NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
561867 | 2m55 | 19036 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2m55 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 2903 _Distance_constraint_stats_list.Viol_count 13529 _Distance_constraint_stats_list.Viol_total 39975.961 _Distance_constraint_stats_list.Viol_max 1.729 _Distance_constraint_stats_list.Viol_rms 0.0886 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0344 _Distance_constraint_stats_list.Viol_average_violations_only 0.1477 _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 2 ASP 0.969 0.159 15 0 "[ . 1 . 2]" 1 3 GLN 3.135 0.373 4 0 "[ . 1 . 2]" 1 4 LEU 25.491 0.404 5 0 "[ . 1 . 2]" 1 5 THR 25.021 0.372 8 0 "[ . 1 . 2]" 1 6 GLU 11.754 0.398 3 0 "[ . 1 . 2]" 1 7 GLU 5.526 0.237 5 0 "[ . 1 . 2]" 1 8 GLN 14.152 0.311 2 0 "[ . 1 . 2]" 1 9 ILE 40.294 0.338 20 0 "[ . 1 . 2]" 1 10 ALA 13.265 0.220 8 0 "[ . 1 . 2]" 1 11 GLU 12.131 0.383 13 0 "[ . 1 . 2]" 1 12 PHE 20.701 0.329 18 0 "[ . 1 . 2]" 1 13 LYS 7.240 0.208 2 0 "[ . 1 . 2]" 1 14 GLU 7.513 0.233 14 0 "[ . 1 . 2]" 1 15 ALA 6.369 0.125 6 0 "[ . 1 . 2]" 1 16 PHE 27.690 0.373 13 0 "[ . 1 . 2]" 1 17 SER 3.381 0.198 5 0 "[ . 1 . 2]" 1 18 LEU 24.685 0.295 6 0 "[ . 1 . 2]" 1 19 PHE 45.771 0.450 6 0 "[ . 1 . 2]" 1 20 ASP 9.812 0.265 20 0 "[ . 1 . 2]" 1 21 LYS 13.478 0.327 5 0 "[ . 1 . 2]" 1 22 ASP 11.957 0.479 15 0 "[ . 1 . 2]" 1 23 GLY 6.104 0.479 15 0 "[ . 1 . 2]" 1 24 ASP 6.141 0.372 2 0 "[ . 1 . 2]" 1 25 GLY 0.073 0.035 15 0 "[ . 1 . 2]" 1 26 THR 20.984 0.335 2 0 "[ . 1 . 2]" 1 27 ILE 30.934 0.373 13 0 "[ . 1 . 2]" 1 28 THR 30.107 0.281 14 0 "[ . 1 . 2]" 1 29 THR 33.814 0.419 3 0 "[ . 1 . 2]" 1 30 LYS 10.087 0.275 18 0 "[ . 1 . 2]" 1 31 GLU 13.131 0.200 13 0 "[ . 1 . 2]" 1 32 LEU 37.569 0.509 4 1 "[ +. 1 . 2]" 1 33 GLY 15.663 0.317 2 0 "[ . 1 . 2]" 1 34 THR 16.322 0.296 19 0 "[ . 1 . 2]" 1 35 VAL 55.948 0.661 8 1 "[ . + 1 . 2]" 1 36 MET 37.455 0.708 6 5 "[* -.+ *1 . * 2]" 1 37 ARG 1.319 0.126 15 0 "[ . 1 . 2]" 1 38 SER 0.642 0.143 6 0 "[ . 1 . 2]" 1 39 LEU 64.498 0.661 8 3 "[ .- + 1* . 2]" 1 40 GLY 6.256 0.362 12 0 "[ . 1 . 2]" 1 41 GLN 16.002 0.430 5 0 "[ . 1 . 2]" 1 42 ASN 20.583 0.364 19 0 "[ . 1 . 2]" 1 43 PRO 1.961 0.170 18 0 "[ . 1 . 2]" 1 44 THR 12.840 0.273 7 0 "[ . 1 . 2]" 1 45 GLU 6.738 0.465 10 0 "[ . 1 . 2]" 1 46 ALA 7.088 0.209 17 0 "[ . 1 . 2]" 1 47 GLU 7.192 0.209 17 0 "[ . 1 . 2]" 1 48 LEU 52.355 0.509 4 1 "[ +. 1 . 2]" 1 49 GLN 16.585 0.298 1 0 "[ . 1 . 2]" 1 50 ASP 3.432 0.185 13 0 "[ . 1 . 2]" 1 51 MET 41.800 0.822 13 3 "[ - . *1 + . 2]" 1 52 ILE 39.848 0.305 6 0 "[ . 1 . 2]" 1 53 ASN 14.911 0.277 6 0 "[ . 1 . 2]" 1 54 GLU 8.828 0.330 17 0 "[ . 1 . 2]" 1 55 VAL 37.041 0.361 17 0 "[ . 1 . 2]" 1 56 ASP 9.716 0.288 6 0 "[ . 1 . 2]" 1 57 ALA 26.750 0.409 18 0 "[ . 1 . 2]" 1 58 ASP 9.760 0.333 18 0 "[ . 1 . 2]" 1 59 GLY 1.186 0.122 18 0 "[ . 1 . 2]" 1 60 ASN 14.520 0.409 18 0 "[ . 1 . 2]" 1 61 GLY 11.431 0.280 13 0 "[ . 1 . 2]" 1 62 THR 31.395 0.281 14 0 "[ . 1 . 2]" 1 63 ILE 60.407 0.419 6 0 "[ . 1 . 2]" 1 64 ASP 26.455 0.323 12 0 "[ . 1 . 2]" 1 65 PHE 10.061 0.323 12 0 "[ . 1 . 2]" 1 66 PRO 2.740 0.108 14 0 "[ . 1 . 2]" 1 67 GLU 18.167 0.333 18 0 "[ . 1 . 2]" 1 68 PHE 51.631 0.419 6 0 "[ . 1 . 2]" 1 69 LEU 64.081 0.419 6 0 "[ . 1 . 2]" 1 70 THR 9.618 0.318 20 0 "[ . 1 . 2]" 1 71 MET 48.554 0.361 17 0 "[ . 1 . 2]" 1 72 MET 49.894 0.651 6 2 "[ .+ 1 .- 2]" 1 73 ALA 22.660 0.354 15 0 "[ . 1 . 2]" 1 74 ARG 11.028 0.287 5 0 "[ . 1 . 2]" 1 75 LYS 5.791 0.299 17 0 "[ . 1 . 2]" 1 76 MET 15.037 0.380 13 0 "[ . 1 . 2]" 1 77 LYS 13.776 0.672 16 5 "[ * . 1 * *+ -]" 1 78 ASP 5.997 0.672 16 1 "[ . 1 .+ 2]" 1 79 THR 19.336 0.426 20 0 "[ . 1 . 2]" 1 80 ASP 6.488 0.418 9 0 "[ . 1 . 2]" 1 81 SER 2.493 0.197 5 0 "[ . 1 . 2]" 1 82 GLU 8.544 0.270 3 0 "[ . 1 . 2]" 1 83 GLU 14.773 0.477 12 0 "[ . 1 . 2]" 1 84 GLU 9.466 0.477 12 0 "[ . 1 . 2]" 1 85 ILE 41.635 0.509 16 1 "[ . 1 .+ 2]" 1 86 ARG 23.611 0.283 13 0 "[ . 1 . 2]" 1 87 GLU 6.093 0.319 8 0 "[ . 1 . 2]" 1 88 ALA 12.901 0.396 2 0 "[ . 1 . 2]" 1 89 PHE 26.919 0.390 10 0 "[ . 1 . 2]" 1 90 ARG 17.865 0.526 7 1 "[ . + 1 . 2]" 1 91 VAL 28.978 0.317 7 0 "[ . 1 . 2]" 1 92 PHE 52.550 0.845 10 18 "[** -*****+****.*****]" 1 93 ASP 2.009 0.127 10 0 "[ . 1 . 2]" 1 94 LYS 13.930 0.398 6 0 "[ . 1 . 2]" 1 95 ASP 0.699 0.083 12 0 "[ . 1 . 2]" 1 96 GLY 0.292 0.042 9 0 "[ . 1 . 2]" 1 97 ASN 17.147 0.376 15 0 "[ . 1 . 2]" 1 98 GLY 0.056 0.022 15 0 "[ . 1 . 2]" 1 99 TYR 37.495 0.387 12 0 "[ . 1 . 2]" 1 100 ILE 71.825 1.247 10 19 [****.*-**+**********] 1 101 SER 11.361 0.305 16 0 "[ . 1 . 2]" 1 102 ALA 16.598 0.327 14 0 "[ . 1 . 2]" 1 103 ALA 17.154 0.598 9 3 "[ - +1 . *2]" 1 104 GLU 19.692 0.598 9 3 "[ - +1 . *2]" 1 105 LEU 177.750 1.729 5 20 [****+*******-*******] 1 106 ARG 18.950 0.591 5 1 "[ + 1 . 2]" 1 107 HIS 4.172 0.159 16 0 "[ . 1 . 2]" 1 108 VAL 108.068 1.729 5 20 [****+-**************] 1 109 MET 63.389 1.729 5 20 [****+***************] 1 110 THR 10.072 0.840 5 1 "[ + 1 . 2]" 1 111 ASN 5.575 0.299 5 0 "[ . 1 . 2]" 1 112 LEU 44.880 0.661 8 3 "[ .- + 1 . *]" 1 113 GLY 4.435 0.367 20 0 "[ . 1 . 2]" 1 114 GLU 3.933 0.367 20 0 "[ . 1 . 2]" 1 115 LYS 3.101 0.212 10 0 "[ . 1 . 2]" 1 116 LEU 22.450 0.287 2 0 "[ . 1 . 2]" 1 117 THR 13.500 0.263 16 0 "[ . 1 . 2]" 1 118 ASP 1.738 0.196 14 0 "[ . 1 . 2]" 1 119 GLU 4.469 0.189 15 0 "[ . 1 . 2]" 1 120 GLU 15.384 0.324 1 0 "[ . 1 . 2]" 1 121 VAL 71.297 0.776 2 18 "[*+**********- *** **]" 1 122 ASP 5.190 0.297 16 0 "[ . 1 . 2]" 1 123 GLU 2.290 0.220 19 0 "[ . 1 . 2]" 1 124 MET 67.107 1.729 5 20 [****+***********-***] 1 125 ILE 47.886 0.526 19 3 "[ . 1 * - +2]" 1 126 ARG 13.208 0.416 4 0 "[ . 1 . 2]" 1 127 GLU 5.573 0.376 15 0 "[ . 1 . 2]" 1 128 ALA 24.045 0.406 7 0 "[ . 1 . 2]" 1 129 ASP 4.883 0.226 5 0 "[ . 1 . 2]" 1 130 ILE 38.700 0.490 5 0 "[ . 1 . 2]" 1 131 ASP 9.011 0.309 13 0 "[ . 1 . 2]" 1 132 GLY 15.999 0.667 12 1 "[ . 1 + . 2]" 1 133 ASP 7.762 0.667 12 1 "[ . 1 + . 2]" 1 134 GLY 3.526 0.195 12 0 "[ . 1 . 2]" 1 135 GLN 26.754 0.376 15 0 "[ . 1 . 2]" 1 136 VAL 67.707 1.247 10 15 "[ * .*** +****-*****]" 1 137 ASN 35.834 0.322 15 0 "[ . 1 . 2]" 1 138 TYR 21.728 0.387 12 0 "[ . 1 . 2]" 1 139 GLU 14.159 0.313 9 0 "[ . 1 . 2]" 1 140 GLU 60.044 1.006 11 19 [****.*-***+*********] 1 141 PHE 43.936 0.479 19 0 "[ . 1 . 2]" 1 142 VAL 34.891 0.386 7 0 "[ . 1 . 2]" 1 143 GLN 29.884 0.510 19 1 "[ . 1 . +2]" 1 144 MET 39.431 0.565 10 3 "[ . +* .- 2]" 1 145 MET 21.898 0.489 18 0 "[ . 1 . 2]" 1 146 THR 17.445 0.510 19 1 "[ . 1 . +2]" 1 147 ALA 7.809 0.196 18 0 "[ . 1 . 2]" 1 148 LYS 11.549 0.360 8 0 "[ . 1 . 2]" 2 2 MET 13.437 0.661 8 1 "[ . + 1 . 2]" 2 3 ASP 11.375 0.361 20 0 "[ . 1 . 2]" 2 4 VAL 30.399 0.661 8 1 "[ . + 1 . 2]" 2 5 PHE 45.230 0.822 13 3 "[ . 1 + . *-]" 2 6 MET 32.093 0.677 19 2 "[ . - 1 . +2]" 2 7 LYS 3.103 0.342 18 0 "[ . 1 . 2]" 2 8 GLY 6.501 0.477 12 0 "[ . 1 . 2]" 2 9 LEU 27.163 0.958 20 3 "[ . * 1 .- +]" 2 10 SER 0.988 0.188 7 0 "[ . 1 . 2]" 2 11 LYS 0.866 0.143 3 0 "[ . 1 . 2]" 2 12 ALA 9.147 0.327 10 0 "[ . 1 . 2]" 2 13 LYS 4.139 0.327 10 0 "[ . 1 . 2]" 2 14 GLU 3.683 0.308 5 0 "[ . 1 . 2]" 2 15 GLY 13.665 0.308 5 0 "[ . 1 . 2]" 2 16 VAL 23.186 0.285 2 0 "[ . 1 . 2]" 2 17 VAL 11.756 0.295 2 0 "[ . 1 . 2]" 2 18 ALA 4.371 0.314 18 0 "[ . 1 . 2]" 2 19 ALA 10.745 0.403 18 0 "[ . 1 . 2]" 2 20 ALA 9.324 0.403 18 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 2 ASP HB3 1 3 GLN H 5.507 4.268 5.755 4.282 4.109 4.453 0.159 15 0 "[ . 1 . 2]" 1 2 1 3 GLN H 1 3 GLN HA . 2.758 3.405 2.895 2.385 3.001 0.373 4 0 "[ . 1 . 2]" 1 3 1 3 GLN H 1 3 GLN HB2 3.368 2.610 4.347 2.712 2.461 4.080 0.149 2 0 "[ . 1 . 2]" 1 4 1 3 GLN H 1 3 GLN HB3 3.343 2.591 4.315 3.280 2.563 4.129 0.028 1 0 "[ . 1 . 2]" 1 5 1 3 GLN H 1 3 GLN QG 3.676 2.849 4.745 3.369 2.623 4.105 0.226 12 0 "[ . 1 . 2]" 1 6 1 3 GLN H 1 4 LEU QD 4.571 3.543 5.900 5.257 4.208 6.010 0.110 4 0 "[ . 1 . 2]" 1 7 1 4 LEU H 1 4 LEU MD1 4.568 3.670 5.687 3.912 3.628 4.302 0.042 10 0 "[ . 1 . 2]" 1 8 1 4 LEU H 1 4 LEU MD2 5.053 4.060 6.291 4.351 3.836 4.658 0.224 20 0 "[ . 1 . 2]" 1 9 1 4 LEU H 1 5 THR H 4.118 3.192 5.315 4.533 4.413 4.644 . 0 0 "[ . 1 . 2]" 1 10 1 4 LEU HB2 1 4 LEU MD1 3.900 2.318 4.855 2.336 2.216 3.187 0.102 3 0 "[ . 1 . 2]" 1 11 1 4 LEU HB2 1 4 LEU MD2 3.858 2.386 4.803 2.427 2.287 3.207 0.099 16 0 "[ . 1 . 2]" 1 12 1 4 LEU HB2 1 5 THR H 3.075 2.383 3.969 4.216 4.045 4.270 0.301 10 0 "[ . 1 . 2]" 1 13 1 4 LEU HB2 1 8 GLN H 3.901 3.023 5.035 4.969 4.852 5.048 0.013 15 0 "[ . 1 . 2]" 1 14 1 4 LEU HB2 1 9 ILE H 3.420 2.651 4.414 4.421 4.388 4.450 0.036 3 0 "[ . 1 . 2]" 1 15 1 4 LEU HB2 1 9 ILE MD 5.265 4.230 6.555 4.649 4.087 5.172 0.143 20 0 "[ . 1 . 2]" 1 16 1 4 LEU HB2 1 9 ILE MG 4.968 3.992 6.185 4.080 3.998 4.293 . 0 0 "[ . 1 . 2]" 1 17 1 4 LEU HB3 1 5 THR H 3.033 2.351 3.915 2.418 2.197 3.189 0.154 5 0 "[ . 1 . 2]" 1 18 1 4 LEU HB3 1 9 ILE H 3.354 2.599 4.329 4.302 4.100 4.667 0.338 20 0 "[ . 1 . 2]" 1 19 1 4 LEU HB3 1 9 ILE MD 4.075 3.274 5.073 3.486 3.076 4.160 0.198 16 0 "[ . 1 . 2]" 1 20 1 4 LEU QD 1 8 GLN H 4.184 3.243 5.400 4.752 3.701 5.519 0.119 20 0 "[ . 1 . 2]" 1 21 1 4 LEU QD 1 8 GLN HE21 3.913 3.033 5.051 3.861 3.012 4.751 0.021 13 0 "[ . 1 . 2]" 1 22 1 4 LEU QD 1 8 GLN HE22 4.386 3.399 5.661 4.546 3.306 5.422 0.093 3 0 "[ . 1 . 2]" 1 23 1 4 LEU QD 1 9 ILE H 3.292 2.551 4.249 3.335 2.980 3.480 . 0 0 "[ . 1 . 2]" 1 24 1 4 LEU QD 1 73 ALA HA 3.568 2.867 4.442 4.568 4.469 4.775 0.333 18 0 "[ . 1 . 2]" 1 25 1 4 LEU QD 1 73 ALA MB 4.288 3.245 5.338 3.260 3.097 3.427 0.148 3 0 "[ . 1 . 2]" 1 26 1 4 LEU MD1 1 9 ILE HA 5.169 4.153 6.435 5.237 4.064 5.764 0.089 16 0 "[ . 1 . 2]" 1 27 1 4 LEU MD1 1 12 PHE QR 4.886 3.926 6.083 3.871 3.694 5.085 0.232 16 0 "[ . 1 . 2]" 1 28 1 4 LEU MD1 1 69 LEU HA 5.490 4.411 6.835 6.770 6.309 6.966 0.131 17 0 "[ . 1 . 2]" 1 29 1 4 LEU MD1 1 69 LEU MD1 4.173 3.153 5.195 3.960 3.292 4.197 . 0 0 "[ . 1 . 2]" 1 30 1 4 LEU MD1 1 69 LEU MD2 4.264 3.426 5.309 4.754 3.287 5.055 0.139 20 0 "[ . 1 . 2]" 1 31 1 4 LEU MD1 1 73 ALA HA 5.283 4.245 6.577 4.990 4.670 6.272 . 0 0 "[ . 1 . 2]" 1 32 1 4 LEU MD2 1 5 THR H 4.589 3.687 5.713 3.925 3.594 4.054 0.093 16 0 "[ . 1 . 2]" 1 33 1 4 LEU MD2 1 8 GLN HB3 4.548 3.654 5.662 3.794 3.386 4.483 0.268 7 0 "[ . 1 . 2]" 1 34 1 4 LEU MD2 1 8 GLN HE22 5.536 4.448 6.892 6.544 5.234 7.142 0.250 7 0 "[ . 1 . 2]" 1 35 1 4 LEU MD2 1 9 ILE HA 4.210 3.383 5.241 3.560 3.452 3.795 . 0 0 "[ . 1 . 2]" 1 36 1 4 LEU MD2 1 9 ILE MG 4.820 3.873 6.001 4.537 3.937 6.179 0.178 16 0 "[ . 1 . 2]" 1 37 1 4 LEU MD2 1 12 PHE QR 4.946 3.974 6.158 4.188 3.895 4.632 0.079 17 0 "[ . 1 . 2]" 1 38 1 4 LEU MD2 1 69 LEU MD2 4.365 3.307 5.434 3.136 2.903 4.538 0.404 5 0 "[ . 1 . 2]" 1 39 1 4 LEU MD2 1 72 MET HG3 6.080 4.885 7.569 6.964 6.674 7.567 . 0 0 "[ . 1 . 2]" 1 40 1 4 LEU MD2 1 73 ALA HA 4.722 3.794 5.879 5.504 4.905 5.911 0.032 3 0 "[ . 1 . 2]" 1 41 1 4 LEU MD2 1 73 ALA MB 4.545 3.652 5.658 3.736 3.420 4.128 0.232 18 0 "[ . 1 . 2]" 1 42 1 4 LEU MD2 1 76 MET ME 5.186 4.167 5.784 5.220 4.235 5.871 0.087 17 0 "[ . 1 . 2]" 1 43 1 5 THR H 1 5 THR HA 3.083 2.389 3.979 3.001 2.995 3.005 . 0 0 "[ . 1 . 2]" 1 44 1 5 THR H 1 5 THR HB 3.320 2.573 4.285 3.740 3.714 3.768 . 0 0 "[ . 1 . 2]" 1 45 1 5 THR H 1 5 THR MG . 3.060 3.172 2.838 2.810 2.886 0.250 7 0 "[ . 1 . 2]" 1 46 1 5 THR H 1 6 GLU H 4.348 3.370 5.612 4.571 4.552 4.584 . 0 0 "[ . 1 . 2]" 1 47 1 5 THR H 1 6 GLU H 2.713 2.103 3.502 2.689 2.623 2.779 . 0 0 "[ . 1 . 2]" 1 48 1 5 THR H 1 9 ILE H 3.937 3.051 5.081 4.033 3.939 4.157 . 0 0 "[ . 1 . 2]" 1 49 1 5 THR H 1 8 GLN H 3.621 2.806 4.674 3.972 3.602 4.151 . 0 0 "[ . 1 . 2]" 1 50 1 5 THR H 1 8 GLN HA 4.873 3.777 6.290 5.634 5.259 5.807 . 0 0 "[ . 1 . 2]" 1 51 1 5 THR H 1 8 GLN HB3 2.727 2.114 3.520 2.956 2.569 3.613 0.093 1 0 "[ . 1 . 2]" 1 52 1 5 THR H 1 8 GLN HE21 5.186 4.019 6.372 4.997 4.273 5.803 . 0 0 "[ . 1 . 2]" 1 53 1 5 THR H 1 8 GLN HE22 5.603 4.342 6.718 5.842 4.306 6.814 0.096 18 0 "[ . 1 . 2]" 1 54 1 5 THR H 1 9 ILE H 4.277 3.315 5.520 4.760 4.380 5.070 . 0 0 "[ . 1 . 2]" 1 55 1 5 THR H 1 9 ILE MD 5.299 4.107 6.839 5.154 4.723 5.892 . 0 0 "[ . 1 . 2]" 1 56 1 5 THR H 1 9 ILE HG12 4.829 3.743 6.233 6.167 5.851 6.417 0.184 12 0 "[ . 1 . 2]" 1 57 1 5 THR H 1 69 LEU MD2 5.446 4.221 7.029 7.246 6.648 7.401 0.372 8 0 "[ . 1 . 2]" 1 58 1 5 THR HA 1 5 THR MG 3.306 2.656 4.116 2.397 2.384 2.406 0.272 12 0 "[ . 1 . 2]" 1 59 1 5 THR HA 1 6 GLU H 2.249 . 2.903 2.317 2.285 2.385 . 0 0 "[ . 1 . 2]" 1 60 1 5 THR HA 1 7 GLU H 3.703 2.870 4.779 4.283 3.980 4.392 . 0 0 "[ . 1 . 2]" 1 61 1 5 THR HA 1 8 GLN H 4.396 3.407 5.674 4.764 4.599 4.876 . 0 0 "[ . 1 . 2]" 1 62 1 5 THR HB 1 6 GLU H 2.544 . 3.283 2.617 2.533 2.651 . 0 0 "[ . 1 . 2]" 1 63 1 5 THR HB 1 7 GLU H 3.244 2.514 4.187 2.773 2.509 2.905 0.005 7 0 "[ . 1 . 2]" 1 64 1 5 THR HB 1 8 GLN H 4.161 3.225 5.371 3.519 3.296 3.860 . 0 0 "[ . 1 . 2]" 1 65 1 5 THR MG 1 6 GLU H 2.880 2.232 3.717 3.727 3.655 3.758 0.041 19 0 "[ . 1 . 2]" 1 66 1 5 THR MG 1 7 GLU H 3.849 2.983 4.968 4.392 4.142 4.505 . 0 0 "[ . 1 . 2]" 1 67 1 5 THR MG 1 8 GLN H . 4.395 5.293 4.425 4.308 4.586 0.087 3 0 "[ . 1 . 2]" 1 68 1 5 THR MG 1 8 GLN HB3 4.644 3.731 5.782 3.876 3.474 4.567 0.257 20 0 "[ . 1 . 2]" 1 69 1 5 THR MG 1 8 GLN HE21 4.963 3.847 6.406 5.335 4.566 6.413 0.007 3 0 "[ . 1 . 2]" 1 70 1 5 THR MG 1 8 GLN HE22 4.979 3.859 6.426 5.884 4.429 6.584 0.158 6 0 "[ . 1 . 2]" 1 71 1 6 GLU H 1 6 GLU HA . 2.883 3.595 2.851 2.829 2.876 0.054 15 0 "[ . 1 . 2]" 1 72 1 6 GLU H 1 6 GLU QB 2.237 . 2.887 2.349 2.245 2.579 . 0 0 "[ . 1 . 2]" 1 73 1 6 GLU H 1 6 GLU QG 2.974 2.305 3.838 3.331 2.239 4.060 0.222 15 0 "[ . 1 . 2]" 1 74 1 6 GLU H 1 7 GLU H 3.030 2.348 3.911 2.708 2.639 2.803 . 0 0 "[ . 1 . 2]" 1 75 1 6 GLU H 1 8 GLN H 4.434 3.453 5.723 4.323 4.123 4.497 . 0 0 "[ . 1 . 2]" 1 76 1 6 GLU H 1 9 ILE H 4.782 3.706 6.172 5.185 5.065 5.331 . 0 0 "[ . 1 . 2]" 1 77 1 6 GLU H 1 9 ILE MD 4.681 3.628 6.042 5.045 4.868 5.419 . 0 0 "[ . 1 . 2]" 1 78 1 6 GLU H 1 9 ILE HG12 5.268 4.083 6.799 6.299 6.194 6.455 . 0 0 "[ . 1 . 2]" 1 79 1 6 GLU H 1 10 ALA H 6.490 5.030 8.376 6.612 6.375 6.912 . 0 0 "[ . 1 . 2]" 1 80 1 6 GLU HA 1 6 GLU QB 2.572 2.066 3.202 2.359 2.186 2.419 . 0 0 "[ . 1 . 2]" 1 81 1 6 GLU HA 1 6 GLU QG 3.447 2.770 4.291 2.777 2.372 3.487 0.398 3 0 "[ . 1 . 2]" 1 82 1 6 GLU HA 1 7 GLU H 3.621 3.462 4.674 3.539 3.446 3.562 0.016 7 0 "[ . 1 . 2]" 1 83 1 6 GLU HA 1 10 ALA H 3.701 2.868 4.777 3.406 3.258 3.533 . 0 0 "[ . 1 . 2]" 1 84 1 6 GLU HA 1 9 ILE H 3.383 3.273 4.366 3.531 3.353 3.645 . 0 0 "[ . 1 . 2]" 1 85 1 6 GLU HA 1 9 ILE HB 2.969 2.385 3.696 3.256 3.072 3.760 0.064 14 0 "[ . 1 . 2]" 1 86 1 6 GLU HA 1 9 ILE MD 4.110 3.302 4.504 3.088 3.035 3.165 0.267 3 0 "[ . 1 . 2]" 1 87 1 6 GLU HA 1 9 ILE HG12 4.127 3.316 5.138 4.266 4.126 4.387 . 0 0 "[ . 1 . 2]" 1 88 1 6 GLU HA 1 9 ILE HG13 3.807 3.059 4.739 3.685 3.204 3.961 . 0 0 "[ . 1 . 2]" 1 89 1 6 GLU HA 1 9 ILE MG 4.743 3.811 5.905 3.973 3.814 4.036 . 0 0 "[ . 1 . 2]" 1 90 1 6 GLU QB 1 7 GLU H 2.355 . 3.040 2.584 2.199 3.245 0.205 19 0 "[ . 1 . 2]" 1 91 1 6 GLU QG 1 7 GLU H 3.238 2.510 4.179 3.138 2.320 3.882 0.190 4 0 "[ . 1 . 2]" 1 92 1 7 GLU H 1 7 GLU HA 2.916 2.319 3.593 2.849 2.817 2.880 . 0 0 "[ . 1 . 2]" 1 93 1 7 GLU H 1 7 GLU HB2 2.924 2.266 3.774 2.482 2.369 3.601 . 0 0 "[ . 1 . 2]" 1 94 1 7 GLU H 1 7 GLU HG3 3.259 2.526 4.206 3.271 2.354 4.443 0.237 5 0 "[ . 1 . 2]" 1 95 1 7 GLU H 1 8 GLN H 2.950 2.286 3.436 2.726 2.603 2.814 . 0 0 "[ . 1 . 2]" 1 96 1 7 GLU H 1 9 ILE H 4.281 3.318 5.526 4.367 4.239 4.500 . 0 0 "[ . 1 . 2]" 1 97 1 7 GLU H 1 10 ALA H 5.131 3.977 6.623 5.075 5.008 5.173 . 0 0 "[ . 1 . 2]" 1 98 1 7 GLU H 1 10 ALA MB 4.591 3.558 5.926 5.136 4.967 5.229 . 0 0 "[ . 1 . 2]" 1 99 1 7 GLU HA 1 7 GLU HB2 2.646 2.126 3.294 2.857 2.387 3.031 . 0 0 "[ . 1 . 2]" 1 100 1 7 GLU HA 1 7 GLU HB3 2.845 2.286 3.542 2.664 2.525 3.035 . 0 0 "[ . 1 . 2]" 1 101 1 7 GLU HA 1 7 GLU HG2 3.139 2.522 3.908 3.083 2.460 3.738 0.062 6 0 "[ . 1 . 2]" 1 102 1 7 GLU HA 1 8 GLN H 3.497 3.149 4.513 3.555 3.518 3.579 . 0 0 "[ . 1 . 2]" 1 103 1 7 GLU HA 1 10 ALA H 3.607 2.898 4.491 3.524 3.294 3.797 . 0 0 "[ . 1 . 2]" 1 104 1 7 GLU HA 1 10 ALA MB . 2.985 3.505 2.946 2.894 3.131 0.091 20 0 "[ . 1 . 2]" 1 105 1 7 GLU HB2 1 8 GLN H 2.963 2.296 3.824 3.077 2.632 3.922 0.098 4 0 "[ . 1 . 2]" 1 106 1 7 GLU HB2 1 10 ALA MB 3.920 3.150 4.880 3.996 3.728 4.097 . 0 0 "[ . 1 . 2]" 1 107 1 7 GLU HB3 1 8 GLN H 2.901 2.248 3.744 3.362 2.505 3.862 0.118 4 0 "[ . 1 . 2]" 1 108 1 7 GLU HG3 1 10 ALA MB 5.216 4.191 6.494 4.886 4.041 5.767 0.150 3 0 "[ . 1 . 2]" 1 109 1 8 GLN H 1 8 GLN HA 2.947 2.521 3.804 2.855 2.838 2.868 . 0 0 "[ . 1 . 2]" 1 110 1 8 GLN H 1 8 GLN HB2 2.952 2.288 3.810 2.412 2.366 2.524 . 0 0 "[ . 1 . 2]" 1 111 1 8 GLN H 1 8 GLN HB3 2.294 . 2.961 2.360 2.072 2.684 . 0 0 "[ . 1 . 2]" 1 112 1 8 GLN H 1 8 GLN HE21 4.666 3.685 6.022 5.381 4.237 6.179 0.157 3 0 "[ . 1 . 2]" 1 113 1 8 GLN H 1 8 GLN HE22 5.397 4.394 6.966 5.991 5.194 6.615 . 0 0 "[ . 1 . 2]" 1 114 1 8 GLN H 1 9 ILE H 2.753 2.134 3.553 2.807 2.759 2.906 . 0 0 "[ . 1 . 2]" 1 115 1 8 GLN H 1 9 ILE H 2.856 2.214 3.686 2.765 2.721 2.857 . 0 0 "[ . 1 . 2]" 1 116 1 8 GLN H 1 9 ILE HG12 4.318 3.347 5.573 5.415 5.263 5.510 . 0 0 "[ . 1 . 2]" 1 117 1 8 GLN HA 1 8 GLN HB2 3.234 2.598 4.026 2.885 2.530 3.038 0.068 3 0 "[ . 1 . 2]" 1 118 1 8 GLN HA 1 8 GLN HB3 2.849 2.289 3.547 2.282 2.150 2.443 0.139 1 0 "[ . 1 . 2]" 1 119 1 8 GLN HA 1 8 GLN HE21 4.672 3.621 6.030 4.522 4.083 5.223 . 0 0 "[ . 1 . 2]" 1 120 1 8 GLN HA 1 8 GLN HE22 5.299 4.107 6.839 4.774 4.011 5.950 0.096 7 0 "[ . 1 . 2]" 1 121 1 8 GLN HA 1 9 ILE H 4.870 3.913 6.063 3.616 3.602 3.651 0.311 2 0 "[ . 1 . 2]" 1 122 1 8 GLN HA 1 10 ALA H 4.712 3.652 6.082 4.433 4.248 4.689 . 0 0 "[ . 1 . 2]" 1 123 1 8 GLN HA 1 11 GLU H 3.558 2.758 4.592 3.399 3.266 3.578 . 0 0 "[ . 1 . 2]" 1 124 1 8 GLN HA 1 12 PHE H 4.278 3.603 5.522 4.601 4.183 4.918 . 0 0 "[ . 1 . 2]" 1 125 1 8 GLN HB2 1 8 GLN HE21 4.089 3.169 5.278 4.079 3.138 4.714 0.031 14 0 "[ . 1 . 2]" 1 126 1 8 GLN HB2 1 8 GLN HE22 4.775 3.701 6.163 4.715 3.792 5.383 . 0 0 "[ . 1 . 2]" 1 127 1 8 GLN HB3 1 8 GLN HE21 2.697 2.090 3.481 2.254 2.196 2.357 . 0 0 "[ . 1 . 2]" 1 128 1 8 GLN HB3 1 8 GLN HE22 3.072 2.381 3.965 3.187 3.105 3.276 . 0 0 "[ . 1 . 2]" 1 129 1 8 GLN HB3 1 9 ILE H 2.926 2.268 3.777 3.140 2.533 3.444 . 0 0 "[ . 1 . 2]" 1 130 1 8 GLN HE21 1 76 MET ME . 4.969 5.519 5.350 4.882 5.666 0.147 7 0 "[ . 1 . 2]" 1 131 1 8 GLN HE22 1 76 MET ME . 5.240 6.089 5.529 5.056 6.100 0.184 10 0 "[ . 1 . 2]" 1 132 1 9 ILE H 1 9 ILE HA 3.108 2.409 3.663 2.853 2.844 2.862 . 0 0 "[ . 1 . 2]" 1 133 1 9 ILE H 1 9 ILE HB 2.490 . 3.214 2.445 2.377 2.525 . 0 0 "[ . 1 . 2]" 1 134 1 9 ILE H 1 9 ILE MD 4.384 3.522 5.458 3.607 3.558 3.657 . 0 0 "[ . 1 . 2]" 1 135 1 9 ILE H 1 9 ILE HG12 2.668 2.068 3.443 3.235 3.098 3.299 . 0 0 "[ . 1 . 2]" 1 136 1 9 ILE H 1 9 ILE HG13 2.734 2.119 3.529 2.232 2.084 2.322 0.035 19 0 "[ . 1 . 2]" 1 137 1 9 ILE H 1 9 ILE MG 4.409 3.542 5.489 3.787 3.763 3.816 . 0 0 "[ . 1 . 2]" 1 138 1 9 ILE H 1 10 ALA H 2.950 2.524 3.808 2.744 2.706 2.804 . 0 0 "[ . 1 . 2]" 1 139 1 9 ILE H 1 11 GLU H 4.532 3.513 5.849 4.165 4.101 4.301 . 0 0 "[ . 1 . 2]" 1 140 1 9 ILE H 1 69 LEU MD2 4.995 3.871 6.447 6.011 5.609 6.356 . 0 0 "[ . 1 . 2]" 1 141 1 9 ILE HA 1 9 ILE HB 3.037 2.440 3.781 3.032 3.026 3.042 . 0 0 "[ . 1 . 2]" 1 142 1 9 ILE HA 1 9 ILE MD 4.310 3.463 5.366 3.805 3.776 3.838 . 0 0 "[ . 1 . 2]" 1 143 1 9 ILE HA 1 9 ILE HG12 2.327 . 2.897 2.186 2.164 2.205 . 0 0 "[ . 1 . 2]" 1 144 1 9 ILE HA 1 9 ILE HG13 2.886 2.319 3.593 2.877 2.789 3.042 . 0 0 "[ . 1 . 2]" 1 145 1 9 ILE HA 1 9 ILE MG 3.491 2.605 4.346 2.460 2.405 2.502 0.200 18 0 "[ . 1 . 2]" 1 146 1 9 ILE HA 1 10 ALA H 4.300 3.333 4.951 3.573 3.557 3.597 . 0 0 "[ . 1 . 2]" 1 147 1 9 ILE HA 1 12 PHE H 3.643 2.994 4.640 3.563 3.482 3.711 . 0 0 "[ . 1 . 2]" 1 148 1 9 ILE HA 1 12 PHE QB 2.835 2.278 3.530 3.593 3.478 3.667 0.137 10 0 "[ . 1 . 2]" 1 149 1 9 ILE HA 1 12 PHE QD 3.516 2.825 4.377 3.536 3.267 3.910 . 0 0 "[ . 1 . 2]" 1 150 1 9 ILE HA 1 13 LYS H 4.216 3.267 5.442 4.098 3.654 4.424 . 0 0 "[ . 1 . 2]" 1 151 1 9 ILE HA 1 69 LEU MD1 4.542 3.449 5.655 3.503 3.362 3.820 0.087 15 0 "[ . 1 . 2]" 1 152 1 9 ILE HA 1 69 LEU MD2 4.265 4.257 5.310 4.778 4.246 5.200 0.011 7 0 "[ . 1 . 2]" 1 153 1 9 ILE HB 1 9 ILE MD 3.522 2.630 4.385 2.351 2.330 2.387 0.300 2 0 "[ . 1 . 2]" 1 154 1 9 ILE HB 1 10 ALA H 2.837 2.199 3.662 2.710 2.541 2.818 . 0 0 "[ . 1 . 2]" 1 155 1 9 ILE MD 1 9 ILE MG 3.242 2.205 4.036 2.057 2.030 2.089 0.175 12 0 "[ . 1 . 2]" 1 156 1 9 ILE MD 1 10 ALA H 4.434 3.437 5.723 4.674 4.500 4.761 . 0 0 "[ . 1 . 2]" 1 157 1 9 ILE MD 1 10 ALA HA 5.602 4.501 6.974 5.953 5.802 6.027 . 0 0 "[ . 1 . 2]" 1 158 1 9 ILE HG12 1 10 ALA H 3.372 2.613 4.352 3.377 3.327 3.495 . 0 0 "[ . 1 . 2]" 1 159 1 9 ILE HG13 1 9 ILE MG 3.770 3.029 4.694 3.199 3.171 3.212 . 0 0 "[ . 1 . 2]" 1 160 1 9 ILE MG 1 10 ALA H 4.471 3.592 5.566 3.430 3.372 3.567 0.220 8 0 "[ . 1 . 2]" 1 161 1 9 ILE MG 1 10 ALA HA 4.011 3.627 4.993 3.517 3.413 3.626 0.214 9 0 "[ . 1 . 2]" 1 162 1 9 ILE MG 1 12 PHE H 4.762 3.691 6.146 4.605 4.506 4.789 . 0 0 "[ . 1 . 2]" 1 163 1 9 ILE MG 1 12 PHE QB 5.289 4.249 6.585 4.227 4.035 4.523 0.214 12 0 "[ . 1 . 2]" 1 164 1 9 ILE MG 1 12 PHE QD 4.035 3.242 5.024 3.116 3.036 3.258 0.206 20 0 "[ . 1 . 2]" 1 165 1 9 ILE MG 1 13 LYS HD3 4.377 3.517 5.449 4.195 3.414 5.009 0.103 4 0 "[ . 1 . 2]" 1 166 1 9 ILE MG 1 13 LYS QE 4.596 3.693 5.722 4.761 4.284 5.414 . 0 0 "[ . 1 . 2]" 1 167 1 9 ILE MG 1 65 PHE QE 3.575 2.800 4.566 3.157 3.061 3.343 . 0 0 "[ . 1 . 2]" 1 168 1 9 ILE MG 1 65 PHE HZ 2.814 2.204 3.594 2.444 2.129 3.909 0.315 14 0 "[ . 1 . 2]" 1 169 1 9 ILE MG 1 69 LEU MD2 4.195 3.371 5.223 3.396 3.119 4.573 0.252 2 0 "[ . 1 . 2]" 1 170 1 10 ALA H 1 10 ALA HA 2.772 2.208 3.421 2.869 2.821 2.881 . 0 0 "[ . 1 . 2]" 1 171 1 10 ALA H 1 10 ALA MB 2.445 2.444 3.156 2.283 2.270 2.290 0.174 19 0 "[ . 1 . 2]" 1 172 1 10 ALA H 1 11 GLU H 3.046 2.361 3.762 2.703 2.665 2.782 . 0 0 "[ . 1 . 2]" 1 173 1 10 ALA H 1 12 PHE H 3.624 3.143 4.677 4.448 4.388 4.507 . 0 0 "[ . 1 . 2]" 1 174 1 10 ALA H 1 12 PHE QD 4.007 3.138 5.118 4.926 4.877 4.961 . 0 0 "[ . 1 . 2]" 1 175 1 10 ALA H 1 13 LYS H 5.273 4.087 6.806 4.629 4.556 4.699 . 0 0 "[ . 1 . 2]" 1 176 1 10 ALA HA 1 11 GLU H 3.504 2.815 4.362 3.548 3.523 3.565 . 0 0 "[ . 1 . 2]" 1 177 1 10 ALA HA 1 13 LYS H . 3.036 3.911 3.254 3.092 3.560 . 0 0 "[ . 1 . 2]" 1 178 1 10 ALA HA 1 13 LYS QB 2.602 2.091 3.239 2.242 2.078 2.473 0.013 14 0 "[ . 1 . 2]" 1 179 1 10 ALA HA 1 13 LYS HD2 4.281 3.440 5.330 4.059 3.410 4.996 0.030 12 0 "[ . 1 . 2]" 1 180 1 10 ALA MB 1 11 GLU H . 2.852 3.617 2.703 2.657 2.788 0.195 15 0 "[ . 1 . 2]" 1 181 1 10 ALA MB 1 12 PHE H 4.336 3.361 5.596 4.716 4.678 4.745 . 0 0 "[ . 1 . 2]" 1 182 1 11 GLU H 1 11 GLU HA 2.827 2.563 3.649 2.842 2.811 2.855 . 0 0 "[ . 1 . 2]" 1 183 1 11 GLU H 1 11 GLU HB2 2.754 2.134 3.555 2.380 2.273 2.421 . 0 0 "[ . 1 . 2]" 1 184 1 11 GLU H 1 11 GLU HB3 2.647 2.051 3.417 3.535 2.573 3.608 0.191 10 0 "[ . 1 . 2]" 1 185 1 11 GLU H 1 11 GLU HG2 3.325 2.577 4.292 3.170 2.312 4.444 0.265 4 0 "[ . 1 . 2]" 1 186 1 11 GLU H 1 11 GLU HG3 3.069 2.379 3.961 2.928 2.286 4.344 0.383 13 0 "[ . 1 . 2]" 1 187 1 11 GLU H 1 12 PHE H 2.864 2.220 3.425 2.790 2.749 2.813 . 0 0 "[ . 1 . 2]" 1 188 1 11 GLU H 1 13 LYS H 4.368 3.385 5.638 3.882 3.710 4.038 . 0 0 "[ . 1 . 2]" 1 189 1 11 GLU HA 1 11 GLU HB2 3.153 2.533 3.925 3.001 2.515 3.034 0.018 13 0 "[ . 1 . 2]" 1 190 1 11 GLU HA 1 11 GLU HB3 3.336 2.680 4.153 2.567 2.523 2.998 0.157 3 0 "[ . 1 . 2]" 1 191 1 11 GLU HA 1 11 GLU HG2 2.753 2.212 3.427 2.626 2.459 2.971 . 0 0 "[ . 1 . 2]" 1 192 1 11 GLU HA 1 11 GLU HG3 3.435 2.760 4.276 3.157 2.483 3.714 0.277 13 0 "[ . 1 . 2]" 1 193 1 11 GLU HA 1 12 PHE H . 3.572 4.376 3.587 3.575 3.595 . 0 0 "[ . 1 . 2]" 1 194 1 11 GLU HA 1 14 GLU H 2.598 2.014 3.353 2.806 2.800 2.813 . 0 0 "[ . 1 . 2]" 1 195 1 11 GLU HA 1 15 ALA H 3.355 2.600 4.330 3.499 3.468 3.520 . 0 0 "[ . 1 . 2]" 1 196 1 11 GLU HA 1 15 ALA MB 4.654 3.739 5.794 4.693 4.510 4.779 . 0 0 "[ . 1 . 2]" 1 197 1 11 GLU HB2 1 12 PHE H 2.723 2.110 3.514 2.668 2.570 3.735 0.221 13 0 "[ . 1 . 2]" 1 198 1 11 GLU HB3 1 12 PHE H 3.084 2.390 3.981 3.429 2.402 3.538 . 0 0 "[ . 1 . 2]" 1 199 1 11 GLU HG2 1 12 PHE H 4.137 3.206 5.340 4.771 3.706 5.087 . 0 0 "[ . 1 . 2]" 1 200 1 11 GLU HG3 1 12 PHE H 4.533 3.513 5.851 4.670 4.420 5.015 . 0 0 "[ . 1 . 2]" 1 201 1 12 PHE H 1 12 PHE HA 3.061 2.372 3.951 2.953 2.934 2.965 . 0 0 "[ . 1 . 2]" 1 202 1 12 PHE H 1 12 PHE QB 2.608 2.021 3.366 2.599 2.512 2.622 . 0 0 "[ . 1 . 2]" 1 203 1 12 PHE H 1 12 PHE QD 3.664 3.111 4.729 3.129 3.078 3.203 0.033 20 0 "[ . 1 . 2]" 1 204 1 12 PHE H 1 13 LYS H 2.679 2.076 3.419 2.374 2.351 2.410 . 0 0 "[ . 1 . 2]" 1 205 1 12 PHE H 1 14 GLU H 4.242 3.288 5.475 4.361 4.234 4.542 . 0 0 "[ . 1 . 2]" 1 206 1 12 PHE H 1 15 ALA H 4.618 3.579 5.960 5.174 5.009 5.323 . 0 0 "[ . 1 . 2]" 1 207 1 12 PHE H 1 69 LEU QD 4.565 3.538 5.892 5.349 5.049 5.517 . 0 0 "[ . 1 . 2]" 1 208 1 12 PHE H 1 72 MET ME 5.655 4.383 7.299 5.635 5.161 6.038 . 0 0 "[ . 1 . 2]" 1 209 1 12 PHE HA 1 12 PHE QB 2.520 2.025 3.137 2.320 2.313 2.353 . 0 0 "[ . 1 . 2]" 1 210 1 12 PHE HA 1 13 LYS H 3.776 2.927 4.873 3.469 3.407 3.524 . 0 0 "[ . 1 . 2]" 1 211 1 12 PHE HA 1 14 GLU H 4.704 3.646 6.072 4.275 4.194 4.407 . 0 0 "[ . 1 . 2]" 1 212 1 12 PHE HA 1 15 ALA H 3.361 2.605 4.338 3.316 3.249 3.426 . 0 0 "[ . 1 . 2]" 1 213 1 12 PHE HA 1 15 ALA MB . 2.697 3.277 2.705 2.666 2.799 0.031 6 0 "[ . 1 . 2]" 1 214 1 12 PHE HA 1 16 PHE H 4.217 3.268 5.443 3.998 3.742 4.186 . 0 0 "[ . 1 . 2]" 1 215 1 12 PHE HA 1 72 MET ME 6.140 4.333 7.644 4.591 4.293 4.980 0.040 16 0 "[ . 1 . 2]" 1 216 1 12 PHE QB 1 13 LYS H 3.052 2.365 3.939 3.012 2.822 3.186 . 0 0 "[ . 1 . 2]" 1 217 1 12 PHE QB 1 13 LYS HA 4.023 3.232 5.009 3.952 3.896 4.016 . 0 0 "[ . 1 . 2]" 1 218 1 12 PHE QB 1 14 GLU H 5.567 4.315 7.185 4.986 4.924 5.102 . 0 0 "[ . 1 . 2]" 1 219 1 12 PHE QB 1 15 ALA H 4.750 3.681 6.131 4.778 4.713 4.910 . 0 0 "[ . 1 . 2]" 1 220 1 12 PHE QB 1 15 ALA MB 4.619 3.711 5.751 3.778 3.634 4.062 0.077 12 0 "[ . 1 . 2]" 1 221 1 12 PHE QB 1 16 PHE H 4.159 3.223 5.368 4.318 4.054 4.483 . 0 0 "[ . 1 . 2]" 1 222 1 12 PHE QB 1 69 LEU MD1 3.711 2.782 4.620 3.738 3.372 4.080 . 0 0 "[ . 1 . 2]" 1 223 1 12 PHE QB 1 69 LEU MD2 4.743 3.611 5.905 5.766 5.234 6.060 0.155 12 0 "[ . 1 . 2]" 1 224 1 12 PHE QB 1 72 MET HG3 3.138 2.521 3.907 3.705 3.318 4.095 0.188 6 0 "[ . 1 . 2]" 1 225 1 12 PHE QR 1 72 MET ME 4.473 2.794 5.569 2.591 2.465 2.717 0.329 18 0 "[ . 1 . 2]" 1 226 1 12 PHE QR 1 76 MET ME 5.323 4.277 6.627 5.028 4.193 6.562 0.084 9 0 "[ . 1 . 2]" 1 227 1 12 PHE QD 1 13 LYS H 3.621 2.806 4.674 4.113 3.929 4.219 . 0 0 "[ . 1 . 2]" 1 228 1 12 PHE QD 1 15 ALA H 4.423 3.428 5.709 4.933 4.836 5.026 . 0 0 "[ . 1 . 2]" 1 229 1 12 PHE QD 1 69 LEU MD1 3.853 2.896 4.797 2.864 2.747 3.168 0.149 20 0 "[ . 1 . 2]" 1 230 1 12 PHE QD 1 69 LEU MD2 4.306 3.260 5.361 3.420 3.133 4.760 0.127 15 0 "[ . 1 . 2]" 1 231 1 12 PHE QD 1 69 LEU HA 4.017 3.228 5.001 4.955 4.703 5.104 0.103 7 0 "[ . 1 . 2]" 1 232 1 12 PHE QE 1 73 ALA H 5.061 3.922 6.532 6.159 5.836 6.394 . 0 0 "[ . 1 . 2]" 1 233 1 12 PHE QE 1 73 ALA HA 4.460 3.583 5.553 5.766 5.642 5.872 0.319 3 0 "[ . 1 . 2]" 1 234 1 13 LYS H 1 13 LYS HA 3.053 2.415 3.742 2.863 2.846 2.873 . 0 0 "[ . 1 . 2]" 1 235 1 13 LYS H 1 13 LYS QB 2.285 . 2.949 2.289 2.246 2.299 . 0 0 "[ . 1 . 2]" 1 236 1 13 LYS H 1 13 LYS HD2 3.196 2.477 4.125 4.196 4.162 4.333 0.208 2 0 "[ . 1 . 2]" 1 237 1 13 LYS H 1 13 LYS HD3 4.921 3.814 6.352 4.961 4.713 5.022 . 0 0 "[ . 1 . 2]" 1 238 1 13 LYS H 1 13 LYS HG2 3.556 2.756 4.590 4.514 4.461 4.523 . 0 0 "[ . 1 . 2]" 1 239 1 13 LYS H 1 14 GLU H 2.729 2.229 3.522 2.699 2.666 2.742 . 0 0 "[ . 1 . 2]" 1 240 1 13 LYS H 1 15 ALA H 3.768 3.419 4.863 4.257 4.219 4.305 . 0 0 "[ . 1 . 2]" 1 241 1 13 LYS H 1 69 LEU QD 4.686 3.632 6.048 5.435 5.156 5.978 . 0 0 "[ . 1 . 2]" 1 242 1 13 LYS HA 1 13 LYS QB 2.244 . 2.794 2.388 2.377 2.395 . 0 0 "[ . 1 . 2]" 1 243 1 13 LYS HA 1 13 LYS HG2 3.140 2.523 3.909 3.040 2.689 3.126 . 0 0 "[ . 1 . 2]" 1 244 1 13 LYS HA 1 13 LYS HG3 3.263 2.622 4.062 2.507 2.418 2.758 0.204 2 0 "[ . 1 . 2]" 1 245 1 13 LYS HA 1 14 GLU H 3.348 3.071 4.321 3.560 3.551 3.565 . 0 0 "[ . 1 . 2]" 1 246 1 13 LYS HA 1 15 ALA H 4.140 3.209 5.343 4.530 4.451 4.622 . 0 0 "[ . 1 . 2]" 1 247 1 13 LYS HA 1 15 ALA H 3.781 3.038 4.707 3.892 3.690 3.989 . 0 0 "[ . 1 . 2]" 1 248 1 13 LYS HA 1 16 PHE H 3.116 2.427 3.761 3.305 3.192 3.384 . 0 0 "[ . 1 . 2]" 1 249 1 13 LYS HA 1 16 PHE HB2 2.947 2.368 3.669 2.875 2.735 3.007 . 0 0 "[ . 1 . 2]" 1 250 1 13 LYS HA 1 16 PHE HB3 2.912 2.340 3.625 2.510 2.326 2.696 0.014 18 0 "[ . 1 . 2]" 1 251 1 13 LYS HA 1 17 SER H 2.378 . 3.069 2.428 2.268 2.456 . 0 0 "[ . 1 . 2]" 1 252 1 13 LYS HA 1 65 PHE QD 4.288 3.445 5.339 4.498 4.030 5.477 0.138 12 0 "[ . 1 . 2]" 1 253 1 13 LYS HA 1 65 PHE QE 2.866 2.303 3.568 3.344 2.493 3.594 0.026 4 0 "[ . 1 . 2]" 1 254 1 13 LYS QB 1 14 GLU H 2.661 2.062 3.435 2.131 2.075 2.203 . 0 0 "[ . 1 . 2]" 1 255 1 13 LYS QB 1 17 SER H 3.993 3.095 5.154 4.480 4.435 4.535 . 0 0 "[ . 1 . 2]" 1 256 1 13 LYS HG2 1 14 GLU H 5.039 3.905 6.504 3.762 3.712 3.852 0.193 12 0 "[ . 1 . 2]" 1 257 1 13 LYS HG3 1 14 GLU H 4.907 3.803 6.333 4.726 4.664 4.849 . 0 0 "[ . 1 . 2]" 1 258 1 14 GLU H 1 14 GLU HA 3.062 2.460 3.812 2.849 2.841 2.856 . 0 0 "[ . 1 . 2]" 1 259 1 14 GLU H 1 15 ALA H 2.794 2.165 3.467 2.777 2.755 2.819 . 0 0 "[ . 1 . 2]" 1 260 1 14 GLU H 1 16 PHE H 4.738 3.672 5.364 4.009 3.909 4.071 . 0 0 "[ . 1 . 2]" 1 261 1 14 GLU HA 1 14 GLU HB2 3.033 2.437 3.776 2.623 2.473 3.037 . 0 0 "[ . 1 . 2]" 1 262 1 14 GLU HA 1 14 GLU QG 3.222 2.589 4.011 2.610 2.356 2.914 0.233 14 0 "[ . 1 . 2]" 1 263 1 14 GLU HA 1 15 ALA H 3.535 2.840 4.401 3.270 3.222 3.354 . 0 0 "[ . 1 . 2]" 1 264 1 14 GLU HA 1 16 PHE H 3.448 2.672 4.450 4.198 4.133 4.296 . 0 0 "[ . 1 . 2]" 1 265 1 14 GLU HA 1 17 SER H 2.549 . 3.290 2.756 2.735 2.780 . 0 0 "[ . 1 . 2]" 1 266 1 14 GLU QB 1 15 ALA H 2.805 2.174 3.620 2.448 2.382 2.518 . 0 0 "[ . 1 . 2]" 1 267 1 14 GLU QG 1 15 ALA H 4.298 3.331 5.547 3.717 3.453 4.133 . 0 0 "[ . 1 . 2]" 1 268 1 15 ALA H 1 15 ALA HA 2.891 2.528 3.731 2.879 2.867 2.903 . 0 0 "[ . 1 . 2]" 1 269 1 15 ALA H 1 15 ALA MB . 2.359 2.979 2.266 2.256 2.274 0.103 17 0 "[ . 1 . 2]" 1 270 1 15 ALA H 1 16 PHE H 2.982 2.311 3.849 2.616 2.528 2.661 . 0 0 "[ . 1 . 2]" 1 271 1 15 ALA H 1 16 PHE H 2.335 . 3.014 2.433 2.377 2.457 . 0 0 "[ . 1 . 2]" 1 272 1 15 ALA H 1 18 LEU H 4.840 3.751 6.247 5.340 5.244 5.453 . 0 0 "[ . 1 . 2]" 1 273 1 15 ALA H 1 18 LEU MD1 5.143 5.062 6.638 6.237 6.103 6.417 . 0 0 "[ . 1 . 2]" 1 274 1 15 ALA H 1 18 LEU MD2 6.570 4.979 8.179 6.946 6.833 7.093 . 0 0 "[ . 1 . 2]" 1 275 1 15 ALA HA 1 16 PHE H 3.527 2.956 4.552 3.544 3.522 3.575 . 0 0 "[ . 1 . 2]" 1 276 1 15 ALA HA 1 17 SER H 4.406 3.415 5.687 4.502 4.433 4.607 . 0 0 "[ . 1 . 2]" 1 277 1 15 ALA HA 1 18 LEU H 3.515 3.189 4.537 3.620 3.547 3.666 . 0 0 "[ . 1 . 2]" 1 278 1 15 ALA HA 1 18 LEU HB2 3.889 3.125 4.842 3.186 3.094 3.310 0.031 6 0 "[ . 1 . 2]" 1 279 1 15 ALA HA 1 18 LEU HB3 3.574 2.872 4.450 4.012 3.856 4.198 . 0 0 "[ . 1 . 2]" 1 280 1 15 ALA HA 1 18 LEU MD1 3.742 3.204 4.659 4.071 3.889 4.256 . 0 0 "[ . 1 . 2]" 1 281 1 15 ALA HA 1 18 LEU MD2 5.535 4.146 6.917 4.467 4.339 4.619 . 0 0 "[ . 1 . 2]" 1 282 1 15 ALA MB 1 16 PHE H . 2.785 3.311 2.692 2.660 2.794 0.125 6 0 "[ . 1 . 2]" 1 283 1 15 ALA MB 1 16 PHE HA . 3.964 4.179 3.872 3.859 3.880 0.105 7 0 "[ . 1 . 2]" 1 284 1 15 ALA MB 1 18 LEU MD1 . 4.495 5.130 4.926 4.740 5.096 . 0 0 "[ . 1 . 2]" 1 285 1 15 ALA MB 1 18 LEU MD2 4.994 4.012 6.217 4.686 4.545 4.847 . 0 0 "[ . 1 . 2]" 1 286 1 15 ALA MB 1 19 PHE QE 3.648 2.931 4.542 3.117 2.891 3.400 0.040 19 0 "[ . 1 . 2]" 1 287 1 15 ALA MB 1 72 MET ME 4.126 3.315 5.085 4.865 4.578 5.109 0.024 7 0 "[ . 1 . 2]" 1 288 1 16 PHE H 1 16 PHE HA 2.758 2.138 3.560 2.808 2.804 2.813 . 0 0 "[ . 1 . 2]" 1 289 1 16 PHE H 1 16 PHE HA 2.536 2.037 3.157 2.778 2.770 2.785 . 0 0 "[ . 1 . 2]" 1 290 1 16 PHE H 1 16 PHE HB2 2.556 . 3.299 2.473 2.411 2.522 . 0 0 "[ . 1 . 2]" 1 291 1 16 PHE H 1 16 PHE HB3 2.570 . 3.317 2.541 2.489 2.587 . 0 0 "[ . 1 . 2]" 1 292 1 16 PHE H 1 16 PHE QD 3.990 3.092 5.150 4.168 4.151 4.176 . 0 0 "[ . 1 . 2]" 1 293 1 16 PHE H 1 17 SER H 2.910 2.255 3.756 2.897 2.862 2.929 . 0 0 "[ . 1 . 2]" 1 294 1 16 PHE H 1 18 LEU H 4.103 3.679 5.296 4.319 4.199 4.460 . 0 0 "[ . 1 . 2]" 1 295 1 16 PHE H 1 65 PHE QE 3.559 2.758 4.593 4.355 4.130 4.522 . 0 0 "[ . 1 . 2]" 1 296 1 16 PHE HA 1 16 PHE HB2 2.435 . 3.031 2.465 2.439 2.488 . 0 0 "[ . 1 . 2]" 1 297 1 16 PHE HA 1 16 PHE HB3 2.234 . 2.781 3.015 3.013 3.019 0.238 14 0 "[ . 1 . 2]" 1 298 1 16 PHE HA 1 27 ILE MD 4.377 3.517 5.449 4.305 4.165 4.415 . 0 0 "[ . 1 . 