NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
460124 |
1v9x   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1v9x
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 10
_Distance_constraint_stats_list.Viol_count 177
_Distance_constraint_stats_list.Viol_total 386.620
_Distance_constraint_stats_list.Viol_max 0.205
_Distance_constraint_stats_list.Viol_rms 0.0725
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0967
_Distance_constraint_stats_list.Viol_average_violations_only 0.1092
_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 23 CYS 6.397 0.203 15 0 "[ . 1 . 2]"
1 26 CYS 6.292 0.204 12 0 "[ . 1 . 2]"
1 55 HIS 6.026 0.205 15 0 "[ . 1 . 2]"
1 58 CYS 13.436 0.205 15 0 "[ . 1 . 2]"
2 1 ZN 6.511 0.102 8 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 23 CYS SG 2 1 ZN ZN . . 2.250 2.332 2.277 2.350 0.100 8 0 "[ . 1 . 2]" 1
2 1 26 CYS SG 2 1 ZN ZN . . 2.250 2.331 2.295 2.351 0.101 18 0 "[ . 1 . 2]" 1
3 1 55 HIS ND1 2 1 ZN ZN . . 1.950 2.027 1.993 2.049 0.099 16 0 "[ . 1 . 2]" 1
4 1 58 CYS SG 2 1 ZN ZN . . 2.250 2.336 2.299 2.352 0.102 8 0 "[ . 1 . 2]" 1
5 1 23 CYS SG 1 26 CYS SG . . 3.650 3.682 3.643 3.745 0.095 20 0 "[ . 1 . 2]" 1
6 1 23 CYS SG 1 55 HIS ND1 . . 3.500 3.520 3.497 3.568 0.068 11 0 "[ . 1 . 2]" 1
7 1 23 CYS SG 1 58 CYS SG . . 3.650 3.836 3.774 3.853 0.203 15 0 "[ . 1 . 2]" 1
8 1 26 CYS SG 1 55 HIS ND1 . . 3.500 3.502 3.496 3.517 0.017 11 0 "[ . 1 . 2]" 1
9 1 26 CYS SG 1 58 CYS SG . . 3.650 3.848 3.804 3.854 0.204 12 0 "[ . 1 . 2]" 1
10 1 55 HIS ND1 1 58 CYS SG . . 3.500 3.701 3.690 3.705 0.205 15 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 3
_Distance_constraint_stats_list.Viol_count 60
_Distance_constraint_stats_list.Viol_total 1393.539
_Distance_constraint_stats_list.Viol_max 1.949
_Distance_constraint_stats_list.Viol_rms 0.4059
_Distance_constraint_stats_list.Viol_average_all_restraints 1.1613
_Distance_constraint_stats_list.Viol_average_violations_only 1.1613
_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 12 ARG 33.639 1.949 1 20 [+**-****************]
1 13 ALA 20.808 1.266 1 20 [+**-****************]
1 15 TYR 15.229 0.837 11 20 [***-******+*********]
1 34 ASN 15.229 0.837 11 20 [***-******+*********]
1 74 GLY 54.448 1.949 1 20 [+**-****************]
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 13 ALA H 1 74 GLY H . . 3.500 4.540 4.164 4.766 1.266 1 20 [+**-****************] 2
2 1 12 ARG HA 1 74 GLY H . . 3.500 5.182 4.856 5.449 1.949 1 20 [+**-****************] 2
3 1 15 TYR HA 1 34 ASN H . . 3.000 3.761 3.663 3.837 0.837 11 20 [***-******+*********] 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 2255
_Distance_constraint_stats_list.Viol_count 1344
_Distance_constraint_stats_list.Viol_total 432.615
_Distance_constraint_stats_list.Viol_max 0.161
_Distance_constraint_stats_list.Viol_rms 0.0048
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0161
_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 HIS 0.018 0.005 12 0 "[ . 1 . 2]"
1 9 LYS 0.658 0.078 17 0 "[ . 1 . 2]"
1 10 PRO 0.338 0.035 18 0 "[ . 1 . 2]"
1 11 TRP 2.054 0.129 9 0 "[ . 1 . 2]"
1 12 ARG 2.887 0.129 9 0 "[ . 1 . 2]"
1 13 ALA 0.180 0.047 13 0 "[ . 1 . 2]"
1 14 GLU 0.447 0.039 17 0 "[ . 1 . 2]"
1 15 TYR 0.912 0.039 17 0 "[ . 1 . 2]"
1 16 ALA 1.407 0.081 16 0 "[ . 1 . 2]"
1 17 LYS 1.153 0.081 16 0 "[ . 1 . 2]"
1 18 SER 0.252 0.033 15 0 "[ . 1 . 2]"
1 19 SER 0.029 0.018 12 0 "[ . 1 . 2]"
1 20 ARG 0.321 0.129 11 0 "[ . 1 . 2]"
1 21 SER 0.010 0.005 10 0 "[ . 1 . 2]"
1 22 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 CYS 0.130 0.026 2 0 "[ . 1 . 2]"
1 24 LYS 0.554 0.141 18 0 "[ . 1 . 2]"
1 25 THR 0.138 0.012 15 0 "[ . 1 . 2]"
1 26 CYS 0.109 0.034 15 0 "[ . 1 . 2]"
1 27 LYS 0.052 0.034 15 0 "[ . 1 . 2]"
1 28 SER 1.236 0.078 14 0 "[ . 1 . 2]"
1 29 VAL 2.159 0.078 14 0 "[ . 1 . 2]"
1 30 ILE 0.303 0.022 9 0 "[ . 1 . 2]"
1 31 ASN 1.016 0.056 4 0 "[ . 1 . 2]"
1 32 LYS 1.677 0.089 9 0 "[ . 1 . 2]"
1 33 GLU 1.763 0.089 9 0 "[ . 1 . 2]"
1 34 ASN 0.184 0.022 12 0 "[ . 1 . 2]"
1 35 PHE 0.087 0.022 12 0 "[ . 1 . 2]"
1 36 ARG 0.091 0.012 17 0 "[ . 1 . 2]"
1 37 LEU 0.218 0.023 12 0 "[ . 1 . 2]"
1 38 GLY 0.206 0.046 17 0 "[ . 1 . 2]"
1 39 LYS 0.125 0.026 17 0 "[ . 1 . 2]"
1 40 LEU 0.372 0.041 17 0 "[ . 1 . 2]"
1 41 VAL 0.042 0.011 8 0 "[ . 1 . 2]"
1 42 GLN 0.006 0.006 14 0 "[ . 1 . 2]"
1 43 SER 0.003 0.001 3 0 "[ . 1 . 2]"
1 45 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 ILE 0.048 0.019 15 0 "[ . 1 . 2]"
1 50 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 PRO 0.220 0.073 17 0 "[ . 1 . 2]"
1 52 MET 0.269 0.041 17 0 "[ . 1 . 2]"
1 53 TRP 1.180 0.118 8 0 "[ . 1 . 2]"
1 54 ASN 0.176 0.046 17 0 "[ . 1 . 2]"
1 55 HIS 0.170 0.028 12 0 "[ . 1 . 2]"
1 56 ALA 0.146 0.015 17 0 "[ . 1 . 2]"
1 57 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 CYS 0.329 0.037 15 0 "[ . 1 . 2]"
1 59 ILE 0.855 0.161 20 0 "[ . 1 . 2]"
1 60 LEU 0.303 0.018 20 0 "[ . 1 . 2]"
1 61 LYS 0.397 0.050 2 0 "[ . 1 . 2]"
1 62 LYS 0.495 0.161 20 0 "[ . 1 . 2]"
1 63 THR 0.050 0.013 17 0 "[ . 1 . 2]"
1 64 LYS 0.396 0.124 17 0 "[ . 1 . 2]"
1 65 GLN 0.055 0.016 15 0 "[ . 1 . 2]"
1 66 ILE 0.297 0.073 5 0 "[ . 1 . 2]"
1 67 LYS 0.555 0.115 10 0 "[ . 1 . 2]"
1 68 SER 0.290 0.068 10 0 "[ . 1 . 2]"
1 69 VAL 0.755 0.048 11 0 "[ . 1 . 2]"
1 70 ASP 0.339 0.050 8 0 "[ . 1 . 2]"
1 71 ASP 0.569 0.050 8 0 "[ . 1 . 2]"
1 72 VAL 0.250 0.026 16 0 "[ . 1 . 2]"
1 73 GLU 0.660 0.060 6 0 "[ . 1 . 2]"
1 74 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 ILE 0.383 0.036 11 0 "[ . 1 . 2]"
1 76 GLU 0.056 0.015 17 0 "[ . 1 . 2]"
1 77 SER 0.074 0.015 17 0 "[ . 1 . 2]"
1 78 LEU 0.294 0.018 18 0 "[ . 1 . 2]"
1 79 ARG 0.494 0.058 12 0 "[ . 1 . 2]"
1 80 TRP 0.214 0.016 16 0 "[ . 1 . 2]"
1 81 GLU 0.170 0.018 16 0 "[ . 1 . 2]"
1 82 ASP 0.099 0.011 17 0 "[ . 1 . 2]"
1 83 GLN 0.432 0.018 18 0 "[ . 1 . 2]"
1 84 GLN 0.130 0.018 16 0 "[ . 1 . 2]"
1 85 LYS 0.147 0.022 12 0 "[ . 1 . 2]"
1 86 ILE 0.898 0.045 16 0 "[ . 1 . 2]"
1 87 ARG 1.877 0.109 6 0 "[ . 1 . 2]"
1 88 LYS 0.446 0.037 20 0 "[ . 1 . 2]"
1 89 TYR 2.182 0.084 19 0 "[ . 1 . 2]"
1 90 VAL 1.132 0.084 19 0 "[ . 1 . 2]"
1 91 GLU 0.190 0.029 5 0 "[ . 1 . 2]"
1 92 SER 0.119 0.029 5 0 "[ . 1 . 2]"
1 93 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 ALA 0.052 0.027 19 0 "[ . 1 . 2]"
1 95 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 13 ALA H 1 73 GLU H . . 4.400 3.670 3.517 3.948 . 0 0 "[ . 1 . 2]" 3
2 1 72 VAL H 1 73 GLU H . . 4.600 4.482 4.307 4.560 . 0 0 "[ . 1 . 2]" 3
3 1 12 ARG HA 1 73 GLU H . . 3.680 2.306 2.028 2.707 . 0 0 "[ . 1 . 2]" 3
4 1 72 VAL HA 1 73 GLU H . . 2.990 2.153 2.141 2.180 . 0 0 "[ . 1 . 2]" 3
5 1 11 TRP HB2 1 73 GLU H . . 4.290 3.966 3.826 4.080 . 0 0 "[ . 1 . 2]" 3
6 1 11 TRP HB3 1 73 GLU H . . 4.690 4.409 4.169 4.603 . 0 0 "[ . 1 . 2]" 3
7 1 73 GLU H 1 73 GLU QG . . 4.030 4.022 3.982 4.066 0.036 17 0 "[ . 1 . 2]" 3
8 1 73 GLU H 1 73 GLU HB3 . . 3.510 2.577 2.450 2.774 . 0 0 "[ . 1 . 2]" 3
9 1 73 GLU H 1 73 GLU HB2 . . 3.560 2.655 2.464 2.823 . 0 0 "[ . 1 . 2]" 3
10 1 9 LYS QB 1 73 GLU H . . 4.470 3.100 2.766 3.290 . 0 0 "[ . 1 . 2]" 3
11 1 9 LYS HG2 1 73 GLU H . . 4.560 4.277 3.738 4.496 . 0 0 "[ . 1 . 2]" 3
12 1 51 PRO QD 1 53 TRP HE1 . . 4.850 4.746 4.555 4.865 0.015 15 0 "[ . 1 . 2]" 3
13 1 53 TRP HB2 1 53 TRP HE1 . . 4.890 4.751 4.749 4.752 . 0 0 "[ . 1 . 2]" 3
14 1 51 PRO HG2 1 53 TRP HE1 . . 4.130 3.031 2.880 3.126 . 0 0 "[ . 1 . 2]" 3
15 1 51 PRO HG3 1 53 TRP HE1 . . 4.130 3.970 3.672 4.127 . 0 0 "[ . 1 . 2]" 3
16 1 51 PRO HB3 1 53 TRP HE1 . . 5.380 5.313 5.053 5.390 0.010 18 0 "[ . 1 . 2]" 3
17 1 51 PRO HB2 1 53 TRP HE1 . . 4.160 4.058 3.822 4.145 . 0 0 "[ . 1 . 2]" 3
18 1 24 LYS H 1 55 HIS H . . 4.520 4.508 4.454 4.533 0.013 14 0 "[ . 1 . 2]" 3
19 1 24 LYS H 1 25 THR H . . 3.270 2.005 1.959 2.069 . 0 0 "[ . 1 . 2]" 3
20 1 23 CYS H 1 24 LYS H . . 4.770 4.642 4.635 4.648 . 0 0 "[ . 1 . 2]" 3
21 1 24 LYS H 1 27 LYS H . . 4.990 3.924 3.846 3.998 . 0 0 "[ . 1 . 2]" 3
22 1 24 LYS H 1 54 ASN HA . . 3.370 2.951 2.818 3.066 . 0 0 "[ . 1 . 2]" 3
23 1 23 CYS HA 1 24 LYS H . . 2.800 2.368 2.341 2.396 . 0 0 "[ . 1 . 2]" 3
24 1 24 LYS H 1 25 THR HB . . 4.940 4.020 3.958 4.126 . 0 0 "[ . 1 . 2]" 3
25 1 23 CYS HB3 1 24 LYS H . . 4.390 3.659 3.555 3.758 . 0 0 "[ . 1 . 2]" 3
26 1 24 LYS H 1 54 ASN HB3 . . 4.740 3.653 3.501 3.891 . 0 0 "[ . 1 . 2]" 3
27 1 23 CYS HB2 1 24 LYS H . . 4.080 3.836 3.797 3.903 . 0 0 "[ . 1 . 2]" 3
28 1 24 LYS H 1 24 LYS QB . . 2.860 2.516 2.453 2.557 . 0 0 "[ . 1 . 2]" 3
29 1 16 ALA H 1 36 ARG H . . 4.190 4.065 3.829 4.178 . 0 0 "[ . 1 . 2]" 3
30 1 14 GLU H 1 36 ARG H . . 3.960 3.639 3.511 3.843 . 0 0 "[ . 1 . 2]" 3
31 1 35 PHE QD 1 36 ARG H . . 3.250 2.318 2.089 2.510 . 0 0 "[ . 1 . 2]" 3
32 1 15 TYR HA 1 36 ARG H . . 3.750 3.501 3.382 3.672 . 0 0 "[ . 1 . 2]" 3
33 1 35 PHE HB2 1 36 ARG H . . 4.780 4.252 4.181 4.329 . 0 0 "[ . 1 . 2]" 3
34 1 35 PHE HB3 1 36 ARG H . . 4.780 4.491 4.451 4.522 . 0 0 "[ . 1 . 2]" 3
35 1 36 ARG H 1 36 ARG HD3 . . 5.000 4.505 4.242 4.644 . 0 0 "[ . 1 . 2]" 3
36 1 36 ARG H 1 36 ARG HD2 . . 5.050 4.806 4.672 4.903 . 0 0 "[ . 1 . 2]" 3
37 1 36 ARG H 1 36 ARG HG2 . . 3.530 2.241 1.986 2.392 . 0 0 "[ . 1 . 2]" 3
38 1 36 ARG H 1 36 ARG HG3 . . 3.890 2.772 2.631 2.951 . 0 0 "[ . 1 . 2]" 3
39 1 36 ARG H 1 56 ALA MB . . 4.810 3.990 3.839 4.153 . 0 0 "[ . 1 . 2]" 3
40 1 80 TRP HE1 1 84 GLN HG3 . . 4.110 3.145 2.913 3.376 . 0 0 "[ . 1 . 2]" 3
41 1 80 TRP HE1 1 84 GLN HG2 . . 4.540 3.503 3.390 3.649 . 0 0 "[ . 1 . 2]" 3
42 1 37 LEU HG 1 56 ALA H . . 4.570 4.142 3.978 4.212 . 0 0 "[ . 1 . 2]" 3
43 1 37 LEU MD2 1 56 ALA H . . 5.490 5.436 5.321 5.494 0.004 9 0 "[ . 1 . 2]" 3
44 1 36 ARG H 1 56 ALA H . . 4.810 4.751 4.619 4.817 0.007 17 0 "[ . 1 . 2]" 3
45 1 37 LEU H 1 56 ALA H . . 3.890 3.762 3.639 3.877 . 0 0 "[ . 1 . 2]" 3
46 1 55 HIS HD2 1 56 ALA H . . 4.800 4.354 4.283 4.502 . 0 0 "[ . 1 . 2]" 3
47 1 35 PHE QD 1 56 ALA H . . 4.880 4.779 4.629 4.889 0.009 3 0 "[ . 1 . 2]" 3
48 1 35 PHE QE 1 56 ALA H . . 5.500 5.184 4.972 5.423 . 0 0 "[ . 1 . 2]" 3
49 1 56 ALA H 1 59 ILE H . . 5.500 5.141 5.056 5.187 . 0 0 "[ . 1 . 2]" 3
50 1 36 ARG HA 1 56 ALA H . . 3.030 2.063 1.921 2.200 . 0 0 "[ . 1 . 2]" 3
51 1 55 HIS HA 1 56 ALA H . . 2.840 2.166 2.143 2.184 . 0 0 "[ . 1 . 2]" 3
52 1 56 ALA H 1 57 SER HB2 . . 5.500 5.112 4.820 5.398 . 0 0 "[ . 1 . 2]" 3
53 1 56 ALA H 1 57 SER HB3 . . 5.500 5.055 4.842 5.430 . 0 0 "[ . 1 . 2]" 3
54 1 55 HIS HB2 1 56 ALA H . . 4.240 4.089 4.050 4.151 . 0 0 "[ . 1 . 2]" 3
55 1 55 HIS HB3 1 56 ALA H . . 3.870 3.081 3.010 3.186 . 0 0 "[ . 1 . 2]" 3
56 1 36 ARG HB2 1 56 ALA H . . 4.380 4.105 3.940 4.287 . 0 0 "[ . 1 . 2]" 3
57 1 36 ARG HB3 1 56 ALA H . . 4.380 3.903 3.760 4.069 . 0 0 "[ . 1 . 2]" 3
58 1 37 LEU HB2 1 56 ALA H . . 4.750 4.680 4.441 4.760 0.010 18 0 "[ . 1 . 2]" 3
59 1 30 ILE MG 1 56 ALA H . . 5.100 4.990 4.915 5.091 . 0 0 "[ . 1 . 2]" 3
60 1 37 LEU MD1 1 56 ALA H . . 4.660 4.532 4.177 4.663 0.003 5 0 "[ . 1 . 2]" 3
61 1 56 ALA H 1 56 ALA MB . . 2.820 2.186 2.061 2.233 . 0 0 "[ . 1 . 2]" 3
62 1 40 LEU H 1 40 LEU HB2 . . 3.750 2.583 2.491 2.741 . 0 0 "[ . 1 . 2]" 3
63 1 40 LEU H 1 40 LEU HB3 . . 4.190 3.596 3.567 3.623 . 0 0 "[ . 1 . 2]" 3
64 1 38 GLY H 1 39 LYS H . . 4.790 4.202 4.087 4.331 . 0 0 "[ . 1 . 2]" 3
65 1 39 LYS H 1 52 MET H . . 3.710 3.180 2.824 3.621 . 0 0 "[ . 1 . 2]" 3
66 1 39 LYS H 1 54 ASN HD22 . . 4.530 3.940 3.602 4.460 . 0 0 "[ . 1 . 2]" 3
67 1 39 LYS H 1 54 ASN HD21 . . 4.120 3.497 3.048 3.893 . 0 0 "[ . 1 . 2]" 3
68 1 11 TRP HZ3 1 39 LYS H . . 4.500 3.596 3.167 4.001 . 0 0 "[ . 1 . 2]" 3
69 1 38 GLY HA2 1 39 LYS H . . 3.210 2.151 2.137 2.192 . 0 0 "[ . 1 . 2]" 3
70 1 38 GLY HA3 1 39 LYS H . . 3.490 3.330 3.234 3.421 . 0 0 "[ . 1 . 2]" 3
71 1 39 LYS H 1 52 MET HB3 . . 3.990 3.958 3.841 4.016 0.026 17 0 "[ . 1 . 2]" 3
72 1 39 LYS H 1 39 LYS HB3 . . 3.440 2.538 2.466 2.619 . 0 0 "[ . 1 . 2]" 3
73 1 39 LYS H 1 39 LYS HB2 . . 3.430 2.588 2.519 2.646 . 0 0 "[ . 1 . 2]" 3
74 1 13 ALA H 1 14 GLU H . . 4.640 4.231 4.127 4.313 . 0 0 "[ . 1 . 2]" 3
75 1 12 ARG HA 1 13 ALA H . . 2.990 2.284 2.238 2.312 . 0 0 "[ . 1 . 2]" 3
76 1 13 ALA H 1 73 GLU HA . . 4.940 4.744 4.499 4.945 0.005 11 0 "[ . 1 . 2]" 3
77 1 13 ALA H 1 73 GLU HB3 . . 4.270 3.219 2.929 3.501 . 0 0 "[ . 1 . 2]" 3
78 1 13 ALA H 1 73 GLU HB2 . . 5.290 4.790 4.388 5.047 . 0 0 "[ . 1 . 2]" 3
79 1 12 ARG HB3 1 13 ALA H . . 4.320 4.054 3.905 4.160 . 0 0 "[ . 1 . 2]" 3
80 1 12 ARG HB2 1 13 ALA H . . 4.390 2.802 2.667 2.955 . 0 0 "[ . 1 . 2]" 3
81 1 13 ALA H 1 13 ALA MB . . 3.170 2.519 2.472 2.560 . 0 0 "[ . 1 . 2]" 3
82 1 13 ALA H 1 72 VAL MG1 . . 3.650 3.426 3.302 3.552 . 0 0 "[ . 1 . 2]" 3
83 1 11 TRP H 1 11 TRP HE1 . . 5.450 5.303 5.078 5.435 . 0 0 "[ . 1 . 2]" 3
84 1 11 TRP HE1 1 66 ILE H . . 4.860 4.590 4.493 4.688 . 0 0 "[ . 1 . 2]" 3
85 1 11 TRP HE1 1 66 ILE HA . . 2.960 2.566 2.405 2.664 . 0 0 "[ . 1 . 2]" 3
86 1 11 TRP HB2 1 11 TRP HE1 . . 4.840 4.788 4.779 4.798 . 0 0 "[ . 1 . 2]" 3
87 1 11 TRP HE1 1 39 LYS HE2 . . 4.760 3.790 2.973 4.451 . 0 0 "[ . 1 . 2]" 3
88 1 11 TRP HE1 1 39 LYS HE3 . . 5.080 3.502 2.824 4.463 . 0 0 "[ . 1 . 2]" 3
89 1 11 TRP HE1 1 65 GLN HB3 . . 4.600 4.469 4.237 4.604 0.004 15 0 "[ . 1 . 2]" 3
90 1 10 PRO HB2 1 11 TRP HE1 . . 4.030 3.702 3.477 3.965 . 0 0 "[ . 1 . 2]" 3
91 1 11 TRP HE1 1 66 ILE HB . . 5.200 5.151 4.951 5.224 0.024 17 0 "[ . 1 . 2]" 3
92 1 11 TRP HE1 1 66 ILE MG . . 4.140 3.935 3.651 4.143 0.003 16 0 "[ . 1 . 2]" 3
93 1 11 TRP HE1 1 66 ILE HG13 . . 3.910 3.831 3.592 3.912 0.002 10 0 "[ . 1 . 2]" 3
94 1 11 TRP HE1 1 39 LYS HG3 . . 4.710 4.284 3.564 4.703 . 0 0 "[ . 1 . 2]" 3
95 1 11 TRP HE1 1 59 ILE MG . . 5.310 5.192 5.023 5.322 0.012 17 0 "[ . 1 . 2]" 3
96 1 11 TRP HE1 1 66 ILE MD . . 4.670 4.605 4.420 4.673 0.003 16 0 "[ . 1 . 2]" 3
97 1 11 TRP HE1 1 66 ILE HG12 . . 3.510 3.093 2.867 3.211 . 0 0 "[ . 1 . 2]" 3
98 1 11 TRP HE1 1 67 LYS H . . 4.400 4.223 4.023 4.406 0.006 5 0 "[ . 1 . 2]" 3
99 1 66 ILE HA 1 67 LYS H . . 3.000 2.218 2.161 2.275 . 0 0 "[ . 1 . 2]" 3
100 1 67 LYS H 1 67 LYS QB . . 3.170 2.382 2.269 2.952 . 0 0 "[ . 1 . 2]" 3
101 1 67 LYS H 1 67 LYS QD . . 4.650 4.239 3.454 4.609 . 0 0 "[ . 1 . 2]" 3
102 1 66 ILE MG 1 67 LYS H . . 3.540 2.012 1.875 2.526 . 0 0 "[ . 1 . 2]" 3
103 1 66 ILE HG12 1 67 LYS H . . 4.870 4.317 4.195 4.495 . 0 0 "[ . 1 . 2]" 3
104 1 66 ILE HB 1 67 LYS H . . 5.000 3.927 3.733 4.102 . 0 0 "[ . 1 . 2]" 3
105 1 22 SER HA 1 30 ILE H . . 3.290 2.602 2.445 2.833 . 0 0 "[ . 1 . 2]" 3
106 1 30 ILE H 1 31 ASN HA . . 4.880 4.833 4.764 4.877 . 0 0 "[ . 1 . 2]" 3
107 1 29 VAL HA 1 30 ILE H . . 2.770 2.206 2.190 2.234 . 0 0 "[ . 1 . 2]" 3
108 1 29 VAL HB 1 30 ILE H . . 4.310 4.229 4.168 4.268 . 0 0 "[ . 1 . 2]" 3
109 1 30 ILE H 1 30 ILE HB . . 3.260 2.555 2.506 2.606 . 0 0 "[ . 1 . 2]" 3
110 1 30 ILE H 1 30 ILE HG13 . . 3.520 2.657 2.608 2.710 . 0 0 "[ . 1 . 2]" 3
111 1 29 VAL MG2 1 30 ILE H . . 3.520 3.498 3.447 3.526 0.006 8 0 "[ . 1 . 2]" 3
112 1 29 VAL MG1 1 30 ILE H . . 3.460 2.312 2.196 2.415 . 0 0 "[ . 1 . 2]" 3
113 1 30 ILE H 1 30 ILE MG . . 3.970 3.815 3.792 3.839 . 0 0 "[ . 1 . 2]" 3
114 1 30 ILE H 1 30 ILE HG12 . . 4.030 4.017 3.953 4.043 0.013 7 0 "[ . 1 . 2]" 3
115 1 31 ASN H 1 34 ASN HD22 . . 5.450 4.474 4.097 5.015 . 0 0 "[ . 1 . 2]" 3
116 1 31 ASN H 1 34 ASN HD21 . . 4.900 3.597 3.031 4.569 . 0 0 "[ . 1 . 2]" 3
117 1 30 ILE HA 1 31 ASN H . . 2.970 2.261 2.260 2.262 . 0 0 "[ . 1 . 2]" 3
118 1 31 ASN H 1 34 ASN HB2 . . 4.630 4.604 4.550 4.650 0.020 4 0 "[ . 1 . 2]" 3
119 1 31 ASN H 1 31 ASN HB3 . . 3.740 3.573 3.551 3.590 . 0 0 "[ . 1 . 2]" 3
120 1 31 ASN H 1 31 ASN HB2 . . 3.280 2.661 2.323 2.822 . 0 0 "[ . 1 . 2]" 3
121 1 30 ILE HB 1 31 ASN H . . 4.890 4.470 4.458 4.486 . 0 0 "[ . 1 . 2]" 3
122 1 29 VAL MG2 1 31 ASN H . . 5.500 5.396 5.377 5.417 . 0 0 "[ . 1 . 2]" 3
123 1 30 ILE HG12 1 31 ASN H . . 5.020 4.967 4.908 5.027 0.007 4 0 "[ . 1 . 2]" 3
124 1 69 VAL H 1 70 ASP H . . 3.240 2.728 2.642 2.814 . 0 0 "[ . 1 . 2]" 3
125 1 69 VAL H 1 71 ASP H . . 4.320 4.303 4.235 4.350 0.030 16 0 "[ . 1 . 2]" 3
126 1 68 SER H 1 69 VAL H . . 4.500 4.338 4.300 4.377 . 0 0 "[ . 1 . 2]" 3
127 1 68 SER HA 1 69 VAL H . . 2.920 2.307 2.262 2.345 . 0 0 "[ . 1 . 2]" 3
128 1 69 VAL H 1 70 ASP HA . . 5.460 5.284 5.203 5.372 . 0 0 "[ . 1 . 2]" 3
129 1 69 VAL H 1 69 VAL HB . . 3.630 3.609 3.603 3.613 . 0 0 "[ . 1 . 2]" 3
130 1 69 VAL H 1 90 VAL MG2 . . 3.280 2.140 1.946 2.434 . 0 0 "[ . 1 . 2]" 3
131 1 16 ALA H 1 33 GLU H . . 4.330 3.679 3.470 3.832 . 0 0 "[ . 1 . 2]" 3
132 1 16 ALA H 1 34 ASN H . . 3.820 2.821 2.628 2.983 . 0 0 "[ . 1 . 2]" 3
133 1 15 TYR QD 1 16 ALA H . . 4.090 3.904 3.637 4.101 0.011 16 0 "[ . 1 . 2]" 3
134 1 15 TYR HA 1 16 ALA H . . 2.890 2.151 2.141 2.170 . 0 0 "[ . 1 . 2]" 3
135 1 16 ALA H 1 17 LYS HA . . 5.500 5.550 5.501 5.581 0.081 16 0 "[ . 1 . 2]" 3
136 1 16 ALA H 1 32 LYS HA . . 4.750 3.987 3.832 4.190 . 0 0 "[ . 1 . 2]" 3
137 1 16 ALA H 1 34 ASN HB2 . . 4.790 4.233 4.100 4.371 . 0 0 "[ . 1 . 2]" 3
138 1 15 TYR HB3 1 16 ALA H . . 3.780 3.312 3.191 3.405 . 0 0 "[ . 1 . 2]" 3
139 1 16 ALA H 1 36 ARG HD3 . . 4.750 4.153 3.699 4.523 . 0 0 "[ . 1 . 2]" 3
140 1 16 ALA H 1 36 ARG HG2 . . 4.020 3.066 2.883 3.203 . 0 0 "[ . 1 . 2]" 3
141 1 16 ALA H 1 36 ARG HG3 . . 4.780 4.609 4.452 4.786 0.006 10 0 "[ . 1 . 2]" 3
142 1 16 ALA H 1 30 ILE MG . . 4.420 4.100 4.019 4.184 . 0 0 "[ . 1 . 2]" 3
143 1 40 LEU HA 1 50 MET H . . 5.500 4.996 4.542 5.487 . 0 0 "[ . 1 . 2]" 3
144 1 50 MET H 1 51 PRO HA . . 5.500 4.935 4.773 5.355 . 0 0 "[ . 1 . 2]" 3
145 1 49 ILE HB 1 50 MET H . . 4.560 4.016 3.582 4.371 . 0 0 "[ . 1 . 2]" 3
146 1 41 VAL MG2 1 50 MET H . . 4.820 3.068 2.303 3.673 . 0 0 "[ . 1 . 2]" 3
147 1 8 HIS HB2 1 9 LYS H . . 4.600 3.889 2.690 4.429 . 0 0 "[ . 1 . 2]" 3
148 1 8 HIS HB3 1 9 LYS H . . 4.600 3.342 2.387 4.067 . 0 0 "[ . 1 . 2]" 3
149 1 9 LYS H 1 9 LYS HG3 . . 4.140 3.068 2.812 3.448 . 0 0 "[ . 1 . 2]" 3
150 1 23 CYS H 1 27 LYS H . . 4.970 4.940 4.824 4.972 0.002 11 0 "[ . 1 . 2]" 3
151 1 23 CYS H 1 55 HIS HE1 . . 4.340 3.232 3.063 3.348 . 0 0 "[ . 1 . 2]" 3
152 1 23 CYS H 1 54 ASN HA . . 5.140 4.898 4.708 5.060 . 0 0 "[ . 1 . 2]" 3
153 1 22 SER HA 1 23 CYS H . . 2.970 2.171 2.155 2.198 . 0 0 "[ . 1 . 2]" 3
154 1 23 CYS H 1 27 LYS HA . . 4.850 4.709 4.601 4.853 0.003 4 0 "[ . 1 . 2]" 3
155 1 23 CYS H 1 29 VAL HA . . 3.860 3.409 3.317 3.543 . 0 0 "[ . 1 . 2]" 3
156 1 23 CYS H 1 23 CYS HB3 . . 3.080 2.559 2.479 2.633 . 0 0 "[ . 1 . 2]" 3
157 1 23 CYS H 1 23 CYS HB2 . . 3.230 2.498 2.429 2.579 . 0 0 "[ . 1 . 2]" 3
158 1 23 CYS H 1 30 ILE HG13 . . 3.900 2.367 2.255 2.453 . 0 0 "[ . 1 . 2]" 3
159 1 23 CYS H 1 30 ILE HG12 . . 4.280 3.764 3.608 3.877 . 0 0 "[ . 1 . 2]" 3
160 1 15 TYR QD 1 35 PHE H . . 5.030 3.826 3.316 4.782 . 0 0 "[ . 1 . 2]" 3
161 1 35 PHE H 1 35 PHE HB2 . . 4.160 2.947 2.879 3.062 . 0 0 "[ . 1 . 2]" 3
162 1 35 PHE H 1 35 PHE HB3 . . 4.160 2.270 2.251 2.307 . 0 0 "[ . 1 . 2]" 3
163 1 94 ALA H 1 94 ALA MB . . 3.500 2.153 2.033 2.292 . 0 0 "[ . 1 . 2]" 3
164 1 42 GLN H 1 42 GLN HB2 . . 4.150 2.506 2.407 2.643 . 0 0 "[ . 1 . 2]" 3
165 1 29 VAL H 1 29 VAL HB . . 2.860 2.250 2.234 2.274 . 0 0 "[ . 1 . 2]" 3
166 1 29 VAL H 1 29 VAL MG2 . . 3.140 3.052 3.006 3.096 . 0 0 "[ . 1 . 2]" 3
167 1 29 VAL H 1 29 VAL MG1 . . 3.760 3.566 3.560 3.571 . 0 0 "[ . 1 . 2]" 3
168 1 55 HIS H 1 56 ALA H . . 4.750 4.544 4.519 4.561 . 0 0 "[ . 1 . 2]" 3
169 1 26 CYS H 1 55 HIS H . . 5.420 5.102 4.850 5.346 . 0 0 "[ . 1 . 2]" 3
170 1 37 LEU H 1 55 HIS H . . 5.500 4.866 4.786 4.966 . 0 0 "[ . 1 . 2]" 3
171 1 54 ASN H 1 55 HIS H . . 4.650 4.314 4.214 4.439 . 0 0 "[ . 1 . 2]" 3
172 1 54 ASN HA 1 55 HIS H . . 3.000 2.255 2.236 2.288 . 0 0 "[ . 1 . 2]" 3
173 1 23 CYS HA 1 55 HIS H . . 4.160 3.885 3.796 4.055 . 0 0 "[ . 1 . 2]" 3
174 1 55 HIS H 1 55 HIS HB2 . . 3.400 2.536 2.483 2.585 . 0 0 "[ . 1 . 2]" 3
175 1 55 HIS H 1 55 HIS HB3 . . 3.690 3.547 3.542 3.550 . 0 0 "[ . 1 . 2]" 3
176 1 23 CYS HB3 1 55 HIS H . . 4.270 4.026 3.853 4.125 . 0 0 "[ . 1 . 2]" 3
177 1 55 HIS H 1 58 CYS HB2 . . 3.900 2.877 2.646 2.977 . 0 0 "[ . 1 . 2]" 3
178 1 55 HIS H 1 58 CYS HB3 . . 4.280 4.165 3.909 4.276 . 0 0 "[ . 1 . 2]" 3
179 1 54 ASN HB3 1 55 HIS H . . 3.480 3.219 3.057 3.331 . 0 0 "[ . 1 . 2]" 3
180 1 23 CYS HB2 1 55 HIS H . . 3.690 2.705 2.462 2.861 . 0 0 "[ . 1 . 2]" 3
181 1 30 ILE HG13 1 55 HIS H . . 5.020 4.783 4.595 4.999 . 0 0 "[ . 1 . 2]" 3
182 1 30 ILE MD 1 55 HIS H . . 3.750 3.343 3.110 3.602 . 0 0 "[ . 1 . 2]" 3
183 1 30 ILE HG12 1 55 HIS H . . 4.840 3.823 3.694 4.012 . 0 0 "[ . 1 . 2]" 3
184 1 52 MET H 1 52 MET HB3 . . 4.050 3.603 3.578 3.802 . 0 0 "[ . 1 . 2]" 3
185 1 41 VAL MG1 1 52 MET H . . 5.130 4.211 3.726 4.690 . 0 0 "[ . 1 . 2]" 3
186 1 41 VAL H 1 50 MET H . . 4.160 3.820 3.146 4.153 . 0 0 "[ . 1 . 2]" 3
187 1 40 LEU HA 1 41 VAL H . . 3.020 2.149 2.139 2.161 . 0 0 "[ . 1 . 2]" 3
188 1 41 VAL H 1 41 VAL HB . . 3.860 3.752 3.679 3.805 . 0 0 "[ . 1 . 2]" 3
189 1 40 LEU HB2 1 41 VAL H . . 4.690 4.266 4.060 4.382 . 0 0 "[ . 1 . 2]" 3
190 1 40 LEU HB3 1 41 VAL H . . 4.310 3.582 3.316 3.725 . 0 0 "[ . 1 . 2]" 3
191 1 41 VAL H 1 41 VAL MG2 . . 3.310 1.947 1.877 2.212 . 0 0 "[ . 1 . 2]" 3
192 1 40 LEU MD2 1 41 VAL H . . 4.220 3.822 3.642 3.995 . 0 0 "[ . 1 . 2]" 3
193 1 79 ARG H 1 82 ASP H . . 4.710 4.059 3.949 4.186 . 0 0 "[ . 1 . 2]" 3
194 1 15 TYR QD 1 79 ARG H . . 5.450 5.197 4.917 5.412 . 0 0 "[ . 1 . 2]" 3
195 1 15 TYR QE 1 79 ARG H . . 3.360 3.095 2.819 3.330 . 0 0 "[ . 1 . 2]" 3
196 1 78 LEU HA 1 79 ARG H . . 3.180 2.352 2.260 2.445 . 0 0 "[ . 1 . 2]" 3
197 1 79 ARG H 1 82 ASP HB2 . . 3.990 2.706 2.513 2.897 . 0 0 "[ . 1 . 2]" 3
198 1 79 ARG H 1 79 ARG HB3 . . 3.870 3.529 3.491 3.573 . 0 0 "[ . 1 . 2]" 3
199 1 79 ARG H 1 79 ARG HG2 . . 4.050 3.196 2.483 3.994 . 0 0 "[ . 1 . 2]" 3
200 1 79 ARG H 1 79 ARG HB2 . . 3.200 2.253 2.185 2.350 . 0 0 "[ . 1 . 2]" 3
201 1 78 LEU HG 1 79 ARG H . . 5.210 5.045 4.929 5.153 . 0 0 "[ . 1 . 2]" 3
202 1 78 LEU HB3 1 79 ARG H . . 3.610 2.609 2.417 2.853 . 0 0 "[ . 1 . 2]" 3
203 1 78 LEU MD1 1 79 ARG H . . 4.970 4.580 4.364 4.786 . 0 0 "[ . 1 . 2]" 3
204 1 78 LEU MD2 1 79 ARG H . . 3.880 3.689 3.541 3.800 . 0 0 "[ . 1 . 2]" 3
205 1 75 ILE H 1 76 GLU H . . 3.310 2.512 2.435 2.648 . 0 0 "[ . 1 . 2]" 3
206 1 73 GLU HA 1 75 ILE H . . 3.870 3.222 3.119 3.285 . 0 0 "[ . 1 . 2]" 3
207 1 75 ILE H 1 76 GLU HG3 . . 5.420 4.846 4.560 5.009 . 0 0 "[ . 1 . 2]" 3
208 1 75 ILE H 1 75 ILE HG13 . . 4.580 4.395 4.324 4.448 . 0 0 "[ . 1 . 2]" 3
209 1 72 VAL MG1 1 75 ILE H . . 3.650 3.418 3.161 3.670 0.020 18 0 "[ . 1 . 2]" 3
210 1 75 ILE H 1 78 LEU MD1 . . 4.650 4.451 4.322 4.660 0.010 18 0 "[ . 1 . 2]" 3
211 1 73 GLU QG 1 75 ILE H . . 4.880 4.319 4.184 4.558 . 0 0 "[ . 1 . 2]" 3
212 1 75 ILE H 1 76 GLU HG2 . . 5.230 4.029 3.868 4.248 . 0 0 "[ . 1 . 2]" 3
213 1 73 GLU HB2 1 75 ILE H . . 5.450 5.419 5.318 5.464 0.014 14 0 "[ . 1 . 2]" 3
214 1 75 ILE H 1 75 ILE HB . . 2.890 2.504 2.408 2.585 . 0 0 "[ . 1 . 2]" 3
215 1 75 ILE H 1 78 LEU HG . . 4.630 4.591 4.497 4.638 0.008 12 0 "[ . 1 . 2]" 3
216 1 13 ALA MB 1 75 ILE H . . 3.810 3.269 3.000 3.434 . 0 0 "[ . 1 . 2]" 3
