NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
381849 | 1j5n | 4869 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1j5n 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 2298 _Distance_constraint_stats_list.Viol_count 9129 _Distance_constraint_stats_list.Viol_total 27841.766 _Distance_constraint_stats_list.Viol_max 0.933 _Distance_constraint_stats_list.Viol_rms 0.0886 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0303 _Distance_constraint_stats_list.Viol_average_violations_only 0.1525 _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 DG 36.118 0.671 2 20 [*+**-***************] 1 2 DG 27.053 0.406 2 0 "[ . 1 . 2]" 1 3 DG 43.867 0.397 15 0 "[ . 1 . 2]" 1 4 DG 62.658 0.434 20 0 "[ . 1 . 2]" 1 5 DT 27.223 0.427 19 0 "[ . 1 . 2]" 1 6 DG 45.360 0.458 13 0 "[ . 1 . 2]" 1 7 DA 84.442 0.761 6 8 "[ *+* 1 **-.* *]" 1 8 DT 37.962 0.493 5 0 "[ . 1 . 2]" 1 9 DT 19.106 0.447 4 0 "[ . 1 . 2]" 1 10 DG 32.895 0.385 16 0 "[ . 1 . 2]" 1 11 DT 27.300 0.370 11 0 "[ . 1 . 2]" 1 12 DT 58.780 0.750 18 20 [**************-**+**] 1 13 DC 73.923 0.750 18 20 [*****************+**] 1 14 DA 83.732 0.637 18 20 [*****************+-*] 1 15 DG 18.738 0.411 14 0 "[ . 1 . 2]" 2 1 DC 65.059 0.594 10 20 [*********+***-******] 2 2 DT 47.679 0.898 15 20 [**************+**-**] 2 3 DG 22.555 0.306 18 0 "[ . 1 . 2]" 2 4 DA 37.564 0.437 11 0 "[ . 1 . 2]" 2 5 DA 56.120 0.424 7 0 "[ . 1 . 2]" 2 6 DC 37.352 0.405 17 0 "[ . 1 . 2]" 2 7 DA 5.009 0.215 18 0 "[ . 1 . 2]" 2 8 DA 54.341 0.612 13 18 "[*********- *+***** *]" 2 9 DT 44.800 0.467 13 0 "[ . 1 . 2]" 2 10 DC 32.676 0.675 6 20 [*****+**-***********] 2 11 DA 56.165 0.575 15 19 "[-* ***********+*****]" 2 12 DC 66.318 0.433 1 0 "[ . 1 . 2]" 2 13 DC 40.668 0.395 12 0 "[ . 1 . 2]" 2 14 DC 78.370 0.780 14 20 [*************+******] 2 15 DC 42.726 0.424 5 0 "[ . 1 . 2]" 3 2 VAL 0.005 0.005 10 0 "[ . 1 . 2]" 3 5 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 3 6 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 3 7 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 3 10 ARG 0.131 0.037 18 0 "[ . 1 . 2]" 3 11 THR 1.677 0.185 16 0 "[ . 1 . 2]" 3 12 THR 1.762 0.263 20 0 "[ . 1 . 2]" 3 13 ARG 3.830 0.192 20 0 "[ . 1 . 2]" 3 14 LYS 0.150 0.024 18 0 "[ . 1 . 2]" 3 15 LYS 0.150 0.024 18 0 "[ . 1 . 2]" 3 16 LYS 0.493 0.041 11 0 "[ . 1 . 2]" 3 17 ASP 2.309 0.177 18 0 "[ . 1 . 2]" 3 18 PRO 2.611 0.140 12 0 "[ . 1 . 2]" 3 19 ASN 5.478 0.184 18 0 "[ . 1 . 2]" 3 20 ALA 13.043 0.357 16 0 "[ . 1 . 2]" 3 21 PRO 11.327 0.357 16 0 "[ . 1 . 2]" 3 22 LYS 9.142 0.463 12 0 "[ . 1 . 2]" 3 23 ARG 15.579 0.463 12 0 "[ . 1 . 2]" 3 24 ALA 14.872 0.432 16 0 "[ . 1 . 2]" 3 25 LEU 16.895 0.419 16 0 "[ . 1 . 2]" 3 26 SER 14.248 0.432 16 0 "[ . 1 . 2]" 3 27 ALA 3.104 0.213 15 0 "[ . 1 . 2]" 3 28 TYR 6.705 0.279 10 0 "[ . 1 . 2]" 3 29 MET 9.657 0.374 11 0 "[ . 1 . 2]" 3 30 PHE 31.749 0.437 8 0 "[ . 1 . 2]" 3 31 PHE 17.383 0.346 6 0 "[ . 1 . 2]" 3 32 ALA 4.704 0.458 16 0 "[ . 1 . 2]" 3 33 ASN 2.816 0.301 16 0 "[ . 1 . 2]" 3 34 GLU 13.346 0.423 16 0 "[ . 1 . 2]" 3 35 ASN 22.952 0.458 16 0 "[ . 1 . 2]" 3 36 ARG 5.460 0.301 16 0 "[ . 1 . 2]" 3 37 ASP 5.026 0.166 18 0 "[ . 1 . 2]" 3 38 ILE 11.196 0.224 4 0 "[ . 1 . 2]" 3 39 VAL 16.340 0.346 6 0 "[ . 1 . 2]" 3 40 ARG 9.476 0.226 20 0 "[ . 1 . 2]" 3 41 SER 0.192 0.054 16 0 "[ . 1 . 2]" 3 42 GLU 4.144 0.218 20 0 "[ . 1 . 2]" 3 43 ASN 19.088 0.719 3 3 "[ *+ . - 1 . 2]" 3 44 PRO 11.606 0.416 16 0 "[ . 1 . 2]" 3 45 ASP 0.952 0.216 8 0 "[ . 1 . 2]" 3 46 ILE 23.531 0.719 3 5 "[ *+ . * - * . 2]" 3 47 THR 2.148 0.311 13 0 "[ . 1 . 2]" 3 48 PHE 6.295 0.332 19 0 "[ . 1 . 2]" 3 49 GLY 6.619 0.414 1 0 "[ . 1 . 2]" 3 50 GLN 22.968 0.578 12 2 "[ . - + . 2]" 3 51 VAL 24.333 0.614 2 2 "[ + . - 1 . 2]" 3 52 GLY 4.869 0.169 11 0 "[ . 1 . 2]" 3 53 LYS 8.894 0.424 7 0 "[ . 1 . 2]" 3 54 LYS 11.890 0.933 17 6 "[ * ** - 1 . + *]" 3 55 LEU 15.140 0.614 2 2 "[ + . - 1 . 2]" 3 56 GLY 6.365 0.384 1 0 "[ . 1 . 2]" 3 57 GLU 11.661 0.933 17 6 "[ * -* * 1 . + *]" 3 58 LYS 2.848 0.142 8 0 "[ . 1 . 2]" 3 59 TRP 15.377 0.253 7 0 "[ . 1 . 2]" 3 60 LYS 9.117 0.253 7 0 "[ . 1 . 2]" 3 61 ALA 0.234 0.048 8 0 "[ . 1 . 2]" 3 62 LEU 10.151 0.323 17 0 "[ . 1 . 2]" 3 63 THR 4.547 0.323 17 0 "[ . 1 . 2]" 3 64 PRO 3.042 0.234 17 0 "[ . 1 . 2]" 3 65 GLU 5.227 0.323 17 0 "[ . 1 . 2]" 3 66 GLU 4.180 0.179 6 0 "[ . 1 . 2]" 3 67 LYS 10.995 0.234 5 0 "[ . 1 . 2]" 3 68 GLN 14.827 0.329 12 0 "[ . 1 . 2]" 3 69 PRO 9.644 0.241 17 0 "[ . 1 . 2]" 3 70 TYR 48.055 0.471 11 0 "[ . 1 . 2]" 3 71 GLU 15.897 0.276 12 0 "[ . 1 . 2]" 3 72 ALA 8.449 0.253 17 0 "[ . 1 . 2]" 3 73 LYS 30.541 0.471 11 0 "[ . 1 . 2]" 3 74 ALA 11.175 0.280 5 0 "[ . 1 . 2]" 3 75 GLN 0.771 0.095 11 0 "[ . 1 . 2]" 3 76 ALA 8.329 0.239 5 0 "[ . 1 . 2]" 3 77 ASP 9.735 0.437 8 0 "[ . 1 . 2]" 3 78 LYS 4.003 0.375 19 0 "[ . 1 . 2]" 3 79 LYS 0.652 0.080 11 0 "[ . 1 . 2]" 3 80 ARG 5.766 0.256 11 0 "[ . 1 . 2]" 3 81 TYR 13.021 0.288 16 0 "[ . 1 . 2]" 3 82 GLU 4.181 0.244 11 0 "[ . 1 . 2]" 3 83 SER 4.205 0.288 16 0 "[ . 1 . 2]" 3 84 GLU 8.868 0.371 5 0 "[ . 1 . 2]" 3 85 LYS 9.299 0.545 18 1 "[ . 1 . + 2]" 3 86 GLU 1.886 0.145 16 0 "[ . 1 . 2]" 3 87 LEU 16.033 0.386 17 0 "[ . 1 . 2]" 3 88 TYR 24.616 0.386 17 0 "[ . 1 . 2]" 3 89 ASN 0.548 0.173 5 0 "[ . 1 . 2]" 3 90 ALA 11.364 0.378 20 0 "[ . 1 . 2]" 3 91 THR 2.219 0.129 9 0 "[ . 1 . 2]" 3 92 LEU 5.251 0.206 9 0 "[ . 1 . 2]" 3 93 ALA 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 3 84 GLU HB3 3 87 LEU QD 3.150 . 4.500 4.051 3.439 4.538 0.038 2 0 "[ . 1 . 2]" 1 2 3 62 LEU HA 3 62 LEU HG 4.150 . 6.500 2.830 2.699 3.265 . 0 0 "[ . 1 . 2]" 1 3 3 36 ARG HA 3 55 LEU MD2 4.150 . 6.500 3.695 2.441 4.298 . 0 0 "[ . 1 . 2]" 1 4 3 39 VAL QG 3 46 ILE QG 4.150 . 6.500 3.897 3.533 4.329 . 0 0 "[ . 1 . 2]" 1 5 3 70 TYR HB2 3 72 ALA MB 4.150 . 6.500 6.007 5.994 6.016 . 0 0 "[ . 1 . 2]" 1 6 3 40 ARG QG 3 51 VAL MG1 4.150 . 6.500 3.087 2.253 4.100 . 0 0 "[ . 1 . 2]" 1 7 3 36 ARG HA 3 38 ILE HB 4.150 . 6.500 5.929 5.377 6.147 . 0 0 "[ . 1 . 2]" 1 8 3 32 ALA HA 3 36 ARG HA 4.150 . 6.500 5.135 4.803 5.355 . 0 0 "[ . 1 . 2]" 1 9 3 55 LEU HA 3 55 LEU MD1 4.150 . 4.500 3.656 3.424 3.846 . 0 0 "[ . 1 . 2]" 1 10 3 81 TYR QB 3 84 GLU HB3 4.150 . 6.500 4.299 3.271 5.332 . 0 0 "[ . 1 . 2]" 1 11 3 25 LEU MD2 3 30 PHE HZ 4.150 . 6.500 3.655 3.528 4.168 . 0 0 "[ . 1 . 2]" 1 12 3 87 LEU HA 3 88 TYR HB3 4.150 . 6.500 5.445 5.394 5.498 . 0 0 "[ . 1 . 2]" 1 13 3 18 PRO QD 3 20 ALA MB 4.150 . 6.500 4.385 4.150 4.720 . 0 0 "[ . 1 . 2]" 1 14 3 65 GLU HG3 3 68 GLN HG3 4.150 . 6.500 2.934 2.538 5.354 . 0 0 "[ . 1 . 2]" 1 15 3 67 LYS HD3 3 71 GLU QG 4.150 . 6.500 5.292 4.700 6.118 . 0 0 "[ . 1 . 2]" 1 16 3 20 ALA MB 3 88 TYR QD 4.150 . 4.640 4.334 4.179 4.569 . 0 0 "[ . 1 . 2]" 1 17 3 20 ALA MB 3 21 PRO QG 4.150 . 6.500 4.841 4.595 4.951 . 0 0 "[ . 1 . 2]" 1 18 3 39 VAL QG 3 55 LEU HG 4.150 . 6.500 2.508 1.915 3.214 . 0 0 "[ . 1 . 2]" 1 19 3 39 VAL HA 3 43 ASN HB2 4.150 . 6.500 4.612 4.510 4.702 . 0 0 "[ . 1 . 2]" 1 20 3 25 LEU MD2 3 30 PHE QD 4.150 . 6.500 2.704 2.472 3.018 . 0 0 "[ . 1 . 2]" 1 21 3 43 ASN HB3 3 51 VAL MG1 4.150 . 6.500 6.029 5.000 6.535 0.035 18 0 "[ . 1 . 2]" 1 22 3 30 PHE QB 3 73 LYS HA 4.150 . 6.500 5.083 4.981 5.307 . 0 0 "[ . 1 . 2]" 1 23 3 31 PHE QE 3 62 LEU MD2 4.150 . 4.403 2.533 2.295 2.818 . 0 0 "[ . 1 . 2]" 1 24 3 67 LYS HB2 3 67 LYS HD3 4.150 . 6.500 3.646 3.281 3.816 . 0 0 "[ . 1 . 2]" 1 25 3 30 PHE QD 3 70 TYR HA 4.150 . 6.500 3.063 2.995 3.139 . 0 0 "[ . 1 . 2]" 1 26 3 25 LEU HA 3 25 LEU MD1 4.150 . 6.500 2.830 2.670 3.240 . 0 0 "[ . 1 . 2]" 1 27 3 57 GLU HA 3 60 LYS HA 4.150 . 6.500 6.415 6.131 6.587 0.087 4 0 "[ . 1 . 2]" 1 28 3 67 LYS HD2 3 71 GLU QG 4.150 . 6.500 4.358 3.673 5.590 . 0 0 "[ . 1 . 2]" 1 29 3 65 GLU HG3 3 68 GLN HA 4.150 . 6.500 6.071 5.867 6.564 0.064 17 0 "[ . 1 . 2]" 1 30 3 68 GLN HG2 3 69 PRO HD3 4.150 . 6.500 4.078 1.559 4.784 0.241 17 0 "[ . 1 . 2]" 1 31 3 47 THR MG 3 51 VAL MG1 4.150 . 6.500 4.494 3.848 6.514 0.014 1 0 "[ . 1 . 2]" 1 32 3 37 ASP HA 3 51 VAL MG2 4.150 . 6.500 5.941 5.365 6.341 . 0 0 "[ . 1 . 2]" 1 33 3 20 ALA HA 3 21 PRO HD3 4.150 . 6.500 2.287 1.970 3.019 . 0 0 "[ . 1 . 2]" 1 34 3 6 GLU HA 3 7 PRO HD3 4.150 . 6.500 2.784 1.955 3.831 . 0 0 "[ . 1 . 2]" 1 35 3 54 LYS HA 3 54 LYS QB . . 2.612 2.404 2.294 2.472 . 0 0 "[ . 1 . 2]" 1 36 3 67 LYS HB2 3 67 LYS HD2 4.150 . 6.500 3.339 2.661 3.459 . 0 0 "[ . 1 . 2]" 1 37 3 46 ILE HA 3 46 ILE QG . . 3.068 3.065 2.226 3.315 0.247 16 0 "[ . 1 . 2]" 1 38 3 73 LYS HA 3 73 LYS HD3 4.150 . 6.500 3.854 3.115 4.515 . 0 0 "[ . 1 . 2]" 1 39 3 67 LYS HD2 3 71 GLU HB3 4.150 . 6.500 5.662 5.415 6.067 . 0 0 "[ . 1 . 2]" 1 40 3 21 PRO HD2 3 85 LYS HA 4.150 . 6.500 4.484 4.069 4.887 . 0 0 "[ . 1 . 2]" 1 41 3 36 ARG QD 3 40 ARG QG . . 2.500 2.070 2.024 2.090 . 0 0 "[ . 1 . 2]" 1 42 3 67 LYS HD3 3 71 GLU HB3 4.150 . 6.500 6.526 6.393 6.659 0.159 8 0 "[ . 1 . 2]" 1 43 3 61 ALA HA 3 62 LEU QB 4.150 . 6.500 5.498 5.406 5.541 . 0 0 "[ . 1 . 2]" 1 44 3 38 ILE MG 3 41 SER QB 4.150 . 6.500 3.787 3.660 3.929 . 0 0 "[ . 1 . 2]" 1 45 3 30 PHE QB 3 31 PHE HA 4.150 . 6.500 3.867 3.821 3.885 . 0 0 "[ . 1 . 2]" 1 46 3 68 GLN HA 3 68 GLN HG2 4.150 . 6.500 2.460 2.268 3.790 . 0 0 "[ . 1 . 2]" 1 47 3 60 LYS QB 3 67 LYS HD3 4.150 . 6.500 5.107 4.793 5.297 . 0 0 "[ . 1 . 2]" 1 48 3 69 PRO HB3 3 70 TYR QE 4.150 . 6.500 4.571 4.526 4.669 . 0 0 "[ . 1 . 2]" 1 49 3 62 LEU MD2 3 70 TYR QD 4.150 . 6.500 5.891 5.632 6.292 . 0 0 "[ . 1 . 2]" 1 50 3 88 TYR QD 3 92 LEU MD1 4.150 . 6.500 4.862 4.221 5.394 . 0 0 "[ . 1 . 2]" 1 51 3 31 PHE HB2 3 59 TRP HZ3 4.150 . 4.829 2.129 1.991 2.283 . 0 0 "[ . 1 . 2]" 1 52 3 81 TYR HA 3 84 GLU HG2 4.150 . 6.500 3.476 1.885 4.558 . 0 0 "[ . 1 . 2]" 1 53 3 59 TRP HH2 3 62 LEU MD1 4.150 . 6.500 4.828 4.463 4.899 . 0 0 "[ . 1 . 2]" 1 54 3 67 LYS HB3 3 70 TYR HB3 4.150 . 6.500 4.852 4.754 4.955 . 0 0 "[ . 1 . 2]" 1 55 3 40 ARG QG 3 51 VAL MG2 4.150 . 6.500 3.392 2.320 4.105 . 0 0 "[ . 1 . 2]" 1 56 3 25 LEU HA 3 25 LEU MD2 4.150 . 6.500 3.608 3.525 3.688 . 0 0 "[ . 1 . 2]" 1 57 3 37 ASP HA 3 40 ARG QB 4.150 . 6.500 3.610 2.942 4.144 . 0 0 "[ . 1 . 2]" 1 58 3 83 SER QB 3 86 GLU QB 4.150 . 6.500 4.971 4.101 5.482 . 0 0 "[ . 1 . 2]" 1 59 3 20 ALA MB 3 21 PRO HD3 4.150 . 6.500 3.863 3.667 4.306 . 0 0 "[ . 1 . 2]" 1 60 3 20 ALA MB 3 21 PRO HD2 4.150 . 6.500 3.740 3.456 3.878 . 0 0 "[ . 1 . 2]" 1 61 3 88 TYR HA 3 88 TYR QD 4.150 . 6.500 2.751 2.456 3.144 . 0 0 "[ . 1 . 2]" 1 62 3 72 ALA HA 3 74 ALA MB 4.150 . 6.500 4.237 4.198 4.298 . 0 0 "[ . 1 . 2]" 1 63 3 84 GLU HA 3 84 GLU HG3 4.150 . 6.500 3.643 3.156 4.042 . 0 0 "[ . 1 . 2]" 1 64 3 40 ARG QG 3 43 ASN HB2 4.150 . 6.500 5.347 4.508 6.365 . 0 0 "[ . 1 . 2]" 1 65 3 88 TYR HB2 3 88 TYR QD . . 3.356 2.525 2.362 2.637 . 0 0 "[ . 1 . 2]" 1 66 3 46 ILE MG 3 50 GLN HA 4.150 . 6.500 4.129 3.809 4.929 . 0 0 "[ . 1 . 2]" 1 67 3 87 LEU HA 3 87 LEU HG 4.150 . 6.500 3.017 2.927 3.620 . 0 0 "[ . 1 . 2]" 1 68 3 32 ALA HA 3 36 ARG QB 4.150 . 6.500 4.040 3.856 4.411 . 0 0 "[ . 1 . 2]" 1 69 3 23 ARG HA 3 23 ARG HG3 4.150 . 6.500 3.586 3.515 3.647 . 0 0 "[ . 1 . 2]" 1 70 3 20 ALA HA 3 21 PRO HD2 4.150 . 6.500 2.346 1.864 2.490 . 0 0 "[ . 1 . 2]" 1 71 3 86 GLU HA 3 87 LEU QD 4.150 . 6.500 5.712 5.273 5.849 . 0 0 "[ . 1 . 2]" 1 72 3 37 ASP HA 3 40 ARG QG 4.150 . 6.500 4.005 2.285 5.543 . 0 0 "[ . 1 . 2]" 1 73 3 67 LYS HA 3 70 TYR HB3 4.150 . 6.500 5.403 5.300 5.518 . 0 0 "[ . 1 . 2]" 1 74 3 70 TYR HB3 3 73 LYS HB2 4.150 . 6.500 3.965 3.924 4.007 . 0 0 "[ . 1 . 2]" 1 75 3 18 PRO HB2 3 19 ASN HA 4.150 . 6.500 4.134 4.012 4.283 . 0 0 "[ . 1 . 2]" 1 76 3 70 TYR HA 3 70 TYR QE 4.150 . 6.500 5.174 5.112 5.226 . 0 0 "[ . 1 . 2]" 1 77 3 36 ARG HA 3 40 ARG QG 4.150 . 6.500 4.725 3.823 5.866 . 0 0 "[ . 1 . 2]" 1 78 3 31 PHE QD 3 32 ALA HA 4.150 . 6.500 3.205 2.706 3.388 . 0 0 "[ . 1 . 2]" 1 79 3 21 PRO HB2 3 85 LYS HA 4.150 . 6.500 3.694 3.275 4.098 . 0 0 "[ . 1 . 2]" 1 80 3 33 ASN HB3 3 36 ARG QD 4.150 . 6.500 5.146 4.120 6.801 0.301 16 0 "[ . 1 . 2]" 1 81 3 91 THR HA 3 92 LEU MD1 4.150 . 6.500 3.145 2.796 3.253 . 0 0 "[ . 1 . 2]" 1 82 3 73 LYS HB2 3 74 ALA MB 4.150 . 6.500 4.832 4.710 4.974 . 0 0 "[ . 1 . 2]" 1 83 3 40 ARG HA 3 46 ILE MG 4.150 . 6.500 5.309 3.598 5.942 . 0 0 "[ . 1 . 2]" 1 84 3 46 ILE HA 3 51 VAL MG1 4.150 . 6.500 3.703 2.635 5.627 . 0 0 "[ . 1 . 2]" 1 85 3 81 TYR HA 3 81 TYR QD 4.150 . 5.000 3.536 3.408 3.582 . 0 0 "[ . 1 . 2]" 1 86 3 24 ALA MB 3 30 PHE HZ 4.150 . 6.500 3.679 3.280 3.895 . 0 0 "[ . 1 . 2]" 1 87 3 81 TYR HA 3 84 GLU HB3 4.150 . 6.500 3.215 2.327 4.162 . 0 0 "[ . 1 . 2]" 1 88 3 54 LYS HA 3 58 LYS QB 4.150 . 6.500 5.022 4.342 5.850 . 0 0 "[ . 1 . 2]" 1 89 3 47 THR MG 3 48 PHE HB2 4.150 . 6.500 4.336 3.694 6.239 . 0 0 "[ . 1 . 2]" 1 90 3 72 ALA HA 3 73 LYS HB2 4.150 . 6.500 5.559 5.554 5.574 . 0 0 "[ . 1 . 2]" 1 91 3 67 LYS HB3 3 70 TYR HB2 4.150 . 6.500 3.912 3.811 4.129 . 0 0 "[ . 1 . 2]" 1 92 3 86 GLU HG2 3 87 LEU HG 4.150 . 6.500 6.412 3.944 6.585 0.085 8 0 "[ . 1 . 2]" 1 93 3 46 ILE MG 3 47 THR HA 4.150 . 6.500 3.517 2.655 5.094 . 0 0 "[ . 1 . 2]" 1 94 3 21 PRO HA 3 22 LYS QG 4.150 . 6.500 3.950 3.412 5.055 . 0 0 "[ . 1 . 2]" 1 95 3 60 LYS QB 3 67 LYS HD2 4.150 . 6.500 5.766 5.408 6.176 . 0 0 "[ . 1 . 2]" 1 96 3 76 ALA HA 3 76 ALA MB . . 2.549 2.102 2.082 2.120 . 0 0 "[ . 1 . 2]" 1 97 3 47 THR HB 3 48 PHE HB2 4.150 . 6.500 5.426 4.449 6.448 . 0 0 "[ . 1 . 2]" 1 98 3 7 PRO HA 3 7 PRO HD3 4.150 . 6.500 3.617 3.597 3.641 . 0 0 "[ . 1 . 2]" 1 99 3 21 PRO HB2 3 87 LEU QD 4.150 . 6.500 6.143 5.530 6.478 . 0 0 "[ . 1 . 2]" 1 100 3 84 GLU HB3 3 87 LEU HG 4.150 . 6.500 6.222 4.318 6.542 0.042 8 0 "[ . 1 . 2]" 1 101 3 21 PRO HB2 3 81 TYR HA 4.150 . 6.500 5.477 4.924 5.910 . 0 0 "[ . 1 . 2]" 1 102 3 35 ASN HA 3 38 ILE HB 4.150 . 4.500 2.014 1.865 2.185 . 0 0 "[ . 1 . 2]" 1 103 3 68 GLN HG3 3 72 ALA MB 4.150 . 6.500 5.404 3.544 5.668 . 0 0 "[ . 1 . 2]" 1 104 3 68 GLN HG3 3 69 PRO QG 4.150 . 6.500 5.107 3.443 5.506 . 0 0 "[ . 1 . 2]" 1 105 3 43 ASN HA 3 44 PRO HB3 3.150 . 4.250 4.167 4.135 4.215 . 0 0 "[ . 1 . 2]" 1 106 3 43 ASN HA 3 46 ILE MG 3.150 . 4.500 4.216 3.045 4.626 0.126 8 0 "[ . 1 . 2]" 1 107 3 17 ASP HA 3 18 PRO HB2 3.150 . 4.500 3.806 3.697 3.938 . 0 0 "[ . 1 . 2]" 1 108 3 60 LYS HA 3 61 ALA HA 4.150 . 6.500 4.766 4.669 4.817 . 0 0 "[ . 1 . 2]" 1 109 3 23 ARG QB 3 24 ALA HA 3.150 . 4.500 4.517 4.326 4.812 0.312 2 0 "[ . 1 . 2]" 1 110 3 43 ASN HB3 3 44 PRO HD3 4.150 . 6.500 4.734 4.663 4.779 . 0 0 "[ . 1 . 2]" 1 111 3 17 ASP HA 3 18 PRO QD 3.150 . 4.500 1.980 1.848 2.129 . 0 0 "[ . 1 . 2]" 1 112 3 18 PRO HB3 3 18 PRO QD 3.150 . 4.500 2.871 2.863 2.882 . 0 0 "[ . 1 . 2]" 1 113 3 17 ASP HA 3 18 PRO HB3 4.150 . 6.500 4.986 4.937 5.032 . 0 0 "[ . 1 . 2]" 1 114 3 20 ALA HA 3 21 PRO QG 3.150 . 4.500 3.888 3.712 4.034 . 0 0 "[ . 1 . 2]" 1 115 3 43 ASN HB3 3 44 PRO HD2 3.150 . 4.500 4.840 4.773 4.916 0.416 16 0 "[ . 1 . 2]" 1 116 3 92 LEU MD1 3 93 ALA HA 4.150 . 6.500 2.935 2.317 5.421 . 0 0 "[ . 1 . 2]" 1 117 3 91 THR HB 3 91 THR MG 2.150 . 2.500 2.121 2.118 2.122 . 0 0 "[ . 1 . 2]" 1 118 3 90 ALA MB 3 91 THR HB 4.150 . 6.500 3.726 3.461 4.099 . 0 0 "[ . 1 . 2]" 1 119 3 88 TYR HB2 3 91 THR HB 4.150 . 6.500 6.552 6.095 6.629 0.129 9 0 "[ . 1 . 2]" 1 120 3 88 TYR HA 3 88 TYR QE 4.150 . 6.500 4.756 4.613 4.902 . 0 0 "[ . 1 . 2]" 1 121 3 77 ASP HA 3 80 ARG HA 3.150 . 4.500 4.574 4.476 4.678 0.178 8 0 "[ . 1 . 2]" 1 122 3 77 ASP HA 3 81 TYR QD 4.150 . 6.500 6.466 6.147 6.558 0.058 15 0 "[ . 1 . 2]" 1 123 3 30 PHE HZ 3 77 ASP HA 4.150 . 5.105 5.113 4.879 5.178 0.073 12 0 "[ . 1 . 2]" 1 124 3 32 ALA HA 3 55 LEU HB2 4.150 . 6.500 5.577 4.720 6.034 . 0 0 "[ . 1 . 2]" 1 125 3 32 ALA HA 3 55 LEU HA 4.150 . 6.500 5.642 4.971 6.149 . 0 0 "[ . 1 . 2]" 1 126 3 46 ILE HB 3 51 VAL HA 3.150 . 4.500 2.711 2.154 3.255 . 0 0 "[ . 1 . 2]" 1 127 3 51 VAL HA 3 54 LYS HA 4.150 . 6.500 4.874 4.705 5.123 . 0 0 "[ . 1 . 2]" 1 128 3 69 PRO HA 3 72 ALA MB 3.150 . 4.500 3.407 3.166 3.489 . 0 0 "[ . 1 . 2]" 1 129 3 64 PRO HA 3 67 LYS QD 3.150 . 4.500 3.067 2.803 3.553 . 0 0 "[ . 1 . 2]" 1 130 3 37 ASP HA 3 38 ILE HA 4.150 . 6.500 4.811 4.768 4.852 . 0 0 "[ . 1 . 2]" 1 131 3 35 ASN HA 3 38 ILE HA 4.150 . 6.500 4.847 4.737 4.948 . 0 0 "[ . 1 . 2]" 1 132 3 29 MET HA 3 30 PHE HA 4.150 . 6.500 4.760 4.742 4.788 . 0 0 "[ . 1 . 2]" 1 133 3 43 ASN HA 3 44 PRO HA 4.150 . 6.500 4.732 4.700 4.758 . 0 0 "[ . 1 . 2]" 1 134 3 40 ARG QD 3 44 PRO HA 4.150 . 6.500 3.505 2.675 4.266 . 0 0 "[ . 1 . 2]" 1 135 3 44 PRO HA 3 46 ILE MG 4.150 . 6.500 5.022 4.038 5.556 . 0 0 "[ . 1 . 2]" 1 136 3 29 MET HA 3 32 ALA HA 4.150 . 6.500 5.371 4.952 5.671 . 0 0 "[ . 1 . 2]" 1 137 3 39 VAL HA 3 51 VAL MG2 3.150 . 4.500 4.500 4.165 4.649 0.149 11 0 "[ . 1 . 2]" 1 138 3 39 VAL HA 3 55 LEU MD2 4.150 . 6.500 5.605 4.504 6.404 . 0 0 "[ . 1 . 2]" 1 139 3 35 ASN HB3 3 39 VAL HA 4.150 . 6.500 4.611 4.435 4.909 . 0 0 "[ . 1 . 2]" 1 140 3 40 ARG HA 3 43 ASN HB2 4.150 . 6.500 3.277 2.975 3.565 . 0 0 "[ . 1 . 2]" 1 141 3 28 TYR HA 3 28 TYR QD 3.150 . 3.802 3.152 3.075 3.207 . 0 0 "[ . 1 . 2]" 1 142 3 28 TYR HA 3 31 PHE HB2 3.150 . 4.500 4.417 4.256 4.504 0.004 16 0 "[ . 1 . 2]" 1 143 3 30 PHE QR 3 74 ALA HA 3.150 . 4.500 1.909 1.807 2.080 . 0 0 "[ . 1 . 2]" 1 144 3 69 PRO HB2 3 69 PRO HD2 3.150 . 4.500 3.131 2.903 4.030 . 0 0 "[ . 1 . 2]" 1 145 3 69 PRO HB2 3 69 PRO HD3 3.150 . 4.500 3.877 3.866 3.890 . 0 0 "[ . 1 . 2]" 1 146 3 47 THR HB 3 48 PHE HA 4.150 . 6.500 4.943 4.335 5.404 . 0 0 "[ . 1 . 2]" 1 147 3 36 ARG HA 3 39 VAL QG 3.150 . 4.500 3.853 2.423 4.126 . 0 0 "[ . 1 . 2]" 1 148 3 20 ALA HA 3 88 TYR QD 3.150 . 4.105 3.566 3.365 3.829 . 0 0 "[ . 1 . 2]" 1 149 3 21 PRO HB3 3 21 PRO HD3 4.150 . 6.500 3.887 2.959 4.058 . 0 0 "[ . 1 . 2]" 1 150 3 21 PRO HB3 3 21 PRO HD2 4.150 . 6.500 3.889 3.881 3.903 . 0 0 "[ . 1 . 2]" 1 151 3 48 PHE HB3 3 49 GLY HA2 4.150 . 6.500 4.536 4.444 4.648 . 0 0 "[ . 1 . 2]" 1 152 3 49 GLY HA2 3 50 GLN QG 4.150 . 6.500 5.181 4.727 5.410 . 0 0 "[ . 1 . 2]" 1 153 3 51 VAL HA 3 52 GLY HA2 4.150 . 6.500 4.761 4.707 4.830 . 0 0 "[ . 1 . 2]" 1 154 3 52 GLY HA2 3 55 LEU MD1 3.150 . 4.500 2.339 1.841 3.000 . 0 0 "[ . 1 . 2]" 1 155 3 52 GLY HA2 3 55 LEU MD2 3.150 . 4.500 4.540 4.284 4.669 0.169 11 0 "[ . 1 . 2]" 1 156 3 59 TRP HD1 3 60 LYS HA 4.150 . 4.694 4.467 4.093 4.707 0.013 15 0 "[ . 1 . 2]" 1 157 3 43 ASN HB2 3 46 ILE HA 4.150 . 6.500 5.695 4.700 5.969 . 0 0 "[ . 1 . 2]" 1 158 3 23 ARG HA 3 24 ALA MB 4.150 . 6.500 3.961 3.879 4.350 . 0 0 "[ . 1 . 2]" 1 159 3 16 LYS HA 3 17 ASP HA 4.150 . 6.500 4.365 4.293 4.631 . 0 0 "[ . 1 . 2]" 1 160 3 56 GLY HA2 3 59 TRP HE3 4.150 . 6.500 5.913 5.544 6.326 . 0 0 "[ . 1 . 2]" 1 161 3 46 ILE MG 3 49 GLY HA3 4.150 . 6.500 5.196 4.600 6.649 0.149 1 0 "[ . 1 . 2]" 1 162 3 52 GLY HA3 3 55 LEU MD1 3.150 . 4.500 3.904 3.443 4.505 0.005 13 0 "[ . 1 . 2]" 1 163 3 52 GLY HA3 3 55 LEU HB2 4.150 . 6.500 4.050 3.838 4.273 . 0 0 "[ . 1 . 2]" 1 164 3 30 PHE QB 3 73 LYS HG3 4.150 . 6.500 4.176 3.632 5.026 . 0 0 "[ . 1 . 2]" 1 165 3 70 TYR HA 3 73 LYS HG3 4.150 . 6.500 3.638 3.374 4.323 . 0 0 "[ . 1 . 2]" 1 166 3 30 PHE QD 3 73 LYS HG3 4.150 . 6.500 5.390 5.007 5.846 . 0 0 "[ . 1 . 2]" 1 167 3 88 TYR QE 3 92 LEU MD2 3.150 . 4.108 2.646 2.346 4.100 . 0 0 "[ . 1 . 2]" 1 168 3 88 TYR QD 3 92 LEU MD2 4.150 . 5.346 2.856 2.483 4.846 . 0 0 "[ . 1 . 2]" 1 169 3 89 ASN QB 3 92 LEU MD2 4.150 . 6.500 3.698 2.992 5.534 . 0 0 "[ . 1 . 2]" 1 170 3 88 TYR HB3 3 92 LEU MD2 4.150 . 6.500 4.244 3.734 6.706 0.206 9 0 "[ . 1 . 2]" 1 171 3 91 THR MG 3 92 LEU MD2 3.150 . 4.500 3.802 2.206 4.574 0.074 5 0 "[ . 1 . 2]" 1 172 3 32 ALA HA 3 55 LEU MD1 3.150 . 3.383 3.357 2.525 3.493 0.110 20 0 "[ . 1 . 2]" 1 173 3 31 PHE QD 3 55 LEU MD1 4.150 . 5.443 5.340 4.633 5.482 0.039 9 0 "[ . 1 . 2]" 1 174 3 31 PHE QE 3 55 LEU MD1 4.150 . 6.500 4.609 4.008 4.780 . 0 0 "[ . 1 . 2]" 1 175 3 59 TRP HB3 3 62 LEU MD1 4.150 . 6.500 4.323 4.207 4.583 . 0 0 "[ . 1 . 2]" 1 176 3 59 TRP HE3 3 62 LEU MD1 3.150 . 3.398 2.453 2.167 2.532 . 0 0 "[ . 1 . 2]" 1 177 3 64 PRO HA 3 67 LYS HG3 4.150 . 6.500 2.349 2.309 2.408 . 0 0 "[ . 1 . 2]" 1 178 3 62 LEU HA 3 67 LYS HG3 3.150 . 4.500 3.457 3.396 3.659 . 0 0 "[ . 1 . 2]" 1 179 3 35 ASN HA 3 55 LEU MD2 4.150 . 6.500 4.075 3.640 4.471 . 0 0 "[ . 1 . 2]" 1 180 3 28 TYR QE 3 55 LEU MD2 4.150 . 6.500 4.216 3.373 5.301 . 0 0 "[ . 1 . 2]" 1 181 3 31 PHE QD 3 55 LEU MD2 4.150 . 4.540 3.639 3.128 4.543 0.003 13 0 "[ . 1 . 2]" 1 182 3 21 PRO HB3 3 87 LEU QD 4.150 . 6.500 4.791 4.251 5.171 . 0 0 "[ . 1 . 2]" 1 183 3 87 LEU QD 3 88 TYR QE 4.150 . 6.500 6.044 5.819 6.297 . 0 0 "[ . 1 . 2]" 1 184 3 63 THR MG 3 65 GLU HB2 3.150 . 4.500 2.252 1.853 2.714 . 0 0 "[ . 1 . 2]" 1 185 3 63 THR MG 3 67 LYS HB2 4.150 . 6.500 5.581 5.407 5.929 . 0 0 "[ . 1 . 2]" 1 186 3 58 LYS QB 3 62 LEU QB 4.150 . 6.500 1.830 1.757 1.871 0.043 1 0 "[ . 1 . 2]" 1 187 3 62 LEU QB 3 67 LYS QD 4.150 . 6.500 4.481 4.031 4.695 . 0 0 "[ . 1 . 2]" 1 188 3 25 LEU HB3 3 30 PHE QE 4.150 . 6.500 2.409 1.843 2.900 . 0 0 "[ . 1 . 2]" 1 189 3 25 LEU HB3 3 30 PHE HZ 4.150 . 6.500 2.325 2.190 2.904 . 0 0 "[ . 1 . 2]" 1 190 3 25 LEU HB3 3 25 LEU MD2 3.150 . 4.500 2.047 1.934 2.218 . 0 0 "[ . 1 . 2]" 1 191 3 25 LEU HB2 3 30 PHE HZ 3.150 . 4.500 2.403 2.053 3.365 . 0 0 "[ . 1 . 2]" 1 192 3 31 PHE QE 3 55 LEU HB3 4.150 . 6.500 3.465 2.698 4.034 . 0 0 "[ . 1 . 2]" 1 193 3 32 ALA HA 3 35 ASN HB2 4.150 . 6.500 2.779 2.085 3.207 . 0 0 "[ . 1 . 2]" 1 194 3 32 ALA HA 3 55 LEU HB2 4.150 . 6.500 5.264 4.544 5.623 . 0 0 "[ . 1 . 2]" 1 195 3 39 VAL HA 3 43 ASN HB3 4.150 . 6.500 4.731 4.682 4.788 . 0 0 "[ . 1 . 2]" 1 196 3 37 ASP HB2 3 38 ILE HA 3.150 . 4.500 4.257 3.923 4.560 0.060 20 0 "[ . 1 . 2]" 1 197 3 70 TYR HB2 3 73 LYS HA 4.150 . 6.500 6.939 6.915 6.971 0.471 11 0 "[ . 1 . 2]" 1 198 3 30 PHE QD 3 70 TYR HB3 3.150 . 4.500 2.367 2.330 2.417 . 0 0 "[ . 1 . 2]" 1 199 3 59 TRP HH2 3 70 TYR HB3 4.150 . 4.637 4.577 4.370 4.686 0.049 8 0 "[ . 1 . 2]" 1 200 3 31 PHE HB3 3 70 TYR HB3 4.150 . 6.500 3.698 3.575 3.858 . 0 0 "[ . 1 . 2]" 1 201 3 81 TYR QB 3 81 TYR QE 3.150 . 4.500 3.943 3.933 3.948 . 0 0 "[ . 1 . 2]" 1 202 3 84 GLU HA 3 88 TYR HB3 4.150 . 6.500 5.570 5.246 5.990 . 0 0 "[ . 1 . 2]" 1 203 3 88 TYR HB3 3 88 TYR QD . . 3.092 2.308 2.268 2.435 . 0 0 "[ . 1 . 2]" 1 204 3 32 ALA HA 3 35 ASN HB3 3.150 . 4.500 4.210 3.749 4.958 0.458 16 0 "[ . 1 . 2]" 1 205 3 31 PHE QE 3 35 ASN HB3 3.150 . 4.500 4.274 4.074 4.371 . 0 0 "[ . 1 . 2]" 1 206 3 76 ALA MB 3 77 ASP HA 4.150 . 5.119 3.817 3.737 3.922 . 0 0 "[ . 1 . 2]" 1 207 3 73 LYS HA 3 76 ALA MB 3.150 . 3.893 2.009 1.912 2.239 . 0 0 "[ . 1 . 2]" 1 208 3 76 ALA MB 3 77 ASP QB 3.150 . 4.500 3.735 3.635 3.904 . 0 0 "[ . 1 . 2]" 1 209 3 73 LYS HB3 3 76 ALA MB 3.150 . 4.500 4.121 4.034 4.230 . 0 0 "[ . 1 . 2]" 1 210 3 30 PHE QE 3 76 ALA MB 4.150 . 6.500 5.313 5.119 5.555 . 0 0 "[ . 1 . 2]" 1 211 3 30 PHE HZ 3 76 ALA MB 4.150 . 6.500 5.857 5.644 6.147 . 0 0 "[ . 1 . 2]" 1 212 3 30 PHE HA 3 32 ALA MB 4.150 . 6.500 4.794 4.600 4.959 . 0 0 "[ . 1 . 2]" 1 213 3 32 ALA MB 3 59 TRP HZ3 4.150 . 6.500 6.582 6.505 6.628 0.128 4 0 "[ . 1 . 2]" 1 214 3 31 PHE QE 3 32 ALA MB 4.150 . 6.500 3.836 3.494 4.030 . 0 0 "[ . 1 . 2]" 1 215 3 31 PHE QD 3 32 ALA MB 3.150 . 4.500 2.897 2.553 3.089 . 0 0 "[ . 1 . 2]" 1 216 3 35 ASN HA 3 38 ILE MG 3.150 . 4.500 2.925 2.742 3.091 . 0 0 "[ . 1 . 2]" 1 217 3 38 ILE MG 3 42 GLU HA 4.150 . 6.500 5.762 5.613 5.959 . 0 0 "[ . 1 . 2]" 1 218 3 46 ILE MG 3 50 GLN QB 3.150 . 4.500 2.162 1.749 3.084 0.051 8 0 "[ . 1 . 2]" 1 219 3 20 ALA MB 3 21 PRO HB3 4.150 . 6.500 5.943 5.763 6.023 . 0 0 "[ . 1 . 2]" 1 220 3 69 PRO HD2 3 72 ALA MB 3.150 . 4.500 3.790 3.750 3.817 . 0 0 "[ . 1 . 2]" 1 221 3 27 ALA MB 3 70 TYR HB3 3.150 . 4.500 4.384 4.211 4.555 0.055 15 0 "[ . 1 . 2]" 1 222 3 27 ALA MB 3 59 TRP HZ3 4.150 . 6.500 4.537 4.292 4.846 . 0 0 "[ . 1 . 2]" 1 223 3 27 ALA MB 3 59 TRP HH2 3.150 . 4.500 2.649 2.370 2.987 . 0 0 "[ . 1 . 2]" 1 224 3 27 ALA MB 3 28 TYR HB3 3.150 . 4.500 4.009 3.943 4.130 . 0 0 "[ . 1 . 2]" 1 225 3 70 TYR HB2 3 74 ALA MB 3.150 . 4.500 4.467 4.338 4.563 0.063 5 0 "[ . 1 . 2]" 1 226 3 36 ARG HA 3 51 VAL MG2 3.150 . 4.500 3.381 2.628 4.597 0.097 1 0 "[ . 1 . 2]" 1 227 3 35 ASN HA 3 39 VAL QG 4.150 . 6.500 2.648 2.474 3.085 . 0 0 "[ . 1 . 2]" 1 228 3 39 VAL QG 3 43 ASN HB2 3.150 . 4.500 3.367 3.243 3.571 . 0 0 "[ . 1 . 2]" 1 229 3 39 VAL QG 3 55 LEU QD 3.150 . 4.500 2.131 1.764 2.571 0.036 13 0 "[ . 1 . 2]" 1 230 3 77 ASP HA 3 80 ARG HG3 3.150 . 4.500 3.989 3.097 4.354 . 0 0 "[ . 1 . 2]" 1 231 3 64 PRO HA 3 67 LYS HG2 4.150 . 6.500 4.016 3.937 4.167 . 0 0 "[ . 1 . 2]" 1 232 3 37 ASP HB2 3 38 ILE HG12 4.150 . 6.500 5.644 4.948 6.522 0.022 3 0 "[ . 1 . 2]" 1 233 3 30 PHE QD 3 73 LYS HD3 3.150 . 4.500 3.256 2.797 4.044 . 0 0 "[ . 1 . 2]" 1 234 3 38 ILE HA 3 38 ILE HG13 3.150 . 3.322 2.389 2.149 2.613 . 0 0 "[ . 1 . 2]" 1 235 3 35 ASN HA 3 38 ILE HG13 4.150 . 6.500 4.952 4.705 5.177 . 0 0 "[ . 1 . 2]" 1 236 3 46 ILE MG 3 50 GLN QB 3.150 . 4.500 2.124 1.745 2.939 0.055 8 0 "[ . 1 . 2]" 1 237 3 46 ILE QG 3 50 GLN QB 3.150 . 4.500 2.939 1.725 3.677 0.075 7 0 "[ . 1 . 2]" 1 238 3 73 LYS HB3 3 73 LYS QD 3.150 . 3.985 2.107 1.933 2.612 . 0 0 "[ . 1 . 2]" 1 239 3 70 TYR HA 3 73 LYS HB3 4.150 . 6.500 2.739 2.603 2.898 . 0 0 "[ . 1 . 2]" 1 240 3 69 PRO HB2 3 70 TYR QE 3.150 . 4.500 3.458 3.388 3.508 . 0 0 "[ . 1 . 2]" 1 241 3 69 PRO HB2 3 70 TYR QD 3.150 . 4.500 3.198 2.961 3.295 . 0 0 "[ . 1 . 2]" 1 242 3 58 LYS QB 3 62 LEU MD2 3.150 . 4.500 3.644 2.697 3.853 . 0 0 "[ . 1 . 2]" 1 243 3 21 PRO HB3 3 81 TYR QE 3.150 . 4.500 3.376 3.245 3.529 . 0 0 "[ . 1 . 2]" 1 244 3 21 PRO HB3 3 81 TYR QD 3.150 . 4.500 3.274 2.746 3.815 . 0 0 "[ . 1 . 2]" 1 245 3 68 GLN HG2 3 72 ALA MB 3.150 . 4.500 4.651 4.562 4.753 0.253 17 0 "[ . 1 . 2]" 1 246 3 88 TYR QD 3 89 ASN QB 4.150 . 6.500 3.436 2.783 4.274 . 0 0 "[ . 1 . 2]" 1 247 3 86 GLU QB 3 89 ASN QB 4.150 . 6.500 5.647 4.918 6.090 . 0 0 "[ . 1 . 2]" 1 248 3 25 LEU QD 3 33 ASN HB3 4.150 . 6.500 5.710 5.469 5.872 . 0 0 "[ . 1 . 2]" 1 249 3 30 PHE QD 3 33 ASN HB3 4.150 . 6.500 5.789 5.578 6.051 . 0 0 "[ . 1 . 2]" 1 250 3 30 PHE QB 3 31 PHE HB3 4.150 . 6.500 3.502 3.403 3.630 . 0 0 "[ . 1 . 2]" 1 251 3 31 PHE HB2 3 31 PHE QE 4.150 . 6.500 4.420 4.401 4.430 . 0 0 "[ . 1 . 2]" 1 252 3 36 ARG QD 3 37 ASP QB 3.150 . 