NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | in_dress | stage | program | type | subtype | subsubtype |
470696 | 1aoy | cing | recoord | dress | 4-filtered-FRED | Wattos | check | violation | distance |
data_1aoy 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 1805 _Distance_constraint_stats_list.Viol_count 2104 _Distance_constraint_stats_list.Viol_total 4856.569 _Distance_constraint_stats_list.Viol_max 0.873 _Distance_constraint_stats_list.Viol_rms 0.0331 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0051 _Distance_constraint_stats_list.Viol_average_violations_only 0.1004 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 1 MET 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 2 ARG 2.824 0.375 12 0 "[ . 1 . 2 ]" 1 3 SER 2.814 0.375 12 0 "[ . 1 . 2 ]" 1 4 SER 2.313 0.262 12 0 "[ . 1 . 2 ]" 1 5 ALA 2.648 0.262 12 0 "[ . 1 . 2 ]" 1 6 LYS 5.716 0.446 3 0 "[ . 1 . 2 ]" 1 7 GLN 8.465 0.427 19 0 "[ . 1 . 2 ]" 1 8 GLU 2.011 0.274 8 0 "[ . 1 . 2 ]" 1 9 GLU 12.517 0.427 19 0 "[ . 1 . 2 ]" 1 10 LEU 1.410 0.133 11 0 "[ . 1 . 2 ]" 1 11 VAL 6.528 0.344 16 0 "[ . 1 . 2 ]" 1 12 LYS 6.939 0.390 12 0 "[ . 1 . 2 ]" 1 13 ALA 2.258 0.229 1 0 "[ . 1 . 2 ]" 1 14 PHE 12.788 0.248 19 0 "[ . 1 . 2 ]" 1 15 LYS 13.909 0.374 7 0 "[ . 1 . 2 ]" 1 16 ALA 2.653 0.130 7 0 "[ . 1 . 2 ]" 1 17 LEU 3.268 0.153 8 0 "[ . 1 . 2 ]" 1 18 LEU 14.474 0.215 20 0 "[ . 1 . 2 ]" 1 19 LYS 11.907 0.351 13 0 "[ . 1 . 2 ]" 1 20 GLU 0.185 0.063 14 0 "[ . 1 . 2 ]" 1 21 GLU 7.076 0.807 4 9 "[ **+. ** **- . 2* ]" 1 22 LYS 2.919 0.646 4 1 "[ +. 1 . 2 ]" 1 23 PHE 8.439 0.873 16 4 "[ -. * 1 *+ 2 ]" 1 24 SER 0.409 0.110 18 0 "[ . 1 . 2 ]" 1 25 SER 0.583 0.133 11 0 "[ . 1 . 2 ]" 1 26 GLN 7.813 0.319 6 0 "[ . 1 . 2 ]" 1 27 GLY 0.873 0.560 6 1 "[ .+ 1 . 2 ]" 1 28 GLU 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 29 ILE 10.358 0.135 4 0 "[ . 1 . 2 ]" 1 30 VAL 2.302 0.133 10 0 "[ . 1 . 2 ]" 1 31 ALA 0.275 0.049 11 0 "[ . 1 . 2 ]" 1 32 ALA 0.312 0.046 16 0 "[ . 1 . 2 ]" 1 33 LEU 5.197 0.196 18 0 "[ . 1 . 2 ]" 1 34 GLN 1.398 0.131 16 0 "[ . 1 . 2 ]" 1 35 GLU 0.008 0.005 17 0 "[ . 1 . 2 ]" 1 36 GLN 9.861 0.873 16 3 "[ . - 1 *+ 2 ]" 1 37 GLY 1.200 0.111 8 0 "[ . 1 . 2 ]" 1 38 PHE 11.382 0.268 10 0 "[ . 1 . 2 ]" 1 39 ASP 11.608 0.452 22 0 "[ . 1 . 2 ]" 1 40 ASN 11.084 0.452 22 0 "[ . 1 . 2 ]" 1 41 ILE 3.340 0.177 6 0 "[ . 1 . 2 ]" 1 42 ASN 1.501 0.177 6 0 "[ . 1 . 2 ]" 1 43 GLN 9.377 0.560 6 2 "[ .+ 1 . - 2 ]" 1 44 SER 19.519 0.538 17 1 "[ . 1 . + 2 ]" 1 45 LYS 3.676 0.234 12 0 "[ . 1 . 2 ]" 1 46 VAL 9.857 0.291 22 0 "[ . 1 . 2 ]" 1 47 SER 6.191 0.245 19 0 "[ . 1 . 2 ]" 1 48 ARG 3.500 0.144 2 0 "[ . 1 . 2 ]" 1 49 MET 0.030 0.030 3 0 "[ . 1 . 2 ]" 1 50 LEU 8.093 0.197 4 0 "[ . 1 . 2 ]" 1 51 THR 0.966 0.076 4 0 "[ . 1 . 2 ]" 1 52 LYS 5.297 0.873 16 3 "[ . - 1 *+ 2 ]" 1 53 PHE 6.592 0.873 16 3 "[ . - 1 *+ 2 ]" 1 54 GLY 1.712 0.135 19 0 "[ . 1 . 2 ]" 1 55 ALA 0.003 0.003 11 0 "[ . 1 . 2 ]" 1 56 VAL 0.798 0.349 20 0 "[ . 1 . 2 ]" 1 57 ARG 8.321 0.771 4 4 "[ * +. 1 . - 2 *]" 1 58 THR 3.752 0.196 22 0 "[ . 1 . 2 ]" 1 59 ARG 1.348 0.248 2 0 "[ . 1 . 2 ]" 1 60 ASN 4.055 0.657 12 1 "[ . 1 + . 2 ]" 1 61 ALA 0.855 0.657 12 1 "[ . 1 + . 2 ]" 1 62 LYS 2.208 0.529 12 1 "[ . 1 + . 2 ]" 1 63 MET 1.765 0.248 2 0 "[ . 1 . 2 ]" 1 64 GLU 4.204 0.629 12 2 "[ . 1 + - 2 ]" 1 65 MET 8.455 0.771 4 4 "[ +. * 1 *- . 2 ]" 1 66 VAL 7.858 0.553 7 3 "[ . + 1 *- . 2 ]" 1 67 TYR 12.297 0.627 4 4 "[ * +. 1 . - 2 *]" 1 68 CYS 11.937 0.807 4 9 "[ **+. ** **- . 2* ]" 1 69 LEU 11.052 0.351 13 0 "[ . 1 . 2 ]" 1 70 PRO 5.677 0.617 23 1 "[ . 1 . 2 +]" 1 71 ALA 8.202 0.617 23 1 "[ . 1 . 2 +]" 1 72 GLU 3.207 0.618 23 1 "[ . 1 . 2 +]" 1 73 LEU 3.842 0.323 10 0 "[ . 1 . 2 ]" 1 74 GLY 1.379 0.116 13 0 "[ . 1 . 2 ]" 1 75 VAL 5.315 0.613 21 3 "[ . 1 . - *2+ ]" 1 76 PRO 5.063 0.613 21 3 "[ . 1 . - *2+ ]" 1 77 THR 0.267 0.080 21 0 "[ . 1 . 2 ]" 1 78 THR 0.076 0.076 1 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 1 MET HA 1 2 ARG H 6.000 . 7.000 2.517 2.136 3.595 . 0 0 "[ . 1 . 2 ]" 1 2 1 2 ARG H 1 2 ARG HB2 3.100 . 4.300 3.022 2.337 3.762 . 0 0 "[ . 1 . 2 ]" 1 3 1 2 ARG H 1 2 ARG HB3 3.800 . 5.600 3.753 2.891 4.122 . 0 0 "[ . 1 . 2 ]" 1 4 1 2 ARG H 1 2 ARG HE 4.900 . 7.000 4.422 3.741 4.848 . 0 0 "[ . 1 . 2 ]" 1 5 1 2 ARG H 1 2 ARG QG 3.900 . 5.800 3.047 2.274 4.312 . 0 0 "[ . 1 . 2 ]" 1 6 1 2 ARG H 1 4 SER H 6.000 . 7.000 5.827 3.978 7.047 0.047 17 0 "[ . 1 . 2 ]" 1 7 1 2 ARG HA 1 2 ARG QD 4.000 . 6.000 3.247 1.974 4.551 0.026 23 0 "[ . 1 . 2 ]" 1 8 1 2 ARG HA 1 2 ARG QG 2.900 . 4.000 2.748 2.121 3.339 . 0 0 "[ . 1 . 2 ]" 1 9 1 2 ARG HA 1 3 SER H 2.500 . 3.300 2.490 2.126 3.517 0.217 21 0 "[ . 1 . 2 ]" 1 10 1 2 ARG HA 1 3 SER H 2.400 . 3.100 2.253 2.013 2.813 . 0 0 "[ . 1 . 2 ]" 1 11 1 2 ARG HB2 1 3 SER H 3.100 . 4.300 4.124 1.959 4.675 0.375 12 0 "[ . 1 . 2 ]" 1 12 1 2 ARG HB3 1 3 SER H 3.800 . 5.600 3.793 1.904 4.567 0.096 22 0 "[ . 1 . 2 ]" 1 13 1 2 ARG HE 1 4 SER H 5.000 . 7.000 5.690 4.697 6.710 . 0 0 "[ . 1 . 2 ]" 1 14 1 2 ARG QG 1 3 SER H 3.900 . 5.800 4.301 2.197 4.937 . 0 0 "[ . 1 . 2 ]" 1 15 1 3 SER H 1 3 SER HB2 3.100 . 4.300 3.080 2.478 3.917 . 0 0 "[ . 1 . 2 ]" 1 16 1 3 SER H 1 3 SER QB 3.000 . 4.100 2.887 2.441 3.467 . 0 0 "[ . 1 . 2 ]" 1 17 1 3 SER H 1 3 SER HB3 3.200 . 4.500 3.730 3.152 4.081 . 0 0 "[ . 1 . 2 ]" 1 18 1 3 SER H 1 4 SER H 3.500 . 5.000 3.306 2.171 4.616 . 0 0 "[ . 1 . 2 ]" 1 19 1 3 SER HB2 1 4 SER H 3.200 . 4.500 3.649 2.218 4.600 0.100 21 0 "[ . 1 . 2 ]" 1 20 1 3 SER HB3 1 4 SER H 2.900 . 4.000 3.314 1.894 3.646 0.006 17 0 "[ . 1 . 2 ]" 1 21 1 4 SER H 1 4 SER HA 2.500 . 3.300 2.818 2.258 2.965 . 0 0 "[ . 1 . 2 ]" 1 22 1 4 SER H 1 4 SER HB2 3.000 . 4.100 2.888 2.399 3.772 . 0 0 "[ . 1 . 2 ]" 1 23 1 4 SER H 1 5 ALA H 3.100 . 4.300 3.868 2.579 4.562 0.262 12 0 "[ . 1 . 2 ]" 1 24 1 4 SER H 1 5 ALA MB 3.700 . 5.400 4.163 2.728 5.107 . 0 0 "[ . 1 . 2 ]" 1 25 1 4 SER HA 1 5 ALA H 2.400 . 3.100 2.303 2.126 2.952 . 0 0 "[ . 1 . 2 ]" 1 26 1 4 SER HA 1 6 LYS H 3.800 . 5.600 4.490 2.953 5.667 0.067 14 0 "[ . 1 . 2 ]" 1 27 1 4 SER HB2 1 5 ALA H 3.100 . 4.300 4.251 3.513 4.551 0.251 16 0 "[ . 1 . 2 ]" 1 28 1 4 SER HB3 1 5 ALA H 3.800 . 5.600 3.827 2.726 4.513 . 0 0 "[ . 1 . 2 ]" 1 29 1 5 ALA H 1 5 ALA HA 2.800 . 3.800 2.816 2.259 2.964 . 0 0 "[ . 1 . 2 ]" 1 30 1 5 ALA H 1 9 GLU HG3 3.900 . 5.800 4.759 3.306 5.898 0.098 15 0 "[ . 1 . 2 ]" 1 31 1 5 ALA HA 1 6 LYS H 2.300 . 3.000 2.424 2.015 2.825 . 0 0 "[ . 1 . 2 ]" 1 32 1 5 ALA HA 1 10 LEU H 4.600 . 7.000 6.645 5.737 7.133 0.133 11 0 "[ . 1 . 2 ]" 1 33 1 5 ALA MB 1 8 GLU H 4.900 . 7.000 4.964 2.554 6.124 . 0 0 "[ . 1 . 2 ]" 1 34 1 6 LYS H 1 6 LYS HB2 2.400 . 3.100 2.698 2.217 3.546 0.446 3 0 "[ . 1 . 2 ]" 1 35 1 6 LYS H 1 6 LYS HB3 2.800 . 3.800 3.636 3.150 4.003 0.203 9 0 "[ . 1 . 2 ]" 1 36 1 6 LYS H 1 6 LYS QD 5.000 . 7.000 3.810 1.930 5.158 . 0 0 "[ . 1 . 2 ]" 1 37 1 6 LYS H 1 6 LYS HG2 3.000 . 4.100 3.141 1.883 4.275 0.175 20 0 "[ . 1 . 2 ]" 1 38 1 6 LYS H 1 6 LYS HG3 3.500 . 5.000 3.185 2.128 4.237 . 0 0 "[ . 1 . 2 ]" 1 39 1 6 LYS H 1 7 GLN H 3.500 . 5.000 4.140 2.158 4.652 . 0 0 "[ . 1 . 2 ]" 1 40 1 6 LYS H 1 8 GLU QG 3.600 . 5.200 4.583 2.662 5.306 0.106 3 0 "[ . 1 . 2 ]" 1 41 1 6 LYS HA 1 6 LYS QE 5.400 . 7.000 4.346 2.725 5.516 . 0 0 "[ . 1 . 2 ]" 1 42 1 6 LYS HA 1 6 LYS HG2 2.800 . 3.800 2.860 2.188 3.679 . 0 0 "[ . 1 . 2 ]" 1 43 1 6 LYS HA 1 6 LYS HG3 2.700 . 3.600 3.374 2.409 3.849 0.249 7 0 "[ . 1 . 2 ]" 1 44 1 6 LYS HA 1 7 GLN H 2.400 . 3.100 2.407 2.034 3.499 0.399 23 0 "[ . 1 . 2 ]" 1 45 1 6 LYS HA 1 7 GLN H 6.000 . 7.000 1.998 1.867 2.211 . 0 0 "[ . 1 . 2 ]" 1 46 1 6 LYS HA 1 8 GLU H 3.100 . 4.300 3.932 3.269 4.385 0.085 16 0 "[ . 1 . 2 ]" 1 47 1 6 LYS HB2 1 7 GLN H 6.000 . 7.000 3.507 2.226 3.905 . 0 0 "[ . 1 . 2 ]" 1 48 1 6 LYS HB2 1 7 GLN H 6.000 . 7.000 3.384 2.221 3.767 . 0 0 "[ . 1 . 2 ]" 1 49 1 6 LYS HB2 1 8 GLU H 2.300 . 3.000 2.775 2.161 3.027 0.027 12 0 "[ . 1 . 2 ]" 1 50 1 6 LYS HB3 1 6 LYS HG3 3.000 . 4.100 2.776 2.384 3.013 . 0 0 "[ . 1 . 2 ]" 1 51 1 6 LYS HB3 1 7 GLN H 2.900 . 4.000 3.309 2.169 4.344 0.344 6 0 "[ . 1 . 2 ]" 1 52 1 6 LYS HB3 1 8 GLU H 6.000 . 7.000 2.812 2.428 3.169 . 0 0 "[ . 1 . 2 ]" 1 53 1 6 LYS QD 1 7 GLN H 6.000 . 7.000 3.112 2.665 3.344 . 0 0 "[ . 1 . 2 ]" 1 54 1 6 LYS HG2 1 7 GLN H 2.900 . 4.000 3.488 3.382 3.571 . 0 0 "[ . 1 . 2 ]" 1 55 1 7 GLN H 1 7 GLN HA 2.600 . 3.400 2.686 2.202 2.946 . 0 0 "[ . 1 . 2 ]" 1 56 1 7 GLN H 1 7 GLN HB2 2.300 . 3.000 2.563 2.126 3.091 0.091 15 0 "[ . 1 . 2 ]" 1 57 1 7 GLN H 1 7 GLN QE 5.200 . 7.000 5.151 3.779 5.874 . 0 0 "[ . 1 . 2 ]" 1 58 1 7 GLN H 1 7 GLN QG 3.000 . 4.100 3.808 2.862 4.275 0.175 15 0 "[ . 1 . 2 ]" 1 59 1 7 GLN H 1 8 GLU H 2.600 . 3.400 2.759 2.244 3.225 . 0 0 "[ . 1 . 2 ]" 1 60 1 7 GLN H 1 9 GLU H 3.600 . 5.200 4.445 3.641 4.984 . 0 0 "[ . 1 . 2 ]" 1 61 1 7 GLN HA 1 7 GLN QE 3.400 . 4.800 3.385 1.962 4.432 0.038 23 0 "[ . 1 . 2 ]" 1 62 1 7 GLN HA 1 8 GLU H 2.400 . 3.100 2.662 2.528 2.753 . 0 0 "[ . 1 . 2 ]" 1 63 1 7 GLN HA 1 9 GLU H 2.700 . 3.600 2.705 2.523 2.872 . 0 0 "[ . 1 . 2 ]" 1 64 1 7 GLN HA 1 10 LEU H 3.300 . 4.700 3.256 2.859 3.540 . 0 0 "[ . 1 . 2 ]" 1 65 1 7 GLN HA 1 38 PHE QE 3.400 . 4.800 4.338 3.781 4.835 0.035 6 0 "[ . 1 . 2 ]" 1 66 1 7 GLN HA 1 10 LEU H 3.200 . 4.500 3.424 2.911 3.908 . 0 0 "[ . 1 . 2 ]" 1 67 1 7 GLN HA 1 10 LEU HB2 3.400 . 4.800 4.378 3.264 4.844 0.044 6 0 "[ . 1 . 2 ]" 1 68 1 7 GLN HA 1 10 LEU HB3 2.700 . 7.000 4.214 2.903 5.378 . 0 0 "[ . 1 . 2 ]" 1 69 1 7 GLN HA 1 10 LEU HG 6.100 . 7.000 5.147 4.457 6.155 . 0 0 "[ . 1 . 2 ]" 1 70 1 7 GLN HA 1 38 PHE QD 3.200 . 4.500 4.087 3.834 4.244 . 0 0 "[ . 1 . 2 ]" 1 71 1 7 GLN HA 1 40 ASN QD 4.400 . 6.800 5.500 3.900 6.460 . 0 0 "[ . 1 . 2 ]" 1 72 1 7 GLN HB3 1 7 GLN QE 5.000 . 7.000 4.005 2.544 4.380 . 0 0 "[ . 1 . 2 ]" 1 73 1 7 GLN HB3 1 9 GLU H 2.600 . 3.400 3.395 3.221 3.674 0.274 8 0 "[ . 1 . 2 ]" 1 74 1 7 GLN HB3 1 10 LEU H 4.100 . 6.200 4.150 3.672 4.524 . 0 0 "[ . 1 . 2 ]" 1 75 1 7 GLN HB3 1 10 LEU H 6.000 . 7.000 3.570 3.351 3.861 . 0 0 "[ . 1 . 2 ]" 1 76 1 7 GLN QE 1 7 GLN QG 2.800 . 3.800 2.204 2.120 2.410 . 0 0 "[ . 1 . 2 ]" 1 77 1 7 GLN QE 1 10 LEU H 4.900 . 7.000 4.104 3.444 4.538 . 0 0 "[ . 1 . 2 ]" 1 78 1 7 GLN QE 1 10 LEU HB3 4.200 . 6.400 3.719 2.820 4.731 . 0 0 "[ . 1 . 2 ]" 1 79 1 7 GLN QE 1 10 LEU QD 4.700 . 7.000 2.880 1.984 4.212 . 0 0 "[ . 1 . 2 ]" 1 80 1 7 GLN QE 1 10 LEU HG 3.300 . 4.700 3.811 3.416 3.993 . 0 0 "[ . 1 . 2 ]" 1 81 1 7 GLN QE 1 38 PHE QB 3.800 . 5.600 3.976 2.922 4.504 . 0 0 "[ . 1 . 2 ]" 1 82 1 7 GLN QE 1 38 PHE HA 3.800 . 5.600 4.669 2.719 5.389 . 0 0 "[ . 1 . 2 ]" 1 83 1 7 GLN QE 1 39 ASP H 4.200 . 6.400 4.711 3.197 5.987 . 0 0 "[ . 1 . 2 ]" 1 84 1 7 GLN QG 1 9 GLU H 2.900 . 4.000 4.201 4.061 4.427 0.427 19 0 "[ . 1 . 2 ]" 1 85 1 7 GLN QG 1 38 PHE HZ 3.100 . 7.000 6.645 5.646 7.055 0.055 8 0 "[ . 1 . 2 ]" 1 86 1 8 GLU H 1 8 GLU QB 2.400 . 3.100 2.563 2.114 2.850 . 0 0 "[ . 1 . 2 ]" 1 87 1 8 GLU H 1 8 GLU QG 2.600 . 3.400 2.300 1.790 3.491 0.091 6 0 "[ . 1 . 2 ]" 1 88 1 8 GLU H 1 9 GLU H 2.400 . 3.100 2.676 2.379 3.117 0.017 2 0 "[ . 1 . 2 ]" 1 89 1 8 GLU H 1 9 GLU HG3 2.700 . 3.600 3.296 2.655 3.589 . 0 0 "[ . 1 . 2 ]" 1 90 1 8 GLU H 1 38 PHE QE 5.200 . 7.000 5.446 5.125 5.679 . 0 0 "[ . 1 . 2 ]" 1 91 1 8 GLU HA 1 11 VAL H 3.200 . 4.500 3.494 3.035 4.161 . 0 0 "[ . 1 . 2 ]" 1 92 1 8 GLU HA 1 11 VAL QG 3.100 . 4.300 2.896 2.180 4.002 . 0 0 "[ . 1 . 2 ]" 1 93 1 8 GLU QG 1 11 VAL H 3.900 . 5.800 4.834 4.541 5.157 . 0 0 "[ . 1 . 2 ]" 1 94 1 9 GLU H 1 9 GLU HA 2.600 . 3.400 2.925 2.865 2.961 . 0 0 "[ . 1 . 2 ]" 1 95 1 9 GLU H 1 9 GLU HB2 2.300 . 3.000 2.489 2.241 2.786 . 0 0 "[ . 1 . 2 ]" 1 96 1 9 GLU H 1 10 LEU H 2.200 . 2.800 2.139 1.622 2.357 . 0 0 "[ . 1 . 2 ]" 1 97 1 9 GLU H 1 10 LEU HA 4.600 . 7.000 4.840 4.359 5.045 . 0 0 "[ . 1 . 2 ]" 1 98 1 9 GLU H 1 10 LEU HB2 3.900 . 5.800 4.595 3.840 5.035 . 0 0 "[ . 1 . 2 ]" 1 99 1 9 GLU H 1 10 LEU HB3 3.500 . 5.000 4.153 3.595 4.614 . 0 0 "[ . 1 . 2 ]" 1 100 1 9 GLU H 1 11 VAL H 2.600 . 3.400 3.544 3.123 3.744 0.344 16 0 "[ . 1 . 2 ]" 1 101 1 9 GLU H 1 11 VAL H 2.600 . 3.400 2.759 2.621 2.987 . 0 0 "[ . 1 . 2 ]" 1 102 1 9 GLU H 1 12 LYS H 3.800 . 5.600 4.696 4.436 5.000 . 0 0 "[ . 1 . 2 ]" 1 103 1 9 GLU H 1 12 LYS QD 3.700 . 5.400 3.961 3.501 4.555 . 0 0 "[ . 1 . 2 ]" 1 104 1 9 GLU H 1 12 LYS QD 3.200 . 4.500 3.821 2.770 4.412 . 0 0 "[ . 1 . 2 ]" 1 105 1 9 GLU H 1 12 LYS HG2 4.400 . 6.800 5.467 4.602 5.995 . 0 0 "[ . 1 . 2 ]" 1 106 1 9 GLU H 1 14 PHE H 5.800 . 7.000 6.853 6.539 7.058 0.058 18 0 "[ . 1 . 2 ]" 1 107 1 9 GLU H 1 38 PHE QE 3.500 . 5.000 3.967 3.541 4.228 . 0 0 "[ . 1 . 2 ]" 1 108 1 9 GLU H 1 38 PHE HZ 4.700 . 7.000 5.276 4.823 5.610 . 0 0 "[ . 1 . 2 ]" 1 109 1 9 GLU HA 1 9 GLU QG 2.100 . 2.700 2.509 2.227 2.842 0.142 7 0 "[ . 1 . 2 ]" 1 110 1 9 GLU HA 1 10 LEU H 2.900 . 4.000 3.511 3.472 3.560 . 0 0 "[ . 1 . 2 ]" 1 111 1 9 GLU HA 1 11 VAL H 4.000 . 6.000 3.951 3.720 4.275 . 0 0 "[ . 1 . 2 ]" 1 112 1 9 GLU HA 1 12 LYS H 3.100 . 4.300 3.298 3.045 3.752 . 0 0 "[ . 1 . 2 ]" 1 113 1 9 GLU HA 1 12 LYS HB3 3.200 . 4.500 4.057 2.219 4.890 0.390 12 0 "[ . 1 . 2 ]" 1 114 1 9 GLU HA 1 38 PHE HZ 3.500 . 5.000 4.380 3.983 4.852 . 0 0 "[ . 1 . 2 ]" 1 115 1 9 GLU QB 1 12 LYS H 3.600 . 5.200 4.616 4.150 4.993 . 0 0 "[ . 1 . 2 ]" 1 116 1 9 GLU QB 1 13 ALA H 4.500 . 7.000 4.554 4.243 4.851 . 0 0 "[ . 1 . 2 ]" 1 117 1 9 GLU QB 1 38 PHE HZ 2.500 . 3.300 2.689 2.215 2.907 . 0 0 "[ . 1 . 2 ]" 1 118 1 9 GLU HB2 1 10 LEU H 2.800 . 3.800 2.744 2.507 2.990 . 0 0 "[ . 1 . 2 ]" 1 119 1 9 GLU HB2 1 38 PHE HZ 4.600 . 7.000 3.573 2.876 4.085 . 0 0 "[ . 1 . 2 ]" 1 120 1 9 GLU HB3 1 13 ALA H 4.700 . 7.000 4.801 4.437 5.193 . 0 0 "[ . 1 . 2 ]" 1 121 1 9 GLU HB3 1 38 PHE QE 6.000 . 7.000 2.394 2.163 2.687 . 0 0 "[ . 1 . 2 ]" 1 122 1 9 GLU HB3 1 38 PHE HZ 2.400 . 3.100 2.814 2.254 3.123 0.023 11 0 "[ . 1 . 2 ]" 1 123 1 9 GLU QG 1 12 LYS QD 3.400 . 4.800 4.052 3.545 4.681 . 0 0 "[ . 1 . 2 ]" 1 124 1 9 GLU QG 1 38 PHE HZ 3.400 . 4.800 4.726 4.001 4.874 0.074 18 0 "[ . 1 . 2 ]" 1 125 1 10 LEU H 1 10 LEU HA 2.500 . 3.300 2.818 2.754 2.858 . 0 0 "[ . 1 . 2 ]" 1 126 1 10 LEU H 1 10 LEU HB2 2.400 . 3.100 2.619 2.240 2.879 . 0 0 "[ . 1 . 2 ]" 1 127 1 10 LEU H 1 10 LEU HB3 2.400 . 3.100 2.410 2.210 2.824 . 0 0 "[ . 1 . 2 ]" 1 128 1 10 LEU H 1 10 LEU QD 3.600 . 5.200 3.721 3.584 3.780 . 0 0 "[ . 1 . 2 ]" 1 129 1 10 LEU H 1 10 LEU QD 3.400 . 4.800 3.673 3.553 3.723 . 0 0 "[ . 1 . 2 ]" 1 130 1 10 LEU H 1 10 LEU HG 3.600 . 5.200 3.762 3.503 4.010 . 0 0 "[ . 1 . 2 ]" 1 131 1 10 LEU H 1 11 VAL H 2.500 . 3.300 2.606 2.419 2.853 . 0 0 "[ . 1 . 2 ]" 1 132 1 10 LEU H 1 12 LYS H 3.500 . 5.000 4.443 4.244 4.720 . 0 0 "[ . 1 . 2 ]" 1 133 1 10 LEU H 1 38 PHE QE 2.800 . 3.800 2.585 2.191 2.847 . 0 0 "[ . 1 . 2 ]" 1 134 1 10 LEU H 1 38 PHE QE 3.200 . 4.500 2.692 2.268 2.992 . 0 0 "[ . 1 . 2 ]" 1 135 1 10 LEU H 1 38 PHE HZ 3.800 . 5.600 4.031 3.715 4.339 . 0 0 "[ . 1 . 2 ]" 1 136 1 10 LEU HA 1 10 LEU HB2 2.200 . 2.800 2.411 2.302 2.584 . 0 0 "[ . 1 . 2 ]" 1 137 1 10 LEU HA 1 10 LEU HB3 2.600 . 3.400 3.017 2.989 3.030 . 0 0 "[ . 1 . 2 ]" 1 138 1 10 LEU HA 1 10 LEU QD . . 2.800 2.221 1.877 2.452 0.123 11 0 "[ . 1 . 2 ]" 1 139 1 10 LEU HA 1 10 LEU HG 2.600 . 3.400 3.330 3.206 3.453 0.053 21 0 "[ . 1 . 2 ]" 1 140 1 10 LEU HA 1 11 VAL H 3.000 . 4.100 3.498 3.461 3.552 . 0 0 "[ . 1 . 2 ]" 1 141 1 10 LEU HA 1 12 LYS H 5.200 . 7.000 4.851 4.500 5.218 . 0 0 "[ . 1 . 2 ]" 1 142 1 10 LEU HA 1 13 ALA H 3.000 . 4.100 3.806 3.528 4.096 . 0 0 "[ . 1 . 2 ]" 1 143 1 10 LEU HA 1 13 ALA MB 2.500 . 3.300 2.660 2.384 2.951 . 0 0 "[ . 1 . 2 ]" 1 144 1 10 LEU HA 1 14 PHE H 3.300 . 4.700 3.920 3.619 4.108 . 0 0 "[ . 1 . 2 ]" 1 145 1 10 LEU HA 1 33 LEU QD 4.200 . 6.400 3.302 3.018 3.512 . 0 0 "[ . 1 . 2 ]" 1 146 1 10 LEU HA 1 38 PHE QD 3.400 . 4.800 3.756 3.476 4.088 . 0 0 "[ . 1 . 2 ]" 1 147 1 10 LEU HA 1 38 PHE QE 2.600 . 3.400 2.857 2.465 3.079 . 0 0 "[ . 1 . 2 ]" 1 148 1 10 LEU HA 1 38 PHE HZ 2.600 . 3.400 2.944 2.620 3.266 . 0 0 "[ . 1 . 2 ]" 1 149 1 10 LEU HB2 1 10 LEU QD 2.500 . 3.300 2.145 2.052 2.607 . 0 0 "[ . 1 . 2 ]" 1 150 1 10 LEU HB2 1 11 VAL H 3.000 . 4.100 4.063 3.763 4.208 0.108 9 0 "[ . 1 . 2 ]" 1 151 1 10 LEU HB2 1 38 PHE QD 2.800 . 3.800 2.768 2.497 3.323 . 0 0 "[ . 1 . 2 ]" 1 152 1 10 LEU HB2 1 38 PHE QE 2.800 . 3.800 2.906 2.342 3.436 . 0 0 "[ . 1 . 2 ]" 1 153 1 10 LEU HB2 1 38 PHE HZ 3.500 . 5.000 4.470 4.158 4.931 . 0 0 "[ . 1 . 2 ]" 1 154 1 10 LEU HB3 1 10 LEU QD 2.300 . 3.000 2.251 2.061 2.323 . 0 0 "[ . 1 . 2 ]" 1 155 1 10 LEU HB3 1 10 LEU HG 2.800 . 3.800 2.493 2.397 2.874 . 0 0 "[ . 1 . 2 ]" 1 156 1 10 LEU HB3 1 11 VAL H 2.700 . 3.600 2.894 2.717 3.065 . 0 0 "[ . 1 . 2 ]" 1 157 1 10 LEU HB3 1 11 VAL H 6.000 . 7.000 2.755 2.445 2.968 . 0 0 "[ . 1 . 2 ]" 1 158 1 10 LEU HB3 1 38 PHE QD 3.600 . 5.200 4.351 3.869 4.975 . 0 0 "[ . 1 . 2 ]" 1 159 1 10 LEU HB3 1 38 PHE QE 5.300 . 7.000 4.037 3.653 4.407 . 0 0 "[ . 1 . 2 ]" 1 160 1 10 LEU MD1 1 10 LEU MD2 2.000 . 2.500 2.058 1.908 2.095 . 0 0 "[ . 1 . 2 ]" 1 161 1 10 LEU QD 1 10 LEU HG 2.200 . 2.800 1.881 1.863 1.891 . 0 0 "[ . 1 . 2 ]" 1 162 1 10 LEU QD 1 11 VAL H 3.800 . 5.400 3.967 3.579 4.186 . 0 0 "[ . 1 . 2 ]" 1 163 1 10 LEU QD 1 11 VAL HA 4.000 . 4.800 4.113 3.442 4.422 . 0 0 "[ . 1 . 2 ]" 1 164 1 10 LEU QD 1 13 ALA H 4.100 . 6.200 4.768 4.170 5.025 . 0 0 "[ . 1 . 2 ]" 1 165 1 10 LEU QD 1 13 ALA MB 3.100 . 4.300 3.216 2.648 3.599 . 0 0 "[ . 1 . 2 ]" 1 166 1 10 LEU QD 1 14 PHE H 3.500 . 5.000 3.700 3.071 3.985 . 0 0 "[ . 1 . 2 ]" 1 167 1 10 LEU QD 1 14 PHE HA 4.100 . 6.200 4.300 3.661 4.717 . 0 0 "[ . 1 . 2 ]" 1 168 1 10 LEU QD 1 14 PHE QB 3.500 . 4.500 3.102 2.292 3.396 . 0 0 "[ . 1 . 2 ]" 1 169 1 10 LEU QD 1 14 PHE QD 3.700 . 5.400 3.302 2.713 3.706 . 0 0 "[ . 1 . 2 ]" 1 170 1 10 LEU QD 1 14 PHE QE 5.000 . 7.000 4.668 4.177 5.094 . 0 0 "[ . 1 . 2 ]" 1 171 1 10 LEU QD 1 46 VAL H 4.100 . 6.200 4.423 3.449 5.619 . 0 0 "[ . 1 . 2 ]" 1 172 1 10 LEU QD 1 33 LEU HA 3.700 . 5.400 4.670 4.354 4.985 . 0 0 "[ . 1 . 2 ]" 1 173 1 10 LEU QD 1 33 LEU HB2 3.900 . 5.800 3.618 3.311 4.110 . 0 0 "[ . 1 . 2 ]" 1 174 1 10 LEU QD 1 33 LEU QD 2.200 . 2.800 1.923 1.786 2.173 . 0 0 "[ . 1 . 2 ]" 1 175 1 10 LEU QD 1 38 PHE HA 4.000 . 6.000 4.619 4.262 5.094 . 0 0 "[ . 1 . 2 ]" 1 176 1 10 LEU QD 1 38 PHE QB 2.800 . 3.800 2.763 2.405 3.192 . 0 0 "[ . 1 . 2 ]" 1 177 1 10 LEU QD 1 38 PHE QD 2.700 . 3.600 2.946 2.659 3.321 . 0 0 "[ . 1 . 2 ]" 1 178 1 10 LEU QD 1 38 PHE QE 3.200 . 4.500 3.437 2.859 3.816 . 0 0 "[ . 1 . 2 ]" 1 179 1 10 LEU QD 1 38 PHE HZ 3.600 . 5.200 4.135 3.561 4.586 . 0 0 "[ . 1 . 2 ]" 1 180 1 10 LEU QD 1 41 ILE HA 3.900 . 5.800 4.031 3.649 4.560 . 0 0 "[ . 1 . 2 ]" 1 181 1 10 LEU QD 1 41 ILE HB 3.600 . 5.200 4.055 3.742 4.796 . 0 0 "[ . 1 . 2 ]" 1 182 1 10 LEU QD 1 45 LYS H 4.500 . 7.000 5.014 4.145 5.876 . 0 0 "[ . 1 . 2 ]" 1 183 1 10 LEU QD 1 41 ILE MG 3.000 . 4.100 3.512 2.872 3.802 . 0 0 "[ . 1 . 2 ]" 1 184 1 10 LEU QD 1 45 LYS HE3 3.600 . 5.200 3.567 2.332 4.988 . 0 0 "[ . 1 . 2 ]" 1 185 1 10 LEU QD 1 45 LYS QG 2.500 . 3.300 2.961 2.485 3.284 . 0 0 "[ . 1 . 2 ]" 1 186 1 10 LEU HG 1 13 ALA H 4.400 . 6.800 4.451 4.264 4.655 . 0 0 "[ . 1 . 2 ]" 1 187 1 10 LEU HG 1 14 PHE H 4.200 . 6.400 4.037 3.889 4.385 . 0 0 "[ . 1 . 2 ]" 1 188 1 10 LEU HG 1 14 PHE QD 4.100 . 6.200 3.941 3.741 4.363 . 0 0 "[ . 1 . 2 ]" 1 189 1 10 LEU HG 1 14 PHE QB 3.600 . 5.200 3.743 3.325 5.191 . 