[ . 1 . 2]" 2
481 1 37 PHE HB3 1 42 VAL MG1 . . 3.280 2.021 1.897 2.170 . 0 0 "[ . 1 . 2]" 2
482 1 37 PHE HB2 1 42 VAL MG1 . . 2.930 1.983 1.933 2.070 . 0 0 "[ . 1 . 2]" 2
483 1 16 LEU HG 1 42 VAL MG1 . . 4.290 4.040 3.682 4.323 0.033 7 0 "[ . 1 . 2]" 2
484 1 42 VAL MG1 1 58 PRO HG3 . . 3.310 2.570 2.122 3.130 . 0 0 "[ . 1 . 2]" 2
485 1 41 CYS HB2 1 42 VAL MG1 . . 3.420 2.915 2.665 3.122 . 0 0 "[ . 1 . 2]" 2
486 1 32 LEU H 1 32 LEU MD2 . . 3.830 3.729 3.508 3.828 . 0 0 "[ . 1 . 2]" 2
487 1 32 LEU MD2 1 56 HIS HE1 . . 3.570 3.254 3.022 3.573 0.003 14 0 "[ . 1 . 2]" 2
488 1 32 LEU MD2 1 64 PHE QD . . 3.950 2.987 2.516 3.485 . 0 0 "[ . 1 . 2]" 2
489 1 32 LEU MD2 1 64 PHE QE . . 4.290 3.051 2.588 3.453 . 0 0 "[ . 1 . 2]" 2
490 1 32 LEU MD2 1 56 HIS HD2 . . 4.270 3.728 3.382 3.933 . 0 0 "[ . 1 . 2]" 2
491 1 32 LEU HA 1 32 LEU MD2 . . 2.780 2.117 1.930 2.311 . 0 0 "[ . 1 . 2]" 2
492 1 32 LEU HB3 1 32 LEU MD2 . . 3.210 2.332 2.239 2.452 . 0 0 "[ . 1 . 2]" 2
493 1 13 VAL MG1 1 19 GLN H . . 3.230 3.096 2.924 3.264 0.034 14 0 "[ . 1 . 2]" 2
494 1 13 VAL MG1 1 20 PRO HA . . 3.300 3.069 2.805 3.346 0.046 4 0 "[ . 1 . 2]" 2
495 1 13 VAL H 1 13 VAL MG1 . . 3.510 2.562 2.408 2.784 . 0 0 "[ . 1 . 2]" 2
496 1 13 VAL MG1 1 20 PRO HD3 . . 3.440 2.510 2.320 2.653 . 0 0 "[ . 1 . 2]" 2
497 1 13 VAL MG1 1 19 GLN HB2 . . 4.370 4.322 4.234 4.399 0.029 5 0 "[ . 1 . 2]" 2
498 1 13 VAL MG1 1 20 PRO HB3 . . 3.420 3.336 3.189 3.447 0.027 8 0 "[ . 1 . 2]" 2
499 1 11 VAL H 1 11 VAL MG2 . . 3.970 3.717 1.859 3.925 . 0 0 "[ . 1 . 2]" 2
500 1 11 VAL MG2 1 20 PRO HB3 . . 3.040 2.709 2.186 3.441 0.401 15 0 "[ . 1 . 2]" 2
501 1 63 VAL MG2 1 64 PHE H . . 3.940 3.603 3.514 3.664 . 0 0 "[ . 1 . 2]" 2
502 1 63 VAL MG2 1 64 PHE QD . . 4.130 4.013 3.874 4.124 . 0 0 "[ . 1 . 2]" 2
503 1 63 VAL H 1 63 VAL MG2 . . 3.960 2.668 2.550 2.726 . 0 0 "[ . 1 . 2]" 2
504 1 60 CYS HA 1 63 VAL MG2 . . 5.270 3.516 3.361 3.727 . 0 0 "[ . 1 . 2]" 2
505 1 63 VAL HA 1 63 VAL MG2 . . 2.990 2.497 2.475 2.544 . 0 0 "[ . 1 . 2]" 2
506 1 63 VAL MG1 1 64 PHE H . . 3.940 3.514 3.435 3.604 . 0 0 "[ . 1 . 2]" 2
507 1 63 VAL MG1 1 64 PHE QD . . 4.130 3.608 3.331 3.722 . 0 0 "[ . 1 . 2]" 2
508 1 63 VAL H 1 63 VAL MG1 . . 3.960 3.937 3.913 3.950 . 0 0 "[ . 1 . 2]" 2
509 1 63 VAL HA 1 63 VAL MG1 . . 2.990 2.246 2.160 2.383 . 0 0 "[ . 1 . 2]" 2
510 1 58 PRO HA 1 61 GLU HB3 . . 3.000 2.868 2.739 3.012 0.012 7 0 "[ . 1 . 2]" 2
511 1 58 PRO HA 1 61 GLU HB2 . . 3.960 3.873 3.741 3.974 0.014 9 0 "[ . 1 . 2]" 2
512 1 50 VAL MG1 1 51 ASP HA . . 4.650 3.525 3.364 3.764 . 0 0 "[ . 1 . 2]" 2
513 1 50 VAL MG2 1 51 ASP HA . . 4.650 3.868 3.508 4.009 . 0 0 "[ . 1 . 2]" 2
514 1 11 VAL H 1 11 VAL MG1 . . 3.970 2.084 1.827 3.742 . 0 0 "[ . 1 . 2]" 2
515 1 11 VAL HA 1 11 VAL MG1 . . 3.300 3.141 2.285 3.197 . 0 0 "[ . 1 . 2]" 2
516 1 11 VAL MG1 1 12 PRO HD2 . . 4.310 4.090 1.853 4.341 0.031 14 0 "[ . 1 . 2]" 2
517 1 11 VAL MG1 1 20 PRO HB2 . . 4.330 2.158 1.923 3.210 . 0 0 "[ . 1 . 2]" 2
518 1 11 VAL MG1 1 20 PRO HB3 . . 3.040 2.042 1.947 2.640 . 0 0 "[ . 1 . 2]" 2
519 1 23 VAL H 1 23 VAL MG1 . . 4.160 2.358 1.939 3.766 . 0 0 "[ . 1 . 2]" 2
520 1 23 VAL MG1 1 24 ASN H . . 4.450 2.252 1.864 3.557 . 0 0 "[ . 1 . 2]" 2
521 1 23 VAL MG1 1 24 ASN HA . . 5.360 3.371 3.100 3.927 . 0 0 "[ . 1 . 2]" 2
522 1 23 VAL H 1 23 VAL MG2 . . 4.160 3.561 2.010 3.859 . 0 0 "[ . 1 . 2]" 2
523 1 23 VAL MG2 1 24 ASN H . . 4.450 3.709 3.465 4.172 . 0 0 "[ . 1 . 2]" 2
524 1 23 VAL HA 1 23 VAL MG2 . . 3.600 2.331 2.136 2.430 . 0 0 "[ . 1 . 2]" 2
525 1 60 CYS HA 1 64 PHE QD . . 3.480 3.338 3.103 3.488 0.008 4 0 "[ . 1 . 2]" 2
526 1 32 LEU MD1 1 60 CYS HA . . 4.300 3.949 3.798 4.178 . 0 0 "[ . 1 . 2]" 2
527 1 9 ALA H 1 9 ALA MB . . 3.120 2.390 2.092 2.859 . 0 0 "[ . 1 . 2]" 2
528 1 9 ALA MB 1 10 LEU H . . 3.110 2.902 2.395 3.301 0.191 5 0 "[ . 1 . 2]" 2
529 1 60 CYS HA 1 63 VAL HB . . 4.230 3.735 3.554 3.827 . 0 0 "[ . 1 . 2]" 2
530 1 49 ALA H 1 49 ALA MB . . 2.960 2.068 2.029 2.196 . 0 0 "[ . 1 . 2]" 2
531 1 28 ILE HG13 1 49 ALA MB . . 4.790 4.144 3.504 4.625 . 0 0 "[ . 1 . 2]" 2
532 1 46 GLU HB2 1 49 ALA MB . . 5.500 4.341 4.169 4.629 . 0 0 "[ . 1 . 2]" 2
533 1 49 ALA MB 1 52 ILE MD . . 3.400 3.119 2.964 3.341 . 0 0 "[ . 1 . 2]" 2
534 1 44 ILE MG 1 49 ALA MB . . 3.250 2.837 2.470 3.097 . 0 0 "[ . 1 . 2]" 2
535 1 28 ILE MD 1 49 ALA MB . . 5.500 4.921 4.274 5.428 . 0 0 "[ . 1 . 2]" 2
536 1 48 ASN H 1 49 ALA MB . . 3.990 3.848 3.780 3.922 . 0 0 "[ . 1 . 2]" 2
537 1 26 PHE QD 1 49 ALA MB . . 4.280 3.731 3.274 4.167 . 0 0 "[ . 1 . 2]" 2
538 1 26 PHE QE 1 49 ALA MB . . 3.370 2.110 1.764 2.754 . 0 0 "[ . 1 . 2]" 2
539 1 26 PHE HZ 1 49 ALA MB . . 3.080 2.258 1.837 2.978 . 0 0 "[ . 1 . 2]" 2
540 1 62 ALA H 1 62 ALA MB . . 2.680 2.089 2.039 2.284 . 0 0 "[ . 1 . 2]" 2
541 1 62 ALA MB 1 63 VAL H . . 3.300 3.267 3.170 3.337 0.037 3 0 "[ . 1 . 2]" 2
542 1 59 ASP HA 1 62 ALA MB . . 3.690 3.584 3.454 3.699 0.009 4 0 "[ . 1 . 2]" 2
543 1 62 ALA MB 1 63 VAL HA . . 4.250 4.174 4.114 4.226 . 0 0 "[ . 1 . 2]" 2
544 1 67 SER H 1 67 SER HB2 . . 3.960 3.276 2.551 3.665 . 0 0 "[ . 1 . 2]" 2
545 1 31 GLY H 1 54 ILE MG . . 3.300 2.640 2.533 2.785 . 0 0 "[ . 1 . 2]" 2
546 1 54 ILE MG 1 55 TYR H . . 3.350 3.128 2.922 3.347 . 0 0 "[ . 1 . 2]" 2
547 1 54 ILE MG 1 56 HIS HD2 . . 3.410 2.423 2.116 2.663 . 0 0 "[ . 1 . 2]" 2
548 1 54 ILE HA 1 54 ILE MG . . 2.980 2.341 2.216 2.409 . 0 0 "[ . 1 . 2]" 2
549 1 31 GLY HA2 1 54 ILE MG . . 3.580 3.437 3.243 3.610 0.030 4 0 "[ . 1 . 2]" 2
550 1 31 GLY HA3 1 54 ILE MG . . 3.110 2.000 1.873 2.144 . 0 0 "[ . 1 . 2]" 2
551 1 54 ILE MD 1 54 ILE MG . . 2.480 1.943 1.881 2.068 . 0 0 "[ . 1 . 2]" 2
552 1 32 LEU MD2 1 54 ILE MG . . 5.500 3.246 2.859 3.479 . 0 0 "[ . 1 . 2]" 2
553 1 12 PRO HA 1 13 VAL MG2 . . 3.940 3.861 3.647 3.940 0.000 6 0 "[ . 1 . 2]" 2
554 1 12 PRO HB2 1 13 VAL MG2 . . 4.710 4.023 3.785 4.737 0.027 15 0 "[ . 1 . 2]" 2
555 1 13 VAL MG2 1 18 ARG HG2 . . 5.080 4.571 3.814 5.071 . 0 0 "[ . 1 . 2]" 2
556 1 13 VAL MG2 1 14 TYR H . . 4.330 3.619 3.384 3.986 . 0 0 "[ . 1 . 2]" 2
557 1 13 VAL MG2 1 19 GLN H . . 4.710 4.046 3.480 4.277 . 0 0 "[ . 1 . 2]" 2
558 1 13 VAL H 1 13 VAL MG2 . . 3.230 1.933 1.854 2.052 . 0 0 "[ . 1 . 2]" 2
559 1 13 VAL MG2 1 14 TYR HA . . 4.510 3.810 3.687 4.079 . 0 0 "[ . 1 . 2]" 2
560 1 13 VAL HA 1 13 VAL MG2 . . 3.670 3.200 3.189 3.203 . 0 0 "[ . 1 . 2]" 2
561 1 13 VAL MG2 1 18 ARG HA . . 3.270 2.429 1.969 2.666 . 0 0 "[ . 1 . 2]" 2
562 1 53 ASP H 1 68 ILE MG . . 4.120 4.078 3.861 4.183 0.063 10 0 "[ . 1 . 2]" 2
563 1 68 ILE MG 1 69 MET H . . 3.050 1.910 1.789 2.164 . 0 0 "[ . 1 . 2]" 2
564 1 54 ILE H 1 54 ILE MG . . 4.300 3.930 3.912 3.975 . 0 0 "[ . 1 . 2]" 2
565 1 53 ASP HB2 1 68 ILE MG . . 3.820 3.306 3.155 3.549 . 0 0 "[ . 1 . 2]" 2
566 1 54 ILE HB 1 68 ILE MG . . 3.710 3.550 3.442 3.607 . 0 0 "[ . 1 . 2]" 2
567 1 54 ILE HG13 1 54 ILE MG . . 3.560 3.190 3.180 3.200 . 0 0 "[ . 1 . 2]" 2
568 1 54 ILE HG13 1 68 ILE MG . . 4.050 3.260 2.990 3.487 . 0 0 "[ . 1 . 2]" 2
569 1 68 ILE MD 1 68 ILE MG . . 2.780 2.017 1.941 2.162 . 0 0 "[ . 1 . 2]" 2
570 1 61 GLU HG3 1 66 PRO HA . . 3.500 2.875 2.688 2.995 . 0 0 "[ . 1 . 2]" 2
571 1 12 PRO HA 1 13 VAL H . . 2.740 2.327 2.156 2.479 . 0 0 "[ . 1 . 2]" 2
572 1 12 PRO HA 1 13 VAL MG1 . . 3.740 3.634 3.549 3.787 0.047 13 0 "[ . 1 . 2]" 2
573 1 67 SER HB3 1 68 ILE H . . 4.100 3.737 2.986 4.111 0.011 3 0 "[ . 1 . 2]" 2
574 1 22 ASN HA 1 23 VAL HA . . 5.290 4.456 4.357 4.621 . 0 0 "[ . 1 . 2]" 2
575 1 23 VAL HA 1 24 ASN HA . . 5.500 4.754 4.363 4.930 . 0 0 "[ . 1 . 2]" 2
576 1 63 VAL HA 1 64 PHE HA . . 5.500 4.688 4.655 4.713 . 0 0 "[ . 1 . 2]" 2
577 1 23 VAL HA 1 23 VAL MG1 . . 3.600 3.086 2.357 3.204 . 0 0 "[ . 1 . 2]" 2
578 1 42 VAL MG2 1 44 ILE H . . 3.520 2.181 1.974 2.372 . 0 0 "[ . 1 . 2]" 2
579 1 42 VAL MG2 1 43 GLY H . . 3.770 1.909 1.779 2.144 . 0 0 "[ . 1 . 2]" 2
580 1 42 VAL H 1 42 VAL MG2 . . 3.000 2.089 1.944 2.288 . 0 0 "[ . 1 . 2]" 2
581 1 39 GLY HA3 1 42 VAL MG2 . . 3.880 3.542 3.343 3.800 . 0 0 "[ . 1 . 2]" 2
582 1 37 PHE HB3 1 42 VAL MG2 . . 3.930 3.767 3.396 3.946 0.016 15 0 "[ . 1 . 2]" 2
583 1 28 ILE MG 1 42 VAL MG2 . . 5.320 4.649 4.432 4.809 . 0 0 "[ . 1 . 2]" 2
584 1 52 ILE MG 1 55 TYR H . . 3.050 2.726 2.538 2.832 . 0 0 "[ . 1 . 2]" 2
585 1 52 ILE MG 1 53 ASP H . . 3.340 3.249 3.097 3.331 . 0 0 "[ . 1 . 2]" 2
586 1 52 ILE MG 1 54 ILE H . . 3.320 2.667 2.285 2.865 . 0 0 "[ . 1 . 2]" 2
587 1 52 ILE H 1 52 ILE MG . . 3.830 3.769 3.756 3.812 . 0 0 "[ . 1 . 2]" 2
588 1 52 ILE MG 1 69 MET HA . . 4.150 3.865 3.538 4.049 . 0 0 "[ . 1 . 2]" 2
589 1 52 ILE MG 1 55 TYR HA . . 3.170 2.206 1.981 2.350 . 0 0 "[ . 1 . 2]" 2
590 1 52 ILE MG 1 54 ILE HA . . 3.610 3.569 3.452 3.652 0.042 15 0 "[ . 1 . 2]" 2
591 1 52 ILE MG 1 67 SER HB3 . . 4.110 3.375 2.591 3.996 . 0 0 "[ . 1 . 2]" 2
592 1 52 ILE MG 1 55 TYR HB2 . . 3.420 2.040 1.952 2.292 . 0 0 "[ . 1 . 2]" 2
593 1 52 ILE MG 1 55 TYR HB3 . . 3.320 3.262 3.125 3.358 0.038 19 0 "[ . 1 . 2]" 2
594 1 28 ILE MG 1 52 ILE MG . . 3.630 3.389 3.240 3.637 0.007 19 0 "[ . 1 . 2]" 2
595 1 44 ILE MG 1 45 GLU H . . 3.300 2.424 1.960 2.787 . 0 0 "[ . 1 . 2]" 2
596 1 26 PHE QD 1 44 ILE MG . . 4.270 4.068 3.728 4.278 0.008 10 0 "[ . 1 . 2]" 2
597 1 44 ILE HA 1 44 ILE MG . . 3.050 2.433 2.371 2.503 . 0 0 "[ . 1 . 2]" 2
598 1 28 ILE MD 1 44 ILE MG . . 5.500 3.569 2.807 4.147 . 0 0 "[ . 1 . 2]" 2
599 1 44 ILE H 1 44 ILE MG . . 3.990 3.800 3.764 3.824 . 0 0 "[ . 1 . 2]" 2
600 1 44 ILE MG 1 49 ALA H . . 3.400 3.337 3.203 3.408 0.008 17 0 "[ . 1 . 2]" 2
601 1 44 ILE MG 1 48 ASN H . . 4.380 4.192 4.046 4.339 . 0 0 "[ . 1 . 2]" 2
602 1 26 PHE QE 1 44 ILE MG . . 3.240 2.460 1.975 2.864 . 0 0 "[ . 1 . 2]" 2
603 1 26 PHE HZ 1 44 ILE MG . . 3.940 2.610 1.828 3.869 . 0 0 "[ . 1 . 2]" 2
604 1 44 ILE MG 1 48 ASN HB2 . . 3.480 2.962 2.787 3.295 . 0 0 "[ . 1 . 2]" 2
605 1 52 ILE HA 1 53 ASP H . . 3.190 2.199 2.168 2.230 . 0 0 "[ . 1 . 2]" 2
606 1 40 SER H 1 40 SER HB3 . . 3.660 3.010 2.331 3.634 . 0 0 "[ . 1 . 2]" 2
607 1 52 ILE HA 1 70 LYS H . . 3.810 3.423 3.185 3.753 . 0 0 "[ . 1 . 2]" 2
608 1 52 ILE HA 1 69 MET HA . . 3.220 2.473 2.155 2.581 . 0 0 "[ . 1 . 2]" 2
609 1 52 ILE HA 1 52 ILE HG13 . . 3.130 2.927 2.839 3.186 0.056 19 0 "[ . 1 . 2]" 2
610 1 52 ILE HA 1 52 ILE MG . . 2.900 2.440 2.257 2.485 . 0 0 "[ . 1 . 2]" 2
611 1 52 ILE H 1 69 MET ME . . 4.270 3.845 2.808 4.268 . 0 0 "[ . 1 . 2]" 2
612 1 51 ASP H 1 69 MET ME . . 4.810 4.449 3.761 4.780 . 0 0 "[ . 1 . 2]" 2
613 1 69 MET HA 1 69 MET ME . . 4.400 3.292 2.501 3.711 . 0 0 "[ . 1 . 2]" 2
614 1 51 ASP HA 1 69 MET ME . . 4.730 4.289 3.859 4.599 . 0 0 "[ . 1 . 2]" 2
615 1 52 ILE HA 1 69 MET ME . . 4.000 2.940 1.816 3.577 . 0 0 "[ . 1 . 2]" 2
616 1 51 ASP HB3 1 69 MET ME . . 3.220 2.358 1.849 2.973 . 0 0 "[ . 1 . 2]" 2
617 1 69 MET ME 1 69 MET HG3 . . 3.520 3.238 2.395 3.382 . 0 0 "[ . 1 . 2]" 2
618 1 51 ASP HB2 1 69 MET ME . . 3.220 2.998 2.711 3.237 0.017 18 0 "[ . 1 . 2]" 2
619 1 69 MET ME 1 69 MET HG2 . . 3.520 2.240 2.032 3.371 . 0 0 "[ . 1 . 2]" 2
620 1 69 MET HB2 1 69 MET ME . . 4.030 3.820 3.420 4.096 0.066 11 0 "[ . 1 . 2]" 2
621 1 52 ILE HG12 1 69 MET ME . . 4.950 2.742 1.875 3.452 . 0 0 "[ . 1 . 2]" 2
622 1 52 ILE HG13 1 69 MET ME . . 3.200 3.037 2.027 3.230 0.030 10 0 "[ . 1 . 2]" 2
623 1 27 MET ME 1 37 PHE H . . 3.260 2.714 2.236 3.357 0.097 16 0 "[ . 1 . 2]" 2
624 1 14 TYR H 1 27 MET ME . . 4.290 4.282 4.020 4.398 0.108 9 0 "[ . 1 . 2]" 2
625 1 15 CYS H 1 27 MET ME . . 3.840 3.320 3.026 3.666 . 0 0 "[ . 1 . 2]" 2
626 1 27 MET ME 1 38 HIS HE1 . . 4.310 3.840 3.524 4.230 . 0 0 "[ . 1 . 2]" 2
627 1 14 TYR QD 1 27 MET ME . . 3.540 3.326 2.748 3.576 0.036 15 0 "[ . 1 . 2]" 2
628 1 27 MET ME 1 36 TRP HE3 . . 3.610 3.336 2.827 3.700 0.090 4 0 "[ . 1 . 2]" 2
629 1 27 MET ME 1 38 HIS HD2 . . 4.200 3.571 3.069 4.010 . 0 0 "[ . 1 . 2]" 2
630 1 21 TYR QD 1 27 MET ME . . 4.490 3.230 1.995 4.226 . 0 0 "[ . 1 . 2]" 2
631 1 27 MET HA 1 27 MET ME . . 4.330 3.835 3.346 4.292 . 0 0 "[ . 1 . 2]" 2
632 1 27 MET ME 1 36 TRP HA . . 4.600 3.629 3.302 4.139 . 0 0 "[ . 1 . 2]" 2