2]" 1 299 1 16 PHE HA 1 16 PHE QD 3.260 2.619 4.059 2.539 2.478 2.609 0.141 15 0 "[ . 1 . 2]" 1 300 1 16 PHE HA 1 17 SER H 3.495 2.709 4.068 3.576 3.568 3.590 . 0 0 "[ . 1 . 2]" 1 301 1 16 PHE HA 1 18 LEU H 4.977 3.857 6.424 4.222 3.983 4.472 . 0 0 "[ . 1 . 2]" 1 302 1 16 PHE HA 1 19 PHE H 4.278 3.316 5.522 3.833 3.716 3.978 . 0 0 "[ . 1 . 2]" 1 303 1 16 PHE HA 1 19 PHE H 3.027 2.432 3.769 2.928 2.710 3.131 . 0 0 "[ . 1 . 2]" 1 304 1 16 PHE HA 1 19 PHE QB 3.375 2.712 4.202 3.718 3.423 3.964 . 0 0 "[ . 1 . 2]" 1 305 1 16 PHE HA 1 19 PHE QD 3.440 2.764 4.283 2.976 2.750 3.209 0.014 18 0 "[ . 1 . 2]" 1 306 1 16 PHE HA 1 20 ASP H 4.180 3.240 5.395 4.874 4.720 5.084 . 0 0 "[ . 1 . 2]" 1 307 1 16 PHE HB2 1 17 SER H 3.320 2.573 4.285 3.839 3.768 3.886 . 0 0 "[ . 1 . 2]" 1 308 1 16 PHE HB3 1 17 SER H 3.081 2.388 3.977 2.472 2.397 2.520 . 0 0 "[ . 1 . 2]" 1 309 1 16 PHE QD 1 17 SER H 4.645 3.600 5.995 3.439 3.402 3.473 0.198 5 0 "[ . 1 . 2]" 1 310 1 16 PHE QD 1 19 PHE QD 5.682 4.450 7.257 4.783 4.522 5.075 . 0 0 "[ . 1 . 2]" 1 311 1 16 PHE QD 1 27 ILE MD 4.855 3.701 6.044 3.692 3.626 3.752 0.075 3 0 "[ . 1 . 2]" 1 312 1 16 PHE QD 1 65 PHE QD 3.061 2.397 3.910 3.394 2.955 4.032 0.122 12 0 "[ . 1 . 2]" 1 313 1 16 PHE QD 1 65 PHE QE 3.515 2.753 4.489 4.237 2.776 4.564 0.075 13 0 "[ . 1 . 2]" 1 314 1 16 PHE QD 1 68 PHE QD 2.965 2.322 3.787 3.057 2.906 3.258 . 0 0 "[ . 1 . 2]" 1 315 1 16 PHE QE 1 25 GLY HA2 3.341 2.684 4.160 3.204 2.889 3.460 . 0 0 "[ . 1 . 2]" 1 316 1 16 PHE QE 1 26 THR H 4.688 3.633 6.051 4.662 4.341 4.866 . 0 0 "[ . 1 . 2]" 1 317 1 16 PHE QE 1 27 ILE H 3.544 2.747 4.574 3.972 3.746 4.166 . 0 0 "[ . 1 . 2]" 1 318 1 16 PHE QE 1 63 ILE H 4.594 3.560 5.929 5.647 5.493 5.835 . 0 0 "[ . 1 . 2]" 1 319 1 16 PHE QE 1 65 PHE QD 3.300 2.584 4.215 3.306 2.821 3.449 . 0 0 "[ . 1 . 2]" 1 320 1 16 PHE QE 1 27 ILE MD 3.656 2.937 4.552 2.634 2.564 2.720 0.373 13 0 "[ . 1 . 2]" 1 321 1 16 PHE QE 1 25 GLY H 4.092 3.172 5.281 5.154 4.865 5.316 0.035 15 0 "[ . 1 . 2]" 1 322 1 16 PHE QE 1 26 THR HA 4.248 3.327 5.426 4.311 4.030 4.554 . 0 0 "[ . 1 . 2]" 1 323 1 16 PHE QE 1 26 THR MG 6.165 4.653 7.675 5.205 4.921 5.429 . 0 0 "[ . 1 . 2]" 1 324 1 16 PHE QE 1 27 ILE MD 3.290 2.577 4.202 2.675 2.594 2.777 . 0 0 "[ . 1 . 2]" 1 325 1 16 PHE QE 1 63 ILE MG 4.248 3.413 5.289 3.234 3.125 3.381 0.288 8 0 "[ . 1 . 2]" 1 326 1 16 PHE QE 1 65 PHE H 4.270 3.309 5.511 3.879 3.678 4.271 . 0 0 "[ . 1 . 2]" 1 327 1 16 PHE QE 1 65 PHE HA 3.207 2.577 3.993 3.144 3.002 3.471 . 0 0 "[ . 1 . 2]" 1 328 1 16 PHE QE 1 65 PHE QD 3.116 2.440 3.980 3.487 2.948 3.637 . 0 0 "[ . 1 . 2]" 1 329 1 16 PHE QE 1 68 PHE H 3.585 2.779 4.627 3.834 3.764 3.885 . 0 0 "[ . 1 . 2]" 1 330 1 16 PHE QE 1 68 PHE QD 2.586 2.025 3.303 3.257 3.000 3.397 0.094 6 0 "[ . 1 . 2]" 1 331 1 16 PHE HZ 1 26 THR HA 3.313 2.662 4.125 3.758 3.409 4.012 . 0 0 "[ . 1 . 2]" 1 332 1 16 PHE HZ 1 64 ASP HA 3.031 2.435 3.773 3.938 3.868 4.024 0.251 16 0 "[ . 1 . 2]" 1 333 1 16 PHE HZ 1 65 PHE H 3.969 3.076 5.123 3.478 3.325 3.917 . 0 0 "[ . 1 . 2]" 1 334 1 17 SER H 1 17 SER HA 2.772 2.227 3.451 2.829 2.810 2.844 . 0 0 "[ . 1 . 2]" 1 335 1 17 SER H 1 18 LEU H 2.865 2.311 3.698 2.827 2.783 2.869 . 0 0 "[ . 1 . 2]" 1 336 1 17 SER H 1 19 PHE H 4.115 3.189 5.133 4.627 4.524 4.716 . 0 0 "[ . 1 . 2]" 1 337 1 17 SER HA 1 18 LEU H 3.147 2.927 4.062 3.533 3.482 3.574 . 0 0 "[ . 1 . 2]" 1 338 1 17 SER HA 1 19 PHE H 3.649 3.349 4.710 4.305 4.228 4.406 . 0 0 "[ . 1 . 2]" 1 339 1 17 SER HA 1 20 ASP H 2.984 2.480 3.843 3.267 3.207 3.318 . 0 0 "[ . 1 . 2]" 1 340 1 17 SER HA 1 20 ASP HB2 3.165 2.543 3.940 3.939 3.889 4.002 0.062 12 0 "[ . 1 . 2]" 1 341 1 17 SER HA 1 20 ASP HB3 2.856 2.295 3.556 2.846 2.719 2.964 . 0 0 "[ . 1 . 2]" 1 342 1 17 SER QB 1 18 LEU H 2.851 2.210 3.680 2.599 2.416 2.759 . 0 0 "[ . 1 . 2]" 1 343 1 18 LEU H 1 18 LEU HA 2.857 2.296 3.557 2.819 2.781 2.852 . 0 0 "[ . 1 . 2]" 1 344 1 18 LEU H 1 18 LEU HB2 2.745 2.127 3.543 2.237 2.192 2.295 . 0 0 "[ . 1 . 2]" 1 345 1 18 LEU H 1 18 LEU MD1 . 3.606 4.575 3.704 3.589 3.827 0.017 3 0 "[ . 1 . 2]" 1 346 1 18 LEU H 1 18 LEU MD2 4.004 3.872 5.168 4.448 4.432 4.462 . 0 0 "[ . 1 . 2]" 1 347 1 18 LEU H 1 18 LEU HG 2.606 2.020 4.164 4.369 4.342 4.392 0.228 6 0 "[ . 1 . 2]" 1 348 1 18 LEU H 1 19 PHE H 2.924 2.266 3.029 2.802 2.662 2.938 . 0 0 "[ . 1 . 2]" 1 349 1 18 LEU H 1 20 ASP H 3.130 2.426 4.040 3.739 3.652 3.814 . 0 0 "[ . 1 . 2]" 1 350 1 18 LEU HA 1 18 LEU HB2 2.713 2.180 3.378 2.148 2.144 2.153 0.036 14 0 "[ . 1 . 2]" 1 351 1 18 LEU HA 1 18 LEU HB3 2.826 2.271 3.518 3.011 3.006 3.020 . 0 0 "[ . 1 . 2]" 1 352 1 18 LEU HA 1 18 LEU MD1 3.129 3.029 3.895 2.756 2.734 2.779 0.295 6 0 "[ . 1 . 2]" 1 353 1 18 LEU HA 1 18 LEU MD2 3.049 2.930 3.796 3.691 3.681 3.701 . 0 0 "[ . 1 . 2]" 1 354 1 18 LEU HA 1 19 PHE H 3.277 2.988 4.230 3.570 3.557 3.587 . 0 0 "[ . 1 . 2]" 1 355 1 18 LEU HA 1 20 ASP H 3.452 2.675 4.455 4.466 4.437 4.487 0.032 7 0 "[ . 1 . 2]" 1 356 1 18 LEU HB2 1 19 PHE H 2.741 2.124 3.538 3.497 3.465 3.538 0.000 12 0 "[ . 1 . 2]" 1 357 1 18 LEU HB3 1 18 LEU MD1 4.244 2.369 5.284 3.060 3.035 3.074 . 0 0 "[ . 1 . 2]" 1 358 1 18 LEU HB3 1 18 LEU MD2 4.189 2.338 5.215 2.183 2.176 2.188 0.162 5 0 "[ . 1 . 2]" 1 359 1 18 LEU HB3 1 19 PHE H 3.147 2.439 4.062 2.642 2.597 2.687 . 0 0 "[ . 1 . 2]" 1 360 1 18 LEU MD1 1 19 PHE H 6.592 4.902 8.207 4.916 4.890 4.948 0.012 6 0 "[ . 1 . 2]" 1 361 1 18 LEU MD1 1 19 PHE H 3.475 2.693 4.485 4.710 4.701 4.721 0.236 16 0 "[ . 1 . 2]" 1 362 1 18 LEU MD1 1 111 ASN H 3.640 2.821 4.698 4.330 3.547 4.581 . 0 0 "[ . 1 . 2]" 1 363 1 18 LEU MD1 1 112 LEU H 3.012 2.334 3.887 3.013 2.189 3.136 0.145 15 0 "[ . 1 . 2]" 1 364 1 18 LEU MD1 1 113 GLY H 3.515 2.724 4.537 4.322 4.052 4.371 . 0 0 "[ . 1 . 2]" 1 365 1 18 LEU MD1 1 114 GLU H 4.404 3.413 5.684 4.275 3.460 4.495 . 0 0 "[ . 1 . 2]" 1 366 1 18 LEU MD1 1 115 LYS H 4.267 3.307 5.507 3.359 3.162 4.289 0.145 7 0 "[ . 1 . 2]" 1 367 1 18 LEU MD2 1 19 PHE H 4.636 4.375 5.984 4.153 4.133 4.173 0.242 6 0 "[ . 1 . 2]" 1 368 1 18 LEU MD2 1 19 PHE HA 5.235 3.906 6.517 4.137 4.067 4.183 . 0 0 "[ . 1 . 2]" 1 369 1 19 PHE H 1 19 PHE HA 2.943 2.281 3.799 2.908 2.897 2.918 . 0 0 "[ . 1 . 2]" 1 370 1 19 PHE H 1 19 PHE HA 2.887 2.319 3.594 2.611 2.565 2.641 . 0 0 "[ . 1 . 2]" 1 371 1 19 PHE H 1 19 PHE QB 2.393 . 3.089 2.356 2.329 2.395 . 0 0 "[ . 1 . 2]" 1 372 1 19 PHE H 1 35 VAL MG2 4.290 3.447 5.341 3.980 3.862 4.197 . 0 0 "[ . 1 . 2]" 1 373 1 19 PHE H 1 20 ASP H 2.372 . 2.921 2.650 2.610 2.689 . 0 0 "[ . 1 . 2]" 1 374 1 19 PHE H 1 21 LYS H 5.579 4.324 7.201 5.761 5.697 5.841 . 0 0 "[ . 1 . 2]" 1 375 1 19 PHE H 1 27 ILE MD 3.504 2.716 4.522 4.615 4.570 4.674 0.152 16 0 "[ . 1 . 2]" 1 376 1 19 PHE HA 1 19 PHE QB 2.466 . 3.070 2.421 2.408 2.440 . 0 0 "[ . 1 . 2]" 1 377 1 19 PHE HA 1 19 PHE QD 3.503 2.815 4.361 2.957 2.859 3.036 . 0 0 "[ . 1 . 2]" 1 378 1 19 PHE HA 1 20 ASP H 3.209 2.487 4.142 3.578 3.566 3.587 . 0 0 "[ . 1 . 2]" 1 379 1 19 PHE HA 1 27 ILE MG 4.216 3.187 5.249 3.606 3.500 3.752 . 0 0 "[ . 1 . 2]" 1 380 1 19 PHE HA 1 35 VAL MG1 . 2.671 3.279 3.604 3.519 3.729 0.450 6 0 "[ . 1 . 2]" 1 381 1 19 PHE HA 1 35 VAL MG2 4.918 3.951 6.123 3.890 3.798 4.036 0.153 16 0 "[ . 1 . 2]" 1 382 1 19 PHE QB 1 20 ASP H 2.469 . 3.187 2.684 2.653 2.730 . 0 0 "[ . 1 . 2]" 1 383 1 19 PHE QB 1 21 LYS H 3.648 2.827 4.709 3.203 3.067 3.462 . 0 0 "[ . 1 . 2]" 1 384 1 19 PHE QB 1 27 ILE MD 2.931 2.355 3.649 2.408 2.347 2.453 0.008 8 0 "[ . 1 . 2]" 1 385 1 19 PHE QB 1 27 ILE MG 3.169 2.346 3.945 2.929 2.883 3.014 . 0 0 "[ . 1 . 2]" 1 386 1 19 PHE QB 1 35 VAL MG1 4.918 3.951 6.123 3.950 3.903 4.061 0.048 17 0 "[ . 1 . 2]" 1 387 1 19 PHE QR 1 32 LEU H 5.484 4.250 7.078 6.632 6.446 6.721 . 0 0 "[ . 1 . 2]" 1 388 1 19 PHE QR 1 32 LEU MD2 4.533 3.642 5.643 3.534 3.417 3.620 0.225 3 0 "[ . 1 . 2]" 1 389 1 19 PHE QR 1 35 VAL H 4.448 3.447 6.041 6.133 6.090 6.201 0.160 19 0 "[ . 1 . 2]" 1 390 1 19 PHE QR 1 35 VAL MG1 4.397 3.033 5.474 2.707 2.668 2.778 0.365 1 0 "[ . 1 . 2]" 1 391 1 19 PHE QR 1 36 MET H 4.795 3.716 6.189 5.649 5.495 5.953 . 0 0 "[ . 1 . 2]" 1 392 1 19 PHE QR 2 6 MET ME 3.217 2.585 4.025 3.055 2.329 3.879 0.256 1 0 "[ . 1 . 2]" 1 393 1 19 PHE QR 2 6 MET HG2 3.362 2.701 4.386 3.409 2.907 4.410 0.024 19 0 "[ . 1 . 2]" 1 394 1 19 PHE QR 2 6 MET HG3 3.699 2.972 4.605 3.307 2.818 4.558 0.154 8 0 "[ . 1 . 2]" 1 395 1 19 PHE QR 2 9 LEU MD1 4.569 3.671 5.688 4.288 3.531 5.742 0.140 19 0 "[ . 1 . 2]" 1 396 1 19 PHE QR 2 9 LEU MD2 4.494 3.611 5.595 4.671 3.564 5.610 0.047 12 0 "[ . 1 . 2]" 1 397 1 19 PHE QR 2 5 PHE QD 3.297 2.626 4.096 4.105 3.849 4.380 0.284 19 0 "[ . 1 . 2]" 1 398 1 19 PHE QD 1 20 ASP H 4.673 3.660 5.969 4.183 4.097 4.269 . 0 0 "[ . 1 . 2]" 1 399 1 19 PHE QD 1 27 ILE MD 5.264 4.123 6.723 3.955 3.854 3.999 0.269 20 0 "[ . 1 . 2]" 1 400 1 19 PHE QD 1 27 ILE MG 5.104 3.901 6.354 4.713 4.513 4.887 . 0 0 "[ . 1 . 2]" 1 401 1 19 PHE QD 1 32 LEU HA 3.475 2.792 4.326 4.474 4.343 4.563 0.237 8 0 "[ . 1 . 2]" 1 402 1 19 PHE QD 1 68 PHE QD 6.010 4.707 7.676 6.496 6.279 6.716 . 0 0 "[ . 1 . 2]" 1 403 1 20 ASP H 1 20 ASP HA 2.754 2.134 3.554 2.947 2.941 2.955 . 0 0 "[ . 1 . 2]" 1 404 1 20 ASP H 1 20 ASP HB2 2.393 . 3.088 2.628 2.591 2.688 . 0 0 "[ . 1 . 2]" 1 405 1 20 ASP H 1 20 ASP HB3 2.369 . 3.057 2.566 2.528 2.597 . 0 0 "[ . 1 . 2]" 1 406 1 20 ASP H 1 21 LYS H 5.868 4.248 7.574 4.015 3.987 4.050 0.261 15 0 "[ . 1 . 2]" 1 407 1 20 ASP H 1 27 ILE MD 3.010 2.333 3.885 3.338 3.244 3.470 . 0 0 "[ . 1 . 2]" 1 408 1 20 ASP H 1 27 ILE HG13 4.118 3.192 5.674 4.772 4.665 5.020 . 0 0 "[ . 1 . 2]" 1 409 1 20 ASP H 1 27 ILE MG 3.960 3.069 5.111 4.978 4.893 5.109 . 0 0 "[ . 1 . 2]" 1 410 1 20 ASP HA 1 21 LYS H 2.435 . 3.143 2.383 2.331 2.413 . 0 0 "[ . 1 . 2]" 1 411 1 20 ASP HA 1 22 ASP H 2.856 2.213 3.686 2.711 2.670 2.779 . 0 0 "[ . 1 . 2]" 1 412 1 20 ASP HA 1 28 THR H 3.597 2.788 4.642 4.595 4.348 4.746 0.104 20 0 "[ . 1 . 2]" 1 413 1 20 ASP HB2 1 21 LYS H 2.742 2.125 3.539 2.225 2.189 2.271 . 0 0 "[ . 1 . 2]" 1 414 1 20 ASP HB2 1 22 ASP H 4.036 3.128 5.209 4.021 3.971 4.071 . 0 0 "[ . 1 . 2]" 1 415 1 20 ASP HB2 1 23 GLY H 4.813 3.730 6.212 4.503 4.380 4.596 . 0 0 "[ . 1 . 2]" 1 416 1 20 ASP HB2 1 27 ILE H 3.814 2.956 4.923 4.823 4.688 4.973 0.050 20 0 "[ . 1 . 2]" 1 417 1 20 ASP HB3 1 21 LYS H 3.158 2.447 4.076 3.386 3.065 3.557 . 0 0 "[ . 1 . 2]" 1 418 1 20 ASP HB3 1 22 ASP H 4.318 3.347 5.573 3.769 3.688 4.104 . 0 0 "[ . 1 . 2]" 1 419 1 20 ASP HB3 1 23 GLY H 4.557 3.532 5.882 3.617 3.513 3.736 0.019 15 0 "[ . 1 . 2]" 1 420 1 20 ASP HB3 1 24 ASP H 4.716 3.655 6.087 4.917 4.648 5.196 . 0 0 "[ . 1 . 2]" 1 421 1 20 ASP HB3 1 27 ILE H 4.175 3.236 5.389 5.608 5.563 5.654 0.265 20 0 "[ . 1 . 2]" 1 422 1 21 LYS H 1 21 LYS HA 2.791 2.422 3.602 2.858 2.844 2.868 . 0 0 "[ . 1 . 2]" 1 423 1 21 LYS H 1 21 LYS QB 2.431 . 3.138 2.423 2.406 2.448 . 0 0 "[ . 1 . 2]" 1 424 1 21 LYS H 1 22 ASP H 2.940 2.279 3.795 2.677 2.621 2.819 . 0 0 "[ . 1 . 2]" 1 425 1 21 LYS H 1 22 ASP H 2.364 . 3.051 2.416 2.383 2.457 . 0 0 "[ . 1 . 2]" 1 426 1 21 LYS H 1 27 ILE HA 5.133 3.978 6.625 5.339 5.167 5.615 . 0 0 "[ . 1 . 2]" 1 427 1 21 LYS H 1 27 ILE MD 4.791 3.713 6.184 4.658 4.540 4.958 . 0 0 "[ . 1 . 2]" 1 428 1 21 LYS H 1 27 ILE HG13 4.948 3.835 6.386 5.363 5.204 5.645 . 0 0 "[ . 1 . 2]" 1 429 1 21 LYS H 1 28 THR H 4.998 3.874 6.451 5.813 5.499 6.035 . 0 0 "[ . 1 . 2]" 1 430 1 21 LYS HA 1 21 LYS QB 2.453 . 3.054 2.403 2.399 2.412 . 0 0 "[ . 1 . 2]" 1 431 1 21 LYS HA 1 21 LYS QD 3.099 2.490 3.858 3.710 2.295 3.972 0.195 18 0 "[ . 1 . 2]" 1 432 1 21 LYS HA 1 21 LYS QE 4.397 3.533 5.474 4.571 4.061 4.943 . 0 0 "[ . 1 . 2]" 1 433 1 21 LYS HA 1 21 LYS QG 3.328 2.674 4.143 2.411 2.347 2.657 0.327 5 0 "[ . 1 . 2]" 1 434 1 21 LYS HA 1 22 ASP H 3.427 3.231 4.423 3.488 3.431 3.571 . 0 0 "[ . 1 . 2]" 1 435 1 21 LYS QB 1 22 ASP H 2.930 2.271 3.782 2.850 2.621 2.951 . 0 0 "[ . 1 . 2]" 1 436 1 21 LYS QB 1 23 GLY H 4.469 3.464 5.768 4.704 4.509 4.800 . 0 0 "[ . 1 . 2]" 1 437 1 21 LYS QD 1 34 THR MG 4.967 3.791 6.184 4.195 3.738 6.070 0.053 6 0 "[ . 1 . 2]" 1 438 1 21 LYS QE 1 34 THR MG 4.451 3.376 5.541 4.301 3.344 5.454 0.032 14 0 "[ . 1 . 2]" 1 439 1 21 LYS QE 1 35 VAL MG1 4.118 3.309 5.127 4.227 3.628 5.042 . 0 0 "[ . 1 . 2]" 1 440 1 21 LYS QG 1 34 THR MG 4.361 3.304 5.429 5.377 4.713 5.521 0.092 13 0 "[ . 1 . 2]" 1 441 1 21 LYS QG 1 35 VAL MG1 4.172 3.352 5.194 4.775 4.462 5.022 . 0 0 "[ . 1 . 2]" 1 442 1 22 ASP H 1 22 ASP HB2 3.125 2.422 4.033 2.543 2.398 3.647 0.024 14 0 "[ . 1 . 2]" 1 443 1 22 ASP H 1 22 ASP HB3 3.314 2.568 4.277 3.478 2.595 3.637 . 0 0 "[ . 1 . 2]" 1 444 1 22 ASP H 1 23 GLY H 2.702 2.094 3.487 2.755 2.666 2.792 . 0 0 "[ . 1 . 2]" 1 445 1 22 ASP H 1 23 GLY QA 3.711 2.876 4.790 4.630 4.577 4.654 . 0 0 "[ . 1 . 2]" 1 446 1 22 ASP H 1 24 ASP H 4.120 3.193 4.786 4.336 4.233 4.387 . 0 0 "[ . 1 . 2]" 1 447 1 22 ASP HA 1 23 GLY H 3.565 2.763 4.601 3.540 3.480 3.563 . 0 0 "[ . 1 . 2]" 1 448 1 22 ASP HB2 1 23 GLY H 4.414 3.421 5.697 3.234 3.065 4.080 0.356 6 0 "[ . 1 . 2]" 1 449 1 22 ASP HB2 1 24 ASP H 4.195 3.251 5.414 3.028 2.879 4.131 0.372 2 0 "[ . 1 . 2]" 1 450 1 22 ASP HB3 1 23 GLY H 4.511 3.496 5.822 3.835 3.017 4.152 0.479 15 0 "[ . 1 . 2]" 1 451 1 23 GLY H 1 23 GLY HA2 2.510 2.017 3.125 2.357 2.346 2.365 . 0 0 "[ . 1 . 2]" 1 452 1 23 GLY H 1 23 GLY QA 2.534 . 3.271 2.260 2.249 2.269 . 0 0 "[ . 1 . 2]" 1 453 1 23 GLY H 1 23 GLY HA3 2.559 2.056 3.186 2.904 2.887 2.920 . 0 0 "[ . 1 . 2]" 1 454 1 23 GLY H 1 24 ASP H 3.160 2.449 3.490 2.565 2.519 2.602 . 0 0 "[ . 1 . 2]" 1 455 1 23 GLY H 1 25 GLY H 3.641 2.822 4.548 3.756 3.621 3.963 . 0 0 "[ . 1 . 2]" 1 456 1 23 GLY QA 1 24 ASP H 2.911 2.256 3.757 2.911 2.877 2.929 . 0 0 "[ . 1 . 2]" 1 457 1 23 GLY QA 1 25 GLY H 3.418 2.649 4.411 3.165 2.980 3.220 . 0 0 "[ . 1 . 2]" 1 458 1 23 GLY HA3 1 24 ASP H 3.754 3.016 4.674 3.373 3.316 3.474 . 0 0 "[ . 1 . 2]" 1 459 1 23 GLY HA3 1 25 GLY H 4.103 3.297 5.108 4.334 4.167 4.383 . 0 0 "[ . 1 . 2]" 1 460 1 24 ASP H 1 24 ASP HA 2.909 2.255 3.755 2.939 2.927 2.958 . 0 0 "[ . 1 . 2]" 1 461 1 24 ASP H 1 24 ASP HB2 2.818 2.184 3.637 3.651 3.639 3.676 0.039 15 0 "[ . 1 . 2]" 1 462 1 24 ASP H 1 24 ASP HB3 2.984 2.313 3.851 2.746 2.663 2.796 . 0 0 "[ . 1 . 2]" 1 463 1 24 ASP H 1 25 GLY H 2.588 2.007 3.340 2.495 2.451 2.529 . 0 0 "[ . 1 . 2]" 1 464 1 24 ASP H 1 25 GLY HA2 3.910 3.030 5.046 4.821 4.761 4.878 . 0 0 "[ . 1 . 2]" 1 465 1 24 ASP H 1 25 GLY HA3 4.312 3.342 5.566 5.143 5.102 5.204 . 0 0 "[ . 1 . 2]" 1 466 1 24 ASP H 1 26 THR H 3.574 2.873 4.613 3.401 3.303 3.532 . 0 0 "[ . 1 . 2]" 1 467 1 24 ASP HA 1 25 GLY H 3.353 2.599 4.328 3.269 3.246 3.296 . 0 0 "[ . 1 . 2]" 1 468 1 24 ASP HA 1 26 THR H 4.868 3.773 6.283 4.428 4.352 4.490 . 0 0 "[ . 1 . 2]" 1 469 1 24 ASP HB2 1 25 GLY H 4.306 3.337 5.558 4.351 4.312 4.372 . 0 0 "[ . 1 . 2]" 1 470 1 24 ASP HB2 1 26 THR H 5.029 3.898 6.491 3.994 3.853 4.089 0.045 3 0 "[ . 1 . 2]" 1 471 1 24 ASP HB3 1 25 GLY H 4.391 3.403 5.667 4.408 4.324 4.436 . 0 0 "[ . 1 . 2]" 1 472 1 24 ASP HB3 1 26 THR H 5.417 4.198 6.991 4.503 4.375 4.561 . 0 0 "[ . 1 . 2]" 1 473 1 25 GLY H 1 25 GLY HA2 2.448 2.089 3.159 2.361 2.350 2.376 . 0 0 "[ . 1 . 2]" 1 474 1 25 GLY H 1 25 GLY HA3 2.485 . 3.207 2.917 2.906 2.930 . 0 0 "[ . 1 . 2]" 1 475 1 25 GLY H 1 26 THR H 2.390 2.104 3.085 2.529 2.497 2.547 . 0 0 "[ . 1 . 2]" 1 476 1 25 GLY H 1 26 THR MG 4.455 3.453 5.750 4.666 4.623 4.723 . 0 0 "[ . 1 . 2]" 1 477 1 25 GLY HA2 1 26 THR H 3.443 2.669 4.109 3.224 3.186 3.259 . 0 0 "[ . 1 . 2]" 1 478 1 25 GLY HA2 1 26 THR MG 3.962 3.183 4.933 4.332 4.314 4.344 . 0 0 "[ . 1 . 2]" 1 479 1 25 GLY HA3 1 26 THR H 3.541 2.744 4.570 3.395 3.344 3.429 . 0 0 "[ . 1 . 2]" 1 480 1 26 THR H 1 26 THR HA 3.422 2.652 3.524 2.990 2.985 2.993 . 0 0 "[ . 1 . 2]" 1 481 1 26 THR H 1 26 THR HB 3.773 2.924 4.870 3.873 3.854 3.884 . 0 0 "[ . 1 . 2]" 1 482 1 26 THR H 1 26 THR MG . 3.269 4.168 3.052 3.038 3.085 0.231 14 0 "[ . 1 . 2]" 1 483 1 26 THR H 1 27 ILE H 4.453 3.451 5.143 4.407 4.390 4.420 . 0 0 "[ . 1 . 2]" 1 484 1 26 THR H 1 27 ILE HG12 5.779 4.479 7.459 5.529 5.400 5.663 . 0 0 "[ . 1 . 2]" 1 485 1 26 THR H 1 27 ILE HG13 4.997 3.873 6.450 4.793 4.709 4.886 . 0 0 "[ . 1 . 2]" 1 486 1 26 THR H 1 62 THR HB 4.854 3.762 6.265 6.390 6.315 6.460 0.195 14 0 "[ . 1 . 2]" 1 487 1 26 THR HA 1 26 THR HB 2.347 . 2.922 2.470 2.461 2.487 . 0 0 "[ . 1 . 2]" 1 488 1 26 THR HA 1 26 THR MG . 2.754 3.157 2.437 2.419 2.466 0.335 2 0 "[ . 1 . 2]" 1 489 1 26 THR HA 1 27 ILE H 2.213 . 2.810 2.289 2.258 2.307 . 0 0 "[ . 1 . 2]" 1 490 1 26 THR HA 1 63 ILE H 4.006 3.105 5.170 4.911 4.797 5.043 . 0 0 "[ . 1 . 2]" 1 491 1 26 THR HA 1 64 ASP HA 2.490 2.001 3.100 2.915 2.780 3.075 . 0 0 "[ . 1 . 2]" 1 492 1 26 THR HB 1 27 ILE H 2.720 2.108 3.511 2.839 2.792 2.922 . 0 0 "[ . 1 . 2]" 1 493 1 26 THR HB 1 62 THR MG 4.373 3.314 5.444 3.661 3.565 3.789 . 0 0 "[ . 1 . 2]" 1 494 1 26 THR HB 1 63 ILE H 3.350 2.596 4.324 4.376 4.332 4.416 0.092 13 0 "[ . 1 . 2]" 1 495 1 26 THR MG 1 27 ILE H 2.881 2.233 3.918 3.925 3.876 3.956 0.038 20 0 "[ . 1 . 2]" 1 496 1 26 THR MG 1 28 THR MG 3.709 2.780 4.618 4.653 4.621 4.690 0.072 18 0 "[ . 1 . 2]" 1 497 1 26 THR MG 1 28 THR MG 3.338 2.682 4.156 2.453 2.404 2.514 0.278 2 0 "[ . 1 . 2]" 1 498 1 26 THR MG 1 60 ASN HD22 4.464 3.460 5.762 3.980 3.804 4.218 . 0 0 "[ . 1 . 2]" 1 499 1 26 THR MG 1 62 THR HB 4.182 3.160 5.207 4.194 4.122 4.278 . 0 0 "[ . 1 . 2]" 1 500 1 26 THR MG 1 64 ASP H 3.679 2.851 4.749 4.074 4.037 4.144 . 0 0 "[ . 1 . 2]" 1 501 1 26 THR MG 1 64 ASP HA 3.354 2.695 4.176 3.203 3.056 3.318 . 0 0 "[ . 1 . 2]" 1 502 1 26 THR MG 1 64 ASP HB2 4.763 3.627 5.930 4.899 4.829 5.001 . 0 0 "[ . 1 . 2]" 1 503 1 26 THR MG 1 64 ASP HB3 5.269 3.933 6.560 3.874 3.845 3.912 0.088 19 0 "[ . 1 . 2]" 1 504 1 26 THR MG 1 65 PHE H 3.850 2.984 4.969 4.078 3.850 4.355 . 0 0 "[ . 1 . 2]" 1 505 1 27 ILE H 1 27 ILE HA 3.003 2.327 3.549 2.988 2.983 2.993 . 0 0 "[ . 1 . 2]" 1 506 1 27 ILE H 1 27 ILE HB 2.621 2.031 3.383 2.552 2.490 2.574 . 0 0 "[ . 1 . 2]" 1 507 1 27 ILE H 1 27 ILE MD 2.661 2.062 3.435 3.438 3.375 3.463 0.028 13 0 "[ . 1 . 2]" 1 508 1 27 ILE H 1 27 ILE MG 3.203 2.981 4.134 3.854 3.817 3.864 . 0 0 "[ . 1 . 2]" 1 509 1 27 ILE H 1 28 THR H 3.843 2.985 4.960 4.451 4.423 4.494 . 0 0 "[ . 1 . 2]" 1 510 1 27 ILE H 1 62 THR HB 3.236 2.508 4.177 3.380 3.223 3.493 . 0 0 "[ . 1 . 2]" 1 511 1 27 ILE H 1 63 ILE H 2.790 2.276 3.601 3.047 2.947 3.160 . 0 0 "[ . 1 . 2]" 1 512 1 27 ILE H 1 63 ILE HA 4.868 3.773 6.283 4.954 4.886 5.016 . 0 0 "[ . 1 . 2]" 1 513 1 27 ILE H 1 63 ILE HB 2.870 2.224 3.704 3.620 3.529 3.718 0.014 7 0 "[ . 1 . 2]" 1 514 1 27 ILE H 1 64 ASP H 4.073 3.157 5.257 5.231 5.117 5.305 0.048 12 0 "[ . 1 . 2]" 1 515 1 27 ILE H 1 64 ASP HA 3.382 2.717 4.211 3.883 3.734 3.970 . 0 0 "[ . 1 . 2]" 1 516 1 27 ILE HA 1 27 ILE MD 3.847 3.091 4.789 3.793 3.770 3.815 . 0 0 "[ . 1 . 2]" 1 517 1 27 ILE HA 1 27 ILE MG 3.129 2.114 3.896 2.446 2.425 2.474 . 0 0 "[ . 1 . 2]" 1 518 1 27 ILE HA 1 28 THR H 1.991 . 2.570 2.132 2.115 2.146 . 0 0 "[ . 1 . 2]" 1 519 1 27 ILE HB 1 27 ILE MD 3.422 2.549 4.260 2.398 2.378 2.414 0.171 3 0 "[ . 1 . 2]" 1 520 1 27 ILE HB 1 28 THR H 3.753 2.909 4.844 4.179 4.162 4.204 . 0 0 "[ . 1 . 2]" 1 521 1 27 ILE HB 1 63 ILE MG 4.190 3.366 5.217 3.688 3.555 3.875 . 0 0 "[ . 1 . 2]" 1 522 1 27 ILE MD 1 28 THR H 3.112 2.412 4.217 4.040 3.969 4.079 . 0 0 "[ . 1 . 2]" 1 523 1 27 ILE MD 1 32 LEU H 5.451 4.225 7.036 5.261 5.152 5.411 . 0 0 "[ . 1 . 2]" 1 524 1 27 ILE MD 1 55 VAL MG2 5.127 4.119 6.383 5.161 4.908 5.387 . 0 0 "[ . 1 . 2]" 1 525 1 27 ILE MD 1 63 ILE H 4.139 3.208 5.342 4.532 4.468 4.628 . 0 0 "[ . 1 . 2]" 1 526 1 27 ILE MD 1 27 ILE MG 2.844 2.085 3.541 1.953 1.932 1.986 0.153 3 0 "[ . 1 . 2]" 1 527 1 27 ILE MD 1 27 ILE MG 2.720 . 3.386 1.937 1.922 1.965 0.063 3 0 "[ . 1 . 2]" 1 528 1 27 ILE MD 1 28 THR H 4.105 3.298 5.111 5.024 4.962 5.079 . 0 0 "[ . 1 . 2]" 1 529 1 27 ILE MD 1 52 ILE MD 5.316 4.271 6.618 5.085 4.950 5.296 . 0 0 "[ . 1 . 2]" 1 530 1 27 ILE MD 1 63 ILE HB 4.138 3.325 5.152 3.194 3.129 3.258 0.196 20 0 "[ . 1 . 2]" 1 531 1 27 ILE MD 1 63 ILE MD 4.081 3.279 5.081 3.437 3.289 3.543 . 0 0 "[ . 1 . 2]" 1 532 1 27 ILE MD 1 63 ILE MG 3.294 2.447 4.101 2.597 2.518 2.646 . 0 0 "[ . 1 . 2]" 1 533 1 27 ILE MD 1 68 PHE H 4.584 3.553 5.916 5.838 5.692 5.950 0.034 16 0 "[ . 1 . 2]" 1 534 1 27 ILE HG13 1 27 ILE MG 3.976 2.994 4.950 3.131 3.121 3.145 . 0 0 "[ . 1 . 2]" 1 535 1 27 ILE HG13 1 28 THR H 3.092 2.396 4.191 4.301 4.278 4.328 0.137 2 0 "[ . 1 . 2]" 1 536 1 27 ILE HG13 1 55 VAL MG2 3.769 3.028 4.692 4.089 3.693 4.207 . 0 0 "[ . 1 . 2]" 1 537 1 27 ILE MG 1 28 THR H . 2.637 3.202 2.622 2.593 2.660 0.044 20 0 "[ . 1 . 2]" 1 538 1 27 ILE MG 1 31 GLU H 4.688 3.567 5.836 4.319 4.267 4.458 . 0 0 "[ . 1 . 2]" 1 539 1 27 ILE MG 1 31 GLU HB2 3.771 2.830 4.695 2.708 2.668 2.791 0.162 15 0 "[ . 1 . 2]" 1 540 1 27 ILE MG 1 32 LEU H 2.652 2.055 3.423 2.921 2.880 2.999 . 0 0 "[ . 1 . 2]" 1 541 1 27 ILE MG 1 63 ILE HA 5.037 3.847 6.271 6.050 5.886 6.131 . 0 0 "[ . 1 . 2]" 1 542 1 28 THR H 1 28 THR HG1 3.960 3.069 5.111 3.526 3.480 3.585 . 0 0 "[ . 1 . 2]" 1 543 1 28 THR H 1 29 THR H 4.181 3.439 5.396 4.584 4.563 4.605 . 0 0 "[ . 1 . 2]" 1 544 1 28 THR H 1 31 GLU H 2.854 2.752 3.684 3.583 3.474 3.709 0.025 3 0 "[ . 1 . 2]" 1 545 1 28 THR H 1 31 GLU HB2 2.434 . 3.142 2.248 2.173 2.324 . 0 0 "[ . 1 . 2]" 1 546 1 28 THR H 1 31 GLU HB3 2.754 2.134 3.555 3.652 3.589 3.718 0.163 12 0 "[ . 1 . 2]" 1 547 1 28 THR H 1 32 LEU H 3.481 3.126 4.493 4.195 4.070 4.302 . 0 0 "[ . 1 . 2]" 1 548 1 28 THR H 1 62 THR HB 3.658 2.835 4.721 4.968 4.927 5.002 0.281 14 0 "[ . 1 . 2]" 1 549 1 28 THR HA 1 29 THR H 2.149 . 2.774 2.217 2.206 2.229 . 0 0 "[ . 1 . 2]" 1 550 1 28 THR HA 1 29 THR MG 4.812 3.866 5.991 3.639 3.587 3.677 0.279 14 0 "[ . 1 . 2]" 1 551 1 28 THR HA 1 32 LEU H 4.678 3.625 6.038 4.879 4.846 4.945 . 0 0 "[ . 1 . 2]" 1 552 1 28 THR HA 1 62 THR MG 3.090 2.283 3.847 2.173 2.145 2.201 0.138 19 0 "[ . 1 . 2]" 1 553 1 28 THR HB 1 30 LYS H 2.847 2.206 3.675 2.951 2.897 2.994 . 0 0 "[ . 1 . 2]" 1 554 1 28 THR HB 1 31 GLU H 3.599 2.789 4.645 3.788 3.706 3.881 . 0 0 "[ . 1 . 2]" 1 555 1 28 THR HG1 1 28 THR MG 3.972 2.491 4.945 2.324 2.294 2.352 0.197 20 0 "[ . 1 . 2]" 1 556 1 28 THR HG1 1 29 THR H 4.755 3.685 6.137 4.537 4.432 4.633 . 0 0 "[ . 1 . 2]" 1 557 1 28 THR HG1 1 30 LYS H 3.944 3.057 5.091 3.514 3.336 3.641 . 0 0 "[ . 1 . 2]" 1 558 1 28 THR HG1 1 31 GLU H 4.099 3.177 5.290 2.992 2.977 3.011 0.200 13 0 "[ . 1 . 2]" 1 559 1 28 THR MG 1 29 THR H 4.379 3.518 5.452 3.857 3.821 3.879 . 0 0 "[ . 1 . 2]" 1 560 1 28 THR MG 1 29 THR H 2.288 . 2.953 2.238 2.166 2.314 . 0 0 "[ . 1 . 2]" 1 561 1 28 THR MG 1 30 LYS H 3.073 2.382 3.966 3.697 3.668 3.714 . 0 0 "[ . 1 . 2]" 1 562 1 28 THR MG 1 31 GLU H 3.050 2.364 4.137 4.201 4.172 4.224 0.087 3 0 "[ . 1 . 2]" 1 563 1 28 THR MG 1 32 LEU H 4.264 3.305 5.503 4.910 4.879 4.938 . 0 0 "[ . 1 . 2]" 1 564 1 28 THR MG 1 31 GLU H 4.811 3.865 5.989 4.362 4.321 4.396 . 0 0 "[ . 1 . 2]" 1 565 1 28 THR MG 1 62 THR H 5.236 4.058 6.758 5.570 5.518 5.612 . 0 0 "[ . 1 . 2]" 1 566 1 28 THR MG 1 62 THR MG 3.060 2.259 3.809 2.461 2.411 2.525 . 0 0 "[ . 1 . 2]" 1 567 1 29 THR H 1 29 THR HA 2.917 2.261 3.765 2.819 2.812 2.832 . 0 0 "[ . 1 . 2]" 1 568 1 29 THR H 1 29 THR HA 2.816 2.262 3.506 2.596 2.524 2.667 . 0 0 "[ . 1 . 2]" 1 569 1 29 THR H 1 29 THR HB 3.349 2.596 4.322 3.615 3.605 3.626 . 0 0 "[ . 1 . 2]" 1 570 1 29 THR H 1 30 LYS H 2.869 2.269 3.703 2.813 2.784 2.845 . 0 0 "[ . 1 . 2]" 1 571 1 29 THR H 1 31 GLU H 4.374 3.390 5.645 4.365 4.331 4.378 . 0 0 "[ . 1 . 2]" 1 572 1 29 THR H 1 32 LEU H 4.766 3.694 6.151 5.012 4.970 5.053 . 0 0 "[ . 1 . 2]" 1 573 1 29 THR H 1 32 LEU QD 3.888 3.013 5.018 4.944 4.263 5.104 0.086 13 0 "[ . 1 . 2]" 1 574 1 29 THR H 1 52 ILE MD 3.158 2.448 4.076 3.969 3.866 4.100 0.024 17 0 "[ . 1 . 2]" 1 575 1 29 THR H 1 62 THR MG 3.398 2.634 4.386 3.593 3.452 3.766 . 0 0 "[ . 1 . 2]" 1 576 1 29 THR HA 1 29 THR HB 2.600 2.089 3.237 2.505 2.484 2.517 . 0 0 "[ . 1 . 2]" 1 577 1 29 THR HA 1 29 THR MG 3.428 2.154 4.268 2.333 2.244 2.388 . 0 0 "[ . 1 . 2]" 1 578 1 29 THR HA 1 30 LYS H 3.757 2.912 4.849 3.537 3.526 3.545 . 0 0 "[ . 1 . 2]" 1 579 1 29 THR HA 1 32 LEU H 3.793 2.940 4.895 3.571 3.529 3.654 . 0 0 "[ . 1 . 2]" 1 580 1 29 THR HA 1 32 LEU H 3.422 2.749 4.260 3.270 3.214 3.312 . 0 0 "[ . 1 . 2]" 1 581 1 29 THR HA 1 32 LEU HB2 3.726 2.994 4.639 2.974 2.803 3.060 0.191 3 0 "[ . 1 . 2]" 1 582 1 29 THR HA 1 32 LEU HB3 3.135 2.519 3.903 4.109 4.052 4.322 0.419 3 0 "[ . 1 . 2]" 1 583 1 29 THR HA 1 32 LEU MD1 3.426 2.753 4.265 3.564 2.823 3.741 . 0 0 "[ . 1 . 2]" 1 584 1 29 THR HA 1 32 LEU MD2 6.060 4.869 7.545 5.316 5.132 5.447 . 0 0 "[ . 1 . 2]" 1 585 1 29 THR HA 1 32 LEU MD2 3.697 2.970 4.603 4.435 4.152 4.674 0.071 2 0 "[ . 1 . 2]" 1 586 1 29 THR HA 1 33 GLY H 3.889 3.014 5.020 3.794 3.670 3.926 . 0 0 "[ . 1 . 2]" 1 587 1 29 THR HA 1 52 ILE MD 3.581 2.877 4.458 3.073 2.866 3.303 0.011 8 0 "[ . 1 . 2]" 1 588 1 29 THR HB 1 30 LYS H 2.701 2.093 3.486 2.782 2.769 2.814 . 0 0 "[ . 1 . 2]" 1 589 1 29 THR HB 1 48 LEU MD1 4.646 3.733 5.784 3.558 3.507 3.624 0.226 10 0 "[ . 1 . 2]" 1 590 1 29 THR HB 1 52 ILE MD 5.043 4.052 6.278 4.444 4.256 4.732 . 0 0 "[ . 1 . 2]" 1 591 1 29 THR MG 1 30 LYS H 5.471 4.096 6.811 3.944 3.907 3.978 0.189 11 0 "[ . 1 . 2]" 1 592 1 29 THR MG 1 32 LEU QD 4.352 3.497 5.418 3.584 3.429 3.698 0.068 3 0 "[ . 1 . 2]" 1 593 1 29 THR MG 1 33 GLY H 4.117 3.191 5.314 5.041 4.967 5.132 . 0 0 "[ . 1 . 2]" 1 594 1 29 THR MG 1 48 LEU H 5.051 4.058 6.288 4.990 4.398 5.220 . 0 0 "[ . 1 . 2]" 1 595 1 29 THR MG 1 48 LEU HA 5.058 4.064 6.297 5.639 5.492 5.753 . 0 0 "[ . 1 . 2]" 1 596 1 29 THR MG 1 49 GLN H 3.818 2.759 4.928 2.761 2.679 3.036 0.080 11 0 "[ . 1 . 2]" 1 597 1 29 THR MG 1 48 LEU HB3 4.721 3.793 5.878 3.689 3.638 3.762 0.155 17 0 "[ . 1 . 2]" 1 598 1 29 THR MG 1 49 GLN HA 3.395 2.728 4.227 4.129 3.595 4.336 0.109 17 0 "[ . 1 . 2]" 1 599 1 29 THR MG 1 49 GLN QB 5.257 4.224 6.545 5.006 4.180 5.265 0.044 6 0 "[ . 1 . 2]" 1 600 1 29 THR MG 1 49 GLN HE21 5.383 4.172 6.948 5.858 5.474 6.170 . 0 0 "[ . 1 . 2]" 1 601 1 29 THR MG 1 49 GLN HE22 5.771 4.473 7.448 5.258 4.650 6.863 . 0 0 "[ . 1 . 2]" 1 602 1 29 THR MG 1 52 ILE H 4.008 3.106 5.173 5.368 5.312 5.464 0.291 17 0 "[ . 1 . 2]" 1 603 1 29 THR MG 1 52 ILE HB 5.121 4.115 6.375 4.072 3.943 4.272 0.172 17 0 "[ . 1 . 2]" 1 604 1 29 THR MG 1 52 ILE MD 3.307 2.657 4.117 2.543 2.483 2.578 0.174 3 0 "[ . 1 . 2]" 1 605 1 29 THR MG 1 52 ILE MD 3.249 2.610 4.045 2.479 2.437 2.528 0.173 3 0 "[ . 1 . 2]" 1 606 1 29 THR MG 1 52 ILE HG13 4.591 3.689 5.716 3.564 3.470 3.625 0.219 9 0 "[ . 1 . 2]" 1 607 1 30 LYS H 1 30 LYS HA 3.312 2.461 4.123 2.875 2.865 2.902 . 0 0 "[ . 1 . 2]" 1 608 1 30 LYS H 1 30 LYS QB 2.375 . 3.065 2.300 2.263 2.398 . 0 0 "[ . 1 . 2]" 1 609 1 30 LYS H 1 30 LYS QG 3.512 2.722 4.533 3.613 2.447 3.999 0.275 18 0 "[ . 1 . 2]" 1 610 1 30 LYS H 1 32 LEU H 4.078 3.161 5.263 4.263 4.198 4.294 . 0 0 "[ . 1 . 2]" 1 611 1 30 LYS H 1 48 LEU QD 4.367 3.385 5.636 5.753 5.630 5.809 0.173 2 0 "[ . 1 . 2]" 1 612 1 30 LYS H 1 52 ILE MD 5.136 3.981 6.629 5.629 5.471 5.791 . 0 0 "[ . 1 . 2]" 1 613 1 30 LYS HA 1 30 LYS QB 3.114 . 3.877 2.386 2.363 2.425 . 0 0 "[ . 1 . 2]" 1 614 1 30 LYS HA 1 30 LYS QD 5.050 3.257 6.287 4.010 3.936 4.210 . 0 0 "[ . 1 . 2]" 1 615 1 30 LYS HA 1 30 LYS QG 4.206 2.579 5.236 2.408 2.369 2.432 0.210 2 0 "[ . 1 . 2]" 1 616 1 30 LYS HA 1 31 GLU H 3.086 2.392 3.983 3.545 3.532 3.552 . 0 0 "[ . 1 . 2]" 1 617 1 30 LYS HA 1 34 THR H 3.334 2.584 4.303 3.398 3.322 3.530 . 0 0 "[ . 1 . 2]" 1 618 1 30 LYS HA 1 33 GLY H 2.943 2.281 3.798 3.349 3.292 3.385 . 0 0 "[ . 1 . 2]" 1 619 1 30 LYS HA 1 33 GLY H 4.658 3.543 5.799 4.021 3.837 4.155 . 0 0 "[ . 1 . 2]" 1 620 1 30 LYS QB 1 31 GLU H 2.704 2.096 3.490 2.560 2.519 2.638 . 0 0 "[ . 1 . 2]" 1 621 1 31 GLU H 1 31 GLU HA . 2.946 3.752 2.867 2.864 2.874 0.082 20 0 "[ . 1 . 2]" 1 622 1 31 GLU H 1 31 GLU HB2 2.666 2.066 3.441 2.320 2.305 2.329 . 0 0 "[ . 1 . 2]" 1 623 1 31 GLU H 1 32 LEU H 2.703 2.095 3.489 2.736 2.696 2.758 . 0 0 "[ . 1 . 2]" 1 624 1 31 GLU H 1 32 LEU H 2.685 2.081 3.466 2.715 2.677 2.739 . 0 0 "[ . 1 . 2]" 1 625 1 31 GLU H 1 33 GLY H 3.579 2.774 4.619 4.010 3.946 4.075 . 0 0 "[ . 1 . 2]" 1 626 1 31 GLU HA 1 31 GLU HB2 2.967 2.384 3.694 2.276 2.263 2.294 0.121 12 0 "[ . 1 . 2]" 1 627 1 31 GLU HA 1 31 GLU HB3 3.092 2.484 3.849 2.547 2.538 2.558 . 0 0 "[ . 1 . 2]" 1 628 1 31 GLU HA 1 32 LEU H 3.464 2.685 4.471 3.573 3.560 3.581 . 0 0 "[ . 1 . 2]" 1 629 1 31 GLU HA 1 34 THR H 4.759 3.824 5.925 3.950 3.831 4.049 . 0 0 "[ . 1 . 2]" 1 630 1 31 GLU HB2 1 32 LEU H 3.109 2.410 4.013 2.603 2.541 2.673 . 0 0 "[ . 1 . 2]" 1 631 1 31 GLU HB3 1 32 LEU H 3.350 2.596 4.324 3.497 3.443 3.534 . 0 0 "[ . 1 . 2]" 1 632 1 32 LEU H 1 32 LEU HA 2.863 2.291 3.551 2.883 2.877 2.894 . 0 0 "[ . 1 . 2]" 1 633 1 32 LEU H 1 32 LEU HB2 2.684 2.080 3.464 2.061 2.040 2.164 0.040 14 0 "[ . 1 . 2]" 1 634 1 32 LEU H 1 32 LEU HB3 2.610 2.023 3.369 3.343 3.273 3.488 0.119 3 0 "[ . 1 . 2]" 1 635 1 32 LEU H 1 32 LEU MD1 4.133 3.321 5.145 3.526 3.244 3.642 0.077 3 0 "[ . 1 . 2]" 1 636 1 32 LEU H 1 32 LEU MD2 4.805 3.861 5.982 3.812 3.771 3.885 0.090 10 0 "[ . 1 . 2]" 1 637 1 32 LEU H 1 33 GLY HA2 4.052 3.140 5.230 5.361 5.300 5.397 0.167 12 0 "[ . 1 . 2]" 1 638 1 32 LEU H 1 34 THR H 4.286 3.322 5.532 4.058 4.034 4.090 . 0 0 "[ . 1 . 2]" 1 639 1 32 LEU H 1 52 ILE MD 4.013 3.110 5.179 4.896 4.639 5.131 . 0 0 "[ . 1 . 2]" 1 640 1 32 LEU HA 1 32 LEU HB2 2.839 2.281 3.535 2.209 2.166 2.375 0.115 14 0 "[ . 1 . 2]" 1 641 1 32 LEU HA 1 32 LEU HB3 2.840 2.282 3.536 2.821 2.670 2.867 . 0 0 "[ . 1 . 2]" 1 642 1 32 LEU HA 1 32 LEU MD1 3.140 2.523 3.909 3.701 3.662 3.795 . 0 0 "[ . 1 . 2]" 1 643 1 32 LEU HA 1 32 LEU QD 2.390 . 2.975 2.547 2.403 2.619 . 0 0 "[ . 1 . 2]" 1 644 1 32 LEU HA 1 32 LEU MD2 3.479 2.795 4.331 2.596 2.430 2.683 0.365 3 0 "[ . 1 . 2]" 1 645 1 32 LEU HA 1 35 VAL H 3.877 3.115 4.827 3.709 3.642 3.779 . 0 0 "[ . 1 . 2]" 1 646 1 32 LEU HA 1 35 VAL HB 3.228 2.594 4.019 4.259 4.188 4.310 0.291 14 0 "[ . 1 . 2]" 1 647 1 32 LEU HA 1 36 MET H 3.759 2.913 4.852 3.780 3.683 4.015 . 0 0 "[ . 1 . 2]" 1 648 1 32 LEU HB2 1 33 GLY H 3.202 2.482 4.133 2.768 2.450 2.883 0.032 3 0 "[ . 1 . 2]" 1 649 1 32 LEU HB3 1 32 LEU MD1 3.147 2.528 3.918 2.617 2.569 2.661 . 0 0 "[ . 1 . 2]" 1 650 1 32 LEU HB3 1 33 GLY H 2.779 2.154 3.587 2.654 2.518 3.019 . 0 0 "[ . 1 . 2]" 1 651 1 32 LEU QD 1 33 GLY H 2.536 . 3.273 3.229 3.110 3.309 0.036 6 0 "[ . 1 . 2]" 1 652 1 32 LEU QD 1 36 MET ME 3.470 2.588 4.320 2.510 2.079 3.295 0.509 4 1 "[ +. 1 . 2]" 1 653 1 32 LEU QD 1 52 ILE H 3.281 2.543 4.235 4.365 4.271 4.540 0.305 6 0 "[ . 1 . 2]" 1 654 1 32 LEU MD2 2 5 PHE QB 2.738 2.200 3.409 3.410 2.219 3.703 0.294 17 0 "[ . 1 . 2]" 1 655 1 32 LEU MD2 2 5 PHE QD 2.538 2.100 3.109 2.984 2.413 3.308 0.199 1 0 "[ . 1 . 2]" 1 656 1 32 LEU MD2 2 5 PHE QE 2.238 . 2.743 2.531 2.029 2.859 0.116 16 0 "[ . 1 . 2]" 1 657 1 32 LEU MD2 2 5 PHE HZ 2.944 2.463 3.582 3.058 2.407 3.664 0.082 20 0 "[ . 1 . 2]" 1 658 1 32 LEU MD2 1 36 MET H 4.984 4.004 6.205 4.233 3.993 4.770 0.011 14 0 "[ . 1 . 2]" 1 659 1 32 LEU MD2 1 36 MET QG 4.993 4.012 6.216 4.385 3.975 5.000 0.037 13 0 "[ . 1 . 2]" 1 660 1 32 LEU MD2 1 51 MET ME 3.476 2.393 4.328 3.567 2.161 4.415 0.232 9 0 "[ . 1 . 2]" 1 661 1 32 LEU MD2 2 5 PHE QE 5.463 4.389 6.801 5.108 4.258 5.980 0.131 16 0 "[ . 1 . 2]" 1 662 1 33 GLY H 1 33 GLY HA2 2.585 2.003 2.858 2.830 2.823 2.839 . 0 0 "[ . 1 . 2]" 1 663 1 33 GLY H 1 33 GLY HA3 2.383 . 2.786 2.355 2.350 2.361 . 0 0 "[ . 1 . 2]" 1 664 1 33 GLY H 1 34 THR H 2.880 2.232 3.653 2.801 2.765 2.815 . 0 0 "[ . 1 . 2]" 1 665 1 33 GLY H 1 48 LEU MD1 4.711 3.785 5.865 3.818 3.695 4.279 0.090 7 0 "[ . 1 . 2]" 1 666 1 33 GLY H 1 48 LEU MD2 4.359 3.502 5.427 4.056 3.570 4.519 . 0 0 "[ . 1 . 2]" 1 667 1 33 GLY HA2 1 34 THR H 3.148 2.440 3.623 3.570 3.563 3.579 . 0 0 "[ . 1 . 2]" 1 668 1 33 GLY HA2 1 36 MET H 3.228 2.502 4.166 3.095 3.034 3.157 . 0 0 "[ . 1 . 2]" 1 669 1 33 GLY HA2 1 36 MET H 3.502 2.814 4.360 3.097 2.977 3.208 . 0 0 "[ . 1 . 2]" 1 670 1 33 GLY HA2 1 36 MET HB2 2.948 2.369 3.670 2.998 2.647 3.200 . 0 0 "[ . 1 . 2]" 1 671 1 33 GLY HA2 1 36 MET HB3 2.791 2.242 3.675 2.373 2.314 2.452 . 0 0 "[ . 1 . 2]" 1 672 1 33 GLY HA2 1 48 LEU MD1 4.277 3.436 5.325 3.400 3.204 3.845 0.232 6 0 "[ . 1 . 2]" 1 673 1 33 GLY HA2 1 48 LEU QD 2.243 . 2.793 2.997 2.879 3.110 0.317 2 0 "[ . 1 . 2]" 1 674 1 33 GLY HA2 1 48 LEU MD2 3.940 3.166 4.905 3.375 3.088 3.745 0.078 14 0 "[ . 1 . 2]" 1 675 1 33 GLY HA3 1 34 THR H 2.860 2.298 3.561 2.875 2.855 2.902 . 0 0 "[ . 1 . 2]" 1 676 1 33 GLY HA3 1 34 THR H 2.492 . 3.216 2.548 2.539 2.557 . 0 0 "[ . 1 . 2]" 1 677 1 33 GLY HA3 1 36 MET H 2.789 2.162 3.600 2.811 2.786 2.826 . 0 0 "[ . 1 . 2]" 1 678 1 33 GLY HA3 1 37 ARG H 3.657 2.834 4.720 3.410 3.391 3.468 . 