NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
369742 | 1bfy | 4182 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1bfy 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 6 _Distance_constraint_stats_list.Viol_count 19 _Distance_constraint_stats_list.Viol_total 8.659 _Distance_constraint_stats_list.Viol_max 0.067 _Distance_constraint_stats_list.Viol_rms 0.0106 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0036 _Distance_constraint_stats_list.Viol_average_violations_only 0.0228 _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 6 CYS 0.207 0.049 18 0 "[ . 1 . 2]" 1 9 CYS 0.238 0.067 17 0 "[ . 1 . 2]" 1 39 CYS 0.225 0.067 17 0 "[ . 1 . 2]" 1 42 CYS 0.195 0.049 18 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 6 CYS SG 1 9 CYS SG . . 4.000 3.593 3.273 4.023 0.023 10 0 "[ . 1 . 2]" 1 2 1 6 CYS SG 1 39 CYS SG . . 4.000 3.451 3.289 3.837 . 0 0 "[ . 1 . 2]" 1 3 1 6 CYS SG 1 42 CYS SG . . 4.000 3.967 3.853 4.049 0.049 18 0 "[ . 1 . 2]" 1 4 1 9 CYS SG 1 39 CYS SG . . 4.000 3.888 3.708 4.067 0.067 17 0 "[ . 1 . 2]" 1 5 1 9 CYS SG 1 42 CYS SG . . 4.000 3.618 3.469 3.839 . 0 0 "[ . 1 . 2]" 1 6 1 39 CYS SG 1 42 CYS SG . . 4.000 3.806 3.412 4.008 0.008 7 0 "[ . 1 . 2]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 1075 _Distance_constraint_stats_list.Viol_count 2417 _Distance_constraint_stats_list.Viol_total 2617.268 _Distance_constraint_stats_list.Viol_max 0.666 _Distance_constraint_stats_list.Viol_rms 0.0270 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0061 _Distance_constraint_stats_list.Viol_average_violations_only 0.0541 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details . loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 1 MET 4.524 0.200 12 0 "[ . 1 . 2]" 1 2 LYS 3.110 0.200 12 0 "[ . 1 . 2]" 1 3 LYS 5.588 0.175 17 0 "[ . 1 . 2]" 1 4 TYR 5.131 0.118 16 0 "[ . 1 . 2]" 1 5 THR 2.070 0.112 20 0 "[ . 1 . 2]" 1 11 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 12 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 13 TYR 4.670 0.094 6 0 "[ . 1 . 2]" 1 14 ASN 3.808 0.113 16 0 "[ . 1 . 2]" 1 15 PRO 18.497 0.340 6 0 "[ . 1 . 2]" 1 16 GLU 4.073 0.146 6 0 "[ . 1 . 2]" 1 17 ASP 7.740 0.146 6 0 "[ . 1 . 2]" 1 18 GLY 3.799 0.076 10 0 "[ . 1 . 2]" 1 19 ASP 0.890 0.036 10 0 "[ . 1 . 2]" 1 20 PRO 5.372 0.237 6 0 "[ . 1 . 2]" 1 21 ASP 1.592 0.071 10 0 "[ . 1 . 2]" 1 22 ASN 4.759 0.666 2 1 "[ + . 1 . 2]" 1 23 GLY 2.106 0.058 20 0 "[ . 1 . 2]" 1 24 VAL 2.012 0.066 19 0 "[ . 1 . 2]" 1 25 ASN 3.528 0.066 19 0 "[ . 1 . 2]" 1 26 PRO 3.699 0.082 16 0 "[ . 1 . 2]" 1 27 GLY 2.616 0.072 9 0 "[ . 1 . 2]" 1 28 THR 6.710 0.097 2 0 "[ . 1 . 2]" 1 29 ASP 6.139 0.170 20 0 "[ . 1 . 2]" 1 30 PHE 8.089 0.224 14 0 "[ . 1 . 2]" 1 31 LYS 6.888 0.170 20 0 "[ . 1 . 2]" 1 32 ASP 0.009 0.004 1 0 "[ . 1 . 2]" 1 33 ILE 11.058 0.165 19 0 "[ . 1 . 2]" 1 34 PRO 27.501 0.445 18 0 "[ . 1 . 2]" 1 35 ASP 3.716 0.171 4 0 "[ . 1 . 2]" 1 36 ASP 4.662 0.141 12 0 "[ . 1 . 2]" 1 37 TRP 4.092 0.116 10 0 "[ . 1 . 2]" 1 38 VAL 0.921 0.087 20 0 "[ . 1 . 2]" 1 40 PRO 2.615 0.666 2 1 "[ + . 1 . 2]" 1 41 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 45 GLY 0.078 0.062 8 0 "[ . 1 . 2]" 1 46 LYS 2.805 0.161 19 0 "[ . 1 . 2]" 1 47 ASP 0.340 0.120 19 0 "[ . 1 . 2]" 1 48 GLN 0.340 0.120 19 0 "[ . 1 . 2]" 1 49 PHE 2.643 0.224 14 0 "[ . 1 . 2]" 1 50 GLU 2.687 0.112 20 0 "[ . 1 . 2]" 1 51 GLU 4.319 0.161 18 0 "[ . 1 . 2]" 1 52 VAL 3.324 0.118 16 0 "[ . 1 . 2]" 1 53 GLU 5.369 0.116 16 0 "[ . 1 . 2]" 1 54 GLU 3.582 0.116 16 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 1 MET HA 1 1 MET HB3 . . 3.000 2.983 2.584 3.035 0.035 8 0 "[ . 1 . 2]" 2 2 1 1 MET HA 1 1 MET HG2 . . 2.900 2.688 2.256 3.024 0.124 19 0 "[ . 1 . 2]" 2 3 1 1 MET HA 1 1 MET HG3 . . 3.700 2.690 2.166 3.547 . 0 0 "[ . 1 . 2]" 2 4 1 1 MET HA 1 2 LYS H . . 3.500 2.614 2.451 2.919 . 0 0 "[ . 1 . 2]" 2 5 1 1 MET HA 1 2 LYS HG2 . . 5.400 4.429 3.588 4.724 . 0 0 "[ . 1 . 2]" 2 6 1 1 MET HA 1 2 LYS HG3 . . 4.800 3.857 3.327 4.871 0.071 15 0 "[ . 1 . 2]" 2 7 1 1 MET HB2 1 1 MET HG3 . . 2.800 2.413 2.249 2.666 . 0 0 "[ . 1 . 2]" 2 8 1 1 MET HB2 1 2 LYS H . . 4.200 2.573 1.926 4.098 . 0 0 "[ . 1 . 2]" 2 9 1 1 MET HB2 1 2 LYS HA . . 6.000 4.474 3.819 6.037 0.037 2 0 "[ . 1 . 2]" 2 10 1 1 MET HB2 1 15 PRO HB2 . . 3.200 3.094 2.270 3.263 0.063 20 0 "[ . 1 . 2]" 2 11 1 1 MET HB2 1 15 PRO HB3 . . 4.000 3.777 3.296 4.090 0.090 15 0 "[ . 1 . 2]" 2 12 1 1 MET HB2 1 16 GLU H . . 6.000 5.086 3.858 5.825 . 0 0 "[ . 1 . 2]" 2 13 1 1 MET HB2 1 16 GLU HG2 . . 6.000 4.719 2.803 5.305 . 0 0 "[ . 1 . 2]" 2 14 1 1 MET HB2 1 16 GLU HG3 . . 6.000 4.773 3.493 5.501 . 0 0 "[ . 1 . 2]" 2 15 1 1 MET HB2 1 29 ASP HA . . 4.800 4.003 3.611 4.541 . 0 0 "[ . 1 . 2]" 2 16 1 1 MET HB2 1 30 PHE H . . 6.000 5.155 4.621 6.005 0.005 3 0 "[ . 1 . 2]" 2 17 1 1 MET HB3 1 1 MET HG2 . . 2.800 2.543 2.175 2.915 0.115 20 0 "[ . 1 . 2]" 2 18 1 1 MET HB3 1 2 LYS H . . 3.300 3.185 2.394 3.386 0.086 4 0 "[ . 1 . 2]" 2 19 1 1 MET HB3 1 15 PRO HB2 . . 3.500 2.941 2.433 3.411 . 0 0 "[ . 1 . 2]" 2 20 1 1 MET HB3 1 15 PRO HB3 . . 3.600 2.934 2.569 3.610 0.010 6 0 "[ . 1 . 2]" 2 21 1 1 MET HB3 1 15 PRO HD3 . . 5.000 4.638 4.408 4.822 . 0 0 "[ . 1 . 2]" 2 22 1 1 MET HB3 1 29 ASP HA . . 4.100 2.699 2.164 3.558 . 0 0 "[ . 1 . 2]" 2 23 1 1 MET HB3 1 30 PHE H . . 4.700 3.670 2.924 4.769 0.069 3 0 "[ . 1 . 2]" 2 24 1 1 MET HG2 1 2 LYS H . . 4.300 3.997 2.456 4.500 0.200 12 0 "[ . 1 . 2]" 2 25 1 1 MET HG3 1 2 LYS H . . 4.900 3.772 3.334 4.900 . 0 0 "[ . 1 . 2]" 2 26 1 1 MET HG3 1 15 PRO HB2 . . 5.400 4.583 3.989 5.002 . 0 0 "[ . 1 . 2]" 2 27 1 1 MET HG3 1 15 PRO HG2 . . 5.600 4.828 4.346 5.294 . 0 0 "[ . 1 . 2]" 2 28 1 1 MET HG3 1 15 PRO HG3 . . 5.000 4.807 4.247 5.090 0.090 19 0 "[ . 1 . 2]" 2 29 1 2 LYS H 1 2 LYS QB . . 3.800 3.111 2.336 3.442 . 0 0 "[ . 1 . 2]" 2 30 1 2 LYS H 1 2 LYS HG2 . . 3.300 3.066 2.752 3.331 0.031 9 0 "[ . 1 . 2]" 2 31 1 2 LYS H 1 2 LYS HG3 . . 3.300 3.051 2.713 3.320 0.020 6 0 "[ . 1 . 2]" 2 32 1 2 LYS H 1 2 LYS QD . . 5.100 4.552 4.205 4.674 . 0 0 "[ . 1 . 2]" 2 33 1 2 LYS H 1 2 LYS QE . . 6.300 5.089 4.766 5.320 . 0 0 "[ . 1 . 2]" 2 34 1 2 LYS H 1 3 LYS H . . 4.600 4.522 4.421 4.585 . 0 0 "[ . 1 . 2]" 2 35 1 2 LYS H 1 4 TYR QD . . 8.000 5.712 4.977 6.082 . 0 0 "[ . 1 . 2]" 2 36 1 2 LYS H 1 4 TYR QE . . 7.000 4.706 3.567 5.242 . 0 0 "[ . 1 . 2]" 2 37 1 2 LYS H 1 15 PRO HG3 . . 4.600 3.385 3.017 4.161 . 0 0 "[ . 1 . 2]" 2 38 1 2 LYS HA 1 2 LYS HG2 . . 3.000 2.543 2.334 2.725 . 0 0 "[ . 1 . 2]" 2 39 1 2 LYS HA 1 2 LYS HG3 . . 3.600 3.433 3.237 3.628 0.028 6 0 "[ . 1 . 2]" 2 40 1 2 LYS HA 1 2 LYS QD . . 4.500 3.584 2.589 3.932 . 0 0 "[ . 1 . 2]" 2 41 1 2 LYS HA 1 2 LYS QE . . 6.000 4.999 4.189 5.237 . 0 0 "[ . 1 . 2]" 2 42 1 2 LYS HA 1 3 LYS H . . 2.500 2.397 2.145 2.529 0.029 8 0 "[ . 1 . 2]" 2 43 1 2 LYS QB 1 3 LYS H . . 4.500 2.337 2.058 2.820 . 0 0 "[ . 1 . 2]" 2 44 1 2 LYS QB 1 4 TYR QD . . 7.700 4.290 3.809 4.801 . 0 0 "[ . 1 . 2]" 2 45 1 2 LYS QB 1 4 TYR QE . . 6.500 3.360 2.489 4.241 . 0 0 "[ . 1 . 2]" 2 46 1 2 LYS QB 1 51 GLU HA . . 5.700 4.372 4.086 4.591 . 0 0 "[ . 1 . 2]" 2 47 1 2 LYS QB 1 52 VAL H . . 4.800 3.654 3.323 3.853 . 0 0 "[ . 1 . 2]" 2 48 1 2 LYS HG2 1 3 LYS H . . 4.300 4.279 4.177 4.386 0.086 6 0 "[ . 1 . 2]" 2 49 1 2 LYS HG2 1 4 TYR QE . . 7.500 6.001 5.360 6.513 . 0 0 "[ . 1 . 2]" 2 50 1 2 LYS HG2 1 53 GLU HA . . 6.000 5.093 4.486 5.794 . 0 0 "[ . 1 . 2]" 2 51 1 2 LYS HG3 1 4 TYR QD . . 8.000 6.478 5.994 7.037 . 0 0 "[ . 1 . 2]" 2 52 1 2 LYS HG3 1 4 TYR QE . . 7.300 5.010 4.462 5.530 . 0 0 "[ . 1 . 2]" 2 53 1 2 LYS QD 1 3 LYS H . . 4.600 3.986 3.395 4.194 . 0 0 "[ . 1 . 2]" 2 54 1 2 LYS QD 1 4 TYR QE . . 8.500 5.138 4.118 6.218 . 0 0 "[ . 1 . 2]" 2 55 1 2 LYS QD 1 53 GLU HA . . 7.000 2.793 2.064 3.354 . 0 0 "[ . 1 . 2]" 2 56 1 2 LYS QE 1 4 TYR QD . . 9.000 7.153 6.823 7.234 . 0 0 "[ . 1 . 2]" 2 57 1 2 LYS QE 1 4 TYR QE . . 8.700 5.850 5.407 6.258 . 0 0 "[ . 1 . 2]" 2 58 1 2 LYS QE 1 53 GLU HA . . 7.000 3.957 2.496 5.007 . 0 0 "[ . 1 . 2]" 2 59 1 3 LYS H 1 3 LYS HB2 . . 2.900 2.372 2.271 2.426 . 0 0 "[ . 1 . 2]" 2 60 1 3 LYS H 1 3 LYS HB3 . . 3.500 3.550 3.508 3.577 0.077 12 0 "[ . 1 . 2]" 2 61 1 3 LYS H 1 3 LYS HG2 . . 3.500 3.447 3.333 3.532 0.032 14 0 "[ . 1 . 2]" 2 62 1 3 LYS H 1 3 LYS HG3 . . 2.700 2.223 2.108 2.320 . 0 0 "[ . 1 . 2]" 2 63 1 3 LYS H 1 3 LYS QD . . 4.600 3.671 3.363 3.915 . 0 0 "[ . 1 . 2]" 2 64 1 3 LYS H 1 3 LYS QE . . 6.200 4.356 3.846 4.881 . 0 0 "[ . 1 . 2]" 2 65 1 3 LYS H 1 4 TYR HA . . 6.000 5.302 5.206 5.425 . 0 0 "[ . 1 . 2]" 2 66 1 3 LYS H 1 4 TYR QD . . 7.700 4.746 4.520 4.985 . 0 0 "[ . 1 . 2]" 2 67 1 3 LYS H 1 4 TYR QE . . 7.700 5.257 4.962 5.565 . 0 0 "[ . 1 . 2]" 2 68 1 3 LYS H 1 15 PRO HD2 . . 4.800 4.190 3.909 4.343 . 0 0 "[ . 1 . 2]" 2 69 1 3 LYS H 1 15 PRO HD3 . . 4.400 4.358 4.186 4.467 0.067 2 0 "[ . 1 . 2]" 2 70 1 3 LYS H 1 52 VAL H . . 4.000 3.868 3.749 4.028 0.028 18 0 "[ . 1 . 2]" 2 71 1 3 LYS H 1 52 VAL HB . . 3.700 3.626 3.391 3.713 0.013 7 0 "[ . 1 . 2]" 2 72 1 3 LYS HA 1 3 LYS HB3 . . 3.100 2.454 2.430 2.505 . 0 0 "[ . 1 . 2]" 2 73 1 3 LYS HA 1 3 LYS HG2 . . 2.700 2.431 2.350 2.497 . 0 0 "[ . 1 . 2]" 2 74 1 3 LYS HA 1 3 LYS HG3 . . 3.100 2.990 2.878 3.069 . 0 0 "[ . 1 . 2]" 2 75 1 3 LYS HA 1 3 LYS QD . . 4.700 4.041 3.909 4.185 . 0 0 "[ . 1 . 2]" 2 76 1 3 LYS HA 1 3 LYS QE . . 5.800 4.397 3.934 4.676 . 0 0 "[ . 1 . 2]" 2 77 1 3 LYS HA 1 4 TYR H . . 3.000 2.406 2.307 2.521 . 0 0 "[ . 1 . 2]" 2 78 1 3 LYS HA 1 4 TYR HB2 . . 5.600 4.304 4.067 4.797 . 0 0 "[ . 1 . 2]" 2 79 1 3 LYS HA 1 4 TYR QD . . 6.100 3.223 2.994 3.422 . 0 0 "[ . 1 . 2]" 2 80 1 3 LYS HA 1 4 TYR QE . . 7.400 4.882 4.526 5.221 . 0 0 "[ . 1 . 2]" 2 81 1 3 LYS HA 1 12 ILE MG . . 6.000 3.926 3.725 4.122 . 0 0 "[ . 1 . 2]" 2 82 1 3 LYS HA 1 15 PRO HG2 . . 5.000 4.423 4.245 4.563 . 0 0 "[ . 1 . 2]" 2 83 1 3 LYS HA 1 15 PRO HG3 . . 4.300 3.729 3.526 3.844 . 0 0 "[ . 1 . 2]" 2 84 1 3 LYS HA 1 15 PRO HD2 . . 3.400 2.871 2.760 2.980 . 0 0 "[ . 1 . 2]" 2 85 1 3 LYS HA 1 15 PRO HD3 . . 3.100 2.095 2.028 2.147 . 0 0 "[ . 1 . 2]" 2 86 1 3 LYS HA 1 52 VAL HB . . 5.000 4.027 3.957 4.089 . 0 0 "[ . 1 . 2]" 2 87 1 3 LYS HA 1 52 VAL MG2 . . 6.700 4.921 4.779 5.040 . 0 0 "[ . 1 . 2]" 2 88 1 3 LYS HB2 1 3 LYS HG2 . . 3.100 3.049 3.033 3.061 . 0 0 "[ . 1 . 