NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
548839 | 2lw1 | 17989 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lw1 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 1897 _Distance_constraint_stats_list.Viol_count 3212 _Distance_constraint_stats_list.Viol_total 4962.093 _Distance_constraint_stats_list.Viol_max 0.995 _Distance_constraint_stats_list.Viol_rms 0.0368 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0065 _Distance_constraint_stats_list.Viol_average_violations_only 0.0772 _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 5 LYS 0.107 0.071 18 0 "[ . 1 . 2]" 1 6 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 7 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 8 THR 1.233 0.234 15 0 "[ . 1 . 2]" 1 9 VAL 2.119 0.260 4 0 "[ . 1 . 2]" 1 10 LYS 1.565 0.260 4 0 "[ . 1 . 2]" 1 11 ARG 0.352 0.163 12 0 "[ . 1 . 2]" 1 15 LYS 0.500 0.103 11 0 "[ . 1 . 2]" 1 16 LEU 31.576 0.930 13 17 "[****.*-*****+ **** *]" 1 17 SER 19.149 0.930 13 17 "[****.-******+ **** *]" 1 18 TYR 8.958 0.655 9 2 "[ . +1 . -2]" 1 19 LYS 10.818 0.655 9 2 "[ . +1 . -2]" 1 20 LEU 22.866 0.494 3 0 "[ . 1 . 2]" 1 21 GLN 11.107 0.614 7 1 "[ . + 1 . 2]" 1 22 ARG 4.700 0.192 5 0 "[ . 1 . 2]" 1 23 GLU 6.041 0.300 18 0 "[ . 1 . 2]" 1 24 LEU 8.020 0.309 8 0 "[ . 1 . 2]" 1 25 GLU 11.466 0.758 19 3 "[ -. *1 . +2]" 1 26 GLN 12.607 0.654 13 5 "[ .* * *+ .- 2]" 1 27 LEU 22.786 0.654 13 5 "[ .* * *+ .- 2]" 1 28 PRO 0.357 0.067 10 0 "[ . 1 . 2]" 1 29 GLN 19.245 0.930 13 17 "[****.-******+ **** *]" 1 30 LEU 35.111 0.930 13 17 "[****.*-*****+ **** *]" 1 31 LEU 26.399 0.995 19 18 "[****.-******* ****+*]" 1 32 GLU 18.198 0.930 13 17 "[****.-******+ **** *]" 1 33 ASP 11.771 0.215 1 0 "[ . 1 . 2]" 1 34 LEU 14.029 0.461 3 0 "[ . 1 . 2]" 1 35 GLU 1.236 0.145 17 0 "[ . 1 . 2]" 1 36 ALA 7.177 0.568 8 1 "[ . + 1 . 2]" 1 37 LYS 13.460 0.239 4 0 "[ . 1 . 2]" 1 38 LEU 8.716 0.206 5 0 "[ . 1 . 2]" 1 39 GLU 2.116 0.568 8 1 "[ . + 1 . 2]" 1 40 ALA 5.830 0.568 8 1 "[ . + 1 . 2]" 1 41 LEU 14.687 0.226 15 0 "[ . 1 . 2]" 1 42 GLN 8.214 0.195 5 0 "[ . 1 . 2]" 1 43 THR 11.170 0.460 14 0 "[ . 1 . 2]" 1 44 GLN 7.258 0.460 14 0 "[ . 1 . 2]" 1 45 VAL 7.670 0.217 4 0 "[ . 1 . 2]" 1 46 ALA 2.974 0.195 5 0 "[ . 1 . 2]" 1 47 ASP 2.508 0.138 5 0 "[ . 1 . 2]" 1 48 ALA 0.630 0.143 1 0 "[ . 1 . 2]" 1 49 SER 1.127 0.143 1 0 "[ . 1 . 2]" 1 50 PHE 3.463 0.097 13 0 "[ . 1 . 2]" 1 51 PHE 3.954 0.166 17 0 "[ . 1 . 2]" 1 52 SER 0.934 0.143 1 0 "[ . 1 . 2]" 1 53 GLN 5.580 0.433 7 0 "[ . 1 . 2]" 1 54 PRO 6.320 0.616 15 1 "[ . 1 + 2]" 1 55 HIS 8.122 0.256 9 0 "[ . 1 . 2]" 1 56 GLU 2.213 0.122 6 0 "[ . 1 . 2]" 1 57 GLN 12.753 0.616 15 1 "[ . 1 + 2]" 1 58 THR 13.384 0.201 13 0 "[ . 1 . 2]" 1 59 GLN 10.703 0.256 9 0 "[ . 1 . 2]" 1 60 LYS 10.984 0.285 19 0 "[ . 1 . 2]" 1 61 VAL 8.387 0.285 19 0 "[ . 1 . 2]" 1 62 LEU 11.595 0.309 8 0 "[ . 1 . 2]" 1 63 ALA 9.572 0.309 8 0 "[ . 1 . 2]" 1 64 ASP 2.149 0.168 3 0 "[ . 1 . 2]" 1 65 MET 8.871 0.259 13 0 "[ . 1 . 2]" 1 66 ALA 4.139 0.259 13 0 "[ . 1 . 2]" 1 67 ALA 1.121 0.140 20 0 "[ . 1 . 2]" 1 68 ALA 8.798 0.461 3 0 "[ . 1 . 2]" 1 69 GLU 2.094 0.150 11 0 "[ . 1 . 2]" 1 70 GLN 2.999 0.272 5 0 "[ . 1 . 2]" 1 71 GLU 23.790 0.995 19 18 "[****.*-****** ****+*]" 1 72 LEU 11.170 0.428 14 0 "[ . 1 . 2]" 1 73 GLU 4.533 0.428 14 0 "[ . 1 . 2]" 1 74 GLN 3.782 0.200 14 0 "[ . 1 . 2]" 1 75 ALA 9.768 0.384 15 0 "[ . 1 . 2]" 1 76 PHE 5.546 0.256 14 0 "[ . 1 . 2]" 1 77 GLU 5.619 0.357 15 0 "[ . 1 . 2]" 1 78 ARG 9.554 0.578 4 7 "[ +. *1 -* . * **]" 1 79 TRP 17.536 0.578 4 7 "[ +. *1 -* . * **]" 1 80 GLU 10.298 0.578 4 7 "[ +. *1 -* . * **]" 1 81 TYR 3.753 0.143 5 0 "[ . 1 . 2]" 1 82 LEU 6.221 0.260 8 0 "[ . 1 . 2]" 1 83 GLU 2.700 0.180 18 0 "[ . 1 . 2]" 1 84 ALA 2.483 0.180 18 0 "[ . 1 . 2]" 1 85 LEU 7.076 0.175 18 0 "[ . 1 . 2]" 1 86 LYS 4.032 0.175 18 0 "[ . 1 . 2]" 1 87 ASN 0.389 0.079 9 0 "[ . 1 . 2]" 1 88 GLY 0.256 0.093 4 0 "[ . 1 . 2]" 1 89 GLY 1.818 0.180 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 65 MET H 1 65 MET HB2 2.659 . 3.543 2.663 2.555 2.873 . 0 0 "[ . 1 . 2]" 1 2 1 56 GLU H 1 56 GLU QB 2.742 . 3.682 2.466 2.372 2.600 . 0 0 "[ . 1 . 2]" 1 3 1 55 HIS HB3 1 56 GLU H 3.284 . 4.632 2.621 2.378 2.771 . 0 0 "[ . 1 . 2]" 1 4 1 55 HIS HB2 1 56 GLU H 3.595 . 5.211 3.865 3.732 3.975 . 0 0 "[ . 1 . 2]" 1 5 1 56 GLU H 1 56 GLU HA 2.938 . 4.017 2.825 2.748 2.870 . 0 0 "[ . 1 . 2]" 1 6 1 55 HIS HA 1 56 GLU H 3.467 . 4.970 3.516 3.483 3.555 . 0 0 "[ . 1 . 2]" 1 7 1 56 GLU H 1 57 GLN H 3.206 . 4.490 2.615 2.475 2.910 . 0 0 "[ . 1 . 2]" 1 8 1 57 GLN H 1 57 GLN HA 2.593 . 3.434 2.905 2.883 2.915 . 0 0 "[ . 1 . 2]" 1 9 1 56 GLU HA 1 57 GLN H 2.973 . 4.078 3.491 3.434 3.567 . 0 0 "[ . 1 . 2]" 1 10 1 57 GLN H 1 58 THR HA 3.780 . 5.566 4.984 4.945 5.079 . 0 0 "[ . 1 . 2]" 1 11 1 54 PRO HB3 1 57 GLN H 3.124 . 4.344 4.265 3.786 4.960 0.616 15 1 "[ . 1 + 2]" 1 12 1 57 GLN H 1 57 GLN HG2 2.733 . 3.667 2.638 1.930 3.766 0.099 14 0 "[ . 1 . 2]" 1 13 1 57 GLN H 1 57 GLN QB 2.282 . 2.933 2.537 2.357 2.680 . 0 0 "[ . 1 . 2]" 1 14 1 57 GLN H 1 58 THR MG 3.590 . 5.201 4.017 3.865 4.318 . 0 0 "[ . 1 . 2]" 1 15 1 54 PRO HA 1 55 HIS H 3.696 . 5.403 2.184 2.140 2.264 . 0 0 "[ . 1 . 2]" 1 16 1 51 PHE H 1 53 GLN H 3.210 . 4.498 4.232 4.040 4.362 . 0 0 "[ . 1 . 2]" 1 17 1 52 SER H 1 53 GLN H 2.312 . 2.980 2.299 1.964 2.480 . 0 0 "[ . 1 . 2]" 1 18 1 50 PHE QD 1 53 GLN H 3.802 . 5.609 5.157 5.001 5.293 . 0 0 "[ . 1 . 2]" 1 19 1 52 SER HA 1 53 GLN H 2.542 . 3.350 3.323 3.230 3.372 0.022 15 0 "[ . 1 . 2]" 1 20 1 53 GLN H 1 53 GLN HA 2.567 . 3.391 2.880 2.852 2.907 . 0 0 "[ . 1 . 2]" 1 21 1 51 PHE HA 1 53 GLN H 2.848 . 3.862 3.331 3.119 3.521 . 0 0 "[ . 1 . 2]" 1 22 1 50 PHE HA 1 53 GLN H 3.177 . 4.439 3.987 3.786 4.231 . 0 0 "[ . 1 . 2]" 1 23 1 52 SER QB 1 53 GLN H 2.766 . 3.722 3.209 3.058 3.326 . 0 0 "[ . 1 . 2]" 1 24 1 53 GLN H 1 53 GLN QG 2.480 . 3.249 2.587 2.351 2.974 . 0 0 "[ . 1 . 2]" 1 25 1 53 GLN H 1 53 GLN HB3 3.366 . 4.782 3.555 3.433 3.611 . 0 0 "[ . 1 . 2]" 1 26 1 53 GLN H 1 53 GLN HB2 2.421 . 3.154 2.320 2.159 2.470 . 0 0 "[ . 1 . 2]" 1 27 1 53 GLN H 1 58 THR MG 2.700 . 3.611 2.912 2.743 3.141 . 0 0 "[ . 1 . 2]" 1 28 1 50 PHE QD 1 52 SER H 3.813 . 5.631 4.999 4.938 5.105 . 0 0 "[ . 1 . 2]" 1 29 1 51 PHE HA 1 52 SER H 2.789 . 3.762 3.281 3.144 3.390 . 0 0 "[ . 1 . 2]" 1 30 1 50 PHE HA 1 52 SER H 3.082 . 4.269 3.736 3.575 3.892 . 0 0 "[ . 1 . 2]" 1 31 1 52 SER H 1 52 SER QB 2.305 . 2.969 2.383 2.269 2.552 . 0 0 "[ . 1 . 2]" 1 32 1 51 PHE HB2 1 52 SER H 3.236 . 4.545 3.522 3.275 3.769 . 0 0 "[ . 1 . 2]" 1 33 1 52 SER H 1 53 GLN QG 3.249 . 4.568 3.844 3.569 4.111 . 0 0 "[ . 1 . 2]" 1 34 1 52 SER H 1 53 GLN HB2 3.497 . 5.026 4.322 3.716 4.673 . 0 0 "[ . 1 . 2]" 1 35 1 52 SER H 1 58 THR MG 3.702 . 5.415 4.054 3.855 4.274 . 0 0 "[ . 1 . 2]" 1 36 1 51 PHE H 1 52 SER H 2.498 . 3.278 2.670 2.524 2.770 . 0 0 "[ . 1 . 2]" 1 37 1 51 PHE H 1 51 PHE QD 2.660 . 3.544 2.408 2.264 2.668 . 0 0 "[ . 1 . 2]" 1 38 1 50 PHE QE 1 51 PHE H 3.775 . 5.557 5.041 4.894 5.220 . 0 0 "[ . 1 . 2]" 1 39 1 50 PHE QD 1 51 PHE H 2.691 . 3.596 3.066 2.911 3.203 . 0 0 "[ . 1 . 2]" 1 40 1 51 PHE H 1 51 PHE HA 2.516 . 3.307 2.848 2.819 2.867 . 0 0 "[ . 1 . 2]" 1 41 1 50 PHE HA 1 51 PHE H 2.791 . 3.765 3.555 3.544 3.568 . 0 0 "[ . 1 . 2]" 1 42 1 50 PHE HB3 1 51 PHE H 2.314 . 2.984 2.474 2.309 2.605 . 0 0 "[ . 1 . 2]" 1 43 1 51 PHE H 1 51 PHE HB2 2.377 . 3.083 2.441 2.397 2.486 . 0 0 "[ . 1 . 2]" 1 44 1 50 PHE HB2 1 51 PHE H 3.366 . 4.782 3.870 3.748 3.962 . 0 0 "[ . 1 . 2]" 1 45 1 51 PHE H 1 58 THR MG 3.525 . 5.078 4.170 4.077 4.238 . 0 0 "[ . 1 . 2]" 1 46 1 45 VAL HA 1 51 PHE H 3.554 . 5.133 5.189 5.149 5.224 0.091 12 0 "[ . 1 . 2]" 1 47 1 49 SER H 1 50 PHE H 2.530 . 3.330 2.417 2.346 2.605 . 0 0 "[ . 1 . 2]" 1 48 1 50 PHE H 1 52 SER H 3.780 . 5.566 3.907 3.673 4.056 . 0 0 "[ . 1 . 2]" 1 49 1 50 PHE H 1 51 PHE QD 3.812 . 5.628 4.222 3.987 4.636 . 0 0 "[ . 1 . 2]" 1 50 1 47 ASP H 1 50 PHE H 3.349 . 4.751 4.695 4.514 4.817 0.066 5 0 "[ . 1 . 2]" 1 51 1 49 SER HA 1 50 PHE H 2.653 . 3.533 3.357 3.334 3.405 . 0 0 "[ . 1 . 2]" 1 52 1 50 PHE H 1 50 PHE HA 2.457 . 3.212 2.797 2.772 2.815 . 0 0 "[ . 1 . 2]" 1 53 1 47 ASP HA 1 50 PHE H 3.236 . 4.545 4.567 4.466 4.642 0.097 13 0 "[ . 1 . 2]" 1 54 1 49 SER QB 1 50 PHE H 2.808 . 3.794 3.266 3.108 3.718 . 0 0 "[ . 1 . 2]" 1 55 1 50 PHE H 1 50 PHE HB3 2.343 . 3.029 2.384 2.288 2.499 . 0 0 "[ . 1 . 2]" 1 56 1 45 VAL HA 1 50 PHE H 3.780 . 5.566 5.140 5.027 5.292 . 0 0 "[ . 1 . 2]" 1 57 1 48 ALA MB 1 50 PHE H 3.333 . 4.721 4.343 4.288 4.398 . 0 0 "[ . 1 . 2]" 1 58 1 47 ASP H 1 49 SER H 3.698 . 5.408 5.330 5.164 5.429 0.021 20 0 "[ . 1 . 2]" 1 59 1 49 SER H 1 49 SER HA 2.498 . 3.278 2.884 2.822 2.900 . 0 0 "[ . 1 . 2]" 1 60 1 47 ASP HA 1 49 SER H 3.050 . 4.213 3.781 3.563 3.911 . 0 0 "[ . 1 . 2]" 1 61 1 48 ALA HA 1 49 SER H 3.003 . 4.130 3.441 3.410 3.476 . 0 0 "[ . 1 . 2]" 1 62 1 49 SER H 1 49 SER QB 2.432 . 3.171 2.447 2.268 2.650 . 0 0 "[ . 1 . 2]" 1 63 1 49 SER H 1 50 PHE HB3 3.362 . 4.775 4.603 4.443 4.743 . 0 0 "[ . 1 . 2]" 1 64 1 47 ASP QB 1 49 SER H 2.885 . 3.925 3.466 2.426 3.859 . 0 0 "[ . 1 . 2]" 1 65 1 48 ALA MB 1 49 SER H 2.729 . 3.660 2.938 2.780 3.007 . 0 0 "[ . 1 . 2]" 1 66 1 47 ASP HA 1 48 ALA H 2.693 . 3.600 2.161 2.126 2.217 . 0 0 "[ . 1 . 2]" 1 67 1 47 ASP QB 1 48 ALA H 3.899 . 5.800 3.659 3.049 3.858 . 0 0 "[ . 1 . 2]" 1 68 1 48 ALA H 1 48 ALA MB 2.700 . 3.611 2.238 2.221 2.255 . 0 0 "[ . 1 . 2]" 1 69 1 58 THR H 1 60 LYS H 3.459 . 4.955 3.956 3.814 4.064 . 0 0 "[ . 1 . 2]" 1 70 1 46 ALA H 1 47 ASP H 2.340 . 3.025 2.521 2.414 2.587 . 0 0 "[ . 1 . 2]" 1 71 1 47 ASP H 1 47 ASP HA 2.392 . 3.107 2.863 2.815 2.907 . 0 0 "[ . 1 . 2]" 1 72 1 57 GLN HA 1 60 LYS H 2.865 . 3.891 3.825 3.596 4.012 0.121 9 0 "[ . 1 . 2]" 1 73 1 60 LYS H 1 60 LYS HA 2.453 . 3.205 2.791 2.764 2.858 . 0 0 "[ . 1 . 2]" 1 74 1 47 ASP H 1 50 PHE HB3 3.124 . 4.344 4.199 4.007 4.333 . 0 0 "[ . 1 . 2]" 1 75 1 58 THR HA 1 60 LYS H 3.476 . 4.986 4.249 3.929 4.433 . 0 0 "[ . 1 . 2]" 1 76 1 43 THR HA 1 47 ASP H 3.246 . 4.563 4.606 4.399 4.701 0.138 5 0 "[ . 1 . 2]" 1 77 1 59 GLN HA 1 60 LYS H 2.922 . 3.989 3.498 3.414 3.544 . 0 0 "[ . 1 . 2]" 1 78 1 47 ASP H 1 47 ASP QB 2.011 . 2.517 2.255 2.176 2.311 . 0 0 "[ . 1 . 2]" 1 79 1 59 GLN QG 1 60 LYS H 3.780 . 5.566 4.090 2.490 4.379 . 0 0 "[ . 1 . 2]" 1 80 1 45 VAL HA 1 47 ASP H 2.950 . 4.038 3.805 3.614 4.029 . 0 0 "[ . 1 . 2]" 1 81 1 60 LYS H 1 61 VAL MG2 3.220 . 4.516 4.127 3.901 4.270 . 0 0 "[ . 1 . 2]" 1 82 1 46 ALA MB 1 47 ASP H 2.562 . 3.383 2.790 2.629 2.974 . 0 0 "[ . 1 . 2]" 1 83 1 45 VAL H 1 46 ALA H 2.505 . 3.289 2.425 2.288 2.543 . 0 0 "[ . 1 . 2]" 1 84 1 43 THR HA 1 46 ALA H 2.714 . 3.635 3.062 2.978 3.160 . 0 0 "[ . 1 . 2]" 1 85 1 44 GLN HA 1 46 ALA H 3.027 . 4.172 3.900 3.680 4.106 . 0 0 "[ . 1 . 2]" 1 86 1 46 ALA H 1 46 ALA HA 2.439 . 3.182 2.827 2.807 2.852 . 0 0 "[ . 1 . 2]" 1 87 1 45 VAL HA 1 46 ALA H 2.927 . 3.998 3.428 3.385 3.457 . 0 0 "[ . 1 . 2]" 1 88 1 45 VAL HB 1 46 ALA H 2.774 . 3.736 3.088 2.964 3.200 . 0 0 "[ . 1 . 2]" 1 89 1 46 ALA H 1 46 ALA MB 2.145 . 2.720 2.246 2.232 2.260 . 0 0 "[ . 1 . 2]" 1 90 1 43 THR MG 1 46 ALA H 3.317 . 4.692 4.626 4.381 4.718 0.026 1 0 "[ . 1 . 2]" 1 91 1 43 THR H 1 45 VAL H 3.366 . 4.782 3.851 3.516 4.089 . 0 0 "[ . 1 . 2]" 1 92 1 45 VAL H 1 47 ASP H 3.419 . 4.881 4.100 3.942 4.381 . 0 0 "[ . 1 . 2]" 1 93 1 44 GLN HA 1 45 VAL H 3.019 . 4.158 3.475 3.441 3.507 . 0 0 "[ . 1 . 2]" 1 94 1 41 LEU HA 1 45 VAL H 3.293 . 4.649 4.258 3.933 4.628 . 0 0 "[ . 1 . 2]" 1 95 1 42 GLN HA 1 45 VAL H 2.895 . 3.943 3.416 3.256 3.591 . 0 0 "[ . 1 . 2]" 1 96 1 45 VAL H 1 45 VAL HA 2.494 . 3.272 2.864 2.832 2.895 . 0 0 "[ . 1 . 2]" 1 97 1 45 VAL H 1 45 VAL HB 2.528 . 3.327 2.457 2.355 2.541 . 0 0 "[ . 1 . 2]" 1 98 1 45 VAL H 1 46 ALA MB 3.394 . 4.834 4.117 3.999 4.228 . 0 0 "[ . 1 . 2]" 1 99 1 45 VAL H 1 61 VAL MG1 3.641 . 5.298 3.897 3.598 4.365 . 0 0 "[ . 1 . 2]" 1 100 1 45 VAL H 1 45 VAL MG2 2.284 . 2.936 2.096 1.796 2.392 . 0 0 "[ . 1 . 2]" 1 101 1 42 GLN H 1 44 GLN H 3.539 . 5.105 4.180 4.055 4.431 . 0 0 "[ . 1 . 2]" 1 102 1 41 LEU H 1 44 GLN H 3.574 . 5.171 4.913 4.630 5.121 . 0 0 "[ . 1 . 2]" 1 103 1 44 GLN H 1 46 ALA H 2.952 . 4.042 3.557 3.446 3.691 . 0 0 "[ . 1 . 2]" 1 104 1 43 THR HB 1 44 GLN H 3.366 . 4.782 3.850 2.761 4.054 . 0 0 "[ . 1 . 2]" 1 105 1 41 LEU HA 1 44 GLN H 2.772 . 3.733 3.479 3.275 3.698 . 0 0 "[ . 1 . 2]" 1 106 1 44 GLN H 1 44 GLN HA 2.398 . 3.117 2.874 2.836 2.900 . 0 0 "[ . 1 . 2]" 1 107 1 44 GLN H 1 44 GLN HG3 2.732 . 3.665 3.393 3.019 3.642 . 0 0 "[ . 1 . 2]" 1 108 1 44 GLN H 1 44 GLN HG2 2.411 . 3.138 2.045 1.829 2.166 . 0 0 "[ . 1 . 2]" 1 109 1 44 GLN H 1 44 GLN HB2 3.366 . 4.782 3.123 2.550 3.675 . 0 0 "[ . 1 . 2]" 1 110 1 43 THR MG 1 44 GLN H 2.892 . 3.937 2.479 2.365 3.013 . 0 0 "[ . 1 . 2]" 1 111 1 44 GLN H 1 45 VAL MG2 3.124 . 4.344 3.780 3.528 4.087 . 0 0 "[ . 1 . 2]" 1 112 1 44 GLN H 1 61 VAL MG1 3.857 . 5.717 4.672 4.208 5.124 . 0 0 "[ . 1 . 2]" 1 113 1 42 GLN H 1 43 THR H 2.703 . 3.616 2.618 2.513 2.674 . 0 0 "[ . 1 . 2]" 1 114 1 40 ALA H 1 43 THR H 3.516 . 5.061 4.821 4.639 4.989 . 0 0 "[ . 1 . 2]" 1 115 1 41 LEU H 1 43 THR H 3.336 . 4.727 3.942 3.734 4.149 . 0 0 "[ . 1 . 2]" 1 116 1 43 THR H 1 44 GLN H 2.501 . 3.283 2.440 2.340 2.536 . 0 0 "[ . 1 . 2]" 1 117 1 43 THR H 1 46 ALA H 3.463 . 4.962 4.349 4.154 4.466 . 0 0 "[ . 1 . 2]" 1 118 1 43 THR H 1 43 THR HB 2.346 . 3.034 2.448 2.126 2.617 . 0 0 "[ . 1 . 2]" 1 119 1 43 THR H 1 44 GLN HA 3.789 . 5.584 5.093 5.007 5.185 . 0 0 "[ . 1 . 2]" 1 120 1 42 GLN HB2 1 43 THR H 2.889 . 3.933 3.130 2.984 3.274 . 0 0 "[ . 1 . 2]" 1 121 1 43 THR H 1 46 ALA MB 3.311 . 4.681 4.273 4.209 4.360 . 0 0 "[ . 1 . 2]" 1 122 1 43 THR H 1 43 THR MG 2.685 . 3.586 2.471 2.157 3.599 0.013 5 0 "[ . 1 . 2]" 1 123 1 40 ALA MB 1 43 THR H 3.376 . 4.801 4.738 4.458 4.881 0.080 1 0 "[ . 1 . 2]" 1 124 1 43 THR H 1 45 VAL MG2 3.854 . 5.710 4.784 4.670 4.943 . 0 0 "[ . 1 . 2]" 1 125 1 40 ALA H 1 42 GLN H 3.463 . 4.962 4.084 3.901 4.507 . 0 0 "[ . 1 . 2]" 1 126 1 42 GLN H 1 42 GLN HA 2.655 . 3.536 2.828 2.802 2.861 . 0 0 "[ . 1 . 2]" 1 127 1 42 GLN H 1 42 GLN HB3 2.602 . 3.448 3.486 3.321 3.552 0.104 13 0 "[ . 1 . 2]" 1 128 1 42 GLN H 1 42 GLN HB2 2.698 . 3.608 2.189 2.057 2.283 . 0 0 "[ . 1 . 2]" 1 129 1 41 LEU HB2 1 42 GLN H 2.965 . 4.064 2.634 2.387 2.757 . 0 0 "[ . 1 . 2]" 1 130 1 42 GLN H 1 43 THR HB 3.342 . 4.738 4.749 4.358 4.834 0.096 1 0 "[ . 1 . 2]" 1 131 1 38 LEU MD2 1 42 GLN H 3.020 . 4.160 3.219 2.782 3.489 . 0 0 "[ . 1 . 2]" 1 132 1 41 LEU MD1 1 42 GLN H 3.423 . 4.888 4.425 4.275 4.548 . 0 0 "[ . 1 . 2]" 1 133 1 42 GLN H 1 45 VAL MG2 3.427 . 4.895 4.521 4.402 4.606 . 0 0 "[ . 1 . 2]" 1 134 1 41 LEU H 1 42 GLN H 2.766 . 3.723 2.520 2.304 2.781 . 0 0 "[ . 1 . 2]" 1 135 1 41 LEU H 1 41 LEU HG 2.609 . 3.460 2.322 2.136 2.462 . 0 0 "[ . 1 . 2]" 1 136 1 41 LEU H 1 41 LEU HB2 2.689 . 3.593 2.446 2.406 2.493 . 0 0 "[ . 1 . 2]" 1 137 1 40 ALA MB 1 41 LEU H 2.630 . 3.494 2.525 2.254 2.801 . 0 0 "[ . 1 . 2]" 1 138 1 41 LEU H 1 41 LEU MD1 2.925 . 3.994 3.467 3.373 3.535 . 0 0 "[ . 1 . 2]" 1 139 1 39 GLU H 1 40 ALA H 2.535 . 3.338 2.825 2.763 3.024 . 0 0 "[ . 1 . 2]" 1 140 1 37 LYS H 1 40 ALA H 3.780 . 5.566 4.521 4.399 4.736 . 0 0 "[ . 1 . 2]" 1 141 1 40 ALA H 1 41 LEU H 2.597 . 3.440 2.619 2.495 2.874 . 0 0 "[ . 1 . 2]" 1 142 1 40 ALA H 1 40 ALA HA 2.357 . 3.051 2.827 2.745 2.860 . 0 0 "[ . 1 . 2]" 1 143 1 39 GLU HG3 1 40 ALA H 3.780 . 5.566 4.455 3.443 5.044 . 0 0 "[ . 1 . 2]" 1 144 1 39 GLU QB 1 40 ALA H 2.511 . 3.299 2.524 2.293 2.647 . 0 0 "[ . 1 . 2]" 1 145 1 40 ALA H 1 40 ALA MB 2.062 . 2.593 2.227 2.198 2.247 . 0 0 "[ . 1 . 2]" 1 146 1 40 ALA H 1 41 LEU HG 3.299 . 4.659 4.349 4.161 4.655 . 0 0 "[ . 1 . 2]" 1 147 1 40 ALA H 1 43 THR MG 3.476 . 4.986 4.672 4.282 5.324 0.338 5 0 "[ . 1 . 2]" 1 148 1 38 LEU H 1 39 GLU H 2.586 . 3.422 2.727 2.681 2.769 . 0 0 "[ . 1 . 2]" 1 149 1 39 GLU H 1 41 LEU H 3.511 . 5.052 4.285 4.134 4.490 . 0 0 "[ . 1 . 2]" 1 150 1 36 ALA HA 1 39 GLU H 2.719 . 3.643 3.370 3.245 3.564 . 0 0 "[ . 1 . 2]" 1 151 1 35 GLU HA 1 39 GLU H 3.023 . 4.166 3.999 3.846 4.108 . 0 0 "[ . 1 . 2]" 1 152 1 38 LEU HB3 1 39 GLU H 2.514 . 3.304 2.429 2.388 2.498 . 0 0 "[ . 1 . 2]" 1 153 1 39 GLU H 1 39 GLU QB 2.268 . 2.911 2.318 2.192 2.509 . 0 0 "[ . 1 . 2]" 1 154 1 35 GLU QG 1 39 GLU H 3.126 . 4.347 4.210 4.144 4.343 . 0 0 "[ . 1 . 2]" 1 155 1 38 LEU MD1 1 39 GLU H 2.914 . 3.975 3.035 2.847 3.172 . 0 0 "[ . 1 . 2]" 1 156 1 38 LEU H 1 40 ALA H 3.394 . 4.834 4.088 3.987 4.406 . 0 0 "[ . 1 . 2]" 1 157 1 35 GLU HA 1 38 LEU H 2.968 . 4.069 3.506 3.379 3.630 . 0 0 "[ . 1 . 2]" 1 158 1 38 LEU H 1 38 LEU HB2 2.593 . 3.433 2.441 2.393 2.513 . 0 0 "[ . 1 . 2]" 1 159 1 38 LEU H 1 41 LEU MD1 3.693 . 5.398 4.231 4.083 4.496 . 0 0 "[ . 1 . 2]" 1 160 1 37 LYS HG2 1 38 LEU H 3.194 . 4.469 3.617 3.442 3.739 . 0 0 "[ . 1 . 2]" 1 161 1 35 GLU H 1 37 LYS H 3.525 . 5.078 3.659 3.554 3.754 . 0 0 "[ . 1 . 2]" 1 162 1 34 LEU H 1 37 LYS H 3.827 . 5.658 4.439 4.345 4.495 . 0 0 "[ . 1 . 2]" 1 163 1 37 LYS H 1 37 LYS QB 2.196 . 2.799 2.249 2.205 2.281 . 0 0 "[ . 1 . 2]" 1 164 1 36 ALA MB 1 37 LYS H 2.480 . 3.249 2.770 2.641 2.954 . 0 0 "[ . 1 . 2]" 1 165 1 65 MET H 1 66 ALA H 2.809 . 3.795 2.783 2.694 2.840 . 0 0 "[ . 1 . 2]" 1 166 1 35 GLU H 1 36 ALA H 2.547 . 3.358 2.713 2.587 2.840 . 0 0 "[ . 1 . 2]" 1 167 1 36 ALA H 1 39 GLU H 3.463 . 4.962 4.671 4.552 4.801 . 0 0 "[ . 1 . 2]" 1 168 1 33 ASP HA 1 36 ALA H 2.877 . 3.912 3.933 3.821 3.995 0.083 10 0 "[ . 1 . 2]" 1 169 1 36 ALA H 1 36 ALA HA 2.327 . 3.004 2.830 2.798 2.852 . 0 0 "[ . 1 . 2]" 1 170 1 33 ASP HB3 1 36 ALA H 3.786 . 5.578 5.598 5.572 5.646 0.068 13 0 "[ . 1 . 2]" 1 171 1 65 MET HB3 1 66 ALA H 2.699 . 3.610 2.467 2.282 2.725 . 0 0 "[ . 1 . 2]" 1 172 1 35 GLU HB3 1 36 ALA H 2.563 . 3.384 2.230 2.103 2.411 . 0 0 "[ . 1 . 2]" 1 173 1 41 LEU MD1 1 66 ALA H 3.739 . 5.486 4.536 4.471 4.595 . 0 0 "[ . 1 . 2]" 1 174 1 34 LEU H 1 35 GLU H 2.750 . 3.696 2.552 2.491 2.629 . 0 0 "[ . 1 . 2]" 1 175 1 35 GLU H 1 35 GLU HA 2.547 . 3.358 2.818 2.794 2.843 . 0 0 "[ . 1 . 2]" 1 176 1 34 LEU HA 1 35 GLU H 3.142 . 4.376 3.497 3.474 3.515 . 0 0 "[ . 1 . 2]" 1 177 1 35 GLU H 1 35 GLU HB2 2.450 . 3.200 2.420 2.340 2.494 . 0 0 "[ . 1 . 2]" 1 178 1 34 LEU HB2 1 35 GLU H 3.191 . 4.464 2.741 2.671 2.849 . 0 0 "[ . 1 . 2]" 1 179 1 35 GLU H 1 72 LEU QD 2.750 . 3.696 2.405 2.268 2.535 . 0 0 "[ . 1 . 2]" 1 180 1 34 LEU QD 1 35 GLU H 3.372 . 4.794 4.081 4.026 4.131 . 0 0 "[ . 1 . 2]" 1 181 1 33 ASP HA 1 34 LEU H 3.369 . 4.788 3.531 3.526 3.540 . 0 0 "[ . 1 . 2]" 1 182 1 34 LEU H 1 34 LEU HA 2.868 . 3.896 2.833 2.819 2.848 . 0 0 "[ . 1 . 2]" 1 183 1 31 LEU HA 1 34 LEU H 3.359 . 4.769 3.471 3.369 3.553 . 0 0 "[ . 1 . 2]" 1 184 1 33 ASP HB3 1 34 LEU H 3.153 . 4.396 2.178 2.006 2.358 . 0 0 "[ . 1 . 2]" 1 185 1 33 ASP HB2 1 34 LEU H 3.251 . 4.572 3.270 3.139 3.410 . 0 0 "[ . 1 . 2]" 1 186 1 34 LEU H 1 34 LEU HG 2.678 . 3.574 2.110 2.012 2.232 . 0 0 "[ . 1 . 2]" 1 187 1 34 LEU H 1 34 LEU HB3 2.829 . 3.829 3.568 3.558 3.581 . 0 0 "[ . 1 . 2]" 1 188 1 34 LEU H 1 34 LEU HB2 3.093 . 4.289 2.508 2.472 2.549 . 0 0 "[ . 1 . 2]" 1 189 1 34 LEU H 1 34 LEU QD 3.223 . 4.521 2.989 2.931 3.048 . 0 0 "[ . 1 . 2]" 1 190 1 33 ASP H 1 34 LEU H 2.715 . 3.636 2.677 2.611 2.762 . 0 0 "[ . 1 . 2]" 1 191 1 33 ASP H 1 35 GLU H 3.213 . 4.503 3.841 3.670 3.959 . 0 0 "[ . 1 . 2]" 1 192 1 32 GLU H 1 33 ASP H 2.506 . 3.291 2.579 2.524 2.626 . 0 0 "[ . 1 . 2]" 1 193 1 33 ASP H 1 36 ALA H 3.394 . 4.834 4.670 4.611 4.731 . 0 0 "[ . 1 . 2]" 1 194 1 33 ASP H 1 33 ASP HA 2.405 . 3.128 2.829 2.799 2.852 . 0 0 "[ . 1 . 2]" 1 195 1 30 LEU HA 1 33 ASP H 2.876 . 3.910 3.209 3.125 3.329 . 0 0 "[ . 1 . 2]" 1 196 1 32 GLU HA 1 33 ASP H 2.706 . 3.621 3.456 3.427 3.495 . 0 0 "[ . 1 . 2]" 1 197 1 33 ASP H 1 33 ASP HB3 3.366 . 4.782 2.913 2.782 3.046 . 0 0 "[ . 1 . 2]" 1 198 1 33 ASP H 1 33 ASP HB2 2.526 . 3.323 2.261 2.175 2.368 . 0 0 "[ . 1 . 2]" 1 199 1 32 GLU HG2 1 33 ASP H 3.095 . 4.292 3.036 2.665 3.338 . 0 0 "[ . 1 . 2]" 1 200 1 32 GLU QB 1 33 ASP H 3.366 . 4.782 3.609 3.527 3.686 . 0 0 "[ . 1 . 2]" 1 201 1 33 ASP H 1 34 LEU HG 3.180 . 4.444 4.306 4.171 4.439 . 0 0 "[ . 1 . 2]" 1 202 1 32 GLU H 1 34 LEU H 3.672 . 5.358 4.433 4.294 4.503 . 0 0 "[ . 1 . 2]" 1 203 1 31 LEU H 1 32 GLU H 2.910 . 3.968 2.837 2.789 2.891 . 0 0 "[ . 1 . 2]" 1 204 1 32 GLU H 1 33 ASP HA 3.780 . 5.566 5.204 5.161 5.243 . 0 0 "[ . 1 . 2]" 1 205 1 30 LEU HA 1 32 GLU H 3.574 . 5.171 4.659 4.543 4.798 . 0 0 "[ . 1 . 2]" 1 206 1 31 LEU HA 1 32 GLU H 3.241 . 4.554 3.561 3.551 3.573 . 0 0 "[ . 1 . 2]" 1 207 1 32 GLU H 1 32 GLU HG2 2.823 . 3.819 2.060 1.837 2.384 . 0 0 "[ . 1 . 2]" 1 208 1 32 GLU H 1 32 GLU QB 2.322 . 2.996 2.605 2.485 2.722 . 0 0 "[ . 1 . 2]" 1 209 1 32 GLU H 1 32 GLU HG3 2.714 . 3.635 3.139 2.794 3.416 . 0 0 "[ . 1 . 2]" 1 210 1 31 LEU HB2 1 32 GLU H 2.845 . 