0 0 "[ . 1 . 2 ]" 1 190 1 10 LEU HG 1 38 PHE QD 4.200 . 6.400 5.077 2.765 5.488 . 0 0 "[ . 1 . 2 ]" 1 191 1 11 VAL H 1 11 VAL HA 2.500 . 3.300 2.879 2.850 2.915 . 0 0 "[ . 1 . 2 ]" 1 192 1 11 VAL H 1 11 VAL HB 2.200 . 2.800 2.472 2.324 2.792 . 0 0 "[ . 1 . 2 ]" 1 193 1 11 VAL H 1 11 VAL QG 2.200 . 2.800 2.370 1.908 2.556 . 0 0 "[ . 1 . 2 ]" 1 194 1 11 VAL H 1 12 LYS H 2.400 . 3.100 2.700 2.575 2.840 . 0 0 "[ . 1 . 2 ]" 1 195 1 11 VAL H 1 12 LYS QB 3.300 . 4.700 4.542 4.213 4.838 0.138 23 0 "[ . 1 . 2 ]" 1 196 1 11 VAL H 1 12 LYS HG3 5.100 . 7.000 5.146 3.481 6.038 . 0 0 "[ . 1 . 2 ]" 1 197 1 11 VAL H 1 13 ALA H 3.500 . 5.000 4.003 3.823 4.287 . 0 0 "[ . 1 . 2 ]" 1 198 1 11 VAL H 1 14 PHE H 5.400 . 7.000 4.528 4.459 4.632 . 0 0 "[ . 1 . 2 ]" 1 199 1 11 VAL H 1 38 PHE QE 4.000 . 6.000 3.790 3.501 3.977 . 0 0 "[ . 1 . 2 ]" 1 200 1 11 VAL HA 1 11 VAL HB 2.700 . 3.600 3.029 3.008 3.042 . 0 0 "[ . 1 . 2 ]" 1 201 1 11 VAL HA 1 11 VAL QG 2.100 . 2.700 2.095 2.066 2.150 . 0 0 "[ . 1 . 2 ]" 1 202 1 11 VAL HA 1 12 LYS H 3.300 . 4.700 3.617 3.593 3.652 . 0 0 "[ . 1 . 2 ]" 1 203 1 11 VAL HA 1 12 LYS HG3 2.900 . 7.000 5.584 4.868 6.826 . 0 0 "[ . 1 . 2 ]" 1 204 1 11 VAL HA 1 13 ALA H 3.900 . 5.800 4.482 4.213 4.695 . 0 0 "[ . 1 . 2 ]" 1 205 1 11 VAL HA 1 14 PHE H 2.900 . 4.000 3.435 3.307 3.567 . 0 0 "[ . 1 . 2 ]" 1 206 1 11 VAL HA 1 14 PHE HA 4.200 . 6.400 5.255 5.104 5.398 . 0 0 "[ . 1 . 2 ]" 1 207 1 11 VAL HA 1 14 PHE QB 2.400 . 2.800 2.604 2.444 2.710 . 0 0 "[ . 1 . 2 ]" 1 208 1 11 VAL HA 1 14 PHE QD 3.300 . 4.700 4.477 4.287 4.591 . 0 0 "[ . 1 . 2 ]" 1 209 1 11 VAL HA 1 15 LYS H 3.300 . 4.700 3.994 3.466 4.338 . 0 0 "[ . 1 . 2 ]" 1 210 1 11 VAL HA 1 15 LYS HB2 5.000 . 7.000 5.929 5.472 6.511 . 0 0 "[ . 1 . 2 ]" 1 211 1 11 VAL HA 1 15 LYS QD 3.500 . 5.000 4.435 3.835 4.735 . 0 0 "[ . 1 . 2 ]" 1 212 1 11 VAL HA 1 53 PHE QD 5.700 . 7.000 5.374 4.959 5.863 . 0 0 "[ . 1 . 2 ]" 1 213 1 11 VAL HA 1 53 PHE QE 4.000 . 6.000 3.398 2.668 3.866 . 0 0 "[ . 1 . 2 ]" 1 214 1 11 VAL HA 1 53 PHE HZ 3.800 . 5.600 3.246 2.644 4.103 . 0 0 "[ . 1 . 2 ]" 1 215 1 11 VAL HB 1 11 VAL QG 2.100 . 2.700 1.881 1.868 1.894 . 0 0 "[ . 1 . 2 ]" 1 216 1 11 VAL HB 1 12 LYS H 2.500 . 3.300 2.538 2.215 2.743 . 0 0 "[ . 1 . 2 ]" 1 217 1 11 VAL HB 1 53 PHE HZ 4.200 . 6.400 4.304 4.124 4.705 . 0 0 "[ . 1 . 2 ]" 1 218 1 11 VAL QG 1 12 LYS H 3.000 . 4.100 3.063 2.838 3.316 . 0 0 "[ . 1 . 2 ]" 1 219 1 11 VAL QG 1 12 LYS HA 3.200 . 4.500 3.419 3.198 4.031 . 0 0 "[ . 1 . 2 ]" 1 220 1 11 VAL QG 1 14 PHE H 4.300 . 6.600 3.930 3.784 4.110 . 0 0 "[ . 1 . 2 ]" 1 221 1 11 VAL QG 1 14 PHE QD 3.400 . 4.800 4.356 4.055 4.570 . 0 0 "[ . 1 . 2 ]" 1 222 1 11 VAL QG 1 15 LYS H 3.600 . 5.200 3.825 3.375 4.242 . 0 0 "[ . 1 . 2 ]" 1 223 1 11 VAL QG 1 15 LYS QD 2.300 . 3.000 2.847 2.409 3.085 0.085 19 0 "[ . 1 . 2 ]" 1 224 1 11 VAL QG 1 15 LYS QE 2.500 . 3.300 2.794 2.248 3.269 . 0 0 "[ . 1 . 2 ]" 1 225 1 11 VAL QG 1 53 PHE QD 4.000 . 6.000 3.988 3.693 4.261 . 0 0 "[ . 1 . 2 ]" 1 226 1 11 VAL QG 1 53 PHE QE 3.000 . 4.100 2.517 2.047 2.782 . 0 0 "[ . 1 . 2 ]" 1 227 1 11 VAL QG 1 53 PHE HZ 2.800 . 3.400 1.927 1.812 2.204 . 0 0 "[ . 1 . 2 ]" 1 228 1 12 LYS H 1 12 LYS HA 2.600 . 3.400 2.807 2.754 2.870 . 0 0 "[ . 1 . 2 ]" 1 229 1 12 LYS H 1 12 LYS QB 2.100 . 2.700 2.364 2.097 2.656 . 0 0 "[ . 1 . 2 ]" 1 230 1 12 LYS H 1 12 LYS QD 3.400 . 4.000 2.806 2.039 4.005 0.005 15 0 "[ . 1 . 2 ]" 1 231 1 12 LYS H 1 12 LYS HG2 3.200 . 4.500 3.681 3.092 4.016 . 0 0 "[ . 1 . 2 ]" 1 232 1 12 LYS H 1 12 LYS HG3 4.400 . 6.800 3.304 1.999 4.643 0.001 20 0 "[ . 1 . 2 ]" 1 233 1 12 LYS H 1 13 ALA H 2.400 . 3.100 2.720 2.473 2.946 . 0 0 "[ . 1 . 2 ]" 1 234 1 12 LYS H 1 14 PHE H 3.500 . 5.000 3.790 3.674 3.902 . 0 0 "[ . 1 . 2 ]" 1 235 1 12 LYS HA 1 12 LYS QB 2.100 . 2.700 2.327 2.150 2.522 . 0 0 "[ . 1 . 2 ]" 1 236 1 12 LYS HA 1 12 LYS QD 2.700 . 3.600 3.519 2.627 3.752 0.152 5 0 "[ . 1 . 2 ]" 1 237 1 12 LYS HA 1 13 ALA H 3.100 . 4.300 3.513 3.466 3.550 . 0 0 "[ . 1 . 2 ]" 1 238 1 12 LYS HA 1 15 LYS H 2.900 . 4.000 3.291 3.176 3.386 . 0 0 "[ . 1 . 2 ]" 1 239 1 12 LYS HA 1 15 LYS HB2 2.500 . 3.300 3.322 3.029 3.419 0.119 7 0 "[ . 1 . 2 ]" 1 240 1 12 LYS HA 1 16 ALA H 3.400 . 4.800 4.232 4.044 4.592 . 0 0 "[ . 1 . 2 ]" 1 241 1 12 LYS QB 1 13 ALA H 2.400 . 3.100 2.816 2.398 3.329 0.229 1 0 "[ . 1 . 2 ]" 1 242 1 12 LYS QB 1 38 PHE QE 6.000 . 7.000 5.755 5.267 6.410 . 0 0 "[ . 1 . 2 ]" 1 243 1 12 LYS HB3 1 14 PHE H 3.500 . 5.000 3.493 3.199 3.694 . 0 0 "[ . 1 . 2 ]" 1 244 1 12 LYS QD 1 13 ALA H 3.000 . 4.100 3.302 2.123 4.179 0.079 6 0 "[ . 1 . 2 ]" 1 245 1 12 LYS HG3 1 14 PHE H 3.200 . 4.500 4.502 4.201 4.670 0.170 21 0 "[ . 1 . 2 ]" 1 246 1 13 ALA H 1 13 ALA HA 2.400 . 3.100 2.829 2.790 2.881 . 0 0 "[ . 1 . 2 ]" 1 247 1 13 ALA H 1 13 ALA MB 2.100 . 2.700 2.252 2.228 2.276 . 0 0 "[ . 1 . 2 ]" 1 248 1 13 ALA H 1 14 PHE H 2.500 . 3.300 2.723 2.534 2.895 . 0 0 "[ . 1 . 2 ]" 1 249 1 13 ALA H 1 14 PHE QB 4.400 . 6.800 4.435 4.220 4.605 . 0 0 "[ . 1 . 2 ]" 1 250 1 13 ALA H 1 15 LYS H 3.800 . 5.600 4.524 4.156 4.749 . 0 0 "[ . 1 . 2 ]" 1 251 1 13 ALA H 1 33 LEU QD 4.000 . 6.000 4.389 4.026 4.690 . 0 0 "[ . 1 . 2 ]" 1 252 1 13 ALA H 1 38 PHE QE 5.000 . 7.000 4.802 4.523 5.194 . 0 0 "[ . 1 . 2 ]" 1 253 1 13 ALA H 1 38 PHE HZ 3.800 . 5.600 4.163 3.783 4.629 . 0 0 "[ . 1 . 2 ]" 1 254 1 13 ALA HA 1 14 PHE H 3.200 . 4.500 3.570 3.543 3.593 . 0 0 "[ . 1 . 2 ]" 1 255 1 13 ALA HA 1 15 LYS H 4.300 . 6.600 4.855 4.525 5.097 . 0 0 "[ . 1 . 2 ]" 1 256 1 13 ALA HA 1 16 ALA H 2.800 . 3.800 3.675 3.488 3.820 0.020 12 0 "[ . 1 . 2 ]" 1 257 1 13 ALA HA 1 16 ALA MB 2.500 . 3.300 2.676 2.510 2.953 . 0 0 "[ . 1 . 2 ]" 1 258 1 13 ALA HA 1 36 GLN HE21 3.700 . 5.400 4.086 3.203 5.111 . 0 0 "[ . 1 . 2 ]" 1 259 1 13 ALA HA 1 36 GLN HE22 3.900 . 5.800 4.193 3.609 4.909 . 0 0 "[ . 1 . 2 ]" 1 260 1 13 ALA MB 1 14 PHE H 2.300 . 3.000 2.462 2.339 2.605 . 0 0 "[ . 1 . 2 ]" 1 261 1 13 ALA MB 1 14 PHE QE 3.700 . 5.400 5.441 5.295 5.528 0.128 19 0 "[ . 1 . 2 ]" 1 262 1 13 ALA MB 1 33 LEU QD 2.400 . 3.100 2.131 1.891 2.452 . 0 0 "[ . 1 . 2 ]" 1 263 1 13 ALA MB 1 36 GLN HE21 3.900 . 5.800 3.440 2.050 5.136 . 0 0 "[ . 1 . 2 ]" 1 264 1 13 ALA MB 1 36 GLN HE22 3.200 . 4.500 3.616 2.762 4.386 . 0 0 "[ . 1 . 2 ]" 1 265 1 13 ALA MB 1 38 PHE QD 3.400 . 4.800 4.032 3.737 4.348 . 0 0 "[ . 1 . 2 ]" 1 266 1 13 ALA MB 1 38 PHE QE 2.300 . 3.000 2.553 2.249 2.919 . 0 0 "[ . 1 . 2 ]" 1 267 1 13 ALA MB 1 38 PHE HZ 2.400 . 3.100 2.590 2.329 2.890 . 0 0 "[ . 1 . 2 ]" 1 268 1 14 PHE H 1 14 PHE HA 2.500 . 3.300 2.778 2.729 2.801 . 0 0 "[ . 1 . 2 ]" 1 269 1 14 PHE H 1 14 PHE QB 2.200 . 2.800 2.226 2.199 2.274 . 0 0 "[ . 1 . 2 ]" 1 270 1 14 PHE H 1 14 PHE QD 3.400 . 4.800 4.099 4.034 4.150 . 0 0 "[ . 1 . 2 ]" 1 271 1 14 PHE H 1 14 PHE QE 5.500 . 7.000 5.141 5.049 5.224 . 0 0 "[ . 1 . 2 ]" 1 272 1 14 PHE H 1 15 LYS H 2.700 . 3.600 2.974 2.836 3.079 . 0 0 "[ . 1 . 2 ]" 1 273 1 14 PHE H 1 16 ALA H 3.800 . 5.600 4.275 4.170 4.440 . 0 0 "[ . 1 . 2 ]" 1 274 1 14 PHE H 1 17 LEU MD1 4.300 . 6.600 4.968 4.559 5.115 . 0 0 "[ . 1 . 2 ]" 1 275 1 14 PHE H 1 33 LEU QD 3.300 . 4.700 3.158 2.705 3.478 . 0 0 "[ . 1 . 2 ]" 1 276 1 14 PHE H 1 38 PHE HZ 5.600 . 7.000 5.509 5.217 5.915 . 0 0 "[ . 1 . 2 ]" 1 277 1 14 PHE HA 1 14 PHE QB 2.600 . 3.000 2.428 2.405 2.448 . 0 0 "[ . 1 . 2 ]" 1 278 1 14 PHE HA 1 14 PHE QD 2.700 . 3.600 2.833 2.749 2.931 . 0 0 "[ . 1 . 2 ]" 1 279 1 14 PHE HA 1 14 PHE QE 4.000 . 6.000 4.531 4.443 4.644 . 0 0 "[ . 1 . 2 ]" 1 280 1 14 PHE HA 1 16 ALA H 3.800 . 5.600 4.579 4.441 4.725 . 0 0 "[ . 1 . 2 ]" 1 281 1 14 PHE HA 1 17 LEU H 2.900 . 4.000 3.761 3.607 3.885 . 0 0 "[ . 1 . 2 ]" 1 282 1 14 PHE HA 1 17 LEU HB2 2.900 . 4.000 3.064 2.778 3.339 . 0 0 "[ . 1 . 2 ]" 1 283 1 14 PHE HA 1 17 LEU HB3 5.200 . 7.000 4.639 4.320 4.950 . 0 0 "[ . 1 . 2 ]" 1 284 1 14 PHE HA 1 17 LEU MD1 2.500 . 3.300 3.251 2.817 3.342 0.042 11 0 "[ . 1 . 2 ]" 1 285 1 14 PHE HA 1 17 LEU HG 6.000 . 7.000 3.357 2.889 3.970 . 0 0 "[ . 1 . 2 ]" 1 286 1 14 PHE HA 1 18 LEU H 4.000 . 6.000 4.392 4.232 4.518 . 0 0 "[ . 1 . 2 ]" 1 287 1 14 PHE HA 1 18 LEU H 4.200 . 6.400 4.251 3.893 4.375 . 0 0 "[ . 1 . 2 ]" 1 288 1 14 PHE HA 1 29 ILE MD 4.000 . 6.000 2.920 2.719 3.073 . 0 0 "[ . 1 . 2 ]" 1 289 1 14 PHE HA 1 33 LEU QD 2.600 . 3.400 2.522 2.128 2.725 . 0 0 "[ . 1 . 2 ]" 1 290 1 14 PHE QB 1 14 PHE QD 2.400 . 3.100 2.130 2.118 2.141 . 0 0 "[ . 1 . 2 ]" 1 291 1 14 PHE QB 1 14 PHE QE 4.000 . 6.000 3.923 3.912 3.932 . 0 0 "[ . 1 . 2 ]" 1 292 1 14 PHE QB 1 14 PHE HZ 4.200 . 6.400 4.613 4.291 4.716 . 0 0 "[ . 1 . 2 ]" 1 293 1 14 PHE QB 1 15 LYS H 2.500 . 3.300 2.247 2.003 2.547 . 0 0 "[ . 1 . 2 ]" 1 294 1 14 PHE QB 1 17 LEU H 4.200 . 6.400 4.154 3.851 4.267 . 0 0 "[ . 1 . 2 ]" 1 295 1 14 PHE QB 1 53 PHE HZ 4.500 . 7.000 3.782 3.391 4.179 . 0 0 "[ . 1 . 2 ]" 1 296 1 14 PHE QB 1 32 ALA MB 3.000 . 7.000 5.421 5.188 5.848 . 0 0 "[ . 1 . 2 ]" 1 297 1 14 PHE QB 1 33 LEU QD 3.700 . 3.800 3.000 2.472 3.245 . 0 0 "[ . 1 . 2 ]" 1 298 1 14 PHE QB 1 53 PHE HB2 2.700 . 7.000 5.785 5.563 6.398 . 0 0 "[ . 1 . 2 ]" 1 299 1 14 PHE QB 1 53 PHE QE 4.700 . 7.000 2.936 2.374 3.315 . 0 0 "[ . 1 . 2 ]" 1 300 1 14 PHE QB 1 53 PHE HZ 4.000 . 6.000 4.185 3.578 4.721 . 0 0 "[ . 1 . 2 ]" 1 301 1 14 PHE QD 1 15 LYS H 3.200 . 4.500 3.407 3.056 3.751 . 0 0 "[ . 1 . 2 ]" 1 302 1 14 PHE QD 1 15 LYS HA 3.100 . 4.300 3.362 3.130 3.608 . 0 0 "[ . 1 . 2 ]" 1 303 1 14 PHE QD 1 15 LYS HB2 4.000 . 6.000 5.340 5.016 5.730 . 0 0 "[ . 1 . 2 ]" 1 304 1 14 PHE QD 1 15 LYS HB3 4.000 . 6.000 4.281 4.019 4.556 . 0 0 "[ . 1 . 2 ]" 1 305 1 14 PHE QD 1 15 LYS QD 2.900 . 4.000 3.340 2.740 4.035 0.035 17 0 "[ . 1 . 2 ]" 1 306 1 14 PHE QD 1 15 LYS HG2 2.800 . 3.800 3.227 2.949 3.564 . 0 0 "[ . 1 . 2 ]" 1 307 1 14 PHE QD 1 17 LEU HG 4.300 . 6.600 3.985 3.556 4.200 . 0 0 "[ . 1 . 2 ]" 1 308 1 14 PHE QD 1 18 LEU HA 4.400 . 6.800 4.847 4.700 5.120 . 0 0 "[ . 1 . 2 ]" 1 309 1 14 PHE QD 1 18 LEU MD1 2.700 . 3.600 2.384 2.192 2.866 . 0 0 "[ . 1 . 2 ]" 1 310 1 14 PHE QD 1 18 LEU HG 4.400 . 6.800 4.069 3.941 4.212 . 0 0 "[ . 1 . 2 ]" 1 311 1 14 PHE QD 1 29 ILE MD 3.100 . 4.300 2.696 2.559 2.889 . 0 0 "[ . 1 . 2 ]" 1 312 1 14 PHE QD 1 29 ILE QG 2.700 . 3.600 3.507 3.309 3.638 0.038 17 0 "[ . 1 . 2 ]" 1 313 1 14 PHE QD 1 29 ILE MG 3.000 . 7.000 5.168 4.983 5.252 . 0 0 "[ . 1 . 2 ]" 1 314 1 14 PHE QD 1 32 ALA MB 2.900 . 7.000 4.991 4.763 5.339 . 0 0 "[ . 1 . 2 ]" 1 315 1 14 PHE QD 1 33 LEU HB3 3.800 . 5.600 5.556 5.203 5.721 0.121 14 0 "[ . 1 . 2 ]" 1 316 1 14 PHE QD 1 33 LEU QD 2.500 . 3.300 2.150 1.926 2.338 . 0 0 "[ . 1 . 2 ]" 1 317 1 14 PHE QD 1 33 LEU HG 4.100 . 6.200 4.532 4.225 4.824 . 0 0 "[ . 1 . 2 ]" 1 318 1 14 PHE QD 1 46 VAL HA 3.100 . 4.300 4.238 4.055 4.339 0.039 19 0 "[ . 1 . 2 ]" 1 319 1 14 PHE QD 1 46 VAL MG1 3.100 . 4.300 4.341 4.112 4.548 0.248 19 0 "[ . 1 . 2 ]" 1 320 1 14 PHE QD 1 46 VAL MG2 3.100 . 4.300 3.618 3.345 3.872 . 0 0 "[ . 1 . 2 ]" 1 321 1 14 PHE QD 1 49 MET HB2 3.500 . 5.000 4.041 3.792 4.208 . 0 0 "[ . 1 . 2 ]" 1 322 1 14 PHE QD 1 49 MET HB3 4.100 . 6.200 3.394 3.143 3.613 . 0 0 "[ . 1 . 2 ]" 1 323 1 14 PHE QD 1 49 MET QG 4.300 . 6.600 4.265 3.636 4.617 . 0 0 "[ . 1 . 2 ]" 1 324 1 14 PHE QD 1 50 LEU HA 4.500 . 7.000 4.975 4.799 5.305 . 0 0 "[ . 1 . 2 ]" 1 325 1 14 PHE QD 1 52 LYS QD 3.000 . 7.000 5.802 5.425 6.611 . 0 0 "[ . 1 . 2 ]" 1 326 1 14 PHE QD 1 53 PHE HB3 4.700 . 7.000 4.415 3.965 4.979 . 0 0 "[ . 1 . 2 ]" 1 327 1 14 PHE QD 1 53 PHE QD 3.200 . 4.500 2.509 2.338 2.934 . 0 0 "[ . 1 . 2 ]" 1 328 1 14 PHE QD 1 53 PHE QE 3.100 . 4.300 3.086 2.800 3.183 . 0 0 "[ . 1 . 2 ]" 1 329 1 14 PHE QE 1 15 LYS H 5.800 . 7.000 5.615 5.315 5.902 . 0 0 "[ . 1 . 2 ]" 1 330 1 14 PHE QE 1 15 LYS HA 3.000 . 7.000 5.007 4.756 5.235 . 0 0 "[ . 1 . 2 ]" 1 331 1 14 PHE QE 1 18 LEU MD1 2.600 . 3.400 2.174 2.068 2.288 . 0 0 "[ . 1 . 2 ]" 1 332 1 14 PHE QE 1 18 LEU HG 3.700 . 5.400 4.201 3.974 4.374 . 0 0 "[ . 1 . 2 ]" 1 333 1 14 PHE QE 1 26 GLN HA 4.200 . 6.400 5.551 5.363 5.823 . 0 0 "[ . 1 . 2 ]" 1 334 1 14 PHE QE 1 26 GLN HA 4.400 . 6.800 4.407 4.296 4.503 . 0 0 "[ . 1 . 2 ]" 1 335 1 14 PHE QE 1 29 ILE MD 2.400 . 3.100 2.305 2.112 2.425 . 0 0 "[ . 1 . 2 ]" 1 336 1 14 PHE QE 1 29 ILE QG 2.600 . 3.300 3.009 2.930 3.085 . 0 0 "[ . 1 . 2 ]" 1 337 1 14 PHE QE 1 29 ILE MG 3.000 . 4.100 4.093 3.799 4.174 0.074 3 0 "[ . 1 . 2 ]" 1 338 1 14 PHE QE 1 30 VAL H 5.000 . 7.000 4.971 4.683 5.201 . 0 0 "[ . 1 . 2 ]" 1 339 1 14 PHE QE 1 33 LEU QD 4.300 . 4.300 3.293 3.128 3.438 . 0 0 "[ . 1 . 2 ]" 1 340 1 14 PHE QE 1 45 LYS QG 3.300 . 4.700 4.393 4.244 4.589 . 0 0 "[ . 1 . 2 ]" 1 341 1 14 PHE QE 1 46 VAL HA 3.000 . 4.100 2.346 2.179 2.632 . 0 0 "[ . 1 . 2 ]" 1 342 1 14 PHE QE 1 46 VAL HB 3.800 . 5.600 4.479 4.323 4.775 . 0 0 "[ . 1 . 2 ]" 1 343 1 14 PHE QE 1 46 VAL MG1 2.600 . 3.400 2.370 2.082 2.642 . 0 0 "[ . 1 . 2 ]" 1 344 1 14 PHE QE 1 46 VAL MG2 2.700 . 3.600 2.514 2.175 2.852 . 0 0 "[ . 1 . 2 ]" 1 345 1 14 PHE QE 1 49 MET H 4.900 . 7.000 4.646 4.487 4.769 . 0 0 "[ . 1 . 2 ]" 1 346 1 14 PHE QE 1 49 MET HB2 2.800 . 3.800 3.005 2.893 3.143 . 0 0 "[ . 1 . 2 ]" 1 347 1 14 PHE QE 1 49 MET HB2 3.200 . 4.500 2.864 2.780 2.989 . 0 0 "[ . 1 . 2 ]" 1 348 1 14 PHE QE 1 49 MET HB3 3.000 . 4.100 2.900 2.754 3.051 . 0 0 "[ . 1 . 2 ]" 1 349 1 14 PHE QE 1 50 LEU H 3.600 . 5.200 3.802 3.572 3.972 . 0 0 "[ . 1 . 2 ]" 1 350 1 14 PHE QE 1 50 LEU HA 2.800 . 3.800 2.679 2.490 3.003 . 0 0 "[ . 1 . 2 ]" 1 351 1 14 PHE QE 1 50 LEU HB3 4.900 . 7.000 5.011 4.828 5.246 . 0 0 "[ . 1 . 2 ]" 1 352 1 14 PHE QE 1 50 LEU QD 2.400 . 3.100 3.181 3.102 3.255 0.155 21 0 "[ . 1 . 2 ]" 1 353 1 14 PHE QE 1 50 LEU HG 2.800 . 3.800 3.152 2.899 3.378 . 0 0 "[ . 1 . 2 ]" 1 354 1 14 PHE QE 1 52 LYS QD 3.300 . 7.000 5.765 5.233 6.308 . 0 0 "[ . 1 . 2 ]" 1 355 1 14 PHE QE 1 53 PHE H 4.200 . 6.400 4.553 4.360 4.775 . 0 0 "[ . 1 . 2 ]" 1 356 1 14 PHE QE 1 53 PHE HB2 2.800 . 3.800 3.122 2.662 3.407 . 0 0 "[ . 1 . 2 ]" 1 357 1 14 PHE QE 1 53 PHE HB3 3.400 . 4.800 4.349 3.658 4.652 . 0 0 "[ . 1 . 2 ]" 1 358 1 14 PHE QE 1 53 PHE QD 2.700 . 3.600 2.439 2.243 3.418 . 0 0 "[ . 1 . 2 ]" 1 359 1 14 PHE HZ 1 15 LYS HA 3.500 . 7.000 7.031 6.836 7.199 0.199 19 0 "[ . 1 . 2 ]" 1 360 1 14 PHE HZ 1 18 LEU MD1 2.700 . 3.600 3.525 3.083 3.669 0.069 7 0 "[ . 1 . 2 ]" 1 361 1 14 PHE HZ 1 18 LEU MD1 3.100 . 4.300 3.401 3.038 3.526 . 0 0 "[ . 1 . 2 ]" 1 362 1 14 PHE HZ 1 18 LEU MD1 2.800 . 3.800 2.746 2.295 2.859 . 0 0 "[ . 1 . 2 ]" 1 363 1 14 PHE HZ 1 18 LEU HG 4.600 . 7.000 5.085 4.723 5.305 . 0 0 "[ . 1 . 2 ]" 1 364 1 14 PHE HZ 1 26 GLN HA 4.600 . 7.000 4.667 4.579 4.737 . 0 0 "[ . 1 . 2 ]" 1 365 1 14 PHE HZ 1 29 ILE MD 2.200 . 2.800 2.889 2.825 2.933 0.133 19 0 "[ . 1 . 2 ]" 1 366 1 14 PHE HZ 1 29 ILE MD 2.100 . 2.700 2.559 2.238 2.619 . 0 0 "[ . 1 . 2 ]" 1 367 1 14 PHE HZ 1 29 ILE QG 3.400 . 4.800 4.542 4.431 4.701 . 0 0 "[ . 1 . 2 ]" 1 368 1 14 PHE HZ 1 29 ILE QG 3.500 . 5.000 4.248 4.165 4.374 . 0 0 "[ . 1 . 2 ]" 1 369 1 14 PHE HZ 1 29 ILE MG 3.300 . 4.700 4.512 4.145 4.709 0.009 19 0 "[ . 1 . 2 ]" 1 370 1 14 PHE HZ 1 50 LEU HB2 3.300 . 4.700 3.822 3.540 4.063 . 0 0 "[ . 1 . 2 ]" 1 371 1 14 PHE HZ 1 46 VAL HA 3.600 . 5.200 3.473 3.281 3.870 . 0 0 "[ . 1 . 2 ]" 1 372 1 14 PHE HZ 1 46 VAL HB 4.100 . 6.200 5.570 5.383 6.051 . 0 0 "[ . 1 . 2 ]" 1 373 1 14 PHE HZ 1 46 VAL MG1 3.000 . 4.100 3.045 2.737 3.473 . 0 0 "[ . 1 . 2 ]" 1 374 1 14 PHE HZ 1 46 VAL MG2 3.500 . 5.000 4.374 4.138 4.640 . 0 0 "[ . 1 . 2 ]" 1 375 1 14 PHE HZ 1 49 MET H 4.800 . 7.000 4.423 4.269 4.638 . 0 0 "[ . 1 . 2 ]" 1 376 1 14 PHE HZ 1 49 MET HA 4.200 . 6.400 4.959 4.830 5.050 . 0 0 "[ . 1 . 2 ]" 1 377 1 14 PHE HZ 1 49 MET HB2 2.800 . 3.800 2.917 2.695 3.092 . 0 0 "[ . 1 . 2 ]" 1 378 1 14 PHE HZ 1 49 MET HB3 3.200 . 4.500 3.168 3.019 3.350 . 0 0 "[ . 1 . 2 ]" 1 379 1 14 PHE HZ 1 50 LEU H 3.100 . 4.300 2.915 2.696 3.139 . 0 0 "[ . 1 . 2 ]" 1 380 1 14 PHE HZ 1 50 LEU HA 2.400 . 3.100 3.146 2.815 3.240 0.140 15 0 "[ . 1 . 2 ]" 1 381 1 14 PHE HZ 1 50 LEU HB2 3.300 . 4.700 3.872 3.569 4.128 . 0 0 "[ . 1 . 2 ]" 1 382 1 14 PHE HZ 1 50 LEU HB3 3.800 . 5.600 4.609 4.425 4.732 . 0 0 "[ . 1 . 2 ]" 1 383 1 14 PHE HZ 1 50 LEU HG 2.400 . 3.100 1.961 1.906 2.204 . 0 0 "[ . 1 . 2 ]" 1 384 1 14 PHE HZ 1 53 PHE HB2 3.800 . 5.600 5.227 4.605 5.471 . 0 0 "[ . 1 . 2 ]" 1 385 1 14 PHE HZ 1 53 PHE QD 3.700 . 5.400 4.254 3.964 5.217 . 0 0 "[ . 1 . 2 ]" 1 386 1 15 LYS H 1 15 LYS HA 2.600 . 3.400 2.771 2.731 2.821 . 0 0 "[ . 1 . 2 ]" 1 387 1 15 LYS H 1 15 LYS HB2 2.400 . 3.100 2.663 2.263 2.861 . 0 0 "[ . 1 . 2 ]" 1 388 1 15 LYS H 1 15 LYS HB3 2.900 . 4.000 3.573 3.512 3.662 . 0 0 "[ . 1 . 2 ]" 1 389 1 15 LYS H 1 15 LYS QD 2.300 . 3.000 3.086 2.412 3.363 0.363 7 0 "[ . 1 . 2 ]" 1 390 1 15 LYS H 1 15 LYS QE 3.800 . 5.600 4.578 3.825 4.841 . 0 0 "[ . 1 . 2 ]" 1 391 1 15 LYS H 1 15 LYS HG2 3.400 . 4.800 2.397 1.626 4.322 0.374 7 0 "[ . 1 . 2 ]" 1 392 1 15 LYS H 1 16 ALA H 2.500 . 3.300 2.852 2.726 2.951 . 0 0 "[ . 1 . 2 ]" 1 393 1 15 LYS H 1 17 LEU H 4.400 . 6.800 4.477 4.270 4.601 . 0 0 "[ . 1 . 2 ]" 1 394 1 15 LYS H 1 18 LEU H 4.700 . 7.000 4.609 4.244 4.723 . 0 0 "[ . 1 . 2 ]" 1 395 1 15 LYS H 1 18 LEU MD1 4.300 . 6.600 3.798 3.591 3.943 . 0 0 "[ . 1 . 2 ]" 1 396 1 15 LYS H 1 29 ILE MD 4.400 . 6.800 4.662 4.530 4.977 . 0 0 "[ . 1 . 2 ]" 1 397 1 15 LYS H 1 19 LYS H 4.500 . 7.000 5.962 5.803 6.199 . 0 0 "[ . 1 . 2 ]" 1 398 1 15 LYS H 1 53 PHE HZ 5.500 . 7.000 5.531 5.279 5.851 . 0 0 "[ . 1 . 2 ]" 1 399 1 15 LYS HA 1 15 LYS HB2 2.400 . 3.100 3.019 2.970 3.052 . 0 0 "[ . 1 . 2 ]" 1 400 1 15 LYS HA 1 15 LYS HB3 2.400 . 3.100 2.458 2.370 2.667 . 0 0 "[ . 1 . 2 ]" 1 401 1 15 LYS HA 1 15 LYS QD 2.500 . 3.300 2.816 2.292 3.657 0.357 17 0 "[ . 1 . 2 ]" 1 402 1 15 LYS HA 1 15 LYS QE 6.000 . 7.000 3.692 3.307 3.939 . 0 0 "[ . 1 . 2 ]" 1 403 1 15 LYS HA 1 16 ALA H 3.100 . 4.300 3.551 3.535 3.575 . 0 0 "[ . 1 . 2 ]" 1 404 1 15 LYS HA 1 16 ALA HA 3.500 . 5.000 4.839 4.795 4.861 . 0 0 "[ . 1 . 2 ]" 1 405 1 15 LYS HA 1 17 LEU H 3.900 . 5.800 4.006 3.912 4.092 . 0 0 "[ . 1 . 2 ]" 1 406 1 15 LYS HA 1 18 LEU H 2.800 . 3.800 3.833 3.718 3.910 0.110 12 0 "[ . 1 . 2 ]" 1 407 1 15 LYS HA 1 18 LEU HB2 2.800 . 3.800 3.257 3.108 3.431 . 0 0 "[ . 1 . 2 ]" 1 408 1 15 LYS HA 1 18 LEU MD1 2.600 . 3.400 2.624 2.333 3.125 . 0 0 "[ . 1 . 2 ]" 1 409 1 15 LYS HA 1 18 LEU MD2 3.800 . 5.600 5.028 4.851 5.318 . 0 0 "[ . 1 . 2 ]" 1 410 1 15 LYS HA 1 19 LYS H 3.600 . 5.200 3.944 3.752 4.189 . 0 0 "[ . 1 . 2 ]" 1 411 1 15 LYS HA 1 53 PHE QE 5.100 . 7.000 5.606 4.580 5.846 . 0 0 "[ . 1 . 2 ]" 1 412 1 15 LYS HB2 1 16 ALA H 2.700 . 3.600 2.560 2.357 2.974 . 0 0 "[ . 1 . 2 ]" 1 413 1 15 LYS HB3 1 18 LEU H 4.000 . 6.000 4.459 3.680 4.595 . 0 0 "[ . 1 . 2 ]" 1 414 1 15 LYS HB3 1 15 LYS QG 3.600 . 5.200 2.357 2.132 2.505 . 0 0 "[ . 1 . 2 ]" 1 415 1 15 LYS HB3 1 16 ALA H 3.000 . 4.100 3.643 3.263 3.833 . 0 0 "[ . 1 . 2 ]" 1 416 1 15 LYS QD 1 15 LYS HG2 1.900 . 2.400 2.078 2.055 2.120 . 0 0 "[ . 1 . 2 ]" 1 417 1 15 LYS QD 1 53 PHE QD 3.200 . 4.500 2.982 1.826 3.367 0.074 19 0 "[ . 1 . 2 ]" 1 418 1 15 LYS QD 1 53 PHE QE 3.000 . 4.100 3.112 2.345 3.524 . 0 0 "[ . 1 . 2 ]" 1 419 1 15 LYS QD 1 53 PHE HB3 4.200 . 6.400 3.558 2.949 4.773 . 0 0 "[ . 1 . 2 ]" 1 420 1 15 LYS QD 1 53 PHE QD 2.900 . 4.000 3.158 1.968 3.827 . 0 0 "[ . 1 . 2 ]" 1 421 1 15 LYS QD 1 53 PHE QE 3.000 . 4.100 3.168 2.379 3.644 . 0 0 "[ . 1 . 2 ]" 1 422 1 15 LYS QD 1 53 PHE HZ 4.200 . 