NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
507295 |
2ecw   |
11161 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ecw
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 27
_Distance_constraint_stats_list.Viol_count 235
_Distance_constraint_stats_list.Viol_total 19.279
_Distance_constraint_stats_list.Viol_max 0.028
_Distance_constraint_stats_list.Viol_rms 0.0033
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0018
_Distance_constraint_stats_list.Viol_average_violations_only 0.0041
_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 22 CYS 0.174 0.016 14 0 "[ . 1 . 2]"
1 25 CYS 0.076 0.014 14 0 "[ . 1 . 2]"
1 37 CYS 0.353 0.013 20 0 "[ . 1 . 2]"
1 39 HIS 0.133 0.028 13 0 "[ . 1 . 2]"
1 42 CYS 0.088 0.006 8 0 "[ . 1 . 2]"
1 45 CYS 0.048 0.008 14 0 "[ . 1 . 2]"
1 62 CYS 0.149 0.028 13 0 "[ . 1 . 2]"
1 65 CYS 0.254 0.020 12 0 "[ . 1 . 2]"
2 1 ZN 0.230 0.016 14 0 "[ . 1 . 2]"
3 1 ZN 0.424 0.020 12 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 22 CYS SG 2 1 ZN ZN . 2.190 2.390 2.391 2.383 2.402 0.012 8 0 "[ . 1 . 2]" 1
2 1 22 CYS CB 2 1 ZN ZN . 3.250 3.510 3.246 3.234 3.251 0.016 14 0 "[ . 1 . 2]" 1
3 1 25 CYS SG 2 1 ZN ZN . 2.190 2.390 2.260 2.187 2.392 0.003 4 0 "[ . 1 . 2]" 1
4 1 25 CYS CB 2 1 ZN ZN . 3.250 3.510 3.385 3.249 3.517 0.007 8 0 "[ . 1 . 2]" 1
5 1 42 CYS SG 2 1 ZN ZN . 2.190 2.390 2.380 2.312 2.396 0.006 8 0 "[ . 1 . 2]" 1
6 1 42 CYS CB 2 1 ZN ZN . 3.250 3.510 3.256 3.246 3.325 0.004 12 0 "[ . 1 . 2]" 1
7 1 45 CYS SG 2 1 ZN ZN . 2.190 2.390 2.193 2.182 2.250 0.008 14 0 "[ . 1 . 2]" 1
8 1 45 CYS CB 2 1 ZN ZN . 3.250 3.510 3.355 3.261 3.435 . 0 0 "[ . 1 . 2]" 1
9 1 22 CYS SG 1 25 CYS SG . 3.560 3.960 3.574 3.546 3.651 0.014 14 0 "[ . 1 . 2]" 1
10 1 22 CYS SG 1 42 CYS SG . 3.560 3.960 3.596 3.555 3.779 0.005 8 0 "[ . 1 . 2]" 1
11 1 22 CYS SG 1 45 CYS SG . 3.560 3.960 3.899 3.693 3.968 0.008 7 0 "[ . 1 . 2]" 1
12 1 25 CYS SG 1 42 CYS SG . 3.560 3.960 3.599 3.555 3.742 0.005 12 0 "[ . 1 . 2]" 1
13 1 25 CYS SG 1 45 CYS SG . 3.560 3.960 3.907 3.703 3.963 0.003 18 0 "[ . 1 . 2]" 1
14 1 42 CYS SG 1 45 CYS SG . 3.560 3.960 3.822 3.703 3.939 . 0 0 "[ . 1 . 2]" 1
15 1 37 CYS SG 3 1 ZN ZN . 2.190 2.390 2.394 2.366 2.403 0.013 20 0 "[ . 1 . 2]" 1
16 1 37 CYS CB 3 1 ZN ZN . 3.250 3.510 3.249 3.237 3.322 0.013 20 0 "[ . 1 . 2]" 1
17 1 39 HIS ND1 3 1 ZN ZN . . 2.100 1.983 1.883 2.098 0.017 13 0 "[ . 1 . 2]" 1
18 1 62 CYS SG 3 1 ZN ZN . 2.190 2.390 2.324 2.209 2.392 0.002 12 0 "[ . 1 . 2]" 1
19 1 62 CYS CB 3 1 ZN ZN . 3.250 3.510 3.260 3.232 3.380 0.018 13 0 "[ . 1 . 2]" 1
20 1 65 CYS SG 3 1 ZN ZN . 2.190 2.390 2.250 2.174 2.377 0.016 12 0 "[ . 1 . 2]" 1
21 1 65 CYS CB 3 1 ZN ZN . 3.250 3.510 3.510 3.427 3.530 0.020 12 0 "[ . 1 . 2]" 1
22 1 37 CYS SG 1 39 HIS ND1 . 3.320 3.720 3.327 3.310 3.444 0.010 13 0 "[ . 1 . 2]" 1
23 1 37 CYS SG 1 62 CYS SG . 3.560 3.960 3.772 3.555 3.962 0.005 9 0 "[ . 1 . 2]" 1
24 1 37 CYS SG 1 65 CYS SG . 3.560 3.960 3.560 3.551 3.614 0.009 7 0 "[ . 1 . 2]" 1
25 1 39 HIS ND1 1 62 CYS SG . 3.320 3.720 3.693 3.515 3.748 0.028 13 0 "[ . 1 . 2]" 1
26 1 39 HIS ND1 1 65 CYS SG . 3.320 3.720 3.698 3.532 3.725 0.005 9 0 "[ . 1 . 2]" 1
27 1 62 CYS SG 1 65 CYS SG . 3.560 3.960 3.699 3.548 3.970 0.012 13 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 1123
_Distance_constraint_stats_list.Viol_count 462
_Distance_constraint_stats_list.Viol_total 207.380
_Distance_constraint_stats_list.Viol_max 0.268
_Distance_constraint_stats_list.Viol_rms 0.0057
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0224
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 8 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 VAL 0.085 0.084 5 0 "[ . 1 . 2]"
1 13 LEU 0.142 0.084 5 0 "[ . 1 . 2]"
1 14 GLU 0.040 0.040 11 0 "[ . 1 . 2]"
1 15 MET 0.240 0.096 9 0 "[ . 1 . 2]"
1 16 ILE 0.096 0.046 16 0 "[ . 1 . 2]"
1 17 LYS 0.737 0.151 9 0 "[ . 1 . 2]"
1 18 GLU 0.477 0.083 11 0 "[ . 1 . 2]"
1 19 GLU 0.178 0.100 8 0 "[ . 1 . 2]"
1 20 VAL 0.649 0.100 8 0 "[ . 1 . 2]"
1 21 THR 0.378 0.034 17 0 "[ . 1 . 2]"
1 22 CYS 0.127 0.027 14 0 "[ . 1 . 2]"
1 23 PRO 0.069 0.014 8 0 "[ . 1 . 2]"
1 24 ILE 0.134 0.021 7 0 "[ . 1 . 2]"
1 25 CYS 0.017 0.017 11 0 "[ . 1 . 2]"
1 26 LEU 0.022 0.012 18 0 "[ . 1 . 2]"
1 27 GLU 0.461 0.037 3 0 "[ . 1 . 2]"
1 28 LEU 0.498 0.058 12 0 "[ . 1 . 2]"
1 29 LEU 0.621 0.062 8 0 "[ . 1 . 2]"
1 30 LYS 0.188 0.135 20 0 "[ . 1 . 2]"
1 31 GLU 0.061 0.028 11 0 "[ . 1 . 2]"
1 32 PRO 0.064 0.025 15 0 "[ . 1 . 2]"
1 33 VAL 0.322 0.041 13 0 "[ . 1 . 2]"
1 34 SER 0.307 0.047 15 0 "[ . 1 . 2]"
1 35 ALA 0.227 0.038 13 0 "[ . 1 . 2]"
1 36 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 CYS 0.401 0.056 10 0 "[ . 1 . 2]"
1 38 ASN 0.396 0.056 10 0 "[ . 1 . 2]"
1 39 HIS 0.326 0.062 13 0 "[ . 1 . 2]"
1 40 SER 0.277 0.034 10 0 "[ . 1 . 2]"
1 41 PHE 0.366 0.037 7 0 "[ . 1 . 2]"
1 42 CYS 0.123 0.027 14 0 "[ . 1 . 2]"
1 43 ARG 0.837 0.268 17 0 "[ . 1 . 2]"
1 44 ALA 0.005 0.005 6 0 "[ . 1 . 2]"
1 45 CYS 0.068 0.016 14 0 "[ . 1 . 2]"
1 46 ILE 0.254 0.037 7 0 "[ . 1 . 2]"
1 47 THR 0.005 0.005 6 0 "[ . 1 . 2]"
1 48 LEU 0.502 0.221 14 0 "[ . 1 . 2]"
1 49 ASN 0.376 0.159 18 0 "[ . 1 . 2]"
1 50 TYR 0.036 0.018 10 0 "[ . 1 . 2]"
1 51 GLU 0.241 0.221 14 0 "[ . 1 . 2]"
1 52 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ASN 0.271 0.050 14 0 "[ . 1 . 2]"
1 54 ARG 0.862 0.194 19 0 "[ . 1 . 2]"
1 55 ASN 0.165 0.052 15 0 "[ . 1 . 2]"
1 56 THR 0.078 0.048 14 0 "[ . 1 . 2]"
1 57 ASP 0.078 0.048 14 0 "[ . 1 . 2]"
1 58 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 LYS 0.037 0.013 14 0 "[ . 1 . 2]"
1 60 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 ASN 0.258 0.084 16 0 "[ . 1 . 2]"
1 62 CYS 0.308 0.088 12 0 "[ . 1 . 2]"
1 63 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 VAL 0.295 0.062 13 0 "[ . 1 . 2]"
1 65 CYS 0.025 0.009 15 0 "[ . 1 . 2]"
1 66 ARG 0.143 0.084 16 0 "[ . 1 . 2]"
1 67 VAL 0.235 0.083 19 0 "[ . 1 . 2]"
1 68 PRO 0.163 0.083 19 0 "[ . 1 . 2]"
1 69 TYR 0.459 0.088 12 0 "[ . 1 . 2]"
1 70 PRO 0.002 0.002 8 0 "[ . 1 . 2]"
1 71 PHE 0.071 0.037 10 0 "[ . 1 . 2]"
1 72 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 LEU 0.107 0.025 13 0 "[ . 1 . 2]"
1 75 LYS 0.156 0.047 15 0 "[ . 1 . 2]"
1 76 PRO 0.738 0.178 18 0 "[ . 1 . 2]"
1 77 ASN 0.822 0.178 18 0 "[ . 1 . 2]"
1 78 LEU 0.196 0.069 20 0 "[ . 1 . 2]"
1 79 HIS 0.030 0.030 16 0 "[ . 1 . 2]"
1 80 VAL 0.516 0.179 16 0 "[ . 1 . 2]"
1 81 ALA 0.256 0.077 12 0 "[ . 1 . 2]"
1 82 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 ILE 0.384 0.095 11 0 "[ . 1 . 2]"
1 84 VAL 0.458 0.087 2 0 "[ . 1 . 2]"
1 85 GLU 0.194 0.061 2 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 22 CYS H 1 29 LEU H . . 4.320 4.125 3.830 4.330 0.010 11 0 "[ . 1 . 2]" 2
2 1 21 THR HA 1 22 CYS H . . 2.950 2.280 2.197 2.382 . 0 0 "[ . 1 . 2]" 2
3 1 22 CYS H 1 26 LEU HA . . 4.080 3.770 3.462 4.067 . 0 0 "[ . 1 . 2]" 2
4 1 22 CYS H 1 22 CYS HB3 . . 2.960 2.750 2.550 2.891 . 0 0 "[ . 1 . 2]" 2
5 1 22 CYS H 1 29 LEU HG . . 4.330 2.526 2.202 2.914 . 0 0 "[ . 1 . 2]" 2
6 1 22 CYS H 1 29 LEU HA . . 4.690 4.450 4.210 4.700 0.010 7 0 "[ . 1 . 2]" 2
7 1 22 CYS H 1 22 CYS HB2 . . 3.370 2.343 2.230 2.518 . 0 0 "[ . 1 . 2]" 2
8 1 22 CYS H 1 29 LEU MD2 . . 3.990 2.811 2.430 3.195 . 0 0 "[ . 1 . 2]" 2
9 1 33 VAL H 1 40 SER HA . . 4.680 3.712 3.488 4.103 . 0 0 "[ . 1 . 2]" 2
10 1 32 PRO HA 1 33 VAL H . . 3.040 2.362 2.214 2.559 . 0 0 "[ . 1 . 2]" 2
11 1 32 PRO HB3 1 33 VAL H . . 4.210 3.516 3.279 3.772 . 0 0 "[ . 1 . 2]" 2
12 1 32 PRO HB2 1 33 VAL H . . 3.940 2.725 2.244 3.178 . 0 0 "[ . 1 . 2]" 2
13 1 33 VAL H 1 33 VAL MG2 . . 3.190 2.114 1.963 2.290 . 0 0 "[ . 1 . 2]" 2
14 1 33 VAL H 1 42 CYS HA . . 4.870 4.674 4.495 4.835 . 0 0 "[ . 1 . 2]" 2
15 1 62 CYS H 1 67 VAL MG1 . . 5.500 3.916 3.234 5.098 . 0 0 "[ . 1 . 2]" 2
16 1 62 CYS H 1 67 VAL MG2 . . 5.500 5.014 4.494 5.430 . 0 0 "[ . 1 . 2]" 2
17 1 61 ASN HB3 1 62 CYS H . . 4.770 3.539 2.793 4.044 . 0 0 "[ . 1 . 2]" 2
18 1 33 VAL H 1 40 SER QB . . 4.800 3.206 2.809 4.184 . 0 0 "[ . 1 . 2]" 2
19 1 21 THR H 1 22 CYS H . . 4.840 4.605 4.480 4.647 . 0 0 "[ . 1 . 2]" 2
20 1 62 CYS H 1 67 VAL H . . 4.390 2.343 2.075 2.924 . 0 0 "[ . 1 . 2]" 2
21 1 62 CYS H 1 69 TYR QD . . 3.860 3.729 3.421 3.948 0.088 12 0 "[ . 1 . 2]" 2
22 1 62 CYS H 1 69 TYR QE . . 4.610 3.407 2.986 3.673 . 0 0 "[ . 1 . 2]" 2
23 1 62 CYS H 1 68 PRO HA . . 4.820 4.637 4.431 4.781 . 0 0 "[ . 1 . 2]" 2
24 1 61 ASN HA 1 62 CYS H . . 3.120 2.226 2.172 2.344 . 0 0 "[ . 1 . 2]" 2
25 1 62 CYS H 1 66 ARG HA . . 4.430 2.294 2.069 2.508 . 0 0 "[ . 1 . 2]" 2
26 1 62 CYS H 1 62 CYS HB2 . . 3.310 2.565 2.332 2.709 . 0 0 "[ . 1 . 2]" 2
27 1 61 ASN HB2 1 62 CYS H . . 4.770 3.463 2.626 4.284 . 0 0 "[ . 1 . 2]" 2
28 1 20 VAL HB 1 21 THR H . . 4.480 3.931 3.592 4.409 . 0 0 "[ . 1 . 2]" 2
29 1 21 THR H 1 21 THR HB . . 3.480 2.729 2.623 2.988 . 0 0 "[ . 1 . 2]" 2
30 1 20 VAL MG2 1 21 THR H . . 3.360 2.398 1.880 3.393 0.033 20 0 "[ . 1 . 2]" 2
31 1 61 ASN H 1 62 CYS H . . 4.750 4.499 4.306 4.609 . 0 0 "[ . 1 . 2]" 2
32 1 54 ARG HA 1 61 ASN H . . 4.620 3.919 2.843 4.621 0.001 13 0 "[ . 1 . 2]" 2
33 1 40 SER H 1 41 PHE H . . 4.750 4.512 4.472 4.558 . 0 0 "[ . 1 . 2]" 2
34 1 39 HIS HD2 1 40 SER H . . 4.400 4.266 4.163 4.414 0.014 9 0 "[ . 1 . 2]" 2
35 1 39 HIS HA 1 40 SER H . . 2.920 2.145 2.139 2.161 . 0 0 "[ . 1 . 2]" 2
36 1 40 SER H 1 40 SER QB . . 3.400 2.738 2.262 2.996 . 0 0 "[ . 1 . 2]" 2
37 1 39 HIS HB2 1 40 SER H . . 4.530 4.331 4.230 4.417 . 0 0 "[ . 1 . 2]" 2
38 1 39 HIS HB3 1 40 SER H . . 3.940 3.426 3.232 3.646 . 0 0 "[ . 1 . 2]" 2
39 1 61 ASN H 1 69 TYR QE . . 4.630 4.377 3.707 4.645 0.015 11 0 "[ . 1 . 2]" 2
40 1 60 GLY HA3 1 61 ASN H . . 3.460 2.789 2.216 3.200 . 0 0 "[ . 1 . 2]" 2
41 1 60 GLY HA2 1 61 ASN H . . 3.460 2.401 2.143 3.000 . 0 0 "[ . 1 . 2]" 2
42 1 61 ASN H 1 61 ASN HB3 . . 4.030 3.316 2.696 3.789 . 0 0 "[ . 1 . 2]" 2
43 1 61 ASN H 1 61 ASN HB2 . . 4.030 3.140 2.259 3.924 . 0 0 "[ . 1 . 2]" 2
44 1 51 GLU H 1 51 GLU HG3 . . 4.030 2.918 1.988 3.654 . 0 0 "[ . 1 . 2]" 2
45 1 51 GLU H 1 52 SER H . . 3.730 2.902 2.631 3.105 . 0 0 "[ . 1 . 2]" 2
46 1 47 THR HA 1 51 GLU H . . 4.900 4.167 3.472 4.594 . 0 0 "[ . 1 . 2]" 2
47 1 51 GLU H 1 51 GLU HG2 . . 4.030 2.682 1.939 3.756 . 0 0 "[ . 1 . 2]" 2
48 1 51 GLU H 1 51 GLU HB3 . . 3.740 3.550 2.606 3.633 . 0 0 "[ . 1 . 2]" 2
49 1 49 ASN HA 1 53 ASN HD22 . . 4.800 3.984 2.488 4.782 . 0 0 "[ . 1 . 2]" 2
50 1 49 ASN HA 1 53 ASN HD21 . . 4.800 3.809 2.859 4.686 . 0 0 "[ . 1 . 2]" 2
51 1 52 SER QB 1 53 ASN HD21 . . 4.440 2.981 2.253 4.440 . 0 0 "[ . 1 . 2]" 2
52 1 37 CYS H 1 38 ASN H . . 3.080 3.086 2.963 3.136 0.056 10 0 "[ . 1 . 2]" 2
53 1 36 ASP H 1 37 CYS H . . 3.510 2.768 2.659 2.841 . 0 0 "[ . 1 . 2]" 2
54 1 37 CYS H 1 37 CYS HB3 . . 3.800 2.873 2.779 2.952 . 0 0 "[ . 1 . 2]" 2
55 1 37 CYS H 1 37 CYS HB2 . . 3.800 3.607 3.575 3.618 . 0 0 "[ . 1 . 2]" 2
56 1 35 ALA MB 1 37 CYS H . . 3.430 2.593 2.363 2.759 . 0 0 "[ . 1 . 2]" 2
57 1 80 VAL HB 1 81 ALA H . . 4.510 4.081 1.893 4.549 0.039 20 0 "[ . 1 . 2]" 2
58 1 81 ALA H 1 81 ALA MB . . 3.380 2.398 2.029 2.739 . 0 0 "[ . 1 . 2]" 2
59 1 80 VAL MG1 1 81 ALA H . . 5.090 3.800 2.438 4.361 . 0 0 "[ . 1 . 2]" 2
60 1 80 VAL MG2 1 81 ALA H . . 5.090 3.721 2.496 4.239 . 0 0 "[ . 1 . 2]" 2
61 1 80 VAL HA 1 81 ALA H . . 3.140 2.358 2.141 2.939 . 0 0 "[ . 1 . 2]" 2
62 1 55 ASN QB 1 55 ASN HD22 . . 3.760 3.243 3.213 3.382 . 0 0 "[ . 1 . 2]" 2
63 1 30 LYS H 1 31 GLU H . . 4.880 4.339 4.232 4.538 . 0 0 "[ . 1 . 2]" 2
64 1 30 LYS H 1 42 CYS HB2 . . 5.190 4.676 4.445 4.911 . 0 0 "[ . 1 . 2]" 2
65 1 29 LEU HA 1 30 LYS H . . 2.940 2.143 2.138 2.156 . 0 0 "[ . 1 . 2]" 2
66 1 30 LYS H 1 42 CYS HA . . 3.970 3.170 2.932 3.526 . 0 0 "[ . 1 . 2]" 2
67 1 30 LYS H 1 42 CYS HB3 . . 4.160 3.331 3.093 3.600 . 0 0 "[ . 1 . 2]" 2
68 1 30 LYS H 1 30 LYS HB2 . . 3.930 2.583 2.261 3.670 . 0 0 "[ . 1 . 2]" 2