3.857 2.612 2.549 2.696 . 0 0 "[ . 1 . 2]" 1 211 1 31 LEU HB3 1 32 GLU H 3.060 . 4.231 2.962 2.895 3.067 . 0 0 "[ . 1 . 2]" 1 212 1 31 LEU QD 1 32 GLU H 3.386 . 4.819 3.850 3.809 3.892 . 0 0 "[ . 1 . 2]" 1 213 1 30 LEU H 1 31 LEU H 2.931 . 4.005 2.521 2.396 2.685 . 0 0 "[ . 1 . 2]" 1 214 1 29 GLN HA 1 31 LEU H 3.544 . 5.114 4.313 4.158 4.466 . 0 0 "[ . 1 . 2]" 1 215 1 28 PRO HA 1 31 LEU H 3.369 . 4.788 3.239 3.104 3.390 . 0 0 "[ . 1 . 2]" 1 216 1 30 LEU HB3 1 31 LEU H 3.064 . 4.237 2.783 2.732 2.864 . 0 0 "[ . 1 . 2]" 1 217 1 31 LEU H 1 31 LEU HB2 2.789 . 3.762 2.216 2.195 2.230 . 0 0 "[ . 1 . 2]" 1 218 1 31 LEU H 1 31 LEU HB3 3.046 . 4.206 3.512 3.495 3.523 . 0 0 "[ . 1 . 2]" 1 219 1 27 LEU QD 1 31 LEU H 3.792 . 5.589 3.293 3.148 3.436 . 0 0 "[ . 1 . 2]" 1 220 1 31 LEU H 1 31 LEU QD 3.254 . 4.365 2.474 2.410 2.508 . 0 0 "[ . 1 . 2]" 1 221 1 30 LEU H 1 30 LEU HA 2.682 . 3.581 2.849 2.800 2.877 . 0 0 "[ . 1 . 2]" 1 222 1 29 GLN HA 1 30 LEU H 3.189 . 4.460 3.459 3.429 3.491 . 0 0 "[ . 1 . 2]" 1 223 1 30 LEU H 1 30 LEU HB3 2.695 . 3.603 2.287 2.212 2.337 . 0 0 "[ . 1 . 2]" 1 224 1 30 LEU H 1 30 LEU HB2 2.711 . 3.630 2.735 2.641 2.855 . 0 0 "[ . 1 . 2]" 1 225 1 30 LEU H 1 30 LEU HG 3.366 . 4.782 4.270 4.207 4.314 . 0 0 "[ . 1 . 2]" 1 226 1 27 LEU QD 1 30 LEU H 3.590 . 5.201 4.050 3.862 4.132 . 0 0 "[ . 1 . 2]" 1 227 1 29 GLN H 1 31 LEU H 3.443 . 4.925 4.007 3.915 4.096 . 0 0 "[ . 1 . 2]" 1 228 1 29 GLN H 1 30 LEU H 2.652 . 3.531 2.501 2.416 2.609 . 0 0 "[ . 1 . 2]" 1 229 1 26 GLN HA 1 29 GLN H 3.349 . 4.751 3.795 3.450 4.072 . 0 0 "[ . 1 . 2]" 1 230 1 29 GLN H 1 29 GLN HA 2.523 . 3.319 2.834 2.803 2.859 . 0 0 "[ . 1 . 2]" 1 231 1 28 PRO HD2 1 29 GLN H 3.093 . 4.289 2.696 2.472 2.889 . 0 0 "[ . 1 . 2]" 1 232 1 29 GLN H 1 29 GLN QG 2.870 . 3.900 2.481 1.900 3.561 . 0 0 "[ . 1 . 2]" 1 233 1 29 GLN H 1 29 GLN HB2 2.348 . 3.037 2.418 2.182 2.674 . 0 0 "[ . 1 . 2]" 1 234 1 28 PRO HB2 1 29 GLN H 2.435 . 3.176 2.545 2.358 2.715 . 0 0 "[ . 1 . 2]" 1 235 1 28 PRO HB3 1 29 GLN H 2.979 . 4.088 3.924 3.792 4.037 . 0 0 "[ . 1 . 2]" 1 236 1 27 LEU H 1 79 TRP HD1 3.617 . 5.253 4.964 4.457 5.296 0.043 15 0 "[ . 1 . 2]" 1 237 1 26 GLN HA 1 27 LEU H 3.134 . 4.362 3.401 3.276 3.479 . 0 0 "[ . 1 . 2]" 1 238 1 27 LEU H 1 27 LEU HA 2.764 . 3.719 2.769 2.722 2.845 . 0 0 "[ . 1 . 2]" 1 239 1 27 LEU H 1 28 PRO HD3 2.931 . 4.005 2.774 2.503 2.942 . 0 0 "[ . 1 . 2]" 1 240 1 27 LEU H 1 28 PRO HD2 3.031 . 4.180 2.786 2.496 2.982 . 0 0 "[ . 1 . 2]" 1 241 1 24 LEU HA 1 27 LEU H 3.140 . 4.373 3.479 3.012 3.704 . 0 0 "[ . 1 . 2]" 1 242 1 27 LEU H 1 27 LEU QB 2.540 . 3.347 2.045 1.962 2.115 . 0 0 "[ . 1 . 2]" 1 243 1 26 GLN HB3 1 27 LEU H 2.713 . 3.633 3.973 3.723 4.287 0.654 13 5 "[ .* * *+ .- 2]" 1 244 1 27 LEU H 1 27 LEU HG 2.997 . 4.120 4.066 3.968 4.348 0.228 1 0 "[ . 1 . 2]" 1 245 1 24 LEU H 1 26 GLN H 3.617 . 5.253 4.323 4.068 4.662 . 0 0 "[ . 1 . 2]" 1 246 1 25 GLU H 1 26 GLN H 2.598 . 3.442 2.560 2.359 2.869 . 0 0 "[ . 1 . 2]" 1 247 1 26 GLN H 1 27 LEU H 2.578 . 3.409 2.123 1.948 2.355 . 0 0 "[ . 1 . 2]" 1 248 1 26 GLN H 1 26 GLN HA 2.595 . 3.437 2.923 2.891 2.947 . 0 0 "[ . 1 . 2]" 1 249 1 25 GLU HA 1 26 GLN H 2.749 . 3.693 3.478 3.403 3.553 . 0 0 "[ . 1 . 2]" 1 250 1 26 GLN H 1 27 LEU HA 3.506 . 5.043 4.678 4.566 4.858 . 0 0 "[ . 1 . 2]" 1 251 1 26 GLN H 1 28 PRO HD3 3.419 . 4.881 4.244 3.880 4.752 . 0 0 "[ . 1 . 2]" 1 252 1 26 GLN H 1 26 GLN QG 2.849 . 3.864 2.317 1.796 2.803 0.038 20 0 "[ . 1 . 2]" 1 253 1 26 GLN H 1 27 LEU QB 3.708 . 5.426 3.669 3.484 3.945 . 0 0 "[ . 1 . 2]" 1 254 1 25 GLU H 1 27 LEU H 3.330 . 4.716 3.834 3.638 4.107 . 0 0 "[ . 1 . 2]" 1 255 1 24 LEU HA 1 25 GLU H 3.259 . 4.587 3.460 3.389 3.569 . 0 0 "[ . 1 . 2]" 1 256 1 25 GLU H 1 25 GLU HG3 2.707 . 3.623 3.385 2.354 4.381 0.758 19 3 "[ -. *1 . +2]" 1 257 1 25 GLU H 1 25 GLU HB2 2.575 . 3.404 2.517 2.304 3.156 . 0 0 "[ . 1 . 2]" 1 258 1 25 GLU H 1 25 GLU HG2 2.971 . 4.074 3.270 2.454 4.177 0.103 12 0 "[ . 1 . 2]" 1 259 1 25 GLU H 1 25 GLU HB3 3.366 . 4.782 3.276 1.985 3.611 . 0 0 "[ . 1 . 2]" 1 260 1 24 LEU HG 1 25 GLU H 3.590 . 5.201 5.144 4.409 5.273 0.072 3 0 "[ . 1 . 2]" 1 261 1 24 LEU HB2 1 25 GLU H 3.233 . 4.539 3.783 3.587 4.092 . 0 0 "[ . 1 . 2]" 1 262 1 24 LEU H 1 25 GLU H 2.765 . 3.720 2.580 2.504 2.678 . 0 0 "[ . 1 . 2]" 1 263 1 22 ARG H 1 24 LEU H 3.249 . 4.568 4.242 3.989 4.415 . 0 0 "[ . 1 . 2]" 1 264 1 23 GLU H 1 24 LEU H 2.623 . 3.483 2.627 2.483 2.872 . 0 0 "[ . 1 . 2]" 1 265 1 24 LEU H 1 24 LEU HA 2.675 . 3.570 2.838 2.812 2.869 . 0 0 "[ . 1 . 2]" 1 266 1 21 GLN HA 1 24 LEU H 2.897 . 3.946 3.881 3.651 4.017 0.071 10 0 "[ . 1 . 2]" 1 267 1 23 GLU QB 1 24 LEU H 2.691 . 3.596 2.329 2.142 2.495 . 0 0 "[ . 1 . 2]" 1 268 1 23 GLU HG3 1 24 LEU H 3.177 . 4.439 4.016 3.692 4.739 0.300 18 0 "[ . 1 . 2]" 1 269 1 24 LEU H 1 24 LEU HB2 2.585 . 3.420 2.168 2.047 2.377 . 0 0 "[ . 1 . 2]" 1 270 1 24 LEU H 1 24 LEU QD 3.366 . 4.782 3.717 3.650 3.774 . 0 0 "[ . 1 . 2]" 1 271 1 24 LEU H 1 82 LEU MD1 2.610 . 3.462 3.020 2.766 3.310 . 0 0 "[ . 1 . 2]" 1 272 1 23 GLU H 1 25 GLU H 3.617 . 5.253 3.839 3.656 4.179 . 0 0 "[ . 1 . 2]" 1 273 1 21 GLN H 1 23 GLU H 3.520 . 5.069 3.750 3.580 3.875 . 0 0 "[ . 1 . 2]" 1 274 1 20 LEU HA 1 23 GLU H 2.957 . 4.050 3.086 2.812 3.336 . 0 0 "[ . 1 . 2]" 1 275 1 23 GLU H 1 23 GLU QB 2.613 . 3.107 2.235 2.168 2.273 . 0 0 "[ . 1 . 2]" 1 276 1 22 ARG QB 1 23 GLU H 2.635 . 3.503 3.339 2.877 3.633 0.130 17 0 "[ . 1 . 2]" 1 277 1 21 GLN H 1 22 ARG H 2.782 . 3.750 2.855 2.695 3.009 . 0 0 "[ . 1 . 2]" 1 278 1 22 ARG H 1 23 GLU H 2.688 . 3.591 2.392 2.302 2.507 . 0 0 "[ . 1 . 2]" 1 279 1 20 LEU H 1 22 ARG H 3.282 . 4.628 4.260 4.050 4.458 . 0 0 "[ . 1 . 2]" 1 280 1 22 ARG H 1 22 ARG HA 2.582 . 3.415 2.877 2.849 2.895 . 0 0 "[ . 1 . 2]" 1 281 1 21 GLN HA 1 22 ARG H 2.776 . 3.739 3.558 3.528 3.596 . 0 0 "[ . 1 . 2]" 1 282 1 18 TYR HA 1 22 ARG H 3.366 . 4.782 3.935 3.651 4.235 . 0 0 "[ . 1 . 2]" 1 283 1 20 LEU HA 1 22 ARG H 3.574 . 5.171 4.458 4.149 4.741 . 0 0 "[ . 1 . 2]" 1 284 1 22 ARG H 1 22 ARG QD 3.590 . 5.201 2.346 1.912 2.680 0.067 5 0 "[ . 1 . 2]" 1 285 1 22 ARG H 1 22 ARG QB 2.365 . 3.064 2.245 2.134 2.351 . 0 0 "[ . 1 . 2]" 1 286 1 21 GLN HG2 1 22 ARG H 3.780 . 5.566 4.915 4.769 5.050 . 0 0 "[ . 1 . 2]" 1 287 1 21 GLN H 1 21 GLN HA 2.726 . 3.655 2.775 2.757 2.801 . 0 0 "[ . 1 . 2]" 1 288 1 18 TYR HA 1 21 GLN H 2.938 . 4.017 2.911 2.737 3.064 . 0 0 "[ . 1 . 2]" 1 289 1 20 LEU HA 1 21 GLN H 3.220 . 4.516 3.470 3.432 3.487 . 0 0 "[ . 1 . 2]" 1 290 1 20 LEU HB2 1 21 GLN H 3.065 . 4.240 2.832 2.713 3.017 . 0 0 "[ . 1 . 2]" 1 291 1 20 LEU HB3 1 21 GLN H 3.134 . 4.362 3.856 3.640 4.168 . 0 0 "[ . 1 . 2]" 1 292 1 20 LEU QD 1 21 GLN H 3.408 . 4.860 3.699 3.415 4.040 . 0 0 "[ . 1 . 2]" 1 293 1 20 LEU H 1 21 GLN H 2.754 . 3.702 2.254 2.170 2.381 . 0 0 "[ . 1 . 2]" 1 294 1 19 LYS H 1 20 LEU H 3.339 . 4.733 2.755 2.614 2.897 . 0 0 "[ . 1 . 2]" 1 295 1 17 SER H 1 20 LEU H 3.674 . 5.361 3.968 3.243 4.484 . 0 0 "[ . 1 . 2]" 1 296 1 20 LEU H 1 20 LEU HA 2.818 . 3.811 2.897 2.861 2.922 . 0 0 "[ . 1 . 2]" 1 297 1 19 LYS HA 1 20 LEU H 3.097 . 4.296 3.493 3.445 3.533 . 0 0 "[ . 1 . 2]" 1 298 1 20 LEU H 1 20 LEU HB2 2.668 . 3.558 2.518 2.251 2.792 . 0 0 "[ . 1 . 2]" 1 299 1 20 LEU H 1 20 LEU QD 2.950 . 4.026 2.151 1.755 2.826 0.107 18 0 "[ . 1 . 2]" 1 300 1 17 SER QB 1 20 LEU H 3.629 . 5.275 2.989 2.558 3.391 . 0 0 "[ . 1 . 2]" 1 301 1 18 TYR HB3 1 19 LYS H 3.525 . 5.078 2.735 2.615 2.881 . 0 0 "[ . 1 . 2]" 1 302 1 19 LYS H 1 19 LYS HB3 2.926 . 3.996 3.009 2.428 3.623 . 0 0 "[ . 1 . 2]" 1 303 1 19 LYS H 1 19 LYS HG3 2.925 . 3.994 2.640 1.782 3.577 0.074 19 0 "[ . 1 . 2]" 1 304 1 19 LYS H 1 19 LYS HG2 3.114 . 4.326 2.444 1.813 3.585 0.089 1 0 "[ . 1 . 2]" 1 305 1 16 LEU HA 1 17 SER H 2.694 . 3.601 2.283 2.007 2.703 . 0 0 "[ . 1 . 2]" 1 306 1 17 SER H 1 17 SER QB 3.427 . 4.895 2.299 2.170 2.518 . 0 0 "[ . 1 . 2]" 1 307 1 17 SER H 1 20 LEU QD 3.262 . 4.592 2.208 1.622 2.867 0.310 14 0 "[ . 1 . 2]" 1 308 1 9 VAL H 1 9 VAL HB 2.929 . 4.001 2.960 2.553 3.986 . 0 0 "[ . 1 . 2]" 1 309 1 57 GLN H 1 58 THR H 2.493 . 3.270 2.336 2.290 2.447 . 0 0 "[ . 1 . 2]" 1 310 1 50 PHE QE 1 58 THR H 3.569 . 5.161 5.105 4.869 5.212 0.051 10 0 "[ . 1 . 2]" 1 311 1 55 HIS HA 1 58 THR H 2.855 . 3.874 3.524 3.385 3.678 . 0 0 "[ . 1 . 2]" 1 312 1 57 GLN HA 1 58 THR H 2.961 . 4.057 3.519 3.499 3.543 . 0 0 "[ . 1 . 2]" 1 313 1 58 THR H 1 58 THR HB 2.900 . 3.951 3.570 3.535 3.626 . 0 0 "[ . 1 . 2]" 1 314 1 58 THR H 1 58 THR HA 2.702 . 3.615 2.816 2.796 2.838 . 0 0 "[ . 1 . 2]" 1 315 1 57 GLN HG2 1 58 THR H 3.187 . 4.456 3.673 3.527 3.751 . 0 0 "[ . 1 . 2]" 1 316 1 57 GLN QB 1 58 THR H 2.513 . 3.302 2.658 2.187 3.423 0.121 16 0 "[ . 1 . 2]" 1 317 1 58 THR H 1 58 THR MG 2.446 . 3.194 2.330 2.171 2.615 . 0 0 "[ . 1 . 2]" 1 318 1 58 THR H 1 59 GLN H 2.472 . 3.236 2.705 2.631 2.784 . 0 0 "[ . 1 . 2]" 1 319 1 59 GLN H 1 61 VAL H 3.317 . 4.692 4.240 4.071 4.381 . 0 0 "[ . 1 . 2]" 1 320 1 57 GLN H 1 59 GLN H 3.196 . 4.473 4.048 3.910 4.194 . 0 0 "[ . 1 . 2]" 1 321 1 59 GLN H 1 60 LYS H 2.472 . 3.236 2.645 2.541 2.749 . 0 0 "[ . 1 . 2]" 1 322 1 55 HIS HA 1 59 GLN H 2.904 . 3.958 3.326 3.203 3.457 . 0 0 "[ . 1 . 2]" 1 323 1 59 GLN H 1 60 LYS HA 3.780 . 5.566 5.250 5.171 5.322 . 0 0 "[ . 1 . 2]" 1 324 1 59 GLN H 1 59 GLN HA 2.302 . 2.965 2.814 2.787 2.844 . 0 0 "[ . 1 . 2]" 1 325 1 58 THR HA 1 59 GLN H 3.033 . 4.183 3.562 3.540 3.578 . 0 0 "[ . 1 . 2]" 1 326 1 59 GLN H 1 59 GLN QB 2.072 . 2.609 2.370 2.259 2.609 . 9 0 "[ . 1 . 2]" 1 327 1 59 GLN H 1 59 GLN QG 2.351 . 3.042 2.400 1.964 2.572 . 0 0 "[ . 1 . 2]" 1 328 1 58 THR MG 1 59 GLN H 3.011 . 4.144 3.934 3.860 4.032 . 0 0 "[ . 1 . 2]" 1 329 1 61 VAL H 1 62 LEU H 2.793 . 3.768 2.578 2.323 2.727 . 0 0 "[ . 1 . 2]" 1 330 1 60 LYS H 1 61 VAL H 2.569 . 3.394 2.699 2.469 2.822 . 0 0 "[ . 1 . 2]" 1 331 1 50 PHE QE 1 61 VAL H 3.270 . 4.607 4.168 3.901 4.327 . 0 0 "[ . 1 . 2]" 1 332 1 60 LYS HA 1 61 VAL H 2.988 . 4.104 3.525 3.413 3.551 . 0 0 "[ . 1 . 2]" 1 333 1 59 GLN HA 1 61 VAL H 3.145 . 4.381 4.291 4.005 4.426 0.045 14 0 "[ . 1 . 2]" 1 334 1 57 GLN HA 1 61 VAL H 3.326 . 4.709 4.497 4.102 4.751 0.042 3 0 "[ . 1 . 2]" 1 335 1 61 VAL H 1 61 VAL HB 2.576 . 3.406 2.539 2.507 2.576 . 0 0 "[ . 1 . 2]" 1 336 1 61 VAL H 1 61 VAL MG2 2.389 . 3.102 2.103 1.970 2.346 . 0 0 "[ . 1 . 2]" 1 337 1 61 VAL H 1 61 VAL MG1 2.873 . 3.905 3.773 3.757 3.792 . 0 0 "[ . 1 . 2]" 1 338 1 62 LEU H 1 63 ALA H 2.704 . 3.618 2.749 2.683 2.821 . 0 0 "[ . 1 . 2]" 1 339 1 62 LEU H 1 65 MET H 3.851 . 5.705 4.580 4.518 4.704 . 0 0 "[ . 1 . 2]" 1 340 1 50 PHE HZ 1 62 LEU H 3.093 . 4.289 2.790 2.622 2.942 . 0 0 "[ . 1 . 2]" 1 341 1 50 PHE QE 1 62 LEU H 3.397 . 4.840 4.012 3.905 4.115 . 0 0 "[ . 1 . 2]" 1 342 1 62 LEU H 1 62 LEU HA 2.780 . 3.746 2.800 2.782 2.822 . 0 0 "[ . 1 . 2]" 1 343 1 59 GLN HA 1 62 LEU H 2.972 . 4.076 3.210 3.082 3.350 . 0 0 "[ . 1 . 2]" 1 344 1 61 VAL HB 1 62 LEU H 2.878 . 3.913 2.506 2.374 2.592 . 0 0 "[ . 1 . 2]" 1 345 1 62 LEU H 1 62 LEU HG 2.570 . 3.396 2.271 2.076 2.378 . 0 0 "[ . 1 . 2]" 1 346 1 62 LEU H 1 62 LEU HB2 2.657 . 3.540 2.454 2.380 2.540 . 0 0 "[ . 1 . 2]" 1 347 1 61 VAL MG1 1 62 LEU H 3.196 . 4.473 3.416 3.317 3.516 . 0 0 "[ . 1 . 2]" 1 348 1 62 LEU H 1 62 LEU MD2 2.858 . 3.879 3.355 3.224 3.437 . 0 0 "[ . 1 . 2]" 1 349 1 62 LEU H 1 62 LEU MD1 2.909 . 3.967 3.573 3.453 3.679 . 0 0 "[ . 1 . 2]" 1 350 1 61 VAL H 1 63 ALA H 3.516 . 5.061 4.127 3.870 4.291 . 0 0 "[ . 1 . 2]" 1 351 1 63 ALA H 1 63 ALA HA 2.457 . 3.212 2.830 2.810 2.850 . 0 0 "[ . 1 . 2]" 1 352 1 61 VAL HA 1 63 ALA H 3.539 . 5.105 4.523 4.236 4.645 . 0 0 "[ . 1 . 2]" 1 353 1 63 ALA H 1 64 ASP HB2 3.471 . 4.977 4.856 4.517 4.989 0.012 2 0 "[ . 1 . 2]" 1 354 1 62 LEU HB2 1 63 ALA H 2.703 . 3.616 2.541 2.421 2.697 . 0 0 "[ . 1 . 2]" 1 355 1 63 ALA H 1 63 ALA MB 2.096 . 2.645 2.229 2.195 2.252 . 0 0 "[ . 1 . 2]" 1 356 1 62 LEU HB3 1 63 ALA H 3.366 . 4.782 3.522 3.402 3.662 . 0 0 "[ . 1 . 2]" 1 357 1 62 LEU MD2 1 63 ALA H 3.369 . 4.788 4.650 4.606 4.703 . 0 0 "[ . 1 . 2]" 1 358 1 62 LEU MD1 1 63 ALA H 3.333 . 4.721 4.441 4.357 4.567 . 0 0 "[ . 1 . 2]" 1 359 1 63 ALA H 1 64 ASP H 2.773 . 3.734 2.612 2.538 2.688 . 0 0 "[ . 1 . 2]" 1 360 1 62 LEU H 1 64 ASP H 3.821 . 5.646 4.153 4.002 4.273 . 0 0 "[ . 1 . 2]" 1 361 1 64 ASP H 1 64 ASP HA 2.713 . 3.633 2.840 2.810 2.875 . 0 0 "[ . 1 . 2]" 1 362 1 63 ALA HA 1 64 ASP H 3.290 . 4.643 3.535 3.516 3.552 . 0 0 "[ . 1 . 2]" 1 363 1 60 LYS HA 1 64 ASP H 3.480 . 4.994 4.181 3.869 4.566 . 0 0 "[ . 1 . 2]" 1 364 1 61 VAL HA 1 64 ASP H 3.223 . 4.521 3.549 3.276 3.719 . 0 0 "[ . 1 . 2]" 1 365 1 64 ASP H 1 64 ASP HB2 2.865 . 3.891 2.420 2.160 2.562 . 0 0 "[ . 1 . 2]" 1 366 1 64 ASP H 1 64 ASP HB3 2.930 . 4.003 2.674 2.540 2.969 . 0 0 "[ . 1 . 2]" 1 367 1 63 ALA MB 1 64 ASP H 2.574 . 3.402 2.538 2.421 2.635 . 0 0 "[ . 1 . 2]" 1 368 1 64 ASP H 1 65 MET H 2.808 . 3.794 2.546 2.419 2.645 . 0 0 "[ . 1 . 2]" 1 369 1 63 ALA H 1 65 MET H 3.451 . 4.940 3.992 3.865 4.110 . 0 0 "[ . 1 . 2]" 1 370 1 65 MET H 1 68 ALA H 3.684 . 5.381 4.618 4.545 4.727 . 0 0 "[ . 1 . 2]" 1 371 1 64 ASP HA 1 65 MET H 3.184 . 4.451 3.513 3.491 3.531 . 0 0 "[ . 1 . 2]" 1 372 1 65 MET H 1 65 MET HA 2.753 . 3.700 2.796 2.774 2.816 . 0 0 "[ . 1 . 2]" 1 373 1 61 VAL HA 1 65 MET H 3.311 . 4.681 3.868 3.721 4.046 . 0 0 "[ . 1 . 2]" 1 374 1 62 LEU HA 1 65 MET H 2.992 . 4.111 3.537 3.431 3.754 . 0 0 "[ . 1 . 2]" 1 375 1 64 ASP HB2 1 65 MET H 3.040 . 4.195 3.771 3.359 3.934 . 0 0 "[ . 1 . 2]" 1 376 1 65 MET H 1 65 MET HB3 2.582 . 3.415 2.403 2.259 2.482 . 0 0 "[ . 1 . 2]" 1 377 1 64 ASP HB3 1 65 MET H 2.962 . 4.059 2.663 2.480 2.791 . 0 0 "[ . 1 . 2]" 1 378 1 65 MET H 1 65 MET ME 3.320 . 4.698 4.056 3.878 4.216 . 0 0 "[ . 1 . 2]" 1 379 1 41 LEU HB3 1 65 MET H 3.516 . 5.061 3.922 3.708 4.041 . 0 0 "[ . 1 . 2]" 1 380 1 41 LEU MD1 1 65 MET H 3.051 . 4.215 2.888 2.781 3.070 . 0 0 "[ . 1 . 2]" 1 381 1 66 ALA H 1 66 ALA HA 2.435 . 3.176 2.818 2.793 2.834 . 0 0 "[ . 1 . 2]" 1 382 1 65 MET H 1 67 ALA H 3.520 . 5.069 4.005 3.883 4.189 . 0 0 "[ . 1 . 2]" 1 383 1 67 ALA H 1 68 ALA H 2.645 . 3.520 2.542 2.438 2.631 . 0 0 "[ . 1 . 2]" 1 384 1 41 LEU MD1 1 67 ALA H 3.924 . 5.849 4.812 4.667 4.927 . 0 0 "[ . 1 . 2]" 1 385 1 68 ALA H 1 69 GLU H 2.692 . 3.598 2.705 2.561 2.809 . 0 0 "[ . 1 . 2]" 1 386 1 66 ALA H 1 68 ALA H 3.339 . 4.733 3.978 3.900 4.060 . 0 0 "[ . 1 . 2]" 1 387 1 68 ALA H 1 68 ALA HA 2.537 . 3.342 2.832 2.800 2.865 . 0 0 "[ . 1 . 2]" 1 388 1 65 MET HA 1 68 ALA H 3.045 . 4.204 3.438 3.317 3.575 . 0 0 "[ . 1 . 2]" 1 389 1 64 ASP HA 1 68 ALA H 3.369 . 4.788 4.123 3.892 4.301 . 0 0 "[ . 1 . 2]" 1 390 1 38 LEU MD2 1 68 ALA H 3.268 . 4.603 4.138 3.974 4.350 . 0 0 "[ . 1 . 2]" 1 391 1 41 LEU MD1 1 68 ALA H 3.590 . 5.201 3.723 3.554 3.867 . 0 0 "[ . 1 . 2]" 1 392 1 69 GLU H 1 70 GLN H 2.664 . 3.551 2.688 2.586 2.799 . 0 0 "[ . 1 . 2]" 1 393 1 69 GLU H 1 69 GLU HA 2.568 . 3.392 2.825 2.798 2.839 . 0 0 "[ . 1 . 2]" 1 394 1 81 TYR HB3 1 82 LEU H 3.122 . 4.340 2.831 2.730 2.933 . 0 0 "[ . 1 . 2]" 1 395 1 80 GLU HA 1 82 LEU H 3.516 . 5.061 4.250 4.078 4.351 . 0 0 "[ . 1 . 2]" 1 396 1 69 GLU H 1 69 GLU HG2 2.690 . 3.594 2.032 1.871 2.869 . 0 0 "[ . 1 . 2]" 1 397 1 68 ALA MB 1 69 GLU H 2.548 . 3.359 2.348 2.246 2.453 . 0 0 "[ . 1 . 2]" 1 398 1 82 LEU H 1 82 LEU HB3 3.302 . 4.665 3.596 3.582 3.614 . 0 0 "[ . 1 . 2]" 1 399 1 38 LEU MD2 1 69 GLU H 2.930 . 4.003 2.741 2.467 3.058 . 0 0 "[ . 1 . 2]" 1 400 1 68 ALA H 1 70 GLN H 3.336 . 4.727 4.059 3.722 4.208 . 0 0 "[ . 1 . 2]" 1 401 1 70 GLN H 1 70 GLN HA 2.480 . 3.249 2.817 2.764 2.852 . 0 0 "[ . 1 . 2]" 1 402 1 69 GLU HA 1 70 GLN H 2.982 . 4.094 3.549 3.498 3.582 . 0 0 "[ . 1 . 2]" 1 403 1 70 GLN H 1 70 GLN HG2 3.093 . 4.289 2.654 2.130 4.561 0.272 5 0 "[ . 1 . 2]" 1 404 1 69 GLU HB2 1 70 GLN H 2.706 . 3.621 3.612 3.521 3.683 0.062 2 0 "[ . 1 . 2]" 1 405 1 69 GLU HB3 1 70 GLN H 3.366 . 4.782 4.020 3.960 4.107 . 0 0 "[ . 1 . 2]" 1 406 1 70 GLN H 1 71 GLU H 2.570 . 3.396 2.701 2.522 2.887 . 0 0 "[ . 1 . 2]" 1 407 1 71 GLU H 1 72 LEU H 2.669 . 3.559 2.589 2.510 2.710 . 0 0 "[ . 1 . 2]" 1 408 1 71 GLU H 1 71 GLU HA 2.415 . 3.144 2.830 2.795 2.846 . 0 0 "[ . 1 . 2]" 1 409 1 68 ALA HA 1 71 GLU H 2.721 . 3.646 3.672 3.604 3.716 0.070 6 0 "[ . 1 . 2]" 1 410 1 71 GLU H 1 71 GLU HB2 2.442 . 3.188 2.486 2.396 2.602 . 0 0 "[ . 1 . 2]" 1 411 1 34 LEU QD 1 71 GLU H 3.734 . 5.477 4.019 3.828 4.214 . 0 0 "[ . 1 . 2]" 1 412 1 72 LEU H 1 74 GLN H 3.262 . 4.592 4.289 4.057 4.499 . 0 0 "[ . 1 . 2]" 1 413 1 70 GLN H 1 72 LEU H 3.606 . 5.232 4.065 3.902 4.200 . 0 0 "[ . 1 . 2]" 1 414 1 72 LEU H 1 72 LEU HA 2.658 . 3.541 2.776 2.749 2.794 . 0 0 "[ . 1 . 2]" 1 415 1 68 ALA HA 1 72 LEU H 3.043 . 4.200 4.003 3.916 4.151 . 0 0 "[ . 1 . 2]" 1 416 1 72 LEU H 1 72 LEU HB3 2.493 . 3.270 2.492 2.445 2.539 . 0 0 "[ . 1 . 2]" 1 417 1 71 GLU HB3 1 72 LEU H 2.707 . 3.623 2.570 2.338 2.790 . 0 0 "[ . 1 . 2]" 1 418 1 72 LEU H 1 72 LEU HB2 2.616 . 3.471 2.494 2.445 2.542 . 0 0 "[ . 1 . 2]" 1 419 1 34 LEU QD 1 72 LEU H 3.128 . 4.351 2.833 2.562 3.011 . 0 0 "[ . 1 . 2]" 1 420 1 71 GLU H 1 73 GLU H 3.254 . 4.578 4.381 4.175 4.574 . 0 0 "[ . 1 . 2]" 1 421 1 70 GLN H 1 73 GLU H 3.525 . 5.078 4.935 4.777 5.082 0.004 11 0 "[ . 1 . 2]" 1 422 1 73 GLU H 1 76 PHE QD 3.612 . 5.243 4.498 4.299 4.786 . 0 0 "[ . 1 . 2]" 1 423 1 73 GLU H 1 73 GLU HA 2.295 . 2.954 2.839 2.795 2.861 . 0 0 "[ . 1 . 2]" 1 424 1 73 GLU H 1 73 GLU HG2 2.754 . 3.702 2.161 1.811 2.749 . 0 0 "[ . 1 . 2]" 1 425 1 72 LEU HB3 1 73 GLU H 3.366 . 4.782 2.413 2.242 2.537 . 0 0 "[ . 1 . 2]" 1 426 1 73 GLU H 1 73 GLU QB 2.246 . 2.876 2.664 2.565 2.760 . 0 0 "[ . 1 . 2]" 1 427 1 73 GLU H 1 73 GLU HG3 2.425 . 3.160 2.710 1.888 3.181 0.021 20 0 "[ . 1 . 2]" 1 428 1 72 LEU HB2 1 73 GLU H 2.910 . 3.968 3.800 3.672 3.880 . 0 0 "[ . 1 . 2]" 1 429 1 72 LEU HG 1 73 GLU H 3.140 . 4.373 3.566 3.345 4.383 0.010 14 0 "[ . 1 . 2]" 1 430 1 73 GLU H 1 74 GLN H 2.561 . 3.381 2.643 2.497 2.712 . 0 0 "[ . 1 . 2]" 1 431 1 74 GLN H 1 75 ALA H 2.516 . 3.307 2.607 2.485 2.896 . 0 0 "[ . 1 . 2]" 1 432 1 71 GLU HA 1 74 GLN H 3.003 . 4.130 3.699 3.277 3.991 . 0 0 "[ . 1 . 2]" 1 433 1 74 GLN H 1 74 GLN HG3 2.790 . 3.763 3.241 2.341 3.790 0.027 2 0 "[ . 1 . 2]" 1 434 1 73 GLU HG3 1 74 GLN H 2.721 . 3.646 2.677 2.065 3.821 0.175 12 0 "[ . 1 . 2]" 1 435 1 75 ALA H 1 75 ALA HA 2.553 . 3.368 2.839 2.827 2.856 . 0 0 "[ . 1 . 2]" 1 436 1 72 LEU HA 1 75 ALA H 2.859 . 3.881 3.861 3.770 3.939 0.058 14 0 "[ . 1 . 2]" 1 437 1 74 GLN HB3 1 75 ALA H 3.971 . 5.943 3.803 3.173 4.071 . 0 0 "[ . 1 . 2]" 1 438 1 74 GLN HG3 1 75 ALA H 3.574 . 5.171 3.314 2.230 5.059 . 0 0 "[ . 1 . 2]" 1 439 1 75 ALA H 1 75 ALA MB 2.286 . 2.939 2.246 2.224 2.259 . 0 0 "[ . 1 . 2]" 1 440 1 34 LEU QD 1 75 ALA H 3.463 . 4.962 3.996 3.640 4.189 . 0 0 "[ . 1 . 2]" 1 441 1 31 LEU QD 1 75 ALA H 3.646 . 5.308 3.861 3.694 3.993 . 0 0 "[ . 1 . 2]" 1 442 1 75 ALA H 1 76 PHE H 2.709 . 3.626 2.522 2.435 2.608 . 0 0 "[ . 1 . 2]" 1 443 1 74 GLN H 1 76 PHE H 3.471 . 4.977 3.926 3.759 4.053 . 0 0 "[ . 1 . 2]" 1 444 1 76 PHE H 1 76 PHE QD 3.386 . 4.819 3.375 3.271 3.457 . 0 0 "[ . 1 . 2]" 1 445 1 76 PHE H 1 76 PHE HA 2.842 . 3.852 2.801 2.782 2.816 . 0 0 "[ . 1 . 2]" 1 446 1 73 GLU HA 1 76 PHE H 2.973 . 4.078 3.265 3.016 3.440 . 0 0 "[ . 1 . 2]" 1 447 1 75 ALA HA 1 76 PHE H 2.948 . 4.035 3.514 3.485 3.537 . 0 0 "[ . 1 . 2]" 1 448 1 76 PHE H 1 76 PHE QB 2.696 . 3.604 2.048 2.025 2.096 . 0 0 "[ . 1 . 2]" 1 449 1 75 ALA MB 1 76 PHE H 2.905 . 3.960 2.616 2.515 2.739 . 0 0 "[ . 1 . 2]" 1 450 1 31 LEU QD 1 76 PHE H 3.314 . 4.687 2.704 2.568 2.822 . 0 0 "[ . 1 . 2]" 1 451 1 76 PHE H 1 77 GLU H 2.737 . 3.673 2.772 2.675 2.866 . 0 0 "[ . 1 . 2]" 1 452 1 77 GLU H 1 79 TRP H 3.502 . 5.035 4.092 3.940 4.211 . 0 0 "[ . 1 . 2]" 1 453 1 77 GLU H 1 78 ARG H 2.538 . 3.343 2.683 2.540 2.833 . 0 0 "[ . 1 . 2]" 1 454 1 76 PHE HA 1 77 GLU H 2.997 . 4.120 3.559 3.542 3.583 . 0 0 "[ . 1 . 2]" 1 455 1 76 PHE QB 1 77 GLU H 2.764 . 3.719 2.525 2.415 2.643 . 0 0 "[ . 1 . 2]" 1 456 1 77 GLU H 1 77 GLU QG 2.707 . 3.623 2.147 1.761 2.587 0.189 13 0 "[ . 1 . 2]" 1 457 1 77 GLU H 1 77 GLU HB2 3.366 . 4.782 2.771 2.235 3.616 . 0 0 "[ . 1 . 2]" 1 458 1 77 GLU H 1 77 GLU HB3 2.480 . 3.249 3.341 2.714 3.606 0.357 15 0 "[ . 1 . 2]" 1 459 1 31 LEU QD 1 77 GLU H 3.695 . 5.402 4.523 4.420 4.614 . 0 0 "[ . 1 . 2]" 1 460 1 78 ARG H 1 79 TRP H 2.976 . 4.083 2.689 2.614 2.821 . 0 0 "[ . 1 . 2]" 1 461 1 78 ARG H 1 80 GLU H 3.564 . 5.152 4.371 4.159 4.555 . 0 0 "[ . 1 . 2]" 1 462 1 75 ALA HA 1 78 ARG H 3.112 . 4.323 3.354 3.162 3.514 . 0 0 "[ . 1 . 2]" 1 463 1 78 ARG H 1 78 ARG HB3 3.009 . 4.141 2.576 2.328 3.564 . 0 0 "[ . 1 . 2]" 1 464 1 78 ARG H 1 78 ARG HB2 2.921 . 3.988 2.515 2.149 2.753 . 0 0 "[ . 1 . 2]" 1 465 1 77 GLU HB2 1 78 ARG H 3.177 . 4.439 2.951 2.340 3.902 . 0 0 "[ . 1 . 2]" 1 466 1 77 GLU HB3 1 78 ARG H 3.138 . 4.369 3.718 3.228 4.269 . 0 0 "[ . 1 . 