217 1 76 GLU H 1 78 LEU H . . 4.380 4.106 4.005 4.224 . 0 0 "[ . 1 . 2]" 3
218 1 78 LEU H 1 79 ARG H . . 4.710 4.615 4.590 4.631 . 0 0 "[ . 1 . 2]" 3
219 1 76 GLU HA 1 78 LEU H . . 3.940 3.820 3.679 3.931 . 0 0 "[ . 1 . 2]" 3
220 1 77 SER HB3 1 78 LEU H . . 4.420 3.230 3.084 3.433 . 0 0 "[ . 1 . 2]" 3
221 1 75 ILE HA 1 78 LEU H . . 3.750 3.451 3.352 3.567 . 0 0 "[ . 1 . 2]" 3
222 1 78 LEU H 1 83 GLN HG2 . . 3.860 3.589 3.446 3.711 . 0 0 "[ . 1 . 2]" 3
223 1 76 GLU HG3 1 78 LEU H . . 5.070 4.772 4.608 4.876 . 0 0 "[ . 1 . 2]" 3
224 1 78 LEU H 1 78 LEU HB2 . . 3.090 2.672 2.606 2.737 . 0 0 "[ . 1 . 2]" 3
225 1 78 LEU H 1 78 LEU HG . . 2.950 2.035 1.901 2.213 . 0 0 "[ . 1 . 2]" 3
226 1 75 ILE HG13 1 78 LEU H . . 5.070 4.844 4.702 4.969 . 0 0 "[ . 1 . 2]" 3
227 1 78 LEU H 1 78 LEU HB3 . . 3.720 3.598 3.582 3.624 . 0 0 "[ . 1 . 2]" 3
228 1 78 LEU H 1 78 LEU MD1 . . 3.800 3.595 3.454 3.718 . 0 0 "[ . 1 . 2]" 3
229 1 78 LEU H 1 78 LEU MD2 . . 3.550 2.994 2.876 3.165 . 0 0 "[ . 1 . 2]" 3
230 1 36 ARG H 1 37 LEU H . . 4.780 4.440 4.409 4.470 . 0 0 "[ . 1 . 2]" 3
231 1 37 LEU H 1 54 ASN H . . 3.640 2.881 2.750 2.984 . 0 0 "[ . 1 . 2]" 3
232 1 37 LEU H 1 53 TRP HE3 . . 3.830 3.767 3.549 3.853 0.023 12 0 "[ . 1 . 2]" 3
233 1 36 ARG HA 1 37 LEU H . . 2.880 2.576 2.494 2.636 . 0 0 "[ . 1 . 2]" 3
234 1 37 LEU H 1 56 ALA HA . . 4.020 3.875 3.734 4.035 0.015 17 0 "[ . 1 . 2]" 3
235 1 36 ARG HB2 1 37 LEU H . . 3.620 2.080 1.978 2.236 . 0 0 "[ . 1 . 2]" 3
236 1 36 ARG HD2 1 37 LEU H . . 4.560 3.995 3.612 4.251 . 0 0 "[ . 1 . 2]" 3
237 1 36 ARG HB3 1 37 LEU H . . 3.620 3.529 3.385 3.620 . 11 0 "[ . 1 . 2]" 3
238 1 30 ILE MD 1 37 LEU H . . 4.750 4.407 4.170 4.524 . 0 0 "[ . 1 . 2]" 3
239 1 37 LEU H 1 55 HIS HA . . 4.400 3.700 3.576 3.845 . 0 0 "[ . 1 . 2]" 3
240 1 37 LEU H 1 54 ASN HB2 . . 4.440 4.277 4.143 4.445 0.005 17 0 "[ . 1 . 2]" 3
241 1 37 LEU H 1 37 LEU HB2 . . 3.290 2.655 2.563 2.735 . 0 0 "[ . 1 . 2]" 3
242 1 37 LEU H 1 37 LEU MD2 . . 4.400 4.092 3.984 4.208 . 0 0 "[ . 1 . 2]" 3
243 1 61 LYS H 1 62 LYS H . . 2.760 2.589 2.519 2.668 . 0 0 "[ . 1 . 2]" 3
244 1 59 ILE HA 1 62 LYS H . . 3.890 3.407 3.283 3.504 . 0 0 "[ . 1 . 2]" 3
245 1 60 LEU HA 1 62 LYS H . . 4.210 3.930 3.806 4.122 . 0 0 "[ . 1 . 2]" 3
246 1 62 LYS H 1 65 GLN HG3 . . 4.120 3.751 3.509 3.988 . 0 0 "[ . 1 . 2]" 3
247 1 62 LYS H 1 62 LYS HB2 . . 2.940 2.363 2.241 2.633 . 0 0 "[ . 1 . 2]" 3
248 1 61 LYS HB3 1 62 LYS H . . 4.040 4.010 3.949 4.081 0.041 9 0 "[ . 1 . 2]" 3
249 1 59 ILE MG 1 62 LYS H . . 4.680 4.053 3.967 4.190 . 0 0 "[ . 1 . 2]" 3
250 1 89 TYR H 1 89 TYR QD . . 4.100 4.012 3.888 4.085 . 0 0 "[ . 1 . 2]" 3
251 1 87 ARG HA 1 89 TYR H . . 4.250 3.471 3.444 3.500 . 0 0 "[ . 1 . 2]" 3
252 1 89 TYR H 1 89 TYR HB3 . . 3.100 2.441 2.405 2.465 . 0 0 "[ . 1 . 2]" 3
253 1 89 TYR H 1 89 TYR HB2 . . 3.290 3.219 3.137 3.257 . 0 0 "[ . 1 . 2]" 3
254 1 89 TYR H 1 91 GLU QB . . 4.550 4.510 4.413 4.572 0.022 11 0 "[ . 1 . 2]" 3
255 1 88 LYS QB 1 89 TYR H . . 3.570 3.436 3.378 3.477 . 0 0 "[ . 1 . 2]" 3
256 1 87 ARG HG2 1 89 TYR H . . 4.770 4.503 4.391 4.585 . 0 0 "[ . 1 . 2]" 3
257 1 88 LYS HG2 1 89 TYR H . . 4.720 4.478 4.434 4.520 . 0 0 "[ . 1 . 2]" 3
258 1 89 TYR H 1 90 VAL MG2 . . 4.300 3.077 3.025 3.224 . 0 0 "[ . 1 . 2]" 3
259 1 86 ILE MG 1 89 TYR H . . 4.590 4.418 4.321 4.509 . 0 0 "[ . 1 . 2]" 3
260 1 60 LEU MD2 1 89 TYR H . . 4.460 4.378 4.284 4.461 0.001 1 0 "[ . 1 . 2]" 3
261 1 31 ASN HB3 1 32 LYS H . . 3.660 2.879 2.723 3.243 . 0 0 "[ . 1 . 2]" 3
262 1 32 LYS H 1 32 LYS HB3 . . 3.410 2.298 2.254 2.313 . 0 0 "[ . 1 . 2]" 3
263 1 32 LYS H 1 32 LYS HB2 . . 3.600 3.550 3.533 3.556 . 0 0 "[ . 1 . 2]" 3
264 1 32 LYS H 1 33 GLU H . . 4.770 4.634 4.623 4.645 . 0 0 "[ . 1 . 2]" 3
265 1 12 ARG H 1 40 LEU MD2 . . 4.830 4.645 4.453 4.833 0.003 14 0 "[ . 1 . 2]" 3
266 1 12 ARG H 1 38 GLY H . . 3.560 2.668 2.465 2.871 . 0 0 "[ . 1 . 2]" 3
267 1 12 ARG H 1 40 LEU H . . 4.380 4.270 4.004 4.387 0.007 6 0 "[ . 1 . 2]" 3
268 1 11 TRP H 1 12 ARG H . . 4.640 4.515 4.478 4.566 . 0 0 "[ . 1 . 2]" 3
269 1 11 TRP HE3 1 12 ARG H . . 3.750 3.298 3.145 3.534 . 0 0 "[ . 1 . 2]" 3
270 1 12 ARG H 1 53 TRP HZ3 . . 5.500 5.498 5.417 5.554 0.054 12 0 "[ . 1 . 2]" 3
271 1 11 TRP HA 1 12 ARG H . . 2.810 2.287 2.241 2.324 . 0 0 "[ . 1 . 2]" 3
272 1 12 ARG H 1 72 VAL HA . . 4.760 4.604 4.414 4.764 0.004 18 0 "[ . 1 . 2]" 3
273 1 12 ARG H 1 39 LYS HA . . 4.250 3.992 3.724 4.177 . 0 0 "[ . 1 . 2]" 3
274 1 11 TRP HB2 1 12 ARG H . . 4.020 3.914 3.834 4.018 . 0 0 "[ . 1 . 2]" 3
275 1 11 TRP HB3 1 12 ARG H . . 3.430 2.738 2.632 2.880 . 0 0 "[ . 1 . 2]" 3
276 1 12 ARG H 1 38 GLY HA3 . . 4.220 4.016 3.729 4.233 0.013 17 0 "[ . 1 . 2]" 3
277 1 12 ARG H 1 12 ARG HB3 . . 3.710 2.975 2.880 3.164 . 0 0 "[ . 1 . 2]" 3
278 1 12 ARG H 1 12 ARG HB2 . . 3.860 3.831 3.804 3.872 0.012 6 0 "[ . 1 . 2]" 3
279 1 12 ARG H 1 40 LEU HG . . 4.010 3.971 3.868 4.016 0.006 6 0 "[ . 1 . 2]" 3
280 1 12 ARG H 1 37 LEU MD2 . . 4.010 3.649 3.348 3.912 . 0 0 "[ . 1 . 2]" 3
281 1 25 THR H 1 26 CYS H . . 3.160 2.636 2.468 2.769 . 0 0 "[ . 1 . 2]" 3
282 1 26 CYS H 1 28 SER H . . 4.010 3.822 3.608 3.940 . 0 0 "[ . 1 . 2]" 3
283 1 26 CYS H 1 27 LYS H . . 2.860 2.026 1.824 2.181 . 0 0 "[ . 1 . 2]" 3
284 1 25 THR HB 1 26 CYS H . . 3.050 2.690 2.427 3.021 . 0 0 "[ . 1 . 2]" 3
285 1 25 THR HA 1 26 CYS H . . 3.570 3.539 3.476 3.568 . 0 0 "[ . 1 . 2]" 3
286 1 26 CYS H 1 26 CYS HB2 . . 3.840 3.727 3.677 3.812 . 0 0 "[ . 1 . 2]" 3
287 1 26 CYS H 1 26 CYS HB3 . . 3.840 2.848 2.698 3.067 . 0 0 "[ . 1 . 2]" 3
288 1 23 CYS HB2 1 26 CYS H . . 4.480 4.382 4.330 4.441 . 0 0 "[ . 1 . 2]" 3
289 1 26 CYS H 1 27 LYS QD . . 4.790 4.176 3.459 4.749 . 0 0 "[ . 1 . 2]" 3
290 1 25 THR MG 1 26 CYS H . . 3.380 3.042 2.821 3.369 . 0 0 "[ . 1 . 2]" 3
291 1 24 LYS H 1 26 CYS H . . 4.560 3.784 3.573 3.987 . 0 0 "[ . 1 . 2]" 3
292 1 23 CYS HB3 1 26 CYS H . . 3.750 3.221 3.035 3.393 . 0 0 "[ . 1 . 2]" 3
293 1 19 SER HB3 1 32 LYS H . . 4.120 3.877 3.532 4.123 0.003 4 0 "[ . 1 . 2]" 3
294 1 32 LYS H 1 32 LYS HG2 . . 4.040 2.746 2.702 2.857 . 0 0 "[ . 1 . 2]" 3
295 1 32 LYS H 1 32 LYS HG3 . . 4.460 4.055 4.028 4.124 . 0 0 "[ . 1 . 2]" 3
296 1 29 VAL MG1 1 32 LYS H . . 5.210 5.012 4.822 5.099 . 0 0 "[ . 1 . 2]" 3
297 1 32 LYS H 1 32 LYS QE . . 5.120 4.735 4.565 5.088 . 0 0 "[ . 1 . 2]" 3
298 1 31 ASN HB2 1 32 LYS H . . 4.090 3.826 3.670 4.038 . 0 0 "[ . 1 . 2]" 3
299 1 82 ASP H 1 83 GLN HA . . 5.500 5.322 5.296 5.347 . 0 0 "[ . 1 . 2]" 3
300 1 81 GLU QG 1 82 ASP H . . 3.300 2.045 1.927 2.136 . 0 0 "[ . 1 . 2]" 3
301 1 79 ARG HB3 1 82 ASP H . . 4.410 3.286 3.095 3.488 . 0 0 "[ . 1 . 2]" 3
302 1 81 GLU QB 1 82 ASP H . . 3.760 3.372 3.344 3.401 . 0 0 "[ . 1 . 2]" 3
303 1 79 ARG HB2 1 82 ASP H . . 3.650 3.109 2.947 3.251 . 0 0 "[ . 1 . 2]" 3
304 1 82 ASP H 1 82 ASP HB3 . . 4.190 3.591 3.574 3.597 . 0 0 "[ . 1 . 2]" 3
305 1 78 LEU HB3 1 82 ASP H . . 4.860 4.701 4.639 4.814 . 0 0 "[ . 1 . 2]" 3
306 1 83 GLN H 1 84 GLN H . . 2.990 2.748 2.721 2.778 . 0 0 "[ . 1 . 2]" 3
307 1 83 GLN H 1 83 GLN HE21 . . 4.330 4.268 4.185 4.331 0.001 4 0 "[ . 1 . 2]" 3
308 1 82 ASP H 1 83 GLN H . . 2.790 2.750 2.717 2.783 . 0 0 "[ . 1 . 2]" 3
309 1 78 LEU HA 1 83 GLN H . . 5.500 5.491 5.416 5.518 0.018 18 0 "[ . 1 . 2]" 3
310 1 80 TRP HA 1 83 GLN H . . 3.770 3.566 3.526 3.595 . 0 0 "[ . 1 . 2]" 3
311 1 81 GLU HA 1 83 GLN H . . 4.960 4.862 4.772 4.921 . 0 0 "[ . 1 . 2]" 3
312 1 83 GLN H 1 83 GLN HG2 . . 3.360 2.894 2.833 2.947 . 0 0 "[ . 1 . 2]" 3
313 1 82 ASP HB2 1 83 GLN H . . 3.250 2.339 2.280 2.449 . 0 0 "[ . 1 . 2]" 3
314 1 83 GLN H 1 83 GLN HG3 . . 3.420 2.194 2.106 2.236 . 0 0 "[ . 1 . 2]" 3
315 1 83 GLN H 1 83 GLN HB2 . . 3.180 2.604 2.582 2.655 . 0 0 "[ . 1 . 2]" 3
316 1 83 GLN H 1 83 GLN HB3 . . 3.620 3.589 3.585 3.591 . 0 0 "[ . 1 . 2]" 3
317 1 78 LEU HB2 1 83 GLN H . . 3.630 3.258 3.133 3.408 . 0 0 "[ . 1 . 2]" 3
318 1 82 ASP HB3 1 83 GLN H . . 3.950 3.392 3.311 3.501 . 0 0 "[ . 1 . 2]" 3
319 1 83 GLN H 1 84 GLN HB2 . . 5.160 5.016 4.962 5.081 . 0 0 "[ . 1 . 2]" 3
320 1 78 LEU HB3 1 83 GLN H . . 3.960 3.897 3.767 3.959 . 0 0 "[ . 1 . 2]" 3
321 1 78 LEU MD1 1 83 GLN H . . 4.330 3.988 3.842 4.116 . 0 0 "[ . 1 . 2]" 3
322 1 88 LYS HA 1 91 GLU H . . 4.050 3.969 3.857 4.053 0.003 16 0 "[ . 1 . 2]" 3
323 1 85 LYS H 1 87 ARG H . . 5.010 4.871 4.828 4.934 . 0 0 "[ . 1 . 2]" 3
324 1 86 ILE H 1 87 ARG H . . 2.990 2.760 2.690 2.851 . 0 0 "[ . 1 . 2]" 3
325 1 87 ARG H 1 88 LYS HA . . 5.500 5.377 5.356 5.389 . 0 0 "[ . 1 . 2]" 3
326 1 87 ARG H 1 87 ARG HA . . 2.920 2.769 2.765 2.775 . 0 0 "[ . 1 . 2]" 3
327 1 87 ARG H 1 87 ARG HD3 . . 4.530 3.521 3.283 3.607 . 0 0 "[ . 1 . 2]" 3
328 1 86 ILE HB 1 87 ARG H . . 2.950 1.995 1.960 2.032 . 0 0 "[ . 1 . 2]" 3
329 1 87 ARG H 1 87 ARG HB3 . . 3.140 2.628 2.449 2.691 . 0 0 "[ . 1 . 2]" 3
330 1 87 ARG H 1 87 ARG HB2 . . 3.640 3.583 3.580 3.589 . 0 0 "[ . 1 . 2]" 3
331 1 87 ARG H 1 87 ARG HG2 . . 3.460 1.975 1.861 2.315 . 0 0 "[ . 1 . 2]" 3
332 1 86 ILE HG12 1 87 ARG H . . 4.330 3.767 3.670 3.882 . 0 0 "[ . 1 . 2]" 3
333 1 69 VAL MG1 1 87 ARG H . . 3.940 2.346 2.219 2.486 . 0 0 "[ . 1 . 2]" 3
334 1 91 GLU H 1 91 GLU QB . . 2.840 2.408 2.345 2.498 . 0 0 "[ . 1 . 2]" 3
335 1 49 ILE H 1 49 ILE HG12 . . 4.260 3.670 2.478 4.209 . 0 0 "[ . 1 . 2]" 3
336 1 49 ILE H 1 49 ILE HB . . 3.830 2.667 2.465 3.629 . 0 0 "[ . 1 . 2]" 3
337 1 89 TYR H 1 90 VAL H . . 3.150 2.015 1.958 2.070 . 0 0 "[ . 1 . 2]" 3
338 1 89 TYR QD 1 90 VAL H . . 3.490 3.078 2.746 3.290 . 0 0 "[ . 1 . 2]" 3
339 1 89 TYR QE 1 90 VAL H . . 5.430 5.147 4.972 5.263 . 0 0 "[ . 1 . 2]" 3
340 1 87 ARG HA 1 91 GLU H . . 4.520 3.782 3.583 3.968 . 0 0 "[ . 1 . 2]" 3
341 1 86 ILE HA 1 90 VAL H . . 4.450 4.228 4.131 4.368 . 0 0 "[ . 1 . 2]" 3
342 1 89 TYR HB3 1 90 VAL H . . 3.250 2.758 2.672 2.860 . 0 0 "[ . 1 . 2]" 3
343 1 66 ILE HB 1 90 VAL H . . 5.340 5.248 4.926 5.351 0.011 12 0 "[ . 1 . 2]" 3
344 1 69 VAL MG1 1 90 VAL H . . 4.270 4.024 3.865 4.292 0.022 8 0 "[ . 1 . 2]" 3
345 1 90 VAL H 1 90 VAL MG2 . . 2.890 1.901 1.842 2.073 . 0 0 "[ . 1 . 2]" 3
346 1 90 VAL MG2 1 91 GLU H . . 3.080 2.098 1.897 2.282 . 0 0 "[ . 1 . 2]" 3
347 1 66 ILE MG 1 90 VAL H . . 5.200 4.935 4.657 5.206 0.006 11 0 "[ . 1 . 2]" 3
348 1 15 TYR H 1 15 TYR QD . . 3.370 2.678 2.470 2.837 . 0 0 "[ . 1 . 2]" 3
349 1 15 TYR H 1 15 TYR QE . . 4.950 4.659 4.497 4.835 . 0 0 "[ . 1 . 2]" 3
350 1 14 GLU HA 1 15 TYR H . . 2.770 2.265 2.237 2.329 . 0 0 "[ . 1 . 2]" 3
351 1 15 TYR H 1 15 TYR HB3 . . 3.780 3.570 3.538 3.590 . 0 0 "[ . 1 . 2]" 3
352 1 15 TYR H 1 15 TYR HB2 . . 3.230 2.320 2.254 2.397 . 0 0 "[ . 1 . 2]" 3
353 1 14 GLU HG2 1 15 TYR H . . 4.820 4.815 4.720 4.859 0.039 17 0 "[ . 1 . 2]" 3
354 1 14 GLU HB2 1 15 TYR H . . 3.020 2.792 2.605 2.881 . 0 0 "[ . 1 . 2]" 3
355 1 14 GLU HG3 1 15 TYR H . . 4.120 4.078 3.967 4.139 0.019 17 0 "[ . 1 . 2]" 3
356 1 15 TYR H 1 78 LEU MD2 . . 4.140 3.775 3.577 3.915 . 0 0 "[ . 1 . 2]" 3
357 1 55 HIS H 1 58 CYS H . . 4.320 4.205 4.056 4.282 . 0 0 "[ . 1 . 2]" 3
358 1 56 ALA H 1 58 CYS H . . 4.430 4.090 4.061 4.139 . 0 0 "[ . 1 . 2]" 3
359 1 57 SER H 1 58 CYS H . . 3.780 2.204 2.117 2.279 . 0 0 "[ . 1 . 2]" 3
360 1 58 CYS H 1 60 LEU H . . 4.310 4.229 4.086 4.314 0.004 9 0 "[ . 1 . 2]" 3
361 1 55 HIS HA 1 58 CYS H . . 4.510 4.234 4.192 4.273 . 0 0 "[ . 1 . 2]" 3
362 1 55 HIS HB2 1 58 CYS H . . 2.990 2.539 2.500 2.586 . 0 0 "[ . 1 . 2]" 3
363 1 55 HIS HB3 1 58 CYS H . . 3.200 3.168 3.127 3.211 0.011 7 0 "[ . 1 . 2]" 3
364 1 56 ALA HA 1 58 CYS H . . 4.200 4.140 4.062 4.206 0.006 4 0 "[ . 1 . 2]" 3
365 1 58 CYS H 1 58 CYS HB2 . . 2.970 2.270 2.258 2.308 . 0 0 "[ . 1 . 2]" 3
366 1 58 CYS H 1 58 CYS HB3 . . 3.700 3.548 3.540 3.565 . 0 0 "[ . 1 . 2]" 3
367 1 54 ASN HB3 1 58 CYS H . . 5.030 4.965 4.848 5.029 . 0 0 "[ . 1 . 2]" 3
368 1 58 CYS H 1 59 ILE HB . . 4.840 4.713 4.646 4.763 . 0 0 "[ . 1 . 2]" 3
369 1 58 CYS H 1 59 ILE HG12 . . 4.530 4.019 3.869 4.116 . 0 0 "[ . 1 . 2]" 3
370 1 25 THR MG 1 58 CYS H . . 5.050 4.989 4.935 5.022 . 0 0 "[ . 1 . 2]" 3
371 1 58 CYS H 1 59 ILE HG13 . . 5.500 5.464 5.335 5.537 0.037 15 0 "[ . 1 . 2]" 3
372 1 58 CYS H 1 59 ILE MD . . 5.490 5.171 4.725 5.319 . 0 0 "[ . 1 . 2]" 3
373 1 56 ALA MB 1 58 CYS H . . 4.620 4.522 4.475 4.583 . 0 0 "[ . 1 . 2]" 3
374 1 85 LYS H 1 88 LYS H . . 4.850 4.810 4.771 4.853 0.003 4 0 "[ . 1 . 2]" 3
375 1 84 GLN H 1 85 LYS H . . 2.960 2.565 2.488 2.635 . 0 0 "[ . 1 . 2]" 3
376 1 83 GLN H 1 85 LYS H . . 4.420 4.352 4.277 4.417 . 0 0 "[ . 1 . 2]" 3
377 1 82 ASP HA 1 85 LYS H . . 3.450 3.344 3.292 3.403 . 0 0 "[ . 1 . 2]" 3
378 1 83 GLN HA 1 85 LYS H . . 4.450 4.387 4.294 4.454 0.004 16 0 "[ . 1 . 2]" 3
379 1 85 LYS H 1 85 LYS HE3 . . 4.320 4.019 3.662 4.296 . 0 0 "[ . 1 . 2]" 3
380 1 81 GLU QG 1 85 LYS H . . 5.040 5.013 4.932 5.048 0.008 14 0 "[ . 1 . 2]" 3
381 1 85 LYS H 1 85 LYS HB2 . . 2.860 2.513 2.434 2.572 . 0 0 "[ . 1 . 2]" 3
382 1 85 LYS H 1 85 LYS HG3 . . 2.830 2.136 2.019 2.294 . 0 0 "[ . 1 . 2]" 3
383 1 84 GLN HB3 1 85 LYS H . . 3.780 3.695 3.606 3.759 . 0 0 "[ . 1 . 2]" 3
384 1 84 GLN HB2 1 85 LYS H . . 3.260 2.633 2.552 2.713 . 0 0 "[ . 1 . 2]" 3
385 1 85 LYS H 1 85 LYS HG2 . . 3.540 3.434 3.349 3.513 . 0 0 "[ . 1 . 2]" 3
386 1 84 GLN HG2 1 85 LYS H . . 4.370 4.321 4.212 4.371 0.001 2 0 "[ . 1 . 2]" 3
387 1 85 LYS H 1 86 ILE HG12 . . 4.870 3.843 3.708 4.025 . 0 0 "[ . 1 . 2]" 3
388 1 85 LYS H 1 86 ILE MD . . 5.110 4.712 4.520 4.848 . 0 0 "[ . 1 . 2]" 3
389 1 60 LEU MD1 1 85 LYS H . . 4.640 4.567 4.447 4.647 0.007 15 0 "[ . 1 . 2]" 3
390 1 13 ALA MB 1 76 GLU H . . 5.130 4.613 4.407 4.849 . 0 0 "[ . 1 . 2]" 3
391 1 76 GLU H 1 76 GLU HG2 . . 3.690 2.278 2.080 2.394 . 0 0 "[ . 1 . 2]" 3
392 1 76 GLU H 1 76 GLU HG3 . . 3.790 2.802 2.572 2.988 . 0 0 "[ . 1 . 2]" 3
393 1 76 GLU H 1 76 GLU HB3 . . 3.370 2.640 2.537 2.746 . 0 0 "[ . 1 . 2]" 3
394 1 75 ILE MD 1 76 GLU H . . 5.220 4.934 4.717 5.049 . 0 0 "[ . 1 . 2]" 3
395 1 69 VAL HA 1 72 VAL H . . 4.270 3.331 3.144 3.534 . 0 0 "[ . 1 . 2]" 3
396 1 72 VAL H 1 72 VAL HB . . 3.170 2.594 2.534 2.646 . 0 0 "[ . 1 . 2]" 3
397 1 72 VAL H 1 75 ILE HB . . 4.760 4.699 4.502 4.776 0.016 7 0 "[ . 1 . 2]" 3
398 1 72 VAL H 1 75 ILE MG . . 4.480 4.247 4.017 4.470 . 0 0 "[ . 1 . 2]" 3
399 1 64 LYS H 1 65 GLN H . . 3.710 2.889 2.757 2.990 . 0 0 "[ . 1 . 2]" 3
400 1 64 LYS H 1 89 TYR QE . . 4.810 4.732 4.396 4.819 0.009 16 0 "[ . 1 . 2]" 3
401 1 64 LYS H 1 66 ILE H . . 4.930 4.847 4.662 4.946 0.016 16 0 "[ . 1 . 2]" 3
402 1 63 THR HA 1 64 LYS H . . 2.930 2.370 2.313 2.488 . 0 0 "[ . 1 . 2]" 3
403 1 64 LYS H 1 65 GLN HG2 . . 4.900 3.954 3.762 4.154 . 0 0 "[ . 1 . 2]" 3
404 1 64 LYS H 1 65 GLN HB2 . . 5.500 5.149 5.036 5.313 . 0 0 "[ . 1 . 2]" 3
405 1 64 LYS H 1 64 LYS HG2 . . 3.960 3.031 2.536 3.226 . 0 0 "[ . 1 . 2]" 3
406 1 64 LYS H 1 64 LYS HG3 . . 3.960 3.224 3.100 4.007 0.047 17 0 "[ . 1 . 2]" 3
407 1 64 LYS H 1 94 ALA MB . . 4.350 2.615 1.749 3.673 . 0 0 "[ . 1 . 2]" 3
408 1 25 THR H 1 54 ASN HA . . 4.540 3.894 3.649 4.147 . 0 0 "[ . 1 . 2]" 3
409 1 23 CYS HA 1 25 THR H . . 4.350 4.126 4.060 4.278 . 0 0 "[ . 1 . 2]" 3
410 1 23 CYS HB3 1 25 THR H . . 4.840 4.208 4.002 4.479 . 0 0 "[ . 1 . 2]" 3
411 1 25 THR H 1 58 CYS HB3 . . 4.630 4.164 4.114 4.236 . 0 0 "[ . 1 . 2]" 3
412 1 24 LYS QB 1 25 THR H . . 3.850 2.853 2.601 3.424 . 0 0 "[ . 1 . 2]" 3
413 1 24 LYS HG2 1 25 THR H . . 5.330 4.293 3.804 4.476 . 0 0 "[ . 1 . 2]" 3
414 1 24 LYS HG3 1 25 THR H . . 5.330 4.617 2.097 5.005 . 0 0 "[ . 1 . 2]" 3
415 1 25 THR H 1 25 THR MG . . 3.920 3.702 3.683 3.734 . 0 0 "[ . 1 . 2]" 3
416 1 25 THR H 1 25 THR HB . . 3.310 2.323 2.290 2.385 . 0 0 "[ . 1 . 2]" 3
417 1 25 THR H 1 58 CYS HB2 . . 5.150 4.882 4.830 4.978 . 0 0 "[ . 1 . 2]" 3
418 1 25 THR H 1 54 ASN HB3 . . 4.890 3.369 3.156 3.533 . 0 0 "[ . 1 . 2]" 3
419 1 21 SER H 1 21 SER QB . . 3.610 2.370 2.147 2.627 . 0 0 "[ . 1 . 2]" 3
420 1 21 SER H 1 30 ILE HB . . 5.500 4.594 4.483 4.789 . 0 0 "[ . 1 . 2]" 3
421 1 21 SER H 1 30 ILE H . . 4.830 4.723 4.615 4.832 0.002 18 0 "[ . 1 . 2]" 3
422 1 20 ARG H 1 21 SER H . . 4.050 2.303 2.236 2.396 . 0 0 "[ . 1 . 2]" 3
423 1 19 SER HA 1 21 SER H . . 4.710 3.905 3.758 4.068 . 0 0 "[ . 1 . 2]" 3
424 1 87 ARG H 1 88 LYS H . . 2.990 2.782 2.755 2.801 . 0 0 "[ . 1 . 2]" 3
425 1 88 LYS H 1 89 TYR H . . 3.050 2.655 2.633 2.667 . 0 0 "[ . 1 . 2]" 3
426 1 84 GLN HA 1 88 LYS H . . 4.030 3.541 3.450 3.670 . 0 0 "[ . 1 . 2]" 3
427 1 86 ILE HA 1 88 LYS H . . 4.720 4.459 4.378 4.514 . 0 0 "[ . 1 . 2]" 3
428 1 88 LYS H 1 89 TYR HB3 . . 4.740 4.503 4.456 4.578 . 0 0 "[ . 1 . 2]" 3
429 1 88 LYS H 1 89 TYR HB2 . . 5.280 5.043 4.993 5.119 . 0 0 "[ . 1 . 2]" 3
430 1 86 ILE HB 1 88 LYS H . . 4.700 4.552 4.513 4.590 . 0 0 "[ . 1 . 2]" 3
431 1 88 LYS H 1 88 LYS QB . . 2.630 2.512 2.473 2.550 . 0 0 "[ . 1 . 2]" 3
432 1 87 ARG HB2 1 88 LYS H . . 3.830 3.611 3.520 3.826 . 0 0 "[ . 1 . 2]" 3
433 1 87 ARG HG2 1 88 LYS H . . 3.200 2.200 1.982 2.310 . 0 0 "[ . 1 . 2]" 3
434 1 88 LYS H 1 88 LYS HG2 . . 3.490 2.144 2.065 2.225 . 0 0 "[ . 1 . 2]" 3
435 1 88 LYS H 1 90 VAL MG2 . . 4.650 4.246 4.169 4.321 . 0 0 "[ . 1 . 2]" 3
436 1 86 ILE MG 1 88 LYS H . . 5.080 4.989 4.878 5.071 . 0 0 "[ . 1 . 2]" 3
437 1 86 ILE H 1 88 LYS H . . 4.180 3.736 3.659 3.804 . 0 0 "[ . 1 . 2]" 3
438 1 33 GLU H 1 34 ASN H . . 3.510 2.490 2.454 2.554 . 0 0 "[ . 1 . 2]" 3
439 1 34 ASN H 1 34 ASN HD21 . . 4.590 3.897 3.259 4.409 . 0 0 "[ . 1 . 2]" 3
440 1 32 LYS HA 1 34 ASN H . . 3.740 3.245 3.219 3.311 . 0 0 "[ . 1 . 2]" 3
441 1 34 ASN H 1 34 ASN HB2 . . 3.110 2.504 2.478 2.553 . 0 0 "[ . 1 . 2]" 3
442 1 15 TYR HB3 1 34 ASN H . . 4.020 3.476 3.319 3.666 . 0 0 "[ . 1 . 2]" 3
443 1 33 GLU HB3 1 34 ASN H . . 4.940 4.547 4.545 4.552 . 0 0 "[ . 1 . 2]" 3
444 1 33 GLU HG2 1 34 ASN H . . 5.260 4.740 4.727 4.756 . 0 0 "[ . 1 . 2]" 3
445 1 16 ALA MB 1 34 ASN H . . 3.300 2.800 2.499 3.234 . 0 0 "[ . 1 . 2]" 3
446 1 30 ILE MG 1 34 ASN H . . 4.460 4.348 4.240 4.420 . 0 0 "[ . 1 . 2]" 3
447 1 69 VAL HA 1 71 ASP H . . 4.210 3.844 3.607 4.007 . 0 0 "[ . 1 . 2]" 3
448 1 71 ASP H 1 71 ASP HB2 . . 3.720 2.663 2.176 3.655 . 0 0 "[ . 1 . 2]" 3
449 1 71 ASP H 1 71 ASP HB3 . . 3.720 3.213 2.309 3.571 . 0 0 "[ . 1 . 2]" 3
450 1 66 ILE MG 1 71 ASP H . . 4.430 3.967 3.754 4.091 . 0 0 "[ . 1 . 2]" 3
451 1 25 THR HB 1 59 ILE H . . 5.500 5.439 5.172 5.508 0.008 3 0 "[ . 1 . 2]" 3
452 1 55 HIS HB3 1 59 ILE H . . 5.410 5.344 5.255 5.390 . 0 0 "[ . 1 . 2]" 3
453 1 56 ALA HA 1 59 ILE H . . 3.830 3.762 3.678 3.824 . 0 0 "[ . 1 . 2]" 3
454 1 58 CYS HB2 1 59 ILE H . . 3.690 3.038 2.930 3.105 . 0 0 "[ . 1 . 2]" 3
455 1 58 CYS HB3 1 59 ILE H . . 4.000 3.734 3.651 3.792 . 0 0 "[ . 1 . 2]" 3
456 1 54 ASN HB2 1 59 ILE H . . 4.980 4.555 4.360 4.717 . 0 0 "[ . 1 . 2]" 3
457 1 54 ASN HB3 1 59 ILE H . . 4.530 4.494 4.355 4.534 0.004 3 0 "[ . 1 . 2]" 3
458 1 59 ILE H 1 59 ILE HB . . 3.060 2.512 2.480 2.562 . 0 0 "[ . 1 . 2]" 3
459 1 59 ILE H 1 59 ILE HG12 . . 3.330 2.393 2.213 2.468 . 0 0 "[ . 1 . 2]" 3
460 1 59 ILE H 1 60 LEU QB . . 4.490 4.291 4.225 4.433 . 0 0 "[ . 1 . 2]" 3
461 1 59 ILE H 1 60 LEU HG . . 4.300 4.263 4.187 4.305 0.005 10 0 "[ . 1 . 2]" 3
462 1 59 ILE H 1 59 ILE HG13 . . 3.680 3.686 3.655 3.715 0.035 1 0 "[ . 1 . 2]" 3
463 1 59 ILE H 1 59 ILE MD . . 3.750 3.651 3.274 3.758 0.008 3 0 "[ . 1 . 2]" 3
464 1 59 ILE H 1 60 LEU MD1 . . 5.040 4.964 4.885 5.044 0.004 7 0 "[ . 1 . 2]" 3
465 1 37 LEU MD1 1 59 ILE H . . 4.110 3.935 3.683 4.100 . 0 0 "[ . 1 . 2]" 3
466 1 56 ALA MB 1 59 ILE H . . 5.140 4.854 4.768 4.945 . 0 0 "[ . 1 . 2]" 3
467 1 59 ILE H 1 60 LEU MD2 . . 5.390 5.323 5.252 5.388 . 0 0 "[ . 1 . 2]" 3
468 1 86 ILE H 1 89 TYR H . . 5.000 4.842 4.748 4.920 . 0 0 "[ . 1 . 2]" 3
469 1 85 LYS H 1 86 ILE H . . 3.180 2.689 2.631 2.735 . 0 0 "[ . 1 . 2]" 3
470 1 35 PHE HZ 1 86 ILE H . . 5.500 5.318 5.131 5.420 . 0 0 "[ . 1 . 2]" 3
471 1 82 ASP HA 1 86 ILE H . . 5.260 4.954 4.874 5.032 . 0 0 "[ . 1 . 2]" 3
472 1 84 GLN HA 1 86 ILE H . . 3.930 3.852 3.735 3.932 0.002 14 0 "[ . 1 . 2]" 3
473 1 86 ILE H 1 86 ILE HB . . 2.920 2.692 2.624 2.735 . 0 0 "[ . 1 . 2]" 3
474 1 85 LYS HB3 1 86 ILE H . . 4.020 3.910 3.843 3.999 . 0 0 "[ . 1 . 2]" 3
475 1 86 ILE H 1 86 ILE HG13 . . 3.550 3.445 3.375 3.552 0.002 14 0 "[ . 1 . 2]" 3
476 1 86 ILE H 1 87 ARG HG2 . . 4.310 3.574 3.416 3.904 . 0 0 "[ . 1 . 2]" 3
477 1 86 ILE H 1 86 ILE HG12 . . 3.410 1.921 1.894 2.001 . 0 0 "[ . 1 . 2]" 3
478 1 75 ILE MD 1 86 ILE H . . 4.310 4.199 4.011 4.346 0.036 11 0 "[ . 1 . 2]" 3
479 1 86 ILE H 1 86 ILE MD . . 3.480 3.182 2.946 3.298 . 0 0 "[ . 1 . 2]" 3
480 1 15 TYR HB3 1 33 GLU H . . 4.730 3.385 3.212 3.519 . 0 0 "[ . 1 . 2]" 3
481 1 33 GLU H 1 33 GLU HG2 . . 4.060 2.844 2.755 2.890 . 0 0 "[ . 1 . 2]" 3
482 1 32 LYS HB3 1 33 GLU H . . 4.580 3.941 3.898 3.998 . 0 0 "[ . 1 . 2]" 3
483 1 32 LYS HB2 1 33 GLU H . . 4.410 2.573 2.505 2.663 . 0 0 "[ . 1 . 2]" 3
484 1 25 THR H 1 27 LYS H . . 4.080 3.528 3.465 3.626 . 0 0 "[ . 1 . 2]" 3
485 1 23 CYS HA 1 27 LYS H . . 5.150 4.839 4.750 4.904 . 0 0 "[ . 1 . 2]" 3
486 1 27 LYS H 1 27 LYS HA . . 2.560 2.277 2.274 2.279 . 0 0 "[ . 1 . 2]" 3
487 1 23 CYS HB3 1 27 LYS H . . 3.610 3.022 2.819 3.138 . 0 0 "[ . 1 . 2]" 3
488 1 26 CYS HB2 1 27 LYS H . . 4.510 4.184 4.123 4.255 . 0 0 "[ . 1 . 2]" 3
489 1 26 CYS HB3 1 27 LYS H . . 4.510 4.137 4.083 4.257 . 0 0 "[ . 1 . 2]" 3
490 1 27 LYS H 1 27 LYS HB2 . . 4.080 3.662 3.537 3.746 . 0 0 "[ . 1 . 2]" 3
491 1 23 CYS HB2 1 27 LYS H . . 4.850 4.638 4.497 4.793 . 0 0 "[ . 1 . 2]" 3
492 1 27 LYS H 1 27 LYS HB3 . . 4.080 4.057 4.038 4.072 . 0 0 "[ . 1 . 2]" 3
493 1 27 LYS H 1 27 LYS QD . . 3.700 2.966 2.671 3.278 . 0 0 "[ . 1 . 2]" 3
494 1 70 ASP H 1 71 ASP H . . 3.220 2.590 2.492 2.688 . 0 0 "[ . 1 . 2]" 3
495 1 68 SER HA 1 70 ASP H . . 4.200 3.982 3.854 4.140 . 0 0 "[ . 1 . 2]" 3
496 1 70 ASP H 1 70 ASP HB2 . . 3.490 2.562 2.184 3.517 0.027 18 0 "[ . 1 . 2]" 3
497 1 70 ASP H 1 70 ASP HB3 . . 3.490 2.674 2.210 3.499 0.009 6 0 "[ . 1 . 2]" 3
498 1 69 VAL HB 1 70 ASP H . . 3.970 3.872 3.636 3.985 0.015 2 0 "[ . 1 . 2]" 3
499 1 70 ASP H 1 90 VAL MG1 . . 5.170 4.806 4.458 5.084 . 0 0 "[ . 1 . 2]" 3
500 1 70 ASP H 1 90 VAL MG2 . . 5.480 4.530 4.419 4.728 . 0 0 "[ . 1 . 2]" 3
501 1 20 ARG H 1 20 ARG HB2 . . 4.180 2.349 2.270 2.417 . 0 0 "[ . 1 . 2]" 3
502 1 20 ARG H 1 20 ARG HB3 . . 4.180 3.592 3.548 3.628 . 0 0 "[ . 1 . 2]" 3
503 1 20 ARG H 1 20 ARG HG3 . . 4.460 3.441 2.682 3.961 . 0 0 "[ . 1 . 2]" 3
504 1 27 LYS H 1 28 SER H . . 3.090 2.636 2.552 2.734 . 0 0 "[ . 1 . 2]" 3
505 1 28 SER H 1 55 HIS HE1 . . 3.820 3.424 3.289 3.591 . 0 0 "[ . 1 . 2]" 3
506 1 23 CYS HA 1 28 SER H . . 4.700 4.610 4.531 4.693 . 0 0 "[ . 1 . 2]" 3
507 1 28 SER H 1 28 SER HB2 . . 2.980 2.771 2.718 2.804 . 0 0 "[ . 1 . 2]" 3
508 1 23 CYS HB3 1 28 SER H . . 3.340 2.088 1.992 2.160 . 0 0 "[ . 1 . 2]" 3
509 1 26 CYS HB2 1 28 SER H . . 4.890 4.420 4.221 4.572 . 0 0 "[ . 1 . 2]" 3
510 1 27 LYS HB2 1 28 SER H . . 4.620 4.245 4.178 4.295 . 0 0 "[ . 1 . 2]" 3
511 1 23 CYS HB2 1 28 SER H . . 3.780 3.708 3.584 3.786 0.006 15 0 "[ . 1 . 2]" 3
512 1 27 LYS HB3 1 28 SER H . . 4.620 4.476 4.434 4.511 . 0 0 "[ . 1 . 2]" 3
513 1 27 LYS QD 1 28 SER H . . 5.000 4.660 4.527 4.810 . 0 0 "[ . 1 . 2]" 3
