NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
506003 |
1weo   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1weo
save_distance_constraint_statistics_1
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 1
_Distance_constraint_stats_list.Constraint_count 28
_Distance_constraint_stats_list.Viol_count 195
_Distance_constraint_stats_list.Viol_total 26.700
_Distance_constraint_stats_list.Viol_max 0.024
_Distance_constraint_stats_list.Viol_rms 0.0048
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0024
_Distance_constraint_stats_list.Viol_average_violations_only 0.0068
_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 19 CYS 0.189 0.012 7 0 "[ . 1 . 2]"
1 22 CYS 0.034 0.004 7 0 "[ . 1 . 2]"
1 38 CYS 0.016 0.004 15 0 "[ . 1 . 2]"
1 41 CYS 0.075 0.013 14 0 "[ . 1 . 2]"
1 46 CYS 0.914 0.024 7 0 "[ . 1 . 2]"
1 49 CYS 0.266 0.013 20 0 "[ . 1 . 2]"
1 61 CYS 0.110 0.014 14 0 "[ . 1 . 2]"
1 64 CYS 0.039 0.009 3 0 "[ . 1 . 2]"
2 1 ZN 0.831 0.024 7 0 "[ . 1 . 2]"
3 1 ZN 0.196 0.014 14 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 19 CYS SG 2 1 ZN ZN . 2.330 2.370 2.336 2.327 2.368 0.003 17 0 "[ . 1 . 2]" 1
2 1 22 CYS SG 2 1 ZN ZN . 2.330 2.370 2.354 2.330 2.372 0.002 12 0 "[ . 1 . 2]" 1
3 1 46 CYS SG 2 1 ZN ZN . 2.330 2.370 2.314 2.306 2.321 0.024 7 0 "[ . 1 . 2]" 1
4 1 49 CYS SG 2 1 ZN ZN . 2.330 2.370 2.359 2.327 2.377 0.007 15 0 "[ . 1 . 2]" 1
5 1 19 CYS CB 2 1 ZN ZN . 3.250 3.510 3.244 3.238 3.249 0.012 7 0 "[ . 1 . 2]" 1
6 1 22 CYS CB 2 1 ZN ZN . 3.250 3.510 3.472 3.389 3.514 0.004 7 0 "[ . 1 . 2]" 1
7 1 46 CYS CB 2 1 ZN ZN . 3.250 3.510 3.527 3.521 3.533 0.023 4 0 "[ . 1 . 2]" 1
8 1 49 CYS CB 2 1 ZN ZN . 3.250 3.510 3.383 3.310 3.453 . 0 0 "[ . 1 . 2]" 1
9 1 19 CYS SG 1 22 CYS SG . 3.200 4.000 3.831 3.706 3.922 . 0 0 "[ . 1 . 2]" 1
10 1 19 CYS SG 1 46 CYS SG . 3.200 4.000 4.001 3.985 4.008 0.008 12 0 "[ . 1 . 2]" 1
11 1 19 CYS SG 1 49 CYS SG . 3.200 4.000 3.897 3.746 3.985 . 0 0 "[ . 1 . 2]" 1
12 1 22 CYS SG 1 46 CYS SG . 3.200 4.000 3.892 3.750 3.992 . 0 0 "[ . 1 . 2]" 1
13 1 22 CYS SG 1 49 CYS SG . 3.200 4.000 3.985 3.897 4.004 0.004 8 0 "[ . 1 . 2]" 1
14 1 46 CYS SG 1 49 CYS SG . 3.200 4.000 3.189 3.187 3.192 0.013 20 0 "[ . 1 . 2]" 1
15 1 38 CYS SG 3 1 ZN ZN . 2.330 2.370 2.347 2.326 2.372 0.004 15 0 "[ . 1 . 2]" 1
16 1 41 CYS SG 3 1 ZN ZN . 2.330 2.370 2.330 2.317 2.337 0.013 14 0 "[ . 1 . 2]" 1
17 1 61 CYS SG 3 1 ZN ZN . 2.330 2.370 2.365 2.332 2.378 0.008 14 0 "[ . 1 . 2]" 1
18 1 64 CYS SG 3 1 ZN ZN . 2.330 2.370 2.341 2.323 2.370 0.007 3 0 "[ . 1 . 2]" 1
19 1 38 CYS CB 3 1 ZN ZN . 3.250 3.510 3.392 3.248 3.511 0.002 10 0 "[ . 1 . 2]" 1
20 1 41 CYS CB 3 1 ZN ZN . 3.250 3.510 3.366 3.243 3.515 0.007 3 0 "[ . 1 . 2]" 1
21 1 61 CYS CB 3 1 ZN ZN . 3.250 3.510 3.253 3.236 3.284 0.014 14 0 "[ . 1 . 2]" 1
22 1 64 CYS CB 3 1 ZN ZN . 3.250 3.510 3.482 3.299 3.519 0.009 3 0 "[ . 1 . 2]" 1
23 1 38 CYS SG 1 41 CYS SG . 3.200 4.000 3.902 3.689 3.991 . 0 0 "[ . 1 . 2]" 1
24 1 38 CYS SG 1 61 CYS SG . 3.200 4.000 3.910 3.793 4.000 . 0 0 "[ . 1 . 2]" 1
25 1 38 CYS SG 1 64 CYS SG . 3.200 4.000 3.718 3.534 3.970 . 0 0 "[ . 1 . 2]" 1
26 1 41 CYS SG 1 61 CYS SG . 3.200 4.000 3.978 3.766 4.008 0.008 3 0 "[ . 1 . 2]" 1
27 1 41 CYS SG 1 64 CYS SG . 3.200 4.000 3.851 3.705 3.980 . 0 0 "[ . 1 . 2]" 1
28 1 61 CYS SG 1 64 CYS SG . 3.200 4.000 3.531 3.434 3.735 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 1572
_Distance_constraint_stats_list.Viol_count 776
_Distance_constraint_stats_list.Viol_total 306.079
_Distance_constraint_stats_list.Viol_max 0.217
_Distance_constraint_stats_list.Viol_rms 0.0051
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0197
_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 PRO 0.095 0.095 1 0 "[ . 1 . 2]"
1 9 LYS 0.165 0.095 1 0 "[ . 1 . 2]"
1 10 PRO 0.078 0.070 18 0 "[ . 1 . 2]"
1 11 LEU 0.020 0.008 20 0 "[ . 1 . 2]"
1 12 LYS 0.171 0.154 12 0 "[ . 1 . 2]"
1 13 ASN 0.007 0.003 1 0 "[ . 1 . 2]"
1 14 LEU 0.025 0.007 10 0 "[ . 1 . 2]"
1 15 ASP 0.002 0.002 4 0 "[ . 1 . 2]"
1 16 GLY 0.051 0.011 3 0 "[ . 1 . 2]"
1 17 GLN 0.342 0.032 4 0 "[ . 1 . 2]"
1 18 PHE 0.635 0.039 4 0 "[ . 1 . 2]"
1 19 CYS 0.218 0.035 7 0 "[ . 1 . 2]"
1 20 GLU 0.131 0.020 2 0 "[ . 1 . 2]"
1 21 ILE 0.173 0.020 8 0 "[ . 1 . 2]"
1 22 CYS 0.217 0.030 2 0 "[ . 1 . 2]"
1 23 GLY 0.162 0.023 8 0 "[ . 1 . 2]"
1 24 ASP 0.254 0.048 3 0 "[ . 1 . 2]"
1 25 GLN 0.863 0.048 3 0 "[ . 1 . 2]"
1 26 ILE 0.818 0.032 4 0 "[ . 1 . 2]"
1 27 GLY 0.073 0.020 20 0 "[ . 1 . 2]"
1 28 LEU 0.127 0.029 20 0 "[ . 1 . 2]"
1 29 THR 0.074 0.023 15 0 "[ . 1 . 2]"
1 30 VAL 0.269 0.116 20 0 "[ . 1 . 2]"
1 31 GLU 0.137 0.062 19 0 "[ . 1 . 2]"
1 32 GLY 0.014 0.011 20 0 "[ . 1 . 2]"
1 33 ASP 0.094 0.029 20 0 "[ . 1 . 2]"
1 34 LEU 0.520 0.080 1 0 "[ . 1 . 2]"
1 35 PHE 0.798 0.072 10 0 "[ . 1 . 2]"
1 36 VAL 0.580 0.072 10 0 "[ . 1 . 2]"
1 37 ALA 0.184 0.028 18 0 "[ . 1 . 2]"
1 38 CYS 0.077 0.016 10 0 "[ . 1 . 2]"
1 39 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 GLU 0.120 0.023 17 0 "[ . 1 . 2]"
1 41 CYS 0.196 0.046 15 0 "[ . 1 . 2]"
1 42 GLY 0.078 0.016 10 0 "[ . 1 . 2]"
1 43 PHE 0.291 0.045 14 0 "[ . 1 . 2]"
1 44 PRO 0.220 0.029 10 0 "[ . 1 . 2]"
1 45 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 CYS 0.209 0.035 7 0 "[ . 1 . 2]"
1 47 ARG 0.701 0.063 7 0 "[ . 1 . 2]"
1 48 PRO 0.014 0.008 7 0 "[ . 1 . 2]"
1 49 CYS 0.085 0.030 3 0 "[ . 1 . 2]"
1 50 TYR 0.386 0.051 9 0 "[ . 1 . 2]"
1 51 GLU 0.232 0.063 7 0 "[ . 1 . 2]"
1 52 TYR 0.206 0.043 6 0 "[ . 1 . 2]"
1 53 GLU 0.226 0.057 15 0 "[ . 1 . 2]"
1 54 ARG 0.364 0.048 19 0 "[ . 1 . 2]"
1 55 ARG 1.565 0.156 17 0 "[ . 1 . 2]"
1 56 GLU 0.252 0.053 13 0 "[ . 1 . 2]"
1 57 GLY 0.554 0.085 19 0 "[ . 1 . 2]"
1 58 THR 0.140 0.057 15 0 "[ . 1 . 2]"
1 59 GLN 0.136 0.023 18 0 "[ . 1 . 2]"
1 60 ASN 0.128 0.030 15 0 "[ . 1 . 2]"
1 61 CYS 0.127 0.028 11 0 "[ . 1 . 2]"
1 62 PRO 0.033 0.022 14 0 "[ . 1 . 2]"
1 63 GLN 0.775 0.045 14 0 "[ . 1 . 2]"
1 64 CYS 0.145 0.046 15 0 "[ . 1 . 2]"
1 65 LYS 0.976 0.217 15 0 "[ . 1 . 2]"
1 66 THR 0.121 0.056 14 0 "[ . 1 . 2]"
1 67 ARG 0.121 0.056 14 0 "[ . 1 . 2]"
1 68 TYR 1.694 0.137 8 0 "[ . 1 . 2]"
1 69 LYS 2.111 0.142 7 0 "[ . 1 . 2]"
1 70 ARG 1.303 0.142 7 0 "[ . 1 . 2]"
1 71 LEU 0.272 0.051 9 0 "[ . 1 . 2]"
1 72 ARG 0.316 0.134 18 0 "[ . 1 . 2]"
1 73 GLY 0.550 0.116 20 0 "[ . 1 . 2]"
1 74 SER 0.128 0.067 11 0 "[ . 1 . 2]"
1 75 PRO 0.039 0.022 11 0 "[ . 1 . 2]"
1 76 ARG 0.352 0.069 4 0 "[ . 1 . 2]"
1 77 VAL 0.796 0.109 9 0 "[ . 1 . 2]"
1 78 GLU 0.460 0.109 9 0 "[ . 1 . 2]"
1 79 GLY 0.141 0.080 14 0 "[ . 1 . 2]"
1 80 ASP 0.345 0.071 12 0 "[ . 1 . 2]"
1 81 GLU 0.424 0.082 5 0 "[ . 1 . 2]"
1 82 ASP 0.501 0.097 13 0 "[ . 1 . 2]"
1 83 GLU 0.463 0.097 13 0 "[ . 1 . 2]"
1 84 GLU 0.050 0.016 10 0 "[ . 1 . 2]"
1 85 ASP 0.050 0.016 10 0 "[ . 1 . 2]"
1 86 ILE 0.030 0.026 6 0 "[ . 1 . 2]"
1 87 ASP 0.026 0.026 6 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 66 THR HA 1 67 ARG H . . 2.960 2.298 2.189 2.400 . 0 0 "[ . 1 . 2]" 2
2 1 67 ARG H 1 67 ARG HG2 . . 3.160 2.169 1.961 2.453 . 0 0 "[ . 1 . 2]" 2
3 1 67 ARG H 1 67 ARG HB3 . . 3.790 2.590 2.493 2.669 . 0 0 "[ . 1 . 2]" 2
4 1 20 GLU H 1 20 GLU HB2 . . 3.320 2.315 2.289 2.354 . 0 0 "[ . 1 . 2]" 2
5 1 20 GLU H 1 20 GLU HB3 . . 3.580 3.554 3.533 3.600 0.020 2 0 "[ . 1 . 2]" 2
6 1 36 VAL HA 1 37 ALA H . . 3.160 2.301 2.212 2.362 . 0 0 "[ . 1 . 2]" 2
7 1 36 VAL MG1 1 37 ALA H . . 4.260 3.678 3.236 4.275 0.015 11 0 "[ . 1 . 2]" 2
8 1 36 VAL MG2 1 37 ALA H . . 4.260 4.039 3.245 4.288 0.028 18 0 "[ . 1 . 2]" 2
9 1 50 TYR HH 1 71 LEU H . . 3.880 3.649 3.104 3.931 0.051 9 0 "[ . 1 . 2]" 2
10 1 70 ARG HA 1 71 LEU H . . 3.150 2.157 2.140 2.264 . 0 0 "[ . 1 . 2]" 2
11 1 70 ARG QB 1 71 LEU H . . 4.080 3.710 2.820 3.924 . 0 0 "[ . 1 . 2]" 2
12 1 71 LEU H 1 71 LEU HG . . 3.130 2.734 2.054 3.029 . 0 0 "[ . 1 . 2]" 2
13 1 71 LEU H 1 71 LEU QB . . 3.050 2.472 2.354 2.735 . 0 0 "[ . 1 . 2]" 2
14 1 70 ARG HG3 1 71 LEU H . . 4.220 3.510 3.159 4.263 0.043 9 0 "[ . 1 . 2]" 2
15 1 25 GLN HG3 1 26 ILE H . . 3.840 3.614 3.455 3.846 0.006 14 0 "[ . 1 . 2]" 2
16 1 17 GLN QB 1 26 ILE H . . 4.540 4.065 3.940 4.204 . 0 0 "[ . 1 . 2]" 2
17 1 26 ILE H 1 26 ILE HG12 . . 3.630 3.306 3.183 3.457 . 0 0 "[ . 1 . 2]" 2
18 1 26 ILE H 1 26 ILE HB . . 3.220 2.566 2.504 2.623 . 0 0 "[ . 1 . 2]" 2
19 1 26 ILE H 1 26 ILE HG13 . . 3.780 2.044 1.968 2.157 . 0 0 "[ . 1 . 2]" 2
20 1 43 PHE H 1 43 PHE HB2 . . 3.500 2.585 2.414 2.679 . 0 0 "[ . 1 . 2]" 2
21 1 35 PHE H 1 36 VAL H . . 4.740 4.187 4.086 4.306 . 0 0 "[ . 1 . 2]" 2
22 1 35 PHE HA 1 36 VAL H . . 2.940 2.225 2.164 2.283 . 0 0 "[ . 1 . 2]" 2
23 1 36 VAL H 1 36 VAL HB . . 3.380 2.656 2.473 3.200 . 0 0 "[ . 1 . 2]" 2
24 1 29 THR MG 1 36 VAL H . . 3.690 3.406 3.004 3.699 0.009 10 0 "[ . 1 . 2]" 2
25 1 36 VAL H 1 36 VAL MG1 . . 4.010 3.303 1.845 3.788 . 0 0 "[ . 1 . 2]" 2
26 1 36 VAL H 1 36 VAL MG2 . . 4.010 2.791 2.332 3.790 . 0 0 "[ . 1 . 2]" 2
27 1 43 PHE H 1 43 PHE QD . . 4.370 4.193 4.111 4.216 . 0 0 "[ . 1 . 2]" 2
28 1 43 PHE H 1 43 PHE HB3 . . 3.510 2.559 2.434 2.797 . 0 0 "[ . 1 . 2]" 2
29 1 45 ALA H 1 45 ALA MB . . 3.480 2.614 2.476 2.849 . 0 0 "[ . 1 . 2]" 2
30 1 44 PRO HA 1 45 ALA H . . 3.090 2.190 2.151 2.265 . 0 0 "[ . 1 . 2]" 2
31 1 44 PRO HB3 1 45 ALA H . . 4.420 4.214 3.664 4.380 . 0 0 "[ . 1 . 2]" 2
32 1 39 ASN H 1 40 GLU H . . 3.910 2.040 1.896 2.831 . 0 0 "[ . 1 . 2]" 2
33 1 38 CYS HA 1 39 ASN H . . 3.330 2.215 2.140 2.315 . 0 0 "[ . 1 . 2]" 2
34 1 67 ARG HA 1 68 TYR H . . 3.070 2.162 2.142 2.186 . 0 0 "[ . 1 . 2]" 2
35 1 68 TYR H 1 68 TYR HB2 . . 3.890 2.183 2.139 2.327 . 0 0 "[ . 1 . 2]" 2
36 1 68 TYR H 1 68 TYR HB3 . . 3.890 3.465 3.433 3.505 . 0 0 "[ . 1 . 2]" 2
37 1 67 ARG HG3 1 68 TYR H . . 4.590 4.441 4.285 4.588 . 0 0 "[ . 1 . 2]" 2
38 1 50 TYR H 1 50 TYR HB3 . . 3.310 2.354 2.294 2.446 . 0 0 "[ . 1 . 2]" 2
39 1 49 CYS HB2 1 50 TYR H . . 3.760 2.908 2.837 3.007 . 0 0 "[ . 1 . 2]" 2
40 1 49 CYS HB3 1 50 TYR H . . 4.240 3.325 3.223 3.422 . 0 0 "[ . 1 . 2]" 2
41 1 50 TYR H 1 50 TYR HB2 . . 3.410 2.820 2.655 2.895 . 0 0 "[ . 1 . 2]" 2
42 1 45 ALA MB 1 50 TYR H . . 4.100 3.489 3.221 3.672 . 0 0 "[ . 1 . 2]" 2
43 1 28 LEU MD2 1 35 PHE H . . 4.070 3.606 3.374 3.781 . 0 0 "[ . 1 . 2]" 2
44 1 35 PHE H 1 35 PHE QD . . 4.560 4.187 4.160 4.214 . 0 0 "[ . 1 . 2]" 2
45 1 29 THR MG 1 35 PHE H . . 3.680 3.029 2.696 3.266 . 0 0 "[ . 1 . 2]" 2
46 1 34 LEU HG 1 35 PHE H . . 4.630 4.561 4.368 4.693 0.063 15 0 "[ . 1 . 2]" 2
47 1 69 LYS HA 1 70 ARG H . . 3.190 2.257 2.171 2.661 . 0 0 "[ . 1 . 2]" 2
48 1 70 ARG H 1 70 ARG QB . . 2.980 2.153 2.098 2.289 . 0 0 "[ . 1 . 2]" 2
49 1 69 LYS QG 1 70 ARG H . . 4.420 3.725 3.569 4.145 . 0 0 "[ . 1 . 2]" 2
50 1 19 CYS HB3 1 24 ASP H . . 4.690 3.732 3.654 3.791 . 0 0 "[ . 1 . 2]" 2
51 1 24 ASP H 1 24 ASP HB3 . . 3.720 3.414 3.040 3.624 . 0 0 "[ . 1 . 2]" 2
52 1 19 CYS H 1 26 ILE HG13 . . 4.230 1.931 1.886 2.045 . 0 0 "[ . 1 . 2]" 2
53 1 49 CYS H 1 50 TYR H . . 3.670 1.934 1.830 2.004 . 0 0 "[ . 1 . 2]" 2
54 1 48 PRO HD2 1 49 CYS H . . 4.660 3.315 3.203 3.430 . 0 0 "[ . 1 . 2]" 2
55 1 49 CYS H 1 49 CYS HB2 . . 3.240 2.457 2.385 2.543 . 0 0 "[ . 1 . 2]" 2
56 1 87 ASP H 1 87 ASP HB2 . . 4.090 3.018 2.358 3.867 . 0 0 "[ . 1 . 2]" 2
57 1 87 ASP H 1 87 ASP HB3 . . 4.090 3.148 2.508 3.792 . 0 0 "[ . 1 . 2]" 2
58 1 19 CYS HA 1 21 ILE H . . 4.240 4.186 4.069 4.251 0.011 7 0 "[ . 1 . 2]" 2
59 1 20 GLU H 1 21 ILE H . . 3.200 2.149 2.074 2.220 . 0 0 "[ . 1 . 2]" 2
60 1 20 GLU HB3 1 21 ILE H . . 4.310 3.384 3.298 3.526 . 0 0 "[ . 1 . 2]" 2
61 1 68 TYR HA 1 69 LYS H . . 3.050 2.558 2.371 2.658 . 0 0 "[ . 1 . 2]" 2
62 1 69 LYS H 1 69 LYS HB3 . . 3.310 3.203 3.092 3.336 0.026 7 0 "[ . 1 . 2]" 2
63 1 69 LYS H 1 69 LYS QD . . 3.190 2.195 1.872 3.328 0.138 7 0 "[ . 1 . 2]" 2
64 1 69 LYS H 1 69 LYS QG . . 3.380 3.039 1.960 3.407 0.027 17 0 "[ . 1 . 2]" 2
65 1 8 PRO HA 1 9 LYS H . . 3.370 2.472 2.150 3.465 0.095 1 0 "[ . 1 . 2]" 2
66 1 9 LYS H 1 9 LYS HB3 . . 4.200 3.407 2.278 3.894 . 0 0 "[ . 1 . 2]" 2
67 1 52 TYR H 1 53 GLU H . . 3.660 2.832 2.537 3.106 . 0 0 "[ . 1 . 2]" 2
68 1 51 GLU HB3 1 52 TYR H . . 3.880 3.189 2.919 3.628 . 0 0 "[ . 1 . 2]" 2
69 1 51 GLU H 1 52 TYR H . . 3.820 2.905 2.648 3.065 . 0 0 "[ . 1 . 2]" 2
70 1 52 TYR H 1 52 TYR QD . . 4.380 4.074 3.852 4.193 . 0 0 "[ . 1 . 2]" 2
71 1 49 CYS HA 1 52 TYR H . . 4.590 4.217 3.993 4.491 . 0 0 "[ . 1 . 2]" 2
72 1 52 TYR H 1 52 TYR HB3 . . 2.960 2.264 2.175 2.520 . 0 0 "[ . 1 . 2]" 2
73 1 51 GLU HB2 1 52 TYR H . . 4.020 2.465 2.193 2.816 . 0 0 "[ . 1 . 2]" 2
74 1 9 LYS H 1 9 LYS HB2 . . 4.200 2.779 2.226 3.730 . 0 0 "[ . 1 . 2]" 2
75 1 9 LYS H 1 9 LYS HG2 . . 5.500 3.170 1.876 4.843 . 0 0 "[ . 1 . 2]" 2
76 1 9 LYS H 1 9 LYS HG3 . . 5.500 3.657 2.656 4.635 . 0 0 "[ . 1 . 2]" 2
77 1 11 LEU H 1 11 LEU MD1 . . 5.500 4.076 3.605 4.545 . 0 0 "[ . 1 . 2]" 2
78 1 11 LEU H 1 11 LEU MD2 . . 5.500 4.223 3.291 4.505 . 0 0 "[ . 1 . 2]" 2
79 1 10 PRO HA 1 11 LEU H . . 3.080 2.316 2.152 2.615 . 0 0 "[ . 1 . 2]" 2
80 1 11 LEU H 1 11 LEU HB3 . . 3.060 2.757 2.453 3.034 . 0 0 "[ . 1 . 2]" 2
81 1 13 ASN HA 1 14 LEU H . . 3.150 2.355 2.140 2.760 . 0 0 "[ . 1 . 2]" 2
82 1 13 ASN HB3 1 14 LEU H . . 4.620 3.425 2.147 4.468 . 0 0 "[ . 1 . 2]" 2
83 1 11 LEU H 1 11 LEU HB2 . . 3.060 2.515 2.124 2.895 . 0 0 "[ . 1 . 2]" 2
84 1 61 CYS H 1 66 THR H . . 4.610 2.601 2.099 3.218 . 0 0 "[ . 1 . 2]" 2
85 1 60 ASN HA 1 61 CYS H . . 3.250 2.163 2.139 2.372 . 0 0 "[ . 1 . 2]" 2
86 1 61 CYS H 1 61 CYS HB3 . . 3.440 2.574 2.470 2.654 . 0 0 "[ . 1 . 2]" 2
87 1 60 ASN HB2 1 61 CYS H . . 4.230 4.013 3.283 4.214 . 0 0 "[ . 1 . 2]" 2
88 1 60 ASN HB3 1 61 CYS H . . 3.730 3.337 2.706 3.549 . 0 0 "[ . 1 . 2]" 2
89 1 81 GLU HB2 1 82 ASP H . . 4.430 4.252 3.889 4.438 0.008 15 0 "[ . 1 . 2]" 2
90 1 84 GLU H 1 84 GLU HB2 . . 3.990 2.909 2.245 3.888 . 0 0 "[ . 1 . 2]" 2
91 1 84 GLU HA 1 85 ASP H . . 3.520 2.519 2.140 3.535 0.015 14 0 "[ . 1 . 2]" 2
92 1 34 LEU H 1 34 LEU MD1 . . 4.260 4.183 4.091 4.300 0.040 11 0 "[ . 1 . 2]" 2
93 1 33 ASP HA 1 34 LEU H . . 3.230 2.386 2.253 2.597 . 0 0 "[ . 1 . 2]" 2
94 1 34 LEU H 1 34 LEU HB2 . . 3.090 2.350 2.220 2.480 . 0 0 "[ . 1 . 2]" 2
95 1 34 LEU H 1 34 LEU HB3 . . 3.090 2.692 2.584 2.876 . 0 0 "[ . 1 . 2]" 2
96 1 46 CYS H 1 49 CYS HB2 . . 3.960 2.759 2.644 2.932 . 0 0 "[ . 1 . 2]" 2
97 1 81 GLU H 1 82 ASP H . . 4.560 3.622 1.841 4.560 0.000 6 0 "[ . 1 . 2]" 2
98 1 81 GLU H 1 81 GLU HB2 . . 3.740 3.009 2.211 3.497 . 0 0 "[ . 1 . 2]" 2
99 1 81 GLU H 1 81 GLU HB3 . . 3.740 3.159 2.569 3.759 0.019 12 0 "[ . 1 . 2]" 2
100 1 81 GLU H 1 81 GLU HG2 . . 5.300 4.618 3.010 5.166 . 0 0 "[ . 1 . 2]" 2
101 1 81 GLU H 1 81 GLU HG3 . . 5.300 4.224 2.234 4.923 . 0 0 "[ . 1 . 2]" 2
102 1 75 PRO HA 1 76 ARG H . . 2.970 2.460 2.202 2.717 . 0 0 "[ . 1 . 2]" 2
103 1 75 PRO HB2 1 76 ARG H . . 3.380 2.505 1.914 3.230 . 0 0 "[ . 1 . 2]" 2
104 1 76 ARG H 1 76 ARG QB . . 2.970 2.236 2.154 2.299 . 0 0 "[ . 1 . 2]" 2
105 1 77 VAL HA 1 78 GLU H . . 3.260 2.585 2.457 2.652 . 0 0 "[ . 1 . 2]" 2
106 1 78 GLU H 1 78 GLU QG . . 3.100 2.690 2.201 3.111 0.011 6 0 "[ . 1 . 2]" 2
107 1 77 VAL HB 1 78 GLU H . . 3.170 2.018 1.897 2.260 . 0 0 "[ . 1 . 2]" 2
108 1 77 VAL MG1 1 78 GLU H . . 3.560 3.486 3.349 3.564 0.004 18 0 "[ . 1 . 2]" 2
109 1 77 VAL MG2 1 78 GLU H . . 3.430 3.152 2.892 3.394 . 0 0 "[ . 1 . 2]" 2
110 1 40 GLU H 1 42 GLY H . . 4.110 4.026 3.049 4.120 0.010 1 0 "[ . 1 . 2]" 2
111 1 39 ASN QB 1 40 GLU H . . 4.070 2.728 2.537 3.827 . 0 0 "[ . 1 . 2]" 2
112 1 40 GLU H 1 40 GLU HG2 . . 4.650 3.697 1.917 4.673 0.023 17 0 "[ . 1 . 2]" 2
113 1 40 GLU H 1 40 GLU HB2 . . 3.660 2.415 2.171 3.152 . 0 0 "[ . 1 . 2]" 2
114 1 40 GLU H 1 40 GLU HB3 . . 3.660 3.088 2.461 3.606 . 0 0 "[ . 1 . 2]" 2
115 1 82 ASP HB3 1 83 GLU H . . 4.140 3.007 2.179 3.946 . 0 0 "[ . 1 . 2]" 2
116 1 83 GLU H 1 83 GLU HB3 . . 3.770 2.923 2.448 3.757 . 0 0 "[ . 1 . 2]" 2
117 1 11 LEU HA 1 12 LYS H . . 3.330 2.297 2.140 2.887 . 0 0 "[ . 1 . 2]" 2
118 1 12 LYS H 1 12 LYS HG2 . . 5.320 3.905 1.943 4.987 . 0 0 "[ . 1 . 2]" 2
119 1 12 LYS H 1 12 LYS HG3 . . 5.320 3.896 3.273 4.630 . 0 0 "[ . 1 . 2]" 2
120 1 83 GLU H 1 83 GLU QG . . 4.160 3.597 1.910 4.224 0.064 2 0 "[ . 1 . 2]" 2
121 1 53 GLU H 1 53 GLU HG2 . . 4.680 4.590 4.294 4.653 . 0 0 "[ . 1 . 2]" 2
122 1 53 GLU H 1 53 GLU HB3 . . 3.560 2.726 2.299 2.985 . 0 0 "[ . 1 . 2]" 2
123 1 83 GLU H 1 83 GLU HB2 . . 3.770 2.980 2.259 3.805 0.035 20 0 "[ . 1 . 2]" 2