2]" 1 467 1 79 TRP H 1 80 GLU H 3.076 . 4.259 2.826 2.732 2.925 . 0 0 "[ . 1 . 2]" 1 468 1 79 TRP H 1 81 TYR H 3.435 . 4.910 4.093 3.976 4.221 . 0 0 "[ . 1 . 2]" 1 469 1 76 PHE HA 1 79 TRP H 2.995 . 4.117 3.334 3.198 3.471 . 0 0 "[ . 1 . 2]" 1 470 1 79 TRP H 1 79 TRP HA 2.829 . 3.829 2.785 2.763 2.800 . 0 0 "[ . 1 . 2]" 1 471 1 79 TRP H 1 79 TRP HB3 2.867 . 3.894 2.457 2.332 2.546 . 0 0 "[ . 1 . 2]" 1 472 1 79 TRP H 1 79 TRP HB2 2.815 . 3.805 2.580 2.516 2.667 . 0 0 "[ . 1 . 2]" 1 473 1 78 ARG HB3 1 79 TRP H 3.302 . 4.665 2.474 2.187 3.084 . 0 0 "[ . 1 . 2]" 1 474 1 79 TRP HE3 1 80 GLU H 3.259 . 4.587 2.935 2.764 3.219 . 0 0 "[ . 1 . 2]" 1 475 1 76 PHE HA 1 80 GLU H 3.314 . 4.687 4.039 3.882 4.158 . 0 0 "[ . 1 . 2]" 1 476 1 79 TRP HB3 1 80 GLU H 2.976 . 4.083 2.452 2.391 2.530 . 0 0 "[ . 1 . 2]" 1 477 1 80 GLU H 1 80 GLU HA 2.822 . 3.817 2.815 2.794 2.835 . 0 0 "[ . 1 . 2]" 1 478 1 80 GLU H 1 80 GLU HG3 2.948 . 4.035 2.372 2.095 3.516 . 0 0 "[ . 1 . 2]" 1 479 1 80 GLU H 1 80 GLU HB2 2.915 . 3.977 2.507 2.249 2.569 . 0 0 "[ . 1 . 2]" 1 480 1 80 GLU H 1 81 TYR H 2.769 . 3.727 2.654 2.574 2.743 . 0 0 "[ . 1 . 2]" 1 481 1 81 TYR H 1 82 LEU H 2.757 . 3.707 2.658 2.580 2.741 . 0 0 "[ . 1 . 2]" 1 482 1 81 TYR H 1 81 TYR QD 3.180 . 4.444 4.036 3.975 4.077 . 0 0 "[ . 1 . 2]" 1 483 1 80 GLU HA 1 81 TYR H 3.203 . 4.486 3.518 3.496 3.544 . 0 0 "[ . 1 . 2]" 1 484 1 81 TYR H 1 81 TYR HB2 2.575 . 3.404 2.928 2.858 2.975 . 0 0 "[ . 1 . 2]" 1 485 1 81 TYR H 1 81 TYR HB3 2.623 . 3.483 2.196 2.152 2.246 . 0 0 "[ . 1 . 2]" 1 486 1 80 GLU HB2 1 81 TYR H 3.182 . 4.448 2.754 2.564 2.890 . 0 0 "[ . 1 . 2]" 1 487 1 80 GLU HG3 1 81 TYR H 3.530 . 5.087 4.375 4.179 5.010 . 0 0 "[ . 1 . 2]" 1 488 1 81 TYR QD 1 82 LEU H 3.287 . 4.638 3.435 3.291 3.567 . 0 0 "[ . 1 . 2]" 1 489 1 83 GLU H 1 85 LEU H 3.617 . 5.253 4.169 4.013 4.324 . 0 0 "[ . 1 . 2]" 1 490 1 82 LEU HB2 1 83 GLU H 2.884 . 3.923 2.511 2.393 2.665 . 0 0 "[ . 1 . 2]" 1 491 1 83 GLU H 1 83 GLU HB3 2.887 . 3.929 3.538 3.437 3.568 . 0 0 "[ . 1 . 2]" 1 492 1 24 LEU QD 1 83 GLU H 3.189 . 4.460 3.039 2.501 3.269 . 0 0 "[ . 1 . 2]" 1 493 1 83 GLU H 1 84 ALA H 2.817 . 3.809 2.721 2.663 2.808 . 0 0 "[ . 1 . 2]" 1 494 1 84 ALA H 1 85 LEU H 2.801 . 3.782 2.657 2.556 2.761 . 0 0 "[ . 1 . 2]" 1 495 1 84 ALA H 1 84 ALA HA 2.644 . 3.518 2.823 2.798 2.865 . 0 0 "[ . 1 . 2]" 1 496 1 81 TYR HA 1 84 ALA H 3.386 . 4.819 3.547 3.352 3.689 . 0 0 "[ . 1 . 2]" 1 497 1 80 GLU HA 1 84 ALA H 3.506 . 5.043 3.831 3.662 3.950 . 0 0 "[ . 1 . 2]" 1 498 1 84 ALA H 1 84 ALA MB 2.266 . 2.908 2.231 2.210 2.255 . 0 0 "[ . 1 . 2]" 1 499 1 83 GLU HB3 1 84 ALA H 3.020 . 4.160 3.299 2.998 3.561 . 0 0 "[ . 1 . 2]" 1 500 1 85 LEU H 1 86 LYS H 2.927 . 3.998 2.605 2.521 2.693 . 0 0 "[ . 1 . 2]" 1 501 1 85 LEU H 1 85 LEU HA 2.776 . 3.739 2.817 2.799 2.847 . 0 0 "[ . 1 . 2]" 1 502 1 84 ALA HA 1 85 LEU H 3.279 . 4.623 3.539 3.509 3.566 . 0 0 "[ . 1 . 2]" 1 503 1 85 LEU H 1 85 LEU HB2 2.880 . 3.917 2.308 2.245 2.376 . 0 0 "[ . 1 . 2]" 1 504 1 84 ALA H 1 86 LYS H 3.544 . 5.114 4.056 3.845 4.229 . 0 0 "[ . 1 . 2]" 1 505 1 86 LYS H 1 86 LYS HA 2.646 . 3.521 2.803 2.771 2.860 . 0 0 "[ . 1 . 2]" 1 506 1 86 LYS H 1 86 LYS HB3 2.787 . 3.758 2.605 2.316 3.603 . 0 0 "[ . 1 . 2]" 1 507 1 86 LYS H 1 86 LYS HB2 2.725 . 3.654 2.442 2.217 2.629 . 0 0 "[ . 1 . 2]" 1 508 1 85 LEU HB3 1 86 LYS H 2.790 . 3.763 2.607 2.338 2.813 . 0 0 "[ . 1 . 2]" 1 509 1 86 LYS H 1 87 ASN H 2.903 . 3.956 2.626 2.431 2.724 . 0 0 "[ . 1 . 2]" 1 510 1 87 ASN H 1 87 ASN HD21 3.362 . 4.775 4.431 2.690 4.783 0.008 8 0 "[ . 1 . 2]" 1 511 1 84 ALA HA 1 87 ASN H 3.265 . 4.597 3.548 3.367 3.898 . 0 0 "[ . 1 . 2]" 1 512 1 87 ASN H 1 87 ASN HB3 2.872 . 3.903 2.620 2.415 3.616 . 0 0 "[ . 1 . 2]" 1 513 1 87 ASN H 1 87 ASN HB2 2.791 . 3.765 2.626 2.309 2.848 . 0 0 "[ . 1 . 2]" 1 514 1 86 LYS HB3 1 87 ASN H 3.073 . 4.253 2.809 2.453 3.949 . 0 0 "[ . 1 . 2]" 1 515 1 86 LYS HB2 1 87 ASN H 3.284 . 4.632 3.855 3.046 4.147 . 0 0 "[ . 1 . 2]" 1 516 1 87 ASN HA 1 88 GLY H 3.083 . 4.271 3.509 3.453 3.528 . 0 0 "[ . 1 . 2]" 1 517 1 87 ASN HB3 1 88 GLY H 3.711 . 5.432 2.886 2.729 3.763 . 0 0 "[ . 1 . 2]" 1 518 1 87 ASN HB2 1 88 GLY H 3.668 . 5.350 3.862 2.751 4.114 . 0 0 "[ . 1 . 2]" 1 519 1 88 GLY H 1 89 GLY H 2.866 . 3.892 3.547 2.759 3.985 0.093 4 0 "[ . 1 . 2]" 1 520 1 88 GLY HA2 1 89 GLY H 2.868 . 3.896 2.326 2.115 2.645 . 0 0 "[ . 1 . 2]" 1 521 1 89 GLY H 1 89 GLY QA 2.484 . 3.255 2.383 2.211 2.493 . 0 0 "[ . 1 . 2]" 1 522 1 85 LEU MD1 1 89 GLY H 3.671 . 5.355 5.061 4.285 5.490 0.135 9 0 "[ . 1 . 2]" 1 523 1 28 PRO HG3 1 79 TRP HE1 3.284 . 4.632 2.216 1.869 2.608 0.067 10 0 "[ . 1 . 2]" 1 524 1 79 TRP HE1 1 83 GLU HG2 3.050 . 4.213 3.389 3.098 3.982 . 0 0 "[ . 1 . 2]" 1 525 1 24 LEU QD 1 79 TRP HE1 2.706 . 3.621 2.260 2.009 2.577 . 0 0 "[ . 1 . 2]" 1 526 1 50 PHE HA 1 50 PHE QD 2.196 . 2.799 2.678 2.518 2.822 0.023 7 0 "[ . 1 . 2]" 1 527 1 50 PHE HB3 1 50 PHE QD 2.366 . 3.066 2.285 2.268 2.304 . 0 0 "[ . 1 . 2]" 1 528 1 50 PHE HB2 1 50 PHE QD 2.311 . 2.978 2.522 2.489 2.555 . 0 0 "[ . 1 . 2]" 1 529 1 45 VAL HA 1 50 PHE QD 2.635 . 3.503 2.791 2.635 2.927 . 0 0 "[ . 1 . 2]" 1 530 1 50 PHE QD 1 58 THR MG 2.706 . 3.622 3.442 3.300 3.546 . 0 0 "[ . 1 . 2]" 1 531 1 50 PHE QD 1 61 VAL MG1 2.661 . 4.550 3.834 3.719 3.985 . 0 0 "[ . 1 . 2]" 1 532 1 50 PHE QD 1 61 VAL MG2 2.826 . 3.824 3.744 3.456 3.879 0.055 7 0 "[ . 1 . 2]" 1 533 1 81 TYR QE 1 85 LEU MD1 2.042 . 2.563 1.832 1.696 1.998 . 0 0 "[ . 1 . 2]" 1 534 1 81 TYR QE 1 82 LEU MD2 2.074 . 2.612 2.558 2.386 2.670 0.058 10 0 "[ . 1 . 2]" 1 535 1 20 LEU QD 1 81 TYR QE 3.134 . 4.362 3.082 2.528 3.771 . 0 0 "[ . 1 . 2]" 1 536 1 81 TYR QE 1 85 LEU HB2 2.654 . 3.534 3.163 2.962 3.492 . 0 0 "[ . 1 . 2]" 1 537 1 18 TYR QE 1 22 ARG QG 2.526 . 3.324 3.164 3.010 3.387 0.063 2 0 "[ . 1 . 2]" 1 538 1 18 TYR QE 1 22 ARG QB 2.776 . 3.739 3.268 2.406 3.931 0.192 5 0 "[ . 1 . 2]" 1 539 1 50 PHE QE 1 58 THR MG 2.534 . 3.337 3.207 3.008 3.350 0.013 9 0 "[ . 1 . 2]" 1 540 1 50 PHE QE 1 62 LEU HG 2.615 . 3.470 2.436 2.274 2.666 . 0 0 "[ . 1 . 2]" 1 541 1 50 PHE QE 1 61 VAL HB 2.535 . 3.338 2.377 2.184 2.564 . 0 0 "[ . 1 . 2]" 1 542 1 50 PHE QE 1 58 THR HA 2.527 . 3.325 2.831 2.610 2.938 . 0 0 "[ . 1 . 2]" 1 543 1 50 PHE QE 1 58 THR HB 2.575 . 3.404 3.168 2.839 3.422 0.018 17 0 "[ . 1 . 2]" 1 544 1 45 VAL MG1 1 51 PHE QE 2.485 . 3.257 2.791 2.623 3.019 . 0 0 "[ . 1 . 2]" 1 545 1 51 PHE QE 1 62 LEU MD2 2.640 . 3.511 2.487 2.344 2.738 . 0 0 "[ . 1 . 2]" 1 546 1 51 PHE HB2 1 51 PHE QD 2.307 . 2.973 2.346 2.306 2.377 . 0 0 "[ . 1 . 2]" 1 547 1 51 PHE HB3 1 51 PHE QD 2.351 . 3.042 2.430 2.397 2.488 . 0 0 "[ . 1 . 2]" 1 548 1 51 PHE HA 1 51 PHE QD 2.291 . 2.947 2.806 2.637 2.866 . 0 0 "[ . 1 . 2]" 1 549 1 79 TRP HZ2 1 83 GLU HG3 2.742 . 3.682 3.152 2.871 3.499 . 0 0 "[ . 1 . 2]" 1 550 1 76 PHE HA 1 76 PHE QD 2.314 . 2.983 2.699 2.564 2.802 . 0 0 "[ . 1 . 2]" 1 551 1 73 GLU HA 1 76 PHE QD 2.368 . 3.069 3.025 2.771 3.165 0.096 14 0 "[ . 1 . 2]" 1 552 1 79 TRP HB3 1 79 TRP HE3 2.591 . 3.430 2.419 2.400 2.445 . 0 0 "[ . 1 . 2]" 1 553 1 50 PHE HZ 1 58 THR HB 2.623 . 3.483 3.336 3.209 3.488 0.005 17 0 "[ . 1 . 2]" 1 554 1 50 PHE HZ 1 58 THR HA 2.573 . 3.400 2.393 2.241 2.539 . 0 0 "[ . 1 . 2]" 1 555 1 28 PRO HD3 1 79 TRP HD1 2.543 . 3.352 2.848 2.485 3.092 . 0 0 "[ . 1 . 2]" 1 556 1 76 PHE QB 1 76 PHE QD 2.332 . 3.012 2.126 2.119 2.141 . 0 0 "[ . 1 . 2]" 1 557 1 18 TYR HB2 1 18 TYR QD 2.325 . 3.001 2.425 2.361 2.469 . 0 0 "[ . 1 . 2]" 1 558 1 78 ARG QD 1 81 TYR QD 2.229 . 2.850 2.153 1.619 2.837 . 0 0 "[ . 1 . 2]" 1 559 1 79 TRP HE3 1 80 GLU HG2 2.445 . 3.192 2.209 1.782 2.591 . 0 0 "[ . 1 . 2]" 1 560 1 55 HIS HD2 1 59 GLN QG 2.486 . 3.259 2.967 2.195 3.305 0.046 16 0 "[ . 1 . 2]" 1 561 1 24 LEU HG 1 79 TRP HD1 2.629 . 3.493 3.032 2.677 3.570 0.077 19 0 "[ . 1 . 2]" 1 562 1 27 LEU QB 1 79 TRP HD1 2.549 . 3.361 2.491 2.183 2.984 . 0 0 "[ . 1 . 2]" 1 563 1 24 LEU QD 1 79 TRP HD1 2.149 . 2.726 2.561 2.153 2.758 0.032 1 0 "[ . 1 . 2]" 1 564 1 50 PHE HZ 1 61 VAL MG1 2.397 . 3.115 2.954 2.845 3.064 . 0 0 "[ . 1 . 2]" 1 565 1 31 LEU QD 1 79 TRP HD1 2.731 . 3.663 3.643 3.339 3.724 0.061 8 0 "[ . 1 . 2]" 1 566 1 50 PHE HZ 1 58 THR MG 2.800 . 3.780 3.487 3.258 3.731 . 0 0 "[ . 1 . 2]" 1 567 1 50 PHE HZ 1 61 VAL HB 2.642 . 3.515 1.744 1.725 1.769 0.044 4 0 "[ . 1 . 2]" 1 568 1 50 PHE HZ 1 62 LEU HG 2.666 . 3.554 2.316 2.141 2.443 . 0 0 "[ . 1 . 2]" 1 569 1 81 TYR QE 1 82 LEU HG 2.761 . 4.550 4.415 4.016 4.612 0.062 4 0 "[ . 1 . 2]" 1 570 1 18 TYR QD 1 21 GLN HG3 3.622 . 5.262 4.445 3.502 4.879 . 0 0 "[ . 1 . 2]" 1 571 1 18 TYR HB3 1 18 TYR QD 2.201 . 2.806 2.372 2.338 2.441 . 0 0 "[ . 1 . 2]" 1 572 1 18 TYR QD 1 19 LYS HA 2.587 . 3.423 3.391 3.096 3.495 0.072 20 0 "[ . 1 . 2]" 1 573 1 18 TYR HA 1 18 TYR QD 2.229 . 2.850 2.829 2.727 2.956 0.106 3 0 "[ . 1 . 2]" 1 574 1 55 HIS HD2 1 56 GLU HA 2.601 . 3.447 3.282 2.816 3.497 0.050 12 0 "[ . 1 . 2]" 1 575 1 55 HIS HB3 1 55 HIS HD2 2.301 . 2.963 2.830 2.726 2.948 . 0 0 "[ . 1 . 2]" 1 576 1 55 HIS HD2 1 56 GLU QG 2.582 . 3.415 3.336 2.992 3.491 0.076 13 0 "[ . 1 . 2]" 1 577 1 55 HIS HD2 1 56 GLU QB 3.622 . 5.262 4.788 4.458 4.950 . 0 0 "[ . 1 . 2]" 1 578 1 55 HIS HD2 1 59 GLN QB 2.772 . 3.733 3.545 3.268 3.850 0.117 13 0 "[ . 1 . 2]" 1 579 1 51 PHE HZ 1 62 LEU MD1 2.913 . 3.974 3.901 3.724 4.020 0.046 12 0 "[ . 1 . 2]" 1 580 1 76 PHE QD 1 80 GLU HG3 2.720 . 3.645 3.107 2.827 3.685 0.040 15 0 "[ . 1 . 2]" 1 581 1 72 LEU HG 1 76 PHE QD 2.613 . 3.467 2.241 1.966 3.723 0.256 14 0 "[ . 1 . 2]" 1 582 1 79 TRP HZ2 1 83 GLU HG2 3.057 . 4.226 4.047 3.988 4.116 . 0 0 "[ . 1 . 2]" 1 583 1 79 TRP HB3 1 79 TRP HD1 3.622 . 5.262 3.873 3.855 3.888 . 0 0 "[ . 1 . 2]" 1 584 1 79 TRP HB2 1 79 TRP HD1 3.018 . 4.157 2.797 2.735 2.861 . 0 0 "[ . 1 . 2]" 1 585 1 28 PRO HG3 1 79 TRP HD1 2.795 . 3.771 3.014 2.667 3.365 . 0 0 "[ . 1 . 2]" 1 586 1 27 LEU QD 1 79 TRP HD1 2.179 . 2.773 2.539 2.321 2.702 . 0 0 "[ . 1 . 2]" 1 587 1 79 TRP HH2 1 80 GLU HG2 3.221 . 4.518 4.590 4.545 4.616 0.098 1 0 "[ . 1 . 2]" 1 588 1 31 LEU HB2 1 31 LEU QD 3.086 . 4.276 2.084 2.072 2.092 . 0 0 "[ . 1 . 2]" 1 589 1 31 LEU MD1 1 31 LEU MD2 3.086 . 4.276 2.091 2.079 2.105 . 0 0 "[ . 1 . 2]" 1 590 1 85 LEU MD1 1 85 LEU HG 3.086 . 4.276 2.123 2.117 2.129 . 0 0 "[ . 1 . 2]" 1 591 1 31 LEU QD 1 31 LEU HG 3.086 . 4.276 1.890 1.888 1.892 0.008 1 0 "[ . 1 . 2]" 1 592 1 31 LEU HB3 1 31 LEU QD 3.086 . 4.276 2.601 2.568 2.611 . 0 0 "[ . 1 . 2]" 1 593 1 27 LEU QD 1 31 LEU QD 3.086 . 4.276 1.786 1.720 1.974 0.176 8 0 "[ . 1 . 2]" 1 594 1 31 LEU QD 1 79 TRP HB2 3.086 . 4.276 2.371 2.136 2.455 . 0 0 "[ . 1 . 2]" 1 595 1 31 LEU QD 1 79 TRP HB3 3.086 . 4.276 2.616 2.402 2.770 . 0 0 "[ . 1 . 2]" 1 596 1 28 PRO HA 1 31 LEU QD 3.086 . 4.276 2.162 2.055 2.230 . 0 0 "[ . 1 . 2]" 1 597 1 27 LEU HA 1 31 LEU QD 3.086 . 4.276 3.757 3.626 3.846 . 0 0 "[ . 1 . 2]" 1 598 1 31 LEU QD 1 76 PHE HA 3.086 . 4.276 2.176 2.079 2.249 . 0 0 "[ . 1 . 2]" 1 599 1 31 LEU QD 1 72 LEU QD 3.086 . 4.276 1.875 1.822 2.303 0.074 12 0 "[ . 1 . 2]" 1 600 1 31 LEU QD 1 34 LEU QD 3.086 . 4.276 2.686 2.437 2.829 . 0 0 "[ . 1 . 2]" 1 601 1 31 LEU QD 1 75 ALA MB 3.086 . 4.276 2.016 1.895 2.150 0.001 16 0 "[ . 1 . 2]" 1 602 1 31 LEU QD 1 34 LEU HG 3.086 . 4.276 4.171 3.978 4.272 . 0 0 "[ . 1 . 2]" 1 603 1 31 LEU QD 1 76 PHE QB 3.086 . 4.276 3.237 3.147 3.350 . 0 0 "[ . 1 . 2]" 1 604 1 31 LEU HA 1 31 LEU QD 3.086 . 4.276 1.797 1.782 1.820 0.114 9 0 "[ . 1 . 2]" 1 605 1 31 LEU QD 1 72 LEU HA 3.086 . 4.276 2.837 2.609 3.092 . 0 0 "[ . 1 . 2]" 1 606 1 31 LEU QD 1 75 ALA HA 3.086 . 4.276 3.821 3.625 3.970 . 0 0 "[ . 1 . 2]" 1 607 1 58 THR MG 1 61 VAL MG2 3.086 . 4.276 4.277 4.058 4.350 0.074 8 0 "[ . 1 . 2]" 1 608 1 53 GLN HB2 1 58 THR MG 3.086 . 4.276 2.065 1.864 2.339 0.032 15 0 "[ . 1 . 2]" 1 609 1 53 GLN HB3 1 58 THR MG 3.086 . 4.276 2.864 2.670 3.174 . 0 0 "[ . 1 . 2]" 1 610 1 58 THR HA 1 58 THR MG 3.086 . 4.276 2.270 2.215 2.302 . 0 0 "[ . 1 . 2]" 1 611 1 58 THR HB 1 58 THR MG 3.086 . 4.276 2.138 2.132 2.144 . 0 0 "[ . 1 . 2]" 1 612 1 50 PHE HA 1 58 THR MG 3.086 . 4.276 4.058 3.835 4.216 . 0 0 "[ . 1 . 2]" 1 613 1 51 PHE HA 1 58 THR MG 3.086 . 4.276 2.136 2.040 2.231 . 0 0 "[ . 1 . 2]" 1 614 1 45 VAL MG1 1 61 VAL MG1 3.086 . 4.276 4.166 3.949 4.284 0.008 11 0 "[ . 1 . 2]" 1 615 1 45 VAL MG1 1 62 LEU MD2 3.086 . 4.276 2.146 2.004 2.298 . 0 0 "[ . 1 . 2]" 1 616 1 45 VAL HB 1 45 VAL MG1 3.086 . 4.276 2.125 2.121 2.128 . 0 0 "[ . 1 . 2]" 1 617 1 45 VAL MG1 1 65 MET ME 3.086 . 4.276 2.115 1.920 2.673 . 0 0 "[ . 1 . 2]" 1 618 1 45 VAL HA 1 45 VAL MG1 3.086 . 4.276 2.434 2.361 2.536 . 0 0 "[ . 1 . 2]" 1 619 1 45 VAL MG1 1 50 PHE HB3 3.086 . 4.276 4.153 3.936 4.277 0.001 4 0 "[ . 1 . 2]" 1 620 1 42 GLN HA 1 45 VAL MG1 3.086 . 4.276 3.836 3.521 4.112 . 0 0 "[ . 1 . 2]" 1 621 1 45 VAL MG1 1 46 ALA HA 3.086 . 4.276 3.833 3.523 4.064 . 0 0 "[ . 1 . 2]" 1 622 1 45 VAL MG1 1 62 LEU HA 3.086 . 4.276 4.084 3.921 4.284 0.008 3 0 "[ . 1 . 2]" 1 623 1 45 VAL MG2 1 61 VAL MG1 3.086 . 4.276 2.196 2.033 2.319 . 0 0 "[ . 1 . 2]" 1 624 1 45 VAL MG2 1 62 LEU MD2 3.086 . 4.276 2.280 2.154 2.446 . 0 0 "[ . 1 . 2]" 1 625 1 45 VAL HB 1 45 VAL MG2 3.086 . 4.276 2.126 2.123 2.128 . 0 0 "[ . 1 . 2]" 1 626 1 45 VAL MG2 1 65 MET ME 3.086 . 4.276 2.567 2.206 2.870 . 0 0 "[ . 1 . 2]" 1 627 1 45 VAL HA 1 45 VAL MG2 3.086 . 4.276 2.394 2.315 2.474 . 0 0 "[ . 1 . 2]" 1 628 1 45 VAL MG2 1 50 PHE HB2 3.285 . 4.634 4.557 4.333 4.665 0.031 7 0 "[ . 1 . 2]" 1 629 1 42 GLN HA 1 45 VAL MG2 3.086 . 4.276 3.162 2.863 3.395 . 0 0 "[ . 1 . 2]" 1 630 1 45 VAL MG2 1 62 LEU HA 3.086 . 4.276 3.163 3.022 3.367 . 0 0 "[ . 1 . 2]" 1 631 1 41 LEU HA 1 45 VAL MG2 3.086 . 4.276 3.750 3.444 4.017 . 0 0 "[ . 1 . 2]" 1 632 1 45 VAL MG2 1 65 MET HB2 3.086 . 4.276 3.111 2.912 3.542 . 0 0 "[ . 1 . 2]" 1 633 1 85 LEU HB2 1 85 LEU MD2 3.086 . 4.276 2.524 2.436 2.600 . 0 0 "[ . 1 . 2]" 1 634 1 20 LEU HB2 1 85 LEU MD2 3.086 . 4.276 4.167 3.835 4.353 0.077 5 0 "[ . 1 . 2]" 1 635 1 85 LEU HA 1 85 LEU MD2 3.086 . 4.276 3.843 3.824 3.862 . 0 0 "[ . 1 . 2]" 1 636 1 85 LEU HB2 1 85 LEU MD1 3.086 . 4.276 2.226 2.194 2.278 . 0 0 "[ . 1 . 2]" 1 637 1 85 LEU HA 1 85 LEU MD1 3.086 . 4.276 2.139 2.004 2.247 . 0 0 "[ . 1 . 2]" 1 638 1 85 LEU MD1 1 89 GLY QA 3.086 . 4.276 2.941 1.973 3.899 . 0 0 "[ . 1 . 2]" 1 639 1 61 VAL MG1 1 61 VAL MG2 3.086 . 4.276 2.088 2.084 2.096 . 0 0 "[ . 1 . 2]" 1 640 1 45 VAL MG2 1 61 VAL MG2 3.086 . 4.276 4.053 3.820 4.210 . 0 0 "[ . 1 . 2]" 1 641 1 61 VAL HB 1 61 VAL MG2 3.086 . 4.276 2.130 2.127 2.133 . 0 0 "[ . 1 . 2]" 1 642 1 60 LYS QE 1 61 VAL MG2 3.086 . 4.276 3.872 2.404 4.393 0.117 11 0 "[ . 1 . 2]" 1 643 1 61 VAL HA 1 61 VAL MG2 3.086 . 4.276 2.399 2.367 2.421 . 0 0 "[ . 1 . 2]" 1 644 1 61 VAL HB 1 61 VAL MG1 3.086 . 4.276 2.133 2.129 2.138 . 0 0 "[ . 1 . 2]" 1 645 1 61 VAL HA 1 61 VAL MG1 3.086 . 4.276 2.383 2.358 2.405 . 0 0 "[ . 1 . 2]" 1 646 1 9 VAL HB 1 9 VAL MG1 3.086 . 4.276 2.126 2.113 2.132 . 0 0 "[ . 1 . 2]" 1 647 1 9 VAL HA 1 9 VAL MG1 3.086 . 4.276 2.663 2.274 3.220 . 0 0 "[ . 1 . 2]" 1 648 1 43 THR HA 1 43 THR MG 3.086 . 4.276 3.149 2.677 3.219 . 0 0 "[ . 1 . 2]" 1 649 1 43 THR HB 1 43 THR MG 3.086 . 4.276 2.131 2.112 2.135 . 0 0 "[ . 1 . 2]" 1 650 1 40 ALA HA 1 43 THR MG 3.086 . 4.276 2.570 2.192 3.288 . 0 0 "[ . 1 . 2]" 1 651 1 43 THR MG 1 44 GLN HA 3.086 . 4.276 3.289 3.154 3.417 . 0 0 "[ . 1 . 2]" 1 652 1 8 THR HA 1 8 THR MG 3.086 . 4.276 2.432 2.227 3.220 . 0 0 "[ . 1 . 2]" 1 653 1 8 THR HB 1 8 THR MG 3.086 . 4.276 2.134 2.128 2.139 . 0 0 "[ . 1 . 2]" 1 654 1 82 LEU MD2 1 85 LEU MD2 3.086 . 4.276 3.208 2.749 3.619 . 0 0 "[ . 1 . 2]" 1 655 1 82 LEU HB3 1 82 LEU MD2 3.086 . 4.276 2.444 2.378 2.519 . 0 0 "[ . 1 . 2]" 1 656 1 20 LEU HB3 1 82 LEU MD2 3.086 . 4.276 2.234 1.886 3.007 0.010 11 0 "[ . 1 . 2]" 1 657 1 82 LEU MD2 1 82 LEU HG 3.086 . 4.276 2.124 2.118 2.129 . 0 0 "[ . 1 . 2]" 1 658 1 82 LEU HA 1 82 LEU MD2 3.086 . 4.276 1.962 1.889 2.078 0.007 11 0 "[ . 1 . 2]" 1 659 1 20 LEU HA 1 82 LEU MD2 3.086 . 4.276 3.349 2.818 3.631 . 0 0 "[ . 1 . 2]" 1 660 1 23 GLU HG3 1 82 LEU MD1 3.086 . 4.276 2.650 2.084 3.942 . 0 0 "[ . 1 . 2]" 1 661 1 23 GLU QB 1 82 LEU MD1 3.086 . 4.276 2.393 2.105 2.721 . 0 0 "[ . 1 . 2]" 1 662 1 41 LEU MD1 1 68 ALA MB 3.086 . 4.276 2.210 2.027 2.343 . 0 0 "[ . 1 . 2]" 1 663 1 38 LEU MD2 1 68 ALA MB 3.086 . 4.276 2.375 2.146 2.684 . 0 0 "[ . 1 . 2]" 1 664 1 37 LYS QE 1 68 ALA MB 3.086 . 4.276 2.346 1.968 3.608 . 0 0 "[ . 1 . 2]" 1 665 1 37 LYS QB 1 40 ALA MB 3.086 . 4.276 4.365 4.308 4.451 0.175 5 0 "[ . 1 . 2]" 1 666 1 65 MET HA 1 68 ALA MB 3.086 . 4.276 2.691 2.458 2.843 . 0 0 "[ . 1 . 2]" 1 667 1 37 LYS HA 1 40 ALA MB 3.086 . 4.276 2.636 2.555 2.752 . 0 0 "[ . 1 . 2]" 1 668 1 40 ALA HA 1 40 ALA MB 3.086 . 4.276 2.129 2.125 2.134 . 0 0 "[ . 1 . 2]" 1 669 1 68 ALA HA 1 68 ALA MB 3.086 . 4.276 2.128 2.124 2.132 . 0 0 "[ . 1 . 2]" 1 670 1 84 ALA HA 1 84 ALA MB 3.086 . 4.276 2.128 2.123 2.131 . 0 0 "[ . 1 . 2]" 1 671 1 81 TYR HA 1 84 ALA MB 3.086 . 4.276 2.543 2.236 2.693 . 0 0 "[ . 1 . 2]" 1 672 1 75 ALA HA 1 75 ALA MB 3.086 . 4.276 2.130 2.126 2.133 . 0 0 "[ . 1 . 2]" 1 673 1 60 LYS HA 1 63 ALA MB 3.086 . 4.276 3.153 2.622 3.563 . 0 0 "[ . 1 . 2]" 1 674 1 48 ALA HA 1 48 ALA MB 3.086 . 4.276 2.126 2.120 2.135 . 0 0 "[ . 1 . 2]" 1 675 1 43 THR HA 1 46 ALA MB 3.086 . 4.276 2.133 2.041 2.294 . 0 0 "[ . 1 . 2]" 1 676 1 46 ALA HA 1 46 ALA MB 3.086 . 4.276 2.127 2.125 2.130 . 0 0 "[ . 1 . 2]" 1 677 1 72 LEU HA 1 75 ALA MB 3.086 . 4.276 2.942 2.784 3.078 . 0 0 "[ . 1 . 2]" 1 678 1 46 ALA MB 1 47 ASP HA 3.086 . 4.276 3.908 3.824 3.978 . 0 0 "[ . 1 . 2]" 1 679 1 6 ALA HA 1 6 ALA MB 3.086 . 4.276 2.130 2.123 2.138 . 0 0 "[ . 1 . 2]" 1 680 1 48 ALA MB 1 49 SER HA 3.086 . 4.276 3.921 3.863 3.969 . 0 0 "[ . 1 . 2]" 1 681 1 31 LEU HA 1 75 ALA MB 3.086 . 4.276 3.830 3.636 3.992 . 0 0 "[ . 1 . 2]" 1 682 1 47 ASP HA 1 48 ALA MB 3.086 . 4.276 3.979 3.950 4.009 . 0 0 "[ . 1 . 2]" 1 683 1 71 GLU HG3 1 75 ALA MB 3.086 . 4.276 3.039 2.548 3.843 . 0 0 "[ . 1 . 2]" 1 684 1 27 LEU QD 1 75 ALA MB 3.086 . 4.276 1.955 1.886 2.059 0.010 1 0 "[ . 1 . 2]" 1 685 1 30 LEU MD2 1 75 ALA MB 3.086 . 4.276 2.360 2.140 2.541 . 0 0 "[ . 1 . 2]" 1 686 1 34 LEU QD 1 75 ALA MB 3.086 . 4.276 2.528 2.375 2.735 . 0 0 "[ . 1 . 2]" 1 687 1 37 LYS QB 1 68 ALA MB 3.086 . 4.276 2.790 2.634 2.960 . 0 0 "[ . 1 . 2]" 1 688 1 18 TYR HA 1 21 GLN HG3 3.086 . 4.276 2.438 2.049 3.078 . 0 0 "[ . 1 . 2]" 1 689 1 53 GLN HA 1 54 PRO HD3 3.086 . 4.276 2.108 1.873 2.779 0.023 17 0 "[ . 1 . 2]" 1 690 1 53 GLN HA 1 54 PRO HD2 3.086 . 4.276 2.873 2.311 3.367 . 0 0 "[ . 1 . 2]" 1 691 1 53 GLN HB3 1 54 PRO HD2 3.086 . 4.276 2.117 1.816 2.341 0.080 7 0 "[ . 1 . 2]" 1 692 1 53 GLN HB3 1 54 PRO HD3 3.086 . 4.276 3.011 2.411 3.512 . 0 0 "[ . 1 . 2]" 1 693 1 53 GLN HB2 1 54 PRO HD2 3.086 . 4.276 3.735 3.418 3.960 . 0 0 "[ . 1 . 2]" 1 694 1 54 PRO HB3 1 54 PRO HD3 3.086 . 4.276 3.946 2.981 4.106 . 0 0 "[ . 1 . 2]" 1 695 1 54 PRO HD2 1 57 GLN HG3 3.086 . 4.276 2.285 1.795 3.345 0.101 8 0 "[ . 1 . 2]" 1 696 1 54 PRO HB3 1 54 PRO HD2 3.086 . 4.276 3.891 3.800 3.973 . 0 0 "[ . 1 . 2]" 1 697 1 54 PRO HB2 1 54 PRO HD2 3.086 . 4.276 3.051 2.792 4.032 . 0 0 "[ . 1 . 2]" 1 698 1 28 PRO HB2 1 28 PRO HD2 3.086 . 4.276 2.931 2.893 3.017 . 0 0 "[ . 1 . 2]" 1 699 1 28 PRO HB3 1 28 PRO HD2 3.086 . 4.276 3.885 3.865 3.931 . 0 0 "[ . 1 . 2]" 1 700 1 54 PRO HA 1 54 PRO HG3 3.086 . 4.276 3.103 2.956 3.946 . 0 0 "[ . 1 . 2]" 1 701 1 54 PRO HD3 1 58 THR MG 3.285 . 5.000 4.827 4.548 5.089 0.089 15 0 "[ . 1 . 2]" 1 702 1 27 LEU QB 1 28 PRO HD2 3.086 . 4.276 3.239 2.905 3.520 . 0 0 "[ . 1 . 2]" 1 703 1 16 LEU HA 1 16 LEU QD 3.086 . 4.276 2.255 1.813 3.397 0.083 12 0 "[ . 1 . 2]" 1 704 1 53 GLN HA 1 53 GLN QG 3.086 . 4.276 2.567 2.324 2.995 . 0 0 "[ . 1 . 2]" 1 705 1 16 LEU HA 1 20 LEU QD 3.086 . 4.276 2.765 2.010 3.743 . 0 0 "[ . 1 . 2]" 1 706 1 53 GLN HA 1 58 THR MG 3.086 . 4.276 4.045 3.914 4.259 . 0 0 "[ . 1 . 2]" 1 707 1 66 ALA HA 1 66 ALA MB 3.086 . 4.276 2.132 2.129 2.136 . 0 0 "[ . 1 . 2]" 1 708 1 67 ALA HA 1 67 ALA MB 3.086 . 4.276 2.127 2.116 2.131 . 0 0 "[ . 1 . 2]" 1 709 1 34 LEU QD 1 68 ALA HA 3.086 . 4.276 2.950 2.561 3.283 . 0 0 "[ . 1 . 2]" 1 710 1 68 ALA HA 1 71 GLU HB3 3.086 . 4.276 2.976 2.769 3.221 . 0 0 "[ . 1 . 2]" 1 711 1 30 LEU MD2 1 75 ALA HA 3.086 . 4.276 4.266 4.059 4.335 0.059 14 0 "[ . 1 . 2]" 1 712 1 83 GLU HB3 1 84 ALA HA 3.285 . 4.634 4.111 3.821 4.284 . 0 0 "[ . 1 . 2]" 1 713 1 16 LEU HA 1 20 LEU HB2 3.086 . 4.276 3.601 2.941 4.422 0.146 2 0 "[ . 1 . 2]" 1 714 1 75 ALA HA 1 78 ARG HB2 3.086 . 4.276 3.036 2.378 3.569 . 0 0 "[ . 1 . 2]" 1 715 1 10 LYS HA 1 10 LYS HG2 3.086 . 4.276 3.057 2.340 3.763 . 0 0 "[ . 1 . 2]" 1 716 1 11 ARG HA 1 11 ARG QG 3.086 . 4.276 2.661 2.300 3.343 . 0 0 "[ . 1 . 2]" 1 717 1 7 GLU HA 1 7 GLU QG 3.086 . 4.276 2.739 2.364 3.471 . 0 0 "[ . 1 . 2]" 1 718 1 20 LEU HA 1 20 LEU HG 3.086 . 