0 0 "[ . 1 . 2]" 1 679 1 33 GLY HA3 1 36 MET HB2 3.043 2.445 3.788 3.817 3.626 3.958 0.170 18 0 "[ . 1 . 2]" 1 680 1 33 GLY HA3 1 36 MET HB3 2.954 2.373 3.878 4.062 3.906 4.140 0.262 8 0 "[ . 1 . 2]" 1 681 1 33 GLY HA3 1 48 LEU MD1 3.361 2.700 4.184 2.988 2.867 3.160 . 0 0 "[ . 1 . 2]" 1 682 1 33 GLY HA3 1 48 LEU QD 2.274 . 2.831 2.867 2.687 3.028 0.197 9 0 "[ . 1 . 2]" 1 683 1 33 GLY HA3 1 48 LEU MD2 3.643 2.927 4.535 3.766 3.158 4.330 . 0 0 "[ . 1 . 2]" 1 684 1 34 THR H 1 34 THR HA 3.010 2.418 3.747 2.845 2.836 2.857 . 0 0 "[ . 1 . 2]" 1 685 1 34 THR H 1 34 THR HB 2.564 . 3.309 2.564 2.549 2.586 . 0 0 "[ . 1 . 2]" 1 686 1 34 THR H 1 34 THR MG . 3.394 3.833 3.788 3.782 3.793 . 0 0 "[ . 1 . 2]" 1 687 1 34 THR H 1 35 VAL H 2.725 2.236 3.517 2.845 2.831 2.866 . 0 0 "[ . 1 . 2]" 1 688 1 34 THR H 1 35 VAL MG1 3.177 2.462 4.100 4.160 4.110 4.196 0.096 13 0 "[ . 1 . 2]" 1 689 1 34 THR H 1 36 MET H 3.644 2.824 4.703 3.697 3.645 3.734 . 0 0 "[ . 1 . 2]" 1 690 1 34 THR HA 1 34 THR HB 3.166 2.544 3.941 3.042 3.039 3.046 . 0 0 "[ . 1 . 2]" 1 691 1 34 THR HA 1 34 THR MG . 2.648 3.287 2.392 2.384 2.403 0.264 17 0 "[ . 1 . 2]" 1 692 1 34 THR HA 1 35 VAL H 3.993 3.095 4.535 3.606 3.593 3.615 . 0 0 "[ . 1 . 2]" 1 693 1 34 THR HA 1 37 ARG H 4.028 3.200 4.959 3.727 3.603 3.892 . 0 0 "[ . 1 . 2]" 1 694 1 34 THR HA 1 37 ARG QB 3.040 2.442 3.785 2.898 2.722 3.373 . 0 0 "[ . 1 . 2]" 1 695 1 34 THR HB 1 35 VAL H 2.800 2.170 3.614 2.523 2.506 2.546 . 0 0 "[ . 1 . 2]" 1 696 1 34 THR MG 1 35 VAL H 4.251 3.675 5.487 3.521 3.491 3.546 0.184 13 0 "[ . 1 . 2]" 1 697 1 34 THR MG 1 35 VAL HA . 4.024 4.468 3.744 3.728 3.770 0.296 19 0 "[ . 1 . 2]" 1 698 1 34 THR MG 1 35 VAL MG1 5.105 3.902 5.180 4.941 4.898 5.006 . 0 0 "[ . 1 . 2]" 1 699 1 34 THR MG 1 38 SER QB 5.095 3.893 6.343 5.441 4.611 6.018 . 0 0 "[ . 1 . 2]" 1 700 1 35 VAL H 1 35 VAL HA 3.037 2.398 3.715 2.927 2.923 2.931 . 0 0 "[ . 1 . 2]" 1 701 1 35 VAL H 1 35 VAL HB 2.494 . 3.219 2.453 2.406 2.502 . 0 0 "[ . 1 . 2]" 1 702 1 35 VAL H 1 35 VAL MG1 . 2.577 3.114 2.451 2.397 2.530 0.180 11 0 "[ . 1 . 2]" 1 703 1 35 VAL H 1 35 VAL MG2 . 3.475 4.108 3.796 3.778 3.813 . 0 0 "[ . 1 . 2]" 1 704 1 35 VAL H 1 36 MET H 2.717 2.106 3.432 2.547 2.503 2.580 . 0 0 "[ . 1 . 2]" 1 705 1 35 VAL H 1 37 ARG H 3.099 2.402 4.000 3.949 3.818 4.075 0.075 16 0 "[ . 1 . 2]" 1 706 1 35 VAL HA 1 35 VAL HB 3.097 2.488 3.856 2.616 2.596 2.641 . 0 0 "[ . 1 . 2]" 1 707 1 35 VAL HA 1 35 VAL MG1 . 2.591 3.125 3.199 3.184 3.210 0.085 11 0 "[ . 1 . 2]" 1 708 1 35 VAL HA 1 35 VAL MG2 2.669 2.464 3.323 2.265 2.246 2.282 0.218 20 0 "[ . 1 . 2]" 1 709 1 35 VAL HA 1 36 MET H 4.026 3.235 5.012 3.555 3.525 3.572 . 0 0 "[ . 1 . 2]" 1 710 1 35 VAL HA 1 38 SER H 4.066 3.151 4.308 3.402 3.327 3.479 . 0 0 "[ . 1 . 2]" 1 711 1 35 VAL HA 1 38 SER HB2 3.342 2.685 4.161 3.523 3.053 3.762 . 0 0 "[ . 1 . 2]" 1 712 1 35 VAL HA 1 39 LEU H 4.040 3.246 5.030 5.269 5.137 5.368 0.338 6 0 "[ . 1 . 2]" 1 713 1 35 VAL HA 1 39 LEU H 5.884 4.260 7.594 4.617 4.549 4.678 . 0 0 "[ . 1 . 2]" 1 714 1 35 VAL HB 1 36 MET H 2.363 . 3.050 2.627 2.471 2.791 . 0 0 "[ . 1 . 2]" 1 715 1 35 VAL MG1 1 38 SER H 4.242 3.288 5.475 4.840 4.749 4.933 . 0 0 "[ . 1 . 2]" 1 716 1 35 VAL MG1 2 2 MET QB 3.306 2.656 4.116 3.859 2.525 4.350 0.234 1 0 "[ . 1 . 2]" 1 717 1 35 VAL MG1 2 2 MET ME 3.038 2.445 3.782 3.392 2.382 4.443 0.661 8 1 "[ . + 1 . 2]" 1 718 1 35 VAL MG1 2 2 MET QG 3.751 3.014 4.670 3.973 2.963 4.774 0.104 16 0 "[ . 1 . 2]" 1 719 1 35 VAL MG2 1 36 MET H . 3.823 4.328 3.962 3.891 4.069 . 0 0 "[ . 1 . 2]" 1 720 1 35 VAL MG2 1 36 MET HA 4.802 3.858 5.978 4.195 4.063 4.358 . 0 0 "[ . 1 . 2]" 1 721 1 35 VAL MG2 1 38 SER H 5.712 4.427 7.372 4.410 4.284 4.569 0.143 6 0 "[ . 1 . 2]" 1 722 1 35 VAL MG2 1 39 LEU H 5.451 4.225 7.036 5.037 4.858 5.157 . 0 0 "[ . 1 . 2]" 1 723 1 35 VAL MG2 1 39 LEU HB2 4.189 3.361 5.218 5.174 4.900 5.328 0.110 11 0 "[ . 1 . 2]" 1 724 1 35 VAL MG2 2 5 PHE QE 4.534 3.643 5.645 5.107 3.751 5.727 0.082 18 0 "[ . 1 . 2]" 1 725 1 36 MET H 1 36 MET HB2 2.728 2.114 3.521 2.380 2.274 2.516 . 0 0 "[ . 1 . 2]" 1 726 1 36 MET H 1 36 MET HG2 3.048 2.362 4.352 4.479 4.443 4.577 0.225 16 0 "[ . 1 . 2]" 1 727 1 36 MET H 1 36 MET HG3 2.712 2.117 4.000 4.281 4.159 4.347 0.347 4 0 "[ . 1 . 2]" 1 728 1 36 MET H 1 37 ARG H 3.396 2.632 4.383 2.615 2.557 2.690 0.075 3 0 "[ . 1 . 2]" 1 729 1 36 MET H 1 39 LEU MD1 5.828 4.683 7.256 6.062 5.527 6.310 . 0 0 "[ . 1 . 2]" 1 730 1 36 MET HA 1 36 MET HB2 3.713 2.748 4.622 2.453 2.385 2.554 0.363 4 0 "[ . 1 . 2]" 1 731 1 36 MET HA 1 36 MET HB3 3.268 2.419 4.069 3.034 3.015 3.047 . 0 0 "[ . 1 . 2]" 1 732 1 36 MET HA 1 36 MET HG2 2.710 2.177 3.374 2.959 2.633 3.575 0.201 16 0 "[ . 1 . 2]" 1 733 1 36 MET HA 1 36 MET HG3 3.018 2.425 3.757 2.328 2.288 2.437 0.137 17 0 "[ . 1 . 2]" 1 734 1 36 MET HA 1 39 LEU H 4.981 3.492 6.201 3.453 3.327 3.604 0.165 4 0 "[ . 1 . 2]" 1 735 1 36 MET HA 1 39 LEU MD2 4.944 3.972 6.155 5.634 5.407 5.807 . 0 0 "[ . 1 . 2]" 1 736 1 36 MET HB2 1 36 MET HG2 2.762 2.219 3.439 3.004 2.738 3.029 . 0 0 "[ . 1 . 2]" 1 737 1 36 MET HB2 1 36 MET HG3 2.840 2.282 3.536 2.520 2.384 2.934 . 0 0 "[ . 1 . 2]" 1 738 1 36 MET HB3 1 36 MET HG3 2.715 2.181 3.380 3.012 2.746 3.043 . 0 0 "[ . 1 . 2]" 1 739 1 36 MET ME 1 36 MET HG3 4.665 3.548 5.808 3.252 2.840 3.358 0.708 6 4 "[* .+ -1 . * 2]" 1 740 1 36 MET ME 1 41 GLN HE21 5.330 3.931 6.291 4.822 3.895 6.079 0.036 19 0 "[ . 1 . 2]" 1 741 1 36 MET ME 1 42 ASN H 2.446 . 3.557 3.649 3.383 3.811 0.254 16 0 "[ . 1 . 2]" 1 742 1 36 MET ME 1 43 PRO HD2 5.002 3.819 6.227 3.887 3.721 4.746 0.098 9 0 "[ . 1 . 2]" 1 743 1 36 MET ME 2 5 PHE H 5.035 3.902 6.499 6.240 5.323 6.653 0.154 19 0 "[ . 1 . 2]" 1 744 1 36 MET ME 2 5 PHE QE 6.000 5.000 105.000 6.324 4.903 7.055 0.097 19 0 "[ . 1 . 2]" 1 745 1 36 MET HG3 1 37 ARG H 4.575 3.546 5.905 4.840 4.256 5.123 . 0 0 "[ . 1 . 2]" 1 746 1 36 MET HG3 1 39 LEU QD 2.643 2.124 3.290 3.385 3.245 3.477 0.187 10 0 "[ . 1 . 2]" 1 747 1 36 MET HG3 1 48 LEU MD2 5.831 4.685 7.260 5.604 4.798 6.090 . 0 0 "[ . 1 . 2]" 1 748 1 36 MET HG3 1 51 MET ME 5.741 4.113 7.147 6.374 5.010 7.182 0.035 13 0 "[ . 1 . 2]" 1 749 1 37 ARG H 1 37 ARG HA 3.267 2.532 4.217 2.845 2.826 2.862 . 0 0 "[ . 1 . 2]" 1 750 1 37 ARG H 1 37 ARG QB 2.448 . 3.159 2.218 2.123 2.280 . 0 0 "[ . 1 . 2]" 1 751 1 37 ARG H 1 38 SER H 2.672 2.392 3.449 2.713 2.672 2.761 . 0 0 "[ . 1 . 2]" 1 752 1 37 ARG H 1 39 LEU H 4.780 3.705 6.034 4.250 4.151 4.334 . 0 0 "[ . 1 . 2]" 1 753 1 37 ARG H 1 40 GLY H 5.478 4.246 7.070 5.941 5.632 6.102 . 0 0 "[ . 1 . 2]" 1 754 1 37 ARG H 1 41 GLN H 5.035 3.902 6.499 5.179 5.048 5.382 . 0 0 "[ . 1 . 2]" 1 755 1 37 ARG HA 1 38 SER H 3.915 3.034 5.053 3.531 3.501 3.548 . 0 0 "[ . 1 . 2]" 1 756 1 37 ARG HA 1 39 LEU H 5.157 3.997 6.656 4.002 3.871 4.106 0.126 15 0 "[ . 1 . 2]" 1 757 1 37 ARG HA 1 40 GLY H 3.531 2.737 4.557 4.254 3.888 4.424 . 0 0 "[ . 1 . 2]" 1 758 1 37 ARG HA 1 41 GLN H 3.179 2.464 4.103 2.650 2.432 2.973 0.032 13 0 "[ . 1 . 2]" 1 759 1 37 ARG QB 1 38 SER H 2.890 2.240 3.730 2.672 2.568 2.816 . 0 0 "[ . 1 . 2]" 1 760 1 37 ARG QG 1 42 ASN HA 3.127 2.512 3.893 3.541 2.794 3.937 0.044 1 0 "[ . 1 . 2]" 1 761 1 38 SER H 1 38 SER HA 3.001 2.326 3.873 2.832 2.800 2.849 . 0 0 "[ . 1 . 2]" 1 762 1 38 SER H 1 38 SER QB 2.817 2.183 3.636 2.416 2.277 2.488 . 0 0 "[ . 1 . 2]" 1 763 1 38 SER H 1 39 LEU H 2.858 2.215 3.689 2.713 2.660 2.803 . 0 0 "[ . 1 . 2]" 1 764 1 38 SER H 1 39 LEU H 2.949 2.286 3.806 2.500 2.431 2.565 . 0 0 "[ . 1 . 2]" 1 765 1 39 LEU H 1 39 LEU HA 3.377 2.617 4.359 2.891 2.869 2.902 . 0 0 "[ . 1 . 2]" 1 766 1 39 LEU H 1 39 LEU QB 2.592 2.009 3.345 2.113 2.077 2.192 . 0 0 "[ . 1 . 2]" 1 767 1 39 LEU H 1 39 LEU MD1 4.538 3.646 5.650 3.994 3.562 4.201 0.084 20 0 "[ . 1 . 2]" 1 768 1 39 LEU H 1 39 LEU QD 2.926 2.268 3.777 3.680 3.378 3.800 0.023 4 0 "[ . 1 . 2]" 1 769 1 39 LEU H 1 40 GLY H 2.679 2.076 3.458 2.929 2.804 3.002 . 0 0 "[ . 1 . 2]" 1 770 1 39 LEU H 1 40 GLY HA2 3.853 3.096 4.797 5.107 5.026 5.159 0.362 12 0 "[ . 1 . 2]" 1 771 1 39 LEU H 1 40 GLY HA3 4.879 3.781 6.297 5.443 5.381 5.484 . 0 0 "[ . 1 . 2]" 1 772 1 39 LEU H 1 41 GLN H 3.658 2.835 4.721 3.909 3.718 4.154 . 0 0 "[ . 1 . 2]" 1 773 1 39 LEU HA 1 39 LEU MD1 4.958 3.984 6.173 3.739 3.725 3.786 0.259 15 0 "[ . 1 . 2]" 1 774 1 39 LEU HA 1 39 LEU MD2 3.270 2.627 4.071 2.503 2.409 2.552 0.218 20 0 "[ . 1 . 2]" 1 775 1 39 LEU HA 1 40 GLY H 3.194 2.475 4.122 3.088 3.014 3.176 . 0 0 "[ . 1 . 2]" 1 776 1 39 LEU QB 1 39 LEU MD1 2.815 2.262 3.504 2.091 2.073 2.116 0.189 16 0 "[ . 1 . 2]" 1 777 1 39 LEU QB 1 40 GLY H 3.146 2.438 4.061 3.649 3.540 3.716 . 0 0 "[ . 1 . 2]" 1 778 1 39 LEU QB 1 41 GLN H 3.413 2.645 4.405 3.770 3.357 4.172 . 0 0 "[ . 1 . 2]" 1 779 1 39 LEU HB2 1 108 VAL MG2 4.304 3.454 5.361 5.262 4.987 5.522 0.161 20 0 "[ . 1 . 2]" 1 780 1 39 LEU QD 1 40 GLY H 3.779 2.929 4.877 4.284 4.132 4.494 . 0 0 "[ . 1 . 2]" 1 781 1 39 LEU QD 1 41 GLN H 4.538 3.517 5.857 4.792 4.258 5.149 . 0 0 "[ . 1 . 2]" 1 782 1 39 LEU QD 1 91 VAL MG2 3.469 2.787 4.319 4.217 3.709 4.478 0.159 19 0 "[ . 1 . 2]" 1 783 1 39 LEU QD 1 108 VAL MG1 3.140 2.523 3.909 2.435 2.190 2.485 0.333 20 0 "[ . 1 . 2]" 1 784 1 39 LEU QD 1 108 VAL MG2 3.232 2.597 4.024 4.162 3.220 4.314 0.290 19 0 "[ . 1 . 2]" 1 785 1 39 LEU QD 1 111 ASN HD22 5.138 3.982 6.632 5.464 4.826 5.945 . 0 0 "[ . 1 . 2]" 1 786 1 39 LEU MD2 1 91 VAL MG1 4.312 3.464 5.368 4.459 3.680 4.751 . 0 0 "[ . 1 . 2]" 1 787 1 39 LEU MD2 1 108 VAL HA 5.389 4.330 6.709 6.940 6.675 7.237 0.528 11 1 "[ . 1+ . 2]" 1 788 1 39 LEU MD2 1 108 VAL HA 3.328 2.674 4.443 4.780 4.547 4.955 0.512 6 1 "[ .+ 1 . 2]" 1 789 1 39 LEU MD2 1 111 ASN QB 4.163 3.341 5.185 5.003 4.340 5.261 0.076 13 0 "[ . 1 . 2]" 1 790 1 39 LEU HG 1 108 VAL MG1 4.927 3.659 6.134 3.452 3.261 4.466 0.398 6 0 "[ . 1 . 2]" 1 791 1 40 GLY H 1 40 GLY HA2 2.423 . 3.127 2.310 2.305 2.321 . 0 0 "[ . 1 . 2]" 1 792 1 40 GLY H 1 40 GLY HA2 2.155 . 2.683 2.212 2.183 2.230 . 0 0 "[ . 1 . 2]" 1 793 1 40 GLY H 1 40 GLY HA3 2.570 . 3.317 2.842 2.815 2.856 . 0 0 "[ . 1 . 2]" 1 794 1 40 GLY H 1 40 GLY HA3 2.499 2.008 3.111 2.736 2.718 2.748 . 0 0 "[ . 1 . 2]" 1 795 1 40 GLY HA2 1 41 GLN H 3.512 2.722 4.533 2.830 2.675 2.922 0.047 7 0 "[ . 1 . 2]" 1 796 1 40 GLY HA3 1 41 GLN H 3.265 2.531 4.214 3.570 3.533 3.601 . 0 0 "[ . 1 . 2]" 1 797 1 41 GLN H 1 41 GLN HA 3.061 2.372 3.951 2.988 2.984 2.993 . 0 0 "[ . 1 . 2]" 1 798 1 41 GLN H 1 41 GLN HB2 3.074 2.383 3.967 2.563 2.469 2.720 . 0 0 "[ . 1 . 2]" 1 799 1 41 GLN H 1 41 GLN HE22 6.035 4.677 7.789 6.112 5.042 6.486 . 0 0 "[ . 1 . 2]" 1 800 1 41 GLN H 1 41 GLN QG 2.819 2.185 3.639 2.789 2.628 2.953 . 0 0 "[ . 1 . 2]" 1 801 1 41 GLN H 1 42 ASN H . 3.448 4.297 4.490 4.451 4.507 0.210 20 0 "[ . 1 . 2]" 1 802 1 41 GLN H 1 43 PRO HD2 4.836 3.748 6.242 5.546 5.387 5.728 . 0 0 "[ . 1 . 2]" 1 803 1 41 GLN H 1 43 PRO HD3 5.279 4.091 6.813 4.808 4.523 4.956 . 0 0 "[ . 1 . 2]" 1 804 1 41 GLN HA 1 41 GLN HE21 6.615 4.827 8.538 4.740 4.397 4.928 0.430 5 0 "[ . 1 . 2]" 1 805 1 41 GLN HA 1 42 ASN H 1.981 . 2.757 2.316 2.243 2.386 . 0 0 "[ . 1 . 2]" 1 806 1 41 GLN HB2 1 42 ASN H 2.729 2.115 3.722 3.738 3.605 3.844 0.122 12 0 "[ . 1 . 2]" 1 807 1 41 GLN HB3 1 42 ASN H 2.306 . 3.176 2.557 2.362 2.714 . 0 0 "[ . 1 . 2]" 1 808 1 41 GLN HE21 1 41 GLN QG 4.206 2.660 5.429 2.373 2.330 2.497 0.330 9 0 "[ . 1 . 2]" 1 809 1 41 GLN HE21 1 42 ASN H 4.424 3.429 6.010 6.150 5.554 6.301 0.291 7 0 "[ . 1 . 2]" 1 810 1 42 ASN H 1 42 ASN HA 2.555 2.555 3.498 2.971 2.964 2.977 . 0 0 "[ . 1 . 2]" 1 811 1 42 ASN H 1 42 ASN HB3 2.508 . 3.637 3.300 2.654 3.446 . 0 0 "[ . 1 . 2]" 1 812 1 42 ASN H 1 42 ASN HD21 . 4.704 5.671 4.728 4.614 5.106 0.090 20 0 "[ . 1 . 2]" 1 813 1 42 ASN H 1 42 ASN HD22 4.204 3.258 5.726 4.512 4.297 5.944 0.218 5 0 "[ . 1 . 2]" 1 814 1 42 ASN H 1 43 PRO HD2 2.969 2.301 4.032 3.961 3.805 4.159 0.127 17 0 "[ . 1 . 2]" 1 815 1 42 ASN H 1 43 PRO HD3 2.990 2.317 4.059 2.925 2.714 3.172 . 0 0 "[ . 1 . 2]" 1 816 1 42 ASN HA 1 42 ASN HB2 2.837 2.279 3.532 2.498 2.398 2.543 . 0 0 "[ . 1 . 2]" 1 817 1 42 ASN HA 1 42 ASN HB3 2.960 2.378 3.685 2.490 2.394 3.035 . 0 0 "[ . 1 . 2]" 1 818 1 42 ASN HA 1 42 ASN HD22 6.605 5.119 8.525 5.362 4.861 5.428 0.258 19 0 "[ . 1 . 2]" 1 819 1 42 ASN HA 1 43 PRO HD2 2.749 2.209 3.422 2.269 2.199 2.466 0.010 15 0 "[ . 1 . 2]" 1 820 1 42 ASN HA 1 43 PRO HD3 2.489 . 3.099 2.878 2.510 2.977 . 0 0 "[ . 1 . 2]" 1 821 1 42 ASN HB2 1 42 ASN HD21 3.965 3.073 5.118 2.812 2.752 3.031 0.321 13 0 "[ . 1 . 2]" 1 822 1 42 ASN HB2 1 42 ASN HD22 4.192 3.249 5.411 3.743 3.717 3.838 . 0 0 "[ . 1 . 2]" 1 823 1 42 ASN HB3 1 42 ASN HD21 3.680 2.852 4.750 2.670 2.488 2.724 0.364 19 0 "[ . 1 . 2]" 1 824 1 42 ASN HB3 1 42 ASN HD22 3.605 2.794 4.653 3.689 3.616 3.711 . 0 0 "[ . 1 . 2]" 1 825 1 43 PRO HA 1 44 THR H 2.319 . 2.993 2.365 2.299 2.404 . 0 0 "[ . 1 . 2]" 1 826 1 43 PRO HB2 1 44 THR H 2.720 2.108 3.511 2.589 2.515 2.895 . 0 0 "[ . 1 . 2]" 1 827 1 43 PRO HB3 1 44 THR H 3.216 2.492 4.151 3.608 3.140 3.666 . 0 0 "[ . 1 . 2]" 1 828 1 43 PRO HB3 1 48 LEU MD2 4.940 3.423 6.150 3.563 3.286 3.705 0.137 17 0 "[ . 1 . 2]" 1 829 1 43 PRO HD2 1 44 THR H 5.161 4.000 6.661 5.537 5.457 5.603 . 0 0 "[ . 1 . 2]" 1 830 1 43 PRO HD3 1 44 THR H 5.638 4.370 7.277 5.656 5.625 5.808 . 0 0 "[ . 1 . 2]" 1 831 1 43 PRO QG 1 48 LEU MD2 3.302 2.653 4.111 2.845 2.603 3.222 0.050 16 0 "[ . 1 . 2]" 1 832 1 44 THR H 1 44 THR HA 2.930 2.271 3.782 2.988 2.982 2.993 . 0 0 "[ . 1 . 2]" 1 833 1 44 THR H 1 44 THR MG . 2.743 3.131 2.688 2.652 2.717 0.091 14 0 "[ . 1 . 2]" 1 834 1 44 THR H 1 47 GLU H 3.718 2.882 4.799 3.660 3.538 3.833 . 0 0 "[ . 1 . 2]" 1 835 1 44 THR H 1 47 GLU HA 4.122 3.195 5.320 5.191 5.038 5.368 0.048 20 0 "[ . 1 . 2]" 1 836 1 44 THR H 1 47 GLU HB3 2.574 . 3.322 2.384 2.262 2.522 . 0 0 "[ . 1 . 2]" 1 837 1 44 THR H 1 48 LEU H 4.438 3.672 5.728 4.090 3.948 4.240 . 0 0 "[ . 1 . 2]" 1 838 1 44 THR H 1 48 LEU MD1 4.406 3.415 5.687 4.534 4.257 4.737 . 0 0 "[ . 1 . 2]" 1 839 1 44 THR HA 1 44 THR MG 3.313 2.662 4.125 2.407 2.389 2.421 0.273 7 0 "[ . 1 . 2]" 1 840 1 44 THR HA 1 45 GLU H 2.236 . 2.886 2.385 2.338 2.446 . 0 0 "[ . 1 . 2]" 1 841 1 44 THR HA 1 46 ALA H 3.955 3.065 5.105 4.520 4.475 4.590 . 0 0 "[ . 1 . 2]" 1 842 1 44 THR HB 1 45 GLU H 2.537 . 3.274 2.415 2.304 2.518 . 0 0 "[ . 1 . 2]" 1 843 1 44 THR HB 1 46 ALA H 3.417 2.648 4.410 3.004 2.970 3.060 . 0 0 "[ . 1 . 2]" 1 844 1 44 THR MG 1 45 GLU H 2.644 2.049 3.413 3.652 3.612 3.673 0.260 20 0 "[ . 1 . 2]" 1 845 1 44 THR MG 1 46 ALA H 5.441 4.372 6.774 4.542 4.525 4.576 . 0 0 "[ . 1 . 2]" 1 846 1 44 THR MG 1 47 GLU H 5.549 4.458 6.908 4.386 4.363 4.426 0.095 2 0 "[ . 1 . 2]" 1 847 1 44 THR MG 1 47 GLU QG 4.455 3.579 5.546 5.511 5.126 5.624 0.078 11 0 "[ . 1 . 2]" 1 848 1 45 GLU H 1 45 GLU HA 2.791 2.640 3.602 2.841 2.817 2.848 . 0 0 "[ . 1 . 2]" 1 849 1 45 GLU H 1 45 GLU QB 2.125 . 2.743 2.418 2.242 2.447 . 0 0 "[ . 1 . 2]" 1 850 1 45 GLU H 1 45 GLU QG 2.686 2.082 3.467 2.453 2.146 3.932 0.465 10 0 "[ . 1 . 2]" 1 851 1 45 GLU H 1 46 ALA H 2.673 2.337 3.450 2.817 2.806 2.842 . 0 0 "[ . 1 . 2]" 1 852 1 45 GLU H 1 47 GLU H 4.046 3.136 5.222 4.273 4.210 4.362 . 0 0 "[ . 1 . 2]" 1 853 1 45 GLU H 1 48 LEU QD 4.101 3.178 5.293 4.545 4.406 4.791 . 0 0 "[ . 1 . 2]" 1 854 1 45 GLU HA 1 46 ALA H 3.574 3.395 4.613 3.567 3.556 3.579 . 0 0 "[ . 1 . 2]" 1 855 1 45 GLU HA 1 48 LEU H 3.024 2.344 3.903 3.198 3.177 3.226 . 0 0 "[ . 1 . 2]" 1 856 1 45 GLU HA 1 48 LEU H 4.200 3.374 5.229 3.613 3.553 3.670 . 0 0 "[ . 1 . 2]" 1 857 1 45 GLU HA 1 48 LEU HB2 3.747 3.010 4.665 2.964 2.882 3.094 0.128 16 0 "[ . 1 . 2]" 1 858 1 45 GLU HA 1 48 LEU HB3 3.962 3.183 4.933 4.623 4.533 4.771 . 0 0 "[ . 1 . 2]" 1 859 1 45 GLU HA 1 48 LEU QD 2.804 2.253 3.491 3.099 2.804 3.487 . 0 0 "[ . 1 . 2]" 1 860 1 45 GLU HA 1 48 LEU HG 3.736 3.002 4.651 4.317 4.096 4.653 0.002 17 0 "[ . 1 . 2]" 1 861 1 45 GLU QB 1 46 ALA H 2.643 2.048 3.411 2.527 2.460 2.585 . 0 0 "[ . 1 . 2]" 1 862 1 45 GLU QG 1 46 ALA H 3.319 2.572 4.284 4.145 3.529 4.413 0.129 7 0 "[ . 1 . 2]" 1 863 1 46 ALA H 1 46 ALA HA 2.887 2.242 3.473 2.875 2.866 2.887 . 0 0 "[ . 1 . 2]" 1 864 1 46 ALA H 1 46 ALA MB 2.311 2.239 2.983 2.135 2.123 2.146 0.116 8 0 "[ . 1 . 2]" 1 865 1 46 ALA H 1 47 GLU H 2.848 2.207 3.676 2.745 2.710 2.794 . 0 0 "[ . 1 . 2]" 1 866 1 46 ALA H 1 48 LEU QD 5.201 4.031 6.713 5.516 5.373 5.679 . 0 0 "[ . 1 . 2]" 1 867 1 46 ALA HA 1 47 GLU H 4.038 3.244 5.027 3.567 3.559 3.584 . 0 0 "[ . 1 . 2]" 1 868 1 46 ALA HA 1 49 GLN H 3.662 2.638 4.727 3.132 3.069 3.236 . 0 0 "[ . 1 . 2]" 1 869 1 46 ALA HA 1 49 GLN H 4.347 3.493 5.412 3.487 3.409 3.677 0.084 9 0 "[ . 1 . 2]" 1 870 1 46 ALA HA 1 49 GLN QB 2.994 2.405 3.728 2.659 2.548 2.917 . 0 0 "[ . 1 . 2]" 1 871 1 46 ALA HA 1 49 GLN QG 4.268 3.429 5.314 4.204 4.083 4.544 . 0 0 "[ . 1 . 2]" 1 872 1 46 ALA MB 1 47 GLU H 4.041 2.947 5.031 2.748 2.738 2.760 0.209 17 0 "[ . 1 . 2]" 1 873 1 46 ALA MB 1 47 GLU QG 4.908 3.943 6.110 5.248 5.181 5.512 . 0 0 "[ . 1 . 2]" 1 874 1 46 ALA MB 1 48 LEU H 4.367 3.385 5.636 4.706 4.669 4.737 . 0 0 "[ . 1 . 2]" 1 875 1 47 GLU H 1 47 GLU HA 3.607 2.898 4.490 2.868 2.860 2.882 0.038 13 0 "[ . 1 . 2]" 1 876 1 47 GLU H 1 48 LEU H 3.178 2.463 4.102 2.726 2.700 2.766 . 0 0 "[ . 1 . 2]" 1 877 1 47 GLU H 1 49 GLN H 5.352 3.848 6.908 4.085 3.943 4.212 . 0 0 "[ . 1 . 2]" 1 878 1 47 GLU HA 1 47 GLU HB2 2.971 2.387 3.699 2.478 2.466 2.491 . 0 0 "[ . 1 . 2]" 1 879 1 47 GLU HA 1 47 GLU HB3 2.856 2.295 3.556 3.035 3.032 3.038 . 0 0 "[ . 1 . 2]" 1 880 1 47 GLU HA 1 50 ASP H 3.698 2.971 4.604 3.808 3.584 4.179 . 0 0 "[ . 1 . 2]" 1 881 1 47 GLU HA 1 50 ASP HB3 3.397 2.729 4.229 3.687 2.996 4.389 0.160 11 0 "[ . 1 . 2]" 1 882 1 47 GLU HB2 1 48 LEU H 3.237 2.509 4.178 3.809 3.793 3.829 . 0 0 "[ . 1 . 2]" 1 883 1 47 GLU HB3 1 48 LEU H 3.159 2.448 4.077 2.452 2.429 2.492 0.019 17 0 "[ . 1 . 2]" 1 884 1 48 LEU H 1 48 LEU HA 2.983 2.340 3.627 2.885 2.876 2.895 . 0 0 "[ . 1 . 2]" 1 885 1 48 LEU H 1 48 LEU HB2 3.347 2.594 4.320 2.435 2.387 2.467 0.207 17 0 "[ . 1 . 2]" 1 886 1 48 LEU H 1 48 LEU HB3 3.044 2.359 3.929 3.632 3.617 3.643 . 0 0 "[ . 1 . 2]" 1 887 1 48 LEU H 1 48 LEU QD 3.200 2.480 4.130 3.209 3.177 3.255 . 0 0 "[ . 1 . 2]" 1 888 1 48 LEU H 1 48 LEU MD2 4.682 3.762 5.829 3.718 3.667 3.811 0.095 18 0 "[ . 1 . 2]" 1 889 1 48 LEU H 1 48 LEU HG 3.106 2.407 4.009 2.408 2.346 2.515 0.061 6 0 "[ . 1 . 2]" 1 890 1 48 LEU H 1 49 GLN H 3.159 2.248 4.077 2.410 2.370 2.473 . 0 0 "[ . 1 . 2]" 1 891 1 48 LEU HA 1 48 LEU HB2 2.736 2.198 3.406 3.034 3.026 3.043 . 0 0 "[ . 1 . 2]" 1 892 1 48 LEU HA 1 48 LEU HB3 2.983 2.397 3.714 2.549 2.532 2.567 . 0 0 "[ . 1 . 2]" 1 893 1 48 LEU HA 1 48 LEU MD2 . 2.552 2.839 2.270 2.237 2.299 0.315 6 0 "[ . 1 . 2]" 1 894 1 48 LEU HA 1 48 LEU HG 3.548 2.851 4.417 2.822 2.764 2.879 0.087 17 0 "[ . 1 . 2]" 1 895 1 48 LEU HA 1 51 MET H 3.588 2.883 4.467 3.386 3.233 3.580 . 0 0 "[ . 1 . 2]" 1 896 1 48 LEU HA 1 51 MET H 2.699 2.092 3.484 2.696 2.639 2.745 . 0 0 "[ . 1 . 2]" 1 897 1 48 LEU HA 1 51 MET ME 4.441 3.068 5.529 3.827 2.868 4.207 0.200 11 0 "[ . 1 . 2]" 1 898 1 48 LEU HA 1 52 ILE H 3.279 2.541 4.232 3.350 3.243 3.406 . 0 0 "[ . 1 . 2]" 1 899 1 48 LEU HA 1 51 MET HB2 3.392 2.725 4.223 2.644 2.530 3.280 0.195 20 0 "[ . 1 . 2]" 1 900 1 48 LEU HA 1 51 MET HB3 3.050 2.451 3.797 3.892 2.465 4.183 0.386 14 0 "[ . 1 . 2]" 1 901 1 48 LEU HA 1 51 MET QG 4.143 3.329 5.158 3.876 3.223 4.615 0.106 16 0 "[ . 1 . 2]" 1 902 1 48 LEU HB2 1 48 LEU MD1 3.789 2.532 4.717 2.341 2.314 2.367 0.218 17 0 "[ . 1 . 2]" 1 903 1 48 LEU HB2 1 48 LEU MD2 3.790 2.533 4.719 3.216 3.207 3.222 . 0 0 "[ . 1 . 2]" 1 904 1 48 LEU HB3 1 48 LEU MD1 3.662 2.434 4.559 2.447 2.426 2.472 0.008 13 0 "[ . 1 . 2]" 1 905 1 48 LEU HB3 1 48 LEU MD2 3.916 2.446 4.875 2.204 2.046 2.248 0.400 14 0 "[ . 1 . 2]" 1 906 1 48 LEU QD 1 49 GLN H 4.568 3.240 5.896 4.198 4.150 4.329 . 0 0 "[ . 1 . 2]" 1 907 1 49 GLN H 1 49 GLN HA 3.792 2.739 4.157 2.849 2.834 2.869 . 0 0 "[ . 1 . 2]" 1 908 1 49 GLN H 1 49 GLN QB 2.954 2.089 3.813 2.232 2.159 2.266 . 0 0 "[ . 1 . 2]" 1 909 1 49 GLN H 1 49 GLN HE21 6.876 5.029 8.875 6.365 6.294 6.447 . 0 0 "[ . 1 . 2]" 1 910 1 49 GLN H 1 49 GLN QG 3.740 2.699 4.827 4.046 3.861 4.091 . 0 0 "[ . 1 . 2]" 1 911 1 49 GLN H 1 50 ASP H 2.848 2.207 3.676 2.762 2.635 2.864 . 0 0 "[ . 1 . 2]" 1 912 1 49 GLN HA 1 49 GLN QB 2.897 2.328 3.607 2.440 2.418 2.494 . 0 0 "[ . 1 . 2]" 1 913 1 49 GLN HA 1 49 GLN HE21 5.060 3.922 6.531 4.121 3.937 4.295 . 0 0 "[ . 1 . 2]" 1 914 1 49 GLN HA 1 49 GLN HE22 5.396 4.182 6.965 4.315 4.136 4.874 0.046 11 0 "[ . 1 . 2]" 1 915 1 49 GLN HA 1 50 ASP H 3.903 3.587 5.037 3.566 3.549 3.581 0.038 6 0 "[ . 1 . 2]" 1 916 1 49 GLN HA 1 52 ILE H 3.294 2.553 4.251 3.845 3.690 3.980 . 0 0 "[ . 1 . 2]" 1 917 1 49 GLN HA 1 52 ILE MG 5.706 4.285 7.104 4.729 4.497 4.945 . 0 0 "[ . 1 . 2]" 1 918 1 49 GLN QB 1 49 GLN HE21 4.752 3.683 6.133 4.080 4.064 4.094 . 0 0 "[ . 1 . 2]" 1 919 1 49 GLN QB 1 49 GLN HE22 5.921 4.589 7.642 4.327 4.291 4.398 0.298 1 0 "[ . 1 . 2]" 1 920 1 49 GLN QB 1 50 ASP H 2.987 2.315 3.855 2.370 2.283 2.528 0.032 17 0 "[ . 1 . 2]" 1 921 1 49 GLN QB 1 53 ASN HD21 4.720 3.658 6.092 4.960 4.690 5.122 . 0 0 "[ . 1 . 2]" 1 922 1 49 GLN QB 1 53 ASN HD22 5.011 3.884 6.468 6.092 4.481 6.502 0.034 17 0 "[ . 1 . 2]" 1 923 1 49 GLN HE21 1 49 GLN QG 3.102 2.404 4.004 2.340 2.291 2.374 0.113 14 0 "[ . 1 . 2]" 1 924 1 49 GLN HE21 1 50 ASP H 5.908 4.579 7.625 6.323 6.151 6.488 . 0 0 "[ . 1 . 2]" 1 925 1 49 GLN HE21 1 50 ASP HA 5.959 4.618 7.691 4.824 4.609 5.318 0.009 4 0 "[ . 1 . 2]" 1 926 1 49 GLN HE21 1 52 ILE HB 4.679 3.626 6.039 5.601 5.104 5.838 . 0 0 "[ . 1 . 2]" 1 927 1 49 GLN HE21 1 52 ILE MD 4.280 3.317 5.524 5.481 4.947 5.613 0.089 17 0 "[ . 1 . 2]" 1 928 1 49 GLN HE21 1 52 ILE MG 5.775 4.340 7.190 5.725 5.124 5.894 . 0 0 "[ . 1 . 2]" 1 929 1 49 GLN HE21 1 53 ASN H 5.351 4.147 6.907 5.340 5.123 5.843 . 0 0 "[ . 1 . 2]" 1 930 1 49 GLN HE21 1 53 ASN HD21 5.855 4.538 7.557 4.451 4.348 4.570 0.190 6 0 "[ . 1 . 2]" 1 931 1 49 GLN HE21 1 53 ASN HD21 5.039 3.905 6.504 4.235 4.139 4.330 . 0 0 "[ . 1 . 2]" 1 932 1 49 GLN HE21 1 61 GLY HA2 5.537 4.291 7.146 5.163 4.279 5.600 0.012 6 0 "[ . 1 . 2]" 1 933 1 49 GLN HE21 1 61 GLY HA3 5.904 4.576 7.620 5.758 4.830 6.237 . 0 0 "[ . 1 . 2]" 1 934 1 49 GLN HE22 1 49 GLN QG 3.487 2.703 4.501 3.283 3.267 3.291 . 0 0 "[ . 1 . 2]" 1 935 1 49 GLN HE22 1 50 ASP H 6.889 5.339 8.891 6.874 5.820 7.201 . 0 0 "[ . 1 . 2]" 1 936 1 49 GLN HE22 1 52 ILE HB 5.223 4.048 6.741 5.647 5.338 5.927 . 0 0 "[ . 1 . 2]" 1 937 1 49 GLN HE22 1 52 ILE MD 4.291 3.326 5.538 5.356 5.118 5.524 . 0 0 "[ . 1 . 2]" 1 938 1 49 GLN HE22 1 52 ILE MG 5.293 3.953 6.590 5.630 5.343 5.857 . 0 0 "[ . 1 . 2]" 1 939 1 49 GLN HE22 1 53 ASN H 5.931 4.597 7.655 5.819 4.526 6.591 0.071 7 0 "[ . 1 . 2]" 1 940 1 49 GLN HE22 1 61 GLY HA2 6.134 4.754 7.917 4.844 4.693 5.381 0.061 5 0 "[ . 1 . 2]" 1 941 1 49 GLN HE22 1 61 GLY HA3 6.450 4.999 8.325 5.174 4.875 6.295 0.124 1 0 "[ . 1 . 2]" 1 942 1 49 GLN QG 1 50 ASP H 4.017 3.113 5.185 3.811 3.628 4.417 . 0 0 "[ . 1 . 2]" 1 943 1 49 GLN QG 1 53 ASN H 4.080 3.162 5.266 4.188 3.837 5.242 . 0 0 "[ . 1 . 2]" 1 944 1 49 GLN QG 1 53 ASN HD21 3.525 2.732 4.550 3.667 3.297 4.827 0.277 6 0 "[ . 1 . 2]" 1 945 1 49 GLN QG 1 53 ASN HD22 3.483 2.699 4.495 4.513 3.906 4.684 0.189 9 0 "[ . 1 . 2]" 1 946 1 50 ASP H 1 50 ASP HA 3.188 2.271 4.115 2.849 2.827 2.879 . 0 0 "[ . 1 . 2]" 1 947 1 50 ASP H 1 50 ASP HB2 3.071 2.380 3.964 2.474 2.361 2.527 0.019 11 0 "[ . 1 . 2]" 1 948 1 50 ASP H 1 50 ASP HB3 2.793 2.165 3.605 2.789 2.555 3.580 . 0 0 "[ . 1 . 2]" 1 949 1 50 ASP H 1 51 MET H 3.120 2.418 3.669 2.769 2.702 2.819 . 0 0 "[ . 1 . 2]" 1 950 1 50 ASP H 1 52 ILE H 4.130 3.201 5.331 4.574 4.472 4.720 . 0 0 "[ . 1 . 2]" 1 951 1 50 ASP H 1 53 ASN H 5.377 4.167 6.940 4.673 4.605 4.739 . 0 0 "[ . 1 . 2]" 1 952 1 50 ASP H 1 53 ASN HD22 5.562 4.311 7.179 7.059 5.658 7.364 0.185 13 0 "[ . 1 . 2]" 1 953 1 50 ASP HA 1 51 MET H 3.960 3.069 5.111 3.572 3.562 3.589 . 0 0 "[ . 1 . 2]" 1 954 1 50 ASP HA 1 52 ILE H 3.943 3.056 5.089 4.844 4.706 5.007 . 0 0 "[ . 1 . 2]" 1 955 1 50 ASP HA 1 53 ASN H 2.613 2.025 3.372 2.740 2.706 2.763 . 0 0 "[ . 1 . 2]" 1 956 1 50 ASP HA 1 53 ASN HD21 3.377 2.617 4.359 3.453 2.878 3.664 . 0 0 "[ . 1 . 2]" 1 957 1 50 ASP HA 1 53 ASN HD22 3.687 2.857 4.759 4.219 3.793 4.336 . 0 0 "[ . 1 . 2]" 1 958 1 50 ASP HA 1 54 GLU H 3.421 2.651 4.416 3.329 3.227 3.400 . 0 0 "[ . 1 . 2]" 1 959 1 50 ASP HB2 1 51 MET H 3.329 2.580 4.297 3.619 2.695 3.904 . 0 0 "[ . 1 . 2]" 1 960 1 50 ASP HB3 1 51 MET H 2.601 2.016 3.357 2.420 2.176 2.972 . 0 0 "[ . 1 . 2]" 1 961 1 51 MET H 1 51 MET HA 3.340 2.684 4.158 2.832 2.789 2.854 . 0 0 "[ . 1 . 2]" 1 962 1 51 MET H 1 51 MET HB2 2.743 2.126 3.540 2.215 2.047 2.594 0.079 7 0 "[ . 1 . 2]" 1 963 1 51 MET H 1 51 MET HB3 2.748 2.130 3.547 3.361 2.232 3.590 0.043 14 0 "[ . 1 . 2]" 1 964 1 51 MET H 1 51 MET ME 6.207 4.487 7.727 4.954 4.302 5.451 0.185 11 0 "[ . 1 . 2]" 1 965 1 51 MET H 1 51 MET QG 3.231 2.504 3.299 2.911 2.344 3.826 0.527 9 2 "[ - . +1 . 2]" 1 966 1 51 MET H 1 52 ILE H 2.809 2.177 3.434 2.895 2.844 2.974 . 0 0 "[ . 1 . 2]" 1 967 1 51 MET H 1 53 ASN H 4.184 3.243 5.400 4.084 4.040 4.135 . 0 0 "[ . 1 . 2]" 1 968 1 51 MET H 1 53 ASN H 3.815 2.957 4.924 3.863 3.741 3.923 . 0 0 "[ . 1 . 2]" 1 969 1 51 MET H 1 54 GLU H 5.026 3.895 6.487 4.578 4.380 4.798 . 0 0 "[ . 1 . 2]" 1 970 1 51 MET HA 1 51 MET QG 2.861 2.299 3.376 2.221 2.108 2.482 0.191 7 0 "[ . 1 . 2]" 1 971 1 51 MET HA 1 52 ILE H 3.465 2.784 4.314 3.590 3.559 3.605 . 0 0 "[ . 1 . 2]" 1 972 1 51 MET HA 1 54 GLU H 2.622 2.032 3.384 2.776 2.761 2.798 . 0 0 "[ . 1 . 2]" 1 973 1 51 MET HB2 1 51 MET QG 3.026 2.431 3.767 2.033 1.956 2.065 0.475 17 0 "[ . 1 . 2]" 1 974 1 51 MET HB2 1 52 ILE H 2.206 . 2.847 2.294 2.178 2.447 . 0 0 "[ . 1 . 2]" 1 975 1 51 MET HB3 1 51 MET ME 4.243 2.929 5.282 3.383 2.548 4.021 0.381 9 0 "[ . 1 . 2]" 1 976 1 51 MET HB3 1 52 ILE H 3.036 2.353 3.918 2.846 2.288 3.248 0.065 9 0 "[ . 1 . 2]" 1 977 1 51 MET ME 1 51 MET QG 4.578 2.686 5.699 2.268 2.216 2.364 0.470 2 0 "[ . 1 . 2]" 1 978 1 51 MET ME 2 2 MET HA 5.372 3.816 6.688 3.869 3.546 4.973 0.270 2 0 "[ . 1 . 2]" 1 979 1 51 MET ME 2 3 ASP HB3 5.893 4.435 7.337 5.371 4.269 7.469 0.166 19 0 "[ . 1 . 2]" 1 980 1 51 MET ME 2 5 PHE QE 5.398 3.641 6.965 7.139 6.759 7.787 0.822 13 1 "[ . 1 + . 2]" 1 981 1 51 MET QG 1 52 ILE H 3.646 2.962 4.706 4.101 2.840 4.307 0.122 2 0 "[ . 1 . 2]" 1 982 1 52 ILE H 1 52 ILE HA 2.995 2.321 3.467 2.865 2.841 2.891 . 0 0 "[ . 1 . 2]" 1 983 1 52 ILE H 1 52 ILE MD 4.287 3.444 5.337 3.860 3.812 3.920 . 0 0 "[ . 1 . 2]" 1 984 1 52 ILE H 1 52 ILE MD 2.695 2.089 3.478 3.402 3.376 3.427 . 0 0 "[ . 1 . 2]" 1 985 1 52 ILE H 1 52 ILE HG12 2.937 2.276 3.791 2.513 2.377 2.700 . 0 0 "[ . 1 . 2]" 1 986 1 52 ILE H 1 52 ILE HG13 2.776 2.152 3.583 2.456 2.339 2.550 . 0 0 "[ . 1 . 2]" 1 987 1 52 ILE H 1 52 ILE MG 4.201 3.175 5.230 3.780 3.758 3.797 . 0 0 "[ . 1 . 2]" 1 988 1 52 ILE H 1 53 ASN H 2.610 2.120 3.369 2.626 2.560 2.746 . 0 0 "[ . 1 . 2]" 1 989 1 52 ILE H 1 54 GLU H 3.917 3.036 4.506 4.272 4.163 4.384 . 0 0 "[ . 1 . 2]" 1 990 1 52 ILE H 1 63 ILE MD 4.276 3.436 5.323 4.866 4.737 5.033 . 0 0 "[ . 1 . 2]" 1 991 1 52 ILE HA 1 52 ILE HB 2.931 2.355 3.649 3.035 3.030 3.044 . 0 0 "[ . 1 . 2]" 1 992 1 52 ILE HA 1 52 ILE MD 3.975 3.194 4.949 3.253 3.131 3.384 0.063 17 0 "[ . 1 . 2]" 1 993 1 52 ILE HA 1 52 ILE MD 2.612 2.099 3.252 2.374 2.339 2.419 . 0 0 "[ . 1 . 2]" 1 994 1 52 ILE HA 1 52 ILE HG12 3.135 2.519 3.903 2.369 2.326 2.422 0.193 9 0 "[ . 1 . 2]" 1 995 1 52 ILE HA 1 52 ILE HG13 3.166 2.544 3.942 3.565 3.485 3.640 . 0 0 "[ . 1 . 2]" 1 996 1 52 ILE HA 1 52 ILE MG 3.566 2.665 4.439 2.430 2.389 2.463 0.276 18 0 "[ . 1 . 2]" 1 997 1 52 ILE HA 1 53 ASN H 3.897 3.219 4.989 3.540 3.525 3.551 . 0 0 "[ . 1 . 2]" 1 998 1 52 ILE HA 1 54 GLU H 4.998 3.874 6.451 4.127 3.789 4.389 0.085 6 0 "[ . 1 . 2]" 1 999 1 52 ILE HA 1 55 VAL H 4.185 3.244 4.538 3.723 3.633 3.843 . 0 0 "[ . 1 . 2]" 1 1000 1 52 ILE HA 1 55 VAL HB 4.461 3.584 5.554 4.968 4.657 5.602 0.048 6 0 "[ . 1 . 2]" 1 1001 1 52 ILE HA 1 55 VAL MG1 3.565 2.864 4.438 3.063 2.917 3.202 . 0 0 "[ . 1 . 2]" 1 1002 1 52 ILE HA 1 55 VAL MG2 4.467 3.589 5.561 5.620 5.503 5.740 0.179 14 0 "[ . 1 . 2]" 1 1003 1 52 ILE HA 1 56 ASP H 4.330 3.356 5.589 5.297 4.815 5.546 . 0 0 "[ . 1 . 2]" 1 1004 1 52 ILE HA 1 63 ILE MD 3.129 2.843 3.896 3.073 2.924 3.260 . 0 0 "[ . 1 . 2]" 1 1005 1 52 ILE HB 1 52 ILE MD 3.750 3.013 4.669 2.876 2.792 2.952 0.221 6 0 "[ . 1 . 2]" 1 1006 1 52 ILE HB 1 53 ASN H 2.664 2.065 3.438 2.674 2.564 2.792 . 0 0 "[ . 1 . 2]" 1 1007 1 52 ILE MD 1 61 GLY H 4.066 3.151 5.248 4.561 4.261 4.799 . 0 0 "[ . 1 . 2]" 1 1008 1 52 ILE MD 1 62 THR H 4.351 3.372 5.616 3.847 3.587 4.082 . 0 0 "[ . 1 . 2]" 1 1009 1 52 ILE MD 1 63 ILE H 3.127 2.424 4.036 3.574 3.399 3.734 . 0 0 "[ . 1 . 2]" 1 1010 1 52 ILE MD 1 62 THR HA 4.092 3.288 5.094 3.565 3.202 4.017 0.086 6 0 "[ . 1 . 2]" 1 1011 1 52 ILE HG12 1 52 ILE MG 4.487 3.040 5.586 2.889 2.797 2.962 0.243 6 0 "[ . 1 . 2]" 1 1012 1 52 ILE HG12 1 53 ASN H 4.695 3.639 6.060 4.514 4.395 4.682 . 0 0 "[ . 1 . 2]" 1 1013 1 52 ILE HG13 1 52 ILE MG 4.650 3.162 5.789 3.080 3.031 3.118 0.131 17 0 "[ . 1 . 2]" 1 1014 1 52 ILE HG13 1 53 ASN H 4.120 3.193 5.318 4.320 4.156 4.430 . 0 0 "[ . 1 . 2]" 1 1015 1 52 ILE MG 1 53 ASN H . 3.712 4.042 3.604 3.558 3.718 0.154 10 0 "[ . 1 . 2]" 1 1016 1 52 ILE MG 1 53 ASN HA 4.826 3.677 6.008 3.656 3.598 3.781 0.079 10 0 "[ . 1 . 2]" 1 1017 1 52 ILE MG 1 54 GLU H 4.587 3.555 5.920 4.911 4.667 5.084 . 0 0 "[ . 1 . 2]" 1 1018 1 52 ILE MG 1 55 VAL H 4.287 3.323 5.533 4.229 3.980 4.672 . 0 0 "[ . 1 . 2]" 1 1019 1 52 ILE MG 1 56 ASP H 3.399 2.634 4.387 4.414 4.287 4.464 0.077 7 0 "[ . 1 . 2]" 1 1020 1 52 ILE MG 1 56 ASP HB2 3.938 2.964 4.903 2.811 2.697 2.896 0.267 6 0 "[ . 1 . 2]" 1 1021 1 52 ILE MG 1 56 ASP HB3 4.801 3.657 5.977 4.339 4.260 4.394 . 0 0 "[ . 1 . 2]" 1 1022 1 52 ILE MG 1 61 GLY HA2 2.989 2.402 3.721 3.364 3.058 3.628 . 0 0 "[ . 1 . 2]" 1 1023 1 52 ILE MG 1 61 GLY HA3 3.727 2.995 4.640 4.487 4.212 4.687 0.047 1 0 "[ . 1 . 2]" 1 1024 1 52 ILE MG 1 62 THR MG 4.540 3.448 5.652 4.519 4.421 4.656 . 0 0 "[ . 1 . 2]" 1 1025 1 53 ASN H 1 53 ASN HA 3.493 2.806 4.349 2.829 2.811 2.841 . 0 0 "[ . 1 . 2]" 1 1026 1 53 ASN H 1 53 ASN HB2 2.801 2.171 3.615 2.408 2.141 2.528 0.030 7 0 "[ . 1 . 2]" 1 1027 1 53 ASN H 1 53 ASN HB3 2.560 . 3.304 2.775 2.520 3.518 0.214 6 0 "[ . 1 . 2]" 1 1028 1 53 ASN H 1 53 ASN HD21 4.376 3.391 5.648 4.774 4.391 4.877 . 0 0 "[ . 1 . 2]" 1 1029 1 53 ASN H 1 53 ASN HD22 4.674 3.672 6.033 5.675 4.822 5.873 . 0 0 "[ . 1 . 2]" 1 1030 1 53 ASN H 1 54 GLU H 2.892 2.280 3.733 2.779 2.710 2.820 . 0 0 "[ . 1 . 2]" 1 1031 1 53 ASN H 1 55 VAL H 4.631 3.589 5.467 4.342 4.248 4.531 . 0 0 "[ . 1 . 2]" 1 1032 1 53 ASN HA 1 53 ASN HB2 3.231 2.596 4.023 2.588 2.464 2.988 0.132 17 0 "[ . 1 . 2]" 1 1033 1 53 ASN HA 1 53 ASN HB3 3.677 2.954 4.578 2.972 2.704 3.039 0.250 6 0 "[ . 1 . 2]" 1 1034 1 53 ASN HA 1 55 VAL H 2.882 2.234 3.720 2.891 2.861 2.934 . 0 0 "[ . 1 . 2]" 1 1035 1 53 ASN HA 1 56 ASP H 2.827 2.191 3.649 2.840 2.751 2.978 . 0 0 "[ . 1 . 2]" 1 1036 1 53 ASN HA 1 56 ASP HB2 3.513 2.822 4.374 2.795 2.727 2.867 0.095 14 0 "[ . 1 . 2]" 1 1037 1 53 ASN HA 1 56 ASP HB3 3.090 2.483 3.847 2.926 2.624 3.219 . 0 0 "[ . 1 . 2]" 1 1038 1 53 ASN HB2 1 53 ASN HD21 3.242 2.513 4.184 2.637 2.350 2.806 0.163 20 0 "[ . 1 . 2]" 1 1039 1 53 ASN HB2 1 53 ASN HD22 3.450 2.674 4.453 3.651 3.535 3.738 . 0 0 "[ . 1 . 2]" 1 1040 1 53 ASN HB2 1 54 GLU H 3.459 2.681 4.465 3.772 3.100 3.980 . 0 0 "[ . 1 . 2]" 1 1041 1 53 ASN HB3 1 53 ASN HD21 3.085 2.391 3.982 2.667 2.513 3.035 . 0 0 "[ . 1 . 2]" 1 1042 1 53 ASN HB3 1 53 ASN HD22 3.230 2.503 4.169 3.675 3.609 3.834 . 0 0 "[ . 1 . 2]" 1 1043 1 53 ASN HB3 1 54 GLU H 3.293 2.552 4.250 2.868 2.623 3.573 . 0 0 "[ . 1 . 2]" 1 1044 1 54 GLU H 1 54 GLU HA 2.999 2.410 3.734 2.834 2.820 2.858 . 0 0 "[ . 1 . 2]" 1 1045 1 54 GLU H 1 54 GLU HB2 2.797 2.168 3.610 2.532 2.248 3.573 . 0 0 "[ . 1 . 2]" 1 1046 1 54 GLU H 1 54 GLU HB3 2.638 2.045 3.405 3.375 2.260 3.590 0.185 7 0 "[ . 1 . 2]" 1 1047 1 54 GLU H 1 54 GLU HG2 3.065 2.375 3.956 3.060 2.246 3.727 0.129 7 0 "[ . 1 . 2]" 1 1048 1 54 GLU H 1 54 GLU HG3 3.130 2.426 4.040 3.014 2.301 3.989 0.125 6 0 "[ . 1 . 2]" 1 1049 1 54 GLU H 1 55 VAL H 2.913 2.258 3.506 2.792 2.710 2.865 . 0 0 "[ . 1 . 2]" 1 1050 1 54 GLU H 1 55 VAL MG1 . 4.195 5.056 4.586 4.244 4.802 . 0 0 "[ . 1 . 2]" 1 1051 1 54 GLU H 1 56 ASP H 3.471 2.690 4.480 4.368 3.972 4.519 0.039 6 0 "[ . 1 . 2]" 1 1052 1 54 GLU HA 1 54 GLU HB2 2.995 2.406 3.729 2.915 2.334 3.027 0.072 16 0 "[ . 1 . 2]" 1 1053 1 54 GLU HA 1 54 GLU HB3 2.925 2.350 3.642 2.564 2.511 2.621 . 0 0 "[ . 1 . 2]" 1 1054 1 54 GLU HA 1 55 VAL H 3.306 3.142 4.267 3.508 3.444 3.587 . 0 0 "[ . 1 . 