NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
623428 | 5noc | 34122 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5noc 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 3437 _Distance_constraint_stats_list.Viol_count 1021 _Distance_constraint_stats_list.Viol_total 4432.065 _Distance_constraint_stats_list.Viol_max 1.439 _Distance_constraint_stats_list.Viol_rms 0.0388 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0032 _Distance_constraint_stats_list.Viol_average_violations_only 0.2170 _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 16 VAL 2.651 0.274 14 0 "[ . 1 . 2]" 1 17 LYS 6.395 0.863 6 3 "[* .+ 1 . -2]" 1 18 ASP 1.471 0.382 7 0 "[ . 1 . 2]" 1 19 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 20 VAL 1.618 0.838 11 1 "[ . 1+ . 2]" 1 21 LEU 7.673 0.599 12 4 "[ . -1*+ * 2]" 1 22 LYS 0.456 0.224 4 0 "[ . 1 . 2]" 1 23 GLU 3.141 0.599 12 4 "[ . -1*+ * 2]" 1 24 ARG 11.990 0.848 4 4 "[ +- * 1* . 2]" 1 25 GLU 1.426 0.282 7 0 "[ . 1 . 2]" 1 26 SER 4.534 0.329 12 0 "[ . 1 . 2]" 1 27 TYR 5.084 0.469 1 0 "[ . 1 . 2]" 1 28 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 29 GLN 1.550 0.395 17 0 "[ . 1 . 2]" 1 30 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 31 TYR 1.979 0.469 1 0 "[ . 1 . 2]" 1 32 PHE 6.309 0.669 12 3 "[ . 1-+ . * 2]" 1 33 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 34 THR 13.478 1.436 18 10 "[** . ***** * -+ 2]" 1 35 THR 3.398 0.750 7 2 "[ . + 1 - . 2]" 1 36 VAL 2.114 0.372 1 0 "[ . 1 . 2]" 1 37 ASN 2.554 0.750 7 1 "[ . + 1 . 2]" 1 38 ILE 5.864 0.436 9 0 "[ . 1 . 2]" 1 39 LYS 3.092 0.603 6 4 "[ .+- 1* * 2]" 1 40 ARG 2.281 0.599 12 4 "[ . -1*+ * 2]" 1 41 GLN 1.143 0.279 13 0 "[ . 1 . 2]" 1 42 LYS 1.520 0.837 5 1 "[ + 1 . 2]" 1 43 LYS 1.663 0.267 6 0 "[ . 1 . 2]" 1 44 LYS 2.607 0.837 5 1 "[ + 1 . 2]" 1 45 GLY 1.173 0.254 18 0 "[ . 1 . 2]" 1 46 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 47 ILE 12.726 0.712 10 3 "[- * . + . 2]" 1 48 GLU 3.612 0.603 6 3 "[ .+ 1- * 2]" 1 49 ILE 1.827 0.251 16 0 "[ . 1 . 2]" 1 50 GLU 0.470 0.211 13 0 "[ . 1 . 2]" 1 51 PHE 10.040 0.684 4 10 "[*- +. ** * *.** *2]" 1 52 PHE 1.152 0.669 12 1 "[ . 1 + . 2]" 1 53 SER 1.095 0.367 15 0 "[ . 1 . 2]" 1 54 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 55 GLU 0.000 0.000 10 0 "[ . 1 . 2]" 1 56 ASP 3.986 0.888 7 3 "[ -. + 1 *. 2]" 1 57 LEU 11.448 0.816 4 4 "[ +* * 1 . - 2]" 1 58 ASP 2.719 0.393 20 0 "[ . 1 . 2]" 1 59 ARG 20.689 1.436 18 11 "[** *. **** ** -+ 2]" 1 60 ILE 8.465 1.055 18 3 "[ -. * 1 . + 2]" 1 61 LEU 11.489 0.826 1 5 "[+ * . * * .* 2]" 1 62 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 63 LEU 7.254 0.826 1 3 "[+ . - 1 .* 2]" 1 64 LEU 4.939 0.445 9 0 "[ . 1 . 2]" 1 65 SER 2.843 0.901 16 3 "[ . -1 *+ 2]" 1 66 GLU 6.367 0.901 16 3 "[ . -1 *+ 2]" 1 67 ARG 8.994 1.287 2 4 "[*+ . * 1 . - 2]" 1 68 GLU 11.869 1.287 2 9 "[-+* *** *1* .* 2]" 1 69 SER 1.756 0.685 8 2 "[ . + 1 . - 2]" 2 16 VAL 2.667 0.275 16 0 "[ . 1 . 2]" 2 17 LYS 6.382 0.860 6 3 "[* .+ 1 . -2]" 2 18 ASP 1.487 0.384 7 0 "[ . 1 . 2]" 2 19 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 2 20 VAL 1.611 0.838 11 1 "[ . 1+ . 2]" 2 21 LEU 7.654 0.593 12 4 "[ . -1*+ * 2]" 2 22 LYS 0.458 0.225 4 0 "[ . 1 . 2]" 2 23 GLU 3.100 0.593 12 4 "[ . -1*+ * 2]" 2 24 ARG 11.875 0.838 11 5 "[ ** * 1+ . - 2]" 2 25 GLU 1.415 0.285 7 0 "[ . 1 . 2]" 2 26 SER 4.507 0.331 15 0 "[ . 1 . 2]" 2 27 TYR 5.105 0.471 1 0 "[ . 1 . 2]" 2 28 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 2 29 GLN 1.567 0.399 17 0 "[ . 1 . 2]" 2 30 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 2 31 TYR 1.991 0.471 1 0 "[ . 1 . 2]" 2 32 PHE 6.328 0.670 12 3 "[ . 1-+ . * 2]" 2 33 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 2 34 THR 13.490 1.439 18 10 "[** . ***** * -+ 2]" 2 35 THR 3.426 0.758 7 2 "[ . + 1 - . 2]" 2 36 VAL 2.103 0.370 1 0 "[ . 1 . 2]" 2 37 ASN 2.587 0.758 7 1 "[ . + 1 . 2]" 2 38 ILE 5.898 0.445 9 0 "[ . 1 . 2]" 2 39 LYS 3.094 0.601 6 4 "[ .+- 1* * 2]" 2 40 ARG 2.245 0.593 12 4 "[ . -1*+ * 2]" 2 41 GLN 1.138 0.272 13 0 "[ . 1 . 2]" 2 42 LYS 1.517 0.838 5 1 "[ + 1 . 2]" 2 43 LYS 1.614 0.254 18 0 "[ . 1 . 2]" 2 44 LYS 2.636 0.838 5 1 "[ + 1 . 2]" 2 45 GLY 1.195 0.254 18 0 "[ . 1 . 2]" 2 46 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 2 47 ILE 19.968 0.683 10 10 "[*-* . ** + *.** *2]" 2 48 GLU 3.636 0.601 6 3 "[ .+ 1- * 2]" 2 49 ILE 1.834 0.266 16 0 "[ . 1 . 2]" 2 50 GLU 0.476 0.212 13 0 "[ . 1 . 2]" 2 51 PHE 2.805 0.686 4 1 "[ +. 1 . 2]" 2 52 PHE 1.119 0.670 12 1 "[ . 1 + . 2]" 2 53 SER 1.120 0.362 15 0 "[ . 1 . 2]" 2 54 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 2 55 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 2 56 ASP 3.969 0.887 7 3 "[ -. + 1 *. 2]" 2 57 LEU 11.631 0.848 4 3 "[ +- * 1 . 2]" 2 58 ASP 2.730 0.395 20 0 "[ . 1 . 2]" 2 59 ARG 20.581 1.439 18 11 "[** *. **** ** -+ 2]" 2 60 ILE 8.468 1.058 18 3 "[ -. * 1 . + 2]" 2 61 LEU 11.512 0.828 1 5 "[+ * . * * .* 2]" 2 62 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 2 63 LEU 7.263 0.828 1 3 "[+ . - 1 .* 2]" 2 64 LEU 4.844 0.436 9 0 "[ . 1 . 2]" 2 65 SER 2.822 0.901 16 3 "[ . -1 *+ 2]" 2 66 GLU 6.401 0.901 16 3 "[ . -1 *+ 2]" 2 67 ARG 9.101 1.291 2 4 "[*+ . * 1 . - 2]" 2 68 GLU 11.949 1.291 2 9 "[-+* *** *1* .* 2]" 2 69 SER 1.752 0.692 8 2 "[ . + 1 . - 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 31 TYR HB3 1 31 TYR HD1 3.229 . 4.532 3.714 3.626 3.740 . 0 0 "[ . 1 . 2]" 1 2 2 31 TYR HB3 2 31 TYR HD1 3.229 . 4.532 3.713 3.621 3.740 . 0 0 "[ . 1 . 2]" 1 3 1 31 TYR HA 1 31 TYR HD1 3.739 . 5.486 2.487 2.116 3.121 . 0 0 "[ . 1 . 2]" 1 4 2 31 TYR HA 2 31 TYR HD1 3.739 . 5.486 2.489 2.116 3.122 . 0 0 "[ . 1 . 2]" 1 5 1 31 TYR HD1 1 32 PHE HE1 4.494 . 7.018 6.293 5.735 6.776 . 0 0 "[ . 1 . 2]" 1 6 2 31 TYR HD1 2 32 PHE HE1 4.494 . 7.018 6.294 5.729 6.776 . 0 0 "[ . 1 . 2]" 1 7 1 27 TYR HA 1 27 TYR HD1 3.899 . 5.799 2.686 2.414 2.838 . 0 0 "[ . 1 . 2]" 1 8 2 27 TYR HA 2 27 TYR HD1 3.899 . 5.799 2.685 2.402 2.845 . 0 0 "[ . 1 . 2]" 1 9 1 51 PHE HD1 1 53 SER H 5.041 . 8.218 5.212 2.382 6.317 . 0 0 "[ . 1 . 2]" 1 10 2 51 PHE HD1 2 53 SER H 5.041 . 8.218 5.210 2.370 6.316 . 0 0 "[ . 1 . 2]" 1 11 1 51 PHE HB3 1 51 PHE HD1 3.644 . 5.304 2.743 2.357 3.684 . 0 0 "[ . 1 . 2]" 1 12 2 51 PHE HB3 2 51 PHE HD1 3.644 . 5.304 2.743 2.359 3.684 . 0 0 "[ . 1 . 2]" 1 13 1 31 TYR HA 1 31 TYR HE1 4.787 . 7.651 4.569 4.336 4.916 . 0 0 "[ . 1 . 2]" 1 14 2 31 TYR HA 2 31 TYR HE1 4.787 . 7.651 4.571 4.337 4.914 . 0 0 "[ . 1 . 2]" 1 15 1 27 TYR HE1 1 31 TYR HA 5.064 . 8.269 5.262 4.507 6.118 . 0 0 "[ . 1 . 2]" 1 16 2 27 TYR HE1 2 31 TYR HA 5.064 . 8.269 5.266 4.507 6.137 . 0 0 "[ . 1 . 2]" 1 17 1 51 PHE HE1 1 57 LEU QD 3.565 . 5.154 2.922 2.407 3.499 . 0 0 "[ . 1 . 2]" 1 18 2 51 PHE QE 2 57 LEU QD 3.565 . 5.154 2.475 2.073 2.762 . 0 0 "[ . 1 . 2]" 1 19 1 51 PHE HD1 1 57 LEU QD 3.898 . 5.798 3.624 3.065 4.068 . 0 0 "[ . 1 . 2]" 1 20 2 51 PHE HD1 2 57 LEU QD 3.898 . 5.798 3.624 3.067 4.069 . 0 0 "[ . 1 . 2]" 1 21 2 51 PHE HB3 2 51 PHE QE 4.292 . 6.594 4.396 4.376 4.417 . 0 0 "[ . 1 . 2]" 1 22 1 27 TYR HE1 1 31 TYR HB3 4.498 . 7.028 6.111 5.154 7.497 0.469 1 0 "[ . 1 . 2]" 1 23 2 27 TYR HE1 2 31 TYR HB3 4.498 . 7.028 6.113 5.150 7.499 0.471 1 0 "[ . 1 . 2]" 1 24 1 27 TYR HB2 1 27 TYR HD1 3.325 . 4.707 2.628 2.520 2.738 . 0 0 "[ . 1 . 2]" 1 25 2 27 TYR HB2 2 27 TYR HD1 3.325 . 4.707 2.629 2.520 2.740 . 0 0 "[ . 1 . 2]" 1 26 1 27 TYR HB3 1 27 TYR HD1 3.307 . 4.674 3.736 3.706 3.756 . 0 0 "[ . 1 . 2]" 1 27 2 27 TYR HB3 2 27 TYR HD1 3.307 . 4.674 3.735 3.707 3.759 . 0 0 "[ . 1 . 2]" 1 28 1 27 TYR HB3 1 27 TYR HE1 4.707 . 7.476 5.468 5.447 5.482 . 0 0 "[ . 1 . 2]" 1 29 2 27 TYR HB3 2 27 TYR HE1 4.707 . 7.476 5.468 5.448 5.481 . 0 0 "[ . 1 . 2]" 1 30 1 52 PHE HB2 1 52 PHE HD1 3.669 . 5.352 2.565 2.277 3.703 . 0 0 "[ . 1 . 2]" 1 31 2 52 PHE HB2 2 52 PHE HD1 3.669 . 5.352 2.565 2.278 3.701 . 0 0 "[ . 1 . 2]" 1 32 1 27 TYR HA 1 27 TYR HE1 4.674 . 7.405 4.880 4.670 4.960 . 0 0 "[ . 1 . 2]" 1 33 2 27 TYR HA 2 27 TYR HE1 4.674 . 7.405 4.880 4.660 4.966 . 0 0 "[ . 1 . 2]" 1 34 1 27 TYR HA 1 31 TYR HD1 5.071 . 8.286 5.969 5.494 6.306 . 0 0 "[ . 1 . 2]" 1 35 2 27 TYR HA 2 31 TYR HD1 5.071 . 8.286 5.969 5.491 6.307 . 0 0 "[ . 1 . 2]" 1 36 1 27 TYR HE1 1 31 TYR HD1 5.105 . 8.363 3.502 2.860 4.323 . 0 0 "[ . 1 . 2]" 1 37 2 27 TYR HE1 2 31 TYR HD1 5.105 . 8.363 3.503 2.867 4.328 . 0 0 "[ . 1 . 2]" 1 38 1 27 TYR HE1 1 31 TYR HE1 4.913 . 7.930 4.481 3.903 5.147 . 0 0 "[ . 1 . 2]" 1 39 2 27 TYR HE1 2 31 TYR HE1 4.913 . 7.930 4.482 3.899 5.149 . 0 0 "[ . 1 . 2]" 1 40 1 57 LEU QD 2 38 ILE MG . . 2.769 2.406 2.010 2.799 0.030 9 0 "[ . 1 . 2]" 1 41 1 38 ILE MG 2 57 LEU QD . . 2.769 2.402 2.011 2.799 0.030 9 0 "[ . 1 . 2]" 1 42 1 47 ILE MD 2 57 LEU QD 3.606 . 5.103 2.376 1.862 2.821 0.119 10 0 "[ . 1 . 2]" 1 43 1 57 LEU QD 2 47 ILE MD 3.606 . 5.103 2.377 1.856 2.829 0.125 10 0 "[ . 1 . 2]" 1 44 1 38 ILE MD 2 57 LEU QD 4.109 . 6.000 2.314 1.948 2.597 0.051 1 0 "[ . 1 . 2]" 1 45 1 57 LEU QD 2 38 ILE MD 4.109 . 6.000 2.314 1.958 2.586 0.041 1 0 "[ . 1 . 2]" 1 46 1 47 ILE MG 2 49 ILE MD 6.622 . 11.514 5.240 4.939 5.543 . 0 0 "[ . 1 . 2]" 1 47 1 49 ILE MD 2 47 ILE MG 6.622 . 11.514 5.240 4.940 5.542 . 0 0 "[ . 1 . 2]" 1 48 1 21 LEU QD 2 57 LEU QD . . 1.996 1.787 1.579 2.445 0.449 1 0 "[ . 1 . 2]" 1 49 1 57 LEU QD 2 21 LEU QD . . 1.996 1.790 1.597 2.452 0.456 1 0 "[ . 1 . 2]" 1 50 1 49 ILE MD 2 64 LEU MD2 4.073 . 6.000 2.732 2.371 3.110 . 0 0 "[ . 1 . 2]" 1 51 1 64 LEU MD2 2 49 ILE MD 4.073 . 6.000 2.738 2.381 3.134 . 0 0 "[ . 1 . 2]" 1 52 1 35 THR HB 1 35 THR MG 2.027 . 2.541 2.134 2.132 2.136 . 0 0 "[ . 1 . 2]" 1 53 2 35 THR HB 2 35 THR MG 2.027 . 2.541 2.134 2.131 2.136 . 0 0 "[ . 1 . 2]" 1 54 1 35 THR HB 1 50 GLU HG3 3.985 . 5.970 2.947 2.150 3.647 . 0 0 "[ . 1 . 2]" 1 55 2 35 THR HB 2 50 GLU HG3 3.985 . 5.970 2.946 2.157 3.628 . 0 0 "[ . 1 . 2]" 1 56 1 35 THR HB 1 36 VAL H 3.616 . 5.251 4.029 3.949 4.115 . 0 0 "[ . 1 . 2]" 1 57 2 35 THR HB 2 36 VAL H 3.616 . 5.251 4.029 3.949 4.112 . 0 0 "[ . 1 . 2]" 1 58 1 57 LEU HA 1 61 LEU MD1 2.696 . 3.604 2.983 2.509 3.312 . 0 0 "[ . 1 . 2]" 1 59 2 57 LEU HA 2 61 LEU MD1 2.696 . 3.604 2.983 2.509 3.309 . 0 0 "[ . 1 . 2]" 1 60 1 49 ILE MG 1 57 LEU HA 3.364 . 6.000 5.578 5.223 5.846 . 0 0 "[ . 1 . 2]" 1 61 2 49 ILE MG 2 57 LEU HA 3.364 . 6.000 5.578 5.224 5.848 . 0 0 "[ . 1 . 2]" 1 62 1 57 LEU HA 1 57 LEU QD 2.497 . 3.066 2.204 2.054 2.319 . 0 0 "[ . 1 . 2]" 1 63 2 57 LEU HA 2 57 LEU QD 2.497 . 3.066 2.204 2.053 2.319 . 0 0 "[ . 1 . 2]" 1 64 1 60 ILE HA 1 60 ILE QG 2.990 . 4.108 2.432 2.353 3.058 . 0 0 "[ . 1 . 2]" 1 65 2 60 ILE HA 2 60 ILE QG 2.990 . 4.108 2.432 2.354 3.058 . 0 0 "[ . 1 . 2]" 1 66 1 60 ILE HA 1 61 LEU MD1 3.128 . 4.351 4.498 4.362 4.604 0.253 3 0 "[ . 1 . 2]" 1 67 2 60 ILE HA 2 61 LEU MD1 3.128 . 4.351 4.498 4.364 4.605 0.254 3 0 "[ . 1 . 2]" 1 68 1 60 ILE HA 1 62 GLU QB 3.912 . 5.825 4.496 4.202 4.784 . 0 0 "[ . 1 . 2]" 1 69 2 60 ILE HA 2 62 GLU QB 3.912 . 5.825 4.495 4.196 4.787 . 0 0 "[ . 1 . 2]" 1 70 1 60 ILE HA 1 60 ILE HB 2.941 . 4.022 3.022 3.016 3.029 . 0 0 "[ . 1 . 2]" 1 71 2 60 ILE HA 2 60 ILE HB 2.941 . 4.022 3.022 3.015 3.028 . 0 0 "[ . 1 . 2]" 1 72 1 19 ALA MB 1 20 VAL HA 3.540 . 4.360 3.865 3.794 3.939 . 0 0 "[ . 1 . 2]" 1 73 2 19 ALA MB 2 20 VAL HA 3.540 . 4.360 3.864 3.801 3.935 . 0 0 "[ . 1 . 2]" 1 74 1 35 THR HA 1 35 THR MG 2.747 . 3.690 2.358 2.317 2.387 . 0 0 "[ . 1 . 2]" 1 75 2 35 THR HA 2 35 THR MG 2.747 . 3.690 2.357 2.317 2.388 . 0 0 "[ . 1 . 2]" 1 76 1 29 GLN HG3 1 35 THR HA 5.297 . 8.804 4.567 4.408 4.780 . 0 0 "[ . 1 . 2]" 1 77 2 29 GLN HG3 2 35 THR HA 5.297 . 8.804 4.568 4.406 4.784 . 0 0 "[ . 1 . 2]" 1 78 1 65 SER QB 1 66 GLU HB2 4.612 . 7.271 5.311 5.021 5.820 . 0 0 "[ . 1 . 2]" 1 79 2 65 SER QB 2 66 GLU HB2 4.612 . 7.271 5.312 5.023 5.818 . 0 0 "[ . 1 . 2]" 1 80 1 65 SER QB 2 28 LEU MD2 3.557 . 5.138 3.374 2.621 4.028 . 0 0 "[ . 1 . 2]" 1 81 1 28 LEU MD2 2 65 SER QB 3.557 . 5.138 3.369 2.594 4.019 . 0 0 "[ . 1 . 2]" 1 82 1 16 VAL HA 1 16 VAL HB 2.163 . 2.748 2.682 2.430 3.022 0.274 14 0 "[ . 1 . 2]" 1 83 2 16 VAL HA 2 16 VAL HB 2.163 . 2.748 2.682 2.431 3.023 0.275 16 0 "[ . 1 . 2]" 1 84 1 16 VAL HA 1 17 LYS HB2 3.947 . 5.894 4.745 4.523 5.667 . 0 0 "[ . 1 . 2]" 1 85 2 16 VAL HA 2 17 LYS HB2 3.947 . 5.894 4.745 4.524 5.658 . 0 0 "[ . 1 . 2]" 1 86 1 16 VAL HA 1 16 VAL QG 1.937 . 2.406 2.235 2.127 2.327 . 0 0 "[ . 1 . 2]" 1 87 2 16 VAL HA 2 16 VAL QG 1.937 . 2.406 2.235 2.127 2.325 . 0 0 "[ . 1 . 2]" 1 88 1 16 VAL HA 1 17 LYS QG 3.508 . 5.047 3.636 3.462 3.840 . 0 0 "[ . 1 . 2]" 1 89 2 16 VAL HA 2 17 LYS QG 3.508 . 5.047 3.637 3.457 3.838 . 0 0 "[ . 1 . 2]" 1 90 1 26 SER H 1 26 SER HB3 2.796 . 3.773 2.814 2.525 3.587 . 0 0 "[ . 1 . 2]" 1 91 2 26 SER H 2 26 SER HB3 2.796 . 3.773 2.814 2.525 3.584 . 0 0 "[ . 1 . 2]" 1 92 1 26 SER HB3 1 27 TYR HB3 6.267 . 11.176 5.287 4.534 6.421 . 0 0 "[ . 1 . 2]" 1 93 2 26 SER HB3 2 27 TYR HB3 6.267 . 11.176 5.288 4.530 6.418 . 0 0 "[ . 1 . 2]" 1 94 1 25 GLU HB3 1 26 SER HB3 4.437 . 6.898 5.839 5.068 6.344 . 0 0 "[ . 1 . 2]" 1 95 2 25 GLU HB3 2 26 SER HB3 4.437 . 6.898 5.839 5.070 6.344 . 0 0 "[ . 1 . 2]" 1 96 1 25 GLU HB3 1 26 SER HA 3.724 . 5.458 4.237 4.090 4.363 . 0 0 "[ . 1 . 2]" 1 97 2 25 GLU HB3 2 26 SER HA 3.724 . 5.458 4.236 4.086 4.358 . 0 0 "[ . 1 . 2]" 1 98 1 27 TYR HA 1 30 ASN HB2 3.003 . 4.130 2.982 2.691 3.197 . 0 0 "[ . 1 . 2]" 1 99 2 27 TYR HA 2 30 ASN HB2 3.003 . 4.130 2.982 2.692 3.205 . 0 0 "[ . 1 . 2]" 1 100 1 27 TYR HA 1 32 PHE H 5.438 . 9.135 6.849 6.606 7.031 . 0 0 "[ . 1 . 2]" 1 101 2 27 TYR HA 2 32 PHE H 5.438 . 9.135 6.850 6.610 7.027 . 0 0 "[ . 1 . 2]" 1 102 1 27 TYR HA 1 31 TYR H 3.628 . 5.273 4.214 4.054 4.374 . 0 0 "[ . 1 . 2]" 1 103 2 27 TYR HA 2 31 TYR H 3.628 . 5.273 4.217 4.057 4.379 . 0 0 "[ . 1 . 2]" 1 104 1 26 SER HA 1 29 GLN H 3.933 . 5.867 3.803 3.649 4.015 . 0 0 "[ . 1 . 2]" 1 105 2 26 SER HA 2 29 GLN H 3.933 . 5.867 3.802 3.648 4.013 . 0 0 "[ . 1 . 2]" 1 106 1 30 ASN HB3 1 31 TYR HA 4.134 . 6.270 4.262 4.062 4.380 . 0 0 "[ . 1 . 2]" 1 107 2 30 ASN HB3 2 31 TYR HA 4.134 . 6.270 4.263 4.059 4.389 . 0 0 "[ . 1 . 2]" 1 108 1 31 TYR HA 1 31 TYR HE2 5.233 . 8.657 5.719 5.360 5.926 . 0 0 "[ . 1 . 2]" 1 109 2 31 TYR HA 2 31 TYR HE2 5.233 . 8.657 5.719 5.362 5.927 . 0 0 "[ . 1 . 2]" 1 110 1 31 TYR HA 1 31 TYR HD2 3.928 . 5.856 4.250 3.785 4.491 . 0 0 "[ . 1 . 2]" 1 111 2 31 TYR HA 2 31 TYR HD2 3.928 . 5.856 4.249 3.785 4.489 . 0 0 "[ . 1 . 2]" 1 112 1 25 GLU HA 1 28 LEU HB2 3.366 . 4.782 2.665 2.549 2.770 . 0 0 "[ . 1 . 2]" 1 113 2 25 GLU HA 2 28 LEU HB2 3.366 . 4.782 2.664 2.551 2.769 . 0 0 "[ . 1 . 2]" 1 114 1 25 GLU HA 1 28 LEU H 3.993 . 5.986 3.359 3.193 3.475 . 0 0 "[ . 1 . 2]" 1 115 2 25 GLU HA 2 28 LEU H 3.993 . 5.986 3.358 3.190 3.472 . 0 0 "[ . 1 . 2]" 1 116 1 25 GLU HA 1 36 VAL HB 4.113 . 6.227 3.771 3.571 3.904 . 0 0 "[ . 1 . 2]" 1 117 2 25 GLU HA 2 36 VAL HB 4.113 . 6.227 3.771 3.571 3.902 . 0 0 "[ . 1 . 2]" 1 118 1 65 SER HA 1 66 GLU H 2.990 . 4.108 3.370 2.660 3.529 . 0 0 "[ . 1 . 2]" 1 119 2 65 SER HA 2 66 GLU H 2.990 . 4.108 3.370 2.656 3.528 . 0 0 "[ . 1 . 2]" 1 120 1 65 SER HA 2 27 TYR HE2 4.441 . 6.906 2.305 1.891 3.587 0.085 20 0 "[ . 1 . 2]" 1 121 1 27 TYR HE2 2 65 SER HA 4.441 . 6.906 2.310 1.908 3.598 0.068 20 0 "[ . 1 . 2]" 1 122 1 23 GLU HA 1 23 GLU QB 2.456 . 3.210 2.291 2.176 2.420 . 0 0 "[ . 1 . 2]" 1 123 2 23 GLU HA 2 23 GLU QB 2.456 . 3.210 2.290 2.175 2.419 . 0 0 "[ . 1 . 2]" 1 124 1 24 ARG HA 1 27 TYR HB3 3.730 . 5.469 2.900 2.668 3.302 . 0 0 "[ . 1 . 2]" 1 125 2 24 ARG HA 2 27 TYR HB3 3.730 . 5.469 2.900 2.670 3.302 . 0 0 "[ . 1 . 2]" 1 126 1 22 LYS HA 1 22 LYS QG 3.035 . 4.187 2.848 2.283 3.041 . 0 0 "[ . 1 . 2]" 1 127 2 22 LYS HA 2 22 LYS QG 3.035 . 4.187 2.848 2.281 3.040 . 0 0 "[ . 1 . 2]" 1 128 1 42 LYS HA 1 42 LYS QB 2.471 . 3.235 2.381 2.338 2.434 . 0 0 "[ . 1 . 2]" 1 129 2 42 LYS HA 2 42 LYS QB 2.471 . 3.235 2.381 2.339 2.433 . 0 0 "[ . 1 . 2]" 1 130 1 21 LEU HA 1 21 LEU HB3 2.326 . 3.002 2.526 2.463 2.577 . 0 0 "[ . 1 . 2]" 1 131 2 21 LEU HA 2 21 LEU HB3 2.326 . 3.002 2.526 2.464 2.580 . 0 0 "[ . 1 . 2]" 1 132 1 63 LEU HA 1 63 LEU QD 2.209 . 2.819 1.915 1.881 1.961 . 0 0 "[ . 1 . 2]" 1 133 2 63 LEU HA 2 63 LEU QD 2.209 . 2.819 1.916 1.882 1.962 . 0 0 "[ . 1 . 2]" 1 134 1 57 LEU QD 1 58 ASP HA 4.295 . 6.601 3.931 3.721 4.198 . 0 0 "[ . 1 . 2]" 1 135 2 57 LEU QD 2 58 ASP HA 4.295 . 6.601 3.931 3.726 4.194 . 0 0 "[ . 1 . 2]" 1 136 1 57 LEU HA 1 60 ILE H 4.006 . 6.012 3.627 3.408 3.782 . 0 0 "[ . 1 . 2]" 1 137 2 57 LEU HA 2 60 ILE H 4.006 . 6.012 3.626 3.406 3.783 . 0 0 "[ . 1 . 2]" 1 138 1 51 PHE HB3 1 57 LEU HA 3.583 . 5.188 3.456 3.092 3.879 . 0 0 "[ . 1 . 2]" 1 139 2 51 PHE HB3 2 57 LEU HA 3.583 . 5.188 3.457 3.097 3.881 . 0 0 "[ . 1 . 2]" 1 140 1 56 ASP QB 1 57 LEU HA 4.967 . 8.051 3.893 3.762 4.334 . 0 0 "[ . 1 . 2]" 1 141 2 56 ASP QB 2 57 LEU HA 4.967 . 8.051 3.895 3.765 4.332 . 0 0 "[ . 1 . 2]" 1 142 1 61 LEU HA 1 63 LEU QB 3.061 . 4.232 4.479 4.062 5.058 0.826 1 3 "[+ . - 1 .* 2]" 1 143 2 61 LEU HA 2 63 LEU QB 3.061 . 4.232 4.480 4.066 5.060 0.828 1 3 "[+ . - 1 .* 2]" 1 144 1 28 LEU HA 1 32 PHE HE2 4.893 . 7.885 4.605 3.879 5.641 . 0 0 "[ . 1 . 2]" 1 145 2 28 LEU HA 2 32 PHE HE2 4.893 . 7.885 4.605 3.881 5.642 . 0 0 "[ . 1 . 2]" 1 146 1 27 TYR HD2 1 28 LEU HA 4.921 . 7.948 3.825 3.430 4.174 . 0 0 "[ . 1 . 2]" 1 147 2 27 TYR HD2 2 28 LEU HA 4.921 . 7.948 3.824 3.426 4.176 . 0 0 "[ . 1 . 2]" 1 148 1 56 ASP HA 1 59 ARG H 3.572 . 5.167 3.472 3.230 3.854 . 0 0 "[ . 1 . 2]" 1 149 2 56 ASP HA 2 59 ARG H 3.572 . 5.167 3.472 3.231 3.851 . 0 0 "[ . 1 . 2]" 1 150 1 58 ASP HA 1 61 LEU HB3 4.219 . 6.444 4.522 4.147 4.908 . 0 0 "[ . 1 . 2]" 1 151 2 58 ASP HA 2 61 LEU HB3 4.219 . 6.444 4.520 4.142 4.918 . 0 0 "[ . 1 . 2]" 1 152 1 63 LEU HA 1 63 LEU QB 2.614 . 3.468 2.463 2.431 2.494 . 0 0 "[ . 1 . 2]" 1 153 2 63 LEU HA 2 63 LEU QB 2.614 . 3.468 2.463 2.431 2.494 . 0 0 "[ . 1 . 2]" 1 154 1 67 ARG HA 1 68 GLU H 2.646 . 3.521 3.244 2.831 3.387 . 0 0 "[ . 1 . 2]" 1 155 2 67 ARG HA 2 68 GLU H 2.646 . 3.521 3.245 2.827 3.387 . 0 0 "[ . 1 . 2]" 1 156 1 18 ASP HA 1 18 ASP HB3 2.427 . 3.163 2.486 2.441 2.523 . 0 0 "[ . 1 . 2]" 1 157 2 18 ASP HA 2 18 ASP HB3 2.427 . 3.163 2.485 2.442 2.520 . 0 0 "[ . 1 . 2]" 1 158 1 19 ALA HA 1 22 LYS QD 4.208 . 6.421 4.539 2.975 5.260 . 0 0 "[ . 1 . 2]" 1 159 2 19 ALA HA 2 22 LYS QD 4.208 . 6.421 4.540 2.987 5.258 . 0 0 "[ . 1 . 2]" 1 160 1 19 ALA HA 1 19 ALA MB 1.909 . 2.365 2.123 2.121 2.127 . 0 0 "[ . 1 . 2]" 1 161 2 19 ALA HA 2 19 ALA MB 1.909 . 2.365 2.123 2.120 2.126 . 0 0 "[ . 1 . 2]" 1 162 1 46 LYS HA 1 47 ILE H 3.011 . 4.144 2.209 2.170 2.246 . 0 0 "[ . 1 . 2]" 1 163 2 46 LYS HA 2 47 ILE H 3.011 . 4.144 2.209 2.164 2.247 . 0 0 "[ . 1 . 2]" 1 164 1 46 LYS HA 2 51 PHE H 4.444 . 5.473 3.249 3.056 3.615 . 0 0 "[ . 1 . 2]" 1 165 1 51 PHE H 2 46 LYS HA 4.444 . 5.473 3.246 3.052 3.623 . 0 0 "[ . 1 . 2]" 1 166 1 38 ILE MG 1 46 LYS HA 4.151 . 6.305 4.432 4.056 4.846 . 0 0 "[ . 1 . 2]" 1 167 2 38 ILE MG 2 46 LYS HA 4.151 . 6.305 4.432 4.056 4.846 . 0 0 "[ . 1 . 2]" 1 168 1 46 LYS HA 2 60 ILE MG 4.548 . 7.134 5.458 5.123 5.761 . 0 0 "[ . 1 . 2]" 1 169 1 60 ILE MG 2 46 LYS HA 4.548 . 7.134 5.466 5.150 5.777 . 0 0 "[ . 1 . 2]" 1 170 1 48 GLU HA 1 49 ILE H 2.905 . 3.960 2.097 2.076 2.125 . 0 0 "[ . 1 . 2]" 1 171 2 48 GLU HA 2 49 ILE H 2.905 . 3.960 2.097 2.075 2.123 . 0 0 "[ . 1 . 2]" 1 172 1 48 GLU HA 1 48 GLU QG 4.347 . 6.710 3.354 3.343 3.364 . 0 0 "[ . 1 . 2]" 1 173 2 48 GLU HA 2 48 GLU QG 4.347 . 6.710 3.354 3.345 3.364 . 0 0 "[ . 1 . 2]" 1 174 1 48 GLU HA 1 49 ILE MD 4.720 . 7.505 4.014 3.790 4.194 . 0 0 "[ . 1 . 2]" 1 175 2 48 GLU HA 2 49 ILE MD 4.720 . 7.505 4.014 3.793 4.199 . 0 0 "[ . 1 . 2]" 1 176 1 64 LEU HA 1 64 LEU MD2 2.202 . 2.808 2.036 1.986 2.086 . 0 0 "[ . 1 . 2]" 1 177 2 64 LEU HA 2 64 LEU MD2 2.202 . 2.808 2.037 1.984 2.086 . 0 0 "[ . 1 . 2]" 1 178 1 16 VAL QG 1 18 ASP HA 2.943 . 4.025 3.612 3.315 3.914 . 0 0 "[ . 1 . 2]" 1 179 2 16 VAL QG 2 18 ASP HA 2.943 . 4.025 3.613 3.315 3.922 . 0 0 "[ . 1 . 2]" 1 180 1 44 LYS HA 1 44 LYS HB3 2.476 . 3.242 2.485 2.383 3.031 . 0 0 "[ . 1 . 2]" 1 181 2 44 LYS HA 2 44 LYS HB3 2.476 . 3.242 2.484 2.383 3.032 . 0 0 "[ . 1 . 2]" 1 182 1 37 ASN HA 1 39 LYS QE 6.088 . 10.721 4.974 4.464 6.067 . 0 0 "[ . 1 . 2]" 1 183 2 37 ASN HA 2 39 LYS QE 6.088 . 10.721 4.974 4.467 6.073 . 0 0 "[ . 1 . 2]" 1 184 1 37 ASN HA 1 37 ASN QB 3.054 . 4.220 2.367 2.187 2.398 . 0 0 "[ . 1 . 2]" 1 185 2 37 ASN HA 2 37 ASN QB 3.054 . 4.220 2.367 2.187 2.397 . 0 0 "[ . 1 . 2]" 1 186 1 25 GLU HG2 1 37 ASN HA 3.704 . 5.419 3.568 3.008 3.757 . 0 0 "[ . 1 . 2]" 1 187 2 25 GLU HG2 2 37 ASN HA 3.704 . 5.419 3.571 3.017 3.761 . 0 0 "[ . 1 . 2]" 1 188 1 37 ASN HA 1 38 ILE HB 5.124 . 8.406 4.704 4.621 4.771 . 0 0 "[ . 1 . 2]" 1 189 2 37 ASN HA 2 38 ILE HB 5.124 . 8.406 4.705 4.622 4.772 . 0 0 "[ . 1 . 2]" 1 190 1 37 ASN HA 1 39 LYS QG 5.544 . 9.386 5.545 4.894 6.345 . 0 0 "[ . 1 . 2]" 1 191 2 37 ASN HA 2 39 LYS QG 5.544 . 9.386 5.545 4.897 6.349 . 0 0 "[ . 1 . 2]" 1 192 1 37 ASN HA 1 47 ILE MD 5.838 . 10.098 7.794 7.640 7.974 . 0 0 "[ . 1 . 2]" 1 193 2 37 ASN HA 2 47 ILE MD 5.838 . 10.098 7.795 7.642 7.975 . 0 0 "[ . 1 . 2]" 1 194 1 36 VAL MG1 1 37 ASN HA 3.813 . 5.630 3.382 3.214 3.577 . 0 0 "[ . 1 . 2]" 1 195 2 36 VAL MG1 2 37 ASN HA 3.813 . 5.630 3.382 3.216 3.581 . 0 0 "[ . 1 . 2]" 1 196 1 45 GLY HA2 2 51 PHE QE 4.523 . 7.080 4.665 4.409 4.854 . 0 0 "[ . 1 . 2]" 1 197 1 51 PHE HE2 2 45 GLY HA2 4.523 . 7.080 5.167 4.848 5.447 . 0 0 "[ . 1 . 2]" 1 198 1 45 GLY HA3 2 51 PHE HZ 5.146 . 8.457 3.150 2.818 3.409 . 0 0 "[ . 1 . 2]" 1 199 1 51 PHE HZ 2 45 GLY HA3 5.146 . 8.457 3.157 2.831 3.417 . 0 0 "[ . 1 . 2]" 1 200 1 40 ARG QD 2 57 LEU QD 3.550 . 4.000 2.654 2.219 2.919 . 0 0 "[ . 1 . 2]" 1 201 1 57 LEU QD 2 40 ARG QD 3.550 . 4.000 2.660 2.229 2.926 . 0 0 "[ . 1 . 2]" 1 202 1 38 ILE MG 1 40 ARG QD 2.927 . 3.998 2.604 1.936 3.176 . 0 0 "[ . 1 . 2]" 1 203 2 38 ILE MG 2 40 ARG QD 2.927 . 3.998 2.604 1.936 3.177 . 0 0 "[ . 1 . 2]" 1 204 1 40 ARG QD 2 51 PHE HZ 2.964 . 4.062 2.557 2.136 3.329 . 0 0 "[ . 1 . 2]" 1 205 1 51 PHE HZ 2 40 ARG QD 2.964 . 4.062 2.559 2.148 3.313 . 0 0 "[ . 1 . 2]" 1 206 1 59 ARG HB3 1 59 ARG HD3 3.801 . 5.607 3.414 2.571 3.577 . 0 0 "[ . 1 . 2]" 1 207 2 59 ARG HB3 2 59 ARG HD3 3.801 . 5.607 3.415 2.576 3.576 . 0 0 "[ . 1 . 2]" 1 208 1 59 ARG HB2 1 59 ARG HD3 5.033 . 8.199 3.532 2.145 4.188 . 0 0 "[ . 1 . 2]" 1 209 2 59 ARG HB2 2 59 ARG HD3 5.033 . 8.199 3.533 2.145 4.193 . 0 0 "[ . 1 . 2]" 1 210 1 24 ARG HD2 2 57 LEU QD 3.350 . 4.753 4.078 3.277 4.902 0.149 4 0 "[ . 1 . 2]" 1 211 1 57 LEU QD 2 24 ARG HD2 3.350 . 4.753 4.072 3.300 4.911 0.158 17 0 "[ . 1 . 2]" 1 212 1 37 ASN HB3 1 48 GLU QG 4.276 . 6.562 3.573 3.256 4.390 . 0 0 "[ . 1 . 2]" 1 213 2 37 ASN HB3 2 48 GLU QG 4.276 . 6.562 3.573 3.253 4.386 . 0 0 "[ . 1 . 2]" 1 214 1 37 ASN HB3 1 39 LYS QG 4.209 . 6.423 4.094 3.266 6.478 0.055 7 0 "[ . 1 . 2]" 1 215 2 37 ASN HB3 2 39 LYS QG 4.209 . 6.423 4.095 3.271 6.477 0.054 7 0 "[ . 1 . 2]" 1 216 1 32 PHE HE2 1 63 LEU QB 4.699 . 7.459 5.255 4.832 5.554 . 0 0 "[ . 1 . 2]" 1 217 2 32 PHE HE2 2 63 LEU QB 4.699 . 7.459 5.255 4.832 5.556 . 0 0 "[ . 1 . 2]" 1 218 1 64 LEU HB2 2 32 PHE HE2 6.529 . 11.857 5.374 4.080 6.217 . 0 0 "[ . 1 . 2]" 1 219 1 32 PHE HE2 2 64 LEU HB2 6.529 . 11.857 5.371 4.087 6.194 . 0 0 "[ . 1 . 2]" 1 220 1 64 LEU H 1 64 LEU HB2 2.815 . 3.805 2.368 2.228 2.438 . 0 0 "[ . 1 . 2]" 1 221 2 64 LEU H 2 64 LEU HB2 2.815 . 3.805 2.367 2.227 2.435 . 0 0 "[ . 1 . 2]" 1 222 1 57 LEU QD 1 61 LEU H 3.595 . 4.770 3.863 3.520 4.033 . 0 0 "[ . 1 . 2]" 1 223 2 57 LEU QD 2 61 LEU H 3.595 . 4.770 3.863 3.519 4.035 . 0 0 "[ . 1 . 2]" 1 224 1 57 LEU QD 1 60 ILE H 4.254 . 6.517 4.632 4.248 4.909 . 0 0 "[ . 1 . 2]" 1 225 2 57 LEU QD 2 60 ILE H 4.254 . 6.517 4.631 4.248 4.906 . 0 0 "[ . 1 . 2]" 1 226 1 57 LEU QD 1 57 LEU HG 1.886 . 2.465 1.889 1.884 1.892 . 0 0 "[ . 1 . 2]" 1 227 2 57 LEU QD 2 57 LEU HG 1.886 . 2.465 1.889 1.884 1.892 . 0 0 "[ . 1 . 2]" 1 228 1 57 LEU QD 1 61 LEU MD1 1.259 . 6.000 1.824 1.739 1.913 . 0 0 "[ . 1 . 2]" 1 229 2 57 LEU QD 2 61 LEU MD1 1.259 . 6.000 1.823 1.738 1.913 . 0 0 "[ . 1 . 2]" 1 230 1 57 LEU MD1 1 57 LEU MD2 1.553 . 6.000 2.073 2.044 2.086 . 0 0 "[ . 1 . 2]" 1 231 2 57 LEU MD1 2 57 LEU MD2 1.553 . 6.000 2.073 2.042 2.086 . 0 0 "[ . 1 . 2]" 1 232 1 54 ASN HB3 1 57 LEU QD 5.536 . 9.366 3.715 3.215 4.610 . 0 0 "[ . 1 . 2]" 1 233 2 54 ASN HB3 2 57 LEU QD 5.536 . 9.366 3.716 3.213 4.611 . 0 0 "[ . 1 . 2]" 1 234 1 49 ILE H 1 49 ILE MD 3.302 . 4.665 3.166 3.063 3.254 . 0 0 "[ . 1 . 2]" 1 235 2 49 ILE H 2 49 ILE MD 3.302 . 4.665 3.167 3.063 3.253 . 0 0 "[ . 1 . 2]" 1 236 1 32 PHE HE2 1 49 ILE MD 2.915 . 3.977 2.220 1.927 2.824 . 0 0 "[ . 1 . 2]" 1 237 2 32 PHE HE2 2 49 ILE MD 2.915 . 3.977 2.220 1.926 2.822 . 0 0 "[ . 1 . 2]" 1 238 1 49 ILE MD 1 49 ILE HG13 1.860 . 2.782 2.114 2.112 2.115 . 0 0 "[ . 1 . 2]" 1 239 2 49 ILE MD 2 49 ILE HG13 1.860 . 2.782 2.114 2.112 2.116 . 0 0 "[ . 1 . 2]" 1 240 1 47 ILE H 1 47 ILE MD 2.623 . 3.483 1.874 1.617 2.220 0.184 9 0 "[ . 1 . 2]" 1 241 2 47 ILE H 2 47 ILE MD 2.623 . 3.483 1.875 1.621 2.223 0.180 9 0 "[ . 1 . 2]" 1 242 1 47 ILE MD 2 57 LEU HA 3.650 . 5.315 3.204 2.678 3.610 . 0 0 "[ . 1 . 2]" 1 243 1 57 LEU HA 2 47 ILE MD 3.650 . 5.315 3.207 2.679 3.613 . 0 0 "[ . 1 . 2]" 1 244 1 47 ILE MD 2 49 ILE HG13 2.951 . 4.039 3.620 3.361 4.116 0.077 4 0 "[ . 1 . 2]" 1 245 1 49 ILE HG13 2 47 ILE MD 2.951 . 4.039 3.622 3.361 4.119 0.080 4 0 "[ . 1 . 2]" 1 246 1 47 ILE MD 2 51 PHE HB3 3.651 . 5.317 3.742 3.431 4.108 . 0 0 "[ . 1 . 2]" 1 247 1 51 PHE HB3 2 47 ILE MD 3.651 . 5.317 3.741 3.436 4.127 . 0 0 "[ . 1 . 2]" 1 248 1 25 GLU HA 1 38 ILE MD 3.847 . 5.697 3.692 3.576 3.905 . 0 0 "[ . 1 . 2]" 1 249 2 25 GLU HA 2 38 ILE MD 3.847 . 5.697 3.692 3.573 3.906 . 0 0 "[ . 1 . 2]" 1 250 1 38 ILE H 1 38 ILE MD 4.190 . 6.384 3.859 3.761 3.954 . 0 0 "[ . 1 . 2]" 1 251 2 38 ILE H 2 38 ILE MD 4.190 . 6.384 3.859 3.763 3.949 . 0 0 "[ . 1 . 2]" 1 252 1 38 ILE MD 1 39 LYS H 5.502 . 9.286 5.066 4.951 5.303 . 0 0 "[ . 1 . 2]" 1 253 2 38 ILE MD 2 39 LYS H 5.502 . 9.286 5.065 4.958 5.303 . 0 0 "[ . 1 . 2]" 1 254 1 25 GLU H 1 38 ILE MD 3.731 . 5.471 3.621 3.429 3.824 . 0 0 "[ . 1 . 2]" 1 255 2 25 GLU H 2 38 ILE MD 3.731 . 5.471 3.623 3.431 3.830 . 0 0 "[ . 1 . 2]" 1 256 1 37 ASN HA 1 38 ILE MD 6.138 . 10.847 5.174 4.774 5.367 . 0 0 "[ . 1 . 2]" 1 257 2 37 ASN HA 2 38 ILE MD 6.138 . 10.847 5.174 4.776 5.366 . 0 0 "[ . 1 . 2]" 1 258 1 21 LEU HA 1 38 ILE MD 3.561 . 5.146 3.174 2.719 3.765 . 0 0 "[ . 1 . 2]" 1 259 2 21 LEU HA 2 38 ILE MD 3.561 . 5.146 3.173 2.722 3.767 . 0 0 "[ . 1 . 2]" 1 260 1 25 GLU HG3 1 38 ILE MD 2.457 . 3.212 2.211 2.027 2.460 . 0 0 "[ . 1 . 2]" 1 261 2 25 GLU HG3 2 38 ILE MD 2.457 . 3.212 2.211 2.029 2.466 . 0 0 "[ . 1 . 2]" 1 262 1 25 GLU HG2 1 38 ILE MD 2.879 . 3.915 2.806 2.597 3.082 . 0 0 "[ . 1 . 2]" 1 263 2 25 GLU HG2 2 38 ILE MD 2.879 . 3.915 2.805 2.596 3.081 . 0 0 "[ . 1 . 2]" 1 264 1 51 PHE HD2 1 60 ILE MD 3.936 . 5.873 4.497 2.629 5.101 . 0 0 "[ . 1 . 2]" 1 265 2 51 PHE HD2 2 60 ILE MD 3.936 . 5.873 4.497 2.629 5.104 . 0 0 "[ . 1 . 2]" 1 266 1 57 LEU HA 1 60 ILE MD 3.173 . 4.432 2.910 2.439 4.307 . 0 0 "[ . 1 . 2]" 1 267 2 57 LEU HA 2 60 ILE MD 3.173 . 4.432 2.911 2.441 4.310 . 0 0 "[ . 1 . 2]" 1 268 1 51 PHE HB2 1 60 ILE MD 3.514 . 5.058 3.255 2.938 4.514 . 0 0 "[ . 1 . 2]" 1 269 2 51 PHE HB2 2 60 ILE MD 3.514 . 5.058 3.255 2.938 4.517 . 0 0 "[ . 1 . 2]" 1 270 1 60 ILE MD 1 61 LEU H 4.207 . 6.419 4.463 4.330 4.552 . 0 0 "[ . 1 . 2]" 1 271 2 60 ILE MD 2 61 LEU H 4.207 . 6.419 4.463 4.329 4.554 . 0 0 "[ . 1 . 2]" 1 272 1 60 ILE H 1 60 ILE MD 3.311 . 4.682 3.436 2.979 3.612 . 0 0 "[ . 1 . 2]" 1 273 2 60 ILE H 2 60 ILE MD 3.311 . 4.682 3.437 2.982 3.612 . 0 0 "[ . 1 . 2]" 1 274 1 59 ARG HE 1 60 ILE MD 3.220 . 4.516 4.160 3.157 5.571 1.055 18 2 "[ . - 1 . + 2]" 1 275 2 59 ARG HE 2 60 ILE MD 3.220 . 4.516 4.159 3.155 5.574 1.058 18 2 "[ . - 1 . + 2]" 1 276 1 60 ILE HA 1 60 ILE MD 3.744 . 5.496 3.757 2.076 3.876 . 0 0 "[ . 1 . 2]" 1 277 2 60 ILE HA 2 60 ILE MD 3.744 . 5.496 3.757 2.077 3.876 . 0 0 "[ . 1 . 2]" 1 278 1 51 PHE HB3 1 60 ILE MD 2.310 . 2.977 2.110 1.907 3.661 0.684 4 1 "[ +. 1 . 2]" 1 279 2 51 PHE HB3 2 60 ILE MD 2.310 . 2.977 2.110 1.905 3.663 0.686 4 1 "[ +. 1 . 2]" 1 280 1 60 ILE MD 1 60 ILE QG 1.763 . 2.152 1.884 1.882 1.886 . 0 0 "[ . 1 . 2]" 1 281 2 60 ILE MD 2 60 ILE QG 1.763 . 2.152 1.884 1.882 1.886 . 0 0 "[ . 1 . 2]" 1 282 1 51 PHE HA 1 60 ILE MD 5.047 . 8.232 3.432 3.102 4.280 . 0 0 "[ . 1 . 2]" 1 283 2 51 PHE HA 2 60 ILE MD 5.047 . 8.232 3.433 3.099 4.287 . 0 0 "[ . 1 . 2]" 1 284 1 57 LEU QD 1 58 ASP HB3 5.462 . 9.192 5.121 3.968 5.546 . 0 0 "[ . 1 . 2]" 1 285 2 57 LEU QD 2 58 ASP HB3 5.462 . 9.192 5.121 3.964 5.546 . 0 0 "[ . 1 . 2]" 1 286 1 36 VAL HA 1 49 ILE MG 4.036 . 6.072 3.603 3.364 3.895 . 0 0 "[ . 1 . 2]" 1 287 2 36 VAL HA 2 49 ILE MG 4.036 . 6.072 3.604 3.367 3.897 . 0 0 "[ . 1 . 2]" 1 288 1 34 THR HB 1 49 ILE MG 4.218 . 6.442 4.332 4.170 4.550 . 0 0 "[ . 1 . 2]" 1 289 2 34 THR HB 2 49 ILE MG 4.218 . 6.442 4.331 4.170 4.550 . 0 0 "[ . 1 . 2]" 1 290 1 32 PHE HB3 1 49 ILE MG 4.387 . 6.793 4.662 3.479 5.712 . 0 0 "[ . 1 . 2]" 1 291 2 32 PHE HB3 2 49 ILE MG 4.387 . 6.793 4.661 3.474 5.713 . 0 0 "[ . 1 . 2]" 1 292 1 49 ILE H 1 49 ILE MG 3.809 . 5.623 3.846 3.831 3.863 . 0 0 "[ . 1 . 2]" 1 293 2 49 ILE H 2 49 ILE MG 3.809 . 5.623 3.846 3.830 3.863 . 0 0 "[ . 1 . 2]" 1 294 1 37 ASN H 1 49 ILE MG 5.806 . 8.029 5.106 4.890 5.321 . 0 0 "[ . 1 . 2]" 1 295 2 37 ASN H 2 49 ILE MG 5.806 . 8.029 5.106 4.887 5.322 . 0 0 "[ . 1 . 2]" 1 296 1 49 ILE MG 1 50 GLU H 2.860 . 3.539 2.843 2.560 3.100 . 0 0 "[ . 1 . 2]" 1 297 2 49 ILE MG 2 50 GLU H 2.860 . 3.539 2.843 2.563 3.100 . 0 0 "[ . 1 . 2]" 1 298 1 49 ILE HA 1 49 ILE MG 2.945 . 4.029 2.248 2.211 2.291 . 0 0 "[ . 1 . 2]" 1 299 2 49 ILE HA 2 49 ILE MG 2.945 . 4.029 2.248 2.210 2.290 . 0 0 "[ . 1 . 2]" 1 300 1 49 ILE MG 1 60 ILE HA 4.766 . 7.606 4.268 3.985 4.625 . 0 0 "[ . 1 . 2]" 1 301 2 49 ILE MG 2 60 ILE HA 4.766 . 7.606 4.268 3.985 4.627 . 0 0 "[ . 1 . 2]" 1 302 1 32 PHE HB2 1 49 ILE MG 3.524 . 5.077 4.008 3.341 4.785 . 0 0 "[ . 1 . 2]" 1 303 2 32 PHE HB2 2 49 ILE MG 3.524 . 5.077 4.008 3.342 4.786 . 0 0 "[ . 1 . 2]" 1 304 1 49 ILE HG13 1 49 ILE MG 2.208 . 2.817 2.349 2.314 2.406 . 0 0 "[ . 1 . 2]" 1 305 2 49 ILE HG13 2 49 ILE MG 2.208 . 2.817 2.349 2.314 2.404 . 0 0 "[ . 1 . 2]" 1 306 1 49 ILE MG 2 64 LEU MD2 2.026 . 6.000 3.480 3.291 3.843 . 0 0 "[ . 1 . 2]" 1 307 1 64 LEU MD2 2 49 ILE MG 2.026 . 6.000 3.484 3.291 3.857 . 0 0 "[ . 1 . 2]" 1 308 1 49 ILE MG 1 60 ILE MG 1.625 . 1.955 1.912 1.819 2.092 0.137 8 0 "[ . 1 . 2]" 1 309 2 49 ILE MG 2 60 ILE MG 1.625 . 1.955 1.912 1.820 2.089 0.134 8 0 "[ . 1 . 2]" 1 310 1 38 ILE H 1 38 ILE MG 4.116 . 6.234 3.827 3.785 3.848 . 0 0 "[ . 1 . 2]" 1 311 2 38 ILE H 2 38 ILE MG 4.116 . 6.234 3.827 3.786 3.849 . 0 0 "[ . 1 . 2]" 1 312 1 38 ILE MG 1 48 GLU H 5.458 . 9.182 4.869 4.600 5.226 . 0 0 "[ . 1 . 2]" 1 313 2 38 ILE MG 2 48 GLU H 5.458 . 9.182 4.869 4.600 5.226 . 0 0 "[ . 1 . 2]" 1 314 1 38 ILE MG 1 39 LYS H 2.843 . 3.118 2.602 2.383 3.003 . 0 0 "[ . 1 . 2]" 1 315 2 38 ILE MG 2 39 LYS H 2.843 . 3.118 2.601 2.377 3.005 . 0 0 "[ . 1 . 2]" 1 316 1 38 ILE MG 1 46 LYS H 4.111 . 4.638 3.421 3.006 3.742 . 0 0 "[ . 1 . 2]" 1 317 2 38 ILE MG 2 46 LYS H 4.111 . 4.638 3.422 3.010 3.737 . 0 0 "[ . 1 . 2]" 1 318 1 38 ILE HA 1 38 ILE MG 3.703 . 5.417 2.390 2.338 2.496 . 0 0 "[ . 1 . 2]" 1 319 2 38 ILE HA 2 38 ILE MG 3.703 . 5.417 2.390 2.335 2.498 . 0 0 "[ . 1 . 2]" 1 320 1 21 LEU HA 1 38 ILE MG 4.831 . 7.748 4.636 4.124 5.520 . 0 0 "[ . 1 . 2]" 1 321 2 21 LEU HA 2 38 ILE MG 4.831 . 7.748 4.636 4.126 5.520 . 0 0 "[ . 1 . 2]" 1 322 1 25 GLU HG3 1 38 ILE MG 4.568 . 7.176 4.477 4.260 4.698 . 0 0 "[ . 1 . 2]" 1 323 2 25 GLU HG3 2 38 ILE MG 4.568 . 7.176 4.477 4.263 4.698 . 0 0 "[ . 1 . 2]" 1 324 1 38 ILE HB 1 38 ILE MG 1.908 . 2.363 2.130 2.128 2.132 . 0 0 "[ . 1 . 2]" 1 325 2 38 ILE HB 2 38 ILE MG 1.908 . 2.363 2.130 2.126 2.131 . 0 0 "[ . 1 . 2]" 1 326 1 23 GLU H 1 24 ARG HD2 5.887 . 10.219 6.283 6.036 6.516 . 0 0 "[ . 1 . 2]" 1 327 2 23 GLU H 2 24 ARG HD2 5.887 . 10.219 6.284 6.042 6.520 . 0 0 "[ . 1 . 2]" 1 328 1 24 ARG HD3 2 57 LEU H 5.470 . 9.210 9.373 8.563 10.058 0.848 4 3 "[ +- * 1 . 2]" 1 329 1 57 LEU H 2 24 ARG HD3 5.470 . 9.210 9.368 8.583 10.026 0.816 4 4 "[ +* * 1 . - 2]" 1 330 1 56 ASP QB 2 45 GLY H 4.981 . 8.082 6.734 6.144 8.198 0.116 2 0 "[ . 1 . 2]" 1 331 1 45 GLY H 2 56 ASP QB 4.981 . 8.082 6.726 6.142 8.178 0.096 2 0 "[ . 1 . 2]" 1 332 1 56 ASP QB 1 59 ARG HE 3.117 . 4.332 3.611 2.540 5.220 0.888 7 3 "[ -. + 1 *. 2]" 1 333 2 56 ASP QB 2 59 ARG HE 3.117 . 4.332 3.611 2.549 5.219 0.887 7 3 "[ -. + 1 *. 2]" 1 334 1 37 ASN HD21 1 39 LYS QE 4.790 . 5.928 4.325 3.792 4.990 . 0 0 "[ . 1 . 2]" 1 335 2 37 ASN HD21 2 39 LYS QE 4.790 . 5.928 4.325 3.781 4.983 . 0 0 "[ . 1 . 2]" 1 336 1 39 LYS QE 1 48 GLU H 5.367 . 8.968 4.841 4.516 5.210 . 0 0 "[ . 1 . 2]" 1 337 2 39 LYS QE 2 48 GLU H 5.367 . 8.968 4.842 4.513 5.207 . 0 0 "[ . 1 . 2]" 1 338 1 46 LYS HE2 1 48 GLU H 5.542 . 9.382 6.523 5.190 7.679 . 0 0 "[ . 1 . 2]" 1 339 2 46 LYS HE2 2 48 GLU H 5.542 . 9.382 6.523 5.180 7.673 . 0 0 "[ . 1 . 2]" 1 340 1 39 LYS QE 1 48 GLU QG 2.729 . 3.660 3.036 2.776 3.376 . 0 0 "[ . 1 . 2]" 1 341 2 39 LYS QE 2 48 GLU QG 2.729 . 3.660 3.036 2.783 3.371 . 0 0 "[ . 1 . 2]" 1 342 1 46 LYS QE 1 48 GLU QG 4.273 . 6.555 4.198 3.456 5.718 . 0 0 "[ . 1 . 2]" 1 343 2 46 LYS QE 2 48 GLU QG 4.273 . 6.555 4.199 3.452 5.719 . 0 0 "[ . 1 . 2]" 1 344 1 46 LYS QD 1 46 LYS HE2 2.193 . 2.794 2.363 2.332 2.473 . 0 0 "[ . 1 . 2]" 1 345 2 46 LYS QD 2 46 LYS HE2 2.193 . 2.794 2.363 2.333 2.472 . 0 0 "[ . 1 . 2]" 1 346 1 46 LYS HE2 1 46 LYS QG 2.141 . 2.714 2.401 2.229 2.451 . 0 0 "[ . 1 . 2]" 1 347 2 46 LYS HE2 2 46 LYS QG 2.141 . 2.714 2.402 2.226 2.454 . 0 0 "[ . 1 . 2]" 1 348 1 64 LEU HB3 2 32 PHE HE2 5.434 . 9.124 3.806 2.444 4.680 . 0 0 "[ . 1 . 2]" 1 349 1 32 PHE HE2 2 64 LEU HB3 5.434 . 9.124 3.802 2.443 4.657 . 0 0 "[ . 1 . 2]" 1 350 1 21 LEU HB3 1 22 LYS H 3.893 . 5.788 3.610 3.433 3.928 . 0 0 "[ . 1 . 2]" 1 351 2 21 LEU HB3 2 22 LYS H 3.893 . 5.788 3.610 3.436 3.926 . 0 0 "[ . 1 . 2]" 1 352 1 21 LEU HB2 1 22 LYS H 3.197 . 4.475 2.705 2.561 2.951 . 0 0 "[ . 1 . 2]" 1 353 2 21 LEU HB2 2 22 LYS H 3.197 . 4.475 2.705 2.565 2.947 . 0 0 "[ . 1 . 2]" 1 354 1 18 ASP HB3 1 21 LEU QD 4.115 . 6.232 3.931 3.639 4.249 . 0 0 "[ . 1 . 2]" 1 355 2 18 ASP HB3 2 21 LEU QD 4.115 . 6.232 3.931 3.635 4.239 . 0 0 "[ . 1 . 2]" 1 356 1 18 ASP HB2 1 21 LEU QD 4.324 . 6.661 4.126 3.668 4.738 . 0 0 "[ . 1 . 2]" 1 357 2 18 ASP HB2 2 21 LEU QD 4.324 . 6.661 4.127 3.679 4.739 . 0 0 "[ . 1 . 2]" 1 358 1 21 LEU HB3 1 38 ILE MD 2.060 . 2.591 2.386 2.076 2.631 0.040 2 0 "[ . 1 . 2]" 1 359 2 21 LEU HB3 2 38 ILE MD 2.060 . 2.591 2.386 2.075 2.632 0.041 2 0 "[ . 1 . 2]" 1 360 1 52 PHE H 1 52 PHE HB2 3.933 . 5.866 3.033 2.476 3.820 . 0 0 "[ . 1 . 2]" 1 361 2 52 PHE H 2 52 PHE HB2 3.933 . 5.866 3.033 2.474 3.819 . 0 0 "[ . 1 . 2]" 1 362 1 52 PHE HB2 1 53 SER H 4.881 . 7.860 3.831 3.065 4.386 . 0 0 "[ . 1 . 2]" 1 363 2 52 PHE HB2 2 53 SER H 4.881 . 7.860 3.834 3.066 4.387 . 0 0 "[ . 1 . 2]" 1 364 1 32 PHE HB2 1 58 ASP H 6.801 . 12.583 9.663 8.754 10.730 . 0 0 "[ . 1 . 2]" 1 365 2 32 PHE HB2 2 58 ASP H 6.801 . 12.583 9.664 8.746 10.749 . 0 0 "[ . 1 . 2]" 1 366 1 32 PHE HB2 1 34 THR MG . . 2.949 2.475 1.887 3.536 0.587 17 2 "[ . 1- . + 2]" 1 367 2 32 PHE HB2 2 34 THR MG . . 2.949 2.475 1.887 3.536 0.587 17 2 "[ . 1- . + 2]" 1 368 1 61 LEU HB3 1 62 GLU H 4.267 . 6.543 3.741 3.550 3.900 . 0 0 "[ . 1 . 2]" 1 369 2 61 LEU HB3 2 62 GLU H 4.267 . 6.543 3.740 3.548 3.897 . 0 0 "[ . 1 . 2]" 1 370 1 57 LEU HB2 1 57 LEU QD 3.097 . 4.296 2.115 2.048 2.154 . 0 0 "[ . 1 . 2]" 1 371 2 57 LEU HB2 2 57 LEU QD 3.097 . 4.296 2.115 2.048 2.152 . 0 0 "[ . 1 . 2]" 1 372 1 30 ASN HB3 1 33 GLY H 5.607 . 9.537 5.229 5.086 5.438 . 0 0 "[ . 1 . 2]" 1 373 2 30 ASN HB3 2 33 GLY H 5.607 . 9.537 5.230 5.085 5.437 . 0 0 "[ . 1 . 2]" 1 374 1 31 TYR H 1 31 TYR HB3 3.723 . 5.456 2.745 2.665 2.838 . 0 0 "[ . 1 . 2]" 1 375 2 31 TYR H 2 31 TYR HB3 3.723 . 5.456 2.744 2.661 2.842 . 0 0 "[ . 1 . 2]" 1 376 1 31 TYR H 1 31 TYR HB2 3.759 . 5.525 2.412 2.241 2.508 . 0 0 "[ . 1 . 2]" 1 377 2 31 TYR H 2 31 TYR HB2 3.759 . 5.525 2.413 2.241 2.507 . 0 0 "[ . 1 . 2]" 1 378 1 31 TYR HB3 1 32 PHE H 5.282 . 8.769 2.483 2.277 2.721 . 0 0 "[ . 1 . 2]" 1 379 2 31 TYR HB3 2 32 PHE H 5.282 . 8.769 2.483 2.277 2.725 . 0 0 "[ . 1 . 2]" 1 380 1 28 LEU MD2 1 31 TYR HB3 4.738 . 7.545 3.892 3.443 4.123 . 0 0 "[ . 1 . 2]" 1 381 2 28 LEU MD2 2 31 TYR HB3 4.738 . 7.545 3.893 3.441 4.125 . 0 0 "[ . 1 . 2]" 1 382 1 28 LEU MD2 1 31 TYR HB2 3.946 . 4.751 3.982 3.474 4.197 . 0 0 "[ . 1 . 2]" 1 383 2 28 LEU MD2 2 31 TYR HB2 3.946 . 4.751 3.983 3.474 4.197 . 0 0 "[ . 1 . 2]" 1 384 1 49 ILE HB 1 49 ILE MD 3.419 . 4.880 3.239 3.236 3.243 . 0 0 "[ . 1 . 2]" 1 385 2 49 ILE HB 2 49 ILE MD 3.419 . 4.880 3.239 3.235 3.242 . 0 0 "[ . 1 . 2]" 1 386 1 49 ILE HB 2 47 ILE MD 2.432 . 3.171 2.270 2.094 2.604 . 0 0 "[ . 1 . 2]" 1 387 1 47 ILE MD 2 49 ILE HB 2.432 . 3.171 2.271 2.102 2.614 . 0 0 "[ . 1 . 2]" 1 388 1 61 LEU HB3 1 61 LEU MD2 2.542 . 2.932 2.350 2.280 2.451 . 0 0 "[ . 1 . 2]" 1 389 2 61 LEU HB3 2 61 LEU MD2 2.542 . 