NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
400833 | 1v63 | 10111 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1v63 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 2076 _Distance_constraint_stats_list.Viol_count 2523 _Distance_constraint_stats_list.Viol_total 3547.008 _Distance_constraint_stats_list.Viol_max 0.981 _Distance_constraint_stats_list.Viol_rms 0.0329 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0043 _Distance_constraint_stats_list.Viol_average_violations_only 0.0703 _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 4 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 5 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 6 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 7 GLY 0.012 0.008 19 0 "[ . 1 . 2]" 1 8 PRO 0.530 0.064 16 0 "[ . 1 . 2]" 1 9 LYS 5.705 0.704 16 1 "[ . 1 .+ 2]" 1 10 LYS 10.910 0.754 3 4 "[ + . 1 .* * -]" 1 11 PRO 4.581 0.369 18 0 "[ . 1 . 2]" 1 12 PRO 0.825 0.406 16 0 "[ . 1 . 2]" 1 13 MET 4.186 0.945 1 3 "[+ . 1 * . -2]" 1 14 ASN 0.081 0.039 4 0 "[ . 1 . 2]" 1 15 GLY 0.160 0.041 4 0 "[ . 1 . 2]" 1 16 TYR 1.022 0.077 18 0 "[ . 1 . 2]" 1 17 GLN 4.161 0.945 1 2 "[+ . 1 - . 2]" 1 18 LYS 9.831 0.744 11 8 "[ * .*** *+ .- * 2]" 1 19 PHE 3.172 0.122 7 0 "[ . 1 . 2]" 1 20 SER 0.729 0.094 19 0 "[ . 1 . 2]" 1 21 GLN 3.512 0.367 3 0 "[ . 1 . 2]" 1 22 GLU 9.128 0.601 8 3 "[ * . + 1 - . 2]" 1 23 LEU 12.259 0.601 8 3 "[ * . + 1 - . 2]" 1 24 LEU 1.639 0.076 2 0 "[ . 1 . 2]" 1 25 SER 2.459 0.138 19 0 "[ . 1 . 2]" 1 26 ASN 6.894 0.210 20 0 "[ . 1 . 2]" 1 27 GLY 1.081 0.076 18 0 "[ . 1 . 2]" 1 28 GLU 9.232 0.258 18 0 "[ . 1 . 2]" 1 29 LEU 3.159 0.514 1 1 "[+ . 1 . 2]" 1 30 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 31 HIS 0.007 0.007 19 0 "[ . 1 . 2]" 1 32 LEU 6.727 0.835 1 1 "[+ . 1 . 2]" 1 33 PRO 1.360 0.095 14 0 "[ . 1 . 2]" 1 34 LEU 1.556 0.076 8 0 "[ . 1 . 2]" 1 35 LYS 3.922 0.744 17 3 "[ *. 1 - + 2]" 1 36 GLU 13.438 0.744 17 3 "[ *. 1 - + 2]" 1 37 ARG 2.206 0.531 1 1 "[+ . 1 . 2]" 1 38 MET 0.812 0.074 13 0 "[ . 1 . 2]" 1 39 VAL 2.314 0.201 17 0 "[ . 1 . 2]" 1 40 GLU 5.329 0.835 1 1 "[+ . 1 . 2]" 1 41 ILE 4.498 0.291 1 0 "[ . 1 . 2]" 1 42 GLY 0.033 0.020 17 0 "[ . 1 . 2]" 1 43 SER 1.980 0.320 1 0 "[ . 1 . 2]" 1 44 ARG 5.561 0.447 1 0 "[ . 1 . 2]" 1 45 TRP 2.722 0.452 10 0 "[ . 1 . 2]" 1 46 GLN 0.907 0.075 16 0 "[ . 1 . 2]" 1 47 ARG 0.210 0.038 19 0 "[ . 1 . 2]" 1 48 ILE 2.588 0.499 10 0 "[ . 1 . 2]" 1 49 SER 1.653 0.192 6 0 "[ . 1 . 2]" 1 50 GLN 1.432 0.297 13 0 "[ . 1 . 2]" 1 51 SER 0.512 0.192 6 0 "[ . 1 . 2]" 1 52 GLN 1.962 0.152 16 0 "[ . 1 . 2]" 1 53 LYS 3.199 0.499 10 0 "[ . 1 . 2]" 1 54 GLU 1.338 0.111 13 0 "[ . 1 . 2]" 1 55 HIS 2.337 0.152 16 0 "[ . 1 . 2]" 1 56 TYR 11.320 0.744 11 8 "[ * .*** *+ .- * 2]" 1 57 LYS 0.997 0.153 20 0 "[ . 1 . 2]" 1 58 LYS 10.299 0.867 2 5 "[ + . * 1 *- * 2]" 1 59 LEU 5.788 0.466 11 0 "[ . 1 . 2]" 1 60 ALA 0.428 0.085 19 0 "[ . 1 . 2]" 1 61 GLU 2.222 0.867 2 2 "[ + . - 1 . 2]" 1 62 GLU 4.954 0.303 11 0 "[ . 1 . 2]" 1 63 GLN 1.693 0.406 16 0 "[ . 1 . 2]" 1 64 GLN 4.703 0.618 19 1 "[ . 1 . +2]" 1 65 ARG 2.627 0.242 4 0 "[ . 1 . 2]" 1 66 GLN 0.063 0.032 9 0 "[ . 1 . 2]" 1 67 TYR 5.878 0.754 3 3 "[ + . 1 .* - 2]" 1 68 LYS 2.387 0.493 3 0 "[ . 1 . 2]" 1 69 VAL 3.376 0.493 3 0 "[ . 1 . 2]" 1 70 HIS 2.445 0.100 5 0 "[ . 1 . 2]" 1 71 LEU 0.086 0.015 17 0 "[ . 1 . 2]" 1 72 ASP 0.135 0.023 7 0 "[ . 1 . 2]" 1 73 LEU 0.098 0.016 5 0 "[ . 1 . 2]" 1 74 TRP 2.411 0.091 2 0 "[ . 1 . 2]" 1 75 VAL 1.212 0.101 9 0 "[ . 1 . 2]" 1 76 LYS 0.092 0.019 15 0 "[ . 1 . 2]" 1 77 SER 0.216 0.093 19 0 "[ . 1 . 2]" 1 78 LEU 0.863 0.090 19 0 "[ . 1 . 2]" 1 79 SER 1.111 0.406 14 0 "[ . 1 . 2]" 1 80 PRO 1.351 0.182 9 0 "[ . 1 . 2]" 1 81 GLN 7.153 0.862 15 5 "[ - *. * 1 *+ 2]" 1 82 ASP 0.456 0.070 15 0 "[ . 1 . 2]" 1 83 ARG 7.202 0.862 15 5 "[ - *. * 1 *+ 2]" 1 84 ALA 3.598 0.445 15 0 "[ . 1 . 2]" 1 85 ALA 2.223 0.190 6 0 "[ . 1 . 2]" 1 86 TYR 1.854 0.491 6 0 "[ . 1 . 2]" 1 87 LYS 1.665 0.491 6 0 "[ . 1 . 2]" 1 88 GLU 5.934 0.285 2 0 "[ . 1 . 2]" 1 89 TYR 2.618 0.776 20 2 "[ . 1 . - +]" 1 90 ILE 6.878 0.453 9 0 "[ . 1 . 2]" 1 91 SER 0.471 0.060 6 0 "[ . 1 . 2]" 1 92 ASN 0.245 0.085 6 0 "[ . 1 . 2]" 1 93 LYS 4.486 0.776 20 5 "[ - . * 1 . ** +]" 1 94 ARG 13.233 0.981 8 7 "[* * +** .- *2]" 1 95 LYS 1.076 0.332 10 0 "[ . 1 . 2]" 1 96 SER 0.518 0.092 2 0 "[ . 1 . 2]" 1 97 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 98 PRO 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 4 GLY QA 1 5 SER HA . . 5.060 3.973 3.900 4.305 . 0 0 "[ . 1 . 2]" 1 2 1 4 GLY QA 1 6 SER H . . 5.500 4.585 3.916 5.438 . 0 0 "[ . 1 . 2]" 1 3 1 6 SER H 1 7 GLY H . . 5.040 4.108 2.499 4.643 . 0 0 "[ . 1 . 2]" 1 4 1 6 SER HB3 1 7 GLY H . . 4.950 3.415 2.250 4.318 . 0 0 "[ . 1 . 2]" 1 5 1 7 GLY H 1 8 PRO HD2 . . 5.090 3.120 2.128 4.909 . 0 0 "[ . 1 . 2]" 1 6 1 7 GLY H 1 8 PRO HD3 . . 4.470 3.538 2.851 4.439 . 0 0 "[ . 1 . 2]" 1 7 1 7 GLY H 1 74 TRP HE1 . . 5.500 4.977 4.349 5.462 . 0 0 "[ . 1 . 2]" 1 8 1 7 GLY QA 1 74 TRP HD1 . . 5.190 3.441 2.540 3.985 . 0 0 "[ . 1 . 2]" 1 9 1 7 GLY QA 1 74 TRP HE1 . . 5.340 4.895 3.976 5.348 0.008 19 0 "[ . 1 . 2]" 1 10 1 8 PRO HA 1 9 LYS H . . 2.880 2.265 2.155 2.636 . 0 0 "[ . 1 . 2]" 1 11 1 8 PRO HA 1 9 LYS QB . . 4.280 4.007 3.867 4.158 . 0 0 "[ . 1 . 2]" 1 12 1 8 PRO HA 1 9 LYS QG . . 4.950 4.624 4.225 4.969 0.019 3 0 "[ . 1 . 2]" 1 13 1 8 PRO HB2 1 9 LYS H . . 4.040 3.234 2.249 3.685 . 0 0 "[ . 1 . 2]" 1 14 1 8 PRO HB2 1 67 TYR HA . . 4.950 3.912 3.663 4.177 . 0 0 "[ . 1 . 2]" 1 15 1 8 PRO HB2 1 67 TYR QD . . 3.670 2.635 1.976 3.192 . 0 0 "[ . 1 . 2]" 1 16 1 8 PRO HB2 1 67 TYR QE . . 3.620 2.866 2.703 3.031 . 0 0 "[ . 1 . 2]" 1 17 1 8 PRO HB2 1 70 HIS HB2 . . 4.410 3.973 3.343 4.156 . 0 0 "[ . 1 . 2]" 1 18 1 8 PRO HB2 1 70 HIS HB3 . . 4.320 4.297 3.882 4.361 0.041 20 0 "[ . 1 . 2]" 1 19 1 8 PRO HB2 1 71 LEU QD . . 4.690 3.337 2.910 3.726 . 0 0 "[ . 1 . 2]" 1 20 1 8 PRO HB3 1 9 LYS H . . 3.980 3.704 3.197 3.993 0.013 3 0 "[ . 1 . 2]" 1 21 1 8 PRO HB3 1 67 TYR QD . . 4.230 3.587 2.446 4.253 0.023 16 0 "[ . 1 . 2]" 1 22 1 8 PRO HB3 1 67 TYR QE . . 4.420 4.412 4.027 4.484 0.064 16 0 "[ . 1 . 2]" 1 23 1 8 PRO HB3 1 70 HIS HB2 . . 4.410 2.666 2.295 3.666 . 0 0 "[ . 1 . 2]" 1 24 1 8 PRO HB3 1 70 HIS HB3 . . 4.180 2.671 2.516 3.456 . 0 0 "[ . 1 . 2]" 1 25 1 8 PRO HD2 1 71 LEU HA . . 5.350 4.747 4.133 5.159 . 0 0 "[ . 1 . 2]" 1 26 1 8 PRO HD2 1 71 LEU QD . . 4.040 3.415 2.642 3.731 . 0 0 "[ . 1 . 2]" 1 27 1 8 PRO HD2 1 74 TRP HB2 . . 4.560 4.285 3.274 4.524 . 0 0 "[ . 1 . 2]" 1 28 1 8 PRO HD2 1 74 TRP HB3 . . 5.060 4.698 3.817 4.998 . 0 0 "[ . 1 . 2]" 1 29 1 8 PRO HD3 1 71 LEU QD . . 5.500 3.558 3.237 4.031 . 0 0 "[ . 1 . 2]" 1 30 1 8 PRO HD3 1 74 TRP HB2 . . 5.060 2.914 2.655 3.441 . 0 0 "[ . 1 . 2]" 1 31 1 8 PRO HD3 1 74 TRP HB3 . . 5.190 3.603 3.170 4.081 . 0 0 "[ . 1 . 2]" 1 32 1 8 PRO HD3 1 74 TRP HD1 . . 5.030 4.092 3.383 4.768 . 0 0 "[ . 1 . 2]" 1 33 1 8 PRO HG2 1 67 TYR QE . . 4.150 3.744 3.063 4.160 0.010 17 0 "[ . 1 . 2]" 1 34 1 8 PRO HG2 1 70 HIS HB2 . . 5.190 4.875 4.076 5.177 . 0 0 "[ . 1 . 2]" 1 35 1 8 PRO HG2 1 70 HIS HB3 . . 5.350 4.819 4.038 5.361 0.011 16 0 "[ . 1 . 2]" 1 36 1 8 PRO HG2 1 71 LEU QD . . 3.990 2.073 1.778 2.481 . 0 0 "[ . 1 . 2]" 1 37 1 8 PRO HG3 1 67 TYR QE . . 5.350 4.776 4.077 5.108 . 0 0 "[ . 1 . 2]" 1 38 1 8 PRO HG3 1 70 HIS HB2 . . 4.950 3.653 2.763 4.449 . 0 0 "[ . 1 . 2]" 1 39 1 8 PRO HG3 1 70 HIS HB3 . . 4.690 3.375 2.676 4.527 . 0 0 "[ . 1 . 2]" 1 40 1 8 PRO HG3 1 71 LEU HA . . 4.250 2.627 2.147 3.353 . 0 0 "[ . 1 . 2]" 1 41 1 8 PRO HG3 1 74 TRP HB2 . . 5.190 3.981 3.119 4.602 . 0 0 "[ . 1 . 2]" 1 42 1 8 PRO HG3 1 74 TRP HB3 . . 5.190 3.757 2.987 4.296 . 0 0 "[ . 1 . 2]" 1 43 1 9 LYS H 1 9 LYS QB . . 3.070 2.495 2.045 3.088 0.018 20 0 "[ . 1 . 2]" 1 44 1 9 LYS H 1 9 LYS QD . . 4.770 3.768 1.815 4.750 . 0 0 "[ . 1 . 2]" 1 45 1 9 LYS H 1 9 LYS QG . . 3.830 3.175 2.402 3.826 . 0 0 "[ . 1 . 2]" 1 46 1 9 LYS H 1 67 TYR QD . . 5.190 3.491 2.922 4.417 . 0 0 "[ . 1 . 2]" 1 47 1 9 LYS H 1 67 TYR QE . . 5.500 4.434 4.056 4.910 . 0 0 "[ . 1 . 2]" 1 48 1 9 LYS HA 1 9 LYS QD . . 3.770 3.708 3.565 3.770 0.000 9 0 "[ . 1 . 2]" 1 49 1 9 LYS HA 1 9 LYS QG . . 3.670 2.681 1.968 3.390 . 0 0 "[ . 1 . 2]" 1 50 1 9 LYS HA 1 10 LYS H . . 2.880 2.354 2.177 3.008 0.128 20 0 "[ . 1 . 2]" 1 51 1 9 LYS HA 1 10 LYS HB2 . . 5.060 4.303 3.974 4.943 . 0 0 "[ . 1 . 2]" 1 52 1 9 LYS HA 1 10 LYS HB3 . . 4.850 5.081 4.746 5.554 0.704 16 1 "[ . 1 .+ 2]" 1 53 1 9 LYS HA 1 67 TYR QE . . 5.030 4.306 3.583 5.084 0.054 20 0 "[ . 1 . 2]" 1 54 1 9 LYS QB 1 10 LYS H . . 3.720 3.117 2.173 4.106 0.386 20 0 "[ . 1 . 2]" 1 55 1 9 LYS QD 1 9 LYS QG . . 2.440 2.093 2.048 2.134 . 0 0 "[ . 1 . 2]" 1 56 1 9 LYS QE 1 9 LYS QG . . 3.010 2.098 1.950 2.328 . 0 0 "[ . 1 . 2]" 1 57 1 9 LYS QG 1 10 LYS H . . 3.550 3.446 2.949 3.611 0.061 6 0 "[ . 1 . 2]" 1 58 1 10 LYS H 1 10 LYS HB2 . . 3.800 2.268 2.041 3.021 . 0 0 "[ . 1 . 2]" 1 59 1 10 LYS H 1 10 LYS HB3 . . 3.250 2.942 2.419 3.879 0.629 16 2 "[ . 1 .+ -]" 1 60 1 10 LYS H 1 10 LYS QD . . 4.410 3.933 3.067 4.426 0.016 7 0 "[ . 1 . 2]" 1 61 1 10 LYS H 1 10 LYS QE . . 5.040 4.638 3.557 5.057 0.017 3 0 "[ . 1 . 2]" 1 62 1 10 LYS H 1 10 LYS HG3 . . 4.230 4.246 3.878 4.420 0.190 3 0 "[ . 1 . 2]" 1 63 1 10 LYS H 1 67 TYR QE . . 4.800 4.069 2.676 4.993 0.193 16 0 "[ . 1 . 2]" 1 64 1 10 LYS HA 1 10 LYS QD . . 4.690 3.064 2.454 3.613 . 0 0 "[ . 1 . 2]" 1 65 1 10 LYS HA 1 10 LYS HG2 . . 4.250 3.323 2.273 3.761 . 0 0 "[ . 1 . 2]" 1 66 1 10 LYS HA 1 67 TYR QE . . 3.990 2.992 2.479 3.838 . 0 0 "[ . 1 . 2]" 1 67 1 10 LYS HB2 1 10 LYS QE . . 4.320 3.196 1.908 4.221 . 0 0 "[ . 1 . 2]" 1 68 1 10 LYS HB3 1 10 LYS QE . . 4.180 3.853 2.820 4.289 0.109 12 0 "[ . 1 . 2]" 1 69 1 10 LYS QD 1 67 TYR QE . . 4.850 4.097 2.311 4.868 0.018 17 0 "[ . 1 . 2]" 1 70 1 10 LYS QE 1 10 LYS HG3 . . 3.380 2.569 1.976 3.384 0.004 10 0 "[ . 1 . 2]" 1 71 1 10 LYS QE 1 67 TYR QE . . 4.270 3.899 2.766 4.291 0.021 4 0 "[ . 1 . 2]" 1 72 1 10 LYS HG3 1 67 TYR QE . . 4.550 4.559 4.176 5.304 0.754 3 3 "[ + . 1 .* - 2]" 1 73 1 11 PRO HA 1 12 PRO HD2 . . 3.450 2.932 2.834 2.957 . 0 0 "[ . 1 . 2]" 1 74 1 11 PRO HA 1 12 PRO HD3 . . 3.320 2.166 2.094 2.185 . 0 0 "[ . 1 . 2]" 1 75 1 11 PRO HB2 1 12 PRO HD3 . . 3.300 3.131 3.080 3.328 0.028 5 0 "[ . 1 . 2]" 1 76 1 11 PRO HB2 1 63 GLN HE21 . . 5.420 3.931 3.266 4.992 . 0 0 "[ . 1 . 2]" 1 77 1 11 PRO HB2 1 63 GLN HE22 . . 5.500 4.526 4.033 5.068 . 0 0 "[ . 1 . 2]" 1 78 1 11 PRO HB2 1 64 GLN HA . . 4.410 3.558 2.914 4.020 . 0 0 "[ . 1 . 2]" 1 79 1 11 PRO HB2 1 64 GLN HG2 . . 4.450 2.912 2.064 3.193 . 0 0 "[ . 1 . 2]" 1 80 1 11 PRO HB2 1 64 GLN HG3 . . 4.450 2.727 2.211 3.079 . 0 0 "[ . 1 . 2]" 1 81 1 11 PRO HB2 1 67 TYR QB . . 4.450 4.312 4.095 4.648 0.198 16 0 "[ . 1 . 2]" 1 82 1 11 PRO HB3 1 12 PRO HD2 . . 3.480 2.772 2.751 2.859 . 0 0 "[ . 1 . 2]" 1 83 1 11 PRO HB3 1 12 PRO HD3 . . 3.890 3.161 3.127 3.297 . 0 0 "[ . 1 . 2]" 1 84 1 11 PRO HB3 1 63 GLN HG2 . . 4.950 4.227 1.980 4.870 . 0 0 "[ . 1 . 2]" 1 85 1 11 PRO HB3 1 63 GLN HG3 . . 5.190 3.598 2.215 4.580 . 0 0 "[ . 1 . 2]" 1 86 1 11 PRO HB3 1 64 GLN HA . . 4.410 3.931 3.225 4.395 . 0 0 "[ . 1 . 2]" 1 87 1 11 PRO HB3 1 64 GLN HG2 . . 4.360 4.263 3.332 4.454 0.094 11 0 "[ . 1 . 2]" 1 88 1 11 PRO HB3 1 64 GLN HG3 . . 4.090 4.162 3.379 4.459 0.369 18 0 "[ . 1 . 2]" 1 89 1 11 PRO HD2 1 67 TYR QD . . 4.150 3.541 2.581 3.893 . 0 0 "[ . 1 . 2]" 1 90 1 11 PRO HD3 1 67 TYR QD . . 5.190 2.252 1.991 3.107 . 0 0 "[ . 1 . 2]" 1 91 1 11 PRO HG2 1 12 PRO HD2 . . 5.350 4.334 4.278 4.551 . 0 0 "[ . 1 . 2]" 1 92 1 11 PRO HG2 1 64 GLN HA . . 4.360 2.501 1.992 3.234 . 0 0 "[ . 1 . 2]" 1 93 1 11 PRO HG2 1 64 GLN HG2 . . 4.120 2.071 1.987 2.205 . 0 0 "[ . 1 . 2]" 1 94 1 11 PRO HG2 1 64 GLN HG3 . . 4.850 3.153 2.720 3.513 . 0 0 "[ . 1 . 2]" 1 95 1 11 PRO HG2 1 67 TYR QB . . 4.620 3.229 2.897 3.689 . 0 0 "[ . 1 . 2]" 1 96 1 11 PRO HG2 1 67 TYR QD . . 3.940 3.858 3.444 4.036 0.096 20 0 "[ . 1 . 2]" 1 97 1 11 PRO HG3 1 12 PRO HD2 . . 5.470 4.667 4.624 4.837 . 0 0 "[ . 1 . 2]" 1 98 1 11 PRO HG3 1 64 GLN HA . . 3.800 2.603 2.022 2.864 . 0 0 "[ . 1 . 2]" 1 99 1 11 PRO HG3 1 64 GLN HG2 . . 4.450 3.561 3.035 3.781 . 0 0 "[ . 1 . 2]" 1 100 1 11 PRO HG3 1 64 GLN HG3 . . 4.510 4.205 3.845 4.516 0.006 5 0 "[ . 1 . 2]" 1 101 1 11 PRO HG3 1 67 TYR H . . 5.040 3.908 3.404 4.464 . 0 0 "[ . 1 . 2]" 1 102 1 11 PRO HG3 1 67 TYR QB . . 4.150 2.065 1.871 2.370 . 0 0 "[ . 1 . 2]" 1 103 1 11 PRO HG3 1 67 TYR QD . . 3.620 2.902 2.322 3.507 . 0 0 "[ . 1 . 2]" 1 104 1 12 PRO HA 1 13 MET H . . 3.160 2.619 2.287 2.783 . 0 0 "[ . 1 . 2]" 1 105 1 12 PRO HA 1 13 MET QB . . 4.850 4.155 3.919 4.432 . 0 0 "[ . 1 . 2]" 1 106 1 12 PRO HA 1 13 MET HG2 . . 5.060 4.107 2.988 4.942 . 0 0 "[ . 1 . 2]" 1 107 1 12 PRO HA 1 13 MET HG3 . . 4.690 4.458 4.041 4.880 0.190 20 0 "[ . 1 . 2]" 1 108 1 12 PRO HA 1 17 GLN HB3 . . 4.620 3.575 3.064 4.067 . 0 0 "[ . 1 . 2]" 1 109 1 12 PRO HA 1 17 GLN HE21 . . 5.060 3.338 2.265 3.801 . 0 0 "[ . 1 . 2]" 1 110 1 12 PRO HA 1 60 ALA MB . . 5.060 4.712 4.100 5.102 0.042 18 0 "[ . 1 . 2]" 1 111 1 12 PRO HB2 1 13 MET H . . 4.620 2.299 1.947 3.116 . 0 0 "[ . 1 . 2]" 1 112 1 12 PRO HB2 1 18 LYS H . . 4.050 3.306 2.766 3.729 . 0 0 "[ . 1 . 2]" 1 113 1 12 PRO HB2 1 60 ALA MB . . 3.680 2.907 2.451 3.349 . 0 0 "[ . 1 . 2]" 1 114 1 12 PRO HB3 1 13 MET H . . 4.320 3.228 3.101 3.619 . 0 0 "[ . 1 . 2]" 1 115 1 12 PRO HB3 1 17 GLN HE21 . . 4.770 4.000 3.265 4.599 . 0 0 "[ . 1 . 2]" 1 116 1 12 PRO HB3 1 18 LYS H . . 4.510 3.709 2.884 4.110 . 0 0 "[ . 1 . 2]" 1 117 1 12 PRO HB3 1 18 LYS HA . . 3.990 2.790 2.246 3.338 . 0 0 "[ . 1 . 2]" 1 118 1 12 PRO HB3 1 60 ALA MB . . 5.060 4.321 3.913 4.667 . 0 0 "[ . 1 . 2]" 1 119 1 12 PRO HD2 1 60 ALA MB . . 4.850 3.975 3.543 4.292 . 0 0 "[ . 1 . 2]" 1 120 1 12 PRO HD2 1 63 GLN HB2 . . 4.770 2.889 2.467 4.155 . 0 0 "[ . 1 . 2]" 1 121 1 12 PRO HD2 1 63 GLN HB3 . . 4.040 2.359 2.021 3.292 . 0 0 "[ . 1 . 2]" 1 122 1 12 PRO HD2 1 63 GLN HE21 . . 5.500 3.395 2.624 4.423 . 0 0 "[ . 1 . 2]" 1 123 1 12 PRO HD2 1 63 GLN HE22 . . 5.500 4.483 3.612 5.200 . 0 0 "[ . 1 . 2]" 1 124 1 12 PRO HD2 1 64 GLN HG3 . . 4.950 3.749 3.066 4.119 . 0 0 "[ . 1 . 2]" 1 125 1 12 PRO HD3 1 63 GLN HB2 . . 4.850 4.205 3.802 4.770 . 0 0 "[ . 1 . 2]" 1 126 1 12 PRO HD3 1 63 GLN HB3 . . 4.250 3.579 3.248 4.359 0.109 19 0 "[ . 1 . 2]" 1 127 1 12 PRO HD3 1 63 GLN HE21 . . 5.190 2.867 1.971 4.483 . 0 0 "[ . 1 . 2]" 1 128 1 12 PRO HD3 1 63 GLN HE22 . . 5.190 3.910 2.787 4.996 . 0 0 "[ . 1 . 2]" 1 129 1 12 PRO HD3 1 63 GLN HG3 . . 4.950 3.391 2.612 4.872 . 0 0 "[ . 1 . 2]" 1 130 1 12 PRO QG 1 18 LYS H . . 5.060 4.102 3.645 4.541 . 0 0 "[ . 1 . 2]" 1 131 1 12 PRO QG 1 18 LYS HA . . 3.990 2.498 1.991 3.027 . 0 0 "[ . 1 . 2]" 1 132 1 12 PRO QG 1 18 LYS HB2 . . 3.950 2.379 1.973 3.009 . 0 0 "[ . 1 . 2]" 1 133 1 12 PRO QG 1 18 LYS HG2 . . 4.620 4.012 3.366 4.421 . 0 0 "[ . 1 . 2]" 1 134 1 12 PRO QG 1 60 ALA H . . 4.870 4.253 3.617 4.745 . 0 0 "[ . 1 . 2]" 1 135 1 12 PRO QG 1 60 ALA HA . . 4.210 2.475 1.988 3.015 . 0 0 "[ . 1 . 2]" 1 136 1 12 PRO QG 1 60 ALA MB . . 4.180 2.696 1.967 2.857 . 0 0 "[ . 1 . 2]" 1 137 1 12 PRO QG 1 63 GLN HE21 . . 5.210 4.193 3.291 5.616 0.406 16 0 "[ . 1 . 2]" 1 138 1 13 MET H 1 13 MET QB . . 3.700 2.674 2.242 3.278 . 0 0 "[ . 1 . 2]" 1 139 1 13 MET H 1 13 MET HG2 . . 4.210 3.420 2.418 4.200 . 0 0 "[ . 1 . 2]" 1 140 1 13 MET H 1 13 MET HG3 . . 4.040 3.588 2.340 4.213 0.173 15 0 "[ . 1 . 2]" 1 141 1 13 MET H 1 17 GLN HB2 . . 4.320 2.439 1.938 2.869 . 0 0 "[ . 1 . 2]" 1 142 1 13 MET H 1 17 GLN HB3 . . 3.380 3.488 3.239 4.325 0.945 1 2 "[+ . 1 - . 2]" 1 143 1 13 MET H 1 17 GLN HE21 . . 4.000 1.958 1.841 2.200 . 0 0 "[ . 1 . 2]" 1 144 1 13 MET H 1 17 GLN HE22 . . 5.500 3.174 2.507 3.741 . 0 0 "[ . 1 . 2]" 1 145 1 13 MET H 1 17 GLN HG2 . . 5.210 5.067 4.693 5.219 0.009 10 0 "[ . 1 . 2]" 1 146 1 13 MET H 1 17 GLN HG3 . . 5.340 4.197 3.645 4.538 . 0 0 "[ . 1 . 2]" 1 147 1 13 MET HA 1 13 MET ME . . 4.320 4.110 3.149 4.317 . 0 0 "[ . 1 . 2]" 1 148 1 13 MET HA 1 13 MET HG3 . . 4.250 3.537 3.187 3.777 . 0 0 "[ . 1 . 2]" 1 149 1 13 MET HA 1 17 GLN HE21 . . 4.410 4.323 4.046 4.530 0.120 3 0 "[ . 1 . 2]" 1 150 1 13 MET HA 1 64 GLN HE21 . . 3.970 3.307 2.352 4.588 0.618 19 1 "[ . 1 . +2]" 1 151 1 13 MET HA 1 64 GLN HE22 . . 4.620 2.644 1.951 3.528 . 0 0 "[ . 1 . 2]" 1 152 1 13 MET HA 1 64 GLN HG2 . . 5.190 4.669 4.249 5.060 . 0 0 "[ . 1 . 2]" 1 153 1 13 MET QB 1 14 ASN HD22 . . 5.270 3.824 2.404 5.022 . 0 0 "[ . 1 . 2]" 1 154 1 13 MET QB 1 17 GLN HE21 . . 4.640 2.626 2.001 4.163 . 0 0 "[ . 1 . 2]" 1 155 1 13 MET QB 1 17 GLN HE22 . . 5.060 2.610 1.940 3.988 . 0 0 "[ . 1 . 2]" 1 156 1 13 MET ME 1 13 MET HG2 . . 3.870 3.212 2.225 3.388 . 0 0 "[ . 1 . 2]" 1 157 1 13 MET ME 1 14 ASN HD21 . . 5.060 4.290 2.352 5.029 . 0 0 "[ . 1 . 2]" 1 158 1 13 MET ME 1 14 ASN HD22 . . 4.950 3.898 2.558 4.954 0.004 4 0 "[ . 1 . 2]" 1 159 1 13 MET HG2 1 17 GLN HE21 . . 5.350 3.916 2.245 4.871 . 0 0 "[ . 1 . 2]" 1 160 1 13 MET HG3 1 17 GLN HE21 . . 4.790 3.484 1.985 4.277 . 0 0 "[ . 1 . 2]" 1 161 1 13 MET HG3 1 17 GLN HE22 . . 5.500 2.903 1.938 3.891 . 0 0 "[ . 1 . 2]" 1 162 1 14 ASN HA 1 14 ASN HD22 . . 5.500 4.612 4.281 5.163 . 0 0 "[ . 1 . 2]" 1 163 1 14 ASN HA 1 16 TYR H . . 5.500 4.584 3.888 5.072 . 0 0 "[ . 1 . 2]" 1 164 1 14 ASN HA 1 60 ALA MB . . 4.250 3.880 3.385 4.289 0.039 4 0 "[ . 1 . 2]" 1 165 1 14 ASN HB2 1 15 GLY H . . 4.540 2.899 1.963 4.351 . 0 0 "[ . 1 . 2]" 1 166 1 14 ASN HB2 1 16 TYR H . . 4.700 2.976 2.301 4.264 . 0 0 "[ . 1 . 2]" 1 167 1 14 ASN HB3 1 15 GLY H . . 4.620 2.832 1.993 3.848 . 0 0 "[ . 1 . 2]" 1 168 1 14 ASN HB3 1 16 TYR H . . 5.150 3.027 2.448 4.398 . 0 0 "[ . 1 . 2]" 1 169 1 14 ASN HD21 1 16 TYR QD . . 5.500 4.720 3.772 5.356 . 0 0 "[ . 1 . 2]" 1 170 1 14 ASN HD21 1 17 GLN H . . 5.500 4.329 3.398 5.219 . 0 0 "[ . 1 . 2]" 1 171 1 14 ASN HD21 1 17 GLN HG3 . . 5.210 3.500 2.428 4.678 . 0 0 "[ . 1 . 2]" 1 172 1 15 GLY H 1 16 TYR H . . 4.200 2.480 1.892 3.015 . 0 0 "[ . 1 . 2]" 1 173 1 15 GLY H 1 57 LYS HA . . 4.510 3.364 1.968 4.511 0.001 1 0 "[ . 1 . 2]" 1 174 1 15 GLY H 1 60 ALA MB . . 5.350 3.850 3.281 4.340 . 0 0 "[ . 1 . 2]" 1 175 1 15 GLY QA 1 17 GLN H . . 5.270 4.389 3.790 4.788 . 0 0 "[ . 1 . 2]" 1 176 1 15 GLY QA 1 18 LYS H . . 4.730 3.392 3.149 3.657 . 0 0 "[ . 1 . 2]" 1 177 1 15 GLY QA 1 18 LYS HB2 . . 4.620 3.400 3.035 3.741 . 0 0 "[ . 1 . 2]" 1 178 1 15 GLY QA 1 18 LYS HB3 . . 4.620 2.614 2.401 2.923 . 0 0 "[ . 1 . 2]" 1 179 1 15 GLY QA 1 45 TRP HH2 . . 3.870 2.457 1.984 2.992 . 0 0 "[ . 1 . 2]" 1 180 1 15 GLY QA 1 45 TRP HZ2 . . 4.620 3.946 3.539 4.283 . 0 0 "[ . 1 . 2]" 1 181 1 15 GLY QA 1 45 TRP HZ3 . . 5.030 3.933 3.484 4.470 . 0 0 "[ . 1 . 2]" 1 182 1 15 GLY QA 1 56 TYR H . . 4.950 4.690 4.254 4.991 0.041 4 0 "[ . 1 . 2]" 1 183 1 15 GLY QA 1 56 TYR HB2 . . 4.250 3.126 2.587 3.550 . 0 0 "[ . 1 . 2]" 1 184 1 15 GLY QA 1 56 TYR HB3 . . 4.320 2.549 2.101 2.978 . 0 0 "[ . 1 . 2]" 1 185 1 15 GLY QA 1 56 TYR QD . . 5.030 4.289 3.881 4.660 . 0 0 "[ . 1 . 2]" 1 186 1 15 GLY QA 1 57 LYS H . . 3.960 2.867 2.186 3.563 . 0 0 "[ . 1 . 2]" 1 187 1 15 GLY QA 1 57 LYS HB3 . . 4.770 3.661 2.241 4.324 . 0 0 "[ . 1 . 2]" 1 188 1 15 GLY QA 1 57 LYS QD . . 4.620 3.874 3.064 4.598 . 0 0 "[ . 1 . 2]" 1 189 1 15 GLY QA 1 57 LYS HG2 . . 4.950 4.659 4.240 4.915 . 0 0 "[ . 1 . 2]" 1 190 1 15 GLY QA 1 57 LYS HG3 . . 5.060 3.769 3.459 4.531 . 0 0 "[ . 1 . 2]" 1 191 1 15 GLY QA 1 60 ALA H . . 4.870 3.886 3.557 4.192 . 0 0 "[ . 1 . 2]" 1 192 1 15 GLY QA 1 60 ALA MB . . 4.040 2.807 2.282 3.377 . 0 0 "[ . 1 . 2]" 1 193 1 16 TYR H 1 16 TYR HB2 . . 3.600 2.427 2.316 2.549 . 0 0 "[ . 1 . 2]" 1 194 1 16 TYR H 1 16 TYR HB3 . . 3.560 2.224 2.113 2.340 . 0 0 "[ . 1 . 2]" 1 195 1 16 TYR H 1 16 TYR QD . . 4.870 4.057 4.033 4.072 . 0 0 "[ . 1 . 2]" 1 196 1 16 TYR H 1 17 GLN H . . 3.790 2.816 2.605 3.110 . 0 0 "[ . 1 . 2]" 1 197 1 16 TYR H 1 17 GLN HG3 . . 5.500 4.655 3.912 5.432 . 0 0 "[ . 1 . 2]" 1 198 1 16 TYR H 1 18 LYS H . . 4.910 3.887 3.672 4.037 . 0 0 "[ . 1 . 2]" 1 199 1 16 TYR H 1 45 TRP HE1 . . 5.500 5.168 4.906 5.426 . 0 0 "[ . 1 . 2]" 1 200 1 16 TYR H 1 45 TRP HH2 . . 4.990 3.478 2.965 3.960 . 0 0 "[ . 1 . 2]" 1 201 1 16 TYR H 1 45 TRP HZ2 . . 4.510 3.485 3.135 3.780 . 0 0 "[ . 1 . 2]" 1 202 1 16 TYR HA 1 16 TYR QD . . 3.730 2.314 2.126 2.481 . 0 0 "[ . 1 . 2]" 1 203 1 16 TYR HA 1 19 PHE H . . 5.190 3.537 3.338 3.665 . 0 0 "[ . 1 . 2]" 1 204 1 16 TYR HA 1 19 PHE HB2 . . 4.450 4.220 3.931 4.498 0.048 19 0 "[ . 1 . 2]" 1 205 1 16 TYR HA 1 19 PHE HB3 . . 4.120 2.863 2.538 3.098 . 0 0 "[ . 1 . 2]" 1 206 1 16 TYR HA 1 19 PHE QD . . 5.030 3.597 3.053 4.026 . 0 0 "[ . 1 . 2]" 1 207 1 16 TYR HA 1 20 SER H . . 5.500 3.928 3.623 4.311 . 0 0 "[ . 1 . 2]" 1 208 1 16 TYR HA 1 45 TRP HH2 . . 4.900 3.371 3.148 3.616 . 0 0 "[ . 1 . 2]" 1 209 1 16 TYR HA 1 45 TRP HZ2 . . 4.900 3.797 3.524 4.095 . 0 0 "[ . 1 . 2]" 1 210 1 16 TYR HA 1 45 TRP HZ3 . . 5.350 2.992 2.844 3.277 . 0 0 "[ . 1 . 2]" 1 211 1 16 TYR HB2 1 17 GLN H . . 4.690 3.731 3.514 4.068 . 0 0 "[ . 1 . 2]" 1 212 1 16 TYR HB2 1 45 TRP HE1 . . 4.560 3.291 3.072 3.372 . 0 0 "[ . 1 . 