4.276 2.808 2.421 3.565 . 0 0 "[ . 1 . 2]" 1 719 1 41 LEU MD1 1 64 ASP HA 3.086 . 4.276 4.056 3.865 4.125 . 0 0 "[ . 1 . 2]" 1 720 1 82 LEU HA 1 85 LEU MD2 3.086 . 4.276 3.522 3.213 3.817 . 0 0 "[ . 1 . 2]" 1 721 1 16 LEU QD 1 82 LEU HA 3.086 . 4.276 3.143 2.705 3.576 . 0 0 "[ . 1 . 2]" 1 722 1 82 LEU HA 1 85 LEU HB3 3.086 . 4.276 2.834 2.501 3.086 . 0 0 "[ . 1 . 2]" 1 723 1 82 LEU HA 1 82 LEU HG 3.086 . 4.276 3.202 3.088 3.369 . 0 0 "[ . 1 . 2]" 1 724 1 32 GLU HG3 1 33 ASP HA 3.086 . 4.276 3.699 3.327 4.023 . 0 0 "[ . 1 . 2]" 1 725 1 32 GLU QB 1 33 ASP HA 3.285 . 4.634 4.501 4.401 4.568 . 0 0 "[ . 1 . 2]" 1 726 1 33 ASP HA 1 36 ALA MB 3.086 . 4.276 3.132 2.976 3.312 . 0 0 "[ . 1 . 2]" 1 727 1 41 LEU HA 1 41 LEU MD2 3.086 . 4.276 2.086 1.975 2.166 . 0 0 "[ . 1 . 2]" 1 728 1 38 LEU HA 1 38 LEU MD2 3.086 . 4.276 1.980 1.922 2.104 . 0 0 "[ . 1 . 2]" 1 729 1 34 LEU QD 1 72 LEU HA 3.086 . 4.276 2.062 1.920 2.183 . 0 0 "[ . 1 . 2]" 1 730 1 30 LEU HA 1 30 LEU MD1 3.086 . 4.276 2.304 2.220 2.515 . 0 0 "[ . 1 . 2]" 1 731 1 30 LEU HA 1 30 LEU HG 3.086 . 4.276 3.135 3.070 3.215 . 0 0 "[ . 1 . 2]" 1 732 1 38 LEU HA 1 68 ALA MB 3.086 . 4.276 2.656 2.508 2.974 . 0 0 "[ . 1 . 2]" 1 733 1 22 ARG HA 1 22 ARG QG 3.086 . 4.276 2.941 2.407 3.391 . 0 0 "[ . 1 . 2]" 1 734 1 22 ARG HA 1 22 ARG QB 3.086 . 4.276 2.301 2.137 2.505 . 0 0 "[ . 1 . 2]" 1 735 1 34 LEU HA 1 37 LYS QB 3.086 . 4.276 1.994 1.913 2.065 . 0 0 "[ . 1 . 2]" 1 736 1 31 LEU HA 1 72 LEU QD 3.086 . 4.276 2.314 2.135 2.530 . 0 0 "[ . 1 . 2]" 1 737 1 31 LEU HA 1 34 LEU QD 3.086 . 4.276 2.955 2.686 3.133 . 0 0 "[ . 1 . 2]" 1 738 1 34 LEU HA 1 37 LYS QD 3.086 . 4.276 2.808 2.626 2.966 . 0 0 "[ . 1 . 2]" 1 739 1 41 LEU HA 1 41 LEU HG 3.086 . 4.276 2.972 2.913 3.038 . 0 0 "[ . 1 . 2]" 1 740 1 31 LEU HA 1 34 LEU HG 3.086 . 4.276 3.813 3.604 3.927 . 0 0 "[ . 1 . 2]" 1 741 1 24 LEU QD 1 83 GLU HA 3.086 . 4.276 2.463 2.141 2.653 . 0 0 "[ . 1 . 2]" 1 742 1 37 LYS HA 1 37 LYS HG2 3.086 . 4.276 3.049 2.896 3.142 . 0 0 "[ . 1 . 2]" 1 743 1 62 LEU HA 1 62 LEU MD2 3.086 . 4.276 1.997 1.937 2.102 . 0 0 "[ . 1 . 2]" 1 744 1 59 GLN HA 1 62 LEU MD1 3.086 . 4.276 2.479 1.860 2.763 0.036 13 0 "[ . 1 . 2]" 1 745 1 59 GLN HA 1 62 LEU MD2 3.086 . 5.000 4.579 4.196 4.792 . 0 0 "[ . 1 . 2]" 1 746 1 62 LEU HA 1 62 LEU MD1 3.086 . 4.276 3.858 3.832 3.903 . 0 0 "[ . 1 . 2]" 1 747 1 72 LEU HA 1 72 LEU QD 3.086 . 4.276 2.040 1.972 2.092 . 0 0 "[ . 1 . 2]" 1 748 1 42 GLN HA 1 45 VAL HB 3.086 . 4.276 2.481 2.276 2.720 . 0 0 "[ . 1 . 2]" 1 749 1 86 LYS HA 1 86 LYS QG 3.086 . 4.276 2.462 2.279 2.586 . 0 0 "[ . 1 . 2]" 1 750 1 25 GLU HA 1 25 GLU HG2 3.086 . 4.276 2.936 2.381 4.099 . 0 0 "[ . 1 . 2]" 1 751 1 59 GLN HA 1 59 GLN QG 3.086 . 4.276 2.921 2.687 3.420 . 0 0 "[ . 1 . 2]" 1 752 1 27 LEU HA 1 27 LEU QD 3.086 . 4.276 2.403 2.118 2.524 . 0 0 "[ . 1 . 2]" 1 753 1 27 LEU HA 1 30 LEU MD2 3.086 . 4.276 2.771 2.621 2.900 . 0 0 "[ . 1 . 2]" 1 754 1 55 HIS HA 1 58 THR MG 3.086 . 4.276 3.774 3.595 4.034 . 0 0 "[ . 1 . 2]" 1 755 1 55 HIS HA 1 59 GLN QB 3.086 . 4.276 4.318 4.069 4.392 0.116 19 0 "[ . 1 . 2]" 1 756 1 55 HIS HA 1 59 GLN QG 3.086 . 4.276 3.146 2.756 3.757 . 0 0 "[ . 1 . 2]" 1 757 1 37 LYS HA 1 37 LYS QB 3.086 . 4.276 2.369 2.356 2.381 . 0 0 "[ . 1 . 2]" 1 758 1 19 LYS HA 1 19 LYS HG3 3.086 . 4.276 3.543 2.745 3.920 . 0 0 "[ . 1 . 2]" 1 759 1 19 LYS HA 1 19 LYS HG2 3.086 . 4.276 3.439 2.619 3.853 . 0 0 "[ . 1 . 2]" 1 760 1 77 GLU HA 1 77 GLU QG 3.086 . 4.276 2.833 2.310 3.379 . 0 0 "[ . 1 . 2]" 1 761 1 39 GLU HA 1 42 GLN HB3 3.086 . 4.276 4.120 3.724 4.355 0.079 8 0 "[ . 1 . 2]" 1 762 1 39 GLU HA 1 39 GLU QB 3.086 . 4.276 2.381 2.303 2.460 . 0 0 "[ . 1 . 2]" 1 763 1 56 GLU HA 1 56 GLU QB 3.086 . 4.276 2.347 2.287 2.386 . 0 0 "[ . 1 . 2]" 1 764 1 72 LEU HG 1 73 GLU HA 3.086 . 4.276 3.494 3.247 4.704 0.428 14 0 "[ . 1 . 2]" 1 765 1 38 LEU MD1 1 39 GLU HA 3.086 . 4.276 2.794 2.629 3.013 . 0 0 "[ . 1 . 2]" 1 766 1 27 LEU HA 1 30 LEU HB3 3.086 . 4.276 2.192 2.101 2.283 . 0 0 "[ . 1 . 2]" 1 767 1 77 GLU HA 1 80 GLU HB2 3.086 . 4.276 2.951 2.322 3.628 . 0 0 "[ . 1 . 2]" 1 768 1 27 LEU HA 1 27 LEU HG 3.086 . 4.276 2.592 2.432 3.507 . 0 0 "[ . 1 . 2]" 1 769 1 35 GLU HA 1 72 LEU QD 3.086 . 4.276 2.007 1.845 2.786 0.051 4 0 "[ . 1 . 2]" 1 770 1 41 LEU MD1 1 65 MET HA 3.086 . 4.276 1.856 1.817 1.950 0.079 15 0 "[ . 1 . 2]" 1 771 1 39 GLU HA 1 39 GLU HG3 3.086 . 4.276 3.480 2.803 3.787 . 0 0 "[ . 1 . 2]" 1 772 1 27 LEU QD 1 79 TRP HA 3.086 . 4.276 1.937 1.870 2.027 0.026 14 0 "[ . 1 . 2]" 1 773 1 79 TRP HA 1 82 LEU MD1 3.086 . 4.276 2.564 2.364 2.812 . 0 0 "[ . 1 . 2]" 1 774 1 79 TRP HA 1 82 LEU HB2 3.086 . 4.276 2.733 2.556 2.952 . 0 0 "[ . 1 . 2]" 1 775 1 75 ALA MB 1 76 PHE HA 3.086 . 4.276 3.900 3.866 3.957 . 0 0 "[ . 1 . 2]" 1 776 1 27 LEU QD 1 76 PHE HA 3.086 . 4.276 3.345 3.245 3.528 . 0 0 "[ . 1 . 2]" 1 777 1 58 THR HA 1 61 VAL MG1 3.285 . 4.634 4.419 4.314 4.514 . 0 0 "[ . 1 . 2]" 1 778 1 58 THR HA 1 62 LEU MD1 3.285 . 4.634 4.249 4.050 4.635 0.001 10 0 "[ . 1 . 2]" 1 779 1 58 THR HA 1 61 VAL MG2 3.086 . 4.276 3.164 3.015 3.236 . 0 0 "[ . 1 . 2]" 1 780 1 58 THR HA 1 61 VAL HB 3.086 . 4.276 3.023 2.892 3.110 . 0 0 "[ . 1 . 2]" 1 781 1 41 LEU MD2 1 61 VAL HA 3.086 . 4.276 3.136 2.791 3.776 . 0 0 "[ . 1 . 2]" 1 782 1 28 PRO HA 1 31 LEU HB2 3.086 . 4.276 2.460 2.190 2.684 . 0 0 "[ . 1 . 2]" 1 783 1 58 THR HB 1 62 LEU MD1 3.086 . 4.276 2.740 2.522 3.103 . 0 0 "[ . 1 . 2]" 1 784 1 58 THR HB 1 62 LEU HG 3.086 . 4.276 3.201 2.992 3.326 . 0 0 "[ . 1 . 2]" 1 785 1 58 THR HB 1 61 VAL HB 3.285 . 4.634 4.729 4.664 4.820 0.186 8 0 "[ . 1 . 2]" 1 786 1 58 THR HB 1 62 LEU MD2 3.086 . 4.276 4.061 3.745 4.293 0.017 10 0 "[ . 1 . 2]" 1 787 1 84 ALA HA 1 87 ASN HB3 3.086 . 4.276 3.313 2.655 4.354 0.078 18 0 "[ . 1 . 2]" 1 788 1 47 ASP HA 1 47 ASP QB 3.086 . 4.276 2.372 2.275 2.450 . 0 0 "[ . 1 . 2]" 1 789 1 36 ALA HA 1 39 GLU HG3 3.086 . 4.276 3.583 2.948 4.400 0.124 13 0 "[ . 1 . 2]" 1 790 1 35 GLU QG 1 36 ALA HA 3.086 . 4.276 3.793 3.425 4.122 . 0 0 "[ . 1 . 2]" 1 791 1 66 ALA HA 1 69 GLU HG2 3.086 . 4.276 2.140 1.936 2.586 . 0 0 "[ . 1 . 2]" 1 792 1 75 ALA HA 1 78 ARG HB3 3.086 . 4.276 2.549 2.154 3.959 . 0 0 "[ . 1 . 2]" 1 793 1 11 ARG HA 1 11 ARG QD 3.086 . 4.276 3.119 1.911 4.265 . 0 0 "[ . 1 . 2]" 1 794 1 10 LYS HA 1 10 LYS QE 3.086 . 4.276 3.903 2.360 4.485 0.209 10 0 "[ . 1 . 2]" 1 795 1 26 GLN HA 1 26 GLN QG 3.086 . 4.276 2.934 2.388 3.429 . 0 0 "[ . 1 . 2]" 1 796 1 78 ARG HA 1 78 ARG QD 3.086 . 4.276 2.259 2.066 2.727 . 0 0 "[ . 1 . 2]" 1 797 1 78 ARG HA 1 81 TYR HB3 3.086 . 4.276 2.598 2.367 2.837 . 0 0 "[ . 1 . 2]" 1 798 1 17 SER HA 1 17 SER QB 3.086 . 4.276 2.407 2.351 2.441 . 0 0 "[ . 1 . 2]" 1 799 1 22 ARG HA 1 22 ARG QD 3.086 . 4.276 3.022 1.937 3.833 . 0 0 "[ . 1 . 2]" 1 800 1 30 LEU HA 1 33 ASP HB2 3.086 . 4.276 2.119 2.047 2.238 . 0 0 "[ . 1 . 2]" 1 801 1 30 LEU HA 1 33 ASP HB3 3.086 . 4.276 2.690 2.455 2.875 . 0 0 "[ . 1 . 2]" 1 802 1 62 LEU HA 1 65 MET HB3 3.086 . 4.276 2.529 2.398 2.763 . 0 0 "[ . 1 . 2]" 1 803 1 74 GLN HA 1 74 GLN HG2 3.086 . 4.276 3.390 2.507 3.848 . 0 0 "[ . 1 . 2]" 1 804 1 41 LEU HA 1 44 GLN HG2 3.086 . 4.276 2.438 1.950 2.846 . 0 0 "[ . 1 . 2]" 1 805 1 52 SER HA 1 52 SER QB 3.086 . 4.276 2.373 2.327 2.426 . 0 0 "[ . 1 . 2]" 1 806 1 25 GLU HA 1 25 GLU HG3 3.086 . 4.276 3.245 2.678 3.728 . 0 0 "[ . 1 . 2]" 1 807 1 44 GLN HA 1 47 ASP QB 3.086 . 4.276 3.379 3.049 3.916 . 0 0 "[ . 1 . 2]" 1 808 1 37 LYS HA 1 37 LYS QE 3.285 . 4.634 4.677 4.596 4.873 0.239 4 0 "[ . 1 . 2]" 1 809 1 42 GLN HA 1 42 GLN HG2 3.086 . 4.276 2.544 2.424 2.642 . 0 0 "[ . 1 . 2]" 1 810 1 71 GLU HA 1 74 GLN HG3 3.086 . 4.276 3.361 2.713 4.308 0.032 1 0 "[ . 1 . 2]" 1 811 1 73 GLU HA 1 76 PHE QB 3.086 . 4.276 2.140 1.865 2.367 0.031 15 0 "[ . 1 . 2]" 1 812 1 73 GLU HA 1 73 GLU HG2 3.086 . 4.276 3.420 2.660 3.786 . 0 0 "[ . 1 . 2]" 1 813 1 80 GLU HA 1 80 GLU HG3 3.086 . 4.276 3.283 3.011 3.667 . 0 0 "[ . 1 . 2]" 1 814 1 76 PHE HA 1 76 PHE QB 3.086 . 4.276 2.533 2.526 2.537 . 0 0 "[ . 1 . 2]" 1 815 1 76 PHE HA 1 79 TRP HB3 3.086 . 4.276 2.547 2.387 2.643 . 0 0 "[ . 1 . 2]" 1 816 1 50 PHE HA 1 53 GLN QG 3.086 . 4.276 3.261 2.632 3.823 . 0 0 "[ . 1 . 2]" 1 817 1 54 PRO HA 1 54 PRO HD3 3.086 . 4.276 3.673 3.223 3.876 . 0 0 "[ . 1 . 2]" 1 818 1 54 PRO HA 1 54 PRO HD2 3.086 . 4.276 3.931 3.879 4.072 . 0 0 "[ . 1 . 2]" 1 819 1 61 VAL HA 1 64 ASP HB2 3.086 . 4.276 3.559 2.775 4.066 . 0 0 "[ . 1 . 2]" 1 820 1 61 VAL HA 1 64 ASP HB3 3.086 . 4.276 2.873 2.558 3.221 . 0 0 "[ . 1 . 2]" 1 821 1 40 ALA HA 1 43 THR HB 3.086 . 4.276 3.751 2.351 4.254 . 0 0 "[ . 1 . 2]" 1 822 1 43 THR HA 1 46 ALA HA 3.086 . 5.000 4.617 4.529 4.788 . 0 0 "[ . 1 . 2]" 1 823 1 55 HIS HA 1 58 THR HB 3.086 . 4.276 4.347 4.242 4.461 0.185 8 0 "[ . 1 . 2]" 1 824 1 62 LEU MD2 1 65 MET ME 3.086 . 4.276 2.099 2.055 2.176 . 0 0 "[ . 1 . 2]" 1 825 1 65 MET ME 1 66 ALA MB 3.086 . 4.276 3.544 3.301 3.925 . 0 0 "[ . 1 . 2]" 1 826 1 19 LYS HG2 1 20 LEU QD 3.086 . 4.276 3.523 2.271 4.417 0.141 10 0 "[ . 1 . 2]" 1 827 1 34 LEU QD 1 37 LYS HG2 3.285 . 4.634 4.502 4.278 4.601 . 0 0 "[ . 1 . 2]" 1 828 1 37 LYS HG2 1 41 LEU MD1 3.086 . 4.276 2.191 2.045 2.313 . 0 0 "[ . 1 . 2]" 1 829 1 37 LYS HG2 1 41 LEU MD2 3.086 . 4.276 3.988 3.758 4.161 . 0 0 "[ . 1 . 2]" 1 830 1 19 LYS HG3 1 20 LEU QD 3.086 . 4.276 2.527 1.801 4.255 0.095 18 0 "[ . 1 . 2]" 1 831 1 37 LYS QB 1 37 LYS HG2 3.086 . 4.276 2.364 2.325 2.398 . 0 0 "[ . 1 . 2]" 1 832 1 37 LYS QB 1 37 LYS HG3 3.086 . 4.276 2.317 2.269 2.354 . 0 0 "[ . 1 . 2]" 1 833 1 37 LYS QD 1 37 LYS HG2 3.086 . 4.276 2.367 2.317 2.411 . 0 0 "[ . 1 . 2]" 1 834 1 37 LYS QD 1 37 LYS HG3 3.086 . 4.276 2.322 2.265 2.374 . 0 0 "[ . 1 . 2]" 1 835 1 37 LYS HG3 1 41 LEU HG 3.086 . 4.276 3.759 3.511 3.922 . 0 0 "[ . 1 . 2]" 1 836 1 16 LEU QD 1 85 LEU HG 3.086 . 4.276 3.621 3.044 4.222 . 0 0 "[ . 1 . 2]" 1 837 1 34 LEU QD 1 34 LEU HG 3.086 . 4.276 1.892 1.889 1.895 0.007 6 0 "[ . 1 . 2]" 1 838 1 22 ARG QB 1 22 ARG QG 3.086 . 4.276 1.993 1.973 2.009 . 0 0 "[ . 1 . 2]" 1 839 1 24 LEU QD 1 24 LEU HG 3.086 . 4.276 1.894 1.889 1.898 0.007 19 0 "[ . 1 . 2]" 1 840 1 41 LEU MD1 1 41 LEU HG 3.086 . 4.276 2.121 2.116 2.125 . 0 0 "[ . 1 . 2]" 1 841 1 41 LEU MD2 1 41 LEU HG 3.086 . 4.276 2.126 2.122 2.129 . 0 0 "[ . 1 . 2]" 1 842 1 62 LEU MD2 1 62 LEU HG 3.086 . 4.276 2.129 2.126 2.131 . 0 0 "[ . 1 . 2]" 1 843 1 62 LEU MD1 1 62 LEU HG 3.086 . 4.276 2.127 2.124 2.132 . 0 0 "[ . 1 . 2]" 1 844 1 20 LEU QD 1 20 LEU HG 3.086 . 4.276 1.890 1.885 1.896 0.011 3 0 "[ . 1 . 2]" 1 845 1 59 GLN QB 1 62 LEU MD1 3.086 . 4.276 4.059 2.970 4.326 0.050 17 0 "[ . 1 . 2]" 1 846 1 11 ARG HB3 1 11 ARG QG 3.086 . 4.276 2.302 2.157 2.390 . 0 0 "[ . 1 . 2]" 1 847 1 60 LYS QD 1 60 LYS HG3 3.086 . 4.276 2.376 2.286 2.428 . 0 0 "[ . 1 . 2]" 1 848 1 59 GLN QB 1 59 GLN QG 3.086 . 4.276 1.981 1.935 2.010 . 0 0 "[ . 1 . 2]" 1 849 1 53 GLN HB2 1 53 GLN QG 3.086 . 4.276 2.279 2.129 2.420 . 0 0 "[ . 1 . 2]" 1 850 1 59 GLN QB 1 63 ALA MB 3.086 . 4.276 3.597 3.457 3.970 . 0 0 "[ . 1 . 2]" 1 851 1 44 GLN HB2 1 61 VAL MG1 3.086 . 4.276 3.282 2.236 4.269 . 0 0 "[ . 1 . 2]" 1 852 1 24 LEU QD 1 28 PRO HG3 3.086 . 4.276 3.019 2.495 4.031 . 0 0 "[ . 1 . 2]" 1 853 1 45 VAL HA 1 62 LEU MD2 3.285 . 4.634 4.080 3.941 4.257 . 0 0 "[ . 1 . 2]" 1 854 1 27 LEU QB 1 28 PRO HG3 3.086 . 4.276 3.609 3.460 3.968 . 0 0 "[ . 1 . 2]" 1 855 1 57 GLN QB 1 58 THR MG 3.086 . 4.276 3.162 2.526 4.285 0.009 16 0 "[ . 1 . 2]" 1 856 1 27 LEU HG 1 30 LEU MD2 3.086 . 4.276 3.080 2.669 4.384 0.108 10 0 "[ . 1 . 2]" 1 857 1 24 LEU QD 1 86 LYS QD 3.086 . 4.276 3.542 2.249 4.268 . 0 0 "[ . 1 . 2]" 1 858 1 34 LEU QD 1 37 LYS QD 3.086 . 4.276 2.427 2.334 2.527 . 0 0 "[ . 1 . 2]" 1 859 1 24 LEU QD 1 83 GLU HB3 3.086 . 4.276 4.138 3.905 4.304 0.028 5 0 "[ . 1 . 2]" 1 860 1 37 LYS QB 1 37 LYS QD 3.086 . 4.276 2.136 2.097 2.165 . 0 0 "[ . 1 . 2]" 1 861 1 19 LYS QD 1 19 LYS HG2 3.086 . 4.276 2.303 2.163 2.439 . 0 0 "[ . 1 . 2]" 1 862 1 38 LEU MD1 1 69 GLU HB3 3.086 . 4.276 3.608 3.258 3.904 . 0 0 "[ . 1 . 2]" 1 863 1 34 LEU QD 1 71 GLU HB3 3.086 . 4.276 2.205 2.030 2.588 . 0 0 "[ . 1 . 2]" 1 864 1 34 LEU QD 1 71 GLU HB2 3.086 . 4.276 3.325 3.188 3.599 . 0 0 "[ . 1 . 2]" 1 865 1 37 LYS QD 1 41 LEU MD1 3.086 . 4.276 3.495 3.314 3.685 . 0 0 "[ . 1 . 2]" 1 866 1 11 ARG HB2 1 11 ARG QG 3.086 . 4.276 2.293 2.157 2.413 . 0 0 "[ . 1 . 2]" 1 867 1 7 GLU HB2 1 7 GLU QG 3.086 . 4.276 2.294 2.151 2.420 . 0 0 "[ . 1 . 2]" 1 868 1 7 GLU HB3 1 7 GLU QG 3.086 . 4.276 2.298 2.154 2.410 . 0 0 "[ . 1 . 2]" 1 869 1 45 VAL HB 1 62 LEU MD2 3.086 . 4.276 4.075 3.927 4.270 . 0 0 "[ . 1 . 2]" 1 870 1 45 VAL HB 1 65 MET ME 3.086 . 4.276 3.683 3.265 4.002 . 0 0 "[ . 1 . 2]" 1 871 1 38 LEU MD2 1 65 MET HG3 3.086 . 4.276 2.245 2.087 2.582 . 0 0 "[ . 1 . 2]" 1 872 1 41 LEU MD1 1 65 MET HG3 3.086 . 4.276 3.701 3.542 4.310 0.034 14 0 "[ . 1 . 2]" 1 873 1 45 VAL MG2 1 65 MET HG3 3.285 . 4.634 4.056 3.751 4.266 . 0 0 "[ . 1 . 2]" 1 874 1 41 LEU MD1 1 65 MET HG2 3.285 . 4.634 4.452 3.934 4.623 . 0 0 "[ . 1 . 2]" 1 875 1 38 LEU MD2 1 65 MET HG2 3.086 . 4.276 2.800 2.031 3.062 . 0 0 "[ . 1 . 2]" 1 876 1 65 MET ME 1 65 MET HG2 3.086 . 4.276 2.551 2.412 3.397 . 0 0 "[ . 1 . 2]" 1 877 1 65 MET ME 1 65 MET HG3 3.086 . 4.276 3.303 2.484 3.403 . 0 0 "[ . 1 . 2]" 1 878 1 34 LEU QD 1 37 LYS QB 3.086 . 4.276 3.070 2.971 3.132 . 0 0 "[ . 1 . 2]" 1 879 1 37 LYS QB 1 41 LEU MD1 3.086 . 4.276 3.850 3.742 3.993 . 0 0 "[ . 1 . 2]" 1 880 1 19 LYS HB3 1 20 LEU QD 3.086 . 4.276 3.859 2.568 4.305 0.029 2 0 "[ . 1 . 2]" 1 881 1 41 LEU HB3 1 65 MET HB2 3.086 . 4.276 2.149 1.936 2.277 . 0 0 "[ . 1 . 2]" 1 882 1 61 VAL MG1 1 65 MET HB2 3.086 . 4.276 3.185 2.999 3.774 . 0 0 "[ . 1 . 2]" 1 883 1 41 LEU MD1 1 65 MET HB2 3.285 . 4.634 2.975 2.818 3.188 . 0 0 "[ . 1 . 2]" 1 884 1 57 GLN HG3 1 58 THR MG 3.086 . 4.276 3.670 2.227 4.467 0.191 17 0 "[ . 1 . 2]" 1 885 1 57 GLN HG2 1 58 THR MG 3.086 . 4.276 4.073 3.404 4.445 0.169 18 0 "[ . 1 . 2]" 1 886 1 16 LEU QD 1 21 GLN HG3 3.086 . 4.276 2.699 1.879 3.779 0.017 17 0 "[ . 1 . 2]" 1 887 1 45 VAL MG2 1 65 MET HB3 3.086 . 4.276 3.593 3.431 3.751 . 0 0 "[ . 1 . 2]" 1 888 1 41 LEU MD1 1 65 MET HB3 3.086 . 4.276 3.949 3.790 4.126 . 0 0 "[ . 1 . 2]" 1 889 1 53 GLN HB2 1 57 GLN HG3 3.086 . 4.276 3.810 2.891 4.348 0.072 19 0 "[ . 1 . 2]" 1 890 1 16 LEU QD 1 21 GLN HG2 3.086 . 4.276 2.389 1.818 3.269 0.078 18 0 "[ . 1 . 2]" 1 891 1 38 LEU MD2 1 42 GLN HG3 3.086 . 4.276 2.624 2.424 2.830 . 0 0 "[ . 1 . 2]" 1 892 1 38 LEU MD2 1 42 GLN HG2 3.086 . 4.276 2.148 2.061 2.246 . 0 0 "[ . 1 . 2]" 1 893 1 59 GLN QG 1 62 LEU MD1 3.086 . 4.276 3.616 3.102 4.356 0.080 13 0 "[ . 1 . 2]" 1 894 1 59 GLN QG 1 63 ALA MB 3.086 . 5.000 5.098 4.962 5.167 0.167 19 0 "[ . 1 . 2]" 1 895 1 38 LEU HG 1 42 GLN HG3 3.086 . 4.276 4.220 4.028 4.326 0.050 11 0 "[ . 1 . 2]" 1 896 1 53 GLN QG 1 58 THR MG 3.086 . 4.276 3.643 3.534 3.765 . 0 0 "[ . 1 . 2]" 1 897 1 44 GLN HG2 1 45 VAL MG2 3.086 . 4.276 3.757 2.979 4.361 0.085 8 0 "[ . 1 . 2]" 1 898 1 44 GLN HG2 1 61 VAL MG1 3.086 . 4.276 3.688 3.225 4.139 . 0 0 "[ . 1 . 2]" 1 899 1 41 LEU MD2 1 44 GLN HG2 3.086 . 4.276 3.745 3.208 4.110 . 0 0 "[ . 1 . 2]" 1 900 1 43 THR MG 1 44 GLN HG2 3.086 . 4.276 3.252 2.577 4.342 0.066 5 0 "[ . 1 . 2]" 1 901 1 44 GLN HG3 1 45 VAL MG2 3.086 . 4.276 3.455 2.380 4.412 0.136 18 0 "[ . 1 . 2]" 1 902 1 41 LEU MD2 1 44 GLN HG3 3.086 . 4.276 3.679 3.096 4.242 . 0 0 "[ . 1 . 2]" 1 903 1 53 GLN HB3 1 53 GLN QG 3.086 . 4.276 2.312 2.245 2.453 . 0 0 "[ . 1 . 2]" 1 904 1 38 LEU MD1 1 42 GLN HG3 3.086 . 4.276 1.969 1.861 2.199 0.035 9 0 "[ . 1 . 2]" 1 905 1 38 LEU MD1 1 42 GLN HG2 3.086 . 4.276 2.837 2.665 3.045 . 0 0 "[ . 1 . 2]" 1 906 1 23 GLU HG3 1 27 LEU QD 3.086 . 4.276 2.677 2.117 4.048 . 0 0 "[ . 1 . 2]" 1 907 1 23 GLU HG2 1 82 LEU MD1 3.086 . 4.276 2.332 2.025 2.820 . 0 0 "[ . 1 . 2]" 1 908 1 23 GLU HG2 1 27 LEU QD 3.086 . 4.276 3.334 2.332 4.260 . 0 0 "[ . 1 . 2]" 1 909 1 24 LEU QD 1 83 GLU HG3 3.086 . 4.276 3.474 3.112 3.706 . 0 0 "[ . 1 . 2]" 1 910 1 24 LEU QD 1 83 GLU HG2 3.086 . 4.276 2.316 1.827 2.577 0.069 19 0 "[ . 1 . 2]" 1 911 1 23 GLU QB 1 23 GLU HG2 3.086 . 4.276 2.176 2.139 2.335 . 0 0 "[ . 1 . 2]" 1 912 1 34 LEU QD 1 71 GLU HG3 3.086 . 4.276 2.116 1.842 3.083 0.054 9 0 "[ . 1 . 2]" 1 913 1 77 GLU HB2 1 77 GLU QG 3.086 . 4.276 2.267 2.152 2.491 . 0 0 "[ . 1 . 2]" 1 914 1 56 GLU QB 1 56 GLU QG 3.086 . 4.276 2.062 2.004 2.087 . 0 0 "[ . 1 . 2]" 1 915 1 32 GLU QB 1 32 GLU HG2 3.086 . 4.276 2.326 2.204 2.378 . 0 0 "[ . 1 . 2]" 1 916 1 34 LEU QD 1 71 GLU HG2 3.086 . 4.276 2.103 1.716 2.350 0.180 15 0 "[ . 1 . 2]" 1 917 1 31 LEU QD 1 71 GLU HG3 3.285 . 5.000 4.998 4.534 5.995 0.995 19 1 "[ . 1 . +2]" 1 918 1 51 PHE HB3 1 58 THR MG 3.285 . 4.634 4.052 3.957 4.155 . 0 0 "[ . 1 . 2]" 1 919 1 51 PHE HB2 1 58 THR MG 3.285 . 4.634 4.737 4.694 4.800 0.166 17 0 "[ . 1 . 2]" 1 920 1 41 LEU MD1 1 64 ASP HB3 3.086 . 4.276 2.760 2.266 3.008 . 0 0 "[ . 1 . 2]" 1 921 1 41 LEU MD2 1 64 ASP HB3 3.086 . 4.276 2.869 2.715 2.965 . 0 0 "[ . 1 . 2]" 1 922 1 61 VAL MG1 1 64 ASP HB3 3.086 . 4.276 3.917 3.689 4.280 0.004 8 0 "[ . 1 . 2]" 1 923 1 41 LEU MD2 1 64 ASP HB2 3.086 . 4.276 4.214 3.946 4.308 0.032 15 0 "[ . 1 . 2]" 1 924 1 41 LEU MD1 1 64 ASP HB2 3.086 . 4.276 4.114 3.798 4.288 0.012 15 0 "[ . 1 . 2]" 1 925 1 45 VAL HA 1 50 PHE HB3 3.086 . 4.276 2.999 2.906 3.096 . 0 0 "[ . 1 . 2]" 1 926 1 30 LEU MD1 1 33 ASP HB2 3.086 . 4.276 3.322 3.116 3.630 . 0 0 "[ . 1 . 2]" 1 927 1 30 LEU MD1 1 33 ASP HB3 3.086 . 4.276 2.594 2.450 2.906 . 0 0 "[ . 1 . 2]" 1 928 1 33 ASP HB3 1 34 LEU QD 3.086 . 4.276 3.150 3.076 3.275 . 0 0 "[ . 1 . 2]" 1 929 1 33 ASP HB2 1 34 LEU HG 3.086 . 4.276 4.118 3.997 4.193 . 0 0 "[ . 1 . 2]" 1 930 1 33 ASP HB3 1 37 LYS QB 3.086 . 4.276 4.433 4.313 4.487 0.211 18 0 "[ . 1 . 2]" 1 931 1 27 LEU QB 1 27 LEU QD 3.086 . 4.276 1.941 1.927 1.959 . 0 0 "[ . 1 . 2]" 1 932 1 27 LEU QB 1 27 LEU HG 3.086 . 4.276 2.342 2.226 2.374 . 0 0 "[ . 1 . 2]" 1 933 1 62 LEU HB3 1 62 LEU MD2 3.086 . 4.276 2.356 2.317 2.404 . 0 0 "[ . 1 . 2]" 1 934 1 62 LEU HB3 1 62 LEU MD1 3.086 . 4.276 2.395 2.354 2.443 . 0 0 "[ . 1 . 2]" 1 935 1 62 LEU HB2 1 62 LEU MD1 3.086 . 4.276 2.310 2.274 2.352 . 0 0 "[ . 1 . 2]" 1 936 1 27 LEU QB 1 31 LEU QD 3.086 . 4.276 3.324 3.212 3.727 . 0 0 "[ . 1 . 2]" 1 937 1 27 LEU QD 1 30 LEU HB2 3.285 . 4.634 4.256 3.840 4.417 . 0 0 "[ . 1 . 2]" 1 938 1 16 LEU QD 1 20 LEU HB3 3.086 . 4.276 2.316 1.882 2.566 0.014 1 0 "[ . 1 . 2]" 1 939 1 24 LEU HB2 1 24 LEU QD 3.086 . 4.276 2.217 2.121 2.260 . 0 0 "[ . 1 . 2]" 1 940 1 20 LEU HB2 1 20 LEU QD 3.086 . 4.276 2.166 2.070 2.389 . 0 0 "[ . 1 . 2]" 1 941 1 16 LEU QD 1 20 LEU HB2 3.086 . 4.276 2.194 1.792 3.132 0.104 4 0 "[ . 1 . 2]" 1 942 1 24 LEU QD 1 86 LYS QE 3.086 . 4.276 2.466 1.879 3.554 0.017 15 0 "[ . 1 . 2]" 1 943 1 19 LYS QE 1 20 LEU QD 3.086 . 4.276 3.813 2.486 4.368 0.092 18 0 "[ . 1 . 2]" 1 944 1 86 LYS QE 1 86 LYS QG 3.086 . 4.276 2.500 2.276 2.852 . 0 0 "[ . 1 . 2]" 1 945 1 37 LYS QB 1 37 LYS QE 3.086 . 4.276 3.524 3.481 3.591 . 0 0 "[ . 1 . 2]" 1 946 1 37 LYS QE 1 37 LYS HG3 3.086 . 4.276 2.471 2.326 2.974 . 0 0 "[ . 1 . 2]" 1 947 1 24 LEU HB3 1 24 LEU QD 3.086 . 4.276 2.122 2.109 2.175 . 0 0 "[ . 1 . 2]" 1 948 1 34 LEU HB3 1 72 LEU HB3 3.086 . 4.276 4.021 3.725 4.273 . 0 0 "[ . 1 . 2]" 1 949 1 41 LEU HB2 1 41 LEU MD1 3.086 . 4.276 2.258 2.228 2.301 . 0 0 "[ . 1 . 2]" 1 950 1 60 LYS QD 1 60 LYS QE 3.086 . 4.276 2.028 1.987 2.093 . 0 0 "[ . 1 . 2]" 1 951 1 22 ARG QD 1 22 ARG QG 3.086 . 4.276 2.079 2.036 2.093 . 0 0 "[ . 1 . 2]" 1 952 1 22 ARG QB 1 22 ARG QD 3.086 . 4.276 2.294 2.124 2.436 . 0 0 "[ . 1 . 2]" 1 953 1 21 GLN HB2 1 22 ARG QD 3.086 . 4.276 3.476 2.274 4.098 . 0 0 "[ . 1 . 2]" 1 954 1 34 LEU HB3 1 34 LEU QD 3.086 . 4.276 2.110 2.100 2.120 . 0 0 "[ . 1 . 2]" 1 955 1 82 LEU HB2 1 82 LEU MD1 3.086 . 4.276 2.371 2.292 2.423 . 0 0 "[ . 1 . 2]" 1 956 1 24 LEU QD 1 82 LEU HB2 3.086 . 4.276 2.578 1.848 2.850 0.048 19 0 "[ . 1 . 2]" 1 957 1 16 LEU QB 1 85 LEU MD2 3.086 . 4.276 3.755 1.849 4.439 0.163 1 0 "[ . 1 . 2]" 1 958 1 16 LEU QB 1 21 GLN HG2 3.086 . 4.276 3.695 2.553 4.322 0.046 2 0 "[ . 1 . 2]" 1 959 1 11 ARG QD 1 11 ARG QG 3.086 . 4.276 2.058 1.979 2.091 . 0 0 "[ . 1 . 2]" 1 960 1 11 ARG HB2 1 11 ARG QD 3.086 . 4.276 2.738 2.298 3.489 . 0 0 "[ . 1 . 2]" 1 961 1 78 ARG QD 1 78 ARG HG2 3.086 . 4.276 2.355 2.248 2.450 . 0 0 "[ . 1 . 2]" 1 962 1 78 ARG QD 1 78 ARG HG3 3.086 . 4.276 2.212 2.165 2.444 . 0 0 "[ . 1 . 2]" 1 963 1 42 GLN HA 1 65 MET ME 3.086 . 4.276 4.198 3.387 4.331 0.055 8 0 "[ . 1 . 2]" 1 964 1 60 LYS QE 1 60 LYS HG3 3.086 . 4.276 2.526 2.266 2.997 . 0 0 "[ . 1 . 2]" 1 965 1 70 GLN QB 1 70 GLN HG2 3.086 . 4.276 2.303 2.145 2.374 . 0 0 "[ . 1 . 2]" 1 966 1 54 PRO HD2 1 57 GLN QB 3.086 . 4.276 3.039 2.749 3.652 . 0 0 "[ . 1 . 2]" 1 967 1 60 LYS HB2 1 60 LYS QD 3.086 . 4.276 3.112 2.149 3.271 . 0 0 "[ . 1 . 