4.500 4.289 3.910 4.666 0.166 18 0 "[ . 1 . 2]" 1 253 3 36 ARG QD 3 37 ASP HA 3.150 . 4.500 3.842 3.346 4.005 . 0 0 "[ . 1 . 2]" 1 254 3 40 ARG QD 3 41 SER HA 3.150 . 4.500 4.099 3.262 4.504 0.004 7 0 "[ . 1 . 2]" 1 255 3 59 TRP HH2 3 71 GLU QG 3.150 . 4.500 4.013 3.582 4.405 . 0 0 "[ . 1 . 2]" 1 256 3 48 PHE HB3 3 48 PHE QD 3.150 . 4.500 2.322 2.266 2.404 . 0 0 "[ . 1 . 2]" 1 257 3 59 TRP HA 3 59 TRP HZ3 4.150 . 5.246 4.543 4.436 4.723 . 0 0 "[ . 1 . 2]" 1 258 3 40 ARG HA 3 51 VAL MG1 3.150 . 4.500 4.398 3.874 4.592 0.092 9 0 "[ . 1 . 2]" 1 259 3 43 ASN HB2 3 51 VAL MG1 4.150 . 6.500 5.279 4.366 5.726 . 0 0 "[ . 1 . 2]" 1 260 3 35 ASN HA 3 38 ILE HG12 3.150 . 4.500 4.012 3.506 4.506 0.006 9 0 "[ . 1 . 2]" 1 261 3 43 ASN HA 3 44 PRO QG 3.150 . 4.500 4.271 4.236 4.324 . 0 0 "[ . 1 . 2]" 1 262 3 62 LEU MD1 3 67 LYS HG3 3.150 . 4.500 4.141 4.046 4.446 . 0 0 "[ . 1 . 2]" 1 263 3 62 LEU HA 3 67 LYS HG2 3.150 . 4.500 2.655 2.588 2.864 . 0 0 "[ . 1 . 2]" 1 264 3 80 ARG HD3 3 81 TYR HA 3.150 . 4.500 3.696 2.268 4.572 0.072 15 0 "[ . 1 . 2]" 1 265 3 59 TRP HZ2 3 67 LYS HD2 3.150 . 4.500 2.648 2.301 4.142 . 0 0 "[ . 1 . 2]" 1 266 3 51 VAL HA 3 51 VAL MG1 3.150 . 3.202 3.149 2.592 3.204 0.002 3 0 "[ . 1 . 2]" 1 267 3 59 TRP HH2 3 67 LYS HD2 4.150 . 6.500 3.138 2.752 4.533 . 0 0 "[ . 1 . 2]" 1 268 3 30 PHE QD 3 74 ALA MB 3.150 . 4.500 2.616 2.519 2.704 . 0 0 "[ . 1 . 2]" 1 269 3 36 ARG HA 3 36 ARG QD 3.150 . 4.500 3.943 2.521 4.176 . 0 0 "[ . 1 . 2]" 1 270 3 43 ASN HB3 3 46 ILE MG 3.150 . 4.500 2.498 1.783 3.289 0.017 16 0 "[ . 1 . 2]" 1 271 3 27 ALA MB 3 30 PHE HA 4.150 . 6.500 6.642 6.452 6.713 0.213 15 0 "[ . 1 . 2]" 1 272 3 31 PHE QE 3 58 LYS QB 3.150 . 4.500 4.072 3.862 4.308 . 0 0 "[ . 1 . 2]" 1 273 3 64 PRO HA 3 67 LYS HB2 3.150 . 4.500 2.913 2.841 3.083 . 0 0 "[ . 1 . 2]" 1 274 3 40 ARG HA 3 40 ARG QD 3.150 . 4.255 3.830 3.523 4.117 . 0 0 "[ . 1 . 2]" 1 275 3 21 PRO HD3 3 88 TYR QD 4.150 . 6.500 2.513 2.054 2.853 . 0 0 "[ . 1 . 2]" 1 276 3 39 VAL HA 3 40 ARG HA 4.150 . 6.500 4.276 4.234 4.307 . 0 0 "[ . 1 . 2]" 1 277 3 63 THR HA 3 64 PRO QD 3.150 . 4.500 2.043 1.999 2.084 . 0 0 "[ . 1 . 2]" 1 278 3 28 TYR QE 3 32 ALA MB 3.150 . 4.500 2.622 2.413 2.838 . 0 0 "[ . 1 . 2]" 1 279 3 59 TRP HA 3 59 TRP HE3 3.150 . 4.500 2.198 2.068 2.419 . 0 0 "[ . 1 . 2]" 1 280 3 64 PRO HA 3 68 GLN HG2 4.150 . 6.500 5.473 4.893 6.636 0.136 17 0 "[ . 1 . 2]" 1 281 3 23 ARG HA 3 81 TYR QD 3.150 . 3.875 3.197 2.743 3.337 . 0 0 "[ . 1 . 2]" 1 282 3 73 LYS HA 3 73 LYS HG3 3.150 . 3.818 3.078 2.185 3.465 . 0 0 "[ . 1 . 2]" 1 283 3 67 LYS HA 3 67 LYS HG3 3.150 . 4.500 3.467 3.404 3.679 . 0 0 "[ . 1 . 2]" 1 284 3 55 LEU MD2 3 58 LYS QB 3.150 . 4.500 3.531 3.217 4.061 . 0 0 "[ . 1 . 2]" 1 285 3 74 ALA MB 3 75 GLN QG 3.150 . 4.500 3.268 2.962 4.377 . 0 0 "[ . 1 . 2]" 1 286 3 30 PHE HZ 3 74 ALA MB 3.150 . 4.500 3.509 3.358 3.657 . 0 0 "[ . 1 . 2]" 1 287 3 71 GLU QG 3 74 ALA MB 3.150 . 4.500 3.225 3.052 3.812 . 0 0 "[ . 1 . 2]" 1 288 3 30 PHE QD 3 73 LYS HB3 3.150 . 4.500 3.273 3.219 3.398 . 0 0 "[ . 1 . 2]" 1 289 3 28 TYR QD 3 32 ALA MB 4.150 . 6.500 2.641 2.495 2.847 . 0 0 "[ . 1 . 2]" 1 290 3 59 TRP HA 3 62 LEU MD1 3.150 . 4.378 1.862 1.776 2.151 0.024 17 0 "[ . 1 . 2]" 1 291 3 28 TYR QD 3 29 MET HA 3.150 . 4.500 3.046 2.651 3.352 . 0 0 "[ . 1 . 2]" 1 292 3 85 LYS HA 3 88 TYR HB2 3.150 . 4.115 2.440 2.199 2.822 . 0 0 "[ . 1 . 2]" 1 293 3 32 ALA MB 3 33 ASN HB3 4.150 . 6.500 5.504 5.151 5.597 . 0 0 "[ . 1 . 2]" 1 294 3 71 GLU HA 3 71 GLU QG 3.150 . 4.500 2.318 2.118 2.658 . 0 0 "[ . 1 . 2]" 1 295 3 31 PHE QE 3 55 LEU MD2 3.150 . 3.796 2.463 1.831 3.206 . 0 0 "[ . 1 . 2]" 1 296 3 85 LYS HB2 3 88 TYR HB3 4.150 . 6.500 3.655 3.402 3.992 . 0 0 "[ . 1 . 2]" 1 297 3 25 LEU HB2 3 25 LEU MD2 3.150 . 4.500 2.619 2.447 3.022 . 0 0 "[ . 1 . 2]" 1 298 3 62 LEU MD1 3 67 LYS HA 3.150 . 4.500 4.060 3.668 4.178 . 0 0 "[ . 1 . 2]" 1 299 3 74 ALA HA 3 77 ASP HA 4.150 . 6.500 5.481 5.150 5.577 . 0 0 "[ . 1 . 2]" 1 300 3 35 ASN HB2 3 55 LEU MD2 3.150 . 4.500 1.886 1.760 2.121 0.040 11 0 "[ . 1 . 2]" 1 301 3 43 ASN HA 3 46 ILE MG 4.150 . 4.643 4.252 3.051 4.725 0.082 7 0 "[ . 1 . 2]" 1 302 3 88 TYR QE 3 92 LEU MD1 3.150 . 4.500 4.151 3.225 4.584 0.084 19 0 "[ . 1 . 2]" 1 303 3 85 LYS HA 3 85 LYS QG 3.150 . 4.500 3.265 3.123 3.356 . 0 0 "[ . 1 . 2]" 1 304 3 71 GLU HB3 3 72 ALA MB 3.150 . 4.500 3.498 3.440 3.669 . 0 0 "[ . 1 . 2]" 1 305 3 39 VAL HA 3 39 VAL QG . . 2.950 2.134 2.084 2.384 . 0 0 "[ . 1 . 2]" 1 306 3 63 THR MG 3 64 PRO HA 4.150 . 6.500 3.858 3.830 3.917 . 0 0 "[ . 1 . 2]" 1 307 3 54 LYS HA 3 55 LEU MD2 3.150 . 4.500 2.532 1.802 3.104 . 0 0 "[ . 1 . 2]" 1 308 3 6 GLU HA 3 7 PRO HD2 3.150 . 4.500 2.637 1.965 4.050 . 0 0 "[ . 1 . 2]" 1 309 3 89 ASN QB 3 92 LEU QD 4.150 . 6.500 3.406 2.921 4.515 . 0 0 "[ . 1 . 2]" 1 310 3 36 ARG HA 3 36 ARG QG 3.150 . 4.500 2.755 2.292 2.926 . 0 0 "[ . 1 . 2]" 1 311 3 43 ASN HB3 3 46 ILE HA 4.150 . 6.500 4.686 3.490 5.215 . 0 0 "[ . 1 . 2]" 1 312 3 59 TRP HH2 3 67 LYS HD3 4.150 . 6.500 4.488 3.723 4.756 . 0 0 "[ . 1 . 2]" 1 313 3 39 VAL QG 3 51 VAL HA 3.150 . 3.695 2.714 2.228 2.989 . 0 0 "[ . 1 . 2]" 1 314 3 28 TYR HB2 3 28 TYR QD 3.150 . 4.500 2.303 2.283 2.330 . 0 0 "[ . 1 . 2]" 1 315 3 32 ALA HA 3 55 LEU MD2 3.150 . 4.500 2.193 1.796 3.349 0.004 12 0 "[ . 1 . 2]" 1 316 3 25 LEU HA 3 25 LEU QD 3.150 . 3.173 2.729 2.609 2.995 . 0 0 "[ . 1 . 2]" 1 317 3 43 ASN HB3 3 45 ASP HA 4.150 . 6.500 6.149 5.720 6.287 . 0 0 "[ . 1 . 2]" 1 318 3 43 ASN HB3 3 46 ILE MG 3.150 . 3.676 2.503 1.784 3.319 0.016 16 0 "[ . 1 . 2]" 1 319 3 46 ILE MG 3 50 GLN QG 4.150 . 6.500 2.514 1.788 3.325 0.012 15 0 "[ . 1 . 2]" 1 320 3 39 VAL HA 3 51 VAL HA 4.150 . 6.500 6.291 5.668 6.556 0.056 6 0 "[ . 1 . 2]" 1 321 3 62 LEU MD1 3 67 LYS HD3 3.150 . 4.500 4.390 3.378 4.541 0.041 8 0 "[ . 1 . 2]" 1 322 3 38 ILE HB 3 41 SER QB 4.150 . 6.500 4.861 4.752 5.004 . 0 0 "[ . 1 . 2]" 1 323 3 89 ASN QB 3 90 ALA MB 4.150 . 6.500 4.241 3.746 4.583 . 0 0 "[ . 1 . 2]" 1 324 3 91 THR MG 3 92 LEU HA 3.150 . 4.500 2.868 2.748 2.964 . 0 0 "[ . 1 . 2]" 1 325 3 84 GLU HA 3 84 GLU QG 3.150 . 4.500 3.249 3.035 3.346 . 0 0 "[ . 1 . 2]" 1 326 3 89 ASN QB 3 92 LEU HG 3.150 . 4.500 3.905 3.579 4.624 0.124 9 0 "[ . 1 . 2]" 1 327 3 28 TYR HA 3 59 TRP HZ3 4.150 . 6.500 5.270 4.896 5.564 . 0 0 "[ . 1 . 2]" 1 328 3 31 PHE QE 3 32 ALA HA 4.150 . 6.500 3.657 3.077 3.865 . 0 0 "[ . 1 . 2]" 1 329 3 62 LEU MD1 3 67 LYS HD2 3.150 . 4.500 4.509 4.437 4.632 0.132 5 0 "[ . 1 . 2]" 1 330 3 40 ARG QB 3 51 VAL MG1 3.150 . 4.500 3.597 2.648 4.278 . 0 0 "[ . 1 . 2]" 1 331 3 63 THR MG 3 64 PRO QD 3.150 . 4.500 1.749 1.706 1.778 0.094 8 0 "[ . 1 . 2]" 1 332 3 73 LYS HB3 3 73 LYS HD2 3.150 . 4.500 2.945 2.360 3.444 . 0 0 "[ . 1 . 2]" 1 333 3 73 LYS HA 3 73 LYS HG2 3.150 . 4.500 2.142 2.023 2.876 . 0 0 "[ . 1 . 2]" 1 334 3 30 PHE HA 3 33 ASN HB3 3.150 . 4.500 3.779 3.559 4.014 . 0 0 "[ . 1 . 2]" 1 335 3 80 ARG HA 3 80 ARG HD3 3.150 . 4.500 3.826 2.914 4.316 . 0 0 "[ . 1 . 2]" 1 336 3 43 ASN HB3 3 46 ILE HB 3.150 . 4.500 3.804 1.731 4.577 0.077 19 0 "[ . 1 . 2]" 1 337 3 39 VAL QG 3 40 ARG HA 3.150 . 4.500 3.011 2.794 3.347 . 0 0 "[ . 1 . 2]" 1 338 3 59 TRP HH2 3 70 TYR HB2 4.150 . 4.614 2.928 2.716 3.098 . 0 0 "[ . 1 . 2]" 1 339 3 59 TRP HZ2 3 67 LYS HD3 4.150 . 5.282 4.107 3.495 4.478 . 0 0 "[ . 1 . 2]" 1 340 3 23 ARG HA 3 81 TYR QE 3.150 . 3.649 2.514 2.268 2.733 . 0 0 "[ . 1 . 2]" 1 341 3 12 THR HA 3 13 ARG QG 3.150 . 4.500 4.049 3.446 4.524 0.024 12 0 "[ . 1 . 2]" 1 342 3 67 LYS HA 3 67 LYS QD 4.150 . 6.500 3.977 3.822 4.061 . 0 0 "[ . 1 . 2]" 1 343 3 40 ARG HA 3 51 VAL MG2 3.150 . 4.500 2.972 2.250 3.471 . 0 0 "[ . 1 . 2]" 1 344 3 40 ARG HA 3 46 ILE MG 3.150 . 4.500 4.109 3.438 4.408 . 0 0 "[ . 1 . 2]" 1 345 3 38 ILE MG 3 42 GLU HG2 3.150 . 4.500 4.063 3.475 4.487 . 0 0 "[ . 1 . 2]" 1 346 3 35 ASN HB2 3 36 ARG QG 4.150 . 6.500 5.399 3.280 6.346 . 0 0 "[ . 1 . 2]" 1 347 3 39 VAL HB 3 43 ASN HB2 3.150 . 4.500 4.102 2.218 4.565 0.065 4 0 "[ . 1 . 2]" 1 348 3 68 GLN QG 3 72 ALA MB 3.150 . 4.500 3.941 3.383 4.148 . 0 0 "[ . 1 . 2]" 1 349 3 67 LYS HA 3 68 GLN HG3 3.150 . 4.500 3.420 2.958 3.530 . 0 0 "[ . 1 . 2]" 1 350 3 28 TYR HB3 3 28 TYR QD 3.150 . 4.500 2.536 2.476 2.589 . 0 0 "[ . 1 . 2]" 1 351 3 84 GLU HG2 3 87 LEU QD 4.150 . 6.500 4.657 3.893 5.355 . 0 0 "[ . 1 . 2]" 1 352 3 48 PHE HB2 3 48 PHE QD 3.150 . 4.500 2.740 2.676 2.762 . 0 0 "[ . 1 . 2]" 1 353 3 36 ARG HA 3 55 LEU MD2 3.150 . 3.942 3.487 2.431 3.931 . 0 0 "[ . 1 . 2]" 1 354 3 67 LYS HB2 3 67 LYS QD 3.150 . 4.500 3.086 2.556 3.177 . 0 0 "[ . 1 . 2]" 1 355 3 84 GLU HA 3 87 LEU HB3 3.150 . 4.500 2.966 2.785 4.292 . 0 0 "[ . 1 . 2]" 1 356 3 46 ILE HA 3 46 ILE MG 3.150 . 3.396 2.357 1.931 3.144 . 0 0 "[ . 1 . 2]" 1 357 3 59 TRP HA 3 62 LEU MD2 3.150 . 4.500 4.084 3.190 4.215 . 0 0 "[ . 1 . 2]" 1 358 3 88 TYR HB2 3 89 ASN QB 4.150 . 6.500 5.762 5.427 6.089 . 0 0 "[ . 1 . 2]" 1 359 3 39 VAL QG 3 42 GLU HG2 3.150 . 4.500 4.461 4.264 4.536 0.036 17 0 "[ . 1 . 2]" 1 360 3 31 PHE QD 3 62 LEU MD1 . . 4.037 3.121 2.779 3.241 . 0 0 "[ . 1 . 2]" 1 361 3 86 GLU QB 3 90 ALA MB 3.150 . 4.500 4.150 3.943 4.405 . 0 0 "[ . 1 . 2]" 1 362 3 59 TRP HZ3 3 62 LEU MD1 3.150 . 4.199 3.260 2.948 3.385 . 0 0 "[ . 1 . 2]" 1 363 3 53 LYS HA 3 53 LYS QB 2.150 . 2.500 2.391 2.344 2.529 0.029 7 0 "[ . 1 . 2]" 1 364 3 74 ALA MB 3 77 ASP QB 3.150 . 4.500 4.103 3.744 4.281 . 0 0 "[ . 1 . 2]" 1 365 3 62 LEU MD2 3 66 GLU QG 3.150 . 4.205 3.226 2.900 3.601 . 0 0 "[ . 1 . 2]" 1 366 3 64 PRO HA 3 67 LYS HD3 3.150 . 4.500 3.294 2.864 4.734 0.234 17 0 "[ . 1 . 2]" 1 367 3 68 GLN HA 3 68 GLN HG3 3.150 . 4.500 3.509 3.382 3.564 . 0 0 "[ . 1 . 2]" 1 368 3 32 ALA HA 3 55 LEU QD 3.150 . 4.500 2.094 1.790 2.563 0.010 12 0 "[ . 1 . 2]" 1 369 3 38 ILE HA 3 38 ILE HG12 3.150 . 3.622 3.564 3.473 3.636 0.014 16 0 "[ . 1 . 2]" 1 370 3 46 ILE HA 3 46 ILE MG 3.150 . 4.500 2.362 1.932 3.165 . 0 0 "[ . 1 . 2]" 1 371 3 84 GLU HA 3 87 LEU QD 3.150 . 3.677 2.344 1.791 2.849 0.009 19 0 "[ . 1 . 2]" 1 372 3 20 ALA HA 3 21 PRO HA 4.150 . 6.500 4.473 4.383 4.548 . 0 0 "[ . 1 . 2]" 1 373 3 67 LYS HA 3 67 LYS HG2 3.150 . 4.500 2.642 2.574 2.844 . 0 0 "[ . 1 . 2]" 1 374 3 79 LYS HA 3 79 LYS QB 2.150 . 2.500 2.383 2.168 2.522 0.022 13 0 "[ . 1 . 2]" 1 375 3 21 PRO HB2 3 81 TYR QD 3.150 . 4.500 2.536 2.079 3.150 . 0 0 "[ . 1 . 2]" 1 376 3 39 VAL QG 3 55 LEU HB2 3.150 . 4.500 4.183 3.713 4.800 0.300 18 0 "[ . 1 . 2]" 1 377 3 67 LYS HA 3 68 GLN HG2 3.150 . 4.500 2.415 2.266 3.350 . 0 0 "[ . 1 . 2]" 1 378 3 63 THR MG 3 66 GLU QG 3.150 . 4.500 2.406 2.134 2.990 . 0 0 "[ . 1 . 2]" 1 379 3 58 LYS HA 3 62 LEU MD1 3.150 . 4.500 4.235 4.140 4.449 . 0 0 "[ . 1 . 2]" 1 380 3 51 VAL HA 3 51 VAL MG2 3.150 . 3.503 2.409 2.057 2.618 . 0 0 "[ . 1 . 2]" 1 381 3 68 GLN HA 3 69 PRO HD2 3.150 . 4.500 3.527 3.389 3.563 . 0 0 "[ . 1 . 2]" 1 382 3 24 ALA MB 3 26 SER HA 3.150 . 4.500 4.793 3.703 4.932 0.432 16 0 "[ . 1 . 2]" 1 383 3 30 PHE QD 3 70 TYR HB2 3.150 . 3.868 2.339 2.298 2.381 . 0 0 "[ . 1 . 2]" 1 384 3 73 LYS HD3 3 73 LYS HG2 2.150 . 2.500 2.648 2.417 2.964 0.464 10 0 "[ . 1 . 2]" 1 385 3 58 LYS QB 3 62 LEU MD1 3.150 . 4.500 3.874 3.741 4.402 . 0 0 "[ . 1 . 2]" 1 386 3 44 PRO HA 3 44 PRO HD2 3.150 . 4.500 3.924 3.913 3.928 . 0 0 "[ . 1 . 2]" 1 387 3 63 THR HB 3 65 GLU HG3 3.150 . 4.500 3.786 3.617 3.955 . 0 0 "[ . 1 . 2]" 1 388 3 27 ALA MB 3 59 TRP HZ2 3.150 . 4.500 2.231 1.924 3.003 . 0 0 "[ . 1 . 2]" 1 389 3 18 PRO HA 3 18 PRO QD 3.150 . 4.500 3.284 3.259 3.322 . 0 0 "[ . 1 . 2]" 1 390 3 46 ILE HA 3 50 GLN HA 4.150 . 6.500 6.244 5.820 6.655 0.155 8 0 "[ . 1 . 2]" 1 391 3 55 LEU HB2 3 55 LEU MD2 3.150 . 4.500 3.125 3.048 3.186 . 0 0 "[ . 1 . 2]" 1 392 3 30 PHE QD 3 73 LYS HD2 3.150 . 4.500 3.997 3.350 4.507 0.007 8 0 "[ . 1 . 2]" 1 393 3 39 VAL HB 3 39 VAL QG 2.150 . 2.500 1.889 1.877 1.896 . 0 0 "[ . 1 . 2]" 1 394 3 80 ARG HA 3 80 ARG HG3 3.150 . 4.500 3.485 3.265 3.697 . 0 0 "[ . 1 . 2]" 1 395 3 43 ASN HB2 3 46 ILE MG 3.150 . 4.500 3.252 2.788 3.633 . 0 0 "[ . 1 . 2]" 1 396 3 73 LYS HB2 3 73 LYS QD 3.150 . 4.500 2.879 2.241 3.198 . 0 0 "[ . 1 . 2]" 1 397 3 79 LYS QB 3 80 ARG HD3 3.150 . 4.500 3.176 2.071 3.450 . 0 0 "[ . 1 . 2]" 1 398 3 43 ASN HB2 3 46 ILE MG 3.150 . 4.500 3.291 2.794 3.704 . 0 0 "[ . 1 . 2]" 1 399 3 43 ASN HA 3 44 PRO HD2 3.150 . 3.242 2.686 2.624 2.771 . 0 0 "[ . 1 . 2]" 1 400 3 92 LEU QB 3 92 LEU MD2 2.150 . 2.500 2.060 1.978 2.524 0.024 19 0 "[ . 1 . 2]" 1 401 3 43 ASN HA 3 44 PRO HD3 3.150 . 3.373 2.659 2.557 2.755 . 0 0 "[ . 1 . 2]" 1 402 3 31 PHE QE 3 62 LEU MD1 3.150 . 3.763 2.018 1.851 2.209 . 0 0 "[ . 1 . 2]" 1 403 3 36 ARG QD 3 51 VAL MG2 3.150 . 4.500 4.073 2.860 4.451 . 0 0 "[ . 1 . 2]" 1 404 3 64 PRO HA 3 67 LYS HD2 4.150 . 6.500 4.099 3.216 4.535 . 0 0 "[ . 1 . 2]" 1 405 3 69 PRO HB3 3 70 TYR QD 3.150 . 4.500 4.561 4.517 4.654 0.154 14 0 "[ . 1 . 2]" 1 406 3 40 ARG QD 3 51 VAL MG1 3.150 . 4.500 4.612 4.524 4.726 0.226 20 0 "[ . 1 . 2]" 1 407 3 27 ALA HA 3 74 ALA MB 3.150 . 4.500 2.421 2.182 2.552 . 0 0 "[ . 1 . 2]" 1 408 3 55 LEU HA 3 55 LEU MD2 3.150 . 3.571 2.534 1.803 3.108 . 0 0 "[ . 1 . 2]" 1 409 3 27 ALA MB 3 70 TYR QD 3.150 . 4.500 3.929 3.606 4.287 . 0 0 "[ . 1 . 2]" 1 410 3 31 PHE HZ 3 62 LEU MD2 3.150 . 4.500 3.821 3.521 4.065 . 0 0 "[ . 1 . 2]" 1 411 3 31 PHE HZ 3 58 LYS QB 3.150 . 4.500 3.168 2.948 3.422 . 0 0 "[ . 1 . 2]" 1 412 3 84 GLU HA 3 84 GLU HB2 2.150 . 2.500 2.376 2.292 2.510 0.010 10 0 "[ . 1 . 2]" 1 413 3 48 PHE HA 3 51 VAL MG2 3.150 . 4.500 4.271 3.834 4.581 0.081 7 0 "[ . 1 . 2]" 1 414 3 21 PRO HB2 3 81 TYR QE 3.150 . 3.708 1.821 1.770 1.960 0.030 15 0 "[ . 1 . 2]" 1 415 3 27 ALA MB 3 71 GLU QG 3.150 . 4.500 2.362 2.207 2.620 . 0 0 "[ . 1 . 2]" 1 416 3 63 THR HA 3 63 THR MG 3.150 . 3.235 2.718 2.612 2.815 . 0 0 "[ . 1 . 2]" 1 417 3 55 LEU HB3 3 55 LEU MD2 3.150 . 4.500 2.183 2.005 2.550 . 0 0 "[ . 1 . 2]" 1 418 3 80 ARG HD3 3 84 GLU HG2 3.150 . 4.500 3.851 3.102 4.558 0.058 9 0 "[ . 1 . 2]" 1 419 3 64 PRO HA 3 68 GLN HG3 3.150 . 4.500 2.064 1.760 4.564 0.064 5 0 "[ . 1 . 2]" 1 420 3 87 LEU HB2 3 91 THR HB 3.150 . 4.500 4.255 2.621 4.562 0.062 19 0 "[ . 1 . 2]" 1 421 3 10 ARG QB 3 11 THR HA 3.150 . 4.500 4.035 3.606 4.537 0.037 18 0 "[ . 1 . 2]" 1 422 3 32 ALA MB 3 55 LEU MD2 3.150 . 4.500 2.801 2.268 3.950 . 0 0 "[ . 1 . 2]" 1 423 3 40 ARG HA 3 40 ARG QG 3.150 . 4.500 2.789 2.213 3.376 . 0 0 "[ . 1 . 2]" 1 424 3 73 LYS HB3 3 73 LYS HD3 3.150 . 4.500 2.190 1.950 2.723 . 0 0 "[ . 1 . 2]" 1 425 3 30 PHE QB 3 74 ALA MB 3.150 . 4.500 4.083 3.988 4.147 . 0 0 "[ . 1 . 2]" 1 426 3 30 PHE HZ 3 77 ASP QB 3.150 . 3.319 2.158 2.046 2.241 . 0 0 "[ . 1 . 2]" 1 427 3 64 PRO HA 3 67 LYS HB2 3.150 . 4.500 2.929 2.857 3.095 . 0 0 "[ . 1 . 2]" 1 428 3 36 ARG QB 3 36 ARG QD 2.150 . 2.500 1.847 1.772 1.919 0.028 7 0 "[ . 1 . 2]" 1 429 3 38 ILE HG13 3 38 ILE MG 3.150 . 4.500 2.457 2.263 2.684 . 0 0 "[ . 1 . 2]" 1 430 3 21 PRO HD2 3 88 TYR QD 4.150 . 6.500 3.955 3.322 4.245 . 0 0 "[ . 1 . 2]" 1 431 3 38 ILE HA 3 38 ILE MG 3.150 . 4.500 2.592 2.538 2.647 . 0 0 "[ . 1 . 2]" 1 432 3 38 ILE HA 3 51 VAL MG2 3.150 . 4.500 4.238 3.823 4.533 0.033 7 0 "[ . 1 . 2]" 1 433 3 69 PRO HB2 3 70 TYR HB3 3.150 . 4.500 4.624 4.590 4.730 0.230 5 0 "[ . 1 . 2]" 1 434 3 58 LYS HA 3 58 LYS QB 2.150 . 2.500 2.348 2.244 2.389 . 0 0 "[ . 1 . 2]" 1 435 3 21 PRO HD3 3 81 TYR QE 3.150 . 4.500 3.318 3.001 3.545 . 0 0 "[ . 1 . 2]" 1 436 3 63 THR HA 3 67 LYS HB2 4.150 . 6.500 6.514 6.348 6.552 0.052 10 0 "[ . 1 . 2]" 1 437 3 35 ASN HB3 3 55 LEU MD2 3.150 . 4.500 2.478 1.836 2.919 . 0 0 "[ . 1 . 2]" 1 438 3 73 LYS HG3 3 76 ALA MB 3.150 . 4.500 4.315 3.355 4.649 0.149 7 0 "[ . 1 . 2]" 1 439 3 55 LEU HB2 3 55 LEU MD1 3.150 . 4.500 2.090 1.943 2.512 . 0 0 "[ . 1 . 2]" 1 440 3 88 TYR HA 3 92 LEU MD2 3.150 . 4.500 2.573 2.063 4.389 . 0 0 "[ . 1 . 2]" 1 441 3 50 GLN HA 3 50 GLN QG 3.150 . 4.500 3.196 2.219 3.464 . 0 0 "[ . 1 . 2]" 1 442 3 63 THR HB 3 66 GLU QG 3.150 . 4.500 1.840 1.757 2.039 0.043 8 0 "[ . 1 . 2]" 1 443 3 87 LEU HA 3 87 LEU QD 3.150 . 3.186 3.238 3.193 3.387 0.201 5 0 "[ . 1 . 2]" 1 444 3 70 TYR HA 3 73 LYS HA 3.150 . 4.500 4.612 4.566 4.654 0.154 6 0 "[ . 1 . 2]" 1 445 3 21 PRO HB2 3 84 GLU HA 3.150 . 4.500 2.957 2.782 4.226 . 0 0 "[ . 1 . 2]" 1 446 3 87 LEU QD 3 90 ALA MB 3.150 . 4.500 3.655 3.358 4.167 . 0 0 "[ . 1 . 2]" 1 447 3 46 ILE HB 3 50 GLN QB 3.150 . 4.500 2.101 1.628 3.765 0.172 15 0 "[ . 1 . 2]" 1 448 3 69 PRO HA 3 69 PRO HG2 3.150 . 4.500 3.924 3.894 3.963 . 0 0 "[ . 1 . 2]" 1 449 3 68 GLN HG3 3 69 PRO HD3 4.150 . 6.500 3.592 2.947 4.123 . 0 0 "[ . 1 . 2]" 1 450 3 74 ALA HA 3 77 ASP QB 3.150 . 3.917 2.837 2.294 3.077 . 0 0 "[ . 1 . 2]" 1 451 3 23 ARG HG3 3 24 ALA HA 3.150 . 4.500 4.093 3.352 4.681 0.181 8 0 "[ . 1 . 2]" 1 452 3 20 ALA MB 3 81 TYR QE 3.150 . 4.500 3.747 3.657 3.847 . 0 0 "[ . 1 . 2]" 1 453 3 20 ALA MB 3 81 TYR QD 4.150 . 6.500 6.601 6.340 6.707 0.207 6 0 "[ . 1 . 2]" 1 454 3 44 PRO HA 3 44 PRO HD3 4.150 . 6.500 3.768 3.719 3.859 . 0 0 "[ . 1 . 2]" 1 455 3 63 THR HA 3 64 PRO HA 3.150 . 4.500 4.400 4.378 4.408 . 0 0 "[ . 1 . 2]" 1 456 3 75 GLN HA 3 75 GLN QG 3.150 . 4.500 2.606 2.450 3.319 . 0 0 "[ . 1 . 2]" 1 457 3 27 ALA MB 3 70 TYR HB2 3.150 . 4.500 3.057 2.834 3.321 . 0 0 "[ . 1 . 2]" 1 458 3 62 LEU MD1 3 70 TYR QE 3.150 . 4.500 3.088 2.591 3.212 . 0 0 "[ . 1 . 2]" 1 459 3 73 LYS HA 3 73 LYS HD2 3.150 . 4.500 4.465 4.126 4.630 0.130 2 0 "[ . 1 . 2]" 1 460 3 46 ILE MG 3 51 VAL HA 3.150 . 3.151 3.018 2.585 3.177 0.026 10 0 "[ . 1 . 2]" 1 461 3 39 VAL QG 3 41 SER HA 3.150 . 4.500 3.219 2.959 3.561 . 0 0 "[ . 1 . 2]" 1 462 3 62 LEU MD1 3 70 TYR QD 3.150 . 4.500 4.510 4.171 4.593 0.093 20 0 "[ . 1 . 2]" 1 463 3 86 GLU HA 3 89 ASN QB 3.150 . 4.500 4.152 3.718 4.499 . 0 0 "[ . 1 . 2]" 1 464 3 46 ILE QG 3 46 ILE MG 3.150 . 3.588 2.247 2.056 2.435 . 0 0 "[ . 1 . 2]" 1 465 3 44 PRO HA 3 44 PRO QG . . 3.020 2.953 2.913 3.048 0.028 14 0 "[ . 1 . 2]" 1 466 3 32 ALA MB 3 33 ASN HA 3.150 . 4.500 3.933 3.764 3.988 . 0 0 "[ . 1 . 2]" 1 467 3 62 LEU MD1 3 62 LEU MD2 . . 2.921 1.907 1.861 2.046 . 0 0 "[ . 1 . 2]" 1 468 3 57 GLU HA 3 57 GLU HB3 2.150 . 2.500 2.610 2.362 2.972 0.472 4 0 "[ . 1 . 2]" 1 469 3 68 GLN HA 3 69 PRO HD3 3.150 . 4.500 3.305 3.166 3.355 . 0 0 "[ . 1 . 2]" 1 470 3 21 PRO HD2 3 81 TYR QD 4.150 . 6.500 5.343 4.871 5.836 . 0 0 "[ . 1 . 2]" 1 471 3 69 PRO HA 3 73 LYS HA 3.150 . 4.500 4.687 4.671 4.717 0.217 14 0 "[ . 1 . 2]" 1 472 3 31 PHE HB2 3 31 PHE QD 3.150 . 4.500 2.431 2.367 2.460 . 0 0 "[ . 1 . 2]" 1 473 3 69 PRO HB3 3 69 PRO QD 3.150 . 4.500 3.442 2.926 3.542 . 0 0 "[ . 1 . 2]" 1 474 3 68 GLN HG3 3 69 PRO HD2 4.150 . 6.500 4.456 3.653 4.759 . 0 0 "[ . 1 . 2]" 1 475 3 63 THR MG 3 64 PRO HA 4.150 . 6.500 3.422 3.350 3.564 . 0 0 "[ . 1 . 2]" 1 476 3 36 ARG HA 3 51 VAL MG2 3.150 . 4.500 2.554 1.925 2.747 . 0 0 "[ . 1 . 2]" 1 477 3 51 VAL HA 3 51 VAL MG2 3.150 . 4.500 2.391 2.050 2.580 . 0 0 "[ . 1 . 2]" 1 478 3 26 SER HA 3 27 ALA MB 3.150 . 4.500 4.006 3.936 4.038 . 0 0 "[ . 1 . 2]" 1 479 3 34 GLU HA 3 35 ASN HA 3.150 . 4.500 4.745 4.664 4.773 0.273 17 0 "[ . 1 . 2]" 1 480 3 85 LYS HA 3 88 TYR HB3 3.150 . 3.504 2.018 1.920 2.214 . 0 0 "[ . 1 . 2]" 1 481 3 84 GLU HA 3 84 GLU HG2 3.150 . 4.500 3.744 3.570 3.994 . 0 0 "[ . 1 . 2]" 1 482 3 30 PHE QD 3 77 ASP QB 3.150 . 3.612 3.886 3.809 4.049 0.437 8 0 "[ . 1 . 2]" 1 483 3 30 PHE QB 3 73 LYS HD2 3.150 . 4.500 3.060 2.288 4.226 . 0 0 "[ . 1 . 2]" 1 484 3 44 PRO HB2 3 44 PRO QG 2.150 . 2.500 2.249 2.238 2.254 . 0 0 "[ . 1 . 2]" 1 485 3 59 TRP HH2 3 60 LYS HA 4.150 . 6.500 6.583 6.490 6.647 0.147 8 0 "[ . 1 . 2]" 1 486 3 47 THR HA 3 47 THR MG 2.150 . 2.500 2.162 1.912 2.565 0.065 13 0 "[ . 1 . 2]" 1 487 3 38 ILE HG12 3 38 ILE MG 3.150 . 4.500 2.298 2.067 2.500 . 0 0 "[ . 1 . 2]" 1 488 3 62 LEU MD1 3 67 LYS HG2 3.150 . 4.500 2.995 2.526 3.186 . 0 0 "[ . 1 . 2]" 1 489 3 31 PHE HB3 3 59 TRP HZ3 3.150 . 4.500 3.279 2.997 3.481 . 0 0 "[ . 1 . 2]" 1 490 3 30 PHE HZ 3 74 ALA HA 4.150 . 4.534 2.579 2.457 2.760 . 0 0 "[ . 1 . 2]" 1 491 3 19 ASN QB 3 88 TYR QD 4.150 . 6.500 1.785 1.741 1.852 0.059 11 0 "[ . 1 . 2]" 1 492 3 19 ASN QB 3 88 TYR QE 3.150 . 4.500 3.503 3.239 3.858 . 0 0 "[ . 1 . 2]" 1 493 3 18 PRO HA 3 19 ASN QB 4.150 . 6.500 5.354 5.269 5.615 . 0 0 "[ . 1 . 2]" 1 494 3 48 PHE HA 3 48 PHE QD . . 2.500 2.329 2.128 2.460 . 0 0 "[ . 1 . 2]" 1 495 3 29 MET HA 3 32 ALA MB 3.150 . 4.500 2.463 2.010 2.850 . 0 0 "[ . 1 . 2]" 1 496 3 18 PRO QG 3 88 TYR QD 3.150 . 4.500 3.178 3.008 3.507 . 0 0 "[ . 1 . 2]" 1 497 3 18 PRO QG 3 88 TYR HB3 4.150 . 6.500 5.740 5.568 5.915 . 0 0 "[ . 1 . 2]" 1 498 3 18 PRO HB3 3 88 TYR QE 3.150 . 4.500 4.578 4.508 4.640 0.140 12 0 "[ . 1 . 2]" 1 499 3 21 PRO HB3 3 81 TYR QD 3.150 . 4.238 3.230 2.736 3.733 . 0 0 "[ . 1 . 2]" 1 500 3 32 ALA HA 3 34 GLU QB 4.150 . 6.500 2.766 2.083 3.173 . 0 0 "[ . 1 . 2]" 1 501 3 37 ASP HA 3 55 LEU MD1 4.150 . 6.500 6.525 6.097 6.631 0.131 1 0 "[ . 1 . 2]" 1 502 3 38 ILE HB 3 55 LEU MD2 4.150 . 6.500 5.617 4.874 6.216 . 0 0 "[ . 1 . 2]" 1 503 3 68 GLN HG3 3 69 PRO HA 4.150 . 6.500 6.211 3.179 6.595 0.095 15 0 "[ . 1 . 2]" 1 504 3 70 TYR HB3 3 74 ALA HA 4.150 . 6.500 6.453 6.409 6.509 0.009 6 0 "[ . 1 . 2]" 1 505 3 62 LEU MD1 3 63 THR MG 4.150 . 6.500 5.670 5.477 5.991 . 0 0 "[ . 1 . 2]" 1 506 3 62 LEU MD1 3 67 LYS HB2 4.150 . 6.500 5.522 5.057 5.701 . 0 0 "[ . 1 . 2]" 1 507 3 62 LEU MD1 3 67 LYS HB3 4.150 . 6.500 4.926 4.117 5.147 . 0 0 "[ . 1 . 2]" 1 508 3 28 TYR HB2 3 56 GLY HA2 4.150 . 6.500 6.014 5.650 6.495 . 0 0 "[ . 1 . 2]" 1 509 3 73 LYS HA 3 74 ALA MB 4.150 . 6.500 4.936 4.909 4.949 . 0 0 "[ . 1 . 2]" 1 510 3 38 ILE HB 3 40 ARG QD 3.150 . 4.500 4.450 3.884 4.604 0.104 15 0 "[ . 1 . 2]" 1 511 3 60 LYS HG2 3 67 LYS HG3 4.150 . 6.500 6.186 5.949 6.492 . 0 0 "[ . 1 . 2]" 1 512 3 25 LEU HB2 3 30 PHE QD 4.650 . 7.500 4.260 3.799 5.216 . 0 0 "[ . 1 . 2]" 1 513 3 62 LEU QB 3 67 LYS HG3 4.150 . 6.500 4.009 3.719 4.136 . 0 0 "[ . 1 . 2]" 1 514 3 81 TYR HA 3 81 TYR QE 4.150 . 5.458 5.345 5.289 5.402 . 0 0 "[ . 1 . 2]" 1 515 3 35 ASN HB2 3 36 ARG HA 4.150 . 6.500 3.250 3.069 3.608 . 0 0 "[ . 1 . 2]" 1 516 3 54 LYS HA 3 54 LYS QD . . 2.952 2.945 2.701 3.034 0.082 2 0 "[ . 1 . 2]" 1 517 3 30 PHE QD 3 31 PHE HA 3.150 . 4.500 2.290 2.093 2.725 . 0 0 "[ . 1 . 2]" 1 518 3 40 ARG QB 3 51 VAL HA 3.150 . 4.500 4.471 4.133 4.651 0.151 1 0 "[ . 1 . 2]" 1 519 3 64 PRO HA 3 64 PRO QG 3.150 . 4.500 2.890 2.824 3.432 . 0 0 "[ . 1 . 2]" 1 520 3 48 PHE HA 3 51 VAL MG1 3.150 . 4.500 2.179 1.796 3.704 0.004 2 0 "[ . 1 . 2]" 1 521 3 31 PHE HA 3 31 PHE HZ 3.150 . 3.576 3.192 2.958 3.453 . 0 0 "[ . 1 . 2]" 1 522 3 35 ASN HB3 3 55 LEU MD2 3.150 . 4.500 1.991 1.750 2.118 0.050 18 0 "[ . 1 . 2]" 1 523 3 70 TYR HB2 3 70 TYR QE 3.150 . 4.500 4.414 4.401 4.425 . 0 0 "[ . 1 . 2]" 1 524 3 70 TYR HB3 3 70 TYR QE 4.150 . 4.320 4.421 4.408 4.437 0.117 6 0 "[ . 1 . 2]" 1 525 3 40 ARG QB 3 51 VAL MG2 3.150 . 4.500 2.275 2.025 2.488 . 0 0 "[ . 1 . 2]" 1 526 3 40 ARG QG 3 44 PRO HB3 3.150 . 4.500 3.965 2.767 4.530 0.030 5 0 "[ . 1 . 2]" 1 527 3 54 LYS QG 3 58 LYS QB 3.150 . 4.500 3.119 2.749 3.302 . 0 0 "[ . 1 . 2]" 1 528 3 31 PHE HB3 3 31 PHE HZ 4.150 . 4.391 4.633 4.493 4.679 0.288 7 0 "[ . 1 . 2]" 1 529 3 77 ASP HA 3 79 LYS QB 3.150 . 4.500 1.915 1.825 2.052 . 0 0 "[ . 1 . 2]" 1 530 3 76 ALA HA 3 78 LYS HB2 3.150 . 4.500 3.425 3.112 3.859 . 0 0 "[ . 1 . 2]" 1 531 3 36 ARG QB 3 39 VAL HA 4.150 . 6.500 4.873 4.709 5.062 . 0 0 "[ . 1 . 2]" 1 532 3 35 ASN HB2 3 55 LEU MD1 3.150 . 4.500 2.767 2.286 3.497 . 0 0 "[ . 1 . 2]" 1 533 3 34 GLU QB 3 55 LEU MD2 3.150 . 4.500 1.794 1.679 2.032 0.121 18 0 "[ . 1 . 2]" 1 534 3 66 GLU QB 3 67 LYS HA 3.150 . 4.500 3.906 3.858 3.939 . 0 0 "[ . 1 . 2]" 1 535 3 40 ARG QG 3 55 LEU MD1 3.150 . 4.500 2.601 2.230 2.769 . 0 0 "[ . 1 . 2]" 1 536 3 27 ALA MB 3 67 LYS HG2 4.150 . 6.500 4.836 4.629 5.179 . 0 0 "[ . 1 . 2]" 1 537 3 63 THR MG 3 65 GLU HG3 3.150 . 4.500 3.728 3.449 4.116 . 0 0 "[ . 1 . 2]" 1 538 3 40 ARG HA 3 44 PRO HB2 4.150 . 6.500 6.465 6.050 6.640 0.140 10 0 "[ . 1 . 2]" 1 539 3 59 TRP HA 3 62 LEU HG 4.150 . 6.500 3.741 2.566 3.954 . 0 0 "[ . 1 . 2]" 1 540 3 43 ASN HB3 3 44 PRO HB2 4.150 . 6.500 6.655 6.578 6.787 0.287 16 0 "[ . 1 . 2]" 1 541 3 27 ALA MB 3 28 TYR HA 4.150 . 6.500 3.902 3.854 3.950 . 0 0 "[ . 1 . 2]" 1 542 3 59 TRP HB2 3 62 LEU HG 4.150 . 6.500 6.025 4.852 6.226 . 0 0 "[ . 1 . 2]" 1 543 3 37 ASP HA 3 38 ILE HB 4.150 . 6.500 5.680 5.634 5.719 . 0 0 "[ . 1 . 2]" 1 544 3 25 LEU MD1 3 30 PHE HA 4.650 . 7.500 6.160 5.978 6.305 . 0 0 "[ . 1 . 2]" 1 545 3 52 GLY HA2 3 55 LEU HB2 4.650 . 7.500 2.514 2.322 2.780 . 0 0 "[ . 1 . 2]" 1 546 3 39 VAL QG 3 55 LEU MD2 3.150 . 3.703 2.508 1.770 3.213 0.030 13 0 "[ . 1 . 2]" 1 547 3 39 VAL QG 3 55 LEU MD1 3.150 . 3.814 2.877 1.959 3.554 . 0 0 "[ . 1 . 2]" 1 548 3 43 ASN HB2 3 44 PRO QG 4.150 . 6.500 5.704 5.623 5.754 . 0 0 "[ . 1 . 2]" 1 549 3 36 ARG QG 3 38 ILE HB 4.150 . 6.500 6.373 6.210 6.546 0.046 18 0 "[ . 1 . 2]" 1 550 3 25 LEU MD2 3 74 ALA MB 4.650 . 7.500 5.601 5.414 5.941 . 0 0 "[ . 1 . 2]" 1 551 3 73 LYS HB3 3 74 ALA MB 4.650 . 7.500 4.369 4.317 4.484 . 0 0 "[ . 1 . 2]" 1 552 3 38 ILE MG 3 42 GLU HG3 4.150 . 6.500 2.876 2.642 3.292 . 0 0 "[ . 1 . 2]" 1 553 3 59 TRP HZ3 3 67 LYS HA 4.150 . 6.037 2.750 2.635 3.054 . 0 0 "[ . 1 . 2]" 1 554 3 37 ASP HB2 3 40 ARG QB 4.150 . 6.500 5.955 5.169 6.491 . 0 0 "[ . 1 . 2]" 1 555 3 27 ALA MB 3 67 LYS QD 4.150 . 6.500 4.067 3.684 4.782 . 0 0 "[ . 1 . 2]" 1 556 3 62 LEU HG 3 63 THR HB 3.150 . 4.500 4.395 3.932 4.823 0.323 17 0 "[ . 1 . 2]" 1 557 3 63 THR HB 3 70 TYR QE 4.650 . 7.500 7.485 7.269 7.533 0.033 16 0 "[ . 1 . 2]" 1 558 3 40 ARG QB 3 46 ILE MG 4.150 . 6.500 6.194 4.672 6.668 0.168 12 0 "[ . 1 . 2]" 1 559 3 28 TYR HB3 3 31 PHE QD 4.150 . 6.500 5.462 5.277 5.707 . 0 0 "[ . 1 . 2]" 1 560 3 38 ILE HG12 3 41 SER QB 4.150 . 6.500 5.607 5.346 5.836 . 0 0 "[ . 1 . 2]" 1 561 3 69 PRO HG2 3 70 TYR HB2 4.150 . 6.500 6.295 4.937 6.583 0.083 8 0 "[ . 1 . 2]" 1 562 3 67 LYS HA 3 70 TYR QD 4.150 . 6.500 1.839 1.787 1.972 0.013 16 0 "[ . 1 . 2]" 1 563 3 67 LYS HA 3 70 TYR QE . . 3.553 1.902 1.825 1.984 . 0 0 "[ . 1 . 2]" 1 564 3 48 PHE HB2 3 48 PHE QE 3.150 . 4.500 4.501 4.489 4.507 0.007 12 0 "[ . 1 . 2]" 1 565 3 28 TYR QD 3 32 ALA HA 3.150 . 4.500 4.001 3.708 4.243 . 