2]" 2 89 1 3 LYS HB2 1 3 LYS HG3 . . 2.600 2.509 2.468 2.604 0.004 2 0 "[ . 1 . 2]" 2 90 1 3 LYS HB2 1 3 LYS QD . . 3.600 2.369 2.206 2.530 . 0 0 "[ . 1 . 2]" 2 91 1 3 LYS HB2 1 3 LYS QE . . 4.500 3.599 3.025 4.024 . 0 0 "[ . 1 . 2]" 2 92 1 3 LYS HB2 1 4 TYR H . . 3.800 3.553 3.466 3.665 . 0 0 "[ . 1 . 2]" 2 93 1 3 LYS HB2 1 12 ILE MG . . 4.500 3.377 3.097 3.644 . 0 0 "[ . 1 . 2]" 2 94 1 3 LYS HB2 1 14 ASN HA . . 5.200 4.653 4.581 4.742 . 0 0 "[ . 1 . 2]" 2 95 1 3 LYS HB2 1 15 PRO HD2 . . 5.700 4.930 4.772 5.116 . 0 0 "[ . 1 . 2]" 2 96 1 3 LYS HB2 1 52 VAL H . . 3.700 3.718 3.620 3.778 0.078 2 0 "[ . 1 . 2]" 2 97 1 3 LYS HB2 1 52 VAL HB . . 2.800 2.116 2.080 2.162 . 0 0 "[ . 1 . 2]" 2 98 1 3 LYS HB2 1 52 VAL MG1 . . 4.000 2.239 2.176 2.405 . 0 0 "[ . 1 . 2]" 2 99 1 3 LYS HB2 1 52 VAL MG2 . . 4.200 3.541 3.408 3.568 . 0 0 "[ . 1 . 2]" 2 100 1 3 LYS HB3 1 3 LYS HG2 . . 2.600 2.477 2.418 2.498 . 0 0 "[ . 1 . 2]" 2 101 1 3 LYS HB3 1 3 LYS HG3 . . 3.100 3.051 3.038 3.068 . 0 0 "[ . 1 . 2]" 2 102 1 3 LYS HB3 1 3 LYS QD . . 3.900 2.678 2.456 3.044 . 0 0 "[ . 1 . 2]" 2 103 1 3 LYS HB3 1 4 TYR H . . 3.400 2.414 2.304 2.508 . 0 0 "[ . 1 . 2]" 2 104 1 3 LYS HB3 1 12 ILE MG . . 3.500 2.264 2.088 2.453 . 0 0 "[ . 1 . 2]" 2 105 1 3 LYS HB3 1 12 ILE MD . . 6.200 4.381 4.069 4.731 . 0 0 "[ . 1 . 2]" 2 106 1 3 LYS HB3 1 14 ASN HA . . 3.600 3.423 3.300 3.601 0.001 18 0 "[ . 1 . 2]" 2 107 1 3 LYS HB3 1 15 PRO HD2 . . 4.800 4.466 4.302 4.704 . 0 0 "[ . 1 . 2]" 2 108 1 3 LYS HB3 1 15 PRO HD3 . . 4.800 4.238 4.130 4.368 . 0 0 "[ . 1 . 2]" 2 109 1 3 LYS HB3 1 52 VAL H . . 4.700 4.576 4.432 4.666 . 0 0 "[ . 1 . 2]" 2 110 1 3 LYS HB3 1 52 VAL HB . . 3.500 2.841 2.622 2.994 . 0 0 "[ . 1 . 2]" 2 111 1 3 LYS HB3 1 52 VAL MG1 . . 6.300 3.101 2.909 3.345 . 0 0 "[ . 1 . 2]" 2 112 1 3 LYS HB3 1 52 VAL MG2 . . 4.400 3.521 3.259 3.643 . 0 0 "[ . 1 . 2]" 2 113 1 3 LYS HG2 1 4 TYR H . . 4.500 4.056 3.919 4.133 . 0 0 "[ . 1 . 2]" 2 114 1 3 LYS HG2 1 12 ILE MG . . 5.000 3.781 3.606 3.968 . 0 0 "[ . 1 . 2]" 2 115 1 3 LYS HG2 1 14 ASN HA . . 2.500 2.101 1.997 2.147 . 0 0 "[ . 1 . 2]" 2 116 1 3 LYS HG2 1 14 ASN HB2 . . 4.100 3.245 3.049 3.390 . 0 0 "[ . 1 . 2]" 2 117 1 3 LYS HG2 1 14 ASN HD21 . . 5.700 4.732 4.487 4.946 . 0 0 "[ . 1 . 2]" 2 118 1 3 LYS HG2 1 14 ASN HD22 . . 5.800 4.326 4.076 4.831 . 0 0 "[ . 1 . 2]" 2 119 1 3 LYS HG2 1 15 PRO HG3 . . 5.300 4.770 4.556 5.063 . 0 0 "[ . 1 . 2]" 2 120 1 3 LYS HG2 1 15 PRO HD2 . . 2.800 2.417 2.209 2.721 . 0 0 "[ . 1 . 2]" 2 121 1 3 LYS HG2 1 15 PRO HD3 . . 3.000 3.102 3.046 3.175 0.175 17 0 "[ . 1 . 2]" 2 122 1 3 LYS HG2 1 52 VAL HB . . 4.900 4.908 4.786 4.961 0.061 2 0 "[ . 1 . 2]" 2 123 1 3 LYS HG3 1 4 TYR H . . 4.800 4.817 4.722 4.861 0.061 13 0 "[ . 1 . 2]" 2 124 1 3 LYS HG3 1 14 ASN HA . . 3.800 3.750 3.517 3.821 0.021 4 0 "[ . 1 . 2]" 2 125 1 3 LYS HG3 1 15 PRO HD2 . . 3.300 3.144 2.819 3.325 0.025 17 0 "[ . 1 . 2]" 2 126 1 3 LYS HG3 1 15 PRO HD3 . . 4.000 3.998 3.779 4.066 0.066 3 0 "[ . 1 . 2]" 2 127 1 3 LYS QD 1 4 TYR H . . 5.800 4.774 4.410 5.172 . 0 0 "[ . 1 . 2]" 2 128 1 3 LYS QD 1 12 ILE MG . . 5.300 3.085 2.549 3.802 . 0 0 "[ . 1 . 2]" 2 129 1 3 LYS QD 1 12 ILE QG . . 7.700 5.517 4.978 6.142 . 0 0 "[ . 1 . 2]" 2 130 1 3 LYS QD 1 14 ASN HA . . 5.300 3.849 3.488 4.232 . 0 0 "[ . 1 . 2]" 2 131 1 3 LYS QD 1 14 ASN HB2 . . 5.200 3.482 2.759 4.299 . 0 0 "[ . 1 . 2]" 2 132 1 3 LYS QD 1 14 ASN HD21 . . 6.200 4.363 3.751 4.722 . 0 0 "[ . 1 . 2]" 2 133 1 3 LYS QD 1 14 ASN HD22 . . 6.200 3.947 3.020 4.977 . 0 0 "[ . 1 . 2]" 2 134 1 3 LYS QD 1 15 PRO HD2 . . 5.600 4.346 3.992 4.737 . 0 0 "[ . 1 . 2]" 2 135 1 3 LYS QD 1 15 PRO HD3 . . 6.400 5.068 4.955 5.192 . 0 0 "[ . 1 . 2]" 2 136 1 3 LYS QD 1 52 VAL HB . . 4.900 4.063 3.883 4.313 . 0 0 "[ . 1 . 2]" 2 137 1 3 LYS QE 1 12 ILE MG . . 6.700 3.499 2.019 4.710 . 0 0 "[ . 1 . 2]" 2 138 1 3 LYS QE 1 14 ASN HB2 . . 5.000 3.121 2.136 3.957 . 0 0 "[ . 1 . 2]" 2 139 1 3 LYS QE 1 14 ASN HD21 . . 5.100 3.460 3.047 3.874 . 0 0 "[ . 1 . 2]" 2 140 1 4 TYR H 1 4 TYR HB2 . . 3.100 2.834 2.679 3.111 0.011 16 0 "[ . 1 . 2]" 2 141 1 4 TYR H 1 4 TYR QE . . 6.200 5.489 5.260 5.589 . 0 0 "[ . 1 . 2]" 2 142 1 4 TYR H 1 12 ILE MG . . 5.700 2.630 2.319 2.972 . 0 0 "[ . 1 . 2]" 2 143 1 4 TYR H 1 13 TYR H . . 3.200 3.163 3.035 3.213 0.013 13 0 "[ . 1 . 2]" 2 144 1 4 TYR H 1 13 TYR QB . . 4.600 3.137 2.986 3.398 . 0 0 "[ . 1 . 2]" 2 145 1 4 TYR H 1 13 TYR QD . . 7.000 3.550 3.289 4.381 . 0 0 "[ . 1 . 2]" 2 146 1 4 TYR H 1 14 ASN HA . . 3.900 3.905 3.809 3.942 0.042 3 0 "[ . 1 . 2]" 2 147 1 4 TYR H 1 15 PRO HD2 . . 6.000 5.053 4.969 5.165 . 0 0 "[ . 1 . 2]" 2 148 1 4 TYR H 1 15 PRO HD3 . . 3.900 3.941 3.878 3.979 0.079 7 0 "[ . 1 . 2]" 2 149 1 4 TYR H 1 30 PHE QD . . 8.000 4.539 4.220 5.710 . 0 0 "[ . 1 . 2]" 2 150 1 4 TYR H 1 52 VAL H . . 6.000 4.237 4.154 4.323 . 0 0 "[ . 1 . 2]" 2 151 1 4 TYR H 1 52 VAL HB . . 3.300 3.384 3.336 3.418 0.118 16 0 "[ . 1 . 2]" 2 152 1 4 TYR H 1 52 VAL MG1 . . 5.900 4.436 4.343 4.533 . 0 0 "[ . 1 . 2]" 2 153 1 4 TYR H 1 52 VAL MG2 . . 4.600 3.581 3.449 3.703 . 0 0 "[ . 1 . 2]" 2 154 1 4 TYR HA 1 4 TYR HB2 . . 3.100 3.036 3.005 3.073 . 0 0 "[ . 1 . 2]" 2 155 1 4 TYR HA 1 4 TYR HB3 . . 2.900 2.585 2.428 2.691 . 0 0 "[ . 1 . 2]" 2 156 1 4 TYR HA 1 4 TYR QE . . 6.000 4.547 4.399 4.709 . 0 0 "[ . 1 . 2]" 2 157 1 4 TYR HA 1 5 THR H . . 2.600 2.263 2.196 2.332 . 0 0 "[ . 1 . 2]" 2 158 1 4 TYR HA 1 50 GLU H . . 6.000 4.705 4.271 5.049 . 0 0 "[ . 1 . 2]" 2 159 1 4 TYR HA 1 51 GLU H . . 6.000 4.706 4.597 4.755 . 0 0 "[ . 1 . 2]" 2 160 1 4 TYR HA 1 51 GLU HA . . 2.400 2.433 2.405 2.465 0.065 8 0 "[ . 1 . 2]" 2 161 1 4 TYR HA 1 51 GLU QB . . 6.500 4.501 4.465 4.538 . 0 0 "[ . 1 . 2]" 2 162 1 4 TYR HA 1 51 GLU HG2 . . 6.000 5.233 5.060 5.387 . 0 0 "[ . 1 . 2]" 2 163 1 4 TYR HA 1 51 GLU HG3 . . 6.000 4.382 4.213 4.593 . 0 0 "[ . 1 . 2]" 2 164 1 4 TYR HA 1 52 VAL H . . 2.600 2.566 2.384 2.635 0.035 12 0 "[ . 1 . 2]" 2 165 1 4 TYR HA 1 52 VAL HA . . 6.000 4.591 4.269 4.732 . 0 0 "[ . 1 . 2]" 2 166 1 4 TYR HA 1 52 VAL HB . . 4.900 3.136 2.960 3.246 . 0 0 "[ . 1 . 2]" 2 167 1 4 TYR HA 1 52 VAL MG1 . . 6.800 4.609 4.519 4.697 . 0 0 "[ . 1 . 2]" 2 168 1 4 TYR HA 1 52 VAL MG2 . . 3.700 2.587 2.457 2.729 . 0 0 "[ . 1 . 2]" 2 169 1 4 TYR HB2 1 13 TYR QB . . 3.800 2.432 2.194 2.816 . 0 0 "[ . 1 . 2]" 2 170 1 4 TYR HB2 1 13 TYR QD . . 6.400 3.103 2.821 3.577 . 0 0 "[ . 1 . 2]" 2 171 1 4 TYR HB2 1 13 TYR QE . . 8.000 5.182 4.917 5.592 . 0 0 "[ . 1 . 2]" 2 172 1 4 TYR HB2 1 30 PHE QD . . 6.000 2.523 2.191 3.790 . 0 0 "[ . 1 . 2]" 2 173 1 4 TYR HB2 1 30 PHE QE . . 7.400 2.829 2.325 3.491 . 0 0 "[ . 1 . 2]" 2 174 1 4 TYR HB2 1 49 PHE HB2 . . 3.900 3.950 3.868 4.011 0.111 16 0 "[ . 1 . 2]" 2 175 1 4 TYR HB2 1 49 PHE QD . . 8.000 4.383 2.687 5.220 . 0 0 "[ . 1 . 2]" 2 176 1 4 TYR HB3 1 5 THR H . . 3.700 2.989 2.798 3.213 . 0 0 "[ . 1 . 2]" 2 177 1 4 TYR HB3 1 13 TYR QB . . 4.600 3.676 3.410 4.041 . 0 0 "[ . 1 . 2]" 2 178 1 4 TYR HB3 1 13 TYR QD . . 6.400 4.741 4.505 5.169 . 0 0 "[ . 1 . 2]" 2 179 1 4 TYR HB3 1 30 PHE QD . . 5.500 3.717 3.209 4.552 . 0 0 "[ . 1 . 2]" 2 180 1 4 TYR HB3 1 49 PHE QD . . 6.900 3.666 2.778 4.357 . 0 0 "[ . 1 . 2]" 2 181 1 4 TYR QD 1 5 THR H . . 8.000 3.863 3.522 4.380 . 0 0 "[ . 1 . 2]" 2 182 1 4 TYR QD 1 13 TYR QB . . 8.100 4.079 3.523 4.503 . 0 0 "[ . 1 . 2]" 2 183 1 4 TYR QD 1 13 TYR QD . . 7.200 3.146 2.418 3.724 . 0 0 "[ . 1 . 2]" 2 184 1 4 TYR QD 1 13 TYR QE . . 8.200 4.418 3.864 5.023 . 0 0 "[ . 1 . 2]" 2 185 1 4 TYR QD 1 15 PRO HD3 . . 8.000 3.677 3.247 4.058 . 0 0 "[ . 1 . 2]" 2 186 1 4 TYR QD 1 30 PHE H . . 6.900 4.288 3.798 4.784 . 0 0 "[ . 1 . 2]" 2 187 1 4 TYR QD 1 30 PHE HB2 . . 4.800 2.811 2.507 3.445 . 0 0 "[ . 1 . 2]" 2 188 1 4 TYR QD 1 30 PHE HB3 . . 5.600 3.778 3.520 4.339 . 0 0 "[ . 1 . 2]" 2 189 1 4 TYR QD 1 30 PHE QD . . 8.500 2.897 2.458 3.451 . 0 0 "[ . 1 . 2]" 2 190 1 4 TYR QD 1 30 PHE QE . . 7.400 4.028 2.809 4.412 . 0 0 "[ . 1 . 2]" 2 191 1 4 TYR QD 1 30 PHE HZ . . 5.800 5.061 4.175 5.330 . 0 0 "[ . 1 . 2]" 2 192 1 4 TYR QD 1 49 PHE HB2 . . 5.400 2.651 2.132 3.923 . 0 0 "[ . 1 . 2]" 2 193 1 4 TYR QD 1 50 GLU H . . 7.300 3.693 3.153 4.292 . 0 0 "[ . 1 . 2]" 2 194 1 4 TYR QD 1 50 GLU HA . . 5.900 3.786 3.177 4.139 . 0 0 "[ . 1 . 2]" 2 195 1 4 TYR QD 1 51 GLU H . . 6.300 4.040 3.426 4.372 . 0 0 "[ . 1 . 2]" 2 196 1 4 TYR QD 1 51 GLU HA . . 5.400 3.092 2.870 3.306 . 0 0 "[ . 1 . 2]" 2 197 1 4 TYR QD 1 51 GLU QB . . 7.700 3.875 3.528 4.114 . 0 0 "[ . 1 . 2]" 2 198 1 4 TYR QD 1 51 GLU HG2 . . 7.800 5.624 5.513 5.804 . 0 0 "[ . 1 . 2]" 2 199 1 4 TYR QD 1 51 GLU HG3 . . 6.700 4.387 4.116 4.613 . 0 0 "[ . 1 . 2]" 2 200 1 4 TYR QD 1 52 VAL H . . 6.100 4.247 4.105 4.383 . 0 0 "[ . 1 . 2]" 2 201 1 4 TYR QE 1 13 TYR QE . . 10.000 5.542 4.306 6.513 . 0 0 "[ . 1 . 2]" 2 202 1 4 TYR QE 1 30 PHE H . . 6.200 3.938 2.792 5.100 . 0 0 "[ . 1 . 2]" 2 203 1 4 TYR QE 1 30 PHE HA . . 7.600 5.579 4.874 6.462 . 0 0 "[ . 1 . 2]" 2 204 1 4 TYR QE 1 30 PHE HB2 . . 5.800 3.238 2.655 4.169 . 0 0 "[ . 1 . 2]" 2 205 1 4 TYR QE 1 30 PHE HB3 . . 5.100 3.453 3.162 4.191 . 0 0 "[ . 1 . 2]" 2 206 1 4 TYR QE 1 30 PHE QD . . 8.300 4.080 3.388 4.652 . 0 0 "[ . 1 . 2]" 2 207 1 4 TYR QE 1 30 PHE QE . . 7.500 5.335 3.767 5.828 . 0 0 "[ . 1 . 2]" 2 208 1 4 TYR QE 1 31 LYS H . . 6.700 5.133 4.604 5.981 . 0 0 "[ . 1 . 2]" 2 209 1 4 TYR QE 1 50 GLU HA . . 5.900 4.180 3.741 4.814 . 0 0 "[ . 1 . 2]" 2 210 1 4 TYR QE 1 51 GLU H . . 5.900 3.753 3.455 4.181 . 0 0 "[ . 1 . 2]" 2 211 1 4 TYR QE 1 51 GLU HA . . 6.000 3.347 3.153 3.542 . 0 0 "[ . 1 . 2]" 2 212 1 4 TYR QE 1 51 GLU QB . . 6.900 2.667 2.405 3.039 . 0 0 "[ . 1 . 2]" 2 213 1 4 TYR QE 1 51 GLU HG2 . . 5.600 4.968 4.688 5.070 . 0 0 "[ . 1 . 2]" 2 214 1 4 TYR QE 1 51 GLU HG3 . . 5.600 3.704 3.210 4.009 . 0 0 "[ . 1 . 2]" 2 215 1 4 TYR QE 1 52 VAL H . . 8.000 4.782 4.501 4.971 . 0 0 "[ . 1 . 2]" 2 216 1 5 THR H 1 5 THR MG . . 4.700 3.053 2.106 3.852 . 0 0 "[ . 1 . 2]" 2 217 1 5 THR H 1 12 ILE MD . . 7.000 5.119 4.760 5.464 . 0 0 "[ . 1 . 2]" 2 218 1 5 THR H 1 13 TYR H . . 5.000 4.950 4.872 4.995 . 0 0 "[ . 1 . 2]" 2 219 1 5 THR H 1 49 PHE QD . . 8.000 5.406 4.112 6.134 . 0 0 "[ . 1 . 2]" 2 220 1 5 THR H 1 50 GLU H . . 3.100 3.131 2.909 3.212 0.112 20 0 "[ . 1 . 2]" 2 221 1 5 THR H 1 50 GLU HB3 . . 4.300 4.355 4.239 4.406 0.106 6 0 "[ . 