514 1 82 ASP H 1 84 GLN H . . 4.020 3.909 3.858 3.980 . 0 0 "[ . 1 . 2]" 3
515 1 84 GLN H 1 84 GLN HE21 . . 5.130 4.477 3.870 5.136 0.006 14 0 "[ . 1 . 2]" 3
516 1 82 ASP HA 1 84 GLN H . . 4.480 4.022 3.933 4.121 . 0 0 "[ . 1 . 2]" 3
517 1 84 GLN H 1 85 LYS HA . . 5.390 5.179 5.116 5.237 . 0 0 "[ . 1 . 2]" 3
518 1 83 GLN HG2 1 84 GLN H . . 4.860 4.858 4.840 4.870 0.010 16 0 "[ . 1 . 2]" 3
519 1 83 GLN HG3 1 84 GLN H . . 4.380 4.323 4.242 4.382 0.002 3 0 "[ . 1 . 2]" 3
520 1 83 GLN HB2 1 84 GLN H . . 3.140 2.870 2.784 2.956 . 0 0 "[ . 1 . 2]" 3
521 1 84 GLN H 1 85 LYS HG3 . . 4.800 4.160 4.025 4.284 . 0 0 "[ . 1 . 2]" 3
522 1 84 GLN H 1 84 GLN HB3 . . 3.740 3.597 3.592 3.606 . 0 0 "[ . 1 . 2]" 3
523 1 84 GLN H 1 84 GLN HB2 . . 2.940 2.493 2.450 2.567 . 0 0 "[ . 1 . 2]" 3
524 1 84 GLN H 1 84 GLN HG3 . . 3.570 3.319 3.242 3.379 . 0 0 "[ . 1 . 2]" 3
525 1 84 GLN H 1 84 GLN HG2 . . 3.110 2.269 2.098 2.374 . 0 0 "[ . 1 . 2]" 3
526 1 65 GLN HG3 1 66 ILE H . . 4.700 4.562 4.482 4.655 . 0 0 "[ . 1 . 2]" 3
527 1 66 ILE H 1 94 ALA MB . . 4.630 4.195 2.528 4.611 . 0 0 "[ . 1 . 2]" 3
528 1 66 ILE H 1 90 VAL MG1 . . 4.570 4.084 3.884 4.411 . 0 0 "[ . 1 . 2]" 3
529 1 66 ILE H 1 67 LYS H . . 4.580 4.439 4.369 4.486 . 0 0 "[ . 1 . 2]" 3
530 1 65 GLN H 1 66 ILE H . . 3.160 2.259 2.170 2.423 . 0 0 "[ . 1 . 2]" 3
531 1 66 ILE H 1 89 TYR QD . . 4.460 4.320 4.091 4.461 0.001 17 0 "[ . 1 . 2]" 3
532 1 66 ILE H 1 89 TYR QE . . 2.990 2.067 1.897 2.249 . 0 0 "[ . 1 . 2]" 3
533 1 66 ILE H 1 67 LYS HA . . 5.100 4.924 4.846 4.990 . 0 0 "[ . 1 . 2]" 3
534 1 65 GLN HB3 1 66 ILE H . . 3.890 3.509 3.382 3.681 . 0 0 "[ . 1 . 2]" 3
535 1 65 GLN HG2 1 66 ILE H . . 4.260 4.043 3.838 4.233 . 0 0 "[ . 1 . 2]" 3
536 1 65 GLN HB2 1 66 ILE H . . 3.620 2.314 2.206 2.385 . 0 0 "[ . 1 . 2]" 3
537 1 66 ILE H 1 66 ILE HB . . 3.270 2.694 2.607 2.804 . 0 0 "[ . 1 . 2]" 3
538 1 66 ILE H 1 66 ILE MG . . 3.980 3.873 3.836 3.921 . 0 0 "[ . 1 . 2]" 3
539 1 66 ILE H 1 66 ILE HG13 . . 3.600 2.758 2.521 2.872 . 0 0 "[ . 1 . 2]" 3
540 1 59 ILE MG 1 66 ILE H . . 4.770 4.465 4.163 4.633 . 0 0 "[ . 1 . 2]" 3
541 1 66 ILE H 1 66 ILE MD . . 4.180 3.964 3.801 4.053 . 0 0 "[ . 1 . 2]" 3
542 1 66 ILE H 1 66 ILE HG12 . . 4.090 3.952 3.818 4.040 . 0 0 "[ . 1 . 2]" 3
543 1 62 LYS HB3 1 65 GLN HE21 . . 4.560 2.440 1.911 4.009 . 0 0 "[ . 1 . 2]" 3
544 1 62 LYS QD 1 65 GLN HE21 . . 4.770 3.172 2.626 4.597 . 0 0 "[ . 1 . 2]" 3
545 1 62 LYS HB3 1 65 GLN HE22 . . 4.560 3.264 2.661 4.158 . 0 0 "[ . 1 . 2]" 3
546 1 62 LYS QD 1 65 GLN HE22 . . 4.770 2.824 2.280 4.279 . 0 0 "[ . 1 . 2]" 3
547 1 37 LEU H 1 38 GLY H . . 4.550 4.320 4.254 4.422 . 0 0 "[ . 1 . 2]" 3
548 1 11 TRP HE3 1 38 GLY H . . 4.330 3.585 3.302 4.013 . 0 0 "[ . 1 . 2]" 3
549 1 38 GLY H 1 53 TRP HZ3 . . 3.580 3.417 3.201 3.573 . 0 0 "[ . 1 . 2]" 3
550 1 38 GLY H 1 53 TRP HH2 . . 5.450 5.244 4.955 5.422 . 0 0 "[ . 1 . 2]" 3
551 1 37 LEU HA 1 38 GLY H . . 2.970 2.184 2.158 2.229 . 0 0 "[ . 1 . 2]" 3
552 1 37 LEU HB3 1 38 GLY H . . 3.910 3.120 2.927 3.264 . 0 0 "[ . 1 . 2]" 3
553 1 37 LEU HB2 1 38 GLY H . . 4.510 4.191 4.090 4.305 . 0 0 "[ . 1 . 2]" 3
554 1 37 LEU MD2 1 38 GLY H . . 3.810 3.248 2.965 3.406 . 0 0 "[ . 1 . 2]" 3
555 1 37 LEU MD1 1 38 GLY H . . 5.170 4.910 4.714 5.096 . 0 0 "[ . 1 . 2]" 3
556 1 81 GLU H 1 84 GLN H . . 4.890 4.870 4.819 4.908 0.018 16 0 "[ . 1 . 2]" 3
557 1 81 GLU H 1 83 GLN H . . 4.570 4.541 4.464 4.584 0.014 18 0 "[ . 1 . 2]" 3
558 1 80 TRP HE3 1 81 GLU H . . 3.780 2.826 2.638 2.914 . 0 0 "[ . 1 . 2]" 3
559 1 80 TRP HD1 1 81 GLU H . . 4.970 4.967 4.931 4.982 0.012 16 0 "[ . 1 . 2]" 3
560 1 81 GLU H 1 82 ASP H . . 3.220 2.847 2.812 2.890 . 0 0 "[ . 1 . 2]" 3
561 1 79 ARG HA 1 81 GLU H . . 4.770 4.589 4.485 4.686 . 0 0 "[ . 1 . 2]" 3
562 1 80 TRP HB2 1 81 GLU H . . 3.990 3.817 3.748 3.879 . 0 0 "[ . 1 . 2]" 3
563 1 80 TRP HB3 1 81 GLU H . . 3.290 2.398 2.289 2.501 . 0 0 "[ . 1 . 2]" 3
564 1 81 GLU H 1 81 GLU QG . . 3.190 2.663 2.545 2.760 . 0 0 "[ . 1 . 2]" 3
565 1 79 ARG HB3 1 81 GLU H . . 3.800 3.079 2.939 3.184 . 0 0 "[ . 1 . 2]" 3
566 1 81 GLU H 1 81 GLU QB . . 2.920 2.231 2.194 2.274 . 0 0 "[ . 1 . 2]" 3
567 1 79 ARG HB2 1 81 GLU H . . 4.420 4.261 4.061 4.424 0.004 1 0 "[ . 1 . 2]" 3
568 1 11 TRP H 1 73 GLU H . . 4.230 4.172 3.961 4.242 0.012 20 0 "[ . 1 . 2]" 3
569 1 11 TRP H 1 11 TRP HD1 . . 3.800 3.037 2.781 3.208 . 0 0 "[ . 1 . 2]" 3
570 1 59 ILE H 1 60 LEU H . . 2.960 2.435 2.332 2.540 . 0 0 "[ . 1 . 2]" 3
571 1 9 LYS HA 1 11 TRP H . . 4.460 4.206 3.919 4.432 . 0 0 "[ . 1 . 2]" 3
572 1 11 TRP H 1 72 VAL HA . . 4.020 3.370 3.255 3.471 . 0 0 "[ . 1 . 2]" 3
573 1 10 PRO HD2 1 11 TRP H . . 3.750 2.675 2.647 2.773 . 0 0 "[ . 1 . 2]" 3
574 1 57 SER HA 1 60 LEU H . . 3.930 3.598 3.449 3.734 . 0 0 "[ . 1 . 2]" 3
575 1 56 ALA HA 1 60 LEU H . . 4.490 4.130 3.922 4.310 . 0 0 "[ . 1 . 2]" 3
576 1 11 TRP H 1 11 TRP HB2 . . 3.230 2.505 2.407 2.577 . 0 0 "[ . 1 . 2]" 3
577 1 11 TRP H 1 11 TRP HB3 . . 3.760 3.698 3.635 3.742 . 0 0 "[ . 1 . 2]" 3
578 1 10 PRO HG3 1 11 TRP H . . 3.930 3.729 3.520 3.898 . 0 0 "[ . 1 . 2]" 3
579 1 10 PRO HG2 1 11 TRP H . . 3.930 2.166 1.889 2.392 . 0 0 "[ . 1 . 2]" 3
580 1 9 LYS QB 1 11 TRP H . . 3.580 2.843 2.565 3.344 . 0 0 "[ . 1 . 2]" 3
581 1 59 ILE HB 1 60 LEU H . . 3.710 2.373 2.292 2.551 . 0 0 "[ . 1 . 2]" 3
582 1 60 LEU H 1 60 LEU QB . . 3.000 2.440 2.399 2.491 . 0 0 "[ . 1 . 2]" 3
583 1 60 LEU H 1 60 LEU HG . . 2.950 2.244 2.148 2.318 . 0 0 "[ . 1 . 2]" 3
584 1 11 TRP H 1 72 VAL MG2 . . 4.400 4.312 4.156 4.404 0.004 3 0 "[ . 1 . 2]" 3
585 1 60 LEU H 1 60 LEU MD1 . . 3.540 3.532 3.485 3.553 0.013 8 0 "[ . 1 . 2]" 3
586 1 37 LEU MD1 1 60 LEU H . . 4.010 3.472 3.229 3.807 . 0 0 "[ . 1 . 2]" 3
587 1 56 ALA MB 1 60 LEU H . . 4.940 4.741 4.587 4.912 . 0 0 "[ . 1 . 2]" 3
588 1 60 LEU H 1 60 LEU MD2 . . 3.600 3.374 3.242 3.462 . 0 0 "[ . 1 . 2]" 3
589 1 11 TRP HZ3 1 54 ASN HD22 . . 5.500 4.658 4.110 5.256 . 0 0 "[ . 1 . 2]" 3
590 1 54 ASN HD22 1 59 ILE MD . . 4.250 3.157 2.873 3.407 . 0 0 "[ . 1 . 2]" 3
591 1 60 LEU H 1 61 LYS H . . 2.890 2.769 2.691 2.814 . 0 0 "[ . 1 . 2]" 3
592 1 61 LYS H 1 61 LYS HA . . 2.930 2.822 2.794 2.846 . 0 0 "[ . 1 . 2]" 3
593 1 58 CYS HA 1 61 LYS H . . 4.110 4.043 3.949 4.110 . 0 0 "[ . 1 . 2]" 3
594 1 57 SER HA 1 61 LYS H . . 4.620 3.899 3.717 4.030 . 0 0 "[ . 1 . 2]" 3
595 1 60 LEU HA 1 61 LYS H . . 3.520 3.505 3.486 3.538 0.018 20 0 "[ . 1 . 2]" 3
596 1 61 LYS H 1 61 LYS HB2 . . 3.780 3.584 3.569 3.596 . 0 0 "[ . 1 . 2]" 3
597 1 61 LYS H 1 61 LYS HB3 . . 2.820 2.472 2.367 2.671 . 0 0 "[ . 1 . 2]" 3
598 1 61 LYS H 1 61 LYS HG2 . . 3.300 2.669 2.420 3.236 . 0 0 "[ . 1 . 2]" 3
599 1 61 LYS H 1 61 LYS HG3 . . 3.300 2.876 1.896 3.195 . 0 0 "[ . 1 . 2]" 3
600 1 60 LEU QB 1 61 LYS H . . 3.520 2.700 2.533 2.786 . 0 0 "[ . 1 . 2]" 3
601 1 60 LEU HG 1 61 LYS H . . 4.490 4.463 4.354 4.507 0.017 1 0 "[ . 1 . 2]" 3
602 1 60 LEU MD1 1 61 LYS H . . 4.780 4.626 4.490 4.706 . 0 0 "[ . 1 . 2]" 3
603 1 59 ILE MG 1 61 LYS H . . 4.790 4.718 4.619 4.823 0.033 20 0 "[ . 1 . 2]" 3
604 1 60 LEU MD2 1 61 LYS H . . 4.880 4.750 4.697 4.786 . 0 0 "[ . 1 . 2]" 3
605 1 14 GLU H 1 35 PHE QD . . 4.210 3.474 3.245 3.769 . 0 0 "[ . 1 . 2]" 3
606 1 14 GLU H 1 14 GLU HG3 . . 4.040 3.595 3.432 3.708 . 0 0 "[ . 1 . 2]" 3
607 1 13 ALA MB 1 14 GLU H . . 3.520 3.212 3.107 3.337 . 0 0 "[ . 1 . 2]" 3
608 1 14 GLU H 1 37 LEU MD2 . . 4.260 4.140 3.924 4.268 0.008 18 0 "[ . 1 . 2]" 3
609 1 14 GLU H 1 35 PHE QE . . 4.210 3.880 3.631 4.166 . 0 0 "[ . 1 . 2]" 3
610 1 76 GLU H 1 77 SER H . . 2.930 2.511 2.428 2.643 . 0 0 "[ . 1 . 2]" 3
611 1 76 GLU HA 1 77 SER H . . 3.550 3.367 3.313 3.426 . 0 0 "[ . 1 . 2]" 3
612 1 77 SER H 1 77 SER HB3 . . 3.100 2.535 2.355 2.828 . 0 0 "[ . 1 . 2]" 3
613 1 75 ILE HA 1 77 SER H . . 3.960 3.642 3.505 3.809 . 0 0 "[ . 1 . 2]" 3
614 1 76 GLU HG2 1 77 SER H . . 4.070 3.613 3.393 3.803 . 0 0 "[ . 1 . 2]" 3
615 1 76 GLU HG3 1 77 SER H . . 3.620 2.693 2.412 2.878 . 0 0 "[ . 1 . 2]" 3
616 1 76 GLU HB2 1 77 SER H . . 4.380 4.159 4.042 4.273 . 0 0 "[ . 1 . 2]" 3
617 1 76 GLU HB3 1 77 SER H . . 4.280 4.247 4.150 4.295 0.015 17 0 "[ . 1 . 2]" 3
618 1 77 SER H 1 78 LEU HB2 . . 4.880 4.770 4.663 4.867 . 0 0 "[ . 1 . 2]" 3
619 1 77 SER H 1 78 LEU HG . . 3.710 3.344 3.169 3.617 . 0 0 "[ . 1 . 2]" 3
620 1 13 ALA MB 1 77 SER H . . 4.470 4.354 4.211 4.482 0.012 3 0 "[ . 1 . 2]" 3
621 1 77 SER H 1 78 LEU MD1 . . 4.990 4.684 4.456 4.918 . 0 0 "[ . 1 . 2]" 3
622 1 77 SER H 1 78 LEU MD2 . . 4.320 4.026 3.890 4.299 . 0 0 "[ . 1 . 2]" 3
623 1 54 ASN H 1 54 ASN HD22 . . 4.520 4.415 4.287 4.511 . 0 0 "[ . 1 . 2]" 3
624 1 73 GLU QG 1 74 GLY H . . 4.200 2.041 1.880 2.390 . 0 0 "[ . 1 . 2]" 3
625 1 73 GLU HB3 1 74 GLY H . . 4.850 3.623 3.225 4.034 . 0 0 "[ . 1 . 2]" 3
626 1 73 GLU HB2 1 74 GLY H . . 4.700 3.938 3.826 4.047 . 0 0 "[ . 1 . 2]" 3
627 1 65 GLN H 1 89 TYR QE . . 4.000 3.481 3.174 3.609 . 0 0 "[ . 1 . 2]" 3
628 1 65 GLN H 1 65 GLN HB3 . . 3.880 3.726 3.665 3.763 . 0 0 "[ . 1 . 2]" 3
629 1 65 GLN H 1 65 GLN HG2 . . 3.510 2.568 2.424 2.673 . 0 0 "[ . 1 . 2]" 3
630 1 65 GLN H 1 65 GLN HB2 . . 3.650 2.618 2.481 2.737 . 0 0 "[ . 1 . 2]" 3
631 1 53 TRP HE3 1 54 ASN H . . 3.760 3.083 2.917 3.351 . 0 0 "[ . 1 . 2]" 3
632 1 54 ASN H 1 54 ASN HD21 . . 4.090 3.515 3.252 3.859 . 0 0 "[ . 1 . 2]" 3
633 1 36 ARG HA 1 54 ASN H . . 5.290 5.078 4.969 5.178 . 0 0 "[ . 1 . 2]" 3
634 1 53 TRP HA 1 54 ASN H . . 3.350 2.147 2.141 2.160 . 0 0 "[ . 1 . 2]" 3
635 1 53 TRP HB2 1 54 ASN H . . 4.660 4.333 4.235 4.471 . 0 0 "[ . 1 . 2]" 3
636 1 53 TRP HB3 1 54 ASN H . . 4.180 3.423 3.252 3.717 . 0 0 "[ . 1 . 2]" 3
637 1 54 ASN H 1 54 ASN HB2 . . 3.980 2.972 2.808 3.077 . 0 0 "[ . 1 . 2]" 3
638 1 54 ASN H 1 54 ASN HB3 . . 4.060 3.948 3.867 3.999 . 0 0 "[ . 1 . 2]" 3
639 1 38 GLY HA3 1 54 ASN H . . 4.810 4.789 4.571 4.856 0.046 17 0 "[ . 1 . 2]" 3
640 1 37 LEU HB3 1 54 ASN H . . 5.500 4.918 4.771 5.057 . 0 0 "[ . 1 . 2]" 3
641 1 54 ASN H 1 59 ILE HG12 . . 5.500 4.910 4.737 5.034 . 0 0 "[ . 1 . 2]" 3
642 1 89 TYR H 1 92 SER H . . 4.970 4.322 4.172 4.479 . 0 0 "[ . 1 . 2]" 3
643 1 89 TYR HA 1 92 SER H . . 3.920 3.828 3.685 3.926 0.006 18 0 "[ . 1 . 2]" 3
644 1 88 LYS HA 1 92 SER H . . 4.020 3.819 3.524 4.027 0.007 19 0 "[ . 1 . 2]" 3
645 1 92 SER H 1 92 SER QB . . 2.880 2.297 2.169 2.407 . 0 0 "[ . 1 . 2]" 3
646 1 90 VAL HA 1 92 SER H . . 4.950 4.833 4.596 4.959 0.009 11 0 "[ . 1 . 2]" 3
647 1 91 GLU HG2 1 92 SER H . . 4.530 4.311 4.216 4.424 . 0 0 "[ . 1 . 2]" 3
648 1 91 GLU HG3 1 92 SER H . . 4.790 4.620 4.507 4.784 . 0 0 "[ . 1 . 2]" 3
649 1 91 GLU QB 1 92 SER H . . 3.130 2.374 2.306 2.527 . 0 0 "[ . 1 . 2]" 3
650 1 88 LYS QB 1 92 SER H . . 5.130 5.053 4.816 5.149 0.019 5 0 "[ . 1 . 2]" 3
651 1 90 VAL MG2 1 92 SER H . . 4.640 4.366 4.220 4.473 . 0 0 "[ . 1 . 2]" 3
652 1 18 SER H 1 32 LYS HA . . 4.750 3.528 2.635 4.051 . 0 0 "[ . 1 . 2]" 3
653 1 16 ALA MB 1 18 SER H . . 3.770 2.754 2.498 3.121 . 0 0 "[ . 1 . 2]" 3
654 1 17 LYS HB2 1 18 SER H . . 4.920 3.270 2.738 4.122 . 0 0 "[ . 1 . 2]" 3
655 1 17 LYS HB3 1 18 SER H . . 4.920 4.004 3.626 4.465 . 0 0 "[ . 1 . 2]" 3
656 1 84 GLN HA 1 84 GLN HE21 . . 4.730 3.587 2.466 4.165 . 0 0 "[ . 1 . 2]" 3
657 1 84 GLN HB3 1 84 GLN HE21 . . 4.620 3.281 2.051 4.183 . 0 0 "[ . 1 . 2]" 3
658 1 84 GLN HB2 1 84 GLN HE21 . . 4.620 4.004 3.271 4.551 . 0 0 "[ . 1 . 2]" 3
659 1 78 LEU H 1 83 GLN HE22 . . 4.670 4.573 4.406 4.687 0.017 12 0 "[ . 1 . 2]" 3
660 1 83 GLN HE22 1 83 GLN HG3 . . 4.070 3.448 3.442 3.457 . 0 0 "[ . 1 . 2]" 3
661 1 92 SER H 1 93 GLY H . . 4.650 3.878 2.121 4.599 . 0 0 "[ . 1 . 2]" 3
662 1 92 SER QB 1 93 GLY H . . 3.930 2.671 1.923 3.257 . 0 0 "[ . 1 . 2]" 3
663 1 67 LYS H 1 68 SER H . . 3.000 2.381 2.229 2.557 . 0 0 "[ . 1 . 2]" 3
664 1 68 SER H 1 70 ASP H . . 4.780 4.615 4.457 4.769 . 0 0 "[ . 1 . 2]" 3
665 1 66 ILE HA 1 68 SER H . . 4.290 4.243 4.070 4.300 0.010 15 0 "[ . 1 . 2]" 3
666 1 68 SER H 1 68 SER HB2 . . 3.610 3.435 3.076 3.567 . 0 0 "[ . 1 . 2]" 3
667 1 68 SER H 1 69 VAL HA . . 5.110 4.892 4.817 4.959 . 0 0 "[ . 1 . 2]" 3
668 1 68 SER H 1 68 SER HB3 . . 3.190 2.983 2.798 3.176 . 0 0 "[ . 1 . 2]" 3
669 1 67 LYS QB 1 68 SER H . . 3.130 2.547 2.346 3.198 0.068 10 0 "[ . 1 . 2]" 3
670 1 67 LYS QD 1 68 SER H . . 5.050 4.270 2.812 4.905 . 0 0 "[ . 1 . 2]" 3
671 1 67 LYS QG 1 68 SER H . . 4.120 3.505 1.831 4.048 . 0 0 "[ . 1 . 2]" 3
672 1 66 ILE HB 1 68 SER H . . 4.900 4.659 4.444 4.909 0.009 15 0 "[ . 1 . 2]" 3
673 1 68 SER H 1 90 VAL MG1 . . 3.380 2.936 2.614 3.226 . 0 0 "[ . 1 . 2]" 3
674 1 68 SER H 1 72 VAL MG2 . . 4.640 4.350 4.137 4.532 . 0 0 "[ . 1 . 2]" 3
675 1 66 ILE MG 1 68 SER H . . 2.790 2.274 2.097 2.402 . 0 0 "[ . 1 . 2]" 3
676 1 66 ILE MD 1 68 SER H . . 5.350 5.246 5.145 5.362 0.012 15 0 "[ . 1 . 2]" 3
677 1 56 ALA H 1 57 SER H . . 4.500 2.729 2.682 2.795 . 0 0 "[ . 1 . 2]" 3
678 1 57 SER H 1 57 SER HB2 . . 4.120 2.770 2.466 2.982 . 0 0 "[ . 1 . 2]" 3
679 1 57 SER H 1 57 SER HB3 . . 4.120 2.532 2.332 2.792 . 0 0 "[ . 1 . 2]" 3
680 1 55 HIS HB2 1 57 SER H . . 4.640 3.304 3.204 3.376 . 0 0 "[ . 1 . 2]" 3
681 1 55 HIS HB3 1 57 SER H . . 4.620 2.609 2.544 2.693 . 0 0 "[ . 1 . 2]" 3
682 1 47 ASP HA 1 48 GLY H . . 3.260 2.481 2.144 2.845 . 0 0 "[ . 1 . 2]" 3
683 1 47 ASP HB2 1 48 GLY H . . 4.760 4.299 3.744 4.603 . 0 0 "[ . 1 . 2]" 3
684 1 47 ASP HB3 1 48 GLY H . . 4.760 3.853 2.354 4.659 . 0 0 "[ . 1 . 2]" 3
685 1 78 LEU H 1 83 GLN HE21 . . 4.280 3.980 3.778 4.112 . 0 0 "[ . 1 . 2]" 3
686 1 15 TYR HH 1 79 ARG H . . 3.870 2.175 1.892 2.568 . 0 0 "[ . 1 . 2]" 3
687 1 15 TYR HH 1 82 ASP H . . 4.870 4.776 4.610 4.881 0.011 17 0 "[ . 1 . 2]" 3
688 1 15 TYR H 1 16 ALA H . . 4.590 4.522 4.493 4.544 . 0 0 "[ . 1 . 2]" 3
689 1 23 CYS H 1 55 HIS H . . 5.500 5.102 4.915 5.279 . 0 0 "[ . 1 . 2]" 3
690 1 25 THR H 1 55 HIS H . . 5.200 4.850 4.758 4.991 . 0 0 "[ . 1 . 2]" 3
691 1 77 SER H 1 78 LEU H . . 2.630 2.284 2.175 2.404 . 0 0 "[ . 1 . 2]" 3
692 1 75 ILE H 1 77 SER H . . 4.130 3.992 3.861 4.125 . 0 0 "[ . 1 . 2]" 3
693 1 88 LYS H 1 90 VAL H . . 4.450 4.338 4.269 4.385 . 0 0 "[ . 1 . 2]" 3
694 1 91 GLU H 1 92 SER H . . 3.040 2.541 2.285 2.667 . 0 0 "[ . 1 . 2]" 3
695 1 77 SER H 1 77 SER HB2 . . 3.100 2.724 2.413 2.995 . 0 0 "[ . 1 . 2]" 3
696 1 71 ASP H 1 72 VAL HB . . 4.970 4.805 4.694 4.943 . 0 0 "[ . 1 . 2]" 3
697 1 71 ASP H 1 72 VAL MG2 . . 3.870 3.535 3.280 3.736 . 0 0 "[ . 1 . 2]" 3
698 1 71 ASP H 1 75 ILE MD . . 5.500 5.331 5.132 5.434 . 0 0 "[ . 1 . 2]" 3
699 1 71 ASP H 1 90 VAL MG1 . . 5.500 4.896 4.709 5.187 . 0 0 "[ . 1 . 2]" 3
700 1 70 ASP HA 1 72 VAL H . . 4.070 3.823 3.526 4.029 . 0 0 "[ . 1 . 2]" 3
701 1 68 SER H 1 71 ASP H . . 3.870 3.573 3.487 3.720 . 0 0 "[ . 1 . 2]" 3
702 1 23 CYS H 1 30 ILE H . . 3.990 3.820 3.732 3.930 . 0 0 "[ . 1 . 2]" 3
703 1 23 CYS H 1 28 SER H . . 3.450 3.229 3.132 3.374 . 0 0 "[ . 1 . 2]" 3
704 1 35 PHE HA 1 36 ARG H . . 3.040 2.149 2.141 2.164 . 0 0 "[ . 1 . 2]" 3
705 1 74 GLY H 1 75 ILE H . . 3.410 2.787 2.601 2.928 . 0 0 "[ . 1 . 2]" 3
706 1 11 TRP HZ2 1 59 ILE MD . . 4.590 4.431 4.197 4.599 0.009 18 0 "[ . 1 . 2]" 3
707 1 11 TRP HH2 1 59 ILE MD . . 3.060 2.325 2.078 2.617 . 0 0 "[ . 1 . 2]" 3
708 1 54 ASN HD21 1 59 ILE MD . . 3.680 2.231 1.792 2.623 . 0 0 "[ . 1 . 2]" 3
709 1 11 TRP HZ3 1 59 ILE MD . . 3.690 2.436 2.084 2.913 . 0 0 "[ . 1 . 2]" 3
710 1 25 THR HB 1 59 ILE MD . . 4.810 4.080 3.363 4.392 . 0 0 "[ . 1 . 2]" 3
711 1 59 ILE HA 1 59 ILE MD . . 2.770 2.076 1.985 2.278 . 0 0 "[ . 1 . 2]" 3
712 1 56 ALA HA 1 59 ILE MD . . 5.410 5.334 5.120 5.413 0.003 3 0 "[ . 1 . 2]" 3
713 1 58 CYS HB2 1 59 ILE MD . . 4.890 4.122 3.541 4.322 . 0 0 "[ . 1 . 2]" 3
714 1 54 ASN HB2 1 59 ILE MD . . 3.640 2.036 1.920 2.226 . 0 0 "[ . 1 . 2]" 3
715 1 59 ILE MD 1 65 GLN HG3 . . 4.160 3.934 3.746 4.121 . 0 0 "[ . 1 . 2]" 3
716 1 59 ILE MD 1 65 GLN HB3 . . 4.690 3.914 3.740 4.137 . 0 0 "[ . 1 . 2]" 3
717 1 59 ILE HB 1 59 ILE MD . . 3.560 3.216 3.210 3.224 . 0 0 "[ . 1 . 2]" 3
718 1 25 THR MG 1 59 ILE MD . . 4.630 4.165 3.601 4.457 . 0 0 "[ . 1 . 2]" 3
719 1 37 LEU HB2 1 59 ILE MD . . 4.890 4.052 3.863 4.219 . 0 0 "[ . 1 . 2]" 3
720 1 37 LEU MD1 1 59 ILE MD . . 4.130 4.026 3.755 4.138 0.008 17 0 "[ . 1 . 2]" 3
721 1 59 ILE MD 1 60 LEU H . . 4.870 4.661 4.554 4.733 . 0 0 "[ . 1 . 2]" 3
722 1 35 PHE QD 1 37 LEU HG . . 4.930 4.239 4.068 4.377 . 0 0 "[ . 1 . 2]" 3
723 1 35 PHE QD 1 37 LEU HA . . 5.500 4.920 4.820 5.113 . 0 0 "[ . 1 . 2]" 3
724 1 35 PHE QD 1 85 LYS HD2 . . 4.250 3.197 3.046 3.346 . 0 0 "[ . 1 . 2]" 3
725 1 35 PHE QD 1 78 LEU HB3 . . 4.880 4.174 4.017 4.323 . 0 0 "[ . 1 . 2]" 3
726 1 35 PHE QD 1 37 LEU MD2 . . 4.160 3.921 3.812 4.037 . 0 0 "[ . 1 . 2]" 3
727 1 35 PHE QD 1 85 LYS HB2 . . 5.290 4.623 4.369 4.801 . 0 0 "[ . 1 . 2]" 3
728 1 35 PHE QE 1 36 ARG H . . 4.280 4.171 3.954 4.285 0.005 6 0 "[ . 1 . 2]" 3
729 1 35 PHE HA 1 35 PHE QE . . 4.750 4.604 4.543 4.633 . 0 0 "[ . 1 . 2]" 3
730 1 35 PHE QE 1 56 ALA HA . . 5.360 4.396 4.177 4.670 . 0 0 "[ . 1 . 2]" 3
731 1 35 PHE QE 1 85 LYS HD2 . . 4.010 2.641 2.445 2.741 . 0 0 "[ . 1 . 2]" 3
732 1 35 PHE QE 1 37 LEU HG . . 4.640 2.842 2.630 3.095 . 0 0 "[ . 1 . 2]" 3
733 1 11 TRP HE3 1 37 LEU HB3 . . 3.880 2.459 2.274 2.682 . 0 0 "[ . 1 . 2]" 3
734 1 11 TRP HZ3 1 37 LEU HB3 . . 4.180 3.077 2.626 3.406 . 0 0 "[ . 1 . 2]" 3
735 1 37 LEU HB3 1 56 ALA HA . . 4.460 4.378 4.226 4.472 0.012 17 0 "[ . 1 . 2]" 3
736 1 37 LEU HB3 1 59 ILE HB . . 5.050 4.388 4.161 4.639 . 0 0 "[ . 1 . 2]" 3
737 1 37 LEU HB3 1 59 ILE MG . . 4.930 3.990 3.693 4.239 . 0 0 "[ . 1 . 2]" 3
738 1 37 LEU HB3 1 56 ALA MB . . 5.220 4.966 4.782 5.088 . 0 0 "[ . 1 . 2]" 3
739 1 11 TRP HE3 1 37 LEU HB2 . . 4.490 4.038 3.830 4.229 . 0 0 "[ . 1 . 2]" 3
740 1 35 PHE QE 1 37 LEU HB2 . . 5.500 5.027 4.882 5.258 . 0 0 "[ . 1 . 2]" 3
741 1 37 LEU HB2 1 54 ASN HD21 . . 5.500 4.649 4.446 4.955 . 0 0 "[ . 1 . 2]" 3
742 1 37 LEU HB2 1 59 ILE H . . 5.500 4.828 4.692 5.040 . 0 0 "[ . 1 . 2]" 3
743 1 11 TRP HZ3 1 37 LEU HB2 . . 4.470 3.676 3.284 4.020 . 0 0 "[ . 1 . 2]" 3
744 1 37 LEU HB2 1 37 LEU MD1 . . 3.450 2.257 2.077 2.384 . 0 0 "[ . 1 . 2]" 3
745 1 37 LEU HB2 1 56 ALA MB . . 4.640 4.071 3.879 4.210 . 0 0 "[ . 1 . 2]" 3
746 1 35 PHE HZ 1 82 ASP HB3 . . 4.650 4.123 3.895 4.309 . 0 0 "[ . 1 . 2]" 3
747 1 35 PHE HZ 1 86 ILE HG13 . . 3.900 3.689 3.481 3.840 . 0 0 "[ . 1 . 2]" 3
748 1 35 PHE HZ 1 60 LEU MD2 . . 5.160 4.534 4.241 4.880 . 0 0 "[ . 1 . 2]" 3
749 1 35 PHE HZ 1 78 LEU MD2 . . 5.450 4.541 4.201 4.750 . 0 0 "[ . 1 . 2]" 3
750 1 93 GLY QA 1 94 ALA MB . . 4.260 3.836 3.723 4.232 . 0 0 "[ . 1 . 2]" 3
751 1 94 ALA MB 1 95 GLY QA . . 4.750 3.654 3.384 3.908 . 0 0 "[ . 1 . 2]" 3
752 1 54 ASN HB2 1 55 HIS H . . 4.350 4.066 3.984 4.142 . 0 0 "[ . 1 . 2]" 3
753 1 37 LEU HB2 1 54 ASN HB2 . . 4.880 3.686 3.532 3.897 . 0 0 "[ . 1 . 2]" 3
754 1 54 ASN HB3 1 59 ILE HG12 . . 3.970 2.782 2.658 3.018 . 0 0 "[ . 1 . 2]" 3
755 1 25 THR MG 1 54 ASN HB3 . . 5.150 4.433 4.198 4.619 . 0 0 "[ . 1 . 2]" 3
756 1 37 LEU HB2 1 54 ASN HB3 . . 5.500 5.159 4.985 5.478 . 0 0 "[ . 1 . 2]" 3
757 1 80 TRP HD1 1 81 GLU HA . . 5.380 5.197 5.115 5.306 . 0 0 "[ . 1 . 2]" 3
758 1 80 TRP HD1 1 83 GLN HB2 . . 4.960 4.053 3.980 4.154 . 0 0 "[ . 1 . 2]" 3
759 1 80 TRP HD1 1 83 GLN HG3 . . 5.500 5.449 5.338 5.505 0.005 3 0 "[ . 1 . 2]" 3
760 1 54 ASN HB2 1 58 CYS HB2 . . 4.990 4.142 3.925 4.296 . 0 0 "[ . 1 . 2]" 3
761 1 54 ASN HB2 1 59 ILE HB . . 5.110 4.515 4.366 4.664 . 0 0 "[ . 1 . 2]" 3
762 1 54 ASN HB3 1 59 ILE HG13 . . 4.450 3.816 3.596 3.994 . 0 0 "[ . 1 . 2]" 3
763 1 54 ASN HB3 1 59 ILE MD . . 4.050 2.411 2.135 2.679 . 0 0 "[ . 1 . 2]" 3
764 1 36 ARG HD3 1 53 TRP HE3 . . 4.700 4.103 3.746 4.680 . 0 0 "[ . 1 . 2]" 3
765 1 36 ARG HD3 1 53 TRP HB3 . . 4.810 4.146 3.806 4.550 . 0 0 "[ . 1 . 2]" 3
766 1 36 ARG HD2 1 53 TRP HE3 . . 4.440 2.369 1.999 2.994 . 0 0 "[ . 1 . 2]" 3
767 1 36 ARG HD2 1 53 TRP HB3 . . 4.520 3.030 2.751 3.297 . 0 0 "[ . 1 . 2]" 3
768 1 36 ARG HB2 1 36 ARG HD2 . . 4.200 2.365 2.197 2.512 . 0 0 "[ . 1 . 2]" 3
769 1 36 ARG HB3 1 36 ARG HD2 . . 4.200 3.075 2.783 3.287 . 0 0 "[ . 1 . 2]" 3
770 1 16 ALA MB 1 36 ARG HD2 . . 4.160 3.902 3.509 4.160 0.000 20 0 "[ . 1 . 2]" 3
771 1 11 TRP HB2 1 11 TRP HD1 . . 3.680 2.660 2.632 2.691 . 0 0 "[ . 1 . 2]" 3
772 1 10 PRO HG3 1 11 TRP HD1 . . 4.020 3.527 3.384 3.623 . 0 0 "[ . 1 . 2]" 3
773 1 11 TRP HD1 1 72 VAL H . . 5.500 5.468 5.332 5.520 0.020 17 0 "[ . 1 . 2]" 3
774 1 11 TRP HD1 1 66 ILE MG . . 4.060 3.161 2.845 3.394 . 0 0 "[ . 1 . 2]" 3
775 1 38 GLY HA2 1 54 ASN H . . 4.650 3.484 3.280 3.564 . 0 0 "[ . 1 . 2]" 3
776 1 38 GLY HA2 1 53 TRP HE3 . . 4.110 3.258 3.026 3.468 . 0 0 "[ . 1 . 2]" 3
777 1 38 GLY HA2 1 54 ASN HD21 . . 4.570 4.057 3.631 4.572 0.002 14 0 "[ . 1 . 2]" 3
778 1 38 GLY HA2 1 39 LYS HB2 . . 4.890 4.562 4.495 4.699 . 0 0 "[ . 1 . 2]" 3
779 1 38 GLY HA3 1 53 TRP HE3 . . 4.230 3.324 3.150 3.553 . 0 0 "[ . 1 . 2]" 3
780 1 38 GLY HA3 1 53 TRP HZ3 . . 4.510 3.118 2.840 3.467 . 0 0 "[ . 1 . 2]" 3
781 1 37 LEU HA 1 38 GLY HA3 . . 4.830 4.343 4.329 4.357 . 0 0 "[ . 1 . 2]" 3
782 1 38 GLY HA3 1 51 PRO HB3 . . 4.450 4.180 3.789 4.489 0.039 17 0 "[ . 1 . 2]" 3
783 1 12 ARG HD2 1 53 TRP HH2 . . 4.170 3.017 1.936 4.102 . 0 0 "[ . 1 . 2]" 3
784 1 12 ARG HD3 1 53 TRP HH2 . . 4.170 2.602 2.083 3.573 . 0 0 "[ . 1 . 2]" 3
785 1 79 ARG H 1 79 ARG HD2 . . 4.950 4.589 3.969 4.955 0.005 15 0 "[ . 1 . 2]" 3
786 1 79 ARG HB3 1 79 ARG HD2 . . 3.870 2.928 2.204 3.774 . 0 0 "[ . 1 . 2]" 3
787 1 79 ARG HB2 1 79 ARG HD2 . . 4.210 3.443 2.491 4.200 . 0 0 "[ . 1 . 2]" 3
788 1 79 ARG HA 1 79 ARG HD3 . . 4.710 3.426 2.116 4.699 . 0 0 "[ . 1 . 2]" 3
789 1 79 ARG HB3 1 79 ARG HD3 . . 3.870 3.046 2.270 3.750 . 0 0 "[ . 1 . 2]" 3
790 1 20 ARG HA 1 20 ARG QD . . 3.850 2.875 1.967 3.979 0.129 11 0 "[ . 1 . 2]" 3
791 1 79 ARG H 1 79 ARG HD3 . . 4.950 4.556 4.081 4.959 0.009 16 0 "[ . 1 . 2]" 3
792 1 87 ARG H 1 87 ARG HD2 . . 4.530 3.568 3.379 4.117 . 0 0 "[ . 1 . 2]" 3
793 1 84 GLN HA 1 87 ARG HD2 . . 3.930 3.638 3.532 3.790 . 0 0 "[ . 1 . 2]" 3
794 1 69 VAL MG1 1 87 ARG HD2 . . 4.330 3.388 2.997 3.982 . 0 0 "[ . 1 . 2]" 3
795 1 87 ARG HB3 1 87 ARG HD3 . . 3.630 3.215 2.727 3.384 . 0 0 "[ . 1 . 2]" 3
796 1 69 VAL MG1 1 87 ARG HD3 . . 4.340 4.169 3.722 4.346 0.006 20 0 "[ . 1 . 2]" 3
797 1 84 GLN H 1 87 ARG HD3 . . 5.080 4.010 3.815 4.358 . 0 0 "[ . 1 . 2]" 3
798 1 84 GLN HA 1 87 ARG HD3 . . 3.740 2.108 1.999 2.317 . 0 0 "[ . 1 . 2]" 3
799 1 9 LYS QE 1 73 GLU HB2 . . 4.460 3.704 1.982 4.471 0.011 18 0 "[ . 1 . 2]" 3
800 1 9 LYS QE 1 9 LYS HG2 . . 3.320 2.741 2.228 3.398 0.078 17 0 "[ . 1 . 2]" 3
801 1 9 LYS QE 1 73 GLU HA . . 4.620 3.391 2.609 4.631 0.011 11 0 "[ . 1 . 2]" 3
802 1 78 LEU HB2 1 79 ARG H . . 4.450 3.503 3.246 3.677 . 0 0 "[ . 1 . 2]" 3
803 1 78 LEU HB2 1 83 GLN HE21 . . 4.730 3.930 3.757 4.075 . 0 0 "[ . 1 . 2]" 3
804 1 35 PHE QD 1 78 LEU HB2 . . 5.500 5.360 5.213 5.501 0.001 7 0 "[ . 1 . 2]" 3
805 1 78 LEU HB2 1 82 ASP H . . 5.500 5.014 4.869 5.253 . 0 0 "[ . 1 . 2]" 3
806 1 78 LEU HB2 1 82 ASP HB2 . . 3.870 2.824 2.608 3.101 . 0 0 "[ . 1 . 2]" 3
807 1 78 LEU HB3 1 83 GLN HA . . 5.090 4.748 4.521 4.941 . 0 0 "[ . 1 . 2]" 3
808 1 78 LEU HB3 1 83 GLN HG2 . . 4.220 3.859 3.610 4.009 . 0 0 "[ . 1 . 2]" 3