124 1 52 TYR HB3 1 53 GLU H . . 3.650 2.725 2.483 2.967 . 0 0 "[ . 1 . 2]" 2
125 1 53 GLU H 1 53 GLU HB2 . . 3.560 2.366 2.179 2.792 . 0 0 "[ . 1 . 2]" 2
126 1 50 TYR H 1 51 GLU H . . 3.640 2.506 2.356 2.686 . 0 0 "[ . 1 . 2]" 2
127 1 50 TYR HB3 1 51 GLU H . . 3.840 2.513 2.296 2.764 . 0 0 "[ . 1 . 2]" 2
128 1 51 GLU H 1 51 GLU HG2 . . 4.040 3.605 3.280 3.960 . 0 0 "[ . 1 . 2]" 2
129 1 51 GLU H 1 51 GLU HB3 . . 3.890 3.563 3.434 3.597 . 0 0 "[ . 1 . 2]" 2
130 1 51 GLU H 1 51 GLU HB2 . . 3.960 2.366 2.129 2.569 . 0 0 "[ . 1 . 2]" 2
131 1 85 ASP HA 1 86 ILE H . . 3.190 2.343 2.139 2.759 . 0 0 "[ . 1 . 2]" 2
132 1 86 ILE H 1 86 ILE HB . . 3.670 3.109 2.468 3.673 0.003 16 0 "[ . 1 . 2]" 2
133 1 86 ILE H 1 86 ILE HG12 . . 4.300 2.959 1.935 4.302 0.002 7 0 "[ . 1 . 2]" 2
134 1 86 ILE H 1 86 ILE HG13 . . 4.300 3.039 1.904 3.892 . 0 0 "[ . 1 . 2]" 2
135 1 85 ASP HB2 1 86 ILE H . . 4.810 4.135 2.457 4.607 . 0 0 "[ . 1 . 2]" 2
136 1 86 ILE H 1 86 ILE MG . . 4.270 3.059 1.851 3.913 . 0 0 "[ . 1 . 2]" 2
137 1 86 ILE H 1 86 ILE MD . . 4.620 3.400 1.932 4.159 . 0 0 "[ . 1 . 2]" 2
138 1 80 ASP H 1 80 ASP HB3 . . 3.720 2.842 2.220 3.688 . 0 0 "[ . 1 . 2]" 2
139 1 71 LEU HA 1 72 ARG H . . 3.060 2.616 2.415 2.668 . 0 0 "[ . 1 . 2]" 2
140 1 72 ARG H 1 72 ARG QB . . 2.900 2.377 2.152 2.589 . 0 0 "[ . 1 . 2]" 2
141 1 72 ARG H 1 72 ARG HG3 . . 3.800 3.249 2.310 3.934 0.134 18 0 "[ . 1 . 2]" 2
142 1 71 LEU QB 1 72 ARG H . . 3.330 2.001 1.895 2.354 . 0 0 "[ . 1 . 2]" 2
143 1 71 LEU MD2 1 72 ARG H . . 3.910 3.280 3.015 3.851 . 0 0 "[ . 1 . 2]" 2
144 1 24 ASP HA 1 25 GLN H . . 3.120 2.306 2.217 2.407 . 0 0 "[ . 1 . 2]" 2
145 1 25 GLN H 1 25 GLN HG2 . . 4.780 4.408 4.360 4.471 . 0 0 "[ . 1 . 2]" 2
146 1 25 GLN H 1 25 GLN HB2 . . 3.040 2.659 2.608 2.720 . 0 0 "[ . 1 . 2]" 2
147 1 25 GLN H 1 25 GLN HB3 . . 3.100 2.476 2.406 2.554 . 0 0 "[ . 1 . 2]" 2
148 1 65 LYS H 1 66 THR H . . 3.860 2.841 2.643 2.979 . 0 0 "[ . 1 . 2]" 2
149 1 65 LYS HA 1 66 THR H . . 3.210 2.680 2.620 2.835 . 0 0 "[ . 1 . 2]" 2
150 1 61 CYS HB3 1 66 THR H . . 3.810 2.117 1.944 2.255 . 0 0 "[ . 1 . 2]" 2
151 1 61 CYS HB2 1 66 THR H . . 4.440 3.033 2.812 3.329 . 0 0 "[ . 1 . 2]" 2
152 1 66 THR H 1 66 THR MG . . 4.060 3.809 3.710 3.848 . 0 0 "[ . 1 . 2]" 2
153 1 15 ASP H 1 15 ASP HB3 . . 3.740 3.240 2.311 3.614 . 0 0 "[ . 1 . 2]" 2
154 1 63 GLN H 1 64 CYS H . . 3.470 2.059 1.987 2.129 . 0 0 "[ . 1 . 2]" 2
155 1 63 GLN H 1 63 GLN HB2 . . 3.630 3.150 3.097 3.205 . 0 0 "[ . 1 . 2]" 2
156 1 62 PRO HG3 1 63 GLN H . . 5.130 4.654 4.617 4.691 . 0 0 "[ . 1 . 2]" 2
157 1 63 GLN H 1 63 GLN HB3 . . 3.630 2.491 2.452 2.530 . 0 0 "[ . 1 . 2]" 2
158 1 62 PRO HD2 1 63 GLN H . . 4.500 3.062 3.027 3.099 . 0 0 "[ . 1 . 2]" 2
159 1 22 CYS H 1 24 ASP H . . 4.620 4.546 4.448 4.615 . 0 0 "[ . 1 . 2]" 2
160 1 40 GLU H 1 41 CYS H . . 3.160 3.038 2.384 3.145 . 0 0 "[ . 1 . 2]" 2
161 1 41 CYS H 1 42 GLY H . . 3.020 2.203 2.039 2.391 . 0 0 "[ . 1 . 2]" 2
162 1 41 CYS H 1 41 CYS HB3 . . 3.770 2.573 2.401 2.825 . 0 0 "[ . 1 . 2]" 2
163 1 41 CYS H 1 41 CYS HB2 . . 3.700 3.675 3.606 3.718 0.018 14 0 "[ . 1 . 2]" 2
164 1 40 GLU HG2 1 41 CYS H . . 4.620 4.321 3.626 4.622 0.002 2 0 "[ . 1 . 2]" 2
165 1 40 GLU HB2 1 41 CYS H . . 3.690 3.055 2.106 3.696 0.006 18 0 "[ . 1 . 2]" 2
166 1 40 GLU HB3 1 41 CYS H . . 3.690 2.528 2.056 3.397 . 0 0 "[ . 1 . 2]" 2
167 1 22 CYS H 1 22 CYS HB2 . . 3.680 3.684 3.663 3.710 0.030 2 0 "[ . 1 . 2]" 2
168 1 21 ILE H 1 22 CYS H . . 3.340 3.088 3.003 3.141 . 0 0 "[ . 1 . 2]" 2
169 1 22 CYS H 1 23 GLY H . . 3.110 2.243 2.159 2.310 . 0 0 "[ . 1 . 2]" 2
170 1 21 ILE HB 1 22 CYS H . . 3.160 2.140 2.082 2.220 . 0 0 "[ . 1 . 2]" 2
171 1 22 CYS H 1 22 CYS HB3 . . 3.400 2.798 2.735 2.883 . 0 0 "[ . 1 . 2]" 2
172 1 46 CYS HB2 1 47 ARG H . . 3.870 2.019 1.946 2.161 . 0 0 "[ . 1 . 2]" 2
173 1 46 CYS HB3 1 47 ARG H . . 4.060 3.528 3.479 3.624 . 0 0 "[ . 1 . 2]" 2
174 1 47 ARG H 1 47 ARG HB2 . . 3.920 2.213 2.148 2.694 . 0 0 "[ . 1 . 2]" 2
175 1 47 ARG H 1 47 ARG HB3 . . 3.920 2.943 2.383 3.466 . 0 0 "[ . 1 . 2]" 2
176 1 54 ARG HB2 1 55 ARG H . . 3.920 3.036 2.748 3.371 . 0 0 "[ . 1 . 2]" 2
177 1 74 SER H 1 74 SER HG . . 5.280 3.674 2.594 4.995 . 0 0 "[ . 1 . 2]" 2
178 1 55 ARG H 1 55 ARG HB2 . . 3.330 2.492 2.214 3.002 . 0 0 "[ . 1 . 2]" 2
179 1 55 ARG H 1 55 ARG HB3 . . 3.290 2.612 2.229 2.897 . 0 0 "[ . 1 . 2]" 2
180 1 55 ARG H 1 55 ARG HG3 . . 4.620 4.542 4.105 4.651 0.031 14 0 "[ . 1 . 2]" 2
181 1 74 SER H 1 74 SER HB2 . . 3.750 3.197 2.233 3.817 0.067 11 0 "[ . 1 . 2]" 2
182 1 74 SER H 1 74 SER HB3 . . 3.750 2.721 2.200 3.651 . 0 0 "[ . 1 . 2]" 2
183 1 29 THR H 1 33 ASP H . . 4.180 3.747 2.388 4.154 . 0 0 "[ . 1 . 2]" 2
184 1 18 PHE H 1 18 PHE QD . . 3.680 2.007 1.955 2.053 . 0 0 "[ . 1 . 2]" 2
185 1 17 GLN HA 1 18 PHE H . . 3.510 3.484 3.434 3.510 . 0 0 "[ . 1 . 2]" 2
186 1 18 PHE H 1 18 PHE HB2 . . 3.400 2.564 2.511 2.627 . 0 0 "[ . 1 . 2]" 2
187 1 30 VAL H 1 31 GLU H . . 4.400 2.830 2.608 2.980 . 0 0 "[ . 1 . 2]" 2
188 1 29 THR HA 1 30 VAL H . . 3.430 2.502 2.410 2.651 . 0 0 "[ . 1 . 2]" 2
189 1 30 VAL H 1 30 VAL HB . . 3.830 2.607 2.436 2.761 . 0 0 "[ . 1 . 2]" 2
190 1 29 THR MG 1 30 VAL H . . 4.170 3.692 3.543 3.882 . 0 0 "[ . 1 . 2]" 2
191 1 76 ARG HG3 1 77 VAL H . . 3.750 2.900 1.882 3.734 . 0 0 "[ . 1 . 2]" 2
192 1 37 ALA H 1 38 CYS H . . 3.910 3.072 2.712 3.353 . 0 0 "[ . 1 . 2]" 2
193 1 38 CYS H 1 38 CYS QB . . 3.520 2.484 2.322 2.600 . 0 0 "[ . 1 . 2]" 2
194 1 28 LEU H 1 28 LEU HB2 . . 3.100 2.567 2.490 2.678 . 0 0 "[ . 1 . 2]" 2
195 1 28 LEU H 1 28 LEU HG . . 2.920 2.840 2.730 2.928 0.008 5 0 "[ . 1 . 2]" 2
196 1 28 LEU H 1 28 LEU HB3 . . 3.820 3.723 3.680 3.779 . 0 0 "[ . 1 . 2]" 2
197 1 28 LEU H 1 28 LEU MD1 . . 3.960 3.928 3.858 3.969 0.009 10 0 "[ . 1 . 2]" 2
198 1 28 LEU H 1 28 LEU MD2 . . 3.910 3.749 3.608 3.863 . 0 0 "[ . 1 . 2]" 2
199 1 17 GLN H 1 18 PHE H . . 3.010 2.918 2.791 2.970 . 0 0 "[ . 1 . 2]" 2
200 1 17 GLN H 1 17 GLN HG2 . . 3.920 3.050 2.026 3.791 . 0 0 "[ . 1 . 2]" 2
201 1 17 GLN H 1 17 GLN HG3 . . 3.920 2.659 2.025 3.880 . 0 0 "[ . 1 . 2]" 2
202 1 17 GLN H 1 17 GLN QB . . 3.320 2.511 2.328 2.655 . 0 0 "[ . 1 . 2]" 2
203 1 63 GLN HG2 1 64 CYS H . . 3.720 3.520 3.390 3.611 . 0 0 "[ . 1 . 2]" 2
204 1 64 CYS H 1 65 LYS H . . 3.200 1.853 1.788 1.884 . 0 0 "[ . 1 . 2]" 2
205 1 64 CYS H 1 65 LYS HA . . 4.440 4.097 4.034 4.133 . 0 0 "[ . 1 . 2]" 2
206 1 63 GLN HB2 1 64 CYS H . . 4.020 3.950 3.891 4.000 . 0 0 "[ . 1 . 2]" 2
207 1 63 GLN HG3 1 64 CYS H . . 4.230 4.178 4.099 4.234 0.004 14 0 "[ . 1 . 2]" 2
208 1 63 GLN HB3 1 64 CYS H . . 4.020 2.609 2.520 2.686 . 0 0 "[ . 1 . 2]" 2
209 1 59 GLN H 1 60 ASN H . . 3.810 2.675 2.466 2.901 . 0 0 "[ . 1 . 2]" 2
210 1 58 THR HB 1 60 ASN H . . 4.640 4.377 4.033 4.598 . 0 0 "[ . 1 . 2]" 2
211 1 53 GLU HG3 1 60 ASN H . . 3.540 2.715 2.429 3.169 . 0 0 "[ . 1 . 2]" 2
212 1 60 ASN H 1 60 ASN HB3 . . 4.190 3.917 3.840 4.007 . 0 0 "[ . 1 . 2]" 2
213 1 31 GLU H 1 32 GLY H . . 2.840 2.544 2.346 2.743 . 0 0 "[ . 1 . 2]" 2
214 1 31 GLU H 1 33 ASP H . . 4.570 4.213 4.019 4.377 . 0 0 "[ . 1 . 2]" 2
215 1 29 THR HG1 1 31 GLU H . . 4.380 2.781 1.894 3.793 . 0 0 "[ . 1 . 2]" 2
216 1 31 GLU H 1 31 GLU HB2 . . 3.870 2.387 2.207 3.602 . 0 0 "[ . 1 . 2]" 2
217 1 31 GLU H 1 31 GLU HG3 . . 4.430 3.467 2.318 4.457 0.027 19 0 "[ . 1 . 2]" 2
218 1 31 GLU H 1 31 GLU HB3 . . 3.870 3.471 2.382 3.642 . 0 0 "[ . 1 . 2]" 2
219 1 30 VAL MG1 1 31 GLU H . . 4.610 3.305 1.878 3.739 . 0 0 "[ . 1 . 2]" 2
220 1 30 VAL MG2 1 31 GLU H . . 4.610 3.843 3.631 4.058 . 0 0 "[ . 1 . 2]" 2
221 1 54 ARG H 1 55 ARG H . . 3.640 2.276 2.159 2.456 . 0 0 "[ . 1 . 2]" 2
222 1 51 GLU HA 1 54 ARG H . . 4.270 3.659 3.490 3.857 . 0 0 "[ . 1 . 2]" 2
223 1 53 GLU HB2 1 54 ARG H . . 4.350 3.876 3.548 4.221 . 0 0 "[ . 1 . 2]" 2
224 1 54 ARG H 1 54 ARG HB3 . . 3.550 3.501 3.432 3.598 0.048 19 0 "[ . 1 . 2]" 2
225 1 54 ARG H 1 54 ARG HB2 . . 3.220 2.230 2.140 2.348 . 0 0 "[ . 1 . 2]" 2
226 1 54 ARG H 1 54 ARG HG3 . . 3.460 3.192 2.868 3.370 . 0 0 "[ . 1 . 2]" 2
227 1 53 GLU H 1 54 ARG H . . 3.810 2.815 2.619 2.935 . 0 0 "[ . 1 . 2]" 2
228 1 65 LYS H 1 65 LYS HD2 . . 4.640 3.750 2.265 4.738 0.098 16 0 "[ . 1 . 2]" 2
229 1 65 LYS H 1 65 LYS HD3 . . 4.640 3.617 2.385 4.265 . 0 0 "[ . 1 . 2]" 2
230 1 65 LYS H 1 65 LYS HG3 . . 4.790 3.742 3.187 4.320 . 0 0 "[ . 1 . 2]" 2
231 1 63 GLN H 1 65 LYS H . . 3.880 2.795 2.689 2.951 . 0 0 "[ . 1 . 2]" 2
232 1 61 CYS HB3 1 65 LYS H . . 3.870 1.932 1.884 2.075 . 0 0 "[ . 1 . 2]" 2
233 1 53 GLU HA 1 58 THR H . . 3.840 3.724 3.380 3.897 0.057 15 0 "[ . 1 . 2]" 2
234 1 57 GLY HA3 1 58 THR H . . 3.320 2.318 2.221 2.427 . 0 0 "[ . 1 . 2]" 2
235 1 55 ARG HB2 1 56 GLU H . . 3.810 3.482 3.249 3.809 . 0 0 "[ . 1 . 2]" 2
236 1 55 ARG HB3 1 56 GLU H . . 3.650 2.058 1.890 2.376 . 0 0 "[ . 1 . 2]" 2
237 1 26 ILE MD 1 27 GLY H . . 5.500 5.306 5.214 5.482 . 0 0 "[ . 1 . 2]" 2
238 1 21 ILE H 1 23 GLY H . . 4.380 4.251 4.107 4.351 . 0 0 "[ . 1 . 2]" 2
239 1 23 GLY H 1 24 ASP H . . 3.620 2.714 2.629 2.824 . 0 0 "[ . 1 . 2]" 2
240 1 19 CYS HB3 1 23 GLY H . . 3.780 2.698 2.593 2.769 . 0 0 "[ . 1 . 2]" 2
241 1 79 GLY H 1 80 ASP H . . 3.650 2.267 1.750 2.993 . 0 0 "[ . 1 . 2]" 2
242 1 78 GLU HA 1 79 GLY H . . 3.230 2.452 2.143 2.798 . 0 0 "[ . 1 . 2]" 2
243 1 28 LEU HB3 1 29 THR H . . 3.640 2.348 2.205 2.603 . 0 0 "[ . 1 . 2]" 2
244 1 42 GLY H 1 43 PHE H . . 3.970 2.222 2.018 2.782 . 0 0 "[ . 1 . 2]" 2
245 1 38 CYS QB 1 42 GLY H . . 3.750 2.998 2.750 3.312 . 0 0 "[ . 1 . 2]" 2
246 1 57 GLY H 1 58 THR H . . 4.540 4.377 4.211 4.509 . 0 0 "[ . 1 . 2]" 2
247 1 56 GLU H 1 57 GLY H . . 3.230 2.007 1.785 2.486 . 0 0 "[ . 1 . 2]" 2
248 1 53 GLU HA 1 57 GLY H . . 3.580 3.040 2.778 3.494 . 0 0 "[ . 1 . 2]" 2
249 1 56 GLU QG 1 57 GLY H . . 4.660 4.440 4.307 4.672 0.012 13 0 "[ . 1 . 2]" 2
250 1 16 GLY H 1 16 GLY HA2 . . 2.890 2.558 2.405 2.674 . 0 0 "[ . 1 . 2]" 2
251 1 15 ASP HB2 1 16 GLY H . . 4.290 2.898 2.220 4.038 . 0 0 "[ . 1 . 2]" 2
252 1 53 GLU HG2 1 59 GLN H . . 4.080 3.947 3.375 4.086 0.006 18 0 "[ . 1 . 2]" 2
253 1 59 GLN H 1 59 GLN HG3 . . 3.270 2.619 2.394 2.825 . 0 0 "[ . 1 . 2]" 2
254 1 58 THR H 1 59 GLN H . . 3.720 2.257 2.017 2.677 . 0 0 "[ . 1 . 2]" 2
255 1 57 GLY HA3 1 59 GLN H . . 4.330 3.170 3.088 3.278 . 0 0 "[ . 1 . 2]" 2
256 1 59 GLN H 1 59 GLN HG2 . . 4.010 3.762 3.540 3.931 . 0 0 "[ . 1 . 2]" 2
257 1 32 GLY H 1 33 ASP H . . 3.430 2.044 1.802 2.411 . 0 0 "[ . 1 . 2]" 2
258 1 71 LEU H 1 71 LEU MD2 . . 4.490 3.554 2.963 3.880 . 0 0 "[ . 1 . 2]" 2
259 1 71 LEU H 1 74 SER HG . . 4.360 2.674 1.899 3.946 . 0 0 "[ . 1 . 2]" 2
260 1 71 LEU H 1 72 ARG H . . 5.000 4.460 4.381 4.534 . 0 0 "[ . 1 . 2]" 2
261 1 18 PHE HB3 1 26 ILE H . . 5.500 4.343 4.230 4.466 . 0 0 "[ . 1 . 2]" 2
262 1 19 CYS HB2 1 26 ILE H . . 5.500 3.898 3.747 4.119 . 0 0 "[ . 1 . 2]" 2
263 1 26 ILE H 1 27 GLY H . . 4.470 4.420 4.254 4.486 0.016 5 0 "[ . 1 . 2]" 2
264 1 18 PHE QD 1 26 ILE H . . 5.050 4.263 4.184 4.373 . 0 0 "[ . 1 . 2]" 2
265 1 19 CYS H 1 26 ILE H . . 5.200 2.276 2.174 2.419 . 0 0 "[ . 1 . 2]" 2
266 1 41 CYS H 1 43 PHE H . . 4.230 3.980 3.732 4.182 . 0 0 "[ . 1 . 2]" 2
267 1 18 PHE QD 1 19 CYS H . . 4.600 4.385 4.312 4.493 . 0 0 "[ . 1 . 2]" 2
268 1 49 CYS H 1 50 TYR HB3 . . 4.950 4.007 3.936 4.099 . 0 0 "[ . 1 . 2]" 2
269 1 68 TYR HB3 1 69 LYS H . . 4.580 2.173 1.962 2.612 . 0 0 "[ . 1 . 2]" 2
270 1 46 CYS H 1 48 PRO HD2 . . 5.410 4.754 4.715 4.797 . 0 0 "[ . 1 . 2]" 2
271 1 20 GLU H 1 46 CYS H . . 4.720 4.549 4.412 4.652 . 0 0 "[ . 1 . 2]" 2
272 1 35 PHE QD 1 47 ARG H . . 4.990 3.847 3.286 4.482 . 0 0 "[ . 1 . 2]" 2
273 1 35 PHE QE 1 47 ARG H . . 5.360 4.082 3.526 4.799 . 0 0 "[ . 1 . 2]" 2
274 1 26 ILE MD 1 47 ARG H . . 5.350 5.283 5.191 5.362 0.012 9 0 "[ . 1 . 2]" 2
275 1 17 GLN HG3 1 18 PHE H . . 5.500 4.735 4.358 5.340 . 0 0 "[ . 1 . 2]" 2
276 1 18 PHE H 1 26 ILE HG13 . . 5.290 4.991 4.787 5.166 . 0 0 "[ . 1 . 2]" 2
277 1 18 PHE H 1 19 CYS H . . 5.000 4.513 4.466 4.550 . 0 0 "[ . 1 . 2]" 2
278 1 28 LEU H 1 29 THR H . . 4.760 4.500 4.463 4.539 . 0 0 "[ . 1 . 2]" 2
279 1 53 GLU HG2 1 60 ASN H . . 4.350 3.211 2.836 3.605 . 0 0 "[ . 1 . 2]" 2
280 1 58 THR MG 1 60 ASN H . . 4.970 4.710 4.572 4.876 . 0 0 "[ . 1 . 2]" 2
281 1 60 ASN H 1 61 CYS H . . 5.050 4.211 4.082 4.385 . 0 0 "[ . 1 . 2]" 2
282 1 31 GLU H 1 31 GLU HG2 . . 4.430 3.315 2.368 4.232 . 0 0 "[ . 1 . 2]" 2
283 1 29 THR MG 1 31 GLU H . . 5.100 4.349 4.197 4.458 . 0 0 "[ . 1 . 2]" 2
284 1 64 CYS HB2 1 65 LYS H . . 4.860 4.120 3.987 4.229 . 0 0 "[ . 1 . 2]" 2
285 1 61 CYS HB2 1 65 LYS H . . 4.000 3.641 3.581 3.789 . 0 0 "[ . 1 . 2]" 2
286 1 59 GLN HE22 1 77 VAL HB . . 4.570 3.943 3.375 4.489 . 0 0 "[ . 1 . 2]" 2
287 1 16 GLY H 1 17 GLN H . . 3.490 2.578 2.102 2.983 . 0 0 "[ . 1 . 2]" 2
288 1 19 CYS H 1 46 CYS HB3 . . 4.340 4.118 3.949 4.229 . 0 0 "[ . 1 . 2]" 2
289 1 21 ILE H 1 45 ALA HA . . 5.480 3.771 3.689 3.883 . 0 0 "[ . 1 . 2]" 2
290 1 19 CYS HB3 1 21 ILE H . . 5.500 4.702 4.507 4.836 . 0 0 "[ . 1 . 2]" 2
291 1 19 CYS HB3 1 22 CYS H . . 4.270 3.825 3.713 3.922 . 0 0 "[ . 1 . 2]" 2
292 1 24 ASP H 1 25 GLN H . . 5.110 4.634 4.604 4.650 . 0 0 "[ . 1 . 2]" 2
293 1 18 PHE QE 1 25 GLN H . . 4.940 4.824 4.676 4.927 . 0 0 "[ . 1 . 2]" 2
294 1 18 PHE QD 1 25 GLN H . . 4.250 3.628 3.499 3.747 . 0 0 "[ . 1 . 2]" 2
295 1 25 GLN H 1 26 ILE H . . 4.770 4.428 4.393 4.481 . 0 0 "[ . 1 . 2]" 2
296 1 26 ILE HB 1 27 GLY H . . 4.680 4.350 4.284 4.445 . 0 0 "[ . 1 . 2]" 2
297 1 27 GLY H 1 46 CYS HA . . 4.880 4.406 4.249 4.706 . 0 0 "[ . 1 . 2]" 2
298 1 29 THR H 1 34 LEU HA . . 4.650 3.814 3.619 4.167 . 0 0 "[ . 1 . 2]" 2
299 1 29 THR H 1 35 PHE HA . . 4.920 4.437 4.126 4.687 . 0 0 "[ . 1 . 2]" 2
300 1 29 THR H 1 33 ASP HB2 . . 5.500 4.446 4.106 5.443 . 0 0 "[ . 1 . 2]" 2
301 1 29 THR H 1 35 PHE HB3 . . 5.500 5.247 4.665 5.507 0.007 2 0 "[ . 1 . 2]" 2
302 1 28 LEU MD1 1 29 THR H . . 4.650 4.354 4.215 4.553 . 0 0 "[ . 1 . 2]" 2
303 1 29 THR HA 1 31 GLU H . . 4.570 4.365 4.176 4.576 0.006 2 0 "[ . 1 . 2]" 2
304 1 29 THR H 1 32 GLY H . . 4.350 3.411 3.137 3.640 . 0 0 "[ . 1 . 2]" 2
305 1 28 LEU HB3 1 32 GLY H . . 4.800 3.963 3.787 4.087 . 0 0 "[ . 1 . 2]" 2
306 1 28 LEU MD1 1 32 GLY H . . 5.030 4.908 4.751 5.032 0.002 18 0 "[ . 1 . 2]" 2
307 1 29 THR HG1 1 33 ASP H . . 4.620 2.814 2.107 3.280 . 0 0 "[ . 1 . 2]" 2
308 1 33 ASP H 1 34 LEU H . . 4.930 4.611 4.426 4.647 . 0 0 "[ . 1 . 2]" 2
309 1 29 THR H 1 35 PHE H . . 4.850 3.796 3.489 4.203 . 0 0 "[ . 1 . 2]" 2
310 1 34 LEU MD1 1 35 PHE H . . 3.720 2.257 2.018 2.550 . 0 0 "[ . 1 . 2]" 2
311 1 35 PHE HB2 1 36 VAL H . . 4.550 4.533 4.468 4.580 0.030 13 0 "[ . 1 . 2]" 2
312 1 35 PHE HB3 1 36 VAL H . . 4.860 4.452 4.388 4.490 . 0 0 "[ . 1 . 2]" 2
313 1 36 VAL H 1 37 ALA H . . 4.650 3.960 3.771 4.143 . 0 0 "[ . 1 . 2]" 2
314 1 36 VAL HA 1 38 CYS H . . 4.680 4.045 3.642 4.382 . 0 0 "[ . 1 . 2]" 2
315 1 38 CYS H 1 42 GLY HA2 . . 5.260 4.741 4.199 5.276 0.016 10 0 "[ . 1 . 2]" 2
316 1 38 CYS H 1 39 ASN H . . 4.520 4.450 4.347 4.519 . 0 0 "[ . 1 . 2]" 2
317 1 38 CYS H 1 42 GLY H . . 5.500 5.230 5.047 5.470 . 0 0 "[ . 1 . 2]" 2
318 1 38 CYS QB 1 39 ASN H . . 4.640 3.567 3.419 3.840 . 0 0 "[ . 1 . 2]" 2
319 1 38 CYS HA 1 40 GLU H . . 4.100 3.984 3.730 4.113 0.013 15 0 "[ . 1 . 2]" 2
320 1 38 CYS QB 1 40 GLU H . . 4.720 4.518 3.732 4.666 . 0 0 "[ . 1 . 2]" 2
321 1 22 CYS H 1 23 GLY HA2 . . 4.530 4.453 4.383 4.508 . 0 0 "[ . 1 . 2]" 2
322 1 46 CYS H 1 46 CYS HB2 . . 3.810 3.590 3.589 3.592 . 0 0 "[ . 1 . 2]" 2
323 1 46 CYS H 1 49 CYS H . . 4.900 4.703 4.564 4.880 . 0 0 "[ . 1 . 2]" 2
324 1 45 ALA H 1 46 CYS H . . 5.500 4.066 3.911 4.160 . 0 0 "[ . 1 . 2]" 2
325 1 46 CYS H 1 47 ARG H . . 5.360 4.563 4.540 4.591 . 0 0 "[ . 1 . 2]" 2
326 1 46 CYS H 1 50 TYR H . . 5.060 4.921 4.757 5.056 . 0 0 "[ . 1 . 2]" 2
327 1 35 PHE HB3 1 47 ARG H . . 4.870 4.861 4.581 4.894 0.024 4 0 "[ . 1 . 2]" 2
328 1 48 PRO HD3 1 49 CYS H . . 4.930 4.197 4.136 4.260 . 0 0 "[ . 1 . 2]" 2
329 1 49 CYS H 1 51 GLU H . . 5.360 3.415 3.152 3.696 . 0 0 "[ . 1 . 2]" 2
330 1 48 PRO HA 1 51 GLU H . . 4.760 4.401 4.196 4.684 . 0 0 "[ . 1 . 2]" 2
331 1 51 GLU H 1 52 TYR HB3 . . 5.410 4.756 4.621 4.893 . 0 0 "[ . 1 . 2]" 2
332 1 50 TYR HB2 1 51 GLU H . . 4.250 3.891 3.737 4.039 . 0 0 "[ . 1 . 2]" 2
333 1 52 TYR H 1 54 ARG H . . 5.300 4.222 3.907 4.571 . 0 0 "[ . 1 . 2]" 2
334 1 53 GLU H 1 55 ARG H . . 4.360 4.059 3.802 4.348 . 0 0 "[ . 1 . 2]" 2