633 1 15 CYS HB3 1 27 MET ME . . 4.720 3.910 3.543 4.422 . 0 0 "[ . 1 . 2]" 2
634 1 27 MET ME 1 36 TRP HB3 . . 3.310 1.971 1.890 2.150 . 0 0 "[ . 1 . 2]" 2
635 1 15 CYS HB2 1 27 MET ME . . 2.980 2.528 2.191 3.008 0.028 16 0 "[ . 1 . 2]" 2
636 1 14 TYR HB2 1 27 MET ME . . 3.420 3.169 3.094 3.244 . 0 0 "[ . 1 . 2]" 2
637 1 27 MET HB3 1 27 MET ME . . 2.910 2.662 2.295 2.917 0.007 9 0 "[ . 1 . 2]" 2
638 1 28 ILE MG 1 29 GLU H . . 3.550 2.399 1.807 2.955 . 0 0 "[ . 1 . 2]" 2
639 1 26 PHE QE 1 28 ILE MG . . 3.620 3.040 2.359 3.626 0.006 3 0 "[ . 1 . 2]" 2
640 1 26 PHE HZ 1 28 ILE MG . . 3.350 2.204 1.884 2.769 . 0 0 "[ . 1 . 2]" 2
641 1 28 ILE MG 1 49 ALA HA . . 4.440 3.523 3.303 3.863 . 0 0 "[ . 1 . 2]" 2
642 1 28 ILE MG 1 55 TYR HB2 . . 4.030 2.580 2.078 3.055 . 0 0 "[ . 1 . 2]" 2
643 1 28 ILE MG 1 55 TYR HB3 . . 3.610 2.891 2.042 3.620 0.010 14 0 "[ . 1 . 2]" 2
644 1 28 ILE MG 1 49 ALA MB . . 3.130 2.458 2.113 2.826 . 0 0 "[ . 1 . 2]" 2
645 1 28 ILE HG13 1 28 ILE MG . . 2.760 2.571 2.329 2.770 0.010 18 0 "[ . 1 . 2]" 2
646 1 28 ILE MG 1 44 ILE MG . . 3.400 2.773 2.371 3.130 . 0 0 "[ . 1 . 2]" 2
647 1 28 ILE HG12 1 28 ILE MG . . 2.460 2.137 1.965 2.394 . 0 0 "[ . 1 . 2]" 2
648 1 28 ILE MD 1 28 ILE MG . . 3.310 3.188 3.090 3.253 . 0 0 "[ . 1 . 2]" 2
649 1 28 ILE H 1 28 ILE MD . . 2.780 1.924 1.849 2.271 . 0 0 "[ . 1 . 2]" 2
650 1 28 ILE MD 1 37 PHE QD . . 4.490 3.492 2.709 4.465 . 0 0 "[ . 1 . 2]" 2
651 1 28 ILE MD 1 42 VAL H . . 5.120 4.608 4.192 4.998 . 0 0 "[ . 1 . 2]" 2
652 1 26 PHE QE 1 28 ILE MD . . 3.540 3.199 2.488 3.562 0.022 17 0 "[ . 1 . 2]" 2
653 1 26 PHE HZ 1 28 ILE MD . . 4.490 4.080 3.645 4.562 0.072 16 0 "[ . 1 . 2]" 2
654 1 28 ILE MD 1 55 TYR HD1 . . 4.940 4.330 3.617 4.728 . 0 0 "[ . 1 . 2]" 2
655 1 27 MET HA 1 28 ILE MD . . 4.070 3.128 2.554 3.488 . 0 0 "[ . 1 . 2]" 2
656 1 28 ILE MD 1 55 TYR HB3 . . 5.130 4.603 4.028 5.144 0.014 5 0 "[ . 1 . 2]" 2
657 1 28 ILE MD 1 37 PHE HB2 . . 3.460 2.536 2.079 3.298 . 0 0 "[ . 1 . 2]" 2
658 1 28 ILE MD 1 44 ILE HB . . 4.330 3.004 1.971 3.862 . 0 0 "[ . 1 . 2]" 2
659 1 28 ILE MD 1 42 VAL MG1 . . 3.270 2.733 2.417 3.093 . 0 0 "[ . 1 . 2]" 2
660 1 28 ILE MD 1 42 VAL MG2 . . 3.190 2.163 1.787 2.500 . 0 0 "[ . 1 . 2]" 2
661 1 28 ILE MD 1 44 ILE MD . . 3.350 2.555 1.950 2.886 . 0 0 "[ . 1 . 2]" 2
662 1 54 ILE HA 1 55 TYR H . . 3.080 2.194 2.160 2.255 . 0 0 "[ . 1 . 2]" 2
663 1 54 ILE HA 1 54 ILE HG13 . . 3.600 3.180 3.144 3.200 . 0 0 "[ . 1 . 2]" 2
664 1 54 ILE HA 1 54 ILE HG12 . . 3.410 2.529 2.484 2.588 . 0 0 "[ . 1 . 2]" 2
665 1 46 GLU HA 1 49 ALA H . . 3.920 3.150 3.079 3.238 . 0 0 "[ . 1 . 2]" 2
666 1 26 PHE QD 1 46 GLU HA . . 3.890 2.772 1.983 3.460 . 0 0 "[ . 1 . 2]" 2
667 1 26 PHE QE 1 46 GLU HA . . 3.640 2.472 1.988 3.071 . 0 0 "[ . 1 . 2]" 2
668 1 26 PHE HZ 1 46 GLU HA . . 4.540 3.863 3.159 4.580 0.040 9 0 "[ . 1 . 2]" 2
669 1 46 GLU HA 1 50 VAL H . . 5.080 4.394 4.087 4.650 . 0 0 "[ . 1 . 2]" 2
670 1 46 GLU HA 1 46 GLU HG2 . . 3.720 2.988 2.502 3.389 . 0 0 "[ . 1 . 2]" 2
671 1 46 GLU HA 1 49 ALA MB . . 2.720 2.187 2.022 2.412 . 0 0 "[ . 1 . 2]" 2
672 1 52 ILE H 1 52 ILE MD . . 3.850 3.577 3.485 3.878 0.028 19 0 "[ . 1 . 2]" 2
673 1 49 ALA HA 1 52 ILE MD . . 2.890 2.045 1.972 2.441 . 0 0 "[ . 1 . 2]" 2
674 1 52 ILE HB 1 52 ILE MD . . 2.850 2.389 2.271 2.453 . 0 0 "[ . 1 . 2]" 2
675 1 44 ILE HG12 1 52 ILE MD . . 3.250 2.817 2.563 3.068 . 0 0 "[ . 1 . 2]" 2
676 1 52 ILE MD 1 52 ILE MG . . 2.400 2.039 1.871 2.238 . 0 0 "[ . 1 . 2]" 2
677 1 44 ILE MD 1 52 ILE MD . . 2.480 2.265 1.913 2.488 0.008 10 0 "[ . 1 . 2]" 2
678 1 28 ILE MD 1 52 ILE MD . . 5.500 4.728 4.330 5.093 . 0 0 "[ . 1 . 2]" 2
679 1 11 VAL HA 1 11 VAL MG2 . . 3.300 2.451 2.337 2.553 . 0 0 "[ . 1 . 2]" 2
680 1 21 TYR HA 1 22 ASN H . . 3.150 2.274 2.139 2.454 . 0 0 "[ . 1 . 2]" 2
681 1 21 TYR H 1 21 TYR HA . . 2.940 2.806 2.798 2.829 . 0 0 "[ . 1 . 2]" 2
682 1 21 TYR HA 1 21 TYR QD . . 3.590 2.858 2.456 3.314 . 0 0 "[ . 1 . 2]" 2
683 1 67 SER HA 1 68 ILE H . . 3.020 2.220 2.171 2.352 . 0 0 "[ . 1 . 2]" 2
684 1 56 HIS H 1 67 SER HA . . 3.980 3.530 3.146 3.918 . 0 0 "[ . 1 . 2]" 2
685 1 52 ILE MG 1 67 SER HA . . 5.090 4.528 4.150 4.849 . 0 0 "[ . 1 . 2]" 2
686 1 13 VAL HA 1 14 TYR H . . 2.800 2.305 2.156 2.421 . 0 0 "[ . 1 . 2]" 2
687 1 13 VAL HA 1 14 TYR QD . . 3.850 3.192 2.951 3.845 . 0 0 "[ . 1 . 2]" 2
688 1 13 VAL HA 1 20 PRO HA . . 3.370 1.952 1.899 2.142 . 0 0 "[ . 1 . 2]" 2
689 1 13 VAL HA 1 13 VAL MG1 . . 2.930 2.335 2.276 2.396 . 0 0 "[ . 1 . 2]" 2
690 1 28 ILE HA 1 29 GLU H . . 2.760 2.577 2.443 2.666 . 0 0 "[ . 1 . 2]" 2
691 1 28 ILE HA 1 28 ILE HG13 . . 3.400 3.098 2.704 3.399 . 0 0 "[ . 1 . 2]" 2
692 1 28 ILE HA 1 28 ILE MG . . 3.310 1.988 1.907 2.140 . 0 0 "[ . 1 . 2]" 2
693 1 28 ILE HA 1 28 ILE MD . . 3.710 3.619 3.460 3.693 . 0 0 "[ . 1 . 2]" 2
694 1 68 ILE HA 1 69 MET H . . 2.730 2.333 2.251 2.417 . 0 0 "[ . 1 . 2]" 2
695 1 68 ILE HA 1 68 ILE HG12 . . 3.650 3.225 3.141 3.331 . 0 0 "[ . 1 . 2]" 2
696 1 68 ILE HA 1 68 ILE MG . . 3.070 2.240 2.151 2.345 . 0 0 "[ . 1 . 2]" 2
697 1 54 ILE H 1 54 ILE MD . . 4.410 4.266 4.211 4.381 . 0 0 "[ . 1 . 2]" 2
698 1 54 ILE HA 1 54 ILE MD . . 3.920 3.805 3.774 3.849 . 0 0 "[ . 1 . 2]" 2
699 1 54 ILE MD 1 68 ILE HB . . 3.350 3.111 2.834 3.360 0.010 13 0 "[ . 1 . 2]" 2
700 1 54 ILE HB 1 54 ILE MD . . 3.060 2.476 2.373 2.546 . 0 0 "[ . 1 . 2]" 2
701 1 64 PHE HA 1 64 PHE QD . . 3.580 3.049 3.000 3.096 . 0 0 "[ . 1 . 2]" 2
702 1 46 GLU HB3 1 47 GLU HA . . 4.580 4.207 3.943 4.382 . 0 0 "[ . 1 . 2]" 2
703 1 44 ILE HA 1 44 ILE MD . . 4.310 3.817 3.771 3.858 . 0 0 "[ . 1 . 2]" 2
704 1 28 ILE MG 1 44 ILE MD . . 4.530 3.119 2.725 3.399 . 0 0 "[ . 1 . 2]" 2
705 1 44 ILE H 1 44 ILE MD . . 4.170 4.061 3.854 4.207 0.037 15 0 "[ . 1 . 2]" 2
706 1 44 ILE MD 1 55 TYR HE1 . . 3.810 2.045 1.864 2.341 . 0 0 "[ . 1 . 2]" 2
707 1 34 GLN HA 1 34 GLN HG3 . . 3.730 3.058 2.438 3.392 . 0 0 "[ . 1 . 2]" 2
708 1 61 GLU HA 1 65 GLY H . . 3.460 1.951 1.880 2.059 . 0 0 "[ . 1 . 2]" 2
709 1 61 GLU HA 1 61 GLU HG3 . . 3.420 2.791 2.597 2.977 . 0 0 "[ . 1 . 2]" 2
710 1 55 TYR HH 1 57 CYS HA . . 3.390 2.396 2.097 2.732 . 0 0 "[ . 1 . 2]" 2
711 1 57 CYS HA 1 58 PRO HD3 . . 3.110 2.321 2.314 2.332 . 0 0 "[ . 1 . 2]" 2
712 1 57 CYS HA 1 57 CYS HB2 . . 2.970 2.366 2.358 2.383 . 0 0 "[ . 1 . 2]" 2
713 1 70 LYS HA 1 71 ASN H . . 3.070 2.524 2.243 3.383 0.313 17 0 "[ . 1 . 2]" 2
714 1 53 ASP HB3 1 70 LYS HA . . 3.780 3.680 3.450 3.823 0.043 16 0 "[ . 1 . 2]" 2
715 1 53 ASP HB2 1 70 LYS HA . . 3.260 2.229 1.987 2.392 . 0 0 "[ . 1 . 2]" 2
716 1 70 LYS HA 1 70 LYS HG2 . . 3.270 2.479 2.322 2.817 . 0 0 "[ . 1 . 2]" 2
717 1 68 ILE MD 1 69 MET H . . 3.850 3.703 3.558 3.862 0.012 13 0 "[ . 1 . 2]" 2
718 1 68 ILE H 1 68 ILE MD . . 3.020 2.907 2.659 3.034 0.014 13 0 "[ . 1 . 2]" 2
719 1 68 ILE HA 1 68 ILE MD . . 3.070 2.171 1.972 2.303 . 0 0 "[ . 1 . 2]" 2
720 1 68 ILE HB 1 68 ILE MD . . 3.550 3.225 3.216 3.229 . 0 0 "[ . 1 . 2]" 2
721 1 54 ILE HB 1 68 ILE MD . . 4.200 3.886 3.725 4.038 . 0 0 "[ . 1 . 2]" 2
722 1 18 ARG HA 1 19 GLN H . . 3.280 2.752 2.644 2.843 . 0 0 "[ . 1 . 2]" 2
723 1 18 ARG HA 1 18 ARG HD3 . . 3.840 3.215 2.532 3.858 0.018 1 0 "[ . 1 . 2]" 2
724 1 45 GLU HA 1 46 GLU H . . 3.030 2.281 2.187 2.390 . 0 0 "[ . 1 . 2]" 2
725 1 45 GLU HA 1 45 GLU HB3 . . 2.900 2.582 2.463 2.688 . 0 0 "[ . 1 . 2]" 2
726 1 10 LEU HA 1 11 VAL H . . 2.820 2.188 2.140 2.489 . 0 0 "[ . 1 . 2]" 2
727 1 10 LEU HA 1 10 LEU HG . . 3.620 3.097 2.350 3.690 0.070 20 0 "[ . 1 . 2]" 2
728 1 29 GLU HA 1 29 GLU HG2 . . 3.640 2.822 2.425 3.115 . 0 0 "[ . 1 . 2]" 2
729 1 49 ALA HA 1 51 ASP H . . 4.210 3.657 3.502 3.832 . 0 0 "[ . 1 . 2]" 2
730 1 48 ASN H 1 49 ALA HA . . 5.010 4.882 4.803 4.981 . 0 0 "[ . 1 . 2]" 2
731 1 49 ALA HA 1 52 ILE HG12 . . 4.290 4.098 3.912 4.225 . 0 0 "[ . 1 . 2]" 2
732 1 44 ILE MG 1 49 ALA HA . . 3.290 3.184 2.951 3.310 0.020 14 0 "[ . 1 . 2]" 2
733 1 29 GLU HA 1 30 CYS H . . 3.030 2.149 2.138 2.189 . 0 0 "[ . 1 . 2]" 2
734 1 29 GLU HA 1 36 TRP HA . . 3.190 2.538 2.199 2.684 . 0 0 "[ . 1 . 2]" 2
735 1 9 ALA HA 1 10 LEU H . . 2.990 2.337 2.152 3.260 0.270 12 0 "[ . 1 . 2]" 2
736 1 11 VAL HA 1 12 PRO HD3 . . 2.840 2.278 2.254 2.328 . 0 0 "[ . 1 . 2]" 2
737 1 19 GLN HA 1 20 PRO HD3 . . 3.020 2.269 2.252 2.291 . 0 0 "[ . 1 . 2]" 2
738 1 19 GLN HB3 1 20 PRO HD3 . . 3.800 3.640 3.444 3.857 0.057 17 0 "[ . 1 . 2]" 2
739 1 19 GLN HA 1 20 PRO HD2 . . 3.050 2.298 2.211 2.381 . 0 0 "[ . 1 . 2]" 2
740 1 19 GLN HG3 1 20 PRO HD2 . . 4.290 4.160 3.965 4.413 0.123 13 0 "[ . 1 . 2]" 2
741 1 19 GLN HB3 1 20 PRO HD2 . . 3.170 2.227 2.006 2.484 . 0 0 "[ . 1 . 2]" 2
742 1 11 VAL HA 1 12 PRO HD2 . . 2.850 2.064 1.974 2.157 . 0 0 "[ . 1 . 2]" 2
743 1 11 VAL MG2 1 12 PRO HD2 . . 4.310 2.114 1.904 3.708 . 0 0 "[ . 1 . 2]" 2
744 1 56 HIS HA 1 56 HIS HD2 . . 3.390 2.396 2.259 2.505 . 0 0 "[ . 1 . 2]" 2
745 1 56 HIS HA 1 57 CYS H . . 2.880 2.149 2.143 2.158 . 0 0 "[ . 1 . 2]" 2
746 1 65 GLY HA3 1 66 PRO HD2 . . 2.810 1.957 1.938 1.994 . 0 0 "[ . 1 . 2]" 2
747 1 65 GLY H 1 66 PRO HD2 . . 4.770 4.709 4.674 4.743 . 0 0 "[ . 1 . 2]" 2
748 1 55 TYR HH 1 58 PRO HD3 . . 3.740 2.072 1.999 2.180 . 0 0 "[ . 1 . 2]" 2
749 1 42 VAL MG1 1 58 PRO HD3 . . 3.750 2.376 1.979 2.941 . 0 0 "[ . 1 . 2]" 2
750 1 57 CYS HB2 1 58 PRO HD2 . . 2.960 1.862 1.816 1.893 . 0 0 "[ . 1 . 2]" 2
751 1 57 CYS HA 1 58 PRO HD2 . . 3.270 2.454 2.438 2.477 . 0 0 "[ . 1 . 2]" 2
752 1 26 PHE QD 1 39 GLY HA3 . . 3.550 2.405 1.985 2.863 . 0 0 "[ . 1 . 2]" 2
753 1 39 GLY HA2 1 44 ILE HB . . 3.520 2.537 2.320 2.766 . 0 0 "[ . 1 . 2]" 2
754 1 39 GLY HA2 1 42 VAL MG2 . . 3.370 2.099 1.960 2.309 . 0 0 "[ . 1 . 2]" 2
755 1 70 LYS HG3 1 72 TRP HD1 . . 5.500 4.745 3.307 5.594 0.094 14 0 "[ . 1 . 2]" 2
756 1 70 LYS HB3 1 72 TRP HD1 . . 5.130 3.143 2.230 4.583 . 0 0 "[ . 1 . 2]" 2
757 1 70 LYS HB2 1 72 TRP HD1 . . 5.500 2.916 2.095 4.418 . 0 0 "[ . 1 . 2]" 2
758 1 71 ASN HA 1 72 TRP HD1 . . 5.010 4.591 3.721 5.146 0.136 18 0 "[ . 1 . 2]" 2
759 1 72 TRP HA 1 72 TRP HD1 . . 5.210 4.235 3.918 4.585 . 0 0 "[ . 1 . 2]" 2
760 1 72 TRP HA 1 72 TRP HE3 . . 4.020 3.494 2.487 4.139 0.119 18 0 "[ . 1 . 2]" 2
761 1 72 TRP H 1 72 TRP HE3 . . 5.500 5.002 4.404 5.328 . 0 0 "[ . 1 . 2]" 2
762 1 70 LYS HD2 1 72 TRP HZ2 . . 4.690 2.643 2.086 3.108 . 0 0 "[ . 1 . 2]" 2
763 1 70 LYS HD3 1 72 TRP HZ2 . . 4.840 3.624 2.518 4.101 . 0 0 "[ . 1 . 2]" 2
764 1 50 VAL HB 1 72 TRP HZ2 . . 5.500 5.428 5.068 5.596 0.096 20 0 "[ . 1 . 2]" 2
765 1 50 VAL HA 1 72 TRP HZ2 . . 5.500 4.367 3.917 4.603 . 0 0 "[ . 1 . 2]" 2
766 1 70 LYS HD2 1 72 TRP HH2 . . 5.260 4.563 4.186 4.723 . 0 0 "[ . 1 . 2]" 2
767 1 70 LYS HD3 1 72 TRP HH2 . . 5.500 5.407 4.751 5.677 0.177 11 0 "[ . 1 . 2]" 2
768 1 70 LYS HA 1 71 ASN HB2 . . 5.470 4.555 3.952 5.603 0.133 9 0 "[ . 1 . 2]" 2
769 1 70 LYS HA 1 71 ASN HB3 . . 5.470 5.120 4.099 5.611 0.141 11 0 "[ . 1 . 2]" 2
770 1 70 LYS HA 1 70 LYS HE2 . . 5.500 5.196 5.019 5.455 . 0 0 "[ . 1 . 2]" 2
771 1 70 LYS HA 1 72 TRP H . . 5.500 4.584 4.023 5.100 . 0 0 "[ . 1 . 2]" 2
772 1 53 ASP H 1 70 LYS HA . . 5.480 4.007 3.718 4.327 . 0 0 "[ . 1 . 2]" 2
773 1 70 LYS HB2 1 70 LYS HE2 . . 5.500 4.598 4.250 4.805 . 0 0 "[ . 1 . 2]" 2
774 1 70 LYS HB2 1 70 LYS HE3 . . 5.500 3.943 3.568 4.257 . 0 0 "[ . 1 . 2]" 2
775 1 70 LYS HA 1 70 LYS HD2 . . 4.850 4.488 4.312 4.733 . 0 0 "[ . 1 . 2]" 2
776 1 70 LYS HD2 1 72 TRP HD1 . . 5.500 4.060 3.752 4.965 . 0 0 "[ . 1 . 2]" 2
777 1 70 LYS H 1 70 LYS HD2 . . 4.770 4.373 3.938 4.598 . 0 0 "[ . 1 . 2]" 2
778 1 70 LYS HD2 1 71 ASN H . . 5.500 4.835 4.431 5.631 0.131 17 0 "[ . 1 . 2]" 2
779 1 26 PHE QD 1 46 GLU HB3 . . 4.670 4.017 3.511 4.465 . 0 0 "[ . 1 . 2]" 2
780 1 46 GLU HB3 1 48 ASN H . . 5.500 4.886 4.693 5.047 . 0 0 "[ . 1 . 2]" 2
781 1 70 LYS H 1 70 LYS HD3 . . 5.110 4.838 4.455 5.020 . 0 0 "[ . 1 . 2]" 2
782 1 52 ILE H 1 70 LYS HE2 . . 5.500 5.037 3.591 5.460 . 0 0 "[ . 1 . 2]" 2
783 1 52 ILE H 1 70 LYS HE3 . . 5.500 3.802 2.806 4.556 . 0 0 "[ . 1 . 2]" 2
784 1 70 LYS H 1 70 LYS HE2 . . 5.500 4.911 4.035 5.277 . 0 0 "[ . 1 . 2]" 2
785 1 70 LYS H 1 70 LYS HE3 . . 5.500 4.476 3.838 4.892 . 0 0 "[ . 1 . 2]" 2