2]" 1 213 1 16 TYR HB2 1 45 TRP HH2 . . 5.380 4.260 4.012 4.515 . 0 0 "[ . 1 . 2]" 1 214 1 16 TYR HB2 1 45 TRP HZ2 . . 4.550 3.112 2.943 3.297 . 0 0 "[ . 1 . 2]" 1 215 1 16 TYR HB3 1 17 GLN H . . 3.900 2.253 1.937 2.762 . 0 0 "[ . 1 . 2]" 1 216 1 16 TYR HB3 1 45 TRP HE1 . . 4.990 4.962 4.719 5.008 0.018 17 0 "[ . 1 . 2]" 1 217 1 16 TYR HB3 1 45 TRP HZ2 . . 4.900 4.551 4.354 4.739 . 0 0 "[ . 1 . 2]" 1 218 1 16 TYR QD 1 17 GLN H . . 4.620 3.433 3.054 3.902 . 0 0 "[ . 1 . 2]" 1 219 1 16 TYR QD 1 17 GLN HA . . 4.700 4.026 3.823 4.174 . 0 0 "[ . 1 . 2]" 1 220 1 16 TYR QD 1 17 GLN HG2 . . 5.060 3.658 3.348 3.965 . 0 0 "[ . 1 . 2]" 1 221 1 16 TYR QD 1 17 GLN HG3 . . 4.700 3.244 2.949 3.458 . 0 0 "[ . 1 . 2]" 1 222 1 16 TYR QD 1 41 ILE MG . . 4.900 3.882 3.739 4.038 . 0 0 "[ . 1 . 2]" 1 223 1 16 TYR QD 1 42 GLY HA2 . . 5.190 4.358 4.211 4.535 . 0 0 "[ . 1 . 2]" 1 224 1 16 TYR QD 1 45 TRP HA . . 4.850 4.474 4.240 4.654 . 0 0 "[ . 1 . 2]" 1 225 1 16 TYR QD 1 45 TRP HB2 . . 4.270 2.561 2.257 2.747 . 0 0 "[ . 1 . 2]" 1 226 1 16 TYR QD 1 45 TRP HB3 . . 4.370 3.194 3.035 3.310 . 0 0 "[ . 1 . 2]" 1 227 1 16 TYR QD 1 45 TRP HD1 . . 4.550 3.670 3.542 3.793 . 0 0 "[ . 1 . 2]" 1 228 1 16 TYR QD 1 45 TRP HE1 . . 4.910 4.153 4.050 4.337 . 0 0 "[ . 1 . 2]" 1 229 1 16 TYR QD 1 45 TRP HE3 . . 3.320 3.116 2.848 3.304 . 0 0 "[ . 1 . 2]" 1 230 1 16 TYR QD 1 45 TRP HZ2 . . 4.730 4.645 4.556 4.807 0.077 18 0 "[ . 1 . 2]" 1 231 1 16 TYR QE 1 17 GLN HA . . 4.900 4.823 4.687 4.915 0.015 19 0 "[ . 1 . 2]" 1 232 1 16 TYR QE 1 17 GLN HG2 . . 4.550 4.523 4.344 4.573 0.023 17 0 "[ . 1 . 2]" 1 233 1 16 TYR QE 1 19 PHE QE . . 4.370 3.867 3.208 4.240 . 0 0 "[ . 1 . 2]" 1 234 1 16 TYR QE 1 20 SER QB . . 5.190 4.366 3.566 4.623 . 0 0 "[ . 1 . 2]" 1 235 1 16 TYR QE 1 41 ILE HB . . 4.900 4.129 3.870 4.409 . 0 0 "[ . 1 . 2]" 1 236 1 16 TYR QE 1 41 ILE MD . . 5.190 4.918 4.568 5.168 . 0 0 "[ . 1 . 2]" 1 237 1 16 TYR QE 1 41 ILE MG . . 3.390 2.441 2.143 2.672 . 0 0 "[ . 1 . 2]" 1 238 1 16 TYR QE 1 42 GLY H . . 4.700 3.747 3.518 3.991 . 0 0 "[ . 1 . 2]" 1 239 1 16 TYR QE 1 42 GLY HA2 . . 3.470 2.263 1.994 2.614 . 0 0 "[ . 1 . 2]" 1 240 1 16 TYR QE 1 43 SER H . . 5.500 5.304 5.161 5.446 . 0 0 "[ . 1 . 2]" 1 241 1 16 TYR QE 1 45 TRP H . . 4.550 3.894 3.467 4.046 . 0 0 "[ . 1 . 2]" 1 242 1 16 TYR QE 1 45 TRP HA . . 4.900 4.858 4.584 4.951 0.051 13 0 "[ . 1 . 2]" 1 243 1 16 TYR QE 1 45 TRP HB2 . . 3.730 2.624 2.392 2.734 . 0 0 "[ . 1 . 2]" 1 244 1 16 TYR QE 1 45 TRP HB3 . . 3.680 2.454 2.138 2.595 . 0 0 "[ . 1 . 2]" 1 245 1 16 TYR QE 1 45 TRP HD1 . . 4.420 4.024 3.951 4.109 . 0 0 "[ . 1 . 2]" 1 246 1 16 TYR QE 1 45 TRP HE1 . . 5.500 5.522 5.486 5.575 0.075 17 0 "[ . 1 . 2]" 1 247 1 16 TYR QE 1 46 GLN H . . 5.380 5.253 4.870 5.390 0.010 14 0 "[ . 1 . 2]" 1 248 1 17 GLN H 1 17 GLN HB2 . . 3.970 2.410 2.230 2.633 . 0 0 "[ . 1 . 2]" 1 249 1 17 GLN H 1 17 GLN HB3 . . 3.590 3.542 3.495 3.563 . 0 0 "[ . 1 . 2]" 1 250 1 17 GLN H 1 17 GLN HE21 . . 4.790 3.860 3.543 4.074 . 0 0 "[ . 1 . 2]" 1 251 1 17 GLN H 1 17 GLN HG2 . . 4.360 3.274 2.825 3.575 . 0 0 "[ . 1 . 2]" 1 252 1 17 GLN H 1 17 GLN HG3 . . 4.010 2.297 1.932 2.675 . 0 0 "[ . 1 . 2]" 1 253 1 17 GLN H 1 18 LYS H . . 4.010 2.736 2.498 2.924 . 0 0 "[ . 1 . 2]" 1 254 1 17 GLN H 1 19 PHE H . . 5.210 4.748 4.593 4.916 . 0 0 "[ . 1 . 2]" 1 255 1 17 GLN HA 1 17 GLN HG2 . . 3.700 2.324 2.176 2.547 . 0 0 "[ . 1 . 2]" 1 256 1 17 GLN HA 1 20 SER H . . 4.450 3.575 3.346 3.792 . 0 0 "[ . 1 . 2]" 1 257 1 17 GLN HA 1 20 SER QB . . 3.320 2.530 2.324 2.967 . 0 0 "[ . 1 . 2]" 1 258 1 17 GLN HA 1 21 GLN H . . 4.850 3.860 3.641 4.215 . 0 0 "[ . 1 . 2]" 1 259 1 17 GLN HB2 1 17 GLN HE21 . . 4.560 1.971 1.916 2.316 . 0 0 "[ . 1 . 2]" 1 260 1 17 GLN HB2 1 18 LYS H . . 4.360 3.032 2.912 3.121 . 0 0 "[ . 1 . 2]" 1 261 1 17 GLN HB3 1 17 GLN HE21 . . 4.320 2.674 2.331 3.410 . 0 0 "[ . 1 . 2]" 1 262 1 17 GLN HB3 1 17 GLN HE22 . . 5.090 3.666 3.468 4.098 . 0 0 "[ . 1 . 2]" 1 263 1 17 GLN HB3 1 18 LYS H . . 3.950 3.876 3.515 4.143 0.193 13 0 "[ . 1 . 2]" 1 264 1 17 GLN HB3 1 21 GLN H . . 5.500 4.810 4.546 5.140 . 0 0 "[ . 1 . 2]" 1 265 1 17 GLN HE21 1 18 LYS H . . 4.830 4.863 4.839 4.905 0.075 18 0 "[ . 1 . 2]" 1 266 1 17 GLN HG3 1 18 LYS H . . 5.190 4.593 4.225 4.819 . 0 0 "[ . 1 . 2]" 1 267 1 18 LYS H 1 18 LYS HB2 . . 3.790 2.698 2.561 2.923 . 0 0 "[ . 1 . 2]" 1 268 1 18 LYS H 1 18 LYS HB3 . . 3.850 2.284 2.125 2.391 . 0 0 "[ . 1 . 2]" 1 269 1 18 LYS H 1 18 LYS HG2 . . 4.790 4.499 4.418 4.584 . 0 0 "[ . 1 . 2]" 1 270 1 18 LYS H 1 19 PHE H . . 3.890 2.772 2.726 2.855 . 0 0 "[ . 1 . 2]" 1 271 1 18 LYS H 1 19 PHE HA . . 5.210 5.267 5.238 5.317 0.107 20 0 "[ . 1 . 2]" 1 272 1 18 LYS H 1 19 PHE HB3 . . 5.040 4.392 4.291 4.503 . 0 0 "[ . 1 . 2]" 1 273 1 18 LYS H 1 20 SER H . . 4.910 3.928 3.849 4.028 . 0 0 "[ . 1 . 2]" 1 274 1 18 LYS H 1 56 TYR QD . . 5.500 5.411 5.188 5.515 0.015 6 0 "[ . 1 . 2]" 1 275 1 18 LYS H 1 60 ALA MB . . 4.690 4.109 3.651 4.516 . 0 0 "[ . 1 . 2]" 1 276 1 18 LYS HA 1 18 LYS QE . . 4.690 4.075 3.639 4.492 . 0 0 "[ . 1 . 2]" 1 277 1 18 LYS HA 1 18 LYS HG2 . . 3.970 3.809 3.688 3.914 . 0 0 "[ . 1 . 2]" 1 278 1 18 LYS HA 1 19 PHE HA . . 4.950 4.789 4.723 4.828 . 0 0 "[ . 1 . 2]" 1 279 1 18 LYS HA 1 20 SER H . . 5.500 4.522 4.382 4.822 . 0 0 "[ . 1 . 2]" 1 280 1 18 LYS HA 1 21 GLN H . . 4.060 3.751 3.490 4.090 0.030 19 0 "[ . 1 . 2]" 1 281 1 18 LYS HB2 1 19 PHE H . . 4.320 3.864 3.795 3.956 . 0 0 "[ . 1 . 2]" 1 282 1 18 LYS HB2 1 60 ALA HA . . 4.250 3.748 3.122 4.196 . 0 0 "[ . 1 . 2]" 1 283 1 18 LYS HB2 1 60 ALA MB . . 3.660 2.631 1.965 3.214 . 0 0 "[ . 1 . 2]" 1 284 1 18 LYS HB3 1 19 PHE H . . 4.050 2.444 2.328 2.605 . 0 0 "[ . 1 . 2]" 1 285 1 18 LYS HB3 1 19 PHE HA . . 4.770 4.502 4.373 4.738 . 0 0 "[ . 1 . 2]" 1 286 1 18 LYS HB3 1 20 SER H . . 4.870 4.902 4.877 4.964 0.094 19 0 "[ . 1 . 2]" 1 287 1 18 LYS HB3 1 56 TYR QD . . 4.480 3.568 3.199 3.894 . 0 0 "[ . 1 . 2]" 1 288 1 18 LYS HB3 1 60 ALA H . . 5.500 4.435 3.725 4.919 . 0 0 "[ . 1 . 2]" 1 289 1 18 LYS HB3 1 60 ALA MB . . 4.150 3.429 2.805 3.962 . 0 0 "[ . 1 . 2]" 1 290 1 18 LYS HD2 1 56 TYR QD . . 4.480 4.517 3.460 5.224 0.744 11 8 "[ * .*** *+ .- * 2]" 1 291 1 18 LYS QE 1 56 TYR QD . . 4.770 3.388 2.933 3.752 . 0 0 "[ . 1 . 2]" 1 292 1 18 LYS QE 1 56 TYR QE . . 4.700 4.447 3.917 4.562 . 0 0 "[ . 1 . 2]" 1 293 1 18 LYS QE 1 59 LEU QD . . 4.690 2.812 2.355 3.654 . 0 0 "[ . 1 . 2]" 1 294 1 18 LYS QE 1 60 ALA H . . 5.420 4.231 3.387 4.724 . 0 0 "[ . 1 . 2]" 1 295 1 18 LYS QE 1 60 ALA HA . . 5.190 4.158 3.431 4.853 . 0 0 "[ . 1 . 2]" 1 296 1 18 LYS QE 1 60 ALA MB . . 5.190 4.511 4.026 4.906 . 0 0 "[ . 1 . 2]" 1 297 1 18 LYS HG2 1 19 PHE H . . 4.850 3.846 3.503 4.337 . 0 0 "[ . 1 . 2]" 1 298 1 18 LYS HG2 1 56 TYR QD . . 4.190 2.211 2.060 2.439 . 0 0 "[ . 1 . 2]" 1 299 1 18 LYS HG2 1 56 TYR QE . . 4.270 4.269 3.815 4.326 0.056 7 0 "[ . 1 . 2]" 1 300 1 18 LYS HG2 1 59 LEU QD . . 4.560 3.297 2.788 3.739 . 0 0 "[ . 1 . 2]" 1 301 1 18 LYS HG2 1 60 ALA H . . 5.040 3.869 3.290 4.354 . 0 0 "[ . 1 . 2]" 1 302 1 18 LYS HG2 1 60 ALA MB . . 4.360 4.012 3.579 4.377 0.017 14 0 "[ . 1 . 2]" 1 303 1 18 LYS HG3 1 19 PHE H . . 4.850 3.211 2.319 3.777 . 0 0 "[ . 1 . 2]" 1 304 1 18 LYS HG3 1 56 TYR QD . . 4.080 2.627 1.993 3.469 . 0 0 "[ . 1 . 2]" 1 305 1 18 LYS HG3 1 56 TYR QE . . 4.320 3.847 3.111 4.330 0.010 18 0 "[ . 1 . 2]" 1 306 1 19 PHE H 1 19 PHE HB2 . . 3.770 2.612 2.496 2.726 . 0 0 "[ . 1 . 2]" 1 307 1 19 PHE H 1 19 PHE HB3 . . 3.760 2.123 2.031 2.254 . 0 0 "[ . 1 . 2]" 1 308 1 19 PHE H 1 19 PHE QD . . 4.590 3.990 3.881 4.073 . 0 0 "[ . 1 . 2]" 1 309 1 19 PHE H 1 20 SER H . . 3.950 2.824 2.683 2.944 . 0 0 "[ . 1 . 2]" 1 310 1 19 PHE H 1 20 SER QB . . 5.040 4.820 4.659 4.877 . 0 0 "[ . 1 . 2]" 1 311 1 19 PHE H 1 21 GLN H . . 5.420 4.616 4.351 4.779 . 0 0 "[ . 1 . 2]" 1 312 1 19 PHE H 1 56 TYR HB3 . . 4.990 3.106 2.742 3.332 . 0 0 "[ . 1 . 2]" 1 313 1 19 PHE H 1 56 TYR QD . . 4.990 3.709 3.535 3.868 . 0 0 "[ . 1 . 2]" 1 314 1 19 PHE H 1 56 TYR QE . . 5.500 4.620 4.381 4.772 . 0 0 "[ . 1 . 2]" 1 315 1 19 PHE HA 1 19 PHE QD . . 3.970 2.772 2.618 2.988 . 0 0 "[ . 1 . 2]" 1 316 1 19 PHE HA 1 22 GLU H . . 4.560 3.446 3.228 3.592 . 0 0 "[ . 1 . 2]" 1 317 1 19 PHE HA 1 22 GLU HB2 . . 4.150 2.667 2.568 2.833 . 0 0 "[ . 1 . 2]" 1 318 1 19 PHE HA 1 22 GLU HB3 . . 4.360 3.569 3.387 3.735 . 0 0 "[ . 1 . 2]" 1 319 1 19 PHE HA 1 56 TYR QD . . 4.770 3.620 3.183 3.935 . 0 0 "[ . 1 . 2]" 1 320 1 19 PHE HA 1 56 TYR QE . . 3.920 3.079 2.686 3.524 . 0 0 "[ . 1 . 2]" 1 321 1 19 PHE HB2 1 20 SER H . . 4.240 3.983 3.935 4.038 . 0 0 "[ . 1 . 2]" 1 322 1 19 PHE HB2 1 45 TRP HE3 . . 5.190 2.993 2.636 3.540 . 0 0 "[ . 1 . 2]" 1 323 1 19 PHE HB2 1 45 TRP HZ3 . . 4.550 2.420 2.097 3.081 . 0 0 "[ . 1 . 2]" 1 324 1 19 PHE HB2 1 56 TYR QD . . 4.800 2.868 2.565 3.171 . 0 0 "[ . 1 . 2]" 1 325 1 19 PHE HB2 1 56 TYR QE . . 4.480 2.962 2.700 3.372 . 0 0 "[ . 1 . 2]" 1 326 1 19 PHE HB3 1 20 SER H . . 3.890 2.610 2.537 2.713 . 0 0 "[ . 1 . 2]" 1 327 1 19 PHE HB3 1 45 TRP HE3 . . 5.190 2.411 2.135 2.652 . 0 0 "[ . 1 . 2]" 1 328 1 19 PHE HB3 1 45 TRP HZ3 . . 4.900 2.563 2.352 2.790 . 0 0 "[ . 1 . 2]" 1 329 1 19 PHE QD 1 20 SER H . . 4.260 3.092 2.655 3.353 . 0 0 "[ . 1 . 2]" 1 330 1 19 PHE QD 1 20 SER QB . . 5.190 4.402 3.527 4.658 . 0 0 "[ . 1 . 2]" 1 331 1 19 PHE QD 1 22 GLU HB2 . . 5.500 4.131 3.399 4.570 . 0 0 "[ . 1 . 2]" 1 332 1 19 PHE QD 1 23 LEU MD1 . . 4.510 3.062 2.934 3.287 . 0 0 "[ . 1 . 2]" 1 333 1 19 PHE QD 1 23 LEU MD2 . . 4.850 4.703 4.511 4.898 0.048 19 0 "[ . 1 . 2]" 1 334 1 19 PHE QD 1 41 ILE MG . . 4.190 3.019 2.732 3.494 . 0 0 "[ . 1 . 2]" 1 335 1 19 PHE QD 1 44 ARG HB3 . . 5.190 5.203 4.757 5.312 0.122 7 0 "[ . 1 . 2]" 1 336 1 19 PHE QD 1 45 TRP H . . 4.950 4.354 3.994 4.660 . 0 0 "[ . 1 . 2]" 1 337 1 19 PHE QD 1 45 TRP HA . . 5.060 3.591 3.245 3.911 . 0 0 "[ . 1 . 2]" 1 338 1 19 PHE QD 1 45 TRP HB2 . . 4.320 2.225 2.052 2.435 . 0 0 "[ . 1 . 2]" 1 339 1 19 PHE QD 1 45 TRP HB3 . . 5.190 3.901 3.723 4.084 . 0 0 "[ . 1 . 2]" 1 340 1 19 PHE QD 1 45 TRP HE3 . . 4.900 2.139 1.986 2.394 . 0 0 "[ . 1 . 2]" 1 341 1 19 PHE QD 1 45 TRP HZ3 . . 4.900 3.855 3.807 3.995 . 0 0 "[ . 1 . 2]" 1 342 1 19 PHE QD 1 48 ILE MD . . 4.560 3.389 3.249 3.532 . 0 0 "[ . 1 . 2]" 1 343 1 19 PHE QD 1 56 TYR QD . . 5.380 4.156 4.025 4.300 . 0 0 "[ . 1 . 2]" 1 344 1 19 PHE QD 1 56 TYR QE . . 4.080 2.805 2.462 3.067 . 0 0 "[ . 1 . 2]" 1 345 1 19 PHE QE 1 23 LEU MD1 . . 3.930 2.386 2.313 2.480 . 0 0 "[ . 1 . 2]" 1 346 1 19 PHE QE 1 23 LEU MD2 . . 4.060 3.251 3.042 3.388 . 0 0 "[ . 1 . 2]" 1 347 1 19 PHE QE 1 41 ILE HA . . 4.560 3.635 3.215 4.307 . 0 0 "[ . 1 . 2]" 1 348 1 19 PHE QE 1 41 ILE MG . . 3.470 2.226 1.963 2.709 . 0 0 "[ . 1 . 2]" 1 349 1 19 PHE QE 1 44 ARG H . . 5.040 4.249 4.020 4.411 . 0 0 "[ . 1 . 2]" 1 350 1 19 PHE QE 1 44 ARG HA . . 5.380 4.753 4.475 5.020 . 0 0 "[ . 1 . 2]" 1 351 1 19 PHE QE 1 44 ARG HB2 . . 4.230 2.541 2.270 2.959 . 0 0 "[ . 1 . 2]" 1 352 1 19 PHE QE 1 44 ARG HB3 . . 4.370 3.174 2.544 3.343 . 0 0 "[ . 1 . 2]" 1 353 1 19 PHE QE 1 45 TRP H . . 4.180 2.561 2.400 2.676 . 0 0 "[ . 1 . 2]" 1 354 1 19 PHE QE 1 45 TRP HA . . 4.620 3.023 2.787 3.278 . 0 0 "[ . 1 . 2]" 1 355 1 19 PHE QE 1 45 TRP HB2 . . 4.450 2.336 1.991 2.641 . 0 0 "[ . 1 . 2]" 1 356 1 19 PHE QE 1 45 TRP HB3 . . 4.690 3.448 3.057 3.712 . 0 0 "[ . 1 . 2]" 1 357 1 19 PHE QE 1 45 TRP HE3 . . 5.500 3.643 3.526 3.830 . 0 0 "[ . 1 . 2]" 1 358 1 19 PHE QE 1 46 GLN H . . 4.910 4.887 4.784 4.927 0.017 13 0 "[ . 1 . 2]" 1 359 1 19 PHE QE 1 48 ILE MD . . 3.990 3.728 3.636 3.842 . 0 0 "[ . 1 . 2]" 1 360 1 19 PHE QE 1 56 TYR QE . . 4.420 4.143 3.948 4.405 . 0 0 "[ . 1 . 2]" 1 361 1 19 PHE HZ 1 23 LEU MD1 . . 4.050 2.072 1.925 2.338 . 0 0 "[ . 1 . 2]" 1 362 1 19 PHE HZ 1 23 LEU MD2 . . 4.180 2.957 2.704 3.402 . 0 0 "[ . 1 . 2]" 1 363 1 19 PHE HZ 1 41 ILE HA . . 5.190 4.384 3.802 4.902 . 0 0 "[ . 1 . 2]" 1 364 1 19 PHE HZ 1 41 ILE MG . . 3.910 3.874 3.537 4.024 0.114 19 0 "[ . 1 . 2]" 1 365 1 19 PHE HZ 1 44 ARG H . . 5.210 4.717 4.280 5.122 . 0 0 "[ . 1 . 2]" 1 366 1 19 PHE HZ 1 44 ARG HA . . 4.690 4.365 4.141 4.581 . 0 0 "[ . 1 . 2]" 1 367 1 19 PHE HZ 1 44 ARG HB2 . . 3.810 2.336 1.986 2.927 . 0 0 "[ . 1 . 2]" 1 368 1 19 PHE HZ 1 44 ARG HB3 . . 3.570 1.958 1.914 1.990 . 0 0 "[ . 1 . 2]" 1 369 1 19 PHE HZ 1 44 ARG HD2 . . 4.690 4.513 4.383 4.758 0.068 18 0 "[ . 1 . 2]" 1 370 1 19 PHE HZ 1 44 ARG HD3 . . 4.690 2.995 2.692 4.647 . 0 0 "[ . 1 . 2]" 1 371 1 19 PHE HZ 1 44 ARG QG . . 4.800 3.758 2.988 3.960 . 0 0 "[ . 1 . 2]" 1 372 1 19 PHE HZ 1 45 TRP H . . 4.620 3.998 3.353 4.361 . 0 0 "[ . 1 . 2]" 1 373 1 19 PHE HZ 1 45 TRP HA . . 4.620 4.048 3.493 4.560 . 0 0 "[ . 1 . 2]" 1 374 1 19 PHE HZ 1 45 TRP HB2 . . 5.190 4.518 3.932 5.019 . 0 0 "[ . 1 . 2]" 1 375 1 19 PHE HZ 1 48 ILE MD . . 4.480 4.432 4.232 4.497 0.017 3 0 "[ . 1 . 2]" 1 376 1 20 SER H 1 20 SER QB . . 3.850 2.458 2.175 2.610 . 0 0 "[ . 1 . 2]" 1 377 1 20 SER H 1 21 GLN H . . 3.920 2.936 2.781 3.075 . 0 0 "[ . 1 . 2]" 1 378 1 20 SER H 1 21 GLN QB . . 4.830 4.499 4.397 4.605 . 0 0 "[ . 1 . 2]" 1 379 1 20 SER H 1 41 ILE MG . . 4.830 3.763 3.678 3.831 . 0 0 "[ . 1 . 2]" 1 380 1 20 SER HA 1 23 LEU H . . 4.670 3.211 3.141 3.352 . 0 0 "[ . 1 . 2]" 1 381 1 20 SER HA 1 23 LEU HB2 . . 4.320 2.988 2.853 3.194 . 0 0 "[ . 1 . 2]" 1 382 1 20 SER HA 1 23 LEU HB3 . . 4.950 4.666 4.547 4.855 . 0 0 "[ . 1 . 2]" 1 383 1 20 SER HA 1 23 LEU MD1 . . 4.560 2.403 2.259 2.561 . 0 0 "[ . 1 . 2]" 1 384 1 20 SER HA 1 23 LEU MD2 . . 4.950 4.879 4.777 5.010 0.060 19 0 "[ . 1 . 2]" 1 385 1 20 SER HA 1 23 LEU HG . . 4.510 4.106 4.006 4.213 . 0 0 "[ . 1 . 2]" 1 386 1 20 SER HA 1 24 LEU H . . 4.990 4.473 4.222 4.936 . 0 0 "[ . 1 . 2]" 1 387 1 20 SER HA 1 24 LEU MD2 . . 5.060 4.968 4.836 5.069 0.009 11 0 "[ . 1 . 2]" 1 388 1 20 SER HA 1 41 ILE HB . . 4.950 4.664 4.578 4.745 . 0 0 "[ . 1 . 2]" 1 389 1 20 SER HA 1 41 ILE MD . . 3.850 3.506 3.033 3.682 . 0 0 "[ . 1 . 2]" 1 390 1 20 SER HA 1 41 ILE MG . . 3.260 1.953 1.934 1.986 . 0 0 "[ . 1 . 2]" 1 391 1 20 SER QB 1 21 GLN H . . 4.060 2.311 2.128 3.128 . 0 0 "[ . 1 . 2]" 1 392 1 20 SER QB 1 21 GLN HA . . 4.850 3.754 3.690 4.405 . 0 0 "[ . 1 . 2]" 1 393 1 20 SER QB 1 21 GLN QB . . 5.060 4.014 3.873 4.594 . 0 0 "[ . 1 . 2]" 1 394 1 20 SER QB 1 24 LEU MD1 . . 4.950 3.517 3.298 3.749 . 0 0 "[ . 1 . 2]" 1 395 1 20 SER QB 1 24 LEU HG . . 5.500 3.408 3.135 3.806 . 0 0 "[ . 1 . 2]" 1 396 1 20 SER QB 1 38 MET ME . . 4.450 2.815 2.035 3.267 . 0 0 "[ . 1 . 2]" 1 397 1 20 SER QB 1 41 ILE MD . . 4.320 2.813 2.579 2.974 . 0 0 "[ . 1 . 2]" 1 398 1 20 SER QB 1 41 ILE MG . . 3.630 2.587 2.266 2.980 . 0 0 "[ . 1 . 2]" 1 399 1 21 GLN H 1 21 GLN QB . . 3.060 2.092 2.022 2.155 . 0 0 "[ . 1 . 2]" 1 400 1 21 GLN H 1 21 GLN HG2 . . 3.950 3.666 2.954 4.317 0.367 3 0 "[ . 1 . 2]" 1 401 1 21 GLN H 1 21 GLN HG3 . . 4.340 3.329 2.921 4.270 . 0 0 "[ . 1 . 2]" 1 402 1 21 GLN H 1 22 GLU HA . . 5.340 5.329 5.238 5.375 0.035 1 0 "[ . 1 . 2]" 1 403 1 21 GLN H 1 23 LEU H . . 5.270 4.424 4.332 4.570 . 0 0 "[ . 1 . 2]" 1 404 1 21 GLN H 1 24 LEU MD1 . . 5.500 4.538 4.198 4.672 . 0 0 "[ . 1 . 2]" 1 405 1 21 GLN H 1 24 LEU HG . . 5.150 4.542 4.370 4.714 . 0 0 "[ . 1 . 2]" 1 406 1 21 GLN H 1 41 ILE MD . . 5.500 5.370 5.160 5.483 . 0 0 "[ . 1 . 2]" 1 407 1 21 GLN H 1 41 ILE MG . . 5.060 4.889 4.755 5.033 . 0 0 "[ . 1 . 2]" 1 408 1 21 GLN HA 1 21 GLN HG2 . . 4.180 2.281 2.001 3.027 . 0 0 "[ . 1 . 2]" 1 409 1 21 GLN HA 1 21 GLN HG3 . . 3.800 2.949 2.012 3.557 . 0 0 "[ . 1 . 2]" 1 410 1 21 GLN HA 1 23 LEU H . . 5.340 4.386 4.309 4.558 . 0 0 "[ . 1 . 2]" 1 411 1 21 GLN HA 1 24 LEU H . . 4.060 3.185 3.111 3.374 . 0 0 "[ . 1 . 2]" 1 412 1 21 GLN HA 1 24 LEU HB2 . . 3.830 2.267 2.200 2.607 . 0 0 "[ . 1 . 2]" 1 413 1 21 GLN HA 1 24 LEU HB3 . . 4.690 3.865 3.795 4.134 . 0 0 "[ . 1 . 2]" 1 414 1 21 GLN HA 1 24 LEU MD1 . . 4.040 2.976 2.518 3.195 . 0 0 "[ . 1 . 2]" 1 415 1 21 GLN HA 1 24 LEU MD2 . . 4.850 4.487 4.309 4.596 . 0 0 "[ . 1 . 2]" 1 416 1 21 GLN HA 1 24 LEU HG . . 3.910 3.049 2.728 3.241 . 0 0 "[ . 1 . 2]" 1 417 1 21 GLN HA 1 25 SER H . . 4.830 4.237 4.102 4.704 . 0 0 "[ . 1 . 2]" 1 418 1 21 GLN QB 1 23 LEU H . . 4.770 4.879 4.845 5.023 0.253 18 0 "[ . 1 . 2]" 1 419 1 21 GLN QB 1 24 LEU H . . 4.990 4.616 4.549 4.767 . 0 0 "[ . 1 . 2]" 1 420 1 21 GLN QB 1 24 LEU MD1 . . 4.950 4.637 4.344 4.823 . 0 0 "[ . 1 . 2]" 1 421 1 21 GLN QB 1 25 SER H . . 5.210 4.763 4.688 4.975 . 0 0 "[ . 1 . 2]" 1 422 1 21 GLN HG2 1 24 LEU MD1 . . 5.350 3.552 2.865 4.379 . 0 0 "[ . 1 . 2]" 1 423 1 22 GLU H 1 22 GLU HB2 . . 2.990 2.106 2.065 2.139 . 0 0 "[ . 1 . 2]" 1 424 1 22 GLU H 1 22 GLU HB3 . . 3.420 2.949 2.897 3.026 . 0 0 "[ . 1 . 2]" 1 425 1 22 GLU H 1 22 GLU HG3 . . 4.010 4.120 3.983 4.172 0.162 13 0 "[ . 1 . 2]" 1 426 1 22 GLU H 1 23 LEU H . . 3.620 2.669 2.626 2.769 . 0 0 "[ . 1 . 2]" 1 427 1 22 GLU H 1 23 LEU HG . . 4.640 4.748 4.724 4.869 0.229 18 0 "[ . 1 . 2]" 1 428 1 22 GLU HA 1 22 GLU HG2 . . 3.830 3.129 2.044 3.340 . 0 0 "[ . 1 . 2]" 1 429 1 22 GLU HA 1 22 GLU HG3 . . 3.150 2.196 2.038 3.045 . 0 0 "[ . 1 . 2]" 1 430 1 22 GLU HB2 1 23 LEU H . . 3.930 3.504 3.427 3.584 . 0 0 "[ . 1 . 2]" 1 431 1 22 GLU HB3 1 23 LEU H . . 3.670 2.732 2.518 2.793 . 0 0 "[ . 1 . 2]" 1 432 1 22 GLU HB3 1 23 LEU HB2 . . 4.850 4.773 4.700 4.820 . 0 0 "[ . 1 . 2]" 1 433 1 22 GLU HB3 1 23 LEU MD1 . . 3.990 4.041 4.009 4.116 0.126 18 0 "[ . 1 . 2]" 1 434 1 22 GLU HB3 1 23 LEU HG . . 4.250 3.147 3.112 3.232 . 0 0 "[ . 1 . 2]" 1 435 1 22 GLU HB3 1 26 ASN HD21 . . 4.910 3.278 3.161 3.768 . 0 0 "[ . 1 . 2]" 1 436 1 22 GLU HB3 1 26 ASN HD22 . . 4.910 2.677 2.277 2.838 . 0 0 "[ . 1 . 2]" 1 437 1 22 GLU HB3 1 56 TYR QE . . 4.850 4.640 4.159 4.876 0.026 13 0 "[ . 1 . 2]" 1 438 1 22 GLU HG2 1 23 LEU H . . 5.340 4.741 4.475 4.800 . 0 0 "[ . 1 . 2]" 1 439 1 22 GLU HG2 1 26 ASN HD21 . . 5.350 3.690 3.533 4.338 . 0 0 "[ . 1 . 2]" 1 440 1 22 GLU HG2 1 26 ASN HD22 . . 5.350 2.163 1.949 3.114 . 0 0 "[ . 1 . 2]" 1 441 1 22 GLU HG2 1 56 TYR QE . . 5.350 4.783 4.064 5.342 . 0 0 "[ . 1 . 2]" 1 442 1 22 GLU HG3 1 23 LEU H . . 4.690 4.862 4.740 5.291 0.601 8 3 "[ * . + 1 - . 2]" 1 443 1 23 LEU H 1 23 LEU HB2 . . 3.310 2.344 2.319 2.373 . 0 0 "[ . 1 . 2]" 1 444 1 23 LEU H 1 23 LEU HB3 . . 3.900 3.530 3.520 3.535 . 0 0 "[ . 1 . 2]" 1 445 1 23 LEU H 1 23 LEU MD1 . . 4.090 3.065 2.999 3.144 . 0 0 "[ . 1 . 2]" 1 446 1 23 LEU H 1 23 LEU MD2 . . 4.150 3.936 3.865 3.974 . 0 0 "[ . 1 . 2]" 1 447 1 23 LEU H 1 23 LEU HG . . 3.770 2.549 2.448 2.619 . 0 0 "[ . 1 . 2]" 1 448 1 23 LEU H 1 24 LEU H . . 3.750 2.503 2.463 2.672 . 0 0 "[ . 1 . 2]" 1 449 1 23 LEU H 1 24 LEU HB2 . . 5.500 4.605 4.541 4.924 . 0 0 "[ . 1 . 2]" 1 450 1 23 LEU H 1 24 LEU HG . . 5.090 4.328 4.173 4.465 . 0 0 "[ . 1 . 2]" 1 451 1 23 LEU H 1 25 SER H . . 4.990 3.916 3.816 4.020 . 0 0 "[ . 1 . 2]" 1 452 1 23 LEU H 1 41 ILE MD . . 4.760 4.632 4.505 4.760 0.000 7 0 "[ . 1 . 2]" 1 453 1 23 LEU H 1 41 ILE MG . . 4.410 4.271 4.129 4.357 . 0 0 "[ . 1 . 2]" 1 454 1 23 LEU HA 1 23 LEU MD1 . . 4.150 3.859 3.852 3.868 . 0 0 "[ . 1 . 2]" 1 455 1 23 LEU HA 1 23 LEU MD2 . . 3.190 2.554 2.453 2.619 . 0 0 "[ . 1 . 2]" 1 456 1 23 LEU HA 1 23 LEU HG . . 3.330 2.622 2.606 2.654 . 0 0 "[ . 1 . 2]" 1 457 1 23 LEU HA 1 25 SER H . . 4.210 4.019 3.919 4.088 . 0 0 "[ . 1 . 2]" 1 458 1 23 LEU HA 1 26 ASN H . . 3.880 3.058 2.976 3.249 . 0 0 "[ . 1 . 2]" 1 459 1 23 LEU HA 1 26 ASN HB2 . . 4.090 2.113 1.987 3.064 . 0 0 "[ . 1 . 2]" 1 460 1 23 LEU HA 1 26 ASN HB3 . . 4.450 3.703 3.584 4.567 0.117 18 0 "[ . 1 . 2]" 1 461 1 23 LEU HA 1 26 ASN HD21 . . 4.450 1.992 1.940 2.355 . 0 0 "[ . 1 . 2]" 1 462 1 23 LEU HA 1 26 ASN HD22 . . 4.620 3.506 2.975 3.590 . 0 0 "[ . 1 . 2]" 1 463 1 23 LEU HA 1 27 GLY H . . 5.090 3.368 3.209 4.155 . 0 0 "[ . 1 . 2]" 1 464 1 23 LEU HA 1 28 GLU H . . 5.150 3.583 3.234 3.661 . 0 0 "[ . 1 . 2]" 1 465 1 23 LEU HA 1 29 LEU MD1 . . 4.560 4.393 4.198 4.540 . 0 0 "[ . 1 . 2]" 1 466 1 23 LEU HB2 1 23 LEU MD1 . . 3.450 2.012 1.965 2.122 . 0 0 "[ . 1 . 2]" 1 467 1 23 LEU HB2 1 24 LEU H . . 3.720 3.121 2.929 3.427 . 0 0 "[ . 1 . 2]" 1 468 1 23 LEU HB2 1 29 LEU MD1 . . 4.250 3.131 2.926 3.297 . 0 0 "[ . 1 . 2]" 1 469 1 23 LEU HB2 1 29 LEU HG . . 4.770 4.589 4.419 4.713 . 0 0 "[ . 1 . 2]" 1 470 1 23 LEU HB2 1 41 ILE MD . . 3.800 3.016 2.838 3.179 . 0 0 "[ . 1 . 2]" 1 471 1 23 LEU HB2 1 41 ILE HG12 . . 3.670 2.432 2.141 2.625 . 0 0 "[ . 1 . 2]" 1 472 1 23 LEU HB2 1 41 ILE HG13 . . 4.770 4.046 3.772 4.255 . 0 0 "[ . 1 . 2]" 1 473 1 23 LEU HB2 1 41 ILE MG . . 4.040 3.036 2.978 3.079 . 0 0 "[ . 1 . 2]" 1 474 1 23 LEU HB3 1 23 LEU MD2 . . 3.580 2.128 2.085 2.211 . 0 0 "[ . 1 . 2]" 1 475 1 23 LEU HB3 1 24 LEU H . . 4.350 3.995 3.848 4.187 . 0 0 "[ . 1 . 2]" 1 476 1 23 LEU HB3 1 24 LEU MD2 . . 3.950 3.782 3.449 3.891 . 0 0 "[ . 1 . 2]" 1 477 1 23 LEU HB3 1 29 LEU MD1 . . 3.950 2.181 1.972 2.370 . 0 0 "[ . 1 . 2]" 1 478 1 23 LEU HB3 1 29 LEU MD2 . . 4.280 3.779 3.430 3.914 . 0 0 "[ . 1 . 2]" 1 479 1 23 LEU HB3 1 41 ILE HA . . 5.350 4.838 4.520 4.969 . 0 0 "[ . 1 . 2]" 1 480 1 23 LEU HB3 1 41 ILE MD . . 3.950 3.616 3.303 3.801 . 0 0 "[ . 1 . 2]" 1 481 1 23 LEU HB3 1 41 ILE HG12 . . 4.850 2.845 2.646 2.931 . 0 0 "[ . 