335 1 54 ARG H 1 55 ARG HA . . 5.500 4.929 4.849 5.077 . 0 0 "[ . 1 . 2]" 2
336 1 54 ARG H 1 77 VAL MG2 . . 5.500 5.282 4.923 5.511 0.011 3 0 "[ . 1 . 2]" 2
337 1 54 ARG H 1 77 VAL MG1 . . 5.130 4.802 4.513 5.010 . 0 0 "[ . 1 . 2]" 2
338 1 52 TYR HB2 1 55 ARG H . . 5.500 5.192 5.038 5.414 . 0 0 "[ . 1 . 2]" 2
339 1 55 ARG H 1 55 ARG HD3 . . 5.500 4.979 4.435 5.596 0.096 17 0 "[ . 1 . 2]" 2
340 1 55 ARG H 1 56 GLU H . . 3.490 2.895 2.618 3.171 . 0 0 "[ . 1 . 2]" 2
341 1 53 GLU HA 1 56 GLU H . . 4.930 4.506 4.222 4.836 . 0 0 "[ . 1 . 2]" 2
342 1 56 GLU H 1 57 GLY HA3 . . 4.440 4.259 4.050 4.493 0.053 13 0 "[ . 1 . 2]" 2
343 1 55 ARG HG3 1 56 GLU H . . 4.820 4.266 2.088 4.613 . 0 0 "[ . 1 . 2]" 2
344 1 55 ARG HB3 1 57 GLY H . . 4.860 3.862 3.611 4.099 . 0 0 "[ . 1 . 2]" 2
345 1 57 GLY H 1 59 GLN H . . 5.440 4.581 4.319 4.708 . 0 0 "[ . 1 . 2]" 2
346 1 55 ARG H 1 57 GLY H . . 4.240 3.538 3.169 3.801 . 0 0 "[ . 1 . 2]" 2
347 1 58 THR H 1 60 ASN H . . 4.910 3.444 3.159 3.903 . 0 0 "[ . 1 . 2]" 2
348 1 53 GLU HG3 1 58 THR H . . 4.200 3.012 2.632 3.387 . 0 0 "[ . 1 . 2]" 2
349 1 58 THR MG 1 59 GLN H . . 4.490 4.163 3.922 4.293 . 0 0 "[ . 1 . 2]" 2
350 1 57 GLY HA2 1 59 GLN H . . 5.220 4.395 4.277 4.545 . 0 0 "[ . 1 . 2]" 2
351 1 61 CYS H 1 63 GLN H . . 5.500 4.991 4.829 5.082 . 0 0 "[ . 1 . 2]" 2
352 1 61 CYS H 1 65 LYS HA . . 3.610 2.540 2.148 2.887 . 0 0 "[ . 1 . 2]" 2
353 1 43 PHE QD 1 63 GLN H . . 4.300 4.254 4.040 4.331 0.031 4 0 "[ . 1 . 2]" 2
354 1 64 CYS H 1 66 THR H . . 4.810 4.013 3.895 4.158 . 0 0 "[ . 1 . 2]" 2
355 1 43 PHE QD 1 64 CYS H . . 5.500 5.228 4.975 5.404 . 0 0 "[ . 1 . 2]" 2
356 1 61 CYS H 1 64 CYS H . . 5.500 4.870 4.683 5.021 . 0 0 "[ . 1 . 2]" 2
357 1 61 CYS HB2 1 64 CYS H . . 4.690 3.902 3.826 3.983 . 0 0 "[ . 1 . 2]" 2
358 1 61 CYS H 1 65 LYS H . . 3.750 3.600 3.287 3.778 0.028 11 0 "[ . 1 . 2]" 2
359 1 60 ASN HB3 1 66 THR H . . 5.410 4.348 4.019 4.648 . 0 0 "[ . 1 . 2]" 2
360 1 66 THR H 1 67 ARG H . . 4.680 4.546 4.479 4.582 . 0 0 "[ . 1 . 2]" 2
361 1 61 CYS H 1 68 TYR H . . 5.500 5.430 5.296 5.518 0.018 7 0 "[ . 1 . 2]" 2
362 1 68 TYR QE 1 69 LYS H . . 5.410 5.216 4.840 5.432 0.022 6 0 "[ . 1 . 2]" 2
363 1 70 ARG H 1 70 ARG HG3 . . 4.860 4.047 2.719 4.416 . 0 0 "[ . 1 . 2]" 2
364 1 70 ARG H 1 70 ARG HG2 . . 4.860 4.580 4.043 4.642 . 0 0 "[ . 1 . 2]" 2
365 1 71 LEU MD1 1 72 ARG H . . 4.850 3.967 3.806 4.236 . 0 0 "[ . 1 . 2]" 2
366 1 72 ARG H 1 72 ARG QD . . 4.800 3.681 1.844 4.391 . 0 0 "[ . 1 . 2]" 2
367 1 77 VAL H 1 80 ASP HB3 . . 4.630 4.264 2.986 4.645 0.015 9 0 "[ . 1 . 2]" 2
368 1 77 VAL H 1 80 ASP HB2 . . 4.630 3.664 2.691 4.614 . 0 0 "[ . 1 . 2]" 2
369 1 77 VAL H 1 80 ASP H . . 5.320 4.315 3.340 5.248 . 0 0 "[ . 1 . 2]" 2
370 1 77 VAL H 1 78 GLU H . . 4.620 4.397 4.364 4.438 . 0 0 "[ . 1 . 2]" 2
371 1 78 GLU H 1 80 ASP H . . 5.500 4.890 3.561 5.493 . 0 0 "[ . 1 . 2]" 2
372 1 78 GLU H 1 79 GLY H . . 4.540 3.810 2.797 4.620 0.080 14 0 "[ . 1 . 2]" 2
373 1 77 VAL MG2 1 80 ASP H . . 5.330 4.198 2.485 5.372 0.042 3 0 "[ . 1 . 2]" 2
374 1 80 ASP H 1 81 GLU H . . 4.700 3.826 2.414 4.651 . 0 0 "[ . 1 . 2]" 2
375 1 86 ILE H 1 87 ASP H . . 4.610 4.085 2.101 4.636 0.026 6 0 "[ . 1 . 2]" 2
376 1 86 ILE MD 1 87 ASP H . . 5.500 4.145 2.658 5.297 . 0 0 "[ . 1 . 2]" 2
377 1 52 TYR QD 1 55 ARG H . . 4.890 4.625 3.811 4.933 0.043 6 0 "[ . 1 . 2]" 2
378 1 76 ARG H 1 76 ARG QD . . 4.900 4.334 3.741 4.740 . 0 0 "[ . 1 . 2]" 2
379 1 16 GLY H 1 17 GLN QB . . 4.800 3.987 3.749 4.376 . 0 0 "[ . 1 . 2]" 2
380 1 14 LEU HA 1 16 GLY H . . 4.540 3.867 3.453 4.528 . 0 0 "[ . 1 . 2]" 2
381 1 8 PRO QD 1 9 LYS H . . 5.500 4.613 2.961 5.007 . 0 0 "[ . 1 . 2]" 2
382 1 9 LYS H 1 10 PRO HD3 . . 5.500 4.827 4.322 5.065 . 0 0 "[ . 1 . 2]" 2
383 1 12 LYS HG2 1 13 ASN H . . 5.500 4.525 3.448 5.150 . 0 0 "[ . 1 . 2]" 2
384 1 12 LYS HG3 1 13 ASN H . . 5.500 3.967 2.203 5.503 0.003 1 0 "[ . 1 . 2]" 2
385 1 14 LEU H 1 14 LEU HA . . 2.940 2.699 2.273 2.947 0.007 10 0 "[ . 1 . 2]" 2
386 1 13 ASN HA 1 15 ASP H . . 4.240 3.936 3.426 4.242 0.002 4 0 "[ . 1 . 2]" 2
387 1 15 ASP H 1 15 ASP HB2 . . 3.740 2.599 2.194 3.612 . 0 0 "[ . 1 . 2]" 2
388 1 16 GLY H 1 18 PHE H . . 3.330 3.026 2.896 3.263 . 0 0 "[ . 1 . 2]" 2
389 1 15 ASP HB3 1 16 GLY H . . 4.290 3.181 2.284 3.945 . 0 0 "[ . 1 . 2]" 2
390 1 15 ASP HA 1 17 GLN H . . 5.190 4.769 4.215 5.147 . 0 0 "[ . 1 . 2]" 2
391 1 18 PHE H 1 26 ILE HB . . 5.500 5.090 4.878 5.202 . 0 0 "[ . 1 . 2]" 2
392 1 18 PHE H 1 25 GLN HA . . 4.760 4.517 4.445 4.590 . 0 0 "[ . 1 . 2]" 2
393 1 18 PHE H 1 18 PHE QE . . 4.150 3.927 3.823 4.019 . 0 0 "[ . 1 . 2]" 2
394 1 20 GLU HB2 1 21 ILE H . . 4.630 2.798 2.693 2.913 . 0 0 "[ . 1 . 2]" 2
395 1 20 GLU HA 1 23 GLY H . . 4.890 4.259 4.120 4.406 . 0 0 "[ . 1 . 2]" 2
396 1 19 CYS H 1 20 GLU H . . 5.460 4.642 4.634 4.650 . 0 0 "[ . 1 . 2]" 2
397 1 34 LEU HB2 1 35 PHE H . . 4.510 4.312 4.221 4.392 . 0 0 "[ . 1 . 2]" 2
398 1 39 ASN HA 1 42 GLY H . . 5.500 3.848 3.312 4.590 . 0 0 "[ . 1 . 2]" 2
399 1 49 CYS HA 1 53 GLU H . . 4.710 4.439 3.862 4.740 0.030 3 0 "[ . 1 . 2]" 2
400 1 53 GLU HA 1 59 GLN H . . 4.110 3.939 3.764 4.109 . 0 0 "[ . 1 . 2]" 2
401 1 59 GLN HE21 1 77 VAL HB . . 4.570 3.673 2.405 4.559 . 0 0 "[ . 1 . 2]" 2
402 1 61 CYS HB3 1 63 GLN H . . 5.120 3.281 3.171 3.351 . 0 0 "[ . 1 . 2]" 2
403 1 63 GLN H 1 65 LYS HA . . 4.850 4.457 4.371 4.564 . 0 0 "[ . 1 . 2]" 2
404 1 69 LYS H 1 70 ARG H . . 4.660 4.303 4.223 4.432 . 0 0 "[ . 1 . 2]" 2
405 1 76 ARG HG2 1 77 VAL H . . 3.750 2.549 1.911 3.749 . 0 0 "[ . 1 . 2]" 2
406 1 77 VAL H 1 77 VAL MG1 . . 3.390 3.090 2.814 3.282 . 0 0 "[ . 1 . 2]" 2
407 1 85 ASP H 1 86 ILE H . . 4.540 4.091 3.077 4.499 . 0 0 "[ . 1 . 2]" 2
408 1 21 ILE H 1 21 ILE MD . . 3.740 3.468 3.349 3.625 . 0 0 "[ . 1 . 2]" 2
409 1 21 ILE MD 1 22 CYS H . . 4.280 4.163 4.102 4.260 . 0 0 "[ . 1 . 2]" 2
410 1 21 ILE MD 1 43 PHE QE . . 3.290 2.288 1.987 2.733 . 0 0 "[ . 1 . 2]" 2
411 1 21 ILE MD 1 45 ALA HA . . 4.260 2.943 2.616 3.350 . 0 0 "[ . 1 . 2]" 2
412 1 21 ILE MD 1 62 PRO HD2 . . 4.490 4.010 3.759 4.330 . 0 0 "[ . 1 . 2]" 2
413 1 21 ILE MD 1 49 CYS HB3 . . 3.330 1.939 1.856 2.027 . 0 0 "[ . 1 . 2]" 2
414 1 21 ILE HB 1 21 ILE MD . . 3.380 2.366 2.297 2.394 . 0 0 "[ . 1 . 2]" 2
415 1 21 ILE MD 1 62 PRO HG2 . . 4.020 3.632 3.212 4.020 0.000 7 0 "[ . 1 . 2]" 2
416 1 19 CYS H 1 26 ILE MD . . 3.770 3.257 3.170 3.381 . 0 0 "[ . 1 . 2]" 2
417 1 20 GLU H 1 26 ILE MD . . 4.450 3.998 3.845 4.189 . 0 0 "[ . 1 . 2]" 2
418 1 26 ILE MD 1 46 CYS HB3 . . 4.120 4.008 3.863 4.106 . 0 0 "[ . 1 . 2]" 2
419 1 26 ILE MD 1 44 PRO HB2 . . 3.390 2.435 2.319 2.599 . 0 0 "[ . 1 . 2]" 2
420 1 26 ILE HB 1 26 ILE MD . . 2.870 2.357 2.294 2.448 . 0 0 "[ . 1 . 2]" 2
421 1 26 ILE MD 1 46 CYS H . . 3.960 3.293 3.060 3.532 . 0 0 "[ . 1 . 2]" 2
422 1 26 ILE H 1 26 ILE MD . . 4.040 3.553 3.522 3.604 . 0 0 "[ . 1 . 2]" 2
423 1 26 ILE MD 1 45 ALA H . . 4.510 2.243 1.834 2.584 . 0 0 "[ . 1 . 2]" 2
424 1 26 ILE MD 1 46 CYS HA . . 3.480 3.061 2.945 3.202 . 0 0 "[ . 1 . 2]" 2
425 1 26 ILE MD 1 44 PRO HA . . 3.850 2.603 2.361 3.038 . 0 0 "[ . 1 . 2]" 2
426 1 19 CYS HA 1 26 ILE MD . . 3.310 2.229 2.036 2.482 . 0 0 "[ . 1 . 2]" 2
427 1 26 ILE HA 1 26 ILE MD . . 3.990 3.827 3.807 3.845 . 0 0 "[ . 1 . 2]" 2
428 1 19 CYS HB2 1 26 ILE MD . . 3.860 2.921 2.684 3.099 . 0 0 "[ . 1 . 2]" 2
429 1 26 ILE MD 1 44 PRO HB3 . . 3.280 2.968 2.853 3.067 . 0 0 "[ . 1 . 2]" 2
430 1 26 ILE MD 1 34 LEU MD2 . . 4.210 4.115 3.868 4.225 0.015 20 0 "[ . 1 . 2]" 2
431 1 28 LEU HB3 1 32 GLY HA3 . . 4.310 4.011 3.714 4.221 . 0 0 "[ . 1 . 2]" 2
432 1 28 LEU HB2 1 29 THR H . . 4.050 3.513 3.297 3.728 . 0 0 "[ . 1 . 2]" 2
433 1 28 LEU HB2 1 28 LEU HG . . 2.620 2.477 2.457 2.509 . 0 0 "[ . 1 . 2]" 2
434 1 86 ILE HB 1 86 ILE MD . . 3.720 2.485 2.089 3.224 . 0 0 "[ . 1 . 2]" 2
435 1 86 ILE HA 1 86 ILE MD . . 4.320 3.505 1.983 4.176 . 0 0 "[ . 1 . 2]" 2
436 1 27 GLY HA3 1 28 LEU H . . 3.110 2.237 2.203 2.288 . 0 0 "[ . 1 . 2]" 2
437 1 27 GLY HA2 1 28 LEU H . . 3.020 2.965 2.885 3.023 0.003 18 0 "[ . 1 . 2]" 2
438 1 72 ARG QB 1 72 ARG QD . . 3.170 2.222 2.040 2.638 . 0 0 "[ . 1 . 2]" 2
439 1 70 ARG QB 1 70 ARG HD2 . . 3.430 3.024 2.411 3.253 . 0 0 "[ . 1 . 2]" 2
440 1 70 ARG QB 1 70 ARG HD3 . . 3.430 2.336 2.044 3.292 . 0 0 "[ . 1 . 2]" 2
441 1 65 LYS HE2 1 65 LYS HG2 . . 3.820 3.017 2.055 3.754 . 0 0 "[ . 1 . 2]" 2
442 1 33 ASP HB2 1 34 LEU H . . 3.800 3.612 2.320 3.808 0.008 11 0 "[ . 1 . 2]" 2
443 1 33 ASP H 1 33 ASP HB2 . . 4.050 2.584 2.283 3.570 . 0 0 "[ . 1 . 2]" 2
444 1 33 ASP HB3 1 34 LEU H . . 3.800 2.578 2.125 3.738 . 0 0 "[ . 1 . 2]" 2
445 1 33 ASP H 1 33 ASP HB3 . . 4.050 3.544 2.324 3.846 . 0 0 "[ . 1 . 2]" 2
446 1 29 THR MG 1 33 ASP HB3 . . 4.170 3.954 3.642 4.175 0.005 2 0 "[ . 1 . 2]" 2
447 1 34 LEU HB3 1 34 LEU HG . . 2.760 2.464 2.391 2.536 . 0 0 "[ . 1 . 2]" 2
448 1 34 LEU HB2 1 34 LEU MD1 . . 3.280 3.179 3.155 3.187 . 0 0 "[ . 1 . 2]" 2
449 1 34 LEU HB3 1 34 LEU MD2 . . 3.240 3.182 3.176 3.196 . 0 0 "[ . 1 . 2]" 2
450 1 69 LYS QE 1 69 LYS QG . . 3.450 2.165 2.026 2.486 . 0 0 "[ . 1 . 2]" 2
451 1 24 ASP H 1 24 ASP HB2 . . 3.720 2.448 2.167 2.860 . 0 0 "[ . 1 . 2]" 2
452 1 24 ASP HB2 1 25 GLN H . . 4.150 3.983 3.742 4.104 . 0 0 "[ . 1 . 2]" 2
453 1 24 ASP HB3 1 25 GLN H . . 4.150 2.976 2.656 3.271 . 0 0 "[ . 1 . 2]" 2
454 1 80 ASP H 1 80 ASP HB2 . . 3.720 2.727 2.178 3.641 . 0 0 "[ . 1 . 2]" 2
455 1 18 PHE HB3 1 19 CYS H . . 3.990 3.396 3.273 3.523 . 0 0 "[ . 1 . 2]" 2
456 1 18 PHE H 1 18 PHE HB3 . . 3.690 3.591 3.587 3.595 . 0 0 "[ . 1 . 2]" 2
457 1 82 ASP H 1 82 ASP HB2 . . 3.810 2.828 2.275 3.693 . 0 0 "[ . 1 . 2]" 2
458 1 82 ASP H 1 82 ASP HB3 . . 3.810 3.381 2.175 3.837 0.027 11 0 "[ . 1 . 2]" 2
459 1 82 ASP HB2 1 83 GLU H . . 4.140 3.129 2.002 4.075 . 0 0 "[ . 1 . 2]" 2
460 1 60 ASN H 1 60 ASN HB2 . . 3.990 2.977 2.760 3.179 . 0 0 "[ . 1 . 2]" 2
461 1 60 ASN HB2 1 60 ASN HD22 . . 3.880 3.452 3.433 3.535 . 0 0 "[ . 1 . 2]" 2
462 1 60 ASN HB2 1 65 LYS HA . . 3.900 3.426 3.272 3.550 . 0 0 "[ . 1 . 2]" 2
463 1 60 ASN HB3 1 65 LYS HA . . 3.670 2.537 2.145 2.772 . 0 0 "[ . 1 . 2]" 2
464 1 43 PHE HB2 1 63 GLN HB2 . . 4.120 3.081 2.818 3.294 . 0 0 "[ . 1 . 2]" 2
465 1 35 PHE H 1 35 PHE HB3 . . 3.560 2.519 2.441 2.600 . 0 0 "[ . 1 . 2]" 2
466 1 35 PHE H 1 35 PHE HB2 . . 3.520 2.581 2.465 2.707 . 0 0 "[ . 1 . 2]" 2
467 1 29 THR MG 1 35 PHE HB2 . . 3.560 2.242 1.978 2.877 . 0 0 "[ . 1 . 2]" 2
468 1 39 ASN H 1 39 ASN QB . . 3.680 2.440 2.347 2.549 . 0 0 "[ . 1 . 2]" 2
469 1 21 ILE H 1 21 ILE HB . . 3.340 2.628 2.553 2.673 . 0 0 "[ . 1 . 2]" 2
470 1 26 ILE HB 1 34 LEU MD2 . . 3.930 3.253 2.652 3.573 . 0 0 "[ . 1 . 2]" 2
471 1 49 CYS HA 1 52 TYR HB3 . . 3.620 3.302 3.139 3.623 0.003 7 0 "[ . 1 . 2]" 2
472 1 37 ALA MB 1 50 TYR HB2 . . 3.590 2.076 1.944 2.451 . 0 0 "[ . 1 . 2]" 2
473 1 20 GLU HA 1 20 GLU HG2 . . 3.710 2.507 2.448 2.580 . 0 0 "[ . 1 . 2]" 2
474 1 20 GLU HA 1 20 GLU HG3 . . 3.810 3.649 3.631 3.689 . 0 0 "[ . 1 . 2]" 2
475 1 31 GLU HA 1 31 GLU HG3 . . 3.700 3.279 2.311 3.692 . 0 0 "[ . 1 . 2]" 2
476 1 20 GLU HG2 1 44 PRO HG2 . . 3.580 2.311 2.146 2.445 . 0 0 "[ . 1 . 2]" 2
477 1 56 GLU H 1 56 GLU QG . . 3.850 3.189 3.007 3.567 . 0 0 "[ . 1 . 2]" 2
478 1 55 ARG HG3 1 56 GLU QG . . 4.590 4.026 2.356 4.563 . 0 0 "[ . 1 . 2]" 2
479 1 56 GLU HA 1 56 GLU QG . . 3.510 2.391 2.128 2.735 . 0 0 "[ . 1 . 2]" 2
480 1 53 GLU HG3 1 59 GLN H . . 3.930 2.448 2.166 3.006 . 0 0 "[ . 1 . 2]" 2
481 1 66 THR H 1 66 THR HB . . 3.570 2.559 2.409 2.672 . 0 0 "[ . 1 . 2]" 2
482 1 41 CYS HB3 1 64 CYS HB2 . . 3.310 3.076 2.885 3.286 . 0 0 "[ . 1 . 2]" 2
483 1 59 GLN HA 1 59 GLN HG3 . . 3.970 2.896 2.759 3.153 . 0 0 "[ . 1 . 2]" 2
484 1 25 GLN H 1 25 GLN HG3 . . 4.630 4.545 4.512 4.587 . 0 0 "[ . 1 . 2]" 2
485 1 69 LYS HB3 1 70 ARG H . . 4.330 4.104 3.404 4.326 . 0 0 "[ . 1 . 2]" 2
486 1 69 LYS H 1 69 LYS HB2 . . 4.020 3.934 3.772 3.981 . 0 0 "[ . 1 . 2]" 2
487 1 30 VAL HA 1 30 VAL MG1 . . 3.470 2.504 2.252 3.196 . 0 0 "[ . 1 . 2]" 2
488 1 30 VAL HA 1 30 VAL MG2 . . 3.470 2.351 2.194 2.446 . 0 0 "[ . 1 . 2]" 2
489 1 75 PRO HB3 1 76 ARG H . . 3.920 3.418 3.151 3.805 . 0 0 "[ . 1 . 2]" 2
490 1 21 ILE HA 1 21 ILE MD . . 4.030 3.846 3.796 3.875 . 0 0 "[ . 1 . 2]" 2
491 1 21 ILE HA 1 21 ILE HG13 . . 3.420 2.964 2.889 3.044 . 0 0 "[ . 1 . 2]" 2
492 1 38 CYS QB 1 43 PHE H . . 3.640 2.125 1.914 3.613 . 0 0 "[ . 1 . 2]" 2
493 1 26 ILE HA 1 27 GLY H . . 3.130 2.154 2.143 2.210 . 0 0 "[ . 1 . 2]" 2
494 1 26 ILE HA 1 26 ILE HG12 . . 3.560 2.527 2.488 2.559 . 0 0 "[ . 1 . 2]" 2
495 1 26 ILE HA 1 26 ILE MG . . 3.500 2.351 2.301 2.449 . 0 0 "[ . 1 . 2]" 2
496 1 26 ILE HA 1 26 ILE HG13 . . 3.430 3.003 2.952 3.058 . 0 0 "[ . 1 . 2]" 2
497 1 56 GLU H 1 56 GLU HB2 . . 3.710 2.403 2.251 2.521 . 0 0 "[ . 1 . 2]" 2
498 1 61 CYS H 1 61 CYS HB2 . . 3.560 2.498 2.431 2.735 . 0 0 "[ . 1 . 2]" 2
499 1 46 CYS HB2 1 48 PRO HD2 . . 3.900 1.976 1.921 2.011 . 0 0 "[ . 1 . 2]" 2
500 1 19 CYS HB2 1 46 CYS HB2 . . 4.150 4.103 4.003 4.166 0.016 6 0 "[ . 1 . 2]" 2
501 1 46 CYS H 1 46 CYS HB3 . . 3.900 2.560 2.512 2.599 . 0 0 "[ . 1 . 2]" 2
502 1 19 CYS HB2 1 46 CYS HB3 . . 3.520 2.390 2.306 2.460 . 0 0 "[ . 1 . 2]" 2
503 1 26 ILE HG13 1 46 CYS HB3 . . 4.060 3.546 3.399 3.697 . 0 0 "[ . 1 . 2]" 2
504 1 48 PRO HB3 1 49 CYS H . . 4.630 4.594 4.564 4.619 . 0 0 "[ . 1 . 2]" 2
505 1 76 ARG QB 1 76 ARG QD . . 3.290 2.184 2.033 2.414 . 0 0 "[ . 1 . 2]" 2
506 1 19 CYS HB3 1 46 CYS H . . 3.740 3.534 3.472 3.635 . 0 0 "[ . 1 . 2]" 2
507 1 19 CYS H 1 19 CYS HB3 . . 3.130 2.511 2.465 2.554 . 0 0 "[ . 1 . 2]" 2
508 1 19 CYS HB3 1 46 CYS HB3 . . 3.610 3.297 3.106 3.375 . 0 0 "[ . 1 . 2]" 2
509 1 19 CYS HB2 1 46 CYS H . . 3.390 2.209 2.101 2.298 . 0 0 "[ . 1 . 2]" 2
510 1 19 CYS H 1 19 CYS HB2 . . 3.230 2.557 2.522 2.592 . 0 0 "[ . 1 . 2]" 2
511 1 19 CYS HB2 1 26 ILE HG13 . . 4.120 2.438 2.251 2.692 . 0 0 "[ . 1 . 2]" 2
512 1 41 CYS HB2 1 64 CYS HB2 . . 4.670 4.332 3.873 4.637 . 0 0 "[ . 1 . 2]" 2
513 1 64 CYS H 1 64 CYS HB2 . . 4.000 3.778 3.755 3.811 . 0 0 "[ . 1 . 2]" 2
514 1 64 CYS H 1 64 CYS HB3 . . 3.750 3.039 2.955 3.109 . 0 0 "[ . 1 . 2]" 2
515 1 41 CYS HB3 1 64 CYS HB3 . . 2.790 2.006 1.978 2.044 . 0 0 "[ . 1 . 2]" 2
516 1 41 CYS HB2 1 64 CYS HB3 . . 3.600 2.917 2.555 3.103 . 0 0 "[ . 1 . 2]" 2
517 1 84 GLU H 1 84 GLU HB3 . . 3.990 3.221 2.404 3.734 . 0 0 "[ . 1 . 2]" 2
518 1 52 TYR HA 1 55 ARG HB2 . . 3.880 2.830 2.265 3.640 . 0 0 "[ . 1 . 2]" 2
519 1 52 TYR HA 1 52 TYR QD . . 3.790 2.747 2.386 3.100 . 0 0 "[ . 1 . 2]" 2
520 1 50 TYR HA 1 53 GLU HB3 . . 4.320 3.167 2.552 3.574 . 0 0 "[ . 1 . 2]" 2
521 1 20 GLU HB3 1 43 PHE QE . . 3.930 3.020 2.623 3.362 . 0 0 "[ . 1 . 2]" 2
522 1 20 GLU HB3 1 20 GLU HG3 . . 2.700 2.593 2.555 2.617 . 0 0 "[ . 1 . 2]" 2
523 1 20 GLU HB2 1 44 PRO HG2 . . 2.710 2.013 1.994 2.124 . 0 0 "[ . 1 . 2]" 2
524 1 17 GLN QB 1 18 PHE H . . 3.400 2.820 2.697 2.984 . 0 0 "[ . 1 . 2]" 2
525 1 72 ARG QB 1 73 GLY H . . 3.850 2.684 2.186 3.539 . 0 0 "[ . 1 . 2]" 2
526 1 17 GLN QB 1 34 LEU MD2 . . 3.300 2.561 2.107 2.980 . 0 0 "[ . 1 . 2]" 2
527 1 26 ILE HG13 1 46 CYS HA . . 4.030 3.814 3.734 3.968 . 0 0 "[ . 1 . 2]" 2
528 1 67 ARG H 1 67 ARG HB2 . . 3.790 3.594 3.581 3.623 . 0 0 "[ . 1 . 2]" 2
529 1 86 ILE HA 1 86 ILE MG . . 3.600 2.341 2.145 2.509 . 0 0 "[ . 1 . 2]" 2
530 1 47 ARG HA 1 47 ARG HG2 . . 4.100 3.080 2.156 3.586 . 0 0 "[ . 1 . 2]" 2
531 1 35 PHE QE 1 47 ARG HA . . 3.730 2.590 1.999 3.278 . 0 0 "[ . 1 . 2]" 2
532 1 47 ARG HA 1 50 TYR HB3 . . 3.680 3.314 3.214 3.438 . 0 0 "[ . 1 . 2]" 2
533 1 36 VAL HA 1 36 VAL MG2 . . 3.320 2.340 2.259 2.495 . 0 0 "[ . 1 . 2]" 2
534 1 69 LYS HA 1 69 LYS QD . . 4.010 3.694 3.626 3.813 . 0 0 "[ . 1 . 2]" 2
535 1 69 LYS HB3 1 69 LYS QD . . 3.600 2.484 2.086 3.502 . 0 0 "[ . 1 . 2]" 2
536 1 18 PHE QE 1 25 GLN HB2 . . 3.890 2.352 2.227 2.445 . 0 0 "[ . 1 . 2]" 2
537 1 35 PHE HA 1 35 PHE QD . . 3.300 2.634 2.165 3.029 . 0 0 "[ . 1 . 2]" 2
538 1 21 ILE H 1 21 ILE HG12 . . 3.960 3.262 3.132 3.383 . 0 0 "[ . 1 . 2]" 2
539 1 21 ILE HG12 1 43 PHE QE . . 4.040 2.544 2.011 3.189 . 0 0 "[ . 1 . 2]" 2
540 1 21 ILE HA 1 21 ILE HG12 . . 3.420 2.570 2.467 2.644 . 0 0 "[ . 1 . 2]" 2
541 1 66 THR MG 1 67 ARG HG3 . . 2.800 2.695 2.472 2.856 0.056 14 0 "[ . 1 . 2]" 2
542 1 76 ARG HA 1 76 ARG HG2 . . 3.920 3.046 2.563 3.748 . 0 0 "[ . 1 . 2]" 2
543 1 76 ARG HA 1 76 ARG HG3 . . 3.920 2.835 2.361 3.665 . 0 0 "[ . 1 . 2]" 2