1 . 2]" 2 222 1 5 THR H 1 51 GLU HA . . 4.100 3.854 3.731 3.941 . 0 0 "[ . 1 . 2]" 2 223 1 5 THR H 1 52 VAL H . . 5.600 4.211 3.945 4.489 . 0 0 "[ . 1 . 2]" 2 224 1 5 THR H 1 52 VAL MG2 . . 4.200 2.412 2.153 2.672 . 0 0 "[ . 1 . 2]" 2 225 1 11 TYR QB 1 41 LEU HG . . 7.000 6.127 4.759 6.279 . 0 0 "[ . 1 . 2]" 2 226 1 11 TYR QD 1 41 LEU HG . . 8.000 5.172 4.285 6.536 . 0 0 "[ . 1 . 2]" 2 227 1 11 TYR QD 1 41 LEU MD1 . . 9.000 4.676 3.441 6.562 . 0 0 "[ . 1 . 2]" 2 228 1 11 TYR QD 1 41 LEU MD2 . . 7.600 5.571 3.757 6.548 . 0 0 "[ . 1 . 2]" 2 229 1 12 ILE MG 1 13 TYR H . . 4.300 2.845 2.686 3.086 . 0 0 "[ . 1 . 2]" 2 230 1 12 ILE MG 1 13 TYR HA . . 7.000 3.969 3.862 4.122 . 0 0 "[ . 1 . 2]" 2 231 1 12 ILE MG 1 13 TYR QB . . 8.000 4.013 3.826 4.224 . 0 0 "[ . 1 . 2]" 2 232 1 12 ILE MG 1 14 ASN H . . 5.300 4.259 4.087 4.416 . 0 0 "[ . 1 . 2]" 2 233 1 12 ILE MG 1 14 ASN HA . . 5.800 3.857 3.667 4.015 . 0 0 "[ . 1 . 2]" 2 234 1 12 ILE MG 1 14 ASN HB2 . . 4.400 3.266 3.030 3.395 . 0 0 "[ . 1 . 2]" 2 235 1 12 ILE MG 1 14 ASN HB3 . . 6.000 4.635 4.325 4.776 . 0 0 "[ . 1 . 2]" 2 236 1 12 ILE MG 1 14 ASN HD21 . . 6.500 5.338 4.877 5.438 . 0 0 "[ . 1 . 2]" 2 237 1 12 ILE MG 1 14 ASN HD22 . . 7.000 5.892 5.867 5.944 . 0 0 "[ . 1 . 2]" 2 238 1 12 ILE MG 1 52 VAL MG2 . . 4.500 2.632 2.447 2.883 . 0 0 "[ . 1 . 2]" 2 239 1 12 ILE MD 1 13 TYR H . . 7.000 5.077 4.933 5.268 . 0 0 "[ . 1 . 2]" 2 240 1 12 ILE MD 1 52 VAL MG2 . . 5.200 2.464 2.199 2.802 . 0 0 "[ . 1 . 2]" 2 241 1 13 TYR HA 1 14 ASN H . . 3.400 2.226 2.191 2.260 . 0 0 "[ . 1 . 2]" 2 242 1 13 TYR HA 1 14 ASN HB3 . . 6.000 4.635 4.454 4.706 . 0 0 "[ . 1 . 2]" 2 243 1 13 TYR QB 1 30 PHE QD . . 7.600 2.888 2.510 3.590 . 0 0 "[ . 1 . 2]" 2 244 1 13 TYR QB 1 37 TRP HH2 . . 6.300 3.030 2.483 3.415 . 0 0 "[ . 1 . 2]" 2 245 1 13 TYR QD 1 14 ASN H . . 7.600 3.539 2.918 3.751 . 0 0 "[ . 1 . 2]" 2 246 1 13 TYR QD 1 19 ASP QB . . 9.000 3.500 2.796 4.764 . 0 0 "[ . 1 . 2]" 2 247 1 13 TYR QD 1 30 PHE H . . 8.000 4.586 4.196 4.887 . 0 0 "[ . 1 . 2]" 2 248 1 13 TYR QD 1 30 PHE HB2 . . 5.400 3.498 2.964 3.848 . 0 0 "[ . 1 . 2]" 2 249 1 13 TYR QD 1 30 PHE HB3 . . 7.700 5.097 4.485 5.378 . 0 0 "[ . 1 . 2]" 2 250 1 13 TYR QD 1 30 PHE QD . . 8.200 2.283 2.031 2.405 . 0 0 "[ . 1 . 2]" 2 251 1 13 TYR QD 1 30 PHE QE . . 8.300 3.272 2.830 3.437 . 0 0 "[ . 1 . 2]" 2 252 1 13 TYR QD 1 30 PHE HZ . . 5.300 4.866 4.822 4.924 . 0 0 "[ . 1 . 2]" 2 253 1 13 TYR QE 1 15 PRO HA . . 5.000 2.450 2.296 3.007 . 0 0 "[ . 1 . 2]" 2 254 1 13 TYR QE 1 15 PRO HB2 . . 6.800 3.867 3.732 4.371 . 0 0 "[ . 1 . 2]" 2 255 1 13 TYR QE 1 15 PRO HB3 . . 5.300 2.260 2.132 2.687 . 0 0 "[ . 1 . 2]" 2 256 1 13 TYR QE 1 15 PRO HG3 . . 5.700 3.600 3.399 3.852 . 0 0 "[ . 1 . 2]" 2 257 1 13 TYR QE 1 18 GLY H . . 8.000 4.472 4.031 4.577 . 0 0 "[ . 1 . 2]" 2 258 1 13 TYR QE 1 18 GLY HA2 . . 5.100 3.211 2.555 3.540 . 0 0 "[ . 1 . 2]" 2 259 1 13 TYR QE 1 18 GLY HA3 . . 6.100 4.423 3.858 4.710 . 0 0 "[ . 1 . 2]" 2 260 1 13 TYR QE 1 19 ASP H . . 7.800 3.595 3.174 3.948 . 0 0 "[ . 1 . 2]" 2 261 1 13 TYR QE 1 19 ASP QB . . 7.400 2.434 2.183 4.138 . 0 0 "[ . 1 . 2]" 2 262 1 13 TYR QE 1 24 VAL MG1 . . 6.500 2.249 2.114 2.527 . 0 0 "[ . 1 . 2]" 2 263 1 13 TYR QE 1 28 THR HB . . 6.600 4.230 4.165 4.278 . 0 0 "[ . 1 . 2]" 2 264 1 13 TYR QE 1 30 PHE H . . 5.900 3.366 2.879 3.544 . 0 0 "[ . 1 . 2]" 2 265 1 13 TYR QE 1 30 PHE HA . . 6.500 3.597 3.125 3.791 . 0 0 "[ . 1 . 2]" 2 266 1 13 TYR QE 1 30 PHE HB2 . . 6.800 3.524 2.937 3.710 . 0 0 "[ . 1 . 2]" 2 267 1 13 TYR QE 1 30 PHE QD . . 9.400 3.421 2.792 4.029 . 0 0 "[ . 1 . 2]" 2 268 1 13 TYR QE 1 33 ILE HG13 . . 8.000 4.228 3.912 4.308 . 0 0 "[ . 1 . 2]" 2 269 1 13 TYR QE 1 33 ILE MD . . 7.600 2.517 2.388 2.632 . 0 0 "[ . 1 . 2]" 2 270 1 13 TYR HH 1 15 PRO HA . . 2.500 2.362 2.225 2.466 . 0 0 "[ . 1 . 2]" 2 271 1 13 TYR HH 1 15 PRO HB2 . . 4.700 4.131 3.912 4.265 . 0 0 "[ . 1 . 2]" 2 272 1 13 TYR HH 1 15 PRO HB3 . . 3.400 3.109 2.929 3.238 . 0 0 "[ . 1 . 2]" 2 273 1 13 TYR HH 1 18 GLY H . . 4.400 4.411 4.381 4.433 0.033 19 0 "[ . 1 . 2]" 2 274 1 13 TYR HH 1 18 GLY HA2 . . 3.200 3.040 2.877 3.164 . 0 0 "[ . 1 . 2]" 2 275 1 13 TYR HH 1 18 GLY HA3 . . 4.400 4.434 4.411 4.467 0.067 14 0 "[ . 1 . 2]" 2 276 1 13 TYR HH 1 19 ASP H . . 6.000 5.076 4.983 5.331 . 0 0 "[ . 1 . 2]" 2 277 1 13 TYR HH 1 24 VAL MG1 . . 4.000 2.827 2.780 2.882 . 0 0 "[ . 1 . 2]" 2 278 1 13 TYR HH 1 26 PRO HA . . 5.500 5.198 5.153 5.263 . 0 0 "[ . 1 . 2]" 2 279 1 13 TYR HH 1 27 GLY H . . 5.700 4.989 4.904 5.049 . 0 0 "[ . 1 . 2]" 2 280 1 13 TYR HH 1 28 THR H . . 3.100 3.164 3.138 3.194 0.094 6 0 "[ . 1 . 2]" 2 281 1 13 TYR HH 1 28 THR HA . . 4.500 4.470 4.437 4.498 . 0 0 "[ . 1 . 2]" 2 282 1 13 TYR HH 1 28 THR HB . . 2.400 2.442 2.424 2.466 0.066 20 0 "[ . 1 . 2]" 2 283 1 13 TYR HH 1 28 THR MG . . 4.600 3.231 3.152 3.299 . 0 0 "[ . 1 . 2]" 2 284 1 13 TYR HH 1 28 THR HG1 . . 4.700 4.440 4.397 4.503 . 0 0 "[ . 1 . 2]" 2 285 1 13 TYR HH 1 29 ASP H . . 4.800 4.827 4.808 4.844 0.044 9 0 "[ . 1 . 2]" 2 286 1 13 TYR HH 1 29 ASP HA . . 4.500 4.345 4.193 4.472 . 0 0 "[ . 1 . 2]" 2 287 1 13 TYR HH 1 30 PHE H . . 4.500 4.485 4.310 4.541 0.041 16 0 "[ . 1 . 2]" 2 288 1 13 TYR HH 1 30 PHE HA . . 4.400 4.278 4.029 4.367 . 0 0 "[ . 1 . 2]" 2 289 1 13 TYR HH 1 30 PHE HB2 . . 6.000 5.322 4.972 5.477 . 0 0 "[ . 1 . 2]" 2 290 1 13 TYR HH 1 30 PHE QD . . 6.700 5.233 4.399 5.998 . 0 0 "[ . 1 . 2]" 2 291 1 13 TYR HH 1 33 ILE MG . . 6.700 5.253 5.157 5.403 . 0 0 "[ . 1 . 2]" 2 292 1 13 TYR HH 1 33 ILE HG12 . . 4.800 3.754 3.652 3.898 . 0 0 "[ . 1 . 2]" 2 293 1 13 TYR HH 1 33 ILE HG13 . . 3.900 3.939 3.924 3.957 0.057 14 0 "[ . 1 . 2]" 2 294 1 13 TYR HH 1 33 ILE MD . . 4.800 3.005 2.863 3.163 . 0 0 "[ . 1 . 2]" 2 295 1 14 ASN H 1 14 ASN HB2 . . 3.200 3.095 3.040 3.166 . 0 0 "[ . 1 . 2]" 2 296 1 14 ASN H 1 14 ASN HB3 . . 2.700 2.673 2.587 2.720 0.020 18 0 "[ . 1 . 2]" 2 297 1 14 ASN H 1 14 ASN HD21 . . 5.600 5.111 5.007 5.227 . 0 0 "[ . 1 . 2]" 2 298 1 14 ASN H 1 15 PRO HD2 . . 5.100 4.954 4.900 4.988 . 0 0 "[ . 1 . 2]" 2 299 1 14 ASN H 1 15 PRO HD3 . . 4.500 4.410 4.347 4.476 . 0 0 "[ . 1 . 2]" 2 300 1 14 ASN H 1 17 ASP H . . 5.300 4.813 4.687 4.924 . 0 0 "[ . 1 . 2]" 2 301 1 14 ASN H 1 17 ASP HB2 . . 5.900 3.982 3.746 4.383 . 0 0 "[ . 1 . 2]" 2 302 1 14 ASN H 1 18 GLY H . . 5.100 4.381 4.293 4.489 . 0 0 "[ . 1 . 2]" 2 303 1 14 ASN HA 1 14 ASN HB2 . . 3.000 2.498 2.409 2.531 . 0 0 "[ . 1 . 2]" 2 304 1 14 ASN HA 1 14 ASN HD21 . . 4.500 4.460 4.412 4.495 . 0 0 "[ . 1 . 2]" 2 305 1 14 ASN HA 1 14 ASN HD22 . . 5.300 4.621 4.572 4.736 . 0 0 "[ . 1 . 2]" 2 306 1 14 ASN HA 1 15 PRO HA . . 4.600 4.432 4.402 4.472 . 0 0 "[ . 1 . 2]" 2 307 1 14 ASN HA 1 15 PRO HG2 . . 4.500 4.414 4.339 4.466 . 0 0 "[ . 1 . 2]" 2 308 1 14 ASN HA 1 15 PRO HG3 . . 4.400 4.466 4.427 4.489 0.089 3 0 "[ . 1 . 2]" 2 309 1 14 ASN HA 1 15 PRO HD2 . . 2.300 2.297 2.247 2.340 0.040 17 0 "[ . 1 . 2]" 2 310 1 14 ASN HA 1 15 PRO HD3 . . 2.400 2.282 2.192 2.342 . 0 0 "[ . 1 . 2]" 2 311 1 14 ASN HA 1 16 GLU H . . 4.200 3.947 3.823 4.027 . 0 0 "[ . 1 . 2]" 2 312 1 14 ASN HA 1 17 ASP H . . 4.400 4.456 4.436 4.481 0.081 9 0 "[ . 1 . 2]" 2 313 1 14 ASN HA 1 18 GLY H . . 5.900 5.024 4.934 5.084 . 0 0 "[ . 1 . 2]" 2 314 1 14 ASN HB2 1 14 ASN HD21 . . 2.700 2.717 2.600 2.767 0.067 20 0 "[ . 1 . 2]" 2 315 1 14 ASN HB2 1 14 ASN HD22 . . 3.700 3.633 3.603 3.690 . 0 0 "[ . 1 . 2]" 2 316 1 14 ASN HB2 1 15 PRO HD2 . . 4.600 4.361 4.203 4.430 . 0 0 "[ . 1 . 2]" 2 317 1 14 ASN HB2 1 15 PRO HD3 . . 5.600 4.776 4.688 4.862 . 0 0 "[ . 1 . 2]" 2 318 1 14 ASN HB2 1 16 GLU H . . 6.000 5.157 5.061 5.235 . 0 0 "[ . 1 . 2]" 2 319 1 14 ASN HB2 1 17 ASP H . . 4.700 4.611 4.483 4.709 0.009 9 0 "[ . 1 . 2]" 2 320 1 14 ASN HB2 1 17 ASP HB2 . . 4.200 3.936 3.768 4.013 . 0 0 "[ . 1 . 2]" 2 321 1 14 ASN HB3 1 14 ASN HD21 . . 2.900 2.494 2.402 2.611 . 0 0 "[ . 1 . 2]" 2 322 1 14 ASN HB3 1 14 ASN HD22 . . 3.900 3.660 3.450 3.751 . 0 0 "[ . 1 . 2]" 2 323 1 14 ASN HB3 1 15 PRO HD2 . . 4.800 4.594 4.563 4.630 . 0 0 "[ . 1 . 2]" 2 324 1 14 ASN HB3 1 15 PRO HD3 . . 5.600 5.037 4.959 5.090 . 0 0 "[ . 1 . 2]" 2 325 1 14 ASN HB3 1 16 GLU H . . 4.800 4.561 4.428 4.765 . 0 0 "[ . 1 . 2]" 2 326 1 14 ASN HB3 1 17 ASP H . . 3.500 3.251 3.131 3.487 . 0 0 "[ . 1 . 2]" 2 327 1 14 ASN HB3 1 17 ASP HB2 . . 2.600 2.218 2.097 2.388 . 0 0 "[ . 1 . 2]" 2 328 1 14 ASN HB3 1 17 ASP HB3 . . 6.000 3.791 3.690 3.935 . 0 0 "[ . 1 . 2]" 2 329 1 14 ASN HB3 1 18 GLY H . . 5.800 3.973 3.734 4.133 . 0 0 "[ . 1 . 2]" 2 330 1 14 ASN HD21 1 16 GLU H . . 6.000 4.951 4.830 5.187 . 0 0 "[ . 1 . 2]" 2 331 1 14 ASN HD21 1 16 GLU HB2 . . 4.400 4.159 3.935 4.415 0.015 16 0 "[ . 1 . 2]" 2 332 1 14 ASN HD21 1 16 GLU HB3 . . 5.700 5.628 5.408 5.813 0.113 16 0 "[ . 1 . 2]" 2 333 1 14 ASN HD21 1 17 ASP HB2 . . 4.300 3.273 2.918 3.432 . 0 0 "[ . 1 . 2]" 2 334 1 14 ASN HD21 1 17 ASP HB3 . . 5.300 4.315 4.150 4.558 . 0 0 "[ . 1 . 2]" 2 335 1 14 ASN HD22 1 15 PRO HD2 . . 5.000 4.779 4.676 4.933 . 0 0 "[ . 1 . 2]" 2 336 1 14 ASN HD22 1 16 GLU H . . 4.300 4.238 4.071 4.324 0.024 6 0 "[ . 1 . 2]" 2 337 1 14 ASN HD22 1 16 GLU HB2 . . 3.300 3.014 2.795 3.188 . 0 0 "[ . 1 . 2]" 2 338 1 14 ASN HD22 1 16 GLU HB3 . . 4.700 4.538 4.161 4.710 0.010 1 0 "[ . 1 . 2]" 2 339 1 14 ASN HD22 1 16 GLU HG3 . . 5.500 4.547 4.383 4.755 . 0 0 "[ . 1 . 2]" 2 340 1 15 PRO HA 1 15 PRO HB3 . . 2.700 2.342 2.306 2.417 . 0 0 "[ . 1 . 2]" 2 341 1 15 PRO HA 1 15 PRO HG2 . . 3.800 3.963 3.906 4.013 0.213 10 0 "[ . 1 . 2]" 2 342 1 15 PRO HA 1 15 PRO HG3 . . 3.700 3.956 3.875 4.040 0.340 6 0 "[ . 1 . 2]" 2 343 1 15 PRO HA 1 16 GLU H . . 3.900 3.561 3.524 3.601 . 0 0 "[ . 1 . 2]" 2 344 1 15 PRO HA 1 16 GLU HA . . 6.000 4.762 4.709 4.807 . 0 0 "[ . 1 . 2]" 2 345 1 15 PRO HA 1 17 ASP H . . 3.800 3.895 3.865 3.941 0.141 15 0 "[ . 1 . 2]" 2 346 1 15 PRO HA 1 18 GLY H . . 3.400 2.886 2.832 3.001 . 0 0 "[ . 1 . 2]" 2 347 1 15 PRO HA 1 18 GLY HA2 . . 3.300 2.917 2.783 3.086 . 0 0 "[ . 1 . 2]" 2 348 1 15 PRO HA 1 18 GLY HA3 . . 4.600 4.399 4.309 4.521 . 0 0 "[ . 1 . 2]" 2 349 1 15 PRO HA 1 27 GLY H . . 4.100 4.023 3.956 4.059 . 0 0 "[ . 1 . 2]" 2 350 1 15 PRO HA 1 27 GLY HA2 . . 5.100 4.768 4.644 4.911 . 0 0 "[ . 1 . 2]" 2 351 1 15 PRO HA 1 28 THR H . . 3.900 3.572 3.454 3.654 . 0 0 "[ . 1 . 