2.932 2.350 2.284 2.450 . 0 0 "[ . 1 . 2]" 1 390 1 58 ASP HA 1 61 LEU HB2 3.813 . 5.631 3.009 2.687 3.353 . 0 0 "[ . 1 . 2]" 1 391 2 58 ASP HA 2 61 LEU HB2 3.813 . 5.631 3.007 2.682 3.361 . 0 0 "[ . 1 . 2]" 1 392 1 62 GLU HA 1 64 LEU HB2 4.445 . 6.915 5.367 5.079 5.604 . 0 0 "[ . 1 . 2]" 1 393 2 62 GLU HA 2 64 LEU HB2 4.445 . 6.915 5.367 5.079 5.603 . 0 0 "[ . 1 . 2]" 1 394 1 60 ILE HA 1 63 LEU QB . . 4.390 3.232 2.678 3.967 . 0 0 "[ . 1 . 2]" 1 395 2 60 ILE HA 2 63 LEU QB . . 4.390 3.234 2.680 3.971 . 0 0 "[ . 1 . 2]" 1 396 1 63 LEU QB 1 63 LEU QD 2.472 . 3.236 2.057 2.042 2.069 . 0 0 "[ . 1 . 2]" 1 397 2 63 LEU QB 2 63 LEU QD 2.472 . 3.236 2.057 2.043 2.069 . 0 0 "[ . 1 . 2]" 1 398 1 31 TYR HE2 1 63 LEU QB 5.451 . 9.166 4.764 3.891 5.200 . 0 0 "[ . 1 . 2]" 1 399 2 31 TYR HE2 2 63 LEU QB 5.451 . 9.166 4.764 3.889 5.200 . 0 0 "[ . 1 . 2]" 1 400 1 57 LEU HB3 1 57 LEU QD . . 3.064 2.207 2.114 2.362 . 0 0 "[ . 1 . 2]" 1 401 2 57 LEU HB3 2 57 LEU QD . . 3.064 2.207 2.113 2.362 . 0 0 "[ . 1 . 2]" 1 402 1 25 GLU H 1 25 GLU HG2 4.473 . 6.974 3.649 3.567 3.731 . 0 0 "[ . 1 . 2]" 1 403 2 25 GLU H 2 25 GLU HG2 4.473 . 6.974 3.650 3.569 3.737 . 0 0 "[ . 1 . 2]" 1 404 1 25 GLU HG2 1 26 SER H 5.639 . 9.613 5.064 4.992 5.165 . 0 0 "[ . 1 . 2]" 1 405 2 25 GLU HG2 2 26 SER H 5.639 . 9.613 5.064 4.984 5.163 . 0 0 "[ . 1 . 2]" 1 406 1 24 ARG H 1 25 GLU HG3 4.928 . 7.964 4.422 4.248 4.694 . 0 0 "[ . 1 . 2]" 1 407 2 24 ARG H 2 25 GLU HG3 4.928 . 7.964 4.421 4.244 4.687 . 0 0 "[ . 1 . 2]" 1 408 1 25 GLU HG3 1 37 ASN HA 5.132 . 8.425 4.936 4.469 5.115 . 0 0 "[ . 1 . 2]" 1 409 2 25 GLU HG3 2 37 ASN HA 5.132 . 8.425 4.937 4.476 5.116 . 0 0 "[ . 1 . 2]" 1 410 1 25 GLU HA 1 25 GLU HG3 3.578 . 5.178 2.921 2.816 3.032 . 0 0 "[ . 1 . 2]" 1 411 2 25 GLU HA 2 25 GLU HG3 3.578 . 5.178 2.922 2.818 3.025 . 0 0 "[ . 1 . 2]" 1 412 1 25 GLU HA 1 25 GLU HG2 3.279 . 4.623 2.535 2.454 2.594 . 0 0 "[ . 1 . 2]" 1 413 2 25 GLU HA 2 25 GLU HG2 3.279 . 4.623 2.534 2.453 2.591 . 0 0 "[ . 1 . 2]" 1 414 1 22 LYS HA 1 25 GLU HG2 5.242 . 8.677 4.581 3.900 5.030 . 0 0 "[ . 1 . 2]" 1 415 2 22 LYS HA 2 25 GLU HG2 5.242 . 8.677 4.582 3.907 5.037 . 0 0 "[ . 1 . 2]" 1 416 1 22 LYS HA 1 25 GLU HG3 4.271 . 6.551 3.337 2.257 3.859 . 0 0 "[ . 1 . 2]" 1 417 2 22 LYS HA 2 25 GLU HG3 4.271 . 6.551 3.337 2.260 3.862 . 0 0 "[ . 1 . 2]" 1 418 1 25 GLU HG3 1 29 GLN HE22 6.321 . 11.315 7.327 7.014 7.486 . 0 0 "[ . 1 . 2]" 1 419 2 25 GLU HG3 2 29 GLN HE22 6.321 . 11.315 7.328 7.021 7.491 . 0 0 "[ . 1 . 2]" 1 420 1 30 ASN HB2 1 32 PHE H 6.237 . 11.099 5.608 5.463 5.751 . 0 0 "[ . 1 . 2]" 1 421 2 30 ASN HB2 2 32 PHE H 6.237 . 11.099 5.607 5.468 5.753 . 0 0 "[ . 1 . 2]" 1 422 1 30 ASN HB3 1 32 PHE H 6.620 . 12.098 5.940 5.705 6.072 . 0 0 "[ . 1 . 2]" 1 423 2 30 ASN HB3 2 32 PHE H 6.620 . 12.098 5.941 5.700 6.070 . 0 0 "[ . 1 . 2]" 1 424 1 54 ASN HB2 1 55 GLU H 4.704 . 7.470 4.101 3.943 4.201 . 0 0 "[ . 1 . 2]" 1 425 2 54 ASN HB2 2 55 GLU H 4.704 . 7.470 4.100 3.937 4.202 . 0 0 "[ . 1 . 2]" 1 426 1 27 TYR HB3 1 28 LEU MD2 4.710 . 7.483 3.655 3.391 3.785 . 0 0 "[ . 1 . 2]" 1 427 2 27 TYR HB3 2 28 LEU MD2 4.710 . 7.483 3.654 3.389 3.787 . 0 0 "[ . 1 . 2]" 1 428 1 27 TYR HB2 1 28 LEU MD2 6.344 . 11.375 5.044 4.801 5.183 . 0 0 "[ . 1 . 2]" 1 429 2 27 TYR HB2 2 28 LEU MD2 6.344 . 11.375 5.043 4.800 5.185 . 0 0 "[ . 1 . 2]" 1 430 1 50 GLU HG2 2 47 ILE H 6.598 . 12.040 5.643 5.176 6.252 . 0 0 "[ . 1 . 2]" 1 431 1 47 ILE H 2 50 GLU HG2 6.598 . 12.040 5.648 5.171 6.267 . 0 0 "[ . 1 . 2]" 1 432 1 38 ILE HB 2 51 PHE QE 6.700 . 12.311 5.349 5.159 5.669 . 0 0 "[ . 1 . 2]" 1 433 1 51 PHE HE2 2 38 ILE HB 6.700 . 12.311 6.605 5.259 7.537 . 0 0 "[ . 1 . 2]" 1 434 1 37 ASN HD22 1 50 GLU HG2 5.106 . 8.365 4.868 4.152 5.567 . 0 0 "[ . 1 . 2]" 1 435 2 37 ASN HD22 2 50 GLU HG2 5.106 . 8.365 4.869 4.162 5.569 . 0 0 "[ . 1 . 2]" 1 436 1 50 GLU HG2 1 52 PHE HD2 5.461 . 9.189 7.523 6.841 8.033 . 0 0 "[ . 1 . 2]" 1 437 2 50 GLU HG2 2 52 PHE HD2 5.461 . 9.189 7.526 6.852 8.031 . 0 0 "[ . 1 . 2]" 1 438 1 50 GLU HG2 1 51 PHE H 5.947 . 10.368 4.551 4.165 5.069 . 0 0 "[ . 1 . 2]" 1 439 2 50 GLU HG2 2 51 PHE H 5.947 . 10.368 4.550 4.166 5.069 . 0 0 "[ . 1 . 2]" 1 440 1 35 THR HA 1 50 GLU HG3 5.032 . 8.197 5.413 5.046 5.763 . 0 0 "[ . 1 . 2]" 1 441 2 35 THR HA 2 50 GLU HG3 5.032 . 8.197 5.413 5.052 5.752 . 0 0 "[ . 1 . 2]" 1 442 1 35 THR HB 1 50 GLU HG2 5.032 . 8.198 3.962 2.790 4.783 . 0 0 "[ . 1 . 2]" 1 443 2 35 THR HB 2 50 GLU HG2 5.032 . 8.198 3.962 2.795 4.777 . 0 0 "[ . 1 . 2]" 1 444 1 35 THR MG 1 50 GLU HG3 2.946 . 4.031 3.093 2.580 3.510 . 0 0 "[ . 1 . 2]" 1 445 2 35 THR MG 2 50 GLU HG3 2.946 . 4.031 3.093 2.584 3.512 . 0 0 "[ . 1 . 2]" 1 446 1 35 THR MG 1 50 GLU HG2 3.690 . 5.392 4.071 3.084 4.721 . 0 0 "[ . 1 . 2]" 1 447 2 35 THR MG 2 50 GLU HG2 3.690 . 5.392 4.071 3.082 4.721 . 0 0 "[ . 1 . 2]" 1 448 1 55 GLU HA 1 55 GLU HG3 3.354 . 4.760 3.000 2.467 3.753 . 0 0 "[ . 1 . 2]" 1 449 2 55 GLU HA 2 55 GLU HG3 3.354 . 4.760 2.998 2.472 3.751 . 0 0 "[ . 1 . 2]" 1 450 1 55 GLU HA 1 55 GLU HG2 3.674 . 5.361 3.221 2.524 3.767 . 0 0 "[ . 1 . 2]" 1 451 2 55 GLU HA 2 55 GLU HG2 3.674 . 5.361 3.221 2.526 3.767 . 0 0 "[ . 1 . 2]" 1 452 1 23 GLU HA 1 23 GLU HG2 3.658 . 5.330 3.286 2.519 3.805 . 0 0 "[ . 1 . 2]" 1 453 2 23 GLU HA 2 23 GLU HG2 3.658 . 5.330 3.284 2.514 3.813 . 0 0 "[ . 1 . 2]" 1 454 1 20 VAL HA 1 23 GLU HG2 3.360 . 4.771 3.047 2.112 4.580 . 0 0 "[ . 1 . 2]" 1 455 2 20 VAL HA 2 23 GLU HG2 3.360 . 4.771 3.047 2.107 4.584 . 0 0 "[ . 1 . 2]" 1 456 1 62 GLU HA 1 62 GLU HG3 2.871 . 3.901 2.788 2.400 3.757 . 0 0 "[ . 1 . 2]" 1 457 2 62 GLU HA 2 62 GLU HG3 2.871 . 3.901 2.789 2.406 3.755 . 0 0 "[ . 1 . 2]" 1 458 1 62 GLU HA 1 62 GLU HG2 3.609 . 5.237 3.023 2.380 3.768 . 0 0 "[ . 1 . 2]" 1 459 2 62 GLU HA 2 62 GLU HG2 3.609 . 5.237 3.025 2.379 3.772 . 0 0 "[ . 1 . 2]" 1 460 1 39 LYS QG 1 48 GLU QG 4.092 . 6.185 3.290 2.936 3.736 . 0 0 "[ . 1 . 2]" 1 461 2 39 LYS QG 2 48 GLU QG 4.092 . 6.185 3.291 2.934 3.740 . 0 0 "[ . 1 . 2]" 1 462 1 46 LYS HB2 1 47 ILE H 4.990 . 8.103 3.005 2.881 3.216 . 0 0 "[ . 1 . 2]" 1 463 2 46 LYS HB2 2 47 ILE H 4.990 . 8.103 3.005 2.885 3.218 . 0 0 "[ . 1 . 2]" 1 464 1 46 LYS HB2 1 47 ILE MD 5.838 . 10.098 4.443 4.233 4.916 . 0 0 "[ . 1 . 2]" 1 465 2 46 LYS HB2 2 47 ILE MD 5.838 . 10.098 4.444 4.236 4.914 . 0 0 "[ . 1 . 2]" 1 466 1 46 LYS HB3 2 60 ILE MG 5.528 . 9.348 7.200 6.900 7.674 . 0 0 "[ . 1 . 2]" 1 467 1 60 ILE MG 2 46 LYS HB3 5.528 . 9.348 7.208 6.926 7.690 . 0 0 "[ . 1 . 2]" 1 468 1 46 LYS HB3 2 49 ILE HG12 5.454 . 9.173 7.145 6.876 7.405 . 0 0 "[ . 1 . 2]" 1 469 1 49 ILE HG12 2 46 LYS HB3 5.454 . 9.173 7.153 6.878 7.407 . 0 0 "[ . 1 . 2]" 1 470 1 36 VAL HB 1 49 ILE HG12 4.572 . 7.185 6.992 6.892 7.071 . 0 0 "[ . 1 . 2]" 1 471 2 36 VAL HB 2 49 ILE HG12 4.572 . 7.185 6.992 6.894 7.071 . 0 0 "[ . 1 . 2]" 1 472 1 36 VAL HB 1 36 VAL MG1 2.118 . 2.212 2.117 2.115 2.121 . 0 0 "[ . 1 . 2]" 1 473 2 36 VAL HB 2 36 VAL MG1 2.118 . 2.212 2.117 2.114 2.120 . 0 0 "[ . 1 . 2]" 1 474 1 26 SER HA 1 29 GLN HG3 4.077 . 6.155 3.518 3.255 3.813 . 0 0 "[ . 1 . 2]" 1 475 2 26 SER HA 2 29 GLN HG3 4.077 . 6.155 3.517 3.256 3.817 . 0 0 "[ . 1 . 2]" 1 476 1 28 LEU H 1 29 GLN HG2 6.388 . 11.489 5.689 5.588 5.802 . 0 0 "[ . 1 . 2]" 1 477 2 28 LEU H 2 29 GLN HG2 6.388 . 11.489 5.689 5.590 5.804 . 0 0 "[ . 1 . 2]" 1 478 1 29 GLN HG2 1 35 THR HA 3.959 . 5.918 3.044 2.897 3.247 . 0 0 "[ . 1 . 2]" 1 479 2 29 GLN HG2 2 35 THR HA 3.959 . 5.918 3.045 2.892 3.251 . 0 0 "[ . 1 . 2]" 1 480 1 29 GLN HG2 1 34 THR HA 6.157 . 10.896 6.009 5.784 6.143 . 0 0 "[ . 1 . 2]" 1 481 2 29 GLN HG2 2 34 THR HA 6.157 . 10.896 6.008 5.782 6.140 . 0 0 "[ . 1 . 2]" 1 482 1 29 GLN HG2 1 36 VAL HB 2.629 . 3.493 2.052 1.933 2.235 . 0 0 "[ . 1 . 2]" 1 483 2 29 GLN HG2 2 36 VAL HB 2.629 . 3.493 2.053 1.933 2.234 . 0 0 "[ . 1 . 2]" 1 484 1 29 GLN HB2 1 29 GLN HG3 2.621 . 3.480 2.335 2.304 2.353 . 0 0 "[ . 1 . 2]" 1 485 2 29 GLN HB2 2 29 GLN HG3 2.621 . 3.480 2.335 2.306 2.355 . 0 0 "[ . 1 . 2]" 1 486 1 29 GLN HG3 1 36 VAL HB 4.110 . 6.221 2.427 2.234 2.597 . 0 0 "[ . 1 . 2]" 1 487 2 29 GLN HG3 2 36 VAL HB 4.110 . 6.221 2.427 2.234 2.590 . 0 0 "[ . 1 . 2]" 1 488 1 29 GLN HG3 1 36 VAL MG2 4.381 . 6.780 3.489 3.339 3.647 . 0 0 "[ . 1 . 2]" 1 489 2 29 GLN HG3 2 36 VAL MG2 4.381 . 6.780 3.489 3.336 3.642 . 0 0 "[ . 1 . 2]" 1 490 1 29 GLN HG2 1 35 THR MG 4.442 . 6.909 4.158 3.980 4.387 . 0 0 "[ . 1 . 2]" 1 491 2 29 GLN HG2 2 35 THR MG 4.442 . 6.909 4.157 3.973 4.394 . 0 0 "[ . 1 . 2]" 1 492 1 29 GLN HG2 1 49 ILE HG12 5.276 . 8.755 8.418 8.241 8.576 . 0 0 "[ . 1 . 2]" 1 493 2 29 GLN HG2 2 49 ILE HG12 5.276 . 8.755 8.418 8.241 8.574 . 0 0 "[ . 1 . 2]" 1 494 1 44 LYS HB2 1 45 GLY HA3 4.988 . 8.098 5.293 4.751 6.182 . 0 0 "[ . 1 . 2]" 1 495 2 44 LYS HB2 2 45 GLY HA3 4.988 . 8.098 5.294 4.753 6.182 . 0 0 "[ . 1 . 2]" 1 496 1 44 LYS HB3 1 45 GLY HA3 5.144 . 8.452 5.246 4.666 5.905 . 0 0 "[ . 1 . 2]" 1 497 2 44 LYS HB3 2 45 GLY HA3 5.144 . 8.452 5.246 4.668 5.905 . 0 0 "[ . 1 . 2]" 1 498 1 44 LYS HB2 2 52 PHE HB3 7.016 . 13.170 6.138 4.829 7.318 . 0 0 "[ . 1 . 2]" 1 499 1 52 PHE HB3 2 44 LYS HB2 7.016 . 13.170 6.144 4.824 7.345 . 0 0 "[ . 1 . 2]" 1 500 1 44 LYS HB2 1 44 LYS QE 5.104 . 8.360 4.297 3.927 4.520 . 0 0 "[ . 1 . 2]" 1 501 2 44 LYS HB2 2 44 LYS QE 5.104 . 8.360 4.297 3.927 4.520 . 0 0 "[ . 1 . 2]" 1 502 1 44 LYS HB3 1 44 LYS QE 4.879 . 7.854 4.079 3.935 4.442 . 0 0 "[ . 1 . 2]" 1 503 2 44 LYS HB3 2 44 LYS QE 4.879 . 7.854 4.078 3.933 4.443 . 0 0 "[ . 1 . 2]" 1 504 1 44 LYS HB2 2 52 PHE HA 7.000 . 13.124 4.871 3.594 6.080 . 0 0 "[ . 1 . 2]" 1 505 1 52 PHE HA 2 44 LYS HB2 7.000 . 13.124 4.878 3.586 6.096 . 0 0 "[ . 1 . 2]" 1 506 1 44 LYS HB3 2 52 PHE HA 5.998 . 10.494 4.096 2.901 6.077 . 0 0 "[ . 1 . 2]" 1 507 1 52 PHE HA 2 44 LYS HB3 5.998 . 10.494 4.105 2.900 6.082 . 0 0 "[ . 1 . 2]" 1 508 1 41 GLN H 1 41 GLN HG3 4.583 . 7.209 3.580 2.905 4.369 . 0 0 "[ . 1 . 2]" 1 509 2 41 GLN H 2 41 GLN HG3 4.583 . 7.209 3.578 2.898 4.371 . 0 0 "[ . 1 . 2]" 1 510 1 41 GLN HE22 1 41 GLN HG3 3.968 . 5.936 3.660 3.487 3.803 . 0 0 "[ . 1 . 2]" 1 511 2 41 GLN HE22 2 41 GLN HG3 3.968 . 5.936 3.661 3.491 3.800 . 0 0 "[ . 1 . 2]" 1 512 1 39 LYS QG 1 41 GLN HG3 4.434 . 6.891 5.447 4.740 6.631 . 0 0 "[ . 1 . 2]" 1 513 2 39 LYS QG 2 41 GLN HG3 4.434 . 6.891 5.447 4.743 6.629 . 0 0 "[ . 1 . 2]" 1 514 1 17 LYS HA 1 17 LYS HB3 2.816 . 3.808 2.455 2.323 2.503 . 0 0 "[ . 1 . 2]" 1 515 2 17 LYS HA 2 17 LYS HB3 2.816 . 3.808 2.454 2.322 2.503 . 0 0 "[ . 1 . 2]" 1 516 1 17 LYS HB3 1 17 LYS QE 4.651 . 7.355 4.064 3.863 4.212 . 0 0 "[ . 1 . 2]" 1 517 2 17 LYS HB3 2 17 LYS QE 4.651 . 7.355 4.064 3.862 4.207 . 0 0 "[ . 1 . 2]" 1 518 1 40 ARG HB3 1 40 ARG QD 3.930 . 5.861 2.973 2.736 3.541 . 0 0 "[ . 1 . 2]" 1 519 2 40 ARG HB3 2 40 ARG QD 3.930 . 5.861 2.974 2.735 3.541 . 0 0 "[ . 1 . 2]" 1 520 1 40 ARG HB2 1 40 ARG QD 4.137 . 6.277 3.460 2.846 3.556 . 0 0 "[ . 1 . 2]" 1 521 2 40 ARG HB2 2 40 ARG QD 4.137 . 6.277 3.460 2.848 3.554 . 0 0 "[ . 1 . 2]" 1 522 1 40 ARG HB2 2 51 PHE HZ 5.482 . 9.239 5.852 4.990 6.298 . 0 0 "[ . 1 . 2]" 1 523 1 51 PHE HZ 2 40 ARG HB2 5.482 . 9.239 5.857 4.992 6.306 . 0 0 "[ . 1 . 2]" 1 524 1 40 ARG HB3 2 51 PHE HZ 5.541 . 9.378 5.456 4.453 5.908 . 0 0 "[ . 1 . 2]" 1 525 1 51 PHE HZ 2 40 ARG HB3 5.541 . 9.378 5.461 4.459 5.910 . 0 0 "[ . 1 . 2]" 1 526 1 40 ARG HB2 2 51 PHE QE 6.219 . 11.054 6.108 5.706 6.424 . 0 0 "[ . 1 . 2]" 1 527 1 51 PHE HE2 2 40 ARG HB2 6.219 . 11.054 6.680 5.893 8.069 . 0 0 "[ . 1 . 2]" 1 528 1 40 ARG HB3 2 51 PHE QE 6.230 . 11.082 5.206 4.610 5.747 . 0 0 "[ . 1 . 2]" 1 529 1 51 PHE HE2 2 40 ARG HB3 6.230 . 11.082 5.851 4.611 7.643 . 0 0 "[ . 1 . 2]" 1 530 1 43 LYS HB3 1 44 LYS H 4.269 . 6.547 3.873 3.451 4.385 . 0 0 "[ . 1 . 2]" 1 531 2 43 LYS HB3 2 44 LYS H 4.269 . 6.547 3.871 3.454 4.385 . 0 0 "[ . 1 . 2]" 1 532 1 40 ARG H 1 40 ARG HB2 3.569 . 5.162 2.434 2.153 2.644 . 0 0 "[ . 1 . 2]" 1 533 2 40 ARG H 2 40 ARG HB2 3.569 . 5.162 2.433 2.153 2.640 . 0 0 "[ . 1 . 2]" 1 534 1 37 ASN H 1 48 GLU HB3 5.747 . 9.875 5.298 5.005 5.618 . 0 0 "[ . 1 . 2]" 1 535 2 37 ASN H 2 48 GLU HB3 5.747 . 9.875 5.298 5.010 5.617 . 0 0 "[ . 1 . 2]" 1 536 1 37 ASN QB 1 48 GLU HB3 5.488 . 9.252 4.833 4.356 6.590 . 0 0 "[ . 1 . 2]" 1 537 2 37 ASN QB 2 48 GLU HB3 5.488 . 9.252 4.833 4.353 6.588 . 0 0 "[ . 1 . 2]" 1 538 1 16 VAL HB 1 16 VAL QG 1.580 . 1.892 1.893 1.891 1.896 0.004 14 0 "[ . 1 . 2]" 1 539 2 16 VAL HB 2 16 VAL QG 1.580 . 1.892 1.894 1.891 1.897 0.005 12 0 "[ . 1 . 2]" 1 540 1 43 LYS HB3 1 43 LYS QG 2.322 . 2.996 2.352 2.317 2.382 . 0 0 "[ . 1 . 2]" 1 541 2 43 LYS HB3 2 43 LYS QG 2.322 . 2.996 2.353 2.316 2.385 . 0 0 "[ . 1 . 2]" 1 542 1 50 GLU HB2 1 52 PHE HD2 4.898 . 7.896 5.712 4.936 6.997 . 0 0 "[ . 1 . 2]" 1 543 2 50 GLU HB2 2 52 PHE HD2 4.898 . 7.896 5.714 4.939 6.994 . 0 0 "[ . 1 . 2]" 1 544 1 50 GLU HB3 1 52 PHE HD2 5.167 . 8.505 4.975 4.625 5.466 . 0 0 "[ . 1 . 2]" 1 545 2 50 GLU HB3 2 52 PHE HD2 5.167 . 8.505 4.976 4.633 5.469 . 0 0 "[ . 1 . 2]" 1 546 1 20 VAL HB 1 22 LYS H 4.795 . 7.669 4.907 4.767 5.114 . 0 0 "[ . 1 . 2]" 1 547 2 20 VAL HB 2 22 LYS H 4.795 . 7.669 4.907 4.767 5.112 . 0 0 "[ . 1 . 2]" 1 548 1 22 LYS HA 1 25 GLU HB3 4.740 . 7.548 4.041 3.796 4.617 . 0 0 "[ . 1 . 2]" 1 549 2 22 LYS HA 2 25 GLU HB3 4.740 . 7.548 4.042 3.801 4.616 . 0 0 "[ . 1 . 2]" 1 550 1 25 GLU HB2 1 37 ASN HA 5.817 . 10.047 5.314 4.943 5.510 . 0 0 "[ . 1 . 2]" 1 551 2 25 GLU HB2 2 37 ASN HA 5.817 . 10.047 5.314 4.946 5.510 . 0 0 "[ . 1 . 2]" 1 552 1 25 GLU HB3 1 37 ASN HA 5.029 . 8.190 4.140 3.719 4.446 . 0 0 "[ . 1 . 2]" 1 553 2 25 GLU HB3 2 37 ASN HA 5.029 . 8.190 4.141 3.722 4.448 . 0 0 "[ . 1 . 2]" 1 554 1 22 LYS HA 1 25 GLU HB2 3.064 . 4.238 2.487 2.217 3.175 . 0 0 "[ . 1 . 2]" 1 555 2 22 LYS HA 2 25 GLU HB2 3.064 . 4.238 2.488 2.222 3.174 . 0 0 "[ . 1 . 2]" 1 556 1 22 LYS QE 1 25 GLU HB3 5.603 . 9.527 5.280 4.288 6.911 . 0 0 "[ . 1 . 2]" 1 557 2 22 LYS QE 2 25 GLU HB3 5.603 . 9.527 5.280 4.290 6.914 . 0 0 "[ . 1 . 2]" 1 558 1 25 GLU HB2 1 29 GLN HE22 5.611 . 9.546 5.654 5.434 5.913 . 0 0 "[ . 1 . 2]" 1 559 2 25 GLU HB2 2 29 GLN HE22 5.611 . 9.546 5.655 5.432 5.912 . 0 0 "[ . 1 . 2]" 1 560 1 60 ILE H 1 60 ILE HG12 4.766 . 7.605 3.692 2.119 3.937 . 0 0 "[ . 1 . 2]" 1 561 2 60 ILE H 2 60 ILE HG12 4.766 . 7.605 3.694 2.123 3.940 . 0 0 "[ . 1 . 2]" 1 562 1 59 ARG HE 1 60 ILE HG12 4.826 . 7.737 4.565 3.938 6.027 . 0 0 "[ . 1 . 2]" 1 563 2 59 ARG HE 2 60 ILE HG12 4.826 . 7.737 4.566 3.936 6.032 . 0 0 "[ . 1 . 2]" 1 564 1 60 ILE HA 1 60 ILE HG12 3.562 . 5.148 2.660 2.569 3.235 . 0 0 "[ . 1 . 2]" 1 565 2 60 ILE HA 2 60 ILE HG12 3.562 . 5.148 2.660 2.569 3.236 . 0 0 "[ . 1 . 2]" 1 566 1 49 ILE HG12 1 60 ILE HG12 4.598 . 7.241 6.412 5.919 7.471 0.230 4 0 "[ . 1 . 2]" 1 567 2 49 ILE HG12 2 60 ILE HG12 4.598 . 7.241 6.412 5.923 7.472 0.231 4 0 "[ . 1 . 2]" 1 568 1 34 THR HB 1 50 GLU HB2 6.039 . 10.598 5.899 5.274 6.840 . 0 0 "[ . 1 . 2]" 1 569 2 34 THR HB 2 50 GLU HB2 6.039 . 10.598 5.898 5.270 6.829 . 0 0 "[ . 1 . 2]" 1 570 1 67 ARG HA 1 67 ARG QB 3.114 . 4.326 2.173 2.153 2.313 . 0 0 "[ . 1 . 2]" 1 571 2 67 ARG HA 2 67 ARG QB 3.114 . 4.326 2.173 2.154 2.313 . 0 0 "[ . 1 . 2]" 1 572 1 68 GLU HA 1 68 GLU QB 2.922 . 3.989 2.368 2.170 2.420 . 0 0 "[ . 1 . 2]" 1 573 2 68 GLU HA 2 68 GLU QB 2.922 . 3.989 2.369 2.170 2.420 . 0 0 "[ . 1 . 2]" 1 574 1 46 LYS HD3 1 47 ILE H 6.069 . 10.672 5.898 5.138 6.183 . 0 0 "[ . 1 . 2]" 1 575 2 46 LYS HD3 2 47 ILE H 6.069 . 10.672 5.899 5.134 6.186 . 0 0 "[ . 1 . 2]" 1 576 1 46 LYS HD3 1 46 LYS QG 2.541 . 3.348 2.338 2.288 2.412 . 0 0 "[ . 1 . 2]" 1 577 2 46 LYS HD3 2 46 LYS QG 2.541 . 3.348 2.338 2.290 2.412 . 0 0 "[ . 1 . 2]" 1 578 1 46 LYS H 1 46 LYS HD3 6.022 . 10.555 5.095 4.974 5.295 . 0 0 "[ . 1 . 2]" 1 579 2 46 LYS H 2 46 LYS HD3 6.022 . 10.555 5.095 4.977 5.297 . 0 0 "[ . 1 . 2]" 1 580 1 37 ASN H 1 39 LYS HD2 6.463 . 11.684 7.972 7.063 8.504 . 0 0 "[ . 1 . 2]" 1 581 2 37 ASN H 2 39 LYS HD2 6.463 . 11.684 7.972 7.062 8.504 . 0 0 "[ . 1 . 2]" 1 582 1 44 LYS HD3 2 52 PHE HD2 4.256 . 6.520 4.291 2.318 6.675 0.155 3 0 "[ . 1 . 2]" 1 583 1 52 PHE HD2 2 44 LYS HD3 4.256 . 6.520 4.297 2.359 6.695 0.175 3 0 "[ . 1 . 2]" 1 584 1 24 ARG HB3 1 25 GLU H 4.974 . 8.066 3.717 3.509 3.870 . 0 0 "[ . 1 . 2]" 1 585 2 24 ARG HB3 2 25 GLU H 4.974 . 8.066 3.718 3.511 3.872 . 0 0 "[ . 1 . 2]" 1 586 1 62 GLU H 1 62 GLU QB 2.478 . 3.215 2.284 2.150 2.474 . 0 0 "[ . 1 . 2]" 1 587 2 62 GLU H 2 62 GLU QB 2.478 . 3.215 2.283 2.148 2.469 . 0 0 "[ . 1 . 2]" 1 588 1 62 GLU QB 1 63 LEU H 2.875 . 3.908 2.616 2.443 2.722 . 0 0 "[ . 1 . 2]" 1 589 2 62 GLU QB 2 63 LEU H 2.875 . 3.908 2.616 2.438 2.723 . 0 0 "[ . 1 . 2]" 1 590 1 62 GLU HA 1 62 GLU QB 2.617 . 3.473 2.401 2.368 2.487 . 0 0 "[ . 1 . 2]" 1 591 2 62 GLU HA 2 62 GLU QB 2.617 . 3.473 2.401 2.366 2.488 . 0 0 "[ . 1 . 2]" 1 592 1 37 ASN QB 1 39 LYS HD3 5.035 . 8.204 4.133 3.193 5.688 . 0 0 "[ . 1 . 2]" 1 593 2 37 ASN QB 2 39 LYS HD3 5.035 . 8.204 4.132 3.198 5.696 . 0 0 "[ . 1 . 2]" 1 594 1 37 ASN QB 1 39 LYS HD2 5.684 . 9.723 4.824 4.337 5.866 . 0 0 "[ . 1 . 2]" 1 595 2 37 ASN QB 2 39 LYS HD2 5.684 . 9.723 4.824 4.341 5.863 . 0 0 "[ . 1 . 2]" 1 596 1 38 ILE H 1 47 ILE HG12 6.695 . 12.298 6.380 6.033 6.739 . 0 0 "[ . 1 . 2]" 1 597 2 38 ILE H 2 47 ILE HG12 6.695 . 12.298 6.382 6.033 6.739 . 0 0 "[ . 1 . 2]" 1 598 1 39 LYS H 1 47 ILE HG12 6.639 . 12.149 6.078 5.620 6.420 . 0 0 "[ . 1 . 2]" 1 599 2 39 LYS H 2 47 ILE HG12 6.639 . 12.149 6.079 5.622 6.423 . 0 0 "[ . 1 . 2]" 1 600 1 47 ILE HG12 2 57 LEU QD 3.191 . 4.464 3.295 2.592 3.699 . 0 0 "[ . 1 . 2]" 1 601 1 57 LEU QD 2 47 ILE HG12 3.191 . 4.464 3.295 2.597 3.698 . 0 0 "[ . 1 . 2]" 1 602 1 47 ILE HG12 2 61 LEU HG 2.501 . 3.283 3.307 2.482 3.995 0.712 10 3 "[- * . + . 2]" 1 603 1 61 LEU HG 2 47 ILE HG12 2.501 . 3.283 3.315 2.495 3.966 0.683 10 3 "[- * . + . 2]" 1 604 1 29 GLN HB3 1 35 THR H 4.060 . 6.120 5.561 5.424 5.813 . 0 0 "[ . 1 . 2]" 1 605 2 29 GLN HB3 2 35 THR H 4.060 . 6.120 5.562 5.427 5.811 . 0 0 "[ . 1 . 2]" 1 606 1 29 GLN HB2 1 29 GLN HE22 5.187 . 8.550 4.470 4.081 4.657 . 0 0 "[ . 1 . 2]" 1 607 2 29 GLN HB2 2 29 GLN HE22 5.187 . 8.550 4.471 4.082 4.662 . 0 0 "[ . 1 . 2]" 1 608 1 47 ILE HG13 2 51 PHE QE 3.775 . 5.556 2.424 2.201 3.296 . 0 0 "[ . 1 . 2]" 1 609 1 51 PHE HE2 2 47 ILE HG13 3.775 . 5.556 5.215 2.331 6.221 0.665 17 9 "[*- . ** * *.*+ *2]" 1 610 1 47 ILE H 1 47 ILE HG13 3.524 . 5.077 3.022 2.819 3.466 . 0 0 "[ . 1 . 2]" 1 611 2 47 ILE H 2 47 ILE HG13 3.524 . 5.077 3.022 2.817 3.465 . 0 0 "[ . 1 . 2]" 1 612 1 49 ILE H 1 49 ILE HG13 4.883 . 7.863 3.779 3.728 3.846 . 0 0 "[ . 1 . 2]" 1 613 2 49 ILE H 2 49 ILE HG13 4.883 . 7.863 3.779 3.728 3.846 . 0 0 "[ . 1 . 2]" 1 614 1 29 GLN HB3 1 35 THR HA 3.768 . 5.543 3.653 3.410 3.979 . 0 0 "[ . 1 . 2]" 1 615 2 29 GLN HB3 2 35 THR HA 3.768 . 5.543 3.654 3.415 3.979 . 0 0 "[ . 1 . 2]" 1 616 1 29 GLN HB2 1 30 ASN HB3 4.537 . 7.110 5.717 5.615 5.942 . 0 0 "[ . 1 . 2]" 1 617 2 29 GLN HB2 2 30 ASN HB3 4.537 . 7.110 5.716 5.612 5.942 . 0 0 "[ . 1 . 2]" 1 618 1 40 ARG QG 1 42 LYS H 5.096 . 8.342 5.816 4.600 7.877 . 0 0 "[ . 1 . 2]" 1 619 2 40 ARG QG 2 42 LYS H 5.096 . 8.342 5.816 4.595 7.875 . 0 0 "[ . 1 . 2]" 1 620 1 40 ARG QG 2 51 PHE QE 4.598 . 7.241 4.428 3.562 4.862 . 0 0 "[ . 1 . 2]" 1 621 1 51 PHE HE2 2 40 ARG QG 4.598 . 7.241 4.824 3.972 5.788 . 0 0 "[ . 1 . 2]" 1 622 1 59 ARG HG2 1 60 ILE HA 6.859 . 12.739 4.399 3.612 5.879 . 0 0 "[ . 1 . 2]" 1 623 2 59 ARG HG2 2 60 ILE HA 6.859 . 12.739 4.398 3.614 5.876 . 0 0 "[ . 1 . 2]" 1 624 1 17 LYS HA 1 40 ARG HG3 4.916 . 7.936 6.611 5.976 7.526 . 0 0 "[ . 1 . 2]" 1 625 2 17 LYS HA 2 40 ARG HG3 4.916 . 7.936 6.611 5.974 7.521 . 0 0 "[ . 1 . 2]" 1 626 1 59 ARG HG2 1 60 ILE H 6.495 . 11.768 4.113 2.708 4.472 . 0 0 "[ . 1 . 2]" 1 627 2 59 ARG HG2 2 60 ILE H 6.495 . 11.768 4.112 2.706 4.468 . 0 0 "[ . 1 . 2]" 1 628 1 38 ILE HG13 2 51 PHE HZ 4.783 . 7.643 6.249 5.852 7.453 . 0 0 "[ . 1 . 2]" 1 629 1 51 PHE HZ 2 38 ILE HG13 4.783 . 7.643 6.246 5.865 7.428 . 0 0 "[ . 1 . 2]" 1 630 1 59 ARG H 1 59 ARG HG2 5.266 . 8.732 4.169 2.359 4.479 . 0 0 "[ . 1 . 2]" 1 631 2 59 ARG H 2 59 ARG HG2 5.266 . 8.732 4.169 2.358 4.477 . 0 0 "[ . 1 . 2]" 1 632 1 61 LEU HG 2 32 PHE HE2 6.221 . 11.059 7.361 6.505 8.365 . 0 0 "[ . 1 . 2]" 1 633 1 32 PHE HE2 2 61 LEU HG 6.221 . 11.059 7.363 6.516 8.369 . 0 0 "[ . 1 . 2]" 1 634 1 28 LEU H 1 29 GLN HB2 5.571 . 9.450 4.883 4.826 4.935 . 0 0 "[ . 1 . 2]" 1 635 2 28 LEU H 2 29 GLN HB2 5.571 . 9.450 4.883 4.822 4.929 . 0 0 "[ . 1 . 2]" 1 636 1 28 LEU H 1 29 GLN HB3 7.132 . 13.491 6.268 6.203 6.302 . 0 0 "[ . 1 . 2]" 1 637 2 28 LEU H 2 29 GLN HB3 7.132 . 13.491 6.267 6.199 6.297 . 0 0 "[ . 1 . 2]" 1 638 1 29 GLN HB3 1 31 TYR H 6.521 . 11.836 5.459 5.264 5.722 . 0 0 "[ . 1 . 2]" 1 639 2 29 GLN HB3 2 31 TYR H 6.521 . 11.836 5.458 5.262 5.714 . 0 0 "[ . 1 . 2]" 1 640 1 61 LEU HA 1 64 LEU HG 4.381 . 6.780 3.501 3.167 3.747 . 0 0 "[ . 1 . 2]" 1 641 2 61 LEU HA 2 64 LEU HG 4.381 . 6.780 3.501 3.168 3.748 . 0 0 "[ . 1 . 2]" 1 642 1 27 TYR HD2 1 28 LEU HG 5.049 . 8.236 3.816 3.513 4.289 . 0 0 "[ . 1 . 2]" 1 643 2 27 TYR HD2 2 28 LEU HG 5.049 . 8.236 3.816 3.515 4.290 . 0 0 "[ . 1 . 2]" 1 644 1 28 LEU MD1 1 29 GLN H 5.066 . 8.273 4.520 4.421 4.624 . 0 0 "[ . 1 . 2]" 1 645 2 28 LEU MD1 2 29 GLN H 5.066 . 8.273 4.521 4.429 4.624 . 0 0 "[ . 1 . 2]" 1 646 1 28 LEU H 1 28 LEU MD1 4.249 . 5.480 3.714 3.639 3.769 . 0 0 "[ . 1 . 2]" 1 647 2 28 LEU H 2 28 LEU MD1 4.249 . 5.480 3.715 3.638 3.770 . 0 0 "[ . 1 . 2]" 1 648 1 64 LEU MD1 2 32 PHE HE2 3.321 . 4.700 3.437 2.876 3.848 . 0 0 "[ . 1 . 2]" 1 649 1 32 PHE HE2 2 64 LEU MD1 3.321 . 4.700 3.439 2.902 3.837 . 0 0 "[ . 1 . 2]" 1 650 1 64 LEU HA 1 64 LEU MD1 4.013 . 6.026 3.854 3.819 3.890 . 0 0 "[ . 1 . 2]" 1 651 2 64 LEU HA 2 64 LEU MD1 4.013 . 6.026 3.855 3.821 3.888 . 0 0 "[ . 1 . 2]" 1 652 1 25 GLU HA 1 28 LEU MD1 3.338 . 4.731 2.549 2.320 2.764 . 0 0 "[ . 1 . 2]" 1 653 2 25 GLU HA 2 28 LEU MD1 3.338 . 4.731 2.549 2.319 2.767 . 0 0 "[ . 1 . 2]" 1 654 1 64 LEU MD1 2 25 GLU HA 4.270 . 6.549 5.577 5.281 6.032 . 0 0 "[ . 1 . 2]" 1 655 1 25 GLU HA 2 64 LEU MD1 4.270 . 6.549 5.576 5.285 6.030 . 0 0 "[ . 1 . 2]" 1 656 1 60 ILE HA 1 63 LEU QD 2.765 . 3.721 2.441 2.063 2.756 . 0 0 "[ . 1 . 2]" 1 657 2 60 ILE HA 2 63 LEU QD 2.765 . 3.721 2.441 2.059 2.754 . 0 0 "[ . 1 . 2]" 1 658 1 64 LEU MD1 1 64 LEU HG 1.791 . 2.192 2.125 2.122 2.127 . 0 0 "[ . 1 . 2]" 1 659 2 64 LEU MD1 2 64 LEU HG 1.791 . 2.192 2.125 2.123 2.127 . 0 0 "[ . 1 . 2]" 1 660 1 62 GLU H 1 63 LEU QD 4.292 . 6.595 3.747 3.524 3.971 . 0 0 "[ . 1 . 2]" 1 661 2 62 GLU H 2 63 LEU QD 4.292 . 6.595 3.748 3.525 3.972 . 0 0 "[ . 1 . 2]" 1 662 1 64 LEU MD1 2 49 ILE MD 1.687 . 2.043 1.949 1.849 2.309 0.266 16 0 "[ . 1 . 2]" 1 663 1 49 ILE MD 2 64 LEU MD1 1.687 . 2.043 1.944 1.858 2.294 0.251 16 0 "[ . 1 . 2]" 1 664 1 57 LEU HA 1 57 LEU HG 4.239 . 6.485 3.231 3.017 3.362 . 0 0 "[ . 1 . 2]" 1 665 2 57 LEU HA 2 57 LEU HG 4.239 . 6.485 3.231 3.018 3.360 . 0 0 "[ . 1 . 2]" 1 666 1 31 TYR HE2 1 63 LEU QD 4.117 . 5.118 1.988 1.834 2.488 0.164 12 0 "[ . 1 . 2]" 1 667 2 31 TYR HE2 2 63 LEU QD 4.117 . 5.118 1.988 1.832 2.489 0.166 12 0 "[ . 1 . 2]" 1 668 1 31 TYR HD2 1 63 LEU QD 4.325 . 5.748 2.599 1.900 3.701 0.098 11 0 "[ . 1 . 2]" 1 669 2 31 TYR HD2 2 63 LEU QD 4.325 . 5.748 2.600 1.903 3.701 0.095 11 0 "[ . 1 . 2]" 1 670 1 61 LEU H 1 61 LEU MD2 3.607 . 5.233 3.814 3.619 3.909 . 0 0 "[ . 1 . 2]" 1 671 2 61 LEU H 2 61 LEU MD2 3.607 . 5.233 3.814 3.618 3.912 . 0 0 "[ . 1 . 2]" 1 672 1 42 LYS HA 1 42 LYS QG 3.559 . 5.142 2.676 2.411 2.993 . 0 0 "[ . 1 . 2]" 1 673 2 42 LYS HA 2 42 LYS QG 3.559 . 5.142 2.677 2.410 2.989 . 0 0 "[ . 1 . 2]" 1 674 1 21 LEU HA 1 21 LEU HG 3.342 . 4.738 3.698 3.646 3.725 . 0 0 "[ . 1 . 2]" 1 675 2 21 LEU HA 2 21 LEU HG 3.342 . 4.738 3.698 3.644 3.724 . 0 0 "[ . 1 . 2]" 1 676 1 43 LYS HA 1 43 LYS HG3 2.520 . 3.314 3.064 2.863 3.190 . 0 0 "[ . 1 . 2]" 1 677 2 43 LYS HA 2 43 LYS HG3 2.520 . 3.314 3.064 2.862 3.190 . 0 0 "[ . 1 . 2]" 1 678 1 43 LYS H 1 43 LYS HG3 3.895 . 5.791 3.143 3.017 3.345 . 0 0 "[ . 1 . 2]" 1 679 2 43 LYS H 2 43 LYS HG3 3.895 . 5.791 3.141 3.011 3.354 . 0 0 "[ . 1 . 2]" 1 680 1 57 LEU QD 1 61 LEU MD2 1.693 . 6.000 2.422 2.053 2.865 . 0 0 "[ . 1 . 2]" 1 681 2 57 LEU QD 2 61 LEU MD2 1.693 . 6.000 2.422 2.052 2.866 . 0 0 "[ . 1 . 2]" 1 682 1 57 LEU QD 2 21 LEU HA 4.870 . 7.834 3.895 3.410 4.436 . 0 0 "[ . 1 . 2]" 1 683 1 21 LEU HA 2 57 LEU QD 4.870 . 7.834 3.897 3.383 4.408 . 0 0 "[ . 1 . 2]" 1 684 1 57 LEU QD 1 58 ASP H 4.773 . 6.038 3.580 3.390 3.904 . 0 0 "[ . 1 . 2]" 1 685 2 57 LEU QD 2 58 ASP H 4.773 . 6.038 3.580 3.392 3.904 . 0 0 "[ . 1 . 2]" 1 686 1 22 LYS H 1 22 LYS QG 3.967 . 5.298 4.015 3.927 4.073 . 0 0 "[ . 1 . 2]" 1 687 2 22 LYS H 2 22 LYS QG 3.967 . 5.298 4.015 3.931 4.069 . 0 0 "[ . 1 . 2]" 1 688 1 22 LYS QG 1 23 GLU HA 2.912 . 3.972 3.684 3.231 4.196 0.224 4 0 "[ . 1 . 2]" 1 689 2 22 LYS QG 2 23 GLU HA 2.912 . 3.972 3.684 3.231 4.197 0.225 4 0 "[ . 1 . 2]" 1 690 1 58 ASP HB2 1 61 LEU MD2 5.833 . 10.086 5.388 4.817 6.616 . 0 0 "[ . 1 . 2]" 1 691 2 58 ASP HB2 2 61 LEU MD2 5.833 . 10.086 5.386 4.817 6.605 . 0 0 "[ . 1 . 2]" 1 692 1 21 LEU QD 1 40 ARG QD . . 3.204 2.318 2.008 2.979 . 0 0 "[ . 1 . 2]" 1 693 2 21 LEU QD 2 40 ARG QD . . 3.204 2.319 2.010 2.980 . 0 0 "[ . 1 . 2]" 1 694 1 51 PHE HZ 1 57 LEU QD 3.002 . 6.000 2.521 2.265 2.780 . 0 0 "[ . 1 . 2]" 1 695 2 51 PHE HZ 2 57 LEU QD 3.002 . 6.000 2.521 2.260 2.779 . 0 0 "[ . 1 . 2]" 1 696 1 63 LEU QD 1 63 LEU HG 1.772 . 6.000 1.886 1.882 1.889 . 0 0 "[ . 1 . 2]" 1 697 2 63 LEU QD 2 63 LEU HG 1.772 . 6.000 1.886 1.883 1.889 . 0 0 "[ . 1 . 2]" 1 698 1 21 LEU QD 1 22 LYS H 4.831 . 5.691 3.643 3.511 3.753 . 0 0 "[ . 1 . 2]" 1 699 2 21 LEU QD 2 22 LYS H 4.831 . 5.691 3.643 3.508 3.755 . 0 0 "[ . 1 . 2]" 1 700 1 46 LYS HG3 1 47 ILE H 5.148 . 8.461 4.183 4.016 4.351 . 0 0 "[ . 1 . 2]" 1 701 2 46 LYS HG3 2 47 ILE H 5.148 . 8.461 4.183 4.010 4.351 . 0 0 "[ . 1 . 2]" 1 702 1 46 LYS H 1 46 LYS HG3 3.274 . 4.614 3.375 3.083 3.550 . 0 0 "[ . 1 . 2]" 1 703 2 46 LYS H 2 46 LYS HG3 3.274 . 4.614 3.375 3.082 3.551 . 0 0 "[ . 1 . 2]" 1 704 1 46 LYS HA 1 46 LYS HG3 4.550 . 7.138 3.754 3.691 3.795 . 0 0 "[ . 1 . 2]" 1 705 2 46 LYS HA 2 46 LYS HG3 4.550 . 7.138 3.755 3.693 3.795 . 0 0 "[ . 1 . 2]" 1 706 1 46 LYS QE 1 46 LYS HG3 2.625 . 3.487 2.443 2.321 3.360 . 0 0 "[ . 1 . 2]" 1 707 2 46 LYS QE 2 46 LYS HG3 2.625 . 3.487 2.443 2.322 3.359 . 0 0 "[ . 1 . 2]" 1 708 1 46 LYS HG3 2 51 PHE H 6.182 . 10.959 6.441 6.102 6.959 . 0 0 "[ . 1 . 2]" 1 709 1 51 PHE H 2 46 LYS HG3 6.182 . 10.959 6.444 6.116 6.974 . 0 0 "[ . 1 . 2]" 1 710 1 39 LYS HG2 1 40 ARG H 5.825 . 10.066 5.023 4.345 5.259 . 0 0 "[ . 1 . 2]" 1 711 2 39 LYS HG2 2 40 ARG H 5.825 . 10.066 5.023 4.358 5.264 . 0 0 "[ . 1 . 2]" 1 712 1 39 LYS HG2 1 46 LYS H 5.262 . 8.724 4.707 3.984 6.159 . 0 0 "[ . 1 . 2]" 1 713 2 39 LYS HG2 2 46 LYS H 5.262 . 8.724 4.707 3.986 6.156 . 0 0 "[ . 1 . 2]" 1 714 1 37 ASN HD21 1 39 LYS HG2 5.527 . 9.345 6.467 5.939 7.280 . 0 0 "[ . 1 . 2]" 1 715 2 37 ASN HD21 2 39 LYS HG2 5.527 . 9.345 6.467 5.931 7.273 . 0 0 "[ . 1 . 2]" 1 716 1 38 ILE H 1 39 LYS HG2 4.807 . 7.696 5.312 5.036 5.807 . 0 0 "[ . 1 . 2]" 1 717 2 38 ILE H 2 39 LYS HG2 4.807 . 7.696 5.312 5.035 5.808 . 0 0 "[ . 1 . 2]" 1 718 1 39 LYS QE 1 39 LYS HG2 2.221 . 2.838 2.422 2.308 2.953 0.115 18 0 "[ . 1 . 2]" 1 719 2 39 LYS QE 2 39 LYS HG2 2.221 . 2.838 2.421 2.308 2.950 0.112 18 0 "[ . 1 . 2]" 1 720 1 37 ASN QB 1 39 LYS HG2 3.382 . 4.812 4.004 3.572 5.315 0.503 7 1 "[ . + 1 . 2]" 1 721 2 37 ASN QB 2 39 LYS HG2 3.382 . 4.812 4.006 3.571 5.319 0.507 7 1 "[ . + 1 . 2]" 1 722 1 39 LYS HG2 1 48 GLU QG 3.265 . 4.597 3.728 2.999 5.200 0.603 6 3 "[ .+ 1- * 2]" 1 723 2 39 LYS HG2 2 48 GLU QG 3.265 . 4.597 3.729 2.996 5.198 0.601 6 3 "[ .+ 1- * 2]" 1 724 1 21 LEU HA 1 21 LEU QD 2.062 . 2.594 1.948 1.896 2.011 0.023 7 0 "[ . 1 . 2]" 1 725 2 21 LEU HA 2 21 LEU QD 2.062 . 2.594 1.948 1.896 2.011 0.023 7 0 "[ . 1 . 2]" 1 726 1 21 LEU QD 1 24 ARG H 5.447 . 9.155 4.519 4.318 4.740 . 0 0 "[ . 1 . 2]" 1 727 2 21 LEU QD 2 24 ARG H 5.447 . 9.155 4.518 4.320 4.741 . 0 0 "[ . 1 . 2]" 1 728 1 64 LEU MD2 2 32 PHE HE2 2.632 . 3.498 2.828 2.119 3.328 . 0 0 "[ . 1 . 2]" 1 729 1 32 PHE HE2 2 64 LEU MD2 2.632 . 3.498 2.825 2.122 3.336 . 0 0 "[ . 1 . 2]" 1 730 1 28 LEU MD2 1 32 PHE HE2 3.174 . 6.000 4.047 2.812 5.310 . 0 0 "[ . 1 . 2]" 1 731 2 28 LEU MD2 2 32 PHE HE2 3.174 . 6.000 4.047 2.814 5.309 . 0 0 "[ . 1 . 2]" 1 732 1 28 LEU MD2 1 29 GLN H 5.537 . 9.369 4.579 4.494 4.651 . 0 0 "[ . 1 . 2]" 1 733 2 28 LEU MD2 2 29 GLN H 5.537 . 9.369 4.579 4.498 4.649 . 0 0 "[ . 1 . 2]" 1 734 1 28 LEU H 1 28 LEU MD2 3.443 . 4.714 3.064 2.874 3.205 . 0 0 "[ . 1 . 2]" 1 735 2 28 LEU H 2 28 LEU MD2 3.443 . 4.714 3.064 2.875 3.203 . 0 0 "[ . 1 . 2]" 1 736 1 24 ARG H 1 28 LEU MD2 4.867 . 7.827 6.393 6.078 6.751 . 0 0 "[ . 1 . 2]" 1 737 2 24 ARG H 2 28 LEU MD2 4.867 . 7.827 6.392 6.079 6.748 . 0 0 "[ . 1 . 2]" 1 738 1 27 TYR HD2 1 28 LEU MD2 3.224 . 4.523 2.542 2.421 2.771 . 0 0 "[ . 1 . 2]" 1 739 2 27 TYR HD2 2 28 LEU MD2 3.224 . 4.523 2.541 2.418 2.771 . 0 0 "[ . 1 . 2]" 1 740 1 27 TYR HE2 1 28 LEU MD2 3.423 . 4.888 3.574 3.293 4.041 . 0 0 "[ . 1 . 2]" 1 741 2 27 TYR HE2 2 28 LEU MD2 3.423 . 4.888 3.574 3.290 4.044 . 0 0 "[ . 1 . 2]" 1 742 1 64 LEU MD2 2 31 TYR HD2 4.178 . 6.360 5.334 5.042 5.631 . 0 0 "[ . 1 . 2]" 1 743 1 31 TYR HD2 2 64 LEU MD2 4.178 . 6.360 5.338 5.072 5.645 . 0 0 "[ . 1 . 2]" 1 744 1 28 LEU MD2 1 31 TYR HD2 4.349 . 6.713 4.535 3.683 5.215 . 0 0 "[ . 1 . 2]" 1 745 2 28 LEU MD2 2 31 TYR HD2 4.349 . 6.713 4.535 3.682 5.214 . 0 0 "[ . 1 . 2]" 1 746 1 44 LYS QE 1 44 LYS QG 3.067 . 4.243 2.308 2.128 2.396 . 0 0 "[ . 1 . 2]" 1 747 2 44 LYS QE 2 44 LYS QG 3.067 . 4.243 2.307 2.132 2.393 . 0 0 "[ . 1 . 2]" 1 748 1 44 LYS QD 1 44 LYS QG 2.242 . 2.870 2.090 2.079 2.093 . 0 0 "[ . 1 . 2]" 1 749 2 44 LYS QD 2 44 LYS QG 2.242 . 2.870 2.090 2.078 2.092 . 0 0 "[ . 1 . 2]" 1 750 1 28 LEU MD2 2 65 SER HA 2.874 . 3.907 2.880 2.588 3.674 . 0 0 "[ . 1 . 2]" 1 751 1 65 SER HA 2 28 LEU MD2 2.874 . 3.907 2.886 2.595 3.655 . 0 0 "[ . 1 . 2]" 1 752 1 28 LEU HA 1 28 LEU MD2 2.388 . 3.101 2.049 2.017 2.086 . 0 0 "[ . 1 . 2]" 1 753 2 28 LEU HA 2 28 LEU MD2 2.388 . 3.101 2.049 2.020 2.091 . 0 0 "[ . 1 . 2]" 1 754 1 61 LEU MD1 1 62 GLU H 3.906 . 5.813 4.154 4.059 4.245 . 0 0 "[ . 1 . 2]" 1 755 2 61 LEU MD1 2 62 GLU H 3.906 . 5.813 4.154 4.059 4.246 . 0 0 "[ . 1 . 2]" 1 756 1 58 ASP HA 1 61 LEU MD1 3.644 . 5.304 3.812 3.480 4.046 . 0 0 "[ . 1 . 2]" 1 757 2 58 ASP HA 2 61 LEU MD1 3.644 . 5.304 3.811 3.475 4.043 . 0 0 "[ . 1 . 2]" 1 758 1 61 LEU H 1 61 LEU MD1 2.277 . 2.746 2.172 2.078 2.257 . 0 0 "[ . 1 . 2]" 1 759 2 61 LEU H 2 61 LEU MD1 2.277 . 2.746 2.172 2.081 2.257 . 0 0 "[ . 1 . 2]" 1 760 1 61 LEU MD1 2 24 ARG QH1 5.017 . 8.163 4.369 3.953 5.060 . 0 0 "[ . 1 . 2]" 1 761 1 24 ARG QH1 2 61 LEU MD1 5.017 . 8.163 4.374 3.952 5.067 . 0 0 "[ . 1 . 2]" 1 762 1 61 LEU HA 1 61 LEU MD1 2.265 . 6.000 2.451 2.236 2.662 . 0 0 "[ . 1 . 2]" 1 763 2 61 LEU HA 2 61 LEU MD1 2.265 . 6.000 2.451 2.235 2.663 . 0 0 "[ . 1 . 2]" 1 764 1 35 THR MG 1 37 ASN H 4.679 . 5.644 4.371 4.089 4.518 . 0 0 "[ . 1 . 2]" 1 765 2 35 THR MG 2 37 ASN H 4.679 . 5.644 4.369 4.087 4.516 . 0 0 "[ . 1 . 2]" 1 766 1 35 THR MG 1 37 ASN HD21 3.835 . 5.419 3.113 2.726 3.703 . 0 0 "[ . 1 . 2]" 1 767 2 35 THR MG 2 37 ASN HD21 3.835 . 5.419 3.112 2.735 3.684 . 0 0 "[ . 1 . 2]" 1 768 1 35 THR MG 1 36 VAL H 2.313 . 2.982 2.493 2.337 2.669 . 0 0 "[ . 1 . 2]" 1 769 2 35 THR MG 2 36 VAL H 2.313 . 2.982 2.491 2.334 2.660 . 0 0 "[ . 1 . 2]" 1 770 1 35 THR MG 1 37 ASN HD22 2.415 . 3.144 2.425 2.159 3.894 0.750 7 1 "[ . + 1 . 2]" 1 771 2 35 THR MG 2 37 ASN HD22 2.415 . 3.144 2.424 2.152 3.902 0.758 7 1 "[ . + 1 . 2]" 1 772 1 35 THR MG 1 36 VAL HA 3.904 . 5.809 3.630 3.585 3.706 . 0 0 "[ . 1 . 2]" 1 773 2 35 THR MG 2 36 VAL HA 3.904 . 5.809 3.627 3.579 3.698 . 0 0 "[ . 1 . 2]" 1 774 1 25 GLU HB3 1 35 THR MG 5.582 . 9.477 6.319 6.100 6.634 . 0 0 "[ . 1 . 2]" 1 775 2 25 GLU HB3 2 35 THR MG 5.582 . 9.477 6.319 6.102 6.634 . 0 0 "[ . 1 . 2]" 1 776 1 32 PHE HD2 1 36 VAL MG2 3.675 . 5.363 3.063 2.144 3.847 . 0 0 "[ . 1 . 2]" 1 777 2 32 PHE HD2 2 36 VAL MG2 3.675 . 5.363 3.064 2.144 3.848 . 0 0 "[ . 1 . 2]" 1 778 1 35 THR HA 1 36 VAL MG2 3.544 . 5.114 3.625 3.562 3.701 . 0 0 "[ . 1 . 2]" 1 779 2 35 THR HA 2 36 VAL MG2 3.544 . 5.114 3.625 3.559 3.699 . 0 0 "[ . 1 . 2]" 1 780 1 20 VAL HA 1 20 VAL MG2 2.147 . 2.723 2.405 2.385 2.471 . 0 0 "[ . 1 . 2]" 1 781 2 20 VAL HA 2 20 VAL MG2 2.147 . 2.723 2.406 2.386 2.470 . 0 0 "[ . 1 . 2]" 1 782 1 29 GLN HG2 1 36 VAL MG2 3.028 . 4.174 2.407 2.213 2.616 . 0 0 "[ . 1 . 2]" 1 783 2 29 GLN HG2 2 36 VAL MG2 3.028 . 4.174 2.406 2.211 2.610 . 0 0 "[ . 1 . 2]" 1 784 1 17 LYS QD 1 20 VAL MG2 2.917 . 3.980 3.054 2.616 3.738 . 0 0 "[ . 1 . 2]" 1 785 2 17 LYS QD 2 20 VAL MG2 2.917 . 3.980 3.053 2.615 3.738 . 0 0 "[ . 1 . 2]" 1 786 1 36 VAL MG2 1 49 ILE HG12 2.448 . 6.000 4.301 4.196 4.387 . 0 0 "[ . 1 . 2]" 1 787 2 36 VAL MG2 2 49 ILE HG12 2.448 . 6.000 4.301 4.194 4.387 . 0 0 "[ . 1 . 2]" 1 788 1 36 VAL MG2 1 49 ILE MD 1.706 . 6.000 1.924 1.859 2.025 . 0 0 "[ . 1 . 2]" 1 789 2 36 VAL MG2 2 49 ILE MD 1.706 . 6.000 1.924 1.859 2.026 . 0 0 "[ . 1 . 2]" 1 790 1 36 VAL MG1 1 49 ILE MD 1.712 . 6.000 1.922 1.880 1.994 . 0 0 "[ . 1 . 2]" 1 791 2 36 VAL MG1 2 49 ILE MD 1.712 . 6.000 1.922 1.882 1.994 . 0 0 "[ . 1 . 2]" 1 792 1 36 VAL HA 1 36 VAL MG1 2.592 . 3.432 2.422 2.385 2.446 . 0 0 "[ . 1 . 2]" 1 793 2 36 VAL HA 2 36 VAL MG1 2.592 . 3.432 2.423 2.389 2.446 . 0 0 "[ . 1 . 2]" 1 794 1 29 GLN HE22 1 36 VAL MG1 4.135 . 6.272 5.592 5.436 5.831 . 0 0 "[ . 1 . 2]" 1 795 2 29 GLN HE22 2 36 VAL MG1 4.135 . 6.272 5.593 5.444 5.833 . 0 0 "[ . 1 . 2]" 1 796 1 29 GLN HG2 1 36 VAL MG1 4.296 . 6.603 3.769 3.662 3.920 . 0 0 "[ . 1 . 2]" 1 797 2 29 GLN HG2 2 36 VAL MG1 4.296 . 6.603 3.770 3.661 3.920 . 0 0 "[ . 1 . 2]" 1 798 1 25 GLU HG3 1 36 VAL MG1 3.631 . 5.279 4.064 3.879 4.280 . 0 0 "[ . 1 . 2]" 1 799 2 25 GLU HG3 2 36 VAL MG1 3.631 . 5.279 4.063 3.881 4.283 . 0 0 "[ . 1 . 2]" 1 800 1 25 GLU HG2 1 36 VAL MG1 2.028 . 2.542 2.586 2.374 2.824 0.282 7 0 "[ . 1 . 2]" 1 801 2 25 GLU HG2 2 36 VAL MG1 2.028 . 2.542 2.585 2.376 2.827 0.285 7 0 "[ . 1 . 2]" 1 802 1 34 THR MG 1 60 ILE MD 1.979 . 2.468 2.113 1.952 2.439 . 0 0 "[ . 1 . 2]" 1 803 2 34 THR MG 2 60 ILE MD 1.979 . 2.468 2.113 1.951 2.437 . 0 0 "[ . 1 . 2]" 1 804 1 34 THR MG 1 49 ILE MG 1.361 . 6.000 2.131 1.983 2.307 . 0 0 "[ . 1 . 2]" 1 805 2 34 THR MG 2 49 ILE MG 1.361 . 6.000 2.131 1.982 2.308 . 0 0 "[ . 1 . 2]" 1 806 1 34 THR MG 1 49 ILE MD 2.478 . 6.000 3.845 3.622 4.029 . 0 0 "[ . 1 . 2]" 1 807 2 34 THR MG 2 49 ILE MD 2.478 . 6.000 3.845 3.620 4.028 . 0 0 "[ . 1 . 2]" 1 808 1 32 PHE H 1 34 THR MG 3.854 . 5.429 4.023 3.600 4.528 . 0 0 "[ . 1 . 2]" 1 809 2 32 PHE H 2 34 THR MG 3.854 . 5.429 4.024 3.605 4.530 . 0 0 "[ . 1 . 2]" 1 810 1 34 THR MG 1 50 GLU H 3.316 . 4.682 3.342 3.145 3.607 . 0 0 "[ . 1 . 2]" 1 811 2 34 THR MG 2 50 GLU H 3.316 . 4.682 3.342 3.139 3.606 . 0 0 "[ . 1 . 2]" 1 812 1 33 GLY H 1 34 THR MG 4.526 . 6.096 4.053 3.705 4.361 . 0 0 "[ . 1 . 2]" 1 813 2 33 GLY H 2 34 THR MG 4.526 . 6.096 4.051 3.692 4.362 . 0 0 "[ . 1 . 2]" 1 814 1 34 THR MG 1 59 ARG HE 3.224 . 4.524 5.026 4.089 5.960 1.436 18 9 "[** . **** * -+ 2]" 1 815 2 34 THR MG 2 59 ARG HE 3.224 . 4.524 5.026 4.089 5.963 1.439 18 9 "[** . **** * -+ 2]" 1 816 1 34 THR MG 1 36 VAL HA 4.379 . 6.776 4.225 4.144 4.336 . 0 0 "[ . 1 . 2]" 1 817 2 34 THR MG 2 36 VAL HA 4.379 . 6.776 4.225 4.141 4.334 . 0 0 "[ . 1 . 2]" 1 818 1 34 THR HA 1 34 THR MG 4.807 . 7.695 3.199 3.188 3.205 . 0 0 "[ . 1 . 2]" 1 819 2 34 THR HA 2 34 THR MG 4.807 . 7.695 3.200 3.190 3.205 . 0 0 "[ . 1 . 2]" 1 820 1 34 THR MG 1 49 ILE HA 4.110 . 6.222 3.823 3.732 3.967 . 0 0 "[ . 1 . 2]" 1 821 2 34 THR MG 2 49 ILE HA 4.110 . 6.222 3.823 3.733 3.969 . 0 0 "[ . 1 . 2]" 1 822 1 32 PHE HA 1 34 THR MG 4.826 . 7.738 4.696 4.332 5.141 . 0 0 "[ . 1 . 2]" 1 823 2 32 PHE HA 2 34 THR MG 4.826 . 7.738 4.696 4.326 5.145 . 0 0 "[ . 1 . 2]" 1 824 1 34 THR HB 1 34 THR MG 2.296 . 2.955 2.134 2.130 2.137 . 0 0 "[ . 1 . 2]" 1 825 2 34 THR HB 2 34 THR MG 2.296 . 2.955 2.134 2.130 2.137 . 0 0 "[ . 1 . 2]" 1 826 1 32 PHE HB3 1 34 THR MG 3.486 . 5.005 3.766 2.817 4.810 . 0 0 "[ . 1 . 2]" 1 827 2 32 PHE HB3 2 34 THR MG 3.486 . 5.005 3.765 2.806 4.811 . 0 0 "[ . 1 . 2]" 1 828 1 19 ALA MB 1 23 GLU QB 3.910 . 6.000 4.849 4.052 5.565 . 0 0 "[ . 1 . 2]" 1 829 2 19 ALA MB 2 23 GLU QB 3.910 . 6.000 4.847 4.051 5.565 . 0 0 "[ . 1 . 2]" 1 830 1 19 ALA MB 1 22 LYS H 3.998 . 5.996 4.393 4.307 4.526 . 0 0 "[ . 1 . 2]" 1 831 2 19 ALA MB 2 22 LYS H 3.998 . 5.996 4.393 4.305 4.531 . 0 0 "[ . 1 . 2]" 1 832 1 19 ALA MB 1 20 VAL H 2.467 . 3.228 2.740 2.638 2.859 . 0 0 "[ . 1 . 2]" 1 833 2 19 ALA MB 2 20 VAL H 2.467 . 3.228 2.740 2.635 2.858 . 0 0 "[ . 1 . 2]" 1 834 1 37 ASN H 1 47 ILE MG 3.478 . 4.703 3.543 3.339 3.782 . 0 0 "[ . 1 . 2]" 1 835 2 37 ASN H 2 47 ILE MG 3.478 . 4.703 3.544 3.340 3.784 . 0 0 "[ . 1 . 2]" 1 836 1 47 ILE H 1 47 ILE MG 3.277 . 4.619 3.845 3.831 3.867 . 0 0 "[ . 1 . 2]" 1 837 2 47 ILE H 2 47 ILE MG 3.277 . 4.619 3.845 3.832 3.871 . 0 0 "[ . 1 . 2]" 1 838 1 60 ILE MG 1 61 LEU H 3.131 . 4.356 3.230 3.102 3.408 . 0 0 "[ . 1 . 2]" 1 839 2 60 ILE MG 2 61 LEU H 3.131 . 4.356 3.230 3.098 3.411 . 