786 1 69 MET HB3 1 70 LYS HA . . 5.210 4.961 4.795 5.096 . 0 0 "[ . 1 . 2]" 2
787 1 68 ILE HA 1 69 MET HB2 . . 4.780 4.481 4.410 4.580 . 0 0 "[ . 1 . 2]" 2
788 1 20 PRO HA 1 21 TYR HA . . 5.080 4.757 4.738 4.773 . 0 0 "[ . 1 . 2]" 2
789 1 68 ILE HA 1 69 MET HA . . 5.360 4.430 4.392 4.457 . 0 0 "[ . 1 . 2]" 2
790 1 53 ASP HB2 1 68 ILE HB . . 4.700 4.248 4.119 4.469 . 0 0 "[ . 1 . 2]" 2
791 1 68 ILE HB 1 69 MET H . . 4.820 3.571 3.428 3.759 . 0 0 "[ . 1 . 2]" 2
792 1 53 ASP H 1 68 ILE HB . . 4.820 4.328 4.112 4.594 . 0 0 "[ . 1 . 2]" 2
793 1 54 ILE H 1 68 ILE HG13 . . 5.020 4.798 4.571 5.062 0.042 10 0 "[ . 1 . 2]" 2
794 1 54 ILE H 1 68 ILE HG12 . . 4.620 4.377 4.154 4.570 . 0 0 "[ . 1 . 2]" 2
795 1 68 ILE HG12 1 69 MET H . . 5.220 4.995 4.902 5.101 . 0 0 "[ . 1 . 2]" 2
796 1 67 SER HA 1 68 ILE MD . . 4.520 3.817 3.539 4.067 . 0 0 "[ . 1 . 2]" 2
797 1 56 HIS HD2 1 68 ILE MD . . 5.500 5.443 5.231 5.515 0.015 10 0 "[ . 1 . 2]" 2
798 1 54 ILE MG 1 67 SER HA . . 4.690 4.508 4.155 4.695 0.005 17 0 "[ . 1 . 2]" 2
799 1 67 SER HA 1 68 ILE HG13 . . 5.370 5.317 5.164 5.376 0.006 4 0 "[ . 1 . 2]" 2
800 1 67 SER HA 1 68 ILE HG12 . . 4.630 3.570 3.416 3.664 . 0 0 "[ . 1 . 2]" 2
801 1 67 SER HA 1 68 ILE HB . . 5.010 4.887 4.819 5.002 . 0 0 "[ . 1 . 2]" 2
802 1 56 HIS HB3 1 67 SER HA . . 4.730 4.082 3.951 4.220 . 0 0 "[ . 1 . 2]" 2
803 1 56 HIS HB2 1 67 SER HA . . 4.250 2.633 2.452 2.808 . 0 0 "[ . 1 . 2]" 2
804 1 67 SER HA 1 68 ILE HA . . 4.570 4.332 4.317 4.342 . 0 0 "[ . 1 . 2]" 2
805 1 55 TYR HA 1 67 SER HA . . 4.350 4.078 3.728 4.358 0.008 15 0 "[ . 1 . 2]" 2
806 1 66 PRO HA 1 67 SER HA . . 4.760 4.346 4.333 4.365 . 0 0 "[ . 1 . 2]" 2
807 1 56 HIS HD2 1 67 SER HA . . 5.200 3.818 3.597 4.210 . 0 0 "[ . 1 . 2]" 2
808 1 52 ILE MG 1 67 SER HB2 . . 4.110 2.782 2.051 3.773 . 0 0 "[ . 1 . 2]" 2
809 1 61 GLU HG3 1 66 PRO HB2 . . 5.500 5.466 5.310 5.530 0.030 6 0 "[ . 1 . 2]" 2
810 1 64 PHE H 1 65 GLY HA3 . . 5.500 5.146 5.067 5.203 . 0 0 "[ . 1 . 2]" 2
811 1 63 VAL H 1 64 PHE HA . . 5.500 4.647 4.599 4.711 . 0 0 "[ . 1 . 2]" 2
812 1 32 LEU MD2 1 64 PHE HB3 . . 5.390 3.666 3.136 4.284 . 0 0 "[ . 1 . 2]" 2
813 1 63 VAL H 1 64 PHE HB3 . . 5.500 5.416 5.370 5.479 . 0 0 "[ . 1 . 2]" 2
814 1 63 VAL H 1 64 PHE HB2 . . 5.500 4.009 3.975 4.065 . 0 0 "[ . 1 . 2]" 2
815 1 56 HIS HE1 1 64 PHE HB2 . . 5.030 4.018 3.336 4.469 . 0 0 "[ . 1 . 2]" 2
816 1 63 VAL H 1 64 PHE QD . . 5.500 3.871 3.710 4.072 . 0 0 "[ . 1 . 2]" 2
817 1 32 LEU MD1 1 64 PHE QE . . 4.700 3.431 3.123 3.750 . 0 0 "[ . 1 . 2]" 2
818 1 63 VAL MG1 1 64 PHE QE . . 4.820 3.896 3.623 4.047 . 0 0 "[ . 1 . 2]" 2
819 1 63 VAL MG2 1 64 PHE QE . . 4.820 4.613 4.466 4.785 . 0 0 "[ . 1 . 2]" 2
820 1 63 VAL HB 1 64 PHE QE . . 4.250 3.819 3.633 4.006 . 0 0 "[ . 1 . 2]" 2
821 1 60 CYS HB2 1 64 PHE QE . . 5.500 5.419 5.258 5.504 0.004 15 0 "[ . 1 . 2]" 2
822 1 60 CYS HA 1 64 PHE QE . . 5.500 4.512 4.236 4.764 . 0 0 "[ . 1 . 2]" 2
823 1 64 PHE HA 1 64 PHE QE . . 4.670 4.577 4.544 4.607 . 0 0 "[ . 1 . 2]" 2
824 1 32 LEU MD1 1 64 PHE HZ . . 5.170 4.317 3.887 4.702 . 0 0 "[ . 1 . 2]" 2
825 1 32 LEU MD2 1 64 PHE HZ . . 5.500 3.726 3.334 4.158 . 0 0 "[ . 1 . 2]" 2
826 1 63 VAL HB 1 64 PHE HB3 . . 5.500 5.465 5.418 5.508 0.008 15 0 "[ . 1 . 2]" 2
827 1 63 VAL HB 1 64 PHE HB2 . . 5.500 4.299 4.206 4.364 . 0 0 "[ . 1 . 2]" 2
828 1 63 VAL HB 1 64 PHE HA . . 5.120 4.176 4.108 4.245 . 0 0 "[ . 1 . 2]" 2
829 1 60 CYS HA 1 63 VAL MG1 . . 5.270 5.096 4.901 5.189 . 0 0 "[ . 1 . 2]" 2
830 1 32 LEU MD1 1 61 GLU HA . . 5.500 4.211 3.880 4.668 . 0 0 "[ . 1 . 2]" 2
831 1 61 GLU HA 1 62 ALA MB . . 5.480 4.950 4.908 4.982 . 0 0 "[ . 1 . 2]" 2
832 1 60 CYS HB2 1 61 GLU HA . . 4.420 4.265 4.205 4.335 . 0 0 "[ . 1 . 2]" 2
833 1 61 GLU HA 1 65 GLY HA3 . . 4.390 4.293 4.223 4.364 . 0 0 "[ . 1 . 2]" 2
834 1 61 GLU HA 1 64 PHE H . . 4.250 3.499 3.294 3.747 . 0 0 "[ . 1 . 2]" 2
835 1 61 GLU HB2 1 66 PRO HA . . 4.350 3.979 3.753 4.192 . 0 0 "[ . 1 . 2]" 2
836 1 61 GLU HB2 1 62 ALA H . . 4.370 4.238 4.136 4.298 . 0 0 "[ . 1 . 2]" 2
837 1 60 CYS H 1 61 GLU HB2 . . 5.020 4.675 4.583 4.771 . 0 0 "[ . 1 . 2]" 2
838 1 56 HIS H 1 61 GLU HB2 . . 5.500 5.506 5.415 5.551 0.051 8 0 "[ . 1 . 2]" 2
839 1 59 ASP H 1 61 GLU HB2 . . 5.500 5.319 5.139 5.418 . 0 0 "[ . 1 . 2]" 2
840 1 59 ASP HA 1 61 GLU HB3 . . 5.500 5.359 5.240 5.421 . 0 0 "[ . 1 . 2]" 2
841 1 61 GLU HB3 1 66 PRO HA . . 5.500 5.321 5.072 5.467 . 0 0 "[ . 1 . 2]" 2
842 1 57 CYS HB3 1 59 ASP H . . 5.500 4.069 4.056 4.093 . 0 0 "[ . 1 . 2]" 2
843 1 59 ASP H 1 61 GLU HB3 . . 5.500 4.601 4.426 4.820 . 0 0 "[ . 1 . 2]" 2
844 1 57 CYS HB3 1 60 CYS H . . 5.060 4.515 4.499 4.531 . 0 0 "[ . 1 . 2]" 2
845 1 60 CYS H 1 61 GLU HB3 . . 5.330 4.247 4.146 4.374 . 0 0 "[ . 1 . 2]" 2
846 1 56 HIS HB3 1 61 GLU HG3 . . 5.180 4.723 4.510 4.903 . 0 0 "[ . 1 . 2]" 2
847 1 61 GLU HG3 1 66 PRO HD2 . . 5.500 5.007 4.815 5.133 . 0 0 "[ . 1 . 2]" 2
848 1 61 GLU HG3 1 66 PRO HD3 . . 5.500 4.240 4.032 4.404 . 0 0 "[ . 1 . 2]" 2
849 1 61 GLU HG3 1 65 GLY HA3 . . 4.660 4.346 4.119 4.468 . 0 0 "[ . 1 . 2]" 2
850 1 61 GLU HG3 1 62 ALA H . . 5.170 4.913 4.639 4.999 . 0 0 "[ . 1 . 2]" 2
851 1 61 GLU HG3 1 65 GLY H . . 4.800 3.805 3.484 3.935 . 0 0 "[ . 1 . 2]" 2
852 1 61 GLU HG3 1 67 SER H . . 5.290 5.082 4.959 5.287 . 0 0 "[ . 1 . 2]" 2
853 1 61 GLU H 1 61 GLU HG3 . . 4.730 4.539 4.475 4.573 . 0 0 "[ . 1 . 2]" 2
854 1 61 GLU HG2 1 62 ALA MB . . 5.500 4.464 4.324 4.673 . 0 0 "[ . 1 . 2]" 2
855 1 61 GLU HG2 1 66 PRO HD3 . . 5.500 5.327 4.944 5.482 . 0 0 "[ . 1 . 2]" 2
856 1 61 GLU HG2 1 62 ALA H . . 4.760 3.873 3.636 4.252 . 0 0 "[ . 1 . 2]" 2
857 1 59 ASP HA 1 62 ALA H . . 4.560 4.211 4.144 4.271 . 0 0 "[ . 1 . 2]" 2
858 1 59 ASP HA 1 61 GLU H . . 5.110 4.523 4.454 4.609 . 0 0 "[ . 1 . 2]" 2
859 1 58 PRO HA 1 62 ALA H . . 5.300 4.909 4.628 5.193 . 0 0 "[ . 1 . 2]" 2
860 1 58 PRO HA 1 60 CYS H . . 5.500 4.229 4.175 4.412 . 0 0 "[ . 1 . 2]" 2
861 1 55 TYR HH 1 58 PRO HA . . 5.500 5.217 4.798 5.516 0.016 9 0 "[ . 1 . 2]" 2
862 1 58 PRO HA 1 62 ALA MB . . 5.500 5.260 5.124 5.398 . 0 0 "[ . 1 . 2]" 2
863 1 58 PRO HB2 1 59 ASP HA . . 5.500 4.419 4.400 4.443 . 0 0 "[ . 1 . 2]" 2
864 1 16 LEU MD1 1 58 PRO HB3 . . 5.220 4.386 4.189 4.613 . 0 0 "[ . 1 . 2]" 2
865 1 16 LEU MD2 1 58 PRO HB3 . . 5.220 5.228 5.184 5.248 0.028 6 0 "[ . 1 . 2]" 2
866 1 16 LEU MD1 1 58 PRO HG2 . . 3.730 2.780 2.233 3.255 . 0 0 "[ . 1 . 2]" 2
867 1 42 VAL HB 1 58 PRO HG3 . . 4.820 3.748 3.294 4.241 . 0 0 "[ . 1 . 2]" 2
868 1 57 CYS HB2 1 59 ASP H . . 5.350 3.037 3.002 3.098 . 0 0 "[ . 1 . 2]" 2
869 1 55 TYR HH 1 57 CYS HB2 . . 5.040 4.031 3.504 4.572 . 0 0 "[ . 1 . 2]" 2
870 1 55 TYR HH 1 58 PRO HG3 . . 5.220 3.994 3.913 4.099 . 0 0 "[ . 1 . 2]" 2
871 1 58 PRO HG3 1 59 ASP H . . 5.190 4.738 4.684 4.817 . 0 0 "[ . 1 . 2]" 2
872 1 37 PHE HB2 1 58 PRO HD2 . . 5.500 4.766 4.188 5.124 . 0 0 "[ . 1 . 2]" 2
873 1 42 VAL HB 1 58 PRO HD2 . . 5.500 4.534 4.262 4.889 . 0 0 "[ . 1 . 2]" 2
874 1 58 PRO HD2 1 59 ASP HB2 . . 5.500 4.425 4.119 5.149 . 0 0 "[ . 1 . 2]" 2
875 1 30 CYS HB2 1 58 PRO HD2 . . 5.500 5.327 5.043 5.522 0.022 16 0 "[ . 1 . 2]" 2
876 1 58 PRO HD2 1 59 ASP HB3 . . 5.500 4.848 4.164 5.157 . 0 0 "[ . 1 . 2]" 2
877 1 37 PHE QE 1 58 PRO HD2 . . 5.140 3.873 3.452 4.263 . 0 0 "[ . 1 . 2]" 2
878 1 37 PHE QD 1 58 PRO HD2 . . 5.500 3.968 3.541 4.365 . 0 0 "[ . 1 . 2]" 2
879 1 55 TYR HH 1 58 PRO HD2 . . 4.240 3.213 2.814 3.590 . 0 0 "[ . 1 . 2]" 2
880 1 42 VAL HB 1 58 PRO HD3 . . 4.910 2.952 2.686 3.299 . 0 0 "[ . 1 . 2]" 2
881 1 58 PRO HD3 1 59 ASP H . . 5.070 4.105 4.077 4.151 . 0 0 "[ . 1 . 2]" 2
882 1 42 VAL MG2 1 57 CYS HA . . 5.410 4.973 4.805 5.089 . 0 0 "[ . 1 . 2]" 2
883 1 42 VAL MG1 1 57 CYS HA . . 4.650 3.707 3.479 4.083 . 0 0 "[ . 1 . 2]" 2
884 1 37 PHE HB2 1 57 CYS HA . . 5.290 4.790 4.340 5.083 . 0 0 "[ . 1 . 2]" 2
885 1 42 VAL HB 1 57 CYS HA . . 5.500 4.436 4.211 4.643 . 0 0 "[ . 1 . 2]" 2
886 1 30 CYS HB2 1 57 CYS HA . . 4.340 3.823 3.479 4.086 . 0 0 "[ . 1 . 2]" 2
887 1 37 PHE QE 1 57 CYS HA . . 5.300 4.489 4.187 4.840 . 0 0 "[ . 1 . 2]" 2
888 1 37 PHE QD 1 57 CYS HA . . 5.500 4.329 3.975 4.696 . 0 0 "[ . 1 . 2]" 2
889 1 57 CYS HA 1 61 GLU H . . 5.500 5.342 5.248 5.438 . 0 0 "[ . 1 . 2]" 2
890 1 61 GLU HB3 1 62 ALA MB . . 5.500 4.293 4.221 4.376 . 0 0 "[ . 1 . 2]" 2
891 1 42 VAL MG1 1 57 CYS HB3 . . 5.500 5.047 4.728 5.443 . 0 0 "[ . 1 . 2]" 2
892 1 37 PHE QE 1 57 CYS HB2 . . 4.490 3.148 2.771 3.476 . 0 0 "[ . 1 . 2]" 2
893 1 37 PHE QD 1 57 CYS HB2 . . 5.420 3.911 3.659 4.236 . 0 0 "[ . 1 . 2]" 2
894 1 32 LEU MD1 1 56 HIS HB2 . . 5.500 4.118 3.858 4.455 . 0 0 "[ . 1 . 2]" 2
895 1 32 LEU HG 1 56 HIS HB2 . . 5.500 5.471 5.372 5.550 0.050 13 0 "[ . 1 . 2]" 2
896 1 52 ILE MG 1 56 HIS HB2 . . 5.500 5.429 5.156 5.550 0.050 16 0 "[ . 1 . 2]" 2
897 1 56 HIS HB2 1 61 GLU HB2 . . 4.420 3.616 3.467 3.814 . 0 0 "[ . 1 . 2]" 2
898 1 55 TYR HA 1 56 HIS HB2 . . 4.870 4.309 4.192 4.385 . 0 0 "[ . 1 . 2]" 2
899 1 56 HIS HB2 1 61 GLU HA . . 5.240 4.613 4.484 4.767 . 0 0 "[ . 1 . 2]" 2
900 1 56 HIS HB2 1 66 PRO HA . . 4.500 4.148 3.876 4.506 0.006 13 0 "[ . 1 . 2]" 2
901 1 56 HIS HB2 1 57 CYS H . . 4.740 4.491 4.440 4.547 . 0 0 "[ . 1 . 2]" 2
902 1 56 HIS HB2 1 61 GLU H . . 5.220 5.073 4.998 5.151 . 0 0 "[ . 1 . 2]" 2
903 1 32 LEU MD2 1 56 HIS HA . . 5.290 4.825 4.686 4.987 . 0 0 "[ . 1 . 2]" 2
904 1 32 LEU HG 1 56 HIS HA . . 4.700 3.495 3.355 3.620 . 0 0 "[ . 1 . 2]" 2
905 1 54 ILE MG 1 56 HIS HA . . 4.570 4.308 4.214 4.419 . 0 0 "[ . 1 . 2]" 2
906 1 56 HIS HA 1 57 CYS HB3 . . 4.580 4.431 4.415 4.464 . 0 0 "[ . 1 . 2]" 2
907 1 32 LEU HB2 1 56 HIS HA . . 4.420 4.381 4.214 4.481 0.061 7 0 "[ . 1 . 2]" 2
908 1 56 HIS HA 1 57 CYS HA . . 4.960 4.415 4.402 4.430 . 0 0 "[ . 1 . 2]" 2
909 1 30 CYS HA 1 56 HIS HA . . 5.220 3.457 3.243 3.600 . 0 0 "[ . 1 . 2]" 2
910 1 31 GLY H 1 56 HIS HA . . 4.970 3.607 3.345 3.767 . 0 0 "[ . 1 . 2]" 2
911 1 56 HIS HA 1 61 GLU H . . 5.500 5.295 5.208 5.427 . 0 0 "[ . 1 . 2]" 2
912 1 56 HIS HB3 1 61 GLU HA . . 4.300 3.498 3.345 3.674 . 0 0 "[ . 1 . 2]" 2
913 1 56 HIS HB3 1 67 SER H . . 5.500 5.175 5.014 5.417 . 0 0 "[ . 1 . 2]" 2
914 1 28 ILE MG 1 55 TYR HA . . 5.420 4.580 4.057 5.024 . 0 0 "[ . 1 . 2]" 2
915 1 55 TYR HA 1 56 HIS HA . . 5.500 4.398 4.388 4.407 . 0 0 "[ . 1 . 2]" 2
916 1 55 TYR HA 1 67 SER HG . . 4.290 3.552 2.280 4.330 0.040 4 0 "[ . 1 . 2]" 2
917 1 55 TYR HA 1 55 TYR HD1 . . 4.260 2.575 2.417 2.794 . 0 0 "[ . 1 . 2]" 2
918 1 54 ILE HA 1 55 TYR HB3 . . 4.700 4.374 4.331 4.415 . 0 0 "[ . 1 . 2]" 2
919 1 55 TYR HB3 1 56 HIS H . . 4.790 4.221 4.115 4.335 . 0 0 "[ . 1 . 2]" 2
920 1 31 GLY H 1 55 TYR HB3 . . 5.050 3.998 3.902 4.094 . 0 0 "[ . 1 . 2]" 2
921 1 28 ILE MD 1 55 TYR HB2 . . 4.760 4.443 3.916 4.759 . 0 0 "[ . 1 . 2]" 2
922 1 44 ILE MD 1 55 TYR HB2 . . 4.040 3.169 3.000 3.317 . 0 0 "[ . 1 . 2]" 2
923 1 52 ILE MD 1 55 TYR HB2 . . 3.950 3.095 2.938 3.217 . 0 0 "[ . 1 . 2]" 2
924 1 54 ILE MG 1 55 TYR HB2 . . 5.500 5.370 5.284 5.453 . 0 0 "[ . 1 . 2]" 2
925 1 31 GLY H 1 55 TYR HB2 . . 5.500 5.438 5.353 5.513 0.013 5 0 "[ . 1 . 2]" 2
926 1 54 ILE HA 1 55 TYR HB2 . . 5.200 5.013 4.929 5.107 . 0 0 "[ . 1 . 2]" 2
927 1 31 GLY H 1 54 ILE HA . . 5.120 4.300 4.096 4.433 . 0 0 "[ . 1 . 2]" 2
928 1 54 ILE HB 1 68 ILE HA . . 5.330 4.540 4.378 4.722 . 0 0 "[ . 1 . 2]" 2
929 1 53 ASP H 1 54 ILE HB . . 5.500 5.431 5.271 5.529 0.029 4 0 "[ . 1 . 2]" 2
930 1 54 ILE HB 1 69 MET H . . 5.500 5.520 5.469 5.600 0.100 16 0 "[ . 1 . 2]" 2
931 1 53 ASP HB2 1 54 ILE HB . . 5.500 5.554 5.531 5.596 0.096 6 0 "[ . 1 . 2]" 2
932 1 53 ASP HB3 1 54 ILE HG12 . . 5.300 3.930 3.893 4.023 . 0 0 "[ . 1 . 2]" 2
933 1 53 ASP HB2 1 54 ILE HG12 . . 5.500 5.516 5.497 5.544 0.044 6 0 "[ . 1 . 2]" 2
934 1 54 ILE HG12 1 68 ILE HB . . 4.480 4.111 3.922 4.329 . 0 0 "[ . 1 . 2]" 2
935 1 54 ILE H 1 54 ILE HG12 . . 4.580 3.903 3.866 3.977 . 0 0 "[ . 1 . 2]" 2
936 1 54 ILE HG12 1 55 TYR H . . 5.000 4.703 4.653 4.769 . 0 0 "[ . 1 . 2]" 2
937 1 53 ASP H 1 54 ILE HG13 . . 4.860 4.851 4.739 4.892 0.032 18 0 "[ . 1 . 2]" 2
938 1 54 ILE HG13 1 55 TYR H . . 5.270 5.221 5.180 5.251 . 0 0 "[ . 1 . 2]" 2