5.400 3.756 3.320 4.688 . 0 0 "[ . 1 . 2 ]" 1 423 1 15 LYS QE 1 15 LYS QG 2.300 . 5.000 2.551 2.125 2.960 . 0 0 "[ . 1 . 2 ]" 1 424 1 15 LYS QE 1 53 PHE QD 3.900 . 5.800 3.040 2.440 4.613 . 0 0 "[ . 1 . 2 ]" 1 425 1 15 LYS QE 1 53 PHE QE 3.600 . 5.200 2.979 2.296 4.245 . 0 0 "[ . 1 . 2 ]" 1 426 1 15 LYS QE 1 53 PHE HZ 3.800 . 5.600 4.114 3.042 5.251 . 0 0 "[ . 1 . 2 ]" 1 427 1 15 LYS QE 1 69 LEU QD 3.300 . 4.700 3.043 2.134 4.107 . 0 0 "[ . 1 . 2 ]" 1 428 1 15 LYS QG 1 16 ALA H 4.700 . 7.000 3.757 3.518 4.203 . 0 0 "[ . 1 . 2 ]" 1 429 1 15 LYS QG 1 53 PHE QE 4.200 . 6.400 3.780 3.103 4.118 . 0 0 "[ . 1 . 2 ]" 1 430 1 15 LYS HG2 1 53 PHE QD 3.100 . 4.300 3.358 2.932 3.594 . 0 0 "[ . 1 . 2 ]" 1 431 1 16 ALA H 1 16 ALA HA 2.600 . 3.400 2.807 2.786 2.843 . 0 0 "[ . 1 . 2 ]" 1 432 1 16 ALA H 1 17 LEU H 2.200 . 2.800 2.417 2.318 2.478 . 0 0 "[ . 1 . 2 ]" 1 433 1 16 ALA H 1 18 LEU MD1 4.000 . 6.000 4.010 3.899 4.134 . 0 0 "[ . 1 . 2 ]" 1 434 1 16 ALA H 1 17 LEU MD2 3.700 . 5.400 4.354 4.156 4.506 . 0 0 "[ . 1 . 2 ]" 1 435 1 16 ALA H 1 17 LEU HG 3.900 . 5.800 4.779 4.519 4.861 . 0 0 "[ . 1 . 2 ]" 1 436 1 16 ALA H 1 17 LEU HG 3.500 . 5.000 4.409 4.261 4.477 . 0 0 "[ . 1 . 2 ]" 1 437 1 16 ALA H 1 18 LEU H 3.100 . 4.300 4.331 4.279 4.386 0.086 7 0 "[ . 1 . 2 ]" 1 438 1 16 ALA H 1 19 LYS HG3 3.600 . 5.200 5.271 5.218 5.330 0.130 7 0 "[ . 1 . 2 ]" 1 439 1 16 ALA HA 1 16 ALA MB 2.100 . 2.700 2.126 2.110 2.131 . 0 0 "[ . 1 . 2 ]" 1 440 1 16 ALA HA 1 17 LEU H 3.400 . 4.800 3.577 3.545 3.591 . 0 0 "[ . 1 . 2 ]" 1 441 1 16 ALA HA 1 18 LEU H 3.800 . 5.600 4.523 4.409 4.712 . 0 0 "[ . 1 . 2 ]" 1 442 1 16 ALA HA 1 19 LYS H 2.800 . 3.800 3.658 3.532 3.744 . 0 0 "[ . 1 . 2 ]" 1 443 1 16 ALA HA 1 19 LYS HB2 2.400 . 3.100 2.719 2.556 2.871 . 0 0 "[ . 1 . 2 ]" 1 444 1 16 ALA HA 1 19 LYS HB3 2.500 . 7.000 4.352 4.157 4.539 . 0 0 "[ . 1 . 2 ]" 1 445 1 16 ALA HA 1 19 LYS HG3 3.100 . 4.300 4.201 3.916 4.366 0.066 20 0 "[ . 1 . 2 ]" 1 446 1 16 ALA MB 1 17 LEU H 2.600 . 3.400 2.459 2.357 2.653 . 0 0 "[ . 1 . 2 ]" 1 447 1 17 LEU H 1 17 LEU HA 2.600 . 3.400 2.788 2.767 2.812 . 0 0 "[ . 1 . 2 ]" 1 448 1 17 LEU H 1 17 LEU HB2 2.600 . 3.400 2.467 2.425 2.517 . 0 0 "[ . 1 . 2 ]" 1 449 1 17 LEU H 1 17 LEU HB3 2.900 . 4.000 3.602 3.591 3.616 . 0 0 "[ . 1 . 2 ]" 1 450 1 17 LEU H 1 17 LEU MD1 3.200 . 4.500 3.791 3.551 3.886 . 0 0 "[ . 1 . 2 ]" 1 451 1 17 LEU H 1 17 LEU HG 2.200 . 2.800 2.491 2.299 2.619 . 0 0 "[ . 1 . 2 ]" 1 452 1 17 LEU H 1 18 LEU H 2.400 . 3.100 2.824 2.774 2.892 . 0 0 "[ . 1 . 2 ]" 1 453 1 17 LEU H 1 18 LEU HG 4.300 . 6.600 4.534 4.372 4.743 . 0 0 "[ . 1 . 2 ]" 1 454 1 17 LEU H 1 19 LYS H 3.700 . 5.400 4.427 4.302 4.582 . 0 0 "[ . 1 . 2 ]" 1 455 1 17 LEU H 1 29 ILE HG13 5.200 . 7.000 3.868 3.471 4.070 . 0 0 "[ . 1 . 2 ]" 1 456 1 17 LEU H 1 33 LEU QD 5.400 . 7.000 4.411 4.079 4.682 . 0 0 "[ . 1 . 2 ]" 1 457 1 17 LEU HA 1 17 LEU HB2 2.700 . 3.600 3.024 3.018 3.029 . 0 0 "[ . 1 . 2 ]" 1 458 1 17 LEU HA 1 17 LEU MD1 3.100 . 4.300 3.697 3.570 3.869 . 0 0 "[ . 1 . 2 ]" 1 459 1 17 LEU HA 1 17 LEU MD2 2.100 . 2.700 1.995 1.957 2.065 . 0 0 "[ . 1 . 2 ]" 1 460 1 17 LEU HA 1 18 LEU H 3.200 . 4.500 3.548 3.535 3.569 . 0 0 "[ . 1 . 2 ]" 1 461 1 17 LEU HA 1 20 GLU H 2.600 . 3.400 3.223 3.108 3.286 . 0 0 "[ . 1 . 2 ]" 1 462 1 17 LEU HA 1 21 GLU H 3.300 . 4.700 3.672 3.608 3.754 . 0 0 "[ . 1 . 2 ]" 1 463 1 17 LEU HA 1 20 GLU HB2 2.600 . 3.400 3.190 2.991 3.453 0.053 18 0 "[ . 1 . 2 ]" 1 464 1 17 LEU HA 1 23 PHE QD 3.200 . 4.500 4.037 3.738 4.220 . 0 0 "[ . 1 . 2 ]" 1 465 1 17 LEU HA 1 23 PHE QE 2.400 . 3.100 2.584 2.200 2.996 . 0 0 "[ . 1 . 2 ]" 1 466 1 17 LEU HA 1 23 PHE HZ 5.300 . 7.000 4.537 4.128 5.090 . 0 0 "[ . 1 . 2 ]" 1 467 1 17 LEU HA 1 29 ILE MD 4.900 . 7.000 5.343 5.173 5.561 . 0 0 "[ . 1 . 2 ]" 1 468 1 17 LEU HB2 1 17 LEU MD1 2.300 . 3.000 2.523 2.313 2.648 . 0 0 "[ . 1 . 2 ]" 1 469 1 17 LEU HB2 1 17 LEU MD2 2.800 . 3.800 3.185 3.153 3.226 . 0 0 "[ . 1 . 2 ]" 1 470 1 17 LEU HB2 1 18 LEU H 6.000 . 7.000 2.513 2.417 2.590 . 0 0 "[ . 1 . 2 ]" 1 471 1 17 LEU HB2 1 23 PHE QD 3.300 . 4.700 4.193 3.914 4.572 . 0 0 "[ . 1 . 2 ]" 1 472 1 17 LEU HB2 1 23 PHE QE 3.300 . 4.700 3.823 3.679 4.231 . 0 0 "[ . 1 . 2 ]" 1 473 1 17 LEU HB2 1 23 PHE HZ 4.500 . 7.000 5.509 4.758 6.026 . 0 0 "[ . 1 . 2 ]" 1 474 1 17 LEU HB3 1 17 LEU MD1 3.400 . 4.800 2.208 2.140 2.351 . 0 0 "[ . 1 . 2 ]" 1 475 1 17 LEU HB3 1 17 LEU MD2 2.400 . 3.100 2.578 2.420 2.719 . 0 0 "[ . 1 . 2 ]" 1 476 1 17 LEU HB3 1 18 LEU H 2.800 . 3.800 3.132 3.040 3.191 . 0 0 "[ . 1 . 2 ]" 1 477 1 17 LEU HB3 1 23 PHE QD 3.000 . 4.100 2.830 2.555 3.328 . 0 0 "[ . 1 . 2 ]" 1 478 1 17 LEU HB3 1 23 PHE QE 2.700 . 3.600 2.212 2.088 2.728 . 0 0 "[ . 1 . 2 ]" 1 479 1 17 LEU HB3 1 23 PHE HZ 4.000 . 6.000 3.920 3.179 4.358 . 0 0 "[ . 1 . 2 ]" 1 480 1 17 LEU MD1 1 17 LEU HG 2.100 . 2.700 2.118 2.109 2.126 . 0 0 "[ . 1 . 2 ]" 1 481 1 17 LEU MD1 1 23 PHE QD 2.900 . 4.000 3.911 3.710 4.105 0.105 8 0 "[ . 1 . 2 ]" 1 482 1 17 LEU MD1 1 23 PHE QE 3.100 . 4.300 2.936 2.709 3.324 . 0 0 "[ . 1 . 2 ]" 1 483 1 17 LEU MD1 1 23 PHE HZ 3.400 . 4.800 3.113 2.646 3.868 . 0 0 "[ . 1 . 2 ]" 1 484 1 17 LEU MD1 1 33 LEU H 2.800 . 3.800 2.794 2.588 2.891 . 0 0 "[ . 1 . 2 ]" 1 485 1 17 LEU MD1 1 32 ALA H 3.700 . 5.400 4.171 3.999 4.329 . 0 0 "[ . 1 . 2 ]" 1 486 1 17 LEU MD1 1 32 ALA MB 2.500 . 3.300 2.088 1.879 2.321 . 0 0 "[ . 1 . 2 ]" 1 487 1 17 LEU MD1 1 33 LEU H 3.300 . 4.700 3.299 3.123 3.510 . 0 0 "[ . 1 . 2 ]" 1 488 1 17 LEU MD1 1 33 LEU H 3.200 . 4.500 2.837 2.743 2.928 . 0 0 "[ . 1 . 2 ]" 1 489 1 17 LEU MD1 1 33 LEU HA 2.700 . 3.600 3.316 3.097 3.556 . 0 0 "[ . 1 . 2 ]" 1 490 1 17 LEU MD1 1 34 GLN H 4.500 . 7.000 5.297 5.070 5.499 . 0 0 "[ . 1 . 2 ]" 1 491 1 17 LEU MD1 1 36 GLN HE21 3.700 . 5.400 3.844 3.029 5.143 . 0 0 "[ . 1 . 2 ]" 1 492 1 17 LEU MD1 1 38 PHE QD 4.000 . 6.000 5.297 5.027 5.520 . 0 0 "[ . 1 . 2 ]" 1 493 1 17 LEU MD2 1 17 LEU HG 2.200 . 2.800 2.117 2.096 2.126 . 0 0 "[ . 1 . 2 ]" 1 494 1 17 LEU MD2 1 18 LEU H 4.600 . 7.000 4.511 4.411 4.682 . 0 0 "[ . 1 . 2 ]" 1 495 1 17 LEU MD2 1 23 PHE QD 3.100 . 4.300 4.173 3.879 4.331 0.031 4 0 "[ . 1 . 2 ]" 1 496 1 17 LEU MD2 1 23 PHE QE 2.400 . 3.100 2.206 2.041 2.455 . 0 0 "[ . 1 . 2 ]" 1 497 1 17 LEU MD2 1 23 PHE HZ 2.500 . 3.300 2.725 2.333 3.220 . 0 0 "[ . 1 . 2 ]" 1 498 1 17 LEU MD2 1 33 LEU H 2.500 . 7.000 3.698 3.638 3.728 . 0 0 "[ . 1 . 2 ]" 1 499 1 17 LEU MD2 1 32 ALA H 4.900 . 7.000 4.761 4.552 4.921 . 0 0 "[ . 1 . 2 ]" 1 500 1 17 LEU MD2 1 32 ALA H 4.400 . 6.800 6.043 5.185 6.334 . 0 0 "[ . 1 . 2 ]" 1 501 1 17 LEU MD2 1 32 ALA MB 2.500 . 3.300 3.047 2.209 3.287 . 0 0 "[ . 1 . 2 ]" 1 502 1 17 LEU MD2 1 36 GLN HE21 3.000 . 4.100 2.892 2.001 4.028 . 0 0 "[ . 1 . 2 ]" 1 503 1 17 LEU MD2 1 36 GLN HE22 3.000 . 4.100 3.300 2.715 3.907 . 0 0 "[ . 1 . 2 ]" 1 504 1 17 LEU HG 1 18 LEU H 3.100 . 4.300 4.413 4.354 4.453 0.153 8 0 "[ . 1 . 2 ]" 1 505 1 17 LEU HG 1 18 LEU H 3.600 . 5.200 3.563 3.461 3.640 . 0 0 "[ . 1 . 2 ]" 1 506 1 17 LEU HG 1 23 PHE QE 2.900 . 4.000 3.709 3.589 3.885 . 0 0 "[ . 1 . 2 ]" 1 507 1 17 LEU HG 1 23 PHE QD 4.600 . 7.000 5.668 5.451 5.923 . 0 0 "[ . 1 . 2 ]" 1 508 1 17 LEU HG 1 23 PHE QE 2.900 . 4.000 2.505 2.382 2.702 . 0 0 "[ . 1 . 2 ]" 1 509 1 17 LEU HG 1 23 PHE HZ 5.100 . 7.000 5.336 4.777 6.006 . 0 0 "[ . 1 . 2 ]" 1 510 1 17 LEU HG 1 36 GLN HE22 4.100 . 6.200 4.781 4.300 5.882 . 0 0 "[ . 1 . 2 ]" 1 511 1 18 LEU H 1 18 LEU HA 2.700 . 3.600 2.849 2.822 2.870 . 0 0 "[ . 1 . 2 ]" 1 512 1 18 LEU H 1 18 LEU MD1 3.000 . 4.100 3.374 3.162 3.616 . 0 0 "[ . 1 . 2 ]" 1 513 1 18 LEU H 1 18 LEU MD1 2.900 . 4.000 3.107 2.984 3.292 . 0 0 "[ . 1 . 2 ]" 1 514 1 18 LEU H 1 18 LEU MD2 3.000 . 4.100 3.288 3.157 3.441 . 0 0 "[ . 1 . 2 ]" 1 515 1 18 LEU H 1 18 LEU HG 2.300 . 3.000 2.190 2.074 2.452 . 0 0 "[ . 1 . 2 ]" 1 516 1 18 LEU H 1 19 LYS H 2.500 . 3.300 2.733 2.661 2.793 . 0 0 "[ . 1 . 2 ]" 1 517 1 18 LEU H 1 19 LYS HG3 4.700 . 7.000 4.584 4.434 4.762 . 0 0 "[ . 1 . 2 ]" 1 518 1 18 LEU HA 1 18 LEU HB3 2.300 . 3.000 2.445 2.421 2.501 . 0 0 "[ . 1 . 2 ]" 1 519 1 18 LEU HA 1 18 LEU HG 2.700 . 3.600 3.006 2.884 3.085 . 0 0 "[ . 1 . 2 ]" 1 520 1 18 LEU HA 1 20 GLU H 3.100 . 4.300 3.668 3.420 3.837 . 0 0 "[ . 1 . 2 ]" 1 521 1 18 LEU HA 1 23 PHE H 3.600 . 5.200 3.781 3.422 4.035 . 0 0 "[ . 1 . 2 ]" 1 522 1 18 LEU HA 1 23 PHE QD 3.400 . 4.800 3.372 2.989 3.636 . 0 0 "[ . 1 . 2 ]" 1 523 1 18 LEU HA 1 68 CYS HA 2.700 . 3.600 3.490 3.371 3.613 0.013 18 0 "[ . 1 . 2 ]" 1 524 1 18 LEU HA 1 69 LEU QD 3.500 . 5.000 5.015 4.663 5.102 0.102 1 0 "[ . 1 . 2 ]" 1 525 1 18 LEU HB2 1 18 LEU HG 2.800 . 3.800 2.570 2.461 2.646 . 0 0 "[ . 1 . 2 ]" 1 526 1 18 LEU HB2 1 19 LYS H 6.000 . 7.000 2.327 2.238 2.495 . 0 0 "[ . 1 . 2 ]" 1 527 1 18 LEU HB2 1 23 PHE QB 2.500 . 7.000 6.594 5.624 6.748 . 0 0 "[ . 1 . 2 ]" 1 528 1 18 LEU HB2 1 23 PHE QD 6.000 . 7.000 6.040 5.786 6.258 . 0 0 "[ . 1 . 2 ]" 1 529 1 18 LEU HB2 1 68 CYS HA 3.400 . 4.800 3.857 3.605 4.053 . 0 0 "[ . 1 . 2 ]" 1 530 1 18 LEU HB3 1 18 LEU MD1 2.900 . 4.000 2.490 2.325 2.644 . 0 0 "[ . 1 . 2 ]" 1 531 1 18 LEU HB3 1 18 LEU MD2 2.700 . 3.600 2.283 2.196 2.339 . 0 0 "[ . 1 . 2 ]" 1 532 1 18 LEU HB3 1 19 LYS H 3.300 . 4.700 3.463 3.220 3.652 . 0 0 "[ . 1 . 2 ]" 1 533 1 18 LEU HB3 1 68 CYS HA 2.700 . 3.600 2.613 2.417 2.747 . 0 0 "[ . 1 . 2 ]" 1 534 1 18 LEU HB3 1 69 LEU H 3.300 . 4.700 3.597 3.239 3.861 . 0 0 "[ . 1 . 2 ]" 1 535 1 18 LEU MD1 1 18 LEU HG 2.100 . 2.700 2.089 2.072 2.123 . 0 0 "[ . 1 . 2 ]" 1 536 1 18 LEU MD1 1 19 LYS H 4.300 . 6.600 4.055 3.940 4.174 . 0 0 "[ . 1 . 2 ]" 1 537 1 18 LEU MD1 1 19 LYS HG3 3.000 . 4.100 4.236 4.170 4.315 0.215 20 0 "[ . 1 . 2 ]" 1 538 1 18 LEU MD1 1 55 ALA H 3.300 . 4.700 3.567 3.181 3.851 . 0 0 "[ . 1 . 2 ]" 1 539 1 18 LEU MD1 1 68 CYS H 3.800 . 5.600 4.363 4.008 4.752 . 0 0 "[ . 1 . 2 ]" 1 540 1 18 LEU MD1 1 53 PHE HB2 3.600 . 5.200 3.700 3.466 3.938 . 0 0 "[ . 1 . 2 ]" 1 541 1 18 LEU MD1 1 53 PHE HB3 3.800 . 5.600 3.980 3.734 4.245 . 0 0 "[ . 1 . 2 ]" 1 542 1 18 LEU MD1 1 55 ALA MB 2.400 . 3.100 2.394 2.196 2.696 . 0 0 "[ . 1 . 2 ]" 1 543 1 18 LEU MD1 1 68 CYS HA 3.400 . 4.800 4.570 4.343 4.784 . 0 0 "[ . 1 . 2 ]" 1 544 1 18 LEU MD1 1 69 LEU H 4.100 . 6.200 4.690 4.516 4.873 . 0 0 "[ . 1 . 2 ]" 1 545 1 18 LEU MD1 1 69 LEU HB2 3.000 . 4.100 3.189 2.724 3.808 . 0 0 "[ . 1 . 2 ]" 1 546 1 18 LEU MD1 1 69 LEU QD 2.300 . 3.000 1.981 1.795 2.089 . 0 0 "[ . 1 . 2 ]" 1 547 1 18 LEU MD2 1 19 LYS H 4.800 . 7.000 4.685 4.549 4.809 . 0 0 "[ . 1 . 2 ]" 1 548 1 18 LEU MD2 1 19 LYS H 4.900 . 7.000 4.544 4.430 4.628 . 0 0 "[ . 1 . 2 ]" 1 549 1 18 LEU MD2 1 19 LYS HG3 4.000 . 6.000 5.727 5.552 5.932 . 0 0 "[ . 1 . 2 ]" 1 550 1 18 LEU MD2 1 20 GLU H 4.200 . 6.400 4.894 4.719 5.027 . 0 0 "[ . 1 . 2 ]" 1 551 1 18 LEU MD2 1 23 PHE QB 2.600 . 3.400 3.404 2.921 3.495 0.095 14 0 "[ . 1 . 2 ]" 1 552 1 18 LEU MD2 1 23 PHE QE 4.500 . 7.000 4.476 4.322 4.606 . 0 0 "[ . 1 . 2 ]" 1 553 1 18 LEU MD2 1 29 ILE H 3.100 . 4.300 4.227 4.134 4.351 0.051 9 0 "[ . 1 . 2 ]" 1 554 1 18 LEU MD2 1 55 ALA H 3.200 . 4.500 3.548 3.183 3.776 . 0 0 "[ . 1 . 2 ]" 1 555 1 18 LEU MD2 1 29 ILE MG 6.000 . 7.000 2.939 2.713 3.235 . 0 0 "[ . 1 . 2 ]" 1 556 1 18 LEU MD2 1 67 TYR QD 2.300 . 3.000 2.687 2.524 2.804 . 0 0 "[ . 1 . 2 ]" 1 557 1 18 LEU MD2 1 68 CYS H 3.800 . 5.600 3.789 3.398 4.240 . 0 0 "[ . 1 . 2 ]" 1 558 1 18 LEU MD2 1 67 TYR H 3.600 . 5.200 4.519 4.334 4.701 . 0 0 "[ . 1 . 2 ]" 1 559 1 18 LEU MD2 1 68 CYS H 3.300 . 4.700 3.991 3.563 4.477 . 0 0 "[ . 1 . 2 ]" 1 560 1 18 LEU MD2 1 68 CYS HA 2.900 . 4.000 3.879 3.507 4.006 0.006 15 0 "[ . 1 . 2 ]" 1 561 1 18 LEU MD2 1 69 LEU H 4.100 . 6.200 5.172 4.876 5.380 . 0 0 "[ . 1 . 2 ]" 1 562 1 18 LEU MD2 1 69 LEU HA 3.600 . 5.200 5.179 4.831 5.284 0.084 20 0 "[ . 1 . 2 ]" 1 563 1 18 LEU HG 1 19 LYS H 4.300 . 6.600 4.197 4.130 4.331 . 0 0 "[ . 1 . 2 ]" 1 564 1 18 LEU HG 1 20 GLU H 3.200 . 7.000 5.235 5.095 5.360 . 0 0 "[ . 1 . 2 ]" 1 565 1 18 LEU HG 1 23 PHE QD 3.500 . 5.000 4.903 4.642 5.132 0.132 18 0 "[ . 1 . 2 ]" 1 566 1 18 LEU HG 1 29 ILE MD 2.200 . 2.800 2.822 2.623 2.898 0.098 10 0 "[ . 1 . 2 ]" 1 567 1 18 LEU HG 1 53 PHE QE 3.900 . 7.000 7.048 6.792 7.113 0.113 18 0 "[ . 1 . 2 ]" 1 568 1 18 LEU HG 1 68 CYS HA 3.700 . 5.400 5.463 5.327 5.533 0.133 17 0 "[ . 1 . 2 ]" 1 569 1 19 LYS H 1 19 LYS HA 2.500 . 3.300 2.788 2.761 2.814 . 0 0 "[ . 1 . 2 ]" 1 570 1 19 LYS H 1 19 LYS HB2 2.200 . 2.800 2.418 2.332 2.547 . 0 0 "[ . 1 . 2 ]" 1 571 1 19 LYS H 1 19 LYS HB3 2.700 . 3.600 3.575 3.557 3.604 0.004 20 0 "[ . 1 . 2 ]" 1 572 1 19 LYS H 1 19 LYS QD 3.800 . 4.700 3.063 2.631 3.360 . 0 0 "[ . 1 . 2 ]" 1 573 1 19 LYS H 1 19 LYS HG2 3.900 . 5.800 3.534 3.461 3.596 . 0 0 "[ . 1 . 2 ]" 1 574 1 19 LYS H 1 19 LYS HG3 3.100 . 4.300 2.288 2.130 2.482 . 0 0 "[ . 1 . 2 ]" 1 575 1 19 LYS H 1 20 GLU H 2.500 . 3.300 2.827 2.764 2.946 . 0 0 "[ . 1 . 2 ]" 1 576 1 19 LYS H 1 69 LEU QD 4.000 . 6.000 3.916 3.378 4.347 . 0 0 "[ . 1 . 2 ]" 1 577 1 19 LYS HA 1 19 LYS HB2 2.400 . 3.100 3.015 3.000 3.024 . 0 0 "[ . 1 . 2 ]" 1 578 1 19 LYS HA 1 19 LYS QD 3.100 . 4.300 4.128 3.987 4.203 . 0 0 "[ . 1 . 2 ]" 1 579 1 19 LYS HA 1 19 LYS QE 4.800 . 7.000 4.325 3.591 4.778 . 0 0 "[ . 1 . 2 ]" 1 580 1 19 LYS HA 1 19 LYS HG2 2.700 . 3.600 2.500 2.305 2.695 . 0 0 "[ . 1 . 2 ]" 1 581 1 19 LYS HA 1 19 LYS HG3 2.900 . 4.000 2.924 2.844 3.069 . 0 0 "[ . 1 . 2 ]" 1 582 1 19 LYS HA 1 68 CYS HA 4.100 . 6.200 3.398 3.176 3.544 . 0 0 "[ . 1 . 2 ]" 1 583 1 19 LYS HA 1 69 LEU H 3.400 . 4.800 2.670 2.224 2.899 . 0 0 "[ . 1 . 2 ]" 1 584 1 19 LYS HA 1 69 LEU QD 3.200 . 4.500 4.573 4.442 4.707 0.207 13 0 "[ . 1 . 2 ]" 1 585 1 19 LYS HB2 1 20 GLU H 4.000 . 6.000 3.279 3.066 3.786 . 0 0 "[ . 1 . 2 ]" 1 586 1 19 LYS HB2 1 20 GLU H 3.600 . 5.200 3.116 2.961 3.602 . 0 0 "[ . 1 . 2 ]" 1 587 1 19 LYS HB3 1 20 GLU H 3.300 . 4.700 4.027 3.796 4.321 . 0 0 "[ . 1 . 2 ]" 1 588 1 19 LYS QE 1 68 CYS HA 6.100 . 7.000 6.812 6.252 7.150 0.150 4 0 "[ . 1 . 2 ]" 1 589 1 19 LYS QE 1 69 LEU QD 3.500 . 5.000 3.401 1.945 4.485 0.055 23 0 "[ . 1 . 2 ]" 1 590 1 19 LYS QE 1 71 ALA HA 4.000 . 6.000 5.227 3.167 6.104 0.104 23 0 "[ . 1 . 2 ]" 1 591 1 19 LYS HE3 1 20 GLU H 3.500 . 5.000 4.453 2.806 5.063 0.063 14 0 "[ . 1 . 2 ]" 1 592 1 19 LYS HG2 1 69 LEU H 2.400 . 3.100 3.104 2.816 3.238 0.138 3 0 "[ . 1 . 2 ]" 1 593 1 19 LYS HG2 1 71 ALA H 3.800 . 5.600 5.613 4.162 5.951 0.351 13 0 "[ . 1 . 2 ]" 1 594 1 19 LYS HG3 1 68 CYS HA 3.900 . 5.800 4.981 4.808 5.260 . 0 0 "[ . 1 . 2 ]" 1 595 1 19 LYS HG3 1 69 LEU H 2.700 . 3.600 3.646 3.515 3.745 0.145 8 0 "[ . 1 . 2 ]" 1 596 1 20 GLU H 1 20 GLU HA 2.500 . 3.300 2.885 2.850 2.948 . 0 0 "[ . 1 . 2 ]" 1 597 1 20 GLU H 1 20 GLU HB3 3.100 . 4.300 3.574 3.523 3.648 . 0 0 "[ . 1 . 2 ]" 1 598 1 20 GLU H 1 20 GLU HB3 2.900 . 4.000 3.367 3.164 3.584 . 0 0 "[ . 1 . 2 ]" 1 599 1 20 GLU H 1 20 GLU QG 2.500 . 3.300 2.763 2.459 3.006 . 0 0 "[ . 1 . 2 ]" 1 600 1 20 GLU H 1 21 GLU H 2.600 . 3.400 2.469 2.123 2.625 . 0 0 "[ . 1 . 2 ]" 1 601 1 20 GLU HA 1 20 GLU HB2 2.200 . 7.000 3.012 2.993 3.029 . 0 0 "[ . 1 . 2 ]" 1 602 1 20 GLU HA 1 20 GLU HB3 2.200 . 2.800 2.596 2.491 2.662 . 0 0 "[ . 1 . 2 ]" 1 603 1 20 GLU HA 1 20 GLU QG 3.100 . 4.300 2.374 2.188 2.784 . 0 0 "[ . 1 . 2 ]" 1 604 1 20 GLU HA 1 21 GLU H 3.000 . 4.100 3.440 3.397 3.479 . 0 0 "[ . 1 . 2 ]" 1 605 1 20 GLU HA 1 21 GLU H 6.000 . 7.000 3.115 3.096 3.136 . 0 0 "[ . 1 . 2 ]" 1 606 1 20 GLU HB2 1 21 GLU H 2.800 . 3.800 2.906 2.614 3.149 . 0 0 "[ . 1 . 2 ]" 1 607 1 20 GLU QG 1 21 GLU H 5.100 . 7.000 4.323 4.099 4.482 . 0 0 "[ . 1 . 2 ]" 1 608 1 21 GLU H 1 21 GLU HA 2.200 . 2.800 2.077 2.028 2.129 . 0 0 "[ . 1 . 2 ]" 1 609 1 21 GLU H 1 21 GLU HB2 . . 5.600 3.509 3.418 3.589 . 0 0 "[ . 1 . 2 ]" 1 610 1 21 GLU H 1 21 GLU HB3 . . 5.600 3.691 3.632 3.750 . 0 0 "[ . 1 . 2 ]" 1 611 1 21 GLU H 1 21 GLU HG3 2.900 . 4.000 2.945 2.573 3.373 . 0 0 "[ . 1 . 2 ]" 1 612 1 21 GLU H 1 66 VAL QG 4.100 . 6.200 3.081 2.818 3.494 . 0 0 "[ . 1 . 2 ]" 1 613 1 21 GLU H 1 68 CYS HA 4.000 . 6.000 4.069 3.783 4.358 . 0 0 "[ . 1 . 2 ]" 1 614 1 21 GLU HA 1 21 GLU HB3 2.500 . 3.300 2.414 2.354 2.508 . 0 0 "[ . 1 . 2 ]" 1 615 1 21 GLU HA 1 21 GLU HG3 2.800 . 3.800 3.211 2.807 3.603 . 0 0 "[ . 1 . 2 ]" 1 616 1 21 GLU HA 1 66 VAL QG 2.500 . 3.300 2.477 2.294 2.810 . 0 0 "[ . 1 . 2 ]" 1 617 1 21 GLU HA 1 68 CYS HB3 3.400 . 4.800 4.445 3.200 5.607 0.807 4 9 "[ **+. ** **- . 2* ]" 1 618 1 21 GLU HB2 1 66 VAL QG 3.200 . 4.500 3.552 3.287 3.934 . 0 0 "[ . 1 . 2 ]" 1 619 1 21 GLU HB3 1 66 VAL QG 2.700 . 3.600 2.372 2.087 2.904 . 0 0 "[ . 1 . 2 ]" 1 620 1 21 GLU HG2 1 66 VAL QG 3.000 . 4.100 3.506 3.023 4.092 . 0 0 "[ . 1 . 2 ]" 1 621 1 21 GLU HG2 1 68 CYS HA 3.000 . 4.100 3.915 3.434 4.141 0.041 12 0 "[ . 1 . 2 ]" 1 622 1 21 GLU HG2 1 69 LEU H 3.500 . 5.000 4.867 4.270 5.042 0.042 9 0 "[ . 1 . 2 ]" 1 623 1 21 GLU HG3 1 22 LYS QB 3.400 . 7.000 6.172 5.811 6.590 . 0 0 "[ . 1 . 2 ]" 1 624 1 21 GLU HG3 1 66 VAL QG 4.900 . 7.000 4.438 4.030 4.821 . 0 0 "[ . 1 . 2 ]" 1 625 1 21 GLU HG3 1 68 CYS HA 3.700 . 5.400 4.828 3.852 5.402 0.002 7 0 "[ . 1 . 2 ]" 1 626 1 22 LYS H 1 22 LYS HA 2.700 . 3.600 2.943 2.919 2.958 . 0 0 "[ . 1 . 2 ]" 1 627 1 22 LYS H 1 22 LYS QB 3.600 . 4.800 2.678 2.395 3.289 . 0 0 "[ . 1 . 2 ]" 1 628 1 22 LYS H 1 22 LYS HG2 2.800 . 3.800 2.908 2.079 3.244 . 0 0 "[ . 1 . 2 ]" 1 629 1 22 LYS H 1 23 PHE H 2.200 . 2.800 2.081 1.732 2.363 . 0 0 "[ . 1 . 2 ]" 1 630 1 22 LYS H 1 23 PHE QB 4.500 . 7.000 4.064 3.350 4.251 . 0 0 "[ . 1 . 2 ]" 1 631 1 22 LYS HA 1 22 LYS QB 2.300 . 3.000 2.269 2.164 2.557 . 0 0 "[ . 1 . 2 ]" 1 632 1 22 LYS HA 1 22 LYS QD 3.300 . 4.700 3.736 2.084 4.280 . 0 0 "[ . 1 . 2 ]" 1 633 1 22 LYS HA 1 22 LYS QE 3.800 . 5.600 5.101 3.593 5.566 . 0 0 "[ . 1 . 2 ]" 1 634 1 22 LYS HA 1 22 LYS HG2 2.800 . 3.800 3.588 2.637 4.013 0.213 20 0 "[ . 1 . 2 ]" 1 635 1 22 LYS HA 1 22 LYS HG3 2.900 . 4.000 3.086 2.594 4.026 0.026 21 0 "[ . 1 . 2 ]" 1 636 1 22 LYS HA 1 23 PHE H 6.000 . 7.000 3.461 2.876 3.573 . 0 0 "[ . 1 . 2 ]" 1 637 1 22 LYS HA 1 23 PHE QD 4.400 . 6.800 5.227 4.665 5.453 . 0 0 "[ . 1 . 2 ]" 1 638 1 22 LYS HA 1 60 ASN HD21 3.100 . 4.300 3.410 2.526 4.203 . 0 0 "[ . 1 . 2 ]" 1 639 1 22 LYS HA 1 60 ASN HD22 3.700 . 5.400 3.982 3.141 5.052 . 0 0 "[ . 1 . 2 ]" 1 640 1 22 LYS HA 1 66 VAL QG 2.400 . 3.100 2.847 2.505 3.006 . 0 0 "[ . 1 . 2 ]" 1 641 1 22 LYS QB 1 22 LYS QE 3.900 . 5.800 3.418 2.094 3.807 . 0 0 "[ . 1 . 2 ]" 1 642 1 22 LYS QB 1 22 LYS HG2 . . 3.000 2.275 2.128 2.509 . 0 0 "[ . 1 . 2 ]" 1 643 1 22 LYS QB 1 22 LYS HG3 2.600 . 3.400 2.389 2.134 2.538 . 0 0 "[ . 1 . 2 ]" 1 644 1 22 LYS QB 1 23 PHE H 6.000 . 7.000 2.824 2.226 4.064 . 0 0 "[ . 1 . 2 ]" 1 645 1 22 LYS QB 1 23 PHE QD 3.600 . 5.200 3.550 2.833 4.454 . 0 0 "[ . 1 . 2 ]" 1 646 1 22 LYS QB 1 23 PHE QE 3.500 . 5.000 3.593 2.734 4.321 . 0 0 "[ . 1 . 2 ]" 1 647 1 22 LYS QB 1 23 PHE HZ 3.600 . 5.200 4.479 3.539 5.064 . 0 0 "[ . 1 . 2 ]" 1 648 1 22 LYS QD 1 22 LYS HG2 3.200 . 4.500 2.330 2.145 2.537 . 0 0 "[ . 1 . 2 ]" 1 649 1 22 LYS HD3 1 23 PHE QD 3.300 . 4.700 3.549 3.237 3.881 . 0 0 "[ . 1 . 2 ]" 1 650 1 22 LYS QE 1 22 LYS HG2 2.800 . 3.800 2.662 2.158 3.499 . 0 0 "[ . 1 . 2 ]" 1 651 1 22 LYS QE 1 22 LYS HG3 3.100 . 4.300 2.776 2.215 3.299 . 0 0 "[ . 1 . 2 ]" 1 652 1 22 LYS QE 1 23 PHE QD 4.300 . 6.600 4.310 3.054 5.304 . 0 0 "[ . 1 . 2 ]" 1 653 1 22 LYS QE 1 23 PHE QD 4.100 . 6.200 3.972 3.025 4.456 . 0 0 "[ . 1 . 