0 0 "[ . 1 . 2]" 1 840 1 60 ILE H 1 60 ILE MG 3.568 . 5.159 3.752 3.729 3.788 . 0 0 "[ . 1 . 2]" 1 841 2 60 ILE H 2 60 ILE MG 3.568 . 5.159 3.752 3.727 3.789 . 0 0 "[ . 1 . 2]" 1 842 1 47 ILE HA 1 47 ILE MG 3.346 . 4.745 2.293 2.246 2.364 . 0 0 "[ . 1 . 2]" 1 843 2 47 ILE HA 2 47 ILE MG 3.346 . 4.745 2.293 2.244 2.364 . 0 0 "[ . 1 . 2]" 1 844 1 60 ILE MG 1 61 LEU HA 3.185 . 4.453 3.277 3.095 3.512 . 0 0 "[ . 1 . 2]" 1 845 2 60 ILE MG 2 61 LEU HA 3.185 . 4.453 3.277 3.092 3.514 . 0 0 "[ . 1 . 2]" 1 846 1 60 ILE HA 1 60 ILE MG 2.537 . 3.341 2.458 2.323 2.528 . 0 0 "[ . 1 . 2]" 1 847 2 60 ILE HA 2 60 ILE MG 2.537 . 3.341 2.458 2.325 2.526 . 0 0 "[ . 1 . 2]" 1 848 1 57 LEU HA 1 60 ILE MG 4.346 . 6.707 4.279 3.992 4.519 . 0 0 "[ . 1 . 2]" 1 849 2 57 LEU HA 2 60 ILE MG 4.346 . 6.707 4.279 3.992 4.522 . 0 0 "[ . 1 . 2]" 1 850 1 51 PHE HB3 1 60 ILE MG 4.248 . 6.504 4.434 3.999 4.804 . 0 0 "[ . 1 . 2]" 1 851 2 51 PHE HB3 2 60 ILE MG 4.248 . 6.504 4.434 4.000 4.806 . 0 0 "[ . 1 . 2]" 1 852 1 32 PHE HB2 1 60 ILE MG 4.595 . 7.234 4.462 3.922 5.103 . 0 0 "[ . 1 . 2]" 1 853 2 32 PHE HB2 2 60 ILE MG 4.595 . 7.234 4.463 3.919 5.103 . 0 0 "[ . 1 . 2]" 1 854 1 49 ILE HG13 1 60 ILE MG 2.121 . 2.683 2.663 2.419 2.899 0.216 2 0 "[ . 1 . 2]" 1 855 2 49 ILE HG13 2 60 ILE MG 2.121 . 2.683 2.664 2.420 2.897 0.214 2 0 "[ . 1 . 2]" 1 856 1 47 ILE HB 1 47 ILE MG 1.854 . 2.284 2.120 2.115 2.124 . 0 0 "[ . 1 . 2]" 1 857 2 47 ILE HB 2 47 ILE MG 1.854 . 2.284 2.120 2.115 2.123 . 0 0 "[ . 1 . 2]" 1 858 1 61 LEU HB3 1 64 LEU H 5.451 . 9.165 5.011 4.606 5.256 . 0 0 "[ . 1 . 2]" 1 859 2 61 LEU HB3 2 64 LEU H 5.451 . 9.165 5.010 4.603 5.255 . 0 0 "[ . 1 . 2]" 1 860 1 32 PHE HD2 1 60 ILE HB 6.271 . 11.187 5.884 5.115 6.816 . 0 0 "[ . 1 . 2]" 1 861 2 32 PHE HD2 2 60 ILE HB 6.271 . 11.187 5.884 5.116 6.814 . 0 0 "[ . 1 . 2]" 1 862 1 21 LEU HB3 2 57 LEU QD 4.264 . 6.537 3.874 2.592 4.276 . 0 0 "[ . 1 . 2]" 1 863 1 57 LEU QD 2 21 LEU HB3 4.264 . 6.537 3.876 2.603 4.271 . 0 0 "[ . 1 . 2]" 1 864 1 21 LEU HB2 2 57 LEU QD 5.355 . 8.940 4.389 2.999 4.795 . 0 0 "[ . 1 . 2]" 1 865 1 57 LEU QD 2 21 LEU HB2 5.355 . 8.940 4.391 3.011 4.814 . 0 0 "[ . 1 . 2]" 1 866 1 51 PHE HB2 1 57 LEU QD 4.829 . 7.744 4.321 3.958 4.756 . 0 0 "[ . 1 . 2]" 1 867 2 51 PHE HB2 2 57 LEU QD 4.829 . 7.744 4.321 3.959 4.754 . 0 0 "[ . 1 . 2]" 1 868 1 57 LEU QD 1 60 ILE HB 3.495 . 5.022 3.676 3.069 4.097 . 0 0 "[ . 1 . 2]" 1 869 2 57 LEU QD 2 60 ILE HB 3.495 . 5.022 3.675 3.068 4.097 . 0 0 "[ . 1 . 2]" 1 870 1 61 LEU MD2 2 24 ARG QH1 5.597 . 9.513 3.010 2.522 3.815 . 0 0 "[ . 1 . 2]" 1 871 1 24 ARG QH1 2 61 LEU MD2 5.597 . 9.513 3.015 2.506 3.794 . 0 0 "[ . 1 . 2]" 1 872 1 49 ILE HA 1 49 ILE MD 3.688 . 5.389 2.282 2.217 2.362 . 0 0 "[ . 1 . 2]" 1 873 2 49 ILE HA 2 49 ILE MD 3.688 . 5.389 2.282 2.215 2.362 . 0 0 "[ . 1 . 2]" 1 874 1 36 VAL MG1 1 38 ILE H 4.935 . 7.979 3.930 3.715 4.261 . 0 0 "[ . 1 . 2]" 1 875 2 36 VAL MG1 2 38 ILE H 4.935 . 7.979 3.930 3.709 4.259 . 0 0 "[ . 1 . 2]" 1 876 1 32 PHE HD2 1 49 ILE HB 5.891 . 10.229 5.338 5.047 5.807 . 0 0 "[ . 1 . 2]" 1 877 2 32 PHE HD2 2 49 ILE HB 5.891 . 10.229 5.338 5.045 5.806 . 0 0 "[ . 1 . 2]" 1 878 1 49 ILE HA 1 49 ILE HG12 4.613 . 7.272 3.325 3.273 3.362 . 0 0 "[ . 1 . 2]" 1 879 2 49 ILE HA 2 49 ILE HG12 4.613 . 7.272 3.325 3.275 3.363 . 0 0 "[ . 1 . 2]" 1 880 1 36 VAL HA 1 49 ILE HG12 5.460 . 9.186 5.302 5.041 5.426 . 0 0 "[ . 1 . 2]" 1 881 2 36 VAL HA 2 49 ILE HG12 5.460 . 9.186 5.303 5.042 5.429 . 0 0 "[ . 1 . 2]" 1 882 1 32 PHE HE2 1 49 ILE HG12 5.421 . 9.095 4.791 4.526 5.079 . 0 0 "[ . 1 . 2]" 1 883 2 32 PHE HE2 2 49 ILE HG12 5.421 . 9.095 4.791 4.524 5.079 . 0 0 "[ . 1 . 2]" 1 884 1 49 ILE MD 1 50 GLU H 5.299 . 6.566 4.094 3.980 4.186 . 0 0 "[ . 1 . 2]" 1 885 2 49 ILE MD 2 50 GLU H 5.299 . 6.566 4.094 3.981 4.189 . 0 0 "[ . 1 . 2]" 1 886 1 49 ILE MD 1 49 ILE HG12 2.248 . 2.880 2.114 2.112 2.116 . 0 0 "[ . 1 . 2]" 1 887 2 49 ILE MD 2 49 ILE HG12 2.248 . 2.880 2.114 2.113 2.116 . 0 0 "[ . 1 . 2]" 1 888 1 19 ALA HA 1 23 GLU HG2 5.202 . 8.585 4.961 4.119 5.990 . 0 0 "[ . 1 . 2]" 1 889 2 19 ALA HA 2 23 GLU HG2 5.202 . 8.585 4.959 4.130 5.974 . 0 0 "[ . 1 . 2]" 1 890 1 18 ASP HB3 1 19 ALA HA 4.611 . 7.269 5.298 4.493 5.758 . 0 0 "[ . 1 . 2]" 1 891 2 18 ASP HB3 2 19 ALA HA 4.611 . 7.269 5.298 4.489 5.758 . 0 0 "[ . 1 . 2]" 1 892 1 19 ALA HA 1 22 LYS QE 6.624 . 12.109 5.973 5.082 6.584 . 0 0 "[ . 1 . 2]" 1 893 2 19 ALA HA 2 22 LYS QE 6.624 . 12.109 5.973 5.091 6.588 . 0 0 "[ . 1 . 2]" 1 894 1 28 LEU HA 1 31 TYR HB2 3.491 . 5.015 3.084 2.456 3.331 . 0 0 "[ . 1 . 2]" 1 895 2 28 LEU HA 2 31 TYR HB2 3.491 . 5.015 3.085 2.457 3.335 . 0 0 "[ . 1 . 2]" 1 896 1 28 LEU HA 1 31 TYR HD2 6.370 . 11.442 4.604 3.927 5.140 . 0 0 "[ . 1 . 2]" 1 897 2 28 LEU HA 2 31 TYR HD2 6.370 . 11.442 4.603 3.923 5.145 . 0 0 "[ . 1 . 2]" 1 898 1 55 GLU HA 1 58 ASP HB3 3.706 . 5.423 3.392 2.754 4.801 . 0 0 "[ . 1 . 2]" 1 899 2 55 GLU HA 2 58 ASP HB3 3.706 . 5.423 3.395 2.756 4.805 . 0 0 "[ . 1 . 2]" 1 900 1 36 VAL HA 1 36 VAL MG2 2.636 . 3.504 2.375 2.353 2.400 . 0 0 "[ . 1 . 2]" 1 901 2 36 VAL HA 2 36 VAL MG2 2.636 . 3.504 2.375 2.354 2.402 . 0 0 "[ . 1 . 2]" 1 902 1 36 VAL HB 1 49 ILE MD 4.256 . 6.521 3.965 3.914 4.003 . 0 0 "[ . 1 . 2]" 1 903 2 36 VAL HB 2 49 ILE MD 4.256 . 6.521 3.965 3.915 4.002 . 0 0 "[ . 1 . 2]" 1 904 1 34 THR HB 1 50 GLU H 5.619 . 9.565 5.943 5.627 6.264 . 0 0 "[ . 1 . 2]" 1 905 2 34 THR HB 2 50 GLU H 5.619 . 9.565 5.942 5.623 6.258 . 0 0 "[ . 1 . 2]" 1 906 1 66 GLU HB3 2 63 LEU QD 3.113 . 4.324 2.620 2.199 2.978 . 0 0 "[ . 1 . 2]" 1 907 1 63 LEU QD 2 66 GLU HB3 3.113 . 4.324 2.617 2.195 2.976 . 0 0 "[ . 1 . 2]" 1 908 1 66 GLU HA 1 66 GLU HB2 2.644 . 3.518 2.487 2.400 2.589 . 0 0 "[ . 1 . 2]" 1 909 2 66 GLU HA 2 66 GLU HB2 2.644 . 3.518 2.488 2.401 2.590 . 0 0 "[ . 1 . 2]" 1 910 1 66 GLU HB2 2 63 LEU QD 3.360 . 4.771 2.148 1.851 2.573 0.098 6 0 "[ . 1 . 2]" 1 911 1 63 LEU QD 2 66 GLU HB2 3.360 . 4.771 2.145 1.864 2.572 0.085 6 0 "[ . 1 . 2]" 1 912 1 26 SER HB3 1 29 GLN H 5.360 . 8.951 5.832 5.697 6.028 . 0 0 "[ . 1 . 2]" 1 913 2 26 SER HB3 2 29 GLN H 5.360 . 8.951 5.832 5.692 6.033 . 0 0 "[ . 1 . 2]" 1 914 1 38 ILE HA 1 39 LYS HG2 4.159 . 6.322 4.094 3.537 5.293 . 0 0 "[ . 1 . 2]" 1 915 2 38 ILE HA 2 39 LYS HG2 4.159 . 6.322 4.094 3.534 5.286 . 0 0 "[ . 1 . 2]" 1 916 1 37 ASN HD22 1 39 LYS QE 5.672 . 8.465 5.222 3.943 5.807 . 0 0 "[ . 1 . 2]" 1 917 2 37 ASN HD22 2 39 LYS QE 5.672 . 8.465 5.223 3.938 5.823 . 0 0 "[ . 1 . 2]" 1 918 1 39 LYS H 1 46 LYS HG3 5.172 . 8.515 3.676 3.315 4.135 . 0 0 "[ . 1 . 2]" 1 919 2 39 LYS H 2 46 LYS HG3 5.172 . 8.515 3.677 3.313 4.137 . 0 0 "[ . 1 . 2]" 1 920 1 59 ARG HA 1 59 ARG HD2 4.498 . 7.027 4.260 3.891 4.828 . 0 0 "[ . 1 . 2]" 1 921 2 59 ARG HA 2 59 ARG HD2 4.498 . 7.027 4.260 3.892 4.829 . 0 0 "[ . 1 . 2]" 1 922 1 51 PHE HD2 1 59 ARG HG2 6.756 . 12.461 10.567 8.170 12.007 . 0 0 "[ . 1 . 2]" 1 923 2 51 PHE HD2 2 59 ARG HG2 6.756 . 12.461 10.565 8.170 12.007 . 0 0 "[ . 1 . 2]" 1 924 1 59 ARG HA 1 59 ARG HB2 2.709 . 3.626 2.443 2.368 2.506 . 0 0 "[ . 1 . 2]" 1 925 2 59 ARG HA 2 59 ARG HB2 2.709 . 3.626 2.442 2.364 2.502 . 0 0 "[ . 1 . 2]" 1 926 1 59 ARG HA 1 59 ARG HG3 3.131 . 4.356 3.320 2.542 3.703 . 0 0 "[ . 1 . 2]" 1 927 2 59 ARG HA 2 59 ARG HG3 3.131 . 4.356 3.319 2.541 3.703 . 0 0 "[ . 1 . 2]" 1 928 1 59 ARG HA 1 59 ARG HG2 4.297 . 6.605 2.968 2.441 4.213 . 0 0 "[ . 1 . 2]" 1 929 2 59 ARG HA 2 59 ARG HG2 4.297 . 6.605 2.968 2.441 4.213 . 0 0 "[ . 1 . 2]" 1 930 1 20 VAL HA 1 20 VAL MG1 2.191 . 2.791 2.395 2.343 2.427 . 0 0 "[ . 1 . 2]" 1 931 2 20 VAL HA 2 20 VAL MG1 2.191 . 2.791 2.396 2.341 2.424 . 0 0 "[ . 1 . 2]" 1 932 1 38 ILE MG 1 40 ARG H 4.399 . 5.107 3.807 3.376 4.243 . 0 0 "[ . 1 . 2]" 1 933 2 38 ILE MG 2 40 ARG H 4.399 . 5.107 3.807 3.366 4.233 . 0 0 "[ . 1 . 2]" 1 934 1 38 ILE MG 2 51 PHE HZ 2.170 . 2.759 2.317 2.012 3.131 0.372 4 0 "[ . 1 . 2]" 1 935 1 51 PHE HZ 2 38 ILE MG 2.170 . 2.759 2.315 2.027 3.114 0.355 4 0 "[ . 1 . 2]" 1 936 1 38 ILE MG 2 51 PHE QE 3.510 . 5.050 2.471 2.222 2.814 . 0 0 "[ . 1 . 2]" 1 937 1 51 PHE HE2 2 38 ILE MG 3.510 . 5.050 3.630 2.230 4.326 . 0 0 "[ . 1 . 2]" 1 938 1 38 ILE MG 2 51 PHE H 5.496 . 9.272 6.231 5.993 6.651 . 0 0 "[ . 1 . 2]" 1 939 1 51 PHE H 2 38 ILE MG 5.496 . 9.272 6.227 5.976 6.665 . 0 0 "[ . 1 . 2]" 1 940 1 38 ILE MD 1 48 GLU H 6.131 . 10.829 5.585 5.403 5.780 . 0 0 "[ . 1 . 2]" 1 941 2 38 ILE MD 2 48 GLU H 6.131 . 10.829 5.585 5.403 5.777 . 0 0 "[ . 1 . 2]" 1 942 1 38 ILE MD 2 51 PHE QE 4.522 . 7.078 4.192 3.934 4.639 . 0 0 "[ . 1 . 2]" 1 943 1 51 PHE HE2 2 38 ILE MD 4.522 . 7.078 5.428 3.975 6.101 . 0 0 "[ . 1 . 2]" 1 944 1 38 ILE MD 2 51 PHE HZ 3.912 . 5.825 4.361 3.895 5.438 . 0 0 "[ . 1 . 2]" 1 945 1 51 PHE HZ 2 38 ILE MD 3.912 . 5.825 4.356 3.872 5.413 . 0 0 "[ . 1 . 2]" 1 946 1 64 LEU HB3 1 64 LEU MD2 2.186 . 2.784 2.324 2.275 2.358 . 0 0 "[ . 1 . 2]" 1 947 2 64 LEU HB3 2 64 LEU MD2 2.186 . 2.784 2.324 2.277 2.357 . 0 0 "[ . 1 . 2]" 1 948 1 64 LEU HA 1 64 LEU HG 4.024 . 6.048 2.961 2.737 3.068 . 0 0 "[ . 1 . 2]" 1 949 2 64 LEU HA 2 64 LEU HG 4.024 . 6.048 2.961 2.741 3.067 . 0 0 "[ . 1 . 2]" 1 950 1 34 THR MG 1 59 ARG HD3 5.797 . 9.997 5.967 5.202 7.219 . 0 0 "[ . 1 . 2]" 1 951 2 34 THR MG 2 59 ARG HD3 5.797 . 9.997 5.967 5.204 7.214 . 0 0 "[ . 1 . 2]" 1 952 1 63 LEU H 1 63 LEU QD 2.600 . 3.206 2.142 1.979 2.350 . 0 0 "[ . 1 . 2]" 1 953 2 63 LEU H 2 63 LEU QD 2.600 . 3.206 2.141 1.987 2.345 . 0 0 "[ . 1 . 2]" 1 954 1 63 LEU HA 1 63 LEU HG 3.746 . 5.500 3.710 3.689 3.742 . 0 0 "[ . 1 . 2]" 1 955 2 63 LEU HA 2 63 LEU HG 3.746 . 5.500 3.710 3.689 3.743 . 0 0 "[ . 1 . 2]" 1 956 1 60 ILE HA 1 63 LEU HG 3.702 . 5.415 4.078 3.673 4.600 . 0 0 "[ . 1 . 2]" 1 957 2 60 ILE HA 2 63 LEU HG 3.702 . 5.415 4.079 3.671 4.603 . 0 0 "[ . 1 . 2]" 1 958 1 61 LEU HA 1 61 LEU HG 2.641 . 3.513 2.504 2.421 2.645 . 0 0 "[ . 1 . 2]" 1 959 2 61 LEU HA 2 61 LEU HG 2.641 . 3.513 2.504 2.421 2.646 . 0 0 "[ . 1 . 2]" 1 960 1 57 LEU QD 1 61 LEU HG 2.802 . 6.000 3.936 3.778 4.133 . 0 0 "[ . 1 . 2]" 1 961 2 57 LEU QD 2 61 LEU HG 2.802 . 6.000 3.935 3.777 4.133 . 0 0 "[ . 1 . 2]" 1 962 1 57 LEU QD 1 61 LEU HB2 4.132 . 6.266 3.880 3.588 4.114 . 0 0 "[ . 1 . 2]" 1 963 2 57 LEU QD 2 61 LEU HB2 4.132 . 6.266 3.880 3.589 4.115 . 0 0 "[ . 1 . 2]" 1 964 1 57 LEU QD 1 61 LEU HB3 5.045 . 8.227 4.751 4.410 5.052 . 0 0 "[ . 1 . 2]" 1 965 2 57 LEU QD 2 61 LEU HB3 5.045 . 8.227 4.750 4.412 5.051 . 0 0 "[ . 1 . 2]" 1 966 1 28 LEU HB3 1 29 GLN H 5.336 . 8.895 3.661 3.579 3.722 . 0 0 "[ . 1 . 2]" 1 967 2 28 LEU HB3 2 29 GLN H 5.336 . 8.895 3.661 3.581 3.727 . 0 0 "[ . 1 . 2]" 1 968 1 28 LEU HG 1 32 PHE HE2 6.675 . 12.245 5.902 4.967 6.969 . 0 0 "[ . 1 . 2]" 1 969 2 28 LEU HG 2 32 PHE HE2 6.675 . 12.245 5.902 4.969 6.970 . 0 0 "[ . 1 . 2]" 1 970 1 27 TYR HE2 1 28 LEU HG 5.756 . 9.898 5.825 5.581 6.392 . 0 0 "[ . 1 . 2]" 1 971 2 27 TYR HE2 2 28 LEU HG 5.756 . 9.898 5.825 5.577 6.395 . 0 0 "[ . 1 . 2]" 1 972 1 32 PHE HE1 1 63 LEU QD 3.438 . 4.908 2.829 2.213 3.637 . 0 0 "[ . 1 . 2]" 1 973 2 32 PHE HE1 2 63 LEU QD 3.438 . 4.908 2.829 2.212 3.635 . 0 0 "[ . 1 . 2]" 1 974 1 32 PHE HD1 1 63 LEU QD 3.642 . 4.433 2.718 2.345 3.336 . 0 0 "[ . 1 . 2]" 1 975 2 32 PHE HD1 2 63 LEU QD 3.642 . 4.433 2.718 2.343 3.336 . 0 0 "[ . 1 . 2]" 1 976 1 26 SER HB3 1 27 TYR HB2 6.189 . 10.978 4.818 4.116 6.176 . 0 0 "[ . 1 . 2]" 1 977 2 26 SER HB3 2 27 TYR HB2 6.189 . 10.978 4.818 4.120 6.181 . 0 0 "[ . 1 . 2]" 1 978 1 45 GLY HA2 2 51 PHE HZ 3.649 . 5.313 4.808 4.456 5.073 . 0 0 "[ . 1 . 2]" 1 979 1 51 PHE HZ 2 45 GLY HA2 3.649 . 5.313 4.816 4.452 5.040 . 0 0 "[ . 1 . 2]" 1 980 1 28 LEU HB2 1 29 GLN HE22 4.791 . 7.660 7.043 6.840 7.201 . 0 0 "[ . 1 . 2]" 1 981 2 28 LEU HB2 2 29 GLN HE22 4.791 . 7.660 7.044 6.839 7.208 . 0 0 "[ . 1 . 2]" 1 982 1 36 VAL HA 1 49 ILE MD 3.584 . 5.189 3.042 2.703 3.225 . 0 0 "[ . 1 . 2]" 1 983 2 36 VAL HA 2 49 ILE MD 3.584 . 5.189 3.043 2.706 3.231 . 0 0 "[ . 1 . 2]" 1 984 1 57 LEU QD 1 60 ILE MD 2.827 . 6.000 3.950 3.223 4.946 . 0 0 "[ . 1 . 2]" 1 985 2 57 LEU QD 2 60 ILE MD 2.827 . 6.000 3.950 3.225 4.948 . 0 0 "[ . 1 . 2]" 1 986 1 61 LEU MD2 2 24 ARG HD2 2.779 . 3.744 2.154 1.921 3.388 . 0 0 "[ . 1 . 2]" 1 987 1 24 ARG HD2 2 61 LEU MD2 2.779 . 3.744 2.156 1.925 3.389 . 0 0 "[ . 1 . 2]" 1 988 1 61 LEU MD2 2 24 ARG HD3 3.021 . 4.162 2.299 2.069 2.548 . 0 0 "[ . 1 . 2]" 1 989 1 24 ARG HD3 2 61 LEU MD2 3.021 . 4.162 2.304 2.067 2.527 . 0 0 "[ . 1 . 2]" 1 990 1 61 LEU MD1 2 24 ARG HD2 3.692 . 5.396 4.494 4.153 5.621 0.225 11 0 "[ . 1 . 2]" 1 991 1 24 ARG HD2 2 61 LEU MD1 3.692 . 5.396 4.497 4.170 5.617 0.221 11 0 "[ . 1 . 2]" 1 992 1 61 LEU MD1 2 24 ARG HD3 3.864 . 5.730 4.598 4.123 4.892 . 0 0 "[ . 1 . 2]" 1 993 1 24 ARG HD3 2 61 LEU MD1 3.864 . 5.730 4.602 4.141 4.878 . 0 0 "[ . 1 . 2]" 1 994 1 24 ARG HD2 1 25 GLU H 6.052 . 10.630 5.314 5.099 6.239 . 0 0 "[ . 1 . 2]" 1 995 2 24 ARG HD2 2 25 GLU H 6.052 . 10.630 5.314 5.096 6.246 . 0 0 "[ . 1 . 2]" 1 996 1 24 ARG HD3 2 65 SER QB 5.541 . 9.379 5.414 4.339 6.771 . 0 0 "[ . 1 . 2]" 1 997 1 65 SER QB 2 24 ARG HD3 5.541 . 9.379 5.421 4.356 6.776 . 0 0 "[ . 1 . 2]" 1 998 1 44 LYS HB3 2 52 PHE HB3 6.118 . 10.796 5.243 4.415 7.156 . 0 0 "[ . 1 . 2]" 1 999 1 52 PHE HB3 2 44 LYS HB3 6.118 . 10.796 5.250 4.415 7.171 . 0 0 "[ . 1 . 2]" 1 1000 1 40 ARG HB2 1 45 GLY HA3 6.810 . 12.607 5.977 5.560 6.461 . 0 0 "[ . 1 . 2]" 1 1001 2 40 ARG HB2 2 45 GLY HA3 6.810 . 12.607 5.977 5.556 6.463 . 0 0 "[ . 1 . 2]" 1 1002 1 40 ARG HB2 2 57 LEU QD 6.840 . 12.688 5.797 4.979 6.137 . 0 0 "[ . 1 . 2]" 1 1003 1 57 LEU QD 2 40 ARG HB2 6.840 . 12.688 5.803 4.994 6.141 . 0 0 "[ . 1 . 2]" 1 1004 1 17 LYS HB3 1 20 VAL H 4.579 . 7.200 3.717 3.248 5.405 . 0 0 "[ . 1 . 2]" 1 1005 2 17 LYS HB3 2 20 VAL H 4.579 . 7.200 3.718 3.256 5.403 . 0 0 "[ . 1 . 2]" 1 1006 1 40 ARG HB3 2 57 LEU QD 6.365 . 11.429 5.293 4.503 5.791 . 0 0 "[ . 1 . 2]" 1 1007 1 57 LEU QD 2 40 ARG HB3 6.365 . 11.429 5.300 4.521 5.805 . 0 0 "[ . 1 . 2]" 1 1008 1 37 ASN HD21 1 48 GLU HB2 6.141 . 10.854 5.042 4.682 5.571 . 0 0 "[ . 1 . 2]" 1 1009 2 37 ASN HD21 2 48 GLU HB2 6.141 . 10.854 5.044 4.681 5.566 . 0 0 "[ . 1 . 2]" 1 1010 1 37 ASN HD22 1 48 GLU HB2 7.385 . 14.201 6.524 4.418 7.057 . 0 0 "[ . 1 . 2]" 1 1011 2 37 ASN HD22 2 48 GLU HB2 7.385 . 14.201 6.526 4.416 7.043 . 0 0 "[ . 1 . 2]" 1 1012 1 37 ASN HD21 1 48 GLU HB3 5.486 . 9.248 5.839 5.377 6.405 . 0 0 "[ . 1 . 2]" 1 1013 2 37 ASN HD21 2 48 GLU HB3 5.486 . 9.248 5.840 5.386 6.413 . 0 0 "[ . 1 . 2]" 1 1014 1 26 SER HA 1 29 GLN HG2 5.549 . 9.398 5.171 4.929 5.446 . 0 0 "[ . 1 . 2]" 1 1015 2 26 SER HA 2 29 GLN HG2 5.549 . 9.398 5.170 4.934 5.449 . 0 0 "[ . 1 . 2]" 1 1016 1 21 LEU QD 2 51 PHE QE 5.738 . 9.853 4.120 3.518 5.148 . 0 0 "[ . 1 . 2]" 1 1017 1 51 PHE HE2 2 21 LEU QD 5.738 . 9.853 4.436 3.667 5.462 . 0 0 "[ . 1 . 2]" 1 1018 1 57 LEU HA 1 60 ILE HB 2.939 . 4.019 2.980 2.702 3.224 . 0 0 "[ . 1 . 2]" 1 1019 2 57 LEU HA 2 60 ILE HB 2.939 . 4.019 2.979 2.700 3.227 . 0 0 "[ . 1 . 2]" 1 1020 1 36 VAL MG1 1 37 ASN H 2.542 . 3.249 2.517 2.409 2.761 . 0 0 "[ . 1 . 2]" 1 1021 2 36 VAL MG1 2 37 ASN H 2.542 . 3.249 2.516 2.403 2.761 . 0 0 "[ . 1 . 2]" 1 1022 1 29 GLN H 1 36 VAL MG1 3.644 . 6.000 4.148 3.952 4.356 . 0 0 "[ . 1 . 2]" 1 1023 2 29 GLN H 2 36 VAL MG1 3.644 . 6.000 4.149 3.956 4.358 . 0 0 "[ . 1 . 2]" 1 1024 1 36 VAL HA 1 47 ILE MG 3.783 . 5.572 4.274 3.890 4.560 . 0 0 "[ . 1 . 2]" 1 1025 2 36 VAL HA 2 47 ILE MG 3.783 . 5.572 4.275 3.890 4.562 . 0 0 "[ . 1 . 2]" 1 1026 1 47 ILE MG 1 48 GLU HA 3.753 . 5.514 3.829 3.596 3.936 . 0 0 "[ . 1 . 2]" 1 1027 2 47 ILE MG 2 48 GLU HA 3.753 . 5.514 3.829 3.595 3.938 . 0 0 "[ . 1 . 2]" 1 1028 1 21 LEU QD 2 51 PHE HZ 5.041 . 8.217 3.977 3.113 5.510 . 0 0 "[ . 1 . 2]" 1 1029 1 51 PHE HZ 2 21 LEU QD 5.041 . 8.217 3.971 3.091 5.517 . 0 0 "[ . 1 . 2]" 1 1030 1 40 ARG QD 2 51 PHE QE 4.736 . 7.540 2.821 2.177 4.195 . 0 0 "[ . 1 . 2]" 1 1031 1 51 PHE HE2 2 40 ARG QD 4.736 . 7.540 3.212 2.215 4.516 . 0 0 "[ . 1 . 2]" 1 1032 1 32 PHE HB2 1 63 LEU QD 5.255 . 8.706 4.470 3.022 6.026 . 0 0 "[ . 1 . 2]" 1 1033 2 32 PHE HB2 2 63 LEU QD 5.255 . 8.706 4.471 3.021 6.027 . 0 0 "[ . 1 . 2]" 1 1034 1 26 SER HB3 1 30 ASN HD21 6.319 . 11.310 5.150 3.871 6.366 . 0 0 "[ . 1 . 2]" 1 1035 2 26 SER HB3 2 30 ASN HD21 6.319 . 11.310 5.149 3.867 6.382 . 0 0 "[ . 1 . 2]" 1 1036 1 26 SER HB3 1 30 ASN HD22 5.840 . 10.103 5.369 4.131 6.026 . 0 0 "[ . 1 . 2]" 1 1037 2 26 SER HB3 2 30 ASN HD22 5.840 . 10.103 5.367 4.136 6.013 . 0 0 "[ . 1 . 2]" 1 1038 1 23 GLU H 1 26 SER HB3 5.087 . 8.322 6.081 5.439 7.262 . 0 0 "[ . 1 . 2]" 1 1039 2 23 GLU H 2 26 SER HB3 5.087 . 8.322 6.082 5.457 7.266 . 0 0 "[ . 1 . 2]" 1 1040 1 37 ASN HB3 1 38 ILE H 4.106 . 6.214 3.397 3.266 4.112 . 0 0 "[ . 1 . 2]" 1 1041 2 37 ASN HB3 2 38 ILE H 4.106 . 6.214 3.398 3.259 4.112 . 0 0 "[ . 1 . 2]" 1 1042 1 37 ASN HB3 1 48 GLU H 6.056 . 10.640 4.958 4.692 5.776 . 0 0 "[ . 1 . 2]" 1 1043 2 37 ASN HB3 2 48 GLU H 6.056 . 10.640 4.958 4.692 5.774 . 0 0 "[ . 1 . 2]" 1 1044 1 37 ASN HD22 1 39 LYS HG2 6.745 . 12.432 7.572 5.905 8.054 . 0 0 "[ . 1 . 2]" 1 1045 2 37 ASN HD22 2 39 LYS HG2 6.745 . 12.432 7.573 5.898 8.051 . 0 0 "[ . 1 . 2]" 1 1046 1 50 GLU HA 1 50 GLU HG2 4.672 . 7.401 2.702 2.479 3.177 . 0 0 "[ . 1 . 2]" 1 1047 2 50 GLU HA 2 50 GLU HG2 4.672 . 7.401 2.701 2.483 3.176 . 0 0 "[ . 1 . 2]" 1 1048 1 37 ASN H 1 50 GLU HG3 4.919 . 7.943 5.193 4.285 6.252 . 0 0 "[ . 1 . 2]" 1 1049 2 37 ASN H 2 50 GLU HG3 4.919 . 7.943 5.194 4.283 6.255 . 0 0 "[ . 1 . 2]" 1 1050 1 50 GLU HG3 2 47 ILE H 5.819 . 10.052 6.596 5.713 7.684 . 0 0 "[ . 1 . 2]" 1 1051 1 47 ILE H 2 50 GLU HG3 5.819 . 10.052 6.600 5.736 7.680 . 0 0 "[ . 1 . 2]" 1 1052 1 50 GLU H 1 50 GLU HG2 5.474 . 9.220 3.086 2.315 3.676 . 0 0 "[ . 1 . 2]" 1 1053 2 50 GLU H 2 50 GLU HG2 5.474 . 9.220 3.086 2.320 3.671 . 0 0 "[ . 1 . 2]" 1 1054 1 27 TYR HB3 1 28 LEU HB2 6.287 . 11.227 5.219 5.031 5.378 . 0 0 "[ . 1 . 2]" 1 1055 2 27 TYR HB3 2 28 LEU HB2 6.287 . 11.227 5.218 5.029 5.380 . 0 0 "[ . 1 . 2]" 1 1056 1 36 VAL HB 1 36 VAL MG2 2.201 . 2.806 2.128 2.127 2.130 . 0 0 "[ . 1 . 2]" 1 1057 2 36 VAL HB 2 36 VAL MG2 2.201 . 2.806 2.128 2.127 2.130 . 0 0 "[ . 1 . 2]" 1 1058 1 46 LYS H 2 51 PHE QE 3.856 . 5.715 3.139 2.803 3.411 . 0 0 "[ . 1 . 2]" 1 1059 1 51 PHE HE1 2 46 LYS H 3.856 . 5.715 3.708 2.879 5.453 . 0 0 "[ . 1 . 2]" 1 1060 1 46 LYS H 2 51 PHE HZ 3.250 . 4.570 3.420 3.179 3.753 . 0 0 "[ . 1 . 2]" 1 1061 1 51 PHE HZ 2 46 LYS H 3.250 . 4.570 3.427 3.192 3.772 . 0 0 "[ . 1 . 2]" 1 1062 1 46 LYS H 2 51 PHE H 4.696 . 7.452 4.739 4.516 5.232 . 0 0 "[ . 1 . 2]" 1 1063 1 51 PHE H 2 46 LYS H 4.696 . 7.452 4.739 4.499 5.239 . 0 0 "[ . 1 . 2]" 1 1064 1 51 PHE H 2 45 GLY H 3.277 . 4.376 3.194 2.867 3.501 . 0 0 "[ . 1 . 2]" 1 1065 1 45 GLY H 2 51 PHE H 3.277 . 4.376 3.187 2.837 3.472 . 0 0 "[ . 1 . 2]" 1 1066 1 47 ILE H 2 49 ILE H 3.354 . 4.702 2.842 2.676 2.999 . 0 0 "[ . 1 . 2]" 1 1067 1 49 ILE H 2 47 ILE H 3.354 . 4.702 2.843 2.668 3.003 . 0 0 "[ . 1 . 2]" 1 1068 1 47 ILE H 2 57 LEU QD 4.056 . 6.113 4.886 4.287 5.344 . 0 0 "[ . 1 . 2]" 1 1069 1 57 LEU QD 2 47 ILE H 4.056 . 6.113 4.890 4.272 5.360 . 0 0 "[ . 1 . 2]" 1 1070 1 51 PHE H 2 46 LYS QG 5.059 . 8.259 5.348 5.003 5.924 . 0 0 "[ . 1 . 2]" 1 1071 1 46 LYS QG 2 51 PHE H 5.059 . 8.259 5.344 4.981 5.910 . 0 0 "[ . 1 . 2]" 1 1072 1 46 LYS H 2 57 LEU QD 4.517 . 7.067 4.977 4.586 5.376 . 0 0 "[ . 1 . 2]" 1 1073 1 57 LEU QD 2 46 LYS H 4.517 . 7.067 4.983 4.576 5.387 . 0 0 "[ . 1 . 2]" 1 1074 1 45 GLY H 2 51 PHE HZ 4.416 . 6.853 4.874 3.971 5.447 . 0 0 "[ . 1 . 2]" 1 1075 1 51 PHE HZ 2 45 GLY H 4.416 . 6.853 4.881 3.994 5.429 . 0 0 "[ . 1 . 2]" 1 1076 1 50 GLU H 2 46 LYS HA 4.958 . 8.031 4.617 4.388 4.867 . 0 0 "[ . 1 . 2]" 1 1077 1 46 LYS HA 2 50 GLU H 4.958 . 8.031 4.616 4.388 4.864 . 0 0 "[ . 1 . 2]" 1 1078 1 49 ILE H 2 46 LYS HA 4.751 . 7.573 4.333 4.124 4.657 . 0 0 "[ . 1 . 2]" 1 1079 1 46 LYS HA 2 49 ILE H 4.751 . 7.573 4.330 4.125 4.654 . 0 0 "[ . 1 . 2]" 1 1080 1 53 SER H 2 43 LYS HA 4.003 . 6.006 5.334 4.652 6.220 0.214 6 0 "[ . 1 . 2]" 1 1081 1 43 LYS HA 2 53 SER H 4.003 . 6.006 5.329 4.622 6.273 0.267 6 0 "[ . 1 . 2]" 1 1082 1 17 LYS H 1 20 VAL MG2 2.893 . 3.939 3.252 2.821 3.833 . 0 0 "[ . 1 . 2]" 1 1083 2 17 LYS H 2 20 VAL MG2 2.893 . 3.939 3.251 2.827 3.828 . 0 0 "[ . 1 . 2]" 1 1084 1 17 LYS H 1 18 ASP HA 3.879 . 5.760 5.092 4.785 5.375 . 0 0 "[ . 1 . 2]" 1 1085 2 17 LYS H 2 18 ASP HA 3.879 . 5.760 5.093 4.797 5.369 . 0 0 "[ . 1 . 2]" 1 1086 1 17 LYS H 1 17 LYS HA 2.666 . 3.555 2.923 2.879 2.945 . 0 0 "[ . 1 . 2]" 1 1087 2 17 LYS H 2 17 LYS HA 2.666 . 3.555 2.924 2.884 2.944 . 0 0 "[ . 1 . 2]" 1 1088 1 16 VAL HA 1 17 LYS H 1.772 . 2.165 2.181 2.126 2.249 0.084 18 0 "[ . 1 . 2]" 1 1089 2 16 VAL HA 2 17 LYS H 1.772 . 2.165 2.180 2.126 2.246 0.081 18 0 "[ . 1 . 2]" 1 1090 1 17 LYS H 1 20 VAL HB 3.324 . 4.705 4.138 3.782 4.797 0.092 19 0 "[ . 1 . 2]" 1 1091 2 17 LYS H 2 20 VAL HB 3.324 . 4.705 4.138 3.785 4.791 0.086 19 0 "[ . 1 . 2]" 1 1092 1 16 VAL HB 1 17 LYS H 3.170 . 4.426 4.073 3.956 4.173 . 0 0 "[ . 1 . 2]" 1 1093 2 16 VAL HB 2 17 LYS H 3.170 . 4.426 4.074 3.951 4.167 . 0 0 "[ . 1 . 2]" 1 1094 1 17 LYS H 1 17 LYS HB3 3.289 . 4.641 3.582 3.008 3.746 . 0 0 "[ . 1 . 2]" 1 1095 2 17 LYS H 2 17 LYS HB3 3.289 . 4.641 3.582 3.012 3.743 . 0 0 "[ . 1 . 2]" 1 1096 1 17 LYS H 1 17 LYS HB2 2.244 . 2.874 2.677 2.418 3.737 0.863 6 3 "[* .+ 1 . -2]" 1 1097 2 17 LYS H 2 17 LYS HB2 2.244 . 2.874 2.677 2.422 3.734 0.860 6 3 "[* .+ 1 . -2]" 1 1098 1 16 VAL QG 1 17 LYS H 2.124 . 2.688 2.410 2.168 2.628 . 0 0 "[ . 1 . 2]" 1 1099 2 16 VAL QG 2 17 LYS H 2.124 . 2.688 2.411 2.167 2.626 . 0 0 "[ . 1 . 2]" 1 1100 1 17 LYS H 1 18 ASP H 3.838 . 5.679 4.403 4.265 4.569 . 0 0 "[ . 1 . 2]" 1 1101 2 17 LYS H 2 18 ASP H 3.838 . 5.679 4.404 4.256 4.568 . 0 0 "[ . 1 . 2]" 1 1102 1 19 ALA H 1 20 VAL HB 4.920 . 7.945 4.934 4.838 5.149 . 0 0 "[ . 1 . 2]" 1 1103 2 19 ALA H 2 20 VAL HB 4.920 . 7.945 4.935 4.834 5.149 . 0 0 "[ . 1 . 2]" 1 1104 1 17 LYS HB3 1 19 ALA H 3.496 . 5.024 3.068 2.591 4.400 . 0 0 "[ . 1 . 2]" 1 1105 2 17 LYS HB3 2 19 ALA H 3.496 . 5.024 3.067 2.588 4.412 . 0 0 "[ . 1 . 2]" 1 1106 1 17 LYS HB2 1 19 ALA H 3.932 . 5.865 3.644 2.705 4.242 . 0 0 "[ . 1 . 2]" 1 1107 2 17 LYS HB2 2 19 ALA H 3.932 . 5.865 3.644 2.700 4.232 . 0 0 "[ . 1 . 2]" 1 1108 1 17 LYS QD 1 19 ALA H 4.740 . 7.548 4.646 4.058 5.159 . 0 0 "[ . 1 . 2]" 1 1109 2 17 LYS QD 2 19 ALA H 4.740 . 7.548 4.644 4.068 5.154 . 0 0 "[ . 1 . 2]" 1 1110 1 18 ASP HA 1 19 ALA H 2.864 . 3.890 3.417 3.376 3.465 . 0 0 "[ . 1 . 2]" 1 1111 2 18 ASP HA 2 19 ALA H 2.864 . 3.890 3.418 3.373 3.467 . 0 0 "[ . 1 . 2]" 1 1112 1 19 ALA H 1 19 ALA HA 2.808 . 3.794 2.805 2.769 2.827 . 0 0 "[ . 1 . 2]" 1 1113 2 19 ALA H 2 19 ALA HA 2.808 . 3.794 2.805 2.770 2.824 . 0 0 "[ . 1 . 2]" 1 1114 1 19 ALA H 1 20 VAL HA 5.142 . 8.447 5.243 5.169 5.342 . 0 0 "[ . 1 . 2]" 1 1115 2 19 ALA H 2 20 VAL HA 5.142 . 8.447 5.244 5.177 5.341 . 0 0 "[ . 1 . 2]" 1 1116 1 19 ALA H 1 19 ALA MB 2.199 . 2.803 2.231 2.213 2.237 . 0 0 "[ . 1 . 2]" 1 1117 2 19 ALA H 2 19 ALA MB 2.199 . 2.803 2.232 2.217 2.238 . 0 0 "[ . 1 . 2]" 1 1118 1 19 ALA H 1 20 VAL MG2 3.971 . 5.942 3.880 3.780 4.093 . 0 0 "[ . 1 . 2]" 1 1119 2 19 ALA H 2 20 VAL MG2 3.971 . 5.942 3.880 3.795 4.086 . 0 0 "[ . 1 . 2]" 1 1120 1 19 ALA H 1 21 LEU QD 4.008 . 6.016 4.329 4.170 4.392 . 0 0 "[ . 1 . 2]" 1 1121 2 19 ALA H 2 21 LEU QD 4.008 . 6.016 4.329 4.172 4.393 . 0 0 "[ . 1 . 2]" 1 1122 1 19 ALA H 1 22 LYS H 4.786 . 7.650 4.630 4.496 4.930 . 0 0 "[ . 1 . 2]" 1 1123 2 19 ALA H 2 22 LYS H 4.786 . 7.650 4.631 4.501 4.931 . 0 0 "[ . 1 . 2]" 1 1124 1 19 ALA H 1 20 VAL H 2.824 . 3.821 2.640 2.578 2.753 . 0 0 "[ . 1 . 2]" 1 1125 2 19 ALA H 2 20 VAL H 2.824 . 3.821 2.641 2.584 2.753 . 0 0 "[ . 1 . 2]" 1 1126 1 16 VAL QG 1 19 ALA H 4.179 . 6.362 5.126 4.955 5.362 . 0 0 "[ . 1 . 2]" 1 1127 2 16 VAL QG 2 19 ALA H 4.179 . 6.362 5.127 4.954 5.369 . 0 0 "[ . 1 . 2]" 1 1128 1 17 LYS HA 1 19 ALA H 4.138 . 6.278 3.686 3.453 3.860 . 0 0 "[ . 1 . 2]" 1 1129 2 17 LYS HA 2 19 ALA H 4.138 . 6.278 3.687 3.456 3.865 . 0 0 "[ . 1 . 2]" 1 1130 1 19 ALA HA 1 20 VAL H 3.100 . 4.301 3.491 3.465 3.519 . 0 0 "[ . 1 . 2]" 1 1131 2 19 ALA HA 2 20 VAL H 3.100 . 4.301 3.491 3.465 3.518 . 0 0 "[ . 1 . 2]" 1 1132 1 20 VAL H 1 20 VAL HA 2.747 . 3.690 2.837 2.811 2.855 . 0 0 "[ . 1 . 2]" 1 1133 2 20 VAL H 2 20 VAL HA 2.747 . 3.690 2.837 2.814 2.857 . 0 0 "[ . 1 . 2]" 1 1134 1 20 VAL H 1 20 VAL HB 2.252 . 2.886 2.533 2.497 2.619 . 0 0 "[ . 1 . 2]" 1 1135 2 20 VAL H 2 20 VAL HB 2.252 . 2.886 2.532 2.496 2.617 . 0 0 "[ . 1 . 2]" 1 1136 1 20 VAL H 1 21 LEU HB3 4.559 . 7.157 6.031 5.870 6.146 . 0 0 "[ . 1 . 2]" 1 1137 2 20 VAL H 2 21 LEU HB3 4.559 . 7.157 6.029 5.878 6.144 . 0 0 "[ . 1 . 2]" 1 1138 1 20 VAL H 1 20 VAL MG2 2.004 . 2.506 2.048 1.922 2.110 . 0 0 "[ . 1 . 2]" 1 1139 2 20 VAL H 2 20 VAL MG2 2.004 . 2.506 2.048 1.918 2.120 . 0 0 "[ . 1 . 2]" 1 1140 1 20 VAL H 1 22 LYS H 3.706 . 5.423 3.830 3.707 4.082 . 0 0 "[ . 1 . 2]" 1 1141 2 20 VAL H 2 22 LYS H 3.706 . 5.423 3.829 3.710 4.073 . 0 0 "[ . 1 . 2]" 1 1142 1 21 LEU H 1 21 LEU HB2 2.307 . 2.972 2.401 2.330 2.483 . 0 0 "[ . 1 . 2]" 1 1143 2 21 LEU H 2 21 LEU HB2 2.307 . 2.972 2.401 2.332 2.485 . 0 0 "[ . 1 . 2]" 1 1144 1 21 LEU H 1 21 LEU QD 2.125 . 2.690 1.898 1.765 2.012 . 0 0 "[ . 1 . 2]" 1 1145 2 21 LEU H 2 21 LEU QD 2.125 . 2.690 1.899 1.765 2.011 . 0 0 "[ . 1 . 2]" 1 1146 1 18 ASP HA 1 21 LEU H 3.428 . 4.897 3.206 3.010 3.527 . 0 0 "[ . 1 . 2]" 1 1147 2 18 ASP HA 2 21 LEU H 3.428 . 4.897 3.207 3.004 3.530 . 0 0 "[ . 1 . 2]" 1 1148 1 21 LEU H 1 21 LEU HA 2.778 . 3.743 2.840 2.806 2.895 . 0 0 "[ . 1 . 2]" 1 1149 2 21 LEU H 2 21 LEU HA 2.778 . 3.743 2.840 2.806 2.895 . 0 0 "[ . 1 . 2]" 1 1150 1 20 VAL HA 1 21 LEU H 3.320 . 4.698 3.502 3.474 3.527 . 0 0 "[ . 1 . 2]" 1 1151 2 20 VAL HA 2 21 LEU H 3.320 . 4.698 3.502 3.473 3.528 . 0 0 "[ . 1 . 2]" 1 1152 1 20 VAL HB 1 21 LEU H 2.456 . 3.210 2.621 2.524 2.783 . 0 0 "[ . 1 . 2]" 1 1153 2 20 VAL HB 2 21 LEU H 2.456 . 3.210 2.621 2.522 2.782 . 0 0 "[ . 1 . 2]" 1 1154 1 21 LEU H 1 21 LEU HB3 3.098 . 4.298 3.586 3.558 3.630 . 0 0 "[ . 1 . 2]" 1 1155 2 21 LEU H 2 21 LEU HB3 3.098 . 4.298 3.587 3.559 3.630 . 0 0 "[ . 1 . 2]" 1 1156 1 20 VAL MG2 1 21 LEU H 3.329 . 4.714 3.747 3.684 3.824 . 0 0 "[ . 1 . 2]" 1 1157 2 20 VAL MG2 2 21 LEU H 3.329 . 4.714 3.747 3.682 3.826 . 0 0 "[ . 1 . 2]" 1 1158 1 58 ASP HA 1 59 ARG H 3.578 . 5.178 3.522 3.460 3.570 . 0 0 "[ . 1 . 2]" 1 1159 2 58 ASP HA 2 59 ARG H 3.578 . 5.178 3.521 3.458 3.567 . 0 0 "[ . 1 . 2]" 1 1160 1 58 ASP HB3 1 59 ARG H 4.241 . 6.489 2.725 2.464 4.005 . 0 0 "[ . 1 . 2]" 1 1161 2 58 ASP HB3 2 59 ARG H 4.241 . 6.489 2.724 2.460 4.006 . 0 0 "[ . 1 . 2]" 1 1162 1 59 ARG H 1 59 ARG HB2 2.864 . 3.890 2.799 2.477 3.647 . 0 0 "[ . 1 . 2]" 1 1163 2 59 ARG H 2 59 ARG HB2 2.864 . 3.890 2.798 2.473 3.651 . 0 0 "[ . 1 . 2]" 1 1164 1 19 ALA H 1 21 LEU H 4.520 . 7.074 4.203 4.095 4.354 . 0 0 "[ . 1 . 2]" 1 1165 2 19 ALA H 2 21 LEU H 4.520 . 7.074 4.204 4.090 4.349 . 0 0 "[ . 1 . 2]" 1 1166 1 59 ARG H 1 60 ILE H 3.038 . 4.192 2.637 2.518 2.854 . 0 0 "[ . 1 . 2]" 1 1167 2 59 ARG H 2 60 ILE H 3.038 . 4.192 2.637 2.511 2.851 . 0 0 "[ . 1 . 2]" 1 1168 1 20 VAL MG2 1 22 LYS H 4.347 . 6.709 5.186 5.058 5.369 . 0 0 "[ . 1 . 2]" 1 1169 2 20 VAL MG2 2 22 LYS H 4.347 . 6.709 5.186 5.056 5.366 . 0 0 "[ . 1 . 2]" 1 1170 1 18 ASP HA 1 22 LYS H 4.134 . 6.271 4.317 4.144 4.825 . 0 0 "[ . 1 . 2]" 1 1171 2 18 ASP HA 2 22 LYS H 4.134 . 6.271 4.317 4.145 4.827 . 0 0 "[ . 1 . 2]" 1 1172 1 22 LYS H 1 22 LYS HA 2.843 . 3.853 2.803 2.772 2.852 . 0 0 "[ . 1 . 2]" 1 1173 2 22 LYS H 2 22 LYS HA 2.843 . 3.853 2.803 2.774 2.852 . 0 0 "[ . 1 . 2]" 1 1174 1 21 LEU HA 1 22 LYS H 3.370 . 4.789 3.506 3.459 3.537 . 0 0 "[ . 1 . 2]" 1 1175 2 21 LEU HA 2 22 LYS H 3.370 . 4.789 3.505 3.457 3.535 . 0 0 "[ . 1 . 2]" 1 1176 1 20 VAL HA 1 22 LYS H 3.840 . 5.683 4.306 4.173 4.488 . 0 0 "[ . 1 . 2]" 1 1177 2 20 VAL HA 2 22 LYS H 3.840 . 5.683 4.305 4.183 4.480 . 0 0 "[ . 1 . 2]" 1 1178 1 22 LYS H 1 22 LYS QE 6.209 . 11.027 5.915 5.757 6.118 . 0 0 "[ . 1 . 2]" 1 1179 2 22 LYS H 2 22 LYS QE 6.209 . 11.027 5.915 5.751 6.119 . 0 0 "[ . 1 . 2]" 1 1180 1 22 LYS H 1 23 GLU HG2 4.242 . 6.491 4.535 3.872 5.870 . 0 0 "[ . 1 . 2]" 1 1181 2 22 LYS H 2 23 GLU HG2 4.242 . 6.491 4.534 3.878 5.850 . 0 0 "[ . 1 . 2]" 1 1182 1 22 LYS H 1 22 LYS HB2 2.206 . 2.814 2.515 2.366 2.732 . 0 0 "[ . 1 . 2]" 1 1183 2 22 LYS H 2 22 LYS HB2 2.206 . 2.814 2.515 2.360 2.735 . 0 0 "[ . 1 . 2]" 1 1184 1 22 LYS H 1 24 ARG H 4.084 . 6.168 4.094 3.764 4.373 . 0 0 "[ . 1 . 2]" 1 1185 2 22 LYS H 2 24 ARG H 4.084 . 6.168 4.093 3.763 4.367 . 0 0 "[ . 1 . 2]" 1 1186 1 19 ALA MB 1 23 GLU H 4.515 . 7.064 4.556 4.314 4.824 . 0 0 "[ . 1 . 2]" 1 1187 2 19 ALA MB 2 23 GLU H 4.515 . 7.064 4.553 4.315 4.816 . 0 0 "[ . 1 . 2]" 1 1188 1 20 VAL MG2 1 23 GLU H 4.409 . 6.839 5.282 5.133 5.548 . 0 0 "[ . 1 . 2]" 1 1189 2 20 VAL MG2 2 23 GLU H 4.409 . 6.839 5.282 5.136 5.552 . 0 0 "[ . 1 . 2]" 1 1190 1 20 VAL HA 1 23 GLU H 3.486 . 5.005 3.558 3.311 3.959 . 0 0 "[ . 1 . 2]" 1 1191 2 20 VAL HA 2 23 GLU H 3.486 . 5.005 3.558 3.310 3.960 . 0 0 "[ . 1 . 2]" 1 1192 1 23 GLU H 1 23 GLU HG2 2.642 . 3.514 2.448 2.051 3.400 . 0 0 "[ . 1 . 2]" 1 1193 2 23 GLU H 2 23 GLU HG2 2.642 . 3.514 2.448 2.042 3.396 . 0 0 "[ . 1 . 2]" 1 1194 1 23 GLU H 1 23 GLU HG3 3.744 . 5.496 3.209 2.141 3.872 . 0 0 "[ . 1 . 2]" 1 1195 2 23 GLU H 2 23 GLU HG3 3.744 . 5.496 3.210 2.141 3.867 . 0 0 "[ . 1 . 2]" 1 1196 1 22 LYS HB2 1 23 GLU H 2.909 . 3.967 3.925 3.805 4.024 0.057 14 0 "[ . 1 . 2]" 1 1197 2 22 LYS HB2 2 23 GLU H 2.909 . 3.967 3.923 3.804 4.018 0.051 14 0 "[ . 1 . 2]" 1 1198 1 22 LYS QG 1 23 GLU H 3.875 . 5.752 3.701 3.270 4.084 . 0 0 "[ . 1 . 2]" 1 1199 2 22 LYS QG 2 23 GLU H 3.875 . 5.752 3.700 3.267 4.078 . 0 0 "[ . 1 . 2]" 1 1200 1 23 GLU H 1 26 SER H 4.177 . 6.358 4.834 4.666 5.101 . 0 0 "[ . 1 . 2]" 1 1201 2 23 GLU H 2 26 SER H 4.177 . 6.358 4.834 4.669 5.104 . 0 0 "[ . 1 . 2]" 1 1202 1 23 GLU H 1 25 GLU H 4.251 . 6.510 4.048 3.890 4.166 . 0 0 "[ . 1 . 2]" 1 1203 2 23 GLU H 2 25 GLU H 4.251 . 6.510 4.049 3.884 4.177 . 0 0 "[ . 1 . 2]" 1 1204 1 23 GLU H 1 24 ARG H 2.740 . 3.678 2.582 2.467 2.681 . 0 0 "[ . 1 . 2]" 1 1205 2 23 GLU H 2 24 ARG H 2.740 . 3.678 2.584 2.474 2.681 . 0 0 "[ . 1 . 2]" 1 1206 1 25 GLU H 1 26 SER HA 5.137 . 8.435 5.330 5.263 5.375 . 0 0 "[ . 1 . 2]" 1 1207 2 25 GLU H 2 26 SER HA 5.137 . 8.435 5.329 5.266 5.375 . 0 0 "[ . 1 . 2]" 1 1208 1 25 GLU H 2 61 LEU MD2 3.598 . 5.216 4.276 3.797 4.459 . 0 0 "[ . 1 . 2]" 1 1209 1 61 LEU MD2 2 25 GLU H 3.598 . 5.216 4.277 3.820 4.487 . 0 0 "[ . 1 . 2]" 1 1210 1 25 GLU H 1 26 SER QB 5.004 . 8.134 4.656 4.408 5.099 . 0 0 "[ . 1 . 2]" 1 1211 2 25 GLU H 2 26 SER QB 5.004 . 8.134 4.655 4.415 5.102 . 0 0 "[ . 1 . 2]" 1 1212 1 21 LEU HA 1 25 GLU H 3.831 . 5.666 4.022 3.805 4.519 . 0 0 "[ . 1 . 2]" 1 1213 2 21 LEU HA 2 25 GLU H 3.831 . 5.666 4.023 3.806 4.523 . 0 0 "[ . 1 . 2]" 1 1214 1 24 ARG HD3 1 25 GLU H 5.756 . 9.897 5.772 5.225 6.011 . 0 0 "[ . 1 . 2]" 1 1215 2 24 ARG HD3 2 25 GLU H 5.756 . 9.897 5.773 5.233 6.013 . 0 0 "[ . 1 . 2]" 1 1216 1 25 GLU H 1 25 GLU HG3 2.733 . 3.667 2.424 2.302 2.602 . 0 0 "[ . 1 . 2]" 1 1217 2 25 GLU H 2 25 GLU HG3 2.733 . 3.667 2.426 2.302 2.606 . 0 0 "[ . 1 . 2]" 1 1218 1 25 GLU H 1 25 GLU HB3 3.964 . 5.928 3.594 3.572 3.622 . 0 0 "[ . 1 . 2]" 1 1219 2 25 GLU H 2 25 GLU HB3 3.964 . 5.928 3.594 3.573 3.622 . 0 0 "[ . 1 . 2]" 1 1220 1 25 GLU H 1 25 GLU HB2 2.679 . 3.576 2.411 2.368 2.468 . 0 0 "[ . 1 . 2]" 1 1221 2 25 GLU H 2 25 GLU HB2 2.679 . 3.576 2.410 2.370 2.463 . 0 0 "[ . 1 . 2]" 1 1222 1 22 LYS H 1 25 GLU H 4.402 . 6.824 4.624 4.528 4.777 . 0 0 "[ . 1 . 2]" 1 1223 2 22 LYS H 2 25 GLU H 4.402 . 6.824 4.624 4.529 4.776 . 0 0 "[ . 1 . 2]" 1 1224 1 24 ARG H 1 25 GLU H 2.803 . 3.785 2.443 2.341 2.614 . 0 0 "[ . 1 . 2]" 1 1225 2 24 ARG H 2 25 GLU H 2.803 . 3.785 2.442 2.342 2.608 . 0 0 "[ . 1 . 2]" 1 1226 1 26 SER H 1 27 TYR HB2 5.729 . 9.831 5.288 5.133 5.473 . 0 0 "[ . 1 . 2]" 1 1227 2 26 SER H 2 27 TYR HB2 5.729 . 9.831 5.287 5.133 5.476 . 0 0 "[ . 1 . 2]" 1 1228 1 25 GLU HA 1 26 SER H 3.697 . 5.406 3.523 3.494 3.540 . 0 0 "[ . 1 . 2]" 1 1229 2 25 GLU HA 2 26 SER H 3.697 . 5.406 3.523 3.494 3.542 . 0 0 "[ . 1 . 2]" 1 1230 1 26 SER H 1 27 TYR HB3 5.203 . 8.587 4.858 4.734 4.981 . 0 0 "[ . 1 . 2]" 1 1231 2 26 SER H 2 27 TYR HB3 5.203 . 8.587 4.857 4.729 4.981 . 0 0 "[ . 1 . 2]" 1 1232 1 25 GLU HG3 1 26 SER H 4.235 . 6.477 4.497 4.373 4.601 . 0 0 "[ . 1 . 2]" 1 1233 2 25 GLU HG3 2 26 SER H 4.235 . 6.477 4.497 4.371 4.603 . 0 0 "[ . 1 . 2]" 1 1234 1 25 GLU HB3 1 26 SER H 3.620 . 5.258 3.520 3.402 3.644 . 0 0 "[ . 1 . 2]" 1 1235 2 25 GLU HB3 2 26 SER H 3.620 . 5.258 3.520 3.397 3.642 . 0 0 "[ . 1 . 2]" 1 1236 1 25 GLU HB2 1 26 SER H 2.867 . 3.895 2.679 2.524 2.872 . 0 0 "[ . 1 . 2]" 1 1237 2 25 GLU HB2 2 26 SER H 2.867 . 3.895 2.679 2.521 2.872 . 0 0 "[ . 1 . 2]" 1 1238 1 22 LYS QD 1 26 SER H 4.642 . 7.335 4.766 3.909 6.611 . 0 0 "[ . 1 . 2]" 1 1239 2 22 LYS QD 2 26 SER H 4.642 . 7.335 4.768 3.926 6.609 . 0 0 "[ . 1 . 2]" 1 1240 1 26 SER H 1 27 TYR HD2 6.371 . 11.445 6.888 6.651 7.108 . 0 0 "[ . 1 . 2]" 1 1241 2 26 SER H 2 27 TYR HD2 6.371 . 11.445 6.887 6.644 7.109 . 0 0 "[ . 1 . 2]" 1 1242 1 26 SER H 1 29 GLN HE22 5.242 . 8.677 6.408 6.144 6.792 . 0 0 "[ . 1 . 2]" 1 1243 2 26 SER H 2 29 GLN HE22 5.242 . 8.677 6.409 6.129 6.799 . 0 0 "[ . 1 . 2]" 1 1244 1 26 SER H 1 28 LEU H 4.341 . 6.696 4.089 4.012 4.195 . 0 0 "[ . 1 . 2]" 1 1245 2 26 SER H 2 28 LEU H 4.341 . 6.696 4.089 4.007 4.197 . 0 0 "[ . 1 . 2]" 1 1246 1 26 SER H 1 29 GLN H 4.475 . 6.978 4.848 4.759 5.022 . 0 0 "[ . 1 . 2]" 1 1247 2 26 SER H 2 29 GLN H 4.475 . 6.978 4.849 4.760 5.018 . 0 0 "[ . 1 . 2]" 1 1248 1 25 GLU H 1 26 SER H 2.877 . 3.911 2.740 2.658 2.797 . 0 0 "[ . 1 . 2]" 1 1249 2 25 GLU H 2 26 SER H 2.877 . 3.911 2.739 2.663 2.798 . 0 0 "[ . 1 . 2]" 1 1250 1 24 ARG QB 1 27 TYR H 5.155 . 8.477 4.696 4.545 4.826 . 0 0 "[ . 1 . 2]" 1 1251 2 24 ARG QB 2 27 TYR H 5.155 . 8.477 4.697 4.547 4.833 . 0 0 "[ . 1 . 2]" 1 1252 1 27 TYR H 1 27 TYR HA 2.982 . 4.093 2.855 2.837 2.885 . 0 0 "[ . 1 . 2]" 1 1253 2 27 TYR H 2 27 TYR HA 2.982 . 4.093 2.856 2.836 2.886 . 0 0 "[ . 1 . 2]" 1 1254 1 24 ARG HA 1 27 TYR H 3.075 . 4.257 3.270 3.075 3.447 . 0 0 "[ . 1 . 2]" 1 1255 2 24 ARG HA 2 27 TYR H 3.075 . 4.257 3.270 3.072 3.446 . 0 0 "[ . 1 . 2]" 1 1256 1 27 TYR H 1 27 TYR HB2 3.347 . 4.748 2.726 2.614 2.845 . 0 0 "[ . 1 . 2]" 1 1257 2 27 TYR H 2 27 TYR HB2 3.347 . 4.748 2.726 2.616 2.847 . 0 0 "[ . 1 . 2]" 1 1258 1 25 GLU HB3 1 27 TYR H 5.034 . 8.201 5.504 5.316 5.621 . 0 0 "[ . 1 . 2]" 1 1259 2 25 GLU HB3 2 27 TYR H 5.034 . 8.201 5.503 5.315 5.622 . 0 0 "[ . 1 . 2]" 1 1260 1 27 TYR H 1 29 GLN HB2 4.458 . 6.942 5.416 5.273 5.569 . 0 0 "[ . 1 . 2]" 1 1261 2 27 TYR H 2 29 GLN HB2 4.458 . 6.942 5.416 5.273 5.566 . 0 0 "[ . 1 . 2]" 1 1262 1 27 TYR H 1 28 LEU MD2 4.461 . 6.949 4.853 4.571 5.112 . 0 0 "[ . 1 . 2]" 1 1263 2 27 TYR H 2 28 LEU MD2 4.461 . 6.949 4.854 4.576 5.109 . 0 0 "[ . 1 . 2]" 1 1264 1 26 SER QB 1 27 TYR H 3.063 . 4.236 2.726 2.471 3.441 . 0 0 "[ . 1 . 2]" 1 1265 2 26 SER QB 2 27 TYR H 3.063 . 4.236 2.726 2.473 3.449 . 0 0 "[ . 1 . 2]" 1 1266 1 27 TYR H 1 27 TYR HB3 2.917 . 3.980 2.403 2.310 2.484 . 0 0 "[ . 1 . 2]" 1 1267 2 27 TYR H 2 27 TYR HB3 2.917 . 3.980 2.403 2.313 2.487 . 0 0 "[ . 1 . 2]" 1 1268 1 27 TYR H 2 61 LEU MD2 4.737 . 7.541 6.514 6.152 6.857 . 0 0 "[ . 1 . 2]" 1 1269 1 61 LEU MD2 2 27 TYR H 4.737 . 7.541 6.511 6.145 6.879 . 0 0 "[ . 1 . 2]" 1 1270 1 27 TYR H 1 30 ASN H 4.786 . 7.649 4.944 4.833 4.996 . 0 0 "[ . 1 . 2]" 1 1271 2 27 TYR H 2 30 ASN H 4.786 . 7.649 4.945 4.836 5.002 . 0 0 "[ . 1 . 2]" 1 1272 1 27 TYR H 1 27 TYR HD2 4.687 . 7.433 4.578 4.440 4.731 . 0 0 "[ . 1 . 2]" 1 1273 2 27 TYR H 2 27 TYR HD2 4.687 . 7.433 4.578 4.438 4.735 . 0 0 "[ . 1 . 2]" 1 1274 1 27 TYR H 1 28 LEU H 2.979 . 4.088 2.533 2.431 2.623 . 0 0 "[ . 1 . 2]" 1 1275 2 27 TYR H 2 28 LEU H 2.979 . 4.088 2.534 2.431 2.620 . 0 0 "[ . 1 . 2]" 1 1276 1 27 TYR H 1 29 GLN H 4.702 . 7.466 4.208 4.052 4.335 . 0 0 "[ . 1 . 2]" 1 1277 2 27 TYR H 2 29 GLN H 4.702 . 7.466 4.209 4.052 4.332 . 0 0 "[ . 1 . 2]" 1 1278 1 25 GLU H 1 27 TYR H 4.584 . 7.210 4.268 4.128 4.490 . 0 0 "[ . 1 . 2]" 1 1279 2 25 GLU H 2 27 TYR H 4.584 . 7.210 4.267 4.129 4.486 . 0 0 "[ . 1 . 2]" 1 1280 1 27 TYR H 1 31 TYR H 5.185 . 8.546 6.053 5.948 6.129 . 0 0 "[ . 1 . 2]" 1 1281 2 27 TYR H 2 31 TYR H 5.185 . 8.546 6.055 5.951 6.133 . 0 0 "[ . 1 . 2]" 1 1282 1 24 ARG HA 1 28 LEU H 4.158 . 6.319 4.159 3.939 4.429 . 0 0 "[ . 1 . 2]" 1 1283 2 24 ARG HA 2 28 LEU H 4.158 . 6.319 4.160 3.944 4.431 . 0 0 "[ . 1 . 2]" 1 1284 1 27 TYR HB3 1 28 LEU H 3.842 . 5.688 2.777 2.618 2.872 . 0 0 "[ . 1 . 2]" 1 1285 2 27 TYR HB3 2 28 LEU H 3.842 . 5.688 2.776 2.615 2.877 . 0 0 "[ . 1 . 2]" 1 1286 1 27 TYR HB2 1 28 LEU H 4.991 . 8.105 4.037 3.941 4.124 . 0 0 "[ . 1 . 2]" 1 1287 2 27 TYR HB2 2 28 LEU H 4.991 . 8.105 4.036 3.939 4.129 . 0 0 "[ . 1 . 2]" 1 1288 1 28 LEU H 1 28 LEU HG 3.090 . 4.284 2.247 2.168 2.315 . 0 0 "[ . 1 . 2]" 1 1289 2 28 LEU H 2 28 LEU HG 3.090 . 4.284 2.248 2.165 2.317 . 0 0 "[ . 1 . 2]" 1 1290 1 28 LEU H 2 61 LEU MD2 4.404 . 6.829 5.870 5.480 6.341 . 0 0 "[ . 1 . 2]" 1 1291 1 61 LEU MD2 2 28 LEU H 4.404 . 6.829 5.867 5.461 6.359 . 0 0 "[ . 1 . 