939 1 54 ILE MG 1 68 ILE H . . 4.130 3.688 3.439 3.847 . 0 0 "[ . 1 . 2]" 2
940 1 68 ILE H 1 68 ILE MG . . 4.440 3.768 3.756 3.805 . 0 0 "[ . 1 . 2]" 2
941 1 54 ILE MD 1 56 HIS HD2 . . 5.250 5.007 4.903 5.145 . 0 0 "[ . 1 . 2]" 2
942 1 52 ILE MG 1 53 ASP HB2 . . 4.930 4.896 4.804 4.981 0.051 19 0 "[ . 1 . 2]" 2
943 1 53 ASP HB2 1 70 LYS H . . 4.540 2.510 2.381 2.804 . 0 0 "[ . 1 . 2]" 2
944 1 53 ASP HB3 1 54 ILE HB . . 4.600 3.942 3.916 3.982 . 0 0 "[ . 1 . 2]" 2
945 1 53 ASP HB3 1 68 ILE HB . . 4.080 2.854 2.633 3.068 . 0 0 "[ . 1 . 2]" 2
946 1 53 ASP HB3 1 68 ILE H . . 5.500 5.272 5.100 5.474 . 0 0 "[ . 1 . 2]" 2
947 1 52 ILE HA 1 69 MET HB2 . . 5.230 5.181 4.897 5.284 0.054 11 0 "[ . 1 . 2]" 2
948 1 52 ILE HA 1 53 ASP HB3 . . 5.500 4.971 4.902 5.011 . 0 0 "[ . 1 . 2]" 2
949 1 49 ALA MB 1 52 ILE HB . . 4.620 3.660 3.433 3.869 . 0 0 "[ . 1 . 2]" 2
950 1 52 ILE HB 1 53 ASP H . . 4.710 4.445 4.411 4.477 . 0 0 "[ . 1 . 2]" 2
951 1 49 ALA MB 1 52 ILE HG12 . . 5.500 5.421 5.240 5.514 0.014 20 0 "[ . 1 . 2]" 2
952 1 51 ASP HB2 1 52 ILE HG12 . . 5.500 4.938 4.661 5.561 0.061 19 0 "[ . 1 . 2]" 2
953 1 51 ASP H 1 52 ILE HG12 . . 5.320 5.216 4.593 5.325 0.005 7 0 "[ . 1 . 2]" 2
954 1 52 ILE HG12 1 53 ASP H . . 4.800 4.711 4.606 4.787 . 0 0 "[ . 1 . 2]" 2
955 1 28 ILE MG 1 52 ILE HG13 . . 5.370 5.188 4.755 5.331 . 0 0 "[ . 1 . 2]" 2
956 1 52 ILE HG13 1 69 MET HA . . 5.290 5.162 4.879 5.288 . 0 0 "[ . 1 . 2]" 2
957 1 52 ILE HG13 1 53 ASP H . . 5.330 5.035 4.966 5.231 . 0 0 "[ . 1 . 2]" 2
958 1 52 ILE MG 1 55 TYR HD2 . . 5.310 5.006 4.913 5.157 . 0 0 "[ . 1 . 2]" 2
959 1 52 ILE MG 1 55 TYR HD1 . . 3.900 3.363 3.139 3.670 . 0 0 "[ . 1 . 2]" 2
960 1 52 ILE MG 1 68 ILE H . . 4.460 4.073 3.737 4.352 . 0 0 "[ . 1 . 2]" 2
961 1 51 ASP H 1 52 ILE MG . . 5.500 5.462 5.355 5.503 0.003 17 0 "[ . 1 . 2]" 2
962 1 28 ILE MD 1 52 ILE MG . . 5.500 5.380 5.077 5.526 0.026 4 0 "[ . 1 . 2]" 2
963 1 28 ILE HG13 1 52 ILE MD . . 5.500 5.157 5.007 5.366 . 0 0 "[ . 1 . 2]" 2
964 1 44 ILE HG13 1 52 ILE MD . . 5.500 4.134 3.892 4.324 . 0 0 "[ . 1 . 2]" 2
965 1 44 ILE HA 1 52 ILE MD . . 5.500 4.038 3.854 4.240 . 0 0 "[ . 1 . 2]" 2
966 1 52 ILE MD 1 55 TYR HD1 . . 4.040 3.497 3.135 3.828 . 0 0 "[ . 1 . 2]" 2
967 1 51 ASP H 1 52 ILE MD . . 4.950 4.563 4.362 4.647 . 0 0 "[ . 1 . 2]" 2
968 1 49 ALA H 1 52 ILE MD . . 4.430 3.513 3.168 4.047 . 0 0 "[ . 1 . 2]" 2
969 1 49 ALA MB 1 50 VAL HA . . 5.500 3.663 3.593 3.774 . 0 0 "[ . 1 . 2]" 2
970 1 50 VAL HA 1 52 ILE H . . 4.880 4.198 3.842 4.434 . 0 0 "[ . 1 . 2]" 2
971 1 49 ALA H 1 50 VAL HB . . 5.430 5.256 5.021 5.460 0.030 20 0 "[ . 1 . 2]" 2
972 1 45 GLU HB2 1 48 ASN HB3 . . 5.010 4.476 4.114 4.928 . 0 0 "[ . 1 . 2]" 2
973 1 45 GLU H 1 48 ASN HB3 . . 4.610 4.138 3.757 4.445 . 0 0 "[ . 1 . 2]" 2
974 1 44 ILE MG 1 46 GLU HA . . 5.500 4.015 3.802 4.156 . 0 0 "[ . 1 . 2]" 2
975 1 45 GLU HA 1 46 GLU HA . . 5.050 4.307 4.299 4.326 . 0 0 "[ . 1 . 2]" 2
976 1 26 PHE QE 1 46 GLU HB2 . . 4.870 4.016 3.604 4.469 . 0 0 "[ . 1 . 2]" 2
977 1 26 PHE QD 1 46 GLU HB2 . . 4.480 2.544 1.989 3.102 . 0 0 "[ . 1 . 2]" 2
978 1 26 PHE QD 1 46 GLU HG2 . . 4.950 3.977 2.944 4.895 . 0 0 "[ . 1 . 2]" 2
979 1 46 GLU H 1 46 GLU HG2 . . 4.770 4.497 4.388 4.607 . 0 0 "[ . 1 . 2]" 2
980 1 26 PHE QD 1 46 GLU HG3 . . 4.950 2.843 2.046 4.123 . 0 0 "[ . 1 . 2]" 2
981 1 46 GLU H 1 46 GLU HG3 . . 4.770 4.417 4.174 4.623 . 0 0 "[ . 1 . 2]" 2
982 1 28 ILE MG 1 44 ILE HB . . 5.230 4.158 3.784 4.438 . 0 0 "[ . 1 . 2]" 2
983 1 44 ILE HB 1 45 GLU H . . 4.360 4.170 3.910 4.368 0.008 3 0 "[ . 1 . 2]" 2
984 1 44 ILE HG12 1 45 GLU H . . 4.390 4.180 3.922 4.366 . 0 0 "[ . 1 . 2]" 2
985 1 28 ILE HG13 1 44 ILE MG . . 4.060 3.516 3.133 3.715 . 0 0 "[ . 1 . 2]" 2
986 1 44 ILE MD 1 49 ALA HA . . 5.110 4.667 4.400 4.864 . 0 0 "[ . 1 . 2]" 2
987 1 44 ILE MD 1 55 TYR HD2 . . 4.770 4.410 4.173 4.665 . 0 0 "[ . 1 . 2]" 2
988 1 26 PHE QE 1 44 ILE MD . . 4.550 4.058 3.255 4.566 0.016 1 0 "[ . 1 . 2]" 2
989 1 42 VAL MG2 1 44 ILE MD . . 2.830 2.270 2.002 2.624 . 0 0 "[ . 1 . 2]" 2
990 1 44 ILE HB 1 44 ILE MD . . 3.530 2.346 2.247 2.415 . 0 0 "[ . 1 . 2]" 2
991 1 42 VAL H 1 43 GLY HA3 . . 4.890 4.837 4.738 4.891 0.001 20 0 "[ . 1 . 2]" 2
992 1 42 VAL HB 1 44 ILE MD . . 4.700 3.433 3.023 3.948 . 0 0 "[ . 1 . 2]" 2
993 1 37 PHE QE 1 42 VAL MG1 . . 4.730 4.402 4.204 4.653 . 0 0 "[ . 1 . 2]" 2
994 1 42 VAL MG1 1 43 GLY H . . 4.730 3.807 3.560 3.969 . 0 0 "[ . 1 . 2]" 2
995 1 42 VAL MG1 1 44 ILE H . . 4.900 4.723 4.518 4.898 . 0 0 "[ . 1 . 2]" 2
996 1 38 HIS H 1 42 VAL MG1 . . 3.840 3.270 2.808 3.852 0.012 16 0 "[ . 1 . 2]" 2
997 1 42 VAL MG2 1 55 TYR HE1 . . 5.140 3.318 2.785 3.735 . 0 0 "[ . 1 . 2]" 2
998 1 42 VAL MG2 1 44 ILE HA . . 4.550 3.913 3.854 4.080 . 0 0 "[ . 1 . 2]" 2
999 1 41 CYS HA 1 42 VAL MG1 . . 5.050 4.562 4.371 4.664 . 0 0 "[ . 1 . 2]" 2
1000 1 41 CYS HA 1 43 GLY H . . 5.500 4.799 4.500 5.140 . 0 0 "[ . 1 . 2]" 2
1001 1 41 CYS HB3 1 42 VAL MG2 . . 5.400 5.146 4.966 5.327 . 0 0 "[ . 1 . 2]" 2
1002 1 41 CYS HB3 1 42 VAL MG1 . . 3.770 3.524 3.247 3.774 0.004 7 0 "[ . 1 . 2]" 2
1003 1 16 LEU HB2 1 41 CYS HB3 . . 4.550 3.869 3.678 3.982 . 0 0 "[ . 1 . 2]" 2
1004 1 16 LEU HG 1 41 CYS HB3 . . 5.070 4.035 3.383 4.305 . 0 0 "[ . 1 . 2]" 2
1005 1 38 HIS HB2 1 41 CYS HB3 . . 4.130 3.886 3.606 4.098 . 0 0 "[ . 1 . 2]" 2
1006 1 41 CYS HB2 1 42 VAL MG2 . . 4.590 4.217 4.002 4.355 . 0 0 "[ . 1 . 2]" 2
1007 1 40 SER HA 1 42 VAL H . . 5.290 4.234 4.005 4.380 . 0 0 "[ . 1 . 2]" 2
1008 1 40 SER HA 1 44 ILE H . . 5.340 4.267 4.076 4.479 . 0 0 "[ . 1 . 2]" 2
1009 1 26 PHE QE 1 39 GLY HA2 . . 4.410 3.036 1.992 4.229 . 0 0 "[ . 1 . 2]" 2
1010 1 26 PHE QD 1 39 GLY HA2 . . 4.190 3.579 2.995 4.210 0.020 18 0 "[ . 1 . 2]" 2
1011 1 39 GLY HA3 1 44 ILE MG . . 4.470 4.042 3.753 4.296 . 0 0 "[ . 1 . 2]" 2
1012 1 26 PHE QE 1 39 GLY HA3 . . 4.220 2.995 2.013 4.016 . 0 0 "[ . 1 . 2]" 2
1013 1 38 HIS HB2 1 41 CYS HB2 . . 3.410 2.352 1.987 2.678 . 0 0 "[ . 1 . 2]" 2
1014 1 38 HIS HB2 1 39 GLY H . . 5.330 4.094 3.647 4.333 . 0 0 "[ . 1 . 2]" 2
1015 1 27 MET HB3 1 38 HIS HD2 . . 4.930 4.726 4.490 5.022 0.092 19 0 "[ . 1 . 2]" 2
1016 1 27 MET HG2 1 38 HIS HD2 . . 4.020 2.447 1.999 2.799 . 0 0 "[ . 1 . 2]" 2
1017 1 38 HIS HD2 1 39 GLY H . . 5.460 4.165 3.835 4.400 . 0 0 "[ . 1 . 2]" 2
1018 1 37 PHE HB2 1 42 VAL MG2 . . 3.970 3.364 3.142 3.567 . 0 0 "[ . 1 . 2]" 2
1019 1 37 PHE HB2 1 38 HIS H . . 4.530 3.591 3.325 4.093 . 0 0 "[ . 1 . 2]" 2
1020 1 28 ILE MD 1 37 PHE HB3 . . 4.290 3.687 3.304 4.315 0.025 7 0 "[ . 1 . 2]" 2
1021 1 36 TRP H 1 36 TRP HB2 . . 3.930 2.513 2.359 2.728 . 0 0 "[ . 1 . 2]" 2
1022 1 36 TRP H 1 36 TRP HB3 . . 3.880 3.694 3.595 3.815 . 0 0 "[ . 1 . 2]" 2
1023 1 29 GLU HG3 1 36 TRP HD1 . . 5.170 4.094 3.147 5.170 . 0 0 "[ . 1 . 2]" 2
1024 1 27 MET ME 1 36 TRP HD1 . . 5.250 4.995 4.608 5.275 0.025 9 0 "[ . 1 . 2]" 2
1025 1 35 ASP HB3 1 36 TRP HD1 . . 5.500 5.104 4.433 5.502 0.002 12 0 "[ . 1 . 2]" 2
1026 1 29 GLU HA 1 36 TRP HD1 . . 5.040 4.801 4.355 5.053 0.013 11 0 "[ . 1 . 2]" 2
1027 1 35 ASP HA 1 36 TRP HD1 . . 4.010 3.289 2.871 3.499 . 0 0 "[ . 1 . 2]" 2
1028 1 14 TYR QE 1 36 TRP HD1 . . 4.380 3.951 3.660 4.212 . 0 0 "[ . 1 . 2]" 2
1029 1 36 TRP H 1 36 TRP HD1 . . 4.190 3.022 2.368 3.480 . 0 0 "[ . 1 . 2]" 2
1030 1 27 MET HB2 1 36 TRP HE3 . . 3.450 3.279 2.908 3.552 0.102 9 0 "[ . 1 . 2]" 2
1031 1 36 TRP HB3 1 36 TRP HE3 . . 3.790 2.500 2.430 2.549 . 0 0 "[ . 1 . 2]" 2
1032 1 36 TRP HA 1 36 TRP HE3 . . 4.530 3.461 3.293 3.740 . 0 0 "[ . 1 . 2]" 2
1033 1 27 MET H 1 36 TRP HE3 . . 5.500 4.985 4.293 5.390 . 0 0 "[ . 1 . 2]" 2
1034 1 29 GLU H 1 36 TRP HE3 . . 5.500 4.859 4.616 5.171 . 0 0 "[ . 1 . 2]" 2
1035 1 28 ILE H 1 36 TRP HE3 . . 4.380 3.341 2.740 3.812 . 0 0 "[ . 1 . 2]" 2
1036 1 36 TRP HE3 1 37 PHE H . . 4.690 3.482 3.119 3.923 . 0 0 "[ . 1 . 2]" 2
1037 1 29 GLU HB2 1 36 TRP HZ2 . . 4.330 3.293 3.145 3.413 . 0 0 "[ . 1 . 2]" 2
1038 1 29 GLU HG3 1 36 TRP HZ2 . . 4.840 4.000 3.610 4.481 . 0 0 "[ . 1 . 2]" 2
1039 1 29 GLU HB3 1 36 TRP HZ2 . . 4.950 4.495 4.119 4.676 . 0 0 "[ . 1 . 2]" 2
1040 1 29 GLU HG2 1 36 TRP HZ2 . . 5.500 5.262 4.904 5.480 . 0 0 "[ . 1 . 2]" 2
1041 1 29 GLU HB2 1 36 TRP HZ3 . . 4.840 4.032 3.818 4.267 . 0 0 "[ . 1 . 2]" 2
1042 1 36 TRP HB3 1 36 TRP HZ3 . . 5.500 4.899 4.846 4.937 . 0 0 "[ . 1 . 2]" 2
1043 1 27 MET H 1 36 TRP HZ3 . . 4.990 4.511 4.199 4.964 . 0 0 "[ . 1 . 2]" 2
1044 1 28 ILE H 1 36 TRP HZ3 . . 5.500 4.461 3.881 4.985 . 0 0 "[ . 1 . 2]" 2
1045 1 29 GLU HB2 1 36 TRP HH2 . . 4.530 3.643 3.491 3.916 . 0 0 "[ . 1 . 2]" 2
1046 1 29 GLU HB3 1 36 TRP HH2 . . 5.000 4.635 4.448 4.906 . 0 0 "[ . 1 . 2]" 2
1047 1 28 ILE HA 1 36 TRP HH2 . . 5.500 4.794 4.421 5.186 . 0 0 "[ . 1 . 2]" 2
1048 1 29 GLU H 1 36 TRP HH2 . . 5.500 5.399 5.012 5.512 0.012 8 0 "[ . 1 . 2]" 2
1049 1 30 CYS HB3 1 35 ASP HB2 . . 4.840 3.049 2.683 3.347 . 0 0 "[ . 1 . 2]" 2
1050 1 35 ASP HB3 1 36 TRP H . . 4.120 2.456 1.887 3.290 . 0 0 "[ . 1 . 2]" 2
1051 1 29 GLU HA 1 34 GLN HA . . 5.500 5.034 4.840 5.327 . 0 0 "[ . 1 . 2]" 2
1052 1 32 LEU H 1 34 GLN HA . . 5.450 4.310 4.182 4.473 . 0 0 "[ . 1 . 2]" 2
1053 1 34 GLN HB2 1 35 ASP H . . 5.190 4.229 4.010 4.399 . 0 0 "[ . 1 . 2]" 2
1054 1 34 GLN HB3 1 35 ASP H . . 5.190 4.395 4.353 4.460 . 0 0 "[ . 1 . 2]" 2
1055 1 32 LEU HB3 1 60 CYS HB3 . . 4.550 3.604 3.226 4.024 . 0 0 "[ . 1 . 2]" 2
1056 1 32 LEU HB2 1 34 GLN H . . 5.160 4.416 4.256 4.638 . 0 0 "[ . 1 . 2]" 2
1057 1 32 LEU HG 1 60 CYS HB2 . . 4.980 4.401 4.157 4.592 . 0 0 "[ . 1 . 2]" 2
1058 1 32 LEU MD2 1 64 PHE HB2 . . 4.750 4.069 3.577 4.646 . 0 0 "[ . 1 . 2]" 2
1059 1 31 GLY HA3 1 32 LEU HG . . 4.300 4.021 3.883 4.150 . 0 0 "[ . 1 . 2]" 2
1060 1 31 GLY HA2 1 55 TYR H . . 5.500 5.528 5.504 5.567 0.067 13 0 "[ . 1 . 2]" 2
1061 1 31 GLY HA2 1 32 LEU MD2 . . 5.500 4.685 4.351 4.872 . 0 0 "[ . 1 . 2]" 2
1062 1 30 CYS HB2 1 57 CYS HB2 . . 4.060 3.819 3.617 4.036 . 0 0 "[ . 1 . 2]" 2
1063 1 29 GLU HA 1 30 CYS HB2 . . 4.750 4.613 4.553 4.673 . 0 0 "[ . 1 . 2]" 2
1064 1 30 CYS HB2 1 37 PHE QD . . 4.400 3.714 3.378 4.011 . 0 0 "[ . 1 . 2]" 2
1065 1 30 CYS HB2 1 35 ASP H . . 4.190 3.680 3.378 4.068 . 0 0 "[ . 1 . 2]" 2
1066 1 30 CYS HB2 1 31 GLY H . . 4.860 4.206 4.145 4.272 . 0 0 "[ . 1 . 2]" 2
1067 1 29 GLU HA 1 30 CYS HB3 . . 4.850 4.546 4.492 4.615 . 0 0 "[ . 1 . 2]" 2
1068 1 30 CYS HB3 1 34 GLN HA . . 4.910 3.937 3.653 4.283 . 0 0 "[ . 1 . 2]" 2
1069 1 30 CYS HB3 1 37 PHE QD . . 4.840 4.545 4.179 4.845 0.005 8 0 "[ . 1 . 2]" 2
1070 1 30 CYS HB3 1 31 GLY H . . 5.030 4.264 4.184 4.339 . 0 0 "[ . 1 . 2]" 2
1071 1 30 CYS HA 1 57 CYS HB3 . . 5.000 4.337 4.221 4.516 . 0 0 "[ . 1 . 2]" 2
1072 1 26 PHE HA 1 26 PHE QD . . 4.210 3.048 2.551 3.397 . 0 0 "[ . 1 . 2]" 2
1073 1 29 GLU HA 1 29 GLU HG3 . . 3.930 2.919 2.512 3.651 . 0 0 "[ . 1 . 2]" 2
1074 1 29 GLU HA 1 36 TRP HE3 . . 5.060 4.256 4.125 4.399 . 0 0 "[ . 1 . 2]" 2
1075 1 29 GLU HA 1 37 PHE QE . . 5.500 5.010 4.486 5.279 . 0 0 "[ . 1 . 2]" 2
1076 1 29 GLU HA 1 36 TRP HZ2 . . 5.500 5.452 5.204 5.543 0.043 9 0 "[ . 1 . 2]" 2
1077 1 29 GLU HA 1 37 PHE QD . . 4.800 4.124 3.800 4.312 . 0 0 "[ . 1 . 2]" 2
1078 1 28 ILE HA 1 29 GLU HB2 . . 4.860 4.301 4.205 4.463 . 0 0 "[ . 1 . 2]" 2
1079 1 29 GLU HB2 1 36 TRP HE3 . . 4.830 4.117 3.808 4.365 . 0 0 "[ . 1 . 2]" 2
1080 1 29 GLU HB2 1 36 TRP HD1 . . 5.100 4.961 4.362 5.134 0.034 1 0 "[ . 1 . 2]" 2
1081 1 29 GLU HB2 1 30 CYS H . . 4.600 4.256 4.161 4.350 . 0 0 "[ . 1 . 2]" 2
1082 1 28 ILE HA 1 29 GLU HB3 . . 4.710 4.617 4.415 4.731 0.021 7 0 "[ . 1 . 2]" 2
1083 1 29 GLU HB3 1 36 TRP HA . . 5.500 5.378 5.063 5.503 0.003 2 0 "[ . 1 . 2]" 2
1084 1 29 GLU HB3 1 36 TRP HZ3 . . 5.500 5.181 4.964 5.527 0.027 2 0 "[ . 1 . 2]" 2
1085 1 29 GLU HB3 1 30 CYS H . . 4.590 4.218 4.015 4.360 . 0 0 "[ . 1 . 2]" 2
1086 1 29 GLU HG3 1 34 GLN HA . . 4.270 3.575 3.201 3.884 . 0 0 "[ . 1 . 2]" 2
1087 1 29 GLU H 1 29 GLU HG3 . . 5.240 4.843 4.733 4.988 . 0 0 "[ . 1 . 2]" 2
1088 1 29 GLU HG3 1 30 CYS H . . 4.690 3.718 2.929 4.551 . 0 0 "[ . 1 . 2]" 2
1089 1 29 GLU HG2 1 30 CYS H . . 4.120 2.899 2.686 3.176 . 0 0 "[ . 1 . 2]" 2
