NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
444574 |
2khq   |
16251 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2khq
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 2114
_Distance_constraint_stats_list.Viol_count 1152
_Distance_constraint_stats_list.Viol_total 994.747
_Distance_constraint_stats_list.Viol_max 0.324
_Distance_constraint_stats_list.Viol_rms 0.0100
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0012
_Distance_constraint_stats_list.Viol_average_violations_only 0.0432
_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 1 MET 0.661 0.086 3 0 "[ . 1 . 2]"
1 2 ILE 0.145 0.043 2 0 "[ . 1 . 2]"
1 3 THR 0.483 0.169 12 0 "[ . 1 . 2]"
1 4 PHE 0.273 0.076 14 0 "[ . 1 . 2]"
1 5 ALA 0.108 0.047 11 0 "[ . 1 . 2]"
1 6 ASP 0.096 0.037 20 0 "[ . 1 . 2]"
1 7 TYR 0.623 0.082 13 0 "[ . 1 . 2]"
1 8 PHE 0.532 0.069 18 0 "[ . 1 . 2]"
1 9 TYR 1.561 0.111 11 0 "[ . 1 . 2]"
1 10 GLN 0.923 0.120 15 0 "[ . 1 . 2]"
1 11 TRP 0.864 0.111 17 0 "[ . 1 . 2]"
1 12 TYR 3.109 0.155 4 0 "[ . 1 . 2]"
1 13 GLU 0.403 0.065 5 0 "[ . 1 . 2]"
1 14 VAL 0.609 0.136 17 0 "[ . 1 . 2]"
1 15 ASN 2.105 0.136 17 0 "[ . 1 . 2]"
1 16 LYS 1.217 0.098 16 0 "[ . 1 . 2]"
1 17 LEU 2.280 0.112 12 0 "[ . 1 . 2]"
1 18 PRO 0.817 0.112 12 0 "[ . 1 . 2]"
1 19 HIS 1.080 0.081 11 0 "[ . 1 . 2]"
1 20 VAL 0.683 0.086 11 0 "[ . 1 . 2]"
1 21 SER 0.611 0.178 16 0 "[ . 1 . 2]"
1 22 GLU 1.070 0.203 10 0 "[ . 1 . 2]"
1 23 SER 0.030 0.030 4 0 "[ . 1 . 2]"
1 24 THR 1.506 0.150 7 0 "[ . 1 . 2]"
1 25 LYS 0.817 0.155 4 0 "[ . 1 . 2]"
1 26 ARG 0.467 0.203 10 0 "[ . 1 . 2]"
1 27 HIS 0.368 0.041 20 0 "[ . 1 . 2]"
1 28 TYR 0.383 0.060 2 0 "[ . 1 . 2]"
1 29 GLU 0.440 0.192 3 0 "[ . 1 . 2]"
1 30 SER 0.470 0.177 6 0 "[ . 1 . 2]"
1 31 ALA 0.195 0.056 20 0 "[ . 1 . 2]"
1 32 TYR 0.700 0.058 16 0 "[ . 1 . 2]"
1 33 LYS 3.109 0.324 5 0 "[ . 1 . 2]"
1 34 HIS 2.394 0.324 5 0 "[ . 1 . 2]"
1 35 ILE 0.456 0.124 9 0 "[ . 1 . 2]"
1 36 LYS 1.372 0.111 8 0 "[ . 1 . 2]"
1 37 ASP 0.311 0.099 5 0 "[ . 1 . 2]"
1 38 HIS 0.343 0.078 16 0 "[ . 1 . 2]"
1 39 PHE 1.186 0.104 3 0 "[ . 1 . 2]"
1 40 ARG 1.258 0.111 8 0 "[ . 1 . 2]"
1 41 HIS 0.459 0.169 12 0 "[ . 1 . 2]"
1 42 LYS 2.824 0.315 9 0 "[ . 1 . 2]"
1 43 LEU 1.333 0.093 14 0 "[ . 1 . 2]"
1 44 LEU 1.617 0.180 14 0 "[ . 1 . 2]"
1 45 LYS 2.274 0.205 7 0 "[ . 1 . 2]"
1 46 ASP 1.367 0.227 2 0 "[ . 1 . 2]"
1 47 ILE 1.013 0.166 2 0 "[ . 1 . 2]"
1 48 LYS 0.453 0.159 20 0 "[ . 1 . 2]"
1 49 ARG 0.795 0.124 18 0 "[ . 1 . 2]"
1 50 THR 1.131 0.117 5 0 "[ . 1 . 2]"
1 51 GLU 1.370 0.159 20 0 "[ . 1 . 2]"
1 52 TYR 0.074 0.031 20 0 "[ . 1 . 2]"
1 53 GLN 1.706 0.213 4 0 "[ . 1 . 2]"
1 54 LYS 1.361 0.213 4 0 "[ . 1 . 2]"
1 55 PHE 1.000 0.078 16 0 "[ . 1 . 2]"
1 56 LEU 0.362 0.094 18 0 "[ . 1 . 2]"
1 57 ASN 0.834 0.118 17 0 "[ . 1 . 2]"
1 58 GLU 0.164 0.071 17 0 "[ . 1 . 2]"
1 59 TYR 1.019 0.061 18 0 "[ . 1 . 2]"
1 60 GLY 0.054 0.018 9 0 "[ . 1 . 2]"
1 61 LEU 0.813 0.097 2 0 "[ . 1 . 2]"
1 62 THR 0.131 0.079 2 0 "[ . 1 . 2]"
1 63 HIS 0.348 0.094 14 0 "[ . 1 . 2]"
1 64 SER 0.008 0.008 17 0 "[ . 1 . 2]"
1 65 TYR 3.107 0.158 19 0 "[ . 1 . 2]"
1 66 GLU 2.165 0.158 19 0 "[ . 1 . 2]"
1 67 THR 0.297 0.094 14 0 "[ . 1 . 2]"
1 68 ILE 0.119 0.029 14 0 "[ . 1 . 2]"
1 69 ARG 0.398 0.133 14 0 "[ . 1 . 2]"
1 70 LYS 1.487 0.229 11 0 "[ . 1 . 2]"
1 71 LEU 1.020 0.077 8 0 "[ . 1 . 2]"
1 72 ASN 0.600 0.059 2 0 "[ . 1 . 2]"
1 73 SER 0.294 0.070 15 0 "[ . 1 . 2]"
1 74 TYR 2.439 0.229 11 0 "[ . 1 . 2]"
1 75 ILE 0.328 0.094 18 0 "[ . 1 . 2]"
1 76 ARG 0.288 0.044 19 0 "[ . 1 . 2]"
1 77 ASN 0.807 0.111 17 0 "[ . 1 . 2]"
1 78 ALA 0.261 0.056 19 0 "[ . 1 . 2]"
1 79 PHE 0.648 0.089 3 0 "[ . 1 . 2]"
1 80 ASP 0.648 0.100 20 0 "[ . 1 . 2]"
1 81 ASP 0.271 0.076 8 0 "[ . 1 . 2]"
1 82 ALA 0.860 0.106 6 0 "[ . 1 . 2]"
1 83 ILE 3.608 0.148 6 0 "[ . 1 . 2]"
1 84 HIS 1.230 0.134 1 0 "[ . 1 . 2]"
1 85 GLU 1.731 0.148 6 0 "[ . 1 . 2]"
1 86 GLY 0.456 0.081 13 0 "[ . 1 . 2]"
1 87 TYR 1.868 0.106 6 0 "[ . 1 . 2]"
1 88 VAL 1.220 0.180 14 0 "[ . 1 . 2]"
1 89 ILE 0.340 0.104 16 0 "[ . 1 . 2]"
1 90 LYS 0.380 0.104 16 0 "[ . 1 . 2]"
1 91 ASN 0.197 0.042 17 0 "[ . 1 . 2]"
1 92 PRO 0.514 0.112 7 0 "[ . 1 . 2]"
1 93 THR 0.487 0.078 7 0 "[ . 1 . 2]"
1 94 TYR 1.107 0.123 13 0 "[ . 1 . 2]"
1 95 LYS 1.667 0.123 13 0 "[ . 1 . 2]"
1 96 ALA 1.009 0.247 20 0 "[ . 1 . 2]"
1 97 GLU 1.163 0.247 20 0 "[ . 1 . 2]"
1 98 LEU 1.907 0.129 4 0 "[ . 1 . 2]"
1 99 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 ALA 0.806 0.134 12 0 "[ . 1 . 2]"
1 101 SER 0.050 0.050 11 0 "[ . 1 . 2]"
1 102 VAL 1.489 0.134 12 0 "[ . 1 . 2]"
1 103 LEU 0.860 0.280 18 0 "[ . 1 . 2]"
1 104 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ILE MG 1 3 THR H . . 5.800 3.572 3.280 3.811 . 0 0 "[ . 1 . 2]" 1
2 1 2 ILE MD 1 3 THR H . . 6.000 3.497 2.120 4.180 . 0 0 "[ . 1 . 2]" 1
3 1 3 THR H 1 43 LEU MD2 . . 5.320 3.620 3.077 4.155 . 0 0 "[ . 1 . 2]" 1
4 1 4 PHE H 1 44 LEU HA . . 5.660 3.662 3.340 4.023 . 0 0 "[ . 1 . 2]" 1
5 1 4 PHE H 1 43 LEU HA . . 4.510 3.043 2.838 3.341 . 0 0 "[ . 1 . 2]" 1
6 1 5 ALA H 1 35 ILE MG . . 5.160 3.434 3.173 3.813 . 0 0 "[ . 1 . 2]" 1
7 1 5 ALA H 1 5 ALA MB . . 3.630 2.232 2.223 2.241 . 0 0 "[ . 1 . 2]" 1
8 1 4 PHE HB2 1 5 ALA H . . 4.870 3.950 3.848 4.041 . 0 0 "[ . 1 . 2]" 1
9 1 4 PHE HB3 1 5 ALA H . . 4.870 2.658 2.508 2.797 . 0 0 "[ . 1 . 2]" 1
10 1 4 PHE H 1 5 ALA H . . 4.580 2.723 2.624 2.846 . 0 0 "[ . 1 . 2]" 1
11 1 5 ALA MB 1 6 ASP H . . 3.930 2.323 2.201 2.421 . 0 0 "[ . 1 . 2]" 1
12 1 3 THR HG1 1 6 ASP H . . 5.320 2.944 2.475 3.439 . 0 0 "[ . 1 . 2]" 1
13 1 6 ASP H 1 7 TYR H . . 4.100 2.611 2.506 2.729 . 0 0 "[ . 1 . 2]" 1
14 1 5 ALA H 1 6 ASP H . . 4.380 2.807 2.723 2.882 . 0 0 "[ . 1 . 2]" 1
15 1 6 ASP H 1 8 PHE H . . 5.590 4.194 4.076 4.334 . 0 0 "[ . 1 . 2]" 1
16 1 2 ILE MG 1 7 TYR H . . 5.030 3.787 3.416 4.197 . 0 0 "[ . 1 . 2]" 1
17 1 2 ILE MD 1 7 TYR H . . 5.240 3.351 3.050 4.152 . 0 0 "[ . 1 . 2]" 1
18 1 2 ILE HG13 1 7 TYR H . . 5.130 4.278 2.838 5.137 0.007 19 0 "[ . 1 . 2]" 1
19 1 2 ILE HG12 1 7 TYR H . . 5.130 3.206 2.711 3.888 . 0 0 "[ . 1 . 2]" 1
20 1 6 ASP HB2 1 7 TYR H . . 4.720 3.271 2.529 3.992 . 0 0 "[ . 1 . 2]" 1
21 1 6 ASP HB3 1 7 TYR H . . 4.720 3.178 2.507 3.786 . 0 0 "[ . 1 . 2]" 1
22 1 7 TYR H 1 7 TYR QB . . 3.600 2.263 2.240 2.285 . 0 0 "[ . 1 . 2]" 1
23 1 4 PHE HA 1 7 TYR H . . 4.880 3.567 3.388 3.754 . 0 0 "[ . 1 . 2]" 1
24 1 7 TYR H 1 7 TYR QD . . 5.090 4.206 4.184 4.221 . 0 0 "[ . 1 . 2]" 1
25 1 7 TYR H 1 8 PHE H . . 4.130 2.699 2.562 2.767 . 0 0 "[ . 1 . 2]" 1
26 1 8 PHE H 1 8 PHE HB2 . . 4.000 2.504 2.461 2.541 . 0 0 "[ . 1 . 2]" 1
27 1 7 TYR QB 1 8 PHE H . . 4.030 2.521 2.353 2.626 . 0 0 "[ . 1 . 2]" 1
28 1 8 PHE H 1 8 PHE HB3 . . 4.070 2.547 2.502 2.601 . 0 0 "[ . 1 . 2]" 1
29 1 4 PHE HA 1 8 PHE H . . 5.790 3.841 3.679 4.060 . 0 0 "[ . 1 . 2]" 1
30 1 6 ASP HA 1 8 PHE H . . 6.000 4.454 4.322 4.720 . 0 0 "[ . 1 . 2]" 1
31 1 4 PHE QE 1 8 PHE H . . 6.000 4.944 4.675 5.329 . 0 0 "[ . 1 . 2]" 1
32 1 7 TYR QE 1 8 PHE H . . 6.000 5.494 5.235 5.963 . 0 0 "[ . 1 . 2]" 1
33 1 8 PHE H 1 8 PHE QD . . 5.130 4.183 4.173 4.196 . 0 0 "[ . 1 . 2]" 1
34 1 8 PHE H 1 32 TYR QD . . 5.940 4.985 4.712 5.340 . 0 0 "[ . 1 . 2]" 1
35 1 9 TYR H 1 35 ILE MD . . 5.900 5.248 5.012 5.518 . 0 0 "[ . 1 . 2]" 1
36 1 9 TYR H 1 9 TYR QB . . 3.580 2.276 2.239 2.318 . 0 0 "[ . 1 . 2]" 1
37 1 8 PHE HB3 1 9 TYR H . . 4.380 2.488 2.388 2.578 . 0 0 "[ . 1 . 2]" 1
38 1 7 TYR QD 1 9 TYR H . . 6.000 5.529 5.372 5.770 . 0 0 "[ . 1 . 2]" 1
39 1 8 PHE H 1 9 TYR H . . 4.350 2.778 2.679 2.887 . 0 0 "[ . 1 . 2]" 1
40 1 10 GLN H 1 10 GLN QB . . 3.510 2.256 2.154 2.488 . 0 0 "[ . 1 . 2]" 1
41 1 10 GLN H 1 10 GLN HG2 . . 4.890 4.310 2.414 4.578 . 0 0 "[ . 1 . 2]" 1
42 1 9 TYR QB 1 10 GLN H . . 4.070 2.527 2.400 2.687 . 0 0 "[ . 1 . 2]" 1
43 1 7 TYR QB 1 10 GLN H . . 6.000 5.103 4.961 5.295 . 0 0 "[ . 1 . 2]" 1
44 1 9 TYR H 1 10 GLN H . . 3.910 2.644 2.537 2.734 . 0 0 "[ . 1 . 2]" 1
45 1 10 GLN H 1 11 TRP H . . 4.090 2.695 2.546 2.779 . 0 0 "[ . 1 . 2]" 1
46 1 7 TYR HA 1 10 GLN HE21 . . 5.960 4.123 2.423 5.846 . 0 0 "[ . 1 . 2]" 1
47 1 7 TYR HA 1 10 GLN HE22 . . 5.960 4.667 3.763 5.985 0.025 13 0 "[ . 1 . 2]" 1
48 1 10 GLN QB 1 11 TRP H . . 4.150 2.498 2.244 3.517 . 0 0 "[ . 1 . 2]" 1
49 1 11 TRP H 1 11 TRP HB2 . . 4.010 2.628 2.437 2.752 . 0 0 "[ . 1 . 2]" 1
50 1 11 TRP H 1 11 TRP HB3 . . 4.010 2.372 2.237 2.488 . 0 0 "[ . 1 . 2]" 1
51 1 11 TRP H 1 14 VAL H . . 5.870 4.899 4.768 5.068 . 0 0 "[ . 1 . 2]" 1
52 1 11 TRP H 1 12 TYR H . . 4.140 2.801 2.700 2.860 . 0 0 "[ . 1 . 2]" 1
53 1 12 TYR H 1 13 GLU QB . . 5.460 4.451 4.247 4.563 . 0 0 "[ . 1 . 2]" 1
54 1 12 TYR H 1 12 TYR HB2 . . 4.030 2.758 2.617 2.846 . 0 0 "[ . 1 . 2]" 1
55 1 12 TYR H 1 12 TYR HB3 . . 4.030 2.307 2.197 2.419 . 0 0 "[ . 1 . 2]" 1
56 1 9 TYR HA 1 12 TYR H . . 5.110 3.487 3.260 3.631 . 0 0 "[ . 1 . 2]" 1
57 1 12 TYR H 1 13 GLU H . . 4.380 2.739 2.626 2.826 . 0 0 "[ . 1 . 2]" 1
58 1 12 TYR HB3 1 13 GLU H . . 5.370 2.568 2.325 2.760 . 0 0 "[ . 1 . 2]" 1
59 1 10 GLN HA 1 13 GLU H . . 5.590 3.436 3.155 3.660 . 0 0 "[ . 1 . 2]" 1
60 1 13 GLU QB 1 14 VAL H . . 4.040 2.739 2.475 3.201 . 0 0 "[ . 1 . 2]" 1
61 1 14 VAL H 1 14 VAL HB . . 3.790 2.521 2.443 2.645 . 0 0 "[ . 1 . 2]" 1
62 1 10 GLN HA 1 14 VAL H . . 5.730 4.074 3.509 4.427 . 0 0 "[ . 1 . 2]" 1
63 1 14 VAL H 1 15 ASN H . . 3.900 2.426 2.163 2.639 . 0 0 "[ . 1 . 2]" 1
64 1 13 GLU H 1 14 VAL H . . 4.680 2.734 2.594 2.862 . 0 0 "[ . 1 . 2]" 1
65 1 14 VAL HB 1 15 ASN H . . 4.350 3.101 2.897 3.279 . 0 0 "[ . 1 . 2]" 1
66 1 14 VAL HB 1 15 ASN HD21 . . 5.360 3.542 2.546 4.723 . 0 0 "[ . 1 . 2]" 1
67 1 12 TYR HA 1 16 LYS H . . 5.270 2.913 2.625 3.380 . 0 0 "[ . 1 . 2]" 1
68 1 16 LYS H 1 18 PRO HD2 . . 5.890 4.338 3.644 5.903 0.013 12 0 "[ . 1 . 2]" 1
69 1 17 LEU H 1 17 LEU HB2 . . 4.080 2.464 2.318 3.293 . 0 0 "[ . 1 . 2]" 1
70 1 17 LEU H 1 17 LEU MD2 . . 5.130 4.323 4.248 4.756 . 0 0 "[ . 1 . 2]" 1
71 1 17 LEU H 1 17 LEU MD1 . . 4.990 3.979 3.868 4.410 . 0 0 "[ . 1 . 2]" 1
72 1 17 LEU H 1 17 LEU HG . . 5.590 4.533 4.499 4.679 . 0 0 "[ . 1 . 2]" 1
73 1 17 LEU H 1 17 LEU HB3 . . 4.170 2.702 2.628 3.035 . 0 0 "[ . 1 . 2]" 1
74 1 17 LEU H 1 18 PRO HD2 . . 4.850 2.757 1.698 3.337 . 0 0 "[ . 1 . 2]" 1
75 1 17 LEU H 1 18 PRO HD3 . . 4.550 2.922 2.543 3.315 . 0 0 "[ . 1 . 2]" 1
76 1 12 TYR QD 1 17 LEU H . . 6.000 4.234 3.719 5.934 . 0 0 "[ . 1 . 2]" 1
77 1 19 HIS H 1 20 VAL MG2 . . 4.690 3.273 3.061 3.465 . 0 0 "[ . 1 . 2]" 1
78 1 19 HIS H 1 20 VAL MG1 . . 4.950 3.624 3.187 3.985 . 0 0 "[ . 1 . 2]" 1
79 1 18 PRO HD2 1 19 HIS H . . 4.850 2.910 2.330 3.211 . 0 0 "[ . 1 . 2]" 1
80 1 17 LEU HA 1 19 HIS H . . 5.960 3.930 3.771 4.312 . 0 0 "[ . 1 . 2]" 1
81 1 16 LYS HA 1 19 HIS H . . 5.690 3.884 3.643 4.078 . 0 0 "[ . 1 . 2]" 1
82 1 19 HIS H 1 19 HIS HD2 . . 5.190 3.215 2.858 3.508 . 0 0 "[ . 1 . 2]" 1
83 1 19 HIS H 1 20 VAL H . . 3.600 2.063 1.889 2.290 . 0 0 "[ . 1 . 2]" 1
84 1 20 VAL MG1 1 21 SER H . . 4.540 3.725 3.542 3.871 . 0 0 "[ . 1 . 2]" 1
85 1 21 SER H 1 24 THR MG . . 4.960 3.969 3.193 4.541 . 0 0 "[ . 1 . 2]" 1
86 1 20 VAL HB 1 21 SER H . . 3.990 2.509 1.990 2.903 . 0 0 "[ . 1 . 2]" 1
87 1 21 SER H 1 24 THR HB . . 4.700 2.934 2.161 3.433 . 0 0 "[ . 1 . 2]" 1
88 1 20 VAL HA 1 21 SER H . . 3.520 2.342 2.176 2.597 . 0 0 "[ . 1 . 2]" 1
89 1 22 GLU H 1 22 GLU QG . . 4.470 2.615 2.091 3.853 . 0 0 "[ . 1 . 2]" 1
90 1 22 GLU QB 1 23 SER H . . 4.730 2.987 2.396 3.578 . 0 0 "[ . 1 . 2]" 1
91 1 20 VAL MG2 1 24 THR H . . 5.990 4.418 4.038 4.904 . 0 0 "[ . 1 . 2]" 1
92 1 24 THR H 1 24 THR MG . . 4.700 3.758 3.721 3.791 . 0 0 "[ . 1 . 2]" 1
93 1 22 GLU QB 1 24 THR H . . 5.730 4.918 4.617 5.392 . 0 0 "[ . 1 . 2]" 1
94 1 20 VAL HB 1 24 THR H . . 5.230 4.085 3.567 4.533 . 0 0 "[ . 1 . 2]" 1
95 1 23 SER QB 1 24 THR H . . 4.300 2.805 2.331 3.320 . 0 0 "[ . 1 . 2]" 1
96 1 24 THR H 1 24 THR HB . . 3.790 2.646 2.517 2.797 . 0 0 "[ . 1 . 2]" 1
97 1 23 SER H 1 24 THR H . . 5.170 2.718 2.580 2.929 . 0 0 "[ . 1 . 2]" 1
98 1 24 THR H 1 25 LYS H . . 4.010 2.510 2.299 2.771 . 0 0 "[ . 1 . 2]" 1
99 1 20 VAL MG2 1 25 LYS H . . 4.730 3.374 2.987 3.970 . 0 0 "[ . 1 . 2]" 1
100 1 40 ARG HB2 1 41 HIS H . . 4.610 3.171 1.989 4.575 . 0 0 "[ . 1 . 2]" 1
101 1 20 VAL HB 1 25 LYS H . . 6.000 4.067 3.422 4.656 . 0 0 "[ . 1 . 2]" 1
102 1 22 GLU QG 1 25 LYS H . . 6.000 5.102 4.612 5.620 . 0 0 "[ . 1 . 2]" 1
103 1 22 GLU HA 1 25 LYS H . . 4.960 3.062 2.679 3.474 . 0 0 "[ . 1 . 2]" 1
104 1 24 THR HB 1 25 LYS H . . 4.570 2.746 2.596 2.885 . 0 0 "[ . 1 . 2]" 1
105 1 25 LYS H 1 26 ARG H . . 4.470 2.753 2.674 2.831 . 0 0 "[ . 1 . 2]" 1
106 1 26 ARG H 1 26 ARG QG . . 4.220 2.593 2.046 4.063 . 0 0 "[ . 1 . 2]" 1
107 1 22 GLU QG 1 26 ARG H . . 6.000 5.523 4.077 6.203 0.203 10 0 "[ . 1 . 2]" 1
108 1 26 ARG QG 1 27 HIS H . . 4.980 3.905 2.458 4.442 . 0 0 "[ . 1 . 2]" 1
109 1 26 ARG QB 1 27 HIS H . . 4.250 2.775 2.450 3.606 . 0 0 "[ . 1 . 2]" 1
110 1 24 THR HA 1 27 HIS H . . 4.570 3.286 3.007 3.701 . 0 0 "[ . 1 . 2]" 1
111 1 26 ARG H 1 27 HIS H . . 4.230 2.726 2.523 2.848 . 0 0 "[ . 1 . 2]" 1
112 1 27 HIS H 1 28 TYR H . . 4.000 2.731 2.546 2.838 . 0 0 "[ . 1 . 2]" 1
113 1 25 LYS H 1 27 HIS H . . 5.930 4.174 3.940 4.382 . 0 0 "[ . 1 . 2]" 1
114 1 27 HIS H 1 29 GLU H . . 6.000 4.107 4.003 4.249 . 0 0 "[ . 1 . 2]" 1
115 1 24 THR MG 1 28 TYR H . . 5.130 3.945 3.698 4.215 . 0 0 "[ . 1 . 2]" 1
116 1 28 TYR H 1 29 GLU QB . . 5.840 4.636 4.206 4.793 . 0 0 "[ . 1 . 2]" 1
117 1 27 HIS HB3 1 28 TYR H . . 4.900 3.293 3.048 3.687 . 0 0 "[ . 1 . 2]" 1
118 1 27 HIS HB2 1 28 TYR H . . 4.900 2.550 2.402 2.715 . 0 0 "[ . 1 . 2]" 1
119 1 28 TYR H 1 29 GLU H . . 4.120 2.697 2.625 2.752 . 0 0 "[ . 1 . 2]" 1
120 1 26 ARG QB 1 29 GLU H . . 6.000 4.924 4.564 5.195 . 0 0 "[ . 1 . 2]" 1
121 1 29 GLU H 1 29 GLU QB . . 3.920 2.367 1.971 2.523 . 0 0 "[ . 1 . 2]" 1
122 1 29 GLU H 1 29 GLU HG2 . . 4.190 3.429 2.090 4.070 . 0 0 "[ . 1 . 2]" 1
123 1 29 GLU H 1 29 GLU HG3 . . 3.920 2.675 2.246 4.112 0.192 3 0 "[ . 1 . 2]" 1
124 1 28 TYR QD 1 29 GLU H . . 5.740 4.403 4.170 4.649 . 0 0 "[ . 1 . 2]" 1
125 1 30 SER H 1 31 ALA MB . . 5.590 4.289 4.162 4.409 . 0 0 "[ . 1 . 2]" 1
126 1 29 GLU QB 1 30 SER H . . 4.150 2.567 2.272 2.832 . 0 0 "[ . 1 . 2]" 1
127 1 29 GLU HG2 1 30 SER H . . 5.260 4.928 4.171 5.150 . 0 0 "[ . 1 . 2]" 1
128 1 29 GLU HG3 1 30 SER H . . 5.510 4.527 4.293 4.977 . 0 0 "[ . 1 . 2]" 1
129 1 29 GLU H 1 30 SER H . . 4.040 2.722 2.554 2.864 . 0 0 "[ . 1 . 2]" 1
130 1 31 ALA H 1 31 ALA MB . . 3.490 2.224 2.210 2.239 . 0 0 "[ . 1 . 2]" 1
131 1 31 ALA H 1 32 TYR HB2 . . 5.920 5.225 5.081 5.413 . 0 0 "[ . 1 . 2]" 1
132 1 31 ALA H 1 32 TYR HB3 . . 5.920 4.723 4.443 4.886 . 0 0 "[ . 1 . 2]" 1
133 1 30 SER HB2 1 31 ALA H . . 4.200 3.012 2.488 3.840 . 0 0 "[ . 1 . 2]" 1
134 1 31 ALA MB 1 32 TYR H . . 3.850 2.339 2.219 2.452 . 0 0 "[ . 1 . 2]" 1
135 1 32 TYR H 1 33 LYS QB . . 5.900 4.925 4.429 5.199 . 0 0 "[ . 1 . 2]" 1
136 1 32 TYR H 1 32 TYR HB2 . . 3.920 2.619 2.496 2.789 . 0 0 "[ . 1 . 2]" 1
137 1 32 TYR H 1 32 TYR HB3 . . 3.920 2.392 2.219 2.487 . 0 0 "[ . 1 . 2]" 1
138 1 8 PHE QD 1 32 TYR H . . 5.290 4.253 3.915 4.641 . 0 0 "[ . 1 . 2]" 1
139 1 32 TYR H 1 32 TYR QD . . 4.270 4.169 4.082 4.201 . 0 0 "[ . 1 . 2]" 1
140 1 31 ALA H 1 32 TYR H . . 4.030 2.723 2.650 2.874 . 0 0 "[ . 1 . 2]" 1
141 1 31 ALA MB 1 33 LYS H . . 5.670 4.480 4.285 4.612 . 0 0 "[ . 1 . 2]" 1
142 1 33 LYS H 1 33 LYS QD . . 5.880 3.753 2.732 4.319 . 0 0 "[ . 1 . 2]" 1
143 1 33 LYS H 1 33 LYS QB . . 3.440 2.492 2.076 2.746 . 0 0 "[ . 1 . 2]" 1
144 1 33 LYS H 1 34 HIS H . . 4.030 2.665 2.595 2.886 . 0 0 "[ . 1 . 2]" 1
145 1 30 SER H 1 33 LYS H . . 5.810 4.709 4.488 4.847 . 0 0 "[ . 1 . 2]" 1
146 1 31 ALA H 1 33 LYS H . . 6.000 4.175 3.801 4.340 . 0 0 "[ . 1 . 2]" 1
147 1 32 TYR H 1 33 LYS H . . 4.170 2.799 2.702 2.896 . 0 0 "[ . 1 . 2]" 1
148 1 33 LYS HG3 1 34 HIS H . . 5.700 3.401 2.127 4.894 . 0 0 "[ . 1 . 2]" 1
149 1 33 LYS QD 1 34 HIS H . . 5.090 4.500 4.093 5.106 0.016 8 0 "[ . 1 . 2]" 1
150 1 33 LYS HG2 1 34 HIS H . . 5.700 3.542 2.516 5.097 . 0 0 "[ . 1 . 2]" 1
151 1 33 LYS QB 1 34 HIS H . . 3.960 3.071 2.362 3.584 . 0 0 "[ . 1 . 2]" 1
152 1 34 HIS H 1 34 HIS QB . . 3.800 2.302 2.190 2.397 . 0 0 "[ . 1 . 2]" 1
153 1 31 ALA HA 1 34 HIS H . . 4.830 3.670 3.400 3.902 . 0 0 "[ . 1 . 2]" 1
154 1 34 HIS H 1 35 ILE H . . 4.020 2.523 2.441 2.622 . 0 0 "[ . 1 . 2]" 1
155 1 34 HIS H 1 36 LYS H . . 5.130 4.146 3.949 4.269 . 0 0 "[ . 1 . 2]" 1
156 1 35 ILE H 1 35 ILE MG . . 4.740 3.756 3.739 3.773 . 0 0 "[ . 1 . 2]" 1
157 1 35 ILE H 1 35 ILE HG13 . . 4.770 2.296 2.182 2.408 . 0 0 "[ . 1 . 2]" 1
158 1 35 ILE H 1 35 ILE HB . . 3.640 2.447 2.398 2.513 . 0 0 "[ . 1 . 2]" 1
159 1 34 HIS QB 1 35 ILE H . . 4.590 2.725 2.646 2.798 . 0 0 "[ . 1 . 2]" 1
160 1 31 ALA HA 1 35 ILE H . . 5.670 4.169 3.980 4.394 . 0 0 "[ . 1 . 2]" 1
161 1 35 ILE H 1 55 PHE HZ . . 5.930 3.530 3.291 3.816 . 0 0 "[ . 1 . 2]" 1
162 1 35 ILE H 1 55 PHE QE . . 5.830 3.673 3.292 4.099 . 0 0 "[ . 1 . 2]" 1
163 1 33 LYS H 1 35 ILE H . . 5.890 4.014 3.855 4.220 . 0 0 "[ . 1 . 2]" 1
164 1 35 ILE MG 1 36 LYS H . . 4.690 3.146 2.983 3.419 . 0 0 "[ . 1 . 2]" 1
165 1 36 LYS H 1 36 LYS HB2 . . 3.860 2.846 2.392 3.622 . 0 0 "[ . 1 . 2]" 1
166 1 5 ALA MB 1 36 LYS H . . 4.470 3.616 3.069 4.128 . 0 0 "[ . 1 . 2]" 1
167 1 36 LYS H 1 36 LYS HB3 . . 3.860 2.503 2.274 2.624 . 0 0 "[ . 1 . 2]" 1
168 1 35 ILE HB 1 36 LYS H . . 4.070 2.507 2.427 2.627 . 0 0 "[ . 1 . 2]" 1
169 1 33 LYS HA 1 36 LYS H . . 4.960 3.479 3.291 3.713 . 0 0 "[ . 1 . 2]" 1
170 1 36 LYS H 1 37 ASP H . . 4.090 2.615 2.532 2.741 . 0 0 "[ . 1 . 2]" 1
171 1 36 LYS HB2 1 37 ASP H . . 4.400 4.010 3.901 4.154 . 0 0 "[ . 1 . 2]" 1
172 1 36 LYS HG2 1 37 ASP H . . 5.150 3.663 2.598 4.857 . 0 0 "[ . 1 . 2]" 1
173 1 36 LYS HG3 1 37 ASP H . . 5.150 4.223 2.546 5.133 . 0 0 "[ . 1 . 2]" 1
174 1 36 LYS HB3 1 37 ASP H . . 4.400 3.213 2.618 4.091 . 0 0 "[ . 1 . 2]" 1
175 1 37 ASP H 1 37 ASP HB2 . . 4.030 2.659 2.512 2.793 . 0 0 "[ . 1 . 2]" 1
176 1 37 ASP H 1 37 ASP HB3 . . 4.030 2.414 2.279 2.515 . 0 0 "[ . 1 . 2]" 1
177 1 34 HIS QB 1 37 ASP H . . 6.000 4.704 4.485 4.846 . 0 0 "[ . 1 . 2]" 1
178 1 33 LYS HA 1 37 ASP H . . 5.650 4.149 3.957 4.462 . 0 0 "[ . 1 . 2]" 1
179 1 35 ILE HA 1 37 ASP H . . 5.990 4.124 3.916 4.423 . 0 0 "[ . 1 . 2]" 1
180 1 34 HIS HA 1 37 ASP H . . 4.760 3.309 3.012 3.572 . 0 0 "[ . 1 . 2]" 1
181 1 37 ASP H 1 39 PHE H . . 5.480 4.079 3.757 4.439 . 0 0 "[ . 1 . 2]" 1
182 1 38 HIS H 1 38 HIS HB2 . . 4.050 2.352 2.145 2.482 . 0 0 "[ . 1 . 2]" 1
183 1 38 HIS H 1 38 HIS HB3 . . 4.050 3.540 2.660 3.653 . 0 0 "[ . 1 . 2]" 1
184 1 35 ILE HA 1 38 HIS H . . 5.390 3.498 3.232 3.686 . 0 0 "[ . 1 . 2]" 1
185 1 34 HIS HA 1 38 HIS H . . 5.040 4.169 4.015 4.355 . 0 0 "[ . 1 . 2]" 1
186 1 38 HIS H 1 39 PHE QE . . 6.000 5.638 5.199 6.018 0.018 6 0 "[ . 1 . 2]" 1
187 1 38 HIS H 1 39 PHE QD . . 5.760 4.431 3.983 4.731 . 0 0 "[ . 1 . 2]" 1
188 1 37 ASP H 1 38 HIS H . . 4.020 2.629 2.430 2.794 . 0 0 "[ . 1 . 2]" 1
189 1 38 HIS H 1 39 PHE H . . 3.970 2.425 2.284 2.529 . 0 0 "[ . 1 . 2]" 1
190 1 38 HIS HB2 1 39 PHE H . . 4.540 2.736 2.474 3.868 . 0 0 "[ . 1 . 2]" 1
191 1 38 HIS HB3 1 39 PHE H . . 4.540 3.384 2.795 3.925 . 0 0 "[ . 1 . 2]" 1
192 1 35 ILE HA 1 39 PHE H . . 5.350 3.485 2.981 3.759 . 0 0 "[ . 1 . 2]" 1
193 1 36 LYS HA 1 39 PHE H . . 5.620 3.823 3.367 4.506 . 0 0 "[ . 1 . 2]" 1
194 1 39 PHE H 1 40 ARG HA . . 5.370 4.642 4.448 4.898 . 0 0 "[ . 1 . 2]" 1
195 1 4 PHE QD 1 39 PHE H . . 6.000 5.223 4.673 6.024 0.024 20 0 "[ . 1 . 2]" 1
196 1 39 PHE H 1 39 PHE QE . . 6.000 4.714 4.506 5.002 . 0 0 "[ . 1 . 2]" 1
197 1 40 ARG H 1 40 ARG HG2 . . 4.680 3.355 2.296 4.310 . 0 0 "[ . 1 . 2]" 1
198 1 39 PHE HB2 1 40 ARG H . . 5.520 4.413 4.328 4.484 . 0 0 "[ . 1 . 2]" 1
199 1 40 ARG H 1 40 ARG HD3 . . 6.000 4.341 1.965 5.240 . 0 0 "[ . 1 . 2]" 1
200 1 38 HIS H 1 40 ARG H . . 5.720 5.202 4.534 5.740 0.020 13 0 "[ . 1 . 2]" 1
201 1 40 ARG H 1 41 HIS H . . 5.760 3.312 2.344 4.422 . 0 0 "[ . 1 . 2]" 1
202 1 39 PHE H 1 40 ARG H . . 4.110 3.642 3.279 4.033 . 0 0 "[ . 1 . 2]" 1
203 1 3 THR MG 1 42 LYS H . . 5.950 3.439 2.039 4.235 . 0 0 "[ . 1 . 2]" 1
204 1 42 LYS H 1 42 LYS HG3 . . 4.660 4.480 4.337 4.701 0.041 20 0 "[ . 1 . 2]" 1
205 1 42 LYS H 1 42 LYS HB3 . . 3.670 2.719 2.404 3.226 . 0 0 "[ . 1 . 2]" 1
206 1 42 LYS H 1 42 LYS HB2 . . 3.670 2.468 2.100 3.282 . 0 0 "[ . 1 . 2]" 1
207 1 39 PHE QD 1 42 LYS H . . 5.590 4.779 4.271 5.244 . 0 0 "[ . 1 . 2]" 1
208 1 41 HIS H 1 42 LYS H . . 4.170 2.513 2.045 3.594 . 0 0 "[ . 1 . 2]" 1
209 1 42 LYS H 1 43 LEU H . . 4.970 4.446 3.909 4.566 . 0 0 "[ . 1 . 2]" 1
210 1 43 LEU H 1 43 LEU MD1 . . 4.470 3.589 3.298 3.705 . 0 0 "[ . 1 . 2]" 1
211 1 3 THR MG 1 43 LEU H . . 5.680 3.896 3.510 4.388 . 0 0 "[ . 1 . 2]" 1
212 1 42 LYS HG3 1 43 LEU H . . 4.430 3.036 2.389 3.487 . 0 0 "[ . 1 . 2]" 1
213 1 43 LEU H 1 43 LEU HG . . 3.600 2.245 2.016 2.451 . 0 0 "[ . 1 . 2]" 1
214 1 42 LYS HB3 1 43 LEU H . . 4.870 4.036 3.619 4.402 . 0 0 "[ . 1 . 2]" 1
215 1 42 LYS HG2 1 43 LEU H . . 4.860 4.301 3.525 4.876 0.016 1 0 "[ . 1 . 2]" 1
216 1 42 LYS HB2 1 43 LEU H . . 4.870 4.382 4.272 4.486 . 0 0 "[ . 1 . 2]" 1
217 1 43 LEU H 1 46 ASP HB2 . . 5.460 3.384 2.369 5.470 0.010 9 0 "[ . 1 . 2]" 1
218 1 42 LYS HA 1 43 LEU H . . 3.370 2.157 2.108 2.278 . 0 0 "[ . 1 . 2]" 1
219 1 3 THR HA 1 43 LEU H . . 5.780 4.201 3.924 4.475 . 0 0 "[ . 1 . 2]" 1
220 1 43 LEU H 1 44 LEU H . . 6.000 4.626 4.592 4.663 . 0 0 "[ . 1 . 2]" 1
221 1 97 GLU H 1 98 LEU H . . 6.000 4.260 2.352 4.541 . 0 0 "[ . 1 . 2]" 1
222 1 46 ASP H 1 47 ILE MD . . 5.530 3.900 2.897 4.890 . 0 0 "[ . 1 . 2]" 1
223 1 43 LEU MD2 1 46 ASP H . . 6.000 5.256 4.892 5.688 . 0 0 "[ . 1 . 2]" 1
224 1 45 LYS HG3 1 46 ASP H . . 5.080 3.235 2.846 3.693 . 0 0 "[ . 1 . 2]" 1
225 1 45 LYS HG2 1 46 ASP H . . 5.080 4.145 3.177 5.110 0.030 1 0 "[ . 1 . 2]" 1
226 1 43 LEU HB3 1 46 ASP H . . 4.960 3.669 3.130 4.171 . 0 0 "[ . 1 . 2]" 1
227 1 43 LEU HB2 1 46 ASP H . . 4.960 2.942 2.562 3.481 . 0 0 "[ . 1 . 2]" 1
228 1 46 ASP H 1 47 ILE H . . 3.890 2.284 2.035 3.336 . 0 0 "[ . 1 . 2]" 1
229 1 44 LEU H 1 46 ASP H . . 4.860 3.975 3.749 4.335 . 0 0 "[ . 1 . 2]" 1
230 1 43 LEU H 1 46 ASP H . . 5.770 4.254 3.883 4.668 . 0 0 "[ . 1 . 2]" 1
231 1 47 ILE H 1 47 ILE MD . . 4.310 3.102 2.230 4.429 0.119 2 0 "[ . 1 . 2]" 1
232 1 47 ILE H 1 47 ILE HG13 . . 4.680 3.577 2.187 3.968 . 0 0 "[ . 1 . 2]" 1
233 1 47 ILE H 1 47 ILE HB . . 4.170 2.574 2.302 2.805 . 0 0 "[ . 1 . 2]" 1
234 1 47 ILE H 1 47 ILE HG12 . . 4.680 2.578 1.885 4.146 . 0 0 "[ . 1 . 2]" 1
235 1 46 ASP HB2 1 47 ILE H . . 5.840 4.250 3.885 4.674 . 0 0 "[ . 1 . 2]" 1
236 1 44 LEU HA 1 47 ILE H . . 5.540 4.202 3.211 5.604 0.064 2 0 "[ . 1 . 2]" 1
237 1 47 ILE H 1 48 LYS H . . 5.520 4.341 4.097 4.536 . 0 0 "[ . 1 . 2]" 1
238 1 48 LYS H 1 48 LYS HG2 . . 4.920 3.613 2.009 4.579 . 0 0 "[ . 1 . 2]" 1