2]" 1 968 1 19 LYS QD 1 19 LYS QE 3.086 . 4.276 2.051 1.985 2.090 . 0 0 "[ . 1 . 2]" 1 969 1 37 LYS QD 1 37 LYS QE 3.086 . 4.276 2.072 2.005 2.092 . 0 0 "[ . 1 . 2]" 1 970 1 78 ARG HB2 1 78 ARG QD 3.086 . 4.276 2.768 2.185 3.311 . 0 0 "[ . 1 . 2]" 1 971 1 73 GLU QB 1 73 GLU HG2 3.086 . 4.276 2.352 2.275 2.508 . 0 0 "[ . 1 . 2]" 1 972 1 19 LYS HA 1 19 LYS QD 3.086 . 4.276 4.321 3.662 4.511 0.235 18 0 "[ . 1 . 2]" 1 973 1 80 GLU HA 1 83 GLU HB2 3.086 . 4.276 2.530 2.043 2.736 . 0 0 "[ . 1 . 2]" 1 974 1 11 ARG HB3 1 11 ARG QD 3.086 . 4.276 2.712 2.308 3.460 . 0 0 "[ . 1 . 2]" 1 975 1 19 LYS HB3 1 19 LYS QE 3.086 . 4.276 2.764 1.854 4.512 0.236 3 0 "[ . 1 . 2]" 1 976 1 57 GLN QB 1 57 GLN HG3 3.086 . 4.276 2.249 2.125 2.485 . 0 0 "[ . 1 . 2]" 1 977 1 54 PRO HB2 1 57 GLN HG3 3.086 . 4.276 3.568 2.806 4.612 0.336 15 0 "[ . 1 . 2]" 1 978 1 54 PRO HD2 1 57 GLN HG2 3.086 . 4.276 2.408 1.434 3.120 0.462 10 0 "[ . 1 . 2]" 1 979 1 21 GLN HA 1 21 GLN HG2 3.086 . 4.276 2.457 2.370 2.549 . 0 0 "[ . 1 . 2]" 1 980 1 21 GLN HA 1 21 GLN HG3 3.086 . 4.276 2.995 2.729 3.577 . 0 0 "[ . 1 . 2]" 1 981 1 54 PRO HD3 1 57 GLN HG3 3.086 . 4.276 3.893 3.298 4.678 0.402 7 0 "[ . 1 . 2]" 1 982 1 26 GLN HB3 1 26 GLN QG 3.086 . 4.276 2.337 2.140 2.433 . 0 0 "[ . 1 . 2]" 1 983 1 26 GLN HB2 1 26 GLN QG 3.086 . 4.276 2.303 2.158 2.471 . 0 0 "[ . 1 . 2]" 1 984 1 53 GLN QG 1 54 PRO HD2 3.086 . 4.276 3.522 3.048 4.053 . 0 0 "[ . 1 . 2]" 1 985 1 55 HIS HB3 1 59 GLN QG 3.086 . 4.276 4.304 3.841 4.417 0.141 3 0 "[ . 1 . 2]" 1 986 1 55 HIS HB2 1 59 GLN QG 3.086 . 4.276 4.312 4.026 4.532 0.256 9 0 "[ . 1 . 2]" 1 987 1 42 GLN HA 1 42 GLN HG3 3.086 . 4.276 3.641 3.587 3.701 . 0 0 "[ . 1 . 2]" 1 988 1 83 GLU HA 1 83 GLU HG3 3.086 . 4.276 3.661 3.600 3.706 . 0 0 "[ . 1 . 2]" 1 989 1 83 GLU HA 1 83 GLU HG2 3.086 . 4.276 2.786 2.628 2.909 . 0 0 "[ . 1 . 2]" 1 990 1 80 GLU HA 1 83 GLU HG2 3.285 . 4.634 4.068 3.568 4.653 0.019 19 0 "[ . 1 . 2]" 1 991 1 80 GLU HA 1 83 GLU HG3 3.086 . 4.276 3.890 3.239 4.329 0.053 20 0 "[ . 1 . 2]" 1 992 1 55 HIS HB3 1 56 GLU QG 3.086 . 4.276 3.078 3.008 3.137 . 0 0 "[ . 1 . 2]" 1 993 1 76 PHE QB 1 77 GLU QG 3.086 . 4.276 3.475 3.082 3.772 . 0 0 "[ . 1 . 2]" 1 994 1 80 GLU HA 1 80 GLU HG2 3.086 . 4.276 2.468 2.339 2.539 . 0 0 "[ . 1 . 2]" 1 995 1 45 VAL HA 1 50 PHE HB2 3.086 . 4.276 3.116 2.762 3.290 . 0 0 "[ . 1 . 2]" 1 996 1 27 LEU QB 1 28 PRO HD3 3.086 . 4.276 1.941 1.839 2.186 0.057 10 0 "[ . 1 . 2]" 1 997 1 16 LEU QB 1 86 LYS HA 3.086 . 4.276 3.187 2.001 4.332 0.056 7 0 "[ . 1 . 2]" 1 998 1 19 LYS HA 1 22 ARG QD 3.086 . 5.000 3.485 2.258 4.883 . 0 0 "[ . 1 . 2]" 1 999 1 78 ARG HB3 1 78 ARG QD 3.086 . 4.276 3.331 2.176 3.539 . 0 0 "[ . 1 . 2]" 1 1000 1 47 ASP QB 1 50 PHE HB3 3.086 . 4.276 3.632 3.368 3.861 . 0 0 "[ . 1 . 2]" 1 1001 1 37 LYS HA 1 37 LYS HG3 3.086 . 4.276 2.604 2.532 2.666 . 0 0 "[ . 1 . 2]" 1 1002 1 60 LYS HA 1 60 LYS HG3 3.086 . 4.276 3.527 2.683 3.670 . 0 0 "[ . 1 . 2]" 1 1003 1 60 LYS HA 1 60 LYS HG2 3.086 . 4.276 2.552 2.366 4.215 . 0 0 "[ . 1 . 2]" 1 1004 1 15 LYS HA 1 15 LYS QG 3.086 . 4.276 2.644 2.130 3.376 . 0 0 "[ . 1 . 2]" 1 1005 1 5 LYS HA 1 5 LYS HG2 3.086 . 4.276 3.064 2.450 3.805 . 0 0 "[ . 1 . 2]" 1 1006 1 5 LYS HA 1 5 LYS HG3 3.086 . 4.276 3.248 2.575 3.830 . 0 0 "[ . 1 . 2]" 1 1007 1 78 ARG HA 1 78 ARG HG2 3.086 . 4.276 3.686 2.450 3.917 . 0 0 "[ . 1 . 2]" 1 1008 1 78 ARG HA 1 78 ARG HG3 3.086 . 4.276 3.141 2.844 3.676 . 0 0 "[ . 1 . 2]" 1 1009 1 34 LEU HA 1 34 LEU HG 3.086 . 4.276 3.085 3.037 3.111 . 0 0 "[ . 1 . 2]" 1 1010 1 16 LEU HA 1 16 LEU HG 3.086 . 4.276 3.271 2.605 3.696 . 0 0 "[ . 1 . 2]" 1 1011 1 62 LEU HA 1 62 LEU HG 3.086 . 4.276 3.036 2.982 3.098 . 0 0 "[ . 1 . 2]" 1 1012 1 38 LEU HA 1 38 LEU HG 3.086 . 4.276 3.688 3.657 3.744 . 0 0 "[ . 1 . 2]" 1 1013 1 18 TYR HA 1 21 GLN HB2 3.086 . 4.276 1.987 1.852 2.217 0.044 17 0 "[ . 1 . 2]" 1 1014 1 59 GLN HA 1 59 GLN QB 3.086 . 4.276 2.390 2.172 2.445 . 0 0 "[ . 1 . 2]" 1 1015 1 59 GLN QB 1 60 LYS HA 3.086 . 4.276 4.052 3.903 4.408 0.132 13 0 "[ . 1 . 2]" 1 1016 1 39 GLU HA 1 42 GLN HB2 3.086 . 4.276 2.774 2.426 3.073 . 0 0 "[ . 1 . 2]" 1 1017 1 57 GLN HA 1 57 GLN QB 3.086 . 4.276 2.248 2.161 2.310 . 0 0 "[ . 1 . 2]" 1 1018 1 60 LYS HA 1 60 LYS QD 3.086 . 4.276 3.432 3.154 3.993 . 0 0 "[ . 1 . 2]" 1 1019 1 57 GLN HA 1 60 LYS QD 3.086 . 4.276 4.085 3.289 4.224 . 0 0 "[ . 1 . 2]" 1 1020 1 60 LYS QD 1 61 VAL HA 3.086 . 4.276 2.939 2.549 4.227 . 0 0 "[ . 1 . 2]" 1 1021 1 5 LYS HA 1 5 LYS QD 3.086 . 4.276 3.391 1.956 4.347 0.071 18 0 "[ . 1 . 2]" 1 1022 1 70 GLN HA 1 70 GLN QB 3.086 . 4.276 2.273 2.169 2.431 . 0 0 "[ . 1 . 2]" 1 1023 1 17 SER QB 1 19 LYS QD 3.086 . 4.276 3.108 1.977 3.659 . 0 0 "[ . 1 . 2]" 1 1024 1 55 HIS HB3 1 56 GLU HA 3.086 . 4.276 4.166 4.028 4.290 0.014 11 0 "[ . 1 . 2]" 1 1025 1 65 MET HA 1 65 MET HG2 3.086 . 4.276 3.197 2.686 3.295 . 0 0 "[ . 1 . 2]" 1 1026 1 65 MET HA 1 65 MET HG3 3.086 . 4.276 2.741 2.598 3.507 . 0 0 "[ . 1 . 2]" 1 1027 1 65 MET HG3 1 66 ALA HA 3.285 . 4.634 4.751 4.719 4.893 0.259 13 0 "[ . 1 . 2]" 1 1028 1 65 MET HG2 1 66 ALA HA 3.086 . 4.276 3.317 3.214 3.498 . 0 0 "[ . 1 . 2]" 1 1029 1 57 GLN HA 1 60 LYS HB3 3.086 . 4.276 3.050 2.703 4.315 0.039 19 0 "[ . 1 . 2]" 1 1030 1 57 GLN HA 1 57 GLN HG3 3.086 . 4.276 3.818 3.628 3.937 . 0 0 "[ . 1 . 2]" 1 1031 1 57 GLN HA 1 57 GLN HG2 3.086 . 4.276 3.624 3.228 4.262 . 0 0 "[ . 1 . 2]" 1 1032 1 18 TYR HA 1 21 GLN HG2 3.086 . 4.276 3.726 3.547 4.013 . 0 0 "[ . 1 . 2]" 1 1033 1 62 LEU HA 1 65 MET HB2 3.086 . 4.276 3.471 3.220 4.006 . 0 0 "[ . 1 . 2]" 1 1034 1 44 GLN HA 1 44 GLN HG2 3.086 . 4.276 3.450 3.113 3.767 . 0 0 "[ . 1 . 2]" 1 1035 1 74 GLN HA 1 74 GLN HG3 3.086 . 4.276 3.614 2.842 3.799 . 0 0 "[ . 1 . 2]" 1 1036 1 44 GLN HA 1 44 GLN HG3 3.086 . 4.276 3.826 3.743 3.893 . 0 0 "[ . 1 . 2]" 1 1037 1 23 GLU HA 1 23 GLU HG3 3.086 . 4.276 2.796 2.467 3.042 . 0 0 "[ . 1 . 2]" 1 1038 1 23 GLU HA 1 23 GLU HG2 3.086 . 4.276 3.664 3.058 3.811 . 0 0 "[ . 1 . 2]" 1 1039 1 20 LEU HA 1 23 GLU HG2 3.086 . 4.276 3.503 3.091 4.106 . 0 0 "[ . 1 . 2]" 1 1040 1 39 GLU HA 1 39 GLU HG2 3.086 . 4.276 3.230 2.633 3.875 . 0 0 "[ . 1 . 2]" 1 1041 1 36 ALA HA 1 39 GLU HG2 3.086 . 4.276 3.496 3.086 4.321 0.045 8 0 "[ . 1 . 2]" 1 1042 1 29 GLN HA 1 32 GLU HG2 3.086 . 4.276 2.104 1.871 2.311 0.025 16 0 "[ . 1 . 2]" 1 1043 1 56 GLU HA 1 56 GLU QG 3.086 . 4.276 2.486 2.338 2.866 . 0 0 "[ . 1 . 2]" 1 1044 1 66 ALA HA 1 69 GLU HG3 3.086 . 4.276 3.025 2.215 3.326 . 0 0 "[ . 1 . 2]" 1 1045 1 77 GLU HA 1 80 GLU HG3 3.086 . 4.276 3.471 2.851 3.996 . 0 0 "[ . 1 . 2]" 1 1046 1 84 ALA HA 1 87 ASN HB2 3.086 . 4.276 3.869 2.708 4.355 0.079 9 0 "[ . 1 . 2]" 1 1047 1 33 ASP HB3 1 34 LEU HA 3.086 . 4.276 3.718 3.659 3.781 . 0 0 "[ . 1 . 2]" 1 1048 1 59 GLN HA 1 62 LEU HB2 3.086 . 4.276 2.164 1.979 2.323 . 0 0 "[ . 1 . 2]" 1 1049 1 24 LEU HA 1 27 LEU QB 3.086 . 4.276 2.449 2.253 2.591 . 0 0 "[ . 1 . 2]" 1 1050 1 21 GLN HA 1 24 LEU HB2 3.086 . 4.276 3.914 3.490 4.322 0.046 19 0 "[ . 1 . 2]" 1 1051 1 16 LEU HA 1 16 LEU QB 3.086 . 4.276 2.399 2.117 2.500 . 0 0 "[ . 1 . 2]" 1 1052 1 18 TYR HA 1 22 ARG QD 3.285 . 4.634 4.338 3.889 4.529 . 0 0 "[ . 1 . 2]" 1 1053 1 47 ASP QB 1 49 SER QB 3.086 . 4.276 3.993 2.679 4.300 0.024 13 0 "[ . 1 . 2]" 1 1054 1 47 ASP QB 1 50 PHE HA 3.086 . 4.276 4.198 3.931 4.333 0.057 13 0 "[ . 1 . 2]" 1 1055 1 30 LEU HB3 1 30 LEU MD1 3.086 . 4.276 3.180 3.160 3.190 . 0 0 "[ . 1 . 2]" 1 1056 1 30 LEU HB2 1 30 LEU MD1 3.086 . 4.276 2.270 2.227 2.306 . 0 0 "[ . 1 . 2]" 1 1057 1 30 LEU MD1 1 30 LEU HG 3.086 . 4.276 2.126 2.121 2.132 . 0 0 "[ . 1 . 2]" 1 1058 1 41 LEU HB3 1 41 LEU MD2 3.086 . 4.276 2.299 2.263 2.357 . 0 0 "[ . 1 . 2]" 1 1059 1 30 LEU MD1 1 75 ALA MB 3.086 . 4.276 4.058 3.693 4.220 . 0 0 "[ . 1 . 2]" 1 1060 1 41 LEU HB2 1 41 LEU MD2 3.086 . 4.276 3.189 3.179 3.199 . 0 0 "[ . 1 . 2]" 1 1061 1 30 LEU MD1 1 34 LEU QD 3.086 . 4.276 2.089 1.957 2.193 . 0 0 "[ . 1 . 2]" 1 1062 1 72 LEU QD 1 72 LEU HG 3.086 . 4.276 1.890 1.864 1.893 0.032 14 0 "[ . 1 . 2]" 1 1063 1 27 LEU QD 1 27 LEU HG 3.086 . 4.276 1.889 1.886 1.892 0.010 14 0 "[ . 1 . 2]" 1 1064 1 16 LEU QD 1 86 LYS QG 3.086 . 4.276 2.431 1.751 3.237 0.145 11 0 "[ . 1 . 2]" 1 1065 1 34 LEU QD 1 72 LEU QD 3.086 . 4.276 2.725 2.560 2.992 . 0 0 "[ . 1 . 2]" 1 1066 1 27 LEU QD 1 34 LEU QD 3.086 . 4.276 4.026 3.834 4.142 . 0 0 "[ . 1 . 2]" 1 1067 1 30 LEU HB2 1 30 LEU MD2 3.086 . 4.276 2.503 2.456 2.571 . 0 0 "[ . 1 . 2]" 1 1068 1 30 LEU MD2 1 30 LEU HG 3.086 . 4.276 2.127 2.124 2.130 . 0 0 "[ . 1 . 2]" 1 1069 1 30 LEU HB3 1 30 LEU MD2 3.086 . 4.276 2.239 2.174 2.269 . 0 0 "[ . 1 . 2]" 1 1070 1 35 GLU HB2 1 72 LEU QD 3.086 . 4.276 2.323 2.168 2.528 . 0 0 "[ . 1 . 2]" 1 1071 1 20 LEU HB3 1 20 LEU QD 3.086 . 4.276 2.123 2.069 2.241 . 0 0 "[ . 1 . 2]" 1 1072 1 20 LEU QD 1 23 GLU QB 3.285 . 4.634 3.567 2.720 4.126 . 0 0 "[ . 1 . 2]" 1 1073 1 20 LEU QD 1 85 LEU MD2 3.086 . 4.276 1.888 1.786 2.081 0.110 7 0 "[ . 1 . 2]" 1 1074 1 16 LEU QD 1 20 LEU QD 3.086 . 4.276 2.176 1.932 2.851 . 0 0 "[ . 1 . 2]" 1 1075 1 41 LEU HB3 1 41 LEU MD1 3.086 . 4.276 2.479 2.439 2.520 . 0 0 "[ . 1 . 2]" 1 1076 1 58 THR MG 1 62 LEU MD1 3.086 . 4.276 3.946 3.732 4.148 . 0 0 "[ . 1 . 2]" 1 1077 1 27 LEU QD 1 82 LEU MD1 3.086 . 4.276 1.917 1.857 2.201 0.039 3 0 "[ . 1 . 2]" 1 1078 1 27 LEU QD 1 78 ARG HG3 3.086 . 4.276 2.438 1.885 3.465 0.011 11 0 "[ . 1 . 2]" 1 1079 1 24 LEU QD 1 82 LEU HB3 3.086 . 4.276 1.971 1.853 2.337 0.043 5 0 "[ . 1 . 2]" 1 1080 1 82 LEU HB3 1 82 LEU MD1 3.086 . 4.276 2.350 2.279 2.442 . 0 0 "[ . 1 . 2]" 1 1081 1 24 LEU MD1 1 24 LEU MD2 3.086 . 4.276 2.067 2.052 2.077 . 0 0 "[ . 1 . 2]" 1 1082 1 72 LEU HB3 1 72 LEU QD 3.086 . 4.276 2.283 2.246 2.315 . 0 0 "[ . 1 . 2]" 1 1083 1 38 LEU HB3 1 38 LEU MD1 3.086 . 4.276 2.235 2.202 2.252 . 0 0 "[ . 1 . 2]" 1 1084 1 35 GLU QG 1 72 LEU QD 3.086 . 4.276 2.656 2.150 3.457 . 0 0 "[ . 1 . 2]" 1 1085 1 38 LEU HB2 1 38 LEU MD1 3.086 . 4.276 3.157 3.142 3.165 . 0 0 "[ . 1 . 2]" 1 1086 1 43 THR MG 1 44 GLN HB3 3.086 . 4.276 3.966 3.174 4.736 0.460 14 0 "[ . 1 . 2]" 1 1087 1 19 LYS HA 1 20 LEU QD 3.086 . 4.276 4.248 3.971 4.367 0.091 20 0 "[ . 1 . 2]" 1 1088 1 30 LEU MD1 1 71 GLU HG2 3.086 . 4.276 3.622 3.164 4.175 . 0 0 "[ . 1 . 2]" 1 1089 1 27 LEU QD 1 30 LEU HB3 3.086 . 4.276 2.806 2.458 2.953 . 0 0 "[ . 1 . 2]" 1 1090 1 27 LEU QD 1 79 TRP HB2 3.086 . 4.276 1.766 1.726 1.932 0.170 9 0 "[ . 1 . 2]" 1 1091 1 37 LYS QE 1 37 LYS HG2 3.086 . 4.276 2.366 2.209 2.936 . 0 0 "[ . 1 . 2]" 1 1092 1 37 LYS QE 1 41 LEU MD1 3.086 . 4.276 2.244 1.899 3.370 . 0 0 "[ . 1 . 2]" 1 1093 1 62 LEU HA 1 65 MET ME 3.086 . 4.276 2.056 1.929 2.245 . 0 0 "[ . 1 . 2]" 1 1094 1 34 LEU HA 1 34 LEU QD 3.086 . 4.276 2.051 2.008 2.093 . 0 0 "[ . 1 . 2]" 1 1095 1 41 LEU MD2 1 65 MET HA 3.086 . 4.276 3.818 3.462 4.029 . 0 0 "[ . 1 . 2]" 1 1096 1 24 LEU QD 1 28 PRO HD3 3.086 . 4.276 2.864 2.210 3.748 . 0 0 "[ . 1 . 2]" 1 1097 1 16 LEU QD 1 21 GLN HA 3.086 . 4.276 2.503 2.042 3.018 . 0 0 "[ . 1 . 2]" 1 1098 1 27 LEU QD 1 79 TRP HB3 3.086 . 4.276 2.981 2.903 3.160 . 0 0 "[ . 1 . 2]" 1 1099 1 30 LEU HA 1 30 LEU MD2 3.086 . 4.276 3.961 3.934 4.018 . 0 0 "[ . 1 . 2]" 1 1100 1 82 LEU HA 1 82 LEU MD1 3.086 . 4.276 3.818 3.759 3.891 . 0 0 "[ . 1 . 2]" 1 1101 1 23 GLU HA 1 82 LEU MD1 3.285 . 4.634 4.381 4.184 4.634 . 0 0 "[ . 1 . 2]" 1 1102 1 17 SER QB 1 20 LEU QD 3.086 . 4.276 2.272 1.442 3.649 0.494 3 0 "[ . 1 . 2]" 1 1103 1 20 LEU HA 1 20 LEU QD 3.086 . 4.276 2.695 2.014 3.078 . 0 0 "[ . 1 . 2]" 1 1104 1 27 LEU QD 1 28 PRO HD3 3.086 . 4.276 3.403 3.138 3.597 . 0 0 "[ . 1 . 2]" 1 1105 1 27 LEU QD 1 75 ALA HA 3.086 . 4.276 2.933 2.841 3.070 . 0 0 "[ . 1 . 2]" 1 1106 1 20 LEU QD 1 82 LEU HA 3.086 . 4.276 3.115 2.286 3.796 . 0 0 "[ . 1 . 2]" 1 1107 1 78 ARG QD 1 82 LEU MD1 3.086 . 4.276 3.033 2.289 3.539 . 0 0 "[ . 1 . 2]" 1 1108 1 27 LEU QD 1 78 ARG QD 3.086 . 4.276 3.637 1.970 3.905 . 0 0 "[ . 1 . 2]" 1 1109 1 16 LEU QD 1 20 LEU HG 3.086 . 4.276 3.896 3.688 4.284 0.008 16 0 "[ . 1 . 2]" 1 1110 1 24 LEU HA 1 24 LEU QD 3.086 . 4.276 2.551 2.180 2.809 . 0 0 "[ . 1 . 2]" 1 1111 1 24 LEU HA 1 82 LEU MD1 3.086 . 4.276 2.624 2.295 2.859 . 0 0 "[ . 1 . 2]" 1 1112 1 27 LEU HA 1 30 LEU HB2 3.086 . 4.276 3.274 3.129 3.440 . 0 0 "[ . 1 . 2]" 1 1113 1 27 LEU HA 1 27 LEU QB 3.086 . 4.276 2.463 2.255 2.497 . 0 0 "[ . 1 . 2]" 1 1114 1 27 LEU HA 1 30 LEU HG 3.086 . 4.276 4.422 4.353 4.489 0.213 18 0 "[ . 1 . 2]" 1 1115 1 31 LEU HB3 1 72 LEU QD 3.086 . 4.276 3.054 2.865 3.238 . 0 0 "[ . 1 . 2]" 1 1116 1 34 LEU HB2 1 34 LEU QD 3.086 . 4.276 2.238 2.208 2.270 . 0 0 "[ . 1 . 2]" 1 1117 1 30 LEU HG 1 34 LEU HG 3.086 . 4.276 2.681 2.469 2.926 . 0 0 "[ . 1 . 2]" 1 1118 1 30 LEU MD1 1 34 LEU HG 3.086 . 4.276 2.449 2.349 2.566 . 0 0 "[ . 1 . 2]" 1 1119 1 38 LEU HA 1 41 LEU MD1 3.086 . 4.276 2.683 2.517 2.995 . 0 0 "[ . 1 . 2]" 1 1120 1 38 LEU MD2 1 38 LEU HG 3.086 . 4.276 2.124 2.119 2.129 . 0 0 "[ . 1 . 2]" 1 1121 1 38 LEU HB2 1 38 LEU MD2 3.086 . 4.276 2.565 2.545 2.599 . 0 0 "[ . 1 . 2]" 1 1122 1 38 LEU MD2 1 41 LEU MD1 3.086 . 4.276 3.337 3.194 3.554 . 0 0 "[ . 1 . 2]" 1 1123 1 41 LEU HB3 1 65 MET HA 3.086 . 4.276 3.034 2.576 3.299 . 0 0 "[ . 1 . 2]" 1 1124 1 59 GLN HA 1 62 LEU HB3 3.086 . 4.276 3.806 3.611 4.012 . 0 0 "[ . 1 . 2]" 1 1125 1 69 GLU HA 1 72 LEU HB2 3.086 . 4.276 3.173 2.844 3.591 . 0 0 "[ . 1 . 2]" 1 1126 1 82 LEU HA 1 85 LEU HB2 3.086 . 4.276 3.191 2.915 3.538 . 0 0 "[ . 1 . 2]" 1 1127 1 85 LEU HB3 1 85 LEU MD2 3.086 . 4.276 2.219 2.174 2.262 . 0 0 "[ . 1 . 2]" 1 1128 1 16 LEU QD 1 85 LEU HB3 3.086 . 4.276 2.603 1.999 2.983 . 0 0 "[ . 1 . 2]" 1 1129 1 16 LEU QD 1 85 LEU HB2 3.086 . 4.276 3.993 3.396 4.340 0.064 16 0 "[ . 1 . 2]" 1 1130 1 82 LEU MD2 1 85 LEU HB2 3.086 . 4.276 3.944 3.638 4.229 . 0 0 "[ . 1 . 2]" 1 1131 1 20 LEU QD 1 85 LEU MD1 3.086 . 4.276 3.875 3.675 4.103 . 0 0 "[ . 1 . 2]" 1 1132 1 45 VAL MG2 1 50 PHE HB3 3.285 . 4.634 4.635 4.486 4.700 0.066 11 0 "[ . 1 . 2]" 1 1133 1 58 THR MG 1 61 VAL HB 3.285 . 4.634 4.530 4.271 4.639 0.005 19 0 "[ . 1 . 2]" 1 1134 1 76 PHE HA 1 79 TRP HB2 3.086 . 4.276 3.322 3.067 3.517 . 0 0 "[ . 1 . 2]" 1 1135 1 27 LEU QD 1 78 ARG HB3 3.086 . 4.276 2.304 2.051 2.847 . 0 0 "[ . 1 . 2]" 1 1136 1 27 LEU QD 1 78 ARG HG2 3.086 . 4.276 2.803 2.317 4.188 . 0 0 "[ . 1 . 2]" 1 1137 1 75 ALA HA 1 78 ARG HG2 3.086 . 4.276 3.920 3.526 4.660 0.384 15 0 "[ . 1 . 2]" 1 1138 1 55 HIS HB2 1 56 GLU QG 3.285 . 4.634 4.680 4.621 4.756 0.122 6 0 "[ . 1 . 2]" 1 1139 1 76 PHE QB 1 79 TRP HB3 3.285 . 4.634 4.397 4.340 4.464 . 0 0 "[ . 1 . 2]" 1 1140 1 28 PRO HA 1 31 LEU HB3 3.086 . 4.276 4.054 3.765 4.274 . 0 0 "[ . 1 . 2]" 1 1141 1 28 PRO HB2 1 31 LEU QD 3.285 . 4.634 4.553 4.450 4.628 . 0 0 "[ . 1 . 2]" 1 1142 1 28 PRO HB2 1 29 GLN HA 3.086 . 4.276 3.984 3.938 4.030 . 0 0 "[ . 1 . 2]" 1 1143 1 25 GLU HA 1 28 PRO HD2 3.086 . 4.276 3.766 3.403 4.130 . 0 0 "[ . 1 . 2]" 1 1144 1 53 GLN QG 1 54 PRO HD3 3.086 . 4.276 3.742 3.066 4.128 . 0 0 "[ . 1 . 2]" 1 1145 1 37 LYS QE 1 68 ALA HA 3.086 . 4.276 3.716 3.138 4.311 0.035 1 0 "[ . 1 . 2]" 1 1146 1 75 ALA MB 1 79 TRP HB2 3.285 . 4.634 4.400 4.261 4.537 . 0 0 "[ . 1 . 2]" 1 1147 1 80 GLU HB3 1 84 ALA MB 3.086 . 4.276 4.219 4.051 4.334 0.058 2 0 "[ . 1 . 2]" 1 1148 1 86 LYS HB3 1 86 LYS QG 3.086 . 4.276 2.426 2.252 2.518 . 0 0 "[ . 1 . 2]" 1 1149 1 16 LEU QB 1 86 LYS QG 3.086 . 4.276 3.408 2.554 4.342 0.066 16 0 "[ . 1 . 2]" 1 1150 1 37 LYS HA 1 41 LEU MD1 3.086 . 4.276 4.237 4.086 4.305 0.029 17 0 "[ . 1 . 2]" 1 1151 1 37 LYS HG3 1 41 LEU MD2 3.086 . 4.276 4.161 3.872 4.295 0.019 15 0 "[ . 1 . 2]" 1 1152 1 34 LEU QD 1 37 LYS HG3 3.285 . 4.634 4.641 4.595 4.694 0.060 20 0 "[ . 1 . 2]" 1 1153 1 37 LYS HG3 1 41 LEU MD1 3.086 . 4.276 3.139 2.927 3.322 . 0 0 "[ . 1 . 2]" 1 1154 1 60 LYS HB2 1 60 LYS QE 3.086 . 4.276 4.294 3.822 4.470 0.194 4 0 "[ . 1 . 2]" 1 1155 1 60 LYS HB3 1 60 LYS QE 3.086 . 4.276 3.936 3.762 4.138 . 0 0 "[ . 1 . 2]" 1 1156 1 60 LYS HB3 1 60 LYS QD 3.086 . 4.276 2.239 2.127 3.218 . 0 0 "[ . 1 . 2]" 1 1157 1 60 LYS QD 1 61 VAL MG2 3.086 . 4.276 2.603 2.158 2.946 . 0 0 "[ . 1 . 2]" 1 1158 1 60 LYS QE 1 60 LYS HG2 3.086 . 4.276 2.666 2.282 3.143 . 0 0 "[ . 1 . 2]" 1 1159 1 83 GLU HA 1 86 LYS QE 3.086 . 4.276 2.643 1.873 3.614 0.023 18 0 "[ . 1 . 2]" 1 1160 1 80 GLU HA 1 83 GLU HB3 3.086 . 4.276 4.107 3.607 4.286 0.010 13 0 "[ . 1 . 2]" 1 1161 1 65 MET HB3 1 65 MET ME 3.086 . 4.276 2.052 1.958 2.113 . 0 0 "[ . 1 . 2]" 1 1162 1 65 MET HB2 1 65 MET ME 3.086 . 4.276 3.026 2.923 3.159 . 0 0 "[ . 1 . 2]" 1 1163 1 38 LEU MD2 1 69 GLU HG2 3.086 . 4.276 3.074 2.714 3.304 . 0 0 "[ . 1 . 2]" 1 1164 1 38 LEU MD2 1 69 GLU HB3 3.086 . 4.276 2.460 2.267 2.891 . 0 0 "[ . 1 . 2]" 1 1165 1 51 PHE QD 1 58 THR MG 2.164 . 4.550 3.645 3.326 3.955 . 0 0 "[ . 1 . 2]" 1 1166 1 45 VAL MG1 1 50 PHE QD 2.263 . 2.903 2.826 2.599 2.936 0.033 2 0 "[ . 1 . 2]" 1 1167 1 45 VAL MG1 1 50 PHE QE 2.298 . 2.958 2.776 2.597 2.961 0.003 2 0 "[ . 1 . 2]" 1 1168 1 45 VAL MG1 1 50 PHE HZ 3.877 . 5.756 4.300 4.021 4.472 . 0 0 "[ . 1 . 2]" 1 1169 1 45 VAL MG2 1 50 PHE QD 3.877 . 5.756 3.450 3.352 3.514 . 0 0 "[ . 1 . 2]" 1 1170 1 45 VAL MG2 1 50 PHE QE 2.248 . 2.880 2.810 2.664 2.899 0.019 16 0 "[ . 1 . 2]" 1 1171 1 45 VAL MG2 1 50 PHE HZ 2.429 . 3.167 3.000 2.818 3.178 0.011 4 0 "[ . 1 . 2]" 1 1172 1 81 TYR QE 1 85 LEU MD2 2.203 . 2.809 2.868 2.784 2.924 0.115 17 0 "[ . 1 . 2]" 1 1173 1 81 TYR QD 1 85 LEU MD2 3.877 . 5.756 4.121 3.918 4.261 . 0 0 "[ . 1 . 2]" 1 1174 1 81 TYR QD 1 85 LEU MD1 2.479 . 3.247 3.319 3.265 3.367 0.120 10 0 "[ . 1 . 2]" 1 1175 1 50 PHE QE 1 61 VAL MG2 2.010 . 2.515 1.901 1.712 1.969 . 0 0 "[ . 1 . 2]" 1 1176 1 50 PHE HZ 1 61 VAL MG2 2.287 . 4.550 3.212 3.126 3.296 . 0 0 "[ . 1 . 2]" 1 1177 1 50 PHE QE 1 61 VAL MG1 2.086 . 2.630 2.545 2.294 2.665 0.035 3 0 "[ . 1 . 2]" 1 1178 1 81 TYR QD 1 82 LEU MD2 2.176 . 2.768 2.589 2.330 2.817 0.049 2 0 "[ . 1 . 2]" 1 1179 1 81 TYR QD 1 84 ALA MB 3.877 . 5.756 3.715 3.421 3.966 . 0 0 "[ . 1 . 2]" 1 1180 1 50 PHE QE 1 62 LEU MD2 2.242 . 2.870 1.785 1.610 1.906 0.004 8 0 "[ . 1 . 2]" 1 1181 1 51 PHE HZ 1 62 LEU MD2 2.966 . 4.065 2.765 2.447 3.020 . 0 0 "[ . 1 . 2]" 1 1182 1 50 PHE QD 1 62 LEU MD2 2.601 . 3.447 3.467 3.424 3.501 0.054 13 0 "[ . 1 . 2]" 1 1183 1 72 LEU QD 1 76 PHE QE 2.196 . 2.799 1.921 1.815 2.055 . 0 0 "[ . 1 . 2]" 1 1184 1 51 PHE QE 1 62 LEU MD1 2.215 . 2.828 2.124 1.858 2.281 . 0 0 "[ . 1 . 2]" 1 1185 1 50 PHE QE 1 62 LEU MD1 2.323 . 2.997 2.689 2.530 2.872 . 0 0 "[ . 1 . 2]" 1 1186 1 50 PHE QD 1 62 LEU MD1 3.877 . 5.756 4.358 4.187 4.582 . 0 0 "[ . 1 . 2]" 1 1187 1 50 PHE HZ 1 62 LEU MD1 2.472 . 4.550 3.743 3.622 3.856 . 0 0 "[ . 1 . 2]" 1 1188 1 18 TYR QD 1 22 ARG QG 2.851 . 4.550 4.396 3.950 4.636 0.086 18 0 "[ . 1 . 2]" 1 1189 1 55 HIS HE1 1 59 GLN QG 2.922 . 3.989 3.125 2.760 3.906 . 0 0 "[ . 1 . 2]" 1 1190 1 79 TRP HE3 1 80 GLU HG3 2.529 . 3.328 2.388 1.991 3.333 0.005 16 0 "[ . 1 . 2]" 1 1191 1 79 TRP HZ3 1 80 GLU HG2 3.069 . 4.247 2.558 2.358 2.799 . 0 0 "[ . 1 . 2]" 1 1192 1 78 ARG HA 1 81 TYR QD 2.973 . 4.078 2.815 2.483 3.150 . 0 0 "[ . 1 . 2]" 1 1193 1 81 TYR HA 1 81 TYR QD 2.567 . 3.391 2.753 2.664 2.843 . 0 0 "[ . 1 . 2]" 1 1194 1 18 TYR HA 1 18 TYR QE 2.826 . 4.550 4.564 4.501 4.607 0.057 18 0 "[ . 1 . 2]" 1 1195 1 55 HIS HB2 1 55 HIS HD2 3.877 . 5.756 3.897 3.796 3.959 . 0 0 "[ . 1 . 2]" 1 1196 1 18 TYR QE 1 22 ARG QD 2.446 . 3.194 2.968 2.687 3.139 . 0 0 "[ . 1 . 2]" 1 1197 1 18 TYR QD 1 22 ARG QD 2.970 . 4.073 3.113 2.486 3.669 . 0 0 "[ . 1 . 2]" 1 1198 1 54 PRO HA 1 57 GLN H 3.097 . 4.296 3.872 3.781 4.082 . 0 0 "[ . 1 . 2]" 1 1199 1 53 GLN HB3 1 57 GLN H 2.716 . 4.550 4.269 4.035 4.587 0.037 13 0 "[ . 1 . 2]" 1 1200 1 53 GLN H 1 54 PRO HD3 3.590 . 5.201 4.545 4.434 4.825 . 0 0 "[ . 1 . 2]" 1 1201 1 51 PHE HB3 1 53 GLN H 3.019 . 4.550 4.493 4.304 4.646 0.096 16 0 "[ . 1 . 2]" 1 1202 1 53 GLN H 1 54 PRO HG3 3.840 . 5.683 5.244 4.706 6.116 0.433 7 0 "[ . 1 . 2]" 1 1203 1 49 SER HA 1 52 SER H 2.340 . 3.025 2.739 2.636 2.838 . 0 0 "[ . 1 . 2]" 1 1204 1 50 PHE HB3 1 52 SER H 3.067 . 4.243 3.915 3.828 3.996 . 0 0 "[ . 1 . 2]" 1 1205 1 47 ASP QB 1 52 SER H 3.812 . 5.628 5.131 5.018 5.300 . 0 0 "[ . 1 . 2]" 1 1206 1 49 SER HA 1 51 PHE H 3.030 . 4.177 4.059 3.888 4.257 0.080 13 0 "[ . 1 . 2]" 1 1207 1 49 SER QB 1 51 PHE H 3.134 . 4.362 4.256 4.081 4.429 0.067 5 0 "[ . 1 . 2]" 1 1208 1 47 ASP QB 1 50 PHE H 2.246 . 2.876 2.530 2.401 2.614 . 0 0 "[ . 1 . 2]" 1 1209 1 47 ASP H 1 48 ALA H 3.104 . 4.308 4.298 4.244 4.340 0.032 20 0 "[ . 1 . 2]" 1 1210 1 47 ASP H 1 50 PHE H 2.992 . 4.111 3.860 3.604 3.948 . 0 0 "[ . 1 . 2]" 1 1211 1 44 GLN H 1 47 ASP H 3.014 . 4.149 3.921 3.790 4.157 0.008 1 0 "[ . 1 . 2]" 1 1212 1 46 ALA HA 1 47 ASP H 2.529 . 3.329 2.678 2.654 2.728 . 0 0 "[ . 1 . 2]" 1 1213 1 44 GLN HA 1 47 ASP H 2.849 . 3.864 3.160 3.036 3.279 . 0 0 "[ . 1 . 2]" 1 1214 1 59 GLN QB 1 60 LYS H 2.141 . 