2]" 1 1055 1 54 GLU HA 1 55 VAL MG1 5.149 4.137 6.410 5.422 5.078 5.598 . 0 0 "[ . 1 . 2]" 1 1056 1 54 GLU HB2 1 55 VAL H 3.287 2.548 4.242 3.274 2.760 4.366 0.124 16 0 "[ . 1 . 2]" 1 1057 1 54 GLU HB2 1 55 VAL MG2 4.276 3.436 5.323 3.227 3.106 3.308 0.330 17 0 "[ . 1 . 2]" 1 1058 1 54 GLU HB3 1 55 VAL H 3.275 2.538 4.227 3.875 3.553 4.088 . 0 0 "[ . 1 . 2]" 1 1059 1 54 GLU HB3 1 55 VAL MG2 3.909 3.141 4.867 4.168 4.023 4.352 . 0 0 "[ . 1 . 2]" 1 1060 1 54 GLU HG2 1 55 VAL H 2.993 2.320 3.863 2.843 2.263 3.213 0.057 2 0 "[ . 1 . 2]" 1 1061 1 54 GLU HG3 1 55 VAL H 3.366 2.609 4.344 3.763 2.506 4.030 0.103 16 0 "[ . 1 . 2]" 1 1062 1 54 GLU HG3 1 55 VAL MG2 4.720 3.492 5.876 3.752 3.467 3.881 0.025 4 0 "[ . 1 . 2]" 1 1063 1 55 VAL H 1 55 VAL MG1 . 2.676 3.176 2.490 2.431 2.570 0.245 6 0 "[ . 1 . 2]" 1 1064 1 55 VAL H 1 55 VAL MG2 4.237 3.404 5.275 3.970 3.837 4.015 . 0 0 "[ . 1 . 2]" 1 1065 1 55 VAL H 1 55 VAL MG2 3.813 2.955 4.921 3.854 3.736 3.908 . 0 0 "[ . 1 . 2]" 1 1066 1 55 VAL H 1 56 ASP H 2.301 . 2.914 2.423 2.336 2.609 . 0 0 "[ . 1 . 2]" 1 1067 1 55 VAL H 1 56 ASP HB3 3.464 2.685 4.471 4.586 4.526 4.696 0.225 13 0 "[ . 1 . 2]" 1 1068 1 55 VAL H 1 63 ILE MG 5.227 4.051 6.746 6.699 6.449 6.792 0.046 12 0 "[ . 1 . 2]" 1 1069 1 55 VAL HA 1 55 VAL MG1 3.724 2.792 4.636 3.185 3.148 3.237 . 0 0 "[ . 1 . 2]" 1 1070 1 55 VAL HA 1 55 VAL MG2 3.461 2.381 4.309 2.221 2.188 2.309 0.193 13 0 "[ . 1 . 2]" 1 1071 1 55 VAL HB 1 63 ILE MD 4.381 3.520 5.454 4.813 4.519 5.250 . 0 0 "[ . 1 . 2]" 1 1072 1 55 VAL QG 1 56 ASP H 2.995 2.321 3.866 3.270 2.966 3.459 . 0 0 "[ . 1 . 2]" 1 1073 1 55 VAL QG 1 71 MET ME 4.899 3.192 6.099 4.732 4.462 5.087 . 0 0 "[ . 1 . 2]" 1 1074 1 55 VAL MG1 1 63 ILE MG 4.309 3.462 5.365 3.283 3.213 3.373 0.249 8 0 "[ . 1 . 2]" 1 1075 1 55 VAL MG1 1 68 PHE QD 5.343 4.293 6.652 5.792 5.564 6.026 . 0 0 "[ . 1 . 2]" 1 1076 1 55 VAL MG1 1 71 MET H 4.299 3.454 5.352 5.606 5.482 5.713 0.361 17 0 "[ . 1 . 2]" 1 1077 1 55 VAL MG1 1 71 MET HB2 4.230 3.399 5.266 4.271 3.896 4.463 . 0 0 "[ . 1 . 2]" 1 1078 1 55 VAL MG1 1 71 MET HB3 4.190 3.366 5.216 5.043 4.671 5.243 0.027 1 0 "[ . 1 . 2]" 1 1079 1 55 VAL MG1 1 71 MET ME 5.558 4.466 6.919 5.300 4.789 5.921 . 0 0 "[ . 1 . 2]" 1 1080 1 55 VAL MG1 1 71 MET HG3 4.889 3.928 6.087 4.836 4.264 5.370 . 0 0 "[ . 1 . 2]" 1 1081 1 55 VAL MG2 1 56 ASP H 5.475 4.399 6.816 4.266 4.111 4.334 0.288 6 0 "[ . 1 . 2]" 1 1082 1 55 VAL MG2 1 57 ALA H 4.463 3.459 5.760 4.427 4.120 4.788 . 0 0 "[ . 1 . 2]" 1 1083 1 55 VAL MG2 1 68 PHE H 4.337 3.361 5.598 5.284 4.995 5.553 . 0 0 "[ . 1 . 2]" 1 1084 1 55 VAL MG2 1 68 PHE HA 3.445 2.768 4.289 4.540 4.492 4.581 0.292 16 0 "[ . 1 . 2]" 1 1085 1 55 VAL MG2 1 70 THR MG 5.287 3.948 6.582 3.969 3.896 4.163 0.052 15 0 "[ . 1 . 2]" 1 1086 1 55 VAL MG2 1 71 MET H . 4.433 4.751 4.214 4.164 4.298 0.269 19 0 "[ . 1 . 2]" 1 1087 1 55 VAL MG2 1 71 MET HA 4.413 3.546 5.494 4.351 4.238 4.444 . 0 0 "[ . 1 . 2]" 1 1088 1 55 VAL MG2 1 71 MET HG3 3.076 2.271 3.830 3.816 3.475 3.903 0.073 15 0 "[ . 1 . 2]" 1 1089 1 56 ASP H 1 56 ASP HA 2.968 2.300 3.831 2.960 2.925 2.978 . 0 0 "[ . 1 . 2]" 1 1090 1 56 ASP H 1 56 ASP HB2 2.443 . 3.153 2.702 2.641 2.742 . 0 0 "[ . 1 . 2]" 1 1091 1 56 ASP H 1 56 ASP HB3 2.471 . 3.189 2.512 2.471 2.540 . 0 0 "[ . 1 . 2]" 1 1092 1 56 ASP H 1 57 ALA H 3.683 2.854 4.754 4.294 4.234 4.391 . 0 0 "[ . 1 . 2]" 1 1093 1 56 ASP HA 1 57 ALA H 2.197 . 2.836 2.266 2.228 2.306 . 0 0 "[ . 1 . 2]" 1 1094 1 56 ASP HA 1 57 ALA MB 5.040 4.049 6.275 4.236 4.188 4.282 . 0 0 "[ . 1 . 2]" 1 1095 1 56 ASP QB 1 57 ALA H 3.727 2.888 4.810 3.750 3.709 3.776 . 0 0 "[ . 1 . 2]" 1 1096 1 56 ASP HB2 1 58 ASP H 4.521 3.504 5.835 5.370 5.196 5.591 . 0 0 "[ . 1 . 2]" 1 1097 1 56 ASP HB2 1 61 GLY H 5.052 3.915 6.521 4.308 4.171 4.503 . 0 0 "[ . 1 . 2]" 1 1098 1 56 ASP HB2 1 62 THR H 6.057 4.694 7.818 4.858 4.633 5.256 0.061 17 0 "[ . 1 . 2]" 1 1099 1 57 ALA H 1 57 ALA HA . 2.672 3.285 2.983 2.978 2.990 . 0 0 "[ . 1 . 2]" 1 1100 1 57 ALA H 1 57 ALA MB . 2.646 2.651 2.418 2.411 2.431 0.235 13 0 "[ . 1 . 2]" 1 1101 1 57 ALA H 1 58 ASP H . 2.424 3.085 2.288 2.254 2.319 0.170 2 0 "[ . 1 . 2]" 1 1102 1 57 ALA H 1 59 GLY H 3.504 2.716 4.523 3.682 3.594 3.758 . 0 0 "[ . 1 . 2]" 1 1103 1 57 ALA H 1 60 ASN H 3.855 2.988 4.975 5.304 5.263 5.384 0.409 18 0 "[ . 1 . 2]" 1 1104 1 57 ALA H 1 67 GLU HB2 4.078 3.161 5.263 5.392 5.348 5.427 0.164 20 0 "[ . 1 . 2]" 1 1105 1 57 ALA H 1 67 GLU HG2 2.882 2.234 3.720 3.561 3.429 3.678 . 0 0 "[ . 1 . 2]" 1 1106 1 57 ALA H 1 67 GLU HG3 3.449 2.673 4.452 4.568 4.392 4.630 0.178 18 0 "[ . 1 . 2]" 1 1107 1 57 ALA HA 1 58 ASP H 3.842 3.110 4.819 3.491 3.436 3.521 . 0 0 "[ . 1 . 2]" 1 1108 1 57 ALA HA 1 58 ASP H 3.255 2.523 4.201 2.803 2.791 2.810 . 0 0 "[ . 1 . 2]" 1 1109 1 57 ALA HA 1 59 GLY H 4.282 3.319 5.527 3.827 3.771 3.892 . 0 0 "[ . 1 . 2]" 1 1110 1 57 ALA MB 1 58 ASP H . 3.104 3.980 2.949 2.883 3.054 0.221 20 0 "[ . 1 . 2]" 1 1111 1 57 ALA MB 1 58 ASP HB2 5.764 4.631 7.176 4.442 4.298 4.530 0.333 18 0 "[ . 1 . 2]" 1 1112 1 57 ALA MB 1 59 GLY H 4.226 3.275 5.455 4.379 4.343 4.448 . 0 0 "[ . 1 . 2]" 1 1113 1 57 ALA MB 1 67 GLU HG2 3.923 3.152 4.884 3.100 3.060 3.159 0.092 19 0 "[ . 1 . 2]" 1 1114 1 57 ALA MB 1 67 GLU HG3 4.566 3.669 5.684 4.066 3.956 4.191 . 0 0 "[ . 1 . 2]" 1 1115 1 58 ASP H 1 58 ASP HB2 3.066 2.376 3.957 3.528 2.519 3.657 . 0 0 "[ . 1 . 2]" 1 1116 1 58 ASP H 1 58 ASP HB3 3.407 2.641 4.397 2.917 2.784 3.656 . 0 0 "[ . 1 . 2]" 1 1117 1 58 ASP H 1 59 GLY H 2.944 2.282 3.538 2.291 2.239 2.338 0.043 2 0 "[ . 1 . 2]" 1 1118 1 58 ASP H 1 60 ASN H 3.996 3.097 5.158 3.660 3.583 3.766 . 0 0 "[ . 1 . 2]" 1 1119 1 58 ASP HB2 1 59 GLY H 3.845 2.980 4.963 4.067 3.172 4.242 . 0 0 "[ . 1 . 2]" 1 1120 1 58 ASP HB3 1 59 GLY H 4.384 3.398 5.658 4.287 4.141 4.342 . 0 0 "[ . 1 . 2]" 1 1121 1 59 GLY H 1 59 GLY HA2 2.375 2.094 3.065 2.347 2.345 2.350 . 0 0 "[ . 1 . 2]" 1 1122 1 59 GLY H 1 59 GLY HA3 2.656 2.135 3.308 2.859 2.836 2.880 . 0 0 "[ . 1 . 2]" 1 1123 1 59 GLY H 1 60 ASN H 3.003 2.627 3.876 2.613 2.505 2.696 0.122 18 0 "[ . 1 . 2]" 1 1124 1 59 GLY H 1 61 GLY H 4.621 3.581 5.964 4.062 3.892 4.198 . 0 0 "[ . 1 . 2]" 1 1125 1 59 GLY HA2 1 60 ASN H 3.953 3.064 4.619 3.042 3.012 3.094 0.052 17 0 "[ . 1 . 2]" 1 1126 1 59 GLY HA2 1 61 GLY H 4.136 3.206 5.338 3.259 3.201 3.313 0.005 13 0 "[ . 1 . 2]" 1 1127 1 59 GLY HA3 1 60 ASN H 3.903 3.025 4.614 3.490 3.443 3.516 . 0 0 "[ . 1 . 2]" 1 1128 1 59 GLY HA3 1 61 GLY H 4.319 3.347 5.012 4.422 4.365 4.460 . 0 0 "[ . 1 . 2]" 1 1129 1 60 ASN H 1 60 ASN HB2 3.454 2.677 4.458 3.729 3.718 3.734 . 0 0 "[ . 1 . 2]" 1 1130 1 60 ASN H 1 60 ASN HB3 3.754 2.909 4.845 2.809 2.786 2.827 0.123 13 0 "[ . 1 . 2]" 1 1131 1 60 ASN H 1 60 ASN HD21 4.016 3.113 5.183 3.377 3.364 3.396 . 0 0 "[ . 1 . 2]" 1 1132 1 60 ASN H 1 60 ASN HD22 5.541 4.294 6.133 4.271 4.236 4.305 0.058 18 0 "[ . 1 . 2]" 1 1133 1 60 ASN H 1 61 GLY H 3.087 2.393 3.271 2.410 2.388 2.440 0.005 5 0 "[ . 1 . 2]" 1 1134 1 60 ASN H 1 62 THR H 4.547 3.524 5.869 3.516 3.500 3.527 0.024 6 0 "[ . 1 . 2]" 1 1135 1 60 ASN HB2 1 60 ASN HD21 2.812 2.179 3.629 2.664 2.615 2.718 . 0 0 "[ . 1 . 2]" 1 1136 1 60 ASN HB2 1 60 ASN HD22 3.030 2.348 3.911 3.681 3.663 3.704 . 0 0 "[ . 1 . 2]" 1 1137 1 60 ASN HB2 1 61 GLY H 4.162 3.226 5.372 4.375 4.362 4.393 . 0 0 "[ . 1 . 2]" 1 1138 1 60 ASN HB2 1 62 THR H 5.525 4.282 7.131 4.126 4.079 4.159 0.203 20 0 "[ . 1 . 2]" 1 1139 1 60 ASN HB3 1 60 ASN HD21 2.849 2.208 3.677 2.650 2.593 2.726 . 0 0 "[ . 1 . 2]" 1 1140 1 60 ASN HB3 1 60 ASN HD22 3.035 2.352 3.917 3.674 3.652 3.708 . 0 0 "[ . 1 . 2]" 1 1141 1 60 ASN HB3 1 61 GLY H 4.574 3.545 5.903 4.389 4.360 4.415 . 0 0 "[ . 1 . 2]" 1 1142 1 60 ASN HB3 1 62 THR H 6.010 4.658 7.757 4.601 4.556 4.656 0.102 13 0 "[ . 1 . 2]" 1 1143 1 60 ASN HD21 1 62 THR H 5.298 4.106 6.838 4.472 4.346 4.557 . 0 0 "[ . 1 . 2]" 1 1144 1 61 GLY H 1 61 GLY HA2 2.448 . 2.897 2.342 2.337 2.349 . 0 0 "[ . 1 . 2]" 1 1145 1 61 GLY H 1 61 GLY HA3 2.502 2.348 3.229 2.880 2.870 2.893 . 0 0 "[ . 1 . 2]" 1 1146 1 61 GLY H 1 62 THR H 2.494 2.320 3.219 2.604 2.583 2.621 . 0 0 "[ . 1 . 2]" 1 1147 1 61 GLY H 1 62 THR HA 4.733 3.668 6.109 5.273 5.245 5.291 . 0 0 "[ . 1 . 2]" 1 1148 1 61 GLY H 1 62 THR MG 4.584 3.553 5.917 4.499 4.445 4.568 . 0 0 "[ . 1 . 2]" 1 1149 1 61 GLY HA2 1 62 THR H . 2.846 3.665 3.085 3.051 3.136 . 0 0 "[ . 1 . 2]" 1 1150 1 61 GLY HA2 1 62 THR MG 3.612 2.902 4.497 4.323 4.300 4.342 . 0 0 "[ . 1 . 2]" 1 1151 1 61 GLY HA3 1 62 THR H 3.690 3.038 4.707 3.469 3.437 3.490 . 0 0 "[ . 1 . 2]" 1 1152 1 61 GLY HA3 1 62 THR MG . 3.861 4.456 3.609 3.581 3.646 0.280 13 0 "[ . 1 . 2]" 1 1153 1 62 THR H 1 62 THR HA 3.499 2.712 4.516 2.967 2.962 2.972 . 0 0 "[ . 1 . 2]" 1 1154 1 62 THR H 1 62 THR HB 4.323 3.350 5.580 3.954 3.938 3.970 . 0 0 "[ . 1 . 2]" 1 1155 1 62 THR H 1 62 THR MG 3.397 3.058 4.384 2.994 2.979 3.013 0.079 16 0 "[ . 1 . 2]" 1 1156 1 62 THR H 1 63 ILE H 4.705 3.647 4.946 4.399 4.387 4.411 . 0 0 "[ . 1 . 2]" 1 1157 1 62 THR H 1 63 ILE MD 6.451 5.000 8.326 6.215 6.094 6.295 . 0 0 "[ . 1 . 2]" 1 1158 1 62 THR HA 1 63 ILE H 2.300 . 2.969 2.393 2.371 2.409 . 0 0 "[ . 1 . 2]" 1 1159 1 62 THR HB 1 63 ILE H 2.398 . 3.095 2.546 2.514 2.576 . 0 0 "[ . 1 . 2]" 1 1160 1 62 THR MG 1 63 ILE H . 3.364 3.663 3.852 3.839 3.866 0.203 17 0 "[ . 1 . 2]" 1 1161 1 63 ILE H 1 63 ILE HA 3.072 2.381 3.965 2.959 2.950 2.970 . 0 0 "[ . 1 . 2]" 1 1162 1 63 ILE H 1 63 ILE HB 2.620 2.031 3.382 2.396 2.361 2.467 . 0 0 "[ . 1 . 2]" 1 1163 1 63 ILE H 1 63 ILE MD . 3.507 3.796 3.807 3.781 3.846 0.050 19 0 "[ . 1 . 2]" 1 1164 1 63 ILE H 1 63 ILE HG12 2.918 2.262 3.766 4.012 3.943 4.051 0.285 17 0 "[ . 1 . 2]" 1 1165 1 63 ILE H 1 63 ILE HG13 2.920 2.263 3.769 2.781 2.689 2.830 . 0 0 "[ . 1 . 2]" 1 1166 1 63 ILE H 1 63 ILE MG . 3.398 3.997 3.755 3.729 3.809 . 0 0 "[ . 1 . 2]" 1 1167 1 63 ILE H 1 64 ASP H 3.697 2.865 4.772 3.831 3.715 3.887 . 0 0 "[ . 1 . 2]" 1 1168 1 63 ILE HA 1 63 ILE HB 2.894 2.325 3.603 3.009 3.004 3.019 . 0 0 "[ . 1 . 2]" 1 1169 1 63 ILE HA 1 63 ILE MD 3.817 3.067 4.752 3.788 3.777 3.811 . 0 0 "[ . 1 . 2]" 1 1170 1 63 ILE HA 1 63 ILE HG13 3.185 2.559 3.965 2.704 2.664 2.791 . 0 0 "[ . 1 . 2]" 1 1171 1 63 ILE HA 1 63 ILE MG 2.718 2.618 3.384 2.507 2.481 2.537 0.137 6 0 "[ . 1 . 2]" 1 1172 1 63 ILE HA 1 64 ASP H 2.116 . 2.731 2.187 2.173 2.199 . 0 0 "[ . 1 . 2]" 1 1173 1 63 ILE HA 1 67 GLU H 4.793 3.715 6.186 5.475 5.376 5.558 . 0 0 "[ . 1 . 2]" 1 1174 1 63 ILE HB 1 63 ILE MD 3.624 2.512 4.512 2.271 2.264 2.278 0.248 3 0 "[ . 1 . 2]" 1 1175 1 63 ILE HB 1 64 ASP H 2.725 2.112 3.517 2.277 2.172 2.355 . 0 0 "[ . 1 . 2]" 1 1176 1 63 ILE MD 1 63 ILE MG 3.024 2.430 3.765 2.192 2.171 2.215 0.259 15 0 "[ . 1 . 2]" 1 1177 1 63 ILE MD 1 64 ASP H 3.621 2.806 4.974 5.215 5.192 5.237 0.263 2 0 "[ . 1 . 2]" 1 1178 1 63 ILE MD 1 68 PHE QD 4.708 3.783 5.861 4.630 4.454 4.957 . 0 0 "[ . 1 . 2]" 1 1179 1 63 ILE HG12 1 63 ILE MG 3.801 2.654 4.732 2.397 2.367 2.412 0.287 6 0 "[ . 1 . 2]" 1 1180 1 63 ILE HG12 1 68 PHE H 3.933 3.048 5.076 5.405 5.307 5.495 0.419 6 0 "[ . 1 . 2]" 1 1181 1 63 ILE HG13 1 63 ILE MG 3.788 2.683 4.716 3.228 3.222 3.236 . 0 0 "[ . 1 . 2]" 1 1182 1 63 ILE HG13 1 64 ASP H 3.900 3.023 5.034 4.844 4.803 4.912 . 0 0 "[ . 1 . 2]" 1 1183 1 63 ILE MG 1 64 ASP H . 3.015 3.380 2.842 2.799 2.878 0.216 14 0 "[ . 1 . 2]" 1 1184 1 63 ILE MG 1 65 PHE H 4.337 3.361 5.598 4.638 4.584 4.735 . 0 0 "[ . 1 . 2]" 1 1185 1 63 ILE MG 1 67 GLU H . 3.770 4.477 4.047 3.977 4.096 . 0 0 "[ . 1 . 2]" 1 1186 1 63 ILE MG 1 67 GLU HB3 3.708 2.779 4.616 2.750 2.628 2.814 0.151 6 0 "[ . 1 . 2]" 1 1187 1 63 ILE MG 1 68 PHE H 2.523 . 3.256 2.788 2.715 2.827 . 0 0 "[ . 1 . 2]" 1 1188 1 63 ILE MG 1 68 PHE HA . 3.058 3.522 3.032 2.956 3.099 0.102 6 0 "[ . 1 . 2]" 1 1189 1 63 ILE MG 1 68 PHE HB2 3.612 2.702 4.497 2.396 2.315 2.503 0.387 12 0 "[ . 1 . 2]" 1 1190 1 63 ILE MG 1 68 PHE HB3 4.237 3.204 5.275 3.422 3.314 3.519 . 0 0 "[ . 1 . 2]" 1 1191 1 63 ILE MG 1 68 PHE QD 4.541 3.648 5.654 3.609 3.476 3.821 0.172 12 0 "[ . 1 . 2]" 1 1192 1 64 ASP H 1 64 ASP HA 3.063 2.374 3.953 2.959 2.948 2.975 . 0 0 "[ . 1 . 2]" 1 1193 1 64 ASP H 1 64 ASP HA 2.323 . 2.892 2.268 2.234 2.307 . 0 0 "[ . 1 . 2]" 1 1194 1 64 ASP H 1 64 ASP HB2 3.059 2.371 3.948 2.555 2.460 2.617 . 0 0 "[ . 1 . 2]" 1 1195 1 64 ASP H 1 64 ASP HB3 3.164 2.452 4.084 3.699 3.669 3.730 . 0 0 "[ . 1 . 2]" 1 1196 1 64 ASP H 1 67 GLU H 3.321 2.574 4.286 3.507 3.435 3.558 . 0 0 "[ . 1 . 2]" 1 1197 1 64 ASP H 1 68 PHE H 3.363 2.606 4.341 3.959 3.790 4.036 . 0 0 "[ . 1 . 2]" 1 1198 1 64 ASP H 1 65 PHE HA 3.875 3.003 5.002 4.734 4.701 4.787 . 0 0 "[ . 1 . 2]" 1 1199 1 64 ASP H 1 66 PRO QD 4.497 3.485 5.804 4.557 4.216 4.806 . 0 0 "[ . 1 . 2]" 1 1200 1 64 ASP H 1 67 GLU H 3.356 2.601 4.332 3.688 3.572 3.779 . 0 0 "[ . 1 . 2]" 1 1201 1 64 ASP H 1 67 GLU HB3 2.628 2.037 3.392 3.598 3.554 3.638 0.246 6 0 "[ . 1 . 2]" 1 1202 1 64 ASP H 1 67 GLU HG2 3.293 2.552 4.250 4.277 4.241 4.330 0.080 18 0 "[ . 1 . 2]" 1 1203 1 64 ASP H 1 67 GLU HG3 3.356 2.601 4.332 3.203 3.129 3.455 . 0 0 "[ . 1 . 2]" 1 1204 1 64 ASP HA 1 64 ASP HB2 2.274 . 2.831 3.024 3.019 3.027 0.196 11 0 "[ . 1 . 2]" 1 1205 1 64 ASP HA 1 64 ASP HB3 2.389 . 2.974 2.453 2.422 2.510 . 0 0 "[ . 1 . 2]" 1 1206 1 64 ASP HA 1 65 PHE H 2.472 . 3.191 2.356 2.313 2.404 . 0 0 "[ . 1 . 2]" 1 1207 1 64 ASP HB2 1 65 PHE H 2.134 . 2.754 2.493 2.348 3.077 0.323 12 0 "[ . 1 . 2]" 1 1208 1 64 ASP HB3 1 65 PHE H 2.360 . 3.046 2.697 2.553 2.801 . 0 0 "[ . 1 . 2]" 1 1209 1 64 ASP HB3 1 67 GLU H 3.855 2.988 4.976 3.980 3.820 4.120 . 0 0 "[ . 1 . 2]" 1 1210 1 65 PHE H 1 65 PHE HA 2.848 2.261 3.503 2.749 2.725 2.774 . 0 0 "[ . 1 . 2]" 1 1211 1 65 PHE H 1 65 PHE HB2 2.429 . 3.135 2.649 2.115 2.852 . 0 0 "[ . 1 . 2]" 1 1212 1 65 PHE H 1 65 PHE QD 3.646 2.826 4.706 4.134 3.720 4.202 . 0 0 "[ . 1 . 2]" 1 1213 1 65 PHE H 1 65 PHE QD 3.593 2.814 4.589 3.632 3.266 3.751 . 0 0 "[ . 1 . 2]" 1 1214 1 65 PHE H 1 66 PRO QD 2.309 . 2.980 2.504 2.395 2.653 . 0 0 "[ . 1 . 2]" 1 1215 1 65 PHE H 1 66 PRO QG 3.613 2.800 4.663 4.421 4.255 4.625 . 0 0 "[ . 1 . 2]" 1 1216 1 65 PHE H 1 67 GLU H 4.981 3.860 6.429 4.395 4.340 4.467 . 0 0 "[ . 1 . 2]" 1 1217 1 65 PHE H 1 68 PHE H 4.392 3.404 5.669 4.808 4.729 4.854 . 0 0 "[ . 1 . 2]" 1 1218 1 65 PHE H 1 68 PHE HB3 4.299 3.332 5.549 4.878 4.659 5.001 . 0 0 "[ . 1 . 2]" 1 1219 1 65 PHE HA 1 65 PHE HB2 2.519 2.024 3.136 2.399 2.294 2.817 . 0 0 "[ . 1 . 2]" 1 1220 1 65 PHE HA 1 65 PHE HB3 2.815 2.262 3.505 2.998 2.890 3.029 . 0 0 "[ . 1 . 2]" 1 1221 1 65 PHE HA 1 65 PHE QD 2.748 2.208 3.421 2.446 2.320 2.780 . 0 0 "[ . 1 . 2]" 1 1222 1 65 PHE HA 1 68 PHE H 2.618 2.029 3.379 3.102 3.069 3.154 . 0 0 "[ . 1 . 2]" 1 1223 1 65 PHE HA 1 68 PHE H 2.874 2.309 3.578 3.456 3.385 3.548 . 0 0 "[ . 1 . 2]" 1 1224 1 65 PHE HA 1 69 LEU H 3.416 2.648 4.409 3.330 3.257 3.366 . 0 0 "[ . 1 . 2]" 1 1225 1 65 PHE HA 1 68 PHE HB2 2.772 2.227 3.451 3.578 3.514 3.674 0.223 12 0 "[ . 1 . 2]" 1 1226 1 65 PHE HA 1 68 PHE HB3 2.602 2.091 3.239 2.423 2.308 2.530 . 0 0 "[ . 1 . 2]" 1 1227 1 65 PHE QD 1 68 PHE H 4.114 3.189 5.310 4.959 4.728 5.324 0.014 16 0 "[ . 1 . 2]" 1 1228 1 65 PHE QD 1 68 PHE QD 2.955 2.314 3.774 2.511 2.288 2.992 0.026 1 0 "[ . 1 . 2]" 1 1229 1 65 PHE QD 1 68 PHE QE 3.336 2.613 4.261 4.146 3.819 4.292 0.031 12 0 "[ . 1 . 2]" 1 1230 1 65 PHE QE 1 69 LEU QD 3.648 2.857 4.659 2.958 2.811 3.860 0.046 17 0 "[ . 1 . 2]" 1 1231 1 66 PRO HA 1 66 PRO HB2 2.449 . 3.049 2.801 2.724 2.909 . 0 0 "[ . 1 . 2]" 1 1232 1 66 PRO HA 1 66 PRO HB3 2.355 . 2.932 2.278 2.251 2.296 . 0 0 "[ . 1 . 2]" 1 1233 1 66 PRO HA 1 67 GLU H 3.536 3.106 4.564 3.567 3.552 3.581 . 0 0 "[ . 1 . 2]" 1 1234 1 66 PRO HA 1 70 THR H 3.211 2.489 4.144 3.705 3.541 3.770 . 0 0 "[ . 1 . 2]" 1 1235 1 66 PRO HA 1 69 LEU H 3.530 2.736 4.556 3.177 3.118 3.273 . 0 0 "[ . 1 . 2]" 1 1236 1 66 PRO HA 1 69 LEU HB2 3.135 2.519 3.903 3.010 2.859 3.239 . 0 0 "[ . 1 . 2]" 1 1237 1 66 PRO HA 1 69 LEU HB3 3.125 2.511 3.890 2.460 2.403 2.492 0.108 14 0 "[ . 1 . 2]" 1 1238 1 66 PRO HA 1 69 LEU MD2 . 3.142 3.651 3.246 3.085 3.400 0.057 15 0 "[ . 1 . 2]" 1 1239 1 66 PRO HA 1 69 LEU HG 3.795 3.049 4.725 4.791 4.751 4.829 0.104 20 0 "[ . 1 . 2]" 1 1240 1 66 PRO HB2 1 67 GLU H 2.969 2.301 3.832 3.077 2.701 3.333 . 0 0 "[ . 1 . 2]" 1 1241 1 66 PRO HB3 1 67 GLU H 3.302 2.559 4.262 3.754 3.672 3.859 . 0 0 "[ . 1 . 2]" 1 1242 1 66 PRO QD 1 67 GLU H 3.305 2.562 4.266 2.800 2.460 3.041 0.102 5 0 "[ . 1 . 2]" 1 1243 1 66 PRO QD 1 68 PHE H 3.906 3.027 5.042 4.361 4.176 4.483 . 0 0 "[ . 1 . 2]" 1 1244 1 67 GLU H 1 67 GLU HA 3.018 2.457 3.807 2.883 2.872 2.891 . 0 0 "[ . 1 . 2]" 1 1245 1 67 GLU H 1 67 GLU HB2 2.710 2.100 3.498 2.399 2.383 2.422 . 0 0 "[ . 1 . 2]" 1 1246 1 67 GLU H 1 67 GLU HB3 2.864 2.220 3.696 3.616 3.600 3.628 . 0 0 "[ . 1 . 2]" 1 1247 1 67 GLU H 1 67 GLU HG2 2.914 2.258 3.761 3.561 3.478 3.719 . 0 0 "[ . 1 . 2]" 1 1248 1 67 GLU H 1 67 GLU HG3 2.809 2.177 3.626 2.384 2.302 2.451 . 0 0 "[ . 1 . 2]" 1 1249 1 67 GLU H 1 68 PHE H 2.725 2.112 3.313 2.552 2.526 2.598 . 0 0 "[ . 1 . 2]" 1 1250 1 67 GLU H 1 69 LEU H 3.947 3.059 5.094 4.056 3.998 4.134 . 0 0 "[ . 1 . 2]" 1 1251 1 67 GLU HA 1 67 GLU HB3 3.147 2.528 3.918 2.562 2.552 2.575 . 0 0 "[ . 1 . 2]" 1 1252 1 67 GLU HA 1 67 GLU HG3 2.892 2.324 3.601 2.947 2.798 2.985 . 0 0 "[ . 1 . 2]" 1 1253 1 67 GLU HA 1 68 PHE H 4.160 3.342 5.179 3.511 3.499 3.535 . 0 0 "[ . 1 . 2]" 1 1254 1 67 GLU HA 1 70 THR H 3.405 2.639 4.395 3.672 3.575 3.794 . 0 0 "[ . 1 . 2]" 1 1255 1 67 GLU HA 1 70 THR HB 3.118 2.505 3.882 3.139 3.001 3.246 . 0 0 "[ . 1 . 2]" 1 1256 1 67 GLU HA 1 70 THR MG . 4.102 4.466 4.308 4.128 4.420 . 0 0 "[ . 1 . 2]" 1 1257 1 67 GLU HA 1 71 MET H 3.642 2.823 4.701 4.568 4.469 4.681 . 0 0 "[ . 1 . 2]" 1 1258 1 67 GLU HB2 1 68 PHE H 2.931 2.272 3.783 2.520 2.471 2.574 . 0 0 "[ . 1 . 2]" 1 1259 1 67 GLU HG2 1 68 PHE H 3.676 2.849 4.745 4.880 4.846 4.928 0.183 19 0 "[ . 1 . 2]" 1 1260 1 67 GLU HG3 1 68 PHE H 3.437 2.664 4.436 4.290 4.241 4.339 . 0 0 "[ . 1 . 2]" 1 1261 1 68 PHE H 1 68 PHE HA 2.621 2.207 3.383 2.848 2.836 2.861 . 0 0 "[ . 1 . 2]" 1 1262 1 68 PHE H 1 68 PHE HB2 2.451 . 3.163 2.764 2.716 2.837 . 0 0 "[ . 1 . 2]" 1 1263 1 68 PHE H 1 68 PHE HB3 3.025 2.344 3.165 2.334 2.260 2.386 0.084 1 0 "[ . 1 . 2]" 1 1264 1 68 PHE H 1 69 LEU H 2.683 2.588 3.463 2.748 2.714 2.795 . 0 0 "[ . 1 . 2]" 1 1265 1 68 PHE H 1 70 THR H 4.125 3.197 5.324 4.194 4.137 4.243 . 0 0 "[ . 1 . 2]" 1 1266 1 68 PHE HA 1 68 PHE HB2 2.564 2.060 3.192 2.363 2.332 2.396 . 0 0 "[ . 1 . 2]" 1 1267 1 68 PHE HA 1 68 PHE HB3 2.868 2.304 3.571 3.025 3.013 3.033 . 0 0 "[ . 1 . 2]" 1 1268 1 68 PHE HA 1 68 PHE QD 3.207 2.577 3.993 2.609 2.519 2.697 0.058 12 0 "[ . 1 . 2]" 1 1269 1 68 PHE HA 1 71 MET H 3.240 2.665 4.129 3.500 3.440 3.574 . 0 0 "[ . 1 . 2]" 1 1270 1 68 PHE HA 1 71 MET HB3 2.691 2.162 3.350 3.343 3.249 3.411 0.061 13 0 "[ . 1 . 2]" 1 1271 1 68 PHE HA 1 71 MET ME 3.639 2.924 4.530 4.643 4.532 4.741 0.211 3 0 "[ . 1 . 2]" 1 1272 1 68 PHE HA 1 71 MET ME 4.395 2.801 5.472 3.445 2.850 3.731 . 0 0 "[ . 1 . 2]" 1 1273 1 68 PHE HA 1 72 MET H 3.931 3.158 4.894 4.384 4.263 4.496 . 0 0 "[ . 1 . 2]" 1 1274 1 68 PHE HB3 1 69 LEU H 2.979 2.685 3.845 2.595 2.506 2.657 0.179 12 0 "[ . 1 . 2]" 1 1275 1 68 PHE QD 1 69 LEU H 4.194 3.251 5.413 3.163 3.069 3.235 0.182 1 0 "[ . 1 . 2]" 1 1276 1 68 PHE QD 1 69 LEU HA 4.310 3.463 5.366 3.426 3.387 3.470 0.076 8 0 "[ . 1 . 2]" 1 1277 1 68 PHE QD 1 71 MET ME 5.844 3.923 7.276 3.772 3.685 3.935 0.238 1 0 "[ . 1 . 2]" 1 1278 1 68 PHE QD 2 6 MET ME 4.517 3.414 5.726 4.053 3.377 5.689 0.037 11 0 "[ . 1 . 2]" 1 1279 1 68 PHE QE 1 71 MET ME 5.521 3.673 6.873 3.516 3.323 3.650 0.350 8 0 "[ . 1 . 2]" 1 1280 1 68 PHE QE 2 2 MET QG 4.123 3.313 5.133 4.780 3.412 5.355 0.222 9 0 "[ . 1 . 2]" 1 1281 1 69 LEU H 1 69 LEU HA 2.929 2.658 3.780 2.794 2.781 2.807 . 0 0 "[ . 1 . 2]" 1 1282 1 69 LEU H 1 69 LEU HB2 2.954 2.289 3.813 2.445 2.411 2.477 . 0 0 "[ . 1 . 2]" 1 1283 1 69 LEU H 1 69 LEU HB3 3.079 2.386 3.974 2.502 2.477 2.524 . 0 0 "[ . 1 . 2]" 1 1284 1 69 LEU H 1 69 LEU MD1 5.270 3.934 6.561 4.045 4.012 4.094 . 0 0 "[ . 1 . 2]" 1 1285 1 69 LEU H 1 69 LEU QD 3.628 2.812 4.683 3.697 3.666 3.726 . 0 0 "[ . 1 . 2]" 1 1286 1 69 LEU H 1 69 LEU MD2 5.794 4.355 7.213 4.277 4.238 4.304 0.117 12 0 "[ . 1 . 2]" 1 1287 1 69 LEU H 1 69 LEU HG 3.293 2.552 4.250 4.438 4.433 4.444 0.194 18 0 "[ . 1 . 2]" 1 1288 1 69 LEU H 1 70 THR H 3.192 2.474 3.766 2.698 2.666 2.736 . 0 0 "[ . 1 . 2]" 1 1289 1 69 LEU H 1 71 MET H 4.503 3.490 5.812 4.277 4.199 4.338 . 0 0 "[ . 1 . 2]" 1 1290 1 69 LEU H 1 72 MET H 4.865 3.771 6.279 4.890 4.751 4.949 . 0 0 "[ . 1 . 2]" 1 1291 1 69 LEU HA 1 69 LEU HB2 2.733 2.196 3.403 2.468 2.449 2.480 . 0 0 "[ . 1 . 2]" 1 1292 1 69 LEU HA 1 69 LEU HB3 2.897 2.328 3.607 3.037 3.031 3.041 . 0 0 "[ . 1 . 2]" 1 1293 1 69 LEU HA 1 69 LEU MD1 3.426 2.353 4.265 2.197 2.176 2.215 0.177 14 0 "[ . 1 . 2]" 1 1294 1 69 LEU HA 1 69 LEU QD 2.638 2.120 3.284 2.186 2.165 2.203 . 0 0 "[ . 1 . 2]" 1 1295 1 69 LEU HA 1 69 LEU MD2 4.290 2.947 5.341 3.899 3.875 3.910 . 0 0 "[ . 1 . 2]" 1 1296 1 69 LEU HA 1 69 LEU HG 3.555 2.856 4.426 3.081 3.047 3.133 . 0 0 "[ . 1 . 2]" 1 1297 1 69 LEU HA 1 70 THR H 3.688 3.195 4.760 3.526 3.510 3.540 . 0 0 "[ . 1 . 2]" 1 1298 1 69 LEU HA 1 72 MET H 3.298 2.837 4.257 3.537 3.355 3.650 . 0 0 "[ . 1 . 2]" 1 1299 1 69 LEU HA 1 72 MET HB3 2.696 2.166 4.056 4.286 4.225 4.348 0.292 5 0 "[ . 1 . 2]" 1 1300 1 69 LEU HA 1 72 MET HG2 3.177 2.553 3.955 3.498 3.272 4.052 0.097 6 0 "[ . 1 . 2]" 1 1301 1 69 LEU HA 1 73 ALA H 4.353 3.664 5.618 4.509 4.379 4.607 . 0 0 "[ . 1 . 2]" 1 1302 1 69 LEU HB2 1 69 LEU MD1 4.233 2.576 5.270 2.337 2.326 2.361 0.250 11 0 "[ . 1 . 2]" 1 1303 1 69 LEU HB2 1 69 LEU MD2 4.131 2.697 5.143 2.428 2.380 2.475 0.317 12 0 "[ . 1 . 2]" 1 1304 1 69 LEU HB2 1 70 THR H 2.532 . 3.268 3.381 3.367 3.415 0.147 20 0 "[ . 1 . 2]" 1 1305 1 69 LEU HB3 1 69 LEU MD2 4.122 2.612 5.132 2.411 2.337 2.447 0.275 15 0 "[ . 1 . 2]" 1 1306 1 69 LEU HB3 1 70 THR H 2.897 2.245 3.739 2.518 2.476 2.606 . 0 0 "[ . 1 . 2]" 1 1307 1 69 LEU QD 1 70 THR H 3.810 2.953 4.917 3.921 3.882 3.982 . 0 0 "[ . 1 . 2]" 1 1308 1 69 LEU QD 1 72 MET H 3.999 3.099 5.161 4.458 4.304 4.581 . 0 0 "[ . 1 . 2]" 1 1309 1 69 LEU QD 1 73 ALA H 5.541 4.295 7.152 4.135 4.090 4.176 0.205 7 0 "[ . 1 . 2]" 1 1310 1 69 LEU MD2 1 70 THR HA 5.558 4.166 6.920 4.677 4.562 4.800 . 0 0 "[ . 1 . 2]" 1 1311 1 69 LEU MD2 1 73 ALA MB 6.401 4.843 7.969 4.761 4.692 4.829 0.151 11 0 "[ . 1 . 2]" 1 1312 1 69 LEU HG 1 70 THR H 3.787 2.935 4.888 3.727 3.668 3.818 . 0 0 "[ . 1 . 2]" 1 1313 1 70 THR H 1 70 THR HA 2.634 2.432 3.400 2.857 2.849 2.867 . 0 0 "[ . 1 . 2]" 1 1314 1 70 THR H 1 71 MET H 2.601 2.107 3.357 2.703 2.659 2.746 . 0 0 "[ . 1 . 2]" 1 1315 1 70 THR H 1 72 MET H 3.682 2.854 4.752 4.165 4.039 4.206 . 0 0 "[ . 1 . 2]" 1 1316 1 70 THR HA 1 70 THR HB 2.903 2.332 3.614 3.041 3.039 3.044 . 0 0 "[ . 1 . 2]" 1 1317 1 70 THR HA 1 70 THR MG 2.688 2.160 3.346 2.441 2.408 2.452 . 0 0 "[ . 1 . 2]" 1 1318 1 70 THR HA 1 70 THR MG 3.602 2.694 4.484 2.396 2.376 2.405 0.318 20 0 "[ . 1 . 2]" 1 1319 1 70 THR HA 1 71 MET H 2.711 2.101 3.499 2.748 2.743 2.756 . 0 0 "[ . 1 . 2]" 1 1320 1 70 THR HA 1 73 ALA H 3.900 3.023 5.034 3.427 3.330 3.523 . 0 0 "[ . 1 . 2]" 1 1321 1 70 THR HA 1 74 ARG H 4.046 3.136 5.222 3.169 3.099 3.274 0.037 16 0 "[ . 1 . 2]" 1 1322 1 70 THR HA 1 73 ALA H 4.199 3.374 5.228 3.566 3.455 3.692 . 0 0 "[ . 1 . 2]" 1 1323 1 70 THR HA 1 73 ALA MB . 3.245 3.750 3.247 3.147 3.459 0.098 18 0 "[ . 1 . 2]" 1 1324 1 70 THR HB 1 71 MET H 2.792 2.164 3.604 2.546 2.486 2.578 . 0 0 "[ . 1 . 2]" 1 1325 1 70 THR MG 1 71 MET H 2.972 2.303 3.836 3.435 3.359 3.509 . 0 0 "[ . 1 . 2]" 1 1326 1 70 THR MG 1 73 ALA MB 4.374 3.866 5.446 4.074 3.894 4.235 . 0 0 "[ . 1 . 2]" 1 1327 1 70 THR MG 1 74 ARG QD 5.275 3.938 6.567 4.259 3.753 4.697 0.185 17 0 "[ . 1 . 2]" 1 1328 1 71 MET H 1 71 MET HA 3.373 2.710 4.199 2.857 2.850 2.866 . 0 0 "[ . 1 . 2]" 1 1329 1 71 MET H 1 71 MET HB2 2.610 2.023 3.369 2.362 2.225 2.429 . 0 0 "[ . 1 . 2]" 1 1330 1 71 MET H 1 71 MET HB3 2.438 . 3.147 2.770 2.723 2.856 . 0 0 "[ . 1 . 2]" 1 1331 1 71 MET H 1 71 MET ME 3.991 3.093 5.151 4.895 4.660 5.008 . 0 0 "[ . 1 . 2]" 1 1332 1 71 MET H 1 71 MET HG3 3.627 2.989 4.681 4.314 4.158 4.388 . 0 0 "[ . 1 . 2]" 1 1333 1 71 MET H 1 72 MET H 2.746 2.128 3.489 2.710 2.658 2.749 . 0 0 "[ . 1 . 2]" 1 1334 1 71 MET H 1 74 ARG H 3.887 3.013 5.017 4.636 4.563 4.800 . 0 0 "[ . 1 . 2]" 1 1335 1 71 MET HA 1 71 MET HB2 3.107 2.496 3.868 2.594 2.557 2.660 . 0 0 "[ . 1 . 2]" 1 1336 1 71 MET HA 1 71 MET HB3 3.112 2.500 3.874 2.519 2.418 2.591 0.082 6 0 "[ . 1 . 2]" 1 1337 1 71 MET HA 1 71 MET HG2 3.038 2.441 3.782 2.700 2.548 2.815 . 0 0 "[ . 1 . 2]" 1 1338 1 71 MET HA 1 71 MET HG3 3.289 2.643 3.466 2.484 2.398 2.657 0.245 10 0 "[ . 1 . 2]" 1 1339 1 71 MET HA 1 72 MET H . 3.664 4.263 3.562 3.542 3.572 0.122 16 0 "[ . 1 . 2]" 1 1340 1 71 MET HB2 1 71 MET ME 3.870 2.495 4.818 3.604 3.532 3.649 . 0 0 "[ . 1 . 2]" 1 1341 1 71 MET HB2 1 71 MET HG2 3.468 2.786 4.317 3.026 3.007 3.035 . 0 0 "[ . 1 . 2]" 1 1342 1 71 MET HB2 1 71 MET HG3 3.253 2.414 4.050 2.408 2.335 2.457 0.079 8 0 "[ . 1 . 2]" 1 1343 1 71 MET HB2 1 72 MET H 3.089 2.394 3.987 3.690 3.543 3.778 . 0 0 "[ . 1 . 2]" 1 1344 1 71 MET HB3 1 71 MET ME 3.770 2.218 4.694 2.067 2.031 2.103 0.187 8 0 "[ . 1 . 2]" 1 1345 1 71 MET HB3 1 71 MET HG2 2.442 . 3.040 2.539 2.486 2.641 . 0 0 "[ . 1 . 2]" 1 1346 1 71 MET HB3 1 72 MET H 2.578 . 3.327 2.536 2.468 2.641 . 0 0 "[ . 1 . 2]" 1 1347 1 71 MET HB3 1 71 MET HG3 2.630 . 3.274 3.023 3.000 3.033 . 0 0 "[ . 1 . 2]" 1 1348 1 71 MET ME 1 71 MET HG3 5.779 2.993 7.195 3.273 3.257 3.294 . 0 0 "[ . 1 . 2]" 1 1349 1 71 MET ME 1 72 MET H 3.108 2.409 4.011 3.951 3.402 4.185 0.174 4 0 "[ . 1 . 2]" 1 1350 1 71 MET ME 1 72 MET HA 3.420 2.748 4.258 2.791 2.601 3.024 0.147 18 0 "[ . 1 . 2]" 1 1351 1 71 MET ME 2 3 ASP HA 5.821 3.942 7.228 5.336 3.740 7.303 0.202 18 0 "[ . 1 . 2]" 1 1352 1 71 MET ME 2 5 PHE QE 5.721 3.959 7.024 7.146 6.866 7.381 0.357 20 0 "[ . 1 . 2]" 1 1353 1 71 MET ME 2 6 MET HG2 3.834 3.005 4.958 4.207 3.221 5.042 0.084 19 0 "[ . 1 . 2]" 1 1354 1 71 MET ME 2 6 MET HG3 3.938 3.101 4.887 4.348 2.969 5.036 0.149 15 0 "[ . 1 . 2]" 1 1355 1 71 MET HG3 1 72 MET H 3.662 2.838 4.727 4.959 4.898 5.060 0.333 6 0 "[ . 1 . 2]" 1 1356 1 72 MET H 1 72 MET HA 2.617 2.378 3.378 2.800 2.787 2.821 . 0 0 "[ . 1 . 2]" 1 1357 1 72 MET H 1 72 MET HB2 2.641 2.047 3.409 2.337 2.306 2.458 . 0 0 "[ . 1 . 2]" 1 1358 1 72 MET H 1 72 MET HB3 2.546 . 3.286 3.499 3.477 3.584 0.298 6 0 "[ . 1 . 2]" 1 1359 1 72 MET H 1 72 MET ME 6.283 4.448 7.822 4.512 4.448 4.612 0.000 16 0 "[ . 1 . 2]" 1 1360 1 72 MET H 1 72 MET HG2 2.672 2.071 3.148 2.140 2.045 2.885 0.026 8 0 "[ . 1 . 2]" 1 1361 1 72 MET H 1 72 MET HG3 2.441 . 3.151 3.351 2.744 3.429 0.278 14 0 "[ . 1 . 2]" 1 1362 1 72 MET H 1 73 ALA H 2.520 2.201 3.252 2.825 2.766 2.871 . 0 0 "[ . 1 . 2]" 1 1363 1 72 MET H 1 74 ARG H 4.486 3.477 5.790 3.896 3.813 3.981 . 0 0 "[ . 1 . 2]" 1 1364 1 72 MET HA 1 72 MET HB2 2.904 2.333 3.615 3.024 3.015 3.039 . 0 0 "[ . 1 . 2]" 1 1365 1 72 MET HA 1 72 MET HB3 3.099 2.490 3.858 2.534 2.524 2.560 . 0 0 "[ . 1 . 2]" 1 1366 1 72 MET HA 1 72 MET ME 4.290 2.947 5.341 2.940 2.745 3.232 0.202 16 0 "[ . 1 . 2]" 1 1367 1 72 MET HA 1 72 MET HG2 . 3.023 3.263 2.814 2.372 2.886 0.651 6 2 "[ .+ 1 .- 2]" 1 1368 1 72 MET HA 1 72 MET HG3 2.630 2.113 3.474 3.636 3.547 3.654 0.180 12 0 "[ . 1 . 2]" 1 1369 1 72 MET HA 1 72 MET HG3 3.005 2.414 3.741 3.481 2.739 3.628 . 0 0 "[ . 1 . 2]" 1 1370 1 72 MET HA 1 73 ALA H 3.703 3.047 4.721 3.587 3.574 3.594 . 0 0 "[ . 1 . 2]" 1 1371 1 72 MET HA 1 74 ARG H 4.054 3.681 5.232 4.225 4.100 4.345 . 0 0 "[ . 1 . 2]" 1 1372 1 72 MET HA 1 75 LYS H 3.523 2.999 4.547 4.037 3.745 4.267 . 0 0 "[ . 1 . 2]" 1 1373 1 72 MET HA 1 75 LYS QB 3.226 2.592 4.016 3.969 3.487 4.172 0.156 11 0 "[ . 1 . 2]" 1 1374 1 72 MET HB2 1 72 MET ME 4.933 3.463 6.142 3.440 3.397 3.646 0.066 7 0 "[ . 1 . 2]" 1 1375 1 72 MET HB2 1 72 MET HG2 2.351 . 2.927 2.512 2.459 2.922 . 0 0 "[ . 1 . 2]" 1 1376 1 72 MET HB2 1 72 MET HG3 2.618 2.103 3.259 2.395 2.232 2.424 . 0 0 "[ . 1 . 2]" 1 1377 1 72 MET HB2 1 73 ALA H 3.547 2.749 4.578 2.593 2.559 2.626 0.190 3 0 "[ . 1 . 2]" 1 1378 1 72 MET HB3 1 72 MET HG2 2.220 . 2.764 2.983 2.821 3.002 0.238 3 0 "[ . 1 . 2]" 1 1379 1 72 MET HB3 1 72 MET HG3 2.405 . 2.994 2.514 2.464 2.889 . 0 0 "[ . 1 . 2]" 1 1380 1 72 MET HB3 1 73 ALA H 3.247 2.516 4.191 3.532 3.491 3.592 . 0 0 "[ . 1 . 2]" 1 1381 1 72 MET ME 1 72 MET HG2 . 2.798 3.322 3.286 2.439 3.382 0.359 16 0 "[ . 1 . 2]" 1 1382 1 72 MET ME 1 72 MET HG3 4.633 2.628 5.768 2.503 2.357 3.414 0.271 17 0 "[ . 1 . 2]" 1 1383 1 72 MET ME 1 76 MET ME 6.116 4.914 7.614 5.849 4.862 7.507 0.052 10 0 "[ . 1 . 2]" 1 1384 1 73 ALA H 1 73 ALA HA 2.850 2.349 3.640 2.921 2.911 2.928 . 0 0 "[ . 1 . 2]" 1 1385 1 73 ALA H 1 73 ALA MB 2.306 2.220 2.976 2.165 2.119 2.187 0.101 14 0 "[ . 1 . 2]" 1 1386 1 73 ALA H 1 74 ARG H 2.796 2.209 3.609 2.388 2.339 2.431 . 0 0 "[ . 1 . 2]" 1 1387 1 73 ALA HA 1 74 ARG H 3.486 2.801 4.340 3.487 3.466 3.503 . 0 0 "[ . 1 . 2]" 1 1388 1 73 ALA HA 1 74 ARG H 2.584 2.003 3.335 2.700 2.673 2.728 . 0 0 "[ . 1 . 2]" 1 1389 1 73 ALA HA 1 76 MET H 3.995 3.210 4.974 3.562 3.273 3.779 . 0 0 "[ . 1 . 2]" 1 1390 1 73 ALA HA 1 76 MET QB 3.613 2.903 4.498 3.834 2.549 4.507 0.354 15 0 "[ . 1 . 2]" 1 1391 1 73 ALA HA 1 76 MET HG2 3.802 3.055 4.733 4.530 3.426 4.935 0.202 14 0 "[ . 1 . 2]" 1 1392 1 73 ALA HA 1 76 MET QG 4.155 3.338 5.173 3.886 3.245 4.515 0.093 14 0 "[ . 1 . 2]" 1 1393 1 73 ALA HA 1 76 MET HG3 4.059 3.261 5.053 4.542 3.291 5.361 0.308 17 0 "[ . 1 . 2]" 1 1394 1 73 ALA HA 1 77 LYS H 4.653 3.738 5.793 5.115 4.140 5.606 . 0 0 "[ . 1 . 2]" 1 1395 1 73 ALA MB 1 74 ARG H . 3.032 3.629 2.915 2.865 2.958 0.167 7 0 "[ . 1 . 2]" 1 1396 1 74 ARG H 1 74 ARG HA 3.326 2.672 4.141 2.811 2.777 2.846 . 0 0 "[ . 1 . 2]" 1 1397 1 74 ARG H 1 74 ARG QB 2.418 . 3.121 2.250 2.184 2.273 . 0 0 "[ . 1 . 2]" 1 1398 1 74 ARG H 1 74 ARG QD 3.941 3.054 5.087 4.548 4.076 4.681 . 0 0 "[ . 1 . 2]" 1 1399 1 74 ARG H 1 74 ARG HG2 3.366 2.609 4.344 4.508 4.436 4.631 0.287 5 0 "[ . 1 . 2]" 1 1400 1 74 ARG H 1 75 LYS H 2.966 2.299 3.739 2.732 2.635 2.765 . 0 0 "[ . 1 . 2]" 1 1401 1 74 ARG H 1 76 MET H 3.829 3.571 4.942 4.514 4.149 4.715 . 0 0 "[ . 1 . 2]" 1 1402 1 74 ARG HA 1 74 ARG QB 2.885 2.318 3.592 2.373 2.355 2.435 . 0 0 "[ . 1 . 2]" 1 1403 1 74 ARG HA 1 74 ARG HG2 4.214 3.386 5.246 3.296 3.115 3.756 0.271 6 0 "[ . 1 . 2]" 1 1404 1 74 ARG HA 1 75 LYS H 2.859 2.216 3.690 3.482 3.415 3.557 . 0 0 "[ . 1 . 2]" 1 1405 1 74 ARG HA 1 77 LYS H 3.383 2.622 4.366 3.203 3.000 3.835 . 0 0 "[ . 1 . 2]" 1 1406 1 74 ARG HA 1 77 LYS QB 3.570 2.868 4.444 2.785 2.669 3.031 0.199 8 0 "[ . 1 . 2]" 1 1407 1 74 ARG QB 1 75 LYS H 2.419 . 3.122 2.200 2.118 2.273 . 0 0 "[ . 1 . 2]" 1 1408 1 75 LYS H 1 75 LYS HA 2.835 2.435 3.659 2.845 2.829 2.874 . 0 0 "[ . 1 . 2]" 1 1409 1 75 LYS H 1 76 MET H 2.998 2.323 3.870 2.745 2.642 2.892 . 0 0 "[ . 1 . 2]" 1 1410 1 75 LYS H 1 76 MET H 2.836 2.198 3.661 2.439 2.392 2.546 . 0 0 "[ . 1 . 2]" 1 1411 1 75 LYS HA 1 75 LYS QB 2.856 2.295 3.556 2.385 2.357 2.422 . 0 0 "[ . 1 . 2]" 1 1412 1 75 LYS HA 1 75 LYS QD 3.144 2.526 3.914 3.790 2.227 3.990 0.299 17 0 "[ . 1 . 2]" 1 1413 1 75 LYS HA 1 75 LYS QG 3.208 2.577 3.994 2.430 2.306 2.882 0.271 20 0 "[ . 1 . 2]" 1 1414 1 75 LYS HA 1 76 MET H 3.387 2.625 4.032 3.557 3.530 3.604 . 0 0 "[ . 1 . 2]" 1 1415 1 75 LYS HA 1 78 ASP H 4.199 3.254 5.420 3.546 3.247 5.534 0.114 16 0 "[ . 1 . 2]" 1 1416 1 75 LYS QD 1 76 MET H 4.507 3.493 5.817 4.703 4.330 5.135 . 0 0 "[ . 1 . 2]" 1 1417 1 75 LYS QG 1 76 MET H 4.211 3.264 5.435 3.646 3.384 4.114 . 0 0 "[ . 1 . 2]" 1 1418 1 76 MET H 1 76 MET HA 3.005 2.603 3.878 2.860 2.816 2.891 . 0 0 "[ . 1 . 2]" 1 1419 1 76 MET H 1 76 MET QB 3.050 2.364 3.937 2.406 2.215 2.512 0.149 17 0 "[ . 1 . 2]" 1 1420 1 76 MET H 1 76 MET HG2 3.503 2.815 4.361 3.353 2.644 4.580 0.219 17 0 "[ . 1 . 2]" 1 1421 1 76 MET H 1 76 MET QG 3.495 2.709 4.511 2.908 2.518 4.011 0.191 8 0 "[ . 1 . 2]" 1 1422 1 76 MET H 1 76 MET HG3 3.629 2.916 4.518 3.356 2.610 4.456 0.306 14 0 "[ . 1 . 2]" 1 1423 1 76 MET H 1 77 LYS H 3.035 2.352 3.917 2.719 2.654 2.815 . 0 0 "[ . 1 . 2]" 1 1424 1 76 MET HA 1 76 MET QB 3.104 2.294 3.864 2.388 2.188 2.442 0.106 16 0 "[ . 1 . 2]" 1 1425 1 76 MET HA 1 76 MET ME 5.718 4.594 7.119 4.512 4.256 4.633 0.338 17 0 "[ . 1 . 2]" 1 1426 1 76 MET HA 1 76 MET HG2 3.348 2.690 4.168 3.174 2.394 3.895 0.296 8 0 "[ . 1 . 2]" 1 1427 1 76 MET HA 1 76 MET HG3 3.505 2.816 4.364 3.069 2.436 3.697 0.380 13 0 "[ . 1 . 2]" 1 1428 1 76 MET HA 1 77 LYS H 3.175 2.551 3.953 3.539 3.211 3.584 . 0 0 "[ . 1 . 2]" 1 1429 1 76 MET HA 1 77 LYS H 2.525 . 3.259 2.781 2.728 2.847 . 0 0 "[ . 1 . 