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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
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404063 |
1wwu ![]() ![]() |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wwu 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 1900 _Distance_constraint_stats_list.Viol_count 467 _Distance_constraint_stats_list.Viol_total 87.934 _Distance_constraint_stats_list.Viol_max 0.159 _Distance_constraint_stats_list.Viol_rms 0.0025 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0001 _Distance_constraint_stats_list.Viol_average_violations_only 0.0094 _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 9 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 10 VAL 0.004 0.004 8 0 "[ . 1 . 2]" 1 11 GLU 0.004 0.004 8 0 "[ . 1 . 2]" 1 12 ARG 0.027 0.025 14 0 "[ . 1 . 2]" 1 18 GLN 0.023 0.005 8 0 "[ . 1 . 2]" 1 19 PRO 0.034 0.011 8 0 "[ . 1 . 2]" 1 20 LEU 0.078 0.018 8 0 "[ . 1 . 2]" 1 21 THR 0.026 0.007 20 0 "[ . 1 . 2]" 1 22 TYR 0.002 0.001 8 0 "[ . 1 . 2]" 1 23 GLU 0.001 0.000 4 0 "[ . 1 . 2]" 1 24 SER 0.011 0.003 8 0 "[ . 1 . 2]" 1 25 GLY 0.001 0.001 12 0 "[ . 1 . 2]" 1 26 PRO 0.028 0.018 6 0 "[ . 1 . 2]" 1 27 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 28 GLU 0.016 0.003 8 0 "[ . 1 . 2]" 1 29 VAL 0.028 0.008 6 0 "[ . 1 . 2]" 1 30 ARG 0.016 0.003 8 0 "[ . 1 . 2]" 1 31 ALA 0.018 0.005 8 0 "[ . 1 . 2]" 1 32 TRP 0.053 0.011 8 0 "[ . 1 . 2]" 1 33 LEU 0.026 0.004 8 0 "[ . 1 . 2]" 1 34 GLU 0.043 0.010 20 0 "[ . 1 . 2]" 1 35 ALA 0.061 0.009 20 0 "[ . 1 . 2]" 1 36 LYS 0.026 0.010 20 0 "[ . 1 . 2]" 1 37 ALA 0.030 0.009 20 0 "[ . 1 . 2]" 1 38 PHE 0.287 0.052 16 0 "[ . 1 . 2]" 1 39 SER 0.475 0.133 13 0 "[ . 1 . 2]" 1 40 PRO 0.368 0.133 13 0 "[ . 1 . 2]" 1 41 ARG 0.079 0.054 20 0 "[ . 1 . 2]" 1 42 ILE 0.486 0.054 20 0 "[ . 1 . 2]" 1 43 VAL 0.148 0.035 16 0 "[ . 1 . 2]" 1 44 GLU 0.180 0.159 14 0 "[ . 1 . 2]" 1 45 ASN 0.020 0.016 20 0 "[ . 1 . 2]" 1 46 LEU 0.023 0.004 8 0 "[ . 1 . 2]" 1 47 GLY 0.082 0.021 15 0 "[ . 1 . 2]" 1 48 ILE 0.007 0.004 6 0 "[ . 1 . 2]" 1 49 LEU 0.016 0.005 15 0 "[ . 1 . 2]" 1 50 THR 0.031 0.018 6 0 "[ . 1 . 2]" 1 51 GLY 0.064 0.012 2 0 "[ . 1 . 2]" 1 52 PRO 0.000 0.000 17 0 "[ . 1 . 2]" 1 53 GLN 0.056 0.007 15 0 "[ . 1 . 2]" 1 54 LEU 0.123 0.012 2 0 "[ . 1 . 2]" 1 55 PHE 0.026 0.004 6 0 "[ . 1 . 2]" 1 56 SER 0.007 0.003 15 0 "[ . 1 . 2]" 1 57 LEU 0.043 0.008 12 0 "[ . 1 . 2]" 1 58 ASN 0.078 0.059 11 0 "[ . 1 . 2]" 1 59 LYS 0.037 0.004 17 0 "[ . 1 . 2]" 1 60 GLU 0.044 0.014 19 0 "[ . 1 . 2]" 1 61 GLU 0.104 0.059 11 0 "[ . 1 . 2]" 1 62 LEU 0.086 0.016 11 0 "[ . 1 . 2]" 1 63 LYS 0.066 0.008 10 0 "[ . 1 . 2]" 1 64 LYS 0.128 0.048 11 0 "[ . 1 . 2]" 1 65 VAL 1.218 0.117 11 0 "[ . 1 . 2]" 1 66 CYS 1.281 0.117 11 0 "[ . 1 . 2]" 1 67 GLY 0.013 0.006 11 0 "[ . 1 . 2]" 1 68 GLU 0.002 0.001 16 0 "[ . 1 . 2]" 1 69 GLU 0.024 0.008 11 0 "[ . 1 . 2]" 1 70 GLY 0.090 0.012 11 0 "[ . 1 . 2]" 1 71 VAL 0.024 0.005 16 0 "[ . 1 . 2]" 1 72 ARG 0.401 0.086 16 0 "[ . 1 . 2]" 1 73 VAL 0.037 0.009 16 0 "[ . 1 . 2]" 1 74 TYR 0.057 0.009 11 0 "[ . 1 . 2]" 1 75 SER 0.299 0.063 16 0 "[ . 1 . 2]" 1 76 GLN 0.035 0.015 16 0 "[ . 1 . 2]" 1 77 LEU 0.014 0.007 16 0 "[ . 1 . 2]" 1 78 THR 0.033 0.008 16 0 "[ . 1 . 2]" 1 79 MET 0.012 0.007 16 0 "[ . 1 . 2]" 1 80 GLN 0.007 0.004 15 0 "[ . 1 . 2]" 1 81 LYS 0.009 0.008 16 0 "[ . 1 . 2]" 1 82 ALA 0.012 0.006 16 0 "[ . 1 . 2]" 1 83 PHE 0.011 0.009 17 0 "[ . 1 . 2]" 1 84 LEU 0.083 0.043 5 0 "[ . 1 . 2]" 1 85 GLU 0.154 0.106 17 0 "[ . 1 . 2]" 1 86 LYS 0.154 0.106 17 0 "[ . 1 . 2]" 1 87 GLN 0.084 0.043 5 0 "[ . 1 . 2]" 1 88 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 92 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 93 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 95 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 96 PRO 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 9 ARG HA 1 9 ARG HD2 . . 5.500 3.746 2.170 5.247 . 0 0 "[ . 1 . 2]" 1 2 1 9 ARG HA 1 9 ARG QD . . 4.680 3.273 2.067 4.251 . 0 0 "[ . 1 . 2]" 1 3 1 9 ARG HA 1 9 ARG HD3 . . 5.500 3.928 2.377 5.158 . 0 0 "[ . 1 . 2]" 1 4 1 9 ARG HA 1 10 VAL H . . 3.280 2.360 2.141 2.795 . 0 0 "[ . 1 . 2]" 1 5 1 9 ARG QB 1 9 ARG QD . . 3.190 2.273 2.050 2.627 . 0 0 "[ . 1 . 2]" 1 6 1 10 VAL H 1 10 VAL HB . . 3.970 3.176 2.509 3.912 . 0 0 "[ . 1 . 2]" 1 7 1 10 VAL H 1 10 VAL MG1 . . 4.750 3.047 2.102 3.884 . 0 0 "[ . 1 . 2]" 1 8 1 10 VAL H 1 10 VAL QG . . 3.940 2.232 1.846 2.933 . 0 0 "[ . 1 . 2]" 1 9 1 10 VAL H 1 10 VAL MG2 . . 4.750 2.596 1.961 4.026 . 0 0 "[ . 1 . 2]" 1 10 1 10 VAL HA 1 11 GLU H . . 3.470 2.459 2.141 3.474 0.004 8 0 "[ . 1 . 2]" 1 11 1 10 VAL HB 1 11 GLU H . . 4.660 3.817 2.467 4.618 . 0 0 "[ . 1 . 2]" 1 12 1 10 VAL QG 1 11 GLU H . . 4.780 2.925 1.890 3.542 . 0 0 "[ . 1 . 2]" 1 13 1 11 GLU H 1 11 GLU HG2 . . 5.500 4.102 2.064 5.256 . 0 0 "[ . 1 . 2]" 1 14 1 11 GLU H 1 11 GLU QG . . 4.820 3.540 2.036 4.476 . 0 0 "[ . 1 . 2]" 1 15 1 11 GLU H 1 11 GLU HG3 . . 5.500 4.058 2.792 5.003 . 0 0 "[ . 1 . 2]" 1 16 1 11 GLU QG 1 12 ARG H . . 5.340 3.522 2.259 4.301 . 0 0 "[ . 1 . 2]" 1 17 1 12 ARG HA 1 12 ARG HD2 . . 5.430 4.226 2.387 5.346 . 0 0 "[ . 1 . 2]" 1 18 1 12 ARG HA 1 12 ARG QD . . 4.650 3.779 2.313 4.566 . 0 0 "[ . 1 . 2]" 1 19 1 12 ARG HA 1 12 ARG HD3 . . 5.430 4.413 2.497 5.455 0.025 14 0 "[ . 1 . 2]" 1 20 1 12 ARG QB 1 12 ARG QD . . 3.280 2.194 2.032 2.544 . 0 0 "[ . 1 . 2]" 1 21 1 18 GLN HA 1 18 GLN QG . . 3.680 2.707 2.197 3.095 . 0 0 "[ . 1 . 2]" 1 22 1 18 GLN HA 1 19 PRO HD2 . . 2.980 2.156 1.994 2.273 . 0 0 "[ . 1 . 2]" 1 23 1 18 GLN HA 1 19 PRO HD3 . . 3.190 2.261 2.251 2.309 . 0 0 "[ . 1 . 2]" 1 24 1 18 GLN HA 1 19 PRO HG2 . . 4.840 4.317 4.188 4.409 . 0 0 "[ . 1 . 2]" 1 25 1 18 GLN HA 1 19 PRO HG3 . . 5.250 4.355 4.315 4.401 . 0 0 "[ . 1 . 2]" 1 26 1 18 GLN QB 1 19 PRO HD2 . . 3.750 2.942 2.273 3.581 . 0 0 "[ . 1 . 2]" 1 27 1 18 GLN QB 1 31 ALA MB . . 4.290 3.933 3.334 4.284 . 0 0 "[ . 1 . 2]" 1 28 1 18 GLN QB 1 32 TRP HA . . 3.920 2.267 1.992 2.516 . 0 0 "[ . 1 . 2]" 1 29 1 18 GLN QB 1 32 TRP HD1 . . 3.980 2.660 2.027 3.114 . 0 0 "[ . 1 . 2]" 1 30 1 18 GLN QB 1 32 TRP HE1 . . 5.200 4.627 4.054 5.190 . 0 0 "[ . 1 . 2]" 1 31 1 18 GLN QB 1 35 ALA MB . . 3.770 2.607 1.899 3.183 . 0 0 "[ . 1 . 2]" 1 32 1 18 GLN HB2 1 19 PRO HD2 . . 4.440 3.950 3.754 4.156 . 0 0 "[ . 1 . 2]" 1 33 1 18 GLN HB2 1 31 ALA MB . . 5.120 4.550 4.007 4.966 . 0 0 "[ . 1 . 2]" 1 34 1 18 GLN HB2 1 32 TRP HA . . 4.470 2.773 2.229 3.505 . 0 0 "[ . 1 . 2]" 1 35 1 18 GLN HB2 1 32 TRP HD1 . . 4.590 3.480 2.427 4.588 . 0 0 "[ . 1 . 2]" 1 36 1 18 GLN HB2 1 35 ALA MB . . 4.440 2.694 1.945 3.276 . 0 0 "[ . 1 . 2]" 1 37 1 18 GLN HB3 1 19 PRO HD2 . . 4.440 3.152 2.292 4.381 . 0 0 "[ . 1 . 2]" 1 38 1 18 GLN HB3 1 31 ALA MB . . 5.120 4.325 3.565 4.829 . 0 0 "[ . 1 . 2]" 1 39 1 18 GLN HB3 1 32 TRP HA . . 4.470 2.898 2.011 3.714 . 0 0 "[ . 1 . 2]" 1 40 1 18 GLN HB3 1 32 TRP HD1 . . 4.590 3.223 2.035 4.290 . 0 0 "[ . 1 . 2]" 1 41 1 18 GLN HB3 1 35 ALA MB . . 4.440 3.561 2.437 4.387 . 0 0 "[ . 1 . 2]" 1 42 1 18 GLN HE21 1 19 PRO HD2 . . 4.730 3.550 2.416 4.516 . 0 0 "[ . 1 . 2]" 1 43 1 18 GLN HE21 1 31 ALA MB . . 4.460 3.324 2.494 4.460 . 0 0 "[ . 1 . 2]" 1 44 1 18 GLN HE21 1 35 ALA MB . . 5.420 4.424 2.626 5.226 . 0 0 "[ . 1 . 2]" 1 45 1 18 GLN HE22 1 19 PRO HD2 . . 4.730 3.606 2.846 4.231 . 0 0 "[ . 1 . 2]" 1 46 1 18 GLN HE22 1 31 ALA MB . . 4.460 4.152 3.526 4.465 0.005 8 0 "[ . 1 . 2]" 1 47 1 18 GLN HE22 1 35 ALA MB . . 5.420 5.273 3.996 5.421 0.001 3 0 "[ . 1 . 2]" 1 48 1 18 GLN QG 1 19 PRO HD2 . . 4.780 3.178 1.979 4.318 . 0 0 "[ . 1 . 2]" 1 49 1 18 GLN QG 1 31 ALA MB . . 3.830 3.064 2.431 3.720 . 0 0 "[ . 1 . 2]" 1 50 1 18 GLN QG 1 32 TRP H . . 4.990 4.260 2.995 4.991 0.001 11 0 "[ . 1 . 2]" 1 51 1 18 GLN QG 1 32 TRP HA . . 4.000 2.863 1.939 3.303 . 0 0 "[ . 1 . 2]" 1 52 1 18 GLN QG 1 35 ALA H . . 5.340 4.375 3.969 4.922 . 0 0 "[ . 1 . 2]" 1 53 1 18 GLN QG 1 35 ALA MB . . 3.560 2.580 2.081 3.181 . 0 0 "[ . 1 . 2]" 1 54 1 18 GLN HG2 1 19 PRO HD2 . . 5.500 3.889 1.989 4.752 . 0 0 "[ . 1 . 2]" 1 55 1 18 GLN HG2 1 32 TRP HA . . 4.610 3.630 1.998 4.614 0.004 5 0 "[ . 1 . 2]" 1 56 1 18 GLN HG2 1 32 TRP HD1 . . 5.500 4.868 3.802 5.435 . 0 0 "[ . 1 . 2]" 1 57 1 18 GLN HG2 1 35 ALA MB . . 4.150 2.951 2.250 4.147 . 0 0 "[ . 1 . 2]" 1 58 1 18 GLN HG3 1 19 PRO HD2 . . 5.500 3.677 1.994 4.957 . 0 0 "[ . 1 . 2]" 1 59 1 18 GLN HG3 1 32 TRP HA . . 4.610 3.228 2.615 3.492 . 0 0 "[ . 1 . 2]" 1 60 1 18 GLN HG3 1 32 TRP HD1 . . 5.500 4.542 2.704 5.493 . 0 0 "[ . 1 . 2]" 1 61 1 18 GLN HG3 1 35 ALA MB . . 4.150 3.120 2.375 4.154 0.004 8 0 "[ . 1 . 2]" 1 62 1 19 PRO HA 1 20 LEU H . . 2.660 2.171 2.151 2.226 . 0 0 "[ . 1 . 2]" 1 63 1 19 PRO HA 1 21 THR MG . . 4.870 4.455 4.248 4.669 . 0 0 "[ . 1 . 2]" 1 64 1 19 PRO HA 1 32 TRP HE1 . . 5.500 5.449 5.254 5.511 0.011 8 0 "[ . 1 . 2]" 1 65 1 19 PRO HA 1 80 GLN HE21 . . 4.830 3.669 2.947 4.244 . 0 0 "[ . 1 . 2]" 1 66 1 19 PRO HA 1 80 GLN HE22 . . 4.830 3.194 2.672 3.807 . 0 0 "[ . 1 . 2]" 1 67 1 19 PRO HB2 1 20 LEU H . . 3.850 3.506 3.134 3.760 . 0 0 "[ . 1 . 2]" 1 68 1 19 PRO HB2 1 21 THR MG . . 3.970 3.642 3.424 3.725 . 0 0 "[ . 1 . 2]" 1 69 1 19 PRO HB3 1 20 LEU H . . 4.170 3.987 3.746 4.158 . 0 0 "[ . 1 . 2]" 1 70 1 19 PRO HB3 1 21 THR MG . . 4.680 4.641 4.476 4.687 0.007 20 0 "[ . 1 . 2]" 1 71 1 19 PRO HG2 1 21 THR MG . . 5.500 5.367 5.068 5.499 . 0 0 "[ . 1 . 2]" 1 72 1 20 LEU H 1 20 LEU HB2 . . 3.540 2.896 2.622 3.052 . 0 0 "[ . 1 . 2]" 1 73 1 20 LEU H 1 20 LEU QB . . 3.070 2.605 2.429 2.753 . 0 0 "[ . 1 . 2]" 1 74 1 20 LEU H 1 20 LEU HB3 . . 3.540 2.965 2.721 3.137 . 0 0 "[ . 1 . 2]" 1 75 1 20 LEU H 1 20 LEU MD1 . . 4.730 4.500 4.043 4.734 0.004 4 0 "[ . 1 . 2]" 1 76 1 20 LEU H 1 20 LEU QD . . 4.050 3.834 3.672 3.915 . 0 0 "[ . 1 . 2]" 1 77 1 20 LEU H 1 20 LEU MD2 . . 4.730 4.169 4.123 4.213 . 0 0 "[ . 1 . 2]" 1 78 1 20 LEU H 1 20 LEU HG . . 4.940 4.774 4.553 4.958 0.018 8 0 "[ . 1 . 2]" 1 79 1 20 LEU H 1 21 THR H . . 4.430 4.190 3.986 4.392 . 0 0 "[ . 1 . 2]" 1 80 1 20 LEU H 1 21 THR MG . . 3.790 3.376 3.114 3.749 . 0 0 "[ . 1 . 2]" 1 81 1 20 LEU H 1 32 TRP HE1 . . 5.170 4.859 4.506 5.173 0.003 5 0 "[ . 1 . 2]" 1 82 1 20 LEU H 1 80 GLN HE21 . . 4.000 2.157 1.806 2.411 . 0 0 "[ . 1 . 2]" 1 83 1 20 LEU H 1 80 GLN QE . . 3.470 2.050 1.774 2.305 . 0 0 "[ . 1 . 2]" 1 84 1 20 LEU H 1 80 GLN HE22 . . 4.000 2.691 1.906 3.413 . 0 0 "[ . 1 . 2]" 1 85 1 20 LEU H 1 80 GLN HG2 . . 5.160 4.150 3.322 4.616 . 0 0 "[ . 1 . 2]" 1 86 1 20 LEU H 1 80 GLN QG . . 4.320 3.839 3.196 4.235 . 0 0 "[ . 1 . 2]" 1 87 1 20 LEU H 1 80 GLN HG3 . . 5.160 4.568 4.005 5.070 . 0 0 "[ . 1 . 2]" 1 88 1 20 LEU HA 1 20 LEU MD1 . . 4.470 3.633 2.975 3.831 . 0 0 "[ . 1 . 2]" 1 89 1 20 LEU HA 1 20 LEU QD . . 3.130 2.189 1.891 2.500 . 0 0 "[ . 1 . 2]" 1 90 1 20 LEU HA 1 20 LEU MD2 . . 4.470 2.209 1.907 2.535 . 0 0 "[ . 1 . 2]" 1 91 1 20 LEU HA 1 21 THR H . . 2.820 2.143 2.138 2.151 . 0 0 "[ . 1 . 2]" 1 92 1 20 LEU HA 1 21 THR MG . . 4.370 3.581 3.257 3.796 . 0 0 "[ . 1 . 2]" 1 93 1 20 LEU QB 1 20 LEU QD . . 2.770 1.949 1.914 2.035 . 0 0 "[ . 1 . 2]" 1 94 1 20 LEU QB 1 21 THR H . . 4.280 3.745 3.663 3.836 . 0 0 "[ . 1 . 2]" 1 95 1 20 LEU QB 1 32 TRP QB . . 4.690 2.926 2.566 3.279 . 0 0 "[ . 1 . 2]" 1 96 1 20 LEU QB 1 32 TRP HD1 . . 3.880 2.371 2.072 2.712 . 0 0 "[ . 1 . 2]" 1 97 1 20 LEU QB 1 32 TRP HE1 . . 3.850 3.242 3.037 3.381 . 0 0 "[ . 1 . 2]" 1 98 1 20 LEU QB 1 55 PHE QE . . 5.340 4.032 3.592 4.756 . 0 0 "[ . 1 . 2]" 1 99 1 20 LEU QB 1 55 PHE HZ . . 4.860 3.008 2.329 4.024 . 0 0 "[ . 1 . 2]" 1 100 1 20 LEU QB 1 80 GLN QE . . 3.390 2.513 1.867 3.222 . 0 0 "[ . 1 . 2]" 1 101 1 20 LEU QB 1 80 GLN QG . . 3.800 2.329 2.020 3.297 . 0 0 "[ . 1 . 2]" 1 102 1 20 LEU HB2 1 21 THR H . . 5.090 4.435 4.321 4.536 . 0 0 "[ . 1 . 2]" 1 103 1 20 LEU HB2 1 32 TRP HD1 . . 4.610 2.391 2.083 2.738 . 0 0 "[ . 1 . 2]" 1 104 1 20 LEU HB2 1 32 TRP HE1 . . 4.460 3.444 3.226 3.584 . 0 0 "[ . 1 . 2]" 1 105 1 20 LEU HB2 1 80 GLN HE21 . . 5.110 3.514 2.746 3.968 . 0 0 "[ . 1 . 2]" 1 106 1 20 LEU HB2 1 80 GLN HE22 . . 5.110 4.102 2.829 4.781 . 0 0 "[ . 1 . 2]" 1 107 1 20 LEU HB3 1 21 THR H . . 5.090 4.039 3.919 4.138 . 0 0 "[ . 1 . 2]" 1 108 1 20 LEU HB3 1 32 TRP HD1 . . 4.610 3.926 3.610 4.370 . 0 0 "[ . 1 . 2]" 1 109 1 20 LEU HB3 1 32 TRP HE1 . . 4.460 3.980 3.508 4.368 . 0 0 "[ . 1 . 2]" 1 110 1 20 LEU HB3 1 80 GLN HE21 . . 5.110 2.702 1.909 3.575 . 0 0 "[ . 1 . 2]" 1 111 1 20 LEU HB3 1 80 GLN HE22 . . 5.110 3.867 2.193 4.863 . 0 0 "[ . 1 . 2]" 1 112 1 20 LEU QD 1 21 THR H . . 3.450 2.203 1.913 2.565 . 0 0 "[ . 1 . 2]" 1 113 1 20 LEU QD 1 24 SER H . . 4.590 4.062 3.934 4.277 . 0 0 "[ . 1 . 2]" 1 114 1 20 LEU QD 1 24 SER QB . . 3.420 2.430 2.233 2.721 . 0 0 "[ . 1 . 2]" 1 115 1 20 LEU QD 1 24 SER HG . . 4.710 3.145 1.961 4.190 . 0 0 "[ . 1 . 2]" 1 116 1 20 LEU QD 1 28 GLU HB2 . . 4.070 3.906 3.487 4.071 0.001 18 0 "[ . 1 . 2]" 1 117 1 20 LEU QD 1 28 GLU HB3 . . 5.440 4.236 3.399 4.629 . 0 0 "[ . 1 . 2]" 1 118 1 20 LEU QD 1 29 VAL H . . 4.400 4.225 3.662 4.403 0.003 18 0 "[ . 1 . 2]" 1 119 1 20 LEU QD 1 29 VAL HA . . 3.230 2.760 2.053 3.106 . 0 0 "[ . 1 . 2]" 1 120 1 20 LEU QD 1 29 VAL MG1 . . 3.850 3.280 3.126 3.461 . 0 0 "[ . 1 . 2]" 1 121 1 20 LEU QD 1 29 VAL MG2 . . 3.050 2.544 2.360 2.696 . 0 0 "[ . 1 . 2]" 1 122 1 20 LEU QD 1 32 TRP H . . 5.060 4.284 3.737 4.815 . 0 0 "[ . 1 . 2]" 1 123 1 20 LEU QD 1 32 TRP HA . . 5.440 4.549 4.295 5.054 . 0 0 "[ . 1 . 2]" 1 124 1 20 LEU QD 1 32 TRP QB . . 3.560 2.424 2.133 2.985 . 0 0 "[ . 1 . 2]" 1 125 1 20 LEU QD 1 32 TRP HD1 . . 4.440 3.522 3.159 3.984 . 0 0 "[ . 1 . 2]" 1 126 1 20 LEU QD 1 32 TRP HE1 . . 4.490 3.743 3.280 4.490 . 13 0 "[ . 1 . 2]" 1 127 1 20 LEU QD 1 32 TRP HE3 . . 4.650 3.185 2.713 3.809 . 0 0 "[ . 1 . 2]" 1 128 1 20 LEU QD 1 32 TRP HZ2 . . 4.830 4.153 3.799 4.822 . 0 0 "[ . 1 . 2]" 1 129 1 20 LEU QD 1 32 TRP HZ3 . . 5.040 4.148 3.815 4.613 . 0 0 "[ . 1 . 2]" 1 130 1 20 LEU QD 1 51 GLY H . . 4.940 4.837 4.634 4.941 0.001 7 0 "[ . 1 . 2]" 1 131 1 20 LEU QD 1 51 GLY HA2 . . 4.440 2.926 2.668 3.217 . 0 0 "[ . 1 . 2]" 1 132 1 20 LEU QD 1 51 GLY HA3 . . 4.160 3.678 3.487 3.897 . 0 0 "[ . 1 . 2]" 1 133 1 20 LEU QD 1 54 LEU HB2 . . 5.230 4.779 4.394 5.152 . 0 0 "[ . 1 . 2]" 1 134 1 20 LEU QD 1 54 LEU HB3 . . 4.830 3.967 3.663 4.320 . 0 0 "[ . 1 . 2]" 1 135 1 20 LEU QD 1 54 LEU HG . . 5.030 4.158 3.792 4.620 . 0 0 "[ . 1 . 2]" 1 136 1 20 LEU QD 1 55 PHE QD . . 5.440 3.707 3.522 3.967 . 0 0 "[ . 1 . 2]" 1 137 1 20 LEU QD 1 55 PHE QE . . 4.120 2.319 2.107 2.710 . 0 0 "[ . 1 . 2]" 1 138 1 20 LEU QD 1 55 PHE HZ . . 4.020 2.112 1.853 2.373 . 0 0 "[ . 1 . 2]" 1 139 1 20 LEU QD 1 77 LEU HA . . 5.440 4.547 4.076 5.026 . 0 0 "[ . 1 . 2]" 1 140 1 20 LEU QD 1 77 LEU QD . . 3.210 2.832 2.333 3.090 . 0 0 "[ . 1 . 2]" 1 141 1 20 LEU QD 1 80 GLN HB3 . . 4.410 3.961 3.600 4.250 . 0 0 "[ . 1 . 2]" 1 142 1 20 LEU QD 1 80 GLN QE . . 4.800 3.689 3.204 4.306 . 0 0 "[ . 1 . 2]" 1 143 1 20 LEU QD 1 80 GLN QG . . 3.610 2.877 2.533 3.312 . 0 0 "[ . 1 . 2]" 1 144 1 20 LEU MD1 1 21 THR H . . 4.940 4.130 2.470 4.884 . 0 0 "[ . 1 . 2]" 1 145 1 20 LEU MD1 1 29 VAL HA . . 4.400 3.525 2.875 4.400 . 0 0 "[ . 1 . 2]" 1 146 1 20 LEU MD1 1 29 VAL MG1 . . 4.810 3.692 3.252 4.515 . 0 0 "[ . 1 . 2]" 1 147 1 20 LEU MD1 1 29 VAL MG2 . . 4.200 3.422 3.161 3.592 . 0 0 "[ . 1 . 2]" 1 148 1 20 LEU MD1 1 32 TRP HB2 . . 4.750 3.484 2.766 4.662 . 0 0 "[ . 1 . 2]" 1 149 1 20 LEU MD1 1 32 TRP HB3 . . 4.750 3.177 2.304 4.689 . 0 0 "[ . 1 . 2]" 1 150 1 20 LEU MD1 1 32 TRP HD1 . . 5.160 3.892 3.195 5.130 . 0 0 "[ . 1 . 2]" 1 151 1 20 LEU MD1 1 32 TRP HE3 . . 5.500 3.410 2.723 4.603 . 0 0 "[ . 1 . 2]" 1 152 1 20 LEU MD1 1 54 LEU MD2 . . 3.610 2.562 2.049 3.331 . 0 0 "[ . 1 . 2]" 1 153 1 20 LEU MD1 1 55 PHE QE . . 5.040 2.864 2.156 3.296 . 0 0 "[ . 1 . 2]" 1 154 1 20 LEU MD2 1 21 THR H . . 4.940 2.250 1.915 2.608 . 0 0 "[ . 1 . 2]" 1 155 1 20 LEU MD2 1 29 VAL HA . . 4.400 3.134 2.057 3.691 . 0 0 "[ . 1 . 2]" 1 156 1 20 LEU MD2 1 29 VAL MG1 . . 4.810 3.889 3.323 4.233 . 0 0 "[ . 1 . 2]" 1 157 1 20 LEU MD2 1 29 VAL MG2 . . 4.200 2.630 2.409 2.875 . 0 0 "[ . 1 . 2]" 1 158 1 20 LEU MD2 1 32 TRP HB2 . . 4.750 3.718 2.202 4.454 . 0 0 "[ . 1 . 2]" 1 159 1 20 LEU MD2 1 32 TRP HB3 . . 4.750 4.037 2.702 4.645 . 0 0 "[ . 1 . 2]" 1 160 1 20 LEU MD2 1 32 TRP HD1 . . 5.160 4.707 3.748 5.162 0.002 6 0 "[ . 1 . 2]" 1 161 1 20 LEU MD2 1 32 TRP HE3 . . 5.500 5.012 3.677 5.499 . 0 0 "[ . 1 . 2]" 1 162 1 20 LEU MD2 1 54 LEU MD2 . . 3.610 3.284 2.947 3.596 . 0 0 "[ . 1 . 2]" 1 163 1 20 LEU MD2 1 55 PHE QE . . 5.040 2.877 2.191 4.653 . 0 0 "[ . 1 . 2]" 1 164 1 20 LEU HG 1 21 THR H . . 4.640 4.215 3.793 4.643 0.003 7 0 "[ . 1 . 2]" 1 165 1 20 LEU HG 1 32 TRP H . . 5.500 4.737 4.199 5.506 0.006 8 0 "[ . 1 . 2]" 1 166 1 20 LEU HG 1 32 TRP QB . . 5.000 2.580 2.218 2.994 . 0 0 "[ . 1 . 2]" 1 167 1 20 LEU HG 1 32 TRP HD1 . . 5.320 3.938 3.659 4.168 . 0 0 "[ . 1 . 2]" 1 168 1 20 LEU HG 1 55 PHE QE . . 5.120 4.912 4.575 5.124 0.004 6 0 "[ . 1 . 2]" 1 169 1 20 LEU HG 1 55 PHE HZ . . 4.820 4.514 4.205 4.801 . 0 0 "[ . 1 . 2]" 1 170 1 20 LEU HG 1 80 GLN QG . . 5.340 4.782 4.019 5.322 . 0 0 "[ . 1 . 2]" 1 171 1 21 THR H 1 21 THR MG . . 3.500 2.816 2.609 3.098 . 0 0 "[ . 1 . 2]" 1 172 1 21 THR H 1 22 TYR H . . 4.980 4.400 4.366 4.440 . 0 0 "[ . 1 . 2]" 1 173 1 21 THR H 1 23 GLU H . . 4.820 4.663 4.323 4.820 0.000 4 0 "[ . 1 . 2]" 1 174 1 21 THR H 1 24 SER H . . 3.760 3.632 3.504 3.762 0.002 16 0 "[ . 1 . 2]" 1 175 1 21 THR H 1 24 SER HB2 . . 4.050 2.781 2.220 3.778 . 0 0 "[ . 1 . 2]" 1 176 1 21 THR H 1 24 SER QB . . 3.500 2.338 2.200 2.570 . 0 0 "[ . 1 . 2]" 1 177 1 21 THR H 1 24 SER HB3 . . 4.050 3.306 2.255 3.883 . 0 0 "[ . 1 . 2]" 1 178 1 21 THR H 1 24 SER HG . . 4.000 3.248 2.658 3.796 . 0 0 "[ . 1 . 2]" 1 179 1 21 THR H 1 28 GLU HB2 . . 5.280 5.231 5.086 5.282 0.002 7 0 "[ . 1 . 2]" 1 180 1 21 THR HA 1 21 THR MG . . 3.350 2.457 2.306 2.638 . 0 0 "[ . 1 . 2]" 1 181 1 21 THR HA 1 22 TYR H . . 3.200 2.594 2.533 2.642 . 0 0 "[ . 1 . 2]" 1 182 1 21 THR HA 1 23 GLU H . . 4.490 4.335 4.119 4.472 . 0 0 "[ . 1 . 2]" 1 183 1 21 THR HA 1 55 PHE QE . . 4.940 3.295 2.870 3.639 . 0 0 "[ . 1 . 2]" 1 184 1 21 THR HA 1 84 LEU MD1 . . 3.620 2.251 1.966 2.799 . 0 0 "[ . 1 . 2]" 1 185 1 21 THR HA 1 84 LEU MD2 . . 3.660 2.346 1.956 3.045 . 0 0 "[ . 1 . 2]" 1 186 1 21 THR MG 1 22 TYR H . . 3.800 3.662 3.571 3.794 . 0 0 "[ . 1 . 2]" 1 187 1 21 THR MG 1 23 GLU H . . 4.380 4.187 4.042 4.277 . 0 0 "[ . 1 . 2]" 1 188 1 21 THR MG 1 24 SER H . . 4.830 4.733 4.541 4.830 0.000 17 0 "[ . 1 . 2]" 1 189 1 21 THR MG 1 84 LEU MD1 . . 4.250 3.343 2.506 3.761 . 0 0 "[ . 1 . 2]" 1 190 1 21 THR MG 1 84 LEU HG . . 4.250 4.177 3.642 4.250 0.000 6 0 "[ . 1 . 2]" 1 191 1 22 TYR H 1 22 TYR HB2 . . 3.190 2.403 2.322 2.528 . 0 0 "[ . 1 . 2]" 1 192 1 22 TYR H 1 22 TYR HB3 . . 3.780 3.587 3.568 3.607 . 0 0 "[ . 1 . 2]" 1 193 1 22 TYR H 1 22 TYR QD . . 3.750 2.184 1.908 2.931 . 0 0 "[ . 1 . 2]" 1 194 1 22 TYR H 1 22 TYR QE . . 4.690 4.284 4.038 4.558 . 0 0 "[ . 1 . 2]" 1 195 1 22 TYR H 1 23 GLU H . . 3.370 2.482 2.434 2.527 . 0 0 "[ . 1 . 2]" 1 196 1 22 TYR H 1 23 GLU HB2 . . 4.490 4.465 4.393 4.490 0.000 10 0 "[ . 1 . 2]" 1 197 1 22 TYR H 1 23 GLU HB3 . . 