2.714 2.304 2.189 2.720 0.006 19 0 "[ . 1 . 2]" 1 1215 1 60 LYS H 1 60 LYS HG3 2.858 . 3.879 4.001 2.162 4.143 0.264 8 0 "[ . 1 . 2]" 1 1216 1 47 ASP H 1 48 ALA MB 3.041 . 4.550 4.502 4.391 4.579 0.029 8 0 "[ . 1 . 2]" 1 1217 1 45 VAL QG 1 47 ASP H 3.282 . 4.628 4.446 4.310 4.637 0.009 4 0 "[ . 1 . 2]" 1 1218 1 46 ALA H 1 47 ASP QB 3.062 . 4.234 4.079 3.958 4.161 . 0 0 "[ . 1 . 2]" 1 1219 1 45 VAL QG 1 46 ALA H 2.600 . 3.445 3.443 3.376 3.495 0.050 4 0 "[ . 1 . 2]" 1 1220 1 41 LEU HB3 1 45 VAL H 3.842 . 5.687 4.142 4.059 4.308 . 0 0 "[ . 1 . 2]" 1 1221 1 42 GLN HA 1 44 GLN H 2.768 . 3.726 3.340 3.267 3.467 . 0 0 "[ . 1 . 2]" 1 1222 1 38 LEU MD2 1 44 GLN H 3.826 . 5.656 4.910 4.637 5.099 . 0 0 "[ . 1 . 2]" 1 1223 1 42 GLN HA 1 43 THR H 2.377 . 3.083 2.750 2.736 2.765 . 0 0 "[ . 1 . 2]" 1 1224 1 40 ALA HA 1 43 THR H 2.688 . 3.591 3.490 3.287 3.598 0.007 2 0 "[ . 1 . 2]" 1 1225 1 42 GLN HG3 1 43 THR H 3.590 . 5.201 5.012 4.819 5.120 . 0 0 "[ . 1 . 2]" 1 1226 1 42 GLN HB3 1 43 THR H 2.712 . 3.631 3.287 3.050 3.391 . 0 0 "[ . 1 . 2]" 1 1227 1 42 GLN H 1 44 GLN H 3.302 . 4.665 3.927 3.844 4.056 . 0 0 "[ . 1 . 2]" 1 1228 1 39 GLU HA 1 42 GLN H 2.634 . 3.501 3.212 3.116 3.331 . 0 0 "[ . 1 . 2]" 1 1229 1 42 GLN H 1 42 GLN HG3 2.666 . 3.554 3.414 3.094 3.563 0.009 12 0 "[ . 1 . 2]" 1 1230 1 38 LEU HG 1 42 GLN H 3.206 . 4.490 4.397 4.205 4.497 0.007 1 0 "[ . 1 . 2]" 1 1231 1 41 LEU HB3 1 42 GLN H 3.122 . 4.340 3.465 3.415 3.558 . 0 0 "[ . 1 . 2]" 1 1232 1 41 LEU H 1 44 GLN H 3.511 . 5.052 4.723 4.468 4.894 . 0 0 "[ . 1 . 2]" 1 1233 1 38 LEU HA 1 41 LEU H 2.508 . 3.294 2.719 2.678 2.750 . 0 0 "[ . 1 . 2]" 1 1234 1 41 LEU H 1 42 GLN HG3 3.480 . 4.994 4.858 4.630 5.064 0.070 13 0 "[ . 1 . 2]" 1 1235 1 41 LEU H 1 42 GLN HB3 3.401 . 4.847 4.474 4.238 4.656 . 0 0 "[ . 1 . 2]" 1 1236 1 41 LEU H 1 41 LEU HB3 2.919 . 3.984 3.435 3.380 3.539 . 0 0 "[ . 1 . 2]" 1 1237 1 38 LEU MD2 1 41 LEU H 2.794 . 3.770 3.344 3.179 3.421 . 0 0 "[ . 1 . 2]" 1 1238 1 37 LYS HA 1 40 ALA H 2.551 . 3.364 3.106 3.045 3.205 . 0 0 "[ . 1 . 2]" 1 1239 1 38 LEU MD2 1 40 ALA H 3.273 . 4.612 4.708 4.655 4.818 0.206 5 0 "[ . 1 . 2]" 1 1240 1 38 LEU HA 1 39 GLU H 2.310 . 2.977 2.678 2.661 2.690 . 0 0 "[ . 1 . 2]" 1 1241 1 38 LEU HG 1 39 GLU H 2.645 . 4.550 3.931 3.897 3.986 . 0 0 "[ . 1 . 2]" 1 1242 1 38 LEU HB2 1 39 GLU H 2.754 . 3.702 3.627 3.594 3.681 . 0 0 "[ . 1 . 2]" 1 1243 1 37 LYS HA 1 38 LEU H 2.521 . 3.315 2.701 2.691 2.710 . 0 0 "[ . 1 . 2]" 1 1244 1 37 LYS QB 1 38 LEU H 2.324 . 2.999 2.158 2.066 2.221 . 0 0 "[ . 1 . 2]" 1 1245 1 38 LEU H 1 38 LEU MD1 2.784 . 3.753 3.704 3.636 3.833 0.080 14 0 "[ . 1 . 2]" 1 1246 1 37 LYS H 1 39 GLU H 3.282 . 4.628 3.709 3.594 3.797 . 0 0 "[ . 1 . 2]" 1 1247 1 34 LEU HA 1 37 LYS H 2.300 . 2.961 2.661 2.636 2.680 . 0 0 "[ . 1 . 2]" 1 1248 1 35 GLU HA 1 37 LYS H 3.155 . 4.399 3.787 3.706 3.862 . 0 0 "[ . 1 . 2]" 1 1249 1 33 ASP H 1 36 ALA H 3.051 . 4.215 3.768 3.710 3.828 . 0 0 "[ . 1 . 2]" 1 1250 1 36 ALA H 1 37 LYS H 2.377 . 3.083 2.301 2.250 2.346 . 0 0 "[ . 1 . 2]" 1 1251 1 32 GLU HA 1 36 ALA H 2.704 . 3.618 2.954 2.915 3.003 . 0 0 "[ . 1 . 2]" 1 1252 1 32 GLU HA 1 36 ALA H 2.828 . 3.828 3.337 3.237 3.447 . 0 0 "[ . 1 . 2]" 1 1253 1 35 GLU HB2 1 36 ALA H 2.547 . 3.358 3.162 2.992 3.291 . 0 0 "[ . 1 . 2]" 1 1254 1 36 ALA H 1 36 ALA MB 1.971 . 2.457 1.993 1.985 2.002 . 0 0 "[ . 1 . 2]" 1 1255 1 36 ALA H 1 37 LYS QB 2.794 . 3.770 3.597 3.503 3.706 . 0 0 "[ . 1 . 2]" 1 1256 1 36 ALA H 1 72 LEU QD 3.187 . 4.456 4.289 4.155 4.449 . 0 0 "[ . 1 . 2]" 1 1257 1 33 ASP H 1 35 GLU H 3.471 . 4.977 3.519 3.430 3.585 . 0 0 "[ . 1 . 2]" 1 1258 1 35 GLU H 1 35 GLU HB3 2.495 . 3.273 2.551 2.238 2.670 . 0 0 "[ . 1 . 2]" 1 1259 1 27 LEU HG 1 79 TRP H 2.958 . 4.052 3.457 3.342 3.505 . 0 0 "[ . 1 . 2]" 1 1260 1 30 LEU HG 1 35 GLU H 3.130 . 4.355 4.179 4.099 4.261 . 0 0 "[ . 1 . 2]" 1 1261 1 30 LEU HG 1 34 LEU H 3.635 . 5.286 3.846 3.757 3.940 . 0 0 "[ . 1 . 2]" 1 1262 1 34 LEU H 1 34 LEU QD 2.936 . 4.014 2.815 2.765 2.853 . 0 0 "[ . 1 . 2]" 1 1263 1 30 LEU HG 1 33 ASP H 3.097 . 4.296 4.349 4.301 4.387 0.091 13 0 "[ . 1 . 2]" 1 1264 1 30 LEU HB2 1 33 ASP H 3.349 . 4.751 4.430 4.377 4.486 . 0 0 "[ . 1 . 2]" 1 1265 1 30 LEU MD1 1 33 ASP H 3.225 . 4.525 4.062 3.919 4.184 . 0 0 "[ . 1 . 2]" 1 1266 1 29 GLN HA 1 32 GLU H 2.395 . 3.112 2.723 2.689 2.750 . 0 0 "[ . 1 . 2]" 1 1267 1 30 LEU HG 1 32 GLU H 3.257 . 4.583 4.663 4.629 4.687 0.104 16 0 "[ . 1 . 2]" 1 1268 1 30 LEU MD1 1 32 GLU H 3.539 . 5.105 4.334 4.244 4.454 . 0 0 "[ . 1 . 2]" 1 1269 1 27 LEU HA 1 31 LEU H 3.262 . 4.592 3.334 3.302 3.360 . 0 0 "[ . 1 . 2]" 1 1270 1 28 PRO HB2 1 31 LEU H 3.439 . 4.917 4.477 4.284 4.585 . 0 0 "[ . 1 . 2]" 1 1271 1 30 LEU HG 1 31 LEU H 2.764 . 3.719 3.423 3.267 3.523 . 0 0 "[ . 1 . 2]" 1 1272 1 30 LEU QD 1 31 LEU H 3.270 . 4.607 3.628 3.522 3.731 . 0 0 "[ . 1 . 2]" 1 1273 1 28 PRO HA 1 30 LEU H 3.739 . 5.487 3.987 3.824 4.206 . 0 0 "[ . 1 . 2]" 1 1274 1 29 GLN QG 1 30 LEU H 3.404 . 4.853 3.801 3.533 3.982 . 0 0 "[ . 1 . 2]" 1 1275 1 29 GLN QB 1 30 LEU H 2.880 . 3.917 2.736 2.391 2.965 . 0 0 "[ . 1 . 2]" 1 1276 1 30 LEU H 1 30 LEU QD 3.053 . 4.218 3.738 3.688 3.757 . 0 0 "[ . 1 . 2]" 1 1277 1 27 LEU HA 1 29 GLN H 3.296 . 4.654 4.210 4.074 4.335 . 0 0 "[ . 1 . 2]" 1 1278 1 28 PRO HA 1 29 GLN H 2.877 . 3.912 3.327 3.258 3.373 . 0 0 "[ . 1 . 2]" 1 1279 1 28 PRO HG2 1 29 GLN H 2.969 . 4.071 3.828 3.751 3.898 . 0 0 "[ . 1 . 2]" 1 1280 1 26 GLN HB2 1 27 LEU H 2.934 . 4.010 3.296 2.695 3.987 . 0 0 "[ . 1 . 2]" 1 1281 1 27 LEU H 1 28 PRO HG2 3.623 . 5.264 4.506 4.375 4.662 . 0 0 "[ . 1 . 2]" 1 1282 1 27 LEU H 1 27 LEU QD 2.869 . 3.898 3.701 3.603 3.755 . 0 0 "[ . 1 . 2]" 1 1283 1 25 GLU HB2 1 26 GLN H 2.408 . 3.133 2.825 2.294 3.426 0.293 9 0 "[ . 1 . 2]" 1 1284 1 25 GLU HB3 1 26 GLN H 2.351 . 3.042 2.773 2.344 3.406 0.364 2 0 "[ . 1 . 2]" 1 1285 1 26 GLN H 1 27 LEU QD 3.774 . 5.554 5.020 4.868 5.248 . 0 0 "[ . 1 . 2]" 1 1286 1 22 ARG HA 1 25 GLU H 2.539 . 3.345 2.657 2.498 2.730 . 0 0 "[ . 1 . 2]" 1 1287 1 21 GLN HA 1 25 GLU H 3.476 . 4.986 4.192 3.786 4.377 . 0 0 "[ . 1 . 2]" 1 1288 1 24 LEU QD 1 25 GLU H 3.412 . 4.867 3.754 3.256 4.021 . 0 0 "[ . 1 . 2]" 1 1289 1 23 GLU HA 1 27 LEU H 3.273 . 4.612 3.858 3.663 4.010 . 0 0 "[ . 1 . 2]" 1 1290 1 23 GLU HA 1 24 LEU H 2.776 . 3.739 2.709 2.689 2.729 . 0 0 "[ . 1 . 2]" 1 1291 1 23 GLU QB 1 24 LEU H 2.348 . 3.037 2.220 2.094 2.330 . 0 0 "[ . 1 . 2]" 1 1292 1 22 ARG HA 1 23 GLU H 2.461 . 3.218 2.702 2.668 2.723 . 0 0 "[ . 1 . 2]" 1 1293 1 19 LYS HA 1 23 GLU H 3.215 . 4.507 3.823 3.742 3.898 . 0 0 "[ . 1 . 2]" 1 1294 1 20 LEU HB3 1 23 GLU H 3.057 . 4.225 3.665 3.004 4.324 0.099 18 0 "[ . 1 . 2]" 1 1295 1 20 LEU QD 1 23 GLU H 3.012 . 4.146 4.119 3.875 4.235 0.089 17 0 "[ . 1 . 2]" 1 1296 1 21 GLN HG3 1 22 ARG H 3.065 . 4.240 4.197 4.034 4.368 0.128 18 0 "[ . 1 . 2]" 1 1297 1 21 GLN QB 1 22 ARG H 2.493 . 3.270 2.393 2.194 2.634 . 0 0 "[ . 1 . 2]" 1 1298 1 19 LYS H 1 21 GLN H 3.742 . 5.493 3.726 3.668 3.779 . 0 0 "[ . 1 . 2]" 1 1299 1 17 SER QB 1 21 GLN H 3.355 . 4.762 4.322 4.085 4.495 . 0 0 "[ . 1 . 2]" 1 1300 1 21 GLN H 1 21 GLN QG 2.850 . 3.866 2.407 2.238 3.263 . 0 0 "[ . 1 . 2]" 1 1301 1 21 GLN H 1 21 GLN QB 2.411 . 3.138 2.345 2.042 2.451 . 0 0 "[ . 1 . 2]" 1 1302 1 19 LYS HB2 1 21 GLN H 3.020 . 4.160 3.997 3.498 4.210 0.050 17 0 "[ . 1 . 2]" 1 1303 1 19 LYS HB2 1 20 LEU H 2.564 . 3.386 2.694 1.916 3.428 0.042 1 0 "[ . 1 . 2]" 1 1304 1 19 LYS HG3 1 20 LEU H 2.821 . 3.816 2.752 2.104 3.452 . 0 0 "[ . 1 . 2]" 1 1305 1 20 LEU H 1 21 GLN QB 3.330 . 4.716 3.705 3.526 3.813 . 0 0 "[ . 1 . 2]" 1 1306 1 18 TYR HB2 1 19 LYS H 3.225 . 4.525 3.606 3.223 3.815 . 0 0 "[ . 1 . 2]" 1 1307 1 16 LEU QB 1 17 SER H 3.208 . 4.494 3.117 1.844 3.917 0.078 7 0 "[ . 1 . 2]" 1 1308 1 16 LEU QD 1 17 SER H 3.333 . 4.721 3.260 2.560 4.174 . 0 0 "[ . 1 . 2]" 1 1309 1 9 VAL H 1 9 VAL QG 2.912 . 3.972 2.165 1.824 2.742 0.028 5 0 "[ . 1 . 2]" 1 1310 1 7 GLU HA 1 8 THR H 3.276 . 4.617 2.346 1.946 2.812 . 0 0 "[ . 1 . 2]" 1 1311 1 50 PHE HZ 1 58 THR H 3.182 . 4.448 3.834 3.719 3.916 . 0 0 "[ . 1 . 2]" 1 1312 1 53 GLN HB3 1 58 THR H 2.878 . 3.913 3.699 3.576 3.850 . 0 0 "[ . 1 . 2]" 1 1313 1 50 PHE QE 1 59 GLN H 3.691 . 5.394 4.797 4.020 5.083 . 0 0 "[ . 1 . 2]" 1 1314 1 58 THR HA 1 61 VAL H 2.584 . 3.419 2.716 2.678 2.780 . 0 0 "[ . 1 . 2]" 1 1315 1 60 LYS QE 1 61 VAL H 3.623 . 5.264 4.624 3.938 5.038 . 0 0 "[ . 1 . 2]" 1 1316 1 60 LYS HB2 1 61 VAL H 2.568 . 3.392 3.569 3.488 3.677 0.285 19 0 "[ . 1 . 2]" 1 1317 1 60 LYS HB3 1 61 VAL H 2.572 . 3.399 2.430 2.188 3.652 0.253 19 0 "[ . 1 . 2]" 1 1318 1 60 LYS HG3 1 61 VAL H 3.110 . 4.319 4.215 2.601 4.383 0.064 20 0 "[ . 1 . 2]" 1 1319 1 41 LEU MD2 1 61 VAL H 3.780 . 5.566 4.820 4.667 4.976 . 0 0 "[ . 1 . 2]" 1 1320 1 58 THR HA 1 62 LEU H 3.140 . 4.373 3.284 3.242 3.307 . 0 0 "[ . 1 . 2]" 1 1321 1 62 LEU H 1 62 LEU HB3 2.768 . 3.726 3.433 3.405 3.454 . 0 0 "[ . 1 . 2]" 1 1322 1 63 ALA H 1 64 ASP H 2.557 . 3.374 2.284 2.219 2.316 . 0 0 "[ . 1 . 2]" 1 1323 1 62 LEU H 1 63 ALA H 2.590 . 3.428 2.377 2.326 2.503 . 0 0 "[ . 1 . 2]" 1 1324 1 50 PHE HZ 1 63 ALA H 3.601 . 5.222 4.416 4.214 4.498 . 0 0 "[ . 1 . 2]" 1 1325 1 63 ALA H 1 64 ASP HA 3.276 . 4.617 4.628 4.578 4.654 0.037 8 0 "[ . 1 . 2]" 1 1326 1 59 GLN HA 1 63 ALA H 2.947 . 4.033 3.069 2.948 3.195 . 0 0 "[ . 1 . 2]" 1 1327 1 62 LEU HG 1 63 ALA H 3.017 . 4.155 4.102 3.976 4.172 0.017 3 0 "[ . 1 . 2]" 1 1328 1 59 GLN HA 1 64 ASP H 3.590 . 5.201 4.839 4.725 4.941 . 0 0 "[ . 1 . 2]" 1 1329 1 62 LEU HB2 1 64 ASP H 3.770 . 5.547 4.464 4.322 4.607 . 0 0 "[ . 1 . 2]" 1 1330 1 41 LEU MD2 1 64 ASP H 3.804 . 5.613 4.639 4.460 4.775 . 0 0 "[ . 1 . 2]" 1 1331 1 63 ALA HA 1 65 MET H 3.241 . 4.554 4.207 4.119 4.273 . 0 0 "[ . 1 . 2]" 1 1332 1 61 VAL HB 1 65 MET H 3.366 . 4.782 4.208 4.181 4.238 . 0 0 "[ . 1 . 2]" 1 1333 1 63 ALA MB 1 65 MET H 2.853 . 3.870 3.767 3.709 3.817 . 0 0 "[ . 1 . 2]" 1 1334 1 41 LEU MD2 1 65 MET H 2.922 . 3.989 3.678 3.503 3.797 . 0 0 "[ . 1 . 2]" 1 1335 1 36 ALA HA 1 37 LYS H 2.439 . 3.182 2.717 2.697 2.741 . 0 0 "[ . 1 . 2]" 1 1336 1 63 ALA HA 1 67 ALA H 2.582 . 3.415 3.326 3.286 3.390 . 0 0 "[ . 1 . 2]" 1 1337 1 33 ASP HA 1 37 LYS H 2.938 . 4.017 3.223 3.048 3.343 . 0 0 "[ . 1 . 2]" 1 1338 1 35 GLU QG 1 37 LYS H 3.511 . 5.052 4.025 3.790 4.334 . 0 0 "[ . 1 . 2]" 1 1339 1 66 ALA MB 1 67 ALA H 2.004 . 2.506 2.135 2.098 2.182 . 0 0 "[ . 1 . 2]" 1 1340 1 37 LYS H 1 38 LEU MD1 3.198 . 4.477 4.582 4.508 4.677 0.200 14 0 "[ . 1 . 2]" 1 1341 1 34 LEU HB2 1 37 LYS H 3.060 . 4.231 4.200 4.164 4.221 . 0 0 "[ . 1 . 2]" 1 1342 1 35 GLU HB2 1 37 LYS H 3.160 . 4.408 4.001 3.752 4.216 . 0 0 "[ . 1 . 2]" 1 1343 1 65 MET HB3 1 68 ALA H 3.506 . 5.043 3.772 3.528 4.344 . 0 0 "[ . 1 . 2]" 1 1344 1 68 ALA H 1 69 GLU HG3 3.369 . 4.788 4.407 3.760 4.733 . 0 0 "[ . 1 . 2]" 1 1345 1 67 ALA MB 1 68 ALA H 2.254 . 2.889 2.147 2.110 2.188 . 0 0 "[ . 1 . 2]" 1 1346 1 66 ALA HA 1 69 GLU H 2.618 . 3.475 3.168 3.072 3.284 . 0 0 "[ . 1 . 2]" 1 1347 1 82 LEU HA 1 83 GLU H 2.790 . 3.763 2.706 2.694 2.726 . 0 0 "[ . 1 . 2]" 1 1348 1 80 GLU HA 1 82 LEU H 3.404 . 4.853 3.240 3.057 3.391 . 0 0 "[ . 1 . 2]" 1 1349 1 69 GLU H 1 69 GLU HB3 2.383 . 3.093 2.486 1.901 2.551 . 0 0 "[ . 1 . 2]" 1 1350 1 82 LEU H 1 82 LEU HB2 2.697 . 3.606 2.097 1.967 2.178 . 0 0 "[ . 1 . 2]" 1 1351 1 82 LEU H 1 82 LEU QD 2.769 . 3.727 2.937 2.725 3.115 . 0 0 "[ . 1 . 2]" 1 1352 1 83 GLU H 1 83 GLU HB2 2.679 . 3.576 2.151 2.096 2.183 . 0 0 "[ . 1 . 2]" 1 1353 1 24 LEU HG 1 82 LEU H 3.233 . 4.539 4.069 3.842 4.643 0.104 15 0 "[ . 1 . 2]" 1 1354 1 24 LEU HG 1 83 GLU H 3.048 . 4.209 3.518 3.379 3.958 . 0 0 "[ . 1 . 2]" 1 1355 1 69 GLU H 1 70 GLN H 2.365 . 3.064 2.395 2.310 2.458 . 0 0 "[ . 1 . 2]" 1 1356 1 67 ALA H 1 70 GLN H 3.213 . 4.503 3.869 3.720 3.993 . 0 0 "[ . 1 . 2]" 1 1357 1 66 ALA HA 1 70 GLN H 2.775 . 3.738 3.787 3.728 3.850 0.112 1 0 "[ . 1 . 2]" 1 1358 1 69 GLU HG2 1 70 GLN H 2.835 . 3.840 2.765 2.618 3.048 . 0 0 "[ . 1 . 2]" 1 1359 1 69 GLU HG3 1 70 GLN H 2.182 . 2.777 1.953 1.871 2.051 . 0 0 "[ . 1 . 2]" 1 1360 1 66 ALA MB 1 70 GLN H 3.182 . 4.448 4.169 4.046 4.280 . 0 0 "[ . 1 . 2]" 1 1361 1 38 LEU MD1 1 70 GLN H 3.816 . 5.636 5.444 5.183 5.555 . 0 0 "[ . 1 . 2]" 1 1362 1 67 ALA HA 1 71 GLU H 2.843 . 3.853 3.263 3.151 3.315 . 0 0 "[ . 1 . 2]" 1 1363 1 69 GLU HG2 1 71 GLU H 2.692 . 4.550 4.063 3.837 4.281 . 0 0 "[ . 1 . 2]" 1 1364 1 70 GLN QB 1 71 GLU H 2.203 . 2.809 2.383 2.125 2.551 . 0 0 "[ . 1 . 2]" 1 1365 1 67 ALA MB 1 71 GLU H 3.590 . 5.201 4.048 3.804 4.164 . 0 0 "[ . 1 . 2]" 1 1366 1 34 LEU QD 1 71 GLU H 3.412 . 4.867 3.923 3.759 4.101 . 0 0 "[ . 1 . 2]" 1 1367 1 69 GLU HA 1 72 LEU H 2.794 . 3.770 3.078 2.975 3.176 . 0 0 "[ . 1 . 2]" 1 1368 1 72 LEU H 1 72 LEU QD 2.745 . 3.687 3.689 3.665 3.713 0.026 15 0 "[ . 1 . 2]" 1 1369 1 69 GLU HA 1 73 GLU H 3.058 . 4.227 3.816 3.529 4.002 . 0 0 "[ . 1 . 2]" 1 1370 1 72 LEU QD 1 73 GLU H 2.887 . 3.929 3.701 2.769 3.847 . 0 0 "[ . 1 . 2]" 1 1371 1 73 GLU HA 1 74 GLN H 2.408 . 3.133 2.730 2.677 2.756 . 0 0 "[ . 1 . 2]" 1 1372 1 73 GLU HG2 1 74 GLN H 2.789 . 3.761 2.274 2.003 2.864 . 0 0 "[ . 1 . 2]" 1 1373 1 74 GLN H 1 74 GLN QB 2.322 . 2.996 2.515 2.351 2.680 . 0 0 "[ . 1 . 2]" 1 1374 1 72 LEU HB2 1 74 GLN H 3.218 . 4.512 4.207 4.117 4.384 . 0 0 "[ . 1 . 2]" 1 1375 1 60 LYS HA 1 63 ALA H 2.632 . 3.498 3.114 2.974 3.166 . 0 0 "[ . 1 . 2]" 1 1376 1 59 GLN HA 1 63 ALA H 3.218 . 4.512 2.951 2.864 3.051 . 0 0 "[ . 1 . 2]" 1 1377 1 74 GLN QB 1 75 ALA H 2.620 . 3.478 3.097 2.307 3.506 0.028 4 0 "[ . 1 . 2]" 1 1378 1 63 ALA H 1 65 MET HB3 3.431 . 4.902 3.322 2.493 4.421 . 0 0 "[ . 1 . 2]" 1 1379 1 30 LEU MD2 1 75 ALA H 3.268 . 4.603 4.352 4.025 4.426 . 0 0 "[ . 1 . 2]" 1 1380 1 73 GLU H 1 76 PHE H 3.493 . 5.018 3.767 3.676 3.879 . 0 0 "[ . 1 . 2]" 1 1381 1 73 GLU QB 1 76 PHE H 3.554 . 5.133 4.548 4.387 4.742 . 0 0 "[ . 1 . 2]" 1 1382 1 73 GLU QB 1 76 PHE H 3.493 . 5.018 4.039 3.817 4.327 . 0 0 "[ . 1 . 2]" 1 1383 1 30 LEU MD2 1 76 PHE H 3.506 . 5.043 3.956 3.261 4.079 . 0 0 "[ . 1 . 2]" 1 1384 1 76 PHE QD 1 77 GLU H 3.376 . 4.801 4.360 4.264 4.430 . 0 0 "[ . 1 . 2]" 1 1385 1 73 GLU HA 1 77 GLU H 2.340 . 3.025 2.750 2.709 2.805 . 0 0 "[ . 1 . 2]" 1 1386 1 77 GLU HA 1 78 ARG H 2.733 . 3.667 2.701 2.674 2.717 . 0 0 "[ . 1 . 2]" 1 1387 1 78 ARG H 1 79 TRP HB2 3.502 . 5.035 4.411 4.264 4.546 . 0 0 "[ . 1 . 2]" 1 1388 1 35 GLU H 1 76 PHE QE 3.671 . 5.356 4.120 4.025 4.237 . 0 0 "[ . 1 . 2]" 1 1389 1 77 GLU HA 1 79 TRP H 2.963 . 4.061 3.381 3.318 3.420 . 0 0 "[ . 1 . 2]" 1 1390 1 27 LEU QD 1 79 TRP H 3.009 . 4.141 2.584 2.434 2.707 . 0 0 "[ . 1 . 2]" 1 1391 1 77 GLU HA 1 80 GLU H 2.927 . 3.998 3.099 2.822 3.292 . 0 0 "[ . 1 . 2]" 1 1392 1 79 TRP HB2 1 80 GLU H 2.930 . 4.003 3.646 3.608 3.685 . 0 0 "[ . 1 . 2]" 1 1393 1 80 GLU H 1 80 GLU HB3 2.632 . 3.498 2.926 2.464 3.126 . 0 0 "[ . 1 . 2]" 1 1394 1 78 ARG HA 1 81 TYR H 2.558 . 3.376 2.736 2.701 2.761 . 0 0 "[ . 1 . 2]" 1 1395 1 80 GLU HB3 1 81 TYR H 3.046 . 4.206 3.642 3.404 3.752 . 0 0 "[ . 1 . 2]" 1 1396 1 79 TRP HB3 1 81 TYR H 3.612 . 5.243 4.480 4.410 4.558 . 0 0 "[ . 1 . 2]" 1 1397 1 79 TRP HA 1 82 LEU H 3.177 . 4.439 3.048 3.003 3.100 . 0 0 "[ . 1 . 2]" 1 1398 1 81 TYR H 1 83 GLU H 3.257 . 4.583 3.967 3.818 4.075 . 0 0 "[ . 1 . 2]" 1 1399 1 79 TRP HA 1 83 GLU H 3.243 . 4.558 3.788 3.700 3.863 . 0 0 "[ . 1 . 2]" 1 1400 1 82 LEU H 1 82 LEU HB3 3.390 . 4.826 3.199 3.121 3.254 . 0 0 "[ . 1 . 2]" 1 1401 1 24 LEU QD 1 83 GLU H 3.025 . 4.169 2.994 2.489 3.195 . 0 0 "[ . 1 . 2]" 1 1402 1 81 TYR H 1 84 ALA H 3.302 . 4.665 3.815 3.683 3.930 . 0 0 "[ . 1 . 2]" 1 1403 1 82 LEU HA 1 84 ALA H 3.073 . 4.253 3.402 3.347 3.435 . 0 0 "[ . 1 . 2]" 1 1404 1 24 LEU HG 1 84 ALA H 3.412 . 4.867 4.861 4.762 4.925 0.058 19 0 "[ . 1 . 2]" 1 1405 1 82 LEU H 1 85 LEU H 3.780 . 5.566 3.850 3.747 3.959 . 0 0 "[ . 1 . 2]" 1 1406 1 85 LEU H 1 87 ASN H 3.187 . 4.456 3.847 3.624 4.062 . 0 0 "[ . 1 . 2]" 1 1407 1 82 LEU HA 1 85 LEU H 3.279 . 4.623 3.318 3.165 3.470 . 0 0 "[ . 1 . 2]" 1 1408 1 84 ALA MB 1 85 LEU H 2.565 . 3.388 2.302 2.231 2.407 . 0 0 "[ . 1 . 2]" 1 1409 1 85 LEU H 1 85 LEU QD 3.110 . 4.319 3.585 3.546 3.627 . 0 0 "[ . 1 . 2]" 1 1410 1 24 LEU QD 1 85 LEU H 3.641 . 5.298 4.382 4.248 4.553 . 0 0 "[ . 1 . 2]" 1 1411 1 82 LEU HA 1 86 LYS H 3.055 . 4.222 3.338 3.142 3.646 . 0 0 "[ . 1 . 2]" 1 1412 1 86 LYS H 1 86 LYS QE 3.646 . 5.308 3.848 3.643 4.056 . 0 0 "[ . 1 . 2]" 1 1413 1 16 LEU QB 1 86 LYS H 2.883 . 3.922 3.556 3.214 3.745 . 0 0 "[ . 1 . 2]" 1 1414 1 16 LEU QD 1 86 LYS H 3.019 . 4.158 2.833 2.281 3.276 . 0 0 "[ . 1 . 2]" 1 1415 1 85 LEU QD 1 86 LYS H 3.431 . 4.902 3.991 3.836 4.102 . 0 0 "[ . 1 . 2]" 1 1416 1 85 LEU HA 1 87 ASN H 3.162 . 4.412 3.313 3.160 3.421 . 0 0 "[ . 1 . 2]" 1 1417 1 83 GLU HA 1 87 ASN H 3.369 . 4.788 4.361 3.790 4.796 0.008 18 0 "[ . 1 . 2]" 1 1418 1 84 ALA MB 1 87 ASN H 3.311 . 4.681 3.613 3.334 3.881 . 0 0 "[ . 1 . 2]" 1 1419 1 16 LEU QB 1 87 ASN H 3.753 . 5.514 5.158 4.758 5.523 0.009 15 0 "[ . 1 . 2]" 1 1420 1 16 LEU QD 1 87 ASN H 3.861 . 5.724 4.430 4.165 4.911 . 0 0 "[ . 1 . 2]" 1 1421 1 86 LYS H 1 88 GLY H 3.110 . 4.319 3.307 2.734 3.585 . 0 0 "[ . 1 . 2]" 1 1422 1 88 GLY H 1 88 GLY QA 2.596 . 3.439 2.431 2.314 2.484 . 0 0 "[ . 1 . 2]" 1 1423 1 79 TRP HB3 1 79 TRP HE1 3.635 . 5.286 4.926 4.859 5.019 . 0 0 "[ . 1 . 2]" 1 1424 1 28 PRO HA 1 79 TRP HE1 3.652 . 5.320 3.582 2.891 3.874 . 0 0 "[ . 1 . 2]" 1 1425 1 24 LEU HA 1 79 TRP HE1 3.737 . 5.482 4.377 3.933 4.660 . 0 0 "[ . 1 . 2]" 1 1426 1 24 LEU HG 1 79 TRP HE1 3.001 . 4.127 3.407 2.826 3.840 . 0 0 "[ . 1 . 2]" 1 1427 1 81 TYR QE 1 84 ALA MB 3.134 . 4.362 4.333 4.224 4.411 0.049 5 0 "[ . 1 . 2]" 1 1428 1 45 VAL QG 1 50 PHE QE 2.347 . 3.036 2.484 2.363 2.562 . 0 0 "[ . 1 . 2]" 1 1429 1 50 PHE QD 1 51 PHE QR 2.589 . 3.427 2.774 2.703 2.856 . 0 0 "[ . 1 . 2]" 1 1430 1 31 LEU QD 1 76 PHE QR 2.284 . 2.936 2.546 2.477 2.610 . 0 0 "[ . 1 . 2]" 1 1431 1 31 LEU QD 1 76 PHE QR 2.382 . 3.091 2.610 2.552 2.726 . 0 0 "[ . 1 . 2]" 1 1432 1 72 LEU QD 1 76 PHE QR 2.191 . 2.791 1.832 1.524 1.911 0.143 14 0 "[ . 1 . 2]" 1 1433 1 27 LEU MD1 1 79 TRP HE3 3.134 . 4.362 4.140 4.023 4.585 0.223 1 0 "[ . 1 . 2]" 1 1434 1 79 TRP HZ2 1 83 GLU HB2 2.858 . 3.879 3.925 3.845 3.957 0.078 16 0 "[ . 1 . 2]" 1 1435 1 78 ARG HA 1 81 TYR QD 2.196 . 2.799 2.471 2.323 2.625 . 0 0 "[ . 1 . 2]" 1 1436 1 81 TYR QB 1 81 TYR QD 2.120 . 2.682 2.140 2.130 2.160 . 0 0 "[ . 1 . 2]" 1 1437 1 55 HIS HD2 1 59 GLN QB 2.474 . 3.239 2.880 2.625 3.034 . 0 0 "[ . 1 . 2]" 1 1438 1 50 PHE QD 1 53 GLN QG 2.787 . 4.550 3.942 3.619 4.168 . 0 0 "[ . 1 . 2]" 1 1439 1 18 TYR QE 1 21 GLN QB 2.822 . 3.817 3.900 3.673 3.994 0.177 5 0 "[ . 1 . 2]" 1 1440 1 78 ARG HA 1 81 TYR QE 2.491 . 4.550 4.376 4.223 4.465 . 0 0 "[ . 1 . 2]" 1 1441 1 81 TYR QB 1 81 TYR QE 2.657 . 4.550 3.945 3.939 3.957 . 0 0 "[ . 1 . 2]" 1 1442 1 81 TYR QD 1 85 LEU QD 2.465 . 3.225 3.187 3.149 3.212 . 0 0 "[ . 1 . 2]" 1 1443 1 18 TYR QD 1 19 LYS HG3 2.524 . 4.550 4.222 3.717 4.513 . 0 0 "[ . 1 . 2]" 1 1444 1 18 TYR QD 1 19 LYS HG2 2.531 . 4.550 3.630 3.353 3.836 . 0 0 "[ . 1 . 2]" 1 1445 1 18 TYR QD 1 19 LYS HB2 3.622 . 5.262 3.834 3.311 4.209 . 0 0 "[ . 1 . 2]" 1 1446 1 18 TYR QD 1 21 GLN QB 2.468 . 3.229 2.795 2.569 2.952 . 0 0 "[ . 1 . 2]" 1 1447 1 18 TYR QD 1 21 GLN QB 2.671 . 3.563 3.251 2.998 3.419 . 0 0 "[ . 1 . 2]" 1 1448 1 50 PHE QE 1 51 PHE QR 2.831 . 3.833 3.015 2.811 3.234 . 0 0 "[ . 1 . 2]" 1 1449 1 72 LEU QD 1 76 PHE HZ 2.954 . 4.045 3.842 3.690 4.005 . 0 0 "[ . 1 . 2]" 1 1450 1 31 LEU HA 1 76 PHE QR 2.885 . 3.925 3.930 3.835 3.974 0.049 8 0 "[ . 1 . 2]" 1 1451 1 72 LEU HB3 1 76 PHE QR 2.678 . 3.575 3.473 3.139 3.606 0.031 10 0 "[ . 1 . 2]" 1 1452 1 35 GLU HB2 1 76 PHE QE 2.907 . 3.963 3.390 3.104 3.635 . 0 0 "[ . 1 . 2]" 1 1453 1 72 LEU HB2 1 76 PHE QD 2.775 . 3.738 3.915 3.829 3.957 0.219 14 0 "[ . 1 . 2]" 1 1454 1 27 LEU HG 1 79 TRP HD1 2.796 . 3.773 3.704 2.142 3.946 0.173 20 0 "[ . 1 . 2]" 1 1455 1 24 LEU HA 1 79 TRP HD1 2.575 . 3.404 2.680 2.520 2.861 . 0 0 "[ . 1 . 2]" 1 1456 1 24 LEU QD 1 79 TRP HD1 2.621 . 3.480 2.504 2.138 2.673 . 0 0 "[ . 1 . 2]" 1 1457 1 27 LEU QB 1 79 TRP HD1 2.725 . 3.653 2.474 2.178 2.920 . 0 0 "[ . 1 . 2]" 1 1458 1 27 LEU QB 1 31 LEU QD 3.086 . 4.276 3.068 2.994 3.290 . 0 0 "[ . 1 . 2]" 1 1459 1 29 GLN HB3 1 31 LEU QD 3.086 . 5.000 3.982 3.812 4.054 . 0 0 "[ . 1 . 2]" 1 1460 1 24 LEU HA 1 31 LEU QD 3.086 . 4.276 3.855 3.788 3.926 . 0 0 "[ . 1 . 2]" 1 1461 1 27 LEU QB 1 31 LEU QD 3.086 . 4.276 3.001 2.941 3.160 . 0 0 "[ . 1 . 2]" 1 1462 1 30 LEU HB3 1 31 LEU QD 3.086 . 4.276 3.296 3.161 3.385 . 0 0 "[ . 1 . 2]" 1 1463 1 31 LEU QD 1 71 GLU HG2 3.086 . 5.000 5.033 4.592 5.200 0.200 14 0 "[ . 1 . 2]" 1 1464 1 31 LEU QD 1 76 PHE QB 3.086 . 4.276 2.313 2.110 2.395 . 0 0 "[ . 1 . 2]" 1 1465 1 57 GLN QB 1 58 THR MG 3.086 . 4.276 3.007 2.513 3.844 . 0 0 "[ . 1 . 2]" 1 1466 1 53 GLN QG 1 58 THR MG 3.086 . 