1090 1 29 GLU HG2 1 36 TRP HE1 . . 5.290 4.676 4.041 4.941 . 0 0 "[ . 1 . 2]" 2
1091 1 28 ILE HA 1 36 TRP HZ3 . . 4.250 3.152 2.701 3.547 . 0 0 "[ . 1 . 2]" 2
1092 1 28 ILE HA 1 36 TRP HE3 . . 4.140 3.726 3.324 4.103 . 0 0 "[ . 1 . 2]" 2
1093 1 28 ILE HB 1 44 ILE HB . . 5.500 5.228 4.716 5.587 0.087 16 0 "[ . 1 . 2]" 2
1094 1 27 MET HA 1 28 ILE HB . . 5.500 5.313 4.996 5.567 0.067 9 0 "[ . 1 . 2]" 2
1095 1 26 PHE HZ 1 28 ILE HB . . 4.650 4.477 4.188 4.670 0.020 11 0 "[ . 1 . 2]" 2
1096 1 28 ILE HB 1 29 GLU H . . 4.370 2.414 1.952 3.024 . 0 0 "[ . 1 . 2]" 2
1097 1 28 ILE HG12 1 44 ILE HB . . 5.100 2.952 2.633 3.084 . 0 0 "[ . 1 . 2]" 2
1098 1 28 ILE HG12 1 49 ALA MB . . 5.500 3.958 3.142 4.744 . 0 0 "[ . 1 . 2]" 2
1099 1 28 ILE HG12 1 55 TYR HB3 . . 5.210 4.911 4.675 5.160 . 0 0 "[ . 1 . 2]" 2
1100 1 28 ILE HG12 1 55 TYR HB2 . . 4.660 4.107 3.879 4.235 . 0 0 "[ . 1 . 2]" 2
1101 1 26 PHE QE 1 28 ILE HG12 . . 4.780 2.849 2.320 3.408 . 0 0 "[ . 1 . 2]" 2
1102 1 28 ILE H 1 28 ILE HG12 . . 4.280 3.699 3.358 4.118 . 0 0 "[ . 1 . 2]" 2
1103 1 28 ILE HG13 1 42 VAL MG2 . . 4.530 3.987 3.571 4.493 . 0 0 "[ . 1 . 2]" 2
1104 1 28 ILE HG13 1 55 TYR HB2 . . 5.500 5.504 5.359 5.539 0.039 20 0 "[ . 1 . 2]" 2
1105 1 28 ILE H 1 28 ILE HG13 . . 4.210 2.373 1.881 2.900 . 0 0 "[ . 1 . 2]" 2
1106 1 28 ILE MG 1 55 TYR HD2 . . 4.710 3.381 2.192 4.493 . 0 0 "[ . 1 . 2]" 2
1107 1 28 ILE MD 1 55 TYR HE2 . . 5.500 2.751 1.974 3.614 . 0 0 "[ . 1 . 2]" 2
1108 1 27 MET HA 1 38 HIS HA . . 4.360 2.574 2.268 2.800 . 0 0 "[ . 1 . 2]" 2
1109 1 27 MET HB3 1 36 TRP HB3 . . 5.230 3.109 2.307 3.669 . 0 0 "[ . 1 . 2]" 2
1110 1 27 MET HB3 1 36 TRP HZ3 . . 4.290 3.546 3.002 4.300 0.010 4 0 "[ . 1 . 2]" 2
1111 1 27 MET HB3 1 36 TRP HE3 . . 3.980 2.036 1.954 2.233 . 0 0 "[ . 1 . 2]" 2
1112 1 27 MET HB3 1 28 ILE H . . 4.110 2.884 2.502 3.403 . 0 0 "[ . 1 . 2]" 2
1113 1 27 MET HB2 1 27 MET ME . . 4.120 3.683 3.310 3.968 . 0 0 "[ . 1 . 2]" 2
1114 1 27 MET HB2 1 36 TRP HB3 . . 5.460 4.586 3.752 5.157 . 0 0 "[ . 1 . 2]" 2
1115 1 27 MET HB2 1 38 HIS HA . . 4.890 4.679 4.429 4.850 . 0 0 "[ . 1 . 2]" 2
1116 1 27 MET HB3 1 38 HIS HA . . 4.880 4.293 4.039 4.606 . 0 0 "[ . 1 . 2]" 2
1117 1 27 MET HB2 1 36 TRP HZ3 . . 4.460 3.795 3.529 4.334 . 0 0 "[ . 1 . 2]" 2
1118 1 27 MET HB2 1 38 HIS HD2 . . 5.150 4.386 4.249 4.670 . 0 0 "[ . 1 . 2]" 2
1119 1 27 MET H 1 27 MET HG2 . . 4.560 4.284 3.548 4.519 . 0 0 "[ . 1 . 2]" 2
1120 1 27 MET HG3 1 39 GLY H . . 5.090 4.655 4.178 5.197 0.107 16 0 "[ . 1 . 2]" 2
1121 1 26 PHE HB3 1 46 GLU HB2 . . 5.060 3.464 2.418 4.194 . 0 0 "[ . 1 . 2]" 2
1122 1 26 PHE HB2 1 46 GLU HB2 . . 5.060 2.631 2.260 2.990 . 0 0 "[ . 1 . 2]" 2
1123 1 25 HIS HB2 1 26 PHE H . . 4.900 3.838 2.261 4.348 . 0 0 "[ . 1 . 2]" 2
1124 1 25 HIS HB3 1 26 PHE H . . 4.900 2.875 2.113 3.696 . 0 0 "[ . 1 . 2]" 2
1125 1 23 VAL MG2 1 24 ASN HA . . 5.360 3.961 3.510 5.422 0.062 19 0 "[ . 1 . 2]" 2
1126 1 22 ASN HB2 1 23 VAL HA . . 5.500 5.355 5.090 5.727 0.227 20 0 "[ . 1 . 2]" 2
1127 1 22 ASN HB3 1 23 VAL HA . . 5.500 5.078 4.424 5.455 . 0 0 "[ . 1 . 2]" 2
1128 1 23 VAL HA 1 25 HIS H . . 5.500 4.290 3.473 5.028 . 0 0 "[ . 1 . 2]" 2
1129 1 22 ASN HA 1 23 VAL HB . . 5.020 4.653 4.315 4.841 . 0 0 "[ . 1 . 2]" 2
1130 1 23 VAL MG1 1 24 ASN HD22 . . 5.500 3.179 2.199 4.695 . 0 0 "[ . 1 . 2]" 2
1131 1 23 VAL MG1 1 25 HIS H . . 5.500 4.364 4.037 4.855 . 0 0 "[ . 1 . 2]" 2
1132 1 22 ASN HB2 1 25 HIS HB2 . . 5.500 2.639 2.091 3.718 . 0 0 "[ . 1 . 2]" 2
1133 1 22 ASN HB3 1 25 HIS HB2 . . 5.500 2.783 1.944 3.470 . 0 0 "[ . 1 . 2]" 2
1134 1 22 ASN HB2 1 25 HIS HB3 . . 5.500 4.236 3.319 5.406 . 0 0 "[ . 1 . 2]" 2
1135 1 22 ASN HB3 1 25 HIS HB3 . . 5.500 4.458 3.240 5.198 . 0 0 "[ . 1 . 2]" 2
1136 1 22 ASN HB3 1 23 VAL H . . 5.040 3.738 3.035 4.294 . 0 0 "[ . 1 . 2]" 2
1137 1 12 PRO HG2 1 13 VAL H . . 5.500 4.570 4.273 4.956 . 0 0 "[ . 1 . 2]" 2
1138 1 12 PRO HG3 1 13 VAL H . . 5.500 5.237 4.946 5.652 0.152 15 0 "[ . 1 . 2]" 2
1139 1 19 GLN H 1 20 PRO HD2 . . 5.100 4.830 4.819 4.837 . 0 0 "[ . 1 . 2]" 2
1140 1 19 GLN H 1 20 PRO HD3 . . 5.060 4.922 4.809 4.999 . 0 0 "[ . 1 . 2]" 2
1141 1 13 VAL MG1 1 19 GLN HA . . 5.500 2.165 1.973 2.431 . 0 0 "[ . 1 . 2]" 2
1142 1 19 GLN HB2 1 20 PRO HD2 . . 3.990 3.731 3.527 3.961 . 0 0 "[ . 1 . 2]" 2
1143 1 19 GLN HB2 1 20 PRO HD3 . . 4.970 4.758 4.627 4.900 . 0 0 "[ . 1 . 2]" 2
1144 1 17 CYS HA 1 19 GLN HG2 . . 5.500 4.387 4.225 4.628 . 0 0 "[ . 1 . 2]" 2
1145 1 19 GLN HG2 1 38 HIS HE1 . . 5.270 3.741 3.076 4.471 . 0 0 "[ . 1 . 2]" 2
1146 1 18 ARG HA 1 19 GLN HG2 . . 5.090 4.873 4.518 5.050 . 0 0 "[ . 1 . 2]" 2
1147 1 13 VAL MG1 1 18 ARG HB2 . . 5.060 4.154 3.926 4.439 . 0 0 "[ . 1 . 2]" 2
1148 1 13 VAL MG1 1 18 ARG HB3 . . 5.060 3.190 2.767 3.460 . 0 0 "[ . 1 . 2]" 2
1149 1 13 VAL MG2 1 18 ARG HG3 . . 5.080 3.854 2.619 4.959 . 0 0 "[ . 1 . 2]" 2
1150 1 18 ARG HD2 1 19 GLN HE21 . . 5.500 5.516 5.386 5.559 0.059 20 0 "[ . 1 . 2]" 2
1151 1 15 CYS HB3 1 37 PHE HB3 . . 5.500 5.415 5.161 5.531 0.031 16 0 "[ . 1 . 2]" 2
1152 1 16 LEU HA 1 18 ARG HD2 . . 5.500 4.317 3.367 5.321 . 0 0 "[ . 1 . 2]" 2
1153 1 16 LEU HA 1 18 ARG HD3 . . 5.500 4.211 3.091 5.296 . 0 0 "[ . 1 . 2]" 2
1154 1 18 ARG HD3 1 19 GLN HE21 . . 5.500 5.272 4.736 5.522 0.022 18 0 "[ . 1 . 2]" 2
1155 1 18 ARG HD2 1 19 GLN H . . 5.500 4.949 4.564 5.339 . 0 0 "[ . 1 . 2]" 2
1156 1 16 LEU H 1 41 CYS HB3 . . 4.580 4.031 3.403 4.367 . 0 0 "[ . 1 . 2]" 2
1157 1 38 HIS H 1 41 CYS HB3 . . 5.040 4.235 3.712 4.947 . 0 0 "[ . 1 . 2]" 2
1158 1 16 LEU HB3 1 41 CYS HB3 . . 5.500 5.469 5.212 5.572 0.072 16 0 "[ . 1 . 2]" 2
1159 1 16 LEU HB3 1 37 PHE QE . . 5.500 4.985 4.622 5.248 . 0 0 "[ . 1 . 2]" 2
1160 1 16 LEU HB3 1 37 PHE QD . . 5.290 5.202 4.960 5.321 0.031 19 0 "[ . 1 . 2]" 2
1161 1 16 LEU HB3 1 17 CYS H . . 4.280 4.179 4.084 4.319 0.039 19 0 "[ . 1 . 2]" 2
1162 1 32 LEU HB2 1 64 PHE QD . . 5.450 5.125 4.857 5.385 . 0 0 "[ . 1 . 2]" 2
1163 1 16 LEU HB2 1 37 PHE QD . . 5.030 4.710 4.527 4.961 . 0 0 "[ . 1 . 2]" 2
1164 1 16 LEU HG 1 58 PRO HD2 . . 5.500 5.013 4.591 5.323 . 0 0 "[ . 1 . 2]" 2
1165 1 16 LEU HG 1 37 PHE QE . . 4.600 3.001 2.721 3.448 . 0 0 "[ . 1 . 2]" 2
1166 1 16 LEU MD1 1 37 PHE QE . . 4.420 4.057 3.719 4.442 0.022 9 0 "[ . 1 . 2]" 2
1167 1 16 LEU MD2 1 17 CYS H . . 4.880 4.789 4.725 4.852 . 0 0 "[ . 1 . 2]" 2
1168 1 15 CYS HA 1 37 PHE QE . . 4.630 3.221 2.945 3.892 . 0 0 "[ . 1 . 2]" 2
1169 1 15 CYS HA 1 37 PHE QD . . 4.150 2.276 1.989 2.841 . 0 0 "[ . 1 . 2]" 2
1170 1 14 TYR HB2 1 15 CYS HB2 . . 4.860 4.006 3.859 4.106 . 0 0 "[ . 1 . 2]" 2
1171 1 15 CYS HB2 1 37 PHE HB3 . . 5.100 4.544 4.177 4.749 . 0 0 "[ . 1 . 2]" 2
1172 1 15 CYS HB2 1 17 CYS H . . 4.350 4.184 4.022 4.301 . 0 0 "[ . 1 . 2]" 2
1173 1 15 CYS H 1 15 CYS HB2 . . 3.970 2.291 2.225 2.369 . 0 0 "[ . 1 . 2]" 2
1174 1 15 CYS HB2 1 16 LEU H . . 4.360 3.812 3.743 3.840 . 0 0 "[ . 1 . 2]" 2
1175 1 14 TYR HB2 1 36 TRP H . . 5.030 2.635 2.248 2.988 . 0 0 "[ . 1 . 2]" 2
1176 1 14 TYR HB3 1 27 MET ME . . 4.500 4.536 4.509 4.588 0.088 13 0 "[ . 1 . 2]" 2
1177 1 13 VAL HA 1 20 PRO HB3 . . 4.810 3.668 3.297 3.871 . 0 0 "[ . 1 . 2]" 2
1178 1 13 VAL HA 1 19 GLN HB2 . . 5.500 5.464 5.168 5.693 0.193 13 0 "[ . 1 . 2]" 2
1179 1 13 VAL HA 1 20 PRO HG2 . . 5.500 5.476 5.279 5.549 0.049 12 0 "[ . 1 . 2]" 2
1180 1 13 VAL HA 1 14 TYR HB2 . . 5.240 4.855 4.756 4.976 . 0 0 "[ . 1 . 2]" 2
1181 1 13 VAL HA 1 20 PRO HB2 . . 4.940 4.586 4.408 4.786 . 0 0 "[ . 1 . 2]" 2
1182 1 28 ILE HA 1 29 GLU HA . . 4.740 4.478 4.421 4.532 . 0 0 "[ . 1 . 2]" 2
1183 1 29 GLU HG2 1 36 TRP HD1 . . 5.500 5.232 4.268 5.513 0.013 18 0 "[ . 1 . 2]" 2
1184 1 29 GLU HG2 1 34 GLN H . . 4.920 4.507 4.096 4.874 . 0 0 "[ . 1 . 2]" 2
1185 1 13 VAL HB 1 18 ARG H . . 4.800 4.092 3.845 4.275 . 0 0 "[ . 1 . 2]" 2
1186 1 13 VAL MG1 1 20 PRO HD2 . . 4.020 3.571 3.404 3.687 . 0 0 "[ . 1 . 2]" 2
1187 1 13 VAL MG1 1 14 TYR QD . . 5.160 4.818 4.642 5.211 0.051 13 0 "[ . 1 . 2]" 2
1188 1 12 PRO HB3 1 13 VAL MG2 . . 5.500 4.765 4.649 5.196 . 0 0 "[ . 1 . 2]" 2
1189 1 13 VAL MG2 1 19 GLN HE21 . . 5.410 5.379 5.160 5.454 0.044 12 0 "[ . 1 . 2]" 2
1190 1 13 VAL MG2 1 14 TYR QD . . 5.270 4.919 4.494 5.150 . 0 0 "[ . 1 . 2]" 2
1191 1 11 VAL HB 1 14 TYR QE . . 5.500 5.244 4.854 5.554 0.054 13 0 "[ . 1 . 2]" 2
1192 1 12 PRO HB3 1 14 TYR QE . . 5.500 5.436 4.966 5.544 0.044 2 0 "[ . 1 . 2]" 2
1193 1 20 PRO HG3 1 21 TYR H . . 4.990 3.462 3.399 3.493 . 0 0 "[ . 1 . 2]" 2
1194 1 13 VAL MG1 1 20 PRO HG2 . . 4.900 4.680 4.562 4.744 . 0 0 "[ . 1 . 2]" 2
1195 1 11 VAL H 1 12 PRO HD2 . . 5.240 4.732 4.632 4.827 . 0 0 "[ . 1 . 2]" 2
1196 1 11 VAL H 1 12 PRO HD3 . . 5.320 4.626 4.244 4.899 . 0 0 "[ . 1 . 2]" 2
1197 1 10 LEU HA 1 11 VAL HB . . 4.900 4.735 4.479 4.875 . 0 0 "[ . 1 . 2]" 2
1198 1 10 LEU HB3 1 11 VAL H . . 4.500 3.841 3.278 4.451 . 0 0 "[ . 1 . 2]" 2
1199 1 9 ALA HA 1 10 LEU HG . . 5.500 4.474 3.460 5.524 0.024 5 0 "[ . 1 . 2]" 2
1200 1 8 MET HA 1 9 ALA MB . . 5.440 4.203 3.816 4.864 . 0 0 "[ . 1 . 2]" 2
1201 1 70 LYS HA 1 71 ASN HA . . 4.930 4.461 4.358 5.203 0.273 17 0 "[ . 1 . 2]" 2
1202 1 53 ASP HA 1 70 LYS HA . . 4.520 4.273 3.953 4.534 0.014 17 0 "[ . 1 . 2]" 2
1203 1 70 LYS HA 1 70 LYS HD3 . . 4.650 4.148 3.916 4.652 0.002 18 0 "[ . 1 . 2]" 2
1204 1 70 LYS HB3 1 71 ASN H . . 4.280 2.405 1.977 4.352 0.072 17 0 "[ . 1 . 2]" 2
1205 1 70 LYS HB2 1 71 ASN H . . 4.070 3.448 3.121 3.977 . 0 0 "[ . 1 . 2]" 2
1206 1 69 MET HA 1 70 LYS HG3 . . 5.500 3.983 3.490 4.246 . 0 0 "[ . 1 . 2]" 2
1207 1 69 MET HA 1 70 LYS HG2 . . 5.020 4.686 3.962 5.093 0.073 20 0 "[ . 1 . 2]" 2
1208 1 70 LYS HG3 1 71 ASN H . . 5.250 4.837 3.942 5.169 . 0 0 "[ . 1 . 2]" 2
1209 1 53 ASP H 1 70 LYS HG3 . . 4.850 2.790 2.146 3.324 . 0 0 "[ . 1 . 2]" 2
1210 1 53 ASP H 1 70 LYS HG2 . . 3.720 3.373 2.980 3.695 . 0 0 "[ . 1 . 2]" 2
1211 1 70 LYS HG2 1 71 ASN H . . 4.540 4.148 3.988 4.633 0.093 17 0 "[ . 1 . 2]" 2
1212 1 51 ASP HA 1 70 LYS HD2 . . 3.910 3.450 2.421 3.884 . 0 0 "[ . 1 . 2]" 2
1213 1 53 ASP HA 1 70 LYS HD3 . . 4.150 3.800 3.107 4.123 . 0 0 "[ . 1 . 2]" 2
1214 1 70 LYS HA 1 70 LYS HE3 . . 5.500 5.483 5.402 5.577 0.077 18 0 "[ . 1 . 2]" 2
1215 1 44 ILE HG13 1 45 GLU H . . 5.050 4.876 4.736 4.957 . 0 0 "[ . 1 . 2]" 2
1216 1 56 HIS HA 1 67 SER HA . . 5.500 4.710 4.572 4.903 . 0 0 "[ . 1 . 2]" 2
1217 1 65 GLY HA2 1 66 PRO HG2 . . 5.500 5.225 5.153 5.268 . 0 0 "[ . 1 . 2]" 2
1218 1 65 GLY HA2 1 66 PRO HG3 . . 5.500 5.170 5.087 5.222 . 0 0 "[ . 1 . 2]" 2
1219 1 66 PRO HD2 1 67 SER H . . 5.500 5.545 5.491 5.603 0.103 15 0 "[ . 1 . 2]" 2
1220 1 66 PRO HD3 1 67 SER H . . 5.500 5.512 5.472 5.554 0.054 15 0 "[ . 1 . 2]" 2
1221 1 26 PHE QD 1 46 GLU H . . 5.500 3.547 2.998 4.011 . 0 0 "[ . 1 . 2]" 2
1222 1 26 PHE QD 1 28 ILE H . . 5.500 4.881 4.179 5.341 . 0 0 "[ . 1 . 2]" 2
1223 1 26 PHE QD 1 47 GLU H . . 5.500 5.435 4.862 5.555 0.055 3 0 "[ . 1 . 2]" 2
1224 1 61 GLU H 1 62 ALA HA . . 5.410 5.272 5.224 5.335 . 0 0 "[ . 1 . 2]" 2
1225 1 62 ALA HA 1 65 GLY H . . 5.500 5.102 5.039 5.228 . 0 0 "[ . 1 . 2]" 2
1226 1 62 ALA HA 1 64 PHE H . . 5.500 5.229 5.099 5.312 . 0 0 "[ . 1 . 2]" 2
1227 1 61 GLU H 1 62 ALA MB . . 4.420 4.282 4.229 4.339 . 0 0 "[ . 1 . 2]" 2
1228 1 60 CYS H 1 62 ALA MB . . 4.860 4.751 4.671 4.814 . 0 0 "[ . 1 . 2]" 2
1229 1 62 ALA MB 1 64 PHE H . . 4.920 4.912 4.818 4.971 0.051 5 0 "[ . 1 . 2]" 2
1230 1 62 ALA MB 1 65 GLY H . . 5.500 5.525 5.484 5.590 0.090 16 0 "[ . 1 . 2]" 2
1231 1 59 ASP H 1 62 ALA MB . . 5.500 5.275 5.196 5.352 . 0 0 "[ . 1 . 2]" 2
1232 1 61 GLU HA 1 65 GLY HA2 . . 5.130 3.471 3.362 3.593 . 0 0 "[ . 1 . 2]" 2
1233 1 57 CYS HB3 1 58 PRO HD3 . . 4.520 4.413 4.367 4.433 . 0 0 "[ . 1 . 2]" 2
1234 1 61 GLU HG3 1 65 GLY HA2 . . 5.500 3.203 2.921 3.365 . 0 0 "[ . 1 . 2]" 2
1235 1 58 PRO HA 1 61 GLU HG2 . . 5.180 5.102 4.728 5.231 0.051 3 0 "[ . 1 . 2]" 2
1236 1 61 GLU HG2 1 62 ALA HA . . 4.640 3.578 3.388 3.899 . 0 0 "[ . 1 . 2]" 2
1237 1 60 CYS HA 1 64 PHE HB2 . . 5.500 4.573 4.350 4.711 . 0 0 "[ . 1 . 2]" 2
1238 1 59 ASP HA 1 60 CYS HA . . 5.500 4.623 4.604 4.649 . 0 0 "[ . 1 . 2]" 2