0 0 "[ . 1 . 2]" 1 566 3 28 TYR QD 3 29 MET HA 3.150 . 4.500 3.039 2.648 3.339 . 0 0 "[ . 1 . 2]" 1 567 3 26 SER HB3 3 28 TYR QD 3.150 . 4.500 4.647 4.477 4.779 0.279 10 0 "[ . 1 . 2]" 1 568 3 28 TYR QE 3 55 LEU HB3 4.150 . 6.500 3.896 3.629 4.298 . 0 0 "[ . 1 . 2]" 1 569 3 28 TYR QE 3 32 ALA MB 3.150 . 4.500 2.627 2.415 2.844 . 0 0 "[ . 1 . 2]" 1 570 3 28 TYR QE 3 59 TRP HB2 4.150 . 6.500 3.974 3.784 4.188 . 0 0 "[ . 1 . 2]" 1 571 3 28 TYR QE 3 56 GLY HA2 3.150 . 4.500 2.050 1.856 2.524 . 0 0 "[ . 1 . 2]" 1 572 3 28 TYR QE 3 56 GLY HA3 3.150 . 4.500 2.602 2.001 3.123 . 0 0 "[ . 1 . 2]" 1 573 3 28 TYR QE 3 59 TRP HD1 4.150 . 6.500 3.716 3.292 4.389 . 0 0 "[ . 1 . 2]" 1 574 3 59 TRP QB 3 59 TRP HD1 3.150 . 4.500 2.500 2.497 2.504 . 0 0 "[ . 1 . 2]" 1 575 3 56 GLY HA2 3 59 TRP HD1 3.150 . 4.500 3.551 3.307 3.783 . 0 0 "[ . 1 . 2]" 1 576 3 56 GLY HA3 3 59 TRP HD1 3.150 . 4.500 4.060 3.725 4.288 . 0 0 "[ . 1 . 2]" 1 577 3 59 TRP HD1 3 60 LYS QG 4.150 . 6.500 2.408 2.138 2.623 . 0 0 "[ . 1 . 2]" 1 578 3 21 PRO HB3 3 81 TYR QE 3.150 . 4.459 3.319 3.195 3.450 . 0 0 "[ . 1 . 2]" 1 579 3 88 TYR QE 3 92 LEU QB 4.150 . 4.154 3.914 3.748 4.306 0.152 17 0 "[ . 1 . 2]" 1 580 3 21 PRO HA 3 88 TYR QE 3.150 . 4.500 4.632 4.495 4.741 0.241 9 0 "[ . 1 . 2]" 1 581 3 88 TYR QE 3 92 LEU QD 3.150 . 4.500 2.588 2.330 3.816 . 0 0 "[ . 1 . 2]" 1 582 3 19 ASN QB 3 88 TYR QE 3.150 . 4.500 3.270 3.096 3.471 . 0 0 "[ . 1 . 2]" 1 583 3 20 ALA MB 3 88 TYR QE 4.150 . 6.500 3.719 3.626 3.838 . 0 0 "[ . 1 . 2]" 1 584 3 67 LYS HG3 3 70 TYR QE 3.150 . 4.500 4.566 4.515 4.727 0.227 17 0 "[ . 1 . 2]" 1 585 3 31 PHE HZ 3 35 ASN HB3 4.150 . 6.500 4.076 3.796 4.224 . 0 0 "[ . 1 . 2]" 1 586 3 62 LEU HG 3 63 THR HA 3.150 . 4.500 3.856 3.812 3.881 . 0 0 "[ . 1 . 2]" 1 587 3 71 GLU HB3 3 74 ALA MB 3.150 . 4.500 4.470 4.383 4.526 0.026 8 0 "[ . 1 . 2]" 1 588 3 27 ALA MB 3 71 GLU HB3 3.150 . 4.500 3.943 3.588 4.226 . 0 0 "[ . 1 . 2]" 1 589 3 55 LEU HB3 3 58 LYS QB 4.150 . 6.500 5.331 4.939 5.899 . 0 0 "[ . 1 . 2]" 1 590 3 81 TYR QD 3 84 GLU QG 3.150 . 4.500 3.222 2.847 3.795 . 0 0 "[ . 1 . 2]" 1 591 3 21 PRO QG 3 81 TYR QE 3.150 . 4.500 2.971 1.849 3.297 . 0 0 "[ . 1 . 2]" 1 592 3 21 PRO HD2 3 81 TYR QE 4.150 . 6.500 3.573 3.340 3.700 . 0 0 "[ . 1 . 2]" 1 593 3 23 ARG HA 3 81 TYR HA 4.150 . 6.500 6.354 5.405 6.597 0.097 4 0 "[ . 1 . 2]" 1 594 3 23 ARG HA 3 23 ARG QD 4.150 . 6.500 4.501 4.198 4.685 . 0 0 "[ . 1 . 2]" 1 595 3 25 LEU HG 3 26 SER HA 4.150 . 6.500 5.848 5.664 6.081 . 0 0 "[ . 1 . 2]" 1 596 3 23 ARG HG3 3 26 SER HB2 4.150 . 6.500 5.118 4.259 5.435 . 0 0 "[ . 1 . 2]" 1 597 3 25 LEU HB3 3 25 LEU HG . . 2.890 2.655 2.564 2.912 0.022 8 0 "[ . 1 . 2]" 1 598 3 24 ALA MB 3 80 ARG HD3 4.150 . 6.500 2.577 2.113 4.347 . 0 0 "[ . 1 . 2]" 1 599 3 23 ARG HG3 3 24 ALA MB 4.150 . 6.500 4.548 3.849 5.131 . 0 0 "[ . 1 . 2]" 1 600 3 23 ARG QD 3 24 ALA MB 4.150 . 6.500 3.058 2.166 3.515 . 0 0 "[ . 1 . 2]" 1 601 3 24 ALA MB 3 25 LEU MD2 4.150 . 6.500 5.406 5.221 5.542 . 0 0 "[ . 1 . 2]" 1 602 3 24 ALA MB 3 77 ASP HA 4.150 . 5.520 4.085 3.242 5.555 0.035 8 0 "[ . 1 . 2]" 1 603 3 24 ALA MB 3 77 ASP HA 4.150 . 6.500 4.036 3.227 5.496 . 0 0 "[ . 1 . 2]" 1 604 3 24 ALA MB 3 80 ARG HG3 4.150 . 6.500 4.617 3.842 5.997 . 0 0 "[ . 1 . 2]" 1 605 3 23 ARG QB 3 24 ALA MB 4.150 . 6.500 2.521 2.044 2.947 . 0 0 "[ . 1 . 2]" 1 606 3 24 ALA MB 3 78 LYS HB2 3.150 . 4.500 3.303 2.879 3.574 . 0 0 "[ . 1 . 2]" 1 607 3 24 ALA MB 3 78 LYS HB3 3.150 . 4.500 4.082 3.744 4.470 . 0 0 "[ . 1 . 2]" 1 608 3 24 ALA HA 3 25 LEU MD2 4.150 . 6.500 6.093 5.876 6.231 . 0 0 "[ . 1 . 2]" 1 609 3 24 ALA MB 3 77 ASP QB 3.150 . 4.500 3.131 2.170 4.002 . 0 0 "[ . 1 . 2]" 1 610 3 24 ALA MB 3 81 TYR QD 4.150 . 6.500 3.075 2.732 4.401 . 0 0 "[ . 1 . 2]" 1 611 3 24 ALA MB 3 81 TYR QE 4.150 . 6.500 4.120 3.675 4.961 . 0 0 "[ . 1 . 2]" 1 612 3 25 LEU HB3 3 26 SER HB3 4.150 . 6.500 4.878 4.596 5.608 . 0 0 "[ . 1 . 2]" 1 613 3 25 LEU HB2 3 26 SER HB3 4.150 . 6.500 6.421 6.170 6.623 0.123 8 0 "[ . 1 . 2]" 1 614 3 37 ASP HA 3 39 VAL QG 4.150 . 6.500 5.451 4.211 5.627 . 0 0 "[ . 1 . 2]" 1 615 3 39 VAL HA 3 41 SER HA 4.150 . 6.500 5.299 5.204 5.408 . 0 0 "[ . 1 . 2]" 1 616 3 25 LEU MD2 3 29 MET HG3 3.150 . 4.500 2.663 2.535 2.882 . 0 0 "[ . 1 . 2]" 1 617 3 25 LEU MD1 3 29 MET HG3 3.150 . 4.500 4.204 4.065 4.498 . 0 0 "[ . 1 . 2]" 1 618 3 25 LEU MD1 3 29 MET HB2 3.150 . 4.500 4.306 4.195 4.441 . 0 0 "[ . 1 . 2]" 1 619 3 25 LEU MD2 3 29 MET HB2 3.150 . 4.500 1.857 1.746 2.011 0.054 12 0 "[ . 1 . 2]" 1 620 3 25 LEU HB2 3 25 LEU MD2 3.150 . 3.733 2.537 2.406 2.768 . 0 0 "[ . 1 . 2]" 1 621 3 25 LEU HB2 3 29 MET HA 3.150 . 4.500 3.385 3.180 3.687 . 0 0 "[ . 1 . 2]" 1 622 3 25 LEU HB2 3 29 MET HB2 4.150 . 6.500 4.256 3.671 5.130 . 0 0 "[ . 1 . 2]" 1 623 3 28 TYR HB2 3 28 TYR QE 4.150 . 6.500 4.359 4.337 4.376 . 0 0 "[ . 1 . 2]" 1 624 3 28 TYR HB2 3 28 TYR QD 3.150 . 4.456 2.300 2.281 2.328 . 0 0 "[ . 1 . 2]" 1 625 3 28 TYR HB3 3 29 MET HA 3.150 . 4.500 3.585 3.374 3.645 . 0 0 "[ . 1 . 2]" 1 626 3 25 LEU QD 3 29 MET HG2 3.150 . 4.500 3.429 3.114 3.637 . 0 0 "[ . 1 . 2]" 1 627 3 29 MET HA 3 29 MET HG2 3.150 . 4.500 3.391 3.185 3.696 . 0 0 "[ . 1 . 2]" 1 628 3 25 LEU HB3 3 29 MET HG3 4.150 . 6.500 3.347 2.736 5.409 . 0 0 "[ . 1 . 2]" 1 629 3 25 LEU HB2 3 29 MET HG3 4.150 . 6.500 4.673 4.197 6.020 . 0 0 "[ . 1 . 2]" 1 630 3 77 ASP QB 3 78 LYS HA 4.150 . 6.500 4.188 3.871 4.494 . 0 0 "[ . 1 . 2]" 1 631 3 77 ASP QB 3 78 LYS HB3 4.150 . 6.500 5.645 5.362 6.011 . 0 0 "[ . 1 . 2]" 1 632 3 76 ALA MB 3 78 LYS HB2 3.150 . 4.500 3.967 3.870 4.130 . 0 0 "[ . 1 . 2]" 1 633 3 81 TYR QE 3 85 LYS HB3 4.150 . 6.500 3.384 3.187 3.792 . 0 0 "[ . 1 . 2]" 1 634 3 21 PRO HB3 3 85 LYS HB3 4.150 . 6.500 2.984 2.338 3.528 . 0 0 "[ . 1 . 2]" 1 635 3 81 TYR QD 3 85 LYS HB3 4.150 . 6.500 3.985 3.734 4.325 . 0 0 "[ . 1 . 2]" 1 636 3 21 PRO HG3 3 85 LYS HB3 4.150 . 6.500 3.685 3.252 4.126 . 0 0 "[ . 1 . 2]" 1 637 3 82 GLU HB2 3 85 LYS HB3 4.150 . 6.500 4.612 4.203 5.188 . 0 0 "[ . 1 . 2]" 1 638 3 81 TYR QE 3 85 LYS HB2 4.150 . 6.500 3.952 3.519 4.654 . 0 0 "[ . 1 . 2]" 1 639 3 87 LEU QD 3 91 THR MG 4.150 . 6.500 2.817 2.501 3.726 . 0 0 "[ . 1 . 2]" 1 640 3 20 ALA HA 3 22 LYS QG 3.150 . 4.500 4.274 3.894 4.631 0.131 17 0 "[ . 1 . 2]" 1 641 3 81 TYR QE 3 85 LYS QG 4.150 . 6.500 4.098 3.734 4.859 . 0 0 "[ . 1 . 2]" 1 642 3 24 ALA MB 3 81 TYR QE 3.150 . 3.698 3.620 3.465 3.738 0.040 19 0 "[ . 1 . 2]" 1 643 3 81 TYR QD 3 85 LYS QG 4.150 . 6.500 4.653 4.106 5.520 . 0 0 "[ . 1 . 2]" 1 644 3 21 PRO HB3 3 85 LYS QG 4.150 . 6.500 2.702 2.434 2.991 . 0 0 "[ . 1 . 2]" 1 645 3 20 ALA MB 3 21 PRO HB3 3.150 . 4.500 4.378 4.006 4.652 0.152 5 0 "[ . 1 . 2]" 1 646 3 21 PRO QB 3 85 LYS HA 4.150 . 6.500 2.611 2.061 3.319 . 0 0 "[ . 1 . 2]" 1 647 3 85 LYS HA 3 88 TYR QD 3.150 . 4.500 3.604 3.486 3.889 . 0 0 "[ . 1 . 2]" 1 648 3 67 LYS QE 3 67 LYS HG3 3.150 . 4.500 2.533 2.281 2.844 . 0 0 "[ . 1 . 2]" 1 649 3 85 LYS HA 3 85 LYS QD 3.150 . 4.500 4.200 3.677 4.465 . 0 0 "[ . 1 . 2]" 1 650 3 82 GLU QB 3 85 LYS QE 3.150 . 4.500 3.486 2.551 4.309 . 0 0 "[ . 1 . 2]" 1 651 3 48 PHE QD 3 52 GLY HA3 2.150 . 2.500 2.556 2.406 2.638 0.138 20 0 "[ . 1 . 2]" 1 652 3 16 LYS HA 3 17 ASP HB2 4.150 . 6.500 4.744 4.378 5.796 . 0 0 "[ . 1 . 2]" 1 653 3 17 ASP HB3 3 88 TYR QE 4.150 . 6.500 2.308 1.869 3.596 . 0 0 "[ . 1 . 2]" 1 654 3 17 ASP HB2 3 18 PRO QD 3.150 . 4.500 3.726 3.025 4.189 . 0 0 "[ . 1 . 2]" 1 655 3 17 ASP HB2 3 20 ALA MB 3.150 . 4.500 2.127 1.804 2.764 . 0 0 "[ . 1 . 2]" 1 656 3 17 ASP HB3 3 20 ALA MB 3.150 . 4.500 2.555 1.813 3.897 . 0 0 "[ . 1 . 2]" 1 657 3 17 ASP HB3 3 18 PRO QD 3.150 . 4.500 2.735 1.878 3.465 . 0 0 "[ . 1 . 2]" 1 658 3 17 ASP HA 3 20 ALA MB 4.150 . 6.500 4.181 3.932 4.505 . 0 0 "[ . 1 . 2]" 1 659 3 24 ALA MB 3 81 TYR HA 4.150 . 6.500 4.696 4.384 5.331 . 0 0 "[ . 1 . 2]" 1 660 3 21 PRO HA 3 85 LYS QG 4.150 . 6.500 4.176 3.922 4.392 . 0 0 "[ . 1 . 2]" 1 661 3 82 GLU QB 3 85 LYS QG 3.150 . 4.500 3.921 3.614 4.551 0.051 2 0 "[ . 1 . 2]" 1 662 3 21 PRO HB3 3 85 LYS HB2 4.150 . 6.500 3.699 2.922 5.002 . 0 0 "[ . 1 . 2]" 1 663 3 21 PRO HB2 3 88 TYR HB3 3.150 . 4.500 4.099 3.936 4.407 . 0 0 "[ . 1 . 2]" 1 664 3 21 PRO HB2 3 88 TYR HB2 4.150 . 6.500 4.092 3.810 4.357 . 0 0 "[ . 1 . 2]" 1 665 3 20 ALA MB 3 88 TYR HB2 4.150 . 6.500 4.335 4.184 4.669 . 0 0 "[ . 1 . 2]" 1 666 3 85 LYS QG 3 88 TYR HB3 4.150 . 6.500 4.293 3.785 4.582 . 0 0 "[ . 1 . 2]" 1 667 3 85 LYS QG 3 88 TYR HB3 3.150 . 4.500 4.094 3.692 4.242 . 0 0 "[ . 1 . 2]" 1 668 3 21 PRO HD3 3 85 LYS HA 4.150 . 6.500 3.911 3.453 4.284 . 0 0 "[ . 1 . 2]" 1 669 3 85 LYS HB3 3 88 TYR HB3 4.150 . 6.500 4.517 4.149 4.816 . 0 0 "[ . 1 . 2]" 1 670 3 21 PRO HG3 3 85 LYS QG 4.150 . 6.500 4.253 4.092 4.387 . 0 0 "[ . 1 . 2]" 1 671 3 82 GLU HG3 3 85 LYS HB3 3.150 . 4.500 3.391 2.527 4.459 . 0 0 "[ . 1 . 2]" 1 672 3 16 LYS QB 3 18 PRO QD 4.150 . 6.500 5.856 5.107 6.338 . 0 0 "[ . 1 . 2]" 1 673 3 16 LYS QB 3 16 LYS QE 3.150 . 4.500 3.047 1.854 3.639 . 0 0 "[ . 1 . 2]" 1 674 3 84 GLU HA 3 87 LEU HB2 3.150 . 4.500 4.540 4.440 4.607 0.107 5 0 "[ . 1 . 2]" 1 675 3 21 PRO HB3 3 84 GLU HA 3.150 . 4.500 4.526 4.304 4.609 0.109 2 0 "[ . 1 . 2]" 1 676 3 18 PRO QG 3 88 TYR HB2 4.150 . 6.500 5.344 5.206 5.498 . 0 0 "[ . 1 . 2]" 1 677 3 19 ASN HA 3 90 ALA HA 4.150 . 6.500 6.595 6.527 6.684 0.184 18 0 "[ . 1 . 2]" 1 678 3 41 SER HA 3 51 VAL MG2 4.150 . 6.500 4.720 4.408 5.511 . 0 0 "[ . 1 . 2]" 1 679 3 31 PHE QE 3 55 LEU HA 4.150 . 4.409 3.780 3.208 4.228 . 0 0 "[ . 1 . 2]" 1 680 3 49 GLY HA2 3 51 VAL MG2 4.150 . 6.500 6.820 6.654 6.914 0.414 1 0 "[ . 1 . 2]" 1 681 3 65 GLU HG3 3 68 GLN HG2 3.150 . 4.500 3.859 3.665 4.428 . 0 0 "[ . 1 . 2]" 1 682 3 63 THR HA 3 64 PRO QB 3.150 . 4.500 3.510 3.386 3.769 . 0 0 "[ . 1 . 2]" 1 683 3 31 PHE QE 3 55 LEU HG 4.150 . 6.500 4.401 3.827 5.018 . 0 0 "[ . 1 . 2]" 1 684 3 31 PHE QE 3 58 LYS QB 3.150 . 4.500 3.905 3.738 4.129 . 0 0 "[ . 1 . 2]" 1 685 3 30 PHE QB 3 73 LYS HD3 3.150 . 4.500 2.730 2.099 3.541 . 0 0 "[ . 1 . 2]" 1 686 3 30 PHE HA 3 73 LYS HD3 3.150 . 4.500 3.825 2.962 4.484 . 0 0 "[ . 1 . 2]" 1 687 3 30 PHE HA 3 73 LYS HD2 3.150 . 4.500 3.754 3.015 4.507 0.007 10 0 "[ . 1 . 2]" 1 688 3 30 PHE HA 3 73 LYS HG2 4.150 . 6.500 4.490 4.233 4.558 . 0 0 "[ . 1 . 2]" 1 689 3 25 LEU HB3 3 77 ASP QB 4.150 . 6.500 3.830 3.568 4.349 . 0 0 "[ . 1 . 2]" 1 690 3 23 ARG QD 3 24 ALA HA 3.150 . 4.500 3.881 3.738 4.207 . 0 0 "[ . 1 . 2]" 1 691 3 25 LEU HB3 3 29 MET HG2 4.150 . 6.500 3.525 2.940 4.531 . 0 0 "[ . 1 . 2]" 1 692 3 36 ARG QD 3 39 VAL QG 4.150 . 6.500 5.031 4.275 5.331 . 0 0 "[ . 1 . 2]" 1 693 3 36 ARG QD 3 55 LEU MD1 4.150 . 6.500 4.693 2.107 5.217 . 0 0 "[ . 1 . 2]" 1 694 3 46 ILE HB 3 47 THR H 4.150 . 6.500 3.247 2.734 4.073 . 0 0 "[ . 1 . 2]" 1 695 3 86 GLU H 3 86 GLU HG3 4.150 . 6.500 3.436 2.938 3.579 . 0 0 "[ . 1 . 2]" 1 696 3 80 ARG HG3 3 81 TYR H 4.150 . 6.500 2.758 1.841 4.546 . 0 0 "[ . 1 . 2]" 1 697 3 41 SER H 3 42 GLU HG2 4.150 . 6.500 5.100 4.426 5.788 . 0 0 "[ . 1 . 2]" 1 698 3 42 GLU H 3 42 GLU HG3 4.150 . 6.500 2.756 2.408 3.056 . 0 0 "[ . 1 . 2]" 1 699 3 19 ASN HA 3 19 ASN HD21 4.150 . 6.500 3.211 2.778 3.682 . 0 0 "[ . 1 . 2]" 1 700 3 72 ALA HA 3 73 LYS H 4.150 . 6.500 3.527 3.516 3.540 . 0 0 "[ . 1 . 2]" 1 701 3 54 LYS H 3 54 LYS QD 4.150 . 6.500 4.343 4.111 4.545 . 0 0 "[ . 1 . 2]" 1 702 3 37 ASP H 3 37 ASP HB2 4.150 . 6.500 2.855 2.263 3.602 . 0 0 "[ . 1 . 2]" 1 703 3 68 GLN H 3 68 GLN HG2 4.150 . 6.500 2.648 2.524 3.064 . 0 0 "[ . 1 . 2]" 1 704 3 52 GLY H 3 54 LYS H 4.150 . 6.500 3.930 3.616 4.328 . 0 0 "[ . 1 . 2]" 1 705 3 68 GLN HG2 3 72 ALA H 4.150 . 6.500 5.454 5.391 5.681 . 0 0 "[ . 1 . 2]" 1 706 3 35 ASN HD22 3 58 LYS QB 4.150 . 6.500 6.378 5.916 6.554 0.054 16 0 "[ . 1 . 2]" 1 707 3 74 ALA HA 3 78 LYS H 4.150 . 6.500 4.133 3.835 4.281 . 0 0 "[ . 1 . 2]" 1 708 3 82 GLU HA 3 83 SER H 4.150 . 6.500 3.454 3.401 3.504 . 0 0 "[ . 1 . 2]" 1 709 3 59 TRP HZ2 3 71 GLU H 4.150 . 6.500 4.696 4.450 5.031 . 0 0 "[ . 1 . 2]" 1 710 3 50 GLN H 3 50 GLN HG3 4.150 . 6.500 3.555 3.281 4.081 . 0 0 "[ . 1 . 2]" 1 711 3 29 MET H 3 33 ASN H 4.150 . 6.500 5.554 5.347 5.660 . 0 0 "[ . 1 . 2]" 1 712 3 36 ARG QD 3 37 ASP H 4.150 . 6.500 3.654 2.959 4.847 . 0 0 "[ . 1 . 2]" 1 713 3 54 LYS H 3 54 LYS QG 4.150 . 6.500 3.612 2.411 4.011 . 0 0 "[ . 1 . 2]" 1 714 3 46 ILE MG 3 47 THR H 4.150 . 6.500 3.440 1.813 4.340 . 0 0 "[ . 1 . 2]" 1 715 3 66 GLU QB 3 67 LYS H 4.150 . 6.500 2.945 2.763 3.024 . 0 0 "[ . 1 . 2]" 1 716 3 67 LYS H 3 67 LYS HB2 4.150 . 6.500 2.696 2.633 2.935 . 0 0 "[ . 1 . 2]" 1 717 3 37 ASP H 3 38 ILE HB 4.150 . 6.500 4.529 4.393 4.655 . 0 0 "[ . 1 . 2]" 1 718 3 71 GLU H 3 71 GLU HB3 4.150 . 6.500 2.931 2.757 3.064 . 0 0 "[ . 1 . 2]" 1 719 3 69 PRO HB3 3 70 TYR H 4.150 . 6.500 3.676 3.560 3.815 . 0 0 "[ . 1 . 2]" 1 720 3 55 LEU HA 3 56 GLY H 4.150 . 6.500 3.547 3.512 3.565 . 0 0 "[ . 1 . 2]" 1 721 3 28 TYR HA 3 31 PHE H 4.150 . 6.500 3.772 3.713 3.858 . 0 0 "[ . 1 . 2]" 1 722 3 29 MET HA 3 33 ASN H 4.150 . 6.500 3.929 3.462 4.092 . 0 0 "[ . 1 . 2]" 1 723 3 78 LYS H 3 78 LYS QG 4.150 . 6.500 3.590 2.973 3.817 . 0 0 "[ . 1 . 2]" 1 724 3 75 GLN H 3 76 ALA H 4.150 . 6.500 2.515 2.381 2.586 . 0 0 "[ . 1 . 2]" 1 725 3 46 ILE HG12 3 47 THR H 4.150 . 6.500 4.332 2.187 5.307 . 0 0 "[ . 1 . 2]" 1 726 3 57 GLU HB2 3 58 LYS H 4.150 . 6.500 3.454 3.182 3.781 . 0 0 "[ . 1 . 2]" 1 727 3 39 VAL H 3 39 VAL HB 4.150 . 6.500 2.532 2.444 2.680 . 0 0 "[ . 1 . 2]" 1 728 3 71 GLU H 3 71 GLU HB2 4.150 . 6.500 2.214 2.140 2.310 . 0 0 "[ . 1 . 2]" 1 729 3 27 ALA MB 3 28 TYR H 4.150 . 6.500 2.945 2.824 3.013 . 0 0 "[ . 1 . 2]" 1 730 3 65 GLU HB2 3 66 GLU H 4.150 . 6.500 3.211 3.011 3.836 . 0 0 "[ . 1 . 2]" 1 731 3 78 LYS H 3 78 LYS HB3 4.150 . 6.500 3.112 2.912 3.526 . 0 0 "[ . 1 . 2]" 1 732 3 41 SER H 3 42 GLU HG3 4.150 . 6.500 4.388 3.991 4.707 . 0 0 "[ . 1 . 2]" 1 733 3 53 LYS QB 3 54 LYS H 4.150 . 6.500 2.580 2.341 2.908 . 0 0 "[ . 1 . 2]" 1 734 3 87 LEU H 3 88 TYR H 4.150 . 6.500 2.305 2.191 2.477 . 0 0 "[ . 1 . 2]" 1 735 3 38 ILE HB 3 39 VAL H 4.150 . 6.500 2.261 2.188 2.326 . 0 0 "[ . 1 . 2]" 1 736 3 76 ALA H 3 79 LYS H 4.150 . 6.500 4.930 4.756 5.073 . 0 0 "[ . 1 . 2]" 1 737 3 78 LYS H 3 80 ARG H 4.150 . 6.500 3.897 3.755 4.023 . 0 0 "[ . 1 . 2]" 1 738 3 46 ILE HG13 3 51 VAL H 4.150 . 6.500 3.971 2.662 5.630 . 0 0 "[ . 1 . 2]" 1 739 3 16 LYS QB 3 17 ASP H 4.150 . 6.500 3.645 2.148 4.064 . 0 0 "[ . 1 . 2]" 1 740 3 46 ILE HG12 3 51 VAL H 4.150 . 6.500 4.676 3.890 5.561 . 0 0 "[ . 1 . 2]" 1 741 3 58 LYS QB 3 60 LYS H 4.150 . 6.500 5.114 4.948 5.234 . 0 0 "[ . 1 . 2]" 1 742 3 52 GLY H 3 55 LEU H 4.150 . 6.500 4.393 4.188 4.613 . 0 0 "[ . 1 . 2]" 1 743 3 35 ASN HD21 3 58 LYS QB 4.150 . 6.500 6.599 6.547 6.641 0.141 18 0 "[ . 1 . 2]" 1 744 3 39 VAL HB 3 41 SER H 4.150 . 6.500 4.584 4.459 5.428 . 0 0 "[ . 1 . 2]" 1 745 3 82 GLU HG3 3 83 SER H 4.150 . 6.500 5.252 4.987 5.430 . 0 0 "[ . 1 . 2]" 1 746 3 39 VAL QG 3 54 LYS H 4.150 . 6.500 5.259 4.835 5.750 . 0 0 "[ . 1 . 2]" 1 747 3 71 GLU QG 3 72 ALA H 4.150 . 6.500 4.045 3.845 4.319 . 0 0 "[ . 1 . 2]" 1 748 3 63 THR H 3 65 GLU H 4.150 . 6.500 5.289 4.733 5.551 . 0 0 "[ . 1 . 2]" 1 749 3 82 GLU H 3 83 SER HA 4.150 . 6.500 5.340 5.232 5.466 . 0 0 "[ . 1 . 2]" 1 750 3 79 LYS HA 3 80 ARG H 4.150 . 6.500 3.532 3.520 3.544 . 0 0 "[ . 1 . 2]" 1 751 3 19 ASN HD21 3 88 TYR H 4.150 . 6.500 6.452 5.966 6.579 0.079 18 0 "[ . 1 . 2]" 1 752 3 72 ALA MB 3 74 ALA H 4.150 . 6.500 4.047 4.016 4.084 . 0 0 "[ . 1 . 2]" 1 753 3 83 SER H 3 83 SER HB3 4.150 . 6.500 3.018 2.128 3.621 . 0 0 "[ . 1 . 2]" 1 754 3 46 ILE HG13 3 47 THR H 4.150 . 6.500 3.724 1.801 4.980 . 0 0 "[ . 1 . 2]" 1 755 3 53 LYS HA 3 54 LYS H 4.150 . 6.500 3.527 3.461 3.562 . 0 0 "[ . 1 . 2]" 1 756 3 31 PHE QE 3 58 LYS H 4.150 . 6.500 5.424 5.192 5.677 . 0 0 "[ . 1 . 2]" 1 757 3 67 LYS H 3 67 LYS HB3 4.150 . 6.500 3.613 3.588 3.621 . 0 0 "[ . 1 . 2]" 1 758 3 36 ARG H 3 37 ASP H 4.150 . 6.500 3.337 2.481 3.584 . 0 0 "[ . 1 . 2]" 1 759 3 26 SER HB2 3 29 MET H 4.150 . 6.500 4.155 3.830 4.495 . 0 0 "[ . 1 . 2]" 1 760 3 54 LYS H 3 57 GLU H 4.150 . 6.500 4.960 4.676 5.091 . 0 0 "[ . 1 . 2]" 1 761 3 57 GLU HA 3 58 LYS H 4.150 . 6.500 3.558 3.535 3.567 . 0 0 "[ . 1 . 2]" 1 762 3 52 GLY HA3 3 54 LYS H 4.150 . 6.500 4.438 4.203 4.793 . 0 0 "[ . 1 . 2]" 1 763 3 49 GLY HA2 3 50 GLN H 4.150 . 6.500 3.416 2.820 3.563 . 0 0 "[ . 1 . 2]" 1 764 3 50 GLN H 3 52 GLY H 4.150 . 6.500 3.510 2.474 4.021 . 0 0 "[ . 1 . 2]" 1 765 3 57 GLU HB3 3 58 LYS H 4.150 . 6.500 3.313 2.164 3.928 . 0 0 "[ . 1 . 2]" 1 766 3 75 GLN H 3 78 LYS H 4.150 . 6.500 4.512 4.422 4.589 . 0 0 "[ . 1 . 2]" 1 767 3 83 SER HA 3 84 GLU H 4.150 . 6.500 3.541 3.497 3.562 . 0 0 "[ . 1 . 2]" 1 768 3 30 PHE HA 3 33 ASN H 4.150 . 6.500 3.582 3.438 3.970 . 0 0 "[ . 1 . 2]" 1 769 3 74 ALA HA 3 77 ASP H 4.150 . 6.500 3.276 3.166 3.332 . 0 0 "[ . 1 . 2]" 1 770 3 81 TYR QB 3 84 GLU H 4.150 . 6.500 4.548 4.433 4.713 . 0 0 "[ . 1 . 2]" 1 771 3 89 ASN HA 3 90 ALA H 4.150 . 6.500 3.498 3.484 3.541 . 0 0 "[ . 1 . 2]" 1 772 3 59 TRP HH2 3 71 GLU H 4.150 . 6.500 2.791 2.621 3.017 . 0 0 "[ . 1 . 2]" 1 773 3 65 GLU HA 3 68 GLN H 4.150 . 6.500 3.215 3.148 3.387 . 0 0 "[ . 1 . 2]" 1 774 3 70 TYR HB3 3 71 GLU H 4.150 . 6.500 3.753 3.694 3.825 . 0 0 "[ . 1 . 2]" 1 775 3 81 TYR H 3 81 TYR QD 4.150 . 6.500 3.154 2.933 3.331 . 0 0 "[ . 1 . 2]" 1 776 3 21 PRO HA 3 23 ARG H 4.150 . 6.500 5.643 5.180 6.113 . 0 0 "[ . 1 . 2]" 1 777 3 73 LYS HA 3 75 GLN H 4.150 . 6.500 4.501 4.413 4.630 . 0 0 "[ . 1 . 2]" 1 778 3 87 LEU HB2 3 88 TYR H 4.150 . 6.500 4.117 3.515 4.315 . 0 0 "[ . 1 . 2]" 1 779 3 87 LEU H 3 87 LEU HB2 4.150 . 6.500 3.223 3.138 3.594 . 0 0 "[ . 1 . 2]" 1 780 3 33 ASN H 3 35 ASN H 4.150 . 6.500 3.984 3.820 4.699 . 0 0 "[ . 1 . 2]" 1 781 3 37 ASP HA 3 41 SER H 4.150 . 6.500 4.032 3.812 4.190 . 0 0 "[ . 1 . 2]" 1 782 3 25 LEU HA 3 29 MET H 4.150 . 6.500 5.879 5.628 6.183 . 0 0 "[ . 1 . 2]" 1 783 3 18 PRO HB2 3 19 ASN HD21 4.150 . 6.500 2.734 2.095 4.390 . 0 0 "[ . 1 . 2]" 1 784 3 88 TYR HA 3 89 ASN H 4.150 . 6.500 3.531 3.512 3.565 . 0 0 "[ . 1 . 2]" 1 785 3 86 GLU H 3 86 GLU HG2 4.150 . 6.500 2.555 1.870 2.954 . 0 0 "[ . 1 . 2]" 1 786 3 13 ARG H 3 13 ARG QG 4.150 . 6.500 2.513 2.001 3.443 . 0 0 "[ . 1 . 2]" 1 787 3 87 LEU HB3 3 88 TYR H 4.150 . 6.500 3.046 2.835 3.943 . 0 0 "[ . 1 . 2]" 1 788 3 79 LYS H 3 79 LYS QG 4.150 . 6.500 3.228 2.186 4.030 . 0 0 "[ . 1 . 2]" 1 789 3 21 PRO HA 3 22 LYS H 4.150 . 6.500 3.559 3.533 3.569 . 0 0 "[ . 1 . 2]" 1 790 3 27 ALA MB 3 71 GLU H 4.150 . 6.500 3.012 2.704 3.392 . 0 0 "[ . 1 . 2]" 1 791 3 57 GLU H 3 59 TRP H 4.150 . 6.500 3.817 3.673 3.974 . 0 0 "[ . 1 . 2]" 1 792 3 71 GLU H 3 74 ALA MB 4.150 . 6.500 4.263 4.192 4.315 . 0 0 "[ . 1 . 2]" 1 793 3 69 PRO HA 3 72 ALA H 4.150 . 6.500 4.606 4.345 4.787 . 0 0 "[ . 1 . 2]" 1 794 3 87 LEU H 3 87 LEU HB3 4.150 . 6.500 2.199 2.141 2.813 . 0 0 "[ . 1 . 2]" 1 795 3 65 GLU HG3 3 68 GLN H 4.150 . 6.500 5.023 4.927 5.245 . 0 0 "[ . 1 . 2]" 1 796 3 80 ARG HE 3 81 TYR H 4.150 . 6.500 4.317 3.089 4.558 . 0 0 "[ . 1 . 2]" 1 797 3 18 PRO HA 3 19 ASN HD21 4.150 . 6.500 4.924 4.302 6.452 . 0 0 "[ . 1 . 2]" 1 798 3 34 GLU H 3 35 ASN H 4.150 . 6.500 2.655 2.487 2.891 . 0 0 "[ . 1 . 2]" 1 799 3 70 TYR HA 3 71 GLU H 4.150 . 6.500 3.574 3.568 3.577 . 0 0 "[ . 1 . 2]" 1 800 3 47 THR H 3 50 GLN H 4.150 . 6.500 3.524 2.001 4.983 . 0 0 "[ . 1 . 2]" 1 801 3 86 GLU QB 3 87 LEU H 4.150 . 6.500 3.454 3.340 3.497 . 0 0 "[ . 1 . 2]" 1 802 3 84 GLU HA 3 87 LEU H 4.150 . 6.500 3.596 3.486 3.653 . 0 0 "[ . 1 . 2]" 1 803 3 55 LEU H 3 57 GLU H 4.150 . 6.500 4.297 3.846 4.783 . 0 0 "[ . 1 . 2]" 1 804 3 57 GLU H 3 60 LYS H 4.150 . 6.500 5.148 5.004 5.232 . 0 0 "[ . 1 . 2]" 1 805 3 75 GLN HA 3 78 LYS H 4.150 . 6.500 3.175 3.069 3.369 . 0 0 "[ . 1 . 2]" 1 806 3 22 LYS QB 3 23 ARG H 4.150 . 6.500 3.880 3.819 3.905 . 0 0 "[ . 1 . 2]" 1 807 3 77 ASP H 3 78 LYS H 4.150 . 6.500 2.435 2.299 2.487 . 0 0 "[ . 1 . 2]" 1 808 3 55 LEU H 3 56 GLY H 4.150 . 6.500 2.746 2.461 3.103 . 0 0 "[ . 1 . 2]" 1 809 3 88 TYR H 3 88 TYR QD 4.150 . 6.500 4.174 4.123 4.208 . 0 0 "[ . 1 . 2]" 1 810 3 87 LEU HA 3 88 TYR H 4.150 . 6.500 3.506 3.428 3.533 . 0 0 "[ . 1 . 2]" 1 811 3 29 MET H 3 31 PHE H 4.150 . 6.500 3.954 3.844 4.166 . 0 0 "[ . 1 . 2]" 1 812 3 17 ASP HB2 3 20 ALA H 3.150 . 4.500 3.279 2.005 4.027 . 0 0 "[ . 1 . 2]" 1 813 3 20 ALA H 3 88 TYR HB2 3.150 . 4.500 4.506 4.407 4.597 0.097 8 0 "[ . 1 . 2]" 1 814 3 20 ALA H 3 88 TYR QD 3.150 . 4.500 2.244 2.120 2.439 . 0 0 "[ . 1 . 2]" 1 815 3 24 ALA H 3 24 ALA MB 3.150 . 4.500 2.320 2.029 2.558 . 0 0 "[ . 1 . 2]" 1 816 3 24 ALA H 3 25 LEU H 3.150 . 4.500 4.474 4.296 4.633 0.133 8 0 "[ . 1 . 2]" 1 817 3 23 ARG HA 3 24 ALA H 3.150 . 4.500 2.685 2.213 2.943 . 0 0 "[ . 1 . 2]" 1 818 3 23 ARG QB 3 24 ALA H 3.150 . 4.500 2.105 1.710 2.870 0.090 6 0 "[ . 1 . 2]" 1 819 3 23 ARG HG3 3 24 ALA H 3.150 . 4.500 3.092 2.245 4.131 . 0 0 "[ . 1 . 2]" 1 820 3 26 SER HA 3 27 ALA H 3.150 . 4.500 2.353 2.131 2.400 . 0 0 "[ . 1 . 2]" 1 821 3 27 ALA H 3 59 TRP HH2 4.150 . 6.500 6.111 5.761 6.512 0.012 15 0 "[ . 1 . 2]" 1 822 3 31 PHE HB2 3 32 ALA H 3.150 . 4.500 3.860 3.682 3.999 . 0 0 "[ . 1 . 2]" 1 823 3 31 PHE HB3 3 32 ALA H 3.150 . 4.500 2.487 2.295 2.688 . 0 0 "[ . 1 . 2]" 1 824 3 31 PHE QD 3 32 ALA H 3.150 . 4.500 2.413 1.834 2.643 . 0 0 "[ . 1 . 2]" 1 825 3 29 MET HA 3 32 ALA H 3.150 . 4.500 3.764 3.342 4.233 . 0 0 "[ . 1 . 2]" 1 826 3 61 ALA H 3 62 LEU MD2 4.150 . 6.500 5.235 4.338 5.457 . 0 0 "[ . 1 . 2]" 1 827 3 59 TRP HB3 3 61 ALA H 3.150 . 4.500 4.437 4.322 4.516 0.016 5 0 "[ . 1 . 2]" 1 828 3 72 ALA H 3 73 LYS HA 4.150 . 6.500 5.218 5.186 5.246 . 0 0 "[ . 1 . 2]" 1 829 3 72 ALA H 3 73 LYS HB3 4.150 . 6.500 5.534 5.365 5.684 . 0 0 "[ . 1 . 2]" 1 830 3 74 ALA H 3 76 ALA H 3.150 . 4.500 3.505 3.313 3.663 . 0 0 "[ . 1 . 2]" 1 831 3 73 LYS HA 3 74 ALA H 3.150 . 4.500 3.376 3.330 3.402 . 0 0 "[ . 1 . 2]" 1 832 3 73 LYS HB2 3 74 ALA H 3.150 . 4.500 3.615 3.528 3.722 . 0 0 "[ . 1 . 2]" 1 833 3 73 LYS HB3 3 74 ALA H 3.150 . 4.500 3.482 3.388 3.674 . 0 0 "[ . 1 . 2]" 1 834 3 74 ALA H 3 75 GLN QG 3.150 . 4.500 4.319 3.901 4.502 0.002 9 0 "[ . 1 . 2]" 1 835 3 74 ALA HA 3 76 ALA H 3.150 . 4.500 4.068 3.954 4.225 . 0 0 "[ . 1 . 2]" 1 836 3 76 ALA H 3 76 ALA MB 2.150 . 2.500 2.113 2.029 2.197 . 0 0 "[ . 1 . 2]" 1 837 3 90 ALA H 3 90 ALA MB 2.150 . 2.500 2.163 2.056 2.237 . 0 0 "[ . 1 . 2]" 1 838 3 89 ASN QB 3 90 ALA H 3.150 . 4.500 3.216 2.610 3.557 . 0 0 "[ . 1 . 2]" 1 839 3 90 ALA H 3 91 THR H 3.150 . 4.500 2.737 2.574 3.268 . 0 0 "[ . 1 . 2]" 1 840 3 88 TYR HB3 3 90 ALA H 3.150 . 4.500 4.685 4.546 4.734 0.234 13 0 "[ . 1 . 2]" 1 841 3 88 TYR H 3 90 ALA H 4.150 . 6.500 3.892 3.707 4.043 . 0 0 "[ . 1 . 2]" 1 842 3 92 LEU HA 3 93 ALA H 3.150 . 4.500 3.510 3.486 3.568 . 0 0 "[ . 1 . 2]" 1 843 3 92 LEU QD 3 93 ALA H 3.150 . 4.500 2.920 2.533 3.684 . 0 0 "[ . 1 . 2]" 1 844 3 37 ASP H 3 38 ILE MG 4.150 . 6.500 5.625 5.546 5.720 . 0 0 "[ . 1 . 2]" 1 845 3 45 ASP H 3 46 ILE HG13 4.150 . 6.500 4.626 3.785 5.751 . 0 0 "[ . 1 . 2]" 1 846 3 45 ASP H 3 46 ILE MG 3.150 . 4.500 4.302 3.385 4.716 0.216 8 0 "[ . 1 . 2]" 1 847 3 43 ASN HA 3 45 ASP H 3.150 . 4.500 3.144 3.011 3.394 . 0 0 "[ . 1 . 2]" 1 848 3 43 ASN HB3 3 45 ASP H 3.150 . 4.500 3.913 3.661 4.399 . 0 0 "[ . 1 . 2]" 1 849 3 44 PRO HB2 3 45 ASP H 3.150 . 4.500 3.223 2.802 3.579 . 0 0 "[ . 1 . 2]" 1 850 3 44 PRO HD2 3 45 ASP H 3.150 . 4.500 2.818 2.585 2.971 . 0 0 "[ . 1 . 2]" 1 851 3 44 PRO HD3 3 45 ASP H 3.150 . 4.500 3.891 3.840 3.963 . 0 0 "[ . 1 . 2]" 1 852 3 73 LYS HA 3 77 ASP H 4.150 . 6.500 4.025 3.794 4.200 . 0 0 "[ . 1 . 2]" 1 853 3 32 ALA H 3 34 GLU H 4.150 . 6.500 4.511 4.446 4.623 . 0 0 "[ . 1 . 2]" 1 854 3 30 PHE HA 3 34 GLU H 4.150 . 6.500 4.527 4.485 4.594 . 0 0 "[ . 1 . 2]" 1 855 3 34 GLU H 3 35 ASN HD21 4.150 . 6.500 4.108 3.327 4.406 . 0 0 "[ . 1 . 2]" 1 856 3 34 GLU H 3 35 ASN HD22 3.150 . 4.500 4.341 4.157 4.797 0.297 18 0 "[ . 1 . 2]" 1 857 3 42 GLU H 3 43 ASN HB2 3.150 . 4.500 4.648 4.585 4.718 0.218 20 0 "[ . 1 . 2]" 1 858 3 40 ARG H 3 42 GLU H 4.150 . 6.500 4.193 4.008 4.359 . 0 0 "[ . 1 . 2]" 1 859 3 57 GLU H 3 58 LYS H 3.150 . 4.500 2.851 2.773 2.979 . 0 0 "[ . 1 . 2]" 1 860 3 63 THR HB 3 65 GLU H 3.150 . 4.500 4.094 3.578 4.262 . 0 0 "[ . 1 . 2]" 1 861 3 62 LEU MD1 3 66 GLU H 4.150 . 6.500 5.282 5.174 5.510 . 0 0 "[ . 1 . 2]" 1 862 3 63 THR HA 3 66 GLU H 4.150 . 6.500 4.575 4.475 4.685 . 0 0 "[ . 1 . 2]" 1 863 3 71 GLU H 3 72 ALA MB 3.150 . 4.500 4.601 4.524 4.660 0.160 8 0 "[ . 1 . 2]" 1 864 3 84 GLU H 3 84 GLU HG2 3.150 . 4.500 3.318 1.860 4.582 0.082 20 0 "[ . 1 . 2]" 1 865 3 85 LYS HB3 3 86 GLU H 3.150 . 4.500 3.532 3.242 3.856 . 0 0 "[ . 1 . 2]" 1 866 3 30 PHE H 3 32 ALA H 4.150 . 6.500 4.234 3.976 4.595 . 0 0 "[ . 1 . 2]" 1 867 3 30 PHE H 3 30 PHE QB 3.150 . 4.500 2.732 2.663 2.758 . 0 0 "[ . 1 . 2]" 1 868 3 30 PHE H 3 31 PHE HB3 3.150 . 4.500 4.563 4.511 4.632 0.132 7 0 "[ . 1 . 2]" 1 869 3 28 TYR HB2 3 30 PHE H 4.150 . 6.500 6.103 5.945 6.253 . 0 0 "[ . 1 . 2]" 1 870 3 30 PHE H 3 30 PHE HZ 4.150 . 6.500 4.868 4.802 5.056 . 0 0 "[ . 1 . 2]" 1 871 3 31 PHE H 3 32 ALA H 3.150 . 4.500 2.733 2.642 2.937 . 0 0 "[ . 1 . 2]" 1 872 3 31 PHE H 3 32 ALA MB 3.150 . 4.500 4.310 4.269 4.398 . 0 0 "[ . 1 . 2]" 1 873 3 31 PHE H 3 31 PHE QD 3.150 . 4.500 3.981 3.914 4.033 . 0 0 "[ . 1 . 2]" 1 874 3 31 PHE H 3 59 TRP HZ3 4.150 . 6.500 4.888 4.657 5.066 . 0 0 "[ . 1 . 2]" 1 875 3 47 THR HA 3 48 PHE H 3.150 . 4.500 2.470 2.254 2.831 . 0 0 "[ . 1 . 2]" 1 876 3 47 THR HB 3 48 PHE H 3.150 . 4.500 2.957 1.871 3.879 . 0 0 "[ . 1 . 2]" 1 877 3 48 PHE HB2 3 49 GLY H 4.150 . 6.500 3.887 3.407 4.209 . 0 0 "[ . 1 . 2]" 1 878 3 48 PHE HB3 3 49 GLY H 3.150 . 4.500 2.588 2.093 3.007 . 0 0 "[ . 1 . 2]" 1 879 3 48 PHE H 3 49 GLY H 3.150 . 4.500 3.081 2.665 3.625 . 0 0 "[ . 1 . 2]" 1 880 3 48 PHE QD 3 49 GLY H 3.150 . 4.500 3.566 2.723 4.134 . 0 0 "[ . 1 . 2]" 1 881 3 47 THR HB 3 49 GLY H 3.150 . 4.500 3.406 2.420 4.536 0.036 2 0 "[ . 1 . 2]" 1 882 3 47 THR MG 3 49 GLY H 4.150 . 6.500 3.462 1.837 4.517 . 0 0 "[ . 1 . 2]" 1 883 3 49 GLY H 3 51 VAL H 4.150 . 6.500 4.669 4.065 5.240 . 0 0 "[ . 1 . 2]" 1 884 3 50 GLN QB 3 52 GLY H 3.150 . 4.500 4.559 4.027 4.668 0.168 19 0 "[ . 1 . 