2]" 1 1430 1 76 MET QG 1 77 LYS H 3.812 2.954 4.920 4.119 2.917 4.491 0.037 19 0 "[ . 1 . 2]" 1 1431 1 76 MET HG2 1 77 LYS H 4.228 3.397 5.264 4.638 3.232 5.200 0.165 19 0 "[ . 1 . 2]" 1 1432 1 76 MET HG3 1 77 LYS H 4.158 3.341 5.177 4.662 3.319 5.054 0.022 19 0 "[ . 1 . 2]" 1 1433 1 77 LYS H 1 77 LYS HA 3.356 2.696 4.178 2.911 2.840 3.000 . 0 0 "[ . 1 . 2]" 1 1434 1 77 LYS H 1 77 LYS QB 2.751 2.132 3.551 2.440 2.282 2.603 . 0 0 "[ . 1 . 2]" 1 1435 1 77 LYS H 1 77 LYS QG 3.161 2.450 4.080 2.865 2.265 4.082 0.185 11 0 "[ . 1 . 2]" 1 1436 1 77 LYS H 1 78 ASP H 3.324 2.576 4.124 2.592 2.379 3.740 0.197 13 0 "[ . 1 . 2]" 1 1437 1 77 LYS H 1 79 THR H 4.840 3.751 6.247 5.123 4.076 6.673 0.426 20 0 "[ . 1 . 2]" 1 1438 1 77 LYS HA 1 77 LYS QB 3.190 2.363 3.972 2.369 2.338 2.402 0.025 17 0 "[ . 1 . 2]" 1 1439 1 77 LYS HA 1 77 LYS QG 3.754 3.016 4.674 2.827 2.442 2.996 0.574 3 5 "[ + . 1 * ** -]" 1 1440 1 77 LYS HA 1 78 ASP H . 2.594 3.296 3.425 3.204 3.519 0.223 18 0 "[ . 1 . 2]" 1 1441 1 77 LYS QB 1 78 ASP H 3.266 2.531 4.216 2.878 1.859 3.569 0.672 16 1 "[ . 1 .+ 2]" 1 1442 1 77 LYS QG 1 78 ASP H 3.662 2.838 4.726 4.048 3.592 4.415 . 0 0 "[ . 1 . 2]" 1 1443 1 78 ASP H 1 78 ASP HB2 2.895 2.244 3.737 3.296 3.056 3.624 . 0 0 "[ . 1 . 2]" 1 1444 1 78 ASP H 1 78 ASP HB3 3.103 2.405 4.005 3.687 2.907 4.089 0.084 8 0 "[ . 1 . 2]" 1 1445 1 78 ASP H 1 79 THR H 3.264 2.723 4.213 3.190 2.657 4.345 0.132 7 0 "[ . 1 . 2]" 1 1446 1 78 ASP H 1 80 ASP H 4.850 3.759 6.260 5.423 4.786 6.355 0.095 14 0 "[ . 1 . 2]" 1 1447 1 78 ASP HB2 1 79 THR H 3.817 2.958 4.927 4.356 3.620 4.690 . 0 0 "[ . 1 . 2]" 1 1448 1 78 ASP HB3 1 79 THR H 3.819 2.960 4.929 4.098 2.862 4.489 0.098 20 0 "[ . 1 . 2]" 1 1449 1 79 THR H 1 79 THR HA 3.049 2.363 3.935 2.769 2.422 2.886 . 0 0 "[ . 1 . 2]" 1 1450 1 79 THR H 1 79 THR MG . 3.689 4.758 3.567 3.408 3.813 0.281 20 0 "[ . 1 . 2]" 1 1451 1 79 THR H 1 80 ASP H 3.438 2.665 4.400 2.921 2.625 4.099 0.040 9 0 "[ . 1 . 2]" 1 1452 1 79 THR HA 1 80 ASP H 2.570 . 3.317 2.279 2.082 2.719 . 0 0 "[ . 1 . 2]" 1 1453 1 79 THR HA 1 83 GLU H 4.455 3.453 5.750 5.915 5.832 6.038 0.288 14 0 "[ . 1 . 2]" 1 1454 1 79 THR HA 1 79 THR MG 3.132 2.516 3.899 2.222 2.185 2.372 0.331 6 0 "[ . 1 . 2]" 1 1455 1 79 THR HA 1 80 ASP H 3.122 2.508 3.887 3.320 2.237 3.622 0.271 17 0 "[ . 1 . 2]" 1 1456 1 79 THR MG 1 80 ASP H 5.708 4.086 7.106 3.900 3.668 4.431 0.418 9 0 "[ . 1 . 2]" 1 1457 1 79 THR MG 1 81 SER H 4.803 3.723 6.199 4.920 3.739 5.328 . 0 0 "[ . 1 . 2]" 1 1458 1 80 ASP H 1 80 ASP HA 2.582 2.001 3.333 2.913 2.350 2.991 . 0 0 "[ . 1 . 2]" 1 1459 1 80 ASP H 1 80 ASP HB2 2.948 2.285 3.805 2.689 2.373 3.656 . 0 0 "[ . 1 . 2]" 1 1460 1 80 ASP H 1 80 ASP HB3 3.019 2.340 3.897 3.457 2.630 3.934 0.037 14 0 "[ . 1 . 2]" 1 1461 1 80 ASP HA 1 81 SER H 2.577 . 3.326 3.378 3.251 3.500 0.174 14 0 "[ . 1 . 2]" 1 1462 1 80 ASP QB 1 81 SER H 3.237 2.509 4.178 3.180 2.710 3.749 . 0 0 "[ . 1 . 2]" 1 1463 1 81 SER H 1 81 SER HA 2.862 2.218 3.694 2.804 2.757 2.900 . 0 0 "[ . 1 . 2]" 1 1464 1 81 SER H 1 81 SER QB 2.947 2.284 3.804 2.464 2.270 2.591 0.014 3 0 "[ . 1 . 2]" 1 1465 1 81 SER H 1 84 GLU H 3.809 2.952 4.916 3.707 3.577 3.930 . 0 0 "[ . 1 . 2]" 1 1466 1 81 SER H 1 83 GLU H 4.263 3.304 5.502 4.487 4.203 5.058 . 0 0 "[ . 1 . 2]" 1 1467 1 81 SER HA 1 83 GLU H 4.125 3.197 5.324 4.183 3.567 4.505 . 0 0 "[ . 1 . 2]" 1 1468 1 81 SER HA 1 85 ILE H 5.133 3.978 6.625 4.215 3.781 5.886 0.197 5 0 "[ . 1 . 2]" 1 1469 1 81 SER QB 1 83 GLU H 2.905 2.251 3.749 2.848 2.793 2.879 . 0 0 "[ . 1 . 2]" 1 1470 1 82 GLU H 1 83 GLU H 3.146 2.438 4.060 2.661 2.429 2.805 0.009 14 0 "[ . 1 . 2]" 1 1471 1 82 GLU HA 1 83 GLU H 3.390 2.627 4.375 3.535 3.502 3.588 . 0 0 "[ . 1 . 2]" 1 1472 1 82 GLU HA 1 85 ILE H 2.998 2.323 3.870 3.100 2.957 3.256 . 0 0 "[ . 1 . 2]" 1 1473 1 82 GLU HA 1 85 ILE MD 4.136 3.323 5.149 3.136 3.054 3.269 0.269 5 0 "[ . 1 . 2]" 1 1474 1 82 GLU QB 1 83 GLU H 2.323 . 2.998 2.156 2.090 2.258 . 0 0 "[ . 1 . 2]" 1 1475 1 82 GLU QB 1 86 ARG H 2.517 . 3.249 3.476 3.412 3.519 0.270 3 0 "[ . 1 . 2]" 1 1476 1 82 GLU QG 1 83 GLU H 2.936 2.275 3.789 2.835 2.172 3.771 0.103 14 0 "[ . 1 . 2]" 1 1477 1 83 GLU H 1 83 GLU HA 3.379 2.715 4.207 2.867 2.805 2.897 . 0 0 "[ . 1 . 2]" 1 1478 1 83 GLU H 1 84 GLU H 3.177 2.462 4.101 2.732 2.543 2.932 . 0 0 "[ . 1 . 2]" 1 1479 1 83 GLU H 1 85 ILE H 4.459 3.456 5.755 4.053 3.916 4.171 . 0 0 "[ . 1 . 2]" 1 1480 1 83 GLU H 1 85 ILE MD 5.850 4.534 7.550 5.740 5.100 6.075 . 0 0 "[ . 1 . 2]" 1 1481 1 83 GLU H 1 85 ILE HG12 5.032 3.900 6.495 5.842 5.630 6.044 . 0 0 "[ . 1 . 2]" 1 1482 1 83 GLU HA 1 84 GLU H 3.273 2.537 4.225 3.559 3.489 3.602 . 0 0 "[ . 1 . 2]" 1 1483 1 83 GLU HA 1 86 ARG H 3.244 2.514 4.187 3.270 3.184 3.358 . 0 0 "[ . 1 . 2]" 1 1484 1 83 GLU HA 1 86 ARG H 4.563 3.666 5.681 3.785 3.601 4.035 0.065 19 0 "[ . 1 . 2]" 1 1485 1 83 GLU QB 1 84 GLU H 2.642 2.048 3.410 2.205 2.100 2.331 . 0 0 "[ . 1 . 2]" 1 1486 1 83 GLU QB 2 8 GLY H 3.911 3.193 4.744 4.585 4.127 4.944 0.200 17 0 "[ . 1 . 2]" 1 1487 1 83 GLU QB 2 8 GLY HA3 3.793 3.048 4.722 4.832 4.206 5.199 0.477 12 0 "[ . 1 . 2]" 1 1488 1 83 GLU QG 1 84 GLU H 3.030 2.348 3.911 2.665 2.071 3.658 0.277 11 0 "[ . 1 . 2]" 1 1489 1 83 GLU QG 1 86 ARG H 3.605 2.794 4.653 4.574 4.085 4.894 0.241 7 0 "[ . 1 . 2]" 1 1490 1 84 GLU H 1 84 GLU HA 3.104 2.406 4.006 2.888 2.857 2.902 . 0 0 "[ . 1 . 2]" 1 1491 1 84 GLU H 1 84 GLU HA 2.823 2.268 3.515 2.706 2.648 2.768 . 0 0 "[ . 1 . 2]" 1 1492 1 84 GLU H 1 85 ILE H 3.007 2.331 3.881 2.570 2.505 2.649 . 0 0 "[ . 1 . 2]" 1 1493 1 84 GLU H 1 85 ILE H 2.611 2.024 3.370 2.546 2.486 2.622 . 0 0 "[ . 1 . 2]" 1 1494 1 84 GLU HB2 1 85 ILE H 2.873 2.227 3.708 3.312 2.615 3.952 0.244 4 0 "[ . 1 . 2]" 1 1495 1 84 GLU HB3 1 85 ILE H 2.324 . 3.000 2.399 2.234 2.488 . 0 0 "[ . 1 . 2]" 1 1496 1 84 GLU QG 2 4 VAL MG2 4.122 3.112 5.132 3.151 2.793 3.571 0.319 8 0 "[ . 1 . 2]" 1 1497 1 85 ILE H 1 85 ILE HA 2.998 2.324 3.473 2.867 2.840 2.882 . 0 0 "[ . 1 . 2]" 1 1498 1 85 ILE H 1 85 ILE MD . 3.734 4.338 3.897 3.649 4.172 0.085 16 0 "[ . 1 . 2]" 1 1499 1 85 ILE H 1 85 ILE QG 3.429 2.658 4.426 2.452 2.356 2.588 0.302 1 0 "[ . 1 . 2]" 1 1500 1 85 ILE H 1 85 ILE HG12 2.748 2.130 3.547 3.197 2.907 3.385 . 0 0 "[ . 1 . 2]" 1 1501 1 85 ILE H 1 85 ILE HG13 2.670 2.069 3.446 2.562 2.409 2.806 . 0 0 "[ . 1 . 2]" 1 1502 1 85 ILE H 1 85 ILE MG 4.757 3.822 5.922 3.823 3.795 3.848 0.027 16 0 "[ . 1 . 2]" 1 1503 1 85 ILE H 1 86 ARG H 2.690 2.085 3.411 2.777 2.665 2.863 . 0 0 "[ . 1 . 2]" 1 1504 1 85 ILE HA 1 85 ILE HB 2.969 2.385 3.696 3.034 3.016 3.051 . 0 0 "[ . 1 . 2]" 1 1505 1 85 ILE HA 1 85 ILE MD 3.685 3.507 4.588 3.650 3.405 3.837 0.102 3 0 "[ . 1 . 2]" 1 1506 1 85 ILE HA 1 85 ILE HG12 2.397 . 2.984 2.170 2.108 2.232 . 0 0 "[ . 1 . 2]" 1 1507 1 85 ILE HA 1 85 ILE HG13 2.393 . 2.979 2.548 2.432 2.732 . 0 0 "[ . 1 . 2]" 1 1508 1 85 ILE HA 1 85 ILE MG 3.371 2.708 4.197 2.564 2.494 2.633 0.214 19 0 "[ . 1 . 2]" 1 1509 1 85 ILE HA 1 86 ARG HA 3.722 2.990 4.634 4.738 4.709 4.769 0.135 19 0 "[ . 1 . 2]" 1 1510 1 85 ILE HA 1 88 ALA H 3.638 2.819 4.696 3.552 3.405 3.693 . 0 0 "[ . 1 . 2]" 1 1511 1 85 ILE HA 1 88 ALA MB 3.407 2.737 4.242 2.748 2.655 2.945 0.082 13 0 "[ . 1 . 2]" 1 1512 1 85 ILE HA 1 141 PHE QR 4.050 3.254 5.042 4.043 3.536 4.515 . 0 0 "[ . 1 . 2]" 1 1513 1 85 ILE HB 1 85 ILE MD 3.671 2.749 4.570 2.568 2.415 2.792 0.334 19 0 "[ . 1 . 2]" 1 1514 1 85 ILE HB 1 86 ARG H 2.710 2.100 3.498 2.754 2.591 2.891 . 0 0 "[ . 1 . 2]" 1 1515 1 85 ILE MD 1 86 ARG H 4.758 3.688 6.141 4.847 4.638 5.049 . 0 0 "[ . 1 . 2]" 1 1516 1 85 ILE MD 1 142 VAL HA 4.694 3.771 5.844 4.295 3.691 5.105 0.080 13 0 "[ . 1 . 2]" 1 1517 1 85 ILE MD 1 145 MET H 4.037 3.129 5.210 4.322 3.883 4.776 . 0 0 "[ . 1 . 2]" 1 1518 1 85 ILE MD 1 144 MET ME 5.229 4.005 6.755 6.700 5.931 7.264 0.509 16 1 "[ . 1 .+ 2]" 1 1519 1 85 ILE MD 1 145 MET ME 4.487 3.405 5.586 3.533 3.264 4.145 0.141 15 0 "[ . 1 . 2]" 1 1520 1 85 ILE MD 1 145 MET QG 3.561 2.861 4.433 3.413 2.470 4.326 0.391 11 0 "[ . 1 . 2]" 1 1521 1 85 ILE MD 1 146 THR HA 5.030 4.041 6.262 5.035 3.833 6.367 0.208 4 0 "[ . 1 . 2]" 1 1522 1 85 ILE MD 2 8 GLY HA2 3.869 3.109 4.817 3.821 3.373 4.828 0.011 6 0 "[ . 1 . 2]" 1 1523 1 85 ILE MD 2 8 GLY HA3 3.809 3.060 4.742 3.383 2.732 4.800 0.328 12 0 "[ . 1 . 2]" 1 1524 1 85 ILE HG12 1 86 ARG H 3.241 2.512 4.183 3.251 3.201 3.306 . 0 0 "[ . 1 . 2]" 1 1525 1 85 ILE HG13 1 85 ILE MG 3.409 2.739 4.244 3.163 3.093 3.213 . 0 0 "[ . 1 . 2]" 1 1526 1 85 ILE HG13 1 86 ARG H 2.724 2.111 3.516 2.386 2.338 2.408 . 0 0 "[ . 1 . 2]" 1 1527 1 85 ILE MG 1 86 ARG H 4.645 3.532 5.783 3.294 3.249 3.359 0.283 13 0 "[ . 1 . 2]" 1 1528 1 85 ILE MG 1 86 ARG HA 3.927 3.261 4.889 3.323 3.249 3.372 0.012 15 0 "[ . 1 . 2]" 1 1529 1 85 ILE MG 1 89 PHE HB2 4.923 3.955 6.129 4.326 3.904 4.807 0.051 8 0 "[ . 1 . 2]" 1 1530 1 85 ILE MG 1 138 TYR QE 4.855 3.701 5.455 5.366 5.076 5.650 0.195 19 0 "[ . 1 . 2]" 1 1531 1 85 ILE MG 1 141 PHE QD 4.343 3.489 5.407 3.701 3.483 4.072 0.006 15 0 "[ . 1 . 2]" 1 1532 1 85 ILE MG 1 141 PHE QE 4.506 3.420 5.610 3.117 2.941 3.246 0.479 19 0 "[ . 1 . 2]" 1 1533 1 85 ILE MG 1 142 VAL H 4.138 3.873 5.341 4.951 4.748 5.434 0.093 19 0 "[ . 1 . 2]" 1 1534 1 85 ILE MG 1 142 VAL HA . 2.995 3.698 3.012 2.700 3.572 0.295 16 0 "[ . 1 . 2]" 1 1535 1 85 ILE MG 1 142 VAL MG1 3.912 3.143 4.870 3.185 2.925 3.668 0.218 15 0 "[ . 1 . 2]" 1 1536 1 85 ILE MG 1 142 VAL MG2 3.488 2.702 4.112 2.897 2.619 3.492 0.083 9 0 "[ . 1 . 2]" 1 1537 1 85 ILE MG 1 145 MET H 3.967 3.075 5.120 4.602 3.912 5.102 . 0 0 "[ . 1 . 2]" 1 1538 1 85 ILE MG 1 145 MET ME 4.982 3.783 6.202 3.946 3.640 4.658 0.143 19 0 "[ . 1 . 2]" 1 1539 1 85 ILE MG 1 145 MET QG 3.505 2.816 4.364 3.136 2.687 3.833 0.129 7 0 "[ . 1 . 2]" 1 1540 1 86 ARG H 1 86 ARG HA 2.715 2.299 3.504 2.874 2.861 2.889 . 0 0 "[ . 1 . 2]" 1 1541 1 86 ARG H 1 86 ARG QD 3.899 3.022 5.032 3.708 3.536 4.209 . 0 0 "[ . 1 . 2]" 1 1542 1 86 ARG H 1 86 ARG HG2 3.377 2.617 4.359 3.590 2.544 3.704 0.073 15 0 "[ . 1 . 2]" 1 1543 1 86 ARG H 1 86 ARG HG3 2.978 2.308 3.844 2.391 2.301 3.427 0.007 3 0 "[ . 1 . 2]" 1 1544 1 86 ARG H 1 87 GLU H 2.709 2.701 3.496 2.676 2.641 2.721 0.060 12 0 "[ . 1 . 2]" 1 1545 1 86 ARG H 1 138 TYR QD 3.405 2.667 4.349 2.832 2.754 2.903 . 0 0 "[ . 1 . 2]" 1 1546 1 86 ARG H 1 138 TYR QE 3.552 2.782 4.537 4.605 4.533 4.668 0.131 17 0 "[ . 1 . 2]" 1 1547 1 86 ARG H 1 138 TYR QE 5.091 3.946 6.571 5.733 5.426 6.228 . 0 0 "[ . 1 . 2]" 1 1548 1 86 ARG HA 1 86 ARG HB2 2.787 2.239 3.470 3.031 3.022 3.034 . 0 0 "[ . 1 . 2]" 1 1549 1 86 ARG HA 1 86 ARG HB3 2.892 2.324 3.600 2.534 2.527 2.566 . 0 0 "[ . 1 . 2]" 1 1550 1 86 ARG HA 1 86 ARG QD 2.859 2.297 3.559 3.294 2.282 3.528 0.015 15 0 "[ . 1 . 2]" 1 1551 1 86 ARG HA 1 86 ARG HG2 3.093 2.485 3.851 2.487 2.428 2.527 0.057 4 0 "[ . 1 . 2]" 1 1552 1 86 ARG HA 1 86 ARG HG3 3.133 2.517 3.901 2.875 2.777 3.658 . 0 0 "[ . 1 . 2]" 1 1553 1 86 ARG HA 1 87 GLU H 4.061 3.263 5.056 3.560 3.545 3.572 . 0 0 "[ . 1 . 2]" 1 1554 1 86 ARG HA 1 89 PHE H 3.004 2.328 3.877 3.206 3.162 3.283 . 0 0 "[ . 1 . 2]" 1 1555 1 86 ARG HA 1 89 PHE H 3.483 2.798 4.336 3.689 3.596 3.842 . 0 0 "[ . 1 . 2]" 1 1556 1 86 ARG HA 1 89 PHE HB3 3.119 2.506 3.883 4.030 3.856 4.139 0.256 12 0 "[ . 1 . 2]" 1 1557 1 86 ARG HA 1 138 TYR QE 3.110 2.499 3.872 2.988 2.785 3.396 . 0 0 "[ . 1 . 2]" 1 1558 1 86 ARG HB2 1 87 GLU H 3.760 2.914 4.853 2.767 2.737 2.789 0.177 13 0 "[ . 1 . 2]" 1 1559 1 86 ARG HB3 1 86 ARG HE 2.760 2.139 3.562 2.441 2.196 3.550 . 0 0 "[ . 1 . 2]" 1 1560 1 86 ARG HB3 1 87 GLU H 2.785 2.158 3.595 2.472 2.424 2.519 . 0 0 "[ . 1 . 2]" 1 1561 1 86 ARG QD 1 86 ARG HE 1.894 . 2.444 2.474 2.265 2.531 0.087 1 0 "[ . 1 . 2]" 1 1562 1 86 ARG QD 1 87 GLU H 5.183 4.017 6.690 4.930 4.827 5.266 . 0 0 "[ . 1 . 2]" 1 1563 1 86 ARG HE 1 86 ARG HG2 2.609 2.022 3.367 2.820 2.448 3.579 0.212 12 0 "[ . 1 . 2]" 1 1564 1 86 ARG HE 1 86 ARG HG3 2.863 2.219 3.695 3.505 2.389 3.961 0.266 7 0 "[ . 1 . 2]" 1 1565 1 86 ARG HG2 1 87 GLU H 5.311 4.116 6.855 5.083 4.596 5.127 . 0 0 "[ . 1 . 2]" 1 1566 1 87 GLU H 1 87 GLU HA 3.172 2.458 4.094 2.863 2.844 2.884 . 0 0 "[ . 1 . 2]" 1 1567 1 87 GLU H 1 87 GLU QG 3.148 2.440 4.063 4.039 3.967 4.084 0.021 3 0 "[ . 1 . 2]" 1 1568 1 87 GLU H 1 88 ALA H 3.256 2.524 3.657 2.664 2.585 2.734 . 0 0 "[ . 1 . 2]" 1 1569 1 87 GLU H 1 89 PHE H 4.859 3.766 6.271 4.242 4.119 4.346 . 0 0 "[ . 1 . 2]" 1 1570 1 87 GLU HA 1 88 ALA H 2.754 2.134 3.555 2.709 2.703 2.721 . 0 0 "[ . 1 . 2]" 1 1571 1 87 GLU HA 1 90 ARG H 3.119 2.417 4.026 3.467 3.329 3.605 . 0 0 "[ . 1 . 2]" 1 1572 1 87 GLU QB 1 88 ALA H 2.973 2.304 3.837 2.603 2.565 2.648 . 0 0 "[ . 1 . 2]" 1 1573 1 87 GLU QG 1 88 ALA H 3.804 2.948 4.910 3.745 3.613 4.252 . 0 0 "[ . 1 . 2]" 1 1574 1 87 GLU QG 1 91 VAL MG1 5.271 4.235 6.562 5.588 5.313 5.998 . 0 0 "[ . 1 . 2]" 1 1575 1 88 ALA H 1 88 ALA HA 3.003 2.413 3.739 2.812 2.804 2.829 . 0 0 "[ . 1 . 2]" 1 1576 1 88 ALA H 1 88 ALA MB 2.506 2.406 3.234 2.181 2.122 2.261 0.284 5 0 "[ . 1 . 2]" 1 1577 1 88 ALA H 1 89 PHE H 3.084 2.390 3.405 2.794 2.723 2.869 . 0 0 "[ . 1 . 2]" 1 1578 1 88 ALA H 1 90 ARG H 4.197 3.253 5.417 4.382 4.310 4.498 . 0 0 "[ . 1 . 2]" 1 1579 1 88 ALA H 1 141 PHE QE 5.503 4.265 7.103 4.382 4.229 4.564 0.036 12 0 "[ . 1 . 2]" 1 1580 1 88 ALA HA 1 91 VAL H 3.398 2.858 4.386 3.209 3.069 3.303 . 0 0 "[ . 1 . 2]" 1 1581 1 88 ALA HA 1 91 VAL HB 3.026 2.431 3.767 2.717 2.592 2.951 . 0 0 "[ . 1 . 2]" 1 1582 1 88 ALA HA 1 91 VAL MG1 3.152 2.532 3.924 3.850 3.762 3.951 0.027 3 0 "[ . 1 . 2]" 1 1583 1 88 ALA MB 1 89 PHE H . 2.941 3.432 2.810 2.709 2.887 0.232 13 0 "[ . 1 . 2]" 1 1584 1 88 ALA MB 1 89 PHE HA 3.719 2.988 4.630 3.791 3.689 3.892 . 0 0 "[ . 1 . 2]" 1 1585 1 88 ALA MB 1 92 PHE QE 3.780 2.637 4.706 2.525 2.419 2.602 0.218 5 0 "[ . 1 . 2]" 1 1586 1 88 ALA MB 1 141 PHE QD 4.039 3.045 5.028 4.865 4.704 5.030 0.002 3 0 "[ . 1 . 2]" 1 1587 1 88 ALA MB 2 4 VAL MG2 4.561 3.365 5.872 3.981 2.969 5.976 0.396 2 0 "[ . 1 . 2]" 1 1588 1 89 PHE H 1 89 PHE HA 2.682 2.079 3.144 2.831 2.814 2.848 . 0 0 "[ . 1 . 2]" 1 1589 1 89 PHE H 1 89 PHE HB2 2.776 2.152 3.583 2.438 2.395 2.483 . 0 0 "[ . 1 . 2]" 1 1590 1 89 PHE H 1 89 PHE HB3 2.665 2.066 3.440 2.644 2.615 2.664 . 0 0 "[ . 1 . 2]" 1 1591 1 89 PHE H 1 89 PHE QD 4.346 3.368 5.609 3.643 3.538 3.776 . 0 0 "[ . 1 . 2]" 1 1592 1 89 PHE H 1 90 ARG H 2.950 2.325 3.807 2.712 2.657 2.759 . 0 0 "[ . 1 . 2]" 1 1593 1 89 PHE H 1 100 ILE MD 5.534 4.289 7.143 5.492 5.298 5.811 . 0 0 "[ . 1 . 2]" 1 1594 1 89 PHE H 1 138 TYR QD 3.876 3.036 4.951 2.895 2.794 3.034 0.242 2 0 "[ . 1 . 2]" 1 1595 1 89 PHE H 1 138 TYR QE 3.734 2.924 4.769 4.003 3.821 4.263 . 0 0 "[ . 1 . 2]" 1 1596 1 89 PHE H 1 141 PHE QD 2.739 2.145 3.898 3.238 3.150 3.374 . 0 0 "[ . 1 . 2]" 1 1597 1 89 PHE H 1 141 PHE QE 3.804 2.948 4.910 2.845 2.766 2.897 0.182 4 0 "[ . 1 . 2]" 1 1598 1 89 PHE H 1 141 PHE QE 3.060 2.396 3.908 2.817 2.752 2.869 . 0 0 "[ . 1 . 2]" 1 1599 1 89 PHE H 1 141 PHE HZ 3.213 2.516 4.104 4.220 4.131 4.279 0.175 5 0 "[ . 1 . 2]" 1 1600 1 89 PHE HA 1 89 PHE HB2 2.191 . 2.728 2.525 2.506 2.540 . 0 0 "[ . 1 . 2]" 1 1601 1 89 PHE HA 1 89 PHE QD 2.952 2.372 3.675 3.075 3.032 3.113 . 0 0 "[ . 1 . 2]" 1 1602 1 89 PHE HA 1 90 ARG H 3.013 2.695 3.889 3.539 3.526 3.556 . 0 0 "[ . 1 . 2]" 1 1603 1 89 PHE HA 1 92 PHE H . 3.456 4.345 3.509 3.440 3.566 0.016 15 0 "[ . 1 . 2]" 1 1604 1 89 PHE HA 1 92 PHE QB 3.257 2.617 4.055 2.712 2.602 2.873 0.015 16 0 "[ . 1 . 2]" 1 1605 1 89 PHE HA 1 92 PHE QD 3.560 2.860 4.432 3.089 2.887 3.233 . 0 0 "[ . 1 . 2]" 1 1606 1 89 PHE HA 1 93 ASP H 4.383 3.397 5.657 3.649 3.454 3.917 . 0 0 "[ . 1 . 2]" 1 1607 1 89 PHE HA 1 100 ILE MD 3.834 3.080 4.773 3.241 3.012 3.543 0.068 14 0 "[ . 1 . 2]" 1 1608 1 89 PHE HA 1 100 ILE MD 2.905 2.334 3.617 3.191 2.984 3.494 . 0 0 "[ . 1 . 2]" 1 1609 1 89 PHE HB2 1 90 ARG H 3.430 2.658 4.427 3.802 3.755 3.849 . 0 0 "[ . 1 . 2]" 1 1610 1 89 PHE HB3 1 90 ARG H 2.910 2.255 3.756 2.570 2.514 2.612 . 0 0 "[ . 1 . 2]" 1 1611 1 89 PHE QD 1 90 ARG H . 3.541 4.157 3.474 3.402 3.510 0.139 6 0 "[ . 1 . 2]" 1 1612 1 89 PHE QD 1 93 ASP H 5.232 4.055 6.753 4.086 3.984 4.228 0.071 13 0 "[ . 1 . 2]" 1 1613 1 89 PHE QD 1 100 ILE MD 4.352 3.297 5.418 3.143 3.058 3.262 0.239 17 0 "[ . 1 . 2]" 1 1614 1 89 PHE QD 1 100 ILE MD 3.316 2.597 4.235 3.108 3.025 3.227 . 0 0 "[ . 1 . 2]" 1 1615 1 89 PHE QD 1 137 ASN H 5.130 3.976 6.621 6.723 6.624 6.816 0.195 17 0 "[ . 1 . 2]" 1 1616 1 89 PHE QD 1 138 TYR QD 3.071 2.617 3.922 3.506 3.286 3.722 . 0 0 "[ . 1 . 2]" 1 1617 1 89 PHE QD 1 138 TYR QE 3.006 2.617 3.839 3.083 2.964 3.162 . 0 0 "[ . 1 . 2]" 1 1618 1 89 PHE QD 1 141 PHE QD 2.751 2.315 3.514 2.356 2.271 2.480 0.044 18 0 "[ . 1 . 2]" 1 1619 1 89 PHE QD 1 141 PHE QE 3.592 2.813 4.588 3.606 3.511 3.748 . 0 0 "[ . 1 . 2]" 1 1620 1 89 PHE QE 1 137 ASN HA 3.186 2.560 3.966 2.742 2.556 2.933 0.004 10 0 "[ . 1 . 2]" 1 1621 1 89 PHE QE 1 138 TYR QD 3.321 2.601 4.242 3.382 3.262 3.456 . 0 0 "[ . 1 . 2]" 1 1622 1 89 PHE QE 1 100 ILE MD 3.872 2.911 4.821 2.782 2.521 2.867 0.390 10 0 "[ . 1 . 2]" 1 1623 1 89 PHE QE 1 98 GLY H 4.208 3.261 5.431 3.457 3.239 3.662 0.022 15 0 "[ . 1 . 2]" 1 1624 1 89 PHE QE 1 98 GLY HA2 3.147 2.529 4.118 2.672 2.582 2.846 . 0 0 "[ . 1 . 2]" 1 1625 1 89 PHE QE 1 98 GLY HA3 3.334 2.679 4.351 3.606 3.502 3.705 . 0 0 "[ . 1 . 2]" 1 1626 1 89 PHE QE 1 100 ILE H 3.481 2.698 4.493 3.749 3.679 3.863 . 0 0 "[ . 1 . 2]" 1 1627 1 89 PHE QE 1 100 ILE H 3.551 2.781 4.535 4.127 4.002 4.316 . 0 0 "[ . 1 . 2]" 1 1628 1 89 PHE QE 1 100 ILE MD 3.167 2.480 4.045 2.750 2.512 2.831 . 0 0 "[ . 1 . 2]" 1 1629 1 89 PHE QE 1 138 TYR H 3.500 2.713 4.517 3.343 3.011 3.605 . 0 0 "[ . 1 . 2]" 1 1630 1 89 PHE QE 1 138 TYR HA 3.266 2.624 4.066 2.926 2.586 3.126 0.038 7 0 "[ . 1 . 2]" 1 1631 1 89 PHE QE 1 138 TYR QD 3.334 2.611 4.258 3.735 3.605 3.821 . 0 0 "[ . 1 . 2]" 1 1632 1 89 PHE QE 1 138 TYR QE 3.334 2.907 4.258 2.997 2.869 3.101 0.038 3 0 "[ . 1 . 2]" 1 1633 1 89 PHE QE 1 141 PHE H 3.613 2.800 4.663 3.839 3.725 3.922 . 0 0 "[ . 1 . 2]" 1 1634 1 89 PHE HZ 1 100 ILE H 2.812 2.202 3.592 3.725 3.674 3.800 0.208 7 0 "[ . 1 . 2]" 1 1635 1 89 PHE HZ 1 100 ILE MD 3.061 2.397 3.910 3.419 2.508 3.728 . 0 0 "[ . 1 . 2]" 1 1636 1 89 PHE HZ 1 138 TYR QD 2.989 2.341 3.818 3.867 3.726 3.944 0.126 15 0 "[ . 1 . 2]" 1 1637 1 89 PHE HZ 1 138 TYR QE 3.133 2.454 4.002 3.975 3.817 4.090 0.088 19 0 "[ . 1 . 2]" 1 1638 1 90 ARG H 1 90 ARG HA 2.978 2.736 3.844 2.859 2.849 2.879 . 0 0 "[ . 1 . 2]" 1 1639 1 90 ARG H 1 90 ARG QB 2.348 . 3.030 2.221 2.067 2.276 . 0 0 "[ . 1 . 2]" 1 1640 1 90 ARG H 1 90 ARG HG2 3.475 2.693 4.485 4.129 3.062 4.486 0.001 19 0 "[ . 1 . 2]" 1 1641 1 90 ARG H 1 91 VAL H 2.989 2.434 3.858 2.703 2.645 2.743 . 0 0 "[ . 1 . 2]" 1 1642 1 90 ARG H 1 91 VAL MG1 4.199 3.254 5.420 5.632 5.596 5.668 0.248 1 0 "[ . 1 . 2]" 1 1643 1 90 ARG H 1 91 VAL MG2 6.052 4.691 7.811 5.129 5.028 5.245 . 0 0 "[ . 1 . 2]" 1 1644 1 90 ARG H 1 92 PHE H 4.128 3.392 5.328 4.190 4.153 4.232 . 0 0 "[ . 1 . 2]" 1 1645 1 90 ARG HA 1 90 ARG QB 2.767 2.223 3.445 2.357 2.347 2.422 . 0 0 "[ . 1 . 2]" 1 1646 1 90 ARG HA 1 90 ARG QD 4.500 3.615 5.602 4.126 4.110 4.162 . 0 0 "[ . 1 . 2]" 1 1647 1 90 ARG HA 1 90 ARG HE 2.508 . 3.237 3.458 3.425 3.576 0.339 7 0 "[ . 1 . 2]" 1 1648 1 90 ARG HA 1 90 ARG HG2 3.626 2.913 4.514 2.998 2.387 3.238 0.526 7 1 "[ . + 1 . 2]" 1 1649 1 90 ARG HA 1 91 VAL H 3.341 2.589 4.312 3.561 3.544 3.572 . 0 0 "[ . 1 . 2]" 1 1650 1 90 ARG HA 1 92 PHE H 4.816 3.733 6.216 4.595 4.509 4.726 . 0 0 "[ . 1 . 2]" 1 1651 1 90 ARG HA 1 93 ASP H 2.919 2.911 3.768 3.711 3.595 3.808 0.040 19 0 "[ . 1 . 2]" 1 1652 1 90 ARG HA 1 93 ASP HB2 4.921 3.954 6.126 4.388 4.115 4.746 . 0 0 "[ . 1 . 2]" 1 1653 1 90 ARG HA 1 93 ASP HB3 3.784 3.040 4.711 3.157 3.017 3.396 0.023 2 0 "[ . 1 . 2]" 1 1654 1 90 ARG QB 1 90 ARG HE 2.184 . 2.819 2.065 1.979 2.433 . 0 0 "[ . 1 . 2]" 1 1655 1 90 ARG QB 1 91 VAL H 3.256 2.524 4.202 2.593 2.571 2.622 . 0 0 "[ . 1 . 2]" 1 1656 1 90 ARG QB 1 91 VAL HA 4.536 3.644 5.647 3.909 3.840 3.973 . 0 0 "[ . 1 . 2]" 1 1657 1 90 ARG QD 1 90 ARG HE 1.834 . 2.367 2.522 2.520 2.526 0.159 7 0 "[ . 1 . 2]" 1 1658 1 90 ARG QD 1 91 VAL H 4.211 3.264 5.435 4.832 4.466 5.046 . 0 0 "[ . 1 . 2]" 1 1659 1 90 ARG HE 1 90 ARG HG2 2.646 2.051 3.415 3.196 2.360 3.553 0.138 9 0 "[ . 1 . 2]" 1 1660 1 90 ARG HG2 1 91 VAL H 4.418 3.424 5.702 4.047 3.698 4.907 . 0 0 "[ . 1 . 2]" 1 1661 1 91 VAL H 1 91 VAL HA 3.222 2.497 3.732 2.884 2.865 2.910 . 0 0 "[ . 1 . 2]" 1 1662 1 91 VAL H 1 91 VAL HB 2.320 . 2.994 2.149 2.136 2.173 . 0 0 "[ . 1 . 2]" 1 1663 1 91 VAL H 1 91 VAL MG1 2.562 2.398 3.307 3.528 3.479 3.557 0.250 7 0 "[ . 1 . 2]" 1 1664 1 91 VAL H 1 91 VAL MG2 3.493 3.316 4.508 3.056 2.999 3.139 0.317 7 0 "[ . 1 . 2]" 1 1665 1 91 VAL H 1 92 PHE H 2.911 2.256 3.525 2.561 2.484 2.631 . 0 0 "[ . 1 . 2]" 1 1666 1 91 VAL HA 1 91 VAL HB 3.171 2.548 3.948 2.955 2.933 2.966 . 0 0 "[ . 1 . 2]" 1 1667 1 91 VAL HA 1 91 VAL MG1 2.507 2.128 3.121 2.763 2.729 2.825 . 0 0 "[ . 1 . 2]" 1 1668 1 91 VAL HA 1 91 VAL MG2 2.722 2.487 3.389 2.192 2.171 2.215 0.316 19 0 "[ . 1 . 2]" 1 1669 1 91 VAL HA 1 92 PHE H 4.225 3.275 4.733 3.561 3.553 3.569 . 0 0 "[ . 1 . 2]" 1 1670 1 91 VAL HA 1 93 ASP H 4.953 3.839 6.393 4.609 4.490 4.720 . 0 0 "[ . 1 . 2]" 1 1671 1 91 VAL HB 1 92 PHE H 3.062 2.373 3.952 2.968 2.919 3.080 . 0 0 "[ . 1 . 2]" 1 1672 1 91 VAL MG1 1 92 PHE H 3.616 2.976 4.667 2.740 2.706 2.770 0.270 3 0 "[ . 1 . 2]" 1 1673 1 91 VAL MG1 2 5 PHE QB 6.000 5.000 105.000 6.007 5.011 7.003 . 0 0 "[ . 1 . 2]" 1 1674 1 91 VAL MG1 2 5 PHE QE 6.000 5.000 105.000 6.220 4.865 8.132 0.135 1 0 "[ . 1 . 2]" 1 1675 1 91 VAL MG2 1 92 PHE H 3.903 3.025 5.038 4.211 4.190 4.252 . 0 0 "[ . 1 . 2]" 1 1676 1 91 VAL MG2 1 92 PHE H 4.506 3.220 5.610 4.052 4.023 4.111 . 0 0 "[ . 1 . 2]" 1 1677 1 91 VAL MG2 1 92 PHE HA 4.596 3.693 5.722 5.260 5.223 5.283 . 0 0 "[ . 1 . 2]" 1 1678 1 91 VAL MG2 1 108 VAL MG1 4.029 3.237 5.016 4.877 4.769 4.994 . 0 0 "[ . 1 . 2]" 1 1679 1 91 VAL MG2 1 108 VAL MG2 3.647 2.930 4.674 4.801 4.656 4.893 0.219 3 0 "[ . 1 . 2]" 1 1680 1 91 VAL MG2 2 5 PHE QB 6.000 5.000 105.000 5.174 4.890 5.868 0.110 20 0 "[ . 1 . 2]" 1 1681 1 91 VAL MG2 2 5 PHE QE 6.000 5.000 105.000 6.276 4.956 8.032 0.044 1 0 "[ . 1 . 2]" 1 1682 1 92 PHE H 1 92 PHE HA 3.102 2.404 4.004 2.886 2.874 2.900 . 0 0 "[ . 1 . 2]" 1 1683 1 92 PHE H 1 92 PHE HA 2.947 2.368 3.669 2.493 2.446 2.551 . 0 0 "[ . 1 . 2]" 1 1684 1 92 PHE H 1 92 PHE QB 2.965 2.298 3.827 2.269 2.244 2.311 0.054 20 0 "[ . 1 . 2]" 1 1685 1 92 PHE H 1 92 PHE QD 3.910 3.030 5.047 2.797 2.724 2.856 0.306 18 0 "[ . 1 . 2]" 1 1686 1 92 PHE H 1 108 VAL MG2 4.315 3.467 5.372 3.791 3.644 3.917 . 0 0 "[ . 1 . 2]" 1 1687 1 92 PHE H 1 93 ASP H 2.886 2.237 3.237 2.619 2.581 2.670 . 0 0 "[ . 1 . 2]" 1 1688 1 92 PHE H 1 100 ILE MD 4.101 3.178 5.293 4.576 4.425 4.746 . 0 0 "[ . 1 . 2]" 1 1689 1 92 PHE H 1 108 VAL MG1 3.938 3.052 5.083 5.225 5.080 5.300 0.217 3 0 "[ . 1 . 2]" 1 1690 1 92 PHE HA 1 92 PHE QB 2.717 2.183 3.383 2.472 2.452 2.486 . 0 0 "[ . 1 . 2]" 1 1691 1 92 PHE HA 1 92 PHE QD 3.608 2.899 4.492 2.728 2.645 2.829 0.254 5 0 "[ . 1 . 2]" 1 1692 1 92 PHE HA 1 93 ASP H 3.504 2.779 4.306 3.569 3.559 3.579 . 0 0 "[ . 1 . 2]" 1 1693 1 92 PHE HA 1 94 LYS H 4.236 3.283 5.467 4.540 4.418 4.673 . 0 0 "[ . 1 . 2]" 1 1694 1 92 PHE HA 1 100 ILE MD 4.498 3.614 5.600 5.046 4.810 5.456 . 0 0 "[ . 1 . 2]" 1 1695 1 92 PHE HA 1 100 ILE MG 2.607 2.095 3.246 3.311 3.198 3.410 0.164 9 0 "[ . 1 . 2]" 1 1696 1 92 PHE HA 1 108 VAL MG1 3.413 2.742 4.249 3.377 3.250 3.469 . 0 0 "[ . 1 . 2]" 1 1697 1 92 PHE HA 1 108 VAL MG2 4.318 3.169 5.376 2.978 2.899 3.040 0.270 9 0 "[ . 1 . 2]" 1 1698 1 92 PHE QB 1 93 ASP H 2.996 2.322 3.867 2.687 2.622 2.716 . 0 0 "[ . 1 . 2]" 1 1699 1 92 PHE QB 1 100 ILE MD 3.341 2.684 4.159 2.722 2.557 3.248 0.127 15 0 "[ . 1 . 2]" 1 1700 1 92 PHE QB 1 100 ILE MG 3.238 2.602 4.031 2.730 2.513 3.107 0.089 20 0 "[ . 1 . 2]" 1 1701 1 92 PHE QR 1 105 LEU HA 3.352 2.693 4.173 3.625 3.338 4.179 0.006 3 0 "[ . 1 . 2]" 1 1702 1 92 PHE QR 1 105 LEU QD . 4.120 5.342 3.457 3.275 3.707 0.845 10 18 "[** -*****+****.*****]" 1 1703 1 92 PHE QR 1 108 VAL MG1 4.779 3.237 5.950 3.018 2.931 3.072 0.306 20 0 "[ . 1 . 2]" 1 1704 1 92 PHE QR 1 109 MET ME 5.825 4.680 7.252 5.399 4.846 6.703 . 0 0 "[ . 1 . 2]" 1 1705 1 92 PHE QR 1 141 PHE HZ 2.811 2.202 3.841 3.261 2.626 3.902 0.061 19 0 "[ . 1 . 2]" 1 1706 1 92 PHE QR 2 16 VAL MG1 5.690 4.572 7.084 6.856 6.289 7.186 0.102 10 0 "[ . 1 . 2]" 1 1707 1 92 PHE QD 1 93 ASP H . 4.386 5.292 4.515 4.411 4.566 . 0 0 "[ . 1 . 2]" 1 1708 1 92 PHE QD 1 100 ILE MD 5.442 4.262 6.951 3.985 3.854 4.072 0.408 19 0 "[ . 1 . 2]" 1 1709 1 92 PHE QD 1 100 ILE MG 4.624 3.515 5.757 4.023 3.664 4.486 . 0 0 "[ . 1 . 2]" 1 1710 1 92 PHE QD 1 105 LEU H 5.759 4.463 7.433 6.026 5.586 6.789 . 0 0 "[ . 1 . 2]" 1 1711 1 92 PHE QD 1 109 MET H 4.805 3.724 6.202 5.566 5.365 5.941 . 0 0 "[ . 1 . 2]" 1 1712 1 92 PHE QE 1 100 ILE MG 4.703 3.574 5.858 5.444 5.117 5.883 0.025 15 0 "[ . 1 . 2]" 1 1713 1 93 ASP H 1 93 ASP HA 2.844 2.204 3.671 2.931 2.915 2.954 . 0 0 "[ . 1 . 2]" 1 1714 1 93 ASP H 1 93 ASP HB2 2.546 . 3.286 2.575 2.501 2.717 . 0 0 "[ . 1 . 2]" 1 1715 1 93 ASP H 1 93 ASP HB3 2.458 . 3.172 2.643 2.563 2.701 . 0 0 "[ . 1 . 2]" 1 1716 1 93 ASP H 1 94 LYS H 3.394 2.630 4.381 4.024 3.988 4.057 . 0 0 "[ . 1 . 2]" 1 1717 1 93 ASP H 1 100 ILE MD 3.134 2.429 4.045 3.368 3.213 3.579 . 0 0 "[ . 1 . 2]" 1 1718 1 93 ASP H 1 100 ILE MG 4.031 3.124 5.581 4.694 4.332 4.979 . 0 0 "[ . 1 . 2]" 1 1719 1 93 ASP HA 1 94 LYS H 2.528 . 3.263 2.335 2.275 2.374 . 0 0 "[ . 1 . 2]" 1 1720 1 93 ASP HA 1 100 ILE MG 4.376 3.516 5.448 3.545 3.394 3.979 0.122 9 0 "[ . 1 . 2]" 1 1721 1 93 ASP HA 1 101 SER H 2.985 2.313 3.853 2.924 2.795 3.611 . 0 0 "[ . 1 . 2]" 1 1722 1 93 ASP HB2 1 100 ILE H 2.707 2.098 3.494 2.664 2.301 3.621 0.127 10 0 "[ . 1 . 2]" 1 1723 1 93 ASP HB2 1 101 SER H 4.305 3.337 5.856 4.634 3.987 4.895 . 0 0 "[ . 1 . 2]" 1 1724 1 93 ASP HB3 1 94 LYS H 3.351 2.597 4.325 3.383 3.008 4.234 . 0 0 "[ . 1 . 2]" 1 1725 1 93 ASP HB3 1 96 GLY H 4.674 3.622 6.033 3.736 3.617 4.012 0.005 12 0 "[ . 1 . 2]" 1 1726 1 93 ASP HB3 1 100 ILE MD 4.040 3.246 5.030 4.510 3.422 5.102 0.072 18 0 "[ . 1 . 2]" 1 1727 1 94 LYS H 1 94 LYS HA 2.856 2.418 3.686 2.871 2.852 2.918 . 0 0 "[ . 1 . 2]" 1 1728 1 94 LYS H 1 94 LYS QB 2.421 . 3.125 2.299 2.261 2.513 . 0 0 "[ . 1 . 2]" 1 1729 1 94 LYS H 1 94 LYS QG 3.122 2.420 4.029 3.751 2.215 4.016 0.205 5 0 "[ . 1 . 2]" 1 1730 1 94 LYS H 1 95 ASP H 3.223 2.498 4.160 2.722 2.530 2.821 . 0 0 "[ . 1 . 2]" 1 1731 1 94 LYS H 1 95 ASP H 2.675 . 3.453 2.394 2.293 2.455 . 0 0 "[ . 1 . 2]" 1 1732 1 94 LYS H 1 95 ASP HB2 3.676 2.849 4.745 3.555 3.079 4.733 . 0 0 "[ . 1 . 2]" 1 1733 1 94 LYS H 1 100 ILE HA 3.743 2.901 4.994 5.155 5.013 5.288 0.294 3 0 "[ . 1 . 2]" 1 1734 1 94 LYS H 1 100 ILE MD 4.886 3.787 6.306 4.701 4.262 5.126 . 0 0 "[ . 1 . 2]" 1 1735 1 94 LYS H 1 100 ILE MG 4.313 3.343 5.567 4.593 4.357 5.054 . 0 0 "[ . 1 . 2]" 1 1736 1 94 LYS H 1 101 SER H 5.250 4.069 6.737 5.659 5.407 5.973 . 0 0 "[ . 1 . 2]" 1 1737 1 94 LYS H 1 104 GLU HA 4.131 3.202 5.332 5.007 4.764 5.368 0.036 1 0 "[ . 1 . 2]" 1 1738 1 94 LYS H 1 104 GLU HB2 3.469 2.689 4.477 3.759 2.776 4.399 . 0 0 "[ . 1 . 2]" 1 1739 1 94 LYS HA 1 94 LYS QB 2.540 2.041 3.162 2.337 2.181 2.369 . 0 0 "[ . 1 . 2]" 1 1740 1 94 LYS HA 1 94 LYS QD 3.494 2.807 4.350 4.023 3.920 4.266 . 0 0 "[ . 1 . 2]" 1 1741 1 94 LYS HA 1 94 LYS QG 3.381 2.716 4.209 2.576 2.414 3.339 0.302 9 0 "[ . 1 . 2]" 1 1742 1 94 LYS HA 1 95 ASP H 3.337 3.246 4.307 3.557 3.464 3.590 . 0 0 "[ . 1 . 2]" 1 1743 1 94 LYS QB 1 95 ASP H 2.937 2.276 3.791 2.737 2.503 3.666 . 0 0 "[ . 1 . 2]" 1 1744 1 94 LYS QB 1 96 GLY H 4.110 3.185 5.305 4.740 4.614 5.098 . 0 0 "[ . 1 . 2]" 1 1745 1 94 LYS HE2 1 108 VAL MG2 5.347 4.296 6.657 4.660 4.458 4.773 . 0 0 "[ . 1 . 2]" 1 1746 1 95 ASP H 1 95 ASP HA 2.845 2.205 3.672 2.870 2.860 2.880 . 0 0 "[ . 1 . 2]" 1 1747 1 95 ASP H 1 95 ASP HB2 2.856 2.213 3.686 3.024 2.380 3.551 . 0 0 "[ . 1 . 2]" 1 1748 1 95 ASP H 1 95 ASP HB3 3.173 2.459 4.095 3.071 2.613 3.616 . 0 0 "[ . 1 . 2]" 1 1749 1 95 ASP H 1 96 GLY H 2.403 . 3.102 2.658 2.619 2.700 . 0 0 "[ . 1 . 2]" 1 1750 1 95 ASP H 1 96 GLY QA 3.522 2.730 4.546 4.559 4.533 4.588 0.042 9 0 "[ . 1 . 2]" 1 1751 1 95 ASP H 1 101 SER H 5.665 4.391 7.312 5.486 5.352 5.689 . 0 0 "[ . 1 . 2]" 1 1752 1 95 ASP H 1 104 GLU HG2 4.440 3.441 5.731 3.805 3.358 5.146 0.083 12 0 "[ . 1 . 2]" 1 1753 1 95 ASP HA 1 96 GLY H 3.207 2.486 4.139 3.515 3.503 3.532 . 0 0 "[ . 1 . 2]" 1 1754 1 95 ASP HB2 1 96 GLY H 3.588 2.781 4.631 3.451 2.846 3.969 . 0 0 "[ . 1 . 2]" 1 1755 1 95 ASP HB3 1 96 GLY H 4.161 3.225 5.371 3.994 3.753 4.203 . 0 0 "[ . 1 . 2]" 1 1756 1 96 GLY H 1 96 GLY HA2 2.486 . 3.095 2.359 2.350 2.371 . 0 0 "[ . 1 . 2]" 1 1757 1 96 GLY H 1 96 GLY QA 2.162 . 2.790 2.262 2.254 2.273 . 0 0 "[ . 1 . 2]" 1 1758 1 96 GLY H 1 96 GLY HA3 2.505 2.013 3.119 2.908 2.899 2.921 . 0 0 "[ . 1 . 2]" 1 1759 1 96 GLY H 1 97 ASN H 2.723 2.417 3.514 2.537 2.497 2.581 . 0 0 "[ . 1 . 2]" 1 1760 1 96 GLY H 1 98 GLY H 4.009 3.190 5.174 3.809 3.666 3.888 . 0 0 "[ . 1 . 2]" 1 1761 1 96 GLY H 1 98 GLY HA2 5.019 3.890 6.478 5.798 5.605 5.904 . 0 0 "[ . 1 . 2]" 1 1762 1 96 GLY QA 1 97 ASN H 3.073 2.382 3.966 2.928 2.919 2.949 . 0 0 "[ . 1 . 2]" 1 1763 1 96 GLY QA 1 98 GLY H 3.568 2.765 4.605 2.971 2.891 3.088 . 0 0 "[ . 1 . 2]" 1 1764 1 96 GLY HA2 1 97 ASN H 3.567 2.866 4.441 3.183 3.147 3.268 . 0 0 "[ . 1 . 2]" 1 1765 1 96 GLY HA3 1 97 ASN H 3.907 3.139 4.864 3.422 3.348 3.459 . 0 0 "[ . 1 . 2]" 1 1766 1 97 ASN H 1 97 ASN HB2 3.111 2.411 4.015 3.645 3.634 3.658 . 0 0 "[ . 1 . 2]" 1 1767 1 97 ASN H 1 97 ASN HB3 3.281 2.543 4.235 2.698 2.662 2.758 . 0 0 "[ . 1 . 2]" 1 1768 1 97 ASN H 1 97 ASN HD21 4.104 3.181 5.297 4.422 4.385 4.484 . 0 0 "[ . 1 . 2]" 1 1769 1 97 ASN H 1 97 ASN HD22 4.937 3.826 5.691 4.254 4.178 4.334 . 0 0 "[ . 1 . 2]" 1 1770 1 97 ASN H 1 98 GLY H 2.953 2.289 3.367 2.556 2.533 2.602 . 0 0 "[ . 1 . 2]" 1 1771 1 97 ASN H 1 98 GLY HA3 4.099 3.177 5.290 5.268 5.248 5.305 0.015 6 0 "[ . 1 . 2]" 1 1772 1 97 ASN H 1 99 TYR H 3.872 3.001 4.997 3.583 3.521 3.675 . 0 0 "[ . 1 . 2]" 1 1773 1 97 ASN HA 1 98 GLY H 3.600 2.790 4.646 3.320 3.293 3.354 . 0 0 "[ . 1 . 2]" 1 1774 1 97 ASN HB2 1 97 ASN HD21 2.580 . 3.330 2.514 2.467 2.558 . 0 0 "[ . 1 . 2]" 1 1775 1 97 ASN HB2 1 97 ASN HD22 2.885 2.236 3.724 3.618 3.598 3.638 . 0 0 "[ . 1 . 2]" 1 1776 1 97 ASN HB2 1 98 GLY H 4.143 3.211 5.347 4.212 4.131 4.257 . 0 0 "[ . 1 . 2]" 1 1777 1 97 ASN HB2 1 99 TYR H 4.598 3.564 5.935 3.652 3.501 3.794 0.063 1 0 "[ . 1 . 2]" 1 1778 1 97 ASN HB3 1 97 ASN HD21 2.479 . 3.199 2.811 2.774 2.865 . 0 0 "[ . 1 . 2]" 1 1779 1 97 ASN HB3 1 97 ASN HD22 2.703 2.095 3.489 3.710 3.694 3.732 0.243 14 0 "[ . 1 . 2]" 1 1780 1 97 ASN HB3 1 98 GLY H 2.414 . 3.116 2.393 2.383 2.402 . 0 0 "[ . 1 . 2]" 1 1781 1 97 ASN HD21 1 99 TYR H 5.254 4.072 5.866 4.011 3.944 4.083 0.128 4 0 "[ . 1 . 2]" 1 1782 1 97 ASN HD21 1 99 TYR QB 3.172 2.458 4.094 3.039 2.919 3.195 . 0 0 "[ . 1 . 2]" 1 1783 1 97 ASN HD21 1 99 TYR QD 3.685 2.916 4.755 3.959 3.219 4.699 . 0 0 "[ . 1 . 2]" 1 1784 1 97 ASN HD21 1 99 TYR QE 5.263 4.122 6.722 5.982 5.247 6.689 . 0 0 "[ . 1 . 2]" 1 1785 1 97 ASN HD21 1 135 GLN HB3 4.071 3.155 5.254 5.537 5.436 5.630 0.376 15 0 "[ . 1 . 2]" 1 1786 1 97 ASN HD22 1 99 TYR H 4.735 3.670 6.111 3.391 3.341 3.456 0.329 5 0 "[ . 1 . 2]" 1 1787 1 97 ASN HD22 1 99 TYR QB 3.035 2.352 3.917 2.593 2.339 2.866 0.013 18 0 "[ . 1 . 2]" 1 1788 1 97 ASN HD22 1 99 TYR QD 3.812 2.954 4.920 4.206 3.639 4.801 . 0 0 "[ . 1 . 2]" 1 1789 1 98 GLY H 1 98 GLY HA2 2.338 . 2.911 2.405 2.394 2.414 . 0 0 "[ . 1 . 2]" 1 1790 1 98 GLY H 1 98 GLY HA3 2.578 . 3.099 2.960 2.950 2.968 . 0 0 "[ . 1 . 2]" 1 1791 1 98 GLY H 1 99 TYR H 2.369 2.041 3.058 2.367 2.252 2.432 . 0 0 "[ . 1 . 2]" 1 1792 1 98 GLY H 1 99 TYR QB 4.110 3.185 5.305 4.865 4.768 4.942 . 0 0 "[ . 1 . 2]" 1 1793 1 98 GLY HA2 1 99 TYR H 3.281 2.543 3.614 3.255 3.208 3.302 . 0 0 "[ . 1 . 2]" 1 1794 1 98 GLY HA3 1 99 TYR H 3.430 2.658 3.813 3.244 3.171 3.298 . 0 0 "[ . 1 . 2]" 1 1795 1 99 TYR H 1 99 TYR HA 3.401 2.636 4.390 2.968 2.962 2.977 . 0 0 "[ . 1 . 2]" 1 1796 1 99 TYR H 1 99 TYR QB 2.701 2.093 3.486 2.729 2.614 2.831 . 0 0 "[ . 1 . 2]" 1 1797 1 99 TYR H 1 99 TYR QD 3.733 2.893 4.307 2.760 2.714 2.801 0.179 3 0 "[ . 1 . 2]" 1 1798 1 99 TYR H 1 99 TYR QE 4.377 3.428 5.590 4.813 4.650 4.972 . 0 0 "[ . 1 . 2]" 1 1799 1 99 TYR H 1 100 ILE H 4.428 3.432 5.147 4.367 4.329 4.394 . 0 0 "[ . 1 . 2]" 1 1800 1 99 TYR H 1 135 GLN HB2 4.852 3.760 6.262 6.396 6.320 6.523 0.261 18 0 "[ . 1 . 2]" 1 1801 1 99 TYR H 1 137 ASN HA 6.087 4.718 7.856 5.476 5.067 5.752 . 0 0 "[ . 1 . 2]" 1 1802 1 99 TYR HA 1 99 TYR QB 2.261 . 2.815 2.376 2.334 2.423 . 0 0 "[ . 1 . 