2]" 1 1292 1 26 SER QB 1 28 LEU H 5.448 . 9.158 4.790 4.637 5.202 . 0 0 "[ . 1 . 2]" 1 1293 2 26 SER QB 2 28 LEU H 5.448 . 9.158 4.790 4.637 5.210 . 0 0 "[ . 1 . 2]" 1 1294 1 27 TYR HD2 1 28 LEU H 4.566 . 7.172 3.762 3.534 4.147 . 0 0 "[ . 1 . 2]" 1 1295 2 27 TYR HD2 2 28 LEU H 4.566 . 7.172 3.761 3.533 4.155 . 0 0 "[ . 1 . 2]" 1 1296 1 29 GLN H 1 30 ASN HA 5.196 . 8.570 5.316 5.261 5.361 . 0 0 "[ . 1 . 2]" 1 1297 2 29 GLN H 2 30 ASN HA 5.196 . 8.570 5.316 5.260 5.364 . 0 0 "[ . 1 . 2]" 1 1298 1 28 LEU HA 1 29 GLN H 3.523 . 5.075 3.550 3.533 3.564 . 0 0 "[ . 1 . 2]" 1 1299 2 28 LEU HA 2 29 GLN H 3.523 . 5.075 3.550 3.533 3.563 . 0 0 "[ . 1 . 2]" 1 1300 1 29 GLN H 1 29 GLN HG2 3.175 . 4.435 3.222 3.181 3.296 . 0 0 "[ . 1 . 2]" 1 1301 2 29 GLN H 2 29 GLN HG2 3.175 . 4.435 3.222 3.176 3.296 . 0 0 "[ . 1 . 2]" 1 1302 1 29 GLN H 1 29 GLN HG3 2.914 . 3.976 2.408 2.342 2.498 . 0 0 "[ . 1 . 2]" 1 1303 2 29 GLN H 2 29 GLN HG3 2.914 . 3.976 2.408 2.344 2.497 . 0 0 "[ . 1 . 2]" 1 1304 1 29 GLN H 1 29 GLN HB3 4.011 . 6.022 3.625 3.617 3.633 . 0 0 "[ . 1 . 2]" 1 1305 2 29 GLN H 2 29 GLN HB3 4.011 . 6.022 3.625 3.618 3.631 . 0 0 "[ . 1 . 2]" 1 1306 1 29 GLN H 1 29 GLN HB2 2.924 . 3.993 2.512 2.479 2.531 . 0 0 "[ . 1 . 2]" 1 1307 2 29 GLN H 2 29 GLN HB2 2.924 . 3.993 2.512 2.481 2.530 . 0 0 "[ . 1 . 2]" 1 1308 1 29 GLN H 1 36 VAL HB 4.274 . 6.557 3.472 3.281 3.706 . 0 0 "[ . 1 . 2]" 1 1309 2 29 GLN H 2 36 VAL HB 4.274 . 6.557 3.472 3.278 3.708 . 0 0 "[ . 1 . 2]" 1 1310 1 28 LEU H 1 29 GLN H 3.259 . 4.587 2.698 2.636 2.730 . 0 0 "[ . 1 . 2]" 1 1311 2 28 LEU H 2 29 GLN H 3.259 . 4.587 2.698 2.637 2.730 . 0 0 "[ . 1 . 2]" 1 1312 1 29 GLN H 1 29 GLN HE22 5.353 . 8.935 5.815 5.606 5.971 . 0 0 "[ . 1 . 2]" 1 1313 2 29 GLN H 2 29 GLN HE22 5.353 . 8.935 5.816 5.606 5.973 . 0 0 "[ . 1 . 2]" 1 1314 1 28 LEU HG 1 29 GLN H 4.042 . 6.084 4.242 4.112 4.367 . 0 0 "[ . 1 . 2]" 1 1315 2 28 LEU HG 2 29 GLN H 4.042 . 6.084 4.242 4.115 4.366 . 0 0 "[ . 1 . 2]" 1 1316 1 27 TYR HD2 1 29 GLN H 5.544 . 9.386 6.152 5.890 6.517 . 0 0 "[ . 1 . 2]" 1 1317 2 27 TYR HD2 2 29 GLN H 5.544 . 9.386 6.152 5.888 6.519 . 0 0 "[ . 1 . 2]" 1 1318 1 29 GLN H 1 37 ASN H 5.265 . 8.731 7.566 7.386 7.820 . 0 0 "[ . 1 . 2]" 1 1319 2 29 GLN H 2 37 ASN H 5.265 . 8.731 7.566 7.390 7.821 . 0 0 "[ . 1 . 2]" 1 1320 1 29 GLN HE21 1 35 THR HA 4.426 . 6.875 4.764 4.460 5.244 . 0 0 "[ . 1 . 2]" 1 1321 2 29 GLN HE21 2 35 THR HA 4.426 . 6.875 4.763 4.464 5.252 . 0 0 "[ . 1 . 2]" 1 1322 1 29 GLN HE21 1 35 THR HB 5.367 . 8.968 7.151 6.662 7.919 . 0 0 "[ . 1 . 2]" 1 1323 2 29 GLN HE21 2 35 THR HB 5.367 . 8.968 7.149 6.662 7.918 . 0 0 "[ . 1 . 2]" 1 1324 1 29 GLN HB3 1 29 GLN HE21 4.661 . 7.377 4.204 3.771 4.405 . 0 0 "[ . 1 . 2]" 1 1325 2 29 GLN HB3 2 29 GLN HE21 4.661 . 7.377 4.205 3.763 4.410 . 0 0 "[ . 1 . 2]" 1 1326 1 25 GLU HB3 1 29 GLN HE21 5.257 . 8.711 3.000 2.742 3.339 . 0 0 "[ . 1 . 2]" 1 1327 2 25 GLU HB3 2 29 GLN HE21 5.257 . 8.711 3.003 2.740 3.350 . 0 0 "[ . 1 . 2]" 1 1328 1 29 GLN HB2 1 29 GLN HE21 5.013 . 8.154 3.795 3.023 4.139 . 0 0 "[ . 1 . 2]" 1 1329 2 29 GLN HB2 2 29 GLN HE21 5.013 . 8.154 3.797 3.023 4.145 . 0 0 "[ . 1 . 2]" 1 1330 1 29 GLN HE21 1 36 VAL HB 5.710 . 9.786 3.559 3.207 4.163 . 0 0 "[ . 1 . 2]" 1 1331 2 29 GLN HE21 2 36 VAL HB 5.710 . 9.786 3.559 3.203 4.163 . 0 0 "[ . 1 . 2]" 1 1332 1 29 GLN HE21 1 35 THR MG 3.405 . 4.854 4.499 4.021 5.249 0.395 17 0 "[ . 1 . 2]" 1 1333 2 29 GLN HE21 2 35 THR MG 3.405 . 4.854 4.496 4.017 5.253 0.399 17 0 "[ . 1 . 2]" 1 1334 1 29 GLN HE21 1 36 VAL MG2 6.192 . 10.985 4.764 4.511 5.183 . 0 0 "[ . 1 . 2]" 1 1335 2 29 GLN HE21 2 36 VAL MG2 6.192 . 10.985 4.763 4.516 5.181 . 0 0 "[ . 1 . 2]" 1 1336 1 29 GLN HE21 1 36 VAL MG1 5.831 . 10.081 4.449 4.060 5.131 . 0 0 "[ . 1 . 2]" 1 1337 2 29 GLN HE21 2 36 VAL MG1 5.831 . 10.081 4.449 4.060 5.134 . 0 0 "[ . 1 . 2]" 1 1338 1 26 SER HA 1 29 GLN HE21 5.439 . 9.137 3.923 2.960 4.706 . 0 0 "[ . 1 . 2]" 1 1339 2 26 SER HA 2 29 GLN HE21 5.439 . 9.137 3.924 2.976 4.712 . 0 0 "[ . 1 . 2]" 1 1340 1 29 GLN HE21 1 36 VAL H 3.847 . 5.697 3.386 2.931 4.207 . 0 0 "[ . 1 . 2]" 1 1341 2 29 GLN HE21 2 36 VAL H 3.847 . 5.697 3.383 2.931 4.216 . 0 0 "[ . 1 . 2]" 1 1342 1 26 SER HA 1 29 GLN HE22 4.217 . 6.440 4.869 4.486 5.487 . 0 0 "[ . 1 . 2]" 1 1343 2 26 SER HA 2 29 GLN HE22 4.217 . 6.440 4.868 4.500 5.497 . 0 0 "[ . 1 . 2]" 1 1344 1 29 GLN HE22 1 29 GLN HG3 2.872 . 3.903 3.507 3.495 3.522 . 0 0 "[ . 1 . 2]" 1 1345 2 29 GLN HE22 2 29 GLN HG3 2.872 . 3.903 3.507 3.494 3.521 . 0 0 "[ . 1 . 2]" 1 1346 1 29 GLN HB3 1 29 GLN HE22 4.716 . 7.496 4.430 4.189 4.569 . 0 0 "[ . 1 . 2]" 1 1347 2 29 GLN HB3 2 29 GLN HE22 4.716 . 7.496 4.431 4.186 4.569 . 0 0 "[ . 1 . 2]" 1 1348 1 25 GLU HB3 1 29 GLN HE22 3.377 . 4.802 4.414 4.253 4.552 . 0 0 "[ . 1 . 2]" 1 1349 2 25 GLU HB3 2 29 GLN HE22 3.377 . 4.802 4.416 4.250 4.538 . 0 0 "[ . 1 . 2]" 1 1350 1 29 GLN HE22 1 36 VAL HB 4.360 . 6.737 4.808 4.679 5.040 . 0 0 "[ . 1 . 2]" 1 1351 2 29 GLN HE22 2 36 VAL HB 4.360 . 6.737 4.809 4.687 5.041 . 0 0 "[ . 1 . 2]" 1 1352 1 29 GLN HE22 1 35 THR MG 4.026 . 6.053 3.814 3.389 4.256 . 0 0 "[ . 1 . 2]" 1 1353 2 29 GLN HE22 2 35 THR MG 4.026 . 6.053 3.814 3.390 4.255 . 0 0 "[ . 1 . 2]" 1 1354 1 29 GLN HE22 1 35 THR HB 5.989 . 10.473 6.709 6.299 7.112 . 0 0 "[ . 1 . 2]" 1 1355 2 29 GLN HE22 2 35 THR HB 5.989 . 10.473 6.709 6.303 7.107 . 0 0 "[ . 1 . 2]" 1 1356 1 29 GLN HE22 1 36 VAL MG2 5.066 . 8.274 5.577 5.437 5.778 . 0 0 "[ . 1 . 2]" 1 1357 2 29 GLN HE22 2 36 VAL MG2 5.066 . 8.274 5.578 5.444 5.776 . 0 0 "[ . 1 . 2]" 1 1358 1 29 GLN HE22 1 37 ASN H 5.021 . 8.173 6.718 6.376 7.182 . 0 0 "[ . 1 . 2]" 1 1359 2 29 GLN HE22 2 37 ASN H 5.021 . 8.173 6.719 6.382 7.184 . 0 0 "[ . 1 . 2]" 1 1360 1 29 GLN HE22 1 30 ASN H 6.097 . 10.744 7.129 6.690 7.432 . 0 0 "[ . 1 . 2]" 1 1361 2 29 GLN HE22 2 30 ASN H 6.097 . 10.744 7.128 6.699 7.431 . 0 0 "[ . 1 . 2]" 1 1362 1 29 GLN HE22 1 36 VAL H 3.662 . 5.338 3.620 3.333 3.968 . 0 0 "[ . 1 . 2]" 1 1363 2 29 GLN HE22 2 36 VAL H 3.662 . 5.338 3.621 3.316 3.976 . 0 0 "[ . 1 . 2]" 1 1364 1 25 GLU HG2 1 29 GLN HE22 4.391 . 6.801 6.366 5.940 6.568 . 0 0 "[ . 1 . 2]" 1 1365 2 25 GLU HG2 2 29 GLN HE22 4.391 . 6.801 6.368 5.951 6.578 . 0 0 "[ . 1 . 2]" 1 1366 1 28 LEU HA 1 30 ASN H 4.072 . 6.144 4.358 4.053 4.569 . 0 0 "[ . 1 . 2]" 1 1367 2 28 LEU HA 2 30 ASN H 4.072 . 6.144 4.360 4.055 4.571 . 0 0 "[ . 1 . 2]" 1 1368 1 27 TYR HB2 1 30 ASN H 5.456 . 9.177 5.861 5.684 5.995 . 0 0 "[ . 1 . 2]" 1 1369 2 27 TYR HB2 2 30 ASN H 5.456 . 9.177 5.863 5.684 5.998 . 0 0 "[ . 1 . 2]" 1 1370 1 29 GLN HA 1 30 ASN H 3.974 . 5.948 3.524 3.464 3.549 . 0 0 "[ . 1 . 2]" 1 1371 2 29 GLN HA 2 30 ASN H 3.974 . 5.948 3.523 3.465 3.548 . 0 0 "[ . 1 . 2]" 1 1372 1 27 TYR HA 1 30 ASN H 3.446 . 4.931 3.586 3.449 3.730 . 0 0 "[ . 1 . 2]" 1 1373 2 27 TYR HA 2 30 ASN H 3.446 . 4.931 3.589 3.450 3.731 . 0 0 "[ . 1 . 2]" 1 1374 1 30 ASN H 1 30 ASN HB2 2.403 . 3.125 2.361 2.304 2.420 . 0 0 "[ . 1 . 2]" 1 1375 2 30 ASN H 2 30 ASN HB2 2.403 . 3.125 2.361 2.300 2.421 . 0 0 "[ . 1 . 2]" 1 1376 1 30 ASN H 1 30 ASN HB3 3.599 . 5.218 3.590 3.572 3.625 . 0 0 "[ . 1 . 2]" 1 1377 2 30 ASN H 2 30 ASN HB3 3.599 . 5.218 3.590 3.569 3.624 . 0 0 "[ . 1 . 2]" 1 1378 1 29 GLN HG3 1 30 ASN H 4.314 . 6.640 4.394 4.292 4.517 . 0 0 "[ . 1 . 2]" 1 1379 2 29 GLN HG3 2 30 ASN H 4.314 . 6.640 4.393 4.289 4.516 . 0 0 "[ . 1 . 2]" 1 1380 1 29 GLN HB3 1 30 ASN H 4.031 . 6.063 3.652 3.513 3.942 . 0 0 "[ . 1 . 2]" 1 1381 2 29 GLN HB3 2 30 ASN H 4.031 . 6.063 3.650 3.503 3.942 . 0 0 "[ . 1 . 2]" 1 1382 1 29 GLN HB2 1 30 ASN H 2.828 . 3.828 2.682 2.530 3.028 . 0 0 "[ . 1 . 2]" 1 1383 2 29 GLN HB2 2 30 ASN H 2.828 . 3.828 2.681 2.531 3.028 . 0 0 "[ . 1 . 2]" 1 1384 1 27 TYR HB3 1 30 ASN H 5.711 . 9.789 5.732 5.578 5.841 . 0 0 "[ . 1 . 2]" 1 1385 2 27 TYR HB3 2 30 ASN H 5.711 . 9.789 5.733 5.580 5.844 . 0 0 "[ . 1 . 2]" 1 1386 1 30 ASN H 1 31 TYR HD2 6.365 . 11.430 7.329 7.145 7.486 . 0 0 "[ . 1 . 2]" 1 1387 2 30 ASN H 2 31 TYR HD2 6.365 . 11.430 7.329 7.143 7.487 . 0 0 "[ . 1 . 2]" 1 1388 1 29 GLN HE21 1 30 ASN H 6.635 . 12.138 6.250 5.477 6.656 . 0 0 "[ . 1 . 2]" 1 1389 2 29 GLN HE21 2 30 ASN H 6.635 . 12.138 6.251 5.490 6.664 . 0 0 "[ . 1 . 2]" 1 1390 1 27 TYR HE2 1 30 ASN H 5.216 . 8.617 7.884 7.478 8.254 . 0 0 "[ . 1 . 2]" 1 1391 2 27 TYR HE2 2 30 ASN H 5.216 . 8.617 7.886 7.477 8.267 . 0 0 "[ . 1 . 2]" 1 1392 1 30 ASN H 1 33 GLY H 4.480 . 6.988 4.605 4.403 4.742 . 0 0 "[ . 1 . 2]" 1 1393 2 30 ASN H 2 33 GLY H 4.480 . 6.988 4.603 4.406 4.743 . 0 0 "[ . 1 . 2]" 1 1394 1 29 GLN H 1 30 ASN H 2.901 . 3.953 2.713 2.650 2.785 . 0 0 "[ . 1 . 2]" 1 1395 2 29 GLN H 2 30 ASN H 2.901 . 3.953 2.713 2.647 2.789 . 0 0 "[ . 1 . 2]" 1 1396 1 30 ASN H 1 32 PHE H 4.711 . 7.485 4.532 4.330 4.687 . 0 0 "[ . 1 . 2]" 1 1397 2 30 ASN H 2 32 PHE H 4.711 . 7.485 4.533 4.320 4.693 . 0 0 "[ . 1 . 2]" 1 1398 1 28 LEU H 1 30 ASN H 4.413 . 6.847 4.176 3.964 4.305 . 0 0 "[ . 1 . 2]" 1 1399 2 28 LEU H 2 30 ASN H 4.413 . 6.847 4.177 3.964 4.310 . 0 0 "[ . 1 . 2]" 1 1400 1 30 ASN H 1 31 TYR H 2.891 . 3.936 2.450 2.318 2.531 . 0 0 "[ . 1 . 2]" 1 1401 2 30 ASN H 2 31 TYR H 2.891 . 3.936 2.451 2.320 2.531 . 0 0 "[ . 1 . 2]" 1 1402 1 30 ASN H 1 30 ASN HD21 4.636 . 7.322 3.589 2.621 3.930 . 0 0 "[ . 1 . 2]" 1 1403 2 30 ASN H 2 30 ASN HD21 4.636 . 7.322 3.589 2.607 3.927 . 0 0 "[ . 1 . 2]" 1 1404 1 30 ASN HA 1 30 ASN HD22 5.163 . 8.496 4.528 4.167 4.655 . 0 0 "[ . 1 . 2]" 1 1405 2 30 ASN HA 2 30 ASN HD22 5.163 . 8.496 4.528 4.168 4.649 . 0 0 "[ . 1 . 2]" 1 1406 1 26 SER HA 1 30 ASN HD22 4.498 . 7.027 4.822 4.432 5.243 . 0 0 "[ . 1 . 2]" 1 1407 2 26 SER HA 2 30 ASN HD22 4.498 . 7.027 4.821 4.433 5.247 . 0 0 "[ . 1 . 2]" 1 1408 1 30 ASN HB2 1 30 ASN HD22 2.810 . 3.797 3.493 3.480 3.506 . 0 0 "[ . 1 . 2]" 1 1409 2 30 ASN HB2 2 30 ASN HD22 2.810 . 3.797 3.493 3.485 3.499 . 0 0 "[ . 1 . 2]" 1 1410 1 30 ASN HB3 1 30 ASN HD22 3.633 . 5.282 3.836 3.770 4.050 . 0 0 "[ . 1 . 2]" 1 1411 2 30 ASN HB3 2 30 ASN HD22 3.633 . 5.282 3.835 3.771 4.049 . 0 0 "[ . 1 . 2]" 1 1412 1 29 GLN HB2 1 30 ASN HD22 4.701 . 7.464 4.779 4.115 5.028 . 0 0 "[ . 1 . 2]" 1 1413 2 29 GLN HB2 2 30 ASN HD22 4.701 . 7.464 4.779 4.109 5.020 . 0 0 "[ . 1 . 2]" 1 1414 1 32 PHE H 1 32 PHE HB2 3.641 . 5.299 3.156 2.679 3.627 . 0 0 "[ . 1 . 2]" 1 1415 2 32 PHE H 2 32 PHE HB2 3.641 . 5.299 3.155 2.674 3.626 . 0 0 "[ . 1 . 2]" 1 1416 1 29 GLN HG3 1 32 PHE H 5.408 . 9.064 6.992 6.709 7.235 . 0 0 "[ . 1 . 2]" 1 1417 2 29 GLN HG3 2 32 PHE H 5.408 . 9.064 6.992 6.708 7.235 . 0 0 "[ . 1 . 2]" 1 1418 1 30 ASN HA 1 32 PHE H 5.233 . 8.656 4.737 4.537 4.998 . 0 0 "[ . 1 . 2]" 1 1419 2 30 ASN HA 2 32 PHE H 5.233 . 8.656 4.738 4.531 5.000 . 0 0 "[ . 1 . 2]" 1 1420 1 31 TYR HA 1 32 PHE H 3.912 . 5.825 3.591 3.570 3.607 . 0 0 "[ . 1 . 2]" 1 1421 2 31 TYR HA 2 32 PHE H 3.912 . 5.825 3.591 3.569 3.605 . 0 0 "[ . 1 . 2]" 1 1422 1 31 TYR HB2 1 32 PHE H 3.698 . 5.408 3.711 3.510 3.876 . 0 0 "[ . 1 . 2]" 1 1423 2 31 TYR HB2 2 32 PHE H 3.698 . 5.408 3.710 3.508 3.876 . 0 0 "[ . 1 . 2]" 1 1424 1 32 PHE H 1 63 LEU QD 4.109 . 6.219 4.934 4.135 6.154 . 0 0 "[ . 1 . 2]" 1 1425 2 32 PHE H 2 63 LEU QD 4.109 . 6.219 4.934 4.137 6.153 . 0 0 "[ . 1 . 2]" 1 1426 1 32 PHE H 1 60 ILE MG 4.413 . 6.848 6.312 5.905 6.755 . 0 0 "[ . 1 . 2]" 1 1427 2 32 PHE H 2 60 ILE MG 4.413 . 6.848 6.312 5.901 6.761 . 0 0 "[ . 1 . 2]" 1 1428 1 32 PHE H 1 32 PHE HD2 3.960 . 5.921 3.689 2.958 4.050 . 0 0 "[ . 1 . 2]" 1 1429 2 32 PHE H 2 32 PHE HD2 3.960 . 5.921 3.689 2.960 4.051 . 0 0 "[ . 1 . 2]" 1 1430 1 32 PHE H 1 32 PHE HE2 4.702 . 7.466 4.895 4.577 5.060 . 0 0 "[ . 1 . 2]" 1 1431 2 32 PHE H 2 32 PHE HE2 4.702 . 7.466 4.894 4.577 5.060 . 0 0 "[ . 1 . 2]" 1 1432 1 31 TYR HD2 1 32 PHE H 4.677 . 7.411 4.005 3.536 4.450 . 0 0 "[ . 1 . 2]" 1 1433 2 31 TYR HD2 2 32 PHE H 4.677 . 7.411 4.004 3.538 4.446 . 0 0 "[ . 1 . 2]" 1 1434 1 30 ASN HA 1 33 GLY H 3.680 . 5.373 3.440 3.211 3.671 . 0 0 "[ . 1 . 2]" 1 1435 2 30 ASN HA 2 33 GLY H 3.680 . 5.373 3.440 3.209 3.670 . 0 0 "[ . 1 . 2]" 1 1436 1 32 PHE HA 1 33 GLY H 3.542 . 5.110 3.249 3.125 3.415 . 0 0 "[ . 1 . 2]" 1 1437 2 32 PHE HA 2 33 GLY H 3.542 . 5.110 3.250 3.124 3.417 . 0 0 "[ . 1 . 2]" 1 1438 1 33 GLY H 1 33 GLY HA3 2.712 . 3.631 2.822 2.760 2.891 . 0 0 "[ . 1 . 2]" 1 1439 2 33 GLY H 2 33 GLY HA3 2.712 . 3.631 2.822 2.760 2.892 . 0 0 "[ . 1 . 2]" 1 1440 1 32 PHE HB3 1 33 GLY H 5.005 . 8.136 4.482 4.287 4.632 . 0 0 "[ . 1 . 2]" 1 1441 2 32 PHE HB3 2 33 GLY H 5.005 . 8.136 4.482 4.280 4.633 . 0 0 "[ . 1 . 2]" 1 1442 1 30 ASN HB2 1 33 GLY H 4.848 . 7.786 5.469 5.353 5.625 . 0 0 "[ . 1 . 2]" 1 1443 2 30 ASN HB2 2 33 GLY H 4.848 . 7.786 5.468 5.345 5.626 . 0 0 "[ . 1 . 2]" 1 1444 1 32 PHE HB2 1 33 GLY H 4.119 . 6.240 3.728 3.206 4.208 . 0 0 "[ . 1 . 2]" 1 1445 2 32 PHE HB2 2 33 GLY H 4.119 . 6.240 3.725 3.190 4.209 . 0 0 "[ . 1 . 2]" 1 1446 1 29 GLN HG3 1 33 GLY H 5.657 . 9.657 7.327 7.129 7.563 . 0 0 "[ . 1 . 2]" 1 1447 2 29 GLN HG3 2 33 GLY H 5.657 . 9.657 7.324 7.127 7.553 . 0 0 "[ . 1 . 2]" 1 1448 1 29 GLN HB2 1 33 GLY H 5.175 . 8.523 6.022 5.876 6.228 . 0 0 "[ . 1 . 2]" 1 1449 2 29 GLN HB2 2 33 GLY H 5.175 . 8.523 6.018 5.873 6.232 . 0 0 "[ . 1 . 2]" 1 1450 1 31 TYR HD2 1 33 GLY H 5.789 . 9.978 5.993 5.537 6.386 . 0 0 "[ . 1 . 2]" 1 1451 2 31 TYR HD2 2 33 GLY H 5.789 . 9.978 5.993 5.537 6.387 . 0 0 "[ . 1 . 2]" 1 1452 1 32 PHE H 1 33 GLY H 3.021 . 4.162 2.314 2.207 2.396 . 0 0 "[ . 1 . 2]" 1 1453 2 32 PHE H 2 33 GLY H 3.021 . 4.162 2.314 2.207 2.398 . 0 0 "[ . 1 . 2]" 1 1454 1 31 TYR H 1 33 GLY H 4.085 . 6.171 3.550 3.442 3.623 . 0 0 "[ . 1 . 2]" 1 1455 2 31 TYR H 2 33 GLY H 4.085 . 6.171 3.547 3.434 3.623 . 0 0 "[ . 1 . 2]" 1 1456 1 34 THR H 1 34 THR HA 2.869 . 3.898 2.899 2.855 2.925 . 0 0 "[ . 1 . 2]" 1 1457 2 34 THR H 2 34 THR HA 2.869 . 3.898 2.899 2.854 2.924 . 0 0 "[ . 1 . 2]" 1 1458 1 30 ASN HA 1 34 THR H 4.351 . 6.717 4.447 4.244 4.781 . 0 0 "[ . 1 . 2]" 1 1459 2 30 ASN HA 2 34 THR H 4.351 . 6.717 4.446 4.250 4.780 . 0 0 "[ . 1 . 2]" 1 1460 1 32 PHE HA 1 34 THR H 4.333 . 6.680 5.098 4.826 5.423 . 0 0 "[ . 1 . 2]" 1 1461 2 32 PHE HA 2 34 THR H 4.333 . 6.680 5.100 4.819 5.432 . 0 0 "[ . 1 . 2]" 1 1462 1 34 THR H 1 34 THR HB 2.715 . 3.636 3.234 3.120 3.370 . 0 0 "[ . 1 . 2]" 1 1463 2 34 THR H 2 34 THR HB 2.715 . 3.636 3.236 3.122 3.368 . 0 0 "[ . 1 . 2]" 1 1464 1 33 GLY HA2 1 34 THR H 3.726 . 5.461 2.774 2.645 2.937 . 0 0 "[ . 1 . 2]" 1 1465 2 33 GLY HA2 2 34 THR H 3.726 . 5.461 2.772 2.643 2.927 . 0 0 "[ . 1 . 2]" 1 1466 1 32 PHE HB3 1 34 THR H 4.752 . 7.574 5.272 4.538 6.147 . 0 0 "[ . 1 . 2]" 1 1467 2 32 PHE HB3 2 34 THR H 4.752 . 7.574 5.274 4.534 6.159 . 0 0 "[ . 1 . 2]" 1 1468 1 29 GLN HG2 1 34 THR H 4.314 . 6.640 4.854 4.445 5.042 . 0 0 "[ . 1 . 2]" 1 1469 2 29 GLN HG2 2 34 THR H 4.314 . 6.640 4.852 4.442 5.044 . 0 0 "[ . 1 . 2]" 1 1470 1 32 PHE HB2 1 34 THR H 3.417 . 4.877 3.854 3.123 5.032 0.155 11 0 "[ . 1 . 2]" 1 1471 2 32 PHE HB2 2 34 THR H 3.417 . 4.877 3.855 3.133 5.045 0.168 11 0 "[ . 1 . 2]" 1 1472 1 29 GLN HG3 1 34 THR H 5.143 . 8.449 6.068 5.734 6.252 . 0 0 "[ . 1 . 2]" 1 1473 2 29 GLN HG3 2 34 THR H 5.143 . 8.449 6.066 5.732 6.245 . 0 0 "[ . 1 . 2]" 1 1474 1 29 GLN HB3 1 34 THR H 4.074 . 6.149 3.989 3.840 4.171 . 0 0 "[ . 1 . 2]" 1 1475 2 29 GLN HB3 2 34 THR H 4.074 . 6.149 3.987 3.831 4.160 . 0 0 "[ . 1 . 2]" 1 1476 1 29 GLN HB2 1 34 THR H 4.774 . 7.623 5.214 5.088 5.385 . 0 0 "[ . 1 . 2]" 1 1477 2 29 GLN HB2 2 34 THR H 4.774 . 7.623 5.212 5.079 5.374 . 0 0 "[ . 1 . 2]" 1 1478 1 34 THR H 1 34 THR MG 2.403 . 6.000 2.482 2.331 2.650 . 0 0 "[ . 1 . 2]" 1 1479 2 34 THR H 2 34 THR MG 2.403 . 6.000 2.484 2.325 2.657 . 0 0 "[ . 1 . 2]" 1 1480 1 34 THR H 1 60 ILE MD 4.128 . 6.258 5.444 4.902 5.795 . 0 0 "[ . 1 . 2]" 1 1481 2 34 THR H 2 60 ILE MD 4.128 . 6.258 5.445 4.907 5.794 . 0 0 "[ . 1 . 2]" 1 1482 1 34 THR H 1 49 ILE MG 3.970 . 5.940 5.123 4.943 5.246 . 0 0 "[ . 1 . 2]" 1 1483 2 34 THR H 2 49 ILE MG 3.970 . 5.940 5.124 4.947 5.244 . 0 0 "[ . 1 . 2]" 1 1484 1 32 PHE HD2 1 34 THR H 4.548 . 7.133 4.278 3.930 4.898 . 0 0 "[ . 1 . 2]" 1 1485 2 32 PHE HD2 2 34 THR H 4.548 . 7.133 4.280 3.934 4.901 . 0 0 "[ . 1 . 2]" 1 1486 1 32 PHE HE2 1 34 THR H 5.039 . 8.213 6.030 4.938 7.229 . 0 0 "[ . 1 . 2]" 1 1487 2 32 PHE HE2 2 34 THR H 5.039 . 8.213 6.032 4.943 7.230 . 0 0 "[ . 1 . 2]" 1 1488 1 32 PHE H 1 34 THR H 3.788 . 5.582 3.903 3.671 4.298 . 0 0 "[ . 1 . 2]" 1 1489 2 32 PHE H 2 34 THR H 3.788 . 5.582 3.906 3.668 4.300 . 0 0 "[ . 1 . 2]" 1 1490 1 31 TYR H 1 34 THR H 4.965 . 8.046 5.141 4.977 5.350 . 0 0 "[ . 1 . 2]" 1 1491 2 31 TYR H 2 34 THR H 4.965 . 8.046 5.139 4.971 5.337 . 0 0 "[ . 1 . 2]" 1 1492 1 33 GLY H 1 34 THR H 2.786 . 3.757 2.738 2.470 2.995 . 0 0 "[ . 1 . 2]" 1 1493 2 33 GLY H 2 34 THR H 2.786 . 3.757 2.736 2.464 2.993 . 0 0 "[ . 1 . 2]" 1 1494 1 35 THR H 1 50 GLU HB3 3.688 . 5.388 4.629 4.028 5.322 . 0 0 "[ . 1 . 2]" 1 1495 2 35 THR H 2 50 GLU HB3 3.688 . 5.388 4.629 4.023 5.329 . 0 0 "[ . 1 . 2]" 1 1496 1 35 THR H 1 36 VAL MG2 3.925 . 5.850 4.275 4.216 4.345 . 0 0 "[ . 1 . 2]" 1 1497 2 35 THR H 2 36 VAL MG2 3.925 . 5.850 4.276 4.222 4.341 . 0 0 "[ . 1 . 2]" 1 1498 1 35 THR H 1 60 ILE MD 4.617 . 7.282 5.110 4.713 5.681 . 0 0 "[ . 1 . 2]" 1 1499 2 35 THR H 2 60 ILE MD 4.617 . 7.282 5.110 4.713 5.683 . 0 0 "[ . 1 . 2]" 1 1500 1 35 THR H 1 49 ILE MG 4.180 . 6.364 4.649 4.331 5.022 . 0 0 "[ . 1 . 2]" 1 1501 2 35 THR H 2 49 ILE MG 4.180 . 6.364 4.649 4.333 5.021 . 0 0 "[ . 1 . 2]" 1 1502 1 35 THR H 1 35 THR HA 2.780 . 3.746 2.881 2.857 2.899 . 0 0 "[ . 1 . 2]" 1 1503 2 35 THR H 2 35 THR HA 2.780 . 3.746 2.881 2.857 2.897 . 0 0 "[ . 1 . 2]" 1 1504 1 35 THR H 1 35 THR HB 2.535 . 3.338 2.550 2.521 2.600 . 0 0 "[ . 1 . 2]" 1 1505 2 35 THR H 2 35 THR HB 2.535 . 3.338 2.551 2.522 2.608 . 0 0 "[ . 1 . 2]" 1 1506 1 35 THR H 1 35 THR MG 3.395 . 4.835 3.775 3.759 3.787 . 0 0 "[ . 1 . 2]" 1 1507 2 35 THR H 2 35 THR MG 3.395 . 4.835 3.775 3.762 3.786 . 0 0 "[ . 1 . 2]" 1 1508 1 34 THR MG 1 35 THR H 3.008 . 4.139 2.785 2.707 2.906 . 0 0 "[ . 1 . 2]" 1 1509 2 34 THR MG 2 35 THR H 3.008 . 4.139 2.786 2.707 2.906 . 0 0 "[ . 1 . 2]" 1 1510 1 35 THR HA 1 36 VAL H 2.651 . 3.529 2.174 2.136 2.228 . 0 0 "[ . 1 . 2]" 1 1511 2 35 THR HA 2 36 VAL H 2.651 . 3.529 2.174 2.141 2.226 . 0 0 "[ . 1 . 2]" 1 1512 1 29 GLN HG2 1 36 VAL H 2.858 . 3.879 2.134 1.975 2.329 . 0 0 "[ . 1 . 2]" 1 1513 2 29 GLN HG2 2 36 VAL H 2.858 . 3.879 2.135 1.974 2.330 . 0 0 "[ . 1 . 2]" 1 1514 1 29 GLN HG3 1 36 VAL H 4.079 . 6.159 3.397 3.260 3.562 . 0 0 "[ . 1 . 2]" 1 1515 2 29 GLN HG3 2 36 VAL H 4.079 . 6.159 3.397 3.263 3.564 . 0 0 "[ . 1 . 2]" 1 1516 1 29 GLN HB3 1 36 VAL H 4.350 . 6.715 4.109 3.965 4.320 . 0 0 "[ . 1 . 2]" 1 1517 2 29 GLN HB3 2 36 VAL H 4.350 . 6.715 4.111 3.981 4.316 . 0 0 "[ . 1 . 2]" 1 1518 1 36 VAL H 1 36 VAL HB 3.182 . 4.448 2.752 2.708 2.771 . 0 0 "[ . 1 . 2]" 1 1519 2 36 VAL H 2 36 VAL HB 3.182 . 4.448 2.753 2.715 2.771 . 0 0 "[ . 1 . 2]" 1 1520 1 36 VAL H 1 36 VAL MG2 3.092 . 4.287 2.985 2.898 3.060 . 0 0 "[ . 1 . 2]" 1 1521 2 36 VAL H 2 36 VAL MG2 3.092 . 4.287 2.985 2.905 3.062 . 0 0 "[ . 1 . 2]" 1 1522 1 36 VAL H 1 36 VAL MG1 3.677 . 5.367 3.873 3.849 3.892 . 0 0 "[ . 1 . 2]" 1 1523 2 36 VAL H 2 36 VAL MG1 3.677 . 5.367 3.873 3.852 3.895 . 0 0 "[ . 1 . 2]" 1 1524 1 36 VAL H 1 49 ILE MG 4.419 . 6.859 5.200 4.951 5.482 . 0 0 "[ . 1 . 2]" 1 1525 2 36 VAL H 2 49 ILE MG 4.419 . 6.859 5.201 4.954 5.482 . 0 0 "[ . 1 . 2]" 1 1526 1 29 GLN HB2 1 36 VAL H 5.391 . 9.024 4.879 4.726 5.088 . 0 0 "[ . 1 . 2]" 1 1527 2 29 GLN HB2 2 36 VAL H 5.391 . 9.024 4.879 4.735 5.088 . 0 0 "[ . 1 . 2]" 1 1528 1 37 ASN H 1 49 ILE HA 4.524 . 7.082 3.806 3.601 3.974 . 0 0 "[ . 1 . 2]" 1 1529 2 37 ASN H 2 49 ILE HA 4.524 . 7.082 3.806 3.599 3.975 . 0 0 "[ . 1 . 2]" 1 1530 1 29 GLN HG3 1 37 ASN H 5.302 . 8.815 6.184 5.993 6.344 . 0 0 "[ . 1 . 2]" 1 1531 2 29 GLN HG3 2 37 ASN H 5.302 . 8.815 6.184 5.991 6.342 . 0 0 "[ . 1 . 2]" 1 1532 1 37 ASN H 1 37 ASN QB 3.044 . 4.202 2.779 2.701 3.196 . 0 0 "[ . 1 . 2]" 1 1533 2 37 ASN H 2 37 ASN QB 3.044 . 4.202 2.779 2.695 3.198 . 0 0 "[ . 1 . 2]" 1 1534 1 25 GLU HG3 1 37 ASN H 5.085 . 8.318 6.532 6.249 6.747 . 0 0 "[ . 1 . 2]" 1 1535 2 25 GLU HG3 2 37 ASN H 5.085 . 8.318 6.531 6.246 6.752 . 0 0 "[ . 1 . 2]" 1 1536 1 37 ASN H 1 38 ILE HG13 3.732 . 5.473 4.573 4.409 4.728 . 0 0 "[ . 1 . 2]" 1 1537 2 37 ASN H 2 38 ILE HG13 3.732 . 5.473 4.573 4.409 4.726 . 0 0 "[ . 1 . 2]" 1 1538 1 36 VAL MG2 1 37 ASN H 3.689 . 5.390 3.953 3.889 4.063 . 0 0 "[ . 1 . 2]" 1 1539 2 36 VAL MG2 2 37 ASN H 3.689 . 5.390 3.953 3.888 4.062 . 0 0 "[ . 1 . 2]" 1 1540 1 36 VAL H 1 37 ASN H 4.413 . 6.848 4.299 4.195 4.354 . 0 0 "[ . 1 . 2]" 1 1541 2 36 VAL H 2 37 ASN H 4.413 . 6.848 4.299 4.192 4.350 . 0 0 "[ . 1 . 2]" 1 1542 1 37 ASN H 1 37 ASN HD22 4.680 . 7.418 4.586 3.947 4.921 . 0 0 "[ . 1 . 2]" 1 1543 2 37 ASN H 2 37 ASN HD22 4.680 . 7.418 4.588 3.948 4.914 . 0 0 "[ . 1 . 2]" 1 1544 1 36 VAL HA 1 37 ASN H 2.802 . 3.783 2.206 2.165 2.237 . 0 0 "[ . 1 . 2]" 1 1545 2 36 VAL HA 2 37 ASN H 2.802 . 3.783 2.206 2.162 2.232 . 0 0 "[ . 1 . 2]" 1 1546 1 37 ASN QB 1 37 ASN HD22 3.421 . 4.884 3.252 3.212 3.278 . 0 0 "[ . 1 . 2]" 1 1547 2 37 ASN QB 2 37 ASN HD22 3.421 . 4.884 3.253 3.211 3.278 . 0 0 "[ . 1 . 2]" 1 1548 1 37 ASN HD22 1 50 GLU HG3 4.349 . 6.714 4.110 3.251 4.491 . 0 0 "[ . 1 . 2]" 1 1549 2 37 ASN HD22 2 50 GLU HG3 4.349 . 6.714 4.110 3.258 4.489 . 0 0 "[ . 1 . 2]" 1 1550 1 37 ASN HD22 1 48 GLU QG 5.174 . 8.521 4.341 2.308 5.001 . 0 0 "[ . 1 . 2]" 1 1551 2 37 ASN HD22 2 48 GLU QG 5.174 . 8.521 4.342 2.303 5.009 . 0 0 "[ . 1 . 2]" 1 1552 1 37 ASN HD22 2 46 LYS QD 5.573 . 9.455 6.179 4.302 7.869 . 0 0 "[ . 1 . 2]" 1 1553 1 46 LYS QD 2 37 ASN HD22 5.573 . 9.455 6.180 4.298 7.869 . 0 0 "[ . 1 . 2]" 1 1554 1 37 ASN HA 1 37 ASN HD22 5.122 . 8.402 4.597 4.459 5.173 . 0 0 "[ . 1 . 2]" 1 1555 2 37 ASN HA 2 37 ASN HD22 5.122 . 8.402 4.598 4.453 5.172 . 0 0 "[ . 1 . 2]" 1 1556 1 37 ASN QB 1 37 ASN HD21 2.729 . 3.660 2.142 2.104 2.188 . 0 0 "[ . 1 . 2]" 1 1557 2 37 ASN QB 2 37 ASN HD21 2.729 . 3.660 2.141 2.102 2.187 . 0 0 "[ . 1 . 2]" 1 1558 1 37 ASN HD21 1 50 GLU HG2 4.757 . 7.586 4.183 3.406 4.850 . 0 0 "[ . 1 . 2]" 1 1559 2 37 ASN HD21 2 50 GLU HG2 4.757 . 7.586 4.184 3.410 4.856 . 0 0 "[ . 1 . 2]" 1 1560 1 37 ASN HD21 1 39 LYS HD2 5.893 . 10.234 7.246 6.068 7.982 . 0 0 "[ . 1 . 2]" 1 1561 2 37 ASN HD21 2 39 LYS HD2 5.893 . 10.234 7.246 6.061 7.976 . 0 0 "[ . 1 . 2]" 1 1562 1 37 ASN HD21 2 46 LYS QD 4.954 . 8.022 5.101 4.564 6.461 . 0 0 "[ . 1 . 2]" 1 1563 1 46 LYS QD 2 37 ASN HD21 4.954 . 8.022 5.100 4.577 6.458 . 0 0 "[ . 1 . 2]" 1 1564 1 37 ASN HD21 1 48 GLU QG 3.873 . 5.748 2.928 2.596 3.424 . 0 0 "[ . 1 . 2]" 1 1565 2 37 ASN HD21 2 48 GLU QG 3.873 . 5.748 2.928 2.594 3.431 . 0 0 "[ . 1 . 2]" 1 1566 1 37 ASN HA 1 37 ASN HD21 5.239 . 8.670 4.191 4.050 4.507 . 0 0 "[ . 1 . 2]" 1 1567 2 37 ASN HA 2 37 ASN HD21 5.239 . 8.670 4.193 4.055 4.508 . 0 0 "[ . 1 . 2]" 1 1568 1 37 ASN H 1 37 ASN HD21 4.662 . 7.379 3.540 3.252 4.241 . 0 0 "[ . 1 . 2]" 1 1569 2 37 ASN H 2 37 ASN HD21 4.662 . 7.379 3.543 3.248 4.233 . 0 0 "[ . 1 . 2]" 1 1570 1 38 ILE H 1 47 ILE HA 5.333 . 8.888 4.705 4.617 4.856 . 0 0 "[ . 1 . 2]" 1 1571 2 38 ILE H 2 47 ILE HA 5.333 . 8.888 4.706 4.615 4.859 . 0 0 "[ . 1 . 2]" 1 1572 1 37 ASN QB 1 38 ILE H 4.260 . 6.528 3.222 2.928 3.342 . 0 0 "[ . 1 . 2]" 1 1573 2 37 ASN QB 2 38 ILE H 4.260 . 6.528 3.222 2.928 3.344 . 0 0 "[ . 1 . 2]" 1 1574 1 25 GLU HG3 1 38 ILE H 3.808 . 5.621 3.898 3.671 4.179 . 0 0 "[ . 1 . 2]" 1 1575 2 25 GLU HG3 2 38 ILE H 3.808 . 5.621 3.899 3.677 4.186 . 0 0 "[ . 1 . 2]" 1 1576 1 25 GLU HB3 1 38 ILE H 4.523 . 7.080 4.536 4.349 4.986 . 0 0 "[ . 1 . 2]" 1 1577 2 25 GLU HB3 2 38 ILE H 4.523 . 7.080 4.537 4.354 5.000 . 0 0 "[ . 1 . 2]" 1 1578 1 25 GLU HB2 1 38 ILE H 4.631 . 7.311 5.093 4.890 5.345 . 0 0 "[ . 1 . 2]" 1 1579 2 25 GLU HB2 2 38 ILE H 4.631 . 7.311 5.093 4.889 5.354 . 0 0 "[ . 1 . 2]" 1 1580 1 25 GLU HG2 1 38 ILE H 3.479 . 4.992 3.070 2.817 3.407 . 0 0 "[ . 1 . 2]" 1 1581 2 25 GLU HG2 2 38 ILE H 3.479 . 4.992 3.073 2.805 3.418 . 0 0 "[ . 1 . 2]" 1 1582 1 38 ILE H 1 38 ILE HB 2.959 . 4.054 2.582 2.485 2.639 . 0 0 "[ . 1 . 2]" 1 1583 2 38 ILE H 2 38 ILE HB 2.959 . 4.054 2.582 2.485 2.640 . 0 0 "[ . 1 . 2]" 1 1584 1 38 ILE H 1 38 ILE HG12 3.939 . 5.879 3.821 3.736 3.910 . 0 0 "[ . 1 . 2]" 1 1585 2 38 ILE H 2 38 ILE HG12 3.939 . 5.879 3.821 3.732 3.912 . 0 0 "[ . 1 . 2]" 1 1586 1 38 ILE H 1 40 ARG HA 5.250 . 8.695 7.860 7.266 8.313 . 0 0 "[ . 1 . 2]" 1 1587 2 38 ILE H 2 40 ARG HA 5.250 . 8.695 7.860 7.263 8.317 . 0 0 "[ . 1 . 2]" 1 1588 1 38 ILE H 1 39 LYS QG 5.023 . 8.177 4.905 4.343 5.266 . 0 0 "[ . 1 . 2]" 1 1589 2 38 ILE H 2 39 LYS QG 5.023 . 8.177 4.904 4.342 5.272 . 0 0 "[ . 1 . 2]" 1 1590 1 38 ILE H 1 47 ILE MG 4.498 . 7.027 4.261 4.112 4.470 . 0 0 "[ . 1 . 2]" 1 1591 2 38 ILE H 2 47 ILE MG 4.498 . 7.027 4.263 4.112 4.476 . 0 0 "[ . 1 . 2]" 1 1592 1 38 ILE H 1 48 GLU H 5.057 . 8.254 4.891 4.807 5.020 . 0 0 "[ . 1 . 2]" 1 1593 2 38 ILE H 2 48 GLU H 5.057 . 8.254 4.892 4.809 5.021 . 0 0 "[ . 1 . 2]" 1 1594 1 37 ASN H 1 38 ILE H 4.403 . 6.826 4.204 4.157 4.263 . 0 0 "[ . 1 . 2]" 1 1595 2 37 ASN H 2 38 ILE H 4.403 . 6.826 4.205 4.155 4.262 . 0 0 "[ . 1 . 2]" 1 1596 1 37 ASN HA 1 38 ILE H 2.854 . 3.872 2.174 2.146 2.202 . 0 0 "[ . 1 . 2]" 1 1597 2 37 ASN HA 2 38 ILE H 2.854 . 3.872 2.175 2.148 2.200 . 0 0 "[ . 1 . 2]" 1 1598 1 36 VAL HA 1 38 ILE H 5.541 . 9.379 6.002 5.888 6.168 . 0 0 "[ . 1 . 2]" 1 1599 2 36 VAL HA 2 38 ILE H 5.541 . 9.379 6.003 5.883 6.170 . 0 0 "[ . 1 . 2]" 1 1600 1 37 ASN HD21 1 38 ILE H 6.273 . 11.192 5.945 5.703 6.159 . 0 0 "[ . 1 . 2]" 1 1601 2 37 ASN HD21 2 38 ILE H 6.273 . 11.192 5.946 5.699 6.162 . 0 0 "[ . 1 . 2]" 1 1602 1 39 LYS H 1 39 LYS HD2 5.325 . 8.870 4.628 4.119 4.877 . 0 0 "[ . 1 . 2]" 1 1603 2 39 LYS H 2 39 LYS HD2 5.325 . 8.870 4.627 4.112 4.871 . 0 0 "[ . 1 . 2]" 1 1604 1 38 ILE HA 1 39 LYS H 2.576 . 3.405 2.145 2.111 2.189 . 0 0 "[ . 1 . 2]" 1 1605 2 38 ILE HA 2 39 LYS H 2.576 . 3.405 2.146 2.111 2.189 . 0 0 "[ . 1 . 2]" 1 1606 1 39 LYS H 1 48 GLU QG 4.824 . 7.732 4.459 3.956 4.822 . 0 0 "[ . 1 . 2]" 1 1607 2 39 LYS H 2 48 GLU QG 4.824 . 7.732 4.461 3.948 4.815 . 0 0 "[ . 1 . 2]" 1 1608 1 38 ILE HB 1 39 LYS H 3.749 . 5.506 4.138 3.981 4.350 . 0 0 "[ . 1 . 2]" 1 1609 2 38 ILE HB 2 39 LYS H 3.749 . 5.506 4.138 3.978 4.353 . 0 0 "[ . 1 . 2]" 1 1610 1 39 LYS H 1 39 LYS HB3 3.784 . 5.574 3.683 3.623 3.751 . 0 0 "[ . 1 . 2]" 1 1611 2 39 LYS H 2 39 LYS HB3 3.784 . 5.574 3.683 3.621 3.751 . 0 0 "[ . 1 . 2]" 1 1612 1 39 LYS H 1 39 LYS HB2 2.708 . 3.624 2.550 2.485 2.654 . 0 0 "[ . 1 . 2]" 1 1613 2 39 LYS H 2 39 LYS HB2 2.708 . 3.624 2.550 2.482 2.650 . 0 0 "[ . 1 . 2]" 1 1614 1 39 LYS H 1 39 LYS HD3 3.734 . 5.477 4.040 3.576 5.190 . 0 0 "[ . 1 . 2]" 1 1615 2 39 LYS H 2 39 LYS HD3 3.734 . 5.477 4.039 3.571 5.192 . 0 0 "[ . 1 . 2]" 1 1616 1 39 LYS H 1 46 LYS QD 5.452 . 9.167 5.542 5.214 5.917 . 0 0 "[ . 1 . 2]" 1 1617 2 39 LYS H 2 46 LYS QD 5.452 . 9.167 5.543 5.214 5.918 . 0 0 "[ . 1 . 2]" 1 1618 1 39 LYS H 1 39 LYS HG2 3.179 . 4.442 2.880 2.392 4.166 . 0 0 "[ . 1 . 2]" 1 1619 2 39 LYS H 2 39 LYS HG2 3.179 . 4.442 2.880 2.392 4.164 . 0 0 "[ . 1 . 2]" 1 1620 1 39 LYS H 1 46 LYS QG 3.597 . 5.214 3.438 3.109 3.768 . 0 0 "[ . 1 . 2]" 1 1621 2 39 LYS H 2 46 LYS QG 3.597 . 5.214 3.439 3.108 3.769 . 0 0 "[ . 1 . 2]" 1 1622 1 39 LYS H 1 47 ILE MG 4.696 . 7.453 4.896 4.688 5.056 . 0 0 "[ . 1 . 2]" 1 1623 2 39 LYS H 2 47 ILE MG 4.696 . 7.453 4.896 4.688 5.055 . 0 0 "[ . 1 . 2]" 1 1624 1 39 LYS H 2 51 PHE QE 4.949 . 8.011 4.166 3.549 4.783 . 0 0 "[ . 1 . 2]" 1 1625 1 51 PHE HE2 2 39 LYS H 4.949 . 8.011 5.869 3.807 7.131 . 0 0 "[ . 1 . 2]" 1 1626 1 38 ILE H 1 39 LYS H 4.970 . 8.058 4.420 4.277 4.497 . 0 0 "[ . 1 . 2]" 1 1627 2 38 ILE H 2 39 LYS H 4.970 . 8.058 4.420 4.278 4.497 . 0 0 "[ . 1 . 2]" 1 1628 1 39 LYS H 1 48 GLU H 5.313 . 8.841 4.428 3.915 4.789 . 0 0 "[ . 1 . 2]" 1 1629 2 39 LYS H 2 48 GLU H 5.313 . 8.841 4.429 3.912 4.784 . 0 0 "[ . 1 . 2]" 1 1630 1 39 LYS QE 1 40 ARG H 6.583 . 12.001 6.003 5.621 6.901 . 0 0 "[ . 1 . 2]" 1 1631 2 39 LYS QE 2 40 ARG H 6.583 . 12.001 6.002 5.623 6.901 . 0 0 "[ . 1 . 2]" 1 1632 1 39 LYS HA 1 40 ARG H 2.283 . 2.935 2.159 2.110 2.232 . 0 0 "[ . 1 . 2]" 1 1633 2 39 LYS HA 2 40 ARG H 2.283 . 2.935 2.159 2.107 2.233 . 0 0 "[ . 1 . 2]" 1 1634 1 40 ARG H 1 40 ARG QD 4.283 . 6.575 3.844 2.468 4.319 . 0 0 "[ . 1 . 2]" 1 1635 2 40 ARG H 2 40 ARG QD 4.283 . 6.575 3.844 2.469 4.309 . 0 0 "[ . 1 . 2]" 1 1636 1 40 ARG H 1 40 ARG HB3 3.985 . 5.970 3.638 3.445 3.764 . 0 0 "[ . 1 . 2]" 1 1637 2 40 ARG H 2 40 ARG HB3 3.985 . 5.970 3.637 3.437 3.763 . 0 0 "[ . 1 . 2]" 1 1638 1 39 LYS HB3 1 40 ARG H 3.674 . 5.361 3.595 3.190 3.995 . 0 0 "[ . 1 . 2]" 1 1639 2 39 LYS HB3 2 40 ARG H 3.674 . 5.361 3.595 3.201 3.997 . 0 0 "[ . 1 . 2]" 1 1640 1 39 LYS QG 1 40 ARG H 4.349 . 6.713 4.647 4.074 4.900 . 0 0 "[ . 1 . 2]" 1 1641 2 39 LYS QG 2 40 ARG H 4.349 . 6.713 4.648 4.084 4.905 . 0 0 "[ . 1 . 2]" 1 1642 1 21 LEU QD 1 40 ARG H 4.850 . 7.790 5.547 4.827 6.899 . 0 0 "[ . 1 . 2]" 1 1643 2 21 LEU QD 2 40 ARG H 4.850 . 7.790 5.547 4.815 6.909 . 0 0 "[ . 1 . 2]" 1 1644 1 40 ARG H 1 41 GLN H 5.218 . 8.621 4.300 3.986 4.544 . 0 0 "[ . 1 . 2]" 1 1645 2 40 ARG H 2 41 GLN H 5.218 . 8.621 4.299 3.972 4.549 . 0 0 "[ . 1 . 2]" 1 1646 1 39 LYS H 1 40 ARG H 3.716 . 5.443 4.269 4.069 4.481 . 0 0 "[ . 1 . 2]" 1 1647 2 39 LYS H 2 40 ARG H 3.716 . 5.443 4.270 4.062 4.477 . 0 0 "[ . 1 . 2]" 1 1648 1 41 GLN H 1 45 GLY HA2 3.745 . 5.498 3.379 2.147 4.082 . 0 0 "[ . 1 . 2]" 1 1649 2 41 GLN H 2 45 GLY HA2 3.745 . 5.498 3.377 2.146 4.076 . 0 0 "[ . 1 . 2]" 1 1650 1 40 ARG QD 1 41 GLN H 5.887 . 7.324 3.949 3.602 4.909 . 0 0 "[ . 1 . 2]" 1 1651 2 40 ARG QD 2 41 GLN H 5.887 . 7.324 3.950 3.601 4.910 . 0 0 "[ . 1 . 2]" 1 1652 1 41 GLN H 1 44 LYS HB2 4.431 . 6.885 4.467 3.630 5.707 . 0 0 "[ . 1 . 2]" 1 1653 2 41 GLN H 2 44 LYS HB2 4.431 . 6.885 4.466 3.627 5.707 . 0 0 "[ . 1 . 2]" 1 1654 1 41 GLN H 1 45 GLY HA3 3.963 . 5.926 3.112 2.725 3.390 . 0 0 "[ . 1 . 2]" 1 1655 2 41 GLN H 2 45 GLY HA3 3.963 . 5.926 3.112 2.720 3.393 . 0 0 "[ . 1 . 2]" 1 1656 1 41 GLN H 1 41 GLN QG 3.759 . 5.525 2.993 2.604 3.238 . 0 0 "[ . 1 . 2]" 1 1657 2 41 GLN H 2 41 GLN QG 3.759 . 5.525 2.992 2.596 3.240 . 0 0 "[ . 1 . 2]" 1 1658 1 41 GLN H 1 41 GLN HB2 3.280 . 4.624 2.666 2.550 2.743 . 0 0 "[ . 1 . 2]" 1 1659 2 41 GLN H 2 41 GLN HB2 3.280 . 4.624 2.665 2.547 2.739 . 0 0 "[ . 1 . 2]" 1 1660 1 41 GLN H 1 44 LYS QG 5.417 . 9.085 5.524 4.623 6.200 . 0 0 "[ . 1 . 2]" 1 1661 2 41 GLN H 2 44 LYS QG 5.417 . 9.085 5.525 4.620 6.198 . 0 0 "[ . 1 . 2]" 1 1662 1 38 ILE MG 1 41 GLN H 5.521 . 9.332 5.451 4.820 5.921 . 0 0 "[ . 1 . 2]" 1 1663 2 38 ILE MG 2 41 GLN H 5.521 . 9.332 5.450 4.819 5.922 . 0 0 "[ . 1 . 2]" 1 1664 1 41 GLN H 2 51 PHE QE 5.897 . 10.243 4.593 4.002 5.041 . 0 0 "[ . 1 . 2]" 1 1665 1 51 PHE HE2 2 41 GLN H 5.897 . 10.243 5.193 4.195 7.144 . 0 0 "[ . 1 . 2]" 1 1666 1 41 GLN H 2 51 PHE HZ 5.538 . 9.372 5.064 3.822 5.777 . 0 0 "[ . 1 . 2]" 1 1667 1 51 PHE HZ 2 41 GLN H 5.538 . 9.372 5.072 3.853 5.791 . 0 0 "[ . 1 . 2]" 1 1668 1 39 LYS H 1 41 GLN H 5.864 . 10.163 6.291 5.576 6.628 . 0 0 "[ . 1 . 2]" 1 1669 2 39 LYS H 2 41 GLN H 5.864 . 10.163 6.289 5.574 6.628 . 0 0 "[ . 1 . 2]" 1 1670 1 41 GLN H 1 42 LYS H 3.891 . 5.784 3.430 2.913 4.502 . 0 0 "[ . 1 . 2]" 1 1671 2 41 GLN H 2 42 LYS H 3.891 . 5.784 3.432 2.909 4.498 . 0 0 "[ . 1 . 2]" 1 1672 1 41 GLN HB3 1 41 GLN HE21 5.135 . 8.431 4.327 4.042 4.496 . 0 0 "[ . 1 . 2]" 1 1673 2 41 GLN HB3 2 41 GLN HE21 5.135 . 8.431 4.329 4.049 4.502 . 0 0 "[ . 1 . 2]" 1 1674 1 39 LYS HB3 1 41 GLN HE21 5.439 . 9.137 3.284 2.875 3.884 . 0 0 "[ . 1 . 2]" 1 1675 2 39 LYS HB3 2 41 GLN HE21 5.439 . 9.137 3.285 2.868 3.883 . 0 0 "[ . 1 . 2]" 1 1676 1 39 LYS HD2 1 41 GLN HE21 5.047 . 8.232 4.559 3.840 5.381 . 0 0 "[ . 1 . 2]" 1 1677 2 39 LYS HD2 2 41 GLN HE21 5.047 . 8.232 4.559 3.843 5.382 . 0 0 "[ . 1 . 2]" 1 1678 1 41 GLN HE21 1 46 LYS QG 5.837 . 10.096 5.504 4.418 6.619 . 0 0 "[ . 1 . 2]" 1 1679 2 41 GLN HE21 2 46 LYS QG 5.837 . 10.096 5.502 4.398 6.624 . 0 0 "[ . 1 . 2]" 1 1680 1 41 GLN HE21 1 41 GLN QG 3.636 . 5.288 2.195 2.170 2.216 . 0 0 "[ . 1 . 2]" 1 1681 2 41 GLN HE21 2 41 GLN QG 3.636 . 5.288 2.196 2.178 2.210 . 0 0 "[ . 1 . 2]" 1 1682 1 41 GLN HE21 1 44 LYS HB2 5.281 . 8.767 7.170 6.234 9.046 0.279 13 0 "[ . 1 . 2]" 1 1683 2 41 GLN HE21 2 44 LYS HB2 5.281 . 8.767 7.170 6.246 9.039 0.272 13 0 "[ . 1 . 2]" 1 1684 1 39 LYS HB2 1 41 GLN HE21 5.955 . 10.387 4.534 3.614 5.416 . 0 0 "[ . 1 . 2]" 1 1685 2 39 LYS HB2 2 41 GLN HE21 5.955 . 10.387 4.534 3.610 5.415 . 0 0 "[ . 1 . 2]" 1 1686 1 41 GLN HE22 1 46 LYS QE 4.949 . 8.010 5.947 4.514 7.553 . 0 0 "[ . 1 . 2]" 1 1687 2 41 GLN HE22 2 46 LYS QE 4.949 . 8.010 5.949 4.534 7.546 . 0 0 "[ . 1 . 2]" 1 1688 1 41 GLN HA 1 41 GLN HE22 5.957 . 10.393 5.294 4.034 6.070 . 0 0 "[ . 1 . 2]" 1 1689 2 41 GLN HA 2 41 GLN HE22 5.957 . 10.393 5.294 4.035 6.068 . 0 0 "[ . 1 . 2]" 1 1690 1 39 LYS QE 1 41 GLN HE22 5.373 . 8.981 6.689 5.858 7.126 . 0 0 "[ . 1 . 2]" 1 1691 2 39 LYS QE 2 41 GLN HE22 5.373 . 8.981 6.690 5.857 7.126 . 0 0 "[ . 1 . 2]" 1 1692 1 41 GLN HE22 1 41 GLN QG 3.049 . 4.211 3.229 3.222 3.235 . 0 0 "[ . 1 . 2]" 1 1693 2 41 GLN HE22 2 41 GLN QG 3.049 . 4.211 3.229 3.222 3.235 . 0 0 "[ . 1 . 2]" 1 1694 1 41 GLN HB2 1 41 GLN HE22 5.299 . 8.809 4.884 4.477 5.360 . 0 0 "[ . 1 . 2]" 1 1695 2 41 GLN HB2 2 41 GLN HE22 5.299 . 8.809 4.885 4.481 5.361 . 0 0 "[ . 1 . 2]" 1 1696 1 41 GLN HB3 1 41 GLN HE22 5.276 . 8.755 4.608 4.439 4.751 . 0 0 "[ . 1 . 2]" 1 1697 2 41 GLN HB3 2 41 GLN HE22 5.276 . 8.755 4.608 4.439 4.754 . 0 0 "[ . 1 . 2]" 1 1698 1 41 GLN HE22 1 44 LYS HB2 5.942 . 10.355 7.440 6.574 9.951 . 0 0 "[ . 1 . 2]" 1 1699 2 41 GLN HE22 2 44 LYS HB2 5.942 . 10.355 7.440 6.564 9.952 . 0 0 "[ . 1 . 2]" 1 1700 1 39 LYS HB3 1 41 GLN HE22 3.785 . 5.576 4.551 4.070 5.222 . 0 0 "[ . 1 . 2]" 1 1701 2 39 LYS HB3 2 41 GLN HE22 3.785 . 5.576 4.553 4.076 5.210 . 0 0 "[ . 1 . 2]" 1 1702 1 39 LYS HB2 1 41 GLN HE22 4.804 . 7.689 5.638 4.919 6.341 . 0 0 "[ . 1 . 2]" 1 1703 2 39 LYS HB2 2 41 GLN HE22 4.804 . 7.689 5.641 4.920 6.347 . 0 0 "[ . 1 . 2]" 1 1704 1 39 LYS QG 1 41 GLN HE22 4.784 . 7.644 5.619 4.735 6.591 . 0 0 "[ . 1 . 2]" 1 1705 2 39 LYS QG 2 41 GLN HE22 4.784 . 7.644 5.621 4.745 6.580 . 0 0 "[ . 1 . 2]" 1 1706 1 39 LYS HD2 1 41 GLN HE22 4.457 . 6.940 5.482 4.708 6.949 0.009 10 0 "[ . 1 . 2]" 1 1707 2 39 LYS HD2 2 41 GLN HE22 4.457 . 6.940 5.485 4.712 6.951 0.011 10 0 "[ . 1 . 2]" 1 1708 1 41 GLN QG 1 42 LYS H 5.810 . 10.030 4.573 3.828 4.892 . 0 0 "[ . 1 . 2]" 1 1709 2 41 GLN QG 2 42 LYS H 5.810 . 10.030 4.573 3.834 4.892 . 0 0 "[ . 1 . 2]" 1 1710 1 41 GLN HB2 1 42 LYS H 4.974 . 8.067 4.339 2.730 4.518 . 0 0 "[ . 1 . 2]" 1 1711 2 41 GLN HB2 2 42 LYS H 4.974 . 8.067 4.340 2.740 4.514 . 0 0 "[ . 1 . 2]" 1 1712 1 42 LYS H 1 42 LYS QB 4.748 . 7.566 3.159 2.330 3.386 . 0 0 "[ . 1 . 2]" 1 1713 2 42 LYS H 2 42 LYS QB 4.748 . 7.566 3.160 2.337 3.383 . 0 0 "[ . 1 . 2]" 1 1714 1 42 LYS H 1 42 LYS QG 4.508 . 7.048 3.273 2.214 4.504 . 0 0 "[ . 1 . 2]" 1 1715 2 42 LYS H 2 42 LYS QG 4.508 . 7.048 3.272 2.213 4.504 . 0 0 "[ . 1 . 2]" 1 1716 1 41 GLN HA 1 42 LYS H 3.774 . 5.554 2.465 2.253 2.960 . 0 0 "[ . 1 . 2]" 1 1717 2 41 GLN HA 2 42 LYS H 3.774 . 5.554 2.464 2.247 2.958 . 0 0 "[ . 1 . 2]" 1 1718 1 42 LYS HA 1 43 LYS H 3.811 . 5.626 2.550 2.128 3.536 . 0 0 "[ . 1 . 2]" 1 1719 2 42 LYS HA 2 43 LYS H 3.811 . 5.626 2.550 2.126 3.536 . 0 0 "[ . 1 . 2]" 1 1720 1 42 LYS QB 1 43 LYS H 4.200 . 6.405 3.660 1.836 4.035 0.160 10 0 "[ . 1 . 2]" 1 1721 2 42 LYS QB 2 43 LYS H 4.200 . 6.405 3.661 1.840 4.035 0.155 10 0 "[ . 1 . 2]" 1 1722 1 43 LYS HA 1 44 LYS H 2.897 . 3.946 3.433 3.068 3.555 . 0 0 "[ . 1 . 2]" 1 1723 2 43 LYS HA 2 44 LYS H 2.897 . 3.946 3.433 3.068 3.553 . 0 0 "[ . 1 . 2]" 1 1724 1 42 LYS HA 1 44 LYS H 3.993 . 5.986 4.164 3.626 4.828 . 0 0 "[ . 1 . 2]" 1 1725 2 42 LYS HA 2 44 LYS H 3.993 . 5.986 4.164 3.630 4.827 . 0 0 "[ . 1 . 2]" 1 1726 1 40 ARG QD 1 44 LYS H 5.017 . 8.163 6.249 5.610 7.583 . 0 0 "[ . 1 . 2]" 1 1727 2 40 ARG QD 2 44 LYS H 5.017 . 8.163 6.251 5.607 7.591 . 0 0 "[ . 1 . 2]" 1 1728 1 41 GLN QG 1 44 LYS H 4.837 . 7.761 5.540 4.918 5.911 . 0 0 "[ . 1 . 2]" 1 1729 2 41 GLN QG 2 44 LYS H 4.837 . 7.761 5.541 4.917 5.906 . 0 0 "[ . 1 . 2]" 1 1730 1 42 LYS QB 1 44 LYS H 3.306 . 3.603 3.466 2.956 4.440 0.837 5 1 "[ + 1 . 2]" 1 1731 2 42 LYS QB 2 44 LYS H 3.306 . 3.603 3.465 2.955 4.441 0.838 5 1 "[ + 1 . 2]" 1 1732 1 44 LYS H 2 52 PHE HA 4.450 . 6.925 4.579 4.112 5.248 . 0 0 "[ . 1 . 2]" 1 1733 1 52 PHE HA 2 44 LYS H 4.450 . 6.925 4.581 4.106 5.191 . 0 0 "[ . 1 . 2]" 1 1734 1 41 GLN HA 1 44 LYS H 4.347 . 6.709 5.071 4.624 5.575 . 0 0 "[ . 1 . 2]" 1 1735 2 41 GLN HA 2 44 LYS H 4.347 . 6.709 5.073 4.626 5.580 . 0 0 "[ . 1 . 2]" 1 1736 1 44 LYS H 1 44 LYS HA 2.726 . 3.655 2.906 2.858 2.945 . 0 0 "[ . 1 . 2]" 1 1737 2 44 LYS H 2 44 LYS HA 2.726 . 3.655 2.906 2.856 2.945 . 0 0 "[ . 1 . 2]" 1 1738 1 44 LYS H 1 45 GLY HA3 4.429 . 6.881 5.168 4.095 5.538 . 0 0 "[ . 1 . 2]" 1 1739 2 44 LYS H 2 45 GLY HA3 4.429 . 6.881 5.170 4.091 5.539 . 0 0 "[ . 1 . 2]" 1 1740 1 44 LYS H 1 45 GLY HA2 4.744 . 7.558 5.254 4.100 5.694 . 0 0 "[ . 1 . 2]" 1 1741 2 44 LYS H 2 45 GLY HA2 4.744 . 7.558 5.256 4.102 5.696 . 0 0 "[ . 1 . 