2]" 2 352 1 15 PRO HA 1 28 THR HB . . 4.600 4.277 4.158 4.373 . 0 0 "[ . 1 . 2]" 2 353 1 15 PRO HB2 1 15 PRO HG2 . . 2.400 2.336 2.296 2.394 . 0 0 "[ . 1 . 2]" 2 354 1 15 PRO HB2 1 15 PRO HG3 . . 3.000 2.748 2.709 2.780 . 0 0 "[ . 1 . 2]" 2 355 1 15 PRO HB2 1 15 PRO HD2 . . 3.900 3.958 3.895 4.025 0.125 9 0 "[ . 1 . 2]" 2 356 1 15 PRO HB2 1 15 PRO HD3 . . 4.200 4.087 4.037 4.127 . 0 0 "[ . 1 . 2]" 2 357 1 15 PRO HB2 1 16 GLU H . . 3.400 3.316 3.153 3.402 0.002 14 0 "[ . 1 . 2]" 2 358 1 15 PRO HB2 1 16 GLU HA . . 4.600 4.010 3.812 4.103 . 0 0 "[ . 1 . 2]" 2 359 1 15 PRO HB2 1 27 GLY H . . 4.500 4.190 4.011 4.390 . 0 0 "[ . 1 . 2]" 2 360 1 15 PRO HB2 1 27 GLY HA2 . . 4.100 3.449 3.277 3.661 . 0 0 "[ . 1 . 2]" 2 361 1 15 PRO HB2 1 28 THR H . . 4.500 4.045 3.643 4.298 . 0 0 "[ . 1 . 2]" 2 362 1 15 PRO HB2 1 29 ASP H . . 6.000 4.915 4.596 5.174 . 0 0 "[ . 1 . 2]" 2 363 1 15 PRO HB2 1 29 ASP HA . . 3.900 3.550 3.286 3.726 . 0 0 "[ . 1 . 2]" 2 364 1 15 PRO HB2 1 30 PHE H . . 4.900 4.772 4.543 4.918 0.018 10 0 "[ . 1 . 2]" 2 365 1 15 PRO HB3 1 15 PRO HD2 . . 4.200 3.956 3.907 3.989 . 0 0 "[ . 1 . 2]" 2 366 1 15 PRO HB3 1 15 PRO HD3 . . 3.500 3.302 3.160 3.408 . 0 0 "[ . 1 . 2]" 2 367 1 15 PRO HB3 1 16 GLU H . . 4.500 4.221 4.114 4.288 . 0 0 "[ . 1 . 2]" 2 368 1 15 PRO HB3 1 27 GLY H . . 5.200 5.228 5.182 5.272 0.072 9 0 "[ . 1 . 2]" 2 369 1 15 PRO HB3 1 27 GLY HA2 . . 6.000 4.899 4.736 5.096 . 0 0 "[ . 1 . 2]" 2 370 1 15 PRO HB3 1 28 THR H . . 4.400 4.353 4.175 4.421 0.021 13 0 "[ . 1 . 2]" 2 371 1 15 PRO HB3 1 29 ASP H . . 5.000 4.726 4.425 4.856 . 0 0 "[ . 1 . 2]" 2 372 1 15 PRO HB3 1 29 ASP HA . . 2.900 2.789 2.554 2.909 0.009 9 0 "[ . 1 . 2]" 2 373 1 15 PRO HB3 1 30 PHE H . . 3.700 3.312 3.212 3.452 . 0 0 "[ . 1 . 2]" 2 374 1 15 PRO HD2 1 15 PRO HG2 . . 2.700 2.233 2.196 2.258 . 0 0 "[ . 1 . 2]" 2 375 1 15 PRO HD3 1 15 PRO HG2 . . 3.000 2.975 2.948 3.005 0.005 14 0 "[ . 1 . 2]" 2 376 1 15 PRO HG2 1 16 GLU H . . 3.200 2.667 2.462 2.910 . 0 0 "[ . 1 . 2]" 2 377 1 15 PRO HG2 1 16 GLU HA . . 4.900 4.544 4.284 4.802 . 0 0 "[ . 1 . 2]" 2 378 1 15 PRO HD2 1 15 PRO HG3 . . 3.100 2.765 2.705 2.833 . 0 0 "[ . 1 . 2]" 2 379 1 15 PRO HD3 1 15 PRO HG3 . . 2.700 2.338 2.288 2.369 . 0 0 "[ . 1 . 2]" 2 380 1 15 PRO HG3 1 16 GLU H . . 4.800 4.089 3.949 4.255 . 0 0 "[ . 1 . 2]" 2 381 1 15 PRO HG3 1 29 ASP HA . . 4.400 3.924 3.643 4.162 . 0 0 "[ . 1 . 2]" 2 382 1 15 PRO HG3 1 30 PHE H . . 4.000 4.024 4.002 4.070 0.070 3 0 "[ . 1 . 2]" 2 383 1 15 PRO HD2 1 16 GLU H . . 3.000 2.602 2.466 2.760 . 0 0 "[ . 1 . 2]" 2 384 1 15 PRO HD3 1 16 GLU H . . 4.000 3.888 3.761 4.010 0.010 20 0 "[ . 1 . 2]" 2 385 1 16 GLU H 1 16 GLU HA . . 3.000 2.839 2.821 2.856 . 0 0 "[ . 1 . 2]" 2 386 1 16 GLU H 1 16 GLU HB2 . . 2.800 2.422 2.352 2.477 . 0 0 "[ . 1 . 2]" 2 387 1 16 GLU H 1 16 GLU HB3 . . 3.500 3.513 3.474 3.535 0.035 14 0 "[ . 1 . 2]" 2 388 1 16 GLU H 1 16 GLU HG2 . . 3.400 2.972 2.650 3.119 . 0 0 "[ . 1 . 2]" 2 389 1 16 GLU H 1 16 GLU HG3 . . 3.200 2.241 2.064 2.636 . 0 0 "[ . 1 . 2]" 2 390 1 16 GLU H 1 17 ASP H . . 2.800 2.589 2.522 2.640 . 0 0 "[ . 1 . 2]" 2 391 1 16 GLU H 1 17 ASP HA . . 6.000 5.331 5.302 5.364 . 0 0 "[ . 1 . 2]" 2 392 1 16 GLU H 1 17 ASP HB2 . . 4.700 4.733 4.710 4.751 0.051 12 0 "[ . 1 . 2]" 2 393 1 16 GLU H 1 18 GLY H . . 4.100 3.846 3.717 3.937 . 0 0 "[ . 1 . 2]" 2 394 1 16 GLU H 1 27 GLY H . . 5.100 4.502 4.417 4.559 . 0 0 "[ . 1 . 2]" 2 395 1 16 GLU HA 1 16 GLU HB2 . . 3.000 3.040 3.037 3.045 0.045 9 0 "[ . 1 . 2]" 2 396 1 16 GLU HA 1 16 GLU HB3 . . 2.900 2.443 2.394 2.521 . 0 0 "[ . 1 . 2]" 2 397 1 16 GLU HA 1 16 GLU HG2 . . 2.900 2.312 2.204 2.381 . 0 0 "[ . 1 . 2]" 2 398 1 16 GLU HA 1 16 GLU HG3 . . 3.700 3.312 3.226 3.507 . 0 0 "[ . 1 . 2]" 2 399 1 16 GLU HA 1 17 ASP H . . 3.500 3.474 3.434 3.505 0.005 9 0 "[ . 1 . 2]" 2 400 1 16 GLU HA 1 18 GLY H . . 4.900 4.386 4.282 4.467 . 0 0 "[ . 1 . 2]" 2 401 1 16 GLU HA 1 26 PRO HA . . 6.000 4.536 4.377 4.670 . 0 0 "[ . 1 . 2]" 2 402 1 16 GLU HA 1 27 GLY H . . 3.000 2.848 2.695 2.975 . 0 0 "[ . 1 . 2]" 2 403 1 16 GLU HA 1 27 GLY HA2 . . 3.000 2.982 2.884 3.028 0.028 12 0 "[ . 1 . 2]" 2 404 1 16 GLU HA 1 27 GLY HA3 . . 4.500 4.267 4.186 4.358 . 0 0 "[ . 1 . 2]" 2 405 1 16 GLU HB2 1 17 ASP H . . 3.300 2.960 2.894 3.003 . 0 0 "[ . 1 . 2]" 2 406 1 16 GLU HB2 1 17 ASP HA . . 4.900 4.676 4.614 4.775 . 0 0 "[ . 1 . 2]" 2 407 1 16 GLU HB3 1 16 GLU HG2 . . 2.800 2.673 2.599 2.813 0.013 18 0 "[ . 1 . 2]" 2 408 1 16 GLU HB3 1 17 ASP H . . 3.800 3.885 3.814 3.946 0.146 6 0 "[ . 1 . 2]" 2 409 1 16 GLU HB3 1 17 ASP HA . . 5.400 4.725 4.592 4.939 . 0 0 "[ . 1 . 2]" 2 410 1 16 GLU HG2 1 17 ASP H . . 4.900 4.830 4.622 4.917 0.017 7 0 "[ . 1 . 2]" 2 411 1 16 GLU HG3 1 17 ASP H . . 5.200 4.431 4.266 4.679 . 0 0 "[ . 1 . 2]" 2 412 1 17 ASP H 1 17 ASP HA . . 3.100 2.992 2.985 3.002 . 0 0 "[ . 1 . 2]" 2 413 1 17 ASP H 1 17 ASP HB2 . . 2.800 2.378 2.334 2.433 . 0 0 "[ . 1 . 2]" 2 414 1 17 ASP H 1 17 ASP HB3 . . 3.600 3.626 3.605 3.650 0.050 15 0 "[ . 1 . 2]" 2 415 1 17 ASP H 1 18 GLY H . . 2.500 2.134 2.097 2.156 . 0 0 "[ . 1 . 2]" 2 416 1 17 ASP H 1 18 GLY HA2 . . 4.300 4.331 4.298 4.352 0.052 10 0 "[ . 1 . 2]" 2 417 1 17 ASP H 1 18 GLY HA3 . . 4.900 4.848 4.809 4.868 . 0 0 "[ . 1 . 2]" 2 418 1 17 ASP H 1 26 PRO HA . . 5.000 4.458 4.414 4.497 . 0 0 "[ . 1 . 2]" 2 419 1 17 ASP H 1 26 PRO HB3 . . 4.800 4.737 4.675 4.783 . 0 0 "[ . 1 . 2]" 2 420 1 17 ASP HA 1 17 ASP HB2 . . 3.000 3.027 3.016 3.036 0.036 6 0 "[ . 1 . 2]" 2 421 1 17 ASP HA 1 17 ASP HB3 . . 2.700 2.509 2.482 2.568 . 0 0 "[ . 1 . 2]" 2 422 1 17 ASP HA 1 18 GLY H . . 4.800 3.545 3.513 3.563 . 0 0 "[ . 1 . 2]" 2 423 1 17 ASP HA 1 26 PRO HA . . 5.000 4.118 3.987 4.203 . 0 0 "[ . 1 . 2]" 2 424 1 17 ASP HA 1 26 PRO HB3 . . 3.200 2.967 2.803 3.022 . 0 0 "[ . 1 . 2]" 2 425 1 17 ASP HA 1 26 PRO HG3 . . 4.800 4.821 4.651 4.844 0.044 12 0 "[ . 1 . 2]" 2 426 1 17 ASP HB2 1 18 GLY H . . 3.200 2.845 2.746 3.121 . 0 0 "[ . 1 . 2]" 2 427 1 17 ASP HB3 1 18 GLY H . . 4.000 3.800 3.716 3.933 . 0 0 "[ . 1 . 2]" 2 428 1 17 ASP HB3 1 26 PRO HA . . 6.000 5.504 5.371 5.578 . 0 0 "[ . 1 . 2]" 2 429 1 18 GLY H 1 18 GLY HA2 . . 2.700 2.219 2.199 2.267 . 0 0 "[ . 1 . 2]" 2 430 1 18 GLY H 1 18 GLY HA3 . . 2.900 2.865 2.846 2.910 0.010 6 0 "[ . 1 . 2]" 2 431 1 18 GLY H 1 19 ASP H . . 4.700 4.568 4.536 4.590 . 0 0 "[ . 1 . 2]" 2 432 1 18 GLY H 1 20 PRO HD3 . . 5.200 4.970 4.801 5.126 . 0 0 "[ . 1 . 2]" 2 433 1 18 GLY H 1 24 VAL MG1 . . 6.800 4.600 4.451 4.709 . 0 0 "[ . 1 . 2]" 2 434 1 18 GLY H 1 26 PRO HA . . 3.200 3.182 3.144 3.217 0.017 6 0 "[ . 1 . 2]" 2 435 1 18 GLY H 1 27 GLY H . . 3.700 3.600 3.554 3.671 . 0 0 "[ . 1 . 2]" 2 436 1 18 GLY H 1 28 THR H . . 4.400 4.463 4.447 4.476 0.076 10 0 "[ . 1 . 2]" 2 437 1 18 GLY HA2 1 19 ASP H . . 3.100 2.857 2.809 2.924 . 0 0 "[ . 1 . 2]" 2 438 1 18 GLY HA2 1 19 ASP QB . . 5.500 4.189 4.049 4.958 . 0 0 "[ . 1 . 2]" 2 439 1 18 GLY HA2 1 20 PRO HD3 . . 4.700 4.308 4.201 4.446 . 0 0 "[ . 1 . 2]" 2 440 1 18 GLY HA2 1 24 VAL HB . . 4.600 4.392 4.266 4.648 0.048 6 0 "[ . 1 . 2]" 2 441 1 18 GLY HA2 1 24 VAL MG1 . . 3.900 2.653 2.523 2.751 . 0 0 "[ . 1 . 2]" 2 442 1 18 GLY HA2 1 26 PRO HA . . 3.400 3.287 3.130 3.411 0.011 10 0 "[ . 1 . 2]" 2 443 1 18 GLY HA2 1 27 GLY H . . 4.200 4.178 3.981 4.252 0.052 10 0 "[ . 1 . 2]" 2 444 1 18 GLY HA2 1 28 THR H . . 4.300 3.690 3.440 3.881 . 0 0 "[ . 1 . 2]" 2 445 1 18 GLY HA2 1 28 THR HB . . 4.000 3.774 3.571 3.932 . 0 0 "[ . 1 . 2]" 2 446 1 18 GLY HA3 1 19 ASP H . . 2.400 2.297 2.247 2.326 . 0 0 "[ . 1 . 2]" 2 447 1 18 GLY HA3 1 19 ASP HA . . 4.500 4.370 4.304 4.403 . 0 0 "[ . 1 . 2]" 2 448 1 18 GLY HA3 1 19 ASP QB . . 7.000 4.562 4.394 5.120 . 0 0 "[ . 1 . 2]" 2 449 1 18 GLY HA3 1 20 PRO HA . . 5.800 5.180 4.969 5.329 . 0 0 "[ . 1 . 2]" 2 450 1 18 GLY HA3 1 20 PRO QG . . 5.800 4.662 4.552 4.822 . 0 0 "[ . 1 . 2]" 2 451 1 18 GLY HA3 1 20 PRO HD2 . . 4.800 4.261 4.181 4.409 . 0 0 "[ . 1 . 2]" 2 452 1 18 GLY HA3 1 20 PRO HD3 . . 3.200 2.874 2.776 3.000 . 0 0 "[ . 1 . 2]" 2 453 1 18 GLY HA3 1 24 VAL HB . . 4.600 4.390 4.270 4.536 . 0 0 "[ . 1 . 2]" 2 454 1 18 GLY HA3 1 24 VAL MG1 . . 3.900 2.909 2.676 3.046 . 0 0 "[ . 1 . 2]" 2 455 1 18 GLY HA3 1 26 PRO HA . . 2.600 2.284 2.241 2.325 . 0 0 "[ . 1 . 2]" 2 456 1 18 GLY HA3 1 26 PRO HB3 . . 4.100 3.819 3.754 3.911 . 0 0 "[ . 1 . 2]" 2 457 1 18 GLY HA3 1 26 PRO HG3 . . 5.200 5.224 5.172 5.243 0.043 20 0 "[ . 1 . 2]" 2 458 1 18 GLY HA3 1 27 GLY H . . 4.000 4.006 3.923 4.031 0.031 18 0 "[ . 1 . 2]" 2 459 1 18 GLY HA3 1 28 THR H . . 4.200 3.933 3.891 4.002 . 0 0 "[ . 1 . 2]" 2 460 1 18 GLY HA3 1 28 THR HB . . 4.600 4.252 4.147 4.307 . 0 0 "[ . 1 . 2]" 2 461 1 19 ASP H 1 20 PRO HA . . 4.300 3.796 3.650 3.965 . 0 0 "[ . 1 . 2]" 2 462 1 19 ASP H 1 20 PRO HB3 . . 6.000 4.576 4.360 4.875 . 0 0 "[ . 1 . 2]" 2 463 1 19 ASP H 1 20 PRO QG . . 5.300 4.544 4.492 4.683 . 0 0 "[ . 1 . 2]" 2 464 1 19 ASP H 1 20 PRO HD2 . . 4.000 3.576 3.531 3.615 . 0 0 "[ . 1 . 2]" 2 465 1 19 ASP H 1 20 PRO HD3 . . 2.800 2.638 2.585 2.794 . 0 0 "[ . 1 . 2]" 2 466 1 19 ASP H 1 24 VAL H . . 3.700 3.505 3.425 3.728 0.028 6 0 "[ . 1 . 2]" 2 467 1 19 ASP H 1 24 VAL HA . . 4.300 4.298 4.245 4.318 0.018 4 0 "[ . 1 . 2]" 2 468 1 19 ASP H 1 24 VAL HB . . 2.500 2.387 2.285 2.515 0.015 6 0 "[ . 1 . 2]" 2 469 1 19 ASP H 1 24 VAL MG1 . . 3.800 2.339 2.105 2.456 . 0 0 "[ . 1 . 2]" 2 470 1 19 ASP H 1 24 VAL MG2 . . 5.300 4.059 3.985 4.131 . 0 0 "[ . 1 . 2]" 2 471 1 19 ASP H 1 25 ASN H . . 4.700 4.657 4.619 4.680 . 0 0 "[ . 1 . 2]" 2 472 1 19 ASP H 1 25 ASN HA . . 4.300 4.309 4.262 4.326 0.026 18 0 "[ . 1 . 2]" 2 473 1 19 ASP H 1 26 PRO HA . . 4.800 4.513 4.420 4.582 . 0 0 "[ . 1 . 2]" 2 474 1 19 ASP H 1 26 PRO QD . . 7.000 4.580 4.448 4.668 . 0 0 "[ . 1 . 2]" 2 475 1 19 ASP HA 1 20 PRO HA . . 5.400 4.676 4.655 4.687 . 0 0 "[ . 1 . 2]" 2 476 1 19 ASP HA 1 20 PRO QG . . 6.900 4.080 3.980 4.108 . 0 0 "[ . 1 . 2]" 2 477 1 19 ASP HA 1 20 PRO HD2 . . 3.000 2.279 2.198 2.307 . 0 0 "[ . 1 . 2]" 2 478 1 19 ASP HA 1 20 PRO HD3 . . 3.100 3.115 3.027 3.130 0.030 5 0 "[ . 1 . 2]" 2 479 1 19 ASP HA 1 21 ASP H . . 4.200 3.615 3.374 3.826 . 0 0 "[ . 1 . 2]" 2 480 1 19 ASP HA 1 22 ASN H . . 6.000 4.107 4.009 4.371 . 0 0 "[ . 1 . 2]" 2 481 1 19 ASP HA 1 24 VAL HB . . 4.200 4.175 4.060 4.236 0.036 10 0 "[ . 1 . 