69 1 30 LYS H 1 30 LYS HB3 . . 3.930 3.261 2.483 3.707 . 0 0 "[ . 1 . 2]" 2
70 1 30 LYS H 1 30 LYS HG2 . . 4.720 3.869 2.517 4.735 0.015 16 0 "[ . 1 . 2]" 2
71 1 29 LEU MD2 1 30 LYS H . . 4.080 3.803 3.591 3.964 . 0 0 "[ . 1 . 2]" 2
72 1 35 ALA MB 1 38 ASN H . . 4.490 4.136 3.998 4.266 . 0 0 "[ . 1 . 2]" 2
73 1 38 ASN H 1 39 HIS H . . 3.540 2.988 2.886 3.073 . 0 0 "[ . 1 . 2]" 2
74 1 38 ASN H 1 38 ASN HA . . 2.740 2.307 2.292 2.315 . 0 0 "[ . 1 . 2]" 2
75 1 38 ASN H 1 38 ASN QB . . 3.550 2.970 2.710 3.269 . 0 0 "[ . 1 . 2]" 2
76 1 43 ARG H 1 44 ALA H . . 4.010 3.031 3.010 3.074 . 0 0 "[ . 1 . 2]" 2
77 1 33 VAL H 1 43 ARG H . . 4.590 4.473 4.227 4.606 0.016 8 0 "[ . 1 . 2]" 2
78 1 32 PRO HA 1 43 ARG H . . 4.070 2.579 2.280 2.946 . 0 0 "[ . 1 . 2]" 2
79 1 42 CYS HA 1 43 ARG H . . 3.020 2.148 2.140 2.154 . 0 0 "[ . 1 . 2]" 2
80 1 42 CYS HB3 1 43 ARG H . . 4.020 3.343 3.281 3.453 . 0 0 "[ . 1 . 2]" 2
81 1 43 ARG H 1 43 ARG HB2 . . 3.280 2.363 2.177 2.521 . 0 0 "[ . 1 . 2]" 2
82 1 31 GLU HB2 1 43 ARG H . . 4.990 4.144 3.485 4.923 . 0 0 "[ . 1 . 2]" 2
83 1 43 ARG H 1 43 ARG HB3 . . 3.380 2.820 2.619 3.090 . 0 0 "[ . 1 . 2]" 2
84 1 43 ARG H 1 43 ARG HG2 . . 5.130 4.622 4.037 4.684 . 0 0 "[ . 1 . 2]" 2
85 1 43 ARG H 1 44 ALA MB . . 5.500 4.679 4.631 4.737 . 0 0 "[ . 1 . 2]" 2
86 1 33 VAL MG1 1 43 ARG H . . 4.560 4.301 3.917 4.601 0.041 13 0 "[ . 1 . 2]" 2
87 1 42 CYS HB2 1 43 ARG H . . 4.450 4.143 4.090 4.234 . 0 0 "[ . 1 . 2]" 2
88 1 43 ARG H 1 43 ARG HG3 . . 5.130 4.357 3.979 4.528 . 0 0 "[ . 1 . 2]" 2
89 1 16 ILE HA 1 17 LYS H . . 2.910 2.211 2.141 2.355 . 0 0 "[ . 1 . 2]" 2
90 1 17 LYS H 1 17 LYS HB2 . . 3.650 2.422 2.212 2.851 . 0 0 "[ . 1 . 2]" 2
91 1 16 ILE MG 1 17 LYS H . . 3.850 2.995 1.906 3.577 . 0 0 "[ . 1 . 2]" 2
92 1 34 SER H 1 75 LYS H . . 3.740 3.601 3.130 3.750 0.010 18 0 "[ . 1 . 2]" 2
93 1 34 SER H 1 35 ALA H . . 5.500 4.623 4.601 4.634 . 0 0 "[ . 1 . 2]" 2
94 1 34 SER H 1 77 ASN H . . 5.500 3.820 3.150 4.813 . 0 0 "[ . 1 . 2]" 2
95 1 33 VAL HA 1 34 SER H . . 3.360 2.148 2.140 2.188 . 0 0 "[ . 1 . 2]" 2
96 1 34 SER H 1 35 ALA MB . . 5.500 5.420 5.368 5.488 . 0 0 "[ . 1 . 2]" 2
97 1 33 VAL MG1 1 34 SER H . . 4.160 3.965 3.839 4.092 . 0 0 "[ . 1 . 2]" 2
98 1 34 SER H 1 76 PRO HA . . 5.390 4.322 3.713 5.219 . 0 0 "[ . 1 . 2]" 2
99 1 34 SER H 1 77 ASN HA . . 5.500 4.502 3.815 5.217 . 0 0 "[ . 1 . 2]" 2
100 1 34 SER H 1 74 LEU HA . . 5.170 5.093 4.833 5.188 0.018 14 0 "[ . 1 . 2]" 2
101 1 33 VAL HB 1 34 SER H . . 3.530 3.330 3.029 3.512 . 0 0 "[ . 1 . 2]" 2
102 1 49 ASN HA 1 49 ASN HD21 . . 4.380 3.062 2.520 4.047 . 0 0 "[ . 1 . 2]" 2
103 1 49 ASN HA 1 49 ASN HD22 . . 4.380 3.874 3.569 4.306 . 0 0 "[ . 1 . 2]" 2
104 1 83 ILE HA 1 84 VAL H . . 3.370 2.631 2.143 3.457 0.087 2 0 "[ . 1 . 2]" 2
105 1 84 VAL H 1 84 VAL HB . . 4.000 3.440 2.468 3.933 . 0 0 "[ . 1 . 2]" 2
106 1 83 ILE HB 1 84 VAL H . . 4.390 3.810 2.886 4.443 0.053 3 0 "[ . 1 . 2]" 2
107 1 84 VAL H 1 84 VAL MG1 . . 4.230 3.150 2.207 4.025 . 0 0 "[ . 1 . 2]" 2
108 1 62 CYS HB3 1 67 VAL H . . 3.740 1.960 1.880 2.315 . 0 0 "[ . 1 . 2]" 2
109 1 67 VAL H 1 67 VAL HB . . 3.310 2.694 2.476 2.915 . 0 0 "[ . 1 . 2]" 2
110 1 67 VAL H 1 67 VAL MG1 . . 4.020 2.641 1.945 3.826 . 0 0 "[ . 1 . 2]" 2
111 1 41 PHE H 1 42 CYS H . . 4.860 4.388 4.340 4.424 . 0 0 "[ . 1 . 2]" 2
112 1 42 CYS H 1 43 ARG H . . 5.260 4.528 4.495 4.546 . 0 0 "[ . 1 . 2]" 2
113 1 42 CYS H 1 46 ILE H . . 4.850 4.074 3.816 4.250 . 0 0 "[ . 1 . 2]" 2
114 1 41 PHE HA 1 42 CYS H . . 3.120 2.337 2.254 2.414 . 0 0 "[ . 1 . 2]" 2
115 1 23 PRO HD2 1 42 CYS H . . 5.180 4.857 4.733 5.044 . 0 0 "[ . 1 . 2]" 2
116 1 42 CYS H 1 42 CYS HB3 . . 3.720 3.582 3.570 3.589 . 0 0 "[ . 1 . 2]" 2
117 1 42 CYS H 1 42 CYS HB2 . . 3.600 2.730 2.647 2.800 . 0 0 "[ . 1 . 2]" 2
118 1 41 PHE HB3 1 42 CYS H . . 3.570 2.725 2.535 2.962 . 0 0 "[ . 1 . 2]" 2
119 1 22 CYS HB2 1 42 CYS H . . 3.770 3.658 3.340 3.797 0.027 14 0 "[ . 1 . 2]" 2
120 1 42 CYS H 1 45 CYS HB3 . . 4.400 4.039 3.831 4.244 . 0 0 "[ . 1 . 2]" 2
121 1 42 CYS H 1 45 CYS HB2 . . 4.400 2.818 2.658 2.964 . 0 0 "[ . 1 . 2]" 2
122 1 41 PHE HB2 1 42 CYS H . . 3.900 3.444 3.251 3.651 . 0 0 "[ . 1 . 2]" 2
123 1 29 LEU MD2 1 42 CYS H . . 3.320 2.524 2.158 2.756 . 0 0 "[ . 1 . 2]" 2
124 1 41 PHE QD 1 42 CYS H . . 4.760 4.368 4.221 4.526 . 0 0 "[ . 1 . 2]" 2
125 1 12 VAL HA 1 13 LEU H . . 3.160 2.349 2.142 2.921 . 0 0 "[ . 1 . 2]" 2
126 1 12 VAL HB 1 13 LEU H . . 4.150 3.370 2.038 4.234 0.084 5 0 "[ . 1 . 2]" 2
127 1 12 VAL MG1 1 13 LEU H . . 4.810 3.309 2.045 4.126 . 0 0 "[ . 1 . 2]" 2
128 1 12 VAL MG2 1 13 LEU H . . 4.810 3.510 1.912 4.265 . 0 0 "[ . 1 . 2]" 2
129 1 34 SER HA 1 35 ALA H . . 3.130 2.343 2.246 2.461 . 0 0 "[ . 1 . 2]" 2
130 1 35 ALA H 1 41 PHE QE . . 5.020 4.854 4.599 5.027 0.007 3 0 "[ . 1 . 2]" 2
131 1 35 ALA H 1 40 SER HA . . 4.500 3.873 3.554 4.049 . 0 0 "[ . 1 . 2]" 2
132 1 35 ALA H 1 74 LEU MD2 . . 4.730 4.169 3.911 4.373 . 0 0 "[ . 1 . 2]" 2
133 1 48 LEU HA 1 52 SER H . . 5.010 4.226 3.417 4.917 . 0 0 "[ . 1 . 2]" 2
134 1 49 ASN HA 1 52 SER H . . 5.290 3.823 3.388 4.134 . 0 0 "[ . 1 . 2]" 2
135 1 52 SER H 1 52 SER QB . . 3.450 2.304 2.159 2.618 . 0 0 "[ . 1 . 2]" 2
136 1 51 GLU HB3 1 52 SER H . . 4.570 3.496 3.108 4.155 . 0 0 "[ . 1 . 2]" 2
137 1 33 VAL HA 1 75 LYS H . . 4.760 4.554 4.018 4.785 0.025 6 0 "[ . 1 . 2]" 2
138 1 74 LEU HA 1 75 LYS H . . 2.840 2.175 2.140 2.260 . 0 0 "[ . 1 . 2]" 2
139 1 75 LYS H 1 75 LYS QB . . 3.350 2.528 2.306 2.816 . 0 0 "[ . 1 . 2]" 2
140 1 75 LYS H 1 75 LYS QD . . 4.540 3.956 1.994 4.517 . 0 0 "[ . 1 . 2]" 2
141 1 75 LYS H 1 75 LYS QG . . 3.630 2.549 1.919 3.120 . 0 0 "[ . 1 . 2]" 2
142 1 74 LEU MD2 1 75 LYS H . . 3.980 3.717 3.427 3.951 . 0 0 "[ . 1 . 2]" 2
143 1 77 ASN HB3 1 78 LEU H . . 4.560 4.236 3.494 4.499 . 0 0 "[ . 1 . 2]" 2
144 1 77 ASN HA 1 78 LEU H . . 3.100 2.440 2.141 3.137 0.037 15 0 "[ . 1 . 2]" 2
145 1 77 ASN HB2 1 78 LEU H . . 4.560 4.484 4.209 4.629 0.069 20 0 "[ . 1 . 2]" 2
146 1 78 LEU H 1 78 LEU QB . . 3.020 2.636 2.244 3.085 0.065 15 0 "[ . 1 . 2]" 2
147 1 78 LEU H 1 78 LEU MD1 . . 5.020 3.647 2.534 4.376 . 0 0 "[ . 1 . 2]" 2
148 1 78 LEU H 1 78 LEU MD2 . . 5.020 3.181 1.843 4.538 . 0 0 "[ . 1 . 2]" 2
149 1 30 LYS HB3 1 31 GLU H . . 4.770 3.840 3.451 4.365 . 0 0 "[ . 1 . 2]" 2
150 1 30 LYS HA 1 31 GLU H . . 3.140 2.149 2.141 2.197 . 0 0 "[ . 1 . 2]" 2
151 1 31 GLU H 1 31 GLU QG . . 4.270 3.029 2.602 4.255 . 0 0 "[ . 1 . 2]" 2
152 1 40 SER QB 1 77 ASN HD21 . . 4.900 3.296 2.168 4.407 . 0 0 "[ . 1 . 2]" 2
153 1 18 GLU H 1 18 GLU HG2 . . 4.540 3.442 2.049 4.499 . 0 0 "[ . 1 . 2]" 2
154 1 18 GLU H 1 18 GLU HB3 . . 3.750 3.384 2.634 3.719 . 0 0 "[ . 1 . 2]" 2
155 1 18 GLU H 1 18 GLU HB2 . . 3.750 2.785 2.202 3.753 0.003 8 0 "[ . 1 . 2]" 2
156 1 17 LYS HB3 1 18 GLU H . . 4.430 3.965 3.170 4.435 0.005 19 0 "[ . 1 . 2]" 2
157 1 18 GLU H 1 20 VAL MG2 . . 5.370 4.356 1.848 5.376 0.006 11 0 "[ . 1 . 2]" 2
158 1 16 ILE H 1 16 ILE HB . . 3.300 2.537 2.403 2.668 . 0 0 "[ . 1 . 2]" 2
159 1 16 ILE H 1 16 ILE HG12 . . 4.020 3.409 2.061 3.986 . 0 0 "[ . 1 . 2]" 2
160 1 16 ILE H 1 16 ILE HG13 . . 4.020 2.996 2.021 4.001 . 0 0 "[ . 1 . 2]" 2
161 1 15 MET HA 1 16 ILE H . . 2.940 2.286 2.140 2.844 . 0 0 "[ . 1 . 2]" 2
162 1 16 ILE H 1 16 ILE MG . . 3.890 3.784 3.739 3.838 . 0 0 "[ . 1 . 2]" 2
163 1 63 PRO HD2 1 64 VAL H . . 4.140 3.163 3.097 3.262 . 0 0 "[ . 1 . 2]" 2
164 1 64 VAL H 1 64 VAL HB . . 3.750 2.701 2.589 3.758 0.008 13 0 "[ . 1 . 2]" 2
165 1 11 SER HA 1 12 VAL H . . 3.320 2.258 2.138 2.762 . 0 0 "[ . 1 . 2]" 2
166 1 11 SER QB 1 12 VAL H . . 4.450 3.402 2.246 4.026 . 0 0 "[ . 1 . 2]" 2
167 1 12 VAL H 1 12 VAL HB . . 3.790 3.269 2.541 3.790 0.000 15 0 "[ . 1 . 2]" 2
168 1 12 VAL H 1 12 VAL MG1 . . 4.340 3.078 2.064 3.939 . 0 0 "[ . 1 . 2]" 2
169 1 23 PRO HD2 1 24 ILE H . . 4.040 3.090 3.046 3.149 . 0 0 "[ . 1 . 2]" 2
170 1 24 ILE H 1 41 PHE QD . . 4.740 4.301 4.089 4.525 . 0 0 "[ . 1 . 2]" 2
171 1 33 VAL HA 1 77 ASN H . . 3.740 2.805 2.190 3.660 . 0 0 "[ . 1 . 2]" 2
172 1 76 PRO HA 1 77 ASN H . . 3.120 2.286 2.152 3.298 0.178 18 0 "[ . 1 . 2]" 2
173 1 77 ASN H 1 77 ASN HB3 . . 3.840 2.847 2.379 3.783 . 0 0 "[ . 1 . 2]" 2
174 1 77 ASN H 1 77 ASN HB2 . . 3.840 2.707 2.253 3.098 . 0 0 "[ . 1 . 2]" 2
175 1 76 PRO HB3 1 77 ASN H . . 4.350 4.075 3.743 4.508 0.158 16 0 "[ . 1 . 2]" 2
176 1 76 PRO HB2 1 77 ASN H . . 4.350 3.604 3.130 3.972 . 0 0 "[ . 1 . 2]" 2
177 1 33 VAL MG1 1 77 ASN H . . 4.190 3.385 2.452 4.133 . 0 0 "[ . 1 . 2]" 2
178 1 22 CYS HB3 1 24 ILE H . . 4.600 3.186 3.009 3.366 . 0 0 "[ . 1 . 2]" 2
179 1 24 ILE H 1 24 ILE HB . . 3.320 2.553 2.489 2.650 . 0 0 "[ . 1 . 2]" 2
180 1 24 ILE H 1 24 ILE HG13 . . 3.640 2.784 2.627 2.920 . 0 0 "[ . 1 . 2]" 2
181 1 23 PRO HG2 1 24 ILE H . . 4.200 3.431 3.374 3.508 . 0 0 "[ . 1 . 2]" 2
182 1 82 ASN HB3 1 83 ILE H . . 4.750 3.271 2.095 4.388 . 0 0 "[ . 1 . 2]" 2
183 1 83 ILE H 1 83 ILE HB . . 3.830 3.183 2.491 3.925 0.095 11 0 "[ . 1 . 2]" 2
184 1 83 ILE H 1 83 ILE HG12 . . 4.220 2.763 2.013 3.567 . 0 0 "[ . 1 . 2]" 2
185 1 83 ILE H 1 83 ILE HG13 . . 4.220 3.123 1.849 4.178 . 0 0 "[ . 1 . 2]" 2
186 1 83 ILE H 1 83 ILE MG . . 4.540 3.235 1.857 3.945 . 0 0 "[ . 1 . 2]" 2
187 1 83 ILE H 1 83 ILE MD . . 5.060 3.456 1.758 4.635 . 0 0 "[ . 1 . 2]" 2
188 1 43 ARG HB2 1 44 ALA H . . 4.540 3.788 3.573 3.936 . 0 0 "[ . 1 . 2]" 2
189 1 44 ALA H 1 45 CYS H . . 4.270 2.703 2.586 2.801 . 0 0 "[ . 1 . 2]" 2
190 1 42 CYS HB3 1 44 ALA H . . 4.240 3.080 2.949 3.285 . 0 0 "[ . 1 . 2]" 2
191 1 42 CYS HB2 1 44 ALA H . . 4.670 3.496 3.379 3.632 . 0 0 "[ . 1 . 2]" 2
192 1 43 ARG HB3 1 44 ALA H . . 3.930 2.604 2.456 2.700 . 0 0 "[ . 1 . 2]" 2
193 1 82 ASN HB2 1 83 ILE H . . 4.750 3.282 2.078 4.659 . 0 0 "[ . 1 . 2]" 2
194 1 55 ASN H 1 59 LYS H . . 4.930 4.294 2.498 4.900 . 0 0 "[ . 1 . 2]" 2
195 1 55 ASN QB 1 59 LYS H . . 5.010 3.580 1.896 5.023 0.013 14 0 "[ . 1 . 2]" 2
196 1 59 LYS H 1 59 LYS HB3 . . 3.680 3.597 3.523 3.691 0.011 19 0 "[ . 1 . 2]" 2
197 1 59 LYS H 1 59 LYS HB2 . . 3.680 2.425 2.235 2.668 . 0 0 "[ . 1 . 2]" 2
198 1 59 LYS H 1 59 LYS HG3 . . 4.040 3.046 2.072 3.964 . 0 0 "[ . 1 . 2]" 2
199 1 59 LYS H 1 59 LYS HG2 . . 4.040 3.136 1.952 4.007 . 0 0 "[ . 1 . 2]" 2
200 1 50 TYR QE 1 59 LYS H . . 5.340 4.839 3.592 5.296 . 0 0 "[ . 1 . 2]" 2
201 1 57 ASP HA 1 59 LYS H . . 5.500 5.062 4.147 5.487 . 0 0 "[ . 1 . 2]" 2
202 1 19 GLU H 1 20 VAL H . . 3.770 2.201 1.867 2.931 . 0 0 "[ . 1 . 2]" 2
203 1 18 GLU HA 1 19 GLU H . . 3.230 2.765 2.307 2.952 . 0 0 "[ . 1 . 2]" 2
204 1 19 GLU H 1 19 GLU HG2 . . 4.530 3.844 2.542 4.525 . 0 0 "[ . 1 . 2]" 2
205 1 19 GLU H 1 20 VAL MG2 . . 4.560 3.324 3.016 3.935 . 0 0 "[ . 1 . 2]" 2
206 1 47 THR MG 1 48 LEU H . . 4.020 3.187 2.963 3.451 . 0 0 "[ . 1 . 2]" 2
207 1 47 THR H 1 48 LEU H . . 3.470 2.746 2.539 2.981 . 0 0 "[ . 1 . 2]" 2
208 1 47 THR HG1 1 48 LEU H . . 4.730 4.158 3.884 4.687 . 0 0 "[ . 1 . 2]" 2
209 1 47 THR HB 1 48 LEU H . . 3.440 2.226 2.033 2.573 . 0 0 "[ . 1 . 2]" 2
210 1 48 LEU H 1 48 LEU QB . . 2.980 2.211 2.088 2.438 . 0 0 "[ . 1 . 2]" 2
211 1 48 LEU H 1 48 LEU MD2 . . 4.670 3.744 1.896 4.325 . 0 0 "[ . 1 . 2]" 2
212 1 13 LEU HA 1 14 GLU H . . 3.230 2.376 2.145 2.947 . 0 0 "[ . 1 . 2]" 2
213 1 15 MET H 1 15 MET HG2 . . 4.440 3.135 1.899 4.536 0.096 9 0 "[ . 1 . 2]" 2
214 1 15 MET H 1 15 MET HG3 . . 4.440 3.333 1.946 4.514 0.074 8 0 "[ . 1 . 2]" 2
215 1 14 GLU H 1 14 GLU QG . . 4.110 3.290 2.080 4.108 . 0 0 "[ . 1 . 2]" 2
216 1 14 GLU QG 1 15 MET H . . 4.600 3.619 1.979 4.453 . 0 0 "[ . 1 . 2]" 2
217 1 14 GLU HB2 1 15 MET H . . 4.670 3.806 2.332 4.475 . 0 0 "[ . 1 . 2]" 2
218 1 13 LEU HG 1 14 GLU H . . 4.810 4.174 2.656 4.850 0.040 11 0 "[ . 1 . 2]" 2
219 1 79 HIS HA 1 80 VAL H . . 3.340 2.631 2.142 3.370 0.030 16 0 "[ . 1 . 2]" 2
220 1 80 VAL H 1 80 VAL HB . . 3.690 3.275 2.503 3.869 0.179 16 0 "[ . 1 . 2]" 2