1 . 2]" 1 482 1 23 LEU HB3 1 41 ILE MG . . 4.090 4.120 4.046 4.147 0.057 1 0 "[ . 1 . 2]" 1 483 1 23 LEU MD1 1 24 LEU H . . 5.060 4.565 4.423 4.874 . 0 0 "[ . 1 . 2]" 1 484 1 23 LEU MD1 1 26 ASN HD21 . . 5.500 4.520 4.468 4.866 . 0 0 "[ . 1 . 2]" 1 485 1 23 LEU MD1 1 26 ASN HD22 . . 5.190 5.223 4.863 5.265 0.075 8 0 "[ . 1 . 2]" 1 486 1 23 LEU MD1 1 28 GLU QG . . 5.500 4.761 4.621 4.865 . 0 0 "[ . 1 . 2]" 1 487 1 23 LEU MD1 1 29 LEU MD1 . . 4.120 2.886 2.719 3.032 . 0 0 "[ . 1 . 2]" 1 488 1 23 LEU MD1 1 29 LEU MD2 . . 4.120 4.004 3.752 4.155 0.035 18 0 "[ . 1 . 2]" 1 489 1 23 LEU MD1 1 29 LEU HG . . 4.850 4.569 4.395 4.686 . 0 0 "[ . 1 . 2]" 1 490 1 23 LEU MD1 1 41 ILE H . . 5.190 4.704 4.472 4.819 . 0 0 "[ . 1 . 2]" 1 491 1 23 LEU MD1 1 41 ILE HA . . 4.090 2.787 2.489 2.928 . 0 0 "[ . 1 . 2]" 1 492 1 23 LEU MD1 1 41 ILE MD . . 3.910 3.307 3.106 3.469 . 0 0 "[ . 1 . 2]" 1 493 1 23 LEU MD1 1 41 ILE HG12 . . 3.310 1.972 1.930 2.035 . 0 0 "[ . 1 . 2]" 1 494 1 23 LEU MD1 1 41 ILE HG13 . . 4.120 3.412 3.194 3.508 . 0 0 "[ . 1 . 2]" 1 495 1 23 LEU MD1 1 41 ILE MG . . 3.380 1.879 1.830 1.936 . 0 0 "[ . 1 . 2]" 1 496 1 23 LEU MD1 1 44 ARG H . . 5.500 4.541 4.120 4.698 . 0 0 "[ . 1 . 2]" 1 497 1 23 LEU MD1 1 44 ARG HB2 . . 4.320 2.619 2.324 2.749 . 0 0 "[ . 1 . 2]" 1 498 1 23 LEU MD1 1 44 ARG HB3 . . 3.970 3.183 2.633 3.341 . 0 0 "[ . 1 . 2]" 1 499 1 23 LEU MD1 1 44 ARG HD2 . . 4.180 3.855 3.204 4.136 . 0 0 "[ . 1 . 2]" 1 500 1 23 LEU MD1 1 44 ARG HD3 . . 3.970 2.717 2.452 3.127 . 0 0 "[ . 1 . 2]" 1 501 1 23 LEU MD1 1 44 ARG QG . . 3.910 3.582 2.736 3.752 . 0 0 "[ . 1 . 2]" 1 502 1 23 LEU MD1 1 45 TRP H . . 5.190 4.246 3.862 4.422 . 0 0 "[ . 1 . 2]" 1 503 1 23 LEU MD2 1 24 LEU H . . 5.060 5.101 5.045 5.136 0.076 2 0 "[ . 1 . 2]" 1 504 1 23 LEU MD2 1 26 ASN H . . 5.500 5.108 5.020 5.180 . 0 0 "[ . 1 . 2]" 1 505 1 23 LEU MD2 1 26 ASN HD21 . . 3.990 2.799 2.664 2.934 . 0 0 "[ . 1 . 2]" 1 506 1 23 LEU MD2 1 26 ASN HD22 . . 4.210 4.062 3.873 4.193 . 0 0 "[ . 1 . 2]" 1 507 1 23 LEU MD2 1 28 GLU H . . 4.850 3.745 3.642 3.919 . 0 0 "[ . 1 . 2]" 1 508 1 23 LEU MD2 1 28 GLU HB2 . . 3.700 2.611 2.144 2.686 . 0 0 "[ . 1 . 2]" 1 509 1 23 LEU MD2 1 28 GLU HB3 . . 4.180 3.641 2.142 3.737 . 0 0 "[ . 1 . 2]" 1 510 1 23 LEU MD2 1 28 GLU QG . . 3.950 2.225 2.156 2.328 . 0 0 "[ . 1 . 2]" 1 511 1 23 LEU MD2 1 29 LEU H . . 5.190 4.304 4.076 4.503 . 0 0 "[ . 1 . 2]" 1 512 1 23 LEU MD2 1 29 LEU QB . . 4.450 4.476 4.439 4.513 0.063 18 0 "[ . 1 . 2]" 1 513 1 23 LEU MD2 1 29 LEU MD1 . . 3.150 2.405 2.221 2.527 . 0 0 "[ . 1 . 2]" 1 514 1 23 LEU MD2 1 29 LEU MD2 . . 3.970 2.503 2.167 2.817 . 0 0 "[ . 1 . 2]" 1 515 1 23 LEU MD2 1 29 LEU HG . . 4.280 2.863 2.778 2.969 . 0 0 "[ . 1 . 2]" 1 516 1 23 LEU MD2 1 41 ILE HA . . 4.250 4.045 3.788 4.207 . 0 0 "[ . 1 . 2]" 1 517 1 23 LEU MD2 1 41 ILE HG12 . . 4.510 3.570 3.403 3.694 . 0 0 "[ . 1 . 2]" 1 518 1 23 LEU MD2 1 41 ILE HG13 . . 4.360 4.338 4.211 4.439 0.079 18 0 "[ . 1 . 2]" 1 519 1 23 LEU MD2 1 41 ILE MG . . 4.250 4.062 3.952 4.218 . 0 0 "[ . 1 . 2]" 1 520 1 23 LEU MD2 1 44 ARG HD2 . . 4.120 3.054 2.666 3.977 . 0 0 "[ . 1 . 2]" 1 521 1 23 LEU MD2 1 44 ARG HD3 . . 3.970 2.133 1.932 2.931 . 0 0 "[ . 1 . 2]" 1 522 1 23 LEU MD2 1 44 ARG QG . . 4.850 3.646 2.460 4.013 . 0 0 "[ . 1 . 2]" 1 523 1 23 LEU HG 1 24 LEU H . . 4.950 4.656 4.609 4.721 . 0 0 "[ . 1 . 2]" 1 524 1 23 LEU HG 1 26 ASN HD21 . . 4.850 2.964 2.895 3.405 . 0 0 "[ . 1 . 2]" 1 525 1 23 LEU HG 1 41 ILE HG12 . . 5.400 4.443 4.304 4.503 . 0 0 "[ . 1 . 2]" 1 526 1 23 LEU HG 1 41 ILE MG . . 5.060 4.284 4.130 4.415 . 0 0 "[ . 1 . 2]" 1 527 1 24 LEU H 1 24 LEU HB2 . . 3.660 2.322 2.272 2.460 . 0 0 "[ . 1 . 2]" 1 528 1 24 LEU H 1 24 LEU MD1 . . 4.120 3.974 3.788 4.134 0.014 19 0 "[ . 1 . 2]" 1 529 1 24 LEU H 1 24 LEU MD2 . . 3.920 3.202 3.076 3.371 . 0 0 "[ . 1 . 2]" 1 530 1 24 LEU H 1 24 LEU HG . . 3.460 2.676 2.388 2.915 . 0 0 "[ . 1 . 2]" 1 531 1 24 LEU H 1 25 SER H . . 3.610 2.350 2.138 2.464 . 0 0 "[ . 1 . 2]" 1 532 1 24 LEU H 1 26 ASN H . . 4.870 3.611 3.427 3.723 . 0 0 "[ . 1 . 2]" 1 533 1 24 LEU H 1 41 ILE MD . . 4.280 4.145 3.923 4.313 0.033 18 0 "[ . 1 . 2]" 1 534 1 24 LEU H 1 41 ILE MG . . 5.500 5.130 4.908 5.348 . 0 0 "[ . 1 . 2]" 1 535 1 24 LEU HA 1 24 LEU MD1 . . 3.780 3.718 3.680 3.798 0.018 7 0 "[ . 1 . 2]" 1 536 1 24 LEU HA 1 24 LEU MD2 . . 3.150 1.929 1.880 2.059 . 0 0 "[ . 1 . 2]" 1 537 1 24 LEU HA 1 24 LEU HG . . 3.820 3.240 3.181 3.314 . 0 0 "[ . 1 . 2]" 1 538 1 24 LEU HA 1 27 GLY H . . 5.190 4.079 3.567 4.192 . 0 0 "[ . 1 . 2]" 1 539 1 24 LEU HA 1 27 GLY HA2 . . 4.510 4.505 3.850 4.552 0.042 15 0 "[ . 1 . 2]" 1 540 1 24 LEU HA 1 37 ARG QD . . 5.060 3.684 3.260 3.972 . 0 0 "[ . 1 . 2]" 1 541 1 24 LEU HA 1 41 ILE MD . . 4.450 4.156 3.905 4.316 . 0 0 "[ . 1 . 2]" 1 542 1 24 LEU HB2 1 25 SER H . . 4.030 3.097 3.056 3.251 . 0 0 "[ . 1 . 2]" 1 543 1 24 LEU HB2 1 25 SER HA . . 4.950 4.620 4.510 4.675 . 0 0 "[ . 1 . 2]" 1 544 1 24 LEU HB3 1 25 SER H . . 4.490 3.955 3.904 4.183 . 0 0 "[ . 1 . 2]" 1 545 1 24 LEU MD1 1 25 SER H . . 5.350 5.072 5.011 5.146 . 0 0 "[ . 1 . 2]" 1 546 1 24 LEU MD1 1 37 ARG QD . . 4.620 4.167 3.391 4.321 . 0 0 "[ . 1 . 2]" 1 547 1 24 LEU MD1 1 38 MET ME . . 3.620 2.517 1.923 3.259 . 0 0 "[ . 1 . 2]" 1 548 1 24 LEU MD2 1 25 SER H . . 4.790 4.568 4.520 4.650 . 0 0 "[ . 1 . 2]" 1 549 1 24 LEU MD2 1 37 ARG H . . 5.500 5.420 5.022 5.517 0.017 1 0 "[ . 1 . 2]" 1 550 1 24 LEU MD2 1 37 ARG QB . . 3.970 2.547 2.139 2.686 . 0 0 "[ . 1 . 2]" 1 551 1 24 LEU MD2 1 37 ARG QD . . 3.700 2.464 2.040 2.631 . 0 0 "[ . 1 . 2]" 1 552 1 24 LEU MD2 1 37 ARG HE . . 5.060 4.906 4.432 5.078 0.018 14 0 "[ . 1 . 2]" 1 553 1 24 LEU MD2 1 38 MET HA . . 4.950 4.093 3.849 4.547 . 0 0 "[ . 1 . 2]" 1 554 1 24 LEU MD2 1 38 MET QG . . 5.060 3.780 3.410 4.458 . 0 0 "[ . 1 . 2]" 1 555 1 24 LEU HG 1 41 ILE MD . . 3.300 2.730 2.570 2.944 . 0 0 "[ . 1 . 2]" 1 556 1 24 LEU HG 1 41 ILE HG12 . . 5.190 4.606 4.374 4.867 . 0 0 "[ . 1 . 2]" 1 557 1 25 SER H 1 25 SER QB . . 3.260 2.240 2.154 2.316 . 0 0 "[ . 1 . 2]" 1 558 1 25 SER H 1 26 ASN H . . 3.390 2.145 2.130 2.154 . 0 0 "[ . 1 . 2]" 1 559 1 25 SER H 1 26 ASN HA . . 5.500 4.696 4.688 4.754 . 0 0 "[ . 1 . 2]" 1 560 1 25 SER H 1 26 ASN HB2 . . 5.060 4.227 4.156 4.825 . 0 0 "[ . 1 . 2]" 1 561 1 25 SER H 1 26 ASN HB3 . . 5.500 5.623 5.609 5.638 0.138 19 0 "[ . 1 . 2]" 1 562 1 25 SER H 1 27 GLY H . . 5.210 4.267 3.424 4.349 . 0 0 "[ . 1 . 2]" 1 563 1 25 SER HA 1 26 ASN HA . . 4.950 4.719 4.671 4.736 . 0 0 "[ . 1 . 2]" 1 564 1 25 SER HA 1 27 GLY H . . 5.090 4.923 3.697 5.076 . 0 0 "[ . 1 . 2]" 1 565 1 25 SER QB 1 26 ASN H . . 3.670 3.082 2.912 3.143 . 0 0 "[ . 1 . 2]" 1 566 1 26 ASN H 1 26 ASN HB2 . . 3.660 2.311 2.254 2.853 . 0 0 "[ . 1 . 2]" 1 567 1 26 ASN H 1 26 ASN HB3 . . 3.760 3.523 3.510 3.546 . 0 0 "[ . 1 . 2]" 1 568 1 26 ASN H 1 26 ASN HD21 . . 5.090 3.557 3.531 3.598 . 0 0 "[ . 1 . 2]" 1 569 1 26 ASN H 1 26 ASN HD22 . . 5.340 4.245 3.654 4.323 . 0 0 "[ . 1 . 2]" 1 570 1 26 ASN H 1 27 GLY H . . 3.580 2.645 2.381 2.706 . 0 0 "[ . 1 . 2]" 1 571 1 26 ASN H 1 27 GLY HA2 . . 5.340 4.682 4.605 4.712 . 0 0 "[ . 1 . 2]" 1 572 1 26 ASN H 1 27 GLY HA3 . . 4.990 5.013 4.992 5.043 0.053 7 0 "[ . 1 . 2]" 1 573 1 26 ASN H 1 28 GLU H . . 4.910 4.327 3.572 4.444 . 0 0 "[ . 1 . 2]" 1 574 1 26 ASN HA 1 26 ASN HD22 . . 5.500 4.620 4.573 5.035 . 0 0 "[ . 1 . 2]" 1 575 1 26 ASN HA 1 28 GLU H . . 5.500 4.842 4.259 4.930 . 0 0 "[ . 1 . 2]" 1 576 1 26 ASN HB2 1 27 GLY H . . 5.150 2.279 2.156 3.446 . 0 0 "[ . 1 . 2]" 1 577 1 26 ASN HB2 1 28 GLU H . . 5.060 2.745 2.280 2.853 . 0 0 "[ . 1 . 2]" 1 578 1 26 ASN HB2 1 28 GLU QG . . 4.690 2.275 2.186 3.033 . 0 0 "[ . 1 . 2]" 1 579 1 26 ASN HB2 1 29 LEU H . . 5.500 4.964 4.865 5.083 . 0 0 "[ . 1 . 2]" 1 580 1 26 ASN HB3 1 27 GLY H . . 5.040 3.135 3.009 4.463 . 0 0 "[ . 1 . 2]" 1 581 1 26 ASN HB3 1 28 GLU H . . 5.060 3.112 2.951 3.840 . 0 0 "[ . 1 . 2]" 1 582 1 26 ASN HB3 1 28 GLU QG . . 4.560 2.072 1.940 3.853 . 0 0 "[ . 1 . 2]" 1 583 1 26 ASN HD21 1 28 GLU HB3 . . 5.500 5.587 4.468 5.710 0.210 20 0 "[ . 1 . 2]" 1 584 1 26 ASN HD21 1 28 GLU QG . . 4.850 2.827 2.633 3.206 . 0 0 "[ . 1 . 2]" 1 585 1 26 ASN HD22 1 28 GLU QG . . 4.620 4.227 4.111 4.695 0.075 18 0 "[ . 1 . 2]" 1 586 1 27 GLY H 1 28 GLU H . . 3.760 2.099 2.048 2.645 . 0 0 "[ . 1 . 2]" 1 587 1 27 GLY H 1 28 GLU HB2 . . 5.500 4.761 4.376 4.826 . 0 0 "[ . 1 . 2]" 1 588 1 27 GLY H 1 28 GLU QG . . 5.500 3.143 2.983 5.576 0.076 18 0 "[ . 1 . 2]" 1 589 1 27 GLY H 1 29 LEU H . . 5.210 3.693 3.588 4.251 . 0 0 "[ . 1 . 2]" 1 590 1 27 GLY H 1 30 ASN QD . . 5.420 4.216 3.647 5.036 . 0 0 "[ . 1 . 2]" 1 591 1 27 GLY HA2 1 29 LEU H . . 5.270 3.247 3.070 3.492 . 0 0 "[ . 1 . 2]" 1 592 1 27 GLY HA2 1 30 ASN H . . 4.950 3.598 3.011 3.794 . 0 0 "[ . 1 . 2]" 1 593 1 27 GLY HA2 1 30 ASN QB . . 4.280 2.924 1.975 3.521 . 0 0 "[ . 1 . 2]" 1 594 1 27 GLY HA2 1 30 ASN QD . . 4.640 2.425 1.926 3.114 . 0 0 "[ . 1 . 2]" 1 595 1 27 GLY HA3 1 29 LEU H . . 5.270 4.436 4.250 4.704 . 0 0 "[ . 1 . 2]" 1 596 1 27 GLY HA3 1 30 ASN H . . 4.700 4.326 3.668 4.493 . 0 0 "[ . 1 . 2]" 1 597 1 27 GLY HA3 1 30 ASN QB . . 4.770 3.206 2.404 3.641 . 0 0 "[ . 1 . 2]" 1 598 1 27 GLY HA3 1 30 ASN QD . . 4.450 2.622 1.982 3.619 . 0 0 "[ . 1 . 2]" 1 599 1 28 GLU H 1 28 GLU HB2 . . 3.420 2.817 2.040 2.873 . 0 0 "[ . 1 . 2]" 1 600 1 28 GLU H 1 28 GLU HB3 . . 3.580 3.511 3.261 3.536 . 0 0 "[ . 1 . 2]" 1 601 1 28 GLU H 1 28 GLU QG . . 3.630 1.942 1.851 3.339 . 0 0 "[ . 1 . 2]" 1 602 1 28 GLU H 1 29 LEU H . . 3.740 2.499 2.430 2.913 . 0 0 "[ . 1 . 2]" 1 603 1 28 GLU H 1 29 LEU MD1 . . 5.190 4.743 4.606 5.272 0.082 18 0 "[ . 1 . 2]" 1 604 1 28 GLU H 1 29 LEU MD2 . . 4.850 4.193 4.008 4.942 0.092 18 0 "[ . 1 . 2]" 1 605 1 28 GLU H 1 29 LEU HG . . 5.420 3.506 3.367 4.225 . 0 0 "[ . 1 . 2]" 1 606 1 28 GLU H 1 30 ASN H . . 4.990 4.342 4.243 4.447 . 0 0 "[ . 1 . 2]" 1 607 1 28 GLU HA 1 28 GLU HB2 . . 2.760 2.999 2.840 3.016 0.256 5 0 "[ . 1 . 2]" 1 608 1 28 GLU HA 1 28 GLU QG . . 2.800 2.668 2.595 2.692 . 0 0 "[ . 1 . 2]" 1 609 1 28 GLU HA 1 30 ASN H . . 4.700 3.991 3.882 4.382 . 0 0 "[ . 1 . 2]" 1 610 1 28 GLU HB2 1 29 LEU H . . 4.670 3.289 3.036 3.533 . 0 0 "[ . 1 . 2]" 1 611 1 28 GLU HB2 1 29 LEU MD2 . . 3.870 2.116 1.963 3.910 0.040 18 0 "[ . 1 . 2]" 1 612 1 28 GLU HB2 1 29 LEU HG . . 4.620 2.759 2.596 3.378 . 0 0 "[ . 1 . 2]" 1 613 1 28 GLU HB3 1 29 LEU H . . 4.700 4.309 3.055 4.500 . 0 0 "[ . 1 . 2]" 1 614 1 28 GLU HB3 1 29 LEU MD2 . . 3.500 3.177 2.325 3.349 . 0 0 "[ . 1 . 2]" 1 615 1 28 GLU HB3 1 29 LEU HG . . 4.410 4.252 2.119 4.503 0.093 20 0 "[ . 1 . 2]" 1 616 1 28 GLU QG 1 29 LEU H . . 4.560 3.739 3.551 4.682 0.122 18 0 "[ . 1 . 2]" 1 617 1 28 GLU QG 1 29 LEU MD1 . . 4.450 4.492 4.449 4.708 0.258 18 0 "[ . 1 . 2]" 1 618 1 28 GLU QG 1 29 LEU MD2 . . 3.850 3.713 3.504 3.864 0.014 4 0 "[ . 1 . 2]" 1 619 1 28 GLU QG 1 29 LEU HG . . 4.180 3.755 3.695 4.172 . 0 0 "[ . 1 . 2]" 1 620 1 29 LEU H 1 29 LEU QB . . 3.730 2.996 2.903 3.051 . 0 0 "[ . 1 . 2]" 1 621 1 29 LEU H 1 29 LEU MD1 . . 4.210 3.663 3.499 3.804 . 0 0 "[ . 1 . 2]" 1 622 1 29 LEU H 1 29 LEU MD2 . . 4.180 3.345 3.191 3.604 . 0 0 "[ . 1 . 2]" 1 623 1 29 LEU H 1 29 LEU HG . . 3.950 2.176 1.979 2.387 . 0 0 "[ . 1 . 2]" 1 624 1 29 LEU H 1 30 ASN H . . 3.470 2.665 2.549 2.858 . 0 0 "[ . 1 . 2]" 1 625 1 29 LEU H 1 30 ASN HA . . 5.060 4.246 4.158 4.405 . 0 0 "[ . 1 . 2]" 1 626 1 29 LEU H 1 30 ASN QB . . 5.350 4.012 3.755 4.342 . 0 0 "[ . 1 . 2]" 1 627 1 29 LEU H 1 31 HIS HE1 . . 5.190 4.864 4.665 5.169 . 0 0 "[ . 1 . 2]" 1 628 1 29 LEU H 1 37 ARG QD . . 5.340 4.502 4.225 4.688 . 0 0 "[ . 1 . 2]" 1 629 1 29 LEU H 1 37 ARG QG . . 5.500 4.379 3.797 5.165 . 0 0 "[ . 1 . 2]" 1 630 1 29 LEU HA 1 29 LEU MD1 . . 4.410 4.085 4.065 4.103 . 0 0 "[ . 1 . 2]" 1 631 1 29 LEU HA 1 29 LEU MD2 . . 3.200 2.628 2.535 2.883 . 0 0 "[ . 1 . 2]" 1 632 1 29 LEU HA 1 31 HIS HE1 . . 3.440 2.176 2.041 2.416 . 0 0 "[ . 1 . 2]" 1 633 1 29 LEU QB 1 29 LEU MD1 . . 3.000 2.001 1.961 2.097 . 0 0 "[ . 1 . 2]" 1 634 1 29 LEU QB 1 29 LEU MD2 . . 3.100 2.168 2.008 2.226 . 0 0 "[ . 1 . 2]" 1 635 1 29 LEU QB 1 30 ASN H . . 4.700 3.994 3.980 4.004 . 0 0 "[ . 1 . 2]" 1 636 1 29 LEU QB 1 31 HIS HE1 . . 4.700 3.025 2.691 3.271 . 0 0 "[ . 1 . 2]" 1 637 1 29 LEU QB 1 37 ARG HA . . 3.870 2.648 2.494 2.878 . 0 0 "[ . 1 . 2]" 1 638 1 29 LEU QB 1 37 ARG QD . . 4.850 3.517 3.083 3.807 . 0 0 "[ . 1 . 2]" 1 639 1 29 LEU MD1 1 30 ASN H . . 5.500 5.433 5.346 5.483 . 0 0 "[ . 1 . 2]" 1 640 1 29 LEU MD1 1 31 HIS HE1 . . 5.500 4.907 4.678 5.177 . 0 0 "[ . 1 . 2]" 1 641 1 29 LEU MD1 1 37 ARG HA . . 4.280 2.698 2.448 3.038 . 0 0 "[ . 1 . 2]" 1 642 1 29 LEU MD1 1 37 ARG QD . . 5.060 3.962 3.648 4.300 . 0 0 "[ . 1 . 2]" 1 643 1 29 LEU MD1 1 40 GLU HA . . 4.850 4.496 4.342 4.696 . 0 0 "[ . 1 . 2]" 1 644 1 29 LEU MD1 1 40 GLU HB2 . . 3.580 3.538 3.334 3.625 0.045 5 0 "[ . 1 . 2]" 1 645 1 29 LEU MD1 1 40 GLU HB3 . . 3.890 2.107 1.961 2.262 . 0 0 "[ . 1 . 2]" 1 646 1 29 LEU MD1 1 40 GLU HG2 . . 4.180 3.636 3.271 4.152 . 0 0 "[ . 1 . 2]" 1 647 1 29 LEU MD1 1 40 GLU HG3 . . 4.680 3.478 3.053 3.978 . 0 0 "[ . 1 . 2]" 1 648 1 29 LEU MD1 1 41 ILE H . . 3.510 3.118 2.835 3.348 . 0 0 "[ . 1 . 2]" 1 649 1 29 LEU MD1 1 41 ILE HA . . 4.560 2.884 2.701 3.098 . 0 0 "[ . 1 . 2]" 1 650 1 29 LEU MD1 1 41 ILE HG13 . . 3.620 1.896 1.830 2.012 . 0 0 "[ . 1 . 2]" 1 651 1 29 LEU MD1 1 41 ILE MG . . 4.280 3.626 3.471 3.771 . 0 0 "[ . 1 . 2]" 1 652 1 29 LEU MD1 1 44 ARG HD2 . . 5.060 3.535 3.169 3.849 . 0 0 "[ . 1 . 2]" 1 653 1 29 LEU MD1 1 44 ARG HD3 . . 4.510 3.777 2.575 4.062 . 0 0 "[ . 1 . 2]" 1 654 1 29 LEU MD2 1 30 ASN H . . 5.190 4.708 4.646 4.913 . 0 0 "[ . 1 . 2]" 1 655 1 29 LEU MD2 1 31 HIS HE1 . . 3.560 2.623 2.411 2.949 . 0 0 "[ . 1 . 2]" 1 656 1 29 LEU MD2 1 37 ARG HA . . 4.620 4.610 4.440 4.683 0.063 8 0 "[ . 1 . 2]" 1 657 1 29 LEU MD2 1 40 GLU HG2 . . 3.580 3.233 2.727 4.094 0.514 1 1 "[+ . 1 . 2]" 1 658 1 29 LEU MD2 1 40 GLU HG3 . . 4.180 3.120 2.574 3.544 . 0 0 "[ . 1 . 2]" 1 659 1 29 LEU MD2 1 41 ILE H . . 5.150 4.924 4.470 5.172 0.022 5 0 "[ . 1 . 2]" 1 660 1 29 LEU MD2 1 41 ILE HA . . 4.360 4.163 3.945 4.367 0.007 6 0 "[ . 1 . 2]" 1 661 1 29 LEU MD2 1 41 ILE HG13 . . 4.210 4.081 3.914 4.215 0.005 10 0 "[ . 1 . 2]" 1 662 1 29 LEU MD2 1 44 ARG HD2 . . 5.190 2.455 2.057 3.643 . 0 0 "[ . 1 . 2]" 1 663 1 29 LEU MD2 1 44 ARG HD3 . . 4.690 3.240 2.291 3.758 . 0 0 "[ . 1 . 2]" 1 664 1 29 LEU HG 1 30 ASN H . . 5.340 4.584 4.521 4.654 . 0 0 "[ . 1 . 2]" 1 665 1 29 LEU HG 1 31 HIS HE1 . . 5.030 4.798 4.649 5.037 0.007 19 0 "[ . 1 . 2]" 1 666 1 29 LEU HG 1 41 ILE MD . . 4.770 4.736 4.445 4.803 0.033 1 0 "[ . 1 . 2]" 1 667 1 30 ASN H 1 30 ASN QB . . 3.410 2.184 2.048 2.642 . 0 0 "[ . 1 . 2]" 1 668 1 30 ASN H 1 30 ASN QD . . 5.040 3.657 2.529 4.408 . 0 0 "[ . 1 . 2]" 1 669 1 30 ASN H 1 31 HIS HE1 . . 5.270 4.664 4.432 4.923 . 0 0 "[ . 1 . 2]" 1 670 1 30 ASN HA 1 32 LEU H . . 4.410 3.630 3.370 3.823 . 0 0 "[ . 1 . 2]" 1 671 1 30 ASN HA 1 32 LEU MD1 . . 4.950 3.975 3.765 4.120 . 0 0 "[ . 1 . 2]" 1 672 1 30 ASN HA 1 37 ARG QD . . 3.800 3.395 2.920 3.649 . 0 0 "[ . 1 . 2]" 1 673 1 30 ASN HA 1 37 ARG HE . . 4.210 2.821 2.377 3.483 . 0 0 "[ . 1 . 2]" 1 674 1 30 ASN HA 1 37 ARG QG . . 5.190 3.659 3.322 3.984 . 0 0 "[ . 1 . 2]" 1 675 1 30 ASN QB 1 31 HIS HA . . 4.770 4.098 3.920 4.652 . 0 0 "[ . 1 . 2]" 1 676 1 31 HIS HB2 1 31 HIS HD2 . . 3.620 2.778 2.734 2.846 . 0 0 "[ . 1 . 2]" 1 677 1 31 HIS HB2 1 32 LEU H . . 5.090 4.118 4.024 4.306 . 0 0 "[ . 1 . 2]" 1 678 1 31 HIS HB2 1 32 LEU HA . . 5.060 4.755 4.663 4.882 . 0 0 "[ . 1 . 2]" 1 679 1 31 HIS HB3 1 32 LEU H . . 5.210 4.292 4.173 4.422 . 0 0 "[ . 1 . 2]" 1 680 1 31 HIS HD2 1 32 LEU H . . 5.500 4.115 3.905 4.516 . 0 0 "[ . 1 . 2]" 1 681 1 31 HIS HD2 1 32 LEU MD1 . . 4.850 4.379 4.138 4.680 . 0 0 "[ . 1 . 2]" 1 682 1 31 HIS HD2 1 32 LEU MD2 . . 3.410 2.708 2.509 3.150 . 0 0 "[ . 1 . 2]" 1 683 1 31 HIS HD2 1 32 LEU HG . . 4.420 2.839 2.528 3.150 . 0 0 "[ . 1 . 2]" 1 684 1 31 HIS HE1 1 32 LEU MD1 . . 3.920 3.560 3.202 3.884 . 0 0 "[ . 1 . 2]" 1 685 1 31 HIS HE1 1 32 LEU MD2 . . 4.770 3.502 3.230 3.766 . 0 0 "[ . 1 . 2]" 1 686 1 31 HIS HE1 1 32 LEU HG . . 4.620 3.771 3.454 4.019 . 0 0 "[ . 1 . 2]" 1 687 1 32 LEU H 1 32 LEU QB . . 3.570 3.096 3.044 3.192 . 0 0 "[ . 1 . 2]" 1 688 1 32 LEU H 1 32 LEU MD1 . . 3.620 2.291 2.103 2.435 . 0 0 "[ . 1 . 2]" 1 689 1 32 LEU H 1 32 LEU MD2 . . 4.040 3.713 3.636 3.858 . 0 0 "[ . 1 . 2]" 1 690 1 32 LEU H 1 32 LEU HG . . 4.620 2.040 1.935 2.211 . 0 0 "[ . 1 . 2]" 1 691 1 32 LEU H 1 33 PRO HD2 . . 5.500 4.857 4.807 4.918 . 0 0 "[ . 1 . 2]" 1 692 1 32 LEU H 1 33 PRO HD3 . . 5.150 4.810 4.780 4.823 . 0 0 "[ . 1 . 2]" 1 693 1 32 LEU H 1 36 GLU HB3 . . 5.160 5.334 5.151 5.456 0.296 8 0 "[ . 1 . 2]" 1 694 1 32 LEU H 1 37 ARG HE . . 4.470 3.716 3.329 4.430 . 0 0 "[ . 1 . 2]" 1 695 1 32 LEU H 1 37 ARG QG . . 5.040 3.703 3.526 3.862 . 0 0 "[ . 1 . 2]" 1 696 1 32 LEU HA 1 32 LEU MD1 . . 3.830 3.693 3.591 3.734 . 0 0 "[ . 1 . 2]" 1 697 1 32 LEU HA 1 33 PRO HD2 . . 3.250 2.951 2.848 3.012 . 0 0 "[ . 1 . 2]" 1 698 1 32 LEU HA 1 33 PRO HD3 . . 3.060 2.149 2.074 2.198 . 0 0 "[ . 1 . 2]" 1 699 1 32 LEU HA 1 33 PRO QG . . 4.150 4.073 4.010 4.113 . 0 0 "[ . 1 . 2]" 1 700 1 32 LEU HA 1 36 GLU HB2 . . 5.060 4.323 4.130 4.409 . 0 0 "[ . 1 . 2]" 1 701 1 32 LEU QB 1 32 LEU MD1 . . 3.200 2.201 2.106 2.319 . 0 0 "[ . 1 . 2]" 1 702 1 32 LEU QB 1 33 PRO HD2 . . 3.890 1.905 1.868 1.955 . 0 0 "[ . 1 . 2]" 1 703 1 32 LEU QB 1 33 PRO HD3 . . 4.210 2.699 2.606 2.831 . 0 0 "[ . 1 . 2]" 1 704 1 32 LEU QB 1 36 GLU HB2 . . 4.040 1.949 1.894 1.994 . 0 0 "[ . 1 . 2]" 1 705 1 32 LEU QB 1 36 GLU HB3 . . 3.910 2.290 2.125 2.408 . 0 0 "[ . 1 . 2]" 1 706 1 32 LEU QB 1 36 GLU HG3 . . 4.850 3.272 2.817 3.536 . 0 0 "[ . 1 . 2]" 1 707 1 32 LEU QB 1 37 ARG H . . 4.560 3.615 3.355 3.961 . 0 0 "[ . 1 . 2]" 1 708 1 32 LEU QB 1 37 ARG HA . . 4.620 4.496 4.417 4.578 . 0 0 "[ . 1 . 2]" 1 709 1 32 LEU QB 1 37 ARG HE . . 5.190 4.681 4.324 4.956 . 0 0 "[ . 1 . 2]" 1 710 1 32 LEU QB 1 37 ARG QG . . 4.450 3.878 3.593 4.111 . 0 0 "[ . 1 . 2]" 1 711 1 32 LEU MD1 1 33 PRO HD2 . . 3.700 3.764 3.652 3.795 0.095 14 0 "[ . 1 . 2]" 1 712 1 32 LEU MD1 1 33 PRO HD3 . . 4.850 4.563 4.411 4.606 . 0 0 "[ . 1 . 2]" 1 713 1 32 LEU MD1 1 36 GLU H . . 4.950 4.316 3.882 4.574 . 0 0 "[ . 1 . 2]" 1 714 1 32 LEU MD1 1 36 GLU HA . . 4.850 4.429 4.200 4.666 . 0 0 "[ . 1 . 2]" 1 715 1 32 LEU MD1 1 36 GLU HB2 . . 3.740 3.021 2.766 3.145 . 0 0 "[ . 1 . 2]" 1 716 1 32 LEU MD1 1 36 GLU HB3 . . 3.540 2.571 2.313 2.807 . 0 0 "[ . 1 . 2]" 1 717 1 32 LEU MD1 1 36 GLU HG3 . . 4.850 4.742 4.425 4.874 0.024 18 0 "[ . 1 . 2]" 1 718 1 32 LEU MD1 1 37 ARG H . . 4.350 2.769 2.422 3.112 . 0 0 "[ . 1 . 2]" 1 719 1 32 LEU MD1 1 37 ARG HA . . 3.340 2.263 1.943 2.524 . 0 0 "[ . 1 . 2]" 1 720 1 32 LEU MD1 1 37 ARG HE . . 5.500 3.154 2.739 3.722 . 0 0 "[ . 1 . 2]" 1 721 1 32 LEU MD1 1 37 ARG QG . . 3.610 1.984 1.761 2.325 . 0 0 "[ . 1 . 2]" 1 722 1 32 LEU MD1 1 40 GLU H . . 5.190 4.327 3.656 4.605 . 0 0 "[ . 1 . 2]" 1 723 1 32 LEU MD1 1 40 GLU HG2 . . 3.970 3.242 2.589 4.805 0.835 1 1 "[+ . 1 . 2]" 1 724 1 32 LEU MD2 1 36 GLU HB2 . . 3.600 3.438 3.175 3.662 0.062 9 0 "[ . 1 . 2]" 1 725 1 32 LEU MD2 1 36 GLU HB3 . . 3.650 2.298 2.051 2.702 . 0 0 "[ . 1 . 2]" 1 726 1 32 LEU MD2 1 36 GLU HG2 . . 4.510 4.319 3.951 4.586 0.076 4 0 "[ . 1 . 2]" 1 727 1 32 LEU MD2 1 36 GLU HG3 . . 4.510 4.094 3.699 4.516 0.006 19 0 "[ . 1 . 2]" 1 728 1 32 LEU MD2 1 37 ARG H . . 4.950 4.579 4.024 4.990 0.040 18 0 "[ . 1 . 2]" 1 729 1 32 LEU MD2 1 37 ARG HA . . 4.690 4.097 3.491 4.362 . 0 0 "[ . 1 . 2]" 1 730 1 32 LEU MD2 1 40 GLU HG2 . . 3.700 2.617 2.175 4.306 0.606 1 1 "[+ . 1 . 2]" 1 731 1 32 LEU HG 1 36 GLU HB3 . . 4.950 4.366 4.216 4.558 . 0 0 "[ . 1 . 2]" 1 732 1 33 PRO HA 1 34 LEU H . . 3.110 2.359 2.281 2.451 . 0 0 "[ . 1 . 2]" 1 733 1 33 PRO HA 1 34 LEU HA . . 4.850 4.197 4.195 4.202 . 0 0 "[ . 1 . 2]" 1 734 1 33 PRO HA 1 34 LEU HB2 . . 4.850 4.519 4.436 4.604 . 0 0 "[ . 1 . 2]" 1 735 1 33 PRO HA 1 35 LYS H . . 4.950 4.573 4.465 4.727 . 0 0 "[ . 1 . 2]" 1 736 1 33 PRO HB2 1 34 LEU H . . 4.040 2.911 2.675 3.132 . 0 0 "[ . 1 . 2]" 1 737 1 33 PRO HB2 1 35 LYS H . . 4.850 2.962 2.901 3.123 . 0 0 "[ . 1 . 2]" 1 738 1 33 PRO HB2 1 36 GLU H . . 4.950 3.493 3.248 3.757 . 0 0 "[ . 1 . 2]" 1 739 1 33 PRO HB3 1 34 LEU H . . 3.960 3.503 3.380 3.628 . 0 0 "[ . 1 . 2]" 1 740 1 33 PRO HD2 1 36 GLU H . . 4.950 3.497 3.315 3.679 . 0 0 "[ . 1 . 2]" 1 741 1 33 PRO HD2 1 36 GLU HB2 . . 4.060 1.980 1.942 2.026 . 0 0 "[ . 1 . 2]" 1 742 1 33 PRO HD2 1 36 GLU HB3 . . 4.010 3.243 3.077 3.432 . 0 0 "[ . 1 . 2]" 1 743 1 33 PRO HD2 1 36 GLU HG2 . . 4.850 3.907 3.314 4.242 . 0 0 "[ . 1 . 2]" 1 744 1 33 PRO HD2 1 36 GLU HG3 . . 4.250 2.459 1.990 2.814 . 0 0 "[ . 1 . 2]" 1 745 1 33 PRO HD2 1 37 ARG H . . 5.500 4.330 4.102 4.590 . 0 0 "[ . 1 . 2]" 1 746 1 33 PRO QG 1 35 LYS H . . 4.420 4.214 4.072 4.391 . 0 0 "[ . 1 . 2]" 1 747 1 33 PRO QG 1 35 LYS HG2 . . 4.850 4.642 3.608 4.871 0.021 11 0 "[ . 1 . 2]" 1 748 1 33 PRO QG 1 36 GLU H . . 4.410 3.086 2.873 3.340 . 0 0 "[ . 1 . 2]" 1 749 1 33 PRO QG 1 36 GLU HG3 . . 