2]" 2 482 1 19 ASP QB 1 20 PRO HA . . 7.000 4.714 4.680 4.940 . 0 0 "[ . 1 . 2]" 2 483 1 19 ASP QB 1 20 PRO HD2 . . 6.600 4.334 4.032 4.368 . 0 0 "[ . 1 . 2]" 2 484 1 19 ASP QB 1 20 PRO HD3 . . 6.300 4.518 4.456 4.619 . 0 0 "[ . 1 . 2]" 2 485 1 19 ASP QB 1 21 ASP H . . 7.000 4.515 3.953 4.914 . 0 0 "[ . 1 . 2]" 2 486 1 19 ASP QB 1 22 ASN H . . 6.600 3.312 2.849 4.284 . 0 0 "[ . 1 . 2]" 2 487 1 19 ASP QB 1 22 ASN HB2 . . 5.600 2.325 2.172 3.594 . 0 0 "[ . 1 . 2]" 2 488 1 19 ASP QB 1 22 ASN QD . . 7.000 2.105 1.796 3.683 . 0 0 "[ . 1 . 2]" 2 489 1 19 ASP QB 1 24 VAL H . . 5.000 3.354 3.259 3.805 . 0 0 "[ . 1 . 2]" 2 490 1 19 ASP QB 1 24 VAL HA . . 6.100 4.969 4.882 5.497 . 0 0 "[ . 1 . 2]" 2 491 1 19 ASP QB 1 24 VAL HB . . 3.600 2.295 2.102 2.954 . 0 0 "[ . 1 . 2]" 2 492 1 19 ASP QB 1 24 VAL MG1 . . 5.900 3.104 2.611 4.106 . 0 0 "[ . 1 . 2]" 2 493 1 19 ASP QB 1 24 VAL MG2 . . 5.400 3.134 2.960 3.751 . 0 0 "[ . 1 . 2]" 2 494 1 19 ASP QB 1 37 TRP HD1 . . 6.200 4.506 4.181 4.718 . 0 0 "[ . 1 . 2]" 2 495 1 19 ASP QB 1 37 TRP HE1 . . 3.900 2.505 2.033 2.822 . 0 0 "[ . 1 . 2]" 2 496 1 20 PRO HA 1 20 PRO HB3 . . 2.700 2.271 2.265 2.281 . 0 0 "[ . 1 . 2]" 2 497 1 20 PRO HA 1 20 PRO HD2 . . 4.200 4.074 4.066 4.082 . 0 0 "[ . 1 . 2]" 2 498 1 20 PRO HA 1 20 PRO HD3 . . 3.800 3.398 3.371 3.426 . 0 0 "[ . 1 . 2]" 2 499 1 20 PRO HA 1 21 ASP H . . 3.900 3.596 3.562 3.612 . 0 0 "[ . 1 . 2]" 2 500 1 20 PRO HA 1 22 ASN H . . 4.100 3.824 3.756 3.898 . 0 0 "[ . 1 . 2]" 2 501 1 20 PRO HA 1 23 GLY H . . 3.600 2.964 2.912 3.163 . 0 0 "[ . 1 . 2]" 2 502 1 20 PRO HA 1 24 VAL H . . 2.900 2.660 2.507 2.853 . 0 0 "[ . 1 . 2]" 2 503 1 20 PRO HA 1 24 VAL HB . . 5.600 4.250 3.908 4.397 . 0 0 "[ . 1 . 2]" 2 504 1 20 PRO HA 1 25 ASN H . . 4.400 4.401 4.338 4.430 0.030 2 0 "[ . 1 . 2]" 2 505 1 20 PRO HA 1 25 ASN HA . . 3.500 3.375 3.223 3.501 0.001 6 0 "[ . 1 . 2]" 2 506 1 20 PRO HA 1 26 PRO QD . . 6.000 4.313 4.167 4.445 . 0 0 "[ . 1 . 2]" 2 507 1 20 PRO HB2 1 20 PRO HD2 . . 3.900 4.119 4.103 4.137 0.237 6 0 "[ . 1 . 2]" 2 508 1 20 PRO HB2 1 20 PRO HD3 . . 4.300 3.908 3.880 3.931 . 0 0 "[ . 1 . 2]" 2 509 1 20 PRO HB2 1 21 ASP H . . 3.700 3.453 3.298 3.635 . 0 0 "[ . 1 . 2]" 2 510 1 20 PRO HB2 1 21 ASP HA . . 4.200 4.222 4.212 4.231 0.031 5 0 "[ . 1 . 2]" 2 511 1 20 PRO HB2 1 23 GLY H . . 5.900 5.004 4.743 5.112 . 0 0 "[ . 1 . 2]" 2 512 1 20 PRO HB2 1 26 PRO QD . . 5.000 4.131 3.960 4.296 . 0 0 "[ . 1 . 2]" 2 513 1 20 PRO HB3 1 20 PRO HD2 . . 4.300 3.883 3.848 3.902 . 0 0 "[ . 1 . 2]" 2 514 1 20 PRO HB3 1 20 PRO HD3 . . 3.500 2.908 2.834 2.961 . 0 0 "[ . 1 . 2]" 2 515 1 20 PRO HB3 1 21 ASP H . . 4.500 4.289 4.199 4.386 . 0 0 "[ . 1 . 2]" 2 516 1 20 PRO HB3 1 24 VAL H . . 5.000 4.814 4.658 5.010 0.010 17 0 "[ . 1 . 2]" 2 517 1 20 PRO HB3 1 25 ASN HA . . 3.300 2.665 2.566 2.824 . 0 0 "[ . 1 . 2]" 2 518 1 20 PRO HB3 1 26 PRO HG3 . . 6.000 4.809 4.622 4.974 . 0 0 "[ . 1 . 2]" 2 519 1 20 PRO HB3 1 26 PRO QD . . 5.100 2.701 2.519 2.833 . 0 0 "[ . 1 . 2]" 2 520 1 20 PRO QG 1 21 ASP H . . 5.000 2.553 2.394 2.711 . 0 0 "[ . 1 . 2]" 2 521 1 20 PRO QG 1 26 PRO QD . . 6.900 2.803 2.655 3.147 . 0 0 "[ . 1 . 2]" 2 522 1 20 PRO HD2 1 21 ASP H . . 3.000 2.965 2.912 3.015 0.015 20 0 "[ . 1 . 2]" 2 523 1 20 PRO HD3 1 21 ASP H . . 4.200 4.038 3.989 4.076 . 0 0 "[ . 1 . 2]" 2 524 1 20 PRO HD3 1 24 VAL HB . . 4.900 4.763 4.676 4.834 . 0 0 "[ . 1 . 2]" 2 525 1 20 PRO HD3 1 25 ASN HA . . 6.000 3.830 3.566 4.064 . 0 0 "[ . 1 . 2]" 2 526 1 20 PRO HD3 1 26 PRO QD . . 4.400 3.033 2.751 3.180 . 0 0 "[ . 1 . 2]" 2 527 1 21 ASP H 1 21 ASP HA . . 3.100 2.774 2.722 2.835 . 0 0 "[ . 1 . 2]" 2 528 1 21 ASP H 1 21 ASP HB2 . . 2.800 2.384 2.286 2.478 . 0 0 "[ . 1 . 2]" 2 529 1 21 ASP H 1 21 ASP HB3 . . 3.400 3.453 3.444 3.471 0.071 10 0 "[ . 1 . 2]" 2 530 1 21 ASP H 1 22 ASN H . . 2.900 2.648 2.478 2.762 . 0 0 "[ . 1 . 2]" 2 531 1 21 ASP H 1 22 ASN HA . . 5.400 5.336 5.201 5.412 0.012 18 0 "[ . 1 . 2]" 2 532 1 21 ASP H 1 22 ASN HB2 . . 5.600 4.957 4.740 5.177 . 0 0 "[ . 1 . 2]" 2 533 1 21 ASP H 1 22 ASN QD . . 3.400 3.385 3.349 3.429 0.029 6 0 "[ . 1 . 2]" 2 534 1 21 ASP H 1 23 GLY H . . 4.400 3.934 3.795 4.014 . 0 0 "[ . 1 . 2]" 2 535 1 21 ASP H 1 24 VAL H . . 5.400 4.780 4.589 4.972 . 0 0 "[ . 1 . 2]" 2 536 1 21 ASP HA 1 21 ASP HB3 . . 2.900 2.499 2.457 2.548 . 0 0 "[ . 1 . 2]" 2 537 1 21 ASP HA 1 22 ASN H . . 3.900 3.491 3.469 3.569 . 0 0 "[ . 1 . 2]" 2 538 1 21 ASP HA 1 22 ASN HA . . 5.500 4.743 4.697 4.762 . 0 0 "[ . 1 . 2]" 2 539 1 21 ASP HA 1 23 GLY H . . 4.700 4.427 3.835 4.560 . 0 0 "[ . 1 . 2]" 2 540 1 21 ASP HB2 1 22 ASN H . . 3.400 2.865 2.811 2.987 . 0 0 "[ . 1 . 2]" 2 541 1 21 ASP HB2 1 22 ASN HA . . 5.100 4.564 4.458 4.750 . 0 0 "[ . 1 . 2]" 2 542 1 21 ASP HB2 1 22 ASN QD . . 3.600 2.651 2.437 2.898 . 0 0 "[ . 1 . 2]" 2 543 1 21 ASP HB3 1 22 ASN H . . 4.000 3.869 3.801 3.989 . 0 0 "[ . 1 . 2]" 2 544 1 21 ASP HB3 1 22 ASN HA . . 5.100 4.693 4.575 4.898 . 0 0 "[ . 1 . 2]" 2 545 1 21 ASP HB3 1 22 ASN QD . . 4.600 3.920 3.561 4.150 . 0 0 "[ . 1 . 2]" 2 546 1 22 ASN H 1 22 ASN HB2 . . 3.000 2.533 2.455 2.641 . 0 0 "[ . 1 . 2]" 2 547 1 22 ASN H 1 22 ASN HB3 . . 3.700 3.655 3.629 3.707 0.007 20 0 "[ . 1 . 2]" 2 548 1 22 ASN H 1 22 ASN QD . . 4.000 2.136 1.943 2.295 . 0 0 "[ . 1 . 2]" 2 549 1 22 ASN H 1 23 GLY H . . 2.800 2.076 1.990 2.414 . 0 0 "[ . 1 . 2]" 2 550 1 22 ASN H 1 23 GLY HA2 . . 4.700 4.395 4.262 4.653 . 0 0 "[ . 1 . 2]" 2 551 1 22 ASN H 1 23 GLY HA3 . . 5.600 4.898 4.822 4.953 . 0 0 "[ . 1 . 2]" 2 552 1 22 ASN H 1 24 VAL H . . 3.600 3.416 3.219 3.503 . 0 0 "[ . 1 . 2]" 2 553 1 22 ASN H 1 24 VAL HB . . 6.000 4.816 4.386 4.945 . 0 0 "[ . 1 . 2]" 2 554 1 22 ASN H 1 24 VAL MG2 . . 6.900 5.036 4.639 5.293 . 0 0 "[ . 1 . 2]" 2 555 1 22 ASN H 1 37 TRP HE1 . . 4.700 4.480 4.288 4.816 0.116 10 0 "[ . 1 . 2]" 2 556 1 22 ASN HA 1 22 ASN HB2 . . 3.100 3.033 3.017 3.044 . 0 0 "[ . 1 . 2]" 2 557 1 22 ASN HA 1 22 ASN HB3 . . 2.700 2.430 2.402 2.456 . 0 0 "[ . 1 . 2]" 2 558 1 22 ASN HA 1 22 ASN QD . . 4.600 3.752 3.652 3.825 . 0 0 "[ . 1 . 2]" 2 559 1 22 ASN HA 1 23 GLY H . . 3.400 3.431 3.163 3.458 0.058 20 0 "[ . 1 . 2]" 2 560 1 22 ASN HA 1 23 GLY HA2 . . 4.800 4.829 4.803 4.845 0.045 16 0 "[ . 1 . 2]" 2 561 1 22 ASN HA 1 23 GLY HA3 . . 4.600 4.609 4.409 4.631 0.031 17 0 "[ . 1 . 2]" 2 562 1 22 ASN HA 1 24 VAL H . . 5.200 5.116 4.829 5.204 0.004 20 0 "[ . 1 . 2]" 2 563 1 22 ASN HB2 1 22 ASN QD . . 2.800 2.309 2.258 2.357 . 0 0 "[ . 1 . 2]" 2 564 1 22 ASN HB2 1 23 GLY H . . 4.800 2.938 2.715 3.895 . 0 0 "[ . 1 . 2]" 2 565 1 22 ASN HB2 1 24 VAL H . . 4.700 3.414 3.156 3.721 . 0 0 "[ . 1 . 2]" 2 566 1 22 ASN HB2 1 37 TRP HD1 . . 4.000 3.536 3.026 3.794 . 0 0 "[ . 1 . 2]" 2 567 1 22 ASN HB2 1 37 TRP HE1 . . 2.900 2.090 1.964 2.587 . 0 0 "[ . 1 . 2]" 2 568 1 22 ASN HB3 1 23 GLY H . . 4.900 4.012 3.865 4.535 . 0 0 "[ . 1 . 2]" 2 569 1 22 ASN HB3 1 24 VAL H . . 6.000 4.841 4.589 4.981 . 0 0 "[ . 1 . 2]" 2 570 1 22 ASN HB3 1 37 TRP HD1 . . 3.600 3.457 2.923 3.620 0.020 1 0 "[ . 1 . 2]" 2 571 1 22 ASN HB3 1 37 TRP HE1 . . 4.100 2.742 2.244 3.499 . 0 0 "[ . 1 . 2]" 2 572 1 22 ASN QD 1 24 VAL MG1 . . 7.000 5.587 5.425 5.736 . 0 0 "[ . 1 . 2]" 2 573 1 22 ASN QD 1 37 TRP HE1 . . 5.800 3.662 3.236 4.007 . 0 0 "[ . 1 . 2]" 2 574 1 22 ASN QD 1 40 PRO HB2 . . 4.000 3.679 2.893 4.334 0.334 16 0 "[ . 1 . 2]" 2 575 1 22 ASN QD 1 40 PRO HB3 . . 4.400 2.643 2.115 3.641 . 0 0 "[ . 1 . 2]" 2 576 1 22 ASN QD 1 40 PRO HG3 . . 4.400 3.567 2.267 5.066 0.666 2 1 "[ + . 1 . 2]" 2 577 1 23 GLY H 1 23 GLY HA2 . . 2.500 2.477 2.283 2.511 0.011 9 0 "[ . 1 . 2]" 2 578 1 23 GLY H 1 23 GLY HA3 . . 3.000 3.001 2.935 3.009 0.009 5 0 "[ . 1 . 2]" 2 579 1 23 GLY H 1 24 VAL H . . 3.100 2.023 1.968 2.611 . 0 0 "[ . 1 . 2]" 2 580 1 23 GLY H 1 24 VAL HB . . 5.400 4.127 4.005 4.732 . 0 0 "[ . 1 . 2]" 2 581 1 23 GLY H 1 24 VAL MG1 . . 7.000 5.352 5.275 5.818 . 0 0 "[ . 1 . 2]" 2 582 1 23 GLY H 1 24 VAL MG2 . . 5.500 3.985 3.825 4.403 . 0 0 "[ . 1 . 2]" 2 583 1 23 GLY HA2 1 24 VAL H . . 3.300 3.241 3.154 3.332 0.032 18 0 "[ . 1 . 2]" 2 584 1 23 GLY HA2 1 24 VAL HA . . 4.700 4.693 4.676 4.724 0.024 17 0 "[ . 1 . 2]" 2 585 1 23 GLY HA2 1 24 VAL MG2 . . 6.500 4.576 4.493 4.655 . 0 0 "[ . 1 . 2]" 2 586 1 23 GLY HA3 1 24 VAL H . . 3.500 3.462 3.357 3.511 0.011 16 0 "[ . 1 . 2]" 2 587 1 23 GLY HA3 1 24 VAL HA . . 4.800 4.571 4.465 4.633 . 0 0 "[ . 1 . 2]" 2 588 1 23 GLY HA3 1 24 VAL MG2 . . 5.000 3.792 3.726 3.882 . 0 0 "[ . 1 . 2]" 2 589 1 24 VAL H 1 24 VAL HB . . 2.800 2.336 2.270 2.376 . 0 0 "[ . 1 . 2]" 2 590 1 24 VAL H 1 24 VAL MG1 . . 4.800 3.722 3.680 3.754 . 0 0 "[ . 1 . 2]" 2 591 1 24 VAL H 1 24 VAL MG2 . . 3.700 2.718 2.508 2.858 . 0 0 "[ . 1 . 2]" 2 592 1 24 VAL H 1 25 ASN H . . 4.500 4.296 4.229 4.360 . 0 0 "[ . 1 . 2]" 2 593 1 24 VAL H 1 37 TRP HE1 . . 5.400 4.015 3.529 4.540 . 0 0 "[ . 1 . 2]" 2 594 1 24 VAL HA 1 24 VAL MG1 . . 3.300 2.453 2.405 2.538 . 0 0 "[ . 1 . 2]" 2 595 1 24 VAL HA 1 24 VAL MG2 . . 3.300 2.312 2.263 2.343 . 0 0 "[ . 1 . 2]" 2 596 1 24 VAL HA 1 25 ASN H . . 2.400 2.161 2.141 2.180 . 0 0 "[ . 1 . 2]" 2 597 1 24 VAL HA 1 25 ASN HA . . 4.700 4.431 4.417 4.455 . 0 0 "[ . 1 . 2]" 2 598 1 24 VAL HA 1 25 ASN HB2 . . 4.500 4.373 4.348 4.394 . 0 0 "[ . 1 . 2]" 2 599 1 24 VAL HA 1 28 THR HB . . 4.700 4.540 4.404 4.640 . 0 0 "[ . 1 . 2]" 2 600 1 24 VAL HA 1 28 THR MG . . 5.100 3.803 3.577 3.917 . 0 0 "[ . 1 . 2]" 2 601 1 24 VAL HA 1 28 THR HG1 . . 4.400 4.419 4.413 4.435 0.035 2 0 "[ . 1 . 2]" 2 602 1 24 VAL HB 1 25 ASN H . . 4.400 4.454 4.443 4.466 0.066 19 0 "[ . 1 . 2]" 2 603 1 24 VAL HB 1 33 ILE MG . . 6.400 4.459 4.379 4.586 . 0 0 "[ . 1 . 2]" 2 604 1 24 VAL HB 1 33 ILE MD . . 6.000 4.245 3.979 4.466 . 0 0 "[ . 1 . 2]" 2 605 1 24 VAL HB 1 37 TRP HD1 . . 5.300 4.497 4.158 4.705 . 0 0 "[ . 1 . 2]" 2 606 1 24 VAL HB 1 37 TRP HE1 . . 4.000 3.536 3.115 3.793 . 0 0 "[ . 1 . 2]" 2 607 1 24 VAL MG1 1 25 ASN H . . 4.200 3.154 3.063 3.300 . 0 0 "[ . 1 . 2]" 2 608 1 24 VAL MG1 1 25 ASN HB2 . . 6.100 4.507 4.416 4.684 . 0 0 "[ . 1 . 2]" 2 609 1 24 VAL MG1 1 27 GLY H . . 7.000 5.273 5.088 5.376 . 0 0 "[ . 1 . 2]" 2 610 1 24 VAL MG1 1 28 THR H . . 4.700 3.717 3.639 3.902 . 0 0 "[ . 1 . 2]" 2 611 1 24 VAL MG1 1 28 THR HB . . 3.300 2.153 2.104 2.280 . 0 0 "[ . 1 . 2]" 2 612 1 24 VAL MG1 1 28 THR MG . . 