221 1 55 ASN H 1 58 GLY H . . 4.920 3.802 3.257 4.203 . 0 0 "[ . 1 . 2]" 2
222 1 54 ARG HA 1 55 ASN H . . 2.940 2.390 2.166 2.581 . 0 0 "[ . 1 . 2]" 2
223 1 55 ASN H 1 55 ASN QB . . 3.400 2.534 2.203 3.177 . 0 0 "[ . 1 . 2]" 2
224 1 54 ARG QG 1 55 ASN H . . 4.160 3.419 2.057 4.165 0.005 3 0 "[ . 1 . 2]" 2
225 1 50 TYR HA 1 53 ASN H . . 4.750 3.507 2.831 4.209 . 0 0 "[ . 1 . 2]" 2
226 1 53 ASN H 1 53 ASN HB3 . . 4.100 3.570 3.157 3.865 . 0 0 "[ . 1 . 2]" 2
227 1 53 ASN H 1 53 ASN HB2 . . 4.100 2.894 2.226 3.677 . 0 0 "[ . 1 . 2]" 2
228 1 74 LEU H 1 74 LEU HG . . 3.920 2.395 1.880 2.857 . 0 0 "[ . 1 . 2]" 2
229 1 50 TYR H 1 51 GLU H . . 3.850 2.832 2.656 3.060 . 0 0 "[ . 1 . 2]" 2
230 1 50 TYR H 1 50 TYR QD . . 4.670 4.077 3.902 4.207 . 0 0 "[ . 1 . 2]" 2
231 1 50 TYR H 1 50 TYR HB3 . . 3.730 2.285 2.188 2.535 . 0 0 "[ . 1 . 2]" 2
232 1 50 TYR H 1 50 TYR HB2 . . 3.730 2.822 2.554 2.995 . 0 0 "[ . 1 . 2]" 2
233 1 49 ASN HB3 1 50 TYR H . . 4.270 2.531 2.253 3.251 . 0 0 "[ . 1 . 2]" 2
234 1 49 ASN HB2 1 50 TYR H . . 4.270 3.580 2.794 3.864 . 0 0 "[ . 1 . 2]" 2
235 1 60 GLY H 1 69 TYR H . . 3.940 3.362 2.633 3.939 . 0 0 "[ . 1 . 2]" 2
236 1 60 GLY H 1 69 TYR QD . . 5.190 4.443 3.776 5.021 . 0 0 "[ . 1 . 2]" 2
237 1 60 GLY H 1 69 TYR QE . . 5.450 4.541 4.004 5.124 . 0 0 "[ . 1 . 2]" 2
238 1 59 LYS HB3 1 60 GLY H . . 4.240 2.536 2.007 3.209 . 0 0 "[ . 1 . 2]" 2
239 1 50 TYR QD 1 60 GLY H . . 4.780 4.036 3.415 4.752 . 0 0 "[ . 1 . 2]" 2
240 1 59 LYS HB2 1 60 GLY H . . 4.240 3.773 3.275 4.235 . 0 0 "[ . 1 . 2]" 2
241 1 46 ILE H 1 47 THR H . . 3.500 2.869 2.680 2.978 . 0 0 "[ . 1 . 2]" 2
242 1 47 THR H 1 47 THR HG1 . . 3.240 2.666 2.001 3.212 . 0 0 "[ . 1 . 2]" 2
243 1 47 THR H 1 47 THR HB . . 3.290 2.550 2.480 2.624 . 0 0 "[ . 1 . 2]" 2
244 1 44 ALA MB 1 47 THR H . . 4.760 4.455 4.339 4.765 0.005 6 0 "[ . 1 . 2]" 2
245 1 47 THR H 1 47 THR MG . . 3.970 3.772 3.762 3.785 . 0 0 "[ . 1 . 2]" 2
246 1 46 ILE HB 1 47 THR H . . 4.800 3.929 3.695 4.036 . 0 0 "[ . 1 . 2]" 2
247 1 46 ILE MG 1 47 THR H . . 3.360 1.956 1.861 2.120 . 0 0 "[ . 1 . 2]" 2
248 1 47 THR H 1 48 LEU QB . . 4.870 4.422 4.216 4.742 . 0 0 "[ . 1 . 2]" 2
249 1 29 LEU H 1 30 LYS H . . 4.560 4.458 4.363 4.522 . 0 0 "[ . 1 . 2]" 2
250 1 21 THR HA 1 29 LEU H . . 4.170 4.044 3.819 4.179 0.009 7 0 "[ . 1 . 2]" 2
251 1 28 LEU HA 1 29 LEU H . . 2.960 2.142 2.139 2.158 . 0 0 "[ . 1 . 2]" 2
252 1 28 LEU HB3 1 29 LEU H . . 3.960 3.548 3.323 3.996 0.036 12 0 "[ . 1 . 2]" 2
253 1 29 LEU H 1 29 LEU HG . . 3.210 2.394 2.040 2.701 . 0 0 "[ . 1 . 2]" 2
254 1 21 THR MG 1 29 LEU H . . 4.580 4.101 3.750 4.437 . 0 0 "[ . 1 . 2]" 2
255 1 28 LEU MD1 1 29 LEU H . . 5.100 4.343 2.779 5.121 0.021 13 0 "[ . 1 . 2]" 2
256 1 28 LEU MD2 1 29 LEU H . . 4.260 3.444 2.049 4.265 0.005 17 0 "[ . 1 . 2]" 2
257 1 29 LEU H 1 29 LEU MD2 . . 4.580 3.807 3.561 3.988 . 0 0 "[ . 1 . 2]" 2
258 1 29 LEU H 1 29 LEU MD1 . . 4.050 3.124 3.006 3.215 . 0 0 "[ . 1 . 2]" 2
259 1 22 CYS H 1 27 GLU H . . 4.130 3.154 2.776 3.514 . 0 0 "[ . 1 . 2]" 2
260 1 26 LEU H 1 27 GLU H . . 3.340 2.683 2.589 2.780 . 0 0 "[ . 1 . 2]" 2
261 1 22 CYS HB3 1 27 GLU H . . 3.570 2.371 2.190 2.589 . 0 0 "[ . 1 . 2]" 2
262 1 22 CYS HB2 1 27 GLU H . . 3.960 3.377 3.191 3.567 . 0 0 "[ . 1 . 2]" 2
263 1 27 GLU H 1 27 GLU HG3 . . 4.390 3.637 3.064 4.405 0.015 5 0 "[ . 1 . 2]" 2
264 1 78 LEU QB 1 79 HIS H . . 4.690 3.088 2.182 3.854 . 0 0 "[ . 1 . 2]" 2
265 1 35 ALA MB 1 39 HIS H . . 4.660 2.761 2.508 3.064 . 0 0 "[ . 1 . 2]" 2
266 1 39 HIS H 1 39 HIS HB2 . . 3.530 2.568 2.434 2.649 . 0 0 "[ . 1 . 2]" 2
267 1 38 ASN QB 1 39 HIS H . . 4.640 3.877 3.770 4.038 . 0 0 "[ . 1 . 2]" 2
268 1 39 HIS H 1 39 HIS HB3 . . 3.970 3.736 3.656 3.786 . 0 0 "[ . 1 . 2]" 2
269 1 36 ASP H 1 36 ASP HB2 . . 4.000 2.460 2.215 2.866 . 0 0 "[ . 1 . 2]" 2
270 1 24 ILE MG 1 49 ASN H . . 5.350 5.001 4.645 5.296 . 0 0 "[ . 1 . 2]" 2
271 1 49 ASN H 1 50 TYR H . . 3.620 2.883 2.479 3.052 . 0 0 "[ . 1 . 2]" 2
272 1 46 ILE HA 1 49 ASN H . . 4.300 4.105 3.630 4.311 0.011 4 0 "[ . 1 . 2]" 2
273 1 49 ASN H 1 49 ASN HB3 . . 3.290 2.857 2.430 3.449 0.159 18 0 "[ . 1 . 2]" 2
274 1 49 ASN H 1 49 ASN HB2 . . 3.290 2.314 2.145 2.668 . 0 0 "[ . 1 . 2]" 2
275 1 24 ILE MD 1 49 ASN H . . 4.760 4.341 4.012 4.604 . 0 0 "[ . 1 . 2]" 2
276 1 56 THR HA 1 58 GLY H . . 4.720 4.512 3.627 4.718 . 0 0 "[ . 1 . 2]" 2
277 1 55 ASN QB 1 58 GLY H . . 4.490 3.151 2.096 4.484 . 0 0 "[ . 1 . 2]" 2
278 1 48 LEU H 1 49 ASN H . . 3.400 2.881 2.598 3.033 . 0 0 "[ . 1 . 2]" 2
279 1 48 LEU QB 1 49 ASN H . . 3.400 2.420 2.074 3.336 . 0 0 "[ . 1 . 2]" 2
280 1 54 ARG H 1 55 ASN H . . 4.560 4.423 3.878 4.611 0.051 14 0 "[ . 1 . 2]" 2
281 1 53 ASN H 1 54 ARG H . . 4.250 3.867 2.501 4.293 0.043 6 0 "[ . 1 . 2]" 2
282 1 53 ASN HB3 1 54 ARG H . . 4.440 4.009 3.441 4.364 . 0 0 "[ . 1 . 2]" 2
283 1 53 ASN HB2 1 54 ARG H . . 4.440 4.106 3.709 4.445 0.005 10 0 "[ . 1 . 2]" 2
284 1 54 ARG H 1 54 ARG QG . . 3.550 2.783 2.223 3.653 0.103 13 0 "[ . 1 . 2]" 2
285 1 45 CYS H 1 46 ILE H . . 3.960 3.195 2.964 3.332 . 0 0 "[ . 1 . 2]" 2
286 1 46 ILE H 1 46 ILE HB . . 3.790 2.467 2.264 2.571 . 0 0 "[ . 1 . 2]" 2
287 1 24 ILE MD 1 46 ILE H . . 4.880 3.893 3.609 4.248 . 0 0 "[ . 1 . 2]" 2
288 1 46 ILE H 1 46 ILE MD . . 5.430 4.170 3.955 4.422 . 0 0 "[ . 1 . 2]" 2
289 1 68 PRO HA 1 69 TYR H . . 3.310 2.194 2.172 2.201 . 0 0 "[ . 1 . 2]" 2
290 1 68 PRO HB3 1 69 TYR H . . 4.460 4.289 4.224 4.305 . 0 0 "[ . 1 . 2]" 2
291 1 69 TYR H 1 69 TYR QD . . 3.730 2.661 2.379 2.900 . 0 0 "[ . 1 . 2]" 2
292 1 61 ASN HA 1 69 TYR H . . 4.180 4.029 3.712 4.201 0.021 20 0 "[ . 1 . 2]" 2
293 1 27 GLU HG2 1 28 LEU H . . 4.630 4.017 3.457 4.656 0.026 14 0 "[ . 1 . 2]" 2
294 1 21 THR MG 1 28 LEU H . . 4.210 3.691 3.503 3.946 . 0 0 "[ . 1 . 2]" 2
295 1 28 LEU H 1 28 LEU MD2 . . 4.090 3.155 1.970 4.148 0.058 12 0 "[ . 1 . 2]" 2
296 1 27 GLU H 1 28 LEU H . . 4.490 4.411 4.377 4.432 . 0 0 "[ . 1 . 2]" 2
297 1 28 LEU H 1 29 LEU H . . 4.690 4.466 4.412 4.532 . 0 0 "[ . 1 . 2]" 2
298 1 27 GLU HA 1 28 LEU H . . 3.120 2.420 2.354 2.534 . 0 0 "[ . 1 . 2]" 2
299 1 28 LEU H 1 28 LEU HG . . 3.940 3.166 2.541 3.935 . 0 0 "[ . 1 . 2]" 2
300 1 28 LEU H 1 28 LEU HB2 . . 3.120 2.295 2.114 2.414 . 0 0 "[ . 1 . 2]" 2
301 1 25 CYS H 1 26 LEU MD2 . . 5.370 4.734 4.318 4.936 . 0 0 "[ . 1 . 2]" 2
302 1 25 CYS H 1 29 LEU MD2 . . 5.500 5.272 5.082 5.517 0.017 11 0 "[ . 1 . 2]" 2
303 1 24 ILE H 1 25 CYS H . . 3.200 2.478 2.391 2.599 . 0 0 "[ . 1 . 2]" 2
304 1 25 CYS H 1 26 LEU HA . . 4.930 4.548 4.460 4.646 . 0 0 "[ . 1 . 2]" 2
305 1 22 CYS HB3 1 25 CYS H . . 3.780 2.832 2.649 3.132 . 0 0 "[ . 1 . 2]" 2
306 1 25 CYS H 1 25 CYS QB . . 3.460 2.699 2.585 2.789 . 0 0 "[ . 1 . 2]" 2
307 1 24 ILE HB 1 25 CYS H . . 3.190 2.096 1.972 2.172 . 0 0 "[ . 1 . 2]" 2
308 1 24 ILE MG 1 25 CYS H . . 3.590 2.877 2.662 3.030 . 0 0 "[ . 1 . 2]" 2
309 1 24 ILE HG13 1 25 CYS H . . 4.470 4.203 4.079 4.283 . 0 0 "[ . 1 . 2]" 2
310 1 24 ILE MD 1 25 CYS H . . 4.600 3.997 3.722 4.181 . 0 0 "[ . 1 . 2]" 2
311 1 64 VAL H 1 65 CYS H . . 3.530 2.249 2.029 2.391 . 0 0 "[ . 1 . 2]" 2
312 1 62 CYS HB3 1 65 CYS H . . 4.210 2.500 1.994 2.685 . 0 0 "[ . 1 . 2]" 2
313 1 64 VAL HB 1 65 CYS H . . 3.330 2.298 2.080 3.338 0.008 13 0 "[ . 1 . 2]" 2
314 1 24 ILE HB 1 26 LEU H . . 4.670 4.145 4.028 4.205 . 0 0 "[ . 1 . 2]" 2
315 1 22 CYS H 1 26 LEU H . . 4.710 4.249 4.003 4.495 . 0 0 "[ . 1 . 2]" 2
316 1 25 CYS H 1 26 LEU H . . 3.090 2.291 2.206 2.395 . 0 0 "[ . 1 . 2]" 2
317 1 23 PRO HA 1 26 LEU H . . 4.650 4.482 4.391 4.591 . 0 0 "[ . 1 . 2]" 2
318 1 26 LEU H 1 26 LEU HA . . 2.780 2.275 2.273 2.278 . 0 0 "[ . 1 . 2]" 2
319 1 25 CYS QB 1 26 LEU H . . 4.330 3.607 3.543 3.700 . 0 0 "[ . 1 . 2]" 2
320 1 26 LEU H 1 26 LEU HG . . 3.900 2.895 2.839 2.992 . 0 0 "[ . 1 . 2]" 2
321 1 24 ILE H 1 26 LEU H . . 4.130 2.891 2.782 2.986 . 0 0 "[ . 1 . 2]" 2
322 1 24 ILE HA 1 26 LEU H . . 4.970 4.561 4.335 4.730 . 0 0 "[ . 1 . 2]" 2
323 1 22 CYS HB3 1 26 LEU H . . 3.740 2.239 2.113 2.528 . 0 0 "[ . 1 . 2]" 2
324 1 84 VAL HA 1 85 GLU H . . 3.420 2.688 2.142 3.481 0.061 2 0 "[ . 1 . 2]" 2
325 1 84 VAL MG1 1 85 GLU H . . 5.270 3.763 2.142 4.358 . 0 0 "[ . 1 . 2]" 2
326 1 84 VAL MG2 1 85 GLU H . . 5.270 3.606 1.936 4.361 . 0 0 "[ . 1 . 2]" 2
327 1 41 PHE H 1 41 PHE QE . . 4.870 4.512 4.367 4.649 . 0 0 "[ . 1 . 2]" 2
328 1 33 VAL H 1 41 PHE H . . 3.580 2.354 2.042 2.684 . 0 0 "[ . 1 . 2]" 2
329 1 41 PHE H 1 41 PHE QD . . 3.570 2.685 2.453 2.904 . 0 0 "[ . 1 . 2]" 2
330 1 40 SER HA 1 41 PHE H . . 2.930 2.274 2.225 2.305 . 0 0 "[ . 1 . 2]" 2
331 1 40 SER QB 1 41 PHE H . . 3.420 2.793 2.635 3.429 0.009 18 0 "[ . 1 . 2]" 2
332 1 41 PHE H 1 41 PHE HB2 . . 4.000 3.072 2.978 3.148 . 0 0 "[ . 1 . 2]" 2
333 1 29 LEU MD1 1 41 PHE H . . 5.500 5.280 5.076 5.513 0.013 14 0 "[ . 1 . 2]" 2
334 1 32 PRO HB2 1 41 PHE H . . 4.740 3.292 2.996 3.666 . 0 0 "[ . 1 . 2]" 2
335 1 84 VAL HB 1 85 GLU H . . 4.780 3.715 2.427 4.440 . 0 0 "[ . 1 . 2]" 2
336 1 32 PRO HA 1 41 PHE H . . 4.570 3.819 3.488 4.117 . 0 0 "[ . 1 . 2]" 2
337 1 66 ARG H 1 67 VAL H . . 3.930 2.827 2.638 3.177 . 0 0 "[ . 1 . 2]" 2
338 1 64 VAL H 1 66 ARG H . . 4.650 2.651 2.522 2.794 . 0 0 "[ . 1 . 2]" 2
339 1 65 CYS H 1 66 ARG H . . 3.330 2.107 1.948 2.467 . 0 0 "[ . 1 . 2]" 2
340 1 62 CYS HB3 1 66 ARG H . . 3.750 2.064 1.878 2.520 . 0 0 "[ . 1 . 2]" 2
341 1 72 GLY H 1 73 ASN H . . 4.090 2.927 1.798 3.607 . 0 0 "[ . 1 . 2]" 2
342 1 73 ASN H 1 74 LEU H . . 3.610 2.940 1.860 3.336 . 0 0 "[ . 1 . 2]" 2
343 1 73 ASN H 1 73 ASN HB3 . . 4.140 3.253 2.465 3.820 . 0 0 "[ . 1 . 2]" 2
344 1 73 ASN H 1 73 ASN HB2 . . 4.140 2.457 2.182 3.253 . 0 0 "[ . 1 . 2]" 2
345 1 66 ARG H 1 66 ARG HD2 . . 4.700 3.759 2.138 4.666 . 0 0 "[ . 1 . 2]" 2
346 1 19 GLU HB3 1 20 VAL H . . 4.610 3.696 3.231 4.339 . 0 0 "[ . 1 . 2]" 2
347 1 20 VAL H 1 20 VAL HB . . 3.890 3.686 3.613 3.823 . 0 0 "[ . 1 . 2]" 2
348 1 19 GLU HB2 1 20 VAL H . . 4.610 3.090 2.280 4.449 . 0 0 "[ . 1 . 2]" 2
349 1 14 GLU HA 1 15 MET H . . 3.500 2.258 2.139 2.540 . 0 0 "[ . 1 . 2]" 2
350 1 17 LYS HA 1 18 GLU H . . 3.000 2.316 2.141 2.755 . 0 0 "[ . 1 . 2]" 2
351 1 17 LYS HB2 1 18 GLU H . . 4.380 4.349 4.120 4.438 0.058 15 0 "[ . 1 . 2]" 2
352 1 19 GLU H 1 19 GLU HG3 . . 4.530 3.512 2.800 4.481 . 0 0 "[ . 1 . 2]" 2
353 1 20 VAL H 1 21 THR H . . 3.290 2.359 2.178 2.619 . 0 0 "[ . 1 . 2]" 2
354 1 37 CYS H 1 67 VAL MG1 . . 5.500 3.896 3.443 4.936 . 0 0 "[ . 1 . 2]" 2
355 1 37 CYS H 1 67 VAL MG2 . . 5.500 5.178 4.561 5.536 0.036 13 0 "[ . 1 . 2]" 2
356 1 58 GLY H 1 59 LYS H . . 3.290 2.409 1.914 3.003 . 0 0 "[ . 1 . 2]" 2
357 1 62 CYS HB2 1 66 ARG H . . 4.140 3.775 3.382 4.199 0.059 12 0 "[ . 1 . 2]" 2
358 1 80 VAL H 1 81 ALA H . . 4.330 3.942 2.599 4.407 0.077 12 0 "[ . 1 . 2]" 2
359 1 16 ILE MG 1 18 GLU H . . 4.480 3.867 1.977 4.526 0.046 16 0 "[ . 1 . 2]" 2
360 1 16 ILE HA 1 16 ILE MG . . 3.240 2.404 2.169 2.503 . 0 0 "[ . 1 . 2]" 2
361 1 24 ILE H 1 24 ILE MG . . 4.080 3.808 3.773 3.856 . 0 0 "[ . 1 . 2]" 2
362 1 24 ILE HA 1 24 ILE MG . . 3.040 2.394 2.273 2.480 . 0 0 "[ . 1 . 2]" 2
363 1 24 ILE MG 1 25 CYS QB . . 3.990 3.234 3.085 3.400 . 0 0 "[ . 1 . 2]" 2
364 1 24 ILE HG13 1 24 ILE MG . . 3.650 3.165 3.128 3.197 . 0 0 "[ . 1 . 2]" 2
365 1 41 PHE HB3 1 46 ILE HB . . 3.930 3.693 3.567 3.897 . 0 0 "[ . 1 . 2]" 2
366 1 29 LEU MD2 1 41 PHE HB3 . . 4.390 3.887 3.637 4.257 . 0 0 "[ . 1 . 2]" 2
367 1 23 PRO HD2 1 41 PHE HB3 . . 4.640 3.824 3.617 3.881 . 0 0 "[ . 1 . 2]" 2
368 1 41 PHE HB2 1 46 ILE H . . 4.600 2.858 2.692 3.081 . 0 0 "[ . 1 . 2]" 2
369 1 41 PHE HB2 1 46 ILE HB . . 3.610 2.039 1.987 2.203 . 0 0 "[ . 1 . 2]" 2
370 1 29 LEU MD2 1 41 PHE HB2 . . 4.860 4.624 4.423 4.857 . 0 0 "[ . 1 . 2]" 2
371 1 33 VAL MG2 1 41 PHE HB2 . . 5.080 4.044 3.731 4.300 . 0 0 "[ . 1 . 2]" 2
372 1 29 LEU HB3 1 32 PRO HB3 . . 4.190 2.149 1.983 2.270 . 0 0 "[ . 1 . 2]" 2
373 1 29 LEU HB2 1 32 PRO HB3 . . 4.190 3.754 3.589 3.896 . 0 0 "[ . 1 . 2]" 2