239 1 48 LYS H 1 48 LYS HG3 . . 4.920 3.173 2.028 4.532 . 0 0 "[ . 1 . 2]" 1
240 1 48 LYS H 1 48 LYS QD . . 5.290 3.622 2.040 4.540 . 0 0 "[ . 1 . 2]" 1
241 1 47 ILE HA 1 48 LYS H . . 3.570 2.158 2.110 2.214 . 0 0 "[ . 1 . 2]" 1
242 1 39 PHE HZ 1 48 LYS H . . 6.000 5.515 4.489 6.035 0.035 4 0 "[ . 1 . 2]" 1
243 1 49 ARG QB 1 50 THR H . . 6.000 3.249 2.534 3.654 . 0 0 "[ . 1 . 2]" 1
244 1 50 THR H 1 51 GLU H . . 5.740 2.570 2.496 2.631 . 0 0 "[ . 1 . 2]" 1
245 1 47 ILE MG 1 51 GLU H . . 5.780 4.717 4.077 5.216 . 0 0 "[ . 1 . 2]" 1
246 1 48 LYS HB2 1 51 GLU H . . 5.000 2.917 1.934 4.471 . 0 0 "[ . 1 . 2]" 1
247 1 51 GLU H 1 54 LYS QB . . 6.000 5.137 4.442 5.606 . 0 0 "[ . 1 . 2]" 1
248 1 48 LYS HB3 1 51 GLU H . . 5.000 3.185 2.253 4.545 . 0 0 "[ . 1 . 2]" 1
249 1 51 GLU H 1 51 GLU HG3 . . 4.690 3.577 2.109 4.502 . 0 0 "[ . 1 . 2]" 1
250 1 51 GLU H 1 51 GLU HG2 . . 4.690 3.216 1.792 4.625 . 0 0 "[ . 1 . 2]" 1
251 1 48 LYS H 1 51 GLU H . . 5.570 4.091 2.882 4.612 . 0 0 "[ . 1 . 2]" 1
252 1 49 ARG H 1 51 GLU H . . 6.000 4.144 3.890 4.466 . 0 0 "[ . 1 . 2]" 1
253 1 51 GLU H 1 53 GLN H . . 6.000 4.007 3.843 4.193 . 0 0 "[ . 1 . 2]" 1
254 1 47 ILE MG 1 52 TYR H . . 4.910 3.468 2.947 3.856 . 0 0 "[ . 1 . 2]" 1
255 1 52 TYR H 1 52 TYR HB2 . . 4.070 2.506 2.341 2.622 . 0 0 "[ . 1 . 2]" 1
256 1 52 TYR H 1 52 TYR HB3 . . 4.070 2.522 2.414 2.633 . 0 0 "[ . 1 . 2]" 1
257 1 39 PHE HZ 1 52 TYR H . . 5.400 4.083 3.373 4.871 . 0 0 "[ . 1 . 2]" 1
258 1 51 GLU H 1 52 TYR H . . 4.110 2.529 2.382 2.697 . 0 0 "[ . 1 . 2]" 1
259 1 53 GLN H 1 54 LYS QB . . 5.450 4.621 4.236 4.866 . 0 0 "[ . 1 . 2]" 1
260 1 53 GLN H 1 53 GLN HB2 . . 3.990 2.448 2.144 2.660 . 0 0 "[ . 1 . 2]" 1
261 1 53 GLN H 1 53 GLN HB3 . . 3.990 2.608 2.347 2.969 . 0 0 "[ . 1 . 2]" 1
262 1 52 TYR HB2 1 53 GLN H . . 4.930 3.872 3.687 3.962 . 0 0 "[ . 1 . 2]" 1
263 1 52 TYR HB3 1 53 GLN H . . 4.930 2.616 2.421 2.729 . 0 0 "[ . 1 . 2]" 1
264 1 50 THR HB 1 53 GLN H . . 6.000 5.313 5.006 5.590 . 0 0 "[ . 1 . 2]" 1
265 1 51 GLU HA 1 53 GLN H . . 6.000 4.344 4.075 4.506 . 0 0 "[ . 1 . 2]" 1
266 1 53 GLN H 1 55 PHE H . . 5.580 4.117 3.909 4.391 . 0 0 "[ . 1 . 2]" 1
267 1 52 TYR H 1 53 GLN H . . 4.110 2.639 2.536 2.717 . 0 0 "[ . 1 . 2]" 1
268 1 53 GLN HE21 1 97 GLU QB . . 5.680 4.253 1.798 5.725 0.045 14 0 "[ . 1 . 2]" 1
269 1 54 LYS H 1 54 LYS HG2 . . 4.810 3.644 2.130 4.592 . 0 0 "[ . 1 . 2]" 1
270 1 54 LYS H 1 54 LYS QD . . 5.040 3.250 2.055 4.390 . 0 0 "[ . 1 . 2]" 1
271 1 54 LYS H 1 54 LYS QB . . 3.430 2.352 2.039 2.591 . 0 0 "[ . 1 . 2]" 1
272 1 53 GLN HB2 1 54 LYS H . . 4.650 3.780 3.388 3.955 . 0 0 "[ . 1 . 2]" 1
273 1 53 GLN HB3 1 54 LYS H . . 4.650 2.541 2.284 2.726 . 0 0 "[ . 1 . 2]" 1
274 1 54 LYS H 1 56 LEU H . . 5.210 4.232 4.097 4.534 . 0 0 "[ . 1 . 2]" 1
275 1 52 TYR H 1 54 LYS H . . 5.530 4.150 3.951 4.359 . 0 0 "[ . 1 . 2]" 1
276 1 53 GLN H 1 54 LYS H . . 4.210 2.734 2.653 2.921 . 0 0 "[ . 1 . 2]" 1
277 1 54 LYS QB 1 55 PHE H . . 4.060 2.602 2.213 3.546 . 0 0 "[ . 1 . 2]" 1
278 1 55 PHE H 1 55 PHE HB2 . . 4.090 2.587 2.469 2.663 . 0 0 "[ . 1 . 2]" 1
279 1 55 PHE H 1 55 PHE HB3 . . 3.840 2.433 2.355 2.510 . 0 0 "[ . 1 . 2]" 1
280 1 51 GLU HA 1 55 PHE H . . 5.490 4.256 3.835 4.753 . 0 0 "[ . 1 . 2]" 1
281 1 39 PHE HZ 1 55 PHE H . . 5.110 4.312 3.376 4.977 . 0 0 "[ . 1 . 2]" 1
282 1 54 LYS H 1 55 PHE H . . 3.760 2.690 2.544 2.877 . 0 0 "[ . 1 . 2]" 1
283 1 52 TYR H 1 55 PHE H . . 5.830 4.703 4.468 5.034 . 0 0 "[ . 1 . 2]" 1
284 1 56 LEU H 1 56 LEU MD2 . . 4.660 3.339 3.226 3.492 . 0 0 "[ . 1 . 2]" 1
285 1 56 LEU H 1 56 LEU MD1 . . 4.770 3.657 3.548 3.755 . 0 0 "[ . 1 . 2]" 1
286 1 56 LEU H 1 56 LEU HG . . 4.100 2.350 2.238 2.557 . 0 0 "[ . 1 . 2]" 1
287 1 55 PHE HB2 1 56 LEU H . . 5.040 3.881 3.810 3.953 . 0 0 "[ . 1 . 2]" 1
288 1 55 PHE HB3 1 56 LEU H . . 4.110 2.526 2.403 2.678 . 0 0 "[ . 1 . 2]" 1
289 1 53 GLN HA 1 56 LEU H . . 5.010 3.434 3.122 3.815 . 0 0 "[ . 1 . 2]" 1
290 1 55 PHE H 1 56 LEU H . . 4.100 2.751 2.639 2.852 . 0 0 "[ . 1 . 2]" 1
291 1 56 LEU H 1 59 TYR H . . 5.820 4.726 4.624 4.871 . 0 0 "[ . 1 . 2]" 1
292 1 56 LEU MD2 1 57 ASN H . . 5.820 4.654 4.595 4.721 . 0 0 "[ . 1 . 2]" 1
293 1 56 LEU HG 1 57 ASN H . . 5.920 4.391 4.280 4.579 . 0 0 "[ . 1 . 2]" 1
294 1 56 LEU HB2 1 57 ASN H . . 4.840 2.652 2.535 2.860 . 0 0 "[ . 1 . 2]" 1
295 1 56 LEU HB3 1 57 ASN H . . 4.840 3.635 3.535 3.761 . 0 0 "[ . 1 . 2]" 1
296 1 55 PHE HA 1 57 ASN H . . 6.000 4.483 4.218 4.667 . 0 0 "[ . 1 . 2]" 1
297 1 54 LYS HA 1 57 ASN H . . 4.620 3.383 3.092 3.830 . 0 0 "[ . 1 . 2]" 1
298 1 56 LEU H 1 57 ASN H . . 4.080 2.636 2.539 2.727 . 0 0 "[ . 1 . 2]" 1
299 1 57 ASN H 1 60 GLY H . . 5.590 4.661 4.565 4.915 . 0 0 "[ . 1 . 2]" 1
300 1 53 GLN HG3 1 57 ASN HD21 . . 5.840 4.163 2.516 5.958 0.118 17 0 "[ . 1 . 2]" 1
301 1 53 GLN HG2 1 57 ASN HD21 . . 5.840 4.866 3.210 5.907 0.067 3 0 "[ . 1 . 2]" 1
302 1 53 GLN HG3 1 57 ASN HD22 . . 5.840 3.698 2.094 4.882 . 0 0 "[ . 1 . 2]" 1
303 1 53 GLN HG2 1 57 ASN HD22 . . 5.840 4.303 2.692 5.918 0.078 10 0 "[ . 1 . 2]" 1
304 1 54 LYS HA 1 57 ASN HD22 . . 5.240 4.181 1.975 5.303 0.063 10 0 "[ . 1 . 2]" 1
305 1 58 GLU H 1 58 GLU QB . . 3.380 2.341 2.093 2.675 . 0 0 "[ . 1 . 2]" 1
306 1 58 GLU H 1 58 GLU HG2 . . 4.710 3.619 1.915 4.594 . 0 0 "[ . 1 . 2]" 1
307 1 58 GLU H 1 58 GLU HG3 . . 4.710 3.900 2.277 4.532 . 0 0 "[ . 1 . 2]" 1
308 1 57 ASN HB2 1 58 GLU H . . 4.640 2.845 2.330 4.074 . 0 0 "[ . 1 . 2]" 1
309 1 57 ASN HB3 1 58 GLU H . . 4.640 3.241 2.202 4.162 . 0 0 "[ . 1 . 2]" 1
310 1 57 ASN H 1 58 GLU H . . 4.020 2.762 2.549 2.910 . 0 0 "[ . 1 . 2]" 1
311 1 58 GLU H 1 59 TYR H . . 3.990 2.571 2.418 2.710 . 0 0 "[ . 1 . 2]" 1
312 1 58 GLU H 1 60 GLY H . . 5.210 4.076 3.897 4.263 . 0 0 "[ . 1 . 2]" 1
313 1 59 TYR H 1 68 ILE MD . . 5.720 4.285 4.079 4.637 . 0 0 "[ . 1 . 2]" 1
314 1 58 GLU QB 1 59 TYR H . . 3.860 2.640 2.471 2.945 . 0 0 "[ . 1 . 2]" 1
315 1 59 TYR H 1 59 TYR HB2 . . 3.990 2.423 2.297 2.561 . 0 0 "[ . 1 . 2]" 1
316 1 59 TYR H 1 59 TYR HB3 . . 3.990 2.647 2.552 2.785 . 0 0 "[ . 1 . 2]" 1
317 1 56 LEU HA 1 59 TYR H . . 4.860 3.423 3.205 3.675 . 0 0 "[ . 1 . 2]" 1
318 1 59 TYR H 1 60 GLY H . . 4.270 2.557 2.432 2.725 . 0 0 "[ . 1 . 2]" 1
319 1 60 GLY H 1 68 ILE MD . . 4.810 2.747 2.534 3.066 . 0 0 "[ . 1 . 2]" 1
320 1 58 GLU QB 1 60 GLY H . . 5.990 4.718 4.566 4.866 . 0 0 "[ . 1 . 2]" 1
321 1 60 GLY H 1 61 LEU HG . . 6.000 4.182 3.981 4.365 . 0 0 "[ . 1 . 2]" 1
322 1 59 TYR HB2 1 60 GLY H . . 4.990 3.815 3.745 3.878 . 0 0 "[ . 1 . 2]" 1
323 1 59 TYR HB3 1 60 GLY H . . 4.990 2.690 2.453 2.796 . 0 0 "[ . 1 . 2]" 1
324 1 61 LEU H 1 102 VAL MG2 . . 4.850 4.314 4.023 4.866 0.016 20 0 "[ . 1 . 2]" 1
325 1 61 LEU H 1 61 LEU MD1 . . 4.260 3.753 3.656 3.811 . 0 0 "[ . 1 . 2]" 1
326 1 61 LEU H 1 62 THR MG . . 4.900 4.081 3.397 4.444 . 0 0 "[ . 1 . 2]" 1
327 1 61 LEU H 1 61 LEU HB2 . . 4.160 2.428 2.370 2.494 . 0 0 "[ . 1 . 2]" 1
328 1 61 LEU H 1 61 LEU HB3 . . 4.160 3.619 3.593 3.637 . 0 0 "[ . 1 . 2]" 1
329 1 61 LEU H 1 61 LEU HG . . 3.510 2.630 2.339 2.785 . 0 0 "[ . 1 . 2]" 1
330 1 59 TYR HA 1 61 LEU H . . 5.300 3.826 3.584 4.377 . 0 0 "[ . 1 . 2]" 1
331 1 58 GLU HA 1 61 LEU H . . 4.560 3.612 3.442 3.854 . 0 0 "[ . 1 . 2]" 1
332 1 61 LEU H 1 62 THR H . . 3.910 2.314 2.208 2.607 . 0 0 "[ . 1 . 2]" 1
333 1 59 TYR H 1 61 LEU H . . 5.510 3.938 3.808 4.075 . 0 0 "[ . 1 . 2]" 1
334 1 60 GLY H 1 61 LEU H . . 4.360 2.590 2.522 2.667 . 0 0 "[ . 1 . 2]" 1
335 1 62 THR H 1 62 THR MG . . 4.200 2.974 2.245 3.261 . 0 0 "[ . 1 . 2]" 1
336 1 61 LEU HB2 1 62 THR H . . 4.930 3.212 2.778 3.417 . 0 0 "[ . 1 . 2]" 1
337 1 61 LEU HB3 1 62 THR H . . 4.930 4.038 3.757 4.205 . 0 0 "[ . 1 . 2]" 1
338 1 61 LEU HG 1 62 THR H . . 5.130 4.603 4.403 4.710 . 0 0 "[ . 1 . 2]" 1
339 1 59 TYR HA 1 62 THR H . . 5.450 3.694 3.338 4.039 . 0 0 "[ . 1 . 2]" 1
340 1 63 HIS H 1 102 VAL MG2 . . 4.870 2.972 2.102 3.665 . 0 0 "[ . 1 . 2]" 1
341 1 62 THR MG 1 63 HIS H . . 4.890 4.217 3.430 4.389 . 0 0 "[ . 1 . 2]" 1
342 1 63 HIS H 1 67 THR MG . . 6.000 5.746 5.411 6.094 0.094 14 0 "[ . 1 . 2]" 1
343 1 63 HIS H 1 100 ALA MB . . 6.000 4.878 4.169 6.007 0.007 13 0 "[ . 1 . 2]" 1
344 1 62 THR HB 1 63 HIS H . . 5.580 4.051 3.573 4.577 . 0 0 "[ . 1 . 2]" 1
345 1 61 LEU H 1 63 HIS H . . 4.860 3.833 3.543 4.150 . 0 0 "[ . 1 . 2]" 1
346 1 64 SER H 1 102 VAL MG1 . . 6.000 5.044 3.486 6.008 0.008 17 0 "[ . 1 . 2]" 1
347 1 64 SER H 1 102 VAL MG2 . . 6.000 4.619 3.351 5.504 . 0 0 "[ . 1 . 2]" 1
348 1 64 SER H 1 67 THR MG . . 5.350 3.757 3.338 4.582 . 0 0 "[ . 1 . 2]" 1
349 1 63 HIS HB3 1 64 SER H . . 4.920 2.397 1.785 2.901 . 0 0 "[ . 1 . 2]" 1
350 1 63 HIS HB2 1 64 SER H . . 4.920 3.662 3.105 3.952 . 0 0 "[ . 1 . 2]" 1
351 1 64 SER H 1 67 THR HB . . 4.820 3.118 2.815 3.715 . 0 0 "[ . 1 . 2]" 1
352 1 65 TYR H 1 68 ILE MG . . 5.940 4.138 3.926 4.372 . 0 0 "[ . 1 . 2]" 1
353 1 66 GLU H 1 66 GLU HB2 . . 4.030 2.364 2.147 2.541 . 0 0 "[ . 1 . 2]" 1
354 1 66 GLU H 1 66 GLU HB3 . . 4.030 3.059 2.642 3.609 . 0 0 "[ . 1 . 2]" 1
355 1 66 GLU H 1 66 GLU HG2 . . 4.910 3.983 2.525 4.555 . 0 0 "[ . 1 . 2]" 1
356 1 66 GLU H 1 66 GLU HG3 . . 4.680 3.844 2.525 4.429 . 0 0 "[ . 1 . 2]" 1
357 1 65 TYR HB2 1 66 GLU H . . 4.700 3.964 3.884 4.066 . 0 0 "[ . 1 . 2]" 1
358 1 65 TYR HB3 1 66 GLU H . . 4.700 2.657 2.534 2.896 . 0 0 "[ . 1 . 2]" 1
359 1 67 THR H 1 68 ILE MG . . 5.610 3.864 3.761 4.050 . 0 0 "[ . 1 . 2]" 1
360 1 67 THR H 1 67 THR MG . . 4.610 3.677 2.941 3.763 . 0 0 "[ . 1 . 2]" 1
361 1 66 GLU HB2 1 67 THR H . . 4.690 3.448 2.690 3.971 . 0 0 "[ . 1 . 2]" 1
362 1 66 GLU HB3 1 67 THR H . . 4.690 3.070 2.510 3.709 . 0 0 "[ . 1 . 2]" 1
363 1 66 GLU HG2 1 67 THR H . . 5.930 4.476 3.936 5.082 . 0 0 "[ . 1 . 2]" 1
364 1 67 THR H 1 68 ILE H . . 3.970 2.689 2.606 2.788 . 0 0 "[ . 1 . 2]" 1
365 1 66 GLU H 1 67 THR H . . 4.220 2.617 2.509 2.758 . 0 0 "[ . 1 . 2]" 1
366 1 68 ILE H 1 68 ILE MG . . 3.900 2.047 1.930 2.196 . 0 0 "[ . 1 . 2]" 1
367 1 67 THR MG 1 68 ILE H . . 4.660 3.709 3.518 4.144 . 0 0 "[ . 1 . 2]" 1
368 1 68 ILE H 1 68 ILE HG13 . . 4.710 4.504 4.445 4.554 . 0 0 "[ . 1 . 2]" 1
369 1 68 ILE H 1 68 ILE HB . . 3.890 2.647 2.564 2.729 . 0 0 "[ . 1 . 2]" 1
370 1 65 TYR HA 1 68 ILE H . . 5.060 3.558 3.354 3.752 . 0 0 "[ . 1 . 2]" 1
371 1 69 ARG H 1 69 ARG HB3 . . 3.800 2.692 2.311 3.619 . 0 0 "[ . 1 . 2]" 1
372 1 69 ARG H 1 69 ARG HG2 . . 4.780 4.349 3.350 4.612 . 0 0 "[ . 1 . 2]" 1
373 1 69 ARG H 1 69 ARG HB2 . . 3.800 2.474 2.118 2.728 . 0 0 "[ . 1 . 2]" 1
374 1 68 ILE MG 1 70 LYS H . . 5.770 4.498 4.370 4.595 . 0 0 "[ . 1 . 2]" 1
375 1 70 LYS H 1 70 LYS HG2 . . 4.800 3.954 2.105 4.582 . 0 0 "[ . 1 . 2]" 1
376 1 69 ARG HB3 1 70 LYS H . . 4.270 2.537 2.330 3.325 . 0 0 "[ . 1 . 2]" 1
377 1 70 LYS H 1 70 LYS HB2 . . 4.090 2.404 2.077 3.637 . 0 0 "[ . 1 . 2]" 1
378 1 69 ARG HB2 1 70 LYS H . . 4.270 3.615 2.411 3.931 . 0 0 "[ . 1 . 2]" 1
379 1 70 LYS H 1 70 LYS HB3 . . 4.090 3.225 2.628 3.527 . 0 0 "[ . 1 . 2]" 1
380 1 66 GLU HG2 1 70 LYS H . . 6.000 4.849 3.679 6.098 0.098 14 0 "[ . 1 . 2]" 1
381 1 66 GLU HA 1 70 LYS H . . 5.010 3.847 3.548 4.322 . 0 0 "[ . 1 . 2]" 1
382 1 67 THR HA 1 70 LYS H . . 5.240 3.651 3.148 3.988 . 0 0 "[ . 1 . 2]" 1
383 1 69 ARG H 1 70 LYS H . . 4.090 2.742 2.613 2.853 . 0 0 "[ . 1 . 2]" 1
384 1 71 LEU H 1 71 LEU MD2 . . 5.340 4.201 4.134 4.243 . 0 0 "[ . 1 . 2]" 1
385 1 71 LEU H 1 71 LEU MD1 . . 5.100 4.168 4.125 4.229 . 0 0 "[ . 1 . 2]" 1
386 1 71 LEU H 1 71 LEU HB2 . . 3.830 2.602 2.529 2.687 . 0 0 "[ . 1 . 2]" 1
387 1 71 LEU H 1 71 LEU HB3 . . 3.830 2.389 2.282 2.451 . 0 0 "[ . 1 . 2]" 1
388 1 67 THR HA 1 71 LEU H . . 5.490 4.140 3.973 4.433 . 0 0 "[ . 1 . 2]" 1
389 1 71 LEU H 1 72 ASN H . . 4.350 2.884 2.789 2.963 . 0 0 "[ . 1 . 2]" 1
390 1 71 LEU MD2 1 72 ASN H . . 5.240 3.714 3.523 3.952 . 0 0 "[ . 1 . 2]" 1
391 1 56 LEU MD2 1 72 ASN H . . 5.830 3.871 3.526 4.257 . 0 0 "[ . 1 . 2]" 1
392 1 72 ASN H 1 98 LEU MD2 . . 5.330 3.630 3.369 4.070 . 0 0 "[ . 1 . 2]" 1
393 1 71 LEU MD1 1 72 ASN H . . 5.460 4.241 4.158 4.339 . 0 0 "[ . 1 . 2]" 1
394 1 68 ILE HG12 1 72 ASN H . . 5.820 3.974 3.842 4.215 . 0 0 "[ . 1 . 2]" 1
395 1 71 LEU HG 1 72 ASN H . . 5.170 3.178 2.979 3.349 . 0 0 "[ . 1 . 2]" 1
396 1 72 ASN H 1 72 ASN HB2 . . 4.100 2.520 2.375 2.663 . 0 0 "[ . 1 . 2]" 1
397 1 72 ASN H 1 72 ASN HB3 . . 4.100 2.507 2.315 2.638 . 0 0 "[ . 1 . 2]" 1
398 1 68 ILE HA 1 72 ASN H . . 4.810 3.860 3.683 4.090 . 0 0 "[ . 1 . 2]" 1
399 1 69 ARG HA 1 72 ASN H . . 5.130 3.609 3.345 3.861 . 0 0 "[ . 1 . 2]" 1
400 1 55 PHE QE 1 72 ASN H . . 6.000 6.022 5.974 6.059 0.059 2 0 "[ . 1 . 2]" 1
401 1 72 ASN H 1 72 ASN HD21 . . 6.000 4.638 4.401 4.739 . 0 0 "[ . 1 . 2]" 1
402 1 72 ASN H 1 74 TYR H . . 6.000 4.315 4.158 4.417 . 0 0 "[ . 1 . 2]" 1
403 1 73 SER H 1 98 LEU MD2 . . 6.000 4.831 4.388 5.391 . 0 0 "[ . 1 . 2]" 1
404 1 70 LYS HA 1 73 SER H . . 4.480 3.336 2.948 3.692 . 0 0 "[ . 1 . 2]" 1
405 1 73 SER H 1 73 SER QB . . 3.560 2.371 2.234 2.726 . 0 0 "[ . 1 . 2]" 1
406 1 73 SER H 1 74 TYR H . . 3.870 2.733 2.643 2.833 . 0 0 "[ . 1 . 2]" 1
407 1 72 ASN H 1 73 SER H . . 4.000 2.771 2.658 2.967 . 0 0 "[ . 1 . 2]" 1
408 1 74 TYR H 1 75 ILE HB . . 5.670 4.847 4.719 5.071 . 0 0 "[ . 1 . 2]" 1
409 1 73 SER QB 1 74 TYR H . . 4.590 2.641 2.466 3.499 . 0 0 "[ . 1 . 2]" 1
410 1 74 TYR H 1 75 ILE H . . 4.330 2.678 2.603 2.889 . 0 0 "[ . 1 . 2]" 1
411 1 75 ILE H 1 75 ILE HG13 . . 4.730 2.198 1.920 3.493 . 0 0 "[ . 1 . 2]" 1
412 1 75 ILE H 1 75 ILE HB . . 3.870 2.499 2.437 2.657 . 0 0 "[ . 1 . 2]" 1
413 1 75 ILE H 1 75 ILE HG12 . . 4.730 3.311 1.951 3.464 . 0 0 "[ . 1 . 2]" 1
414 1 70 LYS HA 1 74 TYR H . . 4.910 4.208 3.848 4.462 . 0 0 "[ . 1 . 2]" 1
415 1 71 LEU HA 1 74 TYR H . . 5.090 3.569 3.274 3.763 . 0 0 "[ . 1 . 2]" 1
416 1 74 TYR QB 1 75 ILE H . . 4.350 2.364 2.251 2.476 . 0 0 "[ . 1 . 2]" 1
417 1 8 PHE QD 1 75 ILE H . . 6.000 5.249 4.837 5.575 . 0 0 "[ . 1 . 2]" 1
418 1 75 ILE H 1 79 PHE QD . . 6.000 5.917 5.658 6.060 0.060 3 0 "[ . 1 . 2]" 1
419 1 8 PHE QE 1 75 ILE H . . 5.690 3.480 3.140 3.804 . 0 0 "[ . 1 . 2]" 1
420 1 75 ILE H 1 76 ARG H . . 4.620 2.690 2.608 2.774 . 0 0 "[ . 1 . 2]" 1
421 1 76 ARG H 1 93 THR MG . . 5.460 3.622 2.930 4.251 . 0 0 "[ . 1 . 2]" 1
422 1 75 ILE MG 1 76 ARG H . . 5.480 3.391 3.231 3.588 . 0 0 "[ . 1 . 2]" 1
423 1 75 ILE HB 1 76 ARG H . . 4.830 2.616 2.369 2.791 . 0 0 "[ . 1 . 2]" 1
424 1 73 SER HA 1 76 ARG H . . 4.840 3.655 3.426 3.917 . 0 0 "[ . 1 . 2]" 1
425 1 77 ASN H 1 77 ASN HB2 . . 4.190 2.390 2.228 2.561 . 0 0 "[ . 1 . 2]" 1
426 1 77 ASN H 1 77 ASN HB3 . . 4.190 2.967 2.542 3.587 . 0 0 "[ . 1 . 2]" 1
427 1 73 SER HA 1 77 ASN H . . 5.640 4.040 3.809 4.456 . 0 0 "[ . 1 . 2]" 1
428 1 76 ARG H 1 77 ASN H . . 4.360 2.715 2.623 2.818 . 0 0 "[ . 1 . 2]" 1
429 1 26 ARG H 1 26 ARG QD . . 5.710 3.835 2.815 4.696 . 0 0 "[ . 1 . 2]" 1
430 1 78 ALA H 1 78 ALA MB . . 3.570 2.237 2.229 2.245 . 0 0 "[ . 1 . 2]" 1
431 1 77 ASN HB2 1 78 ALA H . . 4.540 3.496 2.718 3.911 . 0 0 "[ . 1 . 2]" 1
432 1 77 ASN HB3 1 78 ALA H . . 4.540 2.983 2.596 3.644 . 0 0 "[ . 1 . 2]" 1
433 1 75 ILE HA 1 78 ALA H . . 4.740 3.380 3.215 3.614 . 0 0 "[ . 1 . 2]" 1
434 1 76 ARG HA 1 78 ALA H . . 5.840 4.374 4.212 4.529 . 0 0 "[ . 1 . 2]" 1
435 1 78 ALA H 1 80 ASP H . . 4.950 3.943 3.783 4.140 . 0 0 "[ . 1 . 2]" 1
436 1 78 ALA H 1 79 PHE H . . 4.400 2.737 2.672 2.797 . 0 0 "[ . 1 . 2]" 1
437 1 80 ASP H 1 81 ASP H . . 4.300 2.672 2.597 2.795 . 0 0 "[ . 1 . 2]" 1
438 1 79 PHE H 1 80 ASP H . . 4.260 2.583 2.489 2.703 . 0 0 "[ . 1 . 2]" 1
439 1 79 PHE HA 1 82 ALA H . . 5.930 3.214 2.827 3.583 . 0 0 "[ . 1 . 2]" 1
440 1 82 ALA MB 1 83 ILE H . . 5.450 2.471 2.317 2.622 . 0 0 "[ . 1 . 2]" 1
441 1 83 ILE H 1 83 ILE HB . . 4.190 2.478 2.359 2.615 . 0 0 "[ . 1 . 2]" 1
442 1 83 ILE H 1 84 HIS H . . 5.070 2.580 2.448 2.732 . 0 0 "[ . 1 . 2]" 1
443 1 85 GLU H 1 85 GLU HG3 . . 4.750 3.820 2.559 4.656 . 0 0 "[ . 1 . 2]" 1
444 1 86 GLY H 1 87 TYR QB . . 6.000 3.954 3.569 4.164 . 0 0 "[ . 1 . 2]" 1
445 1 84 HIS HA 1 86 GLY H . . 5.220 4.160 3.765 4.781 . 0 0 "[ . 1 . 2]" 1
446 1 86 GLY H 1 87 TYR HA . . 5.870 4.890 4.537 5.132 . 0 0 "[ . 1 . 2]" 1
447 1 86 GLY H 1 87 TYR QD . . 6.000 5.868 5.384 6.081 0.081 13 0 "[ . 1 . 2]" 1
448 1 85 GLU H 1 86 GLY H . . 3.920 2.269 1.960 2.443 . 0 0 "[ . 1 . 2]" 1
449 1 86 GLY H 1 87 TYR H . . 4.000 2.252 1.842 2.508 . 0 0 "[ . 1 . 2]" 1
450 1 87 TYR H 1 87 TYR QD . . 4.950 4.146 3.990 4.241 . 0 0 "[ . 1 . 2]" 1
451 1 93 THR H 1 93 THR MG . . 4.370 2.740 2.226 3.749 . 0 0 "[ . 1 . 2]" 1
452 1 93 THR H 1 93 THR HG1 . . 5.100 2.955 2.151 3.522 . 0 0 "[ . 1 . 2]" 1
453 1 49 ARG HA 1 93 THR H . . 5.630 5.295 3.360 5.681 0.051 17 0 "[ . 1 . 2]" 1
454 1 93 THR H 1 94 TYR H . . 4.670 2.898 2.373 4.043 . 0 0 "[ . 1 . 2]" 1
455 1 93 THR HG1 1 94 TYR H . . 6.000 4.392 3.451 5.620 . 0 0 "[ . 1 . 2]" 1
456 1 93 THR HB 1 96 ALA H . . 5.750 5.175 4.383 5.772 0.022 12 0 "[ . 1 . 2]" 1
457 1 95 LYS H 1 96 ALA H . . 5.310 2.977 2.132 4.108 . 0 0 "[ . 1 . 2]" 1
458 1 96 ALA H 1 97 GLU H . . 5.570 4.065 2.794 4.588 . 0 0 "[ . 1 . 2]" 1
459 1 56 LEU MD1 1 97 GLU H . . 5.820 3.001 2.043 3.862 . 0 0 "[ . 1 . 2]" 1
460 1 98 LEU H 1 98 LEU MD2 . . 5.270 3.412 2.870 3.826 . 0 0 "[ . 1 . 2]" 1
461 1 98 LEU H 1 98 LEU HG . . 4.100 2.469 2.154 2.991 . 0 0 "[ . 1 . 2]" 1
462 1 97 GLU QB 1 98 LEU H . . 4.800 3.097 2.135 3.840 . 0 0 "[ . 1 . 2]" 1
463 1 98 LEU H 1 99 HIS H . . 5.560 3.829 2.716 4.561 . 0 0 "[ . 1 . 2]" 1
464 1 100 ALA H 1 102 VAL MG2 . . 6.000 5.923 5.339 6.134 0.134 12 0 "[ . 1 . 2]" 1
465 1 99 HIS QB 1 100 ALA H . . 4.790 3.863 3.237 4.039 . 0 0 "[ . 1 . 2]" 1
466 1 99 HIS H 1 100 ALA H . . 5.420 3.929 3.443 4.533 . 0 0 "[ . 1 . 2]" 1
467 1 61 LEU MD2 1 101 SER H . . 5.720 2.981 2.121 3.787 . 0 0 "[ . 1 . 2]" 1
468 1 101 SER H 1 102 VAL MG2 . . 6.000 3.312 2.707 3.649 . 0 0 "[ . 1 . 2]" 1
469 1 100 ALA MB 1 101 SER H . . 4.280 3.365 2.310 3.597 . 0 0 "[ . 1 . 2]" 1
470 1 101 SER H 1 101 SER QB . . 3.890 2.428 2.240 2.797 . 0 0 "[ . 1 . 2]" 1
471 1 61 LEU HA 1 101 SER H . . 5.270 3.362 2.889 4.203 . 0 0 "[ . 1 . 2]" 1
472 1 102 VAL H 1 102 VAL MG2 . . 3.700 2.197 1.858 3.101 . 0 0 "[ . 1 . 2]" 1
473 1 100 ALA MB 1 102 VAL H . . 5.080 3.105 2.685 4.170 . 0 0 "[ . 1 . 2]" 1
474 1 102 VAL H 1 102 VAL HB . . 3.900 2.683 2.530 3.618 . 0 0 "[ . 1 . 2]" 1
475 1 101 SER QB 1 102 VAL H . . 4.490 3.446 2.132 4.021 . 0 0 "[ . 1 . 2]" 1
476 1 102 VAL H 1 103 LEU H . . 4.150 2.768 1.688 4.157 0.007 19 0 "[ . 1 . 2]" 1
477 1 101 SER H 1 102 VAL H . . 4.140 2.693 2.300 3.907 . 0 0 "[ . 1 . 2]" 1
478 1 102 VAL MG1 1 103 LEU H . . 4.370 3.757 3.349 4.211 . 0 0 "[ . 1 . 2]" 1
479 1 103 LEU H 1 103 LEU HG . . 4.290 2.938 2.041 3.928 . 0 0 "[ . 1 . 2]" 1
480 1 102 VAL HB 1 103 LEU H . . 4.830 3.393 2.647 4.447 . 0 0 "[ . 1 . 2]" 1
481 1 101 SER HA 1 103 LEU H . . 5.560 3.844 3.231 5.199 . 0 0 "[ . 1 . 2]" 1
482 1 103 LEU HB2 1 104 GLU H . . 4.910 4.091 2.771 4.514 . 0 0 "[ . 1 . 2]" 1
483 1 103 LEU HG 1 104 GLU H . . 5.590 4.847 3.642 5.231 . 0 0 "[ . 1 . 2]" 1
484 1 104 GLU H 1 104 GLU QB . . 3.710 2.514 2.228 3.002 . 0 0 "[ . 1 . 2]" 1
485 1 104 GLU H 1 104 GLU QG . . 4.650 3.111 1.823 4.072 . 0 0 "[ . 1 . 2]" 1
486 1 72 ASN H 1 72 ASN HD22 . . 6.000 5.779 5.660 5.839 . 0 0 "[ . 1 . 2]" 1
487 1 6 ASP H 1 7 TYR QB . . 5.300 4.374 4.284 4.522 . 0 0 "[ . 1 . 2]" 1
488 1 9 TYR H 1 10 GLN QB . . 5.830 4.415 4.247 4.855 . 0 0 "[ . 1 . 2]" 1
489 1 7 TYR QB 1 9 TYR H . . 5.780 4.851 4.707 4.957 . 0 0 "[ . 1 . 2]" 1
490 1 7 TYR H 1 9 TYR H . . 5.710 4.306 4.074 4.511 . 0 0 "[ . 1 . 2]" 1
491 1 9 TYR H 1 11 TRP H . . 6.000 4.167 3.978 4.361 . 0 0 "[ . 1 . 2]" 1
492 1 10 GLN H 1 13 GLU QB . . 5.870 4.700 4.449 4.934 . 0 0 "[ . 1 . 2]" 1
493 1 8 PHE H 1 10 GLN H . . 6.000 4.210 4.055 4.361 . 0 0 "[ . 1 . 2]" 1
494 1 7 TYR QE 1 11 TRP H . . 6.000 5.255 4.868 5.562 . 0 0 "[ . 1 . 2]" 1
495 1 9 TYR QD 1 11 TRP H . . 6.000 5.606 5.449 5.727 . 0 0 "[ . 1 . 2]" 1
496 1 11 TRP H 1 11 TRP HE3 . . 5.900 4.465 4.198 4.730 . 0 0 "[ . 1 . 2]" 1
497 1 16 LYS H 1 17 LEU HB3 . . 6.000 4.808 4.404 5.480 . 0 0 "[ . 1 . 2]" 1
498 1 17 LEU H 1 19 HIS H . . 4.390 4.094 2.408 4.392 0.002 11 0 "[ . 1 . 2]" 1
499 1 17 LEU H 1 20 VAL H . . 5.640 5.058 3.956 5.644 0.004 16 0 "[ . 1 . 2]" 1
500 1 20 VAL H 1 21 SER H . . 6.000 4.531 4.422 4.614 . 0 0 "[ . 1 . 2]" 1
501 1 22 GLU H 1 23 SER H . . 5.920 2.684 2.488 2.871 . 0 0 "[ . 1 . 2]" 1
502 1 24 THR MG 1 25 LYS H . . 4.650 3.770 3.558 3.954 . 0 0 "[ . 1 . 2]" 1
503 1 24 THR MG 1 27 HIS H . . 5.790 4.366 4.133 4.634 . 0 0 "[ . 1 . 2]" 1
504 1 24 THR HB 1 27 HIS H . . 5.870 5.406 5.230 5.653 . 0 0 "[ . 1 . 2]" 1
505 1 24 THR HA 1 28 TYR H . . 5.840 4.427 4.049 4.683 . 0 0 "[ . 1 . 2]" 1
506 1 26 ARG HA 1 28 TYR H . . 6.000 4.538 4.128 4.764 . 0 0 "[ . 1 . 2]" 1
507 1 27 HIS HD2 1 28 TYR H . . 6.000 4.857 4.649 5.128 . 0 0 "[ . 1 . 2]" 1
508 1 28 TYR H 1 31 ALA H . . 5.770 4.680 4.549 4.816 . 0 0 "[ . 1 . 2]" 1
509 1 27 HIS HA 1 29 GLU H . . 5.690 4.588 4.350 4.743 . 0 0 "[ . 1 . 2]" 1
510 1 30 SER H 1 33 LYS QB . . 5.790 5.372 4.408 5.810 0.020 2 0 "[ . 1 . 2]" 1
511 1 28 TYR H 1 30 SER H . . 5.240 4.222 4.069 4.453 . 0 0 "[ . 1 . 2]" 1
512 1 29 GLU QB 1 31 ALA H . . 5.980 4.690 4.531 4.831 . 0 0 "[ . 1 . 2]" 1
513 1 30 SER HA 1 32 TYR H . . 5.680 4.538 4.261 4.792 . 0 0 "[ . 1 . 2]" 1
514 1 2 ILE MG 1 44 LEU H . . 5.320 3.606 3.187 3.929 . 0 0 "[ . 1 . 2]" 1
515 1 4 PHE H 1 44 LEU H . . 4.730 3.543 3.203 3.921 . 0 0 "[ . 1 . 2]" 1
516 1 45 LYS HA 1 47 ILE H . . 5.280 3.657 3.158 4.371 . 0 0 "[ . 1 . 2]" 1
517 1 49 ARG HA 1 52 TYR H . . 4.570 3.380 3.032 3.767 . 0 0 "[ . 1 . 2]" 1
518 1 49 ARG HA 1 53 GLN H . . 5.300 4.109 3.893 4.396 . 0 0 "[ . 1 . 2]" 1
519 1 39 PHE QE 1 55 PHE H . . 5.360 4.963 4.228 5.378 0.018 9 0 "[ . 1 . 2]" 1
520 1 64 SER H 1 67 THR H . . 5.900 4.047 3.625 4.279 . 0 0 "[ . 1 . 2]" 1
521 1 73 SER H 1 74 TYR QD . . 5.950 5.005 4.888 5.150 . 0 0 "[ . 1 . 2]" 1
522 1 76 ARG HA 1 79 PHE H . . 5.500 3.584 3.377 3.898 . 0 0 "[ . 1 . 2]" 1
523 1 76 ARG HA 1 80 ASP H . . 5.690 3.977 3.656 4.246 . 0 0 "[ . 1 . 2]" 1
524 1 79 PHE HB3 1 91 ASN HD22 . . 5.970 3.514 2.184 5.065 . 0 0 "[ . 1 . 2]" 1
525 1 76 ARG HA 1 91 ASN HD22 . . 5.940 5.036 2.485 5.982 0.042 17 0 "[ . 1 . 2]" 1
526 1 79 PHE HB2 1 91 ASN HD22 . . 5.970 4.051 2.398 5.546 . 0 0 "[ . 1 . 2]" 1
527 1 42 LYS H 1 47 ILE MD . . 5.830 4.800 4.146 5.323 . 0 0 "[ . 1 . 2]" 1
528 1 82 ALA H 1 83 ILE H . . 4.820 2.725 2.616 2.860 . 0 0 "[ . 1 . 2]" 1
529 1 68 ILE MG 1 100 ALA H . . 6.000 4.047 3.334 4.861 . 0 0 "[ . 1 . 2]" 1
530 1 58 GLU H 1 61 LEU MD1 . . 5.550 4.426 4.163 4.909 . 0 0 "[ . 1 . 2]" 1
531 1 18 PRO HA 1 20 VAL H . . 5.930 4.388 3.761 5.157 . 0 0 "[ . 1 . 2]" 1
532 1 90 LYS H 1 91 ASN H . . 5.880 4.123 2.702 4.611 . 0 0 "[ . 1 . 2]" 1