2]" 1 885 3 51 VAL HA 3 52 GLY H 3.150 . 4.500 3.536 3.496 3.565 . 0 0 "[ . 1 . 2]" 1 886 3 56 GLY H 3 57 GLU H 3.150 . 4.500 2.791 2.679 2.954 . 0 0 "[ . 1 . 2]" 1 887 3 55 LEU HB3 3 56 GLY H 3.150 . 4.500 2.874 2.321 3.548 . 0 0 "[ . 1 . 2]" 1 888 3 55 LEU HG 3 56 GLY H 3.150 . 4.500 4.749 4.564 4.884 0.384 1 0 "[ . 1 . 2]" 1 889 3 55 LEU MD1 3 56 GLY H 3.150 . 4.500 4.532 4.446 4.645 0.145 10 0 "[ . 1 . 2]" 1 890 3 28 TYR QE 3 56 GLY H 4.150 . 6.500 3.756 3.358 4.133 . 0 0 "[ . 1 . 2]" 1 891 3 37 ASP HB2 3 38 ILE H 3.150 . 4.500 2.737 2.268 3.505 . 0 0 "[ . 1 . 2]" 1 892 3 34 GLU QB 3 38 ILE H 3.150 . 4.500 4.594 4.539 4.711 0.211 16 0 "[ . 1 . 2]" 1 893 3 36 ARG QB 3 38 ILE H 3.150 . 4.500 4.608 4.349 4.680 0.180 1 0 "[ . 1 . 2]" 1 894 3 36 ARG H 3 38 ILE H 4.150 . 6.500 4.479 3.466 4.759 . 0 0 "[ . 1 . 2]" 1 895 3 45 ASP H 3 46 ILE H 3.150 . 4.500 2.697 2.182 3.264 . 0 0 "[ . 1 . 2]" 1 896 3 46 ILE H 3 46 ILE HB 3.150 . 4.500 3.375 2.422 3.734 . 0 0 "[ . 1 . 2]" 1 897 3 46 ILE H 3 46 ILE MG 3.150 . 4.500 2.549 1.799 3.610 0.001 1 0 "[ . 1 . 2]" 1 898 3 43 ASN HA 3 46 ILE H 4.150 . 6.500 4.309 3.713 5.349 . 0 0 "[ . 1 . 2]" 1 899 3 46 ILE H 3 51 VAL H 4.150 . 6.500 5.809 4.635 6.520 0.020 16 0 "[ . 1 . 2]" 1 900 3 22 LYS H 3 22 LYS QG 3.150 . 4.500 2.938 2.737 3.287 . 0 0 "[ . 1 . 2]" 1 901 3 21 PRO HB3 3 22 LYS H 3.150 . 4.500 3.825 3.545 4.048 . 0 0 "[ . 1 . 2]" 1 902 3 22 LYS H 3 23 ARG H 2.150 . 2.500 2.627 2.426 2.963 0.463 12 0 "[ . 1 . 2]" 1 903 3 22 LYS H 3 81 TYR QE 4.150 . 6.500 2.686 2.211 3.250 . 0 0 "[ . 1 . 2]" 1 904 3 53 LYS H 3 55 LEU QD 4.150 . 6.500 5.160 4.746 5.518 . 0 0 "[ . 1 . 2]" 1 905 3 51 VAL HA 3 54 LYS H 3.150 . 4.500 4.121 3.587 4.581 0.081 8 0 "[ . 1 . 2]" 1 906 3 58 LYS H 3 58 LYS QG 3.150 . 4.500 2.153 1.861 2.366 . 0 0 "[ . 1 . 2]" 1 907 3 55 LEU MD2 3 58 LYS H 4.150 . 6.500 5.434 4.966 5.698 . 0 0 "[ . 1 . 2]" 1 908 3 58 LYS H 3 59 TRP HA 4.150 . 6.500 5.125 5.064 5.261 . 0 0 "[ . 1 . 2]" 1 909 3 60 LYS H 3 60 LYS HG2 3.150 . 4.500 3.821 3.713 3.949 . 0 0 "[ . 1 . 2]" 1 910 3 67 LYS H 3 67 LYS HG3 3.150 . 4.500 2.135 2.063 2.232 . 0 0 "[ . 1 . 2]" 1 911 3 67 LYS H 3 67 LYS QD 3.150 . 4.500 4.094 3.993 4.155 . 0 0 "[ . 1 . 2]" 1 912 3 62 LEU MD1 3 67 LYS H 3.150 . 4.500 4.558 4.377 4.637 0.137 6 0 "[ . 1 . 2]" 1 913 3 67 LYS H 3 68 GLN HG2 3.150 . 4.500 4.578 4.553 4.673 0.173 17 0 "[ . 1 . 2]" 1 914 3 71 GLU H 3 73 LYS H 3.150 . 4.500 4.011 3.919 4.097 . 0 0 "[ . 1 . 2]" 1 915 3 73 LYS H 3 73 LYS HB2 3.150 . 4.500 2.075 2.063 2.104 . 0 0 "[ . 1 . 2]" 1 916 3 73 LYS H 3 73 LYS HB3 3.150 . 4.500 3.222 3.106 3.322 . 0 0 "[ . 1 . 2]" 1 917 3 73 LYS H 3 73 LYS QG 3.150 . 4.500 3.483 3.340 3.627 . 0 0 "[ . 1 . 2]" 1 918 3 77 ASP HA 3 79 LYS H 4.150 . 6.500 4.312 4.176 4.451 . 0 0 "[ . 1 . 2]" 1 919 3 84 GLU HA 3 85 LYS H 3.150 . 4.500 3.428 3.363 3.512 . 0 0 "[ . 1 . 2]" 1 920 3 84 GLU HB2 3 85 LYS H 3.150 . 4.500 4.202 4.020 4.312 . 0 0 "[ . 1 . 2]" 1 921 3 84 GLU HB3 3 85 LYS H 3.150 . 4.500 3.643 2.788 4.307 . 0 0 "[ . 1 . 2]" 1 922 3 84 GLU HG2 3 85 LYS H 3.150 . 4.500 3.617 2.434 4.790 0.290 20 0 "[ . 1 . 2]" 1 923 3 84 GLU H 3 85 LYS H 3.150 . 4.500 2.582 2.513 2.763 . 0 0 "[ . 1 . 2]" 1 924 3 85 LYS H 3 86 GLU H 3.150 . 4.500 2.418 2.315 2.560 . 0 0 "[ . 1 . 2]" 1 925 3 85 LYS H 3 85 LYS HB3 3.150 . 4.500 2.421 2.160 2.683 . 0 0 "[ . 1 . 2]" 1 926 3 85 LYS H 3 85 LYS HB2 3.150 . 4.500 2.526 1.976 2.903 . 0 0 "[ . 1 . 2]" 1 927 3 85 LYS H 3 87 LEU H 3.150 . 4.500 3.698 3.520 3.946 . 0 0 "[ . 1 . 2]" 1 928 3 83 SER HA 3 85 LYS H 4.150 . 6.500 3.918 3.728 4.178 . 0 0 "[ . 1 . 2]" 1 929 3 81 TYR QD 3 85 LYS H 4.150 . 6.500 4.630 4.395 4.788 . 0 0 "[ . 1 . 2]" 1 930 3 25 LEU H 3 77 ASP QB 3.150 . 4.500 3.186 2.707 3.880 . 0 0 "[ . 1 . 2]" 1 931 3 25 LEU H 3 25 LEU QD 3.150 . 4.500 2.746 2.295 3.776 . 0 0 "[ . 1 . 2]" 1 932 3 52 GLY HA3 3 55 LEU H 4.150 . 6.500 4.410 4.328 4.588 . 0 0 "[ . 1 . 2]" 1 933 3 55 LEU H 3 55 LEU HB3 3.150 . 4.500 3.356 3.158 3.566 . 0 0 "[ . 1 . 2]" 1 934 3 55 LEU H 3 55 LEU MD2 3.150 . 4.500 4.153 3.311 4.472 . 0 0 "[ . 1 . 2]" 1 935 3 55 LEU H 3 55 LEU MD1 3.150 . 4.500 3.638 3.361 4.028 . 0 0 "[ . 1 . 2]" 1 936 3 61 ALA H 3 62 LEU H 3.150 . 4.500 2.550 2.336 2.650 . 0 0 "[ . 1 . 2]" 1 937 3 61 ALA MB 3 62 LEU H 3.150 . 4.500 2.702 2.579 2.899 . 0 0 "[ . 1 . 2]" 1 938 3 62 LEU H 3 66 GLU QB 3.150 . 4.500 4.631 4.552 4.679 0.179 6 0 "[ . 1 . 2]" 1 939 3 62 LEU H 3 66 GLU QG 3.150 . 4.500 4.560 4.530 4.591 0.091 20 0 "[ . 1 . 2]" 1 940 3 62 LEU H 3 62 LEU QB 3.150 . 4.500 2.696 2.557 2.736 . 0 0 "[ . 1 . 2]" 1 941 3 62 LEU H 3 62 LEU HG 3.150 . 4.500 1.908 1.793 2.117 0.007 8 0 "[ . 1 . 2]" 1 942 3 62 LEU H 3 62 LEU MD2 3.150 . 4.500 3.550 2.900 3.713 . 0 0 "[ . 1 . 2]" 1 943 3 62 LEU H 3 62 LEU MD1 3.150 . 4.500 2.672 2.544 3.448 . 0 0 "[ . 1 . 2]" 1 944 3 59 TRP HE3 3 62 LEU H 4.150 . 6.500 5.494 5.370 5.652 . 0 0 "[ . 1 . 2]" 1 945 3 87 LEU H 3 89 ASN H 3.150 . 4.500 4.054 3.923 4.519 0.019 5 0 "[ . 1 . 2]" 1 946 3 87 LEU H 3 88 TYR HB3 3.150 . 4.500 4.219 4.133 4.389 . 0 0 "[ . 1 . 2]" 1 947 3 87 LEU H 3 88 TYR HB2 3.150 . 4.500 4.772 4.681 4.886 0.386 17 0 "[ . 1 . 2]" 1 948 3 92 LEU H 3 92 LEU QB 2.150 . 2.500 2.233 2.097 2.285 . 0 0 "[ . 1 . 2]" 1 949 3 92 LEU H 3 92 LEU QD 3.150 . 4.500 3.270 2.348 3.603 . 0 0 "[ . 1 . 2]" 1 950 3 89 ASN HB3 3 92 LEU H 4.150 . 6.500 5.637 5.263 6.673 0.173 5 0 "[ . 1 . 2]" 1 951 3 91 THR H 3 92 LEU H 3.150 . 4.500 2.086 1.871 3.211 . 0 0 "[ . 1 . 2]" 1 952 3 91 THR MG 3 92 LEU H 4.150 . 6.500 1.933 1.800 2.530 . 0 0 "[ . 1 . 2]" 1 953 3 27 ALA H 3 29 MET H 4.150 . 6.500 4.186 4.063 4.347 . 0 0 "[ . 1 . 2]" 1 954 3 25 LEU QD 3 29 MET H 4.150 . 6.500 4.096 3.962 4.221 . 0 0 "[ . 1 . 2]" 1 955 3 19 ASN QB 3 19 ASN HD22 3.150 . 4.500 3.331 3.236 3.386 . 0 0 "[ . 1 . 2]" 1 956 3 18 PRO HB2 3 19 ASN HD22 3.150 . 4.500 3.730 2.144 4.373 . 0 0 "[ . 1 . 2]" 1 957 3 19 ASN H 3 20 ALA MB 3.150 . 4.500 4.138 3.968 4.397 . 0 0 "[ . 1 . 2]" 1 958 3 19 ASN H 3 19 ASN QB 3.150 . 4.500 2.374 2.138 2.901 . 0 0 "[ . 1 . 2]" 1 959 3 19 ASN H 3 19 ASN HD21 3.150 . 4.500 3.004 1.869 4.323 . 0 0 "[ . 1 . 2]" 1 960 3 19 ASN H 3 19 ASN HD22 3.150 . 4.500 4.354 3.432 4.575 0.075 11 0 "[ . 1 . 2]" 1 961 3 18 PRO HA 3 19 ASN H 3.150 . 4.500 3.567 3.563 3.572 . 0 0 "[ . 1 . 2]" 1 962 3 18 PRO HB3 3 19 ASN H 4.150 . 6.500 3.741 3.653 3.831 . 0 0 "[ . 1 . 2]" 1 963 3 18 PRO QD 3 19 ASN H 3.150 . 4.500 3.051 2.939 3.145 . 0 0 "[ . 1 . 2]" 1 964 3 18 PRO HG2 3 19 ASN H 3.150 . 4.500 1.906 1.826 1.990 . 0 0 "[ . 1 . 2]" 1 965 3 19 ASN H 3 88 TYR QD 3.150 . 4.500 2.387 2.157 2.597 . 0 0 "[ . 1 . 2]" 1 966 3 25 LEU QD 3 33 ASN HD21 3.150 . 4.500 3.430 3.124 4.161 . 0 0 "[ . 1 . 2]" 1 967 3 33 ASN HA 3 33 ASN HD21 3.150 . 4.500 3.842 2.479 4.213 . 0 0 "[ . 1 . 2]" 1 968 3 25 LEU QD 3 33 ASN HD22 3.150 . 4.500 3.131 2.725 4.249 . 0 0 "[ . 1 . 2]" 1 969 3 33 ASN HA 3 33 ASN HD22 3.150 . 4.500 4.157 3.429 4.357 . 0 0 "[ . 1 . 2]" 1 970 3 33 ASN QB 3 33 ASN HD22 3.150 . 4.500 3.248 3.214 3.399 . 0 0 "[ . 1 . 2]" 1 971 3 32 ALA H 3 33 ASN H 3.150 . 4.500 2.722 2.637 3.112 . 0 0 "[ . 1 . 2]" 1 972 3 33 ASN H 3 33 ASN HD22 3.150 . 4.500 4.579 4.519 4.704 0.204 7 0 "[ . 1 . 2]" 1 973 3 34 GLU HA 3 35 ASN HD21 3.150 . 4.500 4.709 4.591 4.923 0.423 16 0 "[ . 1 . 2]" 1 974 3 31 PHE HA 3 35 ASN HD21 3.150 . 4.500 4.295 3.232 4.625 0.125 1 0 "[ . 1 . 2]" 1 975 3 35 ASN HA 3 35 ASN HD21 3.150 . 4.500 2.625 2.302 3.718 . 0 0 "[ . 1 . 2]" 1 976 3 35 ASN HB3 3 35 ASN HD21 3.150 . 4.500 3.031 2.802 3.550 . 0 0 "[ . 1 . 2]" 1 977 3 31 PHE HZ 3 35 ASN HD21 3.150 . 4.500 4.576 4.172 4.652 0.152 14 0 "[ . 1 . 2]" 1 978 3 34 GLU HA 3 35 ASN HD22 4.150 . 6.500 5.552 5.446 5.941 . 0 0 "[ . 1 . 2]" 1 979 3 31 PHE HA 3 35 ASN HD22 3.150 . 4.500 3.376 3.237 3.956 . 0 0 "[ . 1 . 2]" 1 980 3 35 ASN HD22 3 70 TYR QE 3.150 . 4.500 3.627 3.014 4.087 . 0 0 "[ . 1 . 2]" 1 981 3 32 ALA HA 3 35 ASN H 3.150 . 4.500 3.365 3.060 3.709 . 0 0 "[ . 1 . 2]" 1 982 3 35 ASN H 3 37 ASP H 4.150 . 6.500 4.693 4.249 4.803 . 0 0 "[ . 1 . 2]" 1 983 3 34 GLU HG3 3 35 ASN H 4.150 . 6.500 4.780 4.257 5.163 . 0 0 "[ . 1 . 2]" 1 984 3 34 GLU HA 3 35 ASN H 3.150 . 4.500 3.536 3.512 3.558 . 0 0 "[ . 1 . 2]" 1 985 3 35 ASN H 3 36 ARG QB 3.150 . 4.500 4.231 4.048 4.545 0.045 18 0 "[ . 1 . 2]" 1 986 3 35 ASN H 3 55 LEU MD2 3.150 . 4.500 3.874 3.589 4.384 . 0 0 "[ . 1 . 2]" 1 987 3 35 ASN H 3 35 ASN HB3 3.150 . 4.500 3.521 3.468 3.614 . 0 0 "[ . 1 . 2]" 1 988 3 35 ASN H 3 35 ASN HD21 3.150 . 4.500 2.051 1.604 2.213 0.196 16 0 "[ . 1 . 2]" 1 989 3 35 ASN H 3 35 ASN HD22 3.150 . 4.500 2.848 2.676 3.434 . 0 0 "[ . 1 . 2]" 1 990 3 42 GLU QB 3 43 ASN HD21 3.150 . 4.500 2.651 1.948 3.701 . 0 0 "[ . 1 . 2]" 1 991 3 43 ASN HD21 3 46 ILE HG12 4.150 . 6.500 4.909 4.154 6.900 0.400 3 0 "[ . 1 . 2]" 1 992 3 43 ASN HA 3 43 ASN HD21 4.150 . 6.500 3.953 3.509 4.389 . 0 0 "[ . 1 . 2]" 1 993 3 43 ASN HB2 3 43 ASN HD21 3.150 . 4.500 2.271 2.113 2.485 . 0 0 "[ . 1 . 2]" 1 994 3 43 ASN HB3 3 43 ASN HD21 3.150 . 4.500 3.460 3.279 3.547 . 0 0 "[ . 1 . 2]" 1 995 3 39 VAL HA 3 43 ASN HD21 3.150 . 4.500 3.386 3.187 3.763 . 0 0 "[ . 1 . 2]" 1 996 3 39 VAL QG 3 43 ASN HD21 3.150 . 4.500 2.659 1.798 3.372 0.002 16 0 "[ . 1 . 2]" 1 997 3 43 ASN HA 3 43 ASN HD22 4.150 . 6.500 4.497 4.232 4.796 . 0 0 "[ . 1 . 2]" 1 998 3 39 VAL HA 3 43 ASN HD22 3.150 . 4.500 4.039 3.275 4.504 0.004 3 0 "[ . 1 . 2]" 1 999 3 43 ASN H 3 45 ASP H 4.150 . 6.500 4.930 4.743 5.189 . 0 0 "[ . 1 . 2]" 1 1000 3 42 GLU HA 3 43 ASN H 3.150 . 4.500 3.390 3.351 3.445 . 0 0 "[ . 1 . 2]" 1 1001 3 42 GLU QB 3 43 ASN H 3.150 . 4.500 3.089 2.936 3.201 . 0 0 "[ . 1 . 2]" 1 1002 3 42 GLU HG3 3 43 ASN H 4.150 . 6.500 4.545 4.303 4.810 . 0 0 "[ . 1 . 2]" 1 1003 3 43 ASN H 3 43 ASN HB2 3.150 . 4.500 2.888 2.804 3.003 . 0 0 "[ . 1 . 2]" 1 1004 3 43 ASN H 3 43 ASN HB3 3.150 . 4.500 3.896 3.856 3.955 . 0 0 "[ . 1 . 2]" 1 1005 3 43 ASN H 3 43 ASN HD21 3.150 . 4.500 2.783 2.222 3.487 . 0 0 "[ . 1 . 2]" 1 1006 3 43 ASN H 3 44 PRO HD2 3.150 . 4.500 3.952 3.883 4.036 . 0 0 "[ . 1 . 2]" 1 1007 3 43 ASN H 3 44 PRO HD3 3.150 . 4.500 2.459 2.350 2.570 . 0 0 "[ . 1 . 2]" 1 1008 3 40 ARG HA 3 43 ASN H 3.150 . 4.500 3.048 2.873 3.271 . 0 0 "[ . 1 . 2]" 1 1009 3 41 SER H 3 43 ASN H 3.150 . 4.500 3.677 3.525 3.827 . 0 0 "[ . 1 . 2]" 1 1010 3 39 VAL QG 3 43 ASN H 3.150 . 4.500 4.139 4.049 4.228 . 0 0 "[ . 1 . 2]" 1 1011 3 89 ASN H 3 89 ASN HD21 4.150 . 6.500 2.669 2.079 3.226 . 0 0 "[ . 1 . 2]" 1 1012 3 89 ASN QB 3 89 ASN HD22 3.150 . 4.500 3.261 3.226 3.304 . 0 0 "[ . 1 . 2]" 1 1013 3 89 ASN H 3 89 ASN HD22 4.150 . 6.500 3.341 2.911 3.786 . 0 0 "[ . 1 . 2]" 1 1014 3 85 LYS QG 3 89 ASN HD22 3.150 . 4.500 3.707 2.549 4.517 0.017 20 0 "[ . 1 . 2]" 1 1015 3 89 ASN H 3 90 ALA H 3.150 . 4.500 2.234 2.136 2.713 . 0 0 "[ . 1 . 2]" 1 1016 3 89 ASN H 3 90 ALA MB 3.150 . 4.500 3.925 3.793 4.314 . 0 0 "[ . 1 . 2]" 1 1017 3 88 TYR HB2 3 89 ASN H 3.150 . 4.500 3.962 3.659 4.027 . 0 0 "[ . 1 . 2]" 1 1018 3 50 GLN HE21 3 51 VAL HB 4.150 . 6.500 6.270 6.037 6.549 0.049 12 0 "[ . 1 . 2]" 1 1019 3 47 THR MG 3 50 GLN HE22 4.150 . 6.500 4.637 2.658 6.600 0.100 7 0 "[ . 1 . 2]" 1 1020 3 49 GLY H 3 50 GLN H 3.150 . 4.500 2.873 2.658 3.230 . 0 0 "[ . 1 . 2]" 1 1021 3 47 THR HB 3 50 GLN H 3.150 . 4.500 3.799 3.069 4.610 0.110 12 0 "[ . 1 . 2]" 1 1022 3 47 THR MG 3 50 GLN H 4.150 . 6.500 4.414 2.633 5.502 . 0 0 "[ . 1 . 2]" 1 1023 3 49 GLY HA3 3 50 GLN H 3.150 . 4.500 2.987 2.661 3.404 . 0 0 "[ . 1 . 2]" 1 1024 3 65 GLU H 3 68 GLN HE21 4.150 . 6.500 6.409 6.083 6.662 0.162 8 0 "[ . 1 . 2]" 1 1025 3 67 LYS HG3 3 68 GLN H 3.150 . 4.500 4.009 3.608 4.121 . 0 0 "[ . 1 . 2]" 1 1026 3 67 LYS HG2 3 68 GLN H 4.150 . 6.500 4.726 4.354 4.809 . 0 0 "[ . 1 . 2]" 1 1027 3 72 ALA MB 3 75 GLN HE21 4.150 . 6.500 4.149 3.756 4.781 . 0 0 "[ . 1 . 2]" 1 1028 3 74 ALA MB 3 75 GLN HE21 3.150 . 4.500 3.470 3.122 3.819 . 0 0 "[ . 1 . 2]" 1 1029 3 27 ALA HA 3 75 GLN HE21 3.150 . 4.500 2.641 2.122 3.440 . 0 0 "[ . 1 . 2]" 1 1030 3 72 ALA MB 3 75 GLN HE22 3.150 . 4.500 3.495 3.256 3.718 . 0 0 "[ . 1 . 2]" 1 1031 3 74 ALA HA 3 75 GLN H 3.150 . 4.500 3.544 3.532 3.552 . 0 0 "[ . 1 . 2]" 1 1032 3 23 ARG H 3 24 ALA H 3.150 . 4.500 4.624 4.562 4.648 0.148 14 0 "[ . 1 . 2]" 1 1033 3 34 GLU QG 3 36 ARG H 4.150 . 6.500 6.219 5.235 6.505 0.005 18 0 "[ . 1 . 2]" 1 1034 3 36 ARG H 3 55 LEU MD2 3.150 . 4.500 2.954 2.072 3.505 . 0 0 "[ . 1 . 2]" 1 1035 3 36 ARG H 3 55 LEU MD1 3.150 . 4.500 3.184 2.515 4.342 . 0 0 "[ . 1 . 2]" 1 1036 3 35 ASN HA 3 36 ARG H 3.150 . 4.500 3.506 3.251 3.560 . 0 0 "[ . 1 . 2]" 1 1037 3 35 ASN HD21 3 36 ARG H 3.150 . 4.500 4.348 4.031 4.463 . 0 0 "[ . 1 . 2]" 1 1038 3 35 ASN H 3 36 ARG H 3.150 . 4.500 2.891 2.382 3.049 . 0 0 "[ . 1 . 2]" 1 1039 3 37 ASP HA 3 40 ARG H 3.150 . 4.500 4.268 4.091 4.422 . 0 0 "[ . 1 . 2]" 1 1040 3 40 ARG H 3 40 ARG QD 3.150 . 4.500 4.479 4.279 4.565 0.065 6 0 "[ . 1 . 2]" 1 1041 3 77 ASP HA 3 80 ARG H 3.150 . 4.500 3.089 3.037 3.155 . 0 0 "[ . 1 . 2]" 1 1042 3 26 SER H 3 27 ALA H 3.150 . 4.500 4.439 4.096 4.496 . 0 0 "[ . 1 . 2]" 1 1043 3 25 LEU H 3 26 SER H 4.150 . 6.500 4.386 3.052 4.532 . 0 0 "[ . 1 . 2]" 1 1044 3 25 LEU QD 3 26 SER H 3.150 . 4.500 3.099 2.793 4.376 . 0 0 "[ . 1 . 2]" 1 1045 3 40 ARG QB 3 41 SER H 3.150 . 4.500 3.233 2.778 3.698 . 0 0 "[ . 1 . 2]" 1 1046 3 40 ARG QD 3 41 SER H 4.150 . 6.500 4.382 3.782 4.615 . 0 0 "[ . 1 . 2]" 1 1047 3 82 GLU QB 3 83 SER H 3.150 . 4.500 2.902 2.743 3.053 . 0 0 "[ . 1 . 2]" 1 1048 3 82 GLU HG2 3 83 SER H 3.150 . 4.500 4.250 3.834 4.510 0.010 12 0 "[ . 1 . 2]" 1 1049 3 82 GLU H 3 83 SER H 3.150 . 4.500 2.749 2.656 2.884 . 0 0 "[ . 1 . 2]" 1 1050 3 83 SER H 3 85 LYS H 4.150 . 6.500 3.719 3.602 3.904 . 0 0 "[ . 1 . 2]" 1 1051 3 10 ARG HB3 3 11 THR H 3.150 . 4.500 2.855 1.874 4.185 . 0 0 "[ . 1 . 2]" 1 1052 3 11 THR H 3 11 THR HB 3.150 . 4.500 3.624 2.586 4.077 . 0 0 "[ . 1 . 2]" 1 1053 3 11 THR H 3 11 THR MG 3.150 . 4.500 3.443 2.297 4.049 . 0 0 "[ . 1 . 2]" 1 1054 3 12 THR H 3 12 THR HA 2.150 . 2.500 2.462 2.275 2.763 0.263 20 0 "[ . 1 . 2]" 1 1055 3 12 THR H 3 12 THR HB 3.150 . 4.500 3.661 2.255 4.047 . 0 0 "[ . 1 . 2]" 1 1056 3 12 THR H 3 12 THR MG 3.150 . 4.500 3.025 2.134 3.978 . 0 0 "[ . 1 . 2]" 1 1057 3 47 THR H 3 47 THR MG 3.150 . 4.500 3.702 2.618 4.108 . 0 0 "[ . 1 . 2]" 1 1058 3 61 ALA H 3 63 THR H 4.150 . 6.500 5.080 4.592 5.358 . 0 0 "[ . 1 . 2]" 1 1059 3 63 THR H 3 66 GLU QB 3.150 . 4.500 2.905 2.607 3.187 . 0 0 "[ . 1 . 2]" 1 1060 3 63 THR H 3 66 GLU QG 3.150 . 4.500 2.782 2.686 2.981 . 0 0 "[ . 1 . 2]" 1 1061 3 63 THR H 3 66 GLU H 3.150 . 4.500 4.118 3.931 4.321 . 0 0 "[ . 1 . 2]" 1 1062 3 62 LEU HA 3 63 THR H 3.150 . 4.500 3.547 3.523 3.560 . 0 0 "[ . 1 . 2]" 1 1063 3 62 LEU HG 3 63 THR H 3.150 . 4.500 4.078 3.759 4.219 . 0 0 "[ . 1 . 2]" 1 1064 3 62 LEU H 3 63 THR H 4.150 . 6.500 3.195 3.138 3.305 . 0 0 "[ . 1 . 2]" 1 1065 3 62 LEU MD2 3 63 THR H 3.150 . 4.500 4.388 4.281 4.518 0.018 16 0 "[ . 1 . 2]" 1 1066 3 62 LEU MD1 3 63 THR H 4.150 . 6.500 3.118 2.971 3.654 . 0 0 "[ . 1 . 2]" 1 1067 3 63 THR H 3 64 PRO QD 4.150 . 6.500 4.012 3.948 4.133 . 0 0 "[ . 1 . 2]" 1 1068 3 63 THR H 3 63 THR HB 3.150 . 4.500 3.341 3.299 3.471 . 0 0 "[ . 1 . 2]" 1 1069 3 90 ALA MB 3 91 THR H 3.150 . 4.500 3.145 1.807 3.470 . 0 0 "[ . 1 . 2]" 1 1070 3 91 THR H 3 91 THR MG 3.150 . 4.500 2.759 2.492 3.644 . 0 0 "[ . 1 . 2]" 1 1071 3 37 ASP HB2 3 39 VAL H 4.150 . 6.500 5.615 5.248 6.160 . 0 0 "[ . 1 . 2]" 1 1072 3 39 VAL H 3 39 VAL QG 2.150 . 2.500 2.101 1.841 2.271 . 0 0 "[ . 1 . 2]" 1 1073 3 48 PHE HA 3 51 VAL H 3.150 . 4.500 3.888 3.466 4.393 . 0 0 "[ . 1 . 2]" 1 1074 3 51 VAL H 3 52 GLY H 3.150 . 4.500 2.670 2.346 2.834 . 0 0 "[ . 1 . 2]" 1 1075 3 51 VAL H 3 53 LYS H 4.150 . 6.500 4.834 4.003 5.367 . 0 0 "[ . 1 . 2]" 1 1076 3 50 GLN QB 3 51 VAL H 3.150 . 4.500 2.373 2.005 2.741 . 0 0 "[ . 1 . 2]" 1 1077 3 50 GLN HG3 3 51 VAL H 4.150 . 6.500 4.182 3.499 4.707 . 0 0 "[ . 1 . 2]" 1 1078 3 51 VAL H 3 51 VAL MG1 3.150 . 4.500 2.063 1.790 3.647 0.010 13 0 "[ . 1 . 2]" 1 1079 3 31 PHE QD 3 59 TRP H 4.150 . 6.500 5.539 5.339 5.851 . 0 0 "[ . 1 . 2]" 1 1080 3 56 GLY HA3 3 59 TRP H 3.150 . 4.500 4.369 4.266 4.512 0.012 18 0 "[ . 1 . 2]" 1 1081 3 59 TRP H 3 60 LYS HG2 4.150 . 6.500 6.512 6.435 6.547 0.047 16 0 "[ . 1 . 2]" 1 1082 3 59 TRP H 3 62 LEU MD1 4.150 . 6.500 3.928 3.762 4.538 . 0 0 "[ . 1 . 2]" 1 1083 3 28 TYR QE 3 59 TRP H 3.150 . 4.500 4.453 4.326 4.558 0.058 17 0 "[ . 1 . 2]" 1 1084 3 27 ALA H 3 28 TYR H 3.150 . 4.500 2.612 2.484 2.736 . 0 0 "[ . 1 . 2]" 1 1085 3 26 SER HA 3 28 TYR H 3.150 . 4.500 3.913 3.466 4.100 . 0 0 "[ . 1 . 2]" 1 1086 3 70 TYR H 3 72 ALA MB 3.150 . 4.500 4.621 4.531 4.644 0.144 8 0 "[ . 1 . 2]" 1 1087 3 70 TYR H 3 71 GLU H 3.150 . 4.500 2.666 2.555 2.725 . 0 0 "[ . 1 . 2]" 1 1088 3 69 PRO HB2 3 70 TYR H 3.150 . 4.500 2.216 2.055 2.538 . 0 0 "[ . 1 . 2]" 1 1089 3 69 PRO QD 3 70 TYR H 3.150 . 4.500 2.849 2.490 3.260 . 0 0 "[ . 1 . 2]" 1 1090 3 69 PRO QG 3 70 TYR H 3.150 . 4.500 3.362 2.264 3.569 . 0 0 "[ . 1 . 2]" 1 1091 3 68 GLN H 3 70 TYR H 3.150 . 4.500 4.791 4.654 4.829 0.329 12 0 "[ . 1 . 2]" 1 1092 3 70 TYR H 3 70 TYR HB3 3.150 . 4.500 3.487 3.458 3.525 . 0 0 "[ . 1 . 2]" 1 1093 3 70 TYR H 3 70 TYR HB2 3.150 . 4.500 3.103 3.052 3.141 . 0 0 "[ . 1 . 2]" 1 1094 3 70 TYR H 3 70 TYR QD 3.150 . 4.500 2.585 2.463 2.735 . 0 0 "[ . 1 . 2]" 1 1095 3 77 ASP HA 3 81 TYR H 3.150 . 4.500 4.154 3.939 4.295 . 0 0 "[ . 1 . 2]" 1 1096 3 81 TYR H 3 81 TYR QE 4.150 . 6.500 5.419 5.229 5.550 . 0 0 "[ . 1 . 2]" 1 1097 3 85 LYS HA 3 88 TYR H 3.150 . 4.500 2.999 2.796 3.271 . 0 0 "[ . 1 . 2]" 1 1098 3 87 LEU QD 3 88 TYR H 4.150 . 6.500 2.440 1.838 3.012 . 0 0 "[ . 1 . 2]" 1 1099 3 88 TYR H 3 89 ASN QB 4.150 . 6.500 5.219 5.028 5.403 . 0 0 "[ . 1 . 2]" 1 1100 3 59 TRP HB3 3 60 LYS H 3.150 . 4.500 2.436 2.340 2.522 . 0 0 "[ . 1 . 2]" 1 1101 3 59 TRP HB2 3 60 LYS H 3.150 . 4.500 3.838 3.760 3.901 . 0 0 "[ . 1 . 2]" 1 1102 3 22 LYS H 3 84 GLU HG3 3.150 . 4.500 4.635 4.423 4.871 0.371 5 0 "[ . 1 . 2]" 1 1103 3 57 GLU H 3 58 LYS QG 3.150 . 4.500 4.436 4.148 4.519 0.019 7 0 "[ . 1 . 2]" 1 1104 3 67 LYS H 3 67 LYS HG2 3.150 . 4.500 2.915 2.508 3.046 . 0 0 "[ . 1 . 2]" 1 1105 3 81 TYR QB 3 83 SER H 3.150 . 4.500 4.699 4.595 4.788 0.288 16 0 "[ . 1 . 2]" 1 1106 3 32 ALA HA 3 33 ASN H 3.150 . 4.500 3.458 3.407 3.568 . 0 0 "[ . 1 . 2]" 1 1107 3 88 TYR H 3 89 ASN H 3.150 . 4.500 2.885 2.661 3.191 . 0 0 "[ . 1 . 2]" 1 1108 3 88 TYR QD 3 89 ASN H 3.150 . 4.500 3.220 2.407 3.716 . 0 0 "[ . 1 . 2]" 1 1109 3 39 VAL QG 3 43 ASN HD22 3.150 . 4.500 3.460 2.234 3.982 . 0 0 "[ . 1 . 2]" 1 1110 3 35 ASN HA 3 35 ASN HD22 3.150 . 4.500 4.008 3.920 4.335 . 0 0 "[ . 1 . 2]" 1 1111 3 31 PHE QE 3 59 TRP H 3.150 . 4.500 3.667 3.477 4.024 . 0 0 "[ . 1 . 2]" 1 1112 3 19 ASN HA 3 19 ASN HD22 3.150 . 4.500 3.930 3.586 4.563 0.063 5 0 "[ . 1 . 2]" 1 1113 3 51 VAL H 3 51 VAL HB 3.150 . 4.500 2.683 2.240 3.007 . 0 0 "[ . 1 . 2]" 1 1114 3 39 VAL QG 3 42 GLU H 3.150 . 4.500 4.191 4.157 4.281 . 0 0 "[ . 1 . 2]" 1 1115 3 79 LYS H 3 81 TYR H 3.150 . 4.500 4.496 4.276 4.580 0.080 11 0 "[ . 1 . 2]" 1 1116 3 38 ILE H 3 38 ILE HG13 3.150 . 4.500 3.817 3.499 4.025 . 0 0 "[ . 1 . 2]" 1 1117 3 29 MET H 3 30 PHE H 3.150 . 4.500 2.496 2.366 2.621 . 0 0 "[ . 1 . 2]" 1 1118 3 43 ASN HB3 3 46 ILE H 3.150 . 4.500 3.414 2.934 4.529 0.029 10 0 "[ . 1 . 2]" 1 1119 3 36 ARG HA 3 37 ASP H 3.150 . 4.500 3.565 3.552 3.570 . 0 0 "[ . 1 . 2]" 1 1120 3 48 PHE H 3 50 GLN H 4.150 . 6.500 4.368 3.834 4.939 . 0 0 "[ . 1 . 2]" 1 1121 3 89 ASN H 3 89 ASN QB 3.150 . 4.500 2.706 2.524 2.974 . 0 0 "[ . 1 . 2]" 1 1122 3 54 LYS QB 3 55 LEU H 3.150 . 4.500 2.734 2.309 3.036 . 0 0 "[ . 1 . 2]" 1 1123 3 46 ILE H 3 46 ILE HG12 3.150 . 4.500 2.690 1.930 4.582 0.082 8 0 "[ . 1 . 2]" 1 1124 3 32 ALA MB 3 33 ASN H 3.150 . 4.500 2.858 2.248 3.029 . 0 0 "[ . 1 . 2]" 1 1125 3 43 ASN H 3 43 ASN HD22 3.150 . 4.500 4.022 3.822 4.218 . 0 0 "[ . 1 . 2]" 1 1126 3 70 TYR HB2 3 71 GLU H 3.150 . 4.500 2.290 2.207 2.395 . 0 0 "[ . 1 . 2]" 1 1127 3 88 TYR HB3 3 89 ASN H 3.150 . 4.500 2.623 2.163 2.729 . 0 0 "[ . 1 . 2]" 1 1128 3 38 ILE H 3 38 ILE HB 3.150 . 4.500 2.271 2.218 2.323 . 0 0 "[ . 1 . 2]" 1 1129 3 19 ASN H 3 20 ALA H 3.150 . 4.500 2.081 1.847 2.312 . 0 0 "[ . 1 . 2]" 1 1130 3 34 GLU QB 3 35 ASN H 3.150 . 4.500 2.327 2.142 2.410 . 0 0 "[ . 1 . 2]" 1 1131 3 64 PRO QD 3 65 GLU H 3.150 . 4.500 3.120 3.067 3.227 . 0 0 "[ . 1 . 2]" 1 1132 3 31 PHE H 3 33 ASN H 4.150 . 6.500 3.720 3.627 4.234 . 0 0 "[ . 1 . 2]" 1 1133 3 30 PHE QB 3 31 PHE H 3.150 . 4.500 2.471 2.358 2.541 . 0 0 "[ . 1 . 2]" 1 1134 3 30 PHE HZ 3 77 ASP H 3.150 . 4.500 4.270 4.129 4.455 . 0 0 "[ . 1 . 2]" 1 1135 3 25 LEU HA 3 26 SER H 2.150 . 2.500 2.715 2.546 2.802 0.302 15 0 "[ . 1 . 2]" 1 1136 3 28 TYR QE 3 60 LYS H 4.150 . 6.500 5.746 5.390 6.506 0.006 15 0 "[ . 1 . 2]" 1 1137 3 60 LYS QG 3 61 ALA H 3.150 . 4.500 4.470 4.424 4.531 0.031 11 0 "[ . 1 . 2]" 1 1138 3 75 GLN HA 3 76 ALA H 3.150 . 4.500 3.486 3.442 3.517 . 0 0 "[ . 1 . 2]" 1 1139 3 57 GLU H 3 57 GLU HB3 2.150 . 2.500 2.304 1.818 2.997 0.497 2 0 "[ . 1 . 2]" 1 1140 3 34 GLU H 3 35 ASN HB3 4.150 . 6.500 6.157 6.044 6.459 . 0 0 "[ . 1 . 2]" 1 1141 3 86 GLU H 3 87 LEU QD 4.150 . 6.500 4.916 4.157 5.137 . 0 0 "[ . 1 . 2]" 1 1142 3 83 SER H 3 84 GLU H 3.150 . 4.500 2.532 2.365 2.660 . 0 0 "[ . 1 . 2]" 1 1143 3 82 GLU H 3 84 GLU H 3.150 . 4.500 4.412 4.094 4.557 0.057 3 0 "[ . 1 . 2]" 1 1144 3 53 LYS H 3 53 LYS QD 3.150 . 4.500 3.326 2.918 4.294 . 0 0 "[ . 1 . 2]" 1 1145 3 18 PRO HB2 3 20 ALA H 3.150 . 4.500 4.537 4.422 4.607 0.107 18 0 "[ . 1 . 2]" 1 1146 3 27 ALA H 3 27 ALA MB 3.150 . 4.500 2.201 2.179 2.249 . 0 0 "[ . 1 . 2]" 1 1147 3 32 ALA MB 3 34 GLU H 4.150 . 6.500 4.811 4.526 4.909 . 0 0 "[ . 1 . 2]" 1 1148 3 47 THR MG 3 50 GLN HE21 4.150 . 6.500 3.827 1.951 5.950 . 0 0 "[ . 1 . 2]" 1 1149 3 57 GLU H 3 57 GLU HG3 3.150 . 4.500 3.770 3.130 4.546 0.046 4 0 "[ . 1 . 2]" 1 1150 3 18 PRO QD 3 20 ALA H 3.150 . 4.500 3.363 3.209 3.482 . 0 0 "[ . 1 . 2]" 1 1151 3 59 TRP HD1 3 60 LYS H 3.150 . 4.500 3.469 3.120 3.812 . 0 0 "[ . 1 . 2]" 1 1152 3 72 ALA H 3 73 LYS H 3.150 . 4.500 2.570 2.524 2.612 . 0 0 "[ . 1 . 2]" 1 1153 3 77 ASP HA 3 78 LYS H 3.150 . 4.500 3.447 3.373 3.505 . 0 0 "[ . 1 . 2]" 1 1154 3 74 ALA MB 3 77 ASP H 3.150 . 4.500 4.490 4.278 4.578 0.078 16 0 "[ . 1 . 2]" 1 1155 3 39 VAL QG 3 55 LEU H 3.150 . 4.500 4.144 3.938 4.448 . 0 0 "[ . 1 . 2]" 1 1156 3 72 ALA H 3 74 ALA H 3.150 . 4.500 3.642 3.614 3.669 . 0 0 "[ . 1 . 2]" 1 1157 3 50 GLN HA 3 51 VAL H 3.150 . 4.500 3.549 3.525 3.562 . 0 0 "[ . 1 . 2]" 1 1158 3 28 TYR H 3 28 TYR QD 3.150 . 4.500 4.200 4.158 4.222 . 0 0 "[ . 1 . 2]" 1 1159 3 63 THR HA 3 65 GLU H 4.150 . 6.500 4.346 3.974 4.538 . 0 0 "[ . 1 . 2]" 1 1160 3 38 ILE H 3 41 SER QB 4.150 . 6.500 4.170 4.050 4.294 . 0 0 "[ . 1 . 2]" 1 1161 3 71 GLU H 3 72 ALA H 3.150 . 4.500 2.973 2.881 3.045 . 0 0 "[ . 1 . 2]" 1 1162 3 70 TYR H 3 72 ALA H 3.150 . 4.500 3.954 3.839 4.002 . 0 0 "[ . 1 . 2]" 1 1163 3 31 PHE HZ 3 59 TRP H 3.150 . 4.500 3.679 3.497 3.810 . 0 0 "[ . 1 . 2]" 1 1164 3 45 ASP HA 3 46 ILE H 3.150 . 4.500 3.249 2.385 3.572 . 0 0 "[ . 1 . 2]" 1 1165 3 86 GLU H 3 87 LEU H 3.150 . 4.500 2.679 2.606 2.743 . 0 0 "[ . 1 . 2]" 1 1166 3 54 LYS H 3 55 LEU H 3.150 . 4.500 2.586 2.408 2.865 . 0 0 "[ . 1 . 2]" 1 1167 3 57 GLU H 3 57 GLU HB2 3.150 . 4.500 3.144 2.106 3.597 . 0 0 "[ . 1 . 2]" 1 1168 3 37 ASP HA 3 38 ILE H 3.150 . 4.500 3.557 3.508 3.569 . 0 0 "[ . 1 . 2]" 1 1169 3 26 SER H 3 26 SER HB3 3.150 . 4.500 3.041 2.757 3.896 . 0 0 "[ . 1 . 2]" 1 1170 3 20 ALA H 3 21 PRO QG 3.150 . 4.500 4.646 4.562 4.857 0.357 16 0 "[ . 1 . 2]" 1 1171 3 73 LYS HA 3 76 ALA H 3.150 . 4.500 3.216 3.166 3.314 . 0 0 "[ . 1 . 2]" 1 1172 3 45 ASP H 3 45 ASP HB3 3.150 . 4.500 3.363 2.429 3.898 . 0 0 "[ . 1 . 2]" 1 1173 3 71 GLU HB3 3 75 GLN HE21 3.150 . 4.500 4.233 4.014 4.595 0.095 11 0 "[ . 1 . 2]" 1 1174 3 45 ASP H 3 45 ASP HB2 3.150 . 4.500 2.572 2.088 3.573 . 0 0 "[ . 1 . 2]" 1 1175 3 26 SER HB2 3 28 TYR H 3.150 . 4.500 3.989 3.786 4.207 . 0 0 "[ . 1 . 2]" 1 1176 3 72 ALA H 3 72 ALA MB 2.150 . 2.500 2.228 2.205 2.246 . 0 0 "[ . 1 . 2]" 1 1177 3 60 LYS QB 3 61 ALA H 3.150 . 4.500 3.176 2.994 3.411 . 0 0 "[ . 1 . 2]" 1 1178 3 75 GLN H 3 77 ASP H 3.150 . 4.500 4.194 3.839 4.314 . 0 0 "[ . 1 . 2]" 1 1179 3 38 ILE H 3 38 ILE HG12 3.150 . 4.500 3.876 3.610 4.099 . 0 0 "[ . 1 . 2]" 1 1180 3 42 GLU H 3 42 GLU HG2 3.150 . 4.500 3.242 2.732 3.791 . 0 0 "[ . 1 . 2]" 1 1181 3 57 GLU HG3 3 58 LYS H 3.150 . 4.500 2.700 1.832 4.484 . 0 0 "[ . 1 . 2]" 1 1182 3 88 TYR H 3 88 TYR HB3 3.150 . 4.500 2.413 2.322 2.516 . 0 0 "[ . 1 . 2]" 1 1183 3 55 LEU H 3 55 LEU HB2 3.150 . 4.500 2.153 2.053 2.337 . 0 0 "[ . 1 . 2]" 1 1184 3 36 ARG QG 3 37 ASP H 3.150 . 4.500 2.604 2.247 4.225 . 0 0 "[ . 1 . 2]" 1 1185 3 67 LYS H 3 68 GLN H 3.150 . 4.500 2.364 2.217 2.450 . 0 0 "[ . 1 . 2]" 1 1186 3 65 GLU H 3 67 LYS H 3.150 . 4.500 3.881 3.658 4.038 . 0 0 "[ . 1 . 2]" 1 1187 3 63 THR H 3 67 LYS H 4.150 . 6.500 3.608 3.393 3.729 . 0 0 "[ . 1 . 2]" 1 1188 3 83 SER HA 3 86 GLU H 3.150 . 4.500 3.417 2.990 3.657 . 0 0 "[ . 1 . 2]" 1 1189 3 76 ALA MB 3 78 LYS H 3.150 . 4.500 4.231 4.071 4.506 0.006 14 0 "[ . 1 . 2]" 1 1190 3 56 GLY HA3 3 57 GLU H 3.150 . 4.500 2.700 2.557 2.854 . 0 0 "[ . 1 . 2]" 1 1191 3 47 THR MG 3 48 PHE H 3.150 . 4.500 2.312 1.810 4.053 . 0 0 "[ . 1 . 2]" 1 1192 3 35 ASN HB3 3 36 ARG H 3.150 . 4.500 3.567 2.869 4.376 . 0 0 "[ . 1 . 2]" 1 1193 3 65 GLU H 3 65 GLU HG3 3.150 . 4.500 3.979 3.853 4.429 . 0 0 "[ . 1 . 2]" 1 1194 3 52 GLY HA2 3 53 LYS H 3.150 . 4.500 3.558 3.521 3.575 . 0 0 "[ . 1 . 2]" 1 1195 3 34 GLU H 3 34 GLU HG2 3.150 . 4.500 2.536 2.213 3.563 . 0 0 "[ . 1 . 2]" 1 1196 3 76 ALA HA 3 77 ASP H 3.150 . 4.500 3.546 3.470 3.558 . 0 0 "[ . 1 . 2]" 1 1197 3 71 GLU HB3 3 72 ALA H 3.150 . 4.500 2.389 2.327 2.473 . 0 0 "[ . 1 . 2]" 1 1198 3 60 LYS HG3 3 62 LEU H 4.150 . 6.500 6.568 6.475 6.602 0.102 14 0 "[ . 1 . 2]" 1 1199 3 20 ALA H 3 20 ALA MB 2.150 . 2.500 2.656 2.600 2.832 0.332 16 0 "[ . 1 . 2]" 1 1200 3 50 GLN H 3 51 VAL H 3.150 . 4.500 2.491 2.037 2.795 . 0 0 "[ . 1 . 2]" 1 1201 3 56 GLY HA2 3 57 GLU H 3.150 . 4.500 3.559 3.527 3.573 . 