5.500 5.150 5.111 5.206 . 0 0 "[ . 1 . 2]" 1 198 1 22 TYR H 1 24 SER H . . 4.200 3.980 3.918 4.090 . 0 0 "[ . 1 . 2]" 1 199 1 22 TYR H 1 24 SER QB . . 5.340 4.935 4.837 5.198 . 0 0 "[ . 1 . 2]" 1 200 1 22 TYR H 1 84 LEU MD1 . . 4.050 3.387 2.879 3.918 . 0 0 "[ . 1 . 2]" 1 201 1 22 TYR H 1 84 LEU MD2 . . 4.410 3.506 2.872 3.991 . 0 0 "[ . 1 . 2]" 1 202 1 22 TYR HA 1 22 TYR QD . . 4.050 3.001 2.408 3.143 . 0 0 "[ . 1 . 2]" 1 203 1 22 TYR HA 1 24 SER H . . 4.000 3.545 3.421 3.676 . 0 0 "[ . 1 . 2]" 1 204 1 22 TYR HA 1 52 PRO HD3 . . 4.040 2.875 2.620 3.013 . 0 0 "[ . 1 . 2]" 1 205 1 22 TYR HA 1 52 PRO HG3 . . 4.920 4.778 4.540 4.920 . 0 0 "[ . 1 . 2]" 1 206 1 22 TYR HA 1 55 PHE QD . . 4.510 3.541 3.357 3.824 . 0 0 "[ . 1 . 2]" 1 207 1 22 TYR HB2 1 23 GLU H . . 4.270 2.971 2.833 3.197 . 0 0 "[ . 1 . 2]" 1 208 1 22 TYR HB3 1 23 GLU H . . 4.460 3.860 3.706 4.061 . 0 0 "[ . 1 . 2]" 1 209 1 22 TYR HB3 1 52 PRO HA . . 5.220 4.535 3.901 4.826 . 0 0 "[ . 1 . 2]" 1 210 1 22 TYR HB3 1 52 PRO HG3 . . 4.310 4.141 3.709 4.302 . 0 0 "[ . 1 . 2]" 1 211 1 22 TYR QD 1 52 PRO HA . . 4.200 2.706 2.011 3.245 . 0 0 "[ . 1 . 2]" 1 212 1 22 TYR QD 1 52 PRO HB3 . . 4.810 2.223 1.999 2.461 . 0 0 "[ . 1 . 2]" 1 213 1 22 TYR QD 1 52 PRO HG3 . . 4.340 4.114 3.878 4.296 . 0 0 "[ . 1 . 2]" 1 214 1 22 TYR QD 1 55 PHE QD . . 4.640 3.436 2.563 4.083 . 0 0 "[ . 1 . 2]" 1 215 1 22 TYR QD 1 84 LEU MD1 . . 4.510 2.987 2.098 4.243 . 0 0 "[ . 1 . 2]" 1 216 1 22 TYR QE 1 52 PRO HA . . 4.370 3.333 2.690 3.746 . 0 0 "[ . 1 . 2]" 1 217 1 22 TYR QE 1 55 PHE HB2 . . 4.310 3.339 2.453 3.911 . 0 0 "[ . 1 . 2]" 1 218 1 22 TYR QE 1 55 PHE HB3 . . 4.180 3.700 2.951 4.181 0.001 8 0 "[ . 1 . 2]" 1 219 1 22 TYR QE 1 84 LEU HB2 . . 4.510 3.005 2.271 4.160 . 0 0 "[ . 1 . 2]" 1 220 1 22 TYR QE 1 84 LEU HB3 . . 4.550 2.995 2.171 3.715 . 0 0 "[ . 1 . 2]" 1 221 1 22 TYR QE 1 84 LEU MD1 . . 3.980 2.474 1.867 3.727 . 0 0 "[ . 1 . 2]" 1 222 1 23 GLU H 1 23 GLU HB2 . . 3.260 2.292 2.244 2.393 . 0 0 "[ . 1 . 2]" 1 223 1 23 GLU H 1 23 GLU HB3 . . 3.250 2.844 2.810 2.868 . 0 0 "[ . 1 . 2]" 1 224 1 23 GLU H 1 23 GLU HG2 . . 4.920 4.529 4.215 4.672 . 0 0 "[ . 1 . 2]" 1 225 1 23 GLU H 1 23 GLU QG . . 4.230 3.977 3.862 4.106 . 0 0 "[ . 1 . 2]" 1 226 1 23 GLU H 1 23 GLU HG3 . . 4.920 4.420 4.184 4.573 . 0 0 "[ . 1 . 2]" 1 227 1 23 GLU H 1 24 SER H . . 2.820 2.532 2.410 2.626 . 0 0 "[ . 1 . 2]" 1 228 1 23 GLU H 1 24 SER HA . . 5.420 5.022 4.897 5.123 . 0 0 "[ . 1 . 2]" 1 229 1 23 GLU H 1 24 SER QB . . 4.390 4.295 4.133 4.383 . 0 0 "[ . 1 . 2]" 1 230 1 23 GLU HA 1 23 GLU HG2 . . 3.850 3.106 2.342 3.658 . 0 0 "[ . 1 . 2]" 1 231 1 23 GLU HA 1 23 GLU QG . . 3.330 2.436 2.250 2.716 . 0 0 "[ . 1 . 2]" 1 232 1 23 GLU HA 1 23 GLU HG3 . . 3.850 2.750 2.339 3.606 . 0 0 "[ . 1 . 2]" 1 233 1 23 GLU HB2 1 24 SER H . . 4.140 4.045 3.933 4.114 . 0 0 "[ . 1 . 2]" 1 234 1 23 GLU HB3 1 24 SER H . . 3.840 3.442 3.266 3.564 . 0 0 "[ . 1 . 2]" 1 235 1 24 SER H 1 24 SER QB . . 2.960 2.225 2.162 2.474 . 0 0 "[ . 1 . 2]" 1 236 1 24 SER H 1 24 SER HG . . 4.160 3.628 2.574 4.160 . 0 0 "[ . 1 . 2]" 1 237 1 24 SER H 1 25 GLY H . . 4.630 4.540 4.468 4.600 . 0 0 "[ . 1 . 2]" 1 238 1 24 SER H 1 29 VAL MG2 . . 5.370 5.092 4.850 5.336 . 0 0 "[ . 1 . 2]" 1 239 1 24 SER H 1 51 GLY H . . 5.070 4.683 4.363 4.944 . 0 0 "[ . 1 . 2]" 1 240 1 24 SER H 1 51 GLY HA2 . . 4.880 4.646 4.369 4.874 . 0 0 "[ . 1 . 2]" 1 241 1 24 SER HA 1 25 GLY H . . 2.720 2.308 2.143 2.655 . 0 0 "[ . 1 . 2]" 1 242 1 24 SER HA 1 28 GLU HB2 . . 3.950 3.737 3.587 3.930 . 0 0 "[ . 1 . 2]" 1 243 1 24 SER HA 1 28 GLU HG2 . . 5.350 3.944 3.665 4.711 . 0 0 "[ . 1 . 2]" 1 244 1 24 SER HA 1 28 GLU QG . . 4.580 3.212 2.952 3.989 . 0 0 "[ . 1 . 2]" 1 245 1 24 SER HA 1 28 GLU HG3 . . 5.350 3.413 3.066 4.316 . 0 0 "[ . 1 . 2]" 1 246 1 24 SER QB 1 25 GLY H . . 3.960 2.901 2.053 3.398 . 0 0 "[ . 1 . 2]" 1 247 1 24 SER QB 1 28 GLU H . . 4.400 4.108 3.964 4.280 . 0 0 "[ . 1 . 2]" 1 248 1 24 SER QB 1 28 GLU HB2 . . 3.270 2.009 1.990 2.078 . 0 0 "[ . 1 . 2]" 1 249 1 24 SER QB 1 28 GLU QG . . 3.960 3.080 2.681 3.543 . 0 0 "[ . 1 . 2]" 1 250 1 24 SER QB 1 29 VAL H . . 4.080 3.625 3.375 3.819 . 0 0 "[ . 1 . 2]" 1 251 1 24 SER QB 1 29 VAL MG2 . . 3.430 3.070 2.758 3.353 . 0 0 "[ . 1 . 2]" 1 252 1 24 SER QB 1 51 GLY H . . 4.560 4.308 3.964 4.545 . 0 0 "[ . 1 . 2]" 1 253 1 24 SER QB 1 51 GLY HA2 . . 4.490 3.739 3.385 4.115 . 0 0 "[ . 1 . 2]" 1 254 1 24 SER HB2 1 25 GLY H . . 4.550 3.722 2.065 4.466 . 0 0 "[ . 1 . 2]" 1 255 1 24 SER HB2 1 28 GLU HB2 . . 3.910 3.204 1.999 3.747 . 0 0 "[ . 1 . 2]" 1 256 1 24 SER HB2 1 28 GLU HG2 . . 5.500 4.895 3.449 5.453 . 0 0 "[ . 1 . 2]" 1 257 1 24 SER HB2 1 28 GLU HG3 . . 5.500 4.262 2.826 4.807 . 0 0 "[ . 1 . 2]" 1 258 1 24 SER HB2 1 29 VAL MG2 . . 4.090 3.677 3.138 4.035 . 0 0 "[ . 1 . 2]" 1 259 1 24 SER HB3 1 25 GLY H . . 4.550 3.397 2.691 3.909 . 0 0 "[ . 1 . 2]" 1 260 1 24 SER HB3 1 28 GLU HB2 . . 3.910 2.521 1.999 3.767 . 0 0 "[ . 1 . 2]" 1 261 1 24 SER HB3 1 28 GLU HG2 . . 5.500 4.233 3.585 5.502 0.002 8 0 "[ . 1 . 2]" 1 262 1 24 SER HB3 1 28 GLU HG3 . . 5.500 3.826 3.010 5.503 0.003 8 0 "[ . 1 . 2]" 1 263 1 24 SER HB3 1 29 VAL MG2 . . 4.090 3.419 2.874 4.091 0.001 8 0 "[ . 1 . 2]" 1 264 1 24 SER HG 1 25 GLY H . . 4.620 4.168 3.306 4.620 0.000 12 0 "[ . 1 . 2]" 1 265 1 25 GLY H 1 26 PRO QD . . 4.520 4.100 4.017 4.227 . 0 0 "[ . 1 . 2]" 1 266 1 25 GLY H 1 28 GLU H . . 3.910 3.460 2.966 3.909 . 0 0 "[ . 1 . 2]" 1 267 1 25 GLY H 1 28 GLU HB2 . . 3.910 3.184 2.366 3.889 . 0 0 "[ . 1 . 2]" 1 268 1 25 GLY H 1 28 GLU QG . . 4.030 2.738 2.309 3.010 . 0 0 "[ . 1 . 2]" 1 269 1 25 GLY H 1 29 VAL H . . 4.980 4.264 3.209 4.900 . 0 0 "[ . 1 . 2]" 1 270 1 25 GLY H 1 29 VAL MG2 . . 5.040 4.326 3.403 4.905 . 0 0 "[ . 1 . 2]" 1 271 1 25 GLY H 1 50 THR MG . . 5.500 5.286 4.769 5.501 0.001 12 0 "[ . 1 . 2]" 1 272 1 25 GLY H 1 51 GLY H . . 5.260 4.557 3.881 4.884 . 0 0 "[ . 1 . 2]" 1 273 1 25 GLY QA 1 26 PRO QD . . 2.800 1.945 1.920 1.971 . 0 0 "[ . 1 . 2]" 1 274 1 25 GLY QA 1 26 PRO HG3 . . 4.960 4.265 4.256 4.272 . 0 0 "[ . 1 . 2]" 1 275 1 25 GLY QA 1 27 ASP H . . 4.780 3.152 3.022 3.365 . 0 0 "[ . 1 . 2]" 1 276 1 25 GLY QA 1 50 THR MG . . 4.700 2.727 2.127 3.024 . 0 0 "[ . 1 . 2]" 1 277 1 25 GLY QA 1 51 GLY H . . 3.630 2.622 2.206 2.910 . 0 0 "[ . 1 . 2]" 1 278 1 25 GLY HA2 1 26 PRO HD2 . . 3.720 3.044 2.972 3.109 . 0 0 "[ . 1 . 2]" 1 279 1 25 GLY HA2 1 26 PRO HD3 . . 3.720 2.753 2.685 2.818 . 0 0 "[ . 1 . 2]" 1 280 1 25 GLY HA3 1 26 PRO HD2 . . 3.720 2.059 2.017 2.107 . 0 0 "[ . 1 . 2]" 1 281 1 25 GLY HA3 1 26 PRO HD3 . . 3.720 2.880 2.814 2.953 . 0 0 "[ . 1 . 2]" 1 282 1 26 PRO HA 1 28 GLU H . . 4.580 4.208 4.075 4.279 . 0 0 "[ . 1 . 2]" 1 283 1 26 PRO HA 1 29 VAL H . . 3.890 3.513 3.236 3.868 . 0 0 "[ . 1 . 2]" 1 284 1 26 PRO HA 1 29 VAL HB . . 3.510 2.437 2.122 2.841 . 0 0 "[ . 1 . 2]" 1 285 1 26 PRO HA 1 29 VAL MG1 . . 4.310 3.752 3.517 4.094 . 0 0 "[ . 1 . 2]" 1 286 1 26 PRO HA 1 29 VAL MG2 . . 3.700 3.034 2.583 3.632 . 0 0 "[ . 1 . 2]" 1 287 1 26 PRO HA 1 30 ARG H . . 4.110 4.057 3.917 4.112 0.002 6 0 "[ . 1 . 2]" 1 288 1 26 PRO HA 1 48 ILE HA . . 4.690 4.413 4.027 4.694 0.004 6 0 "[ . 1 . 2]" 1 289 1 26 PRO HA 1 50 THR HA . . 3.730 2.952 2.776 3.174 . 0 0 "[ . 1 . 2]" 1 290 1 26 PRO HB2 1 27 ASP H . . 3.880 3.567 3.296 3.742 . 0 0 "[ . 1 . 2]" 1 291 1 26 PRO HB2 1 27 ASP HA . . 4.570 4.175 4.058 4.272 . 0 0 "[ . 1 . 2]" 1 292 1 26 PRO HB2 1 28 GLU H . . 5.500 5.425 5.260 5.501 0.001 10 0 "[ . 1 . 2]" 1 293 1 26 PRO HB2 1 48 ILE HA . . 3.730 3.144 2.813 3.380 . 0 0 "[ . 1 . 2]" 1 294 1 26 PRO HB3 1 27 ASP H . . 4.590 4.276 4.117 4.378 . 0 0 "[ . 1 . 2]" 1 295 1 26 PRO HB3 1 48 ILE H . . 5.500 5.274 4.933 5.499 . 0 0 "[ . 1 . 2]" 1 296 1 26 PRO HB3 1 48 ILE HA . . 3.650 3.444 3.084 3.625 . 0 0 "[ . 1 . 2]" 1 297 1 26 PRO HB3 1 49 LEU H . . 4.550 4.378 4.085 4.532 . 0 0 "[ . 1 . 2]" 1 298 1 26 PRO HB3 1 50 THR MG . . 4.610 3.103 2.925 3.239 . 0 0 "[ . 1 . 2]" 1 299 1 26 PRO QD 1 27 ASP H . . 3.880 2.656 2.601 2.737 . 0 0 "[ . 1 . 2]" 1 300 1 26 PRO QD 1 50 THR HA . . 3.680 2.798 2.555 3.008 . 0 0 "[ . 1 . 2]" 1 301 1 26 PRO QD 1 50 THR MG . . 3.210 1.889 1.774 2.003 . 0 0 "[ . 1 . 2]" 1 302 1 26 PRO HD2 1 27 ASP H . . 4.750 2.706 2.646 2.794 . 0 0 "[ . 1 . 2]" 1 303 1 26 PRO HD2 1 50 THR HA . . 4.310 4.188 3.978 4.309 . 0 0 "[ . 1 . 2]" 1 304 1 26 PRO HD2 1 50 THR MG . . 3.760 3.286 3.096 3.459 . 0 0 "[ . 1 . 2]" 1 305 1 26 PRO HD3 1 27 ASP H . . 4.750 3.872 3.835 3.920 . 0 0 "[ . 1 . 2]" 1 306 1 26 PRO HD3 1 50 THR HA . . 4.310 2.842 2.586 3.075 . 0 0 "[ . 1 . 2]" 1 307 1 26 PRO HD3 1 50 THR MG . . 3.760 1.901 1.785 2.018 . 0 0 "[ . 1 . 2]" 1 308 1 26 PRO HG2 1 27 ASP H . . 4.690 2.689 2.322 2.952 . 0 0 "[ . 1 . 2]" 1 309 1 26 PRO HG2 1 50 THR MG . . 4.250 4.215 4.128 4.268 0.018 6 0 "[ . 1 . 2]" 1 310 1 26 PRO HG3 1 48 ILE HA . . 5.500 5.083 4.783 5.477 . 0 0 "[ . 1 . 2]" 1 311 1 26 PRO HG3 1 50 THR HA . . 4.880 4.504 4.198 4.875 . 0 0 "[ . 1 . 2]" 1 312 1 26 PRO HG3 1 50 THR MG . . 3.600 3.115 2.989 3.255 . 0 0 "[ . 1 . 2]" 1 313 1 27 ASP H 1 27 ASP HB2 . . 4.010 2.597 2.241 3.540 . 0 0 "[ . 1 . 2]" 1 314 1 27 ASP H 1 27 ASP QB . . 3.370 2.452 2.218 2.925 . 0 0 "[ . 1 . 2]" 1 315 1 27 ASP H 1 27 ASP HB3 . . 4.010 3.343 2.528 3.647 . 0 0 "[ . 1 . 2]" 1 316 1 27 ASP H 1 28 GLU H . . 3.110 2.472 2.218 2.717 . 0 0 "[ . 1 . 2]" 1 317 1 27 ASP HA 1 29 VAL H . . 5.070 4.790 4.616 5.046 . 0 0 "[ . 1 . 2]" 1 318 1 27 ASP HA 1 30 ARG H . . 4.320 4.121 3.987 4.256 . 0 0 "[ . 1 . 2]" 1 319 1 27 ASP HA 1 30 ARG HB2 . . 4.580 4.471 4.134 4.575 . 0 0 "[ . 1 . 2]" 1 320 1 27 ASP HA 1 30 ARG HB3 . . 4.440 3.706 3.480 4.029 . 0 0 "[ . 1 . 2]" 1 321 1 27 ASP HA 1 31 ALA H . . 5.270 5.043 4.765 5.213 . 0 0 "[ . 1 . 2]" 1 322 1 27 ASP QB 1 28 GLU H . . 3.600 2.808 2.602 3.465 . 0 0 "[ . 1 . 2]" 1 323 1 28 GLU H 1 28 GLU HB2 . . 2.860 2.619 2.528 2.720 . 0 0 "[ . 1 . 2]" 1 324 1 28 GLU H 1 28 GLU QG . . 3.110 2.220 2.045 2.347 . 0 0 "[ . 1 . 2]" 1 325 1 28 GLU H 1 29 VAL H . . 3.020 2.342 2.238 2.500 . 0 0 "[ . 1 . 2]" 1 326 1 28 GLU H 1 29 VAL MG2 . . 4.200 4.127 4.037 4.185 . 0 0 "[ . 1 . 2]" 1 327 1 28 GLU H 1 30 ARG H . . 4.340 3.932 3.722 4.135 . 0 0 "[ . 1 . 2]" 1 328 1 28 GLU H 1 30 ARG HB3 . . 5.500 5.275 4.990 5.499 . 0 0 "[ . 1 . 2]" 1 329 1 28 GLU HA 1 28 GLU HG2 . . 4.150 3.223 2.774 3.452 . 0 0 "[ . 1 . 2]" 1 330 1 28 GLU HA 1 28 GLU QG . . 3.550 3.024 2.566 3.205 . 0 0 "[ . 1 . 2]" 1 331 1 28 GLU HA 1 28 GLU HG3 . . 4.150 3.675 2.976 3.871 . 0 0 "[ . 1 . 2]" 1 332 1 28 GLU HA 1 30 ARG H . . 4.730 4.062 3.863 4.312 . 0 0 "[ . 1 . 2]" 1 333 1 28 GLU HA 1 31 ALA H . . 3.510 3.178 3.072 3.366 . 0 0 "[ . 1 . 2]" 1 334 1 28 GLU HA 1 31 ALA MB . . 3.470 2.468 2.315 2.655 . 0 0 "[ . 1 . 2]" 1 335 1 28 GLU HB2 1 29 VAL H . . 3.270 2.575 2.306 2.781 . 0 0 "[ . 1 . 2]" 1 336 1 28 GLU HB2 1 29 VAL HA . . 4.830 4.060 3.964 4.141 . 0 0 "[ . 1 . 2]" 1 337 1 28 GLU HB2 1 29 VAL MG2 . . 3.970 3.473 3.285 3.609 . 0 0 "[ . 1 . 2]" 1 338 1 28 GLU HB3 1 29 VAL HA . . 5.500 4.633 4.494 4.755 . 0 0 "[ . 1 . 2]" 1 339 1 28 GLU HB3 1 31 ALA MB . . 4.990 3.856 3.681 4.154 . 0 0 "[ . 1 . 2]" 1 340 1 28 GLU QG 1 29 VAL H . . 3.920 3.815 3.652 3.907 . 0 0 "[ . 1 . 2]" 1 341 1 28 GLU HG2 1 31 ALA MB . . 5.500 5.229 4.625 5.502 0.002 20 0 "[ . 1 . 2]" 1 342 1 28 GLU HG3 1 31 ALA MB . . 5.500 5.434 5.144 5.501 0.001 10 0 "[ . 1 . 2]" 1 343 1 29 VAL H 1 29 VAL HB . . 3.390 2.426 2.378 2.505 . 0 0 "[ . 1 . 2]" 1 344 1 29 VAL H 1 29 VAL MG1 . . 3.930 3.744 3.728 3.765 . 0 0 "[ . 1 . 2]" 1 345 1 29 VAL H 1 29 VAL MG2 . . 2.990 2.387 2.231 2.510 . 0 0 "[ . 1 . 2]" 1 346 1 29 VAL H 1 30 ARG H . . 3.290 2.799 2.682 2.970 . 0 0 "[ . 1 . 2]" 1 347 1 29 VAL H 1 30 ARG HB3 . . 5.280 5.002 4.804 5.157 . 0 0 "[ . 1 . 2]" 1 348 1 29 VAL H 1 31 ALA H . . 4.490 4.167 4.037 4.435 . 0 0 "[ . 1 . 2]" 1 349 1 29 VAL H 1 47 GLY HA2 . . 5.500 5.464 5.362 5.504 0.004 6 0 "[ . 1 . 2]" 1 350 1 29 VAL HA 1 29 VAL MG1 . . 3.320 2.482 2.423 2.509 . 0 0 "[ . 1 . 2]" 1 351 1 29 VAL HA 1 29 VAL MG2 . . 3.200 2.252 2.198 2.318 . 0 0 "[ . 1 . 2]" 1 352 1 29 VAL HA 1 31 ALA H . . 4.690 4.275 4.075 4.668 . 0 0 "[ . 1 . 2]" 1 353 1 29 VAL HA 1 32 TRP H . . 3.760 3.597 3.511 3.717 . 0 0 "[ . 1 . 2]" 1 354 1 29 VAL HA 1 32 TRP HE3 . . 4.870 4.535 4.101 4.870 0.000 4 0 "[ . 1 . 2]" 1 355 1 29 VAL HA 1 54 LEU MD2 . . 4.870 3.563 3.342 3.992 . 0 0 "[ . 1 . 2]" 1 356 1 29 VAL HB 1 30 ARG H . . 3.080 2.798 2.559 2.966 . 0 0 "[ . 1 . 2]" 1 357 1 29 VAL HB 1 31 ALA H . . 5.500 5.048 4.938 5.214 . 0 0 "[ . 1 . 2]" 1 358 1 29 VAL HB 1 49 LEU H . . 5.030 4.723 4.526 4.895 . 0 0 "[ . 1 . 2]" 1 359 1 29 VAL HB 1 51 GLY H . . 5.500 5.323 4.803 5.487 . 0 0 "[ . 1 . 2]" 1 360 1 29 VAL HB 1 54 LEU MD2 . . 5.020 4.094 3.879 4.329 . 0 0 "[ . 1 . 2]" 1 361 1 29 VAL MG1 1 30 ARG H . . 3.480 3.276 3.001 3.443 . 0 0 "[ . 1 . 2]" 1 362 1 29 VAL MG1 1 30 ARG HA . . 3.700 3.243 3.073 3.380 . 0 0 "[ . 1 . 2]" 1 363 1 29 VAL MG1 1 30 ARG HB2 . . 4.370 4.051 3.930 4.245 . 0 0 "[ . 1 . 2]" 1 364 1 29 VAL MG1 1 31 ALA H . . 5.270 4.812 4.683 4.969 . 0 0 "[ . 1 . 2]" 1 365 1 29 VAL MG1 1 32 TRP H . . 5.500 4.776 4.648 4.912 . 0 0 "[ . 1 . 2]" 1 366 1 29 VAL MG1 1 32 TRP QB . . 5.340 3.805 3.645 3.928 . 0 0 "[ . 1 . 2]" 1 367 1 29 VAL MG1 1 47 GLY H . . 4.870 4.346 4.194 4.535 . 0 0 "[ . 1 . 2]" 1 368 1 29 VAL MG1 1 47 GLY HA2 . . 3.300 2.404 2.091 2.735 . 0 0 "[ . 1 . 2]" 1 369 1 29 VAL MG1 1 49 LEU H . . 4.250 3.605 3.376 3.926 . 0 0 "[ . 1 . 2]" 1 370 1 29 VAL MG1 1 49 LEU HB2 . . 4.050 3.276 3.005 3.590 . 0 0 "[ . 1 . 2]" 1 371 1 29 VAL MG1 1 51 GLY H . . 5.430 5.324 5.090 5.438 0.008 6 0 "[ . 1 . 2]" 1 372 1 29 VAL MG1 1 51 GLY HA2 . . 5.060 4.241 3.997 4.431 . 0 0 "[ . 1 . 2]" 1 373 1 29 VAL MG1 1 54 LEU HB2 . . 3.310 2.461 2.230 2.815 . 0 0 "[ . 1 . 2]" 1 374 1 29 VAL MG1 1 54 LEU HB3 . . 4.040 3.284 3.016 3.611 . 0 0 "[ . 1 . 2]" 1 375 1 29 VAL MG1 1 54 LEU MD2 . . 3.140 1.832 1.713 2.039 . 0 0 "[ . 1 . 2]" 1 376 1 29 VAL MG1 1 54 LEU HG . . 4.470 4.138 3.944 4.385 . 0 0 "[ . 1 . 2]" 1 377 1 29 VAL MG2 1 30 ARG H . . 4.190 4.041 3.957 4.101 . 0 0 "[ . 1 . 2]" 1 378 1 29 VAL MG2 1 49 LEU H . . 5.500 4.938 4.738 5.148 . 0 0 "[ . 1 . 2]" 1 379 1 29 VAL MG2 1 49 LEU HB2 . . 4.810 4.403 4.167 4.624 . 0 0 "[ . 1 . 2]" 1 380 1 29 VAL MG2 1 50 THR HA . . 3.640 2.725 2.436 3.034 . 0 0 "[ . 1 . 2]" 1 381 1 29 VAL MG2 1 51 GLY H . . 3.710 3.047 2.813 3.189 . 0 0 "[ . 1 . 2]" 1 382 1 29 VAL MG2 1 51 GLY HA2 . . 3.670 2.258 1.960 2.361 . 0 0 "[ . 1 . 2]" 1 383 1 29 VAL MG2 1 51 GLY HA3 . . 3.860 3.462 3.154 3.598 . 0 0 "[ . 1 . 2]" 1 384 1 29 VAL MG2 1 54 LEU H . . 4.490 4.009 3.812 4.207 . 0 0 "[ . 1 . 2]" 1 385 1 29 VAL MG2 1 54 LEU HB3 . . 4.180 3.001 2.788 3.222 . 0 0 "[ . 1 . 2]" 1 386 1 29 VAL MG2 1 55 PHE H . . 5.500 4.787 4.564 5.001 . 0 0 "[ . 1 . 2]" 1 387 1 30 ARG H 1 30 ARG HB2 . . 2.970 2.642 2.512 2.775 . 0 0 "[ . 1 . 2]" 1 388 1 30 ARG H 1 30 ARG HB3 . . 3.100 2.447 2.351 2.555 . 0 0 "[ . 1 . 2]" 1 389 1 30 ARG H 1 30 ARG QD . . 4.890 4.331 3.972 4.638 . 0 0 "[ . 1 . 2]" 1 390 1 30 ARG H 1 30 ARG HG2 . . 4.920 4.437 4.386 4.469 . 0 0 "[ . 1 . 2]" 1 391 1 30 ARG H 1 30 ARG QG . . 4.260 4.020 3.975 4.064 . 0 0 "[ . 1 . 2]" 1 392 1 30 ARG H 1 30 ARG HG3 . . 4.920 4.597 4.497 4.671 . 0 0 "[ . 1 . 2]" 1 393 1 30 ARG H 1 31 ALA H . . 3.260 2.516 2.386 2.760 . 0 0 "[ . 1 . 2]" 1 394 1 30 ARG H 1 31 ALA MB . . 5.240 4.147 4.015 4.309 . 0 0 "[ . 1 . 2]" 1 395 1 30 ARG H 1 32 TRP H . . 4.690 4.188 3.984 4.369 . 0 0 "[ . 1 . 2]" 1 396 1 30 ARG H 1 47 GLY HA2 . . 3.950 3.410 3.178 3.536 . 0 0 "[ . 1 . 2]" 1 397 1 30 ARG HA 1 30 ARG HD2 . . 5.270 4.289 3.612 4.896 . 0 0 "[ . 1 . 2]" 1 398 1 30 ARG HA 1 30 ARG QD . . 4.510 3.831 3.476 4.230 . 0 0 "[ . 1 . 2]" 1 399 1 30 ARG HA 1 30 ARG HD3 . . 5.270 4.467 3.679 4.936 . 0 0 "[ . 1 . 2]" 1 400 1 30 ARG HA 1 30 ARG HG2 . . 3.810 2.631 2.433 2.844 . 0 0 "[ . 1 . 2]" 1 401 1 30 ARG HA 1 30 ARG HG3 . . 3.810 3.276 2.850 3.638 . 0 0 "[ . 1 . 2]" 1 402 1 30 ARG HA 1 32 TRP H . . 4.650 4.534 4.318 4.648 . 0 0 "[ . 1 . 2]" 1 403 1 30 ARG HA 1 33 LEU H . . 4.040 3.750 3.490 3.921 . 0 0 "[ . 1 . 2]" 1 404 1 30 ARG HA 1 33 LEU HB2 . . 4.370 3.418 3.188 3.574 . 0 0 "[ . 1 . 2]" 1 405 1 30 ARG HA 1 33 LEU HB3 . . 5.220 4.924 4.684 5.125 . 0 0 "[ . 1 . 2]" 1 406 1 30 ARG HA 1 33 LEU MD1 . . 3.260 2.082 1.889 2.330 . 0 0 "[ . 1 . 2]" 1 407 1 30 ARG HA 1 33 LEU HG . . 4.230 3.604 3.249 3.890 . 0 0 "[ . 1 . 2]" 1 408 1 30 ARG HA 1 34 GLU H . . 4.460 4.344 4.067 4.462 0.002 5 0 "[ . 1 . 2]" 1 409 1 30 ARG HA 1 43 VAL HA . . 4.870 4.099 3.917 4.327 . 0 0 "[ . 1 . 2]" 1 410 1 30 ARG HA 1 43 VAL MG1 . . 4.020 3.153 2.970 3.434 . 0 0 "[ . 1 . 2]" 1 411 1 30 ARG HA 1 43 VAL MG2 . . 4.990 4.596 4.367 4.984 . 0 0 "[ . 1 . 2]" 1 412 1 30 ARG HB2 1 30 ARG QD . . 3.620 3.232 2.651 3.516 . 0 0 "[ . 1 . 2]" 1 413 1 30 ARG HB2 1 31 ALA H . . 4.120 4.019 3.803 4.121 0.001 12 0 "[ . 1 . 2]" 1 414 1 30 ARG HB2 1 33 LEU MD1 . . 5.490 3.947 3.618 4.167 . 0 0 "[ . 1 . 2]" 1 415 1 30 ARG HB2 1 47 GLY H . . 4.650 4.532 4.304 4.653 0.003 8 0 "[ . 1 . 2]" 1 416 1 30 ARG HB2 1 47 GLY HA2 . . 4.440 2.440 2.025 2.682 . 0 0 "[ . 1 . 2]" 1 417 1 30 ARG HB2 1 47 GLY HA3 . . 4.150 2.276 2.097 2.435 . 0 0 "[ . 1 . 2]" 1 418 1 30 ARG HB2 1 48 ILE H . . 5.500 4.885 4.679 5.107 . 0 0 "[ . 1 . 2]" 1 419 1 30 ARG HB3 1 30 ARG QD . . 3.530 2.308 2.087 2.670 . 0 0 "[ . 1 . 2]" 1 420 1 30 ARG HB3 1 31 ALA H . . 3.190 2.813 2.443 2.986 . 0 0 "[ . 1 . 2]" 1 421 1 30 ARG HB3 1 31 ALA MB . . 4.400 4.064 3.965 4.165 . 0 0 "[ . 1 . 2]" 1 422 1 30 ARG QD 1 31 ALA H . . 4.340 3.662 2.947 4.340 0.000 7 0 "[ . 1 . 2]" 1 423 1 30 ARG QD 1 33 LEU MD1 . . 5.340 4.873 4.490 5.299 . 0 0 "[ . 1 . 2]" 1 424 1 30 ARG QD 1 43 VAL MG1 . . 3.790 3.007 2.550 3.308 . 0 0 "[ . 1 . 2]" 1 425 1 30 ARG QD 1 43 VAL MG2 . . 5.340 4.959 4.264 5.342 0.002 7 0 "[ . 1 . 2]" 1 426 1 30 ARG HD2 1 43 VAL MG1 . . 4.310 3.863 3.123 4.243 . 0 0 "[ . 1 . 2]" 1 427 1 30 ARG HD2 1 47 GLY HA3 . . 5.500 4.997 4.524 5.308 . 0 0 "[ . 1 . 2]" 1 428 1 30 ARG HD3 1 43 VAL MG1 . . 4.310 3.182 2.703 4.193 . 0 0 "[ . 1 . 2]" 1 429 1 30 ARG HD3 1 47 GLY HA3 . . 5.500 4.887 4.161 5.278 . 0 0 "[ . 1 . 2]" 1 430 1 30 ARG QG 1 33 LEU MD1 . . 4.450 3.443 3.120 3.713 . 0 0 "[ . 1 . 2]" 1 431 1 30 ARG QG 1 34 GLU H . . 4.570 4.254 3.727 4.568 . 0 0 "[ . 1 . 2]" 1 432 1 30 ARG QG 1 34 GLU QG . . 4.380 3.234 2.436 3.569 . 0 0 "[ . 1 . 2]" 1 433 1 30 ARG QG 1 43 VAL MG1 . . 3.190 1.987 1.828 2.343 . 0 0 "[ . 1 . 2]" 1 434 1 30 ARG QG 1 43 VAL MG2 . . 4.750 4.055 3.881 4.488 . 0 0 "[ . 1 . 2]" 1 435 1 30 ARG QG 1 47 GLY HA2 . . 4.450 3.497 3.114 3.760 . 0 0 "[ . 1 . 2]" 1 436 1 30 ARG QG 1 47 GLY HA3 . . 4.370 2.505 2.030 2.784 . 0 0 "[ . 1 . 2]" 1 437 1 30 ARG HG2 1 43 VAL MG1 . . 3.830 2.122 1.851 2.455 . 0 0 "[ . 1 . 2]" 1 438 1 30 ARG HG3 1 43 VAL MG1 . . 3.830 2.708 2.005 3.512 . 0 0 "[ . 1 . 2]" 1 439 1 31 ALA H 1 31 ALA MB . . 2.640 2.125 2.039 2.258 . 0 0 "[ . 1 . 2]" 1 440 1 31 ALA H 1 32 TRP H . . 3.170 2.585 2.465 2.753 . 0 0 "[ . 1 . 2]" 1 441 1 31 ALA H 1 32 TRP QB . . 4.940 4.307 4.207 4.497 . 0 0 "[ . 1 . 2]" 1 442 1 31 ALA H 1 33 LEU H . . 4.490 4.217 4.042 4.350 . 0 0 "[ . 1 . 2]" 1 443 1 31 ALA H 1 33 LEU MD1 . . 