4.276 3.499 3.418 3.607 . 0 0 "[ . 1 . 2]" 1 1467 1 53 GLN QG 1 58 THR MG 3.086 . 4.276 3.055 2.210 3.570 . 0 0 "[ . 1 . 2]" 1 1468 1 51 PHE HB3 1 58 THR MG 3.086 . 4.276 3.642 3.545 3.749 . 0 0 "[ . 1 . 2]" 1 1469 1 53 GLN HA 1 58 THR MG 3.086 . 4.276 3.464 3.349 3.580 . 0 0 "[ . 1 . 2]" 1 1470 1 45 VAL MG1 1 65 MET HB3 3.086 . 4.276 4.399 4.321 4.493 0.217 4 0 "[ . 1 . 2]" 1 1471 1 44 GLN HG2 1 45 VAL MG1 3.086 . 5.000 4.497 4.353 4.867 . 0 0 "[ . 1 . 2]" 1 1472 1 41 LEU HB3 1 45 VAL MG2 3.086 . 4.276 3.252 3.091 3.460 . 0 0 "[ . 1 . 2]" 1 1473 1 44 GLN HG2 1 45 VAL MG2 3.086 . 4.276 3.123 2.785 3.457 . 0 0 "[ . 1 . 2]" 1 1474 1 45 VAL MG2 1 65 MET HB3 3.086 . 4.276 3.361 3.220 3.485 . 0 0 "[ . 1 . 2]" 1 1475 1 85 LEU HB3 1 85 LEU MD2 3.086 . 4.276 1.931 1.913 1.945 . 0 0 "[ . 1 . 2]" 1 1476 1 82 LEU HA 1 85 LEU MD2 3.086 . 4.276 3.334 3.119 3.742 . 0 0 "[ . 1 . 2]" 1 1477 1 15 LYS HA 1 85 LEU MD2 3.086 . 4.276 3.996 2.985 4.227 . 0 0 "[ . 1 . 2]" 1 1478 1 41 LEU MD2 1 61 VAL MG2 3.086 . 4.276 3.501 3.215 3.920 . 0 0 "[ . 1 . 2]" 1 1479 1 57 GLN QB 1 61 VAL MG2 3.086 . 4.276 3.688 3.426 3.937 . 0 0 "[ . 1 . 2]" 1 1480 1 60 LYS QB 1 61 VAL MG2 3.086 . 4.276 2.889 2.642 4.134 . 0 0 "[ . 1 . 2]" 1 1481 1 44 GLN HG3 1 61 VAL MG2 3.086 . 4.276 3.755 3.336 4.027 . 0 0 "[ . 1 . 2]" 1 1482 1 30 LEU MD1 1 34 LEU QD 3.086 . 4.276 1.911 1.773 2.044 0.123 19 0 "[ . 1 . 2]" 1 1483 1 34 LEU HB3 1 34 LEU QD 3.086 . 4.276 2.082 2.074 2.089 . 0 0 "[ . 1 . 2]" 1 1484 1 61 VAL MG1 1 62 LEU HG 3.086 . 4.276 3.635 3.394 3.791 . 0 0 "[ . 1 . 2]" 1 1485 1 9 VAL HB 1 9 VAL QG 3.086 . 4.276 1.895 1.888 1.899 0.008 18 0 "[ . 1 . 2]" 1 1486 1 9 VAL HA 1 9 VAL QG 3.086 . 4.276 2.240 2.125 2.428 . 0 0 "[ . 1 . 2]" 1 1487 1 20 LEU HG 1 82 LEU MD2 3.086 . 4.276 2.684 1.970 3.713 . 0 0 "[ . 1 . 2]" 1 1488 1 24 LEU HB2 1 82 LEU MD2 3.086 . 4.276 3.564 3.297 3.814 . 0 0 "[ . 1 . 2]" 1 1489 1 78 ARG HA 1 82 LEU MD2 3.086 . 4.276 4.108 3.876 4.419 0.143 5 0 "[ . 1 . 2]" 1 1490 1 20 LEU HB2 1 82 LEU MD2 3.086 . 4.276 3.449 3.181 3.882 . 0 0 "[ . 1 . 2]" 1 1491 1 24 LEU HA 1 82 LEU MD2 3.086 . 4.276 4.169 3.877 4.288 0.012 10 0 "[ . 1 . 2]" 1 1492 1 23 GLU HG2 1 82 LEU MD1 3.086 . 4.276 1.950 1.843 2.064 0.053 20 0 "[ . 1 . 2]" 1 1493 1 34 LEU QD 1 68 ALA MB 3.086 . 4.276 3.324 3.066 3.623 . 0 0 "[ . 1 . 2]" 1 1494 1 30 LEU MD1 1 36 ALA MB 3.086 . 4.276 4.121 4.048 4.163 . 0 0 "[ . 1 . 2]" 1 1495 1 34 LEU QD 1 36 ALA MB 3.086 . 4.276 4.107 4.048 4.197 . 0 0 "[ . 1 . 2]" 1 1496 1 34 LEU QD 1 36 ALA MB 3.086 . 4.276 4.193 4.117 4.315 0.039 14 0 "[ . 1 . 2]" 1 1497 1 32 GLU HG3 1 36 ALA MB 3.086 . 4.276 3.416 2.973 3.625 . 0 0 "[ . 1 . 2]" 1 1498 1 32 GLU QB 1 36 ALA MB 3.086 . 4.276 2.992 2.884 3.090 . 0 0 "[ . 1 . 2]" 1 1499 1 36 ALA MB 1 37 LYS QB 3.086 . 4.276 3.154 3.084 3.291 . 0 0 "[ . 1 . 2]" 1 1500 1 65 MET HG2 1 68 ALA MB 3.086 . 4.276 3.597 3.171 3.676 . 0 0 "[ . 1 . 2]" 1 1501 1 68 ALA MB 1 70 GLN QB 3.086 . 4.276 4.253 4.154 4.351 0.075 16 0 "[ . 1 . 2]" 1 1502 1 65 MET HB3 1 68 ALA MB 3.086 . 4.276 3.454 3.307 3.885 . 0 0 "[ . 1 . 2]" 1 1503 1 35 GLU QG 1 36 ALA MB 3.086 . 4.276 3.253 3.170 3.360 . 0 0 "[ . 1 . 2]" 1 1504 1 34 LEU HB3 1 68 ALA MB 3.086 . 4.276 3.195 3.046 3.317 . 0 0 "[ . 1 . 2]" 1 1505 1 33 ASP HA 1 36 ALA MB 3.086 . 4.276 2.332 2.099 2.531 . 0 0 "[ . 1 . 2]" 1 1506 1 36 ALA HA 1 36 ALA MB 1.532 . 1.826 1.774 1.773 1.776 . 0 0 "[ . 1 . 2]" 1 1507 1 32 GLU HA 1 36 ALA MB 3.086 . 4.276 3.490 3.345 3.603 . 0 0 "[ . 1 . 2]" 1 1508 1 48 ALA MB 1 49 SER QB 3.086 . 4.276 3.946 3.684 4.116 . 0 0 "[ . 1 . 2]" 1 1509 1 34 LEU HG 1 75 ALA MB 3.086 . 4.276 4.184 4.010 4.355 0.079 15 0 "[ . 1 . 2]" 1 1510 1 34 LEU HB3 1 75 ALA MB 3.086 . 4.276 4.098 3.588 4.308 0.032 4 0 "[ . 1 . 2]" 1 1511 1 71 GLU HG2 1 75 ALA MB 3.086 . 4.276 3.792 3.177 4.307 0.031 12 0 "[ . 1 . 2]" 1 1512 1 18 TYR HA 1 21 GLN QB 3.086 . 4.276 1.975 1.844 2.199 0.052 17 0 "[ . 1 . 2]" 1 1513 1 54 PRO HD3 1 54 PRO QG 3.086 . 4.276 2.192 2.172 2.239 . 0 0 "[ . 1 . 2]" 1 1514 1 54 PRO HD2 1 54 PRO QG 3.086 . 4.276 2.238 2.178 2.271 . 0 0 "[ . 1 . 2]" 1 1515 1 53 GLN QG 1 54 PRO HD3 3.086 . 4.276 3.357 2.994 3.870 . 0 0 "[ . 1 . 2]" 1 1516 1 5 LYS HA 1 5 LYS QB 3.086 . 4.276 2.264 2.112 2.325 . 0 0 "[ . 1 . 2]" 1 1517 1 54 PRO HB3 1 56 GLU QG 3.086 . 4.276 3.846 3.374 4.378 0.102 13 0 "[ . 1 . 2]" 1 1518 1 53 GLN HA 1 54 PRO HG2 3.086 . 4.276 3.720 3.668 3.785 . 0 0 "[ . 1 . 2]" 1 1519 1 26 GLN HA 1 29 GLN HB3 3.086 . 4.276 4.224 4.083 4.317 0.041 14 0 "[ . 1 . 2]" 1 1520 1 42 GLN HA 1 46 ALA HA 3.086 . 4.276 4.409 4.341 4.471 0.195 5 0 "[ . 1 . 2]" 1 1521 1 16 LEU HA 1 16 LEU QB 3.086 . 4.276 2.320 2.102 2.459 . 0 0 "[ . 1 . 2]" 1 1522 1 53 GLN HA 1 54 PRO QG 3.086 . 4.276 3.848 3.641 4.155 . 0 0 "[ . 1 . 2]" 1 1523 1 36 ALA HA 1 39 GLU HG2 3.086 . 4.276 2.789 1.811 3.646 0.085 7 0 "[ . 1 . 2]" 1 1524 1 38 LEU MD2 1 66 ALA HA 3.086 . 4.276 3.915 3.737 4.053 . 0 0 "[ . 1 . 2]" 1 1525 1 34 LEU QD 1 68 ALA HA 3.086 . 4.276 2.905 2.547 3.190 . 0 0 "[ . 1 . 2]" 1 1526 1 65 MET HG2 1 66 ALA HA 3.086 . 4.276 2.790 2.192 2.951 . 0 0 "[ . 1 . 2]" 1 1527 1 59 GLN QB 1 63 ALA HA 3.086 . 4.276 4.088 3.978 4.142 . 0 0 "[ . 1 . 2]" 1 1528 1 36 ALA HA 1 36 ALA MB 3.086 . 4.276 1.896 1.893 1.902 0.003 12 0 "[ . 1 . 2]" 1 1529 1 36 ALA HA 1 39 GLU QB 3.086 . 4.276 2.215 1.988 2.547 . 0 0 "[ . 1 . 2]" 1 1530 1 39 GLU QB 1 40 ALA HA 3.086 . 4.276 3.969 3.762 4.288 0.012 7 0 "[ . 1 . 2]" 1 1531 1 65 MET ME 1 66 ALA HA 3.086 . 4.276 3.441 3.220 3.648 . 0 0 "[ . 1 . 2]" 1 1532 1 74 GLN QB 1 75 ALA HA 3.086 . 4.276 4.191 3.782 4.460 0.184 6 0 "[ . 1 . 2]" 1 1533 1 26 GLN HA 1 26 GLN HB2 3.086 . 4.276 2.608 2.284 2.882 . 0 0 "[ . 1 . 2]" 1 1534 1 9 VAL QG 1 10 LYS HA 3.086 . 4.276 3.864 3.313 4.225 . 0 0 "[ . 1 . 2]" 1 1535 1 9 VAL QG 1 11 ARG HA 3.086 . 4.276 3.794 2.788 4.439 0.163 12 0 "[ . 1 . 2]" 1 1536 1 85 LEU HA 1 85 LEU HB3 3.086 . 4.276 2.537 2.490 2.603 . 0 0 "[ . 1 . 2]" 1 1537 1 38 LEU MD2 1 64 ASP HA 3.086 . 5.000 5.059 5.023 5.092 0.092 20 0 "[ . 1 . 2]" 1 1538 1 20 LEU HA 1 20 LEU QD 3.086 . 4.276 2.427 1.985 2.719 . 0 0 "[ . 1 . 2]" 1 1539 1 16 LEU HG 1 20 LEU HA 3.086 . 4.276 4.238 3.830 4.358 0.082 7 0 "[ . 1 . 2]" 1 1540 1 33 ASP HA 1 34 LEU HG 3.086 . 4.276 4.138 4.024 4.214 . 0 0 "[ . 1 . 2]" 1 1541 1 34 LEU HA 1 34 LEU QD 1.532 . 1.826 1.821 1.795 1.840 0.014 4 0 "[ . 1 . 2]" 1 1542 1 30 LEU HA 1 30 LEU MD2 3.086 . 4.276 3.425 3.361 3.510 . 0 0 "[ . 1 . 2]" 1 1543 1 72 LEU HA 1 72 LEU HB2 3.086 . 4.276 2.322 2.286 2.358 . 0 0 "[ . 1 . 2]" 1 1544 1 34 LEU HA 1 34 LEU HB3 3.086 . 4.276 2.339 2.324 2.356 . 0 0 "[ . 1 . 2]" 1 1545 1 20 LEU HA 1 23 GLU QB 3.086 . 4.276 1.793 1.618 1.944 0.278 10 0 "[ . 1 . 2]" 1 1546 1 30 LEU HA 1 30 LEU HB3 3.086 . 4.276 2.371 2.282 2.674 . 0 0 "[ . 1 . 2]" 1 1547 1 56 GLU QB 1 57 GLN HA 3.086 . 4.276 3.237 2.876 3.956 . 0 0 "[ . 1 . 2]" 1 1548 1 29 GLN HA 1 29 GLN QB 3.086 . 4.276 2.400 2.307 2.495 . 0 0 "[ . 1 . 2]" 1 1549 1 30 LEU HG 1 31 LEU HA 3.086 . 4.276 2.975 2.914 3.031 . 0 0 "[ . 1 . 2]" 1 1550 1 30 LEU HB3 1 31 LEU HA 3.086 . 4.276 4.166 4.124 4.230 . 0 0 "[ . 1 . 2]" 1 1551 1 31 LEU HA 1 32 GLU HG3 3.086 . 4.276 4.276 4.160 4.398 0.122 7 0 "[ . 1 . 2]" 1 1552 1 34 LEU HA 1 35 GLU HB2 3.086 . 4.276 3.637 3.529 3.737 . 0 0 "[ . 1 . 2]" 1 1553 1 57 GLN HA 1 57 GLN QG 3.086 . 4.276 3.243 3.083 3.489 . 0 0 "[ . 1 . 2]" 1 1554 1 34 LEU HA 1 34 LEU HB3 3.086 . 4.276 2.286 2.249 2.307 . 0 0 "[ . 1 . 2]" 1 1555 1 42 GLN HA 1 45 VAL QG 3.086 . 4.276 3.010 2.801 3.120 . 0 0 "[ . 1 . 2]" 1 1556 1 16 LEU MD1 1 21 GLN HA 3.086 . 4.276 2.460 2.028 3.590 . 0 0 "[ . 1 . 2]" 1 1557 1 85 LEU QD 1 86 LYS HA 3.086 . 4.276 4.341 4.272 4.451 0.175 18 0 "[ . 1 . 2]" 1 1558 1 38 LEU MD2 1 42 GLN HA 3.086 . 4.276 3.985 3.717 4.121 . 0 0 "[ . 1 . 2]" 1 1559 1 83 GLU HA 1 83 GLU HG3 3.086 . 4.276 3.404 3.133 3.569 . 0 0 "[ . 1 . 2]" 1 1560 1 83 GLU HA 1 83 GLU HB2 3.086 . 4.276 2.561 2.452 2.628 . 0 0 "[ . 1 . 2]" 1 1561 1 42 GLN HA 1 42 GLN HB2 3.086 . 4.276 2.653 2.385 2.684 . 0 0 "[ . 1 . 2]" 1 1562 1 21 GLN HA 1 21 GLN QB 3.086 . 4.276 2.434 2.398 2.549 . 0 0 "[ . 1 . 2]" 1 1563 1 21 GLN HA 1 21 GLN HG3 3.086 . 4.276 2.489 2.390 2.600 . 0 0 "[ . 1 . 2]" 1 1564 1 60 LYS HA 1 60 LYS HG3 3.086 . 4.276 2.915 2.547 3.219 . 0 0 "[ . 1 . 2]" 1 1565 1 59 GLN HA 1 62 LEU HB3 3.086 . 4.276 3.464 3.365 3.591 . 0 0 "[ . 1 . 2]" 1 1566 1 70 GLN HA 1 70 GLN QB 3.086 . 4.276 2.135 2.024 2.329 . 0 0 "[ . 1 . 2]" 1 1567 1 25 GLU HA 1 25 GLU HB2 3.086 . 4.276 2.598 2.175 2.801 . 0 0 "[ . 1 . 2]" 1 1568 1 59 GLN HA 1 59 GLN QB 3.086 . 4.276 2.006 1.882 2.116 0.014 13 0 "[ . 1 . 2]" 1 1569 1 25 GLU HA 1 25 GLU HB3 3.086 . 4.276 1.910 1.832 1.997 0.064 14 0 "[ . 1 . 2]" 1 1570 1 24 LEU HA 1 27 LEU QB 3.086 . 4.276 2.004 1.923 2.134 . 0 0 "[ . 1 . 2]" 1 1571 1 34 LEU HB3 1 72 LEU HA 3.086 . 4.276 2.767 2.648 2.833 . 0 0 "[ . 1 . 2]" 1 1572 1 62 LEU HA 1 62 LEU HB2 3.086 . 4.276 2.837 2.768 2.932 . 0 0 "[ . 1 . 2]" 1 1573 1 55 HIS HA 1 56 GLU QG 3.086 . 5.000 4.766 4.639 4.975 . 0 0 "[ . 1 . 2]" 1 1574 1 32 GLU HA 1 35 GLU HB2 3.086 . 4.276 2.328 2.261 2.416 . 0 0 "[ . 1 . 2]" 1 1575 1 39 GLU HA 1 39 GLU QB 3.086 . 4.276 2.302 2.260 2.347 . 0 0 "[ . 1 . 2]" 1 1576 1 32 GLU HA 1 32 GLU QB 3.086 . 4.276 2.083 2.028 2.135 . 0 0 "[ . 1 . 2]" 1 1577 1 80 GLU HA 1 80 GLU HB3 3.086 . 4.276 2.201 2.145 2.256 . 0 0 "[ . 1 . 2]" 1 1578 1 80 GLU HA 1 83 GLU HB2 3.086 . 4.276 2.505 2.032 2.713 . 0 0 "[ . 1 . 2]" 1 1579 1 37 LYS HA 1 38 LEU MD2 3.086 . 5.000 4.766 4.604 4.856 . 0 0 "[ . 1 . 2]" 1 1580 1 38 LEU HG 1 69 GLU HA 3.086 . 4.276 2.483 2.296 2.628 . 0 0 "[ . 1 . 2]" 1 1581 1 72 LEU QD 1 73 GLU HA 3.086 . 4.276 3.924 1.945 4.170 . 0 0 "[ . 1 . 2]" 1 1582 1 23 GLU HA 1 23 GLU QB 3.086 . 4.276 2.057 2.036 2.076 . 0 0 "[ . 1 . 2]" 1 1583 1 56 GLU HA 1 56 GLU QG 3.086 . 4.276 2.398 2.276 2.687 . 0 0 "[ . 1 . 2]" 1 1584 1 23 GLU HA 1 23 GLU QB 3.086 . 4.276 2.043 1.840 2.136 0.056 12 0 "[ . 1 . 2]" 1 1585 1 73 GLU HA 1 73 GLU QB 3.086 . 4.276 2.191 2.153 2.267 . 0 0 "[ . 1 . 2]" 1 1586 1 35 GLU HA 1 35 GLU HB3 3.086 . 4.276 2.192 2.147 2.219 . 0 0 "[ . 1 . 2]" 1 1587 1 38 LEU MD2 1 65 MET HA 3.086 . 4.276 2.869 2.783 2.959 . 0 0 "[ . 1 . 2]" 1 1588 1 38 LEU HB2 1 69 GLU HA 3.086 . 4.276 2.916 2.755 3.103 . 0 0 "[ . 1 . 2]" 1 1589 1 78 ARG HB2 1 79 TRP HA 3.285 . 4.634 5.026 4.250 5.212 0.578 4 7 "[ +. *1 -* . * **]" 1 1590 1 8 THR HA 1 9 VAL QG 3.086 . 4.276 3.686 3.217 4.393 0.117 16 0 "[ . 1 . 2]" 1 1591 1 30 LEU MD2 1 76 PHE HA 3.285 . 4.634 4.575 4.148 4.658 0.024 2 0 "[ . 1 . 2]" 1 1592 1 54 PRO HA 1 54 PRO QG 3.086 . 4.276 2.978 2.873 3.494 . 0 0 "[ . 1 . 2]" 1 1593 1 57 GLN QB 1 58 THR HA 3.086 . 4.276 3.333 3.129 3.713 . 0 0 "[ . 1 . 2]" 1 1594 1 53 GLN HB3 1 58 THR HA 3.086 . 4.276 4.358 4.275 4.477 0.201 13 0 "[ . 1 . 2]" 1 1595 1 43 THR HA 1 44 GLN HB3 3.086 . 5.000 5.068 4.952 5.228 0.228 14 0 "[ . 1 . 2]" 1 1596 1 53 GLN HB3 1 58 THR HB 3.086 . 4.276 4.328 4.207 4.410 0.134 19 0 "[ . 1 . 2]" 1 1597 1 8 THR HB 1 9 VAL QG 3.086 . 4.276 4.111 2.851 4.510 0.234 15 0 "[ . 1 . 2]" 1 1598 1 59 GLN HA 1 63 ALA HA 3.086 . 4.276 3.900 3.871 3.926 . 0 0 "[ . 1 . 2]" 1 1599 1 25 GLU HA 1 26 GLN HA 3.086 . 4.276 4.417 4.329 4.501 0.225 5 0 "[ . 1 . 2]" 1 1600 1 33 ASP HB3 1 34 LEU HA 3.086 . 4.276 3.602 3.536 3.658 . 0 0 "[ . 1 . 2]" 1 1601 1 29 GLN HA 1 29 GLN HG2 3.086 . 4.276 2.031 1.820 2.176 0.076 16 0 "[ . 1 . 2]" 1 1602 1 74 GLN HA 1 74 GLN HG3 3.086 . 4.276 2.657 1.962 3.279 . 0 0 "[ . 1 . 2]" 1 1603 1 22 ARG HA 1 25 GLU HB2 3.086 . 4.276 2.454 2.175 2.799 . 0 0 "[ . 1 . 2]" 1 1604 1 49 SER HA 1 49 SER QB 3.086 . 4.276 2.199 1.935 2.395 . 0 0 "[ . 1 . 2]" 1 1605 1 42 GLN HA 1 42 GLN HG3 3.086 . 4.276 3.275 3.041 3.417 . 0 0 "[ . 1 . 2]" 1 1606 1 18 TYR HB2 1 19 LYS HA 3.086 . 4.276 4.234 3.796 4.931 0.655 9 2 "[ . +1 . -2]" 1 1607 1 35 GLU HA 1 35 GLU QG 3.086 . 4.276 2.201 2.123 2.321 . 0 0 "[ . 1 . 2]" 1 1608 1 79 TRP HA 1 79 TRP HB2 3.086 . 4.276 2.096 2.074 2.114 . 0 0 "[ . 1 . 2]" 1 1609 1 73 GLU HA 1 76 PHE HA 3.086 . 4.276 4.139 4.052 4.213 . 0 0 "[ . 1 . 2]" 1 1610 1 49 SER HA 1 49 SER QB 3.086 . 4.276 2.022 1.859 2.113 0.037 9 0 "[ . 1 . 2]" 1 1611 1 18 TYR HA 1 19 LYS HA 3.086 . 4.276 4.016 3.943 4.085 . 0 0 "[ . 1 . 2]" 1 1612 1 20 LEU HA 1 23 GLU HA 3.086 . 4.276 3.620 3.524 3.674 . 0 0 "[ . 1 . 2]" 1 1613 1 48 ALA MB 1 49 SER QB 3.086 . 4.276 4.149 3.788 4.419 0.143 1 0 "[ . 1 . 2]" 1 1614 1 45 VAL QG 1 65 MET ME 3.086 . 4.276 2.010 1.859 2.409 0.037 17 0 "[ . 1 . 2]" 1 1615 1 41 LEU MD1 1 63 ALA MB 3.086 . 4.276 4.235 4.125 4.357 0.081 20 0 "[ . 1 . 2]" 1 1616 1 5 LYS HB2 1 5 LYS HG3 3.086 . 4.276 2.039 1.953 2.223 . 0 0 "[ . 1 . 2]" 1 1617 1 10 LYS HB2 1 10 LYS HG3 3.086 . 4.276 2.156 2.061 2.311 . 0 0 "[ . 1 . 2]" 1 1618 1 10 LYS HB2 1 10 LYS HG2 3.086 . 4.276 2.087 1.967 2.257 . 0 0 "[ . 1 . 2]" 1 1619 1 5 LYS QD 1 5 LYS HG2 1.532 . 1.826 1.746 1.680 1.783 . 0 0 "[ . 1 . 2]" 1 1620 1 5 LYS QD 1 5 LYS HG3 1.532 . 1.826 1.744 1.701 1.781 . 0 0 "[ . 1 . 2]" 1 1621 1 15 LYS HB2 1 15 LYS QG 3.086 . 4.276 2.096 1.983 2.157 . 0 0 "[ . 1 . 2]" 1 1622 1 15 LYS QD 1 15 LYS QG 3.086 . 4.276 1.932 1.888 1.972 0.008 19 0 "[ . 1 . 2]" 1 1623 1 5 LYS QB 1 5 LYS HG2 3.086 . 4.276 2.140 1.975 2.232 . 0 0 "[ . 1 . 2]" 1 1624 1 78 ARG HB2 1 78 ARG HG3 3.086 . 4.276 2.440 2.168 2.659 . 0 0 "[ . 1 . 2]" 1 1625 1 78 ARG HG2 1 82 LEU QD 3.086 . 4.276 3.274 2.780 4.536 0.260 8 0 "[ . 1 . 2]" 1 1626 1 78 ARG HG3 1 82 LEU QD 3.086 . 4.276 2.429 2.021 4.281 0.005 8 0 "[ . 1 . 2]" 1 1627 1 85 LEU QD 1 85 LEU HG 3.086 . 4.276 1.891 1.888 1.894 0.008 9 0 "[ . 1 . 2]" 1 1628 1 21 GLN HB2 1 22 ARG QG 3.086 . 4.276 3.972 3.320 4.461 0.185 18 0 "[ . 1 . 2]" 1 1629 1 22 ARG QG 1 23 GLU QB 3.086 . 4.276 3.881 3.334 4.223 . 0 0 "[ . 1 . 2]" 1 1630 1 30 LEU QD 1 30 LEU HG 3.086 . 4.276 1.894 1.892 1.897 0.004 15 0 "[ . 1 . 2]" 1 1631 1 16 LEU QD 1 16 LEU HG 1.532 . 1.826 1.798 1.777 1.821 . 0 0 "[ . 1 . 2]" 1 1632 1 24 LEU HB3 1 24 LEU HG 3.086 . 4.276 2.346 2.244 2.374 . 0 0 "[ . 1 . 2]" 1 1633 1 16 LEU HG 1 21 GLN HG3 3.086 . 4.276 4.115 3.167 4.890 0.614 7 1 "[ . + 1 . 2]" 1 1634 1 24 LEU HG 1 27 LEU QB 3.086 . 4.276 3.472 3.091 3.729 . 0 0 "[ . 1 . 2]" 1 1635 1 37 LYS HG3 1 41 LEU HG 3.086 . 4.276 2.882 2.798 2.992 . 0 0 "[ . 1 . 2]" 1 1636 1 45 VAL QG 1 62 LEU HG 3.086 . 4.276 3.450 3.309 3.620 . 0 0 "[ . 1 . 2]" 1 1637 1 24 LEU HB2 1 82 LEU HG 3.086 . 5.000 4.872 4.619 5.026 0.026 14 0 "[ . 1 . 2]" 1 1638 1 82 LEU QD 1 82 LEU HG 3.086 . 4.276 1.891 1.887 1.895 0.009 4 0 "[ . 1 . 2]" 1 1639 1 16 LEU QD 1 21 GLN QB 3.086 . 4.276 3.610 2.897 4.280 0.004 7 0 "[ . 1 . 2]" 1 1640 1 66 ALA MB 1 70 GLN QB 3.086 . 4.276 3.839 3.105 4.255 . 0 0 "[ . 1 . 2]" 1 1641 1 16 LEU QB 1 21 GLN QB 3.086 . 4.276 4.339 3.929 4.585 0.309 8 0 "[ . 1 . 2]" 1 1642 1 21 GLN HB2 1 22 ARG QB 3.086 . 4.276 3.217 2.539 3.942 . 0 0 "[ . 1 . 2]" 1 1643 1 45 VAL HA 1 45 VAL QG 3.086 . 4.276 2.146 2.140 2.152 . 0 0 "[ . 1 . 2]" 1 1644 1 53 GLN HB2 1 57 GLN QB 3.086 . 4.276 3.425 2.568 4.309 0.033 10 0 "[ . 1 . 2]" 1 1645 1 23 GLU QB 1 82 LEU MD1 3.086 . 4.276 2.344 2.102 2.659 . 0 0 "[ . 1 . 2]" 1 1646 1 41 LEU MD2 1 44 GLN HB2 3.086 . 4.276 3.839 3.527 4.132 . 0 0 "[ . 1 . 2]" 1 1647 1 43 THR MG 1 44 GLN HB2 3.086 . 4.276 3.971 3.477 4.295 0.019 13 0 "[ . 1 . 2]" 1 1648 1 20 LEU QD 1 23 GLU QB 3.086 . 4.276 3.087 2.610 3.374 . 0 0 "[ . 1 . 2]" 1 1649 1 36 ALA MB 1 39 GLU QB 3.086 . 4.276 3.262 3.083 3.327 . 0 0 "[ . 1 . 2]" 1 1650 1 36 ALA MB 1 39 GLU QB 3.086 . 4.276 3.136 2.989 3.208 . 0 0 "[ . 1 . 2]" 1 1651 1 27 LEU QB 1 27 LEU HG 3.086 . 4.276 2.301 2.217 2.324 . 0 0 "[ . 1 . 2]" 1 1652 1 26 GLN HB2 1 26 GLN HB3 1.532 . 1.826 1.709 1.702 1.720 . 0 0 "[ . 1 . 2]" 1 1653 1 34 LEU QD 1 71 GLU HB2 3.086 . 4.276 3.237 3.100 3.528 . 0 0 "[ . 1 . 2]" 1 1654 1 24 LEU QD 1 25 GLU HB3 3.086 . 4.276 3.792 3.478 4.028 . 0 0 "[ . 1 . 2]" 1 1655 1 19 LYS QD 1 20 LEU QD 3.086 . 4.276 2.870 2.402 3.415 . 0 0 "[ . 1 . 2]" 1 1656 1 67 ALA MB 1 71 GLU HB3 3.086 . 4.276 4.098 3.929 4.199 . 0 0 "[ . 1 . 2]" 1 1657 1 38 LEU HG 1 69 GLU HB2 3.086 . 4.276 3.322 3.158 3.516 . 0 0 "[ . 1 . 2]" 1 1658 1 45 VAL HB 1 45 VAL QG 3.086 . 4.276 1.893 1.892 1.895 0.004 4 0 "[ . 1 . 2]" 1 1659 1 38 LEU HG 1 65 MET HG2 3.086 . 4.276 4.212 3.387 4.345 0.069 10 0 "[ . 1 . 2]" 1 1660 1 38 LEU HG 1 65 MET HG3 3.086 . 4.276 3.915 3.721 4.399 0.123 14 0 "[ . 1 . 2]" 1 1661 1 45 VAL MG2 1 61 VAL HB 3.086 . 4.276 3.326 3.171 3.474 . 0 0 "[ . 1 . 2]" 1 1662 1 16 LEU QD 1 86 LYS HB2 3.086 . 4.276 2.130 1.831 3.849 0.065 7 0 "[ . 1 . 2]" 1 1663 1 16 LEU QD 1 86 LYS HB3 3.086 . 4.276 3.428 3.130 4.118 . 0 0 "[ . 1 . 2]" 1 1664 1 30 LEU MD1 1 37 LYS QB 3.086 . 4.276 4.273 4.229 4.322 0.046 14 0 "[ . 1 . 2]" 1 1665 1 10 LYS HB3 1 10 LYS HG3 3.086 . 4.276 2.521 2.286 2.680 . 0 0 "[ . 1 . 2]" 1 1666 1 9 VAL HB 1 10 LYS HB2 3.086 . 4.276 4.195 4.027 4.536 0.260 4 0 "[ . 1 . 2]" 1 1667 1 5 LYS HB2 1 5 LYS HG3 3.086 . 4.276 2.110 2.016 2.337 . 0 0 "[ . 1 . 2]" 1 1668 1 38 LEU MD2 1 65 MET HB2 3.086 . 4.276 3.208 3.082 3.339 . 0 0 "[ . 1 . 2]" 1 1669 1 38 LEU MD2 1 65 MET HB3 3.086 . 4.276 3.549 3.421 3.670 . 0 0 "[ . 1 . 2]" 1 1670 1 16 LEU QB 1 21 GLN HG3 3.086 . 4.276 3.313 2.518 4.404 0.128 18 0 "[ . 1 . 2]" 1 1671 1 16 LEU QB 1 21 GLN HG2 3.086 . 4.276 3.454 2.546 4.039 . 0 0 "[ . 1 . 2]" 1 1672 1 42 GLN HG2 1 45 VAL QG 3.086 . 4.276 4.336 4.287 4.422 0.146 15 0 "[ . 1 . 2]" 1 1673 1 66 ALA MB 1 70 GLN HG2 3.086 . 4.276 3.575 3.314 4.126 . 0 0 "[ . 1 . 2]" 1 1674 1 38 LEU HG 1 42 GLN HG2 3.086 . 4.276 4.336 4.276 4.396 0.120 5 0 "[ . 1 . 2]" 1 1675 1 22 ARG QG 1 26 GLN QG 3.086 . 4.276 3.488 2.861 4.141 . 0 0 "[ . 1 . 2]" 1 1676 1 22 ARG QG 1 26 GLN QG 3.086 . 4.276 3.319 2.963 3.862 . 0 0 "[ . 1 . 2]" 1 1677 1 66 ALA MB 1 70 GLN HG3 3.086 . 4.276 4.073 3.666 4.416 0.140 20 0 "[ . 1 . 2]" 1 1678 1 26 GLN HB2 1 26 GLN QG 3.086 . 4.276 2.201 2.013 2.301 . 0 0 "[ . 1 . 2]" 1 1679 1 43 THR MG 1 44 GLN HG3 3.086 . 4.276 3.713 3.288 4.050 . 0 0 "[ . 1 . 2]" 1 1680 1 32 GLU HG3 1 36 ALA MB 3.086 . 4.276 4.129 3.816 4.308 0.032 3 0 "[ . 1 . 2]" 1 1681 1 36 ALA MB 1 39 GLU HG3 3.086 . 4.276 4.263 3.951 4.844 0.568 8 1 "[ . + 1 . 2]" 1 1682 1 35 GLU QG 1 38 LEU MD1 3.086 . 4.276 2.626 2.137 3.373 . 0 0 "[ . 1 . 2]" 1 1683 1 35 GLU QG 1 38 LEU MD1 3.086 . 4.276 2.615 2.136 3.332 . 0 0 "[ . 1 . 2]" 1 1684 1 30 LEU MD2 1 71 GLU HG3 3.086 . 4.276 2.564 2.134 3.215 . 0 0 "[ . 1 . 2]" 1 1685 1 35 GLU QG 1 36 ALA MB 3.086 . 4.276 3.262 3.193 3.414 . 0 0 "[ . 1 . 2]" 1 1686 1 30 LEU HG 1 71 GLU HG3 3.086 . 4.276 3.463 3.207 3.630 . 0 0 "[ . 1 . 2]" 1 1687 1 38 LEU HB2 1 69 GLU HG2 3.086 . 4.276 4.130 3.481 4.304 0.028 4 0 "[ . 1 . 2]" 1 1688 1 34 LEU QD 1 71 GLU HG3 3.086 . 4.276 1.985 1.751 2.774 0.145 17 0 "[ . 1 . 2]" 1 1689 1 69 GLU HB2 1 69 GLU HG3 3.086 . 4.276 2.358 2.206 2.615 . 0 0 "[ . 1 . 2]" 1 1690 1 72 LEU QD 1 76 PHE QB 3.086 . 4.276 3.776 2.516 3.909 . 0 0 "[ . 1 . 2]" 1 1691 1 75 ALA MB 1 76 PHE QB 3.086 . 4.276 3.910 3.827 3.984 . 0 0 "[ . 1 . 2]" 1 1692 1 73 GLU QB 1 76 PHE QB 3.086 . 4.276 3.475 3.310 3.596 . 0 0 "[ . 1 . 2]" 1 1693 1 73 GLU QB 1 76 PHE QB 3.086 . 4.276 3.589 3.348 3.785 . 0 0 "[ . 1 . 2]" 1 1694 1 73 GLU QB 1 76 PHE QB 3.086 . 4.276 3.103 2.916 3.250 . 0 0 "[ . 1 . 2]" 1 1695 1 41 LEU HB3 1 64 ASP HB3 3.086 . 4.276 4.094 3.791 4.253 . 0 0 "[ . 1 . 2]" 1 1696 1 60 LYS HG3 1 64 ASP HB3 3.086 . 4.276 4.230 4.095 4.341 0.065 12 0 "[ . 1 . 2]" 1 1697 1 45 VAL QG 1 50 PHE HB2 3.086 . 4.276 4.175 3.932 4.281 0.005 7 0 "[ . 1 . 2]" 1 1698 1 30 LEU MD2 1 33 ASP HB2 3.086 . 4.276 4.151 4.118 4.180 . 0 0 "[ . 1 . 2]" 1 1699 1 30 LEU HG 1 33 ASP HB3 3.086 . 4.276 3.935 3.751 4.197 . 0 0 "[ . 1 . 2]" 1 1700 1 30 LEU HB2 1 33 ASP HB3 3.086 . 4.276 4.294 4.152 4.376 0.100 9 0 "[ . 1 . 2]" 1 1701 1 30 LEU HG 1 33 ASP HB2 3.086 . 4.276 4.436 4.376 4.491 0.215 1 0 "[ . 1 . 2]" 1 1702 1 30 LEU HB2 1 33 ASP HB2 3.086 . 4.276 4.346 4.299 4.417 0.141 1 0 "[ . 1 . 2]" 1 1703 1 29 GLN HB3 1 33 ASP HB2 3.086 . 4.276 4.337 4.224 4.443 0.167 18 0 "[ . 1 . 2]" 1 1704 1 62 LEU HB3 1 62 LEU HG 3.086 . 4.276 2.778 2.670 2.829 . 0 0 "[ . 1 . 2]" 1 1705 1 30 LEU HB3 1 30 LEU MD2 3.086 . 4.276 1.993 1.965 2.012 . 0 0 "[ . 1 . 2]" 1 1706 1 30 LEU HB2 1 30 LEU QD 3.086 . 4.276 2.108 2.099 2.122 . 0 0 "[ . 1 . 2]" 1 1707 1 24 LEU HB2 1 24 LEU QD 3.086 . 4.276 2.100 1.971 2.188 . 0 0 "[ . 1 . 2]" 1 1708 1 20 LEU HB3 1 20 LEU QD 3.086 . 4.276 1.894 1.866 1.983 0.030 11 0 "[ . 1 . 2]" 1 1709 1 85 LEU HB2 1 85 LEU QD 3.086 . 4.276 2.086 2.071 2.115 . 0 0 "[ . 1 . 2]" 1 1710 1 24 LEU QD 1 86 LYS QE 3.086 . 4.276 2.385 1.875 3.249 0.021 15 0 "[ . 1 . 2]" 1 1711 1 24 LEU QD 1 86 LYS QE 3.086 . 4.276 1.990 1.758 2.938 0.138 18 0 "[ . 1 . 