809 1 78 LEU HB3 1 82 ASP HB2 . . 3.650 2.262 2.207 2.358 . 0 0 "[ . 1 . 2]" 3
810 1 78 LEU HB3 1 78 LEU MD1 . . 3.620 2.391 2.264 2.519 . 0 0 "[ . 1 . 2]" 3
811 1 9 LYS QE 1 73 GLU QG . . 5.460 3.556 1.876 4.873 . 0 0 "[ . 1 . 2]" 3
812 1 24 LYS QE 1 52 MET ME . . 4.500 3.313 2.019 4.462 . 0 0 "[ . 1 . 2]" 3
813 1 24 LYS HA 1 24 LYS QE . . 4.560 4.242 3.552 4.555 . 0 0 "[ . 1 . 2]" 3
814 1 24 LYS QB 1 24 LYS QE . . 3.910 2.927 2.118 3.630 . 0 0 "[ . 1 . 2]" 3
815 1 81 GLU QB 1 85 LYS HE2 . . 4.490 3.803 3.435 3.988 . 0 0 "[ . 1 . 2]" 3
816 1 85 LYS H 1 85 LYS HE2 . . 4.870 4.736 4.534 4.879 0.009 16 0 "[ . 1 . 2]" 3
817 1 35 PHE QD 1 85 LYS HE2 . . 5.500 5.135 4.827 5.292 . 0 0 "[ . 1 . 2]" 3
818 1 82 ASP H 1 85 LYS HE2 . . 5.500 5.257 5.039 5.405 . 0 0 "[ . 1 . 2]" 3
819 1 35 PHE QE 1 85 LYS HE2 . . 5.500 5.472 5.300 5.522 0.022 12 0 "[ . 1 . 2]" 3
820 1 82 ASP HA 1 85 LYS HE2 . . 4.280 3.746 3.640 3.892 . 0 0 "[ . 1 . 2]" 3
821 1 81 GLU QG 1 85 LYS HE2 . . 4.710 3.332 3.078 3.578 . 0 0 "[ . 1 . 2]" 3
822 1 85 LYS HB2 1 85 LYS HE2 . . 4.660 4.477 4.369 4.580 . 0 0 "[ . 1 . 2]" 3
823 1 85 LYS HD3 1 85 LYS HE2 . . 3.010 2.480 2.361 2.563 . 0 0 "[ . 1 . 2]" 3
824 1 85 LYS HE2 1 85 LYS HG2 . . 3.260 2.796 2.623 2.946 . 0 0 "[ . 1 . 2]" 3
825 1 60 LEU MD1 1 85 LYS HE2 . . 5.420 5.093 4.923 5.183 . 0 0 "[ . 1 . 2]" 3
826 1 35 PHE QD 1 85 LYS HE3 . . 5.140 3.938 3.594 4.342 . 0 0 "[ . 1 . 2]" 3
827 1 82 ASP H 1 85 LYS HE3 . . 5.500 3.740 3.585 3.975 . 0 0 "[ . 1 . 2]" 3
828 1 35 PHE QE 1 85 LYS HE3 . . 4.830 4.370 4.204 4.594 . 0 0 "[ . 1 . 2]" 3
829 1 82 ASP HA 1 85 LYS HE3 . . 4.050 2.118 1.999 2.281 . 0 0 "[ . 1 . 2]" 3
830 1 85 LYS HB2 1 85 LYS HE3 . . 4.240 3.830 3.774 4.006 . 0 0 "[ . 1 . 2]" 3
831 1 60 LEU MD1 1 85 LYS HE3 . . 5.140 5.098 4.944 5.146 0.006 7 0 "[ . 1 . 2]" 3
832 1 88 LYS QE 1 88 LYS HG3 . . 3.880 2.376 2.053 2.922 . 0 0 "[ . 1 . 2]" 3
833 1 62 LYS H 1 62 LYS QE . . 4.870 4.347 3.451 4.896 0.026 20 0 "[ . 1 . 2]" 3
834 1 59 ILE H 1 62 LYS QE . . 5.500 5.106 4.131 5.661 0.161 20 0 "[ . 1 . 2]" 3
835 1 62 LYS HB3 1 62 LYS QE . . 4.050 3.607 2.601 4.084 0.034 10 0 "[ . 1 . 2]" 3
836 1 62 LYS QE 1 62 LYS HG3 . . 3.880 2.433 2.085 3.542 . 0 0 "[ . 1 . 2]" 3
837 1 25 THR MG 1 62 LYS QE . . 3.140 2.685 2.100 3.150 0.010 7 0 "[ . 1 . 2]" 3
838 1 59 ILE MD 1 62 LYS QE . . 3.720 2.873 1.902 3.635 . 0 0 "[ . 1 . 2]" 3
839 1 59 ILE MG 1 62 LYS QE . . 4.900 3.996 2.425 4.878 . 0 0 "[ . 1 . 2]" 3
840 1 18 SER HA 1 32 LYS QE . . 4.230 3.365 2.510 4.059 . 0 0 "[ . 1 . 2]" 3
841 1 17 LYS HA 1 32 LYS QE . . 4.120 3.358 2.985 4.133 0.013 7 0 "[ . 1 . 2]" 3
842 1 61 LYS QE 1 62 LYS H . . 5.140 4.537 3.781 5.086 . 0 0 "[ . 1 . 2]" 3
843 1 61 LYS H 1 61 LYS QE . . 4.610 4.416 4.070 4.660 0.050 2 0 "[ . 1 . 2]" 3
844 1 58 CYS HA 1 61 LYS QE . . 3.510 2.336 1.940 3.522 0.012 9 0 "[ . 1 . 2]" 3
845 1 61 LYS QE 1 61 LYS HG2 . . 3.820 2.247 2.132 2.406 . 0 0 "[ . 1 . 2]" 3
846 1 39 LYS HB3 1 39 LYS HE2 . . 5.020 4.559 4.424 4.635 . 0 0 "[ . 1 . 2]" 3
847 1 39 LYS HE2 1 39 LYS HG3 . . 3.860 2.290 2.131 2.530 . 0 0 "[ . 1 . 2]" 3
848 1 11 TRP HZ2 1 39 LYS HE3 . . 4.290 2.219 1.994 2.828 . 0 0 "[ . 1 . 2]" 3
849 1 11 TRP HH2 1 39 LYS HE3 . . 4.540 3.722 3.439 4.068 . 0 0 "[ . 1 . 2]" 3
850 1 10 PRO HB2 1 39 LYS HE2 . . 4.660 4.416 4.019 4.641 . 0 0 "[ . 1 . 2]" 3
851 1 39 LYS HB3 1 39 LYS HE3 . . 5.090 4.874 4.686 5.070 . 0 0 "[ . 1 . 2]" 3
852 1 39 LYS HB2 1 39 LYS HE3 . . 4.410 4.139 3.864 4.410 0.000 9 0 "[ . 1 . 2]" 3
853 1 39 LYS HE2 1 39 LYS HG2 . . 3.900 2.834 2.509 3.117 . 0 0 "[ . 1 . 2]" 3
854 1 71 ASP HB2 1 72 VAL MG2 . . 4.730 3.727 3.237 4.614 . 0 0 "[ . 1 . 2]" 3
855 1 10 PRO HG2 1 71 ASP HB3 . . 4.590 2.551 1.986 4.008 . 0 0 "[ . 1 . 2]" 3
856 1 71 ASP HB3 1 72 VAL MG2 . . 4.730 4.116 3.797 4.568 . 0 0 "[ . 1 . 2]" 3
857 1 32 LYS QE 1 32 LYS HG3 . . 3.190 2.278 2.133 2.699 . 0 0 "[ . 1 . 2]" 3
858 1 10 PRO HD2 1 71 ASP HB3 . . 4.270 3.122 2.585 4.183 . 0 0 "[ . 1 . 2]" 3
859 1 10 PRO HG3 1 71 ASP HB3 . . 4.590 2.959 2.528 4.078 . 0 0 "[ . 1 . 2]" 3
860 1 66 ILE MG 1 71 ASP HB3 . . 4.300 3.666 3.281 4.027 . 0 0 "[ . 1 . 2]" 3
861 1 12 ARG HG2 1 53 TRP HH2 . . 4.630 4.219 3.950 4.575 . 0 0 "[ . 1 . 2]" 3
862 1 14 GLU HG3 1 53 TRP HH2 . . 3.950 3.594 3.100 3.983 0.033 17 0 "[ . 1 . 2]" 3
863 1 82 ASP H 1 82 ASP HB2 . . 3.620 2.480 2.373 2.544 . 0 0 "[ . 1 . 2]" 3
864 1 35 PHE QE 1 82 ASP HB2 . . 4.830 4.487 4.300 4.831 0.001 12 0 "[ . 1 . 2]" 3
865 1 79 ARG H 1 82 ASP HB3 . . 5.000 3.947 3.755 4.142 . 0 0 "[ . 1 . 2]" 3
866 1 35 PHE QD 1 82 ASP HB3 . . 3.750 2.709 2.349 2.992 . 0 0 "[ . 1 . 2]" 3
867 1 35 PHE QE 1 82 ASP HB3 . . 4.390 2.897 2.698 3.271 . 0 0 "[ . 1 . 2]" 3
868 1 78 LEU HB3 1 82 ASP HB3 . . 4.020 2.531 2.271 2.693 . 0 0 "[ . 1 . 2]" 3
869 1 78 LEU MD1 1 82 ASP HB3 . . 3.900 2.807 2.561 3.021 . 0 0 "[ . 1 . 2]" 3
870 1 78 LEU MD2 1 82 ASP HB3 . . 4.390 3.925 3.818 4.039 . 0 0 "[ . 1 . 2]" 3
871 1 66 ILE HB 1 89 TYR QD . . 3.950 2.827 2.576 3.099 . 0 0 "[ . 1 . 2]" 3
872 1 66 ILE HB 1 90 VAL MG1 . . 3.860 2.418 2.090 2.713 . 0 0 "[ . 1 . 2]" 3
873 1 70 ASP HB2 1 71 ASP H . . 4.240 3.899 3.046 4.221 . 0 0 "[ . 1 . 2]" 3
874 1 68 SER HB3 1 70 ASP HB2 . . 4.740 4.043 2.698 4.686 . 0 0 "[ . 1 . 2]" 3
875 1 69 VAL MG2 1 70 ASP HB2 . . 5.070 3.648 3.381 4.561 . 0 0 "[ . 1 . 2]" 3
876 1 70 ASP HB3 1 71 ASP H . . 4.240 3.128 2.826 3.790 . 0 0 "[ . 1 . 2]" 3
877 1 34 ASN HB2 1 35 PHE H . . 4.910 4.170 3.989 4.257 . 0 0 "[ . 1 . 2]" 3
878 1 34 ASN HB3 1 35 PHE H . . 4.600 2.961 2.659 3.107 . 0 0 "[ . 1 . 2]" 3
879 1 16 ALA MB 1 34 ASN HB3 . . 4.600 4.432 4.163 4.604 0.004 9 0 "[ . 1 . 2]" 3
880 1 30 ILE MG 1 34 ASN HB2 . . 3.350 2.919 2.750 3.017 . 0 0 "[ . 1 . 2]" 3
881 1 16 ALA H 1 34 ASN HB3 . . 5.030 4.919 4.762 5.027 . 0 0 "[ . 1 . 2]" 3
882 1 34 ASN H 1 34 ASN HB3 . . 3.700 3.621 3.600 3.648 . 0 0 "[ . 1 . 2]" 3
883 1 40 LEU HB3 1 49 ILE MG . . 4.330 2.632 2.254 2.942 . 0 0 "[ . 1 . 2]" 3
884 1 19 SER HB2 1 31 ASN HB3 . . 5.380 5.017 4.810 5.304 . 0 0 "[ . 1 . 2]" 3
885 1 60 LEU QB 1 89 TYR QD . . 4.370 3.157 2.595 3.469 . 0 0 "[ . 1 . 2]" 3
886 1 46 PHE HB2 1 47 ASP H . . 5.110 3.914 2.045 4.624 . 0 0 "[ . 1 . 2]" 3
887 1 46 PHE HB3 1 47 ASP H . . 5.110 3.765 2.305 4.654 . 0 0 "[ . 1 . 2]" 3
888 1 11 TRP HZ3 1 54 ASN HD21 . . 4.700 3.267 2.860 3.843 . 0 0 "[ . 1 . 2]" 3
889 1 14 GLU H 1 53 TRP HZ3 . . 5.230 4.513 4.044 5.000 . 0 0 "[ . 1 . 2]" 3
890 1 37 LEU H 1 53 TRP HZ3 . . 5.500 4.750 4.453 4.918 . 0 0 "[ . 1 . 2]" 3
891 1 36 ARG HD2 1 53 TRP HZ3 . . 5.110 3.645 3.333 4.277 . 0 0 "[ . 1 . 2]" 3
892 1 36 ARG HG2 1 53 TRP HZ3 . . 5.110 4.609 4.049 4.970 . 0 0 "[ . 1 . 2]" 3
893 1 89 TYR HB3 1 90 VAL MG2 . . 5.500 3.968 3.743 4.169 . 0 0 "[ . 1 . 2]" 3
894 1 36 ARG HG3 1 53 TRP HZ3 . . 4.540 3.023 2.472 3.435 . 0 0 "[ . 1 . 2]" 3
895 1 89 TYR HB2 1 90 VAL H . . 4.120 4.054 3.995 4.117 . 0 0 "[ . 1 . 2]" 3
896 1 89 TYR HB2 1 90 VAL MG2 . . 5.500 5.276 5.096 5.412 . 0 0 "[ . 1 . 2]" 3
897 1 80 TRP HE3 1 81 GLU HA . . 4.150 4.010 3.899 4.101 . 0 0 "[ . 1 . 2]" 3
898 1 80 TRP HB3 1 80 TRP HE3 . . 4.010 2.407 2.402 2.417 . 0 0 "[ . 1 . 2]" 3
899 1 80 TRP HE3 1 81 GLU QB . . 4.350 3.163 2.976 3.246 . 0 0 "[ . 1 . 2]" 3
900 1 35 PHE HB2 1 56 ALA MB . . 4.710 4.342 4.196 4.515 . 0 0 "[ . 1 . 2]" 3
901 1 15 TYR HB2 1 16 ALA H . . 4.630 4.304 4.243 4.351 . 0 0 "[ . 1 . 2]" 3
902 1 15 TYR HB2 1 33 GLU HA . . 4.470 4.301 4.163 4.459 . 0 0 "[ . 1 . 2]" 3
903 1 75 ILE HB 1 76 GLU H . . 4.430 3.983 3.804 4.096 . 0 0 "[ . 1 . 2]" 3
904 1 72 VAL HB 1 75 ILE HB . . 3.480 2.420 2.216 2.560 . 0 0 "[ . 1 . 2]" 3
905 1 13 ALA MB 1 75 ILE HB . . 4.110 2.972 2.714 3.173 . 0 0 "[ . 1 . 2]" 3
906 1 11 TRP HE3 1 39 LYS H . . 5.350 4.024 3.796 4.423 . 0 0 "[ . 1 . 2]" 3
907 1 35 PHE HB3 1 56 ALA MB . . 4.710 3.457 3.302 3.629 . 0 0 "[ . 1 . 2]" 3
908 1 34 ASN HB2 1 55 HIS HD2 . . 5.210 4.897 4.753 5.056 . 0 0 "[ . 1 . 2]" 3
909 1 34 ASN HB3 1 55 HIS HD2 . . 4.610 3.979 3.854 4.161 . 0 0 "[ . 1 . 2]" 3
910 1 30 ILE HG13 1 55 HIS HD2 . . 5.190 4.369 4.224 4.546 . 0 0 "[ . 1 . 2]" 3
911 1 33 GLU HA 1 33 GLU HG2 . . 3.410 2.652 2.649 2.659 . 0 0 "[ . 1 . 2]" 3
912 1 32 LYS QE 1 33 GLU HG2 . . 4.360 3.717 3.496 4.296 . 0 0 "[ . 1 . 2]" 3
913 1 32 LYS QD 1 33 GLU HG2 . . 4.670 4.234 4.168 4.301 . 0 0 "[ . 1 . 2]" 3
914 1 32 LYS HB2 1 33 GLU HG2 . . 4.720 3.441 3.395 3.468 . 0 0 "[ . 1 . 2]" 3
915 1 32 LYS HG2 1 33 GLU HG2 . . 3.570 3.249 3.229 3.281 . 0 0 "[ . 1 . 2]" 3
916 1 32 LYS HG3 1 33 GLU HG2 . . 4.200 2.092 2.051 2.166 . 0 0 "[ . 1 . 2]" 3
917 1 32 LYS QE 1 33 GLU HG3 . . 4.430 3.850 3.471 4.426 . 0 0 "[ . 1 . 2]" 3
918 1 32 LYS QD 1 33 GLU HG3 . . 4.490 3.479 3.424 3.746 . 0 0 "[ . 1 . 2]" 3
919 1 32 LYS HB2 1 33 GLU HG3 . . 4.800 3.758 3.720 3.781 . 0 0 "[ . 1 . 2]" 3
920 1 33 GLU H 1 33 GLU HG3 . . 4.230 3.541 3.530 3.556 . 0 0 "[ . 1 . 2]" 3
921 1 33 GLU HA 1 33 GLU HG3 . . 3.900 3.665 3.657 3.687 . 0 0 "[ . 1 . 2]" 3
922 1 32 LYS HA 1 33 GLU HG3 . . 4.940 4.466 4.415 4.547 . 0 0 "[ . 1 . 2]" 3
923 1 32 LYS HG2 1 33 GLU HG3 . . 3.630 2.068 2.054 2.087 . 0 0 "[ . 1 . 2]" 3
924 1 32 LYS HG3 1 33 GLU HG3 . . 4.240 1.973 1.958 1.981 . 0 0 "[ . 1 . 2]" 3
925 1 31 ASN H 1 55 HIS HD2 . . 5.500 5.199 5.071 5.351 . 0 0 "[ . 1 . 2]" 3
926 1 30 ILE HG12 1 55 HIS HD2 . . 4.720 2.838 2.713 2.984 . 0 0 "[ . 1 . 2]" 3
927 1 22 SER HA 1 30 ILE HB . . 4.990 3.987 3.806 4.221 . 0 0 "[ . 1 . 2]" 3
928 1 91 GLU H 1 91 GLU HG2 . . 3.490 2.437 2.321 2.591 . 0 0 "[ . 1 . 2]" 3
929 1 90 VAL MG2 1 91 GLU HG2 . . 4.110 2.223 1.988 2.530 . 0 0 "[ . 1 . 2]" 3
930 1 91 GLU H 1 91 GLU HG3 . . 3.710 3.504 3.402 3.661 . 0 0 "[ . 1 . 2]" 3
931 1 91 GLU HA 1 91 GLU HG3 . . 3.800 3.779 3.743 3.818 0.018 11 0 "[ . 1 . 2]" 3
932 1 91 GLU QB 1 91 GLU HG3 . . 2.780 2.145 2.140 2.151 . 0 0 "[ . 1 . 2]" 3
933 1 90 VAL MG2 1 91 GLU HG3 . . 4.260 3.570 3.302 3.848 . 0 0 "[ . 1 . 2]" 3
934 1 69 VAL MG1 1 86 ILE HB . . 4.460 1.952 1.934 1.971 . 0 0 "[ . 1 . 2]" 3
935 1 78 LEU MD1 1 86 ILE HB . . 5.160 5.010 4.757 5.150 . 0 0 "[ . 1 . 2]" 3
936 1 9 LYS QB 1 73 GLU QG . . 4.420 3.623 3.214 3.952 . 0 0 "[ . 1 . 2]" 3
937 1 37 LEU HA 1 53 TRP HE3 . . 5.000 4.439 4.223 4.614 . 0 0 "[ . 1 . 2]" 3
938 1 53 TRP HA 1 53 TRP HE3 . . 3.820 2.098 1.992 2.345 . 0 0 "[ . 1 . 2]" 3
939 1 36 ARG HG3 1 53 TRP HE3 . . 4.520 3.353 2.853 3.731 . 0 0 "[ . 1 . 2]" 3
940 1 38 GLY H 1 53 TRP HE3 . . 4.670 4.115 3.879 4.300 . 0 0 "[ . 1 . 2]" 3
941 1 14 GLU H 1 14 GLU HG2 . . 3.890 2.686 2.551 2.818 . 0 0 "[ . 1 . 2]" 3
942 1 14 GLU HG2 1 53 TRP HZ3 . . 4.110 3.295 2.950 3.676 . 0 0 "[ . 1 . 2]" 3
943 1 14 GLU HG2 1 53 TRP HH2 . . 3.970 3.298 2.655 3.865 . 0 0 "[ . 1 . 2]" 3
944 1 14 GLU HG2 1 36 ARG HE . . 4.700 3.819 3.555 4.135 . 0 0 "[ . 1 . 2]" 3
945 1 14 GLU HG2 1 36 ARG HG3 . . 4.240 4.115 3.939 4.235 . 0 0 "[ . 1 . 2]" 3
946 1 14 GLU HG3 1 53 TRP HZ3 . . 4.740 3.990 3.724 4.326 . 0 0 "[ . 1 . 2]" 3
947 1 14 GLU HG3 1 36 ARG HG3 . . 4.340 4.176 3.994 4.341 0.001 1 0 "[ . 1 . 2]" 3
948 1 14 GLU HG3 1 36 ARG HE . . 4.220 3.030 2.757 3.167 . 0 0 "[ . 1 . 2]" 3
949 1 76 GLU HA 1 76 GLU HG2 . . 4.230 3.890 3.808 3.935 . 0 0 "[ . 1 . 2]" 3
950 1 76 GLU HA 1 76 GLU HG3 . . 3.730 3.634 3.608 3.688 . 0 0 "[ . 1 . 2]" 3
951 1 76 GLU HB2 1 76 GLU HG3 . . 2.990 2.619 2.552 2.650 . 0 0 "[ . 1 . 2]" 3
952 1 75 ILE MG 1 76 GLU HG3 . . 4.500 4.441 4.304 4.503 0.003 17 0 "[ . 1 . 2]" 3
953 1 80 TRP HE3 1 81 GLU QG . . 4.770 4.753 4.655 4.779 0.009 6 0 "[ . 1 . 2]" 3
954 1 81 GLU HA 1 81 GLU QG . . 3.320 3.304 3.290 3.318 . 0 0 "[ . 1 . 2]" 3
955 1 81 GLU QG 1 85 LYS HE3 . . 4.220 2.285 2.087 2.469 . 0 0 "[ . 1 . 2]" 3
956 1 79 ARG HB2 1 81 GLU QG . . 4.100 2.867 2.704 3.062 . 0 0 "[ . 1 . 2]" 3
957 1 62 LYS H 1 89 TYR QE . . 4.870 4.352 3.842 4.660 . 0 0 "[ . 1 . 2]" 3
958 1 89 TYR QE 1 95 GLY QA . . 4.500 4.072 2.881 4.464 . 0 0 "[ . 1 . 2]" 3
959 1 65 GLN HB2 1 89 TYR QE . . 4.520 2.969 2.639 3.437 . 0 0 "[ . 1 . 2]" 3
960 1 66 ILE HB 1 89 TYR QE . . 3.630 2.204 2.015 2.418 . 0 0 "[ . 1 . 2]" 3
961 1 54 ASN HB3 1 59 ILE HB . . 5.500 5.302 5.175 5.448 . 0 0 "[ . 1 . 2]" 3
962 1 37 LEU HB2 1 59 ILE HB . . 4.600 3.567 3.422 3.705 . 0 0 "[ . 1 . 2]" 3
963 1 59 ILE HB 1 60 LEU MD1 . . 4.950 4.809 4.704 4.881 . 0 0 "[ . 1 . 2]" 3
964 1 56 ALA MB 1 59 ILE HB . . 4.870 4.810 4.657 4.883 0.013 18 0 "[ . 1 . 2]" 3
965 1 59 ILE HB 1 60 LEU MD2 . . 4.790 4.104 3.873 4.261 . 0 0 "[ . 1 . 2]" 3
966 1 15 TYR QE 1 35 PHE HB2 . . 4.110 2.573 1.999 2.976 . 0 0 "[ . 1 . 2]" 3
967 1 15 TYR QE 1 35 PHE HB3 . . 4.110 3.682 3.442 3.975 . 0 0 "[ . 1 . 2]" 3
968 1 15 TYR QE 1 82 ASP HB2 . . 5.360 4.819 4.161 5.245 . 0 0 "[ . 1 . 2]" 3
969 1 15 TYR QE 1 79 ARG HB2 . . 4.880 4.216 3.851 4.413 . 0 0 "[ . 1 . 2]" 3
970 1 15 TYR QE 1 78 LEU HB3 . . 4.520 3.697 2.896 4.331 . 0 0 "[ . 1 . 2]" 3
971 1 65 GLN H 1 65 GLN HG3 . . 3.880 3.868 3.781 3.896 0.016 15 0 "[ . 1 . 2]" 3
972 1 59 ILE HA 1 65 GLN HG3 . . 4.680 3.558 3.162 3.797 . 0 0 "[ . 1 . 2]" 3
973 1 63 THR HA 1 65 GLN HG2 . . 4.430 3.401 3.189 3.655 . 0 0 "[ . 1 . 2]" 3
974 1 30 ILE MG 1 36 ARG HB3 . . 4.000 2.306 2.186 2.430 . 0 0 "[ . 1 . 2]" 3
975 1 11 TRP HB3 1 11 TRP HE3 . . 4.100 2.582 2.539 2.625 . 0 0 "[ . 1 . 2]" 3
976 1 82 ASP H 1 83 GLN HG2 . . 5.500 5.454 5.345 5.510 0.010 18 0 "[ . 1 . 2]" 3
977 1 78 LEU HB2 1 83 GLN HG2 . . 3.800 2.178 2.021 2.287 . 0 0 "[ . 1 . 2]" 3
978 1 75 ILE MG 1 83 GLN HG2 . . 5.190 4.339 4.137 4.455 . 0 0 "[ . 1 . 2]" 3
979 1 75 ILE MD 1 83 GLN HG2 . . 4.890 4.157 4.040 4.218 . 0 0 "[ . 1 . 2]" 3
980 1 78 LEU H 1 83 GLN HG3 . . 4.780 4.269 4.175 4.377 . 0 0 "[ . 1 . 2]" 3
981 1 82 ASP H 1 83 GLN HG3 . . 5.200 4.383 4.241 4.455 . 0 0 "[ . 1 . 2]" 3
982 1 78 LEU HB2 1 83 GLN HG3 . . 3.740 2.817 2.724 2.925 . 0 0 "[ . 1 . 2]" 3
983 1 75 ILE HG13 1 83 GLN HG3 . . 5.350 5.306 5.177 5.360 0.010 18 0 "[ . 1 . 2]" 3
984 1 78 LEU HB3 1 83 GLN HG3 . . 4.300 4.126 3.900 4.283 . 0 0 "[ . 1 . 2]" 3
985 1 75 ILE MD 1 83 GLN HG3 . . 5.500 5.484 5.385 5.515 0.015 3 0 "[ . 1 . 2]" 3
986 1 78 LEU MD1 1 83 GLN HG3 . . 4.490 4.288 3.997 4.479 . 0 0 "[ . 1 . 2]" 3
987 1 41 VAL HB 1 42 GLN H . . 4.290 2.944 2.310 3.612 . 0 0 "[ . 1 . 2]" 3
988 1 62 LYS H 1 62 LYS HB3 . . 3.900 3.580 3.530 3.625 . 0 0 "[ . 1 . 2]" 3
989 1 62 LYS HB3 1 62 LYS QD . . 3.470 2.433 2.163 3.153 . 0 0 "[ . 1 . 2]" 3
990 1 59 ILE HA 1 62 LYS HB3 . . 5.000 4.629 4.395 4.809 . 0 0 "[ . 1 . 2]" 3
991 1 62 LYS HB2 1 62 LYS QE . . 4.790 3.190 2.015 4.053 . 0 0 "[ . 1 . 2]" 3
992 1 62 LYS HB2 1 65 GLN HG3 . . 4.000 2.235 2.000 2.554 . 0 0 "[ . 1 . 2]" 3
993 1 50 MET HB2 1 51 PRO QD . . 4.550 4.239 3.662 4.389 . 0 0 "[ . 1 . 2]" 3
994 1 41 VAL MG2 1 50 MET HB2 . . 5.040 3.395 1.995 4.483 . 0 0 "[ . 1 . 2]" 3
995 1 59 ILE MD 1 62 LYS HB2 . . 5.420 4.022 3.856 4.157 . 0 0 "[ . 1 . 2]" 3
996 1 50 MET HB3 1 51 PRO QD . . 4.550 3.957 3.588 4.372 . 0 0 "[ . 1 . 2]" 3
997 1 41 VAL MG2 1 50 MET HB3 . . 5.040 3.616 2.276 4.671 . 0 0 "[ . 1 . 2]" 3
998 1 12 ARG HB2 1 40 LEU MD2 . . 4.360 4.270 3.900 4.380 0.020 12 0 "[ . 1 . 2]" 3
999 1 12 ARG HB2 1 38 GLY H . . 5.320 4.659 4.504 4.896 . 0 0 "[ . 1 . 2]" 3
1000 1 12 ARG HB3 1 53 TRP HH2 . . 5.500 5.353 5.068 5.618 0.118 8 0 "[ . 1 . 2]" 3
1001 1 12 ARG HB2 1 40 LEU HG . . 5.130 4.818 4.648 5.124 . 0 0 "[ . 1 . 2]" 3
1002 1 12 ARG HB2 1 53 TRP HH2 . . 4.990 4.713 4.295 5.029 0.039 20 0 "[ . 1 . 2]" 3
1003 1 51 PRO QD 1 53 TRP HZ2 . . 5.500 5.437 5.202 5.573 0.073 17 0 "[ . 1 . 2]" 3
1004 1 12 ARG HD2 1 53 TRP HZ2 . . 5.240 4.434 3.619 4.980 . 0 0 "[ . 1 . 2]" 3
1005 1 51 PRO HG2 1 53 TRP HZ2 . . 4.550 4.012 3.736 4.416 . 0 0 "[ . 1 . 2]" 3
1006 1 51 PRO HG3 1 53 TRP HZ2 . . 4.550 3.816 3.551 3.940 . 0 0 "[ . 1 . 2]" 3
1007 1 42 GLN H 1 42 GLN QG . . 4.250 2.633 2.083 3.344 . 0 0 "[ . 1 . 2]" 3
1008 1 42 GLN HA 1 42 GLN QG . . 3.650 2.444 2.320 2.735 . 0 0 "[ . 1 . 2]" 3
1009 1 41 VAL MG1 1 42 GLN QG . . 5.500 5.249 4.963 5.496 . 0 0 "[ . 1 . 2]" 3
1010 1 41 VAL MG2 1 42 GLN QG . . 5.500 5.006 4.628 5.245 . 0 0 "[ . 1 . 2]" 3
1011 1 42 GLN QG 1 49 ILE MG . . 4.600 3.834 2.850 4.540 . 0 0 "[ . 1 . 2]" 3
1012 1 12 ARG HD3 1 53 TRP HZ2 . . 5.240 4.165 3.368 5.286 0.046 20 0 "[ . 1 . 2]" 3
1013 1 22 SER HA 1 29 VAL HB . . 5.280 5.119 4.993 5.256 . 0 0 "[ . 1 . 2]" 3
1014 1 28 SER HA 1 29 VAL HB . . 4.660 4.569 4.547 4.607 . 0 0 "[ . 1 . 2]" 3
1015 1 28 SER HB3 1 29 VAL HB . . 4.400 4.307 4.159 4.389 . 0 0 "[ . 1 . 2]" 3
1016 1 61 LYS HB2 1 61 LYS QE . . 4.550 3.398 2.004 4.017 . 0 0 "[ . 1 . 2]" 3
1017 1 61 LYS HB2 1 62 LYS H . . 4.500 4.026 3.773 4.166 . 0 0 "[ . 1 . 2]" 3
1018 1 81 GLU QB 1 84 GLN HG3 . . 4.510 4.428 4.351 4.508 . 0 0 "[ . 1 . 2]" 3
1019 1 80 TRP HD1 1 84 GLN HG3 . . 4.920 3.827 3.588 4.046 . 0 0 "[ . 1 . 2]" 3
1020 1 80 TRP HH2 1 84 GLN HG3 . . 5.500 5.177 5.005 5.244 . 0 0 "[ . 1 . 2]" 3
1021 1 82 ASP H 1 84 GLN HG3 . . 5.500 5.433 5.343 5.508 0.008 11 0 "[ . 1 . 2]" 3
1022 1 81 GLU HA 1 84 GLN HG3 . . 3.590 2.669 2.571 2.759 . 0 0 "[ . 1 . 2]" 3
1023 1 83 GLN H 1 84 GLN HG2 . . 5.050 4.392 4.263 4.470 . 0 0 "[ . 1 . 2]" 3
1024 1 82 ASP H 1 84 GLN HG2 . . 5.400 5.218 5.128 5.322 . 0 0 "[ . 1 . 2]" 3
1025 1 84 GLN HA 1 84 GLN HG2 . . 3.620 2.754 2.712 2.822 . 0 0 "[ . 1 . 2]" 3
1026 1 83 GLN HB2 1 84 GLN HG2 . . 4.330 3.325 3.238 3.387 . 0 0 "[ . 1 . 2]" 3
1027 1 14 GLU HB3 1 15 TYR H . . 4.010 3.939 3.802 4.012 0.002 14 0 "[ . 1 . 2]" 3
1028 1 13 ALA MB 1 14 GLU HB3 . . 5.100 4.535 4.468 4.657 . 0 0 "[ . 1 . 2]" 3
1029 1 85 LYS HB2 1 86 ILE H . . 3.870 2.957 2.879 3.060 . 0 0 "[ . 1 . 2]" 3
1030 1 35 PHE QE 1 85 LYS HB2 . . 4.390 2.855 2.664 2.996 . 0 0 "[ . 1 . 2]" 3
1031 1 67 LYS QB 1 67 LYS QD . . 3.360 2.143 2.031 2.311 . 0 0 "[ . 1 . 2]" 3
1032 1 67 LYS QB 1 90 VAL MG1 . . 4.990 4.321 4.144 4.540 . 0 0 "[ . 1 . 2]" 3
1033 1 85 LYS H 1 85 LYS HB3 . . 3.830 3.588 3.582 3.590 . 0 0 "[ . 1 . 2]" 3
1034 1 35 PHE QE 1 85 LYS HB3 . . 4.930 3.994 3.749 4.245 . 0 0 "[ . 1 . 2]" 3
1035 1 85 LYS HB3 1 85 LYS HE2 . . 5.270 4.593 4.494 4.681 . 0 0 "[ . 1 . 2]" 3
1036 1 85 LYS HB3 1 89 TYR HB2 . . 5.500 4.815 4.612 5.074 . 0 0 "[ . 1 . 2]" 3
1037 1 61 LYS HB3 1 61 LYS QE . . 4.680 3.453 2.558 4.158 . 0 0 "[ . 1 . 2]" 3
1038 1 14 GLU HB2 1 15 TYR HA . . 5.390 4.855 4.719 4.930 . 0 0 "[ . 1 . 2]" 3
1039 1 14 GLU HB2 1 36 ARG HE . . 5.500 5.251 4.955 5.456 . 0 0 "[ . 1 . 2]" 3
1040 1 39 LYS HB3 1 52 MET H . . 5.150 3.399 3.060 3.811 . 0 0 "[ . 1 . 2]" 3
1041 1 39 LYS HB3 1 52 MET HG3 . . 4.680 2.876 2.502 3.253 . 0 0 "[ . 1 . 2]" 3
1042 1 39 LYS HB3 1 52 MET HB3 . . 3.820 3.602 3.322 3.762 . 0 0 "[ . 1 . 2]" 3
1043 1 11 TRP HH2 1 39 LYS HB2 . . 4.690 2.996 2.710 3.341 . 0 0 "[ . 1 . 2]" 3
1044 1 11 TRP HZ3 1 39 LYS HB2 . . 4.590 2.680 2.494 3.082 . 0 0 "[ . 1 . 2]" 3
1045 1 39 LYS HB2 1 52 MET HB3 . . 4.690 4.657 4.590 4.697 0.007 15 0 "[ . 1 . 2]" 3
1046 1 39 LYS HB2 1 52 MET HB2 . . 4.770 3.263 3.094 3.578 . 0 0 "[ . 1 . 2]" 3
1047 1 10 PRO HB2 1 11 TRP HD1 . . 3.790 2.858 2.690 2.967 . 0 0 "[ . 1 . 2]" 3
1048 1 82 ASP HA 1 85 LYS HB3 . . 4.850 4.614 4.524 4.727 . 0 0 "[ . 1 . 2]" 3
1049 1 11 TRP HZ2 1 65 GLN HB3 . . 3.770 2.531 2.155 2.769 . 0 0 "[ . 1 . 2]" 3
1050 1 11 TRP HZ2 1 65 GLN HG2 . . 5.090 4.983 4.683 5.095 0.005 17 0 "[ . 1 . 2]" 3
1051 1 80 TRP HZ2 1 84 GLN HG3 . . 4.610 3.902 3.794 3.985 . 0 0 "[ . 1 . 2]" 3
1052 1 80 TRP HZ2 1 84 GLN HG2 . . 5.270 5.245 5.124 5.279 0.009 16 0 "[ . 1 . 2]" 3
1053 1 11 TRP HZ2 1 39 LYS HB2 . . 4.730 4.104 3.705 4.467 . 0 0 "[ . 1 . 2]" 3
1054 1 10 PRO HB3 1 11 TRP HD1 . . 4.430 4.341 4.186 4.443 0.013 6 0 "[ . 1 . 2]" 3
1055 1 9 LYS HA 1 10 PRO HB3 . . 4.940 4.836 4.831 4.862 . 0 0 "[ . 1 . 2]" 3
1056 1 10 PRO HB3 1 39 LYS HE2 . . 5.500 5.447 5.272 5.511 0.011 17 0 "[ . 1 . 2]" 3
1057 1 10 PRO HB3 1 11 TRP H . . 4.670 4.035 3.869 4.151 . 0 0 "[ . 1 . 2]" 3
1058 1 39 LYS H 1 52 MET HB2 . . 4.800 2.539 2.407 2.716 . 0 0 "[ . 1 . 2]" 3
1059 1 39 LYS HB3 1 52 MET HB2 . . 4.330 2.047 1.992 2.179 . 0 0 "[ . 1 . 2]" 3
1060 1 18 SER HA 1 32 LYS HB3 . . 4.420 2.279 2.176 2.467 . 0 0 "[ . 1 . 2]" 3
1061 1 32 LYS HB3 1 32 LYS QE . . 4.820 3.040 2.770 3.849 . 0 0 "[ . 1 . 2]" 3
1062 1 32 LYS HB2 1 32 LYS QE . . 4.810 2.737 2.505 3.705 . 0 0 "[ . 1 . 2]" 3
1063 1 36 ARG HD2 1 53 TRP HB2 . . 4.930 4.707 4.436 4.931 0.001 12 0 "[ . 1 . 2]" 3
1064 1 88 LYS QB 1 91 GLU QB . . 5.250 4.971 4.799 5.060 . 0 0 "[ . 1 . 2]" 3
1065 1 87 ARG H 1 88 LYS QB . . 5.400 4.910 4.867 4.952 . 0 0 "[ . 1 . 2]" 3
1066 1 88 LYS QB 1 90 VAL H . . 5.500 5.211 5.146 5.275 . 0 0 "[ . 1 . 2]" 3
1067 1 22 SER HA 1 23 CYS HB3 . . 4.980 4.686 4.647 4.753 . 0 0 "[ . 1 . 2]" 3
1068 1 23 CYS HB3 1 30 ILE HG13 . . 4.560 4.033 3.895 4.143 . 0 0 "[ . 1 . 2]" 3
1069 1 23 CYS HB3 1 30 ILE HG12 . . 4.800 4.600 4.410 4.743 . 0 0 "[ . 1 . 2]" 3
1070 1 26 CYS HB3 1 28 SER H . . 4.890 4.865 4.762 4.905 0.015 15 0 "[ . 1 . 2]" 3
1071 1 25 THR MG 1 26 CYS HB3 . . 4.500 2.981 2.845 3.160 . 0 0 "[ . 1 . 2]" 3
1072 1 52 MET H 1 52 MET HG3 . . 4.400 2.750 2.202 3.748 . 0 0 "[ . 1 . 2]" 3
1073 1 41 VAL MG1 1 52 MET HG3 . . 3.770 2.913 2.346 3.172 . 0 0 "[ . 1 . 2]" 3
1074 1 40 LEU HA 1 52 MET HG3 . . 5.500 5.324 4.744 5.541 0.041 17 0 "[ . 1 . 2]" 3
1075 1 51 PRO HA 1 52 MET HG3 . . 5.500 4.650 4.135 5.494 . 0 0 "[ . 1 . 2]" 3
1076 1 52 MET H 1 52 MET HG2 . . 4.180 2.744 2.094 3.098 . 0 0 "[ . 1 . 2]" 3
1077 1 51 PRO HA 1 52 MET HG2 . . 4.910 4.542 3.314 4.911 0.001 12 0 "[ . 1 . 2]" 3
1078 1 24 LYS QE 1 52 MET HG2 . . 4.880 4.503 4.098 4.886 0.006 17 0 "[ . 1 . 2]" 3
1079 1 52 MET ME 1 52 MET HG2 . . 3.890 2.477 2.000 3.360 . 0 0 "[ . 1 . 2]" 3
1080 1 41 VAL MG2 1 52 MET HG2 . . 3.780 3.421 2.696 3.788 0.008 3 0 "[ . 1 . 2]" 3
1081 1 22 SER HA 1 23 CYS HB2 . . 4.720 4.544 4.490 4.591 . 0 0 "[ . 1 . 2]" 3
1082 1 90 VAL H 1 90 VAL HB . . 3.950 3.602 3.573 3.625 . 0 0 "[ . 1 . 2]" 3
1083 1 90 VAL HB 1 91 GLU H . . 4.290 3.770 3.638 4.020 . 0 0 "[ . 1 . 2]" 3
1084 1 89 TYR H 1 90 VAL HB . . 5.500 5.544 5.516 5.584 0.084 19 0 "[ . 1 . 2]" 3
1085 1 89 TYR QD 1 90 VAL HB . . 4.950 4.722 4.347 4.950 . 0 0 "[ . 1 . 2]" 3
1086 1 68 SER HA 1 90 VAL HB . . 5.030 2.095 1.995 2.365 . 0 0 "[ . 1 . 2]" 3
1087 1 90 VAL HB 1 91 GLU HA . . 5.270 4.356 4.242 4.526 . 0 0 "[ . 1 . 2]" 3
1088 1 87 ARG HA 1 90 VAL HB . . 4.760 4.643 4.502 4.759 . 0 0 "[ . 1 . 2]" 3
1089 1 69 VAL MG1 1 90 VAL HB . . 4.690 4.440 4.289 4.694 0.004 8 0 "[ . 1 . 2]" 3
1090 1 23 CYS HB3 1 54 ASN HA . . 4.860 4.251 4.084 4.344 . 0 0 "[ . 1 . 2]" 3
1091 1 50 MET H 1 50 MET QG . . 4.310 3.311 1.869 4.178 . 0 0 "[ . 1 . 2]" 3
1092 1 50 MET QG 1 51 PRO QD . . 4.430 3.630 2.727 4.335 . 0 0 "[ . 1 . 2]" 3
1093 1 23 CYS HB2 1 30 ILE HG12 . . 4.450 3.060 2.944 3.123 . 0 0 "[ . 1 . 2]" 3
1094 1 72 VAL HB 1 73 GLU H . . 5.130 4.131 4.021 4.253 . 0 0 "[ . 1 . 2]" 3
1095 1 72 VAL HB 1 75 ILE H . . 4.770 4.493 4.136 4.672 . 0 0 "[ . 1 . 2]" 3
1096 1 13 ALA MB 1 72 VAL HB . . 5.050 4.120 3.988 4.422 . 0 0 "[ . 1 . 2]" 3
1097 1 72 VAL HB 1 75 ILE HG12 . . 5.500 4.508 4.336 4.679 . 0 0 "[ . 1 . 2]" 3
1098 1 69 VAL HB 1 72 VAL H . . 4.940 4.740 4.652 4.848 . 0 0 "[ . 1 . 2]" 3