2 ]" 1 654 1 22 LYS QE 1 23 PHE QE 3.000 . 4.100 3.084 2.101 4.040 . 0 0 "[ . 1 . 2 ]" 1 655 1 22 LYS QE 1 23 PHE HZ 2.900 . 4.000 3.308 2.152 4.090 0.090 6 0 "[ . 1 . 2 ]" 1 656 1 22 LYS HG2 1 23 PHE H 4.000 . 6.000 3.008 2.205 3.547 . 0 0 "[ . 1 . 2 ]" 1 657 1 22 LYS HG2 1 23 PHE QD 3.300 . 4.700 3.566 2.705 5.346 0.646 4 1 "[ +. 1 . 2 ]" 1 658 1 22 LYS HG2 1 23 PHE QE 3.200 . 4.500 3.406 2.721 4.808 0.308 4 0 "[ . 1 . 2 ]" 1 659 1 22 LYS HG3 1 23 PHE H 4.700 . 7.000 3.948 2.513 4.688 . 0 0 "[ . 1 . 2 ]" 1 660 1 22 LYS HG3 1 23 PHE QD 5.100 . 7.000 4.185 2.746 5.192 . 0 0 "[ . 1 . 2 ]" 1 661 1 22 LYS HG3 1 23 PHE QE 3.300 . 4.700 4.108 2.290 4.847 0.147 5 0 "[ . 1 . 2 ]" 1 662 1 22 LYS HG3 1 23 PHE HZ 3.900 . 5.800 4.855 3.095 5.697 . 0 0 "[ . 1 . 2 ]" 1 663 1 23 PHE H 1 23 PHE QB 2.500 . 3.300 2.514 2.149 2.854 . 0 0 "[ . 1 . 2 ]" 1 664 1 23 PHE H 1 23 PHE QD 2.700 . 3.600 2.541 2.126 3.247 . 0 0 "[ . 1 . 2 ]" 1 665 1 23 PHE H 1 24 SER H 4.800 . 7.000 4.454 3.784 4.579 . 0 0 "[ . 1 . 2 ]" 1 666 1 23 PHE H 1 66 VAL HB 3.300 . 4.700 3.428 1.941 3.823 . 0 0 "[ . 1 . 2 ]" 1 667 1 23 PHE H 1 66 VAL QG 3.900 . 5.800 3.552 2.538 3.831 . 0 0 "[ . 1 . 2 ]" 1 668 1 23 PHE H 1 67 TYR H 6.000 . 7.000 3.236 2.569 3.588 . 0 0 "[ . 1 . 2 ]" 1 669 1 23 PHE HA 1 23 PHE QB 2.400 . 3.100 2.334 2.301 2.444 . 0 0 "[ . 1 . 2 ]" 1 670 1 23 PHE HA 1 23 PHE QD 2.300 . 3.000 2.655 2.418 2.876 . 0 0 "[ . 1 . 2 ]" 1 671 1 23 PHE HA 1 23 PHE QE 3.600 . 5.200 4.531 4.324 4.631 . 0 0 "[ . 1 . 2 ]" 1 672 1 23 PHE HA 1 23 PHE HZ 5.100 . 7.000 5.968 5.552 6.074 . 0 0 "[ . 1 . 2 ]" 1 673 1 23 PHE HA 1 24 SER H 2.400 . 3.100 2.148 2.091 2.269 . 0 0 "[ . 1 . 2 ]" 1 674 1 23 PHE HA 1 25 SER H 4.000 . 6.000 3.518 3.251 3.812 . 0 0 "[ . 1 . 2 ]" 1 675 1 23 PHE HA 1 28 GLU QB 4.100 . 6.200 3.295 2.953 3.742 . 0 0 "[ . 1 . 2 ]" 1 676 1 23 PHE QB 1 23 PHE QD 2.100 . 2.700 2.145 2.126 2.161 . 0 0 "[ . 1 . 2 ]" 1 677 1 23 PHE QB 1 23 PHE QE 3.700 . 4.800 3.947 3.929 3.963 . 0 0 "[ . 1 . 2 ]" 1 678 1 23 PHE QB 1 24 SER H 2.900 . 4.000 3.182 2.972 3.779 . 0 0 "[ . 1 . 2 ]" 1 679 1 23 PHE QB 1 24 SER H 4.200 . 6.400 2.907 2.755 3.327 . 0 0 "[ . 1 . 2 ]" 1 680 1 23 PHE QB 1 25 SER H 3.200 . 4.500 3.282 2.928 4.373 . 0 0 "[ . 1 . 2 ]" 1 681 1 23 PHE QB 1 25 SER H 3.100 . 4.300 2.644 2.212 3.046 . 0 0 "[ . 1 . 2 ]" 1 682 1 23 PHE QB 1 29 ILE H 3.900 . 5.800 2.465 2.278 2.695 . 0 0 "[ . 1 . 2 ]" 1 683 1 23 PHE QB 1 29 ILE MG 2.600 . 3.400 2.282 2.070 2.877 . 0 0 "[ . 1 . 2 ]" 1 684 1 23 PHE QB 1 66 VAL HB 3.200 . 4.500 4.316 3.531 4.448 . 0 0 "[ . 1 . 2 ]" 1 685 1 23 PHE QB 1 67 TYR H 4.300 . 6.600 3.880 3.280 4.041 . 0 0 "[ . 1 . 2 ]" 1 686 1 23 PHE QB 1 67 TYR QD 3.000 . 4.100 3.483 3.094 3.749 . 0 0 "[ . 1 . 2 ]" 1 687 1 23 PHE QD 1 24 SER H 3.400 . 4.800 4.157 3.956 4.377 . 0 0 "[ . 1 . 2 ]" 1 688 1 23 PHE QD 1 28 GLU HA 3.600 . 5.200 4.310 4.011 4.693 . 0 0 "[ . 1 . 2 ]" 1 689 1 23 PHE QD 1 28 GLU QB 2.400 . 3.100 2.328 1.956 2.888 . 0 0 "[ . 1 . 2 ]" 1 690 1 23 PHE QD 1 29 ILE HA 2.800 . 3.800 3.458 2.827 3.821 0.021 17 0 "[ . 1 . 2 ]" 1 691 1 23 PHE QD 1 29 ILE HB 5.100 . 7.000 3.242 2.528 3.446 . 0 0 "[ . 1 . 2 ]" 1 692 1 23 PHE QD 1 29 ILE MD 2.900 . 4.000 4.016 3.866 4.099 0.099 11 0 "[ . 1 . 2 ]" 1 693 1 23 PHE QD 1 29 ILE QG 6.200 . 7.000 4.785 4.341 4.933 . 0 0 "[ . 1 . 2 ]" 1 694 1 23 PHE QD 1 32 ALA MB 3.400 . 4.800 3.665 3.286 3.960 . 0 0 "[ . 1 . 2 ]" 1 695 1 23 PHE QD 1 67 TYR H 5.200 . 7.000 5.494 5.189 5.749 . 0 0 "[ . 1 . 2 ]" 1 696 1 23 PHE QE 1 28 GLU QB 6.200 . 7.000 3.898 3.031 4.602 . 0 0 "[ . 1 . 2 ]" 1 697 1 23 PHE QE 1 29 ILE HA 3.600 . 5.200 3.472 2.140 4.103 . 0 0 "[ . 1 . 2 ]" 1 698 1 23 PHE QE 1 32 ALA MB 2.500 . 3.300 2.296 2.017 2.783 . 0 0 "[ . 1 . 2 ]" 1 699 1 23 PHE HZ 1 29 ILE QG 4.100 . 6.200 5.356 4.930 5.690 . 0 0 "[ . 1 . 2 ]" 1 700 1 23 PHE HZ 1 32 ALA MB 2.400 . 3.100 2.485 2.140 2.740 . 0 0 "[ . 1 . 2 ]" 1 701 1 23 PHE HZ 1 36 GLN HG2 3.100 . 4.300 4.121 2.772 5.173 0.873 16 3 "[ . - 1 *+ 2 ]" 1 702 1 24 SER H 1 24 SER QB 3.000 . 4.100 2.820 2.200 3.106 . 0 0 "[ . 1 . 2 ]" 1 703 1 24 SER H 1 25 SER H 2.400 . 3.100 2.291 1.969 2.720 . 0 0 "[ . 1 . 2 ]" 1 704 1 24 SER H 1 28 GLU QB 3.300 . 4.700 3.404 3.097 3.794 . 0 0 "[ . 1 . 2 ]" 1 705 1 24 SER H 1 66 VAL HA 5.100 . 7.000 4.431 4.089 4.672 . 0 0 "[ . 1 . 2 ]" 1 706 1 24 SER H 1 66 VAL QG 3.600 . 5.200 3.339 2.720 3.635 . 0 0 "[ . 1 . 2 ]" 1 707 1 24 SER H 1 67 TYR QD 5.000 . 7.000 5.040 4.748 5.330 . 0 0 "[ . 1 . 2 ]" 1 708 1 24 SER HA 1 24 SER QB 2.400 . 3.100 2.214 2.154 2.545 . 0 0 "[ . 1 . 2 ]" 1 709 1 24 SER HA 1 25 SER H 2.700 . 3.600 3.426 3.204 3.555 . 0 0 "[ . 1 . 2 ]" 1 710 1 24 SER HA 1 66 VAL HA 2.700 . 3.600 1.938 1.860 2.039 . 0 0 "[ . 1 . 2 ]" 1 711 1 24 SER HA 1 66 VAL HB 3.300 . 4.700 3.329 2.849 3.758 . 0 0 "[ . 1 . 2 ]" 1 712 1 24 SER HA 1 66 VAL QG . . 4.000 2.724 2.083 3.147 . 0 0 "[ . 1 . 2 ]" 1 713 1 24 SER HA 1 67 TYR H 2.700 . 3.600 2.612 2.145 2.975 . 0 0 "[ . 1 . 2 ]" 1 714 1 24 SER HA 1 67 TYR QD 3.100 . 4.300 4.155 3.656 4.410 0.110 18 0 "[ . 1 . 2 ]" 1 715 1 24 SER HA 1 67 TYR QE 3.800 . 5.600 5.306 4.902 5.621 0.021 20 0 "[ . 1 . 2 ]" 1 716 1 24 SER QB 1 25 SER H 3.500 . 5.000 3.480 2.906 3.955 . 0 0 "[ . 1 . 2 ]" 1 717 1 24 SER QB 1 25 SER H 3.000 . 4.100 3.062 2.757 3.357 . 0 0 "[ . 1 . 2 ]" 1 718 1 24 SER QB 1 67 TYR QE 4.900 . 7.000 5.123 4.773 5.309 . 0 0 "[ . 1 . 2 ]" 1 719 1 24 SER QB 1 60 ASN HD22 4.200 . 6.400 4.659 4.231 4.987 . 0 0 "[ . 1 . 2 ]" 1 720 1 24 SER QB 1 66 VAL HA 3.000 . 4.100 2.866 2.344 3.604 . 0 0 "[ . 1 . 2 ]" 1 721 1 24 SER QB 1 66 VAL QG 2.100 . 2.700 2.325 1.934 2.792 0.092 4 0 "[ . 1 . 2 ]" 1 722 1 24 SER QB 1 67 TYR QE 4.600 . 7.000 5.965 5.493 6.458 . 0 0 "[ . 1 . 2 ]" 1 723 1 25 SER H 1 25 SER HA 2.900 . 4.000 2.937 2.874 2.958 . 0 0 "[ . 1 . 2 ]" 1 724 1 25 SER H 1 25 SER HB2 3.700 . 5.400 3.792 3.670 3.944 . 0 0 "[ . 1 . 2 ]" 1 725 1 25 SER H 1 26 GLN H 4.200 . 6.400 4.433 4.356 4.489 . 0 0 "[ . 1 . 2 ]" 1 726 1 25 SER H 1 28 GLU H 3.800 . 5.600 3.996 3.751 4.359 . 0 0 "[ . 1 . 2 ]" 1 727 1 25 SER H 1 28 GLU QB 2.700 . 3.600 2.839 2.269 3.330 . 0 0 "[ . 1 . 2 ]" 1 728 1 25 SER H 1 29 ILE MG 4.700 . 7.000 3.979 3.583 4.401 . 0 0 "[ . 1 . 2 ]" 1 729 1 25 SER H 1 29 ILE MG 4.000 . 6.000 3.802 3.499 4.031 . 0 0 "[ . 1 . 2 ]" 1 730 1 25 SER H 1 67 TYR QD 3.900 . 5.800 3.921 3.360 4.597 . 0 0 "[ . 1 . 2 ]" 1 731 1 25 SER H 1 67 TYR QE 3.700 . 5.400 4.609 4.268 4.896 . 0 0 "[ . 1 . 2 ]" 1 732 1 25 SER HA 1 25 SER HB2 2.200 . 2.800 2.576 2.465 2.659 . 0 0 "[ . 1 . 2 ]" 1 733 1 25 SER HA 1 25 SER HB3 2.300 . 3.000 2.364 2.304 2.451 . 0 0 "[ . 1 . 2 ]" 1 734 1 25 SER HA 1 26 GLN H 2.300 . 3.000 2.392 2.251 2.607 . 0 0 "[ . 1 . 2 ]" 1 735 1 25 SER HA 1 26 GLN HA 3.700 . 5.400 4.340 4.309 4.380 . 0 0 "[ . 1 . 2 ]" 1 736 1 25 SER HA 1 26 GLN QB 4.100 . 6.200 4.795 4.660 5.029 . 0 0 "[ . 1 . 2 ]" 1 737 1 25 SER HA 1 26 GLN QG 3.700 . 5.400 3.698 3.461 4.058 . 0 0 "[ . 1 . 2 ]" 1 738 1 25 SER HA 1 27 GLY H 3.700 . 5.400 4.711 3.878 5.060 . 0 0 "[ . 1 . 2 ]" 1 739 1 25 SER HA 1 28 GLU H 4.700 . 7.000 4.888 4.621 5.277 . 0 0 "[ . 1 . 2 ]" 1 740 1 25 SER HA 1 28 GLU QB 4.600 . 7.000 4.877 4.179 5.426 . 0 0 "[ . 1 . 2 ]" 1 741 1 25 SER HA 1 29 ILE MG 4.700 . 7.000 4.703 4.490 4.868 . 0 0 "[ . 1 . 2 ]" 1 742 1 25 SER HA 1 50 LEU QD 4.100 . 6.200 4.538 4.300 4.808 . 0 0 "[ . 1 . 2 ]" 1 743 1 25 SER HA 1 67 TYR QD 3.700 . 5.400 3.597 3.122 4.112 . 0 0 "[ . 1 . 2 ]" 1 744 1 25 SER HA 1 67 TYR QE 2.600 . 3.400 2.593 2.193 2.921 . 0 0 "[ . 1 . 2 ]" 1 745 1 25 SER HB2 1 26 GLN H 2.800 . 3.800 2.417 2.004 2.786 . 0 0 "[ . 1 . 2 ]" 1 746 1 25 SER HB2 1 26 GLN HA 3.600 . 5.200 4.754 4.654 4.905 . 0 0 "[ . 1 . 2 ]" 1 747 1 25 SER HB2 1 27 GLY H 3.000 . 4.100 3.095 2.466 3.399 . 0 0 "[ . 1 . 2 ]" 1 748 1 25 SER HB2 1 28 GLU H 3.800 . 5.600 3.660 3.259 4.052 . 0 0 "[ . 1 . 2 ]" 1 749 1 25 SER HB2 1 29 ILE H 3.800 . 5.600 5.420 4.881 5.655 0.055 18 0 "[ . 1 . 2 ]" 1 750 1 25 SER HB2 1 67 TYR QE 4.100 . 6.200 4.587 4.290 5.060 . 0 0 "[ . 1 . 2 ]" 1 751 1 25 SER HB3 1 26 GLN H 3.400 . 4.800 3.576 3.369 3.839 . 0 0 "[ . 1 . 2 ]" 1 752 1 25 SER HB3 1 28 GLU H 4.500 . 7.000 4.823 4.447 5.121 . 0 0 "[ . 1 . 2 ]" 1 753 1 25 SER HB3 1 67 TYR QE 4.100 . 6.200 4.858 4.546 5.250 . 0 0 "[ . 1 . 2 ]" 1 754 1 26 GLN H 1 26 GLN HA 2.700 . 3.600 2.830 2.791 2.868 . 0 0 "[ . 1 . 2 ]" 1 755 1 26 GLN H 1 26 GLN QB 2.900 . 3.600 2.667 2.541 2.835 . 0 0 "[ . 1 . 2 ]" 1 756 1 26 GLN H 1 26 GLN HE21 3.800 . 5.600 4.441 4.080 4.704 . 0 0 "[ . 1 . 2 ]" 1 757 1 26 GLN H 1 26 GLN QG 2.500 . 3.300 2.066 1.732 2.615 0.068 15 0 "[ . 1 . 2 ]" 1 758 1 26 GLN H 1 27 GLY H 2.800 . 3.800 2.810 2.679 2.960 . 0 0 "[ . 1 . 2 ]" 1 759 1 26 GLN H 1 27 GLY HA3 4.300 . 6.600 4.804 4.530 4.993 . 0 0 "[ . 1 . 2 ]" 1 760 1 26 GLN H 1 28 GLU H 3.900 . 5.800 4.225 3.945 4.537 . 0 0 "[ . 1 . 2 ]" 1 761 1 26 GLN H 1 50 LEU MD1 4.200 . 6.400 4.000 3.477 4.281 . 0 0 "[ . 1 . 2 ]" 1 762 1 26 GLN H 1 67 TYR QD 4.900 . 7.000 4.467 4.099 4.943 . 0 0 "[ . 1 . 2 ]" 1 763 1 26 GLN H 1 67 TYR QE 3.100 . 4.300 2.806 2.355 3.374 . 0 0 "[ . 1 . 2 ]" 1 764 1 26 GLN HA 1 26 GLN QB 2.400 . 3.000 2.265 2.201 2.316 . 0 0 "[ . 1 . 2 ]" 1 765 1 26 GLN HA 1 26 GLN HE21 5.000 . 7.000 5.082 4.078 5.471 . 0 0 "[ . 1 . 2 ]" 1 766 1 26 GLN HA 1 26 GLN QG 3.000 . 4.100 2.640 2.458 3.315 . 0 0 "[ . 1 . 2 ]" 1 767 1 26 GLN HA 1 27 GLY H 3.200 . 4.500 3.552 3.438 3.575 . 0 0 "[ . 1 . 2 ]" 1 768 1 26 GLN HA 1 28 GLU H 4.400 . 6.800 4.245 4.000 4.588 . 0 0 "[ . 1 . 2 ]" 1 769 1 26 GLN HA 1 29 ILE H 3.200 . 4.500 3.675 3.592 3.927 . 0 0 "[ . 1 . 2 ]" 1 770 1 26 GLN HA 1 29 ILE HB 2.600 . 7.000 5.235 4.759 5.603 . 0 0 "[ . 1 . 2 ]" 1 771 1 26 GLN HA 1 29 ILE MD 3.300 . 4.700 4.206 3.965 4.392 . 0 0 "[ . 1 . 2 ]" 1 772 1 26 GLN HA 1 29 ILE QG 3.300 . 4.700 4.316 4.034 4.590 . 0 0 "[ . 1 . 2 ]" 1 773 1 26 GLN HA 1 29 ILE MG 2.500 . 3.300 2.271 2.089 2.560 . 0 0 "[ . 1 . 2 ]" 1 774 1 26 GLN HA 1 30 VAL H 3.700 . 5.400 4.462 4.302 4.681 . 0 0 "[ . 1 . 2 ]" 1 775 1 26 GLN HA 1 30 VAL H 3.700 . 5.400 4.055 3.916 4.365 . 0 0 "[ . 1 . 2 ]" 1 776 1 26 GLN HA 1 30 VAL MG2 3.500 . 5.000 3.808 3.605 4.149 . 0 0 "[ . 1 . 2 ]" 1 777 1 26 GLN HA 1 46 VAL HA 3.800 . 5.600 5.809 5.771 5.891 0.291 22 0 "[ . 1 . 2 ]" 1 778 1 26 GLN HA 1 46 VAL MG1 2.500 . 3.300 2.240 2.110 2.378 . 0 0 "[ . 1 . 2 ]" 1 779 1 26 GLN HA 1 46 VAL MG2 3.300 . 4.700 4.381 4.014 4.782 0.082 17 0 "[ . 1 . 2 ]" 1 780 1 26 GLN HA 1 50 LEU HB2 3.200 . 7.000 5.954 5.501 6.349 . 0 0 "[ . 1 . 2 ]" 1 781 1 26 GLN HA 1 50 LEU MD1 2.900 . 4.000 2.731 2.192 3.090 . 0 0 "[ . 1 . 2 ]" 1 782 1 26 GLN HA 1 67 TYR QD 4.400 . 6.800 4.015 3.789 4.210 . 0 0 "[ . 1 . 2 ]" 1 783 1 26 GLN HA 1 67 TYR QE 3.400 . 4.800 3.382 3.230 3.608 . 0 0 "[ . 1 . 2 ]" 1 784 1 26 GLN QB 1 26 GLN HE21 3.900 . 5.800 3.680 2.532 3.927 . 0 0 "[ . 1 . 2 ]" 1 785 1 26 GLN QB 1 26 GLN HE21 2.500 . 3.300 3.326 2.521 3.619 0.319 6 0 "[ . 1 . 2 ]" 1 786 1 26 GLN QB 1 27 GLY H 2.500 . 3.300 2.228 2.027 3.218 . 0 0 "[ . 1 . 2 ]" 1 787 1 26 GLN QB 1 28 GLU H 3.800 . 5.600 4.433 4.252 4.852 . 0 0 "[ . 1 . 2 ]" 1 788 1 26 GLN QB 1 29 ILE H 4.600 . 7.000 4.768 4.693 4.928 . 0 0 "[ . 1 . 2 ]" 1 789 1 26 GLN QB 1 30 VAL H 2.400 . 7.000 4.003 3.919 4.131 . 0 0 "[ . 1 . 2 ]" 1 790 1 26 GLN QB 1 30 VAL MG2 3.100 . 4.300 3.149 2.796 3.759 . 0 0 "[ . 1 . 2 ]" 1 791 1 26 GLN QB 1 43 GLN HA 3.200 . 4.500 3.611 3.139 4.095 . 0 0 "[ . 1 . 2 ]" 1 792 1 26 GLN QB 1 46 VAL MG1 2.400 . 3.100 1.916 1.845 2.047 . 0 0 "[ . 1 . 2 ]" 1 793 1 26 GLN QB 1 50 LEU MD1 2.300 . 3.000 2.894 2.099 3.037 0.037 19 0 "[ . 1 . 2 ]" 1 794 1 26 GLN QB 1 67 TYR QE 3.800 . 5.600 4.000 3.915 4.125 . 0 0 "[ . 1 . 2 ]" 1 795 1 26 GLN QB 1 67 TYR QE 3.200 . 4.500 4.201 4.051 4.403 . 0 0 "[ . 1 . 2 ]" 1 796 1 26 GLN HE21 1 26 GLN QG 2.600 . 3.400 2.182 2.066 2.310 . 0 0 "[ . 1 . 2 ]" 1 797 1 26 GLN HE21 1 27 GLY H 4.200 . 6.400 4.814 2.339 5.864 . 0 0 "[ . 1 . 2 ]" 1 798 1 26 GLN HE21 1 30 VAL MG2 5.100 . 7.000 5.139 2.570 5.928 . 0 0 "[ . 1 . 2 ]" 1 799 1 26 GLN HE21 1 46 VAL MG1 4.200 . 6.400 4.708 3.374 5.909 . 0 0 "[ . 1 . 2 ]" 1 800 1 26 GLN HE21 1 47 SER H 4.500 . 7.000 5.409 3.740 6.410 . 0 0 "[ . 1 . 2 ]" 1 801 1 26 GLN HE21 1 47 SER QB 2.800 . 3.800 3.223 2.435 3.826 0.026 9 0 "[ . 1 . 2 ]" 1 802 1 26 GLN HE21 1 48 ARG HA 3.300 . 7.000 6.845 6.246 7.041 0.041 18 0 "[ . 1 . 2 ]" 1 803 1 26 GLN HE21 1 50 LEU MD1 2.600 . 3.400 2.988 1.863 3.597 0.197 4 0 "[ . 1 . 2 ]" 1 804 1 26 GLN QG 1 27 GLY H 4.100 . 6.200 3.752 3.096 4.350 . 0 0 "[ . 1 . 2 ]" 1 805 1 26 GLN QG 1 29 ILE MG 3.700 . 5.400 4.185 3.857 5.066 . 0 0 "[ . 1 . 2 ]" 1 806 1 26 GLN QG 1 50 LEU MD1 3.000 . 4.100 2.176 1.774 3.737 0.126 17 0 "[ . 1 . 2 ]" 1 807 1 26 GLN QG 1 67 TYR QE 3.000 . 4.100 2.478 2.137 3.923 . 0 0 "[ . 1 . 2 ]" 1 808 1 27 GLY H 1 27 GLY HA2 2.400 . 3.100 2.736 2.673 2.907 . 0 0 "[ . 1 . 2 ]" 1 809 1 27 GLY H 1 27 GLY HA3 2.100 . 2.700 2.314 2.305 2.331 . 0 0 "[ . 1 . 2 ]" 1 810 1 27 GLY H 1 28 GLU H 2.700 . 3.600 2.989 2.479 3.188 . 0 0 "[ . 1 . 2 ]" 1 811 1 27 GLY H 1 28 GLU HA 3.600 . 7.000 5.533 5.119 5.673 . 0 0 "[ . 1 . 2 ]" 1 812 1 27 GLY H 1 29 ILE H 4.200 . 6.400 4.617 4.025 4.775 . 0 0 "[ . 1 . 2 ]" 1 813 1 27 GLY H 1 30 VAL H 4.800 . 7.000 4.780 4.695 4.903 . 0 0 "[ . 1 . 2 ]" 1 814 1 27 GLY H 1 30 VAL HB 4.200 . 6.400 5.065 4.798 5.623 . 0 0 "[ . 1 . 2 ]" 1 815 1 27 GLY H 1 43 GLN HE21 5.000 . 7.000 5.125 3.638 6.739 . 0 0 "[ . 1 . 2 ]" 1 816 1 27 GLY H 1 43 GLN HG2 3.900 . 5.800 4.701 3.482 5.811 0.011 21 0 "[ . 1 . 2 ]" 1 817 1 27 GLY H 1 43 GLN HG3 4.400 . 6.800 3.764 2.796 6.220 . 0 0 "[ . 1 . 2 ]" 1 818 1 27 GLY H 1 67 TYR QE 5.400 . 7.000 5.398 4.787 5.755 . 0 0 "[ . 1 . 2 ]" 1 819 1 27 GLY HA2 1 28 GLU H 3.200 . 4.500 3.536 3.481 3.576 . 0 0 "[ . 1 . 2 ]" 1 820 1 27 GLY HA2 1 30 VAL H 3.300 . 4.700 3.428 3.232 3.697 . 0 0 "[ . 1 . 2 ]" 1 821 1 27 GLY HA2 1 30 VAL HB 2.300 . 3.000 2.547 2.218 3.017 0.017 4 0 "[ . 1 . 2 ]" 1 822 1 27 GLY HA2 1 30 VAL MG1 3.400 . 4.800 3.682 3.445 4.147 . 0 0 "[ . 1 . 2 ]" 1 823 1 27 GLY HA2 1 30 VAL MG2 2.700 . 3.600 2.076 1.999 2.231 . 0 0 "[ . 1 . 2 ]" 1 824 1 27 GLY HA2 1 31 ALA H 3.900 . 5.800 4.230 3.975 4.761 . 0 0 "[ . 1 . 2 ]" 1 825 1 27 GLY HA2 1 43 GLN HE22 4.500 . 7.000 5.377 2.497 7.560 0.560 6 1 "[ .+ 1 . 2 ]" 1 826 1 27 GLY HA3 1 28 GLU H 2.900 . 4.000 2.928 2.792 3.078 . 0 0 "[ . 1 . 2 ]" 1 827 1 27 GLY HA3 1 29 ILE H 4.600 . 7.000 4.956 4.766 5.217 . 0 0 "[ . 1 . 2 ]" 1 828 1 27 GLY HA3 1 30 VAL H 4.100 . 6.200 4.554 4.434 4.759 . 0 0 "[ . 1 . 2 ]" 1 829 1 27 GLY HA3 1 30 VAL MG2 3.300 . 4.700 3.609 3.537 3.826 . 0 0 "[ . 1 . 2 ]" 1 830 1 28 GLU H 1 28 GLU HA 2.500 . 3.300 2.838 2.794 2.891 . 0 0 "[ . 1 . 2 ]" 1 831 1 28 GLU H 1 28 GLU QB 2.700 . 2.800 2.328 2.044 2.574 . 0 0 "[ . 1 . 2 ]" 1 832 1 28 GLU H 1 29 ILE H 2.600 . 3.400 2.692 2.565 2.811 . 0 0 "[ . 1 . 2 ]" 1 833 1 28 GLU H 1 30 VAL H 3.400 . 4.800 3.793 3.548 4.050 . 0 0 "[ . 1 . 2 ]" 1 834 1 28 GLU H 1 30 VAL H 3.200 . 4.500 3.415 3.298 3.519 . 0 0 "[ . 1 . 2 ]" 1 835 1 28 GLU HA 1 28 GLU QB 2.100 . 7.000 2.419 2.316 2.525 . 0 0 "[ . 1 . 2 ]" 1 836 1 28 GLU HA 1 28 GLU QG 4.100 . 6.200 2.380 2.217 2.623 . 0 0 "[ . 1 . 2 ]" 1 837 1 28 GLU HA 1 29 ILE H 3.700 . 5.400 3.578 3.565 3.595 . 0 0 "[ . 1 . 2 ]" 1 838 1 28 GLU HA 1 29 ILE H 2.700 . 3.600 3.248 3.139 3.307 . 0 0 "[ . 1 . 2 ]" 1 839 1 28 GLU HA 1 31 ALA H 6.000 . 7.000 3.735 3.362 3.954 . 0 0 "[ . 1 . 2 ]" 1 840 1 28 GLU HA 1 31 ALA MB 6.000 . 7.000 3.251 2.716 3.494 . 0 0 "[ . 1 . 2 ]" 1 841 1 28 GLU QB 1 29 ILE H 2.800 . 3.800 2.543 2.347 2.792 . 0 0 "[ . 1 . 2 ]" 1 842 1 28 GLU QB 1 29 ILE H . . 5.800 2.252 2.182 2.364 . 0 0 "[ . 1 . 2 ]" 1 843 1 28 GLU QB 1 30 VAL H 4.500 . 7.000 4.155 3.895 4.276 . 0 0 "[ . 1 . 2 ]" 1 844 1 28 GLU QG 1 30 VAL H 4.200 . 6.400 4.342 3.996 4.528 . 0 0 "[ . 1 . 2 ]" 1 845 1 29 ILE H 1 29 ILE HA 2.900 . 4.000 2.879 2.845 2.892 . 0 0 "[ . 1 . 2 ]" 1 846 1 29 ILE H 1 29 ILE QG 3.300 . 4.700 3.693 3.558 3.869 . 0 0 "[ . 1 . 2 ]" 1 847 1 29 ILE H 1 29 ILE MG 2.600 . 3.400 1.790 1.756 1.837 0.044 22 0 "[ . 1 . 2 ]" 1 848 1 29 ILE H 1 30 VAL H 2.500 . 3.300 2.487 2.415 2.645 . 0 0 "[ . 1 . 2 ]" 1 849 1 29 ILE H 1 30 VAL MG2 4.300 . 6.600 3.928 3.738 4.293 . 0 0 "[ . 1 . 2 ]" 1 850 1 29 ILE H 1 31 ALA H 3.900 . 5.800 4.387 4.218 4.524 . 0 0 "[ . 1 . 2 ]" 1 851 1 29 ILE H 1 46 VAL MG1 4.900 . 7.000 3.835 3.652 4.226 . 0 0 "[ . 1 . 2 ]" 1 852 1 29 ILE H 1 46 VAL QG 3.500 . 5.000 3.666 3.509 3.951 . 0 0 "[ . 1 . 2 ]" 1 853 1 29 ILE HA 1 29 ILE MD 2.400 . 7.000 3.953 3.840 4.009 . 0 0 "[ . 1 . 2 ]" 1 854 1 29 ILE HA 1 29 ILE QG 2.300 . 3.000 2.902 2.756 2.997 . 0 0 "[ . 1 . 2 ]" 1 855 1 29 ILE HA 1 29 ILE MG 2.600 . 3.400 3.060 2.999 3.141 . 0 0 "[ . 1 . 2 ]" 1 856 1 29 ILE HA 1 30 VAL H 2.900 . 4.000 3.247 3.212 3.308 . 0 0 "[ . 1 . 2 ]" 1 857 1 29 ILE HA 1 32 ALA H 2.900 . 4.000 3.067 2.879 3.231 . 0 0 "[ . 1 . 2 ]" 1 858 1 29 ILE HA 1 32 ALA MB 2.400 . 3.100 2.183 2.023 2.323 . 0 0 "[ . 1 . 2 ]" 1 859 1 29 ILE HB 1 29 ILE MG 2.300 . 3.000 2.114 2.086 2.119 . 0 0 "[ . 1 . 2 ]" 1 860 1 29 ILE HB 1 30 VAL MG1 3.300 . 7.000 7.096 7.067 7.133 0.133 10 0 "[ . 1 . 2 ]" 1 861 1 29 ILE MD 1 67 TYR HA 3.200 . 7.000 7.063 7.016 7.135 0.135 4 0 "[ . 1 . 2 ]" 1 862 1 29 ILE MD 1 67 TYR HB2 2.100 . 7.000 4.923 4.775 5.016 . 0 0 "[ . 1 . 2 ]" 1 863 1 29 ILE QG 1 30 VAL H 3.400 . 4.800 3.367 3.224 3.543 . 0 0 "[ . 1 . 2 ]" 1 864 1 29 ILE QG 1 30 VAL HA 2.900 . 4.000 3.479 3.411 3.555 . 0 0 "[ . 1 . 2 ]" 1 865 1 29 ILE QG 1 31 ALA H 4.300 . 6.600 4.728 4.550 4.941 . 0 0 "[ . 1 . 2 ]" 1 866 1 29 ILE QG 1 32 ALA H 4.300 . 6.600 4.281 4.178 4.414 . 0 0 "[ . 1 . 2 ]" 1 867 1 29 ILE QG 1 33 LEU HA 3.700 . 5.400 5.431 5.370 5.474 0.074 6 0 "[ . 1 . 2 ]" 1 868 1 29 ILE QG 1 46 VAL HA 3.600 . 5.200 4.334 4.133 4.559 . 0 0 "[ . 1 . 2 ]" 1 869 1 29 ILE MG 1 46 VAL MG1 2.700 . 3.600 2.272 1.978 2.634 . 0 0 "[ . 1 . 2 ]" 1 870 1 29 ILE MG 1 50 LEU HG 2.200 . 7.000 4.348 3.816 4.657 . 0 0 "[ . 1 . 2 ]" 1 871 1 29 ILE MG 1 67 TYR H 4.800 . 7.000 5.464 5.227 5.790 . 0 0 "[ . 1 . 2 ]" 1 872 1 29 ILE MG 1 67 TYR HA 4.700 . 7.000 6.451 6.247 6.694 . 0 0 "[ . 1 . 2 ]" 1 873 1 29 ILE MG 1 67 TYR HB2 2.700 . 7.000 4.050 3.875 4.302 . 0 0 "[ . 1 . 2 ]" 1 874 1 29 ILE MG 1 67 TYR QD 2.500 . 3.300 3.194 3.098 3.367 0.067 22 0 "[ . 1 . 2 ]" 1 875 1 29 ILE MG 1 67 TYR QE 3.000 . 4.100 4.115 3.966 4.188 0.088 20 0 "[ . 1 . 2 ]" 1 876 1 30 VAL H 1 30 VAL HA 2.500 . 3.300 2.847 2.832 2.867 . 0 0 "[ . 1 . 2 ]" 1 877 1 30 VAL H 1 30 VAL HB 2.200 . 2.800 2.537 2.367 2.670 . 0 0 "[ . 1 . 2 ]" 1 878 1 30 VAL H 1 30 VAL MG2 2.200 . 2.800 2.241 2.058 2.463 . 0 0 "[ . 1 . 2 ]" 1 879 1 30 VAL H 1 31 ALA H 2.600 . 3.400 2.663 2.594 2.747 . 0 0 "[ . 1 . 2 ]" 1 880 1 30 VAL H 1 32 ALA H 6.000 . 7.000 3.890 3.672 4.067 . 0 0 "[ . 1 . 2 ]" 1 881 1 30 VAL H 1 43 GLN H 5.300 . 7.000 5.946 5.785 6.078 . 0 0 "[ . 1 . 2 ]" 1 882 1 30 VAL H 1 43 GLN HA 5.200 . 7.000 5.525 5.223 5.872 . 0 0 "[ . 1 . 2 ]" 1 883 1 30 VAL H 1 46 VAL QG 6.000 . 7.000 2.913 2.778 3.134 . 0 0 "[ . 1 . 2 ]" 1 884 1 30 VAL H 1 46 VAL MG1 6.000 . 7.000 3.088 2.955 3.222 . 0 0 "[ . 1 . 2 ]" 1 885 1 30 VAL HA 1 30 VAL MG1 2.300 . 3.000 2.414 2.323 2.548 . 0 0 "[ . 1 . 2 ]" 1 886 1 30 VAL HA 1 30 VAL MG2 2.200 . 2.800 2.454 2.355 2.540 . 0 0 "[ . 