5.500 4.827 4.508 5.048 . 0 0 "[ . 1 . 2]" 1 444 1 31 ALA H 1 33 LEU HG . . 5.500 5.353 5.027 5.500 0.000 18 0 "[ . 1 . 2]" 1 445 1 31 ALA HA 1 34 GLU H . . 3.920 3.633 3.361 3.785 . 0 0 "[ . 1 . 2]" 1 446 1 31 ALA HA 1 34 GLU HB2 . . 3.700 2.704 2.487 2.896 . 0 0 "[ . 1 . 2]" 1 447 1 31 ALA HA 1 34 GLU HB3 . . 4.470 4.250 4.014 4.462 . 0 0 "[ . 1 . 2]" 1 448 1 31 ALA HA 1 34 GLU QG . . 4.890 3.712 3.408 4.214 . 0 0 "[ . 1 . 2]" 1 449 1 31 ALA HA 1 35 ALA H . . 4.410 4.186 3.952 4.405 . 0 0 "[ . 1 . 2]" 1 450 1 31 ALA MB 1 32 TRP H . . 3.220 2.603 2.478 2.715 . 0 0 "[ . 1 . 2]" 1 451 1 31 ALA MB 1 32 TRP HA . . 4.590 3.743 3.646 3.841 . 0 0 "[ . 1 . 2]" 1 452 1 31 ALA MB 1 32 TRP HB2 . . 4.940 4.227 4.095 4.280 . 0 0 "[ . 1 . 2]" 1 453 1 31 ALA MB 1 32 TRP QB . . 4.340 3.937 3.840 3.979 . 0 0 "[ . 1 . 2]" 1 454 1 31 ALA MB 1 32 TRP HB3 . . 4.940 4.696 4.614 4.765 . 0 0 "[ . 1 . 2]" 1 455 1 31 ALA MB 1 33 LEU H . . 4.940 4.591 4.452 4.725 . 0 0 "[ . 1 . 2]" 1 456 1 31 ALA MB 1 35 ALA H . . 4.800 4.613 4.384 4.769 . 0 0 "[ . 1 . 2]" 1 457 1 32 TRP H 1 32 TRP HB2 . . 3.010 2.550 2.492 2.631 . 0 0 "[ . 1 . 2]" 1 458 1 32 TRP H 1 32 TRP HB3 . . 3.010 2.512 2.432 2.570 . 0 0 "[ . 1 . 2]" 1 459 1 32 TRP H 1 32 TRP HE3 . . 4.800 4.683 4.501 4.787 . 0 0 "[ . 1 . 2]" 1 460 1 32 TRP H 1 33 LEU H . . 3.200 2.813 2.661 2.933 . 0 0 "[ . 1 . 2]" 1 461 1 32 TRP H 1 33 LEU MD1 . . 5.500 4.891 4.672 5.116 . 0 0 "[ . 1 . 2]" 1 462 1 32 TRP H 1 33 LEU HG . . 5.300 4.347 4.101 4.508 . 0 0 "[ . 1 . 2]" 1 463 1 32 TRP H 1 35 ALA MB . . 5.070 4.750 4.581 4.924 . 0 0 "[ . 1 . 2]" 1 464 1 32 TRP HA 1 32 TRP HD1 . . 3.940 3.060 2.835 3.240 . 0 0 "[ . 1 . 2]" 1 465 1 32 TRP HA 1 35 ALA H . . 4.180 3.734 3.507 3.903 . 0 0 "[ . 1 . 2]" 1 466 1 32 TRP HA 1 35 ALA MB . . 3.470 2.865 2.677 3.071 . 0 0 "[ . 1 . 2]" 1 467 1 32 TRP QB 1 32 TRP HE3 . . 3.650 2.483 2.411 2.551 . 0 0 "[ . 1 . 2]" 1 468 1 32 TRP QB 1 33 LEU H . . 3.230 2.503 2.327 2.697 . 0 0 "[ . 1 . 2]" 1 469 1 32 TRP QB 1 33 LEU HG . . 4.750 3.179 3.020 3.283 . 0 0 "[ . 1 . 2]" 1 470 1 32 TRP HB2 1 33 LEU H . . 3.990 3.877 3.759 3.992 0.002 10 0 "[ . 1 . 2]" 1 471 1 32 TRP HB3 1 33 LEU H . . 3.990 2.535 2.350 2.742 . 0 0 "[ . 1 . 2]" 1 472 1 32 TRP HD1 1 36 LYS HE2 . . 4.680 4.203 3.850 4.488 . 0 0 "[ . 1 . 2]" 1 473 1 32 TRP HE1 1 36 LYS HD3 . . 5.500 5.367 5.158 5.503 0.003 7 0 "[ . 1 . 2]" 1 474 1 32 TRP HE1 1 36 LYS HE2 . . 3.810 2.966 2.690 3.200 . 0 0 "[ . 1 . 2]" 1 475 1 32 TRP HE1 1 36 LYS HE3 . . 3.870 3.493 2.980 3.857 . 0 0 "[ . 1 . 2]" 1 476 1 32 TRP HE1 1 36 LYS HG3 . . 5.260 5.059 4.619 5.260 0.000 10 0 "[ . 1 . 2]" 1 477 1 32 TRP HE1 1 80 GLN HE21 . . 5.040 4.386 3.800 4.931 . 0 0 "[ . 1 . 2]" 1 478 1 32 TRP HE1 1 80 GLN QE . . 4.410 3.644 2.451 4.414 0.004 15 0 "[ . 1 . 2]" 1 479 1 32 TRP HE1 1 80 GLN HE22 . . 5.040 3.946 2.472 4.978 . 0 0 "[ . 1 . 2]" 1 480 1 32 TRP HE1 1 80 GLN QG . . 4.510 3.924 3.096 4.509 . 0 0 "[ . 1 . 2]" 1 481 1 32 TRP HE3 1 33 LEU H . . 3.640 2.922 2.630 3.293 . 0 0 "[ . 1 . 2]" 1 482 1 32 TRP HE3 1 33 LEU HA . . 3.880 2.985 2.616 3.478 . 0 0 "[ . 1 . 2]" 1 483 1 32 TRP HE3 1 33 LEU MD1 . . 4.690 3.791 3.680 3.905 . 0 0 "[ . 1 . 2]" 1 484 1 32 TRP HE3 1 33 LEU MD2 . . 3.370 2.181 1.927 2.424 . 0 0 "[ . 1 . 2]" 1 485 1 32 TRP HE3 1 33 LEU HG . . 3.740 2.246 2.023 2.489 . 0 0 "[ . 1 . 2]" 1 486 1 32 TRP HE3 1 54 LEU MD2 . . 4.690 3.381 3.111 3.802 . 0 0 "[ . 1 . 2]" 1 487 1 32 TRP HH2 1 33 LEU MD2 . . 4.440 4.037 3.863 4.166 . 0 0 "[ . 1 . 2]" 1 488 1 32 TRP HH2 1 73 VAL MG1 . . 4.420 3.257 2.707 3.757 . 0 0 "[ . 1 . 2]" 1 489 1 32 TRP HH2 1 76 GLN HB2 . . 4.040 3.041 2.594 3.469 . 0 0 "[ . 1 . 2]" 1 490 1 32 TRP HH2 1 76 GLN HB3 . . 4.070 3.395 2.710 4.059 . 0 0 "[ . 1 . 2]" 1 491 1 32 TRP HH2 1 77 LEU H . . 4.110 3.339 2.780 3.835 . 0 0 "[ . 1 . 2]" 1 492 1 32 TRP HH2 1 77 LEU HA . . 4.440 2.905 2.332 3.699 . 0 0 "[ . 1 . 2]" 1 493 1 32 TRP HH2 1 77 LEU QD . . 3.800 2.740 2.189 3.312 . 0 0 "[ . 1 . 2]" 1 494 1 32 TRP HH2 1 77 LEU HG . . 4.250 2.337 2.001 2.828 . 0 0 "[ . 1 . 2]" 1 495 1 32 TRP HZ2 1 33 LEU MD2 . . 5.500 5.433 5.256 5.504 0.004 8 0 "[ . 1 . 2]" 1 496 1 32 TRP HZ2 1 36 LYS HD2 . . 5.240 4.988 4.292 5.231 . 0 0 "[ . 1 . 2]" 1 497 1 32 TRP HZ2 1 36 LYS HE2 . . 4.110 3.530 2.453 4.096 . 0 0 "[ . 1 . 2]" 1 498 1 32 TRP HZ2 1 36 LYS HE3 . . 3.800 2.759 2.293 3.557 . 0 0 "[ . 1 . 2]" 1 499 1 32 TRP HZ2 1 36 LYS HG3 . . 4.700 4.170 3.783 4.677 . 0 0 "[ . 1 . 2]" 1 500 1 32 TRP HZ2 1 76 GLN HB2 . . 4.440 4.055 3.752 4.438 . 0 0 "[ . 1 . 2]" 1 501 1 32 TRP HZ2 1 76 GLN HB3 . . 4.440 3.195 2.777 3.611 . 0 0 "[ . 1 . 2]" 1 502 1 32 TRP HZ2 1 77 LEU HA . . 4.690 3.297 2.745 3.843 . 0 0 "[ . 1 . 2]" 1 503 1 32 TRP HZ2 1 77 LEU QD . . 4.480 3.663 3.015 4.107 . 0 0 "[ . 1 . 2]" 1 504 1 32 TRP HZ2 1 80 GLN H . . 5.290 4.781 4.404 5.228 . 0 0 "[ . 1 . 2]" 1 505 1 32 TRP HZ2 1 80 GLN HB2 . . 4.550 3.380 2.948 3.732 . 0 0 "[ . 1 . 2]" 1 506 1 32 TRP HZ2 1 80 GLN HB3 . . 5.020 4.424 3.998 4.994 . 0 0 "[ . 1 . 2]" 1 507 1 32 TRP HZ3 1 33 LEU MD2 . . 3.370 2.036 1.907 2.336 . 0 0 "[ . 1 . 2]" 1 508 1 32 TRP HZ3 1 54 LEU MD2 . . 4.400 3.470 3.016 3.845 . 0 0 "[ . 1 . 2]" 1 509 1 32 TRP HZ3 1 73 VAL MG1 . . 4.160 2.870 2.614 3.286 . 0 0 "[ . 1 . 2]" 1 510 1 32 TRP HZ3 1 77 LEU QD . . 4.080 2.778 2.302 3.452 . 0 0 "[ . 1 . 2]" 1 511 1 32 TRP HZ3 1 77 LEU HG . . 4.940 3.064 2.538 3.692 . 0 0 "[ . 1 . 2]" 1 512 1 33 LEU H 1 33 LEU HB2 . . 3.240 2.608 2.548 2.667 . 0 0 "[ . 1 . 2]" 1 513 1 33 LEU H 1 33 LEU HB3 . . 3.790 3.585 3.576 3.593 . 0 0 "[ . 1 . 2]" 1 514 1 33 LEU H 1 33 LEU MD1 . . 3.600 3.231 3.091 3.362 . 0 0 "[ . 1 . 2]" 1 515 1 33 LEU H 1 33 LEU MD2 . . 3.930 3.470 3.318 3.594 . 0 0 "[ . 1 . 2]" 1 516 1 33 LEU H 1 33 LEU HG . . 2.950 2.032 1.929 2.135 . 0 0 "[ . 1 . 2]" 1 517 1 33 LEU H 1 34 GLU H . . 3.320 2.835 2.638 2.963 . 0 0 "[ . 1 . 2]" 1 518 1 33 LEU H 1 34 GLU HB2 . . 4.910 4.640 4.481 4.867 . 0 0 "[ . 1 . 2]" 1 519 1 33 LEU H 1 35 ALA H . . 4.580 4.096 3.956 4.256 . 0 0 "[ . 1 . 2]" 1 520 1 33 LEU H 1 42 ILE MD . . 5.500 5.007 4.713 5.398 . 0 0 "[ . 1 . 2]" 1 521 1 33 LEU H 1 43 VAL MG1 . . 4.980 4.582 4.350 4.808 . 0 0 "[ . 1 . 2]" 1 522 1 33 LEU H 1 43 VAL MG2 . . 4.810 4.486 4.263 4.762 . 0 0 "[ . 1 . 2]" 1 523 1 33 LEU HA 1 33 LEU MD1 . . 4.340 3.957 3.941 3.975 . 0 0 "[ . 1 . 2]" 1 524 1 33 LEU HA 1 33 LEU MD2 . . 3.170 2.354 2.147 2.638 . 0 0 "[ . 1 . 2]" 1 525 1 33 LEU HA 1 33 LEU HG . . 3.710 2.991 2.908 3.111 . 0 0 "[ . 1 . 2]" 1 526 1 33 LEU HA 1 35 ALA H . . 4.390 4.266 4.105 4.393 0.003 18 0 "[ . 1 . 2]" 1 527 1 33 LEU HA 1 36 LYS H . . 3.700 3.481 3.334 3.627 . 0 0 "[ . 1 . 2]" 1 528 1 33 LEU HA 1 36 LYS HB2 . . 4.510 3.391 3.069 3.635 . 0 0 "[ . 1 . 2]" 1 529 1 33 LEU HA 1 36 LYS HB3 . . 5.170 4.937 4.649 5.159 . 0 0 "[ . 1 . 2]" 1 530 1 33 LEU HA 1 36 LYS HG2 . . 4.520 3.386 3.019 3.812 . 0 0 "[ . 1 . 2]" 1 531 1 33 LEU HA 1 38 PHE QD . . 3.350 2.854 2.415 3.278 . 0 0 "[ . 1 . 2]" 1 532 1 33 LEU HA 1 38 PHE QE . . 4.180 3.475 2.656 4.148 . 0 0 "[ . 1 . 2]" 1 533 1 33 LEU HA 1 42 ILE MD . . 4.230 3.752 3.418 4.111 . 0 0 "[ . 1 . 2]" 1 534 1 33 LEU HB2 1 33 LEU MD1 . . 3.300 2.136 1.990 2.272 . 0 0 "[ . 1 . 2]" 1 535 1 33 LEU HB2 1 34 GLU H . . 3.330 2.222 2.081 2.427 . 0 0 "[ . 1 . 2]" 1 536 1 33 LEU HB2 1 38 PHE QD . . 5.250 4.594 4.056 5.034 . 0 0 "[ . 1 . 2]" 1 537 1 33 LEU HB2 1 43 VAL HA . . 4.110 2.959 2.768 3.222 . 0 0 "[ . 1 . 2]" 1 538 1 33 LEU HB2 1 43 VAL MG1 . . 3.640 2.784 2.574 3.025 . 0 0 "[ . 1 . 2]" 1 539 1 33 LEU HB2 1 43 VAL MG2 . . 3.370 2.263 1.991 2.670 . 0 0 "[ . 1 . 2]" 1 540 1 33 LEU HB3 1 33 LEU MD1 . . 3.470 2.588 2.470 2.686 . 0 0 "[ . 1 . 2]" 1 541 1 33 LEU HB3 1 33 LEU MD2 . . 3.450 2.192 2.026 2.311 . 0 0 "[ . 1 . 2]" 1 542 1 33 LEU HB3 1 34 GLU H . . 3.680 3.439 3.296 3.613 . 0 0 "[ . 1 . 2]" 1 543 1 33 LEU HB3 1 38 PHE H . . 4.580 4.462 4.251 4.581 0.001 20 0 "[ . 1 . 2]" 1 544 1 33 LEU HB3 1 38 PHE QD . . 4.180 3.039 2.450 3.478 . 0 0 "[ . 1 . 2]" 1 545 1 33 LEU HB3 1 42 ILE MD . . 4.610 2.096 1.852 2.498 . 0 0 "[ . 1 . 2]" 1 546 1 33 LEU HB3 1 43 VAL HA . . 4.140 3.155 2.931 3.341 . 0 0 "[ . 1 . 2]" 1 547 1 33 LEU HB3 1 43 VAL MG1 . . 4.590 3.877 3.672 4.122 . 0 0 "[ . 1 . 2]" 1 548 1 33 LEU HB3 1 43 VAL MG2 . . 3.360 2.303 1.970 2.792 . 0 0 "[ . 1 . 2]" 1 549 1 33 LEU MD1 1 34 GLU H . . 4.810 3.874 3.651 4.102 . 0 0 "[ . 1 . 2]" 1 550 1 33 LEU MD1 1 38 PHE QD . . 5.500 4.871 4.305 5.245 . 0 0 "[ . 1 . 2]" 1 551 1 33 LEU MD1 1 42 ILE MD . . 3.610 2.483 2.055 3.158 . 0 0 "[ . 1 . 2]" 1 552 1 33 LEU MD1 1 43 VAL HA . . 3.030 1.949 1.828 2.028 . 0 0 "[ . 1 . 2]" 1 553 1 33 LEU MD1 1 45 ASN H . . 5.500 4.815 4.519 5.080 . 0 0 "[ . 1 . 2]" 1 554 1 33 LEU MD1 1 46 LEU H . . 3.590 3.406 3.150 3.594 0.004 8 0 "[ . 1 . 2]" 1 555 1 33 LEU MD1 1 46 LEU HB2 . . 3.340 1.881 1.771 2.026 . 0 0 "[ . 1 . 2]" 1 556 1 33 LEU MD1 1 46 LEU HB3 . . 3.640 2.735 2.284 3.113 . 0 0 "[ . 1 . 2]" 1 557 1 33 LEU MD1 1 46 LEU MD1 . . 3.990 2.979 2.504 3.492 . 0 0 "[ . 1 . 2]" 1 558 1 33 LEU MD1 1 46 LEU HG . . 4.160 3.764 3.388 4.122 . 0 0 "[ . 1 . 2]" 1 559 1 33 LEU MD1 1 47 GLY H . . 3.420 3.216 2.905 3.396 . 0 0 "[ . 1 . 2]" 1 560 1 33 LEU MD1 1 47 GLY HA2 . . 4.000 2.760 2.472 3.077 . 0 0 "[ . 1 . 2]" 1 561 1 33 LEU MD1 1 47 GLY HA3 . . 3.510 3.303 2.967 3.510 0.000 10 0 "[ . 1 . 2]" 1 562 1 33 LEU MD1 1 54 LEU MD2 . . 4.370 3.345 2.980 3.739 . 0 0 "[ . 1 . 2]" 1 563 1 33 LEU MD2 1 38 PHE QD . . 3.400 2.915 2.455 3.331 . 0 0 "[ . 1 . 2]" 1 564 1 33 LEU MD2 1 38 PHE QE . . 4.070 3.413 2.613 4.047 . 0 0 "[ . 1 . 2]" 1 565 1 33 LEU MD2 1 46 LEU HB2 . . 4.250 2.749 2.371 3.139 . 0 0 "[ . 1 . 2]" 1 566 1 33 LEU MD2 1 54 LEU MD2 . . 3.090 2.710 2.488 2.939 . 0 0 "[ . 1 . 2]" 1 567 1 33 LEU MD2 1 73 VAL HA . . 5.340 4.902 4.444 5.273 . 0 0 "[ . 1 . 2]" 1 568 1 33 LEU MD2 1 73 VAL MG2 . . 4.170 3.511 3.217 3.858 . 0 0 "[ . 1 . 2]" 1 569 1 33 LEU MD2 1 77 LEU QD . . 4.550 3.377 3.072 3.703 . 0 0 "[ . 1 . 2]" 1 570 1 33 LEU HG 1 34 GLU H . . 4.200 4.120 3.969 4.192 . 0 0 "[ . 1 . 2]" 1 571 1 33 LEU HG 1 54 LEU MD2 . . 5.210 3.699 3.406 3.971 . 0 0 "[ . 1 . 2]" 1 572 1 34 GLU H 1 34 GLU HB2 . . 3.050 2.292 2.211 2.472 . 0 0 "[ . 1 . 2]" 1 573 1 34 GLU H 1 34 GLU HB3 . . 3.610 3.547 3.509 3.594 . 0 0 "[ . 1 . 2]" 1 574 1 34 GLU H 1 34 GLU HG2 . . 4.310 3.168 2.703 4.147 . 0 0 "[ . 1 . 2]" 1 575 1 34 GLU H 1 34 GLU QG . . 3.490 2.646 2.224 2.856 . 0 0 "[ . 1 . 2]" 1 576 1 34 GLU H 1 34 GLU HG3 . . 4.310 3.149 2.248 3.952 . 0 0 "[ . 1 . 2]" 1 577 1 34 GLU H 1 35 ALA MB . . 4.550 4.478 4.372 4.556 0.006 6 0 "[ . 1 . 2]" 1 578 1 34 GLU H 1 36 LYS H . . 4.380 4.323 4.185 4.390 0.010 20 0 "[ . 1 . 2]" 1 579 1 34 GLU H 1 43 VAL HA . . 4.980 4.749 4.506 4.969 . 0 0 "[ . 1 . 2]" 1 580 1 34 GLU H 1 43 VAL MG1 . . 4.200 3.088 2.927 3.257 . 0 0 "[ . 1 . 2]" 1 581 1 34 GLU H 1 43 VAL MG2 . . 3.540 2.888 2.705 3.109 . 0 0 "[ . 1 . 2]" 1 582 1 34 GLU HA 1 34 GLU HG2 . . 4.040 2.392 2.158 2.825 . 0 0 "[ . 1 . 2]" 1 583 1 34 GLU HA 1 34 GLU QG . . 3.330 2.317 2.122 2.729 . 0 0 "[ . 1 . 2]" 1 584 1 34 GLU HA 1 34 GLU HG3 . . 4.040 3.313 2.388 3.648 . 0 0 "[ . 1 . 2]" 1 585 1 34 GLU HA 1 36 LYS H . . 4.940 4.163 4.079 4.270 . 0 0 "[ . 1 . 2]" 1 586 1 34 GLU HA 1 37 ALA H . . 3.800 3.158 3.059 3.302 . 0 0 "[ . 1 . 2]" 1 587 1 34 GLU HA 1 38 PHE H . . 4.110 3.957 3.763 4.113 0.003 7 0 "[ . 1 . 2]" 1 588 1 34 GLU HA 1 43 VAL MG1 . . 4.160 3.659 3.393 3.866 . 0 0 "[ . 1 . 2]" 1 589 1 34 GLU HA 1 43 VAL MG2 . . 3.410 2.498 2.217 2.692 . 0 0 "[ . 1 . 2]" 1 590 1 34 GLU HB2 1 35 ALA H . . 3.360 2.803 2.582 2.934 . 0 0 "[ . 1 . 2]" 1 591 1 34 GLU HB2 1 35 ALA MB . . 4.550 4.266 4.071 4.368 . 0 0 "[ . 1 . 2]" 1 592 1 34 GLU HB2 1 36 LYS H . . 5.290 5.158 5.001 5.245 . 0 0 "[ . 1 . 2]" 1 593 1 34 GLU HB2 1 43 VAL MG1 . . 4.750 3.737 3.483 3.909 . 0 0 "[ . 1 . 2]" 1 594 1 34 GLU HB2 1 43 VAL MG2 . . 4.640 4.030 3.804 4.247 . 0 0 "[ . 1 . 2]" 1 595 1 34 GLU HB3 1 35 ALA H . . 3.530 3.367 3.200 3.531 0.001 8 0 "[ . 1 . 2]" 1 596 1 34 GLU HB3 1 36 LYS H . . 5.350 5.295 5.194 5.354 0.004 7 0 "[ . 1 . 2]" 1 597 1 34 GLU HB3 1 37 ALA H . . 4.980 4.827 4.764 4.904 . 0 0 "[ . 1 . 2]" 1 598 1 34 GLU HB3 1 43 VAL MG1 . . 4.890 4.341 4.111 4.589 . 0 0 "[ . 1 . 2]" 1 599 1 34 GLU HB3 1 43 VAL MG2 . . 4.400 4.277 3.978 4.406 0.006 6 0 "[ . 1 . 2]" 1 600 1 34 GLU QG 1 35 ALA H . . 4.490 4.328 4.161 4.399 . 0 0 "[ . 1 . 2]" 1 601 1 34 GLU QG 1 43 VAL MG1 . . 2.970 1.853 1.720 2.011 . 0 0 "[ . 1 . 2]" 1 602 1 34 GLU HG2 1 35 ALA H . . 5.120 4.879 4.736 5.126 0.006 18 0 "[ . 1 . 2]" 1 603 1 34 GLU HG2 1 43 VAL MG1 . . 3.600 2.150 1.848 2.960 . 0 0 "[ . 1 . 2]" 1 604 1 34 GLU HG2 1 43 VAL MG2 . . 4.040 2.361 1.975 3.270 . 0 0 "[ . 1 . 2]" 1 605 1 34 GLU HG3 1 35 ALA H . . 5.120 4.872 4.439 5.119 . 0 0 "[ . 1 . 2]" 1 606 1 34 GLU HG3 1 43 VAL MG1 . . 3.600 2.335 1.807 3.399 . 0 0 "[ . 1 . 2]" 1 607 1 34 GLU HG3 1 43 VAL MG2 . . 4.040 3.243 2.239 4.008 . 0 0 "[ . 1 . 2]" 1 608 1 35 ALA H 1 35 ALA MB . . 2.710 2.197 2.161 2.218 . 0 0 "[ . 1 . 2]" 1 609 1 35 ALA H 1 36 LYS H . . 3.160 2.756 2.607 2.844 . 0 0 "[ . 1 . 2]" 1 610 1 35 ALA H 1 36 LYS HB2 . . 5.350 5.118 4.952 5.213 . 0 0 "[ . 1 . 2]" 1 611 1 35 ALA H 1 36 LYS HG2 . . 4.770 4.268 4.049 4.485 . 0 0 "[ . 1 . 2]" 1 612 1 35 ALA H 1 37 ALA H . . 4.430 3.947 3.889 4.038 . 0 0 "[ . 1 . 2]" 1 613 1 35 ALA H 1 43 VAL MG1 . . 5.500 5.430 5.220 5.509 0.009 20 0 "[ . 1 . 2]" 1 614 1 35 ALA H 1 43 VAL MG2 . . 5.160 4.900 4.730 5.057 . 0 0 "[ . 1 . 2]" 1 615 1 35 ALA HA 1 37 ALA H . . 4.470 4.092 3.851 4.228 . 0 0 "[ . 1 . 2]" 1 616 1 35 ALA MB 1 36 LYS H . . 3.240 2.604 2.520 2.753 . 0 0 "[ . 1 . 2]" 1 617 1 35 ALA MB 1 36 LYS HA . . 4.550 3.849 3.790 3.896 . 0 0 "[ . 1 . 2]" 1 618 1 35 ALA MB 1 36 LYS HG2 . . 4.510 2.941 2.801 3.067 . 0 0 "[ . 1 . 2]" 1 619 1 35 ALA MB 1 37 ALA H . . 4.340 4.323 4.270 4.349 0.009 20 0 "[ . 1 . 2]" 1 620 1 36 LYS H 1 36 LYS HB2 . . 3.020 2.573 2.520 2.676 . 0 0 "[ . 1 . 2]" 1 621 1 36 LYS H 1 36 LYS HB3 . . 3.910 3.615 3.600 3.631 . 0 0 "[ . 1 . 2]" 1 622 1 36 LYS H 1 36 LYS HD2 . . 4.800 4.549 4.407 4.725 . 0 0 "[ . 1 . 2]" 1 623 1 36 LYS H 1 36 LYS HD3 . . 4.250 3.679 3.333 4.002 . 0 0 "[ . 1 . 2]" 1 624 1 36 LYS H 1 36 LYS HE2 . . 4.830 4.646 4.192 4.829 . 0 0 "[ . 1 . 2]" 1 625 1 36 LYS H 1 36 LYS HE3 . . 5.430 5.277 5.037 5.430 0.000 5 0 "[ . 1 . 2]" 1 626 1 36 LYS H 1 36 LYS HG2 . . 3.220 2.131 1.929 2.260 . 0 0 "[ . 1 . 2]" 1 627 1 36 LYS H 1 36 LYS HG3 . . 3.680 3.504 3.307 3.681 0.001 16 0 "[ . 1 . 2]" 1 628 1 36 LYS H 1 37 ALA H . . 3.100 2.420 2.360 2.519 . 0 0 "[ . 1 . 2]" 1 629 1 36 LYS H 1 37 ALA HA . . 4.870 4.683 4.614 4.784 . 0 0 "[ . 1 . 2]" 1 630 1 36 LYS H 1 37 ALA MB . . 4.630 4.576 4.542 4.605 . 0 0 "[ . 1 . 2]" 1 631 1 36 LYS H 1 38 PHE H . . 4.440 4.261 3.974 4.396 . 0 0 "[ . 1 . 2]" 1 632 1 36 LYS H 1 38 PHE QD . . 4.500 4.320 4.178 4.501 0.001 15 0 "[ . 1 . 2]" 1 633 1 36 LYS HA 1 36 LYS HD2 . . 3.850 3.080 2.839 3.396 . 0 0 "[ . 1 . 2]" 1 634 1 36 LYS HA 1 36 LYS HD3 . . 3.440 2.384 2.061 2.661 . 0 0 "[ . 1 . 2]" 1 635 1 36 LYS HA 1 36 LYS HE2 . . 4.940 4.633 4.292 4.896 . 0 0 "[ . 1 . 2]" 1 636 1 36 LYS HA 1 36 LYS HG2 . . 4.020 3.048 2.890 3.209 . 0 0 "[ . 1 . 2]" 1 637 1 36 LYS HA 1 37 ALA MB . . 4.510 3.847 3.792 3.897 . 0 0 "[ . 1 . 2]" 1 638 1 36 LYS HB2 1 36 LYS HD2 . . 4.200 3.588 3.466 3.729 . 0 0 "[ . 1 . 2]" 1 639 1 36 LYS HB2 1 37 ALA H . . 4.290 3.058 2.900 3.305 . 0 0 "[ . 1 . 2]" 1 640 1 36 LYS HB2 1 38 PHE H . . 4.310 3.143 2.993 3.310 . 0 0 "[ . 1 . 2]" 1 641 1 36 LYS HB2 1 38 PHE QD . . 4.000 2.478 2.034 2.770 . 0 0 "[ . 1 . 2]" 1 642 1 36 LYS HB2 1 38 PHE QE . . 4.040 2.785 2.645 2.995 . 0 0 "[ . 1 . 2]" 1 643 1 36 LYS HB3 1 36 LYS HD2 . . 4.070 2.335 2.165 2.554 . 0 0 "[ . 1 . 2]" 1 644 1 36 LYS HB3 1 37 ALA H . . 4.210 4.081 3.965 4.211 0.001 19 0 "[ . 1 . 2]" 1 645 1 36 LYS HB3 1 38 PHE H . . 4.540 4.298 4.065 4.539 . 0 0 "[ . 1 . 2]" 1 646 1 36 LYS HB3 1 38 PHE QD . . 4.340 3.704 3.227 3.985 . 0 0 "[ . 1 . 2]" 1 647 1 36 LYS HB3 1 38 PHE QE . . 4.040 3.154 2.718 3.621 . 0 0 "[ . 1 . 2]" 1 648 1 36 LYS HD2 1 38 PHE QE . . 4.730 3.876 3.226 4.273 . 0 0 "[ . 1 . 2]" 1 649 1 36 LYS HD2 1 76 GLN HG3 . . 4.880 3.407 2.671 4.155 . 0 0 "[ . 1 . 2]" 1 650 1 36 LYS HE2 1 36 LYS HG2 . . 3.830 2.680 2.358 2.925 . 0 0 "[ . 1 . 2]" 1 651 1 36 LYS HE2 1 36 LYS HG3 . . 4.090 2.932 2.432 3.234 . 0 0 "[ . 1 . 2]" 1 652 1 36 LYS HE3 1 36 LYS HG2 . . 4.090 3.206 2.915 3.727 . 0 0 "[ . 1 . 2]" 1 653 1 36 LYS HE3 1 36 LYS HG3 . . 3.800 2.498 2.200 3.593 . 0 0 "[ . 1 . 2]" 1 654 1 36 LYS HG2 1 37 ALA H . . 4.770 4.244 4.051 4.372 . 0 0 "[ . 1 . 2]" 1 655 1 36 LYS HG2 1 38 PHE QE . . 4.940 3.600 3.143 3.965 . 0 0 "[ . 1 . 2]" 1 656 1 36 LYS HG3 1 38 PHE QE . . 4.470 2.098 1.997 2.308 . 0 0 "[ . 1 . 2]" 1 657 1 37 ALA H 1 37 ALA HA . . 2.620 2.279 2.275 2.287 . 0 0 "[ . 1 . 2]" 1 658 1 37 ALA H 1 37 ALA MB . . 3.260 2.895 2.827 2.944 . 0 0 "[ . 1 . 2]" 1 659 1 37 ALA H 1 38 PHE H . . 3.100 2.659 2.522 2.799 . 0 0 "[ . 1 . 2]" 1 660 1 37 ALA H 1 38 PHE HB2 . . 4.870 4.700 4.538 4.806 . 0 0 "[ . 1 . 2]" 1 661 1 37 ALA H 1 43 VAL MG2 . . 4.620 4.473 4.296 4.623 0.003 11 0 "[ . 1 . 2]" 1 662 1 37 ALA HA 1 38 PHE H . . 3.120 2.745 2.672 2.836 . 0 0 "[ . 1 . 2]" 1 663 1 37 ALA HA 1 39 SER H . . 4.580 4.412 4.227 4.584 0.004 20 0 "[ . 1 . 2]" 1 664 1 37 ALA MB 1 38 PHE H . . 3.870 3.698 3.669 3.713 . 0 0 "[ . 1 . 2]" 1 665 1 38 PHE H 1 38 PHE HB2 . . 2.960 2.263 2.198 2.386 . 0 0 "[ . 1 . 2]" 1 666 1 38 PHE H 1 38 PHE HB3 . . 3.610 3.538 3.503 3.577 . 0 0 "[ . 1 . 2]" 1 667 1 38 PHE H 1 38 PHE QD . . 3.290 3.006 2.903 3.145 . 0 0 "[ . 1 . 2]" 1 668 1 38 PHE H 1 39 SER H . . 4.380 2.907 2.792 3.099 . 0 0 "[ . 1 . 2]" 1 669 1 38 PHE H 1 42 ILE MD . . 4.650 3.579 3.219 3.828 . 0 0 "[ . 1 . 2]" 1 670 1 38 PHE H 1 43 VAL MG2 . . 3.760 3.657 3.466 3.755 . 0 0 "[ . 1 . 2]" 1 671 1 38 PHE HA 1 38 PHE QD . . 3.540 2.438 2.279 2.630 . 0 0 "[ . 1 . 2]" 1 672 1 38 PHE HB2 1 39 SER H . . 3.820 2.274 2.121 2.420 . 0 0 "[ . 1 . 2]" 1 673 1 38 PHE HB2 1 42 ILE MD . . 3.780 1.989 1.819 2.210 . 0 0 "[ . 1 . 2]" 1 674 1 38 PHE HB2 1 42 ILE HG12 . . 4.680 2.511 2.061 2.940 . 0 0 "[ . 1 . 2]" 1 675 1 38 PHE HB2 1 43 VAL MG2 . . 3.720 3.251 3.045 3.448 . 0 0 "[ . 1 . 2]" 1 676 1 38 PHE HB3 1 39 SER H . . 3.440 2.792 2.578 2.905 . 0 0 "[ . 1 . 2]" 1 677 1 38 PHE HB3 1 42 ILE H . . 5.450 5.125 4.966 5.262 . 0 0 "[ . 1 . 2]" 1 678 1 38 PHE HB3 1 42 ILE HB . . 4.280 4.293 4.273 4.332 0.052 16 0 "[ . 1 . 2]" 1 679 1 38 PHE HB3 1 42 ILE MD . . 3.590 2.739 2.310 3.087 . 0 0 "[ . 1 . 2]" 1 680 1 38 PHE HB3 1 42 ILE HG12 . . 4.490 1.995 1.974 2.016 . 0 0 "[ . 1 . 2]" 1 681 1 38 PHE HB3 1 42 ILE HG13 . . 4.870 3.498 3.348 3.607 . 0 0 "[ . 1 . 2]" 1 682 1 38 PHE HB3 1 42 ILE MG . . 3.940 3.265 2.963 3.535 . 0 0 "[ . 1 . 2]" 1 683 1 38 PHE HB3 1 43 VAL H . . 5.500 5.393 5.214 5.497 . 0 0 "[ . 1 . 2]" 1 684 1 38 PHE HB3 1 43 VAL MG2 . . 4.520 4.341 4.081 4.526 0.006 10 0 "[ . 1 . 2]" 1 685 1 38 PHE QD 1 39 SER H . . 4.510 4.183 4.048 4.291 . 0 0 "[ . 1 . 2]" 1 686 1 38 PHE QD 1 42 ILE MD . . 3.760 2.616 2.193 2.986 . 0 0 "[ . 1 . 2]" 1 687 1 38 PHE QD 1 43 VAL MG2 . . 