533 1 1 MET HA 1 43 LEU MD1 . . 5.200 4.708 2.802 5.253 0.053 14 0 "[ . 1 . 2]" 1
534 1 1 MET HA 1 1 MET ME . . 4.830 3.302 1.467 4.481 . 0 0 "[ . 1 . 2]" 1
535 1 1 MET HB2 1 43 LEU MD1 . . 4.480 3.413 1.733 4.504 0.024 3 0 "[ . 1 . 2]" 1
536 1 1 MET QG 1 43 LEU MD2 . . 4.780 3.136 1.602 4.652 . 0 0 "[ . 1 . 2]" 1
537 1 1 MET QG 1 43 LEU MD1 . . 4.640 2.822 1.882 3.925 . 0 0 "[ . 1 . 2]" 1
538 1 1 MET ME 1 43 LEU MD2 . . 4.760 4.275 2.781 4.846 0.086 3 0 "[ . 1 . 2]" 1
539 1 1 MET ME 1 43 LEU MD1 . . 4.390 3.581 1.835 4.459 0.069 11 0 "[ . 1 . 2]" 1
540 1 1 MET ME 1 45 LYS HE3 . . 5.620 4.283 2.652 5.668 0.048 13 0 "[ . 1 . 2]" 1
541 1 1 MET ME 1 45 LYS HE2 . . 5.620 4.126 2.557 5.376 . 0 0 "[ . 1 . 2]" 1
542 1 2 ILE HB 1 3 THR H . . 5.770 4.003 3.907 4.146 . 0 0 "[ . 1 . 2]" 1
543 1 2 ILE MG 1 44 LEU MD2 . . 5.250 2.806 2.036 4.209 . 0 0 "[ . 1 . 2]" 1
544 1 2 ILE MG 1 7 TYR QB . . 4.420 2.028 1.728 2.489 . 0 0 "[ . 1 . 2]" 1
545 1 2 ILE MD 1 7 TYR QB . . 4.810 2.741 2.093 4.059 . 0 0 "[ . 1 . 2]" 1
546 1 2 ILE MD 1 7 TYR HA . . 4.480 2.660 1.934 4.475 . 0 0 "[ . 1 . 2]" 1
547 1 3 THR MG 1 43 LEU MD2 . . 3.520 2.447 2.088 3.045 . 0 0 "[ . 1 . 2]" 1
548 1 3 THR MG 1 6 ASP HB3 . . 5.930 5.082 4.129 5.967 0.037 20 0 "[ . 1 . 2]" 1
549 1 3 THR MG 1 41 HIS HB2 . . 4.900 4.265 1.879 4.755 . 0 0 "[ . 1 . 2]" 1
550 1 3 THR MG 1 43 LEU HA . . 4.470 3.079 2.655 3.522 . 0 0 "[ . 1 . 2]" 1
551 1 3 THR HA 1 3 THR MG . . 3.730 2.259 2.174 2.391 . 0 0 "[ . 1 . 2]" 1
552 1 3 THR MG 1 6 ASP H . . 5.400 4.430 4.271 4.588 . 0 0 "[ . 1 . 2]" 1
553 1 3 THR MG 1 44 LEU H . . 5.680 4.775 4.368 5.156 . 0 0 "[ . 1 . 2]" 1
554 1 3 THR MG 1 4 PHE H . . 4.880 3.539 3.139 3.893 . 0 0 "[ . 1 . 2]" 1
555 1 3 THR H 1 3 THR MG . . 3.760 2.571 2.130 3.011 . 0 0 "[ . 1 . 2]" 1
556 1 4 PHE HB2 1 44 LEU HA . . 5.220 2.133 1.541 2.485 . 0 0 "[ . 1 . 2]" 1
557 1 5 ALA HA 1 8 PHE HB2 . . 6.000 3.763 3.470 3.974 . 0 0 "[ . 1 . 2]" 1
558 1 5 ALA MB 1 35 ILE MG . . 3.900 2.359 2.117 2.865 . 0 0 "[ . 1 . 2]" 1
559 1 5 ALA MB 1 9 TYR QB . . 6.000 4.653 4.360 4.861 . 0 0 "[ . 1 . 2]" 1
560 1 5 ALA MB 1 6 ASP HA . . 5.260 3.769 3.721 3.801 . 0 0 "[ . 1 . 2]" 1
561 1 5 ALA MB 1 7 TYR H . . 5.490 4.382 4.251 4.584 . 0 0 "[ . 1 . 2]" 1
562 1 2 ILE MD 1 6 ASP HB2 . . 5.560 3.439 2.318 4.471 . 0 0 "[ . 1 . 2]" 1
563 1 3 THR MG 1 6 ASP HB2 . . 5.930 4.522 4.318 4.752 . 0 0 "[ . 1 . 2]" 1
564 1 2 ILE HG13 1 6 ASP HB2 . . 5.870 3.952 2.608 4.950 . 0 0 "[ . 1 . 2]" 1
565 1 2 ILE HG12 1 6 ASP HB2 . . 5.870 3.775 2.242 5.730 . 0 0 "[ . 1 . 2]" 1
566 1 3 THR H 1 6 ASP HB2 . . 5.360 3.970 2.881 4.864 . 0 0 "[ . 1 . 2]" 1
567 1 2 ILE MG 1 7 TYR HA . . 4.680 3.518 2.975 4.111 . 0 0 "[ . 1 . 2]" 1
568 1 7 TYR HA 1 10 GLN QB . . 4.720 2.725 2.355 4.064 . 0 0 "[ . 1 . 2]" 1
569 1 7 TYR HA 1 10 GLN H . . 5.150 3.587 3.356 3.823 . 0 0 "[ . 1 . 2]" 1
570 1 4 PHE HA 1 7 TYR QB . . 5.520 2.461 2.095 3.044 . 0 0 "[ . 1 . 2]" 1
571 1 8 PHE HA 1 11 TRP HB2 . . 5.010 3.781 3.381 4.294 . 0 0 "[ . 1 . 2]" 1
572 1 9 TYR HA 1 12 TYR HB2 . . 5.210 3.863 3.417 4.175 . 0 0 "[ . 1 . 2]" 1
573 1 8 PHE HA 1 11 TRP HB3 . . 5.010 2.686 2.554 2.899 . 0 0 "[ . 1 . 2]" 1
574 1 8 PHE HA 1 11 TRP H . . 5.440 3.743 3.646 3.944 . 0 0 "[ . 1 . 2]" 1
575 1 5 ALA HA 1 8 PHE HB3 . . 5.020 3.126 2.899 3.366 . 0 0 "[ . 1 . 2]" 1
576 1 8 PHE HB2 1 9 TYR H . . 5.620 3.824 3.753 3.883 . 0 0 "[ . 1 . 2]" 1
577 1 9 TYR HA 1 12 TYR HB3 . . 4.620 2.634 2.303 2.959 . 0 0 "[ . 1 . 2]" 1
578 1 9 TYR HA 1 32 TYR QD . . 5.260 4.288 4.030 4.599 . 0 0 "[ . 1 . 2]" 1
579 1 6 ASP HA 1 9 TYR QB . . 4.760 3.073 2.520 3.624 . 0 0 "[ . 1 . 2]" 1
580 1 8 PHE QD 1 9 TYR QB . . 5.610 3.646 3.220 3.789 . 0 0 "[ . 1 . 2]" 1
581 1 10 GLN HA 1 13 GLU QB . . 3.980 2.646 2.277 3.017 . 0 0 "[ . 1 . 2]" 1
582 1 2 ILE MD 1 10 GLN QB . . 6.000 3.602 2.728 4.910 . 0 0 "[ . 1 . 2]" 1
583 1 10 GLN QB 1 14 VAL MG2 . . 6.000 4.014 2.866 4.418 . 0 0 "[ . 1 . 2]" 1
584 1 10 GLN HG2 1 14 VAL MG2 . . 4.760 3.003 2.230 4.880 0.120 15 0 "[ . 1 . 2]" 1
585 1 10 GLN HG2 1 11 TRP H . . 5.870 3.725 2.353 4.629 . 0 0 "[ . 1 . 2]" 1
586 1 10 GLN H 1 10 GLN HG3 . . 4.890 4.313 2.352 4.572 . 0 0 "[ . 1 . 2]" 1
587 1 11 TRP HA 1 14 VAL HB . . 5.230 3.366 2.890 3.695 . 0 0 "[ . 1 . 2]" 1
588 1 10 GLN QB 1 11 TRP HA . . 5.880 4.148 3.855 4.611 . 0 0 "[ . 1 . 2]" 1
589 1 11 TRP HA 1 15 ASN H . . 5.350 4.480 4.248 4.862 . 0 0 "[ . 1 . 2]" 1
590 1 11 TRP HA 1 14 VAL H . . 5.420 3.850 3.627 4.158 . 0 0 "[ . 1 . 2]" 1
591 1 12 TYR HA 1 16 LYS HG2 . . 6.000 3.653 2.405 5.158 . 0 0 "[ . 1 . 2]" 1
592 1 12 TYR HA 1 16 LYS HG3 . . 6.000 4.396 3.046 5.552 . 0 0 "[ . 1 . 2]" 1
593 1 12 TYR HA 1 15 ASN H . . 5.030 3.501 3.195 3.858 . 0 0 "[ . 1 . 2]" 1
594 1 9 TYR QE 1 12 TYR HB3 . . 6.000 5.378 4.910 5.737 . 0 0 "[ . 1 . 2]" 1
595 1 11 TRP HZ3 1 12 TYR HB3 . . 6.000 5.176 4.719 5.697 . 0 0 "[ . 1 . 2]" 1
596 1 12 TYR HB2 1 13 GLU H . . 5.750 3.932 3.760 4.053 . 0 0 "[ . 1 . 2]" 1
597 1 13 GLU HA 1 17 LEU HB2 . . 4.650 2.042 1.470 2.927 . 0 0 "[ . 1 . 2]" 1
598 1 13 GLU HA 1 17 LEU HG . . 5.960 4.585 4.091 5.672 . 0 0 "[ . 1 . 2]" 1
599 1 13 GLU HA 1 17 LEU HB3 . . 5.120 3.480 2.636 4.599 . 0 0 "[ . 1 . 2]" 1
600 1 13 GLU HA 1 15 ASN H . . 5.310 4.230 4.020 4.497 . 0 0 "[ . 1 . 2]" 1
601 1 13 GLU QB 1 17 LEU MD2 . . 5.260 3.598 3.033 4.755 . 0 0 "[ . 1 . 2]" 1
602 1 10 GLN HA 1 13 GLU HG2 . . 6.000 5.017 4.137 5.698 . 0 0 "[ . 1 . 2]" 1
603 1 13 GLU H 1 13 GLU HG2 . . 5.360 4.339 2.650 4.548 . 0 0 "[ . 1 . 2]" 1
604 1 10 GLN HA 1 13 GLU HG3 . . 6.000 5.232 3.466 5.984 . 0 0 "[ . 1 . 2]" 1
605 1 13 GLU H 1 13 GLU HG3 . . 5.360 4.382 3.629 4.537 . 0 0 "[ . 1 . 2]" 1
606 1 14 VAL HA 1 15 ASN HA . . 5.740 4.564 4.521 4.617 . 0 0 "[ . 1 . 2]" 1
607 1 14 VAL HB 1 15 ASN HD22 . . 5.360 4.206 2.875 5.496 0.136 17 0 "[ . 1 . 2]" 1
608 1 14 VAL HA 1 14 VAL MG1 . . 3.610 2.411 2.321 2.482 . 0 0 "[ . 1 . 2]" 1
609 1 11 TRP HA 1 14 VAL MG1 . . 5.070 4.660 4.215 4.966 . 0 0 "[ . 1 . 2]" 1
610 1 14 VAL MG1 1 15 ASN HD21 . . 5.170 4.053 3.230 5.142 . 0 0 "[ . 1 . 2]" 1
611 1 14 VAL MG1 1 15 ASN H . . 4.910 3.788 3.566 4.005 . 0 0 "[ . 1 . 2]" 1
612 1 14 VAL MG1 1 15 ASN HD22 . . 5.170 4.040 2.994 5.163 . 0 0 "[ . 1 . 2]" 1
613 1 14 VAL H 1 14 VAL MG1 . . 4.380 3.789 3.760 3.825 . 0 0 "[ . 1 . 2]" 1
614 1 13 GLU QB 1 14 VAL MG2 . . 3.830 2.969 2.781 3.152 . 0 0 "[ . 1 . 2]" 1
615 1 10 GLN HG3 1 14 VAL MG2 . . 4.760 3.327 2.712 4.749 . 0 0 "[ . 1 . 2]" 1
616 1 14 VAL HA 1 14 VAL MG2 . . 3.390 2.388 2.313 2.493 . 0 0 "[ . 1 . 2]" 1
617 1 11 TRP HA 1 14 VAL MG2 . . 4.910 3.785 3.310 4.246 . 0 0 "[ . 1 . 2]" 1
618 1 10 GLN HA 1 14 VAL MG2 . . 4.770 3.468 3.003 3.818 . 0 0 "[ . 1 . 2]" 1
619 1 14 VAL MG2 1 15 ASN H . . 4.260 4.002 3.874 4.119 . 0 0 "[ . 1 . 2]" 1
620 1 14 VAL H 1 14 VAL MG2 . . 3.540 2.256 2.102 2.598 . 0 0 "[ . 1 . 2]" 1
621 1 17 LEU HB2 1 18 PRO HD3 . . 5.710 3.247 2.973 3.565 . 0 0 "[ . 1 . 2]" 1
622 1 17 LEU HG 1 18 PRO HD3 . . 5.890 3.678 3.457 3.906 . 0 0 "[ . 1 . 2]" 1
623 1 13 GLU HG3 1 17 LEU MD1 . . 4.860 3.412 2.014 4.870 0.010 15 0 "[ . 1 . 2]" 1
624 1 17 LEU MD1 1 25 LYS QD . . 4.690 3.372 2.230 4.098 . 0 0 "[ . 1 . 2]" 1
625 1 13 GLU HG2 1 17 LEU MD1 . . 4.860 4.056 2.498 4.925 0.065 5 0 "[ . 1 . 2]" 1
626 1 17 LEU MD1 1 18 PRO HD2 . . 5.510 5.218 4.934 5.517 0.007 16 0 "[ . 1 . 2]" 1
627 1 13 GLU HA 1 17 LEU MD1 . . 4.160 2.651 2.061 3.326 . 0 0 "[ . 1 . 2]" 1
628 1 17 LEU MD1 1 25 LYS HE3 . . 4.860 3.212 2.202 4.256 . 0 0 "[ . 1 . 2]" 1
629 1 69 ARG HA 1 98 LEU MD1 . . 3.750 2.144 1.735 2.518 . 0 0 "[ . 1 . 2]" 1
630 1 17 LEU HA 1 17 LEU MD1 . . 3.970 2.091 2.032 2.255 . 0 0 "[ . 1 . 2]" 1
631 1 66 GLU HA 1 98 LEU MD1 . . 5.970 5.254 4.657 5.834 . 0 0 "[ . 1 . 2]" 1
632 1 17 LEU MD1 1 25 LYS HA . . 6.000 4.877 4.260 5.476 . 0 0 "[ . 1 . 2]" 1
633 1 65 TYR HA 1 98 LEU MD1 . . 6.000 5.053 4.524 5.539 . 0 0 "[ . 1 . 2]" 1
634 1 73 SER QB 1 98 LEU MD1 . . 6.000 5.536 4.798 6.046 0.046 19 0 "[ . 1 . 2]" 1
635 1 17 LEU MD1 1 18 PRO HA . . 6.000 4.935 4.686 5.211 . 0 0 "[ . 1 . 2]" 1
636 1 65 TYR QD 1 98 LEU MD1 . . 5.110 4.058 3.707 4.458 . 0 0 "[ . 1 . 2]" 1
637 1 15 ASN H 1 17 LEU MD1 . . 5.870 5.874 5.523 5.979 0.109 3 0 "[ . 1 . 2]" 1
638 1 69 ARG H 1 98 LEU MD1 . . 5.190 3.695 3.436 4.114 . 0 0 "[ . 1 . 2]" 1
639 1 98 LEU H 1 98 LEU MD1 . . 4.760 3.731 3.507 4.393 . 0 0 "[ . 1 . 2]" 1
640 1 13 GLU HG3 1 17 LEU MD2 . . 4.600 2.396 1.424 4.460 . 0 0 "[ . 1 . 2]" 1
641 1 13 GLU HG2 1 17 LEU MD2 . . 4.600 2.740 1.593 4.505 . 0 0 "[ . 1 . 2]" 1
642 1 17 LEU MD2 1 18 PRO HB3 . . 5.790 4.416 3.781 4.877 . 0 0 "[ . 1 . 2]" 1
643 1 17 LEU MD2 1 18 PRO HD2 . . 5.630 4.696 4.427 4.946 . 0 0 "[ . 1 . 2]" 1
644 1 13 GLU HA 1 17 LEU MD2 . . 4.130 2.744 2.332 3.925 . 0 0 "[ . 1 . 2]" 1
645 1 17 LEU MD2 1 18 PRO HD3 . . 4.810 3.306 3.098 3.481 . 0 0 "[ . 1 . 2]" 1
646 1 14 VAL HA 1 17 LEU MD2 . . 5.090 4.670 4.355 4.927 . 0 0 "[ . 1 . 2]" 1
647 1 17 LEU MD2 1 18 PRO HA . . 4.680 4.579 4.207 4.792 0.112 12 0 "[ . 1 . 2]" 1
648 1 12 TYR QE 1 17 LEU MD2 . . 5.470 4.857 4.475 5.499 0.029 12 0 "[ . 1 . 2]" 1
649 1 15 ASN H 1 17 LEU MD2 . . 5.660 5.562 5.394 5.749 0.089 19 0 "[ . 1 . 2]" 1
650 1 17 LEU HB3 1 18 PRO HA . . 5.070 4.336 4.187 4.466 . 0 0 "[ . 1 . 2]" 1
651 1 17 LEU HB3 1 18 PRO HD3 . . 4.380 1.692 1.401 1.973 . 0 0 "[ . 1 . 2]" 1
652 1 17 LEU HB3 1 18 PRO HD2 . . 5.160 3.051 2.644 3.343 . 0 0 "[ . 1 . 2]" 1
653 1 19 HIS HB2 1 20 VAL MG1 . . 5.570 2.853 2.657 3.122 . 0 0 "[ . 1 . 2]" 1
654 1 19 HIS HB2 1 20 VAL H . . 5.610 3.019 2.356 3.599 . 0 0 "[ . 1 . 2]" 1
655 1 19 HIS HB3 1 20 VAL H . . 5.610 3.981 3.468 4.350 . 0 0 "[ . 1 . 2]" 1
656 1 19 HIS HB3 1 20 VAL MG1 . . 5.570 3.828 3.668 4.227 . 0 0 "[ . 1 . 2]" 1
657 1 17 LEU HA 1 20 VAL MG1 . . 5.520 4.464 3.862 5.075 . 0 0 "[ . 1 . 2]" 1
658 1 20 VAL MG1 1 28 TYR QE . . 4.560 2.859 2.174 3.698 . 0 0 "[ . 1 . 2]" 1
659 1 20 VAL MG1 1 28 TYR QD . . 5.610 4.094 3.323 4.831 . 0 0 "[ . 1 . 2]" 1
660 1 20 VAL H 1 20 VAL MG1 . . 4.120 2.509 2.215 2.906 . 0 0 "[ . 1 . 2]" 1
661 1 17 LEU H 1 20 VAL MG1 . . 5.580 4.794 3.737 5.272 . 0 0 "[ . 1 . 2]" 1
662 1 20 VAL MG2 1 25 LYS HG2 . . 4.090 2.629 2.097 3.403 . 0 0 "[ . 1 . 2]" 1
663 1 20 VAL MG2 1 24 THR MG . . 3.800 2.874 2.425 3.534 . 0 0 "[ . 1 . 2]" 1
664 1 20 VAL MG2 1 25 LYS HG3 . . 4.090 2.733 2.038 4.056 . 0 0 "[ . 1 . 2]" 1
665 1 17 LEU HA 1 20 VAL MG2 . . 4.070 2.789 2.062 3.372 . 0 0 "[ . 1 . 2]" 1
666 1 20 VAL MG2 1 25 LYS HA . . 4.670 3.327 2.711 4.039 . 0 0 "[ . 1 . 2]" 1
667 1 20 VAL MG2 1 24 THR HB . . 4.380 2.680 2.346 3.105 . 0 0 "[ . 1 . 2]" 1
668 1 12 TYR QE 1 20 VAL MG2 . . 4.830 2.188 1.826 2.739 . 0 0 "[ . 1 . 2]" 1
669 1 20 VAL H 1 20 VAL MG2 . . 3.770 2.082 1.993 2.227 . 0 0 "[ . 1 . 2]" 1
670 1 17 LEU H 1 20 VAL MG2 . . 5.460 4.199 3.354 4.470 . 0 0 "[ . 1 . 2]" 1
671 1 20 VAL MG2 1 21 SER H . . 4.470 3.429 2.954 3.752 . 0 0 "[ . 1 . 2]" 1
672 1 22 GLU HA 1 25 LYS QD . . 4.250 2.382 1.794 3.800 . 0 0 "[ . 1 . 2]" 1
673 1 23 SER HA 1 26 ARG QB . . 4.840 3.281 2.713 4.374 . 0 0 "[ . 1 . 2]" 1
674 1 23 SER HA 1 26 ARG QG . . 5.090 3.521 2.776 5.002 . 0 0 "[ . 1 . 2]" 1
675 1 20 VAL MG1 1 24 THR MG . . 3.720 2.202 1.990 2.520 . 0 0 "[ . 1 . 2]" 1
676 1 20 VAL HB 1 24 THR MG . . 3.990 2.382 2.022 2.976 . 0 0 "[ . 1 . 2]" 1
677 1 24 THR MG 1 27 HIS HB2 . . 5.560 3.231 2.927 3.791 . 0 0 "[ . 1 . 2]" 1
678 1 25 LYS HA 1 28 TYR HB3 . . 5.430 4.452 3.850 4.893 . 0 0 "[ . 1 . 2]" 1
679 1 25 LYS HA 1 28 TYR HB2 . . 5.430 2.837 2.485 3.209 . 0 0 "[ . 1 . 2]" 1
680 1 25 LYS HA 1 28 TYR QD . . 4.970 3.129 2.099 3.629 . 0 0 "[ . 1 . 2]" 1
681 1 25 LYS HA 1 28 TYR H . . 5.430 3.486 3.272 3.636 . 0 0 "[ . 1 . 2]" 1
682 1 25 LYS HB2 1 26 ARG H . . 5.320 2.544 2.306 2.731 . 0 0 "[ . 1 . 2]" 1
683 1 25 LYS HB3 1 26 ARG H . . 5.320 3.545 3.260 3.755 . 0 0 "[ . 1 . 2]" 1
684 1 42 LYS HG3 1 46 ASP HB3 . . 5.520 2.656 1.922 5.438 . 0 0 "[ . 1 . 2]" 1
685 1 25 LYS H 1 25 LYS QD . . 5.560 3.886 3.230 4.159 . 0 0 "[ . 1 . 2]" 1
686 1 17 LEU MD1 1 25 LYS HE2 . . 4.860 2.862 2.012 4.189 . 0 0 "[ . 1 . 2]" 1
687 1 23 SER HA 1 26 ARG QD . . 5.740 3.909 2.354 5.770 0.030 4 0 "[ . 1 . 2]" 1
688 1 24 THR HA 1 27 HIS HB2 . . 5.630 2.837 2.116 3.511 . 0 0 "[ . 1 . 2]" 1
689 1 24 THR MG 1 27 HIS HB3 . . 5.560 4.279 3.732 5.023 . 0 0 "[ . 1 . 2]" 1
690 1 24 THR HA 1 27 HIS HB3 . . 5.630 4.432 3.712 5.164 . 0 0 "[ . 1 . 2]" 1
691 1 28 TYR HA 1 31 ALA MB . . 3.770 2.486 2.312 2.795 . 0 0 "[ . 1 . 2]" 1
692 1 8 PHE QE 1 28 TYR HA . . 5.680 3.235 2.857 3.519 . 0 0 "[ . 1 . 2]" 1
693 1 8 PHE HZ 1 28 TYR HA . . 6.000 3.436 3.072 3.906 . 0 0 "[ . 1 . 2]" 1
694 1 28 TYR HA 1 31 ALA H . . 4.810 3.451 3.271 3.761 . 0 0 "[ . 1 . 2]" 1
695 1 29 GLU HA 1 32 TYR QD . . 5.020 3.487 2.859 3.961 . 0 0 "[ . 1 . 2]" 1
696 1 12 TYR QE 1 29 GLU HG3 . . 5.660 4.347 3.183 5.683 0.023 13 0 "[ . 1 . 2]" 1
697 1 22 GLU QG 1 23 SER H . . 5.810 3.654 1.946 4.705 . 0 0 "[ . 1 . 2]" 1
698 1 31 ALA HA 1 34 HIS QB . . 4.800 3.034 2.686 3.350 . 0 0 "[ . 1 . 2]" 1
699 1 31 ALA MB 1 35 ILE MD . . 4.710 2.956 2.702 3.255 . 0 0 "[ . 1 . 2]" 1
700 1 31 ALA MB 1 71 LEU MD2 . . 5.120 3.846 3.095 4.238 . 0 0 "[ . 1 . 2]" 1
701 1 31 ALA MB 1 75 ILE MD . . 5.050 3.861 3.540 4.260 . 0 0 "[ . 1 . 2]" 1
702 1 31 ALA MB 1 71 LEU HG . . 5.680 4.271 4.134 4.353 . 0 0 "[ . 1 . 2]" 1
703 1 31 ALA MB 1 71 LEU HA . . 5.310 3.356 3.026 3.732 . 0 0 "[ . 1 . 2]" 1
704 1 32 TYR HA 1 35 ILE H . . 5.090 3.428 3.232 3.635 . 0 0 "[ . 1 . 2]" 1
705 1 32 TYR HB2 1 33 LYS H . . 5.740 4.022 3.930 4.109 . 0 0 "[ . 1 . 2]" 1
706 1 32 TYR HB3 1 33 LYS H . . 5.740 2.715 2.563 2.853 . 0 0 "[ . 1 . 2]" 1
707 1 33 LYS HA 1 36 LYS HB2 . . 4.740 3.926 3.183 4.812 0.072 19 0 "[ . 1 . 2]" 1
708 1 33 LYS HA 1 36 LYS HB3 . . 4.740 3.073 2.307 4.266 . 0 0 "[ . 1 . 2]" 1
709 1 32 TYR QD 1 33 LYS HA . . 5.870 3.957 3.686 4.211 . 0 0 "[ . 1 . 2]" 1
710 1 32 TYR QD 1 33 LYS QB . . 5.740 4.300 3.574 5.104 . 0 0 "[ . 1 . 2]" 1
711 1 33 LYS QB 1 34 HIS HD2 . . 6.000 4.413 2.965 5.618 . 0 0 "[ . 1 . 2]" 1
712 1 31 ALA MB 1 34 HIS QB . . 6.000 4.306 4.039 4.569 . 0 0 "[ . 1 . 2]" 1
713 1 33 LYS QB 1 34 HIS QB . . 5.870 4.731 4.067 5.214 . 0 0 "[ . 1 . 2]" 1
714 1 32 TYR HA 1 35 ILE HB . . 4.600 2.448 2.222 2.801 . 0 0 "[ . 1 . 2]" 1
715 1 35 ILE H 1 35 ILE HG12 . . 4.770 3.549 3.465 3.669 . 0 0 "[ . 1 . 2]" 1
716 1 11 TRP H 1 13 GLU QB . . 6.000 5.008 4.693 5.325 . 0 0 "[ . 1 . 2]" 1
717 1 35 ILE MG 1 75 ILE MG . . 6.000 4.969 4.408 5.308 . 0 0 "[ . 1 . 2]" 1
718 1 35 ILE MG 1 75 ILE MD . . 6.000 4.278 3.935 4.575 . 0 0 "[ . 1 . 2]" 1
719 1 8 PHE HB2 1 35 ILE MG . . 5.750 3.504 3.067 3.875 . 0 0 "[ . 1 . 2]" 1
720 1 35 ILE MG 1 39 PHE HB2 . . 5.410 2.580 2.140 2.854 . 0 0 "[ . 1 . 2]" 1
721 1 8 PHE HB3 1 35 ILE MG . . 5.470 3.525 3.272 4.027 . 0 0 "[ . 1 . 2]" 1
722 1 35 ILE MG 1 39 PHE HB3 . . 5.410 3.865 3.427 4.212 . 0 0 "[ . 1 . 2]" 1
723 1 5 ALA HA 1 35 ILE MG . . 3.880 2.172 1.871 2.455 . 0 0 "[ . 1 . 2]" 1
724 1 32 TYR HA 1 35 ILE MG . . 5.450 3.782 3.589 4.120 . 0 0 "[ . 1 . 2]" 1
725 1 8 PHE QD 1 35 ILE MG . . 6.000 4.168 3.895 4.505 . 0 0 "[ . 1 . 2]" 1
726 1 35 ILE MG 1 55 PHE QE . . 6.000 4.598 4.318 5.001 . 0 0 "[ . 1 . 2]" 1
727 1 32 TYR QD 1 35 ILE MG . . 5.790 3.838 3.434 4.394 . 0 0 "[ . 1 . 2]" 1
728 1 35 ILE MG 1 40 ARG H . . 5.980 5.888 5.370 6.072 0.092 5 0 "[ . 1 . 2]" 1
729 1 35 ILE MG 1 39 PHE H . . 5.770 3.638 3.297 3.787 . 0 0 "[ . 1 . 2]" 1
730 1 35 ILE MD 1 35 ILE MG . . 3.740 1.936 1.899 1.963 . 0 0 "[ . 1 . 2]" 1
731 1 35 ILE MD 1 75 ILE HG13 . . 5.040 3.488 3.063 4.567 . 0 0 "[ . 1 . 2]" 1
732 1 35 ILE MD 1 75 ILE MD . . 3.970 2.479 2.222 2.918 . 0 0 "[ . 1 . 2]" 1
733 1 35 ILE MD 1 75 ILE HG12 . . 5.040 2.671 2.120 4.278 . 0 0 "[ . 1 . 2]" 1
734 1 8 PHE HB2 1 35 ILE MD . . 5.120 3.058 2.893 3.351 . 0 0 "[ . 1 . 2]" 1
735 1 8 PHE HB3 1 35 ILE MD . . 5.270 3.250 3.060 3.431 . 0 0 "[ . 1 . 2]" 1
736 1 5 ALA HA 1 35 ILE MD . . 5.110 3.746 3.330 4.199 . 0 0 "[ . 1 . 2]" 1
737 1 35 ILE MD 1 75 ILE HA . . 5.820 4.422 4.031 4.774 . 0 0 "[ . 1 . 2]" 1
738 1 32 TYR HA 1 35 ILE MD . . 4.360 2.503 2.124 2.798 . 0 0 "[ . 1 . 2]" 1
739 1 4 PHE QD 1 35 ILE MD . . 5.780 3.776 3.486 4.058 . 0 0 "[ . 1 . 2]" 1
740 1 8 PHE QE 1 35 ILE MD . . 5.000 3.180 3.026 3.398 . 0 0 "[ . 1 . 2]" 1
741 1 35 ILE MD 1 39 PHE QD . . 5.730 4.407 3.964 4.889 . 0 0 "[ . 1 . 2]" 1
742 1 35 ILE MD 1 75 ILE H . . 6.000 5.114 4.717 5.431 . 0 0 "[ . 1 . 2]" 1
743 1 35 ILE H 1 35 ILE MD . . 4.760 3.632 3.580 3.680 . 0 0 "[ . 1 . 2]" 1
744 1 35 ILE MD 1 36 LYS H . . 5.610 4.531 4.464 4.610 . 0 0 "[ . 1 . 2]" 1
745 1 35 ILE MG 1 36 LYS HA . . 5.450 3.230 2.949 3.602 . 0 0 "[ . 1 . 2]" 1
746 1 5 ALA MB 1 36 LYS HA . . 3.590 2.403 1.906 2.950 . 0 0 "[ . 1 . 2]" 1
747 1 36 LYS HA 1 40 ARG H . . 5.250 5.053 4.558 5.361 0.111 8 0 "[ . 1 . 2]" 1
748 1 33 LYS HA 1 36 LYS HG2 . . 5.560 3.970 1.884 5.251 . 0 0 "[ . 1 . 2]" 1
749 1 90 LYS QG 1 91 ASN H . . 5.650 3.971 2.570 4.804 . 0 0 "[ . 1 . 2]" 1
750 1 33 LYS HA 1 36 LYS HG3 . . 5.560 4.699 3.030 5.661 0.101 9 0 "[ . 1 . 2]" 1
751 1 33 LYS HA 1 36 LYS HD2 . . 6.000 4.192 2.506 6.099 0.099 6 0 "[ . 1 . 2]" 1
752 1 32 TYR QE 1 36 LYS HD2 . . 5.310 4.272 2.527 5.208 . 0 0 "[ . 1 . 2]" 1
753 1 33 LYS HA 1 36 LYS HD3 . . 6.000 4.242 2.181 5.945 . 0 0 "[ . 1 . 2]" 1
754 1 32 TYR QE 1 36 LYS HD3 . . 5.310 4.155 3.154 5.314 0.004 7 0 "[ . 1 . 2]" 1
755 1 33 LYS HA 1 36 LYS HE2 . . 5.330 4.254 2.456 5.384 0.054 12 0 "[ . 1 . 2]" 1
756 1 33 LYS HA 1 36 LYS HE3 . . 5.330 3.778 1.689 5.289 . 0 0 "[ . 1 . 2]" 1
757 1 37 ASP HB2 1 38 HIS H . . 5.070 3.909 3.824 4.034 . 0 0 "[ . 1 . 2]" 1
758 1 37 ASP HB3 1 38 HIS H . . 5.070 2.575 2.486 2.779 . 0 0 "[ . 1 . 2]" 1
759 1 36 LYS HA 1 40 ARG HA . . 4.640 3.542 2.644 4.225 . 0 0 "[ . 1 . 2]" 1
760 1 40 ARG HB3 1 41 HIS H . . 5.000 3.562 3.036 3.911 . 0 0 "[ . 1 . 2]" 1
761 1 40 ARG H 1 40 ARG HG3 . . 4.680 2.485 1.814 3.618 . 0 0 "[ . 1 . 2]" 1
762 1 40 ARG HA 1 40 ARG HD2 . . 5.420 4.439 2.866 4.984 . 0 0 "[ . 1 . 2]" 1
763 1 40 ARG H 1 40 ARG HD2 . . 6.000 4.447 3.526 4.917 . 0 0 "[ . 1 . 2]" 1
764 1 40 ARG HA 1 40 ARG HD3 . . 5.420 4.302 2.047 4.942 . 0 0 "[ . 1 . 2]" 1
765 1 66 GLU HA 1 69 ARG HD3 . . 5.840 3.721 2.550 5.595 . 0 0 "[ . 1 . 2]" 1
766 1 3 THR MG 1 41 HIS HB3 . . 4.900 3.542 2.664 4.096 . 0 0 "[ . 1 . 2]" 1
767 1 42 LYS HA 1 43 LEU MD2 . . 5.220 4.540 4.248 5.060 . 0 0 "[ . 1 . 2]" 1
768 1 42 LYS HA 1 42 LYS HG3 . . 4.240 2.597 2.307 2.974 . 0 0 "[ . 1 . 2]" 1
769 1 42 LYS HB3 1 47 ILE MD . . 4.540 2.654 1.966 3.457 . 0 0 "[ . 1 . 2]" 1
770 1 42 LYS HB3 1 42 LYS QE . . 4.770 3.987 3.108 4.462 . 0 0 "[ . 1 . 2]" 1
771 1 42 LYS HG2 1 47 ILE MD . . 4.790 2.161 1.665 3.091 . 0 0 "[ . 1 . 2]" 1
772 1 42 LYS H 1 42 LYS HG2 . . 4.940 4.554 4.412 4.683 . 0 0 "[ . 1 . 2]" 1
773 1 42 LYS QD 1 47 ILE MD . . 4.300 3.405 2.222 4.466 0.166 2 0 "[ . 1 . 2]" 1
774 1 42 LYS HA 1 42 LYS QD . . 4.260 2.931 1.793 4.228 . 0 0 "[ . 1 . 2]" 1
775 1 39 PHE QE 1 42 LYS QD . . 5.920 3.910 2.131 5.295 . 0 0 "[ . 1 . 2]" 1
776 1 42 LYS QE 1 47 ILE MD . . 4.610 3.764 2.085 4.647 0.037 2 0 "[ . 1 . 2]" 1
777 1 42 LYS QE 1 42 LYS HG3 . . 3.830 2.695 2.340 3.241 . 0 0 "[ . 1 . 2]" 1
778 1 42 LYS QE 1 42 LYS HG2 . . 3.550 2.719 2.236 3.438 . 0 0 "[ . 1 . 2]" 1
779 1 42 LYS HB2 1 42 LYS QE . . 4.770 3.283 1.710 4.024 . 0 0 "[ . 1 . 2]" 1
780 1 42 LYS QE 1 47 ILE HA . . 5.860 4.036 2.081 5.839 . 0 0 "[ . 1 . 2]" 1
781 1 42 LYS HA 1 42 LYS QE . . 5.230 3.757 1.785 4.849 . 0 0 "[ . 1 . 2]" 1
782 1 39 PHE HA 1 42 LYS QE . . 6.000 4.582 3.634 5.608 . 0 0 "[ . 1 . 2]" 1
783 1 39 PHE QD 1 42 LYS QE . . 5.360 3.341 2.789 4.617 . 0 0 "[ . 1 . 2]" 1
784 1 42 LYS H 1 42 LYS QE . . 5.720 5.203 3.804 6.035 0.315 9 0 "[ . 1 . 2]" 1
785 1 42 LYS QE 1 43 LEU H . . 5.960 4.676 2.373 5.351 . 0 0 "[ . 1 . 2]" 1
786 1 43 LEU HB2 1 45 LYS HG3 . . 5.360 3.293 2.455 3.954 . 0 0 "[ . 1 . 2]" 1
787 1 43 LEU HB2 1 45 LYS HG2 . . 5.360 3.998 2.635 5.372 0.012 17 0 "[ . 1 . 2]" 1
788 1 43 LEU HB2 1 44 LEU H . . 5.620 3.742 3.351 4.060 . 0 0 "[ . 1 . 2]" 1
789 1 43 LEU HB3 1 45 LYS HG3 . . 5.360 3.264 2.077 4.065 . 0 0 "[ . 1 . 2]" 1
790 1 43 LEU HB3 1 45 LYS HG2 . . 5.360 3.378 2.369 4.538 . 0 0 "[ . 1 . 2]" 1
791 1 43 LEU HB3 1 44 LEU H . . 5.620 2.638 2.262 3.003 . 0 0 "[ . 1 . 2]" 1
792 1 3 THR MG 1 43 LEU HG . . 5.480 3.912 3.504 4.476 . 0 0 "[ . 1 . 2]" 1
793 1 42 LYS HA 1 43 LEU HG . . 4.960 3.902 3.685 4.130 . 0 0 "[ . 1 . 2]" 1
794 1 43 LEU MD1 1 45 LYS HG2 . . 4.920 3.706 2.703 4.486 . 0 0 "[ . 1 . 2]" 1
795 1 1 MET HB3 1 43 LEU MD1 . . 4.480 2.954 1.828 4.148 . 0 0 "[ . 1 . 2]" 1
796 1 3 THR HA 1 43 LEU MD1 . . 5.820 5.129 4.879 5.514 . 0 0 "[ . 1 . 2]" 1
797 1 43 LEU MD1 1 46 ASP H . . 5.620 4.587 4.176 5.064 . 0 0 "[ . 1 . 2]" 1
798 1 43 LEU MD1 1 44 LEU H . . 5.410 4.579 4.260 4.875 . 0 0 "[ . 1 . 2]" 1
799 1 1 MET HB3 1 43 LEU MD2 . . 4.260 2.789 1.845 4.282 0.022 19 0 "[ . 1 . 2]" 1
800 1 1 MET HB2 1 43 LEU MD2 . . 4.260 3.466 2.094 4.313 0.053 4 0 "[ . 1 . 2]" 1
801 1 1 MET HA 1 43 LEU MD2 . . 4.770 4.098 2.862 4.803 0.033 5 0 "[ . 1 . 2]" 1
802 1 2 ILE HA 1 43 LEU MD2 . . 4.410 3.581 3.076 4.453 0.043 2 0 "[ . 1 . 2]" 1
803 1 43 LEU MD2 1 44 LEU H . . 4.520 3.481 3.240 3.685 . 0 0 "[ . 1 . 2]" 1
804 1 4 PHE H 1 43 LEU MD2 . . 5.470 4.416 4.189 4.729 . 0 0 "[ . 1 . 2]" 1
805 1 43 LEU H 1 43 LEU MD2 . . 4.370 3.283 3.027 3.619 . 0 0 "[ . 1 . 2]" 1
806 1 44 LEU HA 1 47 ILE HG12 . . 5.440 3.235 2.018 5.309 . 0 0 "[ . 1 . 2]" 1
807 1 4 PHE HB3 1 44 LEU HA . . 5.220 3.827 3.256 4.226 . 0 0 "[ . 1 . 2]" 1
808 1 44 LEU HA 1 79 PHE QE . . 6.000 3.866 3.288 4.406 . 0 0 "[ . 1 . 2]" 1
809 1 44 LEU HA 1 46 ASP H . . 5.480 3.764 3.479 3.939 . 0 0 "[ . 1 . 2]" 1
810 1 44 LEU H 1 45 LYS HA . . 5.630 5.306 5.150 5.439 . 0 0 "[ . 1 . 2]" 1
811 1 44 LEU H 1 45 LYS HG2 . . 5.270 4.577 3.917 5.386 0.116 15 0 "[ . 1 . 2]" 1
812 1 44 LEU H 1 45 LYS HG3 . . 5.270 4.644 3.676 5.347 0.077 7 0 "[ . 1 . 2]" 1
813 1 45 LYS HA 1 45 LYS HD2 . . 5.580 4.778 3.904 5.243 . 0 0 "[ . 1 . 2]" 1
814 1 45 LYS HA 1 45 LYS HD3 . . 5.580 4.904 3.878 5.538 . 0 0 "[ . 1 . 2]" 1
815 1 43 LEU H 1 46 ASP HB3 . . 5.460 2.793 2.066 4.933 . 0 0 "[ . 1 . 2]" 1
816 1 46 ASP HB3 1 47 ILE H . . 5.840 3.620 2.759 4.484 . 0 0 "[ . 1 . 2]" 1
817 1 42 LYS HG3 1 46 ASP HB2 . . 5.520 4.155 3.425 5.448 . 0 0 "[ . 1 . 2]" 1
818 1 54 LYS HA 1 54 LYS QD . . 4.810 3.371 1.988 4.552 . 0 0 "[ . 1 . 2]" 1
819 1 54 LYS HA 1 57 ASN HB3 . . 4.670 3.875 2.529 4.694 0.024 20 0 "[ . 1 . 2]" 1
820 1 47 ILE HG12 1 79 PHE HZ . . 5.690 3.461 2.865 5.330 . 0 0 "[ . 1 . 2]" 1
821 1 44 LEU HA 1 47 ILE HG13 . . 5.440 3.638 2.423 5.466 0.026 18 0 "[ . 1 . 2]" 1
822 1 47 ILE HG13 1 79 PHE HZ . . 5.690 2.782 1.551 5.303 . 0 0 "[ . 1 . 2]" 1
823 1 47 ILE MG 1 52 TYR HB2 . . 5.000 2.508 2.148 3.004 . 0 0 "[ . 1 . 2]" 1