2]" 1 1742 1 44 LYS H 1 44 LYS QE 5.168 . 8.506 4.799 3.762 5.770 . 0 0 "[ . 1 . 2]" 1 1743 2 44 LYS H 2 44 LYS QE 5.168 . 8.506 4.796 3.765 5.773 . 0 0 "[ . 1 . 2]" 1 1744 1 44 LYS H 1 44 LYS HB2 2.459 . 3.215 2.544 2.432 2.791 . 0 0 "[ . 1 . 2]" 1 1745 2 44 LYS H 2 44 LYS HB2 2.459 . 3.215 2.544 2.427 2.790 . 0 0 "[ . 1 . 2]" 1 1746 1 44 LYS H 1 44 LYS HB3 3.168 . 4.422 3.592 2.478 3.861 . 0 0 "[ . 1 . 2]" 1 1747 2 44 LYS H 2 44 LYS HB3 3.168 . 4.422 3.592 2.481 3.861 . 0 0 "[ . 1 . 2]" 1 1748 1 44 LYS H 1 44 LYS QD 4.023 . 6.046 3.761 3.162 4.243 . 0 0 "[ . 1 . 2]" 1 1749 2 44 LYS H 2 44 LYS QD 4.023 . 6.046 3.759 3.162 4.248 . 0 0 "[ . 1 . 2]" 1 1750 1 44 LYS H 1 44 LYS QG 3.526 . 3.648 2.509 2.023 4.030 0.382 13 0 "[ . 1 . 2]" 1 1751 2 44 LYS H 2 44 LYS QG 3.526 . 3.648 2.507 2.023 4.031 0.383 13 0 "[ . 1 . 2]" 1 1752 1 43 LYS H 1 44 LYS H 3.059 . 4.229 2.973 1.819 3.463 0.070 10 0 "[ . 1 . 2]" 1 1753 2 43 LYS H 2 44 LYS H 3.059 . 4.229 2.974 1.813 3.460 0.076 10 0 "[ . 1 . 2]" 1 1754 1 42 LYS H 1 44 LYS H 4.572 . 7.185 4.206 3.660 4.585 . 0 0 "[ . 1 . 2]" 1 1755 2 42 LYS H 2 44 LYS H 4.572 . 7.185 4.210 3.670 4.593 . 0 0 "[ . 1 . 2]" 1 1756 1 41 GLN H 1 44 LYS H 3.459 . 4.955 3.851 3.357 4.470 . 0 0 "[ . 1 . 2]" 1 1757 2 41 GLN H 2 44 LYS H 3.459 . 4.955 3.854 3.357 4.475 . 0 0 "[ . 1 . 2]" 1 1758 1 41 GLN HB2 1 44 LYS H 3.341 . 4.736 3.965 3.193 4.362 . 0 0 "[ . 1 . 2]" 1 1759 2 41 GLN HB2 2 44 LYS H 3.341 . 4.736 3.967 3.192 4.369 . 0 0 "[ . 1 . 2]" 1 1760 1 45 GLY H 2 52 PHE HA 3.901 . 5.803 3.776 3.441 4.217 . 0 0 "[ . 1 . 2]" 1 1761 1 52 PHE HA 2 45 GLY H 3.901 . 5.803 3.774 3.422 4.183 . 0 0 "[ . 1 . 2]" 1 1762 1 44 LYS HA 1 45 GLY H 2.521 . 3.315 2.384 2.142 2.790 . 0 0 "[ . 1 . 2]" 1 1763 2 44 LYS HA 2 45 GLY H 2.521 . 3.315 2.384 2.143 2.791 . 0 0 "[ . 1 . 2]" 1 1764 1 43 LYS HA 1 45 GLY H 4.199 . 6.403 5.479 3.868 6.657 0.254 18 0 "[ . 1 . 2]" 1 1765 2 43 LYS HA 2 45 GLY H 4.199 . 6.403 5.480 3.869 6.657 0.254 18 0 "[ . 1 . 2]" 1 1766 1 42 LYS QB 1 45 GLY H 6.012 . 10.530 6.943 6.189 7.552 . 0 0 "[ . 1 . 2]" 1 1767 2 42 LYS QB 2 45 GLY H 6.012 . 10.530 6.941 6.189 7.550 . 0 0 "[ . 1 . 2]" 1 1768 1 45 GLY H 2 52 PHE HB3 5.565 . 9.436 5.823 5.061 6.583 . 0 0 "[ . 1 . 2]" 1 1769 1 52 PHE HB3 2 45 GLY H 5.565 . 9.436 5.822 5.088 6.550 . 0 0 "[ . 1 . 2]" 1 1770 1 45 GLY H 2 51 PHE HB2 4.392 . 6.803 5.126 4.701 5.627 . 0 0 "[ . 1 . 2]" 1 1771 1 51 PHE HB2 2 45 GLY H 4.392 . 6.803 5.135 4.733 5.665 . 0 0 "[ . 1 . 2]" 1 1772 1 45 GLY H 1 46 LYS HA 4.722 . 7.509 4.848 4.719 5.340 . 0 0 "[ . 1 . 2]" 1 1773 2 45 GLY H 2 46 LYS HA 4.722 . 7.509 4.849 4.717 5.339 . 0 0 "[ . 1 . 2]" 1 1774 1 41 GLN H 1 45 GLY H 4.352 . 6.719 4.389 3.792 4.813 . 0 0 "[ . 1 . 2]" 1 1775 2 41 GLN H 2 45 GLY H 4.352 . 6.719 4.388 3.792 4.816 . 0 0 "[ . 1 . 2]" 1 1776 1 45 GLY H 1 46 LYS H 4.456 . 6.938 4.314 4.107 4.571 . 0 0 "[ . 1 . 2]" 1 1777 2 45 GLY H 2 46 LYS H 4.456 . 6.938 4.314 4.107 4.570 . 0 0 "[ . 1 . 2]" 1 1778 1 46 LYS H 1 47 ILE HA 4.046 . 6.092 4.589 4.544 4.656 . 0 0 "[ . 1 . 2]" 1 1779 2 46 LYS H 2 47 ILE HA 4.046 . 6.092 4.589 4.546 4.660 . 0 0 "[ . 1 . 2]" 1 1780 1 45 GLY HA2 1 46 LYS H 2.840 . 3.848 2.789 2.444 3.023 . 0 0 "[ . 1 . 2]" 1 1781 2 45 GLY HA2 2 46 LYS H 2.840 . 3.848 2.788 2.441 3.020 . 0 0 "[ . 1 . 2]" 1 1782 1 39 LYS QG 1 46 LYS H 4.889 . 7.876 4.200 3.723 4.987 . 0 0 "[ . 1 . 2]" 1 1783 2 39 LYS QG 2 46 LYS H 4.889 . 7.876 4.200 3.725 4.985 . 0 0 "[ . 1 . 2]" 1 1784 1 45 GLY HA3 1 46 LYS H 3.278 . 4.621 2.354 2.209 2.686 . 0 0 "[ . 1 . 2]" 1 1785 2 45 GLY HA3 2 46 LYS H 3.278 . 4.621 2.353 2.212 2.690 . 0 0 "[ . 1 . 2]" 1 1786 1 39 LYS QE 1 46 LYS H 5.499 . 9.279 6.224 5.867 6.655 . 0 0 "[ . 1 . 2]" 1 1787 2 39 LYS QE 2 46 LYS H 5.499 . 9.279 6.224 5.867 6.656 . 0 0 "[ . 1 . 2]" 1 1788 1 46 LYS H 1 46 LYS HB2 3.593 . 5.206 4.028 3.987 4.056 . 0 0 "[ . 1 . 2]" 1 1789 2 46 LYS H 2 46 LYS HB2 3.593 . 5.206 4.028 3.987 4.055 . 0 0 "[ . 1 . 2]" 1 1790 1 46 LYS H 1 46 LYS QG 3.105 . 4.310 2.733 2.673 2.802 . 0 0 "[ . 1 . 2]" 1 1791 2 46 LYS H 2 46 LYS QG 3.105 . 4.310 2.734 2.674 2.799 . 0 0 "[ . 1 . 2]" 1 1792 1 46 LYS H 1 47 ILE H 4.378 . 6.774 4.185 4.100 4.236 . 0 0 "[ . 1 . 2]" 1 1793 2 46 LYS H 2 47 ILE H 4.378 . 6.774 4.185 4.101 4.235 . 0 0 "[ . 1 . 2]" 1 1794 1 39 LYS H 1 46 LYS H 3.200 . 4.480 2.791 2.648 3.171 . 0 0 "[ . 1 . 2]" 1 1795 2 39 LYS H 2 46 LYS H 3.200 . 4.480 2.791 2.639 3.174 . 0 0 "[ . 1 . 2]" 1 1796 1 40 ARG H 1 46 LYS H 4.593 . 7.229 5.216 4.950 5.416 . 0 0 "[ . 1 . 2]" 1 1797 2 40 ARG H 2 46 LYS H 4.593 . 7.229 5.216 4.943 5.418 . 0 0 "[ . 1 . 2]" 1 1798 1 39 LYS HB2 1 46 LYS H 3.010 . 4.143 2.753 2.357 3.379 . 0 0 "[ . 1 . 2]" 1 1799 2 39 LYS HB2 2 46 LYS H 3.010 . 4.143 2.753 2.356 3.381 . 0 0 "[ . 1 . 2]" 1 1800 1 47 ILE H 2 50 GLU HA 5.057 . 8.254 4.001 3.610 4.349 . 0 0 "[ . 1 . 2]" 1 1801 1 50 GLU HA 2 47 ILE H 5.057 . 8.254 3.997 3.620 4.343 . 0 0 "[ . 1 . 2]" 1 1802 1 47 ILE H 1 47 ILE HB 3.105 . 4.310 2.703 2.608 2.766 . 0 0 "[ . 1 . 2]" 1 1803 2 47 ILE H 2 47 ILE HB 3.105 . 4.310 2.704 2.608 2.769 . 0 0 "[ . 1 . 2]" 1 1804 1 46 LYS HB3 1 47 ILE H 3.691 . 5.394 4.073 3.962 4.179 . 0 0 "[ . 1 . 2]" 1 1805 2 46 LYS HB3 2 47 ILE H 3.691 . 5.394 4.073 3.960 4.180 . 0 0 "[ . 1 . 2]" 1 1806 1 46 LYS QG 1 47 ILE H 4.377 . 6.771 3.992 3.859 4.140 . 0 0 "[ . 1 . 2]" 1 1807 2 46 LYS QG 2 47 ILE H 4.377 . 6.771 3.992 3.854 4.141 . 0 0 "[ . 1 . 2]" 1 1808 1 47 ILE H 2 61 LEU MD1 4.225 . 6.456 4.878 4.479 5.178 . 0 0 "[ . 1 . 2]" 1 1809 1 61 LEU MD1 2 47 ILE H 4.225 . 6.456 4.884 4.489 5.195 . 0 0 "[ . 1 . 2]" 1 1810 1 47 ILE H 2 49 ILE MG 4.366 . 6.748 4.315 4.145 4.459 . 0 0 "[ . 1 . 2]" 1 1811 1 49 ILE MG 2 47 ILE H 4.366 . 6.748 4.319 4.140 4.477 . 0 0 "[ . 1 . 2]" 1 1812 1 46 LYS QD 1 47 ILE H 5.202 . 8.584 4.889 4.699 5.063 . 0 0 "[ . 1 . 2]" 1 1813 2 46 LYS QD 2 47 ILE H 5.202 . 8.584 4.889 4.700 5.063 . 0 0 "[ . 1 . 2]" 1 1814 1 47 ILE H 2 49 ILE HG12 4.353 . 6.722 4.243 4.000 4.581 . 0 0 "[ . 1 . 2]" 1 1815 1 49 ILE HG12 2 47 ILE H 4.353 . 6.722 4.248 3.993 4.583 . 0 0 "[ . 1 . 2]" 1 1816 1 47 ILE H 2 51 PHE H 5.497 . 8.413 5.121 4.930 5.297 . 0 0 "[ . 1 . 2]" 1 1817 1 51 PHE H 2 47 ILE H 5.497 . 8.413 5.115 4.907 5.302 . 0 0 "[ . 1 . 2]" 1 1818 1 46 LYS QG 1 48 GLU H 4.398 . 6.816 4.308 4.087 4.534 . 0 0 "[ . 1 . 2]" 1 1819 2 46 LYS QG 2 48 GLU H 4.398 . 6.816 4.310 4.086 4.537 . 0 0 "[ . 1 . 2]" 1 1820 1 47 ILE HA 1 48 GLU H 2.958 . 4.052 2.182 2.162 2.203 . 0 0 "[ . 1 . 2]" 1 1821 2 47 ILE HA 2 48 GLU H 2.958 . 4.052 2.182 2.164 2.200 . 0 0 "[ . 1 . 2]" 1 1822 1 48 GLU H 1 48 GLU QG 2.938 . 4.017 2.120 2.035 2.226 . 0 0 "[ . 1 . 2]" 1 1823 2 48 GLU H 2 48 GLU QG 2.938 . 4.017 2.121 2.033 2.223 . 0 0 "[ . 1 . 2]" 1 1824 1 39 LYS QG 1 48 GLU H 5.196 . 8.571 4.397 4.080 4.889 . 0 0 "[ . 1 . 2]" 1 1825 2 39 LYS QG 2 48 GLU H 5.196 . 8.571 4.398 4.082 4.885 . 0 0 "[ . 1 . 2]" 1 1826 1 36 VAL MG2 1 48 GLU H 4.551 . 7.140 5.680 5.478 5.849 . 0 0 "[ . 1 . 2]" 1 1827 2 36 VAL MG2 2 48 GLU H 4.551 . 7.140 5.679 5.475 5.848 . 0 0 "[ . 1 . 2]" 1 1828 1 47 ILE MG 1 48 GLU H 2.590 . 3.428 2.770 2.671 2.898 . 0 0 "[ . 1 . 2]" 1 1829 2 47 ILE MG 2 48 GLU H 2.590 . 3.428 2.770 2.670 2.901 . 0 0 "[ . 1 . 2]" 1 1830 1 48 GLU H 1 49 ILE MG 4.782 . 7.641 6.118 6.039 6.230 . 0 0 "[ . 1 . 2]" 1 1831 2 48 GLU H 2 49 ILE MG 4.782 . 7.641 6.117 6.040 6.226 . 0 0 "[ . 1 . 2]" 1 1832 1 48 GLU H 1 49 ILE MD 3.932 . 5.865 3.944 3.747 4.131 . 0 0 "[ . 1 . 2]" 1 1833 2 48 GLU H 2 49 ILE MD 3.932 . 5.865 3.944 3.748 4.130 . 0 0 "[ . 1 . 2]" 1 1834 1 37 ASN HD21 1 48 GLU H 5.751 . 9.885 5.376 5.154 5.649 . 0 0 "[ . 1 . 2]" 1 1835 2 37 ASN HD21 2 48 GLU H 5.751 . 9.885 5.378 5.154 5.662 . 0 0 "[ . 1 . 2]" 1 1836 1 37 ASN HD22 1 48 GLU H 6.283 . 11.218 6.804 4.961 7.219 . 0 0 "[ . 1 . 2]" 1 1837 2 37 ASN HD22 2 48 GLU H 6.283 . 11.218 6.806 4.956 7.229 . 0 0 "[ . 1 . 2]" 1 1838 1 37 ASN H 1 48 GLU H 3.354 . 4.760 3.119 2.977 3.361 . 0 0 "[ . 1 . 2]" 1 1839 2 37 ASN H 2 48 GLU H 3.354 . 4.760 3.120 2.978 3.360 . 0 0 "[ . 1 . 2]" 1 1840 1 36 VAL HA 1 48 GLU H 4.857 . 7.806 4.849 4.726 5.114 . 0 0 "[ . 1 . 2]" 1 1841 2 36 VAL HA 2 48 GLU H 4.857 . 7.806 4.849 4.724 5.109 . 0 0 "[ . 1 . 2]" 1 1842 1 49 ILE H 1 60 ILE MD 4.520 . 7.074 5.442 4.997 6.148 . 0 0 "[ . 1 . 2]" 1 1843 2 49 ILE H 2 60 ILE MD 4.520 . 7.074 5.442 4.998 6.146 . 0 0 "[ . 1 . 2]" 1 1844 1 48 GLU QG 1 49 ILE H 4.650 . 7.353 4.331 4.221 4.397 . 0 0 "[ . 1 . 2]" 1 1845 2 48 GLU QG 2 49 ILE H 4.650 . 7.353 4.331 4.220 4.398 . 0 0 "[ . 1 . 2]" 1 1846 1 49 ILE H 2 47 ILE HB 3.293 . 4.648 3.254 3.174 3.339 . 0 0 "[ . 1 . 2]" 1 1847 1 47 ILE HB 2 49 ILE H 3.293 . 4.648 3.259 3.177 3.331 . 0 0 "[ . 1 . 2]" 1 1848 1 49 ILE H 1 49 ILE HB 3.140 . 4.373 2.761 2.697 2.810 . 0 0 "[ . 1 . 2]" 1 1849 2 49 ILE H 2 49 ILE HB 3.140 . 4.373 2.761 2.697 2.811 . 0 0 "[ . 1 . 2]" 1 1850 1 49 ILE H 2 46 LYS QD 4.810 . 7.702 4.763 4.361 5.138 . 0 0 "[ . 1 . 2]" 1 1851 1 46 LYS QD 2 49 ILE H 4.810 . 7.702 4.755 4.345 5.130 . 0 0 "[ . 1 . 2]" 1 1852 1 36 VAL MG2 1 49 ILE H 4.634 . 7.318 4.984 4.739 5.195 . 0 0 "[ . 1 . 2]" 1 1853 2 36 VAL MG2 2 49 ILE H 4.634 . 7.318 4.984 4.738 5.197 . 0 0 "[ . 1 . 2]" 1 1854 1 36 VAL HA 1 49 ILE H 4.939 . 7.989 5.068 4.998 5.170 . 0 0 "[ . 1 . 2]" 1 1855 2 36 VAL HA 2 49 ILE H 4.939 . 7.989 5.069 5.001 5.166 . 0 0 "[ . 1 . 2]" 1 1856 1 49 ILE HA 1 50 GLU H 2.975 . 4.081 2.167 2.140 2.187 . 0 0 "[ . 1 . 2]" 1 1857 2 49 ILE HA 2 50 GLU H 2.975 . 4.081 2.167 2.141 2.186 . 0 0 "[ . 1 . 2]" 1 1858 1 35 THR HA 1 50 GLU H 4.656 . 7.366 5.072 4.943 5.193 . 0 0 "[ . 1 . 2]" 1 1859 2 35 THR HA 2 50 GLU H 4.656 . 7.366 5.072 4.944 5.186 . 0 0 "[ . 1 . 2]" 1 1860 1 35 THR HB 1 50 GLU H 4.217 . 6.440 3.624 3.113 4.081 . 0 0 "[ . 1 . 2]" 1 1861 2 35 THR HB 2 50 GLU H 4.217 . 6.440 3.623 3.111 4.087 . 0 0 "[ . 1 . 2]" 1 1862 1 50 GLU H 1 51 PHE HB2 5.602 . 9.525 7.013 6.867 7.117 . 0 0 "[ . 1 . 2]" 1 1863 2 50 GLU H 2 51 PHE HB2 5.602 . 9.525 7.013 6.866 7.122 . 0 0 "[ . 1 . 2]" 1 1864 1 50 GLU H 1 50 GLU HG3 3.268 . 4.603 3.003 2.421 3.922 . 0 0 "[ . 1 . 2]" 1 1865 2 50 GLU H 2 50 GLU HG3 3.268 . 4.603 3.003 2.425 3.916 . 0 0 "[ . 1 . 2]" 1 1866 1 36 VAL HB 1 50 GLU H 4.393 . 6.805 5.864 5.614 6.221 . 0 0 "[ . 1 . 2]" 1 1867 2 36 VAL HB 2 50 GLU H 4.393 . 6.805 5.864 5.620 6.222 . 0 0 "[ . 1 . 2]" 1 1868 1 50 GLU H 1 50 GLU HB3 3.202 . 4.483 3.642 3.593 3.687 . 0 0 "[ . 1 . 2]" 1 1869 2 50 GLU H 2 50 GLU HB3 3.202 . 4.483 3.643 3.591 3.688 . 0 0 "[ . 1 . 2]" 1 1870 1 35 THR MG 1 50 GLU H 3.787 . 5.579 4.161 3.777 4.470 . 0 0 "[ . 1 . 2]" 1 1871 2 35 THR MG 2 50 GLU H 3.787 . 5.579 4.159 3.773 4.470 . 0 0 "[ . 1 . 2]" 1 1872 1 36 VAL MG2 1 50 GLU H 3.483 . 5.000 3.633 3.330 4.045 . 0 0 "[ . 1 . 2]" 1 1873 2 36 VAL MG2 2 50 GLU H 3.483 . 5.000 3.633 3.335 4.040 . 0 0 "[ . 1 . 2]" 1 1874 1 50 GLU H 1 60 ILE MG 4.578 . 7.198 5.314 5.074 5.663 . 0 0 "[ . 1 . 2]" 1 1875 2 50 GLU H 2 60 ILE MG 4.578 . 7.198 5.314 5.073 5.665 . 0 0 "[ . 1 . 2]" 1 1876 1 49 ILE HG12 1 50 GLU H 4.581 . 7.204 5.271 5.225 5.308 . 0 0 "[ . 1 . 2]" 1 1877 2 49 ILE HG12 2 50 GLU H 4.581 . 7.204 5.271 5.226 5.307 . 0 0 "[ . 1 . 2]" 1 1878 1 50 GLU H 1 60 ILE MD 3.499 . 5.030 4.395 4.137 4.966 . 0 0 "[ . 1 . 2]" 1 1879 2 50 GLU H 2 60 ILE MD 3.499 . 5.030 4.396 4.136 4.964 . 0 0 "[ . 1 . 2]" 1 1880 1 32 PHE HD2 1 50 GLU H 5.270 . 8.742 5.945 5.497 6.587 . 0 0 "[ . 1 . 2]" 1 1881 2 32 PHE HD2 2 50 GLU H 5.270 . 8.742 5.944 5.498 6.577 . 0 0 "[ . 1 . 2]" 1 1882 1 36 VAL HA 1 50 GLU H 4.342 . 6.699 3.276 3.057 3.614 . 0 0 "[ . 1 . 2]" 1 1883 2 36 VAL HA 2 50 GLU H 4.342 . 6.699 3.275 3.062 3.620 . 0 0 "[ . 1 . 2]" 1 1884 1 36 VAL H 1 50 GLU H 4.787 . 7.652 4.936 4.848 4.996 . 0 0 "[ . 1 . 2]" 1 1885 2 36 VAL H 2 50 GLU H 4.787 . 7.652 4.936 4.849 5.000 . 0 0 "[ . 1 . 2]" 1 1886 1 50 GLU H 2 47 ILE H 4.924 . 7.955 5.009 4.801 5.165 . 0 0 "[ . 1 . 2]" 1 1887 1 47 ILE H 2 50 GLU H 4.924 . 7.955 5.011 4.797 5.152 . 0 0 "[ . 1 . 2]" 1 1888 1 49 ILE H 1 50 GLU H 4.931 . 7.970 4.359 4.250 4.473 . 0 0 "[ . 1 . 2]" 1 1889 2 49 ILE H 2 50 GLU H 4.931 . 7.970 4.360 4.251 4.472 . 0 0 "[ . 1 . 2]" 1 1890 1 37 ASN H 1 50 GLU H 5.307 . 8.828 4.766 4.491 4.963 . 0 0 "[ . 1 . 2]" 1 1891 2 37 ASN H 2 50 GLU H 5.307 . 8.828 4.767 4.490 4.961 . 0 0 "[ . 1 . 2]" 1 1892 1 51 PHE H 2 44 LYS HA 4.000 . 6.000 4.521 4.208 4.809 . 0 0 "[ . 1 . 2]" 1 1893 1 44 LYS HA 2 51 PHE H 4.000 . 6.000 4.513 4.198 4.800 . 0 0 "[ . 1 . 2]" 1 1894 1 50 GLU HG3 1 51 PHE H 5.603 . 9.528 5.143 5.017 5.351 . 0 0 "[ . 1 . 2]" 1 1895 2 50 GLU HG3 2 51 PHE H 5.603 . 9.528 5.143 5.019 5.355 . 0 0 "[ . 1 . 2]" 1 1896 1 51 PHE H 2 41 GLN HB2 5.162 . 8.493 7.385 6.630 7.994 . 0 0 "[ . 1 . 2]" 1 1897 1 41 GLN HB2 2 51 PHE H 5.162 . 8.493 7.378 6.610 8.002 . 0 0 "[ . 1 . 2]" 1 1898 1 51 PHE H 2 46 LYS HB2 4.496 . 7.023 4.930 4.683 5.405 . 0 0 "[ . 1 . 2]" 1 1899 1 46 LYS HB2 2 51 PHE H 4.496 . 7.023 4.929 4.702 5.391 . 0 0 "[ . 1 . 2]" 1 1900 1 51 PHE H 2 47 ILE MD 4.475 . 6.978 4.650 4.475 4.914 . 0 0 "[ . 1 . 2]" 1 1901 1 47 ILE MD 2 51 PHE H 4.475 . 6.978 4.657 4.513 4.919 . 0 0 "[ . 1 . 2]" 1 1902 1 51 PHE H 1 51 PHE HB3 3.852 . 5.706 3.417 3.334 3.517 . 0 0 "[ . 1 . 2]" 1 1903 2 51 PHE H 2 51 PHE HB3 3.852 . 5.706 3.419 3.343 3.512 . 0 0 "[ . 1 . 2]" 1 1904 1 50 GLU HB3 1 51 PHE H 4.374 . 6.765 2.902 2.651 3.061 . 0 0 "[ . 1 . 2]" 1 1905 2 50 GLU HB3 2 51 PHE H 4.374 . 6.765 2.899 2.654 3.060 . 0 0 "[ . 1 . 2]" 1 1906 1 50 GLU HB2 1 51 PHE H 3.330 . 4.716 3.945 3.732 4.134 . 0 0 "[ . 1 . 2]" 1 1907 2 50 GLU HB2 2 51 PHE H 3.330 . 4.716 3.944 3.734 4.131 . 0 0 "[ . 1 . 2]" 1 1908 1 51 PHE H 2 46 LYS HB3 5.133 . 8.426 3.894 3.576 4.549 . 0 0 "[ . 1 . 2]" 1 1909 1 46 LYS HB3 2 51 PHE H 5.133 . 8.426 3.889 3.554 4.532 . 0 0 "[ . 1 . 2]" 1 1910 1 49 ILE MG 1 51 PHE H 4.799 . 7.678 5.058 4.896 5.233 . 0 0 "[ . 1 . 2]" 1 1911 2 49 ILE MG 2 51 PHE H 4.799 . 7.678 5.060 4.892 5.234 . 0 0 "[ . 1 . 2]" 1 1912 1 51 PHE H 1 52 PHE HD2 5.028 . 8.188 5.172 4.748 5.429 . 0 0 "[ . 1 . 2]" 1 1913 2 51 PHE H 2 52 PHE HD2 5.028 . 8.188 5.171 4.750 5.431 . 0 0 "[ . 1 . 2]" 1 1914 1 51 PHE H 1 51 PHE HD2 3.847 . 5.697 3.971 3.189 4.458 . 0 0 "[ . 1 . 2]" 1 1915 2 51 PHE H 2 51 PHE HD2 3.847 . 5.697 3.973 3.198 4.456 . 0 0 "[ . 1 . 2]" 1 1916 1 51 PHE H 1 51 PHE HZ 4.601 . 7.247 5.546 5.364 5.769 . 0 0 "[ . 1 . 2]" 1 1917 2 51 PHE H 2 51 PHE HZ 4.601 . 7.247 5.548 5.367 5.772 . 0 0 "[ . 1 . 2]" 1 1918 1 51 PHE H 1 52 PHE H 5.135 . 8.431 4.354 4.252 4.405 . 0 0 "[ . 1 . 2]" 1 1919 2 51 PHE H 2 52 PHE H 5.135 . 8.431 4.354 4.256 4.407 . 0 0 "[ . 1 . 2]" 1 1920 1 49 ILE H 1 51 PHE H 5.514 . 9.315 6.757 6.596 6.954 . 0 0 "[ . 1 . 2]" 1 1921 2 49 ILE H 2 51 PHE H 5.514 . 9.315 6.760 6.596 6.953 . 0 0 "[ . 1 . 2]" 1 1922 1 50 GLU H 1 51 PHE H 4.608 . 7.262 4.576 4.516 4.611 . 0 0 "[ . 1 . 2]" 1 1923 2 50 GLU H 2 51 PHE H 4.608 . 7.262 4.577 4.515 4.611 . 0 0 "[ . 1 . 2]" 1 1924 1 51 PHE HA 1 52 PHE H 3.110 . 4.319 2.283 2.222 2.557 . 0 0 "[ . 1 . 2]" 1 1925 2 51 PHE HA 2 52 PHE H 3.110 . 4.319 2.282 2.227 2.549 . 0 0 "[ . 1 . 2]" 1 1926 1 52 PHE H 1 56 ASP HA 6.036 . 10.591 5.998 5.386 6.463 . 0 0 "[ . 1 . 2]" 1 1927 2 52 PHE H 2 56 ASP HA 6.036 . 10.591 5.998 5.390 6.459 . 0 0 "[ . 1 . 2]" 1 1928 1 52 PHE H 2 44 LYS HA 5.148 . 8.461 4.819 4.387 5.905 . 0 0 "[ . 1 . 2]" 1 1929 1 44 LYS HA 2 52 PHE H 5.148 . 8.461 4.812 4.350 5.896 . 0 0 "[ . 1 . 2]" 1 1930 1 52 PHE H 1 52 PHE HB3 3.707 . 5.424 3.587 3.237 3.813 . 0 0 "[ . 1 . 2]" 1 1931 2 52 PHE H 2 52 PHE HB3 3.707 . 5.424 3.586 3.235 3.814 . 0 0 "[ . 1 . 2]" 1 1932 1 52 PHE H 1 56 ASP QB 3.516 . 5.061 3.168 2.674 3.695 . 0 0 "[ . 1 . 2]" 1 1933 2 52 PHE H 2 56 ASP QB 3.516 . 5.061 3.167 2.676 3.696 . 0 0 "[ . 1 . 2]" 1 1934 1 51 PHE HB3 1 52 PHE H 4.276 . 6.561 3.897 3.596 4.051 . 0 0 "[ . 1 . 2]" 1 1935 2 51 PHE HB3 2 52 PHE H 4.276 . 6.561 3.898 3.600 4.052 . 0 0 "[ . 1 . 2]" 1 1936 1 51 PHE HB2 1 52 PHE H 3.978 . 5.956 2.810 2.209 2.955 . 0 0 "[ . 1 . 2]" 1 1937 2 51 PHE HB2 2 52 PHE H 3.978 . 5.956 2.811 2.217 2.957 . 0 0 "[ . 1 . 2]" 1 1938 1 52 PHE H 1 60 ILE MD 4.989 . 8.101 4.818 4.411 5.663 . 0 0 "[ . 1 . 2]" 1 1939 2 52 PHE H 2 60 ILE MD 4.989 . 8.101 4.819 4.410 5.666 . 0 0 "[ . 1 . 2]" 1 1940 1 52 PHE H 1 52 PHE HD2 3.949 . 5.899 3.629 2.701 4.726 . 0 0 "[ . 1 . 2]" 1 1941 2 52 PHE H 2 52 PHE HD2 3.949 . 5.899 3.628 2.699 4.726 . 0 0 "[ . 1 . 2]" 1 1942 1 51 PHE HD2 1 52 PHE H 5.128 . 8.415 4.496 3.231 5.865 . 0 0 "[ . 1 . 2]" 1 1943 2 51 PHE HD2 2 52 PHE H 5.128 . 8.415 4.498 3.243 5.871 . 0 0 "[ . 1 . 2]" 1 1944 1 51 PHE HA 1 53 SER H 4.420 . 6.862 3.851 3.678 4.251 . 0 0 "[ . 1 . 2]" 1 1945 2 51 PHE HA 2 53 SER H 4.420 . 6.862 3.851 3.678 4.247 . 0 0 "[ . 1 . 2]" 1 1946 1 53 SER H 1 56 ASP HA 5.009 . 8.145 5.720 5.385 6.149 . 0 0 "[ . 1 . 2]" 1 1947 2 53 SER H 2 56 ASP HA 5.009 . 8.145 5.721 5.388 6.147 . 0 0 "[ . 1 . 2]" 1 1948 1 52 PHE HB3 1 53 SER H 4.561 . 7.161 4.423 4.084 4.606 . 0 0 "[ . 1 . 2]" 1 1949 2 52 PHE HB3 2 53 SER H 4.561 . 7.161 4.425 4.085 4.602 . 0 0 "[ . 1 . 2]" 1 1950 1 53 SER H 1 56 ASP QB 3.032 . 4.181 2.993 2.645 4.068 . 0 0 "[ . 1 . 2]" 1 1951 2 53 SER H 2 56 ASP QB 3.032 . 4.181 2.992 2.645 4.065 . 0 0 "[ . 1 . 2]" 1 1952 1 51 PHE HB2 1 53 SER H 3.214 . 4.505 2.659 2.497 2.870 . 0 0 "[ . 1 . 2]" 1 1953 2 51 PHE HB2 2 53 SER H 3.214 . 4.505 2.658 2.492 2.867 . 0 0 "[ . 1 . 2]" 1 1954 1 53 SER H 1 60 ILE MD 4.964 . 8.045 5.341 5.093 6.476 . 0 0 "[ . 1 . 2]" 1 1955 2 53 SER H 2 60 ILE MD 4.964 . 8.045 5.341 5.094 6.481 . 0 0 "[ . 1 . 2]" 1 1956 1 53 SER H 1 57 LEU H 3.751 . 5.510 4.027 3.626 4.382 . 0 0 "[ . 1 . 2]" 1 1957 2 53 SER H 2 57 LEU H 3.751 . 5.510 4.027 3.627 4.384 . 0 0 "[ . 1 . 2]" 1 1958 1 52 PHE HD2 1 53 SER H 4.905 . 7.912 5.223 4.648 5.668 . 0 0 "[ . 1 . 2]" 1 1959 2 52 PHE HD2 2 53 SER H 4.905 . 7.912 5.223 4.649 5.668 . 0 0 "[ . 1 . 2]" 1 1960 1 51 PHE HD2 1 53 SER H 3.943 . 5.887 3.671 2.338 6.254 0.367 15 0 "[ . 1 . 2]" 1 1961 2 51 PHE HD2 2 53 SER H 3.943 . 5.887 3.670 2.333 6.249 0.362 15 0 "[ . 1 . 2]" 1 1962 1 52 PHE H 1 53 SER H 2.972 . 4.076 2.177 1.752 2.450 0.116 15 0 "[ . 1 . 2]" 1 1963 2 52 PHE H 2 53 SER H 2.972 . 4.076 2.179 1.756 2.448 0.112 15 0 "[ . 1 . 2]" 1 1964 1 54 ASN HD22 2 16 VAL HB 5.472 . 9.214 6.078 3.390 8.827 . 0 0 "[ . 1 . 2]" 1 1965 1 16 VAL HB 2 54 ASN HD22 5.472 . 9.214 6.074 3.376 8.789 . 0 0 "[ . 1 . 2]" 1 1966 1 54 ASN HB3 1 54 ASN HD22 3.476 . 4.986 3.842 3.484 4.061 . 0 0 "[ . 1 . 2]" 1 1967 2 54 ASN HB3 2 54 ASN HD22 3.476 . 4.986 3.841 3.484 4.059 . 0 0 "[ . 1 . 2]" 1 1968 1 54 ASN HD21 2 43 LYS QG 6.031 . 10.577 6.482 4.376 8.616 . 0 0 "[ . 1 . 2]" 1 1969 1 43 LYS QG 2 54 ASN HD21 6.031 . 10.577 6.477 4.365 8.641 . 0 0 "[ . 1 . 2]" 1 1970 1 54 ASN HB3 1 55 GLU H 4.057 . 6.114 4.064 3.164 4.329 . 0 0 "[ . 1 . 2]" 1 1971 2 54 ASN HB3 2 55 GLU H 4.057 . 6.114 4.062 3.154 4.326 . 0 0 "[ . 1 . 2]" 1 1972 1 51 PHE HB2 1 55 GLU H 4.953 . 8.020 5.900 5.645 6.413 . 0 0 "[ . 1 . 2]" 1 1973 2 51 PHE HB2 2 55 GLU H 4.953 . 8.020 5.900 5.647 6.408 . 0 0 "[ . 1 . 2]" 1 1974 1 52 PHE HA 1 55 GLU H 5.292 . 8.792 7.643 7.496 7.866 . 0 0 "[ . 1 . 2]" 1 1975 2 52 PHE HA 2 55 GLU H 5.292 . 8.792 7.643 7.501 7.861 . 0 0 "[ . 1 . 2]" 1 1976 1 55 GLU H 1 56 ASP HA 5.445 . 9.152 5.218 5.122 5.331 . 0 0 "[ . 1 . 2]" 1 1977 2 55 GLU H 2 56 ASP HA 5.445 . 9.152 5.218 5.125 5.329 . 0 0 "[ . 1 . 2]" 1 1978 1 54 ASN HA 1 55 GLU H 3.400 . 4.845 3.405 3.359 3.484 . 0 0 "[ . 1 . 2]" 1 1979 2 54 ASN HA 2 55 GLU H 3.400 . 4.845 3.404 3.360 3.486 . 0 0 "[ . 1 . 2]" 1 1980 1 55 GLU H 2 43 LYS HA 5.135 . 8.431 6.840 6.063 7.838 . 0 0 "[ . 1 . 2]" 1 1981 1 43 LYS HA 2 55 GLU H 5.135 . 8.431 6.833 6.059 7.831 . 0 0 "[ . 1 . 2]" 1 1982 1 55 GLU H 1 56 ASP QB 4.855 . 7.801 4.657 4.495 5.098 . 0 0 "[ . 1 . 2]" 1 1983 2 55 GLU H 2 56 ASP QB 4.855 . 7.801 4.656 4.496 5.094 . 0 0 "[ . 1 . 2]" 1 1984 1 55 GLU H 1 58 ASP HB2 5.149 . 8.463 5.990 5.574 7.825 . 0 0 "[ . 1 . 2]" 1 1985 2 55 GLU H 2 58 ASP HB2 5.149 . 8.463 5.992 5.575 7.828 . 0 0 "[ . 1 . 2]" 1 1986 1 55 GLU H 1 55 GLU HG3 4.562 . 7.163 3.969 2.070 4.524 . 0 0 "[ . 1 . 2]" 1 1987 2 55 GLU H 2 55 GLU HG3 4.562 . 7.163 3.968 2.070 4.530 . 0 0 "[ . 1 . 2]" 1 1988 1 55 GLU H 1 55 GLU HG2 3.289 . 4.641 3.887 2.315 4.641 0.000 10 0 "[ . 1 . 2]" 1 1989 2 55 GLU H 2 55 GLU HG2 3.289 . 4.641 3.888 2.311 4.641 . 0 0 "[ . 1 . 2]" 1 1990 1 55 GLU H 1 55 GLU HB3 3.428 . 4.897 2.958 2.430 3.627 . 0 0 "[ . 1 . 2]" 1 1991 2 55 GLU H 2 55 GLU HB3 3.428 . 4.897 2.959 2.431 3.630 . 0 0 "[ . 1 . 2]" 1 1992 1 55 GLU H 1 55 GLU HB2 2.909 . 3.967 2.520 2.427 2.641 . 0 0 "[ . 1 . 2]" 1 1993 2 55 GLU H 2 55 GLU HB2 2.909 . 3.967 2.520 2.427 2.644 . 0 0 "[ . 1 . 2]" 1 1994 1 55 GLU H 1 56 ASP H 2.995 . 4.116 2.603 2.467 2.745 . 0 0 "[ . 1 . 2]" 1 1995 2 55 GLU H 2 56 ASP H 2.995 . 4.116 2.602 2.469 2.745 . 0 0 "[ . 1 . 2]" 1 1996 1 55 GLU H 1 57 LEU H 4.042 . 6.084 3.775 3.649 3.924 . 0 0 "[ . 1 . 2]" 1 1997 2 55 GLU H 2 57 LEU H 4.042 . 6.084 3.775 3.657 3.925 . 0 0 "[ . 1 . 2]" 1 1998 1 54 ASN HD22 1 55 GLU H 5.103 . 8.358 4.541 3.849 6.278 . 0 0 "[ . 1 . 2]" 1 1999 2 54 ASN HD22 2 55 GLU H 5.103 . 8.358 4.540 3.849 6.273 . 0 0 "[ . 1 . 2]" 1 2000 1 57 LEU H 1 59 ARG HD2 5.443 . 9.146 6.975 5.570 8.707 . 0 0 "[ . 1 . 2]" 1 2001 2 57 LEU H 2 59 ARG HD2 5.443 . 9.146 6.974 5.578 8.704 . 0 0 "[ . 1 . 2]" 1 2002 1 55 GLU HG3 1 57 LEU H 6.066 . 10.665 6.223 5.579 6.997 . 0 0 "[ . 1 . 2]" 1 2003 2 55 GLU HG3 2 57 LEU H 6.066 . 10.665 6.221 5.567 6.995 . 0 0 "[ . 1 . 2]" 1 2004 1 57 LEU H 1 57 LEU HG 4.723 . 7.511 4.428 4.374 4.490 . 0 0 "[ . 1 . 2]" 1 2005 2 57 LEU H 2 57 LEU HG 4.723 . 7.511 4.427 4.371 4.491 . 0 0 "[ . 1 . 2]" 1 2006 1 56 ASP HA 1 57 LEU H 4.017 . 6.034 3.510 3.482 3.532 . 0 0 "[ . 1 . 2]" 1 2007 2 56 ASP HA 2 57 LEU H 4.017 . 6.034 3.510 3.483 3.529 . 0 0 "[ . 1 . 2]" 1 2008 1 54 ASN HA 1 57 LEU H 3.470 . 4.975 3.133 2.886 3.440 . 0 0 "[ . 1 . 2]" 1 2009 2 54 ASN HA 2 57 LEU H 3.470 . 4.975 3.133 2.889 3.439 . 0 0 "[ . 1 . 2]" 1 2010 1 57 LEU H 2 43 LYS HA 5.321 . 8.860 7.193 6.483 7.981 . 0 0 "[ . 1 . 2]" 1 2011 1 43 LYS HA 2 57 LEU H 5.321 . 8.860 7.186 6.463 8.011 . 0 0 "[ . 1 . 2]" 1 2012 1 57 LEU H 1 58 ASP HA 5.424 . 9.102 5.443 5.342 5.499 . 0 0 "[ . 1 . 2]" 1 2013 2 57 LEU H 2 58 ASP HA 5.424 . 9.102 5.444 5.345 5.500 . 0 0 "[ . 1 . 2]" 1 2014 1 55 GLU HA 1 57 LEU H 4.420 . 6.862 4.355 4.201 4.506 . 0 0 "[ . 1 . 2]" 1 2015 2 55 GLU HA 2 57 LEU H 4.420 . 6.862 4.355 4.201 4.506 . 0 0 "[ . 1 . 2]" 1 2016 1 56 ASP QB 1 57 LEU H 3.115 . 4.328 2.623 2.431 3.330 . 0 0 "[ . 1 . 2]" 1 2017 2 56 ASP QB 2 57 LEU H 3.115 . 4.328 2.624 2.427 3.331 . 0 0 "[ . 1 . 2]" 1 2018 1 51 PHE HB3 1 57 LEU H 4.360 . 6.737 4.104 3.745 4.442 . 0 0 "[ . 1 . 2]" 1 2019 2 51 PHE HB3 2 57 LEU H 4.360 . 6.737 4.105 3.743 4.445 . 0 0 "[ . 1 . 2]" 1 2020 1 51 PHE HB2 1 57 LEU H 3.705 . 5.421 3.195 2.890 3.454 . 0 0 "[ . 1 . 2]" 1 2021 2 51 PHE HB2 2 57 LEU H 3.705 . 5.421 3.195 2.890 3.450 . 0 0 "[ . 1 . 2]" 1 2022 1 55 GLU HB3 1 57 LEU H 5.610 . 9.544 5.060 4.626 5.589 . 0 0 "[ . 1 . 2]" 1 2023 2 55 GLU HB3 2 57 LEU H 5.610 . 9.544 5.060 4.629 5.586 . 0 0 "[ . 1 . 2]" 1 2024 1 55 GLU HB2 1 57 LEU H 5.222 . 8.631 5.298 4.695 5.781 . 0 0 "[ . 1 . 2]" 1 2025 2 55 GLU HB2 2 57 LEU H 5.222 . 8.631 5.297 4.695 5.784 . 0 0 "[ . 1 . 2]" 1 2026 1 57 LEU H 1 57 LEU HB3 2.951 . 4.040 2.420 2.346 2.497 . 0 0 "[ . 1 . 2]" 1 2027 2 57 LEU H 2 57 LEU HB3 2.951 . 4.040 2.420 2.343 2.500 . 0 0 "[ . 1 . 2]" 1 2028 1 57 LEU H 1 60 ILE MD 3.943 . 5.886 4.058 3.820 5.115 . 0 0 "[ . 1 . 2]" 1 2029 2 57 LEU H 2 60 ILE MD 3.943 . 5.886 4.058 3.820 5.116 . 0 0 "[ . 1 . 2]" 1 2030 1 57 LEU H 1 57 LEU HB2 3.067 . 4.243 2.554 2.462 2.655 . 0 0 "[ . 1 . 2]" 1 2031 2 57 LEU H 2 57 LEU HB2 3.067 . 4.243 2.554 2.462 2.654 . 0 0 "[ . 1 . 2]" 1 2032 1 57 LEU H 1 57 LEU QD 4.085 . 6.080 3.704 3.670 3.731 . 0 0 "[ . 1 . 2]" 1 2033 2 57 LEU H 2 57 LEU QD 4.085 . 6.080 3.704 3.670 3.728 . 0 0 "[ . 1 . 2]" 1 2034 1 51 PHE HD2 1 57 LEU H 4.651 . 7.355 4.315 3.698 5.715 . 0 0 "[ . 1 . 2]" 1 2035 2 51 PHE HD2 2 57 LEU H 4.651 . 7.355 4.316 3.700 5.714 . 0 0 "[ . 1 . 2]" 1 2036 1 52 PHE H 1 57 LEU H 5.718 . 9.805 5.262 4.414 5.714 . 0 0 "[ . 1 . 2]" 1 2037 2 52 PHE H 2 57 LEU H 5.718 . 9.805 5.263 4.417 5.726 . 0 0 "[ . 1 . 2]" 1 2038 1 56 ASP H 1 57 LEU H 2.871 . 3.901 2.610 2.495 2.720 . 0 0 "[ . 1 . 2]" 1 2039 2 56 ASP H 2 57 LEU H 2.871 . 3.901 2.607 2.493 2.729 . 0 0 "[ . 1 . 2]" 1 2040 1 54 ASN HA 1 58 ASP H 4.306 . 6.624 4.005 3.699 4.504 . 0 0 "[ . 1 . 2]" 1 2041 2 54 ASN HA 2 58 ASP H 4.306 . 6.624 4.006 3.705 4.505 . 0 0 "[ . 1 . 2]" 1 2042 1 55 GLU HA 1 58 ASP H 3.269 . 4.605 3.539 3.273 3.785 . 0 0 "[ . 1 . 2]" 1 2043 2 55 GLU HA 2 58 ASP H 3.269 . 4.605 3.540 3.277 3.787 . 0 0 "[ . 1 . 2]" 1 2044 1 58 ASP H 1 61 LEU HA 5.439 . 9.137 7.517 7.356 7.722 . 0 0 "[ . 1 . 2]" 1 2045 2 58 ASP H 2 61 LEU HA 5.439 . 9.137 7.516 7.356 7.721 . 0 0 "[ . 1 . 2]" 1 2046 1 57 LEU HA 1 58 ASP H 3.858 . 5.718 3.563 3.536 3.600 . 0 0 "[ . 1 . 2]" 1 2047 2 57 LEU HA 2 58 ASP H 3.858 . 5.718 3.563 3.538 3.596 . 0 0 "[ . 1 . 2]" 1 2048 1 56 ASP QB 1 58 ASP H 4.901 . 7.877 4.916 4.645 5.132 . 0 0 "[ . 1 . 2]" 1 2049 2 56 ASP QB 2 58 ASP H 4.901 . 7.877 4.917 4.642 5.123 . 0 0 "[ . 1 . 2]" 1 2050 1 54 ASN HB2 1 58 ASP H 4.310 . 6.632 4.859 4.490 6.491 . 0 0 "[ . 1 . 2]" 1 2051 2 54 ASN HB2 2 58 ASP H 4.310 . 6.632 4.860 4.492 6.493 . 0 0 "[ . 1 . 2]" 1 2052 1 58 ASP H 1 58 ASP HB3 3.006 . 4.135 2.584 2.410 3.580 . 0 0 "[ . 1 . 2]" 1 2053 2 58 ASP H 2 58 ASP HB3 3.006 . 4.135 2.584 2.398 3.580 . 0 0 "[ . 1 . 2]" 1 2054 1 58 ASP H 1 58 ASP HB2 2.878 . 3.913 2.594 2.352 3.631 . 0 0 "[ . 1 . 2]" 1 2055 2 58 ASP H 2 58 ASP HB2 2.878 . 3.913 2.593 2.346 3.632 . 0 0 "[ . 1 . 2]" 1 2056 1 58 ASP H 1 60 ILE HB 4.119 . 6.240 5.389 5.128 5.599 . 0 0 "[ . 1 . 2]" 1 2057 2 58 ASP H 2 60 ILE HB 4.119 . 6.240 5.389 5.128 5.599 . 0 0 "[ . 1 . 2]" 1 2058 1 57 LEU HB3 1 58 ASP H 2.818 . 3.810 2.381 2.269 2.568 . 0 0 "[ . 1 . 2]" 1 2059 2 57 LEU HB3 2 58 ASP H 2.818 . 3.810 2.382 2.271 2.567 . 0 0 "[ . 1 . 2]" 1 2060 1 57 LEU HG 1 58 ASP H 3.703 . 5.417 3.315 3.107 3.774 . 0 0 "[ . 1 . 2]" 1 2061 2 57 LEU HG 2 58 ASP H 3.703 . 5.417 3.315 3.094 3.774 . 0 0 "[ . 1 . 2]" 1 2062 1 57 LEU HB2 1 58 ASP H 4.529 . 7.093 3.800 3.738 3.867 . 0 0 "[ . 1 . 2]" 1 2063 2 57 LEU HB2 2 58 ASP H 4.529 . 7.093 3.800 3.738 3.868 . 0 0 "[ . 1 . 2]" 1 2064 1 56 ASP HA 1 58 ASP H 4.270 . 6.549 4.526 4.271 4.754 . 0 0 "[ . 1 . 2]" 1 2065 2 56 ASP HA 2 58 ASP H 4.270 . 6.549 4.527 4.259 4.751 . 0 0 "[ . 1 . 2]" 1 2066 1 58 ASP H 2 16 VAL QG 4.952 . 8.017 6.336 5.258 7.829 . 0 0 "[ . 1 . 2]" 1 2067 1 16 VAL QG 2 58 ASP H 4.952 . 8.017 6.333 5.258 7.785 . 0 0 "[ . 1 . 2]" 1 2068 1 54 ASN HD21 1 58 ASP H 5.103 . 8.358 5.780 4.639 7.491 . 0 0 "[ . 1 . 2]" 1 2069 2 54 ASN HD21 2 58 ASP H 5.103 . 8.358 5.780 4.644 7.483 . 0 0 "[ . 1 . 2]" 1 2070 1 57 LEU H 1 58 ASP H 2.900 . 3.951 2.895 2.757 3.003 . 0 0 "[ . 1 . 2]" 1 2071 2 57 LEU H 2 58 ASP H 2.900 . 3.951 2.896 2.761 3.002 . 0 0 "[ . 1 . 2]" 1 2072 1 51 PHE HZ 1 58 ASP H 5.586 . 9.486 7.845 7.485 8.308 . 0 0 "[ . 1 . 2]" 1 2073 2 51 PHE HZ 2 58 ASP H 5.586 . 9.486 7.845 7.475 8.311 . 0 0 "[ . 1 . 2]" 1 2074 1 55 GLU H 1 58 ASP H 4.745 . 7.559 4.723 4.429 4.929 . 0 0 "[ . 1 . 2]" 1 2075 2 55 GLU H 2 58 ASP H 4.745 . 7.559 4.724 4.437 4.931 . 0 0 "[ . 1 . 2]" 1 2076 1 58 ASP H 1 61 LEU H 4.556 . 7.151 4.887 4.768 5.033 . 0 0 "[ . 1 . 2]" 1 2077 2 58 ASP H 2 61 LEU H 4.556 . 7.151 4.886 4.771 5.029 . 0 0 "[ . 1 . 2]" 1 2078 1 58 ASP H 1 60 ILE H 4.056 . 6.113 4.158 3.994 4.345 . 0 0 "[ . 1 . 2]" 1 2079 2 58 ASP H 2 60 ILE H 4.056 . 6.113 4.157 3.995 4.340 . 0 0 "[ . 1 . 2]" 1 2080 1 58 ASP H 1 59 ARG H 2.844 . 3.855 2.679 2.552 2.813 . 0 0 "[ . 1 . 2]" 1 2081 2 58 ASP H 2 59 ARG H 2.844 . 3.855 2.678 2.547 2.814 . 0 0 "[ . 1 . 2]" 1 2082 1 56 ASP H 1 58 ASP H 3.974 . 5.948 4.375 4.181 4.624 . 0 0 "[ . 1 . 2]" 1 2083 2 56 ASP H 2 58 ASP H 3.974 . 5.948 4.374 4.186 4.624 . 0 0 "[ . 1 . 2]" 1 2084 1 58 ASP H 1 59 ARG HA 4.569 . 7.178 5.282 5.180 5.353 . 0 0 "[ . 1 . 2]" 1 2085 2 58 ASP H 2 59 ARG HA 4.569 . 7.178 5.281 5.177 5.357 . 0 0 "[ . 1 . 2]" 1 2086 1 55 GLU HG3 1 58 ASP H 4.598 . 7.241 6.047 5.369 7.213 . 0 0 "[ . 1 . 2]" 1 2087 2 55 GLU HG3 2 58 ASP H 4.598 . 7.241 6.046 5.376 7.213 . 0 0 "[ . 1 . 2]" 1 2088 1 58 ASP H 1 59 ARG HB2 4.728 . 7.522 5.339 4.858 6.456 . 0 0 "[ . 1 . 2]" 1 2089 2 58 ASP H 2 59 ARG HB2 4.728 . 7.522 5.338 4.843 6.461 . 0 0 "[ . 1 . 2]" 1 2090 1 55 GLU HB2 1 58 ASP H 4.752 . 7.575 5.746 5.489 6.065 . 0 0 "[ . 1 . 2]" 1 2091 2 55 GLU HB2 2 58 ASP H 4.752 . 7.575 5.747 5.481 6.067 . 0 0 "[ . 1 . 2]" 1 2092 1 58 ASP HB2 1 59 ARG H 3.091 . 4.285 3.840 2.867 3.998 . 0 0 "[ . 1 . 2]" 1 2093 2 58 ASP HB2 2 59 ARG H 3.091 . 4.285 3.839 2.873 3.999 . 0 0 "[ . 1 . 2]" 1 2094 1 59 ARG H 1 59 ARG HB3 3.038 . 4.192 2.519 2.327 2.841 . 0 0 "[ . 1 . 2]" 1 2095 2 59 ARG H 2 59 ARG HB3 3.038 . 4.192 2.519 2.327 2.846 . 0 0 "[ . 1 . 2]" 1 2096 1 57 LEU H 1 59 ARG H 4.334 . 6.682 4.214 3.984 4.534 . 0 0 "[ . 1 . 2]" 1 2097 2 57 LEU H 2 59 ARG H 4.334 . 6.682 4.214 3.979 4.530 . 0 0 "[ . 1 . 2]" 1 2098 1 59 ARG HA 1 60 ILE H 3.771 . 5.548 3.525 3.462 3.566 . 0 0 "[ . 1 . 2]" 1 2099 2 59 ARG HA 2 60 ILE H 3.771 . 5.548 3.526 3.460 3.567 . 0 0 "[ . 1 . 2]" 1 2100 1 59 ARG HB3 1 60 ILE H 4.046 . 6.092 3.016 2.354 4.324 . 0 0 "[ . 1 . 2]" 1 2101 2 59 ARG HB3 2 60 ILE H 4.046 . 6.092 3.017 2.359 4.325 . 0 0 "[ . 1 . 2]" 1 2102 1 60 ILE H 1 62 GLU QB 4.299 . 6.609 4.605 4.372 4.926 . 0 0 "[ . 1 . 2]" 1 2103 2 60 ILE H 2 62 GLU QB 4.299 . 6.609 4.603 4.371 4.924 . 0 0 "[ . 1 . 2]" 1 2104 1 59 ARG HB2 1 60 ILE H 4.183 . 6.370 3.982 3.750 4.114 . 0 0 "[ . 1 . 2]" 1 2105 2 59 ARG HB2 2 60 ILE H 4.183 . 6.370 3.982 3.753 4.113 . 0 0 "[ . 1 . 2]" 1 2106 1 59 ARG HG3 1 60 ILE H 3.575 . 5.173 4.563 2.709 5.249 0.076 2 0 "[ . 1 . 2]" 1 2107 2 59 ARG HG3 2 60 ILE H 3.575 . 5.173 4.562 2.704 5.249 0.076 2 0 "[ . 1 . 2]" 1 2108 1 60 ILE H 1 61 LEU HB2 4.136 . 6.275 4.533 4.417 4.763 . 0 0 "[ . 1 . 2]" 1 2109 2 60 ILE H 2 61 LEU HB2 4.136 . 6.275 4.532 4.420 4.767 . 0 0 "[ . 1 . 2]" 1 2110 1 60 ILE H 1 60 ILE HB 2.935 . 4.012 2.452 2.384 2.662 . 0 0 "[ . 1 . 2]" 1 2111 2 60 ILE H 2 60 ILE HB 2.935 . 4.012 2.452 2.382 2.661 . 0 0 "[ . 1 . 2]" 1 2112 1 60 ILE H 1 61 LEU H 3.157 . 4.403 2.587 2.486 2.742 . 0 0 "[ . 1 . 2]" 1 2113 2 60 ILE H 2 61 LEU H 3.157 . 4.403 2.586 2.486 2.743 . 0 0 "[ . 1 . 2]" 1 2114 1 58 ASP HA 1 61 LEU H 3.734 . 5.477 3.773 3.579 3.946 . 0 0 "[ . 1 . 2]" 1 2115 2 58 ASP HA 2 61 LEU H 3.734 . 5.477 3.771 3.576 3.952 . 0 0 "[ . 1 . 2]" 1 2116 1 61 LEU H 1 62 GLU QB 4.633 . 7.316 4.439 4.291 4.700 . 0 0 "[ . 1 . 2]" 1 2117 2 61 LEU H 2 62 GLU QB 4.633 . 7.316 4.439 4.286 4.703 . 0 0 "[ . 1 . 2]" 1 2118 1 61 LEU H 1 61 LEU HB2 2.584 . 3.419 2.266 2.226 2.323 . 0 0 "[ . 1 . 2]" 1 2119 2 61 LEU H 2 61 LEU HB2 2.584 . 3.419 2.266 2.227 2.323 . 0 0 "[ . 1 . 2]" 1 2120 1 60 ILE HB 1 61 LEU H 2.681 . 3.580 2.577 2.410 2.684 . 0 0 "[ . 1 . 2]" 1 2121 2 60 ILE HB 2 61 LEU H 2.681 . 3.580 2.577 2.416 2.685 . 0 0 "[ . 1 . 2]" 1 2122 1 61 LEU H 1 61 LEU HG 3.160 . 4.408 3.925 3.779 4.049 . 0 0 "[ . 1 . 2]" 1 2123 2 61 LEU H 2 61 LEU HG 3.160 . 4.408 3.926 3.782 4.050 . 0 0 "[ . 1 . 2]" 1 2124 1 61 LEU H 1 61 LEU HB3 3.956 . 5.913 3.543 3.519 3.575 . 0 0 "[ . 1 . 2]" 1 2125 2 61 LEU H 2 61 LEU HB3 3.956 . 5.913 3.543 3.521 3.574 . 0 0 "[ . 1 . 2]" 1 2126 1 62 GLU H 1 62 GLU HA 2.787 . 3.758 2.823 2.786 2.857 . 0 0 "[ . 1 . 2]" 1 2127 2 62 GLU H 2 62 GLU HA 2.787 . 3.758 2.823 2.787 2.854 . 0 0 "[ . 1 . 2]" 1 2128 1 60 ILE HA 1 62 GLU H 3.969 . 5.938 3.946 3.807 4.115 . 0 0 "[ . 1 . 2]" 1 2129 2 60 ILE HA 2 62 GLU H 3.969 . 5.938 3.948 3.801 4.114 . 0 0 "[ . 1 . 2]" 1 2130 1 62 GLU H 1 62 GLU HG3 4.015 . 6.030 3.878 2.428 4.516 . 0 0 "[ . 1 . 2]" 1 2131 2 62 GLU H 2 62 GLU HG3 4.015 . 6.030 3.877 2.419 4.515 . 0 0 "[ . 1 . 2]" 1 2132 1 62 GLU H 1 62 GLU HG2 3.122 . 6.000 4.063 2.276 4.592 . 0 0 "[ . 1 . 2]" 1 2133 2 62 GLU H 2 62 GLU HG2 3.122 . 6.000 4.064 2.283 4.592 . 0 0 "[ . 1 . 2]" 1 2134 1 61 LEU HB2 1 62 GLU H 3.062 . 4.234 3.148 2.983 3.279 . 0 0 "[ . 1 . 2]" 1 2135 2 61 LEU HB2 2 62 GLU H 3.062 . 4.234 3.147 2.979 3.280 . 0 0 "[ . 1 . 2]" 1 2136 1 62 GLU H 1 63 LEU H 2.765 . 3.720 2.617 2.494 2.757 . 0 0 "[ . 1 . 2]" 1 2137 2 62 GLU H 2 63 LEU H 2.765 . 3.720 2.619 2.498 2.762 . 0 0 "[ . 1 . 2]" 1 2138 1 61 LEU H 1 62 GLU H 2.824 . 3.821 2.600 2.539 2.655 . 0 0 "[ . 1 . 2]" 1 2139 2 61 LEU H 2 62 GLU H 2.824 . 3.821 2.600 2.537 2.657 . 0 0 "[ . 1 . 2]" 1 2140 1 62 GLU HA 1 63 LEU H 3.724 . 5.457 3.528 3.501 3.548 . 0 0 "[ . 1 . 2]" 1 2141 2 62 GLU HA 2 63 LEU H 3.724 . 5.457 3.528 3.503 3.549 . 0 0 "[ . 1 . 2]" 1 2142 1 62 GLU HG2 1 63 LEU H 4.137 . 6.277 4.378 3.820 5.071 . 0 0 "[ . 1 . 2]" 1 2143 2 62 GLU HG2 2 63 LEU H 4.137 . 6.277 4.377 3.820 5.067 . 0 0 "[ . 1 . 2]" 1 2144 1 63 LEU H 1 63 LEU QB 3.227 . 3.376 2.264 2.184 2.333 . 0 0 "[ . 1 . 2]" 1 2145 2 63 LEU H 2 63 LEU QB 3.227 . 3.376 2.265 2.186 2.332 . 0 0 "[ . 1 . 2]" 1 2146 1 63 LEU H 1 63 LEU HG 3.392 . 4.830 3.976 3.884 4.056 . 0 0 "[ . 1 . 2]" 1 2147 2 63 LEU H 2 63 LEU HG 3.392 . 4.830 3.977 3.882 4.054 . 0 0 "[ . 1 . 2]" 1 2148 1 63 LEU H 1 64 LEU HB2 4.954 . 8.022 4.739 4.526 4.880 . 0 0 "[ . 1 . 2]" 1 2149 2 63 LEU H 2 64 LEU HB2 4.954 . 8.022 4.739 4.524 4.880 . 0 0 "[ . 1 . 2]" 1 2150 1 49 ILE MG 1 63 LEU H 4.811 . 7.704 6.722 6.340 7.091 . 0 0 "[ . 1 . 2]" 1 2151 2 49 ILE MG 2 63 LEU H 4.811 . 7.704 6.723 6.339 7.087 . 0 0 "[ . 1 . 2]" 1 2152 1 63 LEU H 1 63 LEU HA 2.942 . 4.024 2.816 2.797 2.857 . 0 0 "[ . 1 . 2]" 1 2153 2 63 LEU H 2 63 LEU HA 2.942 . 4.024 2.816 2.795 2.857 . 0 0 "[ . 1 . 2]" 1 2154 1 60 ILE HA 1 63 LEU H 3.555 . 5.135 3.443 3.266 3.789 . 0 0 "[ . 1 . 2]" 1 2155 2 60 ILE HA 2 63 LEU H 3.555 . 5.135 3.444 3.266 3.790 . 0 0 "[ . 1 . 2]" 1 2156 1 31 TYR HE2 1 63 LEU H 5.597 . 9.512 6.595 6.044 7.064 . 0 0 "[ . 1 . 2]" 1 2157 2 31 TYR HE2 2 63 LEU H 5.597 . 9.512 6.595 6.044 7.072 . 0 0 "[ . 1 . 2]" 1 2158 1 61 LEU H 1 63 LEU H 4.690 . 7.439 4.294 4.160 4.445 . 0 0 "[ . 1 . 2]" 1 2159 2 61 LEU H 2 63 LEU H 4.690 . 7.439 4.294 4.162 4.446 . 0 0 "[ . 1 . 2]" 1 2160 1 32 PHE HE2 1 63 LEU H 5.974 . 10.436 7.736 7.232 8.180 . 0 0 "[ . 1 . 2]" 1 2161 2 32 PHE HE2 2 63 LEU H 5.974 . 10.436 7.736 7.236 8.182 . 0 0 "[ . 1 . 2]" 1 2162 1 64 LEU H 1 64 LEU HB3 3.561 . 5.146 3.565 3.514 3.588 . 0 0 "[ . 1 . 2]" 1 2163 2 64 LEU H 2 64 LEU HB3 3.561 . 5.146 3.564 3.515 3.588 . 0 0 "[ . 1 . 2]" 1 2164 1 63 LEU QB 1 64 LEU H 2.918 . 3.982 2.485 2.384 2.638 . 0 0 "[ . 1 . 2]" 1 2165 2 63 LEU QB 2 64 LEU H 2.918 . 3.982 2.486 2.386 2.637 . 0 0 "[ . 1 . 2]" 1 2166 1 63 LEU QD 1 64 LEU H 3.783 . 5.572 3.804 3.707 3.883 . 0 0 "[ . 1 . 2]" 1 2167 2 63 LEU QD 2 64 LEU H 3.783 . 5.572 3.804 3.709 3.884 . 0 0 "[ . 1 . 2]" 1 2168 1 64 LEU H 1 64 LEU HA 2.992 . 4.111 2.832 2.771 2.868 . 0 0 "[ . 1 . 2]" 1 2169 2 64 LEU H 2 64 LEU HA 2.992 . 4.111 2.832 2.771 2.870 . 0 0 "[ . 1 . 2]" 1 2170 1 63 LEU HA 1 64 LEU H 3.585 . 5.192 3.535 3.511 3.551 . 0 0 "[ . 1 . 2]" 1 2171 2 63 LEU HA 2 64 LEU H 3.585 . 5.192 3.535 3.510 3.550 . 0 0 "[ . 1 . 2]" 1 2172 1 62 GLU HA 1 64 LEU H 3.882 . 5.766 4.474 4.220 4.601 . 0 0 "[ . 1 . 2]" 1 2173 2 62 GLU HA 2 64 LEU H 3.882 . 5.766 4.473 4.211 4.602 . 0 0 "[ . 1 . 2]" 1 2174 1 61 LEU HA 1 64 LEU H 3.093 . 4.289 3.067 2.894 3.321 . 0 0 "[ . 1 . 2]" 1 2175 2 61 LEU HA 2 64 LEU H 3.093 . 4.289 3.067 2.895 3.323 . 0 0 "[ . 1 . 2]" 1 2176 1 60 ILE HA 1 64 LEU H 4.487 . 7.003 4.760 4.267 5.380 . 0 0 "[ . 1 . 2]" 1 2177 2 60 ILE HA 2 64 LEU H 4.487 . 7.003 4.761 4.265 5.382 . 0 0 "[ . 1 . 2]" 1 2178 1 64 LEU H 1 64 LEU HG 2.677 . 3.573 2.506 2.349 2.848 . 0 0 "[ . 1 . 2]" 1 2179 2 64 LEU H 2 64 LEU HG 2.677 . 3.573 2.507 2.350 2.850 . 0 0 "[ . 1 . 2]" 1 2180 1 64 LEU H 1 64 LEU MD1 3.343 . 4.740 3.609 3.539 3.690 . 0 0 "[ . 1 . 2]" 1 2181 2 64 LEU H 2 64 LEU MD1 3.343 . 4.740 3.609 3.540 3.690 . 0 0 "[ . 1 . 2]" 1 2182 1 63 LEU QB 1 65 SER H 4.584 . 7.211 4.403 4.238 4.624 . 0 0 "[ . 1 . 2]" 1 2183 2 63 LEU QB 2 65 SER H 4.584 . 7.211 4.404 4.240 4.628 . 0 0 "[ . 1 . 2]" 1 2184 1 65 SER H 1 65 SER HA 2.468 . 3.230 2.872 2.837 2.911 . 0 0 "[ . 1 . 2]" 1 2185 2 65 SER H 2 65 SER HA 2.468 . 3.230 2.873 2.837 2.911 . 0 0 "[ . 1 . 2]" 1 2186 1 65 SER H 1 66 GLU HA 4.829 . 7.745 4.681 4.540 4.783 . 0 0 "[ . 1 . 2]" 1 2187 2 65 SER H 2 66 GLU HA 4.829 . 7.745 4.680 4.534 4.777 . 0 0 "[ . 1 . 2]" 1 2188 1 62 GLU HA 1 65 SER H 3.151 . 4.392 3.327 3.033 3.485 . 0 0 "[ . 1 . 2]" 1 2189 2 62 GLU HA 2 65 SER H 3.151 . 4.392 3.327 3.031 3.487 . 0 0 "[ . 1 . 2]" 1 2190 1 65 SER H 1 65 SER QB 2.780 . 3.107 2.365 2.253 2.516 . 0 0 "[ . 1 . 2]" 1 2191 2 65 SER H 2 65 SER QB 2.780 . 3.107 2.365 2.245 2.513 . 0 0 "[ . 1 . 2]" 1 2192 1 65 SER H 1 66 GLU HB2 3.999 . 5.998 4.922 4.593 5.209 . 0 0 "[ . 1 . 2]" 1 2193 2 65 SER H 2 66 GLU HB2 3.999 . 5.998 4.922 4.583 5.206 . 0 0 "[ . 1 . 2]" 1 2194 1 64 LEU HB3 1 65 SER H 3.397 . 4.840 3.785 3.404 4.024 . 0 0 "[ . 1 . 2]" 1 2195 2 64 LEU HB3 2 65 SER H 3.397 . 4.840 3.785 3.406 4.034 . 0 0 "[ . 1 . 2]" 1 2196 1 64 LEU HB2 1 65 SER H 3.025 . 4.169 2.976 2.714 3.263 . 