0 0 "[ . 1 . 2]" 1 1202 3 77 ASP H 3 77 ASP QB 2.150 . 2.500 2.257 2.171 2.284 . 0 0 "[ . 1 . 2]" 1 1203 3 45 ASP HB2 3 46 ILE H 3.150 . 4.500 3.437 2.281 4.490 . 0 0 "[ . 1 . 2]" 1 1204 3 50 GLN HA 3 50 GLN HE22 4.150 . 6.500 4.323 3.352 5.455 . 0 0 "[ . 1 . 2]" 1 1205 3 79 LYS H 3 82 GLU H 3.150 . 4.500 4.452 4.343 4.550 0.050 2 0 "[ . 1 . 2]" 1 1206 3 68 GLN H 3 68 GLN HG3 3.150 . 4.500 2.829 1.875 4.098 . 0 0 "[ . 1 . 2]" 1 1207 3 74 ALA MB 3 75 GLN HE22 4.150 . 6.500 4.810 4.340 5.093 . 0 0 "[ . 1 . 2]" 1 1208 3 45 ASP HB3 3 46 ILE H 3.150 . 4.500 3.505 2.266 4.457 . 0 0 "[ . 1 . 2]" 1 1209 3 76 ALA MB 3 77 ASP H 3.150 . 4.500 2.567 2.444 2.871 . 0 0 "[ . 1 . 2]" 1 1210 3 66 GLU QG 3 67 LYS H 3.150 . 4.500 3.629 3.479 3.848 . 0 0 "[ . 1 . 2]" 1 1211 3 38 ILE HG12 3 39 VAL H 3.150 . 4.500 4.574 4.503 4.643 0.143 17 0 "[ . 1 . 2]" 1 1212 3 35 ASN H 3 38 ILE HB 3.150 . 4.500 4.411 4.280 4.545 0.045 18 0 "[ . 1 . 2]" 1 1213 3 41 SER H 3 41 SER QB 2.150 . 2.500 2.196 2.150 2.253 . 0 0 "[ . 1 . 2]" 1 1214 3 38 ILE HA 3 41 SER H 3.150 . 4.500 3.631 3.502 3.776 . 0 0 "[ . 1 . 2]" 1 1215 3 47 THR H 3 48 PHE H 4.150 . 6.500 4.340 4.130 4.508 . 0 0 "[ . 1 . 2]" 1 1216 3 50 GLN HE21 3 53 LYS QG 4.150 . 6.500 6.550 6.503 6.594 0.094 4 0 "[ . 1 . 2]" 1 1217 3 81 TYR H 3 81 TYR QB 3.150 . 4.500 2.080 2.067 2.109 . 0 0 "[ . 1 . 2]" 1 1218 3 53 LYS H 3 55 LEU H 3.150 . 4.500 4.089 3.787 4.523 0.023 11 0 "[ . 1 . 2]" 1 1219 3 33 ASN H 3 33 ASN HD21 3.150 . 4.500 3.370 2.913 3.741 . 0 0 "[ . 1 . 2]" 1 1220 3 39 VAL HA 3 42 GLU H 3.150 . 4.500 3.590 3.473 3.761 . 0 0 "[ . 1 . 2]" 1 1221 3 41 SER QB 3 42 GLU H 3.150 . 4.500 2.955 2.875 3.041 . 0 0 "[ . 1 . 2]" 1 1222 3 73 LYS H 3 74 ALA H 3.150 . 4.500 2.560 2.527 2.604 . 0 0 "[ . 1 . 2]" 1 1223 3 84 GLU H 3 84 GLU HB3 2.150 . 2.500 2.405 2.180 2.713 0.213 10 0 "[ . 1 . 2]" 1 1224 3 51 VAL HA 3 55 LEU H 3.150 . 4.500 4.015 3.717 4.258 . 0 0 "[ . 1 . 2]" 1 1225 3 38 ILE HA 3 39 VAL H 3.150 . 4.500 3.556 3.552 3.559 . 0 0 "[ . 1 . 2]" 1 1226 3 60 LYS H 3 61 ALA H 3.150 . 4.500 2.390 2.290 2.475 . 0 0 "[ . 1 . 2]" 1 1227 3 26 SER HB3 3 28 TYR H 3.150 . 4.500 2.328 2.043 2.822 . 0 0 "[ . 1 . 2]" 1 1228 3 30 PHE HA 3 31 PHE H 3.150 . 4.500 3.549 3.543 3.560 . 0 0 "[ . 1 . 2]" 1 1229 3 55 LEU H 3 55 LEU HG 3.150 . 4.500 3.385 2.582 3.917 . 0 0 "[ . 1 . 2]" 1 1230 3 71 GLU HB3 3 75 GLN HE22 3.150 . 4.500 4.178 3.598 4.536 0.036 15 0 "[ . 1 . 2]" 1 1231 3 80 ARG H 3 80 ARG HG3 3.150 . 4.500 4.202 3.390 4.583 0.083 3 0 "[ . 1 . 2]" 1 1232 3 64 PRO HA 3 67 LYS H 3.150 . 4.500 3.463 3.383 3.542 . 0 0 "[ . 1 . 2]" 1 1233 3 65 GLU H 3 65 GLU HG2 3.150 . 4.500 4.581 4.518 4.614 0.114 11 0 "[ . 1 . 2]" 1 1234 3 74 ALA H 3 75 GLN H 3.150 . 4.500 2.465 2.372 2.523 . 0 0 "[ . 1 . 2]" 1 1235 3 58 LYS QB 3 61 ALA H 3.150 . 4.500 4.482 4.403 4.548 0.048 8 0 "[ . 1 . 2]" 1 1236 3 31 PHE QD 3 35 ASN HD21 3.150 . 4.500 3.840 3.144 4.072 . 0 0 "[ . 1 . 2]" 1 1237 3 38 ILE HG13 3 39 VAL H 3.150 . 4.500 4.681 4.642 4.724 0.224 4 0 "[ . 1 . 2]" 1 1238 3 39 VAL HA 3 40 ARG H 3.150 . 4.500 3.575 3.571 3.578 . 0 0 "[ . 1 . 2]" 1 1239 3 52 GLY H 3 53 LYS H 3.150 . 4.500 2.975 2.588 3.106 . 0 0 "[ . 1 . 2]" 1 1240 3 92 LEU QB 3 93 ALA H 3.150 . 4.500 3.261 1.987 3.487 . 0 0 "[ . 1 . 2]" 1 1241 3 24 ALA HA 3 25 LEU H 3.150 . 4.500 2.536 2.302 2.764 . 0 0 "[ . 1 . 2]" 1 1242 3 84 GLU H 3 86 GLU HG2 3.150 . 4.500 4.486 4.175 4.645 0.145 16 0 "[ . 1 . 2]" 1 1243 3 35 ASN HB3 3 39 VAL H 4.150 . 6.500 3.387 3.276 3.626 . 0 0 "[ . 1 . 2]" 1 1244 3 55 LEU HB2 3 56 GLY H 3.150 . 4.500 2.913 2.577 3.138 . 0 0 "[ . 1 . 2]" 1 1245 3 54 LYS H 3 56 GLY H 3.150 . 4.500 4.348 4.030 4.594 0.094 2 0 "[ . 1 . 2]" 1 1246 3 25 LEU H 3 25 LEU HG 3.150 . 4.500 4.037 3.826 4.500 . 0 0 "[ . 1 . 2]" 1 1247 3 71 GLU HB2 3 72 ALA H 3.150 . 4.500 3.521 3.394 3.671 . 0 0 "[ . 1 . 2]" 1 1248 3 24 ALA MB 3 25 LEU H 3.150 . 4.500 2.323 2.033 2.694 . 0 0 "[ . 1 . 2]" 1 1249 3 85 LYS HA 3 86 GLU H 3.150 . 4.500 3.549 3.513 3.561 . 0 0 "[ . 1 . 2]" 1 1250 3 28 TYR H 3 29 MET H 3.150 . 4.500 2.416 2.355 2.505 . 0 0 "[ . 1 . 2]" 1 1251 3 31 PHE HA 3 34 GLU H 3.150 . 4.500 3.358 3.290 3.487 . 0 0 "[ . 1 . 2]" 1 1252 3 82 GLU H 3 82 GLU QB 3.150 . 4.500 2.254 2.236 2.276 . 0 0 "[ . 1 . 2]" 1 1253 3 65 GLU H 3 66 GLU H 3.150 . 4.500 2.726 2.434 2.827 . 0 0 "[ . 1 . 2]" 1 1254 3 73 LYS H 3 76 ALA H 3.150 . 4.500 4.709 4.686 4.739 0.239 5 0 "[ . 1 . 2]" 1 1255 3 39 VAL HB 3 40 ARG H 3.150 . 4.500 2.361 2.151 3.778 . 0 0 "[ . 1 . 2]" 1 1256 3 75 GLN H 3 75 GLN QG 3.150 . 4.500 2.321 2.108 2.461 . 0 0 "[ . 1 . 2]" 1 1257 3 57 GLU HA 3 60 LYS H 3.150 . 4.500 3.905 3.659 4.035 . 0 0 "[ . 1 . 2]" 1 1258 3 36 ARG QB 3 37 ASP H 3.150 . 4.500 2.401 2.268 2.666 . 0 0 "[ . 1 . 2]" 1 1259 3 74 ALA H 3 75 GLN QB 3.150 . 4.500 4.460 4.383 4.580 0.080 11 0 "[ . 1 . 2]" 1 1260 3 32 ALA HA 3 34 GLU H 3.150 . 4.500 4.500 4.277 4.641 0.141 15 0 "[ . 1 . 2]" 1 1261 3 56 GLY H 3 58 LYS H 3.150 . 4.500 4.338 3.953 4.642 0.142 8 0 "[ . 1 . 2]" 1 1262 3 75 GLN HE22 3 75 GLN QG 3.150 . 4.500 3.267 3.217 3.428 . 0 0 "[ . 1 . 2]" 1 1263 3 44 PRO HB3 3 45 ASP H 3.150 . 4.500 3.713 3.498 3.846 . 0 0 "[ . 1 . 2]" 1 1264 3 35 ASN HA 3 38 ILE H 3.150 . 4.500 3.307 3.173 3.389 . 0 0 "[ . 1 . 2]" 1 1265 3 60 LYS H 3 60 LYS QB 2.150 . 2.500 2.216 2.135 2.313 . 0 0 "[ . 1 . 2]" 1 1266 3 41 SER H 3 42 GLU H 2.150 . 2.500 2.446 2.250 2.554 0.054 16 0 "[ . 1 . 2]" 1 1267 3 37 ASP H 3 38 ILE H 3.150 . 4.500 2.644 2.419 2.757 . 0 0 "[ . 1 . 2]" 1 1268 3 65 GLU HA 3 68 GLN HE22 4.150 . 6.500 4.717 3.873 4.901 . 0 0 "[ . 1 . 2]" 1 1269 3 42 GLU H 3 42 GLU QB 2.150 . 2.500 2.493 2.429 2.535 0.035 9 0 "[ . 1 . 2]" 1 1270 3 80 ARG H 3 82 GLU H 3.150 . 4.500 3.887 3.730 4.045 . 0 0 "[ . 1 . 2]" 1 1271 3 79 LYS H 3 79 LYS QB 2.150 . 2.500 2.264 2.095 2.543 0.043 20 0 "[ . 1 . 2]" 1 1272 3 63 THR MG 3 66 GLU H 3.150 . 4.500 2.183 1.812 2.984 . 0 0 "[ . 1 . 2]" 1 1273 3 76 ALA H 3 77 ASP H 3.150 . 4.500 2.631 2.525 2.691 . 0 0 "[ . 1 . 2]" 1 1274 3 33 ASN H 3 34 GLU H 3.150 . 4.500 2.648 2.531 2.979 . 0 0 "[ . 1 . 2]" 1 1275 3 78 LYS H 3 78 LYS HB2 3.150 . 4.500 2.137 2.069 2.239 . 0 0 "[ . 1 . 2]" 1 1276 3 47 THR H 3 50 GLN QB 3.150 . 4.500 3.665 1.971 4.467 . 0 0 "[ . 1 . 2]" 1 1277 3 59 TRP H 3 61 ALA H 3.150 . 4.500 3.568 3.471 3.663 . 0 0 "[ . 1 . 2]" 1 1278 3 66 GLU H 3 66 GLU QG 2.150 . 2.500 1.856 1.823 1.949 . 0 0 "[ . 1 . 2]" 1 1279 3 87 LEU HB2 3 90 ALA H 3.150 . 4.500 4.788 4.739 4.878 0.378 20 0 "[ . 1 . 2]" 1 1280 3 52 GLY HA2 3 55 LEU H 3.150 . 4.500 3.469 3.313 3.659 . 0 0 "[ . 1 . 2]" 1 1281 3 81 TYR QB 3 82 GLU H 3.150 . 4.500 3.206 3.009 3.377 . 0 0 "[ . 1 . 2]" 1 1282 3 31 PHE QE 3 32 ALA H 3.150 . 4.500 4.441 3.981 4.610 0.110 1 0 "[ . 1 . 2]" 1 1283 3 93 ALA H 3 93 ALA MB 3.150 . 4.500 2.436 2.156 2.976 . 0 0 "[ . 1 . 2]" 1 1284 3 65 GLU HG3 3 68 GLN HE22 3.150 . 4.500 4.383 3.001 4.574 0.074 1 0 "[ . 1 . 2]" 1 1285 3 33 ASN HA 3 36 ARG H 3.150 . 4.500 4.164 3.484 4.609 0.109 18 0 "[ . 1 . 2]" 1 1286 3 86 GLU HA 3 89 ASN H 3.150 . 4.500 3.927 3.814 3.981 . 0 0 "[ . 1 . 2]" 1 1287 3 61 ALA H 3 61 ALA MB 2.150 . 2.500 2.213 2.087 2.290 . 0 0 "[ . 1 . 2]" 1 1288 3 60 LYS HA 3 61 ALA H 3.150 . 4.500 3.363 3.244 3.448 . 0 0 "[ . 1 . 2]" 1 1289 3 42 GLU H 3 43 ASN H 3.150 . 4.500 2.162 2.081 2.232 . 0 0 "[ . 1 . 2]" 1 1290 3 81 TYR QD 3 82 GLU H 3.150 . 4.500 2.124 1.881 2.361 . 0 0 "[ . 1 . 2]" 1 1291 3 63 THR H 3 63 THR MG 3.150 . 4.500 3.907 3.810 4.053 . 0 0 "[ . 1 . 2]" 1 1292 3 71 GLU H 3 71 GLU QG 3.150 . 4.500 3.809 3.687 3.898 . 0 0 "[ . 1 . 2]" 1 1293 3 72 ALA MB 3 73 LYS H 2.150 . 2.500 2.499 2.443 2.551 0.051 11 0 "[ . 1 . 2]" 1 1294 3 71 GLU HB3 3 73 LYS H 3.150 . 4.500 4.748 4.734 4.771 0.271 15 0 "[ . 1 . 2]" 1 1295 3 38 ILE MG 3 41 SER H 3.150 . 4.500 4.358 4.301 4.431 . 0 0 "[ . 1 . 2]" 1 1296 3 50 GLN H 3 51 VAL MG1 3.150 . 4.500 3.469 2.952 4.931 0.431 1 0 "[ . 1 . 2]" 1 1297 3 53 LYS H 3 53 LYS QB 2.150 . 2.500 2.462 2.060 2.602 0.102 20 0 "[ . 1 . 2]" 1 1298 3 19 ASN HA 3 20 ALA H 3.150 . 4.500 3.433 3.371 3.499 . 0 0 "[ . 1 . 2]" 1 1299 3 51 VAL MG1 3 52 GLY H 3.150 . 4.500 1.931 1.764 2.922 0.036 18 0 "[ . 1 . 2]" 1 1300 3 62 LEU QB 3 66 GLU H 3.150 . 4.500 3.985 3.743 4.054 . 0 0 "[ . 1 . 2]" 1 1301 3 79 LYS H 3 80 ARG H 3.150 . 4.500 2.535 2.488 2.571 . 0 0 "[ . 1 . 2]" 1 1302 3 80 ARG H 3 81 TYR H 3.150 . 4.500 3.077 2.875 3.146 . 0 0 "[ . 1 . 2]" 1 1303 3 73 LYS H 3 74 ALA MB 3.150 . 4.500 4.187 4.122 4.230 . 0 0 "[ . 1 . 2]" 1 1304 3 75 GLN H 3 75 GLN QB 2.150 . 2.500 2.457 2.384 2.577 0.077 18 0 "[ . 1 . 2]" 1 1305 3 88 TYR H 3 88 TYR HB2 3.150 . 4.500 2.665 2.560 2.733 . 0 0 "[ . 1 . 2]" 1 1306 3 16 LYS QG 3 17 ASP H 3.150 . 4.500 3.730 2.130 4.509 0.009 19 0 "[ . 1 . 2]" 1 1307 3 39 VAL QG 3 40 ARG H 3.150 . 4.500 2.681 1.744 3.056 0.056 17 0 "[ . 1 . 2]" 1 1308 3 34 GLU H 3 34 GLU HG3 3.150 . 4.500 3.435 2.625 4.143 . 0 0 "[ . 1 . 2]" 1 1309 3 31 PHE H 3 70 TYR QD 3.150 . 4.500 3.893 3.712 4.072 . 0 0 "[ . 1 . 2]" 1 1310 3 59 TRP H 3 59 TRP HB2 3.150 . 4.500 2.807 2.761 2.839 . 0 0 "[ . 1 . 2]" 1 1311 3 58 LYS H 3 59 TRP H 3.150 . 4.500 2.556 2.487 2.689 . 0 0 "[ . 1 . 2]" 1 1312 3 59 TRP H 3 60 LYS QB 3.150 . 4.500 4.708 4.642 4.753 0.253 7 0 "[ . 1 . 2]" 1 1313 3 65 GLU H 3 65 GLU HB3 3.150 . 4.500 3.166 2.530 3.310 . 0 0 "[ . 1 . 2]" 1 1314 3 33 ASN QB 3 34 GLU H 3.150 . 4.500 2.550 2.490 2.628 . 0 0 "[ . 1 . 2]" 1 1315 3 38 ILE H 3 40 ARG H 3.150 . 4.500 4.478 4.184 4.588 0.088 1 0 "[ . 1 . 2]" 1 1316 3 68 GLN HE21 3 68 GLN HG2 3.150 . 4.500 2.338 2.128 3.506 . 0 0 "[ . 1 . 2]" 1 1317 3 37 ASP H 3 39 VAL H 3.150 . 4.500 4.629 4.600 4.660 0.160 7 0 "[ . 1 . 2]" 1 1318 3 68 GLN H 3 69 PRO QD 3.150 . 4.500 2.507 2.208 2.598 . 0 0 "[ . 1 . 2]" 1 1319 3 63 THR MG 3 65 GLU H 3.150 . 4.500 1.742 1.689 1.815 0.111 17 0 "[ . 1 . 2]" 1 1320 3 52 GLY HA2 3 54 LYS H 4.150 . 6.500 4.480 4.119 4.921 . 0 0 "[ . 1 . 2]" 1 1321 3 60 LYS H 3 60 LYS HG3 3.150 . 4.500 2.965 2.697 3.185 . 0 0 "[ . 1 . 2]" 1 1322 3 29 MET HA 3 31 PHE H 3.150 . 4.500 4.636 4.574 4.790 0.290 18 0 "[ . 1 . 2]" 1 1323 3 66 GLU H 3 67 LYS H 3.150 . 4.500 2.614 2.496 2.688 . 0 0 "[ . 1 . 2]" 1 1324 3 51 VAL MG2 3 52 GLY H 3.150 . 4.500 3.360 2.975 4.056 . 0 0 "[ . 1 . 2]" 1 1325 3 58 LYS QB 3 59 TRP H 3.150 . 4.500 2.906 2.765 3.065 . 0 0 "[ . 1 . 2]" 1 1326 3 59 TRP H 3 59 TRP HB3 3.150 . 4.500 2.298 2.263 2.333 . 0 0 "[ . 1 . 2]" 1 1327 3 76 ALA H 3 77 ASP QB 3.150 . 4.500 4.426 4.277 4.497 . 0 0 "[ . 1 . 2]" 1 1328 3 80 ARG H 3 80 ARG QB 2.150 . 2.500 2.162 2.057 2.217 . 0 0 "[ . 1 . 2]" 1 1329 3 82 GLU H 3 82 GLU HG2 3.150 . 4.500 4.405 4.389 4.416 . 0 0 "[ . 1 . 2]" 1 1330 3 62 LEU QB 3 63 THR H 3.150 . 4.500 1.768 1.723 1.940 0.077 14 0 "[ . 1 . 2]" 1 1331 3 70 TYR H 3 71 GLU HB2 3.150 . 4.500 4.589 4.518 4.663 0.163 8 0 "[ . 1 . 2]" 1 1332 3 35 ASN HB2 3 36 ARG H 3.150 . 4.500 2.212 1.837 3.577 . 0 0 "[ . 1 . 2]" 1 1333 3 50 GLN HA 3 50 GLN HE21 3.150 . 4.500 3.883 1.796 4.508 0.008 17 0 "[ . 1 . 2]" 1 1334 3 65 GLU H 3 65 GLU HB2 3.150 . 4.500 2.097 2.060 2.607 . 0 0 "[ . 1 . 2]" 1 1335 3 75 GLN QB 3 76 ALA H 3.150 . 4.500 2.861 2.615 3.598 . 0 0 "[ . 1 . 2]" 1 1336 3 47 THR H 3 47 THR HB 3.150 . 4.500 3.547 2.846 4.053 . 0 0 "[ . 1 . 2]" 1 1337 3 11 THR H 3 11 THR HA 2.150 . 2.500 2.455 2.274 2.685 0.185 16 0 "[ . 1 . 2]" 1 1338 3 39 VAL H 3 40 ARG H 3.150 . 4.500 3.113 3.025 3.221 . 0 0 "[ . 1 . 2]" 1 1339 3 27 ALA HA 3 30 PHE H 3.150 . 4.500 3.530 3.321 3.617 . 0 0 "[ . 1 . 2]" 1 1340 3 87 LEU HA 3 90 ALA H 3.150 . 4.500 2.621 2.558 2.962 . 0 0 "[ . 1 . 2]" 1 1341 3 71 GLU H 3 74 ALA H 3.150 . 4.500 4.559 4.515 4.609 0.109 11 0 "[ . 1 . 2]" 1 1342 3 58 LYS HA 3 61 ALA H 3.150 . 4.500 3.105 2.979 3.239 . 0 0 "[ . 1 . 2]" 1 1343 3 65 GLU HA 3 68 GLN HE21 3.150 . 4.500 4.049 3.819 4.209 . 0 0 "[ . 1 . 2]" 1 1344 3 13 ARG H 3 13 ARG HA 2.150 . 2.500 2.603 2.326 2.673 0.173 16 0 "[ . 1 . 2]" 1 1345 3 60 LYS H 3 62 LEU H 3.150 . 4.500 4.356 4.134 4.518 0.018 16 0 "[ . 1 . 2]" 1 1346 3 22 LYS HA 3 23 ARG H 2.150 . 2.500 2.520 2.313 2.675 0.175 4 0 "[ . 1 . 2]" 1 1347 3 46 ILE HG12 3 50 GLN H 4.150 . 6.500 6.114 4.546 7.078 0.578 12 2 "[ . - + . 2]" 1 1348 3 40 ARG H 3 41 SER H 3.150 . 4.500 2.648 2.595 2.688 . 0 0 "[ . 1 . 2]" 1 1349 3 42 GLU H 3 43 ASN HD22 3.150 . 4.500 4.522 4.298 4.577 0.077 20 0 "[ . 1 . 2]" 1 1350 3 34 GLU H 3 34 GLU QB 2.150 . 2.500 2.421 2.224 2.506 0.006 18 0 "[ . 1 . 2]" 1 1351 3 31 PHE H 3 31 PHE HB3 3.150 . 4.500 2.231 2.191 2.259 . 0 0 "[ . 1 . 2]" 1 1352 3 23 ARG H 3 23 ARG HG3 3.150 . 4.500 3.654 3.136 4.117 . 0 0 "[ . 1 . 2]" 1 1353 3 74 ALA MB 3 75 GLN H 3.150 . 4.500 2.405 2.339 2.487 . 0 0 "[ . 1 . 2]" 1 1354 3 81 TYR HA 3 82 GLU H 3.150 . 4.500 3.488 3.446 3.533 . 0 0 "[ . 1 . 2]" 1 1355 3 84 GLU H 3 86 GLU H 3.150 . 4.500 4.328 4.154 4.525 0.025 3 0 "[ . 1 . 2]" 1 1356 3 40 ARG H 3 40 ARG QG 3.150 . 4.500 3.480 2.775 3.991 . 0 0 "[ . 1 . 2]" 1 1357 3 77 ASP QB 3 78 LYS H 3.150 . 4.500 2.952 2.732 3.208 . 0 0 "[ . 1 . 2]" 1 1358 3 35 ASN HB2 3 35 ASN HD21 3.150 . 4.500 3.246 2.384 3.523 . 0 0 "[ . 1 . 2]" 1 1359 3 31 PHE H 3 31 PHE HB2 3.150 . 4.500 2.917 2.880 2.954 . 0 0 "[ . 1 . 2]" 1 1360 3 56 GLY HA2 3 60 LYS H 3.150 . 4.500 4.290 4.130 4.402 . 0 0 "[ . 1 . 2]" 1 1361 3 53 LYS H 3 54 LYS H 3.150 . 4.500 2.802 2.579 3.011 . 0 0 "[ . 1 . 2]" 1 1362 3 59 TRP H 3 60 LYS H 3.150 . 4.500 2.827 2.748 2.892 . 0 0 "[ . 1 . 2]" 1 1363 3 76 ALA H 3 78 LYS H 3.150 . 4.500 3.680 3.542 3.922 . 0 0 "[ . 1 . 2]" 1 1364 3 73 LYS H 3 75 GLN H 3.150 . 4.500 4.444 4.373 4.530 0.030 11 0 "[ . 1 . 2]" 1 1365 3 58 LYS HA 3 59 TRP H 3.150 . 4.500 3.460 3.424 3.500 . 0 0 "[ . 1 . 2]" 1 1366 3 78 LYS H 3 79 LYS H 3.150 . 4.500 2.674 2.604 2.758 . 0 0 "[ . 1 . 2]" 1 1367 3 75 GLN QG 3 76 ALA H 3.150 . 4.500 3.871 2.079 4.223 . 0 0 "[ . 1 . 2]" 1 1368 3 40 ARG QG 3 41 SER H 3.150 . 4.500 3.497 2.074 4.413 . 0 0 "[ . 1 . 2]" 1 1369 3 13 ARG H 3 13 ARG QB 2.150 . 2.500 2.543 2.464 2.692 0.192 20 0 "[ . 1 . 2]" 1 1370 3 33 ASN H 3 34 GLU H 3.150 . 4.500 2.625 2.520 2.880 . 0 0 "[ . 1 . 2]" 1 1371 3 79 LYS HA 3 82 GLU H 3.150 . 4.500 2.990 2.878 3.160 . 0 0 "[ . 1 . 2]" 1 1372 3 82 GLU H 3 82 GLU HG3 3.150 . 4.500 4.512 4.448 4.589 0.089 18 0 "[ . 1 . 2]" 1 1373 3 40 ARG H 3 40 ARG QB 2.150 . 2.500 2.178 2.127 2.248 . 0 0 "[ . 1 . 2]" 1 1374 3 38 ILE H 3 39 VAL H 3.150 . 4.500 3.038 2.915 3.094 . 0 0 "[ . 1 . 2]" 1 1375 3 67 LYS HA 3 70 TYR H 3.150 . 4.500 3.093 3.063 3.116 . 0 0 "[ . 1 . 2]" 1 1376 3 86 GLU H 3 88 TYR H 3.150 . 4.500 3.950 3.736 4.131 . 0 0 "[ . 1 . 2]" 1 1377 3 87 LEU H 3 87 LEU QD 3.150 . 4.500 3.181 2.564 3.361 . 0 0 "[ . 1 . 2]" 1 1378 3 84 GLU H 3 84 GLU HB2 3.150 . 4.500 3.238 2.660 3.609 . 0 0 "[ . 1 . 2]" 1 1379 3 36 ARG H 3 36 ARG QG 3.150 . 4.500 3.802 1.836 4.070 . 0 0 "[ . 1 . 2]" 1 1380 3 74 ALA MB 3 76 ALA H 3.150 . 4.500 4.210 4.092 4.311 . 0 0 "[ . 1 . 2]" 1 1381 3 23 ARG H 3 81 TYR QB 4.150 . 6.500 5.032 4.644 5.483 . 0 0 "[ . 1 . 2]" 1 1382 3 28 TYR QD 3 59 TRP H 4.150 . 6.500 6.222 5.855 6.535 0.035 20 0 "[ . 1 . 2]" 1 1383 3 58 LYS H 3 60 LYS H 4.150 . 6.500 4.653 4.454 4.776 . 0 0 "[ . 1 . 2]" 1 1384 3 38 ILE H 3 42 GLU HG3 4.150 . 6.500 6.438 6.221 6.512 0.012 9 0 "[ . 1 . 2]" 1 1385 3 28 TYR QD 3 29 MET H 3.150 . 4.500 3.718 3.266 3.953 . 0 0 "[ . 1 . 2]" 1 1386 3 57 GLU H 3 60 LYS QB 4.150 . 6.500 5.841 5.699 5.954 . 0 0 "[ . 1 . 2]" 1 1387 3 59 TRP HE3 3 61 ALA H 4.150 . 6.500 5.913 5.547 6.308 . 0 0 "[ . 1 . 2]" 1 1388 3 50 GLN HG2 3 53 LYS H 4.150 . 6.500 6.512 6.229 6.730 0.230 2 0 "[ . 1 . 2]" 1 1389 3 59 TRP H 3 60 LYS HG3 4.150 . 6.500 5.453 5.043 5.795 . 0 0 "[ . 1 . 2]" 1 1390 3 30 PHE HZ 3 74 ALA H 4.150 . 6.500 5.380 5.271 5.545 . 0 0 "[ . 1 . 2]" 1 1391 3 52 GLY HA2 3 56 GLY H 4.150 . 6.500 4.461 4.314 4.562 . 0 0 "[ . 1 . 2]" 1 1392 3 39 VAL H 3 55 LEU HG 4.150 . 6.500 5.730 5.264 6.509 0.009 10 0 "[ . 1 . 2]" 1 1393 3 62 LEU MD2 3 66 GLU H 4.150 . 6.500 5.572 5.123 6.102 . 0 0 "[ . 1 . 2]" 1 1394 3 50 GLN HE22 3 51 VAL HB 4.650 . 7.500 7.705 7.490 7.860 0.360 2 0 "[ . 1 . 2]" 1 1395 3 88 TYR HB2 3 90 ALA H 4.150 . 6.500 5.723 5.614 5.759 . 0 0 "[ . 1 . 2]" 1 1396 3 37 ASP HA 3 42 GLU H 4.150 . 6.500 6.455 6.325 6.543 0.043 9 0 "[ . 1 . 2]" 1 1397 3 77 ASP QB 3 80 ARG H 3.150 . 4.500 4.538 4.369 4.645 0.145 3 0 "[ . 1 . 2]" 1 1398 3 35 ASN HD22 3 36 ARG H 4.150 . 6.500 5.218 5.018 5.643 . 0 0 "[ . 1 . 2]" 1 1399 3 21 PRO HB2 3 22 LYS H 2.150 . 2.500 2.387 1.986 2.633 0.133 1 0 "[ . 1 . 2]" 1 1400 3 59 TRP H 3 59 TRP HD1 4.150 . 6.500 4.784 4.674 4.870 . 0 0 "[ . 1 . 2]" 1 1401 3 42 GLU QB 3 43 ASN HD22 3.150 . 4.500 2.537 2.095 3.023 . 0 0 "[ . 1 . 2]" 1 1402 3 59 TRP HA 3 62 LEU H 3.150 . 4.500 3.638 3.441 3.774 . 0 0 "[ . 1 . 2]" 1 1403 3 80 ARG H 3 81 TYR QB 4.150 . 6.500 4.858 4.612 4.979 . 0 0 "[ . 1 . 2]" 1 1404 3 80 ARG H 3 80 ARG HD3 4.150 . 6.500 5.445 4.602 5.930 . 0 0 "[ . 1 . 2]" 1 1405 3 67 LYS HB3 3 72 ALA H 3.150 . 4.500 4.064 3.990 4.174 . 0 0 "[ . 1 . 2]" 1 1406 3 55 LEU MD2 3 56 GLY H 4.150 . 6.500 4.287 3.772 4.814 . 0 0 "[ . 1 . 2]" 1 1407 3 36 ARG QD 3 38 ILE H 4.150 . 6.500 5.948 5.349 6.333 . 0 0 "[ . 1 . 2]" 1 1408 3 31 PHE HZ 3 32 ALA H 4.150 . 6.500 6.147 5.707 6.311 . 0 0 "[ . 1 . 2]" 1 1409 3 53 LYS H 3 54 LYS HA 4.150 . 6.500 5.390 5.220 5.549 . 0 0 "[ . 1 . 2]" 1 1410 3 31 PHE HZ 3 58 LYS H 4.150 . 6.500 5.204 5.008 5.473 . 0 0 "[ . 1 . 2]" 1 1411 3 87 LEU HB3 3 90 ALA H 4.150 . 6.500 5.066 4.995 5.221 . 0 0 "[ . 1 . 2]" 1 1412 3 31 PHE HZ 3 34 GLU H 4.150 . 6.500 4.823 4.698 5.099 . 0 0 "[ . 1 . 2]" 1 1413 3 43 ASN HD22 3 46 ILE HG12 4.150 . 6.500 5.790 5.274 7.219 0.719 3 3 "[ *+ . - 1 . 2]" 1 1414 3 85 LYS QG 3 89 ASN HD21 3.150 . 4.500 4.009 3.395 4.577 0.077 20 0 "[ . 1 . 2]" 1 1415 3 31 PHE H 3 70 TYR QE 4.150 . 6.500 5.466 5.281 5.572 . 0 0 "[ . 1 . 2]" 1 1416 3 26 SER H 3 27 ALA MB 4.150 . 6.500 5.628 5.447 5.697 . 0 0 "[ . 1 . 2]" 1 1417 3 18 PRO HA 3 20 ALA H 3.150 . 4.500 4.415 4.137 4.576 0.076 16 0 "[ . 1 . 2]" 1 1418 3 48 PHE H 3 48 PHE QD 4.150 4.150 6.500 4.169 4.109 4.196 0.041 19 0 "[ . 1 . 2]" 1 1419 3 48 PHE H 3 48 PHE HB2 2.150 . 2.500 2.732 2.660 2.832 0.332 19 0 "[ . 1 . 2]" 1 1420 3 48 PHE H 3 48 PHE HB3 2.150 . 2.500 2.369 2.231 2.429 . 0 0 "[ . 1 . 2]" 1 1421 3 44 PRO HA 3 45 ASP H 3.150 . 4.500 3.424 3.324 3.522 . 0 0 "[ . 1 . 2]" 1 1422 3 23 ARG QD 3 24 ALA H 3.150 . 4.500 3.614 2.947 4.516 0.016 10 0 "[ . 1 . 2]" 1 1423 3 24 ALA H 3 81 TYR QD 4.150 . 6.500 4.028 2.858 4.553 . 0 0 "[ . 1 . 2]" 1 1424 3 24 ALA H 3 81 TYR QE 4.150 . 6.500 4.280 3.439 4.789 . 0 0 "[ . 1 . 2]" 1 1425 3 24 ALA MB 3 78 LYS H 3.150 . 4.500 3.397 2.919 3.754 . 0 0 "[ . 1 . 2]" 1 1426 3 24 ALA MB 3 81 TYR H 4.150 . 6.500 3.273 2.843 5.411 . 0 0 "[ . 1 . 2]" 1 1427 3 21 PRO HG3 3 22 LYS H 4.150 . 6.500 4.046 3.456 4.244 . 0 0 "[ . 1 . 2]" 1 1428 3 21 PRO HG2 3 22 LYS H 4.150 . 6.500 3.472 1.925 3.957 . 0 0 "[ . 1 . 2]" 1 1429 3 19 ASN H 3 21 PRO QG 4.150 . 6.500 5.660 5.375 6.235 . 0 0 "[ . 1 . 2]" 1 1430 3 29 MET HA 3 30 PHE H 3.150 . 4.500 3.551 3.530 3.560 . 0 0 "[ . 1 . 2]" 1 1431 3 88 TYR QE 3 89 ASN H 4.150 . 6.500 5.178 4.504 5.582 . 0 0 "[ . 1 . 2]" 1 1432 3 29 MET H 3 29 MET HB3 3.150 . 4.500 3.608 3.557 3.644 . 0 0 "[ . 1 . 2]" 1 1433 3 29 MET HB2 3 32 ALA H 4.150 . 6.500 5.715 5.435 6.179 . 0 0 "[ . 1 . 2]" 1 1434 3 28 TYR HB2 3 29 MET H 3.150 . 4.500 2.708 2.487 2.884 . 0 0 "[ . 1 . 2]" 1 1435 3 25 LEU HB2 3 29 MET H 3.150 . 4.500 2.749 2.507 2.938 . 0 0 "[ . 1 . 2]" 1 1436 3 25 LEU HB3 3 29 MET H 3.150 . 4.500 3.459 3.352 3.604 . 0 0 "[ . 1 . 2]" 1 1437 3 25 LEU H 3 25 LEU HB2 4.150 . 6.500 2.134 2.063 2.635 . 0 0 "[ . 1 . 2]" 1 1438 3 25 LEU H 3 25 LEU HB3 4.150 . 6.500 3.345 2.645 3.464 . 0 0 "[ . 1 . 2]" 1 1439 3 25 LEU HB3 3 30 PHE H 3.150 . 4.500 3.861 3.704 4.172 . 0 0 "[ . 1 . 2]" 1 1440 3 25 LEU HB2 3 30 PHE H 3.150 . 4.500 3.689 3.301 4.272 . 0 0 "[ . 1 . 2]" 1 1441 3 25 LEU HB3 3 26 SER H 3.150 . 4.500 2.027 1.773 4.194 0.027 15 0 "[ . 1 . 2]" 1 1442 3 25 LEU HB2 3 26 SER H 3.150 . 4.500 3.523 3.370 4.561 0.061 8 0 "[ . 1 . 2]" 1 1443 3 32 ALA MB 3 33 ASN HD22 4.150 . 6.500 5.237 4.908 5.620 . 0 0 "[ . 1 . 2]" 1 1444 3 28 TYR HB3 3 29 MET H 4.150 . 6.500 2.811 2.665 3.005 . 0 0 "[ . 1 . 2]" 1 1445 3 28 TYR H 3 29 MET HB2 4.150 . 6.500 4.986 4.692 5.257 . 0 0 "[ . 1 . 2]" 1 1446 3 28 TYR H 3 31 PHE HB3 4.150 . 6.500 4.845 4.700 4.987 . 0 0 "[ . 1 . 2]" 1 1447 3 28 TYR H 3 28 TYR HB2 3.150 . 4.500 2.583 2.483 2.681 . 0 0 "[ . 1 . 2]" 1 1448 3 28 TYR H 3 28 TYR HB3 4.150 . 6.500 2.538 2.421 2.646 . 0 0 "[ . 1 . 2]" 1 1449 3 28 TYR HB2 3 30 PHE H 4.150 . 6.500 2.523 2.405 2.728 . 0 0 "[ . 1 . 2]" 1 1450 3 27 ALA H 3 28 TYR HB2 4.150 . 6.500 4.859 4.693 5.167 . 0 0 "[ . 1 . 2]" 1 1451 3 27 ALA H 3 28 TYR HB3 4.150 . 6.500 4.949 4.814 5.083 . 0 0 "[ . 1 . 2]" 1 1452 3 28 TYR HB3 3 59 TRP HE1 4.150 . 6.500 4.792 4.330 4.909 . 0 0 "[ . 1 . 2]" 1 1453 3 26 SER H 3 29 MET HB2 4.150 . 6.500 2.784 2.554 4.949 . 0 0 "[ . 1 . 2]" 1 1454 3 30 PHE H 3 31 PHE HB2 4.150 . 6.500 5.388 5.254 5.527 . 0 0 "[ . 1 . 2]" 1 1455 3 78 LYS QG 3 80 ARG H 4.150 . 6.500 5.891 5.732 6.143 . 0 0 "[ . 1 . 2]" 1 1456 3 78 LYS QE 3 80 ARG H 4.150 . 6.500 5.870 4.826 6.543 0.043 18 0 "[ . 1 . 2]" 1 1457 3 78 LYS QG 3 82 GLU H 4.150 . 6.500 4.399 3.979 4.737 . 0 0 "[ . 1 . 2]" 1 1458 3 85 LYS HA 3 89 ASN H 3.150 . 4.500 4.247 4.084 4.299 . 0 0 "[ . 1 . 2]" 1 1459 3 85 LYS HB2 3 86 GLU H 3.150 . 4.500 1.888 1.817 2.188 . 0 0 "[ . 1 . 2]" 1 1460 3 86 GLU HA 3 89 ASN HD22 3.150 . 4.500 2.634 1.843 4.328 . 0 0 "[ . 1 . 2]" 1 1461 3 86 GLU HA 3 89 ASN HD21 3.150 . 4.500 2.925 2.152 4.180 . 0 0 "[ . 1 . 2]" 1 1462 3 16 LYS QE 3 17 ASP H 4.150 . 6.500 5.576 4.843 6.100 . 0 0 "[ . 1 . 2]" 1 1463 3 17 ASP H 3 17 ASP HB2 3.150 . 4.500 3.412 2.988 4.078 . 0 0 "[ . 1 . 2]" 1 1464 3 17 ASP H 3 17 ASP HB3 3.150 . 4.500 3.999 3.826 4.122 . 0 0 "[ . 1 . 2]" 1 1465 3 17 ASP H 3 18 PRO QD 4.150 . 6.500 3.905 3.598 4.289 . 0 0 "[ . 1 . 2]" 1 1466 3 17 ASP HA 3 19 ASN H 3.150 . 4.500 4.605 4.518 4.677 0.177 18 0 "[ . 1 . 2]" 1 1467 3 17 ASP H 3 20 ALA MB 3.150 . 4.500 4.201 3.228 4.539 0.039 2 0 "[ . 1 . 2]" 1 1468 3 16 LYS HA 3 17 ASP H 2.150 . 2.500 2.333 2.148 2.525 0.025 11 0 "[ . 1 . 2]" 1 1469 3 17 ASP HB3 3 20 ALA H 3.150 . 4.500 2.239 1.846 3.015 . 0 0 "[ . 1 . 2]" 1 1470 3 20 ALA H 3 88 TYR HB3 4.150 . 6.500 5.707 5.614 5.809 . 0 0 "[ . 1 . 2]" 1 1471 3 84 GLU H 3 85 LYS HB2 4.150 . 6.500 4.424 3.704 5.023 . 0 0 "[ . 1 . 2]" 1 1472 3 85 LYS HB3 3 89 ASN H 4.150 . 6.500 5.054 4.909 5.604 . 0 0 "[ . 1 . 2]" 1 1473 3 84 GLU H 3 85 LYS HB3 4.150 . 6.500 4.642 4.374 5.063 . 0 0 "[ . 1 . 2]" 1 1474 3 26 SER H 3 29 MET H 4.150 . 6.500 3.368 3.088 5.323 . 0 0 "[ . 1 . 2]" 1 1475 3 80 ARG HE 3 83 SER H 3.150 . 4.500 4.483 4.341 4.610 0.110 8 0 "[ . 1 . 2]" 1 1476 3 21 PRO HB3 3 82 GLU HG2 3.150 . 4.500 4.666 4.572 4.744 0.244 11 0 "[ . 1 . 2]" 1 1477 3 87 LEU HB2 3 92 LEU H 3.150 . 4.500 4.584 4.532 4.684 0.184 5 0 "[ . 1 . 2]" 1 1478 3 54 LYS H 3 57 GLU HB3 3.150 . 4.500 4.586 4.109 5.433 0.933 17 6 "[ * -* * 1 . + *]" 1 1479 3 46 ILE MG 3 48 PHE H 4.150 . 6.500 3.657 2.872 5.566 . 0 0 "[ . 1 . 2]" 1 1480 3 46 ILE H 3 50 GLN QB 3.150 . 4.500 4.722 4.219 4.905 0.405 8 0 "[ . 1 . 2]" 1 1481 3 46 ILE H 3 47 THR H 3.150 . 4.500 3.440 1.794 4.620 0.120 12 0 "[ . 1 . 2]" 1 1482 3 47 THR H 3 50 GLN HG3 3.150 . 4.500 3.575 1.937 4.811 0.311 13 0 "[ . 1 . 2]" 1 1483 3 53 LYS H 3 53 LYS QG 3.150 . 4.500 2.256 1.881 3.633 . 0 0 "[ . 1 . 2]" 1 1484 3 50 GLN H 3 51 VAL HB 3.150 . 4.500 4.618 3.745 4.770 0.270 10 0 "[ . 1 . 2]" 1 1485 3 68 GLN HE22 3 72 ALA MB 4.150 . 6.500 5.315 5.080 5.870 . 0 0 "[ . 1 . 2]" 1 1486 3 68 GLN HE21 3 72 ALA MB 3.150 . 4.500 4.540 4.523 4.673 0.173 8 0 "[ . 1 . 2]" 1 1487 3 58 LYS HA 3 62 LEU H 4.150 . 6.500 3.971 3.829 4.128 . 0 0 "[ . 1 . 2]" 1 1488 3 40 ARG H 3 41 SER HA 4.150 . 6.500 5.229 5.155 5.258 . 0 0 "[ . 1 . 2]" 1 1489 3 31 PHE QD 3 31 PHE HZ 2.770 . 3.324 2.676 2.594 2.725 . 0 0 "[ . 1 . 2]" 1 1490 3 78 LYS HB3 3 81 TYR QD 4.069 . 4.883 2.942 2.848 3.095 . 0 0 "[ . 1 . 2]" 1 1491 3 62 LEU MD1 3 66 GLU QG 3.802 . 4.562 3.884 3.814 3.992 . 0 0 "[ . 1 . 2]" 1 1492 3 59 TRP HE3 3 62 LEU HA 5.359 . 6.431 4.835 4.690 4.965 . 0 0 "[ . 1 . 2]" 1 1493 3 28 TYR QE 3 31 PHE QE 4.124 . 4.949 4.543 4.069 4.748 . 0 0 "[ . 1 . 2]" 1 1494 3 28 TYR HA 3 59 TRP HZ2 3.546 . 4.255 3.638 3.420 3.763 . 0 0 "[ . 1 . 2]" 1 1495 3 80 ARG QB 3 81 TYR QD 3.629 . 4.355 4.464 4.396 4.611 0.256 11 0 "[ . 1 . 2]" 1 1496 3 30 PHE QB 3 74 ALA HA 3.652 . 4.382 4.611 4.560 4.642 0.260 17 0 "[ . 1 . 2]" 1 1497 3 77 ASP HA 3 80 ARG HD3 5.879 . 7.055 5.471 4.076 5.946 . 0 0 "[ . 1 . 2]" 1 1498 3 64 PRO HB3 3 67 LYS HG3 3.829 . 4.595 4.643 4.601 4.719 0.124 17 0 "[ . 1 . 2]" 1 1499 3 27 ALA MB 3 59 TRP HH2 2.845 . 3.414 2.589 2.338 2.866 . 0 0 "[ . 1 . 2]" 1 1500 3 27 ALA MB 3 59 TRP HZ2 3.032 . 3.638 2.226 1.923 2.985 . 0 0 "[ . 1 . 2]" 1 1501 3 27 ALA MB 3 30 PHE QE 3.118 . 3.742 3.631 3.397 3.795 0.053 5 0 "[ . 1 . 2]" 1 1502 3 27 ALA MB 3 30 PHE QD 2.957 . 3.548 3.278 3.070 3.347 . 0 0 "[ . 1 . 2]" 1 1503 3 59 TRP HZ2 3 60 LYS HG2 4.409 . 5.291 5.332 5.301 5.380 0.089 16 0 "[ . 1 . 2]" 1 1504 3 44 PRO HB2 3 44 PRO HD3 4.036 . 4.843 3.876 3.868 3.899 . 0 0 "[ . 1 . 2]" 1 1505 3 43 ASN HA 3 44 PRO HB2 5.543 . 6.652 5.129 5.073 5.249 . 0 0 "[ . 1 . 2]" 1 1506 3 20 ALA MB 3 88 TYR QE 3.073 . 3.688 3.781 3.688 3.895 0.207 17 0 "[ . 1 . 2]" 1 1507 3 31 PHE HZ 3 62 LEU MD1 3.309 . 3.971 2.678 2.297 2.783 . 0 0 "[ . 1 . 2]" 1 1508 3 31 PHE HZ 3 62 LEU MD2 3.735 . 4.482 3.525 3.324 3.675 . 0 0 "[ . 1 . 2]" 1 1509 3 31 PHE QD 3 70 TYR QD 3.720 . 4.464 3.470 3.330 3.647 . 0 0 "[ . 1 . 2]" 1 1510 3 25 LEU QD 3 30 PHE QE 3.849 . 4.619 2.225 2.016 2.649 . 0 0 "[ . 1 . 2]" 1 1511 3 30 PHE QD 3 73 LYS QD 3.065 . 3.678 3.053 2.728 3.614 . 0 0 "[ . 1 . 2]" 1 1512 3 25 LEU HB3 3 30 PHE QD 4.416 . 5.299 3.803 3.714 3.896 . 0 0 "[ . 1 . 2]" 1 1513 3 27 ALA MB 3 59 TRP HZ3 4.100 . 4.920 4.204 3.988 4.459 . 0 0 "[ . 1 . 2]" 1 1514 3 59 TRP HZ3 3 62 LEU MD2 4.998 . 5.998 5.105 4.985 5.394 . 0 0 "[ . 1 . 2]" 1 1515 3 31 PHE QD 3 62 LEU MD2 3.606 . 