3.200 2.755 2.123 3.206 0.006 3 0 "[ . 1 . 2]" 1 750 1 34 LEU H 1 34 LEU HB2 . . 3.480 2.282 2.218 2.391 . 0 0 "[ . 1 . 2]" 1 751 1 34 LEU H 1 34 LEU HB3 . . 3.210 2.618 2.498 2.691 . 0 0 "[ . 1 . 2]" 1 752 1 34 LEU H 1 34 LEU QD . . 4.120 3.543 3.478 3.618 . 0 0 "[ . 1 . 2]" 1 753 1 34 LEU H 1 35 LYS H . . 4.170 3.044 2.917 3.110 . 0 0 "[ . 1 . 2]" 1 754 1 34 LEU H 1 36 GLU H . . 5.420 4.434 3.956 4.990 . 0 0 "[ . 1 . 2]" 1 755 1 34 LEU H 1 37 ARG H . . 4.950 4.489 4.235 4.718 . 0 0 "[ . 1 . 2]" 1 756 1 34 LEU H 1 37 ARG HE . . 5.270 4.172 3.163 4.794 . 0 0 "[ . 1 . 2]" 1 757 1 34 LEU H 1 37 ARG QG . . 5.420 4.361 3.295 5.236 . 0 0 "[ . 1 . 2]" 1 758 1 34 LEU HA 1 34 LEU QD . . 3.120 2.113 1.981 2.462 . 0 0 "[ . 1 . 2]" 1 759 1 34 LEU HA 1 34 LEU HG . . 3.970 3.619 2.632 3.796 . 0 0 "[ . 1 . 2]" 1 760 1 34 LEU HA 1 36 GLU H . . 5.060 4.286 3.695 4.976 . 0 0 "[ . 1 . 2]" 1 761 1 34 LEU HA 1 37 ARG H . . 4.360 3.083 2.659 3.457 . 0 0 "[ . 1 . 2]" 1 762 1 34 LEU HA 1 37 ARG QB . . 3.450 1.958 1.925 2.039 . 0 0 "[ . 1 . 2]" 1 763 1 34 LEU HA 1 37 ARG QD . . 4.280 2.521 2.225 2.828 . 0 0 "[ . 1 . 2]" 1 764 1 34 LEU HA 1 37 ARG HE . . 5.060 3.667 2.693 4.274 . 0 0 "[ . 1 . 2]" 1 765 1 34 LEU HA 1 37 ARG QG . . 4.090 2.938 1.987 3.718 . 0 0 "[ . 1 . 2]" 1 766 1 34 LEU HA 1 38 MET H . . 4.850 3.621 3.213 3.861 . 0 0 "[ . 1 . 2]" 1 767 1 34 LEU HB2 1 34 LEU QD . . 3.120 2.244 2.127 2.434 . 0 0 "[ . 1 . 2]" 1 768 1 34 LEU HB2 1 35 LYS H . . 3.710 3.744 3.705 3.786 0.076 8 0 "[ . 1 . 2]" 1 769 1 34 LEU HB3 1 35 LYS H . . 3.830 2.377 2.318 2.409 . 0 0 "[ . 1 . 2]" 1 770 1 34 LEU HB3 1 35 LYS HA . . 4.450 4.151 4.091 4.270 . 0 0 "[ . 1 . 2]" 1 771 1 34 LEU QD 1 35 LYS H . . 4.470 2.990 2.568 3.678 . 0 0 "[ . 1 . 2]" 1 772 1 34 LEU QD 1 35 LYS HA . . 4.620 2.850 2.488 4.069 . 0 0 "[ . 1 . 2]" 1 773 1 34 LEU QD 1 37 ARG H . . 4.950 3.919 3.575 4.443 . 0 0 "[ . 1 . 2]" 1 774 1 34 LEU QD 1 37 ARG QB . . 3.750 2.455 1.966 2.782 . 0 0 "[ . 1 . 2]" 1 775 1 34 LEU QD 1 37 ARG QD . . 3.930 2.363 1.962 2.663 . 0 0 "[ . 1 . 2]" 1 776 1 34 LEU QD 1 38 MET H . . 4.560 2.631 2.269 3.780 . 0 0 "[ . 1 . 2]" 1 777 1 34 LEU QD 1 38 MET ME . . 3.590 3.128 2.862 3.424 . 0 0 "[ . 1 . 2]" 1 778 1 34 LEU QD 1 38 MET QG . . 3.770 1.894 1.691 2.589 . 0 0 "[ . 1 . 2]" 1 779 1 34 LEU HG 1 35 LYS H . . 4.410 4.355 3.876 4.462 0.052 8 0 "[ . 1 . 2]" 1 780 1 34 LEU HG 1 38 MET H . . 5.500 5.133 3.002 5.574 0.074 13 0 "[ . 1 . 2]" 1 781 1 34 LEU HG 1 38 MET QG . . 4.360 3.738 1.954 4.184 . 0 0 "[ . 1 . 2]" 1 782 1 35 LYS H 1 35 LYS HB2 . . 3.400 2.487 2.383 2.795 . 0 0 "[ . 1 . 2]" 1 783 1 35 LYS H 1 35 LYS HB3 . . 3.320 2.486 2.226 2.579 . 0 0 "[ . 1 . 2]" 1 784 1 35 LYS H 1 35 LYS QD . . 4.690 4.187 4.043 4.515 . 0 0 "[ . 1 . 2]" 1 785 1 35 LYS H 1 35 LYS HG2 . . 4.770 4.554 4.230 4.613 . 0 0 "[ . 1 . 2]" 1 786 1 35 LYS H 1 35 LYS HG3 . . 4.560 4.394 4.368 4.493 . 0 0 "[ . 1 . 2]" 1 787 1 35 LYS H 1 36 GLU H . . 3.720 3.080 2.872 3.342 . 0 0 "[ . 1 . 2]" 1 788 1 35 LYS H 1 37 ARG H . . 4.430 4.360 4.135 4.483 0.053 12 0 "[ . 1 . 2]" 1 789 1 35 LYS H 1 38 MET H . . 5.500 5.050 4.896 5.289 . 0 0 "[ . 1 . 2]" 1 790 1 35 LYS HA 1 35 LYS QD . . 4.320 2.742 2.220 4.152 . 0 0 "[ . 1 . 2]" 1 791 1 35 LYS HA 1 35 LYS HG2 . . 4.150 3.742 3.002 3.861 . 0 0 "[ . 1 . 2]" 1 792 1 35 LYS HA 1 35 LYS HG3 . . 4.040 2.890 2.723 3.144 . 0 0 "[ . 1 . 2]" 1 793 1 35 LYS HA 1 37 ARG H . . 5.150 4.824 4.626 4.993 . 0 0 "[ . 1 . 2]" 1 794 1 35 LYS HA 1 38 MET H . . 4.670 4.225 3.961 4.564 . 0 0 "[ . 1 . 2]" 1 795 1 35 LYS HA 1 38 MET HB2 . . 4.320 3.605 3.315 3.885 . 0 0 "[ . 1 . 2]" 1 796 1 35 LYS HA 1 38 MET HB3 . . 5.360 5.188 4.920 5.429 0.069 6 0 "[ . 1 . 2]" 1 797 1 35 LYS HA 1 38 MET QG . . 4.360 3.874 3.334 4.372 0.012 18 0 "[ . 1 . 2]" 1 798 1 35 LYS HA 1 39 VAL H . . 5.340 4.627 4.376 5.365 0.025 17 0 "[ . 1 . 2]" 1 799 1 35 LYS HA 1 39 VAL QG . . 5.060 4.159 3.866 4.317 . 0 0 "[ . 1 . 2]" 1 800 1 35 LYS HB2 1 36 GLU H . . 4.260 3.992 3.701 4.234 . 0 0 "[ . 1 . 2]" 1 801 1 35 LYS HB3 1 35 LYS QE . . 4.950 4.113 3.235 4.437 . 0 0 "[ . 1 . 2]" 1 802 1 35 LYS HB3 1 36 GLU H . . 3.720 2.687 2.195 3.088 . 0 0 "[ . 1 . 2]" 1 803 1 35 LYS HB3 1 36 GLU HG2 . . 4.850 4.518 3.709 4.869 0.019 5 0 "[ . 1 . 2]" 1 804 1 35 LYS HB3 1 36 GLU HG3 . . 4.850 4.342 3.969 4.881 0.031 17 0 "[ . 1 . 2]" 1 805 1 35 LYS HB3 1 39 VAL QG . . 5.410 4.875 4.687 5.165 . 0 0 "[ . 1 . 2]" 1 806 1 35 LYS QD 1 35 LYS HG3 . . 2.500 2.364 2.182 2.570 0.070 18 0 "[ . 1 . 2]" 1 807 1 35 LYS QD 1 39 VAL QG . . 4.620 4.337 3.741 4.538 . 0 0 "[ . 1 . 2]" 1 808 1 35 LYS QE 1 35 LYS HG2 . . 3.260 2.509 1.986 3.279 0.019 10 0 "[ . 1 . 2]" 1 809 1 35 LYS QE 1 39 VAL QG . . 4.850 4.122 2.848 4.695 . 0 0 "[ . 1 . 2]" 1 810 1 35 LYS HG2 1 36 GLU H . . 5.060 4.136 2.811 4.915 . 0 0 "[ . 1 . 2]" 1 811 1 35 LYS HG2 1 36 GLU HA . . 5.350 4.628 3.097 5.288 . 0 0 "[ . 1 . 2]" 1 812 1 35 LYS HG2 1 36 GLU HG3 . . 5.060 4.827 3.603 5.804 0.744 17 3 "[ *. 1 - + 2]" 1 813 1 35 LYS HG3 1 39 VAL QG . . 4.450 3.464 3.079 4.358 . 0 0 "[ . 1 . 2]" 1 814 1 36 GLU H 1 36 GLU HB2 . . 3.680 2.209 2.157 2.267 . 0 0 "[ . 1 . 2]" 1 815 1 36 GLU H 1 36 GLU HB3 . . 3.220 3.483 3.453 3.519 0.299 18 0 "[ . 1 . 2]" 1 816 1 36 GLU H 1 36 GLU HG2 . . 3.990 3.365 3.150 3.593 . 0 0 "[ . 1 . 2]" 1 817 1 36 GLU H 1 36 GLU HG3 . . 3.890 3.214 2.729 3.888 . 0 0 "[ . 1 . 2]" 1 818 1 36 GLU H 1 37 ARG H . . 3.440 2.580 2.174 2.926 . 0 0 "[ . 1 . 2]" 1 819 1 36 GLU H 1 37 ARG QB . . 5.350 4.337 4.037 4.538 . 0 0 "[ . 1 . 2]" 1 820 1 36 GLU H 1 38 MET H . . 5.040 4.533 4.084 4.905 . 0 0 "[ . 1 . 2]" 1 821 1 36 GLU H 1 39 VAL H . . 5.270 5.172 4.748 5.301 0.031 20 0 "[ . 1 . 2]" 1 822 1 36 GLU H 1 39 VAL QG . . 4.990 3.754 3.697 3.836 . 0 0 "[ . 1 . 2]" 1 823 1 36 GLU HA 1 36 GLU HG2 . . 3.590 2.122 2.027 2.445 . 0 0 "[ . 1 . 2]" 1 824 1 36 GLU HA 1 36 GLU HG3 . . 3.540 3.314 3.064 3.614 0.074 4 0 "[ . 1 . 2]" 1 825 1 36 GLU HA 1 38 MET H . . 5.270 4.774 4.575 5.120 . 0 0 "[ . 1 . 2]" 1 826 1 36 GLU HA 1 39 VAL H . . 3.930 3.762 3.390 4.027 0.097 18 0 "[ . 1 . 2]" 1 827 1 36 GLU HA 1 39 VAL QG . . 3.460 1.824 1.795 1.896 . 0 0 "[ . 1 . 2]" 1 828 1 36 GLU HA 1 40 GLU H . . 4.540 3.690 3.569 4.163 . 0 0 "[ . 1 . 2]" 1 829 1 36 GLU HB2 1 37 ARG H . . 4.040 2.741 2.629 2.937 . 0 0 "[ . 1 . 2]" 1 830 1 36 GLU HB3 1 37 ARG H . . 3.300 3.275 3.078 3.609 0.309 18 0 "[ . 1 . 2]" 1 831 1 36 GLU HB3 1 39 VAL QG . . 4.510 3.525 3.376 3.920 . 0 0 "[ . 1 . 2]" 1 832 1 36 GLU HG2 1 37 ARG H . . 5.060 4.862 4.734 4.936 . 0 0 "[ . 1 . 2]" 1 833 1 36 GLU HG2 1 39 VAL QG . . 4.850 3.088 2.910 3.653 . 0 0 "[ . 1 . 2]" 1 834 1 36 GLU HG3 1 37 ARG H . . 5.210 4.844 4.707 5.117 . 0 0 "[ . 1 . 2]" 1 835 1 36 GLU HG3 1 39 VAL QG . . 4.510 4.312 4.133 4.711 0.201 17 0 "[ . 1 . 2]" 1 836 1 37 ARG H 1 37 ARG QB . . 3.580 2.316 2.107 2.517 . 0 0 "[ . 1 . 2]" 1 837 1 37 ARG H 1 37 ARG QD . . 5.190 4.059 3.911 4.212 . 0 0 "[ . 1 . 2]" 1 838 1 37 ARG H 1 37 ARG QG . . 3.840 2.482 2.007 2.989 . 0 0 "[ . 1 . 2]" 1 839 1 37 ARG H 1 38 MET H . . 3.750 3.147 2.898 3.246 . 0 0 "[ . 1 . 2]" 1 840 1 37 ARG H 1 38 MET QG . . 5.210 4.891 4.102 5.215 0.005 8 0 "[ . 1 . 2]" 1 841 1 37 ARG H 1 39 VAL H . . 5.150 4.763 3.870 4.969 . 0 0 "[ . 1 . 2]" 1 842 1 37 ARG HA 1 37 ARG QG . . 3.930 2.254 2.190 2.357 . 0 0 "[ . 1 . 2]" 1 843 1 37 ARG HA 1 40 GLU H . . 4.360 3.736 3.326 3.998 . 0 0 "[ . 1 . 2]" 1 844 1 37 ARG HA 1 40 GLU HB2 . . 4.210 3.041 2.887 3.417 . 0 0 "[ . 1 . 2]" 1 845 1 37 ARG HA 1 40 GLU HB3 . . 4.090 3.023 2.731 3.551 . 0 0 "[ . 1 . 2]" 1 846 1 37 ARG HA 1 40 GLU HG2 . . 4.950 4.485 4.205 5.481 0.531 1 1 "[+ . 1 . 2]" 1 847 1 37 ARG HA 1 41 ILE H . . 4.790 4.045 3.791 4.234 . 0 0 "[ . 1 . 2]" 1 848 1 37 ARG HA 1 41 ILE MD . . 4.620 3.612 3.458 3.790 . 0 0 "[ . 1 . 2]" 1 849 1 37 ARG HA 1 41 ILE HG13 . . 5.350 3.700 3.421 3.944 . 0 0 "[ . 1 . 2]" 1 850 1 37 ARG QB 1 37 ARG HE . . 4.410 3.587 3.197 4.006 . 0 0 "[ . 1 . 2]" 1 851 1 37 ARG QB 1 38 MET H . . 3.890 2.249 1.973 2.349 . 0 0 "[ . 1 . 2]" 1 852 1 37 ARG QB 1 38 MET QG . . 4.690 3.237 3.076 3.446 . 0 0 "[ . 1 . 2]" 1 853 1 37 ARG QB 1 41 ILE MD . . 3.780 2.380 2.213 2.667 . 0 0 "[ . 1 . 2]" 1 854 1 37 ARG QD 1 41 ILE MD . . 5.190 3.839 3.209 4.180 . 0 0 "[ . 1 . 2]" 1 855 1 37 ARG QG 1 38 MET H . . 4.990 4.093 3.784 4.251 . 0 0 "[ . 1 . 2]" 1 856 1 38 MET H 1 38 MET HB2 . . 3.650 2.383 2.171 2.683 . 0 0 "[ . 1 . 2]" 1 857 1 38 MET H 1 38 MET HB3 . . 3.930 3.512 3.455 3.536 . 0 0 "[ . 1 . 2]" 1 858 1 38 MET H 1 38 MET ME . . 4.620 3.780 3.315 4.185 . 0 0 "[ . 1 . 2]" 1 859 1 38 MET H 1 38 MET QG . . 3.430 2.253 1.886 2.638 . 0 0 "[ . 1 . 2]" 1 860 1 38 MET H 1 39 VAL H . . 3.620 3.135 2.762 3.223 . 0 0 "[ . 1 . 2]" 1 861 1 38 MET H 1 39 VAL QG . . 4.560 3.717 3.416 3.798 . 0 0 "[ . 1 . 2]" 1 862 1 38 MET H 1 40 GLU H . . 4.870 4.358 4.211 4.802 . 0 0 "[ . 1 . 2]" 1 863 1 38 MET H 1 41 ILE H . . 5.500 4.580 4.448 4.916 . 0 0 "[ . 1 . 2]" 1 864 1 38 MET H 1 41 ILE MD . . 4.760 3.181 2.806 3.505 . 0 0 "[ . 1 . 2]" 1 865 1 38 MET HA 1 38 MET ME . . 3.560 2.089 1.973 2.511 . 0 0 "[ . 1 . 2]" 1 866 1 38 MET HA 1 38 MET QG . . 3.990 2.538 2.308 3.182 . 0 0 "[ . 1 . 2]" 1 867 1 38 MET HA 1 41 ILE H . . 3.990 3.426 3.290 3.830 . 0 0 "[ . 1 . 2]" 1 868 1 38 MET HA 1 41 ILE MD . . 3.660 1.950 1.833 2.136 . 0 0 "[ . 1 . 2]" 1 869 1 38 MET HA 1 41 ILE HG12 . . 5.190 4.550 4.364 4.884 . 0 0 "[ . 1 . 2]" 1 870 1 38 MET HA 1 41 ILE MG . . 4.560 3.953 3.559 4.112 . 0 0 "[ . 1 . 2]" 1 871 1 38 MET HA 1 42 GLY H . . 4.260 4.087 3.830 4.196 . 0 0 "[ . 1 . 2]" 1 872 1 38 MET HB2 1 39 VAL H . . 4.060 2.297 1.965 3.319 . 0 0 "[ . 1 . 2]" 1 873 1 38 MET HB2 1 41 ILE MD . . 5.060 4.400 4.251 4.671 . 0 0 "[ . 1 . 2]" 1 874 1 38 MET ME 1 38 MET QG . . 3.580 2.170 2.035 2.391 . 0 0 "[ . 1 . 2]" 1 875 1 38 MET ME 1 39 VAL H . . 5.060 4.982 4.646 5.062 0.002 9 0 "[ . 1 . 2]" 1 876 1 38 MET ME 1 41 ILE H . . 5.060 4.736 4.558 5.071 0.011 4 0 "[ . 1 . 2]" 1 877 1 38 MET ME 1 41 ILE MD . . 3.380 2.102 1.837 2.753 . 0 0 "[ . 1 . 2]" 1 878 1 38 MET ME 1 41 ILE MG . . 3.830 3.350 2.949 3.841 0.011 19 0 "[ . 1 . 2]" 1 879 1 38 MET QG 1 39 VAL H . . 4.700 4.014 3.636 4.536 . 0 0 "[ . 1 . 2]" 1 880 1 38 MET QG 1 39 VAL QG . . 4.950 4.648 4.023 4.799 . 0 0 "[ . 1 . 2]" 1 881 1 38 MET QG 1 41 ILE MD . . 5.060 3.257 3.042 4.022 . 0 0 "[ . 1 . 2]" 1 882 1 39 VAL H 1 39 VAL HB . . 3.080 2.520 2.463 2.746 . 0 0 "[ . 1 . 2]" 1 883 1 39 VAL H 1 39 VAL QG . . 3.060 1.864 1.815 1.888 . 0 0 "[ . 1 . 2]" 1 884 1 39 VAL H 1 40 GLU H . . 3.530 2.892 2.428 3.144 . 0 0 "[ . 1 . 2]" 1 885 1 39 VAL H 1 41 ILE H . . 4.990 4.121 3.552 4.296 . 0 0 "[ . 1 . 2]" 1 886 1 39 VAL H 1 41 ILE HB . . 5.210 5.056 4.702 5.200 . 0 0 "[ . 1 . 2]" 1 887 1 39 VAL H 1 41 ILE MD . . 5.150 4.662 4.240 4.801 . 0 0 "[ . 1 . 2]" 1 888 1 39 VAL H 1 42 GLY H . . 5.500 4.809 4.632 4.924 . 0 0 "[ . 1 . 2]" 1 889 1 39 VAL HA 1 39 VAL QG . . 3.030 2.343 2.089 2.414 . 0 0 "[ . 1 . 2]" 1 890 1 39 VAL HA 1 40 GLU HA . . 4.850 4.789 4.759 4.807 . 0 0 "[ . 1 . 2]" 1 891 1 39 VAL HA 1 41 ILE H . . 5.350 4.297 4.159 4.467 . 0 0 "[ . 1 . 2]" 1 892 1 39 VAL HA 1 41 ILE HB . . 4.950 5.029 4.956 5.127 0.177 18 0 "[ . 1 . 2]" 1 893 1 39 VAL HA 1 42 GLY H . . 4.410 3.506 3.401 3.621 . 0 0 "[ . 1 . 2]" 1 894 1 39 VAL HA 1 42 GLY HA3 . . 4.360 3.868 3.778 4.043 . 0 0 "[ . 1 . 2]" 1 895 1 39 VAL HA 1 43 SER H . . 4.760 4.592 4.162 4.786 0.026 19 0 "[ . 1 . 2]" 1 896 1 39 VAL QG 1 40 GLU H . . 3.910 2.038 1.799 3.058 . 0 0 "[ . 1 . 2]" 1 897 1 39 VAL QG 1 40 GLU HA . . 4.040 3.192 3.051 3.939 . 0 0 "[ . 1 . 2]" 1 898 1 39 VAL QG 1 43 SER H . . 4.790 4.229 4.018 4.666 . 0 0 "[ . 1 . 2]" 1 899 1 39 VAL QG 1 43 SER QB . . 4.450 3.927 3.558 4.372 . 0 0 "[ . 1 . 2]" 1 900 1 40 GLU H 1 40 GLU HB2 . . 3.440 2.089 2.034 2.213 . 0 0 "[ . 1 . 2]" 1 901 1 40 GLU H 1 40 GLU HB3 . . 3.210 2.975 2.768 3.109 . 0 0 "[ . 1 . 2]" 1 902 1 40 GLU H 1 40 GLU HG2 . . 4.410 4.433 4.208 4.549 0.139 18 0 "[ . 1 . 2]" 1 903 1 40 GLU H 1 40 GLU HG3 . . 4.560 4.474 4.398 4.533 . 0 0 "[ . 1 . 2]" 1 904 1 40 GLU H 1 41 ILE H . . 3.730 2.795 2.683 2.887 . 0 0 "[ . 1 . 2]" 1 905 1 40 GLU H 1 41 ILE HA . . 5.500 5.316 5.227 5.388 . 0 0 "[ . 1 . 2]" 1 906 1 40 GLU H 1 41 ILE HB . . 4.950 4.888 4.740 4.995 0.045 17 0 "[ . 1 . 2]" 1 907 1 40 GLU H 1 41 ILE MD . . 5.060 4.698 4.573 4.913 . 0 0 "[ . 1 . 2]" 1 908 1 40 GLU H 1 42 GLY H . . 5.210 4.586 4.448 4.697 . 0 0 "[ . 1 . 2]" 1 909 1 40 GLU H 1 43 SER H . . 5.270 5.012 4.917 5.074 . 0 0 "[ . 1 . 2]" 1 910 1 40 GLU HA 1 40 GLU HG2 . . 4.060 3.515 2.181 3.622 . 0 0 "[ . 1 . 2]" 1 911 1 40 GLU HA 1 40 GLU HG3 . . 4.280 2.760 2.534 3.389 . 0 0 "[ . 1 . 2]" 1 912 1 40 GLU HA 1 41 ILE HA . . 4.850 4.803 4.760 4.832 . 0 0 "[ . 1 . 2]" 1 913 1 40 GLU HA 1 42 GLY H . . 5.060 4.876 4.690 5.056 . 0 0 "[ . 1 . 2]" 1 914 1 40 GLU HA 1 43 SER H . . 4.180 3.616 3.518 3.697 . 0 0 "[ . 1 . 2]" 1 915 1 40 GLU HA 1 43 SER QB . . 2.850 2.883 2.848 2.915 0.065 15 0 "[ . 1 . 2]" 1 916 1 40 GLU HB2 1 41 ILE H . . 3.720 3.574 3.447 3.763 0.043 1 0 "[ . 1 . 2]" 1 917 1 40 GLU HB2 1 41 ILE HA . . 5.500 5.404 5.290 5.533 0.033 1 0 "[ . 1 . 2]" 1 918 1 40 GLU HB3 1 41 ILE H . . 3.910 2.803 2.667 3.023 . 0 0 "[ . 1 . 2]" 1 919 1 40 GLU HB3 1 41 ILE MD . . 5.150 4.385 4.179 4.697 . 0 0 "[ . 1 . 2]" 1 920 1 40 GLU HB3 1 42 GLY H . . 5.500 5.424 5.305 5.520 0.020 17 0 "[ . 1 . 2]" 1 921 1 40 GLU HG3 1 41 ILE H . . 4.950 4.663 4.361 5.241 0.291 1 0 "[ . 1 . 2]" 1 922 1 40 GLU HG3 1 43 SER QB . . 4.950 4.053 3.629 5.270 0.320 1 0 "[ . 1 . 2]" 1 923 1 40 GLU HG3 1 44 ARG HD2 . . 4.510 4.345 3.809 4.957 0.447 1 0 "[ . 1 . 2]" 1 924 1 41 ILE H 1 41 ILE HB . . 3.200 2.356 2.273 2.442 . 0 0 "[ . 1 . 2]" 1 925 1 41 ILE H 1 41 ILE MD . . 3.450 3.078 2.997 3.172 . 0 0 "[ . 1 . 2]" 1 926 1 41 ILE H 1 41 ILE HG12 . . 4.280 3.653 3.453 3.833 . 0 0 "[ . 1 . 2]" 1 927 1 41 ILE H 1 41 ILE HG13 . . 3.040 2.216 1.981 2.460 . 0 0 "[ . 1 . 2]" 1 928 1 41 ILE H 1 41 ILE MG . . 3.780 3.694 3.671 3.706 . 0 0 "[ . 1 . 2]" 1 929 1 41 ILE H 1 42 GLY H . . 3.840 2.824 2.665 2.899 . 0 0 "[ . 1 . 2]" 1 930 1 41 ILE H 1 42 GLY HA3 . . 5.220 4.935 4.809 5.007 . 0 0 "[ . 1 . 2]" 1 931 1 41 ILE H 1 43 SER H . . 4.560 4.022 3.929 4.160 . 0 0 "[ . 1 . 2]" 1 932 1 41 ILE H 1 44 ARG H . . 4.870 4.853 4.772 4.924 0.054 18 0 "[ . 1 . 2]" 1 933 1 41 ILE HA 1 41 ILE MD . . 3.880 3.845 3.820 3.876 . 0 0 "[ . 1 . 2]" 1 934 1 41 ILE HA 1 41 ILE HG12 . . 3.380 2.763 2.671 2.826 . 0 0 "[ . 1 . 2]" 1 935 1 41 ILE HA 1 41 ILE HG13 . . 3.540 2.629 2.560 2.781 . 0 0 "[ . 1 . 2]" 1 936 1 41 ILE HA 1 41 ILE MG . . 3.160 2.433 2.352 2.512 . 0 0 "[ . 1 . 2]" 1 937 1 41 ILE HA 1 43 SER H . . 5.270 3.954 3.796 4.338 . 0 0 "[ . 1 . 2]" 1 938 1 41 ILE HA 1 44 ARG H . . 4.360 3.170 3.080 3.368 . 0 0 "[ . 1 . 2]" 1 939 1 41 ILE HA 1 44 ARG HB2 . . 4.320 2.727 2.626 2.776 . 0 0 "[ . 1 . 2]" 1 940 1 41 ILE HA 1 44 ARG HB3 . . 4.360 4.383 4.283 4.420 0.060 7 0 "[ . 1 . 2]" 1 941 1 41 ILE HA 1 44 ARG HD2 . . 4.560 4.190 2.037 4.568 0.008 12 0 "[ . 1 . 2]" 1 942 1 41 ILE HA 1 44 ARG HD3 . . 4.280 3.991 2.594 4.262 . 0 0 "[ . 1 . 2]" 1 943 1 41 ILE HA 1 45 TRP H . . 4.830 3.978 3.821 4.193 . 0 0 "[ . 1 . 2]" 1 944 1 41 ILE HB 1 41 ILE MD . . 3.340 2.128 2.017 2.273 . 0 0 "[ . 1 . 2]" 1 945 1 41 ILE HB 1 42 GLY H . . 3.660 2.407 2.320 2.525 . 0 0 "[ . 1 . 2]" 1 946 1 41 ILE HB 1 42 GLY HA2 . . 4.950 4.353 4.275 4.448 . 0 0 "[ . 1 . 2]" 1 947 1 41 ILE HB 1 43 SER H . . 4.950 4.821 4.712 4.962 0.012 18 0 "[ . 1 . 2]" 1 948 1 41 ILE MD 1 41 ILE MG . . 2.850 2.385 2.151 2.483 . 0 0 "[ . 1 . 2]" 1 949 1 41 ILE MD 1 42 GLY H . . 4.610 4.125 4.010 4.305 . 0 0 "[ . 1 . 2]" 1 950 1 41 ILE MG 1 42 GLY H . . 4.010 3.138 3.022 3.209 . 0 0 "[ . 1 . 2]" 1 951 1 41 ILE MG 1 42 GLY HA2 . . 4.210 3.472 3.381 3.573 . 0 0 "[ . 1 . 2]" 1 952 1 41 ILE MG 1 43 SER H . . 5.060 4.603 4.441 4.828 . 0 0 "[ . 1 . 2]" 1 953 1 41 ILE MG 1 44 ARG H . . 5.210 4.285 4.043 4.499 . 0 0 "[ . 1 . 2]" 1 954 1 41 ILE MG 1 44 ARG HD3 . . 4.950 4.837 4.112 4.957 0.007 3 0 "[ . 1 . 2]" 1 955 1 41 ILE MG 1 45 TRP H . . 4.560 3.411 3.234 3.550 . 0 0 "[ . 1 . 2]" 1 956 1 41 ILE MG 1 45 TRP HB2 . . 4.690 3.137 2.952 3.457 . 0 0 "[ . 1 . 2]" 1 957 1 41 ILE MG 1 45 TRP HB3 . . 5.350 3.660 3.431 3.865 . 0 0 "[ . 1 . 2]" 1 958 1 41 ILE MG 1 45 TRP HE3 . . 5.030 4.646 4.384 4.960 . 0 0 "[ . 1 . 2]" 1 959 1 42 GLY H 1 43 SER H . . 3.440 2.963 2.910 2.990 . 0 0 "[ . 1 . 2]" 1 960 1 42 GLY H 1 43 SER QB . . 4.850 4.632 4.562 4.671 . 0 0 "[ . 1 . 2]" 1 961 1 42 GLY H 1 44 ARG H . . 4.990 4.627 4.416 4.729 . 0 0 "[ . 1 . 2]" 1 962 1 42 GLY HA2 1 45 TRP H . . 4.370 3.605 3.476 3.706 . 0 0 "[ . 1 . 2]" 1 963 1 42 GLY HA2 1 45 TRP HB2 . . 5.060 3.845 3.652 4.078 . 0 0 "[ . 1 . 2]" 1 964 1 42 GLY HA2 1 45 TRP HB3 . . 4.690 2.592 2.447 2.741 . 0 0 "[ . 1 . 2]" 1 965 1 42 GLY HA2 1 45 TRP HD1 . . 5.030 4.002 3.786 4.261 . 0 0 "[ . 1 . 2]" 1 966 1 43 SER H 1 43 SER QB . . 2.850 2.061 2.000 2.152 . 0 0 "[ . 1 . 2]" 1 967 1 43 SER H 1 44 ARG H . . 3.440 2.679 2.603 2.816 . 0 0 "[ . 1 . 2]" 1 968 1 43 SER HA 1 45 TRP H . . 5.500 4.366 4.118 4.790 . 0 0 "[ . 1 . 2]" 1 969 1 43 SER HA 1 46 GLN H . . 4.120 3.262 3.128 3.429 . 0 0 "[ . 1 . 2]" 1 970 1 43 SER HA 1 46 GLN HA . . 5.500 5.261 5.096 5.434 . 0 0 "[ . 1 . 2]" 1 971 1 43 SER HA 1 46 GLN QB . . 3.610 2.387 2.174 2.595 . 0 0 "[ . 1 . 2]" 1 972 1 43 SER HA 1 46 GLN HG3 . . 4.410 3.562 3.200 4.143 . 0 0 "[ . 1 . 2]" 1 973 1 43 SER QB 1 44 ARG H . . 3.250 2.422 2.303 2.693 . 0 0 "[ . 1 . 2]" 1 974 1 43 SER QB 1 44 ARG HB2 . . 4.510 4.557 4.502 4.593 0.083 12 0 "[ . 1 . 2]" 1 975 1 43 SER QB 1 44 ARG QG . . 4.410 3.273 3.117 3.940 . 0 0 "[ . 1 . 2]" 1 976 1 44 ARG H 1 44 ARG HB2 . . 3.640 2.440 2.234 2.534 . 0 0 "[ . 1 . 2]" 1 977 1 44 ARG H 1 44 ARG HB3 . . 4.060 3.544 3.496 3.554 . 0 0 "[ . 1 . 2]" 1 978 1 44 ARG H 1 44 ARG HD2 . . 4.610 4.367 1.979 4.653 0.043 13 0 "[ . 1 . 2]" 1 979 1 44 ARG H 1 44 ARG HD3 . . 4.560 4.444 3.651 4.566 0.006 9 0 "[ . 1 . 2]" 1 980 1 44 ARG H 1 44 ARG QG . . 3.500 2.346 2.147 3.158 . 0 0 "[ . 1 . 2]" 1 981 1 44 ARG H 1 45 TRP HA . . 5.310 5.289 5.204 5.339 0.029 6 0 "[ . 1 . 2]" 1 982 1 44 ARG HA 1 44 ARG HD2 . . 4.690 4.630 3.582 4.774 0.084 1 0 "[ . 1 . 2]" 1 983 1 44 ARG HA 1 44 ARG HD3 . . 4.360 4.374 4.276 4.551 0.191 19 0 "[ . 1 . 2]" 1 984 1 44 ARG HA 1 44 ARG QG . . 3.440 2.241 2.102 2.292 . 0 0 "[ . 1 . 2]" 1 985 1 44 ARG HA 1 46 GLN H . . 4.640 4.022 3.909 4.147 . 0 0 "[ . 1 . 2]" 1 986 1 44 ARG HA 1 47 ARG H . . 4.560 3.228 3.005 3.444 . 0 0 "[ . 1 . 2]" 1 987 1 44 ARG HA 1 47 ARG HD2 . . 4.280 2.540 1.992 3.303 . 0 0 "[ . 1 . 2]" 1 988 1 44 ARG HA 1 47 ARG HD3 . . 4.040 2.454 2.008 3.987 . 0 0 "[ . 1 . 2]" 1 989 1 44 ARG HB2 1 44 ARG HD2 . . 4.060 3.567 2.125 3.802 . 0 0 "[ . 1 . 2]" 1 990 1 44 ARG HB2 1 44 ARG HD3 . . 3.890 2.777 2.687 3.112 . 0 0 "[ . 1 . 2]" 1 991 1 44 ARG HB2 1 45 TRP H . . 4.110 2.693 2.490 2.898 . 0 0 "[ . 1 . 2]" 1 992 1 44 ARG HB3 1 44 ARG HD3 . . 3.580 2.506 2.247 3.911 0.331 19 0 "[ . 1 . 2]" 1 993 1 44 ARG HB3 1 45 TRP H . . 4.470 3.663 3.177 3.918 . 0 0 "[ . 1 . 2]" 1 994 1 44 ARG QG 1 47 ARG HD3 . . 4.950 3.241 2.776 4.412 . 0 0 "[ . 1 . 2]" 1 995 1 45 TRP H 1 45 TRP HB2 . . 3.610 2.674 2.592 2.739 . 0 0 "[ . 1 . 2]" 1 996 1 45 TRP H 1 45 TRP HB3 . . 3.580 2.278 2.249 2.331 . 0 0 "[ . 1 . 2]" 1 997 1 45 TRP H 1 45 TRP HD1 . . 4.700 4.708 4.653 4.798 0.098 18 0 "[ . 1 . 2]" 1 998 1 45 TRP H 1 45 TRP HE3 . . 5.500 4.857 4.755 4.925 . 0 0 "[ . 1 . 2]" 1 999 1 45 TRP H 1 46 GLN H . . 3.860 2.532 2.437 2.649 . 0 0 "[ . 1 . 2]" 1 1000 1 45 TRP H 1 46 GLN QB . . 5.060 4.362 4.208 4.500 . 0 0 "[ . 1 . 2]" 1 1001 1 45 TRP H 1 47 ARG H . . 5.340 3.814 3.732 3.906 . 0 0 "[ . 1 . 2]" 1 1002 1 45 TRP HA 1 45 TRP HE3 . . 3.990 2.851 2.731 3.049 . 0 0 "[ . 1 . 2]" 1 1003 1 45 TRP HA 1 48 ILE H . . 4.510 3.545 3.394 3.737 . 0 0 "[ . 1 . 2]" 1 1004 1 45 TRP HA 1 48 ILE MD . . 4.060 2.190 1.969 2.389 . 0 0 "[ . 1 . 2]" 1 1005 1 45 TRP HA 1 48 ILE HG12 . . 4.120 2.221 1.973 2.609 . 0 0 "[ . 1 . 2]" 1 1006 1 45 TRP HA 1 48 ILE MG . . 3.910 3.374 3.096 3.604 . 0 0 "[ . 1 . 2]" 1 1007 1 45 TRP HB2 1 45 TRP HD1 . . 3.920 3.808 3.782 3.846 . 0 0 "[ . 1 . 2]" 1 1008 1 45 TRP HB2 1 46 GLN H . . 4.160 4.193 4.161 4.235 0.075 16 0 "[ . 1 . 2]" 1 1009 1 45 TRP HB2 1 48 ILE MD . . 5.350 3.566 3.240 3.883 . 0 0 "[ . 1 . 2]" 1 1010 1 45 TRP HB3 1 45 TRP HD1 . . 3.610 2.685 2.661 2.730 . 0 0 "[ . 1 . 2]" 1 1011 1 45 TRP HB3 1 45 TRP HE1 . . 5.210 4.936 4.928 4.952 . 0 0 "[ . 1 . 2]" 1 1012 1 45 TRP HB3 1 46 GLN H . . 3.890 3.003 2.956 3.087 . 0 0 "[ . 1 . 2]" 1 1013 1 45 TRP HB3 1 46 GLN QB . . 4.850 4.583 4.439 4.755 . 0 0 "[ . 1 . 2]" 1 1014 1 45 TRP HD1 1 46 GLN H . . 4.320 3.977 3.875 4.060 . 0 0 "[ . 1 . 2]" 1 1015 1 45 TRP HD1 1 46 GLN HA . . 4.120 3.705 3.479 3.867 . 0 0 "[ . 1 . 2]" 1 1016 1 45 TRP HD1 1 46 GLN QB . . 4.850 4.628 4.463 4.779 . 0 0 "[ . 1 . 2]" 1 1017 1 45 TRP HD1 1 46 GLN HG2 . . 4.420 3.032 2.664 3.590 . 0 0 "[ . 1 . 2]" 1 1018 1 45 TRP HD1 1 46 GLN HG3 . . 4.420 3.942 3.200 4.430 0.010 7 0 "[ . 1 . 