4.910 4.044 3.680 4.304 . 0 0 "[ . 1 . 2]" 1 688 1 38 PHE QD 1 69 GLU HG2 . . 4.510 3.238 2.568 4.195 . 0 0 "[ . 1 . 2]" 1 689 1 38 PHE QD 1 69 GLU QG . . 3.730 2.486 1.957 3.732 0.002 12 0 "[ . 1 . 2]" 1 690 1 38 PHE QD 1 69 GLU HG3 . . 4.510 2.625 2.022 4.415 . 0 0 "[ . 1 . 2]" 1 691 1 38 PHE QD 1 72 ARG QB . . 4.170 3.118 2.557 3.624 . 0 0 "[ . 1 . 2]" 1 692 1 38 PHE QD 1 73 VAL MG2 . . 4.050 2.677 2.309 3.354 . 0 0 "[ . 1 . 2]" 1 693 1 38 PHE QE 1 72 ARG H . . 5.170 4.805 4.416 5.168 . 0 0 "[ . 1 . 2]" 1 694 1 38 PHE QE 1 72 ARG HB2 . . 4.370 3.845 2.493 4.373 0.003 9 0 "[ . 1 . 2]" 1 695 1 38 PHE QE 1 72 ARG QB . . 3.630 2.375 1.921 2.963 . 0 0 "[ . 1 . 2]" 1 696 1 38 PHE QE 1 72 ARG HB3 . . 4.370 2.401 1.998 3.024 . 0 0 "[ . 1 . 2]" 1 697 1 38 PHE QE 1 72 ARG HD2 . . 4.810 3.789 2.446 4.804 . 0 0 "[ . 1 . 2]" 1 698 1 38 PHE QE 1 72 ARG HD3 . . 4.810 3.914 2.171 4.801 . 0 0 "[ . 1 . 2]" 1 699 1 38 PHE QE 1 72 ARG QG . . 4.200 2.238 1.850 3.290 . 0 0 "[ . 1 . 2]" 1 700 1 38 PHE QE 1 73 VAL H . . 4.080 3.431 3.118 3.973 . 0 0 "[ . 1 . 2]" 1 701 1 38 PHE QE 1 73 VAL HA . . 3.970 2.813 2.347 3.497 . 0 0 "[ . 1 . 2]" 1 702 1 38 PHE QE 1 73 VAL MG1 . . 4.440 3.357 3.110 4.127 . 0 0 "[ . 1 . 2]" 1 703 1 38 PHE QE 1 73 VAL MG2 . . 3.790 2.920 2.550 3.416 . 0 0 "[ . 1 . 2]" 1 704 1 38 PHE QE 1 76 GLN H . . 5.500 4.705 4.423 5.142 . 0 0 "[ . 1 . 2]" 1 705 1 38 PHE QE 1 76 GLN HB2 . . 4.660 3.488 3.137 3.907 . 0 0 "[ . 1 . 2]" 1 706 1 38 PHE QE 1 76 GLN HG2 . . 5.350 3.373 2.521 3.965 . 0 0 "[ . 1 . 2]" 1 707 1 38 PHE QE 1 76 GLN HG3 . . 4.250 3.283 2.765 3.868 . 0 0 "[ . 1 . 2]" 1 708 1 38 PHE HZ 1 72 ARG QG . . 4.680 3.746 2.961 4.679 . 0 0 "[ . 1 . 2]" 1 709 1 38 PHE HZ 1 73 VAL H . . 4.910 4.600 3.903 4.908 . 0 0 "[ . 1 . 2]" 1 710 1 38 PHE HZ 1 73 VAL HA . . 3.360 2.452 2.195 3.099 . 0 0 "[ . 1 . 2]" 1 711 1 38 PHE HZ 1 73 VAL MG1 . . 4.690 3.813 3.365 4.661 . 0 0 "[ . 1 . 2]" 1 712 1 38 PHE HZ 1 73 VAL MG2 . . 4.230 3.649 3.238 3.972 . 0 0 "[ . 1 . 2]" 1 713 1 38 PHE HZ 1 76 GLN H . . 4.250 4.004 3.699 4.252 0.002 15 0 "[ . 1 . 2]" 1 714 1 38 PHE HZ 1 76 GLN HB2 . . 3.960 2.375 2.000 3.141 . 0 0 "[ . 1 . 2]" 1 715 1 38 PHE HZ 1 76 GLN HB3 . . 4.550 3.283 2.744 4.020 . 0 0 "[ . 1 . 2]" 1 716 1 38 PHE HZ 1 76 GLN HG2 . . 4.180 2.622 1.999 3.426 . 0 0 "[ . 1 . 2]" 1 717 1 38 PHE HZ 1 76 GLN HG3 . . 3.790 2.167 1.998 2.869 . 0 0 "[ . 1 . 2]" 1 718 1 39 SER H 1 39 SER QB . . 3.700 3.116 2.879 3.436 . 0 0 "[ . 1 . 2]" 1 719 1 39 SER H 1 42 ILE H . . 5.040 4.348 4.074 4.487 . 0 0 "[ . 1 . 2]" 1 720 1 39 SER H 1 42 ILE HB . . 5.280 5.153 4.988 5.278 . 0 0 "[ . 1 . 2]" 1 721 1 39 SER H 1 42 ILE MD . . 4.620 2.823 2.140 3.281 . 0 0 "[ . 1 . 2]" 1 722 1 39 SER H 1 42 ILE HG12 . . 4.310 2.717 2.467 2.899 . 0 0 "[ . 1 . 2]" 1 723 1 39 SER H 1 42 ILE MG . . 4.340 4.025 3.628 4.349 0.009 20 0 "[ . 1 . 2]" 1 724 1 39 SER HA 1 40 PRO HD2 . . 3.360 2.413 2.327 2.531 . 0 0 "[ . 1 . 2]" 1 725 1 39 SER HA 1 40 PRO HD3 . . 3.360 2.304 2.273 2.358 . 0 0 "[ . 1 . 2]" 1 726 1 39 SER HA 1 40 PRO HG2 . . 4.640 4.523 4.453 4.620 . 0 0 "[ . 1 . 2]" 1 727 1 39 SER HA 1 40 PRO HG3 . . 4.810 4.479 4.428 4.555 . 0 0 "[ . 1 . 2]" 1 728 1 39 SER HA 1 42 ILE H . . 4.980 4.827 4.626 5.003 0.023 7 0 "[ . 1 . 2]" 1 729 1 39 SER QB 1 40 PRO QD . . 3.510 2.229 1.929 2.949 . 0 0 "[ . 1 . 2]" 1 730 1 39 SER QB 1 40 PRO HG2 . . 4.410 3.865 3.557 4.543 0.133 13 0 "[ . 1 . 2]" 1 731 1 39 SER QB 1 41 ARG H . . 4.230 2.319 2.172 3.413 . 0 0 "[ . 1 . 2]" 1 732 1 39 SER QB 1 42 ILE H . . 3.990 2.663 2.087 3.144 . 0 0 "[ . 1 . 2]" 1 733 1 39 SER QB 1 42 ILE MG . . 4.260 2.442 1.879 3.492 . 0 0 "[ . 1 . 2]" 1 734 1 39 SER QB 1 43 VAL H . . 4.530 4.168 3.705 4.565 0.035 16 0 "[ . 1 . 2]" 1 735 1 39 SER HB2 1 42 ILE MG . . 4.940 2.658 1.963 3.728 . 0 0 "[ . 1 . 2]" 1 736 1 39 SER HB3 1 42 ILE MG . . 4.940 3.220 1.976 4.242 . 0 0 "[ . 1 . 2]" 1 737 1 40 PRO HA 1 43 VAL H . . 4.040 3.890 3.724 4.034 . 0 0 "[ . 1 . 2]" 1 738 1 40 PRO HA 1 43 VAL HB . . 3.600 2.959 2.670 3.214 . 0 0 "[ . 1 . 2]" 1 739 1 40 PRO HA 1 43 VAL MG1 . . 4.370 4.113 3.870 4.356 . 0 0 "[ . 1 . 2]" 1 740 1 40 PRO HA 1 43 VAL MG2 . . 3.610 3.404 3.006 3.622 0.012 20 0 "[ . 1 . 2]" 1 741 1 40 PRO HA 1 44 GLU H . . 4.640 4.354 4.002 4.643 0.003 11 0 "[ . 1 . 2]" 1 742 1 40 PRO QD 1 41 ARG H . . 4.300 2.739 2.651 2.855 . 0 0 "[ . 1 . 2]" 1 743 1 40 PRO QD 1 41 ARG HB2 . . 5.120 4.068 3.986 4.219 . 0 0 "[ . 1 . 2]" 1 744 1 40 PRO HG2 1 41 ARG HB2 . . 4.080 3.619 3.448 4.078 . 0 0 "[ . 1 . 2]" 1 745 1 40 PRO HG3 1 41 ARG H . . 5.110 4.306 4.129 4.499 . 0 0 "[ . 1 . 2]" 1 746 1 41 ARG H 1 41 ARG HB2 . . 3.380 2.439 2.249 2.615 . 0 0 "[ . 1 . 2]" 1 747 1 41 ARG H 1 41 ARG HB3 . . 3.670 2.892 2.650 3.510 . 0 0 "[ . 1 . 2]" 1 748 1 41 ARG H 1 41 ARG QG . . 4.580 3.960 3.293 4.113 . 0 0 "[ . 1 . 2]" 1 749 1 41 ARG H 1 42 ILE H . . 3.660 2.353 2.205 2.559 . 0 0 "[ . 1 . 2]" 1 750 1 41 ARG HA 1 41 ARG HD2 . . 5.500 3.895 2.000 4.662 . 0 0 "[ . 1 . 2]" 1 751 1 41 ARG HA 1 41 ARG QD . . 4.770 3.371 1.966 4.100 . 0 0 "[ . 1 . 2]" 1 752 1 41 ARG HA 1 41 ARG HD3 . . 5.500 3.890 2.005 4.707 . 0 0 "[ . 1 . 2]" 1 753 1 41 ARG HA 1 41 ARG HG2 . . 4.180 3.209 2.710 3.710 . 0 0 "[ . 1 . 2]" 1 754 1 41 ARG HA 1 41 ARG QG . . 3.660 2.336 2.141 2.807 . 0 0 "[ . 1 . 2]" 1 755 1 41 ARG HA 1 41 ARG HG3 . . 4.180 2.411 2.177 2.907 . 0 0 "[ . 1 . 2]" 1 756 1 41 ARG HA 1 44 GLU H . . 3.880 3.583 3.338 3.705 . 0 0 "[ . 1 . 2]" 1 757 1 41 ARG HA 1 44 GLU QG . . 4.640 4.154 3.732 4.622 . 0 0 "[ . 1 . 2]" 1 758 1 41 ARG HA 1 45 ASN H . . 4.340 4.139 3.969 4.257 . 0 0 "[ . 1 . 2]" 1 759 1 41 ARG HA 1 45 ASN HD21 . . 4.650 3.411 2.929 3.940 . 0 0 "[ . 1 . 2]" 1 760 1 41 ARG HA 1 45 ASN HD22 . . 4.920 3.993 3.324 4.485 . 0 0 "[ . 1 . 2]" 1 761 1 41 ARG HB2 1 42 ILE H . . 3.880 3.421 2.635 3.669 . 0 0 "[ . 1 . 2]" 1 762 1 41 ARG HB3 1 42 ILE H . . 3.550 2.563 2.333 3.257 . 0 0 "[ . 1 . 2]" 1 763 1 41 ARG HB3 1 42 ILE MG . . 4.440 3.067 2.736 3.656 . 0 0 "[ . 1 . 2]" 1 764 1 41 ARG HB3 1 45 ASN H . . 5.500 5.386 4.966 5.516 0.016 20 0 "[ . 1 . 2]" 1 765 1 41 ARG HB3 1 45 ASN HD21 . . 4.890 3.487 2.508 4.686 . 0 0 "[ . 1 . 2]" 1 766 1 41 ARG QD 1 42 ILE MG . . 5.340 4.834 3.891 5.394 0.054 20 0 "[ . 1 . 2]" 1 767 1 41 ARG QD 1 45 ASN HD21 . . 5.340 4.158 2.555 5.341 0.001 5 0 "[ . 1 . 2]" 1 768 1 41 ARG QG 1 42 ILE H . . 4.870 4.008 3.700 4.448 . 0 0 "[ . 1 . 2]" 1 769 1 41 ARG QG 1 42 ILE MG . . 5.080 4.225 3.812 4.938 . 0 0 "[ . 1 . 2]" 1 770 1 41 ARG QG 1 45 ASN HD21 . . 4.100 2.373 1.884 3.843 . 0 0 "[ . 1 . 2]" 1 771 1 41 ARG QG 1 45 ASN HD22 . . 4.100 2.382 1.813 3.547 . 0 0 "[ . 1 . 2]" 1 772 1 41 ARG HG2 1 45 ASN HD21 . . 4.970 2.870 1.962 4.471 . 0 0 "[ . 1 . 2]" 1 773 1 41 ARG HG2 1 45 ASN HD22 . . 4.770 2.828 1.968 4.164 . 0 0 "[ . 1 . 2]" 1 774 1 41 ARG HG3 1 45 ASN HD21 . . 4.970 3.155 1.898 4.968 . 0 0 "[ . 1 . 2]" 1 775 1 41 ARG HG3 1 45 ASN HD22 . . 4.770 2.979 2.069 4.770 . 18 0 "[ . 1 . 2]" 1 776 1 42 ILE H 1 42 ILE HB . . 3.680 3.610 3.594 3.625 . 0 0 "[ . 1 . 2]" 1 777 1 42 ILE H 1 42 ILE MD . . 3.910 3.814 3.536 3.911 0.001 13 0 "[ . 1 . 2]" 1 778 1 42 ILE H 1 42 ILE HG12 . . 3.510 3.349 3.166 3.479 . 0 0 "[ . 1 . 2]" 1 779 1 42 ILE H 1 42 ILE HG13 . . 3.920 2.334 1.936 2.502 . 0 0 "[ . 1 . 2]" 1 780 1 42 ILE H 1 42 ILE MG . . 3.480 2.058 1.871 2.392 . 0 0 "[ . 1 . 2]" 1 781 1 42 ILE H 1 43 VAL H . . 2.990 2.602 2.500 2.707 . 0 0 "[ . 1 . 2]" 1 782 1 42 ILE H 1 43 VAL HB . . 4.960 4.762 4.557 4.907 . 0 0 "[ . 1 . 2]" 1 783 1 42 ILE H 1 43 VAL MG2 . . 5.210 4.184 3.948 4.458 . 0 0 "[ . 1 . 2]" 1 784 1 42 ILE H 1 44 GLU H . . 4.380 4.205 3.999 4.363 . 0 0 "[ . 1 . 2]" 1 785 1 42 ILE HA 1 42 ILE MD . . 3.790 3.552 3.466 3.650 . 0 0 "[ . 1 . 2]" 1 786 1 42 ILE HA 1 42 ILE HG12 . . 4.250 4.225 4.197 4.238 . 0 0 "[ . 1 . 2]" 1 787 1 42 ILE HA 1 42 ILE HG13 . . 3.800 3.588 3.558 3.613 . 0 0 "[ . 1 . 2]" 1 788 1 42 ILE HA 1 42 ILE MG . . 3.540 2.405 2.222 2.536 . 0 0 "[ . 1 . 2]" 1 789 1 42 ILE HA 1 44 GLU H . . 4.980 4.337 3.898 4.650 . 0 0 "[ . 1 . 2]" 1 790 1 42 ILE HA 1 45 ASN H . . 3.870 3.319 3.125 3.477 . 0 0 "[ . 1 . 2]" 1 791 1 42 ILE HA 1 45 ASN HB2 . . 3.920 2.372 2.189 2.566 . 0 0 "[ . 1 . 2]" 1 792 1 42 ILE HA 1 45 ASN HB3 . . 4.550 3.788 3.650 4.104 . 0 0 "[ . 1 . 2]" 1 793 1 42 ILE HA 1 45 ASN HD21 . . 4.370 3.269 2.723 4.080 . 0 0 "[ . 1 . 2]" 1 794 1 42 ILE HA 1 46 LEU H . . 4.070 3.629 3.384 3.839 . 0 0 "[ . 1 . 2]" 1 795 1 42 ILE HA 1 46 LEU MD1 . . 4.270 3.678 3.394 3.950 . 0 0 "[ . 1 . 2]" 1 796 1 42 ILE HA 1 46 LEU HG . . 4.280 2.935 2.602 3.335 . 0 0 "[ . 1 . 2]" 1 797 1 42 ILE HB 1 42 ILE MD . . 3.120 2.209 2.118 2.274 . 0 0 "[ . 1 . 2]" 1 798 1 42 ILE HB 1 43 VAL H . . 3.990 3.934 3.752 3.992 0.002 1 0 "[ . 1 . 2]" 1 799 1 42 ILE HB 1 46 LEU MD1 . . 3.800 2.452 2.040 2.865 . 0 0 "[ . 1 . 2]" 1 800 1 42 ILE HB 1 73 VAL MG2 . . 4.760 3.229 2.830 3.552 . 0 0 "[ . 1 . 2]" 1 801 1 42 ILE MD 1 42 ILE MG . . 3.260 3.138 3.116 3.177 . 0 0 "[ . 1 . 2]" 1 802 1 42 ILE MD 1 43 VAL H . . 3.740 2.665 2.376 2.863 . 0 0 "[ . 1 . 2]" 1 803 1 42 ILE MD 1 43 VAL HA . . 4.270 2.354 2.089 2.494 . 0 0 "[ . 1 . 2]" 1 804 1 42 ILE MD 1 43 VAL MG2 . . 2.970 1.904 1.790 2.191 . 0 0 "[ . 1 . 2]" 1 805 1 42 ILE MD 1 44 GLU H . . 4.980 4.467 4.351 4.627 . 0 0 "[ . 1 . 2]" 1 806 1 42 ILE MD 1 45 ASN H . . 5.500 4.820 4.682 4.956 . 0 0 "[ . 1 . 2]" 1 807 1 42 ILE MD 1 46 LEU H . . 4.750 4.169 4.004 4.443 . 0 0 "[ . 1 . 2]" 1 808 1 42 ILE MD 1 46 LEU HB2 . . 4.160 3.295 2.936 3.709 . 0 0 "[ . 1 . 2]" 1 809 1 42 ILE MD 1 46 LEU HG . . 4.230 3.649 3.298 4.166 . 0 0 "[ . 1 . 2]" 1 810 1 42 ILE MD 1 66 CYS QB . . 4.980 4.646 4.242 4.987 0.007 20 0 "[ . 1 . 2]" 1 811 1 42 ILE MD 1 73 VAL MG2 . . 3.320 2.744 2.428 3.103 . 0 0 "[ . 1 . 2]" 1 812 1 42 ILE HG12 1 42 ILE MG . . 3.530 2.148 1.998 2.229 . 0 0 "[ . 1 . 2]" 1 813 1 42 ILE HG12 1 43 VAL H . . 4.240 3.689 3.591 3.785 . 0 0 "[ . 1 . 2]" 1 814 1 42 ILE HG12 1 66 CYS QB . . 4.640 4.470 4.316 4.677 0.037 7 0 "[ . 1 . 2]" 1 815 1 42 ILE HG12 1 69 GLU QG . . 4.700 3.219 2.385 4.467 . 0 0 "[ . 1 . 2]" 1 816 1 42 ILE HG12 1 73 VAL MG2 . . 4.280 3.341 3.141 3.834 . 0 0 "[ . 1 . 2]" 1 817 1 42 ILE HG13 1 43 VAL MG2 . . 4.460 2.499 2.188 2.973 . 0 0 "[ . 1 . 2]" 1 818 1 42 ILE HG13 1 66 CYS QB . . 5.340 5.310 5.170 5.344 0.004 10 0 "[ . 1 . 2]" 1 819 1 42 ILE HG13 1 73 VAL MG2 . . 5.170 4.619 4.407 4.995 . 0 0 "[ . 1 . 2]" 1 820 1 42 ILE MG 1 43 VAL H . . 4.940 3.785 3.670 3.967 . 0 0 "[ . 1 . 2]" 1 821 1 42 ILE MG 1 45 ASN H . . 5.500 5.092 4.952 5.211 . 0 0 "[ . 1 . 2]" 1 822 1 42 ILE MG 1 46 LEU HG . . 5.430 4.213 3.862 4.515 . 0 0 "[ . 1 . 2]" 1 823 1 42 ILE MG 1 66 CYS HA . . 4.020 2.290 1.968 2.995 . 0 0 "[ . 1 . 2]" 1 824 1 42 ILE MG 1 66 CYS HB2 . . 3.940 3.057 1.764 3.493 . 0 0 "[ . 1 . 2]" 1 825 1 42 ILE MG 1 66 CYS QB . . 3.250 1.897 1.750 1.984 . 0 0 "[ . 1 . 2]" 1 826 1 42 ILE MG 1 66 CYS HB3 . . 3.940 2.148 1.828 3.143 . 0 0 "[ . 1 . 2]" 1 827 1 42 ILE MG 1 69 GLU HB2 . . 4.140 3.200 2.039 4.148 0.008 11 0 "[ . 1 . 2]" 1 828 1 42 ILE MG 1 69 GLU QB . . 3.330 2.267 1.808 2.949 . 0 0 "[ . 1 . 2]" 1 829 1 42 ILE MG 1 69 GLU HB3 . . 4.140 2.400 1.833 3.018 . 0 0 "[ . 1 . 2]" 1 830 1 42 ILE MG 1 69 GLU QG . . 3.630 2.908 2.138 3.635 0.005 11 0 "[ . 1 . 2]" 1 831 1 42 ILE MG 1 70 GLY H . . 4.490 3.646 3.059 4.081 . 0 0 "[ . 1 . 2]" 1 832 1 42 ILE MG 1 70 GLY HA2 . . 4.590 3.918 3.317 4.453 . 0 0 "[ . 1 . 2]" 1 833 1 42 ILE MG 1 70 GLY HA3 . . 5.430 4.633 4.157 5.142 . 0 0 "[ . 1 . 2]" 1 834 1 42 ILE MG 1 73 VAL H . . 5.500 5.376 4.874 5.504 0.004 15 0 "[ . 1 . 2]" 1 835 1 42 ILE MG 1 73 VAL MG2 . . 3.490 2.962 2.468 3.175 . 0 0 "[ . 1 . 2]" 1 836 1 43 VAL H 1 43 VAL HB . . 3.010 2.421 2.323 2.529 . 0 0 "[ . 1 . 2]" 1 837 1 43 VAL H 1 43 VAL MG1 . . 3.970 3.741 3.699 3.763 . 0 0 "[ . 1 . 2]" 1 838 1 43 VAL H 1 43 VAL MG2 . . 2.820 2.344 2.127 2.656 . 0 0 "[ . 1 . 2]" 1 839 1 43 VAL H 1 44 GLU H . . 3.280 2.602 2.501 2.696 . 0 0 "[ . 1 . 2]" 1 840 1 43 VAL H 1 45 ASN H . . 4.620 3.838 3.699 4.004 . 0 0 "[ . 1 . 2]" 1 841 1 43 VAL HA 1 43 VAL MG1 . . 3.210 2.482 2.359 2.557 . 0 0 "[ . 1 . 2]" 1 842 1 43 VAL HA 1 43 VAL MG2 . . 3.160 2.297 2.148 2.420 . 0 0 "[ . 1 . 2]" 1 843 1 43 VAL HA 1 45 ASN H . . 4.770 4.316 4.026 4.578 . 0 0 "[ . 1 . 2]" 1 844 1 43 VAL HA 1 46 LEU H . . 4.360 3.682 3.412 3.934 . 0 0 "[ . 1 . 2]" 1 845 1 43 VAL HA 1 47 GLY H . . 4.040 3.757 3.428 4.039 . 0 0 "[ . 1 . 2]" 1 846 1 43 VAL HA 1 47 GLY HA3 . . 5.310 4.265 3.934 4.609 . 0 0 "[ . 1 . 2]" 1 847 1 43 VAL HB 1 44 GLU H . . 3.170 2.717 2.510 3.010 . 0 0 "[ . 1 . 2]" 1 848 1 43 VAL MG1 1 44 GLU H . . 3.770 3.350 3.132 3.574 . 0 0 "[ . 1 . 2]" 1 849 1 43 VAL MG1 1 44 GLU HA . . 3.930 3.336 3.112 3.532 . 0 0 "[ . 1 . 2]" 1 850 1 43 VAL MG1 1 44 GLU QB . . 5.320 4.351 3.869 4.554 . 0 0 "[ . 1 . 2]" 1 851 1 43 VAL MG1 1 45 ASN H . . 5.480 4.830 4.617 5.106 . 0 0 "[ . 1 . 2]" 1 852 1 43 VAL MG1 1 47 GLY H . . 4.660 4.129 3.829 4.389 . 0 0 "[ . 1 . 2]" 1 853 1 43 VAL MG1 1 47 GLY HA2 . . 5.050 4.319 3.898 4.615 . 0 0 "[ . 1 . 2]" 1 854 1 43 VAL MG1 1 47 GLY HA3 . . 5.020 3.417 3.059 3.874 . 0 0 "[ . 1 . 2]" 1 855 1 43 VAL MG2 1 44 GLU H . . 4.040 3.955 3.810 4.048 0.008 2 0 "[ . 1 . 2]" 1 856 1 44 GLU H 1 44 GLU QB . . 2.830 2.273 2.173 2.392 . 0 0 "[ . 1 . 2]" 1 857 1 44 GLU H 1 44 GLU HG2 . . 4.140 3.201 2.638 4.059 . 0 0 "[ . 1 . 2]" 1 858 1 44 GLU H 1 44 GLU HG3 . . 4.140 3.639 2.482 4.299 0.159 14 0 "[ . 1 . 2]" 1 859 1 44 GLU H 1 45 ASN H . . 3.200 2.359 2.167 2.500 . 0 0 "[ . 1 . 2]" 1 860 1 44 GLU H 1 45 ASN HA . . 5.290 5.023 4.868 5.148 . 0 0 "[ . 1 . 2]" 1 861 1 44 GLU H 1 45 ASN HB2 . . 4.820 4.310 4.071 4.564 . 0 0 "[ . 1 . 2]" 1 862 1 44 GLU H 1 45 ASN HD21 . . 5.170 4.560 3.532 5.030 . 0 0 "[ . 1 . 2]" 1 863 1 44 GLU HA 1 44 GLU HG2 . . 4.090 2.846 2.333 3.807 . 0 0 "[ . 1 . 2]" 1 864 1 44 GLU HA 1 44 GLU QG . . 3.460 2.600 2.252 2.935 . 0 0 "[ . 1 . 2]" 1 865 1 44 GLU HA 1 44 GLU HG3 . . 4.090 3.358 2.409 3.730 . 0 0 "[ . 1 . 2]" 1 866 1 44 GLU HA 1 47 GLY H . . 4.230 3.400 3.181 3.633 . 0 0 "[ . 1 . 2]" 1 867 1 44 GLU QB 1 45 ASN H . . 3.160 2.901 2.761 3.096 . 0 0 "[ . 1 . 2]" 1 868 1 44 GLU QB 1 45 ASN HD21 . . 5.090 4.137 2.587 4.676 . 0 0 "[ . 1 . 2]" 1 869 1 44 GLU QB 1 45 ASN HD22 . . 5.280 4.559 3.511 4.957 . 0 0 "[ . 1 . 2]" 1 870 1 44 GLU HG2 1 45 ASN H . . 5.500 4.763 3.357 5.399 . 0 0 "[ . 1 . 2]" 1 871 1 44 GLU HG3 1 45 ASN H . . 5.500 5.032 3.794 5.398 . 0 0 "[ . 1 . 2]" 1 872 1 45 ASN H 1 45 ASN HB2 . . 2.980 2.235 2.182 2.313 . 0 0 "[ . 1 . 2]" 1 873 1 45 ASN H 1 45 ASN HB3 . . 3.600 3.522 3.485 3.577 . 0 0 "[ . 1 . 2]" 1 874 1 45 ASN H 1 45 ASN HD21 . . 4.030 3.146 1.919 3.516 . 0 0 "[ . 1 . 2]" 1 875 1 45 ASN H 1 45 ASN HD22 . . 4.520 4.351 3.634 4.519 . 0 0 "[ . 1 . 2]" 1 876 1 45 ASN H 1 46 LEU H . . 3.060 2.367 2.145 2.620 . 0 0 "[ . 1 . 2]" 1 877 1 45 ASN H 1 46 LEU HA . . 5.290 5.058 4.880 5.234 . 0 0 "[ . 1 . 2]" 1 878 1 45 ASN H 1 46 LEU HB2 . . 5.500 4.757 4.557 5.142 . 0 0 "[ . 1 . 2]" 1 879 1 45 ASN H 1 46 LEU MD2 . . 5.500 4.831 4.424 5.175 . 0 0 "[ . 1 . 2]" 1 880 1 45 ASN H 1 46 LEU HG . . 4.360 4.170 3.932 4.362 0.002 2 0 "[ . 1 . 2]" 1 881 1 45 ASN H 1 65 VAL QG . . 5.440 4.817 4.477 5.102 . 0 0 "[ . 1 . 2]" 1 882 1 45 ASN HA 1 45 ASN HD22 . . 5.040 4.272 3.826 4.461 . 0 0 "[ . 1 . 2]" 1 883 1 45 ASN HA 1 47 GLY H . . 4.820 4.210 4.032 4.576 . 0 0 "[ . 1 . 2]" 1 884 1 45 ASN HB2 1 45 ASN HD22 . . 4.050 3.456 3.434 3.627 . 0 0 "[ . 1 . 2]" 1 885 1 45 ASN HB2 1 46 LEU H . . 3.520 2.969 2.677 3.197 . 0 0 "[ . 1 . 2]" 1 886 1 45 ASN HB2 1 46 LEU MD1 . . 5.120 4.677 4.491 4.854 . 0 0 "[ . 1 . 2]" 1 887 1 45 ASN HB2 1 46 LEU MD2 . . 4.470 3.669 3.190 4.089 . 0 0 "[ . 1 . 2]" 1 888 1 45 ASN HB2 1 46 LEU HG . . 4.530 3.302 3.107 3.482 . 0 0 "[ . 1 . 2]" 1 889 1 45 ASN HB2 1 65 VAL QG . . 4.070 3.155 2.724 3.473 . 0 0 "[ . 1 . 2]" 1 890 1 45 ASN HB3 1 46 LEU H . . 3.750 3.551 3.164 3.735 . 0 0 "[ . 1 . 2]" 1 891 1 45 ASN HB3 1 46 LEU MD2 . . 4.280 2.947 2.412 3.366 . 0 0 "[ . 1 . 2]" 1 892 1 45 ASN HB3 1 46 LEU HG . . 4.590 3.588 3.374 3.780 . 0 0 "[ . 1 . 2]" 1 893 1 45 ASN HB3 1 65 VAL QG . . 3.780 2.076 1.873 2.492 . 0 0 "[ . 1 . 2]" 1 894 1 45 ASN HD21 1 65 VAL QG . . 4.490 3.634 2.949 4.441 . 0 0 "[ . 1 . 2]" 1 895 1 45 ASN HD22 1 65 VAL QG . . 4.880 3.694 2.978 4.549 . 0 0 "[ . 1 . 2]" 1 896 1 46 LEU H 1 46 LEU HB2 . . 3.200 2.598 2.488 2.694 . 0 0 "[ . 1 . 2]" 1 897 1 46 LEU H 1 46 LEU HB3 . . 3.810 3.701 3.622 3.755 . 0 0 "[ . 1 . 2]" 1 898 1 46 LEU H 1 46 LEU MD1 . . 4.070 3.920 3.621 4.071 0.001 20 0 "[ . 1 . 2]" 1 899 1 46 LEU H 1 46 LEU MD2 . . 3.490 3.423 3.079 3.492 0.002 20 0 "[ . 1 . 2]" 1 900 1 46 LEU H 1 46 LEU HG . . 3.220 2.598 2.144 2.813 . 0 0 "[ . 1 . 2]" 1 901 1 46 LEU H 1 47 GLY H . . 2.990 2.113 1.946 2.343 . 0 0 "[ . 1 . 2]" 1 902 1 46 LEU H 1 47 GLY HA3 . . 4.660 4.338 4.194 4.606 . 0 0 "[ . 1 . 2]" 1 903 1 46 LEU H 1 48 ILE H . . 4.690 4.157 3.797 4.417 . 0 0 "[ . 1 . 2]" 1 904 1 46 LEU HA 1 46 LEU MD1 . . 4.180 3.857 3.792 3.956 . 0 0 "[ . 1 . 2]" 1 905 1 46 LEU HA 1 46 LEU MD2 . . 3.040 2.029 1.963 2.221 . 0 0 "[ . 1 . 2]" 1 906 1 46 LEU HA 1 48 ILE H . . 4.080 3.270 3.193 3.461 . 0 0 "[ . 1 . 2]" 1 907 1 46 LEU HA 1 48 ILE MD . . 5.330 4.584 4.273 4.876 . 0 0 "[ . 1 . 2]" 1 908 1 46 LEU HA 1 48 ILE QG . . 4.870 3.451 3.271 3.615 . 0 0 "[ . 1 . 2]" 1 909 1 46 LEU HA 1 49 LEU H . . 3.780 3.505 3.323 3.715 . 0 0 "[ . 1 . 2]" 1 910 1 46 LEU HA 1 49 LEU HB2 . . 4.480 3.666 3.245 3.985 . 0 0 "[ . 1 . 2]" 1 911 1 46 LEU HA 1 49 LEU MD1 . . 3.600 3.162 2.918 3.441 . 0 0 "[ . 1 . 2]" 1 912 1 46 LEU HA 1 49 LEU HG . . 4.170 3.399 2.894 3.679 . 0 0 "[ . 1 . 2]" 1 913 1 46 LEU HA 1 54 LEU MD1 . . 4.690 3.588 3.319 4.102 . 0 0 "[ . 1 . 2]" 1 914 1 46 LEU HB2 1 46 LEU MD1 . . 3.290 2.373 2.168 2.478 . 0 0 "[ . 1 . 2]" 1 915 1 46 LEU HB2 1 47 GLY H . . 3.950 3.306 2.895 3.585 . 0 0 "[ . 1 . 2]" 1 916 1 46 LEU HB2 1 54 LEU MD1 . . 4.200 3.538 3.333 3.848 . 0 0 "[ . 1 . 2]" 1 917 1 46 LEU HB3 1 46 LEU MD1 . . 3.320 2.301 2.183 2.464 . 0 0 "[ . 1 . 2]" 1 918 1 46 LEU HB3 1 46 LEU MD2 . . 3.410 2.358 2.263 2.449 . 0 0 "[ . 1 . 2]" 1 919 1 46 LEU HB3 1 47 GLY H . . 4.380 4.216 3.936 4.364 . 0 0 "[ . 1 . 2]" 1 920 1 46 LEU HB3 1 49 LEU MD1 . . 4.190 4.010 3.682 4.192 0.002 15 0 "[ . 1 . 2]" 1 921 1 46 LEU HB3 1 54 LEU MD1 . . 3.350 2.111 1.942 2.407 . 0 0 "[ . 1 . 2]" 1 922 1 46 LEU MD1 1 54 LEU MD1 . . 2.850 2.403 2.057 2.772 . 0 0 "[ . 1 . 2]" 1 923 1 46 LEU MD1 1 62 LEU HA . . 4.940 3.916 3.387 4.536 . 0 0 "[ . 1 . 2]" 1 924 1 46 LEU MD1 1 62 LEU MD1 . . 4.810 3.958 3.644 4.543 . 0 0 "[ . 1 . 2]" 1 925 1 46 LEU MD1 1 62 LEU MD2 . . 3.050 1.981 1.747 2.568 . 0 0 "[ . 1 . 2]" 1 926 1 46 LEU MD1 1 65 VAL QG . . 5.070 3.973 2.974 4.803 . 0 0 "[ . 1 . 2]" 1 927 1 46 LEU MD1 1 66 CYS HB2 . . 5.380 4.393 3.869 4.735 . 0 0 "[ . 1 . 2]" 1 928 1 46 LEU MD1 1 66 CYS QB . . 4.530 3.813 3.187 4.064 . 0 0 "[ . 1 . 2]" 1 929 1 46 LEU MD1 1 66 CYS HB3 . . 5.380 4.275 3.309 5.074 . 0 0 "[ . 1 . 2]" 1 930 1 46 LEU MD1 1 70 GLY HA2 . . 5.500 4.355 4.091 4.609 . 0 0 "[ . 1 . 2]" 1 931 1 46 LEU MD1 1 70 GLY HA3 . . 5.500 5.303 5.047 5.502 0.002 10 0 "[ . 1 . 2]" 1 932 1 46 LEU MD1 1 73 VAL MG2 . . 