1 . 2 ]" 1 887 1 30 VAL HA 1 31 ALA H 3.100 . 4.300 3.561 3.543 3.577 . 0 0 "[ . 1 . 2 ]" 1 888 1 30 VAL HA 1 31 ALA HA 4.300 . 6.600 4.808 4.746 4.851 . 0 0 "[ . 1 . 2 ]" 1 889 1 30 VAL HA 1 32 ALA H 4.400 . 6.800 4.513 4.282 4.736 . 0 0 "[ . 1 . 2 ]" 1 890 1 30 VAL HA 1 33 LEU H 6.000 . 7.000 3.913 3.737 4.134 . 0 0 "[ . 1 . 2 ]" 1 891 1 30 VAL HA 1 33 LEU HB2 3.000 . 4.100 3.716 3.419 3.967 . 0 0 "[ . 1 . 2 ]" 1 892 1 30 VAL HA 1 33 LEU HB3 4.300 . 6.600 5.409 5.109 5.674 . 0 0 "[ . 1 . 2 ]" 1 893 1 30 VAL HA 1 33 LEU QD 2.800 . 3.800 3.101 2.602 3.824 0.024 16 0 "[ . 1 . 2 ]" 1 894 1 30 VAL HA 1 34 GLN H 3.800 . 5.600 4.685 4.456 5.021 . 0 0 "[ . 1 . 2 ]" 1 895 1 30 VAL HA 1 41 ILE QG 4.800 . 7.000 4.814 4.317 5.447 . 0 0 "[ . 1 . 2 ]" 1 896 1 30 VAL HA 1 41 ILE MG 2.200 . 2.800 2.520 2.269 2.834 0.034 5 0 "[ . 1 . 2 ]" 1 897 1 30 VAL HB 1 30 VAL MG1 2.100 . 2.700 2.117 2.089 2.129 . 0 0 "[ . 1 . 2 ]" 1 898 1 30 VAL HB 1 30 VAL MG2 2.200 . 2.800 2.104 2.084 2.118 . 0 0 "[ . 1 . 2 ]" 1 899 1 30 VAL HB 1 31 ALA H 2.300 . 3.000 2.395 2.281 2.675 . 0 0 "[ . 1 . 2 ]" 1 900 1 30 VAL HB 1 32 ALA H 4.400 . 6.800 4.516 4.376 4.669 . 0 0 "[ . 1 . 2 ]" 1 901 1 30 VAL QG 1 31 ALA H 2.700 . 3.600 3.063 2.885 3.258 . 0 0 "[ . 1 . 2 ]" 1 902 1 30 VAL QG 1 44 SER H 4.100 . 6.200 4.473 4.256 4.878 . 0 0 "[ . 1 . 2 ]" 1 903 1 30 VAL MG1 1 31 ALA HA 2.800 . 3.800 3.446 3.220 3.648 . 0 0 "[ . 1 . 2 ]" 1 904 1 30 VAL MG1 1 34 GLN H 4.200 . 6.400 4.596 4.292 4.907 . 0 0 "[ . 1 . 2 ]" 1 905 1 30 VAL MG1 1 34 GLN QE 2.800 . 3.800 2.254 1.808 2.677 . 0 0 "[ . 1 . 2 ]" 1 906 1 30 VAL MG1 1 34 GLN HG2 4.000 . 6.000 4.383 3.803 4.773 . 0 0 "[ . 1 . 2 ]" 1 907 1 30 VAL MG1 1 34 GLN HG3 3.000 . 4.100 3.333 2.840 3.706 . 0 0 "[ . 1 . 2 ]" 1 908 1 30 VAL MG1 1 42 ASN HA 2.600 . 3.400 2.432 2.028 3.275 . 0 0 "[ . 1 . 2 ]" 1 909 1 30 VAL MG1 1 43 GLN H 3.400 . 4.800 3.235 2.943 3.881 . 0 0 "[ . 1 . 2 ]" 1 910 1 30 VAL MG2 1 31 ALA H 3.300 . 4.700 3.771 3.649 4.008 . 0 0 "[ . 1 . 2 ]" 1 911 1 30 VAL MG2 1 34 GLN HG3 3.200 . 7.000 5.617 5.209 5.975 . 0 0 "[ . 1 . 2 ]" 1 912 1 30 VAL MG2 1 42 ASN H 3.500 . 5.000 4.278 3.816 4.902 . 0 0 "[ . 1 . 2 ]" 1 913 1 30 VAL MG2 1 42 ASN HA 2.900 . 4.000 3.654 3.028 4.010 0.010 8 0 "[ . 1 . 2 ]" 1 914 1 30 VAL MG2 1 43 GLN H 2.900 . 4.000 3.501 3.167 3.784 . 0 0 "[ . 1 . 2 ]" 1 915 1 30 VAL MG2 1 43 GLN HA 2.200 . 2.800 2.126 1.959 2.382 . 0 0 "[ . 1 . 2 ]" 1 916 1 30 VAL MG2 1 46 VAL H 3.200 . 4.500 3.536 3.332 3.945 . 0 0 "[ . 1 . 2 ]" 1 917 1 30 VAL MG2 1 46 VAL HA 2.800 . 7.000 4.288 4.168 4.476 . 0 0 "[ . 1 . 2 ]" 1 918 1 30 VAL MG2 1 46 VAL HB 2.200 . 2.800 2.306 2.094 2.697 . 0 0 "[ . 1 . 2 ]" 1 919 1 31 ALA H 1 31 ALA HA 2.300 . 3.000 2.836 2.809 2.886 . 0 0 "[ . 1 . 2 ]" 1 920 1 31 ALA H 1 31 ALA MB 2.100 . 2.700 2.233 2.139 2.265 . 0 0 "[ . 1 . 2 ]" 1 921 1 31 ALA H 1 32 ALA H 6.000 . 7.000 2.643 2.467 2.720 . 0 0 "[ . 1 . 2 ]" 1 922 1 31 ALA H 1 32 ALA MB 3.600 . 5.200 4.307 4.144 4.387 . 0 0 "[ . 1 . 2 ]" 1 923 1 31 ALA H 1 33 LEU H 3.200 . 4.500 4.458 4.316 4.549 0.049 11 0 "[ . 1 . 2 ]" 1 924 1 31 ALA H 1 41 ILE MG 5.400 . 7.000 4.541 4.374 4.717 . 0 0 "[ . 1 . 2 ]" 1 925 1 31 ALA H 1 41 ILE MG . . 5.000 4.313 4.147 4.597 . 0 0 "[ . 1 . 2 ]" 1 926 1 31 ALA HA 1 32 ALA H 6.000 . 7.000 3.545 3.508 3.565 . 0 0 "[ . 1 . 2 ]" 1 927 1 31 ALA HA 1 34 GLN H 2.500 . 3.300 2.709 2.679 2.745 . 0 0 "[ . 1 . 2 ]" 1 928 1 31 ALA HA 1 35 GLU H 6.000 . 7.000 3.385 3.350 3.413 . 0 0 "[ . 1 . 2 ]" 1 929 1 31 ALA HA 1 34 GLN HB2 2.600 . 3.400 2.558 2.260 3.147 . 0 0 "[ . 1 . 2 ]" 1 930 1 31 ALA HA 1 34 GLN HB3 2.500 . 7.000 4.114 3.784 4.515 . 0 0 "[ . 1 . 2 ]" 1 931 1 31 ALA HA 1 34 GLN QE . . 4.100 3.586 2.568 4.002 . 0 0 "[ . 1 . 2 ]" 1 932 1 31 ALA HA 1 34 GLN HG2 6.000 . 7.000 4.613 3.879 4.870 . 0 0 "[ . 1 . 2 ]" 1 933 1 31 ALA HA 1 34 GLN HG3 6.000 . 7.000 3.405 2.165 3.845 . 0 0 "[ . 1 . 2 ]" 1 934 1 31 ALA HA 1 36 GLN HG2 7.000 . 7.000 5.749 4.823 5.860 . 0 0 "[ . 1 . 2 ]" 1 935 1 31 ALA MB 1 32 ALA H 2.500 . 3.300 2.640 2.504 2.785 . 0 0 "[ . 1 . 2 ]" 1 936 1 31 ALA MB 1 35 GLU QG 3.100 . 4.300 3.689 3.267 4.261 . 0 0 "[ . 1 . 2 ]" 1 937 1 32 ALA H 1 32 ALA HA 2.500 . 3.300 2.786 2.748 2.823 . 0 0 "[ . 1 . 2 ]" 1 938 1 32 ALA H 1 32 ALA MB 2.200 . 2.800 2.232 2.202 2.254 . 0 0 "[ . 1 . 2 ]" 1 939 1 32 ALA H 1 33 LEU H 2.600 . 3.400 2.886 2.790 2.994 . 0 0 "[ . 1 . 2 ]" 1 940 1 32 ALA H 1 34 GLN H 3.600 . 5.200 4.082 3.868 4.215 . 0 0 "[ . 1 . 2 ]" 1 941 1 32 ALA H 1 34 GLN H 4.000 . 6.000 3.926 3.756 4.025 . 0 0 "[ . 1 . 2 ]" 1 942 1 32 ALA HA 1 34 GLN H 3.000 . 4.100 3.374 3.330 3.446 . 0 0 "[ . 1 . 2 ]" 1 943 1 32 ALA HA 1 35 GLU H 2.800 . 3.800 3.609 3.484 3.805 0.005 17 0 "[ . 1 . 2 ]" 1 944 1 32 ALA HA 1 35 GLU QB 2.800 . 3.800 3.150 2.887 3.802 0.002 2 0 "[ . 1 . 2 ]" 1 945 1 32 ALA HA 1 35 GLU QG 6.000 . 7.000 3.327 1.905 4.013 . 0 0 "[ . 1 . 2 ]" 1 946 1 32 ALA MB 1 33 LEU H 2.400 . 3.100 2.474 2.368 2.718 . 0 0 "[ . 1 . 2 ]" 1 947 1 32 ALA MB 1 36 GLN HE21 3.500 . 5.000 4.926 4.512 5.046 0.046 16 0 "[ . 1 . 2 ]" 1 948 1 33 LEU H 1 33 LEU HB2 2.300 . 3.000 2.543 2.477 2.591 . 0 0 "[ . 1 . 2 ]" 1 949 1 33 LEU H 1 33 LEU HB3 2.800 . 3.800 3.643 3.625 3.660 . 0 0 "[ . 1 . 2 ]" 1 950 1 33 LEU H 1 33 LEU QD 2.900 . 4.000 3.099 3.001 3.243 . 0 0 "[ . 1 . 2 ]" 1 951 1 33 LEU H 1 33 LEU HG 2.300 . 3.000 2.339 2.193 2.510 . 0 0 "[ . 1 . 2 ]" 1 952 1 33 LEU H 1 34 GLN H 2.400 . 3.100 2.613 2.461 2.733 . 0 0 "[ . 1 . 2 ]" 1 953 1 33 LEU H 1 35 GLU H 3.600 . 5.200 4.159 4.006 4.341 . 0 0 "[ . 1 . 2 ]" 1 954 1 33 LEU HA 1 33 LEU HB2 2.600 . 3.400 3.018 3.012 3.025 . 0 0 "[ . 1 . 2 ]" 1 955 1 33 LEU HA 1 33 LEU HB3 2.600 . 3.400 2.461 2.432 2.504 . 0 0 "[ . 1 . 2 ]" 1 956 1 33 LEU HA 1 33 LEU QD 2.100 . 2.700 2.285 2.097 2.433 . 0 0 "[ . 1 . 2 ]" 1 957 1 33 LEU HA 1 33 LEU HG 2.500 . 3.300 2.890 2.823 3.044 . 0 0 "[ . 1 . 2 ]" 1 958 1 33 LEU HA 1 36 GLN H 2.700 . 3.600 3.022 2.930 3.198 . 0 0 "[ . 1 . 2 ]" 1 959 1 33 LEU HA 1 36 GLN HB2 6.000 . 7.000 2.222 2.085 2.481 . 0 0 "[ . 1 . 2 ]" 1 960 1 33 LEU HA 1 36 GLN HB3 6.000 . 7.000 3.760 3.635 4.010 . 0 0 "[ . 1 . 2 ]" 1 961 1 33 LEU HA 1 36 GLN QG 3.500 . 5.000 2.294 2.073 2.645 . 0 0 "[ . 1 . 2 ]" 1 962 1 33 LEU HA 1 38 PHE QD 2.500 . 3.300 2.841 2.685 3.214 . 0 0 "[ . 1 . 2 ]" 1 963 1 33 LEU HA 1 38 PHE QE 2.900 . 4.000 3.729 3.479 3.893 . 0 0 "[ . 1 . 2 ]" 1 964 1 33 LEU HB2 1 33 LEU QD 2.600 . 3.100 2.186 2.070 2.290 . 0 0 "[ . 1 . 2 ]" 1 965 1 33 LEU HB2 1 34 GLN H 2.600 . 3.400 2.994 2.764 3.190 . 0 0 "[ . 1 . 2 ]" 1 966 1 33 LEU HB2 1 34 GLN QE 4.600 . 7.000 3.910 3.586 4.039 . 0 0 "[ . 1 . 2 ]" 1 967 1 33 LEU HB2 1 35 GLU H 3.500 . 5.000 3.604 3.400 3.827 . 0 0 "[ . 1 . 2 ]" 1 968 1 33 LEU HB2 1 38 PHE QD 3.400 . 4.800 3.825 3.691 4.268 . 0 0 "[ . 1 . 2 ]" 1 969 1 33 LEU HB3 1 33 LEU QD 2.900 . 4.000 2.083 2.044 2.151 . 0 0 "[ . 1 . 2 ]" 1 970 1 33 LEU HB3 1 34 GLN H 3.400 . 4.800 3.954 3.813 4.099 . 0 0 "[ . 1 . 2 ]" 1 971 1 33 LEU HB3 1 38 PHE H 3.900 . 5.800 4.441 4.224 5.146 . 0 0 "[ . 1 . 2 ]" 1 972 1 33 LEU HB3 1 38 PHE H 3.100 . 4.300 3.559 3.501 3.663 . 0 0 "[ . 1 . 2 ]" 1 973 1 33 LEU HB3 1 38 PHE QB 3.500 . 3.800 2.695 2.403 3.214 . 0 0 "[ . 1 . 2 ]" 1 974 1 33 LEU HB3 1 38 PHE QD 2.600 . 3.400 2.310 2.122 2.776 . 0 0 "[ . 1 . 2 ]" 1 975 1 33 LEU HB3 1 38 PHE QE 3.300 . 4.700 3.819 3.686 4.015 . 0 0 "[ . 1 . 2 ]" 1 976 1 33 LEU HB3 1 38 PHE HZ 3.700 . 5.400 5.547 5.502 5.596 0.196 18 0 "[ . 1 . 2 ]" 1 977 1 33 LEU QD 1 33 LEU HG 2.100 . 2.700 1.885 1.857 1.894 . 0 0 "[ . 1 . 2 ]" 1 978 1 33 LEU QD 1 34 GLN H 4.400 . 6.800 4.234 4.063 4.362 . 0 0 "[ . 1 . 2 ]" 1 979 1 33 LEU QD 1 36 GLN HB2 4.000 . 6.000 3.330 2.992 3.565 . 0 0 "[ . 1 . 2 ]" 1 980 1 33 LEU QD 1 36 GLN HE21 3.900 . 5.800 3.732 2.289 5.162 . 0 0 "[ . 1 . 2 ]" 1 981 1 33 LEU QD 1 36 GLN HE22 3.500 . 5.000 4.541 3.700 4.980 . 0 0 "[ . 1 . 2 ]" 1 982 1 33 LEU QD 1 38 PHE QB 4.900 . 7.000 3.617 3.383 3.897 . 0 0 "[ . 1 . 2 ]" 1 983 1 33 LEU QD 1 38 PHE QD . . 3.300 2.972 2.623 3.254 . 0 0 "[ . 1 . 2 ]" 1 984 1 33 LEU QD 1 38 PHE QE 2.700 . 3.600 2.816 2.417 3.140 . 0 0 "[ . 1 . 2 ]" 1 985 1 33 LEU QD 1 38 PHE HZ 3.900 . 5.800 4.075 3.847 4.293 . 0 0 "[ . 1 . 2 ]" 1 986 1 33 LEU QD 1 46 VAL HA 4.300 . 6.600 4.403 4.023 4.670 . 0 0 "[ . 1 . 2 ]" 1 987 1 33 LEU HG 1 38 PHE QD 4.500 . 7.000 4.817 4.633 5.235 . 0 0 "[ . 1 . 2 ]" 1 988 1 34 GLN H 1 34 GLN HB2 2.300 . 3.000 2.390 2.305 2.643 . 0 0 "[ . 1 . 2 ]" 1 989 1 34 GLN H 1 34 GLN QE 4.800 . 7.000 4.498 3.814 4.829 . 0 0 "[ . 1 . 2 ]" 1 990 1 34 GLN H 1 34 GLN HG2 3.200 . 4.500 3.480 2.662 3.715 . 0 0 "[ . 1 . 2 ]" 1 991 1 34 GLN H 1 34 GLN HG3 2.300 . 3.000 2.615 2.318 2.871 . 0 0 "[ . 1 . 2 ]" 1 992 1 34 GLN H 1 35 GLU H 2.500 . 3.300 2.611 2.494 2.700 . 0 0 "[ . 1 . 2 ]" 1 993 1 34 GLN H 1 35 GLU HA 2.900 . 4.000 3.916 3.873 3.953 . 0 0 "[ . 1 . 2 ]" 1 994 1 34 GLN H 1 36 GLN H 4.100 . 6.200 3.924 3.789 4.112 . 0 0 "[ . 1 . 2 ]" 1 995 1 34 GLN H 1 38 PHE QD 4.700 . 7.000 4.785 4.685 5.022 . 0 0 "[ . 1 . 2 ]" 1 996 1 34 GLN H 1 41 ILE MG 2.900 . 4.000 3.512 3.218 3.840 . 0 0 "[ . 1 . 2 ]" 1 997 1 34 GLN HA 1 34 GLN HB3 2.500 . 3.300 2.562 2.422 2.630 . 0 0 "[ . 1 . 2 ]" 1 998 1 34 GLN HA 1 38 PHE H 2.600 . 3.400 2.884 2.634 3.369 . 0 0 "[ . 1 . 2 ]" 1 999 1 34 GLN HA 1 38 PHE QD 3.100 . 4.300 4.360 4.298 4.431 0.131 16 0 "[ . 1 . 2 ]" 1 1000 1 34 GLN HA 1 39 ASP HA 3.300 . 4.700 4.135 3.605 4.600 . 0 0 "[ . 1 . 2 ]" 1 1001 1 34 GLN HA 1 40 ASN H 3.600 . 5.200 4.658 4.309 5.227 0.027 10 0 "[ . 1 . 2 ]" 1 1002 1 34 GLN HB2 1 34 GLN QE 4.000 . 6.000 3.778 3.221 4.204 . 0 0 "[ . 1 . 2 ]" 1 1003 1 34 GLN HB2 1 35 GLU H 2.700 . 3.600 2.887 2.705 3.375 . 0 0 "[ . 1 . 2 ]" 1 1004 1 34 GLN QE 1 34 GLN HG2 2.500 . 3.300 2.752 2.369 3.171 . 0 0 "[ . 1 . 2 ]" 1 1005 1 34 GLN QE 1 34 GLN HG3 2.800 . 3.800 2.316 2.063 2.574 . 0 0 "[ . 1 . 2 ]" 1 1006 1 34 GLN QE 1 39 ASP HA 4.500 . 7.000 5.286 3.986 5.993 . 0 0 "[ . 1 . 2 ]" 1 1007 1 34 GLN QE 1 41 ILE H 3.400 . 4.800 4.134 3.653 4.562 . 0 0 "[ . 1 . 2 ]" 1 1008 1 34 GLN QE 1 41 ILE H 4.300 . 6.600 3.751 3.463 3.999 . 0 0 "[ . 1 . 2 ]" 1 1009 1 34 GLN QE 1 41 ILE HB 6.000 . 7.000 3.838 3.384 4.635 . 0 0 "[ . 1 . 2 ]" 1 1010 1 34 GLN QE 1 41 ILE MG 3.300 . 4.700 2.545 2.036 3.358 . 0 0 "[ . 1 . 2 ]" 1 1011 1 34 GLN HG2 1 39 ASP HA 3.200 . 4.500 3.612 3.053 4.366 . 0 0 "[ . 1 . 2 ]" 1 1012 1 34 GLN HG2 1 41 ILE H 4.200 . 6.400 4.212 3.511 4.837 . 0 0 "[ . 1 . 2 ]" 1 1013 1 34 GLN HG2 1 41 ILE MG 3.200 . 4.500 3.555 2.770 4.060 . 0 0 "[ . 1 . 2 ]" 1 1014 1 34 GLN HG3 1 41 ILE H 4.100 . 6.200 4.209 3.756 4.826 . 0 0 "[ . 1 . 2 ]" 1 1015 1 35 GLU H 1 35 GLU HA 2.600 . 3.400 2.883 2.859 2.954 . 0 0 "[ . 1 . 2 ]" 1 1016 1 35 GLU H 1 35 GLU QB 2.300 . 3.000 2.448 2.340 2.602 . 0 0 "[ . 1 . 2 ]" 1 1017 1 35 GLU H 1 35 GLU QG 2.900 . 4.000 2.395 2.189 2.693 . 0 0 "[ . 1 . 2 ]" 1 1018 1 35 GLU H 1 36 GLN H 2.500 . 3.300 2.451 2.117 2.563 . 0 0 "[ . 1 . 2 ]" 1 1019 1 35 GLU H 1 36 GLN HG2 4.100 . 6.200 4.381 4.092 4.575 . 0 0 "[ . 1 . 2 ]" 1 1020 1 35 GLU H 1 37 GLY H 3.600 . 5.200 4.527 4.264 4.729 . 0 0 "[ . 1 . 2 ]" 1 1021 1 35 GLU H 1 38 PHE H 3.500 . 5.000 4.061 3.845 4.350 . 0 0 "[ . 1 . 2 ]" 1 1022 1 35 GLU HA 1 35 GLU QG 2.800 . 3.800 2.549 2.305 3.366 . 0 0 "[ . 1 . 2 ]" 1 1023 1 35 GLU HA 1 36 GLN H 2.800 . 3.800 3.502 3.392 3.550 . 0 0 "[ . 1 . 2 ]" 1 1024 1 35 GLU QB 1 36 GLN H 6.000 . 7.000 2.845 2.647 3.798 . 0 0 "[ . 1 . 2 ]" 1 1025 1 35 GLU QG 1 36 GLN H 2.400 . 3.400 3.334 2.642 3.401 0.001 20 0 "[ . 1 . 2 ]" 1 1026 1 36 GLN H 1 36 GLN HA 2.500 . 3.300 2.830 2.791 2.909 . 0 0 "[ . 1 . 2 ]" 1 1027 1 36 GLN H 1 36 GLN HB2 2.300 . 3.000 2.334 2.258 2.448 . 0 0 "[ . 1 . 2 ]" 1 1028 1 36 GLN H 1 36 GLN HG2 2.500 . 3.300 2.845 2.459 3.207 . 0 0 "[ . 1 . 2 ]" 1 1029 1 36 GLN H 1 37 GLY H 2.300 . 3.000 2.823 2.604 2.978 . 0 0 "[ . 1 . 2 ]" 1 1030 1 36 GLN H 1 37 GLY HA2 4.100 . 6.200 4.997 4.726 5.124 . 0 0 "[ . 1 . 2 ]" 1 1031 1 36 GLN H 1 38 PHE H 3.000 . 4.100 4.103 3.838 4.176 0.076 22 0 "[ . 1 . 2 ]" 1 1032 1 36 GLN HA 1 36 GLN HB2 2.500 . 3.300 3.010 2.989 3.030 . 0 0 "[ . 1 . 2 ]" 1 1033 1 36 GLN HA 1 36 GLN HB3 2.000 . 2.500 2.576 2.529 2.632 0.132 2 0 "[ . 1 . 2 ]" 1 1034 1 36 GLN HA 1 36 GLN HE21 3.900 . 5.800 4.543 3.544 5.144 . 0 0 "[ . 1 . 2 ]" 1 1035 1 36 GLN HA 1 36 GLN HE22 4.800 . 7.000 5.049 4.670 5.550 . 0 0 "[ . 1 . 2 ]" 1 1036 1 36 GLN HA 1 36 GLN QG 2.400 . 3.100 2.370 2.239 2.585 . 0 0 "[ . 1 . 2 ]" 1 1037 1 36 GLN HA 1 37 GLY H 2.900 . 4.000 3.577 3.564 3.586 . 0 0 "[ . 1 . 2 ]" 1 1038 1 36 GLN HB2 1 36 GLN HE21 3.400 . 4.800 4.161 3.700 4.593 . 0 0 "[ . 1 . 2 ]" 1 1039 1 36 GLN HB2 1 36 GLN QG 2.300 . 3.000 2.145 2.134 2.200 . 0 0 "[ . 1 . 2 ]" 1 1040 1 36 GLN HB2 1 37 GLY H 3.000 . 4.100 2.413 2.181 2.667 . 0 0 "[ . 1 . 2 ]" 1 1041 1 36 GLN HB2 1 38 PHE QD 2.500 . 3.300 2.441 2.233 2.611 . 0 0 "[ . 1 . 2 ]" 1 1042 1 36 GLN HB2 1 38 PHE QE 2.800 . 3.800 2.767 2.417 2.928 . 0 0 "[ . 1 . 2 ]" 1 1043 1 36 GLN HB3 1 36 GLN HE21 2.800 . 3.800 3.676 3.218 3.985 0.185 12 0 "[ . 1 . 2 ]" 1 1044 1 36 GLN HB3 1 36 GLN HE22 3.700 . 5.400 4.068 3.847 4.216 . 0 0 "[ . 1 . 2 ]" 1 1045 1 36 GLN HB3 1 37 GLY H 3.000 . 4.100 3.146 2.902 3.395 . 0 0 "[ . 1 . 2 ]" 1 1046 1 36 GLN HB3 1 38 PHE QD 2.600 . 3.400 3.469 3.399 3.520 0.120 21 0 "[ . 1 . 2 ]" 1 1047 1 36 GLN HB3 1 38 PHE HZ 3.200 . 4.500 4.507 4.271 4.629 0.129 11 0 "[ . 1 . 2 ]" 1 1048 1 36 GLN HE21 1 36 GLN HG3 2.500 . 3.300 2.503 2.134 3.254 . 0 0 "[ . 1 . 2 ]" 1 1049 1 36 GLN HE22 1 36 GLN QG 3.100 . 4.300 3.246 3.220 3.282 . 0 0 "[ . 1 . 2 ]" 1 1050 1 36 GLN QG 1 38 PHE QD 3.200 . 4.500 3.983 3.894 4.134 . 0 0 "[ . 1 . 2 ]" 1 1051 1 37 GLY H 1 37 GLY HA2 2.200 . 2.800 2.707 2.628 2.758 . 0 0 "[ . 1 . 2 ]" 1 1052 1 37 GLY H 1 37 GLY HA3 2.400 . 3.100 2.899 2.862 2.940 . 0 0 "[ . 1 . 2 ]" 1 1053 1 37 GLY H 1 38 PHE H 2.400 . 3.100 1.840 1.692 2.005 0.008 8 0 "[ . 1 . 2 ]" 1 1054 1 37 GLY H 1 38 PHE QD 3.000 . 4.100 2.721 2.311 3.090 . 0 0 "[ . 1 . 2 ]" 1 1055 1 37 GLY HA2 1 38 PHE H 3.000 . 4.100 2.955 2.732 3.308 . 0 0 "[ . 1 . 2 ]" 1 1056 1 37 GLY HA3 1 38 PHE H 2.300 . 3.000 2.655 2.486 2.692 . 0 0 "[ . 1 . 2 ]" 1 1057 1 37 GLY HA3 1 38 PHE QE 3.300 . 4.700 4.745 4.643 4.811 0.111 8 0 "[ . 1 . 2 ]" 1 1058 1 38 PHE H 1 38 PHE HA 2.600 . 3.400 2.959 2.903 2.970 . 0 0 "[ . 1 . 2 ]" 1 1059 1 38 PHE H 1 38 PHE QB 2.900 . 3.100 2.649 2.489 2.813 . 0 0 "[ . 1 . 2 ]" 1 1060 1 38 PHE H 1 38 PHE QD 2.200 . 2.800 2.778 1.988 2.912 0.112 17 0 "[ . 1 . 2 ]" 1 1061 1 38 PHE H 1 38 PHE QE 3.700 . 5.400 4.613 3.984 4.802 . 0 0 "[ . 1 . 2 ]" 1 1062 1 38 PHE H 1 39 ASP H 3.700 . 5.400 4.289 4.019 4.611 . 0 0 "[ . 1 . 2 ]" 1 1063 1 38 PHE H 1 41 ILE MG 5.200 . 7.000 4.536 4.415 4.712 . 0 0 "[ . 1 . 2 ]" 1 1064 1 38 PHE HA 1 38 PHE QB 2.200 . 2.800 2.329 2.284 2.357 . 0 0 "[ . 1 . 2 ]" 1 1065 1 38 PHE HA 1 38 PHE QD 2.300 . 3.000 2.816 2.634 3.015 0.015 14 0 "[ . 1 . 2 ]" 1 1066 1 38 PHE HA 1 38 PHE QE 3.900 . 5.800 4.634 4.505 4.830 . 0 0 "[ . 1 . 2 ]" 1 1067 1 38 PHE HA 1 39 ASP H 2.200 . 2.800 2.222 2.112 2.560 . 0 0 "[ . 1 . 2 ]" 1 1068 1 38 PHE QB 1 38 PHE QD 2.200 . 2.800 2.133 2.111 2.149 . 0 0 "[ . 1 . 2 ]" 1 1069 1 38 PHE QB 1 39 ASP H 2.700 . 3.600 3.082 2.169 3.535 . 0 0 "[ . 1 . 2 ]" 1 1070 1 38 PHE QB 1 40 ASN H 4.100 . 6.200 4.089 2.879 5.594 . 0 0 "[ . 1 . 2 ]" 1 1071 1 38 PHE QB 1 41 ILE H 4.600 . 7.000 4.298 4.032 4.712 . 0 0 "[ . 1 . 2 ]" 1 1072 1 38 PHE QB 1 41 ILE MD 3.200 . 4.500 3.277 2.006 4.110 . 0 0 "[ . 1 . 2 ]" 1 1073 1 38 PHE QB 1 41 ILE QG 3.400 . 4.800 2.672 2.154 4.113 . 0 0 "[ . 1 . 2 ]" 1 1074 1 38 PHE QB 1 41 ILE MG 4.700 . 7.000 3.890 3.678 4.103 . 0 0 "[ . 1 . 2 ]" 1 1075 1 38 PHE QD 1 39 ASP H 3.500 . 5.000 4.234 3.638 4.748 . 0 0 "[ . 1 . 2 ]" 1 1076 1 38 PHE QD 1 40 ASN H 5.300 . 7.000 5.810 4.495 7.268 0.268 10 0 "[ . 1 . 2 ]" 1 1077 1 38 PHE QD 1 41 ILE QG 4.000 . 6.000 4.127 3.718 5.534 . 0 0 "[ . 1 . 2 ]" 1 1078 1 38 PHE QD 1 41 ILE MG 5.200 . 7.000 5.122 4.749 5.418 . 0 0 "[ . 1 . 2 ]" 1 1079 1 39 ASP H 1 39 ASP HA 2.500 . 3.300 2.908 2.825 2.958 . 0 0 "[ . 1 . 2 ]" 1 1080 1 39 ASP H 1 39 ASP QB 2.500 . 3.300 2.572 2.262 3.111 . 0 0 "[ . 1 . 2 ]" 1 1081 1 39 ASP H 1 40 ASN H 2.800 . 3.800 3.175 2.145 4.180 0.380 18 0 "[ . 1 . 2 ]" 1 1082 1 39 ASP HA 1 39 ASP HB2 2.800 . 3.800 2.660 2.441 3.030 . 0 0 "[ . 1 . 2 ]" 1 1083 1 39 ASP HA 1 39 ASP HB3 2.200 . 2.800 2.849 2.289 3.036 0.236 17 0 "[ . 1 . 2 ]" 1 1084 1 39 ASP HA 1 40 ASN H 2.300 . 3.000 2.739 2.018 3.452 0.452 22 0 "[ . 1 . 2 ]" 1 1085 1 39 ASP HA 1 41 ILE H 3.300 . 4.700 3.693 3.009 4.191 . 0 0 "[ . 1 . 2 ]" 1 1086 1 39 ASP HA 1 41 ILE H 2.700 . 3.600 2.776 2.618 2.839 . 0 0 "[ . 1 . 2 ]" 1 1087 1 39 ASP HA 1 41 ILE MG 3.700 . 5.400 5.355 4.886 5.540 0.140 8 0 "[ . 1 . 2 ]" 1 1088 1 39 ASP QB 1 40 ASN H 2.700 . 3.600 3.383 2.227 3.776 0.176 13 0 "[ . 1 . 2 ]" 1 1089 1 39 ASP QB 1 41 ILE H 4.200 . 6.400 5.027 4.277 5.555 . 0 0 "[ . 1 . 2 ]" 1 1090 1 39 ASP HB2 1 40 ASN H 3.000 . 4.100 4.003 3.031 4.235 0.135 11 0 "[ . 1 . 2 ]" 1 1091 1 40 ASN H 1 40 ASN HA 2.200 . 2.800 2.658 2.284 2.939 0.139 20 0 "[ . 1 . 2 ]" 1 1092 1 40 ASN H 1 40 ASN HB2 2.900 . 4.000 3.129 2.329 3.948 . 0 0 "[ . 1 . 2 ]" 1 1093 1 40 ASN H 1 40 ASN HB3 2.900 . 4.000 3.194 2.608 3.862 . 0 0 "[ . 1 . 2 ]" 1 1094 1 40 ASN H 1 40 ASN QD 3.900 . 5.800 4.407 3.246 5.452 . 0 0 "[ . 1 . 2 ]" 1 1095 1 40 ASN H 1 40 ASN QD 4.700 . 7.000 4.233 3.191 5.152 . 0 0 "[ . 1 . 2 ]" 1 1096 1 40 ASN H 1 41 ILE H 2.500 . 3.300 2.766 1.888 3.389 0.089 9 0 "[ . 1 . 2 ]" 1 1097 1 40 ASN H 1 41 ILE HB 4.700 . 7.000 3.968 3.197 4.798 . 0 0 "[ . 1 . 2 ]" 1 1098 1 40 ASN H 1 41 ILE MD 4.500 . 7.000 4.737 2.729 6.487 . 0 0 "[ . 1 . 2 ]" 1 1099 1 40 ASN H 1 41 ILE MG 3.500 . 7.000 5.239 4.603 5.881 . 0 0 "[ . 1 . 2 ]" 1 1100 1 40 ASN HA 1 40 ASN HB2 2.400 . 3.100 2.632 2.380 3.035 . 0 0 "[ . 1 . 2 ]" 1 1101 1 40 ASN HA 1 40 ASN HB3 2.300 . 3.000 2.913 2.351 3.037 0.037 7 0 "[ . 1 . 2 ]" 1 1102 1 40 ASN HA 1 40 ASN QD 3.400 . 4.800 3.067 2.051 4.061 . 0 0 "[ . 1 . 2 ]" 1 1103 1 40 ASN HA 1 41 ILE H 2.600 . 3.400 2.667 2.440 3.059 . 0 0 "[ . 1 . 2 ]" 1 1104 1 40 ASN HA 1 41 ILE HA 3.200 . 4.500 4.466 4.379 4.576 0.076 21 0 "[ . 1 . 2 ]" 1 1105 1 40 ASN HB2 1 40 ASN QD 3.100 . 4.300 2.668 2.113 3.346 . 0 0 "[ . 1 . 2 ]" 1 1106 1 40 ASN HB2 1 41 ILE H 3.100 . 4.300 3.777 3.621 3.977 . 0 0 "[ . 1 . 2 ]" 1 1107 1 40 ASN HB3 1 40 ASN QD 2.800 . 3.800 2.847 2.125 3.358 . 0 0 "[ . 1 . 2 ]" 1 1108 1 41 ILE H 1 41 ILE HA 2.600 . 3.400 2.939 2.913 2.958 . 0 0 "[ . 1 . 2 ]" 1 1109 1 41 ILE H 1 41 ILE HB 2.300 . 3.000 2.512 2.240 2.781 . 0 0 "[ . 1 . 2 ]" 1 1110 1 41 ILE H 1 41 ILE MD 3.300 . 4.700 3.819 2.589 4.738 0.038 7 0 "[ . 1 . 2 ]" 1 1111 1 41 ILE H 1 41 ILE QG 3.400 . 4.800 3.772 3.140 4.202 . 0 0 "[ . 1 . 2 ]" 1 1112 1 41 ILE H 1 42 ASN H 3.700 . 5.400 4.349 4.237 4.485 . 0 0 "[ . 1 . 2 ]" 1 1113 1 41 ILE HA 1 41 ILE HB 2.500 . 3.300 2.953 2.803 2.998 . 0 0 "[ . 1 . 2 ]" 1 1114 1 41 ILE HA 1 41 ILE MD 2.200 . 2.800 2.345 2.070 2.750 . 0 0 "[ . 1 . 2 ]" 1 1115 1 41 ILE HA 1 41 ILE QG 3.500 . 5.000 2.330 2.127 2.572 . 0 0 "[ . 1 . 2 ]" 1 1116 1 41 ILE HA 1 41 ILE MG 2.500 . 3.300 2.800 2.636 3.079 . 0 0 "[ . 1 . 2 ]" 1 1117 1 41 ILE HA 1 42 ASN H 2.100 . 2.700 2.179 2.086 2.394 . 0 0 "[ . 1 . 