544 1 21 ILE H 1 21 ILE HG13 . . 3.960 1.950 1.896 2.086 . 0 0 "[ . 1 . 2]" 2
545 1 21 ILE HG13 1 43 PHE QE . . 4.040 2.651 2.131 3.199 . 0 0 "[ . 1 . 2]" 2
546 1 54 ARG HA 1 59 GLN H . . 3.960 3.227 2.709 3.612 . 0 0 "[ . 1 . 2]" 2
547 1 54 ARG HA 1 59 GLN HA . . 3.350 2.730 2.073 3.082 . 0 0 "[ . 1 . 2]" 2
548 1 54 ARG HA 1 59 GLN HG2 . . 3.510 2.018 1.989 2.225 . 0 0 "[ . 1 . 2]" 2
549 1 54 ARG HA 1 59 GLN HG3 . . 3.590 2.432 2.057 3.229 . 0 0 "[ . 1 . 2]" 2
550 1 51 GLU HA 1 51 GLU HG3 . . 4.030 2.819 2.332 3.552 . 0 0 "[ . 1 . 2]" 2
551 1 51 GLU HA 1 54 ARG HB2 . . 3.710 3.207 2.822 3.395 . 0 0 "[ . 1 . 2]" 2
552 1 51 GLU HA 1 51 GLU HG2 . . 4.030 2.938 2.242 3.685 . 0 0 "[ . 1 . 2]" 2
553 1 19 CYS HA 1 44 PRO HB2 . . 3.830 2.000 1.987 2.050 . 0 0 "[ . 1 . 2]" 2
554 1 19 CYS HA 1 46 CYS H . . 3.770 3.756 3.609 3.805 0.035 7 0 "[ . 1 . 2]" 2
555 1 19 CYS HA 1 20 GLU H . . 3.110 2.287 2.248 2.348 . 0 0 "[ . 1 . 2]" 2
556 1 19 CYS HA 1 45 ALA HA . . 3.880 3.457 3.311 3.568 . 0 0 "[ . 1 . 2]" 2
557 1 72 ARG H 1 72 ARG HG2 . . 3.800 2.862 1.913 3.853 0.053 15 0 "[ . 1 . 2]" 2
558 1 43 PHE QE 1 62 PRO HG3 . . 4.050 2.612 2.542 2.805 . 0 0 "[ . 1 . 2]" 2
559 1 50 TYR HH 1 71 LEU MD1 . . 4.440 3.202 2.878 3.761 . 0 0 "[ . 1 . 2]" 2
560 1 35 PHE QD 1 71 LEU MD1 . . 4.080 3.876 3.625 4.051 . 0 0 "[ . 1 . 2]" 2
561 1 35 PHE QE 1 71 LEU MD1 . . 3.520 2.405 1.988 2.800 . 0 0 "[ . 1 . 2]" 2
562 1 71 LEU HA 1 71 LEU MD1 . . 4.050 3.839 3.778 3.900 . 0 0 "[ . 1 . 2]" 2
563 1 71 LEU QB 1 71 LEU MD1 . . 2.610 2.079 2.042 2.097 . 0 0 "[ . 1 . 2]" 2
564 1 11 LEU HG 1 12 LYS H . . 4.760 2.709 1.892 4.766 0.006 16 0 "[ . 1 . 2]" 2
565 1 11 LEU H 1 11 LEU HG . . 5.370 4.544 4.445 4.693 . 0 0 "[ . 1 . 2]" 2
566 1 14 LEU H 1 14 LEU HG . . 5.500 3.527 2.649 4.806 . 0 0 "[ . 1 . 2]" 2
567 1 14 LEU HA 1 14 LEU HG . . 3.810 2.889 2.249 3.721 . 0 0 "[ . 1 . 2]" 2
568 1 53 GLU HA 1 57 GLY HA3 . . 2.630 2.023 1.971 2.124 . 0 0 "[ . 1 . 2]" 2
569 1 52 TYR QD 1 53 GLU HA . . 4.210 3.647 3.077 4.038 . 0 0 "[ . 1 . 2]" 2
570 1 55 ARG HA 1 55 ARG HG2 . . 3.960 2.548 2.220 3.842 . 0 0 "[ . 1 . 2]" 2
571 1 55 ARG HA 1 77 VAL MG1 . . 3.570 2.562 1.964 3.258 . 0 0 "[ . 1 . 2]" 2
572 1 55 ARG HA 1 55 ARG HG3 . . 3.960 3.417 2.958 3.626 . 0 0 "[ . 1 . 2]" 2
573 1 78 GLU HA 1 80 ASP H . . 4.480 4.028 3.238 4.491 0.011 3 0 "[ . 1 . 2]" 2
574 1 78 GLU HA 1 78 GLU QG . . 3.710 2.535 2.215 3.476 . 0 0 "[ . 1 . 2]" 2
575 1 34 LEU HB2 1 34 LEU HG . . 2.760 2.406 2.343 2.478 . 0 0 "[ . 1 . 2]" 2
576 1 40 GLU HA 1 40 GLU HG3 . . 4.070 3.260 2.452 3.823 . 0 0 "[ . 1 . 2]" 2
577 1 50 TYR HH 1 70 ARG HA . . 4.090 3.796 3.279 3.944 . 0 0 "[ . 1 . 2]" 2
578 1 70 ARG HA 1 70 ARG HG3 . . 3.740 2.239 2.162 2.496 . 0 0 "[ . 1 . 2]" 2
579 1 70 ARG HA 1 70 ARG HG2 . . 3.740 3.089 2.824 3.188 . 0 0 "[ . 1 . 2]" 2
580 1 59 GLN HA 1 59 GLN HG2 . . 3.780 2.882 2.743 3.017 . 0 0 "[ . 1 . 2]" 2
581 1 63 GLN HA 1 63 GLN HG2 . . 3.720 3.582 3.554 3.603 . 0 0 "[ . 1 . 2]" 2
582 1 63 GLN HA 1 63 GLN HG3 . . 3.390 2.562 2.536 2.593 . 0 0 "[ . 1 . 2]" 2
583 1 28 LEU MD1 1 32 GLY HA3 . . 3.830 3.568 3.304 3.761 . 0 0 "[ . 1 . 2]" 2
584 1 28 LEU HB2 1 28 LEU MD1 . . 2.950 2.338 2.262 2.382 . 0 0 "[ . 1 . 2]" 2
585 1 28 LEU HB3 1 28 LEU MD1 . . 2.970 2.344 2.291 2.436 . 0 0 "[ . 1 . 2]" 2
586 1 28 LEU MD1 1 32 GLY HA2 . . 3.830 2.729 2.530 2.935 . 0 0 "[ . 1 . 2]" 2
587 1 26 ILE HB 1 34 LEU MD1 . . 3.730 3.399 2.665 3.734 0.004 10 0 "[ . 1 . 2]" 2
588 1 34 LEU HB3 1 34 LEU MD1 . . 3.280 2.245 2.120 2.337 . 0 0 "[ . 1 . 2]" 2
589 1 31 GLU HA 1 31 GLU HG2 . . 3.700 2.805 2.163 3.697 . 0 0 "[ . 1 . 2]" 2
590 1 25 GLN HA 1 25 GLN HG2 . . 3.950 3.002 2.888 3.103 . 0 0 "[ . 1 . 2]" 2
591 1 14 LEU HA 1 14 LEU MD1 . . 3.970 3.338 1.970 3.941 . 0 0 "[ . 1 . 2]" 2
592 1 69 LYS HA 1 69 LYS QG . . 3.710 3.410 3.377 3.445 . 0 0 "[ . 1 . 2]" 2
593 1 69 LYS QD 1 69 LYS QG . . 2.400 2.052 2.009 2.089 . 0 0 "[ . 1 . 2]" 2
594 1 11 LEU HA 1 11 LEU MD1 . . 4.050 2.548 1.985 3.705 . 0 0 "[ . 1 . 2]" 2
595 1 25 GLN HA 1 26 ILE H . . 3.040 2.141 2.138 2.145 . 0 0 "[ . 1 . 2]" 2
596 1 25 GLN HA 1 25 GLN HG3 . . 3.630 2.676 2.516 2.897 . 0 0 "[ . 1 . 2]" 2
597 1 81 GLU HA 1 82 ASP H . . 3.220 2.507 2.138 3.302 0.082 5 0 "[ . 1 . 2]" 2
598 1 34 LEU HA 1 35 PHE H . . 3.070 2.156 2.145 2.191 . 0 0 "[ . 1 . 2]" 2
599 1 28 LEU HA 1 34 LEU HA . . 3.610 2.824 2.442 2.999 . 0 0 "[ . 1 . 2]" 2
600 1 34 LEU HA 1 34 LEU HG . . 3.810 3.718 3.651 3.781 . 0 0 "[ . 1 . 2]" 2
601 1 34 LEU HA 1 34 LEU MD2 . . 3.160 1.973 1.904 2.033 . 0 0 "[ . 1 . 2]" 2
602 1 34 LEU HA 1 34 LEU MD1 . . 3.110 2.865 2.731 3.100 . 0 0 "[ . 1 . 2]" 2
603 1 83 GLU HA 1 83 GLU QG . . 3.430 2.677 2.155 3.338 . 0 0 "[ . 1 . 2]" 2
604 1 83 GLU HA 1 84 GLU H . . 3.140 2.325 2.141 2.779 . 0 0 "[ . 1 . 2]" 2
605 1 76 ARG HA 1 77 VAL H . . 3.010 2.262 2.151 2.375 . 0 0 "[ . 1 . 2]" 2
606 1 17 GLN HA 1 17 GLN HG2 . . 3.720 2.724 2.423 3.478 . 0 0 "[ . 1 . 2]" 2
607 1 17 GLN HA 1 17 GLN HG3 . . 3.720 3.160 2.606 3.722 0.002 7 0 "[ . 1 . 2]" 2
608 1 17 GLN HA 1 34 LEU MD2 . . 4.290 4.054 3.581 4.294 0.004 1 0 "[ . 1 . 2]" 2
609 1 17 GLN HG3 1 34 LEU MD2 . . 4.020 3.423 2.040 4.027 0.007 12 0 "[ . 1 . 2]" 2
610 1 34 LEU HB2 1 34 LEU MD2 . . 3.240 2.362 2.315 2.439 . 0 0 "[ . 1 . 2]" 2
611 1 34 LEU MD2 1 35 PHE H . . 3.540 2.674 2.059 2.984 . 0 0 "[ . 1 . 2]" 2
612 1 34 LEU H 1 34 LEU MD2 . . 3.910 3.817 3.622 3.990 0.080 1 0 "[ . 1 . 2]" 2
613 1 26 ILE MG 1 34 LEU MD2 . . 2.960 2.647 2.437 2.838 . 0 0 "[ . 1 . 2]" 2
614 1 28 LEU MD2 1 34 LEU MD2 . . 3.550 2.382 2.128 2.666 . 0 0 "[ . 1 . 2]" 2
615 1 11 LEU HA 1 11 LEU MD2 . . 4.050 3.550 2.003 3.946 . 0 0 "[ . 1 . 2]" 2
616 1 14 LEU HA 1 14 LEU MD2 . . 3.970 2.696 2.047 3.937 . 0 0 "[ . 1 . 2]" 2
617 1 29 THR H 1 29 THR MG . . 3.290 2.356 1.975 2.647 . 0 0 "[ . 1 . 2]" 2
618 1 29 THR MG 1 33 ASP H . . 4.400 3.976 3.281 4.276 . 0 0 "[ . 1 . 2]" 2
619 1 29 THR MG 1 35 PHE QD . . 3.350 2.099 1.932 2.391 . 0 0 "[ . 1 . 2]" 2
620 1 29 THR HA 1 29 THR MG . . 3.460 2.353 2.194 2.549 . 0 0 "[ . 1 . 2]" 2
621 1 29 THR MG 1 35 PHE HA . . 3.120 1.985 1.839 2.159 . 0 0 "[ . 1 . 2]" 2
622 1 29 THR MG 1 35 PHE HB3 . . 4.730 3.596 3.402 3.930 . 0 0 "[ . 1 . 2]" 2
623 1 71 LEU HA 1 71 LEU MD2 . . 3.010 2.008 1.944 2.279 . 0 0 "[ . 1 . 2]" 2
624 1 69 LYS HB2 1 71 LEU MD2 . . 4.330 4.240 3.935 4.347 0.017 9 0 "[ . 1 . 2]" 2
625 1 69 LYS QG 1 71 LEU MD2 . . 3.530 2.101 1.941 2.962 . 0 0 "[ . 1 . 2]" 2
626 1 71 LEU QB 1 71 LEU MD2 . . 2.770 2.298 2.178 2.365 . 0 0 "[ . 1 . 2]" 2
627 1 28 LEU MD2 1 29 THR H . . 3.870 3.364 3.115 3.565 . 0 0 "[ . 1 . 2]" 2
628 1 28 LEU HA 1 28 LEU MD2 . . 3.060 2.103 1.976 2.301 . 0 0 "[ . 1 . 2]" 2
629 1 28 LEU MD2 1 34 LEU HA . . 3.370 2.404 2.144 2.645 . 0 0 "[ . 1 . 2]" 2
630 1 28 LEU HB2 1 28 LEU MD2 . . 3.250 3.187 3.176 3.195 . 0 0 "[ . 1 . 2]" 2
631 1 28 LEU HB3 1 28 LEU MD2 . . 2.910 2.318 2.202 2.391 . 0 0 "[ . 1 . 2]" 2
632 1 37 ALA HA 1 71 LEU MD1 . . 3.280 2.654 2.022 3.045 . 0 0 "[ . 1 . 2]" 2
633 1 45 ALA MB 1 46 CYS H . . 3.400 3.300 3.258 3.383 . 0 0 "[ . 1 . 2]" 2
634 1 45 ALA MB 1 49 CYS HB3 . . 3.720 2.527 2.233 2.971 . 0 0 "[ . 1 . 2]" 2
635 1 45 ALA MB 1 50 TYR HB2 . . 4.030 2.610 2.301 2.962 . 0 0 "[ . 1 . 2]" 2
636 1 21 ILE MD 1 45 ALA MB . . 3.230 1.980 1.858 2.288 . 0 0 "[ . 1 . 2]" 2
637 1 28 LEU HA 1 29 THR H . . 3.160 2.437 2.325 2.515 . 0 0 "[ . 1 . 2]" 2
638 1 28 LEU HA 1 35 PHE H . . 3.720 2.823 2.319 3.087 . 0 0 "[ . 1 . 2]" 2
639 1 28 LEU HA 1 28 LEU HG . . 3.330 3.118 3.043 3.192 . 0 0 "[ . 1 . 2]" 2
640 1 28 LEU HA 1 34 LEU MD2 . . 4.590 3.430 3.071 3.727 . 0 0 "[ . 1 . 2]" 2
641 1 66 THR MG 1 67 ARG H . . 3.520 1.959 1.782 2.197 . 0 0 "[ . 1 . 2]" 2
642 1 66 THR HA 1 66 THR MG . . 2.850 2.373 2.276 2.510 . 0 0 "[ . 1 . 2]" 2
643 1 40 GLU HG2 1 66 THR MG . . 4.130 3.147 2.351 4.111 . 0 0 "[ . 1 . 2]" 2
644 1 40 GLU HG3 1 66 THR MG . . 4.130 3.148 1.965 4.113 . 0 0 "[ . 1 . 2]" 2
645 1 40 GLU HB3 1 66 THR MG . . 4.420 3.606 3.124 3.922 . 0 0 "[ . 1 . 2]" 2
646 1 58 THR H 1 58 THR MG . . 3.330 2.658 2.348 2.863 . 0 0 "[ . 1 . 2]" 2
647 1 58 THR HA 1 58 THR MG . . 3.070 2.420 2.349 2.490 . 0 0 "[ . 1 . 2]" 2
648 1 77 VAL HA 1 77 VAL MG1 . . 3.190 2.325 2.194 2.422 . 0 0 "[ . 1 . 2]" 2
649 1 54 ARG HG2 1 77 VAL MG1 . . 4.450 4.137 3.742 4.466 0.016 14 0 "[ . 1 . 2]" 2
650 1 54 ARG HB3 1 77 VAL MG1 . . 3.310 2.294 2.047 2.667 . 0 0 "[ . 1 . 2]" 2
651 1 36 VAL HA 1 36 VAL MG1 . . 3.320 2.584 2.318 3.190 . 0 0 "[ . 1 . 2]" 2
652 1 37 ALA MB 1 38 CYS H . . 3.740 2.311 1.924 2.666 . 0 0 "[ . 1 . 2]" 2
653 1 37 ALA H 1 37 ALA MB . . 3.350 2.131 2.034 2.236 . 0 0 "[ . 1 . 2]" 2
654 1 37 ALA MB 1 45 ALA H . . 4.300 2.550 2.175 3.103 . 0 0 "[ . 1 . 2]" 2
655 1 35 PHE QE 1 37 ALA MB . . 3.310 2.593 2.020 3.216 . 0 0 "[ . 1 . 2]" 2
656 1 37 ALA MB 1 71 LEU MD1 . . 4.100 3.618 3.106 3.862 . 0 0 "[ . 1 . 2]" 2
657 1 35 PHE QD 1 37 ALA MB . . 4.050 3.519 2.974 4.012 . 0 0 "[ . 1 . 2]" 2
658 1 43 PHE QD 1 62 PRO HD3 . . 4.550 4.267 4.148 4.572 0.022 14 0 "[ . 1 . 2]" 2
659 1 43 PHE QD 1 44 PRO HD2 . . 3.930 2.119 2.003 2.318 . 0 0 "[ . 1 . 2]" 2
660 1 20 GLU HG3 1 44 PRO HD2 . . 3.320 3.050 2.625 3.163 . 0 0 "[ . 1 . 2]" 2
661 1 26 ILE MG 1 35 PHE H . . 3.780 2.894 2.629 3.080 . 0 0 "[ . 1 . 2]" 2
662 1 26 ILE H 1 26 ILE MG . . 3.970 3.764 3.761 3.767 . 0 0 "[ . 1 . 2]" 2
663 1 26 ILE MG 1 27 GLY H . . 3.600 2.825 2.578 3.232 . 0 0 "[ . 1 . 2]" 2
664 1 26 ILE MG 1 35 PHE QD . . 3.420 2.407 2.019 2.696 . 0 0 "[ . 1 . 2]" 2
665 1 26 ILE MG 1 46 CYS HA . . 3.860 2.360 2.083 2.606 . 0 0 "[ . 1 . 2]" 2
666 1 26 ILE MG 1 35 PHE HB3 . . 3.260 2.100 1.907 2.246 . 0 0 "[ . 1 . 2]" 2
667 1 26 ILE MG 1 35 PHE HB2 . . 3.670 3.347 3.135 3.566 . 0 0 "[ . 1 . 2]" 2
668 1 26 ILE HG12 1 26 ILE MG . . 2.750 2.363 2.286 2.429 . 0 0 "[ . 1 . 2]" 2
669 1 26 ILE MG 1 34 LEU MD1 . . 3.370 2.280 1.921 2.745 . 0 0 "[ . 1 . 2]" 2
670 1 26 ILE MD 1 26 ILE MG . . 2.950 2.033 1.918 2.160 . 0 0 "[ . 1 . 2]" 2
671 1 74 SER HA 1 75 PRO HD2 . . 3.240 1.920 1.911 1.954 . 0 0 "[ . 1 . 2]" 2
672 1 74 SER HA 1 75 PRO HD3 . . 3.500 2.460 2.348 2.567 . 0 0 "[ . 1 . 2]" 2
673 1 21 ILE H 1 21 ILE MG . . 3.930 3.769 3.765 3.773 . 0 0 "[ . 1 . 2]" 2
674 1 21 ILE MG 1 22 CYS H . . 3.810 2.974 2.888 3.097 . 0 0 "[ . 1 . 2]" 2
675 1 21 ILE MG 1 22 CYS HA . . 4.480 3.462 3.379 3.585 . 0 0 "[ . 1 . 2]" 2
676 1 21 ILE HA 1 21 ILE MG . . 3.020 2.358 2.298 2.443 . 0 0 "[ . 1 . 2]" 2
677 1 21 ILE MG 1 49 CYS HB3 . . 3.650 3.550 3.455 3.663 0.013 14 0 "[ . 1 . 2]" 2
678 1 21 ILE MG 1 22 CYS HB3 . . 3.260 3.126 3.024 3.212 . 0 0 "[ . 1 . 2]" 2
679 1 21 ILE HG12 1 21 ILE MG . . 3.520 2.380 2.331 2.444 . 0 0 "[ . 1 . 2]" 2
680 1 21 ILE HG13 1 21 ILE MG . . 3.520 3.198 3.189 3.203 . 0 0 "[ . 1 . 2]" 2
681 1 9 LYS HA 1 10 PRO HD2 . . 3.240 2.224 1.920 2.415 . 0 0 "[ . 1 . 2]" 2
682 1 9 LYS HA 1 10 PRO HD3 . . 3.240 2.280 2.254 2.441 . 0 0 "[ . 1 . 2]" 2
683 1 59 GLN HE21 1 77 VAL MG2 . . 3.720 2.879 2.143 3.727 0.007 11 0 "[ . 1 . 2]" 2
684 1 59 GLN HE22 1 77 VAL MG2 . . 3.720 3.150 2.497 3.619 . 0 0 "[ . 1 . 2]" 2
685 1 54 ARG HB3 1 77 VAL MG2 . . 3.400 2.328 1.971 2.633 . 0 0 "[ . 1 . 2]" 2
686 1 77 VAL H 1 77 VAL MG2 . . 3.460 2.197 1.984 2.409 . 0 0 "[ . 1 . 2]" 2
687 1 45 ALA HA 1 46 CYS H . . 3.110 2.144 2.141 2.156 . 0 0 "[ . 1 . 2]" 2
688 1 20 GLU H 1 45 ALA HA . . 4.170 3.459 3.292 3.582 . 0 0 "[ . 1 . 2]" 2
689 1 47 ARG H 1 48 PRO HD2 . . 4.070 1.876 1.846 1.965 . 0 0 "[ . 1 . 2]" 2
690 1 47 ARG HB2 1 48 PRO HD2 . . 4.330 3.237 2.644 3.834 . 0 0 "[ . 1 . 2]" 2
691 1 47 ARG H 1 48 PRO HD3 . . 3.940 2.869 2.832 2.953 . 0 0 "[ . 1 . 2]" 2
692 1 47 ARG HB2 1 48 PRO HD3 . . 4.050 2.901 2.061 3.507 . 0 0 "[ . 1 . 2]" 2
693 1 21 ILE MD 1 62 PRO HD3 . . 4.490 4.032 3.571 4.354 . 0 0 "[ . 1 . 2]" 2
694 1 18 PHE HB3 1 23 GLY HA2 . . 4.410 4.372 4.159 4.433 0.023 8 0 "[ . 1 . 2]" 2
695 1 16 GLY HA3 1 44 PRO HB3 . . 5.350 5.129 4.802 5.356 0.006 8 0 "[ . 1 . 2]" 2
696 1 16 GLY HA2 1 44 PRO HB3 . . 5.500 5.164 4.712 5.387 . 0 0 "[ . 1 . 2]" 2
697 1 53 GLU H 1 57 GLY HA3 . . 5.320 4.653 4.516 4.748 . 0 0 "[ . 1 . 2]" 2
698 1 27 GLY HA3 1 28 LEU MD2 . . 5.060 4.831 4.591 4.990 . 0 0 "[ . 1 . 2]" 2
699 1 27 GLY HA3 1 28 LEU MD1 . . 5.500 5.421 5.279 5.520 0.020 20 0 "[ . 1 . 2]" 2
700 1 27 GLY HA3 1 34 LEU MD2 . . 5.500 5.300 4.855 5.502 0.002 20 0 "[ . 1 . 2]" 2
701 1 26 ILE MG 1 27 GLY HA3 . . 5.020 4.155 4.016 4.397 . 0 0 "[ . 1 . 2]" 2
702 1 27 GLY HA3 1 28 LEU HG . . 4.660 4.274 4.104 4.400 . 0 0 "[ . 1 . 2]" 2
703 1 27 GLY HA3 1 28 LEU HB2 . . 5.000 4.772 4.670 4.853 . 0 0 "[ . 1 . 2]" 2
704 1 26 ILE MG 1 27 GLY HA2 . . 4.840 4.199 4.039 4.367 . 0 0 "[ . 1 . 2]" 2
705 1 27 GLY HA2 1 28 LEU HG . . 4.120 3.668 3.522 3.844 . 0 0 "[ . 1 . 2]" 2
706 1 27 GLY HA2 1 28 LEU MD1 . . 5.500 5.037 4.901 5.191 . 0 0 "[ . 1 . 2]" 2
707 1 27 GLY HA2 1 34 LEU MD2 . . 5.500 4.489 4.051 4.704 . 0 0 "[ . 1 . 2]" 2
708 1 47 ARG HD2 1 73 GLY H . . 5.500 4.823 4.251 5.508 0.008 4 0 "[ . 1 . 2]" 2
709 1 47 ARG HD3 1 73 GLY H . . 5.500 5.317 3.688 5.548 0.048 15 0 "[ . 1 . 2]" 2
710 1 76 ARG QD 1 77 VAL H . . 5.500 3.896 2.829 4.754 . 0 0 "[ . 1 . 2]" 2
711 1 70 ARG HA 1 70 ARG HD2 . . 4.890 4.392 4.064 4.663 . 0 0 "[ . 1 . 2]" 2
712 1 70 ARG HA 1 70 ARG HD3 . . 4.890 4.168 3.946 4.642 . 0 0 "[ . 1 . 2]" 2
713 1 62 PRO HA 1 65 LYS HE2 . . 5.150 3.150 2.044 5.145 . 0 0 "[ . 1 . 2]" 2
714 1 65 LYS HB3 1 65 LYS HE2 . . 5.500 4.568 3.917 4.813 . 0 0 "[ . 1 . 2]" 2
715 1 65 LYS HB2 1 65 LYS HE2 . . 5.500 4.769 3.212 5.447 . 0 0 "[ . 1 . 2]" 2
716 1 65 LYS HB2 1 65 LYS HE3 . . 5.500 4.582 4.062 4.710 . 0 0 "[ . 1 . 2]" 2
717 1 65 LYS HB3 1 65 LYS HE3 . . 5.500 4.653 4.052 5.484 . 0 0 "[ . 1 . 2]" 2
718 1 29 THR MG 1 33 ASP HB2 . . 4.170 3.145 2.782 4.101 . 0 0 "[ . 1 . 2]" 2
719 1 54 ARG HD2 1 77 VAL MG2 . . 4.770 4.291 3.754 4.784 0.014 3 0 "[ . 1 . 2]" 2
720 1 54 ARG HD2 1 68 TYR QE . . 5.080 4.458 3.981 4.974 . 0 0 "[ . 1 . 2]" 2
721 1 54 ARG H 1 54 ARG HD2 . . 5.500 5.083 4.569 5.324 . 0 0 "[ . 1 . 2]" 2
722 1 54 ARG H 1 54 ARG HD3 . . 5.500 4.136 3.701 4.810 . 0 0 "[ . 1 . 2]" 2
723 1 19 CYS HB3 1 24 ASP HB2 . . 5.410 3.946 3.519 4.599 . 0 0 "[ . 1 . 2]" 2
724 1 18 PHE HB3 1 25 GLN HA . . 4.220 3.085 2.982 3.229 . 0 0 "[ . 1 . 2]" 2
725 1 18 PHE HB2 1 25 GLN HA . . 4.510 4.370 4.290 4.460 . 0 0 "[ . 1 . 2]" 2
726 1 60 ASN HB2 1 65 LYS H . . 5.500 5.467 5.261 5.530 0.030 15 0 "[ . 1 . 2]" 2
727 1 60 ASN HB3 1 65 LYS H . . 5.300 4.800 4.410 5.028 . 0 0 "[ . 1 . 2]" 2
728 1 43 PHE HB2 1 63 GLN HB3 . . 4.120 2.283 2.089 2.412 . 0 0 "[ . 1 . 2]" 2
729 1 43 PHE HB2 1 63 GLN HE21 . . 4.680 3.240 1.902 3.780 . 0 0 "[ . 1 . 2]" 2
730 1 43 PHE HB2 1 64 CYS H . . 5.190 4.464 4.251 4.851 . 0 0 "[ . 1 . 2]" 2
731 1 43 PHE HB2 1 63 GLN H . . 5.150 4.385 4.116 4.793 . 0 0 "[ . 1 . 2]" 2
732 1 43 PHE HB3 1 63 GLN HB2 . . 4.530 4.317 3.803 4.534 0.004 19 0 "[ . 1 . 2]" 2
733 1 42 GLY HA2 1 43 PHE HB3 . . 5.500 5.267 5.144 5.464 . 0 0 "[ . 1 . 2]" 2
734 1 43 PHE HB3 1 44 PRO HD3 . . 5.500 5.040 4.981 5.088 . 0 0 "[ . 1 . 2]" 2
735 1 43 PHE HB3 1 64 CYS H . . 5.500 5.166 4.933 5.412 . 0 0 "[ . 1 . 2]" 2
736 1 13 ASN HB2 1 14 LEU H . . 4.620 3.932 2.057 4.579 . 0 0 "[ . 1 . 2]" 2
737 1 21 ILE HB 1 49 CYS HB3 . . 4.060 3.471 3.358 3.574 . 0 0 "[ . 1 . 2]" 2
738 1 35 PHE QE 1 50 TYR HB2 . . 4.190 3.004 2.405 3.524 . 0 0 "[ . 1 . 2]" 2
739 1 35 PHE HZ 1 50 TYR HB2 . . 4.810 3.810 3.340 4.326 . 0 0 "[ . 1 . 2]" 2
740 1 20 GLU HG3 1 43 PHE QE . . 4.080 3.525 3.081 3.770 . 0 0 "[ . 1 . 2]" 2
741 1 20 GLU H 1 20 GLU HG3 . . 4.360 4.033 3.892 4.136 . 0 0 "[ . 1 . 2]" 2
742 1 20 GLU H 1 20 GLU HG2 . . 4.040 3.295 3.107 3.425 . 0 0 "[ . 1 . 2]" 2
743 1 20 GLU HG2 1 43 PHE QE . . 4.960 4.843 4.512 4.969 0.009 1 0 "[ . 1 . 2]" 2
744 1 20 GLU HG2 1 44 PRO HD2 . . 4.300 4.164 3.833 4.308 0.008 12 0 "[ . 1 . 2]" 2
745 1 52 TYR HA 1 56 GLU QG . . 5.450 5.229 4.458 5.484 0.034 19 0 "[ . 1 . 2]" 2
746 1 52 TYR QE 1 56 GLU QG . . 3.980 3.581 2.196 3.965 . 0 0 "[ . 1 . 2]" 2
747 1 52 TYR QD 1 56 GLU QG . . 4.470 3.870 3.451 4.176 . 0 0 "[ . 1 . 2]" 2
748 1 48 PRO HA 1 50 TYR H . . 5.310 4.647 4.503 4.747 . 0 0 "[ . 1 . 2]" 2
749 1 48 PRO HA 1 52 TYR H . . 5.500 4.020 3.811 4.296 . 0 0 "[ . 1 . 2]" 2
750 1 25 GLN HG2 1 26 ILE HG13 . . 5.500 5.233 5.057 5.357 . 0 0 "[ . 1 . 2]" 2