1239 1 60 CYS HA 1 64 PHE H . . 3.970 3.903 3.744 3.995 0.025 1 0 "[ . 1 . 2]" 2
1240 1 59 ASP H 1 60 CYS HA . . 5.500 4.750 4.723 4.790 . 0 0 "[ . 1 . 2]" 2
1241 1 60 CYS HB2 1 61 GLU H . . 4.160 2.833 2.780 2.878 . 0 0 "[ . 1 . 2]" 2
1242 1 57 CYS H 1 60 CYS HB2 . . 4.390 3.594 3.519 3.710 . 0 0 "[ . 1 . 2]" 2
1243 1 57 CYS H 1 60 CYS HB3 . . 5.300 5.186 5.081 5.296 . 0 0 "[ . 1 . 2]" 2
1244 1 60 CYS HB2 1 64 PHE QD . . 4.390 4.143 4.008 4.357 . 0 0 "[ . 1 . 2]" 2
1245 1 60 CYS HB3 1 64 PHE QD . . 4.110 2.537 2.407 2.824 . 0 0 "[ . 1 . 2]" 2
1246 1 56 HIS HA 1 60 CYS HB3 . . 5.500 5.179 4.891 5.340 . 0 0 "[ . 1 . 2]" 2
1247 1 56 HIS HB3 1 60 CYS HB3 . . 4.640 4.524 4.186 4.694 0.054 3 0 "[ . 1 . 2]" 2
1248 1 60 CYS HB2 1 64 PHE HB3 . . 5.500 5.513 5.451 5.532 0.032 3 0 "[ . 1 . 2]" 2
1249 1 60 CYS HB3 1 64 PHE HB3 . . 5.090 4.613 4.359 4.788 . 0 0 "[ . 1 . 2]" 2
1250 1 32 LEU HB2 1 60 CYS HB2 . . 4.560 3.570 3.366 3.849 . 0 0 "[ . 1 . 2]" 2
1251 1 32 LEU HB2 1 60 CYS HB3 . . 4.360 3.517 3.295 3.799 . 0 0 "[ . 1 . 2]" 2
1252 1 32 LEU HB3 1 60 CYS HB2 . . 4.710 4.418 4.097 4.759 0.049 7 0 "[ . 1 . 2]" 2
1253 1 32 LEU HG 1 60 CYS HB3 . . 4.960 4.455 4.218 4.741 . 0 0 "[ . 1 . 2]" 2
1254 1 32 LEU MD2 1 60 CYS HB2 . . 5.500 4.871 4.615 5.104 . 0 0 "[ . 1 . 2]" 2
1255 1 32 LEU MD2 1 60 CYS HB3 . . 5.500 4.222 3.947 4.480 . 0 0 "[ . 1 . 2]" 2
1256 1 59 ASP HB2 1 60 CYS HA . . 5.500 5.588 5.561 5.633 0.133 12 0 "[ . 1 . 2]" 2
1257 1 59 ASP HB3 1 60 CYS HA . . 5.500 4.399 4.145 4.943 . 0 0 "[ . 1 . 2]" 2
1258 1 37 PHE QE 1 57 CYS HB3 . . 3.810 2.746 2.473 3.071 . 0 0 "[ . 1 . 2]" 2
1259 1 30 CYS HB3 1 57 CYS HB2 . . 5.340 4.953 4.691 5.191 . 0 0 "[ . 1 . 2]" 2
1260 1 30 CYS HB2 1 56 HIS HA . . 4.300 3.982 3.755 4.299 . 0 0 "[ . 1 . 2]" 2
1261 1 56 HIS HA 1 60 CYS HB2 . . 4.560 3.929 3.760 4.026 . 0 0 "[ . 1 . 2]" 2
1262 1 56 HIS HB3 1 61 GLU HB2 . . 4.310 2.947 2.801 3.133 . 0 0 "[ . 1 . 2]" 2
1263 1 19 GLN HB3 1 20 PRO HG3 . . 5.290 4.875 4.682 5.093 . 0 0 "[ . 1 . 2]" 2
1264 1 56 HIS HB3 1 61 GLU HB3 . . 5.500 4.411 4.272 4.599 . 0 0 "[ . 1 . 2]" 2
1265 1 56 HIS HB3 1 60 CYS HB2 . . 3.550 3.414 3.139 3.553 0.003 19 0 "[ . 1 . 2]" 2
1266 1 56 HIS HB2 1 61 GLU HB3 . . 5.500 5.287 5.106 5.494 . 0 0 "[ . 1 . 2]" 2
1267 1 32 LEU H 1 56 HIS HD2 . . 4.730 4.597 4.373 4.736 0.006 2 0 "[ . 1 . 2]" 2
1268 1 56 HIS HD2 1 68 ILE H . . 5.260 4.205 3.951 4.636 . 0 0 "[ . 1 . 2]" 2
1269 1 56 HIS H 1 56 HIS HD2 . . 5.500 3.672 3.478 3.880 . 0 0 "[ . 1 . 2]" 2
1270 1 55 TYR H 1 56 HIS HD2 . . 5.500 4.504 4.242 4.884 . 0 0 "[ . 1 . 2]" 2
1271 1 54 ILE HA 1 56 HIS HD2 . . 5.430 4.835 4.578 5.150 . 0 0 "[ . 1 . 2]" 2
1272 1 31 GLY HA2 1 56 HIS HD2 . . 5.500 5.380 5.076 5.507 0.007 5 0 "[ . 1 . 2]" 2
1273 1 31 GLY HA3 1 56 HIS HD2 . . 5.500 4.057 3.725 4.182 . 0 0 "[ . 1 . 2]" 2
1274 1 54 ILE HB 1 56 HIS HD2 . . 5.500 4.146 3.902 4.523 . 0 0 "[ . 1 . 2]" 2
1275 1 32 LEU HG 1 56 HIS HD2 . . 3.890 2.795 2.453 3.074 . 0 0 "[ . 1 . 2]" 2
1276 1 56 HIS HE1 1 68 ILE MD . . 4.200 3.429 2.862 4.203 0.003 6 0 "[ . 1 . 2]" 2
1277 1 44 ILE MD 1 55 TYR HA . . 4.020 3.846 3.656 4.051 0.031 13 0 "[ . 1 . 2]" 2
1278 1 52 ILE MD 1 55 TYR HA . . 3.810 3.726 3.565 3.819 0.009 10 0 "[ . 1 . 2]" 2
1279 1 54 ILE MG 1 55 TYR HA . . 4.510 4.286 4.188 4.387 . 0 0 "[ . 1 . 2]" 2
1280 1 30 CYS H 1 55 TYR HB3 . . 5.010 4.815 4.655 4.992 . 0 0 "[ . 1 . 2]" 2
1281 1 30 CYS HA 1 55 TYR HB3 . . 4.660 3.244 3.101 3.434 . 0 0 "[ . 1 . 2]" 2
1282 1 44 ILE MD 1 55 TYR HB3 . . 4.410 4.325 4.200 4.427 0.017 4 0 "[ . 1 . 2]" 2
1283 1 52 ILE MD 1 55 TYR HB3 . . 4.650 4.635 4.499 4.704 0.054 14 0 "[ . 1 . 2]" 2
1284 1 54 ILE MG 1 55 TYR HB3 . . 4.700 4.578 4.460 4.679 . 0 0 "[ . 1 . 2]" 2
1285 1 30 CYS HA 1 55 TYR HB2 . . 5.150 4.716 4.618 4.842 . 0 0 "[ . 1 . 2]" 2
1286 1 54 ILE HA 1 68 ILE HB . . 4.570 4.292 4.184 4.398 . 0 0 "[ . 1 . 2]" 2
1287 1 54 ILE HB 1 67 SER HA . . 5.500 4.610 4.288 4.851 . 0 0 "[ . 1 . 2]" 2
1288 1 53 ASP HB2 1 70 LYS HB3 . . 4.460 3.972 3.643 4.167 . 0 0 "[ . 1 . 2]" 2
1289 1 53 ASP HB3 1 69 MET HA . . 5.430 3.916 3.806 4.114 . 0 0 "[ . 1 . 2]" 2
1290 1 53 ASP HB3 1 68 ILE HG13 . . 5.260 4.794 4.600 5.052 . 0 0 "[ . 1 . 2]" 2
1291 1 53 ASP HB3 1 70 LYS HG2 . . 3.750 3.601 3.455 3.763 0.013 8 0 "[ . 1 . 2]" 2
1292 1 53 ASP HB3 1 54 ILE MD . . 4.080 3.853 3.656 4.022 . 0 0 "[ . 1 . 2]" 2
1293 1 52 ILE MG 1 53 ASP HB3 . . 5.500 4.661 4.576 4.826 . 0 0 "[ . 1 . 2]" 2
1294 1 52 ILE MG 1 53 ASP HA . . 4.510 4.218 4.080 4.471 . 0 0 "[ . 1 . 2]" 2
1295 1 51 ASP HB3 1 52 ILE HG12 . . 5.500 5.168 4.096 5.488 . 0 0 "[ . 1 . 2]" 2
1296 1 46 GLU HA 1 49 ALA HA . . 5.500 4.904 4.773 5.105 . 0 0 "[ . 1 . 2]" 2
1297 1 48 ASN HB2 1 49 ALA HA . . 5.500 4.417 4.055 4.655 . 0 0 "[ . 1 . 2]" 2
1298 1 49 ALA MB 1 50 VAL HB . . 4.900 4.137 3.960 4.276 . 0 0 "[ . 1 . 2]" 2
1299 1 28 ILE HB 1 49 ALA MB . . 5.080 4.935 4.647 5.097 0.017 20 0 "[ . 1 . 2]" 2
1300 1 44 ILE HA 1 48 ASN HB2 . . 5.500 4.249 3.942 4.523 . 0 0 "[ . 1 . 2]" 2
1301 1 45 GLU HB3 1 48 ASN HB2 . . 5.200 4.150 3.848 4.653 . 0 0 "[ . 1 . 2]" 2
1302 1 47 GLU HG2 1 48 ASN HB2 . . 5.500 4.177 3.551 4.906 . 0 0 "[ . 1 . 2]" 2
1303 1 47 GLU HG3 1 48 ASN HB2 . . 5.500 4.191 3.335 5.397 . 0 0 "[ . 1 . 2]" 2
1304 1 48 ASN HB2 1 49 ALA MB . . 5.500 4.360 4.215 4.523 . 0 0 "[ . 1 . 2]" 2
1305 1 48 ASN HB2 1 52 ILE MD . . 4.840 3.422 2.877 3.635 . 0 0 "[ . 1 . 2]" 2
1306 1 48 ASN HB3 1 49 ALA MB . . 5.500 4.975 4.784 5.231 . 0 0 "[ . 1 . 2]" 2
1307 1 48 ASN HB3 1 49 ALA HA . . 5.500 4.392 4.161 4.726 . 0 0 "[ . 1 . 2]" 2
1308 1 44 ILE HA 1 48 ASN HB3 . . 5.500 5.104 4.531 5.438 . 0 0 "[ . 1 . 2]" 2
1309 1 46 GLU H 1 47 GLU HA . . 5.500 5.300 5.198 5.405 . 0 0 "[ . 1 . 2]" 2
1310 1 47 GLU HA 1 49 ALA H . . 4.910 4.451 4.275 4.626 . 0 0 "[ . 1 . 2]" 2
1311 1 47 GLU HA 1 50 VAL H . . 5.500 4.218 4.060 4.320 . 0 0 "[ . 1 . 2]" 2
1312 1 46 GLU HA 1 47 GLU HA . . 5.500 4.799 4.747 4.829 . 0 0 "[ . 1 . 2]" 2
1313 1 47 GLU HB3 1 48 ASN H . . 4.390 4.044 3.906 4.232 . 0 0 "[ . 1 . 2]" 2
1314 1 45 GLU HB3 1 46 GLU HA . . 5.500 4.820 4.668 5.013 . 0 0 "[ . 1 . 2]" 2
1315 1 46 GLU HA 1 48 ASN H . . 4.930 3.953 3.792 4.123 . 0 0 "[ . 1 . 2]" 2
1316 1 45 GLU HA 1 47 GLU H . . 4.800 4.196 3.915 4.538 . 0 0 "[ . 1 . 2]" 2
1317 1 26 PHE QD 1 45 GLU HA . . 5.070 4.107 3.142 4.587 . 0 0 "[ . 1 . 2]" 2
1318 1 45 GLU HA 1 48 ASN HB2 . . 5.500 4.751 4.485 5.111 . 0 0 "[ . 1 . 2]" 2
1319 1 44 ILE HB 1 45 GLU HA . . 5.500 5.048 4.852 5.204 . 0 0 "[ . 1 . 2]" 2
1320 1 45 GLU HA 1 46 GLU HB3 . . 5.500 4.863 4.611 5.154 . 0 0 "[ . 1 . 2]" 2
1321 1 45 GLU HA 1 49 ALA MB . . 5.500 5.133 4.812 5.377 . 0 0 "[ . 1 . 2]" 2
1322 1 45 GLU HA 1 46 GLU HB2 . . 4.940 4.528 4.360 4.682 . 0 0 "[ . 1 . 2]" 2
1323 1 44 ILE MG 1 45 GLU HA . . 5.080 3.735 3.358 4.020 . 0 0 "[ . 1 . 2]" 2
1324 1 45 GLU HB2 1 48 ASN HB2 . . 4.600 2.941 2.551 3.510 . 0 0 "[ . 1 . 2]" 2
1325 1 45 GLU HB2 1 47 GLU H . . 4.380 3.842 3.313 4.159 . 0 0 "[ . 1 . 2]" 2
1326 1 45 GLU HB3 1 48 ASN H . . 4.790 3.244 2.935 3.509 . 0 0 "[ . 1 . 2]" 2
1327 1 45 GLU HG2 1 46 GLU H . . 4.880 4.420 3.726 4.890 0.010 1 0 "[ . 1 . 2]" 2
1328 1 45 GLU HG3 1 46 GLU H . . 4.880 4.537 4.204 4.894 0.014 5 0 "[ . 1 . 2]" 2
1329 1 45 GLU HG2 1 48 ASN H . . 5.500 5.456 5.192 5.542 0.042 5 0 "[ . 1 . 2]" 2
1330 1 45 GLU HG3 1 48 ASN H . . 5.500 5.350 5.083 5.504 0.004 1 0 "[ . 1 . 2]" 2
1331 1 39 GLY HA2 1 44 ILE MD . . 4.870 4.096 3.737 4.419 . 0 0 "[ . 1 . 2]" 2
1332 1 42 VAL HB 1 44 ILE HG13 . . 5.500 3.691 3.303 4.085 . 0 0 "[ . 1 . 2]" 2
1333 1 42 VAL MG2 1 58 PRO HD2 . . 5.500 5.363 5.137 5.517 0.017 14 0 "[ . 1 . 2]" 2
1334 1 28 ILE MD 1 39 GLY HA2 . . 5.500 3.065 1.913 4.171 . 0 0 "[ . 1 . 2]" 2
1335 1 39 GLY HA2 1 44 ILE MG . . 3.870 3.827 3.681 3.910 0.040 7 0 "[ . 1 . 2]" 2
1336 1 39 GLY HA2 1 44 ILE HG12 . . 5.500 5.341 5.029 5.531 0.031 9 0 "[ . 1 . 2]" 2
1337 1 28 ILE HG13 1 39 GLY HA2 . . 5.500 4.090 3.762 4.409 . 0 0 "[ . 1 . 2]" 2
1338 1 39 GLY HA2 1 44 ILE HG13 . . 5.500 4.270 3.843 4.510 . 0 0 "[ . 1 . 2]" 2
1339 1 39 GLY HA2 1 41 CYS H . . 5.500 4.371 4.068 4.701 . 0 0 "[ . 1 . 2]" 2
1340 1 36 TRP HA 1 37 PHE QD . . 4.490 3.016 2.703 3.306 . 0 0 "[ . 1 . 2]" 2
1341 1 37 PHE HA 1 37 PHE QD . . 4.450 3.097 2.977 3.203 . 0 0 "[ . 1 . 2]" 2
1342 1 37 PHE QD 1 42 VAL MG1 . . 3.890 3.052 2.853 3.247 . 0 0 "[ . 1 . 2]" 2
1343 1 37 PHE QD 1 42 VAL MG2 . . 5.050 4.776 4.647 4.965 . 0 0 "[ . 1 . 2]" 2
1344 1 15 CYS HA 1 37 PHE HZ . . 5.500 4.764 4.410 5.291 . 0 0 "[ . 1 . 2]" 2
1345 1 30 CYS HB3 1 37 PHE HZ . . 5.500 5.160 4.648 5.512 0.012 8 0 "[ . 1 . 2]" 2
1346 1 30 CYS HB2 1 37 PHE HZ . . 5.480 5.003 4.255 5.445 . 0 0 "[ . 1 . 2]" 2
1347 1 37 PHE HZ 1 57 CYS HB3 . . 4.720 3.785 3.137 4.280 . 0 0 "[ . 1 . 2]" 2
1348 1 36 TRP HB2 1 37 PHE H . . 4.210 4.030 3.738 4.203 . 0 0 "[ . 1 . 2]" 2
1349 1 14 TYR HB3 1 36 TRP HB3 . . 5.400 4.695 4.266 5.379 . 0 0 "[ . 1 . 2]" 2
1350 1 29 GLU HA 1 36 TRP HB3 . . 4.860 4.625 4.244 4.832 . 0 0 "[ . 1 . 2]" 2
1351 1 35 ASP HB2 1 37 PHE QD . . 4.890 4.194 4.050 4.469 . 0 0 "[ . 1 . 2]" 2
1352 1 35 ASP HB3 1 37 PHE QD . . 5.140 4.010 3.763 4.281 . 0 0 "[ . 1 . 2]" 2
1353 1 32 LEU MD1 1 56 HIS HB3 . . 4.160 3.035 2.761 3.448 . 0 0 "[ . 1 . 2]" 2
1354 1 32 LEU MD1 1 64 PHE HA . . 4.950 4.569 4.323 4.816 . 0 0 "[ . 1 . 2]" 2
1355 1 30 CYS HA 1 31 GLY HA3 . . 5.050 4.373 4.368 4.378 . 0 0 "[ . 1 . 2]" 2
1356 1 30 CYS HA 1 31 GLY HA2 . . 4.910 4.375 4.366 4.387 . 0 0 "[ . 1 . 2]" 2
1357 1 30 CYS HB3 1 57 CYS H . . 4.260 3.913 3.667 4.177 . 0 0 "[ . 1 . 2]" 2
1358 1 30 CYS HB3 1 33 CYS H . . 4.050 2.962 2.808 3.147 . 0 0 "[ . 1 . 2]" 2
1359 1 30 CYS HB2 1 57 CYS H . . 3.660 2.571 2.253 2.881 . 0 0 "[ . 1 . 2]" 2
1360 1 28 ILE MG 1 52 ILE MD . . 3.260 3.153 3.004 3.242 . 0 0 "[ . 1 . 2]" 2
1361 1 28 ILE MG 1 52 ILE HG12 . . 5.500 5.502 5.360 5.582 0.082 16 0 "[ . 1 . 2]" 2
1362 1 28 ILE MG 1 39 GLY HA2 . . 5.500 5.409 5.078 5.621 0.121 18 0 "[ . 1 . 2]" 2
1363 1 27 MET HG2 1 36 TRP HE3 . . 5.090 4.484 4.144 5.008 . 0 0 "[ . 1 . 2]" 2
1364 1 27 MET HG3 1 36 TRP HE3 . . 5.090 4.875 4.425 5.059 . 0 0 "[ . 1 . 2]" 2
1365 1 21 TYR HA 1 27 MET ME . . 5.500 2.948 2.290 3.459 . 0 0 "[ . 1 . 2]" 2
1366 1 27 MET ME 1 38 HIS HB2 . . 5.500 4.577 4.181 5.300 . 0 0 "[ . 1 . 2]" 2
1367 1 15 CYS HA 1 27 MET ME . . 5.500 4.052 3.683 4.653 . 0 0 "[ . 1 . 2]" 2
1368 1 21 TYR HB2 1 27 MET ME . . 5.500 3.923 3.215 4.569 . 0 0 "[ . 1 . 2]" 2
1369 1 26 PHE QE 1 42 VAL MG2 . . 5.260 3.950 3.146 4.942 . 0 0 "[ . 1 . 2]" 2
1370 1 26 PHE QE 1 52 ILE MD . . 5.500 4.435 4.093 4.736 . 0 0 "[ . 1 . 2]" 2
1371 1 26 PHE QE 1 28 ILE HB . . 4.880 4.805 4.456 4.946 0.066 12 0 "[ . 1 . 2]" 2
1372 1 26 PHE QE 1 28 ILE HG13 . . 5.120 2.345 2.002 2.690 . 0 0 "[ . 1 . 2]" 2
1373 1 26 PHE QE 1 28 ILE HA . . 5.500 4.119 3.119 4.733 . 0 0 "[ . 1 . 2]" 2
1374 1 26 PHE HZ 1 28 ILE HG13 . . 5.160 2.621 2.084 3.321 . 0 0 "[ . 1 . 2]" 2
1375 1 14 TYR QE 1 27 MET ME . . 4.990 4.769 4.259 5.015 0.025 17 0 "[ . 1 . 2]" 2
1376 1 25 HIS HB2 1 38 HIS HD2 . . 3.860 3.057 2.561 3.743 . 0 0 "[ . 1 . 2]" 2
1377 1 25 HIS HB3 1 38 HIS HD2 . . 3.860 3.593 2.884 3.963 0.103 19 0 "[ . 1 . 2]" 2
1378 1 23 VAL MG1 1 24 ASN HD21 . . 5.500 3.287 1.934 4.386 . 0 0 "[ . 1 . 2]" 2
1379 1 23 VAL MG2 1 24 ASN HD22 . . 5.500 4.815 4.350 5.258 . 0 0 "[ . 1 . 2]" 2
1380 1 22 ASN HB2 1 38 HIS HD2 . . 5.500 2.905 2.485 3.389 . 0 0 "[ . 1 . 2]" 2
1381 1 22 ASN HB3 1 38 HIS HD2 . . 5.500 4.339 2.757 4.948 . 0 0 "[ . 1 . 2]" 2
1382 1 14 TYR QD 1 21 TYR HB3 . . 5.500 5.386 4.598 5.570 0.070 19 0 "[ . 1 . 2]" 2
1383 1 20 PRO HG2 1 21 TYR HB3 . . 4.950 4.078 3.983 4.342 . 0 0 "[ . 1 . 2]" 2
1384 1 20 PRO HB3 1 21 TYR HB3 . . 5.500 5.156 4.986 5.579 0.079 19 0 "[ . 1 . 2]" 2
1385 1 20 PRO HG3 1 21 TYR HB3 . . 5.500 5.469 5.355 5.792 0.292 19 0 "[ . 1 . 2]" 2
1386 1 21 TYR H 1 21 TYR QD . . 5.130 4.388 4.045 4.513 . 0 0 "[ . 1 . 2]" 2
1387 1 14 TYR QD 1 21 TYR QD . . 5.500 5.129 4.053 5.521 0.021 20 0 "[ . 1 . 2]" 2
1388 1 21 TYR QD 1 22 ASN HA . . 5.500 3.843 3.236 4.511 . 0 0 "[ . 1 . 2]" 2