824 1 47 ILE MG 1 52 TYR HB3 . . 5.000 3.844 3.465 4.349 . 0 0 "[ . 1 . 2]" 1
825 1 47 ILE MG 1 51 GLU HA . . 5.860 5.554 4.297 5.936 0.076 19 0 "[ . 1 . 2]" 1
826 1 47 ILE MG 1 49 ARG HA . . 6.000 3.993 3.393 4.816 . 0 0 "[ . 1 . 2]" 1
827 1 47 ILE MG 1 52 TYR HA . . 6.000 3.649 3.313 3.945 . 0 0 "[ . 1 . 2]" 1
828 1 47 ILE MG 1 48 LYS HA . . 5.950 4.024 3.447 4.411 . 0 0 "[ . 1 . 2]" 1
829 1 4 PHE QE 1 47 ILE MG . . 5.390 4.193 3.822 4.846 . 0 0 "[ . 1 . 2]" 1
830 1 39 PHE QE 1 47 ILE MG . . 4.500 2.992 2.324 3.513 . 0 0 "[ . 1 . 2]" 1
831 1 47 ILE MG 1 79 PHE QE . . 4.930 3.460 2.736 4.228 . 0 0 "[ . 1 . 2]" 1
832 1 39 PHE QD 1 47 ILE MG . . 5.570 4.014 3.504 4.564 . 0 0 "[ . 1 . 2]" 1
833 1 47 ILE MG 1 48 LYS H . . 4.310 3.023 2.440 3.377 . 0 0 "[ . 1 . 2]" 1
834 1 42 LYS HG3 1 47 ILE MD . . 4.290 2.853 2.047 4.333 0.043 20 0 "[ . 1 . 2]" 1
835 1 42 LYS HB2 1 47 ILE MD . . 4.540 3.786 3.074 4.548 0.008 20 0 "[ . 1 . 2]" 1
836 1 4 PHE HB2 1 47 ILE MD . . 4.480 2.293 2.027 3.070 . 0 0 "[ . 1 . 2]" 1
837 1 4 PHE HB3 1 47 ILE MD . . 4.480 2.478 2.103 2.850 . 0 0 "[ . 1 . 2]" 1
838 1 44 LEU HA 1 47 ILE MD . . 4.840 3.231 1.475 4.075 . 0 0 "[ . 1 . 2]" 1
839 1 47 ILE HA 1 47 ILE MD . . 3.730 2.342 2.010 3.767 0.037 20 0 "[ . 1 . 2]" 1
840 1 42 LYS HA 1 47 ILE MD . . 5.520 4.504 4.199 5.269 . 0 0 "[ . 1 . 2]" 1
841 1 39 PHE HA 1 47 ILE MD . . 5.780 4.540 4.074 4.876 . 0 0 "[ . 1 . 2]" 1
842 1 43 LEU HA 1 47 ILE MD . . 6.000 4.884 4.292 5.410 . 0 0 "[ . 1 . 2]" 1
843 1 4 PHE HA 1 47 ILE MD . . 5.470 4.402 4.057 4.994 . 0 0 "[ . 1 . 2]" 1
844 1 4 PHE QE 1 47 ILE MD . . 5.290 4.069 3.633 4.721 . 0 0 "[ . 1 . 2]" 1
845 1 47 ILE MD 1 48 LYS H . . 4.810 4.071 3.676 4.863 0.053 2 0 "[ . 1 . 2]" 1
846 1 4 PHE H 1 47 ILE MD . . 5.710 3.721 3.308 4.056 . 0 0 "[ . 1 . 2]" 1
847 1 5 ALA H 1 47 ILE MD . . 6.000 4.699 4.316 5.067 . 0 0 "[ . 1 . 2]" 1
848 1 43 LEU H 1 47 ILE MD . . 6.000 4.522 4.071 5.534 . 0 0 "[ . 1 . 2]" 1
849 1 50 THR MG 1 51 GLU H . . 5.010 4.046 3.648 4.199 . 0 0 "[ . 1 . 2]" 1
850 1 49 ARG H 1 50 THR MG . . 6.000 4.841 4.132 5.913 . 0 0 "[ . 1 . 2]" 1
851 1 50 THR MG 1 53 GLN H . . 6.000 4.979 4.542 5.255 . 0 0 "[ . 1 . 2]" 1
852 1 48 LYS H 1 51 GLU HG2 . . 5.530 3.751 2.301 5.307 . 0 0 "[ . 1 . 2]" 1
853 1 48 LYS H 1 51 GLU HG3 . . 5.530 3.796 2.188 5.417 . 0 0 "[ . 1 . 2]" 1
854 1 53 GLN HA 1 56 LEU HB3 . . 5.170 4.481 4.147 5.165 . 0 0 "[ . 1 . 2]" 1
855 1 52 TYR QD 1 53 GLN HA . . 5.550 4.247 3.837 4.660 . 0 0 "[ . 1 . 2]" 1
856 1 53 GLN HA 1 57 ASN H . . 5.530 4.107 3.906 4.547 . 0 0 "[ . 1 . 2]" 1
857 1 52 TYR H 1 53 GLN HA . . 5.720 5.252 5.163 5.314 . 0 0 "[ . 1 . 2]" 1
858 1 27 HIS H 1 29 GLU QB . . 5.890 4.938 4.492 5.255 . 0 0 "[ . 1 . 2]" 1
859 1 10 GLN HG3 1 11 TRP H . . 5.870 4.432 2.163 4.853 . 0 0 "[ . 1 . 2]" 1
860 1 54 LYS HA 1 57 ASN HD21 . . 5.240 3.356 2.000 4.714 . 0 0 "[ . 1 . 2]" 1
861 1 54 LYS H 1 54 LYS HG3 . . 4.810 3.151 1.937 4.423 . 0 0 "[ . 1 . 2]" 1
862 1 50 THR MG 1 54 LYS QE . . 4.660 4.033 1.929 4.682 0.022 20 0 "[ . 1 . 2]" 1
863 1 50 THR HA 1 54 LYS QE . . 6.000 4.669 3.673 5.863 . 0 0 "[ . 1 . 2]" 1
864 1 54 LYS HA 1 54 LYS QE . . 6.000 4.278 1.884 5.201 . 0 0 "[ . 1 . 2]" 1
865 1 50 THR HB 1 54 LYS QE . . 5.800 3.656 2.535 5.844 0.044 2 0 "[ . 1 . 2]" 1
866 1 51 GLU HA 1 54 LYS QE . . 6.000 3.638 1.688 5.597 . 0 0 "[ . 1 . 2]" 1
867 1 54 LYS H 1 54 LYS QE . . 5.380 3.969 2.474 4.799 . 0 0 "[ . 1 . 2]" 1
868 1 55 PHE HA 1 58 GLU QB . . 4.450 3.213 2.783 3.555 . 0 0 "[ . 1 . 2]" 1
869 1 38 HIS HE1 1 55 PHE HB2 . . 6.000 5.314 3.844 6.014 0.014 2 0 "[ . 1 . 2]" 1
870 1 54 LYS H 1 55 PHE HB2 . . 6.000 5.137 4.975 5.361 . 0 0 "[ . 1 . 2]" 1
871 1 52 TYR QD 1 55 PHE HB3 . . 6.000 3.357 2.709 4.107 . 0 0 "[ . 1 . 2]" 1
872 1 39 PHE HZ 1 55 PHE HB3 . . 5.430 3.649 2.971 4.479 . 0 0 "[ . 1 . 2]" 1
873 1 56 LEU HA 1 56 LEU MD1 . . 4.640 3.840 3.808 3.875 . 0 0 "[ . 1 . 2]" 1
874 1 56 LEU HA 1 68 ILE MD . . 5.150 2.818 2.513 3.030 . 0 0 "[ . 1 . 2]" 1
875 1 56 LEU HA 1 59 TYR HB2 . . 4.990 3.316 2.997 3.840 . 0 0 "[ . 1 . 2]" 1
876 1 56 LEU HA 1 59 TYR HB3 . . 4.990 2.656 2.529 2.859 . 0 0 "[ . 1 . 2]" 1
877 1 55 PHE QD 1 56 LEU HA . . 5.660 3.701 3.509 3.901 . 0 0 "[ . 1 . 2]" 1
878 1 56 LEU HB2 1 68 ILE MD . . 4.920 3.527 3.199 3.799 . 0 0 "[ . 1 . 2]" 1
879 1 53 GLN HA 1 56 LEU HB2 . . 5.170 2.852 2.514 3.481 . 0 0 "[ . 1 . 2]" 1
880 1 56 LEU MD1 1 71 LEU MD2 . . 5.240 4.575 4.297 4.986 . 0 0 "[ . 1 . 2]" 1
881 1 56 LEU MD1 1 68 ILE MD . . 4.360 3.270 2.957 3.663 . 0 0 "[ . 1 . 2]" 1
882 1 55 PHE HB3 1 56 LEU MD1 . . 5.290 4.843 4.737 4.942 . 0 0 "[ . 1 . 2]" 1
883 1 53 GLN HA 1 56 LEU MD1 . . 4.820 2.720 2.254 3.573 . 0 0 "[ . 1 . 2]" 1
884 1 56 LEU MD1 1 98 LEU HA . . 5.520 3.501 2.844 3.905 . 0 0 "[ . 1 . 2]" 1
885 1 56 LEU MD1 1 57 ASN H . . 5.820 4.562 4.443 4.777 . 0 0 "[ . 1 . 2]" 1
886 1 56 LEU MD1 1 98 LEU H . . 6.000 4.457 2.420 5.072 . 0 0 "[ . 1 . 2]" 1
887 1 52 TYR HH 1 56 LEU MD1 . . 5.140 3.478 2.270 4.510 . 0 0 "[ . 1 . 2]" 1
888 1 56 LEU MD2 1 71 LEU MD2 . . 4.070 2.380 2.051 2.753 . 0 0 "[ . 1 . 2]" 1
889 1 56 LEU MD2 1 68 ILE MD . . 3.770 2.471 2.151 2.895 . 0 0 "[ . 1 . 2]" 1
890 1 56 LEU MD2 1 96 ALA MB . . 4.410 3.978 3.526 4.343 . 0 0 "[ . 1 . 2]" 1
891 1 56 LEU MD2 1 68 ILE HG13 . . 5.250 2.581 2.196 3.066 . 0 0 "[ . 1 . 2]" 1
892 1 56 LEU MD2 1 75 ILE HB . . 6.000 4.773 4.419 5.155 . 0 0 "[ . 1 . 2]" 1
893 1 56 LEU HA 1 56 LEU MD2 . . 3.710 1.980 1.885 2.040 . 0 0 "[ . 1 . 2]" 1
894 1 56 LEU MD2 1 68 ILE HA . . 5.890 4.268 3.769 4.819 . 0 0 "[ . 1 . 2]" 1
895 1 56 LEU MD2 1 98 LEU HA . . 5.820 4.183 3.630 4.775 . 0 0 "[ . 1 . 2]" 1
896 1 52 TYR HH 1 56 LEU MD2 . . 5.360 3.186 2.688 3.752 . 0 0 "[ . 1 . 2]" 1
897 1 58 GLU HA 1 61 LEU MD2 . . 4.880 4.494 3.936 4.928 0.048 20 0 "[ . 1 . 2]" 1
898 1 58 GLU HA 1 61 LEU MD1 . . 3.920 2.274 1.881 2.816 . 0 0 "[ . 1 . 2]" 1
899 1 58 GLU QB 1 61 LEU MD1 . . 5.160 3.885 3.274 4.516 . 0 0 "[ . 1 . 2]" 1
900 1 20 VAL MG2 1 22 GLU QB . . 5.980 5.876 5.624 6.066 0.086 11 0 "[ . 1 . 2]" 1
901 1 58 GLU HG2 1 61 LEU MD1 . . 5.090 4.374 2.892 5.135 0.045 6 0 "[ . 1 . 2]" 1
902 1 58 GLU HG3 1 61 LEU MD1 . . 5.090 4.284 3.238 4.959 . 0 0 "[ . 1 . 2]" 1
903 1 29 GLU HA 1 29 GLU HG2 . . 4.190 2.555 2.160 3.607 . 0 0 "[ . 1 . 2]" 1
904 1 34 HIS QB 1 59 TYR HA . . 6.000 5.253 4.677 5.693 . 0 0 "[ . 1 . 2]" 1
905 1 56 LEU HA 1 59 TYR HA . . 6.000 5.297 5.130 5.600 . 0 0 "[ . 1 . 2]" 1
906 1 58 GLU HA 1 61 LEU HG . . 4.460 3.116 2.474 3.547 . 0 0 "[ . 1 . 2]" 1
907 1 61 LEU MD2 1 62 THR H . . 5.500 4.718 4.645 4.779 . 0 0 "[ . 1 . 2]" 1
908 1 61 LEU H 1 61 LEU MD2 . . 4.330 3.594 3.225 3.763 . 0 0 "[ . 1 . 2]" 1
909 1 61 LEU HB2 1 62 THR MG . . 4.210 3.040 2.884 3.285 . 0 0 "[ . 1 . 2]" 1
910 1 61 LEU HB3 1 62 THR MG . . 4.210 3.592 3.262 4.261 0.051 2 0 "[ . 1 . 2]" 1
911 1 63 HIS HB2 1 68 ILE MG . . 5.760 4.635 4.366 5.184 . 0 0 "[ . 1 . 2]" 1
912 1 63 HIS HB3 1 68 ILE MG . . 5.760 4.879 4.543 5.347 . 0 0 "[ . 1 . 2]" 1
913 1 63 HIS HB3 1 67 THR MG . . 4.630 2.593 2.208 2.928 . 0 0 "[ . 1 . 2]" 1
914 1 65 TYR HA 1 69 ARG H . . 5.310 3.933 3.782 4.182 . 0 0 "[ . 1 . 2]" 1
915 1 64 SER HA 1 65 TYR HB2 . . 5.890 4.690 4.598 4.860 . 0 0 "[ . 1 . 2]" 1
916 1 64 SER HA 1 65 TYR HB3 . . 5.890 4.959 4.829 5.135 . 0 0 "[ . 1 . 2]" 1
917 1 66 GLU HA 1 69 ARG HB3 . . 4.240 2.587 1.905 4.112 . 0 0 "[ . 1 . 2]" 1
918 1 66 GLU HA 1 69 ARG HB2 . . 4.240 3.039 2.320 3.686 . 0 0 "[ . 1 . 2]" 1
919 1 66 GLU HA 1 69 ARG HD2 . . 5.840 4.234 3.062 5.689 . 0 0 "[ . 1 . 2]" 1
920 1 66 GLU HA 1 69 ARG H . . 4.950 3.413 3.121 3.762 . 0 0 "[ . 1 . 2]" 1
921 1 66 GLU HG2 1 70 LYS HD2 . . 6.000 4.626 2.638 6.086 0.086 12 0 "[ . 1 . 2]" 1
922 1 66 GLU HG2 1 70 LYS HD3 . . 6.000 4.500 1.774 6.082 0.082 8 0 "[ . 1 . 2]" 1
923 1 66 GLU HG2 1 70 LYS QE . . 5.620 3.930 2.394 5.671 0.051 3 0 "[ . 1 . 2]" 1
924 1 67 THR MG 1 71 LEU MD2 . . 5.890 4.565 4.332 5.413 . 0 0 "[ . 1 . 2]" 1
925 1 63 HIS HB2 1 67 THR MG . . 4.630 3.707 3.320 4.127 . 0 0 "[ . 1 . 2]" 1
926 1 67 THR MG 1 68 ILE HA . . 5.140 3.956 3.604 5.124 . 0 0 "[ . 1 . 2]" 1
927 1 67 THR HA 1 67 THR MG . . 3.750 2.267 2.173 2.366 . 0 0 "[ . 1 . 2]" 1
928 1 59 TYR QD 1 67 THR MG . . 5.580 4.368 3.972 5.039 . 0 0 "[ . 1 . 2]" 1
929 1 67 THR MG 1 69 ARG H . . 5.830 5.228 5.050 5.617 . 0 0 "[ . 1 . 2]" 1
930 1 68 ILE HA 1 68 ILE MD . . 4.780 3.805 3.767 3.865 . 0 0 "[ . 1 . 2]" 1
931 1 68 ILE HA 1 71 LEU HB2 . . 4.660 3.088 2.838 3.258 . 0 0 "[ . 1 . 2]" 1
932 1 68 ILE HA 1 71 LEU HB3 . . 4.660 2.249 1.986 2.457 . 0 0 "[ . 1 . 2]" 1
933 1 68 ILE HA 1 71 LEU H . . 4.970 3.278 3.113 3.399 . 0 0 "[ . 1 . 2]" 1
934 1 68 ILE HB 1 98 LEU MD2 . . 5.550 4.285 4.083 4.675 . 0 0 "[ . 1 . 2]" 1
935 1 65 TYR HA 1 68 ILE HB . . 4.650 4.251 3.956 4.642 . 0 0 "[ . 1 . 2]" 1
936 1 68 ILE HB 1 69 ARG H . . 4.620 4.024 3.973 4.058 . 0 0 "[ . 1 . 2]" 1
937 1 30 SER H 1 33 LYS QD . . 5.250 4.886 4.437 5.427 0.177 6 0 "[ . 1 . 2]" 1
938 1 56 LEU MD2 1 68 ILE HG12 . . 5.690 2.669 2.546 2.963 . 0 0 "[ . 1 . 2]" 1
939 1 68 ILE HG12 1 98 LEU MD2 . . 5.570 1.949 1.730 2.461 . 0 0 "[ . 1 . 2]" 1
940 1 68 ILE HG12 1 69 ARG HA . . 6.000 3.939 3.746 4.164 . 0 0 "[ . 1 . 2]" 1
941 1 65 TYR HA 1 68 ILE HG12 . . 6.000 5.522 5.286 5.771 . 0 0 "[ . 1 . 2]" 1
942 1 59 TYR QD 1 68 ILE HG12 . . 5.010 4.049 3.774 4.413 . 0 0 "[ . 1 . 2]" 1
943 1 68 ILE H 1 68 ILE HG12 . . 5.300 4.487 4.426 4.543 . 0 0 "[ . 1 . 2]" 1
944 1 68 ILE MG 1 71 LEU MD2 . . 5.330 4.646 4.325 4.847 . 0 0 "[ . 1 . 2]" 1
945 1 56 LEU MD2 1 68 ILE MG . . 4.480 4.328 4.212 4.500 0.020 19 0 "[ . 1 . 2]" 1
946 1 68 ILE MG 1 98 LEU MD2 . . 3.560 2.434 2.089 2.914 . 0 0 "[ . 1 . 2]" 1
947 1 56 LEU HA 1 68 ILE MG . . 6.000 5.534 5.350 5.752 . 0 0 "[ . 1 . 2]" 1
948 1 68 ILE MG 1 69 ARG HA . . 4.500 3.333 3.266 3.450 . 0 0 "[ . 1 . 2]" 1
949 1 65 TYR HA 1 68 ILE MG . . 3.910 1.992 1.802 2.226 . 0 0 "[ . 1 . 2]" 1
950 1 68 ILE MG 1 98 LEU HA . . 4.750 3.555 2.969 4.099 . 0 0 "[ . 1 . 2]" 1
951 1 59 TYR QD 1 68 ILE MG . . 4.730 3.782 3.510 4.302 . 0 0 "[ . 1 . 2]" 1
952 1 68 ILE MG 1 69 ARG H . . 4.120 2.235 2.171 2.295 . 0 0 "[ . 1 . 2]" 1
953 1 68 ILE MD 1 100 ALA MB . . 4.340 3.565 2.774 4.248 . 0 0 "[ . 1 . 2]" 1
954 1 56 LEU HB3 1 68 ILE MD . . 4.920 1.953 1.622 2.290 . 0 0 "[ . 1 . 2]" 1
955 1 68 ILE MD 1 99 HIS QB . . 5.580 4.431 3.444 5.508 . 0 0 "[ . 1 . 2]" 1
956 1 60 GLY HA2 1 68 ILE MD . . 4.300 2.890 2.632 3.152 . 0 0 "[ . 1 . 2]" 1
957 1 65 TYR HA 1 68 ILE MD . . 4.660 4.422 4.145 4.658 . 0 0 "[ . 1 . 2]" 1
958 1 60 GLY HA3 1 68 ILE MD . . 4.300 2.530 2.232 2.765 . 0 0 "[ . 1 . 2]" 1
959 1 65 TYR QD 1 68 ILE MD . . 5.200 4.609 4.270 5.008 . 0 0 "[ . 1 . 2]" 1
960 1 68 ILE H 1 68 ILE MD . . 4.990 4.451 4.433 4.469 . 0 0 "[ . 1 . 2]" 1
961 1 68 ILE MD 1 100 ALA H . . 5.540 4.311 3.620 5.125 . 0 0 "[ . 1 . 2]" 1
962 1 68 ILE MD 1 99 HIS H . . 5.670 3.103 2.270 4.460 . 0 0 "[ . 1 . 2]" 1
963 1 55 PHE HA 1 55 PHE QE . . 5.730 4.634 4.551 4.721 . 0 0 "[ . 1 . 2]" 1
964 1 55 PHE HA 1 58 GLU H . . 4.920 3.764 3.570 3.887 . 0 0 "[ . 1 . 2]" 1
965 1 69 ARG HA 1 73 SER H . . 5.550 4.236 3.918 4.493 . 0 0 "[ . 1 . 2]" 1
966 1 69 ARG HG2 1 98 LEU MD1 . . 4.520 3.349 1.456 4.074 . 0 0 "[ . 1 . 2]" 1
967 1 69 ARG HG3 1 98 LEU MD1 . . 4.520 2.509 1.876 3.910 . 0 0 "[ . 1 . 2]" 1
968 1 69 ARG H 1 69 ARG HG3 . . 4.780 4.238 2.521 4.544 . 0 0 "[ . 1 . 2]" 1
969 1 69 ARG HA 1 69 ARG HD2 . . 5.720 4.350 2.085 4.834 . 0 0 "[ . 1 . 2]" 1
970 1 69 ARG H 1 69 ARG HD2 . . 6.000 5.126 4.451 5.988 . 0 0 "[ . 1 . 2]" 1
971 1 69 ARG HA 1 69 ARG HD3 . . 5.720 4.540 3.282 4.721 . 0 0 "[ . 1 . 2]" 1
972 1 69 ARG H 1 69 ARG HD3 . . 6.000 4.991 4.397 5.990 . 0 0 "[ . 1 . 2]" 1
973 1 70 LYS HA 1 73 SER QB . . 4.090 2.632 2.006 3.752 . 0 0 "[ . 1 . 2]" 1
974 1 69 ARG H 1 70 LYS HA . . 5.650 5.331 5.235 5.421 . 0 0 "[ . 1 . 2]" 1
975 1 70 LYS H 1 70 LYS HG3 . . 4.800 3.692 2.733 4.368 . 0 0 "[ . 1 . 2]" 1
976 1 70 LYS HB2 1 70 LYS QE . . 4.600 2.992 1.895 4.226 . 0 0 "[ . 1 . 2]" 1
977 1 70 LYS HB3 1 70 LYS QE . . 4.600 3.397 1.957 4.436 . 0 0 "[ . 1 . 2]" 1
978 1 67 THR HA 1 70 LYS QE . . 5.470 4.094 2.701 5.522 0.052 4 0 "[ . 1 . 2]" 1
979 1 70 LYS H 1 70 LYS QE . . 5.890 4.177 3.214 5.012 . 0 0 "[ . 1 . 2]" 1
980 1 71 LEU H 1 71 LEU HG . . 5.050 4.396 4.319 4.436 . 0 0 "[ . 1 . 2]" 1
981 1 35 ILE MD 1 71 LEU MD1 . . 4.640 2.948 2.510 3.385 . 0 0 "[ . 1 . 2]" 1
982 1 71 LEU MD1 1 75 ILE MD . . 3.900 2.168 1.933 2.479 . 0 0 "[ . 1 . 2]" 1
983 1 31 ALA MB 1 71 LEU MD1 . . 3.450 1.913 1.500 2.050 . 0 0 "[ . 1 . 2]" 1
984 1 34 HIS QB 1 71 LEU MD1 . . 5.440 3.928 3.580 4.492 . 0 0 "[ . 1 . 2]" 1
985 1 71 LEU HA 1 71 LEU MD1 . . 3.750 2.253 2.173 2.341 . 0 0 "[ . 1 . 2]" 1
986 1 31 ALA HA 1 71 LEU MD1 . . 3.930 2.574 2.093 3.155 . 0 0 "[ . 1 . 2]" 1
987 1 59 TYR QD 1 71 LEU MD1 . . 6.000 4.332 3.916 4.711 . 0 0 "[ . 1 . 2]" 1
988 1 8 PHE QE 1 71 LEU MD1 . . 5.910 4.098 3.562 4.584 . 0 0 "[ . 1 . 2]" 1
989 1 31 ALA H 1 71 LEU MD1 . . 5.760 4.268 3.974 4.609 . 0 0 "[ . 1 . 2]" 1
990 1 71 LEU MD1 1 75 ILE H . . 6.000 4.042 3.587 4.520 . 0 0 "[ . 1 . 2]" 1
991 1 68 ILE MD 1 71 LEU MD2 . . 5.140 3.716 3.400 3.976 . 0 0 "[ . 1 . 2]" 1
992 1 68 ILE HG13 1 71 LEU MD2 . . 4.560 2.458 2.005 2.735 . 0 0 "[ . 1 . 2]" 1
993 1 59 TYR HB2 1 71 LEU MD2 . . 5.770 3.271 2.909 3.511 . 0 0 "[ . 1 . 2]" 1
994 1 59 TYR HB3 1 71 LEU MD2 . . 5.770 3.169 2.842 3.327 . 0 0 "[ . 1 . 2]" 1
995 1 34 HIS QB 1 71 LEU MD2 . . 5.980 4.010 3.700 4.547 . 0 0 "[ . 1 . 2]" 1
996 1 56 LEU HA 1 71 LEU MD2 . . 6.000 3.454 3.042 3.728 . 0 0 "[ . 1 . 2]" 1
997 1 68 ILE HA 1 71 LEU MD2 . . 4.900 2.864 2.560 3.138 . 0 0 "[ . 1 . 2]" 1
998 1 31 ALA HA 1 71 LEU MD2 . . 5.560 3.993 3.466 4.502 . 0 0 "[ . 1 . 2]" 1
999 1 55 PHE QD 1 71 LEU MD2 . . 5.810 3.290 2.867 3.604 . 0 0 "[ . 1 . 2]" 1
1000 1 4 PHE QE 1 75 ILE HA . . 5.590 3.930 3.538 4.368 . 0 0 "[ . 1 . 2]" 1
1001 1 4 PHE HZ 1 75 ILE HA . . 5.730 3.410 3.032 3.948 . 0 0 "[ . 1 . 2]" 1
1002 1 8 PHE QD 1 75 ILE HA . . 5.400 3.217 2.859 3.816 . 0 0 "[ . 1 . 2]" 1
1003 1 75 ILE HB 1 93 THR MG . . 5.450 3.775 3.329 4.281 . 0 0 "[ . 1 . 2]" 1
1004 1 4 PHE HZ 1 75 ILE HB . . 6.000 4.358 4.074 5.017 . 0 0 "[ . 1 . 2]" 1
1005 1 52 TYR QE 1 75 ILE HB . . 6.000 3.430 2.971 4.135 . 0 0 "[ . 1 . 2]" 1
1006 1 35 ILE MD 1 75 ILE MG . . 5.400 3.836 3.229 4.365 . 0 0 "[ . 1 . 2]" 1
1007 1 75 ILE MG 1 93 THR MG . . 3.810 2.961 2.351 3.749 . 0 0 "[ . 1 . 2]" 1
1008 1 75 ILE MG 1 78 ALA MB . . 4.730 3.438 3.222 3.746 . 0 0 "[ . 1 . 2]" 1
1009 1 75 ILE MG 1 76 ARG HA . . 5.950 3.443 3.179 3.709 . 0 0 "[ . 1 . 2]" 1
1010 1 75 ILE MG 1 93 THR HB . . 5.850 5.381 4.792 5.869 0.019 10 0 "[ . 1 . 2]" 1
1011 1 72 ASN HA 1 75 ILE MG . . 5.910 4.220 3.898 4.587 . 0 0 "[ . 1 . 2]" 1
1012 1 52 TYR HH 1 75 ILE MG . . 5.910 3.056 2.032 4.178 . 0 0 "[ . 1 . 2]" 1
1013 1 71 LEU MD2 1 75 ILE MD . . 4.370 3.060 2.717 3.508 . 0 0 "[ . 1 . 2]" 1
1014 1 35 ILE HG13 1 75 ILE MD . . 4.960 3.704 3.292 4.166 . 0 0 "[ . 1 . 2]" 1
1015 1 56 LEU MD2 1 75 ILE MD . . 4.830 3.226 2.739 4.171 . 0 0 "[ . 1 . 2]" 1
1016 1 56 LEU MD1 1 75 ILE MD . . 5.190 4.605 3.988 5.284 0.094 18 0 "[ . 1 . 2]" 1
1017 1 35 ILE HG12 1 75 ILE MD . . 4.960 3.170 2.878 3.533 . 0 0 "[ . 1 . 2]" 1
1018 1 35 ILE HA 1 75 ILE MD . . 6.000 5.097 4.782 5.448 . 0 0 "[ . 1 . 2]" 1
1019 1 71 LEU HA 1 75 ILE MD . . 5.360 4.462 4.230 4.748 . 0 0 "[ . 1 . 2]" 1
1020 1 4 PHE QE 1 75 ILE MD . . 5.420 3.049 2.765 3.451 . 0 0 "[ . 1 . 2]" 1
1021 1 55 PHE HZ 1 75 ILE MD . . 4.820 3.678 3.430 4.065 . 0 0 "[ . 1 . 2]" 1
1022 1 8 PHE HZ 1 75 ILE MD . . 5.900 5.036 4.356 5.480 . 0 0 "[ . 1 . 2]" 1
1023 1 75 ILE H 1 75 ILE MD . . 5.040 3.550 3.046 3.633 . 0 0 "[ . 1 . 2]" 1
1024 1 52 TYR HH 1 75 ILE MD . . 5.960 2.888 1.809 3.719 . 0 0 "[ . 1 . 2]" 1
1025 1 76 ARG HA 1 93 THR HG1 . . 5.230 4.131 2.826 5.251 0.021 2 0 "[ . 1 . 2]" 1
1026 1 76 ARG HA 1 91 ASN HD21 . . 5.940 4.693 3.030 5.750 . 0 0 "[ . 1 . 2]" 1
1027 1 49 ARG QB 1 92 PRO HA . . 5.010 2.885 1.701 4.578 . 0 0 "[ . 1 . 2]" 1
1028 1 73 SER HA 1 76 ARG QD . . 5.380 3.501 2.523 5.406 0.026 16 0 "[ . 1 . 2]" 1
1029 1 72 ASN HD21 1 76 ARG QD . . 5.670 4.647 3.112 5.714 0.044 19 0 "[ . 1 . 2]" 1
1030 1 72 ASN HD22 1 76 ARG QD . . 5.670 3.682 2.487 4.596 . 0 0 "[ . 1 . 2]" 1
1031 1 76 ARG QD 1 77 ASN H . . 6.000 4.723 4.104 5.207 . 0 0 "[ . 1 . 2]" 1
1032 1 76 ARG H 1 76 ARG QD . . 5.980 4.268 3.657 4.710 . 0 0 "[ . 1 . 2]" 1
1033 1 39 PHE HB3 1 40 ARG H . . 5.520 4.178 3.876 4.419 . 0 0 "[ . 1 . 2]" 1
1034 1 78 ALA HA 1 81 ASP HB3 . . 5.590 3.608 2.655 4.977 . 0 0 "[ . 1 . 2]" 1
1035 1 11 TRP HD1 1 78 ALA HA . . 6.000 3.992 3.650 4.363 . 0 0 "[ . 1 . 2]" 1
1036 1 75 ILE HA 1 78 ALA MB . . 4.040 2.558 2.332 2.732 . 0 0 "[ . 1 . 2]" 1
1037 1 78 ALA MB 1 79 PHE HA . . 5.640 3.853 3.788 3.928 . 0 0 "[ . 1 . 2]" 1
1038 1 7 TYR QD 1 78 ALA MB . . 4.670 3.170 2.809 3.610 . 0 0 "[ . 1 . 2]" 1
1039 1 11 TRP HZ3 1 78 ALA MB . . 5.140 3.567 3.083 4.013 . 0 0 "[ . 1 . 2]" 1
1040 1 75 ILE H 1 78 ALA MB . . 6.000 4.644 4.421 4.761 . 0 0 "[ . 1 . 2]" 1
1041 1 78 ALA MB 1 80 ASP H . . 6.000 4.388 4.255 4.508 . 0 0 "[ . 1 . 2]" 1
1042 1 78 ALA MB 1 79 PHE H . . 4.430 2.410 2.310 2.512 . 0 0 "[ . 1 . 2]" 1
1043 1 79 PHE HA 1 82 ALA MB . . 4.360 2.426 2.008 2.738 . 0 0 "[ . 1 . 2]" 1
1044 1 76 ARG HA 1 79 PHE HB2 . . 5.400 2.947 2.569 3.326 . 0 0 "[ . 1 . 2]" 1
1045 1 79 PHE HB2 1 91 ASN HD21 . . 5.970 3.868 2.092 4.958 . 0 0 "[ . 1 . 2]" 1
1046 1 76 ARG HA 1 79 PHE HB3 . . 5.400 4.522 4.147 4.905 . 0 0 "[ . 1 . 2]" 1
1047 1 79 PHE HB3 1 91 ASN HD21 . . 5.970 3.438 1.957 4.484 . 0 0 "[ . 1 . 2]" 1
1048 1 2 ILE MD 1 6 ASP HB3 . . 5.560 2.773 2.228 3.868 . 0 0 "[ . 1 . 2]" 1
1049 1 2 ILE HG13 1 6 ASP HB3 . . 5.870 3.631 2.393 5.171 . 0 0 "[ . 1 . 2]" 1
1050 1 2 ILE HG12 1 6 ASP HB3 . . 5.870 3.411 2.466 4.646 . 0 0 "[ . 1 . 2]" 1
1051 1 3 THR H 1 6 ASP HB3 . . 5.360 4.148 2.769 5.381 0.021 15 0 "[ . 1 . 2]" 1
1052 1 78 ALA HA 1 81 ASP HB2 . . 5.590 3.501 2.949 4.024 . 0 0 "[ . 1 . 2]" 1
1053 1 82 ALA MB 1 87 TYR QB . . 4.970 2.091 1.691 2.832 . 0 0 "[ . 1 . 2]" 1
1054 1 83 ILE HA 1 83 ILE MD . . 4.550 3.678 1.939 3.838 . 0 0 "[ . 1 . 2]" 1
1055 1 83 ILE HB 1 84 HIS H . . 4.870 3.692 2.541 4.028 . 0 0 "[ . 1 . 2]" 1
1056 1 83 ILE HB 1 85 GLU H . . 5.430 5.476 4.995 5.578 0.148 6 0 "[ . 1 . 2]" 1
1057 1 83 ILE MG 1 84 HIS HA . . 4.320 3.148 2.950 3.504 . 0 0 "[ . 1 . 2]" 1
1058 1 83 ILE MG 1 84 HIS H . . 5.270 2.472 2.201 3.582 . 0 0 "[ . 1 . 2]" 1
1059 1 81 ASP H 1 83 ILE MG . . 6.000 4.523 4.022 6.076 0.076 8 0 "[ . 1 . 2]" 1
1060 1 83 ILE MG 1 85 GLU H . . 6.000 4.391 4.194 5.129 . 0 0 "[ . 1 . 2]" 1
1061 1 83 ILE H 1 83 ILE MG . . 4.710 2.529 2.040 3.759 . 0 0 "[ . 1 . 2]" 1
1062 1 83 ILE MD 1 91 ASN HB2 . . 5.410 4.043 1.918 4.779 . 0 0 "[ . 1 . 2]" 1
1063 1 83 ILE MD 1 91 ASN HB3 . . 5.410 4.506 2.279 5.433 0.023 18 0 "[ . 1 . 2]" 1
1064 1 83 ILE H 1 83 ILE MD . . 5.370 4.245 3.529 4.447 . 0 0 "[ . 1 . 2]" 1
1065 1 85 GLU H 1 85 GLU HG2 . . 4.750 3.462 2.192 4.662 . 0 0 "[ . 1 . 2]" 1
1066 1 89 ILE HB 1 90 LYS H . . 5.280 3.440 1.693 4.593 . 0 0 "[ . 1 . 2]" 1
1067 1 89 ILE MG 1 90 LYS QG . . 4.350 3.169 1.841 4.454 0.104 16 0 "[ . 1 . 2]" 1
1068 1 47 ILE MG 1 92 PRO HB2 . . 5.520 2.875 2.346 3.835 . 0 0 "[ . 1 . 2]" 1
1069 1 47 ILE MG 1 92 PRO HB3 . . 5.520 2.799 2.279 3.560 . 0 0 "[ . 1 . 2]" 1
1070 1 93 THR HA 1 96 ALA MB . . 4.330 2.701 1.974 3.848 . 0 0 "[ . 1 . 2]" 1
1071 1 93 THR MG 1 96 ALA MB . . 4.770 3.163 1.983 4.465 . 0 0 "[ . 1 . 2]" 1
1072 1 76 ARG HB3 1 93 THR MG . . 5.810 3.771 1.551 4.350 . 0 0 "[ . 1 . 2]" 1
1073 1 76 ARG HB2 1 93 THR MG . . 5.810 3.141 1.931 4.713 . 0 0 "[ . 1 . 2]" 1
1074 1 76 ARG HA 1 93 THR MG . . 4.570 2.470 1.757 3.605 . 0 0 "[ . 1 . 2]" 1
1075 1 79 PHE QE 1 93 THR MG . . 5.890 4.301 3.042 5.240 . 0 0 "[ . 1 . 2]" 1
1076 1 76 ARG HE 1 93 THR MG . . 6.000 3.990 2.381 5.395 . 0 0 "[ . 1 . 2]" 1
1077 1 93 THR MG 1 94 TYR H . . 6.000 4.269 4.091 4.394 . 0 0 "[ . 1 . 2]" 1
1078 1 52 TYR HH 1 93 THR MG . . 6.000 3.145 2.344 4.057 . 0 0 "[ . 1 . 2]" 1
1079 1 50 THR MG 1 95 LYS HG3 . . 5.110 4.728 3.480 5.186 0.076 8 0 "[ . 1 . 2]" 1
1080 1 50 THR MG 1 95 LYS HG2 . . 5.110 4.833 4.038 5.227 0.117 5 0 "[ . 1 . 2]" 1
1081 1 95 LYS HA 1 95 LYS QD . . 4.860 3.032 1.789 4.593 . 0 0 "[ . 1 . 2]" 1
1082 1 95 LYS H 1 95 LYS QD . . 5.950 4.095 3.009 5.490 . 0 0 "[ . 1 . 2]" 1
1083 1 96 ALA HA 1 97 GLU QB . . 5.260 4.436 3.894 4.907 . 0 0 "[ . 1 . 2]" 1
1084 1 56 LEU MD1 1 96 ALA MB . . 3.560 2.198 1.744 2.941 . 0 0 "[ . 1 . 2]" 1
1085 1 93 THR HB 1 96 ALA MB . . 4.720 3.606 2.761 4.769 0.049 11 0 "[ . 1 . 2]" 1
1086 1 96 ALA MB 1 97 GLU HA . . 5.280 4.152 3.816 4.359 . 0 0 "[ . 1 . 2]" 1
1087 1 96 ALA H 1 96 ALA MB . . 3.660 2.350 2.223 2.686 . 0 0 "[ . 1 . 2]" 1
1088 1 96 ALA MB 1 97 GLU H . . 4.220 3.284 2.574 3.700 . 0 0 "[ . 1 . 2]" 1
1089 1 52 TYR HH 1 96 ALA MB . . 5.800 4.107 2.776 5.748 . 0 0 "[ . 1 . 2]" 1
1090 1 53 GLN HE22 1 97 GLU QB . . 5.680 3.648 1.995 5.438 . 0 0 "[ . 1 . 2]" 1
1091 1 96 ALA MB 1 97 GLU HG2 . . 6.000 5.396 4.704 6.039 0.039 10 0 "[ . 1 . 2]" 1
1092 1 97 GLU HG2 1 98 LEU H . . 5.860 4.344 2.464 5.308 . 0 0 "[ . 1 . 2]" 1
1093 1 97 GLU H 1 97 GLU HG2 . . 5.240 3.478 2.210 4.508 . 0 0 "[ . 1 . 2]" 1
1094 1 96 ALA MB 1 97 GLU HG3 . . 6.000 5.239 4.305 6.247 0.247 20 0 "[ . 1 . 2]" 1
1095 1 97 GLU HG3 1 98 LEU H . . 5.860 4.584 2.722 5.682 . 0 0 "[ . 1 . 2]" 1
1096 1 97 GLU H 1 97 GLU HG3 . . 5.240 3.028 1.703 4.911 . 0 0 "[ . 1 . 2]" 1
1097 1 56 LEU MD2 1 98 LEU HG . . 5.200 5.078 4.509 5.247 0.047 8 0 "[ . 1 . 2]" 1
1098 1 68 ILE MG 1 98 LEU HG . . 5.510 4.657 4.310 5.013 . 0 0 "[ . 1 . 2]" 1
1099 1 68 ILE HG12 1 98 LEU HG . . 5.930 4.820 4.566 5.124 . 0 0 "[ . 1 . 2]" 1
1100 1 65 TYR QD 1 98 LEU HG . . 6.000 5.923 5.528 6.087 0.087 17 0 "[ . 1 . 2]" 1
1101 1 68 ILE MD 1 98 LEU MD2 . . 4.210 2.552 2.274 3.203 . 0 0 "[ . 1 . 2]" 1
1102 1 96 ALA MB 1 98 LEU MD2 . . 6.000 3.799 3.008 5.168 . 0 0 "[ . 1 . 2]" 1
1103 1 72 ASN HB2 1 98 LEU MD2 . . 4.620 2.112 1.835 2.533 . 0 0 "[ . 1 . 2]" 1
1104 1 72 ASN HB3 1 98 LEU MD2 . . 4.620 2.637 2.178 3.187 . 0 0 "[ . 1 . 2]" 1
1105 1 69 ARG HA 1 98 LEU MD2 . . 4.190 2.607 1.765 3.411 . 0 0 "[ . 1 . 2]" 1
1106 1 72 ASN HD21 1 98 LEU MD2 . . 5.020 3.004 2.123 3.914 . 0 0 "[ . 1 . 2]" 1
1107 1 72 ASN HD22 1 98 LEU MD2 . . 5.020 3.798 3.295 4.300 . 0 0 "[ . 1 . 2]" 1
1108 1 69 ARG H 1 98 LEU MD2 . . 5.140 3.773 3.321 4.476 . 0 0 "[ . 1 . 2]" 1
1109 1 98 LEU MD2 1 99 HIS H . . 5.470 4.034 3.571 4.553 . 0 0 "[ . 1 . 2]" 1
1110 1 98 LEU HA 1 99 HIS QB . . 5.430 4.410 3.992 4.933 . 0 0 "[ . 1 . 2]" 1
1111 1 68 ILE MG 1 100 ALA MB . . 3.770 2.572 1.845 3.322 . 0 0 "[ . 1 . 2]" 1