4.327 4.153 4.002 4.338 0.011 8 0 "[ . 1 . 2]" 1 1516 3 77 ASP HA 3 80 ARG QB 3.062 . 3.674 1.911 1.822 2.042 . 0 0 "[ . 1 . 2]" 1 1517 3 59 TRP HE3 3 62 LEU MD2 3.728 . 4.474 4.476 4.321 4.534 0.060 6 0 "[ . 1 . 2]" 1 1518 3 31 PHE HB3 3 59 TRP HE3 3.951 . 4.741 3.619 3.524 3.768 . 0 0 "[ . 1 . 2]" 1 1519 3 31 PHE HA 3 31 PHE QD 2.872 . 3.446 2.954 2.871 3.106 . 0 0 "[ . 1 . 2]" 1 1520 3 31 PHE HA 3 31 PHE QE 4.652 . 5.582 4.878 4.829 4.940 . 0 0 "[ . 1 . 2]" 1 1521 3 31 PHE HA 3 59 TRP HZ3 4.580 . 5.496 4.230 4.115 4.376 . 0 0 "[ . 1 . 2]" 1 1522 3 31 PHE HA 3 70 TYR QD 3.870 . 4.644 2.293 2.094 2.731 . 0 0 "[ . 1 . 2]" 1 1523 3 31 PHE QD 3 32 ALA HA 3.285 . 3.942 3.147 2.686 3.326 . 0 0 "[ . 1 . 2]" 1 1524 3 31 PHE QE 3 32 ALA HA 3.975 . 4.770 3.162 2.900 3.249 . 0 0 "[ . 1 . 2]" 1 1525 3 31 PHE HZ 3 59 TRP HZ3 3.789 . 4.547 2.309 2.198 2.446 . 0 0 "[ . 1 . 2]" 1 1526 3 31 PHE QD 3 59 TRP HZ3 3.070 . 3.684 2.609 2.493 2.766 . 0 0 "[ . 1 . 2]" 1 1527 3 31 PHE QD 3 59 TRP HH2 4.073 . 4.888 4.641 4.548 4.744 . 0 0 "[ . 1 . 2]" 1 1528 3 31 PHE QD 3 59 TRP HE3 3.132 . 3.758 2.781 2.742 2.820 . 0 0 "[ . 1 . 2]" 1 1529 3 28 TYR QD 3 31 PHE QD 4.273 . 5.128 4.201 4.010 4.384 . 0 0 "[ . 1 . 2]" 1 1530 3 31 PHE HZ 3 59 TRP HE3 4.723 . 5.668 3.231 3.072 3.351 . 0 0 "[ . 1 . 2]" 1 1531 3 92 LEU HA 3 92 LEU MD1 2.621 . 3.145 3.153 2.798 3.262 0.117 19 0 "[ . 1 . 2]" 1 1532 3 31 PHE HZ 3 55 LEU MD2 3.593 . 4.312 3.195 2.737 3.593 . 0 0 "[ . 1 . 2]" 1 1533 3 55 LEU MD1 3 55 LEU MD2 2.218 . 2.662 2.006 1.863 2.085 . 0 0 "[ . 1 . 2]" 1 1534 3 39 VAL HB 3 55 LEU MD2 3.471 . 4.165 3.543 2.316 4.263 0.098 9 0 "[ . 1 . 2]" 1 1535 3 30 PHE QD 3 73 LYS HB3 4.515 . 5.418 3.304 3.245 3.434 . 0 0 "[ . 1 . 2]" 1 1536 3 30 PHE QD 3 73 LYS HB2 4.279 . 5.135 4.270 4.094 4.476 . 0 0 "[ . 1 . 2]" 1 1537 3 30 PHE QE 3 73 LYS HB2 6.060 . 7.272 5.617 5.437 5.764 . 0 0 "[ . 1 . 2]" 1 1538 3 30 PHE QD 3 73 LYS HA 4.245 . 5.094 5.188 5.131 5.289 0.195 8 0 "[ . 1 . 2]" 1 1539 3 30 PHE QE 3 73 LYS HA 4.936 . 5.923 5.708 5.596 5.790 . 0 0 "[ . 1 . 2]" 1 1540 3 30 PHE QD 3 74 ALA HA 2.598 . 3.118 3.331 3.267 3.398 0.280 5 0 "[ . 1 . 2]" 1 1541 3 30 PHE QE 3 74 ALA MB 2.824 . 3.389 1.812 1.785 1.848 0.015 4 0 "[ . 1 . 2]" 1 1542 3 30 PHE QD 3 74 ALA MB 2.808 . 3.370 2.620 2.522 2.709 . 0 0 "[ . 1 . 2]" 1 1543 3 30 PHE QE 3 77 ASP QB 3.954 . 4.745 2.450 2.288 2.676 . 0 0 "[ . 1 . 2]" 1 1544 3 25 LEU QD 3 30 PHE HZ 4.247 . 5.096 3.430 3.294 3.697 . 0 0 "[ . 1 . 2]" 1 1545 3 59 TRP HZ2 3 67 LYS HA 4.123 . 4.948 5.119 5.053 5.182 0.234 5 0 "[ . 1 . 2]" 1 1546 3 31 PHE QD 3 66 GLU QB 4.452 . 5.342 5.248 5.085 5.397 0.055 4 0 "[ . 1 . 2]" 1 1547 3 28 TYR HA 3 31 PHE QD 3.812 . 4.574 2.898 2.748 3.211 . 0 0 "[ . 1 . 2]" 1 1548 3 28 TYR QE 3 31 PHE QD 3.915 . 4.698 4.679 4.435 4.808 0.110 16 0 "[ . 1 . 2]" 1 1549 3 31 PHE HZ 3 35 ASN HB2 3.652 . 4.382 3.106 2.865 3.352 . 0 0 "[ . 1 . 2]" 1 1550 3 36 ARG HA 3 51 VAL MG2 2.917 . 3.500 2.099 1.725 2.351 0.075 18 0 "[ . 1 . 2]" 1 1551 3 54 LYS HA 3 54 LYS QG 2.468 . 2.962 2.410 2.241 2.749 . 0 0 "[ . 1 . 2]" 1 1552 3 32 ALA HA 3 55 LEU MD2 2.884 . 3.461 2.197 1.796 3.373 0.004 12 0 "[ . 1 . 2]" 1 1553 3 39 VAL QG 3 51 VAL MG2 2.402 . 2.882 1.832 1.738 2.092 0.062 17 0 "[ . 1 . 2]" 1 1554 3 39 VAL HB 3 51 VAL MG2 3.062 . 3.674 2.986 2.273 3.839 0.165 17 0 "[ . 1 . 2]" 1 1555 3 39 VAL QG 3 51 VAL HB 2.632 . 3.158 3.124 2.669 3.435 0.277 1 0 "[ . 1 . 2]" 1 1556 3 59 TRP HB2 3 59 TRP HE3 3.944 . 4.733 3.048 2.920 3.128 . 0 0 "[ . 1 . 2]" 1 1557 3 30 PHE QB 3 30 PHE QD 2.651 . 3.181 2.126 2.121 2.131 . 0 0 "[ . 1 . 2]" 1 1558 3 30 PHE QD 3 33 ASN HB2 5.590 . 6.708 4.780 4.614 5.116 . 0 0 "[ . 1 . 2]" 1 1559 3 22 LYS QB 3 81 TYR QE 3.902 . 4.682 4.584 4.068 4.785 0.103 4 0 "[ . 1 . 2]" 1 1560 3 22 LYS HA 3 81 TYR QE 5.056 . 6.067 3.968 3.551 4.324 . 0 0 "[ . 1 . 2]" 1 1561 3 81 TYR QE 3 82 GLU HA 4.430 . 5.316 3.049 2.894 3.299 . 0 0 "[ . 1 . 2]" 1 1562 3 81 TYR QD 3 82 GLU HA 4.171 . 5.005 2.962 2.823 3.228 . 0 0 "[ . 1 . 2]" 1 1563 3 21 PRO HA 3 81 TYR QD 4.382 . 5.258 3.971 3.780 4.311 . 0 0 "[ . 1 . 2]" 1 1564 3 21 PRO HA 3 81 TYR QE 4.174 . 5.009 4.446 4.171 4.562 . 0 0 "[ . 1 . 2]" 1 1565 3 21 PRO HG3 3 81 TYR QD 2.917 . 3.500 2.141 2.134 2.145 . 0 0 "[ . 1 . 2]" 1 1566 3 21 PRO HG3 3 81 TYR QE 3.223 . 3.868 3.612 2.883 3.744 . 0 0 "[ . 1 . 2]" 1 1567 3 88 TYR HB3 3 88 TYR QE 3.479 . 4.175 4.386 4.374 4.425 0.250 17 0 "[ . 1 . 2]" 1 1568 3 21 PRO QD 3 88 TYR QE 3.441 . 4.129 3.179 2.937 3.412 . 0 0 "[ . 1 . 2]" 1 1569 3 21 PRO QD 3 88 TYR QD 3.097 . 3.716 2.443 2.039 2.708 . 0 0 "[ . 1 . 2]" 1 1570 3 20 ALA HA 3 88 TYR QE 3.511 . 4.213 3.250 3.155 3.394 . 0 0 "[ . 1 . 2]" 1 1571 3 31 PHE QD 3 59 TRP HA 4.595 . 5.514 3.977 3.818 4.214 . 0 0 "[ . 1 . 2]" 1 1572 3 31 PHE QE 3 59 TRP HA 4.770 . 5.724 2.887 2.758 3.065 . 0 0 "[ . 1 . 2]" 1 1573 3 59 TRP HH2 3 67 LYS HA 4.685 . 5.622 2.936 2.837 3.086 . 0 0 "[ . 1 . 2]" 1 1574 3 30 PHE QE 3 70 TYR HB2 4.601 . 5.521 5.567 5.522 5.625 0.104 16 0 "[ . 1 . 2]" 1 1575 3 30 PHE QD 3 70 TYR HB3 2.686 . 3.223 3.414 3.374 3.462 0.239 8 0 "[ . 1 . 2]" 1 1576 3 25 LEU HA 3 30 PHE QD 2.927 . 3.512 3.721 3.663 3.788 0.276 12 0 "[ . 1 . 2]" 1 1577 3 46 ILE HA 3 47 THR MG 2.566 . 3.079 2.153 1.911 2.431 . 0 0 "[ . 1 . 2]" 1 1578 3 40 ARG HA 3 46 ILE MG 2.874 . 3.449 3.276 2.934 3.512 0.063 20 0 "[ . 1 . 2]" 1 1579 3 28 TYR QD 3 59 TRP HD1 4.978 . 5.974 2.910 2.222 3.423 . 0 0 "[ . 1 . 2]" 1 1580 3 60 LYS HA 3 60 LYS HG3 2.595 . 3.114 3.047 2.815 3.150 0.036 8 0 "[ . 1 . 2]" 1 1581 3 59 TRP HD1 3 60 LYS HG3 3.646 . 4.375 2.438 2.155 2.663 . 0 0 "[ . 1 . 2]" 1 1582 3 59 TRP HB2 3 59 TRP HD1 3.844 . 4.613 3.550 3.500 3.627 . 0 0 "[ . 1 . 2]" 1 1583 3 59 TRP HB3 3 59 TRP HD1 3.763 . 4.516 2.555 2.549 2.564 . 0 0 "[ . 1 . 2]" 1 1584 3 44 PRO HA 3 44 PRO HB3 2.488 . 2.986 2.288 2.275 2.293 . 0 0 "[ . 1 . 2]" 1 1585 3 73 LYS HA 3 73 LYS QD 3.178 . 3.814 3.613 3.042 3.857 0.043 8 0 "[ . 1 . 2]" 1 1586 3 85 LYS HA 3 85 LYS HB2 2.677 . 3.212 2.270 2.190 2.410 . 0 0 "[ . 1 . 2]" 1 1587 3 89 ASN HA 3 92 LEU MD1 5.705 . 6.846 3.454 3.314 3.809 . 0 0 "[ . 1 . 2]" 1 1588 3 59 TRP HZ3 3 70 TYR HB2 5.180 . 6.216 3.604 3.571 3.650 . 0 0 "[ . 1 . 2]" 1 1589 3 59 TRP HZ2 3 70 TYR HB2 5.822 . 6.986 4.776 4.388 5.159 . 0 0 "[ . 1 . 2]" 1 1590 3 37 ASP HA 3 40 ARG QD 3.515 . 4.218 4.105 3.373 4.323 0.105 20 0 "[ . 1 . 2]" 1 1591 3 31 PHE HB2 3 31 PHE QD 3.132 . 3.758 2.427 2.365 2.456 . 0 0 "[ . 1 . 2]" 1 1592 3 75 GLN HA 3 75 GLN QG 3.753 . 4.504 2.608 2.451 3.326 . 0 0 "[ . 1 . 2]" 1 1593 3 31 PHE HA 3 34 GLU QB 3.920 . 4.704 3.172 2.810 3.517 . 0 0 "[ . 1 . 2]" 1 1594 3 59 TRP HD1 3 60 LYS QB 4.579 . 5.495 4.021 3.702 4.217 . 0 0 "[ . 1 . 2]" 1 1595 3 57 GLU HA 3 59 TRP HD1 5.887 . 7.064 5.973 5.745 6.214 . 0 0 "[ . 1 . 2]" 1 1596 3 59 TRP HZ3 3 70 TYR HB3 3.739 . 4.487 4.583 4.506 4.641 0.154 16 0 "[ . 1 . 2]" 1 1597 3 27 ALA HA 3 59 TRP HZ2 5.026 . 6.031 4.769 4.254 5.616 . 0 0 "[ . 1 . 2]" 1 1598 3 59 TRP HZ2 3 70 TYR HB3 6.774 . 8.129 6.364 5.945 6.719 . 0 0 "[ . 1 . 2]" 1 1599 3 28 TYR QD 3 59 TRP HB2 5.215 . 6.258 4.236 3.967 4.483 . 0 0 "[ . 1 . 2]" 1 1600 3 86 GLU HA 3 89 ASN QB 5.549 . 6.659 4.404 3.732 4.938 . 0 0 "[ . 1 . 2]" 1 1601 3 59 TRP HD1 3 60 LYS HG2 3.840 . 4.608 3.763 3.521 3.937 . 0 0 "[ . 1 . 2]" 1 1602 3 51 VAL MG2 3 55 LEU HB2 3.460 . 4.152 2.081 1.933 2.490 . 0 0 "[ . 1 . 2]" 1 1603 3 87 LEU QD 3 88 TYR HB3 3.712 . 4.454 4.101 3.480 4.452 . 0 0 "[ . 1 . 2]" 1 1604 3 73 LYS QD 3 73 LYS HG3 2.616 . 3.139 2.235 2.142 2.371 . 0 0 "[ . 1 . 2]" 1 1605 3 31 PHE QE 3 59 TRP HE3 3.837 . 4.604 2.943 2.823 3.016 . 0 0 "[ . 1 . 2]" 1 1606 3 59 TRP HH2 3 67 LYS QD 4.290 . 5.148 3.010 2.725 3.618 . 0 0 "[ . 1 . 2]" 1 1607 3 59 TRP HH2 3 67 LYS HB3 3.674 . 4.409 1.987 1.850 2.549 . 0 0 "[ . 1 . 2]" 1 1608 3 59 TRP HZ2 3 67 LYS HB3 3.771 . 4.525 3.324 3.176 3.625 . 0 0 "[ . 1 . 2]" 1 1609 3 31 PHE QD 3 55 LEU HA 6.245 . 7.494 5.924 5.409 6.330 . 0 0 "[ . 1 . 2]" 1 1610 3 18 PRO HA 3 88 TYR QE 3.490 . 4.188 3.821 3.458 3.971 . 0 0 "[ . 1 . 2]" 1 1611 3 18 PRO HA 3 88 TYR QD 2.594 . 3.113 2.664 2.441 2.836 . 0 0 "[ . 1 . 2]" 1 1612 3 66 GLU QB 3 70 TYR QE 3.365 . 4.038 3.300 3.179 3.344 . 0 0 "[ . 1 . 2]" 1 1613 3 31 PHE HZ 3 35 ASN HB2 3.790 . 4.548 4.521 3.505 4.894 0.346 6 0 "[ . 1 . 2]" 1 1614 3 31 PHE QD 3 70 TYR HB3 4.169 . 5.003 4.683 4.572 4.868 . 0 0 "[ . 1 . 2]" 1 1615 3 59 TRP HZ2 3 67 LYS HB3 3.842 . 4.610 3.355 3.198 3.655 . 0 0 "[ . 1 . 2]" 1 1616 3 31 PHE QE 3 59 TRP HB2 4.199 . 5.039 1.869 1.824 1.965 . 0 0 "[ . 1 . 2]" 1 1617 3 31 PHE QD 3 34 GLU QB 5.503 . 6.604 3.905 3.737 3.967 . 0 0 "[ . 1 . 2]" 1 1618 3 86 GLU HA 3 86 GLU HG3 3.839 . 4.607 3.612 3.493 3.861 . 0 0 "[ . 1 . 2]" 1 1619 3 27 ALA MB 3 31 PHE QD 6.748 . 8.098 5.158 5.033 5.400 . 0 0 "[ . 1 . 2]" 1 1620 3 31 PHE HB3 3 59 TRP HH2 4.699 . 5.639 3.971 3.823 4.077 . 0 0 "[ . 1 . 2]" 1 1621 3 31 PHE HB3 3 59 TRP HZ2 4.120 . 4.944 4.811 4.470 4.949 0.005 8 0 "[ . 1 . 2]" 1 1622 3 46 ILE QG 3 51 VAL HA 3.351 . 4.021 3.838 3.185 4.635 0.614 2 2 "[ + . - 1 . 2]" 1 1623 3 31 PHE QD 3 55 LEU HG 6.424 . 7.709 6.283 5.620 7.036 . 0 0 "[ . 1 . 2]" 1 1624 3 81 TYR QE 3 82 GLU HG3 6.065 . 7.278 4.521 4.393 4.958 . 0 0 "[ . 1 . 2]" 1 1625 3 31 PHE QD 3 62 LEU HA 5.852 . 7.022 4.461 4.259 4.858 . 0 0 "[ . 1 . 2]" 1 1626 3 30 PHE QE 3 77 ASP HA 5.718 . 6.862 4.808 4.671 5.091 . 0 0 "[ . 1 . 2]" 1 1627 3 27 ALA HA 3 59 TRP HH2 4.150 . 6.500 4.556 4.342 4.971 . 0 0 "[ . 1 . 2]" 1 1628 3 32 ALA MB 3 55 LEU HA 5.321 . 6.385 5.625 4.973 6.152 . 0 0 "[ . 1 . 2]" 1 1629 3 25 LEU HB3 3 30 PHE HA 5.361 . 6.433 4.789 4.633 4.920 . 0 0 "[ . 1 . 2]" 1 1630 3 81 TYR QE 3 82 GLU HB2 5.855 . 7.026 3.702 3.508 4.046 . 0 0 "[ . 1 . 2]" 1 1631 3 31 PHE HZ 3 59 TRP HH2 4.150 . 6.500 3.889 3.815 3.949 . 0 0 "[ . 1 . 2]" 1 1632 3 81 TYR QD 3 82 GLU HB3 4.146 . 4.975 4.166 3.999 4.380 . 0 0 "[ . 1 . 2]" 1 1633 3 31 PHE QD 3 59 TRP HZ2 4.650 . 7.500 5.529 5.461 5.639 . 0 0 "[ . 1 . 2]" 1 1634 3 45 ASP HA 3 47 THR MG 4.150 . 6.500 5.768 4.535 6.619 0.119 20 0 "[ . 1 . 2]" 1 1635 3 85 LYS HA 3 88 TYR QE 4.521 . 5.425 5.497 5.456 5.623 0.198 17 0 "[ . 1 . 2]" 1 1636 3 74 ALA MB 3 77 ASP HA 4.150 . 6.500 6.468 6.201 6.572 0.072 16 0 "[ . 1 . 2]" 1 1637 3 27 ALA HA 3 30 PHE QE 4.150 . 6.500 1.883 1.777 2.049 0.023 12 0 "[ . 1 . 2]" 1 1638 3 30 PHE QE 3 73 LYS HB3 4.535 . 5.442 4.188 4.146 4.250 . 0 0 "[ . 1 . 2]" 1 1639 3 25 LEU QD 3 30 PHE QD 4.875 . 5.500 2.683 2.458 2.981 . 0 0 "[ . 1 . 2]" 1 1640 3 25 LEU HA 3 30 PHE QE 3.857 . 4.628 3.974 3.905 4.060 . 0 0 "[ . 1 . 2]" 1 1641 3 59 TRP HE3 3 70 TYR QD 4.733 . 5.680 4.438 4.292 4.675 . 0 0 "[ . 1 . 2]" 1 1642 3 59 TRP HZ3 3 70 TYR QD 3.471 . 4.165 2.063 1.899 2.372 . 0 0 "[ . 1 . 2]" 1 1643 3 59 TRP HH2 3 70 TYR QD 3.297 . 3.956 2.103 2.010 2.308 . 0 0 "[ . 1 . 2]" 1 1644 3 59 TRP HZ3 3 71 GLU HB3 4.150 . 6.500 6.525 6.436 6.578 0.078 11 0 "[ . 1 . 2]" 1 1645 3 80 ARG HG3 3 81 TYR QD 3.915 . 4.698 3.137 2.829 3.654 . 0 0 "[ . 1 . 2]" 1 1646 3 23 ARG HG3 3 81 TYR QE 3.650 . 5.000 5.119 5.012 5.189 0.189 3 0 "[ . 1 . 2]" 1 1647 3 24 ALA MB 3 30 PHE QE 3.691 . 4.429 4.453 3.705 4.672 0.243 15 0 "[ . 1 . 2]" 1 1648 3 39 VAL HA 3 51 VAL MG2 4.243 . 5.092 2.257 1.835 2.823 . 0 0 "[ . 1 . 2]" 1 1649 3 25 LEU QB 3 30 PHE QE 3.211 . 3.853 1.916 1.792 2.076 0.008 18 0 "[ . 1 . 2]" 1 1650 3 25 LEU HB3 3 25 LEU QD 3.062 . 3.674 2.021 1.903 2.177 . 0 0 "[ . 1 . 2]" 1 1651 3 25 LEU QD 3 29 MET HG3 3.984 . 4.781 2.635 2.518 2.850 . 0 0 "[ . 1 . 2]" 1 1652 3 28 TYR QD 3 29 MET HG3 3.878 . 4.654 4.592 4.329 4.712 0.058 20 0 "[ . 1 . 2]" 1 1653 3 28 TYR HB3 3 59 TRP HD1 5.754 . 6.905 6.142 5.325 6.881 . 0 0 "[ . 1 . 2]" 1 1654 3 28 TYR HB2 3 31 PHE QD 4.882 . 5.858 4.900 4.799 5.071 . 0 0 "[ . 1 . 2]" 1 1655 3 81 TYR QE 3 85 LYS HA 4.524 . 5.429 4.813 4.407 5.191 . 0 0 "[ . 1 . 2]" 1 1656 3 23 ARG HG2 3 81 TYR QE 3.650 . 5.000 3.227 3.061 3.607 . 0 0 "[ . 1 . 2]" 1 1657 3 24 ALA MB 3 81 TYR QD 3.233 . 3.880 3.011 2.705 3.899 0.019 8 0 "[ . 1 . 2]" 1 1658 3 85 LYS QG 3 88 TYR QD 3.629 . 4.355 4.064 3.598 4.412 0.057 19 0 "[ . 1 . 2]" 1 1659 2 14 DC H1' 2 14 DC H2'' 2.400 . 3.000 2.189 2.185 2.192 . 0 0 "[ . 1 . 2]" 1 1660 2 13 DC H1' 2 13 DC H6 3.625 3.000 4.250 3.714 3.702 3.719 . 0 0 "[ . 1 . 2]" 1 1661 2 14 DC H2' 2 14 DC H6 2.400 . 3.000 2.724 2.640 2.799 . 0 0 "[ . 1 . 2]" 1 1662 2 13 DC H2' 2 14 DC H6 2.400 . 3.000 2.989 2.757 3.041 0.041 3 0 "[ . 1 . 2]" 1 1663 2 13 DC H1' 2 13 DC H2' 2.400 . 3.000 2.927 2.922 2.935 . 0 0 "[ . 1 . 2]" 1 1664 2 13 DC H1' 2 13 DC H2'' 2.400 . 3.000 2.255 2.247 2.266 . 0 0 "[ . 1 . 2]" 1 1665 2 11 DA H1' 2 11 DA H2'' 2.400 . 3.000 2.381 2.314 2.400 . 0 0 "[ . 1 . 2]" 1 1666 2 8 DA H2' 2 8 DA H8 2.400 . 3.000 2.251 2.139 2.397 . 0 0 "[ . 1 . 2]" 1 1667 2 8 DA H1' 2 8 DA H2' 2.400 . 3.000 3.000 2.985 3.030 0.030 11 0 "[ . 1 . 2]" 1 1668 2 8 DA H1' 2 8 DA H2'' 2.400 . 3.000 2.329 2.307 2.405 . 0 0 "[ . 1 . 2]" 1 1669 2 1 DC H2' 2 2 DT H6 2.400 . 3.000 2.298 2.227 2.347 . 0 0 "[ . 1 . 2]" 1 1670 2 2 DT H2' 2 2 DT H6 2.400 . 3.000 2.393 2.040 2.576 . 0 0 "[ . 1 . 2]" 1 1671 2 1 DC H5'' 2 1 DC H6 3.625 3.000 4.250 3.991 3.929 4.260 0.010 7 0 "[ . 1 . 2]" 1 1672 2 2 DT H1' 2 2 DT H4' 3.625 3.000 4.250 3.184 3.013 3.323 . 0 0 "[ . 1 . 2]" 1 1673 2 14 DC H3' 2 14 DC H6 3.625 3.000 4.250 3.178 2.985 3.363 0.015 6 0 "[ . 1 . 2]" 1 1674 2 10 DC H3' 2 10 DC H6 3.625 3.000 4.250 4.104 3.779 4.268 0.018 10 0 "[ . 1 . 2]" 1 1675 2 13 DC H3' 2 13 DC H6 2.400 . 3.000 3.004 2.968 3.035 0.035 20 0 "[ . 1 . 2]" 1 1676 2 4 DA H1' 2 4 DA H8 3.625 3.000 4.250 3.865 3.850 3.870 . 0 0 "[ . 1 . 2]" 1 1677 2 2 DT H3' 2 2 DT H6 2.400 . 3.000 2.694 2.534 2.786 . 0 0 "[ . 1 . 2]" 1 1678 2 4 DA H2'' 2 4 DA H8 3.625 3.000 4.250 4.064 3.982 4.098 . 0 0 "[ . 1 . 2]" 1 1679 2 7 DA H2'' 2 7 DA H8 3.625 3.000 4.250 3.977 3.880 4.048 . 0 0 "[ . 1 . 2]" 1 1680 2 13 DC H1' 2 13 DC H4' 3.625 3.000 4.250 3.169 3.018 3.245 . 0 0 "[ . 1 . 2]" 1 1681 2 4 DA H1' 2 4 DA H2' 2.400 . 3.000 2.877 2.866 2.883 . 0 0 "[ . 1 . 2]" 1 1682 2 5 DA H2' 2 5 DA H8 2.400 . 3.000 2.812 2.403 2.910 . 0 0 "[ . 1 . 2]" 1 1683 2 5 DA H2'' 2 5 DA H8 3.625 3.000 4.250 4.228 3.966 4.298 0.048 6 0 "[ . 1 . 2]" 1 1684 2 9 DT H1' 2 9 DT H3' 3.625 3.000 4.250 3.977 3.959 4.035 . 0 0 "[ . 1 . 2]" 1 1685 2 9 DT H1' 2 9 DT H4' 3.625 3.000 4.250 3.024 2.878 3.603 0.122 16 0 "[ . 1 . 2]" 1 1686 2 9 DT H4' 2 9 DT H6 3.625 3.000 4.250 4.485 4.369 4.656 0.406 19 0 "[ . 1 . 2]" 1 1687 2 2 DT H4' 2 2 DT H6 3.625 3.000 4.250 4.276 4.193 4.487 0.237 7 0 "[ . 1 . 2]" 1 1688 2 12 DC H1' 2 13 DC H6 3.625 3.000 4.250 4.326 4.257 4.550 0.300 18 0 "[ . 1 . 2]" 1 1689 2 13 DC H3' 2 14 DC H6 3.625 3.000 4.250 4.522 4.469 4.539 0.289 1 0 "[ . 1 . 2]" 1 1690 2 12 DC H3' 2 13 DC H6 3.625 3.000 4.250 4.423 4.350 4.459 0.209 2 0 "[ . 1 . 2]" 1 1691 2 11 DA H1' 2 11 DA H4' 3.625 3.000 4.250 3.411 2.897 3.646 0.103 10 0 "[ . 1 . 2]" 1 1692 2 4 DA H4' 2 4 DA H8 3.625 3.000 4.250 4.532 4.519 4.565 0.315 17 0 "[ . 1 . 2]" 1 1693 2 5 DA H4' 2 5 DA H8 3.625 3.000 4.250 4.508 4.482 4.566 0.316 17 0 "[ . 1 . 2]" 1 1694 2 9 DT H1' 2 10 DC H5' 2.536 2.282 2.790 2.366 2.126 2.905 0.156 10 0 "[ . 1 . 2]" 1 1695 2 11 DA H1' 2 11 DA H5'' 2.545 2.290 2.800 2.743 2.216 2.867 0.074 18 0 "[ . 1 . 2]" 1 1696 2 14 DC H1' 2 15 DC H5' 3.625 3.000 4.250 3.611 3.520 3.687 . 0 0 "[ . 1 . 2]" 1 1697 2 1 DC H1' 2 1 DC H6 1.822 . 2.004 2.404 2.400 2.418 0.414 7 0 "[ . 1 . 2]" 1 1698 2 6 DC H5 2 6 DC H6 2.024 . 2.226 2.375 2.342 2.386 0.160 16 0 "[ . 1 . 2]" 1 1699 2 12 DC H5 2 12 DC H6 2.015 . 2.217 2.397 2.385 2.418 0.201 16 0 "[ . 1 . 2]" 1 1700 2 13 DC H5 2 13 DC H6 1.883 . 2.071 2.378 2.370 2.391 0.320 16 0 "[ . 1 . 2]" 1 1701 2 14 DC H5 2 14 DC H6 1.882 . 2.070 2.433 2.428 2.437 0.367 15 0 "[ . 1 . 2]" 1 1702 2 15 DC H5 2 15 DC H6 1.957 . 2.153 2.355 2.351 2.360 0.207 20 0 "[ . 1 . 2]" 1 1703 2 10 DC H1' 2 10 DC H2'' 2.324 2.092 2.556 2.282 2.256 2.308 . 0 0 "[ . 1 . 2]" 1 1704 2 5 DA H1' 2 5 DA H2'' 2.435 2.191 2.679 2.238 2.220 2.310 . 0 0 "[ . 1 . 2]" 1 1705 2 14 DC H1' 2 14 DC H6 2.807 2.526 3.088 3.561 3.546 3.573 0.485 6 0 "[ . 1 . 2]" 1 1706 2 14 DC H2'' 2 15 DC H6 2.725 2.452 2.998 2.363 2.356 2.379 0.096 2 0 "[ . 1 . 2]" 1 1707 2 15 DC H1' 2 15 DC Q2' 1.955 . 2.151 2.165 2.165 2.166 0.015 1 0 "[ . 1 . 2]" 1 1708 2 14 DC H1' 2 14 DC H2' 2.349 2.114 2.584 2.822 2.802 2.842 0.258 20 0 "[ . 1 . 2]" 1 1709 2 13 DC H2' 2 13 DC H6 1.800 . 1.980 2.109 2.094 2.151 0.171 18 0 "[ . 1 . 2]" 1 1710 2 12 DC H2'' 2 13 DC H6 2.346 2.111 2.581 2.446 2.339 2.629 0.048 18 0 "[ . 1 . 2]" 1 1711 2 12 DC H2' 2 12 DC H6 2.223 2.001 2.445 1.936 1.898 1.971 0.103 19 0 "[ . 1 . 2]" 1 1712 2 12 DC H2'' 2 12 DC H6 2.864 2.578 3.150 3.497 3.466 3.520 0.370 3 0 "[ . 1 . 2]" 1 1713 2 12 DC H1' 2 12 DC H2' 2.562 2.306 2.818 2.937 2.934 2.945 0.127 17 0 "[ . 1 . 2]" 1 1714 2 12 DC H1' 2 12 DC H2'' 2.048 . 2.253 2.217 2.209 2.242 . 0 0 "[ . 1 . 2]" 1 1715 2 11 DA H1' 2 12 DC H6 2.983 2.685 3.281 2.644 2.354 3.018 0.331 10 0 "[ . 1 . 2]" 1 1716 2 9 DT H2' 2 10 DC H6 1.891 . 2.080 1.950 1.841 2.070 . 0 0 "[ . 1 . 2]" 1 1717 2 10 DC H1' 2 10 DC H2' 2.696 2.426 2.966 3.000 2.979 3.020 0.054 15 0 "[ . 1 . 2]" 1 1718 2 11 DA H2'' 2 12 DC H5 3.142 2.828 3.456 3.194 2.769 3.468 0.059 10 0 "[ . 1 . 2]" 1 1719 2 13 DC H2'' 2 14 DC H5 2.722 2.450 2.994 3.044 3.024 3.095 0.101 6 0 "[ . 1 . 2]" 1 1720 2 13 DC H2' 2 14 DC H5 2.623 2.361 2.885 2.651 2.326 2.786 0.035 6 0 "[ . 1 . 2]" 1 1721 2 9 DT H6 2 9 DT M7 2.078 . 2.286 2.274 2.237 2.293 0.007 4 0 "[ . 1 . 2]" 1 1722 2 6 DC H2' 2 6 DC H6 2.114 . 2.325 2.213 2.049 2.284 . 0 0 "[ . 1 . 2]" 1 1723 2 9 DT H1' 2 9 DT H2' 2.893 2.604 3.182 2.949 2.891 2.965 . 0 0 "[ . 1 . 2]" 1 1724 2 8 DA H1' 2 8 DA H8 3.539 3.185 3.893 3.831 3.801 3.841 . 0 0 "[ . 1 . 2]" 1 1725 2 5 DA H1' 2 6 DC H6 3.244 2.920 3.568 3.715 3.636 3.769 0.201 11 0 "[ . 1 . 2]" 1 1726 2 2 DT H6 2 2 DT M7 1.800 . 1.980 2.104 2.100 2.113 0.133 18 0 "[ . 1 . 2]" 1 1727 2 1 DC H1' 2 2 DT H6 3.400 3.060 3.740 3.948 3.933 3.987 0.247 7 0 "[ . 1 . 2]" 1 1728 2 1 DC H2'' 2 2 DT H6 2.597 2.337 2.857 2.124 2.045 2.145 0.292 18 0 "[ . 1 . 2]" 1 1729 2 2 DT H1' 2 2 DT H2' 2.489 2.240 2.738 2.866 2.856 2.883 0.145 10 0 "[ . 1 . 2]" 1 1730 2 1 DC H6 2 2 DT M7 2.559 2.303 2.815 2.684 2.597 2.939 0.124 18 0 "[ . 1 . 2]" 1 1731 2 1 DC H2' 2 1 DC H6 2.067 . 2.274 2.208 2.182 2.276 0.002 18 0 "[ . 1 . 2]" 1 1732 2 1 DC H1' 2 1 DC H2' 2.492 2.243 2.741 2.877 2.856 2.884 0.143 11 0 "[ . 1 . 2]" 1 1733 2 1 DC H1' 2 1 DC H2'' 1.961 . 2.157 2.179 2.163 2.200 0.043 11 0 "[ . 1 . 2]" 1 1734 2 3 DG H1' 2 4 DA H8 3.393 3.054 3.732 3.804 3.777 3.830 0.098 11 0 "[ . 1 . 2]" 1 1735 2 5 DA H1' 2 5 DA H2' 2.523 2.271 2.775 2.927 2.844 2.965 0.190 7 0 "[ . 1 . 2]" 1 1736 2 7 DA H1' 2 7 DA H8 3.529 3.176 3.882 3.899 3.887 3.906 0.024 1 0 "[ . 1 . 2]" 1 1737 2 3 DG H1' 2 3 DG H4' 2.552 2.297 2.807 3.023 2.993 3.111 0.304 10 0 "[ . 1 . 2]" 1 1738 2 1 DC H1' 2 1 DC H4' 2.631 2.368 2.894 3.251 3.115 3.282 0.388 16 0 "[ . 1 . 2]" 1 1739 2 1 DC H1' 2 2 DT H5' 2.275 2.047 2.503 2.652 2.137 2.810 0.307 12 0 "[ . 1 . 2]" 1 1740 2 1 DC H5' 2 1 DC H6 2.562 2.306 2.818 2.907 2.860 3.157 0.339 14 0 "[ . 1 . 2]" 1 1741 2 14 DC H1' 2 14 DC H3' 3.224 2.902 3.546 3.919 3.917 3.921 0.375 6 0 "[ . 1 . 2]" 1 1742 2 14 DC H1' 2 14 DC H4' 2.187 . 2.406 3.157 3.144 3.186 0.780 14 20 [***-*********+******] 1 1743 2 1 DC H3' 2 1 DC H6 2.359 2.123 2.595 2.701 2.498 2.762 0.167 10 0 "[ . 1 . 2]" 1 1744 2 1 DC H4' 2 1 DC H6 3.218 2.896 3.540 3.961 3.941 4.032 0.492 7 0 "[ . 1 . 2]" 1 1745 2 15 DC H3' 2 15 DC H6 2.364 2.128 2.600 2.783 2.766 2.795 0.195 3 0 "[ . 1 . 2]" 1 1746 2 12 DC H3' 2 12 DC H6 2.915 2.623 3.207 3.242 3.169 3.427 0.220 16 0 "[ . 1 . 2]" 1 1747 2 11 DA H3' 2 11 DA H8 2.736 2.462 3.010 3.545 3.501 3.585 0.575 15 19 "[-* ***********+*****]" 1 1748 2 6 DC H3' 2 6 DC H6 2.706 2.435 2.977 3.109 3.080 3.144 0.167 13 0 "[ . 1 . 2]" 1 1749 2 1 DC H3' 2 2 DT M7 2.517 2.265 2.769 2.760 2.691 2.841 0.072 11 0 "[ . 1 . 2]" 1 1750 2 10 DC H1' 2 10 DC H3' 2.955 2.659 3.251 3.872 3.820 3.926 0.675 6 20 [*****+**-***********] 1 1751 2 4 DA H3' 2 4 DA H8 2.853 2.568 3.138 3.173 3.155 3.241 0.103 17 0 "[ . 1 . 2]" 1 1752 2 5 DA H1' 2 5 DA H4' 3.092 2.783 3.401 3.455 3.285 3.482 0.081 11 0 "[ . 1 . 2]" 1 1753 2 5 DA H1' 2 6 DC H5' 2.689 2.420 2.958 2.699 2.222 2.936 0.198 17 0 "[ . 1 . 2]" 1 1754 2 12 DC H2' 2 12 DC H5 3.488 3.139 3.837 4.009 3.990 4.033 0.196 18 0 "[ . 1 . 2]" 1 1755 2 3 DG H1' 2 4 DA H5' 2.621 2.359 2.883 3.019 3.009 3.034 0.151 15 0 "[ . 1 . 2]" 1 1756 2 15 DC H1' 2 15 DC H4' 2.750 2.475 3.025 3.447 3.445 3.449 0.424 5 0 "[ . 1 . 2]" 1 1757 2 12 DC H1' 2 12 DC H3' 3.276 2.948 3.604 3.901 3.863 3.911 0.307 3 0 "[ . 1 . 2]" 1 1758 2 8 DA H1' 2 8 DA H3' 2.960 2.664 3.256 3.814 3.754 3.868 0.612 13 18 "[*********- *+***** *]" 1 1759 2 14 DC H1' 2 15 DC H6 3.959 3.563 4.355 4.540 4.524 4.558 0.203 13 0 "[ . 1 . 2]" 1 1760 2 13 DC H1' 2 14 DC H6 2.671 2.404 2.938 3.013 2.986 3.054 0.116 16 0 "[ . 1 . 2]" 1 1761 2 12 DC H1' 2 12 DC H6 3.505 3.154 3.856 3.671 3.644 3.683 . 0 0 "[ . 1 . 2]" 1 1762 2 9 DT H1' 2 9 DT H6 3.453 3.108 3.798 3.695 3.667 3.750 . 0 0 "[ . 1 . 2]" 1 1763 2 7 DA H1' 2 8 DA H8 3.505 3.154 3.856 3.777 3.449 3.907 0.051 16 0 "[ . 1 . 2]" 1 1764 2 14 DC H3' 2 15 DC H6 2.961 2.665 3.257 3.554 3.531 3.580 0.323 6 0 "[ . 1 . 2]" 1 1765 2 1 DC H3' 2 2 DT H6 3.300 2.970 3.630 3.695 3.486 3.765 0.135 8 0 "[ . 1 . 2]" 1 1766 2 11 DA H3' 2 12 DC H6 3.997 3.597 4.397 4.799 4.742 4.830 0.433 1 0 "[ . 1 . 2]" 1 1767 2 11 DA H1' 2 11 DA H2 3.445 3.100 3.790 4.264 4.238 4.283 0.493 19 0 "[ . 1 . 2]" 1 1768 2 5 DA H1' 2 5 DA H2 3.574 3.217 3.931 4.281 4.238 4.295 0.364 5 0 "[ . 1 . 2]" 1 1769 2 12 DC H6 2 13 DC H5 3.773 3.396 4.150 3.663 3.235 4.105 0.161 18 0 "[ . 1 . 2]" 1 1770 2 10 DC H2'' 2 11 DA H8 3.417 3.075 3.759 3.020 2.762 3.582 0.313 13 0 "[ . 1 . 2]" 1 1771 2 11 DA H2'' 2 12 DC H6 2.744 2.470 3.018 2.135 2.061 2.172 0.409 13 0 "[ . 1 . 2]" 1 1772 2 11 DA H2' 2 12 DC H6 3.824 3.442 4.206 3.268 3.110 3.538 0.332 18 0 "[ . 1 . 2]" 1 1773 2 8 DA H3' 2 9 DT H6 3.997 3.597 4.397 4.782 4.704 4.864 0.467 13 0 "[ . 1 . 2]" 1 1774 2 1 DC H6 2 2 DT H6 3.951 3.556 4.346 4.456 4.382 4.508 0.162 18 0 "[ . 1 . 2]" 1 1775 2 8 DA H8 2 9 DT H6 3.870 3.483 4.257 4.488 4.410 4.659 0.402 11 0 "[ . 1 . 2]" 1 1776 2 1 DC H2'' 2 1 DC H3' 2.514 2.263 2.765 2.821 2.810 2.873 0.108 18 0 "[ . 1 . 2]" 1 1777 2 1 DC H2' 2 1 DC H3' 1.836 . 2.020 2.176 2.163 2.182 0.162 2 0 "[ . 1 . 2]" 1 1778 2 15 DC Q2' 2 15 DC H3' 2.083 . 2.291 2.146 2.143 2.149 . 0 0 "[ . 1 . 2]" 1 1779 2 4 DA H2' 2 4 DA H3' 1.994 . 2.193 2.229 2.222 2.243 0.050 16 0 "[ . 1 . 2]" 1 1780 2 4 DA H2'' 2 4 DA H3' 2.768 2.491 3.045 2.873 2.864 2.893 . 0 0 "[ . 1 . 2]" 1 1781 2 3 DG Q2' 2 3 DG H3' 1.948 . 2.143 2.196 2.193 2.199 0.056 14 0 "[ . 1 . 2]" 1 1782 2 4 DA H1' 2 4 DA H4' 2.743 2.469 3.017 3.332 3.308 3.360 0.343 11 0 "[ . 1 . 2]" 1 1783 2 8 DA H1' 2 8 DA H4' 2.525 2.272 2.778 3.078 3.038 3.204 0.426 19 0 "[ . 1 . 2]" 1 1784 2 15 DC H5 2 15 DC Q5' 3.456 3.110 3.802 4.091 4.078 4.098 0.296 19 0 "[ . 1 . 2]" 1 1785 2 13 DC H1' 2 14 DC H5' 2.770 2.493 3.047 3.037 2.754 3.074 0.027 8 0 "[ . 1 . 2]" 1 1786 2 15 DC H5'' 2 15 DC H6 3.029 2.726 3.332 3.563 3.555 3.569 0.237 6 0 "[ . 1 . 2]" 1 1787 2 14 DC Q5' 2 14 DC H6 2.944 2.650 3.238 3.178 2.978 3.252 0.014 20 0 "[ . 1 . 2]" 1 1788 2 8 DA Q5' 2 8 DA H8 3.419 3.077 3.761 3.774 3.669 3.828 0.067 13 0 "[ . 1 . 2]" 1 1789 2 14 DC H2'' 2 15 DC H1' 5.000 . 5.500 4.542 4.503 4.565 . 0 0 "[ . 1 . 2]" 1 1790 2 11 DA H1' 2 11 DA H8 3.523 3.171 3.875 3.864 3.843 3.881 0.006 1 0 "[ . 1 . 2]" 1 1791 2 12 DC H2'' 2 12 DC H5 4.739 4.265 5.213 5.426 5.369 5.441 0.228 3 0 "[ . 1 . 2]" 1 1792 2 11 DA H4' 2 11 DA H8 4.875 4.250 5.500 4.838 4.609 5.146 . 0 0 "[ . 1 . 2]" 1 1793 2 9 DT H1' 2 9 DT H5' 4.043 3.639 4.447 4.468 4.335 4.541 0.094 6 0 "[ . 1 . 2]" 1 1794 2 9 DT H2' 2 9 DT H6 2.400 . 3.000 2.238 2.042 2.437 . 0 0 "[ . 1 . 2]" 1 1795 2 10 DC H5 2 10 DC H6 2.061 . 2.267 2.409 2.393 2.429 0.162 8 0 "[ . 1 . 2]" 1 1796 2 15 DC Q2' 2 15 DC H5 4.875 4.250 5.500 4.107 4.103 4.111 0.147 13 0 "[ . 1 . 2]" 1 1797 2 3 DG Q2' 2 3 DG H8 3.366 3.029 3.703 2.782 2.723 2.801 0.306 18 0 "[ . 1 . 2]" 1 1798 2 10 DC H2'' 2 10 DC H6 5.000 . 5.500 3.248 2.880 3.680 . 0 0 "[ . 1 . 2]" 1 1799 2 6 DC H1' 2 6 DC H6 4.473 4.026 4.920 3.780 3.774 3.789 0.252 8 0 "[ . 1 . 2]" 1 1800 2 6 DC H2'' 2 6 DC H6 5.000 . 5.500 3.776 3.645 3.833 . 0 0 "[ . 1 . 2]" 1 1801 2 9 DT H2'' 2 10 DC H6 5.000 . 5.500 2.245 2.086 2.518 . 0 0 "[ . 1 . 2]" 1 1802 2 9 DT H1' 2 9 DT H2'' 2.400 . 3.000 2.255 2.203 2.272 . 0 0 "[ . 1 . 2]" 1 1803 2 14 DC H2'' 2 14 DC H6 3.625 3.000 4.250 4.054 3.990 4.104 . 0 0 "[ . 1 . 2]" 1 1804 2 2 DT H2'' 2 2 DT H6 3.625 3.000 4.250 3.849 3.588 3.977 . 0 0 "[ . 1 . 2]" 1 1805 2 14 DC H2' 2 15 DC H6 3.625 3.000 4.250 3.146 3.102 3.214 . 0 0 "[ . 1 . 2]" 1 1806 2 8 DA H2'' 2 8 DA H8 5.000 . 5.500 3.754 3.555 3.874 . 0 0 "[ . 1 . 2]" 1 1807 2 14 DC H2' 2 14 DC H5 3.625 3.000 4.250 4.372 4.305 4.442 0.192 20 0 "[ . 1 . 2]" 1 1808 2 14 DC H2'' 2 15 DC H5 3.625 3.000 4.250 2.996 2.981 3.015 0.019 20 0 "[ . 1 . 2]" 1 1809 2 13 DC H4' 2 13 DC H6 3.625 3.000 4.250 4.422 4.404 4.439 0.189 19 0 "[ . 1 . 2]" 1 1810 2 4 DA H1' 2 4 DA H2'' 2.434 2.191 2.677 2.228 2.193 2.236 . 0 0 "[ . 1 . 2]" 1 1811 2 7 DA H2' 2 7 DA H8 2.400 . 3.000 2.406 2.276 2.506 . 0 0 "[ . 1 . 2]" 1 1812 2 14 DC H2' 2 15 DC H5 5.000 . 5.500 2.205 2.160 2.276 . 0 0 "[ . 1 . 2]" 1 1813 2 4 DA H2'' 2 5 DA H8 2.659 2.393 2.925 2.216 2.168 2.244 0.225 17 0 "[ . 1 . 2]" 1 1814 2 2 DT H1' 2 2 DT H6 3.625 3.000 4.250 3.721 3.697 3.738 . 0 0 "[ . 1 . 2]" 1 1815 2 11 DA H2' 2 11 DA H8 2.577 2.319 2.835 2.161 2.109 2.192 0.210 19 0 "[ . 1 . 2]" 1 1816 2 4 DA H2' 2 4 DA H8 2.478 2.230 2.726 2.538 2.397 2.593 . 0 0 "[ . 1 . 2]" 1 1817 2 2 DT H1' 2 3 DG H8 4.627 4.164 5.090 4.050 3.986 4.075 0.178 7 0 "[ . 1 . 2]" 1 1818 2 3 DG H1' 2 3 DG H8 3.855 3.469 4.241 3.947 3.941 3.964 . 0 0 "[ . 1 . 