2]" 1 1803 1 99 TYR HA 1 99 TYR QD 4.099 3.210 5.088 3.091 3.022 3.146 0.188 16 0 "[ . 1 . 2]" 1 1804 1 99 TYR HA 1 100 ILE H 2.212 . 2.753 2.282 2.236 2.315 . 0 0 "[ . 1 . 2]" 1 1805 1 99 TYR HA 1 136 VAL H 3.691 2.861 4.764 4.686 4.329 4.825 0.061 11 0 "[ . 1 . 2]" 1 1806 1 99 TYR HA 1 137 ASN H 3.854 2.987 5.274 5.091 4.752 5.297 0.023 12 0 "[ . 1 . 2]" 1 1807 1 99 TYR HA 1 137 ASN HA 2.397 2.014 2.984 2.715 2.393 3.018 0.034 12 0 "[ . 1 . 2]" 1 1808 1 99 TYR HA 1 138 TYR H 4.697 3.640 6.062 4.712 4.458 4.927 . 0 0 "[ . 1 . 2]" 1 1809 1 99 TYR QB 1 99 TYR QD 3.076 2.409 3.929 2.162 2.159 2.168 0.250 18 0 "[ . 1 . 2]" 1 1810 1 99 TYR QB 1 100 ILE H 2.632 2.040 3.397 2.961 2.849 3.086 . 0 0 "[ . 1 . 2]" 1 1811 1 99 TYR QB 1 135 GLN HE21 4.234 3.282 5.465 4.057 3.897 4.193 . 0 0 "[ . 1 . 2]" 1 1812 1 99 TYR QB 1 135 GLN HE22 4.282 3.319 5.527 3.852 3.637 3.958 . 0 0 "[ . 1 . 2]" 1 1813 1 99 TYR QB 1 136 VAL H 3.613 2.800 4.663 3.804 3.362 4.118 . 0 0 "[ . 1 . 2]" 1 1814 1 99 TYR QD 1 100 ILE H 3.134 2.455 4.203 4.306 4.213 4.378 0.175 16 0 "[ . 1 . 2]" 1 1815 1 99 TYR QD 1 135 GLN HE21 4.993 3.870 5.042 5.079 5.008 5.136 0.094 1 0 "[ . 1 . 2]" 1 1816 1 99 TYR QD 1 135 GLN HE22 5.070 3.929 5.148 5.046 4.487 5.195 0.047 5 0 "[ . 1 . 2]" 1 1817 1 99 TYR QD 1 136 VAL H 4.862 3.768 6.275 4.684 4.181 5.097 . 0 0 "[ . 1 . 2]" 1 1818 1 99 TYR QD 1 136 VAL HA 4.510 3.532 5.760 5.012 4.568 5.375 . 0 0 "[ . 1 . 2]" 1 1819 1 99 TYR QD 1 137 ASN H 3.897 3.059 5.030 3.552 3.482 3.602 . 0 0 "[ . 1 . 2]" 1 1820 1 99 TYR QD 1 137 ASN HA . 3.619 3.836 3.468 3.338 3.655 0.281 7 0 "[ . 1 . 2]" 1 1821 1 99 TYR QD 1 137 ASN QB 3.571 2.797 4.561 3.023 2.768 3.337 0.029 18 0 "[ . 1 . 2]" 1 1822 1 99 TYR QD 1 137 ASN HD21 4.079 3.195 5.210 4.662 4.198 5.054 . 0 0 "[ . 1 . 2]" 1 1823 1 99 TYR QD 1 138 TYR H 3.852 3.017 4.920 5.181 5.075 5.307 0.387 12 0 "[ . 1 . 2]" 1 1824 1 99 TYR QE 1 135 GLN HE21 4.670 3.657 5.965 6.009 5.916 6.074 0.109 1 0 "[ . 1 . 2]" 1 1825 1 99 TYR QE 1 135 GLN HE22 4.858 3.805 6.205 5.699 5.434 6.206 0.001 15 0 "[ . 1 . 2]" 1 1826 1 99 TYR QE 1 137 ASN H 5.021 3.932 6.413 5.467 4.824 5.932 . 0 0 "[ . 1 . 2]" 1 1827 1 99 TYR QE 1 137 ASN QB 4.130 3.234 5.275 3.019 2.912 3.116 0.322 15 0 "[ . 1 . 2]" 1 1828 1 99 TYR QE 1 137 ASN HD21 4.093 3.205 5.228 3.752 3.170 4.206 0.035 15 0 "[ . 1 . 2]" 1 1829 1 99 TYR QE 1 137 ASN HD22 3.245 2.515 4.188 3.706 2.853 4.284 0.096 10 0 "[ . 1 . 2]" 1 1830 1 99 TYR QE 1 138 TYR H 4.508 3.531 5.758 5.401 5.138 5.554 . 0 0 "[ . 1 . 2]" 1 1831 1 100 ILE H 1 100 ILE HA 3.210 2.488 4.143 2.977 2.964 2.987 . 0 0 "[ . 1 . 2]" 1 1832 1 100 ILE H 1 100 ILE HB 2.529 . 3.264 2.406 2.301 2.503 . 0 0 "[ . 1 . 2]" 1 1833 1 100 ILE H 1 100 ILE MD 2.546 . 3.286 3.023 2.293 3.242 . 0 0 "[ . 1 . 2]" 1 1834 1 100 ILE H 1 100 ILE MG 2.750 2.131 3.549 3.600 3.501 3.650 0.101 16 0 "[ . 1 . 2]" 1 1835 1 100 ILE H 1 101 SER H 3.772 3.057 4.868 4.526 4.472 4.584 . 0 0 "[ . 1 . 2]" 1 1836 1 100 ILE H 1 101 SER HA 3.418 2.649 4.412 4.547 4.476 4.606 0.194 17 0 "[ . 1 . 2]" 1 1837 1 100 ILE H 1 135 GLN HB2 3.867 2.997 4.991 4.670 4.459 4.983 . 0 0 "[ . 1 . 2]" 1 1838 1 100 ILE H 1 135 GLN HB3 3.371 2.613 4.351 3.672 3.486 3.874 . 0 0 "[ . 1 . 2]" 1 1839 1 100 ILE H 1 136 VAL H 2.766 2.392 3.570 3.116 2.889 3.213 . 0 0 "[ . 1 . 2]" 1 1840 1 100 ILE H 1 136 VAL HA 3.236 2.508 4.177 3.549 3.378 3.845 . 0 0 "[ . 1 . 2]" 1 1841 1 100 ILE H 1 136 VAL HB 2.862 2.218 3.694 3.349 3.129 3.538 . 0 0 "[ . 1 . 2]" 1 1842 1 100 ILE H 1 137 ASN H 5.302 4.109 6.843 5.005 4.831 5.226 . 0 0 "[ . 1 . 2]" 1 1843 1 100 ILE H 1 137 ASN QB 4.538 3.517 5.857 5.216 4.983 5.621 . 0 0 "[ . 1 . 2]" 1 1844 1 100 ILE H 1 138 TYR H 5.101 3.953 6.584 6.002 5.849 6.214 . 0 0 "[ . 1 . 2]" 1 1845 1 100 ILE HA 1 100 ILE MD 3.695 2.969 4.600 3.631 2.727 3.871 0.242 10 0 "[ . 1 . 2]" 1 1846 1 100 ILE HA 1 100 ILE MG 3.237 2.601 4.030 2.449 2.384 2.527 0.217 4 0 "[ . 1 . 2]" 1 1847 1 100 ILE HA 1 101 SER H 2.195 . 2.833 2.172 2.148 2.206 . 0 0 "[ . 1 . 2]" 1 1848 1 100 ILE HB 1 101 SER H 3.591 2.783 4.635 4.304 4.229 4.406 . 0 0 "[ . 1 . 2]" 1 1849 1 100 ILE HB 1 136 VAL H 3.142 2.435 4.055 3.433 3.190 3.626 . 0 0 "[ . 1 . 2]" 1 1850 1 100 ILE HB 1 136 VAL MG1 4.475 3.396 5.571 3.530 3.372 3.659 0.024 17 0 "[ . 1 . 2]" 1 1851 1 100 ILE HB 1 136 VAL MG2 4.686 3.765 5.834 3.682 3.616 3.745 0.149 12 0 "[ . 1 . 2]" 1 1852 1 100 ILE MD 1 101 SER H 3.108 2.409 4.311 4.304 4.195 4.406 0.095 5 0 "[ . 1 . 2]" 1 1853 1 100 ILE MD 1 105 LEU QD 5.341 4.291 6.649 3.547 3.285 4.313 1.006 11 19 [****.*-***+*********] 1 1854 1 100 ILE MD 1 136 VAL H 4.032 3.125 5.204 4.588 4.362 4.839 . 0 0 "[ . 1 . 2]" 1 1855 1 100 ILE MD 1 136 VAL MG1 3.622 2.710 4.509 2.799 2.593 3.348 0.117 13 0 "[ . 1 . 2]" 1 1856 1 100 ILE MD 1 136 VAL MG2 4.216 3.387 5.249 4.031 3.860 4.360 . 0 0 "[ . 1 . 2]" 1 1857 1 100 ILE MD 1 138 TYR H 5.003 3.878 6.457 5.446 4.884 5.763 . 0 0 "[ . 1 . 2]" 1 1858 1 100 ILE MD 1 138 TYR HA 3.591 2.885 4.471 4.252 4.195 4.333 . 0 0 "[ . 1 . 2]" 1 1859 1 100 ILE MD 1 144 MET ME 5.540 4.151 6.897 5.775 4.977 6.571 . 0 0 "[ . 1 . 2]" 1 1860 1 100 ILE MD 1 141 PHE H 4.842 3.753 6.250 5.182 4.894 5.537 . 0 0 "[ . 1 . 2]" 1 1861 1 100 ILE MD 1 100 ILE MG 2.851 2.091 3.549 2.218 1.919 3.171 0.172 17 0 "[ . 1 . 2]" 1 1862 1 100 ILE MD 1 141 PHE QD 4.783 3.643 5.955 3.739 3.450 4.370 0.193 13 0 "[ . 1 . 2]" 1 1863 1 100 ILE HG13 1 136 VAL MG2 4.774 3.836 5.944 5.670 5.397 6.094 0.150 5 0 "[ . 1 . 2]" 1 1864 1 100 ILE MG 1 101 SER H 2.628 2.037 3.392 2.717 2.562 2.994 . 0 0 "[ . 1 . 2]" 1 1865 1 100 ILE MG 1 104 GLU H 4.642 3.730 5.779 4.522 4.400 4.851 . 0 0 "[ . 1 . 2]" 1 1866 1 100 ILE MG 1 104 GLU H 3.785 2.934 4.885 4.475 4.359 4.793 . 0 0 "[ . 1 . 2]" 1 1867 1 100 ILE MG 1 104 GLU HB2 3.386 2.720 4.216 2.945 2.562 3.850 0.158 16 0 "[ . 1 . 2]" 1 1868 1 100 ILE MG 1 105 LEU H 3.935 3.162 4.899 3.611 3.387 3.842 . 0 0 "[ . 1 . 2]" 1 1869 1 100 ILE MG 1 105 LEU H 3.045 2.360 3.930 3.589 3.372 3.817 . 0 0 "[ . 1 . 2]" 1 1870 1 100 ILE MG 1 105 LEU HA 4.267 3.428 5.312 4.032 3.636 4.287 . 0 0 "[ . 1 . 2]" 1 1871 1 100 ILE MG 1 105 LEU HA 3.268 2.626 4.068 3.809 3.550 4.007 . 0 0 "[ . 1 . 2]" 1 1872 1 100 ILE MG 1 105 LEU HB2 3.693 2.967 4.598 3.072 2.755 3.401 0.212 15 0 "[ . 1 . 2]" 1 1873 1 100 ILE MG 1 105 LEU QD 3.792 3.047 4.721 2.186 1.800 2.800 1.247 10 15 "[ - .*** +**********]" 1 1874 1 101 SER H 1 101 SER HB2 2.855 2.213 3.685 3.644 2.579 3.714 0.029 6 0 "[ . 1 . 2]" 1 1875 1 101 SER H 1 101 SER HG 4.203 2.757 5.425 2.746 2.697 3.304 0.060 18 0 "[ . 1 . 2]" 1 1876 1 101 SER H 1 102 ALA H 3.751 3.189 4.841 4.546 4.519 4.584 . 0 0 "[ . 1 . 2]" 1 1877 1 101 SER H 1 103 ALA H 4.460 4.034 5.756 5.222 5.123 5.333 . 0 0 "[ . 1 . 2]" 1 1878 1 101 SER H 1 104 GLU H 3.114 2.920 4.019 3.881 3.748 4.149 0.130 16 0 "[ . 1 . 2]" 1 1879 1 101 SER H 1 104 GLU HB2 2.501 . 3.228 2.694 2.396 3.253 0.025 4 0 "[ . 1 . 2]" 1 1880 1 101 SER H 1 104 GLU HB3 2.928 2.269 3.779 3.619 2.613 4.054 0.275 16 0 "[ . 1 . 2]" 1 1881 1 101 SER H 1 104 GLU HG2 3.360 2.604 4.637 4.293 2.299 4.585 0.305 16 0 "[ . 1 . 2]" 1 1882 1 101 SER H 1 105 LEU H 3.817 3.274 4.927 4.690 4.588 4.859 . 0 0 "[ . 1 . 2]" 1 1883 1 101 SER HA 1 102 ALA H 2.339 . 3.019 2.396 2.362 2.458 . 0 0 "[ . 1 . 2]" 1 1884 1 101 SER HA 1 102 ALA MB 4.627 3.718 5.760 4.039 4.021 4.076 . 0 0 "[ . 1 . 2]" 1 1885 1 101 SER HA 1 103 ALA H 4.353 3.374 5.618 4.564 4.496 4.672 . 0 0 "[ . 1 . 2]" 1 1886 1 101 SER HA 1 104 GLU H 4.835 3.796 6.240 4.849 4.778 5.107 . 0 0 "[ . 1 . 2]" 1 1887 1 101 SER HA 1 125 ILE MD 4.148 3.333 5.164 3.445 3.286 3.746 0.047 13 0 "[ . 1 . 2]" 1 1888 1 101 SER HA 1 136 VAL H 2.252 . 2.907 2.415 2.343 2.604 . 0 0 "[ . 1 . 2]" 1 1889 1 101 SER HB2 1 102 ALA H 2.753 . 3.553 2.298 2.212 2.733 . 0 0 "[ . 1 . 2]" 1 1890 1 101 SER HB2 1 103 ALA H 2.812 2.179 3.629 2.634 2.593 2.732 . 0 0 "[ . 1 . 2]" 1 1891 1 101 SER HB2 1 104 GLU H 2.871 2.225 3.706 2.679 2.531 2.717 . 0 0 "[ . 1 . 2]" 1 1892 1 101 SER HB2 1 136 VAL H 5.235 4.057 6.757 6.681 6.444 6.832 0.075 9 0 "[ . 1 . 2]" 1 1893 1 101 SER HB3 1 102 ALA H 2.791 2.163 3.602 3.667 2.517 3.757 0.155 1 0 "[ . 1 . 2]" 1 1894 1 101 SER HB3 1 102 ALA MB 5.231 4.203 6.512 5.182 4.074 5.303 0.129 9 0 "[ . 1 . 2]" 1 1895 1 101 SER HB3 1 103 ALA H 3.967 3.075 5.120 4.576 3.372 4.696 . 0 0 "[ . 1 . 2]" 1 1896 1 101 SER HB3 1 103 ALA MB 5.533 4.446 6.888 4.989 4.260 5.083 0.186 9 0 "[ . 1 . 2]" 1 1897 1 101 SER HB3 1 104 GLU H 3.782 2.931 4.881 4.648 4.142 4.783 . 0 0 "[ . 1 . 2]" 1 1898 1 101 SER HG 1 102 ALA H 4.663 3.614 6.018 4.664 4.538 4.858 . 0 0 "[ . 1 . 2]" 1 1899 1 101 SER HG 1 103 ALA H 5.000 3.375 6.454 4.381 4.275 5.333 . 0 0 "[ . 1 . 2]" 1 1900 1 101 SER HG 1 103 ALA MB 5.214 4.189 6.491 4.179 4.101 5.335 0.088 8 0 "[ . 1 . 2]" 1 1901 1 101 SER HG 1 104 GLU H 4.354 2.774 5.620 3.551 3.364 5.038 . 0 0 "[ . 1 . 2]" 1 1902 1 102 ALA H 1 102 ALA HA 2.902 2.332 3.613 2.650 2.440 2.809 . 0 0 "[ . 1 . 2]" 1 1903 1 102 ALA H 1 102 ALA MB 2.230 . 2.878 2.067 2.042 2.109 . 0 0 "[ . 1 . 2]" 1 1904 1 102 ALA H 1 103 ALA H 2.939 2.616 3.793 2.857 2.791 2.950 . 0 0 "[ . 1 . 2]" 1 1905 1 102 ALA H 1 104 GLU H 3.971 3.078 5.125 4.294 4.263 4.438 . 0 0 "[ . 1 . 2]" 1 1906 1 102 ALA H 1 104 GLU HB2 5.690 4.410 7.344 5.094 4.787 5.837 . 0 0 "[ . 1 . 2]" 1 1907 1 102 ALA H 1 125 ILE MD 3.388 2.626 4.373 3.509 3.308 3.684 . 0 0 "[ . 1 . 2]" 1 1908 1 102 ALA H 1 135 GLN HB3 3.691 2.861 4.764 4.918 4.711 5.050 0.286 14 0 "[ . 1 . 2]" 1 1909 1 102 ALA HA 1 103 ALA H 3.809 3.110 4.819 3.593 3.576 3.609 . 0 0 "[ . 1 . 2]" 1 1910 1 102 ALA HA 1 105 LEU H 3.214 3.043 4.148 3.391 3.269 3.565 . 0 0 "[ . 1 . 2]" 1 1911 1 102 ALA HA 1 105 LEU HB3 2.979 2.393 3.709 3.769 3.243 4.036 0.327 14 0 "[ . 1 . 2]" 1 1912 1 102 ALA HA 1 121 VAL MG1 3.218 3.191 4.006 3.417 3.212 3.685 . 0 0 "[ . 1 . 2]" 1 1913 1 102 ALA HA 1 125 ILE MD 3.412 2.741 4.248 3.158 2.787 3.473 . 0 0 "[ . 1 . 2]" 1 1914 1 102 ALA HA 1 125 ILE MD 2.987 2.400 3.829 3.143 2.774 3.454 . 0 0 "[ . 1 . 2]" 1 1915 1 102 ALA MB 1 103 ALA H 3.523 2.631 4.386 2.704 2.630 2.754 0.001 4 0 "[ . 1 . 2]" 1 1916 1 102 ALA MB 1 103 ALA HA 4.313 3.465 5.370 3.666 3.636 3.700 . 0 0 "[ . 1 . 2]" 1 1917 1 102 ALA MB 1 121 VAL MG2 3.858 3.100 4.803 2.989 2.905 3.158 0.195 20 0 "[ . 1 . 2]" 1 1918 1 102 ALA MB 1 121 VAL MG1 3.317 2.465 4.130 2.741 2.607 2.988 . 0 0 "[ . 1 . 2]" 1 1919 1 102 ALA MB 1 121 VAL QG 3.622 2.710 4.509 2.726 2.594 2.969 0.116 11 0 "[ . 1 . 2]" 1 1920 1 102 ALA MB 1 122 ASP H 4.921 3.814 6.351 5.811 5.651 5.994 . 0 0 "[ . 1 . 2]" 1 1921 1 102 ALA MB 1 122 ASP HA 5.684 4.567 7.076 4.781 4.650 4.968 . 0 0 "[ . 1 . 2]" 1 1922 1 102 ALA MB 1 125 ILE MD 3.774 3.032 4.698 2.825 2.773 2.899 0.259 17 0 "[ . 1 . 2]" 1 1923 1 103 ALA H 1 103 ALA HA 2.898 2.328 3.608 2.859 2.847 2.870 . 0 0 "[ . 1 . 2]" 1 1924 1 103 ALA H 1 103 ALA MB 2.445 2.216 3.156 2.137 2.109 2.166 0.107 16 0 "[ . 1 . 2]" 1 1925 1 103 ALA H 1 104 GLU H 3.160 2.449 3.826 2.655 2.633 2.732 . 0 0 "[ . 1 . 2]" 1 1926 1 103 ALA H 1 105 LEU H 4.182 3.241 5.037 4.279 4.182 4.442 . 0 0 "[ . 1 . 2]" 1 1927 1 103 ALA H 1 106 ARG H . 4.344 5.234 5.092 4.903 5.324 0.090 1 0 "[ . 1 . 2]" 1 1928 1 103 ALA H 1 125 ILE MD 4.960 3.844 6.802 5.585 5.477 5.805 . 0 0 "[ . 1 . 2]" 1 1929 1 103 ALA HA 1 104 GLU H 3.769 3.028 4.692 3.542 3.522 3.556 . 0 0 "[ . 1 . 2]" 1 1930 1 103 ALA HA 1 107 HIS H 3.364 2.607 4.342 3.535 3.476 3.607 . 0 0 "[ . 1 . 2]" 1 1931 1 103 ALA HA 1 106 ARG H 3.250 2.484 4.195 3.157 3.073 3.268 . 0 0 "[ . 1 . 2]" 1 1932 1 103 ALA HA 1 121 VAL MG1 5.390 4.331 7.010 4.957 4.872 5.050 . 0 0 "[ . 1 . 2]" 1 1933 1 103 ALA HA 1 106 ARG H 4.069 3.269 5.066 3.552 3.367 3.841 . 0 0 "[ . 1 . 2]" 1 1934 1 103 ALA HA 1 106 ARG QB 2.908 2.337 3.620 3.094 2.830 3.567 . 0 0 "[ . 1 . 2]" 1 1935 1 103 ALA HA 1 106 ARG HD2 4.579 3.679 5.701 4.932 4.195 5.863 0.162 15 0 "[ . 1 . 2]" 1 1936 1 103 ALA HA 1 107 HIS H 4.307 3.461 5.362 4.572 4.332 4.959 . 0 0 "[ . 1 . 2]" 1 1937 1 103 ALA MB 1 104 GLU H . 2.923 3.665 2.808 2.713 2.851 0.210 16 0 "[ . 1 . 2]" 1 1938 1 103 ALA MB 1 104 GLU HB2 5.228 4.201 6.509 3.856 3.603 4.694 0.598 9 3 "[ - +1 . *2]" 1 1939 1 103 ALA MB 1 121 VAL QG 7.000 6.000 106.000 5.831 5.692 5.903 0.308 15 0 "[ . 1 . 2]" 1 1940 1 104 GLU H 1 104 GLU HA 3.262 2.421 4.061 2.847 2.817 2.872 . 0 0 "[ . 1 . 2]" 1 1941 1 104 GLU H 1 104 GLU HB2 2.595 2.011 3.349 2.276 2.105 2.945 . 0 0 "[ . 1 . 2]" 1 1942 1 104 GLU H 1 104 GLU HB3 2.943 2.281 3.799 3.278 2.423 3.635 . 0 0 "[ . 1 . 2]" 1 1943 1 104 GLU H 1 104 GLU HG2 3.006 2.330 3.880 3.602 2.033 4.367 0.487 3 0 "[ . 1 . 2]" 1 1944 1 104 GLU H 1 105 LEU H 3.023 2.343 3.627 2.743 2.686 2.838 . 0 0 "[ . 1 . 2]" 1 1945 1 104 GLU H 1 106 ARG H 4.521 3.504 5.835 4.324 4.232 4.466 . 0 0 "[ . 1 . 2]" 1 1946 1 104 GLU HA 1 104 GLU HB3 2.976 2.191 3.705 2.664 2.451 3.029 . 0 0 "[ . 1 . 2]" 1 1947 1 104 GLU HA 1 107 HIS QB 4.284 3.142 5.333 3.036 2.983 3.127 0.159 16 0 "[ . 1 . 2]" 1 1948 1 104 GLU HB2 1 105 LEU H 2.943 2.281 3.798 2.877 2.415 3.720 . 0 0 "[ . 1 . 2]" 1 1949 1 104 GLU HB3 1 105 LEU H 3.421 2.651 4.415 3.324 2.572 4.164 0.079 15 0 "[ . 1 . 2]" 1 1950 1 104 GLU HG2 1 105 LEU H 4.214 3.266 5.439 4.504 2.966 5.023 0.300 16 0 "[ . 1 . 2]" 1 1951 1 105 LEU H 1 105 LEU HA 2.968 2.378 3.685 2.863 2.843 2.876 . 0 0 "[ . 1 . 2]" 1 1952 1 105 LEU H 1 105 LEU HB2 2.552 . 3.294 2.181 2.056 2.390 . 0 0 "[ . 1 . 2]" 1 1953 1 105 LEU H 1 105 LEU HB3 2.757 2.137 3.558 3.114 2.654 3.444 . 0 0 "[ . 1 . 2]" 1 1954 1 105 LEU H 1 105 LEU QD 5.236 4.207 6.519 3.149 2.567 3.758 1.640 6 12 "[ .+** *****. *-**]" 1 1955 1 105 LEU H 1 105 LEU QD 3.391 2.628 4.377 3.117 2.564 3.695 0.064 6 0 "[ . 1 . 2]" 1 1956 1 105 LEU H 1 106 ARG H 2.848 2.207 3.624 2.732 2.641 2.788 . 0 0 "[ . 1 . 2]" 1 1957 1 105 LEU H 1 107 HIS H 4.224 3.409 5.452 4.254 4.200 4.337 . 0 0 "[ . 1 . 2]" 1 1958 1 105 LEU HA 1 105 LEU HB2 2.547 2.046 3.171 2.101 2.066 2.146 . 0 0 "[ . 1 . 2]" 1 1959 1 105 LEU HA 1 105 LEU HB3 3.127 2.512 3.893 2.894 2.748 3.037 . 0 0 "[ . 1 . 2]" 1 1960 1 105 LEU HA 1 108 VAL H 2.980 2.310 3.846 3.909 3.822 4.036 0.190 9 0 "[ . 1 . 2]" 1 1961 1 105 LEU HA 1 108 VAL MG1 4.726 3.797 5.884 4.793 4.562 5.110 . 0 0 "[ . 1 . 2]" 1 1962 1 105 LEU HA 1 109 MET H 4.416 3.422 5.700 3.999 3.626 4.572 . 0 0 "[ . 1 . 2]" 1 1963 1 105 LEU HB2 1 106 ARG H 2.981 2.310 3.848 3.268 2.888 3.694 . 0 0 "[ . 1 . 2]" 1 1964 1 105 LEU HB3 1 105 LEU QD 4.356 2.495 5.423 2.101 2.081 2.118 0.414 5 0 "[ . 1 . 2]" 1 1965 1 105 LEU HB3 1 106 ARG H 2.905 2.251 3.749 2.951 2.683 3.171 . 0 0 "[ . 1 . 2]" 1 1966 1 105 LEU HB3 1 121 VAL MG2 4.436 3.564 5.523 3.845 3.505 4.488 0.059 6 0 "[ . 1 . 2]" 1 1967 1 105 LEU HB3 1 125 ILE MD 4.725 3.796 5.882 5.401 4.307 6.007 0.125 14 0 "[ . 1 . 2]" 1 1968 1 105 LEU QD 1 106 ARG H 3.547 2.749 4.578 3.842 3.405 4.164 . 0 0 "[ . 1 . 2]" 1 1969 1 105 LEU QD 1 106 ARG HA 3.857 3.099 4.802 4.019 3.081 4.684 0.018 1 0 "[ . 1 . 2]" 1 1970 1 105 LEU QD 1 108 VAL H 4.119 3.192 5.316 5.523 5.150 5.676 0.360 14 0 "[ . 1 . 2]" 1 1971 1 105 LEU QD 1 108 VAL HB 5.501 4.420 6.849 2.941 2.691 3.059 1.729 5 20 [****+*****-*********] 1 1972 1 105 LEU QD 1 108 VAL MG2 4.978 4.000 6.197 5.320 5.203 5.388 . 0 0 "[ . 1 . 2]" 1 1973 1 105 LEU QD 1 109 MET H 3.382 2.621 4.365 4.075 3.674 4.384 0.019 6 0 "[ . 1 . 2]" 1 1974 1 105 LEU QD 1 109 MET ME 4.272 3.432 5.319 3.283 3.207 3.698 0.225 9 0 "[ . 1 . 2]" 1 1975 1 105 LEU QD 1 109 MET QG 4.729 3.821 5.887 3.062 2.619 3.124 1.202 5 20 [****+********-******] 1 1976 1 105 LEU QD 1 109 MET QG 2.620 2.145 3.262 3.029 2.601 3.088 . 0 0 "[ . 1 . 2]" 1 1977 1 105 LEU QD 1 121 VAL HA 3.182 2.557 3.961 3.738 3.603 3.877 . 0 0 "[ . 1 . 2]" 1 1978 1 105 LEU QD 1 121 VAL MG1 3.564 2.863 4.437 2.689 2.576 2.803 0.287 2 0 "[ . 1 . 2]" 1 1979 1 105 LEU QD 1 121 VAL MG2 3.333 2.678 4.149 2.670 2.463 2.750 0.215 5 0 "[ . 1 . 2]" 1 1980 1 105 LEU QD 1 124 MET H 4.212 3.264 5.436 5.229 5.083 5.471 0.035 15 0 "[ . 1 . 2]" 1 1981 1 105 LEU QD 1 124 MET ME 3.461 2.581 4.309 2.595 2.307 3.177 0.274 6 0 "[ . 1 . 2]" 1 1982 1 105 LEU QD 1 124 MET HG2 3.670 2.949 4.569 4.266 3.522 4.729 0.160 9 0 "[ . 1 . 2]" 1 1983 1 105 LEU QD 1 124 MET HG3 4.448 3.574 5.538 4.386 4.101 4.725 . 0 0 "[ . 1 . 2]" 1 1984 1 105 LEU QD 1 121 VAL HA 5.700 4.580 7.096 4.191 4.019 4.407 0.561 2 5 "[*+ -* *1 . 2]" 1 1985 1 105 LEU QD 1 121 VAL QG 3.919 3.149 4.879 2.534 2.373 2.669 0.776 2 18 "[*+**********- *** **]" 1 1986 1 105 LEU QD 1 124 MET H 5.825 4.680 7.252 5.853 5.554 6.047 . 0 0 "[ . 1 . 2]" 1 1987 1 105 LEU QD 1 124 MET QB 4.891 3.930 6.089 3.756 3.373 4.110 0.557 8 3 "[ . + 1 . - *]" 1 1988 1 105 LEU QD 2 19 ALA MB 4.701 3.777 5.853 5.948 5.020 6.256 0.403 18 0 "[ . 1 . 2]" 1 1989 1 105 LEU QD 1 125 ILE HG12 5.228 4.200 6.495 3.787 3.674 3.986 0.526 19 3 "[ . 1 * - +2]" 1 1990 1 105 LEU HG 1 109 MET QG 3.761 3.022 4.682 3.716 3.336 4.493 . 0 0 "[ . 1 . 2]" 1 1991 1 105 LEU HG 1 121 VAL MG2 3.513 2.823 4.373 2.822 2.728 2.901 0.095 5 0 "[ . 1 . 2]" 1 1992 1 106 ARG H 1 106 ARG HA 2.938 2.520 3.792 2.853 2.821 2.880 . 0 0 "[ . 1 . 2]" 1 1993 1 106 ARG H 1 106 ARG QB 2.229 . 2.877 2.349 2.221 2.414 . 0 0 "[ . 1 . 2]" 1 1994 1 106 ARG H 1 106 ARG HD2 4.647 3.602 5.998 5.032 4.185 5.961 . 0 0 "[ . 1 . 2]" 1 1995 1 106 ARG H 1 106 ARG HD3 4.150 3.216 5.356 4.574 3.787 5.584 0.228 2 0 "[ . 1 . 2]" 1 1996 1 106 ARG H 1 106 ARG QG 3.067 2.377 3.958 2.924 2.328 4.034 0.076 2 0 "[ . 1 . 2]" 1 1997 1 106 ARG H 1 107 HIS H 2.885 2.236 3.723 2.678 2.631 2.727 . 0 0 "[ . 1 . 2]" 1 1998 1 106 ARG H 1 107 HIS H 2.850 2.209 3.679 2.664 2.619 2.713 . 0 0 "[ . 1 . 2]" 1 1999 1 106 ARG H 1 109 MET H 4.776 3.702 6.164 5.022 4.912 5.214 . 0 0 "[ . 1 . 2]" 1 2000 1 106 ARG H 1 121 VAL MG1 3.183 2.467 4.108 4.391 4.350 4.437 0.329 1 0 "[ . 1 . 2]" 1 2001 1 106 ARG H 1 121 VAL MG2 5.430 4.363 6.760 4.956 4.767 5.114 . 0 0 "[ . 1 . 2]" 1 2002 1 106 ARG HA 1 106 ARG QB 2.410 . 3.000 2.245 2.155 2.405 . 0 0 "[ . 1 . 2]" 1 2003 1 106 ARG HA 1 106 ARG QG 2.861 2.299 3.562 2.351 2.286 2.461 0.013 4 0 "[ . 1 . 2]" 1 2004 1 106 ARG HA 1 107 HIS H 3.834 3.186 4.936 3.536 3.524 3.556 . 0 0 "[ . 1 . 2]" 1 2005 1 106 ARG HA 1 108 VAL MG1 3.083 2.477 3.838 3.886 3.726 4.028 0.190 11 0 "[ . 1 . 2]" 1 2006 1 106 ARG HA 1 109 MET H 3.745 3.091 4.789 3.913 3.711 4.086 . 0 0 "[ . 1 . 2]" 1 2007 1 106 ARG HA 1 109 MET QB 3.402 2.733 4.235 2.750 2.579 4.115 0.154 9 0 "[ . 1 . 2]" 1 2008 1 106 ARG HA 1 109 MET QG 3.473 2.790 4.324 3.929 2.199 4.215 0.591 5 1 "[ + 1 . 2]" 1 2009 1 106 ARG HA 1 110 THR H 4.289 3.324 5.536 4.045 3.797 4.455 . 0 0 "[ . 1 . 2]" 1 2010 1 106 ARG HA 1 121 VAL MG1 5.119 4.113 6.373 4.738 4.572 4.875 . 0 0 "[ . 1 . 2]" 1 2011 1 106 ARG HA 1 121 VAL MG2 4.251 3.415 5.292 4.175 3.978 4.345 . 0 0 "[ . 1 . 2]" 1 2012 1 106 ARG QB 1 106 ARG HE 2.088 . 2.895 2.221 2.111 2.632 . 0 0 "[ . 1 . 2]" 1 2013 1 106 ARG QB 1 107 HIS H 2.673 2.072 3.450 2.694 2.614 2.773 . 0 0 "[ . 1 . 2]" 1 2014 1 106 ARG QB 1 121 VAL MG1 3.945 3.170 4.911 4.377 3.694 4.704 . 0 0 "[ . 1 . 2]" 1 2015 1 106 ARG QB 1 121 VAL MG2 3.795 3.049 4.725 4.486 3.745 4.821 0.096 13 0 "[ . 1 . 2]" 1 2016 1 106 ARG HD2 1 106 ARG HE 1.876 . 2.621 2.809 2.762 2.852 0.231 2 0 "[ . 1 . 2]" 1 2017 1 106 ARG HD3 1 106 ARG HE 1.865 . 2.607 2.826 2.778 2.866 0.259 20 0 "[ . 1 . 2]" 1 2018 1 106 ARG HE 1 106 ARG QG 1.803 . 2.527 2.408 2.238 2.452 . 0 0 "[ . 1 . 2]" 1 2019 1 106 ARG QG 1 107 HIS H 3.887 3.013 5.017 4.015 3.600 4.226 . 0 0 "[ . 1 . 2]" 1 2020 1 107 HIS H 1 107 HIS HA 2.901 2.373 3.678 2.853 2.827 2.872 . 0 0 "[ . 1 . 2]" 1 2021 1 107 HIS H 1 107 HIS QB 2.298 . 2.966 2.197 2.153 2.251 . 0 0 "[ . 1 . 2]" 1 2022 1 107 HIS H 1 107 HIS HD2 5.676 4.399 7.326 5.347 4.944 5.493 . 0 0 "[ . 1 . 2]" 1 2023 1 107 HIS H 1 108 VAL H 3.375 2.616 4.356 2.989 2.935 3.029 . 0 0 "[ . 1 . 2]" 1 2024 1 107 HIS HA 1 107 HIS QB 2.434 . 3.030 2.405 2.260 2.467 . 0 0 "[ . 1 . 2]" 1 2025 1 107 HIS HA 1 108 VAL H 2.506 . 3.534 3.585 3.571 3.593 0.059 19 0 "[ . 1 . 2]" 1 2026 1 107 HIS HA 1 110 THR H 2.482 . 3.203 2.431 2.421 2.456 . 0 0 "[ . 1 . 2]" 1 2027 1 107 HIS HA 1 111 ASN H 2.645 2.050 3.414 2.594 2.380 2.649 . 0 0 "[ . 1 . 2]" 1 2028 1 107 HIS HA 1 111 ASN HD22 5.299 4.107 6.839 5.370 4.761 6.112 . 0 0 "[ . 1 . 2]" 1 2029 1 107 HIS QB 1 108 VAL H 2.559 . 3.303 2.111 2.026 2.368 . 0 0 "[ . 1 . 2]" 1 2030 1 107 HIS HD2 1 108 VAL MG1 4.868 3.813 6.217 5.956 4.628 6.310 0.093 16 0 "[ . 1 . 2]" 1 2031 1 107 HIS HD2 1 111 ASN H 6.113 4.788 7.808 6.845 5.087 7.183 . 0 0 "[ . 1 . 2]" 1 2032 1 107 HIS HD2 1 111 ASN HD22 6.074 4.757 7.758 4.786 4.684 5.366 0.073 16 0 "[ . 1 . 2]" 1 2033 1 108 VAL H 1 108 VAL HA 3.057 2.494 3.864 2.881 2.862 2.893 . 0 0 "[ . 1 . 2]" 1 2034 1 108 VAL H 1 108 VAL HB 2.512 . 3.242 2.389 2.364 2.411 . 0 0 "[ . 1 . 2]" 1 2035 1 108 VAL H 1 108 VAL MG1 2.461 2.070 3.476 3.740 3.726 3.751 0.275 4 0 "[ . 1 . 2]" 1 2036 1 108 VAL H 1 108 VAL MG2 3.279 2.672 4.232 2.494 2.466 2.510 0.206 6 0 "[ . 1 . 2]" 1 2037 1 108 VAL H 1 109 MET H 2.929 2.270 3.780 2.736 2.705 2.857 . 0 0 "[ . 1 . 2]" 1 2038 1 108 VAL H 1 109 MET H 2.756 2.136 3.557 2.419 2.401 2.463 . 0 0 "[ . 1 . 2]" 1 2039 1 108 VAL HA 1 108 VAL HB 3.091 2.283 3.848 3.043 3.037 3.047 . 0 0 "[ . 1 . 2]" 1 2040 1 108 VAL HA 1 108 VAL MG1 2.619 2.369 3.261 2.435 2.414 2.449 . 0 0 "[ . 1 . 2]" 1 2041 1 108 VAL HA 1 108 VAL MG2 2.753 2.482 3.428 2.246 2.237 2.258 0.245 1 0 "[ . 1 . 2]" 1 2042 1 108 VAL HA 1 109 MET H 3.736 3.002 4.651 3.565 3.554 3.591 . 0 0 "[ . 1 . 2]" 1 2043 1 108 VAL HA 1 110 THR H 4.460 3.457 5.756 4.309 4.004 4.452 . 0 0 "[ . 1 . 2]" 1 2044 1 108 VAL HA 1 111 ASN H 3.634 2.816 4.690 3.508 3.412 3.761 . 0 0 "[ . 1 . 2]" 1 2045 1 108 VAL HA 1 111 ASN H 3.534 2.839 4.400 3.398 3.291 3.454 . 0 0 "[ . 1 . 2]" 1 2046 1 108 VAL HA 1 111 ASN QB 3.060 2.458 3.810 2.966 2.740 3.219 . 0 0 "[ . 1 . 2]" 1 2047 1 108 VAL HA 1 111 ASN HD22 5.308 4.114 5.752 4.433 4.097 5.655 0.017 13 0 "[ . 1 . 2]" 1 2048 1 108 VAL HB 1 109 MET H 2.424 . 3.129 2.237 2.204 2.334 . 0 0 "[ . 1 . 2]" 1 2049 1 108 VAL MG1 1 109 MET H 3.348 2.818 4.321 3.308 3.203 3.371 . 0 0 "[ . 1 . 2]" 1 2050 1 108 VAL MG1 1 109 MET ME 3.749 3.012 4.667 3.079 2.865 3.872 0.147 12 0 "[ . 1 . 2]" 1 2051 1 108 VAL MG1 1 110 THR H 4.557 3.532 5.882 4.929 4.715 4.980 . 0 0 "[ . 1 . 2]" 1 2052 1 108 VAL MG1 1 111 ASN H 4.076 3.159 5.261 4.722 4.639 5.034 . 0 0 "[ . 1 . 2]" 1 2053 1 108 VAL MG1 2 5 PHE QE 6.000 5.000 105.000 6.980 5.780 8.961 . 0 0 "[ . 1 . 2]" 1 2054 1 108 VAL MG2 1 109 MET H . 3.380 4.347 4.036 4.015 4.051 . 0 0 "[ . 1 . 2]" 1 2055 1 108 VAL MG2 1 110 THR H 4.934 3.824 6.368 5.433 5.224 5.499 . 0 0 "[ . 1 . 2]" 1 2056 1 108 VAL MG2 1 111 ASN H 4.838 3.750 6.244 5.209 5.107 5.363 . 0 0 "[ . 1 . 2]" 1 2057 1 108 VAL MG2 1 112 LEU H 5.050 3.914 6.518 6.135 5.287 6.314 . 0 0 "[ . 1 . 2]" 1 2058 1 108 VAL MG2 2 5 PHE QE 6.000 5.000 105.000 8.397 7.003 10.162 . 0 0 "[ . 1 . 2]" 1 2059 1 109 MET H 1 109 MET HA 2.814 2.599 3.632 2.858 2.851 2.873 . 0 0 "[ . 1 . 2]" 1 2060 1 109 MET H 1 109 MET QB 2.716 2.105 3.505 2.379 2.359 2.571 . 0 0 "[ . 1 . 2]" 1 2061 1 109 MET H 1 109 MET ME 5.639 4.531 7.020 4.657 4.619 4.782 . 0 0 "[ . 1 . 2]" 1 2062 1 109 MET H 1 109 MET QG 3.033 2.351 3.081 2.222 1.979 2.316 0.372 5 0 "[ . 1 . 2]" 1 2063 1 109 MET H 1 111 ASN H 4.125 3.197 5.324 4.349 4.250 4.497 . 0 0 "[ . 1 . 2]" 1 2064 1 109 MET HA 1 109 MET ME 4.572 3.673 5.692 3.915 3.853 4.383 . 0 0 "[ . 1 . 2]" 1 2065 1 109 MET HA 1 109 MET QG 2.850 2.548 3.548 2.426 2.340 3.390 0.208 15 0 "[ . 1 . 2]" 1 2066 1 109 MET HA 1 112 LEU H 3.838 2.974 4.954 3.683 3.440 3.805 . 0 0 "[ . 1 . 2]" 1 2067 1 109 MET HA 1 113 GLY H 3.014 2.336 3.890 3.160 2.987 3.198 . 0 0 "[ . 1 . 2]" 1 2068 1 109 MET HA 1 112 LEU HB2 3.300 2.651 4.108 3.436 3.082 3.733 . 0 0 "[ . 1 . 2]" 1 2069 1 109 MET HA 1 112 LEU QD 3.475 2.792 4.326 2.985 2.705 4.386 0.087 5 0 "[ . 1 . 2]" 1 2070 1 109 MET QB 1 109 MET QG 2.449 . 3.021 1.944 1.885 1.952 0.083 5 0 "[ . 1 . 2]" 1 2071 1 109 MET QB 1 110 THR H 3.150 2.441 4.066 2.624 2.539 3.502 . 0 0 "[ . 1 . 2]" 1 2072 1 109 MET QB 1 114 GLU H 3.192 2.474 4.120 3.201 2.498 3.565 . 0 0 "[ . 1 . 2]" 1 2073 1 109 MET QB 1 109 MET QG 2.484 2.070 3.093 2.105 2.016 2.114 0.054 5 0 "[ . 1 . 2]" 1 2074 1 109 MET QB 1 110 THR H 3.193 2.475 4.121 2.640 2.547 3.659 . 0 0 "[ . 1 . 2]" 1 2075 1 109 MET QB 1 116 LEU MD1 4.663 3.746 5.805 4.501 3.871 4.824 . 0 0 "[ . 1 . 2]" 1 2076 1 109 MET ME 1 112 LEU QD 3.330 2.675 4.146 2.527 2.463 2.659 0.212 7 0 "[ . 1 . 2]" 1 2077 1 109 MET ME 1 116 LEU MD1 3.705 2.977 4.613 2.917 2.821 3.028 0.156 9 0 "[ . 1 . 2]" 1 2078 1 109 MET QG 1 110 THR H 4.246 3.291 5.480 4.052 2.451 4.166 0.840 5 1 "[ + 1 . 2]" 1 2079 1 109 MET QG 1 110 THR H 3.535 2.740 4.563 3.797 2.441 3.906 0.299 5 0 "[ . 1 . 2]" 1 2080 1 109 MET QG 1 116 LEU MD1 4.433 3.562 5.519 5.365 5.214 5.408 . 0 0 "[ . 1 . 2]" 1 2081 1 109 MET QG 1 116 LEU MD2 4.927 3.959 6.134 5.488 4.759 5.670 . 0 0 "[ . 1 . 2]" 1 2082 1 109 MET QG 1 124 MET ME 5.780 4.344 7.196 5.526 4.489 6.671 . 0 0 "[ . 1 . 2]" 1 2083 1 110 THR H 1 110 THR HA 2.856 2.399 3.686 2.865 2.853 2.888 . 0 0 "[ . 1 . 2]" 1 2084 1 110 THR H 1 110 THR MG . 3.505 4.039 3.781 3.775 3.795 . 0 0 "[ . 1 . 2]" 1 2085 1 110 THR H 1 111 ASN H 2.742 2.125 3.532 2.718 2.592 2.812 . 0 0 "[ . 1 . 2]" 1 2086 1 110 THR H 1 112 LEU H 4.763 3.691 6.148 4.111 3.932 4.207 . 0 0 "[ . 1 . 2]" 1 2087 1 110 THR H 1 112 LEU QD 4.223 3.273 5.751 4.982 4.741 5.089 . 0 0 "[ . 1 . 2]" 1 2088 1 110 THR HA 1 110 THR HB 2.388 . 2.973 3.031 3.027 3.035 0.062 4 0 "[ . 1 . 2]" 1 2089 1 110 THR HA 1 110 THR MG 2.734 2.541 3.404 2.365 2.357 2.377 0.184 7 0 "[ . 1 . 2]" 1 2090 1 110 THR HA 1 111 ASN H 3.123 2.881 4.031 3.568 3.547 3.601 . 0 0 "[ . 1 . 2]" 1 2091 1 110 THR HA 1 113 GLY H 3.260 2.619 4.059 3.812 3.496 4.027 . 0 0 "[ . 1 . 2]" 1 2092 1 110 THR HA 1 114 GLU H 3.311 2.566 4.274 2.932 2.299 3.130 0.267 6 0 "[ . 1 . 2]" 1 2093 1 110 THR MG 1 111 ASN H . 3.601 4.306 3.551 3.433 3.588 0.168 15 0 "[ . 1 . 2]" 1 2094 1 110 THR MG 1 111 ASN HA 5.142 3.831 6.402 3.706 3.686 3.731 0.145 10 0 "[ . 1 . 2]" 1 2095 1 110 THR MG 1 111 ASN HD22 5.735 4.445 7.402 5.509 4.899 5.772 . 0 0 "[ . 1 . 2]" 1 2096 1 110 THR MG 1 112 LEU H 5.332 4.132 6.882 4.797 4.676 5.151 . 0 0 "[ . 1 . 2]" 1 2097 1 110 THR MG 1 113 GLY H 4.793 3.715 6.186 4.300 4.113 4.905 . 0 0 "[ . 1 . 2]" 1 2098 1 110 THR MG 1 114 GLU H 5.504 4.266 7.104 4.816 4.543 4.993 . 0 0 "[ . 1 . 2]" 1 2099 1 111 ASN H 1 111 ASN HA 2.709 2.100 3.496 2.863 2.852 2.898 . 0 0 "[ . 1 . 2]" 1 2100 1 111 ASN H 1 111 ASN QB 2.398 . 3.095 2.341 2.323 2.362 . 0 0 "[ . 1 . 2]" 1 2101 1 111 ASN H 1 111 ASN HD21 4.020 3.116 5.188 4.066 3.946 4.648 . 0 0 "[ . 1 . 2]" 1 2102 1 111 ASN H 1 111 ASN HD22 4.111 3.292 5.306 4.419 4.334 4.747 . 0 0 "[ . 1 . 2]" 1 2103 1 111 ASN HA 1 111 ASN HD21 3.802 2.947 4.907 4.290 2.935 4.450 0.012 17 0 "[ . 1 . 2]" 1 2104 1 111 ASN HA 1 111 ASN HD22 4.717 3.656 6.088 4.473 3.758 4.567 . 0 0 "[ . 1 . 2]" 1 2105 1 111 ASN HA 1 112 LEU H 4.424 3.429 5.710 3.496 3.470 3.554 . 0 0 "[ . 1 . 2]" 1 2106 1 111 ASN HA 1 113 GLY H 3.373 2.614 4.353 3.708 3.541 4.275 . 0 0 "[ . 1 . 2]" 1 2107 1 111 ASN QB 1 111 ASN HD22 . 3.297 4.227 3.274 3.262 3.342 0.035 7 0 "[ . 1 . 2]" 1 2108 1 111 ASN QB 1 112 LEU H 3.473 2.692 4.483 2.915 2.648 2.991 0.044 15 0 "[ . 1 . 2]" 1 2109 1 111 ASN QB 1 113 GLY H 4.423 3.428 5.709 4.483 4.432 4.537 . 0 0 "[ . 1 . 2]" 1 2110 1 111 ASN HD22 1 112 LEU H 6.430 4.983 8.299 6.380 6.153 6.513 . 0 0 "[ . 1 . 2]" 1 2111 1 112 LEU H 1 112 LEU HA 2.761 2.218 3.437 2.966 2.946 2.996 . 0 0 "[ . 1 . 2]" 1 2112 1 112 LEU H 1 112 LEU HB2 3.053 2.366 3.941 2.131 2.080 2.467 0.286 12 0 "[ . 1 . 2]" 1 2113 1 112 LEU H 1 112 LEU MD2 4.368 3.510 5.438 3.470 3.329 4.285 0.181 5 0 "[ . 1 . 2]" 1 2114 1 112 LEU HA 1 112 LEU HB2 2.806 2.254 3.493 3.032 3.024 3.037 . 0 0 "[ . 1 . 2]" 1 2115 1 112 LEU HA 1 112 LEU HB3 2.792 2.243 3.476 2.429 2.399 2.580 . 0 0 "[ . 1 . 2]" 1 2116 1 112 LEU HA 1 112 LEU MD1 4.570 3.672 5.690 3.813 3.089 3.887 0.583 20 1 "[ . 1 . +]" 1 2117 1 112 LEU HA 1 112 LEU QD 2.449 . 3.049 2.341 2.244 3.047 . 0 0 "[ . 1 . 2]" 1 2118 1 112 LEU HA 1 112 LEU MD2 3.216 2.584 4.004 2.411 2.259 3.643 0.325 5 0 "[ . 1 . 2]" 1 2119 1 112 LEU HA 1 113 GLY H 2.492 . 3.216 2.681 2.579 2.716 . 0 0 "[ . 1 . 2]" 1 2120 1 112 LEU HB2 1 113 GLY H 3.476 2.694 4.487 3.545 3.333 3.678 . 0 0 "[ . 1 . 2]" 1 2121 1 112 LEU HB2 1 114 GLU H 2.946 2.283 3.802 2.683 2.214 3.989 0.187 15 0 "[ . 1 . 2]" 1 2122 1 112 LEU HB3 1 113 GLY H 3.335 2.585 4.304 4.404 4.138 4.455 0.151 4 0 "[ . 1 . 2]" 1 2123 1 112 LEU QD 2 12 ALA MB 4.429 3.558 5.514 3.472 3.295 3.849 0.263 14 0 "[ . 1 . 2]" 1 2124 1 113 GLY H 1 113 GLY HA2 2.396 . 2.984 2.452 2.353 2.960 . 0 0 "[ . 1 . 2]" 1 2125 1 113 GLY H 1 113 GLY HA3 2.696 2.166 3.356 2.881 2.681 2.930 . 0 0 "[ . 1 . 2]" 1 2126 1 113 GLY H 1 114 GLU H 2.393 2.082 3.089 2.591 2.431 3.267 0.178 15 0 "[ . 1 . 2]" 1 2127 1 113 GLY HA2 1 114 GLU H 3.573 2.769 3.962 3.203 3.074 3.561 . 0 0 "[ . 1 . 2]" 1 2128 1 113 GLY HA3 1 114 GLU H 3.439 2.763 4.281 3.266 2.396 3.468 0.367 20 0 "[ . 1 . 2]" 1 2129 1 114 GLU H 1 114 GLU HA 3.268 2.533 4.218 2.967 2.843 2.996 . 0 0 "[ . 1 . 2]" 1 2130 1 114 GLU H 1 114 GLU HG2 3.350 2.596 4.324 3.482 2.592 4.401 0.077 17 0 "[ . 1 . 2]" 1 2131 1 114 GLU H 1 114 GLU HG3 3.599 2.789 4.645 3.679 2.797 4.596 . 0 0 "[ . 1 . 2]" 1 2132 1 114 GLU H 1 115 LYS H 3.876 3.302 5.003 4.476 4.250 4.558 . 0 0 "[ . 1 . 2]" 1 2133 1 114 GLU HA 1 115 LYS H 2.358 . 3.043 2.186 2.145 2.307 . 0 0 "[ . 1 . 2]" 1 2134 1 114 GLU HB3 1 115 LYS H 3.265 2.530 4.214 3.445 2.967 4.237 0.023 8 0 "[ . 1 . 2]" 1 2135 1 114 GLU HG2 1 115 LYS H 4.313 3.343 5.567 4.354 3.165 5.034 0.178 11 0 "[ . 1 . 2]" 1 2136 1 115 LYS H 1 115 LYS HB2 2.685 2.081 3.466 3.103 2.545 3.414 . 0 0 "[ . 1 . 2]" 1 2137 1 115 LYS H 1 115 LYS HB3 3.132 2.427 4.043 3.003 2.531 3.874 . 0 0 "[ . 1 . 2]" 1 2138 1 115 LYS H 1 115 LYS QD 4.649 3.603 6.000 4.822 4.428 5.172 . 0 0 "[ . 1 . 2]" 1 2139 1 115 LYS H 1 115 LYS QG 3.866 2.996 4.990 3.990 3.155 4.198 . 0 0 "[ . 1 . 2]" 1 2140 1 115 LYS H 1 116 LEU H 3.857 3.208 4.978 4.216 3.965 4.620 . 0 0 "[ . 1 . 2]" 1 2141 1 115 LYS HA 1 115 LYS HB3 3.432 2.758 4.273 2.965 2.546 3.035 0.212 10 0 "[ . 1 . 2]" 1 2142 1 115 LYS HA 1 116 LEU H 2.395 2.131 3.091 2.189 2.171 2.239 . 0 0 "[ . 1 . 2]" 1 2143 1 115 LYS QB 1 116 LEU H 3.703 2.870 4.780 3.738 3.389 3.871 . 0 0 "[ . 1 . 2]" 1 2144 1 116 LEU H 1 116 LEU HA 3.412 2.644 4.404 2.994 2.989 2.998 . 0 0 "[ . 1 . 2]" 1 2145 1 116 LEU H 1 116 LEU HB2 3.027 2.346 3.907 2.376 2.316 2.441 0.030 15 0 "[ . 1 . 2]" 1 2146 1 116 LEU H 1 116 LEU HB3 2.780 2.155 3.588 3.345 3.304 3.372 . 0 0 "[ . 1 . 2]" 1 2147 1 116 LEU H 1 116 LEU QD 3.375 2.616 4.356 2.888 2.731 2.996 . 0 0 "[ . 1 . 2]" 1 2148 1 116 LEU H 1 116 LEU MD2 5.228 4.200 6.509 4.324 4.185 4.373 0.015 5 0 "[ . 1 . 2]" 1 2149 1 116 LEU H 1 117 THR H 4.344 3.367 5.607 4.443 4.409 4.526 . 0 0 "[ . 1 . 2]" 1 2150 1 116 LEU H 1 117 THR H 3.459 2.681 4.464 3.872 3.848 3.928 . 0 0 "[ . 1 . 2]" 1 2151 1 116 LEU H 1 120 GLU HB2 4.358 3.378 5.625 5.698 5.645 5.767 0.142 5 0 "[ . 1 . 2]" 1 2152 1 116 LEU H 1 121 VAL MG2 4.582 3.551 5.914 4.061 3.829 4.485 . 0 0 "[ . 1 . 2]" 1 2153 1 116 LEU HA 1 116 LEU MD2 3.432 2.758 4.273 3.713 3.702 3.728 . 0 0 "[ . 1 . 2]" 1 2154 1 116 LEU HA 1 117 THR H 2.189 . 2.825 2.640 2.520 2.740 . 0 0 "[ . 1 . 2]" 1 2155 1 116 LEU QB 1 121 VAL H 4.186 3.244 5.403 3.721 3.654 3.823 . 0 0 "[ . 1 . 2]" 1 2156 1 116 LEU HB2 1 117 THR H 3.057 2.369 3.946 3.671 3.600 3.858 . 0 0 "[ . 1 . 2]" 1 2157 1 116 LEU HB3 1 116 LEU MD2 3.298 2.650 4.106 2.417 2.372 2.502 0.278 6 0 "[ . 1 . 2]" 1 2158 1 116 LEU HB3 1 117 THR H 2.809 2.177 3.626 2.150 2.043 2.417 0.134 15 0 "[ . 1 . 2]" 1 2159 1 116 LEU HB3 1 120 GLU H 3.794 2.940 4.897 4.532 4.471 4.657 . 0 0 "[ . 1 . 2]" 1 2160 1 116 LEU QD 1 117 THR H 2.874 2.227 3.709 3.496 3.427 3.567 . 0 0 "[ . 1 . 2]" 1 2161 1 116 LEU QD 1 120 GLU H 4.266 3.306 5.506 4.954 4.903 5.023 . 0 0 "[ . 1 . 2]" 1 2162 1 116 LEU QD 1 121 VAL H 3.807 2.951 4.914 4.310 4.188 4.437 . 0 0 "[ . 1 . 2]" 1 2163 1 116 LEU QD 1 122 ASP H 4.976 3.856 6.423 6.112 5.963 6.282 . 0 0 "[ . 1 . 2]" 1 2164 1 116 LEU MD1 1 121 VAL MG2 3.743 3.007 4.660 4.420 4.267 4.520 . 0 0 "[ . 1 . 2]" 1 2165 1 117 THR H 1 117 THR HA 2.816 2.182 3.635 2.996 2.992 2.999 . 0 0 "[ . 1 . 2]" 1 2166 1 117 THR H 1 117 THR MG . 2.885 3.044 2.647 2.622 2.665 0.263 16 0 "[ . 1 . 2]" 1 2167 1 117 THR H 1 118 ASP H 4.337 3.361 5.445 4.609 4.599 4.621 . 0 0 "[ . 1 . 2]" 1 2168 1 117 THR H 1 119 GLU H 5.178 4.013 6.639 5.146 5.038 5.228 . 0 0 "[ . 1 . 