1112 1 65 TYR HA 1 100 ALA MB . . 4.010 2.450 2.028 3.173 . 0 0 "[ . 1 . 2]" 1
1113 1 60 GLY H 1 100 ALA MB . . 6.000 5.347 4.536 6.013 0.013 13 0 "[ . 1 . 2]" 1
1114 1 66 GLU H 1 100 ALA MB . . 6.000 5.076 4.728 5.652 . 0 0 "[ . 1 . 2]" 1
1115 1 65 TYR H 1 100 ALA MB . . 4.920 3.331 2.948 3.844 . 0 0 "[ . 1 . 2]" 1
1116 1 61 LEU MD2 1 101 SER QB . . 4.370 1.868 1.633 2.342 . 0 0 "[ . 1 . 2]" 1
1117 1 61 LEU HA 1 101 SER QB . . 4.120 3.143 2.555 3.607 . 0 0 "[ . 1 . 2]" 1
1118 1 102 VAL HA 1 103 LEU HG . . 6.000 4.957 4.424 5.755 . 0 0 "[ . 1 . 2]" 1
1119 1 61 LEU HA 1 102 VAL HB . . 5.250 5.278 5.211 5.347 0.097 2 0 "[ . 1 . 2]" 1
1120 1 102 VAL HA 1 102 VAL MG1 . . 3.630 2.367 2.308 2.470 . 0 0 "[ . 1 . 2]" 1
1121 1 102 VAL MG1 1 103 LEU HA . . 4.780 3.823 3.527 4.099 . 0 0 "[ . 1 . 2]" 1
1122 1 64 SER HA 1 102 VAL MG1 . . 5.490 3.949 2.612 4.834 . 0 0 "[ . 1 . 2]" 1
1123 1 102 VAL H 1 102 VAL MG1 . . 4.560 3.812 3.753 3.961 . 0 0 "[ . 1 . 2]" 1
1124 1 102 VAL MG2 1 103 LEU HG . . 6.000 4.800 4.196 6.040 0.040 19 0 "[ . 1 . 2]" 1
1125 1 101 SER QB 1 102 VAL MG2 . . 5.010 3.842 3.385 4.395 . 0 0 "[ . 1 . 2]" 1
1126 1 102 VAL HA 1 102 VAL MG2 . . 3.700 2.443 2.357 2.520 . 0 0 "[ . 1 . 2]" 1
1127 1 64 SER HA 1 102 VAL MG2 . . 5.980 3.672 2.039 4.317 . 0 0 "[ . 1 . 2]" 1
1128 1 100 ALA HA 1 102 VAL MG2 . . 6.000 3.795 3.314 4.455 . 0 0 "[ . 1 . 2]" 1
1129 1 102 VAL MG2 1 103 LEU H . . 4.760 3.983 3.698 4.337 . 0 0 "[ . 1 . 2]" 1
1130 1 103 LEU HB3 1 104 GLU H . . 4.910 3.832 1.774 4.654 . 0 0 "[ . 1 . 2]" 1
1131 1 103 LEU H 1 103 LEU MD1 . . 5.510 3.567 2.223 4.431 . 0 0 "[ . 1 . 2]" 1
1132 1 103 LEU H 1 103 LEU MD2 . . 5.510 3.819 3.379 4.539 . 0 0 "[ . 1 . 2]" 1
1133 1 104 GLU QG 1 105 HIS H . . 6.000 3.807 2.349 4.762 . 0 0 "[ . 1 . 2]" 1
1134 1 84 HIS HB2 1 85 GLU H . . 4.640 3.540 2.431 4.038 . 0 0 "[ . 1 . 2]" 1
1135 1 84 HIS HB3 1 85 GLU H . . 4.640 3.104 2.575 3.773 . 0 0 "[ . 1 . 2]" 1
1136 1 5 ALA HA 1 8 PHE H . . 5.790 3.717 3.600 3.849 . 0 0 "[ . 1 . 2]" 1
1137 1 8 PHE HA 1 78 ALA MB . . 5.300 3.251 2.942 3.483 . 0 0 "[ . 1 . 2]" 1
1138 1 13 GLU QB 1 15 ASN H . . 6.000 4.668 4.531 4.924 . 0 0 "[ . 1 . 2]" 1
1139 1 14 VAL HA 1 17 LEU HB3 . . 5.840 4.845 4.450 5.389 . 0 0 "[ . 1 . 2]" 1
1140 1 32 TYR HA 1 36 LYS H . . 5.560 3.819 3.626 4.043 . 0 0 "[ . 1 . 2]" 1
1141 1 42 LYS HA 1 43 LEU MD1 . . 5.230 5.140 4.768 5.299 0.069 14 0 "[ . 1 . 2]" 1
1142 1 43 LEU MD1 1 45 LYS HG3 . . 4.920 3.505 3.090 3.992 . 0 0 "[ . 1 . 2]" 1
1143 1 54 LYS HA 1 57 ASN HB2 . . 4.670 2.711 2.213 4.711 0.041 11 0 "[ . 1 . 2]" 1
1144 1 39 PHE QE 1 47 ILE HA . . 6.000 3.770 3.086 4.251 . 0 0 "[ . 1 . 2]" 1
1145 1 2 ILE MG 1 44 LEU MD1 . . 5.250 3.522 2.261 4.342 . 0 0 "[ . 1 . 2]" 1
1146 1 89 ILE HB 1 90 LYS QG . . 5.590 4.443 2.955 5.487 . 0 0 "[ . 1 . 2]" 1
1147 1 90 LYS HA 1 90 LYS QD . . 4.920 3.274 1.789 4.532 . 0 0 "[ . 1 . 2]" 1
1148 1 87 TYR QB 1 88 VAL MG2 . . 6.000 3.932 2.354 5.105 . 0 0 "[ . 1 . 2]" 1
1149 1 79 PHE QD 1 88 VAL MG2 . . 5.340 2.666 1.864 3.650 . 0 0 "[ . 1 . 2]" 1
1150 1 87 TYR QB 1 88 VAL MG1 . . 6.000 3.555 2.581 4.991 . 0 0 "[ . 1 . 2]" 1
1151 1 79 PHE QE 1 88 VAL MG1 . . 5.690 3.613 2.452 4.268 . 0 0 "[ . 1 . 2]" 1
1152 1 68 ILE HB 1 100 ALA MB . . 5.090 4.205 3.497 5.070 . 0 0 "[ . 1 . 2]" 1
1153 1 62 THR HA 1 102 VAL MG1 . . 5.540 4.649 2.746 5.513 . 0 0 "[ . 1 . 2]" 1
1154 1 100 ALA MB 1 102 VAL MG2 . . 3.890 3.234 2.331 3.683 . 0 0 "[ . 1 . 2]" 1
1155 1 82 ALA MB 1 87 TYR H . . 5.790 3.743 3.388 4.080 . 0 0 "[ . 1 . 2]" 1
1156 1 89 ILE MG 1 90 LYS QE . . 6.000 4.655 2.110 6.025 0.025 7 0 "[ . 1 . 2]" 1
1157 1 2 ILE HA 1 2 ILE MD . . 4.400 3.420 1.933 3.810 . 0 0 "[ . 1 . 2]" 1
1158 1 2 ILE HA 1 3 THR MG . . 4.220 3.948 3.614 4.254 0.034 2 0 "[ . 1 . 2]" 1
1159 1 2 ILE HA 1 3 THR H . . 3.140 2.285 2.156 2.430 . 0 0 "[ . 1 . 2]" 1
1160 1 3 THR HA 1 43 LEU MD2 . . 3.890 2.642 2.331 3.050 . 0 0 "[ . 1 . 2]" 1
1161 1 3 THR HA 1 43 LEU HA . . 3.370 1.891 1.659 2.283 . 0 0 "[ . 1 . 2]" 1
1162 1 3 THR HA 1 44 LEU H . . 4.170 3.177 2.758 3.591 . 0 0 "[ . 1 . 2]" 1
1163 1 3 THR HA 1 5 ALA H . . 4.420 4.320 4.097 4.467 0.047 11 0 "[ . 1 . 2]" 1
1164 1 4 PHE HA 1 44 LEU HA . . 4.350 3.117 2.401 4.181 . 0 0 "[ . 1 . 2]" 1
1165 1 6 ASP HA 1 9 TYR H . . 4.330 3.599 3.229 3.882 . 0 0 "[ . 1 . 2]" 1
1166 1 14 VAL MG1 1 15 ASN HA . . 4.410 3.479 3.338 3.725 . 0 0 "[ . 1 . 2]" 1
1167 1 20 VAL HA 1 20 VAL MG1 . . 3.520 2.370 2.344 2.424 . 0 0 "[ . 1 . 2]" 1
1168 1 21 SER HA 1 22 GLU QB . . 4.710 4.600 4.199 4.816 0.106 10 0 "[ . 1 . 2]" 1
1169 1 20 VAL HB 1 21 SER HA . . 4.890 4.730 4.488 4.856 . 0 0 "[ . 1 . 2]" 1
1170 1 21 SER HA 1 22 GLU QG . . 5.450 4.490 3.734 5.628 0.178 16 0 "[ . 1 . 2]" 1
1171 1 21 SER HB2 1 22 GLU H . . 4.800 3.056 2.082 3.787 . 0 0 "[ . 1 . 2]" 1
1172 1 21 SER HB3 1 22 GLU H . . 4.800 2.766 2.120 3.796 . 0 0 "[ . 1 . 2]" 1
1173 1 20 VAL HB 1 24 THR HB . . 4.130 1.769 1.510 2.275 . 0 0 "[ . 1 . 2]" 1
1174 1 26 ARG HA 1 26 ARG QG . . 3.840 2.668 2.242 3.365 . 0 0 "[ . 1 . 2]" 1
1175 1 26 ARG HA 1 29 GLU QB . . 3.690 2.492 1.803 2.994 . 0 0 "[ . 1 . 2]" 1
1176 1 26 ARG HA 1 29 GLU HG3 . . 4.310 3.676 2.638 4.366 0.056 7 0 "[ . 1 . 2]" 1
1177 1 26 ARG HA 1 26 ARG QD . . 4.230 3.304 1.809 4.241 0.011 3 0 "[ . 1 . 2]" 1
1178 1 26 ARG HA 1 29 GLU H . . 4.240 3.409 2.837 3.824 . 0 0 "[ . 1 . 2]" 1
1179 1 30 SER HA 1 33 LYS HG3 . . 5.610 3.437 2.335 5.092 . 0 0 "[ . 1 . 2]" 1
1180 1 30 SER HA 1 33 LYS HG2 . . 5.610 2.901 1.750 5.308 . 0 0 "[ . 1 . 2]" 1
1181 1 30 SER HA 1 33 LYS QB . . 3.850 3.371 2.264 3.909 0.059 10 0 "[ . 1 . 2]" 1
1182 1 30 SER HA 1 33 LYS H . . 4.130 3.461 3.053 3.745 . 0 0 "[ . 1 . 2]" 1
1183 1 30 SER H 1 30 SER HB2 . . 3.780 2.575 2.393 3.598 . 0 0 "[ . 1 . 2]" 1
1184 1 30 SER H 1 30 SER HB3 . . 3.780 3.253 2.548 3.621 . 0 0 "[ . 1 . 2]" 1
1185 1 30 SER HB3 1 31 ALA H . . 4.200 3.352 2.382 4.116 . 0 0 "[ . 1 . 2]" 1
1186 1 34 HIS HA 1 37 ASP HB2 . . 4.100 3.150 2.586 3.906 . 0 0 "[ . 1 . 2]" 1
1187 1 34 HIS HA 1 37 ASP HB3 . . 4.100 2.451 2.159 2.897 . 0 0 "[ . 1 . 2]" 1
1188 1 37 ASP HA 1 40 ARG HG2 . . 5.060 3.815 2.903 5.098 0.038 3 0 "[ . 1 . 2]" 1
1189 1 37 ASP HA 1 40 ARG HG3 . . 5.060 4.208 3.461 5.159 0.099 5 0 "[ . 1 . 2]" 1
1190 1 36 LYS HA 1 37 ASP HA . . 4.810 4.769 4.670 4.845 0.035 10 0 "[ . 1 . 2]" 1
1191 1 39 PHE HA 1 42 LYS QD . . 4.370 3.607 2.493 4.387 0.017 7 0 "[ . 1 . 2]" 1
1192 1 39 PHE HA 1 42 LYS HG2 . . 5.200 4.258 3.297 5.236 0.036 12 0 "[ . 1 . 2]" 1
1193 1 39 PHE HA 1 40 ARG HB2 . . 4.920 4.746 4.555 4.907 . 0 0 "[ . 1 . 2]" 1
1194 1 3 THR MG 1 41 HIS HA . . 3.520 2.141 1.775 2.664 . 0 0 "[ . 1 . 2]" 1
1195 1 43 LEU HA 1 43 LEU MD2 . . 3.450 2.066 1.958 2.269 . 0 0 "[ . 1 . 2]" 1
1196 1 48 LYS HA 1 48 LYS HG3 . . 3.930 3.006 2.356 3.822 . 0 0 "[ . 1 . 2]" 1
1197 1 48 LYS HA 1 48 LYS HG2 . . 3.930 3.038 2.401 3.707 . 0 0 "[ . 1 . 2]" 1
1198 1 48 LYS HA 1 48 LYS QD . . 4.440 3.545 1.924 4.470 0.030 20 0 "[ . 1 . 2]" 1
1199 1 49 ARG HA 1 92 PRO HB3 . . 4.860 3.102 1.838 4.279 . 0 0 "[ . 1 . 2]" 1
1200 1 49 ARG HA 1 92 PRO HB2 . . 4.860 3.049 2.011 4.011 . 0 0 "[ . 1 . 2]" 1
1201 1 49 ARG HA 1 52 TYR HB2 . . 4.780 3.316 2.831 3.826 . 0 0 "[ . 1 . 2]" 1
1202 1 49 ARG HA 1 52 TYR HB3 . . 4.780 2.656 2.165 3.237 . 0 0 "[ . 1 . 2]" 1
1203 1 50 THR HA 1 50 THR MG . . 3.360 2.233 2.159 2.359 . 0 0 "[ . 1 . 2]" 1
1204 1 50 THR HA 1 53 GLN HB2 . . 4.100 3.202 2.656 3.754 . 0 0 "[ . 1 . 2]" 1
1205 1 50 THR HA 1 53 GLN HB3 . . 4.100 2.883 2.259 3.485 . 0 0 "[ . 1 . 2]" 1
1206 1 50 THR HA 1 54 LYS H . . 5.120 4.274 3.750 4.994 . 0 0 "[ . 1 . 2]" 1
1207 1 50 THR HA 1 53 GLN H . . 4.260 3.375 3.179 3.604 . 0 0 "[ . 1 . 2]" 1
1208 1 50 THR HB 1 51 GLU H . . 4.440 3.348 2.688 3.781 . 0 0 "[ . 1 . 2]" 1
1209 1 50 THR MG 1 51 GLU HA . . 5.400 5.131 3.721 5.472 0.072 5 0 "[ . 1 . 2]" 1
1210 1 51 GLU HA 1 54 LYS QD . . 4.140 2.931 1.587 4.245 0.105 1 0 "[ . 1 . 2]" 1
1211 1 51 GLU HA 1 54 LYS QB . . 3.490 2.802 2.262 3.638 0.148 9 0 "[ . 1 . 2]" 1
1212 1 51 GLU HA 1 51 GLU HG3 . . 3.940 3.294 2.422 3.901 . 0 0 "[ . 1 . 2]" 1
1213 1 51 GLU HA 1 51 GLU HG2 . . 3.940 3.250 2.497 3.797 . 0 0 "[ . 1 . 2]" 1
1214 1 51 GLU HA 1 54 LYS H . . 4.280 3.375 3.005 3.688 . 0 0 "[ . 1 . 2]" 1
1215 1 52 TYR HA 1 55 PHE HB2 . . 4.410 3.273 2.941 3.837 . 0 0 "[ . 1 . 2]" 1
1216 1 52 TYR HA 1 55 PHE HB3 . . 4.460 2.588 2.303 3.001 . 0 0 "[ . 1 . 2]" 1
1217 1 52 TYR HA 1 55 PHE QD . . 4.820 3.958 3.570 4.281 . 0 0 "[ . 1 . 2]" 1
1218 1 52 TYR HA 1 55 PHE H . . 4.720 3.330 3.152 3.536 . 0 0 "[ . 1 . 2]" 1
1219 1 57 ASN HA 1 60 GLY H . . 4.590 3.605 3.162 3.900 . 0 0 "[ . 1 . 2]" 1
1220 1 61 LEU HA 1 61 LEU MD2 . . 3.200 2.009 1.951 2.047 . 0 0 "[ . 1 . 2]" 1
1221 1 61 LEU HA 1 102 VAL MG2 . . 3.480 2.721 2.503 3.159 . 0 0 "[ . 1 . 2]" 1
1222 1 61 LEU HA 1 61 LEU MD1 . . 3.920 3.862 3.838 3.879 . 0 0 "[ . 1 . 2]" 1
1223 1 61 LEU HA 1 61 LEU HG . . 3.860 3.068 2.983 3.186 . 0 0 "[ . 1 . 2]" 1
1224 1 62 THR HA 1 102 VAL MG2 . . 4.100 3.446 2.497 4.051 . 0 0 "[ . 1 . 2]" 1
1225 1 62 THR HA 1 62 THR MG . . 3.120 2.309 2.230 3.199 0.079 2 0 "[ . 1 . 2]" 1
1226 1 63 HIS HA 1 102 VAL MG2 . . 4.710 3.911 3.383 4.718 0.008 14 0 "[ . 1 . 2]" 1
1227 1 63 HIS HA 1 63 HIS HE1 . . 5.400 5.376 5.220 5.460 0.060 4 0 "[ . 1 . 2]" 1
1228 1 63 HIS HA 1 64 SER H . . 3.530 2.412 2.258 2.765 . 0 0 "[ . 1 . 2]" 1
1229 1 64 SER HA 1 100 ALA MB . . 4.160 3.415 3.006 3.912 . 0 0 "[ . 1 . 2]" 1
1230 1 64 SER HA 1 102 VAL HB . . 4.590 3.568 2.076 4.534 . 0 0 "[ . 1 . 2]" 1
1231 1 64 SER HB2 1 65 TYR H . . 4.710 3.448 2.162 3.912 . 0 0 "[ . 1 . 2]" 1
1232 1 64 SER HB3 1 65 TYR H . . 4.710 2.899 2.053 3.651 . 0 0 "[ . 1 . 2]" 1
1233 1 63 HIS HB3 1 67 THR HB . . 4.590 2.145 1.903 2.695 . 0 0 "[ . 1 . 2]" 1
1234 1 63 HIS HB2 1 67 THR HB . . 4.590 3.325 2.936 3.776 . 0 0 "[ . 1 . 2]" 1
1235 1 67 THR H 1 67 THR HB . . 3.850 2.767 2.564 3.437 . 0 0 "[ . 1 . 2]" 1
1236 1 67 THR HB 1 68 ILE H . . 4.310 2.529 2.377 3.059 . 0 0 "[ . 1 . 2]" 1
1237 1 56 LEU MD2 1 72 ASN HA . . 4.470 3.336 2.934 3.704 . 0 0 "[ . 1 . 2]" 1
1238 1 56 LEU MD1 1 72 ASN HA . . 5.540 4.296 3.623 4.884 . 0 0 "[ . 1 . 2]" 1
1239 1 72 ASN HA 1 98 LEU MD2 . . 6.000 4.203 3.846 4.572 . 0 0 "[ . 1 . 2]" 1
1240 1 72 ASN HA 1 75 ILE MD . . 4.380 3.126 2.511 4.410 0.030 18 0 "[ . 1 . 2]" 1
1241 1 72 ASN HA 1 75 ILE HB . . 4.070 2.883 2.567 3.205 . 0 0 "[ . 1 . 2]" 1
1242 1 72 ASN HA 1 75 ILE H . . 4.690 3.610 3.432 3.791 . 0 0 "[ . 1 . 2]" 1
1243 1 52 TYR HH 1 72 ASN HA . . 3.760 2.436 1.937 3.128 . 0 0 "[ . 1 . 2]" 1
1244 1 74 TYR HA 1 77 ASN HB2 . . 4.430 3.372 2.647 3.981 . 0 0 "[ . 1 . 2]" 1
1245 1 74 TYR HA 1 77 ASN HB3 . . 4.430 3.542 2.866 4.464 0.034 17 0 "[ . 1 . 2]" 1
1246 1 74 TYR HA 1 77 ASN H . . 4.560 3.637 3.505 3.842 . 0 0 "[ . 1 . 2]" 1
1247 1 77 ASN HA 1 80 ASP HB2 . . 4.200 3.091 2.239 3.697 . 0 0 "[ . 1 . 2]" 1
1248 1 77 ASN HA 1 80 ASP HB3 . . 4.200 2.493 1.936 3.775 . 0 0 "[ . 1 . 2]" 1
1249 1 11 TRP HH2 1 77 ASN HA . . 5.640 5.442 5.065 5.662 0.022 10 0 "[ . 1 . 2]" 1
1250 1 77 ASN HA 1 77 ASN HD22 . . 4.630 3.673 3.245 4.449 . 0 0 "[ . 1 . 2]" 1
1251 1 77 ASN HA 1 77 ASN HD21 . . 4.630 2.517 1.658 4.178 . 0 0 "[ . 1 . 2]" 1
1252 1 77 ASN HA 1 80 ASP H . . 4.950 3.355 2.958 3.774 . 0 0 "[ . 1 . 2]" 1
1253 1 80 ASP HA 1 83 ILE MD . . 4.180 3.908 1.869 4.280 0.100 20 0 "[ . 1 . 2]" 1
1254 1 80 ASP HA 1 83 ILE MG . . 5.050 2.226 1.710 3.787 . 0 0 "[ . 1 . 2]" 1
1255 1 80 ASP HA 1 83 ILE HB . . 4.080 3.516 2.108 4.113 0.033 9 0 "[ . 1 . 2]" 1
1256 1 81 ASP HA 1 84 HIS HB2 . . 4.340 2.996 2.338 3.716 . 0 0 "[ . 1 . 2]" 1
1257 1 87 TYR HA 1 87 TYR QD . . 3.730 2.512 2.089 3.067 . 0 0 "[ . 1 . 2]" 1
1258 1 43 LEU HA 1 44 LEU H . . 3.180 2.323 2.249 2.473 . 0 0 "[ . 1 . 2]" 1
1259 1 97 GLU HA 1 98 LEU H . . 3.450 2.280 2.096 3.371 . 0 0 "[ . 1 . 2]" 1
1260 1 98 LEU HA 1 98 LEU MD2 . . 3.320 2.051 1.947 2.129 . 0 0 "[ . 1 . 2]" 1
1261 1 98 LEU HA 1 98 LEU MD1 . . 4.140 3.874 3.839 3.910 . 0 0 "[ . 1 . 2]" 1
1262 1 68 ILE MD 1 98 LEU HA . . 4.220 2.461 2.023 2.868 . 0 0 "[ . 1 . 2]" 1
1263 1 98 LEU HA 1 98 LEU HG . . 4.060 3.129 3.063 3.228 . 0 0 "[ . 1 . 2]" 1
1264 1 99 HIS HA 1 100 ALA H . . 3.440 2.267 2.136 2.521 . 0 0 "[ . 1 . 2]" 1
1265 1 68 ILE MD 1 100 ALA HA . . 4.740 3.938 3.397 4.294 . 0 0 "[ . 1 . 2]" 1
1266 1 100 ALA HA 1 101 SER QB . . 4.770 4.324 4.064 4.542 . 0 0 "[ . 1 . 2]" 1
1267 1 61 LEU MD2 1 101 SER HA . . 4.860 4.306 4.084 4.595 . 0 0 "[ . 1 . 2]" 1
1268 1 101 SER HA 1 102 VAL MG2 . . 5.350 4.597 3.938 4.874 . 0 0 "[ . 1 . 2]" 1
1269 1 101 SER HA 1 102 VAL H . . 3.510 3.113 2.251 3.560 0.050 11 0 "[ . 1 . 2]" 1
1270 1 103 LEU HA 1 103 LEU HG . . 3.990 3.092 2.460 3.674 . 0 0 "[ . 1 . 2]" 1
1271 1 103 LEU HA 1 104 GLU H . . 3.300 2.523 2.125 3.275 . 0 0 "[ . 1 . 2]" 1
1272 1 81 ASP HA 1 84 HIS HB3 . . 4.340 3.332 2.259 4.388 0.048 16 0 "[ . 1 . 2]" 1
1273 1 30 SER HA 1 33 LYS QD . . 4.400 2.875 2.010 4.303 . 0 0 "[ . 1 . 2]" 1
1274 1 90 LYS HA 1 90 LYS QG . . 3.880 2.749 2.265 3.355 . 0 0 "[ . 1 . 2]" 1
1275 1 83 ILE MD 1 90 LYS HA . . 5.010 3.233 1.631 5.038 0.028 1 0 "[ . 1 . 2]" 1
1276 1 4 PHE QD 1 35 ILE MG . . 3.750 2.286 2.073 2.460 . 0 0 "[ . 1 . 2]" 1
1277 1 4 PHE QD 1 47 ILE MD . . 3.790 2.774 2.432 3.252 . 0 0 "[ . 1 . 2]" 1
1278 1 39 PHE QE 1 47 ILE MD . . 3.960 3.156 2.341 3.867 . 0 0 "[ . 1 . 2]" 1
1279 1 39 PHE QE 1 42 LYS HG2 . . 4.210 3.801 2.816 4.314 0.104 3 0 "[ . 1 . 2]" 1
1280 1 39 PHE QE 1 55 PHE HB2 . . 4.380 2.973 2.037 3.532 . 0 0 "[ . 1 . 2]" 1
1281 1 4 PHE QD 1 35 ILE HA . . 5.260 4.733 4.494 5.273 0.013 15 0 "[ . 1 . 2]" 1
1282 1 35 ILE HA 1 39 PHE QE . . 5.530 3.897 3.359 4.573 . 0 0 "[ . 1 . 2]" 1
1283 1 4 PHE QD 1 44 LEU HA . . 4.140 3.240 2.498 3.954 . 0 0 "[ . 1 . 2]" 1
1284 1 4 PHE HA 1 4 PHE QD . . 3.310 2.230 2.102 2.422 . 0 0 "[ . 1 . 2]" 1
1285 1 4 PHE H 1 4 PHE QD . . 4.430 4.183 4.163 4.194 . 0 0 "[ . 1 . 2]" 1
1286 1 4 PHE QD 1 5 ALA H . . 4.660 3.948 3.621 4.117 . 0 0 "[ . 1 . 2]" 1
1287 1 4 PHE QE 1 35 ILE MD . . 4.520 2.675 2.181 3.084 . 0 0 "[ . 1 . 2]" 1
1288 1 4 PHE QE 1 35 ILE MG . . 4.020 2.595 2.375 2.831 . 0 0 "[ . 1 . 2]" 1
1289 1 4 PHE QE 1 75 ILE MG . . 3.890 2.788 2.305 3.365 . 0 0 "[ . 1 . 2]" 1
1290 1 4 PHE QE 1 7 TYR QB . . 5.560 4.764 4.540 5.121 . 0 0 "[ . 1 . 2]" 1
1291 1 4 PHE QE 1 5 ALA HA . . 6.000 5.129 4.742 5.367 . 0 0 "[ . 1 . 2]" 1
1292 1 4 PHE QE 1 44 LEU HA . . 6.000 5.159 4.555 5.715 . 0 0 "[ . 1 . 2]" 1
1293 1 4 PHE HZ 1 35 ILE MD . . 4.120 3.049 2.803 3.309 . 0 0 "[ . 1 . 2]" 1
1294 1 4 PHE HZ 1 35 ILE MG . . 4.430 4.098 3.856 4.372 . 0 0 "[ . 1 . 2]" 1
1295 1 4 PHE HZ 1 75 ILE MG . . 3.180 1.790 1.519 2.386 . 0 0 "[ . 1 . 2]" 1
1296 1 4 PHE HZ 1 79 PHE QE . . 4.490 3.076 2.712 3.416 . 0 0 "[ . 1 . 2]" 1
1297 1 2 ILE MG 1 7 TYR QD . . 3.830 2.141 1.536 3.184 . 0 0 "[ . 1 . 2]" 1
1298 1 2 ILE MD 1 7 TYR QD . . 4.390 2.945 1.925 4.402 0.012 11 0 "[ . 1 . 2]" 1
1299 1 7 TYR QD 1 8 PHE HA . . 4.470 3.263 2.930 3.623 . 0 0 "[ . 1 . 2]" 1
1300 1 7 TYR HA 1 7 TYR QD . . 3.510 2.797 2.587 2.940 . 0 0 "[ . 1 . 2]" 1
1301 1 7 TYR QD 1 87 TYR QE . . 3.900 3.553 2.935 3.982 0.082 13 0 "[ . 1 . 2]" 1
1302 1 7 TYR QD 1 8 PHE H . . 4.370 3.394 3.106 3.861 . 0 0 "[ . 1 . 2]" 1
1303 1 7 TYR QE 1 78 ALA MB . . 3.380 2.459 2.033 3.399 0.019 6 0 "[ . 1 . 2]" 1
1304 1 2 ILE MG 1 7 TYR QE . . 4.870 3.783 3.216 4.512 . 0 0 "[ . 1 . 2]" 1
1305 1 7 TYR QE 1 82 ALA MB . . 3.990 2.967 2.272 3.240 . 0 0 "[ . 1 . 2]" 1
1306 1 7 TYR QE 1 78 ALA HA . . 5.080 3.578 3.121 3.979 . 0 0 "[ . 1 . 2]" 1
1307 1 7 TYR QE 1 79 PHE HA . . 4.360 3.909 3.490 4.385 0.025 7 0 "[ . 1 . 2]" 1
1308 1 7 TYR QE 1 87 TYR QE . . 3.720 3.555 2.634 3.759 0.039 11 0 "[ . 1 . 2]" 1
1309 1 8 PHE QD 1 35 ILE MD . . 4.040 2.872 2.758 3.018 . 0 0 "[ . 1 . 2]" 1
1310 1 8 PHE QD 1 78 ALA MB . . 3.640 2.657 2.366 2.917 . 0 0 "[ . 1 . 2]" 1
1311 1 8 PHE QD 1 31 ALA MB . . 5.150 4.213 3.863 4.596 . 0 0 "[ . 1 . 2]" 1
1312 1 8 PHE QD 1 35 ILE HB . . 5.470 4.498 4.236 4.835 . 0 0 "[ . 1 . 2]" 1
1313 1 8 PHE HA 1 8 PHE QD . . 3.730 2.754 2.708 2.909 . 0 0 "[ . 1 . 2]" 1
1314 1 8 PHE QD 1 9 TYR HA . . 4.270 3.364 3.129 3.475 . 0 0 "[ . 1 . 2]" 1
1315 1 8 PHE QD 1 32 TYR HA . . 4.140 3.026 2.655 3.357 . 0 0 "[ . 1 . 2]" 1
1316 1 8 PHE QD 1 9 TYR QD . . 4.330 4.247 3.807 4.399 0.069 18 0 "[ . 1 . 2]" 1
1317 1 8 PHE QD 1 9 TYR H . . 4.330 3.401 3.219 3.523 . 0 0 "[ . 1 . 2]" 1
1318 1 8 PHE QE 1 78 ALA MB . . 4.200 3.322 3.010 3.725 . 0 0 "[ . 1 . 2]" 1
1319 1 8 PHE QE 1 75 ILE MG . . 4.950 4.414 3.949 4.982 0.032 18 0 "[ . 1 . 2]" 1
1320 1 8 PHE QE 1 75 ILE MD . . 5.230 4.283 2.871 4.591 . 0 0 "[ . 1 . 2]" 1
1321 1 8 PHE QE 1 31 ALA MB . . 3.690 2.546 2.237 3.075 . 0 0 "[ . 1 . 2]" 1
1322 1 8 PHE QE 1 74 TYR QB . . 4.350 2.272 1.887 2.557 . 0 0 "[ . 1 . 2]" 1
1323 1 8 PHE QE 1 75 ILE HA . . 3.710 2.803 2.438 3.477 . 0 0 "[ . 1 . 2]" 1
1324 1 8 PHE QE 1 11 TRP HZ3 . . 4.420 3.263 2.780 3.624 . 0 0 "[ . 1 . 2]" 1
1325 1 8 PHE QE 1 32 TYR H . . 4.710 3.035 2.707 3.612 . 0 0 "[ . 1 . 2]" 1
1326 1 8 PHE HZ 1 71 LEU MD1 . . 4.780 3.828 3.434 4.286 . 0 0 "[ . 1 . 2]" 1
1327 1 8 PHE HZ 1 31 ALA MB . . 3.690 2.763 2.451 3.324 . 0 0 "[ . 1 . 2]" 1
1328 1 8 PHE HZ 1 74 TYR QB . . 3.940 2.406 2.088 2.767 . 0 0 "[ . 1 . 2]" 1
1329 1 8 PHE HZ 1 28 TYR QD . . 4.040 2.799 2.458 3.106 . 0 0 "[ . 1 . 2]" 1
1330 1 9 TYR QD 1 10 GLN QB . . 4.630 4.102 3.785 4.448 . 0 0 "[ . 1 . 2]" 1
1331 1 9 TYR QD 1 32 TYR HB2 . . 4.240 3.197 2.468 3.842 . 0 0 "[ . 1 . 2]" 1
1332 1 9 TYR QD 1 32 TYR HB3 . . 4.240 3.672 3.116 3.994 . 0 0 "[ . 1 . 2]" 1
1333 1 9 TYR HA 1 9 TYR QD . . 3.380 2.833 2.555 3.017 . 0 0 "[ . 1 . 2]" 1
1334 1 9 TYR QD 1 32 TYR QE . . 4.110 3.848 3.422 4.080 . 0 0 "[ . 1 . 2]" 1
1335 1 9 TYR QD 1 32 TYR QD . . 3.700 3.260 3.022 3.403 . 0 0 "[ . 1 . 2]" 1
1336 1 9 TYR QD 1 10 GLN H . . 4.150 3.611 3.425 3.807 . 0 0 "[ . 1 . 2]" 1
1337 1 9 TYR H 1 9 TYR QD . . 4.370 4.200 4.174 4.225 . 0 0 "[ . 1 . 2]" 1
1338 1 9 TYR QD 1 13 GLU H . . 5.050 4.563 4.216 4.879 . 0 0 "[ . 1 . 2]" 1
1339 1 9 TYR QE 1 13 GLU QB . . 4.730 3.388 2.918 4.215 . 0 0 "[ . 1 . 2]" 1
1340 1 9 TYR QE 1 13 GLU HG3 . . 5.240 4.067 2.475 5.059 . 0 0 "[ . 1 . 2]" 1
1341 1 9 TYR QE 1 13 GLU HG2 . . 5.240 4.865 3.444 5.290 0.050 1 0 "[ . 1 . 2]" 1
1342 1 9 TYR QE 1 29 GLU HG2 . . 4.620 3.387 1.668 4.532 . 0 0 "[ . 1 . 2]" 1
1343 1 9 TYR HA 1 9 TYR QE . . 4.850 4.570 4.498 4.621 . 0 0 "[ . 1 . 2]" 1
1344 1 9 TYR QE 1 10 GLN HA . . 4.870 4.879 4.680 4.981 0.111 11 0 "[ . 1 . 2]" 1
1345 1 9 TYR QE 1 29 GLU HA . . 4.760 4.220 3.434 4.802 0.042 4 0 "[ . 1 . 2]" 1
1346 1 9 TYR QE 1 12 TYR QD . . 4.330 3.916 3.236 4.331 0.001 10 0 "[ . 1 . 2]" 1
1347 1 9 TYR QE 1 32 TYR QD . . 4.160 4.072 3.589 4.218 0.058 16 0 "[ . 1 . 2]" 1
1348 1 11 TRP HZ3 1 74 TYR QB . . 4.770 2.666 2.316 3.061 . 0 0 "[ . 1 . 2]" 1
1349 1 11 TRP HZ3 1 28 TYR QE . . 3.960 1.883 1.526 2.299 . 0 0 "[ . 1 . 2]" 1
1350 1 8 PHE HZ 1 11 TRP HZ3 . . 4.990 3.884 3.442 4.324 . 0 0 "[ . 1 . 2]" 1
1351 1 11 TRP HE3 1 78 ALA MB . . 4.350 3.260 3.047 3.540 . 0 0 "[ . 1 . 2]" 1
1352 1 11 TRP HE3 1 12 TYR HB2 . . 3.860 2.958 2.642 3.131 . 0 0 "[ . 1 . 2]" 1
1353 1 11 TRP HE3 1 12 TYR HB3 . . 4.590 3.939 3.598 4.334 . 0 0 "[ . 1 . 2]" 1
1354 1 11 TRP HE3 1 12 TYR HA . . 4.220 3.463 3.188 3.865 . 0 0 "[ . 1 . 2]" 1
1355 1 8 PHE HA 1 11 TRP HE3 . . 4.320 3.330 2.809 3.820 . 0 0 "[ . 1 . 2]" 1
1356 1 11 TRP HE3 1 12 TYR H . . 4.230 2.812 2.532 3.266 . 0 0 "[ . 1 . 2]" 1
1357 1 11 TRP HZ2 1 78 ALA MB . . 4.400 4.268 3.995 4.456 0.056 19 0 "[ . 1 . 2]" 1
1358 1 11 TRP HZ2 1 78 ALA HA . . 4.260 3.725 3.303 4.219 . 0 0 "[ . 1 . 2]" 1
1359 1 11 TRP HZ2 1 16 LYS HE2 . . 4.870 3.184 2.517 4.104 . 0 0 "[ . 1 . 2]" 1
1360 1 11 TRP HZ2 1 16 LYS HE3 . . 4.870 3.106 2.268 4.303 . 0 0 "[ . 1 . 2]" 1
1361 1 11 TRP HZ2 1 77 ASN HB2 . . 4.060 3.645 2.603 4.124 0.064 14 0 "[ . 1 . 2]" 1
1362 1 11 TRP HZ2 1 77 ASN HB3 . . 4.060 2.411 1.796 2.850 . 0 0 "[ . 1 . 2]" 1
1363 1 11 TRP HD1 1 81 ASP HB2 . . 4.640 3.957 3.074 4.673 0.033 12 0 "[ . 1 . 2]" 1
1364 1 11 TRP HD1 1 81 ASP HB3 . . 4.640 3.623 3.022 4.018 . 0 0 "[ . 1 . 2]" 1
1365 1 11 TRP HA 1 11 TRP HD1 . . 3.870 3.068 2.951 3.196 . 0 0 "[ . 1 . 2]" 1
1366 1 7 TYR QE 1 11 TRP HD1 . . 4.740 4.400 3.865 4.751 0.011 10 0 "[ . 1 . 2]" 1
1367 1 11 TRP HD1 1 15 ASN HD21 . . 4.090 3.205 2.323 3.945 . 0 0 "[ . 1 . 2]" 1
1368 1 11 TRP HD1 1 15 ASN HD22 . . 4.090 3.530 2.756 4.096 0.006 2 0 "[ . 1 . 2]" 1
1369 1 11 TRP HH2 1 78 ALA MB . . 4.300 4.060 3.481 4.321 0.021 8 0 "[ . 1 . 2]" 1
1370 1 11 TRP HH2 1 16 LYS HE2 . . 4.610 4.023 3.079 4.685 0.075 20 0 "[ . 1 . 2]" 1
1371 1 11 TRP HH2 1 16 LYS HE3 . . 4.610 3.198 2.604 3.762 . 0 0 "[ . 1 . 2]" 1
1372 1 11 TRP HH2 1 77 ASN HB2 . . 4.330 3.505 2.504 4.352 0.022 7 0 "[ . 1 . 2]" 1
1373 1 11 TRP HH2 1 77 ASN HB3 . . 4.330 2.749 2.096 3.569 . 0 0 "[ . 1 . 2]" 1
1374 1 11 TRP HH2 1 74 TYR QB . . 4.560 3.518 2.852 4.080 . 0 0 "[ . 1 . 2]" 1
1375 1 11 TRP HH2 1 74 TYR HA . . 4.340 2.793 2.421 3.155 . 0 0 "[ . 1 . 2]" 1
1376 1 11 TRP HH2 1 28 TYR QE . . 3.830 3.192 2.591 3.828 . 0 0 "[ . 1 . 2]" 1
1377 1 11 TRP HH2 1 78 ALA H . . 4.670 4.059 3.603 4.406 . 0 0 "[ . 1 . 2]" 1
1378 1 12 TYR QD 1 17 LEU MD1 . . 5.470 3.753 3.282 4.788 . 0 0 "[ . 1 . 2]" 1
1379 1 12 TYR QD 1 16 LYS HB3 . . 4.130 3.288 2.680 3.854 . 0 0 "[ . 1 . 2]" 1
1380 1 12 TYR QD 1 16 LYS HB2 . . 4.130 1.824 1.586 2.209 . 0 0 "[ . 1 . 2]" 1
1381 1 12 TYR QD 1 13 GLU QB . . 4.330 3.681 3.203 4.368 0.038 14 0 "[ . 1 . 2]" 1
1382 1 12 TYR QD 1 24 THR MG . . 5.050 5.087 4.875 5.200 0.150 7 0 "[ . 1 . 2]" 1
1383 1 12 TYR HA 1 12 TYR QD . . 3.610 2.549 2.286 2.764 . 0 0 "[ . 1 . 2]" 1
1384 1 9 TYR HA 1 12 TYR QD . . 4.290 3.440 3.008 3.894 . 0 0 "[ . 1 . 2]" 1
1385 1 12 TYR QD 1 28 TYR QD . . 4.390 3.499 3.290 3.647 . 0 0 "[ . 1 . 2]" 1
1386 1 12 TYR QD 1 15 ASN H . . 5.050 5.008 4.756 5.151 0.101 20 0 "[ . 1 . 2]" 1
1387 1 12 TYR H 1 12 TYR QD . . 4.210 4.132 4.048 4.186 . 0 0 "[ . 1 . 2]" 1
1388 1 12 TYR QD 1 13 GLU H . . 4.240 3.353 3.164 3.573 . 0 0 "[ . 1 . 2]" 1
1389 1 12 TYR QE 1 17 LEU HB2 . . 5.050 4.341 3.958 5.059 0.009 20 0 "[ . 1 . 2]" 1
1390 1 12 TYR QE 1 17 LEU MD1 . . 4.130 2.792 2.368 3.655 . 0 0 "[ . 1 . 2]" 1
1391 1 12 TYR QE 1 16 LYS HB3 . . 4.230 3.044 2.545 3.445 . 0 0 "[ . 1 . 2]" 1
1392 1 12 TYR QE 1 16 LYS HB2 . . 4.230 2.599 2.139 3.141 . 0 0 "[ . 1 . 2]" 1
1393 1 12 TYR QE 1 24 THR MG . . 4.070 3.856 3.238 4.149 0.079 19 0 "[ . 1 . 2]" 1
1394 1 12 TYR QE 1 28 TYR HB3 . . 4.030 3.852 3.423 4.037 0.007 6 0 "[ . 1 . 2]" 1
1395 1 12 TYR QE 1 28 TYR HB2 . . 4.030 3.534 3.151 3.818 . 0 0 "[ . 1 . 2]" 1
1396 1 12 TYR HA 1 12 TYR QE . . 4.820 4.692 4.513 4.848 0.028 4 0 "[ . 1 . 2]" 1
1397 1 12 TYR QE 1 17 LEU HA . . 4.560 3.292 2.968 4.134 . 0 0 "[ . 1 . 2]" 1