1099 1 24 LYS QB 1 54 ASN HD22 . . 4.310 3.586 3.043 4.309 . 0 0 "[ . 1 . 2]" 3
1100 1 23 CYS HA 1 24 LYS QB . . 4.460 4.409 3.958 4.486 0.026 2 0 "[ . 1 . 2]" 3
1101 1 20 ARG HB2 1 20 ARG QD . . 3.910 3.059 2.044 3.508 . 0 0 "[ . 1 . 2]" 3
1102 1 20 ARG HB3 1 20 ARG QD . . 3.910 2.347 2.074 3.008 . 0 0 "[ . 1 . 2]" 3
1103 1 8 HIS HB3 1 49 ILE MD . . 5.030 4.695 4.147 5.035 0.005 12 0 "[ . 1 . 2]" 3
1104 1 79 ARG HB2 1 79 ARG HD3 . . 4.210 3.499 2.315 4.217 0.007 6 0 "[ . 1 . 2]" 3
1105 1 55 HIS HB3 1 58 CYS HB2 . . 4.510 3.939 3.902 3.970 . 0 0 "[ . 1 . 2]" 3
1106 1 38 GLY HA2 1 51 PRO HB2 . . 4.900 4.140 3.757 4.423 . 0 0 "[ . 1 . 2]" 3
1107 1 38 GLY HA3 1 51 PRO HB2 . . 4.620 3.357 2.886 3.692 . 0 0 "[ . 1 . 2]" 3
1108 1 11 TRP HH2 1 65 GLN HB3 . . 4.900 2.979 2.566 3.324 . 0 0 "[ . 1 . 2]" 3
1109 1 65 GLN HB3 1 89 TYR QE . . 4.920 4.451 4.041 4.877 . 0 0 "[ . 1 . 2]" 3
1110 1 65 GLN HB3 1 66 ILE HG13 . . 4.490 3.024 2.696 3.237 . 0 0 "[ . 1 . 2]" 3
1111 1 65 GLN HB3 1 66 ILE MD . . 5.200 4.215 3.818 4.407 . 0 0 "[ . 1 . 2]" 3
1112 1 11 TRP HZ2 1 65 GLN HB2 . . 4.230 3.993 3.661 4.238 0.008 12 0 "[ . 1 . 2]" 3
1113 1 11 TRP HH2 1 65 GLN HB2 . . 5.220 4.686 4.273 5.060 . 0 0 "[ . 1 . 2]" 3
1114 1 90 VAL MG2 1 91 GLU QB . . 4.380 3.620 3.543 3.712 . 0 0 "[ . 1 . 2]" 3
1115 1 35 PHE QD 1 85 LYS HD3 . . 4.870 4.551 4.279 4.754 . 0 0 "[ . 1 . 2]" 3
1116 1 35 PHE QE 1 85 LYS HD3 . . 4.860 4.227 4.023 4.406 . 0 0 "[ . 1 . 2]" 3
1117 1 82 ASP HA 1 85 LYS HD3 . . 4.390 4.114 3.893 4.329 . 0 0 "[ . 1 . 2]" 3
1118 1 64 LYS HB2 1 64 LYS QE . . 4.170 3.817 3.199 4.255 0.085 17 0 "[ . 1 . 2]" 3
1119 1 85 LYS HB2 1 85 LYS HD3 . . 3.600 3.307 3.220 3.392 . 0 0 "[ . 1 . 2]" 3
1120 1 60 LEU MD1 1 85 LYS HD3 . . 4.360 3.177 2.983 3.292 . 0 0 "[ . 1 . 2]" 3
1121 1 85 LYS H 1 85 LYS HD2 . . 4.600 3.964 3.776 4.113 . 0 0 "[ . 1 . 2]" 3
1122 1 85 LYS HB2 1 85 LYS HD2 . . 3.740 2.269 2.186 2.333 . 0 0 "[ . 1 . 2]" 3
1123 1 60 LEU MD1 1 85 LYS HD2 . . 4.330 3.210 3.015 3.300 . 0 0 "[ . 1 . 2]" 3
1124 1 88 LYS QD 1 91 GLU QB . . 4.880 4.594 4.379 4.679 . 0 0 "[ . 1 . 2]" 3
1125 1 64 LYS HB3 1 64 LYS QE . . 4.750 3.946 3.633 4.037 . 0 0 "[ . 1 . 2]" 3
1126 1 64 LYS HB3 1 64 LYS HD2 . . 3.770 2.404 2.111 2.739 . 0 0 "[ . 1 . 2]" 3
1127 1 85 LYS H 1 85 LYS HD3 . . 4.910 4.796 4.677 4.918 0.008 20 0 "[ . 1 . 2]" 3
1128 1 87 ARG HB3 1 88 LYS H . . 4.260 3.989 3.881 4.037 . 0 0 "[ . 1 . 2]" 3
1129 1 87 ARG HB3 1 87 ARG HD2 . . 4.040 2.115 2.044 2.327 . 0 0 "[ . 1 . 2]" 3
1130 1 69 VAL MG1 1 87 ARG HB3 . . 4.500 1.964 1.937 2.041 . 0 0 "[ . 1 . 2]" 3
1131 1 69 VAL MG1 1 87 ARG HB2 . . 4.430 3.177 2.882 3.420 . 0 0 "[ . 1 . 2]" 3
1132 1 61 LYS QD 1 62 LYS H . . 4.340 3.925 2.474 4.348 0.008 7 0 "[ . 1 . 2]" 3
1133 1 62 LYS H 1 62 LYS QD . . 4.720 4.095 3.202 4.475 . 0 0 "[ . 1 . 2]" 3
1134 1 59 ILE HA 1 62 LYS QD . . 4.040 3.374 1.766 3.972 . 0 0 "[ . 1 . 2]" 3
1135 1 61 LYS HB2 1 61 LYS QD . . 3.100 2.210 2.065 2.468 . 0 0 "[ . 1 . 2]" 3
1136 1 62 LYS HB2 1 62 LYS QD . . 3.500 2.508 2.073 2.907 . 0 0 "[ . 1 . 2]" 3
1137 1 25 THR MG 1 61 LYS QD . . 4.210 3.444 2.733 3.911 . 0 0 "[ . 1 . 2]" 3
1138 1 25 THR MG 1 62 LYS QD . . 4.560 3.500 1.815 4.490 . 0 0 "[ . 1 . 2]" 3
1139 1 59 ILE MD 1 62 LYS QD . . 3.750 3.384 2.135 3.768 0.018 1 0 "[ . 1 . 2]" 3
1140 1 32 LYS HA 1 32 LYS QD . . 4.460 4.281 4.232 4.319 . 0 0 "[ . 1 . 2]" 3
1141 1 63 THR HB 1 64 LYS H . . 3.460 3.402 3.003 3.467 0.007 2 0 "[ . 1 . 2]" 3
1142 1 63 THR HB 1 64 LYS HA . . 5.250 5.070 4.759 5.186 . 0 0 "[ . 1 . 2]" 3
1143 1 63 THR HB 1 64 LYS QE . . 4.890 4.544 4.175 4.903 0.013 17 0 "[ . 1 . 2]" 3
1144 1 63 THR HB 1 64 LYS HB3 . . 5.500 5.321 5.106 5.464 . 0 0 "[ . 1 . 2]" 3
1145 1 63 THR HB 1 65 GLN HG2 . . 5.500 5.002 4.861 5.109 . 0 0 "[ . 1 . 2]" 3
1146 1 63 THR HB 1 64 LYS HB2 . . 4.520 3.795 3.589 4.008 . 0 0 "[ . 1 . 2]" 3
1147 1 63 THR HB 1 94 ALA MB . . 5.480 4.311 3.704 5.492 0.012 19 0 "[ . 1 . 2]" 3
1148 1 42 GLN H 1 42 GLN HB3 . . 4.150 3.660 3.594 3.776 . 0 0 "[ . 1 . 2]" 3
1149 1 58 CYS HA 1 61 LYS QD . . 3.960 3.459 3.007 3.967 0.007 4 0 "[ . 1 . 2]" 3
1150 1 9 LYS HD2 1 73 GLU HB2 . . 3.560 2.290 1.968 2.932 . 0 0 "[ . 1 . 2]" 3
1151 1 61 LYS H 1 61 LYS QD . . 4.420 4.160 3.603 4.420 . 0 0 "[ . 1 . 2]" 3
1152 1 61 LYS HA 1 61 LYS QD . . 4.250 4.094 3.741 4.201 . 0 0 "[ . 1 . 2]" 3
1153 1 9 LYS HD3 1 73 GLU HB2 . . 3.560 2.491 1.992 3.620 0.060 6 0 "[ . 1 . 2]" 3
1154 1 80 TRP HB2 1 80 TRP HE3 . . 4.010 3.894 3.867 3.932 . 0 0 "[ . 1 . 2]" 3
1155 1 64 LYS HB3 1 64 LYS HD3 . . 3.770 2.688 2.304 3.428 . 0 0 "[ . 1 . 2]" 3
1156 1 64 LYS HA 1 64 LYS HD3 . . 4.420 3.924 2.533 4.403 . 0 0 "[ . 1 . 2]" 3
1157 1 75 ILE HG13 1 76 GLU H . . 5.130 4.908 4.789 4.993 . 0 0 "[ . 1 . 2]" 3
1158 1 75 ILE HG13 1 83 GLN HG2 . . 4.100 3.588 3.439 3.661 . 0 0 "[ . 1 . 2]" 3
1159 1 72 VAL HB 1 75 ILE HG13 . . 4.320 3.938 3.745 4.081 . 0 0 "[ . 1 . 2]" 3
1160 1 75 ILE HG12 1 76 GLU H . . 5.260 4.271 4.022 4.403 . 0 0 "[ . 1 . 2]" 3
1161 1 75 ILE H 1 75 ILE HG12 . . 4.770 4.541 4.494 4.576 . 0 0 "[ . 1 . 2]" 3
1162 1 75 ILE HA 1 75 ILE HG12 . . 3.670 3.070 3.012 3.119 . 0 0 "[ . 1 . 2]" 3
1163 1 75 ILE HG12 1 83 GLN HG2 . . 3.840 2.907 2.780 2.985 . 0 0 "[ . 1 . 2]" 3
1164 1 75 ILE HG12 1 83 GLN HB3 . . 4.170 3.417 3.222 3.622 . 0 0 "[ . 1 . 2]" 3
1165 1 75 ILE HG12 1 86 ILE MD . . 4.870 4.767 4.653 4.857 . 0 0 "[ . 1 . 2]" 3
1166 1 75 ILE HG12 1 78 LEU MD1 . . 3.950 3.277 2.849 3.434 . 0 0 "[ . 1 . 2]" 3
1167 1 79 ARG H 1 79 ARG HG3 . . 4.050 3.405 2.610 3.974 . 0 0 "[ . 1 . 2]" 3
1168 1 87 ARG HG3 1 88 LYS H . . 3.980 2.682 2.605 2.854 . 0 0 "[ . 1 . 2]" 3
1169 1 87 ARG HG3 1 89 TYR H . . 4.990 4.965 4.862 5.000 0.010 12 0 "[ . 1 . 2]" 3
1170 1 88 LYS HA 1 88 LYS QD . . 3.360 2.481 2.435 2.594 . 0 0 "[ . 1 . 2]" 3
1171 1 80 TRP HZ3 1 81 GLU QB . . 4.460 3.868 3.598 4.010 . 0 0 "[ . 1 . 2]" 3
1172 1 84 GLN HB2 1 86 ILE H . . 4.970 4.851 4.771 4.910 . 0 0 "[ . 1 . 2]" 3
1173 1 84 GLN HA 1 87 ARG HG3 . . 3.930 2.888 2.667 3.375 . 0 0 "[ . 1 . 2]" 3
1174 1 26 CYS H 1 58 CYS HB2 . . 5.290 4.953 4.725 5.297 0.007 8 0 "[ . 1 . 2]" 3
1175 1 25 THR HB 1 58 CYS HB2 . . 3.910 3.271 3.216 3.359 . 0 0 "[ . 1 . 2]" 3
1176 1 55 HIS HB2 1 58 CYS HB2 . . 4.010 2.409 2.370 2.440 . 0 0 "[ . 1 . 2]" 3
1177 1 54 ASN HB3 1 58 CYS HB2 . . 4.380 3.055 2.901 3.142 . 0 0 "[ . 1 . 2]" 3
1178 1 26 CYS H 1 58 CYS HB3 . . 5.090 4.116 3.891 4.481 . 0 0 "[ . 1 . 2]" 3
1179 1 55 HIS HB2 1 58 CYS HB3 . . 4.380 3.843 3.815 3.870 . 0 0 "[ . 1 . 2]" 3
1180 1 55 HIS HB3 1 58 CYS HB3 . . 5.500 5.499 5.468 5.528 0.028 12 0 "[ . 1 . 2]" 3
1181 1 54 ASN HB3 1 58 CYS HB3 . . 4.620 3.359 3.094 3.554 . 0 0 "[ . 1 . 2]" 3
1182 1 69 VAL MG1 1 87 ARG HG3 . . 4.440 4.338 4.264 4.471 0.031 8 0 "[ . 1 . 2]" 3
1183 1 84 GLN HA 1 87 ARG HG2 . . 3.560 2.161 2.071 2.238 . 0 0 "[ . 1 . 2]" 3
1184 1 11 TRP HH2 1 39 LYS HD2 . . 4.750 2.382 2.152 2.939 . 0 0 "[ . 1 . 2]" 3
1185 1 39 LYS HB3 1 39 LYS HD2 . . 3.860 2.996 2.826 3.129 . 0 0 "[ . 1 . 2]" 3
1186 1 39 LYS HB2 1 39 LYS HD2 . . 4.180 2.200 2.088 2.386 . 0 0 "[ . 1 . 2]" 3
1187 1 39 LYS H 1 39 LYS HD2 . . 5.500 4.732 4.674 4.812 . 0 0 "[ . 1 . 2]" 3
1188 1 11 TRP HZ2 1 39 LYS HD2 . . 4.800 2.702 2.231 3.256 . 0 0 "[ . 1 . 2]" 3
1189 1 39 LYS HA 1 39 LYS HD2 . . 4.990 4.089 3.908 4.315 . 0 0 "[ . 1 . 2]" 3
1190 1 39 LYS H 1 39 LYS HD3 . . 5.500 5.255 5.149 5.351 . 0 0 "[ . 1 . 2]" 3
1191 1 11 TRP HZ2 1 39 LYS HD3 . . 4.800 4.154 3.794 4.739 . 0 0 "[ . 1 . 2]" 3
1192 1 11 TRP HH2 1 39 LYS HD3 . . 4.750 4.001 3.859 4.684 . 0 0 "[ . 1 . 2]" 3
1193 1 39 LYS HA 1 39 LYS HD3 . . 4.990 4.753 4.700 4.784 . 0 0 "[ . 1 . 2]" 3
1194 1 39 LYS HB3 1 39 LYS HD3 . . 3.860 2.882 2.633 3.054 . 0 0 "[ . 1 . 2]" 3
1195 1 39 LYS HB2 1 39 LYS HD3 . . 4.180 3.135 3.013 3.283 . 0 0 "[ . 1 . 2]" 3
1196 1 58 CYS HB3 1 59 ILE MD . . 5.110 3.982 3.439 4.209 . 0 0 "[ . 1 . 2]" 3
1197 1 25 THR HB 1 27 LYS H . . 4.890 4.546 4.375 4.749 . 0 0 "[ . 1 . 2]" 3
1198 1 25 THR HB 1 58 CYS HB3 . . 3.540 2.011 1.990 2.082 . 0 0 "[ . 1 . 2]" 3
1199 1 76 GLU H 1 76 GLU HB2 . . 3.640 3.604 3.593 3.619 . 0 0 "[ . 1 . 2]" 3
1200 1 75 ILE MG 1 76 GLU HB2 . . 4.580 4.377 4.250 4.446 . 0 0 "[ . 1 . 2]" 3
1201 1 75 ILE MG 1 76 GLU HB3 . . 4.740 3.078 2.998 3.169 . 0 0 "[ . 1 . 2]" 3
1202 1 75 ILE H 1 76 GLU HB3 . . 5.150 4.879 4.740 5.032 . 0 0 "[ . 1 . 2]" 3
1203 1 24 LYS HA 1 24 LYS QD . . 3.080 2.527 2.141 3.221 0.141 18 0 "[ . 1 . 2]" 3
1204 1 24 LYS QB 1 24 LYS QD . . 3.060 2.220 2.034 2.513 . 0 0 "[ . 1 . 2]" 3
1205 1 33 GLU HB2 1 34 ASN H . . 4.940 4.022 4.011 4.071 . 0 0 "[ . 1 . 2]" 3
1206 1 32 LYS HG2 1 33 GLU HB3 . . 4.940 4.888 4.863 4.899 . 0 0 "[ . 1 . 2]" 3
1207 1 75 ILE MD 1 83 GLN HB2 . . 5.330 5.162 5.006 5.266 . 0 0 "[ . 1 . 2]" 3
1208 1 80 TRP HA 1 83 GLN HB3 . . 4.560 4.472 4.436 4.506 . 0 0 "[ . 1 . 2]" 3
1209 1 75 ILE MD 1 83 GLN HB3 . . 4.650 3.823 3.648 3.961 . 0 0 "[ . 1 . 2]" 3
1210 1 83 GLN HB3 1 84 GLN H . . 4.210 3.908 3.834 3.982 . 0 0 "[ . 1 . 2]" 3
1211 1 24 LYS H 1 24 LYS QD . . 4.530 4.186 3.973 4.344 . 0 0 "[ . 1 . 2]" 3
1212 1 35 PHE QE 1 86 ILE HG13 . . 4.680 4.448 4.249 4.638 . 0 0 "[ . 1 . 2]" 3
1213 1 86 ILE HG13 1 87 ARG H . . 4.540 4.269 4.208 4.392 . 0 0 "[ . 1 . 2]" 3
1214 1 83 GLN HA 1 86 ILE HG13 . . 3.670 2.970 2.751 3.126 . 0 0 "[ . 1 . 2]" 3
1215 1 78 LEU MD1 1 86 ILE HG13 . . 4.430 3.127 2.924 3.243 . 0 0 "[ . 1 . 2]" 3
1216 1 60 LEU MD2 1 86 ILE HG13 . . 5.120 4.888 4.727 5.103 . 0 0 "[ . 1 . 2]" 3
1217 1 12 ARG HG3 1 53 TRP HH2 . . 4.630 3.484 2.812 4.194 . 0 0 "[ . 1 . 2]" 3
1218 1 75 ILE MD 1 86 ILE HG12 . . 4.500 3.246 3.060 3.425 . 0 0 "[ . 1 . 2]" 3
1219 1 35 PHE QE 1 86 ILE HG12 . . 4.600 3.778 3.552 4.121 . 0 0 "[ . 1 . 2]" 3
1220 1 35 PHE HZ 1 86 ILE HG12 . . 3.980 3.680 3.541 3.821 . 0 0 "[ . 1 . 2]" 3
1221 1 83 GLN HA 1 86 ILE HG12 . . 3.650 2.867 2.657 3.003 . 0 0 "[ . 1 . 2]" 3
1222 1 60 LEU MD1 1 86 ILE HG12 . . 4.440 4.104 3.883 4.367 . 0 0 "[ . 1 . 2]" 3
1223 1 60 LEU MD2 1 86 ILE HG12 . . 4.430 4.220 4.005 4.440 0.010 12 0 "[ . 1 . 2]" 3
1224 1 10 PRO HG3 1 71 ASP HA . . 4.830 4.206 3.940 4.449 . 0 0 "[ . 1 . 2]" 3
1225 1 10 PRO HG3 1 71 ASP HB2 . . 4.590 3.594 2.130 4.282 . 0 0 "[ . 1 . 2]" 3
1226 1 10 PRO HG2 1 11 TRP HD1 . . 4.020 2.214 1.998 2.385 . 0 0 "[ . 1 . 2]" 3
1227 1 9 LYS HA 1 10 PRO HG2 . . 4.630 4.403 4.290 4.572 . 0 0 "[ . 1 . 2]" 3
1228 1 10 PRO HG2 1 71 ASP HB2 . . 4.590 3.213 2.060 3.718 . 0 0 "[ . 1 . 2]" 3
1229 1 20 ARG H 1 20 ARG HG2 . . 4.460 3.169 2.623 4.273 . 0 0 "[ . 1 . 2]" 3
1230 1 20 ARG HA 1 20 ARG HG2 . . 3.750 2.593 2.226 2.950 . 0 0 "[ . 1 . 2]" 3
1231 1 49 ILE H 1 49 ILE HG13 . . 4.260 2.635 1.921 4.100 . 0 0 "[ . 1 . 2]" 3
1232 1 40 LEU H 1 40 LEU HG . . 3.750 2.134 1.896 2.328 . 0 0 "[ . 1 . 2]" 3
1233 1 11 TRP HZ3 1 59 ILE HG12 . . 4.780 4.269 3.922 4.731 . 0 0 "[ . 1 . 2]" 3
1234 1 11 TRP HH2 1 59 ILE HG12 . . 5.500 5.047 4.747 5.462 . 0 0 "[ . 1 . 2]" 3
1235 1 54 ASN HD22 1 59 ILE HG12 . . 5.500 5.307 5.049 5.502 0.002 11 0 "[ . 1 . 2]" 3
1236 1 54 ASN HB2 1 59 ILE HG12 . . 3.990 2.311 2.092 2.465 . 0 0 "[ . 1 . 2]" 3
1237 1 39 LYS HA 1 40 LEU HG . . 5.190 3.951 3.768 4.119 . 0 0 "[ . 1 . 2]" 3
1238 1 37 LEU H 1 37 LEU HG . . 4.440 3.415 3.311 3.590 . 0 0 "[ . 1 . 2]" 3
1239 1 54 ASN HB2 1 59 ILE HG13 . . 4.210 2.493 2.355 2.626 . 0 0 "[ . 1 . 2]" 3
1240 1 35 PHE QD 1 78 LEU MD1 . . 4.280 3.129 2.956 3.376 . 0 0 "[ . 1 . 2]" 3
1241 1 35 PHE QE 1 78 LEU MD1 . . 3.600 2.323 2.184 2.425 . 0 0 "[ . 1 . 2]" 3
1242 1 35 PHE HZ 1 78 LEU MD1 . . 3.680 2.808 2.612 2.967 . 0 0 "[ . 1 . 2]" 3
1243 1 78 LEU MD1 1 82 ASP HA . . 4.970 4.651 4.532 4.789 . 0 0 "[ . 1 . 2]" 3
1244 1 78 LEU MD1 1 83 GLN HG2 . . 3.970 3.205 2.713 3.422 . 0 0 "[ . 1 . 2]" 3
1245 1 78 LEU MD1 1 82 ASP HB2 . . 3.580 3.435 3.290 3.563 . 0 0 "[ . 1 . 2]" 3
1246 1 75 ILE HB 1 78 LEU MD1 . . 3.990 3.492 3.332 3.654 . 0 0 "[ . 1 . 2]" 3
1247 1 78 LEU HB2 1 78 LEU MD1 . . 3.280 2.244 2.172 2.351 . 0 0 "[ . 1 . 2]" 3
1248 1 75 ILE HG13 1 78 LEU MD1 . . 3.510 2.081 1.885 2.261 . 0 0 "[ . 1 . 2]" 3
1249 1 13 ALA MB 1 78 LEU MD1 . . 2.900 1.752 1.685 1.847 . 0 0 "[ . 1 . 2]" 3
1250 1 75 ILE MG 1 78 LEU MD1 . . 4.300 4.147 3.936 4.212 . 0 0 "[ . 1 . 2]" 3
1251 1 37 LEU MD2 1 78 LEU MD1 . . 3.460 3.234 3.007 3.397 . 0 0 "[ . 1 . 2]" 3
1252 1 11 TRP HH2 1 59 ILE HG13 . . 4.760 3.929 3.424 4.352 . 0 0 "[ . 1 . 2]" 3
1253 1 11 TRP HZ3 1 59 ILE HG13 . . 4.430 2.647 2.243 3.162 . 0 0 "[ . 1 . 2]" 3
1254 1 23 CYS HB2 1 30 ILE HG13 . . 4.280 2.945 2.876 3.027 . 0 0 "[ . 1 . 2]" 3
1255 1 56 ALA MB 1 60 LEU HG . . 4.710 3.782 3.603 3.960 . 0 0 "[ . 1 . 2]" 3
1256 1 59 ILE HB 1 60 LEU HG . . 4.650 3.440 3.333 3.553 . 0 0 "[ . 1 . 2]" 3
1257 1 37 LEU MD1 1 60 LEU HG . . 4.190 2.783 2.501 3.009 . 0 0 "[ . 1 . 2]" 3
1258 1 9 LYS H 1 9 LYS HG2 . . 4.420 4.203 4.091 4.319 . 0 0 "[ . 1 . 2]" 3
1259 1 9 LYS HG2 1 73 GLU HB2 . . 3.880 3.806 3.503 3.916 0.036 17 0 "[ . 1 . 2]" 3
1260 1 9 LYS HG3 1 73 GLU HB2 . . 4.410 4.130 3.889 4.425 0.015 3 0 "[ . 1 . 2]" 3
1261 1 24 LYS QB 1 25 THR HA . . 4.840 3.996 3.868 4.678 . 0 0 "[ . 1 . 2]" 3
1262 1 85 LYS HG3 1 86 ILE H . . 4.880 4.404 4.320 4.522 . 0 0 "[ . 1 . 2]" 3
1263 1 82 ASP HA 1 85 LYS HG3 . . 4.060 2.912 2.761 3.031 . 0 0 "[ . 1 . 2]" 3
1264 1 85 LYS HA 1 85 LYS HG3 . . 3.770 2.994 2.929 3.039 . 0 0 "[ . 1 . 2]" 3
1265 1 85 LYS HE2 1 85 LYS HG3 . . 4.110 2.665 2.477 2.891 . 0 0 "[ . 1 . 2]" 3
1266 1 85 LYS HE3 1 85 LYS HG3 . . 3.910 2.411 2.197 2.563 . 0 0 "[ . 1 . 2]" 3
1267 1 60 LEU MD1 1 85 LYS HG2 . . 4.550 3.572 3.486 3.664 . 0 0 "[ . 1 . 2]" 3
1268 1 85 LYS HG2 1 86 ILE H . . 5.210 5.147 5.104 5.203 . 0 0 "[ . 1 . 2]" 3
1269 1 85 LYS HE3 1 85 LYS HG2 . . 3.890 3.434 3.254 3.581 . 0 0 "[ . 1 . 2]" 3
1270 1 60 LEU MD1 1 85 LYS HG3 . . 4.680 4.215 4.152 4.273 . 0 0 "[ . 1 . 2]" 3
1271 1 64 LYS HA 1 64 LYS HG2 . . 3.620 2.388 2.285 2.634 . 0 0 "[ . 1 . 2]" 3
1272 1 27 LYS HA 1 27 LYS HG2 . . 4.040 3.295 3.038 3.613 . 0 0 "[ . 1 . 2]" 3
1273 1 27 LYS HA 1 27 LYS HG3 . . 4.040 3.289 2.384 3.897 . 0 0 "[ . 1 . 2]" 3
1274 1 68 SER HA 1 69 VAL HA . . 4.540 4.300 4.297 4.306 . 0 0 "[ . 1 . 2]" 3
1275 1 69 VAL HA 1 69 VAL MG1 . . 2.900 2.255 2.192 2.320 . 0 0 "[ . 1 . 2]" 3
1276 1 69 VAL HA 1 75 ILE MD . . 3.410 2.760 2.624 2.907 . 0 0 "[ . 1 . 2]" 3
1277 1 69 VAL HA 1 72 VAL MG2 . . 3.300 2.397 2.066 2.612 . 0 0 "[ . 1 . 2]" 3
1278 1 66 ILE MG 1 69 VAL HA . . 3.960 3.450 3.284 3.604 . 0 0 "[ . 1 . 2]" 3
1279 1 88 LYS H 1 88 LYS HG3 . . 3.610 3.263 3.235 3.303 . 0 0 "[ . 1 . 2]" 3
1280 1 88 LYS HG3 1 89 TYR H . . 5.340 5.358 5.341 5.377 0.037 20 0 "[ . 1 . 2]" 3
1281 1 88 LYS HA 1 88 LYS HG3 . . 3.970 3.840 3.815 3.865 . 0 0 "[ . 1 . 2]" 3
1282 1 84 GLN HA 1 88 LYS HG3 . . 5.200 3.555 3.433 3.705 . 0 0 "[ . 1 . 2]" 3
1283 1 88 LYS QD 1 88 LYS HG3 . . 2.560 2.393 2.241 2.490 . 0 0 "[ . 1 . 2]" 3
1284 1 17 LYS HA 1 17 LYS HG2 . . 3.680 2.709 2.343 3.544 . 0 0 "[ . 1 . 2]" 3
1285 1 69 VAL HA 1 72 VAL HB . . 4.430 3.208 3.011 3.445 . 0 0 "[ . 1 . 2]" 3
1286 1 61 LYS QE 1 61 LYS HG3 . . 3.820 2.899 2.438 3.301 . 0 0 "[ . 1 . 2]" 3
1287 1 67 LYS H 1 67 LYS QG . . 4.150 3.711 1.878 4.103 . 0 0 "[ . 1 . 2]" 3
1288 1 32 LYS HA 1 32 LYS HG2 . . 3.970 3.601 3.594 3.606 . 0 0 "[ . 1 . 2]" 3
1289 1 32 LYS HG2 1 33 GLU H . . 4.190 3.879 3.806 3.936 . 0 0 "[ . 1 . 2]" 3
1290 1 18 SER HA 1 32 LYS HG2 . . 4.940 4.616 4.498 4.755 . 0 0 "[ . 1 . 2]" 3
1291 1 32 LYS HG2 1 33 GLU HB2 . . 4.940 3.807 3.757 3.836 . 0 0 "[ . 1 . 2]" 3
1292 1 32 LYS HG3 1 33 GLU H . . 4.090 3.317 3.230 3.443 . 0 0 "[ . 1 . 2]" 3
1293 1 18 SER HA 1 32 LYS HG3 . . 4.660 4.671 4.652 4.693 0.033 15 0 "[ . 1 . 2]" 3
1294 1 32 LYS HG3 1 33 GLU HA . . 5.020 4.323 4.260 4.406 . 0 0 "[ . 1 . 2]" 3
1295 1 60 LEU MD1 1 86 ILE H . . 4.270 4.062 3.925 4.215 . 0 0 "[ . 1 . 2]" 3
1296 1 35 PHE QE 1 60 LEU MD1 . . 3.640 3.341 3.107 3.585 . 0 0 "[ . 1 . 2]" 3
1297 1 66 ILE HG13 1 89 TYR QE . . 3.850 3.189 2.540 3.814 . 0 0 "[ . 1 . 2]" 3
1298 1 66 ILE HA 1 66 ILE HG13 . . 3.960 3.011 2.935 3.071 . 0 0 "[ . 1 . 2]" 3
1299 1 60 LEU MD1 1 85 LYS HA . . 4.430 3.565 3.442 3.667 . 0 0 "[ . 1 . 2]" 3
1300 1 57 SER HA 1 60 LEU MD1 . . 3.610 2.947 2.708 3.228 . 0 0 "[ . 1 . 2]" 3
1301 1 60 LEU MD1 1 86 ILE HA . . 3.990 3.565 3.333 3.763 . 0 0 "[ . 1 . 2]" 3
1302 1 56 ALA HA 1 60 LEU MD1 . . 4.290 4.067 3.776 4.265 . 0 0 "[ . 1 . 2]" 3
1303 1 60 LEU MD1 1 89 TYR HB3 . . 4.410 4.210 3.956 4.403 . 0 0 "[ . 1 . 2]" 3
1304 1 60 LEU MD1 1 89 TYR HB2 . . 4.160 3.762 3.536 3.880 . 0 0 "[ . 1 . 2]" 3
1305 1 60 LEU MD1 1 85 LYS HB2 . . 3.700 2.616 2.484 2.783 . 0 0 "[ . 1 . 2]" 3
1306 1 60 LEU MD1 1 85 LYS HB3 . . 3.130 1.833 1.789 1.880 . 0 0 "[ . 1 . 2]" 3
1307 1 65 GLN HB2 1 66 ILE HG13 . . 3.870 2.771 2.518 2.952 . 0 0 "[ . 1 . 2]" 3
1308 1 60 LEU QB 1 60 LEU MD1 . . 2.910 2.088 2.074 2.098 . 0 0 "[ . 1 . 2]" 3
1309 1 60 LEU MD1 1 86 ILE MD . . 3.280 2.750 2.553 2.917 . 0 0 "[ . 1 . 2]" 3
1310 1 59 ILE MG 1 66 ILE HG13 . . 3.850 3.131 2.919 3.334 . 0 0 "[ . 1 . 2]" 3
1311 1 37 LEU H 1 37 LEU MD1 . . 4.430 4.253 4.111 4.353 . 0 0 "[ . 1 . 2]" 3
1312 1 11 TRP HE3 1 37 LEU MD1 . . 4.370 3.644 3.190 3.881 . 0 0 "[ . 1 . 2]" 3
1313 1 35 PHE QE 1 37 LEU MD1 . . 4.040 3.646 3.409 3.844 . 0 0 "[ . 1 . 2]" 3
1314 1 35 PHE HZ 1 37 LEU MD1 . . 4.290 3.117 2.678 3.381 . 0 0 "[ . 1 . 2]" 3
1315 1 11 TRP HZ3 1 37 LEU MD1 . . 4.710 3.745 3.358 4.199 . 0 0 "[ . 1 . 2]" 3
1316 1 37 LEU HA 1 37 LEU MD1 . . 4.070 3.854 3.829 3.897 . 0 0 "[ . 1 . 2]" 3
1317 1 37 LEU MD1 1 57 SER HA . . 5.500 5.128 4.970 5.240 . 0 0 "[ . 1 . 2]" 3
1318 1 37 LEU MD1 1 59 ILE HA . . 5.500 4.862 4.673 5.019 . 0 0 "[ . 1 . 2]" 3
1319 1 37 LEU MD1 1 59 ILE HB . . 3.330 2.290 2.029 2.493 . 0 0 "[ . 1 . 2]" 3
1320 1 37 LEU HB3 1 37 LEU MD1 . . 3.260 2.387 2.283 2.552 . 0 0 "[ . 1 . 2]" 3
1321 1 37 LEU MD1 1 66 ILE MD . . 3.090 2.402 2.167 2.722 . 0 0 "[ . 1 . 2]" 3
1322 1 11 TRP HD1 1 66 ILE HG12 . . 4.650 3.104 2.876 3.351 . 0 0 "[ . 1 . 2]" 3
1323 1 66 ILE HG12 1 89 TYR QE . . 5.050 4.521 3.998 4.989 . 0 0 "[ . 1 . 2]" 3
1324 1 62 LYS QE 1 62 LYS HG2 . . 3.880 2.942 2.174 3.296 . 0 0 "[ . 1 . 2]" 3
1325 1 32 LYS HG2 1 33 GLU HA . . 4.950 5.018 4.988 5.039 0.089 9 0 "[ . 1 . 2]" 3
1326 1 21 SER QB 1 22 SER H . . 3.920 2.840 2.465 3.523 . 0 0 "[ . 1 . 2]" 3
1327 1 21 SER QB 1 53 TRP HB2 . . 4.220 3.472 2.937 4.225 0.005 10 0 "[ . 1 . 2]" 3
1328 1 21 SER QB 1 53 TRP HB3 . . 4.720 3.484 2.860 4.116 . 0 0 "[ . 1 . 2]" 3
1329 1 21 SER QB 1 30 ILE HB . . 4.470 3.598 2.845 4.264 . 0 0 "[ . 1 . 2]" 3
1330 1 21 SER QB 1 30 ILE MG . . 5.230 4.344 3.696 4.992 . 0 0 "[ . 1 . 2]" 3
1331 1 21 SER QB 1 53 TRP HD1 . . 3.950 3.072 2.561 3.556 . 0 0 "[ . 1 . 2]" 3
1332 1 89 TYR QD 1 90 VAL HA . . 3.770 3.252 2.598 3.598 . 0 0 "[ . 1 . 2]" 3
1333 1 89 TYR QE 1 90 VAL HA . . 4.570 4.100 3.598 4.350 . 0 0 "[ . 1 . 2]" 3
1334 1 67 LYS HA 1 90 VAL HA . . 5.200 4.718 4.374 4.961 . 0 0 "[ . 1 . 2]" 3
1335 1 90 VAL HA 1 90 VAL MG1 . . 2.660 2.253 2.117 2.361 . 0 0 "[ . 1 . 2]" 3
1336 1 66 ILE MG 1 90 VAL HA . . 5.060 4.472 4.224 4.741 . 0 0 "[ . 1 . 2]" 3
1337 1 36 ARG HG2 1 53 TRP HE3 . . 5.500 4.729 4.265 5.043 . 0 0 "[ . 1 . 2]" 3
1338 1 14 GLU H 1 36 ARG HG2 . . 5.500 4.470 4.249 4.650 . 0 0 "[ . 1 . 2]" 3
1339 1 36 ARG HG2 1 37 LEU H . . 5.500 4.552 4.413 4.703 . 0 0 "[ . 1 . 2]" 3
1340 1 14 GLU H 1 36 ARG HG3 . . 5.450 3.796 3.579 4.031 . 0 0 "[ . 1 . 2]" 3
1341 1 36 ARG HG3 1 37 LEU H . . 5.500 3.510 3.317 3.682 . 0 0 "[ . 1 . 2]" 3
1342 1 24 LYS HA 1 24 LYS HG2 . . 4.190 2.945 2.672 4.230 0.040 18 0 "[ . 1 . 2]" 3
1343 1 24 LYS QE 1 24 LYS HG2 . . 3.770 2.928 2.048 3.411 . 0 0 "[ . 1 . 2]" 3
1344 1 24 LYS QE 1 24 LYS HG3 . . 3.770 2.348 2.080 3.216 . 0 0 "[ . 1 . 2]" 3
1345 1 12 ARG H 1 40 LEU MD1 . . 4.590 4.478 4.258 4.599 0.009 15 0 "[ . 1 . 2]" 3
1346 1 40 LEU H 1 40 LEU MD1 . . 4.300 3.581 3.470 3.705 . 0 0 "[ . 1 . 2]" 3
1347 1 11 TRP H 1 40 LEU MD1 . . 4.680 4.456 4.205 4.680 . 10 0 "[ . 1 . 2]" 3
1348 1 8 HIS HD2 1 40 LEU MD1 . . 5.000 3.810 1.904 4.992 . 0 0 "[ . 1 . 2]" 3
1349 1 11 TRP HA 1 40 LEU MD1 . . 4.670 4.258 4.004 4.433 . 0 0 "[ . 1 . 2]" 3
1350 1 12 ARG HA 1 40 LEU MD1 . . 4.860 4.247 3.972 4.656 . 0 0 "[ . 1 . 2]" 3
1351 1 10 PRO HA 1 40 LEU MD1 . . 4.360 3.758 3.499 3.969 . 0 0 "[ . 1 . 2]" 3
1352 1 40 LEU HA 1 40 LEU MD1 . . 4.110 3.909 3.871 3.949 . 0 0 "[ . 1 . 2]" 3
1353 1 40 LEU MD1 1 73 GLU QG . . 5.500 4.933 4.201 5.443 . 0 0 "[ . 1 . 2]" 3
1354 1 40 LEU MD1 1 73 GLU HB3 . . 4.590 4.245 3.986 4.521 . 0 0 "[ . 1 . 2]" 3
1355 1 40 LEU MD1 1 73 GLU HB2 . . 4.680 4.335 4.040 4.679 . 0 0 "[ . 1 . 2]" 3
1356 1 12 ARG HB3 1 40 LEU MD1 . . 3.520 2.754 2.418 2.970 . 0 0 "[ . 1 . 2]" 3
1357 1 40 LEU HB2 1 40 LEU MD1 . . 3.380 2.250 2.154 2.387 . 0 0 "[ . 1 . 2]" 3
1358 1 12 ARG HB2 1 40 LEU MD1 . . 4.070 3.983 3.808 4.092 0.022 17 0 "[ . 1 . 2]" 3
1359 1 40 LEU HB3 1 40 LEU MD1 . . 3.330 2.391 2.284 2.475 . 0 0 "[ . 1 . 2]" 3
1360 1 40 LEU MD1 1 49 ILE MD . . 4.020 3.796 3.445 4.039 0.019 15 0 "[ . 1 . 2]" 3
1361 1 39 LYS HG2 1 40 LEU H . . 4.150 4.041 3.755 4.150 . 0 0 "[ . 1 . 2]" 3
1362 1 39 LYS HG2 1 41 VAL MG1 . . 3.230 2.223 1.987 2.650 . 0 0 "[ . 1 . 2]" 3
1363 1 39 LYS HG3 1 40 LEU H . . 4.220 3.641 3.171 4.094 . 0 0 "[ . 1 . 2]" 3
1364 1 11 TRP HH2 1 39 LYS HG3 . . 5.200 4.363 3.962 4.714 . 0 0 "[ . 1 . 2]" 3
1365 1 13 ALA H 1 37 LEU MD2 . . 4.720 4.452 4.271 4.576 . 0 0 "[ . 1 . 2]" 3
1366 1 11 TRP HE3 1 37 LEU MD2 . . 3.860 3.311 3.001 3.622 . 0 0 "[ . 1 . 2]" 3
1367 1 35 PHE QE 1 37 LEU MD2 . . 3.470 2.016 1.935 2.117 . 0 0 "[ . 1 . 2]" 3
1368 1 35 PHE HZ 1 37 LEU MD2 . . 3.760 2.520 2.100 2.880 . 0 0 "[ . 1 . 2]" 3
1369 1 11 TRP HZ3 1 37 LEU MD2 . . 5.110 4.704 4.317 4.977 . 0 0 "[ . 1 . 2]" 3
1370 1 37 LEU HA 1 37 LEU MD2 . . 2.880 2.071 1.971 2.266 . 0 0 "[ . 1 . 2]" 3
1371 1 11 TRP HB2 1 37 LEU MD2 . . 4.690 4.410 4.249 4.563 . 0 0 "[ . 1 . 2]" 3
1372 1 11 TRP HB3 1 37 LEU MD2 . . 3.920 3.139 2.988 3.358 . 0 0 "[ . 1 . 2]" 3
1373 1 37 LEU MD2 1 59 ILE HB . . 5.060 4.921 4.792 5.061 0.001 8 0 "[ . 1 . 2]" 3
1374 1 37 LEU HB3 1 37 LEU MD2 . . 3.140 2.305 2.191 2.361 . 0 0 "[ . 1 . 2]" 3
1375 1 13 ALA MB 1 37 LEU MD2 . . 2.820 2.612 2.419 2.736 . 0 0 "[ . 1 . 2]" 3
1376 1 37 LEU MD2 1 59 ILE MG . . 4.710 4.545 4.337 4.712 0.002 8 0 "[ . 1 . 2]" 3
1377 1 37 LEU MD2 1 56 ALA MB . . 3.760 3.444 3.264 3.584 . 0 0 "[ . 1 . 2]" 3
1378 1 37 LEU MD2 1 66 ILE MD . . 3.410 3.117 2.909 3.400 . 0 0 "[ . 1 . 2]" 3
1379 1 28 SER HB2 1 29 VAL H . . 3.560 3.096 3.015 3.153 . 0 0 "[ . 1 . 2]" 3
1380 1 28 SER HB2 1 29 VAL MG2 . . 5.450 5.415 5.376 5.448 . 0 0 "[ . 1 . 2]" 3
1381 1 28 SER HB2 1 29 VAL MG1 . . 5.500 5.505 5.463 5.529 0.029 14 0 "[ . 1 . 2]" 3
1382 1 28 SER HB3 1 29 VAL MG2 . . 5.020 4.869 4.763 4.937 . 0 0 "[ . 1 . 2]" 3
1383 1 28 SER HB2 1 29 VAL HB . . 5.350 5.197 5.154 5.222 . 0 0 "[ . 1 . 2]" 3
1384 1 28 SER HB3 1 29 VAL MG1 . . 5.500 5.176 5.061 5.236 . 0 0 "[ . 1 . 2]" 3
1385 1 28 SER HB3 1 29 VAL H . . 3.030 2.237 2.090 2.319 . 0 0 "[ . 1 . 2]" 3
1386 1 28 SER HB3 1 55 HIS HE1 . . 3.810 3.636 3.564 3.813 0.003 14 0 "[ . 1 . 2]" 3