2 ]" 1 1118 1 41 ILE HA 1 42 ASN HA 4.100 . 6.200 4.452 4.390 4.563 . 0 0 "[ . 1 . 2 ]" 1 1119 1 41 ILE HA 1 45 LYS QD 2.600 . 3.400 3.174 2.387 3.478 0.078 7 0 "[ . 1 . 2 ]" 1 1120 1 41 ILE HB 1 41 ILE MG 2.200 . 2.800 2.117 2.102 2.128 . 0 0 "[ . 1 . 2 ]" 1 1121 1 41 ILE HB 1 42 ASN H 3.200 . 4.500 4.319 3.956 4.525 0.025 19 0 "[ . 1 . 2 ]" 1 1122 1 41 ILE MD 1 42 ASN H 2.800 . 3.800 3.207 1.910 3.977 0.177 6 0 "[ . 1 . 2 ]" 1 1123 1 41 ILE MD 1 45 LYS QD 3.100 . 4.300 3.635 3.432 4.210 . 0 0 "[ . 1 . 2 ]" 1 1124 1 41 ILE QG 1 41 ILE MG 3.000 . 4.100 2.291 2.085 2.528 . 0 0 "[ . 1 . 2 ]" 1 1125 1 41 ILE QG 1 42 ASN H 3.000 . 4.100 3.780 2.392 4.032 . 0 0 "[ . 1 . 2 ]" 1 1126 1 41 ILE QG 1 42 ASN H 3.400 . 4.800 3.355 2.377 3.743 . 0 0 "[ . 1 . 2 ]" 1 1127 1 41 ILE MG 1 42 ASN H 2.700 . 3.600 2.625 2.034 3.093 . 0 0 "[ . 1 . 2 ]" 1 1128 1 41 ILE MG 1 42 ASN HA 3.500 . 5.000 3.281 2.854 3.711 . 0 0 "[ . 1 . 2 ]" 1 1129 1 41 ILE MG 1 43 GLN H 3.700 . 5.400 4.334 4.120 4.579 . 0 0 "[ . 1 . 2 ]" 1 1130 1 41 ILE MG 1 43 GLN H 3.400 . 4.800 3.242 3.065 3.445 . 0 0 "[ . 1 . 2 ]" 1 1131 1 41 ILE MG 1 45 LYS H 3.700 . 5.400 4.169 3.937 4.478 . 0 0 "[ . 1 . 2 ]" 1 1132 1 41 ILE MG 1 46 VAL H 3.200 . 4.500 3.517 3.429 3.587 . 0 0 "[ . 1 . 2 ]" 1 1133 1 42 ASN H 1 42 ASN HA 2.800 . 3.800 2.913 2.790 2.963 . 0 0 "[ . 1 . 2 ]" 1 1134 1 42 ASN H 1 42 ASN HB2 3.600 . 5.200 3.906 3.703 4.093 . 0 0 "[ . 1 . 2 ]" 1 1135 1 42 ASN H 1 42 ASN HB3 3.200 . 4.500 3.388 3.076 3.711 . 0 0 "[ . 1 . 2 ]" 1 1136 1 42 ASN H 1 42 ASN HD21 3.800 . 5.600 3.950 2.942 5.036 . 0 0 "[ . 1 . 2 ]" 1 1137 1 42 ASN H 1 42 ASN HD22 6.000 . 7.000 4.181 3.283 4.980 . 0 0 "[ . 1 . 2 ]" 1 1138 1 42 ASN H 1 43 GLN H 4.400 . 6.800 4.414 4.349 4.534 . 0 0 "[ . 1 . 2 ]" 1 1139 1 42 ASN H 1 43 GLN HA 5.000 . 7.000 5.173 4.937 5.467 . 0 0 "[ . 1 . 2 ]" 1 1140 1 42 ASN H 1 43 GLN HB2 4.700 . 7.000 5.083 4.567 5.577 . 0 0 "[ . 1 . 2 ]" 1 1141 1 42 ASN H 1 44 SER H 5.100 . 7.000 4.896 4.405 5.260 . 0 0 "[ . 1 . 2 ]" 1 1142 1 42 ASN H 1 45 LYS H 3.200 . 4.500 3.468 3.058 3.869 . 0 0 "[ . 1 . 2 ]" 1 1143 1 42 ASN H 1 45 LYS HA 4.300 . 6.600 5.050 4.656 5.460 . 0 0 "[ . 1 . 2 ]" 1 1144 1 42 ASN H 1 45 LYS QB 2.200 . 2.800 2.284 2.016 2.700 . 0 0 "[ . 1 . 2 ]" 1 1145 1 42 ASN H 1 45 LYS QD 2.800 . 3.800 3.548 3.017 3.829 0.029 1 0 "[ . 1 . 2 ]" 1 1146 1 42 ASN H 1 45 LYS QG 3.900 . 5.800 3.890 3.122 4.506 . 0 0 "[ . 1 . 2 ]" 1 1147 1 42 ASN H 1 46 VAL H 3.700 . 5.400 4.030 3.534 4.806 . 0 0 "[ . 1 . 2 ]" 1 1148 1 42 ASN HA 1 42 ASN HB2 2.200 . 2.800 2.494 2.376 2.583 . 0 0 "[ . 1 . 2 ]" 1 1149 1 42 ASN HA 1 42 ASN HB3 2.000 . 2.500 2.423 2.353 2.533 0.033 10 0 "[ . 1 . 2 ]" 1 1150 1 42 ASN HA 1 42 ASN HD21 3.400 . 4.800 4.316 3.920 4.636 . 0 0 "[ . 1 . 2 ]" 1 1151 1 42 ASN HA 1 43 GLN H 2.700 . 3.600 2.550 2.413 2.662 . 0 0 "[ . 1 . 2 ]" 1 1152 1 42 ASN HA 1 43 GLN HA 3.900 . 5.800 4.308 4.286 4.335 . 0 0 "[ . 1 . 2 ]" 1 1153 1 42 ASN HB2 1 42 ASN HD21 2.900 . 4.000 3.125 2.450 3.472 . 0 0 "[ . 1 . 2 ]" 1 1154 1 42 ASN HB2 1 42 ASN HD22 3.600 . 5.200 3.886 3.576 4.053 . 0 0 "[ . 1 . 2 ]" 1 1155 1 42 ASN HB2 1 43 GLN H 2.400 . 3.100 2.181 1.936 2.436 . 0 0 "[ . 1 . 2 ]" 1 1156 1 42 ASN HB2 1 44 SER H 3.400 . 4.800 3.193 2.568 3.763 . 0 0 "[ . 1 . 2 ]" 1 1157 1 42 ASN HB2 1 45 LYS H 4.000 . 6.000 4.233 3.736 5.111 . 0 0 "[ . 1 . 2 ]" 1 1158 1 42 ASN HB3 1 42 ASN HD21 2.600 . 3.400 2.260 2.135 2.643 . 0 0 "[ . 1 . 2 ]" 1 1159 1 42 ASN HB3 1 42 ASN HD22 3.100 . 4.300 3.500 3.449 3.651 . 0 0 "[ . 1 . 2 ]" 1 1160 1 42 ASN HB3 1 43 GLN H 2.900 . 4.000 3.594 3.410 3.755 . 0 0 "[ . 1 . 2 ]" 1 1161 1 42 ASN HB3 1 44 SER H 3.700 . 5.400 4.652 4.264 5.011 . 0 0 "[ . 1 . 2 ]" 1 1162 1 42 ASN HD21 1 43 GLN H 4.400 . 6.800 4.319 2.574 5.121 . 0 0 "[ . 1 . 2 ]" 1 1163 1 42 ASN HD21 1 45 LYS H 4.300 . 6.600 4.198 3.763 4.332 . 0 0 "[ . 1 . 2 ]" 1 1164 1 42 ASN HD22 1 44 SER H 5.000 . 7.000 4.684 3.518 5.341 . 0 0 "[ . 1 . 2 ]" 1 1165 1 42 ASN HD22 1 44 SER HB2 3.800 . 5.600 3.937 2.596 5.264 . 0 0 "[ . 1 . 2 ]" 1 1166 1 42 ASN HD22 1 45 LYS H 4.400 . 6.800 3.905 3.291 4.277 . 0 0 "[ . 1 . 2 ]" 1 1167 1 42 ASN HD22 1 45 LYS QD 4.600 . 7.000 3.820 2.551 6.523 . 0 0 "[ . 1 . 2 ]" 1 1168 1 42 ASN HD22 1 45 LYS QG 4.300 . 6.600 5.196 4.321 6.146 . 0 0 "[ . 1 . 2 ]" 1 1169 1 43 GLN H 1 43 GLN HA 2.600 . 3.400 2.785 2.750 2.813 . 0 0 "[ . 1 . 2 ]" 1 1170 1 43 GLN H 1 43 GLN HB2 2.300 . 3.000 2.266 2.105 2.607 . 0 0 "[ . 1 . 2 ]" 1 1171 1 43 GLN H 1 43 GLN HB3 2.600 . 3.400 2.853 2.402 3.084 . 0 0 "[ . 1 . 2 ]" 1 1172 1 43 GLN H 1 43 GLN HE22 5.200 . 7.000 5.633 4.092 6.304 . 0 0 "[ . 1 . 2 ]" 1 1173 1 43 GLN H 1 43 GLN HG2 3.300 . 4.700 4.548 4.386 4.645 . 0 0 "[ . 1 . 2 ]" 1 1174 1 43 GLN H 1 43 GLN HG3 3.600 . 5.200 4.258 4.044 4.476 . 0 0 "[ . 1 . 2 ]" 1 1175 1 43 GLN H 1 44 SER H 2.900 . 4.000 2.847 2.716 3.014 . 0 0 "[ . 1 . 2 ]" 1 1176 1 43 GLN H 1 45 LYS H 5.000 . 7.000 4.420 4.122 4.844 . 0 0 "[ . 1 . 2 ]" 1 1177 1 43 GLN HA 1 43 GLN HB2 2.200 . 2.800 2.602 2.393 2.755 . 0 0 "[ . 1 . 2 ]" 1 1178 1 43 GLN HA 1 43 GLN HB3 2.500 . 3.300 3.004 2.957 3.026 . 0 0 "[ . 1 . 2 ]" 1 1179 1 43 GLN HA 1 43 GLN HE22 4.900 . 7.000 5.459 3.628 5.954 . 0 0 "[ . 1 . 2 ]" 1 1180 1 43 GLN HA 1 43 GLN HG2 2.900 . 4.000 2.997 2.340 3.861 . 0 0 "[ . 1 . 2 ]" 1 1181 1 43 GLN HA 1 43 GLN HG3 2.700 . 3.600 2.544 2.291 3.311 . 0 0 "[ . 1 . 2 ]" 1 1182 1 43 GLN HA 1 44 SER H 3.200 . 4.500 3.553 3.506 3.591 . 0 0 "[ . 1 . 2 ]" 1 1183 1 43 GLN HA 1 45 LYS H 4.000 . 6.000 4.532 4.164 4.947 . 0 0 "[ . 1 . 2 ]" 1 1184 1 43 GLN HA 1 46 VAL H 2.800 . 3.800 3.515 3.257 3.817 0.017 16 0 "[ . 1 . 2 ]" 1 1185 1 43 GLN HA 1 46 VAL HB 2.300 . 3.000 2.639 2.282 2.952 . 0 0 "[ . 1 . 2 ]" 1 1186 1 43 GLN HA 1 46 VAL MG1 2.900 . 4.000 3.864 3.581 4.051 0.051 12 0 "[ . 1 . 2 ]" 1 1187 1 43 GLN HA 1 46 VAL MG2 2.600 . 7.000 3.465 3.128 3.792 . 0 0 "[ . 1 . 2 ]" 1 1188 1 43 GLN HA 1 47 SER H 3.300 . 4.700 3.993 3.774 4.207 . 0 0 "[ . 1 . 2 ]" 1 1189 1 43 GLN HB2 1 44 SER H 3.000 . 4.100 3.732 3.481 3.901 . 0 0 "[ . 1 . 2 ]" 1 1190 1 43 GLN HB2 1 45 LYS H 3.600 . 5.200 4.515 4.370 4.696 . 0 0 "[ . 1 . 2 ]" 1 1191 1 43 GLN HB3 1 44 SER H 2.900 . 4.000 2.701 2.352 3.035 . 0 0 "[ . 1 . 2 ]" 1 1192 1 43 GLN HB3 1 44 SER HA 2.700 . 7.000 4.092 3.908 4.438 . 0 0 "[ . 1 . 2 ]" 1 1193 1 43 GLN HB3 1 46 VAL H 3.800 . 5.600 4.321 3.779 4.896 . 0 0 "[ . 1 . 2 ]" 1 1194 1 43 GLN HE21 1 43 GLN HG2 3.300 . 4.700 2.981 2.135 3.568 . 0 0 "[ . 1 . 2 ]" 1 1195 1 43 GLN HE21 1 43 GLN HG3 3.300 . 4.700 2.937 2.241 3.565 . 0 0 "[ . 1 . 2 ]" 1 1196 1 43 GLN HE22 1 43 GLN HG2 3.800 . 5.600 3.827 3.449 4.107 . 0 0 "[ . 1 . 2 ]" 1 1197 1 43 GLN HE22 1 43 GLN HG3 3.600 . 5.200 3.805 3.491 4.102 . 0 0 "[ . 1 . 2 ]" 1 1198 1 43 GLN HG2 1 44 SER H 4.600 . 7.000 4.410 3.964 5.098 . 0 0 "[ . 1 . 2 ]" 1 1199 1 43 GLN HG3 1 44 SER H 3.300 . 4.700 4.858 3.296 5.238 0.538 17 1 "[ . 1 . + 2 ]" 1 1200 1 44 SER H 1 44 SER HA 2.600 . 3.400 2.804 2.764 2.841 . 0 0 "[ . 1 . 2 ]" 1 1201 1 44 SER H 1 44 SER HB2 2.600 . 3.400 2.830 2.135 3.569 0.169 10 0 "[ . 1 . 2 ]" 1 1202 1 44 SER H 1 44 SER HB3 2.500 . 3.300 3.401 2.439 3.567 0.267 5 0 "[ . 1 . 2 ]" 1 1203 1 44 SER H 1 45 LYS H 2.500 . 3.300 2.737 2.599 2.864 . 0 0 "[ . 1 . 2 ]" 1 1204 1 44 SER H 1 45 LYS QB 4.600 . 7.000 4.427 4.248 4.575 . 0 0 "[ . 1 . 2 ]" 1 1205 1 44 SER H 1 46 VAL H 3.900 . 5.800 4.090 3.925 4.242 . 0 0 "[ . 1 . 2 ]" 1 1206 1 44 SER H 1 47 SER H 5.500 . 7.000 4.689 4.583 4.817 . 0 0 "[ . 1 . 2 ]" 1 1207 1 44 SER H 1 47 SER QB 4.300 . 6.600 5.315 4.661 5.789 . 0 0 "[ . 1 . 2 ]" 1 1208 1 44 SER HA 1 44 SER HB2 2.100 . 2.700 2.926 2.404 3.035 0.335 6 0 "[ . 1 . 2 ]" 1 1209 1 44 SER HA 1 44 SER HB3 2.200 . 7.000 2.391 2.233 2.952 . 0 0 "[ . 1 . 2 ]" 1 1210 1 44 SER HA 1 45 LYS H 3.000 . 4.100 3.544 3.491 3.567 . 0 0 "[ . 1 . 2 ]" 1 1211 1 44 SER HA 1 46 VAL H 3.900 . 5.800 4.295 4.034 4.393 . 0 0 "[ . 1 . 2 ]" 1 1212 1 44 SER HA 1 47 SER H 2.600 . 3.400 3.475 3.409 3.526 0.126 13 0 "[ . 1 . 2 ]" 1 1213 1 44 SER HA 1 47 SER QB 6.000 . 7.000 3.437 2.539 3.957 . 0 0 "[ . 1 . 2 ]" 1 1214 1 44 SER HB2 1 45 LYS H 2.900 . 4.000 2.762 2.488 3.517 . 0 0 "[ . 1 . 2 ]" 1 1215 1 44 SER HB3 1 45 LYS H 2.800 . 3.800 3.793 2.878 4.034 0.234 12 0 "[ . 1 . 2 ]" 1 1216 1 45 LYS H 1 45 LYS HA 2.600 . 3.400 2.825 2.778 2.857 . 0 0 "[ . 1 . 2 ]" 1 1217 1 45 LYS H 1 45 LYS QB . . 2.800 2.133 2.053 2.204 . 0 0 "[ . 1 . 2 ]" 1 1218 1 45 LYS H 1 45 LYS QD 3.700 . 5.400 3.806 2.837 4.186 . 0 0 "[ . 1 . 2 ]" 1 1219 1 45 LYS H 1 45 LYS QG . . 5.600 3.963 3.821 4.044 . 0 0 "[ . 1 . 2 ]" 1 1220 1 45 LYS H 1 46 VAL H 2.400 . 3.100 2.651 2.531 2.841 . 0 0 "[ . 1 . 2 ]" 1 1221 1 45 LYS H 1 47 SER H 4.000 . 6.000 4.241 4.129 4.453 . 0 0 "[ . 1 . 2 ]" 1 1222 1 45 LYS H 1 48 ARG H 3.900 . 5.800 4.692 4.582 4.896 . 0 0 "[ . 1 . 2 ]" 1 1223 1 45 LYS H 1 49 MET H 3.400 . 7.000 5.967 5.785 6.316 . 0 0 "[ . 1 . 2 ]" 1 1224 1 45 LYS HA 1 45 LYS QB 2.100 . 2.700 2.479 2.261 2.550 . 0 0 "[ . 1 . 2 ]" 1 1225 1 45 LYS HA 1 45 LYS QD 3.000 . 4.100 3.161 2.257 3.822 . 0 0 "[ . 1 . 2 ]" 1 1226 1 45 LYS HA 1 45 LYS QG 2.800 . 3.600 2.292 2.078 2.717 . 0 0 "[ . 1 . 2 ]" 1 1227 1 45 LYS HA 1 46 VAL H 3.200 . 4.500 3.513 3.493 3.532 . 0 0 "[ . 1 . 2 ]" 1 1228 1 45 LYS HA 1 46 VAL HA 3.700 . 5.400 4.781 4.747 4.825 . 0 0 "[ . 1 . 2 ]" 1 1229 1 45 LYS HA 1 47 SER H 3.600 . 5.200 4.671 4.352 4.996 . 0 0 "[ . 1 . 2 ]" 1 1230 1 45 LYS HA 1 48 ARG H 3.200 . 4.500 3.671 3.321 4.040 . 0 0 "[ . 1 . 2 ]" 1 1231 1 45 LYS HA 1 48 ARG H 6.000 . 7.000 3.212 3.045 3.346 . 0 0 "[ . 1 . 2 ]" 1 1232 1 45 LYS HA 1 48 ARG HB2 2.500 . 3.300 2.673 2.377 3.079 . 0 0 "[ . 1 . 2 ]" 1 1233 1 45 LYS HA 1 48 ARG HB3 2.500 . 7.000 4.193 3.964 4.562 . 0 0 "[ . 1 . 2 ]" 1 1234 1 45 LYS HA 1 48 ARG HD2 4.800 . 7.000 4.990 3.021 6.325 . 0 0 "[ . 1 . 2 ]" 1 1235 1 45 LYS HA 1 48 ARG HD3 4.700 . 7.000 4.741 2.776 6.259 . 0 0 "[ . 1 . 2 ]" 1 1236 1 45 LYS HA 1 49 MET H 4.000 . 6.000 3.924 3.780 4.320 . 0 0 "[ . 1 . 2 ]" 1 1237 1 45 LYS QB 1 46 VAL H . . 3.600 2.713 2.515 2.936 . 0 0 "[ . 1 . 2 ]" 1 1238 1 45 LYS HB2 1 46 VAL H 6.000 . 7.000 2.482 2.042 3.565 . 0 0 "[ . 1 . 2 ]" 1 1239 1 45 LYS HE3 1 46 VAL H 4.900 . 7.000 4.722 3.600 6.448 . 0 0 "[ . 1 . 2 ]" 1 1240 1 45 LYS QG 1 46 VAL H 4.700 . 7.000 4.234 4.053 4.561 . 0 0 "[ . 1 . 2 ]" 1 1241 1 45 LYS QG 1 46 VAL H 4.000 . 6.000 4.004 2.989 4.430 . 0 0 "[ . 1 . 2 ]" 1 1242 1 45 LYS QG 1 49 MET H 3.500 . 5.000 4.035 3.870 4.184 . 0 0 "[ . 1 . 2 ]" 1 1243 1 45 LYS QG 1 49 MET QG 2.900 . 4.000 3.396 2.929 3.820 . 0 0 "[ . 1 . 2 ]" 1 1244 1 46 VAL H 1 46 VAL HA 2.600 . 3.400 2.868 2.855 2.904 . 0 0 "[ . 1 . 2 ]" 1 1245 1 46 VAL H 1 46 VAL HB 2.100 . 2.700 2.311 2.261 2.374 . 0 0 "[ . 1 . 2 ]" 1 1246 1 46 VAL H 1 46 VAL MG2 2.300 . 3.000 2.584 2.461 2.715 . 0 0 "[ . 1 . 2 ]" 1 1247 1 46 VAL H 1 47 SER H 2.500 . 3.300 2.585 2.494 2.658 . 0 0 "[ . 1 . 2 ]" 1 1248 1 46 VAL H 1 47 SER QB 4.000 . 6.000 4.774 4.312 5.109 . 0 0 "[ . 1 . 2 ]" 1 1249 1 46 VAL H 1 48 ARG H 2.800 . 3.800 3.896 3.841 3.944 0.144 2 0 "[ . 1 . 2 ]" 1 1250 1 46 VAL HA 1 47 SER H 3.100 . 4.300 3.570 3.537 3.597 . 0 0 "[ . 1 . 2 ]" 1 1251 1 46 VAL HA 1 48 ARG H 4.400 . 6.800 4.341 4.256 4.467 . 0 0 "[ . 1 . 2 ]" 1 1252 1 46 VAL HA 1 49 MET H 2.900 . 4.000 3.498 3.375 3.646 . 0 0 "[ . 1 . 2 ]" 1 1253 1 46 VAL HA 1 49 MET HB2 2.500 . 3.300 2.698 2.540 2.910 . 0 0 "[ . 1 . 2 ]" 1 1254 1 46 VAL HA 1 49 MET HB3 2.900 . 7.000 4.280 4.100 4.517 . 0 0 "[ . 1 . 2 ]" 1 1255 1 46 VAL HA 1 49 MET QG 6.000 . 7.000 3.931 3.380 4.321 . 0 0 "[ . 1 . 2 ]" 1 1256 1 46 VAL HA 1 50 LEU H 3.500 . 5.000 4.089 3.991 4.261 . 0 0 "[ . 1 . 2 ]" 1 1257 1 46 VAL HA 1 50 LEU HB2 2.800 . 7.000 5.363 5.202 5.599 . 0 0 "[ . 1 . 2 ]" 1 1258 1 46 VAL HB 1 46 VAL MG1 2.100 . 2.700 2.126 2.116 2.135 . 0 0 "[ . 1 . 2 ]" 1 1259 1 46 VAL HB 1 47 SER H 2.500 . 3.300 2.793 2.635 2.893 . 0 0 "[ . 1 . 2 ]" 1 1260 1 46 VAL MG1 1 47 SER H 2.900 . 4.000 3.212 2.959 3.419 . 0 0 "[ . 1 . 2 ]" 1 1261 1 46 VAL MG1 1 47 SER QB 2.900 . 4.000 4.029 3.880 4.245 0.245 19 0 "[ . 1 . 2 ]" 1 1262 1 46 VAL MG1 1 49 MET H 3.100 . 4.300 2.683 1.870 3.877 0.030 3 0 "[ . 1 . 2 ]" 1 1263 1 46 VAL MG1 1 50 LEU MD1 2.300 . 3.000 2.110 1.749 2.437 . 0 0 "[ . 1 . 2 ]" 1 1264 1 46 VAL MG1 1 50 LEU HG 2.400 . 7.000 3.332 3.247 3.664 . 0 0 "[ . 1 . 2 ]" 1 1265 1 46 VAL MG1 1 67 TYR QD 4.800 . 7.000 4.134 4.035 4.197 . 0 0 "[ . 1 . 2 ]" 1 1266 1 46 VAL MG1 1 67 TYR QE 4.400 . 6.800 4.343 4.215 4.682 . 0 0 "[ . 1 . 2 ]" 1 1267 1 46 VAL MG2 1 47 SER H 3.100 . 4.300 4.070 4.009 4.120 . 0 0 "[ . 1 . 2 ]" 1 1268 1 47 SER H 1 47 SER QB 2.100 . 2.700 2.546 2.176 2.768 0.068 7 0 "[ . 1 . 2 ]" 1 1269 1 47 SER H 1 48 ARG H 2.500 . 3.300 2.584 2.483 2.776 . 0 0 "[ . 1 . 2 ]" 1 1270 1 47 SER H 1 49 MET H 3.700 . 5.400 4.197 4.027 4.394 . 0 0 "[ . 1 . 2 ]" 1 1271 1 47 SER H 1 50 LEU MD1 3.400 . 4.800 3.921 3.648 4.113 . 0 0 "[ . 1 . 2 ]" 1 1272 1 47 SER HA 1 47 SER QB 3.700 . 5.400 2.264 2.172 2.507 . 0 0 "[ . 1 . 2 ]" 1 1273 1 47 SER HA 1 48 ARG H 6.000 . 7.000 3.358 3.323 3.399 . 0 0 "[ . 1 . 2 ]" 1 1274 1 47 SER QB 1 50 LEU HB2 3.100 . 4.300 4.215 3.921 4.474 0.174 22 0 "[ . 1 . 2 ]" 1 1275 1 47 SER HB2 1 50 LEU H 2.900 . 4.000 4.038 3.979 4.076 0.076 4 0 "[ . 1 . 2 ]" 1 1276 1 48 ARG H 1 48 ARG HB2 2.300 . 3.000 2.296 2.250 2.396 . 0 0 "[ . 1 . 2 ]" 1 1277 1 48 ARG H 1 48 ARG HB3 2.700 . 3.600 3.566 3.538 3.601 0.001 8 0 "[ . 1 . 2 ]" 1 1278 1 48 ARG H 1 48 ARG HD2 3.900 . 5.800 4.814 3.956 5.216 . 0 0 "[ . 1 . 2 ]" 1 1279 1 48 ARG H 1 48 ARG QD 3.900 . 5.800 4.215 3.683 4.721 . 0 0 "[ . 1 . 2 ]" 1 1280 1 48 ARG H 1 48 ARG HG2 2.900 . 4.000 3.494 2.587 4.074 0.074 7 0 "[ . 1 . 2 ]" 1 1281 1 48 ARG H 1 48 ARG HG3 3.500 . 5.000 3.070 2.692 4.047 . 0 0 "[ . 1 . 2 ]" 1 1282 1 48 ARG H 1 49 MET H 2.400 . 3.100 2.634 2.541 2.712 . 0 0 "[ . 1 . 2 ]" 1 1283 1 48 ARG H 1 49 MET HA 4.100 . 6.200 4.239 4.119 4.393 . 0 0 "[ . 1 . 2 ]" 1 1284 1 48 ARG H 1 50 LEU H 3.200 . 4.500 3.966 3.860 4.101 . 0 0 "[ . 1 . 2 ]" 1 1285 1 48 ARG H 1 50 LEU MD2 3.300 . 4.700 4.060 3.981 4.155 . 0 0 "[ . 1 . 2 ]" 1 1286 1 48 ARG HA 1 48 ARG HB2 2.500 . 3.300 3.007 2.996 3.017 . 0 0 "[ . 1 . 2 ]" 1 1287 1 48 ARG HA 1 48 ARG HB3 2.400 . 3.100 2.615 2.546 2.651 . 0 0 "[ . 1 . 2 ]" 1 1288 1 48 ARG HA 1 48 ARG HG2 2.600 . 3.400 2.424 2.159 2.943 . 0 0 "[ . 1 . 2 ]" 1 1289 1 48 ARG HA 1 48 ARG HG3 2.700 . 3.600 3.182 2.686 3.701 0.101 8 0 "[ . 1 . 2 ]" 1 1290 1 48 ARG HA 1 49 MET H 3.300 . 4.700 3.561 3.546 3.582 . 0 0 "[ . 1 . 2 ]" 1 1291 1 48 ARG HA 1 51 THR H 6.000 . 7.000 3.595 3.463 3.761 . 0 0 "[ . 1 . 2 ]" 1 1292 1 48 ARG HA 1 51 THR H 2.500 . 3.300 2.753 2.723 2.795 . 0 0 "[ . 1 . 2 ]" 1 1293 1 48 ARG HA 1 52 LYS H . . 4.800 3.315 3.286 3.383 . 0 0 "[ . 1 . 2 ]" 1 1294 1 48 ARG HB2 1 48 ARG HD2 3.300 . 4.700 3.429 2.289 4.193 . 0 0 "[ . 1 . 2 ]" 1 1295 1 48 ARG HB2 1 49 MET H 2.800 . 3.800 2.715 2.566 2.883 . 0 0 "[ . 1 . 2 ]" 1 1296 1 48 ARG HB3 1 49 MET H 3.200 . 4.500 3.380 3.209 3.519 . 0 0 "[ . 1 . 2 ]" 1 1297 1 48 ARG HB3 1 51 THR H 4.200 . 6.400 4.491 4.429 4.619 . 0 0 "[ . 1 . 2 ]" 1 1298 1 48 ARG HD2 1 48 ARG HG3 2.900 . 4.000 2.685 2.223 3.019 . 0 0 "[ . 1 . 2 ]" 1 1299 1 49 MET H 1 49 MET HA 2.600 . 3.400 2.831 2.804 2.875 . 0 0 "[ . 1 . 2 ]" 1 1300 1 49 MET H 1 49 MET HB2 2.500 . 3.300 2.287 2.254 2.320 . 0 0 "[ . 1 . 2 ]" 1 1301 1 49 MET H 1 49 MET HB3 3.000 . 4.100 3.554 3.539 3.569 . 0 0 "[ . 1 . 2 ]" 1 1302 1 49 MET H 1 49 MET QG 2.400 . 3.100 2.811 2.576 3.092 . 0 0 "[ . 1 . 2 ]" 1 1303 1 49 MET H 1 50 LEU H 2.400 . 3.100 2.660 2.523 2.755 . 0 0 "[ . 1 . 2 ]" 1 1304 1 49 MET H 1 51 THR H 4.300 . 6.600 4.326 4.191 4.547 . 0 0 "[ . 1 . 2 ]" 1 1305 1 49 MET HA 1 49 MET HB2 2.400 . 3.100 2.995 2.983 3.012 . 0 0 "[ . 1 . 2 ]" 1 1306 1 49 MET HA 1 49 MET QG 2.500 . 3.000 2.428 2.155 2.955 . 0 0 "[ . 1 . 2 ]" 1 1307 1 49 MET HA 1 50 LEU H 3.300 . 4.700 3.541 3.522 3.555 . 0 0 "[ . 1 . 2 ]" 1 1308 1 49 MET HA 1 52 LYS H 2.900 . 4.000 3.341 3.159 3.475 . 0 0 "[ . 1 . 2 ]" 1 1309 1 49 MET HA 1 53 PHE H 3.300 . 4.700 3.481 3.343 3.683 . 0 0 "[ . 1 . 2 ]" 1 1310 1 49 MET HA 1 53 PHE QD 3.100 . 4.300 3.560 2.884 3.798 . 0 0 "[ . 1 . 2 ]" 1 1311 1 49 MET HA 1 53 PHE QE 3.500 . 5.000 3.937 3.346 4.218 . 0 0 "[ . 1 . 2 ]" 1 1312 1 49 MET HB2 1 49 MET QG 2.400 . 3.100 2.269 2.120 2.462 . 0 0 "[ . 1 . 2 ]" 1 1313 1 49 MET HB2 1 50 LEU H 2.700 . 3.600 2.949 2.830 3.040 . 0 0 "[ . 1 . 2 ]" 1 1314 1 49 MET HB2 1 53 PHE QD 3.300 . 4.700 3.896 3.753 4.499 . 0 0 "[ . 1 . 2 ]" 1 1315 1 49 MET HB3 1 50 LEU H 3.400 . 4.800 3.588 3.505 3.670 . 0 0 "[ . 1 . 2 ]" 1 1316 1 49 MET HB3 1 53 PHE QD 2.900 . 4.000 2.461 2.263 3.671 . 0 0 "[ . 1 . 2 ]" 1 1317 1 49 MET HB3 1 53 PHE QE 3.700 . 5.400 2.670 2.424 3.636 . 0 0 "[ . 1 . 2 ]" 1 1318 1 49 MET QG 1 53 PHE QD 3.500 . 4.700 3.762 3.618 3.862 . 0 0 "[ . 1 . 2 ]" 1 1319 1 49 MET QG 1 53 PHE QE 3.300 . 4.700 2.641 2.198 3.084 . 0 0 "[ . 1 . 2 ]" 1 1320 1 50 LEU H 1 50 LEU HA 2.600 . 3.400 2.829 2.817 2.842 . 0 0 "[ . 1 . 2 ]" 1 1321 1 50 LEU H 1 50 LEU HB2 2.700 . 3.600 2.246 2.213 2.293 . 0 0 "[ . 1 . 2 ]" 1 1322 1 50 LEU H 1 50 LEU HB3 2.500 . 7.000 3.539 3.518 3.562 . 0 0 "[ . 1 . 2 ]" 1 1323 1 50 LEU H 1 50 LEU QD 2.600 . 3.400 3.193 2.803 3.316 . 0 0 "[ . 1 . 2 ]" 1 1324 1 50 LEU H 1 50 LEU HG 2.500 . 3.300 2.987 2.778 3.304 0.004 12 0 "[ . 1 . 2 ]" 1 1325 1 50 LEU H 1 51 THR H 2.700 . 3.600 2.717 2.667 2.794 . 0 0 "[ . 1 . 2 ]" 1 1326 1 50 LEU H 1 52 LYS H 4.400 . 6.800 4.038 3.903 4.173 . 0 0 "[ . 1 . 2 ]" 1 1327 1 50 LEU H 1 53 PHE QD 5.000 . 7.000 4.748 4.608 5.312 . 0 0 "[ . 1 . 2 ]" 1 1328 1 50 LEU HA 1 50 LEU HB2 2.400 . 3.100 2.994 2.979 3.007 . 0 0 "[ . 1 . 2 ]" 1 1329 1 50 LEU HA 1 50 LEU HB3 2.700 . 3.600 2.668 2.632 2.685 . 0 0 "[ . 1 . 2 ]" 1 1330 1 50 LEU HA 1 51 THR H 3.700 . 5.400 3.557 3.535 3.579 . 0 0 "[ . 1 . 2 ]" 1 1331 1 50 LEU HA 1 53 PHE H 3.800 . 5.600 3.952 3.829 4.045 . 0 0 "[ . 1 . 2 ]" 1 1332 1 50 LEU HA 1 53 PHE HB2 3.300 . 4.700 3.447 3.240 3.520 . 0 0 "[ . 1 . 2 ]" 1 1333 1 50 LEU HA 1 53 PHE HB3 3.500 . 5.000 5.037 4.812 5.094 0.094 9 0 "[ . 1 . 2 ]" 1 1334 1 50 LEU HA 1 55 ALA H 3.100 . 4.300 3.467 3.206 3.628 . 0 0 "[ . 1 . 2 ]" 1 1335 1 50 LEU HA 1 55 ALA MB 2.300 . 3.000 2.719 2.361 2.976 . 0 0 "[ . 1 . 2 ]" 1 1336 1 50 LEU HB2 1 50 LEU MD1 2.100 . 2.700 2.199 1.983 2.265 . 0 0 "[ . 1 . 2 ]" 1 1337 1 50 LEU HB2 1 50 LEU HG 2.900 . 4.000 2.648 2.576 2.858 . 0 0 "[ . 1 . 2 ]" 1 1338 1 50 LEU HB2 1 51 THR H 3.000 . 4.100 2.727 2.595 2.876 . 0 0 "[ . 1 . 2 ]" 1 1339 1 50 LEU HB2 1 67 TYR QE 3.800 . 5.600 5.269 4.848 5.652 0.052 4 0 "[ . 1 . 2 ]" 1 1340 1 50 LEU HB3 1 51 THR H 2.600 . 3.400 3.243 3.051 3.380 . 0 0 "[ . 1 . 2 ]" 1 1341 1 50 LEU HB3 1 67 TYR QE 4.100 . 6.200 4.409 3.767 4.908 . 0 0 "[ . 1 . 2 ]" 1 1342 1 50 LEU QD 1 51 THR H 3.600 . 5.200 4.089 4.006 4.188 . 0 0 "[ . 1 . 2 ]" 1 1343 1 50 LEU QD 1 67 TYR QD 2.300 . 3.000 2.685 2.479 2.879 . 0 0 "[ . 1 . 2 ]" 1 1344 1 50 LEU QD 1 67 TYR QE 2.400 . 3.100 2.488 2.354 2.630 . 0 0 "[ . 1 . 2 ]" 1 1345 1 50 LEU MD2 1 55 ALA MB 2.000 . 2.500 1.813 1.764 1.902 . 0 0 "[ . 1 . 2 ]" 1 1346 1 50 LEU HG 1 67 TYR QD 3.700 . 5.400 5.069 4.804 5.237 . 0 0 "[ . 1 . 2 ]" 1 1347 1 50 LEU HG 1 67 TYR QE 4.100 . 6.200 5.038 4.861 5.272 . 0 0 "[ . 1 . 2 ]" 1 1348 1 51 THR H 1 51 THR HB 2.300 . 