2]" 1 1019 1 45 TRP HD1 1 53 LYS QE . . 4.230 3.196 2.599 3.604 . 0 0 "[ . 1 . 2]" 1 1020 1 45 TRP HE1 1 46 GLN HA . . 5.210 5.199 5.102 5.238 0.028 18 0 "[ . 1 . 2]" 1 1021 1 45 TRP HE1 1 53 LYS HB3 . . 5.500 4.885 4.300 5.255 . 0 0 "[ . 1 . 2]" 1 1022 1 45 TRP HE1 1 53 LYS QD . . 4.390 3.669 2.389 4.308 . 0 0 "[ . 1 . 2]" 1 1023 1 45 TRP HE1 1 53 LYS QE . . 4.230 2.584 2.080 3.214 . 0 0 "[ . 1 . 2]" 1 1024 1 45 TRP HE1 1 53 LYS HG2 . . 5.500 4.030 3.643 5.952 0.452 10 0 "[ . 1 . 2]" 1 1025 1 45 TRP HE3 1 48 ILE MD . . 4.150 2.203 1.953 2.471 . 0 0 "[ . 1 . 2]" 1 1026 1 45 TRP HE3 1 48 ILE MG . . 4.950 4.334 3.998 4.702 . 0 0 "[ . 1 . 2]" 1 1027 1 45 TRP HH2 1 48 ILE MD . . 5.190 3.947 3.586 4.396 . 0 0 "[ . 1 . 2]" 1 1028 1 45 TRP HH2 1 53 LYS H . . 5.500 4.722 4.600 4.862 . 0 0 "[ . 1 . 2]" 1 1029 1 45 TRP HH2 1 53 LYS HA . . 3.750 2.107 1.993 2.328 . 0 0 "[ . 1 . 2]" 1 1030 1 45 TRP HH2 1 53 LYS HB2 . . 5.380 4.530 4.295 4.772 . 0 0 "[ . 1 . 2]" 1 1031 1 45 TRP HH2 1 53 LYS HB3 . . 4.480 3.209 2.793 3.543 . 0 0 "[ . 1 . 2]" 1 1032 1 45 TRP HH2 1 53 LYS QD . . 5.190 4.508 2.714 5.029 . 0 0 "[ . 1 . 2]" 1 1033 1 45 TRP HH2 1 53 LYS QE . . 5.500 4.684 4.104 5.086 . 0 0 "[ . 1 . 2]" 1 1034 1 45 TRP HH2 1 53 LYS HG2 . . 5.190 3.209 2.799 5.243 0.053 10 0 "[ . 1 . 2]" 1 1035 1 45 TRP HH2 1 53 LYS HG3 . . 5.380 4.412 4.178 4.849 . 0 0 "[ . 1 . 2]" 1 1036 1 45 TRP HH2 1 56 TYR H . . 5.030 4.852 4.464 5.038 0.008 14 0 "[ . 1 . 2]" 1 1037 1 45 TRP HH2 1 56 TYR HB2 . . 4.370 2.825 2.486 3.035 . 0 0 "[ . 1 . 2]" 1 1038 1 45 TRP HH2 1 56 TYR HB3 . . 3.420 3.370 3.126 3.445 0.025 12 0 "[ . 1 . 2]" 1 1039 1 45 TRP HH2 1 56 TYR QD . . 4.800 3.616 3.192 4.170 . 0 0 "[ . 1 . 2]" 1 1040 1 45 TRP HH2 1 57 LYS H . . 5.150 3.807 3.027 4.570 . 0 0 "[ . 1 . 2]" 1 1041 1 45 TRP HZ2 1 53 LYS HA . . 4.700 3.625 3.336 4.033 . 0 0 "[ . 1 . 2]" 1 1042 1 45 TRP HZ2 1 53 LYS HB2 . . 4.700 4.463 4.000 4.707 0.007 15 0 "[ . 1 . 2]" 1 1043 1 45 TRP HZ2 1 53 LYS HB3 . . 4.370 2.842 2.354 3.130 . 0 0 "[ . 1 . 2]" 1 1044 1 45 TRP HZ2 1 53 LYS QD . . 3.920 3.276 2.307 3.862 . 0 0 "[ . 1 . 2]" 1 1045 1 45 TRP HZ2 1 53 LYS QE . . 4.900 3.472 3.015 3.984 . 0 0 "[ . 1 . 2]" 1 1046 1 45 TRP HZ2 1 53 LYS HG2 . . 5.030 2.927 2.587 4.939 . 0 0 "[ . 1 . 2]" 1 1047 1 45 TRP HZ2 1 53 LYS HG3 . . 5.030 4.398 3.743 4.579 . 0 0 "[ . 1 . 2]" 1 1048 1 45 TRP HZ3 1 48 ILE MD . . 4.180 2.923 2.631 3.234 . 0 0 "[ . 1 . 2]" 1 1049 1 45 TRP HZ3 1 53 LYS HA . . 4.770 3.017 2.705 3.378 . 0 0 "[ . 1 . 2]" 1 1050 1 45 TRP HZ3 1 56 TYR HB2 . . 4.950 2.855 2.519 3.096 . 0 0 "[ . 1 . 2]" 1 1051 1 45 TRP HZ3 1 56 TYR HB3 . . 4.800 3.017 2.797 3.294 . 0 0 "[ . 1 . 2]" 1 1052 1 45 TRP HZ3 1 56 TYR QD . . 4.700 2.255 1.978 2.923 . 0 0 "[ . 1 . 2]" 1 1053 1 45 TRP HZ3 1 56 TYR QE . . 4.900 3.886 3.575 4.389 . 0 0 "[ . 1 . 2]" 1 1054 1 46 GLN H 1 46 GLN QB . . 3.140 2.161 2.077 2.266 . 0 0 "[ . 1 . 2]" 1 1055 1 46 GLN H 1 46 GLN HG2 . . 4.030 3.314 2.658 3.760 . 0 0 "[ . 1 . 2]" 1 1056 1 46 GLN H 1 46 GLN HG3 . . 4.040 3.408 2.881 3.694 . 0 0 "[ . 1 . 2]" 1 1057 1 46 GLN H 1 47 ARG H . . 3.750 2.468 2.337 2.558 . 0 0 "[ . 1 . 2]" 1 1058 1 46 GLN H 1 47 ARG HA . . 5.420 4.893 4.824 4.958 . 0 0 "[ . 1 . 2]" 1 1059 1 46 GLN H 1 47 ARG HG3 . . 4.910 4.008 3.575 4.439 . 0 0 "[ . 1 . 2]" 1 1060 1 46 GLN H 1 48 ILE H . . 5.210 4.478 4.252 4.683 . 0 0 "[ . 1 . 2]" 1 1061 1 46 GLN HA 1 46 GLN HG2 . . 3.830 2.175 2.007 2.550 . 0 0 "[ . 1 . 2]" 1 1062 1 46 GLN HA 1 46 GLN HG3 . . 4.040 3.406 2.967 3.676 . 0 0 "[ . 1 . 2]" 1 1063 1 46 GLN HA 1 53 LYS QE . . 4.690 3.227 2.632 3.930 . 0 0 "[ . 1 . 2]" 1 1064 1 46 GLN QB 1 47 ARG H . . 3.720 3.329 3.105 3.459 . 0 0 "[ . 1 . 2]" 1 1065 1 46 GLN QB 1 47 ARG HA . . 4.360 4.024 3.949 4.079 . 0 0 "[ . 1 . 2]" 1 1066 1 46 GLN QB 1 47 ARG HG3 . . 3.990 3.717 3.491 3.975 . 0 0 "[ . 1 . 2]" 1 1067 1 46 GLN HG2 1 47 ARG H . . 5.270 4.951 4.690 5.197 . 0 0 "[ . 1 . 2]" 1 1068 1 47 ARG H 1 47 ARG HB2 . . 3.910 2.320 2.175 2.455 . 0 0 "[ . 1 . 2]" 1 1069 1 47 ARG H 1 47 ARG HB3 . . 3.680 3.550 3.464 3.613 . 0 0 "[ . 1 . 2]" 1 1070 1 47 ARG H 1 47 ARG HD2 . . 4.850 4.493 3.946 4.844 . 0 0 "[ . 1 . 2]" 1 1071 1 47 ARG H 1 47 ARG HD3 . . 4.850 4.262 3.862 4.875 0.025 7 0 "[ . 1 . 2]" 1 1072 1 47 ARG H 1 47 ARG HG2 . . 3.970 3.856 3.383 4.008 0.038 19 0 "[ . 1 . 2]" 1 1073 1 47 ARG H 1 47 ARG HG3 . . 3.350 2.711 2.354 2.905 . 0 0 "[ . 1 . 2]" 1 1074 1 47 ARG H 1 48 ILE H . . 3.660 2.404 2.212 2.584 . 0 0 "[ . 1 . 2]" 1 1075 1 47 ARG H 1 48 ILE HA . . 5.090 4.962 4.806 5.120 0.030 19 0 "[ . 1 . 2]" 1 1076 1 47 ARG H 1 48 ILE HG12 . . 5.340 3.282 3.134 3.503 . 0 0 "[ . 1 . 2]" 1 1077 1 47 ARG H 1 48 ILE MG . . 4.620 4.158 3.946 4.420 . 0 0 "[ . 1 . 2]" 1 1078 1 47 ARG HA 1 47 ARG HD3 . . 4.560 4.496 4.147 4.577 0.017 11 0 "[ . 1 . 2]" 1 1079 1 47 ARG HA 1 47 ARG HG2 . . 3.410 2.489 2.190 2.703 . 0 0 "[ . 1 . 2]" 1 1080 1 47 ARG HA 1 47 ARG HG3 . . 3.220 2.832 2.627 3.158 . 0 0 "[ . 1 . 2]" 1 1081 1 47 ARG HB2 1 47 ARG HD3 . . 3.720 2.410 2.145 3.007 . 0 0 "[ . 1 . 2]" 1 1082 1 47 ARG HB2 1 48 ILE H . . 4.770 2.471 2.223 2.688 . 0 0 "[ . 1 . 2]" 1 1083 1 47 ARG HB2 1 48 ILE MG . . 4.690 3.478 3.368 3.692 . 0 0 "[ . 1 . 2]" 1 1084 1 47 ARG HB3 1 47 ARG HD3 . . 4.150 2.703 2.132 2.924 . 0 0 "[ . 1 . 2]" 1 1085 1 47 ARG HB3 1 48 ILE H . . 4.390 3.349 3.066 3.591 . 0 0 "[ . 1 . 2]" 1 1086 1 47 ARG HD3 1 47 ARG HG3 . . 3.030 2.783 2.610 3.059 0.029 7 0 "[ . 1 . 2]" 1 1087 1 47 ARG HG2 1 48 ILE H . . 5.500 4.989 4.855 5.112 . 0 0 "[ . 1 . 2]" 1 1088 1 48 ILE H 1 48 ILE HB . . 4.050 3.533 3.520 3.543 . 0 0 "[ . 1 . 2]" 1 1089 1 48 ILE H 1 48 ILE MD . . 4.410 3.559 3.473 3.622 . 0 0 "[ . 1 . 2]" 1 1090 1 48 ILE H 1 48 ILE HG12 . . 3.590 1.941 1.923 2.009 . 0 0 "[ . 1 . 2]" 1 1091 1 48 ILE H 1 48 ILE HG13 . . 4.850 3.021 2.723 3.233 . 0 0 "[ . 1 . 2]" 1 1092 1 48 ILE H 1 48 ILE MG . . 3.340 2.295 2.171 2.457 . 0 0 "[ . 1 . 2]" 1 1093 1 48 ILE H 1 49 SER H . . 4.870 4.644 4.592 4.675 . 0 0 "[ . 1 . 2]" 1 1094 1 48 ILE HA 1 48 ILE MD . . 4.120 4.120 4.112 4.137 0.017 18 0 "[ . 1 . 2]" 1 1095 1 48 ILE HA 1 48 ILE HG13 . . 4.010 3.739 3.686 3.781 . 0 0 "[ . 1 . 2]" 1 1096 1 48 ILE HA 1 48 ILE MG . . 3.170 2.246 2.072 2.301 . 0 0 "[ . 1 . 2]" 1 1097 1 48 ILE HA 1 49 SER H . . 3.050 2.555 2.427 2.686 . 0 0 "[ . 1 . 2]" 1 1098 1 48 ILE HB 1 48 ILE MD . . 3.480 2.274 2.138 2.389 . 0 0 "[ . 1 . 2]" 1 1099 1 48 ILE HB 1 49 SER H . . 3.480 2.307 2.057 2.575 . 0 0 "[ . 1 . 2]" 1 1100 1 48 ILE HB 1 52 GLN H . . 5.210 3.996 3.844 4.267 . 0 0 "[ . 1 . 2]" 1 1101 1 48 ILE HB 1 52 GLN HB2 . . 3.950 2.086 1.977 2.562 . 0 0 "[ . 1 . 2]" 1 1102 1 48 ILE HB 1 52 GLN HB3 . . 4.040 2.476 1.989 2.817 . 0 0 "[ . 1 . 2]" 1 1103 1 48 ILE HB 1 52 GLN QG . . 4.620 2.592 2.036 3.723 . 0 0 "[ . 1 . 2]" 1 1104 1 48 ILE MD 1 48 ILE MG . . 2.960 2.001 1.879 2.174 . 0 0 "[ . 1 . 2]" 1 1105 1 48 ILE MD 1 49 SER H . . 4.590 4.152 3.711 4.507 . 0 0 "[ . 1 . 2]" 1 1106 1 48 ILE MD 1 52 GLN H . . 5.270 4.560 4.267 4.952 . 0 0 "[ . 1 . 2]" 1 1107 1 48 ILE MD 1 52 GLN HB2 . . 3.610 2.896 2.043 3.414 . 0 0 "[ . 1 . 2]" 1 1108 1 48 ILE MD 1 52 GLN HB3 . . 3.890 1.932 1.784 2.135 . 0 0 "[ . 1 . 2]" 1 1109 1 48 ILE MD 1 52 GLN HE21 . . 5.500 4.634 4.011 5.320 . 0 0 "[ . 1 . 2]" 1 1110 1 48 ILE MD 1 52 GLN QG . . 4.620 2.761 1.903 3.659 . 0 0 "[ . 1 . 2]" 1 1111 1 48 ILE MD 1 53 LYS H . . 4.180 2.924 2.722 3.475 . 0 0 "[ . 1 . 2]" 1 1112 1 48 ILE MD 1 53 LYS HA . . 3.870 3.141 2.878 3.586 . 0 0 "[ . 1 . 2]" 1 1113 1 48 ILE MD 1 53 LYS HB3 . . 4.950 4.366 4.085 4.758 . 0 0 "[ . 1 . 2]" 1 1114 1 48 ILE MD 1 53 LYS QE . . 4.950 2.914 1.941 3.452 . 0 0 "[ . 1 . 2]" 1 1115 1 48 ILE MD 1 53 LYS HG3 . . 4.320 2.404 1.967 4.292 . 0 0 "[ . 1 . 2]" 1 1116 1 48 ILE MD 1 56 TYR QD . . 4.040 2.732 2.533 3.049 . 0 0 "[ . 1 . 2]" 1 1117 1 48 ILE MD 1 56 TYR QE . . 3.570 2.562 2.139 3.140 . 0 0 "[ . 1 . 2]" 1 1118 1 48 ILE HG12 1 48 ILE MG . . 3.470 2.455 2.329 2.529 . 0 0 "[ . 1 . 2]" 1 1119 1 48 ILE HG12 1 49 SER H . . 4.830 4.757 4.509 4.987 0.157 13 0 "[ . 1 . 2]" 1 1120 1 48 ILE HG12 1 53 LYS H . . 5.340 5.228 4.922 5.839 0.499 10 0 "[ . 1 . 2]" 1 1121 1 48 ILE MG 1 49 SER H . . 3.630 3.515 3.404 3.604 . 0 0 "[ . 1 . 2]" 1 1122 1 48 ILE MG 1 52 GLN H . . 5.060 5.003 4.899 5.102 0.042 5 0 "[ . 1 . 2]" 1 1123 1 48 ILE MG 1 52 GLN HB2 . . 3.750 3.321 3.217 3.401 . 0 0 "[ . 1 . 2]" 1 1124 1 48 ILE MG 1 52 GLN HB3 . . 3.890 3.189 2.907 3.432 . 0 0 "[ . 1 . 2]" 1 1125 1 48 ILE MG 1 52 GLN HE21 . . 5.340 3.636 2.018 4.707 . 0 0 "[ . 1 . 2]" 1 1126 1 48 ILE MG 1 52 GLN HE22 . . 4.990 4.233 2.320 5.137 0.147 20 0 "[ . 1 . 2]" 1 1127 1 48 ILE MG 1 52 GLN QG . . 4.690 2.260 1.908 3.171 . 0 0 "[ . 1 . 2]" 1 1128 1 48 ILE MG 1 56 TYR QD . . 4.850 4.523 4.147 4.863 0.013 1 0 "[ . 1 . 2]" 1 1129 1 48 ILE MG 1 56 TYR QE . . 4.550 3.134 2.746 3.599 . 0 0 "[ . 1 . 2]" 1 1130 1 49 SER H 1 49 SER HB2 . . 4.090 2.411 2.202 3.699 . 0 0 "[ . 1 . 2]" 1 1131 1 49 SER H 1 49 SER HB3 . . 3.560 3.358 2.839 3.689 0.129 9 0 "[ . 1 . 2]" 1 1132 1 49 SER H 1 50 GLN H . . 5.090 4.438 4.361 4.563 . 0 0 "[ . 1 . 2]" 1 1133 1 49 SER H 1 52 GLN H . . 4.950 3.395 3.209 3.610 . 0 0 "[ . 1 . 2]" 1 1134 1 49 SER H 1 52 GLN HB2 . . 3.870 2.605 2.131 2.743 . 0 0 "[ . 1 . 2]" 1 1135 1 49 SER H 1 52 GLN HB3 . . 4.040 3.977 3.468 4.087 0.047 16 0 "[ . 1 . 2]" 1 1136 1 49 SER H 1 52 GLN QG . . 4.450 3.629 2.033 4.317 . 0 0 "[ . 1 . 2]" 1 1137 1 49 SER HA 1 50 GLN H . . 3.510 2.727 2.518 2.857 . 0 0 "[ . 1 . 2]" 1 1138 1 49 SER HA 1 52 GLN H . . 5.350 5.006 4.581 5.357 0.007 2 0 "[ . 1 . 2]" 1 1139 1 49 SER HB2 1 50 GLN H . . 4.120 3.520 2.485 4.012 . 0 0 "[ . 1 . 2]" 1 1140 1 49 SER HB2 1 51 SER H . . 4.370 3.934 3.266 4.562 0.192 6 0 "[ . 1 . 2]" 1 1141 1 49 SER HB3 1 50 GLN H . . 4.510 2.245 1.942 3.882 . 0 0 "[ . 1 . 2]" 1 1142 1 49 SER HB3 1 51 SER H . . 5.040 3.003 2.701 4.913 . 0 0 "[ . 1 . 2]" 1 1143 1 49 SER HB3 1 52 GLN H . . 5.040 4.065 3.512 4.778 . 0 0 "[ . 1 . 2]" 1 1144 1 50 GLN H 1 50 GLN HB2 . . 3.840 2.405 2.274 2.523 . 0 0 "[ . 1 . 2]" 1 1145 1 50 GLN H 1 50 GLN HB3 . . 3.960 2.556 2.425 2.758 . 0 0 "[ . 1 . 2]" 1 1146 1 50 GLN H 1 50 GLN QG . . 4.510 4.026 3.977 4.056 . 0 0 "[ . 1 . 2]" 1 1147 1 50 GLN H 1 51 SER H . . 4.320 2.889 2.637 3.152 . 0 0 "[ . 1 . 2]" 1 1148 1 50 GLN H 1 52 GLN H . . 5.500 4.576 4.224 4.920 . 0 0 "[ . 1 . 2]" 1 1149 1 50 GLN HA 1 50 GLN HE21 . . 5.420 2.414 2.264 2.701 . 0 0 "[ . 1 . 2]" 1 1150 1 50 GLN HA 1 50 GLN HE22 . . 5.500 3.002 2.853 3.384 . 0 0 "[ . 1 . 2]" 1 1151 1 50 GLN HA 1 50 GLN QG . . 3.670 2.984 2.893 3.031 . 0 0 "[ . 1 . 2]" 1 1152 1 50 GLN HA 1 53 LYS H . . 4.150 3.674 3.265 3.950 . 0 0 "[ . 1 . 2]" 1 1153 1 50 GLN HA 1 53 LYS HB3 . . 4.320 4.341 4.141 4.617 0.297 13 0 "[ . 1 . 2]" 1 1154 1 50 GLN HA 1 53 LYS QD . . 3.910 3.215 2.778 4.032 0.122 10 0 "[ . 1 . 2]" 1 1155 1 50 GLN HA 1 54 GLU H . . 4.540 3.684 3.412 3.995 . 0 0 "[ . 1 . 2]" 1 1156 1 50 GLN HB2 1 50 GLN HE22 . . 5.500 4.442 4.354 4.496 . 0 0 "[ . 1 . 2]" 1 1157 1 50 GLN HB2 1 51 SER H . . 4.470 3.787 3.645 3.853 . 0 0 "[ . 1 . 2]" 1 1158 1 50 GLN HB3 1 51 SER H . . 4.210 2.417 2.259 2.503 . 0 0 "[ . 1 . 2]" 1 1159 1 50 GLN HB3 1 54 GLU H . . 5.270 5.242 5.084 5.345 0.075 10 0 "[ . 1 . 2]" 1 1160 1 50 GLN HE21 1 52 GLN H . . 5.340 5.178 4.916 5.359 0.019 10 0 "[ . 1 . 2]" 1 1161 1 50 GLN HE21 1 54 GLU HG2 . . 4.950 2.244 1.987 2.638 . 0 0 "[ . 1 . 2]" 1 1162 1 50 GLN HE21 1 54 GLU HG3 . . 4.950 2.742 2.396 3.138 . 0 0 "[ . 1 . 2]" 1 1163 1 50 GLN HE22 1 53 LYS HB2 . . 5.150 2.382 2.172 2.666 . 0 0 "[ . 1 . 2]" 1 1164 1 50 GLN HE22 1 53 LYS QD . . 5.500 3.530 3.175 5.088 . 0 0 "[ . 1 . 2]" 1 1165 1 50 GLN QG 1 51 SER H . . 4.620 3.500 3.235 3.547 . 0 0 "[ . 1 . 2]" 1 1166 1 50 GLN QG 1 51 SER HA . . 4.040 3.586 3.332 3.698 . 0 0 "[ . 1 . 2]" 1 1167 1 50 GLN QG 1 51 SER QB . . 4.690 4.675 4.451 4.712 0.022 15 0 "[ . 1 . 2]" 1 1168 1 50 GLN QG 1 54 GLU H . . 5.060 3.735 3.423 3.989 . 0 0 "[ . 1 . 2]" 1 1169 1 51 SER H 1 51 SER QB . . 3.640 2.206 2.069 2.247 . 0 0 "[ . 1 . 2]" 1 1170 1 51 SER H 1 52 GLN H . . 4.070 3.144 2.982 3.288 . 0 0 "[ . 1 . 2]" 1 1171 1 51 SER HA 1 54 GLU H . . 4.100 3.783 3.527 3.944 . 0 0 "[ . 1 . 2]" 1 1172 1 51 SER HA 1 54 GLU HB2 . . 3.630 2.554 2.379 2.811 . 0 0 "[ . 1 . 2]" 1 1173 1 51 SER HA 1 54 GLU HB3 . . 3.910 3.797 3.560 4.009 0.099 10 0 "[ . 1 . 2]" 1 1174 1 51 SER HA 1 54 GLU HG3 . . 4.510 3.781 3.348 4.370 . 0 0 "[ . 1 . 2]" 1 1175 1 51 SER QB 1 52 GLN H . . 3.880 2.385 2.050 2.756 . 0 0 "[ . 1 . 2]" 1 1176 1 51 SER QB 1 52 GLN HB2 . . 4.620 4.172 3.864 4.634 0.014 4 0 "[ . 1 . 2]" 1 1177 1 52 GLN H 1 52 GLN HB2 . . 3.890 2.124 2.021 2.463 . 0 0 "[ . 1 . 2]" 1 1178 1 52 GLN H 1 52 GLN HB3 . . 3.520 3.333 3.159 3.554 0.034 4 0 "[ . 1 . 2]" 1 1179 1 52 GLN H 1 52 GLN QG . . 3.950 3.386 2.205 3.863 . 0 0 "[ . 1 . 2]" 1 1180 1 52 GLN H 1 53 LYS H . . 3.290 3.086 2.803 3.293 0.003 1 0 "[ . 1 . 2]" 1 1181 1 52 GLN H 1 54 GLU H . . 4.790 4.087 3.750 4.366 . 0 0 "[ . 1 . 2]" 1 1182 1 52 GLN H 1 55 HIS HB2 . . 5.500 5.299 5.016 5.527 0.027 18 0 "[ . 1 . 2]" 1 1183 1 52 GLN H 1 55 HIS HB3 . . 5.500 5.193 4.909 5.511 0.011 18 0 "[ . 1 . 2]" 1 1184 1 52 GLN HA 1 52 GLN HE21 . . 5.340 3.731 2.074 5.060 . 0 0 "[ . 1 . 2]" 1 1185 1 52 GLN HA 1 52 GLN QG . . 3.600 2.450 1.964 2.604 . 0 0 "[ . 1 . 2]" 1 1186 1 52 GLN HA 1 55 HIS H . . 3.830 3.416 3.265 3.627 . 0 0 "[ . 1 . 2]" 1 1187 1 52 GLN HA 1 55 HIS HB2 . . 3.580 3.513 3.257 3.732 0.152 16 0 "[ . 1 . 2]" 1 1188 1 52 GLN HA 1 55 HIS HB3 . . 3.720 2.786 2.589 3.033 . 0 0 "[ . 1 . 2]" 1 1189 1 52 GLN HA 1 56 TYR H . . 4.730 3.670 3.339 4.031 . 0 0 "[ . 1 . 2]" 1 1190 1 52 GLN HB2 1 53 LYS H . . 4.180 2.707 2.165 3.117 . 0 0 "[ . 1 . 2]" 1 1191 1 52 GLN HB2 1 56 TYR QD . . 4.800 4.460 3.459 4.824 0.024 18 0 "[ . 1 . 2]" 1 1192 1 52 GLN HB2 1 56 TYR QE . . 5.250 4.388 3.728 4.873 . 0 0 "[ . 1 . 2]" 1 1193 1 52 GLN HB3 1 53 LYS H . . 3.890 2.459 2.144 3.363 . 0 0 "[ . 1 . 2]" 1 1194 1 52 GLN HE21 1 56 TYR QE . . 5.420 4.134 3.272 5.434 0.014 17 0 "[ . 1 . 2]" 1 1195 1 52 GLN QG 1 53 LYS H . . 4.360 4.036 3.888 4.220 . 0 0 "[ . 1 . 2]" 1 1196 1 52 GLN QG 1 56 TYR QD . . 4.800 3.490 2.750 4.367 . 0 0 "[ . 1 . 2]" 1 1197 1 52 GLN QG 1 56 TYR QE . . 4.320 2.488 1.956 3.768 . 0 0 "[ . 1 . 2]" 1 1198 1 53 LYS H 1 53 LYS HB2 . . 3.780 2.545 2.452 2.838 . 0 0 "[ . 1 . 2]" 1 1199 1 53 LYS H 1 53 LYS HB3 . . 4.160 3.547 3.486 3.556 . 0 0 "[ . 1 . 2]" 1 1200 1 53 LYS H 1 53 LYS QD . . 4.390 3.520 1.907 3.926 . 0 0 "[ . 1 . 2]" 1 1201 1 53 LYS H 1 53 LYS HG2 . . 3.830 3.160 1.897 3.399 . 0 0 "[ . 1 . 2]" 1 1202 1 53 LYS H 1 53 LYS HG3 . . 4.470 2.064 1.931 3.304 . 0 0 "[ . 1 . 2]" 1 1203 1 53 LYS H 1 54 GLU H . . 3.610 2.961 2.834 3.064 . 0 0 "[ . 1 . 2]" 1 1204 1 53 LYS H 1 54 GLU HB2 . . 4.950 4.822 4.709 4.873 . 0 0 "[ . 1 . 2]" 1 1205 1 53 LYS H 1 55 HIS H . . 4.790 4.591 4.304 4.789 . 0 0 "[ . 1 . 2]" 1 1206 1 53 LYS HA 1 53 LYS QD . . 4.360 3.879 1.888 4.071 . 0 0 "[ . 1 . 2]" 1 1207 1 53 LYS HA 1 53 LYS QE . . 4.850 4.412 3.819 4.542 . 0 0 "[ . 1 . 2]" 1 1208 1 53 LYS HA 1 53 LYS HG2 . . 4.060 2.528 2.291 3.560 . 0 0 "[ . 1 . 2]" 1 1209 1 53 LYS HA 1 53 LYS HG3 . . 3.990 2.963 2.735 3.723 . 0 0 "[ . 1 . 2]" 1 1210 1 53 LYS HA 1 56 TYR H . . 4.450 3.975 3.616 4.199 . 0 0 "[ . 1 . 2]" 1 1211 1 53 LYS HA 1 56 TYR HB2 . . 3.910 2.729 2.556 2.990 . 0 0 "[ . 1 . 2]" 1 1212 1 53 LYS HA 1 56 TYR HB3 . . 4.410 4.146 3.957 4.413 0.003 10 0 "[ . 1 . 2]" 1 1213 1 53 LYS HA 1 56 TYR QD . . 4.180 2.853 2.316 3.277 . 0 0 "[ . 1 . 2]" 1 1214 1 53 LYS HB2 1 53 LYS QD . . 3.820 2.465 2.278 3.301 . 0 0 "[ . 1 . 2]" 1 1215 1 53 LYS HB2 1 53 LYS QE . . 4.950 4.131 3.960 4.433 . 0 0 "[ . 1 . 2]" 1 1216 1 53 LYS HB2 1 54 GLU H . . 3.870 2.700 2.510 2.847 . 0 0 "[ . 1 . 2]" 1 1217 1 53 LYS HB2 1 54 GLU HG2 . . 4.950 4.214 3.505 4.460 . 0 0 "[ . 1 . 2]" 1 1218 1 53 LYS HB3 1 53 LYS QD . . 3.830 2.416 2.275 2.629 . 0 0 "[ . 1 . 2]" 1 1219 1 53 LYS HB3 1 54 GLU H . . 4.290 3.695 3.509 4.012 . 0 0 "[ . 1 . 2]" 1 1220 1 53 LYS HB3 1 54 GLU HG2 . . 4.850 4.844 4.723 4.961 0.111 13 0 "[ . 1 . 2]" 1 1221 1 53 LYS QD 1 54 GLU H . . 5.090 4.728 4.236 4.964 . 0 0 "[ . 1 . 2]" 1 1222 1 53 LYS HG2 1 54 GLU H . . 5.210 5.011 3.810 5.221 0.011 11 0 "[ . 1 . 2]" 1 1223 1 53 LYS HG3 1 54 GLU H . . 5.500 4.432 4.266 4.942 . 0 0 "[ . 1 . 2]" 1 1224 1 54 GLU H 1 54 GLU HB2 . . 3.350 2.130 2.091 2.246 . 0 0 "[ . 1 . 2]" 1 1225 1 54 GLU H 1 54 GLU HB3 . . 3.490 3.430 3.394 3.502 0.012 10 0 "[ . 1 . 2]" 1 1226 1 54 GLU H 1 54 GLU HG2 . . 3.770 3.040 2.685 3.196 . 0 0 "[ . 1 . 2]" 1 1227 1 54 GLU H 1 54 GLU HG3 . . 3.630 3.566 3.306 3.647 0.017 17 0 "[ . 1 . 2]" 1 1228 1 54 GLU H 1 55 HIS H . . 3.610 2.843 2.740 2.909 . 0 0 "[ . 1 . 2]" 1 1229 1 54 GLU H 1 55 HIS HA . . 5.340 5.327 5.245 5.375 0.035 20 0 "[ . 1 . 2]" 1 1230 1 54 GLU H 1 55 HIS HB2 . . 5.420 5.074 4.891 5.160 . 0 0 "[ . 1 . 2]" 1 1231 1 54 GLU H 1 55 HIS HB3 . . 5.190 4.975 4.802 5.132 . 0 0 "[ . 1 . 2]" 1 1232 1 54 GLU H 1 56 TYR H . . 4.590 4.592 4.487 4.639 0.049 20 0 "[ . 1 . 2]" 1 1233 1 54 GLU HA 1 54 GLU HG2 . . 3.850 2.224 2.098 2.421 . 0 0 "[ . 1 . 2]" 1 1234 1 54 GLU HA 1 56 TYR H . . 5.210 5.082 4.917 5.250 0.040 14 0 "[ . 1 . 2]" 1 1235 1 54 GLU HA 1 57 LYS H . . 3.990 3.658 3.427 4.020 0.030 19 0 "[ . 1 . 2]" 1 1236 1 54 GLU HA 1 57 LYS HB3 . . 3.630 2.576 2.243 3.529 . 0 0 "[ . 1 . 2]" 1 1237 1 54 GLU HA 1 57 LYS QE . . 4.250 3.120 2.568 4.248 . 0 0 "[ . 1 . 2]" 1 1238 1 54 GLU HB2 1 55 HIS H . . 4.180 2.678 2.518 2.918 . 0 0 "[ . 1 . 2]" 1 1239 1 55 HIS H 1 55 HIS HB2 . . 3.430 2.350 2.243 2.423 . 0 0 "[ . 1 . 2]" 1 1240 1 55 HIS H 1 55 HIS HB3 . . 3.400 2.566 2.486 2.686 . 0 0 "[ . 1 . 2]" 1 1241 1 55 HIS H 1 55 HIS HD2 . . 5.190 5.237 5.157 5.329 0.139 15 0 "[ . 1 . 2]" 1 1242 1 55 HIS H 1 56 TYR H . . 3.600 3.048 2.862 3.183 . 0 0 "[ . 1 . 2]" 1 1243 1 55 HIS H 1 56 TYR QD . . 5.420 5.111 4.856 5.427 0.007 12 0 "[ . 1 . 2]" 1 1244 1 55 HIS H 1 57 LYS H . . 5.090 4.162 3.810 4.520 . 0 0 "[ . 1 . 2]" 1 1245 1 55 HIS HA 1 57 LYS H . . 5.500 4.435 3.796 5.134 . 0 0 "[ . 1 . 2]" 1 1246 1 55 HIS HA 1 58 LYS H . . 4.210 3.364 3.031 3.695 . 0 0 "[ . 1 . 2]" 1 1247 1 55 HIS HA 1 58 LYS HB2 . . 4.180 3.940 3.728 4.278 0.098 15 0 "[ . 1 . 2]" 1 1248 1 55 HIS HA 1 58 LYS HB3 . . 3.850 2.646 2.322 3.129 . 0 0 "[ . 1 . 2]" 1 1249 1 55 HIS HA 1 58 LYS QD . . 4.560 3.828 2.800 4.336 . 0 0 "[ . 1 . 2]" 1 1250 1 55 HIS HA 1 58 LYS HG2 . . 5.500 4.942 2.157 5.587 0.087 11 0 "[ . 1 . 2]" 1 1251 1 55 HIS HB2 1 56 TYR H . . 3.700 3.661 3.529 3.747 0.047 1 0 "[ . 1 . 2]" 1 1252 1 55 HIS HB3 1 56 TYR H . . 4.090 2.200 2.081 2.323 . 0 0 "[ . 1 . 2]" 1 1253 1 55 HIS HD2 1 56 TYR H . . 4.700 3.870 3.420 4.267 . 0 0 "[ . 1 . 2]" 1 1254 1 55 HIS HD2 1 56 TYR HA . . 4.900 4.217 3.287 4.933 0.033 12 0 "[ . 1 . 2]" 1 1255 1 55 HIS HD2 1 56 TYR QD . . 4.620 4.271 3.741 4.613 . 0 0 "[ . 1 . 2]" 1 1256 1 55 HIS HD2 1 56 TYR QE . . 4.620 4.403 4.045 4.611 . 0 0 "[ . 1 . 2]" 1 1257 1 55 HIS HD2 1 59 LEU QD . . 4.150 2.494 1.831 2.883 . 0 0 "[ . 1 . 2]" 1 1258 1 55 HIS HD2 1 59 LEU HG . . 4.900 4.217 3.100 4.902 0.002 10 0 "[ . 1 . 2]" 1 1259 1 55 HIS HE1 1 59 LEU QD . . 3.770 2.634 2.064 3.310 . 0 0 "[ . 1 . 2]" 1 1260 1 55 HIS HE1 1 59 LEU HG . . 4.800 4.116 3.465 4.800 . 0 0 "[ . 1 . 2]" 1 1261 1 56 TYR H 1 56 TYR HB2 . . 3.670 2.230 2.168 2.311 . 0 0 "[ . 1 . 2]" 1 1262 1 56 TYR H 1 56 TYR HB3 . . 3.530 3.440 3.422 3.474 . 0 0 "[ . 1 . 2]" 1 1263 1 56 TYR H 1 56 TYR QD . . 3.830 3.036 2.843 3.158 . 0 0 "[ . 1 . 2]" 1 1264 1 56 TYR H 1 56 TYR QE . . 4.550 4.606 4.550 4.660 0.110 10 0 "[ . 1 . 2]" 1 1265 1 56 TYR H 1 57 LYS H . . 3.420 2.932 2.754 3.039 . 0 0 "[ . 1 . 2]" 1 1266 1 56 TYR H 1 57 LYS HB3 . . 5.500 5.015 4.781 5.212 . 0 0 "[ . 1 . 2]" 1 1267 1 56 TYR H 1 59 LEU HB2 . . 5.210 5.012 4.762 5.185 . 0 0 "[ . 1 . 2]" 1 1268 1 56 TYR H 1 59 LEU QD . . 5.500 3.704 3.107 4.283 . 0 0 "[ . 1 . 2]" 1 1269 1 56 TYR H 1 59 LEU HG . . 5.500 4.841 4.464 5.610 0.110 13 0 "[ . 1 . 2]" 1 1270 1 56 TYR HA 1 56 TYR QD . . 3.640 2.156 1.949 2.434 . 0 0 "[ . 1 . 2]" 1 1271 1 56 TYR HA 1 56 TYR QE . . 4.320 4.373 4.300 4.444 0.124 3 0 "[ . 1 . 2]" 1 1272 1 56 TYR HA 1 59 LEU H . . 4.450 3.332 2.955 3.669 . 0 0 "[ . 1 . 2]" 1 1273 1 56 TYR HA 1 59 LEU HB2 . . 3.780 2.566 2.183 2.714 . 0 0 "[ . 1 . 2]" 1 1274 1 56 TYR HA 1 59 LEU HB3 . . 4.210 4.159 3.798 4.288 0.078 15 0 "[ . 1 . 2]" 1 1275 1 56 TYR HA 1 59 LEU QD . . 3.890 2.245 1.885 2.938 . 0 0 "[ . 1 . 2]" 1 1276 1 56 TYR HA 1 59 LEU HG . . 3.780 3.431 3.077 3.804 0.024 14 0 "[ . 1 . 2]" 1 1277 1 56 TYR HB2 1 57 LYS H . . 4.540 2.533 2.136 2.911 . 0 0 "[ . 1 . 2]" 1 1278 1 56 TYR HB2 1 58 LYS H . . 5.500 4.852 4.547 5.176 . 0 0 "[ . 1 . 2]" 1 1279 1 56 TYR HB3 1 57 LYS H . . 3.870 3.316 2.859 3.769 . 0 0 "[ . 1 . 2]" 1 1280 1 56 TYR HB3 1 60 ALA H . . 5.500 4.876 4.556 5.355 . 0 0 "[ . 1 . 2]" 1 1281 1 56 TYR HB3 1 60 ALA MB . . 4.950 4.544 4.171 4.970 0.020 17 0 "[ . 1 . 2]" 1 1282 1 56 TYR QD 1 57 LYS H . . 5.270 4.389 4.116 4.634 . 0 0 "[ . 1 . 2]" 1 1283 1 56 TYR QD 1 59 LEU QD . . 