4.600 2.240 2.167 2.399 . 0 0 "[ . 1 . 2]" 2 613 1 24 VAL MG1 1 28 THR HG1 . . 4.300 3.063 2.946 3.236 . 0 0 "[ . 1 . 2]" 2 614 1 24 VAL MG1 1 30 PHE QD . . 9.000 5.669 4.789 5.938 . 0 0 "[ . 1 . 2]" 2 615 1 24 VAL MG1 1 33 ILE HA . . 4.800 3.608 3.380 3.771 . 0 0 "[ . 1 . 2]" 2 616 1 24 VAL MG1 1 33 ILE MG . . 5.200 3.092 2.988 3.251 . 0 0 "[ . 1 . 2]" 2 617 1 24 VAL MG1 1 33 ILE HG12 . . 3.500 2.403 2.318 2.561 . 0 0 "[ . 1 . 2]" 2 618 1 24 VAL MG1 1 33 ILE HG13 . . 4.600 3.655 3.577 3.835 . 0 0 "[ . 1 . 2]" 2 619 1 24 VAL MG1 1 33 ILE MD . . 5.000 2.454 2.306 2.559 . 0 0 "[ . 1 . 2]" 2 620 1 24 VAL MG1 1 34 PRO HD2 . . 5.600 4.250 4.012 4.456 . 0 0 "[ . 1 . 2]" 2 621 1 24 VAL MG1 1 34 PRO HD3 . . 5.900 4.194 3.873 4.448 . 0 0 "[ . 1 . 2]" 2 622 1 24 VAL MG1 1 37 TRP HD1 . . 6.600 5.015 4.684 5.167 . 0 0 "[ . 1 . 2]" 2 623 1 24 VAL MG2 1 25 ASN H . . 5.700 4.065 3.970 4.133 . 0 0 "[ . 1 . 2]" 2 624 1 24 VAL MG2 1 28 THR MG . . 5.600 3.386 3.200 3.530 . 0 0 "[ . 1 . 2]" 2 625 1 24 VAL MG2 1 33 ILE HA . . 4.800 3.315 3.131 3.409 . 0 0 "[ . 1 . 2]" 2 626 1 24 VAL MG2 1 33 ILE MG . . 4.500 2.149 2.057 2.225 . 0 0 "[ . 1 . 2]" 2 627 1 24 VAL MG2 1 33 ILE HG12 . . 4.100 3.021 2.786 3.179 . 0 0 "[ . 1 . 2]" 2 628 1 24 VAL MG2 1 33 ILE HG13 . . 6.000 4.407 4.177 4.578 . 0 0 "[ . 1 . 2]" 2 629 1 24 VAL MG2 1 33 ILE MD . . 5.300 2.743 2.430 2.940 . 0 0 "[ . 1 . 2]" 2 630 1 24 VAL MG2 1 34 PRO QG . . 6.900 3.491 3.376 3.719 . 0 0 "[ . 1 . 2]" 2 631 1 24 VAL MG2 1 34 PRO HD2 . . 3.800 2.632 2.484 2.801 . 0 0 "[ . 1 . 2]" 2 632 1 24 VAL MG2 1 34 PRO HD3 . . 4.400 3.145 3.045 3.367 . 0 0 "[ . 1 . 2]" 2 633 1 24 VAL MG2 1 37 TRP HB2 . . 6.000 3.154 2.982 3.282 . 0 0 "[ . 1 . 2]" 2 634 1 24 VAL MG2 1 37 TRP HB3 . . 6.900 3.769 3.640 3.982 . 0 0 "[ . 1 . 2]" 2 635 1 24 VAL MG2 1 37 TRP HD1 . . 3.900 2.379 2.164 2.508 . 0 0 "[ . 1 . 2]" 2 636 1 24 VAL MG2 1 37 TRP HE1 . . 4.200 2.778 2.520 2.991 . 0 0 "[ . 1 . 2]" 2 637 1 25 ASN H 1 25 ASN HB2 . . 2.700 2.252 2.242 2.261 . 0 0 "[ . 1 . 2]" 2 638 1 25 ASN H 1 25 ASN HB3 . . 3.500 3.530 3.526 3.533 0.033 6 0 "[ . 1 . 2]" 2 639 1 25 ASN H 1 25 ASN HD21 . . 3.800 2.140 2.116 2.175 . 0 0 "[ . 1 . 2]" 2 640 1 25 ASN H 1 25 ASN HD22 . . 3.800 3.824 3.811 3.834 0.034 20 0 "[ . 1 . 2]" 2 641 1 25 ASN H 1 26 PRO QD . . 5.700 4.488 4.472 4.498 . 0 0 "[ . 1 . 2]" 2 642 1 25 ASN H 1 28 THR HB . . 4.400 4.338 4.194 4.422 0.022 2 0 "[ . 1 . 2]" 2 643 1 25 ASN H 1 28 THR MG . . 5.500 4.013 3.851 4.093 . 0 0 "[ . 1 . 2]" 2 644 1 25 ASN H 1 28 THR HG1 . . 3.600 3.181 3.086 3.232 . 0 0 "[ . 1 . 2]" 2 645 1 25 ASN HA 1 25 ASN HB3 . . 2.800 2.648 2.630 2.661 . 0 0 "[ . 1 . 2]" 2 646 1 25 ASN HA 1 25 ASN HD21 . . 3.300 3.160 2.982 3.301 0.001 12 0 "[ . 1 . 2]" 2 647 1 25 ASN HA 1 26 PRO QD . . 4.200 2.193 2.169 2.209 . 0 0 "[ . 1 . 2]" 2 648 1 25 ASN HB2 1 25 ASN HD21 . . 2.700 2.638 2.560 2.704 0.004 17 0 "[ . 1 . 2]" 2 649 1 25 ASN HB2 1 25 ASN HD22 . . 3.700 3.685 3.659 3.705 0.005 20 0 "[ . 1 . 2]" 2 650 1 25 ASN HB2 1 26 PRO QD . . 4.500 3.809 3.776 3.851 . 0 0 "[ . 1 . 2]" 2 651 1 25 ASN HB2 1 28 THR MG . . 7.000 4.596 4.477 4.682 . 0 0 "[ . 1 . 2]" 2 652 1 25 ASN HB2 1 28 THR HG1 . . 3.400 2.918 2.756 3.029 . 0 0 "[ . 1 . 2]" 2 653 1 25 ASN HB3 1 25 ASN HD21 . . 3.600 3.646 3.634 3.662 0.062 6 0 "[ . 1 . 2]" 2 654 1 25 ASN HB3 1 25 ASN HD22 . . 4.200 4.130 4.125 4.134 . 0 0 "[ . 1 . 2]" 2 655 1 25 ASN HB3 1 26 PRO QD . . 3.700 2.402 2.355 2.458 . 0 0 "[ . 1 . 2]" 2 656 1 25 ASN HB3 1 28 THR HG1 . . 4.100 3.624 3.485 3.756 . 0 0 "[ . 1 . 2]" 2 657 1 25 ASN HD21 1 26 PRO QD . . 7.000 4.647 4.526 4.740 . 0 0 "[ . 1 . 2]" 2 658 1 26 PRO HA 1 26 PRO HB3 . . 2.600 2.252 2.242 2.261 . 0 0 "[ . 1 . 2]" 2 659 1 26 PRO HA 1 26 PRO HG2 . . 4.100 3.920 3.900 3.946 . 0 0 "[ . 1 . 2]" 2 660 1 26 PRO HA 1 26 PRO HG3 . . 3.900 3.956 3.922 3.982 0.082 16 0 "[ . 1 . 2]" 2 661 1 26 PRO HA 1 27 GLY H . . 2.400 2.166 2.138 2.182 . 0 0 "[ . 1 . 2]" 2 662 1 26 PRO HA 1 27 GLY HA2 . . 4.600 4.381 4.351 4.407 . 0 0 "[ . 1 . 2]" 2 663 1 26 PRO HA 1 27 GLY HA3 . . 4.600 4.525 4.517 4.534 . 0 0 "[ . 1 . 2]" 2 664 1 26 PRO HA 1 28 THR H . . 3.500 3.277 3.233 3.338 . 0 0 "[ . 1 . 2]" 2 665 1 26 PRO HB2 1 26 PRO HG2 . . 2.600 2.352 2.337 2.363 . 0 0 "[ . 1 . 2]" 2 666 1 26 PRO HB2 1 26 PRO HG3 . . 2.700 2.744 2.732 2.770 0.070 20 0 "[ . 1 . 2]" 2 667 1 26 PRO HB2 1 27 GLY H . . 3.900 3.107 3.049 3.201 . 0 0 "[ . 1 . 2]" 2 668 1 26 PRO HB2 1 27 GLY HA2 . . 6.000 4.640 4.577 4.683 . 0 0 "[ . 1 . 2]" 2 669 1 26 PRO HB2 1 27 GLY HA3 . . 6.000 4.247 4.209 4.273 . 0 0 "[ . 1 . 2]" 2 670 1 26 PRO HB3 1 26 PRO HG2 . . 3.100 3.004 2.994 3.013 . 0 0 "[ . 1 . 2]" 2 671 1 26 PRO HB3 1 27 GLY H . . 3.500 3.528 3.513 3.549 0.049 9 0 "[ . 1 . 2]" 2 672 1 26 PRO HB3 1 27 GLY HA2 . . 6.000 5.588 5.557 5.620 . 0 0 "[ . 1 . 2]" 2 673 1 26 PRO HG2 1 27 GLY H . . 5.500 4.891 4.831 5.005 . 0 0 "[ . 1 . 2]" 2 674 1 27 GLY H 1 27 GLY HA2 . . 2.500 2.282 2.266 2.302 . 0 0 "[ . 1 . 2]" 2 675 1 27 GLY H 1 27 GLY HA3 . . 3.100 2.911 2.893 2.922 . 0 0 "[ . 1 . 2]" 2 676 1 27 GLY H 1 28 THR H . . 2.900 2.640 2.588 2.699 . 0 0 "[ . 1 . 2]" 2 677 1 27 GLY H 1 28 THR HG1 . . 5.400 4.549 4.472 4.634 . 0 0 "[ . 1 . 2]" 2 678 1 27 GLY HA2 1 28 THR H . . 3.300 3.233 3.179 3.271 . 0 0 "[ . 1 . 2]" 2 679 1 27 GLY HA2 1 28 THR HA . . 4.600 4.623 4.603 4.636 0.036 19 0 "[ . 1 . 2]" 2 680 1 27 GLY HA3 1 28 THR H . . 3.700 3.619 3.605 3.636 . 0 0 "[ . 1 . 2]" 2 681 1 27 GLY HA3 1 28 THR HA . . 4.500 4.525 4.509 4.545 0.045 3 0 "[ . 1 . 2]" 2 682 1 28 THR H 1 28 THR HB . . 2.800 2.384 2.334 2.404 . 0 0 "[ . 1 . 2]" 2 683 1 28 THR H 1 28 THR MG . . 4.300 3.713 3.699 3.723 . 0 0 "[ . 1 . 2]" 2 684 1 28 THR H 1 28 THR HG1 . . 3.000 2.534 2.483 2.625 . 0 0 "[ . 1 . 2]" 2 685 1 28 THR H 1 29 ASP H . . 4.600 4.338 4.243 4.412 . 0 0 "[ . 1 . 2]" 2 686 1 28 THR HA 1 28 THR MG . . 3.300 2.333 2.312 2.384 . 0 0 "[ . 1 . 2]" 2 687 1 28 THR HA 1 28 THR HG1 . . 3.800 3.128 3.065 3.254 . 0 0 "[ . 1 . 2]" 2 688 1 28 THR HA 1 29 ASP H . . 2.400 2.103 2.060 2.146 . 0 0 "[ . 1 . 2]" 2 689 1 28 THR HA 1 29 ASP HA . . 5.800 4.440 4.415 4.474 . 0 0 "[ . 1 . 2]" 2 690 1 28 THR HA 1 29 ASP HB2 . . 4.300 4.375 4.350 4.397 0.097 2 0 "[ . 1 . 2]" 2 691 1 28 THR HA 1 29 ASP HB3 . . 5.200 4.623 4.451 4.766 . 0 0 "[ . 1 . 2]" 2 692 1 28 THR HA 1 32 ASP HB2 . . 5.000 3.763 3.559 3.961 . 0 0 "[ . 1 . 2]" 2 693 1 28 THR HB 1 28 THR HG1 . . 2.500 2.203 2.163 2.219 . 0 0 "[ . 1 . 2]" 2 694 1 28 THR HB 1 29 ASP H . . 4.300 4.319 4.300 4.337 0.037 2 0 "[ . 1 . 2]" 2 695 1 28 THR HB 1 33 ILE HG12 . . 3.800 3.537 3.410 3.642 . 0 0 "[ . 1 . 2]" 2 696 1 28 THR MG 1 29 ASP H . . 3.600 2.925 2.833 3.005 . 0 0 "[ . 1 . 2]" 2 697 1 28 THR MG 1 29 ASP HA . . 5.800 4.238 4.133 4.310 . 0 0 "[ . 1 . 2]" 2 698 1 28 THR MG 1 29 ASP HB2 . . 5.700 4.654 4.575 4.755 . 0 0 "[ . 1 . 2]" 2 699 1 28 THR MG 1 29 ASP HB3 . . 5.500 4.073 3.974 4.231 . 0 0 "[ . 1 . 2]" 2 700 1 28 THR MG 1 30 PHE HA . . 5.400 4.018 3.847 4.163 . 0 0 "[ . 1 . 2]" 2 701 1 28 THR MG 1 32 ASP H . . 4.900 3.783 3.680 3.896 . 0 0 "[ . 1 . 2]" 2 702 1 28 THR MG 1 32 ASP HB2 . . 3.300 2.485 2.213 2.651 . 0 0 "[ . 1 . 2]" 2 703 1 28 THR MG 1 32 ASP HB3 . . 3.700 3.054 2.838 3.127 . 0 0 "[ . 1 . 2]" 2 704 1 28 THR MG 1 33 ILE H . . 3.700 3.039 2.938 3.084 . 0 0 "[ . 1 . 2]" 2 705 1 28 THR MG 1 33 ILE HA . . 3.300 2.584 2.479 2.669 . 0 0 "[ . 1 . 2]" 2 706 1 28 THR MG 1 34 PRO HD2 . . 5.200 4.295 4.164 4.350 . 0 0 "[ . 1 . 2]" 2 707 1 28 THR MG 1 34 PRO HD3 . . 4.700 3.440 3.208 3.597 . 0 0 "[ . 1 . 2]" 2 708 1 28 THR HG1 1 29 ASP H . . 6.000 5.106 5.059 5.203 . 0 0 "[ . 1 . 2]" 2 709 1 29 ASP H 1 29 ASP HA . . 3.100 2.856 2.836 2.887 . 0 0 "[ . 1 . 2]" 2 710 1 29 ASP H 1 29 ASP HB2 . . 2.700 2.329 2.298 2.361 . 0 0 "[ . 1 . 2]" 2 711 1 29 ASP H 1 29 ASP HB3 . . 2.800 2.630 2.517 2.692 . 0 0 "[ . 1 . 2]" 2 712 1 29 ASP H 1 30 PHE H . . 4.700 4.556 4.534 4.574 . 0 0 "[ . 1 . 2]" 2 713 1 29 ASP H 1 31 LYS H . . 6.000 5.070 4.965 5.112 . 0 0 "[ . 1 . 2]" 2 714 1 29 ASP H 1 31 LYS HG2 . . 6.000 4.913 4.788 5.033 . 0 0 "[ . 1 . 2]" 2 715 1 29 ASP H 1 32 ASP H . . 4.500 4.106 3.929 4.259 . 0 0 "[ . 1 . 2]" 2 716 1 29 ASP H 1 32 ASP HB2 . . 3.500 2.868 2.712 3.102 . 0 0 "[ . 1 . 2]" 2 717 1 29 ASP H 1 32 ASP HB3 . . 4.800 4.292 4.120 4.553 . 0 0 "[ . 1 . 2]" 2 718 1 29 ASP HA 1 29 ASP HB2 . . 2.800 2.562 2.517 2.589 . 0 0 "[ . 1 . 2]" 2 719 1 29 ASP HA 1 29 ASP HB3 . . 3.000 3.030 3.022 3.037 0.037 7 0 "[ . 1 . 2]" 2 720 1 29 ASP HA 1 30 PHE H . . 2.600 2.166 2.150 2.191 . 0 0 "[ . 1 . 2]" 2 721 1 29 ASP HA 1 30 PHE HA . . 4.400 4.423 4.398 4.441 0.041 12 0 "[ . 1 . 2]" 2 722 1 29 ASP HA 1 31 LYS H . . 4.100 3.861 3.816 3.950 . 0 0 "[ . 1 . 2]" 2 723 1 29 ASP HB2 1 30 PHE H . . 4.400 4.229 4.130 4.299 . 0 0 "[ . 1 . 2]" 2 724 1 29 ASP HB2 1 31 LYS H . . 4.100 4.230 4.208 4.270 0.170 20 0 "[ . 1 . 2]" 2 725 1 29 ASP HB2 1 31 LYS HG2 . . 3.900 3.653 3.558 3.769 . 0 0 "[ . 1 . 2]" 2 726 1 29 ASP HB2 1 31 LYS HG3 . . 6.000 4.929 4.768 5.114 . 0 0 "[ . 1 . 2]" 2 727 1 29 ASP HB2 1 32 ASP H . . 4.900 4.063 3.916 4.205 . 0 0 "[ . 1 . 2]" 2 728 1 29 ASP HB3 1 30 PHE H . . 4.100 3.919 3.711 4.008 . 0 0 "[ . 1 . 2]" 2 729 1 29 ASP HB3 1 31 LYS H . . 3.500 3.004 2.834 3.103 . 0 0 "[ . 1 . 2]" 2 730 1 29 ASP HB3 1 31 LYS QB . . 7.000 4.388 4.233 4.518 . 0 0 "[ . 1 . 2]" 2 731 1 29 ASP HB3 1 31 LYS HG2 . . 3.200 2.305 2.166 2.441 . 0 0 "[ . 1 . 2]" 2 732 1 29 ASP HB3 1 31 LYS HG3 . . 4.500 3.471 3.267 3.660 . 0 0 "[ . 1 . 2]" 2 733 1 29 ASP HB3 1 31 LYS QE . . 5.400 3.005 2.807 3.327 . 0 0 "[ . 1 . 2]" 2 734 1 29 ASP HB3 1 32 ASP H . . 3.400 2.343 2.180 2.501 . 0 0 "[ . 1 . 2]" 2 735 1 30 PHE H 1 30 PHE HA . . 3.000 2.790 2.745 2.837 . 0 0 "[ . 1 . 2]" 2 736 1 30 PHE H 1 30 PHE HB2 . . 2.600 2.147 2.077 2.207 . 0 0 "[ . 1 . 2]" 2 737 1 30 PHE H 1 30 PHE HB3 . . 2.900 2.854 2.624 2.916 0.016 3 0 "[ . 1 . 2]" 2 738 1 30 PHE H 1 31 LYS H . . 3.300 2.885 2.797 2.985 . 0 0 "[ . 1 . 2]" 2 739 1 30 PHE H 1 31 LYS QB . . 7.000 5.044 4.902 5.156 . 0 0 "[ . 1 . 2]" 2 740 1 30 PHE H 1 31 LYS HG2 . . 5.800 4.528 4.390 4.651 . 0 0 "[ . 1 . 2]" 2 741 1 30 PHE H 1 32 ASP H . . 4.800 4.303 4.219 4.519 . 0 0 "[ . 1 . 2]" 2 742 1 30 PHE H 1 33 ILE HG13 . . 4.300 4.075 3.959 4.208 . 