374 1 43 ARG HA 1 43 ARG HD2 . . 4.710 3.135 2.138 4.648 . 0 0 "[ . 1 . 2]" 2
375 1 43 ARG HB2 1 43 ARG HD2 . . 4.040 2.906 2.067 3.761 . 0 0 "[ . 1 . 2]" 2
376 1 43 ARG HB3 1 43 ARG HD2 . . 3.950 3.665 2.722 4.218 0.268 17 0 "[ . 1 . 2]" 2
377 1 33 VAL MG1 1 43 ARG HD2 . . 4.430 3.046 2.192 4.430 0.000 11 0 "[ . 1 . 2]" 2
378 1 43 ARG HA 1 43 ARG HD3 . . 4.710 3.736 2.026 4.571 . 0 0 "[ . 1 . 2]" 2
379 1 43 ARG HB2 1 43 ARG HD3 . . 4.040 2.580 2.222 4.188 0.148 11 0 "[ . 1 . 2]" 2
380 1 43 ARG HB3 1 43 ARG HD3 . . 3.950 3.400 2.606 4.048 0.098 6 0 "[ . 1 . 2]" 2
381 1 33 VAL MG1 1 43 ARG HD3 . . 4.430 3.500 2.517 4.431 0.001 9 0 "[ . 1 . 2]" 2
382 1 21 THR HB 1 22 CYS H . . 3.930 3.713 3.419 3.922 . 0 0 "[ . 1 . 2]" 2
383 1 21 THR HB 1 26 LEU H . . 5.500 5.423 5.319 5.512 0.012 18 0 "[ . 1 . 2]" 2
384 1 21 THR HB 1 26 LEU HA . . 3.740 3.441 3.272 3.593 . 0 0 "[ . 1 . 2]" 2
385 1 21 THR HB 1 26 LEU MD2 . . 4.350 3.625 3.155 4.094 . 0 0 "[ . 1 . 2]" 2
386 1 66 ARG H 1 66 ARG HD3 . . 4.700 3.564 2.245 4.323 . 0 0 "[ . 1 . 2]" 2
387 1 66 ARG HA 1 66 ARG HD3 . . 4.290 3.240 2.086 4.228 . 0 0 "[ . 1 . 2]" 2
388 1 66 ARG HA 1 66 ARG HD2 . . 4.290 3.079 2.040 4.274 . 0 0 "[ . 1 . 2]" 2
389 1 59 LYS QE 1 70 PRO HB3 . . 5.010 2.694 2.093 3.456 . 0 0 "[ . 1 . 2]" 2
390 1 59 LYS QE 1 70 PRO HB2 . . 5.010 4.051 3.576 4.706 . 0 0 "[ . 1 . 2]" 2
391 1 59 LYS HB3 1 59 LYS QE . . 5.080 3.328 1.977 4.070 . 0 0 "[ . 1 . 2]" 2
392 1 13 LEU H 1 13 LEU HB3 . . 4.140 3.151 2.383 3.844 . 0 0 "[ . 1 . 2]" 2
393 1 24 ILE H 1 24 ILE MD . . 4.230 3.685 3.461 3.926 . 0 0 "[ . 1 . 2]" 2
394 1 24 ILE MD 1 41 PHE QE . . 4.510 3.877 3.555 4.205 . 0 0 "[ . 1 . 2]" 2
395 1 24 ILE MD 1 41 PHE QD . . 4.030 2.605 2.359 2.946 . 0 0 "[ . 1 . 2]" 2
396 1 41 PHE QD 1 46 ILE MD . . 4.220 2.113 1.969 3.932 . 0 0 "[ . 1 . 2]" 2
397 1 24 ILE MD 1 45 CYS HA . . 4.640 3.807 3.515 4.094 . 0 0 "[ . 1 . 2]" 2
398 1 24 ILE MD 1 41 PHE HB3 . . 3.640 2.587 1.983 2.951 . 0 0 "[ . 1 . 2]" 2
399 1 24 ILE MD 1 45 CYS HB3 . . 3.650 1.957 1.865 2.077 . 0 0 "[ . 1 . 2]" 2
400 1 24 ILE MD 1 45 CYS HB2 . . 3.650 3.260 2.878 3.420 . 0 0 "[ . 1 . 2]" 2
401 1 24 ILE MD 1 49 ASN HB3 . . 3.800 3.575 3.086 3.801 0.001 17 0 "[ . 1 . 2]" 2
402 1 24 ILE MD 1 49 ASN HB2 . . 3.800 2.805 2.499 3.133 . 0 0 "[ . 1 . 2]" 2
403 1 24 ILE MD 1 41 PHE HB2 . . 4.430 3.571 3.075 3.825 . 0 0 "[ . 1 . 2]" 2
404 1 41 PHE HB2 1 46 ILE MD . . 4.680 3.142 2.724 4.457 . 0 0 "[ . 1 . 2]" 2
405 1 24 ILE MD 1 63 PRO HB2 . . 4.770 3.590 3.075 4.101 . 0 0 "[ . 1 . 2]" 2
406 1 24 ILE HB 1 24 ILE MD . . 3.320 2.254 2.101 2.383 . 0 0 "[ . 1 . 2]" 2
407 1 23 PRO HG2 1 24 ILE MD . . 4.190 3.451 3.097 3.802 . 0 0 "[ . 1 . 2]" 2
408 1 24 ILE MD 1 63 PRO HB3 . . 4.770 3.624 3.090 4.240 . 0 0 "[ . 1 . 2]" 2
409 1 24 ILE MD 1 63 PRO QG . . 3.240 2.114 1.888 2.428 . 0 0 "[ . 1 . 2]" 2
410 1 24 ILE MD 1 24 ILE MG . . 2.940 2.250 1.921 2.498 . 0 0 "[ . 1 . 2]" 2
411 1 17 LYS QE 1 17 LYS QG . . 3.420 2.174 2.058 2.472 . 0 0 "[ . 1 . 2]" 2
412 1 17 LYS QE 1 20 VAL MG2 . . 4.800 4.065 2.175 4.783 . 0 0 "[ . 1 . 2]" 2
413 1 13 LEU H 1 13 LEU HB2 . . 4.140 2.986 2.164 4.003 . 0 0 "[ . 1 . 2]" 2
414 1 28 LEU H 1 28 LEU HB3 . . 3.620 3.536 3.095 3.605 . 0 0 "[ . 1 . 2]" 2
415 1 28 LEU HB2 1 29 LEU H . . 4.490 4.452 4.365 4.504 0.014 12 0 "[ . 1 . 2]" 2
416 1 16 ILE H 1 16 ILE MD . . 4.640 3.099 1.823 3.939 . 0 0 "[ . 1 . 2]" 2
417 1 16 ILE HA 1 16 ILE MD . . 3.930 3.181 1.969 3.955 0.025 17 0 "[ . 1 . 2]" 2
418 1 16 ILE HB 1 16 ILE MD . . 3.550 2.507 2.106 3.226 . 0 0 "[ . 1 . 2]" 2
419 1 56 THR HB 1 57 ASP H . . 4.540 3.974 3.298 4.588 0.048 14 0 "[ . 1 . 2]" 2
420 1 36 ASP H 1 36 ASP HB3 . . 4.000 2.930 2.281 3.591 . 0 0 "[ . 1 . 2]" 2
421 1 69 TYR HB2 1 70 PRO HD2 . . 4.640 2.305 2.037 2.568 . 0 0 "[ . 1 . 2]" 2
422 1 35 ALA MB 1 69 TYR HB2 . . 4.000 3.549 3.424 3.716 . 0 0 "[ . 1 . 2]" 2
423 1 69 TYR HB3 1 70 PRO HD3 . . 4.640 4.445 4.337 4.608 . 0 0 "[ . 1 . 2]" 2
424 1 47 THR HA 1 71 PHE HZ . . 4.290 3.615 2.494 4.288 . 0 0 "[ . 1 . 2]" 2
425 1 36 ASP H 1 69 TYR HB3 . . 5.180 4.003 3.695 4.417 . 0 0 "[ . 1 . 2]" 2
426 1 71 PHE H 1 71 PHE HB3 . . 4.080 2.728 2.478 2.936 . 0 0 "[ . 1 . 2]" 2
427 1 71 PHE H 1 71 PHE HB2 . . 4.080 2.382 2.198 2.728 . 0 0 "[ . 1 . 2]" 2
428 1 50 TYR HB3 1 71 PHE QE . . 4.770 3.494 2.217 4.353 . 0 0 "[ . 1 . 2]" 2
429 1 50 TYR HB2 1 71 PHE QE . . 4.770 3.718 2.611 4.411 . 0 0 "[ . 1 . 2]" 2
430 1 32 PRO HB2 1 77 ASN HB3 . . 4.320 3.544 2.691 4.316 . 0 0 "[ . 1 . 2]" 2
431 1 16 ILE HB 1 17 LYS H . . 4.660 4.330 3.735 4.505 . 0 0 "[ . 1 . 2]" 2
432 1 34 SER HB3 1 35 ALA H . . 4.010 3.186 2.506 3.911 . 0 0 "[ . 1 . 2]" 2
433 1 34 SER HB3 1 40 SER HA . . 5.500 4.990 4.663 5.334 . 0 0 "[ . 1 . 2]" 2
434 1 34 SER HB2 1 35 ALA H . . 4.010 3.490 2.544 4.016 0.006 19 0 "[ . 1 . 2]" 2
435 1 34 SER HB2 1 40 SER HA . . 5.500 5.094 3.905 5.534 0.034 10 0 "[ . 1 . 2]" 2
436 1 34 SER HB2 1 75 LYS QB . . 5.180 3.969 2.464 5.192 0.012 13 0 "[ . 1 . 2]" 2
437 1 32 PRO HB3 1 40 SER QB . . 4.740 3.505 3.014 4.195 . 0 0 "[ . 1 . 2]" 2
438 1 40 SER QB 1 77 ASN HD22 . . 4.900 4.019 2.107 4.788 . 0 0 "[ . 1 . 2]" 2
439 1 34 SER HA 1 40 SER QB . . 4.630 2.579 1.977 3.600 . 0 0 "[ . 1 . 2]" 2
440 1 32 PRO HB2 1 40 SER QB . . 4.390 2.127 1.973 3.044 . 0 0 "[ . 1 . 2]" 2
441 1 29 LEU MD2 1 40 SER QB . . 3.780 3.626 3.134 3.809 0.029 19 0 "[ . 1 . 2]" 2
442 1 40 SER QB 1 41 PHE QD . . 5.500 4.606 4.406 4.918 . 0 0 "[ . 1 . 2]" 2
443 1 31 GLU HA 1 31 GLU QG . . 3.870 2.438 2.157 3.332 . 0 0 "[ . 1 . 2]" 2
444 1 50 TYR QD 1 51 GLU HG2 . . 4.610 2.947 2.031 4.037 . 0 0 "[ . 1 . 2]" 2
445 1 48 LEU HA 1 51 GLU HG2 . . 4.800 4.061 1.950 4.805 0.005 11 0 "[ . 1 . 2]" 2
446 1 19 GLU HA 1 19 GLU HG3 . . 3.950 3.102 2.405 3.759 . 0 0 "[ . 1 . 2]" 2
447 1 18 GLU H 1 18 GLU HG3 . . 4.540 3.237 1.903 4.263 . 0 0 "[ . 1 . 2]" 2
448 1 14 GLU HA 1 14 GLU QG . . 3.830 2.680 2.192 3.454 . 0 0 "[ . 1 . 2]" 2
449 1 27 GLU HG3 1 28 LEU H . . 4.630 4.234 3.076 4.667 0.037 3 0 "[ . 1 . 2]" 2
450 1 27 GLU HA 1 27 GLU HG3 . . 4.020 3.221 2.757 3.718 . 0 0 "[ . 1 . 2]" 2
451 1 27 GLU H 1 27 GLU HG2 . . 4.390 3.821 2.676 4.424 0.034 18 0 "[ . 1 . 2]" 2
452 1 27 GLU HA 1 27 GLU HG2 . . 4.020 2.908 2.295 3.985 . 0 0 "[ . 1 . 2]" 2
453 1 33 VAL HB 1 75 LYS H . . 4.350 3.520 3.038 3.853 . 0 0 "[ . 1 . 2]" 2
454 1 33 VAL HB 1 76 PRO HA . . 4.810 4.015 3.594 4.378 . 0 0 "[ . 1 . 2]" 2
455 1 33 VAL HB 1 74 LEU HB2 . . 4.240 3.134 2.691 3.514 . 0 0 "[ . 1 . 2]" 2
456 1 33 VAL HB 1 74 LEU HB3 . . 4.240 2.017 1.984 2.141 . 0 0 "[ . 1 . 2]" 2
457 1 24 ILE HA 1 24 ILE HG13 . . 3.700 2.764 2.617 2.875 . 0 0 "[ . 1 . 2]" 2
458 1 24 ILE HA 1 24 ILE HG12 . . 3.470 2.698 2.508 2.857 . 0 0 "[ . 1 . 2]" 2
459 1 24 ILE HA 1 24 ILE MD . . 4.240 3.863 3.816 3.913 . 0 0 "[ . 1 . 2]" 2
460 1 52 SER QB 1 53 ASN H . . 3.920 2.507 2.269 3.306 . 0 0 "[ . 1 . 2]" 2
461 1 45 CYS HA 1 48 LEU H . . 4.380 3.613 3.317 3.887 . 0 0 "[ . 1 . 2]" 2
462 1 45 CYS HA 1 48 LEU QB . . 3.670 2.849 2.547 3.234 . 0 0 "[ . 1 . 2]" 2
463 1 44 ALA MB 1 45 CYS HA . . 4.380 3.656 3.549 3.798 . 0 0 "[ . 1 . 2]" 2
464 1 12 VAL HA 1 12 VAL MG1 . . 3.700 2.453 2.246 3.205 . 0 0 "[ . 1 . 2]" 2
465 1 22 CYS HB2 1 26 LEU H . . 4.690 3.980 3.838 4.251 . 0 0 "[ . 1 . 2]" 2
466 1 22 CYS HB3 1 23 PRO HD2 . . 4.610 4.253 4.136 4.361 . 0 0 "[ . 1 . 2]" 2
467 1 22 CYS HB3 1 42 CYS H . . 5.090 4.808 4.584 5.009 . 0 0 "[ . 1 . 2]" 2
468 1 21 THR MG 1 22 CYS HB3 . . 4.700 3.273 3.070 3.649 . 0 0 "[ . 1 . 2]" 2
469 1 22 CYS HB2 1 23 PRO HD2 . . 4.390 4.078 3.934 4.165 . 0 0 "[ . 1 . 2]" 2
470 1 22 CYS HB2 1 29 LEU HA . . 4.010 3.453 3.215 3.593 . 0 0 "[ . 1 . 2]" 2
471 1 22 CYS HB2 1 29 LEU HG . . 4.560 2.941 2.658 3.262 . 0 0 "[ . 1 . 2]" 2
472 1 74 LEU HA 1 75 LYS QB . . 4.730 4.346 4.118 4.429 . 0 0 "[ . 1 . 2]" 2
473 1 75 LYS QB 1 75 LYS QD . . 3.320 2.175 2.032 2.386 . 0 0 "[ . 1 . 2]" 2
474 1 71 PHE HA 1 71 PHE QD . . 3.830 2.561 2.201 3.112 . 0 0 "[ . 1 . 2]" 2
475 1 71 PHE HA 1 74 LEU HG . . 4.240 3.682 3.156 3.975 . 0 0 "[ . 1 . 2]" 2
476 1 20 VAL HA 1 21 THR H . . 3.510 3.367 2.976 3.544 0.034 17 0 "[ . 1 . 2]" 2
477 1 20 VAL HA 1 29 LEU MD1 . . 4.280 4.024 3.666 4.342 0.062 8 0 "[ . 1 . 2]" 2
478 1 61 ASN HA 1 68 PRO HB3 . . 4.990 4.833 4.544 5.021 0.031 4 0 "[ . 1 . 2]" 2
479 1 16 ILE HA 1 17 LYS HB2 . . 4.770 4.529 4.286 4.749 . 0 0 "[ . 1 . 2]" 2
480 1 17 LYS HB2 1 19 GLU H . . 4.860 4.588 3.573 4.854 . 0 0 "[ . 1 . 2]" 2
481 1 17 LYS HB3 1 19 GLU H . . 5.140 3.487 2.850 4.121 . 0 0 "[ . 1 . 2]" 2
482 1 17 LYS H 1 17 LYS HB3 . . 3.890 3.236 2.725 3.883 . 0 0 "[ . 1 . 2]" 2
483 1 67 VAL HB 1 68 PRO HD3 . . 5.010 4.756 4.581 5.001 . 0 0 "[ . 1 . 2]" 2
484 1 29 LEU MD2 1 32 PRO HB2 . . 3.990 3.355 3.067 3.916 . 0 0 "[ . 1 . 2]" 2
485 1 83 ILE HA 1 83 ILE MG . . 3.620 2.308 2.133 2.470 . 0 0 "[ . 1 . 2]" 2
486 1 50 TYR HA 1 50 TYR QD . . 3.750 2.867 2.485 3.197 . 0 0 "[ . 1 . 2]" 2
487 1 16 ILE HA 1 16 ILE HG12 . . 4.100 3.013 2.520 3.557 . 0 0 "[ . 1 . 2]" 2
488 1 16 ILE HA 1 16 ILE HG13 . . 4.100 2.962 2.234 3.761 . 0 0 "[ . 1 . 2]" 2
489 1 43 ARG HA 1 43 ARG HG2 . . 3.900 3.509 2.181 3.851 . 0 0 "[ . 1 . 2]" 2
490 1 33 VAL MG2 1 43 ARG HA . . 3.310 3.109 2.682 3.322 0.012 20 0 "[ . 1 . 2]" 2
491 1 43 ARG HA 1 43 ARG HG3 . . 3.900 2.708 2.181 3.476 . 0 0 "[ . 1 . 2]" 2
492 1 21 THR HA 1 28 LEU HA . . 4.490 4.382 3.987 4.503 0.013 12 0 "[ . 1 . 2]" 2
493 1 24 ILE HG12 1 63 PRO HB2 . . 4.840 3.197 2.766 3.856 . 0 0 "[ . 1 . 2]" 2
494 1 24 ILE HG12 1 63 PRO HB3 . . 4.840 3.707 3.187 4.429 . 0 0 "[ . 1 . 2]" 2
495 1 32 PRO HA 1 42 CYS HA . . 3.770 2.759 2.498 3.055 . 0 0 "[ . 1 . 2]" 2
496 1 29 LEU MD2 1 42 CYS HA . . 4.160 3.344 3.139 3.675 . 0 0 "[ . 1 . 2]" 2
497 1 42 CYS HB3 1 45 CYS H . . 3.690 3.159 2.990 3.302 . 0 0 "[ . 1 . 2]" 2
498 1 42 CYS HB3 1 43 ARG HB3 . . 5.060 4.782 4.585 5.079 0.019 20 0 "[ . 1 . 2]" 2
499 1 42 CYS HB2 1 46 ILE H . . 4.770 3.746 3.651 3.892 . 0 0 "[ . 1 . 2]" 2
500 1 42 CYS HB2 1 45 CYS H . . 3.500 2.198 2.111 2.310 . 0 0 "[ . 1 . 2]" 2
501 1 46 ILE HA 1 50 TYR H . . 4.760 4.055 3.689 4.344 . 0 0 "[ . 1 . 2]" 2
502 1 46 ILE HA 1 49 ASN HB3 . . 3.950 3.202 2.599 3.952 0.002 15 0 "[ . 1 . 2]" 2
503 1 46 ILE HA 1 49 ASN HB2 . . 3.950 3.677 2.688 3.951 0.001 13 0 "[ . 1 . 2]" 2
504 1 41 PHE HB2 1 46 ILE HA . . 4.860 3.336 3.124 3.533 . 0 0 "[ . 1 . 2]" 2
505 1 24 ILE MD 1 46 ILE HA . . 4.070 3.597 3.354 3.862 . 0 0 "[ . 1 . 2]" 2
506 1 46 ILE HA 1 46 ILE MD . . 4.230 2.888 2.046 3.659 . 0 0 "[ . 1 . 2]" 2
507 1 39 HIS HB2 1 41 PHE HZ . . 4.820 2.715 2.401 3.031 . 0 0 "[ . 1 . 2]" 2
508 1 39 HIS HB2 1 41 PHE QE . . 4.750 3.073 2.833 3.326 . 0 0 "[ . 1 . 2]" 2
509 1 39 HIS HB3 1 41 PHE QE . . 4.540 2.864 2.731 2.931 . 0 0 "[ . 1 . 2]" 2
510 1 39 HIS HB3 1 64 VAL HB . . 4.840 4.187 4.058 4.902 0.062 13 0 "[ . 1 . 2]" 2
511 1 62 CYS H 1 62 CYS HB3 . . 3.610 2.591 2.459 2.911 . 0 0 "[ . 1 . 2]" 2
512 1 62 CYS HB3 1 66 ARG HA . . 4.610 2.958 2.728 3.163 . 0 0 "[ . 1 . 2]" 2
513 1 62 CYS HB3 1 67 VAL HB . . 4.710 4.016 3.576 4.281 . 0 0 "[ . 1 . 2]" 2
514 1 62 CYS HB3 1 69 TYR QD . . 4.660 4.507 4.296 4.681 0.021 4 0 "[ . 1 . 2]" 2
515 1 61 ASN HA 1 62 CYS HB3 . . 5.500 4.796 4.633 5.203 . 0 0 "[ . 1 . 2]" 2
516 1 62 CYS HB3 1 65 CYS HA . . 5.500 4.662 4.327 4.868 . 0 0 "[ . 1 . 2]" 2
517 1 62 CYS HB2 1 65 CYS H . . 4.400 3.961 3.680 4.066 . 0 0 "[ . 1 . 2]" 2
518 1 62 CYS HB2 1 67 VAL H . . 4.020 2.603 2.001 3.063 . 0 0 "[ . 1 . 2]" 2
519 1 62 CYS HB2 1 66 ARG HA . . 4.680 4.067 3.688 4.411 . 0 0 "[ . 1 . 2]" 2
520 1 62 CYS HB2 1 67 VAL MG1 . . 5.500 3.029 1.894 5.113 . 0 0 "[ . 1 . 2]" 2
521 1 62 CYS HB2 1 67 VAL MG2 . . 5.500 4.789 3.792 5.191 . 0 0 "[ . 1 . 2]" 2
522 1 62 CYS HB2 1 67 VAL HB . . 4.510 4.216 3.023 4.522 0.012 1 0 "[ . 1 . 2]" 2