4.410 2.823 2.420 3.193 . 0 0 "[ . 1 . 2]" 1 1284 1 56 TYR QD 1 59 LEU HG . . 4.900 4.664 3.508 5.023 0.123 17 0 "[ . 1 . 2]" 1 1285 1 56 TYR QE 1 59 LEU QD . . 4.230 3.897 3.621 4.312 0.082 12 0 "[ . 1 . 2]" 1 1286 1 57 LYS H 1 57 LYS HB2 . . 3.700 2.632 2.380 3.387 . 0 0 "[ . 1 . 2]" 1 1287 1 57 LYS H 1 57 LYS HB3 . . 3.280 2.370 2.080 2.540 . 0 0 "[ . 1 . 2]" 1 1288 1 57 LYS H 1 57 LYS QE . . 4.850 4.554 4.373 4.834 . 0 0 "[ . 1 . 2]" 1 1289 1 57 LYS H 1 57 LYS HG2 . . 4.450 4.299 3.049 4.528 0.078 6 0 "[ . 1 . 2]" 1 1290 1 57 LYS H 1 57 LYS HG3 . . 4.670 4.388 4.093 4.550 . 0 0 "[ . 1 . 2]" 1 1291 1 57 LYS HA 1 57 LYS QE . . 4.690 4.496 3.516 4.692 0.002 2 0 "[ . 1 . 2]" 1 1292 1 57 LYS HA 1 57 LYS HG2 . . 3.870 3.416 3.103 3.740 . 0 0 "[ . 1 . 2]" 1 1293 1 57 LYS HA 1 57 LYS HG3 . . 3.930 2.533 2.305 3.527 . 0 0 "[ . 1 . 2]" 1 1294 1 57 LYS HA 1 60 ALA H . . 4.200 3.585 3.199 3.994 . 0 0 "[ . 1 . 2]" 1 1295 1 57 LYS HA 1 60 ALA MB . . 3.570 2.703 2.307 3.246 . 0 0 "[ . 1 . 2]" 1 1296 1 57 LYS HB2 1 57 LYS QE . . 3.990 2.910 2.053 3.548 . 0 0 "[ . 1 . 2]" 1 1297 1 57 LYS HB2 1 58 LYS H . . 4.090 4.088 3.924 4.243 0.153 20 0 "[ . 1 . 2]" 1 1298 1 57 LYS HB3 1 57 LYS QE . . 3.930 2.625 2.301 3.304 . 0 0 "[ . 1 . 2]" 1 1299 1 57 LYS HB3 1 58 LYS H . . 3.910 2.907 2.603 3.662 . 0 0 "[ . 1 . 2]" 1 1300 1 57 LYS QE 1 57 LYS HG3 . . 3.620 3.160 2.187 3.436 . 0 0 "[ . 1 . 2]" 1 1301 1 57 LYS HG2 1 61 GLU QG . . 4.950 3.895 3.273 4.673 . 0 0 "[ . 1 . 2]" 1 1302 1 57 LYS HG3 1 61 GLU QG . . 4.510 3.977 3.293 4.627 0.117 17 0 "[ . 1 . 2]" 1 1303 1 58 LYS H 1 58 LYS HB2 . . 3.370 2.948 2.640 3.487 0.117 14 0 "[ . 1 . 2]" 1 1304 1 58 LYS H 1 58 LYS HB3 . . 3.290 2.198 2.075 2.309 . 0 0 "[ . 1 . 2]" 1 1305 1 58 LYS H 1 58 LYS HG2 . . 4.170 4.245 3.558 4.382 0.212 19 0 "[ . 1 . 2]" 1 1306 1 58 LYS H 1 58 LYS HG3 . . 4.560 4.315 2.617 4.649 0.089 12 0 "[ . 1 . 2]" 1 1307 1 58 LYS HA 1 58 LYS HB2 . . 2.750 2.315 2.256 2.384 . 0 0 "[ . 1 . 2]" 1 1308 1 58 LYS HA 1 58 LYS QD . . 3.800 3.667 3.362 3.775 . 0 0 "[ . 1 . 2]" 1 1309 1 58 LYS HA 1 58 LYS HG2 . . 3.680 2.910 2.497 4.247 0.567 14 3 "[ . 1 +- * 2]" 1 1310 1 58 LYS HA 1 58 LYS HG3 . . 3.740 3.643 3.503 3.823 0.083 7 0 "[ . 1 . 2]" 1 1311 1 58 LYS HA 1 60 ALA MB . . 4.770 4.630 4.459 4.801 0.031 7 0 "[ . 1 . 2]" 1 1312 1 58 LYS HA 1 61 GLU H . . 4.000 3.484 3.341 3.900 . 0 0 "[ . 1 . 2]" 1 1313 1 58 LYS HA 1 61 GLU HB2 . . 3.950 3.635 3.368 4.817 0.867 2 2 "[ + . - 1 . 2]" 1 1314 1 58 LYS HA 1 61 GLU QG . . 3.870 2.005 1.894 2.147 . 0 0 "[ . 1 . 2]" 1 1315 1 58 LYS QD 1 59 LEU H . . 4.280 2.493 2.003 3.003 . 0 0 "[ . 1 . 2]" 1 1316 1 58 LYS QD 1 59 LEU HA . . 3.740 2.279 2.148 2.439 . 0 0 "[ . 1 . 2]" 1 1317 1 58 LYS QD 1 59 LEU HG . . 4.360 2.937 1.994 4.025 . 0 0 "[ . 1 . 2]" 1 1318 1 58 LYS QD 1 61 GLU QG . . 5.060 4.556 4.200 4.678 . 0 0 "[ . 1 . 2]" 1 1319 1 58 LYS QE 1 58 LYS HG3 . . 3.780 2.569 2.309 2.867 . 0 0 "[ . 1 . 2]" 1 1320 1 58 LYS QE 1 59 LEU H . . 4.620 3.663 2.915 4.378 . 0 0 "[ . 1 . 2]" 1 1321 1 58 LYS QE 1 59 LEU HA . . 4.150 3.800 3.396 4.165 0.015 2 0 "[ . 1 . 2]" 1 1322 1 58 LYS QE 1 59 LEU QD . . 3.620 2.169 1.863 2.563 . 0 0 "[ . 1 . 2]" 1 1323 1 58 LYS QE 1 59 LEU HG . . 4.620 3.022 2.350 4.724 0.104 12 0 "[ . 1 . 2]" 1 1324 1 58 LYS HG2 1 59 LEU H . . 3.890 3.930 3.669 4.019 0.129 14 0 "[ . 1 . 2]" 1 1325 1 58 LYS HG3 1 59 LEU H . . 5.420 4.260 1.933 4.725 . 0 0 "[ . 1 . 2]" 1 1326 1 59 LEU H 1 59 LEU HB2 . . 3.620 2.424 2.248 2.573 . 0 0 "[ . 1 . 2]" 1 1327 1 59 LEU H 1 59 LEU QD . . 3.780 2.813 1.839 3.236 . 0 0 "[ . 1 . 2]" 1 1328 1 59 LEU H 1 59 LEU HG . . 3.470 2.529 1.957 3.936 0.466 11 0 "[ . 1 . 2]" 1 1329 1 59 LEU HA 1 59 LEU QD . . 2.950 1.991 1.885 2.226 . 0 0 "[ . 1 . 2]" 1 1330 1 59 LEU HA 1 59 LEU HG . . 3.970 3.124 2.891 3.647 . 0 0 "[ . 1 . 2]" 1 1331 1 59 LEU HA 1 62 GLU H . . 4.210 3.106 2.876 3.668 . 0 0 "[ . 1 . 2]" 1 1332 1 59 LEU HA 1 62 GLU HB2 . . 3.830 3.356 2.496 3.836 0.006 7 0 "[ . 1 . 2]" 1 1333 1 59 LEU HA 1 62 GLU HB3 . . 3.560 2.693 2.367 3.863 0.303 11 0 "[ . 1 . 2]" 1 1334 1 59 LEU HA 1 62 GLU QG . . 4.120 4.110 3.622 4.191 0.071 20 0 "[ . 1 . 2]" 1 1335 1 59 LEU HA 1 63 GLN H . . 4.560 4.021 3.756 4.355 . 0 0 "[ . 1 . 2]" 1 1336 1 59 LEU HB2 1 60 ALA H . . 3.800 2.562 2.395 2.796 . 0 0 "[ . 1 . 2]" 1 1337 1 59 LEU HB2 1 60 ALA HA . . 4.690 4.329 4.195 4.526 . 0 0 "[ . 1 . 2]" 1 1338 1 59 LEU HB3 1 60 ALA H . . 3.740 3.523 3.079 3.692 . 0 0 "[ . 1 . 2]" 1 1339 1 59 LEU HB3 1 62 GLU HB3 . . 4.850 4.196 3.709 5.087 0.237 11 0 "[ . 1 . 2]" 1 1340 1 59 LEU QD 1 60 ALA H . . 4.990 3.976 3.666 4.216 . 0 0 "[ . 1 . 2]" 1 1341 1 59 LEU QD 1 62 GLU H . . 5.500 4.438 4.102 4.887 . 0 0 "[ . 1 . 2]" 1 1342 1 59 LEU QD 1 62 GLU HB2 . . 4.360 3.906 3.136 4.336 . 0 0 "[ . 1 . 2]" 1 1343 1 59 LEU QD 1 62 GLU HB3 . . 4.770 3.374 2.912 4.163 . 0 0 "[ . 1 . 2]" 1 1344 1 59 LEU QD 1 62 GLU QG . . 4.510 3.795 3.474 4.016 . 0 0 "[ . 1 . 2]" 1 1345 1 60 ALA H 1 60 ALA MB . . 3.070 2.118 2.000 2.181 . 0 0 "[ . 1 . 2]" 1 1346 1 60 ALA H 1 61 GLU QG . . 5.270 4.039 3.774 4.217 . 0 0 "[ . 1 . 2]" 1 1347 1 60 ALA H 1 63 GLN HB2 . . 5.190 4.712 4.390 5.205 0.015 19 0 "[ . 1 . 2]" 1 1348 1 60 ALA HA 1 63 GLN H . . 4.090 3.374 3.174 3.641 . 0 0 "[ . 1 . 2]" 1 1349 1 60 ALA HA 1 63 GLN HB2 . . 3.970 2.534 2.256 3.445 . 0 0 "[ . 1 . 2]" 1 1350 1 60 ALA HA 1 63 GLN HB3 . . 4.210 3.652 1.998 4.057 . 0 0 "[ . 1 . 2]" 1 1351 1 60 ALA HA 1 63 GLN HG2 . . 4.850 4.694 3.445 4.865 0.015 3 0 "[ . 1 . 2]" 1 1352 1 60 ALA HA 1 63 GLN HG3 . . 4.620 4.083 3.488 4.705 0.085 19 0 "[ . 1 . 2]" 1 1353 1 60 ALA HA 1 64 GLN HG3 . . 4.690 4.058 3.443 4.644 . 0 0 "[ . 1 . 2]" 1 1354 1 60 ALA MB 1 61 GLU H . . 3.860 2.552 1.930 2.799 . 0 0 "[ . 1 . 2]" 1 1355 1 60 ALA MB 1 61 GLU QG . . 4.320 3.256 2.940 3.896 . 0 0 "[ . 1 . 2]" 1 1356 1 60 ALA MB 1 62 GLU H . . 4.830 4.511 4.145 4.666 . 0 0 "[ . 1 . 2]" 1 1357 1 60 ALA MB 1 63 GLN H . . 4.950 4.582 4.345 4.861 . 0 0 "[ . 1 . 2]" 1 1358 1 60 ALA MB 1 63 GLN HB2 . . 5.190 4.139 3.812 4.938 . 0 0 "[ . 1 . 2]" 1 1359 1 60 ALA MB 1 63 GLN HB3 . . 4.950 4.823 3.710 4.974 0.024 8 0 "[ . 1 . 2]" 1 1360 1 60 ALA MB 1 64 GLN HE21 . . 4.210 2.739 1.928 3.278 . 0 0 "[ . 1 . 2]" 1 1361 1 60 ALA MB 1 64 GLN HE22 . . 4.690 3.244 2.027 4.019 . 0 0 "[ . 1 . 2]" 1 1362 1 60 ALA MB 1 64 GLN HG3 . . 5.350 3.944 3.514 4.485 . 0 0 "[ . 1 . 2]" 1 1363 1 61 GLU H 1 61 GLU HB2 . . 3.470 2.837 2.701 3.557 0.087 7 0 "[ . 1 . 2]" 1 1364 1 61 GLU H 1 61 GLU HB3 . . 3.710 3.411 2.299 3.555 . 0 0 "[ . 1 . 2]" 1 1365 1 61 GLU H 1 61 GLU QG . . 3.660 1.974 1.872 2.473 . 0 0 "[ . 1 . 2]" 1 1366 1 61 GLU H 1 62 GLU H . . 3.460 2.720 2.492 2.982 . 0 0 "[ . 1 . 2]" 1 1367 1 61 GLU HA 1 61 GLU QG . . 3.620 2.825 2.479 3.333 . 0 0 "[ . 1 . 2]" 1 1368 1 61 GLU HA 1 64 GLN H . . 4.690 3.603 3.507 3.764 . 0 0 "[ . 1 . 2]" 1 1369 1 61 GLU HA 1 64 GLN HB2 . . 3.560 3.113 2.860 3.341 . 0 0 "[ . 1 . 2]" 1 1370 1 61 GLU HA 1 64 GLN HE21 . . 5.060 2.714 1.963 4.111 . 0 0 "[ . 1 . 2]" 1 1371 1 61 GLU HA 1 64 GLN HE22 . . 5.190 3.459 2.643 4.172 . 0 0 "[ . 1 . 2]" 1 1372 1 61 GLU HA 1 64 GLN HG3 . . 4.850 3.971 3.548 4.322 . 0 0 "[ . 1 . 2]" 1 1373 1 61 GLU HA 1 65 ARG H . . 4.760 4.393 4.120 4.736 . 0 0 "[ . 1 . 2]" 1 1374 1 61 GLU HB2 1 62 GLU H . . 3.720 2.821 2.462 3.944 0.224 2 0 "[ . 1 . 2]" 1 1375 1 61 GLU HB3 1 61 GLU QG . . 2.780 2.434 2.267 2.554 . 0 0 "[ . 1 . 2]" 1 1376 1 61 GLU QG 1 62 GLU H . . 4.620 3.529 1.880 3.869 . 0 0 "[ . 1 . 2]" 1 1377 1 62 GLU H 1 62 GLU HB2 . . 3.450 2.601 2.017 2.881 . 0 0 "[ . 1 . 2]" 1 1378 1 62 GLU H 1 62 GLU HB3 . . 3.320 2.438 2.205 3.232 . 0 0 "[ . 1 . 2]" 1 1379 1 62 GLU H 1 62 GLU QG . . 3.780 3.871 3.793 3.933 0.153 16 0 "[ . 1 . 2]" 1 1380 1 62 GLU H 1 63 GLN H . . 3.600 2.644 2.487 2.987 . 0 0 "[ . 1 . 2]" 1 1381 1 62 GLU H 1 64 GLN H . . 4.640 4.206 4.014 4.480 . 0 0 "[ . 1 . 2]" 1 1382 1 62 GLU HA 1 62 GLU QG . . 3.460 2.633 2.446 2.903 . 0 0 "[ . 1 . 2]" 1 1383 1 62 GLU HA 1 65 ARG H . . 3.820 3.155 2.990 3.334 . 0 0 "[ . 1 . 2]" 1 1384 1 62 GLU HA 1 65 ARG HB2 . . 3.580 3.305 3.130 3.482 . 0 0 "[ . 1 . 2]" 1 1385 1 62 GLU HA 1 65 ARG HB3 . . 3.910 2.049 1.987 2.132 . 0 0 "[ . 1 . 2]" 1 1386 1 62 GLU HA 1 65 ARG QD . . 4.210 2.987 2.774 3.272 . 0 0 "[ . 1 . 2]" 1 1387 1 62 GLU HA 1 65 ARG HG2 . . 4.560 3.940 3.805 4.072 . 0 0 "[ . 1 . 2]" 1 1388 1 62 GLU HA 1 65 ARG HG3 . . 4.850 4.855 4.796 4.900 0.050 20 0 "[ . 1 . 2]" 1 1389 1 62 GLU HA 1 66 GLN H . . 4.910 4.172 3.966 4.583 . 0 0 "[ . 1 . 2]" 1 1390 1 62 GLU HB2 1 62 GLU QG . . 2.760 2.524 2.343 2.572 . 0 0 "[ . 1 . 2]" 1 1391 1 62 GLU HB2 1 63 GLN H . . 4.040 3.901 2.985 4.110 0.070 19 0 "[ . 1 . 2]" 1 1392 1 62 GLU HB2 1 65 ARG QD . . 4.950 4.362 3.972 5.192 0.242 4 0 "[ . 1 . 2]" 1 1393 1 62 GLU HB3 1 63 GLN H . . 3.540 2.718 2.505 2.882 . 0 0 "[ . 1 . 2]" 1 1394 1 62 GLU QG 1 63 GLN H . . 4.180 3.562 2.927 4.248 0.068 11 0 "[ . 1 . 2]" 1 1395 1 62 GLU QG 1 66 GLN HE21 . . 4.210 2.544 1.941 3.705 . 0 0 "[ . 1 . 2]" 1 1396 1 62 GLU QG 1 66 GLN HE22 . . 4.690 3.104 1.953 4.696 0.006 17 0 "[ . 1 . 2]" 1 1397 1 63 GLN H 1 63 GLN HB2 . . 3.550 2.094 2.022 2.931 . 0 0 "[ . 1 . 2]" 1 1398 1 63 GLN H 1 63 GLN HB3 . . 3.680 3.258 2.110 3.420 . 0 0 "[ . 1 . 2]" 1 1399 1 63 GLN H 1 63 GLN HG2 . . 3.960 3.375 3.165 4.032 0.072 19 0 "[ . 1 . 2]" 1 1400 1 63 GLN H 1 63 GLN HG3 . . 4.090 3.969 3.154 4.320 0.230 19 0 "[ . 1 . 2]" 1 1401 1 63 GLN H 1 64 GLN H . . 3.730 2.817 2.691 2.969 . 0 0 "[ . 1 . 2]" 1 1402 1 63 GLN HA 1 63 GLN HG2 . . 4.060 2.369 1.998 3.781 . 0 0 "[ . 1 . 2]" 1 1403 1 63 GLN HA 1 63 GLN HG3 . . 3.910 3.457 2.857 3.555 . 0 0 "[ . 1 . 2]" 1 1404 1 63 GLN HA 1 67 TYR H . . 4.790 4.101 3.646 4.747 . 0 0 "[ . 1 . 2]" 1 1405 1 63 GLN HB2 1 64 GLN H . . 4.450 3.114 2.809 4.179 . 0 0 "[ . 1 . 2]" 1 1406 1 63 GLN HB3 1 63 GLN HE22 . . 5.210 3.970 3.308 5.019 . 0 0 "[ . 1 . 2]" 1 1407 1 64 GLN H 1 64 GLN HB3 . . 4.120 3.559 3.549 3.575 . 0 0 "[ . 1 . 2]" 1 1408 1 64 GLN H 1 64 GLN HG2 . . 4.360 3.447 3.224 3.643 . 0 0 "[ . 1 . 2]" 1 1409 1 64 GLN H 1 64 GLN HG3 . . 4.060 2.144 1.971 2.386 . 0 0 "[ . 1 . 2]" 1 1410 1 64 GLN H 1 65 ARG H . . 3.640 2.536 2.435 2.639 . 0 0 "[ . 1 . 2]" 1 1411 1 64 GLN H 1 66 GLN H . . 4.410 4.283 4.139 4.418 0.008 16 0 "[ . 1 . 2]" 1 1412 1 64 GLN HA 1 64 GLN HG2 . . 3.540 2.587 2.451 2.826 . 0 0 "[ . 1 . 2]" 1 1413 1 64 GLN HA 1 64 GLN HG3 . . 3.910 2.934 2.732 3.077 . 0 0 "[ . 1 . 2]" 1 1414 1 64 GLN HA 1 67 TYR H . . 4.280 3.364 2.987 3.531 . 0 0 "[ . 1 . 2]" 1 1415 1 64 GLN HA 1 67 TYR QB . . 3.780 2.247 1.987 2.498 . 0 0 "[ . 1 . 2]" 1 1416 1 64 GLN HA 1 67 TYR QD . . 4.120 3.878 3.070 4.142 0.022 17 0 "[ . 1 . 2]" 1 1417 1 64 GLN HB2 1 65 ARG H . . 3.980 3.052 2.682 3.329 . 0 0 "[ . 1 . 2]" 1 1418 1 64 GLN HB2 1 65 ARG HA . . 4.360 4.277 4.085 4.383 0.023 10 0 "[ . 1 . 2]" 1 1419 1 64 GLN HB2 1 65 ARG HB2 . . 5.190 4.942 4.829 5.206 0.016 16 0 "[ . 1 . 2]" 1 1420 1 64 GLN HB3 1 65 ARG H . . 4.200 4.032 3.766 4.224 0.024 15 0 "[ . 1 . 2]" 1 1421 1 64 GLN HG3 1 65 ARG H . . 4.950 4.380 4.170 4.483 . 0 0 "[ . 1 . 2]" 1 1422 1 64 GLN HG3 1 67 TYR QB . . 5.190 4.803 4.641 5.000 . 0 0 "[ . 1 . 2]" 1 1423 1 65 ARG H 1 65 ARG HB2 . . 3.430 3.002 2.970 3.067 . 0 0 "[ . 1 . 2]" 1 1424 1 65 ARG H 1 65 ARG HB3 . . 3.490 2.106 2.080 2.138 . 0 0 "[ . 1 . 2]" 1 1425 1 65 ARG H 1 65 ARG QD . . 4.510 4.376 4.301 4.494 . 0 0 "[ . 1 . 2]" 1 1426 1 65 ARG H 1 65 ARG HG2 . . 3.860 3.936 3.890 3.960 0.100 15 0 "[ . 1 . 2]" 1 1427 1 65 ARG HA 1 65 ARG HB3 . . 3.060 2.979 2.936 2.999 . 0 0 "[ . 1 . 2]" 1 1428 1 65 ARG HA 1 65 ARG QD . . 4.180 4.040 3.874 4.172 . 0 0 "[ . 1 . 2]" 1 1429 1 65 ARG HA 1 65 ARG HG2 . . 3.710 3.630 3.549 3.724 0.014 7 0 "[ . 1 . 2]" 1 1430 1 65 ARG HA 1 65 ARG HG3 . . 3.560 2.928 2.841 3.063 . 0 0 "[ . 1 . 2]" 1 1431 1 65 ARG HA 1 67 TYR H . . 4.700 4.711 4.665 4.753 0.053 3 0 "[ . 1 . 2]" 1 1432 1 65 ARG HA 1 68 LYS H . . 4.320 3.823 3.612 4.091 . 0 0 "[ . 1 . 2]" 1 1433 1 65 ARG HA 1 69 VAL QG . . 4.850 4.590 4.042 4.713 . 0 0 "[ . 1 . 2]" 1 1434 1 65 ARG HB2 1 65 ARG QD . . 3.910 2.326 2.235 2.417 . 0 0 "[ . 1 . 2]" 1 1435 1 65 ARG HB3 1 65 ARG QD . . 3.340 2.509 2.413 2.639 . 0 0 "[ . 1 . 2]" 1 1436 1 65 ARG HB3 1 65 ARG HG2 . . 2.910 2.436 2.371 2.469 . 0 0 "[ . 1 . 2]" 1 1437 1 65 ARG HB3 1 66 GLN H . . 3.650 2.892 2.731 3.001 . 0 0 "[ . 1 . 2]" 1 1438 1 65 ARG QD 1 66 GLN H . . 4.910 4.478 4.148 4.841 . 0 0 "[ . 1 . 2]" 1 1439 1 65 ARG QD 1 66 GLN QG . . 5.060 3.912 3.660 4.330 . 0 0 "[ . 1 . 2]" 1 1440 1 65 ARG QD 1 69 VAL QG . . 5.190 4.832 4.284 5.006 . 0 0 "[ . 1 . 2]" 1 1441 1 65 ARG HG2 1 66 GLN H . . 4.180 2.841 2.311 3.227 . 0 0 "[ . 1 . 2]" 1 1442 1 65 ARG HG2 1 69 VAL QG . . 4.560 3.949 3.534 4.245 . 0 0 "[ . 1 . 2]" 1 1443 1 65 ARG HG3 1 66 GLN H . . 4.210 3.923 3.472 4.172 . 0 0 "[ . 1 . 2]" 1 1444 1 65 ARG HG3 1 66 GLN QG . . 4.850 3.985 3.467 4.477 . 0 0 "[ . 1 . 2]" 1 1445 1 65 ARG HG3 1 69 VAL QG . . 4.280 3.579 3.030 3.828 . 0 0 "[ . 1 . 2]" 1 1446 1 66 GLN H 1 66 GLN QB . . 3.200 2.322 2.093 2.554 . 0 0 "[ . 1 . 2]" 1 1447 1 66 GLN H 1 66 GLN HE21 . . 5.270 3.742 2.948 4.892 . 0 0 "[ . 1 . 2]" 1 1448 1 66 GLN H 1 66 GLN HE22 . . 5.500 5.069 4.100 5.532 0.032 9 0 "[ . 1 . 2]" 1 1449 1 66 GLN H 1 66 GLN QG . . 3.750 2.453 2.134 2.869 . 0 0 "[ . 1 . 2]" 1 1450 1 66 GLN H 1 67 TYR H . . 3.630 2.563 2.369 2.821 . 0 0 "[ . 1 . 2]" 1 1451 1 66 GLN H 1 67 TYR HA . . 5.500 5.118 4.946 5.333 . 0 0 "[ . 1 . 2]" 1 1452 1 66 GLN H 1 67 TYR QB . . 5.040 4.044 3.874 4.277 . 0 0 "[ . 1 . 2]" 1 1453 1 66 GLN H 1 68 LYS H . . 4.760 3.988 3.809 4.572 . 0 0 "[ . 1 . 2]" 1 1454 1 66 GLN HA 1 66 GLN HE21 . . 5.500 4.749 4.009 5.130 . 0 0 "[ . 1 . 2]" 1 1455 1 66 GLN HA 1 66 GLN QG . . 3.660 2.347 2.111 2.864 . 0 0 "[ . 1 . 2]" 1 1456 1 66 GLN HA 1 69 VAL H . . 4.560 3.378 3.230 3.630 . 0 0 "[ . 1 . 2]" 1 1457 1 66 GLN HA 1 69 VAL QG . . 3.530 2.522 2.261 3.255 . 0 0 "[ . 1 . 2]" 1 1458 1 66 GLN HA 1 70 HIS H . . 4.670 3.991 3.741 4.216 . 0 0 "[ . 1 . 2]" 1 1459 1 66 GLN HA 1 70 HIS HD2 . . 5.030 3.856 3.415 4.329 . 0 0 "[ . 1 . 2]" 1 1460 1 66 GLN QB 1 67 TYR H . . 3.750 2.583 2.502 2.643 . 0 0 "[ . 1 . 2]" 1 1461 1 66 GLN QB 1 67 TYR QB . . 4.950 3.930 3.847 3.975 . 0 0 "[ . 1 . 2]" 1 1462 1 66 GLN QB 1 70 HIS HE1 . . 4.480 3.153 2.556 4.155 . 0 0 "[ . 1 . 2]" 1 1463 1 66 GLN QG 1 67 TYR H . . 4.760 4.187 3.782 4.355 . 0 0 "[ . 1 . 2]" 1 1464 1 66 GLN QG 1 69 VAL QG . . 4.950 3.626 3.281 4.081 . 0 0 "[ . 1 . 2]" 1 1465 1 66 GLN QG 1 70 HIS HE1 . . 5.380 4.832 4.094 5.177 . 0 0 "[ . 1 . 2]" 1 1466 1 67 TYR H 1 67 TYR QB . . 3.300 2.050 1.985 2.087 . 0 0 "[ . 1 . 2]" 1 1467 1 67 TYR H 1 67 TYR QD . . 4.050 4.030 3.931 4.081 0.031 4 0 "[ . 1 . 2]" 1 1468 1 67 TYR H 1 68 LYS H . . 3.750 2.827 2.727 3.043 . 0 0 "[ . 1 . 2]" 1 1469 1 67 TYR H 1 68 LYS HA . . 5.420 5.305 5.221 5.487 0.067 7 0 "[ . 1 . 2]" 1 1470 1 67 TYR HA 1 67 TYR QD . . 3.370 3.211 2.601 3.348 . 0 0 "[ . 1 . 2]" 1 1471 1 67 TYR HA 1 68 LYS HA . . 4.850 4.775 4.731 4.881 0.031 9 0 "[ . 1 . 2]" 1 1472 1 67 TYR HA 1 69 VAL H . . 5.500 4.614 3.774 5.215 . 0 0 "[ . 1 . 2]" 1 1473 1 67 TYR HA 1 70 HIS H . . 4.510 3.400 3.131 3.675 . 0 0 "[ . 1 . 2]" 1 1474 1 67 TYR HA 1 70 HIS HB2 . . 4.060 2.192 1.986 2.475 . 0 0 "[ . 1 . 2]" 1 1475 1 67 TYR HA 1 70 HIS HB3 . . 3.950 3.670 3.469 4.001 0.051 7 0 "[ . 1 . 2]" 1 1476 1 67 TYR HA 1 70 HIS HD2 . . 4.560 4.481 4.198 4.598 0.038 9 0 "[ . 1 . 2]" 1 1477 1 67 TYR QB 1 68 LYS H . . 3.890 2.781 2.122 3.025 . 0 0 "[ . 1 . 2]" 1 1478 1 67 TYR QB 1 68 LYS HA . . 4.850 4.270 4.040 4.405 . 0 0 "[ . 1 . 2]" 1 1479 1 67 TYR QD 1 68 LYS H . . 4.050 3.140 2.648 3.522 . 0 0 "[ . 1 . 2]" 1 1480 1 67 TYR QD 1 68 LYS HA . . 3.970 2.750 2.486 3.529 . 0 0 "[ . 1 . 2]" 1 1481 1 67 TYR QD 1 68 LYS QB . . 4.120 4.058 3.456 4.197 0.077 16 0 "[ . 1 . 2]" 1 1482 1 67 TYR QD 1 68 LYS HG2 . . 4.850 2.780 1.980 4.502 . 0 0 "[ . 1 . 2]" 1 1483 1 67 TYR QD 1 68 LYS HG3 . . 4.480 4.221 3.417 4.852 0.372 1 0 "[ . 1 . 2]" 1 1484 1 67 TYR QD 1 71 LEU QD . . 4.120 3.501 2.912 3.772 . 0 0 "[ . 1 . 2]" 1 1485 1 67 TYR QE 1 71 LEU QD . . 3.220 2.509 1.964 2.725 . 0 0 "[ . 1 . 2]" 1 1486 1 67 TYR QE 1 71 LEU HG . . 5.350 4.721 3.096 5.365 0.015 17 0 "[ . 1 . 2]" 1 1487 1 68 LYS H 1 68 LYS QB . . 3.150 2.292 2.124 2.632 . 0 0 "[ . 1 . 2]" 1 1488 1 68 LYS H 1 68 LYS QD . . 5.500 4.227 2.894 4.488 . 0 0 "[ . 1 . 2]" 1 1489 1 68 LYS H 1 68 LYS HG2 . . 4.410 2.821 1.939 4.305 . 0 0 "[ . 1 . 2]" 1 1490 1 68 LYS H 1 68 LYS HG3 . . 4.510 3.330 2.471 4.414 . 0 0 "[ . 1 . 2]" 1 1491 1 68 LYS H 1 69 VAL H . . 3.950 2.726 2.634 2.890 . 0 0 "[ . 1 . 2]" 1 1492 1 68 LYS H 1 69 VAL QG . . 4.560 3.711 3.493 4.414 . 0 0 "[ . 1 . 2]" 1 1493 1 68 LYS H 1 70 HIS H . . 4.950 3.943 3.702 4.834 . 0 0 "[ . 1 . 2]" 1 1494 1 68 LYS H 1 71 LEU H . . 5.500 4.803 4.689 5.096 . 0 0 "[ . 1 . 2]" 1 1495 1 68 LYS HA 1 68 LYS QD . . 4.850 2.954 1.962 3.708 . 0 0 "[ . 1 . 2]" 1 1496 1 68 LYS HA 1 68 LYS QE . . 4.850 3.387 2.098 4.562 . 0 0 "[ . 1 . 2]" 1 1497 1 68 LYS HA 1 68 LYS HG2 . . 3.460 2.392 2.042 3.109 . 0 0 "[ . 1 . 2]" 1 1498 1 68 LYS HA 1 68 LYS HG3 . . 4.040 3.561 3.181 3.755 . 0 0 "[ . 1 . 2]" 1 1499 1 68 LYS HA 1 71 LEU H . . 5.060 3.803 3.689 4.075 . 0 0 "[ . 1 . 2]" 1 1500 1 68 LYS HA 1 71 LEU HB2 . . 4.770 3.447 2.980 3.802 . 0 0 "[ . 1 . 2]" 1 1501 1 68 LYS HA 1 71 LEU QD . . 3.770 3.266 2.437 3.684 . 0 0 "[ . 1 . 2]" 1 1502 1 68 LYS QB 1 68 LYS QE . . 4.560 3.452 2.018 3.799 . 0 0 "[ . 1 . 2]" 1 1503 1 68 LYS QB 1 69 VAL H . . 3.770 2.527 2.210 3.046 . 0 0 "[ . 1 . 2]" 1 1504 1 68 LYS QB 1 69 VAL HA . . 4.770 3.947 3.834 4.261 . 0 0 "[ . 1 . 2]" 1 1505 1 68 LYS QB 1 69 VAL QG . . 3.820 2.839 2.597 3.337 . 0 0 "[ . 1 . 2]" 1 1506 1 68 LYS QD 1 71 LEU QD . . 5.060 4.455 3.417 4.939 . 0 0 "[ . 1 . 2]" 1 1507 1 68 LYS QE 1 71 LEU QD . . 4.950 4.144 3.122 4.873 . 0 0 "[ . 1 . 2]" 1 1508 1 68 LYS HG3 1 69 VAL QG . . 4.950 4.815 4.655 5.443 0.493 3 0 "[ . 1 . 2]" 1 1509 1 69 VAL H 1 69 VAL HB . . 3.450 3.232 2.139 3.500 0.050 20 0 "[ . 1 . 2]" 1 1510 1 69 VAL H 1 69 VAL QG . . 3.180 1.987 1.806 2.740 . 0 0 "[ . 1 . 2]" 1 1511 1 69 VAL H 1 70 HIS H . . 3.890 2.611 2.353 2.830 . 0 0 "[ . 1 . 2]" 1 1512 1 69 VAL H 1 70 HIS HB2 . . 5.340 4.648 4.334 4.872 . 0 0 "[ . 1 . 2]" 1 1513 1 69 VAL HA 1 69 VAL QG . . 3.010 2.369 2.135 2.453 . 0 0 "[ . 1 . 2]" 1 1514 1 69 VAL HA 1 70 HIS HA . . 4.850 4.879 4.832 4.917 0.067 10 0 "[ . 1 . 2]" 1 1515 1 69 VAL HA 1 72 ASP H . . 4.560 3.175 2.997 3.521 . 0 0 "[ . 1 . 2]" 1 1516 1 69 VAL HA 1 72 ASP HB2 . . 3.910 2.526 2.381 3.106 . 0 0 "[ . 1 . 2]" 1 1517 1 69 VAL HA 1 72 ASP HB3 . . 3.970 3.902 3.785 3.973 0.003 13 0 "[ . 1 . 2]" 1 1518 1 69 VAL HA 1 73 LEU H . . 4.950 4.189 3.979 4.416 . 0 0 "[ . 1 . 2]" 1 1519 1 69 VAL HB 1 70 HIS H . . 4.900 3.715 2.248 4.075 . 0 0 "[ . 1 . 2]" 1 1520 1 69 VAL HB 1 70 HIS HA . . 5.190 4.821 4.315 4.970 . 0 0 "[ . 1 . 2]" 1 1521 1 69 VAL HB 1 70 HIS HD2 . . 4.270 4.060 2.529 4.370 0.100 5 0 "[ . 1 . 2]" 1 1522 1 69 VAL QG 1 70 HIS H . . 4.060 2.202 1.942 2.781 . 0 0 "[ . 1 . 2]" 1 1523 1 69 VAL QG 1 70 HIS HA . . 4.180 2.820 2.724 3.065 . 0 0 "[ . 1 . 2]" 1 1524 1 69 VAL QG 1 70 HIS HB2 . . 4.770 4.016 3.803 4.611 . 0 0 "[ . 1 . 2]" 1 1525 1 69 VAL QG 1 70 HIS HB3 . . 4.950 4.495 4.342 4.919 . 0 0 "[ . 1 . 2]" 1 1526 1 69 VAL QG 1 70 HIS HD2 . . 3.490 1.917 1.760 2.555 . 0 0 "[ . 1 . 2]" 1 1527 1 69 VAL QG 1 72 ASP H . . 5.500 4.240 4.115 4.382 . 0 0 "[ . 1 . 2]" 1 1528 1 69 VAL QG 1 72 ASP HB2 . . 4.560 3.965 3.647 4.095 . 0 0 "[ . 1 . 2]" 1 1529 1 69 VAL QG 1 72 ASP HB3 . . 5.190 4.550 3.695 4.769 . 0 0 "[ . 1 . 2]" 1 1530 1 69 VAL QG 1 73 LEU H . . 4.770 3.868 3.605 4.149 . 0 0 "[ . 1 . 2]" 1 1531 1 69 VAL QG 1 73 LEU MD2 . . 4.280 2.860 2.330 3.148 . 0 0 "[ . 1 . 2]" 1 1532 1 69 VAL QG 1 73 LEU HG . . 3.950 2.407 2.106 2.830 . 0 0 "[ . 1 . 2]" 1 1533 1 70 HIS H 1 70 HIS HB2 . . 3.720 2.457 2.372 2.569 . 0 0 "[ . 1 . 2]" 1 1534 1 70 HIS H 1 70 HIS HB3 . . 3.780 3.544 3.532 3.558 . 0 0 "[ . 1 . 2]" 1 1535 1 70 HIS H 1 70 HIS HD2 . . 4.480 2.295 1.930 2.456 . 0 0 "[ . 1 . 2]" 1 1536 1 70 HIS H 1 71 LEU H . . 4.270 2.943 2.815 3.078 . 0 0 "[ . 1 . 2]" 1 1537 1 70 HIS H 1 72 ASP H . . 5.040 4.297 4.125 4.866 . 0 0 "[ . 1 . 2]" 1 1538 1 70 HIS H 1 73 LEU MD1 . . 5.190 4.108 3.480 4.414 . 0 0 "[ . 1 . 2]" 1 1539 1 70 HIS HA 1 70 HIS HD2 . . 3.610 2.673 2.547 3.030 . 0 0 "[ . 1 . 2]" 1 1540 1 70 HIS HA 1 73 LEU H . . 3.910 3.148 2.947 3.366 . 0 0 "[ . 1 . 2]" 1 1541 1 70 HIS HA 1 73 LEU HB2 . . 3.930 2.559 2.269 2.882 . 0 0 "[ . 1 . 2]" 1 1542 1 70 HIS HA 1 73 LEU HB3 . . 4.320 4.047 3.849 4.336 0.016 2 0 "[ . 1 . 2]" 1 1543 1 70 HIS HA 1 73 LEU MD1 . . 3.700 2.647 2.205 3.135 . 0 0 "[ . 1 . 2]" 1 1544 1 70 HIS HA 1 73 LEU MD2 . . 4.560 3.963 3.766 4.179 . 0 0 "[ . 1 . 2]" 1 1545 1 70 HIS HA 1 73 LEU HG . . 4.320 2.289 2.023 2.581 . 0 0 "[ . 1 . 2]" 1 1546 1 70 HIS HA 1 74 TRP H . . 4.700 3.996 3.752 4.279 . 0 0 "[ . 1 . 2]" 1 1547 1 70 HIS HB2 1 71 LEU H . . 4.620 2.630 2.454 2.820 . 0 0 "[ . 1 . 2]" 1 1548 1 70 HIS HB3 1 71 LEU H . . 