3.000 2.704 2.468 2.819 . 0 0 "[ . 1 . 2 ]" 1 1349 1 51 THR H 1 52 LYS H 2.600 . 3.400 2.575 2.468 2.656 . 0 0 "[ . 1 . 2 ]" 1 1350 1 51 THR H 1 53 PHE H 4.000 . 6.000 4.348 4.160 4.489 . 0 0 "[ . 1 . 2 ]" 1 1351 1 51 THR HA 1 51 THR MG 2.300 . 3.000 2.327 2.172 2.429 . 0 0 "[ . 1 . 2 ]" 1 1352 1 51 THR HA 1 55 ALA H 3.900 . 5.800 2.583 2.458 2.740 . 0 0 "[ . 1 . 2 ]" 1 1353 1 51 THR HB 1 51 THR MG 2.100 . 2.700 2.112 2.078 2.124 . 0 0 "[ . 1 . 2 ]" 1 1354 1 51 THR HB 1 52 LYS H 2.900 . 4.000 2.654 2.463 2.910 . 0 0 "[ . 1 . 2 ]" 1 1355 1 51 THR MG 1 52 LYS H 3.200 . 4.500 3.808 3.630 4.040 . 0 0 "[ . 1 . 2 ]" 1 1356 1 51 THR MG 1 52 LYS HA 3.200 . 4.500 4.073 3.711 4.297 . 0 0 "[ . 1 . 2 ]" 1 1357 1 52 LYS H 1 52 LYS HA 2.900 . 4.000 2.814 2.785 2.857 . 0 0 "[ . 1 . 2 ]" 1 1358 1 52 LYS H 1 52 LYS HB2 2.400 . 3.100 2.504 2.339 2.628 . 0 0 "[ . 1 . 2 ]" 1 1359 1 52 LYS H 1 52 LYS HB3 2.800 . 3.800 2.518 2.339 2.672 . 0 0 "[ . 1 . 2 ]" 1 1360 1 52 LYS H 1 52 LYS HG2 3.600 . 5.200 4.431 4.380 4.462 . 0 0 "[ . 1 . 2 ]" 1 1361 1 52 LYS H 1 52 LYS HG3 4.300 . 6.600 4.556 4.398 4.633 . 0 0 "[ . 1 . 2 ]" 1 1362 1 52 LYS H 1 53 PHE H 2.500 . 3.300 2.811 2.665 2.915 . 0 0 "[ . 1 . 2 ]" 1 1363 1 52 LYS H 1 53 PHE QD 4.300 . 6.600 5.141 4.056 5.333 . 0 0 "[ . 1 . 2 ]" 1 1364 1 52 LYS H 1 54 GLY H 3.900 . 5.800 3.889 3.707 4.041 . 0 0 "[ . 1 . 2 ]" 1 1365 1 52 LYS HA 1 52 LYS HE3 6.000 . 7.000 5.468 4.498 6.232 . 0 0 "[ . 1 . 2 ]" 1 1366 1 52 LYS HA 1 52 LYS HG2 2.600 . 3.400 2.502 2.361 2.712 . 0 0 "[ . 1 . 2 ]" 1 1367 1 52 LYS HA 1 52 LYS HG3 3.000 . 4.100 3.400 2.954 3.580 . 0 0 "[ . 1 . 2 ]" 1 1368 1 52 LYS HA 1 53 PHE H 3.200 . 4.500 3.573 3.545 3.588 . 0 0 "[ . 1 . 2 ]" 1 1369 1 52 LYS HB2 1 52 LYS HG2 2.900 . 4.000 2.769 2.607 2.948 . 0 0 "[ . 1 . 2 ]" 1 1370 1 52 LYS HB2 1 53 PHE H 3.000 . 4.100 3.776 3.662 3.947 . 0 0 "[ . 1 . 2 ]" 1 1371 1 52 LYS HB2 1 53 PHE QD 3.800 . 5.600 5.468 3.914 5.632 0.032 13 0 "[ . 1 . 2 ]" 1 1372 1 52 LYS HB3 1 53 PHE H 2.500 . 3.300 2.403 2.257 2.697 . 0 0 "[ . 1 . 2 ]" 1 1373 1 52 LYS QD 1 53 PHE H 4.900 . 7.000 3.097 2.707 4.081 . 0 0 "[ . 1 . 2 ]" 1 1374 1 52 LYS QD 1 53 PHE QD 3.800 . 5.600 3.009 2.139 4.240 . 0 0 "[ . 1 . 2 ]" 1 1375 1 52 LYS QD 1 53 PHE QE 3.200 . 4.500 3.190 2.963 3.894 . 0 0 "[ . 1 . 2 ]" 1 1376 1 52 LYS QD 1 54 GLY H 3.700 . 5.400 3.997 3.747 4.218 . 0 0 "[ . 1 . 2 ]" 1 1377 1 52 LYS HE2 1 53 PHE HZ 3.800 . 5.600 4.207 2.774 5.397 . 0 0 "[ . 1 . 2 ]" 1 1378 1 52 LYS HE3 1 52 LYS HG2 3.400 . 4.800 3.227 2.192 4.142 . 0 0 "[ . 1 . 2 ]" 1 1379 1 52 LYS HE3 1 53 PHE QE 4.800 . 7.000 3.299 2.459 4.420 . 0 0 "[ . 1 . 2 ]" 1 1380 1 52 LYS HG2 1 53 PHE H 3.600 . 5.200 4.127 3.824 4.597 . 0 0 "[ . 1 . 2 ]" 1 1381 1 52 LYS HG3 1 53 PHE H 3.800 . 5.600 4.795 4.668 5.077 . 0 0 "[ . 1 . 2 ]" 1 1382 1 52 LYS HG3 1 53 PHE QD 3.900 . 5.800 5.527 4.177 5.928 0.128 21 0 "[ . 1 . 2 ]" 1 1383 1 52 LYS HG3 1 53 PHE QE 5.700 . 7.000 5.536 4.487 6.069 . 0 0 "[ . 1 . 2 ]" 1 1384 1 53 PHE H 1 53 PHE HA 2.700 . 3.600 2.871 2.841 2.922 . 0 0 "[ . 1 . 2 ]" 1 1385 1 53 PHE H 1 53 PHE HB2 2.300 . 3.000 2.369 2.319 2.411 . 0 0 "[ . 1 . 2 ]" 1 1386 1 53 PHE H 1 53 PHE HB3 2.700 . 3.600 3.591 3.566 3.610 0.010 14 0 "[ . 1 . 2 ]" 1 1387 1 53 PHE H 1 53 PHE QD 3.000 . 4.100 3.169 2.115 3.393 . 0 0 "[ . 1 . 2 ]" 1 1388 1 53 PHE H 1 54 GLY H 2.400 . 3.100 2.562 2.319 2.746 . 0 0 "[ . 1 . 2 ]" 1 1389 1 53 PHE HA 1 53 PHE HB2 2.600 . 3.400 3.027 3.018 3.033 . 0 0 "[ . 1 . 2 ]" 1 1390 1 53 PHE HA 1 53 PHE HB3 2.300 . 3.000 2.554 2.522 2.583 . 0 0 "[ . 1 . 2 ]" 1 1391 1 53 PHE HA 1 53 PHE QD 2.500 . 3.300 2.211 2.088 2.786 . 0 0 "[ . 1 . 2 ]" 1 1392 1 53 PHE HA 1 53 PHE QE 4.200 . 6.400 4.327 4.271 4.555 . 0 0 "[ . 1 . 2 ]" 1 1393 1 53 PHE HA 1 54 GLY H 2.900 . 4.000 3.436 3.285 3.533 . 0 0 "[ . 1 . 2 ]" 1 1394 1 53 PHE HB2 1 53 PHE QD 2.600 . 3.400 2.293 2.242 2.748 . 0 0 "[ . 1 . 2 ]" 1 1395 1 53 PHE HB2 1 54 GLY H 3.800 . 5.600 3.228 2.851 3.663 . 0 0 "[ . 1 . 2 ]" 1 1396 1 53 PHE HB2 1 55 ALA MB 3.600 . 5.200 3.799 3.574 4.038 . 0 0 "[ . 1 . 2 ]" 1 1397 1 53 PHE HB2 1 69 LEU QD 2.900 . 4.000 3.057 2.583 3.541 . 0 0 "[ . 1 . 2 ]" 1 1398 1 53 PHE HB3 1 53 PHE QD 2.800 . 3.800 2.666 2.264 2.729 . 0 0 "[ . 1 . 2 ]" 1 1399 1 53 PHE HB3 1 53 PHE QE 4.500 . 7.000 4.480 4.359 4.507 . 0 0 "[ . 1 . 2 ]" 1 1400 1 53 PHE HB3 1 54 GLY H 3.900 . 5.800 3.963 3.610 4.288 . 0 0 "[ . 1 . 2 ]" 1 1401 1 53 PHE HB3 1 55 ALA H 4.200 . 6.400 4.787 4.608 5.051 . 0 0 "[ . 1 . 2 ]" 1 1402 1 53 PHE HB3 1 55 ALA MB 4.100 . 6.200 4.433 4.192 4.690 . 0 0 "[ . 1 . 2 ]" 1 1403 1 53 PHE HB3 1 69 LEU QD 2.800 . 3.800 2.369 2.134 2.839 . 0 0 "[ . 1 . 2 ]" 1 1404 1 53 PHE QD 1 69 LEU QD 3.000 . 4.100 3.572 3.040 3.987 . 0 0 "[ . 1 . 2 ]" 1 1405 1 53 PHE QE 1 69 LEU QD 3.600 . 5.200 4.722 4.523 5.074 . 0 0 "[ . 1 . 2 ]" 1 1406 1 54 GLY H 1 54 GLY HA3 2.200 . 2.800 2.874 2.787 2.935 0.135 19 0 "[ . 1 . 2 ]" 1 1407 1 54 GLY H 1 55 ALA H 2.600 . 3.400 2.711 2.457 2.903 . 0 0 "[ . 1 . 2 ]" 1 1408 1 54 GLY HA2 1 55 ALA H 3.600 . 5.200 2.619 2.474 2.803 . 0 0 "[ . 1 . 2 ]" 1 1409 1 54 GLY HA3 1 55 ALA H 2.700 . 3.600 3.569 3.554 3.579 . 0 0 "[ . 1 . 2 ]" 1 1410 1 55 ALA H 1 55 ALA HA 2.700 . 3.600 2.885 2.856 2.907 . 0 0 "[ . 1 . 2 ]" 1 1411 1 55 ALA H 1 55 ALA MB 2.100 . 2.700 2.252 2.185 2.289 . 0 0 "[ . 1 . 2 ]" 1 1412 1 55 ALA H 1 56 VAL H 4.000 . 6.000 4.594 4.494 4.628 . 0 0 "[ . 1 . 2 ]" 1 1413 1 55 ALA H 1 56 VAL QG 3.400 . 4.800 3.522 3.152 3.776 . 0 0 "[ . 1 . 2 ]" 1 1414 1 55 ALA HA 1 55 ALA MB 2.000 . 2.500 2.121 2.089 2.129 . 0 0 "[ . 1 . 2 ]" 1 1415 1 55 ALA HA 1 56 VAL H 2.000 . 2.500 2.239 2.138 2.405 . 0 0 "[ . 1 . 2 ]" 1 1416 1 55 ALA HA 1 56 VAL QG 3.200 . 4.500 3.243 3.000 3.381 . 0 0 "[ . 1 . 2 ]" 1 1417 1 55 ALA HA 1 67 TYR QD 3.800 . 5.600 4.507 4.236 4.693 . 0 0 "[ . 1 . 2 ]" 1 1418 1 55 ALA HA 1 68 CYS H 3.600 . 5.200 4.511 4.269 4.789 . 0 0 "[ . 1 . 2 ]" 1 1419 1 55 ALA HA 1 69 LEU QD 2.500 . 3.300 2.404 1.978 2.889 . 0 0 "[ . 1 . 2 ]" 1 1420 1 55 ALA HA 1 70 PRO QD 2.700 . 3.600 2.592 2.245 3.316 . 0 0 "[ . 1 . 2 ]" 1 1421 1 55 ALA MB 1 56 VAL H 2.500 . 3.300 2.761 2.524 3.199 . 0 0 "[ . 1 . 2 ]" 1 1422 1 55 ALA MB 1 56 VAL HA 3.500 . 5.000 4.109 3.975 4.272 . 0 0 "[ . 1 . 2 ]" 1 1423 1 55 ALA MB 1 67 TYR HA 3.700 . 5.400 4.136 3.738 4.566 . 0 0 "[ . 1 . 2 ]" 1 1424 1 55 ALA MB 1 67 TYR QD 2.500 . 3.300 3.045 2.705 3.303 0.003 11 0 "[ . 1 . 2 ]" 1 1425 1 55 ALA MB 1 67 TYR QE 3.200 . 4.500 3.795 3.426 4.265 . 0 0 "[ . 1 . 2 ]" 1 1426 1 55 ALA MB 1 68 CYS H 3.200 . 4.500 3.437 3.141 3.706 . 0 0 "[ . 1 . 2 ]" 1 1427 1 55 ALA MB 1 68 CYS HA 5.400 . 7.000 4.591 4.082 4.987 . 0 0 "[ . 1 . 2 ]" 1 1428 1 55 ALA MB 1 69 LEU HA 3.800 . 5.600 3.673 3.301 4.325 . 0 0 "[ . 1 . 2 ]" 1 1429 1 56 VAL H 1 56 VAL HA 2.800 . 3.800 2.955 2.948 2.959 . 0 0 "[ . 1 . 2 ]" 1 1430 1 56 VAL H 1 56 VAL HB 3.600 . 5.200 3.794 3.678 3.870 . 0 0 "[ . 1 . 2 ]" 1 1431 1 56 VAL H 1 56 VAL QG 2.400 . 3.100 2.034 1.899 2.140 . 0 0 "[ . 1 . 2 ]" 1 1432 1 56 VAL H 1 56 VAL QG 2.800 . 3.800 2.026 1.896 2.127 . 0 0 "[ . 1 . 2 ]" 1 1433 1 56 VAL H 1 57 ARG H 3.700 . 5.400 4.470 4.395 4.552 . 0 0 "[ . 1 . 2 ]" 1 1434 1 56 VAL H 1 67 TYR HA 4.300 . 6.600 4.690 4.211 5.055 . 0 0 "[ . 1 . 2 ]" 1 1435 1 56 VAL H 1 67 TYR QD 3.900 . 5.800 4.165 3.843 4.512 . 0 0 "[ . 1 . 2 ]" 1 1436 1 56 VAL H 1 68 CYS H 2.800 . 3.800 3.118 2.835 3.520 . 0 0 "[ . 1 . 2 ]" 1 1437 1 56 VAL H 1 68 CYS HA 4.000 . 6.000 4.904 4.754 5.254 . 0 0 "[ . 1 . 2 ]" 1 1438 1 56 VAL H 1 70 PRO QD 3.200 . 4.500 3.075 2.397 3.655 . 0 0 "[ . 1 . 2 ]" 1 1439 1 56 VAL HA 1 56 VAL HB 2.200 . 2.800 2.445 2.241 2.563 . 0 0 "[ . 1 . 2 ]" 1 1440 1 56 VAL HA 1 56 VAL QG 2.300 . 3.000 2.286 2.152 2.661 . 0 0 "[ . 1 . 2 ]" 1 1441 1 56 VAL HA 1 57 ARG H 2.200 . 2.800 2.324 2.203 2.574 . 0 0 "[ . 1 . 2 ]" 1 1442 1 56 VAL HA 1 57 ARG HA 3.800 . 5.600 4.416 4.370 4.485 . 0 0 "[ . 1 . 2 ]" 1 1443 1 56 VAL HA 1 57 ARG HB3 4.200 . 6.400 5.712 5.605 5.780 . 0 0 "[ . 1 . 2 ]" 1 1444 1 56 VAL HA 1 57 ARG HG3 3.900 . 5.800 3.961 3.586 4.464 . 0 0 "[ . 1 . 2 ]" 1 1445 1 56 VAL HA 1 67 TYR QD 3.700 . 5.400 4.200 3.857 4.548 . 0 0 "[ . 1 . 2 ]" 1 1446 1 56 VAL HA 1 67 TYR QE 3.900 . 5.800 4.579 4.276 4.925 . 0 0 "[ . 1 . 2 ]" 1 1447 1 56 VAL HB 1 57 ARG H 2.300 . 3.000 2.764 2.199 3.072 0.072 13 0 "[ . 1 . 2 ]" 1 1448 1 56 VAL HB 1 57 ARG HA 5.000 . 7.000 4.790 4.433 5.399 . 0 0 "[ . 1 . 2 ]" 1 1449 1 56 VAL QG 1 57 ARG H 3.200 . 4.500 3.259 1.984 3.476 0.016 5 0 "[ . 1 . 2 ]" 1 1450 1 56 VAL QG 1 57 ARG H 3.300 . 4.700 2.934 1.962 3.249 . 0 0 "[ . 1 . 2 ]" 1 1451 1 56 VAL QG 1 57 ARG HA 4.100 . 4.800 3.995 3.223 4.265 . 0 0 "[ . 1 . 2 ]" 1 1452 1 56 VAL QG 1 58 THR H 4.200 . 6.400 4.471 3.514 4.963 . 0 0 "[ . 1 . 2 ]" 1 1453 1 56 VAL QG 1 58 THR HA 4.100 . 6.200 5.002 3.831 5.598 . 0 0 "[ . 1 . 2 ]" 1 1454 1 56 VAL QG 1 58 THR HB 3.300 . 4.700 3.439 2.760 4.524 . 0 0 "[ . 1 . 2 ]" 1 1455 1 56 VAL QG 1 67 TYR HA 3.800 . 5.600 4.661 4.442 4.883 . 0 0 "[ . 1 . 2 ]" 1 1456 1 56 VAL QG 1 67 TYR QE 4.000 . 6.000 5.455 5.228 5.592 . 0 0 "[ . 1 . 2 ]" 1 1457 1 56 VAL QG 1 68 CYS H 2.900 . 4.000 3.347 3.137 3.598 . 0 0 "[ . 1 . 2 ]" 1 1458 1 56 VAL QG 1 68 CYS HA 4.400 . 6.800 4.580 4.257 4.959 . 0 0 "[ . 1 . 2 ]" 1 1459 1 56 VAL QG 1 69 LEU HA 4.100 . 6.200 3.320 2.745 3.781 . 0 0 "[ . 1 . 2 ]" 1 1460 1 56 VAL QG 1 71 ALA H 5.900 . 6.600 4.406 3.926 4.730 . 0 0 "[ . 1 . 2 ]" 1 1461 1 56 VAL QG 1 70 PRO HA 2.900 . 4.000 3.522 3.086 3.766 . 0 0 "[ . 1 . 2 ]" 1 1462 1 56 VAL QG 1 70 PRO HB2 3.500 . 4.700 4.219 3.530 5.049 0.349 20 0 "[ . 1 . 2 ]" 1 1463 1 56 VAL QG 1 70 PRO QD 2.900 . 4.000 2.570 2.144 3.159 . 0 0 "[ . 1 . 2 ]" 1 1464 1 56 VAL QG 1 71 ALA H 4.100 . 6.200 5.161 4.828 5.697 . 0 0 "[ . 1 . 2 ]" 1 1465 1 57 ARG H 1 57 ARG HA 2.900 . 4.000 2.939 2.902 2.962 . 0 0 "[ . 1 . 2 ]" 1 1466 1 57 ARG H 1 57 ARG QB 2.700 . 3.600 2.547 2.297 2.880 . 0 0 "[ . 1 . 2 ]" 1 1467 1 57 ARG H 1 57 ARG HG3 3.300 . 4.700 2.788 2.407 3.797 . 0 0 "[ . 1 . 2 ]" 1 1468 1 57 ARG H 1 58 THR H 3.700 . 5.400 4.476 4.263 4.591 . 0 0 "[ . 1 . 2 ]" 1 1469 1 57 ARG H 1 67 TYR HA 4.900 . 7.000 4.698 4.349 5.078 . 0 0 "[ . 1 . 2 ]" 1 1470 1 57 ARG H 1 67 TYR QD 4.600 . 7.000 4.241 3.898 4.724 . 0 0 "[ . 1 . 2 ]" 1 1471 1 57 ARG H 1 67 TYR QE 5.000 . 7.000 4.665 4.230 5.418 . 0 0 "[ . 1 . 2 ]" 1 1472 1 57 ARG H 1 68 CYS H 5.400 . 7.000 4.812 4.561 4.965 . 0 0 "[ . 1 . 2 ]" 1 1473 1 57 ARG HA 1 57 ARG HB2 2.800 . 3.800 3.017 2.990 3.035 . 0 0 "[ . 1 . 2 ]" 1 1474 1 57 ARG HA 1 57 ARG HB3 2.400 . 3.100 2.452 2.300 2.611 . 0 0 "[ . 1 . 2 ]" 1 1475 1 57 ARG HA 1 57 ARG HD2 3.500 . 5.000 4.431 3.524 4.910 . 0 0 "[ . 1 . 2 ]" 1 1476 1 57 ARG HA 1 57 ARG HD3 3.000 . 7.000 4.738 4.021 5.110 . 0 0 "[ . 1 . 2 ]" 1 1477 1 57 ARG HA 1 57 ARG HG2 2.600 . 3.400 2.538 2.200 2.783 . 0 0 "[ . 1 . 2 ]" 1 1478 1 57 ARG HA 1 57 ARG HG3 2.900 . 4.000 3.323 2.976 3.704 . 0 0 "[ . 1 . 2 ]" 1 1479 1 57 ARG HA 1 58 THR H 2.100 . 2.700 2.193 2.094 2.250 . 0 0 "[ . 1 . 2 ]" 1 1480 1 57 ARG HA 1 58 THR HA 3.800 . 5.600 4.451 4.394 4.477 . 0 0 "[ . 1 . 2 ]" 1 1481 1 57 ARG HA 1 58 THR HB 4.100 . 6.200 4.487 3.983 5.746 . 0 0 "[ . 1 . 2 ]" 1 1482 1 57 ARG HA 1 58 THR MG 3.400 . 4.800 4.039 3.275 4.977 0.177 5 0 "[ . 1 . 2 ]" 1 1483 1 57 ARG HA 1 66 VAL H 3.900 . 5.800 4.718 4.336 5.178 . 0 0 "[ . 1 . 2 ]" 1 1484 1 57 ARG HA 1 66 VAL HB 4.800 . 7.000 5.858 5.598 6.071 . 0 0 "[ . 1 . 2 ]" 1 1485 1 57 ARG HA 1 66 VAL QG 3.500 . 5.000 4.635 4.390 4.851 . 0 0 "[ . 1 . 2 ]" 1 1486 1 57 ARG HA 1 67 TYR H 4.900 . 7.000 4.530 4.226 4.851 . 0 0 "[ . 1 . 2 ]" 1 1487 1 57 ARG HA 1 67 TYR HA 2.200 . 2.800 2.440 2.289 2.595 . 0 0 "[ . 1 . 2 ]" 1 1488 1 57 ARG HA 1 67 TYR QD 3.300 . 4.700 3.316 3.005 3.561 . 0 0 "[ . 1 . 2 ]" 1 1489 1 57 ARG HA 1 67 TYR QE 4.400 . 6.800 4.760 4.333 5.047 . 0 0 "[ . 1 . 2 ]" 1 1490 1 57 ARG HA 1 68 CYS H 3.100 . 4.300 3.276 2.957 3.639 . 0 0 "[ . 1 . 2 ]" 1 1491 1 57 ARG HA 1 68 CYS HB3 3.800 . 5.600 5.104 4.308 5.681 0.081 13 0 "[ . 1 . 2 ]" 1 1492 1 57 ARG QB 1 57 ARG QH2 4.200 . 6.400 3.615 3.254 4.431 . 0 0 "[ . 1 . 2 ]" 1 1493 1 57 ARG QB 1 58 THR H 3.100 . 4.300 3.096 2.808 3.470 . 0 0 "[ . 1 . 2 ]" 1 1494 1 57 ARG QB 1 67 TYR QD 3.400 . 4.800 4.181 3.950 4.299 . 0 0 "[ . 1 . 2 ]" 1 1495 1 57 ARG QB 1 67 TYR QE 3.400 . 4.800 4.385 4.040 4.529 . 0 0 "[ . 1 . 2 ]" 1 1496 1 57 ARG HB2 1 57 ARG HE 3.800 . 5.600 3.068 1.961 3.898 0.039 21 0 "[ . 1 . 2 ]" 1 1497 1 57 ARG HB2 1 58 THR H 3.400 . 4.800 4.103 3.646 4.395 . 0 0 "[ . 1 . 2 ]" 1 1498 1 57 ARG HB3 1 57 ARG HE 3.200 . 4.500 2.437 1.832 3.304 0.068 3 0 "[ . 1 . 2 ]" 1 1499 1 57 ARG HB3 1 58 THR H 2.900 . 4.000 3.210 2.861 3.637 . 0 0 "[ . 1 . 2 ]" 1 1500 1 57 ARG HB3 1 67 TYR HA 3.400 . 4.800 4.201 3.619 4.762 . 0 0 "[ . 1 . 2 ]" 1 1501 1 57 ARG HB3 1 67 TYR QD 3.600 . 5.200 4.583 4.119 4.949 . 0 0 "[ . 1 . 2 ]" 1 1502 1 57 ARG HB3 1 67 TYR QE 3.400 . 4.800 5.009 4.775 5.427 0.627 4 4 "[ * +. 1 . - 2 *]" 1 1503 1 57 ARG HD2 1 57 ARG HG2 2.800 . 3.800 2.377 2.231 2.654 . 0 0 "[ . 1 . 2 ]" 1 1504 1 57 ARG HD2 1 57 ARG HG3 2.900 . 4.000 2.685 2.387 3.018 . 0 0 "[ . 1 . 2 ]" 1 1505 1 57 ARG HD2 1 57 ARG QH2 2.800 . 7.000 4.089 3.998 4.225 . 0 0 "[ . 1 . 2 ]" 1 1506 1 57 ARG HD2 1 67 TYR QD 3.200 . 4.500 4.020 3.377 4.603 0.103 4 0 "[ . 1 . 2 ]" 1 1507 1 57 ARG HD2 1 67 TYR QE 3.400 . 4.800 3.225 2.746 4.897 0.097 4 0 "[ . 1 . 2 ]" 1 1508 1 57 ARG HD3 1 57 ARG HE 2.800 . 3.800 2.738 2.299 2.967 . 0 0 "[ . 1 . 2 ]" 1 1509 1 57 ARG HD3 1 57 ARG HG3 2.800 . 3.800 2.381 2.238 2.658 . 0 0 "[ . 1 . 2 ]" 1 1510 1 57 ARG HD3 1 57 ARG QH2 3.100 . 4.300 4.091 4.009 4.250 . 0 0 "[ . 1 . 2 ]" 1 1511 1 57 ARG HD3 1 67 TYR QE 3.100 . 4.300 3.433 2.870 3.852 . 0 0 "[ . 1 . 2 ]" 1 1512 1 57 ARG HE 1 57 ARG HG2 3.500 . 5.000 3.184 2.398 3.834 . 0 0 "[ . 1 . 2 ]" 1 1513 1 57 ARG HE 1 57 ARG HG3 3.300 . 4.700 3.424 2.249 3.929 . 0 0 "[ . 1 . 2 ]" 1 1514 1 57 ARG HE 1 65 MET HB3 4.200 . 6.400 3.810 2.787 4.346 . 0 0 "[ . 1 . 2 ]" 1 1515 1 57 ARG HE 1 65 MET ME 4.300 . 6.600 4.251 3.001 6.577 . 0 0 "[ . 1 . 2 ]" 1 1516 1 57 ARG HE 1 65 MET HG2 4.400 . 6.800 6.472 5.539 6.953 0.153 15 0 "[ . 1 . 2 ]" 1 1517 1 57 ARG HE 1 65 MET HG3 4.700 . 7.000 6.024 4.508 6.881 . 0 0 "[ . 1 . 2 ]" 1 1518 1 57 ARG HG2 1 57 ARG QH2 3.600 . 5.200 4.878 4.296 5.434 0.234 23 0 "[ . 1 . 2 ]" 1 1519 1 57 ARG HG2 1 58 THR H 4.200 . 6.400 4.431 3.958 4.840 . 0 0 "[ . 1 . 2 ]" 1 1520 1 57 ARG HG2 1 67 TYR HA 3.100 . 4.300 2.968 2.277 3.502 . 0 0 "[ . 1 . 2 ]" 1 1521 1 57 ARG HG2 1 67 TYR QD 3.000 . 4.100 2.512 2.181 2.883 . 0 0 "[ . 1 . 2 ]" 1 1522 1 57 ARG HG2 1 67 TYR QE 3.400 . 4.800 2.828 2.383 3.603 . 0 0 "[ . 1 . 2 ]" 1 1523 1 57 ARG HG2 1 68 CYS H 4.300 . 6.600 4.559 3.894 5.193 . 0 0 "[ . 1 . 2 ]" 1 1524 1 57 ARG HG3 1 57 ARG QH2 4.500 . 7.000 5.107 4.271 5.468 . 0 0 "[ . 1 . 2 ]" 1 1525 1 57 ARG HG3 1 58 THR H 4.000 . 6.000 5.226 4.949 5.521 . 0 0 "[ . 1 . 2 ]" 1 1526 1 57 ARG HG3 1 67 TYR HA 3.500 . 5.000 4.297 3.271 5.032 0.032 10 0 "[ . 1 . 2 ]" 1 1527 1 57 ARG HG3 1 67 TYR QD 3.200 . 4.500 3.315 2.445 4.163 . 0 0 "[ . 1 . 2 ]" 1 1528 1 57 ARG HG3 1 67 TYR QE 3.200 . 4.500 2.744 2.110 3.744 . 0 0 "[ . 1 . 2 ]" 1 1529 1 57 ARG QH2 1 65 MET HB2 3.700 . 5.400 3.292 2.506 4.324 . 0 0 "[ . 1 . 2 ]" 1 1530 1 57 ARG QH2 1 65 MET HB3 3.800 . 5.600 2.996 2.371 4.669 . 0 0 "[ . 1 . 2 ]" 1 1531 1 57 ARG QH2 1 65 MET ME 3.600 . 5.200 3.850 2.558 5.215 0.015 11 0 "[ . 1 . 2 ]" 1 1532 1 57 ARG QH2 1 65 MET HG3 3.600 . 5.200 4.302 3.170 5.971 0.771 4 1 "[ +. 1 . 2 ]" 1 1533 1 58 THR H 1 58 THR HA 2.700 . 3.600 2.911 2.870 2.959 . 0 0 "[ . 1 . 2 ]" 1 1534 1 58 THR H 1 58 THR HB 3.200 . 4.500 3.303 2.592 3.859 . 0 0 "[ . 1 . 2 ]" 1 1535 1 58 THR H 1 58 THR MG 2.700 . 3.600 2.758 2.328 3.770 0.170 21 0 "[ . 1 . 2 ]" 1 1536 1 58 THR H 1 59 ARG H 4.400 . 6.800 4.414 4.356 4.479 . 0 0 "[ . 1 . 2 ]" 1 1537 1 58 THR H 1 65 MET HA 4.000 . 6.000 4.009 3.489 4.425 . 0 0 "[ . 1 . 2 ]" 1 1538 1 58 THR H 1 65 MET ME 3.400 . 4.800 4.047 3.230 4.743 . 0 0 "[ . 1 . 2 ]" 1 1539 1 58 THR H 1 66 VAL H 2.600 . 3.400 3.181 2.856 3.487 0.087 12 0 "[ . 1 . 2 ]" 1 1540 1 58 THR H 1 66 VAL HA 4.800 . 7.000 4.611 4.426 4.812 . 0 0 "[ . 1 . 2 ]" 1 1541 1 58 THR H 1 66 VAL QG 3.100 . 4.300 3.618 3.447 3.830 . 0 0 "[ . 1 . 2 ]" 1 1542 1 58 THR H 1 67 TYR H 3.400 . 4.800 4.931 4.837 4.996 0.196 22 0 "[ . 1 . 2 ]" 1 1543 1 58 THR H 1 67 TYR HA 3.400 . 4.800 3.811 3.601 4.099 . 0 0 "[ . 1 . 2 ]" 1 1544 1 58 THR H 1 68 CYS HB3 3.700 . 5.400 4.761 4.212 5.420 0.020 13 0 "[ . 1 . 2 ]" 1 1545 1 58 THR HA 1 58 THR MG 2.600 . 3.400 3.087 2.033 3.250 . 0 0 "[ . 1 . 2 ]" 1 1546 1 58 THR HA 1 59 ARG H 2.300 . 3.000 2.440 2.284 2.660 . 0 0 "[ . 1 . 2 ]" 1 1547 1 58 THR HA 1 59 ARG HA 3.600 . 5.200 4.343 4.302 4.370 . 0 0 "[ . 1 . 2 ]" 1 1548 1 58 THR HA 1 59 ARG QB 4.100 . 6.200 4.230 4.024 4.452 . 0 0 "[ . 1 . 2 ]" 1 1549 1 58 THR HA 1 59 ARG QG 3.900 . 5.800 4.859 4.315 5.847 0.047 15 0 "[ . 1 . 2 ]" 1 1550 1 58 THR HA 1 65 MET ME 2.900 . 4.000 2.864 2.355 3.775 . 0 0 "[ . 1 . 2 ]" 1 1551 1 58 THR HB 1 58 THR MG 2.300 . 3.000 2.104 2.067 2.114 . 0 0 "[ . 1 . 2 ]" 1 1552 1 58 THR HB 1 59 ARG H 3.200 . 4.500 3.688 2.277 4.177 . 0 0 "[ . 1 . 2 ]" 1 1553 1 58 THR MG 1 59 ARG H 2.900 . 4.000 3.077 2.339 3.902 . 0 0 "[ . 1 . 2 ]" 1 1554 1 58 THR MG 1 59 ARG HA 4.800 . 7.000 4.325 3.796 5.644 . 0 0 "[ . 1 . 2 ]" 1 1555 1 58 THR MG 1 60 ASN HA 4.200 . 6.400 4.243 3.567 6.435 0.035 11 0 "[ . 1 . 2 ]" 1 1556 1 58 THR MG 1 66 VAL H 4.600 . 7.000 4.312 3.801 5.716 . 0 0 "[ . 1 . 2 ]" 1 1557 1 58 THR MG 1 68 CYS H 3.800 . 5.600 4.446 3.201 5.594 . 0 0 "[ . 1 . 2 ]" 1 1558 1 58 THR MG 1 68 CYS HA 4.400 . 6.800 5.085 4.141 6.470 . 0 0 "[ . 1 . 2 ]" 1 1559 1 59 ARG H 1 59 ARG HA 2.900 . 4.000 2.882 2.843 2.911 . 0 0 "[ . 1 . 2 ]" 1 1560 1 59 ARG H 1 59 ARG QB . . 3.300 2.136 2.070 2.537 . 0 0 "[ . 1 . 2 ]" 1 1561 1 59 ARG H 1 59 ARG QG 2.800 . 3.800 3.294 2.429 3.746 . 0 0 "[ . 1 . 2 ]" 1 1562 1 59 ARG HA 1 59 ARG QB 2.500 . 3.300 2.436 2.129 2.557 . 0 0 "[ . 1 . 2 ]" 1 1563 1 59 ARG HA 1 59 ARG QD 3.000 . 4.100 3.894 3.649 4.245 0.145 16 0 "[ . 1 . 2 ]" 1 1564 1 59 ARG HA 1 59 ARG QG 2.400 . 3.100 2.381 2.088 3.300 0.200 3 0 "[ . 1 . 2 ]" 1 1565 1 59 ARG HA 1 60 ASN H 2.500 . 3.300 2.183 2.105 2.258 . 0 0 "[ . 1 . 2 ]" 1 1566 1 59 ARG HA 1 60 ASN H 2.400 . 3.000 2.125 2.055 2.187 . 0 0 "[ . 1 . 2 ]" 1 1567 1 59 ARG HA 1 64 GLU H 4.200 . 6.400 3.854 3.388 4.281 . 0 0 "[ . 1 . 2 ]" 1 1568 1 59 ARG HA 1 63 MET HA 3.700 . 5.400 4.036 3.573 4.654 . 0 0 "[ . 1 . 2 ]" 1 1569 1 59 ARG HA 1 64 GLU HB2 5.900 . 7.000 3.838 2.254 4.475 . 0 0 "[ . 1 . 2 ]" 1 1570 1 59 ARG HA 1 65 MET H 4.000 . 6.000 4.302 3.861 4.695 . 0 0 "[ . 1 . 2 ]" 1 1571 1 59 ARG HA 1 65 MET HA 2.300 . 3.000 2.642 2.219 3.035 0.035 23 0 "[ . 1 . 2 ]" 1 1572 1 59 ARG HA 1 66 VAL H 3.200 . 4.500 3.418 3.065 3.668 . 0 0 "[ . 1 . 2 ]" 1 1573 1 59 ARG HA 1 66 VAL QG 3.800 . 5.600 3.722 3.335 4.047 . 0 0 "[ . 1 . 2 ]" 1 1574 1 59 ARG QB 1 59 ARG HE 4.000 . 6.000 2.911 2.064 3.959 . 0 0 "[ . 1 . 2 ]" 1 1575 1 59 ARG QB 1 60 ASN H 3.100 . 4.100 3.379 2.821 3.679 . 0 0 "[ . 1 . 2 ]" 1 1576 1 59 ARG QB 1 63 MET HA 2.500 . 3.300 2.881 1.972 3.334 0.034 12 0 "[ . 1 . 2 ]" 1 1577 1 59 ARG QB 1 64 GLU H 3.000 . 4.100 3.504 3.189 3.588 . 0 0 "[ . 1 . 