1387 1 22 SER HB2 1 23 CYS H . . 4.250 3.993 3.893 4.144 . 0 0 "[ . 1 . 2]" 3
1388 1 22 SER H 1 22 SER HB2 . . 4.000 2.860 2.736 3.043 . 0 0 "[ . 1 . 2]" 3
1389 1 22 SER HB2 1 27 LYS HA . . 5.040 4.788 4.559 4.989 . 0 0 "[ . 1 . 2]" 3
1390 1 22 SER HB2 1 29 VAL MG2 . . 4.730 4.268 3.985 4.449 . 0 0 "[ . 1 . 2]" 3
1391 1 22 SER HB3 1 23 CYS H . . 4.250 3.194 3.072 3.265 . 0 0 "[ . 1 . 2]" 3
1392 1 22 SER H 1 22 SER HB3 . . 4.000 3.870 3.827 3.949 . 0 0 "[ . 1 . 2]" 3
1393 1 22 SER HB3 1 27 LYS HA . . 5.040 4.339 4.091 4.494 . 0 0 "[ . 1 . 2]" 3
1394 1 22 SER HB3 1 29 VAL MG2 . . 4.730 3.179 2.973 3.403 . 0 0 "[ . 1 . 2]" 3
1395 1 66 ILE MG 1 68 SER HB2 . . 5.200 4.911 4.751 5.051 . 0 0 "[ . 1 . 2]" 3
1396 1 68 SER HB2 1 69 VAL H . . 4.060 3.886 3.740 4.094 0.034 11 0 "[ . 1 . 2]" 3
1397 1 68 SER HB2 1 70 ASP H . . 4.320 4.169 4.077 4.311 . 0 0 "[ . 1 . 2]" 3
1398 1 68 SER HB2 1 71 ASP H . . 5.180 4.862 4.574 5.121 . 0 0 "[ . 1 . 2]" 3
1399 1 68 SER HA 1 68 SER HB2 . . 3.020 2.453 2.362 2.654 . 0 0 "[ . 1 . 2]" 3
1400 1 67 LYS QB 1 68 SER HB2 . . 4.350 3.923 3.371 4.295 . 0 0 "[ . 1 . 2]" 3
1401 1 67 LYS QG 1 68 SER HB2 . . 4.820 3.522 2.735 4.242 . 0 0 "[ . 1 . 2]" 3
1402 1 68 SER HB2 1 90 VAL MG1 . . 4.630 4.140 3.865 4.449 . 0 0 "[ . 1 . 2]" 3
1403 1 68 SER HB3 1 69 VAL H . . 4.040 3.789 3.362 3.971 . 0 0 "[ . 1 . 2]" 3
1404 1 68 SER HB3 1 70 ASP H . . 3.850 3.040 2.506 3.346 . 0 0 "[ . 1 . 2]" 3
1405 1 68 SER HB3 1 71 ASP H . . 3.600 3.316 3.096 3.605 0.005 10 0 "[ . 1 . 2]" 3
1406 1 68 SER HB3 1 70 ASP HB3 . . 4.740 3.357 2.884 4.596 . 0 0 "[ . 1 . 2]" 3
1407 1 67 LYS QB 1 68 SER HB3 . . 4.290 3.791 3.435 4.209 . 0 0 "[ . 1 . 2]" 3
1408 1 67 LYS QG 1 68 SER HB3 . . 4.820 3.957 2.566 4.791 . 0 0 "[ . 1 . 2]" 3
1409 1 68 SER HB3 1 90 VAL MG1 . . 5.080 4.445 4.224 4.730 . 0 0 "[ . 1 . 2]" 3
1410 1 68 SER HB3 1 90 VAL MG2 . . 5.500 4.704 4.401 5.025 . 0 0 "[ . 1 . 2]" 3
1411 1 66 ILE MG 1 68 SER HB3 . . 4.690 4.609 4.548 4.674 . 0 0 "[ . 1 . 2]" 3
1412 1 13 ALA MB 1 75 ILE MD . . 4.150 3.816 3.656 4.041 . 0 0 "[ . 1 . 2]" 3
1413 1 13 ALA MB 1 35 PHE QD . . 4.180 3.886 3.702 4.062 . 0 0 "[ . 1 . 2]" 3
1414 1 13 ALA MB 1 35 PHE QE . . 3.180 2.513 2.224 2.740 . 0 0 "[ . 1 . 2]" 3
1415 1 13 ALA MB 1 35 PHE HZ . . 3.920 3.763 3.451 3.924 0.004 8 0 "[ . 1 . 2]" 3
1416 1 12 ARG HA 1 13 ALA MB . . 4.200 3.785 3.766 3.821 . 0 0 "[ . 1 . 2]" 3
1417 1 10 PRO HA 1 40 LEU HG . . 5.300 4.525 4.249 4.824 . 0 0 "[ . 1 . 2]" 3
1418 1 10 PRO HA 1 40 LEU H . . 4.340 3.952 3.805 4.149 . 0 0 "[ . 1 . 2]" 3
1419 1 10 PRO HA 1 40 LEU HB2 . . 3.890 2.880 2.608 3.062 . 0 0 "[ . 1 . 2]" 3
1420 1 10 PRO HA 1 40 LEU HB3 . . 4.770 4.524 4.159 4.789 0.019 17 0 "[ . 1 . 2]" 3
1421 1 10 PRO HA 1 39 LYS HG3 . . 5.340 5.180 5.009 5.331 . 0 0 "[ . 1 . 2]" 3
1422 1 72 VAL MG1 1 73 GLU H . . 3.680 2.590 2.294 2.889 . 0 0 "[ . 1 . 2]" 3
1423 1 11 TRP H 1 72 VAL MG1 . . 4.900 4.801 4.617 4.923 0.023 18 0 "[ . 1 . 2]" 3
1424 1 72 VAL H 1 72 VAL MG1 . . 4.130 3.802 3.780 3.853 . 0 0 "[ . 1 . 2]" 3
1425 1 35 PHE QE 1 72 VAL MG1 . . 4.800 4.216 4.113 4.313 . 0 0 "[ . 1 . 2]" 3
1426 1 35 PHE HZ 1 72 VAL MG1 . . 5.270 4.322 4.186 4.491 . 0 0 "[ . 1 . 2]" 3
1427 1 13 ALA HA 1 72 VAL MG1 . . 4.300 3.833 3.693 4.036 . 0 0 "[ . 1 . 2]" 3
1428 1 12 ARG HA 1 72 VAL MG1 . . 3.920 3.278 2.995 3.542 . 0 0 "[ . 1 . 2]" 3
1429 1 72 VAL HA 1 72 VAL MG1 . . 3.100 2.295 2.202 2.426 . 0 0 "[ . 1 . 2]" 3
1430 1 72 VAL MG1 1 75 ILE HA . . 3.970 3.210 3.030 3.368 . 0 0 "[ . 1 . 2]" 3
1431 1 11 TRP HB2 1 72 VAL MG1 . . 3.700 3.218 3.069 3.343 . 0 0 "[ . 1 . 2]" 3
1432 1 11 TRP HB3 1 72 VAL MG1 . . 3.730 2.989 2.709 3.315 . 0 0 "[ . 1 . 2]" 3
1433 1 72 VAL MG1 1 73 GLU HB2 . . 5.080 4.794 4.573 4.982 . 0 0 "[ . 1 . 2]" 3
1434 1 72 VAL MG1 1 75 ILE HB . . 3.280 2.007 1.898 2.180 . 0 0 "[ . 1 . 2]" 3
1435 1 13 ALA MB 1 72 VAL MG1 . . 2.680 1.998 1.872 2.218 . 0 0 "[ . 1 . 2]" 3
1436 1 72 VAL MG1 1 75 ILE MD . . 3.150 2.442 2.110 2.737 . 0 0 "[ . 1 . 2]" 3
1437 1 72 VAL MG1 1 78 LEU MD1 . . 3.910 3.098 2.993 3.274 . 0 0 "[ . 1 . 2]" 3
1438 1 66 ILE MD 1 72 VAL MG1 . . 4.240 3.491 3.272 3.755 . 0 0 "[ . 1 . 2]" 3
1439 1 58 CYS HA 1 61 LYS HB2 . . 4.990 4.852 4.735 4.989 . 0 0 "[ . 1 . 2]" 3
1440 1 58 CYS HA 1 61 LYS HB3 . . 4.100 3.851 3.688 4.104 0.004 2 0 "[ . 1 . 2]" 3
1441 1 58 CYS HA 1 61 LYS HG3 . . 4.260 3.717 2.849 4.193 . 0 0 "[ . 1 . 2]" 3
1442 1 25 THR MG 1 58 CYS HA . . 3.890 3.151 3.045 3.262 . 0 0 "[ . 1 . 2]" 3
1443 1 72 VAL HB 1 75 ILE HA . . 4.970 4.768 4.586 4.930 . 0 0 "[ . 1 . 2]" 3
1444 1 75 ILE HA 1 78 LEU HB2 . . 4.180 3.844 3.660 4.098 . 0 0 "[ . 1 . 2]" 3
1445 1 75 ILE HA 1 78 LEU HG . . 3.240 2.117 2.023 2.201 . 0 0 "[ . 1 . 2]" 3
1446 1 75 ILE HA 1 75 ILE HG13 . . 3.180 2.320 2.268 2.383 . 0 0 "[ . 1 . 2]" 3
1447 1 13 ALA MB 1 75 ILE HA . . 3.360 2.148 1.958 2.322 . 0 0 "[ . 1 . 2]" 3
1448 1 75 ILE HA 1 75 ILE MD . . 3.830 3.696 3.650 3.730 . 0 0 "[ . 1 . 2]" 3
1449 1 75 ILE HA 1 78 LEU MD1 . . 3.170 1.993 1.951 2.127 . 0 0 "[ . 1 . 2]" 3
1450 1 75 ILE HA 1 78 LEU MD2 . . 3.960 3.427 3.201 3.537 . 0 0 "[ . 1 . 2]" 3
1451 1 86 ILE HA 1 89 TYR H . . 3.820 3.783 3.743 3.815 . 0 0 "[ . 1 . 2]" 3
1452 1 86 ILE HA 1 89 TYR QD . . 4.200 3.816 3.480 4.229 0.029 17 0 "[ . 1 . 2]" 3
1453 1 35 PHE HZ 1 86 ILE HA . . 5.500 5.341 5.167 5.495 . 0 0 "[ . 1 . 2]" 3
1454 1 86 ILE HA 1 89 TYR HA . . 5.500 5.522 5.463 5.545 0.045 16 0 "[ . 1 . 2]" 3
1455 1 86 ILE HA 1 89 TYR HB3 . . 3.410 2.653 2.553 2.721 . 0 0 "[ . 1 . 2]" 3
1456 1 86 ILE HA 1 89 TYR HB2 . . 3.900 3.891 3.800 3.923 0.023 11 0 "[ . 1 . 2]" 3
1457 1 86 ILE HA 1 86 ILE HG13 . . 4.010 3.842 3.774 3.874 . 0 0 "[ . 1 . 2]" 3
1458 1 86 ILE HA 1 86 ILE HG12 . . 3.420 3.139 3.060 3.232 . 0 0 "[ . 1 . 2]" 3
1459 1 75 ILE MD 1 86 ILE HA . . 5.090 4.362 4.206 4.483 . 0 0 "[ . 1 . 2]" 3
1460 1 86 ILE HA 1 90 VAL MG1 . . 5.500 4.029 3.730 4.310 . 0 0 "[ . 1 . 2]" 3
1461 1 86 ILE HA 1 90 VAL MG2 . . 5.500 4.274 3.981 4.726 . 0 0 "[ . 1 . 2]" 3
1462 1 60 LEU MD2 1 86 ILE HA . . 3.650 2.455 2.249 2.608 . 0 0 "[ . 1 . 2]" 3
1463 1 77 SER HB2 1 78 LEU H . . 4.420 4.171 3.927 4.381 . 0 0 "[ . 1 . 2]" 3
1464 1 91 GLU H 1 92 SER QB . . 4.600 4.446 4.263 4.584 . 0 0 "[ . 1 . 2]" 3
1465 1 92 SER HA 1 92 SER QB . . 2.670 2.447 2.336 2.494 . 0 0 "[ . 1 . 2]" 3
1466 1 91 GLU QB 1 92 SER QB . . 4.160 3.600 3.381 4.189 0.029 5 0 "[ . 1 . 2]" 3
1467 1 40 LEU H 1 40 LEU MD2 . . 3.940 3.211 2.741 3.426 . 0 0 "[ . 1 . 2]" 3
1468 1 40 LEU HA 1 40 LEU MD2 . . 3.080 2.108 1.966 2.412 . 0 0 "[ . 1 . 2]" 3
1469 1 40 LEU MD2 1 51 PRO QD . . 4.300 3.635 3.089 4.005 . 0 0 "[ . 1 . 2]" 3
1470 1 12 ARG HB3 1 40 LEU MD2 . . 3.820 3.161 2.784 3.333 . 0 0 "[ . 1 . 2]" 3
1471 1 40 LEU MD2 1 49 ILE HB . . 5.010 4.100 3.618 4.770 . 0 0 "[ . 1 . 2]" 3
1472 1 40 LEU HB3 1 40 LEU MD2 . . 3.560 2.331 2.182 2.405 . 0 0 "[ . 1 . 2]" 3
1473 1 40 LEU MD2 1 51 PRO HB3 . . 3.430 2.162 1.877 2.499 . 0 0 "[ . 1 . 2]" 3
1474 1 40 LEU MD2 1 49 ILE MG . . 3.370 2.528 2.028 3.166 . 0 0 "[ . 1 . 2]" 3
1475 1 40 LEU MD2 1 51 PRO HB2 . . 4.390 3.319 3.031 3.635 . 0 0 "[ . 1 . 2]" 3
1476 1 29 VAL HA 1 30 ILE HB . . 4.830 4.610 4.572 4.634 . 0 0 "[ . 1 . 2]" 3
1477 1 40 LEU MD2 1 52 MET H . . 4.560 4.236 3.614 4.583 0.023 14 0 "[ . 1 . 2]" 3
1478 1 11 TRP HA 1 40 LEU MD2 . . 4.950 4.826 4.606 4.955 0.005 16 0 "[ . 1 . 2]" 3
1479 1 19 SER HA 1 29 VAL MG2 . . 4.950 4.901 4.843 4.968 0.018 12 0 "[ . 1 . 2]" 3
1480 1 22 SER HA 1 29 VAL MG2 . . 3.950 3.509 3.398 3.706 . 0 0 "[ . 1 . 2]" 3
1481 1 19 SER HB3 1 29 VAL MG2 . . 4.290 4.193 4.099 4.291 0.001 9 0 "[ . 1 . 2]" 3
1482 1 29 VAL HA 1 29 VAL MG2 . . 2.990 2.100 2.066 2.134 . 0 0 "[ . 1 . 2]" 3
1483 1 63 THR MG 1 64 LYS H . . 3.870 1.899 1.801 1.991 . 0 0 "[ . 1 . 2]" 3
1484 1 63 THR MG 1 89 TYR QE . . 4.690 4.511 4.064 4.698 0.008 10 0 "[ . 1 . 2]" 3
1485 1 63 THR HA 1 63 THR MG . . 2.950 2.163 2.034 2.257 . 0 0 "[ . 1 . 2]" 3
1486 1 63 THR MG 1 64 LYS HA . . 3.980 3.581 3.348 3.798 . 0 0 "[ . 1 . 2]" 3
1487 1 63 THR MG 1 64 LYS QE . . 4.190 3.552 3.312 3.853 . 0 0 "[ . 1 . 2]" 3
1488 1 69 VAL H 1 90 VAL MG1 . . 3.960 2.962 2.512 3.226 . 0 0 "[ . 1 . 2]" 3
1489 1 90 VAL H 1 90 VAL MG1 . . 2.820 2.589 2.411 2.792 . 0 0 "[ . 1 . 2]" 3
1490 1 89 TYR H 1 90 VAL MG1 . . 4.390 4.094 3.906 4.307 . 0 0 "[ . 1 . 2]" 3
1491 1 89 TYR QD 1 90 VAL MG1 . . 3.260 2.125 1.960 2.350 . 0 0 "[ . 1 . 2]" 3
1492 1 89 TYR QE 1 90 VAL MG1 . . 4.100 3.203 2.971 3.509 . 0 0 "[ . 1 . 2]" 3
1493 1 87 ARG HA 1 90 VAL MG1 . . 3.990 3.836 3.596 3.995 0.005 13 0 "[ . 1 . 2]" 3
1494 1 69 VAL HA 1 90 VAL MG1 . . 3.560 3.452 3.195 3.586 0.026 11 0 "[ . 1 . 2]" 3
1495 1 89 TYR HB3 1 90 VAL MG1 . . 4.170 3.532 3.335 3.788 . 0 0 "[ . 1 . 2]" 3
1496 1 89 TYR HB2 1 90 VAL MG1 . . 5.360 4.928 4.750 5.106 . 0 0 "[ . 1 . 2]" 3
1497 1 90 VAL MG1 1 91 GLU HG2 . . 5.240 4.912 4.708 5.096 . 0 0 "[ . 1 . 2]" 3
1498 1 66 ILE MD 1 90 VAL MG1 . . 3.990 3.275 3.102 3.453 . 0 0 "[ . 1 . 2]" 3
1499 1 19 SER HB2 1 32 LYS H . . 4.520 4.406 4.067 4.524 0.004 3 0 "[ . 1 . 2]" 3
1500 1 19 SER HB2 1 31 ASN HA . . 4.000 3.665 3.555 3.917 . 0 0 "[ . 1 . 2]" 3
1501 1 69 VAL H 1 69 VAL MG1 . . 3.370 2.391 2.306 2.473 . 0 0 "[ . 1 . 2]" 3
1502 1 69 VAL MG1 1 86 ILE HG13 . . 3.730 3.631 3.373 3.746 0.016 19 0 "[ . 1 . 2]" 3
1503 1 19 SER HB3 1 31 ASN HA . . 3.670 2.331 2.248 2.572 . 0 0 "[ . 1 . 2]" 3
1504 1 19 SER HB2 1 29 VAL MG2 . . 4.990 4.823 4.681 4.982 . 0 0 "[ . 1 . 2]" 3
1505 1 19 SER HB2 1 29 VAL MG1 . . 4.030 3.510 3.352 3.713 . 0 0 "[ . 1 . 2]" 3
1506 1 69 VAL MG1 1 70 ASP H . . 4.320 4.115 4.071 4.156 . 0 0 "[ . 1 . 2]" 3
1507 1 69 VAL MG1 1 71 ASP H . . 5.500 5.249 5.119 5.356 . 0 0 "[ . 1 . 2]" 3
1508 1 69 VAL MG1 1 72 VAL H . . 5.500 5.047 4.907 5.191 . 0 0 "[ . 1 . 2]" 3
1509 1 69 VAL MG1 1 86 ILE H . . 4.730 4.143 4.072 4.200 . 0 0 "[ . 1 . 2]" 3
1510 1 69 VAL MG1 1 70 ASP HA . . 5.470 5.449 5.410 5.470 . 0 0 "[ . 1 . 2]" 3
1511 1 69 VAL MG1 1 87 ARG HG2 . . 3.790 3.558 3.416 3.784 . 0 0 "[ . 1 . 2]" 3
1512 1 68 SER HA 1 90 VAL MG2 . . 3.040 2.338 2.107 2.640 . 0 0 "[ . 1 . 2]" 3
1513 1 89 TYR HA 1 90 VAL MG2 . . 5.090 4.872 4.812 4.959 . 0 0 "[ . 1 . 2]" 3
1514 1 68 SER HB2 1 90 VAL MG2 . . 4.570 4.078 3.715 4.324 . 0 0 "[ . 1 . 2]" 3
1515 1 90 VAL HA 1 90 VAL MG2 . . 3.210 3.185 3.171 3.197 . 0 0 "[ . 1 . 2]" 3
1516 1 68 SER H 1 90 VAL MG2 . . 4.890 4.620 4.473 4.847 . 0 0 "[ . 1 . 2]" 3
1517 1 89 TYR QD 1 90 VAL MG2 . . 4.030 3.872 3.568 4.047 0.017 16 0 "[ . 1 . 2]" 3
1518 1 89 TYR QE 1 90 VAL MG2 . . 5.500 5.428 5.204 5.509 0.009 1 0 "[ . 1 . 2]" 3
1519 1 66 ILE MG 1 90 VAL MG2 . . 3.820 3.732 3.604 3.828 0.008 19 0 "[ . 1 . 2]" 3
1520 1 102 THR HA 1 102 THR MG . . 3.590 2.445 2.181 3.198 . 0 0 "[ . 1 . 2]" 3
1521 1 68 SER HB2 1 69 VAL MG2 . . 4.980 4.587 4.372 4.792 . 0 0 "[ . 1 . 2]" 3
1522 1 63 THR HA 1 64 LYS HA . . 4.540 4.478 4.447 4.528 . 0 0 "[ . 1 . 2]" 3
1523 1 69 VAL H 1 69 VAL MG2 . . 2.940 1.892 1.852 1.949 . 0 0 "[ . 1 . 2]" 3
1524 1 69 VAL MG2 1 87 ARG H . . 4.610 4.475 4.421 4.549 . 0 0 "[ . 1 . 2]" 3
1525 1 69 VAL MG2 1 70 ASP H . . 3.430 2.383 2.160 2.549 . 0 0 "[ . 1 . 2]" 3
1526 1 69 VAL MG2 1 71 ASP H . . 4.540 4.417 4.322 4.494 . 0 0 "[ . 1 . 2]" 3
1527 1 68 SER HA 1 69 VAL MG2 . . 3.870 3.831 3.736 3.876 0.006 20 0 "[ . 1 . 2]" 3
1528 1 69 VAL MG2 1 87 ARG HA . . 3.600 3.535 3.455 3.616 0.016 11 0 "[ . 1 . 2]" 3
1529 1 69 VAL HA 1 69 VAL MG2 . . 3.190 3.187 3.166 3.196 0.006 15 0 "[ . 1 . 2]" 3
1530 1 69 VAL MG2 1 87 ARG HD2 . . 4.290 3.981 3.842 4.318 0.028 18 0 "[ . 1 . 2]" 3
1531 1 69 VAL MG2 1 87 ARG HD3 . . 5.340 5.263 4.929 5.388 0.048 11 0 "[ . 1 . 2]" 3
1532 1 69 VAL MG2 1 70 ASP HB3 . . 5.070 4.303 3.353 4.872 . 0 0 "[ . 1 . 2]" 3
1533 1 60 LEU MD2 1 90 VAL H . . 4.740 4.701 4.559 4.754 0.014 19 0 "[ . 1 . 2]" 3
1534 1 60 LEU MD2 1 86 ILE H . . 4.750 4.260 4.094 4.383 . 0 0 "[ . 1 . 2]" 3
1535 1 60 LEU MD2 1 89 TYR QD . . 3.310 2.719 2.465 2.874 . 0 0 "[ . 1 . 2]" 3
1536 1 60 LEU MD2 1 89 TYR QE . . 3.740 3.484 3.298 3.742 0.002 19 0 "[ . 1 . 2]" 3
1537 1 60 LEU MD2 1 89 TYR HA . . 4.410 4.272 4.094 4.415 0.005 9 0 "[ . 1 . 2]" 3
1538 1 60 LEU HA 1 60 LEU MD2 . . 2.900 2.132 2.068 2.224 . 0 0 "[ . 1 . 2]" 3
1539 1 60 LEU MD2 1 89 TYR HB3 . . 3.640 2.447 2.329 2.547 . 0 0 "[ . 1 . 2]" 3
1540 1 60 LEU MD2 1 89 TYR HB2 . . 3.460 2.238 2.027 2.454 . 0 0 "[ . 1 . 2]" 3
1541 1 60 LEU MD2 1 85 LYS HB3 . . 3.790 3.516 3.338 3.662 . 0 0 "[ . 1 . 2]" 3
1542 1 60 LEU QB 1 60 LEU MD2 . . 3.110 2.233 2.185 2.263 . 0 0 "[ . 1 . 2]" 3
1543 1 37 LEU MD1 1 60 LEU MD2 . . 3.280 3.079 2.860 3.271 . 0 0 "[ . 1 . 2]" 3
1544 1 63 THR HA 1 65 GLN H . . 4.430 3.741 3.524 3.873 . 0 0 "[ . 1 . 2]" 3
1545 1 63 THR HA 1 89 TYR QE . . 3.920 3.550 3.036 3.789 . 0 0 "[ . 1 . 2]" 3
1546 1 40 LEU HA 1 41 VAL MG1 . . 4.350 3.954 3.795 4.155 . 0 0 "[ . 1 . 2]" 3
1547 1 41 VAL MG1 1 42 GLN H . . 4.420 3.820 3.582 4.105 . 0 0 "[ . 1 . 2]" 3
1548 1 41 VAL H 1 41 VAL MG1 . . 3.710 2.902 2.639 3.134 . 0 0 "[ . 1 . 2]" 3
1549 1 41 VAL HA 1 41 VAL MG1 . . 3.360 2.287 2.156 2.416 . 0 0 "[ . 1 . 2]" 3
1550 1 39 LYS HE2 1 41 VAL MG1 . . 4.550 3.803 3.210 4.359 . 0 0 "[ . 1 . 2]" 3
1551 1 72 VAL MG2 1 73 GLU H . . 4.150 4.108 4.000 4.176 0.026 16 0 "[ . 1 . 2]" 3
1552 1 72 VAL H 1 72 VAL MG2 . . 3.040 2.197 1.984 2.485 . 0 0 "[ . 1 . 2]" 3
1553 1 11 TRP HD1 1 72 VAL MG2 . . 3.850 3.799 3.559 3.861 0.011 6 0 "[ . 1 . 2]" 3
1554 1 11 TRP HA 1 72 VAL MG2 . . 5.260 4.872 4.642 5.015 . 0 0 "[ . 1 . 2]" 3
1555 1 72 VAL HA 1 72 VAL MG2 . . 3.120 2.439 2.351 2.491 . 0 0 "[ . 1 . 2]" 3
1556 1 11 TRP HB2 1 72 VAL MG2 . . 3.200 2.317 2.134 2.453 . 0 0 "[ . 1 . 2]" 3
1557 1 11 TRP HB3 1 72 VAL MG2 . . 3.550 2.913 2.568 3.217 . 0 0 "[ . 1 . 2]" 3
1558 1 60 LEU MD2 1 65 GLN HB2 . . 4.810 4.637 4.408 4.792 . 0 0 "[ . 1 . 2]" 3
1559 1 66 ILE HG12 1 72 VAL MG2 . . 4.560 3.349 3.149 3.612 . 0 0 "[ . 1 . 2]" 3
1560 1 25 THR MG 1 27 LYS H . . 5.130 4.626 4.492 4.804 . 0 0 "[ . 1 . 2]" 3
1561 1 25 THR HA 1 25 THR MG . . 2.890 2.560 2.520 2.593 . 0 0 "[ . 1 . 2]" 3
1562 1 25 THR MG 1 26 CYS HB2 . . 4.500 4.342 4.196 4.455 . 0 0 "[ . 1 . 2]" 3
1563 1 25 THR MG 1 58 CYS HB2 . . 3.700 3.701 3.666 3.712 0.012 15 0 "[ . 1 . 2]" 3
1564 1 80 TRP HA 1 84 GLN H . . 4.410 4.260 4.133 4.405 . 0 0 "[ . 1 . 2]" 3
1565 1 80 TRP HA 1 83 GLN HE21 . . 3.550 3.510 3.352 3.556 0.006 18 0 "[ . 1 . 2]" 3
1566 1 80 TRP HA 1 80 TRP HD1 . . 4.230 2.867 2.795 2.958 . 0 0 "[ . 1 . 2]" 3
1567 1 80 TRP HA 1 82 ASP H . . 4.550 4.350 4.289 4.433 . 0 0 "[ . 1 . 2]" 3
1568 1 80 TRP HA 1 83 GLN HE22 . . 4.700 4.559 4.378 4.685 . 0 0 "[ . 1 . 2]" 3
1569 1 80 TRP HA 1 83 GLN HG2 . . 4.840 4.701 4.634 4.775 . 0 0 "[ . 1 . 2]" 3
1570 1 80 TRP HA 1 83 GLN HG3 . . 3.790 3.044 2.960 3.132 . 0 0 "[ . 1 . 2]" 3
1571 1 80 TRP HA 1 83 GLN HB2 . . 3.510 2.856 2.801 2.897 . 0 0 "[ . 1 . 2]" 3
1572 1 29 VAL MG1 1 31 ASN H . . 3.000 2.758 2.717 2.791 . 0 0 "[ . 1 . 2]" 3
1573 1 19 SER HA 1 29 VAL MG1 . . 4.330 3.198 3.130 3.294 . 0 0 "[ . 1 . 2]" 3
1574 1 22 SER HA 1 29 VAL MG1 . . 4.200 4.064 3.903 4.165 . 0 0 "[ . 1 . 2]" 3
1575 1 29 VAL MG1 1 31 ASN HA . . 3.660 3.226 3.195 3.258 . 0 0 "[ . 1 . 2]" 3
1576 1 20 ARG HA 1 29 VAL MG1 . . 4.640 4.574 4.481 4.649 0.009 12 0 "[ . 1 . 2]" 3
1577 1 19 SER HB3 1 29 VAL MG1 . . 3.400 2.415 2.300 2.579 . 0 0 "[ . 1 . 2]" 3
1578 1 29 VAL HA 1 29 VAL MG1 . . 3.170 2.660 2.651 2.672 . 0 0 "[ . 1 . 2]" 3
1579 1 89 TYR HA 1 89 TYR QD . . 3.330 2.981 2.838 3.274 . 0 0 "[ . 1 . 2]" 3
1580 1 89 TYR HA 1 89 TYR QE . . 5.110 4.852 4.788 4.962 . 0 0 "[ . 1 . 2]" 3
1581 1 89 TYR HA 1 92 SER QB . . 4.070 3.646 2.830 4.073 0.003 13 0 "[ . 1 . 2]" 3
1582 1 89 TYR HA 1 90 VAL HA . . 4.860 4.714 4.691 4.749 . 0 0 "[ . 1 . 2]" 3
1583 1 88 LYS QB 1 89 TYR HA . . 4.310 4.197 4.175 4.215 . 0 0 "[ . 1 . 2]" 3
1584 1 51 PRO HA 1 52 MET H . . 3.140 2.211 2.175 2.355 . 0 0 "[ . 1 . 2]" 3
1585 1 41 VAL H 1 51 PRO HA . . 4.140 3.723 3.067 4.147 0.007 8 0 "[ . 1 . 2]" 3
1586 1 89 TYR HA 1 91 GLU QB . . 5.430 5.321 5.153 5.431 0.001 11 0 "[ . 1 . 2]" 3
1587 1 40 LEU MD2 1 51 PRO HA . . 3.540 2.647 2.201 3.068 . 0 0 "[ . 1 . 2]" 3
1588 1 40 LEU HA 1 41 VAL MG2 . . 4.270 3.694 3.506 3.923 . 0 0 "[ . 1 . 2]" 3
1589 1 41 VAL MG2 1 51 PRO HA . . 4.790 4.170 3.281 4.629 . 0 0 "[ . 1 . 2]" 3
1590 1 40 LEU MD2 1 41 VAL MG2 . . 4.920 4.843 4.735 4.931 0.011 8 0 "[ . 1 . 2]" 3
1591 1 35 PHE QE 1 78 LEU MD2 . . 3.780 3.116 2.603 3.373 . 0 0 "[ . 1 . 2]" 3
1592 1 14 GLU H 1 78 LEU MD2 . . 4.270 2.876 2.652 3.131 . 0 0 "[ . 1 . 2]" 3
1593 1 35 PHE QD 1 78 LEU MD2 . . 3.840 2.813 2.549 2.971 . 0 0 "[ . 1 . 2]" 3
1594 1 15 TYR QD 1 78 LEU MD2 . . 4.010 3.324 2.693 3.685 . 0 0 "[ . 1 . 2]" 3
1595 1 15 TYR QE 1 78 LEU MD2 . . 3.470 2.834 2.015 3.275 . 0 0 "[ . 1 . 2]" 3
1596 1 13 ALA HA 1 78 LEU MD2 . . 4.840 3.223 3.060 3.394 . 0 0 "[ . 1 . 2]" 3
1597 1 78 LEU HA 1 78 LEU MD2 . . 3.030 2.286 2.159 2.451 . 0 0 "[ . 1 . 2]" 3
1598 1 14 GLU HB3 1 78 LEU MD2 . . 4.650 4.361 4.179 4.525 . 0 0 "[ . 1 . 2]" 3
1599 1 78 LEU MD2 1 82 ASP HB2 . . 4.190 4.172 4.120 4.198 0.008 11 0 "[ . 1 . 2]" 3
1600 1 78 LEU HB2 1 78 LEU MD2 . . 3.340 3.181 3.168 3.185 . 0 0 "[ . 1 . 2]" 3
1601 1 13 ALA MB 1 78 LEU MD2 . . 3.090 2.111 1.871 2.362 . 0 0 "[ . 1 . 2]" 3
1602 1 78 LEU HB3 1 78 LEU MD2 . . 3.390 2.268 2.162 2.338 . 0 0 "[ . 1 . 2]" 3
1603 1 57 SER HA 1 60 LEU QB . . 3.500 2.725 2.624 2.866 . 0 0 "[ . 1 . 2]" 3
1604 1 57 SER HA 1 60 LEU MD2 . . 5.310 5.036 4.921 5.190 . 0 0 "[ . 1 . 2]" 3
1605 1 41 VAL MG2 1 42 GLN H . . 4.930 3.821 3.399 4.195 . 0 0 "[ . 1 . 2]" 3
1606 1 41 VAL MG2 1 52 MET H . . 5.250 3.891 3.573 4.364 . 0 0 "[ . 1 . 2]" 3
1607 1 41 VAL HA 1 41 VAL MG2 . . 3.720 3.192 3.178 3.203 . 0 0 "[ . 1 . 2]" 3
1608 1 41 VAL MG2 1 52 MET HG3 . . 3.580 3.058 2.773 3.333 . 0 0 "[ . 1 . 2]" 3
1609 1 11 TRP HD1 1 72 VAL HA . . 5.150 4.609 4.469 4.688 . 0 0 "[ . 1 . 2]" 3
1610 1 12 ARG HA 1 72 VAL HA . . 4.700 3.919 3.691 4.202 . 0 0 "[ . 1 . 2]" 3
1611 1 11 TRP HB2 1 72 VAL HA . . 3.380 2.359 2.250 2.458 . 0 0 "[ . 1 . 2]" 3
1612 1 11 TRP HB3 1 72 VAL HA . . 3.780 3.367 3.130 3.498 . 0 0 "[ . 1 . 2]" 3
1613 1 72 VAL HA 1 73 GLU HB2 . . 4.730 4.442 4.280 4.578 . 0 0 "[ . 1 . 2]" 3
1614 1 66 ILE MG 1 72 VAL HA . . 5.090 4.436 4.297 4.579 . 0 0 "[ . 1 . 2]" 3
1615 1 57 SER HA 1 60 LEU HG . . 4.210 3.920 3.713 4.145 . 0 0 "[ . 1 . 2]" 3
1616 1 87 ARG HA 1 90 VAL H . . 3.860 3.272 3.208 3.338 . 0 0 "[ . 1 . 2]" 3
1617 1 87 ARG HA 1 87 ARG HD2 . . 4.680 4.385 4.304 4.595 . 0 0 "[ . 1 . 2]" 3
1618 1 87 ARG HA 1 87 ARG HD3 . . 5.160 5.162 4.870 5.269 0.109 6 0 "[ . 1 . 2]" 3
1619 1 87 ARG HA 1 91 GLU HG2 . . 5.030 3.448 3.167 3.918 . 0 0 "[ . 1 . 2]" 3
1620 1 86 ILE HB 1 87 ARG HA . . 4.090 3.986 3.937 4.070 . 0 0 "[ . 1 . 2]" 3
1621 1 87 ARG HA 1 87 ARG HG2 . . 3.780 3.581 3.557 3.640 . 0 0 "[ . 1 . 2]" 3
1622 1 69 VAL MG1 1 87 ARG HA . . 3.050 2.016 1.886 2.292 . 0 0 "[ . 1 . 2]" 3
1623 1 87 ARG HA 1 90 VAL MG2 . . 3.420 1.907 1.839 1.960 . 0 0 "[ . 1 . 2]" 3
1624 1 86 ILE MG 1 87 ARG HA . . 3.850 3.672 3.507 3.821 . 0 0 "[ . 1 . 2]" 3
1625 1 30 ILE HA 1 31 ASN HB2 . . 4.860 4.696 4.408 4.827 . 0 0 "[ . 1 . 2]" 3
1626 1 30 ILE HA 1 30 ILE HG13 . . 4.100 2.775 2.715 2.846 . 0 0 "[ . 1 . 2]" 3
1627 1 29 VAL MG1 1 30 ILE HA . . 4.800 3.435 3.363 3.479 . 0 0 "[ . 1 . 2]" 3
1628 1 30 ILE HA 1 30 ILE HG12 . . 3.950 2.738 2.672 2.799 . 0 0 "[ . 1 . 2]" 3
1629 1 30 ILE HA 1 55 HIS HD2 . . 4.240 3.633 3.526 3.765 . 0 0 "[ . 1 . 2]" 3
1630 1 36 ARG HB2 1 55 HIS HA . . 5.150 3.394 3.252 3.612 . 0 0 "[ . 1 . 2]" 3
1631 1 55 HIS HA 1 55 HIS HD2 . . 3.970 3.034 2.934 3.167 . 0 0 "[ . 1 . 2]" 3
1632 1 36 ARG HA 1 55 HIS HA . . 3.690 2.782 2.672 2.845 . 0 0 "[ . 1 . 2]" 3
1633 1 55 HIS HA 1 56 ALA HA . . 4.580 4.317 4.308 4.325 . 0 0 "[ . 1 . 2]" 3
1634 1 36 ARG HB3 1 55 HIS HA . . 5.150 3.244 3.142 3.384 . 0 0 "[ . 1 . 2]" 3
1635 1 55 HIS HA 1 56 ALA MB . . 4.150 4.002 3.941 4.027 . 0 0 "[ . 1 . 2]" 3
1636 1 30 ILE HG12 1 55 HIS HA . . 4.770 3.773 3.628 3.892 . 0 0 "[ . 1 . 2]" 3
1637 1 75 ILE MG 1 83 GLN HA . . 4.890 4.858 4.779 4.902 0.012 12 0 "[ . 1 . 2]" 3
1638 1 83 GLN HA 1 86 ILE H . . 4.140 3.631 3.571 3.693 . 0 0 "[ . 1 . 2]" 3
1639 1 80 TRP HA 1 83 GLN HA . . 5.500 5.502 5.465 5.516 0.016 16 0 "[ . 1 . 2]" 3
1640 1 83 GLN HA 1 83 GLN HG2 . . 3.450 2.456 2.439 2.510 . 0 0 "[ . 1 . 2]" 3
1641 1 83 GLN HA 1 83 GLN HG3 . . 3.680 3.368 3.342 3.397 . 0 0 "[ . 1 . 2]" 3
1642 1 83 GLN HA 1 86 ILE HB . . 3.790 3.617 3.489 3.753 . 0 0 "[ . 1 . 2]" 3
1643 1 75 ILE HG13 1 83 GLN HA . . 3.950 3.346 3.179 3.497 . 0 0 "[ . 1 . 2]" 3
1644 1 75 ILE HG12 1 83 GLN HA . . 3.980 3.099 3.033 3.165 . 0 0 "[ . 1 . 2]" 3
1645 1 83 GLN HA 1 86 ILE MD . . 4.180 4.149 4.051 4.194 0.014 12 0 "[ . 1 . 2]" 3
1646 1 78 LEU MD1 1 83 GLN HA . . 3.540 3.213 2.849 3.442 . 0 0 "[ . 1 . 2]" 3
1647 1 11 TRP HH2 1 59 ILE HA . . 5.500 4.912 4.427 5.365 . 0 0 "[ . 1 . 2]" 3
1648 1 59 ILE HA 1 61 LYS H . . 4.480 4.114 3.991 4.335 . 0 0 "[ . 1 . 2]" 3
1649 1 59 ILE HA 1 62 LYS QE . . 4.610 3.060 1.842 3.747 . 0 0 "[ . 1 . 2]" 3
1650 1 59 ILE HA 1 62 LYS HB2 . . 4.280 3.047 2.771 3.341 . 0 0 "[ . 1 . 2]" 3
1651 1 59 ILE HA 1 59 ILE HG12 . . 3.970 2.924 2.852 3.132 . 0 0 "[ . 1 . 2]" 3
1652 1 89 TYR QD 1 94 ALA MB . . 4.580 3.498 2.868 4.430 . 0 0 "[ . 1 . 2]" 3
1653 1 89 TYR QE 1 94 ALA MB . . 4.000 2.281 1.915 3.362 . 0 0 "[ . 1 . 2]" 3
1654 1 63 THR HA 1 94 ALA MB . . 3.840 2.285 1.850 3.393 . 0 0 "[ . 1 . 2]" 3
1655 1 64 LYS HA 1 94 ALA MB . . 4.950 4.006 2.197 4.954 0.004 5 0 "[ . 1 . 2]" 3
1656 1 11 TRP HD1 1 66 ILE HA . . 3.880 3.406 3.248 3.628 . 0 0 "[ . 1 . 2]" 3
1657 1 66 ILE HA 1 67 LYS QB . . 4.470 4.099 3.993 4.543 0.073 5 0 "[ . 1 . 2]" 3
1658 1 66 ILE HA 1 72 VAL MG2 . . 5.000 4.734 4.589 4.894 . 0 0 "[ . 1 . 2]" 3
1659 1 66 ILE HA 1 66 ILE HG12 . . 3.670 2.608 2.545 2.749 . 0 0 "[ . 1 . 2]" 3
1660 1 85 LYS HA 1 88 LYS H . . 4.190 4.044 3.935 4.135 . 0 0 "[ . 1 . 2]" 3
1661 1 85 LYS HA 1 87 ARG H . . 5.500 5.295 5.245 5.326 . 0 0 "[ . 1 . 2]" 3
1662 1 85 LYS HA 1 89 TYR H . . 5.240 4.972 4.882 5.063 . 0 0 "[ . 1 . 2]" 3
1663 1 82 ASP HA 1 85 LYS HA . . 5.500 5.413 5.343 5.501 0.001 5 0 "[ . 1 . 2]" 3
1664 1 85 LYS HA 1 89 TYR HB2 . . 4.850 4.576 4.422 4.859 0.009 19 0 "[ . 1 . 2]" 3
1665 1 85 LYS HA 1 85 LYS HE3 . . 5.500 5.348 5.153 5.502 0.002 17 0 "[ . 1 . 2]" 3
1666 1 85 LYS HA 1 85 LYS HB3 . . 2.930 2.484 2.459 2.524 . 0 0 "[ . 1 . 2]" 3
1667 1 85 LYS HA 1 88 LYS QB . . 3.330 2.868 2.731 3.021 . 0 0 "[ . 1 . 2]" 3
1668 1 84 GLN HB2 1 85 LYS HA . . 4.420 4.229 4.151 4.264 . 0 0 "[ . 1 . 2]" 3
1669 1 85 LYS HA 1 85 LYS HG2 . . 3.170 2.611 2.511 2.722 . 0 0 "[ . 1 . 2]" 3
1670 1 15 TYR HB3 1 16 ALA MB . . 5.190 4.521 4.435 4.638 . 0 0 "[ . 1 . 2]" 3
1671 1 16 ALA MB 1 36 ARG H . . 4.880 4.774 4.525 4.877 . 0 0 "[ . 1 . 2]" 3
1672 1 16 ALA MB 1 33 GLU H . . 3.390 3.103 2.910 3.259 . 0 0 "[ . 1 . 2]" 3
1673 1 16 ALA H 1 16 ALA MB . . 2.910 2.195 2.112 2.227 . 0 0 "[ . 1 . 2]" 3
1674 1 15 TYR HA 1 16 ALA MB . . 4.090 4.000 3.954 4.011 . 0 0 "[ . 1 . 2]" 3