3.770 3.119 2.811 3.682 . 0 0 "[ . 1 . 2]" 1 933 1 46 LEU MD2 1 47 GLY H . . 4.710 4.597 4.408 4.692 . 0 0 "[ . 1 . 2]" 1 934 1 46 LEU MD2 1 49 LEU H . . 5.500 4.856 4.674 5.055 . 0 0 "[ . 1 . 2]" 1 935 1 46 LEU MD2 1 49 LEU HB2 . . 4.690 4.208 3.797 4.562 . 0 0 "[ . 1 . 2]" 1 936 1 46 LEU MD2 1 49 LEU MD1 . . 3.410 2.709 2.345 2.983 . 0 0 "[ . 1 . 2]" 1 937 1 46 LEU MD2 1 57 LEU MD1 . . 3.460 2.227 1.937 2.518 . 0 0 "[ . 1 . 2]" 1 938 1 46 LEU MD2 1 62 LEU HA . . 4.510 3.425 3.240 3.737 . 0 0 "[ . 1 . 2]" 1 939 1 46 LEU MD2 1 65 VAL HB . . 4.400 3.340 2.642 3.960 . 0 0 "[ . 1 . 2]" 1 940 1 46 LEU MD2 1 65 VAL MG1 . . 3.840 2.953 1.872 3.747 . 0 0 "[ . 1 . 2]" 1 941 1 46 LEU MD2 1 65 VAL QG . . 3.220 2.547 1.674 3.218 . 0 0 "[ . 1 . 2]" 1 942 1 46 LEU MD2 1 65 VAL MG2 . . 3.840 2.841 1.755 3.506 . 0 0 "[ . 1 . 2]" 1 943 1 46 LEU HG 1 47 GLY H . . 4.720 4.452 4.286 4.677 . 0 0 "[ . 1 . 2]" 1 944 1 47 GLY H 1 47 GLY HA2 . . 2.890 2.884 2.796 2.911 0.021 15 0 "[ . 1 . 2]" 1 945 1 47 GLY H 1 47 GLY HA3 . . 2.880 2.321 2.294 2.342 . 0 0 "[ . 1 . 2]" 1 946 1 47 GLY H 1 48 ILE H . . 3.480 2.724 2.600 2.940 . 0 0 "[ . 1 . 2]" 1 947 1 47 GLY H 1 48 ILE QG . . 4.660 4.082 3.889 4.281 . 0 0 "[ . 1 . 2]" 1 948 1 47 GLY H 1 48 ILE MG . . 4.890 3.509 3.267 3.967 . 0 0 "[ . 1 . 2]" 1 949 1 47 GLY HA2 1 48 ILE MG . . 5.500 4.478 4.305 4.672 . 0 0 "[ . 1 . 2]" 1 950 1 47 GLY HA2 1 49 LEU H . . 4.310 3.989 3.777 4.158 . 0 0 "[ . 1 . 2]" 1 951 1 47 GLY HA3 1 48 ILE MG . . 5.500 3.750 3.597 3.928 . 0 0 "[ . 1 . 2]" 1 952 1 48 ILE H 1 48 ILE HB . . 3.870 3.761 3.669 3.822 . 0 0 "[ . 1 . 2]" 1 953 1 48 ILE H 1 48 ILE MD . . 3.950 3.730 3.493 3.861 . 0 0 "[ . 1 . 2]" 1 954 1 48 ILE H 1 48 ILE HG12 . . 3.500 2.687 2.094 3.500 0.000 17 0 "[ . 1 . 2]" 1 955 1 48 ILE H 1 48 ILE QG . . 2.800 2.149 1.964 2.252 . 0 0 "[ . 1 . 2]" 1 956 1 48 ILE H 1 48 ILE HG13 . . 3.500 2.825 1.978 3.485 . 0 0 "[ . 1 . 2]" 1 957 1 48 ILE H 1 48 ILE MG . . 3.180 2.574 2.273 2.881 . 0 0 "[ . 1 . 2]" 1 958 1 48 ILE H 1 49 LEU H . . 2.950 1.994 1.829 2.301 . 0 0 "[ . 1 . 2]" 1 959 1 48 ILE H 1 49 LEU HB2 . . 4.490 4.113 3.943 4.405 . 0 0 "[ . 1 . 2]" 1 960 1 48 ILE H 1 49 LEU MD2 . . 4.910 4.782 4.593 4.880 . 0 0 "[ . 1 . 2]" 1 961 1 48 ILE H 1 49 LEU HG . . 4.310 3.811 3.672 4.004 . 0 0 "[ . 1 . 2]" 1 962 1 48 ILE HA 1 48 ILE MD . . 4.310 3.929 3.493 4.175 . 0 0 "[ . 1 . 2]" 1 963 1 48 ILE HA 1 48 ILE MG . . 3.050 2.407 2.289 2.538 . 0 0 "[ . 1 . 2]" 1 964 1 48 ILE HB 1 48 ILE MD . . 3.180 2.341 2.190 2.498 . 0 0 "[ . 1 . 2]" 1 965 1 48 ILE HB 1 49 LEU H . . 4.520 4.150 3.967 4.252 . 0 0 "[ . 1 . 2]" 1 966 1 48 ILE MD 1 49 LEU H . . 4.370 3.730 2.711 4.371 0.001 10 0 "[ . 1 . 2]" 1 967 1 48 ILE MD 1 49 LEU HA . . 5.500 3.860 2.426 4.825 . 0 0 "[ . 1 . 2]" 1 968 1 48 ILE MD 1 49 LEU HG . . 4.340 3.045 1.943 3.747 . 0 0 "[ . 1 . 2]" 1 969 1 48 ILE QG 1 48 ILE MG . . 3.230 2.176 1.942 2.383 . 0 0 "[ . 1 . 2]" 1 970 1 48 ILE QG 1 49 LEU H . . 3.510 2.456 2.169 2.698 . 0 0 "[ . 1 . 2]" 1 971 1 48 ILE QG 1 49 LEU HA . . 4.940 3.494 3.146 3.992 . 0 0 "[ . 1 . 2]" 1 972 1 48 ILE QG 1 49 LEU MD2 . . 3.690 2.860 2.318 3.496 . 0 0 "[ . 1 . 2]" 1 973 1 48 ILE HG12 1 49 LEU MD2 . . 4.250 3.899 3.363 4.251 0.001 6 0 "[ . 1 . 2]" 1 974 1 48 ILE HG12 1 49 LEU HG . . 4.440 3.259 2.751 3.935 . 0 0 "[ . 1 . 2]" 1 975 1 48 ILE HG13 1 49 LEU MD2 . . 4.250 2.958 2.344 3.719 . 0 0 "[ . 1 . 2]" 1 976 1 48 ILE HG13 1 49 LEU HG . . 4.440 2.605 2.312 3.176 . 0 0 "[ . 1 . 2]" 1 977 1 48 ILE MG 1 49 LEU H . . 4.590 3.921 3.837 4.034 . 0 0 "[ . 1 . 2]" 1 978 1 49 LEU H 1 49 LEU HB2 . . 3.060 2.392 2.354 2.454 . 0 0 "[ . 1 . 2]" 1 979 1 49 LEU H 1 49 LEU HB3 . . 3.690 3.604 3.583 3.630 . 0 0 "[ . 1 . 2]" 1 980 1 49 LEU H 1 49 LEU MD1 . . 4.250 3.803 3.663 3.945 . 0 0 "[ . 1 . 2]" 1 981 1 49 LEU H 1 49 LEU MD2 . . 3.720 3.541 3.382 3.684 . 0 0 "[ . 1 . 2]" 1 982 1 49 LEU H 1 49 LEU HG . . 3.050 2.645 2.456 2.837 . 0 0 "[ . 1 . 2]" 1 983 1 49 LEU H 1 50 THR H . . 4.800 4.587 4.535 4.612 . 0 0 "[ . 1 . 2]" 1 984 1 49 LEU HA 1 49 LEU MD2 . . 2.920 2.021 1.948 2.156 . 0 0 "[ . 1 . 2]" 1 985 1 49 LEU HA 1 50 THR H . . 2.850 2.269 2.178 2.337 . 0 0 "[ . 1 . 2]" 1 986 1 49 LEU HA 1 50 THR MG . . 4.110 3.823 3.588 4.054 . 0 0 "[ . 1 . 2]" 1 987 1 49 LEU HA 1 53 GLN HB2 . . 4.690 3.485 3.240 3.721 . 0 0 "[ . 1 . 2]" 1 988 1 49 LEU HA 1 53 GLN HB3 . . 4.590 3.441 3.053 3.625 . 0 0 "[ . 1 . 2]" 1 989 1 49 LEU HB2 1 49 LEU MD1 . . 3.400 2.389 2.340 2.457 . 0 0 "[ . 1 . 2]" 1 990 1 49 LEU HB2 1 49 LEU MD2 . . 3.460 3.193 3.189 3.195 . 0 0 "[ . 1 . 2]" 1 991 1 49 LEU HB2 1 50 THR H . . 4.470 3.927 3.773 4.151 . 0 0 "[ . 1 . 2]" 1 992 1 49 LEU HB2 1 53 GLN HB3 . . 4.070 3.890 3.735 4.069 . 0 0 "[ . 1 . 2]" 1 993 1 49 LEU HB2 1 54 LEU MD1 . . 4.450 3.466 3.306 3.701 . 0 0 "[ . 1 . 2]" 1 994 1 49 LEU HB2 1 54 LEU MD2 . . 4.640 4.357 4.149 4.549 . 0 0 "[ . 1 . 2]" 1 995 1 49 LEU HB3 1 49 LEU MD1 . . 3.460 2.305 2.197 2.369 . 0 0 "[ . 1 . 2]" 1 996 1 49 LEU HB3 1 49 LEU MD2 . . 3.460 2.368 2.286 2.432 . 0 0 "[ . 1 . 2]" 1 997 1 49 LEU HB3 1 50 THR H . . 3.400 2.772 2.567 3.108 . 0 0 "[ . 1 . 2]" 1 998 1 49 LEU HB3 1 53 GLN H . . 4.640 4.497 4.371 4.607 . 0 0 "[ . 1 . 2]" 1 999 1 49 LEU HB3 1 53 GLN HB2 . . 4.160 2.490 2.087 2.742 . 0 0 "[ . 1 . 2]" 1 1000 1 49 LEU HB3 1 53 GLN HB3 . . 3.940 2.158 2.003 2.338 . 0 0 "[ . 1 . 2]" 1 1001 1 49 LEU HB3 1 53 GLN HG2 . . 5.090 4.560 4.300 4.815 . 0 0 "[ . 1 . 2]" 1 1002 1 49 LEU HB3 1 53 GLN HG3 . . 5.500 4.710 4.420 4.916 . 0 0 "[ . 1 . 2]" 1 1003 1 49 LEU HB3 1 54 LEU H . . 4.750 3.142 3.055 3.292 . 0 0 "[ . 1 . 2]" 1 1004 1 49 LEU HB3 1 54 LEU HA . . 5.010 3.258 3.058 3.466 . 0 0 "[ . 1 . 2]" 1 1005 1 49 LEU HB3 1 54 LEU HB2 . . 4.690 3.295 3.110 3.540 . 0 0 "[ . 1 . 2]" 1 1006 1 49 LEU MD1 1 50 THR H . . 4.940 4.597 4.441 4.791 . 0 0 "[ . 1 . 2]" 1 1007 1 49 LEU MD1 1 53 GLN H . . 5.500 5.411 5.253 5.501 0.001 6 0 "[ . 1 . 2]" 1 1008 1 49 LEU MD1 1 53 GLN HB3 . . 4.310 2.883 2.695 3.049 . 0 0 "[ . 1 . 2]" 1 1009 1 49 LEU MD1 1 53 GLN HG2 . . 5.500 4.761 4.619 4.975 . 0 0 "[ . 1 . 2]" 1 1010 1 49 LEU MD1 1 54 LEU H . . 4.030 3.887 3.792 4.026 . 0 0 "[ . 1 . 2]" 1 1011 1 49 LEU MD1 1 54 LEU HA . . 2.870 2.365 2.164 2.495 . 0 0 "[ . 1 . 2]" 1 1012 1 49 LEU MD1 1 54 LEU HB2 . . 4.400 3.511 3.358 3.675 . 0 0 "[ . 1 . 2]" 1 1013 1 49 LEU MD1 1 54 LEU MD2 . . 4.990 4.729 4.579 4.867 . 0 0 "[ . 1 . 2]" 1 1014 1 49 LEU MD2 1 50 THR H . . 3.660 3.315 3.209 3.455 . 0 0 "[ . 1 . 2]" 1 1015 1 49 LEU MD2 1 53 GLN H . . 5.370 5.167 5.132 5.227 . 0 0 "[ . 1 . 2]" 1 1016 1 49 LEU MD2 1 53 GLN HA . . 4.310 4.212 4.068 4.307 . 0 0 "[ . 1 . 2]" 1 1017 1 49 LEU MD2 1 53 GLN HB2 . . 3.710 3.286 3.143 3.403 . 0 0 "[ . 1 . 2]" 1 1018 1 49 LEU MD2 1 53 GLN HB3 . . 3.610 2.006 1.973 2.095 . 0 0 "[ . 1 . 2]" 1 1019 1 49 LEU MD2 1 53 GLN HE21 . . 4.920 4.727 3.932 4.925 0.005 15 0 "[ . 1 . 2]" 1 1020 1 49 LEU MD2 1 53 GLN HE22 . . 4.920 4.238 3.548 4.541 . 0 0 "[ . 1 . 2]" 1 1021 1 49 LEU MD2 1 53 GLN HG2 . . 4.690 3.512 3.170 3.727 . 0 0 "[ . 1 . 2]" 1 1022 1 49 LEU MD2 1 54 LEU H . . 4.940 4.727 4.601 4.809 . 0 0 "[ . 1 . 2]" 1 1023 1 49 LEU HG 1 50 THR H . . 5.250 4.968 4.880 5.115 . 0 0 "[ . 1 . 2]" 1 1024 1 50 THR H 1 50 THR HB . . 4.200 3.610 3.555 3.629 . 0 0 "[ . 1 . 2]" 1 1025 1 50 THR H 1 50 THR HG1 . . 3.960 3.088 2.308 3.617 . 0 0 "[ . 1 . 2]" 1 1026 1 50 THR H 1 50 THR MG . . 3.160 2.557 2.153 2.811 . 0 0 "[ . 1 . 2]" 1 1027 1 50 THR H 1 53 GLN H . . 3.960 3.842 3.806 3.889 . 0 0 "[ . 1 . 2]" 1 1028 1 50 THR H 1 53 GLN HB2 . . 3.410 1.910 1.891 1.962 . 0 0 "[ . 1 . 2]" 1 1029 1 50 THR H 1 53 GLN HB3 . . 3.090 2.964 2.858 3.097 0.007 15 0 "[ . 1 . 2]" 1 1030 1 50 THR H 1 53 GLN HG2 . . 4.710 4.200 4.017 4.354 . 0 0 "[ . 1 . 2]" 1 1031 1 50 THR H 1 53 GLN HG3 . . 4.940 3.507 3.309 3.726 . 0 0 "[ . 1 . 2]" 1 1032 1 50 THR H 1 54 LEU H . . 4.550 4.131 3.896 4.345 . 0 0 "[ . 1 . 2]" 1 1033 1 50 THR HA 1 50 THR MG . . 3.170 2.272 2.190 2.420 . 0 0 "[ . 1 . 2]" 1 1034 1 50 THR HA 1 51 GLY H . . 3.090 2.598 2.436 2.656 . 0 0 "[ . 1 . 2]" 1 1035 1 50 THR HB 1 51 GLY H . . 3.160 1.998 1.896 2.319 . 0 0 "[ . 1 . 2]" 1 1036 1 50 THR HB 1 52 PRO HD2 . . 3.770 2.175 2.002 2.318 . 0 0 "[ . 1 . 2]" 1 1037 1 50 THR HB 1 52 PRO HD3 . . 4.810 3.722 3.595 3.858 . 0 0 "[ . 1 . 2]" 1 1038 1 50 THR HB 1 53 GLN H . . 4.310 3.803 3.576 4.116 . 0 0 "[ . 1 . 2]" 1 1039 1 50 THR HG1 1 50 THR MG . . 3.290 2.695 2.230 3.034 . 0 0 "[ . 1 . 2]" 1 1040 1 50 THR HG1 1 51 GLY H . . 4.580 3.674 3.341 4.292 . 0 0 "[ . 1 . 2]" 1 1041 1 50 THR HG1 1 52 PRO HD2 . . 4.310 2.458 2.020 2.926 . 0 0 "[ . 1 . 2]" 1 1042 1 50 THR HG1 1 52 PRO HD3 . . 4.690 4.057 3.625 4.480 . 0 0 "[ . 1 . 2]" 1 1043 1 50 THR HG1 1 53 GLN H . . 3.470 2.296 1.892 2.868 . 0 0 "[ . 1 . 2]" 1 1044 1 50 THR HG1 1 53 GLN HE21 . . 5.180 3.007 2.162 3.762 . 0 0 "[ . 1 . 2]" 1 1045 1 50 THR HG1 1 53 GLN HG3 . . 4.120 2.357 2.006 2.747 . 0 0 "[ . 1 . 2]" 1 1046 1 50 THR MG 1 51 GLY H . . 3.970 3.449 3.153 3.652 . 0 0 "[ . 1 . 2]" 1 1047 1 50 THR MG 1 52 PRO HD2 . . 4.750 3.794 3.717 3.847 . 0 0 "[ . 1 . 2]" 1 1048 1 50 THR MG 1 53 GLN H . . 4.660 4.395 4.217 4.569 . 0 0 "[ . 1 . 2]" 1 1049 1 50 THR MG 1 53 GLN HE22 . . 4.770 2.711 2.212 3.188 . 0 0 "[ . 1 . 2]" 1 1050 1 50 THR MG 1 53 GLN HG2 . . 5.500 4.831 4.399 5.172 . 0 0 "[ . 1 . 2]" 1 1051 1 50 THR MG 1 53 GLN HG3 . . 3.980 3.711 3.391 3.980 . 0 0 "[ . 1 . 2]" 1 1052 1 51 GLY H 1 52 PRO HD2 . . 4.000 2.255 2.182 2.400 . 0 0 "[ . 1 . 2]" 1 1053 1 51 GLY H 1 52 PRO HD3 . . 3.510 3.261 3.201 3.385 . 0 0 "[ . 1 . 2]" 1 1054 1 51 GLY H 1 52 PRO HG2 . . 4.710 4.486 4.414 4.629 . 0 0 "[ . 1 . 2]" 1 1055 1 51 GLY H 1 53 GLN H . . 4.840 4.278 4.065 4.425 . 0 0 "[ . 1 . 2]" 1 1056 1 51 GLY H 1 54 LEU HB3 . . 5.500 5.464 5.378 5.505 0.005 15 0 "[ . 1 . 2]" 1 1057 1 51 GLY HA2 1 53 GLN H . . 5.120 4.898 4.674 5.080 . 0 0 "[ . 1 . 2]" 1 1058 1 51 GLY HA2 1 54 LEU H . . 4.230 4.174 4.073 4.242 0.012 2 0 "[ . 1 . 2]" 1 1059 1 51 GLY HA2 1 54 LEU HB2 . . 4.870 4.720 4.525 4.848 . 0 0 "[ . 1 . 2]" 1 1060 1 51 GLY HA2 1 54 LEU HB3 . . 4.370 3.618 3.504 3.672 . 0 0 "[ . 1 . 2]" 1 1061 1 51 GLY HA2 1 54 LEU MD2 . . 4.870 3.956 3.860 4.114 . 0 0 "[ . 1 . 2]" 1 1062 1 51 GLY HA3 1 54 LEU HB3 . . 5.250 5.032 4.932 5.097 . 0 0 "[ . 1 . 2]" 1 1063 1 52 PRO HA 1 55 PHE H . . 3.930 3.477 3.375 3.568 . 0 0 "[ . 1 . 2]" 1 1064 1 52 PRO HA 1 55 PHE HB2 . . 3.810 2.623 2.457 2.767 . 0 0 "[ . 1 . 2]" 1 1065 1 52 PRO HA 1 55 PHE HB3 . . 4.840 4.273 4.080 4.459 . 0 0 "[ . 1 . 2]" 1 1066 1 52 PRO HA 1 55 PHE QD . . 4.160 2.582 2.218 2.828 . 0 0 "[ . 1 . 2]" 1 1067 1 52 PRO HB2 1 53 GLN H . . 3.480 3.022 2.869 3.206 . 0 0 "[ . 1 . 2]" 1 1068 1 52 PRO HB2 1 53 GLN HG3 . . 4.470 4.337 4.104 4.470 0.000 17 0 "[ . 1 . 2]" 1 1069 1 52 PRO HB2 1 55 PHE QD . . 5.500 5.234 4.898 5.458 . 0 0 "[ . 1 . 2]" 1 1070 1 52 PRO HB3 1 53 GLN H . . 4.070 3.961 3.872 4.066 . 0 0 "[ . 1 . 2]" 1 1071 1 52 PRO HD2 1 53 GLN H . . 3.620 2.711 2.657 2.771 . 0 0 "[ . 1 . 2]" 1 1072 1 52 PRO HD2 1 53 GLN HB2 . . 5.180 4.155 4.074 4.268 . 0 0 "[ . 1 . 2]" 1 1073 1 52 PRO HD2 1 54 LEU H . . 4.540 4.474 4.433 4.538 . 0 0 "[ . 1 . 2]" 1 1074 1 52 PRO HD3 1 53 GLN H . . 4.250 3.857 3.838 3.881 . 0 0 "[ . 1 . 2]" 1 1075 1 52 PRO HG2 1 53 GLN H . . 4.040 2.034 1.895 2.218 . 0 0 "[ . 1 . 2]" 1 1076 1 53 GLN H 1 53 GLN HB2 . . 3.380 2.334 2.233 2.477 . 0 0 "[ . 1 . 2]" 1 1077 1 53 GLN H 1 53 GLN HB3 . . 3.910 3.560 3.522 3.600 . 0 0 "[ . 1 . 2]" 1 1078 1 53 GLN H 1 53 GLN HE21 . . 4.730 4.361 3.951 4.726 . 0 0 "[ . 1 . 2]" 1 1079 1 53 GLN H 1 53 GLN HG3 . . 2.900 2.547 2.258 2.758 . 0 0 "[ . 1 . 2]" 1 1080 1 53 GLN H 1 54 LEU H . . 3.160 2.832 2.735 2.909 . 0 0 "[ . 1 . 2]" 1 1081 1 53 GLN H 1 54 LEU HB2 . . 5.500 5.472 5.344 5.507 0.007 6 0 "[ . 1 . 2]" 1 1082 1 53 GLN H 1 55 PHE H . . 5.360 4.616 4.366 4.790 . 0 0 "[ . 1 . 2]" 1 1083 1 53 GLN HA 1 53 GLN HG2 . . 3.810 2.423 2.293 2.555 . 0 0 "[ . 1 . 2]" 1 1084 1 53 GLN HA 1 53 GLN HG3 . . 4.030 2.859 2.631 2.999 . 0 0 "[ . 1 . 2]" 1 1085 1 53 GLN HA 1 56 SER H . . 4.210 3.803 3.746 3.863 . 0 0 "[ . 1 . 2]" 1 1086 1 53 GLN HB2 1 53 GLN HE22 . . 4.980 4.310 3.854 4.544 . 0 0 "[ . 1 . 2]" 1 1087 1 53 GLN HB2 1 54 LEU H . . 3.610 2.819 2.723 2.907 . 0 0 "[ . 1 . 2]" 1 1088 1 53 GLN HB2 1 55 PHE H . . 5.500 5.422 5.270 5.502 0.002 6 0 "[ . 1 . 2]" 1 1089 1 53 GLN HB3 1 54 LEU H . . 3.570 3.476 3.328 3.575 0.005 2 0 "[ . 1 . 2]" 1 1090 1 53 GLN HB3 1 56 SER H . . 5.500 5.480 5.440 5.503 0.003 15 0 "[ . 1 . 2]" 1 1091 1 53 GLN HE21 1 53 GLN HG3 . . 3.480 2.201 2.118 2.374 . 0 0 "[ . 1 . 2]" 1 1092 1 53 GLN HE22 1 53 GLN HG3 . . 3.640 3.470 3.437 3.538 . 0 0 "[ . 1 . 2]" 1 1093 1 53 GLN HG2 1 54 LEU H . . 5.500 5.084 5.039 5.143 . 0 0 "[ . 1 . 2]" 1 1094 1 53 GLN HG3 1 54 LEU H . . 5.500 4.667 4.505 4.775 . 0 0 "[ . 1 . 2]" 1 1095 1 54 LEU H 1 54 LEU HB2 . . 3.030 2.778 2.711 2.864 . 0 0 "[ . 1 . 2]" 1 1096 1 54 LEU H 1 54 LEU HB3 . . 3.030 2.294 2.233 2.337 . 0 0 "[ . 1 . 2]" 1 1097 1 54 LEU H 1 54 LEU MD1 . . 4.450 4.238 4.195 4.287 . 0 0 "[ . 1 . 2]" 1 1098 1 54 LEU H 1 54 LEU MD2 . . 4.200 4.164 4.119 4.202 0.002 16 0 "[ . 1 . 2]" 1 1099 1 54 LEU H 1 54 LEU HG . . 4.370 4.307 4.228 4.357 . 0 0 "[ . 1 . 2]" 1 1100 1 54 LEU H 1 56 SER H . . 4.490 3.782 3.647 3.927 . 0 0 "[ . 1 . 2]" 1 1101 1 54 LEU HA 1 54 LEU MD1 . . 3.160 2.231 2.060 2.393 . 0 0 "[ . 1 . 2]" 1 1102 1 54 LEU HA 1 54 LEU MD2 . . 4.310 3.938 3.883 3.971 . 0 0 "[ . 1 . 2]" 1 1103 1 54 LEU HA 1 54 LEU HG . . 4.140 3.300 3.234 3.385 . 0 0 "[ . 1 . 2]" 1 1104 1 54 LEU HA 1 56 SER H . . 4.660 3.989 3.824 4.116 . 0 0 "[ . 1 . 2]" 1 1105 1 54 LEU HA 1 57 LEU H . . 3.970 3.624 3.490 3.783 . 0 0 "[ . 1 . 2]" 1 1106 1 54 LEU HA 1 57 LEU MD1 . . 3.560 2.811 2.254 3.183 . 0 0 "[ . 1 . 2]" 1 1107 1 54 LEU HA 1 57 LEU HG . . 3.880 3.029 2.720 3.271 . 0 0 "[ . 1 . 2]" 1 1108 1 54 LEU HB2 1 54 LEU MD2 . . 3.540 2.359 2.300 2.427 . 0 0 "[ . 1 . 2]" 1 1109 1 54 LEU HB2 1 55 PHE H . . 4.370 3.800 3.715 3.905 . 0 0 "[ . 1 . 2]" 1 1110 1 54 LEU HB2 1 77 LEU QD . . 5.060 4.585 4.208 4.863 . 0 0 "[ . 1 . 2]" 1 1111 1 54 LEU HB3 1 54 LEU MD1 . . 3.660 3.192 3.185 3.196 . 0 0 "[ . 1 . 2]" 1 1112 1 54 LEU HB3 1 54 LEU MD2 . . 3.410 2.283 2.193 2.360 . 0 0 "[ . 1 . 2]" 1 1113 1 54 LEU HB3 1 55 PHE H . . 3.230 2.360 2.232 2.515 . 0 0 "[ . 1 . 2]" 1 1114 1 54 LEU HB3 1 56 SER H . . 4.770 4.657 4.493 4.772 0.002 7 0 "[ . 1 . 2]" 1 1115 1 54 LEU HB3 1 57 LEU H . . 5.500 5.499 5.478 5.508 0.008 12 0 "[ . 1 . 2]" 1 1116 1 54 LEU HB3 1 77 LEU QD . . 4.480 4.149 3.827 4.458 . 0 0 "[ . 1 . 2]" 1 1117 1 54 LEU MD1 1 55 PHE H . . 4.140 4.122 4.023 4.144 0.004 6 0 "[ . 1 . 2]" 1 1118 1 54 LEU MD1 1 56 SER H . . 5.500 5.026 4.753 5.187 . 0 0 "[ . 1 . 2]" 1 1119 1 54 LEU MD1 1 57 LEU HG . . 4.590 3.702 3.389 4.074 . 0 0 "[ . 1 . 2]" 1 1120 1 54 LEU MD1 1 77 LEU QD . . 3.640 2.386 1.908 2.869 . 0 0 "[ . 1 . 2]" 1 1121 1 54 LEU MD2 1 55 PHE H . . 4.520 3.807 3.592 4.010 . 0 0 "[ . 1 . 2]" 1 1122 1 54 LEU MD2 1 77 LEU QD . . 3.300 2.259 1.918 2.606 . 0 0 "[ . 1 . 2]" 1 1123 1 54 LEU HG 1 55 PHE H . . 3.480 3.042 2.873 3.157 . 0 0 "[ . 1 . 2]" 1 1124 1 54 LEU HG 1 55 PHE HA . . 4.590 3.184 3.056 3.267 . 0 0 "[ . 1 . 2]" 1 1125 1 54 LEU HG 1 56 SER H . . 5.160 4.919 4.782 5.042 . 0 0 "[ . 1 . 2]" 1 1126 1 54 LEU HG 1 77 LEU MD1 . . 3.540 2.909 2.520 3.448 . 0 0 "[ . 1 . 2]" 1 1127 1 54 LEU HG 1 77 LEU MD2 . . 3.540 2.671 2.320 2.995 . 0 0 "[ . 1 . 2]" 1 1128 1 55 PHE H 1 55 PHE HB2 . . 2.960 2.403 2.270 2.485 . 0 0 "[ . 1 . 2]" 1 1129 1 55 PHE H 1 55 PHE HB3 . . 3.660 3.578 3.541 3.597 . 0 0 "[ . 1 . 2]" 1 1130 1 55 PHE H 1 55 PHE QD . . 3.780 3.091 2.957 3.238 . 0 0 "[ . 1 . 2]" 1 1131 1 55 PHE H 1 56 SER H . . 3.200 2.746 2.692 2.855 . 0 0 "[ . 1 . 2]" 1 1132 1 55 PHE H 1 57 LEU H . . 4.500 4.257 4.210 4.389 . 0 0 "[ . 1 . 2]" 1 1133 1 55 PHE H 1 57 LEU HB2 . . 5.500 5.454 5.418 5.503 0.003 15 0 "[ . 1 . 2]" 1 1134 1 55 PHE H 1 77 LEU QD . . 5.440 4.173 3.847 4.382 . 0 0 "[ . 1 . 2]" 1 1135 1 55 PHE HA 1 55 PHE QD . . 3.460 2.192 2.014 2.456 . 0 0 "[ . 1 . 2]" 1 1136 1 55 PHE HA 1 57 LEU H . . 4.160 3.766 3.578 4.077 . 0 0 "[ . 1 . 2]" 1 1137 1 55 PHE HA 1 77 LEU MD1 . . 4.370 3.505 3.184 3.852 . 0 0 "[ . 1 . 2]" 1 1138 1 55 PHE HA 1 77 LEU QD . . 3.790 2.998 2.587 3.275 . 0 0 "[ . 1 . 2]" 1 1139 1 55 PHE HA 1 77 LEU MD2 . . 4.370 3.283 2.673 3.678 . 0 0 "[ . 1 . 2]" 1 1140 1 55 PHE HA 1 81 LYS HE2 . . 5.500 4.388 2.153 5.481 . 0 0 "[ . 1 . 2]" 1 1141 1 55 PHE HA 1 81 LYS HE3 . . 5.500 4.271 2.592 5.485 . 0 0 "[ . 1 . 2]" 1 1142 1 55 PHE HB2 1 56 SER H . . 3.750 2.969 2.804 3.101 . 0 0 "[ . 1 . 2]" 1 1143 1 55 PHE HB3 1 56 SER H . . 4.030 3.764 3.563 3.940 . 0 0 "[ . 1 . 2]" 1 1144 1 55 PHE HB3 1 81 LYS HD2 . . 5.500 3.799 2.001 4.879 . 0 0 "[ . 1 . 2]" 1 1145 1 55 PHE HB3 1 81 LYS HD3 . . 5.500 3.569 2.003 5.406 . 0 0 "[ . 1 . 2]" 1 1146 1 55 PHE HB3 1 81 LYS HE2 . . 5.480 3.845 2.304 5.138 . 0 0 "[ . 1 . 2]" 1 1147 1 55 PHE HB3 1 81 LYS QE . . 4.720 3.245 1.991 4.363 . 0 0 "[ . 1 . 2]" 1 1148 1 55 PHE HB3 1 81 LYS HE3 . . 5.480 3.845 2.018 5.289 . 0 0 "[ . 1 . 2]" 1 1149 1 55 PHE QD 1 56 SER H . . 4.770 4.573 4.450 4.655 . 0 0 "[ . 1 . 2]" 1 1150 1 55 PHE QD 1 77 LEU HB3 . . 4.230 3.336 2.837 3.768 . 0 0 "[ . 1 . 2]" 1 1151 1 55 PHE QD 1 77 LEU MD1 . . 4.750 3.753 3.487 4.115 . 0 0 "[ . 1 . 2]" 1 1152 1 55 PHE QD 1 77 LEU QD . . 4.020 2.508 2.048 2.885 . 0 0 "[ . 1 . 2]" 1 1153 1 55 PHE QD 1 77 LEU MD2 . . 4.750 2.554 2.055 3.005 . 0 0 "[ . 1 . 2]" 1 1154 1 55 PHE QD 1 77 LEU HG . . 5.500 5.279 4.951 5.504 0.004 6 0 "[ . 1 . 2]" 1 1155 1 55 PHE QD 1 81 LYS HB2 . . 5.500 4.739 4.355 5.125 . 0 0 "[ . 1 . 2]" 1 1156 1 55 PHE QD 1 81 LYS HB3 . . 5.500 4.968 4.571 5.424 . 0 0 "[ . 1 . 2]" 1 1157 1 55 PHE QD 1 81 LYS QD . . 4.560 2.497 1.990 3.672 . 0 0 "[ . 1 . 2]" 1 1158 1 55 PHE QD 1 81 LYS HE2 . . 4.970 3.551 1.995 4.628 . 0 0 "[ . 1 . 2]" 1 1159 1 55 PHE QD 1 81 LYS QE . . 4.280 2.930 1.935 3.938 . 0 0 "[ . 1 . 2]" 1 1160 1 55 PHE QD 1 81 LYS HE3 . . 4.970 3.423 2.004 4.609 . 0 0 "[ . 1 . 2]" 1 1161 1 55 PHE QD 1 81 LYS QG . . 4.820 2.422 2.132 2.965 . 0 0 "[ . 1 . 2]" 1 1162 1 55 PHE QE 1 77 LEU HA . . 4.690 3.524 2.937 4.032 . 0 0 "[ . 1 . 2]" 1 1163 1 55 PHE QE 1 77 LEU HB3 . . 5.030 3.653 2.871 4.346 . 0 0 "[ . 1 . 2]" 1 1164 1 55 PHE QE 1 77 LEU QD . . 4.090 2.192 1.964 2.564 . 0 0 "[ . 1 . 2]" 1 1165 1 55 PHE QE 1 80 GLN HB3 . . 4.750 2.792 2.386 3.461 . 0 0 "[ . 1 . 2]" 1 1166 1 55 PHE QE 1 81 LYS H . . 4.550 3.657 3.200 4.394 . 0 0 "[ . 1 . 2]" 1 1167 1 55 PHE QE 1 81 LYS HA . . 5.020 4.178 3.709 4.460 . 0 0 "[ . 1 . 2]" 1 1168 1 55 PHE QE 1 81 LYS HB2 . . 5.500 4.774 4.043 5.212 . 0 0 "[ . 1 . 2]" 1 1169 1 55 PHE QE 1 81 LYS HB3 . . 5.500 5.315 4.960 5.495 . 0 0 "[ . 1 . 2]" 1 1170 1 55 PHE QE 1 81 LYS QG . . 4.820 2.568 2.092 2.933 . 0 0 "[ . 1 . 2]" 1 1171 1 55 PHE QE 1 84 LEU MD1 . . 4.180 2.992 2.325 3.462 . 0 0 "[ . 1 . 2]" 1 1172 1 55 PHE HZ 1 80 GLN HB3 . . 4.870 3.572 2.669 4.227 . 0 0 "[ . 1 . 2]" 1 1173 1 55 PHE HZ 1 80 GLN QE . . 4.970 4.476 3.784 4.971 0.001 4 0 "[ . 1 . 2]" 1 1174 1 55 PHE HZ 1 80 GLN QG . . 4.110 2.796 2.237 3.792 . 0 0 "[ . 1 . 