1398 1 12 TYR QE 1 25 LYS HA . . 3.880 3.387 2.598 3.895 0.015 14 0 "[ . 1 . 2]" 1
1399 1 9 TYR QE 1 12 TYR QE . . 4.750 4.109 2.923 4.764 0.014 14 0 "[ . 1 . 2]" 1
1400 1 12 TYR QE 1 28 TYR QD . . 3.860 3.363 3.153 3.592 . 0 0 "[ . 1 . 2]" 1
1401 1 12 TYR QE 1 17 LEU H . . 5.210 4.310 3.936 5.296 0.086 20 0 "[ . 1 . 2]" 1
1402 1 18 PRO HB2 1 19 HIS HD2 . . 4.990 4.717 4.291 5.003 0.013 2 0 "[ . 1 . 2]" 1
1403 1 19 HIS HD2 1 20 VAL MG1 . . 4.690 4.665 4.350 4.771 0.081 11 0 "[ . 1 . 2]" 1
1404 1 18 PRO HD2 1 19 HIS HD2 . . 4.010 2.400 1.798 3.370 . 0 0 "[ . 1 . 2]" 1
1405 1 19 HIS HB3 1 19 HIS HD2 . . 3.830 3.816 3.770 3.860 0.030 17 0 "[ . 1 . 2]" 1
1406 1 19 HIS HB2 1 19 HIS HD2 . . 3.830 2.701 2.671 2.745 . 0 0 "[ . 1 . 2]" 1
1407 1 18 PRO HD3 1 19 HIS HD2 . . 5.000 4.067 3.460 4.983 . 0 0 "[ . 1 . 2]" 1
1408 1 16 LYS HA 1 19 HIS HD2 . . 3.590 2.595 2.006 3.227 . 0 0 "[ . 1 . 2]" 1
1409 1 24 THR MG 1 27 HIS HD2 . . 4.050 3.855 2.941 4.088 0.038 2 0 "[ . 1 . 2]" 1
1410 1 24 THR HA 1 27 HIS HD2 . . 3.260 2.227 1.408 2.584 . 0 0 "[ . 1 . 2]" 1
1411 1 27 HIS H 1 27 HIS HD2 . . 4.190 2.870 2.353 3.249 . 0 0 "[ . 1 . 2]" 1
1412 1 27 HIS HE1 1 67 THR MG . . 3.800 3.358 2.647 3.832 0.032 13 0 "[ . 1 . 2]" 1
1413 1 27 HIS HE1 1 70 LYS QE . . 4.670 3.883 2.762 4.694 0.024 13 0 "[ . 1 . 2]" 1
1414 1 27 HIS HE1 1 67 THR HA . . 4.660 3.871 2.862 4.701 0.041 20 0 "[ . 1 . 2]" 1
1415 1 20 VAL MG2 1 28 TYR QD . . 4.550 3.601 3.098 4.424 . 0 0 "[ . 1 . 2]" 1
1416 1 24 THR MG 1 28 TYR QD . . 3.360 2.308 1.844 2.593 . 0 0 "[ . 1 . 2]" 1
1417 1 12 TYR HB2 1 28 TYR QD . . 4.420 2.845 2.607 3.139 . 0 0 "[ . 1 . 2]" 1
1418 1 28 TYR HA 1 28 TYR QD . . 3.510 2.909 2.762 3.090 . 0 0 "[ . 1 . 2]" 1
1419 1 8 PHE QE 1 28 TYR QD . . 4.040 2.924 2.498 3.442 . 0 0 "[ . 1 . 2]" 1
1420 1 28 TYR H 1 28 TYR QD . . 3.620 2.523 2.187 3.025 . 0 0 "[ . 1 . 2]" 1
1421 1 28 TYR QE 1 78 ALA MB . . 5.520 5.130 4.601 5.552 0.032 1 0 "[ . 1 . 2]" 1
1422 1 20 VAL MG2 1 28 TYR QE . . 4.320 3.677 2.306 4.361 0.041 20 0 "[ . 1 . 2]" 1
1423 1 16 LYS HB3 1 28 TYR QE . . 4.520 3.884 3.462 4.532 0.012 20 0 "[ . 1 . 2]" 1
1424 1 16 LYS HB2 1 28 TYR QE . . 4.520 4.006 3.684 4.338 . 0 0 "[ . 1 . 2]" 1
1425 1 24 THR MG 1 28 TYR QE . . 2.890 2.038 1.579 2.742 . 0 0 "[ . 1 . 2]" 1
1426 1 12 TYR HB2 1 28 TYR QE . . 5.350 3.396 2.911 4.223 . 0 0 "[ . 1 . 2]" 1
1427 1 12 TYR HA 1 28 TYR QE . . 5.210 4.281 3.944 4.760 . 0 0 "[ . 1 . 2]" 1
1428 1 28 TYR QE 1 74 TYR QB . . 3.830 2.664 2.399 3.146 . 0 0 "[ . 1 . 2]" 1
1429 1 28 TYR HA 1 28 TYR QE . . 4.760 4.538 4.406 4.636 . 0 0 "[ . 1 . 2]" 1
1430 1 11 TRP HE3 1 28 TYR QE . . 4.440 3.832 3.393 4.446 0.006 20 0 "[ . 1 . 2]" 1
1431 1 8 PHE QE 1 28 TYR QE . . 4.520 3.972 3.406 4.447 . 0 0 "[ . 1 . 2]" 1
1432 1 8 PHE HZ 1 28 TYR QE . . 4.730 3.678 3.142 4.202 . 0 0 "[ . 1 . 2]" 1
1433 1 32 TYR QD 1 35 ILE MD . . 4.440 3.712 3.331 4.127 . 0 0 "[ . 1 . 2]" 1
1434 1 5 ALA MB 1 32 TYR QD . . 4.190 3.547 3.137 4.085 . 0 0 "[ . 1 . 2]" 1
1435 1 32 TYR QD 1 35 ILE HB . . 4.240 3.562 3.203 3.891 . 0 0 "[ . 1 . 2]" 1
1436 1 9 TYR QB 1 32 TYR QD . . 3.630 2.922 2.564 3.180 . 0 0 "[ . 1 . 2]" 1
1437 1 8 PHE HB3 1 32 TYR QD . . 4.140 3.031 2.790 3.324 . 0 0 "[ . 1 . 2]" 1
1438 1 5 ALA HA 1 32 TYR QD . . 3.990 3.419 3.155 3.705 . 0 0 "[ . 1 . 2]" 1
1439 1 32 TYR HA 1 32 TYR QD . . 3.090 2.511 2.288 2.714 . 0 0 "[ . 1 . 2]" 1
1440 1 8 PHE QD 1 32 TYR QD . . 3.060 2.645 2.156 2.906 . 0 0 "[ . 1 . 2]" 1
1441 1 32 TYR QD 1 33 LYS H . . 4.030 3.687 3.427 3.958 . 0 0 "[ . 1 . 2]" 1
1442 1 9 TYR H 1 32 TYR QD . . 4.330 3.554 3.189 3.850 . 0 0 "[ . 1 . 2]" 1
1443 1 32 TYR QD 1 36 LYS H . . 4.640 4.352 3.868 4.640 0.000 6 0 "[ . 1 . 2]" 1
1444 1 5 ALA MB 1 32 TYR QE . . 3.070 2.527 2.018 3.006 . 0 0 "[ . 1 . 2]" 1
1445 1 52 TYR QE 1 96 ALA MB . . 3.350 2.222 1.437 3.005 . 0 0 "[ . 1 . 2]" 1
1446 1 9 TYR QB 1 32 TYR QE . . 3.410 2.802 2.425 3.119 . 0 0 "[ . 1 . 2]" 1
1447 1 5 ALA HA 1 32 TYR QE . . 4.010 3.466 2.939 3.996 . 0 0 "[ . 1 . 2]" 1
1448 1 6 ASP HA 1 32 TYR QE . . 4.210 3.103 2.426 3.769 . 0 0 "[ . 1 . 2]" 1
1449 1 6 ASP H 1 32 TYR QE . . 4.700 4.075 3.821 4.547 . 0 0 "[ . 1 . 2]" 1
1450 1 9 TYR H 1 32 TYR QE . . 3.980 3.690 3.246 3.989 0.009 11 0 "[ . 1 . 2]" 1
1451 1 34 HIS QB 1 34 HIS HD2 . . 3.610 2.676 2.606 2.832 . 0 0 "[ . 1 . 2]" 1
1452 1 31 ALA HA 1 34 HIS HD2 . . 4.110 3.539 2.597 4.036 . 0 0 "[ . 1 . 2]" 1
1453 1 30 SER HA 1 34 HIS HD2 . . 4.750 3.822 3.147 4.681 . 0 0 "[ . 1 . 2]" 1
1454 1 34 HIS HA 1 34 HIS HD2 . . 5.100 4.198 3.600 4.436 . 0 0 "[ . 1 . 2]" 1
1455 1 34 HIS HD2 1 59 TYR QE . . 4.140 2.428 2.158 3.053 . 0 0 "[ . 1 . 2]" 1
1456 1 34 HIS H 1 34 HIS HD2 . . 4.100 3.084 2.597 3.519 . 0 0 "[ . 1 . 2]" 1
1457 1 35 ILE MG 1 39 PHE QD . . 3.460 2.155 1.669 2.833 . 0 0 "[ . 1 . 2]" 1
1458 1 39 PHE QD 1 47 ILE MD . . 3.490 2.817 2.342 3.257 . 0 0 "[ . 1 . 2]" 1
1459 1 39 PHE QD 1 42 LYS HG3 . . 5.220 3.845 3.167 4.374 . 0 0 "[ . 1 . 2]" 1
1460 1 39 PHE QD 1 42 LYS QD . . 3.500 2.565 1.274 3.536 0.036 2 0 "[ . 1 . 2]" 1
1461 1 39 PHE QD 1 42 LYS HB3 . . 4.370 2.925 2.212 3.533 . 0 0 "[ . 1 . 2]" 1
1462 1 39 PHE QD 1 42 LYS HG2 . . 4.570 2.413 1.499 3.177 . 0 0 "[ . 1 . 2]" 1
1463 1 39 PHE QD 1 42 LYS HB2 . . 4.370 2.948 2.423 3.446 . 0 0 "[ . 1 . 2]" 1
1464 1 35 ILE HA 1 39 PHE QD . . 3.300 2.648 2.200 3.127 . 0 0 "[ . 1 . 2]" 1
1465 1 39 PHE HA 1 39 PHE QD . . 3.420 2.596 2.291 2.776 . 0 0 "[ . 1 . 2]" 1
1466 1 4 PHE QE 1 39 PHE QD . . 4.440 3.456 2.805 4.455 0.015 20 0 "[ . 1 . 2]" 1
1467 1 39 PHE H 1 39 PHE QD . . 3.660 2.990 2.726 3.251 . 0 0 "[ . 1 . 2]" 1
1468 1 4 PHE QD 1 7 TYR QB . . 3.990 3.291 2.989 3.955 . 0 0 "[ . 1 . 2]" 1
1469 1 4 PHE QD 1 39 PHE HB2 . . 4.120 3.026 2.217 3.847 . 0 0 "[ . 1 . 2]" 1
1470 1 4 PHE QD 1 39 PHE HB3 . . 4.120 3.508 2.762 4.139 0.019 15 0 "[ . 1 . 2]" 1
1471 1 39 PHE QE 1 52 TYR HA . . 4.280 3.689 3.303 4.145 . 0 0 "[ . 1 . 2]" 1
1472 1 39 PHE HZ 1 47 ILE MG . . 4.270 3.153 2.606 3.571 . 0 0 "[ . 1 . 2]" 1
1473 1 39 PHE HZ 1 47 ILE MD . . 4.710 3.977 3.620 4.776 0.066 18 0 "[ . 1 . 2]" 1
1474 1 39 PHE HZ 1 55 PHE HB2 . . 3.810 2.981 2.500 3.831 0.021 3 0 "[ . 1 . 2]" 1
1475 1 39 PHE HZ 1 52 TYR HA . . 3.610 2.662 2.104 3.321 . 0 0 "[ . 1 . 2]" 1
1476 1 3 THR MG 1 41 HIS HD2 . . 4.490 3.632 2.402 4.659 0.169 12 0 "[ . 1 . 2]" 1
1477 1 40 ARG HB3 1 41 HIS HD2 . . 4.830 4.249 2.465 4.878 0.048 5 0 "[ . 1 . 2]" 1
1478 1 41 HIS HA 1 41 HIS HD2 . . 4.170 2.734 2.041 4.000 . 0 0 "[ . 1 . 2]" 1
1479 1 47 ILE MG 1 52 TYR QD . . 4.340 3.340 2.551 3.920 . 0 0 "[ . 1 . 2]" 1
1480 1 52 TYR QD 1 93 THR MG . . 4.730 3.644 3.248 4.271 . 0 0 "[ . 1 . 2]" 1
1481 1 52 TYR QD 1 56 LEU MD1 . . 4.030 3.293 2.912 3.797 . 0 0 "[ . 1 . 2]" 1
1482 1 52 TYR QD 1 75 ILE MG . . 4.410 3.565 3.250 4.221 . 0 0 "[ . 1 . 2]" 1
1483 1 52 TYR QD 1 75 ILE MD . . 4.770 3.503 3.239 4.150 . 0 0 "[ . 1 . 2]" 1
1484 1 52 TYR QD 1 96 ALA MB . . 3.540 2.766 1.933 3.571 0.031 20 0 "[ . 1 . 2]" 1
1485 1 52 TYR QD 1 93 THR HA . . 3.540 2.829 2.250 3.310 . 0 0 "[ . 1 . 2]" 1
1486 1 52 TYR HA 1 52 TYR QD . . 3.330 2.331 1.994 2.590 . 0 0 "[ . 1 . 2]" 1
1487 1 52 TYR H 1 52 TYR QD . . 4.540 4.173 4.118 4.196 . 0 0 "[ . 1 . 2]" 1
1488 1 52 TYR QD 1 53 GLN H . . 4.460 3.937 3.608 4.226 . 0 0 "[ . 1 . 2]" 1
1489 1 52 TYR QD 1 52 TYR HH . . 4.360 4.285 4.257 4.301 . 0 0 "[ . 1 . 2]" 1
1490 1 52 TYR QE 1 56 LEU MD2 . . 4.040 3.160 2.818 3.663 . 0 0 "[ . 1 . 2]" 1
1491 1 52 TYR QE 1 93 THR MG . . 4.180 2.288 1.688 3.446 . 0 0 "[ . 1 . 2]" 1
1492 1 52 TYR QE 1 56 LEU MD1 . . 3.480 2.583 2.074 3.347 . 0 0 "[ . 1 . 2]" 1
1493 1 52 TYR QE 1 75 ILE MG . . 3.560 2.227 1.454 2.953 . 0 0 "[ . 1 . 2]" 1
1494 1 52 TYR QE 1 75 ILE MD . . 3.700 1.831 1.574 2.963 . 0 0 "[ . 1 . 2]" 1
1495 1 52 TYR QE 1 93 THR HA . . 3.650 2.667 2.137 3.377 . 0 0 "[ . 1 . 2]" 1
1496 1 52 TYR QE 1 93 THR HB . . 4.550 3.962 3.373 4.572 0.022 13 0 "[ . 1 . 2]" 1
1497 1 55 PHE QD 1 56 LEU MD2 . . 3.950 2.673 2.469 2.857 . 0 0 "[ . 1 . 2]" 1
1498 1 55 PHE QD 1 56 LEU HG . . 4.120 3.060 2.684 3.537 . 0 0 "[ . 1 . 2]" 1
1499 1 55 PHE HA 1 55 PHE QD . . 3.400 2.617 2.454 2.764 . 0 0 "[ . 1 . 2]" 1
1500 1 52 TYR QD 1 55 PHE QD . . 4.170 3.292 2.626 3.959 . 0 0 "[ . 1 . 2]" 1
1501 1 52 TYR QE 1 55 PHE QD . . 4.320 3.120 2.332 4.072 . 0 0 "[ . 1 . 2]" 1
1502 1 55 PHE H 1 55 PHE QD . . 4.300 4.167 4.142 4.186 . 0 0 "[ . 1 . 2]" 1
1503 1 38 HIS HE1 1 55 PHE QD . . 4.670 4.058 3.346 4.621 . 0 0 "[ . 1 . 2]" 1
1504 1 38 HIS H 1 55 PHE QD . . 5.990 4.608 4.323 5.155 . 0 0 "[ . 1 . 2]" 1
1505 1 55 PHE QD 1 58 GLU H . . 6.000 5.623 5.509 5.743 . 0 0 "[ . 1 . 2]" 1
1506 1 55 PHE QD 1 56 LEU H . . 4.110 3.400 3.146 3.723 . 0 0 "[ . 1 . 2]" 1
1507 1 55 PHE QE 1 71 LEU MD2 . . 3.580 1.807 1.630 1.975 . 0 0 "[ . 1 . 2]" 1
1508 1 55 PHE QE 1 56 LEU MD2 . . 4.210 3.294 2.879 3.684 . 0 0 "[ . 1 . 2]" 1
1509 1 55 PHE QE 1 71 LEU MD1 . . 4.370 2.354 1.779 2.669 . 0 0 "[ . 1 . 2]" 1
1510 1 55 PHE QE 1 75 ILE MD . . 3.300 2.298 1.892 2.756 . 0 0 "[ . 1 . 2]" 1
1511 1 34 HIS QB 1 55 PHE QE . . 3.520 2.043 1.671 2.392 . 0 0 "[ . 1 . 2]" 1
1512 1 35 ILE HA 1 55 PHE QE . . 4.420 2.993 2.637 3.583 . 0 0 "[ . 1 . 2]" 1
1513 1 35 ILE MD 1 55 PHE HZ . . 4.630 3.846 3.444 4.416 . 0 0 "[ . 1 . 2]" 1
1514 1 55 PHE HZ 1 71 LEU MD2 . . 3.770 2.923 2.537 3.351 . 0 0 "[ . 1 . 2]" 1
1515 1 35 ILE HG13 1 55 PHE HZ . . 4.660 2.652 2.225 3.247 . 0 0 "[ . 1 . 2]" 1
1516 1 55 PHE HZ 1 71 LEU MD1 . . 4.080 2.802 2.423 3.159 . 0 0 "[ . 1 . 2]" 1
1517 1 35 ILE HG12 1 55 PHE HZ . . 4.660 3.134 2.560 3.642 . 0 0 "[ . 1 . 2]" 1
1518 1 34 HIS QB 1 55 PHE HZ . . 3.850 2.573 2.159 2.921 . 0 0 "[ . 1 . 2]" 1
1519 1 35 ILE HA 1 55 PHE HZ . . 4.550 3.664 3.269 4.222 . 0 0 "[ . 1 . 2]" 1
1520 1 59 TYR QD 1 71 LEU MD2 . . 3.780 2.809 2.671 2.887 . 0 0 "[ . 1 . 2]" 1
1521 1 59 TYR QD 1 68 ILE MD . . 3.150 2.999 2.635 3.179 0.029 14 0 "[ . 1 . 2]" 1
1522 1 56 LEU MD2 1 59 TYR QD . . 4.690 4.252 3.911 4.442 . 0 0 "[ . 1 . 2]" 1
1523 1 59 TYR QD 1 68 ILE HG13 . . 3.600 2.577 2.199 2.995 . 0 0 "[ . 1 . 2]" 1
1524 1 59 TYR QD 1 68 ILE HB . . 4.000 2.092 1.738 2.769 . 0 0 "[ . 1 . 2]" 1
1525 1 34 HIS QB 1 59 TYR QD . . 3.930 2.937 2.591 3.327 . 0 0 "[ . 1 . 2]" 1
1526 1 59 TYR QD 1 68 ILE HA . . 4.030 2.789 2.539 3.228 . 0 0 "[ . 1 . 2]" 1
1527 1 59 TYR HA 1 59 TYR QD . . 3.620 2.916 2.754 3.028 . 0 0 "[ . 1 . 2]" 1
1528 1 31 ALA HA 1 59 TYR QD . . 5.250 4.926 4.264 5.260 0.010 3 0 "[ . 1 . 2]" 1
1529 1 55 PHE QE 1 59 TYR QD . . 4.040 3.995 3.572 4.101 0.061 18 0 "[ . 1 . 2]" 1
1530 1 34 HIS HD2 1 59 TYR QD . . 4.030 3.998 3.761 4.087 0.057 8 0 "[ . 1 . 2]" 1
1531 1 59 TYR H 1 59 TYR QD . . 4.260 4.170 4.072 4.224 . 0 0 "[ . 1 . 2]" 1
1532 1 59 TYR QD 1 60 GLY H . . 4.130 3.855 3.362 4.148 0.018 9 0 "[ . 1 . 2]" 1
1533 1 59 TYR QE 1 71 LEU MD2 . . 3.670 3.020 2.909 3.188 . 0 0 "[ . 1 . 2]" 1
1534 1 59 TYR QE 1 71 LEU MD1 . . 4.100 3.750 3.334 4.114 0.014 18 0 "[ . 1 . 2]" 1
1535 1 59 TYR QE 1 68 ILE MG . . 4.770 4.296 4.109 4.621 . 0 0 "[ . 1 . 2]" 1
1536 1 59 TYR QE 1 68 ILE MD . . 5.240 4.747 4.311 5.001 . 0 0 "[ . 1 . 2]" 1
1537 1 59 TYR QE 1 71 LEU HB2 . . 4.380 3.470 3.226 3.714 . 0 0 "[ . 1 . 2]" 1
1538 1 59 TYR QE 1 67 THR MG . . 3.340 2.366 1.853 3.350 0.010 14 0 "[ . 1 . 2]" 1
1539 1 59 TYR QE 1 71 LEU HB3 . . 4.380 3.840 3.655 4.069 . 0 0 "[ . 1 . 2]" 1
1540 1 31 ALA MB 1 59 TYR QE . . 5.020 4.426 3.476 4.864 . 0 0 "[ . 1 . 2]" 1
1541 1 59 TYR QE 1 68 ILE HG13 . . 5.220 4.064 3.503 4.373 . 0 0 "[ . 1 . 2]" 1
1542 1 59 TYR QE 1 68 ILE HB . . 4.040 3.190 2.820 3.521 . 0 0 "[ . 1 . 2]" 1
1543 1 59 TYR QE 1 63 HIS HB3 . . 4.450 3.210 2.956 3.436 . 0 0 "[ . 1 . 2]" 1
1544 1 59 TYR QE 1 63 HIS HB2 . . 4.450 3.085 2.819 3.373 . 0 0 "[ . 1 . 2]" 1
1545 1 34 HIS QB 1 59 TYR QE . . 4.320 3.121 2.752 3.550 . 0 0 "[ . 1 . 2]" 1
1546 1 59 TYR QE 1 68 ILE HA . . 3.300 2.442 2.053 2.679 . 0 0 "[ . 1 . 2]" 1
1547 1 59 TYR QE 1 63 HIS HE1 . . 4.610 3.823 3.513 4.096 . 0 0 "[ . 1 . 2]" 1
1548 1 59 TYR QE 1 68 ILE H . . 4.260 3.297 2.927 3.670 . 0 0 "[ . 1 . 2]" 1
1549 1 63 HIS HD2 1 67 THR MG . . 3.230 2.159 1.827 2.605 . 0 0 "[ . 1 . 2]" 1
1550 1 63 HIS HD2 1 67 THR HB . . 4.610 3.893 3.366 4.312 . 0 0 "[ . 1 . 2]" 1
1551 1 63 HIS HA 1 63 HIS HD2 . . 3.980 3.447 2.942 3.714 . 0 0 "[ . 1 . 2]" 1
1552 1 59 TYR QD 1 63 HIS HE1 . . 4.640 4.247 3.766 4.635 . 0 0 "[ . 1 . 2]" 1
1553 1 65 TYR QD 1 68 ILE MG . . 3.530 3.159 2.891 3.481 . 0 0 "[ . 1 . 2]" 1
1554 1 65 TYR QD 1 98 LEU HB2 . . 4.480 3.891 3.201 4.389 . 0 0 "[ . 1 . 2]" 1
1555 1 65 TYR QD 1 100 ALA MB . . 3.550 2.774 1.966 3.599 0.049 14 0 "[ . 1 . 2]" 1
1556 1 65 TYR QD 1 98 LEU HB3 . . 4.480 3.281 3.006 3.548 . 0 0 "[ . 1 . 2]" 1
1557 1 65 TYR QD 1 66 GLU HG3 . . 4.610 4.411 3.285 4.768 0.158 19 0 "[ . 1 . 2]" 1
1558 1 65 TYR QD 1 66 GLU HA . . 3.790 3.422 3.079 3.803 0.013 5 0 "[ . 1 . 2]" 1
1559 1 65 TYR HA 1 65 TYR QD . . 3.150 2.705 2.487 2.851 . 0 0 "[ . 1 . 2]" 1
1560 1 65 TYR QD 1 100 ALA H . . 4.310 3.362 2.841 4.156 . 0 0 "[ . 1 . 2]" 1
1561 1 65 TYR QD 1 66 GLU H . . 3.820 3.477 3.199 3.855 0.035 13 0 "[ . 1 . 2]" 1
1562 1 65 TYR H 1 65 TYR QD . . 4.370 4.198 4.162 4.220 . 0 0 "[ . 1 . 2]" 1
1563 1 65 TYR QE 1 98 LEU MD2 . . 4.380 4.364 4.069 4.447 0.067 14 0 "[ . 1 . 2]" 1
1564 1 65 TYR QE 1 98 LEU MD1 . . 3.390 2.895 2.652 3.291 . 0 0 "[ . 1 . 2]" 1
1565 1 65 TYR QE 1 68 ILE MG . . 4.340 4.029 3.713 4.210 . 0 0 "[ . 1 . 2]" 1
1566 1 65 TYR QE 1 98 LEU HB2 . . 3.470 2.194 1.959 2.575 . 0 0 "[ . 1 . 2]" 1
1567 1 65 TYR QE 1 98 LEU HG . . 4.580 4.411 4.072 4.583 0.003 3 0 "[ . 1 . 2]" 1
1568 1 65 TYR QE 1 98 LEU HB3 . . 3.470 2.695 2.183 2.918 . 0 0 "[ . 1 . 2]" 1
1569 1 65 TYR QE 1 66 GLU HA . . 4.770 4.505 4.110 4.821 0.051 12 0 "[ . 1 . 2]" 1
1570 1 65 TYR HA 1 65 TYR QE . . 4.950 4.636 4.525 4.699 . 0 0 "[ . 1 . 2]" 1
1571 1 65 TYR QE 1 98 LEU HA . . 4.780 4.699 4.367 4.853 0.073 19 0 "[ . 1 . 2]" 1
1572 1 65 TYR QE 1 98 LEU H . . 5.520 4.552 4.170 5.555 0.035 13 0 "[ . 1 . 2]" 1
1573 1 65 TYR QE 1 100 ALA H . . 6.000 4.670 4.008 5.636 . 0 0 "[ . 1 . 2]" 1
1574 1 71 LEU MD1 1 74 TYR QD . . 3.880 3.056 2.684 3.369 . 0 0 "[ . 1 . 2]" 1
1575 1 31 ALA MB 1 74 TYR QD . . 3.360 2.835 2.445 3.181 . 0 0 "[ . 1 . 2]" 1
1576 1 71 LEU HA 1 74 TYR QD . . 3.070 2.338 2.038 2.660 . 0 0 "[ . 1 . 2]" 1
1577 1 28 TYR HA 1 74 TYR QD . . 4.520 3.661 3.301 3.967 . 0 0 "[ . 1 . 2]" 1
1578 1 73 SER QB 1 74 TYR QD . . 4.710 3.622 3.278 4.007 . 0 0 "[ . 1 . 2]" 1
1579 1 74 TYR HA 1 74 TYR QD . . 2.990 2.137 2.019 2.222 . 0 0 "[ . 1 . 2]" 1
1580 1 8 PHE HZ 1 74 TYR QD . . 3.410 2.916 2.486 3.299 . 0 0 "[ . 1 . 2]" 1
1581 1 74 TYR H 1 74 TYR QD . . 3.680 3.039 2.876 3.168 . 0 0 "[ . 1 . 2]" 1
1582 1 74 TYR QD 1 75 ILE H . . 4.260 4.192 4.124 4.283 0.023 18 0 "[ . 1 . 2]" 1
1583 1 71 LEU MD1 1 74 TYR QE . . 4.490 4.429 4.213 4.538 0.048 11 0 "[ . 1 . 2]" 1
1584 1 70 LYS HG2 1 74 TYR QE . . 4.540 3.708 2.770 4.497 . 0 0 "[ . 1 . 2]" 1
1585 1 70 LYS HG3 1 74 TYR QE . . 4.540 3.850 2.664 4.769 0.229 11 0 "[ . 1 . 2]" 1
1586 1 24 THR MG 1 74 TYR QE . . 4.790 3.819 3.032 4.794 0.004 20 0 "[ . 1 . 2]" 1
1587 1 31 ALA MB 1 74 TYR QE . . 3.760 3.586 3.276 3.816 0.056 20 0 "[ . 1 . 2]" 1
1588 1 70 LYS QE 1 74 TYR QE . . 5.240 4.661 3.175 5.296 0.056 16 0 "[ . 1 . 2]" 1
1589 1 71 LEU HA 1 74 TYR QE . . 3.400 3.432 3.381 3.477 0.077 8 0 "[ . 1 . 2]" 1
1590 1 28 TYR HA 1 74 TYR QE . . 3.990 3.816 3.489 4.050 0.060 2 0 "[ . 1 . 2]" 1
1591 1 74 TYR HA 1 74 TYR QE . . 4.540 4.472 4.367 4.563 0.023 8 0 "[ . 1 . 2]" 1
1592 1 8 PHE HZ 1 74 TYR QE . . 5.100 4.830 4.509 5.131 0.031 12 0 "[ . 1 . 2]" 1
1593 1 71 LEU H 1 74 TYR QE . . 4.440 4.370 4.122 4.499 0.059 19 0 "[ . 1 . 2]" 1
1594 1 74 TYR H 1 74 TYR QE . . 4.480 4.374 4.239 4.515 0.035 10 0 "[ . 1 . 2]" 1
1595 1 79 PHE QD 1 93 THR MG . . 4.200 3.424 2.626 4.278 0.078 7 0 "[ . 1 . 2]" 1
1596 1 78 ALA MB 1 79 PHE QD . . 4.520 3.657 3.193 4.010 . 0 0 "[ . 1 . 2]" 1
1597 1 79 PHE QD 1 88 VAL MG1 . . 5.340 2.936 2.067 4.771 . 0 0 "[ . 1 . 2]" 1
1598 1 75 ILE MG 1 79 PHE QD . . 3.300 2.110 1.914 2.355 . 0 0 "[ . 1 . 2]" 1
1599 1 79 PHE HA 1 79 PHE QD . . 3.950 2.562 2.237 2.880 . 0 0 "[ . 1 . 2]" 1
1600 1 79 PHE H 1 79 PHE QD . . 4.380 2.917 2.497 3.192 . 0 0 "[ . 1 . 2]" 1
1601 1 79 PHE QE 1 88 VAL MG2 . . 5.690 2.957 1.911 4.257 . 0 0 "[ . 1 . 2]" 1
1602 1 75 ILE MG 1 79 PHE QE . . 3.540 2.177 1.943 2.493 . 0 0 "[ . 1 . 2]" 1
1603 1 47 ILE HB 1 79 PHE QE . . 5.260 3.640 2.997 4.566 . 0 0 "[ . 1 . 2]" 1
1604 1 47 ILE MG 1 79 PHE HZ . . 4.340 3.003 2.301 4.190 . 0 0 "[ . 1 . 2]" 1
1605 1 47 ILE MD 1 79 PHE HZ . . 5.010 3.629 1.892 4.555 . 0 0 "[ . 1 . 2]" 1
1606 1 47 ILE HB 1 79 PHE HZ . . 3.900 2.864 2.084 3.757 . 0 0 "[ . 1 . 2]" 1
1607 1 47 ILE H 1 79 PHE HZ . . 5.460 4.655 4.111 5.367 . 0 0 "[ . 1 . 2]" 1
1608 1 82 ALA MB 1 87 TYR QD . . 4.730 2.725 1.893 3.814 . 0 0 "[ . 1 . 2]" 1
1609 1 82 ALA HA 1 87 TYR QD . . 3.700 3.700 3.253 3.806 0.106 6 0 "[ . 1 . 2]" 1
1610 1 2 ILE MG 1 87 TYR QE . . 4.330 2.338 1.529 3.131 . 0 0 "[ . 1 . 2]" 1
1611 1 44 LEU HG 1 87 TYR QE . . 5.220 4.695 2.893 5.240 0.020 6 0 "[ . 1 . 2]" 1
1612 1 1 MET HA 1 87 TYR QE . . 6.000 3.823 1.799 6.004 0.004 15 0 "[ . 1 . 2]" 1
1613 1 82 ALA HA 1 87 TYR QE . . 6.000 5.713 5.287 5.953 . 0 0 "[ . 1 . 2]" 1
1614 1 94 TYR QD 1 95 LYS QD . . 4.340 3.370 2.423 4.398 0.058 8 0 "[ . 1 . 2]" 1
1615 1 94 TYR QD 1 95 LYS HB2 . . 4.660 3.365 2.030 4.532 . 0 0 "[ . 1 . 2]" 1
1616 1 94 TYR QD 1 95 LYS HB3 . . 4.660 3.712 2.148 4.742 0.082 10 0 "[ . 1 . 2]" 1
1617 1 49 ARG QD 1 94 TYR QD . . 4.160 2.918 1.927 4.227 0.067 19 0 "[ . 1 . 2]" 1
1618 1 94 TYR HA 1 94 TYR QD . . 3.150 2.862 2.529 3.099 . 0 0 "[ . 1 . 2]" 1
1619 1 94 TYR QD 1 95 LYS H . . 4.270 3.146 2.642 3.796 . 0 0 "[ . 1 . 2]" 1
1620 1 94 TYR QE 1 95 LYS QD . . 4.730 3.629 2.166 4.800 0.070 12 0 "[ . 1 . 2]" 1
1621 1 94 TYR QE 1 95 LYS QE . . 4.190 3.383 1.937 4.271 0.081 20 0 "[ . 1 . 2]" 1
1622 1 8 PHE HB3 1 32 TYR QE . . 4.320 4.238 3.625 4.374 0.054 7 0 "[ . 1 . 2]" 1
1623 1 52 TYR HA 1 52 TYR QE . . 4.970 4.463 4.296 4.584 . 0 0 "[ . 1 . 2]" 1
1624 1 94 TYR HA 1 94 TYR QE . . 5.380 4.702 4.495 4.906 . 0 0 "[ . 1 . 2]" 1
1625 1 32 TYR QE 1 36 LYS H . . 5.250 5.004 4.637 5.272 0.022 10 0 "[ . 1 . 2]" 1
1626 1 99 HIS QB 1 99 HIS HD2 . . 3.280 2.805 2.658 3.143 . 0 0 "[ . 1 . 2]" 1
1627 1 83 ILE MG 1 84 HIS HD2 . . 4.500 3.991 1.960 4.634 0.134 1 0 "[ . 1 . 2]" 1
1628 1 84 HIS HA 1 84 HIS HD2 . . 4.260 2.893 2.309 4.321 0.061 16 0 "[ . 1 . 2]" 1
1629 1 55 PHE QD 1 75 ILE MD . . 4.240 3.320 2.960 4.082 . 0 0 "[ . 1 . 2]" 1
1630 1 34 HIS HE1 1 59 TYR QE . . 4.860 4.783 4.476 4.908 0.048 20 0 "[ . 1 . 2]" 1
1631 1 38 HIS HE1 1 58 GLU QB . . 4.070 3.153 2.007 4.141 0.071 17 0 "[ . 1 . 2]" 1
1632 1 38 HIS HE1 1 55 PHE HA . . 4.260 3.772 2.757 4.338 0.078 16 0 "[ . 1 . 2]" 1
1633 1 18 PRO HB2 1 19 HIS HE1 . . 4.860 4.849 4.536 4.921 0.061 13 0 "[ . 1 . 2]" 1
1634 1 1 MET QB 1 43 LEU MD2 . . 3.630 2.492 1.830 3.347 . 0 0 "[ . 1 . 2]" 1
1635 1 1 MET QG 1 43 LEU QB . . 5.610 3.739 2.012 5.300 . 0 0 "[ . 1 . 2]" 1
1636 1 1 MET QG 1 45 LYS QD . . 5.810 3.832 2.833 5.016 . 0 0 "[ . 1 . 2]" 1
1637 1 1 MET ME 1 45 LYS QE . . 4.850 3.598 2.506 4.706 . 0 0 "[ . 1 . 2]" 1
1638 1 2 ILE HA 1 2 ILE QG . . 3.730 2.452 2.304 2.877 . 0 0 "[ . 1 . 2]" 1
1639 1 2 ILE MG 1 44 LEU QB . . 5.300 2.835 2.190 3.691 . 0 0 "[ . 1 . 2]" 1
1640 1 2 ILE MG 1 44 LEU QD . . 4.380 2.619 1.990 3.453 . 0 0 "[ . 1 . 2]" 1
1641 1 2 ILE QG 1 3 THR H . . 4.380 2.162 1.880 2.499 . 0 0 "[ . 1 . 2]" 1
1642 1 2 ILE QG 1 6 ASP QB . . 4.410 2.564 2.145 3.182 . 0 0 "[ . 1 . 2]" 1
1643 1 2 ILE QG 1 7 TYR H . . 4.340 3.006 2.659 3.446 . 0 0 "[ . 1 . 2]" 1
1644 1 2 ILE QG 1 7 TYR QB . . 5.520 2.736 2.151 3.218 . 0 0 "[ . 1 . 2]" 1
1645 1 2 ILE MD 1 6 ASP QB . . 4.740 2.588 2.053 3.286 . 0 0 "[ . 1 . 2]" 1
1646 1 2 ILE MD 1 10 GLN QE . . 4.960 3.315 2.119 4.808 . 0 0 "[ . 1 . 2]" 1
1647 1 3 THR HA 1 43 LEU QB . . 5.790 3.945 3.685 4.347 . 0 0 "[ . 1 . 2]" 1
1648 1 3 THR MG 1 41 HIS QB . . 4.080 3.332 1.866 3.798 . 0 0 "[ . 1 . 2]" 1
1649 1 4 PHE HA 1 44 LEU QB . . 4.150 2.759 2.058 3.392 . 0 0 "[ . 1 . 2]" 1
1650 1 4 PHE HA 1 44 LEU QD . . 3.800 2.875 2.219 3.627 . 0 0 "[ . 1 . 2]" 1
1651 1 4 PHE QB 1 5 ALA H . . 4.100 2.619 2.477 2.748 . 0 0 "[ . 1 . 2]" 1
1652 1 4 PHE QB 1 5 ALA HA . . 5.780 4.181 4.129 4.230 . 0 0 "[ . 1 . 2]" 1
1653 1 4 PHE QB 1 42 LYS HG2 . . 5.810 4.447 3.773 5.314 . 0 0 "[ . 1 . 2]" 1
1654 1 4 PHE QB 1 44 LEU HA . . 4.390 2.122 1.538 2.468 . 0 0 "[ . 1 . 2]" 1
1655 1 4 PHE QB 1 44 LEU QD . . 5.280 3.344 2.806 4.061 . 0 0 "[ . 1 . 2]" 1
1656 1 4 PHE QB 1 47 ILE QG . . 5.020 2.777 2.253 3.470 . 0 0 "[ . 1 . 2]" 1
1657 1 4 PHE QD 1 35 ILE QG . . 5.810 4.131 3.856 4.515 . 0 0 "[ . 1 . 2]" 1
1658 1 4 PHE QD 1 39 PHE QB . . 3.610 2.853 2.131 3.541 . 0 0 "[ . 1 . 2]" 1
1659 1 4 PHE QD 1 44 LEU QB . . 3.800 3.327 2.007 3.876 0.076 14 0 "[ . 1 . 2]" 1
1660 1 4 PHE QD 1 44 LEU QD . . 4.610 2.343 1.641 3.613 . 0 0 "[ . 1 . 2]" 1
1661 1 4 PHE QD 1 47 ILE QG . . 5.810 3.330 2.662 4.441 . 0 0 "[ . 1 . 2]" 1
1662 1 4 PHE QE 1 35 ILE QG . . 5.300 2.812 2.484 3.270 . 0 0 "[ . 1 . 2]" 1
1663 1 4 PHE QE 1 39 PHE QB . . 5.730 4.534 3.710 5.084 . 0 0 "[ . 1 . 2]" 1
1664 1 4 PHE HZ 1 35 ILE QG . . 5.810 4.284 3.735 4.899 . 0 0 "[ . 1 . 2]" 1
1665 1 4 PHE HZ 1 75 ILE QG . . 4.370 2.524 2.115 3.940 . 0 0 "[ . 1 . 2]" 1
1666 1 6 ASP H 1 6 ASP QB . . 3.580 2.344 2.247 2.516 . 0 0 "[ . 1 . 2]" 1
1667 1 6 ASP QB 1 7 TYR H . . 4.040 2.622 2.470 2.833 . 0 0 "[ . 1 . 2]" 1
1668 1 7 TYR H 1 44 LEU QD . . 5.890 4.674 4.293 5.035 . 0 0 "[ . 1 . 2]" 1
1669 1 7 TYR HA 1 10 GLN QE . . 5.170 3.810 2.395 5.040 . 0 0 "[ . 1 . 2]" 1
1670 1 7 TYR QB 1 44 LEU QD . . 5.170 2.689 2.266 3.109 . 0 0 "[ . 1 . 2]" 1
1671 1 7 TYR QD 1 44 LEU QD . . 3.940 2.583 2.170 3.158 . 0 0 "[ . 1 . 2]" 1
1672 1 7 TYR QE 1 11 TRP QB . . 4.450 3.482 3.003 3.801 . 0 0 "[ . 1 . 2]" 1
1673 1 7 TYR QE 1 44 LEU QD . . 4.490 2.929 2.631 3.329 . 0 0 "[ . 1 . 2]" 1
1674 1 8 PHE HA 1 11 TRP QB . . 4.150 2.631 2.508 2.856 . 0 0 "[ . 1 . 2]" 1
1675 1 8 PHE QD 1 32 TYR QB . . 3.620 2.493 1.953 2.919 . 0 0 "[ . 1 . 2]" 1
1676 1 8 PHE QE 1 32 TYR QB . . 4.060 2.748 2.481 3.259 . 0 0 "[ . 1 . 2]" 1
1677 1 8 PHE QE 1 75 ILE QG . . 4.560 2.922 2.574 4.104 . 0 0 "[ . 1 . 2]" 1
1678 1 9 TYR H 1 11 TRP QB . . 5.810 4.720 4.577 4.908 . 0 0 "[ . 1 . 2]" 1
1679 1 9 TYR QD 1 13 GLU QG . . 5.510 4.723 2.808 5.276 . 0 0 "[ . 1 . 2]" 1
1680 1 9 TYR QE 1 13 GLU QG . . 4.400 3.812 2.422 4.423 0.023 17 0 "[ . 1 . 2]" 1
1681 1 10 GLN H 1 10 GLN QG . . 4.120 3.811 2.314 4.046 . 0 0 "[ . 1 . 2]" 1
1682 1 10 GLN H 1 11 TRP QB . . 5.810 4.322 4.204 4.387 . 0 0 "[ . 1 . 2]" 1
1683 1 10 GLN HA 1 10 GLN QE . . 5.810 4.645 2.875 5.464 . 0 0 "[ . 1 . 2]" 1