2]" 1 1819 2 10 DC H3' 2 11 DA H8 4.347 3.912 4.782 4.786 4.246 4.937 0.155 10 0 "[ . 1 . 2]" 1 1820 2 2 DT H1' 2 3 DG H5' 2.494 2.245 2.743 2.946 2.930 2.975 0.232 7 0 "[ . 1 . 2]" 1 1821 2 4 DA H3' 2 5 DA H8 3.515 3.163 3.867 3.905 3.637 3.955 0.088 2 0 "[ . 1 . 2]" 1 1822 2 7 DA H1' 2 8 DA H5' 2.796 2.516 3.076 2.649 2.469 3.093 0.047 17 0 "[ . 1 . 2]" 1 1823 2 8 DA H8 2 9 DT M7 2.721 2.449 2.993 2.516 2.410 2.644 0.039 6 0 "[ . 1 . 2]" 1 1824 2 8 DA H2' 2 9 DT H6 3.990 3.591 4.389 3.289 3.216 3.595 0.375 17 0 "[ . 1 . 2]" 1 1825 2 8 DA H1' 2 9 DT H6 2.888 2.599 3.177 3.311 2.707 3.405 0.228 17 0 "[ . 1 . 2]" 1 1826 2 9 DT H1' 2 10 DC H6 5.000 . 5.500 4.068 3.105 4.371 . 0 0 "[ . 1 . 2]" 1 1827 2 6 DC H1' 2 7 DA H8 4.196 3.776 4.616 4.651 4.630 4.693 0.077 16 0 "[ . 1 . 2]" 1 1828 2 5 DA H2'' 2 6 DC H5 3.423 3.081 3.765 4.038 3.971 4.088 0.323 10 0 "[ . 1 . 2]" 1 1829 2 6 DC H6 2 7 DA H8 4.316 3.884 4.748 4.112 3.811 4.430 0.073 17 0 "[ . 1 . 2]" 1 1830 2 5 DA H3' 2 6 DC H6 3.998 3.598 4.398 4.367 4.119 4.513 0.115 7 0 "[ . 1 . 2]" 1 1831 2 9 DT H2'' 2 9 DT H6 3.625 3.000 4.250 3.767 3.599 3.920 . 0 0 "[ . 1 . 2]" 1 1832 2 13 DC H2'' 2 13 DC H6 3.625 3.000 4.250 3.686 3.674 3.718 . 0 0 "[ . 1 . 2]" 1 1833 2 3 DG H1' 2 3 DG Q2' 2.203 2.197 2.423 2.117 2.113 2.120 0.084 11 0 "[ . 1 . 2]" 1 1834 2 2 DT H2' 2 2 DT H3' 2.400 . 3.000 2.241 2.222 2.302 . 0 0 "[ . 1 . 2]" 1 1835 2 11 DA H8 2 12 DC H5 3.009 2.708 3.310 3.514 3.424 3.663 0.353 13 0 "[ . 1 . 2]" 1 1836 2 2 DT H1' 2 2 DT H2'' 2.254 2.029 2.479 2.242 2.221 2.253 . 0 0 "[ . 1 . 2]" 1 1837 2 12 DC H2' 2 13 DC H5 3.609 3.248 3.970 3.050 3.021 3.069 0.227 16 0 "[ . 1 . 2]" 1 1838 2 5 DA H2'' 2 6 DC H6 2.828 2.545 3.111 2.306 2.140 2.342 0.405 17 0 "[ . 1 . 2]" 1 1839 2 11 DA H2' 2 12 DC H5 3.369 3.032 3.706 3.004 2.947 3.120 0.085 20 0 "[ . 1 . 2]" 1 1840 2 10 DC H1' 2 11 DA H8 3.393 3.054 3.732 3.586 3.023 4.032 0.300 13 0 "[ . 1 . 2]" 1 1841 2 11 DA H1' 2 12 DC H3' 4.039 3.635 4.443 4.313 4.150 4.594 0.151 16 0 "[ . 1 . 2]" 1 1842 2 2 DT H1' 2 2 DT M7 4.875 4.250 5.500 5.116 5.097 5.124 . 0 0 "[ . 1 . 2]" 1 1843 2 13 DC H2'' 2 13 DC H5 4.875 4.250 5.500 5.547 5.515 5.557 0.057 13 0 "[ . 1 . 2]" 1 1844 2 3 DG H1' 2 3 DG H3' 3.625 3.000 4.250 3.919 3.913 3.927 . 0 0 "[ . 1 . 2]" 1 1845 2 4 DA H1' 2 4 DA H3' 3.625 3.000 4.250 4.023 4.016 4.028 . 0 0 "[ . 1 . 2]" 1 1846 2 2 DT H2'' 2 2 DT H3' 2.400 . 3.000 2.928 2.906 2.971 . 0 0 "[ . 1 . 2]" 1 1847 2 8 DA H2'' 2 9 DT H6 2.770 2.493 3.047 2.220 2.153 2.294 0.340 19 0 "[ . 1 . 2]" 1 1848 2 12 DC H2' 2 13 DC H6 3.625 3.000 4.250 2.990 2.934 3.287 0.066 18 0 "[ . 1 . 2]" 1 1849 2 13 DC H1' 2 13 DC H3' 3.625 3.000 4.250 3.991 3.972 3.997 . 0 0 "[ . 1 . 2]" 1 1850 2 9 DT H3' 2 10 DC H6 4.875 4.250 5.500 4.206 4.084 4.630 0.166 18 0 "[ . 1 . 2]" 1 1851 2 10 DC H1' 2 10 DC H6 3.625 3.000 4.250 3.661 3.506 3.760 . 0 0 "[ . 1 . 2]" 1 1852 2 9 DT H2' 2 10 DC H5 3.625 3.000 4.250 2.975 2.902 3.110 0.098 13 0 "[ . 1 . 2]" 1 1853 2 9 DT H2'' 2 10 DC H5 5.000 . 5.500 3.879 3.559 4.144 . 0 0 "[ . 1 . 2]" 1 1854 2 6 DC H1' 2 7 DA H5' 2.864 2.578 3.150 3.312 3.267 3.365 0.215 18 0 "[ . 1 . 2]" 1 1855 2 8 DA H1' 2 9 DT H5' 5.000 . 5.500 2.255 2.127 3.298 . 0 0 "[ . 1 . 2]" 1 1856 2 8 DA H3' 2 8 DA H8 3.625 3.000 4.250 4.033 3.714 4.264 0.014 11 0 "[ . 1 . 2]" 1 1857 2 13 DC H6 2 14 DC H5 3.625 3.000 4.250 4.016 3.233 4.281 0.031 20 0 "[ . 1 . 2]" 1 1858 2 13 DC H2' 2 13 DC H5 3.229 2.906 3.552 3.940 3.908 3.947 0.395 12 0 "[ . 1 . 2]" 1 1859 2 12 DC H1' 2 12 DC H4' 3.625 3.000 4.250 3.153 3.095 3.287 . 0 0 "[ . 1 . 2]" 1 1860 2 11 DA H2 2 12 DC H1' 3.625 3.000 4.250 3.941 3.769 4.261 0.011 10 0 "[ . 1 . 2]" 1 1861 2 11 DA H2'' 2 11 DA H8 3.625 3.000 4.250 3.765 3.699 3.803 . 0 0 "[ . 1 . 2]" 1 1862 2 10 DC H1' 2 10 DC H4' 3.625 3.000 4.250 3.184 3.055 3.365 . 0 0 "[ . 1 . 2]" 1 1863 2 9 DT H3' 2 9 DT H6 2.895 2.605 3.185 3.201 2.909 3.392 0.207 2 0 "[ . 1 . 2]" 1 1864 2 8 DA H4' 2 8 DA H8 4.058 3.652 4.464 4.758 4.716 4.839 0.375 11 0 "[ . 1 . 2]" 1 1865 2 7 DA H3' 2 7 DA H8 3.625 3.000 4.250 3.576 3.303 3.735 . 0 0 "[ . 1 . 2]" 1 1866 2 5 DA H3' 2 5 DA H8 3.625 3.000 4.250 4.201 2.972 4.400 0.150 13 0 "[ . 1 . 2]" 1 1867 2 7 DA H3' 2 8 DA H8 5.000 . 5.500 4.823 4.371 5.193 . 0 0 "[ . 1 . 2]" 1 1868 2 9 DT H1' 2 9 DT M7 3.123 2.811 3.435 3.490 2.802 3.704 0.269 17 0 "[ . 1 . 2]" 1 1869 2 1 DC H1' 2 1 DC Q5' 3.625 3.000 4.245 3.858 3.833 3.957 . 0 0 "[ . 1 . 2]" 1 1870 2 1 DC H1' 2 2 DT M7 3.092 2.783 3.401 3.252 3.048 3.411 0.010 14 0 "[ . 1 . 2]" 1 1871 2 2 DT H1' 2 2 DT H3' 3.625 3.000 4.250 3.969 3.949 3.984 . 0 0 "[ . 1 . 2]" 1 1872 2 2 DT H3' 2 2 DT M7 2.940 2.646 3.234 4.080 3.997 4.132 0.898 15 20 [**************+**-**] 1 1873 2 5 DA H1' 2 5 DA H3' 3.421 3.079 3.763 3.933 3.892 3.991 0.228 18 0 "[ . 1 . 2]" 1 1874 2 14 DC H4' 2 14 DC H6 3.132 2.819 3.445 3.962 3.937 3.976 0.531 4 18 "[***+*********-* * **]" 1 1875 2 4 DA H2' 2 5 DA H8 2.717 2.445 2.989 2.323 2.192 2.347 0.253 17 0 "[ . 1 . 2]" 1 1876 2 1 DC H1' 2 1 DC H3' 2.938 2.644 3.232 3.812 3.780 3.826 0.594 10 20 [*********+***-******] 1 1877 2 4 DA H1' 2 4 DA H2 3.516 3.164 3.868 4.295 4.282 4.305 0.437 11 0 "[ . 1 . 2]" 1 1878 2 4 DA H1' 2 5 DA H8 3.445 3.100 3.790 4.003 3.981 4.043 0.253 16 0 "[ . 1 . 2]" 1 1879 2 5 DA H1' 2 5 DA H8 3.625 3.000 4.250 3.839 3.817 3.852 . 0 0 "[ . 1 . 2]" 1 1880 2 5 DA H2 2 6 DC H1' 3.625 3.000 4.250 4.395 4.339 4.491 0.241 17 0 "[ . 1 . 2]" 1 1881 2 1 DC H2'' 2 1 DC H6 3.625 3.000 4.250 3.675 3.648 3.717 . 0 0 "[ . 1 . 2]" 1 1882 2 15 DC H1' 2 15 DC H3' 3.625 3.000 4.250 4.030 4.028 4.032 . 0 0 "[ . 1 . 2]" 1 1883 2 11 DA H1' 2 11 DA H3' 3.625 3.000 4.250 4.008 3.956 4.042 . 0 0 "[ . 1 . 2]" 1 1884 2 15 DC H1' 2 15 DC H6 3.625 3.000 4.250 3.709 3.705 3.713 . 0 0 "[ . 1 . 2]" 1 1885 2 11 DA H1' 2 11 DA H2' 2.400 . 3.000 2.988 2.972 3.018 0.018 15 0 "[ . 1 . 2]" 1 1886 2 6 DC H1' 2 6 DC H3' 4.602 4.142 5.062 3.982 3.959 3.994 0.183 15 0 "[ . 1 . 2]" 1 1887 1 12 DT H2' 1 12 DT H6 2.400 . 3.000 2.440 2.329 2.520 . 0 0 "[ . 1 . 2]" 1 1888 1 1 DG H2'' 1 1 DG H8 3.625 3.000 4.250 3.401 3.217 3.476 . 0 0 "[ . 1 . 2]" 1 1889 1 14 DA H1' 1 15 DG H8 4.875 4.250 5.500 5.302 5.196 5.328 . 0 0 "[ . 1 . 2]" 1 1890 1 11 DT H1' 1 11 DT H6 3.625 3.000 4.250 3.734 3.722 3.737 . 0 0 "[ . 1 . 2]" 1 1891 1 6 DG H2'' 1 6 DG H8 3.625 3.000 4.250 4.087 3.978 4.223 . 0 0 "[ . 1 . 2]" 1 1892 1 1 DG H3' 1 1 DG H8 3.625 3.000 4.250 4.175 4.086 4.244 . 0 0 "[ . 1 . 2]" 1 1893 1 10 DG H2'' 1 10 DG H8 3.625 3.000 4.250 4.088 3.825 4.152 . 0 0 "[ . 1 . 2]" 1 1894 1 9 DT H2'' 1 9 DT H6 3.625 3.000 4.250 3.829 3.590 4.028 . 0 0 "[ . 1 . 2]" 1 1895 1 11 DT H2' 1 12 DT H6 2.400 . 3.000 2.181 2.167 2.199 . 0 0 "[ . 1 . 2]" 1 1896 1 2 DG H2' 1 3 DG H8 3.625 3.000 4.250 3.503 3.038 3.744 . 0 0 "[ . 1 . 2]" 1 1897 1 1 DG H2' 1 2 DG H8 4.875 4.250 5.500 4.316 4.226 4.493 0.024 16 0 "[ . 1 . 2]" 1 1898 1 10 DG H1' 1 10 DG H2'' 2.400 . 3.000 2.201 2.180 2.257 . 0 0 "[ . 1 . 2]" 1 1899 1 11 DT H1' 1 12 DT M7 3.625 3.000 4.250 4.306 4.273 4.344 0.094 11 0 "[ . 1 . 2]" 1 1900 1 6 DG H1' 1 6 DG H2' 2.400 . 3.000 2.885 2.862 2.907 . 0 0 "[ . 1 . 2]" 1 1901 1 15 DG H1' 1 15 DG H2' 2.400 . 3.000 2.839 2.832 2.851 . 0 0 "[ . 1 . 2]" 1 1902 1 12 DT H1' 1 12 DT H2'' 2.400 . 3.000 2.170 2.160 2.173 . 0 0 "[ . 1 . 2]" 1 1903 1 9 DT H1' 1 9 DT H6 3.625 3.000 4.250 3.740 3.721 3.750 . 0 0 "[ . 1 . 2]" 1 1904 1 9 DT H1' 1 9 DT H3' 3.625 3.000 4.250 3.924 3.861 3.944 . 0 0 "[ . 1 . 2]" 1 1905 1 11 DT H1' 1 11 DT H3' 3.625 3.000 4.250 3.970 3.941 4.004 . 0 0 "[ . 1 . 2]" 1 1906 1 13 DC H1' 1 13 DC H4' 2.400 . 3.000 3.183 3.170 3.204 0.204 18 0 "[ . 1 . 2]" 1 1907 1 1 DG H1' 1 2 DG H4' 3.625 3.000 4.250 4.214 4.086 4.371 0.121 9 0 "[ . 1 . 2]" 1 1908 1 12 DT H3' 1 13 DC H6 3.625 3.000 4.250 4.033 3.981 4.077 . 0 0 "[ . 1 . 2]" 1 1909 1 1 DG H3' 1 2 DG H8 4.875 4.250 5.500 5.136 4.426 5.518 0.018 13 0 "[ . 1 . 2]" 1 1910 1 13 DC H5 1 13 DC H6 2.130 . 2.343 2.397 2.395 2.399 0.056 4 0 "[ . 1 . 2]" 1 1911 1 7 DA H1' 1 7 DA H2'' 2.562 2.306 2.818 2.212 2.148 2.324 0.158 8 0 "[ . 1 . 2]" 1 1912 1 14 DA H1' 1 14 DA H2'' 2.311 2.080 2.542 2.214 2.209 2.221 . 0 0 "[ . 1 . 2]" 1 1913 1 9 DT H6 1 9 DT M7 2.129 . 2.342 2.283 2.210 2.349 0.007 15 0 "[ . 1 . 2]" 1 1914 1 12 DT H1' 1 12 DT H6 2.962 2.666 3.258 3.645 3.638 3.650 0.392 11 0 "[ . 1 . 2]" 1 1915 1 11 DT H1' 1 12 DT H6 3.513 3.162 3.864 4.096 4.063 4.127 0.263 18 0 "[ . 1 . 2]" 1 1916 1 12 DT H6 1 12 DT M7 2.156 . 2.372 2.264 2.257 2.277 . 0 0 "[ . 1 . 2]" 1 1917 1 11 DT H2'' 1 12 DT H6 2.362 2.126 2.598 2.182 2.162 2.273 . 0 0 "[ . 1 . 2]" 1 1918 1 11 DT H6 1 11 DT M7 2.295 2.065 2.525 2.216 2.204 2.237 . 0 0 "[ . 1 . 2]" 1 1919 1 13 DC H3' 1 13 DC H6 2.573 2.316 2.830 2.443 2.423 2.458 . 0 0 "[ . 1 . 2]" 1 1920 1 8 DT H6 1 8 DT M7 2.196 . 2.416 2.179 2.154 2.207 . 0 0 "[ . 1 . 2]" 1 1921 1 5 DT H6 1 5 DT M7 2.128 . 2.341 2.294 2.200 2.347 0.006 10 0 "[ . 1 . 2]" 1 1922 1 10 DG H2'' 1 11 DT H6 2.794 2.515 3.073 2.398 2.268 2.448 0.247 18 0 "[ . 1 . 2]" 1 1923 1 7 DA H2' 1 7 DA H8 2.896 2.606 3.186 2.755 2.246 3.112 0.360 6 0 "[ . 1 . 2]" 1 1924 1 3 DG H2' 1 3 DG H8 2.961 2.665 3.257 2.424 2.399 2.447 0.266 20 0 "[ . 1 . 2]" 1 1925 1 2 DG H2'' 1 2 DG H8 3.264 2.938 3.590 3.963 3.912 3.996 0.406 2 0 "[ . 1 . 2]" 1 1926 1 4 DG H8 1 5 DT M7 3.574 3.217 3.931 3.855 3.510 3.953 0.022 8 0 "[ . 1 . 2]" 1 1927 1 12 DT H6 1 13 DC H5 2.864 2.578 3.150 3.210 3.178 3.251 0.101 13 0 "[ . 1 . 2]" 1 1928 1 13 DC H1' 1 13 DC H6 3.132 2.819 3.445 3.654 3.652 3.658 0.213 17 0 "[ . 1 . 2]" 1 1929 1 12 DT H1' 1 13 DC H6 3.108 2.797 3.419 4.117 4.098 4.169 0.750 18 20 [**************-**+**] 1 1930 1 14 DA H1' 1 14 DA H8 3.290 2.961 3.619 3.851 3.847 3.852 0.233 13 0 "[ . 1 . 2]" 1 1931 1 10 DG H1' 1 10 DG H8 3.551 3.196 3.906 3.907 3.878 3.917 0.011 12 0 "[ . 1 . 2]" 1 1932 1 4 DG H1' 1 5 DT H6 3.246 2.921 3.571 2.839 2.674 3.616 0.247 19 0 "[ . 1 . 2]" 1 1933 1 5 DT H1' 1 5 DT H6 3.832 3.449 4.215 3.727 3.709 3.738 . 0 0 "[ . 1 . 2]" 1 1934 1 3 DG H1' 1 4 DG H8 3.549 3.194 3.904 4.125 4.027 4.150 0.246 1 0 "[ . 1 . 2]" 1 1935 1 3 DG H1' 1 3 DG H8 3.856 3.470 4.242 3.892 3.884 3.902 . 0 0 "[ . 1 . 2]" 1 1936 1 2 DG H1' 1 3 DG H8 3.615 3.253 3.977 3.989 3.707 4.038 0.061 2 0 "[ . 1 . 2]" 1 1937 1 7 DA H1' 1 7 DA H8 3.352 3.017 3.687 3.823 3.803 3.837 0.150 19 0 "[ . 1 . 2]" 1 1938 1 6 DG H1' 1 7 DA H8 2.923 2.631 3.215 3.599 3.554 3.673 0.458 13 0 "[ . 1 . 2]" 1 1939 1 6 DG H1' 1 6 DG H8 3.275 2.947 3.603 3.842 3.836 3.849 0.246 11 0 "[ . 1 . 2]" 1 1940 1 6 DG H3' 1 6 DG H8 3.105 2.795 3.415 3.308 3.028 3.511 0.096 13 0 "[ . 1 . 2]" 1 1941 1 6 DG H3' 1 7 DA H8 3.289 2.960 3.618 4.029 3.993 4.066 0.448 20 0 "[ . 1 . 2]" 1 1942 1 7 DA H3' 1 7 DA H8 3.333 3.000 3.666 3.788 3.455 4.070 0.404 6 0 "[ . 1 . 2]" 1 1943 1 7 DA H1' 1 8 DT H6 3.239 2.915 3.563 3.774 3.631 3.918 0.355 8 0 "[ . 1 . 2]" 1 1944 1 8 DT H1' 1 8 DT H6 3.387 3.048 3.726 3.745 3.713 3.783 0.057 13 0 "[ . 1 . 2]" 1 1945 1 8 DT H1' 1 9 DT H6 3.483 3.135 3.831 3.733 3.356 3.922 0.091 9 0 "[ . 1 . 2]" 1 1946 1 10 DG H3' 1 10 DG H8 3.266 2.939 3.593 3.532 3.065 3.643 0.050 11 0 "[ . 1 . 2]" 1 1947 1 9 DT H3' 1 10 DG H8 3.957 3.561 4.353 4.055 3.762 4.516 0.163 16 0 "[ . 1 . 2]" 1 1948 1 10 DG H3' 1 11 DT H6 4.590 4.131 5.049 5.045 4.787 5.138 0.089 11 0 "[ . 1 . 2]" 1 1949 1 14 DA H3' 1 14 DA H8 2.837 2.553 3.121 3.195 3.162 3.206 0.085 4 0 "[ . 1 . 2]" 1 1950 1 13 DC H3' 1 14 DA H8 3.902 3.512 4.292 4.478 4.450 4.494 0.202 4 0 "[ . 1 . 2]" 1 1951 1 2 DG H3' 1 3 DG H8 3.437 3.093 3.781 3.804 3.672 4.026 0.245 20 0 "[ . 1 . 2]" 1 1952 1 4 DG H3' 1 4 DG H8 3.393 3.054 3.732 3.881 3.804 3.921 0.189 17 0 "[ . 1 . 2]" 1 1953 1 4 DG H3' 1 5 DT H6 5.468 4.921 6.015 5.495 5.281 5.728 . 0 0 "[ . 1 . 2]" 1 1954 1 5 DT H3' 1 5 DT H6 3.197 2.877 3.517 3.272 2.982 3.486 . 0 0 "[ . 1 . 2]" 1 1955 1 12 DT H2'' 1 13 DC H6 2.653 2.388 2.918 2.376 2.365 2.407 0.023 4 0 "[ . 1 . 2]" 1 1956 1 7 DA H1' 1 7 DA H2 3.928 3.535 4.321 4.356 4.309 4.416 0.095 13 0 "[ . 1 . 2]" 1 1957 1 4 DG H1' 1 4 DG H8 3.363 3.027 3.699 3.804 3.770 3.824 0.125 10 0 "[ . 1 . 2]" 1 1958 1 12 DT H2' 1 13 DC H6 2.432 2.189 2.675 2.395 2.338 2.473 . 0 0 "[ . 1 . 2]" 1 1959 1 14 DA H2' 1 15 DG H8 3.736 3.362 4.110 3.303 3.264 3.335 0.098 10 0 "[ . 1 . 2]" 1 1960 1 14 DA H2'' 1 15 DG H8 3.655 3.290 4.020 3.272 3.259 3.287 0.031 4 0 "[ . 1 . 2]" 1 1961 1 1 DG H2'' 1 2 DG H8 3.212 2.891 3.533 2.855 2.791 2.889 0.100 20 0 "[ . 1 . 2]" 1 1962 1 14 DA H1' 1 14 DA H2' 2.388 2.149 2.627 2.828 2.826 2.830 0.203 18 0 "[ . 1 . 2]" 1 1963 1 3 DG H1' 1 3 DG H2' 2.593 2.334 2.852 2.953 2.937 2.987 0.135 20 0 "[ . 1 . 2]" 1 1964 1 1 DG H1' 1 1 DG H2' 2.755 2.479 3.031 3.001 2.990 3.016 . 0 0 "[ . 1 . 2]" 1 1965 1 2 DG H1' 1 2 DG H2' 2.575 2.317 2.833 2.970 2.964 2.978 0.145 9 0 "[ . 1 . 2]" 1 1966 1 2 DG H1' 1 2 DG H2'' 2.355 2.119 2.591 2.231 2.224 2.238 . 0 0 "[ . 1 . 2]" 1 1967 1 10 DG H1' 1 10 DG H2' 2.400 2.160 2.640 2.872 2.818 2.937 0.297 11 0 "[ . 1 . 2]" 1 1968 1 12 DT M7 1 13 DC H5 3.697 3.327 4.067 3.368 3.324 3.438 0.003 11 0 "[ . 1 . 2]" 1 1969 1 4 DG H1' 1 4 DG H2' 2.417 2.175 2.659 2.972 2.945 2.981 0.322 15 0 "[ . 1 . 2]" 1 1970 1 4 DG H1' 1 4 DG H2'' 2.108 . 2.319 2.290 2.244 2.311 . 0 0 "[ . 1 . 2]" 1 1971 1 7 DA H1' 1 7 DA H2' 2.360 2.124 2.596 2.876 2.803 2.969 0.373 16 0 "[ . 1 . 2]" 1 1972 1 15 DG H1' 1 15 DG H2'' 2.153 . 2.368 2.164 2.164 2.165 . 0 0 "[ . 1 . 2]" 1 1973 1 12 DT H1' 1 12 DT H2' 2.840 2.556 3.124 2.882 2.879 2.885 . 0 0 "[ . 1 . 2]" 1 1974 1 4 DG H1' 1 5 DT M7 3.262 2.936 3.588 3.245 3.016 3.693 0.105 10 0 "[ . 1 . 2]" 1 1975 1 11 DT H1' 1 11 DT H2'' 2.170 . 2.387 2.215 2.198 2.221 . 0 0 "[ . 1 . 2]" 1 1976 1 12 DT H2'' 1 13 DC H5 3.041 2.737 3.345 3.588 3.549 3.618 0.273 12 0 "[ . 1 . 2]" 1 1977 1 9 DT H1' 1 9 DT H2'' 2.337 2.103 2.571 2.251 2.212 2.338 . 0 0 "[ . 1 . 2]" 1 1978 1 8 DT H1' 1 9 DT M7 3.617 3.255 3.979 4.025 3.781 4.128 0.149 8 0 "[ . 1 . 2]" 1 1979 1 8 DT H6 1 9 DT M7 2.674 2.407 2.941 2.991 2.763 3.142 0.201 13 0 "[ . 1 . 2]" 1 1980 1 8 DT H1' 1 8 DT H2'' 2.489 2.240 2.738 2.231 2.192 2.260 0.048 13 0 "[ . 1 . 2]" 1 1981 1 7 DA H1' 1 7 DA H3' 3.757 3.381 4.133 3.951 3.868 4.002 . 0 0 "[ . 1 . 2]" 1 1982 1 12 DT H1' 1 12 DT H3' 3.266 2.939 3.593 3.898 3.890 3.906 0.313 11 0 "[ . 1 . 2]" 1 1983 1 5 DT H1' 1 5 DT H3' 3.208 2.887 3.529 3.887 3.858 3.940 0.411 10 0 "[ . 1 . 2]" 1 1984 1 12 DT H3' 1 13 DC H5 3.509 3.158 3.860 3.973 3.950 4.003 0.143 17 0 "[ . 1 . 2]" 1 1985 1 1 DG H1' 1 1 DG Q5' 3.207 2.886 3.528 4.192 4.180 4.199 0.671 2 20 [*+******-***********] 1 1986 1 1 DG H1' 1 1 DG H4' 2.673 2.406 2.940 3.081 3.025 3.116 0.176 18 0 "[ . 1 . 2]" 1 1987 1 2 DG H1' 1 2 DG H4' 2.680 2.412 2.948 3.022 2.897 3.086 0.138 18 0 "[ . 1 . 2]" 1 1988 1 3 DG H1' 1 3 DG H4' 2.696 2.426 2.966 3.096 3.063 3.115 0.149 7 0 "[ . 1 . 2]" 1 1989 1 3 DG H1' 1 3 DG H5' 3.588 3.229 3.947 4.331 4.299 4.344 0.397 15 0 "[ . 1 . 2]" 1 1990 1 4 DG H1' 1 4 DG H4' 2.784 2.506 3.062 3.213 3.073 3.279 0.217 10 0 "[ . 1 . 2]" 1 1991 1 7 DA H1' 1 7 DA H4' 3.204 2.884 3.524 3.282 3.225 3.387 . 0 0 "[ . 1 . 2]" 1 1992 1 7 DA H1' 1 8 DT H5' 3.529 3.176 3.882 3.444 3.259 3.633 . 0 0 "[ . 1 . 2]" 1 1993 1 14 DA H1' 1 14 DA H4' 2.883 2.595 3.171 3.267 3.250 3.312 0.141 18 0 "[ . 1 . 2]" 1 1994 1 6 DG H1' 1 6 DG H4' 2.536 2.282 2.790 3.173 3.083 3.242 0.452 6 0 "[ . 1 . 2]" 1 1995 1 1 DG H1' 1 2 DG H5' 3.083 2.775 3.391 3.261 3.114 3.398 0.007 9 0 "[ . 1 . 2]" 1 1996 1 3 DG H1' 1 4 DG H5' 3.288 2.959 3.617 3.452 2.945 3.743 0.126 3 0 "[ . 1 . 2]" 1 1997 1 13 DC H4' 1 13 DC H6 3.100 2.790 3.410 3.253 3.228 3.265 . 0 0 "[ . 1 . 2]" 1 1998 1 12 DT Q5' 1 12 DT H6 3.229 2.906 3.552 3.452 3.378 3.523 . 0 0 "[ . 1 . 2]" 1 1999 1 10 DG H1' 1 10 DG H4' 2.873 2.586 3.160 3.266 2.806 3.545 0.385 16 0 "[ . 1 . 2]" 1 2000 1 8 DT H3' 1 8 DT H6 3.701 3.331 4.071 3.707 3.445 4.041 . 0 0 "[ . 1 . 2]" 1 2001 1 14 DA H3' 1 15 DG H8 4.798 4.318 5.278 4.301 4.250 4.527 0.068 4 0 "[ . 1 . 2]" 1 2002 1 1 DG H3' 1 1 DG Q5' 2.154 . 2.369 2.489 2.453 2.511 0.142 7 0 "[ . 1 . 2]" 1 2003 1 1 DG H3' 1 1 DG H4' 2.051 . 2.256 2.858 2.857 2.861 0.605 13 20 [****-*******+*******] 1 2004 1 1 DG H2'' 1 1 DG H5'' 4.594 4.135 5.053 4.891 4.857 4.912 . 0 0 "[ . 1 . 2]" 1 2005 1 14 DA H2'' 1 14 DA H3' 2.250 2.025 2.475 2.820 2.808 2.828 0.353 4 0 "[ . 1 . 2]" 1 2006 1 14 DA H2' 1 14 DA H3' 1.955 . 2.151 2.176 2.172 2.180 0.029 4 0 "[ . 1 . 2]" 1 2007 1 14 DA H3' 1 14 DA H4' 2.129 . 2.342 2.943 2.935 2.947 0.605 5 20 [****+************-**] 1 2008 1 1 DG H4' 1 1 DG Q5' 2.251 2.026 2.476 2.187 2.182 2.189 . 0 0 "[ . 1 . 2]" 1 2009 1 2 DG H4' 1 3 DG H8 4.394 3.955 4.833 4.766 4.713 4.830 . 0 0 "[ . 1 . 2]" 1 2010 1 5 DT H1' 1 6 DG H8 3.545 3.190 3.900 3.997 3.921 4.090 0.190 17 0 "[ . 1 . 2]" 1 2011 1 1 DG H2' 1 1 DG H3' 2.062 . 2.268 2.261 2.240 2.290 0.022 20 0 "[ . 1 . 2]" 1 2012 1 1 DG H2'' 1 1 DG H3' 2.462 2.216 2.708 2.772 2.752 2.785 0.077 15 0 "[ . 1 . 2]" 1 2013 1 13 DC Q2' 1 13 DC H3' 2.065 . 2.272 2.076 2.070 2.079 . 0 0 "[ . 1 . 2]" 1 2014 1 11 DT H3' 1 12 DT M7 2.565 2.308 2.822 2.749 2.681 2.866 0.044 15 0 "[ . 1 . 2]" 1 2015 1 14 DA H4' 1 14 DA H8 4.839 4.355 5.323 4.680 4.672 4.697 . 0 0 "[ . 1 . 2]" 1 2016 1 8 DT H1' 1 8 DT H3' 3.920 3.528 4.312 3.940 3.888 4.031 . 0 0 "[ . 1 . 2]" 1 2017 1 9 DT H1' 1 9 DT H2' 3.015 2.713 3.317 2.957 2.938 3.021 . 0 0 "[ . 1 . 2]" 1 2018 1 4 DG H3' 1 5 DT M7 4.875 4.250 5.500 4.737 4.343 5.031 . 0 0 "[ . 1 . 2]" 1 2019 1 1 DG H1' 1 1 DG H8 3.442 3.098 3.786 3.827 3.749 3.866 0.080 17 0 "[ . 1 . 2]" 1 2020 1 1 DG H2' 1 1 DG H8 5.000 . 5.500 2.080 2.057 2.116 . 0 0 "[ . 1 . 2]" 1 2021 1 15 DG H1' 1 15 DG H8 5.000 . 5.500 3.876 3.874 3.878 . 0 0 "[ . 1 . 2]" 1 2022 1 1 DG H1' 1 1 DG H2'' 2.125 . 2.338 2.294 2.279 2.316 . 0 0 "[ . 1 . 2]" 1 2023 1 10 DG H2' 1 11 DT H6 5.000 . 5.500 3.303 2.899 3.863 . 0 0 "[ . 1 . 2]" 1 2024 1 4 DG H4' 1 4 DG H8 4.369 3.932 4.806 4.941 4.859 5.084 0.278 20 0 "[ . 1 . 2]" 1 2025 1 4 DG Q5' 1 4 DG H8 3.952 3.557 4.347 4.041 3.776 4.429 0.082 20 0 "[ . 1 . 2]" 1 2026 1 8 DT H2' 1 8 DT H6 3.077 2.769 3.385 2.809 2.607 3.017 0.162 13 0 "[ . 1 . 2]" 1 2027 1 15 DG H1' 1 15 DG H3' 5.000 . 5.500 4.018 3.988 4.033 . 0 0 "[ . 1 . 2]" 1 2028 1 12 DT H1' 1 12 DT Q5' 2.400 . 3.000 3.092 3.051 3.103 0.103 12 0 "[ . 1 . 2]" 1 2029 1 2 DG H1' 1 2 DG H3' 3.625 3.000 4.250 3.918 3.894 3.933 . 0 0 "[ . 1 . 2]" 1 2030 1 10 DG H1' 1 10 DG H3' 3.625 3.000 4.250 3.959 3.889 4.018 . 0 0 "[ . 1 . 2]" 1 2031 1 4 DG H1' 1 4 DG H3' 3.625 3.000 4.250 3.907 3.892 3.941 . 0 0 "[ . 1 . 2]" 1 2032 1 8 DT H2'' 1 8 DT H6 5.000 . 5.500 4.167 4.017 4.302 . 0 0 "[ . 1 . 2]" 1 2033 1 5 DT H2'' 1 5 DT H6 3.625 3.000 4.250 3.749 3.719 3.799 . 0 0 "[ . 1 . 2]" 1 2034 1 4 DG H1' 1 4 DG H5' 4.875 4.250 5.500 4.552 4.469 4.666 . 0 0 "[ . 1 . 2]" 1 2035 1 6 DG H2' 1 6 DG H8 2.718 2.446 2.990 2.565 2.408 2.763 0.038 6 0 "[ . 1 . 2]" 1 2036 1 6 DG H4' 1 6 DG H8 4.875 4.250 5.500 4.582 4.494 4.644 . 0 0 "[ . 1 . 2]" 1 2037 1 10 DG H4' 1 10 DG H8 4.443 3.999 4.887 4.768 4.516 5.032 0.145 11 0 "[ . 1 . 2]" 1 2038 1 3 DG H2' 1 4 DG H8 3.291 2.962 3.620 2.806 2.704 3.717 0.258 18 0 "[ . 1 . 2]" 1 2039 1 4 DG H2'' 1 4 DG H8 3.153 2.838 3.468 3.643 3.584 3.712 0.244 10 0 "[ . 1 . 2]" 1 2040 1 14 DA Q5' 1 14 DA H8 3.667 3.300 4.034 3.843 3.794 3.870 . 0 0 "[ . 1 . 2]" 1 2041 1 14 DA H2' 1 14 DA H8 2.390 2.151 2.629 2.575 2.444 2.644 0.015 4 0 "[ . 1 . 2]" 1 2042 1 12 DT M7 1 13 DC H6 5.000 . 5.500 5.247 5.191 5.310 . 0 0 "[ . 1 . 2]" 1 2043 1 13 DC H4' 1 13 DC H5 5.730 5.157 6.303 5.002 4.963 5.020 0.194 18 0 "[ . 1 . 2]" 1 2044 1 2 DG H2' 1 2 DG H8 3.177 2.859 3.495 2.496 2.466 2.525 0.393 9 0 "[ . 1 . 2]" 1 2045 1 2 DG H1' 1 2 DG H8 4.448 4.003 4.893 3.908 3.901 3.915 0.102 16 0 "[ . 1 . 2]" 1 2046 1 1 DG H1' 1 2 DG H3' 5.000 . 5.500 5.538 5.513 5.576 0.076 17 0 "[ . 1 . 2]" 1 2047 1 6 DG H1' 1 6 DG H3' 3.625 3.000 4.250 3.943 3.926 3.956 . 0 0 "[ . 1 . 2]" 1 2048 1 10 DG H2' 1 10 DG H8 2.690 2.421 2.959 2.542 2.254 2.631 0.167 11 0 "[ . 1 . 2]" 1 2049 1 13 DC Q2' 1 14 DA H8 3.625 3.000 4.250 2.414 2.408 2.421 0.592 4 20 [***+*************-**] 1 2050 1 1 DG H1' 1 1 DG H3' 3.625 3.000 4.250 3.878 3.841 3.900 . 0 0 "[ . 1 . 2]" 1 2051 1 12 DT H1' 1 12 DT H4' 3.625 3.000 4.250 3.203 3.105 3.246 . 0 0 "[ . 1 . 2]" 1 2052 1 15 DG H2'' 1 15 DG H8 3.446 3.101 3.791 4.191 4.187 4.202 0.411 14 0 "[ . 1 . 2]" 1 2053 1 10 DG H1' 1 11 DT H3' 4.875 4.250 5.500 5.311 4.895 5.543 0.043 18 0 "[ . 1 . 2]" 1 2054 1 8 DT H3' 1 9 DT H6 3.625 3.000 4.250 4.316 4.111 4.405 0.155 12 0 "[ . 1 . 2]" 1 2055 1 8 DT H2' 1 9 DT H6 2.322 2.090 2.554 2.588 2.374 2.768 0.214 13 0 "[ . 1 . 2]" 1 2056 1 4 DG H2'' 1 5 DT H6 3.620 3.258 3.982 2.972 2.917 3.051 0.341 12 0 "[ . 1 . 2]" 1 2057 1 8 DT H1' 1 9 DT Q5' 3.386 3.047 3.725 3.438 3.003 3.798 0.073 16 0 "[ . 1 . 2]" 1 2058 1 3 DG H1' 1 3 DG H3' 3.625 3.000 4.250 3.885 3.823 3.914 . 0 0 "[ . 1 . 2]" 1 2059 1 12 DT H4' 1 12 DT H6 3.625 3.000 4.250 4.308 4.275 4.342 0.092 15 0 "[ . 1 . 2]" 1 2060 1 9 DT H1' 1 9 DT H4' 5.000 . 5.500 2.886 2.748 3.001 . 0 0 "[ . 1 . 2]" 1 2061 1 7 DA H2 1 8 DT H1' 4.183 3.765 4.601 4.409 4.089 4.650 0.049 6 0 "[ . 1 . 2]" 1 2062 1 14 DA H1' 1 14 DA H2 3.410 3.069 3.751 4.375 4.370 4.388 0.637 18 20 [***********-*****+**] 1 2063 1 7 DA H1' 1 8 DT M7 3.481 3.133 3.829 4.009 3.835 4.121 0.292 15 0 "[ . 1 . 2]" 1 2064 1 4 DG H2' 1 4 DG H8 2.816 2.534 3.098 2.152 2.100 2.211 0.434 20 0 "[ . 1 . 2]" 1 2065 1 3 DG H2'' 1 4 DG H8 2.816 2.534 3.098 2.345 2.248 2.398 0.286 20 0 "[ . 1 . 2]" 1 2066 1 4 DG H8 1 5 DT H6 4.875 4.250 5.500 5.785 5.613 5.927 0.427 19 0 "[ . 1 . 2]" 1 2067 1 13 DC H1' 1 14 DA Q5' 2.566 2.309 2.823 2.997 2.980 3.021 0.198 18 0 "[ . 1 . 2]" 1 2068 1 13 DC H1' 1 14 DA H8 3.537 3.183 3.891 4.214 4.198 4.251 0.360 18 0 "[ . 1 . 2]" 1 2069 1 9 DT H6 1 10 DG H8 3.883 3.495 4.271 4.007 3.550 4.390 0.119 16 0 "[ . 1 . 2]" 1 2070 1 10 DG H1' 1 11 DT M7 3.514 3.163 3.865 3.700 3.315 4.013 0.148 16 0 "[ . 1 . 2]" 1 2071 1 7 DA H2'' 1 8 DT H6 3.688 3.319 4.057 2.941 2.886 3.010 0.433 19 0 "[ . 1 . 2]" 1 2072 1 7 DA H3' 1 8 DT H6 4.875 4.250 5.500 4.857 4.302 5.585 0.085 16 0 "[ . 1 . 2]" 1 2073 1 7 DA H8 1 8 DT M7 3.279 2.951 3.607 2.756 2.657 2.833 0.294 8 0 "[ . 1 . 2]" 1 2074 1 6 DG H2'' 1 7 DA H8 2.872 2.585 3.159 2.208 2.170 2.278 0.415 8 0 "[ . 1 . 2]" 1 2075 1 6 DG H2' 1 7 DA H8 2.659 2.393 2.925 2.155 2.127 2.181 0.266 16 0 "[ . 1 . 2]" 1 2076 1 6 DG H8 1 7 DA H8 5.000 . 5.500 4.326 3.968 4.639 . 0 0 "[ . 1 . 2]" 1 2077 1 7 DA H4' 1 7 DA H8 3.868 3.481 4.255 4.794 4.628 5.016 0.761 6 8 "[ *+* 1 **-.* *]" 1 2078 1 10 DG H8 1 11 DT M7 4.101 3.691 4.511 3.434 3.371 3.527 0.320 19 0 "[ . 1 . 2]" 1 2079 1 9 DT H2' 1 9 DT H6 2.612 2.351 2.873 2.307 2.148 2.575 0.203 16 0 "[ . 1 . 2]" 1 2080 1 11 DT H2' 1 11 DT H6 2.778 2.500 3.056 2.412 2.272 2.455 0.228 11 0 "[ . 1 . 2]" 1 2081 1 5 DT H2' 1 5 DT H6 2.567 2.310 2.824 2.200 2.179 2.265 0.131 15 0 "[ . 1 . 2]" 1 2082 1 8 DT H1' 1 8 DT H2' 3.382 3.044 3.720 2.955 2.928 2.974 0.116 6 0 "[ . 1 . 2]" 1 2083 1 6 DG H1' 1 6 DG H2'' 2.529 2.276 2.782 2.203 2.185 2.222 0.091 3 0 "[ . 1 . 2]" 1 2084 1 2 DG H3' 1 2 DG H8 4.177 3.759 4.595 3.926 3.847 4.017 . 0 0 "[ . 1 . 2]" 1 2085 1 11 DT H1' 1 11 DT H2' 3.187 2.868 3.506 2.877 2.847 2.894 0.021 11 0 "[ . 1 . 2]" 1 2086 1 15 DG H3' 1 15 DG H8 4.157 3.741 4.573 3.576 3.555 3.617 0.186 4 0 "[ . 1 . 2]" 1 2087 1 1 DG H2' 1 1 DG H5'' 3.625 3.000 4.250 4.219 4.132 4.276 0.026 18 0 "[ . 1 . 2]" 1 2088 1 13 DC H1' 1 13 DC H3' 3.625 3.000 4.250 3.932 3.930 3.935 . 0 0 "[ . 1 . 2]" 1 2089 1 3 DG H1' 1 3 DG H2'' 2.335 2.101 2.569 2.218 2.198 2.234 . 0 0 "[ . 1 . 2]" 1 2090 1 11 DT H1' 1 12 DT Q5' 5.000 . 5.500 3.395 3.271 3.550 . 0 0 "[ . 1 . 2]" 1 2091 1 15 DG H1' 1 15 DG H4' 3.625 3.000 4.250 3.318 3.196 3.374 . 0 0 "[ . 1 . 2]" 1 2092 1 2 DG H2'' 1 3 DG H8 3.119 2.807 3.431 2.739 2.662 2.794 0.145 20 0 "[ . 1 . 2]" 1 2093 1 3 DG H3' 1 4 DG H8 3.661 3.295 4.027 4.320 4.146 4.356 0.329 16 0 "[ . 1 . 2]" 1 2094 1 1 DG H1' 1 2 DG H8 3.772 3.395 4.149 4.170 4.128 4.202 0.053 2 0 "[ . 1 . 2]" 1 2095 1 4 DG H1' 1 5 DT H3' 4.875 4.250 5.500 4.359 4.229 4.876 0.021 3 0 "[ . 1 . 2]" 1 2096 1 5 DT H1' 1 6 DG H5' 3.052 2.747 3.357 2.872 2.710 3.355 0.037 16 0 "[ . 1 . 2]" 1 2097 1 3 DG H2'' 1 3 DG H8 3.349 3.014 3.684 3.931 3.805 3.964 0.280 10 0 "[ . 1 . 2]" 1 2098 1 9 DT H3' 1 9 DT H6 3.625 3.000 4.250 3.445 3.232 3.921 . 0 0 "[ . 1 . 2]" 1 2099 1 11 DT H3' 1 11 DT H6 3.625 3.000 4.250 3.145 2.944 3.360 0.056 11 0 "[ . 1 . 2]" 1 2100 1 9 DT H4' 1 9 DT H6 4.875 4.250 5.500 3.975 3.803 4.138 0.447 4 0 "[ . 1 . 2]" 1 2101 1 10 DG H1' 1 11 DT H6 2.939 2.645 3.233 3.420 3.125 3.531 0.298 17 0 "[ . 1 . 2]" 1 2102 1 14 DA H1' 1 14 DA H3' 3.074 2.767 3.381 3.895 3.891 3.907 0.526 18 20 [*****************+-*] 1 2103 1 15 DG H2' 1 15 DG H8 3.370 3.033 3.707 2.770 2.764 2.782 0.269 10 0 "[ . 1 . 2]" 1 2104 1 12 DT H2' 1 13 DC H5 2.441 2.197 2.685 2.209 2.196 2.242 0.001 13 0 "[ . 1 . 2]" 1 2105 1 12 DT H1' 1 13 DC H3' 4.875 4.250 5.500 5.646 5.629 5.675 0.175 17 0 "[ . 1 . 2]" 1 2106 1 12 DT H3' 1 12 DT H6 2.710 2.439 2.981 3.170 3.122 3.215 0.234 13 0 "[ . 1 . 2]" 1 2107 1 11 DT H3' 1 12 DT H6 2.999 2.699 3.299 3.592 3.551 3.669 0.370 11 0 "[ . 1 . 2]" 1 2108 1 14 DA H2'' 1 14 DA H8 3.625 3.000 4.250 4.102 4.014 4.146 . 0 0 "[ . 1 . 2]" 1 2109 1 13 DC H3' 1 13 DC H5 3.625 3.000 4.250 4.658 4.636 4.671 0.421 20 0 "[ . 1 . 2]" 1 2110 1 7 DA H2'' 1 7 DA H8 3.625 3.000 4.250 4.147 3.702 4.413 0.163 9 0 "[ . 1 . 2]" 1 2111 1 7 DA H8 1 8 DT H6 3.888 3.500 4.276 4.547 4.396 4.769 0.493 5 0 "[ . 1 . 2]" 1 2112 2 2 DT H3 2 3 DG H1 3.400 . 5.500 4.266 4.029 4.368 . 0 0 "[ . 1 . 2]" 1 2113 2 2 DT H3 2 2 DT M7 3.400 . 5.500 4.159 4.149 4.164 . 0 0 "[ . 1 . 2]" 1 2114 1 14 DA H2 2 2 DT H3 3.400 . 5.500 3.381 3.377 3.385 . 0 0 "[ . 1 . 2]" 1 2115 1 13 DC H41 2 2 DT H3 3.400 . 5.500 3.948 3.900 3.988 . 0 0 "[ . 1 . 2]" 1 2116 1 12 DT H3 1 12 DT M7 3.400 . 5.500 4.145 4.137 4.150 . 0 0 "[ . 1 . 2]" 1 2117 1 11 DT H3 1 11 DT M7 3.400 . 5.500 4.131 4.124 4.138 . 0 0 "[ . 1 . 