0 0 "[ . 1 . 2]" 1 2197 2 64 LEU HB2 2 65 SER H 3.025 . 4.169 2.976 2.709 3.274 . 0 0 "[ . 1 . 2]" 1 2198 1 65 SER H 2 32 PHE HE2 5.374 . 8.984 7.472 6.133 8.591 . 0 0 "[ . 1 . 2]" 1 2199 1 32 PHE HE2 2 65 SER H 5.374 . 8.984 7.467 6.126 8.566 . 0 0 "[ . 1 . 2]" 1 2200 1 62 GLU HA 1 66 GLU H 4.091 . 6.183 4.469 3.917 5.911 . 0 0 "[ . 1 . 2]" 1 2201 2 62 GLU HA 2 66 GLU H 4.091 . 6.183 4.469 3.919 5.915 . 0 0 "[ . 1 . 2]" 1 2202 1 66 GLU H 1 66 GLU HA 2.191 . 2.791 2.349 2.265 2.782 . 0 0 "[ . 1 . 2]" 1 2203 2 66 GLU H 2 66 GLU HA 2.191 . 2.791 2.348 2.267 2.783 . 0 0 "[ . 1 . 2]" 1 2204 1 65 SER QB 1 66 GLU H . . 3.065 2.950 2.486 3.966 0.901 16 3 "[ . -1 *+ 2]" 1 2205 2 65 SER QB 2 66 GLU H . . 3.065 2.950 2.489 3.966 0.901 16 3 "[ . -1 *+ 2]" 1 2206 1 66 GLU H 1 66 GLU HG3 3.840 . 5.683 4.464 4.374 4.839 . 0 0 "[ . 1 . 2]" 1 2207 2 66 GLU H 2 66 GLU HG3 3.840 . 5.683 4.465 4.376 4.842 . 0 0 "[ . 1 . 2]" 1 2208 1 66 GLU H 1 66 GLU HG2 3.561 . 5.146 4.797 4.249 5.116 . 0 0 "[ . 1 . 2]" 1 2209 2 66 GLU H 2 66 GLU HG2 3.561 . 5.146 4.797 4.246 5.115 . 0 0 "[ . 1 . 2]" 1 2210 1 66 GLU H 1 66 GLU HB3 2.734 . 3.669 3.378 2.457 3.579 . 0 0 "[ . 1 . 2]" 1 2211 2 66 GLU H 2 66 GLU HB3 2.734 . 3.669 3.379 2.460 3.578 . 0 0 "[ . 1 . 2]" 1 2212 1 66 GLU H 1 66 GLU HB2 2.218 . 2.833 2.876 2.251 2.996 0.163 18 0 "[ . 1 . 2]" 1 2213 2 66 GLU H 2 66 GLU HB2 2.218 . 2.833 2.877 2.249 2.999 0.166 18 0 "[ . 1 . 2]" 1 2214 1 64 LEU HB3 1 66 GLU H 4.395 . 6.809 5.425 4.904 5.888 . 0 0 "[ . 1 . 2]" 1 2215 2 64 LEU HB3 2 66 GLU H 4.395 . 6.809 5.425 4.906 5.894 . 0 0 "[ . 1 . 2]" 1 2216 1 66 GLU H 2 63 LEU QD 4.179 . 6.362 3.616 2.600 4.039 . 0 0 "[ . 1 . 2]" 1 2217 1 63 LEU QD 2 66 GLU H 4.179 . 6.362 3.616 2.587 4.040 . 0 0 "[ . 1 . 2]" 1 2218 1 65 SER H 1 66 GLU H 2.440 . 3.184 2.535 2.310 3.249 0.065 16 0 "[ . 1 . 2]" 1 2219 2 65 SER H 2 66 GLU H 2.440 . 3.184 2.534 2.305 3.254 0.070 16 0 "[ . 1 . 2]" 1 2220 1 66 GLU H 1 68 GLU H 4.423 . 6.869 5.103 4.698 5.984 . 0 0 "[ . 1 . 2]" 1 2221 2 66 GLU H 2 68 GLU H 4.423 . 6.869 5.102 4.683 5.987 . 0 0 "[ . 1 . 2]" 1 2222 1 67 ARG H 1 67 ARG HA 2.361 . 3.058 2.897 2.865 2.935 . 0 0 "[ . 1 . 2]" 1 2223 2 67 ARG H 2 67 ARG HA 2.361 . 3.058 2.896 2.862 2.934 . 0 0 "[ . 1 . 2]" 1 2224 1 66 GLU HA 1 67 ARG H 1.943 . 2.415 2.365 2.091 2.590 0.175 19 0 "[ . 1 . 2]" 1 2225 2 66 GLU HA 2 67 ARG H 1.943 . 2.415 2.366 2.092 2.585 0.170 19 0 "[ . 1 . 2]" 1 2226 1 67 ARG H 1 68 GLU HG3 3.448 . 4.934 4.322 3.095 5.441 0.507 1 1 "[+ . 1 . 2]" 1 2227 2 67 ARG H 2 68 GLU HG3 3.448 . 4.934 4.326 3.094 5.442 0.508 1 1 "[+ . 1 . 2]" 1 2228 1 66 GLU HB3 1 67 ARG H 3.142 . 4.376 4.392 4.166 4.469 0.093 8 0 "[ . 1 . 2]" 1 2229 2 66 GLU HB3 2 67 ARG H 3.142 . 4.376 4.392 4.167 4.467 0.091 8 0 "[ . 1 . 2]" 1 2230 1 67 ARG H 1 67 ARG QB . . 2.850 2.874 2.532 3.303 0.453 16 0 "[ . 1 . 2]" 1 2231 2 67 ARG H 2 67 ARG QB . . 2.850 2.873 2.535 3.304 0.454 16 0 "[ . 1 . 2]" 1 2232 1 67 ARG H 2 63 LEU QD 4.848 . 7.786 5.573 5.296 5.940 . 0 0 "[ . 1 . 2]" 1 2233 1 63 LEU QD 2 67 ARG H 4.848 . 7.786 5.570 5.280 5.930 . 0 0 "[ . 1 . 2]" 1 2234 1 67 ARG H 1 67 ARG QD 3.363 . 4.776 2.978 2.410 3.852 . 0 0 "[ . 1 . 2]" 1 2235 2 67 ARG H 2 67 ARG QD 3.363 . 4.776 2.981 2.416 3.858 . 0 0 "[ . 1 . 2]" 1 2236 1 67 ARG H 1 67 ARG HG3 1.993 . 2.489 1.952 1.750 2.457 . 0 0 "[ . 1 . 2]" 1 2237 2 67 ARG H 2 67 ARG HG3 1.993 . 2.489 1.951 1.741 2.456 . 0 0 "[ . 1 . 2]" 1 2238 1 67 ARG H 1 69 SER H 4.256 . 6.520 4.176 3.414 4.581 . 0 0 "[ . 1 . 2]" 1 2239 2 67 ARG H 2 69 SER H 4.256 . 6.520 4.177 3.421 4.616 . 0 0 "[ . 1 . 2]" 1 2240 1 66 GLU HA 1 68 GLU H 3.004 . 4.132 3.185 2.935 3.509 . 0 0 "[ . 1 . 2]" 1 2241 2 66 GLU HA 2 68 GLU H 3.004 . 4.132 3.186 2.941 3.508 . 0 0 "[ . 1 . 2]" 1 2242 1 67 ARG QD 1 68 GLU H 2.824 . 3.821 2.921 2.321 5.108 1.287 2 1 "[ + . 1 . 2]" 1 2243 2 67 ARG QD 2 68 GLU H 2.824 . 3.821 2.921 2.320 5.112 1.291 2 1 "[ + . 1 . 2]" 1 2244 1 68 GLU H 1 68 GLU HG3 2.215 . 2.828 3.045 2.450 3.790 0.962 1 6 "[+ - *** 1* . 2]" 1 2245 2 68 GLU H 2 68 GLU HG3 2.215 . 2.828 3.044 2.454 3.788 0.960 1 6 "[+ - *** 1* . 2]" 1 2246 1 68 GLU H 1 68 GLU QB . . 2.373 2.451 2.317 3.037 0.664 16 2 "[ . -1 .+ 2]" 1 2247 2 68 GLU H 2 68 GLU QB . . 2.373 2.450 2.316 3.035 0.662 16 2 "[ . -1 .+ 2]" 1 2248 1 67 ARG QB 1 68 GLU H 3.037 . 4.190 3.803 3.148 3.992 . 0 0 "[ . 1 . 2]" 1 2249 2 67 ARG QB 2 68 GLU H 3.037 . 4.190 3.803 3.151 3.992 . 0 0 "[ . 1 . 2]" 1 2250 1 67 ARG HG3 1 68 GLU H 3.083 . 4.271 3.562 2.953 4.325 0.054 16 0 "[ . 1 . 2]" 1 2251 2 67 ARG HG3 2 68 GLU H 3.083 . 4.271 3.561 2.959 4.327 0.056 16 0 "[ . 1 . 2]" 1 2252 1 67 ARG QD 1 69 SER H 4.271 . 6.551 4.746 4.401 6.547 . 0 0 "[ . 1 . 2]" 1 2253 2 67 ARG QD 2 69 SER H 4.271 . 6.551 4.747 4.400 6.544 . 0 0 "[ . 1 . 2]" 1 2254 1 67 ARG QB 1 69 SER H 4.548 . 5.250 4.834 4.441 5.935 0.685 8 2 "[ . + 1 . - 2]" 1 2255 2 67 ARG QB 2 69 SER H 4.548 . 5.250 4.836 4.437 5.942 0.692 8 2 "[ . + 1 . - 2]" 1 2256 1 68 GLU HA 1 69 SER H 2.040 . 6.000 3.269 3.003 3.556 . 0 0 "[ . 1 . 2]" 1 2257 2 68 GLU HA 2 69 SER H 2.040 . 6.000 3.271 3.006 3.558 . 0 0 "[ . 1 . 2]" 1 2258 1 69 SER H 1 69 SER HA 2.404 . 3.127 2.802 2.263 2.943 . 0 0 "[ . 1 . 2]" 1 2259 2 69 SER H 2 69 SER HA 2.404 . 3.127 2.802 2.266 2.941 . 0 0 "[ . 1 . 2]" 1 2260 1 68 GLU QB 1 69 SER H 3.343 . 3.991 3.247 2.132 3.797 . 0 0 "[ . 1 . 2]" 1 2261 2 68 GLU QB 2 69 SER H 3.343 . 3.991 3.244 2.122 3.791 . 0 0 "[ . 1 . 2]" 1 2262 1 68 GLU H 1 69 SER H 2.212 . 2.824 2.436 1.949 2.706 . 0 0 "[ . 1 . 2]" 1 2263 2 68 GLU H 2 69 SER H 2.212 . 2.824 2.435 1.949 2.691 . 0 0 "[ . 1 . 2]" 1 2264 1 16 VAL HA 1 18 ASP H 5.466 . 9.200 5.939 5.574 6.186 . 0 0 "[ . 1 . 2]" 1 2265 2 16 VAL HA 2 18 ASP H 5.466 . 9.200 5.940 5.571 6.184 . 0 0 "[ . 1 . 2]" 1 2266 1 18 ASP H 1 18 ASP HA 2.898 . 3.947 2.828 2.799 2.851 . 0 0 "[ . 1 . 2]" 1 2267 2 18 ASP H 2 18 ASP HA 2.898 . 3.947 2.828 2.800 2.851 . 0 0 "[ . 1 . 2]" 1 2268 1 17 LYS HB2 1 18 ASP H 4.017 . 6.034 4.052 3.050 4.360 . 0 0 "[ . 1 . 2]" 1 2269 2 17 LYS HB2 2 18 ASP H 4.017 . 6.034 4.050 3.047 4.362 . 0 0 "[ . 1 . 2]" 1 2270 1 17 LYS QD 1 18 ASP H 5.106 . 8.365 5.264 4.968 5.560 . 0 0 "[ . 1 . 2]" 1 2271 2 17 LYS QD 2 18 ASP H 5.106 . 8.365 5.262 4.966 5.565 . 0 0 "[ . 1 . 2]" 1 2272 1 18 ASP H 1 21 LEU QD 4.105 . 6.212 4.123 3.970 4.268 . 0 0 "[ . 1 . 2]" 1 2273 2 18 ASP H 2 21 LEU QD 4.105 . 6.212 4.123 3.963 4.272 . 0 0 "[ . 1 . 2]" 1 2274 1 16 VAL QG 1 18 ASP H 3.877 . 5.756 3.981 3.540 4.546 . 0 0 "[ . 1 . 2]" 1 2275 2 16 VAL QG 2 18 ASP H 3.877 . 5.756 3.983 3.538 4.548 . 0 0 "[ . 1 . 2]" 1 2276 1 18 ASP H 1 40 ARG QG 4.679 . 7.415 5.020 4.377 5.736 . 0 0 "[ . 1 . 2]" 1 2277 2 18 ASP H 2 40 ARG QG 4.679 . 7.415 5.021 4.380 5.739 . 0 0 "[ . 1 . 2]" 1 2278 1 21 LEU HA 1 24 ARG H 3.377 . 4.802 3.411 3.186 3.707 . 0 0 "[ . 1 . 2]" 1 2279 2 21 LEU HA 2 24 ARG H 3.377 . 4.802 3.410 3.186 3.707 . 0 0 "[ . 1 . 2]" 1 2280 1 24 ARG H 1 24 ARG HD3 5.203 . 8.587 4.948 4.346 5.050 . 0 0 "[ . 1 . 2]" 1 2281 2 24 ARG H 2 24 ARG HD3 5.203 . 8.587 4.947 4.351 5.046 . 0 0 "[ . 1 . 2]" 1 2282 1 24 ARG H 1 24 ARG HD2 4.553 . 7.144 4.312 4.159 4.776 . 0 0 "[ . 1 . 2]" 1 2283 2 24 ARG H 2 24 ARG HD2 4.553 . 7.144 4.310 4.162 4.782 . 0 0 "[ . 1 . 2]" 1 2284 1 23 GLU QB 1 24 ARG H 3.270 . 4.607 3.068 2.527 3.630 . 0 0 "[ . 1 . 2]" 1 2285 2 23 GLU QB 2 24 ARG H 3.270 . 4.607 3.068 2.533 3.626 . 0 0 "[ . 1 . 2]" 1 2286 1 23 GLU HG3 1 24 ARG H 4.203 . 6.411 3.810 2.500 5.256 . 0 0 "[ . 1 . 2]" 1 2287 2 23 GLU HG3 2 24 ARG H 4.203 . 6.411 3.808 2.502 5.253 . 0 0 "[ . 1 . 2]" 1 2288 1 24 ARG H 1 24 ARG HG3 3.833 . 5.670 2.518 2.391 2.691 . 0 0 "[ . 1 . 2]" 1 2289 2 24 ARG H 2 24 ARG HG3 3.833 . 5.670 2.518 2.393 2.693 . 0 0 "[ . 1 . 2]" 1 2290 1 24 ARG H 1 24 ARG HG2 2.730 . 3.662 3.567 3.442 3.749 0.087 4 0 "[ . 1 . 2]" 1 2291 2 24 ARG H 2 24 ARG HG2 2.730 . 3.662 3.567 3.444 3.753 0.091 4 0 "[ . 1 . 2]" 1 2292 1 24 ARG H 1 24 ARG HB2 3.018 . 4.157 2.464 2.374 2.537 . 0 0 "[ . 1 . 2]" 1 2293 2 24 ARG H 2 24 ARG HB2 3.018 . 4.157 2.463 2.375 2.541 . 0 0 "[ . 1 . 2]" 1 2294 1 24 ARG H 1 26 SER H 3.744 . 5.496 3.980 3.840 4.101 . 0 0 "[ . 1 . 2]" 1 2295 2 24 ARG H 2 26 SER H 3.744 . 5.496 3.981 3.842 4.103 . 0 0 "[ . 1 . 2]" 1 2296 1 24 ARG H 2 61 LEU MD2 4.266 . 6.541 4.483 4.037 4.740 . 0 0 "[ . 1 . 2]" 1 2297 1 61 LEU MD2 2 24 ARG H 4.266 . 6.541 4.482 4.045 4.726 . 0 0 "[ . 1 . 2]" 1 2298 1 20 VAL HA 1 24 ARG H 4.632 . 7.313 4.654 4.361 5.071 . 0 0 "[ . 1 . 2]" 1 2299 2 20 VAL HA 2 24 ARG H 4.632 . 7.313 4.653 4.359 5.070 . 0 0 "[ . 1 . 2]" 1 2300 1 24 ARG H 1 26 SER QB 4.756 . 7.583 5.051 4.677 5.800 . 0 0 "[ . 1 . 2]" 1 2301 2 24 ARG H 2 26 SER QB 4.756 . 7.583 5.053 4.692 5.802 . 0 0 "[ . 1 . 2]" 1 2302 1 24 ARG H 1 25 GLU HA 5.417 . 9.085 5.084 4.989 5.228 . 0 0 "[ . 1 . 2]" 1 2303 2 24 ARG H 2 25 GLU HA 5.417 . 9.085 5.083 4.992 5.221 . 0 0 "[ . 1 . 2]" 1 2304 1 64 LEU HG 1 65 SER H 3.920 . 5.841 4.598 4.411 4.845 . 0 0 "[ . 1 . 2]" 1 2305 2 64 LEU HG 2 65 SER H 3.920 . 5.841 4.599 4.410 4.845 . 0 0 "[ . 1 . 2]" 1 2306 1 68 GLU H 1 68 GLU HG2 3.522 . 5.072 3.159 2.103 3.979 . 0 0 "[ . 1 . 2]" 1 2307 2 68 GLU H 2 68 GLU HG2 3.522 . 5.072 3.157 2.088 3.966 . 0 0 "[ . 1 . 2]" 1 2308 1 31 TYR HE2 1 32 PHE H 4.945 . 8.001 6.309 5.896 6.731 . 0 0 "[ . 1 . 2]" 1 2309 2 31 TYR HE2 2 32 PHE H 4.945 . 8.001 6.308 5.896 6.738 . 0 0 "[ . 1 . 2]" 1 2310 1 30 ASN HB2 1 31 TYR H 3.171 . 4.428 3.033 2.886 3.186 . 0 0 "[ . 1 . 2]" 1 2311 2 30 ASN HB2 2 31 TYR H 3.171 . 4.428 3.033 2.882 3.192 . 0 0 "[ . 1 . 2]" 1 2312 1 30 ASN HB3 1 31 TYR H 3.903 . 5.807 3.816 3.660 3.969 . 0 0 "[ . 1 . 2]" 1 2313 2 30 ASN HB3 2 31 TYR H 3.903 . 5.807 3.817 3.665 3.971 . 0 0 "[ . 1 . 2]" 1 2314 1 29 GLN HG3 1 31 TYR H 5.199 . 8.578 6.151 5.970 6.293 . 0 0 "[ . 1 . 2]" 1 2315 2 29 GLN HG3 2 31 TYR H 5.199 . 8.578 6.150 5.974 6.296 . 0 0 "[ . 1 . 2]" 1 2316 1 28 LEU HA 1 31 TYR H 3.514 . 5.058 3.359 3.225 3.499 . 0 0 "[ . 1 . 2]" 1 2317 2 28 LEU HA 2 31 TYR H 3.514 . 5.058 3.360 3.224 3.500 . 0 0 "[ . 1 . 2]" 1 2318 1 27 TYR HD2 1 31 TYR H 5.413 . 9.076 5.795 5.339 6.262 . 0 0 "[ . 1 . 2]" 1 2319 2 27 TYR HD2 2 31 TYR H 5.413 . 9.076 5.796 5.329 6.253 . 0 0 "[ . 1 . 2]" 1 2320 1 30 ASN HD21 1 31 TYR H 6.868 . 12.764 5.095 4.644 5.332 . 0 0 "[ . 1 . 2]" 1 2321 2 30 ASN HD21 2 31 TYR H 6.868 . 12.764 5.096 4.646 5.347 . 0 0 "[ . 1 . 2]" 1 2322 1 27 TYR HE2 1 31 TYR H 5.849 . 10.126 6.407 5.976 6.864 . 0 0 "[ . 1 . 2]" 1 2323 2 27 TYR HE2 2 31 TYR H 5.849 . 10.126 6.408 5.974 6.874 . 0 0 "[ . 1 . 2]" 1 2324 1 31 TYR H 1 31 TYR HE2 5.346 . 8.918 7.176 7.140 7.224 . 0 0 "[ . 1 . 2]" 1 2325 2 31 TYR H 2 31 TYR HE2 5.346 . 8.918 7.176 7.136 7.225 . 0 0 "[ . 1 . 2]" 1 2326 1 31 TYR H 1 31 TYR HD2 4.762 . 7.596 5.009 4.936 5.104 . 0 0 "[ . 1 . 2]" 1 2327 2 31 TYR H 2 31 TYR HD2 4.762 . 7.596 5.008 4.933 5.103 . 0 0 "[ . 1 . 2]" 1 2328 1 31 TYR H 1 32 PHE HD2 5.413 . 9.076 5.890 5.079 6.520 . 0 0 "[ . 1 . 2]" 1 2329 2 31 TYR H 2 32 PHE HD2 5.413 . 9.076 5.888 5.086 6.503 . 0 0 "[ . 1 . 2]" 1 2330 1 29 GLN H 1 31 TYR H 4.291 . 6.592 4.002 3.856 4.117 . 0 0 "[ . 1 . 2]" 1 2331 2 29 GLN H 2 31 TYR H 4.291 . 6.592 4.001 3.855 4.119 . 0 0 "[ . 1 . 2]" 1 2332 1 31 TYR H 1 32 PHE H 3.187 . 4.456 2.740 2.533 2.865 . 0 0 "[ . 1 . 2]" 1 2333 2 31 TYR H 2 32 PHE H 3.187 . 4.456 2.738 2.523 2.872 . 0 0 "[ . 1 . 2]" 1 2334 1 30 ASN HA 1 31 TYR H 3.866 . 5.735 3.480 3.422 3.518 . 0 0 "[ . 1 . 2]" 1 2335 2 30 ASN HA 2 31 TYR H 3.866 . 5.735 3.480 3.422 3.515 . 0 0 "[ . 1 . 2]" 1 2336 1 31 TYR H 1 63 LEU QD 4.702 . 7.377 6.284 5.678 7.379 0.002 8 0 "[ . 1 . 2]" 1 2337 2 31 TYR H 2 63 LEU QD 4.702 . 7.377 6.284 5.682 7.377 . 0 0 "[ . 1 . 2]" 1 2338 1 27 TYR HD2 1 32 PHE H 6.213 . 11.039 7.363 6.915 7.917 . 0 0 "[ . 1 . 2]" 1 2339 2 27 TYR HD2 2 32 PHE H 6.213 . 11.039 7.362 6.912 7.913 . 0 0 "[ . 1 . 2]" 1 2340 1 27 TYR HE2 1 32 PHE H 6.859 . 12.739 7.543 7.170 8.039 . 0 0 "[ . 1 . 2]" 1 2341 2 27 TYR HE2 2 32 PHE H 6.859 . 12.739 7.542 7.165 8.042 . 0 0 "[ . 1 . 2]" 1 2342 1 44 LYS HB2 1 45 GLY H 3.647 . 5.309 4.013 3.393 4.486 . 0 0 "[ . 1 . 2]" 1 2343 2 44 LYS HB2 2 45 GLY H 3.647 . 5.309 4.012 3.394 4.487 . 0 0 "[ . 1 . 2]" 1 2344 1 51 PHE HD2 1 56 ASP H 5.712 . 9.791 5.929 5.149 7.983 . 0 0 "[ . 1 . 2]" 1 2345 2 51 PHE HD2 2 56 ASP H 5.712 . 9.791 5.928 5.155 7.977 . 0 0 "[ . 1 . 2]" 1 2346 1 55 GLU HA 1 56 ASP H 3.798 . 5.601 3.554 3.534 3.577 . 0 0 "[ . 1 . 2]" 1 2347 2 55 GLU HA 2 56 ASP H 3.798 . 5.601 3.554 3.535 3.573 . 0 0 "[ . 1 . 2]" 1 2348 1 56 ASP H 1 57 LEU HA 5.479 . 9.232 5.225 5.125 5.316 . 0 0 "[ . 1 . 2]" 1 2349 2 56 ASP H 2 57 LEU HA 5.479 . 9.232 5.224 5.127 5.325 . 0 0 "[ . 1 . 2]" 1 2350 1 56 ASP H 1 56 ASP QB 2.973 . 4.078 2.552 2.426 2.847 . 0 0 "[ . 1 . 2]" 1 2351 2 56 ASP H 2 56 ASP QB 2.973 . 4.078 2.550 2.429 2.848 . 0 0 "[ . 1 . 2]" 1 2352 1 51 PHE HB2 1 56 ASP H 4.756 . 7.583 4.349 4.050 5.000 . 0 0 "[ . 1 . 2]" 1 2353 2 51 PHE HB2 2 56 ASP H 4.756 . 7.583 4.347 4.049 4.993 . 0 0 "[ . 1 . 2]" 1 2354 1 55 GLU HG3 1 56 ASP H 5.222 . 8.631 4.424 3.662 4.977 . 0 0 "[ . 1 . 2]" 1 2355 2 55 GLU HG3 2 56 ASP H 5.222 . 8.631 4.425 3.660 4.983 . 0 0 "[ . 1 . 2]" 1 2356 1 56 ASP H 1 60 ILE MD 4.697 . 7.455 5.228 5.024 5.805 . 0 0 "[ . 1 . 2]" 1 2357 2 56 ASP H 2 60 ILE MD 4.697 . 7.455 5.227 5.023 5.810 . 0 0 "[ . 1 . 2]" 1 2358 1 52 PHE H 1 56 ASP H 4.864 . 7.821 5.059 4.520 5.463 . 0 0 "[ . 1 . 2]" 1 2359 2 52 PHE H 2 56 ASP H 4.864 . 7.821 5.059 4.528 5.464 . 0 0 "[ . 1 . 2]" 1 2360 1 20 VAL H 1 21 LEU H 2.088 . 2.633 2.515 2.448 2.581 . 0 0 "[ . 1 . 2]" 1 2361 2 20 VAL H 2 21 LEU H 2.088 . 2.633 2.513 2.446 2.579 . 0 0 "[ . 1 . 2]" 1 2362 1 20 VAL H 1 24 ARG H 5.405 . 9.057 6.328 6.202 6.507 . 0 0 "[ . 1 . 2]" 1 2363 2 20 VAL H 2 24 ARG H 5.405 . 9.057 6.326 6.197 6.504 . 0 0 "[ . 1 . 2]" 1 2364 1 21 LEU H 1 22 LYS H 2.352 . 3.044 2.499 2.244 2.638 . 0 0 "[ . 1 . 2]" 1 2365 2 21 LEU H 2 22 LYS H 2.352 . 3.044 2.499 2.242 2.637 . 0 0 "[ . 1 . 2]" 1 2366 1 22 LYS H 1 23 GLU H 2.483 . 3.254 2.672 2.506 2.802 . 0 0 "[ . 1 . 2]" 1 2367 2 22 LYS H 2 23 GLU H 2.483 . 3.254 2.672 2.506 2.810 . 0 0 "[ . 1 . 2]" 1 2368 1 28 LEU H 1 31 TYR H 4.848 . 7.786 4.663 4.591 4.739 . 0 0 "[ . 1 . 2]" 1 2369 2 28 LEU H 2 31 TYR H 4.848 . 7.786 4.664 4.594 4.741 . 0 0 "[ . 1 . 2]" 1 2370 1 25 GLU H 1 28 LEU H 5.016 . 8.161 4.711 4.640 4.817 . 0 0 "[ . 1 . 2]" 1 2371 2 25 GLU H 2 28 LEU H 5.016 . 8.161 4.711 4.637 4.818 . 0 0 "[ . 1 . 2]" 1 2372 1 29 GLN H 1 32 PHE H 5.120 . 8.397 5.221 4.957 5.424 . 0 0 "[ . 1 . 2]" 1 2373 2 29 GLN H 2 32 PHE H 5.120 . 8.397 5.221 4.958 5.423 . 0 0 "[ . 1 . 2]" 1 2374 1 29 GLN H 1 33 GLY H 5.646 . 9.631 5.994 5.797 6.203 . 0 0 "[ . 1 . 2]" 1 2375 2 29 GLN H 2 33 GLY H 5.646 . 9.631 5.991 5.796 6.204 . 0 0 "[ . 1 . 2]" 1 2376 1 29 GLN H 1 34 THR H 5.527 . 9.346 5.626 5.430 5.735 . 0 0 "[ . 1 . 2]" 1 2377 2 29 GLN H 2 34 THR H 5.527 . 9.346 5.625 5.428 5.733 . 0 0 "[ . 1 . 2]" 1 2378 1 29 GLN H 1 36 VAL H 6.166 . 10.918 5.272 5.101 5.450 . 0 0 "[ . 1 . 2]" 1 2379 2 29 GLN H 2 36 VAL H 6.166 . 10.918 5.272 5.098 5.451 . 0 0 "[ . 1 . 2]" 1 2380 1 34 THR H 1 35 THR H 3.694 . 5.400 4.369 4.356 4.385 . 0 0 "[ . 1 . 2]" 1 2381 2 34 THR H 2 35 THR H 3.694 . 5.400 4.369 4.356 4.382 . 0 0 "[ . 1 . 2]" 1 2382 1 29 GLN HE21 1 34 THR H 5.751 . 9.885 7.647 7.353 7.843 . 0 0 "[ . 1 . 2]" 1 2383 2 29 GLN HE21 2 34 THR H 5.751 . 9.885 7.646 7.351 7.843 . 0 0 "[ . 1 . 2]" 1 2384 1 29 GLN HE21 1 33 GLY H 5.684 . 9.723 9.213 8.836 9.564 . 0 0 "[ . 1 . 2]" 1 2385 2 29 GLN HE21 2 33 GLY H 5.684 . 9.723 9.210 8.836 9.552 . 0 0 "[ . 1 . 2]" 1 2386 1 35 THR H 1 37 ASN HD21 5.704 . 9.771 7.240 6.907 8.003 . 0 0 "[ . 1 . 2]" 1 2387 2 35 THR H 2 37 ASN HD21 5.704 . 9.771 7.241 6.907 7.979 . 0 0 "[ . 1 . 2]" 1 2388 1 37 ASN H 1 49 ILE H 4.960 . 8.036 5.128 5.045 5.301 . 0 0 "[ . 1 . 2]" 1 2389 2 37 ASN H 2 49 ILE H 4.960 . 8.036 5.129 5.046 5.302 . 0 0 "[ . 1 . 2]" 1 2390 1 31 TYR HD2 1 34 THR H 6.100 . 10.751 7.830 7.413 8.326 . 0 0 "[ . 1 . 2]" 1 2391 2 31 TYR HD2 2 34 THR H 6.100 . 10.751 7.831 7.421 8.322 . 0 0 "[ . 1 . 2]" 1 2392 1 51 PHE H 1 53 SER H 4.945 . 8.002 5.299 5.088 5.641 . 0 0 "[ . 1 . 2]" 1 2393 2 51 PHE H 2 53 SER H 4.945 . 8.002 5.297 5.088 5.636 . 0 0 "[ . 1 . 2]" 1 2394 1 53 SER H 1 55 GLU H 4.781 . 7.639 4.737 4.332 5.004 . 0 0 "[ . 1 . 2]" 1 2395 2 53 SER H 2 55 GLU H 4.781 . 7.639 4.737 4.341 4.995 . 0 0 "[ . 1 . 2]" 1 2396 1 57 LEU H 1 61 LEU H 5.573 . 9.456 6.026 5.851 6.214 . 0 0 "[ . 1 . 2]" 1 2397 2 57 LEU H 2 61 LEU H 5.573 . 9.456 6.026 5.851 6.214 . 0 0 "[ . 1 . 2]" 1 2398 1 59 ARG H 1 59 ARG HE 5.160 . 8.488 4.776 4.313 5.756 . 0 0 "[ . 1 . 2]" 1 2399 2 59 ARG H 2 59 ARG HE 5.160 . 8.488 4.777 4.315 5.748 . 0 0 "[ . 1 . 2]" 1 2400 1 59 ARG HE 1 60 ILE H 5.106 . 8.364 4.436 3.844 5.520 . 0 0 "[ . 1 . 2]" 1 2401 2 59 ARG HE 2 60 ILE H 5.106 . 8.364 4.438 3.852 5.525 . 0 0 "[ . 1 . 2]" 1 2402 1 57 LEU H 1 60 ILE H 4.826 . 7.737 4.705 4.609 4.849 . 0 0 "[ . 1 . 2]" 1 2403 2 57 LEU H 2 60 ILE H 4.826 . 7.737 4.704 4.609 4.851 . 0 0 "[ . 1 . 2]" 1 2404 1 59 ARG HE 1 62 GLU H 6.392 . 11.500 7.400 7.012 8.039 . 0 0 "[ . 1 . 2]" 1 2405 2 59 ARG HE 2 62 GLU H 6.392 . 11.500 7.402 7.009 8.046 . 0 0 "[ . 1 . 2]" 1 2406 1 67 ARG H 1 68 GLU H 1.946 . 2.419 2.306 1.786 2.516 0.097 4 0 "[ . 1 . 2]" 1 2407 2 67 ARG H 2 68 GLU H 1.946 . 2.419 2.310 1.792 2.517 0.098 4 0 "[ . 1 . 2]" 1 2408 1 64 LEU H 1 65 SER H 2.340 . 3.025 2.565 2.406 2.762 . 0 0 "[ . 1 . 2]" 1 2409 2 64 LEU H 2 65 SER H 2.340 . 3.025 2.564 2.398 2.757 . 0 0 "[ . 1 . 2]" 1 2410 1 67 ARG H 2 27 TYR HE2 5.598 . 9.515 6.031 4.917 7.746 . 0 0 "[ . 1 . 2]" 1 2411 1 27 TYR HE2 2 67 ARG H 5.598 . 9.515 6.021 4.909 7.742 . 0 0 "[ . 1 . 2]" 1 2412 1 66 GLU H 2 31 TYR HE2 5.402 . 9.050 4.950 4.233 5.906 . 0 0 "[ . 1 . 2]" 1 2413 1 31 TYR HE2 2 66 GLU H 5.402 . 9.050 4.954 4.242 5.894 . 0 0 "[ . 1 . 2]" 1 2414 1 67 ARG H 2 31 TYR HE2 5.359 . 8.949 6.582 6.099 7.898 . 0 0 "[ . 1 . 2]" 1 2415 1 31 TYR HE2 2 67 ARG H 5.359 . 8.949 6.580 6.089 7.893 . 0 0 "[ . 1 . 2]" 1 2416 1 66 GLU H 2 31 TYR HD2 5.026 . 8.183 5.697 4.637 7.050 . 0 0 "[ . 1 . 2]" 1 2417 1 31 TYR HD2 2 66 GLU H 5.026 . 8.183 5.694 4.623 7.039 . 0 0 "[ . 1 . 2]" 1 2418 1 65 SER H 2 31 TYR HD2 5.244 . 8.681 6.152 5.574 7.287 . 0 0 "[ . 1 . 2]" 1 2419 1 31 TYR HD2 2 65 SER H 5.244 . 8.681 6.153 5.560 7.273 . 0 0 "[ . 1 . 2]" 1 2420 1 40 ARG H 2 51 PHE HZ 5.191 . 8.560 5.334 4.729 5.973 . 0 0 "[ . 1 . 2]" 1 2421 1 51 PHE HZ 2 40 ARG H 5.191 . 8.560 5.339 4.738 5.951 . 0 0 "[ . 1 . 2]" 1 2422 1 40 ARG H 2 51 PHE QE 6.095 . 10.739 5.970 5.535 6.374 . 0 0 "[ . 1 . 2]" 1 2423 1 51 PHE HE2 2 40 ARG H 6.095 . 10.739 6.545 5.964 7.015 . 0 0 "[ . 1 . 2]" 1 2424 1 35 THR H 1 50 GLU H 3.950 . 5.900 4.140 3.999 4.407 . 0 0 "[ . 1 . 2]" 1 2425 2 35 THR H 2 50 GLU H 3.950 . 5.900 4.140 3.993 4.404 . 0 0 "[ . 1 . 2]" 1 2426 1 41 GLN H 1 46 LYS H 4.926 . 7.959 5.004 3.892 5.351 . 0 0 "[ . 1 . 2]" 1 2427 2 41 GLN H 2 46 LYS H 4.926 . 7.959 5.003 3.889 5.357 . 0 0 "[ . 1 . 2]" 1 2428 1 53 SER H 1 57 LEU QD 5.118 . 8.393 5.368 4.869 5.794 . 0 0 "[ . 1 . 2]" 1 2429 2 53 SER H 2 57 LEU QD 5.118 . 8.393 5.366 4.871 5.794 . 0 0 "[ . 1 . 2]" 1 2430 1 25 GLU HA 1 27 TYR H 4.720 . 7.505 4.354 4.190 4.486 . 0 0 "[ . 1 . 2]" 1 2431 2 25 GLU HA 2 27 TYR H 4.720 . 7.505 4.354 4.185 4.476 . 0 0 "[ . 1 . 2]" 1 2432 1 25 GLU HA 1 29 GLN H 4.337 . 6.688 3.917 3.822 4.061 . 0 0 "[ . 1 . 2]" 1 2433 2 25 GLU HA 2 29 GLN H 4.337 . 6.688 3.918 3.824 4.063 . 0 0 "[ . 1 . 2]" 1 2434 1 19 ALA HA 1 22 LYS H 3.133 . 4.360 3.177 3.029 3.398 . 0 0 "[ . 1 . 2]" 1 2435 2 19 ALA HA 2 22 LYS H 3.133 . 4.360 3.178 3.027 3.403 . 0 0 "[ . 1 . 2]" 1 2436 1 57 LEU HA 1 61 LEU H 4.175 . 6.354 3.989 3.789 4.145 . 0 0 "[ . 1 . 2]" 1 2437 2 57 LEU HA 2 61 LEU H 4.175 . 6.354 3.989 3.792 4.147 . 0 0 "[ . 1 . 2]" 1 2438 1 60 ILE HA 1 61 LEU H 4.160 . 6.324 3.551 3.537 3.566 . 0 0 "[ . 1 . 2]" 1 2439 2 60 ILE HA 2 61 LEU H 4.160 . 6.324 3.552 3.535 3.567 . 0 0 "[ . 1 . 2]" 1 2440 1 34 THR HA 1 35 THR H 2.677 . 3.573 2.567 2.518 2.588 . 0 0 "[ . 1 . 2]" 1 2441 2 34 THR HA 2 35 THR H 2.677 . 3.573 2.567 2.510 2.591 . 0 0 "[ . 1 . 2]" 1 2442 1 49 ILE H 1 49 ILE HG12 3.114 . 4.326 2.265 2.192 2.327 . 0 0 "[ . 1 . 2]" 1 2443 2 49 ILE H 2 49 ILE HG12 3.114 . 4.326 2.265 2.192 2.328 . 0 0 "[ . 1 . 2]" 1 2444 1 17 LYS QE 1 18 ASP H 6.690 . 12.284 6.570 6.066 6.814 . 0 0 "[ . 1 . 2]" 1 2445 2 17 LYS QE 2 18 ASP H 6.690 . 12.284 6.568 6.063 6.806 . 0 0 "[ . 1 . 2]" 1 2446 1 46 LYS H 1 48 GLU H 5.759 . 9.905 6.005 5.858 6.130 . 0 0 "[ . 1 . 2]" 1 2447 2 46 LYS H 2 48 GLU H 5.759 . 9.905 6.006 5.858 6.128 . 0 0 "[ . 1 . 2]" 1 2448 1 18 ASP H 1 18 ASP HB2 2.846 . 3.858 3.175 2.469 3.628 . 0 0 "[ . 1 . 2]" 1 2449 2 18 ASP H 2 18 ASP HB2 2.846 . 3.858 3.175 2.474 3.629 . 0 0 "[ . 1 . 2]" 1 2450 1 18 ASP H 1 18 ASP HB3 3.696 . 5.403 2.960 2.486 3.618 . 0 0 "[ . 1 . 2]" 1 2451 2 18 ASP H 2 18 ASP HB3 3.696 . 5.403 2.961 2.488 3.616 . 0 0 "[ . 1 . 2]" 1 2452 1 59 ARG H 1 59 ARG HD2 4.773 . 7.621 4.686 3.611 5.958 . 0 0 "[ . 1 . 2]" 1 2453 2 59 ARG H 2 59 ARG HD2 4.773 . 7.621 4.686 3.615 5.957 . 0 0 "[ . 1 . 2]" 1 2454 1 38 ILE H 1 38 ILE HG13 2.953 . 4.043 2.623 2.523 2.775 . 0 0 "[ . 1 . 2]" 1 2455 2 38 ILE H 2 38 ILE HG13 2.953 . 4.043 2.624 2.521 2.778 . 0 0 "[ . 1 . 2]" 1 2456 1 28 LEU H 1 28 LEU HB2 3.453 . 4.943 2.583 2.536 2.638 . 0 0 "[ . 1 . 2]" 1 2457 2 28 LEU H 2 28 LEU HB2 3.453 . 4.943 2.582 2.530 2.639 . 0 0 "[ . 1 . 2]" 1 2458 1 60 ILE H 1 60 ILE HG13 3.576 . 5.175 2.478 2.143 3.654 . 0 0 "[ . 1 . 2]" 1 2459 2 60 ILE H 2 60 ILE HG13 3.576 . 5.175 2.479 2.144 3.658 . 0 0 "[ . 1 . 2]" 1 2460 1 46 LYS H 1 46 LYS QD 4.836 . 7.759 4.645 4.582 4.719 . 0 0 "[ . 1 . 2]" 1 2461 2 46 LYS H 2 46 LYS QD 4.836 . 7.759 4.645 4.583 4.721 . 0 0 "[ . 1 . 2]" 1 2462 1 52 PHE HA 1 53 SER H 3.243 . 4.557 3.185 2.943 3.463 . 0 0 "[ . 1 . 2]" 1 2463 2 52 PHE HA 2 53 SER H 3.243 . 4.557 3.184 2.946 3.465 . 0 0 "[ . 1 . 2]" 1 2464 1 51 PHE H 1 60 ILE MD 4.217 . 6.440 4.517 4.200 5.792 . 0 0 "[ . 1 . 2]" 1 2465 2 51 PHE H 2 60 ILE MD 4.217 . 6.440 4.519 4.207 5.800 . 0 0 "[ . 1 . 2]" 1 2466 1 65 SER H 1 67 ARG H 4.883 . 7.863 5.182 4.749 6.366 . 0 0 "[ . 1 . 2]" 1 2467 2 65 SER H 2 67 ARG H 4.883 . 7.863 5.178 4.740 6.361 . 0 0 "[ . 1 . 2]" 1 2468 1 29 GLN HB2 1 30 ASN HD21 4.830 . 7.746 4.831 3.394 5.294 . 0 0 "[ . 1 . 2]" 1 2469 2 29 GLN HB2 2 30 ASN HD21 4.830 . 7.746 4.830 3.389 5.295 . 0 0 "[ . 1 . 2]" 1 2470 1 29 GLN HG3 1 30 ASN HD22 5.489 . 9.255 6.847 6.241 7.098 . 0 0 "[ . 1 . 2]" 1 2471 2 29 GLN HG3 2 30 ASN HD22 5.489 . 9.255 6.847 6.232 7.081 . 0 0 "[ . 1 . 2]" 1 2472 1 35 THR HB 1 37 ASN HD21 5.848 . 10.123 5.039 4.756 5.659 . 0 0 "[ . 1 . 2]" 1 2473 2 35 THR HB 2 37 ASN HD21 5.848 . 10.123 5.038 4.749 5.641 . 0 0 "[ . 1 . 2]" 1 2474 1 35 THR HB 1 37 ASN HD22 4.617 . 7.281 4.630 4.173 5.807 . 0 0 "[ . 1 . 2]" 1 2475 2 35 THR HB 2 37 ASN HD22 4.617 . 7.281 4.629 4.172 5.812 . 0 0 "[ . 1 . 2]" 1 2476 1 37 ASN HD21 1 38 ILE HA 5.333 . 8.889 6.821 6.550 7.004 . 0 0 "[ . 1 . 2]" 1 2477 2 37 ASN HD21 2 38 ILE HA 5.333 . 8.889 6.823 6.543 7.006 . 0 0 "[ . 1 . 2]" 1 2478 1 36 VAL HA 1 37 ASN HD22 4.931 . 7.971 4.982 4.719 5.487 . 0 0 "[ . 1 . 2]" 1 2479 2 36 VAL HA 2 37 ASN HD22 4.931 . 7.971 4.983 4.713 5.496 . 0 0 "[ . 1 . 2]" 1 2480 1 36 VAL HA 1 37 ASN HD21 5.056 . 8.252 4.342 3.983 5.391 . 0 0 "[ . 1 . 2]" 1 2481 2 36 VAL HA 2 37 ASN HD21 5.056 . 8.252 4.343 3.977 5.401 . 0 0 "[ . 1 . 2]" 1 2482 1 37 ASN HD22 1 38 ILE H 6.991 . 13.100 6.546 6.203 6.757 . 0 0 "[ . 1 . 2]" 1 2483 2 37 ASN HD22 2 38 ILE H 6.991 . 13.100 6.548 6.201 6.755 . 0 0 "[ . 1 . 2]" 1 2484 1 24 ARG HH11 1 28 LEU MD2 5.659 . 9.662 5.420 4.070 6.888 . 0 0 "[ . 1 . 2]" 1 2485 2 24 ARG HH11 2 28 LEU MD2 5.659 . 9.662 5.420 4.075 6.884 . 0 0 "[ . 1 . 2]" 1 2486 1 20 VAL MG1 1 24 ARG HE 3.404 . 4.853 3.062 2.512 5.691 0.838 11 1 "[ . 1+ . 2]" 1 2487 2 20 VAL MG1 2 24 ARG HE 3.404 . 4.853 3.058 2.510 5.691 0.838 11 1 "[ . 1+ . 2]" 1 2488 1 24 ARG HE 2 61 LEU MD2 5.061 . 8.263 4.084 2.451 4.382 . 0 0 "[ . 1 . 2]" 1 2489 1 61 LEU MD2 2 24 ARG HE 5.061 . 8.263 4.080 2.440 4.385 . 0 0 "[ . 1 . 2]" 1 2490 1 59 ARG HD2 1 59 ARG HE 2.875 . 3.908 2.403 2.290 2.950 . 0 0 "[ . 1 . 2]" 1 2491 2 59 ARG HD2 2 59 ARG HE 2.875 . 3.908 2.404 2.293 2.951 . 0 0 "[ . 1 . 2]" 1 2492 1 59 ARG HE 1 59 ARG HG3 3.949 . 5.898 3.295 2.761 3.824 . 0 0 "[ . 1 . 2]" 1 2493 2 59 ARG HE 2 59 ARG HG3 3.949 . 5.898 3.295 2.764 3.824 . 0 0 "[ . 1 . 2]" 1 2494 1 59 ARG HB2 1 59 ARG HE 5.359 . 8.949 3.708 2.540 4.611 . 0 0 "[ . 1 . 2]" 1 2495 2 59 ARG HB2 2 59 ARG HE 5.359 . 8.949 3.708 2.542 4.612 . 0 0 "[ . 1 . 2]" 1 2496 1 56 ASP HA 1 59 ARG HE 4.136 . 6.274 2.829 1.770 4.318 0.228 13 0 "[ . 1 . 2]" 1 2497 2 56 ASP HA 2 59 ARG HE 4.136 . 6.274 2.829 1.776 4.308 0.222 13 0 "[ . 1 . 2]" 1 2498 1 59 ARG HE 1 60 ILE MG 5.789 . 9.978 5.852 5.329 7.024 . 0 0 "[ . 1 . 2]" 1 2499 2 59 ARG HE 2 60 ILE MG 5.789 . 9.978 5.853 5.329 7.026 . 0 0 "[ . 1 . 2]" 1 2500 1 59 ARG HB3 1 59 ARG HE 3.945 . 5.890 2.914 2.072 5.024 . 0 0 "[ . 1 . 2]" 1 2501 2 59 ARG HB3 2 59 ARG HE 3.945 . 5.890 2.916 2.069 5.022 . 0 0 "[ . 1 . 2]" 1 2502 1 31 TYR QB 1 31 TYR HE1 4.344 . 6.703 4.500 4.384 4.570 . 0 0 "[ . 1 . 2]" 1 2503 2 31 TYR QB 2 31 TYR HE1 4.344 . 6.703 4.500 4.380 4.575 . 0 0 "[ . 1 . 2]" 1 2504 1 57 LEU QD 2 38 ILE MD 3.632 . 5.281 2.093 1.768 2.344 0.215 1 0 "[ . 1 . 2]" 1 2505 1 38 ILE MD 2 57 LEU QD 3.632 . 5.281 2.091 1.762 2.351 0.221 1 0 "[ . 1 . 2]" 1 2506 1 61 LEU HB2 2 38 ILE MD 6.828 . 12.655 4.651 4.472 4.848 . 0 0 "[ . 1 . 2]" 1 2507 1 38 ILE MD 2 61 LEU HB2 6.828 . 12.655 4.645 4.479 4.829 . 0 0 "[ . 1 . 2]" 1 2508 1 32 PHE HE2 1 35 THR HB 4.383 . 6.784 6.200 5.387 7.453 0.669 12 1 "[ . 1 + . 2]" 1 2509 2 32 PHE HE2 2 35 THR HB 4.383 . 6.784 6.201 5.390 7.454 0.670 12 1 "[ . 1 + . 2]" 1 2510 1 35 THR HB 1 50 GLU HB2 4.242 . 6.492 2.073 1.902 2.414 0.090 3 0 "[ . 1 . 2]" 1 2511 2 35 THR HB 2 50 GLU HB2 4.242 . 6.492 2.073 1.904 2.414 0.088 3 0 "[ . 1 . 2]" 1 2512 1 20 VAL H 1 20 VAL HA 2.680 . 3.578 2.721 2.699 2.736 . 0 0 "[ . 1 . 2]" 1 2513 2 20 VAL H 2 20 VAL HA 2.680 . 3.578 2.722 2.701 2.738 . 0 0 "[ . 1 . 2]" 1 2514 1 20 VAL HA 1 20 VAL HB 2.611 . 3.463 2.811 2.561 2.970 . 0 0 "[ . 1 . 2]" 1 2515 2 20 VAL HA 2 20 VAL HB 2.611 . 3.463 2.811 2.563 2.970 . 0 0 "[ . 1 . 2]" 1 2516 1 65 SER HB2 1 66 GLU HB2 4.352 . 6.720 4.046 3.583 4.825 . 0 0 "[ . 1 . 2]" 1 2517 2 65 SER HB2 2 66 GLU HB2 4.352 . 6.720 4.045 3.578 4.823 . 0 0 "[ . 1 . 2]" 1 2518 1 20 VAL HA 1 22 LYS QG 4.671 . 7.399 6.048 5.686 6.525 . 0 0 "[ . 1 . 2]" 1 2519 1 28 LEU HB2 2 65 SER QB 4.671 . 7.399 6.046 5.675 6.521 . 0 0 "[ . 1 . 2]" 1 2520 1 62 GLU HG2 1 65 SER QB 4.627 . 7.303 4.488 3.889 5.208 . 0 0 "[ . 1 . 2]" 1 2521 2 62 GLU HG2 2 65 SER QB 4.627 . 7.303 4.489 3.877 5.211 . 0 0 "[ . 1 . 2]" 1 2522 1 25 GLU HB2 1 26 SER HA 3.646 . 5.308 3.176 2.952 3.461 . 0 0 "[ . 1 . 2]" 1 2523 2 25 GLU HB2 2 26 SER HA 3.646 . 5.308 3.176 2.952 3.460 . 0 0 "[ . 1 . 2]" 1 2524 1 31 TYR HA 1 31 TYR QB 3.039 . 4.193 2.432 2.407 2.462 . 0 0 "[ . 1 . 2]" 1 2525 2 31 TYR HA 2 31 TYR QB 3.039 . 4.193 2.432 2.406 2.464 . 0 0 "[ . 1 . 2]" 1 2526 1 25 GLU HA 1 25 GLU HB3 2.910 . 3.968 2.407 2.375 2.447 . 0 0 "[ . 1 . 2]" 1 2527 2 25 GLU HA 2 25 GLU HB3 2.910 . 3.968 2.407 2.375 2.449 . 0 0 "[ . 1 . 2]" 1 2528 1 25 GLU HA 1 25 GLU HB2 2.859 . 3.881 2.668 2.544 2.800 . 0 0 "[ . 1 . 2]" 1 2529 2 25 GLU HA 2 25 GLU HB2 2.859 . 3.881 2.667 2.540 2.800 . 0 0 "[ . 1 . 2]" 1 2530 1 25 GLU HA 1 28 LEU MD1 2.732 . 3.665 2.402 2.249 2.516 . 0 0 "[ . 1 . 2]" 1 2531 2 25 GLU HA 2 28 LEU MD1 2.732 . 3.665 2.402 2.248 2.513 . 0 0 "[ . 1 . 2]" 1 2532 1 32 PHE HA 1 32 PHE HD2 4.200 . 6.405 3.992 2.862 4.468 . 0 0 "[ . 1 . 2]" 1 2533 2 32 PHE HA 2 32 PHE HD2 4.200 . 6.405 3.992 2.863 4.469 . 0 0 "[ . 1 . 2]" 1 2534 1 59 ARG HA 1 62 GLU H 3.096 . 4.294 2.704 2.592 2.757 . 0 0 "[ . 1 . 2]" 1 2535 2 59 ARG HA 2 62 GLU H 3.096 . 4.294 2.704 2.592 2.755 . 0 0 "[ . 1 . 2]" 1 2536 1 21 LEU HA 2 57 LEU QD 4.069 . 6.139 3.746 3.334 4.096 . 0 0 "[ . 1 . 2]" 1 2537 1 57 LEU QD 2 21 LEU HA 4.069 . 6.139 3.743 3.358 4.113 . 0 0 "[ . 1 . 2]" 1 2538 1 66 GLU H 1 66 GLU HA 2.139 . 2.711 2.073 2.002 2.139 . 0 0 "[ . 1 . 2]" 1 2539 2 66 GLU H 2 66 GLU HA 2.139 . 2.711 2.073 2.000 2.135 . 0 0 "[ . 1 . 2]" 1 2540 1 18 ASP H 1 18 ASP HA 2.934 . 4.010 2.699 2.685 2.716 . 0 0 "[ . 1 . 2]" 1 2541 2 18 ASP H 2 18 ASP HA 2.934 . 4.010 2.700 2.687 2.716 . 0 0 "[ . 1 . 2]" 1 2542 1 18 ASP HA 1 21 LEU H 3.151 . 4.392 2.677 2.607 2.754 . 0 0 "[ . 1 . 2]" 1 2543 2 18 ASP HA 2 21 LEU H 3.151 . 4.392 2.677 2.604 2.755 . 0 0 "[ . 1 . 2]" 1 2544 1 19 ALA HA 1 22 LYS QB 2.631 . 3.496 2.332 2.136 2.629 . 0 0 "[ . 1 . 2]" 1 2545 2 19 ALA HA 2 22 LYS QB 2.631 . 3.496 2.332 2.134 2.631 . 0 0 "[ . 1 . 2]" 1 2546 1 46 LYS HA 2 51 PHE HD2 4.190 . 6.384 2.670 2.407 2.910 . 0 0 "[ . 1 . 2]" 1 2547 1 51 PHE HD2 2 46 LYS HA 4.190 . 6.384 4.557 2.606 5.343 . 0 0 "[ . 1 . 2]" 1 2548 1 46 LYS HA 1 47 ILE HG13 4.291 . 6.592 3.748 3.497 4.274 . 0 0 "[ . 1 . 2]" 1 2549 1 50 GLU HB2 2 46 LYS HA 4.291 . 6.592 3.748 3.489 4.270 . 0 0 "[ . 1 . 2]" 1 2550 1 46 LYS QD 1 48 GLU HA 4.609 . 7.264 3.945 3.494 4.286 . 0 0 "[ . 1 . 2]" 1 2551 1 46 LYS QD 2 48 GLU HA 4.609 . 7.264 3.939 3.485 4.280 . 0 0 "[ . 1 . 2]" 1 2552 1 47 ILE MG 1 48 GLU HA 3.940 . 5.880 3.681 3.461 3.764 . 0 0 "[ . 1 . 2]" 1 2553 1 47 ILE MG 2 48 GLU HA 3.940 . 5.880 3.682 3.463 3.770 . 0 0 "[ . 1 . 2]" 1 2554 1 46 LYS QG 1 48 GLU HA 5.205 . 8.591 4.316 4.120 4.491 . 0 0 "[ . 1 . 2]" 1 2555 1 46 LYS QG 2 48 GLU HA 5.205 . 8.591 4.313 4.126 4.485 . 0 0 "[ . 1 . 2]" 1 2556 1 18 ASP HA 1 38 ILE MD 3.684 . 5.380 5.253 4.815 5.762 0.382 7 0 "[ . 1 . 2]" 1 2557 2 18 ASP HA 2 38 ILE MD 3.684 . 5.380 5.253 4.814 5.764 0.384 7 0 "[ . 1 . 2]" 1 2558 1 18 ASP HA 1 23 GLU QB 4.862 . 7.816 7.643 7.278 7.967 0.151 8 0 "[ . 1 . 2]" 1 2559 2 18 ASP HA 2 23 GLU QB 4.862 . 7.816 7.643 7.277 7.968 0.152 8 0 "[ . 1 . 2]" 1 2560 1 37 ASN HA 1 38 ILE QG 4.454 . 6.933 3.803 3.381 4.046 . 0 0 "[ . 1 . 2]" 1 2561 2 37 ASN HA 2 38 ILE QG 4.454 . 6.933 3.804 3.383 4.044 . 0 0 "[ . 1 . 2]" 1 2562 1 40 ARG HB2 1 45 GLY HA3 5.376 . 8.989 4.269 4.093 4.439 . 0 0 "[ . 1 . 2]" 1 2563 2 40 ARG HB2 2 45 GLY HA3 5.376 . 8.989 4.269 4.093 4.439 . 0 0 "[ . 1 . 2]" 1 2564 1 59 ARG HD2 1 60 ILE MD 3.333 . 4.721 3.412 2.929 4.677 . 0 0 "[ . 1 . 2]" 1 2565 2 59 ARG HD2 2 60 ILE MD 3.333 . 4.721 3.412 2.932 4.678 . 0 0 "[ . 1 . 2]" 1 2566 1 24 ARG HA 1 24 ARG HD3 4.312 . 6.636 3.934 3.805 4.176 . 0 0 "[ . 1 . 2]" 1 2567 1 58 ASP HA 2 24 ARG HD3 4.312 . 6.636 3.935 3.798 4.188 . 0 0 "[ . 1 . 2]" 1 2568 1 24 ARG HA 1 24 ARG HD2 4.511 . 7.054 4.122 3.634 4.331 . 0 0 "[ . 1 . 2]" 1 2569 1 58 ASP HA 2 24 ARG HD2 4.511 . 7.054 4.124 3.662 4.344 . 0 0 "[ . 1 . 2]" 1 2570 1 59 ARG HD3 1 61 LEU QD 5.768 . 9.927 7.528 6.575 8.077 . 0 0 "[ . 1 . 2]" 1 2571 2 59 ARG HD3 2 61 LEU QD 5.768 . 9.927 7.528 6.580 8.080 . 0 0 "[ . 1 . 2]" 1 2572 1 37 ASN HB3 1 38 ILE HG12 5.228 . 8.645 5.743 5.554 6.303 . 0 0 "[ . 1 . 2]" 1 2573 2 37 ASN HB3 2 38 ILE HG12 5.228 . 8.645 5.744 5.557 6.303 . 0 0 "[ . 1 . 2]" 1 2574 1 36 VAL MG1 1 37 ASN HB3 4.880 . 7.857 4.869 4.638 5.028 . 0 0 "[ . 1 . 2]" 1 2575 2 36 VAL MG1 2 37 ASN HB3 4.880 . 7.857 4.869 4.639 5.029 . 0 0 "[ . 1 . 2]" 1 2576 1 63 LEU H 1 63 LEU QB 3.335 . 3.442 2.098 2.048 2.168 . 0 0 "[ . 1 . 2]" 1 2577 2 63 LEU H 2 63 LEU QB 3.335 . 3.442 2.099 2.049 2.168 . 0 0 "[ . 1 . 2]" 1 2578 1 62 GLU H 1 63 LEU QB 5.134 . 8.429 3.869 3.693 4.055 . 0 0 "[ . 1 . 2]" 1 2579 1 66 GLU H 2 63 LEU QB 5.134 . 8.429 3.871 3.693 4.060 . 0 0 "[ . 1 . 2]" 1 2580 1 62 GLU H 1 63 LEU QB 4.933 . 7.975 4.099 3.944 4.378 . 0 0 "[ . 1 . 2]" 1 2581 2 62 GLU H 2 63 LEU QB 4.933 . 7.975 4.100 3.946 4.382 . 0 0 "[ . 1 . 2]" 1 2582 1 51 PHE HD2 1 57 LEU QD 3.155 . 4.399 2.621 2.102 3.023 . 0 0 "[ . 1 . 2]" 1 2583 2 51 PHE HD2 2 57 LEU QD 3.155 . 4.399 2.428 2.049 2.705 . 0 0 "[ . 1 . 2]" 1 2584 1 57 LEU QD 1 61 LEU HA 4.402 . 6.824 3.743 3.358 4.113 . 0 0 "[ . 1 . 2]" 1 2585 1 21 LEU HA 2 57 LEU QD 4.402 . 6.824 3.746 3.334 4.096 . 0 0 "[ . 1 . 2]" 1 2586 1 57 LEU QD 2 20 VAL HB 4.506 . 7.044 4.411 3.829 4.894 . 0 0 "[ . 1 . 2]" 1 2587 1 20 VAL HB 2 57 LEU QD 4.506 . 7.044 4.413 3.807 4.875 . 0 0 "[ . 1 . 2]" 1 2588 1 24 ARG QB 1 49 ILE MD 2.990 . 6.000 4.450 4.245 4.607 . 0 0 "[ . 1 . 2]" 1 2589 2 24 ARG QB 2 49 ILE MD 2.990 . 6.000 4.450 4.246 4.608 . 0 0 "[ . 1 . 2]" 1 2590 1 47 ILE MD 1 49 ILE MD 2.274 . 6.000 4.098 3.981 4.419 . 0 0 "[ . 1 . 2]" 1 2591 1 47 ILE MD 2 49 ILE MD 2.274 . 6.000 4.098 3.985 4.420 . 0 0 "[ . 1 . 2]" 1 2592 1 46 LYS H 1 47 ILE MD 3.947 . 5.895 3.809 3.627 3.950 . 0 0 "[ . 1 . 2]" 1 2593 1 61 LEU H 2 47 ILE MD 3.947 . 5.895 3.813 3.648 3.958 . 0 0 "[ . 1 . 2]" 1 2594 1 47 ILE MD 2 51 PHE HD2 3.185 . 6.000 2.171 1.947 2.504 . 0 0 "[ . 1 . 2]" 1 2595 1 51 PHE HD2 2 47 ILE MD 3.185 . 6.000 3.995 1.948 4.772 . 0 0 "[ . 1 . 2]" 1 2596 1 21 LEU HA 1 47 ILE MD 4.919 . 7.943 6.388 6.171 6.544 . 0 0 "[ . 1 . 2]" 1 2597 1 35 THR HB 2 47 ILE MD 4.919 . 7.943 6.389 6.176 6.543 . 0 0 "[ . 1 . 2]" 1 2598 1 29 GLN HG3 1 47 ILE MD 5.555 . 9.412 7.420 7.110 7.892 . 0 0 "[ . 1 . 2]" 1 2599 1 29 GLN HG3 2 47 ILE MD 5.555 . 9.412 7.423 7.128 7.895 . 0 0 "[ . 1 . 2]" 1 2600 1 38 ILE MD 1 46 LYS H 4.841 . 7.771 5.118 4.960 5.273 . 0 0 "[ . 1 . 2]" 1 2601 1 61 LEU H 2 38 ILE MD 4.841 . 7.771 5.121 4.961 5.284 . 0 0 "[ . 1 . 2]" 1 2602 1 21 LEU H 1 38 ILE MD 5.258 . 8.714 4.807 4.514 4.995 . 0 0 "[ . 1 . 2]" 1 2603 2 21 LEU H 2 38 ILE MD 5.258 . 8.714 4.808 4.514 4.991 . 0 0 "[ . 1 . 2]" 1 2604 1 22 LYS HA 1 38 ILE MD 4.469 . 6.965 4.410 3.181 4.813 . 0 0 "[ . 1 . 2]" 1 2605 2 22 LYS HA 2 38 ILE MD 4.469 . 6.965 4.410 3.184 4.812 . 0 0 "[ . 1 . 2]" 1 2606 1 21 LEU HB3 1 38 ILE MD 1.951 . 2.427 2.111 1.955 2.212 . 0 0 "[ . 1 . 2]" 1 2607 2 21 LEU HB3 2 38 ILE MD 1.951 . 2.427 2.111 1.954 2.211 . 0 0 "[ . 1 . 2]" 1 2608 1 51 PHE H 1 60 ILE MD 4.262 . 6.532 4.192 4.002 4.521 . 0 0 "[ . 1 . 2]" 1 2609 2 51 PHE H 2 60 ILE MD 4.262 . 6.532 4.193 4.009 4.524 . 0 0 "[ . 1 . 2]" 1 2610 1 49 ILE MG 1 51 PHE HD1 4.572 . 7.185 4.556 3.432 6.943 . 0 0 "[ . 1 . 2]" 1 2611 2 49 ILE MG 2 51 PHE HD1 4.572 . 7.185 4.250 3.426 5.860 . 0 0 "[ . 1 . 2]" 1 2612 1 48 GLU HB3 1 49 ILE MG 4.205 . 6.415 4.552 4.253 4.747 . 0 0 "[ . 1 . 2]" 1 2613 2 48 GLU HB3 2 49 ILE MG 4.205 . 6.415 4.552 4.254 4.748 . 0 0 "[ . 1 . 2]" 1 2614 1 37 ASN HA 1 38 ILE MG 6.513 . 11.816 5.307 5.191 5.367 . 0 0 "[ . 1 . 2]" 1 2615 2 37 ASN HA 2 38 ILE MG 6.513 . 11.816 5.307 5.191 5.368 . 0 0 "[ . 1 . 2]" 1 2616 1 18 ASP HB3 1 38 ILE MG 5.403 . 9.052 5.749 5.334 6.193 . 0 0 "[ . 1 . 2]" 1 2617 1 51 PHE HB2 2 38 ILE MG 5.403 . 9.052 5.749 5.329 6.208 . 0 0 "[ . 1 . 2]" 1 2618 1 20 VAL HB 1 38 ILE MG 4.380 . 6.779 4.401 4.294 4.535 . 0 0 "[ . 1 . 2]" 1 2619 2 20 VAL HB 2 38 ILE MG 4.380 . 6.779 4.401 4.293 4.536 . 0 0 "[ . 1 . 2]" 1 2620 1 24 ARG QB 1 38 ILE MG 2.947 . 6.000 4.167 3.970 4.293 . 0 0 "[ . 1 . 2]" 1 2621 1 49 ILE HB 2 38 ILE MG 2.947 . 6.000 4.167 3.973 4.293 . 0 0 "[ . 1 . 2]" 1 2622 1 24 ARG H 1 38 ILE MG 5.817 . 10.047 6.532 6.287 6.706 . 0 0 "[ . 1 . 2]" 1 2623 1 60 ILE H 2 38 ILE MG 5.817 . 10.047 6.533 6.288 6.703 . 0 0 "[ . 1 . 2]" 1 2624 1 53 SER H 1 56 ASP QB 3.128 . 4.351 2.401 2.290 2.793 . 0 0 "[ . 1 . 2]" 1 2625 2 53 SER H 2 56 ASP QB 3.128 . 4.351 2.400 2.283 2.794 . 0 0 "[ . 1 . 2]" 1 2626 1 21 LEU H 1 24 ARG HD3 5.882 . 10.206 6.175 5.299 6.450 . 0 0 "[ . 1 . 2]" 1 2627 1 59 ARG H 2 24 ARG HD3 5.882 . 10.206 6.175 5.305 6.440 . 0 0 "[ . 1 . 2]" 1 2628 1 51 PHE HD2 1 56 ASP QB 6.528 . 11.854 4.198 3.591 5.514 . 0 0 "[ . 1 . 2]" 1 2629 2 51 PHE HD2 2 56 ASP QB 6.528 . 11.854 4.133 3.568 5.353 . 0 0 "[ . 1 . 2]" 1 2630 1 21 LEU HB2 1 38 ILE MD 2.861 . 3.884 3.530 2.947 3.817 . 0 0 "[ . 1 . 2]" 1 2631 2 21 LEU HB2 2 38 ILE MD 2.861 . 3.884 3.530 2.945 3.821 . 0 0 "[ . 1 . 2]" 1 2632 1 18 ASP H 1 18 ASP HB3 4.160 . 6.324 2.845 2.468 3.381 . 0 0 "[ . 1 . 2]" 1 2633 2 18 ASP H 2 18 ASP HB3 4.160 . 6.324 2.847 2.467 3.383 . 0 0 "[ . 1 . 2]" 1 2634 1 18 ASP QB 1 41 GLN HE22 5.804 . 10.014 9.014 7.495 10.247 0.233 16 0 "[ . 1 . 2]" 1 2635 2 18 ASP QB 2 41 GLN HE22 5.804 . 10.014 9.016 7.502 10.249 0.235 16 0 "[ . 1 . 2]" 1 2636 1 58 ASP HA 1 61 LEU HB3 5.433 . 9.123 4.371 4.063 4.679 . 0 0 "[ . 1 . 2]" 1 2637 1 24 ARG HA 2 61 LEU HB3 5.433 . 9.123 4.370 4.060 4.683 . 0 0 "[ . 1 . 2]" 1 2638 1 51 PHE HD2 1 57 LEU HB2 4.466 . 6.959 3.112 2.548 4.177 . 0 0 "[ . 1 . 2]" 1 2639 2 51 PHE HD2 2 57 LEU HB2 4.466 . 6.959 2.887 2.540 3.260 . 0 0 "[ . 1 . 2]" 1 2640 1 61 LEU HB2 1 61 LEU QD 2.544 . 3.353 2.108 2.089 2.121 . 0 0 "[ . 1 . 2]" 1 2641 2 61 LEU HB2 2 61 LEU QD 2.544 . 3.353 2.108 2.089 2.120 . 0 0 "[ . 1 . 2]" 1 2642 1 57 LEU HB2 1 60 ILE MD 4.011 . 6.022 3.724 3.550 3.982 . 0 0 "[ . 1 . 2]" 1 2643 1 21 LEU QD 2 57 LEU HB2 4.011 . 6.022 3.725 3.538 3.993 . 0 0 "[ . 1 . 2]" 1 2644 1 51 PHE HD2 1 57 LEU HB3 5.610 . 9.544 4.447 3.827 5.588 . 0 0 "[ . 1 . 2]" 1 2645 2 51 PHE HD2 2 57 LEU HB3 5.610 . 9.544 4.169 3.795 4.513 . 0 0 "[ . 1 . 2]" 1 2646 1 32 PHE HE2 1 50 GLU HG3 5.618 . 