1675 1 16 ALA MB 1 34 ASN HB2 . . 3.820 3.332 3.051 3.656 . 0 0 "[ . 1 . 2]" 3
1676 1 16 ALA MB 1 36 ARG HD3 . . 3.450 2.450 2.085 2.807 . 0 0 "[ . 1 . 2]" 3
1677 1 16 ALA MB 1 30 ILE MD . . 4.450 4.310 4.066 4.399 . 0 0 "[ . 1 . 2]" 3
1678 1 91 GLU H 1 92 SER HA . . 5.310 5.153 4.921 5.260 . 0 0 "[ . 1 . 2]" 3
1679 1 91 GLU QB 1 92 SER HA . . 4.460 3.942 3.806 4.077 . 0 0 "[ . 1 . 2]" 3
1680 1 49 ILE HA 1 50 MET H . . 3.290 2.237 2.146 2.620 . 0 0 "[ . 1 . 2]" 3
1681 1 81 GLU HA 1 84 GLN H . . 4.000 3.684 3.635 3.733 . 0 0 "[ . 1 . 2]" 3
1682 1 80 TRP HA 1 81 GLU HA . . 4.990 4.838 4.827 4.852 . 0 0 "[ . 1 . 2]" 3
1683 1 80 TRP HB3 1 81 GLU HA . . 5.170 4.492 4.417 4.568 . 0 0 "[ . 1 . 2]" 3
1684 1 81 GLU HA 1 84 GLN HB3 . . 4.490 4.401 4.341 4.477 . 0 0 "[ . 1 . 2]" 3
1685 1 81 GLU HA 1 84 GLN HB2 . . 3.420 2.962 2.889 3.061 . 0 0 "[ . 1 . 2]" 3
1686 1 81 GLU HA 1 84 GLN HG2 . . 4.170 3.608 3.474 3.704 . 0 0 "[ . 1 . 2]" 3
1687 1 16 ALA MB 1 33 GLU HA . . 5.370 4.763 4.579 4.992 . 0 0 "[ . 1 . 2]" 3
1688 1 16 ALA H 1 33 GLU HA . . 4.820 4.694 4.501 4.835 0.015 2 0 "[ . 1 . 2]" 3
1689 1 15 TYR QD 1 33 GLU HA . . 4.610 3.386 3.151 3.876 . 0 0 "[ . 1 . 2]" 3
1690 1 15 TYR HA 1 33 GLU HA . . 4.810 4.828 4.816 4.839 0.029 18 0 "[ . 1 . 2]" 3
1691 1 32 LYS HA 1 33 GLU HA . . 4.580 4.555 4.533 4.568 . 0 0 "[ . 1 . 2]" 3
1692 1 15 TYR HB3 1 33 GLU HA . . 3.560 2.762 2.672 2.867 . 0 0 "[ . 1 . 2]" 3
1693 1 49 ILE MG 1 50 MET H . . 4.130 2.256 1.885 4.002 . 0 0 "[ . 1 . 2]" 3
1694 1 41 VAL H 1 49 ILE MG . . 4.390 2.796 2.304 3.869 . 0 0 "[ . 1 . 2]" 3
1695 1 40 LEU HB2 1 49 ILE MG . . 4.400 4.070 3.725 4.392 . 0 0 "[ . 1 . 2]" 3
1696 1 26 CYS HA 1 28 SER H . . 5.150 4.994 4.801 5.075 . 0 0 "[ . 1 . 2]" 3
1697 1 25 THR HA 1 26 CYS HA . . 4.860 4.569 4.527 4.596 . 0 0 "[ . 1 . 2]" 3
1698 1 26 CYS HA 1 26 CYS HB2 . . 2.990 2.409 2.383 2.444 . 0 0 "[ . 1 . 2]" 3
1699 1 26 CYS HA 1 26 CYS HB3 . . 2.990 2.500 2.462 2.529 . 0 0 "[ . 1 . 2]" 3
1700 1 25 THR MG 1 26 CYS HA . . 3.900 3.296 3.155 3.520 . 0 0 "[ . 1 . 2]" 3
1701 1 30 ILE MG 1 37 LEU H . . 5.130 5.038 4.911 5.138 0.008 3 0 "[ . 1 . 2]" 3
1702 1 30 ILE MG 1 31 ASN H . . 3.470 3.337 3.301 3.404 . 0 0 "[ . 1 . 2]" 3
1703 1 30 ILE MG 1 55 HIS HD2 . . 3.620 2.955 2.772 3.184 . 0 0 "[ . 1 . 2]" 3
1704 1 30 ILE MG 1 36 ARG HA . . 4.390 4.238 4.123 4.392 0.002 9 0 "[ . 1 . 2]" 3
1705 1 30 ILE MG 1 55 HIS HA . . 4.130 3.756 3.649 3.893 . 0 0 "[ . 1 . 2]" 3
1706 1 30 ILE HA 1 30 ILE MG . . 3.270 2.320 2.282 2.365 . 0 0 "[ . 1 . 2]" 3
1707 1 16 ALA HA 1 30 ILE MG . . 4.640 4.622 4.429 4.662 0.022 9 0 "[ . 1 . 2]" 3
1708 1 30 ILE MG 1 34 ASN HB3 . . 3.300 3.275 3.119 3.322 0.022 12 0 "[ . 1 . 2]" 3
1709 1 30 ILE MG 1 36 ARG HD3 . . 3.500 2.206 1.979 2.413 . 0 0 "[ . 1 . 2]" 3
1710 1 23 CYS HB2 1 30 ILE MG . . 4.790 4.740 4.649 4.792 0.002 9 0 "[ . 1 . 2]" 3
1711 1 30 ILE MG 1 36 ARG HB2 . . 4.000 3.333 3.196 3.462 . 0 0 "[ . 1 . 2]" 3
1712 1 30 ILE MG 1 36 ARG HD2 . . 3.870 3.353 2.900 3.625 . 0 0 "[ . 1 . 2]" 3
1713 1 16 ALA MB 1 30 ILE MG . . 2.980 2.343 2.216 2.400 . 0 0 "[ . 1 . 2]" 3
1714 1 30 ILE HG13 1 30 ILE MG . . 3.540 3.160 3.136 3.175 . 0 0 "[ . 1 . 2]" 3
1715 1 30 ILE HG12 1 30 ILE MG . . 3.420 2.185 2.064 2.283 . 0 0 "[ . 1 . 2]" 3
1716 1 40 LEU HA 1 49 ILE MG . . 4.460 2.939 2.517 3.745 . 0 0 "[ . 1 . 2]" 3
1717 1 30 ILE MG 1 31 ASN HA . . 4.840 4.425 4.373 4.472 . 0 0 "[ . 1 . 2]" 3
1718 1 66 ILE MG 1 72 VAL H . . 4.900 3.950 3.751 4.175 . 0 0 "[ . 1 . 2]" 3
1719 1 66 ILE MG 1 89 TYR QD . . 4.290 3.739 3.426 3.992 . 0 0 "[ . 1 . 2]" 3
1720 1 66 ILE MG 1 89 TYR QE . . 4.220 3.841 3.534 4.061 . 0 0 "[ . 1 . 2]" 3
1721 1 66 ILE MG 1 68 SER HA . . 4.470 3.441 3.326 3.629 . 0 0 "[ . 1 . 2]" 3
1722 1 66 ILE HA 1 66 ILE MG . . 3.150 2.317 2.174 2.433 . 0 0 "[ . 1 . 2]" 3
1723 1 49 ILE MG 1 51 PRO QD . . 4.080 2.814 2.285 3.321 . 0 0 "[ . 1 . 2]" 3
1724 1 66 ILE MG 1 71 ASP HB2 . . 4.300 3.194 2.501 4.255 . 0 0 "[ . 1 . 2]" 3
1725 1 11 TRP HB2 1 66 ILE MG . . 4.460 3.572 3.373 3.786 . 0 0 "[ . 1 . 2]" 3
1726 1 66 ILE MG 1 72 VAL HB . . 5.450 4.486 4.338 4.747 . 0 0 "[ . 1 . 2]" 3
1727 1 66 ILE MG 1 67 LYS QB . . 4.420 3.676 3.533 4.257 . 0 0 "[ . 1 . 2]" 3
1728 1 66 ILE MG 1 90 VAL MG1 . . 2.910 1.872 1.784 2.118 . 0 0 "[ . 1 . 2]" 3
1729 1 66 ILE MG 1 72 VAL MG2 . . 2.750 2.161 2.041 2.402 . 0 0 "[ . 1 . 2]" 3
1730 1 66 ILE HG12 1 66 ILE MG . . 3.360 2.300 2.244 2.347 . 0 0 "[ . 1 . 2]" 3
1731 1 87 ARG HA 1 88 LYS HA . . 4.770 4.734 4.724 4.749 . 0 0 "[ . 1 . 2]" 3
1732 1 88 LYS HA 1 91 GLU HG2 . . 4.860 4.757 4.515 4.862 0.002 11 0 "[ . 1 . 2]" 3
1733 1 88 LYS HA 1 91 GLU HG3 . . 4.270 4.161 3.951 4.280 0.010 19 0 "[ . 1 . 2]" 3
1734 1 88 LYS HA 1 91 GLU QB . . 3.290 3.209 3.039 3.294 0.004 1 0 "[ . 1 . 2]" 3
1735 1 88 LYS HA 1 88 LYS HG2 . . 3.450 2.829 2.780 2.876 . 0 0 "[ . 1 . 2]" 3
1736 1 32 LYS HA 1 33 GLU H . . 2.920 2.403 2.360 2.438 . 0 0 "[ . 1 . 2]" 3
1737 1 16 ALA HA 1 32 LYS HA . . 4.790 4.194 4.020 4.457 . 0 0 "[ . 1 . 2]" 3
1738 1 32 LYS HA 1 33 GLU HG2 . . 4.580 4.544 4.512 4.575 . 0 0 "[ . 1 . 2]" 3
1739 1 16 ALA MB 1 32 LYS HA . . 3.170 1.924 1.793 2.049 . 0 0 "[ . 1 . 2]" 3
1740 1 32 LYS HA 1 32 LYS HG3 . . 4.030 3.856 3.848 3.867 . 0 0 "[ . 1 . 2]" 3
1741 1 86 ILE MG 1 87 ARG H . . 3.490 3.257 3.154 3.354 . 0 0 "[ . 1 . 2]" 3
1742 1 72 VAL H 1 86 ILE MG . . 5.140 4.458 4.352 4.711 . 0 0 "[ . 1 . 2]" 3
1743 1 86 ILE H 1 86 ILE MG . . 3.840 3.781 3.774 3.790 . 0 0 "[ . 1 . 2]" 3
1744 1 86 ILE MG 1 89 TYR QD . . 4.090 3.682 3.404 4.029 . 0 0 "[ . 1 . 2]" 3
1745 1 35 PHE HZ 1 86 ILE MG . . 4.850 4.509 4.356 4.691 . 0 0 "[ . 1 . 2]" 3
1746 1 86 ILE HA 1 86 ILE MG . . 2.830 2.233 2.131 2.365 . 0 0 "[ . 1 . 2]" 3
1747 1 86 ILE MG 1 89 TYR HB3 . . 4.380 3.761 3.652 3.821 . 0 0 "[ . 1 . 2]" 3
1748 1 86 ILE MG 1 89 TYR HB2 . . 5.340 5.176 5.048 5.241 . 0 0 "[ . 1 . 2]" 3
1749 1 72 VAL HB 1 86 ILE MG . . 4.070 3.279 3.151 3.442 . 0 0 "[ . 1 . 2]" 3
1750 1 86 ILE HG13 1 86 ILE MG . . 3.130 2.445 2.371 2.509 . 0 0 "[ . 1 . 2]" 3
1751 1 86 ILE HG12 1 86 ILE MG . . 3.260 3.186 3.176 3.193 . 0 0 "[ . 1 . 2]" 3
1752 1 66 ILE MG 1 86 ILE MG . . 3.250 2.976 2.658 3.185 . 0 0 "[ . 1 . 2]" 3
1753 1 66 ILE MD 1 86 ILE MG . . 3.200 2.567 2.391 2.832 . 0 0 "[ . 1 . 2]" 3
1754 1 76 GLU H 1 77 SER HA . . 5.180 5.086 5.014 5.186 0.006 18 0 "[ . 1 . 2]" 3
1755 1 76 GLU HG3 1 77 SER HA . . 4.710 3.617 3.468 3.775 . 0 0 "[ . 1 . 2]" 3
1756 1 90 VAL HA 1 91 GLU HA . . 4.790 4.708 4.606 4.750 . 0 0 "[ . 1 . 2]" 3
1757 1 91 GLU HA 1 91 GLU HG2 . . 3.430 2.777 2.736 2.812 . 0 0 "[ . 1 . 2]" 3
1758 1 76 GLU HA 1 76 GLU HB3 . . 2.920 2.439 2.395 2.469 . 0 0 "[ . 1 . 2]" 3
1759 1 90 VAL MG2 1 91 GLU HA . . 3.790 3.614 3.458 3.803 0.013 10 0 "[ . 1 . 2]" 3
1760 1 26 CYS H 1 27 LYS HA . . 4.500 4.279 4.059 4.434 . 0 0 "[ . 1 . 2]" 3
1761 1 23 CYS HB3 1 27 LYS HA . . 4.770 3.951 3.815 4.043 . 0 0 "[ . 1 . 2]" 3
1762 1 27 LYS HA 1 27 LYS QD . . 3.990 2.693 2.010 3.544 . 0 0 "[ . 1 . 2]" 3
1763 1 76 GLU HA 1 83 GLN HE21 . . 3.900 3.723 3.508 3.900 . 0 0 "[ . 1 . 2]" 3
1764 1 76 GLU HA 1 83 GLN HE22 . . 3.570 2.723 2.567 2.908 . 0 0 "[ . 1 . 2]" 3
1765 1 75 ILE HA 1 76 GLU HA . . 5.050 4.742 4.708 4.791 . 0 0 "[ . 1 . 2]" 3
1766 1 76 GLU HA 1 76 GLU HB2 . . 2.990 2.455 2.424 2.502 . 0 0 "[ . 1 . 2]" 3
1767 1 75 ILE HG12 1 76 GLU HA . . 4.840 4.092 3.857 4.196 . 0 0 "[ . 1 . 2]" 3
1768 1 23 CYS HA 1 30 ILE HG13 . . 4.740 3.909 3.737 3.997 . 0 0 "[ . 1 . 2]" 3
1769 1 23 CYS HA 1 30 ILE HG12 . . 5.130 4.420 4.292 4.490 . 0 0 "[ . 1 . 2]" 3
1770 1 28 SER HA 1 29 VAL H . . 2.770 2.562 2.523 2.620 . 0 0 "[ . 1 . 2]" 3
1771 1 28 SER HA 1 29 VAL MG2 . . 4.290 4.124 4.098 4.159 . 0 0 "[ . 1 . 2]" 3
1772 1 28 SER HA 1 29 VAL MG1 . . 5.500 5.552 5.537 5.578 0.078 14 0 "[ . 1 . 2]" 3
1773 1 59 ILE MG 1 65 GLN H . . 5.070 4.846 4.649 4.972 . 0 0 "[ . 1 . 2]" 3
1774 1 59 ILE MG 1 60 LEU H . . 3.750 3.309 3.227 3.442 . 0 0 "[ . 1 . 2]" 3
1775 1 11 TRP HZ2 1 59 ILE MG . . 3.940 3.559 3.336 3.817 . 0 0 "[ . 1 . 2]" 3
1776 1 11 TRP HE3 1 59 ILE MG . . 4.890 4.034 3.759 4.382 . 0 0 "[ . 1 . 2]" 3
1777 1 11 TRP HH2 1 59 ILE MG . . 3.500 2.219 1.959 2.667 . 0 0 "[ . 1 . 2]" 3
1778 1 59 ILE H 1 59 ILE MG . . 3.910 3.786 3.771 3.794 . 0 0 "[ . 1 . 2]" 3
1779 1 59 ILE MG 1 89 TYR QE . . 4.400 4.226 4.024 4.398 . 0 0 "[ . 1 . 2]" 3
1780 1 11 TRP HZ3 1 59 ILE MG . . 3.970 2.683 2.297 3.235 . 0 0 "[ . 1 . 2]" 3
1781 1 59 ILE MG 1 65 GLN HA . . 4.550 4.169 3.860 4.391 . 0 0 "[ . 1 . 2]" 3
1782 1 59 ILE HA 1 59 ILE MG . . 3.180 2.365 2.297 2.469 . 0 0 "[ . 1 . 2]" 3
1783 1 59 ILE MG 1 60 LEU HA . . 3.890 3.494 3.383 3.573 . 0 0 "[ . 1 . 2]" 3
1784 1 54 ASN HB2 1 59 ILE MG . . 4.780 4.281 4.181 4.436 . 0 0 "[ . 1 . 2]" 3
1785 1 59 ILE MG 1 65 GLN HG3 . . 3.370 2.170 2.006 2.379 . 0 0 "[ . 1 . 2]" 3
1786 1 59 ILE MG 1 65 GLN HB3 . . 3.390 2.269 1.984 2.491 . 0 0 "[ . 1 . 2]" 3
1787 1 59 ILE MG 1 65 GLN HG2 . . 3.760 3.622 3.458 3.747 . 0 0 "[ . 1 . 2]" 3
1788 1 59 ILE MG 1 65 GLN HB2 . . 3.320 2.756 2.498 2.913 . 0 0 "[ . 1 . 2]" 3
1789 1 59 ILE HG12 1 59 ILE MG . . 3.450 3.181 3.174 3.198 . 0 0 "[ . 1 . 2]" 3
1790 1 37 LEU HB2 1 59 ILE MG . . 4.430 3.993 3.726 4.108 . 0 0 "[ . 1 . 2]" 3
1791 1 59 ILE MG 1 60 LEU HG . . 4.700 4.054 3.916 4.191 . 0 0 "[ . 1 . 2]" 3
1792 1 59 ILE HG13 1 59 ILE MG . . 3.170 2.463 2.387 2.524 . 0 0 "[ . 1 . 2]" 3
1793 1 59 ILE MD 1 59 ILE MG . . 2.740 1.913 1.866 1.984 . 0 0 "[ . 1 . 2]" 3
1794 1 59 ILE MG 1 60 LEU MD2 . . 3.620 3.610 3.539 3.629 0.009 20 0 "[ . 1 . 2]" 3
1795 1 59 ILE MG 1 66 ILE MD . . 3.320 2.962 2.888 3.092 . 0 0 "[ . 1 . 2]" 3
1796 1 59 ILE MG 1 66 ILE HG12 . . 4.290 4.129 3.967 4.283 . 0 0 "[ . 1 . 2]" 3
1797 1 67 LYS HA 1 68 SER HA . . 4.860 4.605 4.582 4.634 . 0 0 "[ . 1 . 2]" 3
1798 1 66 ILE HA 1 67 LYS HA . . 4.480 4.355 4.349 4.365 . 0 0 "[ . 1 . 2]" 3
1799 1 67 LYS HA 1 67 LYS QD . . 4.260 3.550 2.026 4.375 0.115 10 0 "[ . 1 . 2]" 3
1800 1 67 LYS HA 1 67 LYS QG . . 3.360 2.595 2.170 3.342 . 0 0 "[ . 1 . 2]" 3
1801 1 67 LYS HA 1 90 VAL MG1 . . 3.980 3.551 3.302 3.799 . 0 0 "[ . 1 . 2]" 3
1802 1 66 ILE MG 1 67 LYS HA . . 4.420 3.914 3.762 4.078 . 0 0 "[ . 1 . 2]" 3
1803 1 75 ILE MG 1 76 GLU H . . 2.890 2.054 1.879 2.321 . 0 0 "[ . 1 . 2]" 3
1804 1 75 ILE MG 1 77 SER H . . 4.300 4.088 3.963 4.182 . 0 0 "[ . 1 . 2]" 3
1805 1 75 ILE H 1 75 ILE MG . . 2.830 2.295 2.092 2.414 . 0 0 "[ . 1 . 2]" 3
1806 1 75 ILE MG 1 78 LEU H . . 4.950 4.807 4.654 4.888 . 0 0 "[ . 1 . 2]" 3
1807 1 70 ASP HA 1 75 ILE MG . . 4.980 4.188 3.968 4.494 . 0 0 "[ . 1 . 2]" 3
1808 1 73 GLU HA 1 75 ILE MG . . 4.650 3.940 3.718 4.180 . 0 0 "[ . 1 . 2]" 3
1809 1 75 ILE MG 1 76 GLU HA . . 3.680 3.207 2.962 3.334 . 0 0 "[ . 1 . 2]" 3
1810 1 75 ILE HA 1 75 ILE MG . . 3.450 3.185 3.177 3.193 . 0 0 "[ . 1 . 2]" 3
1811 1 75 ILE MG 1 76 GLU HG2 . . 3.790 3.542 3.366 3.734 . 0 0 "[ . 1 . 2]" 3
1812 1 72 VAL HB 1 75 ILE MG . . 3.380 3.036 2.683 3.231 . 0 0 "[ . 1 . 2]" 3
1813 1 69 VAL HB 1 75 ILE MG . . 3.650 3.186 2.838 3.472 . 0 0 "[ . 1 . 2]" 3
1814 1 75 ILE HG13 1 75 ILE MG . . 3.270 3.184 3.172 3.191 . 0 0 "[ . 1 . 2]" 3
1815 1 75 ILE HG12 1 75 ILE MG . . 2.870 2.253 2.150 2.354 . 0 0 "[ . 1 . 2]" 3
1816 1 72 VAL MG1 1 75 ILE MG . . 3.670 3.417 3.167 3.546 . 0 0 "[ . 1 . 2]" 3
1817 1 41 VAL MG2 1 43 SER HA . . 5.270 4.842 3.764 5.271 0.001 3 0 "[ . 1 . 2]" 3
1818 1 15 TYR QE 1 79 ARG HA . . 5.000 4.928 4.644 5.037 0.037 16 0 "[ . 1 . 2]" 3
1819 1 79 ARG HA 1 80 TRP HA . . 4.530 4.301 4.297 4.306 . 0 0 "[ . 1 . 2]" 3
1820 1 79 ARG HA 1 80 TRP HB2 . . 5.150 4.883 4.833 4.942 . 0 0 "[ . 1 . 2]" 3
1821 1 79 ARG HA 1 79 ARG HD2 . . 4.710 3.487 1.976 4.718 0.008 17 0 "[ . 1 . 2]" 3
1822 1 79 ARG HA 1 79 ARG HG2 . . 3.650 2.641 2.343 2.922 . 0 0 "[ . 1 . 2]" 3
1823 1 79 ARG HA 1 79 ARG HG3 . . 3.650 3.312 2.684 3.708 0.058 12 0 "[ . 1 . 2]" 3
1824 1 24 LYS HA 1 24 LYS HG3 . . 4.190 3.790 3.627 3.824 . 0 0 "[ . 1 . 2]" 3
1825 1 24 LYS HA 1 27 LYS H . . 4.840 3.369 3.151 3.550 . 0 0 "[ . 1 . 2]" 3
1826 1 64 LYS HA 1 89 TYR QE . . 5.500 5.407 5.027 5.508 0.008 14 0 "[ . 1 . 2]" 3
1827 1 64 LYS HA 1 66 ILE H . . 4.470 4.378 4.270 4.472 0.002 14 0 "[ . 1 . 2]" 3
1828 1 64 LYS HA 1 64 LYS HD2 . . 4.420 4.348 3.961 4.418 . 0 0 "[ . 1 . 2]" 3
1829 1 64 LYS HA 1 64 LYS HG3 . . 3.620 3.387 3.271 3.744 0.124 17 0 "[ . 1 . 2]" 3
1830 1 73 GLU HA 1 74 GLY H . . 3.200 2.348 2.216 2.441 . 0 0 "[ . 1 . 2]" 3
1831 1 12 ARG HA 1 73 GLU HA . . 4.860 4.418 4.136 4.728 . 0 0 "[ . 1 . 2]" 3
1832 1 73 GLU HA 1 73 GLU QG . . 3.470 2.463 2.215 2.862 . 0 0 "[ . 1 . 2]" 3
1833 1 9 LYS HD2 1 73 GLU HA . . 4.010 3.056 2.006 4.053 0.043 3 0 "[ . 1 . 2]" 3
1834 1 9 LYS HD3 1 73 GLU HA . . 4.010 2.341 1.991 3.301 . 0 0 "[ . 1 . 2]" 3
1835 1 72 VAL MG1 1 73 GLU HA . . 5.100 4.043 3.821 4.228 . 0 0 "[ . 1 . 2]" 3
1836 1 11 TRP HE1 1 65 GLN HA . . 5.040 4.115 3.987 4.253 . 0 0 "[ . 1 . 2]" 3
1837 1 65 GLN HA 1 65 GLN HE22 . . 4.480 4.126 3.592 4.328 . 0 0 "[ . 1 . 2]" 3
1838 1 65 GLN HA 1 65 GLN HG3 . . 4.060 3.821 3.768 3.866 . 0 0 "[ . 1 . 2]" 3
1839 1 65 GLN HA 1 65 GLN HG2 . . 3.650 3.064 2.877 3.215 . 0 0 "[ . 1 . 2]" 3
1840 1 11 TRP HZ2 1 65 GLN HA . . 3.970 2.610 2.399 2.862 . 0 0 "[ . 1 . 2]" 3
1841 1 65 GLN HA 1 65 GLN HE21 . . 4.480 3.956 2.929 4.300 . 0 0 "[ . 1 . 2]" 3
1842 1 15 TYR HA 1 15 TYR QD . . 3.310 2.523 1.990 2.868 . 0 0 "[ . 1 . 2]" 3
1843 1 15 TYR HA 1 15 TYR QE . . 4.600 4.423 4.213 4.578 . 0 0 "[ . 1 . 2]" 3
1844 1 15 TYR HA 1 16 ALA HA . . 4.450 4.355 4.340 4.370 . 0 0 "[ . 1 . 2]" 3
1845 1 35 PHE QD 1 82 ASP HA . . 4.130 3.225 2.967 3.481 . 0 0 "[ . 1 . 2]" 3
1846 1 81 GLU QG 1 82 ASP HA . . 3.830 2.942 2.893 2.980 . 0 0 "[ . 1 . 2]" 3
1847 1 82 ASP HA 1 85 LYS HB2 . . 3.680 3.168 3.017 3.317 . 0 0 "[ . 1 . 2]" 3
1848 1 82 ASP HA 1 85 LYS HD2 . . 3.620 2.633 2.431 2.841 . 0 0 "[ . 1 . 2]" 3
1849 1 82 ASP HA 1 85 LYS HG2 . . 4.600 4.387 4.267 4.480 . 0 0 "[ . 1 . 2]" 3
1850 1 35 PHE QE 1 82 ASP HA . . 4.290 3.160 2.891 3.484 . 0 0 "[ . 1 . 2]" 3
1851 1 46 PHE HA 1 46 PHE QD . . 4.170 2.860 2.138 3.720 . 0 0 "[ . 1 . 2]" 3
1852 1 20 ARG HA 1 20 ARG HG3 . . 3.750 3.487 2.450 3.763 0.013 8 0 "[ . 1 . 2]" 3
1853 1 20 ARG HA 1 29 VAL MG2 . . 4.400 4.257 4.136 4.409 0.009 12 0 "[ . 1 . 2]" 3
1854 1 22 SER HA 1 30 ILE HG12 . . 4.920 4.675 4.528 4.836 . 0 0 "[ . 1 . 2]" 3
1855 1 56 ALA MB 1 57 SER H . . 3.800 2.970 2.862 3.114 . 0 0 "[ . 1 . 2]" 3
1856 1 37 LEU H 1 56 ALA MB . . 4.240 4.028 3.894 4.150 . 0 0 "[ . 1 . 2]" 3
1857 1 35 PHE QD 1 56 ALA MB . . 3.530 2.775 2.664 2.907 . 0 0 "[ . 1 . 2]" 3
1858 1 35 PHE QE 1 56 ALA MB . . 3.550 2.521 2.320 2.753 . 0 0 "[ . 1 . 2]" 3
1859 1 35 PHE HZ 1 56 ALA MB . . 4.130 2.866 2.588 3.175 . 0 0 "[ . 1 . 2]" 3
1860 1 37 LEU HA 1 56 ALA MB . . 4.970 4.635 4.500 4.836 . 0 0 "[ . 1 . 2]" 3
1861 1 36 ARG HA 1 56 ALA MB . . 3.930 2.662 2.488 2.881 . 0 0 "[ . 1 . 2]" 3
1862 1 35 PHE HA 1 56 ALA MB . . 5.030 4.329 4.210 4.503 . 0 0 "[ . 1 . 2]" 3
1863 1 56 ALA MB 1 85 LYS HD2 . . 4.110 3.733 3.494 3.920 . 0 0 "[ . 1 . 2]" 3
1864 1 37 LEU HG 1 56 ALA MB . . 3.290 2.435 2.151 2.618 . 0 0 "[ . 1 . 2]" 3
1865 1 56 ALA MB 1 60 LEU MD1 . . 3.280 2.905 2.548 3.149 . 0 0 "[ . 1 . 2]" 3
1866 1 37 LEU MD1 1 56 ALA MB . . 3.160 2.772 2.316 3.052 . 0 0 "[ . 1 . 2]" 3
1867 1 56 ALA MB 1 57 SER HA . . 4.330 3.962 3.879 4.013 . 0 0 "[ . 1 . 2]" 3
1868 1 22 SER HA 1 30 ILE HG13 . . 3.890 2.939 2.782 3.099 . 0 0 "[ . 1 . 2]" 3
1869 1 45 HIS HA 1 45 HIS HD2 . . 5.040 3.622 2.201 4.930 . 0 0 "[ . 1 . 2]" 3
1870 1 17 LYS HA 1 32 LYS HA . . 4.900 4.151 4.004 4.289 . 0 0 "[ . 1 . 2]" 3
1871 1 17 LYS HA 1 33 GLU H . . 4.500 3.725 3.454 3.911 . 0 0 "[ . 1 . 2]" 3
1872 1 17 LYS HA 1 17 LYS HG3 . . 3.680 3.047 2.302 3.735 0.055 19 0 "[ . 1 . 2]" 3
1873 1 17 LYS HA 1 32 LYS HB2 . . 3.690 2.494 2.152 2.610 . 0 0 "[ . 1 . 2]" 3
1874 1 16 ALA MB 1 17 LYS HA . . 4.320 4.156 4.015 4.298 . 0 0 "[ . 1 . 2]" 3
1875 1 17 LYS HA 1 32 LYS HG3 . . 4.150 4.052 3.460 4.170 0.020 16 0 "[ . 1 . 2]" 3
1876 1 19 SER HA 1 20 ARG HA . . 5.130 4.595 4.572 4.643 . 0 0 "[ . 1 . 2]" 3
1877 1 19 SER HA 1 32 LYS H . . 3.930 3.290 2.912 3.430 . 0 0 "[ . 1 . 2]" 3
1878 1 19 SER HA 1 31 ASN HA . . 3.590 2.447 2.242 2.940 . 0 0 "[ . 1 . 2]" 3
1879 1 18 SER HA 1 32 LYS QD . . 3.610 2.476 2.292 2.753 . 0 0 "[ . 1 . 2]" 3
1880 1 18 SER HA 1 32 LYS HB2 . . 3.770 3.515 3.370 3.642 . 0 0 "[ . 1 . 2]" 3
1881 1 16 ALA MB 1 18 SER HA . . 5.330 4.681 4.588 4.920 . 0 0 "[ . 1 . 2]" 3
1882 1 16 ALA HA 1 17 LYS HA . . 4.820 4.380 4.366 4.416 . 0 0 "[ . 1 . 2]" 3
1883 1 60 LEU HA 1 61 LYS HA . . 5.130 4.792 4.760 4.827 . 0 0 "[ . 1 . 2]" 3
1884 1 59 ILE HB 1 60 LEU HA . . 4.660 4.169 4.099 4.227 . 0 0 "[ . 1 . 2]" 3
1885 1 36 ARG HA 1 56 ALA HA . . 4.660 3.637 3.520 3.736 . 0 0 "[ . 1 . 2]" 3
1886 1 56 ALA HA 1 59 ILE HB . . 3.830 3.524 3.348 3.610 . 0 0 "[ . 1 . 2]" 3
1887 1 56 ALA HA 1 59 ILE HG12 . . 5.120 4.172 3.800 4.328 . 0 0 "[ . 1 . 2]" 3
1888 1 37 LEU HB2 1 56 ALA HA . . 3.470 2.987 2.777 3.098 . 0 0 "[ . 1 . 2]" 3
1889 1 37 LEU HG 1 56 ALA HA . . 3.470 2.392 2.208 2.685 . 0 0 "[ . 1 . 2]" 3
1890 1 37 LEU MD2 1 56 ALA HA . . 4.090 3.972 3.818 4.092 0.002 9 0 "[ . 1 . 2]" 3
1891 1 37 LEU MD1 1 56 ALA HA . . 3.080 2.151 1.968 2.330 . 0 0 "[ . 1 . 2]" 3
1892 1 68 SER HA 1 69 VAL MG1 . . 4.350 3.921 3.831 4.015 . 0 0 "[ . 1 . 2]" 3
1893 1 68 SER HA 1 90 VAL MG1 . . 3.140 2.175 1.955 2.410 . 0 0 "[ . 1 . 2]" 3
1894 1 60 LEU HA 1 89 TYR QD . . 3.720 3.396 2.753 3.729 0.009 16 0 "[ . 1 . 2]" 3
1895 1 60 LEU HA 1 89 TYR QE . . 3.460 3.076 2.462 3.457 . 0 0 "[ . 1 . 2]" 3
1896 1 60 LEU HA 1 60 LEU HG . . 3.620 3.010 2.962 3.078 . 0 0 "[ . 1 . 2]" 3
1897 1 60 LEU HA 1 60 LEU MD1 . . 3.950 3.878 3.871 3.888 . 0 0 "[ . 1 . 2]" 3
1898 1 42 GLN HA 1 50 MET H . . 5.300 4.805 4.224 5.268 . 0 0 "[ . 1 . 2]" 3
1899 1 42 GLN HA 1 49 ILE MG . . 4.180 3.718 2.803 4.145 . 0 0 "[ . 1 . 2]" 3
1900 1 8 HIS HA 1 9 LYS H . . 3.340 2.218 2.115 2.417 . 0 0 "[ . 1 . 2]" 3
1901 1 8 HIS HA 1 8 HIS HD2 . . 5.070 4.198 3.184 4.999 . 0 0 "[ . 1 . 2]" 3
1902 1 8 HIS HA 1 9 LYS QB . . 4.870 4.242 4.137 4.400 . 0 0 "[ . 1 . 2]" 3
1903 1 8 HIS HA 1 9 LYS HG3 . . 4.890 4.562 4.349 4.867 . 0 0 "[ . 1 . 2]" 3
1904 1 8 HIS HA 1 40 LEU MD1 . . 5.320 4.920 4.697 5.322 0.002 4 0 "[ . 1 . 2]" 3
1905 1 41 VAL MG2 1 42 GLN HA . . 4.880 4.195 3.888 4.461 . 0 0 "[ . 1 . 2]" 3
1906 1 69 VAL HB 1 70 ASP HA . . 5.070 4.428 4.264 4.484 . 0 0 "[ . 1 . 2]" 3
1907 1 69 VAL MG2 1 70 ASP HA . . 4.060 3.492 3.378 3.640 . 0 0 "[ . 1 . 2]" 3
1908 1 11 TRP HA 1 12 ARG HB2 . . 5.500 5.588 5.561 5.629 0.129 9 0 "[ . 1 . 2]" 3
1909 1 11 TRP HA 1 37 LEU HB3 . . 5.500 5.216 5.015 5.390 . 0 0 "[ . 1 . 2]" 3
1910 1 11 TRP HA 1 40 LEU H . . 4.000 2.959 2.792 3.187 . 0 0 "[ . 1 . 2]" 3
1911 1 11 TRP HA 1 11 TRP HE3 . . 3.740 3.154 3.028 3.274 . 0 0 "[ . 1 . 2]" 3
1912 1 11 TRP HA 1 11 TRP HD1 . . 4.770 4.126 4.033 4.196 . 0 0 "[ . 1 . 2]" 3
1913 1 10 PRO HA 1 11 TRP HA . . 5.370 4.562 4.546 4.590 . 0 0 "[ . 1 . 2]" 3
1914 1 11 TRP HA 1 72 VAL HA . . 5.500 4.554 4.368 4.707 . 0 0 "[ . 1 . 2]" 3
1915 1 11 TRP HA 1 39 LYS HA . . 3.600 2.676 2.386 2.851 . 0 0 "[ . 1 . 2]" 3
1916 1 10 PRO HB2 1 11 TRP HA . . 5.500 4.291 4.143 4.379 . 0 0 "[ . 1 . 2]" 3
1917 1 11 TRP HA 1 12 ARG HB3 . . 5.500 4.230 4.158 4.379 . 0 0 "[ . 1 . 2]" 3
1918 1 11 TRP HA 1 40 LEU HB2 . . 5.100 4.655 4.432 5.004 . 0 0 "[ . 1 . 2]" 3
1919 1 11 TRP HA 1 40 LEU HG . . 4.060 3.553 3.368 3.742 . 0 0 "[ . 1 . 2]" 3
1920 1 11 TRP HA 1 37 LEU MD2 . . 5.470 4.841 4.652 5.099 . 0 0 "[ . 1 . 2]" 3
1921 1 11 TRP HA 1 39 LYS HG3 . . 4.470 4.294 4.083 4.426 . 0 0 "[ . 1 . 2]" 3
1922 1 75 ILE MD 1 87 ARG H . . 3.870 3.686 3.528 3.825 . 0 0 "[ . 1 . 2]" 3
1923 1 75 ILE H 1 75 ILE MD . . 4.410 4.376 4.341 4.403 . 0 0 "[ . 1 . 2]" 3
1924 1 72 VAL H 1 75 ILE MD . . 4.360 3.974 3.764 4.099 . 0 0 "[ . 1 . 2]" 3
1925 1 75 ILE MD 1 83 GLN HA . . 3.310 3.150 3.020 3.311 0.001 11 0 "[ . 1 . 2]" 3
1926 1 72 VAL HB 1 75 ILE MD . . 3.210 2.207 2.035 2.366 . 0 0 "[ . 1 . 2]" 3
1927 1 75 ILE MD 1 86 ILE HB . . 3.090 2.220 2.056 2.411 . 0 0 "[ . 1 . 2]" 3
1928 1 75 ILE HB 1 75 ILE MD . . 2.940 2.401 2.316 2.440 . 0 0 "[ . 1 . 2]" 3
1929 1 75 ILE MD 1 86 ILE HG13 . . 3.340 1.974 1.865 2.128 . 0 0 "[ . 1 . 2]" 3
1930 1 75 ILE MD 1 75 ILE MG . . 2.690 2.071 1.927 2.229 . 0 0 "[ . 1 . 2]" 3
1931 1 75 ILE MD 1 86 ILE MG . . 2.670 1.930 1.794 2.036 . 0 0 "[ . 1 . 2]" 3
1932 1 75 ILE MD 1 78 LEU MD1 . . 3.570 3.376 3.177 3.504 . 0 0 "[ . 1 . 2]" 3
1933 1 60 LEU MD2 1 75 ILE MD . . 5.500 5.323 5.104 5.454 . 0 0 "[ . 1 . 2]" 3
1934 1 75 ILE MD 1 78 LEU MD2 . . 5.500 5.420 5.204 5.514 0.014 6 0 "[ . 1 . 2]" 3
1935 1 35 PHE HA 1 35 PHE QD . . 3.360 2.270 2.198 2.318 . 0 0 "[ . 1 . 2]" 3
1936 1 15 TYR QD 1 35 PHE HA . . 3.490 3.062 2.443 3.415 . 0 0 "[ . 1 . 2]" 3
1937 1 15 TYR QE 1 35 PHE HA . . 4.340 3.515 3.001 3.794 . 0 0 "[ . 1 . 2]" 3
1938 1 35 PHE HA 1 36 ARG HA . . 5.150 4.394 4.391 4.399 . 0 0 "[ . 1 . 2]" 3
1939 1 34 ASN HB3 1 35 PHE HA . . 4.790 4.648 4.493 4.703 . 0 0 "[ . 1 . 2]" 3
1940 1 35 PHE HA 1 36 ARG HG2 . . 5.090 3.927 3.694 4.057 . 0 0 "[ . 1 . 2]" 3
1941 1 35 PHE HA 1 36 ARG HG3 . . 5.100 4.839 4.687 5.011 . 0 0 "[ . 1 . 2]" 3
1942 1 16 ALA H 1 35 PHE HA . . 4.480 4.248 4.024 4.399 . 0 0 "[ . 1 . 2]" 3
1943 1 24 LYS H 1 30 ILE MD . . 4.310 4.245 4.120 4.313 0.003 20 0 "[ . 1 . 2]" 3
1944 1 21 SER H 1 30 ILE MD . . 5.500 5.152 4.979 5.312 . 0 0 "[ . 1 . 2]" 3
1945 1 30 ILE MD 1 56 ALA H . . 5.500 5.392 5.218 5.500 . 0 0 "[ . 1 . 2]" 3
1946 1 23 CYS H 1 30 ILE MD . . 3.980 2.689 2.443 2.828 . 0 0 "[ . 1 . 2]" 3
1947 1 30 ILE H 1 30 ILE MD . . 3.860 3.559 3.449 3.647 . 0 0 "[ . 1 . 2]" 3
1948 1 30 ILE MD 1 54 ASN H . . 4.120 3.611 3.468 3.808 . 0 0 "[ . 1 . 2]" 3
1949 1 30 ILE MD 1 55 HIS HD2 . . 4.830 4.164 4.076 4.345 . 0 0 "[ . 1 . 2]" 3
1950 1 30 ILE MD 1 53 TRP HD1 . . 4.900 4.773 4.590 4.905 0.005 16 0 "[ . 1 . 2]" 3
1951 1 30 ILE MD 1 53 TRP HE3 . . 4.440 4.112 3.936 4.252 . 0 0 "[ . 1 . 2]" 3
1952 1 30 ILE MD 1 54 ASN HA . . 3.600 2.980 2.791 3.234 . 0 0 "[ . 1 . 2]" 3
1953 1 30 ILE MD 1 36 ARG HA . . 4.850 4.743 4.467 4.839 . 0 0 "[ . 1 . 2]" 3
1954 1 22 SER HA 1 30 ILE MD . . 4.260 3.294 3.116 3.462 . 0 0 "[ . 1 . 2]" 3
1955 1 23 CYS HA 1 30 ILE MD . . 3.260 2.194 2.102 2.287 . 0 0 "[ . 1 . 2]" 3
1956 1 30 ILE MD 1 55 HIS HA . . 4.150 3.732 3.543 3.848 . 0 0 "[ . 1 . 2]" 3
1957 1 30 ILE HA 1 30 ILE MD . . 4.280 3.883 3.867 3.896 . 0 0 "[ . 1 . 2]" 3
1958 1 21 SER QB 1 30 ILE MD . . 3.900 3.072 2.685 3.379 . 0 0 "[ . 1 . 2]" 3
1959 1 23 CYS HB3 1 30 ILE MD . . 4.220 3.774 3.648 3.897 . 0 0 "[ . 1 . 2]" 3
1960 1 30 ILE MD 1 53 TRP HB2 . . 3.610 3.291 3.128 3.440 . 0 0 "[ . 1 . 2]" 3
1961 1 30 ILE MD 1 53 TRP HB3 . . 3.440 2.387 2.273 2.485 . 0 0 "[ . 1 . 2]" 3
1962 1 30 ILE MD 1 36 ARG HD3 . . 4.230 3.024 2.822 3.439 . 0 0 "[ . 1 . 2]" 3
1963 1 23 CYS HB2 1 30 ILE MD . . 3.730 2.471 2.344 2.623 . 0 0 "[ . 1 . 2]" 3
1964 1 30 ILE MD 1 36 ARG HD2 . . 4.010 2.937 2.611 3.300 . 0 0 "[ . 1 . 2]" 3
1965 1 30 ILE HB 1 30 ILE MD . . 3.160 2.217 2.148 2.300 . 0 0 "[ . 1 . 2]" 3