2]" 1 2118 1 12 DT H3 2 3 DG H1 3.400 . 5.500 3.187 3.090 3.567 . 0 0 "[ . 1 . 2]" 1 2119 1 10 DG H1 1 11 DT H3 3.400 . 5.500 3.944 3.606 4.422 . 0 0 "[ . 1 . 2]" 1 2120 1 12 DT H3 1 13 DC H41 3.400 . 5.500 3.736 3.589 3.954 . 0 0 "[ . 1 . 2]" 1 2121 1 5 DT H3 1 5 DT M7 3.400 . 5.500 4.138 4.134 4.144 . 0 0 "[ . 1 . 2]" 1 2122 1 8 DT H3 1 8 DT M7 3.400 . 5.500 4.140 4.129 4.147 . 0 0 "[ . 1 . 2]" 1 2123 1 9 DT H3 1 9 DT M7 3.400 . 5.500 4.133 4.127 4.140 . 0 0 "[ . 1 . 2]" 1 2124 2 9 DT H3 2 9 DT M7 3.400 . 5.500 4.138 4.129 4.146 . 0 0 "[ . 1 . 2]" 1 2125 1 12 DT M7 2 3 DG H1 3.400 . 5.500 5.006 4.846 5.061 . 0 0 "[ . 1 . 2]" 1 2126 1 12 DT M7 1 13 DC H41 3.400 . 5.500 2.968 2.838 3.073 . 0 0 "[ . 1 . 2]" 1 2127 1 11 DT H3 1 12 DT M7 3.400 . 5.500 4.993 4.866 5.095 . 0 0 "[ . 1 . 2]" 1 2128 1 12 DT H3 2 4 DA H2 3.400 . 5.500 2.233 2.194 2.270 . 0 0 "[ . 1 . 2]" 1 2129 1 12 DT H3 2 5 DA H2 3.400 . 5.500 5.041 5.013 5.072 . 0 0 "[ . 1 . 2]" 1 2130 1 11 DT H3 2 5 DA H2 3.400 . 5.500 2.229 2.194 2.489 . 0 0 "[ . 1 . 2]" 1 2131 1 11 DT H3 2 4 DA H2 3.400 . 5.500 4.603 4.346 4.961 . 0 0 "[ . 1 . 2]" 1 2132 1 9 DT H3 1 10 DG H1 3.400 . 5.500 4.078 3.658 4.434 . 0 0 "[ . 1 . 2]" 1 2133 2 9 DT H3 2 10 DC H5 3.400 . 5.500 4.986 4.659 5.110 . 0 0 "[ . 1 . 2]" 1 2134 1 8 DT H3 1 9 DT H3 3.400 . 5.500 3.933 3.412 5.019 . 0 0 "[ . 1 . 2]" 1 2135 1 7 DA H2 2 9 DT H3 3.400 . 5.500 2.965 2.232 3.358 . 0 0 "[ . 1 . 2]" 1 2136 1 14 DA H61 2 2 DT H3 3.400 . 5.500 1.758 1.744 1.765 0.056 18 0 "[ . 1 . 2]" 1 2137 1 14 DA H62 2 2 DT H3 3.400 . 5.500 3.348 3.337 3.357 . 0 0 "[ . 1 . 2]" 1 2138 1 10 DG H1 2 6 DC H42 3.400 . 5.500 3.317 3.253 3.360 . 0 0 "[ . 1 . 2]" 1 2139 1 10 DG H1 2 6 DC H41 3.400 . 5.500 1.757 1.725 1.783 0.075 11 0 "[ . 1 . 2]" 1 2140 1 10 DG H1 1 10 DG H22 3.400 . 5.500 3.488 3.484 3.493 . 0 0 "[ . 1 . 2]" 1 2141 1 10 DG H1 1 10 DG H21 3.400 . 5.500 2.227 2.222 2.233 . 0 0 "[ . 1 . 2]" 1 2142 2 6 DC H41 2 6 DC H42 3.400 . 5.500 1.746 1.742 1.749 0.058 11 0 "[ . 1 . 2]" 1 2143 1 6 DG H1 2 10 DC H42 3.400 . 5.500 3.498 3.350 4.098 . 0 0 "[ . 1 . 2]" 1 2144 1 6 DG H1 2 10 DC H41 3.400 . 5.500 1.922 1.772 2.594 0.028 20 0 "[ . 1 . 2]" 1 2145 1 6 DG H1 1 6 DG H22 3.400 . 5.500 3.490 3.488 3.491 . 0 0 "[ . 1 . 2]" 1 2146 1 6 DG H1 1 6 DG H21 3.400 . 5.500 2.231 2.224 2.237 . 0 0 "[ . 1 . 2]" 1 2147 1 13 DC H41 1 13 DC H42 3.400 . 5.500 1.748 1.747 1.750 0.053 17 0 "[ . 1 . 2]" 1 2148 2 10 DC H41 2 10 DC H42 3.400 . 5.500 1.751 1.750 1.753 0.050 6 0 "[ . 1 . 2]" 1 2149 1 13 DC H42 2 3 DG H1 3.400 . 5.500 4.114 4.060 4.143 . 0 0 "[ . 1 . 2]" 1 2150 1 13 DC H41 2 3 DG H1 3.400 . 5.500 2.641 2.572 2.669 . 0 0 "[ . 1 . 2]" 1 2151 2 3 DG H1 2 3 DG H22 3.400 . 5.500 3.485 3.480 3.490 . 0 0 "[ . 1 . 2]" 1 2152 2 3 DG H1 2 3 DG H21 3.400 . 5.500 2.219 2.212 2.226 . 0 0 "[ . 1 . 2]" 1 2153 1 14 DA H61 1 14 DA H62 3.400 . 5.500 1.750 1.749 1.751 0.051 14 0 "[ . 1 . 2]" 1 2154 2 12 DC H41 2 12 DC H42 3.400 . 5.500 1.751 1.750 1.753 0.050 12 0 "[ . 1 . 2]" 1 2155 1 4 DG H1 2 12 DC H42 3.400 . 5.500 3.367 3.303 3.684 . 0 0 "[ . 1 . 2]" 1 2156 1 4 DG H1 2 12 DC H41 3.400 . 5.500 1.802 1.761 2.118 0.039 3 0 "[ . 1 . 2]" 1 2157 1 4 DG H1 1 4 DG H21 3.400 . 5.500 2.232 2.225 2.237 . 0 0 "[ . 1 . 2]" 1 2158 1 4 DG H1 1 4 DG H22 3.400 . 5.500 3.490 3.487 3.493 . 0 0 "[ . 1 . 2]" 1 2159 2 13 DC H41 2 13 DC H42 3.400 . 5.500 1.751 1.750 1.752 0.050 12 0 "[ . 1 . 2]" 1 2160 1 3 DG H1 2 13 DC H42 3.400 . 5.500 4.045 3.718 4.085 . 0 0 "[ . 1 . 2]" 1 2161 1 3 DG H1 2 13 DC H41 3.400 . 5.500 2.554 2.393 2.592 . 0 0 "[ . 1 . 2]" 1 2162 1 3 DG H1 1 3 DG H22 3.400 . 5.500 3.487 3.480 3.491 . 0 0 "[ . 1 . 2]" 1 2163 1 3 DG H1 1 3 DG H21 3.400 . 5.500 2.221 2.212 2.224 . 0 0 "[ . 1 . 2]" 1 2164 1 2 DG H1 2 14 DC H41 3.400 . 5.500 1.781 1.769 1.792 0.031 17 0 "[ . 1 . 2]" 1 2165 1 2 DG H1 2 14 DC H42 3.400 . 5.500 3.378 3.364 3.390 . 0 0 "[ . 1 . 2]" 1 2166 2 14 DC H41 2 14 DC H42 3.400 . 5.500 1.751 1.750 1.752 0.050 6 0 "[ . 1 . 2]" 1 2167 2 1 DC H41 2 1 DC H42 3.400 . 5.500 1.752 1.751 1.754 0.049 18 0 "[ . 1 . 2]" 1 2168 1 15 DG H1 2 1 DC H42 3.400 . 5.500 3.847 3.630 4.162 . 0 0 "[ . 1 . 2]" 1 2169 1 15 DG H1 2 1 DC H41 3.400 . 5.500 2.334 2.095 2.692 . 0 0 "[ . 1 . 2]" 1 2170 1 9 DT H3 2 7 DA H2 3.400 . 5.500 2.740 2.246 3.273 . 0 0 "[ . 1 . 2]" 1 2171 1 8 DT H3 2 8 DA H2 3.400 . 5.500 2.482 2.202 3.308 . 0 0 "[ . 1 . 2]" 1 2172 1 8 DT H3 2 8 DA H62 3.400 . 5.500 4.361 3.443 4.642 . 0 0 "[ . 1 . 2]" 1 2173 1 8 DT H3 2 8 DA H61 3.400 . 5.500 2.919 1.859 3.250 . 0 0 "[ . 1 . 2]" 1 2174 1 12 DT H3 2 4 DA H61 3.400 . 5.500 3.212 3.161 3.281 . 0 0 "[ . 1 . 2]" 1 2175 1 11 DT H3 2 5 DA H61 3.400 . 5.500 3.345 3.076 3.401 . 0 0 "[ . 1 . 2]" 1 2176 1 12 DT H3 2 4 DA H62 3.400 . 5.500 4.606 4.563 4.661 . 0 0 "[ . 1 . 2]" 1 2177 1 11 DT H3 2 5 DA H62 3.400 . 5.500 4.638 4.400 4.693 . 0 0 "[ . 1 . 2]" 1 2178 1 7 DA H62 2 9 DT H3 3.400 . 5.500 3.803 3.337 4.565 . 0 0 "[ . 1 . 2]" 1 2179 1 7 DA H61 2 9 DT H3 3.400 . 5.500 2.285 1.764 3.154 0.036 16 0 "[ . 1 . 2]" 1 2180 1 9 DT H3 2 7 DA H61 3.400 . 5.500 2.562 1.786 3.067 0.014 10 0 "[ . 1 . 2]" 1 2181 1 9 DT H3 2 7 DA H62 3.400 . 5.500 4.054 3.369 4.495 . 0 0 "[ . 1 . 2]" 1 2182 1 5 DT H3 2 11 DA H2 3.400 . 5.500 2.244 2.196 2.291 . 0 0 "[ . 1 . 2]" 1 2183 1 10 DG H1 1 11 DT M7 3.400 . 5.500 4.574 4.258 5.030 . 0 0 "[ . 1 . 2]" 1 2184 1 5 DT H3 1 6 DG H1 3.400 . 5.500 4.099 3.723 4.483 . 0 0 "[ . 1 . 2]" 1 2185 1 4 DG H1 1 5 DT H3 3.400 . 5.500 3.705 3.487 4.023 . 0 0 "[ . 1 . 2]" 1 2186 1 3 DG H1 1 4 DG H1 3.400 . 5.500 3.995 3.802 4.652 . 0 0 "[ . 1 . 2]" 1 2187 2 3 DG H1 2 4 DA H2 3.400 . 5.500 3.428 3.217 3.625 . 0 0 "[ . 1 . 2]" 1 2188 1 6 DG H1 1 7 DA H2 3.400 . 5.500 4.169 3.799 4.630 . 0 0 "[ . 1 . 2]" 1 2189 1 13 DC H5 2 3 DG H1 3.400 . 5.500 5.106 5.068 5.126 . 0 0 "[ . 1 . 2]" 1 2190 1 10 DG H1 2 6 DC H5 3.400 . 5.500 4.645 4.548 4.706 . 0 0 "[ . 1 . 2]" 1 2191 1 10 DG H1 2 7 DA H2 3.400 . 5.500 5.075 4.993 5.113 . 0 0 "[ . 1 . 2]" 1 2192 1 10 DG H1 2 5 DA H2 3.400 . 5.500 4.340 3.887 4.738 . 0 0 "[ . 1 . 2]" 1 2193 2 9 DT H3 2 10 DC H41 3.400 . 5.500 3.472 2.823 4.211 . 0 0 "[ . 1 . 2]" 1 2194 1 4 DG H1 2 13 DC H42 3.400 . 5.500 4.950 4.145 5.125 . 0 0 "[ . 1 . 2]" 1 2195 1 4 DG H1 2 11 DA H2 3.400 . 5.500 4.243 3.740 4.597 . 0 0 "[ . 1 . 2]" 1 2196 1 4 DG H1 2 13 DC H41 3.400 . 5.500 3.960 3.419 4.090 . 0 0 "[ . 1 . 2]" 1 2197 1 11 DT H3 2 6 DC H41 3.400 . 5.500 4.975 4.816 5.044 . 0 0 "[ . 1 . 2]" 1 2198 1 9 DT H3 2 6 DC H41 3.400 . 5.500 3.963 3.780 4.299 . 0 0 "[ . 1 . 2]" 1 2199 1 8 DT H3 2 7 DA H2 3.400 . 5.500 4.850 4.526 5.074 . 0 0 "[ . 1 . 2]" 1 2200 1 9 DT H3 2 6 DC H42 3.400 . 5.500 5.191 5.120 5.279 . 0 0 "[ . 1 . 2]" 1 2201 1 6 DG H1 2 10 DC H5 3.400 . 5.500 4.739 4.629 5.094 . 0 0 "[ . 1 . 2]" 1 2202 1 13 DC H1' 2 3 DG H1 3.400 . 5.500 5.068 5.048 5.103 . 0 0 "[ . 1 . 2]" 1 2203 1 3 DG H1 2 13 DC H1' 3.400 . 5.500 5.056 5.033 5.070 . 0 0 "[ . 1 . 2]" 1 2204 1 3 DG H1 2 13 DC H5 3.400 . 5.500 5.062 4.704 5.104 . 0 0 "[ . 1 . 2]" 1 2205 1 10 DG H1 2 5 DA H62 3.400 . 5.500 3.882 3.430 4.879 . 0 0 "[ . 1 . 2]" 1 2206 1 7 DA H61 1 8 DT H3 3.400 . 5.500 4.243 4.087 4.350 . 0 0 "[ . 1 . 2]" 1 2207 1 4 DG H1 2 12 DC H5 3.400 . 5.500 4.671 4.597 4.900 . 0 0 "[ . 1 . 2]" 1 2208 1 2 DG H1 2 14 DC H5 3.400 . 5.500 4.708 4.695 4.718 . 0 0 "[ . 1 . 2]" 1 2209 2 8 DA H62 2 9 DT H3 3.400 . 5.500 4.929 4.477 5.083 . 0 0 "[ . 1 . 2]" 1 2210 1 7 DA H62 1 8 DT H3 3.400 . 5.500 5.068 4.972 5.159 . 0 0 "[ . 1 . 2]" 1 2211 1 3 DG H21 1 3 DG H22 3.400 . 5.500 1.752 1.751 1.753 0.049 6 0 "[ . 1 . 2]" 1 2212 1 13 DC H42 2 2 DT H3 3.400 . 5.500 5.172 5.156 5.200 . 0 0 "[ . 1 . 2]" 1 2213 1 14 DA H62 1 15 DG H1 3.400 . 5.500 5.009 5.003 5.016 . 0 0 "[ . 1 . 2]" 1 2214 1 14 DA H61 1 15 DG H1 3.400 . 5.500 4.715 4.572 4.793 . 0 0 "[ . 1 . 2]" 1 2215 2 1 DC H42 2 2 DT H3 3.400 . 5.500 5.062 5.024 5.234 . 0 0 "[ . 1 . 2]" 1 2216 2 1 DC H41 2 2 DT H3 3.400 . 5.500 4.594 4.481 4.669 . 0 0 "[ . 1 . 2]" 1 2217 1 7 DA Q5' 3 11 THR MG 3.650 . 4.500 3.404 3.132 3.766 . 0 0 "[ . 1 . 2]" 1 2218 1 7 DA H4' 3 11 THR MG 3.650 . 4.500 4.472 4.305 4.589 0.089 10 0 "[ . 1 . 2]" 1 2219 1 7 DA H3' 3 11 THR MG 4.000 . 4.000 3.214 2.191 4.021 0.021 9 0 "[ . 1 . 2]" 1 2220 1 7 DA H8 3 11 THR MG 5.000 . 5.000 3.731 2.404 5.004 0.004 16 0 "[ . 1 . 2]" 1 2221 1 8 DT H6 3 11 THR MG 5.000 . 5.000 4.702 4.096 5.023 0.023 8 0 "[ . 1 . 2]" 1 2222 1 8 DT M7 3 10 ARG QD 3.650 . 4.500 2.906 1.802 3.789 . 0 0 "[ . 1 . 2]" 1 2223 1 8 DT H3' 3 10 ARG QB 3.650 . 4.500 3.635 2.957 4.029 . 0 0 "[ . 1 . 2]" 1 2224 1 6 DG H1' 3 14 LYS QE 3.650 . 4.500 4.506 4.481 4.524 0.024 18 0 "[ . 1 . 2]" 1 2225 1 7 DA H3' 3 22 LYS QG 3.650 . 4.500 4.507 4.272 4.600 0.100 13 0 "[ . 1 . 2]" 1 2226 1 7 DA H1' 3 23 ARG QB 3.650 . 4.500 3.878 3.569 4.282 . 0 0 "[ . 1 . 2]" 1 2227 1 7 DA H4' 3 23 ARG QB 3.650 . 4.500 4.021 3.443 4.410 . 0 0 "[ . 1 . 2]" 1 2228 1 7 DA Q5' 3 23 ARG QB 3.650 . 4.500 4.023 3.739 4.360 . 0 0 "[ . 1 . 2]" 1 2229 1 7 DA H3' 3 23 ARG QG 3.650 . 5.500 4.345 4.154 4.597 . 0 0 "[ . 1 . 2]" 1 2230 1 7 DA H4' 3 23 ARG QG 3.650 . 4.500 2.409 1.998 2.681 . 0 0 "[ . 1 . 2]" 1 2231 1 7 DA Q5' 3 23 ARG QG 3.650 . 4.500 2.690 2.326 3.033 . 0 0 "[ . 1 . 2]" 1 2232 1 7 DA H1' 3 23 ARG QD 3.650 . 4.500 2.075 1.895 2.980 . 0 0 "[ . 1 . 2]" 1 2233 1 9 DT H3' 3 25 LEU QD 3.650 . 4.500 3.488 3.410 3.743 . 0 0 "[ . 1 . 2]" 1 2234 1 10 DG H3' 3 25 LEU QD 3.650 . 4.500 3.945 3.596 4.033 . 0 0 "[ . 1 . 2]" 1 2235 1 9 DT H5' 3 25 LEU QD 3.650 . 4.500 1.841 1.801 1.948 . 0 0 "[ . 1 . 2]" 1 2236 1 9 DT H4' 3 25 LEU QD 3.650 . 4.500 1.986 1.925 2.375 . 0 0 "[ . 1 . 2]" 1 2237 1 10 DG H4' 3 25 LEU QD 3.650 . 4.500 2.524 1.996 3.006 . 0 0 "[ . 1 . 2]" 1 2238 1 9 DT H1' 3 25 LEU QD 3.650 . 4.500 3.479 3.318 3.668 . 0 0 "[ . 1 . 2]" 1 2239 1 10 DG H1' 3 25 LEU QD 3.650 . 4.500 4.504 4.253 4.635 0.135 11 0 "[ . 1 . 2]" 1 2240 2 7 DA H4' 3 28 TYR QB 3.650 . 4.500 3.297 2.876 3.627 . 0 0 "[ . 1 . 2]" 1 2241 1 10 DG H1' 3 28 TYR QD 3.650 . 4.500 4.591 4.509 4.740 0.240 16 0 "[ . 1 . 2]" 1 2242 1 8 DT H1' 3 28 TYR QD 3.650 . 4.500 2.735 2.259 3.075 . 0 0 "[ . 1 . 2]" 1 2243 1 9 DT H4' 3 28 TYR QD 3.650 . 4.500 2.529 2.030 2.954 . 0 0 "[ . 1 . 2]" 1 2244 1 10 DG H4' 3 28 TYR QD 3.650 . 4.500 4.551 4.326 4.699 0.199 19 0 "[ . 1 . 2]" 1 2245 1 10 DG Q5' 3 28 TYR QD 3.650 . 4.500 3.404 3.064 3.801 . 0 0 "[ . 1 . 2]" 1 2246 1 9 DT Q5' 3 28 TYR QD 3.650 . 4.500 3.578 3.364 3.904 . 0 0 "[ . 1 . 2]" 1 2247 1 10 DG H4' 3 29 MET HA 3.650 . 4.500 3.998 3.823 4.214 . 0 0 "[ . 1 . 2]" 1 2248 1 9 DT Q5' 3 29 MET QB 3.650 . 4.500 2.641 2.453 2.795 . 0 0 "[ . 1 . 2]" 1 2249 1 10 DG Q5' 3 29 MET HG3 3.650 . 4.500 3.069 2.695 3.253 . 0 0 "[ . 1 . 2]" 1 2250 1 10 DG Q5' 3 33 ASN HD21 3.650 . 4.500 4.484 3.991 4.657 0.157 16 0 "[ . 1 . 2]" 1 2251 1 10 DG Q5' 3 33 ASN HD22 3.650 . 4.500 3.426 2.706 4.531 0.031 16 0 "[ . 1 . 2]" 1 2252 1 11 DT Q5' 3 36 ARG QD 3.650 . 4.500 2.248 1.783 2.906 0.017 15 0 "[ . 1 . 2]" 1 2253 1 11 DT H4' 3 36 ARG QB 3.650 . 4.500 2.246 1.964 3.075 . 0 0 "[ . 1 . 2]" 1 2254 1 11 DT Q5' 3 36 ARG QB 3.650 . 4.500 3.670 3.321 4.556 0.056 18 0 "[ . 1 . 2]" 1 2255 1 11 DT H3' 3 36 ARG QB 3.650 . 4.500 4.398 4.186 4.656 0.156 18 0 "[ . 1 . 2]" 1 2256 1 11 DT H1' 3 36 ARG QD 3.650 . 4.500 4.161 1.920 4.714 0.214 11 0 "[ . 1 . 2]" 1 2257 1 11 DT H3' 3 40 ARG QD 3.650 . 4.500 3.970 2.960 4.515 0.015 5 0 "[ . 1 . 2]" 1 2258 2 5 DA H4' 3 53 LYS QG 3.650 . 4.500 3.377 2.200 3.532 . 0 0 "[ . 1 . 2]" 1 2259 2 5 DA H3' 3 53 LYS QG 3.650 . 4.500 4.772 4.713 4.924 0.424 7 0 "[ . 1 . 2]" 1 2260 2 5 DA Q5' 3 53 LYS QG 3.650 . 4.500 1.787 1.743 1.931 0.057 2 0 "[ . 1 . 2]" 1 2261 2 6 DC H3' 3 59 TRP HD1 3.650 . 5.500 4.522 4.077 4.727 . 0 0 "[ . 1 . 2]" 1 2262 2 6 DC H4' 3 59 TRP HD1 3.650 . 4.500 2.016 1.973 2.225 . 0 0 "[ . 1 . 2]" 1 2263 2 6 DC Q5' 3 59 TRP HD1 4.000 . 4.000 2.781 2.492 2.935 . 0 0 "[ . 1 . 2]" 1 2264 2 7 DA H3' 3 60 LYS QE 3.650 . 4.500 3.521 2.438 4.256 . 0 0 "[ . 1 . 2]" 1 2265 2 7 DA H4' 3 60 LYS QE 3.650 . 4.500 3.960 2.749 4.572 0.072 16 0 "[ . 1 . 2]" 1 2266 2 7 DA Q5' 3 60 LYS QE 3.650 . 4.500 2.782 2.013 3.564 . 0 0 "[ . 1 . 2]" 1 2267 2 9 DT H3' 3 78 LYS QG 3.650 . 4.500 3.927 2.563 4.596 0.096 7 0 "[ . 1 . 2]" 1 2268 2 9 DT Q5' 3 78 LYS QG 3.650 . 4.500 2.251 1.951 2.712 . 0 0 "[ . 1 . 2]" 1 2269 2 9 DT H1' 3 78 LYS QG 3.650 . 4.500 4.688 4.505 4.875 0.375 19 0 "[ . 1 . 2]" 1 2270 2 11 DA H3' 3 85 LYS QE 3.650 . 4.500 3.088 2.011 4.319 . 0 0 "[ . 1 . 2]" 1 2271 2 11 DA H4' 3 85 LYS QE 3.650 . 4.500 3.260 2.010 4.263 . 0 0 "[ . 1 . 2]" 1 2272 2 11 DA Q5' 3 85 LYS QE 3.650 . 4.500 3.055 2.006 4.510 0.010 16 0 "[ . 1 . 2]" 1 2273 1 9 DT H6 3 25 LEU HG 5.500 . 5.500 5.775 5.723 5.919 0.419 16 0 "[ . 1 . 2]" 1 2274 1 9 DT H1' 3 25 LEU HG 3.650 . 4.500 2.720 2.490 3.507 . 0 0 "[ . 1 . 2]" 1 2275 1 9 DT H4' 3 25 LEU HG 3.650 . 4.500 2.140 1.892 2.390 . 0 0 "[ . 1 . 2]" 1 2276 1 9 DT Q5' 3 25 LEU HG 3.650 . 4.500 2.096 1.933 2.190 . 0 0 "[ . 1 . 2]" 1 2277 1 10 DG H3' 3 25 LEU HG 3.650 . 5.500 5.466 5.163 5.599 0.099 3 0 "[ . 1 . 2]" 1 2278 1 10 DG H4' 3 25 LEU HG 3.650 . 4.500 4.459 3.975 4.696 0.196 11 0 "[ . 1 . 2]" 1 2279 2 8 DA H4' 3 27 ALA MB 3.650 . 4.500 2.560 2.251 2.943 . 0 0 "[ . 1 . 2]" 1 2280 1 10 DG H3' 3 29 MET HB3 3.650 . 4.500 4.809 4.738 4.874 0.374 11 0 "[ . 1 . 2]" 1 2281 1 10 DG H4' 3 29 MET HG3 3.650 . 4.500 4.422 3.715 4.585 0.085 17 0 "[ . 1 . 2]" 1 2282 2 10 DC H5 3 2 VAL HB 3.650 . 8.500 6.520 3.572 8.505 0.005 10 0 "[ . 1 . 2]" 1 2283 2 8 DA P 3 5 ARG NH1 3.650 . 8.500 7.052 3.743 8.470 . 0 0 "[ . 1 . 2]" 1 2284 1 8 DT M7 3 10 ARG QD 3.650 . 4.500 3.999 1.804 4.510 0.010 15 0 "[ . 1 . 2]" 1 2285 1 9 DT M7 3 10 ARG QD 3.650 . 4.500 3.218 2.342 4.388 . 0 0 "[ . 1 . 2]" 1 2286 1 8 DT H3' 3 10 ARG QB 4.000 . 4.000 3.636 2.957 4.029 0.029 1 0 "[ . 1 . 2]" 1 2287 1 7 DA H3' 3 10 ARG QB 4.000 . 4.000 3.711 2.732 4.012 0.012 14 0 "[ . 1 . 2]" 1 2288 1 8 DT M7 3 13 ARG QB 4.000 . 4.000 3.708 2.210 4.060 0.060 10 0 "[ . 1 . 2]" 1 2289 1 9 DT M7 3 13 ARG QB 4.000 . 4.500 3.852 3.157 4.503 0.003 5 0 "[ . 1 . 2]" 1 2290 1 6 DG H1' 3 16 LYS QE 3.650 . 4.500 4.514 4.501 4.541 0.041 11 0 "[ . 1 . 2]" 1 2291 1 8 DT H1' 3 23 ARG QB 3.650 . 4.500 4.160 3.861 4.576 0.076 13 0 "[ . 1 . 2]" 1 2292 1 7 DA Q5' 3 23 ARG QB 3.650 . 4.500 4.414 3.909 4.580 0.080 20 0 "[ . 1 . 2]" 1 2293 1 8 DT Q5' 3 23 ARG HG3 3.650 . 4.500 4.540 4.143 4.671 0.171 15 0 "[ . 1 . 2]" 1 2294 1 8 DT H1' 3 23 ARG QD 3.650 . 4.500 2.081 1.898 3.029 . 0 0 "[ . 1 . 2]" 1 2295 1 7 DA H1' 3 23 ARG QD 3.650 . 4.500 4.489 4.178 4.620 0.120 10 0 "[ . 1 . 2]" 1 2296 2 9 DT H4' 3 26 SER HA 3.650 . 4.500 3.744 3.075 4.494 . 0 0 "[ . 1 . 2]" 1 2297 2 9 DT Q5' 3 26 SER HA 3.650 . 4.500 3.157 2.052 4.237 . 0 0 "[ . 1 . 2]" 1 2298 2 11 DA H4' 3 85 LYS HB2 3.650 . 5.000 4.768 3.998 5.545 0.545 18 1 "[ . 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 100 _Distance_constraint_stats_list.Viol_count 768 _Distance_constraint_stats_list.Viol_total 609.980 _Distance_constraint_stats_list.Viol_max 0.208 _Distance_constraint_stats_list.Viol_rms 0.0306 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0152 _Distance_constraint_stats_list.Viol_average_violations_only 0.0397 _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 3 26 SER 1.352 0.143 8 0 "[ . 1 . 2]" 3 27 ALA 0.409 0.033 10 0 "[ . 1 . 2]" 3 28 TYR 0.005 0.005 7 0 "[ . 1 . 2]" 3 29 MET 0.054 0.013 14 0 "[ . 1 . 2]" 3 30 PHE 4.068 0.167 18 0 "[ . 1 . 2]" 3 31 PHE 0.409 0.033 10 0 "[ . 1 . 2]" 3 32 ALA 0.370 0.101 16 0 "[ . 1 . 2]" 3 33 ASN 0.054 0.013 14 0 "[ . 1 . 2]" 3 34 GLU 4.164 0.167 18 0 "[ . 1 . 2]" 3 35 ASN 0.268 0.028 8 0 "[ . 1 . 2]" 3 36 ARG 0.957 0.101 16 0 "[ . 1 . 2]" 3 37 ASP 0.330 0.044 17 0 "[ . 1 . 2]" 3 38 ILE 1.764 0.086 18 0 "[ . 1 . 2]" 3 39 VAL 0.499 0.032 20 0 "[ . 1 . 2]" 3 40 ARG 0.592 0.061 19 0 "[ . 1 . 2]" 3 41 SER 0.330 0.044 17 0 "[ . 1 . 2]" 3 42 GLU 0.316 0.036 7 0 "[ . 1 . 2]" 3 43 ASN 0.232 0.032 20 0 "[ . 1 . 2]" 3 47 THR 0.019 0.019 13 0 "[ . 1 . 2]" 3 48 PHE 0.032 0.008 9 0 "[ . 1 . 2]" 3 50 GLN 0.034 0.014 13 0 "[ . 1 . 2]" 3 51 VAL 0.316 0.032 6 0 "[ . 1 . 2]" 3 52 GLY 0.888 0.074 18 0 "[ . 1 . 2]" 3 53 LYS 0.676 0.052 4 0 "[ . 1 . 2]" 3 54 LYS 0.034 0.014 13 0 "[ . 1 . 2]" 3 55 LEU 0.417 0.032 6 0 "[ . 1 . 2]" 3 56 GLY 2.016 0.078 9 0 "[ . 1 . 2]" 3 57 GLU 1.166 0.054 8 0 "[ . 1 . 2]" 3 58 LYS 0.670 0.049 18 0 "[ . 1 . 2]" 3 59 TRP 0.120 0.028 10 0 "[ . 1 . 2]" 3 60 LYS 1.160 0.078 9 0 "[ . 1 . 2]" 3 61 ALA 0.491 0.054 8 0 "[ . 1 . 2]" 3 62 LEU 0.670 0.049 18 0 "[ . 1 . 2]" 3 63 THR 0.821 0.074 5 0 "[ . 1 . 2]" 3 64 PRO 0.455 0.037 4 0 "[ . 1 . 2]" 3 66 GLU 1.274 0.074 5 0 "[ . 1 . 2]" 3 67 LYS 1.349 0.055 6 0 "[ . 1 . 2]" 3 68 GLN 0.455 0.037 4 0 "[ . 1 . 2]" 3 69 PRO 1.626 0.114 8 0 "[ . 1 . 2]" 3 70 TYR 4.330 0.208 17 0 "[ . 1 . 2]" 3 71 GLU 2.909 0.126 14 0 "[ . 1 . 2]" 3 72 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 3 73 LYS 1.636 0.114 8 0 "[ . 1 . 2]" 3 74 ALA 3.990 0.208 17 0 "[ . 1 . 2]" 3 75 GLN 3.007 0.126 14 0 "[ . 1 . 2]" 3 76 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 3 77 ASP 0.630 0.063 16 0 "[ . 1 . 2]" 3 78 LYS 0.137 0.061 8 0 "[ . 1 . 2]" 3 79 LYS 2.272 0.088 10 0 "[ . 1 . 2]" 3 81 TYR 0.726 0.063 16 0 "[ . 1 . 2]" 3 82 GLU 0.010 0.010 8 0 "[ . 1 . 2]" 3 83 SER 1.958 0.088 10 0 "[ . 1 . 2]" 3 84 GLU 0.132 0.041 20 0 "[ . 1 . 2]" 3 85 LYS 0.959 0.062 12 0 "[ . 1 . 2]" 3 86 GLU 0.807 0.076 5 0 "[ . 1 . 2]" 3 87 LEU 2.144 0.105 5 0 "[ . 1 . 2]" 3 88 TYR 0.298 0.061 5 0 "[ . 1 . 2]" 3 89 ASN 1.523 0.062 12 0 "[ . 1 . 2]" 3 90 ALA 0.797 0.076 5 0 "[ . 1 . 2]" 3 91 THR 1.512 0.105 5 0 "[ . 1 . 2]" 3 92 LEU 0.166 0.061 5 0 "[ . 1 . 2]" 3 93 ALA 0.669 0.052 18 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 3 26 SER O 3 29 MET H 2.000 . 2.200 2.020 1.959 2.064 . 0 0 "[ . 1 . 2]" 2 2 3 26 SER O 3 29 MET N 2.900 2.700 3.200 2.830 2.778 2.920 . 0 0 "[ . 1 . 2]" 2 3 3 26 SER O 3 30 PHE H 2.000 . 2.200 2.255 2.237 2.343 0.143 8 0 "[ . 1 . 2]" 2 4 3 26 SER O 3 30 PHE N 2.900 2.700 3.200 3.211 3.185 3.279 0.079 8 0 "[ . 1 . 2]" 2 5 3 27 ALA O 3 31 PHE H 2.000 . 2.200 2.220 2.204 2.233 0.033 10 0 "[ . 1 . 2]" 2 6 3 27 ALA O 3 31 PHE N 2.900 2.700 3.200 3.122 3.089 3.161 . 0 0 "[ . 1 . 2]" 2 7 3 28 TYR O 3 32 ALA H 2.000 . 2.200 2.027 1.990 2.099 . 0 0 "[ . 1 . 2]" 2 8 3 28 TYR O 3 32 ALA N 2.900 2.700 3.200 2.816 2.695 2.907 0.005 7 0 "[ . 1 . 2]" 2 9 3 29 MET O 3 33 ASN H 2.000 . 2.200 2.102 2.043 2.204 0.004 15 0 "[ . 1 . 2]" 2 10 3 29 MET O 3 33 ASN N 2.900 2.700 3.200 2.738 2.687 2.995 0.013 14 0 "[ . 1 . 2]" 2 11 3 32 ALA O 3 36 ARG H 2.000 . 2.200 2.026 1.952 2.205 0.005 15 0 "[ . 1 . 2]" 2 12 3 32 ALA O 3 36 ARG N 2.900 2.700 3.200 2.727 2.599 2.855 0.101 16 0 "[ . 1 . 2]" 2 13 3 35 ASN O 3 39 VAL H 2.000 . 2.200 2.042 1.970 2.088 . 0 0 "[ . 1 . 2]" 2 14 3 35 ASN O 3 39 VAL N 2.900 2.700 3.200 2.698 2.672 2.810 0.028 8 0 "[ . 1 . 2]" 2 15 3 39 VAL O 3 43 ASN H 2.000 . 2.200 2.210 2.175 2.232 0.032 20 0 "[ . 1 . 2]" 2 16 3 39 VAL O 3 43 ASN N 2.900 2.700 3.200 2.929 2.790 3.012 . 0 0 "[ . 1 . 2]" 2 17 3 51 VAL O 3 55 LEU H 2.000 . 2.200 2.162 2.037 2.232 0.032 6 0 "[ . 1 . 2]" 2 18 3 51 VAL O 3 55 LEU N 2.900 2.700 3.200 2.847 2.674 3.084 0.026 10 0 "[ . 1 . 2]" 2 19 3 52 GLY O 3 56 GLY H 2.000 . 2.200 2.243 2.216 2.274 0.074 18 0 "[ . 1 . 2]" 2 20 3 52 GLY O 3 56 GLY N 2.900 2.700 3.200 3.154 3.074 3.197 . 0 0 "[ . 1 . 2]" 2 21 3 53 LYS O 3 57 GLU H 2.000 . 2.200 2.230 2.204 2.252 0.052 4 0 "[ . 1 . 2]" 2 22 3 53 LYS O 3 57 GLU N 2.900 2.700 3.200 3.188 3.121 3.217 0.017 6 0 "[ . 1 . 2]" 2 23 3 54 LYS O 3 58 LYS H 2.000 . 2.200 2.011 1.888 2.100 . 0 0 "[ . 1 . 2]" 2 24 3 54 LYS O 3 58 LYS N 2.900 2.700 3.200 2.921 2.806 3.009 . 0 0 "[ . 1 . 2]" 2 25 3 55 LEU O 3 59 TRP H 2.000 . 2.200 2.027 1.959 2.083 . 0 0 "[ . 1 . 2]" 2 26 3 55 LEU O 3 59 TRP N 2.900 2.700 3.200 2.710 2.672 2.795 0.028 10 0 "[ . 1 . 2]" 2 27 3 56 GLY O 3 60 LYS H 2.000 . 2.200 2.256 2.227 2.278 0.078 9 0 "[ . 1 . 2]" 2 28 3 56 GLY O 3 60 LYS N 2.900 2.700 3.200 3.194 3.159 3.214 0.014 10 0 "[ . 1 . 2]" 2 29 3 57 GLU O 3 61 ALA H 2.000 . 2.200 2.225 2.208 2.254 0.054 8 0 "[ . 1 . 2]" 2 30 3 57 GLU O 3 61 ALA N 2.900 2.700 3.200 2.884 2.728 3.082 . 0 0 "[ . 1 . 2]" 2 31 3 58 LYS O 3 62 LEU H 2.000 . 2.200 2.234 2.218 2.249 0.049 18 0 "[ . 1 . 2]" 2 32 3 58 LYS O 3 62 LEU N 2.900 2.700 3.200 3.084 2.922 3.159 . 0 0 "[ . 1 . 2]" 2 33 3 63 THR O 3 66 GLU H 2.000 . 2.200 2.127 1.994 2.184 . 0 0 "[ . 1 . 2]" 2 34 3 63 THR O 3 66 GLU N 2.900 2.700 3.200 2.660 2.626 2.684 0.074 5 0 "[ . 1 . 2]" 2 35 3 63 THR O 3 67 LYS H 2.000 . 2.200 2.161 2.067 2.214 0.014 1 0 "[ . 1 . 2]" 2 36 3 63 THR O 3 67 LYS N 2.900 2.700 3.200 2.968 2.941 3.026 . 0 0 "[ . 1 . 2]" 2 37 3 64 PRO O 3 68 GLN H 2.000 . 2.200 2.205 2.046 2.237 0.037 4 0 "[ . 1 . 2]" 2 38 3 64 PRO O 3 68 GLN N 2.900 2.700 3.200 2.943 2.808 3.001 . 0 0 "[ . 1 . 2]" 2 39 3 66 GLU O 3 70 TYR H 2.000 . 2.200 2.201 2.159 2.253 0.053 5 0 "[ . 1 . 2]" 2 40 3 66 GLU O 3 70 TYR N 2.900 2.700 3.200 2.697 2.668 2.846 0.032 6 0 "[ . 1 . 2]" 2 41 3 67 LYS O 3 71 GLU H 2.000 . 2.200 1.960 1.860 2.008 . 0 0 "[ . 1 . 2]" 2 42 3 67 LYS O 3 71 GLU N 2.900 2.700 3.200 2.658 2.645 2.693 0.055 6 0 "[ . 1 . 2]" 2 43 3 69 PRO O 3 73 LYS H 2.000 . 2.200 2.281 2.269 2.314 0.114 8 0 "[ . 1 . 2]" 2 44 3 69 PRO O 3 73 LYS N 2.900 2.700 3.200 3.035 2.988 3.086 . 0 0 "[ . 1 . 2]" 2 45 3 70 TYR O 3 74 ALA H 2.000 . 2.200 1.941 1.888 2.027 . 0 0 "[ . 1 . 2]" 2 46 3 70 TYR O 3 74 ALA N 2.900 2.700 3.200 2.507 2.492 2.519 0.208 17 0 "[ . 1 . 2]" 2 47 3 71 GLU O 3 75 GLN H 2.000 . 2.200 2.303 2.249 2.326 0.126 14 0 "[ . 1 . 2]" 2 48 3 71 GLU O 3 75 GLN N 2.900 2.700 3.200 3.160 3.115 3.187 . 0 0 "[ . 1 . 2]" 2 49 3 72 ALA O 3 76 ALA H 2.000 . 2.200 2.071 2.043 2.106 . 0 0 "[ . 1 . 2]" 2 50 3 72 ALA O 3 76 ALA N 2.900 2.700 3.200 2.953 2.890 3.020 . 0 0 "[ . 1 . 2]" 2 51 3 73 LYS O 3 77 ASP H 2.000 . 2.200 2.135 2.073 2.204 0.004 15 0 "[ . 1 . 2]" 2 52 3 73 LYS O 3 77 ASP N 2.900 2.700 3.200 3.004 2.840 3.077 . 0 0 "[ . 1 . 2]" 2 53 3 74 ALA O 3 78 LYS H 2.000 . 2.200 1.944 1.831 2.047 . 0 0 "[ . 1 . 2]" 2 54 3 74 ALA O 3 78 LYS N 2.900 2.700 3.200 2.700 2.639 2.741 0.061 8 0 "[ . 1 . 2]" 2 55 3 30 PHE O 3 34 GLU H 2.000 . 2.200 2.315 2.300 2.367 0.167 18 0 "[ . 1 . 2]" 2 56 3 30 PHE O 3 34 GLU N 2.900 2.700 3.200 3.220 3.207 3.244 0.044 15 0 "[ . 1 . 2]" 2 57 3 31 PHE O 3 35 ASN H 2.000 . 2.200 1.967 1.918 2.084 . 0 0 "[ . 1 . 2]" 2 58 3 31 PHE O 3 35 ASN N 2.900 2.700 3.200 2.932 2.882 2.994 . 0 0 "[ . 1 . 2]" 2 59 3 34 GLU O 3 38 ILE H 2.000 . 2.200 2.268 2.258 2.286 0.086 18 0 "[ . 1 . 2]" 2 60 3 34 GLU O 3 38 ILE N 2.900 2.700 3.200 3.198 3.155 3.217 0.017 14 0 "[ . 1 . 2]" 2 61 3 36 ARG O 3 40 ARG H 2.000 . 2.200 2.228 2.175 2.261 0.061 19 0 "[ . 1 . 2]" 2 62 3 36 ARG O 3 40 ARG N 2.900 2.700 3.200 3.039 2.959 3.145 . 0 0 "[ . 1 . 2]" 2 63 3 37 ASP O 3 41 SER H 2.000 . 2.200 2.094 2.005 2.194 . 0 0 "[ . 1 . 2]" 2 64 3 37 ASP O 3 41 SER N 2.900 2.700 3.200 2.693 2.656 2.833 0.044 17 0 "[ . 1 . 2]" 2 65 3 38 ILE O 3 42 GLU H 2.000 . 2.200 2.216 2.201 2.236 0.036 7 0 "[ . 1 . 2]" 2 66 3 38 ILE O 3 42 GLU N 2.900 2.700 3.200 2.955 2.899 3.040 . 0 0 "[ . 1 . 2]" 2 67 3 47 THR O 3 51 VAL H 2.000 . 2.200 2.046 1.962 2.219 0.019 13 0 "[ . 1 . 2]" 2 68 3 47 THR O 3 51 VAL N 2.900 2.700 3.200 2.943 2.828 3.177 . 0 0 "[ . 1 . 2]" 2 69 3 48 PHE O 3 52 GLY H 2.000 . 2.200 2.041 1.829 2.208 0.008 9 0 "[ . 1 . 2]" 2 70 3 48 PHE O 3 52 GLY N 2.900 2.700 3.200 2.807 2.723 2.992 . 0 0 "[ . 1 . 2]" 2 71 3 50 GLN O 3 54 LYS H 2.000 . 2.200 2.104 2.019 2.214 0.014 13 0 "[ . 1 . 2]" 2 72 3 50 GLN O 3 54 LYS N 2.900 2.700 3.200 2.883 2.803 2.994 . 0 0 "[ . 1 . 2]" 2 73 3 68 GLN O 3 72 ALA H 2.000 . 2.200 2.078 1.974 2.109 . 0 0 "[ . 1 . 2]" 2 74 3 68 GLN O 3 72 ALA N 2.900 2.700 3.200 2.872 2.747 2.903 . 0 0 "[ . 1 . 2]" 2 75 3 75 GLN O 3 79 LYS H 2.000 . 2.200 2.247 2.229 2.267 0.067 5 0 "[ . 1 . 2]" 2 76 3 75 GLN O 3 79 LYS N 2.900 2.700 3.200 3.160 3.126 3.203 0.003 14 0 "[ . 1 . 2]" 2 77 3 77 ASP O 3 81 TYR H 2.000 . 2.200 2.231 2.206 2.263 0.063 16 0 "[ . 1 . 2]" 2 78 3 77 ASP O 3 81 TYR N 2.900 2.700 3.200 3.188 3.136 3.203 0.003 16 0 "[ . 1 . 2]" 2 79 3 78 LYS O 3 82 GLU H 2.000 . 2.200 2.077 2.006 2.122 . 0 0 "[ . 1 . 2]" 2 80 3 78 LYS O 3 82 GLU N 2.900 2.700 3.200 2.888 2.801 2.977 . 0 0 "[ . 1 . 2]" 2 81 3 79 LYS O 3 83 SER H 2.000 . 2.200 2.266 2.237 2.288 0.088 10 0 "[ . 1 . 2]" 2 82 3 79 LYS O 3 83 SER N 2.900 2.700 3.200 2.996 2.940 3.098 . 0 0 "[ . 1 . 2]" 2 83 3 81 TYR O 3 85 LYS H 2.000 . 2.200 2.146 2.008 2.230 0.030 17 0 "[ . 1 . 2]" 2 84 3 81 TYR O 3 85 LYS N 2.900 2.700 3.200 2.946 2.816 3.021 . 0 0 "[ . 1 . 2]" 2 85 3 82 GLU O 3 86 GLU H 2.000 . 2.200 2.081 2.010 2.210 0.010 8 0 "[ . 1 . 2]" 2 86 3 82 GLU O 3 86 GLU N 2.900 2.700 3.200 3.006 2.942 3.085 . 0 0 "[ . 1 . 2]" 2 87 3 83 SER O 3 87 LEU H 2.000 . 2.200 2.232 2.212 2.243 0.043 17 0 "[ . 1 . 2]" 2 88 3 83 SER O 3 87 LEU N 2.900 2.700 3.200 3.105 3.047 3.168 . 0 0 "[ . 1 . 2]" 2 89 3 84 GLU O 3 88 TYR H 2.000 . 2.200 2.092 2.051 2.190 . 0 0 "[ . 1 . 2]" 2 90 3 84 GLU O 3 88 TYR N 2.900 2.700 3.200 2.835 2.659 2.963 0.041 20 0 "[ . 1 . 2]" 2 91 3 85 LYS O 3 89 ASN H 2.000 . 2.200 2.243 2.222 2.262 0.062 12 0 "[ . 1 . 2]" 2 92 3 85 LYS O 3 89 ASN N 2.900 2.700 3.200 3.126 3.088 3.201 0.001 5 0 "[ . 1 . 2]" 2 93 3 86 GLU O 3 90 ALA H 2.000 . 2.200 2.240 2.228 2.276 0.076 5 0 "[ . 1 . 2]" 2 94 3 86 GLU O 3 90 ALA N 2.900 2.700 3.200 3.031 2.982 3.170 . 0 0 "[ . 1 . 2]" 2 95 3 87 LEU O 3 91 THR H 2.000 . 2.200 2.140 1.980 2.212 0.012 5 0 "[ . 1 . 2]" 2 96 3 87 LEU O 3 91 THR N 2.900 2.700 3.200 2.628 2.595 2.726 0.105 5 0 "[ . 1 . 2]" 2 97 3 88 TYR O 3 92 LEU H 2.000 . 2.200 2.195 2.063 2.261 0.061 5 0 "[ . 1 . 2]" 2 98 3 88 TYR O 3 92 LEU N 2.900 2.700 3.200 3.019 2.859 3.077 . 0 0 "[ . 1 . 2]" 2 99 3 89 ASN O 3 93 ALA H 2.000 . 2.200 2.233 2.207 2.252 0.052 18 0 "[ . 1 . 2]" 2 100 3 89 ASN O 3 93 ALA N 2.900 2.700 3.200 3.071 2.914 3.202 0.002 9 0 "[ . 1 . 2]" 2 stop_ save_
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