2]" 1 2169 1 117 THR H 1 120 GLU H 3.464 2.884 4.471 3.654 3.562 3.764 . 0 0 "[ . 1 . 2]" 1 2170 1 117 THR H 1 120 GLU HA 4.381 3.395 5.655 5.164 5.082 5.261 . 0 0 "[ . 1 . 2]" 1 2171 1 117 THR H 1 120 GLU HB2 3.095 2.399 3.995 2.365 2.345 2.412 0.054 18 0 "[ . 1 . 2]" 1 2172 1 117 THR H 1 120 GLU HB3 2.754 2.134 3.555 3.691 3.663 3.739 0.184 6 0 "[ . 1 . 2]" 1 2173 1 117 THR H 1 120 GLU HG2 3.441 2.667 4.441 3.368 3.160 3.572 . 0 0 "[ . 1 . 2]" 1 2174 1 117 THR H 1 121 VAL H 4.601 3.566 5.939 4.263 4.235 4.309 . 0 0 "[ . 1 . 2]" 1 2175 1 117 THR H 1 121 VAL MG2 3.859 2.991 4.981 4.160 4.056 4.286 . 0 0 "[ . 1 . 2]" 1 2176 1 117 THR HA 1 117 THR MG 3.306 2.656 4.116 2.431 2.426 2.437 0.230 1 0 "[ . 1 . 2]" 1 2177 1 117 THR HA 1 118 ASP H 2.295 . 2.962 2.420 2.386 2.446 . 0 0 "[ . 1 . 2]" 1 2178 1 117 THR HA 1 119 GLU H 4.101 3.178 5.293 4.420 4.302 4.491 . 0 0 "[ . 1 . 2]" 1 2179 1 117 THR HA 1 120 GLU H 4.177 3.237 5.391 4.671 4.612 4.700 . 0 0 "[ . 1 . 2]" 1 2180 1 117 THR HB 1 118 ASP H 2.589 2.006 3.342 2.582 2.540 2.647 . 0 0 "[ . 1 . 2]" 1 2181 1 117 THR HB 1 119 GLU H 3.287 2.547 4.243 3.070 2.959 3.140 . 0 0 "[ . 1 . 2]" 1 2182 1 117 THR MG 1 119 GLU H 3.997 3.098 5.159 4.535 4.449 4.578 . 0 0 "[ . 1 . 2]" 1 2183 1 117 THR MG 1 120 GLU H 4.145 3.213 5.350 4.289 4.269 4.318 . 0 0 "[ . 1 . 2]" 1 2184 1 118 ASP H 1 118 ASP HA 2.900 2.399 3.717 2.826 2.812 2.832 . 0 0 "[ . 1 . 2]" 1 2185 1 118 ASP H 1 118 ASP HB2 2.625 2.034 3.388 2.563 2.417 3.584 0.196 14 0 "[ . 1 . 2]" 1 2186 1 118 ASP H 1 118 ASP HB3 2.841 2.202 3.667 3.153 2.542 3.610 . 0 0 "[ . 1 . 2]" 1 2187 1 118 ASP H 1 119 GLU H 2.848 2.429 3.676 2.789 2.765 2.820 . 0 0 "[ . 1 . 2]" 1 2188 1 118 ASP H 1 120 GLU H 4.315 3.506 5.569 4.288 4.265 4.351 . 0 0 "[ . 1 . 2]" 1 2189 1 118 ASP H 1 121 VAL H 5.038 3.905 6.443 4.875 4.839 4.975 . 0 0 "[ . 1 . 2]" 1 2190 1 118 ASP H 1 121 VAL QG 4.935 3.825 6.370 4.825 4.777 4.984 . 0 0 "[ . 1 . 2]" 1 2191 1 118 ASP HA 1 118 ASP HB2 2.870 2.306 3.573 2.782 2.476 3.026 . 0 0 "[ . 1 . 2]" 1 2192 1 118 ASP HA 1 118 ASP HB3 2.598 2.087 3.234 2.705 2.442 3.032 . 0 0 "[ . 1 . 2]" 1 2193 1 118 ASP HA 1 119 GLU H 3.777 3.108 4.816 3.558 3.542 3.569 . 0 0 "[ . 1 . 2]" 1 2194 1 118 ASP HA 1 121 VAL H 3.650 2.829 4.711 3.397 3.356 3.482 . 0 0 "[ . 1 . 2]" 1 2195 1 118 ASP HA 1 121 VAL H 3.507 2.818 4.366 3.161 3.123 3.212 . 0 0 "[ . 1 . 2]" 1 2196 1 118 ASP HA 1 121 VAL HB 2.965 2.382 3.691 2.783 2.721 2.930 . 0 0 "[ . 1 . 2]" 1 2197 1 118 ASP HA 1 121 VAL MG1 5.256 4.223 6.544 4.180 4.131 4.289 0.092 1 0 "[ . 1 . 2]" 1 2198 1 118 ASP HA 1 121 VAL MG2 . 3.448 3.823 3.452 3.389 3.676 0.059 5 0 "[ . 1 . 2]" 1 2199 1 118 ASP HB2 1 119 GLU H 3.047 2.361 3.933 3.208 2.675 3.895 . 0 0 "[ . 1 . 2]" 1 2200 1 118 ASP HB3 1 119 GLU H 3.280 2.542 4.233 3.272 2.569 3.976 . 0 0 "[ . 1 . 2]" 1 2201 1 119 GLU H 1 119 GLU HA 2.994 2.320 3.546 2.857 2.841 2.872 . 0 0 "[ . 1 . 2]" 1 2202 1 119 GLU H 1 119 GLU HB2 2.961 2.295 3.822 2.467 2.386 2.549 . 0 0 "[ . 1 . 2]" 1 2203 1 119 GLU H 1 119 GLU HB3 2.806 2.175 3.622 3.148 2.552 3.632 0.010 11 0 "[ . 1 . 2]" 1 2204 1 119 GLU H 1 119 GLU QG 3.296 2.555 4.254 3.156 2.369 4.075 0.186 17 0 "[ . 1 . 2]" 1 2205 1 119 GLU H 1 120 GLU H 2.908 2.254 3.482 2.701 2.654 2.757 . 0 0 "[ . 1 . 2]" 1 2206 1 119 GLU H 1 121 VAL H 3.810 3.241 4.917 4.228 4.195 4.314 . 0 0 "[ . 1 . 2]" 1 2207 1 119 GLU H 1 121 VAL QG 5.429 4.208 7.007 5.277 5.248 5.376 . 0 0 "[ . 1 . 2]" 1 2208 1 119 GLU HA 1 119 GLU HB2 2.847 2.288 3.544 2.786 2.472 3.046 . 0 0 "[ . 1 . 2]" 1 2209 1 119 GLU HA 1 119 GLU HB3 3.128 2.742 3.894 2.783 2.553 3.039 0.189 15 0 "[ . 1 . 2]" 1 2210 1 119 GLU HA 1 119 GLU QG 3.031 2.435 3.774 2.524 2.303 2.918 0.132 15 0 "[ . 1 . 2]" 1 2211 1 119 GLU HA 1 120 GLU H 3.527 3.049 4.552 3.551 3.544 3.563 . 0 0 "[ . 1 . 2]" 1 2212 1 119 GLU HA 1 122 ASP H 3.494 2.768 4.289 3.349 3.293 3.423 . 0 0 "[ . 1 . 2]" 1 2213 1 119 GLU HA 1 122 ASP HB2 3.487 2.802 4.341 2.993 2.762 3.157 0.040 17 0 "[ . 1 . 2]" 1 2214 1 119 GLU HA 1 122 ASP HB3 2.902 2.332 3.613 2.409 2.330 2.488 0.002 6 0 "[ . 1 . 2]" 1 2215 1 119 GLU HB2 1 120 GLU H 2.661 2.062 3.435 2.323 2.226 2.431 . 0 0 "[ . 1 . 2]" 1 2216 1 119 GLU HB3 1 120 GLU H 2.937 2.276 3.791 3.112 2.528 3.580 . 0 0 "[ . 1 . 2]" 1 2217 1 120 GLU H 1 120 GLU HA 2.960 2.294 3.820 2.868 2.852 2.876 . 0 0 "[ . 1 . 2]" 1 2218 1 120 GLU H 1 120 GLU HB3 2.345 . 3.027 2.158 2.119 2.189 . 0 0 "[ . 1 . 2]" 1 2219 1 120 GLU H 1 121 VAL H 2.749 2.169 3.548 2.688 2.667 2.743 . 0 0 "[ . 1 . 2]" 1 2220 1 120 GLU H 1 121 VAL QG 3.849 2.983 4.968 4.378 4.359 4.400 . 0 0 "[ . 1 . 2]" 1 2221 1 120 GLU H 1 121 VAL MG2 5.774 4.639 7.188 4.501 4.479 4.523 0.160 11 0 "[ . 1 . 2]" 1 2222 1 120 GLU HA 1 120 GLU HB3 2.899 2.329 3.609 2.481 2.469 2.495 . 0 0 "[ . 1 . 2]" 1 2223 1 120 GLU HA 1 121 VAL H 3.671 2.845 4.738 3.550 3.539 3.558 . 0 0 "[ . 1 . 2]" 1 2224 1 120 GLU HB2 1 121 VAL H 3.355 2.600 4.330 2.516 2.483 2.540 0.117 6 0 "[ . 1 . 2]" 1 2225 1 120 GLU HG2 1 121 VAL H 3.066 2.376 3.957 4.261 4.231 4.281 0.324 1 0 "[ . 1 . 2]" 1 2226 1 121 VAL H 1 121 VAL HA 3.054 2.367 3.496 2.916 2.908 2.936 . 0 0 "[ . 1 . 2]" 1 2227 1 121 VAL H 1 121 VAL HB 2.577 . 3.326 2.483 2.471 2.502 . 0 0 "[ . 1 . 2]" 1 2228 1 121 VAL H 1 121 VAL QG 2.406 . 3.105 2.460 2.437 2.480 . 0 0 "[ . 1 . 2]" 1 2229 1 121 VAL H 1 121 VAL MG2 3.154 2.534 3.927 2.491 2.466 2.512 0.068 6 0 "[ . 1 . 2]" 1 2230 1 121 VAL HA 1 121 VAL HB 2.916 2.343 3.630 2.437 2.236 2.671 0.107 19 0 "[ . 1 . 2]" 1 2231 1 121 VAL HA 1 121 VAL MG1 3.509 2.619 4.369 2.418 2.396 2.441 0.223 6 0 "[ . 1 . 2]" 1 2232 1 121 VAL HA 1 121 VAL QG 2.416 . 3.008 2.126 2.117 2.140 . 0 0 "[ . 1 . 2]" 1 2233 1 121 VAL HA 1 121 VAL MG2 3.389 2.523 4.219 2.357 2.343 2.384 0.180 5 0 "[ . 1 . 2]" 1 2234 1 121 VAL HA 1 124 MET H 3.835 2.972 4.223 3.303 3.144 3.434 . 0 0 "[ . 1 . 2]" 1 2235 1 121 VAL HA 1 124 MET QB 3.300 2.651 4.108 2.568 2.298 2.941 0.353 19 0 "[ . 1 . 2]" 1 2236 1 121 VAL HA 1 124 MET ME 5.409 4.046 6.734 4.940 4.065 5.664 . 0 0 "[ . 1 . 2]" 1 2237 1 121 VAL HA 1 124 MET HG2 4.440 3.567 4.697 4.754 4.448 5.002 0.305 19 0 "[ . 1 . 2]" 1 2238 1 121 VAL HA 1 124 MET HG3 4.162 3.547 5.182 4.229 3.404 5.456 0.274 6 0 "[ . 1 . 2]" 1 2239 1 121 VAL HA 1 125 ILE H 4.480 3.472 5.782 4.415 4.153 4.671 . 0 0 "[ . 1 . 2]" 1 2240 1 121 VAL HB 1 122 ASP H 2.792 2.164 3.604 2.842 2.769 2.972 . 0 0 "[ . 1 . 2]" 1 2241 1 121 VAL QG 1 123 GLU H 4.994 3.871 6.446 4.734 4.608 4.835 . 0 0 "[ . 1 . 2]" 1 2242 1 121 VAL QG 1 124 MET H 4.793 3.715 6.186 4.191 3.987 4.351 . 0 0 "[ . 1 . 2]" 1 2243 1 121 VAL MG1 1 122 ASP H 3.098 2.401 3.999 3.620 3.563 3.738 . 0 0 "[ . 1 . 2]" 1 2244 1 121 VAL MG1 1 122 ASP HA 4.989 4.008 6.211 3.752 3.711 3.817 0.297 16 0 "[ . 1 . 2]" 1 2245 1 121 VAL MG1 1 125 ILE H 4.436 3.438 5.725 4.058 3.902 4.232 . 0 0 "[ . 1 . 2]" 1 2246 1 121 VAL MG1 1 125 ILE MD 4.307 3.460 5.362 3.609 3.394 4.058 0.066 15 0 "[ . 1 . 2]" 1 2247 1 121 VAL MG2 1 124 MET ME 4.665 3.548 5.808 4.414 3.483 5.288 0.065 17 0 "[ . 1 . 2]" 1 2248 1 122 ASP H 1 122 ASP HA 3.005 2.472 3.831 2.860 2.853 2.868 . 0 0 "[ . 1 . 2]" 1 2249 1 122 ASP H 1 122 ASP HB2 2.734 2.119 3.529 2.469 2.442 2.507 . 0 0 "[ . 1 . 2]" 1 2250 1 122 ASP H 1 122 ASP HB3 2.489 . 3.213 2.619 2.582 2.646 . 0 0 "[ . 1 . 2]" 1 2251 1 122 ASP H 1 123 GLU H 2.762 2.141 3.565 2.756 2.724 2.816 . 0 0 "[ . 1 . 2]" 1 2252 1 122 ASP HA 1 122 ASP HB2 2.685 2.157 3.343 2.511 2.491 2.525 . 0 0 "[ . 1 . 2]" 1 2253 1 122 ASP HA 1 122 ASP HB3 2.871 2.307 3.574 3.029 3.027 3.033 . 0 0 "[ . 1 . 2]" 1 2254 1 122 ASP HA 1 123 GLU H 3.258 2.618 4.056 3.198 3.146 3.248 . 0 0 "[ . 1 . 2]" 1 2255 1 122 ASP HA 1 125 ILE H 3.456 2.678 4.461 3.606 3.498 3.719 . 0 0 "[ . 1 . 2]" 1 2256 1 122 ASP HA 1 125 ILE HB 3.132 2.516 3.899 3.248 3.122 3.558 . 0 0 "[ . 1 . 2]" 1 2257 1 122 ASP HA 1 125 ILE MD 5.297 4.256 6.595 4.611 4.302 4.946 . 0 0 "[ . 1 . 2]" 1 2258 1 122 ASP HA 1 125 ILE MG 5.166 3.851 6.432 4.542 4.397 4.745 . 0 0 "[ . 1 . 2]" 1 2259 1 122 ASP HB2 1 123 GLU H 3.046 2.361 3.931 3.783 3.730 3.857 . 0 0 "[ . 1 . 2]" 1 2260 1 122 ASP HB3 1 123 GLU H 2.925 2.267 3.775 2.477 2.384 2.630 . 0 0 "[ . 1 . 2]" 1 2261 1 123 GLU H 1 123 GLU HA 3.223 2.590 4.012 2.861 2.853 2.869 . 0 0 "[ . 1 . 2]" 1 2262 1 123 GLU H 1 123 GLU QB 2.530 . 3.265 2.391 2.374 2.415 . 0 0 "[ . 1 . 2]" 1 2263 1 123 GLU H 1 123 GLU HG2 2.806 2.175 3.622 3.461 2.299 3.657 0.035 10 0 "[ . 1 . 2]" 1 2264 1 123 GLU H 1 124 MET H 2.701 2.093 3.486 2.712 2.660 2.742 . 0 0 "[ . 1 . 2]" 1 2265 1 123 GLU HA 1 123 GLU QB 2.893 2.324 3.602 2.412 2.409 2.416 . 0 0 "[ . 1 . 2]" 1 2266 1 123 GLU HA 1 124 MET H 2.736 2.120 3.531 2.716 2.684 2.744 . 0 0 "[ . 1 . 2]" 1 2267 1 123 GLU HA 1 125 ILE H 3.235 2.507 4.176 3.391 3.344 3.431 . 0 0 "[ . 1 . 2]" 1 2268 1 123 GLU HA 1 126 ARG H 3.686 2.961 4.589 3.272 2.965 3.568 . 0 0 "[ . 1 . 2]" 1 2269 1 123 GLU HA 1 126 ARG H 3.029 2.348 3.909 2.676 2.587 2.743 . 0 0 "[ . 1 . 2]" 1 2270 1 123 GLU HB2 1 124 MET H 2.710 2.100 3.498 2.125 2.049 2.242 0.051 19 0 "[ . 1 . 2]" 1 2271 1 123 GLU HG2 1 124 MET H 2.829 2.193 3.651 2.215 2.105 2.378 0.088 19 0 "[ . 1 . 2]" 1 2272 1 123 GLU HG2 1 126 ARG HE 3.645 2.825 4.705 4.701 3.749 4.925 0.220 19 0 "[ . 1 . 2]" 1 2273 1 124 MET H 1 124 MET HA 3.206 2.576 3.991 2.818 2.776 2.858 . 0 0 "[ . 1 . 2]" 1 2274 1 124 MET H 1 124 MET ME 6.315 4.774 7.862 5.341 4.658 5.786 0.116 18 0 "[ . 1 . 2]" 1 2275 1 124 MET H 1 124 MET HG2 3.139 2.588 4.010 4.010 3.655 4.334 0.324 12 0 "[ . 1 . 2]" 1 2276 1 124 MET H 1 124 MET HG3 3.127 2.614 4.036 3.414 2.439 4.367 0.331 11 0 "[ . 1 . 2]" 1 2277 1 124 MET HA 1 124 MET ME 5.903 4.443 7.349 4.483 4.219 4.729 0.224 14 0 "[ . 1 . 2]" 1 2278 1 124 MET HA 1 124 MET HG2 2.823 2.268 3.514 2.779 2.337 3.545 0.031 11 0 "[ . 1 . 2]" 1 2279 1 124 MET HA 1 124 MET HG3 3.634 2.920 4.524 2.715 2.474 2.901 0.446 12 0 "[ . 1 . 2]" 1 2280 1 124 MET HA 1 127 GLU H 2.504 . 3.232 2.681 2.660 2.705 . 0 0 "[ . 1 . 2]" 1 2281 1 124 MET QB 1 124 MET ME 4.442 3.369 5.530 3.467 3.069 3.597 0.300 14 0 "[ . 1 . 2]" 1 2282 1 124 MET QB 1 124 MET HG2 2.527 2.030 3.146 2.339 2.249 2.463 . 0 0 "[ . 1 . 2]" 1 2283 1 124 MET QB 1 125 ILE H 3.019 2.340 3.896 2.594 2.466 2.683 . 0 0 "[ . 1 . 2]" 1 2284 1 124 MET ME 1 124 MET HG2 4.531 2.603 5.641 2.404 2.274 2.545 0.329 17 0 "[ . 1 . 2]" 1 2285 1 124 MET ME 1 124 MET HG3 4.984 2.894 6.205 2.728 2.483 3.155 0.411 6 0 "[ . 1 . 2]" 1 2286 1 124 MET ME 2 19 ALA MB 5.082 4.083 6.327 4.325 3.896 4.681 0.187 16 0 "[ . 1 . 2]" 1 2287 1 124 MET ME 2 18 ALA MB 5.995 4.611 7.467 4.502 4.297 5.149 0.314 18 0 "[ . 1 . 2]" 1 2288 1 124 MET HG2 1 125 ILE H 4.111 3.186 5.306 4.332 3.117 5.082 0.069 11 0 "[ . 1 . 2]" 1 2289 1 124 MET HG3 1 125 ILE H 4.448 3.447 5.741 4.535 3.990 5.066 . 0 0 "[ . 1 . 2]" 1 2290 1 125 ILE H 1 125 ILE HA 3.017 2.338 3.559 2.875 2.858 2.896 . 0 0 "[ . 1 . 2]" 1 2291 1 125 ILE H 1 125 ILE HB 2.515 . 3.246 2.490 2.447 2.523 . 0 0 "[ . 1 . 2]" 1 2292 1 125 ILE H 1 125 ILE MD 4.410 3.543 5.490 3.946 3.880 4.017 . 0 0 "[ . 1 . 2]" 1 2293 1 125 ILE H 1 125 ILE MD 2.938 2.277 3.792 3.446 3.414 3.473 . 0 0 "[ . 1 . 2]" 1 2294 1 125 ILE H 1 125 ILE HG12 2.926 2.268 3.777 2.394 2.299 2.517 . 0 0 "[ . 1 . 2]" 1 2295 1 125 ILE H 1 125 ILE HG13 2.923 2.265 3.773 3.026 2.923 3.109 . 0 0 "[ . 1 . 2]" 1 2296 1 125 ILE H 1 125 ILE MG 4.475 3.395 5.571 3.801 3.788 3.811 . 0 0 "[ . 1 . 2]" 1 2297 1 125 ILE H 1 126 ARG H 2.772 2.148 3.578 2.679 2.567 2.794 . 0 0 "[ . 1 . 2]" 1 2298 1 125 ILE H 1 126 ARG H 2.922 2.265 3.771 2.448 2.393 2.496 . 0 0 "[ . 1 . 2]" 1 2299 1 125 ILE HA 1 125 ILE HB 3.111 2.499 3.873 3.044 3.041 3.047 . 0 0 "[ . 1 . 2]" 1 2300 1 125 ILE HA 1 125 ILE MD 3.700 2.973 4.607 2.797 2.767 2.841 0.206 16 0 "[ . 1 . 2]" 1 2301 1 125 ILE HA 1 125 ILE MD 2.633 2.116 3.278 2.291 2.260 2.318 . 0 0 "[ . 1 . 2]" 1 2302 1 125 ILE HA 1 125 ILE HG12 3.304 2.655 4.113 2.511 2.464 2.553 0.191 2 0 "[ . 1 . 2]" 1 2303 1 125 ILE HA 1 125 ILE HG13 3.489 2.803 4.344 3.731 3.701 3.757 . 0 0 "[ . 1 . 2]" 1 2304 1 125 ILE HA 1 125 ILE MG 3.580 2.676 4.457 2.433 2.397 2.475 0.279 16 0 "[ . 1 . 2]" 1 2305 1 125 ILE HA 1 126 ARG H . 3.188 4.731 3.565 3.535 3.598 . 0 0 "[ . 1 . 2]" 1 2306 1 125 ILE HA 1 127 GLU H 5.092 3.946 6.572 4.586 4.493 4.670 . 0 0 "[ . 1 . 2]" 1 2307 1 125 ILE HA 1 128 ALA H 3.980 3.097 4.799 3.593 3.528 3.658 . 0 0 "[ . 1 . 2]" 1 2308 1 125 ILE HA 1 128 ALA MB 3.317 3.232 4.130 3.070 2.962 3.156 0.270 16 0 "[ . 1 . 2]" 1 2309 1 125 ILE HA 1 129 ASP H 4.228 3.277 5.457 4.246 3.924 4.693 . 0 0 "[ . 1 . 2]" 1 2310 1 125 ILE HA 1 136 VAL MG2 3.573 2.952 4.448 3.470 3.197 3.754 . 0 0 "[ . 1 . 2]" 1 2311 1 125 ILE HB 1 125 ILE MD 4.115 3.306 5.123 3.110 3.097 3.118 0.209 11 0 "[ . 1 . 2]" 1 2312 1 125 ILE HB 1 126 ARG H 2.696 2.089 3.480 2.591 2.525 2.685 . 0 0 "[ . 1 . 2]" 1 2313 1 125 ILE MD 1 126 ARG H 4.129 3.200 5.329 3.337 3.264 3.402 . 0 0 "[ . 1 . 2]" 1 2314 1 125 ILE MD 1 127 GLU H 5.193 4.025 6.703 4.945 4.881 5.001 . 0 0 "[ . 1 . 2]" 1 2315 1 125 ILE MD 1 128 ALA H 4.573 3.544 5.902 4.600 4.532 4.711 . 0 0 "[ . 1 . 2]" 1 2316 1 125 ILE MD 1 129 ASP H 3.632 2.815 4.688 4.156 3.937 4.575 . 0 0 "[ . 1 . 2]" 1 2317 1 125 ILE MD 1 134 GLY H 4.066 3.151 5.248 4.807 4.643 5.115 . 0 0 "[ . 1 . 2]" 1 2318 1 125 ILE MD 1 135 GLN H 4.394 3.405 5.671 4.665 4.471 4.984 . 0 0 "[ . 1 . 2]" 1 2319 1 125 ILE MD 1 136 VAL H 3.302 2.559 4.262 4.012 3.876 4.263 0.001 12 0 "[ . 1 . 2]" 1 2320 1 125 ILE MD 1 136 VAL MG2 2.961 2.376 3.688 2.249 2.198 2.300 0.178 3 0 "[ . 1 . 2]" 1 2321 1 125 ILE MD 1 126 ARG H 5.338 4.289 6.646 4.964 4.940 5.002 . 0 0 "[ . 1 . 2]" 1 2322 1 125 ILE MD 1 136 VAL MG2 3.318 2.666 4.131 2.736 2.625 3.012 0.041 11 0 "[ . 1 . 2]" 1 2323 1 125 ILE HG12 1 125 ILE MG 4.227 2.896 5.262 3.079 3.067 3.086 . 0 0 "[ . 1 . 2]" 1 2324 1 125 ILE HG13 1 125 ILE MG 4.159 3.141 5.178 2.861 2.847 2.887 0.294 17 0 "[ . 1 . 2]" 1 2325 1 125 ILE MG 1 126 ARG H 4.718 3.591 5.874 3.392 3.310 3.461 0.281 9 0 "[ . 1 . 2]" 1 2326 1 125 ILE MG 1 134 GLY HA3 4.251 3.216 5.292 4.953 4.439 5.301 0.009 1 0 "[ . 1 . 2]" 1 2327 1 125 ILE MG 1 135 GLN HA 4.434 3.362 5.520 4.069 3.725 4.432 . 0 0 "[ . 1 . 2]" 1 2328 1 125 ILE MG 1 136 VAL MG2 3.855 2.897 4.799 3.281 3.033 3.539 . 0 0 "[ . 1 . 2]" 1 2329 1 126 ARG H 1 126 ARG HA 3.336 2.680 4.153 2.844 2.832 2.867 . 0 0 "[ . 1 . 2]" 1 2330 1 126 ARG H 1 126 ARG HB2 3.120 2.418 4.027 2.425 2.390 2.486 0.028 17 0 "[ . 1 . 2]" 1 2331 1 126 ARG H 1 126 ARG QD 5.183 4.017 6.690 4.502 3.713 4.789 0.304 19 0 "[ . 1 . 2]" 1 2332 1 126 ARG H 1 126 ARG HG2 4.827 3.741 6.230 4.350 3.580 4.674 0.161 11 0 "[ . 1 . 2]" 1 2333 1 126 ARG H 1 127 GLU H 3.033 2.351 3.915 2.838 2.792 2.872 . 0 0 "[ . 1 . 2]" 1 2334 1 126 ARG H 1 128 ALA H 5.569 4.316 5.663 4.306 4.260 4.350 0.056 11 0 "[ . 1 . 2]" 1 2335 1 126 ARG H 1 129 ASP H 4.544 3.522 5.865 4.855 4.755 5.089 . 0 0 "[ . 1 . 2]" 1 2336 1 126 ARG HA 1 126 ARG QB 3.028 2.433 3.770 2.399 2.368 2.429 0.065 6 0 "[ . 1 . 2]" 1 2337 1 126 ARG HA 1 126 ARG HE 3.317 2.571 4.281 4.419 3.952 4.697 0.416 4 0 "[ . 1 . 2]" 1 2338 1 126 ARG HA 1 129 ASP H 3.070 2.379 3.962 3.652 3.451 3.826 . 0 0 "[ . 1 . 2]" 1 2339 1 126 ARG HA 1 129 ASP HB2 3.218 2.586 4.006 3.167 2.769 3.573 . 0 0 "[ . 1 . 2]" 1 2340 1 126 ARG HA 1 129 ASP HB3 3.627 2.914 4.516 3.106 2.858 3.435 0.056 8 0 "[ . 1 . 2]" 1 2341 1 126 ARG QB 1 126 ARG HE 2.867 2.222 3.700 2.176 2.061 2.314 0.161 14 0 "[ . 1 . 2]" 1 2342 1 126 ARG HB2 1 127 GLU H 2.952 2.288 3.810 3.559 2.670 3.826 0.016 6 0 "[ . 1 . 2]" 1 2343 1 126 ARG HB3 1 127 GLU H 2.317 . 2.990 2.158 2.011 2.333 . 0 0 "[ . 1 . 2]" 1 2344 1 126 ARG QD 1 126 ARG HE 2.197 . 2.836 2.480 2.271 2.537 . 0 0 "[ . 1 . 2]" 1 2345 1 126 ARG QD 1 127 GLU H 4.912 3.807 6.340 4.803 4.382 5.203 . 0 0 "[ . 1 . 2]" 1 2346 1 126 ARG HE 1 126 ARG HG2 3.258 2.525 4.205 3.072 2.418 3.956 0.107 1 0 "[ . 1 . 2]" 1 2347 1 126 ARG HE 1 126 ARG HG3 3.012 2.334 3.888 3.252 2.402 3.941 0.053 11 0 "[ . 1 . 2]" 1 2348 1 126 ARG HG2 1 127 GLU H 4.407 3.416 5.688 4.068 3.652 5.135 . 0 0 "[ . 1 . 2]" 1 2349 1 127 GLU H 1 127 GLU HA 2.771 2.226 3.450 2.864 2.827 2.888 . 0 0 "[ . 1 . 2]" 1 2350 1 127 GLU H 1 127 GLU HG2 3.255 2.523 4.201 3.822 3.609 4.413 0.212 1 0 "[ . 1 . 2]" 1 2351 1 127 GLU H 1 127 GLU HG3 3.196 2.477 4.125 2.779 2.353 4.501 0.376 15 0 "[ . 1 . 2]" 1 2352 1 127 GLU H 1 128 ALA H 2.807 2.176 3.623 2.731 2.649 2.787 . 0 0 "[ . 1 . 2]" 1 2353 1 127 GLU H 1 128 ALA H 2.243 . 2.895 2.336 2.297 2.376 . 0 0 "[ . 1 . 2]" 1 2354 1 127 GLU H 1 128 ALA MB 3.980 3.085 5.137 4.486 4.379 4.553 . 0 0 "[ . 1 . 2]" 1 2355 1 127 GLU HA 1 127 GLU QB 2.304 . 2.869 2.408 2.365 2.422 . 0 0 "[ . 1 . 2]" 1 2356 1 127 GLU HA 1 127 GLU QG 2.967 2.384 3.694 2.325 2.285 2.340 0.099 15 0 "[ . 1 . 2]" 1 2357 1 127 GLU HA 1 128 ALA H 3.106 2.903 4.009 3.568 3.547 3.581 . 0 0 "[ . 1 . 2]" 1 2358 1 127 GLU QB 1 128 ALA H 2.801 2.171 3.615 2.639 2.424 2.697 . 0 0 "[ . 1 . 2]" 1 2359 1 127 GLU HG2 1 128 ALA H 4.342 3.365 5.604 4.879 3.675 5.137 . 0 0 "[ . 1 . 2]" 1 2360 1 127 GLU HG3 1 128 ALA H 3.576 2.771 4.616 4.545 4.484 4.773 0.157 15 0 "[ . 1 . 2]" 1 2361 1 128 ALA H 1 128 ALA HA 2.911 2.256 3.757 2.939 2.900 2.959 . 0 0 "[ . 1 . 2]" 1 2362 1 128 ALA H 1 128 ALA MB . 2.469 3.126 2.285 2.248 2.316 0.221 11 0 "[ . 1 . 2]" 1 2363 1 128 ALA H 1 129 ASP H 2.362 . 3.048 2.540 2.475 2.644 . 0 0 "[ . 1 . 2]" 1 2364 1 128 ALA H 1 129 ASP HB3 4.019 3.115 5.187 5.002 4.881 5.175 . 0 0 "[ . 1 . 2]" 1 2365 1 128 ALA H 1 136 VAL MG2 4.686 4.383 6.048 4.922 4.768 5.213 . 0 0 "[ . 1 . 2]" 1 2366 1 128 ALA HA 1 129 ASP H 3.334 2.584 4.303 3.393 3.267 3.497 . 0 0 "[ . 1 . 2]" 1 2367 1 128 ALA HA 1 144 MET ME 6.177 4.663 7.690 5.162 4.388 6.826 0.275 13 0 "[ . 1 . 2]" 1 2368 1 128 ALA HA 1 144 MET HG2 3.936 3.162 4.900 5.122 4.111 5.306 0.406 7 0 "[ . 1 . 2]" 1 2369 1 128 ALA MB 1 129 ASP H . 2.965 3.682 3.151 2.918 3.353 0.047 16 0 "[ . 1 . 2]" 1 2370 1 128 ALA MB 1 129 ASP HB2 4.287 3.444 5.337 3.330 3.218 3.851 0.226 5 0 "[ . 1 . 2]" 1 2371 1 128 ALA MB 1 136 VAL HA 5.132 4.123 6.389 4.594 4.137 5.016 . 0 0 "[ . 1 . 2]" 1 2372 1 128 ALA MB 1 136 VAL HB 5.018 3.544 6.247 3.716 3.260 3.987 0.284 15 0 "[ . 1 . 2]" 1 2373 1 128 ALA MB 1 136 VAL MG1 3.392 2.725 4.223 2.993 2.703 3.526 0.022 20 0 "[ . 1 . 2]" 1 2374 1 128 ALA MB 1 136 VAL MG2 3.484 2.799 4.338 2.630 2.570 2.746 0.229 18 0 "[ . 1 . 2]" 1 2375 1 128 ALA MB 1 136 VAL MG2 3.289 2.643 4.095 2.600 2.545 2.705 0.098 18 0 "[ . 1 . 2]" 1 2376 1 128 ALA MB 1 141 PHE HA 4.403 3.538 5.482 4.844 4.447 5.552 0.070 15 0 "[ . 1 . 2]" 1 2377 1 128 ALA MB 1 144 MET QB 3.814 3.064 4.748 3.473 2.985 4.888 0.140 16 0 "[ . 1 . 2]" 1 2378 1 128 ALA MB 1 144 MET ME 4.437 3.565 5.524 3.776 3.413 4.583 0.152 18 0 "[ . 1 . 2]" 1 2379 1 128 ALA MB 1 144 MET HG2 3.481 2.597 4.334 4.159 3.324 4.400 0.066 1 0 "[ . 1 . 2]" 1 2380 1 128 ALA MB 1 144 MET HG3 3.337 2.681 4.155 3.456 3.298 4.362 0.207 15 0 "[ . 1 . 2]" 1 2381 1 128 ALA MB 1 145 MET ME 6.419 5.157 7.992 6.012 5.028 7.872 0.129 4 0 "[ . 1 . 2]" 1 2382 1 129 ASP H 1 129 ASP HA 2.821 2.186 3.641 2.915 2.870 2.938 . 0 0 "[ . 1 . 2]" 1 2383 1 129 ASP H 1 129 ASP HB2 2.477 . 3.197 2.574 2.448 2.651 . 0 0 "[ . 1 . 2]" 1 2384 1 129 ASP H 1 129 ASP HB3 2.418 . 3.121 2.637 2.583 2.702 . 0 0 "[ . 1 . 2]" 1 2385 1 129 ASP H 1 130 ILE H 3.577 2.772 4.617 4.141 3.944 4.365 . 0 0 "[ . 1 . 2]" 1 2386 1 129 ASP H 1 130 ILE H 3.778 2.928 4.876 4.090 3.903 4.299 . 0 0 "[ . 1 . 2]" 1 2387 1 129 ASP H 1 130 ILE MD 3.769 2.921 4.865 4.438 4.253 4.685 . 0 0 "[ . 1 . 2]" 1 2388 1 129 ASP H 1 130 ILE HG12 4.419 3.425 5.704 4.288 4.136 4.544 . 0 0 "[ . 1 . 2]" 1 2389 1 129 ASP H 1 136 VAL MG2 4.686 3.765 5.834 4.842 4.436 5.411 . 0 0 "[ . 1 . 2]" 1 2390 1 129 ASP HA 1 130 ILE H 2.236 . 2.886 2.317 2.193 2.453 . 0 0 "[ . 1 . 2]" 1 2391 1 129 ASP HA 1 131 ASP H 3.100 2.402 4.001 2.841 2.832 2.889 . 0 0 "[ . 1 . 2]" 1 2392 1 129 ASP HA 1 136 VAL MG2 4.549 3.655 5.663 4.058 3.669 4.637 . 0 0 "[ . 1 . 2]" 1 2393 1 129 ASP HA 1 137 ASN H 4.831 3.744 6.235 6.079 5.729 6.289 0.054 11 0 "[ . 1 . 2]" 1 2394 1 129 ASP HB2 1 130 ILE H 2.880 2.232 3.717 3.170 2.939 3.430 . 0 0 "[ . 1 . 2]" 1 2395 1 129 ASP HB2 1 135 GLN H 4.406 3.415 5.687 3.466 3.370 3.949 0.045 8 0 "[ . 1 . 2]" 1 2396 1 129 ASP HB2 1 136 VAL MG2 4.664 3.747 5.806 3.753 3.614 3.986 0.133 3 0 "[ . 1 . 2]" 1 2397 1 129 ASP HB3 1 130 ILE H 2.985 2.313 3.853 3.895 3.788 4.005 0.152 1 0 "[ . 1 . 2]" 1 2398 1 129 ASP HB3 1 136 VAL MG2 5.488 4.409 6.832 5.998 5.504 6.629 . 0 0 "[ . 1 . 2]" 1 2399 1 130 ILE H 1 130 ILE HA 2.819 2.385 3.639 2.964 2.955 2.974 . 0 0 "[ . 1 . 2]" 1 2400 1 130 ILE H 1 130 ILE HB 2.512 . 3.242 2.584 2.544 2.628 . 0 0 "[ . 1 . 2]" 1 2401 1 130 ILE H 1 130 ILE MD 4.616 3.709 5.747 3.954 3.894 3.993 . 0 0 "[ . 1 . 2]" 1 2402 1 130 ILE H 1 130 ILE MD 2.749 2.130 3.548 3.460 3.434 3.481 . 0 0 "[ . 1 . 2]" 1 2403 1 130 ILE H 1 130 ILE HG12 2.702 2.094 3.487 2.588 2.555 2.626 . 0 0 "[ . 1 . 2]" 1 2404 1 130 ILE H 1 130 ILE HG13 2.602 2.017 3.358 2.594 2.452 2.711 . 0 0 "[ . 1 . 2]" 1 2405 1 130 ILE H 1 130 ILE MG 4.243 3.209 5.282 3.279 3.257 3.318 . 0 0 "[ . 1 . 2]" 1 2406 1 130 ILE H 1 132 GLY H 4.015 3.112 5.182 3.529 3.466 3.598 . 0 0 "[ . 1 . 2]" 1 2407 1 130 ILE H 1 134 GLY H 5.433 4.211 7.012 6.261 5.932 6.961 . 0 0 "[ . 1 . 2]" 1 2408 1 130 ILE H 1 136 VAL HA 5.326 4.128 6.874 5.452 5.225 5.635 . 0 0 "[ . 1 . 2]" 1 2409 1 130 ILE H 1 137 ASN H 5.739 4.448 7.407 6.007 5.842 6.106 . 0 0 "[ . 1 . 2]" 1 2410 1 130 ILE H 1 140 GLU H 4.726 3.663 6.400 6.234 6.097 6.406 0.006 1 0 "[ . 1 . 2]" 1 2411 1 130 ILE H 1 140 GLU HA 4.056 3.144 5.235 5.021 4.884 5.249 0.014 13 0 "[ . 1 . 2]" 1 2412 1 130 ILE H 1 140 GLU HB2 3.744 2.902 4.832 4.999 4.888 5.107 0.275 11 0 "[ . 1 . 2]" 1 2413 1 130 ILE H 1 140 GLU HB3 3.678 2.851 4.747 3.902 3.726 4.170 . 0 0 "[ . 1 . 2]" 1 2414 1 130 ILE HA 1 130 ILE HB 3.169 2.546 3.945 3.013 3.005 3.018 . 0 0 "[ . 1 . 2]" 1 2415 1 130 ILE HA 1 130 ILE MD 4.228 3.397 5.264 3.236 3.128 3.343 0.269 9 0 "[ . 1 . 2]" 1 2416 1 130 ILE HA 1 130 ILE HG12 3.086 2.479 3.842 2.460 2.440 2.496 0.039 14 0 "[ . 1 . 2]" 1 2417 1 130 ILE HA 1 130 ILE HG13 3.499 2.811 4.356 3.641 3.629 3.654 . 0 0 "[ . 1 . 2]" 1 2418 1 130 ILE HA 1 130 ILE MG 2.705 2.647 3.368 2.326 2.302 2.347 0.345 4 0 "[ . 1 . 2]" 1 2419 1 130 ILE HB 1 130 ILE MD 4.137 3.124 5.150 2.896 2.829 2.955 0.295 4 0 "[ . 1 . 2]" 1 2420 1 130 ILE HB 1 131 ASP H 3.014 2.336 3.890 2.459 2.359 2.546 . 0 0 "[ . 1 . 2]" 1 2421 1 130 ILE HB 1 132 GLY H 4.735 3.670 6.111 4.596 4.527 4.684 . 0 0 "[ . 1 . 2]" 1 2422 1 130 ILE MD 1 131 ASP H 3.461 2.682 4.467 3.484 3.454 3.545 . 0 0 "[ . 1 . 2]" 1 2423 1 130 ILE MD 1 132 GLY H 5.185 4.019 6.692 4.799 4.735 4.932 . 0 0 "[ . 1 . 2]" 1 2424 1 130 ILE MD 1 133 ASP H 5.742 4.450 7.411 5.844 5.708 7.259 . 0 0 "[ . 1 . 2]" 1 2425 1 130 ILE MD 1 140 GLU H 3.908 3.029 5.044 5.184 5.090 5.250 0.206 12 0 "[ . 1 . 2]" 1 2426 1 130 ILE MD 1 143 GLN HE21 5.329 3.830 6.878 4.764 4.115 5.813 . 0 0 "[ . 1 . 2]" 1 2427 1 130 ILE MD 1 143 GLN HE22 5.743 4.151 7.412 5.782 5.388 6.169 . 0 0 "[ . 1 . 2]" 1 2428 1 130 ILE MD 1 140 GLU HA 4.024 3.653 5.010 4.020 3.683 4.252 . 0 0 "[ . 1 . 2]" 1 2429 1 130 ILE MD 1 140 GLU HG2 4.130 3.318 5.142 3.331 2.967 3.882 0.351 8 0 "[ . 1 . 2]" 1 2430 1 130 ILE MD 1 140 GLU HG3 5.676 4.560 7.066 5.508 5.140 5.670 . 0 0 "[ . 1 . 2]" 1 2431 1 130 ILE MD 1 143 GLN QB 5.024 3.736 6.255 3.509 3.246 3.754 0.490 5 0 "[ . 1 . 2]" 1 2432 1 130 ILE MD 1 143 GLN HE22 5.108 4.104 6.359 6.198 5.698 6.495 0.136 5 0 "[ . 1 . 2]" 1 2433 1 130 ILE HG12 1 130 ILE MG 3.795 2.849 4.725 2.883 2.819 2.939 0.030 4 0 "[ . 1 . 2]" 1 2434 1 130 ILE HG12 1 131 ASP H 4.287 3.323 5.533 4.384 4.350 4.426 . 0 0 "[ . 1 . 2]" 1 2435 1 130 ILE HG13 1 130 ILE MG 4.386 3.324 5.461 3.092 3.058 3.126 0.266 9 0 "[ . 1 . 2]" 1 2436 1 130 ILE HG13 1 131 ASP H 4.187 3.245 5.404 4.099 3.917 4.221 . 0 0 "[ . 1 . 2]" 1 2437 1 130 ILE MG 1 131 ASP HA 5.044 3.753 6.280 3.680 3.622 3.736 0.131 9 0 "[ . 1 . 2]" 1 2438 1 130 ILE MG 1 140 GLU HG2 5.571 4.176 6.936 4.065 3.962 4.136 0.214 13 0 "[ . 1 . 2]" 1 2439 1 131 ASP H 1 131 ASP HB2 3.349 2.595 4.323 3.650 3.641 3.670 . 0 0 "[ . 1 . 2]" 1 2440 1 131 ASP H 1 131 ASP HB3 3.575 2.771 4.614 2.704 2.679 2.852 0.092 13 0 "[ . 1 . 2]" 1 2441 1 131 ASP H 1 132 GLY H 2.773 2.149 3.579 2.411 2.228 2.446 . 0 0 "[ . 1 . 2]" 1 2442 1 131 ASP H 1 132 GLY H 2.411 . 3.112 2.138 2.119 2.220 . 0 0 "[ . 1 . 2]" 1 2443 1 131 ASP H 1 132 GLY HA2 4.185 3.244 5.401 4.762 4.594 4.800 . 0 0 "[ . 1 . 2]" 1 2444 1 131 ASP H 1 132 GLY HA3 3.715 2.879 4.795 5.074 4.967 5.104 0.309 13 0 "[ . 1 . 2]" 1 2445 1 131 ASP H 1 140 GLU HB2 5.353 4.149 6.909 5.537 5.409 5.779 . 0 0 "[ . 1 . 2]" 1 2446 1 131 ASP H 1 140 GLU HG2 4.200 3.255 5.421 3.279 3.151 3.503 0.104 1 0 "[ . 1 . 2]" 1 2447 1 131 ASP H 1 140 GLU HG3 4.615 3.577 5.957 3.852 3.739 4.107 . 0 0 "[ . 1 . 2]" 1 2448 1 131 ASP HA 1 132 GLY H 3.593 2.785 4.637 3.473 3.458 3.486 . 0 0 "[ . 1 . 2]" 1 2449 1 131 ASP HB2 1 132 GLY H 4.327 3.353 5.585 3.972 3.909 4.010 . 0 0 "[ . 1 . 2]" 1 2450 1 131 ASP HB2 1 133 ASP H 4.711 3.651 6.081 3.787 3.634 5.117 0.017 2 0 "[ . 1 . 2]" 1 2451 1 131 ASP HB3 1 132 GLY H 4.615 3.577 5.957 4.095 4.073 4.131 . 0 0 "[ . 1 . 2]" 1 2452 1 131 ASP HB3 1 133 ASP H 4.964 3.847 6.407 4.542 4.396 6.493 0.086 12 0 "[ . 1 . 2]" 1 2453 1 132 GLY H 1 132 GLY HA2 2.405 . 2.726 2.380 2.368 2.442 . 0 0 "[ . 1 . 2]" 1 2454 1 132 GLY H 1 132 GLY HA3 2.664 2.065 2.844 2.917 2.907 2.948 0.104 12 0 "[ . 1 . 2]" 1 2455 1 132 GLY H 1 133 ASP H 2.743 2.126 3.540 2.463 2.329 4.207 0.667 12 1 "[ . 1 + . 2]" 1 2456 1 132 GLY H 1 133 ASP HB2 4.388 3.401 5.663 5.913 5.850 5.942 0.279 11 0 "[ . 1 . 2]" 1 2457 1 132 GLY H 1 133 ASP HB3 5.101 3.953 6.584 4.691 4.155 4.743 . 0 0 "[ . 1 . 2]" 1 2458 1 132 GLY H 1 134 GLY H 4.545 3.523 5.092 3.874 3.728 4.320 . 0 0 "[ . 1 . 2]" 1 2459 1 132 GLY H 1 135 GLN H 4.952 4.311 6.392 5.454 5.236 5.651 . 0 0 "[ . 1 . 2]" 1 2460 1 132 GLY H 1 140 GLU H 6.056 4.694 7.816 7.950 7.684 8.037 0.221 13 0 "[ . 1 . 2]" 1 2461 1 132 GLY HA2 1 133 ASP H 3.293 2.552 3.670 3.104 3.041 3.356 . 0 0 "[ . 1 . 2]" 1 2462 1 132 GLY HA2 1 134 GLY H 4.085 3.166 4.589 3.184 3.032 3.266 0.134 12 0 "[ . 1 . 2]" 1 2463 1 132 GLY HA3 1 133 ASP H 3.296 2.555 3.751 3.390 2.241 3.467 0.314 12 0 "[ . 1 . 2]" 1 2464 1 133 ASP H 1 133 ASP HA 2.927 2.269 3.778 2.883 2.315 2.924 . 0 0 "[ . 1 . 2]" 1 2465 1 133 ASP H 1 133 ASP HB2 3.007 2.330 3.881 3.594 3.559 3.837 . 0 0 "[ . 1 . 2]" 1 2466 1 133 ASP H 1 133 ASP HB3 3.227 2.501 4.165 2.630 2.585 3.062 . 0 0 "[ . 1 . 2]" 1 2467 1 133 ASP H 1 134 GLY H 2.606 2.020 3.301 2.540 2.493 3.057 . 0 0 "[ . 1 . 2]" 1 2468 1 133 ASP H 1 134 GLY HA2 3.949 3.060 5.097 4.909 4.862 5.171 0.074 12 0 "[ . 1 . 2]" 1 2469 1 133 ASP H 1 135 GLN H 3.625 3.091 4.679 3.806 3.634 4.933 0.254 12 0 "[ . 1 . 2]" 1 2470 1 133 ASP H 1 135 GLN HB3 4.714 3.654 6.084 5.948 5.417 6.151 0.067 8 0 "[ . 1 . 2]" 1 2471 1 133 ASP HA 1 134 GLY H 3.519 2.727 4.542 3.383 3.349 3.472 . 0 0 "[ . 1 . 2]" 1 2472 1 133 ASP HA 1 135 GLN H 4.749 3.681 6.130 4.281 4.235 4.343 . 0 0 "[ . 1 . 2]" 1 2473 1 133 ASP HB2 1 134 GLY H 4.609 3.572 5.079 4.204 4.139 4.379 . 0 0 "[ . 1 . 2]" 1 2474 1 133 ASP HB3 1 135 GLN H 5.394 4.180 6.962 4.204 3.910 4.257 0.270 12 0 "[ . 1 . 2]" 1 2475 1 133 ASP HB3 1 135 GLN HE21 5.567 4.315 7.185 6.839 6.184 7.222 0.037 19 0 "[ . 1 . 2]" 1 2476 1 133 ASP HB3 1 135 GLN HE22 5.840 4.526 7.538 6.446 5.549 7.659 0.121 12 0 "[ . 1 . 2]" 1 2477 1 134 GLY H 1 134 GLY HA2 2.385 . 2.835 2.385 2.360 2.399 . 0 0 "[ . 1 . 2]" 1 2478 1 134 GLY H 1 134 GLY HA3 2.480 . 3.030 2.943 2.920 2.957 . 0 0 "[ . 1 . 2]" 1 2479 1 134 GLY H 1 135 GLN H . 2.758 3.095 2.618 2.563 2.649 0.195 12 0 "[ . 1 . 2]" 1 2480 1 134 GLY H 1 135 GLN HB3 4.079 3.161 5.265 4.755 4.302 4.925 . 0 0 "[ . 1 . 2]" 1 2481 1 134 GLY HA2 1 135 GLN H 3.443 2.668 3.480 3.359 3.269 3.404 . 0 0 "[ . 1 . 2]" 1 2482 1 134 GLY HA2 1 135 GLN HE21 5.349 4.146 6.904 6.739 6.201 6.913 0.009 11 0 "[ . 1 . 2]" 1 2483 1 134 GLY HA2 1 135 GLN HE22 6.094 4.723 7.866 7.106 6.604 7.961 0.095 3 0 "[ . 1 . 2]" 1 2484 1 134 GLY HA3 1 135 GLN H 3.384 2.623 3.602 3.250 3.196 3.343 . 0 0 "[ . 1 . 2]" 1 2485 1 134 GLY HA3 1 135 GLN HA 3.939 3.165 4.904 4.628 4.613 4.654 . 0 0 "[ . 1 . 2]" 1 2486 1 135 GLN H 1 135 GLN HA 3.249 2.518 4.193 2.995 2.985 3.001 . 0 0 "[ . 1 . 2]" 1 2487 1 135 GLN H 1 135 GLN HB2 3.478 2.696 4.489 2.884 2.849 2.985 . 0 0 "[ . 1 . 2]" 1 2488 1 135 GLN H 1 135 GLN HB3 2.968 2.300 3.831 2.916 2.650 3.039 . 0 0 "[ . 1 . 2]" 1 2489 1 135 GLN H 1 135 GLN HE21 6.691 5.186 8.636 5.104 4.903 5.243 0.283 18 0 "[ . 1 . 2]" 1 2490 1 135 GLN H 1 136 VAL H 4.585 3.554 5.226 4.455 4.414 4.478 . 0 0 "[ . 1 . 2]" 1 2491 1 135 GLN H 1 136 VAL HA 6.270 4.860 8.092 4.802 4.737 4.842 0.123 18 0 "[ . 1 . 2]" 1 2492 1 135 GLN H 1 136 VAL QG 5.575 4.321 7.195 4.752 4.640 4.832 . 0 0 "[ . 1 . 2]" 1 2493 1 135 GLN HA 1 135 GLN HE21 6.181 4.791 7.978 5.398 5.310 5.457 . 0 0 "[ . 1 . 2]" 1 2494 1 135 GLN HA 1 136 VAL MG2 4.282 3.440 5.331 3.465 3.372 3.585 0.068 12 0 "[ . 1 . 2]" 1 2495 1 135 GLN HB2 1 135 GLN HE21 4.370 3.387 5.640 3.882 3.587 4.010 . 0 0 "[ . 1 . 2]" 1 2496 1 135 GLN HB2 1 135 GLN HE22 4.586 3.554 5.919 4.201 4.125 4.381 . 0 0 "[ . 1 . 2]" 1 2497 1 135 GLN HB2 1 136 VAL H 3.069 2.378 3.961 3.493 3.022 3.715 . 0 0 "[ . 1 . 2]" 1 2498 1 135 GLN HB2 1 137 ASN H 4.973 3.854 6.419 5.257 5.177 5.409 . 0 0 "[ . 1 . 2]" 1 2499 1 135 GLN HB3 1 135 GLN HE21 3.049 2.363 3.935 2.244 2.234 2.257 0.129 1 0 "[ . 1 . 2]" 1 2500 1 135 GLN HB3 1 135 GLN HE22 3.166 2.454 4.086 3.237 3.211 3.249 . 0 0 "[ . 1 . 2]" 1 2501 1 135 GLN HB3 1 136 VAL H 2.670 2.069 3.446 2.585 2.282 2.829 . 0 0 "[ . 1 . 2]" 1 2502 1 135 GLN HB3 1 137 ASN H 4.369 3.386 5.639 4.422 4.380 4.495 . 0 0 "[ . 1 . 2]" 1 2503 1 135 GLN HE21 1 136 VAL H 5.878 4.556 7.587 6.806 6.608 6.977 . 0 0 "[ . 1 . 2]" 1 2504 1 135 GLN HE22 1 136 VAL H 6.487 5.028 8.373 7.306 6.841 7.514 . 0 0 "[ . 1 . 2]" 1 2505 1 136 VAL H 1 136 VAL HA 3.135 2.430 4.046 3.001 2.987 3.023 . 0 0 "[ . 1 . 2]" 1 2506 1 136 VAL H 1 136 VAL HB 2.557 . 3.300 2.541 2.483 2.613 . 0 0 "[ . 1 . 2]" 1 2507 1 136 VAL H 1 136 VAL MG1 3.035 2.352 3.917 3.839 3.798 3.875 . 0 0 "[ . 1 . 2]" 1 2508 1 136 VAL H 1 136 VAL MG2 2.528 . 3.263 2.466 2.411 2.578 . 0 0 "[ . 1 . 2]" 1 2509 1 136 VAL H 1 137 ASN H 3.949 3.061 5.097 4.417 4.377 4.450 . 0 0 "[ . 1 . 2]" 1 2510 1 136 VAL HA 1 136 VAL HB 2.960 2.378 3.685 3.032 3.026 3.040 . 0 0 "[ . 1 . 2]" 1 2511 1 136 VAL HA 1 136 VAL MG1 2.626 2.544 3.269 2.369 2.342 2.395 0.202 1 0 "[ . 1 . 2]" 1 2512 1 136 VAL HA 1 136 VAL MG2 . 2.682 3.239 2.403 2.363 2.448 0.319 11 0 "[ . 1 . 2]" 1 2513 1 136 VAL HA 1 137 ASN H 2.141 . 2.665 2.116 2.102 2.132 . 0 0 "[ . 1 . 2]" 1 2514 1 136 VAL HA 1 137 ASN H 2.066 . 2.666 2.075 2.063 2.089 . 0 0 "[ . 1 . 2]" 1 2515 1 136 VAL HA 1 140 GLU H 4.132 3.202 5.333 4.342 4.318 4.366 . 0 0 "[ . 1 . 2]" 1 2516 1 136 VAL HB 1 137 ASN H 2.792 2.164 3.604 2.187 2.108 2.251 0.056 11 0 "[ . 1 . 2]" 1 2517 1 136 VAL MG1 1 137 ASN H 2.709 2.100 3.496 2.616 2.555 2.789 . 0 0 "[ . 1 . 2]" 1 2518 1 136 VAL MG1 1 138 TYR H 4.851 3.760 6.261 5.205 5.044 5.266 . 0 0 "[ . 1 . 2]" 1 2519 1 136 VAL MG1 1 140 GLU H 3.118 2.417 4.024 4.060 3.979 4.138 0.114 1 0 "[ . 1 . 2]" 1 2520 1 136 VAL MG1 1 140 GLU HB3 3.671 2.749 4.570 2.844 2.715 2.994 0.034 9 0 "[ . 1 . 2]" 1 2521 1 136 VAL MG1 1 141 PHE H . 2.806 3.321 2.893 2.779 3.019 0.027 11 0 "[ . 1 . 2]" 1 2522 1 136 VAL MG1 1 141 PHE HA . 2.796 3.439 3.092 2.858 3.242 . 0 0 "[ . 1 . 2]" 1 2523 1 136 VAL MG1 1 141 PHE HB2 3.544 2.647 4.412 2.507 2.443 2.558 0.204 1 0 "[ . 1 . 2]" 1 2524 1 136 VAL MG1 1 141 PHE HB3 4.040 3.046 5.030 3.861 3.760 3.945 . 0 0 "[ . 1 . 2]" 1 2525 1 136 VAL MG1 1 141 PHE QD 4.059 2.704 5.053 3.044 2.662 3.623 0.042 7 0 "[ . 1 . 2]" 1 2526 1 136 VAL MG1 1 142 VAL H 4.089 3.169 5.278 5.157 5.046 5.252 . 0 0 "[ . 1 . 2]" 1 2527 1 136 VAL MG1 1 144 MET ME 6.229 4.705 7.755 4.697 4.343 5.451 0.362 19 0 "[ . 1 . 2]" 1 2528 1 136 VAL MG2 1 137 ASN H 3.013 2.335 3.889 4.087 4.015 4.149 0.260 10 0 "[ . 1 . 2]" 1 2529 1 136 VAL MG2 1 141 PHE H 4.613 3.909 5.954 5.397 5.299 5.478 . 0 0 "[ . 1 . 2]" 1 2530 1 136 VAL MG2 1 141 PHE HA 4.727 3.798 5.885 5.224 5.012 5.352 . 0 0 "[ . 1 . 2]" 1 2531 1 136 VAL MG2 1 141 PHE QD 4.875 3.917 6.069 5.027 4.647 5.564 . 0 0 "[ . 1 . 2]" 1 2532 1 136 VAL MG2 1 144 MET ME 4.423 3.354 5.507 4.595 3.311 5.699 0.192 4 0 "[ . 1 . 2]" 1 2533 1 136 VAL MG2 1 145 MET ME 5.560 4.167 6.922 5.773 4.142 7.186 0.264 19 0 "[ . 1 . 2]" 1 2534 1 137 ASN H 1 137 ASN HA 2.813 2.260 3.502 3.000 2.995 3.004 . 