2]" 1 1175 1 55 PHE HZ 1 84 LEU MD1 . . 3.840 2.763 2.303 3.379 . 0 0 "[ . 1 . 2]" 1 1176 1 56 SER H 1 56 SER QB . . 2.940 2.288 2.170 2.547 . 0 0 "[ . 1 . 2]" 1 1177 1 56 SER H 1 57 LEU H . . 3.020 2.627 2.494 2.742 . 0 0 "[ . 1 . 2]" 1 1178 1 56 SER H 1 57 LEU HB2 . . 5.300 4.777 4.573 4.908 . 0 0 "[ . 1 . 2]" 1 1179 1 56 SER H 1 57 LEU MD2 . . 5.500 5.287 5.055 5.473 . 0 0 "[ . 1 . 2]" 1 1180 1 56 SER H 1 57 LEU HG . . 4.560 4.379 4.205 4.502 . 0 0 "[ . 1 . 2]" 1 1181 1 56 SER QB 1 57 LEU H . . 3.830 2.993 2.652 3.547 . 0 0 "[ . 1 . 2]" 1 1182 1 56 SER QB 1 57 LEU MD2 . . 4.490 3.934 3.397 4.413 . 0 0 "[ . 1 . 2]" 1 1183 1 56 SER HB2 1 57 LEU H . . 4.460 3.649 2.959 4.245 . 0 0 "[ . 1 . 2]" 1 1184 1 56 SER HB3 1 57 LEU H . . 4.460 3.430 2.705 4.046 . 0 0 "[ . 1 . 2]" 1 1185 1 57 LEU H 1 57 LEU HB2 . . 2.990 2.381 2.319 2.491 . 0 0 "[ . 1 . 2]" 1 1186 1 57 LEU H 1 57 LEU HB3 . . 3.770 3.580 3.562 3.594 . 0 0 "[ . 1 . 2]" 1 1187 1 57 LEU H 1 57 LEU MD1 . . 4.050 3.699 3.483 3.860 . 0 0 "[ . 1 . 2]" 1 1188 1 57 LEU H 1 57 LEU MD2 . . 3.630 3.542 3.316 3.634 0.004 11 0 "[ . 1 . 2]" 1 1189 1 57 LEU H 1 57 LEU HG . . 2.890 2.510 2.224 2.631 . 0 0 "[ . 1 . 2]" 1 1190 1 57 LEU H 1 58 ASN H . . 4.740 4.505 4.385 4.601 . 0 0 "[ . 1 . 2]" 1 1191 1 57 LEU H 1 62 LEU MD1 . . 5.320 5.001 4.665 5.314 . 0 0 "[ . 1 . 2]" 1 1192 1 57 LEU H 1 62 LEU HG . . 5.500 5.109 4.910 5.499 . 0 0 "[ . 1 . 2]" 1 1193 1 57 LEU H 1 77 LEU QD . . 5.310 4.713 4.386 4.948 . 0 0 "[ . 1 . 2]" 1 1194 1 57 LEU HA 1 57 LEU MD1 . . 4.370 3.848 3.774 3.896 . 0 0 "[ . 1 . 2]" 1 1195 1 57 LEU HA 1 57 LEU MD2 . . 3.020 2.004 1.938 2.105 . 0 0 "[ . 1 . 2]" 1 1196 1 57 LEU HA 1 58 ASN H . . 2.730 2.156 2.140 2.214 . 0 0 "[ . 1 . 2]" 1 1197 1 57 LEU HB2 1 57 LEU MD1 . . 3.370 2.280 2.103 2.427 . 0 0 "[ . 1 . 2]" 1 1198 1 57 LEU HB2 1 58 ASN H . . 4.810 4.271 4.103 4.395 . 0 0 "[ . 1 . 2]" 1 1199 1 57 LEU HB2 1 62 LEU MD1 . . 4.370 3.497 3.002 3.792 . 0 0 "[ . 1 . 2]" 1 1200 1 57 LEU HB2 1 62 LEU MD2 . . 3.730 3.082 2.780 3.442 . 0 0 "[ . 1 . 2]" 1 1201 1 57 LEU HB2 1 62 LEU HG . . 4.020 2.905 2.676 3.309 . 0 0 "[ . 1 . 2]" 1 1202 1 57 LEU HB3 1 57 LEU MD1 . . 3.360 2.402 2.281 2.536 . 0 0 "[ . 1 . 2]" 1 1203 1 57 LEU HB3 1 57 LEU MD2 . . 3.390 2.339 2.292 2.407 . 0 0 "[ . 1 . 2]" 1 1204 1 57 LEU HB3 1 58 ASN H . . 3.620 3.335 2.966 3.616 . 0 0 "[ . 1 . 2]" 1 1205 1 57 LEU HB3 1 61 GLU HB2 . . 4.550 3.044 2.574 3.352 . 0 0 "[ . 1 . 2]" 1 1206 1 57 LEU HB3 1 61 GLU HB3 . . 4.710 2.638 2.077 3.000 . 0 0 "[ . 1 . 2]" 1 1207 1 57 LEU HB3 1 62 LEU H . . 3.760 3.245 2.948 3.646 . 0 0 "[ . 1 . 2]" 1 1208 1 57 LEU HB3 1 62 LEU MD1 . . 4.640 3.634 3.298 3.898 . 0 0 "[ . 1 . 2]" 1 1209 1 57 LEU HB3 1 62 LEU MD2 . . 3.680 3.296 2.981 3.643 . 0 0 "[ . 1 . 2]" 1 1210 1 57 LEU HB3 1 62 LEU HG . . 3.760 2.295 2.000 2.594 . 0 0 "[ . 1 . 2]" 1 1211 1 57 LEU MD1 1 62 LEU HG . . 3.860 3.251 2.944 3.487 . 0 0 "[ . 1 . 2]" 1 1212 1 57 LEU MD1 1 65 VAL H . . 5.500 5.331 4.793 5.499 . 0 0 "[ . 1 . 2]" 1 1213 1 57 LEU MD1 1 65 VAL HB . . 5.090 4.610 4.046 5.090 . 13 0 "[ . 1 . 2]" 1 1214 1 57 LEU MD1 1 65 VAL QG . . 3.890 3.013 2.435 3.540 . 0 0 "[ . 1 . 2]" 1 1215 1 57 LEU MD2 1 58 ASN H . . 3.580 3.324 2.987 3.555 . 0 0 "[ . 1 . 2]" 1 1216 1 57 LEU MD2 1 61 GLU H . . 5.190 4.952 4.678 5.157 . 0 0 "[ . 1 . 2]" 1 1217 1 57 LEU MD2 1 61 GLU HA . . 5.160 4.163 3.675 4.392 . 0 0 "[ . 1 . 2]" 1 1218 1 57 LEU MD2 1 61 GLU HB2 . . 4.110 3.087 2.768 3.348 . 0 0 "[ . 1 . 2]" 1 1219 1 57 LEU MD2 1 61 GLU HB3 . . 3.230 2.039 1.916 2.160 . 0 0 "[ . 1 . 2]" 1 1220 1 57 LEU MD2 1 61 GLU QG . . 4.310 2.651 2.130 3.084 . 0 0 "[ . 1 . 2]" 1 1221 1 57 LEU MD2 1 62 LEU HA . . 5.500 4.328 3.881 4.675 . 0 0 "[ . 1 . 2]" 1 1222 1 57 LEU MD2 1 62 LEU HG . . 4.370 4.178 3.753 4.373 0.003 11 0 "[ . 1 . 2]" 1 1223 1 57 LEU HG 1 58 ASN H . . 5.300 5.083 4.944 5.256 . 0 0 "[ . 1 . 2]" 1 1224 1 58 ASN H 1 58 ASN HB2 . . 3.870 3.580 3.484 3.701 . 0 0 "[ . 1 . 2]" 1 1225 1 58 ASN H 1 58 ASN QB . . 3.300 2.776 2.319 3.004 . 0 0 "[ . 1 . 2]" 1 1226 1 58 ASN H 1 58 ASN HB3 . . 3.870 2.917 2.349 3.264 . 0 0 "[ . 1 . 2]" 1 1227 1 58 ASN H 1 58 ASN HD21 . . 4.550 3.758 1.797 4.430 . 0 0 "[ . 1 . 2]" 1 1228 1 58 ASN H 1 58 ASN HD22 . . 4.730 3.847 2.489 4.348 . 0 0 "[ . 1 . 2]" 1 1229 1 58 ASN H 1 59 LYS H . . 4.580 4.522 4.461 4.583 0.003 1 0 "[ . 1 . 2]" 1 1230 1 58 ASN H 1 60 GLU QG . . 4.750 4.272 3.849 4.717 . 0 0 "[ . 1 . 2]" 1 1231 1 58 ASN H 1 61 GLU H . . 4.340 3.580 3.359 3.795 . 0 0 "[ . 1 . 2]" 1 1232 1 58 ASN H 1 61 GLU HA . . 4.980 4.832 4.687 4.967 . 0 0 "[ . 1 . 2]" 1 1233 1 58 ASN H 1 61 GLU HB2 . . 3.330 1.993 1.895 2.142 . 0 0 "[ . 1 . 2]" 1 1234 1 58 ASN H 1 61 GLU HB3 . . 3.560 3.201 2.948 3.558 . 0 0 "[ . 1 . 2]" 1 1235 1 58 ASN H 1 61 GLU HG2 . . 5.000 3.410 2.547 4.260 . 0 0 "[ . 1 . 2]" 1 1236 1 58 ASN H 1 61 GLU QG . . 4.270 2.579 2.165 3.356 . 0 0 "[ . 1 . 2]" 1 1237 1 58 ASN H 1 61 GLU HG3 . . 5.000 2.756 2.244 4.066 . 0 0 "[ . 1 . 2]" 1 1238 1 58 ASN H 1 62 LEU H . . 4.520 3.980 3.778 4.233 . 0 0 "[ . 1 . 2]" 1 1239 1 58 ASN H 1 62 LEU HG . . 4.870 4.559 4.155 4.871 0.001 11 0 "[ . 1 . 2]" 1 1240 1 58 ASN HA 1 59 LYS H . . 3.060 2.534 2.369 2.652 . 0 0 "[ . 1 . 2]" 1 1241 1 58 ASN HA 1 60 GLU H . . 5.280 5.001 4.572 5.225 . 0 0 "[ . 1 . 2]" 1 1242 1 58 ASN HA 1 74 TYR QD . . 4.870 3.707 2.848 4.557 . 0 0 "[ . 1 . 2]" 1 1243 1 58 ASN HA 1 74 TYR QE . . 3.800 2.856 2.005 3.774 . 0 0 "[ . 1 . 2]" 1 1244 1 58 ASN QB 1 58 ASN HD22 . . 3.480 3.233 3.213 3.461 . 0 0 "[ . 1 . 2]" 1 1245 1 58 ASN QB 1 59 LYS H . . 2.920 2.199 1.945 2.481 . 0 0 "[ . 1 . 2]" 1 1246 1 58 ASN QB 1 60 GLU H . . 4.400 3.409 2.766 4.032 . 0 0 "[ . 1 . 2]" 1 1247 1 58 ASN QB 1 61 GLU H . . 4.190 3.685 3.336 4.083 . 0 0 "[ . 1 . 2]" 1 1248 1 58 ASN QB 1 74 TYR QE . . 5.340 3.836 2.732 4.864 . 0 0 "[ . 1 . 2]" 1 1249 1 58 ASN HB2 1 61 GLU H . . 4.770 3.898 3.411 4.583 . 0 0 "[ . 1 . 2]" 1 1250 1 58 ASN HB3 1 61 GLU H . . 4.770 4.674 4.326 4.829 0.059 11 0 "[ . 1 . 2]" 1 1251 1 58 ASN HD21 1 59 LYS H . . 5.170 4.601 3.763 5.164 . 0 0 "[ . 1 . 2]" 1 1252 1 58 ASN HD22 1 60 GLU H . . 5.070 4.611 3.878 5.031 . 0 0 "[ . 1 . 2]" 1 1253 1 58 ASN HD22 1 60 GLU QB . . 4.910 4.286 3.628 4.882 . 0 0 "[ . 1 . 2]" 1 1254 1 58 ASN HD22 1 60 GLU HG2 . . 5.500 2.649 1.897 3.240 . 0 0 "[ . 1 . 2]" 1 1255 1 58 ASN HD22 1 60 GLU HG3 . . 5.500 2.781 1.900 3.398 . 0 0 "[ . 1 . 2]" 1 1256 1 58 ASN HD22 1 61 GLU H . . 5.040 3.528 2.763 4.182 . 0 0 "[ . 1 . 2]" 1 1257 1 58 ASN HD22 1 61 GLU QG . . 4.680 2.603 1.714 3.904 . 0 0 "[ . 1 . 2]" 1 1258 1 59 LYS H 1 59 LYS HB2 . . 3.220 2.448 2.189 2.679 . 0 0 "[ . 1 . 2]" 1 1259 1 59 LYS H 1 59 LYS HB3 . . 3.220 2.643 2.373 2.951 . 0 0 "[ . 1 . 2]" 1 1260 1 59 LYS H 1 59 LYS QG . . 4.210 3.950 3.795 4.037 . 0 0 "[ . 1 . 2]" 1 1261 1 59 LYS H 1 60 GLU H . . 3.420 3.108 2.900 3.213 . 0 0 "[ . 1 . 2]" 1 1262 1 59 LYS H 1 61 GLU H . . 5.040 4.193 3.810 4.469 . 0 0 "[ . 1 . 2]" 1 1263 1 59 LYS H 1 74 TYR QD . . 4.650 3.571 2.535 4.482 . 0 0 "[ . 1 . 2]" 1 1264 1 59 LYS H 1 74 TYR QE . . 3.860 2.953 2.017 3.851 . 0 0 "[ . 1 . 2]" 1 1265 1 59 LYS HA 1 59 LYS HD2 . . 5.500 4.028 2.695 4.597 . 0 0 "[ . 1 . 2]" 1 1266 1 59 LYS HA 1 59 LYS QD . . 4.710 3.679 2.469 4.245 . 0 0 "[ . 1 . 2]" 1 1267 1 59 LYS HA 1 59 LYS HD3 . . 5.500 4.329 2.509 5.019 . 0 0 "[ . 1 . 2]" 1 1268 1 59 LYS HA 1 59 LYS HG2 . . 4.180 3.298 2.515 3.869 . 0 0 "[ . 1 . 2]" 1 1269 1 59 LYS HA 1 59 LYS QG . . 3.470 2.517 2.282 2.853 . 0 0 "[ . 1 . 2]" 1 1270 1 59 LYS HA 1 59 LYS HG3 . . 4.180 2.631 2.374 2.940 . 0 0 "[ . 1 . 2]" 1 1271 1 59 LYS HA 1 62 LEU H . . 3.840 3.771 3.556 3.844 0.004 16 0 "[ . 1 . 2]" 1 1272 1 59 LYS HA 1 62 LEU HB2 . . 3.670 2.956 2.785 3.090 . 0 0 "[ . 1 . 2]" 1 1273 1 59 LYS HA 1 62 LEU HB3 . . 4.710 4.568 4.324 4.713 0.003 12 0 "[ . 1 . 2]" 1 1274 1 59 LYS HA 1 62 LEU MD1 . . 3.530 2.745 2.380 3.076 . 0 0 "[ . 1 . 2]" 1 1275 1 59 LYS HA 1 62 LEU MD2 . . 5.500 5.208 4.925 5.436 . 0 0 "[ . 1 . 2]" 1 1276 1 59 LYS HA 1 63 LYS H . . 4.430 4.136 3.880 4.424 . 0 0 "[ . 1 . 2]" 1 1277 1 59 LYS HA 1 74 TYR QD . . 4.070 3.024 2.228 3.674 . 0 0 "[ . 1 . 2]" 1 1278 1 59 LYS HA 1 74 TYR QE . . 4.800 4.058 3.696 4.376 . 0 0 "[ . 1 . 2]" 1 1279 1 59 LYS QB 1 59 LYS QD . . 3.210 2.132 2.039 2.260 . 0 0 "[ . 1 . 2]" 1 1280 1 59 LYS QB 1 59 LYS QE . . 4.070 3.224 2.084 3.661 . 0 0 "[ . 1 . 2]" 1 1281 1 59 LYS QB 1 60 GLU H . . 3.190 2.127 1.961 2.449 . 0 0 "[ . 1 . 2]" 1 1282 1 59 LYS QB 1 61 GLU H . . 5.050 4.477 4.221 4.710 . 0 0 "[ . 1 . 2]" 1 1283 1 59 LYS QB 1 74 TYR QD . . 4.230 3.096 2.712 3.863 . 0 0 "[ . 1 . 2]" 1 1284 1 59 LYS QB 1 74 TYR QE . . 4.180 2.985 2.610 3.436 . 0 0 "[ . 1 . 2]" 1 1285 1 59 LYS HB2 1 59 LYS HE2 . . 5.400 4.009 2.119 4.893 . 0 0 "[ . 1 . 2]" 1 1286 1 59 LYS HB2 1 59 LYS HE3 . . 5.400 4.105 2.246 4.733 . 0 0 "[ . 1 . 2]" 1 1287 1 59 LYS HB2 1 60 GLU H . . 3.880 3.592 3.296 3.871 . 0 0 "[ . 1 . 2]" 1 1288 1 59 LYS HB2 1 74 TYR QE . . 4.870 3.048 2.639 3.514 . 0 0 "[ . 1 . 2]" 1 1289 1 59 LYS HB3 1 59 LYS HE2 . . 5.400 4.417 3.467 5.197 . 0 0 "[ . 1 . 2]" 1 1290 1 59 LYS HB3 1 59 LYS HE3 . . 5.400 4.615 3.719 5.401 0.001 17 0 "[ . 1 . 2]" 1 1291 1 59 LYS HB3 1 60 GLU H . . 3.880 2.144 1.976 2.477 . 0 0 "[ . 1 . 2]" 1 1292 1 59 LYS HB3 1 74 TYR QE . . 4.870 4.283 3.878 4.854 . 0 0 "[ . 1 . 2]" 1 1293 1 59 LYS QD 1 71 VAL QG . . 4.690 3.810 2.467 4.691 0.001 10 0 "[ . 1 . 2]" 1 1294 1 59 LYS QD 1 74 TYR QB . . 5.180 3.756 1.947 4.902 . 0 0 "[ . 1 . 2]" 1 1295 1 59 LYS QD 1 74 TYR QD . . 4.240 3.026 2.036 4.215 . 0 0 "[ . 1 . 2]" 1 1296 1 59 LYS HD2 1 60 GLU H . . 5.500 4.841 4.037 5.383 . 0 0 "[ . 1 . 2]" 1 1297 1 59 LYS HD2 1 74 TYR QD . . 4.970 3.388 2.062 4.569 . 0 0 "[ . 1 . 2]" 1 1298 1 59 LYS HD2 1 74 TYR QE . . 5.500 3.694 2.314 5.503 0.003 12 0 "[ . 1 . 2]" 1 1299 1 59 LYS HD3 1 60 GLU H . . 5.500 4.700 3.852 5.311 . 0 0 "[ . 1 . 2]" 1 1300 1 59 LYS HD3 1 74 TYR QD . . 4.970 3.972 2.121 4.946 . 0 0 "[ . 1 . 2]" 1 1301 1 59 LYS HD3 1 74 TYR QE . . 5.500 4.356 2.789 5.494 . 0 0 "[ . 1 . 2]" 1 1302 1 59 LYS QE 1 71 VAL QG . . 3.810 2.799 1.951 3.769 . 0 0 "[ . 1 . 2]" 1 1303 1 59 LYS QE 1 74 TYR QB . . 4.520 3.609 3.103 4.425 . 0 0 "[ . 1 . 2]" 1 1304 1 59 LYS QE 1 74 TYR QD . . 4.470 2.976 1.987 3.830 . 0 0 "[ . 1 . 2]" 1 1305 1 59 LYS HE2 1 71 VAL HA . . 5.500 4.235 3.261 5.346 . 0 0 "[ . 1 . 2]" 1 1306 1 59 LYS HE2 1 74 TYR QD . . 5.110 3.701 1.999 4.630 . 0 0 "[ . 1 . 2]" 1 1307 1 59 LYS HE2 1 74 TYR QE . . 5.500 4.590 2.574 5.503 0.003 16 0 "[ . 1 . 2]" 1 1308 1 59 LYS HE3 1 71 VAL HA . . 5.500 4.001 2.419 5.398 . 0 0 "[ . 1 . 2]" 1 1309 1 59 LYS HE3 1 74 TYR QD . . 5.110 3.507 2.052 4.607 . 0 0 "[ . 1 . 2]" 1 1310 1 59 LYS HE3 1 74 TYR QE . . 5.500 4.494 2.737 5.495 . 0 0 "[ . 1 . 2]" 1 1311 1 59 LYS QG 1 60 GLU H . . 4.040 3.182 2.644 3.728 . 0 0 "[ . 1 . 2]" 1 1312 1 59 LYS QG 1 71 VAL HA . . 4.310 3.559 2.731 4.314 0.004 17 0 "[ . 1 . 2]" 1 1313 1 59 LYS QG 1 74 TYR QD . . 4.220 3.323 2.235 4.223 0.003 12 0 "[ . 1 . 2]" 1 1314 1 59 LYS HG2 1 60 GLU H . . 4.730 3.423 2.685 3.909 . 0 0 "[ . 1 . 2]" 1 1315 1 59 LYS HG3 1 60 GLU H . . 4.730 4.075 3.026 4.704 . 0 0 "[ . 1 . 2]" 1 1316 1 60 GLU H 1 60 GLU HB2 . . 3.620 3.566 3.488 3.598 . 0 0 "[ . 1 . 2]" 1 1317 1 60 GLU H 1 60 GLU QB . . 2.950 2.404 2.158 2.604 . 0 0 "[ . 1 . 2]" 1 1318 1 60 GLU H 1 60 GLU HB3 . . 3.620 2.447 2.179 2.673 . 0 0 "[ . 1 . 2]" 1 1319 1 60 GLU H 1 60 GLU HG2 . . 3.940 2.389 1.895 3.637 . 0 0 "[ . 1 . 2]" 1 1320 1 60 GLU H 1 60 GLU QG . . 3.300 2.309 1.882 2.861 . 0 0 "[ . 1 . 2]" 1 1321 1 60 GLU H 1 60 GLU HG3 . . 3.940 3.444 2.929 3.954 0.014 19 0 "[ . 1 . 2]" 1 1322 1 60 GLU H 1 61 GLU H . . 3.070 2.841 2.667 3.047 . 0 0 "[ . 1 . 2]" 1 1323 1 60 GLU HA 1 63 LYS H . . 4.110 3.696 3.280 3.998 . 0 0 "[ . 1 . 2]" 1 1324 1 60 GLU HA 1 63 LYS HB2 . . 4.360 2.651 2.192 2.999 . 0 0 "[ . 1 . 2]" 1 1325 1 60 GLU HA 1 63 LYS QB . . 3.520 2.618 2.176 2.948 . 0 0 "[ . 1 . 2]" 1 1326 1 60 GLU HA 1 63 LYS HB3 . . 4.360 4.076 3.696 4.366 0.006 20 0 "[ . 1 . 2]" 1 1327 1 60 GLU HA 1 63 LYS QD . . 4.060 3.096 1.993 4.067 0.007 11 0 "[ . 1 . 2]" 1 1328 1 60 GLU HA 1 64 LYS H . . 4.870 4.352 3.921 4.875 0.005 20 0 "[ . 1 . 2]" 1 1329 1 60 GLU HB2 1 61 GLU H . . 4.110 3.725 3.205 4.081 . 0 0 "[ . 1 . 2]" 1 1330 1 60 GLU HB3 1 61 GLU H . . 4.110 3.836 3.565 4.041 . 0 0 "[ . 1 . 2]" 1 1331 1 60 GLU QG 1 61 GLU H . . 3.540 2.012 1.835 2.293 . 0 0 "[ . 1 . 2]" 1 1332 1 60 GLU QG 1 61 GLU HA . . 3.680 3.241 2.805 3.565 . 0 0 "[ . 1 . 2]" 1 1333 1 60 GLU QG 1 63 LYS H . . 5.340 5.122 4.795 5.342 0.002 7 0 "[ . 1 . 2]" 1 1334 1 61 GLU H 1 61 GLU HB2 . . 3.120 2.228 2.178 2.330 . 0 0 "[ . 1 . 2]" 1 1335 1 61 GLU H 1 61 GLU HB3 . . 3.580 3.517 3.484 3.563 . 0 0 "[ . 1 . 2]" 1 1336 1 61 GLU H 1 61 GLU QG . . 3.300 2.795 2.544 3.313 0.013 5 0 "[ . 1 . 2]" 1 1337 1 61 GLU H 1 62 LEU H . . 3.190 2.852 2.626 3.000 . 0 0 "[ . 1 . 2]" 1 1338 1 61 GLU H 1 62 LEU HG . . 5.500 5.146 4.954 5.485 . 0 0 "[ . 1 . 2]" 1 1339 1 61 GLU H 1 63 LYS H . . 4.270 4.032 3.808 4.266 . 0 0 "[ . 1 . 2]" 1 1340 1 61 GLU HA 1 64 LYS QB . . 3.310 2.640 2.305 3.283 . 0 0 "[ . 1 . 2]" 1 1341 1 61 GLU HA 1 64 LYS QD . . 3.840 3.174 2.074 3.845 0.005 18 0 "[ . 1 . 2]" 1 1342 1 61 GLU HB2 1 62 LEU H . . 3.530 2.487 2.325 2.687 . 0 0 "[ . 1 . 2]" 1 1343 1 61 GLU HB3 1 62 LEU H . . 3.100 2.944 2.745 3.109 0.009 4 0 "[ . 1 . 2]" 1 1344 1 61 GLU HB3 1 62 LEU HA . . 4.210 3.949 3.876 4.014 . 0 0 "[ . 1 . 2]" 1 1345 1 62 LEU H 1 62 LEU HB2 . . 2.930 2.359 2.244 2.495 . 0 0 "[ . 1 . 2]" 1 1346 1 62 LEU H 1 62 LEU HB3 . . 3.590 3.566 3.529 3.606 0.016 11 0 "[ . 1 . 2]" 1 1347 1 62 LEU H 1 62 LEU MD1 . . 3.720 3.279 3.140 3.557 . 0 0 "[ . 1 . 2]" 1 1348 1 62 LEU H 1 62 LEU MD2 . . 4.000 3.860 3.681 3.988 . 0 0 "[ . 1 . 2]" 1 1349 1 62 LEU H 1 62 LEU HG . . 3.230 2.555 2.359 2.799 . 0 0 "[ . 1 . 2]" 1 1350 1 62 LEU H 1 63 LYS H . . 3.230 2.793 2.566 2.973 . 0 0 "[ . 1 . 2]" 1 1351 1 62 LEU HA 1 62 LEU MD1 . . 4.280 3.855 3.817 3.879 . 0 0 "[ . 1 . 2]" 1 1352 1 62 LEU HA 1 62 LEU MD2 . . 3.000 2.308 2.011 2.425 . 0 0 "[ . 1 . 2]" 1 1353 1 62 LEU HA 1 62 LEU HG . . 3.590 2.676 2.566 2.796 . 0 0 "[ . 1 . 2]" 1 1354 1 62 LEU HA 1 65 VAL H . . 3.860 3.663 3.388 3.868 0.008 4 0 "[ . 1 . 2]" 1 1355 1 62 LEU HA 1 65 VAL HB . . 5.070 4.224 3.475 4.667 . 0 0 "[ . 1 . 2]" 1 1356 1 62 LEU HA 1 65 VAL QG . . 3.760 2.714 1.834 3.672 . 0 0 "[ . 1 . 2]" 1 1357 1 62 LEU HA 1 66 CYS H . . 4.040 3.677 3.286 3.983 . 0 0 "[ . 1 . 2]" 1 1358 1 62 LEU HB2 1 62 LEU MD1 . . 3.200 2.109 1.996 2.221 . 0 0 "[ . 1 . 2]" 1 1359 1 62 LEU HB2 1 63 LYS H . . 4.160 2.734 2.437 2.947 . 0 0 "[ . 1 . 2]" 1 1360 1 62 LEU HB2 1 74 TYR H . . 4.690 4.511 4.190 4.694 0.004 17 0 "[ . 1 . 2]" 1 1361 1 62 LEU HB2 1 74 TYR QD . . 5.050 4.146 3.708 4.459 . 0 0 "[ . 1 . 2]" 1 1362 1 62 LEU HB3 1 62 LEU MD1 . . 3.510 2.618 2.516 2.674 . 0 0 "[ . 1 . 2]" 1 1363 1 62 LEU HB3 1 62 LEU MD2 . . 3.330 2.217 2.147 2.328 . 0 0 "[ . 1 . 2]" 1 1364 1 62 LEU HB3 1 63 LYS H . . 3.710 3.501 3.266 3.714 0.004 20 0 "[ . 1 . 2]" 1 1365 1 62 LEU HB3 1 70 GLY H . . 5.500 5.178 4.593 5.503 0.003 9 0 "[ . 1 . 2]" 1 1366 1 62 LEU HB3 1 70 GLY HA2 . . 4.470 2.987 2.331 3.326 . 0 0 "[ . 1 . 2]" 1 1367 1 62 LEU HB3 1 70 GLY HA3 . . 4.310 3.150 2.732 3.393 . 0 0 "[ . 1 . 2]" 1 1368 1 62 LEU HB3 1 74 TYR QD . . 5.500 5.146 4.769 5.476 . 0 0 "[ . 1 . 2]" 1 1369 1 62 LEU MD1 1 63 LYS H . . 4.680 4.418 4.140 4.672 . 0 0 "[ . 1 . 2]" 1 1370 1 62 LEU MD1 1 70 GLY HA2 . . 5.050 4.368 3.739 4.660 . 0 0 "[ . 1 . 2]" 1 1371 1 62 LEU MD1 1 73 VAL HA . . 5.500 4.953 4.632 5.427 . 0 0 "[ . 1 . 2]" 1 1372 1 62 LEU MD1 1 73 VAL HB . . 3.910 3.208 2.652 3.876 . 0 0 "[ . 1 . 2]" 1 1373 1 62 LEU MD1 1 73 VAL MG1 . . 3.650 2.702 2.195 3.125 . 0 0 "[ . 1 . 2]" 1 1374 1 62 LEU MD1 1 73 VAL MG2 . . 5.160 4.405 3.987 4.956 . 0 0 "[ . 1 . 2]" 1 1375 1 62 LEU MD1 1 74 TYR H . . 3.620 3.119 2.777 3.604 . 0 0 "[ . 1 . 2]" 1 1376 1 62 LEU MD1 1 74 TYR HA . . 3.560 2.346 1.938 2.569 . 0 0 "[ . 1 . 2]" 1 1377 1 62 LEU MD1 1 74 TYR HB2 . . 3.940 2.117 1.802 2.398 . 0 0 "[ . 1 . 2]" 1 1378 1 62 LEU MD1 1 74 TYR QB . . 3.250 2.101 1.792 2.374 . 0 0 "[ . 1 . 2]" 1 1379 1 62 LEU MD1 1 74 TYR HB3 . . 3.940 3.570 3.190 3.811 . 0 0 "[ . 1 . 2]" 1 1380 1 62 LEU MD1 1 74 TYR QD . . 3.210 2.081 1.842 2.495 . 0 0 "[ . 1 . 2]" 1 1381 1 62 LEU MD1 1 74 TYR QE . . 4.250 3.826 3.490 4.251 0.001 5 0 "[ . 1 . 2]" 1 1382 1 62 LEU MD1 1 75 SER H . . 5.070 4.835 4.495 5.066 . 0 0 "[ . 1 . 2]" 1 1383 1 62 LEU MD1 1 77 LEU QD . . 3.610 1.880 1.688 2.003 . 0 0 "[ . 1 . 2]" 1 1384 1 62 LEU MD2 1 63 LYS H . . 5.120 4.814 4.691 4.924 . 0 0 "[ . 1 . 2]" 1 1385 1 62 LEU MD2 1 65 VAL H . . 5.500 5.282 4.992 5.470 . 0 0 "[ . 1 . 2]" 1 1386 1 62 LEU MD2 1 65 VAL HB . . 5.500 4.880 4.140 5.502 0.002 6 0 "[ . 1 . 2]" 1 1387 1 62 LEU MD2 1 65 VAL QG . . 4.460 3.714 2.624 4.462 0.002 3 0 "[ . 1 . 2]" 1 1388 1 62 LEU MD2 1 66 CYS H . . 4.920 4.555 4.167 4.922 0.002 11 0 "[ . 1 . 2]" 1 1389 1 62 LEU MD2 1 66 CYS QB . . 4.750 4.121 3.648 4.484 . 0 0 "[ . 1 . 2]" 1 1390 1 62 LEU MD2 1 70 GLY HA2 . . 4.340 3.763 3.253 4.154 . 0 0 "[ . 1 . 2]" 1 1391 1 62 LEU MD2 1 70 GLY HA3 . . 5.500 4.511 4.251 4.759 . 0 0 "[ . 1 . 2]" 1 1392 1 62 LEU MD2 1 73 VAL H . . 5.500 5.281 5.051 5.495 . 0 0 "[ . 1 . 2]" 1 1393 1 62 LEU MD2 1 73 VAL HB . . 3.700 2.950 2.640 3.215 . 0 0 "[ . 1 . 2]" 1 1394 1 62 LEU MD2 1 73 VAL MG1 . . 3.250 2.070 1.935 2.328 . 0 0 "[ . 1 . 2]" 1 1395 1 62 LEU MD2 1 73 VAL MG2 . . 4.140 3.578 3.249 3.970 . 0 0 "[ . 1 . 2]" 1 1396 1 62 LEU MD2 1 74 TYR H . . 4.460 4.318 3.801 4.461 0.001 3 0 "[ . 1 . 2]" 1 1397 1 62 LEU MD2 1 74 TYR QB . . 5.340 4.205 3.788 4.450 . 0 0 "[ . 1 . 2]" 1 1398 1 62 LEU HG 1 73 VAL MG1 . . 4.810 4.557 4.267 4.812 0.002 10 0 "[ . 1 . 2]" 1 1399 1 63 LYS H 1 63 LYS HB2 . . 3.550 2.214 2.174 2.305 . 0 0 "[ . 1 . 2]" 1 1400 1 63 LYS H 1 63 LYS QB . . 2.860 2.191 2.153 2.278 . 0 0 "[ . 1 . 2]" 1 1401 1 63 LYS H 1 63 LYS HB3 . . 3.550 3.508 3.478 3.553 0.003 8 0 "[ . 1 . 2]" 1 1402 1 63 LYS H 1 63 LYS HD2 . . 5.500 4.696 4.301 5.227 . 0 0 "[ . 1 . 2]" 1 1403 1 63 LYS H 1 63 LYS HD3 . . 5.500 4.167 3.454 5.412 . 0 0 "[ . 1 . 2]" 1 1404 1 63 LYS H 1 63 LYS QE . . 5.340 4.702 3.742 5.341 0.001 20 0 "[ . 1 . 2]" 1 1405 1 63 LYS H 1 63 LYS HG2 . . 4.200 4.014 3.681 4.199 . 0 0 "[ . 1 . 2]" 1 1406 1 63 LYS H 1 63 LYS QG . . 3.610 2.833 2.525 3.010 . 0 0 "[ . 1 . 2]" 1 1407 1 63 LYS H 1 63 LYS HG3 . . 4.200 2.898 2.564 3.131 . 0 0 "[ . 1 . 2]" 1 1408 1 63 LYS H 1 64 LYS H . . 3.100 2.567 2.392 2.859 . 0 0 "[ . 1 . 2]" 1 1409 1 63 LYS H 1 64 LYS QB . . 4.560 4.336 4.152 4.511 . 0 0 "[ . 1 . 2]" 1 1410 1 63 LYS H 1 66 CYS QB . . 5.340 4.788 4.316 5.205 . 0 0 "[ . 1 . 2]" 1 1411 1 63 LYS H 1 70 GLY HA3 . . 4.770 3.978 3.616 4.278 . 0 0 "[ . 1 . 2]" 1 1412 1 63 LYS HA 1 63 LYS HG2 . . 4.110 2.546 2.220 2.784 . 0 0 "[ . 1 . 2]" 1 1413 1 63 LYS HA 1 63 LYS QG . . 3.550 2.280 2.167 2.345 . 0 0 "[ . 1 . 2]" 1 1414 1 63 LYS HA 1 63 LYS HG3 . . 4.110 2.682 2.428 3.085 . 0 0 "[ . 1 . 2]" 1 1415 1 63 LYS HA 1 65 VAL H . . 4.730 4.261 3.894 4.738 0.008 10 0 "[ . 1 . 2]" 1 1416 1 63 LYS HA 1 66 CYS H . . 