751 1 25 GLN HG2 1 26 ILE H . . 4.270 3.252 3.050 3.410 . 0 0 "[ . 1 . 2]" 2
752 1 17 GLN HG2 1 18 PHE H . . 5.500 4.932 4.244 5.279 . 0 0 "[ . 1 . 2]" 2
753 1 18 PHE H 1 25 GLN HG2 . . 5.500 5.424 5.283 5.510 0.010 20 0 "[ . 1 . 2]" 2
754 1 25 GLN HG2 1 27 GLY H . . 5.500 4.807 4.401 5.148 . 0 0 "[ . 1 . 2]" 2
755 1 18 PHE QE 1 25 GLN HG2 . . 4.510 4.232 4.029 4.450 . 0 0 "[ . 1 . 2]" 2
756 1 30 VAL HA 1 32 GLY H . . 5.050 4.980 4.567 5.061 0.011 20 0 "[ . 1 . 2]" 2
757 1 21 ILE HA 1 43 PHE HZ . . 4.740 3.430 3.002 3.761 . 0 0 "[ . 1 . 2]" 2
758 1 26 ILE HA 1 46 CYS HB3 . . 4.240 2.921 2.788 3.208 . 0 0 "[ . 1 . 2]" 2
759 1 26 ILE HA 1 46 CYS HB2 . . 4.190 3.324 3.112 3.492 . 0 0 "[ . 1 . 2]" 2
760 1 26 ILE HA 1 27 GLY HA2 . . 4.490 4.416 4.391 4.481 . 0 0 "[ . 1 . 2]" 2
761 1 26 ILE HA 1 46 CYS HA . . 4.210 3.099 2.961 3.199 . 0 0 "[ . 1 . 2]" 2
762 1 18 PHE HA 1 26 ILE HA . . 4.970 4.876 4.767 4.982 0.012 17 0 "[ . 1 . 2]" 2
763 1 26 ILE HA 1 27 GLY HA3 . . 4.420 4.390 4.381 4.419 . 0 0 "[ . 1 . 2]" 2
764 1 26 ILE MG 1 46 CYS HB2 . . 4.610 3.930 3.806 4.127 . 0 0 "[ . 1 . 2]" 2
765 1 26 ILE HG12 1 46 CYS HB2 . . 5.040 3.614 3.465 3.721 . 0 0 "[ . 1 . 2]" 2
766 1 46 CYS HB2 1 48 PRO HD3 . . 4.200 3.523 3.461 3.575 . 0 0 "[ . 1 . 2]" 2
767 1 48 PRO HB2 1 49 CYS H . . 4.630 4.132 4.076 4.183 . 0 0 "[ . 1 . 2]" 2
768 1 58 THR HA 1 59 GLN HG3 . . 4.430 3.645 3.246 4.001 . 0 0 "[ . 1 . 2]" 2
769 1 58 THR HA 1 60 ASN H . . 5.230 4.746 4.472 5.027 . 0 0 "[ . 1 . 2]" 2
770 1 52 TYR HA 1 55 ARG H . . 4.380 2.985 2.843 3.168 . 0 0 "[ . 1 . 2]" 2
771 1 52 TYR HA 1 56 GLU H . . 4.710 3.327 2.971 3.650 . 0 0 "[ . 1 . 2]" 2
772 1 20 GLU HB3 1 44 PRO HD2 . . 4.770 4.596 4.337 4.757 . 0 0 "[ . 1 . 2]" 2
773 1 19 CYS HB2 1 26 ILE HG12 . . 4.390 2.289 2.141 2.371 . 0 0 "[ . 1 . 2]" 2
774 1 19 CYS HA 1 26 ILE HG12 . . 4.250 3.582 3.479 3.661 . 0 0 "[ . 1 . 2]" 2
775 1 26 ILE HG12 1 46 CYS HA . . 3.960 2.068 1.997 2.213 . 0 0 "[ . 1 . 2]" 2
776 1 26 ILE HG12 1 27 GLY H . . 5.020 4.528 4.445 4.704 . 0 0 "[ . 1 . 2]" 2
777 1 19 CYS H 1 26 ILE HG12 . . 4.100 3.358 3.201 3.423 . 0 0 "[ . 1 . 2]" 2
778 1 26 ILE HG13 1 46 CYS H . . 4.580 4.050 3.848 4.307 . 0 0 "[ . 1 . 2]" 2
779 1 26 ILE HG13 1 27 GLY H . . 5.400 5.084 5.030 5.128 . 0 0 "[ . 1 . 2]" 2
780 1 19 CYS HA 1 26 ILE HG13 . . 4.490 2.898 2.794 3.009 . 0 0 "[ . 1 . 2]" 2
781 1 26 ILE HG13 1 46 CYS HB2 . . 5.090 4.964 4.845 5.097 0.007 10 0 "[ . 1 . 2]" 2
782 1 47 ARG HA 1 50 TYR HB2 . . 4.690 4.612 4.291 4.728 0.038 10 0 "[ . 1 . 2]" 2
783 1 35 PHE HZ 1 47 ARG HA . . 4.120 3.004 2.334 3.391 . 0 0 "[ . 1 . 2]" 2
784 1 35 PHE QD 1 47 ARG HA . . 4.420 3.767 3.239 4.063 . 0 0 "[ . 1 . 2]" 2
785 1 47 ARG HA 1 50 TYR H . . 4.240 3.503 3.452 3.546 . 0 0 "[ . 1 . 2]" 2
786 1 47 ARG HA 1 51 GLU H . . 5.060 3.767 3.403 4.155 . 0 0 "[ . 1 . 2]" 2
787 1 25 GLN HB2 1 26 ILE H . . 4.490 4.341 4.271 4.401 . 0 0 "[ . 1 . 2]" 2
788 1 18 PHE QE 1 25 GLN HB3 . . 4.080 3.798 3.668 3.906 . 0 0 "[ . 1 . 2]" 2
789 1 54 ARG HG3 1 77 VAL MG2 . . 4.840 4.227 3.611 4.838 . 0 0 "[ . 1 . 2]" 2
790 1 26 ILE MD 1 44 PRO HG2 . . 4.390 4.385 4.285 4.419 0.029 10 0 "[ . 1 . 2]" 2
791 1 20 GLU H 1 21 ILE HG12 . . 5.200 5.185 5.107 5.215 0.015 8 0 "[ . 1 . 2]" 2
792 1 55 ARG H 1 55 ARG HG2 . . 4.620 4.352 4.154 4.606 . 0 0 "[ . 1 . 2]" 2
793 1 20 GLU H 1 21 ILE HG13 . . 5.200 3.572 3.518 3.647 . 0 0 "[ . 1 . 2]" 2
794 1 54 ARG HA 1 54 ARG HG3 . . 4.040 2.661 2.368 3.150 . 0 0 "[ . 1 . 2]" 2
795 1 54 ARG HA 1 77 VAL MG2 . . 4.150 3.604 3.250 3.935 . 0 0 "[ . 1 . 2]" 2
796 1 43 PHE QE 1 62 PRO HG2 . . 4.050 2.193 1.984 2.529 . 0 0 "[ . 1 . 2]" 2
797 1 62 PRO HG2 1 63 GLN H . . 5.130 3.394 3.345 3.442 . 0 0 "[ . 1 . 2]" 2
798 1 73 GLY H 1 74 SER HA . . 5.390 5.119 4.760 5.381 . 0 0 "[ . 1 . 2]" 2
799 1 70 ARG HA 1 74 SER HG . . 4.750 3.647 2.389 4.798 0.048 9 0 "[ . 1 . 2]" 2
800 1 69 LYS QG 1 70 ARG HA . . 5.110 4.538 4.216 5.252 0.142 7 0 "[ . 1 . 2]" 2
801 1 70 ARG HA 1 71 LEU HG . . 5.310 4.020 3.601 4.295 . 0 0 "[ . 1 . 2]" 2
802 1 29 THR MG 1 35 PHE QE . . 4.710 3.983 3.719 4.208 . 0 0 "[ . 1 . 2]" 2
803 1 70 ARG HA 1 71 LEU MD2 . . 5.280 4.489 3.392 4.788 . 0 0 "[ . 1 . 2]" 2
804 1 35 PHE QE 1 71 LEU MD2 . . 4.570 4.248 3.585 4.514 . 0 0 "[ . 1 . 2]" 2
805 1 43 PHE QD 1 44 PRO HD3 . . 4.030 3.551 3.355 3.780 . 0 0 "[ . 1 . 2]" 2
806 1 43 PHE H 1 44 PRO HD3 . . 4.930 4.634 4.411 4.748 . 0 0 "[ . 1 . 2]" 2
807 1 62 PRO HD2 1 68 TYR HH . . 4.700 3.472 2.699 4.384 . 0 0 "[ . 1 . 2]" 2
808 1 20 GLU H 1 44 PRO HD2 . . 5.240 4.627 4.491 4.788 . 0 0 "[ . 1 . 2]" 2
809 1 43 PHE H 1 44 PRO HD2 . . 4.900 4.763 4.574 4.812 . 0 0 "[ . 1 . 2]" 2
810 1 43 PHE HB2 1 44 PRO HD2 . . 5.140 3.993 3.856 4.092 . 0 0 "[ . 1 . 2]" 2
811 1 21 ILE MG 1 43 PHE QE . . 4.890 4.273 3.938 4.739 . 0 0 "[ . 1 . 2]" 2
812 1 47 ARG HB3 1 48 PRO HD2 . . 4.330 2.952 2.628 3.590 . 0 0 "[ . 1 . 2]" 2
813 1 47 ARG HB3 1 48 PRO HD3 . . 4.050 1.917 1.788 2.642 . 0 0 "[ . 1 . 2]" 2
814 1 9 LYS QD 1 10 PRO HD2 . . 5.500 3.543 1.981 4.928 . 0 0 "[ . 1 . 2]" 2
815 1 9 LYS QD 1 10 PRO HD3 . . 5.500 4.497 3.037 5.570 0.070 18 0 "[ . 1 . 2]" 2
816 1 12 LYS HA 1 12 LYS QD . . 3.320 2.681 1.976 3.474 0.154 12 0 "[ . 1 . 2]" 2
817 1 12 LYS HA 1 12 LYS QE . . 5.220 4.138 3.355 4.686 . 0 0 "[ . 1 . 2]" 2
818 1 63 GLN H 1 63 GLN HG2 . . 4.350 4.336 4.295 4.361 0.011 14 0 "[ . 1 . 2]" 2
819 1 59 GLN HG3 1 60 ASN H . . 5.500 4.718 4.511 4.821 . 0 0 "[ . 1 . 2]" 2
820 1 19 CYS HA 1 44 PRO HG2 . . 5.500 3.619 3.490 3.765 . 0 0 "[ . 1 . 2]" 2
821 1 19 CYS HB3 1 45 ALA HA . . 4.890 4.521 4.442 4.583 . 0 0 "[ . 1 . 2]" 2
822 1 19 CYS HB3 1 46 CYS HA . . 5.210 5.121 4.930 5.212 0.002 4 0 "[ . 1 . 2]" 2
823 1 19 CYS HB3 1 20 GLU H . . 4.460 3.899 3.810 3.976 . 0 0 "[ . 1 . 2]" 2
824 1 19 CYS HB2 1 20 GLU H . . 4.540 3.887 3.763 3.963 . 0 0 "[ . 1 . 2]" 2
825 1 41 CYS H 1 64 CYS HB3 . . 5.020 4.253 4.045 4.366 . 0 0 "[ . 1 . 2]" 2
826 1 19 CYS HB2 1 23 GLY H . . 4.530 4.278 4.186 4.368 . 0 0 "[ . 1 . 2]" 2
827 1 19 CYS HA 1 20 GLU HA . . 4.390 4.368 4.362 4.377 . 0 0 "[ . 1 . 2]" 2
828 1 20 GLU HB2 1 43 PHE QE . . 3.710 2.888 2.722 3.151 . 0 0 "[ . 1 . 2]" 2
829 1 80 ASP HA 1 81 GLU HB2 . . 5.500 4.611 4.064 5.194 . 0 0 "[ . 1 . 2]" 2
830 1 21 ILE MG 1 22 CYS HB2 . . 4.540 4.522 4.435 4.560 0.020 8 0 "[ . 1 . 2]" 2
831 1 22 CYS HB2 1 23 GLY H . . 5.270 3.683 3.595 3.769 . 0 0 "[ . 1 . 2]" 2
832 1 22 CYS HB2 1 24 ASP H . . 4.920 3.521 3.427 3.607 . 0 0 "[ . 1 . 2]" 2
833 1 22 CYS HB3 1 24 ASP H . . 5.030 4.571 4.515 4.629 . 0 0 "[ . 1 . 2]" 2
834 1 41 CYS HB2 1 43 PHE H . . 5.420 4.678 3.456 4.919 . 0 0 "[ . 1 . 2]" 2
835 1 41 CYS HB2 1 64 CYS HA . . 5.080 5.009 4.724 5.126 0.046 15 0 "[ . 1 . 2]" 2
836 1 18 PHE HB3 1 23 GLY HA3 . . 5.500 5.408 5.128 5.490 . 0 0 "[ . 1 . 2]" 2
837 1 22 CYS H 1 23 GLY HA3 . . 5.030 4.893 4.829 4.943 . 0 0 "[ . 1 . 2]" 2
838 1 19 CYS HB3 1 23 GLY HA2 . . 5.050 3.916 3.770 4.082 . 0 0 "[ . 1 . 2]" 2
839 1 18 PHE HA 1 25 GLN HA . . 3.370 1.987 1.967 2.025 . 0 0 "[ . 1 . 2]" 2
840 1 19 CYS H 1 25 GLN HA . . 4.240 2.856 2.764 3.031 . 0 0 "[ . 1 . 2]" 2
841 1 18 PHE QD 1 25 GLN HA . . 3.620 2.383 2.273 2.526 . 0 0 "[ . 1 . 2]" 2
842 1 18 PHE QE 1 25 GLN HA . . 4.200 4.145 4.042 4.218 0.018 7 0 "[ . 1 . 2]" 2
843 1 25 GLN HA 1 26 ILE HB . . 4.600 4.610 4.595 4.623 0.023 13 0 "[ . 1 . 2]" 2
844 1 25 GLN HA 1 26 ILE HG13 . . 4.790 3.838 3.803 3.873 . 0 0 "[ . 1 . 2]" 2
845 1 24 ASP HA 1 25 GLN HB2 . . 4.840 4.494 4.402 4.583 . 0 0 "[ . 1 . 2]" 2
846 1 18 PHE QD 1 25 GLN HB2 . . 4.180 2.045 2.006 2.151 . 0 0 "[ . 1 . 2]" 2
847 1 25 GLN HB3 1 26 ILE H . . 4.510 4.318 4.202 4.379 . 0 0 "[ . 1 . 2]" 2
848 1 18 PHE QD 1 25 GLN HB3 . . 4.330 3.687 3.610 3.812 . 0 0 "[ . 1 . 2]" 2
849 1 24 ASP HA 1 25 GLN HB3 . . 4.960 4.744 4.632 4.872 . 0 0 "[ . 1 . 2]" 2
850 1 18 PHE QD 1 25 GLN HG3 . . 4.480 2.852 2.619 3.123 . 0 0 "[ . 1 . 2]" 2
851 1 18 PHE QE 1 25 GLN HG3 . . 4.720 2.898 2.731 3.203 . 0 0 "[ . 1 . 2]" 2
852 1 19 CYS HB2 1 26 ILE HB . . 5.420 4.776 4.593 4.968 . 0 0 "[ . 1 . 2]" 2
853 1 26 ILE HB 1 35 PHE HB3 . . 5.500 4.655 4.356 4.828 . 0 0 "[ . 1 . 2]" 2
854 1 26 ILE HB 1 46 CYS HA . . 4.740 4.472 4.330 4.631 . 0 0 "[ . 1 . 2]" 2
855 1 26 ILE HB 1 35 PHE QD . . 5.490 5.220 4.825 5.494 0.004 6 0 "[ . 1 . 2]" 2
856 1 17 GLN QB 1 26 ILE MG . . 4.220 4.060 3.787 4.222 0.002 8 0 "[ . 1 . 2]" 2
857 1 26 ILE MG 1 36 VAL HA . . 5.500 4.348 3.656 4.822 . 0 0 "[ . 1 . 2]" 2
858 1 26 ILE MG 1 35 PHE HA . . 4.560 4.270 4.027 4.453 . 0 0 "[ . 1 . 2]" 2
859 1 19 CYS HA 1 26 ILE MG . . 5.230 5.000 4.923 5.063 . 0 0 "[ . 1 . 2]" 2
860 1 26 ILE MG 1 34 LEU HA . . 4.610 4.225 3.947 4.495 . 0 0 "[ . 1 . 2]" 2
861 1 17 GLN HA 1 26 ILE MG . . 5.130 4.735 4.503 4.883 . 0 0 "[ . 1 . 2]" 2
862 1 26 ILE MG 1 44 PRO HA . . 5.500 4.908 4.762 5.286 . 0 0 "[ . 1 . 2]" 2
863 1 26 ILE MG 1 28 LEU HA . . 5.500 4.271 4.078 4.388 . 0 0 "[ . 1 . 2]" 2
864 1 26 ILE MG 1 35 PHE QE . . 4.620 4.271 3.846 4.501 . 0 0 "[ . 1 . 2]" 2
865 1 26 ILE MD 1 46 CYS HB2 . . 4.990 4.917 4.803 5.001 0.011 7 0 "[ . 1 . 2]" 2
866 1 26 ILE MD 1 35 PHE QE . . 5.500 4.808 4.381 5.184 . 0 0 "[ . 1 . 2]" 2
867 1 18 PHE H 1 26 ILE MD . . 4.800 4.715 4.636 4.803 0.003 4 0 "[ . 1 . 2]" 2
868 1 28 LEU HA 1 29 THR MG . . 4.000 3.590 3.293 3.824 . 0 0 "[ . 1 . 2]" 2
869 1 28 LEU HA 1 35 PHE HB2 . . 4.540 3.700 3.373 3.963 . 0 0 "[ . 1 . 2]" 2
870 1 28 LEU HA 1 35 PHE HB3 . . 4.980 4.395 3.958 4.630 . 0 0 "[ . 1 . 2]" 2
871 1 27 GLY HA2 1 28 LEU HB2 . . 5.130 5.065 4.987 5.131 0.001 14 0 "[ . 1 . 2]" 2
872 1 28 LEU HB2 1 32 GLY H . . 5.270 5.105 4.878 5.266 . 0 0 "[ . 1 . 2]" 2
873 1 28 LEU HG 1 29 THR H . . 5.050 4.851 4.781 4.970 . 0 0 "[ . 1 . 2]" 2
874 1 28 LEU HA 1 28 LEU MD1 . . 4.290 3.888 3.867 3.916 . 0 0 "[ . 1 . 2]" 2
875 1 28 LEU MD2 1 33 ASP HB3 . . 5.500 5.148 4.472 5.401 . 0 0 "[ . 1 . 2]" 2
876 1 28 LEU MD2 1 35 PHE HB2 . . 5.500 5.115 4.942 5.278 . 0 0 "[ . 1 . 2]" 2
877 1 28 LEU MD2 1 33 ASP HB2 . . 5.500 5.288 4.781 5.529 0.029 20 0 "[ . 1 . 2]" 2
878 1 28 LEU MD2 1 35 PHE HB3 . . 5.500 5.424 5.087 5.516 0.016 15 0 "[ . 1 . 2]" 2
879 1 28 LEU MD2 1 32 GLY H . . 5.290 5.118 4.897 5.253 . 0 0 "[ . 1 . 2]" 2
880 1 28 LEU MD2 1 34 LEU H . . 4.410 3.601 2.777 3.910 . 0 0 "[ . 1 . 2]" 2
881 1 29 THR HA 1 35 PHE QD . . 4.430 3.363 2.747 3.957 . 0 0 "[ . 1 . 2]" 2
882 1 29 THR MG 1 34 LEU MD1 . . 4.530 4.135 3.923 4.320 . 0 0 "[ . 1 . 2]" 2
883 1 28 LEU MD2 1 29 THR MG . . 4.740 4.326 4.116 4.512 . 0 0 "[ . 1 . 2]" 2
884 1 29 THR HB 1 30 VAL HB . . 4.920 4.114 3.927 4.724 . 0 0 "[ . 1 . 2]" 2
885 1 30 VAL HB 1 31 GLU H . . 4.390 2.907 2.577 4.050 . 0 0 "[ . 1 . 2]" 2
886 1 31 GLU HB3 1 32 GLY H . . 4.450 3.229 2.255 3.680 . 0 0 "[ . 1 . 2]" 2
887 1 31 GLU HB3 1 33 ASP H . . 4.700 3.683 2.610 4.410 . 0 0 "[ . 1 . 2]" 2
888 1 28 LEU HB3 1 32 GLY HA2 . . 4.310 2.575 2.290 2.807 . 0 0 "[ . 1 . 2]" 2
889 1 34 LEU HA 1 35 PHE HB2 . . 4.560 4.522 4.459 4.574 0.014 2 0 "[ . 1 . 2]" 2
890 1 34 LEU HB3 1 35 PHE H . . 4.510 4.034 3.843 4.140 . 0 0 "[ . 1 . 2]" 2
891 1 34 LEU H 1 34 LEU HG . . 4.640 4.574 4.497 4.638 . 0 0 "[ . 1 . 2]" 2
892 1 17 GLN HE21 1 34 LEU MD1 . . 5.400 4.251 3.124 5.304 . 0 0 "[ . 1 . 2]" 2
893 1 17 GLN HE22 1 34 LEU MD1 . . 5.400 4.585 1.881 5.401 0.001 2 0 "[ . 1 . 2]" 2
894 1 17 GLN HA 1 34 LEU MD1 . . 4.340 3.598 3.108 4.032 . 0 0 "[ . 1 . 2]" 2
895 1 34 LEU MD2 1 35 PHE HB3 . . 4.470 4.130 3.806 4.276 . 0 0 "[ . 1 . 2]" 2
896 1 34 LEU MD2 1 35 PHE HA . . 5.350 4.967 4.525 5.174 . 0 0 "[ . 1 . 2]" 2
897 1 17 GLN HE21 1 34 LEU MD2 . . 5.220 3.257 2.366 4.548 . 0 0 "[ . 1 . 2]" 2
898 1 34 LEU MD2 1 35 PHE QD . . 5.500 5.408 5.063 5.525 0.025 15 0 "[ . 1 . 2]" 2
899 1 17 GLN HE22 1 34 LEU MD2 . . 5.220 3.414 2.748 4.731 . 0 0 "[ . 1 . 2]" 2
900 1 28 LEU HA 1 35 PHE HA . . 5.500 4.904 4.482 5.187 . 0 0 "[ . 1 . 2]" 2
901 1 29 THR HB 1 35 PHE HA . . 4.770 4.536 4.249 4.777 0.007 1 0 "[ . 1 . 2]" 2
902 1 34 LEU HA 1 35 PHE HA . . 4.720 4.358 4.344 4.368 . 0 0 "[ . 1 . 2]" 2
903 1 34 LEU MD1 1 35 PHE HA . . 4.480 3.560 3.410 3.726 . 0 0 "[ . 1 . 2]" 2
904 1 34 LEU HA 1 35 PHE HB3 . . 4.770 4.652 4.593 4.732 . 0 0 "[ . 1 . 2]" 2
905 1 29 THR HB 1 35 PHE HB2 . . 5.070 4.693 4.305 5.050 . 0 0 "[ . 1 . 2]" 2
906 1 34 LEU MD2 1 35 PHE HB2 . . 5.030 4.733 4.372 4.991 . 0 0 "[ . 1 . 2]" 2
907 1 29 THR HB 1 35 PHE QD . . 3.970 3.736 3.227 3.970 . 4 0 "[ . 1 . 2]" 2
908 1 35 PHE QD 1 37 ALA H . . 5.210 3.491 2.937 4.341 . 0 0 "[ . 1 . 2]" 2
909 1 29 THR HB 1 35 PHE QE . . 5.430 5.288 4.676 5.453 0.023 15 0 "[ . 1 . 2]" 2
910 1 35 PHE HZ 1 71 LEU MD1 . . 3.910 2.428 2.039 3.079 . 0 0 "[ . 1 . 2]" 2
911 1 35 PHE HZ 1 37 ALA MB . . 4.110 3.858 3.341 4.113 0.003 11 0 "[ . 1 . 2]" 2
912 1 36 VAL HA 1 37 ALA MB . . 4.100 4.009 3.945 4.091 . 0 0 "[ . 1 . 2]" 2
913 1 36 VAL HB 1 37 ALA H . . 5.160 4.482 4.420 4.552 . 0 0 "[ . 1 . 2]" 2
914 1 35 PHE HA 1 36 VAL HB . . 4.890 4.758 4.671 4.962 0.072 10 0 "[ . 1 . 2]" 2
915 1 35 PHE QE 1 37 ALA HA . . 4.150 3.512 2.739 4.062 . 0 0 "[ . 1 . 2]" 2
916 1 35 PHE QD 1 37 ALA HA . . 5.240 4.360 3.796 4.838 . 0 0 "[ . 1 . 2]" 2
917 1 36 VAL H 1 37 ALA HA . . 5.500 5.010 4.719 5.165 . 0 0 "[ . 1 . 2]" 2
918 1 35 PHE HZ 1 37 ALA HA . . 4.580 3.882 3.500 4.213 . 0 0 "[ . 1 . 2]" 2
919 1 36 VAL HA 1 37 ALA HA . . 4.840 4.553 4.490 4.602 . 0 0 "[ . 1 . 2]" 2
920 1 37 ALA HA 1 50 TYR HB2 . . 5.300 3.747 3.465 4.221 . 0 0 "[ . 1 . 2]" 2
921 1 37 ALA HA 1 71 LEU MD2 . . 4.560 4.123 3.557 4.572 0.012 16 0 "[ . 1 . 2]" 2
922 1 37 ALA MB 1 50 TYR HA . . 4.440 3.917 3.547 4.352 . 0 0 "[ . 1 . 2]" 2
923 1 37 ALA MB 1 45 ALA HA . . 5.500 4.002 3.770 4.242 . 0 0 "[ . 1 . 2]" 2
924 1 37 ALA MB 1 38 CYS QB . . 4.350 3.161 3.036 3.282 . 0 0 "[ . 1 . 2]" 2
925 1 38 CYS QB 1 61 CYS HB3 . . 5.000 4.813 4.499 5.010 0.010 14 0 "[ . 1 . 2]" 2
926 1 38 CYS QB 1 42 GLY HA3 . . 5.440 4.869 4.528 5.292 . 0 0 "[ . 1 . 2]" 2
927 1 38 CYS QB 1 61 CYS HA . . 5.500 4.835 4.530 5.050 . 0 0 "[ . 1 . 2]" 2
928 1 38 CYS QB 1 42 GLY HA2 . . 4.590 3.654 3.220 4.229 . 0 0 "[ . 1 . 2]" 2
929 1 38 CYS QB 1 43 PHE HB2 . . 5.140 3.562 3.239 4.178 . 0 0 "[ . 1 . 2]" 2
930 1 38 CYS QB 1 50 TYR HE2 . . 4.920 4.535 4.238 4.928 0.008 10 0 "[ . 1 . 2]" 2
931 1 38 CYS QB 1 50 TYR HD2 . . 4.680 4.249 3.894 4.683 0.003 11 0 "[ . 1 . 2]" 2
932 1 38 CYS QB 1 41 CYS H . . 4.770 4.008 3.659 4.188 . 0 0 "[ . 1 . 2]" 2
933 1 54 ARG HG2 1 68 TYR HB3 . . 4.560 3.554 3.107 4.147 . 0 0 "[ . 1 . 2]" 2
934 1 39 ASN QB 1 40 GLU HA . . 5.120 4.096 3.835 4.423 . 0 0 "[ . 1 . 2]" 2
935 1 40 GLU HB2 1 66 THR MG . . 4.420 3.190 2.341 3.828 . 0 0 "[ . 1 . 2]" 2
936 1 40 GLU HG3 1 41 CYS H . . 4.620 4.112 2.769 4.627 0.007 15 0 "[ . 1 . 2]" 2
937 1 40 GLU H 1 40 GLU HG3 . . 4.650 4.093 3.203 4.597 . 0 0 "[ . 1 . 2]" 2
938 1 41 CYS HB3 1 63 GLN HG2 . . 5.070 3.628 3.289 3.957 . 0 0 "[ . 1 . 2]" 2
939 1 41 CYS HB3 1 64 CYS H . . 5.270 4.540 4.317 4.691 . 0 0 "[ . 1 . 2]" 2
940 1 41 CYS H 1 42 GLY HA2 . . 4.730 4.448 4.369 4.635 . 0 0 "[ . 1 . 2]" 2
941 1 41 CYS H 1 42 GLY HA3 . . 5.000 4.850 4.780 5.010 0.010 16 0 "[ . 1 . 2]" 2
942 1 43 PHE HB2 1 63 GLN HG3 . . 4.700 4.396 3.846 4.547 . 0 0 "[ . 1 . 2]" 2
943 1 43 PHE HB2 1 44 PRO HD3 . . 4.910 4.797 4.712 4.854 . 0 0 "[ . 1 . 2]" 2
944 1 43 PHE HB2 1 63 GLN HG2 . . 4.040 3.277 2.870 3.457 . 0 0 "[ . 1 . 2]" 2
945 1 20 GLU HB2 1 43 PHE QD . . 4.780 4.013 3.822 4.291 . 0 0 "[ . 1 . 2]" 2
946 1 43 PHE QD 1 61 CYS HA . . 4.630 4.193 3.809 4.644 0.014 5 0 "[ . 1 . 2]" 2
947 1 44 PRO HA 1 45 ALA HA . . 5.110 4.396 4.382 4.506 . 0 0 "[ . 1 . 2]" 2
948 1 20 GLU H 1 44 PRO HB2 . . 4.380 2.850 2.666 3.007 . 0 0 "[ . 1 . 2]" 2
949 1 19 CYS HA 1 44 PRO HB3 . . 3.770 3.660 3.610 3.720 . 0 0 "[ . 1 . 2]" 2
950 1 56 GLU HB3 1 57 GLY H . . 4.130 3.774 3.510 4.163 0.033 13 0 "[ . 1 . 2]" 2
951 1 52 TYR QD 1 55 ARG HB2 . . 5.410 4.567 3.680 5.235 . 0 0 "[ . 1 . 2]" 2
952 1 20 GLU H 1 44 PRO HG3 . . 4.600 4.177 4.030 4.302 . 0 0 "[ . 1 . 2]" 2
953 1 16 GLY HA2 1 44 PRO HG3 . . 5.070 4.873 4.637 5.073 0.003 3 0 "[ . 1 . 2]" 2
954 1 20 GLU HB3 1 44 PRO HG3 . . 4.850 4.734 4.585 4.844 . 0 0 "[ . 1 . 2]" 2
955 1 26 ILE MD 1 44 PRO HG3 . . 4.800 4.636 4.549 4.714 . 0 0 "[ . 1 . 2]" 2
956 1 26 ILE MD 1 45 ALA HA . . 4.270 3.300 3.025 3.444 . 0 0 "[ . 1 . 2]" 2
957 1 19 CYS HB2 1 45 ALA HA . . 4.410 3.384 3.239 3.459 . 0 0 "[ . 1 . 2]" 2