0 0 "[ . 1 . 2]" 2 743 1 30 PHE H 1 33 ILE MD . . 5.800 4.016 3.939 4.220 . 0 0 "[ . 1 . 2]" 2 744 1 30 PHE HA 1 30 PHE HB2 . . 2.600 2.623 2.584 2.651 0.051 14 0 "[ . 1 . 2]" 2 745 1 30 PHE HA 1 30 PHE HB3 . . 3.100 3.038 3.021 3.074 . 0 0 "[ . 1 . 2]" 2 746 1 30 PHE HA 1 30 PHE QD . . 3.900 2.897 2.203 3.116 . 0 0 "[ . 1 . 2]" 2 747 1 30 PHE HA 1 31 LYS H . . 3.900 3.613 3.554 3.652 . 0 0 "[ . 1 . 2]" 2 748 1 30 PHE HA 1 31 LYS HA . . 5.800 4.705 4.678 4.742 . 0 0 "[ . 1 . 2]" 2 749 1 30 PHE HA 1 32 ASP H . . 4.600 4.266 4.145 4.448 . 0 0 "[ . 1 . 2]" 2 750 1 30 PHE HA 1 33 ILE H . . 3.500 3.339 3.288 3.402 . 0 0 "[ . 1 . 2]" 2 751 1 30 PHE HA 1 33 ILE HB . . 3.400 3.333 3.193 3.409 0.009 20 0 "[ . 1 . 2]" 2 752 1 30 PHE HA 1 33 ILE MG . . 4.700 3.987 3.929 4.024 . 0 0 "[ . 1 . 2]" 2 753 1 30 PHE HA 1 33 ILE HG12 . . 3.400 3.532 3.513 3.565 0.165 19 0 "[ . 1 . 2]" 2 754 1 30 PHE HA 1 33 ILE HG13 . . 2.400 2.066 2.042 2.086 . 0 0 "[ . 1 . 2]" 2 755 1 30 PHE HA 1 33 ILE MD . . 3.300 2.036 2.005 2.124 . 0 0 "[ . 1 . 2]" 2 756 1 30 PHE HA 1 46 LYS HE3 . . 4.300 3.987 3.754 4.149 . 0 0 "[ . 1 . 2]" 2 757 1 30 PHE HB2 1 31 LYS H . . 3.900 3.847 3.747 3.952 0.052 20 0 "[ . 1 . 2]" 2 758 1 30 PHE HB2 1 33 ILE MD . . 5.200 3.727 3.615 3.834 . 0 0 "[ . 1 . 2]" 2 759 1 30 PHE HB3 1 31 LYS H . . 3.100 2.933 2.812 3.020 . 0 0 "[ . 1 . 2]" 2 760 1 30 PHE HB3 1 31 LYS HA . . 4.500 4.048 3.909 4.144 . 0 0 "[ . 1 . 2]" 2 761 1 30 PHE HB3 1 32 ASP H . . 5.700 5.056 4.926 5.258 . 0 0 "[ . 1 . 2]" 2 762 1 30 PHE HB3 1 33 ILE MD . . 6.200 4.348 4.290 4.487 . 0 0 "[ . 1 . 2]" 2 763 1 30 PHE QD 1 31 LYS H . . 6.000 4.293 4.156 4.532 . 0 0 "[ . 1 . 2]" 2 764 1 30 PHE QD 1 31 LYS HA . . 5.800 3.656 3.378 4.253 . 0 0 "[ . 1 . 2]" 2 765 1 30 PHE QD 1 31 LYS QB . . 9.000 4.667 4.468 5.090 . 0 0 "[ . 1 . 2]" 2 766 1 30 PHE QD 1 31 LYS HG2 . . 7.500 6.039 5.915 6.241 . 0 0 "[ . 1 . 2]" 2 767 1 30 PHE QD 1 31 LYS HG3 . . 8.000 6.783 6.604 7.144 . 0 0 "[ . 1 . 2]" 2 768 1 30 PHE QD 1 32 ASP H . . 8.000 5.567 5.318 5.977 . 0 0 "[ . 1 . 2]" 2 769 1 30 PHE QD 1 33 ILE HB . . 7.200 4.201 3.182 4.569 . 0 0 "[ . 1 . 2]" 2 770 1 30 PHE QD 1 33 ILE MG . . 9.000 4.536 3.863 4.823 . 0 0 "[ . 1 . 2]" 2 771 1 30 PHE QD 1 33 ILE HG12 . . 7.400 5.379 4.558 5.646 . 0 0 "[ . 1 . 2]" 2 772 1 30 PHE QD 1 33 ILE HG13 . . 6.600 4.351 3.665 4.577 . 0 0 "[ . 1 . 2]" 2 773 1 30 PHE QD 1 33 ILE MD . . 6.000 2.935 2.000 3.214 . 0 0 "[ . 1 . 2]" 2 774 1 30 PHE QD 1 37 TRP HH2 . . 5.900 5.489 4.911 5.778 . 0 0 "[ . 1 . 2]" 2 775 1 30 PHE QD 1 46 LYS QB . . 9.000 4.300 3.828 5.010 . 0 0 "[ . 1 . 2]" 2 776 1 30 PHE QD 1 46 LYS HE2 . . 4.800 3.183 2.402 4.321 . 0 0 "[ . 1 . 2]" 2 777 1 30 PHE QD 1 46 LYS HE3 . . 6.900 3.269 2.252 4.123 . 0 0 "[ . 1 . 2]" 2 778 1 30 PHE QD 1 46 LYS QZ . . 6.900 3.258 2.825 4.109 . 0 0 "[ . 1 . 2]" 2 779 1 30 PHE QE 1 33 ILE MD . . 8.200 3.350 2.788 3.611 . 0 0 "[ . 1 . 2]" 2 780 1 30 PHE QE 1 37 TRP HZ3 . . 7.200 3.537 2.832 3.850 . 0 0 "[ . 1 . 2]" 2 781 1 30 PHE QE 1 37 TRP HH2 . . 8.000 3.701 3.069 4.466 . 0 0 "[ . 1 . 2]" 2 782 1 30 PHE QE 1 46 LYS QB . . 7.300 2.588 2.150 3.550 . 0 0 "[ . 1 . 2]" 2 783 1 30 PHE QE 1 46 LYS QG . . 8.300 3.517 2.216 4.955 . 0 0 "[ . 1 . 2]" 2 784 1 30 PHE QE 1 46 LYS HE2 . . 6.300 2.609 2.264 4.144 . 0 0 "[ . 1 . 2]" 2 785 1 30 PHE QE 1 46 LYS HE3 . . 8.000 3.053 2.592 4.097 . 0 0 "[ . 1 . 2]" 2 786 1 30 PHE QE 1 49 PHE HB3 . . 6.000 3.304 2.455 3.787 . 0 0 "[ . 1 . 2]" 2 787 1 30 PHE HZ 1 46 LYS HA . . 3.500 3.316 2.785 3.554 0.054 12 0 "[ . 1 . 2]" 2 788 1 30 PHE HZ 1 46 LYS QB . . 4.400 3.417 2.813 3.958 . 0 0 "[ . 1 . 2]" 2 789 1 30 PHE HZ 1 46 LYS QG . . 5.700 4.513 3.185 5.125 . 0 0 "[ . 1 . 2]" 2 790 1 30 PHE HZ 1 46 LYS HE2 . . 4.500 4.588 4.551 4.661 0.161 19 0 "[ . 1 . 2]" 2 791 1 30 PHE HZ 1 49 PHE HB3 . . 2.900 2.962 2.726 3.124 0.224 14 0 "[ . 1 . 2]" 2 792 1 31 LYS H 1 31 LYS HA . . 3.000 2.919 2.909 2.930 . 0 0 "[ . 1 . 2]" 2 793 1 31 LYS H 1 31 LYS HG2 . . 2.800 2.110 2.066 2.153 . 0 0 "[ . 1 . 2]" 2 794 1 31 LYS H 1 31 LYS HG3 . . 3.400 3.479 3.418 3.513 0.113 20 0 "[ . 1 . 2]" 2 795 1 31 LYS H 1 31 LYS QD . . 4.200 3.521 3.299 3.723 . 0 0 "[ . 1 . 2]" 2 796 1 31 LYS H 1 31 LYS QE . . 6.800 4.176 4.000 4.563 . 0 0 "[ . 1 . 2]" 2 797 1 31 LYS H 1 32 ASP H . . 3.100 2.455 2.384 2.519 . 0 0 "[ . 1 . 2]" 2 798 1 31 LYS H 1 32 ASP HB2 . . 6.000 4.549 4.426 4.725 . 0 0 "[ . 1 . 2]" 2 799 1 31 LYS H 1 33 ILE H . . 4.500 3.938 3.889 3.985 . 0 0 "[ . 1 . 2]" 2 800 1 31 LYS H 1 33 ILE HG13 . . 4.700 4.409 4.362 4.487 . 0 0 "[ . 1 . 2]" 2 801 1 31 LYS HA 1 31 LYS HG2 . . 3.600 3.632 3.611 3.659 0.059 17 0 "[ . 1 . 2]" 2 802 1 31 LYS HA 1 31 LYS HG3 . . 4.000 3.660 3.603 3.730 . 0 0 "[ . 1 . 2]" 2 803 1 31 LYS HA 1 31 LYS QD . . 4.600 4.179 4.152 4.192 . 0 0 "[ . 1 . 2]" 2 804 1 31 LYS HA 1 32 ASP H . . 3.700 3.525 3.503 3.566 . 0 0 "[ . 1 . 2]" 2 805 1 31 LYS HA 1 32 ASP HA . . 5.800 4.799 4.766 4.848 . 0 0 "[ . 1 . 2]" 2 806 1 31 LYS HA 1 33 ILE H . . 4.000 4.062 4.024 4.088 0.088 10 0 "[ . 1 . 2]" 2 807 1 31 LYS HA 1 46 LYS HE2 . . 4.600 4.533 4.391 4.625 0.025 6 0 "[ . 1 . 2]" 2 808 1 31 LYS HA 1 46 LYS HE3 . . 5.000 4.718 4.456 4.887 . 0 0 "[ . 1 . 2]" 2 809 1 31 LYS HA 1 46 LYS QZ . . 4.600 2.625 2.417 2.841 . 0 0 "[ . 1 . 2]" 2 810 1 31 LYS QB 1 32 ASP H . . 5.800 3.576 3.494 3.625 . 0 0 "[ . 1 . 2]" 2 811 1 31 LYS HG2 1 32 ASP H . . 3.600 2.297 2.092 2.536 . 0 0 "[ . 1 . 2]" 2 812 1 31 LYS HG2 1 32 ASP HB2 . . 6.000 4.044 3.752 4.481 . 0 0 "[ . 1 . 2]" 2 813 1 31 LYS HG2 1 32 ASP HB3 . . 6.000 5.125 4.905 5.343 . 0 0 "[ . 1 . 2]" 2 814 1 31 LYS HG3 1 32 ASP H . . 3.900 2.734 2.588 2.834 . 0 0 "[ . 1 . 2]" 2 815 1 31 LYS HG3 1 33 ILE H . . 4.900 4.935 4.897 4.995 0.095 19 0 "[ . 1 . 2]" 2 816 1 31 LYS QE 1 32 ASP H . . 7.000 4.072 3.739 4.463 . 0 0 "[ . 1 . 2]" 2 817 1 32 ASP H 1 32 ASP HB2 . . 2.800 2.377 2.313 2.493 . 0 0 "[ . 1 . 2]" 2 818 1 32 ASP H 1 32 ASP HB3 . . 3.600 3.560 3.528 3.593 . 0 0 "[ . 1 . 2]" 2 819 1 32 ASP H 1 33 ILE H . . 2.700 2.523 2.425 2.676 . 0 0 "[ . 1 . 2]" 2 820 1 32 ASP H 1 33 ILE HA . . 5.100 4.966 4.883 5.103 0.003 1 0 "[ . 1 . 2]" 2 821 1 32 ASP H 1 33 ILE HB . . 4.900 4.684 4.531 4.890 . 0 0 "[ . 1 . 2]" 2 822 1 32 ASP H 1 33 ILE MG . . 7.000 5.693 5.609 5.832 . 0 0 "[ . 1 . 2]" 2 823 1 32 ASP H 1 33 ILE HG12 . . 5.300 5.131 5.037 5.304 0.004 1 0 "[ . 1 . 2]" 2 824 1 32 ASP H 1 33 ILE HG13 . . 4.000 3.808 3.692 3.975 . 0 0 "[ . 1 . 2]" 2 825 1 32 ASP H 1 33 ILE MD . . 6.700 5.096 4.992 5.255 . 0 0 "[ . 1 . 2]" 2 826 1 32 ASP HA 1 32 ASP HB3 . . 2.700 2.505 2.435 2.544 . 0 0 "[ . 1 . 2]" 2 827 1 32 ASP HA 1 33 ILE H . . 3.600 3.541 3.500 3.583 . 0 0 "[ . 1 . 2]" 2 828 1 32 ASP HB2 1 33 ILE H . . 3.900 3.316 3.187 3.487 . 0 0 "[ . 1 . 2]" 2 829 1 32 ASP HB2 1 33 ILE HA . . 5.200 4.530 4.246 4.688 . 0 0 "[ . 1 . 2]" 2 830 1 32 ASP HB3 1 33 ILE H . . 4.400 4.156 4.028 4.245 . 0 0 "[ . 1 . 2]" 2 831 1 32 ASP HB3 1 33 ILE HA . . 5.200 4.739 4.549 4.855 . 0 0 "[ . 1 . 2]" 2 832 1 33 ILE H 1 33 ILE HA . . 3.000 2.738 2.715 2.765 . 0 0 "[ . 1 . 2]" 2 833 1 33 ILE H 1 33 ILE HB . . 2.700 2.360 2.264 2.456 . 0 0 "[ . 1 . 2]" 2 834 1 33 ILE H 1 33 ILE MG . . 4.200 3.647 3.622 3.664 . 0 0 "[ . 1 . 2]" 2 835 1 33 ILE H 1 33 ILE HG12 . . 3.000 3.078 3.049 3.105 0.105 18 0 "[ . 1 . 2]" 2 836 1 33 ILE H 1 33 ILE HG13 . . 2.400 2.028 2.004 2.082 . 0 0 "[ . 1 . 2]" 2 837 1 33 ILE H 1 33 ILE MD . . 4.300 3.588 3.574 3.621 . 0 0 "[ . 1 . 2]" 2 838 1 33 ILE H 1 34 PRO HD2 . . 5.100 5.031 4.974 5.052 . 0 0 "[ . 1 . 2]" 2 839 1 33 ILE H 1 34 PRO HD3 . . 4.700 4.637 4.571 4.687 . 0 0 "[ . 1 . 2]" 2 840 1 33 ILE H 1 46 LYS HE3 . . 4.400 4.180 3.972 4.297 . 0 0 "[ . 1 . 2]" 2 841 1 33 ILE H 1 46 LYS QZ . . 3.700 2.971 2.795 3.130 . 0 0 "[ . 1 . 2]" 2 842 1 33 ILE HA 1 33 ILE HB . . 3.000 2.985 2.965 3.001 0.001 15 0 "[ . 1 . 2]" 2 843 1 33 ILE HA 1 33 ILE MG . . 3.300 2.519 2.473 2.556 . 0 0 "[ . 1 . 2]" 2 844 1 33 ILE HA 1 33 ILE HG12 . . 2.400 2.272 2.256 2.284 . 0 0 "[ . 1 . 2]" 2 845 1 33 ILE HA 1 33 ILE HG13 . . 4.100 3.012 2.985 3.049 . 0 0 "[ . 1 . 2]" 2 846 1 33 ILE HA 1 33 ILE MD . . 4.400 3.700 3.675 3.711 . 0 0 "[ . 1 . 2]" 2 847 1 33 ILE HA 1 34 PRO HA . . 5.800 4.532 4.483 4.572 . 0 0 "[ . 1 . 2]" 2 848 1 33 ILE HA 1 34 PRO QG . . 4.300 3.941 3.888 3.962 . 0 0 "[ . 1 . 2]" 2 849 1 33 ILE HA 1 34 PRO HD2 . . 2.600 2.586 2.510 2.610 0.010 17 0 "[ . 1 . 2]" 2 850 1 33 ILE HA 1 34 PRO HD3 . . 2.300 2.046 2.016 2.063 . 0 0 "[ . 1 . 2]" 2 851 1 33 ILE HA 1 46 LYS QZ . . 5.700 3.998 3.927 4.104 . 0 0 "[ . 1 . 2]" 2 852 1 33 ILE HB 1 33 ILE HG12 . . 3.000 3.018 3.005 3.033 0.033 15 0 "[ . 1 . 2]" 2 853 1 33 ILE HB 1 33 ILE HG13 . . 2.600 2.444 2.410 2.498 . 0 0 "[ . 1 . 2]" 2 854 1 33 ILE HB 1 33 ILE MD . . 3.300 2.509 2.490 2.540 . 0 0 "[ . 1 . 2]" 2 855 1 33 ILE HB 1 34 PRO HD2 . . 4.100 4.149 4.110 4.207 0.107 13 0 "[ . 1 . 2]" 2 856 1 33 ILE HB 1 34 PRO HD3 . . 4.600 4.639 4.622 4.664 0.064 20 0 "[ . 1 . 2]" 2 857 1 33 ILE HB 1 37 TRP HB2 . . 5.900 5.589 5.414 5.713 . 0 0 "[ . 1 . 2]" 2 858 1 33 ILE HB 1 37 TRP HB3 . . 5.200 4.697 4.563 4.785 . 0 0 "[ . 1 . 2]" 2 859 1 33 ILE HB 1 46 LYS QG . . 5.200 4.522 4.116 4.763 . 0 0 "[ . 1 . 2]" 2 860 1 33 ILE HB 1 46 LYS HD2 . . 3.300 3.143 2.923 3.345 0.045 19 0 "[ . 1 . 2]" 2 861 1 33 ILE HB 1 46 LYS HD3 . . 4.500 3.998 3.368 4.464 . 0 0 "[ . 1 . 2]" 2 862 1 33 ILE HB 1 46 LYS HE2 . . 4.300 3.655 3.541 3.733 . 0 0 "[ . 1 . 2]" 2 863 1 33 ILE HB 1 46 LYS HE3 . . 2.700 2.130 2.058 2.193 . 0 0 "[ . 1 . 2]" 2 864 1 33 ILE HB 1 46 LYS QZ . . 4.500 2.147 2.068 2.260 . 0 0 "[ . 1 . 2]" 2 865 1 33 ILE HG12 1 33 ILE MG . . 3.300 2.394 2.338 2.451 . 0 0 "[ . 1 . 2]" 2 866 1 33 ILE HG13 1 33 ILE MG . . 3.700 3.125 3.114 3.139 . 0 0 "[ . 1 . 2]" 2 867 1 33 ILE MG 1 34 PRO HA . . 6.200 4.205 4.151 4.266 . 0 0 "[ . 1 . 2]" 2 868 1 33 ILE MG 1 34 PRO HB2 . . 5.400 4.313 3.947 4.503 . 0 0 "[ . 1 . 2]" 2 869 1 33 ILE MG 1 34 PRO HB3 . . 7.000 5.001 4.957 5.061 . 0 0 "[ . 1 . 2]" 2 870 1 33 ILE MG 1 34 PRO QG . . 6.100 3.680 3.579 3.853 . 0 0 "[ . 1 . 2]" 2 871 1 33 ILE MG 1 34 PRO HD2 . . 3.300 2.089 2.038 2.156 . 0 0 "[ . 1 . 2]" 2 872 1 33 ILE MG 1 34 PRO HD3 . . 4.000 3.147 3.090 3.213 . 0 0 "[ . 1 . 2]" 2 873 1 33 ILE MG 1 35 ASP H . . 