1389 1 21 TYR QD 1 23 VAL HA . . 4.580 4.196 3.188 4.627 0.047 20 0 "[ . 1 . 2]" 2
1390 1 21 TYR QD 1 27 MET HG3 . . 4.790 3.953 2.742 4.531 . 0 0 "[ . 1 . 2]" 2
1391 1 21 TYR QD 1 23 VAL HB . . 5.440 3.987 3.268 5.240 . 0 0 "[ . 1 . 2]" 2
1392 1 20 PRO HG2 1 21 TYR QD . . 5.500 5.302 4.797 5.701 0.201 19 0 "[ . 1 . 2]" 2
1393 1 21 TYR QD 1 27 MET HG2 . . 4.790 4.689 4.465 4.872 0.082 9 0 "[ . 1 . 2]" 2
1394 1 21 TYR QE 1 23 VAL MG2 . . 3.990 3.036 1.851 3.742 . 0 0 "[ . 1 . 2]" 2
1395 1 21 TYR QE 1 23 VAL MG1 . . 3.990 3.708 3.384 4.044 0.054 9 0 "[ . 1 . 2]" 2
1396 1 21 TYR QE 1 27 MET ME . . 5.500 4.539 3.551 5.032 . 0 0 "[ . 1 . 2]" 2
1397 1 21 TYR QE 1 27 MET HB3 . . 5.400 3.707 3.022 4.334 . 0 0 "[ . 1 . 2]" 2
1398 1 21 TYR QE 1 27 MET HG2 . . 5.320 4.945 4.247 5.337 0.017 9 0 "[ . 1 . 2]" 2
1399 1 21 TYR QE 1 23 VAL HB . . 4.290 2.500 1.990 4.361 0.071 9 0 "[ . 1 . 2]" 2
1400 1 21 TYR QE 1 27 MET HG3 . . 5.320 3.913 2.921 4.360 . 0 0 "[ . 1 . 2]" 2
1401 1 21 TYR QE 1 23 VAL HA . . 4.220 2.518 1.985 3.020 . 0 0 "[ . 1 . 2]" 2
1402 1 21 TYR HA 1 21 TYR QE . . 4.990 4.757 4.520 4.990 0.000 9 0 "[ . 1 . 2]" 2
1403 1 21 TYR QE 1 22 ASN HA . . 5.500 4.605 4.041 5.231 . 0 0 "[ . 1 . 2]" 2
1404 1 21 TYR QE 1 23 VAL H . . 5.500 3.319 2.922 4.177 . 0 0 "[ . 1 . 2]" 2
1405 1 14 TYR HB3 1 36 TRP H . . 5.040 1.922 1.860 2.212 . 0 0 "[ . 1 . 2]" 2
1406 1 14 TYR HB3 1 15 CYS H . . 4.170 3.821 3.303 4.044 . 0 0 "[ . 1 . 2]" 2
1407 1 15 CYS HA 1 17 CYS H . . 4.430 4.213 4.129 4.334 . 0 0 "[ . 1 . 2]" 2
1408 1 14 TYR HB3 1 15 CYS HA . . 5.040 4.767 4.498 4.875 . 0 0 "[ . 1 . 2]" 2
1409 1 15 CYS HA 1 37 PHE HB3 . . 4.940 3.631 3.400 3.860 . 0 0 "[ . 1 . 2]" 2
1410 1 14 TYR HB2 1 15 CYS HA . . 4.910 3.985 3.892 4.090 . 0 0 "[ . 1 . 2]" 2
1411 1 14 TYR QD 1 36 TRP H . . 3.880 3.167 2.662 3.561 . 0 0 "[ . 1 . 2]" 2
1412 1 14 TYR QD 1 21 TYR H . . 5.440 5.048 4.933 5.382 . 0 0 "[ . 1 . 2]" 2
1413 1 14 TYR H 1 14 TYR QD . . 4.090 2.430 1.925 3.372 . 0 0 "[ . 1 . 2]" 2
1414 1 14 TYR QD 1 35 ASP HA . . 3.830 3.267 2.657 3.933 0.103 13 0 "[ . 1 . 2]" 2
1415 1 14 TYR HA 1 14 TYR QD . . 3.820 3.131 2.456 3.291 . 0 0 "[ . 1 . 2]" 2
1416 1 14 TYR QD 1 20 PRO HA . . 4.030 3.097 2.740 3.895 . 0 0 "[ . 1 . 2]" 2
1417 1 14 TYR QD 1 21 TYR HA . . 4.860 4.316 4.064 4.474 . 0 0 "[ . 1 . 2]" 2
1418 1 14 TYR QD 1 21 TYR HB2 . . 4.650 4.097 3.096 4.339 . 0 0 "[ . 1 . 2]" 2
1419 1 14 TYR QD 1 35 ASP HB3 . . 5.070 4.209 3.343 4.939 . 0 0 "[ . 1 . 2]" 2
1420 1 14 TYR QD 1 36 TRP HB3 . . 4.520 4.335 3.604 4.564 0.044 9 0 "[ . 1 . 2]" 2
1421 1 14 TYR QD 1 36 TRP HB2 . . 3.800 3.114 1.958 3.361 . 0 0 "[ . 1 . 2]" 2
1422 1 14 TYR QD 1 20 PRO HB3 . . 5.500 5.204 4.902 5.516 0.016 4 0 "[ . 1 . 2]" 2
1423 1 12 PRO HB2 1 14 TYR QD . . 5.040 4.838 4.038 5.018 . 0 0 "[ . 1 . 2]" 2
1424 1 13 VAL HB 1 14 TYR QD . . 4.870 4.701 4.478 5.013 0.143 13 0 "[ . 1 . 2]" 2
1425 1 12 PRO HG2 1 14 TYR QE . . 4.520 3.045 2.395 3.218 . 0 0 "[ . 1 . 2]" 2
1426 1 12 PRO HG3 1 14 TYR QE . . 4.520 4.348 4.030 4.451 . 0 0 "[ . 1 . 2]" 2
1427 1 14 TYR QE 1 36 TRP HB2 . . 4.690 4.354 3.646 4.691 0.001 16 0 "[ . 1 . 2]" 2
1428 1 14 TYR QE 1 21 TYR HB3 . . 4.500 4.329 3.313 4.554 0.054 19 0 "[ . 1 . 2]" 2
1429 1 12 PRO HD2 1 14 TYR QE . . 5.500 4.120 3.550 4.323 . 0 0 "[ . 1 . 2]" 2
1430 1 12 PRO HD3 1 14 TYR QE . . 5.500 5.347 4.891 5.513 0.013 15 0 "[ . 1 . 2]" 2
1431 1 14 TYR QE 1 21 TYR HA . . 4.930 4.761 4.293 4.914 . 0 0 "[ . 1 . 2]" 2
1432 1 12 PRO HA 1 14 TYR QE . . 5.500 5.432 4.961 5.550 0.050 19 0 "[ . 1 . 2]" 2
1433 1 13 VAL HA 1 14 TYR QE . . 4.920 3.796 3.544 4.165 . 0 0 "[ . 1 . 2]" 2
1434 1 14 TYR QE 1 20 PRO HA . . 4.020 2.858 2.551 3.776 . 0 0 "[ . 1 . 2]" 2
1435 1 14 TYR QE 1 35 ASP HA . . 5.500 4.961 4.225 5.523 0.023 19 0 "[ . 1 . 2]" 2
1436 1 14 TYR H 1 14 TYR QE . . 5.500 4.293 3.946 4.646 . 0 0 "[ . 1 . 2]" 2
1437 1 14 TYR QE 1 21 TYR H . . 4.830 4.861 4.771 4.907 0.077 14 0 "[ . 1 . 2]" 2
1438 1 14 TYR QE 1 36 TRP H . . 5.500 5.012 4.478 5.516 0.016 16 0 "[ . 1 . 2]" 2
1439 1 14 TYR QE 1 36 TRP HE1 . . 5.500 5.363 4.951 5.540 0.040 4 0 "[ . 1 . 2]" 2
1440 1 13 VAL MG2 1 20 PRO HB3 . . 5.500 5.546 5.505 5.646 0.146 13 0 "[ . 1 . 2]" 2
1441 1 12 PRO HB2 1 13 VAL MG1 . . 5.500 4.867 4.689 5.247 . 0 0 "[ . 1 . 2]" 2
1442 1 13 VAL HA 1 20 PRO HG3 . . 5.500 5.361 4.990 5.499 . 0 0 "[ . 1 . 2]" 2
1443 1 61 GLU HG3 1 66 PRO HB3 . . 4.660 4.515 4.336 4.600 . 0 0 "[ . 1 . 2]" 2
1444 1 15 CYS HB3 1 38 HIS HE1 . . 4.540 3.674 3.385 4.061 . 0 0 "[ . 1 . 2]" 2
1445 1 15 CYS HB2 1 38 HIS HE1 . . 4.090 3.751 3.264 4.105 0.015 14 0 "[ . 1 . 2]" 2
1446 1 19 GLN HG3 1 38 HIS HE1 . . 4.350 3.235 2.744 3.800 . 0 0 "[ . 1 . 2]" 2
1447 1 19 GLN HB3 1 38 HIS HE1 . . 3.780 3.210 2.751 3.791 0.011 6 0 "[ . 1 . 2]" 2
1448 1 37 PHE QD 1 55 TYR HH . . 5.500 4.221 3.785 4.675 . 0 0 "[ . 1 . 2]" 2
1449 1 37 PHE HZ 1 57 CYS HB2 . . 4.780 3.287 2.819 3.645 . 0 0 "[ . 1 . 2]" 2
1450 1 42 VAL MG1 1 55 TYR HH . . 3.820 2.109 1.883 2.465 . 0 0 "[ . 1 . 2]" 2
1451 1 42 VAL MG2 1 55 TYR HH . . 3.500 2.990 2.575 3.383 . 0 0 "[ . 1 . 2]" 2
1452 1 44 ILE MD 1 55 TYR HH . . 3.830 3.388 2.935 3.663 . 0 0 "[ . 1 . 2]" 2
1453 1 65 GLY HA2 1 66 PRO HD2 . . 3.400 3.229 3.150 3.278 . 0 0 "[ . 1 . 2]" 2
1454 1 65 GLY HA2 1 66 PRO HD3 . . 3.580 2.948 2.861 3.003 . 0 0 "[ . 1 . 2]" 2
1455 1 57 CYS HB3 1 58 PRO HD2 . . 3.450 3.441 3.393 3.464 0.014 4 0 "[ . 1 . 2]" 2
1456 1 25 HIS HA 1 25 HIS HD2 . . 4.030 2.543 2.174 2.856 . 0 0 "[ . 1 . 2]" 2
1457 1 11 VAL MG1 1 13 VAL MG1 . . 5.330 4.548 4.337 4.794 . 0 0 "[ . 1 . 2]" 2
1458 1 11 VAL MG2 1 13 VAL MG1 . . 5.330 4.632 4.404 5.355 0.025 15 0 "[ . 1 . 2]" 2
1459 1 27 MET ME 1 36 TRP HB2 . . 3.250 2.731 2.053 3.071 . 0 0 "[ . 1 . 2]" 2
1460 1 19 GLN HB2 1 38 HIS HE1 . . 3.440 2.308 2.031 2.728 . 0 0 "[ . 1 . 2]" 2
1461 1 24 ASN HB2 1 25 HIS HD2 . . 5.500 4.141 2.266 5.303 . 0 0 "[ . 1 . 2]" 2
1462 1 24 ASN HB3 1 25 HIS HD2 . . 5.500 4.230 2.078 5.516 0.016 19 0 "[ . 1 . 2]" 2
1463 1 44 ILE MD 1 55 TYR HE2 . . 4.920 4.436 4.070 4.758 . 0 0 "[ . 1 . 2]" 2
1464 1 55 TYR HE2 1 57 CYS HA . . 4.610 3.602 2.983 4.155 . 0 0 "[ . 1 . 2]" 2
1465 1 28 ILE MD 1 55 TYR HD2 . . 4.690 3.385 2.736 4.102 . 0 0 "[ . 1 . 2]" 2
1466 1 55 TYR HE1 1 57 CYS HA . . 4.470 3.159 2.487 3.724 . 0 0 "[ . 1 . 2]" 2
1467 1 28 ILE MD 1 55 TYR HE1 . . 4.590 3.796 3.225 4.169 . 0 0 "[ . 1 . 2]" 2
1468 1 32 LEU MD1 1 56 HIS HA . . 4.840 3.121 2.874 3.406 . 0 0 "[ . 1 . 2]" 2
1469 1 44 ILE MD 1 55 TYR HD1 . . 4.770 2.073 1.820 2.406 . 0 0 "[ . 1 . 2]" 2
1470 1 8 MET H 1 8 MET QG . . 4.740 3.202 1.887 4.081 . 0 0 "[ . 1 . 2]" 2
1471 1 8 MET QB 1 9 ALA H . . 4.440 3.203 2.147 4.043 . 0 0 "[ . 1 . 2]" 2
1472 1 9 ALA HA 1 10 LEU QB . . 5.340 4.386 4.044 5.343 0.003 12 0 "[ . 1 . 2]" 2
1473 1 9 ALA HA 1 10 LEU QD . . 5.440 3.965 2.826 4.651 . 0 0 "[ . 1 . 2]" 2
1474 1 9 ALA MB 1 11 VAL QG . . 5.440 4.737 3.272 5.458 0.018 5 0 "[ . 1 . 2]" 2
1475 1 10 LEU H 1 10 LEU QB . . 3.230 2.603 2.211 3.204 . 0 0 "[ . 1 . 2]" 2
1476 1 10 LEU H 1 10 LEU QD . . 4.120 2.725 1.849 3.464 . 0 0 "[ . 1 . 2]" 2
1477 1 10 LEU HA 1 10 LEU QD . . 3.470 2.957 2.032 3.447 . 0 0 "[ . 1 . 2]" 2
1478 1 10 LEU HA 1 11 VAL QG . . 3.530 3.410 3.286 3.612 0.082 19 0 "[ . 1 . 2]" 2
1479 1 10 LEU QB 1 10 LEU QD . . 2.710 1.823 1.744 1.914 . 0 0 "[ . 1 . 2]" 2
1480 1 11 VAL H 1 11 VAL QG . . 2.840 1.983 1.824 2.210 . 0 0 "[ . 1 . 2]" 2
1481 1 11 VAL HA 1 11 VAL QG . . 2.880 2.360 2.120 2.451 . 0 0 "[ . 1 . 2]" 2
1482 1 11 VAL HA 1 12 PRO QG . . 4.250 3.817 3.778 3.861 . 0 0 "[ . 1 . 2]" 2
1483 1 11 VAL QG 1 12 PRO HB2 . . 5.440 4.373 4.183 4.601 . 0 0 "[ . 1 . 2]" 2
1484 1 11 VAL QG 1 12 PRO QG . . 4.380 3.088 2.911 3.331 . 0 0 "[ . 1 . 2]" 2
1485 1 11 VAL QG 1 12 PRO HD2 . . 3.240 2.017 1.848 2.194 . 0 0 "[ . 1 . 2]" 2
1486 1 11 VAL QG 1 12 PRO HD3 . . 3.530 3.322 3.120 3.506 . 0 0 "[ . 1 . 2]" 2
1487 1 11 VAL QG 1 13 VAL HA . . 4.340 4.017 3.870 4.349 0.009 15 0 "[ . 1 . 2]" 2
1488 1 11 VAL QG 1 13 VAL MG1 . . 4.600 4.079 3.939 4.210 . 0 0 "[ . 1 . 2]" 2
1489 1 11 VAL QG 1 14 TYR QD . . 4.580 4.203 3.935 4.664 0.084 15 0 "[ . 1 . 2]" 2
1490 1 11 VAL QG 1 14 TYR QE . . 4.690 2.536 2.221 3.135 . 0 0 "[ . 1 . 2]" 2
1491 1 11 VAL QG 1 20 PRO HA . . 5.440 2.989 2.666 3.474 . 0 0 "[ . 1 . 2]" 2
1492 1 11 VAL QG 1 20 PRO HB2 . . 3.620 1.996 1.783 2.817 . 0 0 "[ . 1 . 2]" 2
1493 1 11 VAL QG 1 20 PRO HG2 . . 5.440 3.442 3.249 4.115 . 0 0 "[ . 1 . 2]" 2
1494 1 11 VAL QG 1 20 PRO HG3 . . 4.190 2.923 2.651 3.311 . 0 0 "[ . 1 . 2]" 2
1495 1 12 PRO QG 1 13 VAL H . . 4.790 4.300 4.032 4.656 . 0 0 "[ . 1 . 2]" 2
1496 1 12 PRO QG 1 14 TYR QE . . 3.940 2.986 2.381 3.145 . 0 0 "[ . 1 . 2]" 2
1497 1 13 VAL MG1 1 18 ARG QB . . 4.200 3.085 2.720 3.306 . 0 0 "[ . 1 . 2]" 2
1498 1 13 VAL MG2 1 18 ARG QB . . 3.590 3.127 2.695 3.501 . 0 0 "[ . 1 . 2]" 2
1499 1 13 VAL MG2 1 18 ARG QG . . 4.440 3.595 2.576 4.460 0.020 20 0 "[ . 1 . 2]" 2
1500 1 13 VAL MG2 1 18 ARG QD . . 4.170 3.479 2.814 4.175 0.005 1 0 "[ . 1 . 2]" 2
1501 1 16 LEU H 1 16 LEU QD . . 3.020 2.907 2.880 2.933 . 0 0 "[ . 1 . 2]" 2
1502 1 16 LEU HA 1 16 LEU QD . . 2.920 2.505 2.344 2.720 . 0 0 "[ . 1 . 2]" 2
1503 1 16 LEU HA 1 18 ARG QG . . 5.340 4.956 4.493 5.404 0.064 19 0 "[ . 1 . 2]" 2
1504 1 16 LEU HB2 1 16 LEU QD . . 2.920 2.139 1.993 2.212 . 0 0 "[ . 1 . 2]" 2
1505 1 16 LEU HB3 1 16 LEU QD . . 2.710 2.055 1.983 2.115 . 0 0 "[ . 1 . 2]" 2
1506 1 16 LEU QD 1 17 CYS H . . 4.200 4.055 3.936 4.132 . 0 0 "[ . 1 . 2]" 2
1507 1 16 LEU QD 1 37 PHE QD . . 3.380 2.930 2.719 3.172 . 0 0 "[ . 1 . 2]" 2
1508 1 16 LEU QD 1 37 PHE QE . . 3.300 2.166 1.918 2.588 . 0 0 "[ . 1 . 2]" 2
1509 1 16 LEU QD 1 41 CYS HA . . 4.650 4.312 3.886 4.522 . 0 0 "[ . 1 . 2]" 2
1510 1 16 LEU QD 1 41 CYS HB2 . . 4.160 3.827 3.547 4.126 . 0 0 "[ . 1 . 2]" 2
1511 1 16 LEU QD 1 41 CYS HB3 . . 3.730 2.668 2.428 2.911 . 0 0 "[ . 1 . 2]" 2
1512 1 16 LEU QD 1 42 VAL HA . . 4.170 3.824 3.347 4.193 0.023 14 0 "[ . 1 . 2]" 2
1513 1 16 LEU QD 1 42 VAL MG1 . . 3.860 3.138 2.716 3.453 . 0 0 "[ . 1 . 2]" 2
1514 1 16 LEU QD 1 58 PRO HB2 . . 4.440 3.645 3.418 3.877 . 0 0 "[ . 1 . 2]" 2
1515 1 16 LEU QD 1 58 PRO HB3 . . 4.380 4.170 4.027 4.326 . 0 0 "[ . 1 . 2]" 2
1516 1 16 LEU QD 1 58 PRO HG2 . . 2.790 2.453 2.109 2.672 . 0 0 "[ . 1 . 2]" 2
1517 1 16 LEU QD 1 58 PRO HG3 . . 3.230 2.610 2.394 2.913 . 0 0 "[ . 1 . 2]" 2
1518 1 16 LEU QD 1 58 PRO HD2 . . 4.390 3.512 3.232 3.954 . 0 0 "[ . 1 . 2]" 2
1519 1 16 LEU QD 1 58 PRO HD3 . . 4.440 4.107 3.915 4.447 0.007 8 0 "[ . 1 . 2]" 2
1520 1 16 LEU QD 1 59 ASP H . . 4.970 4.682 4.162 4.997 0.027 14 0 "[ . 1 . 2]" 2
1521 1 17 CYS QB 1 19 GLN H . . 4.650 4.068 3.133 4.615 . 0 0 "[ . 1 . 2]" 2
1522 1 17 CYS QB 1 19 GLN HG2 . . 3.260 2.465 2.027 2.814 . 0 0 "[ . 1 . 2]" 2
1523 1 18 ARG H 1 18 ARG QG . . 3.960 3.255 2.942 3.661 . 0 0 "[ . 1 . 2]" 2
1524 1 18 ARG H 1 18 ARG QD . . 3.420 2.434 1.953 2.821 . 0 0 "[ . 1 . 2]" 2
1525 1 18 ARG HA 1 18 ARG QG . . 3.380 2.739 2.299 3.164 . 0 0 "[ . 1 . 2]" 2
1526 1 18 ARG QB 1 18 ARG QD . . 2.990 2.278 2.203 2.342 . 0 0 "[ . 1 . 2]" 2
1527 1 18 ARG QB 1 19 GLN H . . 4.290 3.874 3.825 3.901 . 0 0 "[ . 1 . 2]" 2
1528 1 18 ARG QB 1 19 GLN HE21 . . 4.270 2.641 2.324 3.028 . 0 0 "[ . 1 . 2]" 2
1529 1 18 ARG QG 1 19 GLN H . . 5.340 4.755 4.634 4.873 . 0 0 "[ . 1 . 2]" 2
1530 1 18 ARG QG 1 19 GLN HE21 . . 5.340 4.377 3.688 5.013 . 0 0 "[ . 1 . 2]" 2
1531 1 21 TYR QD 1 23 VAL QG . . 4.640 3.941 2.244 4.554 . 0 0 "[ . 1 . 2]" 2
1532 1 21 TYR QD 1 27 MET QG . . 4.140 3.721 2.718 4.136 . 0 0 "[ . 1 . 2]" 2
1533 1 21 TYR QE 1 23 VAL QG . . 3.420 2.876 1.843 3.423 0.003 4 0 "[ . 1 . 2]" 2
1534 1 21 TYR QE 1 27 MET QG . . 4.660 3.763 2.878 4.153 . 0 0 "[ . 1 . 2]" 2
1535 1 22 ASN H 1 22 ASN QB . . 3.570 2.568 2.242 2.850 . 0 0 "[ . 1 . 2]" 2
1536 1 22 ASN HA 1 23 VAL QG . . 4.820 3.679 3.482 4.033 . 0 0 "[ . 1 . 2]" 2
1537 1 22 ASN QB 1 24 ASN H . . 4.530 3.387 2.603 4.773 0.243 9 0 "[ . 1 . 2]" 2
1538 1 22 ASN QB 1 25 HIS H . . 3.860 2.586 2.007 3.862 0.002 9 0 "[ . 1 . 2]" 2
1539 1 22 ASN QB 1 25 HIS QB . . 4.050 2.346 1.859 2.889 . 0 0 "[ . 1 . 2]" 2