4.620 3.551 3.305 3.838 . 0 0 "[ . 1 . 2]" 1 1549 1 70 HIS HB3 1 73 LEU HG . . 5.060 4.791 4.518 5.075 0.015 20 0 "[ . 1 . 2]" 1 1550 1 70 HIS HD2 1 73 LEU HB2 . . 5.190 4.840 4.344 5.206 0.016 5 0 "[ . 1 . 2]" 1 1551 1 70 HIS HD2 1 73 LEU MD1 . . 4.280 2.862 2.552 3.192 . 0 0 "[ . 1 . 2]" 1 1552 1 71 LEU H 1 71 LEU HB3 . . 4.090 3.103 2.714 3.539 . 0 0 "[ . 1 . 2]" 1 1553 1 71 LEU H 1 71 LEU QD . . 4.730 3.215 2.993 3.472 . 0 0 "[ . 1 . 2]" 1 1554 1 71 LEU H 1 71 LEU HG . . 5.190 3.745 2.085 4.531 . 0 0 "[ . 1 . 2]" 1 1555 1 71 LEU H 1 72 ASP H . . 4.870 2.811 2.596 3.139 . 0 0 "[ . 1 . 2]" 1 1556 1 71 LEU HA 1 71 LEU QD . . 3.130 2.019 1.955 2.126 . 0 0 "[ . 1 . 2]" 1 1557 1 71 LEU HA 1 71 LEU HG . . 4.120 2.836 2.725 2.955 . 0 0 "[ . 1 . 2]" 1 1558 1 71 LEU HA 1 74 TRP H . . 4.090 3.363 3.162 3.493 . 0 0 "[ . 1 . 2]" 1 1559 1 71 LEU HA 1 74 TRP HB2 . . 4.060 3.814 3.625 3.980 . 0 0 "[ . 1 . 2]" 1 1560 1 71 LEU HA 1 74 TRP HB3 . . 3.950 2.525 2.197 2.746 . 0 0 "[ . 1 . 2]" 1 1561 1 71 LEU HA 1 74 TRP HE3 . . 4.040 3.250 2.593 3.748 . 0 0 "[ . 1 . 2]" 1 1562 1 71 LEU HA 1 75 VAL H . . 5.500 4.389 3.898 4.705 . 0 0 "[ . 1 . 2]" 1 1563 1 71 LEU HA 1 75 VAL MG2 . . 4.560 4.070 3.648 4.452 . 0 0 "[ . 1 . 2]" 1 1564 1 71 LEU HB2 1 72 ASP H . . 4.950 3.270 2.324 3.816 . 0 0 "[ . 1 . 2]" 1 1565 1 71 LEU HB3 1 71 LEU QD . . 3.070 2.258 2.121 2.391 . 0 0 "[ . 1 . 2]" 1 1566 1 71 LEU HB3 1 72 ASP H . . 4.060 3.020 2.468 3.602 . 0 0 "[ . 1 . 2]" 1 1567 1 71 LEU HB3 1 74 TRP HE3 . . 5.190 4.408 3.182 5.193 0.003 9 0 "[ . 1 . 2]" 1 1568 1 71 LEU QD 1 72 ASP H . . 4.790 4.161 3.910 4.270 . 0 0 "[ . 1 . 2]" 1 1569 1 71 LEU QD 1 74 TRP HB2 . . 4.450 4.298 4.147 4.401 . 0 0 "[ . 1 . 2]" 1 1570 1 71 LEU QD 1 74 TRP HB3 . . 4.250 3.351 3.162 3.485 . 0 0 "[ . 1 . 2]" 1 1571 1 71 LEU QD 1 74 TRP HE3 . . 3.410 3.151 2.528 3.356 . 0 0 "[ . 1 . 2]" 1 1572 1 71 LEU QD 1 74 TRP HZ3 . . 4.280 3.804 3.269 4.067 . 0 0 "[ . 1 . 2]" 1 1573 1 71 LEU QD 1 86 TYR QE . . 4.450 3.530 3.257 3.861 . 0 0 "[ . 1 . 2]" 1 1574 1 71 LEU HG 1 72 ASP H . . 5.190 4.605 4.161 4.799 . 0 0 "[ . 1 . 2]" 1 1575 1 71 LEU HG 1 74 TRP HE3 . . 5.190 4.053 3.134 5.203 0.013 2 0 "[ . 1 . 2]" 1 1576 1 72 ASP H 1 72 ASP HB2 . . 3.450 2.023 2.005 2.051 . 0 0 "[ . 1 . 2]" 1 1577 1 72 ASP H 1 72 ASP HB3 . . 3.600 3.252 3.105 3.343 . 0 0 "[ . 1 . 2]" 1 1578 1 72 ASP H 1 73 LEU H . . 3.860 2.615 2.401 2.941 . 0 0 "[ . 1 . 2]" 1 1579 1 72 ASP H 1 74 TRP H . . 5.500 3.973 3.823 4.197 . 0 0 "[ . 1 . 2]" 1 1580 1 72 ASP HA 1 75 VAL H . . 5.420 3.184 2.979 3.345 . 0 0 "[ . 1 . 2]" 1 1581 1 72 ASP HA 1 75 VAL HB . . 3.570 2.453 2.302 2.741 . 0 0 "[ . 1 . 2]" 1 1582 1 72 ASP HA 1 75 VAL MG1 . . 4.410 3.776 3.620 4.045 . 0 0 "[ . 1 . 2]" 1 1583 1 72 ASP HA 1 75 VAL MG2 . . 4.040 2.447 2.356 2.556 . 0 0 "[ . 1 . 2]" 1 1584 1 72 ASP HA 1 76 LYS H . . 4.990 4.243 4.062 4.515 . 0 0 "[ . 1 . 2]" 1 1585 1 72 ASP HB2 1 73 LEU H . . 3.890 3.020 2.873 3.311 . 0 0 "[ . 1 . 2]" 1 1586 1 72 ASP HB2 1 73 LEU HA . . 5.280 4.929 4.819 5.248 . 0 0 "[ . 1 . 2]" 1 1587 1 72 ASP HB2 1 73 LEU MD2 . . 4.950 3.417 3.171 4.011 . 0 0 "[ . 1 . 2]" 1 1588 1 72 ASP HB2 1 73 LEU HG . . 4.850 4.102 3.857 4.345 . 0 0 "[ . 1 . 2]" 1 1589 1 72 ASP HB3 1 73 LEU H . . 3.850 2.935 2.564 3.169 . 0 0 "[ . 1 . 2]" 1 1590 1 72 ASP HB3 1 73 LEU HA . . 4.950 3.763 3.698 3.834 . 0 0 "[ . 1 . 2]" 1 1591 1 72 ASP HB3 1 73 LEU MD2 . . 4.510 2.564 2.388 2.944 . 0 0 "[ . 1 . 2]" 1 1592 1 72 ASP HB3 1 73 LEU HG . . 4.770 4.080 3.455 4.375 . 0 0 "[ . 1 . 2]" 1 1593 1 72 ASP HB3 1 75 VAL MG2 . . 4.950 4.949 4.869 4.973 0.023 7 0 "[ . 1 . 2]" 1 1594 1 72 ASP HB3 1 76 LYS QD . . 4.770 3.600 2.775 4.770 . 0 0 "[ . 1 . 2]" 1 1595 1 73 LEU H 1 73 LEU HB2 . . 3.600 2.627 2.495 2.745 . 0 0 "[ . 1 . 2]" 1 1596 1 73 LEU H 1 73 LEU HB3 . . 3.780 3.531 3.518 3.543 . 0 0 "[ . 1 . 2]" 1 1597 1 73 LEU H 1 73 LEU MD1 . . 4.150 3.708 3.583 3.870 . 0 0 "[ . 1 . 2]" 1 1598 1 73 LEU H 1 73 LEU MD2 . . 3.910 2.422 2.168 2.777 . 0 0 "[ . 1 . 2]" 1 1599 1 73 LEU H 1 73 LEU HG . . 3.300 2.113 1.963 2.369 . 0 0 "[ . 1 . 2]" 1 1600 1 73 LEU H 1 74 TRP H . . 3.670 2.641 2.577 2.735 . 0 0 "[ . 1 . 2]" 1 1601 1 73 LEU H 1 74 TRP HA . . 5.500 5.200 5.145 5.273 . 0 0 "[ . 1 . 2]" 1 1602 1 73 LEU HA 1 73 LEU MD1 . . 3.970 3.744 3.625 3.860 . 0 0 "[ . 1 . 2]" 1 1603 1 73 LEU HA 1 73 LEU MD2 . . 3.060 2.016 1.956 2.127 . 0 0 "[ . 1 . 2]" 1 1604 1 73 LEU HA 1 73 LEU HG . . 3.990 3.479 3.313 3.534 . 0 0 "[ . 1 . 2]" 1 1605 1 73 LEU HA 1 76 LYS H . . 3.970 3.183 2.882 3.370 . 0 0 "[ . 1 . 2]" 1 1606 1 73 LEU HA 1 76 LYS QB . . 3.050 2.689 2.254 3.056 0.006 20 0 "[ . 1 . 2]" 1 1607 1 73 LEU HA 1 76 LYS QD . . 4.010 2.516 1.983 4.010 0.000 11 0 "[ . 1 . 2]" 1 1608 1 73 LEU HA 1 76 LYS QE . . 4.620 3.836 1.862 4.438 . 0 0 "[ . 1 . 2]" 1 1609 1 73 LEU HA 1 76 LYS HG2 . . 4.950 4.512 3.637 4.959 0.009 13 0 "[ . 1 . 2]" 1 1610 1 73 LEU HA 1 77 SER H . . 4.910 4.739 4.626 4.924 0.014 7 0 "[ . 1 . 2]" 1 1611 1 73 LEU HB2 1 73 LEU MD1 . . 3.360 2.534 2.381 2.640 . 0 0 "[ . 1 . 2]" 1 1612 1 73 LEU HB2 1 74 TRP H . . 4.000 2.838 2.694 3.026 . 0 0 "[ . 1 . 2]" 1 1613 1 73 LEU HB2 1 74 TRP HA . . 4.770 4.222 4.090 4.314 . 0 0 "[ . 1 . 2]" 1 1614 1 73 LEU HB3 1 73 LEU MD1 . . 2.860 2.154 2.032 2.318 . 0 0 "[ . 1 . 2]" 1 1615 1 73 LEU HB3 1 74 TRP H . . 4.230 3.999 3.883 4.127 . 0 0 "[ . 1 . 2]" 1 1616 1 73 LEU HB3 1 74 TRP HA . . 4.950 4.742 4.602 4.880 . 0 0 "[ . 1 . 2]" 1 1617 1 73 LEU MD1 1 74 TRP H . . 5.060 4.834 4.654 5.031 . 0 0 "[ . 1 . 2]" 1 1618 1 73 LEU MD2 1 74 TRP H . . 4.760 4.311 4.252 4.545 . 0 0 "[ . 1 . 2]" 1 1619 1 73 LEU MD2 1 76 LYS QB . . 4.180 3.828 3.383 4.162 . 0 0 "[ . 1 . 2]" 1 1620 1 73 LEU MD2 1 76 LYS QD . . 3.950 2.594 2.115 3.590 . 0 0 "[ . 1 . 2]" 1 1621 1 73 LEU MD2 1 76 LYS QE . . 3.990 3.369 1.737 3.984 . 0 0 "[ . 1 . 2]" 1 1622 1 73 LEU HG 1 74 TRP H . . 4.950 4.147 3.871 4.369 . 0 0 "[ . 1 . 2]" 1 1623 1 74 TRP H 1 74 TRP HB2 . . 3.620 2.830 2.782 2.855 . 0 0 "[ . 1 . 2]" 1 1624 1 74 TRP H 1 74 TRP HB3 . . 3.620 2.172 2.145 2.211 . 0 0 "[ . 1 . 2]" 1 1625 1 74 TRP H 1 74 TRP HD1 . . 5.210 5.255 5.234 5.271 0.061 17 0 "[ . 1 . 2]" 1 1626 1 74 TRP H 1 74 TRP HE3 . . 4.800 3.890 3.825 3.955 . 0 0 "[ . 1 . 2]" 1 1627 1 74 TRP H 1 75 VAL H . . 4.020 2.481 2.366 2.558 . 0 0 "[ . 1 . 2]" 1 1628 1 74 TRP H 1 75 VAL HA . . 5.500 5.056 4.975 5.130 . 0 0 "[ . 1 . 2]" 1 1629 1 74 TRP H 1 75 VAL HB . . 5.340 4.501 4.386 4.714 . 0 0 "[ . 1 . 2]" 1 1630 1 74 TRP H 1 75 VAL MG2 . . 4.790 4.127 3.862 4.231 . 0 0 "[ . 1 . 2]" 1 1631 1 74 TRP H 1 76 LYS H . . 4.950 4.145 3.816 4.329 . 0 0 "[ . 1 . 2]" 1 1632 1 74 TRP HA 1 74 TRP HD1 . . 3.640 3.299 3.233 3.333 . 0 0 "[ . 1 . 2]" 1 1633 1 74 TRP HA 1 74 TRP HE1 . . 5.470 5.464 5.393 5.505 0.035 8 0 "[ . 1 . 2]" 1 1634 1 74 TRP HA 1 74 TRP HE3 . . 4.620 4.677 4.639 4.711 0.091 2 0 "[ . 1 . 2]" 1 1635 1 74 TRP HA 1 76 LYS H . . 5.190 4.507 4.206 4.682 . 0 0 "[ . 1 . 2]" 1 1636 1 74 TRP HA 1 77 SER H . . 4.230 3.546 3.430 3.717 . 0 0 "[ . 1 . 2]" 1 1637 1 74 TRP HB2 1 74 TRP HD1 . . 3.720 2.748 2.732 2.759 . 0 0 "[ . 1 . 2]" 1 1638 1 74 TRP HB2 1 74 TRP HE1 . . 5.420 4.958 4.952 4.962 . 0 0 "[ . 1 . 2]" 1 1639 1 74 TRP HB2 1 74 TRP HE3 . . 4.120 4.037 4.028 4.052 . 0 0 "[ . 1 . 2]" 1 1640 1 74 TRP HB2 1 75 VAL H . . 4.620 4.271 4.207 4.312 . 0 0 "[ . 1 . 2]" 1 1641 1 74 TRP HB3 1 74 TRP HE3 . . 3.790 2.483 2.469 2.504 . 0 0 "[ . 1 . 2]" 1 1642 1 74 TRP HB3 1 75 VAL H . . 4.360 3.088 2.974 3.178 . 0 0 "[ . 1 . 2]" 1 1643 1 74 TRP HB3 1 75 VAL MG2 . . 4.450 3.741 3.466 3.846 . 0 0 "[ . 1 . 2]" 1 1644 1 74 TRP HB3 1 76 LYS H . . 5.500 5.383 5.128 5.516 0.016 10 0 "[ . 1 . 2]" 1 1645 1 74 TRP HD1 1 77 SER QB . . 4.850 4.226 3.977 4.554 . 0 0 "[ . 1 . 2]" 1 1646 1 74 TRP HD1 1 78 LEU MD2 . . 4.700 4.114 3.770 4.487 . 0 0 "[ . 1 . 2]" 1 1647 1 74 TRP HE1 1 78 LEU MD1 . . 5.150 4.376 4.087 4.624 . 0 0 "[ . 1 . 2]" 1 1648 1 74 TRP HE1 1 78 LEU MD2 . . 3.970 2.938 2.530 3.288 . 0 0 "[ . 1 . 2]" 1 1649 1 74 TRP HE1 1 78 LEU HG . . 5.500 4.485 4.262 4.649 . 0 0 "[ . 1 . 2]" 1 1650 1 74 TRP HE3 1 75 VAL H . . 4.480 3.020 2.838 3.208 . 0 0 "[ . 1 . 2]" 1 1651 1 74 TRP HE3 1 75 VAL HA . . 4.320 3.481 3.361 3.596 . 0 0 "[ . 1 . 2]" 1 1652 1 74 TRP HE3 1 75 VAL HB . . 5.030 4.128 3.993 4.235 . 0 0 "[ . 1 . 2]" 1 1653 1 74 TRP HE3 1 75 VAL MG1 . . 4.620 4.548 4.304 4.628 0.008 6 0 "[ . 1 . 2]" 1 1654 1 74 TRP HE3 1 75 VAL MG2 . . 3.270 1.957 1.831 2.093 . 0 0 "[ . 1 . 2]" 1 1655 1 74 TRP HE3 1 78 LEU MD1 . . 5.380 3.328 3.186 3.529 . 0 0 "[ . 1 . 2]" 1 1656 1 74 TRP HE3 1 86 TYR QE . . 5.030 4.005 3.650 4.445 . 0 0 "[ . 1 . 2]" 1 1657 1 74 TRP HH2 1 75 VAL MG2 . . 4.800 4.032 3.869 4.134 . 0 0 "[ . 1 . 2]" 1 1658 1 74 TRP HH2 1 78 LEU MD1 . . 4.480 2.353 2.237 2.667 . 0 0 "[ . 1 . 2]" 1 1659 1 74 TRP HH2 1 78 LEU MD2 . . 4.700 3.621 3.322 4.028 . 0 0 "[ . 1 . 2]" 1 1660 1 74 TRP HH2 1 86 TYR HB2 . . 5.060 3.338 3.196 3.584 . 0 0 "[ . 1 . 2]" 1 1661 1 74 TRP HH2 1 86 TYR HB3 . . 4.800 4.804 4.762 4.818 0.018 19 0 "[ . 1 . 2]" 1 1662 1 74 TRP HH2 1 86 TYR QD . . 4.020 2.377 2.055 2.701 . 0 0 "[ . 1 . 2]" 1 1663 1 74 TRP HZ2 1 78 LEU MD1 . . 4.480 2.817 2.542 3.057 . 0 0 "[ . 1 . 2]" 1 1664 1 74 TRP HZ2 1 78 LEU MD2 . . 3.830 2.404 2.143 2.868 . 0 0 "[ . 1 . 2]" 1 1665 1 74 TRP HZ3 1 75 VAL MG2 . . 4.120 2.277 2.070 2.385 . 0 0 "[ . 1 . 2]" 1 1666 1 74 TRP HZ3 1 78 LEU MD1 . . 4.850 2.584 2.411 2.936 . 0 0 "[ . 1 . 2]" 1 1667 1 74 TRP HZ3 1 86 TYR QD . . 4.700 2.591 2.033 3.439 . 0 0 "[ . 1 . 2]" 1 1668 1 74 TRP HZ3 1 86 TYR QE . . 4.320 2.282 2.059 2.630 . 0 0 "[ . 1 . 2]" 1 1669 1 75 VAL H 1 75 VAL HB . . 3.620 2.250 2.196 2.352 . 0 0 "[ . 1 . 2]" 1 1670 1 75 VAL H 1 75 VAL MG1 . . 4.180 3.662 3.633 3.709 . 0 0 "[ . 1 . 2]" 1 1671 1 75 VAL H 1 75 VAL MG2 . . 3.490 2.523 2.311 2.638 . 0 0 "[ . 1 . 2]" 1 1672 1 75 VAL H 1 76 LYS H . . 3.830 2.547 2.334 2.738 . 0 0 "[ . 1 . 2]" 1 1673 1 75 VAL H 1 77 SER H . . 5.210 3.765 3.725 3.831 . 0 0 "[ . 1 . 2]" 1 1674 1 75 VAL HA 1 75 VAL MG1 . . 3.400 2.501 2.386 2.566 . 0 0 "[ . 1 . 2]" 1 1675 1 75 VAL HA 1 75 VAL MG2 . . 3.380 2.190 2.158 2.297 . 0 0 "[ . 1 . 2]" 1 1676 1 75 VAL HA 1 76 LYS HA . . 5.350 4.817 4.738 4.856 . 0 0 "[ . 1 . 2]" 1 1677 1 75 VAL HA 1 77 SER H . . 4.870 3.587 3.354 3.672 . 0 0 "[ . 1 . 2]" 1 1678 1 75 VAL HA 1 78 LEU H . . 4.510 2.874 2.740 3.400 . 0 0 "[ . 1 . 2]" 1 1679 1 75 VAL HA 1 78 LEU HB2 . . 4.510 2.492 2.247 2.721 . 0 0 "[ . 1 . 2]" 1 1680 1 75 VAL HA 1 78 LEU HB3 . . 4.450 3.926 3.798 4.076 . 0 0 "[ . 1 . 2]" 1 1681 1 75 VAL HA 1 78 LEU MD1 . . 3.540 2.343 2.119 2.550 . 0 0 "[ . 1 . 2]" 1 1682 1 75 VAL HA 1 78 LEU MD2 . . 4.450 3.819 3.730 4.149 . 0 0 "[ . 1 . 2]" 1 1683 1 75 VAL HA 1 78 LEU HG . . 3.600 2.122 1.992 2.609 . 0 0 "[ . 1 . 2]" 1 1684 1 75 VAL HA 1 83 ARG HA . . 5.190 4.987 4.756 5.156 . 0 0 "[ . 1 . 2]" 1 1685 1 75 VAL HA 1 83 ARG QG . . 4.620 3.773 3.014 4.013 . 0 0 "[ . 1 . 2]" 1 1686 1 75 VAL HA 1 86 TYR QD . . 5.030 5.046 5.008 5.080 0.050 9 0 "[ . 1 . 2]" 1 1687 1 75 VAL HB 1 76 LYS H . . 3.680 2.679 2.492 2.935 . 0 0 "[ . 1 . 2]" 1 1688 1 75 VAL HB 1 76 LYS HG3 . . 4.450 3.615 3.290 4.163 . 0 0 "[ . 1 . 2]" 1 1689 1 75 VAL HB 1 77 SER H . . 5.500 4.709 4.621 4.797 . 0 0 "[ . 1 . 2]" 1 1690 1 75 VAL HB 1 78 LEU MD1 . . 5.350 4.487 4.327 4.719 . 0 0 "[ . 1 . 2]" 1 1691 1 75 VAL HB 1 86 TYR QE . . 5.380 4.677 4.175 5.300 . 0 0 "[ . 1 . 2]" 1 1692 1 75 VAL MG1 1 76 LYS H . . 4.090 3.243 3.044 3.701 . 0 0 "[ . 1 . 2]" 1 1693 1 75 VAL MG1 1 76 LYS HA . . 3.950 3.289 3.153 3.621 . 0 0 "[ . 1 . 2]" 1 1694 1 75 VAL MG1 1 76 LYS HG2 . . 4.950 4.164 3.196 4.887 . 0 0 "[ . 1 . 2]" 1 1695 1 75 VAL MG1 1 77 SER H . . 4.990 4.424 4.388 4.507 . 0 0 "[ . 1 . 2]" 1 1696 1 75 VAL MG1 1 78 LEU H . . 4.950 3.994 3.836 4.085 . 0 0 "[ . 1 . 2]" 1 1697 1 75 VAL MG1 1 78 LEU MD1 . . 3.930 3.006 2.825 3.169 . 0 0 "[ . 1 . 2]" 1 1698 1 75 VAL MG1 1 78 LEU MD2 . . 4.850 4.864 4.831 4.940 0.090 19 0 "[ . 1 . 2]" 1 1699 1 75 VAL MG1 1 78 LEU HG . . 4.510 4.016 3.901 4.316 . 0 0 "[ . 1 . 2]" 1 1700 1 75 VAL MG1 1 83 ARG HA . . 4.850 3.707 3.241 3.817 . 0 0 "[ . 1 . 2]" 1 1701 1 75 VAL MG1 1 83 ARG HB2 . . 5.350 3.957 3.876 4.089 . 0 0 "[ . 1 . 2]" 1 1702 1 75 VAL MG1 1 83 ARG HB3 . . 4.950 4.417 4.039 4.519 . 0 0 "[ . 1 . 2]" 1 1703 1 75 VAL MG1 1 83 ARG QD . . 3.410 1.862 1.767 1.990 . 0 0 "[ . 1 . 2]" 1 1704 1 75 VAL MG1 1 83 ARG QG . . 3.450 1.944 1.727 2.008 . 0 0 "[ . 1 . 2]" 1 1705 1 75 VAL MG1 1 86 TYR QD . . 4.020 3.315 2.670 3.902 . 0 0 "[ . 1 . 2]" 1 1706 1 75 VAL MG1 1 86 TYR QE . . 4.510 3.092 2.459 3.804 . 0 0 "[ . 1 . 2]" 1 1707 1 75 VAL MG2 1 76 LYS H . . 4.370 4.007 3.930 4.088 . 0 0 "[ . 1 . 2]" 1 1708 1 75 VAL MG2 1 77 SER H . . 5.500 4.945 4.853 4.986 . 0 0 "[ . 1 . 2]" 1 1709 1 75 VAL MG2 1 78 LEU H . . 5.500 4.679 4.546 5.103 . 0 0 "[ . 1 . 2]" 1 1710 1 75 VAL MG2 1 78 LEU MD1 . . 4.010 2.345 2.179 2.646 . 0 0 "[ . 1 . 2]" 1 1711 1 75 VAL MG2 1 78 LEU MD2 . . 4.690 4.418 4.272 4.701 0.011 9 0 "[ . 1 . 2]" 1 1712 1 75 VAL MG2 1 78 LEU HG . . 3.830 3.476 3.306 3.845 0.015 9 0 "[ . 1 . 2]" 1 1713 1 75 VAL MG2 1 83 ARG QD . . 4.410 4.099 3.930 4.511 0.101 9 0 "[ . 1 . 2]" 1 1714 1 75 VAL MG2 1 83 ARG QG . . 3.610 3.618 3.596 3.642 0.032 19 0 "[ . 1 . 2]" 1 1715 1 75 VAL MG2 1 86 TYR QD . . 4.080 3.156 2.932 3.283 . 0 0 "[ . 1 . 2]" 1 1716 1 75 VAL MG2 1 86 TYR QE . . 3.570 2.450 1.967 2.831 . 0 0 "[ . 1 . 2]" 1 1717 1 76 LYS H 1 76 LYS QB . . 3.110 2.385 2.112 2.623 . 0 0 "[ . 1 . 2]" 1 1718 1 76 LYS H 1 76 LYS QD . . 4.450 3.577 3.253 4.271 . 0 0 "[ . 1 . 2]" 1 1719 1 76 LYS H 1 76 LYS QE . . 4.950 4.360 2.970 4.843 . 0 0 "[ . 1 . 2]" 1 1720 1 76 LYS H 1 76 LYS HG2 . . 4.410 3.379 2.033 4.161 . 0 0 "[ . 1 . 2]" 1 1721 1 76 LYS H 1 76 LYS HG3 . . 3.630 2.265 1.969 2.983 . 0 0 "[ . 1 . 2]" 1 1722 1 76 LYS H 1 77 SER H . . 3.510 2.703 2.568 2.786 . 0 0 "[ . 1 . 2]" 1 1723 1 76 LYS H 1 78 LEU H . . 5.090 4.083 3.941 4.201 . 0 0 "[ . 1 . 2]" 1 1724 1 76 LYS HA 1 76 LYS QD . . 4.280 4.021 3.291 4.207 . 0 0 "[ . 1 . 2]" 1 1725 1 76 LYS HA 1 76 LYS QE . . 4.090 4.030 3.818 4.101 0.011 13 0 "[ . 1 . 2]" 1 1726 1 76 LYS HA 1 76 LYS HG2 . . 3.610 2.561 2.388 2.789 . 0 0 "[ . 1 . 2]" 1 1727 1 76 LYS HA 1 76 LYS HG3 . . 4.120 2.860 2.290 3.694 . 0 0 "[ . 1 . 2]" 1 1728 1 76 LYS HA 1 78 LEU H . . 4.950 4.147 3.532 4.459 . 0 0 "[ . 1 . 2]" 1 1729 1 76 LYS QB 1 76 LYS QD . . 3.300 2.240 1.975 2.387 . 0 0 "[ . 1 . 2]" 1 1730 1 76 LYS QB 1 76 LYS QE . . 3.750 2.257 1.930 3.559 . 0 0 "[ . 1 . 2]" 1 1731 1 76 LYS QB 1 77 SER H . . 3.760 3.171 3.055 3.440 . 0 0 "[ . 1 . 2]" 1 1732 1 76 LYS QB 1 77 SER HA . . 4.560 4.104 4.037 4.244 . 0 0 "[ . 1 . 2]" 1 1733 1 76 LYS QB 1 78 LEU H . . 5.040 4.829 4.610 4.916 . 0 0 "[ . 1 . 2]" 1 1734 1 76 LYS QE 1 76 LYS HG2 . . 3.800 2.611 2.152 3.397 . 0 0 "[ . 1 . 2]" 1 1735 1 76 LYS HG2 1 77 SER H . . 5.500 5.216 4.446 5.519 0.019 15 0 "[ . 1 . 2]" 1 1736 1 77 SER H 1 77 SER QB . . 3.260 2.266 2.085 2.520 . 0 0 "[ . 1 . 2]" 1 1737 1 77 SER H 1 78 LEU H . . 3.420 2.214 1.933 2.376 . 0 0 "[ . 1 . 2]" 1 1738 1 77 SER H 1 78 LEU HB2 . . 4.450 4.182 3.803 4.328 . 0 0 "[ . 1 . 2]" 1 1739 1 77 SER H 1 78 LEU MD2 . . 5.420 4.752 4.573 4.946 . 0 0 "[ . 1 . 2]" 1 1740 1 77 SER H 1 78 LEU HG . . 4.450 4.001 3.630 4.152 . 0 0 "[ . 1 . 2]" 1 1741 1 77 SER H 1 83 ARG QD . . 5.500 4.753 4.542 5.593 0.093 19 0 "[ . 1 . 2]" 1 1742 1 77 SER QB 1 78 LEU H . . 4.350 3.033 2.731 3.612 . 0 0 "[ . 1 . 2]" 1 1743 1 77 SER QB 1 78 LEU HA . . 4.950 3.984 3.770 4.269 . 0 0 "[ . 1 . 2]" 1 1744 1 77 SER QB 1 78 LEU HG . . 4.850 4.088 3.950 4.244 . 0 0 "[ . 1 . 2]" 1 1745 1 78 LEU H 1 78 LEU HB2 . . 3.620 2.287 2.126 2.357 . 0 0 "[ . 1 . 2]" 1 1746 1 78 LEU H 1 78 LEU HB3 . . 4.120 3.506 3.431 3.546 . 0 0 "[ . 1 . 2]" 1 1747 1 78 LEU H 1 78 LEU MD1 . . 3.970 3.848 3.711 3.984 0.014 15 0 "[ . 1 . 2]" 1 1748 1 78 LEU H 1 78 LEU MD2 . . 4.180 3.359 3.064 3.808 . 0 0 "[ . 1 . 2]" 1 1749 1 78 LEU H 1 78 LEU HG . . 3.370 2.594 2.361 3.003 . 0 0 "[ . 1 . 2]" 1 1750 1 78 LEU H 1 79 SER H . . 4.790 4.577 4.544 4.647 . 0 0 "[ . 1 . 2]" 1 1751 1 78 LEU H 1 83 ARG HB2 . . 5.500 4.853 4.598 5.000 . 0 0 "[ . 1 . 2]" 1 1752 1 78 LEU H 1 83 ARG QD . . 4.770 3.795 3.344 4.824 0.054 9 0 "[ . 1 . 2]" 1 1753 1 78 LEU HA 1 78 LEU MD1 . . 4.280 3.766 3.724 3.805 . 0 0 "[ . 1 . 2]" 1 1754 1 78 LEU HA 1 78 LEU MD2 . . 3.150 1.966 1.884 2.045 . 0 0 "[ . 1 . 2]" 1 1755 1 78 LEU HA 1 79 SER H . . 3.150 2.210 2.181 2.310 . 0 0 "[ . 1 . 2]" 1 1756 1 78 LEU HA 1 82 ASP HB2 . . 4.690 3.442 3.242 3.742 . 0 0 "[ . 1 . 2]" 1 1757 1 78 LEU HA 1 82 ASP HB3 . . 4.950 4.093 3.863 4.499 . 0 0 "[ . 1 . 2]" 1 1758 1 78 LEU HB2 1 78 LEU MD1 . . 3.390 2.419 2.295 2.506 . 0 0 "[ . 1 . 2]" 1 1759 1 78 LEU HB2 1 79 SER H . . 4.430 4.361 4.127 4.469 0.039 19 0 "[ . 1 . 2]" 1 1760 1 78 LEU HB2 1 82 ASP HB2 . . 4.450 4.340 4.173 4.480 0.030 19 0 "[ . 1 . 2]" 1 1761 1 78 LEU HB2 1 82 ASP HB3 . . 4.620 4.562 4.483 4.623 0.003 2 0 "[ . 1 . 2]" 1 1762 1 78 LEU HB2 1 83 ARG H . . 3.980 3.870 3.740 3.993 0.013 15 0 "[ . 1 . 2]" 1 1763 1 78 LEU HB2 1 83 ARG HA . . 4.850 3.579 3.376 3.880 . 0 0 "[ . 1 . 2]" 1 1764 1 78 LEU HB2 1 83 ARG HB2 . . 4.280 3.057 2.918 3.582 . 0 0 "[ . 1 . 2]" 1 1765 1 78 LEU HB2 1 83 ARG QD . . 5.190 2.740 2.499 4.099 . 0 0 "[ . 1 . 2]" 1 1766 1 78 LEU HB3 1 79 SER H . . 3.850 3.331 2.911 3.487 . 0 0 "[ . 1 . 2]" 1 1767 1 78 LEU HB3 1 82 ASP H . . 5.210 4.520 4.421 4.679 . 0 0 "[ . 1 . 2]" 1 1768 1 78 LEU HB3 1 82 ASP HB2 . . 4.090 2.636 2.441 2.750 . 0 0 "[ . 1 . 2]" 1 1769 1 78 LEU HB3 1 82 ASP HB3 . . 4.250 2.901 2.796 2.992 . 0 0 "[ . 1 . 2]" 1 1770 1 78 LEU HB3 1 83 ARG H . . 4.370 2.545 2.394 2.649 . 0 0 "[ . 1 . 2]" 1 1771 1 78 LEU HB3 1 83 ARG HA . . 4.410 3.000 2.808 3.306 . 0 0 "[ . 1 . 2]" 1 1772 1 78 LEU HB3 1 83 ARG HB2 . . 4.510 2.772 2.666 2.967 . 0 0 "[ . 1 . 2]" 1 1773 1 78 LEU HB3 1 83 ARG HB3 . . 4.560 4.345 4.265 4.450 . 0 0 "[ . 1 . 2]" 1 1774 1 78 LEU HB3 1 83 ARG QD . . 5.500 3.752 3.515 4.800 . 0 0 "[ . 1 . 2]" 1 1775 1 78 LEU HB3 1 83 ARG QG . . 4.850 3.376 2.563 3.634 . 0 0 "[ . 1 . 2]" 1 1776 1 78 LEU MD1 1 79 SER H . . 4.950 4.867 4.610 4.949 . 0 0 "[ . 1 . 2]" 1 1777 1 78 LEU MD1 1 82 ASP H . . 5.500 5.468 5.348 5.521 0.021 15 0 "[ . 1 . 2]" 1 1778 1 78 LEU MD1 1 82 ASP HA . . 5.500 4.837 4.746 4.948 . 0 0 "[ . 1 . 2]" 1 1779 1 78 LEU MD1 1 82 ASP HB2 . . 4.560 3.815 3.667 3.925 . 0 0 "[ . 1 . 2]" 1 1780 1 78 LEU MD1 1 82 ASP HB3 . . 4.410 2.965 2.752 3.077 . 0 0 "[ . 1 . 2]" 1 1781 1 78 LEU MD1 1 83 ARG H . . 4.760 3.718 3.575 3.849 . 0 0 "[ . 1 . 2]" 1 1782 1 78 LEU MD1 1 83 ARG HA . . 3.550 2.433 2.318 2.667 . 0 0 "[ . 1 . 2]" 1 1783 1 78 LEU MD1 1 83 ARG HB2 . . 4.620 3.814 3.658 4.146 . 0 0 "[ . 1 . 2]" 1 1784 1 78 LEU MD1 1 83 ARG HB3 . . 4.850 4.763 4.673 4.889 0.039 19 0 "[ . 1 . 2]" 1 1785 1 78 LEU MD1 1 83 ARG QD . . 4.850 3.856 3.495 4.726 . 0 0 "[ . 1 . 2]" 1 1786 1 78 LEU MD1 1 83 ARG QG . . 4.450 2.846 2.604 3.040 . 0 0 "[ . 1 . 2]" 1 1787 1 78 LEU MD1 1 84 ALA H . . 5.500 5.430 5.328 5.543 0.043 19 0 "[ . 1 . 2]" 1 1788 1 78 LEU MD1 1 86 TYR HB3 . . 4.150 2.918 2.680 3.326 . 0 0 "[ . 1 . 2]" 1 1789 1 78 LEU MD1 1 86 TYR QD . . 4.420 3.065 2.832 3.541 . 0 0 "[ . 1 . 2]" 1 1790 1 78 LEU MD1 1 86 TYR QE . . 4.900 4.005 3.873 4.396 . 0 0 "[ . 1 . 2]" 1 1791 1 78 LEU MD2 1 79 SER H . . 3.990 3.101 2.835 3.284 . 0 0 "[ . 1 . 2]" 1 1792 1 78 LEU MD2 1 82 ASP H . . 5.500 4.806 4.419 5.012 . 0 0 "[ . 1 . 2]" 1 1793 1 78 LEU MD2 1 82 ASP HA . . 4.950 4.720 4.516 4.893 . 0 0 "[ . 1 . 2]" 1 1794 1 78 LEU MD2 1 82 ASP HB2 . . 4.010 2.770 2.453 2.964 . 0 0 "[ . 1 . 2]" 1 1795 1 78 LEU MD2 1 82 ASP HB3 . . 3.850 2.433 2.146 2.580 . 0 0 "[ . 1 . 2]" 1 1796 1 78 LEU MD2 1 83 ARG H . . 5.340 4.131 3.882 4.293 . 0 0 "[ . 1 . 2]" 1 1797 1 78 LEU MD2 1 83 ARG HA . . 4.560 4.527 4.460 4.587 0.027 19 0 "[ . 1 . 2]" 1 1798 1 78 LEU HG 1 79 SER H . . 5.350 5.091 4.909 5.244 . 0 0 "[ . 1 . 2]" 1 1799 1 78 LEU HG 1 82 ASP HB2 . . 5.190 5.124 4.970 5.199 0.009 3 0 "[ . 1 . 2]" 1 1800 1 79 SER H 1 79 SER QB . . 3.590 2.317 1.996 2.893 . 0 0 "[ . 1 . 2]" 1 1801 1 79 SER H 1 80 PRO HD2 . . 4.730 4.726 4.686 4.786 0.056 19 0 "[ . 1 . 2]" 1 1802 1 79 SER H 1 80 PRO HD3 . . 4.730 4.754 4.737 4.783 0.053 15 0 "[ . 1 . 2]" 1 1803 1 79 SER H 1 81 GLN H . . 5.500 4.650 4.492 4.746 . 0 0 "[ . 1 . 2]" 1 1804 1 79 SER H 1 82 ASP H . . 4.910 3.795 3.581 4.107 . 0 0 "[ . 1 . 2]" 1 1805 1 79 SER H 1 82 ASP HB2 . . 4.090 2.579 2.323 3.037 . 0 0 "[ . 1 . 2]" 1 1806 1 79 SER H 1 82 ASP HB3 . . 4.470 4.008 3.758 4.490 0.020 19 0 "[ . 1 . 2]" 1 1807 1 79 SER H 1 83 ARG H . . 5.210 3.887 3.636 4.152 . 0 0 "[ . 1 . 2]" 1 1808 1 79 SER HA 1 80 PRO HD2 . . 3.270 3.143 3.078 3.179 . 0 0 "[ . 1 . 2]" 1 1809 1 79 SER HA 1 80 PRO HD3 . . 3.340 2.323 2.264 2.356 . 0 0 "[ . 1 . 2]" 1 1810 1 79 SER HA 1 81 GLN H . . 4.830 4.185 4.066 4.229 . 0 0 "[ . 1 . 2]" 1 1811 1 79 SER QB 1 80 PRO HD2 . . 3.850 1.930 1.784 2.022 . 0 0 "[ . 1 . 2]" 1 1812 1 79 SER QB 1 80 PRO HD3 . . 3.700 2.606 2.312 3.040 . 0 0 "[ . 1 . 2]" 1 1813 1 79 SER QB 1 81 GLN H . . 