1966 1 30 ILE MD 1 30 ILE MG . . 2.930 2.271 2.145 2.451 . 0 0 "[ . 1 . 2]" 3
1967 1 12 ARG HA 1 73 GLU HB3 . . 3.720 2.283 1.991 2.523 . 0 0 "[ . 1 . 2]" 3
1968 1 12 ARG HA 1 12 ARG HG2 . . 4.090 3.814 3.672 3.985 . 0 0 "[ . 1 . 2]" 3
1969 1 12 ARG HA 1 40 LEU MD2 . . 5.500 5.316 5.004 5.432 . 0 0 "[ . 1 . 2]" 3
1970 1 12 ARG HA 1 73 GLU QG . . 4.420 4.193 3.775 4.446 0.026 17 0 "[ . 1 . 2]" 3
1971 1 12 ARG HA 1 12 ARG HG3 . . 4.090 3.669 3.567 3.770 . 0 0 "[ . 1 . 2]" 3
1972 1 14 GLU HA 1 15 TYR QD . . 4.730 3.813 3.556 4.078 . 0 0 "[ . 1 . 2]" 3
1973 1 13 ALA HA 1 14 GLU HA . . 4.840 4.406 4.379 4.434 . 0 0 "[ . 1 . 2]" 3
1974 1 14 GLU HA 1 15 TYR HA . . 4.900 4.328 4.323 4.334 . 0 0 "[ . 1 . 2]" 3
1975 1 14 GLU HA 1 14 GLU HG2 . . 4.190 3.675 3.637 3.730 . 0 0 "[ . 1 . 2]" 3
1976 1 14 GLU HA 1 14 GLU HG3 . . 4.210 3.829 3.766 3.880 . 0 0 "[ . 1 . 2]" 3
1977 1 13 ALA MB 1 14 GLU HA . . 4.280 3.918 3.860 3.973 . 0 0 "[ . 1 . 2]" 3
1978 1 14 GLU HA 1 78 LEU MD2 . . 3.370 2.682 2.521 2.855 . 0 0 "[ . 1 . 2]" 3
1979 1 12 ARG HA 1 73 GLU HB2 . . 4.120 3.510 2.975 3.927 . 0 0 "[ . 1 . 2]" 3
1980 1 9 LYS HA 1 10 PRO HD2 . . 3.270 2.264 2.122 2.473 . 0 0 "[ . 1 . 2]" 3
1981 1 9 LYS HA 1 10 PRO HD3 . . 3.100 2.268 2.254 2.331 . 0 0 "[ . 1 . 2]" 3
1982 1 9 LYS HA 1 10 PRO HG3 . . 4.630 4.402 4.340 4.518 . 0 0 "[ . 1 . 2]" 3
1983 1 9 LYS HA 1 9 LYS HG2 . . 3.500 2.902 2.743 3.455 . 0 0 "[ . 1 . 2]" 3
1984 1 39 LYS HA 1 40 LEU H . . 3.120 2.189 2.145 2.256 . 0 0 "[ . 1 . 2]" 3
1985 1 11 TRP HE3 1 39 LYS HA . . 4.440 3.291 3.092 3.512 . 0 0 "[ . 1 . 2]" 3
1986 1 39 LYS HA 1 40 LEU HA . . 5.030 4.451 4.405 4.505 . 0 0 "[ . 1 . 2]" 3
1987 1 39 LYS HA 1 40 LEU HB2 . . 5.450 4.693 4.595 4.814 . 0 0 "[ . 1 . 2]" 3
1988 1 39 LYS HA 1 52 MET HB2 . . 5.500 4.510 4.374 4.609 . 0 0 "[ . 1 . 2]" 3
1989 1 39 LYS HA 1 39 LYS HG2 . . 4.180 3.271 3.009 3.402 . 0 0 "[ . 1 . 2]" 3
1990 1 39 LYS HA 1 39 LYS HG3 . . 3.750 2.424 2.361 2.529 . 0 0 "[ . 1 . 2]" 3
1991 1 40 LEU HA 1 40 LEU HG . . 4.230 3.211 3.119 3.354 . 0 0 "[ . 1 . 2]" 3
1992 1 11 TRP HZ2 1 66 ILE MD . . 5.360 4.935 4.779 5.133 . 0 0 "[ . 1 . 2]" 3
1993 1 66 ILE MD 1 72 VAL H . . 5.500 5.204 4.875 5.509 0.009 3 0 "[ . 1 . 2]" 3
1994 1 66 ILE MD 1 69 VAL HA . . 5.270 4.497 4.308 4.635 . 0 0 "[ . 1 . 2]" 3
1995 1 66 ILE MD 1 86 ILE HA . . 5.440 3.860 3.659 4.077 . 0 0 "[ . 1 . 2]" 3
1996 1 59 ILE HB 1 66 ILE MD . . 4.950 4.267 4.059 4.394 . 0 0 "[ . 1 . 2]" 3
1997 1 65 GLN HB2 1 66 ILE MD . . 4.190 3.929 3.676 4.042 . 0 0 "[ . 1 . 2]" 3
1998 1 37 LEU HB3 1 66 ILE MD . . 4.700 4.151 3.797 4.526 . 0 0 "[ . 1 . 2]" 3
1999 1 11 TRP HB2 1 66 ILE MD . . 4.760 3.703 3.465 4.087 . 0 0 "[ . 1 . 2]" 3
2000 1 66 ILE HB 1 66 ILE MD . . 3.160 2.375 2.260 2.461 . 0 0 "[ . 1 . 2]" 3
2001 1 40 LEU HA 1 52 MET H . . 4.880 3.831 3.238 4.221 . 0 0 "[ . 1 . 2]" 3
2002 1 40 LEU HA 1 51 PRO HB3 . . 5.290 3.872 3.263 4.427 . 0 0 "[ . 1 . 2]" 3
2003 1 11 TRP HD1 1 66 ILE MD . . 4.580 4.289 4.057 4.526 . 0 0 "[ . 1 . 2]" 3
2004 1 66 ILE MD 1 89 TYR QD . . 3.800 3.312 2.834 3.764 . 0 0 "[ . 1 . 2]" 3
2005 1 66 ILE MD 1 89 TYR QE . . 3.850 3.373 2.877 3.852 0.002 17 0 "[ . 1 . 2]" 3
2006 1 66 ILE HA 1 66 ILE MD . . 4.170 3.866 3.835 3.929 . 0 0 "[ . 1 . 2]" 3
2007 1 66 ILE MD 1 72 VAL MG2 . . 2.840 2.267 1.961 2.657 . 0 0 "[ . 1 . 2]" 3
2008 1 66 ILE MD 1 66 ILE MG . . 2.820 2.047 1.927 2.205 . 0 0 "[ . 1 . 2]" 3
2009 1 49 ILE HA 1 49 ILE MD . . 3.970 3.702 2.226 3.938 . 0 0 "[ . 1 . 2]" 3
2010 1 36 ARG HA 1 37 LEU HB2 . . 5.370 4.383 4.289 4.450 . 0 0 "[ . 1 . 2]" 3
2011 1 15 TYR QD 1 78 LEU HA . . 4.390 4.140 3.921 4.292 . 0 0 "[ . 1 . 2]" 3
2012 1 15 TYR QE 1 78 LEU HA . . 3.120 2.517 2.146 2.873 . 0 0 "[ . 1 . 2]" 3
2013 1 78 LEU HA 1 82 ASP HB2 . . 4.420 4.027 3.863 4.120 . 0 0 "[ . 1 . 2]" 3
2014 1 78 LEU HA 1 78 LEU HG . . 4.000 3.325 3.265 3.359 . 0 0 "[ . 1 . 2]" 3
2015 1 78 LEU HA 1 78 LEU MD1 . . 4.330 3.920 3.861 3.984 . 0 0 "[ . 1 . 2]" 3
2016 1 49 ILE H 1 49 ILE MD . . 4.960 3.651 2.896 4.107 . 0 0 "[ . 1 . 2]" 3
2017 1 8 HIS HD2 1 49 ILE MD . . 4.690 4.089 2.901 4.689 . 0 0 "[ . 1 . 2]" 3
2018 1 8 HIS HB2 1 49 ILE MD . . 5.030 4.817 4.321 5.032 0.002 9 0 "[ . 1 . 2]" 3
2019 1 42 GLN QG 1 49 ILE MD . . 4.380 3.397 1.915 4.386 0.006 14 0 "[ . 1 . 2]" 3
2020 1 36 ARG HA 1 37 LEU MD1 . . 5.500 4.819 4.523 4.968 . 0 0 "[ . 1 . 2]" 3
2021 1 86 ILE MD 1 87 ARG H . . 4.680 4.489 4.430 4.535 . 0 0 "[ . 1 . 2]" 3
2022 1 35 PHE QE 1 86 ILE MD . . 3.430 2.750 2.629 2.952 . 0 0 "[ . 1 . 2]" 3
2023 1 35 PHE HZ 1 86 ILE MD . . 3.190 1.917 1.772 2.029 . 0 0 "[ . 1 . 2]" 3
2024 1 13 ALA HA 1 86 ILE MD . . 5.500 5.459 5.350 5.528 0.028 18 0 "[ . 1 . 2]" 3
2025 1 86 ILE HA 1 86 ILE MD . . 3.060 2.244 2.092 2.415 . 0 0 "[ . 1 . 2]" 3
2026 1 86 ILE MD 1 89 TYR HB3 . . 4.850 4.299 4.139 4.497 . 0 0 "[ . 1 . 2]" 3
2027 1 72 VAL HB 1 86 ILE MD . . 4.690 4.558 4.397 4.692 0.002 7 0 "[ . 1 . 2]" 3
2028 1 86 ILE HB 1 86 ILE MD . . 3.220 3.211 3.199 3.221 0.001 14 0 "[ . 1 . 2]" 3
2029 1 75 ILE HG13 1 86 ILE MD . . 3.610 3.583 3.485 3.626 0.016 16 0 "[ . 1 . 2]" 3
2030 1 78 LEU MD1 1 86 ILE MD . . 3.190 3.120 2.973 3.198 0.008 3 0 "[ . 1 . 2]" 3
2031 1 56 ALA MB 1 86 ILE MD . . 3.960 3.544 3.404 3.685 . 0 0 "[ . 1 . 2]" 3
2032 1 60 LEU MD2 1 86 ILE MD . . 3.220 2.373 2.089 2.563 . 0 0 "[ . 1 . 2]" 3
2033 1 31 ASN HA 1 32 LYS HA . . 4.970 4.315 4.309 4.339 . 0 0 "[ . 1 . 2]" 3
2034 1 31 ASN HA 1 32 LYS H . . 3.020 2.252 2.164 2.296 . 0 0 "[ . 1 . 2]" 3
2035 1 31 ASN HA 1 32 LYS HB3 . . 4.660 4.364 4.353 4.376 . 0 0 "[ . 1 . 2]" 3
2036 1 30 ILE HB 1 31 ASN HA . . 5.390 5.228 5.194 5.268 . 0 0 "[ . 1 . 2]" 3
2037 1 29 VAL MG2 1 31 ASN HA . . 5.500 5.546 5.538 5.556 0.056 4 0 "[ . 1 . 2]" 3
2038 1 15 TYR H 1 16 ALA HA . . 5.500 5.468 5.407 5.509 0.009 16 0 "[ . 1 . 2]" 3
2039 1 16 ALA HA 1 34 ASN H . . 5.500 5.014 4.806 5.152 . 0 0 "[ . 1 . 2]" 3
2040 1 16 ALA HA 1 36 ARG HE . . 4.160 3.342 2.797 4.014 . 0 0 "[ . 1 . 2]" 3
2041 1 16 ALA HA 1 36 ARG HD3 . . 4.820 4.222 3.892 4.478 . 0 0 "[ . 1 . 2]" 3
2042 1 14 GLU HB2 1 16 ALA HA . . 5.500 5.506 5.463 5.521 0.021 8 0 "[ . 1 . 2]" 3
2043 1 14 GLU HG3 1 16 ALA HA . . 4.620 4.264 4.088 4.491 . 0 0 "[ . 1 . 2]" 3
2044 1 24 LYS QE 1 52 MET HA . . 4.910 4.017 3.294 4.923 0.013 19 0 "[ . 1 . 2]" 3
2045 1 52 MET HA 1 53 TRP HB2 . . 5.450 4.522 4.490 4.616 . 0 0 "[ . 1 . 2]" 3
2046 1 52 MET HA 1 52 MET HG2 . . 3.930 2.556 2.353 2.863 . 0 0 "[ . 1 . 2]" 3
2047 1 52 MET HA 1 52 MET ME . . 4.580 3.837 2.486 4.478 . 0 0 "[ . 1 . 2]" 3
2048 1 89 TYR QD 1 94 ALA HA . . 5.500 4.067 2.458 5.527 0.027 19 0 "[ . 1 . 2]" 3
2049 1 93 GLY QA 1 94 ALA HA . . 4.420 4.053 3.930 4.134 . 0 0 "[ . 1 . 2]" 3
2050 1 12 ARG H 1 37 LEU HA . . 5.070 4.198 4.119 4.315 . 0 0 "[ . 1 . 2]" 3
2051 1 11 TRP HE3 1 37 LEU HA . . 4.890 4.316 4.097 4.506 . 0 0 "[ . 1 . 2]" 3
2052 1 37 LEU HA 1 53 TRP HZ3 . . 4.060 3.937 3.623 4.081 0.021 13 0 "[ . 1 . 2]" 3
2053 1 37 LEU HA 1 37 LEU HG . . 3.770 2.958 2.885 3.027 . 0 0 "[ . 1 . 2]" 3
2054 1 89 TYR QE 1 94 ALA HA . . 4.890 3.696 2.651 4.750 . 0 0 "[ . 1 . 2]" 3
2055 1 54 ASN HA 1 54 ASN HD21 . . 4.770 4.281 4.105 4.464 . 0 0 "[ . 1 . 2]" 3
2056 1 23 CYS HA 1 54 ASN HA . . 3.330 2.587 2.415 2.771 . 0 0 "[ . 1 . 2]" 3
2057 1 23 CYS HB2 1 54 ASN HA . . 4.520 3.153 2.921 3.343 . 0 0 "[ . 1 . 2]" 3
2058 1 54 ASN HA 1 59 ILE HG12 . . 5.240 4.657 4.544 4.782 . 0 0 "[ . 1 . 2]" 3
2059 1 30 ILE HG13 1 54 ASN HA . . 5.500 5.137 4.947 5.329 . 0 0 "[ . 1 . 2]" 3
2060 1 54 ASN HA 1 59 ILE HG13 . . 5.500 5.356 5.189 5.463 . 0 0 "[ . 1 . 2]" 3
2061 1 60 LEU MD1 1 89 TYR QD . . 4.780 4.406 4.147 4.627 . 0 0 "[ . 1 . 2]" 3
2062 1 66 ILE HG13 1 89 TYR QD . . 5.210 4.561 4.146 4.982 . 0 0 "[ . 1 . 2]" 3
2063 1 10 PRO HD2 1 11 TRP HD1 . . 4.780 4.376 4.122 4.599 . 0 0 "[ . 1 . 2]" 3
2064 1 10 PRO HD2 1 72 VAL HA . . 5.250 4.525 4.425 4.651 . 0 0 "[ . 1 . 2]" 3
2065 1 10 PRO HD2 1 71 ASP HB2 . . 4.270 3.757 2.410 4.300 0.030 18 0 "[ . 1 . 2]" 3
2066 1 9 LYS QB 1 10 PRO HD2 . . 4.390 2.527 1.980 2.838 . 0 0 "[ . 1 . 2]" 3
2067 1 9 LYS HG2 1 10 PRO HD2 . . 4.360 2.869 2.597 3.373 . 0 0 "[ . 1 . 2]" 3
2068 1 10 PRO HD3 1 11 TRP H . . 4.410 3.844 3.835 3.881 . 0 0 "[ . 1 . 2]" 3
2069 1 9 LYS QB 1 10 PRO HD3 . . 4.530 3.756 3.358 3.966 . 0 0 "[ . 1 . 2]" 3
2070 1 9 LYS HG2 1 10 PRO HD3 . . 4.670 4.179 3.882 4.705 0.035 18 0 "[ . 1 . 2]" 3
2071 1 10 PRO HD3 1 11 TRP HD1 . . 5.350 5.182 4.977 5.333 . 0 0 "[ . 1 . 2]" 3
2072 1 15 TYR QD 1 36 ARG H . . 4.870 4.496 3.714 4.882 0.012 17 0 "[ . 1 . 2]" 3
2073 1 15 TYR QD 1 34 ASN H . . 4.700 3.601 2.821 4.718 0.018 15 0 "[ . 1 . 2]" 3
2074 1 14 GLU HB2 1 15 TYR QD . . 5.260 5.101 4.974 5.254 . 0 0 "[ . 1 . 2]" 3
2075 1 50 MET HA 1 51 PRO QD . . 2.910 1.882 1.853 1.952 . 0 0 "[ . 1 . 2]" 3
2076 1 13 ALA HA 1 14 GLU H . . 2.970 2.148 2.142 2.164 . 0 0 "[ . 1 . 2]" 3
2077 1 13 ALA HA 1 35 PHE QD . . 5.210 4.111 3.990 4.284 . 0 0 "[ . 1 . 2]" 3
2078 1 13 ALA HA 1 35 PHE QE . . 4.090 3.100 2.917 3.326 . 0 0 "[ . 1 . 2]" 3
2079 1 13 ALA HA 1 35 PHE HZ . . 5.500 5.263 5.024 5.494 . 0 0 "[ . 1 . 2]" 3
2080 1 12 ARG HA 1 13 ALA HA . . 5.000 4.437 4.427 4.449 . 0 0 "[ . 1 . 2]" 3
2081 1 13 ALA HA 1 37 LEU MD2 . . 3.350 2.683 2.524 2.851 . 0 0 "[ . 1 . 2]" 3
2082 1 13 ALA HA 1 37 LEU MD1 . . 5.500 5.393 5.242 5.500 . 0 0 "[ . 1 . 2]" 3
2083 1 13 ALA HA 1 38 GLY H . . 4.740 4.254 4.034 4.445 . 0 0 "[ . 1 . 2]" 3
2084 1 13 ALA HA 1 14 GLU HG2 . . 4.980 3.784 3.672 3.908 . 0 0 "[ . 1 . 2]" 3
2085 1 12 ARG HB2 1 13 ALA HA . . 4.990 4.688 4.498 4.764 . 0 0 "[ . 1 . 2]" 3
2086 1 110 GLY QA 1 111 PRO QD . . 3.420 1.947 1.844 2.132 . 0 0 "[ . 1 . 2]" 3
2087 1 15 TYR QE 1 78 LEU MD1 . . 5.180 4.800 4.035 5.194 0.014 14 0 "[ . 1 . 2]" 3
2088 1 49 ILE HA 1 49 ILE MG . . 3.530 2.360 2.277 2.450 . 0 0 "[ . 1 . 2]" 3
2089 1 65 GLN HA 1 89 TYR QE . . 5.490 5.216 5.031 5.446 . 0 0 "[ . 1 . 2]" 3
2090 1 9 LYS HG2 1 71 ASP HA . . 3.880 2.624 2.280 3.015 . 0 0 "[ . 1 . 2]" 3
2091 1 10 PRO HG2 1 71 ASP HA . . 4.830 3.963 3.740 4.170 . 0 0 "[ . 1 . 2]" 3
2092 1 10 PRO HD3 1 71 ASP HA . . 3.930 3.896 3.700 3.952 0.022 12 0 "[ . 1 . 2]" 3
2093 1 10 PRO HD2 1 71 ASP HA . . 3.590 2.762 2.568 2.864 . 0 0 "[ . 1 . 2]" 3
2094 1 15 TYR HH 1 78 LEU HA . . 4.810 3.516 3.130 3.879 . 0 0 "[ . 1 . 2]" 3
2095 1 15 TYR HH 1 82 ASP HB2 . . 4.250 3.643 3.415 3.882 . 0 0 "[ . 1 . 2]" 3
2096 1 15 TYR HH 1 82 ASP HB3 . . 4.350 4.132 3.954 4.355 0.005 15 0 "[ . 1 . 2]" 3
2097 1 15 TYR HH 1 79 ARG HB2 . . 4.970 2.535 1.997 2.872 . 0 0 "[ . 1 . 2]" 3
2098 1 15 TYR HH 1 79 ARG HB3 . . 5.270 4.244 3.709 4.610 . 0 0 "[ . 1 . 2]" 3
2099 1 15 TYR HH 1 78 LEU MD2 . . 4.550 3.808 3.321 4.247 . 0 0 "[ . 1 . 2]" 3
2100 1 29 VAL H 1 55 HIS HE1 . . 4.890 4.185 4.065 4.255 . 0 0 "[ . 1 . 2]" 3
2101 1 23 CYS HB3 1 55 HIS HE1 . . 3.940 2.686 2.496 2.865 . 0 0 "[ . 1 . 2]" 3
2102 1 28 SER HB2 1 55 HIS HE1 . . 3.400 2.043 1.996 2.321 . 0 0 "[ . 1 . 2]" 3
2103 1 23 CYS HB2 1 55 HIS HE1 . . 3.950 2.553 2.444 2.640 . 0 0 "[ . 1 . 2]" 3
2104 1 30 ILE HG13 1 55 HIS HE1 . . 5.110 3.177 3.043 3.291 . 0 0 "[ . 1 . 2]" 3
2105 1 30 ILE HG12 1 55 HIS HE1 . . 5.390 3.439 3.321 3.528 . 0 0 "[ . 1 . 2]" 3
2106 1 58 CYS HA 1 61 LYS HG2 . . 4.260 2.267 2.114 2.498 . 0 0 "[ . 1 . 2]" 3
2107 1 25 THR MG 1 58 CYS HB3 . . 3.160 2.173 2.121 2.204 . 0 0 "[ . 1 . 2]" 3
2108 1 25 THR MG 1 61 LYS QE . . 3.420 2.444 1.840 3.262 . 0 0 "[ . 1 . 2]" 3
2109 1 25 THR MG 1 59 ILE HA . . 4.500 4.348 3.961 4.492 . 0 0 "[ . 1 . 2]" 3
2110 1 22 SER HA 1 29 VAL HA . . 3.040 2.150 2.021 2.293 . 0 0 "[ . 1 . 2]" 3
2111 1 8 HIS QB 1 9 LYS H . . 3.980 3.019 2.354 3.534 . 0 0 "[ . 1 . 2]" 3
2112 1 8 HIS QB 1 40 LEU MD1 . . 4.340 3.252 2.596 3.681 . 0 0 "[ . 1 . 2]" 3
2113 1 8 HIS QB 1 49 ILE MD . . 4.410 4.220 3.812 4.415 0.005 12 0 "[ . 1 . 2]" 3
2114 1 9 LYS H 1 9 LYS QD . . 4.450 3.301 2.068 4.084 . 0 0 "[ . 1 . 2]" 3
2115 1 9 LYS HA 1 10 PRO QG . . 4.040 3.922 3.844 4.049 0.009 3 0 "[ . 1 . 2]" 3
2116 1 9 LYS QD 1 73 GLU H . . 4.860 3.222 2.853 4.095 . 0 0 "[ . 1 . 2]" 3
2117 1 9 LYS QD 1 73 GLU HB3 . . 4.230 3.414 3.214 3.915 . 0 0 "[ . 1 . 2]" 3
2118 1 9 LYS QD 1 73 GLU QG . . 3.860 2.698 2.088 3.324 . 0 0 "[ . 1 . 2]" 3
2119 1 10 PRO HB3 1 71 ASP QB . . 4.860 4.501 4.253 4.628 . 0 0 "[ . 1 . 2]" 3
2120 1 10 PRO QG 1 11 TRP H . . 3.260 2.152 1.882 2.371 . 0 0 "[ . 1 . 2]" 3
2121 1 10 PRO QG 1 11 TRP HD1 . . 3.330 2.192 1.985 2.352 . 0 0 "[ . 1 . 2]" 3
2122 1 10 PRO QG 1 11 TRP HE1 . . 4.320 4.107 3.866 4.305 . 0 0 "[ . 1 . 2]" 3
2123 1 10 PRO QG 1 66 ILE MG . . 4.850 4.168 3.895 4.339 . 0 0 "[ . 1 . 2]" 3
2124 1 10 PRO QG 1 71 ASP HA . . 4.120 3.628 3.413 3.826 . 0 0 "[ . 1 . 2]" 3
2125 1 10 PRO QG 1 71 ASP QB . . 3.190 1.937 1.857 2.184 . 0 0 "[ . 1 . 2]" 3
2126 1 10 PRO HD2 1 71 ASP QB . . 3.580 2.632 2.392 2.752 . 0 0 "[ . 1 . 2]" 3
2127 1 10 PRO HD3 1 71 ASP QB . . 4.010 3.528 3.137 3.756 . 0 0 "[ . 1 . 2]" 3
2128 1 11 TRP HD1 1 71 ASP QB . . 3.980 3.065 2.691 3.545 . 0 0 "[ . 1 . 2]" 3
2129 1 11 TRP HE1 1 71 ASP QB . . 5.340 4.969 4.479 5.344 0.004 17 0 "[ . 1 . 2]" 3
2130 1 11 TRP HZ2 1 39 LYS QD . . 4.200 2.669 2.216 3.202 . 0 0 "[ . 1 . 2]" 3
2131 1 11 TRP HH2 1 39 LYS QD . . 4.180 2.364 2.142 2.911 . 0 0 "[ . 1 . 2]" 3
2132 1 12 ARG HA 1 12 ARG QG . . 3.540 3.324 3.313 3.344 . 0 0 "[ . 1 . 2]" 3
2133 1 12 ARG HB2 1 12 ARG QD . . 3.720 2.658 2.038 3.027 . 0 0 "[ . 1 . 2]" 3
2134 1 12 ARG QG 1 13 ALA H . . 3.760 3.532 3.347 3.807 0.047 13 0 "[ . 1 . 2]" 3
2135 1 12 ARG QG 1 53 TRP HZ3 . . 4.610 2.692 2.444 2.994 . 0 0 "[ . 1 . 2]" 3
2136 1 12 ARG QG 1 53 TRP HH2 . . 3.980 3.300 2.756 3.858 . 0 0 "[ . 1 . 2]" 3
2137 1 12 ARG QD 1 40 LEU MD1 . . 5.340 3.862 2.965 4.648 . 0 0 "[ . 1 . 2]" 3
2138 1 12 ARG QD 1 40 LEU MD2 . . 4.390 2.620 1.947 3.808 . 0 0 "[ . 1 . 2]" 3
2139 1 13 ALA MB 1 74 GLY QA . . 4.230 3.370 3.210 3.473 . 0 0 "[ . 1 . 2]" 3
2140 1 15 TYR QD 1 35 PHE QB . . 4.090 3.638 3.324 3.827 . 0 0 "[ . 1 . 2]" 3
2141 1 15 TYR QE 1 35 PHE QB . . 3.400 2.506 1.991 2.840 . 0 0 "[ . 1 . 2]" 3
2142 1 15 TYR QE 1 79 ARG QG . . 4.090 3.152 2.817 3.620 . 0 0 "[ . 1 . 2]" 3
2143 1 15 TYR QE 1 79 ARG QD . . 4.730 4.279 3.095 4.736 0.006 7 0 "[ . 1 . 2]" 3
2144 1 15 TYR HH 1 79 ARG QG . . 4.780 2.943 2.587 3.374 . 0 0 "[ . 1 . 2]" 3
2145 1 16 ALA HA 1 17 LYS QG . . 4.720 3.874 3.363 4.548 . 0 0 "[ . 1 . 2]" 3
2146 1 17 LYS HA 1 17 LYS QG . . 3.130 2.418 2.271 2.679 . 0 0 "[ . 1 . 2]" 3
2147 1 17 LYS QB 1 18 SER H . . 4.280 3.118 2.662 3.804 . 0 0 "[ . 1 . 2]" 3
2148 1 17 LYS QD 1 17 LYS QG . . 2.430 2.044 2.017 2.091 . 0 0 "[ . 1 . 2]" 3
2149 1 18 SER QB 1 20 ARG H . . 4.680 2.765 2.457 3.111 . 0 0 "[ . 1 . 2]" 3
2150 1 18 SER QB 1 20 ARG QG . . 3.500 2.767 2.153 3.508 0.008 9 0 "[ . 1 . 2]" 3
2151 1 20 ARG H 1 20 ARG QB . . 3.500 2.320 2.245 2.383 . 0 0 "[ . 1 . 2]" 3
2152 1 20 ARG HA 1 20 ARG QG . . 3.060 2.508 2.192 2.840 . 0 0 "[ . 1 . 2]" 3
2153 1 20 ARG QB 1 21 SER H . . 4.370 2.619 2.472 2.733 . 0 0 "[ . 1 . 2]" 3
2154 1 20 ARG QG 1 21 SER H . . 5.190 4.188 4.049 4.339 . 0 0 "[ . 1 . 2]" 3
2155 1 22 SER H 1 22 SER QB . . 3.450 2.789 2.680 2.948 . 0 0 "[ . 1 . 2]" 3
2156 1 22 SER QB 1 23 CYS H . . 3.390 3.072 2.963 3.145 . 0 0 "[ . 1 . 2]" 3
2157 1 22 SER QB 1 27 LYS HA . . 4.170 4.029 3.843 4.141 . 0 0 "[ . 1 . 2]" 3
2158 1 22 SER QB 1 29 VAL MG2 . . 4.160 3.095 2.895 3.279 . 0 0 "[ . 1 . 2]" 3
2159 1 22 SER QB 1 30 ILE H . . 4.830 4.393 4.263 4.661 . 0 0 "[ . 1 . 2]" 3
2160 1 24 LYS H 1 24 LYS QG . . 3.210 2.684 2.614 2.850 . 0 0 "[ . 1 . 2]" 3
2161 1 24 LYS QG 1 25 THR H . . 4.450 3.870 2.088 4.150 . 0 0 "[ . 1 . 2]" 3
2162 1 24 LYS QG 1 52 MET HA . . 4.500 3.522 3.216 4.218 . 0 0 "[ . 1 . 2]" 3
2163 1 24 LYS QG 1 52 MET HB3 . . 4.030 3.248 2.620 3.486 . 0 0 "[ . 1 . 2]" 3
2164 1 24 LYS QG 1 54 ASN HB3 . . 5.340 5.153 3.722 5.345 0.005 12 0 "[ . 1 . 2]" 3
2165 1 24 LYS QG 1 54 ASN HD21 . . 5.340 4.932 4.068 5.340 . 0 0 "[ . 1 . 2]" 3
2166 1 25 THR MG 1 26 CYS QB . . 3.820 2.932 2.802 3.097 . 0 0 "[ . 1 . 2]" 3
2167 1 25 THR MG 1 62 LYS QG . . 4.780 3.386 3.062 3.672 . 0 0 "[ . 1 . 2]" 3
2168 1 26 CYS H 1 26 CYS QB . . 3.150 2.763 2.634 2.945 . 0 0 "[ . 1 . 2]" 3
2169 1 26 CYS H 1 27 LYS QG . . 4.480 4.228 3.837 4.514 0.034 15 0 "[ . 1 . 2]" 3
2170 1 26 CYS QB 1 28 SER H . . 4.200 4.102 3.957 4.200 0.000 7 0 "[ . 1 . 2]" 3
2171 1 27 LYS H 1 27 LYS QB . . 3.540 3.406 3.327 3.451 . 0 0 "[ . 1 . 2]" 3
2172 1 27 LYS H 1 27 LYS QG . . 3.430 2.880 2.758 3.008 . 0 0 "[ . 1 . 2]" 3
2173 1 27 LYS HA 1 27 LYS QG . . 3.340 2.756 2.349 3.032 . 0 0 "[ . 1 . 2]" 3
2174 1 27 LYS QB 1 27 LYS QE . . 4.530 2.740 1.980 3.771 . 0 0 "[ . 1 . 2]" 3
2175 1 27 LYS QB 1 28 SER H . . 4.050 3.875 3.851 3.887 . 0 0 "[ . 1 . 2]" 3
2176 1 27 LYS QG 1 28 SER H . . 4.820 4.649 4.570 4.714 . 0 0 "[ . 1 . 2]" 3
2177 1 29 VAL MG1 1 31 ASN QD . . 3.980 2.529 2.091 3.039 . 0 0 "[ . 1 . 2]" 3
2178 1 29 VAL MG2 1 31 ASN QD . . 5.110 4.581 4.124 5.099 . 0 0 "[ . 1 . 2]" 3
2179 1 30 ILE MG 1 36 ARG QB . . 3.420 2.266 2.152 2.384 . 0 0 "[ . 1 . 2]" 3
2180 1 30 ILE MD 1 36 ARG QB . . 3.570 2.802 2.631 2.891 . 0 0 "[ . 1 . 2]" 3
2181 1 32 LYS HG2 1 33 GLU QB . . 4.300 3.681 3.639 3.705 . 0 0 "[ . 1 . 2]" 3
2182 1 33 GLU QB 1 34 ASN H . . 4.330 3.768 3.761 3.800 . 0 0 "[ . 1 . 2]" 3
2183 1 35 PHE H 1 35 PHE QB . . 3.650 2.199 2.181 2.229 . 0 0 "[ . 1 . 2]" 3
2184 1 35 PHE QB 1 36 ARG H . . 4.070 3.885 3.832 3.932 . 0 0 "[ . 1 . 2]" 3
2185 1 35 PHE QB 1 56 ALA MB . . 4.100 3.329 3.187 3.487 . 0 0 "[ . 1 . 2]" 3
2186 1 36 ARG QB 1 36 ARG HD2 . . 3.660 2.291 2.144 2.426 . 0 0 "[ . 1 . 2]" 3
2187 1 36 ARG QB 1 36 ARG HD3 . . 3.710 2.483 2.353 2.647 . 0 0 "[ . 1 . 2]" 3
2188 1 36 ARG QB 1 37 LEU H . . 3.170 2.065 1.965 2.216 . 0 0 "[ . 1 . 2]" 3
2189 1 36 ARG QB 1 53 TRP HB3 . . 4.890 4.095 3.854 4.273 . 0 0 "[ . 1 . 2]" 3
2190 1 36 ARG QB 1 53 TRP HE3 . . 4.100 3.305 2.979 3.592 . 0 0 "[ . 1 . 2]" 3
2191 1 36 ARG QB 1 54 ASN H . . 4.480 3.347 3.158 3.515 . 0 0 "[ . 1 . 2]" 3
2192 1 36 ARG QB 1 55 HIS HA . . 4.370 2.949 2.864 3.053 . 0 0 "[ . 1 . 2]" 3
2193 1 36 ARG QB 1 56 ALA H . . 3.820 3.559 3.424 3.706 . 0 0 "[ . 1 . 2]" 3
2194 1 36 ARG QB 1 56 ALA MB . . 5.110 4.197 4.084 4.321 . 0 0 "[ . 1 . 2]" 3
2195 1 39 LYS H 1 39 LYS QD . . 4.630 4.406 4.375 4.438 . 0 0 "[ . 1 . 2]" 3
2196 1 39 LYS HA 1 39 LYS QD . . 4.250 3.861 3.733 4.004 . 0 0 "[ . 1 . 2]" 3
2197 1 39 LYS HB2 1 39 LYS QD . . 3.520 2.159 2.056 2.323 . 0 0 "[ . 1 . 2]" 3
2198 1 39 LYS QD 1 41 VAL MG1 . . 4.390 3.232 2.908 3.421 . 0 0 "[ . 1 . 2]" 3
2199 1 40 LEU MD2 1 51 PRO QG . . 4.230 3.637 3.251 4.037 . 0 0 "[ . 1 . 2]" 3
2200 1 41 VAL MG2 1 50 MET QB . . 4.420 2.910 1.970 3.609 . 0 0 "[ . 1 . 2]" 3
2201 1 42 GLN H 1 42 GLN QB . . 3.600 2.465 2.373 2.594 . 0 0 "[ . 1 . 2]" 3
2202 1 42 GLN HA 1 49 ILE QG . . 4.970 3.411 2.220 4.788 . 0 0 "[ . 1 . 2]" 3
2203 1 46 PHE QB 1 47 ASP H . . 4.380 3.324 2.011 4.035 . 0 0 "[ . 1 . 2]" 3
2204 1 47 ASP QB 1 48 GLY H . . 4.180 3.547 2.331 4.046 . 0 0 "[ . 1 . 2]" 3
2205 1 49 ILE QG 1 49 ILE MG . . 3.170 2.257 2.095 2.416 . 0 0 "[ . 1 . 2]" 3
2206 1 49 ILE QG 1 50 MET H . . 4.930 4.061 3.868 4.638 . 0 0 "[ . 1 . 2]" 3
2207 1 50 MET HA 1 51 PRO QG . . 4.780 3.796 3.768 3.853 . 0 0 "[ . 1 . 2]" 3
2208 1 50 MET QB 1 51 PRO QD . . 3.920 3.612 3.347 3.767 . 0 0 "[ . 1 . 2]" 3
2209 1 51 PRO QG 1 53 TRP HE1 . . 3.530 2.941 2.790 3.037 . 0 0 "[ . 1 . 2]" 3
2210 1 55 HIS HB3 1 57 SER QB . . 4.290 3.300 3.201 3.444 . 0 0 "[ . 1 . 2]" 3
2211 1 56 ALA H 1 57 SER QB . . 4.840 4.511 4.455 4.583 . 0 0 "[ . 1 . 2]" 3
2212 1 56 ALA MB 1 57 SER QB . . 4.540 3.841 3.761 3.910 . 0 0 "[ . 1 . 2]" 3
2213 1 57 SER H 1 57 SER QB . . 3.570 2.321 2.253 2.360 . 0 0 "[ . 1 . 2]" 3
2214 1 57 SER QB 1 58 CYS H . . 3.850 3.012 2.922 3.082 . 0 0 "[ . 1 . 2]" 3
2215 1 57 SER QB 1 60 LEU QB . . 5.120 4.617 4.491 4.779 . 0 0 "[ . 1 . 2]" 3
2216 1 59 ILE HA 1 62 LYS QG . . 4.270 3.275 2.578 3.951 . 0 0 "[ . 1 . 2]" 3
2217 1 59 ILE HA 1 65 GLN QE . . 5.340 4.620 2.864 5.263 . 0 0 "[ . 1 . 2]" 3
2218 1 61 LYS HA 1 61 LYS QG . . 3.520 3.348 3.330 3.421 . 0 0 "[ . 1 . 2]" 3
2219 1 61 LYS QE 1 61 LYS QG . . 3.110 2.155 2.065 2.304 . 0 0 "[ . 1 . 2]" 3
2220 1 61 LYS QG 1 62 LYS H . . 4.360 2.285 2.184 2.444 . 0 0 "[ . 1 . 2]" 3
2221 1 62 LYS H 1 62 LYS QG . . 3.100 2.622 2.013 2.942 . 0 0 "[ . 1 . 2]" 3
2222 1 62 LYS HA 1 62 LYS QG . . 3.740 2.342 2.210 2.618 . 0 0 "[ . 1 . 2]" 3
2223 1 62 LYS HB2 1 65 GLN QE . . 4.610 2.935 2.532 3.366 . 0 0 "[ . 1 . 2]" 3
2224 1 62 LYS HB3 1 65 GLN QE . . 3.750 2.340 1.871 3.634 . 0 0 "[ . 1 . 2]" 3
2225 1 62 LYS QE 1 62 LYS QG . . 3.140 2.222 2.048 2.760 . 0 0 "[ . 1 . 2]" 3
2226 1 62 LYS QG 1 65 GLN HG3 . . 5.050 4.245 3.955 4.561 . 0 0 "[ . 1 . 2]" 3
2227 1 62 LYS QE 1 65 GLN QE . . 4.490 3.545 2.171 4.411 . 0 0 "[ . 1 . 2]" 3
2228 1 63 THR HB 1 64 LYS QG . . 3.500 3.158 2.824 3.476 . 0 0 "[ . 1 . 2]" 3
2229 1 64 LYS H 1 64 LYS QD . . 5.340 4.660 4.055 4.790 . 0 0 "[ . 1 . 2]" 3
2230 1 64 LYS HA 1 64 LYS QG . . 3.040 2.342 2.245 2.584 . 0 0 "[ . 1 . 2]" 3
2231 1 64 LYS HA 1 64 LYS QD . . 3.740 3.634 2.506 3.736 . 0 0 "[ . 1 . 2]" 3
2232 1 64 LYS HB3 1 64 LYS QD . . 3.300 2.227 2.092 2.258 . 0 0 "[ . 1 . 2]" 3
2233 1 65 GLN HA 1 65 GLN QE . . 3.840 3.590 2.806 3.843 0.003 1 0 "[ . 1 . 2]" 3
2234 1 65 GLN QE 1 65 GLN HG2 . . 3.390 2.337 2.104 3.300 . 0 0 "[ . 1 . 2]" 3
2235 1 68 SER H 1 71 ASP QB . . 3.360 2.763 2.509 3.310 . 0 0 "[ . 1 . 2]" 3
2236 1 68 SER HB2 1 70 ASP QB . . 4.750 4.373 4.214 4.760 0.010 18 0 "[ . 1 . 2]" 3
2237 1 68 SER HB3 1 70 ASP QB . . 4.030 3.051 2.668 3.350 . 0 0 "[ . 1 . 2]" 3
2238 1 69 VAL H 1 70 ASP QB . . 4.630 4.487 4.389 4.612 . 0 0 "[ . 1 . 2]" 3
2239 1 69 VAL MG2 1 70 ASP QB . . 4.230 3.398 3.258 3.698 . 0 0 "[ . 1 . 2]" 3
2240 1 70 ASP H 1 70 ASP QB . . 2.940 2.226 2.163 2.260 . 0 0 "[ . 1 . 2]" 3
2241 1 70 ASP HA 1 71 ASP QB . . 5.340 5.340 5.296 5.390 0.050 8 0 "[ . 1 . 2]" 3
2242 1 70 ASP QB 1 72 VAL H . . 5.140 4.623 4.500 4.742 . 0 0 "[ . 1 . 2]" 3
2243 1 71 ASP H 1 71 ASP QB . . 3.160 2.288 2.155 2.544 . 0 0 "[ . 1 . 2]" 3
2244 1 71 ASP QB 1 72 VAL H . . 4.230 3.273 2.967 3.811 . 0 0 "[ . 1 . 2]" 3
2245 1 73 GLU HA 1 74 GLY QA . . 4.610 4.033 3.971 4.075 . 0 0 "[ . 1 . 2]" 3
2246 1 73 GLU QG 1 74 GLY QA . . 4.570 3.150 2.898 3.714 . 0 0 "[ . 1 . 2]" 3
2247 1 74 GLY QA 1 77 SER H . . 4.560 3.370 3.253 3.441 . 0 0 "[ . 1 . 2]" 3
2248 1 77 SER H 1 77 SER QB . . 2.700 2.304 2.263 2.362 . 0 0 "[ . 1 . 2]" 3
2249 1 77 SER QB 1 78 LEU H . . 3.770 3.125 2.980 3.316 . 0 0 "[ . 1 . 2]" 3
2250 1 77 SER QB 1 78 LEU MD2 . . 4.990 3.152 2.940 3.311 . 0 0 "[ . 1 . 2]" 3
2251 1 78 LEU HA 1 79 ARG QG . . 4.650 4.153 3.910 4.341 . 0 0 "[ . 1 . 2]" 3
2252 1 79 ARG H 1 79 ARG QG . . 3.300 2.685 2.450 2.868 . 0 0 "[ . 1 . 2]" 3
2253 1 79 ARG H 1 79 ARG QD . . 4.250 4.029 3.774 4.269 0.019 10 0 "[ . 1 . 2]" 3
2254 1 79 ARG HB2 1 79 ARG QD . . 3.430 3.000 2.286 3.421 . 0 0 "[ . 1 . 2]" 3
2255 1 79 ARG HB3 1 79 ARG QD . . 3.370 2.421 2.171 2.748 . 0 0 "[ . 1 . 2]" 3
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