4.110 3.776 3.539 4.115 0.005 18 0 "[ . 1 . 2]" 1 1417 1 63 LYS HA 1 66 CYS QB . . 4.200 3.054 2.637 3.548 . 0 0 "[ . 1 . 2]" 1 1418 1 63 LYS HA 1 70 GLY H . . 4.000 3.728 3.249 4.004 0.004 11 0 "[ . 1 . 2]" 1 1419 1 63 LYS HA 1 70 GLY HA2 . . 4.470 4.103 3.707 4.472 0.002 20 0 "[ . 1 . 2]" 1 1420 1 63 LYS HA 1 70 GLY HA3 . . 4.070 2.410 2.065 2.787 . 0 0 "[ . 1 . 2]" 1 1421 1 63 LYS HA 1 71 VAL H . . 4.180 3.953 3.233 4.183 0.003 5 0 "[ . 1 . 2]" 1 1422 1 63 LYS HA 1 71 VAL QG . . 4.630 4.060 3.614 4.334 . 0 0 "[ . 1 . 2]" 1 1423 1 63 LYS QB 1 63 LYS QE . . 3.500 2.471 2.108 3.421 . 0 0 "[ . 1 . 2]" 1 1424 1 63 LYS QB 1 64 LYS H . . 3.230 2.830 2.306 3.050 . 0 0 "[ . 1 . 2]" 1 1425 1 63 LYS QB 1 65 VAL H . . 5.340 4.785 4.386 5.052 . 0 0 "[ . 1 . 2]" 1 1426 1 63 LYS QB 1 71 VAL QG . . 4.630 3.713 3.516 3.915 . 0 0 "[ . 1 . 2]" 1 1427 1 63 LYS HB2 1 63 LYS HE2 . . 4.730 3.496 2.686 4.443 . 0 0 "[ . 1 . 2]" 1 1428 1 63 LYS HB2 1 63 LYS HE3 . . 4.730 3.718 2.419 4.724 . 0 0 "[ . 1 . 2]" 1 1429 1 63 LYS HB2 1 64 LYS H . . 3.710 2.981 2.460 3.242 . 0 0 "[ . 1 . 2]" 1 1430 1 63 LYS HB3 1 63 LYS HE2 . . 4.730 3.180 2.335 4.487 . 0 0 "[ . 1 . 2]" 1 1431 1 63 LYS HB3 1 63 LYS HE3 . . 4.730 3.435 2.177 4.554 . 0 0 "[ . 1 . 2]" 1 1432 1 63 LYS HB3 1 64 LYS H . . 3.710 3.530 2.787 3.713 0.003 17 0 "[ . 1 . 2]" 1 1433 1 63 LYS QD 1 71 VAL QG . . 3.420 2.073 1.790 2.666 . 0 0 "[ . 1 . 2]" 1 1434 1 63 LYS QE 1 71 VAL QG . . 3.440 2.409 1.872 3.436 . 0 0 "[ . 1 . 2]" 1 1435 1 63 LYS QG 1 64 LYS H . . 4.900 4.410 4.195 4.498 . 0 0 "[ . 1 . 2]" 1 1436 1 63 LYS QG 1 66 CYS QB . . 5.180 4.319 3.843 4.950 . 0 0 "[ . 1 . 2]" 1 1437 1 63 LYS QG 1 71 VAL QG . . 3.710 2.071 1.907 2.325 . 0 0 "[ . 1 . 2]" 1 1438 1 64 LYS H 1 64 LYS QB . . 2.810 2.214 2.126 2.385 . 0 0 "[ . 1 . 2]" 1 1439 1 64 LYS H 1 64 LYS HG2 . . 4.700 4.183 3.275 4.622 . 0 0 "[ . 1 . 2]" 1 1440 1 64 LYS H 1 64 LYS QG . . 3.990 3.452 2.294 4.038 0.048 11 0 "[ . 1 . 2]" 1 1441 1 64 LYS H 1 64 LYS HG3 . . 4.700 3.740 2.322 4.629 . 0 0 "[ . 1 . 2]" 1 1442 1 64 LYS H 1 65 VAL H . . 3.330 2.675 2.419 2.951 . 0 0 "[ . 1 . 2]" 1 1443 1 64 LYS H 1 66 CYS H . . 4.870 4.315 3.768 4.542 . 0 0 "[ . 1 . 2]" 1 1444 1 64 LYS HA 1 64 LYS HE2 . . 5.080 4.439 2.000 5.060 . 0 0 "[ . 1 . 2]" 1 1445 1 64 LYS HA 1 64 LYS QE . . 4.320 3.970 1.992 4.329 0.009 18 0 "[ . 1 . 2]" 1 1446 1 64 LYS HA 1 64 LYS HE3 . . 5.080 4.616 3.723 5.058 . 0 0 "[ . 1 . 2]" 1 1447 1 64 LYS HA 1 64 LYS HG2 . . 3.920 2.816 2.254 3.628 . 0 0 "[ . 1 . 2]" 1 1448 1 64 LYS HA 1 64 LYS HG3 . . 3.920 2.719 2.194 3.627 . 0 0 "[ . 1 . 2]" 1 1449 1 64 LYS QB 1 64 LYS QD . . 3.320 2.208 1.994 2.344 . 0 0 "[ . 1 . 2]" 1 1450 1 64 LYS QB 1 65 VAL H . . 3.160 2.635 2.319 3.005 . 0 0 "[ . 1 . 2]" 1 1451 1 64 LYS QB 1 65 VAL QG . . 3.970 2.889 2.372 3.684 . 0 0 "[ . 1 . 2]" 1 1452 1 64 LYS QD 1 65 VAL H . . 5.340 4.682 3.111 5.340 0.000 16 0 "[ . 1 . 2]" 1 1453 1 64 LYS QD 1 65 VAL QG . . 4.850 4.239 2.314 4.877 0.027 4 0 "[ . 1 . 2]" 1 1454 1 64 LYS QG 1 65 VAL H . . 4.510 4.159 3.556 4.503 . 0 0 "[ . 1 . 2]" 1 1455 1 64 LYS HG2 1 65 VAL H . . 5.230 4.619 3.669 5.154 . 0 0 "[ . 1 . 2]" 1 1456 1 64 LYS HG3 1 65 VAL H . . 5.230 4.847 4.421 5.230 0.000 1 0 "[ . 1 . 2]" 1 1457 1 65 VAL H 1 65 VAL HB . . 3.150 2.892 2.633 2.959 . 0 0 "[ . 1 . 2]" 1 1458 1 65 VAL H 1 65 VAL MG1 . . 3.910 3.301 1.829 3.839 . 0 0 "[ . 1 . 2]" 1 1459 1 65 VAL H 1 65 VAL QG . . 3.000 1.987 1.825 2.155 . 0 0 "[ . 1 . 2]" 1 1460 1 65 VAL H 1 65 VAL MG2 . . 3.910 2.469 1.884 3.790 . 0 0 "[ . 1 . 2]" 1 1461 1 65 VAL H 1 66 CYS H . . 3.100 2.457 2.297 2.846 . 0 0 "[ . 1 . 2]" 1 1462 1 65 VAL H 1 66 CYS QB . . 5.150 4.514 4.292 5.020 . 0 0 "[ . 1 . 2]" 1 1463 1 65 VAL H 1 67 GLY H . . 4.270 3.849 3.404 4.276 0.006 11 0 "[ . 1 . 2]" 1 1464 1 65 VAL HA 1 65 VAL MG1 . . 3.370 2.436 2.103 3.202 . 0 0 "[ . 1 . 2]" 1 1465 1 65 VAL HA 1 65 VAL MG2 . . 3.370 2.598 2.308 2.689 . 0 0 "[ . 1 . 2]" 1 1466 1 65 VAL HB 1 66 CYS H . . 3.940 2.701 2.306 4.047 0.107 10 0 "[ . 1 . 2]" 1 1467 1 65 VAL HB 1 67 GLY H . . 5.500 5.073 4.597 5.501 0.001 6 0 "[ . 1 . 2]" 1 1468 1 65 VAL QG 1 66 CYS H . . 3.780 2.671 1.748 2.976 . 0 0 "[ . 1 . 2]" 1 1469 1 65 VAL QG 1 66 CYS HA . . 4.280 3.821 3.099 4.074 . 0 0 "[ . 1 . 2]" 1 1470 1 65 VAL MG1 1 66 CYS H . . 4.380 3.275 1.754 3.779 . 0 0 "[ . 1 . 2]" 1 1471 1 65 VAL MG1 1 66 CYS HA . . 5.030 4.079 3.434 4.270 . 0 0 "[ . 1 . 2]" 1 1472 1 65 VAL MG2 1 66 CYS H . . 4.380 3.152 3.045 3.444 . 0 0 "[ . 1 . 2]" 1 1473 1 65 VAL MG2 1 66 CYS HA . . 5.030 4.705 3.378 5.147 0.117 11 0 "[ . 1 . 2]" 1 1474 1 66 CYS H 1 66 CYS HB2 . . 3.750 2.708 2.513 2.873 . 0 0 "[ . 1 . 2]" 1 1475 1 66 CYS H 1 66 CYS QB . . 3.220 2.545 2.247 2.740 . 0 0 "[ . 1 . 2]" 1 1476 1 66 CYS H 1 66 CYS HB3 . . 3.750 3.355 2.350 3.672 . 0 0 "[ . 1 . 2]" 1 1477 1 66 CYS H 1 67 GLY H . . 3.170 2.767 2.344 2.997 . 0 0 "[ . 1 . 2]" 1 1478 1 66 CYS H 1 70 GLY H . . 4.930 4.777 4.307 4.937 0.007 7 0 "[ . 1 . 2]" 1 1479 1 66 CYS H 1 70 GLY HA3 . . 4.980 4.199 3.753 4.556 . 0 0 "[ . 1 . 2]" 1 1480 1 66 CYS QB 1 67 GLY H . . 4.120 2.672 2.093 3.827 . 0 0 "[ . 1 . 2]" 1 1481 1 66 CYS QB 1 69 GLU QB . . 4.430 2.791 2.285 3.745 . 0 0 "[ . 1 . 2]" 1 1482 1 66 CYS QB 1 71 VAL H . . 4.820 4.326 4.062 4.756 . 0 0 "[ . 1 . 2]" 1 1483 1 66 CYS QB 1 73 VAL MG2 . . 4.640 3.236 2.757 3.709 . 0 0 "[ . 1 . 2]" 1 1484 1 66 CYS HB2 1 70 GLY H . . 3.810 2.588 2.059 3.818 0.008 16 0 "[ . 1 . 2]" 1 1485 1 66 CYS HB2 1 70 GLY HA2 . . 3.890 2.737 2.166 3.755 . 0 0 "[ . 1 . 2]" 1 1486 1 66 CYS HB2 1 70 GLY HA3 . . 3.910 2.458 1.999 3.922 0.012 11 0 "[ . 1 . 2]" 1 1487 1 66 CYS HB3 1 70 GLY H . . 3.810 2.505 2.109 3.103 . 0 0 "[ . 1 . 2]" 1 1488 1 66 CYS HB3 1 70 GLY HA2 . . 3.890 2.981 2.708 3.212 . 0 0 "[ . 1 . 2]" 1 1489 1 66 CYS HB3 1 70 GLY HA3 . . 3.910 3.199 2.388 3.800 . 0 0 "[ . 1 . 2]" 1 1490 1 68 GLU HA 1 70 GLY H . . 4.520 4.286 3.927 4.520 . 0 0 "[ . 1 . 2]" 1 1491 1 68 GLU HA 1 71 VAL H . . 4.440 3.951 3.724 4.128 . 0 0 "[ . 1 . 2]" 1 1492 1 68 GLU HA 1 71 VAL QG . . 3.840 3.030 2.680 3.383 . 0 0 "[ . 1 . 2]" 1 1493 1 68 GLU QB 1 71 VAL QG . . 4.540 4.263 3.418 4.541 0.001 16 0 "[ . 1 . 2]" 1 1494 1 68 GLU QG 1 71 VAL QG . . 4.850 4.084 3.102 4.851 0.001 11 0 "[ . 1 . 2]" 1 1495 1 69 GLU H 1 70 GLY H . . 4.210 2.739 2.602 2.905 . 0 0 "[ . 1 . 2]" 1 1496 1 69 GLU HA 1 69 GLU HG2 . . 3.980 3.520 2.175 3.790 . 0 0 "[ . 1 . 2]" 1 1497 1 69 GLU HA 1 69 GLU QG . . 3.300 2.647 2.154 3.041 . 0 0 "[ . 1 . 2]" 1 1498 1 69 GLU HA 1 69 GLU HG3 . . 3.980 2.838 2.219 3.626 . 0 0 "[ . 1 . 2]" 1 1499 1 69 GLU HA 1 71 VAL H . . 4.770 4.064 3.668 4.533 . 0 0 "[ . 1 . 2]" 1 1500 1 69 GLU HA 1 71 VAL QG . . 5.090 4.575 4.410 4.800 . 0 0 "[ . 1 . 2]" 1 1501 1 69 GLU HA 1 72 ARG H . . 3.620 3.423 3.199 3.606 . 0 0 "[ . 1 . 2]" 1 1502 1 69 GLU HA 1 73 VAL H . . 4.730 4.461 3.991 4.735 0.005 12 0 "[ . 1 . 2]" 1 1503 1 69 GLU QB 1 70 GLY H . . 3.750 2.639 2.482 2.769 . 0 0 "[ . 1 . 2]" 1 1504 1 69 GLU HB2 1 70 GLY H . . 4.340 3.551 2.825 3.963 . 0 0 "[ . 1 . 2]" 1 1505 1 69 GLU HB3 1 70 GLY H . . 4.340 2.794 2.533 3.459 . 0 0 "[ . 1 . 2]" 1 1506 1 69 GLU QG 1 72 ARG H . . 4.980 4.475 3.998 4.945 . 0 0 "[ . 1 . 2]" 1 1507 1 69 GLU QG 1 73 VAL MG2 . . 3.950 2.797 2.005 3.897 . 0 0 "[ . 1 . 2]" 1 1508 1 69 GLU HG2 1 73 VAL MG2 . . 4.810 3.765 3.270 4.742 . 0 0 "[ . 1 . 2]" 1 1509 1 69 GLU HG3 1 73 VAL MG2 . . 4.810 2.957 2.022 4.550 . 0 0 "[ . 1 . 2]" 1 1510 1 70 GLY H 1 71 VAL H . . 3.340 3.012 2.901 3.118 . 0 0 "[ . 1 . 2]" 1 1511 1 70 GLY H 1 71 VAL QG . . 4.610 4.257 4.032 4.448 . 0 0 "[ . 1 . 2]" 1 1512 1 70 GLY H 1 72 ARG H . . 4.580 4.514 4.393 4.586 0.006 9 0 "[ . 1 . 2]" 1 1513 1 70 GLY H 1 73 VAL H . . 4.980 4.768 4.585 4.972 . 0 0 "[ . 1 . 2]" 1 1514 1 70 GLY H 1 73 VAL MG2 . . 4.730 3.778 3.619 4.041 . 0 0 "[ . 1 . 2]" 1 1515 1 70 GLY HA2 1 72 ARG H . . 4.460 4.310 4.100 4.462 0.002 11 0 "[ . 1 . 2]" 1 1516 1 70 GLY HA2 1 73 VAL H . . 4.870 3.322 3.107 3.555 . 0 0 "[ . 1 . 2]" 1 1517 1 70 GLY HA2 1 73 VAL HB . . 3.810 2.481 2.080 2.834 . 0 0 "[ . 1 . 2]" 1 1518 1 70 GLY HA2 1 73 VAL MG1 . . 5.500 3.824 3.575 4.051 . 0 0 "[ . 1 . 2]" 1 1519 1 70 GLY HA2 1 73 VAL MG2 . . 3.480 2.378 2.001 2.965 . 0 0 "[ . 1 . 2]" 1 1520 1 70 GLY HA2 1 74 TYR H . . 4.460 3.900 3.663 4.100 . 0 0 "[ . 1 . 2]" 1 1521 1 70 GLY HA3 1 73 VAL H . . 4.940 4.584 4.356 4.800 . 0 0 "[ . 1 . 2]" 1 1522 1 70 GLY HA3 1 73 VAL HB . . 4.250 4.015 3.722 4.251 0.001 16 0 "[ . 1 . 2]" 1 1523 1 70 GLY HA3 1 73 VAL MG1 . . 5.500 5.132 4.896 5.309 . 0 0 "[ . 1 . 2]" 1 1524 1 70 GLY HA3 1 73 VAL MG2 . . 4.310 3.880 3.593 4.295 . 0 0 "[ . 1 . 2]" 1 1525 1 70 GLY HA3 1 74 TYR H . . 4.910 4.768 4.562 4.919 0.009 11 0 "[ . 1 . 2]" 1 1526 1 71 VAL H 1 71 VAL HB . . 3.010 2.626 2.420 2.787 . 0 0 "[ . 1 . 2]" 1 1527 1 71 VAL H 1 71 VAL MG1 . . 3.980 3.764 3.742 3.780 . 0 0 "[ . 1 . 2]" 1 1528 1 71 VAL H 1 71 VAL QG . . 2.860 2.052 1.870 2.261 . 0 0 "[ . 1 . 2]" 1 1529 1 71 VAL H 1 71 VAL MG2 . . 3.980 2.062 1.875 2.279 . 0 0 "[ . 1 . 2]" 1 1530 1 71 VAL H 1 72 ARG H . . 3.090 2.857 2.690 3.000 . 0 0 "[ . 1 . 2]" 1 1531 1 71 VAL HA 1 71 VAL MG1 . . 3.300 2.376 2.238 2.463 . 0 0 "[ . 1 . 2]" 1 1532 1 71 VAL HA 1 71 VAL QG . . 2.880 2.111 2.045 2.179 . 0 0 "[ . 1 . 2]" 1 1533 1 71 VAL HA 1 71 VAL MG2 . . 3.300 2.367 2.272 2.468 . 0 0 "[ . 1 . 2]" 1 1534 1 71 VAL HA 1 73 VAL H . . 4.820 4.739 4.483 4.821 0.001 15 0 "[ . 1 . 2]" 1 1535 1 71 VAL HA 1 74 TYR H . . 4.090 3.971 3.845 4.065 . 0 0 "[ . 1 . 2]" 1 1536 1 71 VAL HA 1 74 TYR HB2 . . 4.250 4.173 3.967 4.255 0.005 16 0 "[ . 1 . 2]" 1 1537 1 71 VAL HA 1 74 TYR QB . . 3.420 3.306 3.152 3.422 0.002 15 0 "[ . 1 . 2]" 1 1538 1 71 VAL HA 1 74 TYR HB3 . . 4.250 3.468 3.269 3.620 . 0 0 "[ . 1 . 2]" 1 1539 1 71 VAL HA 1 74 TYR QD . . 4.990 4.726 4.396 4.941 . 0 0 "[ . 1 . 2]" 1 1540 1 71 VAL HA 1 75 SER H . . 4.910 4.701 4.384 4.908 . 0 0 "[ . 1 . 2]" 1 1541 1 71 VAL HB 1 72 ARG H . . 3.220 2.550 2.465 2.653 . 0 0 "[ . 1 . 2]" 1 1542 1 71 VAL QG 1 72 ARG H . . 3.450 3.186 3.046 3.280 . 0 0 "[ . 1 . 2]" 1 1543 1 71 VAL QG 1 72 ARG HA . . 4.850 3.445 3.214 3.699 . 0 0 "[ . 1 . 2]" 1 1544 1 71 VAL QG 1 74 TYR QB . . 4.450 3.956 3.780 4.090 . 0 0 "[ . 1 . 2]" 1 1545 1 71 VAL QG 1 75 SER H . . 5.140 4.481 4.205 4.800 . 0 0 "[ . 1 . 2]" 1 1546 1 71 VAL MG1 1 72 ARG H . . 4.050 3.431 3.175 3.620 . 0 0 "[ . 1 . 2]" 1 1547 1 71 VAL MG1 1 73 VAL H . . 5.500 5.165 4.879 5.341 . 0 0 "[ . 1 . 2]" 1 1548 1 71 VAL MG2 1 72 ARG H . . 4.050 3.794 3.703 3.923 . 0 0 "[ . 1 . 2]" 1 1549 1 71 VAL MG2 1 73 VAL H . . 5.500 5.445 5.306 5.501 0.001 17 0 "[ . 1 . 2]" 1 1550 1 72 ARG H 1 72 ARG HB2 . . 3.400 2.407 2.168 2.748 . 0 0 "[ . 1 . 2]" 1 1551 1 72 ARG H 1 72 ARG QB . . 2.870 2.232 2.147 2.283 . 0 0 "[ . 1 . 2]" 1 1552 1 72 ARG H 1 72 ARG HB3 . . 3.400 2.724 2.440 3.471 0.071 15 0 "[ . 1 . 2]" 1 1553 1 72 ARG H 1 72 ARG QD . . 4.820 4.390 2.384 4.791 . 0 0 "[ . 1 . 2]" 1 1554 1 72 ARG H 1 72 ARG HG2 . . 4.710 4.565 4.310 4.653 . 0 0 "[ . 1 . 2]" 1 1555 1 72 ARG H 1 72 ARG QG . . 4.070 3.960 3.559 4.058 . 0 0 "[ . 1 . 2]" 1 1556 1 72 ARG H 1 72 ARG HG3 . . 4.710 4.347 3.792 4.494 . 0 0 "[ . 1 . 2]" 1 1557 1 72 ARG H 1 73 VAL H . . 3.110 2.558 2.349 2.737 . 0 0 "[ . 1 . 2]" 1 1558 1 72 ARG H 1 73 VAL MG2 . . 4.340 3.887 3.751 4.059 . 0 0 "[ . 1 . 2]" 1 1559 1 72 ARG H 1 74 TYR H . . 4.460 4.202 3.974 4.460 0.000 16 0 "[ . 1 . 2]" 1 1560 1 72 ARG HA 1 72 ARG HD2 . . 5.020 4.001 2.265 4.581 . 0 0 "[ . 1 . 2]" 1 1561 1 72 ARG HA 1 72 ARG HD3 . . 5.020 4.069 2.551 4.792 . 0 0 "[ . 1 . 2]" 1 1562 1 72 ARG HA 1 72 ARG QG . . 3.680 2.421 2.139 2.744 . 0 0 "[ . 1 . 2]" 1 1563 1 72 ARG HA 1 74 TYR H . . 5.110 4.394 4.184 4.654 . 0 0 "[ . 1 . 2]" 1 1564 1 72 ARG HA 1 75 SER H . . 3.750 3.377 3.257 3.502 . 0 0 "[ . 1 . 2]" 1 1565 1 72 ARG HA 1 75 SER HB2 . . 4.050 3.132 2.413 4.062 0.012 16 0 "[ . 1 . 2]" 1 1566 1 72 ARG HA 1 75 SER HB3 . . 4.050 3.225 2.647 4.050 . 0 0 "[ . 1 . 2]" 1 1567 1 72 ARG HA 1 76 GLN H . . 4.770 4.480 3.973 4.728 . 0 0 "[ . 1 . 2]" 1 1568 1 72 ARG QB 1 72 ARG QD . . 3.180 2.297 2.049 2.695 . 0 0 "[ . 1 . 2]" 1 1569 1 72 ARG QB 1 73 VAL H . . 3.470 2.488 2.355 2.642 . 0 0 "[ . 1 . 2]" 1 1570 1 72 ARG QB 1 73 VAL MG2 . . 4.920 3.195 3.040 3.317 . 0 0 "[ . 1 . 2]" 1 1571 1 72 ARG HB2 1 72 ARG HD2 . . 4.070 2.828 2.089 3.532 . 0 0 "[ . 1 . 2]" 1 1572 1 72 ARG HB2 1 72 ARG HD3 . . 4.070 3.265 2.270 3.828 . 0 0 "[ . 1 . 2]" 1 1573 1 72 ARG HB3 1 72 ARG HD2 . . 4.070 3.137 2.273 4.156 0.086 16 0 "[ . 1 . 2]" 1 1574 1 72 ARG HB3 1 72 ARG HD3 . . 4.070 3.611 2.288 4.085 0.015 5 0 "[ . 1 . 2]" 1 1575 1 72 ARG QD 1 73 VAL H . . 5.330 4.823 4.288 5.237 . 0 0 "[ . 1 . 2]" 1 1576 1 72 ARG QG 1 75 SER H . . 5.340 4.705 4.488 5.109 . 0 0 "[ . 1 . 2]" 1 1577 1 72 ARG QG 1 76 GLN HG2 . . 4.750 2.973 2.281 4.371 . 0 0 "[ . 1 . 2]" 1 1578 1 73 VAL H 1 73 VAL HB . . 3.160 2.631 2.549 2.751 . 0 0 "[ . 1 . 2]" 1 1579 1 73 VAL H 1 73 VAL MG1 . . 3.770 3.762 3.744 3.767 . 0 0 "[ . 1 . 2]" 1 1580 1 73 VAL H 1 73 VAL MG2 . . 2.920 2.028 1.873 2.248 . 0 0 "[ . 1 . 2]" 1 1581 1 73 VAL H 1 74 TYR H . . 3.330 2.855 2.720 3.025 . 0 0 "[ . 1 . 2]" 1 1582 1 73 VAL H 1 75 SER H . . 4.770 4.240 4.133 4.405 . 0 0 "[ . 1 . 2]" 1 1583 1 73 VAL HA 1 73 VAL MG1 . . 3.220 2.348 2.229 2.456 . 0 0 "[ . 1 . 2]" 1 1584 1 73 VAL HA 1 73 VAL MG2 . . 3.310 2.382 2.314 2.456 . 0 0 "[ . 1 . 2]" 1 1585 1 73 VAL HA 1 76 GLN H . . 4.040 3.529 3.393 3.681 . 0 0 "[ . 1 . 2]" 1 1586 1 73 VAL HA 1 76 GLN HB2 . . 4.090 2.955 2.719 3.168 . 0 0 "[ . 1 . 2]" 1 1587 1 73 VAL HA 1 76 GLN HB3 . . 4.840 4.612 4.374 4.849 0.009 16 0 "[ . 1 . 2]" 1 1588 1 73 VAL HA 1 77 LEU H . . 4.520 4.064 3.704 4.378 . 0 0 "[ . 1 . 2]" 1 1589 1 73 VAL HB 1 74 TYR H . . 3.190 2.502 2.267 2.700 . 0 0 "[ . 1 . 2]" 1 1590 1 73 VAL HB 1 75 SER H . . 5.230 4.965 4.756 5.170 . 0 0 "[ . 1 . 2]" 1 1591 1 73 VAL MG1 1 74 TYR H . . 3.810 3.444 3.298 3.592 . 0 0 "[ . 1 . 2]" 1 1592 1 73 VAL MG1 1 74 TYR HA . . 4.310 3.555 3.316 3.797 . 0 0 "[ . 1 . 2]" 1 1593 1 73 VAL MG1 1 76 GLN H . . 4.820 4.464 4.194 4.805 . 0 0 "[ . 1 . 2]" 1 1594 1 73 VAL MG1 1 76 GLN HB2 . . 4.940 3.773 3.560 4.159 . 0 0 "[ . 1 . 2]" 1 1595 1 73 VAL MG1 1 77 LEU H . . 4.270 3.729 3.358 4.118 . 0 0 "[ . 1 . 2]" 1 1596 1 73 VAL MG1 1 77 LEU HB2 . . 4.400 3.759 3.418 3.939 . 0 0 "[ . 1 . 2]" 1 1597 1 73 VAL MG1 1 77 LEU HG . . 3.590 2.540 2.260 2.848 . 0 0 "[ . 1 . 2]" 1 1598 1 73 VAL MG2 1 74 TYR H . . 3.990 3.759 3.600 3.888 . 0 0 "[ . 1 . 2]" 1 1599 1 73 VAL MG2 1 76 GLN H . . 5.350 5.273 5.180 5.353 0.003 16 0 "[ . 1 . 2]" 1 1600 1 74 TYR H 1 74 TYR HB2 . . 3.090 2.542 2.472 2.645 . 0 0 "[ . 1 . 2]" 1 1601 1 74 TYR H 1 74 TYR HB3 . . 3.090 2.519 2.425 2.589 . 0 0 "[ . 1 . 2]" 1 1602 1 74 TYR H 1 74 TYR QD . . 4.240 4.193 4.178 4.198 . 0 0 "[ . 1 . 2]" 1 1603 1 74 TYR H 1 75 SER H . . 3.470 2.696 2.593 2.793 . 0 0 "[ . 1 . 2]" 1 1604 1 74 TYR H 1 75 SER HA . . 5.370 5.294 5.213 5.374 0.004 11 0 "[ . 1 . 2]" 1 1605 1 74 TYR HA 1 74 TYR QD . . 3.470 2.571 2.321 3.007 . 0 0 "[ . 1 . 2]" 1 1606 1 74 TYR HA 1 74 TYR QE . . 4.810 4.566 4.461 4.707 . 0 0 "[ . 1 . 2]" 1 1607 1 74 TYR HA 1 77 LEU H . . 3.930 3.381 3.124 3.832 . 0 0 "[ . 1 . 2]" 1 1608 1 74 TYR HA 1 77 LEU HB2 . . 3.790 2.378 2.127 2.703 . 0 0 "[ . 1 . 2]" 1 1609 1 74 TYR HA 1 77 LEU HB3 . . 4.400 3.904 3.660 4.214 . 0 0 "[ . 1 . 2]" 1 1610 1 74 TYR HA 1 77 LEU QD . . 3.720 2.620 2.089 3.000 . 0 0 "[ . 1 . 2]" 1 1611 1 74 TYR HA 1 78 THR H . . 4.770 3.956 3.578 4.773 0.003 16 0 "[ . 1 . 2]" 1 1612 1 74 TYR QB 1 75 SER H . . 3.120 2.587 2.459 2.713 . 0 0 "[ . 1 . 2]" 1 1613 1 74 TYR HB2 1 75 SER H . . 3.930 3.904 3.853 3.933 0.003 11 0 "[ . 1 . 2]" 1 1614 1 74 TYR HB3 1 75 SER H . . 3.930 2.626 2.488 2.765 . 0 0 "[ . 1 . 2]" 1 1615 1 74 TYR QD 1 75 SER H . . 4.130 3.692 3.382 4.043 . 0 0 "[ . 1 . 2]" 1 1616 1 74 TYR QD 1 75 SER HA . . 4.540 3.704 3.054 4.083 . 0 0 "[ . 1 . 2]" 1 1617 1 74 TYR QD 1 75 SER QB . . 5.090 4.289 3.854 4.973 . 0 0 "[ . 1 . 2]" 1 1618 1 74 TYR QD 1 77 LEU HB2 . . 5.320 3.884 3.264 4.468 . 0 0 "[ . 1 . 2]" 1 1619 1 74 TYR QD 1 77 LEU QD . . 4.440 3.378 2.911 4.143 . 0 0 "[ . 1 . 2]" 1 1620 1 74 TYR QD 1 78 THR MG . . 4.640 4.013 3.310 4.388 . 0 0 "[ . 1 . 2]" 1 1621 1 74 TYR QE 1 78 THR MG . . 4.440 3.908 3.035 4.437 . 0 0 "[ . 1 . 2]" 1 1622 1 75 SER H 1 75 SER HB2 . . 3.440 2.432 2.175 3.503 0.063 16 0 "[ . 1 . 2]" 1 1623 1 75 SER H 1 75 SER QB . . 2.830 2.202 2.149 2.259 . 0 0 "[ . 1 . 2]" 1 1624 1 75 SER H 1 75 SER HB3 . . 3.440 2.808 2.195 3.491 0.051 8 0 "[ . 1 . 2]" 1 1625 1 75 SER H 1 76 GLN H . . 3.350 2.654 2.521 2.799 . 0 0 "[ . 1 . 2]" 1 1626 1 75 SER H 1 76 GLN HG2 . . 4.820 4.526 4.227 4.821 0.001 16 0 "[ . 1 . 2]" 1 1627 1 75 SER H 1 77 LEU H . . 4.520 4.173 3.958 4.520 . 0 0 "[ . 1 . 2]" 1 1628 1 75 SER H 1 77 LEU HB2 . . 5.500 4.955 4.633 5.232 . 0 0 "[ . 1 . 2]" 1 1629 1 75 SER H 1 78 THR MG . . 5.500 4.558 4.188 4.993 . 0 0 "[ . 1 . 2]" 1 1630 1 75 SER HA 1 78 THR MG . . 4.590 2.669 2.248 3.308 . 0 0 "[ . 1 . 2]" 1 1631 1 75 SER QB 1 76 GLN H . . 3.200 2.801 2.537 3.215 0.015 16 0 "[ . 1 . 2]" 1 1632 1 76 GLN H 1 76 GLN HB2 . . 3.130 2.422 2.352 2.502 . 0 0 "[ . 1 . 2]" 1 1633 1 76 GLN H 1 76 GLN HB3 . . 3.650 3.606 3.577 3.640 . 0 0 "[ . 1 . 2]" 1 1634 1 76 GLN H 1 76 GLN HE21 . . 5.420 4.208 2.704 5.119 . 0 0 "[ . 1 . 2]" 1 1635 1 76 GLN H 1 76 GLN QE . . 4.750 3.976 2.677 4.639 . 0 0 "[ . 1 . 2]" 1 1636 1 76 GLN H 1 76 GLN HE22 . . 5.420 5.131 4.313 5.396 . 0 0 "[ . 1 . 2]" 1 1637 1 76 GLN H 1 76 GLN HG2 . . 3.220 2.565 2.307 2.728 . 0 0 "[ . 1 . 2]" 1 1638 1 76 GLN H 1 76 GLN HG3 . . 4.060 3.913 3.761 4.044 . 0 0 "[ . 1 . 2]" 1 1639 1 76 GLN H 1 77 LEU H . . 3.100 2.441 2.197 2.736 . 0 0 "[ . 1 . 2]" 1 1640 1 76 GLN H 1 77 LEU HB2 . . 4.770 4.263 4.082 4.466 . 0 0 "[ . 1 . 2]" 1 1641 1 76 GLN H 1 77 LEU HG . . 5.190 4.902 4.706 5.046 . 0 0 "[ . 1 . 2]" 1 1642 1 76 GLN HA 1 76 GLN HE21 . . 5.180 2.857 2.090 4.077 . 0 0 "[ . 1 . 2]" 1 1643 1 76 GLN HA 1 76 GLN QE . . 4.550 2.663 2.058 3.606 . 0 0 "[ . 1 . 2]" 1 1644 1 76 GLN HA 1 76 GLN HE22 . . 5.180 3.241 2.951 4.020 . 0 0 "[ . 1 . 2]" 1 1645 1 76 GLN HA 1 76 GLN HG2 . . 3.840 3.182 2.876 3.427 . 0 0 "[ . 1 . 2]" 1 1646 1 76 GLN HA 1 76 GLN HG3 . . 4.160 3.661 3.578 3.747 . 0 0 "[ . 1 . 2]" 1 1647 1 76 GLN HA 1 78 THR MG . . 5.500 4.432 3.496 5.503 0.003 6 0 "[ . 1 . 2]" 1 1648 1 76 GLN HA 1 79 MET ME . . 4.570 3.498 2.034 4.565 . 0 0 "[ . 1 . 2]" 1 1649 1 76 GLN HA 1 79 MET HG2 . . 4.510 3.494 2.003 4.487 . 0 0 "[ . 1 . 2]" 1 1650 1 76 GLN HA 1 79 MET QG . . 3.780 2.546 1.985 2.884 . 0 0 "[ . 1 . 2]" 1 1651 1 76 GLN HA 1 79 MET HG3 . . 4.510 2.906 2.230 4.508 . 0 0 "[ . 1 . 2]" 1 1652 1 76 GLN HB2 1 77 LEU H . . 3.620 2.643 2.254 3.018 . 0 0 "[ . 1 . 2]" 1 1653 1 76 GLN HB3 1 77 LEU H . . 3.940 3.612 3.269 3.929 . 0 0 "[ . 1 . 2]" 1 1654 1 76 GLN QE 1 79 MET ME . . 4.310 2.926 1.931 3.818 . 0 0 "[ . 1 . 2]" 1 1655 1 76 GLN HE21 1 79 MET ME . . 5.110 3.929 2.336 5.040 . 0 0 "[ . 1 . 2]" 1 1656 1 76 GLN HE22 1 79 MET ME . . 5.110 3.069 1.949 4.003 . 0 0 "[ . 1 . 2]" 1 1657 1 76 GLN HG2 1 77 LEU H . . 4.550 4.366 4.119 4.541 . 0 0 "[ . 1 . 2]" 1 1658 1 77 LEU H 1 77 LEU HB2 . . 