1684 1 10 GLN QG 1 11 TRP H . . 5.070 3.469 2.152 4.133 . 0 0 "[ . 1 . 2]" 1
1685 1 10 GLN QG 1 13 GLU QB . . 5.540 4.040 3.422 5.212 . 0 0 "[ . 1 . 2]" 1
1686 1 10 GLN QE 1 11 TRP H . . 5.710 4.356 2.864 5.645 . 0 0 "[ . 1 . 2]" 1
1687 1 10 GLN QE 1 14 VAL MG2 . . 5.810 4.131 3.164 5.169 . 0 0 "[ . 1 . 2]" 1
1688 1 11 TRP H 1 11 TRP QB . . 3.520 2.204 2.145 2.228 . 0 0 "[ . 1 . 2]" 1
1689 1 11 TRP HA 1 15 ASN QD . . 4.400 3.305 2.396 4.256 . 0 0 "[ . 1 . 2]" 1
1690 1 11 TRP QB 1 11 TRP HE3 . . 3.580 2.434 2.402 2.498 . 0 0 "[ . 1 . 2]" 1
1691 1 11 TRP QB 1 12 TYR H . . 4.320 2.498 2.387 2.625 . 0 0 "[ . 1 . 2]" 1
1692 1 11 TRP QB 1 78 ALA MB . . 5.600 3.337 3.080 3.738 . 0 0 "[ . 1 . 2]" 1
1693 1 11 TRP HD1 1 15 ASN QB . . 5.810 4.363 3.660 5.139 . 0 0 "[ . 1 . 2]" 1
1694 1 11 TRP HD1 1 15 ASN QD . . 3.410 2.926 2.207 3.426 0.016 11 0 "[ . 1 . 2]" 1
1695 1 11 TRP HD1 1 81 ASP QB . . 3.820 3.313 2.779 3.753 . 0 0 "[ . 1 . 2]" 1
1696 1 11 TRP HE1 1 81 ASP QB . . 5.480 2.666 2.062 3.143 . 0 0 "[ . 1 . 2]" 1
1697 1 11 TRP HZ2 1 15 ASN QB . . 5.810 4.668 4.061 5.516 . 0 0 "[ . 1 . 2]" 1
1698 1 11 TRP HZ2 1 16 LYS QE . . 4.250 2.686 2.175 3.203 . 0 0 "[ . 1 . 2]" 1
1699 1 11 TRP HZ2 1 77 ASN QB . . 3.300 2.377 1.779 2.802 . 0 0 "[ . 1 . 2]" 1
1700 1 11 TRP HZ2 1 77 ASN QD . . 4.430 3.538 1.447 4.541 0.111 17 0 "[ . 1 . 2]" 1
1701 1 11 TRP HZ2 1 81 ASP QB . . 5.810 4.358 3.445 5.104 . 0 0 "[ . 1 . 2]" 1
1702 1 11 TRP HH2 1 16 LYS QG . . 5.810 4.022 3.031 5.187 . 0 0 "[ . 1 . 2]" 1
1703 1 11 TRP HH2 1 16 LYS QE . . 3.900 3.052 2.527 3.557 . 0 0 "[ . 1 . 2]" 1
1704 1 11 TRP HH2 1 77 ASN QB . . 3.720 2.508 2.078 2.747 . 0 0 "[ . 1 . 2]" 1
1705 1 12 TYR HA 1 16 LYS QB . . 5.030 3.219 2.644 3.594 . 0 0 "[ . 1 . 2]" 1
1706 1 12 TYR HA 1 16 LYS QG . . 5.290 3.458 2.333 4.671 . 0 0 "[ . 1 . 2]" 1
1707 1 12 TYR QD 1 13 GLU QG . . 5.610 4.783 2.771 5.629 0.019 5 0 "[ . 1 . 2]" 1
1708 1 12 TYR QD 1 16 LYS QB . . 3.300 1.814 1.582 2.196 . 0 0 "[ . 1 . 2]" 1
1709 1 12 TYR QD 1 16 LYS QG . . 4.340 3.069 2.563 3.738 . 0 0 "[ . 1 . 2]" 1
1710 1 12 TYR QE 1 16 LYS QB . . 3.700 2.427 2.078 2.648 . 0 0 "[ . 1 . 2]" 1
1711 1 12 TYR QE 1 16 LYS QG . . 4.060 4.070 3.755 4.158 0.098 16 0 "[ . 1 . 2]" 1
1712 1 12 TYR QE 1 25 LYS QG . . 4.490 3.429 2.178 4.645 0.155 4 0 "[ . 1 . 2]" 1
1713 1 12 TYR QE 1 28 TYR QB . . 3.430 3.262 2.996 3.457 0.027 14 0 "[ . 1 . 2]" 1
1714 1 13 GLU H 1 13 GLU QG . . 4.610 3.872 2.589 4.013 . 0 0 "[ . 1 . 2]" 1
1715 1 13 GLU QG 1 14 VAL H . . 5.350 3.965 3.381 4.518 . 0 0 "[ . 1 . 2]" 1
1716 1 13 GLU QG 1 14 VAL MG2 . . 5.550 3.841 3.276 4.703 . 0 0 "[ . 1 . 2]" 1
1717 1 13 GLU QG 1 17 LEU MD1 . . 4.080 3.049 2.003 3.988 . 0 0 "[ . 1 . 2]" 1
1718 1 13 GLU QG 1 17 LEU MD2 . . 4.010 2.038 1.420 3.577 . 0 0 "[ . 1 . 2]" 1
1719 1 14 VAL HB 1 15 ASN QD . . 4.600 3.326 2.479 4.405 . 0 0 "[ . 1 . 2]" 1
1720 1 14 VAL MG2 1 15 ASN QD . . 5.520 4.547 3.818 5.430 . 0 0 "[ . 1 . 2]" 1
1721 1 15 ASN H 1 15 ASN QD . . 5.070 3.459 2.711 4.277 . 0 0 "[ . 1 . 2]" 1
1722 1 15 ASN H 1 16 LYS QE . . 5.560 5.357 4.938 5.588 0.028 8 0 "[ . 1 . 2]" 1
1723 1 15 ASN QB 1 16 LYS QG . . 4.940 2.845 1.990 3.968 . 0 0 "[ . 1 . 2]" 1
1724 1 15 ASN QB 1 16 LYS QE . . 5.370 2.658 2.256 2.987 . 0 0 "[ . 1 . 2]" 1
1725 1 15 ASN QB 1 17 LEU H . . 5.810 4.414 4.099 5.510 . 0 0 "[ . 1 . 2]" 1
1726 1 16 LYS H 1 16 LYS QG . . 4.870 2.823 1.959 3.847 . 0 0 "[ . 1 . 2]" 1
1727 1 16 LYS H 1 16 LYS QE . . 5.810 4.174 3.708 4.720 . 0 0 "[ . 1 . 2]" 1
1728 1 16 LYS HA 1 16 LYS QD . . 3.490 2.499 1.953 3.554 0.064 12 0 "[ . 1 . 2]" 1
1729 1 16 LYS HA 1 16 LYS QE . . 5.580 4.290 3.920 4.836 . 0 0 "[ . 1 . 2]" 1
1730 1 16 LYS HA 1 19 HIS QB . . 5.670 2.944 2.518 3.697 . 0 0 "[ . 1 . 2]" 1
1731 1 16 LYS QB 1 17 LEU H . . 4.240 3.198 2.963 3.702 . 0 0 "[ . 1 . 2]" 1
1732 1 16 LYS QB 1 28 TYR QD . . 5.360 4.381 3.951 4.680 . 0 0 "[ . 1 . 2]" 1
1733 1 16 LYS QB 1 28 TYR QE . . 3.900 3.504 3.220 3.945 0.045 20 0 "[ . 1 . 2]" 1
1734 1 16 LYS QG 1 28 TYR QE . . 4.180 3.291 2.679 4.186 0.006 20 0 "[ . 1 . 2]" 1
1735 1 16 LYS QD 1 17 LEU H . . 5.180 4.609 3.964 5.190 0.010 12 0 "[ . 1 . 2]" 1
1736 1 16 LYS QE 1 28 TYR QE . . 5.470 4.322 3.337 4.934 . 0 0 "[ . 1 . 2]" 1
1737 1 17 LEU H 1 18 PRO QG . . 4.550 4.369 3.481 4.543 . 0 0 "[ . 1 . 2]" 1
1738 1 17 LEU HG 1 25 LYS QE . . 4.490 4.011 3.224 4.545 0.055 20 0 "[ . 1 . 2]" 1
1739 1 17 LEU MD1 1 25 LYS QG . . 5.070 3.391 2.524 4.604 . 0 0 "[ . 1 . 2]" 1
1740 1 17 LEU MD1 1 25 LYS QE . . 4.100 2.508 1.974 3.706 . 0 0 "[ . 1 . 2]" 1
1741 1 17 LEU MD2 1 25 LYS QE . . 4.530 4.403 3.637 4.632 0.102 16 0 "[ . 1 . 2]" 1
1742 1 18 PRO QG 1 19 HIS H . . 4.970 3.688 2.776 4.234 . 0 0 "[ . 1 . 2]" 1
1743 1 18 PRO QG 1 19 HIS HE1 . . 4.580 4.197 3.793 4.617 0.037 7 0 "[ . 1 . 2]" 1
1744 1 19 HIS QB 1 19 HIS HD2 . . 3.190 2.649 2.619 2.690 . 0 0 "[ . 1 . 2]" 1
1745 1 19 HIS QB 1 20 VAL MG1 . . 4.700 2.779 2.598 3.045 . 0 0 "[ . 1 . 2]" 1
1746 1 19 HIS QB 1 20 VAL MG2 . . 5.330 3.998 3.794 4.356 . 0 0 "[ . 1 . 2]" 1
1747 1 20 VAL MG2 1 25 LYS QG . . 3.590 2.334 1.854 3.035 . 0 0 "[ . 1 . 2]" 1
1748 1 20 VAL MG2 1 25 LYS QE . . 5.040 3.743 2.529 4.732 . 0 0 "[ . 1 . 2]" 1
1749 1 21 SER H 1 21 SER QB . . 3.670 2.564 2.261 2.820 . 0 0 "[ . 1 . 2]" 1
1750 1 21 SER QB 1 22 GLU H . . 4.120 2.322 2.064 2.994 . 0 0 "[ . 1 . 2]" 1
1751 1 21 SER QB 1 22 GLU QG . . 5.700 4.202 3.155 5.850 0.150 7 0 "[ . 1 . 2]" 1
1752 1 22 GLU HA 1 25 LYS QB . . 4.040 2.276 1.763 2.921 . 0 0 "[ . 1 . 2]" 1
1753 1 22 GLU HA 1 25 LYS QG . . 4.330 2.308 1.643 2.890 . 0 0 "[ . 1 . 2]" 1
1754 1 22 GLU HA 1 25 LYS QE . . 4.930 4.008 2.501 4.841 . 0 0 "[ . 1 . 2]" 1
1755 1 22 GLU QG 1 25 LYS QB . . 5.810 4.133 2.971 4.994 . 0 0 "[ . 1 . 2]" 1
1756 1 22 GLU QG 1 25 LYS QG . . 5.520 4.210 2.705 5.403 . 0 0 "[ . 1 . 2]" 1
1757 1 24 THR H 1 25 LYS QG . . 5.210 4.109 3.833 4.450 . 0 0 "[ . 1 . 2]" 1
1758 1 24 THR HA 1 27 HIS QB . . 4.950 2.805 2.104 3.456 . 0 0 "[ . 1 . 2]" 1
1759 1 24 THR MG 1 27 HIS QB . . 4.850 3.139 2.826 3.685 . 0 0 "[ . 1 . 2]" 1
1760 1 25 LYS H 1 25 LYS QG . . 3.690 2.246 1.977 2.442 . 0 0 "[ . 1 . 2]" 1
1761 1 25 LYS HA 1 28 TYR QB . . 4.730 2.807 2.464 3.168 . 0 0 "[ . 1 . 2]" 1
1762 1 25 LYS QB 1 29 GLU H . . 5.810 4.450 4.040 4.847 . 0 0 "[ . 1 . 2]" 1
1763 1 25 LYS QB 1 29 GLU HG2 . . 5.810 4.548 2.748 5.428 . 0 0 "[ . 1 . 2]" 1
1764 1 25 LYS QG 1 26 ARG H . . 5.540 4.035 3.763 4.168 . 0 0 "[ . 1 . 2]" 1
1765 1 27 HIS QB 1 28 TYR H . . 4.240 2.466 2.354 2.649 . 0 0 "[ . 1 . 2]" 1
1766 1 27 HIS QB 1 74 TYR QE . . 3.680 2.262 1.950 2.910 . 0 0 "[ . 1 . 2]" 1
1767 1 28 TYR H 1 28 TYR QB . . 3.660 2.263 2.134 2.366 . 0 0 "[ . 1 . 2]" 1
1768 1 28 TYR QB 1 29 GLU H . . 3.850 2.620 2.520 2.742 . 0 0 "[ . 1 . 2]" 1
1769 1 29 GLU HA 1 32 TYR QB . . 4.940 2.418 1.931 2.852 . 0 0 "[ . 1 . 2]" 1
1770 1 30 SER H 1 30 SER QB . . 3.310 2.426 2.224 2.647 . 0 0 "[ . 1 . 2]" 1
1771 1 30 SER HA 1 33 LYS QG . . 4.760 2.474 1.727 4.200 . 0 0 "[ . 1 . 2]" 1
1772 1 31 ALA MB 1 32 TYR QB . . 4.980 3.702 3.573 3.798 . 0 0 "[ . 1 . 2]" 1
1773 1 31 ALA MB 1 71 LEU QB . . 4.870 3.528 3.062 3.911 . 0 0 "[ . 1 . 2]" 1
1774 1 32 TYR QB 1 35 ILE MD . . 5.210 3.887 3.425 4.274 . 0 0 "[ . 1 . 2]" 1
1775 1 32 TYR QD 1 36 LYS QB . . 4.340 3.865 3.480 4.373 0.033 10 0 "[ . 1 . 2]" 1
1776 1 32 TYR QE 1 36 LYS QB . . 4.390 3.486 3.003 3.959 . 0 0 "[ . 1 . 2]" 1
1777 1 32 TYR QE 1 36 LYS QE . . 4.580 3.313 2.519 4.135 . 0 0 "[ . 1 . 2]" 1
1778 1 33 LYS H 1 33 LYS QG . . 4.260 2.347 1.910 3.942 . 0 0 "[ . 1 . 2]" 1
1779 1 33 LYS HA 1 36 LYS QE . . 4.610 3.318 1.684 4.599 . 0 0 "[ . 1 . 2]" 1
1780 1 33 LYS QG 1 34 HIS H . . 4.950 3.035 2.081 4.444 . 0 0 "[ . 1 . 2]" 1
1781 1 33 LYS QG 1 34 HIS HA . . 5.350 4.330 3.346 5.674 0.324 5 0 "[ . 1 . 2]" 1
1782 1 33 LYS QG 1 34 HIS HD2 . . 5.700 3.934 2.520 5.697 . 0 0 "[ . 1 . 2]" 1
1783 1 33 LYS QG 1 35 ILE H . . 5.670 4.930 4.343 5.794 0.124 9 0 "[ . 1 . 2]" 1
1784 1 34 HIS H 1 37 ASP QB . . 5.810 4.581 4.348 5.036 . 0 0 "[ . 1 . 2]" 1
1785 1 34 HIS HA 1 37 ASP QB . . 3.510 2.367 2.057 2.804 . 0 0 "[ . 1 . 2]" 1
1786 1 35 ILE HA 1 38 HIS QB . . 5.720 3.250 2.857 3.469 . 0 0 "[ . 1 . 2]" 1
1787 1 35 ILE MG 1 39 PHE QB . . 4.560 2.543 2.119 2.811 . 0 0 "[ . 1 . 2]" 1
1788 1 35 ILE QG 1 36 LYS H . . 5.810 4.063 3.941 4.151 . 0 0 "[ . 1 . 2]" 1
1789 1 35 ILE QG 1 39 PHE QD . . 4.860 3.394 2.891 3.962 . 0 0 "[ . 1 . 2]" 1
1790 1 35 ILE QG 1 52 TYR QE . . 5.810 5.022 4.531 5.444 . 0 0 "[ . 1 . 2]" 1
1791 1 35 ILE QG 1 55 PHE HZ . . 3.860 2.514 2.130 3.034 . 0 0 "[ . 1 . 2]" 1
1792 1 35 ILE QG 1 75 ILE MD . . 4.280 2.998 2.706 3.312 . 0 0 "[ . 1 . 2]" 1
1793 1 35 ILE MD 1 75 ILE QG . . 4.370 2.581 2.094 3.926 . 0 0 "[ . 1 . 2]" 1
1794 1 36 LYS H 1 36 LYS QB . . 3.380 2.303 2.148 2.558 . 0 0 "[ . 1 . 2]" 1
1795 1 36 LYS H 1 36 LYS QG . . 4.390 3.429 2.046 3.974 . 0 0 "[ . 1 . 2]" 1
1796 1 36 LYS H 1 36 LYS QE . . 5.810 4.312 3.730 5.827 0.017 8 0 "[ . 1 . 2]" 1
1797 1 36 LYS H 1 37 ASP QB . . 5.810 4.357 4.242 4.493 . 0 0 "[ . 1 . 2]" 1
1798 1 36 LYS QB 1 36 LYS QE . . 3.950 2.120 1.813 3.654 . 0 0 "[ . 1 . 2]" 1
1799 1 36 LYS QB 1 37 ASP H . . 3.720 3.033 2.581 3.610 . 0 0 "[ . 1 . 2]" 1
1800 1 36 LYS QB 1 37 ASP HA . . 4.890 4.319 4.105 4.605 . 0 0 "[ . 1 . 2]" 1
1801 1 36 LYS QG 1 37 ASP HA . . 5.260 3.663 3.342 4.043 . 0 0 "[ . 1 . 2]" 1
1802 1 36 LYS QG 1 40 ARG HA . . 5.510 4.248 2.665 5.564 0.054 10 0 "[ . 1 . 2]" 1
1803 1 37 ASP H 1 37 ASP QB . . 3.400 2.236 2.183 2.281 . 0 0 "[ . 1 . 2]" 1
1804 1 37 ASP H 1 38 HIS QB . . 5.810 4.617 4.395 4.847 . 0 0 "[ . 1 . 2]" 1
1805 1 37 ASP HA 1 40 ARG QG . . 4.250 3.452 2.787 4.071 . 0 0 "[ . 1 . 2]" 1
1806 1 37 ASP HA 1 40 ARG QD . . 5.050 3.968 2.970 4.979 . 0 0 "[ . 1 . 2]" 1
1807 1 37 ASP QB 1 38 HIS H . . 4.420 2.542 2.458 2.733 . 0 0 "[ . 1 . 2]" 1
1808 1 38 HIS H 1 38 HIS QB . . 3.480 2.314 2.121 2.443 . 0 0 "[ . 1 . 2]" 1
1809 1 38 HIS H 1 39 PHE QB . . 5.630 4.654 4.532 4.765 . 0 0 "[ . 1 . 2]" 1
1810 1 38 HIS H 1 40 ARG QG . . 5.750 4.592 4.029 5.610 . 0 0 "[ . 1 . 2]" 1
1811 1 38 HIS QB 1 39 PHE QD . . 4.110 3.140 2.885 3.400 . 0 0 "[ . 1 . 2]" 1
1812 1 38 HIS QB 1 39 PHE HZ . . 5.060 4.260 3.896 4.718 . 0 0 "[ . 1 . 2]" 1
1813 1 38 HIS QB 1 55 PHE QD . . 3.870 2.702 2.380 3.153 . 0 0 "[ . 1 . 2]" 1
1814 1 38 HIS QB 1 55 PHE QE . . 5.080 3.365 2.717 4.051 . 0 0 "[ . 1 . 2]" 1
1815 1 38 HIS HE1 1 58 GLU QG . . 5.760 3.606 2.086 5.234 . 0 0 "[ . 1 . 2]" 1
1816 1 39 PHE H 1 40 ARG QG . . 5.670 4.179 3.765 4.919 . 0 0 "[ . 1 . 2]" 1
1817 1 39 PHE HA 1 42 LYS QB . . 4.450 2.661 2.187 3.013 . 0 0 "[ . 1 . 2]" 1
1818 1 39 PHE QB 1 42 LYS QB . . 4.420 1.914 1.577 2.305 . 0 0 "[ . 1 . 2]" 1
1819 1 39 PHE QB 1 47 ILE MD . . 5.320 2.840 2.503 3.130 . 0 0 "[ . 1 . 2]" 1
1820 1 39 PHE QD 1 42 LYS QB . . 3.820 2.562 2.139 3.045 . 0 0 "[ . 1 . 2]" 1
1821 1 39 PHE QE 1 51 GLU QB . . 3.860 2.570 1.974 3.802 . 0 0 "[ . 1 . 2]" 1
1822 1 39 PHE QE 1 51 GLU QG . . 4.140 3.266 1.762 4.241 0.101 8 0 "[ . 1 . 2]" 1
1823 1 40 ARG H 1 40 ARG QG . . 3.930 2.310 1.804 3.283 . 0 0 "[ . 1 . 2]" 1
1824 1 40 ARG H 1 40 ARG QD . . 5.210 3.837 1.955 4.392 . 0 0 "[ . 1 . 2]" 1
1825 1 40 ARG HA 1 40 ARG QD . . 4.580 3.839 2.025 4.292 . 0 0 "[ . 1 . 2]" 1
1826 1 40 ARG QG 1 41 HIS H . . 4.990 4.060 3.557 4.697 . 0 0 "[ . 1 . 2]" 1
1827 1 41 HIS QB 1 41 HIS HD2 . . 3.370 3.142 2.800 3.297 . 0 0 "[ . 1 . 2]" 1
1828 1 42 LYS QB 1 42 LYS QE . . 4.080 3.095 1.702 3.716 . 0 0 "[ . 1 . 2]" 1
1829 1 42 LYS QB 1 43 LEU H . . 4.070 3.714 3.473 3.918 . 0 0 "[ . 1 . 2]" 1
1830 1 42 LYS QB 1 47 ILE MD . . 3.970 2.599 1.944 3.298 . 0 0 "[ . 1 . 2]" 1
1831 1 42 LYS HG2 1 46 ASP QB . . 5.810 3.714 2.502 5.200 . 0 0 "[ . 1 . 2]" 1
1832 1 42 LYS QD 1 46 ASP QB . . 5.810 3.561 2.554 5.639 . 0 0 "[ . 1 . 2]" 1
1833 1 42 LYS QE 1 46 ASP QB . . 4.290 3.748 2.430 4.517 0.227 2 0 "[ . 1 . 2]" 1
1834 1 43 LEU H 1 43 LEU QB . . 3.480 2.467 2.376 2.571 . 0 0 "[ . 1 . 2]" 1
1835 1 43 LEU H 1 46 ASP QB . . 4.700 2.650 2.021 4.591 . 0 0 "[ . 1 . 2]" 1
1836 1 43 LEU QB 1 45 LYS QG . . 4.110 2.553 1.951 3.034 . 0 0 "[ . 1 . 2]" 1
1837 1 43 LEU QB 1 46 ASP H . . 4.090 2.824 2.498 3.316 . 0 0 "[ . 1 . 2]" 1
1838 1 43 LEU QB 1 46 ASP QB . . 4.080 2.053 1.475 3.520 . 0 0 "[ . 1 . 2]" 1
1839 1 43 LEU HG 1 46 ASP QB . . 5.040 3.610 3.053 5.044 0.004 9 0 "[ . 1 . 2]" 1
1840 1 43 LEU MD1 1 45 LYS QG . . 4.140 3.172 2.551 3.661 . 0 0 "[ . 1 . 2]" 1
1841 1 43 LEU MD1 1 45 LYS QD . . 4.740 3.324 2.375 4.783 0.043 12 0 "[ . 1 . 2]" 1
1842 1 43 LEU MD1 1 45 LYS QE . . 4.220 3.679 1.928 4.313 0.093 14 0 "[ . 1 . 2]" 1
1843 1 43 LEU MD1 1 46 ASP QB . . 3.880 3.063 2.237 3.932 0.052 9 0 "[ . 1 . 2]" 1
1844 1 44 LEU H 1 45 LYS QB . . 5.210 5.007 4.731 5.191 . 0 0 "[ . 1 . 2]" 1
1845 1 44 LEU H 1 45 LYS QG . . 4.630 3.890 3.612 4.277 . 0 0 "[ . 1 . 2]" 1
1846 1 44 LEU H 1 88 VAL QG . . 5.490 5.078 4.189 5.670 0.180 14 0 "[ . 1 . 2]" 1
1847 1 44 LEU HA 1 47 ILE QG . . 4.680 2.942 1.933 4.230 . 0 0 "[ . 1 . 2]" 1
1848 1 44 LEU QB 1 79 PHE QE . . 4.810 3.887 1.903 4.821 0.011 7 0 "[ . 1 . 2]" 1
1849 1 44 LEU QB 1 87 TYR QD . . 5.810 4.457 3.630 5.461 . 0 0 "[ . 1 . 2]" 1
1850 1 44 LEU QB 1 88 VAL QG . . 4.900 3.491 2.962 3.983 . 0 0 "[ . 1 . 2]" 1
1851 1 44 LEU HG 1 88 VAL QG . . 4.310 2.457 1.588 4.380 0.070 5 0 "[ . 1 . 2]" 1
1852 1 44 LEU QD 1 79 PHE QE . . 5.210 2.556 1.818 3.017 . 0 0 "[ . 1 . 2]" 1
1853 1 44 LEU QD 1 79 PHE HZ . . 3.850 3.356 2.726 3.939 0.089 3 0 "[ . 1 . 2]" 1
1854 1 44 LEU QD 1 82 ALA MB . . 5.400 2.294 1.937 2.735 . 0 0 "[ . 1 . 2]" 1
1855 1 44 LEU QD 1 87 TYR QB . . 5.920 3.377 2.619 3.894 . 0 0 "[ . 1 . 2]" 1
1856 1 45 LYS HA 1 45 LYS QD . . 4.750 4.208 3.689 4.559 . 0 0 "[ . 1 . 2]" 1
1857 1 45 LYS HA 1 88 VAL QG . . 3.770 2.420 1.498 3.223 . 0 0 "[ . 1 . 2]" 1
1858 1 45 LYS QB 1 45 LYS QE . . 3.980 2.499 1.797 3.643 . 0 0 "[ . 1 . 2]" 1
1859 1 45 LYS QB 1 88 VAL QG . . 5.130 2.189 1.527 2.892 . 0 0 "[ . 1 . 2]" 1
1860 1 45 LYS QG 1 46 ASP HA . . 5.510 4.009 3.206 5.059 . 0 0 "[ . 1 . 2]" 1
1861 1 45 LYS QG 1 46 ASP QB . . 4.260 3.397 2.781 4.103 . 0 0 "[ . 1 . 2]" 1
1862 1 45 LYS QG 1 88 VAL HB . . 5.810 5.629 5.225 5.934 0.124 9 0 "[ . 1 . 2]" 1
1863 1 45 LYS QG 1 88 VAL QG . . 4.810 3.737 2.946 4.355 . 0 0 "[ . 1 . 2]" 1
1864 1 45 LYS QE 1 46 ASP HA . . 5.090 4.538 3.611 5.295 0.205 7 0 "[ . 1 . 2]" 1
1865 1 45 LYS QE 1 88 VAL QG . . 5.280 4.757 3.558 5.389 0.109 7 0 "[ . 1 . 2]" 1
1866 1 45 LYS QE 1 89 ILE MG . . 5.810 4.955 2.899 5.862 0.052 8 0 "[ . 1 . 2]" 1
1867 1 46 ASP H 1 46 ASP QB . . 3.650 2.430 2.324 3.059 . 0 0 "[ . 1 . 2]" 1
1868 1 46 ASP H 1 47 ILE QG . . 5.810 3.438 2.872 5.056 . 0 0 "[ . 1 . 2]" 1
1869 1 46 ASP H 1 88 VAL QG . . 5.920 4.761 4.300 5.360 . 0 0 "[ . 1 . 2]" 1
1870 1 46 ASP QB 1 47 ILE MD . . 5.140 3.714 2.726 5.146 0.006 2 0 "[ . 1 . 2]" 1
1871 1 47 ILE H 1 47 ILE QG . . 3.990 2.380 1.877 3.561 . 0 0 "[ . 1 . 2]" 1
1872 1 47 ILE HA 1 48 LYS QG . . 5.810 4.374 3.485 5.885 0.075 19 0 "[ . 1 . 2]" 1
1873 1 47 ILE HA 1 51 GLU QB . . 5.680 3.862 2.393 5.441 . 0 0 "[ . 1 . 2]" 1
1874 1 47 ILE MG 1 51 GLU QB . . 4.610 3.231 1.949 4.484 . 0 0 "[ . 1 . 2]" 1
1875 1 47 ILE MG 1 51 GLU QG . . 5.300 4.220 2.737 5.205 . 0 0 "[ . 1 . 2]" 1
1876 1 47 ILE MG 1 52 TYR QB . . 4.190 2.477 2.132 2.953 . 0 0 "[ . 1 . 2]" 1
1877 1 47 ILE MG 1 92 PRO QB . . 4.800 2.481 2.140 3.180 . 0 0 "[ . 1 . 2]" 1
1878 1 47 ILE MG 1 92 PRO QG . . 4.520 2.551 1.985 3.052 . 0 0 "[ . 1 . 2]" 1
1879 1 47 ILE QG 1 79 PHE QE . . 5.810 3.514 2.780 5.004 . 0 0 "[ . 1 . 2]" 1
1880 1 47 ILE QG 1 79 PHE HZ . . 4.990 2.500 1.547 4.217 . 0 0 "[ . 1 . 2]" 1
1881 1 48 LYS H 1 48 LYS QG . . 4.250 2.809 1.998 4.058 . 0 0 "[ . 1 . 2]" 1
1882 1 48 LYS H 1 51 GLU QB . . 4.460 2.802 1.584 4.349 . 0 0 "[ . 1 . 2]" 1
1883 1 48 LYS H 1 51 GLU QG . . 4.740 3.216 2.085 4.072 . 0 0 "[ . 1 . 2]" 1
1884 1 48 LYS HA 1 92 PRO QB . . 5.370 3.760 1.886 4.793 . 0 0 "[ . 1 . 2]" 1
1885 1 48 LYS QB 1 50 THR H . . 5.810 2.913 2.424 3.749 . 0 0 "[ . 1 . 2]" 1
1886 1 48 LYS QB 1 51 GLU H . . 4.320 2.529 1.918 4.015 . 0 0 "[ . 1 . 2]" 1
1887 1 48 LYS QB 1 51 GLU QB . . 4.020 2.712 1.487 4.179 0.159 20 0 "[ . 1 . 2]" 1
1888 1 48 LYS QB 1 51 GLU QG . . 4.600 2.556 1.389 4.087 . 0 0 "[ . 1 . 2]" 1
1889 1 48 LYS QG 1 51 GLU H . . 5.650 4.092 2.182 5.037 . 0 0 "[ . 1 . 2]" 1
1890 1 49 ARG HA 1 49 ARG QG . . 3.570 3.064 2.246 3.368 . 0 0 "[ . 1 . 2]" 1
1891 1 49 ARG HA 1 52 TYR QB . . 3.940 2.549 2.107 3.068 . 0 0 "[ . 1 . 2]" 1
1892 1 49 ARG HA 1 92 PRO QB . . 4.210 2.613 1.831 3.453 . 0 0 "[ . 1 . 2]" 1
1893 1 49 ARG QG 1 50 THR H . . 5.810 2.940 2.140 4.568 . 0 0 "[ . 1 . 2]" 1
1894 1 49 ARG QG 1 53 GLN H . . 5.810 5.488 5.013 5.934 0.124 18 0 "[ . 1 . 2]" 1
1895 1 49 ARG QG 1 92 PRO HA . . 4.420 3.650 1.401 4.532 0.112 7 0 "[ . 1 . 2]" 1
1896 1 50 THR HA 1 53 GLN QG . . 5.810 4.148 3.681 4.743 . 0 0 "[ . 1 . 2]" 1
1897 1 50 THR MG 1 53 GLN QB . . 5.610 3.816 2.992 4.405 . 0 0 "[ . 1 . 2]" 1
1898 1 50 THR MG 1 53 GLN QG . . 5.340 4.610 3.275 5.384 0.044 10 0 "[ . 1 . 2]" 1
1899 1 51 GLU H 1 51 GLU QB . . 3.690 2.398 2.103 2.742 . 0 0 "[ . 1 . 2]" 1
1900 1 51 GLU HA 1 51 GLU QG . . 3.400 2.788 2.388 3.350 . 0 0 "[ . 1 . 2]" 1
1901 1 51 GLU HA 1 54 LYS QG . . 5.810 3.341 2.111 4.531 . 0 0 "[ . 1 . 2]" 1
1902 1 51 GLU QB 1 52 TYR H . . 3.930 2.609 2.276 3.516 . 0 0 "[ . 1 . 2]" 1
1903 1 51 GLU QB 1 54 LYS H . . 5.810 4.833 4.528 5.065 . 0 0 "[ . 1 . 2]" 1
1904 1 51 GLU QG 1 52 TYR H . . 5.180 3.888 2.288 4.546 . 0 0 "[ . 1 . 2]" 1
1905 1 51 GLU QG 1 54 LYS H . . 5.810 5.449 4.871 5.895 0.085 20 0 "[ . 1 . 2]" 1
1906 1 52 TYR QB 1 53 GLN H . . 4.190 2.577 2.390 2.678 . 0 0 "[ . 1 . 2]" 1
1907 1 52 TYR QB 1 54 LYS H . . 5.810 4.804 4.673 5.014 . 0 0 "[ . 1 . 2]" 1
1908 1 52 TYR QB 1 92 PRO QB . . 5.560 2.618 1.926 3.208 . 0 0 "[ . 1 . 2]" 1
1909 1 52 TYR QB 1 93 THR H . . 5.810 5.248 3.261 5.559 . 0 0 "[ . 1 . 2]" 1
1910 1 52 TYR QE 1 75 ILE QG . . 5.160 3.643 2.121 4.131 . 0 0 "[ . 1 . 2]" 1
1911 1 52 TYR HH 1 72 ASN QB . . 5.800 3.683 2.698 4.413 . 0 0 "[ . 1 . 2]" 1
1912 1 53 GLN H 1 53 GLN QB . . 3.500 2.221 2.095 2.279 . 0 0 "[ . 1 . 2]" 1
1913 1 53 GLN H 1 53 GLN QG . . 4.530 3.980 3.761 4.068 . 0 0 "[ . 1 . 2]" 1
1914 1 53 GLN H 1 53 GLN QE . . 5.810 4.934 3.856 5.852 0.042 19 0 "[ . 1 . 2]" 1
1915 1 53 GLN H 1 92 PRO QB . . 5.810 5.430 4.835 5.903 0.093 3 0 "[ . 1 . 2]" 1
1916 1 53 GLN HA 1 53 GLN QE . . 4.780 2.966 2.329 4.790 0.010 19 0 "[ . 1 . 2]" 1
1917 1 53 GLN HA 1 56 LEU QB . . 4.370 2.821 2.494 3.429 . 0 0 "[ . 1 . 2]" 1
1918 1 53 GLN QB 1 54 LYS H . . 3.950 2.503 2.261 2.680 . 0 0 "[ . 1 . 2]" 1
1919 1 53 GLN QG 1 54 LYS H . . 4.830 3.793 2.838 4.435 . 0 0 "[ . 1 . 2]" 1
1920 1 53 GLN QG 1 54 LYS HA . . 5.810 4.106 3.241 5.331 . 0 0 "[ . 1 . 2]" 1
1921 1 53 GLN QG 1 57 ASN QD . . 4.250 2.964 2.050 3.878 . 0 0 "[ . 1 . 2]" 1
1922 1 53 GLN QE 1 54 LYS H . . 5.090 4.753 3.198 5.303 0.213 4 0 "[ . 1 . 2]" 1
1923 1 53 GLN QE 1 56 LEU QB . . 5.600 3.260 2.061 5.444 . 0 0 "[ . 1 . 2]" 1
1924 1 53 GLN QE 1 56 LEU MD1 . . 5.810 3.603 2.474 5.722 . 0 0 "[ . 1 . 2]" 1
1925 1 53 GLN QE 1 57 ASN H . . 5.420 3.841 2.787 5.464 0.044 11 0 "[ . 1 . 2]" 1
1926 1 53 GLN QE 1 57 ASN QD . . 5.610 3.090 2.075 5.504 . 0 0 "[ . 1 . 2]" 1
1927 1 53 GLN QE 1 97 GLU QB . . 4.920 3.260 1.791 4.935 0.015 17 0 "[ . 1 . 2]" 1
1928 1 54 LYS H 1 54 LYS QG . . 4.030 2.827 1.919 4.011 . 0 0 "[ . 1 . 2]" 1
1929 1 54 LYS HA 1 57 ASN QB . . 3.990 2.599 2.198 3.839 . 0 0 "[ . 1 . 2]" 1
1930 1 54 LYS HA 1 57 ASN QD . . 4.410 3.155 1.951 4.401 . 0 0 "[ . 1 . 2]" 1
1931 1 54 LYS QG 1 55 PHE H . . 5.810 4.096 2.379 4.623 . 0 0 "[ . 1 . 2]" 1
1932 1 55 PHE HA 1 58 GLU QG . . 5.810 4.410 2.904 5.491 . 0 0 "[ . 1 . 2]" 1
1933 1 56 LEU H 1 56 LEU QB . . 3.650 2.416 2.344 2.450 . 0 0 "[ . 1 . 2]" 1
1934 1 56 LEU HA 1 59 TYR QB . . 4.220 2.550 2.440 2.785 . 0 0 "[ . 1 . 2]" 1
1935 1 56 LEU QB 1 57 ASN H . . 4.080 2.590 2.484 2.771 . 0 0 "[ . 1 . 2]" 1
1936 1 56 LEU QB 1 58 GLU H . . 5.810 4.809 4.595 4.992 . 0 0 "[ . 1 . 2]" 1
1937 1 56 LEU MD1 1 72 ASN QB . . 5.040 3.419 3.020 4.188 . 0 0 "[ . 1 . 2]" 1
1938 1 56 LEU MD1 1 72 ASN QD . . 5.070 3.846 2.190 5.060 . 0 0 "[ . 1 . 2]" 1
1939 1 56 LEU MD2 1 59 TYR QB . . 5.670 3.365 3.085 3.680 . 0 0 "[ . 1 . 2]" 1
1940 1 56 LEU MD2 1 72 ASN QB . . 4.450 2.899 2.610 3.375 . 0 0 "[ . 1 . 2]" 1
1941 1 56 LEU MD2 1 72 ASN QD . . 5.350 4.359 2.731 5.270 . 0 0 "[ . 1 . 2]" 1
1942 1 57 ASN H 1 57 ASN QB . . 3.640 2.347 2.135 2.598 . 0 0 "[ . 1 . 2]" 1
1943 1 57 ASN H 1 57 ASN QD . . 5.210 3.470 2.061 4.332 . 0 0 "[ . 1 . 2]" 1
1944 1 57 ASN QB 1 58 GLU H . . 4.020 2.519 2.180 3.667 . 0 0 "[ . 1 . 2]" 1
1945 1 57 ASN QB 1 58 GLU HA . . 5.430 3.890 3.731 4.594 . 0 0 "[ . 1 . 2]" 1
1946 1 58 GLU H 1 61 LEU QB . . 5.810 5.382 5.082 5.734 . 0 0 "[ . 1 . 2]" 1
1947 1 58 GLU QG 1 59 TYR H . . 5.740 3.897 3.570 4.333 . 0 0 "[ . 1 . 2]" 1
1948 1 58 GLU QG 1 61 LEU MD1 . . 4.390 3.738 2.824 4.215 . 0 0 "[ . 1 . 2]" 1
1949 1 59 TYR QB 1 60 GLY H . . 4.290 2.638 2.423 2.731 . 0 0 "[ . 1 . 2]" 1
1950 1 59 TYR QB 1 68 ILE MG . . 5.810 4.808 4.386 5.367 . 0 0 "[ . 1 . 2]" 1
1951 1 59 TYR QB 1 68 ILE MD . . 5.450 2.869 2.483 3.272 . 0 0 "[ . 1 . 2]" 1
1952 1 59 TYR QB 1 71 LEU MD2 . . 5.090 2.864 2.560 2.966 . 0 0 "[ . 1 . 2]" 1
1953 1 59 TYR QD 1 60 GLY QA . . 3.720 3.385 2.918 3.731 0.011 13 0 "[ . 1 . 2]" 1
1954 1 59 TYR QD 1 63 HIS QB . . 3.970 2.983 2.830 3.268 . 0 0 "[ . 1 . 2]" 1
1955 1 59 TYR QE 1 63 HIS QB . . 3.800 2.792 2.627 3.032 . 0 0 "[ . 1 . 2]" 1
1956 1 59 TYR QE 1 71 LEU QB . . 3.730 3.224 3.055 3.430 . 0 0 "[ . 1 . 2]" 1
1957 1 60 GLY QA 1 62 THR H . . 5.800 3.507 3.288 3.925 . 0 0 "[ . 1 . 2]" 1
1958 1 60 GLY QA 1 63 HIS H . . 4.340 3.178 2.850 3.372 . 0 0 "[ . 1 . 2]" 1
1959 1 60 GLY QA 1 68 ILE HG12 . . 5.710 4.869 4.579 5.115 . 0 0 "[ . 1 . 2]" 1
1960 1 60 GLY QA 1 100 ALA HA . . 3.950 2.453 1.943 3.307 . 0 0 "[ . 1 . 2]" 1
1961 1 60 GLY QA 1 100 ALA MB . . 5.120 3.051 2.416 3.721 . 0 0 "[ . 1 . 2]" 1
1962 1 61 LEU H 1 61 LEU QB . . 3.460 2.393 2.339 2.451 . 0 0 "[ . 1 . 2]" 1
1963 1 61 LEU QB 1 62 THR H . . 4.200 3.092 2.709 3.276 . 0 0 "[ . 1 . 2]" 1
1964 1 61 LEU QB 1 62 THR MG . . 3.660 2.880 2.742 3.154 . 0 0 "[ . 1 . 2]" 1
1965 1 61 LEU QB 1 102 VAL MG2 . . 5.370 4.060 3.819 4.516 . 0 0 "[ . 1 . 2]" 1
1966 1 63 HIS QB 1 63 HIS HD2 . . 3.400 2.706 2.638 2.855 . 0 0 "[ . 1 . 2]" 1
1967 1 63 HIS QB 1 64 SER H . . 4.160 2.366 1.774 2.832 . 0 0 "[ . 1 . 2]" 1
1968 1 63 HIS QB 1 67 THR HB . . 3.980 2.118 1.880 2.608 . 0 0 "[ . 1 . 2]" 1
1969 1 63 HIS QB 1 67 THR MG . . 3.960 2.544 2.181 2.842 . 0 0 "[ . 1 . 2]" 1
1970 1 63 HIS QB 1 68 ILE H . . 5.810 3.695 3.457 4.008 . 0 0 "[ . 1 . 2]" 1