9.563 6.934 6.383 7.318 . 0 0 "[ . 1 . 2]" 1 2647 2 32 PHE HE2 2 50 GLU HG3 5.618 . 9.563 6.935 6.385 7.325 . 0 0 "[ . 1 . 2]" 1 2648 1 37 ASN HA 1 50 GLU HG3 4.735 . 7.537 6.068 5.231 7.077 . 0 0 "[ . 1 . 2]" 1 2649 2 37 ASN HA 2 50 GLU HG3 4.735 . 7.537 6.068 5.233 7.075 . 0 0 "[ . 1 . 2]" 1 2650 1 47 ILE H 1 48 GLU QG 5.153 . 8.472 5.194 5.051 5.308 . 0 0 "[ . 1 . 2]" 1 2651 1 47 ILE H 2 48 GLU QG 5.153 . 8.472 5.196 5.055 5.308 . 0 0 "[ . 1 . 2]" 1 2652 1 62 GLU H 1 62 GLU HG2 3.414 . 4.871 3.526 2.263 3.860 . 0 0 "[ . 1 . 2]" 1 2653 2 62 GLU H 2 62 GLU HG2 3.414 . 4.871 3.528 2.270 3.867 . 0 0 "[ . 1 . 2]" 1 2654 1 62 GLU H 1 62 GLU HG3 3.753 . 5.514 3.530 2.416 3.955 . 0 0 "[ . 1 . 2]" 1 2655 2 62 GLU H 2 62 GLU HG3 3.753 . 5.514 3.530 2.408 3.958 . 0 0 "[ . 1 . 2]" 1 2656 1 59 ARG H 1 62 GLU HG2 4.304 . 6.620 4.260 3.776 4.878 . 0 0 "[ . 1 . 2]" 1 2657 2 59 ARG H 2 62 GLU HG2 4.304 . 6.620 4.260 3.776 4.877 . 0 0 "[ . 1 . 2]" 1 2658 1 66 GLU HA 1 66 GLU HG3 3.362 . 4.775 2.683 2.459 3.480 . 0 0 "[ . 1 . 2]" 1 2659 2 66 GLU HA 2 66 GLU HG3 3.362 . 4.775 2.684 2.463 3.478 . 0 0 "[ . 1 . 2]" 1 2660 1 66 GLU HA 1 66 GLU HG2 2.984 . 4.097 3.102 2.347 3.656 . 0 0 "[ . 1 . 2]" 1 2661 2 66 GLU HA 2 66 GLU HG2 2.984 . 4.097 3.102 2.344 3.655 . 0 0 "[ . 1 . 2]" 1 2662 1 21 LEU HB2 1 23 GLU HG2 4.713 . 7.490 6.653 5.849 8.089 0.599 12 4 "[ . -1*+ * 2]" 1 2663 2 21 LEU HB2 2 23 GLU HG2 4.713 . 7.490 6.652 5.845 8.083 0.593 12 4 "[ . -1*+ * 2]" 1 2664 1 23 GLU HG3 2 61 LEU QD 4.496 . 7.023 5.471 4.536 6.165 . 0 0 "[ . 1 . 2]" 1 2665 1 60 ILE MG 2 66 GLU HG3 4.496 . 7.023 5.469 4.538 6.159 . 0 0 "[ . 1 . 2]" 1 2666 1 63 LEU QD 1 66 GLU HG2 4.328 . 6.670 3.770 2.385 4.248 . 0 0 "[ . 1 . 2]" 1 2667 1 63 LEU QD 2 66 GLU HG2 4.328 . 6.670 3.766 2.394 4.258 . 0 0 "[ . 1 . 2]" 1 2668 1 46 LYS HB3 2 37 ASN HD22 6.344 . 11.376 4.722 4.519 4.919 . 0 0 "[ . 1 . 2]" 1 2669 1 37 ASN HD22 2 46 LYS HB3 6.344 . 11.376 5.732 4.570 6.460 . 0 0 "[ . 1 . 2]" 1 2670 1 46 LYS HB2 2 37 ASN HD22 6.061 . 10.653 4.690 4.459 4.898 . 0 0 "[ . 1 . 2]" 1 2671 1 37 ASN HD22 2 46 LYS HB2 6.061 . 10.653 6.033 4.557 6.826 . 0 0 "[ . 1 . 2]" 1 2672 1 46 LYS HB2 1 48 GLU HA 6.650 . 12.178 3.740 3.504 3.949 . 0 0 "[ . 1 . 2]" 1 2673 1 48 GLU HA 2 46 LYS HB2 6.650 . 12.178 3.743 3.513 3.954 . 0 0 "[ . 1 . 2]" 1 2674 1 37 ASN HA 1 46 LYS HB3 6.066 . 10.666 9.025 8.823 9.292 . 0 0 "[ . 1 . 2]" 1 2675 1 37 ASN HA 2 46 LYS HB3 6.066 . 10.666 9.025 8.807 9.296 . 0 0 "[ . 1 . 2]" 1 2676 1 28 LEU HA 1 36 VAL HB 5.685 . 9.725 4.328 4.262 4.367 . 0 0 "[ . 1 . 2]" 1 2677 2 28 LEU HA 2 36 VAL HB 5.685 . 9.725 4.329 4.263 4.373 . 0 0 "[ . 1 . 2]" 1 2678 1 26 SER QB 1 29 GLN HG3 4.739 . 7.546 4.315 4.133 4.525 . 0 0 "[ . 1 . 2]" 1 2679 2 26 SER QB 2 29 GLN HG3 4.739 . 7.546 4.316 4.132 4.528 . 0 0 "[ . 1 . 2]" 1 2680 1 26 SER H 1 29 GLN HG2 6.683 . 12.266 6.027 5.838 6.195 . 0 0 "[ . 1 . 2]" 1 2681 2 26 SER H 2 29 GLN HG2 6.683 . 12.266 6.028 5.836 6.197 . 0 0 "[ . 1 . 2]" 1 2682 1 44 LYS HB2 2 51 PHE HD2 6.434 . 11.609 6.109 5.131 6.930 . 0 0 "[ . 1 . 2]" 1 2683 1 51 PHE HD2 2 44 LYS HB2 6.434 . 11.609 6.604 5.150 8.128 . 0 0 "[ . 1 . 2]" 1 2684 1 44 LYS HB3 2 51 PHE HD2 6.356 . 11.407 5.944 4.765 7.270 . 0 0 "[ . 1 . 2]" 1 2685 1 51 PHE HD2 2 44 LYS HB3 6.356 . 11.407 6.353 4.775 8.021 . 0 0 "[ . 1 . 2]" 1 2686 1 18 ASP H 1 40 ARG HB2 5.452 . 9.168 5.737 5.168 6.142 . 0 0 "[ . 1 . 2]" 1 2687 2 18 ASP H 2 40 ARG HB2 5.452 . 9.168 5.738 5.169 6.139 . 0 0 "[ . 1 . 2]" 1 2688 1 18 ASP H 1 40 ARG HB3 4.875 . 7.846 5.779 5.337 6.180 . 0 0 "[ . 1 . 2]" 1 2689 2 18 ASP H 2 40 ARG HB3 4.875 . 7.846 5.780 5.345 6.183 . 0 0 "[ . 1 . 2]" 1 2690 1 48 GLU H 1 48 GLU HB2 4.851 . 7.792 3.606 3.562 3.650 . 0 0 "[ . 1 . 2]" 1 2691 1 47 ILE H 2 48 GLU HB2 4.851 . 7.792 3.607 3.563 3.652 . 0 0 "[ . 1 . 2]" 1 2692 1 22 LYS H 1 22 LYS QB 2.497 . 3.276 2.241 2.209 2.285 . 0 0 "[ . 1 . 2]" 1 2693 2 22 LYS H 2 22 LYS QB 2.497 . 3.276 2.240 2.212 2.284 . 0 0 "[ . 1 . 2]" 1 2694 1 22 LYS QB 1 23 GLU H 3.169 . 4.424 2.655 2.525 2.803 . 0 0 "[ . 1 . 2]" 1 2695 2 22 LYS QB 2 23 GLU H 3.169 . 4.424 2.654 2.517 2.802 . 0 0 "[ . 1 . 2]" 1 2696 1 21 LEU QD 1 40 ARG HB2 4.202 . 6.409 4.087 3.724 4.516 . 0 0 "[ . 1 . 2]" 1 2697 2 21 LEU QD 2 40 ARG HB2 4.202 . 6.409 4.087 3.718 4.514 . 0 0 "[ . 1 . 2]" 1 2698 1 20 VAL H 1 20 VAL HB 2.279 . 2.928 2.291 2.237 2.362 . 0 0 "[ . 1 . 2]" 1 2699 2 20 VAL H 2 20 VAL HB 2.279 . 2.928 2.291 2.235 2.360 . 0 0 "[ . 1 . 2]" 1 2700 1 25 GLU HB2 1 36 VAL MG1 4.139 . 6.281 4.015 3.888 4.161 . 0 0 "[ . 1 . 2]" 1 2701 2 25 GLU HB2 2 36 VAL MG1 4.139 . 6.281 4.014 3.888 4.161 . 0 0 "[ . 1 . 2]" 1 2702 1 25 GLU HB3 1 36 VAL MG1 3.881 . 5.764 3.423 3.288 3.676 . 0 0 "[ . 1 . 2]" 1 2703 2 25 GLU HB3 2 36 VAL MG1 3.881 . 5.764 3.422 3.287 3.675 . 0 0 "[ . 1 . 2]" 1 2704 1 59 ARG H 1 60 ILE HG12 6.204 . 11.016 5.162 3.991 5.418 . 0 0 "[ . 1 . 2]" 1 2705 2 59 ARG H 2 60 ILE HG12 6.204 . 11.016 5.163 3.994 5.418 . 0 0 "[ . 1 . 2]" 1 2706 1 60 ILE HG12 1 61 LEU MD1 3.337 . 4.729 4.061 3.759 4.300 . 0 0 "[ . 1 . 2]" 1 2707 2 60 ILE HG12 2 61 LEU MD1 3.337 . 4.729 4.061 3.758 4.299 . 0 0 "[ . 1 . 2]" 1 2708 1 50 GLU HB3 1 60 ILE HG12 4.415 . 6.851 6.299 5.924 6.615 . 0 0 "[ . 1 . 2]" 1 2709 1 64 LEU HB3 2 60 ILE HG12 4.415 . 6.851 6.300 5.926 6.617 . 0 0 "[ . 1 . 2]" 1 2710 1 67 ARG QB 1 67 ARG QD 3.691 . 4.672 2.614 2.109 2.791 . 0 0 "[ . 1 . 2]" 1 2711 2 67 ARG QB 2 67 ARG QD 3.691 . 4.672 2.614 2.110 2.790 . 0 0 "[ . 1 . 2]" 1 2712 1 24 ARG HB3 1 26 SER H 4.306 . 6.624 4.691 4.571 4.828 . 0 0 "[ . 1 . 2]" 1 2713 2 24 ARG HB3 2 26 SER H 4.306 . 6.624 4.691 4.571 4.836 . 0 0 "[ . 1 . 2]" 1 2714 1 24 ARG HB3 1 37 ASN HA 5.465 . 9.198 9.209 8.737 9.483 0.285 11 0 "[ . 1 . 2]" 1 2715 2 24 ARG HB3 2 37 ASN HA 5.465 . 9.198 9.211 8.741 9.486 0.288 11 0 "[ . 1 . 2]" 1 2716 1 41 GLN HB3 1 41 GLN HE22 4.914 . 7.933 3.416 2.520 3.984 . 0 0 "[ . 1 . 2]" 1 2717 2 41 GLN HB3 2 41 GLN HE22 4.914 . 7.933 3.416 2.522 3.985 . 0 0 "[ . 1 . 2]" 1 2718 1 46 LYS HD3 1 46 LYS QE 2.575 . 3.404 2.365 2.332 2.476 . 0 0 "[ . 1 . 2]" 1 2719 2 46 LYS HD3 2 46 LYS QE 2.575 . 3.404 2.366 2.333 2.475 . 0 0 "[ . 1 . 2]" 1 2720 1 46 LYS HD3 1 48 GLU HA 6.425 . 11.584 5.419 3.949 5.875 . 0 0 "[ . 1 . 2]" 1 2721 1 48 GLU HA 2 46 LYS HD3 6.425 . 11.584 5.426 3.960 5.882 . 0 0 "[ . 1 . 2]" 1 2722 1 46 LYS HD3 2 48 GLU HB3 4.115 . 6.232 3.722 2.829 4.140 . 0 0 "[ . 1 . 2]" 1 2723 1 48 GLU HB3 2 46 LYS HD3 4.115 . 6.232 3.726 2.836 4.137 . 0 0 "[ . 1 . 2]" 1 2724 1 46 LYS HD3 1 47 ILE MG 5.173 . 8.518 6.863 6.052 7.124 . 0 0 "[ . 1 . 2]" 1 2725 1 47 ILE MG 2 46 LYS HD3 5.173 . 8.518 6.867 6.057 7.128 . 0 0 "[ . 1 . 2]" 1 2726 1 32 PHE HD2 1 62 GLU QB 5.931 . 10.328 6.495 6.081 6.932 . 0 0 "[ . 1 . 2]" 1 2727 2 32 PHE HD2 2 62 GLU QB 5.931 . 10.328 6.496 6.076 6.937 . 0 0 "[ . 1 . 2]" 1 2728 1 39 LYS HD3 1 39 LYS QE 2.546 . 3.356 2.325 2.175 2.372 . 0 0 "[ . 1 . 2]" 1 2729 2 39 LYS HD3 2 39 LYS QE 2.546 . 3.356 2.324 2.175 2.373 . 0 0 "[ . 1 . 2]" 1 2730 1 39 LYS HD2 1 39 LYS QE 2.628 . 3.491 2.329 2.175 2.381 . 0 0 "[ . 1 . 2]" 1 2731 2 39 LYS HD2 2 39 LYS QE 2.628 . 3.491 2.329 2.174 2.383 . 0 0 "[ . 1 . 2]" 1 2732 1 47 ILE H 1 47 ILE HG12 5.154 . 8.474 3.899 3.779 4.005 . 0 0 "[ . 1 . 2]" 1 2733 2 47 ILE H 2 47 ILE HG12 5.154 . 8.474 3.900 3.781 4.006 . 0 0 "[ . 1 . 2]" 1 2734 1 47 ILE HG12 2 51 PHE HD2 5.126 . 8.411 3.823 3.598 4.216 . 0 0 "[ . 1 . 2]" 1 2735 1 51 PHE HD2 2 47 ILE HG12 5.126 . 8.411 5.987 3.659 6.874 . 0 0 "[ . 1 . 2]" 1 2736 1 29 GLN HE21 1 38 ILE HG13 5.411 . 9.071 6.482 6.103 7.055 . 0 0 "[ . 1 . 2]" 1 2737 2 29 GLN HE21 2 38 ILE HG13 5.411 . 9.071 6.483 6.110 7.051 . 0 0 "[ . 1 . 2]" 1 2738 1 26 SER HA 1 29 GLN HB3 5.598 . 9.515 4.787 4.542 5.092 . 0 0 "[ . 1 . 2]" 1 2739 2 26 SER HA 2 29 GLN HB3 5.598 . 9.515 4.786 4.541 5.090 . 0 0 "[ . 1 . 2]" 1 2740 1 21 LEU HA 1 40 ARG QG 5.352 . 8.933 5.384 4.895 6.410 . 0 0 "[ . 1 . 2]" 1 2741 2 21 LEU HA 2 40 ARG QG 5.352 . 8.933 5.385 4.896 6.411 . 0 0 "[ . 1 . 2]" 1 2742 1 25 GLU H 1 38 ILE HG13 5.626 . 9.582 4.839 4.599 5.012 . 0 0 "[ . 1 . 2]" 1 2743 1 25 GLU H 2 61 LEU HG 5.626 . 9.582 4.839 4.596 5.016 . 0 0 "[ . 1 . 2]" 1 2744 1 56 ASP H 1 59 ARG HG2 6.153 . 10.885 5.002 4.657 5.400 . 0 0 "[ . 1 . 2]" 1 2745 2 56 ASP H 2 59 ARG HG2 6.153 . 10.885 5.003 4.654 5.403 . 0 0 "[ . 1 . 2]" 1 2746 1 60 ILE H 1 61 LEU HG 4.221 . 6.448 5.915 5.611 6.098 . 0 0 "[ . 1 . 2]" 1 2747 1 24 ARG H 2 61 LEU HG 4.221 . 6.448 5.914 5.609 6.098 . 0 0 "[ . 1 . 2]" 1 2748 1 63 LEU H 1 63 LEU HG 3.756 . 5.520 3.821 3.741 3.894 . 0 0 "[ . 1 . 2]" 1 2749 2 63 LEU H 2 63 LEU HG 3.756 . 5.520 3.821 3.740 3.892 . 0 0 "[ . 1 . 2]" 1 2750 1 32 PHE HE2 1 64 LEU HG 4.943 . 7.997 5.251 4.584 5.759 . 0 0 "[ . 1 . 2]" 1 2751 1 32 PHE HE2 2 64 LEU HG 4.943 . 7.997 5.250 4.586 5.760 . 0 0 "[ . 1 . 2]" 1 2752 1 26 SER H 1 28 LEU MD1 5.662 . 9.670 4.615 4.525 4.713 . 0 0 "[ . 1 . 2]" 1 2753 1 62 GLU H 2 28 LEU MD1 5.662 . 9.670 4.616 4.525 4.715 . 0 0 "[ . 1 . 2]" 1 2754 1 28 LEU MD1 2 61 LEU HA 3.056 . 4.223 2.513 2.173 2.834 . 0 0 "[ . 1 . 2]" 1 2755 1 61 LEU HA 2 28 LEU MD1 3.056 . 4.223 2.514 2.175 2.835 . 0 0 "[ . 1 . 2]" 1 2756 1 28 LEU HB3 1 28 LEU MD1 2.009 . 2.513 1.967 1.955 1.983 . 0 0 "[ . 1 . 2]" 1 2757 2 28 LEU HB3 2 28 LEU MD1 2.009 . 2.513 1.967 1.954 1.984 . 0 0 "[ . 1 . 2]" 1 2758 1 62 GLU QB 1 63 LEU QD 2.688 . 3.591 1.994 1.953 2.027 . 0 0 "[ . 1 . 2]" 1 2759 2 62 GLU QB 2 63 LEU QD 2.688 . 3.591 1.994 1.953 2.027 . 0 0 "[ . 1 . 2]" 1 2760 1 64 LEU MD2 1 64 LEU HG 2.076 . 2.615 1.964 1.811 2.102 . 0 0 "[ . 1 . 2]" 1 2761 1 64 LEU MD2 2 64 LEU HG 2.076 . 2.615 1.964 1.810 2.102 . 0 0 "[ . 1 . 2]" 1 2762 1 64 LEU MD1 2 24 ARG QH1 4.843 . 7.775 6.071 5.608 6.605 . 0 0 "[ . 1 . 2]" 1 2763 1 24 ARG QH1 2 64 LEU MD1 4.843 . 7.775 6.074 5.609 6.619 . 0 0 "[ . 1 . 2]" 1 2764 1 28 LEU MD1 1 31 TYR HD2 5.674 . 9.698 5.950 5.482 6.394 . 0 0 "[ . 1 . 2]" 1 2765 1 31 TYR HD2 2 64 LEU MD1 5.674 . 9.698 5.951 5.491 6.398 . 0 0 "[ . 1 . 2]" 1 2766 1 61 LEU MD2 1 62 GLU H 4.231 . 6.469 4.819 4.632 4.952 . 0 0 "[ . 1 . 2]" 1 2767 1 26 SER H 2 61 LEU MD2 4.231 . 6.469 4.817 4.628 4.954 . 0 0 "[ . 1 . 2]" 1 2768 1 57 LEU QD 1 60 ILE H 5.472 . 9.215 4.492 4.188 4.667 . 0 0 "[ . 1 . 2]" 1 2769 1 24 ARG H 2 57 LEU QD 5.472 . 9.215 4.492 4.187 4.676 . 0 0 "[ . 1 . 2]" 1 2770 1 43 LYS QE 1 43 LYS HG3 2.337 . 3.020 2.681 2.386 2.977 . 0 0 "[ . 1 . 2]" 1 2771 2 43 LYS QE 2 43 LYS HG3 2.337 . 3.020 2.682 2.386 2.977 . 0 0 "[ . 1 . 2]" 1 2772 1 61 LEU HA 1 61 LEU MD2 3.247 . 4.565 3.148 2.644 3.396 . 0 0 "[ . 1 . 2]" 1 2773 1 21 LEU HA 2 61 LEU MD2 3.247 . 4.565 3.146 2.644 3.398 . 0 0 "[ . 1 . 2]" 1 2774 1 18 ASP QB 1 21 LEU QD 4.307 . 6.626 3.546 3.378 3.903 . 0 0 "[ . 1 . 2]" 1 2775 2 18 ASP QB 2 21 LEU QD 4.307 . 6.626 3.547 3.376 3.905 . 0 0 "[ . 1 . 2]" 1 2776 1 57 LEU QD 1 61 LEU H 5.431 . 9.118 3.722 3.406 3.890 . 0 0 "[ . 1 . 2]" 1 2777 1 18 ASP H 2 57 LEU QD 5.431 . 9.118 3.721 3.408 3.890 . 0 0 "[ . 1 . 2]" 1 2778 1 57 LEU HG 1 61 LEU QD 2.513 . 3.303 2.551 2.266 2.865 . 0 0 "[ . 1 . 2]" 1 2779 2 57 LEU HG 2 61 LEU QD 2.513 . 3.303 2.551 2.265 2.862 . 0 0 "[ . 1 . 2]" 1 2780 1 46 LYS HG3 1 48 GLU HB3 4.537 . 7.110 3.328 3.132 3.603 . 0 0 "[ . 1 . 2]" 1 2781 1 48 GLU HB3 2 46 LYS HG3 4.537 . 7.110 3.329 3.136 3.601 . 0 0 "[ . 1 . 2]" 1 2782 1 22 LYS QG 1 23 GLU QB 4.150 . 6.302 3.840 2.930 4.184 . 0 0 "[ . 1 . 2]" 1 2783 2 22 LYS QG 2 23 GLU QB 4.150 . 6.302 3.840 2.927 4.182 . 0 0 "[ . 1 . 2]" 1 2784 1 62 GLU H 1 64 LEU MD2 5.609 . 9.541 4.855 4.702 5.066 . 0 0 "[ . 1 . 2]" 1 2785 1 62 GLU H 2 64 LEU MD2 5.609 . 9.541 4.857 4.706 5.063 . 0 0 "[ . 1 . 2]" 1 2786 1 64 LEU H 1 64 LEU MD2 3.368 . 4.786 3.180 3.053 3.400 . 0 0 "[ . 1 . 2]" 1 2787 1 64 LEU H 2 64 LEU MD2 3.368 . 4.786 3.182 3.044 3.401 . 0 0 "[ . 1 . 2]" 1 2788 1 46 LYS QG 1 48 GLU HB3 3.825 . 5.654 3.265 3.082 3.515 . 0 0 "[ . 1 . 2]" 1 2789 1 48 GLU HB3 2 46 LYS QG 3.825 . 5.654 3.266 3.086 3.513 . 0 0 "[ . 1 . 2]" 1 2790 1 28 LEU HB3 1 28 LEU MD2 1.991 . 2.487 1.999 1.991 2.007 . 0 0 "[ . 1 . 2]" 1 2791 2 28 LEU HB3 2 28 LEU MD2 1.991 . 2.487 1.999 1.990 2.006 . 0 0 "[ . 1 . 2]" 1 2792 1 64 LEU MD2 1 64 LEU HG 1.765 . 2.154 1.964 1.810 2.102 . 0 0 "[ . 1 . 2]" 1 2793 1 64 LEU HG 2 64 LEU MD2 1.765 . 2.154 1.964 1.811 2.103 . 0 0 "[ . 1 . 2]" 1 2794 1 62 GLU HA 1 64 LEU MD2 4.419 . 6.860 6.404 6.274 6.740 . 0 0 "[ . 1 . 2]" 1 2795 1 62 GLU HA 2 64 LEU MD2 4.419 . 6.860 6.406 6.268 6.745 . 0 0 "[ . 1 . 2]" 1 2796 1 27 TYR HB2 1 28 LEU MD2 5.016 . 8.161 4.907 4.730 5.039 . 0 0 "[ . 1 . 2]" 1 2797 2 27 TYR HB2 2 28 LEU MD2 5.016 . 8.161 4.907 4.728 5.035 . 0 0 "[ . 1 . 2]" 1 2798 1 64 LEU MD2 2 32 PHE HB3 3.874 . 5.750 5.285 4.848 5.779 0.029 16 0 "[ . 1 . 2]" 1 2799 1 32 PHE HB3 2 64 LEU MD2 3.874 . 5.750 5.286 4.854 5.782 0.032 16 0 "[ . 1 . 2]" 1 2800 1 63 LEU QD 1 66 GLU H 4.566 . 7.173 3.470 2.583 3.939 . 0 0 "[ . 1 . 2]" 1 2801 1 66 GLU H 2 63 LEU QD 4.566 . 7.173 3.470 2.596 3.929 . 0 0 "[ . 1 . 2]" 1 2802 1 63 LEU H 1 63 LEU QD 3.335 . 4.725 2.130 1.972 2.331 . 0 0 "[ . 1 . 2]" 1 2803 2 63 LEU H 2 63 LEU QD 3.335 . 4.725 2.130 1.979 2.326 . 0 0 "[ . 1 . 2]" 1 2804 1 32 PHE HB3 1 63 LEU QD 4.203 . 4.414 2.759 1.943 3.502 0.052 11 0 "[ . 1 . 2]" 1 2805 2 32 PHE HB3 2 63 LEU QD 4.203 . 4.414 2.760 1.943 3.506 0.052 11 0 "[ . 1 . 2]" 1 2806 1 61 LEU MD1 1 62 GLU QB 3.661 . 6.000 4.613 4.375 4.798 . 0 0 "[ . 1 . 2]" 1 2807 1 25 GLU HG2 2 61 LEU MD1 3.661 . 6.000 4.612 4.375 4.796 . 0 0 "[ . 1 . 2]" 1 2808 1 61 LEU MD1 1 63 LEU H 4.132 . 6.266 4.537 4.446 4.758 . 0 0 "[ . 1 . 2]" 1 2809 2 61 LEU MD1 2 63 LEU H 4.132 . 6.266 4.538 4.443 4.762 . 0 0 "[ . 1 . 2]" 1 2810 1 32 PHE HE2 1 61 LEU MD1 5.317 . 8.850 6.541 6.258 6.903 . 0 0 "[ . 1 . 2]" 1 2811 1 32 PHE HE2 2 61 LEU MD1 5.317 . 8.850 6.543 6.253 6.897 . 0 0 "[ . 1 . 2]" 1 2812 1 32 PHE HB2 1 35 THR MG 4.708 . 7.479 6.209 5.884 6.729 . 0 0 "[ . 1 . 2]" 1 2813 2 32 PHE HB2 2 35 THR MG 4.708 . 7.479 6.209 5.886 6.728 . 0 0 "[ . 1 . 2]" 1 2814 1 17 LYS H 1 20 VAL MG2 3.278 . 4.621 3.011 2.745 3.369 . 0 0 "[ . 1 . 2]" 1 2815 2 17 LYS H 2 20 VAL MG2 3.278 . 4.621 3.011 2.751 3.368 . 0 0 "[ . 1 . 2]" 1 2816 1 18 ASP HB3 1 20 VAL MG2 4.363 . 6.742 6.404 6.248 6.523 . 0 0 "[ . 1 . 2]" 1 2817 1 46 LYS QE 2 36 VAL MG2 4.363 . 6.742 6.403 6.248 6.519 . 0 0 "[ . 1 . 2]" 1 2818 1 20 VAL MG2 1 23 GLU HG2 3.962 . 5.924 3.802 3.633 4.039 . 0 0 "[ . 1 . 2]" 1 2819 2 20 VAL MG2 2 23 GLU HG2 3.962 . 5.924 3.803 3.633 4.038 . 0 0 "[ . 1 . 2]" 1 2820 1 17 LYS HB3 1 20 VAL MG2 2.873 . 3.904 3.169 2.534 4.276 0.372 1 0 "[ . 1 . 2]" 1 2821 1 64 LEU HB3 2 36 VAL MG2 2.873 . 3.904 3.170 2.532 4.274 0.370 1 0 "[ . 1 . 2]" 1 2822 1 29 GLN HE21 1 36 VAL MG1 6.060 . 10.650 4.311 3.991 4.872 . 0 0 "[ . 1 . 2]" 1 2823 2 29 GLN HE21 2 36 VAL MG1 6.060 . 10.650 4.311 3.991 4.872 . 0 0 "[ . 1 . 2]" 1 2824 1 16 VAL QG 1 17 LYS HB2 3.823 . 5.650 3.776 3.363 4.330 . 0 0 "[ . 1 . 2]" 1 2825 1 57 LEU HB3 2 16 VAL QG 3.823 . 5.650 3.777 3.366 4.329 . 0 0 "[ . 1 . 2]" 1 2826 1 29 GLN H 1 34 THR MG 5.330 . 8.881 5.166 5.002 5.298 . 0 0 "[ . 1 . 2]" 1 2827 2 29 GLN H 2 34 THR MG 5.330 . 8.881 5.166 5.002 5.297 . 0 0 "[ . 1 . 2]" 1 2828 1 34 THR MG 1 50 GLU HB3 3.367 . 6.000 5.079 4.771 5.427 . 0 0 "[ . 1 . 2]" 1 2829 1 64 LEU HB3 2 34 THR MG 3.367 . 6.000 5.080 4.768 5.427 . 0 0 "[ . 1 . 2]" 1 2830 1 17 LYS HB3 1 19 ALA MB 3.177 . 4.438 3.068 2.753 4.061 . 0 0 "[ . 1 . 2]" 1 2831 2 17 LYS HB3 2 19 ALA MB 3.177 . 4.438 3.068 2.752 4.062 . 0 0 "[ . 1 . 2]" 1 2832 1 17 LYS QE 1 19 ALA MB 5.050 . 8.237 4.930 3.779 5.358 . 0 0 "[ . 1 . 2]" 1 2833 2 17 LYS QE 2 19 ALA MB 5.050 . 8.237 4.929 3.770 5.357 . 0 0 "[ . 1 . 2]" 1 2834 1 60 ILE MG 1 63 LEU H 3.516 . 5.061 3.786 3.626 3.960 . 0 0 "[ . 1 . 2]" 1 2835 2 60 ILE MG 2 63 LEU H 3.516 . 5.061 3.787 3.628 3.958 . 0 0 "[ . 1 . 2]" 1 2836 1 29 GLN HE21 1 47 ILE MG 4.721 . 7.507 4.446 4.306 4.706 . 0 0 "[ . 1 . 2]" 1 2837 1 51 PHE HD2 2 47 ILE MG 4.721 . 7.507 5.604 4.330 6.243 . 0 0 "[ . 1 . 2]" 1 2838 1 58 ASP HA 1 60 ILE MG 5.550 . 9.401 5.506 5.348 5.650 . 0 0 "[ . 1 . 2]" 1 2839 2 58 ASP HA 2 60 ILE MG 5.550 . 9.401 5.506 5.349 5.647 . 0 0 "[ . 1 . 2]" 1 2840 1 32 PHE HB3 1 60 ILE MG 4.852 . 7.795 4.073 3.580 4.774 . 0 0 "[ . 1 . 2]" 1 2841 2 32 PHE HB3 2 60 ILE MG 4.852 . 7.795 4.072 3.581 4.774 . 0 0 "[ . 1 . 2]" 1 2842 1 25 GLU HG2 1 47 ILE MG 3.254 . 4.578 3.524 3.387 3.628 . 0 0 "[ . 1 . 2]" 1 2843 2 25 GLU HG2 2 47 ILE MG 3.254 . 4.578 3.524 3.386 3.628 . 0 0 "[ . 1 . 2]" 1 2844 1 47 ILE MG 1 49 ILE HG13 3.166 . 6.000 3.857 3.727 3.978 . 0 0 "[ . 1 . 2]" 1 2845 1 49 ILE HG13 2 47 ILE MG 3.166 . 6.000 3.857 3.726 3.979 . 0 0 "[ . 1 . 2]" 1 2846 1 47 ILE MD 1 48 GLU HB3 4.352 . 6.719 4.810 4.682 4.922 . 0 0 "[ . 1 . 2]" 1 2847 1 48 GLU HB3 2 47 ILE MD 4.352 . 6.719 4.811 4.686 4.922 . 0 0 "[ . 1 . 2]" 1 2848 1 58 ASP HA 1 61 LEU MD2 3.838 . 5.679 3.446 2.958 3.902 . 0 0 "[ . 1 . 2]" 1 2849 1 24 ARG HA 2 61 LEU MD2 3.838 . 5.679 3.446 2.956 3.905 . 0 0 "[ . 1 . 2]" 1 2850 1 48 GLU HA 1 49 ILE HB 6.271 . 11.186 4.649 4.563 4.738 . 0 0 "[ . 1 . 2]" 1 2851 1 48 GLU HA 2 49 ILE HB 6.271 . 11.186 4.648 4.563 4.732 . 0 0 "[ . 1 . 2]" 1 2852 1 48 GLU HA 1 49 ILE HG13 6.312 . 11.293 5.112 4.956 5.239 . 0 0 "[ . 1 . 2]" 1 2853 1 48 GLU HA 2 49 ILE HG13 6.312 . 11.293 5.110 4.951 5.238 . 0 0 "[ . 1 . 2]" 1 2854 1 34 THR HB 1 49 ILE MD 5.773 . 9.939 5.865 5.622 6.061 . 0 0 "[ . 1 . 2]" 1 2855 2 34 THR HB 2 49 ILE MD 5.773 . 9.939 5.865 5.617 6.058 . 0 0 "[ . 1 . 2]" 1 2856 1 36 VAL MG2 1 49 ILE HG12 3.675 . 5.363 4.214 4.117 4.284 . 0 0 "[ . 1 . 2]" 1 2857 2 36 VAL MG2 2 49 ILE HG12 3.675 . 5.363 4.214 4.115 4.283 . 0 0 "[ . 1 . 2]" 1 2858 1 48 GLU QG 1 49 ILE HG12 5.754 . 9.893 5.321 5.212 5.482 . 0 0 "[ . 1 . 2]" 1 2859 1 48 GLU QG 2 49 ILE HG12 5.754 . 9.893 5.321 5.211 5.476 . 0 0 "[ . 1 . 2]" 1 2860 1 46 LYS QE 1 49 ILE HG13 6.749 . 12.442 8.852 8.591 9.270 . 0 0 "[ . 1 . 2]" 1 2861 1 46 LYS QE 2 49 ILE HG13 6.749 . 12.442 8.847 8.570 9.259 . 0 0 "[ . 1 . 2]" 1 2862 1 49 ILE MD 1 51 PHE HD2 5.764 . 9.917 6.434 5.552 6.807 . 0 0 "[ . 1 . 2]" 1 2863 1 51 PHE HD2 2 49 ILE MD 5.764 . 9.917 6.495 5.549 7.084 . 0 0 "[ . 1 . 2]" 1 2864 1 36 VAL HA 1 49 ILE HG12 4.041 . 6.082 3.546 3.317 3.812 . 0 0 "[ . 1 . 2]" 1 2865 2 36 VAL HA 2 49 ILE HG12 4.041 . 6.082 3.547 3.320 3.814 . 0 0 "[ . 1 . 2]" 1 2866 1 36 VAL HA 1 38 ILE HG13 4.638 . 7.327 5.661 5.408 5.821 . 0 0 "[ . 1 . 2]" 1 2867 2 36 VAL HA 2 38 ILE HG13 4.638 . 7.327 5.662 5.405 5.824 . 0 0 "[ . 1 . 2]" 1 2868 1 37 ASN HA 1 39 LYS HG2 5.693 . 9.744 5.624 5.221 6.235 . 0 0 "[ . 1 . 2]" 1 2869 2 37 ASN HA 2 39 LYS HG2 5.693 . 9.744 5.624 5.221 6.231 . 0 0 "[ . 1 . 2]" 1 2870 1 22 LYS QE 1 38 ILE MG 4.682 . 7.422 6.084 5.741 6.351 . 0 0 "[ . 1 . 2]" 1 2871 1 51 PHE HB3 2 38 ILE MG 4.682 . 7.422 6.084 5.745 6.343 . 0 0 "[ . 1 . 2]" 1 2872 1 18 ASP HB2 1 38 ILE MD 5.692 . 9.741 5.965 5.152 6.411 . 0 0 "[ . 1 . 2]" 1 2873 1 58 ASP HB3 2 38 ILE MD 5.692 . 9.741 5.966 5.149 6.411 . 0 0 "[ . 1 . 2]" 1 2874 1 46 LYS HD3 2 37 ASN HD22 6.517 . 11.826 6.139 4.947 6.646 . 0 0 "[ . 1 . 2]" 1 2875 1 37 ASN HD22 2 46 LYS HD3 6.517 . 11.826 6.577 5.035 7.905 . 0 0 "[ . 1 . 2]" 1 2876 1 28 LEU MD1 2 64 LEU HB3 2.115 . 2.674 2.287 2.138 2.395 . 0 0 "[ . 1 . 2]" 1 2877 1 64 LEU HB3 2 28 LEU MD1 2.115 . 2.674 2.289 2.144 2.396 . 0 0 "[ . 1 . 2]" 1 2878 1 45 GLY HA3 2 51 PHE HD2 5.993 . 10.482 3.257 2.972 3.583 . 0 0 "[ . 1 . 2]" 1 2879 1 51 PHE HD2 2 45 GLY HA3 5.993 . 10.482 3.513 3.057 3.945 . 0 0 "[ . 1 . 2]" 1 2880 1 48 GLU HA 1 49 ILE MD 4.351 . 6.717 3.898 3.689 4.067 . 0 0 "[ . 1 . 2]" 1 2881 1 48 GLU HA 2 49 ILE MD 4.351 . 6.717 3.897 3.692 4.068 . 0 0 "[ . 1 . 2]" 1 2882 1 51 PHE HB2 1 57 LEU QD 5.068 . 8.279 4.081 3.685 4.350 . 0 0 "[ . 1 . 2]" 1 2883 2 51 PHE HB2 2 57 LEU QD 5.068 . 8.279 4.081 3.683 4.350 . 0 0 "[ . 1 . 2]" 1 2884 1 57 LEU HB3 1 57 LEU QD 2.551 . 6.000 2.187 2.107 2.327 . 0 0 "[ . 1 . 2]" 1 2885 1 38 ILE HG12 2 57 LEU QD 2.551 . 6.000 2.187 2.106 2.327 . 0 0 "[ . 1 . 2]" 1 2886 1 24 ARG HG3 1 27 TYR HE2 4.904 . 7.910 7.051 6.549 7.601 . 0 0 "[ . 1 . 2]" 1 2887 2 24 ARG HG3 2 27 TYR HE2 4.904 . 7.910 7.051 6.548 7.601 . 0 0 "[ . 1 . 2]" 1 2888 1 20 VAL HA 1 24 ARG HD2 6.266 . 11.174 5.631 5.113 6.270 . 0 0 "[ . 1 . 2]" 1 2889 1 65 SER QB 2 24 ARG HD2 6.266 . 11.174 5.633 5.124 6.275 . 0 0 "[ . 1 . 2]" 1 2890 1 40 ARG HB2 1 41 GLN HE22 7.071 . 13.321 6.758 5.792 7.346 . 0 0 "[ . 1 . 2]" 1 2891 2 40 ARG HB2 2 41 GLN HE22 7.071 . 13.321 6.760 5.798 7.347 . 0 0 "[ . 1 . 2]" 1 2892 1 37 ASN H 1 48 GLU HB2 6.321 . 11.316 4.803 4.583 5.114 . 0 0 "[ . 1 . 2]" 1 2893 2 37 ASN H 2 48 GLU HB2 6.321 . 11.316 4.805 4.592 5.116 . 0 0 "[ . 1 . 2]" 1 2894 1 37 ASN HD22 1 48 GLU HB3 7.783 . 15.354 6.554 4.948 7.095 . 0 0 "[ . 1 . 2]" 1 2895 1 37 ASN HD22 2 48 GLU HB3 7.783 . 15.354 6.983 4.997 7.524 . 0 0 "[ . 1 . 2]" 1 2896 1 26 SER H 1 29 GLN HB3 6.783 . 12.535 6.356 6.223 6.508 . 0 0 "[ . 1 . 2]" 1 2897 2 26 SER H 2 29 GLN HB3 6.783 . 12.535 6.356 6.219 6.510 . 0 0 "[ . 1 . 2]" 1 2898 1 24 ARG QH1 1 26 SER HA 5.397 . 9.038 9.240 8.913 9.367 0.329 12 0 "[ . 1 . 2]" 1 2899 2 24 ARG QH1 2 26 SER HA 5.397 . 9.038 9.240 8.915 9.369 0.331 15 0 "[ . 1 . 2]" 1 2900 1 46 LYS HG3 2 51 PHE HD2 6.182 . 10.959 5.220 4.927 5.533 . 0 0 "[ . 1 . 2]" 1 2901 1 51 PHE HD2 2 46 LYS HG3 6.182 . 10.959 7.027 5.128 7.792 . 0 0 "[ . 1 . 2]" 1 2902 1 47 ILE H 2 51 PHE HD2 4.359 . 6.734 2.906 2.432 3.231 . 0 0 "[ . 1 . 2]" 1 2903 1 51 PHE HD2 2 47 ILE H 4.359 . 6.734 5.494 2.963 6.419 . 0 0 "[ . 1 . 2]" 1 2904 1 45 GLY H 2 51 PHE HD1 3.893 . 5.787 3.729 3.002 4.325 . 0 0 "[ . 1 . 2]" 1 2905 1 51 PHE HD1 2 45 GLY H 3.893 . 5.787 4.441 3.068 5.146 . 0 0 "[ . 1 . 2]" 1 2906 1 17 LYS H 1 17 LYS QE 5.071 . 8.285 4.776 4.295 5.218 . 0 0 "[ . 1 . 2]" 1 2907 2 17 LYS H 2 17 LYS QE 5.071 . 8.285 4.774 4.291 5.219 . 0 0 "[ . 1 . 2]" 1 2908 1 17 LYS H 1 17 LYS QD 3.876 . 5.754 3.997 3.747 4.239 . 0 0 "[ . 1 . 2]" 1 2909 2 17 LYS H 2 17 LYS QD 3.876 . 5.754 3.996 3.744 4.228 . 0 0 "[ . 1 . 2]" 1 2910 1 17 LYS H 1 17 LYS QG 2.544 . 3.353 2.466 1.937 2.903 . 0 0 "[ . 1 . 2]" 1 2911 2 17 LYS H 2 17 LYS QG 2.544 . 3.353 2.465 1.940 2.890 . 0 0 "[ . 1 . 2]" 1 2912 1 17 LYS QE 1 19 ALA H 6.301 . 11.263 6.171 5.355 6.496 . 0 0 "[ . 1 . 2]" 1 2913 2 17 LYS QE 2 19 ALA H 6.301 . 11.263 6.170 5.342 6.492 . 0 0 "[ . 1 . 2]" 1 2914 1 18 ASP QB 1 19 ALA H 3.405 . 4.854 3.393 2.801 3.725 . 0 0 "[ . 1 . 2]" 1 2915 2 18 ASP QB 2 19 ALA H 3.405 . 4.854 3.393 2.814 3.719 . 0 0 "[ . 1 . 2]" 1 2916 1 17 LYS QD 1 20 VAL H 4.342 . 6.698 4.548 3.976 4.905 . 0 0 "[ . 1 . 2]" 1 2917 2 17 LYS QD 2 20 VAL H 4.342 . 6.698 4.548 3.973 4.906 . 0 0 "[ . 1 . 2]" 1 2918 1 20 VAL H 1 20 VAL MG1 2.754 . 3.702 3.110 2.985 3.201 . 0 0 "[ . 1 . 2]" 1 2919 2 20 VAL H 2 20 VAL MG1 2.754 . 3.702 3.109 2.985 3.204 . 0 0 "[ . 1 . 2]" 1 2920 1 59 ARG H 1 60 ILE MG 4.429 . 6.881 4.798 4.636 4.925 . 0 0 "[ . 1 . 2]" 1 2921 2 59 ARG H 2 60 ILE MG 4.429 . 6.881 4.798 4.637 4.924 . 0 0 "[ . 1 . 2]" 1 2922 1 18 ASP QB 1 22 LYS H 4.427 . 6.876 4.521 4.161 4.884 . 0 0 "[ . 1 . 2]" 1 2923 2 18 ASP QB 2 22 LYS H 4.427 . 6.876 4.521 4.155 4.897 . 0 0 "[ . 1 . 2]" 1 2924 1 22 LYS H 1 23 GLU QB 4.220 . 6.446 4.335 4.177 4.667 . 0 0 "[ . 1 . 2]" 1 2925 2 22 LYS H 2 23 GLU QB 4.220 . 6.446 4.335 4.176 4.669 . 0 0 "[ . 1 . 2]" 1 2926 1 22 LYS H 1 22 LYS QD 4.148 . 6.298 4.176 3.974 4.442 . 0 0 "[ . 1 . 2]" 1 2927 2 22 LYS H 2 22 LYS QD 4.148 . 6.298 4.176 3.970 4.443 . 0 0 "[ . 1 . 2]" 1 2928 1 19 ALA MB 1 22 LYS H 3.873 . 5.748 4.151 4.064 4.256 . 0 0 "[ . 1 . 2]" 1 2929 2 19 ALA MB 2 22 LYS H 3.873 . 5.748 4.151 4.064 4.260 . 0 0 "[ . 1 . 2]" 1 2930 1 20 VAL MG1 1 22 LYS H 3.637 . 5.291 3.562 3.449 3.656 . 0 0 "[ . 1 . 2]" 1 2931 2 20 VAL MG1 2 22 LYS H 3.637 . 5.291 3.562 3.447 3.657 . 0 0 "[ . 1 . 2]" 1 2932 1 22 LYS QD 1 23 GLU H 4.117 . 6.236 4.492 4.385 4.790 . 0 0 "[ . 1 . 2]" 1 2933 2 22 LYS QD 2 23 GLU H 4.117 . 6.236 4.493 4.383 4.795 . 0 0 "[ . 1 . 2]" 1 2934 1 22 LYS HA 1 23 GLU H 2.852 . 3.869 2.725 2.704 2.752 . 0 0 "[ . 1 . 2]" 1 2935 2 22 LYS HA 2 23 GLU H 2.852 . 3.869 2.724 2.703 2.750 . 0 0 "[ . 1 . 2]" 1 2936 1 23 GLU H 1 23 GLU QB 2.671 . 3.563 2.496 2.326 2.646 . 0 0 "[ . 1 . 2]" 1 2937 2 23 GLU H 2 23 GLU QB 2.671 . 3.563 2.495 2.328 2.646 . 0 0 "[ . 1 . 2]" 1 2938 1 20 VAL MG1 1 23 GLU H 4.032 . 6.064 4.280 4.122 4.434 . 0 0 "[ . 1 . 2]" 1 2939 2 20 VAL MG1 2 23 GLU H 4.032 . 6.064 4.280 4.125 4.437 . 0 0 "[ . 1 . 2]" 1 2940 1 19 ALA HA 1 23 GLU H 4.132 . 6.266 3.990 3.757 4.155 . 0 0 "[ . 1 . 2]" 1 2941 2 19 ALA HA 2 23 GLU H 4.132 . 6.266 3.989 3.762 4.157 . 0 0 "[ . 1 . 2]" 1 2942 1 22 LYS QB 1 25 GLU H 4.752 . 7.574 4.805 4.547 4.924 . 0 0 "[ . 1 . 2]" 1 2943 2 22 LYS QB 2 25 GLU H 4.752 . 7.574 4.805 4.547 4.927 . 0 0 "[ . 1 . 2]" 1 2944 1 25 GLU H 1 28 LEU MD2 4.873 . 7.841 5.358 5.114 5.568 . 0 0 "[ . 1 . 2]" 1 2945 2 25 GLU H 2 28 LEU MD2 4.873 . 7.841 5.358 5.115 5.564 . 0 0 "[ . 1 . 2]" 1 2946 1 25 GLU H 1 47 ILE MD 4.932 . 7.972 6.080 5.809 6.255 . 0 0 "[ . 1 . 2]" 1 2947 2 25 GLU H 2 47 ILE MD 4.932 . 7.972 6.081 5.809 6.255 . 0 0 "[ . 1 . 2]" 1 2948 1 22 LYS HA 1 25 GLU H 3.293 . 4.649 3.062 2.757 3.189 . 0 0 "[ . 1 . 2]" 1 2949 2 22 LYS HA 2 25 GLU H 3.293 . 4.649 3.062 2.756 3.188 . 0 0 "[ . 1 . 2]" 1 2950 1 21 LEU HB3 1 25 GLU H 4.198 . 6.401 4.012 3.889 4.255 . 0 0 "[ . 1 . 2]" 1 2951 2 21 LEU HB3 2 25 GLU H 4.198 . 6.401 4.013 3.889 4.258 . 0 0 "[ . 1 . 2]" 1 2952 1 22 LYS QD 1 25 GLU H 4.380 . 6.778 4.453 4.124 5.085 . 0 0 "[ . 1 . 2]" 1 2953 2 22 LYS QD 2 25 GLU H 4.380 . 6.778 4.455 4.127 5.089 . 0 0 "[ . 1 . 2]" 1 2954 1 21 LEU HB2 1 25 GLU H 4.364 . 6.744 4.369 4.007 4.496 . 0 0 "[ . 1 . 2]" 1 2955 2 21 LEU HB2 2 25 GLU H 4.364 . 6.744 4.369 4.006 4.498 . 0 0 "[ . 1 . 2]" 1 2956 1 25 GLU H 1 36 VAL MG1 3.388 . 4.823 3.550 3.371 3.725 . 0 0 "[ . 1 . 2]" 1 2957 2 25 GLU H 2 36 VAL MG1 3.388 . 4.823 3.551 3.373 3.730 . 0 0 "[ . 1 . 2]" 1 2958 1 26 SER H 1 29 GLN HG2 5.516 . 9.320 6.124 6.031 6.289 . 0 0 "[ . 1 . 2]" 1 2959 2 26 SER H 2 29 GLN HG2 5.516 . 9.320 6.125 6.030 6.288 . 0 0 "[ . 1 . 2]" 1 2960 1 26 SER H 1 28 LEU MD2 4.960 . 8.035 5.708 5.577 5.853 . 0 0 "[ . 1 . 2]" 1 2961 2 26 SER H 2 28 LEU MD2 4.960 . 8.035 5.708 5.578 5.851 . 0 0 "[ . 1 . 2]" 1 2962 1 23 GLU HA 1 26 SER H 3.056 . 4.223 3.401 3.043 3.638 . 0 0 "[ . 1 . 2]" 1 2963 2 23 GLU HA 2 26 SER H 3.056 . 4.223 3.400 3.042 3.643 . 0 0 "[ . 1 . 2]" 1 2964 1 26 SER H 1 26 SER QB 2.642 . 3.514 2.382 2.233 2.670 . 0 0 "[ . 1 . 2]" 1 2965 2 26 SER H 2 26 SER QB 2.642 . 3.514 2.382 2.240 2.677 . 0 0 "[ . 1 . 2]" 1 2966 1 22 LYS QB 1 26 SER H 4.998 . 8.121 5.065 4.905 5.413 . 0 0 "[ . 1 . 2]" 1 2967 2 22 LYS QB 2 26 SER H 4.998 . 8.121 5.065 4.908 5.409 . 0 0 "[ . 1 . 2]" 1 2968 1 22 LYS QG 1 26 SER H 4.304 . 6.620 4.249 3.913 4.609 . 0 0 "[ . 1 . 2]" 1 2969 2 22 LYS QG 2 26 SER H 4.304 . 6.620 4.249 3.913 4.604 . 0 0 "[ . 1 . 2]" 1 2970 1 26 SER H 1 36 VAL MG1 4.427 . 6.876 5.089 4.976 5.185 . 0 0 "[ . 1 . 2]" 1 2971 1 64 LEU MD1 2 26 SER H 4.427 . 6.876 5.089 4.976 5.187 . 0 0 "[ . 1 . 2]" 1 2972 1 21 LEU HB3 1 26 SER H 5.209 . 8.601 6.473 6.258 6.853 . 0 0 "[ . 1 . 2]" 1 2973 1 64 LEU HB3 2 26 SER H 5.209 . 8.601 6.473 6.262 6.854 . 0 0 "[ . 1 . 2]" 1 2974 1 26 SER H 1 47 ILE HG13 4.984 . 8.088 7.850 7.282 8.319 0.231 9 0 "[ . 1 . 2]" 1 2975 1 61 LEU HG 2 26 SER H 4.984 . 8.088 7.852 7.295 8.314 0.226 9 0 "[ . 1 . 2]" 1 2976 1 27 TYR H 1 29 GLN HG2 5.151 . 8.467 5.246 5.072 5.410 . 0 0 "[ . 1 . 2]" 1 2977 2 27 TYR H 2 29 GLN HG2 5.151 . 8.467 5.246 5.073 5.415 . 0 0 "[ . 1 . 2]" 1 2978 1 23 GLU QB 1 27 TYR H 4.184 . 6.372 3.880 3.777 3.977 . 0 0 "[ . 1 . 2]" 1 2979 2 23 GLU QB 2 27 TYR H 4.184 . 6.372 3.881 3.783 3.979 . 0 0 "[ . 1 . 2]" 1 2980 1 24 ARG HG2 1 27 TYR H 5.285 . 8.776 5.595 5.306 5.827 . 0 0 "[ . 1 . 2]" 1 2981 1 61 LEU HG 2 27 TYR H 5.285 . 8.776 5.596 5.308 5.828 . 0 0 "[ . 1 . 2]" 1 2982 1 27 TYR H 1 28 LEU MD1 4.634 . 7.319 5.048 4.923 5.134 . 0 0 "[ . 1 . 2]" 1 2983 2 27 TYR H 2 28 LEU MD1 4.634 . 7.319 5.049 4.924 5.135 . 0 0 "[ . 1 . 2]" 1 2984 1 23 GLU HG2 1 27 TYR H 5.489 . 9.255 5.656 5.462 5.866 . 0 0 "[ . 1 . 2]" 1 2985 2 23 GLU HG2 2 27 TYR H 5.489 . 9.255 5.656 5.460 5.868 . 0 0 "[ . 1 . 2]" 1 2986 1 24 ARG QH1 1 27 TYR H 5.302 . 8.816 6.556 6.199 6.705 . 0 0 "[ . 1 . 2]" 1 2987 2 24 ARG QH1 2 27 TYR H 5.302 . 8.816 6.556 6.202 6.699 . 0 0 "[ . 1 . 2]" 1 2988 1 26 SER HA 1 28 LEU H 3.893 . 5.787 3.411 3.388 3.445 . 0 0 "[ . 1 . 2]" 1 2989 2 26 SER HA 2 28 LEU H 3.893 . 5.787 3.411 3.388 3.445 . 0 0 "[ . 1 . 2]" 1 2990 1 28 LEU H 1 29 GLN HG2 5.116 . 8.387 4.918 4.790 5.055 . 0 0 "[ . 1 . 2]" 1 2991 2 28 LEU H 2 29 GLN HG2 5.116 . 8.387 4.917 4.790 5.056 . 0 0 "[ . 1 . 2]" 1 2992 1 25 GLU HG3 1 28 LEU H 5.841 . 10.105 5.481 5.386 5.607 . 0 0 "[ . 1 . 2]" 1 2993 2 25 GLU HG3 2 28 LEU H 5.841 . 10.105 5.481 5.383 5.608 . 0 0 "[ . 1 . 2]" 1 2994 1 24 ARG QH1 1 28 LEU H 5.070 . 8.283 5.737 5.522 5.918 . 0 0 "[ . 1 . 2]" 1 2995 2 24 ARG QH1 2 28 LEU H 5.070 . 8.283 5.736 5.520 5.922 . 0 0 "[ . 1 . 2]" 1 2996 1 28 LEU MD2 1 29 GLN H 3.602 . 5.223 3.332 3.223 3.482 . 0 0 "[ . 1 . 2]" 1 2997 2 28 LEU MD2 2 29 GLN H 3.602 . 5.223 3.331 3.226 3.485 . 0 0 "[ . 1 . 2]" 1 2998 1 26 SER HA 1 29 GLN H 3.676 . 5.365 3.610 3.497 3.743 . 0 0 "[ . 1 . 2]" 1 2999 2 26 SER HA 2 29 GLN H 3.676 . 5.365 3.610 3.495 3.741 . 0 0 "[ . 1 . 2]" 1 3000 1 28 LEU MD1 1 29 GLN H 3.946 . 5.893 3.834 3.729 3.949 . 0 0 "[ . 1 . 2]" 1 3001 2 28 LEU MD1 2 29 GLN H 3.946 . 5.893 3.834 3.737 3.946 . 0 0 "[ . 1 . 2]" 1 3002 1 26 SER H 1 29 GLN H 4.397 . 6.813 3.964 3.867 4.053 . 0 0 "[ . 1 . 2]" 1 3003 2 26 SER H 2 29 GLN H 4.397 . 6.813 3.965 3.867 4.051 . 0 0 "[ . 1 . 2]" 1 3004 1 29 GLN H 1 30 ASN HD22 4.999 . 8.122 5.231 4.956 5.349 . 0 0 "[ . 1 . 2]" 1 3005 2 29 GLN H 2 30 ASN HD22 4.999 . 8.122 5.230 4.954 5.346 . 0 0 "[ . 1 . 2]" 1 3006 1 29 GLN H 1 30 ASN HB3 5.456 . 9.176 5.866 5.459 6.099 . 0 0 "[ . 1 . 2]" 1 3007 2 29 GLN H 2 30 ASN HB3 5.456 . 9.176 5.865 5.455 6.096 . 0 0 "[ . 1 . 2]" 1 3008 1 25 GLU HB2 1 29 GLN HE21 5.645 . 9.628 4.094 3.872 4.318 . 0 0 "[ . 1 . 2]" 1 3009 2 25 GLU HB2 2 29 GLN HE21 5.645 . 9.628 4.097 3.869 4.323 . 0 0 "[ . 1 . 2]" 1 3010 1 25 GLU HB2 1 29 GLN HE22 4.358 . 6.732 4.304 3.997 4.475 . 0 0 "[ . 1 . 2]" 1 3011 2 25 GLU HB2 2 29 GLN HE22 4.358 . 6.732 4.305 3.997 4.481 . 0 0 "[ . 1 . 2]" 1 3012 1 29 GLN HE22 1 38 ILE QG 5.476 . 9.224 7.729 7.466 8.013 . 0 0 "[ . 1 . 2]" 1 3013 2 29 GLN HE22 2 38 ILE QG 5.476 . 9.224 7.730 7.481 8.003 . 0 0 "[ . 1 . 2]" 1 3014 1 26 SER QB 1 29 GLN HE22 4.795 . 7.670 4.335 4.118 4.528 . 0 0 "[ . 1 . 2]" 1 3015 2 26 SER QB 2 29 GLN HE22 4.795 . 7.670 4.336 4.102 4.541 . 0 0 "[ . 1 . 2]" 1 3016 1 30 ASN H 1 31 TYR QB 4.878 . 7.852 4.221 4.128 4.306 . 0 0 "[ . 1 . 2]" 1 3017 2 30 ASN H 2 31 TYR QB 4.878 . 7.852 4.222 4.129 4.307 . 0 0 "[ . 1 . 2]" 1 3018 1 32 PHE HD2 1 64 LEU H 5.344 . 8.913 7.286 6.930 7.526 . 0 0 "[ . 1 . 2]" 1 3019 1 32 PHE HD2 2 64 LEU H 5.344 . 8.913 7.286 6.934 7.525 . 0 0 "[ . 1 . 2]" 1 3020 1 32 PHE HE2 1 64 LEU H 5.684 . 9.723 6.499 5.658 7.032 . 0 0 "[ . 1 . 2]" 1 3021 1 32 PHE HE2 2 64 LEU H 5.684 . 9.723 6.497 5.656 7.033 . 0 0 "[ . 1 . 2]" 1 3022 1 26 SER HA 1 30 ASN HD21 5.274 . 8.752 3.277 2.961 3.606 . 0 0 "[ . 1 . 2]" 1 3023 2 26 SER HA 2 30 ASN HD21 5.274 . 8.752 3.275 2.963 3.616 . 0 0 "[ . 1 . 2]" 1 3024 1 28 LEU MD2 1 32 PHE H 3.985 . 5.970 4.167 3.881 4.347 . 0 0 "[ . 1 . 2]" 1 3025 2 28 LEU MD2 2 32 PHE H 3.985 . 5.970 4.167 3.880 4.346 . 0 0 "[ . 1 . 2]" 1 3026 1 28 LEU HA 1 32 PHE H 4.677 . 7.411 3.894 3.686 4.071 . 0 0 "[ . 1 . 2]" 1 3027 2 28 LEU HA 2 32 PHE H 4.677 . 7.411 3.894 3.686 4.071 . 0 0 "[ . 1 . 2]" 1 3028 1 29 GLN HG2 1 32 PHE H 4.878 . 7.852 5.285 5.142 5.415 . 0 0 "[ . 1 . 2]" 1 3029 2 29 GLN HG2 2 32 PHE H 4.878 . 7.852 5.284 5.136 5.416 . 0 0 "[ . 1 . 2]" 1 3030 1 31 TYR QB 1 33 GLY H 5.144 . 8.452 4.272 4.122 4.419 . 0 0 "[ . 1 . 2]" 1 3031 2 31 TYR QB 2 33 GLY H 5.144 . 8.452 4.272 4.125 4.424 . 0 0 "[ . 1 . 2]" 1 3032 1 33 GLY H 1 36 VAL MG2 4.611 . 7.268 5.057 4.824 5.241 . 0 0 "[ . 1 . 2]" 1 3033 2 33 GLY H 2 36 VAL MG2 4.611 . 7.268 5.056 4.820 5.242 . 0 0 "[ . 1 . 2]" 1 3034 1 33 GLY H 1 60 ILE MG 4.659 . 7.372 5.845 5.259 6.792 . 0 0 "[ . 1 . 2]" 1 3035 2 33 GLY H 2 60 ILE MG 4.659 . 7.372 5.845 5.259 6.792 . 0 0 "[ . 1 . 2]" 1 3036 1 33 GLY H 1 60 ILE MD 4.519 . 7.071 5.548 4.914 6.256 . 0 0 "[ . 1 . 2]" 1 3037 2 33 GLY H 2 60 ILE MD 4.519 . 7.071 5.547 4.915 6.260 . 0 0 "[ . 1 . 2]" 1 3038 1 32 PHE HD2 1 33 GLY H 5.137 . 8.435 4.671 4.169 5.124 . 0 0 "[ . 1 . 2]" 1 3039 2 32 PHE HD2 2 33 GLY H 5.137 . 8.435 4.669 4.165 5.126 . 0 0 "[ . 1 . 2]" 1 3040 1 34 THR H 1 36 VAL MG2 3.442 . 4.923 3.931 3.695 4.119 . 0 0 "[ . 1 . 2]" 1 3041 2 34 THR H 2 36 VAL MG2 3.442 . 4.923 3.932 3.698 4.121 . 0 0 "[ . 1 . 2]" 1 3042 1 28 LEU MD1 1 34 THR H 4.159 . 6.321 6.102 5.875 6.255 . 0 0 "[ . 1 . 2]" 1 3043 1 64 LEU MD1 2 34 THR H 4.159 . 6.321 6.103 5.877 6.256 . 0 0 "[ . 1 . 2]" 1 3044 1 34 THR H 1 60 ILE MG 4.439 . 6.902 6.261 5.802 7.015 0.113 1 0 "[ . 1 . 2]" 1 3045 2 34 THR H 2 60 ILE MG 4.439 . 6.902 6.262 5.809 7.020 0.118 1 0 "[ . 1 . 2]" 1 3046 1 29 GLN HG3 1 35 THR H 5.665 . 9.676 6.342 6.086 6.450 . 0 0 "[ . 1 . 2]" 1 3047 2 29 GLN HG3 2 35 THR H 5.665 . 9.676 6.342 6.087 6.449 . 0 0 "[ . 1 . 2]" 1 3048 1 35 THR H 1 50 GLU HB2 4.967 . 8.051 3.175 2.722 3.864 . 0 0 "[ . 1 . 2]" 1 3049 2 35 THR H 2 50 GLU HB2 4.967 . 8.051 3.175 2.714 3.873 . 0 0 "[ . 1 . 2]" 1 3050 1 37 ASN H 1 38 ILE HB 4.846 . 7.781 5.967 5.905 6.036 . 0 0 "[ . 1 . 2]" 1 3051 2 37 ASN H 2 38 ILE HB 4.846 . 7.781 5.967 5.904 6.036 . 0 0 "[ . 1 . 2]" 1 3052 1 37 ASN H 1 49 ILE HG13 5.206 . 8.594 5.721 5.572 5.877 . 0 0 "[ . 1 . 2]" 1 3053 1 46 LYS HB2 2 37 ASN H 5.206 . 8.594 5.721 5.584 5.877 . 0 0 "[ . 1 . 2]" 1 3054 1 25 GLU HG2 1 37 ASN H 3.539 . 5.105 2.815 2.433 3.122 . 0 0 "[ . 1 . 2]" 1 3055 2 25 GLU HG2 2 37 ASN H 3.539 . 5.105 2.816 2.446 3.128 . 0 0 "[ . 1 . 2]" 1 3056 1 36 VAL HB 1 37 ASN H 3.804 . 5.613 2.783 2.423 3.059 . 0 0 "[ . 1 . 2]" 1 3057 2 36 VAL HB 2 37 ASN H 3.804 . 5.613 2.784 2.436 3.064 . 0 0 "[ . 1 . 2]" 1 3058 1 37 ASN H 1 50 GLU HB2 4.989 . 8.100 5.091 4.530 5.534 . 0 0 "[ . 1 . 2]" 1 3059 1 61 LEU HG 2 37 ASN H 4.989 . 8.100 5.091 4.523 5.540 . 0 0 "[ . 1 . 2]" 1 3060 1 37 ASN H 1 38 ILE HG12 4.399 . 6.818 4.476 4.341 4.603 . 0 0 "[ . 1 . 2]" 1 3061 2 37 ASN H 2 38 ILE HG12 4.399 . 6.818 4.476 4.343 4.601 . 0 0 "[ . 1 . 2]" 1 3062 1 37 ASN H 1 39 LYS HD3 4.902 . 7.906 6.376 6.113 6.878 . 0 0 "[ . 1 . 2]" 1 3063 1 46 LYS HB3 2 37 ASN H 4.902 . 7.906 6.374 6.109 6.869 . 0 0 "[ . 1 . 2]" 1 3064 1 37 ASN H 1 46 LYS QD 5.089 . 8.327 5.892 5.619 6.348 . 0 0 "[ . 1 . 2]" 1 3065 1 46 LYS QD 2 37 ASN H 5.089 . 8.327 5.889 5.631 6.341 . 0 0 "[ . 1 . 2]" 1 3066 1 37 ASN H 1 60 ILE MG 4.444 . 6.912 6.325 6.174 6.440 . 0 0 "[ . 1 . 2]" 1 3067 1 61 LEU QD 2 37 ASN H 4.444 . 6.912 6.327 6.169 6.454 . 0 0 "[ . 1 . 2]" 1 3068 1 37 ASN H 1 46 LYS HA 5.374 . 8.984 7.428 7.268 7.601 . 0 0 "[ . 1 . 2]" 1 3069 1 46 LYS HA 2 37 ASN H 5.374 . 8.984 7.430 7.287 7.593 . 0 0 "[ . 1 . 2]" 1 3070 1 29 GLN HG2 1 37 ASN HD22 5.653 . 9.648 5.031 3.935 5.586 . 0 0 "[ . 1 . 2]" 1 3071 2 29 GLN HG2 2 37 ASN HD22 5.653 . 9.648 5.032 3.929 5.595 . 0 0 "[ . 1 . 2]" 1 3072 1 22 LYS QD 1 37 ASN HD22 5.332 . 8.885 6.991 6.430 7.235 . 0 0 "[ . 1 . 2]" 1 3073 2 22 LYS QD 2 37 ASN HD22 5.332 . 8.885 6.992 6.429 7.234 . 0 0 "[ . 1 . 2]" 1 3074 1 37 ASN HD21 1 48 GLU QG 4.086 . 6.173 2.813 2.529 3.256 . 0 0 "[ . 1 . 2]" 1 3075 2 37 ASN HD21 2 48 GLU QG 4.086 . 6.173 2.813 2.531 3.259 . 0 0 "[ . 1 . 2]" 1 3076 1 22 LYS QD 1 37 ASN HD21 5.056 . 8.251 6.715 6.485 6.923 . 0 0 "[ . 1 . 2]" 1 3077 2 22 LYS QD 2 37 ASN HD21 5.056 . 8.251 6.717 6.489 6.924 . 0 0 "[ . 1 . 2]" 1 3078 1 37 ASN HD21 1 39 LYS HD3 5.146 . 8.456 5.877 5.545 6.339 . 0 0 "[ . 1 . 2]" 1 3079 1 46 LYS HB3 2 37 ASN HD21 5.146 . 8.456 5.876 5.549 6.330 . 0 0 "[ . 1 . 2]" 1 3080 1 36 VAL MG1 1 37 ASN HD21 5.433 . 9.123 5.215 4.991 5.899 . 0 0 "[ . 1 . 2]" 1 3081 2 36 VAL MG1 2 37 ASN HD21 5.433 . 9.123 5.217 4.989 5.905 . 0 0 "[ . 1 . 2]" 1 3082 1 34 THR MG 1 37 ASN HD21 5.122 . 8.402 6.033 5.767 6.212 . 0 0 "[ . 1 . 2]" 1 3083 1 46 LYS QG 2 37 ASN HD21 5.122 . 8.402 6.035 5.764 6.212 . 0 0 "[ . 1 . 2]" 1 3084 1 36 VAL MG1 1 37 ASN HD22 5.222 . 8.630 5.848 5.697 6.287 . 0 0 "[ . 1 . 2]" 1 3085 2 36 VAL MG1 2 37 ASN HD22 5.222 . 8.630 5.849 5.694 6.293 . 0 0 "[ . 1 . 2]" 1 3086 1 21 LEU HB2 1 38 ILE H 4.367 . 6.750 4.681 4.301 5.300 . 0 0 "[ . 1 . 2]" 1 3087 2 21 LEU HB2 2 38 ILE H 4.367 . 6.750 4.679 4.303 5.297 . 0 0 "[ . 1 . 2]" 1 3088 1 36 VAL MG1 1 38 ILE H 3.314 . 4.687 3.220 3.156 3.284 . 0 0 "[ . 1 . 2]" 1 3089 2 36 VAL MG1 2 38 ILE H 3.314 . 4.687 3.221 3.154 3.284 . 0 0 "[ . 1 . 2]" 1 3090 1 38 ILE H 1 49 ILE MG 5.047 . 8.230 7.944 7.781 8.089 . 0 0 "[ . 1 . 2]" 1 3091 1 49 ILE MG 2 38 ILE H 5.047 . 8.230 7.946 7.781 8.088 . 0 0 "[ . 1 . 2]" 1 3092 1 18 ASP HB2 1 38 ILE H 5.047 . 8.231 6.639 6.187 7.216 . 0 0 "[ . 1 . 2]" 1 3093 2 18 ASP HB2 2 38 ILE H 5.047 . 8.231 6.640 6.186 7.216 . 