523 1 37 CYS HB3 1 67 VAL MG1 . . 5.030 2.441 1.973 3.474 . 0 0 "[ . 1 . 2]" 2
524 1 37 CYS HB3 1 38 ASN H . . 4.700 4.644 4.631 4.653 . 0 0 "[ . 1 . 2]" 2
525 1 37 CYS HB2 1 38 ASN H . . 4.700 4.426 4.384 4.448 . 0 0 "[ . 1 . 2]" 2
526 1 37 CYS HB2 1 67 VAL MG1 . . 5.030 3.720 3.149 4.854 . 0 0 "[ . 1 . 2]" 2
527 1 14 GLU HB3 1 15 MET H . . 4.670 3.425 2.169 4.292 . 0 0 "[ . 1 . 2]" 2
528 1 50 TYR QD 1 51 GLU HA . . 4.570 3.234 2.434 4.032 . 0 0 "[ . 1 . 2]" 2
529 1 19 GLU HB3 1 20 VAL MG1 . . 4.320 3.756 3.187 4.420 0.100 8 0 "[ . 1 . 2]" 2
530 1 19 GLU HB2 1 20 VAL MG1 . . 4.320 3.407 2.848 4.229 . 0 0 "[ . 1 . 2]" 2
531 1 19 GLU HB2 1 20 VAL MG2 . . 5.330 4.224 3.729 5.038 . 0 0 "[ . 1 . 2]" 2
532 1 45 CYS HB3 1 46 ILE H . . 4.030 2.952 2.754 3.277 . 0 0 "[ . 1 . 2]" 2
533 1 45 CYS H 1 45 CYS HB3 . . 4.170 3.603 3.565 3.625 . 0 0 "[ . 1 . 2]" 2
534 1 42 CYS HB2 1 45 CYS HB3 . . 4.090 3.610 3.536 3.714 . 0 0 "[ . 1 . 2]" 2
535 1 45 CYS HB2 1 46 ILE H . . 4.030 2.277 2.107 2.462 . 0 0 "[ . 1 . 2]" 2
536 1 45 CYS H 1 45 CYS HB2 . . 4.170 2.453 2.348 2.582 . 0 0 "[ . 1 . 2]" 2
537 1 42 CYS HB2 1 45 CYS HB2 . . 4.090 2.044 1.976 2.200 . 0 0 "[ . 1 . 2]" 2
538 1 65 CYS H 1 66 ARG HA . . 4.390 4.294 4.184 4.385 . 0 0 "[ . 1 . 2]" 2
539 1 51 GLU H 1 51 GLU HB2 . . 3.740 2.574 2.380 3.589 . 0 0 "[ . 1 . 2]" 2
540 1 51 GLU HB2 1 52 SER H . . 4.570 2.592 2.188 3.921 . 0 0 "[ . 1 . 2]" 2
541 1 31 GLU HB3 1 43 ARG HB2 . . 4.350 3.135 2.349 4.222 . 0 0 "[ . 1 . 2]" 2
542 1 33 VAL MG1 1 43 ARG HB2 . . 3.960 3.632 3.265 3.994 0.034 11 0 "[ . 1 . 2]" 2
543 1 31 GLU HB3 1 43 ARG HB3 . . 4.530 4.256 3.099 4.532 0.002 1 0 "[ . 1 . 2]" 2
544 1 33 VAL MG1 1 43 ARG HB3 . . 5.330 4.885 4.595 5.194 . 0 0 "[ . 1 . 2]" 2
545 1 62 CYS HA 1 63 PRO QG . . 4.790 3.813 3.791 3.832 . 0 0 "[ . 1 . 2]" 2
546 1 37 CYS HA 1 67 VAL MG1 . . 5.500 4.333 3.978 5.167 . 0 0 "[ . 1 . 2]" 2
547 1 37 CYS HA 1 67 VAL MG2 . . 5.500 4.958 4.678 5.170 . 0 0 "[ . 1 . 2]" 2
548 1 48 LEU HA 1 51 GLU H . . 4.160 3.637 3.335 3.965 . 0 0 "[ . 1 . 2]" 2
549 1 49 ASN HA 1 53 ASN H . . 5.500 4.081 3.588 4.430 . 0 0 "[ . 1 . 2]" 2
550 1 48 LEU HA 1 51 GLU HG3 . . 4.800 3.221 2.234 4.188 . 0 0 "[ . 1 . 2]" 2
551 1 47 THR MG 1 48 LEU HA . . 4.640 3.403 3.186 3.607 . 0 0 "[ . 1 . 2]" 2
552 1 75 LYS HA 1 75 LYS QD . . 4.520 3.600 2.058 4.406 . 0 0 "[ . 1 . 2]" 2
553 1 17 LYS QG 1 20 VAL MG2 . . 4.680 2.883 1.750 4.462 . 0 0 "[ . 1 . 2]" 2
554 1 36 ASP HA 1 38 ASN H . . 4.720 3.566 3.488 3.639 . 0 0 "[ . 1 . 2]" 2
555 1 46 ILE HG12 1 74 LEU MD1 . . 4.690 2.483 1.922 4.132 . 0 0 "[ . 1 . 2]" 2
556 1 31 GLU HB3 1 43 ARG H . . 4.990 4.520 3.576 4.917 . 0 0 "[ . 1 . 2]" 2
557 1 31 GLU HB3 1 32 PRO HD3 . . 5.500 5.029 4.755 5.099 . 0 0 "[ . 1 . 2]" 2
558 1 31 GLU HB2 1 43 ARG HB2 . . 4.350 3.214 2.116 4.092 . 0 0 "[ . 1 . 2]" 2
559 1 19 GLU HA 1 20 VAL MG1 . . 5.410 4.713 4.407 5.047 . 0 0 "[ . 1 . 2]" 2
560 1 19 GLU HA 1 20 VAL MG2 . . 5.500 4.877 4.273 5.123 . 0 0 "[ . 1 . 2]" 2
561 1 19 GLU HA 1 19 GLU HG2 . . 3.950 2.638 2.172 3.873 . 0 0 "[ . 1 . 2]" 2
562 1 22 CYS HB3 1 26 LEU HA . . 4.660 3.384 3.231 3.504 . 0 0 "[ . 1 . 2]" 2
563 1 59 LYS QE 1 70 PRO HG2 . . 4.990 4.692 4.219 4.992 0.002 8 0 "[ . 1 . 2]" 2
564 1 17 LYS HA 1 17 LYS HD3 . . 4.340 2.798 1.998 4.100 . 0 0 "[ . 1 . 2]" 2
565 1 16 ILE MG 1 17 LYS HA . . 4.530 3.923 3.497 4.297 . 0 0 "[ . 1 . 2]" 2
566 1 30 LYS HA 1 31 GLU HA . . 4.480 4.372 4.355 4.382 . 0 0 "[ . 1 . 2]" 2
567 1 29 LEU HA 1 42 CYS HB3 . . 5.500 4.430 4.165 4.774 . 0 0 "[ . 1 . 2]" 2
568 1 29 LEU HA 1 29 LEU HG . . 3.930 2.771 2.668 2.916 . 0 0 "[ . 1 . 2]" 2
569 1 23 PRO HG3 1 41 PHE QE . . 4.510 2.431 2.003 2.846 . 0 0 "[ . 1 . 2]" 2
570 1 23 PRO HG3 1 41 PHE QD . . 4.220 3.329 3.180 3.525 . 0 0 "[ . 1 . 2]" 2
571 1 67 VAL HA 1 68 PRO HG3 . . 4.580 4.342 4.318 4.361 . 0 0 "[ . 1 . 2]" 2
572 1 67 VAL HA 1 68 PRO HG2 . . 4.580 4.296 4.222 4.339 . 0 0 "[ . 1 . 2]" 2
573 1 23 PRO HG2 1 24 ILE HG13 . . 4.100 2.677 2.582 2.781 . 0 0 "[ . 1 . 2]" 2
574 1 24 ILE H 1 24 ILE HG12 . . 4.370 4.091 3.988 4.240 . 0 0 "[ . 1 . 2]" 2
575 1 24 ILE HG12 1 41 PHE QD . . 5.200 4.779 4.394 5.077 . 0 0 "[ . 1 . 2]" 2
576 1 54 ARG HA 1 55 ASN QB . . 5.410 4.279 3.859 4.621 . 0 0 "[ . 1 . 2]" 2
577 1 54 ARG HA 1 54 ARG QG . . 3.700 3.035 2.154 3.429 . 0 0 "[ . 1 . 2]" 2
578 1 22 CYS H 1 28 LEU HA . . 4.830 4.723 4.560 4.832 0.002 17 0 "[ . 1 . 2]" 2
579 1 28 LEU HA 1 28 LEU HG . . 4.060 3.092 2.593 3.693 . 0 0 "[ . 1 . 2]" 2
580 1 21 THR MG 1 28 LEU HA . . 3.990 3.548 3.159 3.815 . 0 0 "[ . 1 . 2]" 2
581 1 33 VAL HB 1 74 LEU HA . . 4.510 3.944 3.789 4.068 . 0 0 "[ . 1 . 2]" 2
582 1 63 PRO QG 1 64 VAL H . . 4.550 3.436 3.359 3.543 . 0 0 "[ . 1 . 2]" 2
583 1 41 PHE QE 1 63 PRO QG . . 4.120 2.877 2.256 3.357 . 0 0 "[ . 1 . 2]" 2
584 1 41 PHE QD 1 63 PRO QG . . 4.370 3.535 3.048 3.995 . 0 0 "[ . 1 . 2]" 2
585 1 24 ILE HG12 1 63 PRO QG . . 4.070 3.127 2.695 3.569 . 0 0 "[ . 1 . 2]" 2
586 1 26 LEU HA 1 26 LEU HG . . 4.110 3.092 3.004 3.232 . 0 0 "[ . 1 . 2]" 2
587 1 13 LEU HA 1 13 LEU HG . . 4.250 3.006 2.361 3.700 . 0 0 "[ . 1 . 2]" 2
588 1 48 LEU H 1 48 LEU HG . . 4.370 3.757 2.262 4.523 0.153 10 0 "[ . 1 . 2]" 2
589 1 48 LEU H 1 48 LEU MD1 . . 4.670 3.651 1.951 4.328 . 0 0 "[ . 1 . 2]" 2
590 1 13 LEU H 1 13 LEU HG . . 4.270 3.411 1.908 4.288 0.018 19 0 "[ . 1 . 2]" 2
591 1 78 LEU H 1 78 LEU HG . . 4.960 3.271 1.910 4.380 . 0 0 "[ . 1 . 2]" 2
592 1 44 ALA HA 1 47 THR MG . . 4.530 4.009 3.840 4.179 . 0 0 "[ . 1 . 2]" 2
593 1 44 ALA HA 1 47 THR H . . 4.550 3.510 3.325 3.856 . 0 0 "[ . 1 . 2]" 2
594 1 44 ALA HA 1 47 THR HG1 . . 4.470 3.070 2.219 4.410 . 0 0 "[ . 1 . 2]" 2
595 1 28 LEU HB2 1 28 LEU HG . . 3.000 2.449 2.386 2.520 . 0 0 "[ . 1 . 2]" 2
596 1 78 LEU HA 1 78 LEU HG . . 3.780 3.182 2.330 3.727 . 0 0 "[ . 1 . 2]" 2
597 1 37 CYS H 1 38 ASN HA . . 5.030 4.931 4.893 4.985 . 0 0 "[ . 1 . 2]" 2
598 1 71 PHE QE 1 74 LEU MD1 . . 4.070 3.337 2.581 3.858 . 0 0 "[ . 1 . 2]" 2
599 1 71 PHE QD 1 74 LEU MD1 . . 4.160 3.177 2.230 3.942 . 0 0 "[ . 1 . 2]" 2
600 1 74 LEU HA 1 74 LEU MD1 . . 4.430 3.945 3.917 3.980 . 0 0 "[ . 1 . 2]" 2
601 1 71 PHE HA 1 74 LEU MD1 . . 4.170 3.167 2.620 3.551 . 0 0 "[ . 1 . 2]" 2
602 1 33 VAL MG2 1 74 LEU MD1 . . 3.480 2.188 1.926 2.460 . 0 0 "[ . 1 . 2]" 2
603 1 71 PHE QD 1 74 LEU HG . . 5.500 4.851 4.073 5.500 . 0 0 "[ . 1 . 2]" 2
604 1 21 THR HA 1 29 LEU MD1 . . 4.840 2.995 2.667 3.447 . 0 0 "[ . 1 . 2]" 2
605 1 29 LEU HA 1 29 LEU MD1 . . 4.630 3.904 3.864 3.956 . 0 0 "[ . 1 . 2]" 2
606 1 28 LEU HA 1 29 LEU MD1 . . 4.680 4.618 4.518 4.713 0.033 20 0 "[ . 1 . 2]" 2
607 1 29 LEU MD1 1 40 SER QB . . 3.890 3.587 3.081 3.915 0.025 19 0 "[ . 1 . 2]" 2
608 1 22 CYS HB2 1 29 LEU MD1 . . 4.730 4.039 3.752 4.327 . 0 0 "[ . 1 . 2]" 2
609 1 20 VAL HB 1 29 LEU MD1 . . 4.030 3.550 2.919 4.011 . 0 0 "[ . 1 . 2]" 2
610 1 29 LEU MD1 1 32 PRO HB3 . . 3.800 3.504 3.303 3.732 . 0 0 "[ . 1 . 2]" 2
611 1 29 LEU MD1 1 32 PRO HB2 . . 3.920 3.748 3.526 3.945 0.025 15 0 "[ . 1 . 2]" 2
612 1 29 LEU HB3 1 29 LEU MD1 . . 3.420 2.648 2.586 2.697 . 0 0 "[ . 1 . 2]" 2
613 1 29 LEU HB2 1 29 LEU MD1 . . 3.420 2.136 1.969 2.209 . 0 0 "[ . 1 . 2]" 2
614 1 26 LEU H 1 26 LEU MD1 . . 4.640 4.359 4.293 4.443 . 0 0 "[ . 1 . 2]" 2
615 1 26 LEU HA 1 26 LEU MD1 . . 4.090 3.936 3.889 3.974 . 0 0 "[ . 1 . 2]" 2
616 1 26 LEU HB3 1 26 LEU MD1 . . 3.120 2.488 2.401 2.586 . 0 0 "[ . 1 . 2]" 2
617 1 28 LEU H 1 28 LEU MD1 . . 4.190 3.741 3.574 4.164 . 0 0 "[ . 1 . 2]" 2
618 1 28 LEU HA 1 28 LEU MD1 . . 3.950 3.202 1.974 3.829 . 0 0 "[ . 1 . 2]" 2
619 1 28 LEU HB3 1 28 LEU MD1 . . 3.250 2.359 2.272 2.470 . 0 0 "[ . 1 . 2]" 2
620 1 78 LEU QB 1 78 LEU MD1 . . 3.260 2.078 1.936 2.320 . 0 0 "[ . 1 . 2]" 2
621 1 17 LYS HA 1 17 LYS HD2 . . 4.340 2.945 2.005 4.154 . 0 0 "[ . 1 . 2]" 2
622 1 17 LYS HB2 1 17 LYS HD2 . . 3.780 3.250 2.062 3.704 . 0 0 "[ . 1 . 2]" 2
623 1 17 LYS HB2 1 17 LYS HD3 . . 3.780 3.025 2.261 3.779 . 0 0 "[ . 1 . 2]" 2
624 1 67 VAL HA 1 67 VAL MG1 . . 3.290 2.970 2.429 3.203 . 0 0 "[ . 1 . 2]" 2
625 1 67 VAL MG1 1 68 PRO HD3 . . 4.630 4.166 3.143 4.713 0.083 19 0 "[ . 1 . 2]" 2
626 1 67 VAL MG1 1 68 PRO HD2 . . 4.220 3.231 1.811 4.079 . 0 0 "[ . 1 . 2]" 2
627 1 29 LEU MD2 1 41 PHE H . . 4.250 3.974 3.827 4.232 . 0 0 "[ . 1 . 2]" 2
628 1 29 LEU MD2 1 41 PHE HA . . 3.280 2.253 2.003 2.555 . 0 0 "[ . 1 . 2]" 2
629 1 21 THR HA 1 29 LEU MD2 . . 4.110 3.988 3.521 4.134 0.024 20 0 "[ . 1 . 2]" 2
630 1 23 PRO HD2 1 29 LEU MD2 . . 4.290 3.385 3.148 3.623 . 0 0 "[ . 1 . 2]" 2
631 1 29 LEU HA 1 29 LEU MD2 . . 3.140 2.441 2.343 2.601 . 0 0 "[ . 1 . 2]" 2
632 1 22 CYS HB3 1 29 LEU MD2 . . 3.610 3.393 3.180 3.562 . 0 0 "[ . 1 . 2]" 2
633 1 22 CYS HB2 1 29 LEU MD2 . . 3.290 1.960 1.805 2.093 . 0 0 "[ . 1 . 2]" 2
634 1 29 LEU MD2 1 32 PRO HB3 . . 3.530 2.444 1.972 2.926 . 0 0 "[ . 1 . 2]" 2
635 1 30 LYS H 1 30 LYS HG3 . . 4.720 3.577 2.620 4.680 . 0 0 "[ . 1 . 2]" 2
636 1 30 LYS HA 1 30 LYS HG3 . . 4.160 2.967 2.200 3.806 . 0 0 "[ . 1 . 2]" 2
637 1 30 LYS HA 1 30 LYS HG2 . . 4.160 2.880 2.262 3.929 . 0 0 "[ . 1 . 2]" 2
638 1 34 SER H 1 75 LYS QG . . 5.500 4.668 2.667 5.522 0.022 10 0 "[ . 1 . 2]" 2
639 1 74 LEU HA 1 75 LYS QG . . 4.780 3.837 3.485 4.489 . 0 0 "[ . 1 . 2]" 2
640 1 28 LEU HA 1 28 LEU MD2 . . 3.020 2.164 1.960 2.372 . 0 0 "[ . 1 . 2]" 2
641 1 28 LEU HB2 1 28 LEU MD2 . . 3.530 2.914 2.396 3.193 . 0 0 "[ . 1 . 2]" 2
642 1 28 LEU HB3 1 28 LEU MD2 . . 3.320 2.623 2.177 3.196 . 0 0 "[ . 1 . 2]" 2
643 1 67 VAL MG2 1 68 PRO HD3 . . 4.630 3.468 3.126 4.216 . 0 0 "[ . 1 . 2]" 2
644 1 67 VAL HA 1 68 PRO HD3 . . 2.880 2.258 2.253 2.283 . 0 0 "[ . 1 . 2]" 2
645 1 67 VAL HA 1 68 PRO HD2 . . 3.070 2.129 2.036 2.183 . 0 0 "[ . 1 . 2]" 2
646 1 67 VAL HB 1 68 PRO HD2 . . 4.150 3.865 3.660 4.168 0.018 15 0 "[ . 1 . 2]" 2
647 1 67 VAL MG2 1 68 PRO HD2 . . 4.220 2.287 1.791 3.452 . 0 0 "[ . 1 . 2]" 2
648 1 23 PRO HD3 1 41 PHE QD . . 4.510 3.735 3.506 3.999 . 0 0 "[ . 1 . 2]" 2
649 1 23 PRO HD3 1 24 ILE H . . 4.680 4.076 4.054 4.107 . 0 0 "[ . 1 . 2]" 2
650 1 23 PRO HD3 1 29 LEU MD2 . . 4.270 3.821 3.593 4.022 . 0 0 "[ . 1 . 2]" 2
651 1 78 LEU QB 1 78 LEU MD2 . . 3.260 2.123 1.934 2.275 . 0 0 "[ . 1 . 2]" 2
652 1 26 LEU MD2 1 27 GLU H . . 4.760 4.576 4.468 4.715 . 0 0 "[ . 1 . 2]" 2
653 1 26 LEU H 1 26 LEU MD2 . . 3.480 3.224 2.963 3.354 . 0 0 "[ . 1 . 2]" 2
654 1 23 PRO HA 1 26 LEU MD2 . . 3.400 2.516 2.341 2.702 . 0 0 "[ . 1 . 2]" 2
655 1 26 LEU HA 1 26 LEU MD2 . . 2.980 2.244 2.025 2.462 . 0 0 "[ . 1 . 2]" 2
656 1 26 LEU HB3 1 26 LEU MD2 . . 3.580 2.249 2.124 2.356 . 0 0 "[ . 1 . 2]" 2
657 1 26 LEU HB2 1 26 LEU MD2 . . 3.580 3.175 3.160 3.191 . 0 0 "[ . 1 . 2]" 2
658 1 69 TYR QD 1 74 LEU MD2 . . 3.920 3.098 2.490 3.430 . 0 0 "[ . 1 . 2]" 2
659 1 69 TYR QE 1 74 LEU MD2 . . 4.150 3.086 1.994 3.587 . 0 0 "[ . 1 . 2]" 2
660 1 71 PHE HA 1 74 LEU MD2 . . 4.500 4.230 3.668 4.500 0.000 12 0 "[ . 1 . 2]" 2
661 1 74 LEU H 1 74 LEU MD2 . . 4.710 3.677 3.000 4.102 . 0 0 "[ . 1 . 2]" 2
662 1 74 LEU HA 1 74 LEU MD2 . . 3.140 2.354 2.088 2.651 . 0 0 "[ . 1 . 2]" 2
663 1 33 VAL HB 1 74 LEU MD2 . . 4.220 3.469 3.006 3.732 . 0 0 "[ . 1 . 2]" 2
664 1 35 ALA MB 1 74 LEU MD2 . . 3.250 2.227 2.037 2.548 . 0 0 "[ . 1 . 2]" 2
665 1 46 ILE MG 1 74 LEU MD2 . . 4.350 4.233 3.949 4.369 0.019 14 0 "[ . 1 . 2]" 2
666 1 33 VAL MG2 1 74 LEU MD2 . . 3.420 2.431 1.929 2.919 . 0 0 "[ . 1 . 2]" 2
667 1 69 TYR HA 1 70 PRO HD2 . . 3.540 2.255 2.140 2.362 . 0 0 "[ . 1 . 2]" 2
668 1 69 TYR HB3 1 70 PRO HD2 . . 4.640 3.494 3.363 3.705 . 0 0 "[ . 1 . 2]" 2
669 1 63 PRO HD2 1 69 TYR QE . . 4.820 4.116 3.725 4.458 . 0 0 "[ . 1 . 2]" 2
670 1 41 PHE HZ 1 63 PRO HD2 . . 4.640 3.374 3.060 3.709 . 0 0 "[ . 1 . 2]" 2
671 1 62 CYS HA 1 63 PRO HD2 . . 3.360 2.060 2.010 2.100 . 0 0 "[ . 1 . 2]" 2
672 1 69 TYR HB2 1 70 PRO HD3 . . 4.640 3.709 3.471 3.928 . 0 0 "[ . 1 . 2]" 2