1971 1 63 HIS QB 1 68 ILE MG . . 5.050 4.225 3.984 4.687 . 0 0 "[ . 1 . 2]" 1
1972 1 63 HIS QB 1 68 ILE MD . . 5.810 4.683 4.256 4.960 . 0 0 "[ . 1 . 2]" 1
1973 1 63 HIS QB 1 102 VAL MG2 . . 5.580 4.512 4.034 5.048 . 0 0 "[ . 1 . 2]" 1
1974 1 64 SER HA 1 65 TYR QB . . 5.190 4.285 4.210 4.381 . 0 0 "[ . 1 . 2]" 1
1975 1 64 SER QB 1 65 TYR H . . 3.960 2.651 2.029 3.355 . 0 0 "[ . 1 . 2]" 1
1976 1 64 SER QB 1 66 GLU H . . 4.090 3.108 2.787 3.595 . 0 0 "[ . 1 . 2]" 1
1977 1 64 SER QB 1 67 THR H . . 4.180 2.978 2.629 3.694 . 0 0 "[ . 1 . 2]" 1
1978 1 64 SER QB 1 102 VAL MG1 . . 5.810 4.625 3.501 5.543 . 0 0 "[ . 1 . 2]" 1
1979 1 65 TYR QB 1 66 GLU H . . 3.920 2.619 2.503 2.837 . 0 0 "[ . 1 . 2]" 1
1980 1 65 TYR QB 1 66 GLU HA . . 5.730 4.173 4.036 4.254 . 0 0 "[ . 1 . 2]" 1
1981 1 65 TYR QB 1 68 ILE MG . . 5.430 3.713 3.549 3.895 . 0 0 "[ . 1 . 2]" 1
1982 1 65 TYR QB 1 100 ALA MB . . 4.410 2.639 2.199 3.348 . 0 0 "[ . 1 . 2]" 1
1983 1 65 TYR QD 1 69 ARG QG . . 5.690 4.745 3.466 5.334 . 0 0 "[ . 1 . 2]" 1
1984 1 65 TYR QD 1 69 ARG QD . . 5.800 3.746 3.093 4.903 . 0 0 "[ . 1 . 2]" 1
1985 1 65 TYR QD 1 98 LEU QB . . 3.810 3.111 2.755 3.406 . 0 0 "[ . 1 . 2]" 1
1986 1 65 TYR QE 1 69 ARG QB . . 4.640 3.611 3.064 4.761 0.121 5 0 "[ . 1 . 2]" 1
1987 1 65 TYR QE 1 69 ARG QG . . 5.190 3.822 2.435 4.617 . 0 0 "[ . 1 . 2]" 1
1988 1 65 TYR QE 1 69 ARG QD . . 3.240 2.520 2.011 3.373 0.133 14 0 "[ . 1 . 2]" 1
1989 1 65 TYR QE 1 98 LEU QB . . 2.990 2.085 1.920 2.297 . 0 0 "[ . 1 . 2]" 1
1990 1 66 GLU H 1 66 GLU QB . . 3.500 2.262 2.127 2.364 . 0 0 "[ . 1 . 2]" 1
1991 1 66 GLU H 1 69 ARG QB . . 5.810 4.473 4.175 4.977 . 0 0 "[ . 1 . 2]" 1
1992 1 66 GLU HA 1 69 ARG QD . . 4.960 3.422 2.515 4.540 . 0 0 "[ . 1 . 2]" 1
1993 1 66 GLU QB 1 68 ILE H . . 5.700 4.908 4.708 5.063 . 0 0 "[ . 1 . 2]" 1
1994 1 66 GLU QB 1 70 LYS QE . . 5.550 4.016 2.411 5.564 0.014 20 0 "[ . 1 . 2]" 1
1995 1 66 GLU HG2 1 69 ARG QB . . 5.810 3.926 3.526 4.512 . 0 0 "[ . 1 . 2]" 1
1996 1 66 GLU HG2 1 70 LYS QD . . 5.290 3.889 1.766 4.921 . 0 0 "[ . 1 . 2]" 1
1997 1 66 GLU HG3 1 69 ARG QB . . 5.810 4.439 3.143 5.802 . 0 0 "[ . 1 . 2]" 1
1998 1 67 THR H 1 69 ARG QB . . 5.450 4.579 4.320 4.892 . 0 0 "[ . 1 . 2]" 1
1999 1 67 THR HA 1 69 ARG QB . . 5.810 4.963 4.689 5.362 . 0 0 "[ . 1 . 2]" 1
2000 1 67 THR HA 1 70 LYS QB . . 4.400 3.090 2.307 4.241 . 0 0 "[ . 1 . 2]" 1
2001 1 68 ILE HA 1 71 LEU QB . . 4.000 2.196 1.956 2.368 . 0 0 "[ . 1 . 2]" 1
2002 1 68 ILE MG 1 69 ARG QG . . 5.600 4.419 2.895 4.932 . 0 0 "[ . 1 . 2]" 1
2003 1 68 ILE MG 1 71 LEU QB . . 5.730 4.484 4.373 4.566 . 0 0 "[ . 1 . 2]" 1
2004 1 68 ILE MG 1 72 ASN QB . . 5.810 4.493 4.158 4.712 . 0 0 "[ . 1 . 2]" 1
2005 1 68 ILE MG 1 98 LEU QB . . 3.900 2.555 2.165 3.027 . 0 0 "[ . 1 . 2]" 1
2006 1 68 ILE MD 1 98 LEU QB . . 4.660 3.061 2.601 3.494 . 0 0 "[ . 1 . 2]" 1
2007 1 69 ARG H 1 69 ARG QG . . 4.130 3.807 2.459 4.050 . 0 0 "[ . 1 . 2]" 1
2008 1 69 ARG H 1 69 ARG QD . . 5.260 4.456 4.087 4.890 . 0 0 "[ . 1 . 2]" 1
2009 1 69 ARG HA 1 69 ARG QD . . 5.000 3.921 2.063 4.130 . 0 0 "[ . 1 . 2]" 1
2010 1 69 ARG HA 1 72 ASN QB . . 4.550 2.798 2.224 3.135 . 0 0 "[ . 1 . 2]" 1
2011 1 69 ARG QB 1 69 ARG QD . . 3.330 2.217 2.084 2.403 . 0 0 "[ . 1 . 2]" 1
2012 1 69 ARG QB 1 70 LYS H . . 3.430 2.417 2.301 2.539 . 0 0 "[ . 1 . 2]" 1
2013 1 69 ARG QB 1 98 LEU MD1 . . 4.720 2.618 2.073 3.589 . 0 0 "[ . 1 . 2]" 1
2014 1 69 ARG QB 1 98 LEU MD2 . . 5.400 3.903 3.187 4.803 . 0 0 "[ . 1 . 2]" 1
2015 1 69 ARG QG 1 70 LYS H . . 5.540 3.653 3.029 4.158 . 0 0 "[ . 1 . 2]" 1
2016 1 69 ARG QG 1 73 SER H . . 5.810 4.548 4.061 5.880 0.070 15 0 "[ . 1 . 2]" 1
2017 1 69 ARG QG 1 98 LEU MD1 . . 3.970 2.318 1.452 3.551 . 0 0 "[ . 1 . 2]" 1
2018 1 69 ARG QG 1 98 LEU MD2 . . 5.060 3.957 3.097 4.904 . 0 0 "[ . 1 . 2]" 1
2019 1 69 ARG QD 1 98 LEU MD1 . . 5.220 3.388 1.884 4.335 . 0 0 "[ . 1 . 2]" 1
2020 1 70 LYS H 1 70 LYS QB . . 3.540 2.215 2.051 2.588 . 0 0 "[ . 1 . 2]" 1
2021 1 70 LYS H 1 70 LYS QD . . 5.730 3.339 2.354 4.748 . 0 0 "[ . 1 . 2]" 1
2022 1 70 LYS HA 1 70 LYS QG . . 3.740 2.440 2.087 3.363 . 0 0 "[ . 1 . 2]" 1
2023 1 70 LYS QB 1 70 LYS QE . . 3.890 2.734 1.877 3.851 . 0 0 "[ . 1 . 2]" 1
2024 1 70 LYS QB 1 71 LEU H . . 3.920 2.729 2.388 3.498 . 0 0 "[ . 1 . 2]" 1
2025 1 70 LYS QB 1 74 TYR QE . . 4.990 2.953 2.340 3.731 . 0 0 "[ . 1 . 2]" 1
2026 1 70 LYS QG 1 71 LEU H . . 5.220 4.010 2.167 4.511 . 0 0 "[ . 1 . 2]" 1
2027 1 70 LYS QG 1 73 SER H . . 5.810 5.188 4.706 5.682 . 0 0 "[ . 1 . 2]" 1
2028 1 70 LYS QG 1 74 TYR QE . . 3.710 3.157 2.639 3.606 . 0 0 "[ . 1 . 2]" 1
2029 1 71 LEU H 1 72 ASN QB . . 5.760 4.532 4.399 4.647 . 0 0 "[ . 1 . 2]" 1
2030 1 71 LEU QB 1 72 ASN H . . 4.010 2.316 2.212 2.449 . 0 0 "[ . 1 . 2]" 1
2031 1 71 LEU QB 1 73 SER H . . 5.750 4.595 4.457 4.831 . 0 0 "[ . 1 . 2]" 1
2032 1 71 LEU MD1 1 75 ILE QG . . 4.810 2.728 2.414 3.136 . 0 0 "[ . 1 . 2]" 1
2033 1 72 ASN H 1 72 ASN QD . . 5.170 4.458 4.257 4.544 . 0 0 "[ . 1 . 2]" 1
2034 1 72 ASN QB 1 73 SER H . . 3.960 2.581 2.391 2.776 . 0 0 "[ . 1 . 2]" 1
2035 1 72 ASN QB 1 98 LEU MD1 . . 5.040 3.037 2.447 3.630 . 0 0 "[ . 1 . 2]" 1
2036 1 72 ASN QB 1 98 LEU MD2 . . 4.060 2.006 1.797 2.316 . 0 0 "[ . 1 . 2]" 1
2037 1 72 ASN QD 1 73 SER H . . 5.740 4.242 3.277 5.084 . 0 0 "[ . 1 . 2]" 1
2038 1 72 ASN QD 1 76 ARG QD . . 4.990 3.541 2.435 4.403 . 0 0 "[ . 1 . 2]" 1
2039 1 72 ASN QD 1 93 THR MG . . 5.160 3.800 1.910 5.182 0.022 2 0 "[ . 1 . 2]" 1
2040 1 72 ASN QD 1 96 ALA MB . . 4.500 3.201 2.097 4.396 . 0 0 "[ . 1 . 2]" 1
2041 1 72 ASN QD 1 98 LEU HG . . 5.810 3.864 2.903 5.123 . 0 0 "[ . 1 . 2]" 1
2042 1 72 ASN QD 1 98 LEU MD1 . . 4.640 3.086 1.854 4.669 0.029 11 0 "[ . 1 . 2]" 1
2043 1 73 SER HA 1 76 ARG QB . . 3.610 2.753 2.278 3.582 . 0 0 "[ . 1 . 2]" 1
2044 1 74 TYR HA 1 77 ASN QD . . 5.790 5.347 2.904 5.880 0.090 2 0 "[ . 1 . 2]" 1
2045 1 74 TYR QB 1 75 ILE QG . . 5.440 2.900 2.735 3.237 . 0 0 "[ . 1 . 2]" 1
2046 1 75 ILE H 1 75 ILE QG . . 4.080 2.100 1.905 2.188 . 0 0 "[ . 1 . 2]" 1
2047 1 76 ARG HA 1 79 PHE QB . . 4.730 2.910 2.546 3.275 . 0 0 "[ . 1 . 2]" 1
2048 1 76 ARG HA 1 91 ASN QD . . 5.240 4.193 2.455 5.174 . 0 0 "[ . 1 . 2]" 1
2049 1 76 ARG QB 1 77 ASN H . . 4.210 2.605 2.332 3.486 . 0 0 "[ . 1 . 2]" 1
2050 1 76 ARG QB 1 93 THR MG . . 4.990 2.853 1.534 4.014 . 0 0 "[ . 1 . 2]" 1
2051 1 76 ARG QG 1 77 ASN H . . 5.540 3.761 2.276 4.432 . 0 0 "[ . 1 . 2]" 1
2052 1 76 ARG QG 1 91 ASN QD . . 5.150 4.032 2.768 5.184 0.034 20 0 "[ . 1 . 2]" 1
2053 1 76 ARG QG 1 93 THR HG1 . . 5.620 3.464 2.340 4.633 . 0 0 "[ . 1 . 2]" 1
2054 1 77 ASN H 1 77 ASN QB . . 3.560 2.256 2.205 2.334 . 0 0 "[ . 1 . 2]" 1
2055 1 77 ASN HA 1 77 ASN QD . . 3.790 2.432 1.653 3.820 0.030 15 0 "[ . 1 . 2]" 1
2056 1 77 ASN HA 1 80 ASP QB . . 3.370 2.328 1.910 2.683 . 0 0 "[ . 1 . 2]" 1
2057 1 77 ASN QD 1 80 ASP QB . . 5.610 3.473 2.204 5.270 . 0 0 "[ . 1 . 2]" 1
2058 1 78 ALA H 1 79 PHE QB . . 5.810 4.584 4.503 4.644 . 0 0 "[ . 1 . 2]" 1
2059 1 78 ALA H 1 80 ASP QB . . 5.810 4.646 4.436 4.838 . 0 0 "[ . 1 . 2]" 1
2060 1 78 ALA H 1 81 ASP QB . . 5.810 5.020 4.675 5.528 . 0 0 "[ . 1 . 2]" 1
2061 1 78 ALA HA 1 81 ASP QB . . 4.910 3.024 2.557 3.260 . 0 0 "[ . 1 . 2]" 1
2062 1 78 ALA MB 1 79 PHE QB . . 5.760 4.058 3.965 4.143 . 0 0 "[ . 1 . 2]" 1
2063 1 78 ALA MB 1 81 ASP QB . . 5.810 4.217 3.815 4.393 . 0 0 "[ . 1 . 2]" 1
2064 1 79 PHE QB 1 83 ILE MD . . 5.810 4.471 2.958 5.006 . 0 0 "[ . 1 . 2]" 1
2065 1 79 PHE QB 1 88 VAL QG . . 5.730 3.520 2.728 4.651 . 0 0 "[ . 1 . 2]" 1
2066 1 79 PHE QB 1 91 ASN QD . . 4.610 2.735 1.840 3.455 . 0 0 "[ . 1 . 2]" 1
2067 1 79 PHE QB 1 92 PRO QG . . 5.620 4.592 3.751 5.414 . 0 0 "[ . 1 . 2]" 1
2068 1 79 PHE QB 1 93 THR MG . . 5.660 3.708 2.701 5.096 . 0 0 "[ . 1 . 2]" 1
2069 1 79 PHE QB 1 93 THR HG1 . . 5.810 4.436 3.011 5.825 0.015 18 0 "[ . 1 . 2]" 1
2070 1 79 PHE QD 1 88 VAL QG . . 3.830 2.294 1.802 3.225 . 0 0 "[ . 1 . 2]" 1
2071 1 79 PHE QE 1 88 VAL QG . . 4.200 2.676 1.899 3.443 . 0 0 "[ . 1 . 2]" 1
2072 1 80 ASP H 1 80 ASP QB . . 3.580 2.254 2.211 2.355 . 0 0 "[ . 1 . 2]" 1
2073 1 80 ASP H 1 91 ASN QD . . 5.180 3.959 2.666 4.779 . 0 0 "[ . 1 . 2]" 1
2074 1 80 ASP HA 1 91 ASN QD . . 4.510 3.305 2.177 4.434 . 0 0 "[ . 1 . 2]" 1
2075 1 80 ASP QB 1 91 ASN QD . . 5.610 3.786 2.519 5.192 . 0 0 "[ . 1 . 2]" 1
2076 1 81 ASP HA 1 84 HIS QB . . 3.650 2.666 2.155 3.154 . 0 0 "[ . 1 . 2]" 1
2077 1 82 ALA HA 1 85 GLU QB . . 4.610 3.293 2.636 4.216 . 0 0 "[ . 1 . 2]" 1
2078 1 82 ALA MB 1 88 VAL QG . . 4.620 2.124 1.802 2.986 . 0 0 "[ . 1 . 2]" 1
2079 1 83 ILE H 1 83 ILE QG . . 4.880 3.640 2.109 4.001 . 0 0 "[ . 1 . 2]" 1
2080 1 83 ILE H 1 84 HIS QB . . 5.810 4.375 4.168 4.713 . 0 0 "[ . 1 . 2]" 1
2081 1 83 ILE H 1 88 VAL QG . . 5.920 3.287 2.386 5.121 . 0 0 "[ . 1 . 2]" 1
2082 1 83 ILE HA 1 88 VAL QG . . 4.840 3.089 2.257 4.801 . 0 0 "[ . 1 . 2]" 1
2083 1 83 ILE QG 1 88 VAL QG . . 5.310 3.309 1.958 5.091 . 0 0 "[ . 1 . 2]" 1
2084 1 83 ILE MD 1 91 ASN QB . . 4.610 3.631 1.907 4.402 . 0 0 "[ . 1 . 2]" 1
2085 1 83 ILE MD 1 91 ASN QD . . 5.780 3.177 2.687 4.837 . 0 0 "[ . 1 . 2]" 1
2086 1 84 HIS QB 1 84 HIS HD2 . . 3.490 2.958 2.621 3.285 . 0 0 "[ . 1 . 2]" 1
2087 1 84 HIS QB 1 85 GLU QG . . 5.610 3.831 2.824 5.599 . 0 0 "[ . 1 . 2]" 1
2088 1 85 GLU HA 1 85 GLU QG . . 3.690 2.746 2.341 3.348 . 0 0 "[ . 1 . 2]" 1
2089 1 85 GLU QB 1 87 TYR QD . . 5.810 4.289 3.279 5.607 . 0 0 "[ . 1 . 2]" 1
2090 1 85 GLU QG 1 86 GLY H . . 5.810 4.158 2.577 4.907 . 0 0 "[ . 1 . 2]" 1
2091 1 87 TYR HA 1 88 VAL QG . . 5.920 4.485 3.881 5.034 . 0 0 "[ . 1 . 2]" 1
2092 1 87 TYR QB 1 88 VAL QG . . 4.910 3.054 2.348 3.853 . 0 0 "[ . 1 . 2]" 1
2093 1 87 TYR QD 1 88 VAL QG . . 4.640 3.323 1.865 4.244 . 0 0 "[ . 1 . 2]" 1
2094 1 88 VAL QG 1 89 ILE HA . . 5.920 3.797 3.252 4.213 . 0 0 "[ . 1 . 2]" 1
2095 1 88 VAL QG 1 90 LYS H . . 5.900 2.997 1.914 5.002 . 0 0 "[ . 1 . 2]" 1
2096 1 88 VAL QG 1 90 LYS HA . . 5.660 4.132 3.054 5.703 0.043 12 0 "[ . 1 . 2]" 1
2097 1 88 VAL QG 1 92 PRO QD . . 5.710 3.580 2.274 4.792 . 0 0 "[ . 1 . 2]" 1
2098 1 92 PRO QG 1 93 THR H . . 5.120 3.560 2.670 4.325 . 0 0 "[ . 1 . 2]" 1
2099 1 94 TYR QD 1 95 LYS QB . . 4.100 2.832 2.020 3.825 . 0 0 "[ . 1 . 2]" 1
2100 1 94 TYR QD 1 95 LYS QG . . 4.460 2.845 1.671 4.509 0.049 17 0 "[ . 1 . 2]" 1
2101 1 94 TYR QE 1 95 LYS QG . . 4.670 3.960 2.992 4.793 0.123 13 0 "[ . 1 . 2]" 1
2102 1 96 ALA MB 1 97 GLU QG . . 5.130 4.678 4.166 5.375 0.245 9 0 "[ . 1 . 2]" 1
2103 1 97 GLU H 1 97 GLU QG . . 4.600 2.700 1.696 4.159 . 0 0 "[ . 1 . 2]" 1
2104 1 97 GLU HA 1 97 GLU QG . . 3.550 2.657 2.145 3.356 . 0 0 "[ . 1 . 2]" 1
2105 1 97 GLU QG 1 98 LEU H . . 5.160 3.879 2.290 4.690 . 0 0 "[ . 1 . 2]" 1
2106 1 97 GLU QG 1 98 LEU HG . . 5.810 5.595 4.499 5.939 0.129 4 0 "[ . 1 . 2]" 1
2107 1 98 LEU QB 1 100 ALA H . . 5.780 4.273 3.615 5.257 . 0 0 "[ . 1 . 2]" 1
2108 1 102 VAL H 1 103 LEU QB . . 5.810 4.742 3.560 5.603 . 0 0 "[ . 1 . 2]" 1
2109 1 102 VAL HA 1 103 LEU QB . . 5.810 5.148 4.568 5.494 . 0 0 "[ . 1 . 2]" 1
2110 1 103 LEU H 1 103 LEU QB . . 3.630 2.623 2.412 3.164 . 0 0 "[ . 1 . 2]" 1
2111 1 103 LEU H 1 103 LEU QD . . 4.770 3.150 2.214 3.819 . 0 0 "[ . 1 . 2]" 1
2112 1 103 LEU HA 1 103 LEU QD . . 3.080 2.355 1.927 3.360 0.280 18 0 "[ . 1 . 2]" 1
2113 1 103 LEU QB 1 104 GLU H . . 4.180 3.441 1.754 4.019 . 0 0 "[ . 1 . 2]" 1
2114 1 103 LEU QD 1 104 GLU H . . 4.990 3.862 2.830 4.466 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 90
_Distance_constraint_stats_list.Viol_count 1800
_Distance_constraint_stats_list.Viol_total 18535.621
_Distance_constraint_stats_list.Viol_max 0.915
_Distance_constraint_stats_list.Viol_rms 0.1712
_Distance_constraint_stats_list.Viol_average_all_restraints 0.5149
_Distance_constraint_stats_list.Viol_average_violations_only 0.5149
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ILE 25.662 0.915 20 15 "[****. * **-****** +]"
1 4 PHE 30.568 0.748 20 4 "[ .- * * . +]"
1 5 ALA 30.928 0.889 9 20 [********+*******-***]
1 6 ASP 20.650 0.743 20 13 "[** *. * *1*-**** * +]"
1 7 TYR 11.946 0.461 4 0 "[ . 1 . 2]"
1 8 PHE 38.868 0.757 15 19 "[** *****-*****+*****]"
1 9 TYR 45.509 0.889 9 20 [********+*******-***]
1 10 GLN 43.657 0.817 9 19 "[******* +**-********]"
1 11 TRP 11.946 0.461 4 0 "[ . 1 . 2]"
1 12 TYR 52.279 0.839 1 20 [+*******-***********]
1 13 GLU 14.582 0.478 1 0 "[ . 1 . 2]"
1 14 VAL 23.006 0.817 9 12 "[ ***** +* -*.** *2]"
1 15 ASN 29.425 0.839 1 20 [+**********-********]
1 21 SER 18.988 0.746 12 10 "[** *. - 1 + ** ***2]"
1 22 GLU 23.615 0.858 7 16 "[***** +*** -***** *2]"
1 24 THR 28.631 0.904 20 20 [*********-*********+]
1 25 LYS 33.736 0.746 12 11 "[****. - 1 + ** ***2]"
1 26 ARG 42.505 0.858 7 18 "[***** +******-*****2]"
1 27 HIS 19.386 0.681 1 9 "[+* . **1 -* * * *]"
1 28 TYR 41.335 0.904 20 20 [*********-*********+]
1 29 GLU 34.829 0.820 2 9 "[ +* .** *1 * .*- *2]"
1 30 SER 49.527 0.891 8 20 [*******+*****-******]
1 31 ALA 36.909 0.734 8 11 "[** .* +*1 -* * ** *]"
1 32 TYR 25.997 0.564 10 2 "[ . + - 2]"
1 33 LYS 46.041 0.829 17 19 "[****************+ **]"
1 34 HIS 56.126 0.891 8 20 [*******+-***********]
1 35 ILE 27.272 0.734 8 5 "[ - .* +*1 . * 2]"
1 36 LYS 13.294 0.564 10 2 "[ . + - 2]"
1 37 ASP 25.960 0.829 17 19 "[****************+ *-]"
1 38 HIS 25.489 0.842 1 19 "[+*******-******* ***]"
1 39 PHE 9.749 0.405 6 0 "[ . 1 . 2]"
1 42 LYS 14.554 0.748 20 3 "[ . * - . +]"
1 44 LEU 25.662 0.915 20 15 "[****. * **-****** +]"
1 48 LYS 19.959 0.727 2 11 "[*+ * **** *- . ** 2]"
1 49 ARG 24.053 0.851 14 17 "[* ****- ****+******]"
1 52 TYR 19.959 0.727 2 11 "[*+ * **** *- . ** 2]"
1 53 GLN 41.913 0.851 14 18 "[******* ****+*****-]"
1 54 LYS 24.282 0.871 6 15 "[****.+**** * ** -* *]"
1 55 PHE 24.776 0.810 11 18 "[**********+*-*.*** *]"
1 56 LEU 14.706 0.586 19 1 "[ . 1 . +2]"
1 57 ASN 17.860 0.741 18 8 "[*** . * 1* . *+ -]"
1 58 GLU 24.282 0.871 6 15 "[****.+**** * ** -* *]"
1 59 TYR 24.776 0.810 11 18 "[**********+*-*.*** *]"
1 60 GLY 14.706 0.586 19 1 "[ . 1 . +2]"
1 64 SER 27.874 0.874 14 20 [**-**********+******]
1 65 TYR 15.473 0.580 13 3 "[ * 1 + - 2]"
1 67 THR 22.606 0.862 16 14 "[****** * * *-*.+ * *]"
1 68 ILE 44.395 0.874 14 20 [********-****+******]
1 69 ARG 38.650 0.870 2 14 "[*+ ****** **- ** *]"
1 70 LYS 22.259 0.746 19 13 "[***** * - ***.* +*]"
1 71 LEU 46.822 0.862 16 20 [************-**+****]
1 72 ASN 32.832 0.599 20 7 "[* * **-1 * +]"
1 73 SER 46.418 0.870 2 20 [*+*********-********]
1 74 TYR 42.130 0.746 19 17 "[***** ***- ****** +*]"
1 75 ILE 46.194 0.770 3 20 [**+***-*************]
1 76 ARG 32.033 0.663 5 4 "[ + * 1 . - *]"
1 77 ASN 44.788 0.869 7 18 "[***** +****-***** **]"
1 78 ALA 48.135 0.873 5 20 [****+***********-***]
1 79 PHE 34.748 0.770 3 17 "[**+** -**** ****** *]"
1 80 ASP 15.722 0.663 5 3 "[ + 1 . - *]"
1 81 ASP 21.547 0.821 12 13 "[ ** ***-+**.** **]"
1 82 ALA 28.264 0.873 5 20 [****+***********-***]
1 83 ILE 12.770 0.474 8 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 4 PHE H 1 42 LYS O . . 1.500 1.829 1.633 2.169 0.669 20 1 "[ . 1 . +]" 2
2 1 4 PHE N 1 42 LYS O . . 2.400 2.799 2.617 3.148 0.748 20 3 "[ . * - . +]" 2
3 1 4 PHE O 1 8 PHE H . . 1.500 1.883 1.766 2.017 0.517 10 2 "[ .- + . 2]" 2
4 1 4 PHE O 1 8 PHE N . . 2.400 2.817 2.687 2.949 0.549 10 3 "[ .* - + . 2]" 2
5 1 5 ALA O 1 9 TYR H . . 1.500 2.247 2.059 2.330 0.830 1 20 [+***************-***] 2
6 1 5 ALA O 1 9 TYR N . . 2.400 3.200 3.006 3.289 0.889 9 20 [********+*******-***] 2
7 1 6 ASP O 1 10 GLN H . . 1.500 1.994 1.785 2.223 0.723 7 10 "[ * . + *1*-*** * *]" 2
8 1 6 ASP O 1 10 GLN N . . 2.400 2.938 2.744 3.143 0.743 20 13 "[** *. * *1**-*** * +]" 2
9 1 7 TYR O 1 11 TRP H . . 1.500 1.770 1.644 1.910 0.410 4 0 "[ . 1 . 2]" 2
10 1 7 TYR O 1 11 TRP N . . 2.400 2.727 2.619 2.861 0.461 4 0 "[ . 1 . 2]" 2
11 1 8 PHE O 1 12 TYR H . . 1.500 2.053 1.904 2.228 0.728 15 16 "[* ***** *****+* *-*]" 2
12 1 8 PHE O 1 12 TYR N . . 2.400 2.990 2.870 3.157 0.757 15 19 "[** *****-*****+*****]" 2
13 1 9 TYR O 1 13 GLU H . . 1.500 1.837 1.698 1.901 0.401 1 0 "[ . 1 . 2]" 2
14 1 9 TYR O 1 13 GLU N . . 2.400 2.793 2.645 2.878 0.478 1 0 "[ . 1 . 2]" 2
15 1 10 GLN O 1 14 VAL H . . 1.500 2.080 1.840 2.315 0.815 19 12 "[ ***** ** -*.** +2]" 2
16 1 10 GLN O 1 14 VAL N . . 2.400 2.970 2.790 3.217 0.817 9 12 "[ -**** +* **.** *2]" 2
17 1 12 TYR O 1 15 ASN H . . 1.500 2.297 2.166 2.339 0.839 1 20 [+********-**********] 2
18 1 12 TYR O 1 15 ASN N . . 2.400 3.075 3.001 3.144 0.744 4 20 [***+*******-********] 2
19 1 21 SER O 1 25 LYS H . . 1.500 1.969 1.775 2.234 0.734 12 9 "[** *. - 1 + ** * *2]" 2
20 1 21 SER O 1 25 LYS N . . 2.400 2.880 2.718 3.146 0.746 12 9 "[ - *. * 1 + ** ***2]" 2
21 1 22 GLU O 1 26 ARG H . . 1.500 2.084 1.741 2.327 0.827 7 15 "[***** +**1 -***** *2]" 2
22 1 22 GLU O 1 26 ARG N . . 2.400 2.997 2.682 3.258 0.858 7 16 "[***** +**- ****** *2]" 2
23 1 24 THR O 1 28 TYR H . . 1.500 2.188 1.951 2.336 0.836 20 18 "[****.****-****** **+]" 2
24 1 24 THR O 1 28 TYR N . . 2.400 3.143 2.912 3.304 0.904 20 20 [****************-**+] 2
25 1 25 LYS O 1 29 GLU H . . 1.500 1.839 1.624 2.121 0.621 17 1 "[ . 1 . + 2]" 2
26 1 25 LYS O 1 29 GLU N . . 2.400 2.798 2.594 3.034 0.634 17 2 "[ - . 1 . + 2]" 2
27 1 26 ARG O 1 30 SER H . . 1.500 1.959 1.785 2.193 0.693 11 7 "[** . 1+ *-. **2]" 2
28 1 26 ARG O 1 30 SER N . . 2.400 2.885 2.748 3.115 0.715 13 6 "[-* . 1* + . **2]" 2
29 1 27 HIS O 1 31 ALA H . . 1.500 1.967 1.839 2.137 0.637 1 8 "[+- . **1 * * * *]" 2
30 1 27 HIS O 1 31 ALA N . . 2.400 2.903 2.791 3.081 0.681 1 9 "[+* . **1 -* * * *]" 2
31 1 28 TYR O 1 32 TYR H . . 1.500 1.792 1.713 1.924 0.424 20 0 "[ . 1 . 2]" 2
32 1 28 TYR O 1 32 TYR N . . 2.400 2.743 2.663 2.865 0.465 20 0 "[ . 1 . 2]" 2
33 1 29 GLU O 1 33 LYS H . . 1.500 2.000 1.733 2.310 0.810 2 8 "[ +* .** *1 * .*- 2]" 2
34 1 29 GLU O 1 33 LYS N . . 2.400 2.904 2.682 3.220 0.820 2 8 "[ +* .** 1 * .** -2]" 2
35 1 30 SER O 1 34 HIS H . . 1.500 2.254 1.989 2.340 0.840 14 18 "[****.****-***+*** **]" 2
36 1 30 SER O 1 34 HIS N . . 2.400 3.178 2.917 3.291 0.891 8 20 [****-**+************] 2
37 1 31 ALA O 1 35 ILE H . . 1.500 1.924 1.792 2.194 0.694 8 4 "[ - .* +*1 . 2]" 2
38 1 31 ALA O 1 35 ILE N . . 2.400 2.852 2.712 3.134 0.734 8 4 "[ - .* + 1 . * 2]" 2
39 1 32 TYR O 1 36 LYS H . . 1.500 1.802 1.670 1.989 0.489 10 0 "[ . 1 . 2]" 2
40 1 32 TYR O 1 36 LYS N . . 2.400 2.763 2.615 2.964 0.564 10 2 "[ . + - 2]" 2
41 1 33 LYS O 1 37 ASP H . . 1.500 2.215 1.995 2.329 0.829 17 19 "[******-*********+ **]" 2
42 1 33 LYS O 1 37 ASP N . . 2.400 2.983 2.781 3.128 0.728 5 17 "[****+** *** ***** *-]" 2
43 1 34 HIS O 1 38 HIS H . . 1.500 2.131 1.907 2.336 0.836 1 18 "[+*********-** ** ***]" 2
44 1 34 HIS O 1 38 HIS N . . 2.400 3.044 2.870 3.242 0.842 1 19 "[+*******-******* ***]" 2
45 1 35 ILE O 1 39 PHE H . . 1.500 1.737 1.656 1.905 0.405 6 0 "[ . 1 . 2]" 2
46 1 35 ILE O 1 39 PHE N . . 2.400 2.650 2.574 2.715 0.315 17 0 "[ . 1 . 2]" 2
47 1 2 ILE O 1 44 LEU H . . 1.500 2.127 1.818 2.380 0.880 20 14 "[****. * **-**** * +]" 2
48 1 2 ILE O 1 44 LEU N . . 2.400 3.056 2.783 3.315 0.915 20 13 "[****. * **** *.-* +]" 2
49 1 48 LYS O 1 52 TYR H . . 1.500 1.986 1.842 2.207 0.707 2 8 "[*+ * **-* * . 2]" 2
50 1 48 LYS O 1 52 TYR N . . 2.400 2.912 2.735 3.127 0.727 2 11 "[*+ * **** *- . ** 2]" 2
51 1 49 ARG O 1 53 GLN H . . 1.500 2.104 1.889 2.351 0.851 14 15 "[* *.-* ****+******]" 2
52 1 49 ARG O 1 53 GLN N . . 2.400 2.999 2.806 3.225 0.825 17 16 "[* *** - *******+***]" 2
53 1 53 GLN O 1 57 ASN H . . 1.500 1.937 1.696 2.233 0.733 18 6 "[*- . * 1* . *+ 2]" 2
54 1 53 GLN O 1 57 ASN N . . 2.400 2.856 2.640 3.141 0.741 18 8 "[*** . * 1* . *+ -]" 2
55 1 54 LYS O 1 58 GLU H . . 1.500 2.081 1.849 2.322 0.822 6 14 "[****.+**** * -* * *]" 2
56 1 54 LYS O 1 58 GLU N . . 2.400 3.033 2.784 3.271 0.871 6 15 "[****.+**** * ** -* *]" 2
57 1 55 PHE O 1 59 TYR H . . 1.500 2.125 1.936 2.310 0.810 11 18 "[**********+*-*.*** *]" 2
58 1 55 PHE O 1 59 TYR N . . 2.400 3.013 2.852 3.155 0.755 18 18 "[************-*.**+ *]" 2
59 1 56 LEU O 1 60 GLY H . . 1.500 1.868 1.749 2.060 0.560 19 1 "[ . 1 . +2]" 2
60 1 56 LEU O 1 60 GLY N . . 2.400 2.767 2.676 2.986 0.586 19 1 "[ . 1 . +2]" 2
61 1 64 SER O 1 68 ILE H . . 1.500 2.170 1.999 2.322 0.822 14 19 "[**-******** *+******]" 2
62 1 64 SER O 1 68 ILE N . . 2.400 3.124 2.957 3.274 0.874 14 20 [***********-*+******] 2
63 1 65 TYR O 1 69 ARG H . . 1.500 1.882 1.735 2.080 0.580 13 3 "[ * 1 + - 2]" 2
64 1 65 TYR O 1 69 ARG N . . 2.400 2.792 2.649 2.965 0.565 5 3 "[ + 1 - * 2]" 2
65 1 67 THR O 1 71 LEU H . . 1.500 2.047 1.807 2.297 0.797 16 12 "[*****- * * *.+ * *]" 2
66 1 67 THR O 1 71 LEU N . . 2.400 2.983 2.757 3.262 0.862 16 14 "[****** * * *-*.+ * *]" 2
67 1 68 ILE O 1 72 ASN H . . 1.500 1.878 1.774 2.035 0.535 1 1 "[+ . 1 . 2]" 2
68 1 68 ILE O 1 72 ASN N . . 2.400 2.848 2.744 2.977 0.577 1 5 "[+ * *-1 * 2]" 2
69 1 69 ARG O 1 73 SER H . . 1.500 2.080 1.858 2.316 0.816 2 12 "[*+ *-**** *. ** *]" 2
70 1 69 ARG O 1 73 SER N . . 2.400 2.979 2.748 3.270 0.870 2 11 "[*+ * -*** *. ** *]" 2
71 1 70 LYS O 1 74 TYR H . . 1.500 2.049 1.859 2.246 0.746 19 13 "[***** * - ***.* +*]" 2
72 1 70 LYS O 1 74 TYR N . . 2.400 2.964 2.810 3.143 0.743 19 13 "[***** * - ***.* +*]" 2
73 1 71 LEU O 1 75 ILE H . . 1.500 2.070 1.855 2.187 0.687 5 16 "[ ***+****1-* **** **]" 2
74 1 71 LEU O 1 75 ILE N . . 2.400 3.041 2.822 3.158 0.758 5 19 "[****+*******-**** **]" 2
75 1 72 ASN O 1 76 ARG H . . 1.500 1.886 1.743 2.069 0.569 20 2 "[ . - 1 . +]" 2
76 1 72 ASN O 1 76 ARG N . . 2.400 2.830 2.709 2.999 0.599 20 3 "[ * - 1 . +]" 2
77 1 73 SER O 1 77 ASN H . . 1.500 2.073 1.801 2.326 0.826 7 16 "[***** +****-* ** **]" 2
78 1 73 SER O 1 77 ASN N . . 2.400 2.989 2.746 3.269 0.869 7 17 "[***** +****-**** **]" 2
79 1 74 TYR O 1 78 ALA H . . 1.500 1.996 1.812 2.094 0.594 12 10 "[ ** . *** +*** - 2]" 2
80 1 74 TYR O 1 78 ALA N . . 2.400 2.897 2.743 2.994 0.594 9 11 "[ ** . -*+* **** * 2]" 2
81 1 75 ILE O 1 79 PHE H . . 1.500 2.018 1.915 2.214 0.714 3 10 "[**+*. - * *** *]" 2
82 1 75 ILE O 1 79 PHE N . . 2.400 2.981 2.871 3.170 0.770 3 17 "[**+** **-** ****** *]" 2
83 1 76 ARG O 1 80 ASP H . . 1.500 1.899 1.779 2.163 0.663 5 3 "[ + 1 . - *]" 2
84 1 76 ARG O 1 80 ASP N . . 2.400 2.787 2.681 2.911 0.511 5 1 "[ + 1 . 2]" 2
85 1 77 ASN O 1 81 ASP H . . 1.500 2.040 1.785 2.321 0.821 12 10 "[ ** **- +**. * *2]" 2
86 1 77 ASN O 1 81 ASP N . . 2.400 2.937 2.703 3.168 0.768 12 12 "[ ** **1-+**.** **]" 2
87 1 78 ALA O 1 82 ALA H . . 1.500 2.194 1.995 2.340 0.840 5 19 "[****+-********** ***]" 2
88 1 78 ALA O 1 82 ALA N . . 2.400 3.119 2.902 3.273 0.873 5 20 [****+***********-***] 2
89 1 79 PHE O 1 83 ILE H . . 1.500 1.794 1.695 1.973 0.473 8 0 "[ . 1 . 2]" 2
90 1 79 PHE O 1 83 ILE N . . 2.400 2.744 2.649 2.874 0.474 8 0 "[ . 1 . 2]" 2
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