2]" 1 1712 1 5 LYS QD 1 5 LYS QE 1.532 . 1.826 1.620 1.599 1.640 . 0 0 "[ . 1 . 2]" 1 1713 1 5 LYS QE 1 5 LYS HG3 3.086 . 4.276 2.210 1.953 2.655 . 0 0 "[ . 1 . 2]" 1 1714 1 37 LYS QD 1 37 LYS QE 1.532 . 1.826 1.840 1.789 1.864 0.038 12 0 "[ . 1 . 2]" 1 1715 1 38 LEU MD2 1 41 LEU HB2 3.086 . 4.276 2.731 2.633 2.822 . 0 0 "[ . 1 . 2]" 1 1716 1 22 ARG QB 1 22 ARG QD 3.086 . 4.276 1.999 1.910 2.155 . 0 0 "[ . 1 . 2]" 1 1717 1 21 GLN HG3 1 22 ARG QD 3.086 . 4.276 3.252 2.765 3.990 . 0 0 "[ . 1 . 2]" 1 1718 1 40 ALA MB 1 41 LEU HB2 3.086 . 4.276 3.661 3.448 3.809 . 0 0 "[ . 1 . 2]" 1 1719 1 41 LEU HB2 1 42 GLN HB3 3.086 . 4.276 4.138 3.824 4.345 0.069 8 0 "[ . 1 . 2]" 1 1720 1 34 LEU HB3 1 34 LEU QD 3.086 . 4.276 2.064 2.045 2.075 . 0 0 "[ . 1 . 2]" 1 1721 1 16 LEU QB 1 16 LEU QD 3.086 . 4.276 1.963 1.862 2.066 0.034 7 0 "[ . 1 . 2]" 1 1722 1 16 LEU QB 1 20 LEU QD 3.086 . 4.276 3.305 1.872 4.025 0.024 11 0 "[ . 1 . 2]" 1 1723 1 16 LEU QB 1 85 LEU HG 3.086 . 4.276 3.232 2.543 3.910 . 0 0 "[ . 1 . 2]" 1 1724 1 78 ARG HB2 1 78 ARG QD 3.086 . 4.276 2.531 2.144 3.020 . 0 0 "[ . 1 . 2]" 1 1725 1 78 ARG QD 1 82 LEU QD 3.086 . 4.276 2.418 1.980 2.907 . 0 0 "[ . 1 . 2]" 1 1726 1 9 VAL QG 1 11 ARG QD 3.086 . 4.276 3.391 1.933 4.279 0.003 15 0 "[ . 1 . 2]" 1 1727 1 21 GLN HB2 1 22 ARG QD 3.086 . 4.276 2.426 2.099 2.738 . 0 0 "[ . 1 . 2]" 1 1728 1 15 LYS HB3 1 16 LEU QB 3.086 . 4.276 2.895 1.793 3.773 0.103 11 0 "[ . 1 . 2]" 1 1729 1 5 LYS QE 1 5 LYS HG2 3.086 . 4.276 2.035 1.945 2.218 . 0 0 "[ . 1 . 2]" 1 1730 1 15 LYS QG 1 86 LYS HA 3.086 . 4.276 2.991 2.317 3.781 . 0 0 "[ . 1 . 2]" 1 1731 1 16 LEU HG 1 21 GLN HA 3.086 . 4.276 2.749 1.935 3.754 . 0 0 "[ . 1 . 2]" 1 1732 1 21 GLN QB 1 21 GLN HG3 3.086 . 4.276 2.320 2.158 2.393 . 0 0 "[ . 1 . 2]" 1 1733 1 53 GLN HB2 1 54 PRO HD3 3.086 . 4.276 3.988 3.761 4.238 . 0 0 "[ . 1 . 2]" 1 1734 1 21 GLN HA 1 21 GLN QB 3.086 . 4.276 2.269 2.227 2.327 . 0 0 "[ . 1 . 2]" 1 1735 1 44 GLN HB3 1 44 GLN HG3 3.086 . 4.276 2.161 2.013 2.317 . 0 0 "[ . 1 . 2]" 1 1736 1 29 GLN HB2 1 29 GLN QG 3.086 . 4.276 2.298 2.154 2.521 . 0 0 "[ . 1 . 2]" 1 1737 1 29 GLN HB3 1 29 GLN HG3 3.086 . 4.276 2.142 1.994 2.374 . 0 0 "[ . 1 . 2]" 1 1738 1 54 PRO HD3 1 57 GLN QB 3.086 . 4.276 4.241 3.983 4.460 0.184 7 0 "[ . 1 . 2]" 1 1739 1 5 LYS QD 1 5 LYS QE 1.532 . 1.826 1.698 1.671 1.716 . 0 0 "[ . 1 . 2]" 1 1740 1 26 GLN HB3 1 26 GLN QG 3.086 . 4.276 2.082 1.972 2.145 . 0 0 "[ . 1 . 2]" 1 1741 1 26 GLN HB3 1 26 GLN QG 3.086 . 4.276 2.087 1.975 2.160 . 0 0 "[ . 1 . 2]" 1 1742 1 19 LYS HA 1 22 ARG QB 3.086 . 4.276 3.956 3.276 4.421 0.145 16 0 "[ . 1 . 2]" 1 1743 1 55 HIS HB3 1 56 GLU QB 3.086 . 4.276 4.294 4.196 4.363 0.087 16 0 "[ . 1 . 2]" 1 1744 1 10 LYS HB2 1 10 LYS QE 3.086 . 4.276 2.513 1.702 3.685 0.194 11 0 "[ . 1 . 2]" 1 1745 1 33 ASP HB3 1 37 LYS QB 3.086 . 4.276 3.394 3.361 3.441 . 0 0 "[ . 1 . 2]" 1 1746 1 19 LYS HA 1 19 LYS HB3 3.086 . 4.276 2.283 2.159 2.400 . 0 0 "[ . 1 . 2]" 1 1747 1 19 LYS HA 1 19 LYS HB2 3.086 . 4.276 2.283 2.149 2.443 . 0 0 "[ . 1 . 2]" 1 1748 1 5 LYS HB2 1 5 LYS QE 3.086 . 4.276 2.690 1.876 3.609 0.020 2 0 "[ . 1 . 2]" 1 1749 1 21 GLN QB 1 21 GLN HG2 3.086 . 4.276 2.053 1.964 2.124 . 0 0 "[ . 1 . 2]" 1 1750 1 44 GLN HG2 1 44 GLN HG3 1.532 . 1.826 1.706 1.685 1.722 . 0 0 "[ . 1 . 2]" 1 1751 1 42 GLN HA 1 44 GLN HG2 3.086 . 4.276 3.662 3.028 4.040 . 0 0 "[ . 1 . 2]" 1 1752 1 55 HIS HB2 1 56 GLU QG 3.086 . 4.276 3.342 3.026 3.559 . 0 0 "[ . 1 . 2]" 1 1753 1 18 TYR HB2 1 21 GLN QB 3.086 . 4.276 4.081 3.925 4.251 . 0 0 "[ . 1 . 2]" 1 1754 1 18 TYR HB3 1 21 GLN QB 3.086 . 4.276 4.409 4.350 4.507 0.231 5 0 "[ . 1 . 2]" 1 1755 1 19 LYS HA 1 22 ARG QD 3.086 . 4.276 3.131 2.256 4.048 . 0 0 "[ . 1 . 2]" 1 1756 1 10 LYS HA 1 10 LYS HG3 3.086 . 4.276 2.411 2.099 3.093 . 0 0 "[ . 1 . 2]" 1 1757 1 38 LEU HA 1 41 LEU HG 3.086 . 4.276 2.880 2.835 2.949 . 0 0 "[ . 1 . 2]" 1 1758 1 24 LEU HA 1 24 LEU HG 3.086 . 4.276 2.389 2.313 2.641 . 0 0 "[ . 1 . 2]" 1 1759 1 16 LEU HG 1 17 SER QB 3.086 . 4.276 4.999 4.165 5.206 0.930 13 17 "[****.-******+ **** *]" 1 1760 1 35 GLU HA 1 72 LEU HG 3.086 . 4.276 4.176 2.793 4.349 0.073 4 0 "[ . 1 . 2]" 1 1761 1 29 GLN HA 1 29 GLN HB2 3.086 . 4.276 2.523 2.320 2.696 . 0 0 "[ . 1 . 2]" 1 1762 1 10 LYS HA 1 10 LYS QD 3.086 . 4.276 2.955 1.814 3.864 0.082 15 0 "[ . 1 . 2]" 1 1763 1 53 GLN HB3 1 57 GLN HA 3.086 . 5.000 4.641 4.447 4.949 . 0 0 "[ . 1 . 2]" 1 1764 1 25 GLU HA 1 25 GLU HB3 3.086 . 4.276 2.069 2.043 2.124 . 0 0 "[ . 1 . 2]" 1 1765 1 23 GLU HA 1 23 GLU QB 3.086 . 4.276 2.193 2.160 2.222 . 0 0 "[ . 1 . 2]" 1 1766 1 73 GLU HA 1 73 GLU QB 3.086 . 4.276 2.050 1.997 2.119 . 0 0 "[ . 1 . 2]" 1 1767 1 73 GLU HA 1 73 GLU QB 3.086 . 4.276 2.119 2.046 2.191 . 0 0 "[ . 1 . 2]" 1 1768 1 24 LEU HA 1 27 LEU HG 3.086 . 4.276 4.218 3.367 4.393 0.117 4 0 "[ . 1 . 2]" 1 1769 1 17 SER QB 1 19 LYS QD 3.086 . 4.276 2.998 1.972 3.411 . 0 0 "[ . 1 . 2]" 1 1770 1 17 SER QB 1 19 LYS QD 3.086 . 4.276 2.721 1.958 2.979 . 0 0 "[ . 1 . 2]" 1 1771 1 22 ARG HA 1 25 GLU HB2 3.086 . 4.276 2.340 2.175 2.628 . 0 0 "[ . 1 . 2]" 1 1772 1 77 GLU HA 1 80 GLU HB2 3.086 . 4.276 2.900 2.315 3.486 . 0 0 "[ . 1 . 2]" 1 1773 1 38 LEU HA 1 65 MET HG3 3.086 . 4.276 3.722 3.548 4.149 . 0 0 "[ . 1 . 2]" 1 1774 1 38 LEU HA 1 65 MET HG2 3.086 . 4.276 4.278 3.915 4.350 0.074 18 0 "[ . 1 . 2]" 1 1775 1 37 LYS QB 1 68 ALA HA 3.086 . 4.276 3.301 2.902 4.140 . 0 0 "[ . 1 . 2]" 1 1776 1 10 LYS HA 1 10 LYS HB2 3.086 . 4.276 2.343 2.166 2.690 . 0 0 "[ . 1 . 2]" 1 1777 1 53 GLN HA 1 57 GLN HG3 3.086 . 4.276 4.195 3.945 4.354 0.078 14 0 "[ . 1 . 2]" 1 1778 1 53 GLN HA 1 57 GLN HG2 3.086 . 4.276 4.098 3.832 4.299 0.023 18 0 "[ . 1 . 2]" 1 1779 1 67 ALA HA 1 70 GLN HG3 3.086 . 4.276 3.128 2.895 3.435 . 0 0 "[ . 1 . 2]" 1 1780 1 29 GLN HA 1 29 GLN QG 3.086 . 4.276 2.544 2.073 2.992 . 0 0 "[ . 1 . 2]" 1 1781 1 50 PHE HA 1 53 GLN QG 3.086 . 4.276 2.341 1.851 2.878 0.045 17 0 "[ . 1 . 2]" 1 1782 1 23 GLU HA 1 26 GLN QG 3.086 . 4.276 3.128 2.410 3.641 . 0 0 "[ . 1 . 2]" 1 1783 1 20 LEU HA 1 23 GLU HG3 3.086 . 4.276 4.132 3.938 4.316 0.040 18 0 "[ . 1 . 2]" 1 1784 1 70 GLN HA 1 73 GLU HG2 3.086 . 4.276 2.427 1.982 2.734 . 0 0 "[ . 1 . 2]" 1 1785 1 69 GLU HA 1 73 GLU HG2 3.086 . 4.276 4.341 4.263 4.426 0.150 11 0 "[ . 1 . 2]" 1 1786 1 70 GLN HA 1 73 GLU HG3 3.086 . 4.276 2.524 2.229 2.942 . 0 0 "[ . 1 . 2]" 1 1787 1 29 GLN HA 1 32 GLU HG3 3.086 . 4.276 2.916 2.738 3.107 . 0 0 "[ . 1 . 2]" 1 1788 1 22 ARG HA 1 25 GLU HG3 3.086 . 4.276 2.786 2.211 3.146 . 0 0 "[ . 1 . 2]" 1 1789 1 74 GLN HA 1 77 GLU QG 3.086 . 4.276 2.327 1.955 2.602 . 0 0 "[ . 1 . 2]" 1 1790 1 22 ARG HA 1 25 GLU HG2 3.086 . 4.276 2.612 2.027 3.289 . 0 0 "[ . 1 . 2]" 1 1791 1 35 GLU HA 1 35 GLU QG 3.086 . 4.276 2.406 2.293 2.732 . 0 0 "[ . 1 . 2]" 1 1792 1 35 GLU HA 1 35 GLU QG 3.086 . 4.276 2.286 2.151 2.497 . 0 0 "[ . 1 . 2]" 1 1793 1 77 GLU HA 1 80 GLU HG2 3.086 . 5.000 4.703 4.055 5.075 0.075 8 0 "[ . 1 . 2]" 1 1794 1 78 ARG HA 1 81 TYR HB2 3.086 . 4.276 2.901 2.858 2.928 . 0 0 "[ . 1 . 2]" 1 1795 1 73 GLU HA 1 76 PHE QB 3.086 . 4.276 2.126 1.860 2.340 0.036 15 0 "[ . 1 . 2]" 1 1796 1 35 GLU HA 1 38 LEU HB2 3.086 . 4.276 3.154 2.960 3.318 . 0 0 "[ . 1 . 2]" 1 1797 1 20 LEU HA 1 20 LEU HB3 3.086 . 4.276 2.183 2.029 2.255 . 0 0 "[ . 1 . 2]" 1 1798 1 35 GLU HA 1 72 LEU HB3 3.086 . 4.276 2.531 2.103 2.889 . 0 0 "[ . 1 . 2]" 1 1799 1 21 GLN HA 1 24 LEU HB3 3.086 . 4.276 3.706 3.346 4.133 . 0 0 "[ . 1 . 2]" 1 1800 1 28 PRO HA 1 30 LEU HB3 3.086 . 5.000 4.669 4.563 4.746 . 0 0 "[ . 1 . 2]" 1 1801 1 38 LEU HA 1 41 LEU HB2 3.086 . 4.276 2.556 2.470 2.653 . 0 0 "[ . 1 . 2]" 1 1802 1 34 LEU HA 1 34 LEU HB3 3.086 . 4.276 2.367 2.321 2.394 . 0 0 "[ . 1 . 2]" 1 1803 1 19 LYS HG2 1 20 LEU QD 3.086 . 4.276 2.090 1.933 2.234 . 0 0 "[ . 1 . 2]" 1 1804 1 16 LEU QB 1 20 LEU QD 3.086 . 4.276 3.071 1.878 3.748 0.018 11 0 "[ . 1 . 2]" 1 1805 1 62 LEU MD2 1 62 LEU HG 3.086 . 4.276 1.883 1.862 1.916 0.034 20 0 "[ . 1 . 2]" 1 1806 1 24 LEU QD 1 82 LEU HB2 3.086 . 4.276 2.385 1.826 2.537 0.070 19 0 "[ . 1 . 2]" 1 1807 1 61 VAL HB 1 62 LEU MD2 3.086 . 4.276 3.829 3.673 3.951 . 0 0 "[ . 1 . 2]" 1 1808 1 45 VAL QG 1 62 LEU MD2 3.086 . 4.276 1.962 1.864 2.106 0.032 7 0 "[ . 1 . 2]" 1 1809 1 16 LEU QB 1 20 LEU QD 3.086 . 4.276 2.138 1.784 2.329 0.112 11 0 "[ . 1 . 2]" 1 1810 1 19 LYS HG3 1 20 LEU QD 3.086 . 4.276 1.888 1.708 2.230 0.188 18 0 "[ . 1 . 2]" 1 1811 1 34 LEU QD 1 71 GLU HG3 3.086 . 4.276 2.089 1.841 3.050 0.055 9 0 "[ . 1 . 2]" 1 1812 1 20 LEU QD 1 20 LEU HG 3.086 . 4.276 1.827 1.811 1.842 0.085 6 0 "[ . 1 . 2]" 1 1813 1 24 LEU QD 1 28 PRO HG3 3.086 . 4.276 2.875 2.413 3.401 . 0 0 "[ . 1 . 2]" 1 1814 1 26 GLN HB3 1 30 LEU MD1 3.086 . 4.276 3.963 3.602 4.320 0.044 19 0 "[ . 1 . 2]" 1 1815 1 15 LYS QG 1 16 LEU QD 3.086 . 4.276 2.265 1.877 2.512 0.019 1 0 "[ . 1 . 2]" 1 1816 1 16 LEU QD 1 20 LEU HB2 3.086 . 4.276 2.148 1.786 2.865 0.110 4 0 "[ . 1 . 2]" 1 1817 1 16 LEU QD 1 21 GLN QB 3.086 . 4.276 3.227 2.856 3.640 . 0 0 "[ . 1 . 2]" 1 1818 1 24 LEU MD1 1 24 LEU MD2 1.532 . 1.826 1.847 1.839 1.852 0.026 19 0 "[ . 1 . 2]" 1 1819 1 27 LEU QD 1 30 LEU HG 3.086 . 4.276 3.356 3.232 3.423 . 0 0 "[ . 1 . 2]" 1 1820 1 27 LEU QD 1 30 LEU HB2 3.086 . 4.276 2.415 1.883 3.326 0.013 11 0 "[ . 1 . 2]" 1 1821 1 72 LEU HB2 1 72 LEU QD 3.086 . 4.276 2.113 2.086 2.320 . 0 0 "[ . 1 . 2]" 1 1822 1 34 LEU HB3 1 72 LEU QD 3.086 . 4.276 2.207 2.161 2.243 . 0 0 "[ . 1 . 2]" 1 1823 1 35 GLU QG 1 72 LEU QD 3.086 . 4.276 2.584 2.141 3.293 . 0 0 "[ . 1 . 2]" 1 1824 1 38 LEU MD2 1 65 MET HG2 3.086 . 4.276 2.290 1.900 2.508 . 0 0 "[ . 1 . 2]" 1 1825 1 27 LEU QB 1 27 LEU QD 3.086 . 4.276 1.735 1.703 1.783 0.193 10 0 "[ . 1 . 2]" 1 1826 1 38 LEU MD2 1 38 LEU HG 3.086 . 4.276 1.979 1.902 2.047 . 0 0 "[ . 1 . 2]" 1 1827 1 38 LEU HB3 1 38 LEU MD2 3.086 . 4.276 2.725 2.630 2.813 . 0 0 "[ . 1 . 2]" 1 1828 1 16 LEU QB 1 20 LEU QD 3.086 . 4.276 2.898 1.876 3.430 0.020 11 0 "[ . 1 . 2]" 1 1829 1 20 LEU QD 1 23 GLU HG2 3.086 . 4.276 3.692 2.921 4.094 . 0 0 "[ . 1 . 2]" 1 1830 1 23 GLU HG2 1 27 LEU QD 3.086 . 4.276 2.921 2.284 3.432 . 0 0 "[ . 1 . 2]" 1 1831 1 34 LEU HB3 1 34 LEU QD 3.086 . 4.276 1.938 1.925 1.957 . 0 0 "[ . 1 . 2]" 1 1832 1 16 LEU QD 1 20 LEU HB2 3.086 . 4.276 1.880 1.702 2.091 0.194 4 0 "[ . 1 . 2]" 1 1833 1 45 VAL QG 1 62 LEU MD1 3.086 . 4.276 3.692 3.550 3.845 . 0 0 "[ . 1 . 2]" 1 1834 1 24 LEU HB2 1 27 LEU QD 3.086 . 4.276 3.267 3.153 3.331 . 0 0 "[ . 1 . 2]" 1 1835 1 30 LEU HB3 1 72 LEU QD 3.086 . 5.000 3.350 3.086 4.192 . 0 0 "[ . 1 . 2]" 1 1836 1 16 LEU QD 1 20 LEU QD 3.086 . 4.276 1.739 1.675 1.837 0.221 19 0 "[ . 1 . 2]" 1 1837 1 38 LEU MD1 1 38 LEU HG 3.086 . 4.276 1.894 1.880 1.978 0.016 16 0 "[ . 1 . 2]" 1 1838 1 35 GLU QG 1 72 LEU QD 3.086 . 4.276 2.566 2.137 3.218 . 0 0 "[ . 1 . 2]" 1 1839 1 16 LEU QD 1 16 LEU HG 3.086 . 4.276 1.721 1.670 1.745 0.226 15 0 "[ . 1 . 2]" 1 1840 1 30 LEU MD2 1 34 LEU MD1 3.086 . 4.276 1.964 1.936 1.992 . 0 0 "[ . 1 . 2]" 1 1841 1 5 LYS QD 1 5 LYS QG 1.532 . 1.826 1.756 1.715 1.792 . 0 0 "[ . 1 . 2]" 1 1842 1 33 ASP HB3 1 34 LEU QD 3.086 . 4.276 3.022 2.898 3.089 . 0 0 "[ . 1 . 2]" 1 1843 1 20 LEU QD 1 21 GLN QB 3.086 . 4.276 3.317 2.516 3.767 . 0 0 "[ . 1 . 2]" 1 1844 1 23 GLU HG3 1 27 LEU QD 3.086 . 4.276 2.111 1.868 2.533 0.028 13 0 "[ . 1 . 2]" 1 1845 1 35 GLU QG 1 72 LEU QD 3.086 . 4.276 2.607 2.147 3.352 . 0 0 "[ . 1 . 2]" 1 1846 1 38 LEU MD2 1 42 GLN HG3 3.086 . 4.276 2.108 2.022 2.284 . 0 0 "[ . 1 . 2]" 1 1847 1 63 ALA HA 1 65 MET ME 3.086 . 4.276 4.045 3.849 4.337 0.061 14 0 "[ . 1 . 2]" 1 1848 1 34 LEU QD 1 35 GLU HA 3.086 . 4.276 3.513 3.458 3.593 . 0 0 "[ . 1 . 2]" 1 1849 1 17 SER QB 1 20 LEU QD 3.086 . 4.276 1.936 1.439 2.350 0.457 3 0 "[ . 1 . 2]" 1 1850 1 24 LEU HA 1 24 LEU QD 3.086 . 4.276 1.989 1.872 2.043 0.024 15 0 "[ . 1 . 2]" 1 1851 1 24 LEU QD 1 83 GLU HA 3.086 . 4.276 2.363 2.089 2.568 . 0 0 "[ . 1 . 2]" 1 1852 1 27 LEU QD 1 28 PRO HA 3.086 . 4.276 3.104 3.013 3.339 . 0 0 "[ . 1 . 2]" 1 1853 1 38 LEU MD2 1 65 MET HA 3.086 . 4.276 2.969 2.842 3.079 . 0 0 "[ . 1 . 2]" 1 1854 1 24 LEU HA 1 27 LEU QD 3.086 . 4.276 1.910 1.837 1.986 0.059 6 0 "[ . 1 . 2]" 1 1855 1 34 LEU QD 1 72 LEU HA 3.086 . 4.276 1.995 1.886 2.084 0.010 15 0 "[ . 1 . 2]" 1 1856 1 24 LEU HA 1 82 LEU MD1 3.086 . 4.276 2.294 2.148 2.489 . 0 0 "[ . 1 . 2]" 1 1857 1 24 LEU HA 1 24 LEU QD 3.086 . 4.276 2.517 2.117 2.753 . 0 0 "[ . 1 . 2]" 1 1858 1 21 GLN HA 1 24 LEU QD 3.086 . 4.276 2.781 2.202 3.463 . 0 0 "[ . 1 . 2]" 1 1859 1 27 LEU HA 1 27 LEU QD 3.086 . 4.276 2.388 2.114 2.504 . 0 0 "[ . 1 . 2]" 1 1860 1 38 LEU HA 1 38 LEU MD1 3.086 . 4.276 2.644 2.534 2.774 . 0 0 "[ . 1 . 2]" 1 1861 1 36 ALA HA 1 38 LEU MD1 3.086 . 5.000 4.416 4.347 4.518 . 0 0 "[ . 1 . 2]" 1 1862 1 19 LYS HA 1 20 LEU QD 3.086 . 4.276 3.830 3.678 3.939 . 0 0 "[ . 1 . 2]" 1 1863 1 79 TRP HB2 1 82 LEU MD1 3.086 . 4.276 3.992 3.802 4.204 . 0 0 "[ . 1 . 2]" 1 1864 1 34 LEU HA 1 34 LEU HB2 3.086 . 4.276 2.578 2.425 2.657 . 0 0 "[ . 1 . 2]" 1 1865 1 34 LEU HB2 1 34 LEU QD 3.086 . 4.276 1.795 1.760 1.916 0.136 20 0 "[ . 1 . 2]" 1 1866 1 17 SER QB 1 20 LEU QD 3.086 . 4.276 1.905 1.435 2.260 0.461 3 0 "[ . 1 . 2]" 1 1867 1 30 LEU HB3 1 30 LEU MD1 3.086 . 4.276 2.830 2.821 2.835 . 0 0 "[ . 1 . 2]" 1 1868 1 20 LEU HB3 1 20 LEU QD 3.086 . 4.276 2.026 1.985 2.103 . 0 0 "[ . 1 . 2]" 1 1869 1 38 LEU HG 1 42 GLN HG3 3.086 . 4.276 3.682 3.348 3.781 . 0 0 "[ . 1 . 2]" 1 1870 1 38 LEU HB3 1 38 LEU MD2 3.086 . 4.276 2.836 2.832 2.840 . 0 0 "[ . 1 . 2]" 1 1871 1 20 LEU QD 1 85 LEU MD2 3.086 . 4.276 1.872 1.781 2.044 0.115 7 0 "[ . 1 . 2]" 1 1872 1 20 LEU QD 1 85 LEU MD1 3.086 . 4.276 3.689 3.567 3.789 . 0 0 "[ . 1 . 2]" 1 1873 1 16 LEU QB 1 85 LEU HG 3.086 . 4.276 2.957 2.706 2.995 . 0 0 "[ . 1 . 2]" 1 1874 1 24 LEU HA 1 82 LEU HB3 3.086 . 4.276 3.843 3.713 4.090 . 0 0 "[ . 1 . 2]" 1 1875 1 82 LEU HB3 1 82 LEU QD 3.086 . 4.276 2.131 2.103 2.148 . 0 0 "[ . 1 . 2]" 1 1876 1 34 LEU HA 1 37 LYS QB 3.086 . 4.276 1.895 1.838 1.943 0.058 6 0 "[ . 1 . 2]" 1 1877 1 58 THR HA 1 61 VAL HB 3.086 . 4.276 2.693 2.631 2.731 . 0 0 "[ . 1 . 2]" 1 1878 1 78 ARG HB3 1 82 LEU QD 3.086 . 4.276 3.950 2.516 4.326 0.050 11 0 "[ . 1 . 2]" 1 1879 1 87 ASN HB3 1 88 GLY QA 3.086 . 4.276 3.923 3.753 4.201 . 0 0 "[ . 1 . 2]" 1 1880 1 62 LEU HB3 1 65 MET HB2 3.086 . 4.276 4.249 4.074 4.308 0.032 11 0 "[ . 1 . 2]" 1 1881 1 45 VAL QG 1 50 PHE HB3 3.086 . 4.276 3.873 3.715 3.962 . 0 0 "[ . 1 . 2]" 1 1882 1 31 LEU HA 1 76 PHE QB 3.086 . 4.276 3.962 3.923 3.982 . 0 0 "[ . 1 . 2]" 1 1883 1 81 TYR QB 1 84 ALA MB 3.086 . 4.276 4.210 3.913 4.328 0.052 5 0 "[ . 1 . 2]" 1 1884 1 82 LEU HA 1 84 ALA MB 3.086 . 4.276 4.323 4.190 4.456 0.180 18 0 "[ . 1 . 2]" 1 1885 1 18 TYR HB3 1 19 LYS HA 3.086 . 4.276 3.110 2.249 3.991 . 0 0 "[ . 1 . 2]" 1 1886 1 20 LEU QD 1 21 GLN HA 3.086 . 4.276 3.647 3.452 3.853 . 0 0 "[ . 1 . 2]" 1 1887 1 37 LYS QE 1 37 LYS HG2 3.086 . 4.276 2.148 2.022 2.517 . 0 0 "[ . 1 . 2]" 1 1888 1 60 LYS HA 1 60 LYS QE 3.086 . 4.276 4.125 3.865 4.444 0.168 3 0 "[ . 1 . 2]" 1 1889 1 15 LYS QG 1 16 LEU QD 3.086 . 4.276 3.722 2.111 4.205 . 0 0 "[ . 1 . 2]" 1 1890 1 60 LYS QB 1 60 LYS QE 3.086 . 4.276 3.636 3.514 3.773 . 0 0 "[ . 1 . 2]" 1 1891 1 79 TRP HA 1 80 GLU HA 3.086 . 4.276 4.244 4.215 4.271 . 0 0 "[ . 1 . 2]" 1 1892 1 30 LEU MD1 1 71 GLU HG3 3.086 . 4.276 3.702 3.426 3.921 . 0 0 "[ . 1 . 2]" 1 1893 1 45 VAL MG1 1 51 PHE QE 2.250 . 2.883 2.238 2.079 2.418 . 0 0 "[ . 1 . 2]" 1 1894 1 45 VAL MG2 1 51 PHE QE 2.612 . 4.550 4.001 3.876 4.144 . 0 0 "[ . 1 . 2]" 1 1895 1 27 LEU QD 1 76 PHE QR 2.637 . 4.550 4.026 3.948 4.199 . 0 0 "[ . 1 . 2]" 1 1896 1 18 TYR HA 1 18 TYR QD 2.398 . 3.117 2.535 2.407 2.611 . 0 0 "[ . 1 . 2]" 1 1897 1 51 PHE QR 1 58 THR HB 2.828 . 3.828 3.548 3.181 3.791 . 0 0 "[ . 1 . 2]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 40 _Distance_constraint_stats_list.Viol_count 221 _Distance_constraint_stats_list.Viol_total 161.590 _Distance_constraint_stats_list.Viol_max 0.123 _Distance_constraint_stats_list.Viol_rms 0.0216 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0101 _Distance_constraint_stats_list.Viol_average_violations_only 0.0366 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details . loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 27 LEU 1.412 0.123 6 0 "[ . 1 . 2]" 1 28 PRO 0.049 0.020 14 0 "[ . 1 . 2]" 1 30 LEU 0.480 0.059 11 0 "[ . 1 . 2]" 1 31 LEU 2.294 0.123 6 0 "[ . 1 . 2]" 1 32 GLU 0.058 0.020 14 0 "[ . 1 . 2]" 1 33 ASP 1.465 0.120 6 0 "[ . 1 . 2]" 1 34 LEU 1.715 0.077 15 0 "[ . 1 . 2]" 1 35 GLU 1.098 0.077 4 0 "[ . 1 . 2]" 1 36 ALA 0.009 0.009 10 0 "[ . 1 . 2]" 1 37 LYS 1.465 0.120 6 0 "[ . 1 . 2]" 1 38 LEU 1.235 0.077 15 0 "[ . 1 . 2]" 1 39 GLU 0.216 0.062 4 0 "[ . 1 . 2]" 1 41 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 59 GLN 0.423 0.050 19 0 "[ . 1 . 2]" 1 63 ALA 0.423 0.050 19 0 "[ . 1 . 2]" 1 64 ASP 0.139 0.037 7 0 "[ . 1 . 2]" 1 65 MET 0.046 0.028 5 0 "[ . 1 . 2]" 1 66 ALA 0.044 0.031 15 0 "[ . 1 . 2]" 1 67 ALA 0.115 0.035 5 0 "[ . 1 . 2]" 1 68 ALA 0.196 0.037 7 0 "[ . 1 . 2]" 1 69 GLU 0.183 0.048 11 0 "[ . 1 . 2]" 1 70 GLN 0.214 0.075 20 0 "[ . 1 . 2]" 1 71 GLU 0.488 0.102 2 0 "[ . 1 . 2]" 1 72 LEU 0.056 0.016 20 0 "[ . 1 . 2]" 1 73 GLU 0.309 0.056 12 0 "[ . 1 . 2]" 1 74 GLN 0.170 0.075 20 0 "[ . 1 . 2]" 1 75 ALA 1.029 0.102 2 0 "[ . 1 . 2]" 1 77 GLU 0.173 0.056 12 0 "[ . 1 . 2]" 1 79 TRP 0.657 0.072 2 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 27 LEU O 1 31 LEU H 1.800 . 2.300 1.852 1.792 1.934 0.008 6 0 "[ . 1 . 2]" 2 2 1 27 LEU O 1 31 LEU N 2.800 2.800 3.300 2.730 2.677 2.764 0.123 6 0 "[ . 1 . 2]" 2 3 1 28 PRO O 1 32 GLU H 1.800 . 2.300 2.147 1.941 2.320 0.020 14 0 "[ . 1 . 2]" 2 4 1 28 PRO O 1 32 GLU N 2.800 2.800 3.300 3.120 2.924 3.294 . 0 0 "[ . 1 . 2]" 2 5 1 30 LEU O 1 34 LEU H 1.800 . 2.300 1.821 1.778 1.859 0.022 15 0 "[ . 1 . 2]" 2 6 1 30 LEU O 1 34 LEU N 2.800 2.800 3.300 2.782 2.741 2.827 0.059 11 0 "[ . 1 . 2]" 2 7 1 31 LEU O 1 35 GLU H 1.800 . 2.300 1.834 1.795 1.887 0.005 14 0 "[ . 1 . 2]" 2 8 1 31 LEU O 1 35 GLU N 2.800 2.800 3.300 2.757 2.723 2.811 0.077 4 0 "[ . 1 . 2]" 2 9 1 32 GLU O 1 36 ALA H 1.800 . 2.300 2.068 1.871 2.309 0.009 10 0 "[ . 1 . 2]" 2 10 1 32 GLU O 1 36 ALA N 2.800 2.800 3.300 3.013 2.815 3.230 . 0 0 "[ . 1 . 2]" 2 11 1 33 ASP O 1 37 LYS H 1.800 . 2.300 1.951 1.885 2.097 . 0 0 "[ . 1 . 2]" 2 12 1 33 ASP O 1 37 LYS N 2.800 2.800 3.300 2.727 2.680 2.763 0.120 6 0 "[ . 1 . 2]" 2 13 1 34 LEU O 1 38 LEU H 1.800 . 2.300 1.803 1.772 1.846 0.028 13 0 "[ . 1 . 2]" 2 14 1 34 LEU O 1 38 LEU N 2.800 2.800 3.300 2.746 2.723 2.776 0.077 15 0 "[ . 1 . 2]" 2 15 1 35 GLU O 1 39 GLU H 1.800 . 2.300 1.845 1.774 1.947 0.026 4 0 "[ . 1 . 2]" 2 16 1 35 GLU O 1 39 GLU N 2.800 2.800 3.300 2.822 2.738 2.931 0.062 4 0 "[ . 1 . 2]" 2 17 1 37 LYS O 1 41 LEU H 1.800 . 2.300 1.983 1.893 2.187 . 0 0 "[ . 1 . 2]" 2 18 1 37 LYS O 1 41 LEU N 2.800 2.800 3.300 2.892 2.809 3.004 . 0 0 "[ . 1 . 2]" 2 19 1 59 GLN O 1 63 ALA H 1.800 . 2.300 1.873 1.801 2.093 . 0 0 "[ . 1 . 2]" 2 20 1 59 GLN O 1 63 ALA N 2.800 2.800 3.300 2.795 2.750 3.004 0.050 19 0 "[ . 1 . 2]" 2 21 1 64 ASP O 1 68 ALA H 1.800 . 2.300 2.062 1.930 2.243 . 0 0 "[ . 1 . 2]" 2 22 1 64 ASP O 1 68 ALA N 2.800 2.800 3.300 2.841 2.763 2.997 0.037 7 0 "[ . 1 . 2]" 2 23 1 65 MET O 1 69 GLU H 1.800 . 2.300 2.184 1.901 2.328 0.028 5 0 "[ . 1 . 2]" 2 24 1 65 MET O 1 69 GLU N 2.800 2.800 3.300 3.144 2.844 3.284 . 0 0 "[ . 1 . 2]" 2 25 1 66 ALA O 1 70 GLN H 1.800 . 2.300 2.154 1.961 2.331 0.031 15 0 "[ . 1 . 2]" 2 26 1 66 ALA O 1 70 GLN N 2.800 2.800 3.300 3.094 2.885 3.263 . 0 0 "[ . 1 . 2]" 2 27 1 67 ALA O 1 71 GLU H 1.800 . 2.300 2.053 1.806 2.327 0.027 11 0 "[ . 1 . 2]" 2 28 1 67 ALA O 1 71 GLU N 2.800 2.800 3.300 2.948 2.765 3.179 0.035 5 0 "[ . 1 . 2]" 2 29 1 68 ALA O 1 72 LEU H 1.800 . 2.300 1.906 1.837 1.994 . 0 0 "[ . 1 . 2]" 2 30 1 68 ALA O 1 72 LEU N 2.800 2.800 3.300 2.821 2.784 2.889 0.016 20 0 "[ . 1 . 2]" 2 31 1 69 GLU O 1 73 GLU H 1.800 . 2.300 2.119 1.815 2.348 0.048 11 0 "[ . 1 . 2]" 2 32 1 69 GLU O 1 73 GLU N 2.800 2.800 3.300 3.078 2.782 3.313 0.018 20 0 "[ . 1 . 2]" 2 33 1 70 GLN O 1 74 GLN H 1.800 . 2.300 2.193 1.839 2.375 0.075 20 0 "[ . 1 . 2]" 2 34 1 70 GLN O 1 74 GLN N 2.800 2.800 3.300 3.142 2.795 3.325 0.025 20 0 "[ . 1 . 2]" 2 35 1 71 GLU O 1 75 ALA H 1.800 . 2.300 1.915 1.763 2.091 0.037 2 0 "[ . 1 . 2]" 2 36 1 71 GLU O 1 75 ALA N 2.800 2.800 3.300 2.839 2.698 2.997 0.102 2 0 "[ . 1 . 2]" 2 37 1 73 GLU O 1 77 GLU H 1.800 . 2.300 1.918 1.789 2.171 0.011 12 0 "[ . 1 . 2]" 2 38 1 73 GLU O 1 77 GLU N 2.800 2.800 3.300 2.879 2.744 3.132 0.056 12 0 "[ . 1 . 2]" 2 39 1 75 ALA O 1 79 TRP H 1.800 . 2.300 1.865 1.823 1.921 . 0 0 "[ . 1 . 2]" 2 40 1 75 ALA O 1 79 TRP N 2.800 2.800 3.300 2.768 2.728 2.823 0.072 2 0 "[ . 1 . 2]" 2 stop_ save_
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