0 0 "[ . 1 . 2]" 1 3094 1 29 GLN HE21 1 38 ILE H 6.035 . 10.588 5.652 5.324 6.135 . 0 0 "[ . 1 . 2]" 1 3095 2 29 GLN HE21 2 38 ILE H 6.035 . 10.588 5.652 5.325 6.131 . 0 0 "[ . 1 . 2]" 1 3096 1 40 ARG H 1 40 ARG HB2 2.426 . 3.162 2.283 2.115 2.494 . 0 0 "[ . 1 . 2]" 1 3097 2 40 ARG H 2 40 ARG HB2 2.426 . 3.162 2.282 2.116 2.487 . 0 0 "[ . 1 . 2]" 1 3098 1 21 LEU HG 1 40 ARG H 4.806 . 7.693 4.651 4.244 5.717 . 0 0 "[ . 1 . 2]" 1 3099 2 21 LEU HG 2 40 ARG H 4.806 . 7.693 4.648 4.248 5.719 . 0 0 "[ . 1 . 2]" 1 3100 1 41 GLN H 1 42 LYS QG 5.681 . 9.716 5.330 4.859 6.130 . 0 0 "[ . 1 . 2]" 1 3101 2 41 GLN H 2 42 LYS QG 5.681 . 9.716 5.331 4.860 6.133 . 0 0 "[ . 1 . 2]" 1 3102 1 40 ARG HB3 1 41 GLN H 3.374 . 4.797 3.261 2.927 3.443 . 0 0 "[ . 1 . 2]" 1 3103 2 40 ARG HB3 2 41 GLN H 3.374 . 4.797 3.260 2.928 3.442 . 0 0 "[ . 1 . 2]" 1 3104 1 39 LYS HB3 1 41 GLN H 5.324 . 8.867 4.480 4.030 5.010 . 0 0 "[ . 1 . 2]" 1 3105 2 39 LYS HB3 2 41 GLN H 5.324 . 8.867 4.479 4.030 5.008 . 0 0 "[ . 1 . 2]" 1 3106 1 40 ARG HB2 1 41 GLN H 3.993 . 5.986 3.982 3.613 4.139 . 0 0 "[ . 1 . 2]" 1 3107 2 40 ARG HB2 2 41 GLN H 3.993 . 5.986 3.982 3.616 4.140 . 0 0 "[ . 1 . 2]" 1 3108 1 41 GLN HE21 1 42 LYS QG 5.616 . 9.558 6.314 5.484 7.175 . 0 0 "[ . 1 . 2]" 1 3109 2 41 GLN HE21 2 42 LYS QG 5.616 . 9.558 6.313 5.473 7.169 . 0 0 "[ . 1 . 2]" 1 3110 1 41 GLN HE22 1 44 LYS HB2 5.603 . 9.528 7.245 6.295 9.740 0.212 13 0 "[ . 1 . 2]" 1 3111 1 50 GLU HG2 2 41 GLN HE22 5.603 . 9.528 7.245 6.296 9.739 0.211 13 0 "[ . 1 . 2]" 1 3112 1 39 LYS HD3 1 41 GLN HE22 4.853 . 7.797 5.867 4.439 7.030 . 0 0 "[ . 1 . 2]" 1 3113 2 39 LYS HD3 2 41 GLN HE22 4.853 . 7.797 5.871 4.459 7.036 . 0 0 "[ . 1 . 2]" 1 3114 1 41 GLN HE22 1 42 LYS QG 5.674 . 9.698 6.303 5.446 7.337 . 0 0 "[ . 1 . 2]" 1 3115 2 41 GLN HE22 2 42 LYS QG 5.674 . 9.698 6.304 5.444 7.332 . 0 0 "[ . 1 . 2]" 1 3116 1 40 ARG HB3 1 42 LYS H 4.088 . 6.176 2.980 2.328 3.280 . 0 0 "[ . 1 . 2]" 1 3117 2 40 ARG HB3 2 42 LYS H 4.088 . 6.176 2.981 2.335 3.284 . 0 0 "[ . 1 . 2]" 1 3118 1 17 LYS QG 1 42 LYS H 5.521 . 9.331 8.019 7.192 8.982 . 0 0 "[ . 1 . 2]" 1 3119 2 17 LYS QG 2 42 LYS H 5.521 . 9.331 8.019 7.204 8.981 . 0 0 "[ . 1 . 2]" 1 3120 1 42 LYS QE 1 43 LYS H 6.393 . 11.502 5.021 4.581 5.392 . 0 0 "[ . 1 . 2]" 1 3121 2 42 LYS QE 2 43 LYS H 6.393 . 11.502 5.021 4.579 5.386 . 0 0 "[ . 1 . 2]" 1 3122 1 42 LYS QG 1 43 LYS H 4.686 . 7.431 4.416 3.744 4.835 . 0 0 "[ . 1 . 2]" 1 3123 2 42 LYS QG 2 43 LYS H 4.686 . 7.431 4.418 3.747 4.836 . 0 0 "[ . 1 . 2]" 1 3124 1 42 LYS QD 1 43 LYS H 5.656 . 9.654 4.940 3.657 6.082 . 0 0 "[ . 1 . 2]" 1 3125 2 42 LYS QD 2 43 LYS H 5.656 . 9.654 4.943 3.667 6.080 . 0 0 "[ . 1 . 2]" 1 3126 1 40 ARG QD 1 44 LYS H 5.362 . 8.956 5.307 4.504 5.737 . 0 0 "[ . 1 . 2]" 1 3127 2 40 ARG QD 2 44 LYS H 5.362 . 8.956 5.308 4.514 5.732 . 0 0 "[ . 1 . 2]" 1 3128 1 42 LYS QG 1 44 LYS H 3.713 . 5.436 3.965 3.679 4.299 . 0 0 "[ . 1 . 2]" 1 3129 2 42 LYS QG 2 44 LYS H 3.713 . 5.436 3.963 3.676 4.300 . 0 0 "[ . 1 . 2]" 1 3130 1 44 LYS H 2 51 PHE HD2 5.227 . 8.643 5.004 4.144 5.765 . 0 0 "[ . 1 . 2]" 1 3131 1 51 PHE HD2 2 44 LYS H 5.227 . 8.643 5.667 4.137 8.233 . 0 0 "[ . 1 . 2]" 1 3132 1 45 GLY H 2 51 PHE HB3 5.126 . 8.410 5.253 4.996 5.580 . 0 0 "[ . 1 . 2]" 1 3133 1 51 PHE HB3 2 45 GLY H 5.126 . 8.410 5.259 4.986 5.564 . 0 0 "[ . 1 . 2]" 1 3134 1 44 LYS QE 1 45 GLY H 6.184 . 10.965 5.475 2.970 5.880 . 0 0 "[ . 1 . 2]" 1 3135 1 56 ASP QB 2 45 GLY H 6.184 . 10.965 5.477 2.970 5.877 . 0 0 "[ . 1 . 2]" 1 3136 1 40 ARG HB3 1 45 GLY H 5.022 . 8.174 5.539 5.007 6.012 . 0 0 "[ . 1 . 2]" 1 3137 2 40 ARG HB3 2 45 GLY H 5.022 . 8.174 5.537 5.001 6.014 . 0 0 "[ . 1 . 2]" 1 3138 1 44 LYS HB3 1 45 GLY H 3.519 . 5.067 3.363 2.239 4.393 . 0 0 "[ . 1 . 2]" 1 3139 1 50 GLU HB2 2 45 GLY H 3.519 . 5.067 3.362 2.241 4.394 . 0 0 "[ . 1 . 2]" 1 3140 1 39 LYS HB2 1 45 GLY H 4.893 . 7.886 4.196 2.522 5.419 . 0 0 "[ . 1 . 2]" 1 3141 2 39 LYS HB2 2 45 GLY H 4.893 . 7.886 4.195 2.524 5.414 . 0 0 "[ . 1 . 2]" 1 3142 1 44 LYS QG 1 45 GLY H 4.461 . 6.949 4.310 3.068 4.805 . 0 0 "[ . 1 . 2]" 1 3143 2 44 LYS QG 2 45 GLY H 4.461 . 6.949 4.309 3.070 4.805 . 0 0 "[ . 1 . 2]" 1 3144 1 44 LYS QG 1 45 GLY H 4.418 . 6.857 4.186 3.059 4.635 . 0 0 "[ . 1 . 2]" 1 3145 2 44 LYS QG 2 45 GLY H 4.418 . 6.857 4.185 3.061 4.636 . 0 0 "[ . 1 . 2]" 1 3146 1 38 ILE MD 1 45 GLY H 4.813 . 7.708 5.885 5.492 6.218 . 0 0 "[ . 1 . 2]" 1 3147 2 38 ILE MD 2 45 GLY H 4.813 . 7.708 5.886 5.494 6.220 . 0 0 "[ . 1 . 2]" 1 3148 1 42 LYS HA 1 45 GLY H 5.230 . 8.649 7.093 5.494 7.481 . 0 0 "[ . 1 . 2]" 1 3149 1 35 THR HB 2 45 GLY H 5.230 . 8.649 7.094 5.495 7.482 . 0 0 "[ . 1 . 2]" 1 3150 1 41 GLN HA 1 45 GLY H 5.120 . 8.397 6.562 5.882 6.911 . 0 0 "[ . 1 . 2]" 1 3151 2 41 GLN HA 2 45 GLY H 5.120 . 8.397 6.560 5.876 6.915 . 0 0 "[ . 1 . 2]" 1 3152 1 39 LYS HB3 1 46 LYS H 4.308 . 6.628 4.178 3.853 4.580 . 0 0 "[ . 1 . 2]" 1 3153 1 50 GLU HB2 2 46 LYS H 4.308 . 6.628 4.177 3.851 4.580 . 0 0 "[ . 1 . 2]" 1 3154 1 40 ARG QG 1 46 LYS H 3.725 . 5.459 3.472 3.410 3.558 . 0 0 "[ . 1 . 2]" 1 3155 2 40 ARG QG 2 46 LYS H 3.725 . 5.459 3.472 3.413 3.555 . 0 0 "[ . 1 . 2]" 1 3156 1 18 ASP HA 1 46 LYS H 5.150 . 8.465 7.273 7.159 7.389 . 0 0 "[ . 1 . 2]" 1 3157 1 49 ILE HA 2 46 LYS H 5.150 . 8.465 7.276 7.152 7.381 . 0 0 "[ . 1 . 2]" 1 3158 1 40 ARG HB3 1 46 LYS H 5.539 . 9.373 6.045 5.815 6.302 . 0 0 "[ . 1 . 2]" 1 3159 1 48 GLU QG 2 46 LYS H 5.539 . 9.373 6.044 5.815 6.298 . 0 0 "[ . 1 . 2]" 1 3160 1 38 ILE HB 1 46 LYS H 4.572 . 7.185 5.807 5.518 6.106 . 0 0 "[ . 1 . 2]" 1 3161 2 38 ILE HB 2 46 LYS H 4.572 . 7.185 5.808 5.521 6.103 . 0 0 "[ . 1 . 2]" 1 3162 1 46 LYS H 1 47 ILE HG13 4.217 . 6.440 4.570 4.370 4.959 . 0 0 "[ . 1 . 2]" 1 3163 1 50 GLU HB2 2 46 LYS H 4.217 . 6.440 4.570 4.371 4.959 . 0 0 "[ . 1 . 2]" 1 3164 1 38 ILE HG12 1 46 LYS H 4.140 . 6.282 5.355 5.111 5.625 . 0 0 "[ . 1 . 2]" 1 3165 1 48 GLU HB2 2 46 LYS H 4.140 . 6.282 5.355 5.107 5.621 . 0 0 "[ . 1 . 2]" 1 3166 1 47 ILE H 1 48 GLU HB3 5.441 . 9.141 4.586 4.447 4.771 . 0 0 "[ . 1 . 2]" 1 3167 1 48 GLU HB3 2 47 ILE H 5.441 . 9.141 4.584 4.450 4.766 . 0 0 "[ . 1 . 2]" 1 3168 1 38 ILE HB 1 47 ILE H 4.571 . 7.183 5.748 5.473 5.991 . 0 0 "[ . 1 . 2]" 1 3169 1 60 ILE HB 2 47 ILE H 4.571 . 7.183 5.754 5.495 6.006 . 0 0 "[ . 1 . 2]" 1 3170 1 38 ILE HG12 1 47 ILE H 4.158 . 6.319 4.196 4.060 4.295 . 0 0 "[ . 1 . 2]" 1 3171 1 48 GLU HB2 2 47 ILE H 4.158 . 6.319 4.193 4.051 4.295 . 0 0 "[ . 1 . 2]" 1 3172 1 46 LYS HB2 1 47 ILE H 4.640 . 7.331 2.984 2.866 3.186 . 0 0 "[ . 1 . 2]" 1 3173 1 49 ILE HG13 2 47 ILE H 4.640 . 7.331 2.984 2.870 3.187 . 0 0 "[ . 1 . 2]" 1 3174 1 47 ILE H 1 64 LEU MD2 4.707 . 7.477 5.280 4.689 5.509 . 0 0 "[ . 1 . 2]" 1 3175 1 36 VAL MG2 2 47 ILE H 4.707 . 7.477 5.283 4.703 5.515 . 0 0 "[ . 1 . 2]" 1 3176 1 38 ILE MD 1 47 ILE H 3.723 . 5.455 3.592 3.438 3.740 . 0 0 "[ . 1 . 2]" 1 3177 2 38 ILE MD 2 47 ILE H 3.723 . 5.455 3.593 3.436 3.739 . 0 0 "[ . 1 . 2]" 1 3178 1 47 ILE H 1 49 ILE MD 4.531 . 7.097 4.799 4.659 4.921 . 0 0 "[ . 1 . 2]" 1 3179 1 49 ILE MD 2 47 ILE H 4.531 . 7.097 4.801 4.657 4.922 . 0 0 "[ . 1 . 2]" 1 3180 1 47 ILE H 2 32 PHE HE2 5.379 . 8.995 7.628 7.194 8.084 . 0 0 "[ . 1 . 2]" 1 3181 1 32 PHE HE2 2 47 ILE H 5.379 . 8.995 7.632 7.187 8.087 . 0 0 "[ . 1 . 2]" 1 3182 1 38 ILE HG13 1 48 GLU H 3.503 . 5.037 3.873 3.802 3.952 . 0 0 "[ . 1 . 2]" 1 3183 2 38 ILE HG13 2 48 GLU H 3.503 . 5.037 3.873 3.802 3.952 . 0 0 "[ . 1 . 2]" 1 3184 1 46 LYS QD 1 48 GLU H 5.029 . 8.190 4.832 4.509 5.048 . 0 0 "[ . 1 . 2]" 1 3185 1 46 LYS QD 2 48 GLU H 5.029 . 8.190 4.831 4.509 5.050 . 0 0 "[ . 1 . 2]" 1 3186 1 36 VAL MG1 1 48 GLU H 3.356 . 4.764 3.750 3.617 3.891 . 0 0 "[ . 1 . 2]" 1 3187 2 36 VAL MG1 2 48 GLU H 3.356 . 4.764 3.749 3.616 3.890 . 0 0 "[ . 1 . 2]" 1 3188 1 48 GLU H 1 49 ILE HG12 4.399 . 6.817 4.782 4.701 4.839 . 0 0 "[ . 1 . 2]" 1 3189 1 49 ILE HG12 2 48 GLU H 4.399 . 6.817 4.782 4.707 4.842 . 0 0 "[ . 1 . 2]" 1 3190 1 46 LYS HB3 1 48 GLU H 4.722 . 7.509 5.690 5.617 5.753 . 0 0 "[ . 1 . 2]" 1 3191 1 46 LYS HB3 2 48 GLU H 4.722 . 7.509 5.689 5.613 5.753 . 0 0 "[ . 1 . 2]" 1 3192 1 46 LYS HB2 1 48 GLU H 5.336 . 8.895 4.726 4.583 4.821 . 0 0 "[ . 1 . 2]" 1 3193 1 46 LYS HB2 2 48 GLU H 5.336 . 8.895 4.726 4.579 4.822 . 0 0 "[ . 1 . 2]" 1 3194 1 48 GLU H 1 49 ILE H 4.508 . 7.048 4.010 3.963 4.044 . 0 0 "[ . 1 . 2]" 1 3195 1 49 ILE H 2 48 GLU H 4.508 . 7.048 4.011 3.963 4.046 . 0 0 "[ . 1 . 2]" 1 3196 1 48 GLU HB3 1 49 ILE H 4.579 . 7.200 3.979 3.851 4.079 . 0 0 "[ . 1 . 2]" 1 3197 1 48 GLU HB3 2 49 ILE H 4.579 . 7.200 3.978 3.848 4.074 . 0 0 "[ . 1 . 2]" 1 3198 1 49 ILE H 1 50 GLU HG2 4.422 . 6.866 4.756 4.629 4.906 . 0 0 "[ . 1 . 2]" 1 3199 1 47 ILE HG13 2 49 ILE H 4.422 . 6.866 4.757 4.630 4.905 . 0 0 "[ . 1 . 2]" 1 3200 1 48 GLU HB2 1 49 ILE H 3.433 . 4.906 2.658 2.610 2.706 . 0 0 "[ . 1 . 2]" 1 3201 2 48 GLU HB2 2 49 ILE H 3.433 . 4.906 2.658 2.610 2.706 . 0 0 "[ . 1 . 2]" 1 3202 1 49 ILE H 1 49 ILE HG13 4.499 . 7.029 3.209 3.072 3.333 . 0 0 "[ . 1 . 2]" 1 3203 1 46 LYS HB2 2 49 ILE H 4.499 . 7.029 3.205 3.065 3.331 . 0 0 "[ . 1 . 2]" 1 3204 1 35 THR MG 1 49 ILE H 4.803 . 7.686 4.855 4.592 5.060 . 0 0 "[ . 1 . 2]" 1 3205 1 46 LYS QG 2 49 ILE H 4.803 . 7.686 4.848 4.603 5.048 . 0 0 "[ . 1 . 2]" 1 3206 1 34 THR MG 1 49 ILE H 4.839 . 7.766 4.708 4.486 4.882 . 0 0 "[ . 1 . 2]" 1 3207 1 46 LYS QG 2 49 ILE H 4.839 . 7.766 4.702 4.494 4.879 . 0 0 "[ . 1 . 2]" 1 3208 1 36 VAL MG1 1 49 ILE H 3.990 . 5.980 4.103 3.954 4.228 . 0 0 "[ . 1 . 2]" 1 3209 1 47 ILE HG12 2 49 ILE H 3.990 . 5.980 4.104 3.955 4.233 . 0 0 "[ . 1 . 2]" 1 3210 1 47 ILE MG 1 49 ILE H 3.554 . 5.133 3.414 3.122 3.550 . 0 0 "[ . 1 . 2]" 1 3211 1 47 ILE MD 2 49 ILE H 3.554 . 5.133 3.416 3.129 3.556 . 0 0 "[ . 1 . 2]" 1 3212 1 39 LYS H 1 49 ILE H 5.820 . 10.054 6.749 6.428 7.052 . 0 0 "[ . 1 . 2]" 1 3213 1 39 LYS H 2 49 ILE H 5.820 . 10.054 6.746 6.420 7.036 . 0 0 "[ . 1 . 2]" 1 3214 1 48 GLU QG 1 49 ILE H 4.765 . 7.604 4.207 4.052 4.362 . 0 0 "[ . 1 . 2]" 1 3215 2 48 GLU QG 2 49 ILE H 4.765 . 7.604 4.207 4.051 4.363 . 0 0 "[ . 1 . 2]" 1 3216 1 48 GLU H 1 49 ILE H 4.455 . 6.936 4.011 3.963 4.046 . 0 0 "[ . 1 . 2]" 1 3217 1 48 GLU H 2 49 ILE H 4.455 . 6.936 4.010 3.963 4.044 . 0 0 "[ . 1 . 2]" 1 3218 1 47 ILE HA 1 50 GLU H 4.832 . 7.751 6.994 6.835 7.140 . 0 0 "[ . 1 . 2]" 1 3219 1 47 ILE HA 2 50 GLU H 4.832 . 7.751 6.994 6.836 7.135 . 0 0 "[ . 1 . 2]" 1 3220 1 50 GLU H 1 50 GLU HB2 3.954 . 5.908 2.364 2.147 2.509 . 0 0 "[ . 1 . 2]" 1 3221 2 50 GLU H 2 50 GLU HB2 3.954 . 5.908 2.364 2.149 2.510 . 0 0 "[ . 1 . 2]" 1 3222 1 48 GLU HB2 1 50 GLU H 4.444 . 6.913 5.156 4.774 5.530 . 0 0 "[ . 1 . 2]" 1 3223 1 38 ILE HG12 2 50 GLU H 4.444 . 6.913 5.156 4.775 5.530 . 0 0 "[ . 1 . 2]" 1 3224 1 49 ILE HG13 1 50 GLU H 4.609 . 7.264 4.272 3.952 4.735 . 0 0 "[ . 1 . 2]" 1 3225 1 46 LYS HB2 2 50 GLU H 4.609 . 7.264 4.269 3.954 4.730 . 0 0 "[ . 1 . 2]" 1 3226 1 28 LEU MD1 1 50 GLU H 4.180 . 6.364 4.700 4.455 5.013 . 0 0 "[ . 1 . 2]" 1 3227 1 64 LEU MD1 2 50 GLU H 4.180 . 6.364 4.700 4.459 5.011 . 0 0 "[ . 1 . 2]" 1 3228 1 47 ILE MG 1 50 GLU H 4.157 . 6.317 4.757 4.602 4.934 . 0 0 "[ . 1 . 2]" 1 3229 1 47 ILE MD 2 50 GLU H 4.157 . 6.317 4.760 4.610 4.944 . 0 0 "[ . 1 . 2]" 1 3230 1 32 PHE HE2 1 50 GLU H 5.482 . 9.238 5.868 5.080 6.680 . 0 0 "[ . 1 . 2]" 1 3231 2 32 PHE HE2 2 50 GLU H 5.482 . 9.238 5.868 5.083 6.685 . 0 0 "[ . 1 . 2]" 1 3232 1 51 PHE H 1 56 ASP HA 4.487 . 7.004 7.019 6.798 7.235 0.231 3 0 "[ . 1 . 2]" 1 3233 1 47 ILE HA 2 51 PHE H 4.487 . 7.004 7.022 6.815 7.238 0.234 2 0 "[ . 1 . 2]" 1 3234 1 49 ILE HB 1 51 PHE H 4.383 . 6.784 5.159 3.663 5.695 . 0 0 "[ . 1 . 2]" 1 3235 1 44 LYS QD 2 51 PHE H 4.383 . 6.784 5.157 3.670 5.694 . 0 0 "[ . 1 . 2]" 1 3236 1 51 PHE H 1 56 ASP QB 5.805 . 10.017 5.119 3.050 5.910 . 0 0 "[ . 1 . 2]" 1 3237 1 44 LYS QE 2 51 PHE H 5.805 . 10.017 5.119 3.062 5.903 . 0 0 "[ . 1 . 2]" 1 3238 1 51 PHE H 2 43 LYS QG 6.096 . 10.741 5.777 5.497 6.800 . 0 0 "[ . 1 . 2]" 1 3239 1 43 LYS QG 2 51 PHE H 6.096 . 10.741 5.772 5.489 6.789 . 0 0 "[ . 1 . 2]" 1 3240 1 50 GLU HB2 1 52 PHE H 5.188 . 8.553 5.984 5.554 6.380 . 0 0 "[ . 1 . 2]" 1 3241 1 44 LYS HB2 2 52 PHE H 5.188 . 8.553 5.983 5.560 6.366 . 0 0 "[ . 1 . 2]" 1 3242 1 50 GLU HB2 1 52 PHE H 5.303 . 8.818 5.464 5.195 5.799 . 0 0 "[ . 1 . 2]" 1 3243 1 43 LYS QD 2 52 PHE H 5.303 . 8.818 5.461 5.192 5.779 . 0 0 "[ . 1 . 2]" 1 3244 1 52 PHE H 1 57 LEU H 4.956 . 8.027 4.684 4.229 4.886 . 0 0 "[ . 1 . 2]" 1 3245 1 45 GLY H 2 52 PHE H 4.956 . 8.027 4.683 4.225 4.889 . 0 0 "[ . 1 . 2]" 1 3246 1 51 PHE HB3 1 53 SER H 3.932 . 5.865 3.566 3.016 3.883 . 0 0 "[ . 1 . 2]" 1 3247 2 51 PHE HB3 2 53 SER H 3.932 . 5.865 3.568 3.017 3.884 . 0 0 "[ . 1 . 2]" 1 3248 1 50 GLU HB2 1 53 SER H 4.789 . 7.656 6.402 5.225 7.339 . 0 0 "[ . 1 . 2]" 1 3249 1 44 LYS HB3 2 53 SER H 4.789 . 7.656 6.395 5.244 7.335 . 0 0 "[ . 1 . 2]" 1 3250 1 53 SER H 1 54 ASN HA 3.879 . 5.760 4.142 3.324 4.816 . 0 0 "[ . 1 . 2]" 1 3251 1 44 LYS HA 2 53 SER H 3.879 . 5.760 4.136 3.327 4.818 . 0 0 "[ . 1 . 2]" 1 3252 1 54 ASN HD22 1 57 LEU HB3 5.743 . 9.866 5.769 4.282 6.554 . 0 0 "[ . 1 . 2]" 1 3253 1 43 LYS QD 2 54 ASN HD22 5.743 . 9.866 5.768 4.285 6.556 . 0 0 "[ . 1 . 2]" 1 3254 1 54 ASN HD22 2 21 LEU HG 6.054 . 10.635 6.436 5.020 8.297 . 0 0 "[ . 1 . 2]" 1 3255 1 21 LEU HG 2 54 ASN HD22 6.054 . 10.635 6.428 5.001 8.300 . 0 0 "[ . 1 . 2]" 1 3256 1 54 ASN HD21 1 55 GLU HB2 6.086 . 10.716 4.873 3.720 6.032 . 0 0 "[ . 1 . 2]" 1 3257 1 16 VAL HB 2 54 ASN HD21 6.086 . 10.716 4.872 3.722 6.026 . 0 0 "[ . 1 . 2]" 1 3258 1 54 ASN HD21 1 57 LEU HB3 7.044 . 13.247 5.141 4.340 6.027 . 0 0 "[ . 1 . 2]" 1 3259 1 43 LYS QD 2 54 ASN HD21 7.044 . 13.247 5.142 4.329 6.028 . 0 0 "[ . 1 . 2]" 1 3260 1 54 ASN QB 1 55 GLU H 3.761 . 5.529 3.622 3.041 3.755 . 0 0 "[ . 1 . 2]" 1 3261 2 54 ASN QB 2 55 GLU H 3.761 . 5.529 3.621 3.033 3.754 . 0 0 "[ . 1 . 2]" 1 3262 1 50 GLU HB3 1 55 GLU H 5.783 . 9.963 8.407 8.036 8.603 . 0 0 "[ . 1 . 2]" 1 3263 1 21 LEU HB3 2 55 GLU H 5.783 . 9.963 8.407 8.033 8.599 . 0 0 "[ . 1 . 2]" 1 3264 1 57 LEU H 1 61 LEU HB2 4.831 . 7.749 6.874 6.695 7.151 . 0 0 "[ . 1 . 2]" 1 3265 1 40 ARG HB3 2 57 LEU H 4.831 . 7.749 6.873 6.696 7.149 . 0 0 "[ . 1 . 2]" 1 3266 1 55 GLU HG2 1 57 LEU H 5.118 . 8.392 4.965 4.599 5.979 . 0 0 "[ . 1 . 2]" 1 3267 2 55 GLU HG2 2 57 LEU H 5.118 . 8.392 4.964 4.597 5.978 . 0 0 "[ . 1 . 2]" 1 3268 1 58 ASP H 1 59 ARG HG2 5.947 . 10.367 6.244 4.483 6.890 . 0 0 "[ . 1 . 2]" 1 3269 1 21 LEU HG 2 58 ASP H 5.947 . 10.367 6.242 4.482 6.884 . 0 0 "[ . 1 . 2]" 1 3270 1 32 PHE HA 1 58 ASP H 5.795 . 9.992 10.084 9.617 10.385 0.393 20 0 "[ . 1 . 2]" 1 3271 1 17 LYS HA 2 58 ASP H 5.795 . 9.992 10.083 9.613 10.387 0.395 20 0 "[ . 1 . 2]" 1 3272 1 55 GLU HB3 1 58 ASP H 4.960 . 8.035 5.252 5.054 5.485 . 0 0 "[ . 1 . 2]" 1 3273 2 55 GLU HB3 2 58 ASP H 4.960 . 8.035 5.253 5.060 5.478 . 0 0 "[ . 1 . 2]" 1 3274 1 58 ASP H 2 21 LEU QD 4.513 . 7.059 5.057 3.573 5.543 . 0 0 "[ . 1 . 2]" 1 3275 1 21 LEU QD 2 58 ASP H 4.513 . 7.059 5.054 3.557 5.570 . 0 0 "[ . 1 . 2]" 1 3276 1 58 ASP H 1 60 ILE MD 4.122 . 6.246 4.660 3.537 5.003 . 0 0 "[ . 1 . 2]" 1 3277 1 21 LEU QD 2 58 ASP H 4.122 . 6.246 4.658 3.523 5.007 . 0 0 "[ . 1 . 2]" 1 3278 1 58 ASP H 1 61 LEU QD 3.664 . 5.342 4.267 4.179 4.346 . 0 0 "[ . 1 . 2]" 1 3279 2 58 ASP H 2 61 LEU QD 3.664 . 5.342 4.266 4.179 4.345 . 0 0 "[ . 1 . 2]" 1 3280 1 51 PHE HD2 1 58 ASP H 5.697 . 9.754 6.106 5.680 6.771 . 0 0 "[ . 1 . 2]" 1 3281 2 51 PHE HD2 2 58 ASP H 5.697 . 9.754 5.856 5.558 6.153 . 0 0 "[ . 1 . 2]" 1 3282 1 55 GLU HG2 1 58 ASP H 4.880 . 7.856 4.690 4.448 5.138 . 0 0 "[ . 1 . 2]" 1 3283 2 55 GLU HG2 2 58 ASP H 4.880 . 7.856 4.688 4.449 5.141 . 0 0 "[ . 1 . 2]" 1 3284 1 56 ASP H 1 59 ARG H 4.028 . 6.056 4.267 4.116 4.399 . 0 0 "[ . 1 . 2]" 1 3285 2 56 ASP H 2 59 ARG H 4.028 . 6.056 4.266 4.115 4.396 . 0 0 "[ . 1 . 2]" 1 3286 1 60 ILE H 1 60 ILE MG 3.524 . 5.076 3.370 3.256 3.447 . 0 0 "[ . 1 . 2]" 1 3287 2 60 ILE H 2 60 ILE MG 3.524 . 5.076 3.370 3.258 3.447 . 0 0 "[ . 1 . 2]" 1 3288 1 59 ARG H 1 61 LEU H 4.252 . 6.512 3.695 3.644 3.785 . 0 0 "[ . 1 . 2]" 1 3289 2 59 ARG H 2 61 LEU H 4.252 . 6.512 3.695 3.644 3.781 . 0 0 "[ . 1 . 2]" 1 3290 1 58 ASP HA 1 62 GLU H 4.008 . 6.016 4.163 3.887 4.405 . 0 0 "[ . 1 . 2]" 1 3291 2 58 ASP HA 2 62 GLU H 4.008 . 6.016 4.161 3.889 4.400 . 0 0 "[ . 1 . 2]" 1 3292 1 62 GLU H 1 63 LEU HG 4.258 . 6.525 6.159 6.014 6.261 . 0 0 "[ . 1 . 2]" 1 3293 1 24 ARG HG3 2 62 GLU H 4.258 . 6.525 6.160 6.021 6.264 . 0 0 "[ . 1 . 2]" 1 3294 1 60 ILE MD 1 62 GLU H 4.134 . 6.270 5.577 5.000 5.674 . 0 0 "[ . 1 . 2]" 1 3295 1 38 ILE MD 2 62 GLU H 4.134 . 6.270 5.575 4.996 5.675 . 0 0 "[ . 1 . 2]" 1 3296 1 61 LEU QD 1 62 GLU H 3.475 . 4.985 3.959 3.887 4.048 . 0 0 "[ . 1 . 2]" 1 3297 2 61 LEU QD 2 62 GLU H 3.475 . 4.985 3.959 3.887 4.049 . 0 0 "[ . 1 . 2]" 1 3298 1 63 LEU H 1 64 LEU HA 5.472 . 9.215 4.849 4.731 5.019 . 0 0 "[ . 1 . 2]" 1 3299 1 64 LEU HA 2 63 LEU H 5.472 . 9.215 4.848 4.734 5.023 . 0 0 "[ . 1 . 2]" 1 3300 1 59 ARG HB3 1 63 LEU H 4.570 . 7.180 4.558 3.747 5.007 . 0 0 "[ . 1 . 2]" 1 3301 2 59 ARG HB3 2 63 LEU H 4.570 . 7.180 4.557 3.744 5.010 . 0 0 "[ . 1 . 2]" 1 3302 1 49 ILE HG13 1 63 LEU H 4.987 . 8.096 5.352 5.182 5.479 . 0 0 "[ . 1 . 2]" 1 3303 2 49 ILE HG13 2 63 LEU H 4.987 . 8.096 5.352 5.183 5.483 . 0 0 "[ . 1 . 2]" 1 3304 1 60 ILE QG 1 63 LEU H 4.495 . 7.020 4.447 4.173 5.002 . 0 0 "[ . 1 . 2]" 1 3305 1 64 LEU MD2 2 63 LEU H 4.495 . 7.020 4.444 4.157 4.995 . 0 0 "[ . 1 . 2]" 1 3306 1 61 LEU HB2 1 63 LEU H 4.618 . 7.284 5.052 4.956 5.146 . 0 0 "[ . 1 . 2]" 1 3307 2 61 LEU HB2 2 63 LEU H 4.618 . 7.284 5.052 4.958 5.145 . 0 0 "[ . 1 . 2]" 1 3308 1 32 PHE HD2 1 63 LEU H 5.628 . 9.587 6.737 6.190 7.268 . 0 0 "[ . 1 . 2]" 1 3309 2 32 PHE HD2 2 63 LEU H 5.628 . 9.587 6.738 6.192 7.270 . 0 0 "[ . 1 . 2]" 1 3310 1 64 LEU H 1 66 GLU HB2 4.029 . 6.058 5.448 5.185 5.776 . 0 0 "[ . 1 . 2]" 1 3311 1 66 GLU HB2 2 64 LEU H 4.029 . 6.058 5.449 5.185 5.783 . 0 0 "[ . 1 . 2]" 1 3312 1 47 ILE HB 1 64 LEU H 4.268 . 6.545 6.729 6.402 6.990 0.445 9 0 "[ . 1 . 2]" 1 3313 1 38 ILE HG12 2 64 LEU H 4.268 . 6.545 6.724 6.387 6.981 0.436 9 0 "[ . 1 . 2]" 1 3314 1 64 LEU H 1 67 ARG QG 5.054 . 8.246 6.300 5.865 6.601 . 0 0 "[ . 1 . 2]" 1 3315 1 24 ARG QB 2 64 LEU H 5.054 . 8.246 6.299 5.867 6.605 . 0 0 "[ . 1 . 2]" 1 3316 1 28 LEU HB2 1 64 LEU H 5.526 . 9.344 7.997 7.562 8.389 . 0 0 "[ . 1 . 2]" 1 3317 1 28 LEU HB2 2 64 LEU H 5.526 . 9.344 7.993 7.553 8.397 . 0 0 "[ . 1 . 2]" 1 3318 1 60 ILE MG 1 64 LEU H 3.590 . 5.201 3.942 3.693 4.211 . 0 0 "[ . 1 . 2]" 1 3319 2 60 ILE MG 2 64 LEU H 3.590 . 5.201 3.942 3.694 4.210 . 0 0 "[ . 1 . 2]" 1 3320 1 60 ILE MG 1 64 LEU H 3.663 . 5.340 3.436 3.353 3.493 . 0 0 "[ . 1 . 2]" 1 3321 1 63 LEU QD 2 64 LEU H 3.663 . 5.340 3.436 3.353 3.497 . 0 0 "[ . 1 . 2]" 1 3322 1 62 GLU H 1 64 LEU H 3.895 . 5.791 3.684 3.529 3.876 . 0 0 "[ . 1 . 2]" 1 3323 2 62 GLU H 2 64 LEU H 3.895 . 5.791 3.684 3.529 3.873 . 0 0 "[ . 1 . 2]" 1 3324 1 32 PHE HB3 1 65 SER H 6.243 . 11.114 6.413 5.821 6.860 . 0 0 "[ . 1 . 2]" 1 3325 1 27 TYR HB2 2 65 SER H 6.243 . 11.114 6.413 5.822 6.857 . 0 0 "[ . 1 . 2]" 1 3326 1 62 GLU HG3 1 65 SER H 4.885 . 7.868 5.394 4.991 6.038 . 0 0 "[ . 1 . 2]" 1 3327 2 62 GLU HG3 2 65 SER H 4.885 . 7.868 5.395 4.987 6.037 . 0 0 "[ . 1 . 2]" 1 3328 1 62 GLU HG2 1 65 SER H 4.975 . 8.069 5.440 5.048 6.080 . 0 0 "[ . 1 . 2]" 1 3329 2 62 GLU HG2 2 65 SER H 4.975 . 8.069 5.441 5.046 6.079 . 0 0 "[ . 1 . 2]" 1 3330 1 64 LEU HG 1 65 SER H 3.927 . 5.854 4.365 4.214 4.553 . 0 0 "[ . 1 . 2]" 1 3331 2 64 LEU HG 2 65 SER H 3.927 . 5.854 4.365 4.213 4.553 . 0 0 "[ . 1 . 2]" 1 3332 1 65 SER H 1 67 ARG QG 5.588 . 9.491 4.979 4.356 5.454 . 0 0 "[ . 1 . 2]" 1 3333 1 24 ARG QB 2 65 SER H 5.588 . 9.491 4.978 4.361 5.458 . 0 0 "[ . 1 . 2]" 1 3334 1 64 LEU MD2 1 65 SER H 3.728 . 5.465 4.500 4.418 4.591 . 0 0 "[ . 1 . 2]" 1 3335 1 64 LEU MD2 2 65 SER H 3.728 . 5.465 4.500 4.416 4.592 . 0 0 "[ . 1 . 2]" 1 3336 1 64 LEU MD1 1 65 SER H 3.819 . 5.642 4.739 4.533 4.992 . 0 0 "[ . 1 . 2]" 1 3337 1 36 VAL MG1 2 65 SER H 3.819 . 5.642 4.739 4.529 4.999 . 0 0 "[ . 1 . 2]" 1 3338 1 61 LEU QD 1 65 SER H 4.100 . 6.202 5.387 5.081 5.590 . 0 0 "[ . 1 . 2]" 1 3339 2 61 LEU QD 2 65 SER H 4.100 . 6.202 5.387 5.077 5.591 . 0 0 "[ . 1 . 2]" 1 3340 1 63 LEU QD 1 65 SER H 3.895 . 5.791 4.116 3.600 4.713 . 0 0 "[ . 1 . 2]" 1 3341 1 63 LEU QD 2 65 SER H 3.895 . 5.791 4.117 3.599 4.719 . 0 0 "[ . 1 . 2]" 1 3342 1 65 SER H 2 24 ARG QH1 4.522 . 7.078 4.586 4.077 5.068 . 0 0 "[ . 1 . 2]" 1 3343 1 24 ARG QH1 2 65 SER H 4.522 . 7.078 4.587 4.077 5.076 . 0 0 "[ . 1 . 2]" 1 3344 1 31 TYR HE2 1 65 SER H 5.262 . 8.723 6.202 5.524 7.337 . 0 0 "[ . 1 . 2]" 1 3345 1 31 TYR HE2 2 65 SER H 5.262 . 8.723 6.207 5.534 7.335 . 0 0 "[ . 1 . 2]" 1 3346 1 64 LEU MD2 1 66 GLU H 4.635 . 7.320 5.231 5.008 5.627 . 0 0 "[ . 1 . 2]" 1 3347 1 64 LEU MD2 2 66 GLU H 4.635 . 7.320 5.230 5.005 5.626 . 0 0 "[ . 1 . 2]" 1 3348 1 64 LEU HA 1 66 GLU H 2.607 . 3.457 3.213 2.605 3.404 . 0 0 "[ . 1 . 2]" 1 3349 2 64 LEU HA 2 66 GLU H 2.607 . 3.457 3.213 2.602 3.403 . 0 0 "[ . 1 . 2]" 1 3350 1 62 GLU QB 1 66 GLU H 3.786 . 5.578 4.086 3.867 4.433 . 0 0 "[ . 1 . 2]" 1 3351 1 63 LEU QB 2 66 GLU H 3.786 . 5.578 4.085 3.865 4.428 . 0 0 "[ . 1 . 2]" 1 3352 1 63 LEU H 1 66 GLU H 3.984 . 5.968 3.966 3.705 4.613 . 0 0 "[ . 1 . 2]" 1 3353 2 63 LEU H 2 66 GLU H 3.984 . 5.968 3.965 3.700 4.601 . 0 0 "[ . 1 . 2]" 1 3354 1 66 GLU H 2 24 ARG QH1 4.797 . 7.673 4.981 3.669 5.820 . 0 0 "[ . 1 . 2]" 1 3355 1 24 ARG QH1 2 66 GLU H 4.797 . 7.673 4.979 3.659 5.812 . 0 0 "[ . 1 . 2]" 1 3356 1 66 GLU HG2 1 67 ARG H 3.686 . 5.384 3.788 3.052 4.273 . 0 0 "[ . 1 . 2]" 1 3357 2 66 GLU HG2 2 67 ARG H 3.686 . 5.384 3.791 3.051 4.267 . 0 0 "[ . 1 . 2]" 1 3358 1 63 LEU H 1 67 ARG H 5.012 . 8.152 6.079 5.529 7.317 . 0 0 "[ . 1 . 2]" 1 3359 2 63 LEU H 2 67 ARG H 5.012 . 8.152 6.077 5.529 7.316 . 0 0 "[ . 1 . 2]" 1 3360 1 67 ARG HA 1 68 GLU H 2.024 . 6.000 2.705 2.570 2.742 . 0 0 "[ . 1 . 2]" 1 3361 2 67 ARG HA 2 68 GLU H 2.024 . 6.000 2.706 2.568 2.745 . 0 0 "[ . 1 . 2]" 1 3362 1 69 SER H 1 69 SER QB 2.417 . 3.147 2.556 2.293 2.982 . 0 0 "[ . 1 . 2]" 1 3363 2 69 SER H 2 69 SER QB 2.417 . 3.147 2.554 2.287 2.976 . 0 0 "[ . 1 . 2]" 1 3364 1 67 ARG QG 1 69 SER H 4.762 . 7.597 5.314 5.016 5.948 . 0 0 "[ . 1 . 2]" 1 3365 2 67 ARG QG 2 69 SER H 4.762 . 7.597 5.313 5.014 5.953 . 0 0 "[ . 1 . 2]" 1 3366 1 66 GLU HG2 1 69 SER H 3.390 . 4.826 3.113 2.494 3.998 . 0 0 "[ . 1 . 2]" 1 3367 2 66 GLU HG2 2 69 SER H 3.390 . 4.826 3.108 2.494 4.002 . 0 0 "[ . 1 . 2]" 1 3368 1 66 GLU HG3 1 69 SER H 3.074 . 4.255 3.754 2.677 4.305 0.050 10 0 "[ . 1 . 2]" 1 3369 2 66 GLU HG3 2 69 SER H 3.074 . 4.255 3.751 2.675 4.303 0.048 10 0 "[ . 1 . 2]" 1 3370 1 17 LYS QG 1 18 ASP H 4.415 . 6.852 3.770 3.665 3.874 . 0 0 "[ . 1 . 2]" 1 3371 2 17 LYS QG 2 18 ASP H 4.415 . 6.852 3.769 3.663 3.874 . 0 0 "[ . 1 . 2]" 1 3372 1 23 GLU HA 1 24 ARG H 3.032 . 4.181 2.752 2.729 2.768 . 0 0 "[ . 1 . 2]" 1 3373 2 23 GLU HA 2 24 ARG H 3.032 . 4.181 2.752 2.730 2.769 . 0 0 "[ . 1 . 2]" 1 3374 1 23 GLU HG2 1 24 ARG H 4.006 . 6.012 3.489 2.720 4.195 . 0 0 "[ . 1 . 2]" 1 3375 2 23 GLU HG2 2 24 ARG H 4.006 . 6.012 3.490 2.729 4.196 . 0 0 "[ . 1 . 2]" 1 3376 1 20 VAL HB 1 24 ARG H 4.345 . 6.704 5.376 5.291 5.510 . 0 0 "[ . 1 . 2]" 1 3377 2 20 VAL HB 2 24 ARG H 4.345 . 6.704 5.375 5.292 5.509 . 0 0 "[ . 1 . 2]" 1 3378 1 20 VAL MG2 1 24 ARG H 4.849 . 7.788 5.586 5.378 5.882 . 0 0 "[ . 1 . 2]" 1 3379 2 20 VAL MG2 2 24 ARG H 4.849 . 7.788 5.586 5.377 5.883 . 0 0 "[ . 1 . 2]" 1 3380 1 20 VAL MG1 1 24 ARG H 3.697 . 5.406 4.040 3.812 4.241 . 0 0 "[ . 1 . 2]" 1 3381 2 20 VAL MG1 2 24 ARG H 3.697 . 5.406 4.040 3.814 4.245 . 0 0 "[ . 1 . 2]" 1 3382 1 24 ARG H 1 47 ILE MD 5.073 . 8.290 7.406 7.095 7.664 . 0 0 "[ . 1 . 2]" 1 3383 2 24 ARG H 2 47 ILE MD 5.073 . 8.290 7.405 7.090 7.663 . 0 0 "[ . 1 . 2]" 1 3384 1 21 LEU QD 1 24 ARG H 3.951 . 5.902 4.102 3.982 4.223 . 0 0 "[ . 1 . 2]" 1 3385 2 21 LEU QD 2 24 ARG H 3.951 . 5.902 4.102 3.987 4.222 . 0 0 "[ . 1 . 2]" 1 3386 1 21 LEU HB2 1 24 ARG H 4.428 . 6.879 5.345 5.162 5.472 . 0 0 "[ . 1 . 2]" 1 3387 2 21 LEU HB2 2 24 ARG H 4.428 . 6.879 5.345 5.164 5.470 . 0 0 "[ . 1 . 2]" 1 3388 1 19 ALA MB 1 24 ARG H 5.306 . 8.825 6.010 5.869 6.191 . 0 0 "[ . 1 . 2]" 1 3389 2 19 ALA MB 2 24 ARG H 5.306 . 8.825 6.009 5.866 6.188 . 0 0 "[ . 1 . 2]" 1 3390 1 22 LYS QB 1 24 ARG H 4.593 . 7.230 4.706 4.550 4.920 . 0 0 "[ . 1 . 2]" 1 3391 2 22 LYS QB 2 24 ARG H 4.593 . 7.230 4.706 4.546 4.915 . 0 0 "[ . 1 . 2]" 1 3392 1 31 TYR H 1 31 TYR QB 3.065 . 4.239 2.261 2.162 2.301 . 0 0 "[ . 1 . 2]" 1 3393 2 31 TYR H 2 31 TYR QB 3.065 . 4.239 2.262 2.162 2.303 . 0 0 "[ . 1 . 2]" 1 3394 1 30 ASN HD22 1 31 TYR H 5.055 . 8.249 4.906 4.800 5.027 . 0 0 "[ . 1 . 2]" 1 3395 2 30 ASN HD22 2 31 TYR H 5.055 . 8.249 4.904 4.793 5.025 . 0 0 "[ . 1 . 2]" 1 3396 1 28 LEU MD2 1 31 TYR H 4.058 . 6.117 4.475 4.363 4.548 . 0 0 "[ . 1 . 2]" 1 3397 2 28 LEU MD2 2 31 TYR H 4.058 . 6.117 4.475 4.362 4.550 . 0 0 "[ . 1 . 2]" 1 3398 1 28 LEU MD1 1 31 TYR H 4.896 . 7.892 5.864 5.765 5.963 . 0 0 "[ . 1 . 2]" 1 3399 2 28 LEU MD1 2 31 TYR H 4.896 . 7.892 5.864 5.765 5.967 . 0 0 "[ . 1 . 2]" 1 3400 1 29 GLN HE21 1 35 THR H 5.940 . 10.350 6.381 6.115 6.875 . 0 0 "[ . 1 . 2]" 1 3401 2 29 GLN HE21 2 35 THR H 5.940 . 10.350 6.380 6.110 6.879 . 0 0 "[ . 1 . 2]" 1 3402 1 37 ASN HD22 1 50 GLU H 5.492 . 9.263 5.542 4.850 5.959 . 0 0 "[ . 1 . 2]" 1 3403 2 37 ASN HD22 2 50 GLU H 5.492 . 9.263 5.296 4.833 5.611 . 0 0 "[ . 1 . 2]" 1 3404 1 27 TYR HE2 1 30 ASN H 5.761 . 9.910 6.693 6.427 7.196 . 0 0 "[ . 1 . 2]" 1 3405 1 27 TYR HE2 2 64 LEU H 5.761 . 9.910 6.694 6.417 7.193 . 0 0 "[ . 1 . 2]" 1 3406 1 34 THR HB 1 59 ARG H 5.515 . 9.317 6.710 6.433 6.929 . 0 0 "[ . 1 . 2]" 1 3407 2 34 THR HB 2 59 ARG H 5.515 . 9.317 6.710 6.432 6.932 . 0 0 "[ . 1 . 2]" 1 3408 1 57 LEU HA 1 59 ARG H 5.088 . 8.324 4.250 3.868 4.473 . 0 0 "[ . 1 . 2]" 1 3409 2 57 LEU HA 2 59 ARG H 5.088 . 8.324 4.250 3.870 4.487 . 0 0 "[ . 1 . 2]" 1 3410 1 46 LYS H 1 47 ILE MD 4.611 . 7.268 4.450 4.086 4.734 . 0 0 "[ . 1 . 2]" 1 3411 2 46 LYS H 2 47 ILE MD 4.611 . 7.268 4.451 4.088 4.732 . 0 0 "[ . 1 . 2]" 1 3412 1 68 GLU H 1 69 SER QB 4.823 . 7.731 4.263 3.869 4.645 . 0 0 "[ . 1 . 2]" 1 3413 2 68 GLU H 2 69 SER QB 4.823 . 7.731 4.262 3.861 4.640 . 0 0 "[ . 1 . 2]" 1 3414 1 67 ARG H 1 69 SER QB 4.698 . 7.457 5.422 4.991 5.880 . 0 0 "[ . 1 . 2]" 1 3415 2 67 ARG H 2 69 SER QB 4.698 . 7.457 5.423 4.992 5.875 . 0 0 "[ . 1 . 2]" 1 3416 1 26 SER QB 1 30 ASN HD21 5.235 . 8.660 4.594 3.736 5.185 . 0 0 "[ . 1 . 2]" 1 3417 2 26 SER QB 2 30 ASN HD21 5.235 . 8.660 4.593 3.735 5.159 . 0 0 "[ . 1 . 2]" 1 3418 1 26 SER QB 1 30 ASN HD22 4.783 . 7.642 4.742 4.035 5.322 . 0 0 "[ . 1 . 2]" 1 3419 2 26 SER QB 2 30 ASN HD22 4.783 . 7.642 4.740 4.040 5.325 . 0 0 "[ . 1 . 2]" 1 3420 1 37 ASN HD21 1 47 ILE MG 5.524 . 9.338 6.243 6.028 6.670 . 0 0 "[ . 1 . 2]" 1 3421 1 47 ILE MD 2 37 ASN HD21 5.524 . 9.338 6.245 6.023 6.671 . 0 0 "[ . 1 . 2]" 1 3422 1 29 GLN HA 1 37 ASN HD22 5.803 . 10.012 7.078 6.269 7.366 . 0 0 "[ . 1 . 2]" 1 3423 2 29 GLN HA 2 37 ASN HD22 5.803 . 10.012 7.078 6.265 7.358 . 0 0 "[ . 1 . 2]" 1 3424 1 24 ARG HH11 2 61 LEU QD 6.320 . 11.313 3.036 2.520 3.805 . 0 0 "[ . 1 . 2]" 1 3425 1 61 LEU QD 2 24 ARG HH11 6.320 . 11.313 3.030 2.536 3.827 . 0 0 "[ . 1 . 2]" 1 3426 1 20 VAL MG2 1 24 ARG HE 5.045 . 8.226 5.162 3.905 5.735 . 0 0 "[ . 1 . 2]" 1 3427 2 20 VAL MG2 2 24 ARG HE 5.045 . 8.226 5.160 3.906 5.735 . 0 0 "[ . 1 . 2]" 1 3428 1 24 ARG HE 1 38 ILE MD 5.228 . 8.644 6.027 4.947 6.409 . 0 0 "[ . 1 . 2]" 1 3429 2 24 ARG HE 2 38 ILE MD 5.228 . 8.644 6.026 4.949 6.398 . 0 0 "[ . 1 . 2]" 1 3430 1 20 VAL MG1 1 24 ARG HH11 5.930 . 10.325 4.709 4.083 5.091 . 0 0 "[ . 1 . 2]" 1 3431 2 20 VAL MG1 2 24 ARG HH11 5.930 . 10.325 4.710 4.089 5.091 . 0 0 "[ . 1 . 2]" 1 3432 1 24 ARG HH11 1 38 ILE MD 6.608 . 12.066 5.389 5.125 5.985 . 0 0 "[ . 1 . 2]" 1 3433 1 64 LEU MD1 2 24 ARG HH11 6.608 . 12.066 5.388 5.121 5.976 . 0 0 "[ . 1 . 2]" 1 3434 1 33 GLY HA3 1 59 ARG HE 5.586 . 9.486 4.704 3.643 5.439 . 0 0 "[ . 1 . 2]" 1 3435 2 33 GLY HA3 2 59 ARG HE 5.586 . 9.486 4.705 3.635 5.439 . 0 0 "[ . 1 . 2]" 1 3436 1 67 ARG HE 1 67 ARG QG 3.569 . 5.161 2.516 2.193 2.739 . 0 0 "[ . 1 . 2]" 1 3437 2 67 ARG HE 2 67 ARG QG 3.569 . 5.161 2.516 2.194 2.747 . 0 0 "[ . 1 . 2]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 56 _Distance_constraint_stats_list.Viol_count 153 _Distance_constraint_stats_list.Viol_total 1343.705 _Distance_constraint_stats_list.Viol_max 1.671 _Distance_constraint_stats_list.Viol_rms 0.2087 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0600 _Distance_constraint_stats_list.Viol_average_violations_only 0.4391 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details . loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 21 LEU 0.136 0.053 16 0 "[ . 1 . 2]" 1 24 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 25 GLU 3.465 0.642 13 5 "[ *. 1 + **- 2]" 1 27 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 28 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 29 GLN 8.824 0.903 9 13 "[****.***+* *- ** 2]" 1 30 ASN 3.434 0.566 10 1 "[ . + . 2]" 1 31 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 32 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 33 GLY 3.434 0.566 10 1 "[ . + . 2]" 1 34 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 35 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 36 VAL 8.824 0.903 9 13 "[****.***+* *- ** 2]" 1 37 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 38 ILE 3.330 0.642 13 5 "[ *. 1 + **- 2]" 1 39 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 45 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 46 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 47 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 48 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 49 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 50 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 51 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 53 SER 10.867 1.671 8 8 "[ * . +** *- .** 2]" 1 54 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 55 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 56 ASP 10.867 1.671 8 8 "[ * . +** *- .** 2]" 1 57 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 58 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 59 ARG 2.656 0.659 9 1 "[ . +1 . 2]" 1 60 ILE 0.448 0.229 9 0 "[ . 1 . 2]" 1 61 LEU 0.012 0.012 9 0 "[ . 1 . 2]" 1 62 GLU 3.777 1.465 16 3 "[ . -1 *+ 2]" 1 63 LEU 2.656 0.659 9 1 "[ . +1 . 2]" 1 64 LEU 0.448 0.229 9 0 "[ . 1 . 2]" 1 65 SER 0.012 0.012 9 0 "[ . 1 . 2]" 1 66 GLU 3.777 1.465 16 3 "[ . -1 *+ 2]" 2 21 LEU 0.133 0.052 16 0 "[ . 1 . 2]" 2 24 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 2 25 GLU 3.432 0.658 13 5 "[ *. 1 + **- 2]" 2 27 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 2 28 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 2 29 GLN 8.838 0.899 9 13 "[****.***+* *- ** 2]" 2 30 ASN 3.558 0.547 10 1 "[ . + . 2]" 2 31 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 2 32 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 2 33 GLY 3.558 0.547 10 1 "[ . + . 2]" 2 34 THR 0.000 0.000 . 0 "[ . 1 . 2]" 2 35 THR 0.000 0.000 . 0 "[ . 1 . 2]" 2 36 VAL 8.838 0.899 9 13 "[****.***+* *- ** 2]" 2 37 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 2 38 ILE 3.299 0.658 13 5 "[ *. 1 + **- 2]" 2 39 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 2 45 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 2 46 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 2 47 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 2 48 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 2 49 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 2 50 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 2 51 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 2 53 SER 10.952 1.644 8 8 "[ * . +** *- .** 2]" 2 54 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 2 55 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 2 56 ASP 10.952 1.644 8 8 "[ * . +** *- .** 2]" 2 57 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 2 58 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 2 59 ARG 2.700 0.677 9 1 "[ . +1 . 2]" 2 60 ILE 0.449 0.231 9 0 "[ . 1 . 2]" 2 61 LEU 0.010 0.010 9 0 "[ . 1 . 2]" 2 62 GLU 3.762 1.460 16 3 "[ . -1 *+ 2]" 2 63 LEU 2.700 0.677 9 1 "[ . +1 . 2]" 2 64 LEU 0.449 0.231 9 0 "[ . 1 . 2]" 2 65 SER 0.010 0.010 9 0 "[ . 1 . 2]" 2 66 GLU 3.762 1.460 16 3 "[ . -1 *+ 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 21 LEU O 1 25 GLU H 2.200 . 2.700 1.826 1.677 2.201 0.053 16 0 "[ . 1 . 2]" 2 2 1 24 ARG O 1 28 LEU H 2.200 . 2.700 1.940 1.784 2.131 . 0 0 "[ . 1 . 2]" 2 3 1 25 GLU O 1 29 GLN H 2.200 . 2.700 1.967 1.872 2.185 . 0 0 "[ . 1 . 2]" 2 4 1 27 TYR O 1 31 TYR H 2.200 . 2.700 2.071 1.915 2.203 . 0 0 "[ . 1 . 2]" 2 5 1 28 LEU O 1 32 PHE H 2.200 . 2.700 2.262 1.980 2.455 . 0 0 "[ . 1 . 2]" 2 6 1 30 ASN O 1 33 GLY H 2.200 . 2.700 2.859 2.598 3.266 0.566 10 1 "[ . + . 2]" 2 7 1 29 GLN O 1 34 THR H 2.200 . 2.700 2.161 1.994 2.537 . 0 0 "[ . 1 . 2]" 2 8 1 29 GLN OE1 1 36 VAL H 2.200 . 2.700 2.961 2.052 3.603 0.903 9 13 "[****.***+* *- ** 2]" 2 9 1 37 ASN H 1 48 GLU O 2.200 . 2.700 2.160 2.066 2.337 . 0 0 "[ . 1 . 2]" 2 10 1 25 GLU OE1 1 38 ILE H 2.200 . 2.700 2.344 1.718 3.342 0.642 13 5 "[ *. 1 + **- 2]" 2 11 1 39 LYS H 1 46 LYS O 2.200 . 2.700 1.914 1.758 2.128 . 0 0 "[ . 1 . 2]" 2 12 1 39 LYS O 1 46 LYS H 2.200 . 2.700 2.385 2.103 2.675 . 0 0 "[ . 1 . 2]" 2 13 1 37 ASN O 1 48 GLU H 2.200 . 2.700 1.885 1.777 2.019 . 0 0 "[ . 1 . 2]" 2 14 1 35 THR O 1 50 GLU H 2.200 . 2.700 1.953 1.902 2.035 . 0 0 "[ . 1 . 2]" 2 15 1 53 SER H 1 56 ASP OD1 2.200 . 2.700 3.150 1.911 4.371 1.671 8 8 "[ * . +** *- .** 2]" 2 16 1 54 ASN O 1 58 ASP H 2.200 . 2.700 2.136 1.977 2.447 . 0 0 "[ . 1 . 2]" 2 17 1 55 GLU O 1 59 ARG H 2.200 . 2.700 2.244 1.954 2.580 . 0 0 "[ . 1 . 2]" 2 18 1 56 ASP O 1 60 ILE H 2.200 . 2.700 1.886 1.787 2.080 . 0 0 "[ . 1 . 2]" 2 19 1 57 LEU O 1 61 LEU H 2.200 . 2.700 1.982 1.861 2.138 . 0 0 "[ . 1 . 2]" 2 20 1 58 ASP O 1 62 GLU H 2.200 . 2.700 2.358 2.067 2.625 . 0 0 "[ . 1 . 2]" 2 21 1 59 ARG O 1 63 LEU H 2.200 . 2.700 2.651 2.144 3.359 0.659 9 1 "[ . +1 . 2]" 2 22 1 60 ILE O 1 64 LEU H 2.200 . 2.700 2.415 1.998 2.929 0.229 9 0 "[ . 1 . 2]" 2 23 1 61 LEU O 1 65 SER H 2.200 . 2.700 2.050 1.718 2.224 0.012 9 0 "[ . 1 . 2]" 2 24 1 62 GLU O 1 66 GLU H 2.200 . 2.700 2.505 1.918 4.165 1.465 16 3 "[ . -1 *+ 2]" 2 25 2 21 LEU O 2 25 GLU H 2.200 . 2.700 1.827 1.678 2.204 0.052 16 0 "[ . 1 . 2]" 2 26 2 24 ARG O 2 28 LEU H 2.200 . 2.700 1.941 1.785 2.134 . 0 0 "[ . 1 . 2]" 2 27 2 25 GLU O 2 29 GLN H 2.200 . 2.700 1.968 1.874 2.183 . 0 0 "[ . 1 . 2]" 2 28 2 27 TYR O 2 31 TYR H 2.200 . 2.700 2.074 1.919 2.214 . 0 0 "[ . 1 . 2]" 2 29 2 28 LEU O 2 32 PHE H 2.200 . 2.700 2.263 1.981 2.455 . 0 0 "[ . 1 . 2]" 2 30 2 30 ASN O 2 33 GLY H 2.200 . 2.700 2.867 2.596 3.247 0.547 10 1 "[ . + . 2]" 2 31 2 29 GLN O 2 34 THR H 2.200 . 2.700 2.159 1.993 2.531 . 0 0 "[ . 1 . 2]" 2 32 2 29 GLN OE1 2 36 VAL H 2.200 . 2.700 2.961 2.053 3.599 0.899 9 13 "[****.***+* *- ** 2]" 2 33 2 37 ASN H 2 48 GLU O 2.200 . 2.700 2.160 2.067 2.338 . 0 0 "[ . 1 . 2]" 2 34 2 25 GLU OE1 2 38 ILE H 2.200 . 2.700 2.342 1.723 3.358 0.658 13 5 "[ *. 1 + **- 2]" 2 35 2 39 LYS H 2 46 LYS O 2.200 . 2.700 1.913 1.758 2.128 . 0 0 "[ . 1 . 2]" 2 36 2 39 LYS O 2 46 LYS H 2.200 . 2.700 2.385 2.106 2.680 . 0 0 "[ . 1 . 2]" 2 37 2 37 ASN O 2 48 GLU H 2.200 . 2.700 1.887 1.782 2.024 . 0 0 "[ . 1 . 2]" 2 38 2 35 THR O 2 50 GLU H 2.200 . 2.700 1.954 1.904 2.037 . 0 0 "[ . 1 . 2]" 2 39 2 53 SER H 2 56 ASP OD1 2.200 . 2.700 3.158 1.924 4.344 1.644 8 8 "[ * . +** *- .** 2]" 2 40 2 54 ASN O 2 58 ASP H 2.200 . 2.700 2.136 1.961 2.452 . 0 0 "[ . 1 . 2]" 2 41 2 55 GLU O 2 59 ARG H 2.200 . 2.700 2.244 1.957 2.562 . 0 0 "[ . 1 . 2]" 2 42 2 56 ASP O 2 60 ILE H 2.200 . 2.700 1.887 1.789 2.082 . 0 0 "[ . 1 . 2]" 2 43 2 57 LEU O 2 61 LEU H 2.200 . 2.700 1.981 1.859 2.138 . 0 0 "[ . 1 . 2]" 2 44 2 58 ASP O 2 62 GLU H 2.200 . 2.700 2.354 2.066 2.615 . 0 0 "[ . 1 . 2]" 2 45 2 59 ARG O 2 63 LEU H 2.200 . 2.700 2.653 2.152 3.377 0.677 9 1 "[ . +1 . 2]" 2 46 2 60 ILE O 2 64 LEU H 2.200 . 2.700 2.416 1.999 2.931 0.231 9 0 "[ . 1 . 2]" 2 47 2 61 LEU O 2 65 SER H 2.200 . 2.700 2.046 1.720 2.240 0.010 9 0 "[ . 1 . 2]" 2 48 2 62 GLU O 2 66 GLU H 2.200 . 2.700 2.502 1.937 4.160 1.460 16 3 "[ . -1 *+ 2]" 2 49 1 45 GLY H 2 51 PHE O 2.200 . 2.700 2.258 1.937 2.469 . 0 0 "[ . 1 . 2]" 2 50 1 47 ILE H 2 49 ILE O 2.200 . 2.700 2.026 1.847 2.154 . 0 0 "[ . 1 . 2]" 2 51 1 49 ILE H 2 47 ILE O 2.200 . 2.700 1.883 1.795 1.997 . 0 0 "[ . 1 . 2]" 2 52 1 51 PHE H 2 45 GLY O 2.200 . 2.700 2.037 1.901 2.454 . 0 0 "[ . 1 . 2]" 2 53 1 51 PHE O 2 45 GLY H 2.200 . 2.700 2.263 1.932 2.497 . 0 0 "[ . 1 . 2]" 2 54 1 49 ILE O 2 47 ILE H 2.200 . 2.700 2.025 1.852 2.149 . 0 0 "[ . 1 . 2]" 2 55 1 47 ILE O 2 49 ILE H 2.200 . 2.700 1.883 1.803 1.995 . 0 0 "[ . 1 . 2]" 2 56 1 45 GLY O 2 51 PHE H 2.200 . 2.700 2.031 1.902 2.428 . 0 0 "[ . 1 . 2]" 2 stop_ save_
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