1540 1 22 ASN QB 1 25 HIS HE1 . . 5.340 4.756 3.761 5.356 0.016 20 0 "[ . 1 . 2]" 2
1541 1 22 ASN QB 1 38 HIS HD2 . . 4.770 2.842 2.457 3.334 . 0 0 "[ . 1 . 2]" 2
1542 1 22 ASN QD 1 25 HIS QB . . 4.490 3.636 2.509 4.463 . 0 0 "[ . 1 . 2]" 2
1543 1 23 VAL H 1 23 VAL QG . . 3.140 2.139 1.933 2.856 . 0 0 "[ . 1 . 2]" 2
1544 1 23 VAL HA 1 23 VAL QG . . 2.910 2.252 2.056 2.359 . 0 0 "[ . 1 . 2]" 2
1545 1 23 VAL QG 1 24 ASN H . . 3.390 2.215 1.857 3.309 . 0 0 "[ . 1 . 2]" 2
1546 1 23 VAL QG 1 24 ASN HA . . 4.400 3.165 2.909 3.839 . 0 0 "[ . 1 . 2]" 2
1547 1 23 VAL QG 1 24 ASN QB . . 4.900 3.622 2.734 4.662 . 0 0 "[ . 1 . 2]" 2
1548 1 23 VAL QG 1 24 ASN QD . . 3.630 2.770 1.813 3.629 . 0 0 "[ . 1 . 2]" 2
1549 1 23 VAL QG 1 25 HIS H . . 4.590 4.127 3.822 4.566 . 0 0 "[ . 1 . 2]" 2
1550 1 24 ASN H 1 24 ASN QB . . 3.360 2.590 2.229 3.422 0.062 9 0 "[ . 1 . 2]" 2
1551 1 24 ASN H 1 24 ASN QD . . 4.170 3.162 1.816 4.150 . 0 0 "[ . 1 . 2]" 2
1552 1 24 ASN HA 1 24 ASN QD . . 4.250 2.919 2.169 4.057 . 0 0 "[ . 1 . 2]" 2
1553 1 24 ASN QB 1 25 HIS H . . 3.710 2.731 2.249 3.895 0.185 9 0 "[ . 1 . 2]" 2
1554 1 24 ASN QB 1 25 HIS HE1 . . 5.340 4.671 3.980 5.365 0.025 19 0 "[ . 1 . 2]" 2
1555 1 25 HIS H 1 25 HIS QB . . 3.410 2.507 2.348 2.762 . 0 0 "[ . 1 . 2]" 2
1556 1 25 HIS HA 1 26 PHE QB . . 4.570 4.100 4.049 4.194 . 0 0 "[ . 1 . 2]" 2
1557 1 25 HIS QB 1 26 PHE H . . 4.290 2.781 2.024 3.500 . 0 0 "[ . 1 . 2]" 2
1558 1 26 PHE H 1 26 PHE QB . . 3.170 2.219 2.089 2.967 . 0 0 "[ . 1 . 2]" 2
1559 1 26 PHE QB 1 46 GLU HB2 . . 4.200 2.524 2.147 2.929 . 0 0 "[ . 1 . 2]" 2
1560 1 26 PHE QB 1 46 GLU HB3 . . 4.580 3.993 3.439 4.556 . 0 0 "[ . 1 . 2]" 2
1561 1 26 PHE QB 1 46 GLU QG . . 4.760 3.604 2.861 4.257 . 0 0 "[ . 1 . 2]" 2
1562 1 26 PHE QD 1 46 GLU QG . . 4.170 2.715 2.032 3.644 . 0 0 "[ . 1 . 2]" 2
1563 1 27 MET H 1 27 MET QG . . 3.820 3.565 3.382 3.763 . 0 0 "[ . 1 . 2]" 2
1564 1 27 MET HA 1 27 MET QG . . 3.310 2.240 2.140 2.447 . 0 0 "[ . 1 . 2]" 2
1565 1 27 MET HB3 1 27 MET QG . . 2.430 2.419 2.340 2.489 0.059 16 0 "[ . 1 . 2]" 2
1566 1 27 MET ME 1 27 MET QG . . 2.850 2.189 2.016 2.337 . 0 0 "[ . 1 . 2]" 2
1567 1 27 MET QG 1 28 ILE H . . 4.120 3.612 3.377 4.098 . 0 0 "[ . 1 . 2]" 2
1568 1 27 MET QG 1 36 TRP HE3 . . 4.310 4.120 3.922 4.323 0.013 4 0 "[ . 1 . 2]" 2
1569 1 27 MET QG 1 38 HIS HA . . 3.720 2.138 1.966 2.379 . 0 0 "[ . 1 . 2]" 2
1570 1 27 MET QG 1 38 HIS HD2 . . 3.530 1.960 1.898 2.270 . 0 0 "[ . 1 . 2]" 2
1571 1 27 MET QG 1 39 GLY H . . 4.250 3.704 3.389 4.081 . 0 0 "[ . 1 . 2]" 2
1572 1 31 GLY HA2 1 34 GLN QG . . 3.820 3.828 3.739 3.854 0.034 1 0 "[ . 1 . 2]" 2
1573 1 31 GLY HA3 1 34 GLN QG . . 5.340 5.363 5.334 5.402 0.062 4 0 "[ . 1 . 2]" 2
1574 1 32 LEU H 1 33 CYS QB . . 5.220 4.563 4.197 4.763 . 0 0 "[ . 1 . 2]" 2
1575 1 32 LEU HB2 1 33 CYS QB . . 4.690 3.983 3.684 4.343 . 0 0 "[ . 1 . 2]" 2
1576 1 33 CYS H 1 33 CYS QB . . 3.390 2.817 2.610 2.941 . 0 0 "[ . 1 . 2]" 2
1577 1 33 CYS H 1 34 GLN QG . . 5.060 4.424 4.130 4.683 . 0 0 "[ . 1 . 2]" 2
1578 1 33 CYS QB 1 34 GLN H . . 4.290 3.615 3.169 3.902 . 0 0 "[ . 1 . 2]" 2
1579 1 33 CYS QB 1 35 ASP H . . 4.940 3.698 2.616 4.406 . 0 0 "[ . 1 . 2]" 2
1580 1 34 GLN H 1 34 GLN QB . . 3.550 3.290 3.230 3.378 . 0 0 "[ . 1 . 2]" 2
1581 1 34 GLN H 1 34 GLN QG . . 3.500 2.909 2.790 3.026 . 0 0 "[ . 1 . 2]" 2
1582 1 34 GLN HA 1 34 GLN QG . . 3.090 2.310 2.215 2.399 . 0 0 "[ . 1 . 2]" 2
1583 1 34 GLN QB 1 34 GLN QG . . 2.360 2.066 2.017 2.086 . 0 0 "[ . 1 . 2]" 2
1584 1 34 GLN QG 1 35 ASP H . . 5.340 4.533 4.447 4.652 . 0 0 "[ . 1 . 2]" 2
1585 1 40 SER H 1 40 SER QB . . 3.130 2.369 2.191 2.761 . 0 0 "[ . 1 . 2]" 2
1586 1 40 SER HA 1 40 SER QB . . 2.590 2.357 2.184 2.484 . 0 0 "[ . 1 . 2]" 2
1587 1 40 SER QB 1 41 CYS H . . 3.970 2.952 2.588 3.638 . 0 0 "[ . 1 . 2]" 2
1588 1 40 SER QB 1 42 VAL H . . 5.250 4.760 4.531 5.134 . 0 0 "[ . 1 . 2]" 2
1589 1 42 VAL H 1 43 GLY QA . . 4.280 4.094 4.004 4.158 . 0 0 "[ . 1 . 2]" 2
1590 1 42 VAL MG2 1 43 GLY QA . . 4.900 3.310 3.117 3.421 . 0 0 "[ . 1 . 2]" 2
1591 1 44 ILE HA 1 48 ASN QD . . 5.340 4.119 3.282 5.185 . 0 0 "[ . 1 . 2]" 2
1592 1 44 ILE MG 1 48 ASN QD . . 5.340 4.002 3.356 4.555 . 0 0 "[ . 1 . 2]" 2
1593 1 45 GLU H 1 45 GLU QG . . 3.120 3.021 2.775 3.126 0.006 1 0 "[ . 1 . 2]" 2
1594 1 45 GLU H 1 48 ASN QD . . 4.450 2.819 2.067 3.542 . 0 0 "[ . 1 . 2]" 2
1595 1 45 GLU HA 1 45 GLU QG . . 2.950 2.591 2.288 2.975 0.025 14 0 "[ . 1 . 2]" 2
1596 1 45 GLU HA 1 48 ASN QD . . 5.340 4.733 4.335 5.167 . 0 0 "[ . 1 . 2]" 2
1597 1 45 GLU HB2 1 48 ASN QD . . 4.140 2.265 1.886 2.730 . 0 0 "[ . 1 . 2]" 2
1598 1 45 GLU HB3 1 48 ASN QD . . 4.300 3.655 2.959 4.209 . 0 0 "[ . 1 . 2]" 2
1599 1 45 GLU QG 1 46 GLU H . . 4.070 3.928 3.600 4.113 0.043 3 0 "[ . 1 . 2]" 2
1600 1 45 GLU QG 1 47 GLU H . . 5.340 4.536 4.331 4.891 . 0 0 "[ . 1 . 2]" 2
1601 1 45 GLU QG 1 48 ASN QD . . 4.450 3.500 3.013 3.928 . 0 0 "[ . 1 . 2]" 2
1602 1 46 GLU HA 1 46 GLU QG . . 3.150 2.399 2.197 2.534 . 0 0 "[ . 1 . 2]" 2
1603 1 46 GLU HA 1 47 GLU QG . . 5.340 5.107 4.968 5.345 0.005 10 0 "[ . 1 . 2]" 2
1604 1 46 GLU HA 1 50 VAL QG . . 5.440 5.274 5.043 5.459 0.019 7 0 "[ . 1 . 2]" 2
1605 1 46 GLU QG 1 47 GLU H . . 4.110 3.885 3.546 4.100 . 0 0 "[ . 1 . 2]" 2
1606 1 46 GLU QG 1 47 GLU HA . . 4.400 3.984 3.483 4.378 . 0 0 "[ . 1 . 2]" 2
1607 1 46 GLU QG 1 49 ALA MB . . 3.700 3.266 3.036 3.450 . 0 0 "[ . 1 . 2]" 2
1608 1 47 GLU H 1 47 GLU QB . . 2.900 2.469 2.350 2.662 . 0 0 "[ . 1 . 2]" 2
1609 1 47 GLU H 1 47 GLU QG . . 3.590 2.253 1.958 2.520 . 0 0 "[ . 1 . 2]" 2
1610 1 47 GLU HA 1 50 VAL QG . . 4.060 3.139 2.788 3.418 . 0 0 "[ . 1 . 2]" 2
1611 1 47 GLU QB 1 47 GLU QG . . 2.240 2.065 2.018 2.086 . 0 0 "[ . 1 . 2]" 2
1612 1 47 GLU QB 1 50 VAL QG . . 5.280 4.046 3.758 4.186 . 0 0 "[ . 1 . 2]" 2
1613 1 47 GLU QG 1 48 ASN H . . 3.580 2.268 2.015 2.557 . 0 0 "[ . 1 . 2]" 2
1614 1 47 GLU QG 1 48 ASN QD . . 4.490 3.033 1.985 3.666 . 0 0 "[ . 1 . 2]" 2
1615 1 47 GLU QG 1 49 ALA H . . 5.340 4.305 4.106 4.531 . 0 0 "[ . 1 . 2]" 2
1616 1 48 ASN H 1 50 VAL QG . . 4.690 4.211 4.040 4.421 . 0 0 "[ . 1 . 2]" 2
1617 1 48 ASN HA 1 48 ASN QD . . 4.520 3.871 3.306 4.151 . 0 0 "[ . 1 . 2]" 2
1618 1 48 ASN HA 1 50 VAL QG . . 4.850 3.441 3.259 3.597 . 0 0 "[ . 1 . 2]" 2
1619 1 48 ASN HB2 1 48 ASN QD . . 3.330 2.224 2.097 2.415 . 0 0 "[ . 1 . 2]" 2
1620 1 49 ALA H 1 50 VAL QG . . 3.950 3.895 3.618 3.967 0.017 8 0 "[ . 1 . 2]" 2
1621 1 49 ALA HA 1 51 ASP QB . . 5.200 4.868 4.711 5.017 . 0 0 "[ . 1 . 2]" 2
1622 1 49 ALA MB 1 50 VAL QG . . 4.100 3.847 3.631 3.976 . 0 0 "[ . 1 . 2]" 2
1623 1 50 VAL H 1 50 VAL QG . . 3.020 2.169 1.852 2.305 . 0 0 "[ . 1 . 2]" 2
1624 1 50 VAL H 1 51 ASP QB . . 5.340 4.680 4.340 4.846 . 0 0 "[ . 1 . 2]" 2
1625 1 50 VAL HA 1 50 VAL QG . . 2.960 2.248 2.153 2.378 . 0 0 "[ . 1 . 2]" 2
1626 1 50 VAL QG 1 51 ASP H . . 4.000 2.431 2.183 2.743 . 0 0 "[ . 1 . 2]" 2
1627 1 50 VAL QG 1 51 ASP HA . . 4.000 3.260 3.171 3.379 . 0 0 "[ . 1 . 2]" 2
1628 1 50 VAL QG 1 51 ASP QB . . 4.850 3.267 2.850 3.446 . 0 0 "[ . 1 . 2]" 2
1629 1 50 VAL QG 1 72 TRP HZ2 . . 3.570 2.590 2.351 2.981 . 0 0 "[ . 1 . 2]" 2
1630 1 50 VAL QG 1 72 TRP HH2 . . 4.730 3.040 1.911 3.715 . 0 0 "[ . 1 . 2]" 2
1631 1 51 ASP H 1 51 ASP QB . . 2.990 2.317 2.244 2.425 . 0 0 "[ . 1 . 2]" 2
1632 1 51 ASP QB 1 52 ILE H . . 3.790 3.048 2.880 3.358 . 0 0 "[ . 1 . 2]" 2
1633 1 51 ASP QB 1 52 ILE HG12 . . 4.660 4.466 3.996 4.585 . 0 0 "[ . 1 . 2]" 2
1634 1 51 ASP QB 1 52 ILE HG13 . . 4.760 3.473 3.345 3.630 . 0 0 "[ . 1 . 2]" 2
1635 1 51 ASP QB 1 70 LYS H . . 5.030 4.051 3.808 4.441 . 0 0 "[ . 1 . 2]" 2
1636 1 51 ASP QB 1 70 LYS HB2 . . 5.340 4.331 3.915 5.352 0.012 17 0 "[ . 1 . 2]" 2
1637 1 51 ASP QB 1 70 LYS HG3 . . 5.340 4.562 4.279 4.921 . 0 0 "[ . 1 . 2]" 2
1638 1 52 ILE HA 1 69 MET QG . . 5.340 3.143 2.820 3.958 . 0 0 "[ . 1 . 2]" 2
1639 1 52 ILE MG 1 67 SER QB . . 3.370 2.546 2.032 3.282 . 0 0 "[ . 1 . 2]" 2
1640 1 52 ILE MG 1 69 MET QG . . 5.340 3.867 3.541 4.386 . 0 0 "[ . 1 . 2]" 2
1641 1 52 ILE MD 1 67 SER QB . . 4.570 3.829 3.389 4.251 . 0 0 "[ . 1 . 2]" 2
1642 1 53 ASP H 1 70 LYS QE . . 4.930 3.984 3.172 4.412 . 0 0 "[ . 1 . 2]" 2
1643 1 53 ASP HA 1 70 LYS QE . . 3.110 2.411 2.149 2.628 . 0 0 "[ . 1 . 2]" 2
1644 1 53 ASP HB2 1 70 LYS QE . . 4.930 4.147 3.898 4.379 . 0 0 "[ . 1 . 2]" 2
1645 1 55 TYR HA 1 67 SER QB . . 3.030 2.147 1.921 2.795 . 0 0 "[ . 1 . 2]" 2
1646 1 56 HIS H 1 67 SER QB . . 3.830 2.055 1.842 2.519 . 0 0 "[ . 1 . 2]" 2
1647 1 58 PRO HB2 1 59 ASP QB . . 5.340 4.699 4.663 4.728 . 0 0 "[ . 1 . 2]" 2
1648 1 59 ASP H 1 59 ASP QB . . 3.110 2.378 2.274 2.433 . 0 0 "[ . 1 . 2]" 2
1649 1 59 ASP HA 1 63 VAL QG . . 5.440 5.456 5.354 5.498 0.058 1 0 "[ . 1 . 2]" 2
1650 1 59 ASP QB 1 60 CYS H . . 3.400 2.956 2.878 3.048 . 0 0 "[ . 1 . 2]" 2
1651 1 59 ASP QB 1 62 ALA MB . . 5.340 5.065 4.945 5.204 . 0 0 "[ . 1 . 2]" 2
1652 1 60 CYS HA 1 63 VAL QG . . 4.070 3.456 3.314 3.645 . 0 0 "[ . 1 . 2]" 2
1653 1 62 ALA H 1 63 VAL QG . . 3.650 3.636 3.585 3.677 0.027 5 0 "[ . 1 . 2]" 2
1654 1 62 ALA MB 1 63 VAL QG . . 3.790 2.645 2.448 2.748 . 0 0 "[ . 1 . 2]" 2
1655 1 63 VAL H 1 63 VAL QG . . 2.870 2.627 2.520 2.679 . 0 0 "[ . 1 . 2]" 2
1656 1 63 VAL HA 1 63 VAL QG . . 2.500 2.090 2.048 2.163 . 0 0 "[ . 1 . 2]" 2
1657 1 63 VAL QG 1 64 PHE H . . 3.430 3.168 3.122 3.212 . 0 0 "[ . 1 . 2]" 2
1658 1 63 VAL QG 1 64 PHE HA . . 4.410 3.657 3.531 3.768 . 0 0 "[ . 1 . 2]" 2
1659 1 63 VAL QG 1 64 PHE HB2 . . 5.440 4.594 4.538 4.645 . 0 0 "[ . 1 . 2]" 2
1660 1 63 VAL QG 1 64 PHE HB3 . . 5.440 5.228 5.185 5.278 . 0 0 "[ . 1 . 2]" 2
1661 1 63 VAL QG 1 64 PHE QD . . 3.410 3.360 3.164 3.427 0.017 5 0 "[ . 1 . 2]" 2
1662 1 63 VAL QG 1 64 PHE QE . . 3.980 3.697 3.487 3.794 . 0 0 "[ . 1 . 2]" 2
1663 1 63 VAL QG 1 64 PHE HZ . . 4.980 4.958 4.846 5.000 0.020 6 0 "[ . 1 . 2]" 2
1664 1 65 GLY HA2 1 66 PRO QG . . 4.830 4.630 4.561 4.672 . 0 0 "[ . 1 . 2]" 2
1665 1 65 GLY HA3 1 66 PRO QG . . 4.320 3.821 3.804 3.851 . 0 0 "[ . 1 . 2]" 2
1666 1 66 PRO QG 1 67 SER H . . 4.310 4.090 3.973 4.234 . 0 0 "[ . 1 . 2]" 2
1667 1 67 SER H 1 67 SER QB . . 3.180 2.628 2.189 2.776 . 0 0 "[ . 1 . 2]" 2
1668 1 67 SER QB 1 68 ILE H . . 3.350 2.971 2.744 3.386 0.036 6 0 "[ . 1 . 2]" 2
1669 1 68 ILE H 1 69 MET QG . . 5.340 5.014 4.843 5.235 . 0 0 "[ . 1 . 2]" 2
1670 1 68 ILE HA 1 69 MET QG . . 3.900 3.673 3.496 3.808 . 0 0 "[ . 1 . 2]" 2
1671 1 68 ILE MD 1 69 MET QG . . 5.340 5.037 4.862 5.274 . 0 0 "[ . 1 . 2]" 2
1672 1 69 MET H 1 69 MET QG . . 3.170 3.056 2.747 3.173 0.003 14 0 "[ . 1 . 2]" 2
1673 1 69 MET HB3 1 69 MET QG . . 2.610 2.465 2.412 2.484 . 0 0 "[ . 1 . 2]" 2
1674 1 69 MET ME 1 69 MET QG . . 2.770 2.160 2.011 2.347 . 0 0 "[ . 1 . 2]" 2
1675 1 69 MET QG 1 70 LYS H . . 4.170 4.090 3.905 4.357 0.187 10 0 "[ . 1 . 2]" 2
1676 1 70 LYS H 1 70 LYS QE . . 4.850 4.147 3.499 4.507 . 0 0 "[ . 1 . 2]" 2
1677 1 70 LYS HA 1 70 LYS QE . . 4.850 4.743 4.633 4.894 0.044 17 0 "[ . 1 . 2]" 2
1678 1 70 LYS HA 1 71 ASN QB . . 4.610 4.198 3.872 4.661 0.051 12 0 "[ . 1 . 2]" 2
1679 1 70 LYS HB2 1 70 LYS QE . . 4.820 3.728 3.394 3.986 . 0 0 "[ . 1 . 2]" 2
1680 1 70 LYS HB3 1 70 LYS QE . . 4.680 3.975 3.894 4.069 . 0 0 "[ . 1 . 2]" 2
1681 1 70 LYS QE 1 70 LYS HG2 . . 3.140 2.632 2.492 2.800 . 0 0 "[ . 1 . 2]" 2
1682 1 70 LYS QE 1 70 LYS HG3 . . 2.980 2.243 2.159 2.331 . 0 0 "[ . 1 . 2]" 2
1683 1 70 LYS QE 1 72 TRP HD1 . . 5.340 5.342 4.753 5.720 0.380 20 0 "[ . 1 . 2]" 2
1684 1 70 LYS QE 1 72 TRP HZ2 . . 5.340 3.358 2.808 3.844 . 0 0 "[ . 1 . 2]" 2
1685 1 70 LYS QE 1 72 TRP HH2 . . 5.340 5.262 4.710 5.461 0.121 20 0 "[ . 1 . 2]" 2
1686 1 71 ASN H 1 71 ASN QB . . 3.680 2.637 2.295 3.173 . 0 0 "[ . 1 . 2]" 2
1687 1 71 ASN QD 1 72 TRP H . . 5.340 4.765 3.741 5.294 . 0 0 "[ . 1 . 2]" 2
1688 1 72 TRP H 1 72 TRP QB . . 3.250 2.806 2.415 3.234 . 0 0 "[ . 1 . 2]" 2
1689 1 72 TRP QB 1 72 TRP HD1 . . 3.340 2.621 2.512 2.740 . 0 0 "[ . 1 . 2]" 2
1690 1 72 TRP QB 1 72 TRP HE3 . . 3.490 2.568 2.422 2.806 . 0 0 "[ . 1 . 2]" 2
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