0 0 "[ . 1 . 2]" 1 2535 1 137 ASN H 1 137 ASN QB 2.959 2.293 3.819 3.012 2.985 3.050 . 0 0 "[ . 1 . 2]" 1 2536 1 137 ASN H 1 137 ASN HD21 4.581 3.550 5.714 3.951 3.923 4.015 . 0 0 "[ . 1 . 2]" 1 2537 1 137 ASN H 1 137 ASN HD22 4.701 3.643 6.068 3.767 3.740 3.810 . 0 0 "[ . 1 . 2]" 1 2538 1 137 ASN H 1 138 TYR H 4.065 3.305 5.247 4.487 4.451 4.515 . 0 0 "[ . 1 . 2]" 1 2539 1 137 ASN H 1 139 GLU H 5.750 4.457 7.421 4.742 4.702 4.783 . 0 0 "[ . 1 . 2]" 1 2540 1 137 ASN H 1 140 GLU H 3.237 2.537 4.178 3.230 3.188 3.276 . 0 0 "[ . 1 . 2]" 1 2541 1 137 ASN H 1 140 GLU HA 3.915 3.034 5.053 5.040 4.995 5.086 0.033 4 0 "[ . 1 . 2]" 1 2542 1 137 ASN H 1 140 GLU HB3 2.715 2.104 3.504 3.737 3.656 3.795 0.291 19 0 "[ . 1 . 2]" 1 2543 1 137 ASN H 1 140 GLU HG2 3.295 2.554 4.253 4.394 4.348 4.442 0.189 9 0 "[ . 1 . 2]" 1 2544 1 137 ASN H 1 140 GLU HG3 3.449 2.673 4.451 3.007 2.908 3.157 . 0 0 "[ . 1 . 2]" 1 2545 1 137 ASN H 1 141 PHE H 3.979 3.084 5.136 3.747 3.671 3.832 . 0 0 "[ . 1 . 2]" 1 2546 1 137 ASN HA 1 137 ASN QB 2.118 . 2.637 2.178 2.168 2.185 . 0 0 "[ . 1 . 2]" 1 2547 1 137 ASN HA 1 137 ASN HD21 3.866 2.996 4.990 4.714 4.705 4.724 . 0 0 "[ . 1 . 2]" 1 2548 1 137 ASN HA 1 137 ASN HD22 4.053 3.141 5.231 5.149 5.119 5.174 . 0 0 "[ . 1 . 2]" 1 2549 1 137 ASN HA 1 138 TYR H 2.570 . 3.056 2.568 2.495 2.614 . 0 0 "[ . 1 . 2]" 1 2550 1 137 ASN HA 1 139 GLU H 5.220 4.046 6.737 4.503 4.408 4.582 . 0 0 "[ . 1 . 2]" 1 2551 1 137 ASN QB 1 137 ASN HD21 2.547 . 3.287 2.272 2.259 2.285 . 0 0 "[ . 1 . 2]" 1 2552 1 137 ASN QB 1 137 ASN HD22 2.609 2.022 3.367 3.271 3.265 3.277 . 0 0 "[ . 1 . 2]" 1 2553 1 137 ASN QB 1 138 TYR H 2.313 . 2.985 2.240 2.165 2.320 . 0 0 "[ . 1 . 2]" 1 2554 1 137 ASN HD21 1 138 TYR H 4.152 3.259 5.359 4.726 4.634 4.858 . 0 0 "[ . 1 . 2]" 1 2555 1 137 ASN HD21 1 139 GLU H . 4.187 5.390 3.950 3.904 4.004 0.283 10 0 "[ . 1 . 2]" 1 2556 1 137 ASN HD21 1 139 GLU HB2 4.159 3.223 5.368 4.005 3.080 4.125 0.143 9 0 "[ . 1 . 2]" 1 2557 1 137 ASN HD21 1 139 GLU HB3 3.727 2.889 4.810 3.183 3.019 4.152 . 0 0 "[ . 1 . 2]" 1 2558 1 137 ASN HD21 1 140 GLU H 5.121 3.969 5.618 3.898 3.860 3.942 0.109 12 0 "[ . 1 . 2]" 1 2559 1 137 ASN HD21 1 140 GLU HB2 4.479 3.494 5.781 4.988 4.913 5.074 . 0 0 "[ . 1 . 2]" 1 2560 1 137 ASN HD21 1 140 GLU HG2 4.280 3.317 5.524 5.055 4.854 5.216 . 0 0 "[ . 1 . 2]" 1 2561 1 137 ASN HD21 1 140 GLU HG3 3.906 3.027 5.041 3.457 3.307 3.551 . 0 0 "[ . 1 . 2]" 1 2562 1 137 ASN HD22 1 139 GLU H 5.155 3.695 5.412 5.402 5.345 5.462 0.050 4 0 "[ . 1 . 2]" 1 2563 1 137 ASN HD22 1 139 GLU HB2 4.144 3.212 5.349 5.504 4.478 5.608 0.259 12 0 "[ . 1 . 2]" 1 2564 1 137 ASN HD22 1 139 GLU HB3 3.741 2.899 4.828 4.379 4.296 5.141 0.313 9 0 "[ . 1 . 2]" 1 2565 1 137 ASN HD22 1 139 GLU HG3 4.762 3.691 6.146 6.182 6.064 6.241 0.095 7 0 "[ . 1 . 2]" 1 2566 1 137 ASN HD22 1 140 GLU H 4.380 3.395 5.469 4.617 4.510 4.703 . 0 0 "[ . 1 . 2]" 1 2567 1 137 ASN HD22 1 140 GLU HB3 4.707 3.648 6.075 6.006 5.916 6.090 0.015 19 0 "[ . 1 . 2]" 1 2568 1 137 ASN HD22 1 140 GLU HG2 4.292 3.326 5.540 4.824 4.764 4.866 . 0 0 "[ . 1 . 2]" 1 2569 1 137 ASN HD22 1 140 GLU HG3 4.421 3.426 5.706 3.364 3.322 3.388 0.104 9 0 "[ . 1 . 2]" 1 2570 1 138 TYR H 1 138 TYR HA 2.797 2.225 3.447 2.837 2.823 2.853 . 0 0 "[ . 1 . 2]" 1 2571 1 138 TYR H 1 138 TYR HB2 2.389 . 3.084 2.212 2.192 2.234 . 0 0 "[ . 1 . 2]" 1 2572 1 138 TYR H 1 138 TYR HB3 2.389 . 3.384 3.524 3.511 3.534 0.150 16 0 "[ . 1 . 2]" 1 2573 1 138 TYR H 1 138 TYR QD 3.872 3.001 4.998 2.835 2.757 2.908 0.244 18 0 "[ . 1 . 2]" 1 2574 1 138 TYR H 1 139 GLU H 2.794 2.538 3.606 2.700 2.674 2.748 . 0 0 "[ . 1 . 2]" 1 2575 1 138 TYR H 1 140 GLU H . 3.958 4.945 4.438 4.406 4.489 . 0 0 "[ . 1 . 2]" 1 2576 1 138 TYR H 1 141 PHE H 4.647 3.601 5.998 4.646 4.581 4.690 . 0 0 "[ . 1 . 2]" 1 2577 1 138 TYR HA 1 138 TYR HB2 2.548 2.047 3.172 2.985 2.975 2.994 . 0 0 "[ . 1 . 2]" 1 2578 1 138 TYR HA 1 138 TYR HB3 2.799 2.249 3.485 2.684 2.663 2.703 . 0 0 "[ . 1 . 2]" 1 2579 1 138 TYR HA 1 138 TYR QD 2.852 2.291 3.551 2.669 2.604 2.759 . 0 0 "[ . 1 . 2]" 1 2580 1 138 TYR HA 1 139 GLU H 4.121 3.194 4.755 3.549 3.538 3.562 . 0 0 "[ . 1 . 2]" 1 2581 1 138 TYR HA 1 141 PHE H 2.956 2.375 3.680 3.508 3.448 3.548 . 0 0 "[ . 1 . 2]" 1 2582 1 138 TYR HA 1 141 PHE H 2.476 . 3.196 2.463 2.377 2.517 . 0 0 "[ . 1 . 2]" 1 2583 1 138 TYR HA 1 141 PHE HB2 2.827 2.271 3.520 3.432 3.220 3.632 0.112 18 0 "[ . 1 . 2]" 1 2584 1 138 TYR HA 1 142 VAL H 3.590 2.884 4.469 3.607 3.530 3.757 . 0 0 "[ . 1 . 2]" 1 2585 1 138 TYR HB2 1 139 GLU H 2.541 . 3.280 2.398 2.353 2.690 . 0 0 "[ . 1 . 2]" 1 2586 1 138 TYR HB3 1 139 GLU H 2.886 2.237 3.725 3.216 3.104 3.272 . 0 0 "[ . 1 . 2]" 1 2587 1 138 TYR QD 1 139 GLU H 4.469 3.464 4.787 4.533 4.499 4.563 . 0 0 "[ . 1 . 2]" 1 2588 1 138 TYR QD 1 139 GLU HA 4.540 3.648 5.652 5.634 5.551 5.693 0.041 16 0 "[ . 1 . 2]" 1 2589 1 138 TYR QD 1 141 PHE QD 3.669 2.873 4.082 3.315 3.133 3.367 . 0 0 "[ . 1 . 2]" 1 2590 1 138 TYR QD 1 141 PHE QE 3.804 2.979 4.859 4.927 4.567 5.065 0.206 12 0 "[ . 1 . 2]" 1 2591 1 138 TYR QE 1 141 PHE QD 3.863 3.026 4.021 4.049 3.899 4.101 0.080 8 0 "[ . 1 . 2]" 1 2592 1 138 TYR QE 1 141 PHE QE 3.682 2.884 4.703 4.546 4.153 4.707 0.004 15 0 "[ . 1 . 2]" 1 2593 1 138 TYR QE 1 142 VAL MG2 4.735 3.804 4.991 4.512 4.375 4.659 . 0 0 "[ . 1 . 2]" 1 2594 1 139 GLU H 1 139 GLU HA 2.966 2.369 3.671 2.828 2.823 2.835 . 0 0 "[ . 1 . 2]" 1 2595 1 139 GLU H 1 139 GLU HB2 2.996 2.322 3.867 2.443 2.128 2.494 0.194 9 0 "[ . 1 . 2]" 1 2596 1 139 GLU H 1 140 GLU H 3.042 2.358 3.303 2.839 2.811 2.901 . 0 0 "[ . 1 . 2]" 1 2597 1 139 GLU H 1 141 PHE H 4.812 3.729 5.431 4.054 3.998 4.097 . 0 0 "[ . 1 . 2]" 1 2598 1 139 GLU H 1 142 VAL MG2 5.197 4.028 6.708 4.783 4.590 4.909 . 0 0 "[ . 1 . 2]" 1 2599 1 139 GLU HA 1 139 GLU HB2 2.770 2.226 3.448 2.537 2.490 2.942 . 0 0 "[ . 1 . 2]" 1 2600 1 139 GLU HA 1 139 GLU HB3 2.845 2.286 3.542 3.027 2.784 3.043 . 0 0 "[ . 1 . 2]" 1 2601 1 139 GLU HA 1 139 GLU QG 3.174 2.550 3.952 2.675 2.348 2.936 0.202 17 0 "[ . 1 . 2]" 1 2602 1 139 GLU HA 1 140 GLU H 3.382 3.249 4.365 3.594 3.581 3.609 . 0 0 "[ . 1 . 2]" 1 2603 1 139 GLU HA 1 141 PHE H 4.964 3.847 6.407 4.595 4.515 4.653 . 0 0 "[ . 1 . 2]" 1 2604 1 139 GLU HA 1 142 VAL H 3.534 2.949 4.561 3.807 3.710 3.920 . 0 0 "[ . 1 . 2]" 1 2605 1 139 GLU HA 1 142 VAL HB 2.983 2.397 3.714 3.505 3.377 3.633 . 0 0 "[ . 1 . 2]" 1 2606 1 139 GLU HA 1 142 VAL MG1 . 4.324 4.939 4.838 4.712 4.967 0.028 12 0 "[ . 1 . 2]" 1 2607 1 139 GLU HA 1 142 VAL MG2 . 3.280 3.797 3.826 3.616 3.887 0.090 20 0 "[ . 1 . 2]" 1 2608 1 139 GLU HA 1 143 GLN H 4.841 3.752 5.312 3.966 3.747 4.366 0.005 9 0 "[ . 1 . 2]" 1 2609 1 139 GLU HB2 1 140 GLU H 2.826 2.190 3.648 3.660 2.827 3.728 0.080 15 0 "[ . 1 . 2]" 1 2610 1 139 GLU HB3 1 140 GLU H 2.615 2.027 3.375 2.335 2.274 2.883 . 0 0 "[ . 1 . 2]" 1 2611 1 140 GLU H 1 140 GLU HA 2.731 2.633 3.525 2.863 2.852 2.875 . 0 0 "[ . 1 . 2]" 1 2612 1 140 GLU H 1 140 GLU HB2 2.620 2.031 3.382 2.381 2.367 2.406 . 0 0 "[ . 1 . 2]" 1 2613 1 140 GLU H 1 140 GLU HB3 2.551 . 3.292 3.554 3.541 3.559 0.267 3 0 "[ . 1 . 2]" 1 2614 1 140 GLU H 1 140 GLU HG2 2.604 2.018 3.361 3.237 3.136 3.361 0.000 11 0 "[ . 1 . 2]" 1 2615 1 140 GLU H 1 140 GLU HG3 2.499 . 3.225 2.232 2.157 2.280 . 0 0 "[ . 1 . 2]" 1 2616 1 140 GLU H 1 141 PHE H 2.660 2.062 3.371 2.576 2.530 2.607 . 0 0 "[ . 1 . 2]" 1 2617 1 140 GLU H 1 142 VAL H 3.650 2.829 4.711 4.378 4.291 4.466 . 0 0 "[ . 1 . 2]" 1 2618 1 140 GLU H 1 142 VAL MG2 5.191 4.023 6.700 5.599 5.463 5.716 . 0 0 "[ . 1 . 2]" 1 2619 1 140 GLU H 1 143 GLN H 5.459 4.843 7.046 4.831 4.742 5.068 0.101 8 0 "[ . 1 . 2]" 1 2620 1 140 GLU HA 1 140 GLU HB2 3.260 2.619 4.059 3.041 3.036 3.044 . 0 0 "[ . 1 . 2]" 1 2621 1 140 GLU HA 1 140 GLU HB3 3.368 2.706 4.193 2.536 2.518 2.547 0.188 16 0 "[ . 1 . 2]" 1 2622 1 140 GLU HA 1 140 GLU HG2 3.072 2.468 3.825 2.341 2.324 2.370 0.144 19 0 "[ . 1 . 2]" 1 2623 1 140 GLU HA 1 140 GLU HG3 3.278 2.634 4.081 3.145 3.043 3.211 . 0 0 "[ . 1 . 2]" 1 2624 1 140 GLU HA 1 141 PHE H 3.889 3.125 4.842 3.524 3.511 3.539 . 0 0 "[ . 1 . 2]" 1 2625 1 140 GLU HA 1 141 PHE H 2.609 2.022 3.367 2.734 2.726 2.745 . 0 0 "[ . 1 . 2]" 1 2626 1 140 GLU HA 1 143 GLN H 3.676 3.187 4.745 3.750 3.657 3.935 . 0 0 "[ . 1 . 2]" 1 2627 1 140 GLU HA 1 143 GLN QB 2.790 2.242 3.473 2.652 2.426 3.141 . 0 0 "[ . 1 . 2]" 1 2628 1 140 GLU HB2 1 141 PHE H 3.135 2.430 4.046 2.551 2.518 2.606 . 0 0 "[ . 1 . 2]" 1 2629 1 140 GLU HB3 1 141 PHE H 3.118 2.416 4.024 3.563 3.519 3.612 . 0 0 "[ . 1 . 2]" 1 2630 1 140 GLU HG2 1 141 PHE H 3.612 2.799 4.662 4.811 4.758 4.868 0.206 11 0 "[ . 1 . 2]" 1 2631 1 140 GLU HG3 1 141 PHE H 3.773 2.924 4.870 4.230 4.162 4.291 . 0 0 "[ . 1 . 2]" 1 2632 1 141 PHE H 1 141 PHE HA 2.865 2.302 3.567 2.849 2.834 2.864 . 0 0 "[ . 1 . 2]" 1 2633 1 141 PHE H 1 141 PHE HB2 2.500 . 3.227 2.460 2.353 2.606 . 0 0 "[ . 1 . 2]" 1 2634 1 141 PHE H 1 142 VAL H 2.597 2.251 3.352 2.905 2.820 2.953 . 0 0 "[ . 1 . 2]" 1 2635 1 141 PHE H 1 142 VAL MG2 3.620 2.806 4.672 4.667 4.588 4.712 0.040 9 0 "[ . 1 . 2]" 1 2636 1 141 PHE H 1 143 GLN H 4.364 4.082 5.632 4.229 4.162 4.313 . 0 0 "[ . 1 . 2]" 1 2637 1 141 PHE H 1 144 MET H 5.694 4.413 7.349 4.595 4.427 5.001 . 0 0 "[ . 1 . 2]" 1 2638 1 141 PHE HA 1 141 PHE HB2 2.718 2.184 3.384 2.486 2.428 2.527 . 0 0 "[ . 1 . 2]" 1 2639 1 141 PHE HA 1 141 PHE HB3 2.984 2.398 3.715 3.031 3.017 3.041 . 0 0 "[ . 1 . 2]" 1 2640 1 141 PHE HA 1 141 PHE QD 3.147 2.528 3.918 2.369 2.314 2.477 0.214 11 0 "[ . 1 . 2]" 1 2641 1 141 PHE HA 1 142 VAL H 3.391 2.978 4.377 3.643 3.620 3.664 . 0 0 "[ . 1 . 2]" 1 2642 1 141 PHE HA 1 144 MET H 3.840 2.976 4.956 3.167 2.977 3.251 . 0 0 "[ . 1 . 2]" 1 2643 1 141 PHE HA 1 144 MET H 3.569 2.867 4.443 3.586 3.259 3.785 . 0 0 "[ . 1 . 2]" 1 2644 1 141 PHE HA 1 144 MET QB 2.831 2.274 3.525 2.818 2.239 3.489 0.035 11 0 "[ . 1 . 2]" 1 2645 1 141 PHE HA 1 144 MET ME . 3.747 4.611 4.523 3.823 4.818 0.207 13 0 "[ . 1 . 2]" 1 2646 1 141 PHE HA 1 144 MET HG2 4.055 3.258 5.048 4.918 3.306 5.371 0.323 2 0 "[ . 1 . 2]" 1 2647 1 141 PHE HA 1 145 MET H 4.593 3.560 5.928 4.391 4.131 4.732 . 0 0 "[ . 1 . 2]" 1 2648 1 141 PHE HA 1 145 MET ME 4.939 3.668 6.149 6.214 5.748 6.385 0.236 10 0 "[ . 1 . 2]" 1 2649 1 141 PHE HA 1 145 MET QG 4.615 3.708 5.746 4.259 3.788 5.553 . 0 0 "[ . 1 . 2]" 1 2650 1 141 PHE HB3 1 142 VAL H 2.978 2.308 3.844 2.604 2.543 2.661 . 0 0 "[ . 1 . 2]" 1 2651 1 141 PHE HB3 1 142 VAL HA 3.920 3.150 4.880 4.430 4.262 4.581 . 0 0 "[ . 1 . 2]" 1 2652 1 141 PHE HB3 1 142 VAL MG2 4.929 3.760 6.136 3.586 3.519 3.665 0.241 12 0 "[ . 1 . 2]" 1 2653 1 141 PHE HB3 1 145 MET ME 7.120 5.421 8.864 7.348 6.939 7.600 . 0 0 "[ . 1 . 2]" 1 2654 1 141 PHE QD 1 142 VAL H 4.195 3.251 5.414 3.777 3.672 3.897 . 0 0 "[ . 1 . 2]" 1 2655 1 141 PHE QD 1 142 VAL MG2 5.541 3.601 6.899 3.317 3.215 3.482 0.386 7 0 "[ . 1 . 2]" 1 2656 1 141 PHE QD 1 145 MET ME 6.263 4.732 7.797 5.542 5.101 6.508 . 0 0 "[ . 1 . 2]" 1 2657 1 141 PHE QD 1 145 MET QG 4.526 3.636 5.635 4.249 3.831 5.511 . 0 0 "[ . 1 . 2]" 1 2658 1 141 PHE QE 1 145 MET ME 5.848 4.399 7.281 4.822 4.136 6.920 0.263 16 0 "[ . 1 . 2]" 1 2659 1 142 VAL H 1 142 VAL HA 2.761 2.378 3.564 2.890 2.852 2.922 . 0 0 "[ . 1 . 2]" 1 2660 1 142 VAL H 1 142 VAL HB 2.398 . 3.095 2.591 2.528 2.645 . 0 0 "[ . 1 . 2]" 1 2661 1 142 VAL H 1 142 VAL MG1 . 3.492 3.899 3.858 3.839 3.877 . 0 0 "[ . 1 . 2]" 1 2662 1 142 VAL H 1 142 VAL MG2 . 2.500 2.909 2.431 2.369 2.488 0.131 19 0 "[ . 1 . 2]" 1 2663 1 142 VAL H 1 143 GLN H 2.877 2.516 3.713 2.600 2.552 2.695 . 0 0 "[ . 1 . 2]" 1 2664 1 142 VAL H 1 145 MET H 5.141 3.984 6.635 5.176 4.837 5.553 . 0 0 "[ . 1 . 2]" 1 2665 1 142 VAL HA 1 142 VAL HB 2.917 2.344 3.631 3.061 3.050 3.067 . 0 0 "[ . 1 . 2]" 1 2666 1 142 VAL HA 1 142 VAL MG1 2.675 2.612 3.330 2.427 2.397 2.499 0.215 7 0 "[ . 1 . 2]" 1 2667 1 142 VAL HA 1 142 VAL MG2 2.762 2.658 3.439 2.382 2.318 2.424 0.340 4 0 "[ . 1 . 2]" 1 2668 1 142 VAL HA 1 143 GLN H 4.152 3.218 4.343 3.543 3.507 3.566 . 0 0 "[ . 1 . 2]" 1 2669 1 142 VAL HA 1 145 MET H 3.696 2.864 4.125 3.782 3.508 4.173 0.048 10 0 "[ . 1 . 2]" 1 2670 1 142 VAL HA 1 145 MET QG 3.048 3.047 3.795 3.551 2.748 4.021 0.299 18 0 "[ . 1 . 2]" 1 2671 1 142 VAL HA 1 146 THR H 4.871 3.775 6.287 4.789 3.957 5.958 . 0 0 "[ . 1 . 2]" 1 2672 1 142 VAL HA 1 146 THR MG 6.260 5.030 7.794 6.161 5.562 7.435 . 0 0 "[ . 1 . 2]" 1 2673 1 142 VAL HB 1 143 GLN H 3.037 2.354 3.920 2.585 2.522 2.732 . 0 0 "[ . 1 . 2]" 1 2674 1 142 VAL MG1 1 143 GLN H . 3.562 4.595 3.501 3.407 3.577 0.155 10 0 "[ . 1 . 2]" 1 2675 1 142 VAL MG1 1 143 GLN HA 4.280 3.807 5.329 3.619 3.540 3.691 0.267 10 0 "[ . 1 . 2]" 1 2676 1 142 VAL MG1 1 143 GLN QG 5.180 4.162 6.449 4.757 3.955 5.499 0.207 5 0 "[ . 1 . 2]" 1 2677 1 142 VAL MG1 1 146 THR H 4.776 3.701 6.164 4.350 3.662 5.451 0.039 6 0 "[ . 1 . 2]" 1 2678 1 142 VAL MG2 1 143 GLN H 3.906 3.858 5.042 3.875 3.810 4.005 0.048 19 0 "[ . 1 . 2]" 1 2679 1 142 VAL MG2 1 145 MET H 5.210 4.038 6.724 5.584 5.367 5.905 . 0 0 "[ . 1 . 2]" 1 2680 1 143 GLN H 1 143 GLN HA 3.095 2.577 3.993 2.849 2.820 2.890 . 0 0 "[ . 1 . 2]" 1 2681 1 143 GLN H 1 143 GLN QB 2.365 . 3.052 2.304 2.222 2.394 . 0 0 "[ . 1 . 2]" 1 2682 1 143 GLN H 1 143 GLN QG 3.121 2.419 4.028 3.300 2.329 4.096 0.090 4 0 "[ . 1 . 2]" 1 2683 1 143 GLN H 1 144 MET H 3.032 2.416 3.913 2.723 2.541 2.881 . 0 0 "[ . 1 . 2]" 1 2684 1 143 GLN HA 1 143 GLN QB 2.660 2.137 3.312 2.407 2.384 2.448 . 0 0 "[ . 1 . 2]" 1 2685 1 143 GLN HA 1 143 GLN QG 3.329 2.675 4.145 2.768 2.610 2.842 0.065 10 0 "[ . 1 . 2]" 1 2686 1 143 GLN HA 1 144 MET H 3.637 2.922 4.528 3.532 3.432 3.579 . 0 0 "[ . 1 . 2]" 1 2687 1 143 GLN HA 1 146 THR H 4.062 3.148 5.243 3.507 3.310 3.774 . 0 0 "[ . 1 . 2]" 1 2688 1 143 GLN HA 1 146 THR HB 3.912 3.143 4.870 3.529 3.253 4.321 . 0 0 "[ . 1 . 2]" 1 2689 1 143 GLN HA 1 146 THR MG 6.253 5.024 7.785 4.656 4.514 4.799 0.510 19 1 "[ . 1 . +2]" 1 2690 1 143 GLN HA 1 147 ALA H 5.073 3.932 6.548 6.394 5.743 6.744 0.196 18 0 "[ . 1 . 2]" 1 2691 1 143 GLN QB 1 144 MET H 2.510 . 3.240 2.152 1.994 2.294 . 0 0 "[ . 1 . 2]" 1 2692 1 143 GLN HE21 1 143 GLN QG 4.323 2.750 5.580 2.547 2.293 2.650 0.457 1 0 "[ . 1 . 2]" 1 2693 1 143 GLN HE22 1 143 GLN QG 4.865 3.171 6.279 3.408 3.291 3.452 . 0 0 "[ . 1 . 2]" 1 2694 1 144 MET H 1 144 MET HA 3.004 2.369 3.877 2.844 2.817 2.877 . 0 0 "[ . 1 . 2]" 1 2695 1 144 MET H 1 144 MET HG2 3.858 2.900 4.803 4.201 2.552 4.539 0.348 13 0 "[ . 1 . 2]" 1 2696 1 144 MET H 1 144 MET HG3 3.992 3.007 4.970 4.366 3.943 4.628 . 0 0 "[ . 1 . 2]" 1 2697 1 144 MET H 1 145 MET H 2.697 2.090 3.481 2.788 2.716 2.912 . 0 0 "[ . 1 . 2]" 1 2698 1 144 MET HA 1 144 MET QB 3.125 2.111 3.891 2.394 2.316 2.557 . 0 0 "[ . 1 . 2]" 1 2699 1 144 MET HA 1 144 MET HG2 . 3.042 3.897 3.028 2.618 3.528 0.424 11 0 "[ . 1 . 2]" 1 2700 1 144 MET HA 1 144 MET HG3 3.960 2.594 4.020 2.786 2.265 3.693 0.329 15 0 "[ . 1 . 2]" 1 2701 1 144 MET HA 1 147 ALA MB 4.326 3.176 5.386 4.136 3.416 4.862 . 0 0 "[ . 1 . 2]" 1 2702 1 144 MET QB 1 144 MET ME 3.826 2.674 4.763 3.046 2.485 3.540 0.189 19 0 "[ . 1 . 2]" 1 2703 1 144 MET QB 1 144 MET HG2 2.929 2.353 3.646 2.362 2.163 2.513 0.190 15 0 "[ . 1 . 2]" 1 2704 1 144 MET QB 1 144 MET HG3 3.146 2.328 3.917 2.323 2.166 2.517 0.162 11 0 "[ . 1 . 2]" 1 2705 1 144 MET QB 1 145 MET H 2.705 2.096 3.491 2.526 2.349 2.745 . 0 0 "[ . 1 . 2]" 1 2706 1 144 MET QB 1 145 MET ME 3.917 2.947 4.877 4.909 4.298 5.149 0.272 19 0 "[ . 1 . 2]" 1 2707 1 144 MET QB 1 146 THR H 4.540 3.519 5.860 4.655 4.476 4.863 . 0 0 "[ . 1 . 2]" 1 2708 1 144 MET ME 1 144 MET HG2 . 2.618 4.057 2.425 2.272 3.462 0.346 4 0 "[ . 1 . 2]" 1 2709 1 144 MET ME 1 144 MET HG3 . 2.986 4.626 3.091 2.421 3.369 0.565 10 2 "[ . +- . 2]" 1 2710 1 144 MET ME 1 145 MET HA 5.755 4.324 7.165 4.563 4.027 6.144 0.297 10 0 "[ . 1 . 2]" 1 2711 1 144 MET ME 2 16 VAL MG1 4.885 3.925 6.082 5.853 4.484 6.342 0.260 14 0 "[ . 1 . 2]" 1 2712 1 144 MET ME 2 12 ALA HA 3.795 3.049 4.725 3.662 3.029 3.965 0.020 16 0 "[ . 1 . 2]" 1 2713 1 144 MET ME 2 15 GLY QA 4.802 3.850 6.034 4.673 3.771 6.106 0.079 3 0 "[ . 1 . 2]" 1 2714 1 144 MET ME 2 16 VAL H 5.035 3.902 6.499 5.470 3.789 6.509 0.113 19 0 "[ . 1 . 2]" 1 2715 1 144 MET ME 2 9 LEU MD2 5.126 4.134 6.317 5.287 4.118 6.346 0.029 11 0 "[ . 1 . 2]" 1 2716 1 144 MET HG2 1 145 MET H 4.064 3.150 5.245 3.984 3.507 4.915 . 0 0 "[ . 1 . 2]" 1 2717 1 144 MET HG2 1 145 MET ME 5.431 4.094 6.761 5.670 4.472 6.944 0.183 16 0 "[ . 1 . 2]" 1 2718 1 144 MET HG3 1 145 MET H 4.213 3.265 5.438 4.810 4.578 5.242 . 0 0 "[ . 1 . 2]" 1 2719 1 145 MET H 1 145 MET HA 2.797 2.489 3.610 2.906 2.862 2.956 . 0 0 "[ . 1 . 2]" 1 2720 1 145 MET H 1 145 MET QB 2.235 . 2.885 2.014 1.764 2.129 . 0 0 "[ . 1 . 2]" 1 2721 1 145 MET H 1 145 MET QG 2.823 2.268 3.515 2.192 1.779 2.860 0.489 18 0 "[ . 1 . 2]" 1 2722 1 145 MET H 1 146 THR H 2.710 2.100 3.498 2.701 2.541 2.884 . 0 0 "[ . 1 . 2]" 1 2723 1 145 MET H 1 146 THR H 2.576 . 3.325 2.599 2.409 2.734 . 0 0 "[ . 1 . 2]" 1 2724 1 145 MET H 1 147 ALA MB 5.141 3.984 6.635 5.161 4.219 5.533 . 0 0 "[ . 1 . 2]" 1 2725 1 145 MET HA 1 145 MET HB2 2.659 2.136 3.310 2.889 2.437 3.025 . 0 0 "[ . 1 . 2]" 1 2726 1 145 MET HA 1 145 MET ME 4.674 3.455 5.819 3.513 3.206 4.231 0.249 20 0 "[ . 1 . 2]" 1 2727 1 145 MET HA 1 145 MET QG 2.657 2.346 3.308 2.719 2.272 3.441 0.133 10 0 "[ . 1 . 2]" 1 2728 1 145 MET HA 1 146 THR H 3.892 3.127 4.846 3.473 3.268 3.594 . 0 0 "[ . 1 . 2]" 1 2729 1 145 MET HA 1 146 THR H 2.732 2.117 3.526 2.789 2.763 2.809 . 0 0 "[ . 1 . 2]" 1 2730 1 145 MET QB 1 146 THR H 3.339 2.588 4.310 2.935 2.577 3.331 0.011 15 0 "[ . 1 . 2]" 1 2731 1 145 MET QB 1 146 THR MG 4.882 3.922 6.078 4.605 4.457 4.748 . 0 0 "[ . 1 . 2]" 1 2732 1 145 MET QG 1 146 THR H 4.069 3.269 5.066 3.934 3.120 4.523 0.149 19 0 "[ . 1 . 2]" 1 2733 1 146 THR H 1 146 THR HA 3.487 2.802 4.341 2.942 2.888 3.004 . 0 0 "[ . 1 . 2]" 1 2734 1 146 THR H 1 146 THR HB 4.527 3.209 5.843 3.004 2.941 3.104 0.268 3 0 "[ . 1 . 2]" 1 2735 1 146 THR H 1 146 THR MG . 3.368 3.962 3.809 3.691 3.953 . 0 0 "[ . 1 . 2]" 1 2736 1 146 THR H 1 147 ALA H 3.063 2.374 3.953 3.418 2.990 3.623 . 0 0 "[ . 1 . 2]" 1 2737 1 146 THR H 1 147 ALA MB 4.576 3.547 5.906 4.275 3.755 4.513 . 0 0 "[ . 1 . 2]" 1 2738 1 146 THR HA 1 146 THR MG 2.973 2.389 3.701 2.202 2.182 2.233 0.207 12 0 "[ . 1 . 2]" 1 2739 1 146 THR HA 1 147 ALA H 3.275 2.631 4.077 2.681 2.632 2.769 . 0 0 "[ . 1 . 2]" 1 2740 1 146 THR HA 1 147 ALA H 2.661 2.062 3.435 2.501 2.470 2.553 . 0 0 "[ . 1 . 2]" 1 2741 1 146 THR HB 1 147 ALA H 5.011 3.884 6.468 4.327 4.217 4.357 . 0 0 "[ . 1 . 2]" 1 2742 1 146 THR MG 1 147 ALA H 3.948 3.813 5.096 4.094 4.002 4.203 . 0 0 "[ . 1 . 2]" 1 2743 1 147 ALA H 1 147 ALA HA 2.761 2.218 3.437 2.993 2.989 2.996 . 0 0 "[ . 1 . 2]" 1 2744 1 147 ALA H 1 147 ALA MB 2.681 2.625 3.460 2.447 2.436 2.456 0.189 10 0 "[ . 1 . 2]" 1 2745 1 147 ALA HA 1 148 LYS H 3.066 2.376 3.957 2.250 2.225 2.276 0.151 18 0 "[ . 1 . 2]" 1 2746 1 147 ALA MB 1 148 LYS H 3.655 2.833 4.717 2.913 2.834 3.016 . 0 0 "[ . 1 . 2]" 1 2747 1 147 ALA MB 1 148 LYS HA 5.402 4.340 6.725 4.295 4.243 4.347 0.097 9 0 "[ . 1 . 2]" 1 2748 1 148 LYS H 1 148 LYS HB2 4.162 3.226 5.372 3.633 3.238 3.688 . 0 0 "[ . 1 . 2]" 1 2749 1 148 LYS HA 1 148 LYS HB2 4.044 2.693 5.035 2.515 2.333 2.634 0.360 8 0 "[ . 1 . 2]" 1 2750 1 148 LYS HA 1 148 LYS HB3 4.058 2.702 5.052 2.496 2.380 2.994 0.322 4 0 "[ . 1 . 2]" 1 2751 1 148 LYS HA 1 148 LYS QG 4.339 2.911 5.402 3.288 2.785 3.328 0.126 8 0 "[ . 1 . 2]" 1 2752 2 2 MET H 2 2 MET QB 2.151 . 2.776 2.520 2.130 2.934 0.158 1 0 "[ . 1 . 2]" 1 2753 2 2 MET H 2 2 MET QB 2.995 2.406 3.729 2.376 2.045 2.636 0.361 20 0 "[ . 1 . 2]" 1 2754 2 2 MET HA 2 2 MET QB 2.586 2.161 3.219 2.380 2.173 2.546 . 0 0 "[ . 1 . 2]" 1 2755 2 2 MET HA 2 2 MET QG 3.262 2.621 4.061 2.675 2.363 3.440 0.258 19 0 "[ . 1 . 2]" 1 2756 2 2 MET HA 2 5 PHE H 4.228 3.277 5.457 3.647 3.154 4.288 0.123 3 0 "[ . 1 . 2]" 1 2757 2 2 MET HA 2 5 PHE QB 2.888 2.320 3.355 3.447 2.529 3.744 0.389 9 0 "[ . 1 . 2]" 1 2758 2 2 MET QB 2 2 MET QG 2.058 . 2.562 2.056 2.000 2.113 . 0 0 "[ . 1 . 2]" 1 2759 2 2 MET QG 2 3 ASP H 3.893 3.128 4.847 4.252 2.875 4.886 0.253 9 0 "[ . 1 . 2]" 1 2760 2 3 ASP H 2 4 VAL H 3.085 2.391 3.982 2.824 2.669 3.169 . 0 0 "[ . 1 . 2]" 1 2761 2 3 ASP H 2 5 PHE H 5.983 4.337 7.722 4.139 4.003 4.266 0.334 13 0 "[ . 1 . 2]" 1 2762 2 3 ASP HA 2 4 VAL H 3.468 2.688 4.476 3.541 3.479 3.620 . 0 0 "[ . 1 . 2]" 1 2763 2 3 ASP HA 2 6 MET H 2.638 2.045 3.405 2.856 2.806 2.927 . 0 0 "[ . 1 . 2]" 1 2764 2 3 ASP HA 2 6 MET HB2 3.316 2.664 4.128 2.753 2.396 3.045 0.268 20 0 "[ . 1 . 2]" 1 2765 2 3 ASP HA 2 6 MET HB3 2.991 2.403 3.724 2.520 2.389 2.649 0.014 3 0 "[ . 1 . 2]" 1 2766 2 3 ASP HB2 2 4 VAL H 3.865 2.996 4.988 3.662 2.914 3.967 0.082 20 0 "[ . 1 . 2]" 1 2767 2 3 ASP HB3 2 4 VAL H 3.906 3.027 5.041 3.842 2.828 4.143 0.199 14 0 "[ . 1 . 2]" 1 2768 2 4 VAL H 2 4 VAL HA 3.207 2.486 3.215 2.888 2.848 2.927 . 0 0 "[ . 1 . 2]" 1 2769 2 4 VAL H 2 4 VAL HB 2.577 . 3.326 2.651 2.384 2.869 . 0 0 "[ . 1 . 2]" 1 2770 2 4 VAL H 2 4 VAL MG1 2.691 2.086 3.473 2.069 1.921 2.390 0.165 13 0 "[ . 1 . 2]" 1 2771 2 4 VAL H 2 4 VAL MG2 3.389 3.020 4.374 3.769 3.727 3.805 . 0 0 "[ . 1 . 2]" 1 2772 2 4 VAL H 2 5 PHE H 2.955 2.707 3.814 2.630 2.491 2.800 0.216 13 0 "[ . 1 . 2]" 1 2773 2 4 VAL H 2 6 MET H 5.185 4.019 6.692 4.744 4.279 5.144 . 0 0 "[ . 1 . 2]" 1 2774 2 4 VAL HA 2 4 VAL HB 2.950 2.370 3.329 2.459 2.375 2.579 . 0 0 "[ . 1 . 2]" 1 2775 2 4 VAL HA 2 4 VAL MG1 2.500 2.009 3.112 3.185 3.169 3.211 0.099 14 0 "[ . 1 . 2]" 1 2776 2 4 VAL HA 2 4 VAL QG 2.679 2.152 3.335 2.312 2.225 2.402 . 0 0 "[ . 1 . 2]" 1 2777 2 4 VAL HA 2 4 VAL MG2 . 2.646 3.288 2.375 2.271 2.486 0.375 15 0 "[ . 1 . 2]" 1 2778 2 4 VAL HA 2 5 PHE H . 3.816 4.306 3.503 3.404 3.582 0.412 10 0 "[ . 1 . 2]" 1 2779 2 4 VAL HA 2 7 LYS H 3.991 3.207 4.372 3.292 3.048 3.413 0.159 20 0 "[ . 1 . 2]" 1 2780 2 4 VAL HA 2 7 LYS QB 2.945 2.366 3.446 2.568 2.206 3.057 0.160 20 0 "[ . 1 . 2]" 1 2781 2 4 VAL HA 2 7 LYS QG 3.808 3.060 4.741 4.179 3.404 4.702 . 0 0 "[ . 1 . 2]" 1 2782 2 4 VAL HA 2 8 GLY H 3.800 2.945 4.905 3.886 3.055 5.000 0.095 13 0 "[ . 1 . 2]" 1 2783 2 4 VAL HB 2 5 PHE H 3.420 2.651 4.414 4.161 3.893 4.448 0.034 10 0 "[ . 1 . 2]" 1 2784 2 4 VAL MG2 2 5 PHE H 4.192 3.479 5.410 3.743 3.410 4.171 0.069 8 0 "[ . 1 . 2]" 1 2785 2 4 VAL MG2 2 7 LYS HA 4.235 3.203 5.273 5.206 4.800 5.615 0.342 18 0 "[ . 1 . 2]" 1 2786 2 5 PHE H 2 5 PHE HA . 2.929 3.665 2.807 2.780 2.831 0.149 20 0 "[ . 1 . 2]" 1 2787 2 5 PHE H 2 5 PHE QB . 2.317 2.953 2.206 2.076 2.269 0.241 17 0 "[ . 1 . 2]" 1 2788 2 5 PHE H 2 5 PHE QD 4.785 3.709 6.176 3.925 3.017 4.199 0.692 19 2 "[ . 1 . +-]" 1 2789 2 5 PHE H 2 6 MET H . 2.947 3.507 2.939 2.825 3.018 0.122 1 0 "[ . 1 . 2]" 1 2790 2 5 PHE HA 2 5 PHE QB 2.482 . 3.012 2.289 2.172 2.393 . 0 0 "[ . 1 . 2]" 1 2791 2 5 PHE HA 2 5 PHE QD 2.884 2.317 3.591 2.909 2.350 3.548 . 0 0 "[ . 1 . 2]" 1 2792 2 5 PHE HA 2 6 MET H 3.362 2.606 4.339 3.591 3.537 3.614 . 0 0 "[ . 1 . 2]" 1 2793 2 5 PHE HA 2 8 GLY H 3.930 3.046 5.072 3.681 3.083 4.778 . 0 0 "[ . 1 . 2]" 1 2794 2 5 PHE QB 2 5 PHE QD 2.738 2.200 3.409 2.154 2.130 2.179 0.070 4 0 "[ . 1 . 2]" 1 2795 2 5 PHE QB 2 6 MET H 2.653 2.352 3.424 2.700 2.385 3.502 0.078 19 0 "[ . 1 . 2]" 1 2796 2 5 PHE QE 2 9 LEU MD1 5.045 4.053 6.281 4.817 3.886 6.388 0.167 17 0 "[ . 1 . 2]" 1 2797 2 5 PHE QE 2 9 LEU MD2 5.294 4.253 6.591 4.284 3.955 5.738 0.298 8 0 "[ . 1 . 2]" 1 2798 2 6 MET H 2 6 MET HB2 3.998 2.912 4.977 3.086 2.547 3.746 0.365 11 0 "[ . 1 . 2]" 1 2799 2 6 MET H 2 6 MET QB 2.496 . 3.221 2.558 2.503 2.894 . 0 0 "[ . 1 . 2]" 1 2800 2 6 MET H 2 6 MET HB3 3.672 2.750 4.571 3.227 2.572 3.717 0.178 16 0 "[ . 1 . 2]" 1 2801 2 6 MET H 2 6 MET HG2 2.950 2.286 3.723 3.041 2.147 3.675 0.139 3 0 "[ . 1 . 2]" 1 2802 2 6 MET H 2 6 MET HG3 3.128 2.424 3.640 2.758 2.308 3.728 0.116 1 0 "[ . 1 . 2]" 1 2803 2 6 MET H 2 7 LYS H 2.832 2.195 3.655 2.617 2.211 2.829 . 0 0 "[ . 1 . 2]" 1 2804 2 6 MET HA 2 6 MET QB 3.366 2.504 4.191 2.318 2.202 2.409 0.302 3 0 "[ . 1 . 2]" 1 2805 2 6 MET HA 2 6 MET HG2 2.602 2.091 3.539 3.081 2.417 4.216 0.677 19 1 "[ . 1 . +2]" 1 2806 2 6 MET HA 2 6 MET HG3 2.752 2.211 3.426 3.284 2.889 3.721 0.295 16 0 "[ . 1 . 2]" 1 2807 2 6 MET HA 2 9 LEU H . 3.554 4.369 3.773 3.375 4.356 0.179 6 0 "[ . 1 . 2]" 1 2808 2 6 MET HA 2 9 LEU QB 3.095 2.487 3.853 3.529 2.823 4.079 0.226 14 0 "[ . 1 . 2]" 1 2809 2 6 MET HA 2 9 LEU QB 3.499 2.811 4.356 3.019 2.778 3.314 0.033 16 0 "[ . 1 . 2]" 1 2810 2 6 MET HA 2 9 LEU MD1 4.329 3.178 5.389 3.821 3.093 5.391 0.085 14 0 "[ . 1 . 2]" 1 2811 2 6 MET HA 2 9 LEU QD 3.869 3.109 4.817 3.151 2.912 3.958 0.197 5 0 "[ . 1 . 2]" 1 2812 2 6 MET HA 2 9 LEU HG 3.256 2.616 4.054 3.642 3.029 4.316 0.262 20 0 "[ . 1 . 2]" 1 2813 2 6 MET QB 2 6 MET HG2 2.271 . 3.027 2.354 2.174 2.450 . 0 0 "[ . 1 . 2]" 1 2814 2 6 MET QB 2 6 MET HG3 2.377 . 2.959 2.403 2.312 2.485 . 0 0 "[ . 1 . 2]" 1 2815 2 6 MET HB2 2 6 MET HG3 3.454 2.775 4.300 2.537 2.398 2.979 0.377 20 0 "[ . 1 . 2]" 1 2816 2 6 MET HB3 2 6 MET HG2 3.182 2.557 3.961 2.456 2.314 2.587 0.243 19 0 "[ . 1 . 2]" 1 2817 2 6 MET HB3 2 6 MET HG3 3.096 2.487 3.854 3.019 2.660 3.051 . 0 0 "[ . 1 . 2]" 1 2818 2 6 MET ME 2 6 MET HG3 3.380 3.161 4.208 3.332 3.216 3.347 . 0 0 "[ . 1 . 2]" 1 2819 2 7 LYS H 2 8 GLY H 2.669 2.068 3.445 2.602 2.363 2.761 . 0 0 "[ . 1 . 2]" 1 2820 2 7 LYS HA 2 8 GLY H 2.762 2.141 3.565 3.529 3.446 3.593 0.028 16 0 "[ . 1 . 2]" 1 2821 2 7 LYS QB 2 8 GLY H 2.503 . 3.231 2.597 1.963 2.970 . 0 0 "[ . 1 . 2]" 1 2822 2 8 GLY H 2 8 GLY HA2 2.743 2.204 3.415 2.862 2.831 2.907 . 0 0 "[ . 1 . 2]" 1 2823 2 8 GLY H 2 8 GLY QA 2.114 . 2.728 2.244 2.234 2.260 . 0 0 "[ . 1 . 2]" 1 2824 2 8 GLY H 2 8 GLY HA3 2.693 2.164 3.353 2.345 2.335 2.358 . 0 0 "[ . 1 . 2]" 1 2825 2 8 GLY H 2 9 LEU H 2.824 2.451 3.645 2.713 2.586 2.831 . 0 0 "[ . 1 . 2]" 1 2826 2 8 GLY QA 2 9 LEU H 2.985 2.313 3.853 2.870 2.737 2.947 . 0 0 "[ . 1 . 2]" 1 2827 2 8 GLY QA 2 12 ALA H 4.663 3.614 6.018 3.838 3.553 4.471 0.061 16 0 "[ . 1 . 2]" 1 2828 2 8 GLY HA2 2 9 LEU H 3.323 2.670 4.137 2.912 2.688 3.274 . 0 0 "[ . 1 . 2]" 1 2829 2 8 GLY HA2 2 11 LYS QB 3.137 2.520 3.905 2.640 2.405 3.003 0.115 9 0 "[ . 1 . 2]" 1 2830 2 8 GLY HA3 2 9 LEU H 3.329 2.675 4.144 3.029 2.813 3.209 . 0 0 "[ . 1 . 2]" 1 2831 2 8 GLY HA3 2 11 LYS QB 3.280 2.635 4.083 3.684 2.763 4.226 0.143 3 0 "[ . 1 . 2]" 1 2832 2 9 LEU H 2 9 LEU HA 2.988 2.316 3.856 2.802 2.720 2.912 . 0 0 "[ . 1 . 2]" 1 2833 2 9 LEU H 2 9 LEU HA 3.044 2.446 3.790 2.706 2.646 2.790 . 0 0 "[ . 1 . 2]" 1 2834 2 9 LEU H 2 9 LEU QB 2.816 2.262 3.506 2.179 2.128 2.312 0.134 19 0 "[ . 1 . 2]" 1 2835 2 9 LEU H 2 9 LEU QB 2.225 . 2.872 2.146 2.108 2.204 . 0 0 "[ . 1 . 2]" 1 2836 2 9 LEU H 2 9 LEU MD1 5.071 3.844 6.313 3.965 3.686 4.377 0.158 4 0 "[ . 1 . 2]" 1 2837 2 9 LEU H 2 9 LEU QD 3.278 2.541 4.231 3.568 3.381 3.757 . 0 0 "[ . 1 . 2]" 1 2838 2 9 LEU H 2 9 LEU MD2 5.416 4.052 6.743 4.088 3.817 4.262 0.235 6 0 "[ . 1 . 2]" 1 2839 2 9 LEU H 2 9 LEU HG 3.047 2.448 3.793 3.419 2.777 4.520 0.727 16 1 "[ . 1 .+ 2]" 1 2840 2 9 LEU HA 2 9 LEU QB 2.845 2.286 3.542 2.426 2.188 2.561 0.098 5 0 "[ . 1 . 2]" 1 2841 2 9 LEU HA 2 9 LEU QB 2.326 . 2.896 2.215 2.152 2.302 . 0 0 "[ . 1 . 2]" 1 2842 2 9 LEU HA 2 9 LEU MD1 4.057 3.260 5.051 3.452 2.302 3.805 0.958 20 1 "[ . 1 . +]" 1 2843 2 9 LEU HA 2 9 LEU QD 2.609 2.096 3.248 2.442 2.168 3.051 . 0 0 "[ . 1 . 2]" 1 2844 2 9 LEU HA 2 9 LEU MD2 3.681 2.458 4.583 2.841 2.197 4.157 0.261 16 0 "[ . 1 . 2]" 1 2845 2 9 LEU HA 2 9 LEU HG 3.129 2.514 3.896 2.879 2.329 3.760 0.185 12 0 "[ . 1 . 2]" 1 2846 2 9 LEU HA 2 12 ALA H 4.033 3.126 5.205 3.636 3.198 3.820 . 0 0 "[ . 1 . 2]" 1 2847 2 9 LEU HA 2 12 ALA MB 2.895 2.326 3.604 2.950 2.289 3.607 0.037 5 0 "[ . 1 . 2]" 1 2848 2 9 LEU QB 2 9 LEU QD 2.444 . 3.043 1.909 1.885 2.015 0.079 10 0 "[ . 1 . 2]" 1 2849 2 9 LEU QB 2 10 SER H 3.211 2.580 3.998 2.676 2.392 3.442 0.188 7 0 "[ . 1 . 2]" 1 2850 2 9 LEU QD 2 12 ALA H 4.609 3.572 5.949 4.656 4.197 4.988 . 0 0 "[ . 1 . 2]" 1 2851 2 11 LYS H 2 12 ALA H 2.692 2.086 3.475 2.308 2.065 2.446 0.021 5 0 "[ . 1 . 2]" 1 2852 2 11 LYS QB 2 12 ALA H 2.973 2.304 3.837 2.882 2.441 3.490 . 0 0 "[ . 1 . 2]" 1 2853 2 11 LYS QD 2 12 ALA H 4.363 3.381 5.631 4.938 4.581 5.493 . 0 0 "[ . 1 . 2]" 1 2854 2 12 ALA H 2 12 ALA HA 2.683 2.656 3.463 2.886 2.833 2.951 . 0 0 "[ . 1 . 2]" 1 2855 2 12 ALA H 2 12 ALA MB 2.519 2.451 3.251 2.285 2.235 2.334 0.216 12 0 "[ . 1 . 2]" 1 2856 2 12 ALA HA 2 15 GLY H 2.953 2.289 3.811 3.411 2.884 3.583 . 0 0 "[ . 1 . 2]" 1 2857 2 12 ALA MB 2 13 LYS H 3.838 3.084 4.778 2.940 2.757 3.259 0.327 10 0 "[ . 1 . 2]" 1 2858 2 13 LYS HA 2 16 VAL H 4.592 3.559 5.927 3.992 3.391 4.653 0.168 17 0 "[ . 1 . 2]" 1 2859 2 13 LYS HA 2 16 VAL HB 3.482 2.798 4.335 3.923 3.235 4.519 0.184 18 0 "[ . 1 . 2]" 1 2860 2 14 GLU H 2 15 GLY H 3.058 2.370 3.947 2.912 2.571 3.584 . 0 0 "[ . 1 . 2]" 1 2861 2 14 GLU HA 2 17 VAL H 4.209 3.262 5.432 3.862 3.448 4.279 . 0 0 "[ . 1 . 2]" 1 2862 2 14 GLU HA 2 17 VAL HB 3.396 2.729 4.228 3.868 2.664 4.326 0.098 19 0 "[ . 1 . 2]" 1 2863 2 14 GLU QB 2 15 GLY H 2.963 2.296 3.824 2.578 1.988 3.593 0.308 5 0 "[ . 1 . 2]" 1 2864 2 14 GLU QB 2 15 GLY QA 4.648 3.734 5.787 3.649 3.484 3.936 0.250 6 0 "[ . 1 . 2]" 1 2865 2 15 GLY H 2 15 GLY QA . 2.456 2.814 2.265 2.258 2.272 0.198 3 0 "[ . 1 . 2]" 1 2866 2 15 GLY H 2 16 VAL H 3.088 2.914 3.986 2.787 2.702 2.846 0.212 9 0 "[ . 1 . 2]" 1 2867 2 15 GLY QA 2 16 VAL H 3.681 2.957 4.583 2.774 2.732 2.798 0.225 2 0 "[ . 1 . 2]" 1 2868 2 15 GLY QA 2 16 VAL H 3.190 2.472 4.117 2.501 2.482 2.516 . 0 0 "[ . 1 . 2]" 1 2869 2 15 GLY QA 2 18 ALA H 4.500 3.616 5.602 3.821 3.564 4.538 0.052 9 0 "[ . 1 . 2]" 1 2870 2 15 GLY QA 2 18 ALA MB 4.416 3.548 5.498 4.030 3.523 4.882 0.025 1 0 "[ . 1 . 2]" 1 2871 2 15 GLY QA 2 18 ALA MB 3.925 3.153 4.887 3.982 3.503 4.758 . 0 0 "[ . 1 . 2]" 1 2872 2 16 VAL H 2 16 VAL HA 2.862 2.300 3.563 2.845 2.796 2.893 . 0 0 "[ . 1 . 2]" 1 2873 2 16 VAL H 2 16 VAL HB 3.098 2.401 3.437 2.290 2.244 2.317 0.157 18 0 "[ . 1 . 2]" 1 2874 2 16 VAL H 2 16 VAL MG1 3.945 2.970 4.911 2.752 2.685 2.833 0.285 2 0 "[ . 1 . 2]" 1 2875 2 16 VAL H 2 16 VAL QG 3.182 2.466 4.107 2.679 2.625 2.742 . 0 0 "[ . 1 . 2]" 1 2876 2 16 VAL H 2 16 VAL MG2 4.712 3.586 5.866 3.683 3.648 3.708 . 0 0 "[ . 1 . 2]" 1 2877 2 16 VAL H 2 17 VAL H 3.563 2.761 4.599 2.730 2.602 2.796 0.159 13 0 "[ . 1 . 2]" 1 2878 2 16 VAL H 2 19 ALA MB 4.881 3.783 6.300 5.773 5.085 6.305 0.005 2 0 "[ . 1 . 2]" 1 2879 2 16 VAL HA 2 16 VAL HB 3.184 2.558 3.953 2.664 2.626 2.707 . 0 0 "[ . 1 . 2]" 1 2880 2 16 VAL HA 2 16 VAL QG 2.653 2.131 3.303 2.156 2.134 2.204 . 0 0 "[ . 1 . 2]" 1 2881 2 16 VAL HA 2 17 VAL H 3.179 2.464 4.103 2.708 2.662 2.733 . 0 0 "[ . 1 . 2]" 1 2882 2 16 VAL HA 2 17 VAL H 3.007 2.416 3.744 3.125 2.932 3.351 . 0 0 "[ . 1 . 2]" 1 2883 2 16 VAL HA 2 18 ALA MB 3.122 2.508 3.887 3.509 3.231 3.688 . 0 0 "[ . 1 . 2]" 1 2884 2 16 VAL HA 2 19 ALA MB 4.831 3.881 6.014 3.787 3.648 4.549 0.233 17 0 "[ . 1 . 2]" 1 2885 2 16 VAL HB 2 17 VAL H 3.490 2.804 4.345 4.029 3.880 4.281 . 0 0 "[ . 1 . 2]" 1 2886 2 16 VAL HB 2 17 VAL H 2.805 2.174 3.620 2.410 2.286 2.438 . 0 0 "[ . 1 . 2]" 1 2887 2 16 VAL QG 2 17 VAL H 2.780 2.155 3.588 2.217 2.118 2.334 0.037 20 0 "[ . 1 . 2]" 1 2888 2 17 VAL H 2 17 VAL HB 2.837 2.279 3.532 2.429 2.298 2.460 . 0 0 "[ . 1 . 2]" 1 2889 2 17 VAL H 2 17 VAL QG 4.442 2.639 5.530 2.444 2.400 2.559 0.239 18 0 "[ . 1 . 2]" 1 2890 2 17 VAL H 2 18 ALA H 3.281 2.543 4.235 2.742 2.700 2.840 . 0 0 "[ . 1 . 2]" 1 2891 2 17 VAL H 2 18 ALA H 2.935 2.275 3.788 2.503 2.455 2.584 . 0 0 "[ . 1 . 2]" 1 2892 2 17 VAL HA 2 17 VAL HB 3.273 2.630 4.075 3.012 2.595 3.039 0.035 2 0 "[ . 1 . 2]" 1 2893 2 17 VAL HA 2 17 VAL QG 3.057 2.262 3.806 2.104 2.080 2.224 0.182 4 0 "[ . 1 . 2]" 1 2894 2 17 VAL HA 2 18 ALA H 3.261 2.527 4.209 3.545 3.371 3.588 . 0 0 "[ . 1 . 2]" 1 2895 2 17 VAL HA 2 20 ALA H 4.590 3.557 5.924 3.875 3.427 5.398 0.130 16 0 "[ . 1 . 2]" 1 2896 2 17 VAL HB 2 18 ALA H 3.481 2.698 4.102 2.804 2.663 4.134 0.035 9 0 "[ . 1 . 2]" 1 2897 2 17 VAL QG 2 18 ALA H 3.569 2.766 4.607 3.139 2.677 3.223 0.089 2 0 "[ . 1 . 2]" 1 2898 2 17 VAL QG 2 18 ALA MB 4.903 3.594 6.104 3.563 3.299 3.634 0.295 2 0 "[ . 1 . 2]" 1 2899 2 18 ALA H 2 18 ALA HA 3.173 2.459 4.095 2.832 2.796 2.901 . 0 0 "[ . 1 . 2]" 1 2900 2 18 ALA H 2 18 ALA MB 2.753 2.183 3.553 2.203 2.145 2.256 0.038 2 0 "[ . 1 . 2]" 1 2901 2 19 ALA H 2 19 ALA HA 2.901 2.248 3.744 2.860 2.839 2.969 . 0 0 "[ . 1 . 2]" 1 2902 2 20 ALA H 2 20 ALA HA 3.254 2.522 4.200 2.812 2.367 2.998 0.155 11 0 "[ . 1 . 2]" 1 2903 2 20 ALA H 2 20 ALA MB 2.800 2.170 3.614 2.762 2.393 2.982 . 0 0 "[ . 1 . 2]" 1 stop_ save_
Contact the webmaster for help, if required. Saturday, May 25, 2024 1:42:19 PM GMT (wattos1)