4.350 2.374 1.959 3.246 . 0 0 "[ . 1 . 2]" 1 1814 1 79 SER QB 1 81 GLN HB2 . . 4.770 3.684 3.049 5.176 0.406 14 0 "[ . 1 . 2]" 1 1815 1 79 SER QB 1 82 ASP H . . 5.060 2.792 2.442 3.534 . 0 0 "[ . 1 . 2]" 1 1816 1 80 PRO HA 1 82 ASP H . . 5.190 4.672 4.459 4.968 . 0 0 "[ . 1 . 2]" 1 1817 1 80 PRO HA 1 83 ARG H . . 4.290 4.082 3.960 4.271 . 0 0 "[ . 1 . 2]" 1 1818 1 80 PRO HA 1 83 ARG HB2 . . 3.800 3.750 3.375 3.822 0.022 15 0 "[ . 1 . 2]" 1 1819 1 80 PRO HA 1 83 ARG HB3 . . 3.620 3.520 3.347 3.739 0.119 19 0 "[ . 1 . 2]" 1 1820 1 80 PRO HA 1 83 ARG QD . . 4.450 4.440 4.332 4.632 0.182 9 0 "[ . 1 . 2]" 1 1821 1 80 PRO HA 1 84 ALA H . . 4.770 3.867 3.659 3.993 . 0 0 "[ . 1 . 2]" 1 1822 1 80 PRO HA 1 84 ALA MB . . 5.060 4.165 4.002 4.266 . 0 0 "[ . 1 . 2]" 1 1823 1 80 PRO HB2 1 81 GLN H . . 4.010 3.764 3.713 3.893 . 0 0 "[ . 1 . 2]" 1 1824 1 80 PRO HB2 1 84 ALA MB . . 4.620 4.587 4.433 4.639 0.019 8 0 "[ . 1 . 2]" 1 1825 1 80 PRO HB3 1 81 GLN H . . 4.510 4.476 4.449 4.544 0.034 19 0 "[ . 1 . 2]" 1 1826 1 80 PRO HD2 1 81 GLN H . . 4.410 2.416 2.375 2.538 . 0 0 "[ . 1 . 2]" 1 1827 1 80 PRO HD3 1 81 GLN H . . 4.060 3.699 3.684 3.748 . 0 0 "[ . 1 . 2]" 1 1828 1 80 PRO HG2 1 81 GLN H . . 4.540 3.434 3.358 3.634 . 0 0 "[ . 1 . 2]" 1 1829 1 81 GLN H 1 81 GLN HB2 . . 3.330 2.602 2.429 2.994 . 0 0 "[ . 1 . 2]" 1 1830 1 81 GLN H 1 81 GLN HB3 . . 3.670 3.298 2.278 3.639 . 0 0 "[ . 1 . 2]" 1 1831 1 81 GLN H 1 81 GLN HG2 . . 4.560 3.935 3.678 4.255 . 0 0 "[ . 1 . 2]" 1 1832 1 81 GLN H 1 81 GLN HG3 . . 4.510 2.971 2.291 4.588 0.078 4 0 "[ . 1 . 2]" 1 1833 1 81 GLN H 1 82 ASP H . . 3.470 2.274 2.201 2.407 . 0 0 "[ . 1 . 2]" 1 1834 1 81 GLN H 1 82 ASP HB2 . . 5.150 4.191 4.150 4.258 . 0 0 "[ . 1 . 2]" 1 1835 1 81 GLN H 1 83 ARG H . . 4.700 3.938 3.834 4.082 . 0 0 "[ . 1 . 2]" 1 1836 1 81 GLN H 1 84 ALA MB . . 5.500 4.332 4.221 4.415 . 0 0 "[ . 1 . 2]" 1 1837 1 81 GLN HA 1 81 GLN HG2 . . 3.630 2.938 2.642 3.598 . 0 0 "[ . 1 . 2]" 1 1838 1 81 GLN HA 1 81 GLN HG3 . . 3.200 2.731 2.584 2.896 . 0 0 "[ . 1 . 2]" 1 1839 1 81 GLN HA 1 83 ARG H . . 5.060 4.908 4.720 5.010 . 0 0 "[ . 1 . 2]" 1 1840 1 81 GLN HA 1 84 ALA MB . . 3.250 2.411 2.190 2.523 . 0 0 "[ . 1 . 2]" 1 1841 1 81 GLN HB2 1 82 ASP H . . 3.890 2.973 2.308 3.960 0.070 15 0 "[ . 1 . 2]" 1 1842 1 81 GLN HB2 1 83 ARG H . . 5.340 5.489 5.055 6.202 0.862 15 5 "[ - *. * 1 *+ 2]" 1 1843 1 81 GLN HB2 1 84 ALA MB . . 5.340 4.754 4.327 4.937 . 0 0 "[ . 1 . 2]" 1 1844 1 81 GLN HB3 1 82 ASP H . . 3.930 3.458 2.540 3.873 . 0 0 "[ . 1 . 2]" 1 1845 1 81 GLN HB3 1 84 ALA MB . . 4.320 4.409 4.173 4.765 0.445 15 0 "[ . 1 . 2]" 1 1846 1 81 GLN HG2 1 84 ALA MB . . 4.950 4.671 4.113 4.928 . 0 0 "[ . 1 . 2]" 1 1847 1 81 GLN HG3 1 82 ASP H . . 4.690 4.280 3.994 4.638 . 0 0 "[ . 1 . 2]" 1 1848 1 81 GLN HG3 1 84 ALA MB . . 4.950 4.505 3.600 4.901 . 0 0 "[ . 1 . 2]" 1 1849 1 82 ASP H 1 82 ASP HB2 . . 3.720 2.279 2.217 2.396 . 0 0 "[ . 1 . 2]" 1 1850 1 82 ASP H 1 82 ASP HB3 . . 3.970 3.510 3.488 3.538 . 0 0 "[ . 1 . 2]" 1 1851 1 82 ASP H 1 83 ARG H . . 3.600 2.759 2.639 2.901 . 0 0 "[ . 1 . 2]" 1 1852 1 82 ASP H 1 84 ALA H . . 5.270 3.977 3.818 4.250 . 0 0 "[ . 1 . 2]" 1 1853 1 82 ASP H 1 84 ALA MB . . 5.090 4.420 4.351 4.595 . 0 0 "[ . 1 . 2]" 1 1854 1 82 ASP HA 1 84 ALA H . . 5.090 4.394 4.165 4.651 . 0 0 "[ . 1 . 2]" 1 1855 1 82 ASP HA 1 85 ALA H . . 4.050 3.528 3.383 3.692 . 0 0 "[ . 1 . 2]" 1 1856 1 82 ASP HA 1 85 ALA MB . . 3.420 2.973 2.640 3.146 . 0 0 "[ . 1 . 2]" 1 1857 1 82 ASP HA 1 86 TYR H . . 5.500 4.245 4.004 4.583 . 0 0 "[ . 1 . 2]" 1 1858 1 82 ASP HB2 1 83 ARG H . . 4.230 2.313 2.248 2.382 . 0 0 "[ . 1 . 2]" 1 1859 1 82 ASP HB3 1 83 ARG H . . 4.560 3.122 2.929 3.249 . 0 0 "[ . 1 . 2]" 1 1860 1 82 ASP HB3 1 85 ALA MB . . 4.950 4.427 4.242 4.782 . 0 0 "[ . 1 . 2]" 1 1861 1 82 ASP HB3 1 86 TYR HB3 . . 5.350 4.951 4.582 5.312 . 0 0 "[ . 1 . 2]" 1 1862 1 83 ARG H 1 83 ARG HB2 . . 3.640 2.097 2.029 2.135 . 0 0 "[ . 1 . 2]" 1 1863 1 83 ARG H 1 83 ARG HB3 . . 3.650 2.978 2.899 3.223 . 0 0 "[ . 1 . 2]" 1 1864 1 83 ARG H 1 83 ARG QD . . 5.040 4.106 3.992 4.713 . 0 0 "[ . 1 . 2]" 1 1865 1 83 ARG H 1 83 ARG QG . . 4.280 3.728 3.350 3.809 . 0 0 "[ . 1 . 2]" 1 1866 1 83 ARG H 1 84 ALA H . . 3.570 2.819 2.727 2.947 . 0 0 "[ . 1 . 2]" 1 1867 1 83 ARG H 1 84 ALA HA . . 5.500 5.324 5.245 5.422 . 0 0 "[ . 1 . 2]" 1 1868 1 83 ARG H 1 84 ALA MB . . 4.770 4.318 4.191 4.393 . 0 0 "[ . 1 . 2]" 1 1869 1 83 ARG H 1 85 ALA H . . 5.090 4.177 4.031 4.574 . 0 0 "[ . 1 . 2]" 1 1870 1 83 ARG HA 1 83 ARG QD . . 3.720 3.759 3.723 3.943 0.223 9 0 "[ . 1 . 2]" 1 1871 1 83 ARG HA 1 83 ARG QG . . 3.460 2.122 2.104 2.177 . 0 0 "[ . 1 . 2]" 1 1872 1 83 ARG HA 1 84 ALA MB . . 4.950 4.992 4.973 5.018 0.068 19 0 "[ . 1 . 2]" 1 1873 1 83 ARG HA 1 85 ALA H . . 5.040 3.953 3.702 4.571 . 0 0 "[ . 1 . 2]" 1 1874 1 83 ARG HA 1 85 ALA MB . . 4.950 4.661 4.457 4.953 0.003 7 0 "[ . 1 . 2]" 1 1875 1 83 ARG HA 1 86 TYR HB3 . . 3.540 2.143 2.002 2.379 . 0 0 "[ . 1 . 2]" 1 1876 1 83 ARG HA 1 86 TYR QD . . 4.230 3.703 3.390 4.111 . 0 0 "[ . 1 . 2]" 1 1877 1 83 ARG HB2 1 84 ALA H . . 4.180 3.523 3.169 3.673 . 0 0 "[ . 1 . 2]" 1 1878 1 83 ARG HB3 1 84 ALA H . . 3.690 2.706 2.537 2.841 . 0 0 "[ . 1 . 2]" 1 1879 1 83 ARG QG 1 84 ALA H . . 4.260 4.227 4.142 4.384 0.124 19 0 "[ . 1 . 2]" 1 1880 1 83 ARG QG 1 86 TYR HB3 . . 4.690 3.151 2.825 3.414 . 0 0 "[ . 1 . 2]" 1 1881 1 84 ALA H 1 84 ALA MB . . 2.890 2.065 1.960 2.149 . 0 0 "[ . 1 . 2]" 1 1882 1 84 ALA H 1 85 ALA H . . 3.490 2.768 2.633 3.014 . 0 0 "[ . 1 . 2]" 1 1883 1 84 ALA H 1 86 TYR H . . 4.760 4.545 4.307 4.758 . 0 0 "[ . 1 . 2]" 1 1884 1 84 ALA H 1 86 TYR HB3 . . 4.990 4.987 4.901 5.018 0.028 7 0 "[ . 1 . 2]" 1 1885 1 84 ALA H 1 87 LYS QB . . 4.950 4.795 4.489 4.988 0.038 6 0 "[ . 1 . 2]" 1 1886 1 84 ALA HA 1 87 LYS H . . 4.180 4.073 3.864 4.184 0.004 2 0 "[ . 1 . 2]" 1 1887 1 84 ALA HA 1 87 LYS QB . . 3.560 3.207 2.869 3.468 . 0 0 "[ . 1 . 2]" 1 1888 1 84 ALA HA 1 88 GLU H . . 4.770 4.339 3.803 4.744 . 0 0 "[ . 1 . 2]" 1 1889 1 84 ALA MB 1 85 ALA H . . 3.230 2.817 2.467 2.982 . 0 0 "[ . 1 . 2]" 1 1890 1 85 ALA H 1 85 ALA MB . . 2.870 2.148 1.966 2.236 . 0 0 "[ . 1 . 2]" 1 1891 1 85 ALA H 1 86 TYR H . . 3.520 2.584 2.353 2.960 . 0 0 "[ . 1 . 2]" 1 1892 1 85 ALA H 1 86 TYR HA . . 5.500 5.104 4.942 5.407 . 0 0 "[ . 1 . 2]" 1 1893 1 85 ALA H 1 86 TYR HB3 . . 4.790 4.202 3.950 4.692 . 0 0 "[ . 1 . 2]" 1 1894 1 85 ALA H 1 87 LYS QB . . 5.150 4.804 4.570 5.045 . 0 0 "[ . 1 . 2]" 1 1895 1 85 ALA H 1 88 GLU QB . . 5.090 4.593 4.144 4.956 . 0 0 "[ . 1 . 2]" 1 1896 1 85 ALA HA 1 87 LYS H . . 4.950 4.557 4.269 4.965 0.015 20 0 "[ . 1 . 2]" 1 1897 1 85 ALA HA 1 88 GLU H . . 4.150 3.311 3.159 3.548 . 0 0 "[ . 1 . 2]" 1 1898 1 85 ALA HA 1 88 GLU HA . . 5.060 5.025 4.918 5.107 0.047 2 0 "[ . 1 . 2]" 1 1899 1 85 ALA HA 1 88 GLU QB . . 3.470 2.307 2.115 2.513 . 0 0 "[ . 1 . 2]" 1 1900 1 85 ALA HA 1 88 GLU HG2 . . 4.850 3.684 3.528 3.937 . 0 0 "[ . 1 . 2]" 1 1901 1 85 ALA HA 1 88 GLU HG3 . . 4.690 4.781 4.529 4.880 0.190 6 0 "[ . 1 . 2]" 1 1902 1 85 ALA MB 1 86 TYR H . . 3.670 2.306 2.134 2.580 . 0 0 "[ . 1 . 2]" 1 1903 1 85 ALA MB 1 86 TYR HA . . 4.620 3.750 3.617 3.822 . 0 0 "[ . 1 . 2]" 1 1904 1 85 ALA MB 1 86 TYR HB3 . . 4.510 4.304 4.191 4.447 . 0 0 "[ . 1 . 2]" 1 1905 1 85 ALA MB 1 88 GLU QB . . 4.280 3.760 3.644 3.885 . 0 0 "[ . 1 . 2]" 1 1906 1 85 ALA MB 1 89 TYR H . . 5.420 5.003 4.883 5.151 . 0 0 "[ . 1 . 2]" 1 1907 1 86 TYR H 1 86 TYR HB2 . . 3.890 2.412 2.216 2.499 . 0 0 "[ . 1 . 2]" 1 1908 1 86 TYR H 1 86 TYR HB3 . . 3.620 2.308 2.196 2.570 . 0 0 "[ . 1 . 2]" 1 1909 1 86 TYR H 1 86 TYR QD . . 4.270 4.069 4.040 4.104 . 0 0 "[ . 1 . 2]" 1 1910 1 86 TYR HA 1 86 TYR QD . . 3.480 3.102 2.740 3.309 . 0 0 "[ . 1 . 2]" 1 1911 1 86 TYR HA 1 88 GLU H . . 5.150 4.443 4.151 4.612 . 0 0 "[ . 1 . 2]" 1 1912 1 86 TYR HA 1 89 TYR H . . 4.300 3.586 3.449 3.685 . 0 0 "[ . 1 . 2]" 1 1913 1 86 TYR HA 1 89 TYR QD . . 4.230 4.142 3.306 4.251 0.021 6 0 "[ . 1 . 2]" 1 1914 1 86 TYR HA 1 90 ILE H . . 5.340 4.575 4.349 4.994 . 0 0 "[ . 1 . 2]" 1 1915 1 86 TYR HB3 1 87 LYS H . . 3.760 2.338 2.118 2.541 . 0 0 "[ . 1 . 2]" 1 1916 1 86 TYR QD 1 87 LYS H . . 4.150 2.600 2.244 3.233 . 0 0 "[ . 1 . 2]" 1 1917 1 86 TYR QD 1 87 LYS HA . . 4.420 2.741 2.398 3.306 . 0 0 "[ . 1 . 2]" 1 1918 1 86 TYR QD 1 87 LYS QB . . 5.190 3.369 2.908 4.171 . 0 0 "[ . 1 . 2]" 1 1919 1 86 TYR QD 1 87 LYS HG2 . . 4.190 3.000 2.350 4.375 0.185 6 0 "[ . 1 . 2]" 1 1920 1 86 TYR QD 1 87 LYS HG3 . . 4.850 3.558 3.211 4.398 . 0 0 "[ . 1 . 2]" 1 1921 1 86 TYR QD 1 90 ILE H . . 4.700 4.634 4.412 4.754 0.054 8 0 "[ . 1 . 2]" 1 1922 1 86 TYR QD 1 90 ILE MD . . 4.620 3.655 3.476 3.807 . 0 0 "[ . 1 . 2]" 1 1923 1 86 TYR QD 1 90 ILE HG12 . . 5.190 3.554 3.247 3.821 . 0 0 "[ . 1 . 2]" 1 1924 1 86 TYR QD 1 90 ILE HG13 . . 5.030 2.777 2.632 2.904 . 0 0 "[ . 1 . 2]" 1 1925 1 86 TYR QD 1 90 ILE MG . . 4.690 4.676 4.544 4.724 0.034 11 0 "[ . 1 . 2]" 1 1926 1 86 TYR QE 1 87 LYS H . . 5.500 4.917 4.608 5.468 . 0 0 "[ . 1 . 2]" 1 1927 1 86 TYR QE 1 87 LYS HA . . 4.900 3.838 3.499 4.682 . 0 0 "[ . 1 . 2]" 1 1928 1 86 TYR QE 1 87 LYS HG2 . . 4.620 3.619 2.959 5.111 0.491 6 0 "[ . 1 . 2]" 1 1929 1 86 TYR QE 1 90 ILE HB . . 5.190 4.393 4.069 4.994 . 0 0 "[ . 1 . 2]" 1 1930 1 86 TYR QE 1 90 ILE MD . . 3.470 2.469 2.135 2.795 . 0 0 "[ . 1 . 2]" 1 1931 1 86 TYR QE 1 90 ILE HG12 . . 4.550 3.607 3.254 3.948 . 0 0 "[ . 1 . 2]" 1 1932 1 86 TYR QE 1 90 ILE HG13 . . 4.700 2.320 1.994 2.776 . 0 0 "[ . 1 . 2]" 1 1933 1 86 TYR QE 1 90 ILE MG . . 4.120 3.570 3.361 3.965 . 0 0 "[ . 1 . 2]" 1 1934 1 87 LYS H 1 87 LYS QB . . 3.260 2.000 1.984 2.029 . 0 0 "[ . 1 . 2]" 1 1935 1 87 LYS H 1 87 LYS QD . . 5.500 4.452 2.556 4.608 . 0 0 "[ . 1 . 2]" 1 1936 1 87 LYS H 1 87 LYS HG2 . . 3.990 3.634 3.246 4.362 0.372 6 0 "[ . 1 . 2]" 1 1937 1 87 LYS H 1 87 LYS HG3 . . 4.250 3.742 3.468 4.003 . 0 0 "[ . 1 . 2]" 1 1938 1 87 LYS H 1 88 GLU H . . 3.590 2.731 2.655 2.818 . 0 0 "[ . 1 . 2]" 1 1939 1 87 LYS H 1 90 ILE MD . . 5.500 5.456 5.264 5.527 0.027 12 0 "[ . 1 . 2]" 1 1940 1 87 LYS H 1 90 ILE HG13 . . 5.500 4.316 4.067 4.556 . 0 0 "[ . 1 . 2]" 1 1941 1 87 LYS HA 1 87 LYS QD . . 4.180 3.096 2.535 3.730 . 0 0 "[ . 1 . 2]" 1 1942 1 87 LYS HA 1 87 LYS HG2 . . 3.800 2.060 1.920 3.412 . 0 0 "[ . 1 . 2]" 1 1943 1 87 LYS HA 1 87 LYS HG3 . . 3.750 3.223 2.067 3.476 . 0 0 "[ . 1 . 2]" 1 1944 1 87 LYS HA 1 89 TYR H . . 5.040 3.939 3.813 4.043 . 0 0 "[ . 1 . 2]" 1 1945 1 87 LYS HA 1 90 ILE H . . 3.870 2.833 2.760 2.952 . 0 0 "[ . 1 . 2]" 1 1946 1 87 LYS HA 1 90 ILE HB . . 4.090 2.201 2.066 2.429 . 0 0 "[ . 1 . 2]" 1 1947 1 87 LYS HA 1 90 ILE MD . . 3.950 3.884 3.711 3.982 0.032 2 0 "[ . 1 . 2]" 1 1948 1 87 LYS HA 1 90 ILE HG12 . . 4.090 2.752 2.485 3.100 . 0 0 "[ . 1 . 2]" 1 1949 1 87 LYS HA 1 90 ILE HG13 . . 3.710 2.231 1.997 2.439 . 0 0 "[ . 1 . 2]" 1 1950 1 87 LYS HA 1 90 ILE MG . . 3.780 3.616 3.543 3.723 . 0 0 "[ . 1 . 2]" 1 1951 1 87 LYS QB 1 88 GLU H . . 3.680 2.799 2.681 3.005 . 0 0 "[ . 1 . 2]" 1 1952 1 87 LYS QD 1 88 GLU H . . 4.950 4.707 4.555 4.774 . 0 0 "[ . 1 . 2]" 1 1953 1 87 LYS QD 1 90 ILE HB . . 4.950 3.347 2.477 4.391 . 0 0 "[ . 1 . 2]" 1 1954 1 87 LYS HG2 1 88 GLU H . . 5.090 4.989 4.883 5.366 0.276 6 0 "[ . 1 . 2]" 1 1955 1 87 LYS HG3 1 90 ILE HG13 . . 4.690 4.413 3.013 4.688 . 0 0 "[ . 1 . 2]" 1 1956 1 88 GLU H 1 88 GLU QB . . 2.960 2.072 2.040 2.104 . 0 0 "[ . 1 . 2]" 1 1957 1 88 GLU H 1 88 GLU HG2 . . 4.230 3.466 3.060 4.136 . 0 0 "[ . 1 . 2]" 1 1958 1 88 GLU H 1 88 GLU HG3 . . 4.090 4.244 4.160 4.375 0.285 2 0 "[ . 1 . 2]" 1 1959 1 88 GLU H 1 89 TYR QB . . 4.730 4.420 4.211 4.535 . 0 0 "[ . 1 . 2]" 1 1960 1 88 GLU HA 1 88 GLU HG2 . . 3.870 3.733 3.686 3.766 . 0 0 "[ . 1 . 2]" 1 1961 1 88 GLU HA 1 88 GLU HG3 . . 3.850 3.323 2.801 3.607 . 0 0 "[ . 1 . 2]" 1 1962 1 88 GLU HA 1 90 ILE H . . 5.340 4.492 4.119 4.701 . 0 0 "[ . 1 . 2]" 1 1963 1 88 GLU HA 1 91 SER H . . 4.320 4.156 3.573 4.339 0.019 7 0 "[ . 1 . 2]" 1 1964 1 88 GLU QB 1 88 GLU HG3 . . 2.790 2.407 2.328 2.529 . 0 0 "[ . 1 . 2]" 1 1965 1 88 GLU QB 1 89 TYR H . . 3.390 3.288 2.936 3.438 0.048 6 0 "[ . 1 . 2]" 1 1966 1 88 GLU QB 1 89 TYR HA . . 4.770 4.668 4.573 4.724 . 0 0 "[ . 1 . 2]" 1 1967 1 88 GLU QB 1 92 ASN HD21 . . 5.340 4.800 4.278 5.379 0.039 19 0 "[ . 1 . 2]" 1 1968 1 88 GLU QB 1 92 ASN HD22 . . 5.500 4.595 4.074 5.277 . 0 0 "[ . 1 . 2]" 1 1969 1 88 GLU HG2 1 89 TYR H . . 3.950 2.471 1.969 3.476 . 0 0 "[ . 1 . 2]" 1 1970 1 88 GLU HG2 1 92 ASN HD21 . . 5.420 4.609 3.982 5.452 0.032 11 0 "[ . 1 . 2]" 1 1971 1 88 GLU HG3 1 89 TYR H . . 3.990 3.394 3.007 3.972 . 0 0 "[ . 1 . 2]" 1 1972 1 88 GLU HG3 1 92 ASN HD21 . . 5.340 3.365 2.906 4.246 . 0 0 "[ . 1 . 2]" 1 1973 1 88 GLU HG3 1 92 ASN HD22 . . 5.420 3.492 2.763 4.373 . 0 0 "[ . 1 . 2]" 1 1974 1 89 TYR H 1 89 TYR QB . . 3.100 1.953 1.908 1.982 . 0 0 "[ . 1 . 2]" 1 1975 1 89 TYR H 1 89 TYR QD . . 4.230 3.787 3.648 3.887 . 0 0 "[ . 1 . 2]" 1 1976 1 89 TYR H 1 90 ILE HA . . 5.500 4.947 4.846 5.037 . 0 0 "[ . 1 . 2]" 1 1977 1 89 TYR H 1 90 ILE MD . . 5.150 5.152 5.006 5.199 0.049 3 0 "[ . 1 . 2]" 1 1978 1 89 TYR H 1 90 ILE HG13 . . 5.270 5.002 4.725 5.246 . 0 0 "[ . 1 . 2]" 1 1979 1 89 TYR H 1 91 SER H . . 5.150 4.492 4.140 4.642 . 0 0 "[ . 1 . 2]" 1 1980 1 89 TYR HA 1 89 TYR QD . . 3.290 3.054 2.811 3.304 0.014 20 0 "[ . 1 . 2]" 1 1981 1 89 TYR HA 1 92 ASN QB . . 4.280 2.966 2.237 4.302 0.022 19 0 "[ . 1 . 2]" 1 1982 1 89 TYR HA 1 92 ASN HD21 . . 5.500 2.788 2.024 3.639 . 0 0 "[ . 1 . 2]" 1 1983 1 89 TYR QB 1 90 ILE H . . 3.690 2.746 2.577 3.037 . 0 0 "[ . 1 . 2]" 1 1984 1 89 TYR QB 1 90 ILE HB . . 5.060 4.955 4.838 5.157 0.097 6 0 "[ . 1 . 2]" 1 1985 1 89 TYR QB 1 90 ILE MD . . 4.620 4.318 4.085 4.493 . 0 0 "[ . 1 . 2]" 1 1986 1 89 TYR QB 1 90 ILE HG12 . . 5.350 3.357 3.232 3.466 . 0 0 "[ . 1 . 2]" 1 1987 1 89 TYR QB 1 90 ILE HG13 . . 4.950 4.880 4.671 4.977 0.027 12 0 "[ . 1 . 2]" 1 1988 1 89 TYR QB 1 91 SER H . . 5.420 5.234 5.032 5.399 . 0 0 "[ . 1 . 2]" 1 1989 1 89 TYR QD 1 90 ILE H . . 3.610 2.991 2.839 3.249 . 0 0 "[ . 1 . 2]" 1 1990 1 89 TYR QD 1 90 ILE HA . . 4.560 3.161 2.693 3.792 . 0 0 "[ . 1 . 2]" 1 1991 1 89 TYR QD 1 90 ILE HB . . 5.060 4.619 4.332 4.953 . 0 0 "[ . 1 . 2]" 1 1992 1 89 TYR QD 1 90 ILE MD . . 3.510 2.719 2.427 3.126 . 0 0 "[ . 1 . 2]" 1 1993 1 89 TYR QD 1 90 ILE HG12 . . 4.620 2.418 1.985 2.720 . 0 0 "[ . 1 . 2]" 1 1994 1 89 TYR QD 1 90 ILE HG13 . . 4.370 4.057 3.531 4.305 . 0 0 "[ . 1 . 2]" 1 1995 1 89 TYR QD 1 93 LYS QD . . 4.700 3.767 2.432 4.559 . 0 0 "[ . 1 . 2]" 1 1996 1 89 TYR QE 1 90 ILE H . . 5.080 5.064 4.954 5.159 0.079 6 0 "[ . 1 . 2]" 1 1997 1 89 TYR QE 1 90 ILE HA . . 4.900 3.916 3.627 4.196 . 0 0 "[ . 1 . 2]" 1 1998 1 89 TYR QE 1 90 ILE MD . . 3.770 2.956 2.427 3.215 . 0 0 "[ . 1 . 2]" 1 1999 1 89 TYR QE 1 93 LYS QD . . 4.270 2.490 2.111 3.001 . 0 0 "[ . 1 . 2]" 1 2000 1 89 TYR QE 1 93 LYS HE2 . . 4.620 3.912 2.149 5.396 0.776 20 2 "[ . 1 . - +]" 1 2001 1 89 TYR QE 1 93 LYS QG . . 4.900 3.463 1.988 4.290 . 0 0 "[ . 1 . 2]" 1 2002 1 90 ILE H 1 90 ILE HB . . 3.510 2.436 2.355 2.502 . 0 0 "[ . 1 . 2]" 1 2003 1 90 ILE H 1 90 ILE MD . . 3.640 3.506 3.313 3.649 0.009 20 0 "[ . 1 . 2]" 1 2004 1 90 ILE H 1 90 ILE HG12 . . 3.800 1.998 1.932 2.168 . 0 0 "[ . 1 . 2]" 1 2005 1 90 ILE H 1 90 ILE HG13 . . 3.620 3.218 3.047 3.327 . 0 0 "[ . 1 . 2]" 1 2006 1 90 ILE H 1 90 ILE MG . . 3.510 3.706 3.694 3.738 0.228 6 0 "[ . 1 . 2]" 1 2007 1 90 ILE H 1 91 SER H . . 3.340 2.932 2.433 3.091 . 0 0 "[ . 1 . 2]" 1 2008 1 90 ILE H 1 91 SER QB . . 4.790 4.485 4.234 4.628 . 0 0 "[ . 1 . 2]" 1 2009 1 90 ILE HA 1 90 ILE MD . . 3.480 2.231 2.118 2.423 . 0 0 "[ . 1 . 2]" 1 2010 1 90 ILE HA 1 90 ILE HG13 . . 4.180 3.755 3.726 3.826 . 0 0 "[ . 1 . 2]" 1 2011 1 90 ILE HA 1 90 ILE MG . . 3.170 2.375 2.327 2.435 . 0 0 "[ . 1 . 2]" 1 2012 1 90 ILE HA 1 93 LYS H . . 4.830 4.164 3.417 4.829 . 0 0 "[ . 1 . 2]" 1 2013 1 90 ILE HA 1 93 LYS HB2 . . 4.510 3.230 2.497 4.137 . 0 0 "[ . 1 . 2]" 1 2014 1 90 ILE HA 1 93 LYS HB3 . . 4.450 3.413 2.475 4.184 . 0 0 "[ . 1 . 2]" 1 2015 1 90 ILE HA 1 93 LYS QD . . 4.690 4.323 3.023 4.710 0.020 2 0 "[ . 1 . 2]" 1 2016 1 90 ILE HB 1 90 ILE MD . . 3.450 3.177 3.143 3.197 . 0 0 "[ . 1 . 2]" 1 2017 1 90 ILE HB 1 91 SER H . . 3.890 2.311 2.232 2.666 . 0 0 "[ . 1 . 2]" 1 2018 1 90 ILE HB 1 91 SER HA . . 4.620 4.249 4.172 4.334 . 0 0 "[ . 1 . 2]" 1 2019 1 90 ILE HG12 1 90 ILE MG . . 3.520 3.216 3.189 3.231 . 0 0 "[ . 1 . 2]" 1 2020 1 90 ILE HG12 1 91 SER H . . 4.450 4.272 4.139 4.352 . 0 0 "[ . 1 . 2]" 1 2021 1 90 ILE HG13 1 90 ILE MG . . 3.390 2.561 2.439 2.681 . 0 0 "[ . 1 . 2]" 1 2022 1 90 ILE HG13 1 91 SER H . . 4.540 4.553 4.481 4.600 0.060 6 0 "[ . 1 . 2]" 1 2023 1 90 ILE MG 1 91 SER H . . 4.090 3.055 2.842 3.660 . 0 0 "[ . 1 . 2]" 1 2024 1 90 ILE MG 1 91 SER HA . . 4.410 3.312 3.125 3.737 . 0 0 "[ . 1 . 2]" 1 2025 1 90 ILE MG 1 91 SER QB . . 4.360 4.092 3.927 4.394 0.034 3 0 "[ . 1 . 2]" 1 2026 1 90 ILE MG 1 93 LYS H . . 5.500 4.794 4.628 5.217 . 0 0 "[ . 1 . 2]" 1 2027 1 90 ILE MG 1 94 ARG HD2 . . 4.280 3.492 2.094 4.733 0.453 9 0 "[ . 1 . 2]" 1 2028 1 90 ILE MG 1 94 ARG HG2 . . 4.450 4.232 3.220 4.621 0.171 5 0 "[ . 1 . 2]" 1 2029 1 90 ILE MG 1 94 ARG HG3 . . 4.620 3.198 2.178 4.303 . 0 0 "[ . 1 . 2]" 1 2030 1 91 SER H 1 91 SER QB . . 3.310 2.184 2.016 2.225 . 0 0 "[ . 1 . 2]" 1 2031 1 91 SER H 1 92 ASN H . . 4.020 3.030 2.927 3.334 . 0 0 "[ . 1 . 2]" 1 2032 1 91 SER H 1 92 ASN HA . . 5.500 5.439 5.381 5.524 0.024 10 0 "[ . 1 . 2]" 1 2033 1 91 SER HA 1 93 LYS H . . 4.670 4.266 3.815 4.629 . 0 0 "[ . 1 . 2]" 1 2034 1 91 SER QB 1 92 ASN H . . 4.130 2.554 2.178 4.064 . 0 0 "[ . 1 . 2]" 1 2035 1 91 SER QB 1 92 ASN QB . . 4.850 4.283 4.100 4.502 . 0 0 "[ . 1 . 2]" 1 2036 1 92 ASN H 1 92 ASN QB . . 3.620 2.473 2.093 3.324 . 0 0 "[ . 1 . 2]" 1 2037 1 92 ASN H 1 92 ASN HD21 . . 5.150 3.408 2.855 5.235 0.085 6 0 "[ . 1 . 2]" 1 2038 1 92 ASN H 1 92 ASN HD22 . . 5.500 4.024 3.215 5.251 . 0 0 "[ . 1 . 2]" 1 2039 1 92 ASN H 1 93 LYS HB2 . . 5.420 4.543 3.879 5.060 . 0 0 "[ . 1 . 2]" 1 2040 1 92 ASN QB 1 93 LYS H . . 4.120 3.267 2.288 4.122 0.002 6 0 "[ . 1 . 2]" 1 2041 1 92 ASN QB 1 93 LYS HA . . 4.950 4.155 3.605 4.725 . 0 0 "[ . 1 . 2]" 1 2042 1 93 LYS H 1 93 LYS HB2 . . 3.810 2.756 2.006 3.631 . 0 0 "[ . 1 . 2]" 1 2043 1 93 LYS H 1 93 LYS HB3 . . 3.530 3.249 2.824 3.785 0.255 2 0 "[ . 1 . 2]" 1 2044 1 93 LYS H 1 93 LYS QG . . 4.040 3.837 3.278 4.065 0.025 7 0 "[ . 1 . 2]" 1 2045 1 93 LYS HA 1 93 LYS QD . . 3.910 3.484 2.446 3.916 0.006 3 0 "[ . 1 . 2]" 1 2046 1 93 LYS HA 1 93 LYS HE2 . . 5.500 4.398 2.472 6.228 0.728 18 3 "[ - . * 1 . + 2]" 1 2047 1 93 LYS HA 1 93 LYS QG . . 3.820 2.169 1.933 2.664 . 0 0 "[ . 1 . 2]" 1 2048 1 93 LYS HB2 1 93 LYS HE2 . . 4.950 4.397 3.388 5.227 0.277 2 0 "[ . 1 . 2]" 1 2049 1 93 LYS HB3 1 94 ARG H . . 3.870 2.382 1.934 2.769 . 0 0 "[ . 1 . 2]" 1 2050 1 93 LYS QD 1 94 ARG H . . 5.500 4.373 1.936 4.937 . 0 0 "[ . 1 . 2]" 1 2051 1 93 LYS QG 1 94 ARG H . . 5.150 3.460 2.265 4.478 . 0 0 "[ . 1 . 2]" 1 2052 1 94 ARG H 1 94 ARG HB2 . . 3.930 2.826 2.067 3.930 . 0 0 "[ . 1 . 2]" 1 2053 1 94 ARG H 1 94 ARG HB3 . . 3.450 3.610 2.974 4.012 0.562 19 5 "[ * ** .- +2]" 1 2054 1 94 ARG H 1 94 ARG HG2 . . 4.560 3.289 2.286 4.570 0.010 10 0 "[ . 1 . 2]" 1 2055 1 94 ARG H 1 94 ARG HG3 . . 4.090 3.051 2.047 4.124 0.034 1 0 "[ . 1 . 2]" 1 2056 1 94 ARG HA 1 94 ARG HD2 . . 4.450 4.500 3.680 5.431 0.981 8 2 "[- . + 1 . 2]" 1 2057 1 94 ARG HA 1 94 ARG HG2 . . 4.010 2.604 1.996 4.031 0.021 8 0 "[ . 1 . 2]" 1 2058 1 94 ARG HA 1 94 ARG HG3 . . 3.820 3.171 2.321 3.703 . 0 0 "[ . 1 . 2]" 1 2059 1 94 ARG HA 1 95 LYS H . . 3.640 2.943 2.270 3.648 0.008 18 0 "[ . 1 . 2]" 1 2060 1 94 ARG HB2 1 94 ARG HD2 . . 3.930 3.376 2.576 4.150 0.220 9 0 "[ . 1 . 2]" 1 2061 1 94 ARG HB2 1 94 ARG HG2 . . 2.990 2.950 2.799 3.057 0.067 12 0 "[ . 1 . 2]" 1 2062 1 94 ARG HB3 1 94 ARG HD2 . . 3.770 3.267 2.017 4.223 0.453 6 0 "[ . 1 . 2]" 1 2063 1 94 ARG HB3 1 94 ARG HG3 . . 2.860 2.950 2.799 3.057 0.197 10 0 "[ . 1 . 2]" 1 2064 1 94 ARG HB3 1 95 LYS H . . 5.060 2.981 1.947 4.094 . 0 0 "[ . 1 . 2]" 1 2065 1 94 ARG HG2 1 95 LYS H . . 4.990 4.298 2.068 4.988 . 0 0 "[ . 1 . 2]" 1 2066 1 95 LYS H 1 95 LYS HB2 . . 4.200 2.799 2.092 3.535 . 0 0 "[ . 1 . 2]" 1 2067 1 95 LYS H 1 95 LYS HB3 . . 3.750 3.183 2.408 4.005 0.255 9 0 "[ . 1 . 2]" 1 2068 1 95 LYS H 1 95 LYS HG2 . . 4.670 4.400 3.011 5.002 0.332 10 0 "[ . 1 . 2]" 1 2069 1 95 LYS HA 1 95 LYS QD . . 4.560 3.745 2.454 4.092 . 0 0 "[ . 1 . 2]" 1 2070 1 95 LYS HA 1 95 LYS HG3 . . 4.010 2.658 2.020 3.566 . 0 0 "[ . 1 . 2]" 1 2071 1 95 LYS HA 1 96 SER HA . . 4.690 4.430 4.260 4.662 . 0 0 "[ . 1 . 2]" 1 2072 1 95 LYS HB2 1 96 SER H . . 4.870 4.113 2.503 4.706 . 0 0 "[ . 1 . 2]" 1 2073 1 95 LYS HB3 1 96 SER H . . 4.990 3.557 1.998 4.582 . 0 0 "[ . 1 . 2]" 1 2074 1 96 SER HA 1 96 SER HB3 . . 2.960 2.786 2.423 3.052 0.092 2 0 "[ . 1 . 2]" 1 2075 1 96 SER HB3 1 97 GLY H . . 4.700 3.319 2.222 4.570 . 0 0 "[ . 1 . 2]" 1 2076 1 97 GLY QA 1 98 PRO HD3 . . 3.180 2.111 1.927 2.413 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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