958 1 45 ALA HA 1 49 CYS HB2 . . 5.070 3.632 3.514 3.726 . 0 0 "[ . 1 . 2]" 2
959 1 45 ALA HA 1 49 CYS HB3 . . 5.430 3.595 3.422 3.735 . 0 0 "[ . 1 . 2]" 2
960 1 45 ALA MB 1 50 TYR HB3 . . 4.590 3.892 3.654 4.253 . 0 0 "[ . 1 . 2]" 2
961 1 19 CYS HA 1 45 ALA MB . . 4.930 4.777 4.628 4.888 . 0 0 "[ . 1 . 2]" 2
962 1 35 PHE QE 1 45 ALA MB . . 4.740 3.820 3.202 4.338 . 0 0 "[ . 1 . 2]" 2
963 1 43 PHE QE 1 45 ALA MB . . 3.990 3.256 2.448 3.821 . 0 0 "[ . 1 . 2]" 2
964 1 43 PHE QD 1 45 ALA MB . . 4.040 2.991 2.537 3.610 . 0 0 "[ . 1 . 2]" 2
965 1 20 GLU H 1 45 ALA MB . . 4.790 4.468 4.272 4.568 . 0 0 "[ . 1 . 2]" 2
966 1 45 ALA MB 1 49 CYS H . . 5.500 4.512 4.388 4.655 . 0 0 "[ . 1 . 2]" 2
967 1 27 GLY H 1 46 CYS HB2 . . 5.500 4.104 3.854 4.392 . 0 0 "[ . 1 . 2]" 2
968 1 26 ILE MG 1 46 CYS HB3 . . 4.510 3.848 3.703 4.078 . 0 0 "[ . 1 . 2]" 2
969 1 26 ILE HG12 1 46 CYS HB3 . . 4.840 2.492 2.301 2.595 . 0 0 "[ . 1 . 2]" 2
970 1 46 CYS HB3 1 48 PRO HD3 . . 5.280 5.231 5.180 5.286 0.006 7 0 "[ . 1 . 2]" 2
971 1 46 CYS HB3 1 48 PRO HD2 . . 4.320 3.590 3.550 3.628 . 0 0 "[ . 1 . 2]" 2
972 1 21 ILE MG 1 49 CYS HA . . 5.500 4.170 3.984 4.343 . 0 0 "[ . 1 . 2]" 2
973 1 21 ILE MD 1 49 CYS HA . . 5.220 3.662 3.409 3.964 . 0 0 "[ . 1 . 2]" 2
974 1 45 ALA MB 1 49 CYS HA . . 5.500 4.744 4.543 5.011 . 0 0 "[ . 1 . 2]" 2
975 1 45 ALA MB 1 50 TYR HA . . 3.970 3.420 3.304 3.596 . 0 0 "[ . 1 . 2]" 2
976 1 50 TYR HA 1 53 GLU HB2 . . 4.320 3.147 2.701 3.984 . 0 0 "[ . 1 . 2]" 2
977 1 50 TYR HA 1 53 GLU H . . 4.810 3.612 3.311 4.080 . 0 0 "[ . 1 . 2]" 2
978 1 37 ALA MB 1 50 TYR HB3 . . 3.950 3.144 2.863 3.584 . 0 0 "[ . 1 . 2]" 2
979 1 35 PHE HZ 1 50 TYR HB3 . . 4.680 2.569 2.137 3.125 . 0 0 "[ . 1 . 2]" 2
980 1 35 PHE QE 1 50 TYR HB3 . . 4.260 2.572 2.102 3.262 . 0 0 "[ . 1 . 2]" 2
981 1 51 GLU HA 1 55 ARG H . . 4.970 4.474 4.223 4.751 . 0 0 "[ . 1 . 2]" 2
982 1 51 GLU HG2 1 73 GLY H . . 5.500 5.236 4.908 5.508 0.008 11 0 "[ . 1 . 2]" 2
983 1 51 GLU HG3 1 73 GLY H . . 5.500 5.351 4.780 5.536 0.036 4 0 "[ . 1 . 2]" 2
984 1 51 GLU H 1 51 GLU HG3 . . 4.040 3.008 2.065 3.964 . 0 0 "[ . 1 . 2]" 2
985 1 52 TYR HA 1 56 GLU HB2 . . 5.200 4.631 4.083 5.206 0.006 7 0 "[ . 1 . 2]" 2
986 1 52 TYR HA 1 52 TYR QE . . 4.960 4.846 4.517 5.000 0.040 6 0 "[ . 1 . 2]" 2
987 1 52 TYR QD 1 56 GLU HB2 . . 4.790 2.722 2.073 3.192 . 0 0 "[ . 1 . 2]" 2
988 1 52 TYR QD 1 56 GLU HB3 . . 4.680 4.319 3.412 4.689 0.009 14 0 "[ . 1 . 2]" 2
989 1 49 CYS HA 1 52 TYR QD . . 4.220 3.574 3.081 4.183 . 0 0 "[ . 1 . 2]" 2
990 1 52 TYR QD 1 53 GLU H . . 4.240 3.160 2.494 3.856 . 0 0 "[ . 1 . 2]" 2
991 1 52 TYR QE 1 56 GLU HB3 . . 3.870 2.878 1.996 3.354 . 0 0 "[ . 1 . 2]" 2
992 1 53 GLU HB3 1 59 GLN H . . 5.500 4.441 4.044 5.097 . 0 0 "[ . 1 . 2]" 2
993 1 50 TYR HA 1 53 GLU HG2 . . 4.590 4.380 4.125 4.573 . 0 0 "[ . 1 . 2]" 2
994 1 53 GLU HG2 1 58 THR H . . 4.860 4.538 4.139 4.799 . 0 0 "[ . 1 . 2]" 2
995 1 53 GLU HG3 1 59 GLN HA . . 4.820 2.989 2.271 3.879 . 0 0 "[ . 1 . 2]" 2
996 1 53 GLU HG3 1 57 GLY HA3 . . 5.150 3.221 2.874 3.503 . 0 0 "[ . 1 . 2]" 2
997 1 54 ARG HA 1 59 GLN HB2 . . 4.450 4.328 3.960 4.473 0.023 18 0 "[ . 1 . 2]" 2
998 1 55 ARG HA 1 55 ARG HD3 . . 4.750 3.573 2.017 4.906 0.156 17 0 "[ . 1 . 2]" 2
999 1 56 GLU HB2 1 57 GLY H . . 4.030 3.161 2.844 3.863 . 0 0 "[ . 1 . 2]" 2
1000 1 52 TYR QE 1 56 GLU HB2 . . 4.100 2.115 1.985 2.354 . 0 0 "[ . 1 . 2]" 2
1001 1 53 GLU HA 1 57 GLY HA2 . . 3.600 3.524 3.437 3.613 0.013 8 0 "[ . 1 . 2]" 2
1002 1 57 GLY HA3 1 58 THR HA . . 5.300 4.431 4.407 4.451 . 0 0 "[ . 1 . 2]" 2
1003 1 57 GLY HA2 1 58 THR HA . . 5.360 4.412 4.381 4.442 . 0 0 "[ . 1 . 2]" 2
1004 1 58 THR HB 1 60 ASN HB2 . . 4.490 4.134 3.898 4.454 . 0 0 "[ . 1 . 2]" 2
1005 1 58 THR HB 1 60 ASN HD22 . . 4.400 2.456 1.902 3.585 . 0 0 "[ . 1 . 2]" 2
1006 1 58 THR HB 1 60 ASN HD21 . . 4.400 2.517 2.048 3.332 . 0 0 "[ . 1 . 2]" 2
1007 1 58 THR HB 1 59 GLN H . . 5.150 4.319 4.141 4.460 . 0 0 "[ . 1 . 2]" 2
1008 1 57 GLY HA3 1 58 THR MG . . 4.440 4.079 3.860 4.253 . 0 0 "[ . 1 . 2]" 2
1009 1 58 THR MG 1 60 ASN HD22 . . 5.250 4.032 3.519 5.051 . 0 0 "[ . 1 . 2]" 2
1010 1 54 ARG HG3 1 59 GLN HA . . 5.410 2.868 2.160 3.903 . 0 0 "[ . 1 . 2]" 2
1011 1 54 ARG HG2 1 59 GLN HA . . 4.240 3.180 2.379 3.930 . 0 0 "[ . 1 . 2]" 2
1012 1 58 THR H 1 59 GLN HA . . 5.170 4.398 4.275 4.560 . 0 0 "[ . 1 . 2]" 2
1013 1 54 ARG HA 1 59 GLN HB3 . . 4.450 3.652 3.138 4.018 . 0 0 "[ . 1 . 2]" 2
1014 1 60 ASN HA 1 68 TYR H . . 4.930 4.357 3.854 4.660 . 0 0 "[ . 1 . 2]" 2
1015 1 58 THR MG 1 60 ASN HB2 . . 5.080 4.659 4.453 4.831 . 0 0 "[ . 1 . 2]" 2
1016 1 61 CYS HA 1 62 PRO HG3 . . 4.740 4.319 4.314 4.334 . 0 0 "[ . 1 . 2]" 2
1017 1 61 CYS HA 1 62 PRO HG2 . . 4.740 4.221 4.187 4.277 . 0 0 "[ . 1 . 2]" 2
1018 1 61 CYS HA 1 63 GLN H . . 5.430 3.570 3.521 3.638 . 0 0 "[ . 1 . 2]" 2
1019 1 61 CYS HA 1 68 TYR HH . . 4.420 2.827 2.009 3.920 . 0 0 "[ . 1 . 2]" 2
1020 1 61 CYS HB3 1 64 CYS HB2 . . 5.500 4.481 4.335 4.701 . 0 0 "[ . 1 . 2]" 2
1021 1 60 ASN HA 1 61 CYS HB3 . . 4.810 4.653 4.587 4.763 . 0 0 "[ . 1 . 2]" 2
1022 1 61 CYS HB3 1 64 CYS H . . 4.390 2.504 2.395 2.577 . 0 0 "[ . 1 . 2]" 2
1023 1 38 CYS QB 1 61 CYS HB2 . . 4.090 3.624 3.319 3.889 . 0 0 "[ . 1 . 2]" 2
1024 1 60 ASN HA 1 61 CYS HB2 . . 4.780 4.548 4.479 4.588 . 0 0 "[ . 1 . 2]" 2
1025 1 43 PHE QE 1 62 PRO HB2 . . 5.320 4.048 3.450 4.364 . 0 0 "[ . 1 . 2]" 2
1026 1 21 ILE MD 1 62 PRO HB3 . . 5.300 4.773 3.937 5.136 . 0 0 "[ . 1 . 2]" 2
1027 1 43 PHE QE 1 62 PRO HB3 . . 5.320 4.618 4.310 4.760 . 0 0 "[ . 1 . 2]" 2
1028 1 62 PRO HD3 1 63 GLN H . . 4.500 4.062 4.043 4.081 . 0 0 "[ . 1 . 2]" 2
1029 1 62 PRO HD3 1 68 TYR HH . . 4.700 3.459 2.700 4.309 . 0 0 "[ . 1 . 2]" 2
1030 1 43 PHE HB3 1 63 GLN HB3 . . 4.530 3.465 2.966 3.650 . 0 0 "[ . 1 . 2]" 2
1031 1 63 GLN HG2 1 64 CYS HB3 . . 4.450 3.133 3.027 3.180 . 0 0 "[ . 1 . 2]" 2
1032 1 43 PHE QD 1 63 GLN HG2 . . 4.700 4.371 4.100 4.583 . 0 0 "[ . 1 . 2]" 2
1033 1 43 PHE QD 1 63 GLN HG3 . . 4.670 4.597 4.367 4.715 0.045 14 0 "[ . 1 . 2]" 2
1034 1 63 GLN H 1 63 GLN HG3 . . 4.490 4.516 4.500 4.531 0.041 5 0 "[ . 1 . 2]" 2
1035 1 41 CYS HA 1 64 CYS HB2 . . 5.500 5.307 5.061 5.472 . 0 0 "[ . 1 . 2]" 2
1036 1 64 CYS HB2 1 66 THR H . . 4.910 4.252 3.770 4.440 . 0 0 "[ . 1 . 2]" 2
1037 1 63 GLN HG2 1 64 CYS HB2 . . 5.500 4.838 4.737 4.897 . 0 0 "[ . 1 . 2]" 2
1038 1 63 GLN HG3 1 64 CYS HB3 . . 4.830 4.369 4.269 4.439 . 0 0 "[ . 1 . 2]" 2
1039 1 41 CYS HA 1 64 CYS HB3 . . 5.440 4.455 4.328 4.560 . 0 0 "[ . 1 . 2]" 2
1040 1 64 CYS HB3 1 65 LYS H . . 4.760 4.156 4.063 4.236 . 0 0 "[ . 1 . 2]" 2
1041 1 66 THR HA 1 67 ARG HG2 . . 4.350 4.219 3.976 4.367 0.017 18 0 "[ . 1 . 2]" 2
1042 1 66 THR HA 1 67 ARG HA . . 4.930 4.303 4.295 4.321 . 0 0 "[ . 1 . 2]" 2
1043 1 40 GLU HB2 1 66 THR HB . . 5.100 3.764 3.321 4.666 . 0 0 "[ . 1 . 2]" 2
1044 1 66 THR HB 1 67 ARG H . . 4.390 3.781 3.492 4.200 . 0 0 "[ . 1 . 2]" 2
1045 1 66 THR MG 1 67 ARG HG2 . . 4.050 2.411 2.187 2.727 . 0 0 "[ . 1 . 2]" 2
1046 1 66 THR MG 1 67 ARG HD2 . . 5.500 4.556 4.085 4.802 . 0 0 "[ . 1 . 2]" 2
1047 1 66 THR MG 1 67 ARG HD3 . . 5.500 4.413 3.946 4.877 . 0 0 "[ . 1 . 2]" 2
1048 1 54 ARG HG3 1 68 TYR HB2 . . 5.150 3.654 3.082 4.469 . 0 0 "[ . 1 . 2]" 2
1049 1 54 ARG HD3 1 68 TYR HB2 . . 5.130 4.737 4.234 5.088 . 0 0 "[ . 1 . 2]" 2
1050 1 54 ARG HG2 1 68 TYR HB2 . . 4.560 3.448 3.046 3.856 . 0 0 "[ . 1 . 2]" 2
1051 1 54 ARG HD2 1 68 TYR HB2 . . 5.130 3.256 2.798 3.817 . 0 0 "[ . 1 . 2]" 2
1052 1 68 TYR HB2 1 69 LYS H . . 4.580 3.654 3.489 3.964 . 0 0 "[ . 1 . 2]" 2
1053 1 54 ARG HG3 1 68 TYR HB3 . . 5.150 3.509 2.942 4.135 . 0 0 "[ . 1 . 2]" 2
1054 1 69 LYS HB3 1 71 LEU MD2 . . 4.690 4.618 4.487 4.704 0.014 6 0 "[ . 1 . 2]" 2
1055 1 69 LYS HB2 1 70 ARG H . . 4.310 2.924 1.916 3.246 . 0 0 "[ . 1 . 2]" 2
1056 1 68 TYR HA 1 69 LYS QG . . 5.190 4.750 3.439 5.184 . 0 0 "[ . 1 . 2]" 2
1057 1 69 LYS QD 1 71 LEU MD2 . . 4.880 2.489 1.648 3.414 . 0 0 "[ . 1 . 2]" 2
1058 1 68 TYR HA 1 69 LYS QD . . 5.500 3.413 2.937 5.174 . 0 0 "[ . 1 . 2]" 2
1059 1 69 LYS QD 1 70 ARG H . . 5.350 4.517 2.647 4.940 . 0 0 "[ . 1 . 2]" 2
1060 1 69 LYS H 1 69 LYS QE . . 5.310 4.142 3.461 4.968 . 0 0 "[ . 1 . 2]" 2
1061 1 69 LYS HA 1 69 LYS QE . . 5.500 5.077 4.078 5.408 . 0 0 "[ . 1 . 2]" 2
1062 1 69 LYS QE 1 71 LEU MD2 . . 4.680 2.729 1.788 3.931 . 0 0 "[ . 1 . 2]" 2
1063 1 69 LYS HB3 1 69 LYS QE . . 4.350 3.393 1.991 4.119 . 0 0 "[ . 1 . 2]" 2
1064 1 50 TYR HH 1 70 ARG QB . . 5.500 5.465 5.054 5.534 0.034 8 0 "[ . 1 . 2]" 2
1065 1 71 LEU QB 1 72 ARG QB . . 4.470 3.713 3.479 4.247 . 0 0 "[ . 1 . 2]" 2
1066 1 70 ARG HA 1 71 LEU QB . . 5.050 4.396 4.312 4.587 . 0 0 "[ . 1 . 2]" 2
1067 1 35 PHE HZ 1 71 LEU QB . . 5.400 3.897 3.298 4.698 . 0 0 "[ . 1 . 2]" 2
1068 1 35 PHE QD 1 71 LEU QB . . 5.300 4.613 4.027 5.244 . 0 0 "[ . 1 . 2]" 2
1069 1 50 TYR HH 1 71 LEU QB . . 4.760 4.077 3.643 4.547 . 0 0 "[ . 1 . 2]" 2
1070 1 37 ALA HA 1 71 LEU HG . . 5.420 5.278 4.837 5.429 0.009 15 0 "[ . 1 . 2]" 2
1071 1 71 LEU HA 1 71 LEU HG . . 3.960 3.197 3.068 3.521 . 0 0 "[ . 1 . 2]" 2
1072 1 35 PHE QE 1 71 LEU HG . . 5.440 4.928 4.300 5.340 . 0 0 "[ . 1 . 2]" 2
1073 1 50 TYR HH 1 71 LEU MD2 . . 4.810 3.329 2.084 3.907 . 0 0 "[ . 1 . 2]" 2
1074 1 35 PHE QD 1 71 LEU MD2 . . 5.500 5.192 4.781 5.507 0.007 6 0 "[ . 1 . 2]" 2
1075 1 75 PRO HA 1 76 ARG QB . . 4.400 4.256 4.153 4.403 0.003 7 0 "[ . 1 . 2]" 2
1076 1 75 PRO HB2 1 77 VAL MG1 . . 4.520 4.248 3.822 4.542 0.022 11 0 "[ . 1 . 2]" 2
1077 1 70 ARG HD2 1 76 ARG HA . . 4.040 2.803 2.033 4.047 0.007 9 0 "[ . 1 . 2]" 2
1078 1 70 ARG HD3 1 76 ARG HA . . 4.040 3.194 2.143 4.037 . 0 0 "[ . 1 . 2]" 2
1079 1 70 ARG HG2 1 76 ARG HA . . 4.610 4.418 2.707 4.647 0.037 15 0 "[ . 1 . 2]" 2
1080 1 76 ARG HA 1 77 VAL MG1 . . 4.090 3.631 3.509 3.824 . 0 0 "[ . 1 . 2]" 2
1081 1 76 ARG HA 1 77 VAL MG2 . . 3.930 3.565 3.271 3.802 . 0 0 "[ . 1 . 2]" 2
1082 1 55 ARG HB3 1 56 GLU HA . . 4.890 4.444 4.204 4.821 . 0 0 "[ . 1 . 2]" 2
1083 1 55 ARG HA 1 77 VAL HB . . 4.950 4.099 3.302 4.593 . 0 0 "[ . 1 . 2]" 2
1084 1 54 ARG QH2 1 77 VAL MG1 . . 4.490 3.303 2.476 4.027 . 0 0 "[ . 1 . 2]" 2
1085 1 59 GLN HE22 1 77 VAL MG1 . . 5.350 5.007 4.536 5.360 0.010 7 0 "[ . 1 . 2]" 2
1086 1 59 GLN HE21 1 77 VAL MG1 . . 5.350 4.300 3.534 4.894 . 0 0 "[ . 1 . 2]" 2
1087 1 55 ARG H 1 77 VAL MG1 . . 4.480 3.815 3.326 4.337 . 0 0 "[ . 1 . 2]" 2
1088 1 59 GLN HG2 1 77 VAL MG2 . . 4.900 2.867 2.277 3.487 . 0 0 "[ . 1 . 2]" 2
1089 1 77 VAL MG2 1 78 GLU HA . . 4.760 4.410 4.051 4.780 0.020 4 0 "[ . 1 . 2]" 2
1090 1 77 VAL HA 1 78 GLU HA . . 4.540 4.384 4.297 4.649 0.109 9 0 "[ . 1 . 2]" 2
1091 1 78 GLU QG 1 79 GLY H . . 4.670 4.374 3.628 4.710 0.040 19 0 "[ . 1 . 2]" 2
1092 1 76 ARG HG3 1 80 ASP HB2 . . 4.440 3.217 2.056 4.349 . 0 0 "[ . 1 . 2]" 2
1093 1 76 ARG HG2 1 80 ASP HB2 . . 4.440 2.994 1.995 4.441 0.001 2 0 "[ . 1 . 2]" 2
1094 1 76 ARG HG3 1 80 ASP HB3 . . 4.440 3.482 2.240 4.458 0.018 9 0 "[ . 1 . 2]" 2
1095 1 80 ASP HA 1 81 GLU HA . . 4.740 4.465 4.320 4.637 . 0 0 "[ . 1 . 2]" 2
1096 1 81 GLU HA 1 82 ASP HA . . 5.120 4.432 4.332 4.806 . 0 0 "[ . 1 . 2]" 2
1097 1 82 ASP HA 1 83 GLU HA . . 5.500 4.498 4.298 4.847 . 0 0 "[ . 1 . 2]" 2
1098 1 85 ASP HA 1 86 ILE HA . . 5.490 4.432 4.311 4.727 . 0 0 "[ . 1 . 2]" 2
1099 1 86 ILE HA 1 87 ASP HA . . 5.500 4.441 4.302 4.873 . 0 0 "[ . 1 . 2]" 2
1100 1 86 ILE HB 1 87 ASP H . . 4.740 3.362 1.978 4.451 . 0 0 "[ . 1 . 2]" 2
1101 1 86 ILE MG 1 87 ASP H . . 4.540 3.256 2.344 4.339 . 0 0 "[ . 1 . 2]" 2
1102 1 30 VAL HB 1 72 ARG QD . . 4.620 3.416 2.265 4.628 0.008 15 0 "[ . 1 . 2]" 2
1103 1 72 ARG HA 1 72 ARG QD . . 4.350 3.175 1.980 4.393 0.043 3 0 "[ . 1 . 2]" 2
1104 1 10 PRO HB2 1 11 LEU H . . 4.420 3.110 2.124 4.078 . 0 0 "[ . 1 . 2]" 2
1105 1 9 LYS HA 1 10 PRO QG . . 4.550 3.902 3.767 4.011 . 0 0 "[ . 1 . 2]" 2
1106 1 10 PRO QG 1 11 LEU H . . 5.140 4.389 3.797 4.754 . 0 0 "[ . 1 . 2]" 2
1107 1 16 GLY HA3 1 17 GLN HA . . 4.410 4.381 4.358 4.421 0.011 17 0 "[ . 1 . 2]" 2
1108 1 15 ASP HA 1 16 GLY HA3 . . 5.150 4.572 4.528 4.642 . 0 0 "[ . 1 . 2]" 2
1109 1 15 ASP HA 1 16 GLY HA2 . . 5.500 5.032 4.856 5.238 . 0 0 "[ . 1 . 2]" 2
1110 1 16 GLY HA2 1 18 PHE QE . . 5.500 5.482 5.425 5.511 0.011 3 0 "[ . 1 . 2]" 2
1111 1 17 GLN HA 1 18 PHE QD . . 5.200 5.171 5.128 5.220 0.020 7 0 "[ . 1 . 2]" 2
1112 1 17 GLN QB 1 18 PHE QD . . 4.160 3.788 3.721 3.881 . 0 0 "[ . 1 . 2]" 2
1113 1 9 LYS HA 1 9 LYS QD . . 4.630 3.045 2.131 4.418 . 0 0 "[ . 1 . 2]" 2
1114 1 10 PRO HB3 1 11 LEU H . . 4.420 3.769 3.229 4.401 . 0 0 "[ . 1 . 2]" 2
1115 1 21 ILE MD 1 62 PRO HG3 . . 4.020 2.842 2.135 3.193 . 0 0 "[ . 1 . 2]" 2
1116 1 20 GLU HB3 1 44 PRO HG2 . . 4.450 3.522 3.485 3.600 . 0 0 "[ . 1 . 2]" 2
1117 1 74 SER HA 1 75 PRO HG3 . . 4.950 4.364 4.320 4.417 . 0 0 "[ . 1 . 2]" 2
1118 1 74 SER HA 1 75 PRO HG2 . . 4.950 4.124 4.113 4.156 . 0 0 "[ . 1 . 2]" 2
1119 1 75 PRO HG3 1 76 ARG H . . 5.500 4.989 4.522 5.495 . 0 0 "[ . 1 . 2]" 2
1120 1 75 PRO HG2 1 76 ARG H . . 5.500 4.306 3.795 4.822 . 0 0 "[ . 1 . 2]" 2
1121 1 9 LYS H 1 10 PRO HD2 . . 5.500 4.766 4.547 4.840 . 0 0 "[ . 1 . 2]" 2
1122 1 13 ASN HA 1 14 LEU HA . . 4.860 4.454 4.339 4.648 . 0 0 "[ . 1 . 2]" 2
1123 1 14 LEU HA 1 15 ASP HA . . 5.500 4.734 4.530 4.866 . 0 0 "[ . 1 . 2]" 2
1124 1 11 LEU HA 1 11 LEU HG . . 4.020 2.788 2.330 3.737 . 0 0 "[ . 1 . 2]" 2
1125 1 82 ASP HB2 1 83 GLU HA . . 5.500 4.829 3.943 5.597 0.097 13 0 "[ . 1 . 2]" 2
1126 1 16 GLY HA2 1 18 PHE H . . 3.810 3.594 3.439 3.728 . 0 0 "[ . 1 . 2]" 2
1127 1 17 GLN HA 1 26 ILE H . . 5.230 5.239 5.214 5.262 0.032 4 0 "[ . 1 . 2]" 2
1128 1 16 GLY HA2 1 17 GLN HA . . 5.500 4.958 4.903 4.978 . 0 0 "[ . 1 . 2]" 2
1129 1 17 GLN HA 1 26 ILE HB . . 4.170 3.987 3.808 4.139 . 0 0 "[ . 1 . 2]" 2
1130 1 59 GLN HG3 1 77 VAL MG2 . . 4.990 4.064 3.612 4.945 . 0 0 "[ . 1 . 2]" 2
1131 1 17 GLN HG2 1 34 LEU MD2 . . 4.020 3.020 2.122 4.030 0.010 14 0 "[ . 1 . 2]" 2
1132 1 18 PHE HB2 1 19 CYS H . . 4.330 4.232 4.156 4.304 . 0 0 "[ . 1 . 2]" 2
1133 1 17 GLN H 1 18 PHE QD . . 4.060 3.744 3.576 3.806 . 0 0 "[ . 1 . 2]" 2
1134 1 17 GLN QB 1 18 PHE QE . . 4.500 4.198 4.095 4.330 . 0 0 "[ . 1 . 2]" 2
1135 1 19 CYS HA 1 44 PRO HA . . 5.100 3.997 3.789 4.322 . 0 0 "[ . 1 . 2]" 2
1136 1 19 CYS HA 1 20 GLU HB2 . . 4.530 4.321 4.289 4.400 . 0 0 "[ . 1 . 2]" 2
1137 1 55 ARG HB2 1 55 ARG HD3 . . 4.050 3.755 2.783 4.193 0.143 18 0 "[ . 1 . 2]" 2
1138 1 55 ARG HB2 1 55 ARG HD2 . . 4.050 3.395 2.688 3.831 . 0 0 "[ . 1 . 2]" 2
1139 1 54 ARG HB3 1 59 GLN HG2 . . 5.130 3.299 2.918 3.900 . 0 0 "[ . 1 . 2]" 2
1140 1 51 GLU HA 1 54 ARG HB3 . . 5.010 4.764 4.287 5.002 . 0 0 "[ . 1 . 2]" 2
1141 1 54 ARG HB3 1 55 ARG H . . 4.720 3.553 3.223 3.803 . 0 0 "[ . 1 . 2]" 2
1142 1 54 ARG HB2 1 77 VAL MG1 . . 4.050 3.506 3.080 3.894 . 0 0 "[ . 1 . 2]" 2
1143 1 54 ARG HB2 1 77 VAL MG2 . . 4.320 3.860 3.527 4.124 . 0 0 "[ . 1 . 2]" 2
1144 1 20 GLU HB2 1 21 ILE HA . . 4.640 4.566 4.462 4.632 . 0 0 "[ . 1 . 2]" 2
1145 1 21 ILE HB 1 49 CYS HB2 . . 4.520 4.247 4.138 4.349 . 0 0 "[ . 1 . 2]" 2
1146 1 21 ILE HB 1 23 GLY H . . 4.780 4.254 4.187 4.339 . 0 0 "[ . 1 . 2]" 2
1147 1 21 ILE MD 1 62 PRO HB2 . . 5.300 4.934 4.154 5.303 0.003 7 0 "[ . 1 . 2]" 2
1148 1 21 ILE MG 1 52 TYR QD . . 5.500 4.919 4.446 5.446 . 0 0 "[ . 1 . 2]" 2
1149 1 21 ILE MG 1 23 GLY H . . 5.440 4.859 4.754 4.916 . 0 0 "[ . 1 . 2]" 2
1150 1 21 ILE MD 1 21 ILE MG . . 3.000 1.970 1.919 2.132 . 0 0 "[ . 1 . 2]" 2
1151 1 18 PHE HB2 1 25 GLN HB2 . . 5.500 5.517 5.493 5.539 0.039 4 0 "[ . 1 . 2]" 2
1152 1 18 PHE HB2 1 25 GLN HG3 . . 5.500 5.038 4.756 5.475 . 0 0 "[ . 1 . 2]" 2
1153 1 19 CYS HB3 1 24 ASP HB3 . . 5.410 4.442 3.647 5.131 . 0 0 "[ . 1 . 2]" 2
1154 1 25 GLN HA 1 26 ILE HA . . 5.220 4.393 4.372 4.411 . 0 0 "[ . 1 . 2]" 2
1155 1 19 CYS HB2 1 26 ILE HA . . 4.950 4.001 3.845 4.211 . 0 0 "[ . 1 . 2]" 2
1156 1 26 ILE HA 1 47 ARG H . . 4.290 4.235 4.036 4.313 0.023 4 0 "[ . 1 . 2]" 2
1157 1 19 CYS H 1 26 ILE HA . . 5.370 4.139 4.032 4.255 . 0 0 "[ . 1 . 2]" 2
1158 1 19 CYS HB3 1 26 ILE HG13 . . 3.870 3.520 3.353 3.648 . 0 0 "[ . 1 . 2]" 2
1159 1 26 ILE HG13 1 44 PRO HB3 . . 5.260 5.006 4.841 5.126 . 0 0 "[ . 1 . 2]" 2
1160 1 26 ILE HG13 1 44 PRO HB2 . . 5.500 4.079 3.970 4.238 . 0 0 "[ . 1 . 2]" 2
1161 1 19 CYS HB3 1 26 ILE HG12 . . 3.920 3.888 3.766 3.930 0.010 7 0 "[ . 1 . 2]" 2