673 1 69 TYR QD 1 70 PRO HD3 . . 5.050 4.877 4.677 5.028 . 0 0 "[ . 1 . 2]" 2
674 1 69 TYR HA 1 70 PRO HD3 . . 3.540 2.260 2.250 2.285 . 0 0 "[ . 1 . 2]" 2
675 1 41 PHE QE 1 63 PRO HD3 . . 5.290 4.840 4.559 5.145 . 0 0 "[ . 1 . 2]" 2
676 1 62 CYS HA 1 63 PRO HD3 . . 3.320 2.272 2.259 2.296 . 0 0 "[ . 1 . 2]" 2
677 1 75 LYS HA 1 76 PRO HD2 . . 3.150 2.279 2.133 2.411 . 0 0 "[ . 1 . 2]" 2
678 1 75 LYS QB 1 76 PRO HD2 . . 3.840 2.255 1.990 2.585 . 0 0 "[ . 1 . 2]" 2
679 1 75 LYS QG 1 76 PRO HD2 . . 4.830 3.621 3.064 4.030 . 0 0 "[ . 1 . 2]" 2
680 1 75 LYS HA 1 76 PRO HD3 . . 3.150 2.270 2.255 2.304 . 0 0 "[ . 1 . 2]" 2
681 1 75 LYS QB 1 76 PRO HD3 . . 3.840 3.555 3.310 3.811 . 0 0 "[ . 1 . 2]" 2
682 1 75 LYS QG 1 76 PRO HD3 . . 4.830 4.411 3.862 4.827 . 0 0 "[ . 1 . 2]" 2
683 1 31 GLU H 1 32 PRO HD2 . . 3.830 2.786 2.611 3.022 . 0 0 "[ . 1 . 2]" 2
684 1 31 GLU HA 1 32 PRO HD2 . . 3.130 2.338 2.313 2.375 . 0 0 "[ . 1 . 2]" 2
685 1 31 GLU H 1 32 PRO HD3 . . 3.750 2.549 2.351 2.765 . 0 0 "[ . 1 . 2]" 2
686 1 30 LYS HA 1 32 PRO HD3 . . 4.370 3.160 2.926 3.263 . 0 0 "[ . 1 . 2]" 2
687 1 31 GLU HA 1 32 PRO HD3 . . 3.470 3.227 3.201 3.265 . 0 0 "[ . 1 . 2]" 2
688 1 29 LEU HB3 1 32 PRO HD3 . . 4.700 2.794 2.637 3.278 . 0 0 "[ . 1 . 2]" 2
689 1 29 LEU HB2 1 32 PRO HD3 . . 4.700 3.556 3.306 4.018 . 0 0 "[ . 1 . 2]" 2
690 1 29 LEU MD2 1 32 PRO HD3 . . 4.690 4.303 4.052 4.703 0.013 20 0 "[ . 1 . 2]" 2
691 1 55 ASN HA 1 56 THR MG . . 4.850 3.932 3.364 4.392 . 0 0 "[ . 1 . 2]" 2
692 1 56 THR HA 1 56 THR MG . . 3.310 2.942 2.266 3.206 . 0 0 "[ . 1 . 2]" 2
693 1 55 ASN QB 1 56 THR MG . . 4.500 3.817 2.909 4.490 . 0 0 "[ . 1 . 2]" 2
694 1 20 VAL MG1 1 21 THR H . . 4.540 4.046 3.865 4.362 . 0 0 "[ . 1 . 2]" 2
695 1 20 VAL H 1 20 VAL MG1 . . 3.860 2.637 2.213 3.230 . 0 0 "[ . 1 . 2]" 2
696 1 20 VAL HA 1 20 VAL MG1 . . 3.100 2.312 2.210 2.404 . 0 0 "[ . 1 . 2]" 2
697 1 64 VAL H 1 64 VAL MG1 . . 4.420 3.817 3.251 3.888 . 0 0 "[ . 1 . 2]" 2
698 1 64 VAL MG1 1 65 CYS H . . 4.180 3.178 2.922 3.989 . 0 0 "[ . 1 . 2]" 2
699 1 64 VAL HA 1 64 VAL MG1 . . 3.180 2.421 2.154 2.476 . 0 0 "[ . 1 . 2]" 2
700 1 39 HIS HB3 1 64 VAL MG1 . . 4.510 4.433 3.943 4.533 0.023 2 0 "[ . 1 . 2]" 2
701 1 21 THR MG 1 22 CYS H . . 3.640 2.006 1.863 2.295 . 0 0 "[ . 1 . 2]" 2
702 1 21 THR MG 1 27 GLU H . . 4.270 2.395 2.179 2.537 . 0 0 "[ . 1 . 2]" 2
703 1 21 THR MG 1 26 LEU H . . 4.180 3.533 3.394 3.780 . 0 0 "[ . 1 . 2]" 2
704 1 21 THR H 1 21 THR MG . . 4.010 3.777 3.686 3.916 . 0 0 "[ . 1 . 2]" 2
705 1 21 THR MG 1 27 GLU HA . . 4.190 2.660 2.515 2.762 . 0 0 "[ . 1 . 2]" 2
706 1 21 THR HA 1 21 THR MG . . 3.210 2.285 2.119 2.383 . 0 0 "[ . 1 . 2]" 2
707 1 21 THR MG 1 26 LEU HA . . 3.150 2.052 1.909 2.301 . 0 0 "[ . 1 . 2]" 2
708 1 33 VAL H 1 33 VAL MG1 . . 4.100 2.983 2.679 3.285 . 0 0 "[ . 1 . 2]" 2
709 1 33 VAL MG1 1 75 LYS H . . 5.200 4.599 4.205 4.997 . 0 0 "[ . 1 . 2]" 2
710 1 33 VAL HA 1 33 VAL MG1 . . 3.380 2.300 2.153 2.428 . 0 0 "[ . 1 . 2]" 2
711 1 33 VAL MG1 1 76 PRO HA . . 3.230 2.291 1.955 2.747 . 0 0 "[ . 1 . 2]" 2
712 1 33 VAL MG1 1 43 ARG HA . . 4.070 3.057 2.487 3.583 . 0 0 "[ . 1 . 2]" 2
713 1 47 THR MG 1 51 GLU H . . 4.500 4.001 3.517 4.300 . 0 0 "[ . 1 . 2]" 2
714 1 47 THR MG 1 71 PHE HZ . . 3.810 3.216 2.704 3.758 . 0 0 "[ . 1 . 2]" 2
715 1 47 THR MG 1 50 TYR QD . . 4.830 3.758 3.184 4.490 . 0 0 "[ . 1 . 2]" 2
716 1 47 THR HA 1 47 THR MG . . 3.130 2.378 2.277 2.444 . 0 0 "[ . 1 . 2]" 2
717 1 47 THR MG 1 51 GLU HG2 . . 4.330 3.309 2.203 4.233 . 0 0 "[ . 1 . 2]" 2
718 1 47 THR MG 1 51 GLU HG3 . . 4.330 2.964 2.265 4.202 . 0 0 "[ . 1 . 2]" 2
719 1 47 THR MG 1 48 LEU QB . . 4.650 4.306 3.950 4.647 . 0 0 "[ . 1 . 2]" 2
720 1 35 ALA MB 1 36 ASP H . . 3.360 2.188 1.974 2.382 . 0 0 "[ . 1 . 2]" 2
721 1 35 ALA MB 1 69 TYR QD . . 3.960 3.684 3.303 3.944 . 0 0 "[ . 1 . 2]" 2
722 1 34 SER HA 1 35 ALA MB . . 4.490 3.853 3.761 3.896 . 0 0 "[ . 1 . 2]" 2
723 1 35 ALA MB 1 69 TYR HB3 . . 4.000 3.706 3.575 3.824 . 0 0 "[ . 1 . 2]" 2
724 1 35 ALA MB 1 39 HIS HB3 . . 5.390 4.211 3.978 4.458 . 0 0 "[ . 1 . 2]" 2
725 1 35 ALA H 1 35 ALA MB . . 3.350 2.538 2.476 2.640 . 0 0 "[ . 1 . 2]" 2
726 1 35 ALA MB 1 41 PHE QE . . 3.890 2.918 2.650 3.118 . 0 0 "[ . 1 . 2]" 2
727 1 35 ALA MB 1 62 CYS HB2 . . 5.020 4.835 4.598 5.058 0.038 13 0 "[ . 1 . 2]" 2
728 1 35 ALA MB 1 39 HIS HB2 . . 4.840 3.010 2.722 3.306 . 0 0 "[ . 1 . 2]" 2
729 1 37 CYS HB3 1 67 VAL MG2 . . 5.030 3.410 3.081 3.677 . 0 0 "[ . 1 . 2]" 2
730 1 67 VAL H 1 67 VAL MG2 . . 4.020 3.471 2.513 3.875 . 0 0 "[ . 1 . 2]" 2
731 1 67 VAL HA 1 67 VAL MG2 . . 3.290 2.327 2.193 2.452 . 0 0 "[ . 1 . 2]" 2
732 1 37 CYS HB2 1 67 VAL MG2 . . 5.030 4.538 3.584 5.017 . 0 0 "[ . 1 . 2]" 2
733 1 12 VAL H 1 12 VAL MG2 . . 4.340 2.631 1.881 4.034 . 0 0 "[ . 1 . 2]" 2
734 1 12 VAL HA 1 12 VAL MG2 . . 3.700 2.748 2.280 3.203 . 0 0 "[ . 1 . 2]" 2
735 1 84 VAL H 1 84 VAL MG2 . . 4.230 2.262 1.872 2.988 . 0 0 "[ . 1 . 2]" 2
736 1 33 VAL MG2 1 34 SER H . . 4.470 4.017 3.822 4.178 . 0 0 "[ . 1 . 2]" 2
737 1 33 VAL MG2 1 41 PHE H . . 3.820 2.952 2.590 3.279 . 0 0 "[ . 1 . 2]" 2
738 1 33 VAL MG2 1 41 PHE QE . . 5.500 4.900 4.489 5.293 . 0 0 "[ . 1 . 2]" 2
739 1 33 VAL MG2 1 74 LEU H . . 5.500 5.188 4.908 5.525 0.025 13 0 "[ . 1 . 2]" 2
740 1 32 PRO HA 1 33 VAL MG2 . . 4.250 3.689 3.456 3.824 . 0 0 "[ . 1 . 2]" 2
741 1 33 VAL MG2 1 43 ARG HB2 . . 5.460 4.736 4.169 5.251 . 0 0 "[ . 1 . 2]" 2
742 1 46 ILE H 1 46 ILE MG . . 3.360 2.275 2.105 2.637 . 0 0 "[ . 1 . 2]" 2
743 1 46 ILE MG 1 71 PHE QE . . 4.230 3.911 2.993 4.244 0.014 11 0 "[ . 1 . 2]" 2
744 1 46 ILE MG 1 47 THR HG1 . . 4.600 2.736 2.032 3.242 . 0 0 "[ . 1 . 2]" 2
745 1 43 ARG HA 1 46 ILE MG . . 3.260 2.476 2.208 2.744 . 0 0 "[ . 1 . 2]" 2
746 1 41 PHE HB3 1 46 ILE MG . . 4.930 4.723 4.602 4.953 0.023 4 0 "[ . 1 . 2]" 2
747 1 41 PHE HB2 1 46 ILE MG . . 3.840 3.468 3.279 3.716 . 0 0 "[ . 1 . 2]" 2
748 1 33 VAL HB 1 46 ILE MG . . 5.310 4.725 4.418 5.194 . 0 0 "[ . 1 . 2]" 2
749 1 46 ILE HG12 1 46 ILE MG . . 3.410 2.205 2.036 3.160 . 0 0 "[ . 1 . 2]" 2
750 1 46 ILE HG13 1 46 ILE MG . . 3.410 2.827 2.547 3.179 . 0 0 "[ . 1 . 2]" 2
751 1 46 ILE MG 1 74 LEU MD1 . . 3.390 3.071 2.699 3.288 . 0 0 "[ . 1 . 2]" 2
752 1 46 ILE MG 1 47 THR HA . . 4.590 3.263 2.866 3.573 . 0 0 "[ . 1 . 2]" 2
753 1 17 LYS HB2 1 20 VAL MG2 . . 4.810 3.741 3.283 4.785 . 0 0 "[ . 1 . 2]" 2
754 1 20 VAL H 1 20 VAL MG2 . . 3.170 1.991 1.877 2.253 . 0 0 "[ . 1 . 2]" 2
755 1 17 LYS HA 1 20 VAL MG2 . . 4.510 4.094 2.453 4.570 0.060 8 0 "[ . 1 . 2]" 2
756 1 19 GLU HB3 1 20 VAL MG2 . . 5.330 4.968 4.548 5.340 0.010 20 0 "[ . 1 . 2]" 2
757 1 17 LYS HB3 1 20 VAL MG2 . . 4.430 2.579 1.965 3.934 . 0 0 "[ . 1 . 2]" 2
758 1 64 VAL H 1 64 VAL MG2 . . 4.420 2.724 1.821 2.891 . 0 0 "[ . 1 . 2]" 2
759 1 39 HIS HB3 1 64 VAL MG2 . . 4.510 3.496 2.468 3.822 . 0 0 "[ . 1 . 2]" 2
760 1 64 VAL MG2 1 65 CYS H . . 4.180 3.614 1.896 3.777 . 0 0 "[ . 1 . 2]" 2
761 1 64 VAL HA 1 64 VAL MG2 . . 3.180 2.418 2.272 3.165 . 0 0 "[ . 1 . 2]" 2
762 1 81 ALA MB 1 82 ASN H . . 4.270 3.027 2.146 3.717 . 0 0 "[ . 1 . 2]" 2
763 1 44 ALA H 1 44 ALA MB . . 3.100 2.165 2.067 2.252 . 0 0 "[ . 1 . 2]" 2
764 1 44 ALA MB 1 45 CYS H . . 3.740 2.259 2.031 2.499 . 0 0 "[ . 1 . 2]" 2
765 1 42 CYS HB3 1 44 ALA MB . . 4.290 3.544 3.423 3.692 . 0 0 "[ . 1 . 2]" 2
766 1 42 CYS HB2 1 44 ALA MB . . 4.290 3.639 3.498 3.747 . 0 0 "[ . 1 . 2]" 2
767 1 47 THR HA 1 71 PHE QE . . 3.890 3.120 2.561 3.845 . 0 0 "[ . 1 . 2]" 2
768 1 47 THR MG 1 71 PHE QE . . 4.550 3.908 3.415 4.359 . 0 0 "[ . 1 . 2]" 2
769 1 35 ALA MB 1 41 PHE HZ . . 4.630 4.407 3.959 4.636 0.006 3 0 "[ . 1 . 2]" 2
770 1 41 PHE QE 1 63 PRO HD2 . . 4.300 3.558 3.359 3.806 . 0 0 "[ . 1 . 2]" 2
771 1 23 PRO HG2 1 41 PHE QE . . 4.370 2.468 2.070 2.736 . 0 0 "[ . 1 . 2]" 2
772 1 41 PHE QE 1 74 LEU MD2 . . 4.490 4.266 3.881 4.499 0.009 8 0 "[ . 1 . 2]" 2
773 1 61 ASN HA 1 68 PRO HA . . 3.830 3.253 3.013 3.425 . 0 0 "[ . 1 . 2]" 2
774 1 39 HIS HD2 1 64 VAL MG1 . . 5.190 4.492 4.323 5.197 0.007 13 0 "[ . 1 . 2]" 2
775 1 39 HIS HA 1 39 HIS HD2 . . 3.490 2.301 2.252 2.362 . 0 0 "[ . 1 . 2]" 2
776 1 39 HIS HD2 1 64 VAL MG2 . . 5.190 5.039 4.151 5.206 0.016 10 0 "[ . 1 . 2]" 2
777 1 50 TYR QE 1 60 GLY H . . 4.670 3.882 2.998 4.660 . 0 0 "[ . 1 . 2]" 2
778 1 50 TYR QE 1 54 ARG HD2 . . 4.900 3.929 2.838 4.725 . 0 0 "[ . 1 . 2]" 2
779 1 50 TYR QE 1 71 PHE HB2 . . 5.070 3.688 2.930 4.428 . 0 0 "[ . 1 . 2]" 2
780 1 50 TYR QE 1 60 GLY HA2 . . 4.830 3.550 2.721 4.151 . 0 0 "[ . 1 . 2]" 2
781 1 69 TYR QE 1 74 LEU HG . . 4.410 4.102 2.796 4.416 0.006 17 0 "[ . 1 . 2]" 2
782 1 62 CYS HA 1 69 TYR QE . . 3.810 2.559 2.143 2.943 . 0 0 "[ . 1 . 2]" 2
783 1 69 TYR QE 1 71 PHE HA . . 3.760 3.115 2.462 3.631 . 0 0 "[ . 1 . 2]" 2
784 1 63 PRO HD3 1 69 TYR QE . . 4.790 4.104 3.764 4.590 . 0 0 "[ . 1 . 2]" 2
785 1 69 TYR QE 1 74 LEU MD1 . . 3.970 2.909 2.000 3.290 . 0 0 "[ . 1 . 2]" 2
786 1 34 SER HA 1 41 PHE H . . 4.770 4.422 4.006 4.783 0.013 20 0 "[ . 1 . 2]" 2
787 1 34 SER HA 1 40 SER HA . . 3.490 2.485 1.981 2.936 . 0 0 "[ . 1 . 2]" 2
788 1 34 SER HA 1 74 LEU MD2 . . 4.920 4.501 4.360 4.670 . 0 0 "[ . 1 . 2]" 2
789 1 69 TYR HA 1 70 PRO HG2 . . 5.110 4.396 4.304 4.481 . 0 0 "[ . 1 . 2]" 2
790 1 35 ALA MB 1 69 TYR HA . . 5.500 5.500 5.448 5.524 0.024 14 0 "[ . 1 . 2]" 2
791 1 39 HIS HE1 1 65 CYS H . . 4.620 3.781 3.403 4.228 . 0 0 "[ . 1 . 2]" 2
792 1 39 HIS HE1 1 65 CYS HA . . 4.450 4.364 4.141 4.459 0.009 15 0 "[ . 1 . 2]" 2
793 1 39 HIS HE1 1 64 VAL HB . . 4.900 3.436 2.726 4.210 . 0 0 "[ . 1 . 2]" 2
794 1 23 PRO HD2 1 41 PHE HA . . 4.150 3.698 3.451 3.896 . 0 0 "[ . 1 . 2]" 2
795 1 23 PRO HD3 1 41 PHE HA . . 5.000 4.864 4.640 5.014 0.014 8 0 "[ . 1 . 2]" 2
796 1 69 TYR HA 1 69 TYR QD . . 4.400 3.738 3.732 3.742 . 0 0 "[ . 1 . 2]" 2
797 1 61 ASN HA 1 69 TYR QD . . 4.570 4.059 3.626 4.291 . 0 0 "[ . 1 . 2]" 2
798 1 62 CYS HA 1 69 TYR QD . . 4.910 4.261 4.028 4.611 . 0 0 "[ . 1 . 2]" 2
799 1 69 TYR QD 1 71 PHE HA . . 3.890 3.168 2.671 3.927 0.037 10 0 "[ . 1 . 2]" 2
800 1 62 CYS HB2 1 69 TYR QD . . 4.340 2.969 2.810 3.176 . 0 0 "[ . 1 . 2]" 2
801 1 69 TYR QD 1 74 LEU HG . . 4.400 3.934 3.145 4.342 . 0 0 "[ . 1 . 2]" 2
802 1 69 TYR QD 1 74 LEU MD1 . . 4.850 3.969 3.428 4.336 . 0 0 "[ . 1 . 2]" 2
803 1 24 ILE HG13 1 41 PHE QD . . 4.330 3.388 2.964 3.764 . 0 0 "[ . 1 . 2]" 2
804 1 33 VAL MG2 1 41 PHE QD . . 3.800 3.470 3.119 3.741 . 0 0 "[ . 1 . 2]" 2
805 1 41 PHE QD 1 46 ILE HG13 . . 4.800 4.196 2.446 4.827 0.027 1 0 "[ . 1 . 2]" 2
806 1 41 PHE HA 1 41 PHE QD . . 4.250 3.158 3.030 3.271 . 0 0 "[ . 1 . 2]" 2
807 1 50 TYR QD 1 54 ARG QG . . 5.500 4.484 3.183 5.240 . 0 0 "[ . 1 . 2]" 2
808 1 50 TYR QD 1 51 GLU H . . 4.500 2.756 2.117 3.512 . 0 0 "[ . 1 . 2]" 2
809 1 50 TYR QD 1 71 PHE QE . . 4.800 3.656 2.647 4.505 . 0 0 "[ . 1 . 2]" 2
810 1 50 TYR QD 1 60 GLY HA3 . . 4.480 2.312 2.001 3.161 . 0 0 "[ . 1 . 2]" 2
811 1 50 TYR QD 1 60 GLY HA2 . . 4.480 2.996 2.009 3.902 . 0 0 "[ . 1 . 2]" 2
812 1 50 TYR QD 1 51 GLU HG3 . . 4.610 3.759 2.438 4.602 . 0 0 "[ . 1 . 2]" 2
813 1 23 PRO HD2 1 41 PHE QD . . 4.200 2.317 2.088 2.634 . 0 0 "[ . 1 . 2]" 2
814 1 23 PRO HG2 1 41 PHE QD . . 3.920 2.491 2.206 2.626 . 0 0 "[ . 1 . 2]" 2
815 1 41 PHE QD 1 46 ILE HG12 . . 4.800 4.198 2.819 4.783 . 0 0 "[ . 1 . 2]" 2
816 1 41 PHE QD 1 46 ILE HB . . 4.360 2.910 2.468 3.183 . 0 0 "[ . 1 . 2]" 2
817 1 41 PHE QD 1 46 ILE MG . . 4.220 4.152 3.805 4.257 0.037 7 0 "[ . 1 . 2]" 2
818 1 71 PHE H 1 71 PHE QD . . 5.440 4.092 3.868 4.253 . 0 0 "[ . 1 . 2]" 2
819 1 71 PHE QD 1 72 GLY H . . 5.500 3.493 2.717 4.827 . 0 0 "[ . 1 . 2]" 2
820 1 69 TYR QE 1 71 PHE QD . . 3.830 2.797 2.156 3.629 . 0 0 "[ . 1 . 2]" 2
821 1 8 MET H 1 8 MET HG3 . . 5.500 3.983 2.772 5.000 . 0 0 "[ . 1 . 2]" 2
822 1 8 MET H 1 8 MET HG2 . . 5.500 3.748 2.121 4.840 . 0 0 "[ . 1 . 2]" 2
823 1 17 LYS QG 1 18 GLU H . . 5.340 3.708 2.336 4.794 . 0 0 "[ . 1 . 2]" 2