3.150 2.225 2.162 2.364 . 0 0 "[ . 1 . 2]" 1 1659 1 77 LEU H 1 77 LEU HB3 . . 3.770 3.517 3.473 3.586 . 0 0 "[ . 1 . 2]" 1 1660 1 77 LEU H 1 77 LEU MD1 . . 4.570 3.659 3.509 3.773 . 0 0 "[ . 1 . 2]" 1 1661 1 77 LEU H 1 77 LEU QD . . 3.710 3.351 3.277 3.459 . 0 0 "[ . 1 . 2]" 1 1662 1 77 LEU H 1 77 LEU MD2 . . 4.570 3.898 3.717 4.073 . 0 0 "[ . 1 . 2]" 1 1663 1 77 LEU H 1 77 LEU HG . . 3.140 2.854 2.603 3.095 . 0 0 "[ . 1 . 2]" 1 1664 1 77 LEU H 1 78 THR H . . 3.480 2.845 2.480 3.141 . 0 0 "[ . 1 . 2]" 1 1665 1 77 LEU H 1 78 THR MG . . 4.920 4.043 3.589 4.490 . 0 0 "[ . 1 . 2]" 1 1666 1 77 LEU H 1 79 MET H . . 4.690 4.393 3.819 4.697 0.007 16 0 "[ . 1 . 2]" 1 1667 1 77 LEU HA 1 77 LEU MD1 . . 4.370 3.820 3.812 3.834 . 0 0 "[ . 1 . 2]" 1 1668 1 77 LEU HA 1 77 LEU QD . . 3.070 2.092 1.966 2.302 . 0 0 "[ . 1 . 2]" 1 1669 1 77 LEU HA 1 77 LEU MD2 . . 4.370 2.102 1.972 2.321 . 0 0 "[ . 1 . 2]" 1 1670 1 77 LEU HA 1 77 LEU HG . . 3.940 2.709 2.619 2.791 . 0 0 "[ . 1 . 2]" 1 1671 1 77 LEU HA 1 80 GLN H . . 3.730 3.548 3.352 3.705 . 0 0 "[ . 1 . 2]" 1 1672 1 77 LEU HA 1 80 GLN HB2 . . 3.950 3.545 2.980 3.886 . 0 0 "[ . 1 . 2]" 1 1673 1 77 LEU HA 1 80 GLN HB3 . . 4.080 3.365 2.853 3.802 . 0 0 "[ . 1 . 2]" 1 1674 1 77 LEU HA 1 81 LYS H . . 4.980 4.231 3.987 4.552 . 0 0 "[ . 1 . 2]" 1 1675 1 77 LEU HB2 1 78 THR H . . 3.720 2.660 2.393 3.133 . 0 0 "[ . 1 . 2]" 1 1676 1 77 LEU HB3 1 77 LEU MD1 . . 3.550 2.423 2.331 2.548 . 0 0 "[ . 1 . 2]" 1 1677 1 77 LEU HB3 1 77 LEU QD . . 3.080 2.091 2.018 2.153 . 0 0 "[ . 1 . 2]" 1 1678 1 77 LEU HB3 1 77 LEU MD2 . . 3.550 2.290 2.166 2.367 . 0 0 "[ . 1 . 2]" 1 1679 1 77 LEU HB3 1 78 THR H . . 4.130 3.106 2.716 3.640 . 0 0 "[ . 1 . 2]" 1 1680 1 77 LEU HB3 1 78 THR HA . . 4.990 3.981 3.838 4.183 . 0 0 "[ . 1 . 2]" 1 1681 1 77 LEU HB3 1 80 GLN H . . 5.290 5.109 4.959 5.242 . 0 0 "[ . 1 . 2]" 1 1682 1 77 LEU QD 1 78 THR H . . 4.730 4.005 3.763 4.310 . 0 0 "[ . 1 . 2]" 1 1683 1 77 LEU QD 1 80 GLN HB2 . . 4.480 4.182 3.572 4.470 . 0 0 "[ . 1 . 2]" 1 1684 1 77 LEU QD 1 80 GLN HB3 . . 4.650 3.562 3.053 3.822 . 0 0 "[ . 1 . 2]" 1 1685 1 77 LEU HG 1 78 THR H . . 5.220 4.728 4.611 4.898 . 0 0 "[ . 1 . 2]" 1 1686 1 78 THR H 1 78 THR HB . . 3.620 2.913 2.299 3.626 0.006 4 0 "[ . 1 . 2]" 1 1687 1 78 THR H 1 78 THR MG . . 3.620 2.240 1.951 2.610 . 0 0 "[ . 1 . 2]" 1 1688 1 78 THR H 1 79 MET H . . 3.370 2.894 2.610 3.157 . 0 0 "[ . 1 . 2]" 1 1689 1 78 THR H 1 79 MET QB . . 5.140 4.885 4.741 5.058 . 0 0 "[ . 1 . 2]" 1 1690 1 78 THR H 1 80 GLN H . . 4.690 4.226 3.855 4.576 . 0 0 "[ . 1 . 2]" 1 1691 1 78 THR H 1 81 LYS QB . . 5.340 4.778 4.331 5.327 . 0 0 "[ . 1 . 2]" 1 1692 1 78 THR HA 1 78 THR MG . . 3.280 2.876 2.271 3.206 . 0 0 "[ . 1 . 2]" 1 1693 1 78 THR HA 1 80 GLN H . . 4.550 4.148 3.783 4.530 . 0 0 "[ . 1 . 2]" 1 1694 1 78 THR HA 1 81 LYS H . . 4.750 3.382 3.121 3.627 . 0 0 "[ . 1 . 2]" 1 1695 1 78 THR HA 1 81 LYS QB . . 3.520 2.454 2.089 2.888 . 0 0 "[ . 1 . 2]" 1 1696 1 78 THR HA 1 81 LYS HD2 . . 5.210 3.997 2.718 4.881 . 0 0 "[ . 1 . 2]" 1 1697 1 78 THR HA 1 81 LYS QD . . 4.470 3.204 1.985 4.478 0.008 16 0 "[ . 1 . 2]" 1 1698 1 78 THR HA 1 81 LYS HD3 . . 5.210 3.810 1.998 5.207 . 0 0 "[ . 1 . 2]" 1 1699 1 78 THR HA 1 81 LYS HE2 . . 5.500 4.104 2.165 5.495 . 0 0 "[ . 1 . 2]" 1 1700 1 78 THR HA 1 81 LYS HE3 . . 5.500 3.915 2.134 5.139 . 0 0 "[ . 1 . 2]" 1 1701 1 78 THR HA 1 81 LYS QG . . 5.260 3.662 2.781 4.238 . 0 0 "[ . 1 . 2]" 1 1702 1 78 THR HB 1 79 MET H . . 3.800 3.655 3.096 3.801 0.001 8 0 "[ . 1 . 2]" 1 1703 1 78 THR MG 1 79 MET H . . 4.080 2.611 1.775 3.885 . 0 0 "[ . 1 . 2]" 1 1704 1 78 THR MG 1 79 MET HA . . 5.500 3.987 2.868 5.386 . 0 0 "[ . 1 . 2]" 1 1705 1 78 THR MG 1 80 GLN H . . 5.110 4.525 4.035 5.112 0.002 6 0 "[ . 1 . 2]" 1 1706 1 78 THR MG 1 81 LYS QB . . 4.810 4.461 3.826 4.810 . 0 0 "[ . 1 . 2]" 1 1707 1 78 THR MG 1 82 ALA H . . 5.290 4.998 4.701 5.220 . 0 0 "[ . 1 . 2]" 1 1708 1 78 THR MG 1 82 ALA MB . . 4.690 4.502 3.992 4.696 0.006 16 0 "[ . 1 . 2]" 1 1709 1 79 MET H 1 79 MET QB . . 2.790 2.520 2.321 2.639 . 0 0 "[ . 1 . 2]" 1 1710 1 79 MET H 1 79 MET ME . . 4.750 4.383 3.663 4.741 . 0 0 "[ . 1 . 2]" 1 1711 1 79 MET H 1 79 MET HG2 . . 3.930 2.400 1.919 2.977 . 0 0 "[ . 1 . 2]" 1 1712 1 79 MET H 1 79 MET QG . . 3.270 2.138 1.905 2.542 . 0 0 "[ . 1 . 2]" 1 1713 1 79 MET H 1 79 MET HG3 . . 3.930 2.897 2.033 3.474 . 0 0 "[ . 1 . 2]" 1 1714 1 79 MET H 1 80 GLN H . . 3.220 2.804 2.549 3.024 . 0 0 "[ . 1 . 2]" 1 1715 1 79 MET H 1 81 LYS H . . 5.040 4.414 3.832 4.740 . 0 0 "[ . 1 . 2]" 1 1716 1 79 MET H 1 81 LYS QB . . 5.340 5.036 4.649 5.342 0.002 16 0 "[ . 1 . 2]" 1 1717 1 79 MET HA 1 79 MET QG . . 3.740 2.730 2.283 3.338 . 0 0 "[ . 1 . 2]" 1 1718 1 79 MET HA 1 82 ALA H . . 4.390 4.016 3.568 4.382 . 0 0 "[ . 1 . 2]" 1 1719 1 79 MET HA 1 82 ALA MB . . 3.390 3.186 2.956 3.380 . 0 0 "[ . 1 . 2]" 1 1720 1 79 MET HB2 1 80 GLN H . . 4.370 2.938 2.369 4.161 . 0 0 "[ . 1 . 2]" 1 1721 1 79 MET HB3 1 80 GLN H . . 4.370 3.773 3.424 4.055 . 0 0 "[ . 1 . 2]" 1 1722 1 79 MET QG 1 80 GLN H . . 4.160 3.643 1.941 4.158 . 0 0 "[ . 1 . 2]" 1 1723 1 79 MET HG2 1 80 GLN H . . 4.870 4.224 2.717 4.859 . 0 0 "[ . 1 . 2]" 1 1724 1 79 MET HG3 1 80 GLN H . . 4.870 4.090 1.986 4.871 0.001 4 0 "[ . 1 . 2]" 1 1725 1 80 GLN H 1 80 GLN HB2 . . 3.050 2.432 2.308 2.590 . 0 0 "[ . 1 . 2]" 1 1726 1 80 GLN H 1 80 GLN HB3 . . 2.950 2.704 2.511 2.834 . 0 0 "[ . 1 . 2]" 1 1727 1 80 GLN H 1 81 LYS H . . 3.370 2.572 2.366 2.774 . 0 0 "[ . 1 . 2]" 1 1728 1 80 GLN H 1 81 LYS QB . . 4.600 4.350 4.067 4.564 . 0 0 "[ . 1 . 2]" 1 1729 1 80 GLN H 1 82 ALA H . . 4.550 4.150 3.765 4.494 . 0 0 "[ . 1 . 2]" 1 1730 1 80 GLN H 1 83 PHE HB3 . . 5.040 4.918 4.616 5.032 . 0 0 "[ . 1 . 2]" 1 1731 1 80 GLN HA 1 80 GLN QE . . 5.340 4.003 3.352 4.600 . 0 0 "[ . 1 . 2]" 1 1732 1 80 GLN HA 1 82 ALA H . . 4.730 4.565 4.133 4.728 . 0 0 "[ . 1 . 2]" 1 1733 1 80 GLN HA 1 83 PHE H . . 3.880 3.412 3.280 3.533 . 0 0 "[ . 1 . 2]" 1 1734 1 80 GLN HA 1 83 PHE HB2 . . 4.050 3.679 3.478 3.843 . 0 0 "[ . 1 . 2]" 1 1735 1 80 GLN HA 1 83 PHE HB3 . . 3.940 2.457 2.326 2.611 . 0 0 "[ . 1 . 2]" 1 1736 1 80 GLN HA 1 83 PHE QD . . 4.940 3.323 2.873 3.761 . 0 0 "[ . 1 . 2]" 1 1737 1 80 GLN HA 1 84 LEU H . . 4.580 4.242 3.937 4.559 . 0 0 "[ . 1 . 2]" 1 1738 1 80 GLN HB2 1 81 LYS H . . 3.910 3.625 3.390 3.896 . 0 0 "[ . 1 . 2]" 1 1739 1 80 GLN HB3 1 81 LYS H . . 3.720 2.421 2.156 2.914 . 0 0 "[ . 1 . 2]" 1 1740 1 80 GLN HB3 1 82 ALA H . . 5.390 5.056 4.814 5.344 . 0 0 "[ . 1 . 2]" 1 1741 1 80 GLN HB3 1 83 PHE H . . 5.500 5.276 5.042 5.459 . 0 0 "[ . 1 . 2]" 1 1742 1 80 GLN QE 1 80 GLN QG . . 3.060 2.200 2.087 2.225 . 0 0 "[ . 1 . 2]" 1 1743 1 80 GLN QE 1 83 PHE QE . . 4.390 3.654 3.227 4.070 . 0 0 "[ . 1 . 2]" 1 1744 1 80 GLN QE 1 84 LEU MD2 . . 4.030 3.518 3.056 3.968 . 0 0 "[ . 1 . 2]" 1 1745 1 80 GLN QE 1 84 LEU HG . . 4.410 4.141 3.569 4.404 . 0 0 "[ . 1 . 2]" 1 1746 1 80 GLN QG 1 81 LYS H . . 4.570 3.780 3.632 4.169 . 0 0 "[ . 1 . 2]" 1 1747 1 80 GLN QG 1 83 PHE H . . 4.990 4.795 4.368 4.940 . 0 0 "[ . 1 . 2]" 1 1748 1 80 GLN QG 1 84 LEU MD1 . . 4.100 2.430 1.971 2.959 . 0 0 "[ . 1 . 2]" 1 1749 1 80 GLN QG 1 84 LEU MD2 . . 4.340 3.438 2.979 3.845 . 0 0 "[ . 1 . 2]" 1 1750 1 80 GLN QG 1 84 LEU HG . . 4.670 2.822 2.433 3.140 . 0 0 "[ . 1 . 2]" 1 1751 1 80 GLN HG2 1 81 LYS H . . 5.240 4.527 4.366 4.775 . 0 0 "[ . 1 . 2]" 1 1752 1 80 GLN HG3 1 81 LYS H . . 5.240 4.062 3.818 4.866 . 0 0 "[ . 1 . 2]" 1 1753 1 81 LYS H 1 81 LYS QB . . 2.960 2.315 2.180 2.521 . 0 0 "[ . 1 . 2]" 1 1754 1 81 LYS H 1 81 LYS HD2 . . 5.500 4.489 3.608 5.029 . 0 0 "[ . 1 . 2]" 1 1755 1 81 LYS H 1 81 LYS QD . . 4.750 3.907 3.212 4.546 . 0 0 "[ . 1 . 2]" 1 1756 1 81 LYS H 1 81 LYS HD3 . . 5.500 4.413 3.374 5.254 . 0 0 "[ . 1 . 2]" 1 1757 1 81 LYS H 1 81 LYS HG2 . . 4.270 3.703 3.211 4.160 . 0 0 "[ . 1 . 2]" 1 1758 1 81 LYS H 1 81 LYS QG . . 3.430 2.502 2.055 2.874 . 0 0 "[ . 1 . 2]" 1 1759 1 81 LYS H 1 81 LYS HG3 . . 4.270 2.550 2.068 2.929 . 0 0 "[ . 1 . 2]" 1 1760 1 81 LYS H 1 82 ALA H . . 3.530 2.862 2.665 3.045 . 0 0 "[ . 1 . 2]" 1 1761 1 81 LYS H 1 82 ALA MB . . 4.650 4.450 4.235 4.558 . 0 0 "[ . 1 . 2]" 1 1762 1 81 LYS H 1 83 PHE H . . 4.980 4.055 3.827 4.249 . 0 0 "[ . 1 . 2]" 1 1763 1 81 LYS H 1 84 LEU MD1 . . 4.820 4.028 3.507 4.707 . 0 0 "[ . 1 . 2]" 1 1764 1 81 LYS HA 1 81 LYS HD2 . . 5.290 4.462 3.964 4.855 . 0 0 "[ . 1 . 2]" 1 1765 1 81 LYS HA 1 81 LYS QD . . 4.540 3.972 3.672 4.183 . 0 0 "[ . 1 . 2]" 1 1766 1 81 LYS HA 1 81 LYS HD3 . . 5.290 4.489 4.083 4.685 . 0 0 "[ . 1 . 2]" 1 1767 1 81 LYS HA 1 81 LYS HG2 . . 4.000 2.528 2.205 2.819 . 0 0 "[ . 1 . 2]" 1 1768 1 81 LYS HA 1 81 LYS QG . . 3.450 2.318 2.167 2.479 . 0 0 "[ . 1 . 2]" 1 1769 1 81 LYS HA 1 81 LYS HG3 . . 4.000 2.829 2.389 3.229 . 0 0 "[ . 1 . 2]" 1 1770 1 81 LYS HA 1 82 ALA MB . . 5.440 5.029 4.996 5.042 . 0 0 "[ . 1 . 2]" 1 1771 1 81 LYS HA 1 83 PHE H . . 4.820 4.209 3.838 4.444 . 0 0 "[ . 1 . 2]" 1 1772 1 81 LYS HA 1 84 LEU H . . 3.860 3.506 3.365 3.734 . 0 0 "[ . 1 . 2]" 1 1773 1 81 LYS HA 1 84 LEU HB2 . . 4.070 3.002 2.759 3.175 . 0 0 "[ . 1 . 2]" 1 1774 1 81 LYS HA 1 84 LEU HB3 . . 4.790 4.616 4.356 4.763 . 0 0 "[ . 1 . 2]" 1 1775 1 81 LYS HA 1 84 LEU MD1 . . 3.620 2.333 1.980 2.976 . 0 0 "[ . 1 . 2]" 1 1776 1 81 LYS HA 1 84 LEU HG . . 4.200 3.750 3.291 4.094 . 0 0 "[ . 1 . 2]" 1 1777 1 81 LYS HA 1 85 GLU H . . 4.410 4.241 3.945 4.406 . 0 0 "[ . 1 . 2]" 1 1778 1 81 LYS QB 1 81 LYS QD . . 3.320 2.141 2.041 2.252 . 0 0 "[ . 1 . 2]" 1 1779 1 81 LYS QB 1 82 ALA H . . 3.440 2.467 2.268 2.778 . 0 0 "[ . 1 . 2]" 1 1780 1 81 LYS QB 1 82 ALA MB . . 4.200 3.729 3.645 3.799 . 0 0 "[ . 1 . 2]" 1 1781 1 81 LYS QB 1 83 PHE H . . 4.840 4.471 4.339 4.604 . 0 0 "[ . 1 . 2]" 1 1782 1 81 LYS HB2 1 83 PHE H . . 5.500 4.861 4.696 5.041 . 0 0 "[ . 1 . 2]" 1 1783 1 81 LYS HB3 1 83 PHE H . . 5.500 5.226 5.039 5.465 . 0 0 "[ . 1 . 2]" 1 1784 1 81 LYS QE 1 81 LYS QG . . 3.280 2.215 2.061 2.520 . 0 0 "[ . 1 . 2]" 1 1785 1 82 ALA H 1 82 ALA MB . . 2.970 2.129 2.026 2.232 . 0 0 "[ . 1 . 2]" 1 1786 1 82 ALA H 1 83 PHE HB3 . . 5.110 4.630 4.377 4.864 . 0 0 "[ . 1 . 2]" 1 1787 1 82 ALA H 1 84 LEU H . . 5.040 4.262 4.006 4.438 . 0 0 "[ . 1 . 2]" 1 1788 1 82 ALA H 1 85 GLU H . . 5.500 4.916 4.697 5.112 . 0 0 "[ . 1 . 2]" 1 1789 1 82 ALA H 1 85 GLU QG . . 5.340 4.574 4.270 4.991 . 0 0 "[ . 1 . 2]" 1 1790 1 82 ALA HA 1 84 LEU H . . 4.820 4.415 3.956 4.692 . 0 0 "[ . 1 . 2]" 1 1791 1 82 ALA HA 1 85 GLU H . . 3.850 3.588 3.327 3.801 . 0 0 "[ . 1 . 2]" 1 1792 1 82 ALA HA 1 85 GLU QB . . 3.550 2.983 2.486 3.424 . 0 0 "[ . 1 . 2]" 1 1793 1 82 ALA HA 1 85 GLU QG . . 4.640 2.742 1.991 3.196 . 0 0 "[ . 1 . 2]" 1 1794 1 82 ALA MB 1 83 PHE H . . 3.320 2.787 2.608 3.109 . 0 0 "[ . 1 . 2]" 1 1795 1 82 ALA MB 1 83 PHE HA . . 4.950 3.815 3.686 3.932 . 0 0 "[ . 1 . 2]" 1 1796 1 82 ALA MB 1 83 PHE HB2 . . 4.940 4.361 4.216 4.451 . 0 0 "[ . 1 . 2]" 1 1797 1 82 ALA MB 1 85 GLU QB . . 4.640 4.138 3.800 4.644 0.004 17 0 "[ . 1 . 2]" 1 1798 1 82 ALA MB 1 85 GLU QG . . 4.680 4.119 3.300 4.578 . 0 0 "[ . 1 . 2]" 1 1799 1 83 PHE H 1 83 PHE HB2 . . 3.170 2.911 2.691 3.103 . 0 0 "[ . 1 . 2]" 1 1800 1 83 PHE H 1 83 PHE HB3 . . 3.120 2.246 2.196 2.388 . 0 0 "[ . 1 . 2]" 1 1801 1 83 PHE H 1 83 PHE QD . . 4.340 4.034 3.879 4.169 . 0 0 "[ . 1 . 2]" 1 1802 1 83 PHE H 1 84 LEU H . . 3.310 2.569 2.202 2.740 . 0 0 "[ . 1 . 2]" 1 1803 1 83 PHE H 1 84 LEU HG . . 4.620 4.395 3.823 4.605 . 0 0 "[ . 1 . 2]" 1 1804 1 83 PHE H 1 85 GLU QG . . 5.340 4.881 3.925 5.317 . 0 0 "[ . 1 . 2]" 1 1805 1 83 PHE HA 1 83 PHE QD . . 3.940 2.693 2.381 3.198 . 0 0 "[ . 1 . 2]" 1 1806 1 83 PHE HA 1 85 GLU H . . 4.770 4.507 4.246 4.722 . 0 0 "[ . 1 . 2]" 1 1807 1 83 PHE HA 1 86 LYS H . . 4.110 3.826 3.511 4.119 0.009 17 0 "[ . 1 . 2]" 1 1808 1 83 PHE HA 1 86 LYS HD2 . . 5.500 4.273 3.158 5.407 . 0 0 "[ . 1 . 2]" 1 1809 1 83 PHE HA 1 86 LYS HD3 . . 5.500 4.102 2.148 5.502 0.002 5 0 "[ . 1 . 2]" 1 1810 1 83 PHE HA 1 86 LYS QE . . 5.340 3.843 2.053 5.239 . 0 0 "[ . 1 . 2]" 1 1811 1 83 PHE HA 1 86 LYS QG . . 5.110 3.120 2.207 4.881 . 0 0 "[ . 1 . 2]" 1 1812 1 83 PHE HB2 1 84 LEU H . . 4.350 4.075 3.908 4.328 . 0 0 "[ . 1 . 2]" 1 1813 1 83 PHE HB3 1 84 LEU H . . 3.460 2.797 2.539 3.237 . 0 0 "[ . 1 . 2]" 1 1814 1 83 PHE QD 1 84 LEU H . . 4.110 3.365 2.692 3.921 . 0 0 "[ . 1 . 2]" 1 1815 1 83 PHE QD 1 84 LEU HA . . 4.690 3.791 2.930 4.203 . 0 0 "[ . 1 . 2]" 1 1816 1 83 PHE QD 1 84 LEU MD2 . . 3.810 3.191 2.536 3.781 . 0 0 "[ . 1 . 2]" 1 1817 1 83 PHE QD 1 84 LEU HG . . 4.400 2.764 2.024 3.435 . 0 0 "[ . 1 . 2]" 1 1818 1 83 PHE QE 1 84 LEU MD2 . . 4.250 3.130 2.190 4.142 . 0 0 "[ . 1 . 2]" 1 1819 1 84 LEU H 1 84 LEU HB2 . . 3.160 2.454 2.374 2.531 . 0 0 "[ . 1 . 2]" 1 1820 1 84 LEU H 1 84 LEU HB3 . . 3.690 3.590 3.569 3.634 . 0 0 "[ . 1 . 2]" 1 1821 1 84 LEU H 1 84 LEU MD1 . . 3.880 3.363 3.164 3.635 . 0 0 "[ . 1 . 2]" 1 1822 1 84 LEU H 1 84 LEU MD2 . . 3.870 3.684 3.349 3.871 0.001 17 0 "[ . 1 . 2]" 1 1823 1 84 LEU H 1 84 LEU HG . . 3.010 2.368 2.176 2.693 . 0 0 "[ . 1 . 2]" 1 1824 1 84 LEU H 1 85 GLU H . . 3.290 2.627 2.269 2.879 . 0 0 "[ . 1 . 2]" 1 1825 1 84 LEU H 1 85 GLU QG . . 4.750 4.265 3.394 4.675 . 0 0 "[ . 1 . 2]" 1 1826 1 84 LEU H 1 86 LYS H . . 4.620 4.273 3.982 4.575 . 0 0 "[ . 1 . 2]" 1 1827 1 84 LEU HA 1 84 LEU MD1 . . 4.400 3.908 3.879 3.935 . 0 0 "[ . 1 . 2]" 1 1828 1 84 LEU HA 1 84 LEU MD2 . . 2.940 2.295 1.982 2.559 . 0 0 "[ . 1 . 2]" 1 1829 1 84 LEU HA 1 84 LEU HG . . 3.830 2.886 2.743 3.038 . 0 0 "[ . 1 . 2]" 1 1830 1 84 LEU HA 1 86 LYS H . . 4.580 4.229 3.691 4.556 . 0 0 "[ . 1 . 2]" 1 1831 1 84 LEU HA 1 87 GLN H . . 4.380 3.544 2.924 4.323 . 0 0 "[ . 1 . 2]" 1 1832 1 84 LEU HA 1 87 GLN HB2 . . 4.420 2.679 2.014 4.456 0.036 5 0 "[ . 1 . 2]" 1 1833 1 84 LEU HA 1 87 GLN QB . . 3.790 2.498 1.952 3.833 0.043 5 0 "[ . 1 . 2]" 1 1834 1 84 LEU HA 1 87 GLN HB3 . . 4.420 3.551 2.002 4.420 0.000 4 0 "[ . 1 . 2]" 1 1835 1 84 LEU HA 1 87 GLN HG2 . . 4.750 3.921 1.998 4.718 . 0 0 "[ . 1 . 2]" 1 1836 1 84 LEU HA 1 87 GLN QG . . 4.100 3.096 1.795 4.101 0.001 6 0 "[ . 1 . 2]" 1 1837 1 84 LEU HA 1 87 GLN HG3 . . 4.750 3.426 2.000 4.744 . 0 0 "[ . 1 . 2]" 1 1838 1 84 LEU HB2 1 84 LEU MD1 . . 3.490 2.109 1.989 2.256 . 0 0 "[ . 1 . 2]" 1 1839 1 84 LEU HB2 1 84 LEU MD2 . . 3.470 3.156 3.124 3.190 . 0 0 "[ . 1 . 2]" 1 1840 1 84 LEU HB2 1 85 GLU H . . 3.450 2.579 2.318 2.845 . 0 0 "[ . 1 . 2]" 1 1841 1 84 LEU HB3 1 84 LEU MD1 . . 3.490 2.572 2.451 2.678 . 0 0 "[ . 1 . 2]" 1 1842 1 84 LEU HB3 1 84 LEU MD2 . . 3.270 2.202 2.061 2.370 . 0 0 "[ . 1 . 2]" 1 1843 1 84 LEU HB3 1 85 GLU H . . 3.860 3.588 3.310 3.851 . 0 0 "[ . 1 . 2]" 1 1844 1 84 LEU HB3 1 85 GLU HA . . 4.750 4.382 4.210 4.559 . 0 0 "[ . 1 . 2]" 1 1845 1 84 LEU MD1 1 85 GLU H . . 4.420 4.266 3.936 4.420 0.000 6 0 "[ . 1 . 2]" 1 1846 1 84 LEU MD2 1 85 GLU H . . 5.500 4.773 4.660 4.907 . 0 0 "[ . 1 . 2]" 1 1847 1 84 LEU MD2 1 87 GLN QE . . 4.500 2.527 1.984 3.784 . 0 0 "[ . 1 . 2]" 1 1848 1 84 LEU MD2 1 87 GLN HG2 . . 5.500 4.364 2.892 5.252 . 0 0 "[ . 1 . 2]" 1 1849 1 84 LEU MD2 1 87 GLN HG3 . . 5.500 4.020 2.791 5.222 . 0 0 "[ . 1 . 2]" 1 1850 1 84 LEU HG 1 87 GLN QE . . 5.340 4.463 3.395 5.341 0.001 17 0 "[ . 1 . 2]" 1 1851 1 85 GLU H 1 85 GLU QB . . 2.800 2.423 2.222 2.583 . 0 0 "[ . 1 . 2]" 1 1852 1 85 GLU H 1 85 GLU HG2 . . 3.730 2.848 1.951 3.707 . 0 0 "[ . 1 . 2]" 1 1853 1 85 GLU H 1 85 GLU QG . . 3.270 2.298 1.938 2.669 . 0 0 "[ . 1 . 2]" 1 1854 1 85 GLU H 1 85 GLU HG3 . . 3.730 2.894 2.214 3.737 0.007 6 0 "[ . 1 . 2]" 1 1855 1 85 GLU H 1 86 LYS H . . 3.180 2.868 2.612 3.136 . 0 0 "[ . 1 . 2]" 1 1856 1 85 GLU HA 1 85 GLU HG2 . . 4.070 2.731 2.280 3.864 . 0 0 "[ . 1 . 2]" 1 1857 1 85 GLU HA 1 85 GLU QG . . 3.500 2.589 2.228 3.335 . 0 0 "[ . 1 . 2]" 1 1858 1 85 GLU HA 1 85 GLU HG3 . . 4.070 3.390 2.722 3.819 . 0 0 "[ . 1 . 2]" 1 1859 1 85 GLU QB 1 86 LYS H . . 3.860 2.674 2.260 3.332 . 0 0 "[ . 1 . 2]" 1 1860 1 85 GLU HB2 1 86 LYS H . . 4.620 2.800 2.299 3.896 . 0 0 "[ . 1 . 2]" 1 1861 1 85 GLU HB2 1 86 LYS HA . . 5.500 4.569 4.329 4.835 . 0 0 "[ . 1 . 2]" 1 1862 1 85 GLU HB3 1 86 LYS H . . 4.620 3.549 3.278 4.021 . 0 0 "[ . 1 . 2]" 1 1863 1 85 GLU HB3 1 86 LYS HA . . 5.500 4.556 4.204 5.606 0.106 17 0 "[ . 1 . 2]" 1 1864 1 85 GLU QG 1 86 LYS H . . 4.250 3.800 1.819 4.245 . 0 0 "[ . 1 . 2]" 1 1865 1 85 GLU HG2 1 86 LYS H . . 5.040 4.372 2.035 5.040 . 0 0 "[ . 1 . 2]" 1 1866 1 85 GLU HG3 1 86 LYS H . . 5.040 4.240 1.897 5.033 . 0 0 "[ . 1 . 2]" 1 1867 1 86 LYS H 1 86 LYS HB2 . . 4.190 3.253 2.297 3.758 . 0 0 "[ . 1 . 2]" 1 1868 1 86 LYS H 1 86 LYS QB . . 3.580 2.587 2.270 2.944 . 0 0 "[ . 1 . 2]" 1 1869 1 86 LYS H 1 86 LYS HB3 . . 4.190 3.043 2.311 3.744 . 0 0 "[ . 1 . 2]" 1 1870 1 86 LYS H 1 86 LYS HD2 . . 5.500 4.478 2.795 4.961 . 0 0 "[ . 1 . 2]" 1 1871 1 86 LYS H 1 86 LYS HD3 . . 5.500 4.243 1.868 4.938 . 0 0 "[ . 1 . 2]" 1 1872 1 86 LYS H 1 86 LYS HG2 . . 3.720 2.848 1.983 3.708 . 0 0 "[ . 1 . 2]" 1 1873 1 86 LYS H 1 86 LYS QG . . 3.250 2.272 1.965 2.563 . 0 0 "[ . 1 . 2]" 1 1874 1 86 LYS H 1 86 LYS HG3 . . 3.720 2.781 2.184 3.678 . 0 0 "[ . 1 . 2]" 1 1875 1 86 LYS H 1 87 GLN H . . 3.400 2.779 2.344 3.227 . 0 0 "[ . 1 . 2]" 1 1876 1 86 LYS HA 1 86 LYS HD2 . . 5.500 4.855 4.094 5.501 0.001 11 0 "[ . 1 . 2]" 1 1877 1 86 LYS HA 1 86 LYS QD . . 4.680 4.161 3.516 4.463 . 0 0 "[ . 1 . 2]" 1 1878 1 86 LYS HA 1 86 LYS HD3 . . 5.500 4.625 3.606 5.502 0.002 3 0 "[ . 1 . 2]" 1 1879 1 86 LYS HA 1 86 LYS QG . . 3.600 3.041 2.301 3.449 . 0 0 "[ . 1 . 2]" 1 1880 1 86 LYS QG 1 87 GLN H . . 4.580 3.606 1.957 4.458 . 0 0 "[ . 1 . 2]" 1 1881 1 87 GLN H 1 87 GLN HB2 . . 3.620 2.566 2.178 3.604 . 0 0 "[ . 1 . 2]" 1 1882 1 87 GLN H 1 87 GLN QB . . 2.990 2.338 2.134 2.579 . 0 0 "[ . 1 . 2]" 1 1883 1 87 GLN H 1 87 GLN HB3 . . 3.620 3.084 2.527 3.623 0.003 17 0 "[ . 1 . 2]" 1 1884 1 87 GLN H 1 87 GLN HG2 . . 5.160 3.802 1.956 4.690 . 0 0 "[ . 1 . 2]" 1 1885 1 87 GLN H 1 87 GLN QG . . 4.490 3.255 1.943 4.093 . 0 0 "[ . 1 . 2]" 1 1886 1 87 GLN H 1 87 GLN HG3 . . 5.160 3.744 2.419 4.660 . 0 0 "[ . 1 . 2]" 1 1887 1 87 GLN HA 1 87 GLN HG2 . . 4.180 2.938 2.252 3.901 . 0 0 "[ . 1 . 2]" 1 1888 1 87 GLN HA 1 87 GLN QG . . 3.590 2.504 2.156 3.340 . 0 0 "[ . 1 . 2]" 1 1889 1 87 GLN HA 1 87 GLN HG3 . . 4.180 2.975 2.198 3.855 . 0 0 "[ . 1 . 2]" 1 1890 1 87 GLN QB 1 88 GLN H . . 3.830 2.756 2.121 3.785 . 0 0 "[ . 1 . 2]" 1 1891 1 88 GLN H 1 88 GLN HB2 . . 4.160 3.098 2.227 3.977 . 0 0 "[ . 1 . 2]" 1 1892 1 88 GLN H 1 88 GLN HB3 . . 4.160 3.248 2.525 4.040 . 0 0 "[ . 1 . 2]" 1 1893 1 88 GLN H 1 88 GLN HG2 . . 5.260 3.356 1.906 5.227 . 0 0 "[ . 1 . 2]" 1 1894 1 88 GLN H 1 88 GLN QG . . 4.540 3.030 1.894 4.390 . 0 0 "[ . 1 . 2]" 1 1895 1 88 GLN H 1 88 GLN HG3 . . 5.260 3.824 2.635 4.718 . 0 0 "[ . 1 . 2]" 1 1896 1 92 GLU HB2 1 93 LEU H . . 4.920 3.923 2.339 4.650 . 0 0 "[ . 1 . 2]" 1 1897 1 92 GLU HB3 1 93 LEU H . . 4.920 3.764 2.043 4.474 . 0 0 "[ . 1 . 2]" 1 1898 1 93 LEU H 1 93 LEU QB . . 3.540 2.525 2.158 3.218 . 0 0 "[ . 1 . 2]" 1 1899 1 93 LEU HA 1 93 LEU QD . . 4.170 2.672 1.988 3.385 . 0 0 "[ . 1 . 2]" 1 1900 1 95 GLY QA 1 96 PRO QD . . 3.190 1.970 1.898 2.067 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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