1162 1 19 CYS HB3 1 26 ILE MD . . 4.410 4.177 4.033 4.333 . 0 0 "[ . 1 . 2]" 2
1163 1 28 LEU HB3 1 33 ASP H . . 5.500 4.243 2.936 4.550 . 0 0 "[ . 1 . 2]" 2
1164 1 27 GLY HA2 1 28 LEU MD2 . . 4.290 4.143 3.878 4.289 . 0 0 "[ . 1 . 2]" 2
1165 1 28 LEU MD2 1 33 ASP H . . 5.260 4.606 3.780 4.819 . 0 0 "[ . 1 . 2]" 2
1166 1 28 LEU HA 1 29 THR HA . . 5.500 4.325 4.306 4.343 . 0 0 "[ . 1 . 2]" 2
1167 1 29 THR HA 1 35 PHE HA . . 5.010 4.463 3.994 4.864 . 0 0 "[ . 1 . 2]" 2
1168 1 29 THR HA 1 30 VAL HB . . 5.500 5.045 4.753 5.184 . 0 0 "[ . 1 . 2]" 2
1169 1 29 THR HA 1 30 VAL HA . . 4.330 4.304 4.297 4.319 . 0 0 "[ . 1 . 2]" 2
1170 1 31 GLU HA 1 33 ASP H . . 5.470 5.046 4.880 5.405 . 0 0 "[ . 1 . 2]" 2
1171 1 40 GLU HA 1 40 GLU HG2 . . 4.070 3.169 2.329 3.870 . 0 0 "[ . 1 . 2]" 2
1172 1 31 GLU HB2 1 32 GLY H . . 4.450 2.598 2.355 4.064 . 0 0 "[ . 1 . 2]" 2
1173 1 29 THR H 1 33 ASP HB3 . . 5.500 5.264 4.957 5.433 . 0 0 "[ . 1 . 2]" 2
1174 1 33 ASP HA 1 34 LEU HA . . 4.830 4.303 4.295 4.327 . 0 0 "[ . 1 . 2]" 2
1175 1 29 THR MG 1 34 LEU HA . . 3.970 3.723 3.458 3.955 . 0 0 "[ . 1 . 2]" 2
1176 1 33 ASP HA 1 34 LEU HB2 . . 5.160 4.432 4.369 4.492 . 0 0 "[ . 1 . 2]" 2
1177 1 33 ASP HA 1 34 LEU HB3 . . 5.160 5.064 4.932 5.176 0.016 6 0 "[ . 1 . 2]" 2
1178 1 54 ARG HD2 1 68 TYR HB3 . . 5.130 2.123 1.991 2.445 . 0 0 "[ . 1 . 2]" 2
1179 1 54 ARG HD3 1 68 TYR HB3 . . 5.130 3.699 3.316 4.028 . 0 0 "[ . 1 . 2]" 2
1180 1 54 ARG HD3 1 77 VAL MG2 . . 4.770 4.153 3.107 4.771 0.001 20 0 "[ . 1 . 2]" 2
1181 1 35 PHE HA 1 35 PHE QE . . 4.780 4.559 4.371 4.698 . 0 0 "[ . 1 . 2]" 2
1182 1 29 THR H 1 35 PHE HB2 . . 5.500 3.862 3.317 4.114 . 0 0 "[ . 1 . 2]" 2
1183 1 35 PHE QD 1 46 CYS HA . . 4.290 2.919 2.600 3.456 . 0 0 "[ . 1 . 2]" 2
1184 1 26 ILE MD 1 35 PHE QD . . 4.420 3.564 3.173 3.990 . 0 0 "[ . 1 . 2]" 2
1185 1 35 PHE QE 1 71 LEU QB . . 3.730 2.982 2.413 3.603 . 0 0 "[ . 1 . 2]" 2
1186 1 40 GLU HB3 1 66 THR HB . . 5.100 3.936 3.222 5.033 . 0 0 "[ . 1 . 2]" 2
1187 1 43 PHE HB3 1 63 GLN HG2 . . 5.060 4.901 4.140 5.053 . 0 0 "[ . 1 . 2]" 2
1188 1 43 PHE HB2 1 63 GLN HE22 . . 4.680 3.671 2.713 4.008 . 0 0 "[ . 1 . 2]" 2
1189 1 20 GLU HB2 1 43 PHE HZ . . 4.470 3.557 3.089 3.926 . 0 0 "[ . 1 . 2]" 2
1190 1 20 GLU HB3 1 44 PRO HB2 . . 5.500 5.385 5.233 5.519 0.019 15 0 "[ . 1 . 2]" 2
1191 1 20 GLU H 1 44 PRO HB3 . . 5.450 4.502 4.336 4.644 . 0 0 "[ . 1 . 2]" 2
1192 1 20 GLU H 1 44 PRO HG2 . . 4.270 2.673 2.559 2.824 . 0 0 "[ . 1 . 2]" 2
1193 1 43 PHE QE 1 44 PRO HD2 . . 3.970 3.406 3.225 3.635 . 0 0 "[ . 1 . 2]" 2
1194 1 20 GLU HG3 1 44 PRO HD3 . . 4.000 3.856 3.576 4.001 0.001 4 0 "[ . 1 . 2]" 2
1195 1 20 GLU HB2 1 45 ALA HA . . 5.500 5.077 4.905 5.204 . 0 0 "[ . 1 . 2]" 2
1196 1 44 PRO HB2 1 45 ALA HA . . 5.500 4.317 3.989 4.418 . 0 0 "[ . 1 . 2]" 2
1197 1 45 ALA HA 1 46 CYS HA . . 5.500 4.401 4.385 4.427 . 0 0 "[ . 1 . 2]" 2
1198 1 44 PRO HA 1 45 ALA MB . . 4.210 4.093 3.805 4.185 . 0 0 "[ . 1 . 2]" 2
1199 1 21 ILE HB 1 45 ALA MB . . 4.770 4.193 4.093 4.376 . 0 0 "[ . 1 . 2]" 2
1200 1 20 GLU HB2 1 45 ALA MB . . 5.500 5.161 4.952 5.287 . 0 0 "[ . 1 . 2]" 2
1201 1 44 PRO HB2 1 45 ALA MB . . 5.500 4.976 4.595 5.104 . 0 0 "[ . 1 . 2]" 2
1202 1 26 ILE MD 1 45 ALA MB . . 5.130 3.786 3.624 3.895 . 0 0 "[ . 1 . 2]" 2
1203 1 47 ARG HA 1 47 ARG HD2 . . 5.440 4.497 3.806 4.737 . 0 0 "[ . 1 . 2]" 2
1204 1 47 ARG HA 1 49 CYS HB2 . . 5.500 5.020 4.976 5.069 . 0 0 "[ . 1 . 2]" 2
1205 1 70 ARG HG2 1 71 LEU H . . 4.220 3.707 3.383 4.085 . 0 0 "[ . 1 . 2]" 2
1206 1 70 ARG HG3 1 76 ARG HA . . 4.610 3.265 2.815 3.802 . 0 0 "[ . 1 . 2]" 2
1207 1 67 ARG H 1 67 ARG HG3 . . 3.720 3.048 2.833 3.332 . 0 0 "[ . 1 . 2]" 2
1208 1 54 ARG HG2 1 54 ARG QH2 . . 4.550 4.221 4.088 4.348 . 0 0 "[ . 1 . 2]" 2
1209 1 67 ARG HA 1 67 ARG HG3 . . 4.120 3.711 3.631 3.797 . 0 0 "[ . 1 . 2]" 2
1210 1 55 ARG HG2 1 56 GLU H . . 4.820 3.971 2.687 4.568 . 0 0 "[ . 1 . 2]" 2
1211 1 55 ARG HA 1 55 ARG HD2 . . 4.750 4.161 3.648 4.574 . 0 0 "[ . 1 . 2]" 2
1212 1 55 ARG H 1 55 ARG HD2 . . 5.500 4.834 4.145 5.534 0.034 13 0 "[ . 1 . 2]" 2
1213 1 55 ARG HD2 1 57 GLY H . . 5.500 5.226 3.912 5.572 0.072 13 0 "[ . 1 . 2]" 2
1214 1 55 ARG HD3 1 57 GLY H . . 5.500 5.235 4.779 5.585 0.085 19 0 "[ . 1 . 2]" 2
1215 1 47 ARG HA 1 47 ARG HD3 . . 5.440 3.978 2.473 4.655 . 0 0 "[ . 1 . 2]" 2
1216 1 48 PRO HA 1 51 GLU HB2 . . 3.680 3.489 3.281 3.633 . 0 0 "[ . 1 . 2]" 2
1217 1 46 CYS HA 1 48 PRO HD2 . . 4.720 3.818 3.752 3.874 . 0 0 "[ . 1 . 2]" 2
1218 1 49 CYS HB2 1 50 TYR HA . . 5.090 4.833 4.795 4.874 . 0 0 "[ . 1 . 2]" 2
1219 1 49 CYS H 1 50 TYR HA . . 5.500 4.653 4.567 4.723 . 0 0 "[ . 1 . 2]" 2
1220 1 49 CYS H 1 50 TYR HB2 . . 5.500 4.668 4.493 4.785 . 0 0 "[ . 1 . 2]" 2
1221 1 31 GLU HB2 1 33 ASP H . . 4.700 3.241 2.800 4.285 . 0 0 "[ . 1 . 2]" 2
1222 1 52 TYR HA 1 55 ARG HB3 . . 3.790 2.308 1.970 2.755 . 0 0 "[ . 1 . 2]" 2
1223 1 53 GLU HA 1 53 GLU HG3 . . 3.580 2.739 2.545 2.958 . 0 0 "[ . 1 . 2]" 2
1224 1 53 GLU HB2 1 59 GLN H . . 5.500 5.145 4.984 5.308 . 0 0 "[ . 1 . 2]" 2
1225 1 53 GLU HB3 1 54 ARG H . . 4.350 2.789 2.443 3.037 . 0 0 "[ . 1 . 2]" 2
1226 1 54 ARG HA 1 77 VAL MG1 . . 4.210 4.047 3.675 4.221 0.011 18 0 "[ . 1 . 2]" 2
1227 1 47 ARG HA 1 47 ARG HG3 . . 4.100 2.254 2.137 3.064 . 0 0 "[ . 1 . 2]" 2
1228 1 54 ARG HA 1 54 ARG HG2 . . 4.210 2.549 2.203 2.801 . 0 0 "[ . 1 . 2]" 2
1229 1 54 ARG HG2 1 59 GLN HG2 . . 4.070 2.348 1.996 3.134 . 0 0 "[ . 1 . 2]" 2
1230 1 54 ARG HG2 1 77 VAL MG2 . . 4.630 2.945 2.196 3.781 . 0 0 "[ . 1 . 2]" 2
1231 1 55 ARG HA 1 77 VAL MG2 . . 4.590 4.483 4.184 4.607 0.017 14 0 "[ . 1 . 2]" 2
1232 1 55 ARG HB2 1 77 VAL MG1 . . 4.210 3.970 3.486 4.237 0.027 5 0 "[ . 1 . 2]" 2
1233 1 55 ARG HG2 1 56 GLU QG . . 4.590 3.719 2.020 4.625 0.035 6 0 "[ . 1 . 2]" 2
1234 1 57 GLY H 1 58 THR MG . . 5.500 5.459 5.304 5.515 0.015 7 0 "[ . 1 . 2]" 2
1235 1 58 THR MG 1 60 ASN HD21 . . 5.250 3.631 3.289 4.301 . 0 0 "[ . 1 . 2]" 2
1236 1 57 GLY HA2 1 58 THR MG . . 4.850 3.416 3.350 3.507 . 0 0 "[ . 1 . 2]" 2
1237 1 66 THR MG 1 67 ARG HA . . 5.500 3.941 3.737 4.088 . 0 0 "[ . 1 . 2]" 2
1238 1 53 GLU HG2 1 59 GLN HA . . 4.140 3.695 2.893 4.155 0.015 6 0 "[ . 1 . 2]" 2
1239 1 54 ARG H 1 59 GLN HA . . 5.080 4.438 4.199 4.759 . 0 0 "[ . 1 . 2]" 2
1240 1 18 PHE QD 1 25 GLN HG2 . . 4.780 4.105 3.955 4.379 . 0 0 "[ . 1 . 2]" 2
1241 1 61 CYS HB3 1 65 LYS HA . . 3.770 2.904 2.780 3.060 . 0 0 "[ . 1 . 2]" 2
1242 1 74 SER HA 1 75 PRO HB3 . . 5.450 4.966 4.897 5.032 . 0 0 "[ . 1 . 2]" 2
1243 1 62 PRO HA 1 65 LYS H . . 5.500 4.399 4.314 4.444 . 0 0 "[ . 1 . 2]" 2
1244 1 43 PHE QD 1 44 PRO HG2 . . 4.100 3.985 3.832 4.127 0.027 14 0 "[ . 1 . 2]" 2
1245 1 43 PHE QD 1 62 PRO HD2 . . 4.550 2.720 2.560 2.904 . 0 0 "[ . 1 . 2]" 2
1246 1 43 PHE QD 1 63 GLN HA . . 5.100 5.053 4.817 5.109 0.009 16 0 "[ . 1 . 2]" 2
1247 1 63 GLN HA 1 65 LYS H . . 5.500 4.718 4.620 4.879 . 0 0 "[ . 1 . 2]" 2
1248 1 71 LEU QB 1 72 ARG HA . . 5.500 4.289 4.236 4.432 . 0 0 "[ . 1 . 2]" 2
1249 1 64 CYS HB2 1 66 THR MG . . 5.500 4.839 4.602 5.031 . 0 0 "[ . 1 . 2]" 2
1250 1 65 LYS HE3 1 65 LYS HG2 . . 3.820 2.983 2.474 3.791 . 0 0 "[ . 1 . 2]" 2
1251 1 65 LYS HE3 1 65 LYS HG3 . . 3.820 2.768 2.318 4.037 0.217 15 0 "[ . 1 . 2]" 2
1252 1 65 LYS HE2 1 65 LYS HG3 . . 3.820 3.221 2.348 3.704 . 0 0 "[ . 1 . 2]" 2
1253 1 65 LYS H 1 65 LYS HG2 . . 4.790 3.409 2.402 4.590 . 0 0 "[ . 1 . 2]" 2
1254 1 62 PRO HA 1 65 LYS HE3 . . 5.150 3.057 2.087 4.375 . 0 0 "[ . 1 . 2]" 2
1255 1 65 LYS HA 1 65 LYS HE3 . . 5.500 4.870 4.046 5.500 0.000 15 0 "[ . 1 . 2]" 2
1256 1 65 LYS HA 1 65 LYS HE2 . . 5.500 4.947 4.337 5.369 . 0 0 "[ . 1 . 2]" 2
1257 1 61 CYS HB3 1 66 THR HB . . 5.500 3.914 3.735 4.101 . 0 0 "[ . 1 . 2]" 2
1258 1 61 CYS HB3 1 66 THR MG . . 5.500 5.238 5.090 5.391 . 0 0 "[ . 1 . 2]" 2
1259 1 67 ARG H 1 67 ARG HD3 . . 4.940 4.370 3.896 4.804 . 0 0 "[ . 1 . 2]" 2
1260 1 68 TYR HA 1 69 LYS HB2 . . 5.500 5.575 5.518 5.637 0.137 8 0 "[ . 1 . 2]" 2
1261 1 68 TYR HA 1 69 LYS HB3 . . 5.440 4.155 4.007 4.523 . 0 0 "[ . 1 . 2]" 2
1262 1 70 ARG QB 1 76 ARG HA . . 5.190 4.366 3.125 4.943 . 0 0 "[ . 1 . 2]" 2
1263 1 69 LYS HA 1 70 ARG QB . . 4.740 4.124 4.060 4.470 . 0 0 "[ . 1 . 2]" 2
1264 1 70 ARG H 1 70 ARG HD3 . . 5.500 4.473 4.208 5.626 0.126 8 0 "[ . 1 . 2]" 2
1265 1 70 ARG H 1 70 ARG HD2 . . 5.500 5.335 4.607 5.595 0.095 17 0 "[ . 1 . 2]" 2
1266 1 71 LEU QB 1 74 SER HG . . 4.060 2.948 1.987 4.061 0.001 2 0 "[ . 1 . 2]" 2
1267 1 50 TYR HH 1 71 LEU HG . . 3.980 2.313 1.994 2.796 . 0 0 "[ . 1 . 2]" 2
1268 1 71 LEU H 1 71 LEU MD1 . . 4.200 3.937 3.628 4.217 0.017 9 0 "[ . 1 . 2]" 2
1269 1 71 LEU MD1 1 74 SER HG . . 4.130 3.538 2.037 4.124 . 0 0 "[ . 1 . 2]" 2
1270 1 17 GLN QB 1 26 ILE MD . . 4.070 3.895 3.594 4.078 0.008 17 0 "[ . 1 . 2]" 2
1271 1 17 GLN QB 1 34 LEU MD1 . . 4.040 3.546 2.935 3.989 . 0 0 "[ . 1 . 2]" 2
1272 1 17 GLN QB 1 26 ILE HB . . 4.040 3.070 2.819 3.280 . 0 0 "[ . 1 . 2]" 2
1273 1 67 ARG H 1 67 ARG HD2 . . 4.940 4.633 4.216 4.850 . 0 0 "[ . 1 . 2]" 2
1274 1 75 PRO HB2 1 76 ARG QB . . 4.490 4.009 3.656 4.389 . 0 0 "[ . 1 . 2]" 2
1275 1 76 ARG HG2 1 80 ASP HB3 . . 4.440 3.401 2.334 4.394 . 0 0 "[ . 1 . 2]" 2
1276 1 76 ARG HA 1 76 ARG QD . . 4.280 3.745 2.021 4.288 0.008 14 0 "[ . 1 . 2]" 2
1277 1 54 ARG HE 1 77 VAL MG2 . . 4.410 3.291 2.061 4.057 . 0 0 "[ . 1 . 2]" 2
1278 1 77 VAL HB 1 78 GLU HA . . 4.710 4.471 4.001 4.696 . 0 0 "[ . 1 . 2]" 2
1279 1 80 ASP HA 1 81 GLU HB3 . . 5.500 5.227 4.413 5.571 0.071 12 0 "[ . 1 . 2]" 2
1280 1 81 GLU HB3 1 82 ASP H . . 4.430 3.858 2.563 4.245 . 0 0 "[ . 1 . 2]" 2
1281 1 81 GLU HG2 1 82 ASP H . . 5.500 4.354 2.414 5.500 0.000 18 0 "[ . 1 . 2]" 2
1282 1 81 GLU HG3 1 82 ASP H . . 5.500 4.047 2.425 5.492 . 0 0 "[ . 1 . 2]" 2
1283 1 82 ASP HB3 1 83 GLU HA . . 5.500 4.735 3.962 5.553 0.053 5 0 "[ . 1 . 2]" 2
1284 1 85 ASP HB3 1 86 ILE H . . 4.810 3.908 2.373 4.661 . 0 0 "[ . 1 . 2]" 2
1285 1 76 ARG HA 1 77 VAL HA . . 4.920 4.448 4.397 4.494 . 0 0 "[ . 1 . 2]" 2
1286 1 84 GLU HA 1 85 ASP HA . . 5.300 4.426 4.308 4.653 . 0 0 "[ . 1 . 2]" 2
1287 1 54 ARG QH2 1 77 VAL MG2 . . 3.560 2.375 1.925 3.022 . 0 0 "[ . 1 . 2]" 2
1288 1 54 ARG HD3 1 68 TYR QE . . 5.080 4.700 3.785 5.115 0.035 7 0 "[ . 1 . 2]" 2
1289 1 50 TYR HH 1 68 TYR QE . . 5.160 4.898 4.426 5.179 0.019 9 0 "[ . 1 . 2]" 2
1290 1 8 PRO QB 1 9 LYS H . . 3.930 3.027 1.836 3.900 . 0 0 "[ . 1 . 2]" 2
1291 1 9 LYS H 1 9 LYS QG . . 4.730 2.855 1.864 4.215 . 0 0 "[ . 1 . 2]" 2
1292 1 9 LYS H 1 10 PRO QD . . 4.810 4.269 3.942 4.378 . 0 0 "[ . 1 . 2]" 2
1293 1 9 LYS HA 1 10 PRO QD . . 2.810 1.998 1.853 2.099 . 0 0 "[ . 1 . 2]" 2
1294 1 9 LYS QB 1 10 PRO QD . . 3.360 2.466 1.965 3.270 . 0 0 "[ . 1 . 2]" 2
1295 1 9 LYS QG 1 10 PRO QD . . 4.630 3.356 1.903 4.152 . 0 0 "[ . 1 . 2]" 2
1296 1 10 PRO QB 1 11 LEU H . . 3.750 2.951 2.097 3.758 0.008 20 0 "[ . 1 . 2]" 2
1297 1 11 LEU H 1 11 LEU QB . . 2.640 2.310 2.085 2.555 . 0 0 "[ . 1 . 2]" 2
1298 1 11 LEU H 1 11 LEU QD . . 4.660 3.662 3.192 3.908 . 0 0 "[ . 1 . 2]" 2
1299 1 11 LEU HA 1 11 LEU QD . . 3.040 2.348 1.929 3.026 . 0 0 "[ . 1 . 2]" 2
1300 1 11 LEU QB 1 11 LEU QD . . 2.520 1.875 1.769 2.031 . 0 0 "[ . 1 . 2]" 2
1301 1 11 LEU QB 1 12 LYS H . . 3.790 3.455 2.966 3.796 0.006 16 0 "[ . 1 . 2]" 2
1302 1 11 LEU QD 1 12 LYS H . . 5.030 2.809 1.894 4.572 . 0 0 "[ . 1 . 2]" 2
1303 1 12 LYS H 1 12 LYS QB . . 3.370 2.353 2.137 2.634 . 0 0 "[ . 1 . 2]" 2
1304 1 12 LYS H 1 12 LYS QG . . 4.500 3.362 1.930 4.263 . 0 0 "[ . 1 . 2]" 2
1305 1 12 LYS HA 1 13 ASN QB . . 5.340 4.460 3.897 5.341 0.001 2 0 "[ . 1 . 2]" 2
1306 1 12 LYS QB 1 12 LYS QD . . 2.960 2.319 2.071 2.548 . 0 0 "[ . 1 . 2]" 2
1307 1 13 ASN H 1 13 ASN QB . . 3.610 2.540 2.144 3.281 . 0 0 "[ . 1 . 2]" 2
1308 1 13 ASN H 1 13 ASN QD . . 5.110 4.057 2.918 4.826 . 0 0 "[ . 1 . 2]" 2
1309 1 13 ASN QB 1 14 LEU H . . 3.990 3.117 2.044 3.906 . 0 0 "[ . 1 . 2]" 2
1310 1 13 ASN QB 1 14 LEU HA . . 5.340 4.402 3.990 5.174 . 0 0 "[ . 1 . 2]" 2
1311 1 14 LEU H 1 14 LEU QB . . 3.630 2.658 2.169 3.329 . 0 0 "[ . 1 . 2]" 2
1312 1 14 LEU H 1 14 LEU QD . . 3.930 3.170 2.113 3.936 0.006 13 0 "[ . 1 . 2]" 2
1313 1 14 LEU HA 1 14 LEU QD . . 3.020 2.343 1.889 2.918 . 0 0 "[ . 1 . 2]" 2
1314 1 14 LEU HA 1 15 ASP QB . . 5.340 4.733 4.382 5.327 . 0 0 "[ . 1 . 2]" 2
1315 1 14 LEU QB 1 15 ASP H . . 4.250 3.709 2.303 3.911 . 0 0 "[ . 1 . 2]" 2
1316 1 14 LEU QB 1 16 GLY H . . 5.340 4.815 4.252 5.311 . 0 0 "[ . 1 . 2]" 2
1317 1 14 LEU QD 1 15 ASP H . . 4.870 4.254 3.335 4.528 . 0 0 "[ . 1 . 2]" 2
1318 1 15 ASP QB 1 16 GLY H . . 3.600 2.470 2.179 3.358 . 0 0 "[ . 1 . 2]" 2
1319 1 15 ASP QB 1 17 GLN H . . 3.680 2.830 2.569 3.487 . 0 0 "[ . 1 . 2]" 2
1320 1 15 ASP QB 1 17 GLN QB . . 4.880 3.584 2.994 4.359 . 0 0 "[ . 1 . 2]" 2
1321 1 16 GLY HA3 1 17 GLN QG . . 4.910 4.571 4.359 4.895 . 0 0 "[ . 1 . 2]" 2
1322 1 17 GLN HA 1 17 GLN QE . . 5.340 4.296 3.350 4.680 . 0 0 "[ . 1 . 2]" 2
1323 1 17 GLN QG 1 18 PHE H . . 4.630 4.240 4.050 4.435 . 0 0 "[ . 1 . 2]" 2
1324 1 17 GLN QG 1 26 ILE MD . . 5.340 4.767 4.203 5.275 . 0 0 "[ . 1 . 2]" 2
1325 1 17 GLN QG 1 34 LEU MD1 . . 3.720 3.331 2.552 3.737 0.017 4 0 "[ . 1 . 2]" 2
1326 1 17 GLN QG 1 34 LEU MD2 . . 3.310 2.527 2.030 3.141 . 0 0 "[ . 1 . 2]" 2
1327 1 17 GLN QE 1 34 LEU MD2 . . 4.500 2.934 2.304 4.128 . 0 0 "[ . 1 . 2]" 2
1328 1 19 CYS HB3 1 24 ASP QB . . 4.570 3.530 3.440 3.662 . 0 0 "[ . 1 . 2]" 2
1329 1 21 ILE H 1 21 ILE QG . . 3.350 1.935 1.885 2.064 . 0 0 "[ . 1 . 2]" 2
1330 1 21 ILE QG 1 21 ILE MG . . 2.970 2.318 2.277 2.371 . 0 0 "[ . 1 . 2]" 2
1331 1 21 ILE QG 1 22 CYS H . . 4.590 3.886 3.851 3.921 . 0 0 "[ . 1 . 2]" 2
1332 1 21 ILE QG 1 43 PHE HZ . . 3.990 2.344 1.795 2.935 . 0 0 "[ . 1 . 2]" 2
1333 1 21 ILE QG 1 45 ALA MB . . 4.450 3.143 2.995 3.345 . 0 0 "[ . 1 . 2]" 2
1334 1 21 ILE QG 1 62 PRO QG . . 4.500 3.025 2.627 3.361 . 0 0 "[ . 1 . 2]" 2
1335 1 21 ILE MD 1 62 PRO QB . . 4.630 4.319 3.595 4.621 . 0 0 "[ . 1 . 2]" 2
1336 1 21 ILE MD 1 62 PRO QD . . 3.860 3.579 3.269 3.868 0.008 14 0 "[ . 1 . 2]" 2
1337 1 24 ASP H 1 24 ASP QB . . 3.070 2.395 2.123 2.753 . 0 0 "[ . 1 . 2]" 2
1338 1 24 ASP QB 1 25 GLN H . . 3.330 2.892 2.612 3.136 . 0 0 "[ . 1 . 2]" 2
1339 1 24 ASP QB 1 25 GLN HB2 . . 5.340 5.238 5.081 5.388 0.048 3 0 "[ . 1 . 2]" 2
1340 1 28 LEU HB2 1 32 GLY QA . . 4.010 3.305 2.993 3.473 . 0 0 "[ . 1 . 2]" 2
1341 1 28 LEU HB3 1 32 GLY QA . . 3.610 2.546 2.269 2.767 . 0 0 "[ . 1 . 2]" 2
1342 1 28 LEU MD1 1 32 GLY QA . . 3.300 2.647 2.454 2.829 . 0 0 "[ . 1 . 2]" 2
1343 1 28 LEU MD2 1 32 GLY QA . . 3.890 3.766 3.567 3.869 . 0 0 "[ . 1 . 2]" 2
1344 1 29 THR H 1 32 GLY QA . . 4.790 3.669 3.407 4.087 . 0 0 "[ . 1 . 2]" 2
1345 1 29 THR H 1 33 ASP QB . . 4.740 4.211 3.929 4.687 . 0 0 "[ . 1 . 2]" 2
1346 1 29 THR HA 1 30 VAL QG . . 4.280 3.840 3.652 4.169 . 0 0 "[ . 1 . 2]" 2
1347 1 29 THR MG 1 30 VAL QG . . 5.440 4.486 4.078 4.718 . 0 0 "[ . 1 . 2]" 2
1348 1 29 THR MG 1 33 ASP QB . . 3.630 3.014 2.732 3.611 . 0 0 "[ . 1 . 2]" 2
1349 1 29 THR MG 1 36 VAL QG . . 4.860 4.217 3.932 4.518 . 0 0 "[ . 1 . 2]" 2
1350 1 29 THR HG1 1 33 ASP QB . . 5.040 3.004 2.106 3.766 . 0 0 "[ . 1 . 2]" 2
1351 1 30 VAL H 1 30 VAL QG . . 3.220 2.078 1.852 2.387 . 0 0 "[ . 1 . 2]" 2
1352 1 30 VAL HA 1 30 VAL QG . . 2.950 2.134 2.031 2.371 . 0 0 "[ . 1 . 2]" 2
1353 1 30 VAL HB 1 72 ARG QG . . 5.170 3.781 2.581 5.170 0.000 7 0 "[ . 1 . 2]" 2
1354 1 30 VAL QG 1 31 GLU H . . 3.960 3.081 1.872 3.411 . 0 0 "[ . 1 . 2]" 2
1355 1 30 VAL QG 1 31 GLU HA . . 3.770 3.454 3.140 3.624 . 0 0 "[ . 1 . 2]" 2
1356 1 30 VAL QG 1 31 GLU QB . . 4.760 4.153 2.769 4.474 . 0 0 "[ . 1 . 2]" 2
1357 1 30 VAL QG 1 31 GLU QG . . 3.820 3.475 2.454 3.826 0.006 2 0 "[ . 1 . 2]" 2
1358 1 30 VAL QG 1 72 ARG QB . . 3.220 2.226 1.787 3.247 0.027 20 0 "[ . 1 . 2]" 2
1359 1 30 VAL QG 1 72 ARG QG . . 3.930 2.991 1.941 3.776 . 0 0 "[ . 1 . 2]" 2
1360 1 30 VAL QG 1 72 ARG QD . . 3.670 2.765 1.748 3.689 0.019 15 0 "[ . 1 . 2]" 2
1361 1 30 VAL QG 1 73 GLY QA . . 4.150 3.767 2.924 4.266 0.116 20 0 "[ . 1 . 2]" 2
1362 1 31 GLU H 1 31 GLU QG . . 3.800 2.772 2.288 3.862 0.062 19 0 "[ . 1 . 2]" 2
1363 1 31 GLU H 1 32 GLY QA . . 5.340 4.396 4.294 4.495 . 0 0 "[ . 1 . 2]" 2
1364 1 31 GLU HA 1 31 GLU QG . . 3.240 2.589 2.126 3.277 0.037 7 0 "[ . 1 . 2]" 2
1365 1 31 GLU QB 1 33 ASP H . . 4.110 2.985 2.584 3.850 . 0 0 "[ . 1 . 2]" 2
1366 1 32 GLY H 1 33 ASP QB . . 5.340 3.859 3.690 4.000 . 0 0 "[ . 1 . 2]" 2