824 1 20 VAL HA 1 20 VAL MG2 . . 3.410 3.195 3.181 3.203 . 0 0 "[ . 1 . 2]" 2
825 1 22 CYS HB2 1 24 ILE H . . 5.180 4.265 4.210 4.306 . 0 0 "[ . 1 . 2]" 2
826 1 22 CYS HB3 1 29 LEU HA . . 5.050 4.911 4.682 5.064 0.014 15 0 "[ . 1 . 2]" 2
827 1 21 THR MG 1 22 CYS HB2 . . 5.400 3.681 3.526 3.872 . 0 0 "[ . 1 . 2]" 2
828 1 24 ILE HG12 1 25 CYS H . . 5.140 4.795 4.708 4.846 . 0 0 "[ . 1 . 2]" 2
829 1 24 ILE MG 1 41 PHE QD . . 5.500 5.360 5.094 5.521 0.021 7 0 "[ . 1 . 2]" 2
830 1 24 ILE MD 1 42 CYS H . . 5.110 4.266 3.833 4.696 . 0 0 "[ . 1 . 2]" 2
831 1 24 ILE MG 1 25 CYS HA . . 4.750 3.353 3.205 3.626 . 0 0 "[ . 1 . 2]" 2
832 1 26 LEU HB2 1 26 LEU MD1 . . 3.120 2.188 2.086 2.273 . 0 0 "[ . 1 . 2]" 2
833 1 22 CYS HB3 1 29 LEU HG . . 4.910 4.383 4.138 4.762 . 0 0 "[ . 1 . 2]" 2
834 1 21 THR HA 1 29 LEU HG . . 4.380 3.078 2.781 3.285 . 0 0 "[ . 1 . 2]" 2
835 1 29 LEU MD2 1 41 PHE QD . . 4.860 4.147 3.876 4.544 . 0 0 "[ . 1 . 2]" 2
836 1 30 LYS HB2 1 31 GLU H . . 4.770 4.339 3.104 4.535 . 0 0 "[ . 1 . 2]" 2
837 1 30 LYS HA 1 30 LYS HD2 . . 5.170 4.410 2.832 5.305 0.135 20 0 "[ . 1 . 2]" 2
838 1 30 LYS HA 1 30 LYS HD3 . . 5.170 4.179 2.414 4.882 . 0 0 "[ . 1 . 2]" 2
839 1 31 GLU HB3 1 32 PRO HD2 . . 5.130 4.658 4.605 4.800 . 0 0 "[ . 1 . 2]" 2
840 1 31 GLU HB2 1 32 PRO HD2 . . 5.130 4.801 4.634 4.829 . 0 0 "[ . 1 . 2]" 2
841 1 31 GLU HB2 1 32 PRO HD3 . . 5.500 4.686 4.607 5.087 . 0 0 "[ . 1 . 2]" 2
842 1 31 GLU HB2 1 43 ARG HB3 . . 4.530 3.864 3.241 4.536 0.006 19 0 "[ . 1 . 2]" 2
843 1 29 LEU MD2 1 32 PRO HA . . 5.240 4.131 3.725 4.646 . 0 0 "[ . 1 . 2]" 2
844 1 22 CYS HA 1 23 PRO HG3 . . 5.080 4.316 4.314 4.321 . 0 0 "[ . 1 . 2]" 2
845 1 30 LYS HA 1 32 PRO HD2 . . 4.410 4.279 4.118 4.373 . 0 0 "[ . 1 . 2]" 2
846 1 33 VAL MG2 1 34 SER HA . . 5.010 4.402 4.254 4.487 . 0 0 "[ . 1 . 2]" 2
847 1 34 SER HB3 1 75 LYS QB . . 5.180 4.311 3.283 5.227 0.047 15 0 "[ . 1 . 2]" 2
848 1 40 SER HA 1 41 PHE QD . . 5.110 3.188 2.955 3.484 . 0 0 "[ . 1 . 2]" 2
849 1 23 PRO HD3 1 41 PHE HB3 . . 5.500 5.463 5.243 5.513 0.013 11 0 "[ . 1 . 2]" 2
850 1 41 PHE HB3 1 46 ILE H . . 4.870 3.594 3.404 3.833 . 0 0 "[ . 1 . 2]" 2
851 1 46 ILE HG13 1 74 LEU MD2 . . 4.920 4.197 3.001 4.674 . 0 0 "[ . 1 . 2]" 2
852 1 46 ILE HG13 1 74 LEU MD1 . . 4.690 3.438 2.912 4.307 . 0 0 "[ . 1 . 2]" 2
853 1 46 ILE HG12 1 74 LEU MD2 . . 4.920 3.521 2.800 4.231 . 0 0 "[ . 1 . 2]" 2
854 1 44 ALA MB 1 47 THR HB . . 4.840 3.945 3.754 4.226 . 0 0 "[ . 1 . 2]" 2
855 1 46 ILE MG 1 47 THR HB . . 5.110 3.782 3.644 3.891 . 0 0 "[ . 1 . 2]" 2
856 1 50 TYR QE 1 54 ARG QG . . 4.900 3.917 2.654 4.918 0.018 10 0 "[ . 1 . 2]" 2
857 1 50 TYR QE 1 71 PHE HB3 . . 5.070 4.595 3.956 5.082 0.012 10 0 "[ . 1 . 2]" 2
858 1 50 TYR HA 1 50 TYR QE . . 5.000 4.849 4.692 4.969 . 0 0 "[ . 1 . 2]" 2
859 1 50 TYR QE 1 60 GLY HA3 . . 4.830 3.499 2.851 4.104 . 0 0 "[ . 1 . 2]" 2
860 1 41 PHE HZ 1 63 PRO HD3 . . 5.500 5.104 4.795 5.401 . 0 0 "[ . 1 . 2]" 2
861 1 63 PRO HD3 1 64 VAL H . . 5.080 4.115 4.079 4.168 . 0 0 "[ . 1 . 2]" 2
862 1 52 SER QB 1 53 ASN HD22 . . 4.440 3.308 2.545 4.053 . 0 0 "[ . 1 . 2]" 2
863 1 54 ARG HA 1 54 ARG HD2 . . 5.270 4.624 3.799 5.299 0.029 4 0 "[ . 1 . 2]" 2
864 1 54 ARG HA 1 54 ARG HD3 . . 5.270 4.712 4.087 5.464 0.194 19 0 "[ . 1 . 2]" 2
865 1 50 TYR QE 1 54 ARG HD3 . . 4.900 3.904 2.858 4.872 . 0 0 "[ . 1 . 2]" 2
866 1 59 LYS HB2 1 59 LYS QE . . 5.080 3.988 3.319 4.472 . 0 0 "[ . 1 . 2]" 2
867 1 61 ASN HA 1 62 CYS HB2 . . 4.930 4.400 4.192 4.515 . 0 0 "[ . 1 . 2]" 2
868 1 36 ASP H 1 69 TYR HB2 . . 5.180 3.581 3.151 3.908 . 0 0 "[ . 1 . 2]" 2
869 1 36 ASP H 1 69 TYR QD . . 5.190 4.776 4.147 5.123 . 0 0 "[ . 1 . 2]" 2
870 1 69 TYR HA 1 70 PRO HG3 . . 5.110 4.393 4.343 4.449 . 0 0 "[ . 1 . 2]" 2
871 1 59 LYS QE 1 70 PRO HG3 . . 4.990 4.052 3.213 4.536 . 0 0 "[ . 1 . 2]" 2
872 1 69 TYR QD 1 70 PRO HD2 . . 5.050 3.802 3.389 4.044 . 0 0 "[ . 1 . 2]" 2
873 1 50 TYR HB3 1 71 PHE QD . . 5.000 4.519 3.687 5.003 0.003 17 0 "[ . 1 . 2]" 2
874 1 50 TYR HB2 1 71 PHE QD . . 5.000 3.873 2.807 4.465 . 0 0 "[ . 1 . 2]" 2
875 1 32 PRO HB2 1 77 ASN HB2 . . 4.320 3.944 3.080 4.324 0.004 7 0 "[ . 1 . 2]" 2
876 1 8 MET H 1 8 MET QG . . 4.780 3.300 2.103 4.263 . 0 0 "[ . 1 . 2]" 2
877 1 12 VAL H 1 12 VAL QG . . 3.730 2.318 1.816 2.951 . 0 0 "[ . 1 . 2]" 2
878 1 12 VAL QG 1 13 LEU H . . 4.100 2.783 1.907 3.732 . 0 0 "[ . 1 . 2]" 2
879 1 13 LEU H 1 13 LEU QB . . 3.610 2.528 2.122 3.216 . 0 0 "[ . 1 . 2]" 2
880 1 13 LEU HA 1 13 LEU QD . . 3.440 2.857 2.149 3.436 . 0 0 "[ . 1 . 2]" 2
881 1 13 LEU QB 1 14 GLU H . . 4.230 3.470 2.145 4.029 . 0 0 "[ . 1 . 2]" 2
882 1 13 LEU QD 1 14 GLU H . . 4.500 3.563 2.139 4.499 . 0 0 "[ . 1 . 2]" 2
883 1 15 MET QB 1 16 ILE H . . 3.940 3.232 1.960 3.869 . 0 0 "[ . 1 . 2]" 2
884 1 16 ILE H 1 16 ILE QG . . 3.440 2.531 2.010 3.061 . 0 0 "[ . 1 . 2]" 2
885 1 16 ILE HA 1 16 ILE QG . . 3.570 2.549 2.208 2.936 . 0 0 "[ . 1 . 2]" 2
886 1 16 ILE MG 1 18 GLU QG . . 4.000 3.033 1.794 4.004 0.004 3 0 "[ . 1 . 2]" 2
887 1 17 LYS H 1 17 LYS QD . . 3.950 3.709 1.868 4.101 0.151 9 0 "[ . 1 . 2]" 2
888 1 17 LYS HA 1 17 LYS QD . . 3.680 2.297 1.977 3.305 . 0 0 "[ . 1 . 2]" 2
889 1 17 LYS HB3 1 17 LYS QD . . 3.500 2.984 2.304 3.415 . 0 0 "[ . 1 . 2]" 2
890 1 17 LYS QD 1 18 GLU H . . 4.760 3.878 3.146 4.843 0.083 11 0 "[ . 1 . 2]" 2
891 1 18 GLU H 1 18 GLU QB . . 3.160 2.484 2.180 3.025 . 0 0 "[ . 1 . 2]" 2
892 1 18 GLU H 1 18 GLU QG . . 3.710 2.750 1.890 3.372 . 0 0 "[ . 1 . 2]" 2
893 1 19 GLU H 1 19 GLU QB . . 3.230 2.720 2.441 3.183 . 0 0 "[ . 1 . 2]" 2
894 1 19 GLU H 1 19 GLU QG . . 3.660 3.131 2.360 3.586 . 0 0 "[ . 1 . 2]" 2
895 1 19 GLU HA 1 19 GLU QG . . 3.380 2.407 2.132 3.339 . 0 0 "[ . 1 . 2]" 2
896 1 19 GLU QB 1 20 VAL H . . 3.940 2.898 2.251 3.906 . 0 0 "[ . 1 . 2]" 2
897 1 19 GLU QB 1 20 VAL MG1 . . 3.790 3.141 2.723 3.773 . 0 0 "[ . 1 . 2]" 2
898 1 19 GLU QB 1 20 VAL MG2 . . 4.570 3.986 3.620 4.609 0.039 20 0 "[ . 1 . 2]" 2
899 1 19 GLU QB 1 21 THR H . . 5.340 4.614 4.269 4.835 . 0 0 "[ . 1 . 2]" 2
900 1 19 GLU QG 1 20 VAL H . . 5.070 4.173 1.996 4.734 . 0 0 "[ . 1 . 2]" 2
901 1 22 CYS HB2 1 29 LEU QB . . 5.340 4.321 4.159 4.547 . 0 0 "[ . 1 . 2]" 2
902 1 23 PRO HA 1 64 VAL QG . . 5.040 4.482 3.986 4.894 . 0 0 "[ . 1 . 2]" 2
903 1 23 PRO QB 1 26 LEU MD2 . . 4.560 4.018 3.852 4.169 . 0 0 "[ . 1 . 2]" 2
904 1 23 PRO QB 1 41 PHE QD . . 5.130 4.418 4.197 4.547 . 0 0 "[ . 1 . 2]" 2
905 1 23 PRO QB 1 41 PHE QE . . 4.690 3.867 3.573 4.131 . 0 0 "[ . 1 . 2]" 2
906 1 23 PRO QB 1 64 VAL HA . . 4.970 4.391 4.064 4.820 . 0 0 "[ . 1 . 2]" 2
907 1 23 PRO QB 1 64 VAL QG . . 3.020 2.357 1.873 2.746 . 0 0 "[ . 1 . 2]" 2
908 1 23 PRO HG2 1 64 VAL QG . . 3.540 2.688 2.490 2.977 . 0 0 "[ . 1 . 2]" 2
909 1 23 PRO HG3 1 64 VAL QG . . 3.350 2.173 1.943 2.476 . 0 0 "[ . 1 . 2]" 2
910 1 23 PRO HD2 1 64 VAL QG . . 5.260 4.162 4.014 4.373 . 0 0 "[ . 1 . 2]" 2
911 1 23 PRO HD3 1 64 VAL QG . . 4.830 3.978 3.789 4.298 . 0 0 "[ . 1 . 2]" 2
912 1 24 ILE HB 1 45 CYS QB . . 3.430 3.200 2.975 3.342 . 0 0 "[ . 1 . 2]" 2
913 1 24 ILE MG 1 45 CYS QB . . 3.220 3.167 2.920 3.236 0.016 14 0 "[ . 1 . 2]" 2
914 1 24 ILE MG 1 49 ASN QB . . 4.180 3.782 3.269 4.200 0.020 15 0 "[ . 1 . 2]" 2
915 1 24 ILE MG 1 49 ASN QD . . 4.420 3.497 1.907 4.433 0.013 14 0 "[ . 1 . 2]" 2
916 1 24 ILE HG12 1 49 ASN QD . . 5.340 3.536 2.344 4.273 . 0 0 "[ . 1 . 2]" 2
917 1 24 ILE HG12 1 63 PRO QB . . 4.220 3.011 2.607 3.631 . 0 0 "[ . 1 . 2]" 2
918 1 24 ILE MD 1 45 CYS QB . . 3.050 1.942 1.848 2.060 . 0 0 "[ . 1 . 2]" 2
919 1 24 ILE MD 1 49 ASN QB . . 3.260 2.705 2.440 2.943 . 0 0 "[ . 1 . 2]" 2
920 1 24 ILE MD 1 49 ASN QD . . 4.910 3.052 1.931 3.881 . 0 0 "[ . 1 . 2]" 2
921 1 25 CYS H 1 45 CYS QB . . 4.930 4.515 4.286 4.692 . 0 0 "[ . 1 . 2]" 2
922 1 25 CYS QB 1 27 GLU QB . . 4.520 3.278 3.075 3.572 . 0 0 "[ . 1 . 2]" 2
923 1 25 CYS QB 1 27 GLU QG . . 4.080 3.318 2.379 3.838 . 0 0 "[ . 1 . 2]" 2
924 1 26 LEU QB 1 26 LEU MD2 . . 3.000 2.204 2.093 2.297 . 0 0 "[ . 1 . 2]" 2
925 1 27 GLU H 1 27 GLU QB . . 3.150 2.772 2.584 3.089 . 0 0 "[ . 1 . 2]" 2
926 1 27 GLU H 1 27 GLU QG . . 3.540 3.176 2.631 3.566 0.026 3 0 "[ . 1 . 2]" 2
927 1 27 GLU HA 1 27 GLU QG . . 3.450 2.653 2.218 3.325 . 0 0 "[ . 1 . 2]" 2
928 1 27 GLU QB 1 28 LEU H . . 2.970 2.414 2.130 2.649 . 0 0 "[ . 1 . 2]" 2
929 1 27 GLU QG 1 28 LEU H . . 4.020 3.511 3.005 4.029 0.009 7 0 "[ . 1 . 2]" 2
930 1 29 LEU H 1 29 LEU QB . . 3.310 2.405 2.303 2.552 . 0 0 "[ . 1 . 2]" 2
931 1 29 LEU QB 1 30 LYS H . . 4.200 3.356 3.210 3.514 . 0 0 "[ . 1 . 2]" 2
932 1 29 LEU QB 1 32 PRO HB2 . . 4.060 3.412 3.259 3.557 . 0 0 "[ . 1 . 2]" 2
933 1 29 LEU QB 1 32 PRO HB3 . . 3.630 2.136 1.974 2.255 . 0 0 "[ . 1 . 2]" 2
934 1 29 LEU QB 1 32 PRO QG . . 3.780 1.949 1.850 2.430 . 0 0 "[ . 1 . 2]" 2
935 1 29 LEU QB 1 32 PRO HD2 . . 4.720 3.852 3.749 4.371 . 0 0 "[ . 1 . 2]" 2
936 1 29 LEU QB 1 32 PRO HD3 . . 3.920 2.695 2.571 3.140 . 0 0 "[ . 1 . 2]" 2
937 1 29 LEU MD1 1 32 PRO QG . . 4.370 2.877 2.713 3.431 . 0 0 "[ . 1 . 2]" 2
938 1 29 LEU MD2 1 32 PRO QG . . 4.570 3.349 3.108 3.997 . 0 0 "[ . 1 . 2]" 2
939 1 30 LYS H 1 30 LYS QB . . 3.360 2.383 2.236 2.532 . 0 0 "[ . 1 . 2]" 2
940 1 30 LYS H 1 30 LYS QE . . 4.830 4.136 2.661 4.854 0.024 6 0 "[ . 1 . 2]" 2
941 1 30 LYS HA 1 30 LYS QG . . 3.590 2.491 2.178 3.312 . 0 0 "[ . 1 . 2]" 2
942 1 30 LYS HA 1 30 LYS QD . . 4.450 3.768 2.289 4.212 . 0 0 "[ . 1 . 2]" 2
943 1 30 LYS QB 1 30 LYS QE . . 3.540 2.429 1.965 3.515 . 0 0 "[ . 1 . 2]" 2
944 1 30 LYS QB 1 31 GLU H . . 4.170 3.553 3.031 3.914 . 0 0 "[ . 1 . 2]" 2
945 1 30 LYS QB 1 31 GLU QB . . 4.550 3.680 3.363 4.205 . 0 0 "[ . 1 . 2]" 2
946 1 30 LYS QB 1 42 CYS HB3 . . 4.190 3.471 2.934 4.204 0.014 20 0 "[ . 1 . 2]" 2
947 1 30 LYS QG 1 31 GLU H . . 4.840 3.862 2.898 4.721 . 0 0 "[ . 1 . 2]" 2
948 1 31 GLU HA 1 32 PRO QG . . 4.840 4.109 4.090 4.137 . 0 0 "[ . 1 . 2]" 2
949 1 31 GLU QB 1 43 ARG H . . 4.220 3.796 3.330 4.137 . 0 0 "[ . 1 . 2]" 2
950 1 31 GLU QB 1 43 ARG HB2 . . 3.770 2.758 2.019 3.284 . 0 0 "[ . 1 . 2]" 2
951 1 31 GLU QB 1 43 ARG HB3 . . 3.820 3.543 3.050 3.824 0.004 13 0 "[ . 1 . 2]" 2
952 1 31 GLU QB 1 43 ARG QD . . 4.150 3.240 2.141 4.178 0.028 11 0 "[ . 1 . 2]" 2
953 1 32 PRO HB2 1 77 ASN QB . . 3.760 3.229 2.658 3.709 . 0 0 "[ . 1 . 2]" 2
954 1 32 PRO QG 1 77 ASN QB . . 3.760 2.120 1.916 2.771 . 0 0 "[ . 1 . 2]" 2
955 1 33 VAL HB 1 74 LEU QB . . 3.380 1.992 1.939 2.124 . 0 0 "[ . 1 . 2]" 2
956 1 33 VAL MG1 1 43 ARG QG . . 4.280 3.618 2.610 4.312 0.032 15 0 "[ . 1 . 2]" 2
957 1 33 VAL MG1 1 76 PRO QB . . 3.840 3.485 2.910 3.844 0.004 15 0 "[ . 1 . 2]" 2
958 1 33 VAL MG1 1 76 PRO QD . . 4.400 4.045 3.441 4.404 0.004 18 0 "[ . 1 . 2]" 2
959 1 33 VAL MG2 1 46 ILE QG . . 4.580 3.027 2.358 3.936 . 0 0 "[ . 1 . 2]" 2
960 1 33 VAL MG2 1 74 LEU QB . . 4.750 2.238 1.939 2.608 . 0 0 "[ . 1 . 2]" 2
961 1 34 SER QB 1 35 ALA H . . 3.510 2.732 2.471 3.295 . 0 0 "[ . 1 . 2]" 2
962 1 34 SER QB 1 38 ASN HA . . 4.040 3.808 3.451 4.063 0.023 19 0 "[ . 1 . 2]" 2
963 1 34 SER QB 1 40 SER HA . . 4.780 4.454 3.746 4.711 . 0 0 "[ . 1 . 2]" 2
964 1 35 ALA MB 1 36 ASP QB . . 5.030 3.589 3.424 3.982 . 0 0 "[ . 1 . 2]" 2
965 1 35 ALA MB 1 69 TYR QB . . 3.420 3.224 3.162 3.293 . 0 0 "[ . 1 . 2]" 2
966 1 36 ASP H 1 36 ASP QB . . 3.480 2.258 2.150 2.750 . 0 0 "[ . 1 . 2]" 2
967 1 36 ASP H 1 69 TYR QB . . 4.480 3.340 2.985 3.661 . 0 0 "[ . 1 . 2]" 2
968 1 36 ASP QB 1 37 CYS H . . 3.610 2.723 2.625 2.820 . 0 0 "[ . 1 . 2]" 2
969 1 37 CYS H 1 37 CYS QB . . 3.200 2.766 2.693 2.825 . 0 0 "[ . 1 . 2]" 2
970 1 37 CYS QB 1 38 ASN H . . 4.050 4.032 4.009 4.039 . 0 0 "[ . 1 . 2]" 2
971 1 37 CYS QB 1 39 HIS HE1 . . 4.670 3.371 2.949 3.643 . 0 0 "[ . 1 . 2]" 2
972 1 37 CYS QB 1 67 VAL HB . . 3.850 3.497 2.849 3.855 0.005 14 0 "[ . 1 . 2]" 2
973 1 37 CYS QB 1 67 VAL QG . . 3.330 2.253 1.946 2.853 . 0 0 "[ . 1 . 2]" 2