2 ]" 1 1578 1 59 ARG QB 1 65 MET H 3.000 . 4.100 3.232 2.970 3.426 . 0 0 "[ . 1 . 2 ]" 1 1579 1 59 ARG QB 1 65 MET HA 4.100 . 6.200 4.359 3.341 4.944 . 0 0 "[ . 1 . 2 ]" 1 1580 1 59 ARG QD 1 60 ASN H 4.400 . 6.800 4.533 4.216 4.770 . 0 0 "[ . 1 . 2 ]" 1 1581 1 59 ARG QD 1 62 LYS QB 3.400 . 7.000 6.323 6.151 6.517 . 0 0 "[ . 1 . 2 ]" 1 1582 1 59 ARG QD 1 63 MET H 3.700 . 5.400 3.772 3.152 4.237 . 0 0 "[ . 1 . 2 ]" 1 1583 1 59 ARG QD 1 63 MET HB3 3.000 . 4.100 2.614 2.088 3.654 . 0 0 "[ . 1 . 2 ]" 1 1584 1 59 ARG QD 1 63 MET QG 3.800 . 5.600 3.650 2.708 4.354 . 0 0 "[ . 1 . 2 ]" 1 1585 1 59 ARG HD3 1 63 MET HA 2.700 . 3.600 2.728 1.931 3.848 0.248 2 0 "[ . 1 . 2 ]" 1 1586 1 59 ARG HE 1 59 ARG QG 3.000 . 4.100 2.781 2.174 3.412 . 0 0 "[ . 1 . 2 ]" 1 1587 1 59 ARG HE 1 63 MET HA 4.700 . 7.000 4.242 2.569 4.846 . 0 0 "[ . 1 . 2 ]" 1 1588 1 59 ARG QG 1 60 ASN H 3.000 . 4.100 3.326 2.641 3.801 . 0 0 "[ . 1 . 2 ]" 1 1589 1 59 ARG QG 1 63 MET HA 2.500 . 3.300 2.687 2.011 3.312 0.012 16 0 "[ . 1 . 2 ]" 1 1590 1 60 ASN H 1 60 ASN HB2 3.600 . 5.200 3.633 2.376 3.749 . 0 0 "[ . 1 . 2 ]" 1 1591 1 60 ASN H 1 60 ASN HB3 2.800 . 3.800 2.739 2.519 2.974 . 0 0 "[ . 1 . 2 ]" 1 1592 1 60 ASN H 1 60 ASN HD22 5.000 . 7.000 4.535 3.986 5.771 . 0 0 "[ . 1 . 2 ]" 1 1593 1 60 ASN H 1 61 ALA H 4.100 . 6.200 4.099 3.983 4.200 . 0 0 "[ . 1 . 2 ]" 1 1594 1 60 ASN H 1 62 LYS H 4.500 . 7.000 4.242 3.709 4.572 . 0 0 "[ . 1 . 2 ]" 1 1595 1 60 ASN H 1 63 MET H 4.200 . 6.400 3.968 3.529 4.334 . 0 0 "[ . 1 . 2 ]" 1 1596 1 60 ASN H 1 63 MET HA 3.600 . 5.200 3.828 3.336 4.178 . 0 0 "[ . 1 . 2 ]" 1 1597 1 60 ASN H 1 64 GLU H 3.000 . 4.100 2.752 2.256 3.156 . 0 0 "[ . 1 . 2 ]" 1 1598 1 60 ASN H 1 65 MET HA 4.000 . 6.000 4.070 3.744 4.519 . 0 0 "[ . 1 . 2 ]" 1 1599 1 60 ASN H 1 66 VAL QG 3.000 . 4.100 3.098 2.717 3.511 . 0 0 "[ . 1 . 2 ]" 1 1600 1 60 ASN HA 1 60 ASN HB2 2.100 . 2.700 2.423 2.347 2.560 . 0 0 "[ . 1 . 2 ]" 1 1601 1 60 ASN HA 1 60 ASN HB3 2.200 . 2.800 2.499 2.410 2.995 0.195 12 0 "[ . 1 . 2 ]" 1 1602 1 60 ASN HA 1 61 ALA H 2.400 . 3.100 2.815 2.659 3.048 . 0 0 "[ . 1 . 2 ]" 1 1603 1 60 ASN HA 1 61 ALA HA 3.900 . 5.800 4.355 4.316 4.395 . 0 0 "[ . 1 . 2 ]" 1 1604 1 60 ASN HA 1 61 ALA MB 4.600 . 7.000 4.416 4.304 4.512 . 0 0 "[ . 1 . 2 ]" 1 1605 1 60 ASN HA 1 62 LYS HA 3.800 . 7.000 7.057 6.891 7.132 0.132 8 0 "[ . 1 . 2 ]" 1 1606 1 60 ASN HA 1 66 VAL QG 3.500 . 5.000 3.730 2.991 4.227 . 0 0 "[ . 1 . 2 ]" 1 1607 1 60 ASN HB2 1 60 ASN HD21 2.800 . 3.800 2.527 2.268 2.878 . 0 0 "[ . 1 . 2 ]" 1 1608 1 60 ASN HB2 1 60 ASN HD22 3.400 . 4.800 3.605 3.501 3.768 . 0 0 "[ . 1 . 2 ]" 1 1609 1 60 ASN HB2 1 61 ALA H 2.300 . 3.000 2.019 1.822 3.657 0.657 12 1 "[ . 1 + . 2 ]" 1 1610 1 60 ASN HB2 1 61 ALA HA 2.800 . 7.000 4.698 4.524 5.942 . 0 0 "[ . 1 . 2 ]" 1 1611 1 60 ASN HB2 1 61 ALA MB 3.900 . 5.800 3.728 3.554 5.248 . 0 0 "[ . 1 . 2 ]" 1 1612 1 60 ASN HB2 1 62 LYS H 4.200 . 6.400 3.664 3.155 4.097 . 0 0 "[ . 1 . 2 ]" 1 1613 1 60 ASN HB2 1 66 VAL QG 3.000 . 4.100 3.257 2.114 3.862 . 0 0 "[ . 1 . 2 ]" 1 1614 1 60 ASN HB3 1 60 ASN HD21 2.700 . 3.600 2.551 2.236 2.886 . 0 0 "[ . 1 . 2 ]" 1 1615 1 60 ASN HB3 1 60 ASN HD22 3.700 . 5.400 3.614 3.479 3.760 . 0 0 "[ . 1 . 2 ]" 1 1616 1 60 ASN HB3 1 61 ALA H 2.800 . 3.800 3.447 2.853 3.570 . 0 0 "[ . 1 . 2 ]" 1 1617 1 60 ASN HB3 1 66 VAL QG . . 3.100 2.166 1.838 3.332 0.232 12 0 "[ . 1 . 2 ]" 1 1618 1 60 ASN HD21 1 61 ALA H 4.100 . 6.200 3.926 3.106 4.689 . 0 0 "[ . 1 . 2 ]" 1 1619 1 60 ASN HD21 1 62 LYS QB 3.700 . 5.400 4.639 3.806 5.228 . 0 0 "[ . 1 . 2 ]" 1 1620 1 60 ASN HD21 1 64 GLU H 3.600 . 5.200 4.752 3.811 5.070 . 0 0 "[ . 1 . 2 ]" 1 1621 1 60 ASN HD21 1 64 GLU HB2 3.600 . 5.200 3.539 2.156 4.091 . 0 0 "[ . 1 . 2 ]" 1 1622 1 60 ASN HD21 1 64 GLU HB3 4.100 . 6.200 4.970 3.506 5.642 . 0 0 "[ . 1 . 2 ]" 1 1623 1 60 ASN HD21 1 66 VAL QG 2.900 . 4.000 2.600 1.921 3.129 . 0 0 "[ . 1 . 2 ]" 1 1624 1 60 ASN HD22 1 62 LYS QB 3.100 . 4.300 3.366 2.523 4.829 0.529 12 1 "[ . 1 + . 2 ]" 1 1625 1 60 ASN HD22 1 64 GLU HB3 3.200 . 4.500 3.999 3.319 5.129 0.629 12 1 "[ . 1 + . 2 ]" 1 1626 1 60 ASN HD22 1 66 VAL QG 3.200 . 4.500 3.133 2.467 3.750 . 0 0 "[ . 1 . 2 ]" 1 1627 1 61 ALA H 1 61 ALA HA 2.600 . 3.400 2.805 2.758 2.861 . 0 0 "[ . 1 . 2 ]" 1 1628 1 61 ALA H 1 61 ALA MB 2.200 . 2.800 2.233 2.211 2.258 . 0 0 "[ . 1 . 2 ]" 1 1629 1 61 ALA H 1 62 LYS H 2.700 . 3.600 2.762 2.548 2.920 . 0 0 "[ . 1 . 2 ]" 1 1630 1 61 ALA H 1 63 MET H 3.400 . 4.800 4.536 4.311 4.862 0.062 4 0 "[ . 1 . 2 ]" 1 1631 1 61 ALA HA 1 62 LYS H 3.000 . 4.100 3.486 3.253 3.560 . 0 0 "[ . 1 . 2 ]" 1 1632 1 61 ALA HA 1 63 MET H 3.200 . 4.500 3.984 3.616 4.433 . 0 0 "[ . 1 . 2 ]" 1 1633 1 61 ALA MB 1 62 LYS H 6.000 . 7.000 2.910 2.652 3.406 . 0 0 "[ . 1 . 2 ]" 1 1634 1 61 ALA MB 1 63 MET H 4.900 . 6.600 4.094 3.972 4.274 . 0 0 "[ . 1 . 2 ]" 1 1635 1 62 LYS H 1 62 LYS HA 2.500 . 3.300 2.947 2.937 2.958 . 0 0 "[ . 1 . 2 ]" 1 1636 1 62 LYS H 1 62 LYS QB 2.400 . 3.100 2.521 2.393 2.731 . 0 0 "[ . 1 . 2 ]" 1 1637 1 62 LYS H 1 62 LYS QG 2.700 . 3.600 3.112 2.642 3.644 0.044 20 0 "[ . 1 . 2 ]" 1 1638 1 62 LYS H 1 63 MET H 2.400 . 3.100 2.741 2.314 3.118 0.018 8 0 "[ . 1 . 2 ]" 1 1639 1 62 LYS H 1 64 GLU H 3.600 . 5.200 3.345 3.038 3.688 . 0 0 "[ . 1 . 2 ]" 1 1640 1 62 LYS HA 1 62 LYS QB 2.400 . 3.100 2.375 2.331 2.421 . 0 0 "[ . 1 . 2 ]" 1 1641 1 62 LYS HA 1 62 LYS QE 5.100 . 7.000 4.471 2.644 5.094 . 0 0 "[ . 1 . 2 ]" 1 1642 1 62 LYS HA 1 62 LYS QG 2.700 . 3.600 2.404 2.225 2.882 . 0 0 "[ . 1 . 2 ]" 1 1643 1 62 LYS HA 1 63 MET H 2.600 . 3.400 2.907 2.574 3.112 . 0 0 "[ . 1 . 2 ]" 1 1644 1 62 LYS QB 1 62 LYS QD 3.700 . 5.400 2.164 2.064 2.327 . 0 0 "[ . 1 . 2 ]" 1 1645 1 62 LYS QB 1 63 MET H 3.700 . 4.700 3.779 3.646 3.910 . 0 0 "[ . 1 . 2 ]" 1 1646 1 62 LYS QB 1 63 MET QG 3.000 . 4.100 3.812 3.414 3.995 . 0 0 "[ . 1 . 2 ]" 1 1647 1 62 LYS QB 1 64 GLU H 3.300 . 4.700 3.556 2.954 4.443 . 0 0 "[ . 1 . 2 ]" 1 1648 1 63 MET H 1 63 MET HA 2.100 . 2.700 2.260 2.248 2.275 . 0 0 "[ . 1 . 2 ]" 1 1649 1 63 MET H 1 63 MET HB2 3.800 . 5.600 3.862 3.698 4.041 . 0 0 "[ . 1 . 2 ]" 1 1650 1 63 MET H 1 63 MET HB3 3.200 . 4.500 3.706 2.980 3.980 . 0 0 "[ . 1 . 2 ]" 1 1651 1 63 MET H 1 63 MET QG 3.200 . 4.500 2.910 2.445 3.292 . 0 0 "[ . 1 . 2 ]" 1 1652 1 63 MET H 1 64 GLU H 2.500 . 3.300 2.887 2.712 3.214 . 0 0 "[ . 1 . 2 ]" 1 1653 1 63 MET HA 1 63 MET HB2 2.600 . 3.400 2.874 2.465 3.016 . 0 0 "[ . 1 . 2 ]" 1 1654 1 63 MET HA 1 63 MET QG 3.500 . 5.000 3.029 2.558 3.362 . 0 0 "[ . 1 . 2 ]" 1 1655 1 63 MET HA 1 64 GLU H 2.800 . 3.800 3.039 2.646 3.292 . 0 0 "[ . 1 . 2 ]" 1 1656 1 63 MET HB2 1 64 GLU H 6.000 . 7.000 4.079 3.705 4.443 . 0 0 "[ . 1 . 2 ]" 1 1657 1 63 MET HB2 1 64 GLU HA 3.200 . 4.500 4.495 4.304 4.679 0.179 5 0 "[ . 1 . 2 ]" 1 1658 1 63 MET HB3 1 63 MET QG 2.200 . 2.800 2.358 2.249 2.483 . 0 0 "[ . 1 . 2 ]" 1 1659 1 63 MET HB3 1 64 GLU H 4.000 . 6.000 4.613 4.516 4.730 . 0 0 "[ . 1 . 2 ]" 1 1660 1 64 GLU H 1 64 GLU HA 2.800 . 3.800 2.925 2.891 2.956 . 0 0 "[ . 1 . 2 ]" 1 1661 1 64 GLU H 1 64 GLU HB2 2.500 . 3.300 2.554 2.428 2.673 . 0 0 "[ . 1 . 2 ]" 1 1662 1 64 GLU H 1 64 GLU HG3 2.600 . 3.400 2.883 2.108 4.007 0.607 15 1 "[ . 1 + 2 ]" 1 1663 1 64 GLU H 1 65 MET H 4.100 . 6.200 4.491 4.361 4.576 . 0 0 "[ . 1 . 2 ]" 1 1664 1 64 GLU H 1 66 VAL QG 4.300 . 6.600 4.107 3.876 4.398 . 0 0 "[ . 1 . 2 ]" 1 1665 1 64 GLU HA 1 65 MET H 2.200 . 2.800 2.179 2.150 2.236 . 0 0 "[ . 1 . 2 ]" 1 1666 1 64 GLU HA 1 65 MET HA 3.700 . 5.400 4.401 4.374 4.450 . 0 0 "[ . 1 . 2 ]" 1 1667 1 64 GLU HA 1 66 VAL QG 4.400 . 6.800 4.131 3.925 4.506 . 0 0 "[ . 1 . 2 ]" 1 1668 1 64 GLU HB3 1 66 VAL QG 2.400 . 3.100 2.690 2.303 3.083 . 0 0 "[ . 1 . 2 ]" 1 1669 1 64 GLU QG 1 65 MET H 3.700 . 5.400 4.304 3.928 4.587 . 0 0 "[ . 1 . 2 ]" 1 1670 1 65 MET H 1 65 MET HA 2.900 . 4.000 2.877 2.848 2.904 . 0 0 "[ . 1 . 2 ]" 1 1671 1 65 MET H 1 65 MET HB2 2.500 . 3.300 2.410 2.239 2.656 . 0 0 "[ . 1 . 2 ]" 1 1672 1 65 MET H 1 65 MET HB3 3.000 . 4.100 3.595 3.528 3.621 . 0 0 "[ . 1 . 2 ]" 1 1673 1 65 MET H 1 65 MET HG2 2.800 . 3.800 2.831 2.068 3.636 . 0 0 "[ . 1 . 2 ]" 1 1674 1 65 MET H 1 65 MET HG3 2.800 . 3.800 3.270 2.348 3.884 0.084 10 0 "[ . 1 . 2 ]" 1 1675 1 65 MET H 1 66 VAL H 3.200 . 4.500 4.173 3.892 4.475 . 0 0 "[ . 1 . 2 ]" 1 1676 1 65 MET H 1 66 VAL QG 4.200 . 6.400 3.871 3.649 4.131 . 0 0 "[ . 1 . 2 ]" 1 1677 1 65 MET HA 1 65 MET HB2 2.800 . 3.800 3.026 2.999 3.034 . 0 0 "[ . 1 . 2 ]" 1 1678 1 65 MET HA 1 65 MET HB3 2.500 . 3.300 2.524 2.400 2.653 . 0 0 "[ . 1 . 2 ]" 1 1679 1 65 MET HA 1 65 MET ME 5.000 . 7.000 3.041 2.197 3.817 . 0 0 "[ . 1 . 2 ]" 1 1680 1 65 MET HA 1 65 MET HG2 3.200 . 4.500 2.664 2.284 3.364 . 0 0 "[ . 1 . 2 ]" 1 1681 1 65 MET HA 1 65 MET HG3 3.500 . 5.000 3.593 3.107 3.814 . 0 0 "[ . 1 . 2 ]" 1 1682 1 65 MET HA 1 66 VAL H 2.200 . 2.800 2.244 2.128 2.382 . 0 0 "[ . 1 . 2 ]" 1 1683 1 65 MET HA 1 66 VAL QG 3.500 . 5.000 3.508 3.342 3.632 . 0 0 "[ . 1 . 2 ]" 1 1684 1 65 MET HB2 1 66 VAL H 3.800 . 5.600 4.499 4.324 4.583 . 0 0 "[ . 1 . 2 ]" 1 1685 1 65 MET HB3 1 65 MET HG2 2.900 . 4.000 2.858 2.516 3.015 . 0 0 "[ . 1 . 2 ]" 1 1686 1 65 MET HB3 1 65 MET HG3 2.500 . 3.300 2.697 2.380 3.005 . 0 0 "[ . 1 . 2 ]" 1 1687 1 65 MET HB3 1 66 VAL H 3.500 . 5.000 3.961 3.484 4.224 . 0 0 "[ . 1 . 2 ]" 1 1688 1 65 MET ME 1 66 VAL H 3.000 . 4.100 3.545 3.365 3.680 . 0 0 "[ . 1 . 2 ]" 1 1689 1 65 MET HG3 1 66 VAL H 3.700 . 5.400 5.666 5.281 5.953 0.553 7 3 "[ . + 1 *- . 2 ]" 1 1690 1 66 VAL H 1 66 VAL QG 2.300 . 3.000 1.974 1.814 2.162 . 0 0 "[ . 1 . 2 ]" 1 1691 1 66 VAL H 1 67 TYR H 3.700 . 5.400 4.480 4.402 4.536 . 0 0 "[ . 1 . 2 ]" 1 1692 1 66 VAL HA 1 66 VAL HB 2.200 . 2.800 2.494 2.438 2.539 . 0 0 "[ . 1 . 2 ]" 1 1693 1 66 VAL HA 1 66 VAL QG . . 2.700 2.248 2.153 2.331 . 0 0 "[ . 1 . 2 ]" 1 1694 1 66 VAL HA 1 67 TYR H 2.300 . 3.000 2.366 2.234 2.513 . 0 0 "[ . 1 . 2 ]" 1 1695 1 66 VAL HA 1 67 TYR QD 3.500 . 5.000 4.972 4.675 5.092 0.092 5 0 "[ . 1 . 2 ]" 1 1696 1 66 VAL HB 1 66 VAL QG 2.100 . 2.700 1.894 1.883 1.902 . 0 0 "[ . 1 . 2 ]" 1 1697 1 66 VAL HB 1 67 TYR H 2.400 . 3.100 2.309 2.043 2.633 . 0 0 "[ . 1 . 2 ]" 1 1698 1 66 VAL HB 1 67 TYR HA 4.400 . 6.800 4.682 4.543 4.816 . 0 0 "[ . 1 . 2 ]" 1 1699 1 66 VAL QG 1 67 TYR H 3.300 . 4.700 3.105 2.958 3.259 . 0 0 "[ . 1 . 2 ]" 1 1700 1 66 VAL QG 1 67 TYR HA 3.600 . 5.200 4.281 4.155 4.437 . 0 0 "[ . 1 . 2 ]" 1 1701 1 66 VAL QG 1 68 CYS H 3.900 . 5.800 4.776 4.355 5.034 . 0 0 "[ . 1 . 2 ]" 1 1702 1 66 VAL QG 1 68 CYS HA 4.000 . 6.000 4.692 4.479 5.038 . 0 0 "[ . 1 . 2 ]" 1 1703 1 67 TYR H 1 67 TYR HA 3.000 . 4.100 2.868 2.834 2.894 . 0 0 "[ . 1 . 2 ]" 1 1704 1 67 TYR H 1 67 TYR HB2 2.700 . 3.600 2.216 2.173 2.274 . 0 0 "[ . 1 . 2 ]" 1 1705 1 67 TYR H 1 67 TYR HB3 2.400 . 7.000 3.498 3.438 3.536 . 0 0 "[ . 1 . 2 ]" 1 1706 1 67 TYR H 1 67 TYR QD 2.700 . 3.600 3.525 3.236 3.662 0.062 3 0 "[ . 1 . 2 ]" 1 1707 1 67 TYR H 1 67 TYR QE 4.300 . 6.600 5.242 5.016 5.446 . 0 0 "[ . 1 . 2 ]" 1 1708 1 67 TYR H 1 68 CYS H 4.200 . 6.400 4.540 4.410 4.591 . 0 0 "[ . 1 . 2 ]" 1 1709 1 67 TYR HA 1 67 TYR HB2 2.400 . 3.100 3.002 2.977 3.018 . 0 0 "[ . 1 . 2 ]" 1 1710 1 67 TYR HA 1 67 TYR HB3 2.600 . 3.400 2.662 2.593 2.721 . 0 0 "[ . 1 . 2 ]" 1 1711 1 67 TYR HA 1 67 TYR QD 2.400 . 3.100 2.120 1.965 2.335 . 0 0 "[ . 1 . 2 ]" 1 1712 1 67 TYR HA 1 67 TYR QE 3.700 . 5.400 4.263 4.159 4.378 . 0 0 "[ . 1 . 2 ]" 1 1713 1 67 TYR HA 1 68 CYS H 2.200 . 2.800 2.184 2.130 2.254 . 0 0 "[ . 1 . 2 ]" 1 1714 1 67 TYR HB2 1 67 TYR QD 2.200 . 2.800 2.298 2.279 2.333 . 0 0 "[ . 1 . 2 ]" 1 1715 1 67 TYR HB2 1 68 CYS H 3.100 . 4.300 4.261 4.075 4.518 0.218 17 0 "[ . 1 . 2 ]" 1 1716 1 67 TYR HB2 1 68 CYS HA 3.800 . 5.600 5.010 4.797 5.113 . 0 0 "[ . 1 . 2 ]" 1 1717 1 67 TYR HB3 1 67 TYR QD 2.300 . 3.000 2.713 2.645 2.749 . 0 0 "[ . 1 . 2 ]" 1 1718 1 67 TYR HB3 1 67 TYR QE 3.500 . 5.000 4.479 4.465 4.498 . 0 0 "[ . 1 . 2 ]" 1 1719 1 67 TYR HB3 1 68 CYS H 3.300 . 4.700 3.162 2.866 3.695 . 0 0 "[ . 1 . 2 ]" 1 1720 1 67 TYR QD 1 68 CYS H 3.100 . 4.300 3.125 2.600 3.586 . 0 0 "[ . 1 . 2 ]" 1 1721 1 67 TYR QD 1 68 CYS HA 5.400 . 7.000 5.464 5.130 5.641 . 0 0 "[ . 1 . 2 ]" 1 1722 1 67 TYR QD 1 69 LEU QD 3.900 . 5.800 5.661 5.489 5.754 . 0 0 "[ . 1 . 2 ]" 1 1723 1 67 TYR QE 1 68 CYS H 5.500 . 7.000 5.378 4.870 5.799 . 0 0 "[ . 1 . 2 ]" 1 1724 1 68 CYS H 1 68 CYS HA 2.800 . 3.800 2.914 2.871 2.960 . 0 0 "[ . 1 . 2 ]" 1 1725 1 68 CYS H 1 68 CYS HB2 3.100 . 4.300 3.498 2.748 3.932 . 0 0 "[ . 1 . 2 ]" 1 1726 1 68 CYS H 1 68 CYS HB3 3.000 . 4.100 3.263 2.852 3.880 . 0 0 "[ . 1 . 2 ]" 1 1727 1 68 CYS H 1 69 LEU H 4.200 . 6.400 4.380 4.328 4.450 . 0 0 "[ . 1 . 2 ]" 1 1728 1 68 CYS HA 1 68 CYS HB2 2.400 . 3.100 2.567 2.396 3.036 . 0 0 "[ . 1 . 2 ]" 1 1729 1 68 CYS HA 1 68 CYS HB3 2.300 . 3.000 2.683 2.356 3.036 0.036 12 0 "[ . 1 . 2 ]" 1 1730 1 68 CYS HA 1 69 LEU H 2.300 . 3.000 2.457 2.338 2.536 . 0 0 "[ . 1 . 2 ]" 1 1731 1 68 CYS HA 1 69 LEU QB 4.500 . 7.000 3.923 3.822 4.111 . 0 0 "[ . 1 . 2 ]" 1 1732 1 68 CYS HA 1 69 LEU QD 4.000 . 6.000 4.390 3.942 4.573 . 0 0 "[ . 1 . 2 ]" 1 1733 1 68 CYS QB 1 69 LEU H 2.500 . 3.300 2.654 2.231 3.260 . 0 0 "[ . 1 . 2 ]" 1 1734 1 68 CYS HB2 1 69 LEU H 2.700 . 3.600 3.063 2.251 3.798 0.198 9 0 "[ . 1 . 2 ]" 1 1735 1 68 CYS HB3 1 69 LEU H 2.700 . 3.600 3.373 2.377 3.712 0.112 1 0 "[ . 1 . 2 ]" 1 1736 1 69 LEU H 1 69 LEU QB 2.800 . 3.800 2.410 2.258 2.548 . 0 0 "[ . 1 . 2 ]" 1 1737 1 69 LEU H 1 69 LEU QD 2.900 . 4.000 3.604 3.215 3.853 . 0 0 "[ . 1 . 2 ]" 1 1738 1 69 LEU HA 1 69 LEU QB 2.500 . 3.300 2.503 2.467 2.538 . 0 0 "[ . 1 . 2 ]" 1 1739 1 69 LEU HA 1 69 LEU QD 2.300 . 3.000 2.095 1.868 2.185 . 0 0 "[ . 1 . 2 ]" 1 1740 1 69 LEU HA 1 69 LEU HG 2.600 . 3.400 2.761 2.563 3.517 0.117 13 0 "[ . 1 . 2 ]" 1 1741 1 69 LEU HA 1 70 PRO QD 2.200 . 2.800 1.945 1.866 2.077 . 0 0 "[ . 1 . 2 ]" 1 1742 1 69 LEU QB 1 69 LEU MD2 2.000 . 2.500 2.058 2.000 2.125 . 0 0 "[ . 1 . 2 ]" 1 1743 1 69 LEU QB 1 70 PRO QD 3.400 . 4.800 3.316 2.006 3.631 . 0 0 "[ . 1 . 2 ]" 1 1744 1 69 LEU HB3 1 71 ALA H 4.300 . 6.600 4.616 3.819 5.552 . 0 0 "[ . 1 . 2 ]" 1 1745 1 69 LEU QD 1 70 PRO QD 2.500 . 3.300 2.329 1.602 2.729 0.198 13 0 "[ . 1 . 2 ]" 1 1746 1 69 LEU QD 1 72 GLU H 5.300 . 7.000 3.462 1.758 4.477 0.042 23 0 "[ . 1 . 2 ]" 1 1747 1 69 LEU QD 1 73 LEU H 4.000 . 6.000 3.472 2.163 4.107 . 0 0 "[ . 1 . 2 ]" 1 1748 1 69 LEU HG 1 70 PRO QD 2.500 . 3.300 2.318 1.952 3.593 0.293 13 0 "[ . 1 . 2 ]" 1 1749 1 70 PRO HA 1 70 PRO HB3 2.500 . 3.300 2.287 2.254 2.352 . 0 0 "[ . 1 . 2 ]" 1 1750 1 70 PRO HA 1 70 PRO QD 3.300 . 4.700 3.464 3.378 3.550 . 0 0 "[ . 1 . 2 ]" 1 1751 1 70 PRO HA 1 70 PRO HG2 3.200 . 4.500 3.964 3.837 4.073 . 0 0 "[ . 1 . 2 ]" 1 1752 1 70 PRO HA 1 71 ALA H 2.100 . 2.700 2.784 2.171 3.317 0.617 23 1 "[ . 1 . 2 +]" 1 1753 1 70 PRO HA 1 71 ALA MB 3.900 . 5.800 4.392 4.011 4.751 . 0 0 "[ . 1 . 2 ]" 1 1754 1 70 PRO HB2 1 70 PRO QD 3.400 . 4.800 3.106 2.733 3.560 . 0 0 "[ . 1 . 2 ]" 1 1755 1 70 PRO HB2 1 71 ALA H 3.200 . 4.500 2.131 1.788 3.203 0.112 2 0 "[ . 1 . 2 ]" 1 1756 1 70 PRO HB2 1 71 ALA MB 3.000 . 4.100 3.662 2.999 4.255 0.155 9 0 "[ . 1 . 2 ]" 1 1757 1 70 PRO HB3 1 70 PRO QD 2.800 . 3.800 3.350 2.860 3.538 . 0 0 "[ . 1 . 2 ]" 1 1758 1 70 PRO HB3 1 71 ALA H 2.800 . 3.800 2.818 2.351 3.782 . 0 0 "[ . 1 . 2 ]" 1 1759 1 70 PRO QD 1 70 PRO HG2 2.500 . 3.300 2.193 2.171 2.231 . 0 0 "[ . 1 . 2 ]" 1 1760 1 70 PRO QD 1 71 ALA H 4.500 . 7.000 4.370 2.300 4.977 . 0 0 "[ . 1 . 2 ]" 1 1761 1 70 PRO QD 1 73 LEU QB 3.300 . 4.700 3.942 2.718 4.547 . 0 0 "[ . 1 . 2 ]" 1 1762 1 70 PRO HG3 1 71 ALA H 4.300 . 6.600 4.531 3.417 5.468 . 0 0 "[ . 1 . 2 ]" 1 1763 1 71 ALA H 1 71 ALA HA 2.500 . 3.300 2.839 2.709 2.892 . 0 0 "[ . 1 . 2 ]" 1 1764 1 71 ALA H 1 71 ALA MB 2.200 . 2.800 2.222 2.101 2.277 . 0 0 "[ . 1 . 2 ]" 1 1765 1 71 ALA HA 1 72 GLU H 2.200 . 2.800 2.444 2.143 3.024 0.224 13 0 "[ . 1 . 2 ]" 1 1766 1 71 ALA MB 1 72 GLU H 2.600 . 3.400 2.838 1.793 3.685 0.285 12 0 "[ . 1 . 2 ]" 1 1767 1 72 GLU H 1 72 GLU HA 2.700 . 3.600 2.583 2.245 2.868 . 0 0 "[ . 1 . 2 ]" 1 1768 1 72 GLU H 1 72 GLU HB2 2.600 . 3.400 2.915 2.236 4.018 0.618 23 1 "[ . 1 . 2 +]" 1 1769 1 72 GLU H 1 72 GLU HB3 2.900 . 4.000 3.583 2.733 4.053 0.053 6 0 "[ . 1 . 2 ]" 1 1770 1 72 GLU H 1 72 GLU QG 3.000 . 4.100 2.798 1.839 4.104 0.061 13 0 "[ . 1 . 2 ]" 1 1771 1 72 GLU H 1 73 LEU H 2.900 . 4.000 3.366 2.629 3.749 . 0 0 "[ . 1 . 2 ]" 1 1772 1 72 GLU H 1 73 LEU QB 3.700 . 5.400 3.707 1.917 3.903 0.083 23 0 "[ . 1 . 2 ]" 1 1773 1 72 GLU HA 1 73 LEU H 2.200 . 2.800 2.290 2.115 2.897 0.097 23 0 "[ . 1 . 2 ]" 1 1774 1 72 GLU HB2 1 73 LEU H 4.000 . 6.000 4.433 3.880 4.599 . 0 0 "[ . 1 . 2 ]" 1 1775 1 72 GLU HB3 1 73 LEU H 3.300 . 4.700 4.074 3.662 4.574 . 0 0 "[ . 1 . 2 ]" 1 1776 1 73 LEU H 1 73 LEU HA 2.600 . 3.400 2.888 2.252 2.959 . 0 0 "[ . 1 . 2 ]" 1 1777 1 73 LEU H 1 73 LEU MD2 4.100 . 6.200 4.335 3.669 4.870 . 0 0 "[ . 1 . 2 ]" 1 1778 1 73 LEU H 1 74 GLY H 2.900 . 4.000 3.851 2.748 4.116 0.116 13 0 "[ . 1 . 2 ]" 1 1779 1 73 LEU HA 1 73 LEU MD1 3.600 . 5.200 2.888 1.976 3.890 0.024 4 0 "[ . 1 . 2 ]" 1 1780 1 73 LEU HA 1 73 LEU MD2 2.700 . 3.600 3.284 1.954 3.923 0.323 10 0 "[ . 1 . 2 ]" 1 1781 1 73 LEU HA 1 74 GLY H 2.500 . 3.300 2.366 2.125 3.375 0.075 3 0 "[ . 1 . 2 ]" 1 1782 1 73 LEU QB 1 73 LEU MD2 2.800 . 3.800 2.140 1.960 2.655 . 0 0 "[ . 1 . 2 ]" 1 1783 1 73 LEU QB 1 74 GLY H 4.000 . 4.800 3.456 1.910 3.815 0.090 23 0 "[ . 1 . 2 ]" 1 1784 1 74 GLY H 1 74 GLY HA2 2.600 . 3.400 2.752 2.325 2.968 . 0 0 "[ . 1 . 2 ]" 1 1785 1 74 GLY H 1 74 GLY HA3 2.900 . 4.000 2.721 2.328 2.965 . 0 0 "[ . 1 . 2 ]" 1 1786 1 74 GLY H 1 75 VAL H 2.900 . 4.000 3.062 1.889 4.098 0.098 20 0 "[ . 1 . 2 ]" 1 1787 1 74 GLY HA2 1 75 VAL H 2.900 . 4.000 2.717 2.130 3.572 . 0 0 "[ . 1 . 2 ]" 1 1788 1 74 GLY HA3 1 75 VAL H 3.000 . 4.100 3.158 2.149 3.561 . 0 0 "[ . 1 . 2 ]" 1 1789 1 75 VAL H 1 75 VAL HB 3.100 . 4.300 3.525 2.612 3.850 . 0 0 "[ . 1 . 2 ]" 1 1790 1 75 VAL H 1 75 VAL MG1 3.700 . 5.400 2.947 1.958 4.016 0.042 21 0 "[ . 1 . 2 ]" 1 1791 1 75 VAL HA 1 75 VAL MG1 3.100 . 4.300 2.531 2.168 3.229 . 0 0 "[ . 1 . 2 ]" 1 1792 1 75 VAL HA 1 75 VAL MG2 3.200 . 4.500 2.811 2.298 3.228 . 0 0 "[ . 1 . 2 ]" 1 1793 1 75 VAL HA 1 76 PRO HD3 2.800 . 3.800 2.309 1.955 4.413 0.613 21 1 "[ . 1 . 2+ ]" 1 1794 1 75 VAL HB 1 76 PRO HD3 3.200 . 4.500 4.017 2.488 5.072 0.572 19 2 "[ . 1 . - +2 ]" 1 1795 1 75 VAL MG1 1 76 PRO HD3 3.200 . 4.500 3.683 1.996 4.833 0.333 1 0 "[ . 1 . 2 ]" 1 1796 1 76 PRO HA 1 77 THR H 2.600 . 3.400 2.474 2.124 3.480 0.080 21 0 "[ . 1 . 2 ]" 1 1797 1 76 PRO HB2 1 76 PRO HD2 4.200 . 6.400 3.543 2.909 4.112 . 0 0 "[ . 1 . 2 ]" 1 1798 1 76 PRO HB2 1 77 THR H 4.000 . 6.000 3.941 3.166 4.410 . 0 0 "[ . 1 . 2 ]" 1 1799 1 76 PRO HB3 1 77 THR H 4.400 . 6.800 4.144 3.272 4.684 . 0 0 "[ . 1 . 2 ]" 1 1800 1 76 PRO HD3 1 76 PRO QG 3.000 . 4.100 2.206 2.166 2.264 . 0 0 "[ . 1 . 2 ]" 1 1801 1 77 THR H 1 77 THR HB 3.600 . 5.200 3.165 2.341 3.667 . 0 0 "[ . 1 . 2 ]" 1 1802 1 77 THR H 1 77 THR MG 3.700 . 5.400 2.494 2.027 2.837 . 0 0 "[ . 1 . 2 ]" 1 1803 1 77 THR H 1 78 THR H 3.500 . 5.000 3.765 1.924 4.598 0.076 1 0 "[ . 1 . 2 ]" 1 1804 1 77 THR HA 1 78 THR H 3.000 . 4.100 2.603 2.122 3.561 . 0 0 "[ . 1 . 2 ]" 1 1805 1 77 THR HB 1 78 THR H 4.500 . 7.000 4.088 3.399 4.682 . 0 0 "[ . 1 . 2 ]" 1 stop_ save_
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