1367 1 33 ASP H 1 33 ASP QB . . 3.400 2.474 2.257 2.730 . 0 0 "[ . 1 . 2]" 2
1368 1 33 ASP HA 1 34 LEU QB . . 4.480 4.165 4.135 4.214 . 0 0 "[ . 1 . 2]" 2
1369 1 33 ASP QB 1 34 LEU H . . 3.190 2.466 2.109 2.782 . 0 0 "[ . 1 . 2]" 2
1370 1 33 ASP QB 1 34 LEU HA . . 5.140 4.468 4.292 4.709 . 0 0 "[ . 1 . 2]" 2
1371 1 33 ASP QB 1 34 LEU QB . . 4.040 3.950 3.781 4.053 0.013 6 0 "[ . 1 . 2]" 2
1372 1 34 LEU QB 1 34 LEU HG . . 2.290 2.166 2.162 2.168 . 0 0 "[ . 1 . 2]" 2
1373 1 34 LEU QB 1 34 LEU MD1 . . 2.850 2.202 2.089 2.281 . 0 0 "[ . 1 . 2]" 2
1374 1 35 PHE H 1 36 VAL QG . . 4.860 4.591 4.331 4.886 0.026 11 0 "[ . 1 . 2]" 2
1375 1 35 PHE HA 1 36 VAL QG . . 4.340 3.854 3.488 4.032 . 0 0 "[ . 1 . 2]" 2
1376 1 35 PHE QE 1 47 ARG QB . . 5.320 4.131 3.653 4.655 . 0 0 "[ . 1 . 2]" 2
1377 1 35 PHE QE 1 47 ARG QG . . 3.590 3.152 2.464 3.609 0.019 11 0 "[ . 1 . 2]" 2
1378 1 35 PHE HZ 1 47 ARG QG . . 5.330 3.260 2.776 3.873 . 0 0 "[ . 1 . 2]" 2
1379 1 36 VAL H 1 36 VAL QG . . 3.270 2.294 1.841 2.531 . 0 0 "[ . 1 . 2]" 2
1380 1 36 VAL HA 1 36 VAL QG . . 2.840 2.156 2.045 2.410 . 0 0 "[ . 1 . 2]" 2
1381 1 36 VAL QG 1 37 ALA H . . 3.680 3.314 3.140 3.450 . 0 0 "[ . 1 . 2]" 2
1382 1 36 VAL QG 1 37 ALA HA . . 4.830 4.256 3.984 4.475 . 0 0 "[ . 1 . 2]" 2
1383 1 36 VAL QG 1 37 ALA MB . . 4.330 4.005 3.758 4.171 . 0 0 "[ . 1 . 2]" 2
1384 1 36 VAL QG 1 38 CYS H . . 3.600 3.034 2.633 3.452 . 0 0 "[ . 1 . 2]" 2
1385 1 36 VAL QG 1 38 CYS QB . . 5.140 4.143 3.841 4.384 . 0 0 "[ . 1 . 2]" 2
1386 1 36 VAL QG 1 39 ASN H . . 5.280 3.826 3.436 4.150 . 0 0 "[ . 1 . 2]" 2
1387 1 36 VAL QG 1 39 ASN HA . . 3.800 2.783 2.404 3.040 . 0 0 "[ . 1 . 2]" 2
1388 1 36 VAL QG 1 39 ASN QB . . 4.300 2.652 2.273 3.494 . 0 0 "[ . 1 . 2]" 2
1389 1 36 VAL QG 1 42 GLY H . . 5.280 5.027 4.636 5.271 . 0 0 "[ . 1 . 2]" 2
1390 1 36 VAL QG 1 42 GLY HA2 . . 4.040 3.783 3.472 3.991 . 0 0 "[ . 1 . 2]" 2
1391 1 36 VAL QG 1 42 GLY HA3 . . 5.110 4.979 4.768 5.116 0.006 3 0 "[ . 1 . 2]" 2
1392 1 40 GLU H 1 40 GLU QB . . 3.120 2.293 2.121 2.596 . 0 0 "[ . 1 . 2]" 2
1393 1 40 GLU H 1 40 GLU QG . . 4.020 3.349 1.903 4.031 0.011 12 0 "[ . 1 . 2]" 2
1394 1 40 GLU HA 1 40 GLU QG . . 3.570 2.649 2.302 3.183 . 0 0 "[ . 1 . 2]" 2
1395 1 40 GLU QB 1 41 CYS H . . 3.220 2.170 2.037 2.354 . 0 0 "[ . 1 . 2]" 2
1396 1 40 GLU QB 1 41 CYS HA . . 5.340 4.089 3.932 4.395 . 0 0 "[ . 1 . 2]" 2
1397 1 40 GLU QB 1 41 CYS HB3 . . 4.680 3.454 3.264 3.788 . 0 0 "[ . 1 . 2]" 2
1398 1 40 GLU QB 1 42 GLY H . . 4.550 4.125 4.024 4.235 . 0 0 "[ . 1 . 2]" 2
1399 1 40 GLU QB 1 64 CYS HB2 . . 5.130 4.209 3.857 4.877 . 0 0 "[ . 1 . 2]" 2
1400 1 40 GLU QB 1 66 THR HB . . 4.490 3.368 3.012 3.775 . 0 0 "[ . 1 . 2]" 2
1401 1 40 GLU QB 1 66 THR MG . . 3.680 2.966 2.292 3.429 . 0 0 "[ . 1 . 2]" 2
1402 1 40 GLU QG 1 66 THR HB . . 5.340 3.566 2.614 4.363 . 0 0 "[ . 1 . 2]" 2
1403 1 40 GLU QG 1 66 THR MG . . 3.460 2.415 1.955 2.898 . 0 0 "[ . 1 . 2]" 2
1404 1 41 CYS HB2 1 63 GLN QE . . 4.150 2.665 2.177 3.602 . 0 0 "[ . 1 . 2]" 2
1405 1 41 CYS HB3 1 63 GLN QE . . 4.440 3.909 3.558 4.446 0.006 4 0 "[ . 1 . 2]" 2
1406 1 43 PHE H 1 63 GLN QB . . 4.880 4.390 4.169 4.558 . 0 0 "[ . 1 . 2]" 2
1407 1 43 PHE H 1 63 GLN QE . . 4.780 3.750 2.374 4.360 . 0 0 "[ . 1 . 2]" 2
1408 1 43 PHE HB2 1 63 GLN QB . . 3.530 2.222 2.051 2.327 . 0 0 "[ . 1 . 2]" 2
1409 1 43 PHE HB2 1 63 GLN QE . . 4.100 3.020 1.889 3.439 . 0 0 "[ . 1 . 2]" 2
1410 1 43 PHE HB3 1 63 GLN QB . . 3.840 3.330 2.868 3.505 . 0 0 "[ . 1 . 2]" 2
1411 1 43 PHE HB3 1 63 GLN QE . . 5.340 4.468 3.407 4.936 . 0 0 "[ . 1 . 2]" 2
1412 1 43 PHE QD 1 62 PRO QG . . 3.930 3.055 2.384 3.423 . 0 0 "[ . 1 . 2]" 2
1413 1 43 PHE QD 1 62 PRO QD . . 3.820 2.691 2.538 2.873 . 0 0 "[ . 1 . 2]" 2
1414 1 43 PHE QD 1 63 GLN QB . . 3.830 2.822 2.540 2.964 . 0 0 "[ . 1 . 2]" 2
1415 1 43 PHE QE 1 62 PRO QB . . 4.490 3.799 3.319 4.032 . 0 0 "[ . 1 . 2]" 2
1416 1 43 PHE QE 1 62 PRO QG . . 3.350 2.077 1.929 2.294 . 0 0 "[ . 1 . 2]" 2
1417 1 43 PHE QE 1 62 PRO QD . . 4.010 3.051 2.609 3.651 . 0 0 "[ . 1 . 2]" 2
1418 1 45 ALA MB 1 53 GLU QB . . 5.340 4.827 4.478 4.975 . 0 0 "[ . 1 . 2]" 2
1419 1 45 ALA MB 1 62 PRO QD . . 5.210 4.274 3.899 4.556 . 0 0 "[ . 1 . 2]" 2
1420 1 46 CYS HB2 1 47 ARG QB . . 5.030 3.756 3.698 3.813 . 0 0 "[ . 1 . 2]" 2
1421 1 46 CYS HB2 1 48 PRO QG . . 5.350 3.174 3.096 3.234 . 0 0 "[ . 1 . 2]" 2
1422 1 47 ARG H 1 47 ARG QB . . 3.400 2.136 2.104 2.232 . 0 0 "[ . 1 . 2]" 2
1423 1 47 ARG HA 1 47 ARG QG . . 3.570 2.161 2.101 2.486 . 0 0 "[ . 1 . 2]" 2
1424 1 47 ARG HA 1 47 ARG QD . . 4.630 3.695 2.443 4.067 . 0 0 "[ . 1 . 2]" 2
1425 1 47 ARG QB 1 47 ARG QD . . 3.230 2.395 2.119 2.617 . 0 0 "[ . 1 . 2]" 2
1426 1 47 ARG QB 1 47 ARG HE . . 4.250 2.283 1.798 3.012 . 0 0 "[ . 1 . 2]" 2
1427 1 47 ARG QB 1 48 PRO HD2 . . 3.560 2.709 2.580 2.734 . 0 0 "[ . 1 . 2]" 2
1428 1 47 ARG QB 1 48 PRO HD3 . . 3.280 1.864 1.778 1.993 . 0 0 "[ . 1 . 2]" 2
1429 1 47 ARG QB 1 49 CYS H . . 5.340 4.205 4.162 4.347 . 0 0 "[ . 1 . 2]" 2
1430 1 47 ARG QG 1 49 CYS H . . 5.340 4.798 4.323 5.156 . 0 0 "[ . 1 . 2]" 2
1431 1 47 ARG QG 1 51 GLU H . . 4.660 4.340 4.028 4.723 0.063 7 0 "[ . 1 . 2]" 2
1432 1 47 ARG QG 1 51 GLU QG . . 3.850 3.031 2.674 3.882 0.032 11 0 "[ . 1 . 2]" 2
1433 1 47 ARG QG 1 73 GLY H . . 5.340 4.682 3.916 5.371 0.031 20 0 "[ . 1 . 2]" 2
1434 1 47 ARG QG 1 73 GLY QA . . 4.800 3.671 3.163 4.337 . 0 0 "[ . 1 . 2]" 2
1435 1 47 ARG QD 1 48 PRO HD3 . . 5.130 4.682 3.852 5.004 . 0 0 "[ . 1 . 2]" 2
1436 1 47 ARG QD 1 73 GLY H . . 4.680 4.395 3.628 4.701 0.021 7 0 "[ . 1 . 2]" 2
1437 1 48 PRO HA 1 51 GLU QG . . 5.150 4.746 4.367 5.004 . 0 0 "[ . 1 . 2]" 2
1438 1 48 PRO QB 1 49 CYS H . . 3.880 3.849 3.806 3.888 0.008 7 0 "[ . 1 . 2]" 2
1439 1 48 PRO QG 1 49 CYS H . . 4.970 3.598 3.482 3.711 . 0 0 "[ . 1 . 2]" 2
1440 1 50 TYR H 1 53 GLU QB . . 5.340 4.868 4.609 5.073 . 0 0 "[ . 1 . 2]" 2
1441 1 50 TYR HA 1 53 GLU QB . . 3.660 2.749 2.507 2.984 . 0 0 "[ . 1 . 2]" 2
1442 1 50 TYR HH 1 54 ARG QD . . 4.460 2.609 2.087 2.968 . 0 0 "[ . 1 . 2]" 2
1443 1 50 TYR HH 1 68 TYR QB . . 4.730 3.082 2.572 3.503 . 0 0 "[ . 1 . 2]" 2
1444 1 51 GLU HA 1 51 GLU QG . . 3.420 2.382 2.199 2.559 . 0 0 "[ . 1 . 2]" 2
1445 1 51 GLU HA 1 54 ARG QD . . 4.990 3.739 3.196 4.253 . 0 0 "[ . 1 . 2]" 2
1446 1 51 GLU QG 1 52 TYR H . . 4.970 4.207 3.974 4.435 . 0 0 "[ . 1 . 2]" 2
1447 1 51 GLU QG 1 73 GLY H . . 4.790 4.701 4.405 4.819 0.029 14 0 "[ . 1 . 2]" 2
1448 1 51 GLU QG 1 73 GLY QA . . 4.860 3.610 2.970 4.054 . 0 0 "[ . 1 . 2]" 2
1449 1 51 GLU QG 1 74 SER QB . . 4.650 2.304 1.908 3.416 . 0 0 "[ . 1 . 2]" 2
1450 1 51 GLU QG 1 75 PRO HD2 . . 5.010 3.438 3.192 3.994 . 0 0 "[ . 1 . 2]" 2
1451 1 51 GLU QG 1 75 PRO HD3 . . 4.540 3.934 3.620 4.486 . 0 0 "[ . 1 . 2]" 2
1452 1 52 TYR HA 1 55 ARG QG . . 4.540 3.939 3.508 4.280 . 0 0 "[ . 1 . 2]" 2
1453 1 53 GLU H 1 53 GLU QB . . 3.060 2.204 2.128 2.260 . 0 0 "[ . 1 . 2]" 2
1454 1 53 GLU QB 1 54 ARG H . . 3.620 2.728 2.402 2.970 . 0 0 "[ . 1 . 2]" 2
1455 1 53 GLU QB 1 58 THR H . . 5.340 4.751 4.557 4.971 . 0 0 "[ . 1 . 2]" 2
1456 1 53 GLU QB 1 59 GLN H . . 4.830 4.182 3.900 4.531 . 0 0 "[ . 1 . 2]" 2
1457 1 54 ARG H 1 54 ARG QD . . 4.760 3.953 3.601 4.474 . 0 0 "[ . 1 . 2]" 2
1458 1 54 ARG HA 1 59 GLN QB . . 3.910 3.462 3.024 3.735 . 0 0 "[ . 1 . 2]" 2
1459 1 54 ARG HB3 1 54 ARG QD . . 3.650 2.874 2.312 3.207 . 0 0 "[ . 1 . 2]" 2
1460 1 54 ARG HG2 1 59 GLN QB . . 4.760 2.899 2.094 3.363 . 0 0 "[ . 1 . 2]" 2
1461 1 54 ARG HG2 1 68 TYR QB . . 4.000 3.110 2.740 3.505 . 0 0 "[ . 1 . 2]" 2
1462 1 54 ARG HG3 1 59 GLN QB . . 4.880 3.670 3.075 4.575 . 0 0 "[ . 1 . 2]" 2
1463 1 54 ARG HG3 1 68 TYR QB . . 4.370 3.173 2.687 3.599 . 0 0 "[ . 1 . 2]" 2
1464 1 54 ARG QD 1 68 TYR QB . . 3.420 2.079 1.940 2.393 . 0 0 "[ . 1 . 2]" 2
1465 1 54 ARG QD 1 68 TYR QE . . 4.320 4.004 3.561 4.323 0.003 20 0 "[ . 1 . 2]" 2
1466 1 54 ARG QD 1 74 SER HG . . 4.890 3.150 1.932 4.164 . 0 0 "[ . 1 . 2]" 2
1467 1 54 ARG QH1 1 70 ARG QB . . 4.940 4.084 2.835 4.948 0.008 15 0 "[ . 1 . 2]" 2
1468 1 54 ARG QH1 1 76 ARG HA . . 4.030 3.816 2.834 4.042 0.012 17 0 "[ . 1 . 2]" 2
1469 1 54 ARG QH1 1 77 VAL MG1 . . 4.250 3.454 2.046 4.220 . 0 0 "[ . 1 . 2]" 2
1470 1 54 ARG QH1 1 77 VAL MG2 . . 3.380 2.707 2.336 3.364 . 0 0 "[ . 1 . 2]" 2
1471 1 55 ARG H 1 55 ARG QD . . 4.670 4.310 4.035 4.435 . 0 0 "[ . 1 . 2]" 2
1472 1 55 ARG HA 1 55 ARG QG . . 3.140 2.428 2.197 3.263 0.123 13 0 "[ . 1 . 2]" 2
1473 1 55 ARG HA 1 55 ARG QD . . 4.170 3.287 2.008 4.175 0.005 17 0 "[ . 1 . 2]" 2
1474 1 55 ARG HB2 1 55 ARG QG . . 2.580 2.172 2.137 2.279 . 0 0 "[ . 1 . 2]" 2
1475 1 55 ARG HB3 1 55 ARG QD . . 3.280 2.281 2.007 3.332 0.052 13 0 "[ . 1 . 2]" 2
1476 1 55 ARG QD 1 56 GLU QG . . 3.660 2.041 1.816 2.503 . 0 0 "[ . 1 . 2]" 2
1477 1 58 THR MG 1 60 ASN QD . . 4.470 3.373 3.053 3.871 . 0 0 "[ . 1 . 2]" 2
1478 1 59 GLN H 1 59 GLN QB . . 3.690 3.376 3.269 3.470 . 0 0 "[ . 1 . 2]" 2
1479 1 59 GLN QE 1 59 GLN HG2 . . 3.300 2.544 2.200 2.951 . 0 0 "[ . 1 . 2]" 2
1480 1 59 GLN QE 1 77 VAL MG1 . . 4.560 4.054 3.440 4.534 . 0 0 "[ . 1 . 2]" 2
1481 1 59 GLN QE 1 78 GLU H . . 5.340 3.741 2.971 4.588 . 0 0 "[ . 1 . 2]" 2
1482 1 59 GLN QE 1 78 GLU QB . . 3.980 3.051 1.888 3.916 . 0 0 "[ . 1 . 2]" 2
1483 1 59 GLN QE 1 78 GLU QG . . 5.340 3.958 1.749 5.282 . 0 0 "[ . 1 . 2]" 2
1484 1 60 ASN H 1 60 ASN QD . . 4.500 3.654 3.154 4.146 . 0 0 "[ . 1 . 2]" 2
1485 1 60 ASN HB2 1 60 ASN QD . . 3.390 2.140 2.095 2.336 . 0 0 "[ . 1 . 2]" 2
1486 1 61 CYS H 1 62 PRO QD . . 4.740 4.207 4.138 4.274 . 0 0 "[ . 1 . 2]" 2
1487 1 61 CYS HA 1 62 PRO QD . . 2.710 1.902 1.881 1.936 . 0 0 "[ . 1 . 2]" 2
1488 1 61 CYS HB2 1 62 PRO QD . . 4.060 3.676 3.562 3.769 . 0 0 "[ . 1 . 2]" 2
1489 1 61 CYS HB3 1 62 PRO QD . . 5.140 4.014 3.906 4.079 . 0 0 "[ . 1 . 2]" 2
1490 1 62 PRO HA 1 65 LYS QE . . 4.450 2.514 2.024 4.147 . 0 0 "[ . 1 . 2]" 2
1491 1 62 PRO QB 1 63 GLN H . . 4.070 3.739 3.719 3.758 . 0 0 "[ . 1 . 2]" 2
1492 1 62 PRO QB 1 63 GLN HA . . 5.300 4.300 4.278 4.330 . 0 0 "[ . 1 . 2]" 2
1493 1 62 PRO QG 1 63 GLN H . . 4.380 3.315 3.271 3.360 . 0 0 "[ . 1 . 2]" 2
1494 1 62 PRO QD 1 63 GLN H . . 3.800 2.977 2.946 3.009 . 0 0 "[ . 1 . 2]" 2
1495 1 62 PRO QD 1 68 TYR HH . . 4.110 3.050 2.536 3.817 . 0 0 "[ . 1 . 2]" 2
1496 1 63 GLN H 1 63 GLN QB . . 3.160 2.402 2.368 2.440 . 0 0 "[ . 1 . 2]" 2
1497 1 63 GLN HA 1 65 LYS QE . . 4.950 4.510 3.279 4.910 . 0 0 "[ . 1 . 2]" 2
1498 1 63 GLN QB 1 63 GLN QE . . 3.770 3.202 2.596 3.354 . 0 0 "[ . 1 . 2]" 2
1499 1 63 GLN QB 1 64 CYS H . . 3.300 2.574 2.490 2.647 . 0 0 "[ . 1 . 2]" 2
1500 1 63 GLN QB 1 65 LYS H . . 5.030 4.188 4.096 4.260 . 0 0 "[ . 1 . 2]" 2
1501 1 65 LYS H 1 65 LYS QB . . 3.570 3.320 3.193 3.411 . 0 0 "[ . 1 . 2]" 2
1502 1 65 LYS H 1 65 LYS QG . . 3.920 2.814 2.384 3.456 . 0 0 "[ . 1 . 2]" 2
1503 1 65 LYS H 1 65 LYS QD . . 3.950 2.977 2.251 3.456 . 0 0 "[ . 1 . 2]" 2
1504 1 65 LYS HA 1 65 LYS QD . . 3.660 2.847 2.445 3.356 . 0 0 "[ . 1 . 2]" 2
1505 1 65 LYS HA 1 65 LYS QE . . 4.730 4.330 3.881 4.667 . 0 0 "[ . 1 . 2]" 2
1506 1 65 LYS QB 1 65 LYS QD . . 3.120 2.153 2.076 2.353 . 0 0 "[ . 1 . 2]" 2
1507 1 65 LYS QB 1 65 LYS QE . . 4.300 3.620 2.967 3.790 . 0 0 "[ . 1 . 2]" 2
1508 1 65 LYS QE 1 65 LYS QG . . 2.980 2.195 2.017 2.311 . 0 0 "[ . 1 . 2]" 2
1509 1 66 THR HA 1 67 ARG QB . . 4.660 4.519 4.443 4.560 . 0 0 "[ . 1 . 2]" 2
1510 1 66 THR MG 1 67 ARG QB . . 3.990 3.594 3.487 3.702 . 0 0 "[ . 1 . 2]" 2
1511 1 66 THR MG 1 67 ARG QD . . 4.770 3.967 3.701 4.177 . 0 0 "[ . 1 . 2]" 2
1512 1 67 ARG H 1 67 ARG QB . . 3.090 2.534 2.450 2.600 . 0 0 "[ . 1 . 2]" 2
1513 1 67 ARG H 1 67 ARG QD . . 4.340 3.978 3.673 4.300 . 0 0 "[ . 1 . 2]" 2
1514 1 67 ARG QB 1 67 ARG QD . . 3.320 2.154 2.028 2.364 . 0 0 "[ . 1 . 2]" 2
1515 1 67 ARG QB 1 68 TYR H . . 3.490 3.122 3.000 3.300 . 0 0 "[ . 1 . 2]" 2
1516 1 68 TYR H 1 68 TYR QB . . 3.330 2.161 2.119 2.295 . 0 0 "[ . 1 . 2]" 2
1517 1 68 TYR QB 1 69 LYS H . . 3.720 2.157 1.952 2.578 . 0 0 "[ . 1 . 2]" 2
1518 1 68 TYR QB 1 69 LYS QD . . 5.210 3.916 3.568 5.202 . 0 0 "[ . 1 . 2]" 2
1519 1 70 ARG H 1 70 ARG QG . . 4.210 3.781 2.679 3.969 . 0 0 "[ . 1 . 2]" 2
1520 1 70 ARG H 1 70 ARG QD . . 4.840 4.198 3.976 4.913 0.073 8 0 "[ . 1 . 2]" 2
1521 1 70 ARG HA 1 70 ARG QG . . 3.210 2.186 2.124 2.408 . 0 0 "[ . 1 . 2]" 2
1522 1 70 ARG QB 1 70 ARG QD . . 2.980 2.144 2.022 2.602 . 0 0 "[ . 1 . 2]" 2
1523 1 70 ARG QG 1 71 LEU H . . 3.610 3.194 2.932 3.613 0.003 8 0 "[ . 1 . 2]" 2
1524 1 70 ARG QG 1 76 ARG HA . . 3.770 3.164 2.512 3.624 . 0 0 "[ . 1 . 2]" 2
1525 1 70 ARG QD 1 76 ARG H . . 5.340 3.140 1.905 4.148 . 0 0 "[ . 1 . 2]" 2
1526 1 70 ARG QD 1 76 ARG HA . . 3.520 2.419 2.010 2.869 . 0 0 "[ . 1 . 2]" 2
1527 1 70 ARG QD 1 76 ARG QB . . 4.000 2.422 1.938 3.367 . 0 0 "[ . 1 . 2]" 2
1528 1 70 ARG QD 1 77 VAL H . . 4.590 4.170 3.484 4.606 0.016 4 0 "[ . 1 . 2]" 2
1529 1 71 LEU H 1 74 SER QB . . 5.340 2.832 1.831 3.959 . 0 0 "[ . 1 . 2]" 2
1530 1 71 LEU QB 1 74 SER QB . . 4.600 2.627 1.911 3.545 . 0 0 "[ . 1 . 2]" 2
1531 1 71 LEU HG 1 74 SER QB . . 5.340 3.616 2.701 4.449 . 0 0 "[ . 1 . 2]" 2
1532 1 71 LEU MD1 1 74 SER QB . . 4.890 3.293 2.796 3.775 . 0 0 "[ . 1 . 2]" 2
1533 1 72 ARG H 1 72 ARG QG . . 3.130 2.468 1.898 2.971 . 0 0 "[ . 1 . 2]" 2
1534 1 72 ARG HA 1 72 ARG QG . . 3.540 2.739 2.200 3.447 . 0 0 "[ . 1 . 2]" 2
1535 1 72 ARG QB 1 72 ARG QG . . 2.430 2.031 2.005 2.084 . 0 0 "[ . 1 . 2]" 2
1536 1 72 ARG QB 1 73 GLY QA . . 5.200 3.678 3.480 4.172 . 0 0 "[ . 1 . 2]" 2
1537 1 73 GLY H 1 74 SER QB . . 4.770 4.326 3.653 4.692 . 0 0 "[ . 1 . 2]" 2
1538 1 73 GLY QA 1 74 SER QB . . 5.180 4.282 3.954 4.676 . 0 0 "[ . 1 . 2]" 2
1539 1 74 SER H 1 74 SER QB . . 3.260 2.400 2.167 2.837 . 0 0 "[ . 1 . 2]" 2
1540 1 74 SER HA 1 75 PRO QG . . 4.280 3.770 3.765 3.783 . 0 0 "[ . 1 . 2]" 2
1541 1 74 SER QB 1 75 PRO HD2 . . 4.120 3.520 3.086 3.945 . 0 0 "[ . 1 . 2]" 2
1542 1 74 SER QB 1 75 PRO HD3 . . 5.340 4.319 4.108 4.475 . 0 0 "[ . 1 . 2]" 2
1543 1 75 PRO QG 1 76 ARG H . . 4.680 4.064 3.610 4.529 . 0 0 "[ . 1 . 2]" 2
1544 1 76 ARG HA 1 76 ARG QG . . 3.370 2.488 2.308 2.615 . 0 0 "[ . 1 . 2]" 2
1545 1 76 ARG QB 1 80 ASP QB . . 5.080 3.587 1.916 4.890 . 0 0 "[ . 1 . 2]" 2
1546 1 76 ARG QG 1 77 VAL H . . 3.210 2.156 1.876 2.701 . 0 0 "[ . 1 . 2]" 2
1547 1 76 ARG QG 1 77 VAL HA . . 4.500 3.725 3.336 4.060 . 0 0 "[ . 1 . 2]" 2
1548 1 76 ARG QG 1 77 VAL HB . . 5.340 5.315 5.156 5.409 0.069 4 0 "[ . 1 . 2]" 2
1549 1 76 ARG QG 1 80 ASP QB . . 3.410 2.359 1.828 3.114 . 0 0 "[ . 1 . 2]" 2
1550 1 77 VAL H 1 80 ASP QB . . 3.870 3.372 2.658 3.888 0.018 11 0 "[ . 1 . 2]" 2
1551 1 77 VAL HA 1 78 GLU QB . . 4.900 4.698 4.414 4.929 0.029 6 0 "[ . 1 . 2]" 2
1552 1 77 VAL HB 1 78 GLU QB . . 4.070 3.811 3.569 3.979 . 0 0 "[ . 1 . 2]" 2
1553 1 77 VAL MG2 1 78 GLU QB . . 4.850 3.836 2.520 4.476 . 0 0 "[ . 1 . 2]" 2
1554 1 78 GLU H 1 78 GLU QB . . 3.170 2.548 2.182 3.186 0.016 9 0 "[ . 1 . 2]" 2
1555 1 78 GLU HA 1 79 GLY QA . . 4.340 3.971 3.901 4.171 . 0 0 "[ . 1 . 2]" 2
1556 1 78 GLU QB 1 79 GLY H . . 4.280 3.583 1.925 4.037 . 0 0 "[ . 1 . 2]" 2
1557 1 79 GLY H 1 80 ASP QB . . 5.100 3.927 3.285 4.955 . 0 0 "[ . 1 . 2]" 2
1558 1 80 ASP H 1 80 ASP QB . . 3.070 2.369 2.155 2.822 . 0 0 "[ . 1 . 2]" 2
1559 1 80 ASP QB 1 81 GLU H . . 3.740 3.117 1.961 3.768 0.028 17 0 "[ . 1 . 2]" 2
1560 1 81 GLU H 1 81 GLU QG . . 4.590 3.866 2.214 4.266 . 0 0 "[ . 1 . 2]" 2
1561 1 81 GLU HA 1 82 ASP QB . . 5.340 4.588 4.018 5.227 . 0 0 "[ . 1 . 2]" 2
1562 1 81 GLU QB 1 82 ASP H . . 3.790 3.554 2.531 3.774 . 0 0 "[ . 1 . 2]" 2
1563 1 82 ASP H 1 82 ASP QB . . 3.270 2.582 2.133 3.239 . 0 0 "[ . 1 . 2]" 2
1564 1 82 ASP QB 1 83 GLU H . . 3.480 2.477 1.984 3.248 . 0 0 "[ . 1 . 2]" 2
1565 1 83 GLU H 1 83 GLU QB . . 3.270 2.556 2.173 3.149 . 0 0 "[ . 1 . 2]" 2
1566 1 84 GLU H 1 84 GLU QB . . 3.210 2.577 2.222 3.033 . 0 0 "[ . 1 . 2]" 2
1567 1 84 GLU H 1 84 GLU QG . . 4.540 3.339 1.884 4.407 . 0 0 "[ . 1 . 2]" 2
1568 1 84 GLU HA 1 84 GLU QG . . 3.720 2.658 2.219 3.505 . 0 0 "[ . 1 . 2]" 2
1569 1 84 GLU QB 1 85 ASP H . . 3.990 3.285 2.144 4.006 0.016 10 0 "[ . 1 . 2]" 2
1570 1 84 GLU QB 1 85 ASP HA . . 5.340 4.429 3.937 4.957 . 0 0 "[ . 1 . 2]" 2
1571 1 85 ASP QB 1 86 ILE H . . 4.090 3.495 2.349 4.034 . 0 0 "[ . 1 . 2]" 2
1572 1 86 ILE H 1 86 ILE QG . . 3.710 2.417 1.891 3.477 . 0 0 "[ . 1 . 2]" 2
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