974 1 39 HIS HB2 1 64 VAL QG . . 4.990 4.283 3.254 4.457 . 0 0 "[ . 1 . 2]" 2
975 1 39 HIS HB3 1 64 VAL QG . . 3.620 3.363 2.444 3.622 0.002 11 0 "[ . 1 . 2]" 2
976 1 39 HIS HD2 1 64 VAL QG . . 4.200 4.174 3.994 4.224 0.024 20 0 "[ . 1 . 2]" 2
977 1 39 HIS HE1 1 64 VAL QG . . 3.880 2.573 1.986 2.982 . 0 0 "[ . 1 . 2]" 2
978 1 39 HIS HE1 1 65 CYS QB . . 2.910 2.237 1.995 2.501 . 0 0 "[ . 1 . 2]" 2
979 1 39 HIS HE1 1 67 VAL QG . . 5.130 4.873 4.293 5.133 0.003 16 0 "[ . 1 . 2]" 2
980 1 40 SER QB 1 77 ASN QD . . 4.250 3.087 2.080 3.993 . 0 0 "[ . 1 . 2]" 2
981 1 41 PHE H 1 46 ILE QG . . 5.340 5.154 4.010 5.356 0.016 14 0 "[ . 1 . 2]" 2
982 1 41 PHE QD 1 46 ILE QG . . 4.130 3.618 2.305 3.879 . 0 0 "[ . 1 . 2]" 2
983 1 41 PHE QD 1 64 VAL QG . . 4.350 3.766 3.525 3.917 . 0 0 "[ . 1 . 2]" 2
984 1 41 PHE QE 1 64 VAL QG . . 3.690 1.997 1.833 2.383 . 0 0 "[ . 1 . 2]" 2
985 1 41 PHE HZ 1 64 VAL QG . . 4.280 2.923 1.945 3.570 . 0 0 "[ . 1 . 2]" 2
986 1 42 CYS H 1 45 CYS QB . . 3.630 2.767 2.615 2.904 . 0 0 "[ . 1 . 2]" 2
987 1 42 CYS HB2 1 45 CYS QB . . 3.450 2.033 1.967 2.184 . 0 0 "[ . 1 . 2]" 2
988 1 42 CYS HB3 1 45 CYS QB . . 4.030 3.686 3.616 3.844 . 0 0 "[ . 1 . 2]" 2
989 1 43 ARG H 1 43 ARG QG . . 4.340 3.980 3.712 4.089 . 0 0 "[ . 1 . 2]" 2
990 1 43 ARG HA 1 43 ARG QG . . 3.330 2.573 2.145 2.960 . 0 0 "[ . 1 . 2]" 2
991 1 45 CYS H 1 45 CYS QB . . 3.580 2.415 2.318 2.530 . 0 0 "[ . 1 . 2]" 2
992 1 45 CYS HA 1 48 LEU QD . . 4.810 3.405 1.949 4.680 . 0 0 "[ . 1 . 2]" 2
993 1 45 CYS QB 1 46 ILE H . . 3.480 2.205 2.061 2.395 . 0 0 "[ . 1 . 2]" 2
994 1 45 CYS QB 1 49 ASN H . . 5.300 4.456 4.237 4.681 . 0 0 "[ . 1 . 2]" 2
995 1 46 ILE H 1 46 ILE QG . . 4.660 4.014 3.834 4.075 . 0 0 "[ . 1 . 2]" 2
996 1 46 ILE HA 1 46 ILE QG . . 3.730 2.504 2.126 2.799 . 0 0 "[ . 1 . 2]" 2
997 1 46 ILE HA 1 49 ASN QB . . 3.300 2.944 2.551 3.202 . 0 0 "[ . 1 . 2]" 2
998 1 46 ILE QG 1 69 TYR QE . . 4.740 3.658 3.305 4.146 . 0 0 "[ . 1 . 2]" 2
999 1 46 ILE QG 1 71 PHE QE . . 4.760 3.359 2.789 4.434 . 0 0 "[ . 1 . 2]" 2
1000 1 46 ILE QG 1 74 LEU MD2 . . 4.210 3.289 2.740 3.918 . 0 0 "[ . 1 . 2]" 2
1001 1 47 THR HA 1 50 TYR QB . . 3.950 2.875 2.493 3.367 . 0 0 "[ . 1 . 2]" 2
1002 1 47 THR MG 1 51 GLU QG . . 3.720 2.659 2.102 3.161 . 0 0 "[ . 1 . 2]" 2
1003 1 48 LEU H 1 48 LEU QD . . 3.910 3.104 1.891 3.736 . 0 0 "[ . 1 . 2]" 2
1004 1 48 LEU HA 1 48 LEU QD . . 3.090 2.430 1.870 3.047 . 0 0 "[ . 1 . 2]" 2
1005 1 48 LEU HA 1 51 GLU QB . . 3.620 2.883 2.187 3.841 0.221 14 0 "[ . 1 . 2]" 2
1006 1 48 LEU QB 1 48 LEU QD . . 2.720 1.898 1.806 2.061 . 0 0 "[ . 1 . 2]" 2
1007 1 48 LEU QD 1 49 ASN H . . 4.650 3.551 2.829 3.931 . 0 0 "[ . 1 . 2]" 2
1008 1 48 LEU QD 1 51 GLU QB . . 4.630 3.619 2.851 4.644 0.014 15 0 "[ . 1 . 2]" 2
1009 1 49 ASN H 1 50 TYR QB . . 5.340 4.555 4.185 4.728 . 0 0 "[ . 1 . 2]" 2
1010 1 49 ASN HA 1 49 ASN QD . . 3.780 2.936 2.484 3.709 . 0 0 "[ . 1 . 2]" 2
1011 1 49 ASN HA 1 53 ASN QD . . 4.190 3.318 2.456 4.036 . 0 0 "[ . 1 . 2]" 2
1012 1 49 ASN QB 1 50 TYR H . . 3.590 2.444 2.235 2.729 . 0 0 "[ . 1 . 2]" 2
1013 1 49 ASN QD 1 63 PRO QB . . 4.310 2.353 1.874 4.127 . 0 0 "[ . 1 . 2]" 2
1014 1 49 ASN QD 1 63 PRO QG . . 4.650 3.112 2.425 3.812 . 0 0 "[ . 1 . 2]" 2
1015 1 50 TYR H 1 50 TYR QB . . 3.230 2.183 2.132 2.267 . 0 0 "[ . 1 . 2]" 2
1016 1 50 TYR HA 1 53 ASN QB . . 5.030 3.903 1.996 5.033 0.003 12 0 "[ . 1 . 2]" 2
1017 1 50 TYR QB 1 51 GLU H . . 3.730 2.484 2.274 2.657 . 0 0 "[ . 1 . 2]" 2
1018 1 50 TYR QB 1 71 PHE QE . . 4.190 3.191 2.102 3.856 . 0 0 "[ . 1 . 2]" 2
1019 1 50 TYR QD 1 60 GLY QA . . 3.790 2.152 1.944 2.551 . 0 0 "[ . 1 . 2]" 2
1020 1 50 TYR QE 1 54 ARG QB . . 4.720 3.136 2.028 4.706 . 0 0 "[ . 1 . 2]" 2
1021 1 50 TYR QE 1 54 ARG QD . . 4.080 3.334 2.716 4.021 . 0 0 "[ . 1 . 2]" 2
1022 1 50 TYR QE 1 71 PHE QB . . 4.330 3.529 2.872 4.086 . 0 0 "[ . 1 . 2]" 2
1023 1 51 GLU H 1 51 GLU QB . . 3.160 2.477 2.347 2.598 . 0 0 "[ . 1 . 2]" 2
1024 1 51 GLU H 1 51 GLU QG . . 3.530 2.210 1.925 2.429 . 0 0 "[ . 1 . 2]" 2
1025 1 51 GLU HA 1 51 GLU QG . . 3.540 2.600 2.268 3.334 . 0 0 "[ . 1 . 2]" 2
1026 1 51 GLU QB 1 52 SER H . . 3.840 2.517 2.153 3.587 . 0 0 "[ . 1 . 2]" 2
1027 1 53 ASN H 1 53 ASN QB . . 3.470 2.682 2.203 3.116 . 0 0 "[ . 1 . 2]" 2
1028 1 53 ASN QB 1 53 ASN QD . . 3.080 2.188 2.063 2.486 . 0 0 "[ . 1 . 2]" 2
1029 1 53 ASN QB 1 54 ARG H . . 3.670 3.561 3.265 3.720 0.050 14 0 "[ . 1 . 2]" 2
1030 1 53 ASN QB 1 54 ARG HA . . 5.340 4.237 4.065 4.703 . 0 0 "[ . 1 . 2]" 2
1031 1 54 ARG H 1 54 ARG QB . . 3.350 2.785 2.196 3.351 0.001 9 0 "[ . 1 . 2]" 2
1032 1 54 ARG HA 1 54 ARG QD . . 4.570 4.104 3.645 4.364 . 0 0 "[ . 1 . 2]" 2
1033 1 54 ARG HA 1 60 GLY QA . . 4.650 2.833 2.003 4.262 . 0 0 "[ . 1 . 2]" 2
1034 1 54 ARG QB 1 54 ARG QD . . 3.310 2.120 2.019 2.284 . 0 0 "[ . 1 . 2]" 2
1035 1 54 ARG QB 1 55 ASN H . . 3.740 2.583 2.054 3.602 . 0 0 "[ . 1 . 2]" 2
1036 1 55 ASN H 1 55 ASN QD . . 4.600 3.847 2.204 4.652 0.052 15 0 "[ . 1 . 2]" 2
1037 1 55 ASN H 1 60 GLY QA . . 4.570 3.474 2.502 4.511 . 0 0 "[ . 1 . 2]" 2
1038 1 55 ASN QB 1 59 LYS QB . . 4.780 3.342 1.918 4.694 . 0 0 "[ . 1 . 2]" 2
1039 1 55 ASN QD 1 59 LYS QB . . 4.040 2.961 1.880 4.029 . 0 0 "[ . 1 . 2]" 2
1040 1 57 ASP H 1 57 ASP QB . . 3.680 2.433 2.143 3.458 . 0 0 "[ . 1 . 2]" 2
1041 1 57 ASP QB 1 59 LYS H . . 4.560 3.132 2.786 3.657 . 0 0 "[ . 1 . 2]" 2
1042 1 59 LYS H 1 59 LYS QB . . 3.050 2.388 2.211 2.601 . 0 0 "[ . 1 . 2]" 2
1043 1 59 LYS H 1 59 LYS QG . . 3.350 2.517 1.942 3.247 . 0 0 "[ . 1 . 2]" 2
1044 1 59 LYS H 1 60 GLY QA . . 5.340 5.076 4.669 5.301 . 0 0 "[ . 1 . 2]" 2
1045 1 59 LYS QB 1 59 LYS QD . . 3.240 2.168 2.008 2.493 . 0 0 "[ . 1 . 2]" 2
1046 1 59 LYS QB 1 59 LYS QE . . 4.320 3.140 1.964 3.765 . 0 0 "[ . 1 . 2]" 2
1047 1 59 LYS QB 1 60 GLY H . . 3.530 2.496 1.995 3.118 . 0 0 "[ . 1 . 2]" 2
1048 1 59 LYS QB 1 68 PRO HB3 . . 4.430 3.600 2.779 4.428 . 0 0 "[ . 1 . 2]" 2
1049 1 59 LYS QB 1 69 TYR H . . 4.030 3.609 3.165 4.019 . 0 0 "[ . 1 . 2]" 2
1050 1 59 LYS QG 1 60 GLY H . . 4.640 3.936 3.218 4.459 . 0 0 "[ . 1 . 2]" 2
1051 1 59 LYS QD 1 69 TYR HA . . 5.340 4.166 2.939 5.347 0.007 18 0 "[ . 1 . 2]" 2
1052 1 59 LYS QD 1 70 PRO QD . . 4.850 3.971 2.857 4.835 . 0 0 "[ . 1 . 2]" 2
1053 1 59 LYS QE 1 70 PRO QB . . 4.210 2.652 2.081 3.373 . 0 0 "[ . 1 . 2]" 2
1054 1 59 LYS QE 1 70 PRO QG . . 4.320 3.817 3.119 4.166 . 0 0 "[ . 1 . 2]" 2
1055 1 59 LYS QE 1 70 PRO QD . . 4.540 2.921 2.095 3.839 . 0 0 "[ . 1 . 2]" 2
1056 1 60 GLY QA 1 61 ASN H . . 3.010 2.205 2.112 2.283 . 0 0 "[ . 1 . 2]" 2
1057 1 60 GLY QA 1 69 TYR QE . . 4.530 3.869 3.273 4.433 . 0 0 "[ . 1 . 2]" 2
1058 1 61 ASN H 1 61 ASN QB . . 3.270 2.720 2.234 3.249 . 0 0 "[ . 1 . 2]" 2
1059 1 61 ASN H 1 61 ASN QD . . 4.570 3.361 2.037 4.612 0.042 16 0 "[ . 1 . 2]" 2
1060 1 61 ASN QB 1 62 CYS H . . 3.960 2.920 2.568 3.649 . 0 0 "[ . 1 . 2]" 2
1061 1 61 ASN QB 1 66 ARG HA . . 3.680 2.788 2.383 3.764 0.084 16 0 "[ . 1 . 2]" 2
1062 1 61 ASN QB 1 69 TYR QE . . 5.340 4.960 4.720 5.230 . 0 0 "[ . 1 . 2]" 2
1063 1 62 CYS HB3 1 67 VAL QG . . 4.650 3.041 2.412 3.892 . 0 0 "[ . 1 . 2]" 2
1064 1 63 PRO QB 1 64 VAL HA . . 5.340 4.344 4.310 4.409 . 0 0 "[ . 1 . 2]" 2
1065 1 63 PRO QG 1 64 VAL QG . . 3.810 2.546 2.425 2.728 . 0 0 "[ . 1 . 2]" 2
1066 1 64 VAL H 1 64 VAL QG . . 3.250 2.666 1.812 2.811 . 0 0 "[ . 1 . 2]" 2
1067 1 64 VAL HA 1 64 VAL QG . . 2.750 2.139 2.080 2.179 . 0 0 "[ . 1 . 2]" 2
1068 1 64 VAL QG 1 65 CYS H . . 3.660 2.920 1.892 3.125 . 0 0 "[ . 1 . 2]" 2
1069 1 64 VAL QG 1 65 CYS HA . . 4.450 3.523 3.374 3.931 . 0 0 "[ . 1 . 2]" 2
1070 1 64 VAL QG 1 65 CYS QB . . 4.000 3.177 2.980 3.302 . 0 0 "[ . 1 . 2]" 2
1071 1 65 CYS QB 1 67 VAL QG . . 4.010 3.216 2.257 3.718 . 0 0 "[ . 1 . 2]" 2
1072 1 66 ARG H 1 66 ARG QG . . 4.350 2.999 2.390 4.339 . 0 0 "[ . 1 . 2]" 2
1073 1 66 ARG HA 1 66 ARG QG . . 3.720 2.640 2.213 3.431 . 0 0 "[ . 1 . 2]" 2
1074 1 66 ARG HA 1 66 ARG QD . . 3.770 2.658 2.026 3.705 . 0 0 "[ . 1 . 2]" 2
1075 1 67 VAL H 1 67 VAL QG . . 3.080 2.260 1.940 2.668 . 0 0 "[ . 1 . 2]" 2
1076 1 67 VAL HA 1 68 PRO QG . . 4.000 3.847 3.803 3.875 . 0 0 "[ . 1 . 2]" 2
1077 1 67 VAL QG 1 68 PRO HB2 . . 4.640 4.305 4.180 4.477 . 0 0 "[ . 1 . 2]" 2
1078 1 67 VAL QG 1 68 PRO QG . . 3.950 2.934 2.823 3.092 . 0 0 "[ . 1 . 2]" 2
1079 1 67 VAL QG 1 68 PRO HD2 . . 3.010 1.844 1.787 1.962 . 0 0 "[ . 1 . 2]" 2
1080 1 67 VAL QG 1 68 PRO HD3 . . 3.340 3.120 3.046 3.266 . 0 0 "[ . 1 . 2]" 2
1081 1 69 TYR HA 1 70 PRO QG . . 4.330 3.915 3.852 3.978 . 0 0 "[ . 1 . 2]" 2
1082 1 69 TYR HA 1 70 PRO QD . . 2.950 2.011 1.952 2.068 . 0 0 "[ . 1 . 2]" 2
1083 1 69 TYR QB 1 70 PRO QD . . 3.390 2.247 2.007 2.484 . 0 0 "[ . 1 . 2]" 2
1084 1 69 TYR QD 1 70 PRO QD . . 4.400 3.675 3.313 3.882 . 0 0 "[ . 1 . 2]" 2
1085 1 69 TYR QE 1 71 PHE QB . . 5.330 4.101 3.225 4.989 . 0 0 "[ . 1 . 2]" 2
1086 1 70 PRO QB 1 73 ASN H . . 4.000 3.731 3.484 3.955 . 0 0 "[ . 1 . 2]" 2
1087 1 70 PRO QB 1 73 ASN QB . . 3.870 3.065 2.293 3.816 . 0 0 "[ . 1 . 2]" 2
1088 1 70 PRO QB 1 73 ASN QD . . 5.000 3.419 1.894 4.723 . 0 0 "[ . 1 . 2]" 2
1089 1 70 PRO QG 1 73 ASN QB . . 3.640 2.203 1.867 2.443 . 0 0 "[ . 1 . 2]" 2
1090 1 70 PRO QG 1 73 ASN QD . . 4.130 2.719 1.844 3.921 . 0 0 "[ . 1 . 2]" 2
1091 1 70 PRO QD 1 73 ASN QB . . 3.920 3.756 3.332 3.905 . 0 0 "[ . 1 . 2]" 2
1092 1 71 PHE HA 1 73 ASN QB . . 5.340 4.899 4.538 5.311 . 0 0 "[ . 1 . 2]" 2
1093 1 72 GLY QA 1 73 ASN QB . . 5.180 4.372 4.128 4.572 . 0 0 "[ . 1 . 2]" 2
1094 1 73 ASN H 1 73 ASN QB . . 3.360 2.328 2.160 2.656 . 0 0 "[ . 1 . 2]" 2
1095 1 74 LEU H 1 74 LEU QB . . 3.600 2.582 2.463 2.699 . 0 0 "[ . 1 . 2]" 2
1096 1 74 LEU QB 1 74 LEU MD1 . . 3.270 2.013 1.932 2.097 . 0 0 "[ . 1 . 2]" 2
1097 1 74 LEU QB 1 75 LYS H . . 3.910 3.053 2.727 3.262 . 0 0 "[ . 1 . 2]" 2
1098 1 75 LYS QB 1 76 PRO QD . . 3.230 2.230 1.977 2.546 . 0 0 "[ . 1 . 2]" 2
1099 1 75 LYS QG 1 76 PRO QD . . 4.170 3.462 2.952 3.824 . 0 0 "[ . 1 . 2]" 2
1100 1 76 PRO HA 1 78 LEU QD . . 4.630 4.078 3.143 4.645 0.015 15 0 "[ . 1 . 2]" 2
1101 1 76 PRO QB 1 77 ASN H . . 3.700 3.375 2.980 3.726 0.026 16 0 "[ . 1 . 2]" 2
1102 1 76 PRO QB 1 78 LEU QB . . 5.190 3.989 2.707 5.163 . 0 0 "[ . 1 . 2]" 2
1103 1 76 PRO QB 1 78 LEU HG . . 5.340 3.899 2.014 5.334 . 0 0 "[ . 1 . 2]" 2
1104 1 76 PRO QB 1 78 LEU QD . . 3.750 2.262 1.786 2.907 . 0 0 "[ . 1 . 2]" 2
1105 1 76 PRO QG 1 78 LEU QD . . 3.970 2.998 2.383 3.649 . 0 0 "[ . 1 . 2]" 2
1106 1 76 PRO QD 1 78 LEU QD . . 5.280 4.435 3.830 5.044 . 0 0 "[ . 1 . 2]" 2
1107 1 77 ASN HA 1 80 VAL QG . . 4.520 2.914 1.852 4.433 . 0 0 "[ . 1 . 2]" 2
1108 1 77 ASN QB 1 80 VAL QG . . 4.120 3.545 2.723 4.070 . 0 0 "[ . 1 . 2]" 2
1109 1 77 ASN QD 1 80 VAL QG . . 4.250 2.870 1.808 3.966 . 0 0 "[ . 1 . 2]" 2
1110 1 78 LEU H 1 78 LEU QD . . 4.290 2.614 1.840 3.543 . 0 0 "[ . 1 . 2]" 2
1111 1 78 LEU H 1 80 VAL QG . . 5.040 3.199 2.044 4.578 . 0 0 "[ . 1 . 2]" 2
1112 1 78 LEU HA 1 78 LEU QD . . 3.690 2.847 1.916 3.395 . 0 0 "[ . 1 . 2]" 2
1113 1 78 LEU HA 1 80 VAL QG . . 5.440 4.091 3.256 5.191 . 0 0 "[ . 1 . 2]" 2
1114 1 78 LEU QB 1 78 LEU QD . . 2.830 1.864 1.753 2.014 . 0 0 "[ . 1 . 2]" 2
1115 1 78 LEU QD 1 79 HIS H . . 5.440 3.667 2.544 4.532 . 0 0 "[ . 1 . 2]" 2
1116 1 79 HIS QB 1 80 VAL H . . 4.320 3.775 3.032 4.027 . 0 0 "[ . 1 . 2]" 2
1117 1 80 VAL H 1 80 VAL QG . . 3.540 2.137 1.778 2.948 . 0 0 "[ . 1 . 2]" 2
1118 1 80 VAL QG 1 81 ALA H . . 4.190 3.193 2.418 3.743 . 0 0 "[ . 1 . 2]" 2
1119 1 80 VAL QG 1 81 ALA HA . . 5.440 3.782 3.199 4.462 . 0 0 "[ . 1 . 2]" 2
1120 1 81 ALA HA 1 84 VAL QG . . 4.570 4.173 2.700 4.571 0.001 4 0 "[ . 1 . 2]" 2
1121 1 82 ASN QB 1 83 ILE H . . 4.160 2.729 2.057 4.017 . 0 0 "[ . 1 . 2]" 2
1122 1 84 VAL H 1 84 VAL QG . . 3.650 2.190 1.833 2.900 . 0 0 "[ . 1 . 2]" 2
1123 1 84 VAL QG 1 85 GLU H . . 4.360 3.090 1.932 3.737 . 0 0 "[ . 1 . 2]" 2
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