7.000 4.843 4.702 4.960 . 0 0 "[ . 1 . 2]" 2 874 1 33 ILE MG 1 36 ASP H . . 6.900 5.084 4.895 5.267 . 0 0 "[ . 1 . 2]" 2 875 1 33 ILE MG 1 37 TRP H . . 4.900 3.667 3.548 3.745 . 0 0 "[ . 1 . 2]" 2 876 1 33 ILE MG 1 37 TRP HA . . 6.600 4.600 4.481 4.675 . 0 0 "[ . 1 . 2]" 2 877 1 33 ILE MG 1 37 TRP HB2 . . 3.500 2.844 2.678 2.945 . 0 0 "[ . 1 . 2]" 2 878 1 33 ILE MG 1 37 TRP HB3 . . 3.500 2.232 2.171 2.323 . 0 0 "[ . 1 . 2]" 2 879 1 33 ILE MG 1 37 TRP HD1 . . 5.400 4.117 3.819 4.300 . 0 0 "[ . 1 . 2]" 2 880 1 33 ILE MG 1 37 TRP HE3 . . 4.400 2.607 2.304 3.019 . 0 0 "[ . 1 . 2]" 2 881 1 33 ILE MG 1 37 TRP HE1 . . 7.000 4.591 4.224 4.807 . 0 0 "[ . 1 . 2]" 2 882 1 33 ILE MG 1 46 LYS QG . . 6.200 3.563 2.850 3.998 . 0 0 "[ . 1 . 2]" 2 883 1 33 ILE MG 1 46 LYS HD2 . . 3.900 2.203 2.087 2.311 . 0 0 "[ . 1 . 2]" 2 884 1 33 ILE MG 1 46 LYS HD3 . . 4.800 3.478 2.741 3.800 . 0 0 "[ . 1 . 2]" 2 885 1 33 ILE MG 1 46 LYS HE2 . . 7.000 3.955 3.811 4.079 . 0 0 "[ . 1 . 2]" 2 886 1 33 ILE MG 1 46 LYS HE3 . . 5.300 2.579 2.406 2.841 . 0 0 "[ . 1 . 2]" 2 887 1 33 ILE MG 1 46 LYS QZ . . 8.000 2.943 2.737 3.087 . 0 0 "[ . 1 . 2]" 2 888 1 33 ILE HG12 1 34 PRO HD2 . . 3.900 3.927 3.865 3.950 0.050 6 0 "[ . 1 . 2]" 2 889 1 33 ILE HG12 1 34 PRO HD3 . . 3.900 3.968 3.949 3.997 0.097 12 0 "[ . 1 . 2]" 2 890 1 33 ILE HG12 1 46 LYS HE3 . . 5.300 4.831 4.716 4.936 . 0 0 "[ . 1 . 2]" 2 891 1 33 ILE HG13 1 46 LYS QZ . . 5.100 3.851 3.691 4.097 . 0 0 "[ . 1 . 2]" 2 892 1 33 ILE MD 1 34 PRO HD2 . . 5.700 4.371 4.282 4.431 . 0 0 "[ . 1 . 2]" 2 893 1 33 ILE MD 1 37 TRP HB2 . . 6.500 5.056 4.798 5.253 . 0 0 "[ . 1 . 2]" 2 894 1 33 ILE MD 1 37 TRP HB3 . . 6.400 4.469 4.295 4.575 . 0 0 "[ . 1 . 2]" 2 895 1 33 ILE MD 1 37 TRP HE3 . . 7.000 3.889 3.624 4.242 . 0 0 "[ . 1 . 2]" 2 896 1 33 ILE MD 1 46 LYS HD2 . . 6.700 4.071 3.544 4.280 . 0 0 "[ . 1 . 2]" 2 897 1 33 ILE MD 1 46 LYS HE2 . . 6.200 4.283 4.126 4.440 . 0 0 "[ . 1 . 2]" 2 898 1 33 ILE MD 1 46 LYS HE3 . . 5.000 2.855 2.757 2.966 . 0 0 "[ . 1 . 2]" 2 899 1 34 PRO HA 1 34 PRO HB3 . . 2.600 2.277 2.243 2.333 . 0 0 "[ . 1 . 2]" 2 900 1 34 PRO HA 1 34 PRO QG . . 3.200 3.380 3.052 3.508 0.308 20 0 "[ . 1 . 2]" 2 901 1 34 PRO HA 1 34 PRO HD2 . . 3.700 3.950 3.894 3.982 0.282 20 0 "[ . 1 . 2]" 2 902 1 34 PRO HA 1 34 PRO HD3 . . 3.600 3.803 3.739 3.861 0.261 6 0 "[ . 1 . 2]" 2 903 1 34 PRO HA 1 35 ASP H . . 2.500 2.298 2.258 2.365 . 0 0 "[ . 1 . 2]" 2 904 1 34 PRO HA 1 35 ASP HB2 . . 4.700 4.308 4.225 4.439 . 0 0 "[ . 1 . 2]" 2 905 1 34 PRO HA 1 35 ASP HB3 . . 6.000 5.587 5.481 5.694 . 0 0 "[ . 1 . 2]" 2 906 1 34 PRO HA 1 36 ASP H . . 4.200 3.758 3.653 3.851 . 0 0 "[ . 1 . 2]" 2 907 1 34 PRO HB2 1 34 PRO QG . . 2.500 2.215 2.182 2.281 . 0 0 "[ . 1 . 2]" 2 908 1 34 PRO HB2 1 34 PRO HD2 . . 3.800 3.484 3.073 3.706 . 0 0 "[ . 1 . 2]" 2 909 1 34 PRO HB2 1 34 PRO HD3 . . 3.800 4.074 3.923 4.141 0.341 11 0 "[ . 1 . 2]" 2 910 1 34 PRO HB2 1 35 ASP H . . 3.700 3.563 3.413 3.747 0.047 18 0 "[ . 1 . 2]" 2 911 1 34 PRO HB2 1 36 ASP H . . 3.200 2.511 2.303 2.964 . 0 0 "[ . 1 . 2]" 2 912 1 34 PRO HB2 1 37 TRP H . . 3.800 2.980 2.591 3.158 . 0 0 "[ . 1 . 2]" 2 913 1 34 PRO HB2 1 37 TRP HA . . 6.000 4.764 4.112 5.103 . 0 0 "[ . 1 . 2]" 2 914 1 34 PRO HB2 1 37 TRP HB2 . . 4.000 3.586 2.754 3.985 . 0 0 "[ . 1 . 2]" 2 915 1 34 PRO HB2 1 37 TRP HB3 . . 4.600 4.320 3.668 4.618 0.018 10 0 "[ . 1 . 2]" 2 916 1 34 PRO HB3 1 34 PRO HD2 . . 4.100 4.015 3.966 4.037 . 0 0 "[ . 1 . 2]" 2 917 1 34 PRO HB3 1 34 PRO HD3 . . 3.600 3.810 3.638 4.045 0.445 18 0 "[ . 1 . 2]" 2 918 1 34 PRO HB3 1 35 ASP H . . 3.700 3.707 3.544 3.764 0.064 6 0 "[ . 1 . 2]" 2 919 1 34 PRO HB3 1 36 ASP H . . 3.700 3.640 3.363 3.720 0.020 20 0 "[ . 1 . 2]" 2 920 1 34 PRO HB3 1 37 TRP H . . 4.800 4.632 4.192 4.811 0.011 19 0 "[ . 1 . 2]" 2 921 1 34 PRO HD2 1 34 PRO QG . . 2.500 2.243 2.193 2.336 . 0 0 "[ . 1 . 2]" 2 922 1 34 PRO HD3 1 34 PRO QG . . 2.600 2.200 2.180 2.216 . 0 0 "[ . 1 . 2]" 2 923 1 34 PRO QG 1 35 ASP H . . 5.600 4.890 4.820 4.959 . 0 0 "[ . 1 . 2]" 2 924 1 34 PRO QG 1 36 ASP H . . 5.400 4.345 4.033 4.851 . 0 0 "[ . 1 . 2]" 2 925 1 34 PRO HD2 1 36 ASP H . . 5.700 5.322 5.079 5.599 . 0 0 "[ . 1 . 2]" 2 926 1 34 PRO HD2 1 37 TRP H . . 5.000 4.133 3.975 4.291 . 0 0 "[ . 1 . 2]" 2 927 1 34 PRO HD2 1 37 TRP HB2 . . 3.000 2.617 2.506 2.747 . 0 0 "[ . 1 . 2]" 2 928 1 34 PRO HD2 1 37 TRP HB3 . . 3.500 3.263 3.009 3.591 0.091 17 0 "[ . 1 . 2]" 2 929 1 34 PRO HD2 1 37 TRP HD1 . . 4.900 4.565 4.432 4.677 . 0 0 "[ . 1 . 2]" 2 930 1 34 PRO HD3 1 37 TRP H . . 5.700 5.589 5.460 5.733 0.033 18 0 "[ . 1 . 2]" 2 931 1 34 PRO HD3 1 37 TRP HB2 . . 4.900 4.289 4.187 4.477 . 0 0 "[ . 1 . 2]" 2 932 1 34 PRO HD3 1 37 TRP HD1 . . 6.000 5.970 5.843 6.024 0.024 6 0 "[ . 1 . 2]" 2 933 1 35 ASP H 1 35 ASP HB2 . . 2.800 2.077 2.015 2.144 . 0 0 "[ . 1 . 2]" 2 934 1 35 ASP H 1 35 ASP HB3 . . 3.200 3.318 3.211 3.371 0.171 4 0 "[ . 1 . 2]" 2 935 1 35 ASP H 1 36 ASP H . . 3.400 2.660 2.520 2.750 . 0 0 "[ . 1 . 2]" 2 936 1 35 ASP H 1 37 TRP H . . 4.600 4.182 4.028 4.260 . 0 0 "[ . 1 . 2]" 2 937 1 35 ASP H 1 46 LYS HD2 . . 6.000 4.766 4.373 5.438 . 0 0 "[ . 1 . 2]" 2 938 1 35 ASP H 1 46 LYS HD3 . . 6.000 4.151 3.691 4.814 . 0 0 "[ . 1 . 2]" 2 939 1 35 ASP HA 1 35 ASP HB3 . . 2.900 2.698 2.533 2.897 . 0 0 "[ . 1 . 2]" 2 940 1 35 ASP HA 1 36 ASP H . . 3.700 3.402 3.299 3.491 . 0 0 "[ . 1 . 2]" 2 941 1 35 ASP HA 1 37 TRP H . . 5.100 3.391 3.192 3.603 . 0 0 "[ . 1 . 2]" 2 942 1 35 ASP HA 1 37 TRP HB2 . . 6.000 5.420 5.078 5.745 . 0 0 "[ . 1 . 2]" 2 943 1 35 ASP HA 1 37 TRP HB3 . . 5.200 4.281 3.982 4.638 . 0 0 "[ . 1 . 2]" 2 944 1 35 ASP HA 1 46 LYS QB . . 7.000 4.026 3.521 4.419 . 0 0 "[ . 1 . 2]" 2 945 1 35 ASP HA 1 46 LYS QG . . 6.900 2.786 2.335 3.576 . 0 0 "[ . 1 . 2]" 2 946 1 35 ASP HA 1 46 LYS HD2 . . 3.400 2.861 2.421 3.452 0.052 6 0 "[ . 1 . 2]" 2 947 1 35 ASP HA 1 46 LYS HD3 . . 2.700 2.136 2.061 2.222 . 0 0 "[ . 1 . 2]" 2 948 1 35 ASP HA 1 46 LYS HE2 . . 4.700 4.676 4.535 4.807 0.107 20 0 "[ . 1 . 2]" 2 949 1 35 ASP HA 1 46 LYS HE3 . . 5.100 4.829 4.545 5.049 . 0 0 "[ . 1 . 2]" 2 950 1 35 ASP HA 1 46 LYS QZ . . 5.500 3.500 2.951 3.833 . 0 0 "[ . 1 . 2]" 2 951 1 35 ASP HB2 1 36 ASP H . . 3.900 3.600 3.319 3.886 . 0 0 "[ . 1 . 2]" 2 952 1 35 ASP HB3 1 36 ASP H . . 4.000 3.857 3.485 4.059 0.059 6 0 "[ . 1 . 2]" 2 953 1 35 ASP HB3 1 46 LYS HD2 . . 5.900 5.508 5.041 5.903 0.003 1 0 "[ . 1 . 2]" 2 954 1 35 ASP HB3 1 46 LYS HD3 . . 6.000 4.376 3.964 4.814 . 0 0 "[ . 1 . 2]" 2 955 1 36 ASP H 1 36 ASP HB2 . . 3.500 2.801 2.017 3.580 0.080 1 0 "[ . 1 . 2]" 2 956 1 36 ASP H 1 36 ASP HB3 . . 3.200 2.959 2.600 3.249 0.049 12 0 "[ . 1 . 2]" 2 957 1 36 ASP H 1 37 TRP H . . 2.900 2.531 2.423 2.599 . 0 0 "[ . 1 . 2]" 2 958 1 36 ASP H 1 37 TRP HA . . 6.000 5.043 4.968 5.127 . 0 0 "[ . 1 . 2]" 2 959 1 36 ASP H 1 37 TRP HB2 . . 4.700 4.731 4.710 4.754 0.054 14 0 "[ . 1 . 2]" 2 960 1 36 ASP H 1 37 TRP HB3 . . 5.000 4.714 4.586 4.795 . 0 0 "[ . 1 . 2]" 2 961 1 36 ASP HA 1 36 ASP HB2 . . 2.700 2.645 2.372 2.841 0.141 12 0 "[ . 1 . 2]" 2 962 1 36 ASP HA 1 36 ASP HB3 . . 2.700 2.614 2.408 2.819 0.119 10 0 "[ . 1 . 2]" 2 963 1 36 ASP HA 1 37 TRP H . . 3.400 3.452 3.410 3.475 0.075 3 0 "[ . 1 . 2]" 2 964 1 36 ASP HB2 1 37 TRP H . . 4.800 3.950 3.579 4.313 . 0 0 "[ . 1 . 2]" 2 965 1 36 ASP HB3 1 37 TRP H . . 5.800 3.994 3.446 4.505 . 0 0 "[ . 1 . 2]" 2 966 1 37 TRP H 1 37 TRP HB2 . . 2.700 2.640 2.579 2.680 . 0 0 "[ . 1 . 2]" 2 967 1 37 TRP H 1 37 TRP HB3 . . 2.600 2.364 2.310 2.407 . 0 0 "[ . 1 . 2]" 2 968 1 37 TRP H 1 37 TRP HE3 . . 4.300 4.336 4.305 4.361 0.061 15 0 "[ . 1 . 2]" 2 969 1 37 TRP H 1 46 LYS HD2 . . 5.000 3.954 3.674 4.457 . 0 0 "[ . 1 . 2]" 2 970 1 37 TRP HA 1 37 TRP HB2 . . 3.100 2.445 2.415 2.468 . 0 0 "[ . 1 . 2]" 2 971 1 37 TRP HA 1 37 TRP HD1 . . 4.300 3.122 3.011 3.227 . 0 0 "[ . 1 . 2]" 2 972 1 37 TRP HA 1 38 VAL H . . 2.900 2.301 2.201 2.376 . 0 0 "[ . 1 . 2]" 2 973 1 37 TRP HB2 1 37 TRP HD1 . . 2.800 2.805 2.781 2.828 0.028 14 0 "[ . 1 . 2]" 2 974 1 37 TRP HB2 1 37 TRP HE3 . . 4.000 4.022 3.951 4.052 0.052 10 0 "[ . 1 . 2]" 2 975 1 37 TRP HB2 1 38 VAL H . . 6.000 3.870 3.770 3.968 . 0 0 "[ . 1 . 2]" 2 976 1 37 TRP HB2 1 46 LYS HD2 . . 5.100 4.554 4.276 4.768 . 0 0 "[ . 1 . 2]" 2 977 1 37 TRP HB3 1 37 TRP HD1 . . 4.000 3.850 3.842 3.857 . 0 0 "[ . 1 . 2]" 2 978 1 37 TRP HB3 1 37 TRP HE3 . . 2.700 2.437 2.377 2.473 . 0 0 "[ . 1 . 2]" 2 979 1 37 TRP HB3 1 38 VAL H . . 5.600 3.786 3.697 3.857 . 0 0 "[ . 1 . 2]" 2 980 1 37 TRP HB3 1 46 LYS QG . . 7.000 3.933 3.171 4.563 . 0 0 "[ . 1 . 2]" 2 981 1 37 TRP HB3 1 46 LYS HD2 . . 3.900 3.023 2.789 3.280 . 0 0 "[ . 1 . 2]" 2 982 1 37 TRP HB3 1 46 LYS HD3 . . 5.600 4.424 3.632 4.775 . 0 0 "[ . 1 . 2]" 2 983 1 37 TRP HB3 1 46 LYS HE3 . . 5.800 4.831 4.419 5.085 . 0 0 "[ . 1 . 2]" 2 984 1 37 TRP HD1 1 38 VAL H . . 3.400 3.257 3.028 3.429 0.029 12 0 "[ . 1 . 2]" 2 985 1 37 TRP HE3 1 38 VAL H . . 4.100 4.117 4.009 4.165 0.065 17 0 "[ . 1 . 2]" 2 986 1 37 TRP HE3 1 46 LYS HA . . 5.800 4.234 3.732 4.530 . 0 0 "[ . 1 . 2]" 2 987 1 37 TRP HE3 1 46 LYS QB . . 4.400 2.809 2.034 4.072 . 0 0 "[ . 1 . 2]" 2 988 1 37 TRP HE3 1 46 LYS QG . . 4.600 3.040 1.957 3.925 . 0 0 "[ . 1 . 2]" 2 989 1 37 TRP HE3 1 46 LYS HD2 . . 5.800 2.887 2.279 3.336 . 0 0 "[ . 1 . 2]" 2 990 1 37 TRP HH2 1 37 TRP HZ3 . . 2.500 2.482 2.472 2.486 . 0 0 "[ . 1 . 2]" 2 991 1 37 TRP HZ3 1 46 LYS QG . . 5.500 3.830 2.275 4.747 . 0 0 "[ . 1 . 2]" 2 992 1 38 VAL H 1 38 VAL HB . . 3.600 3.107 2.518 3.687 0.087 20 0 "[ . 1 . 2]" 2 993 1 40 PRO HB2 1 40 PRO HG3 . . 3.100 2.708 2.688 2.722 . 0 0 "[ . 1 . 2]" 2 994 1 40 PRO HB3 1 40 PRO HG3 . . 2.500 2.380 2.296 2.417 . 0 0 "[ . 1 . 2]" 2 995 1 45 GLY HA2 1 46 LYS H . . 3.200 2.595 2.068 3.215 0.015 17 0 "[ . 1 . 2]" 2 996 1 45 GLY HA3 1 46 LYS H . . 3.200 2.647 2.126 3.262 0.062 8 0 "[ . 1 . 2]" 2 997 1 46 LYS H 1 46 LYS QB . . 3.600 2.707 2.357 3.307 . 0 0 "[ . 1 . 2]" 2 998 1 46 LYS QB 1 46 LYS HE2 . . 3.800 2.395 2.071 2.966 . 0 0 "[ . 1 . 2]" 2 999 1 46 LYS QB 1 46 LYS HE3 . . 3.900 2.794 2.251 3.322 . 0 0 "[ . 1 . 2]" 2 1000 1 46 LYS QB 1 47 ASP H . . 4.400 3.311 1.981 3.991 . 0 0 "[ . 1 . 2]" 2 1001 1 46 LYS HD2 1 46 LYS HE2 . . 3.100 3.018 2.886 3.065 . 0 0 "[ . 1 . 2]" 2 1002 1 46 LYS HD2 1 46 LYS HE3 . . 2.500 2.359 2.289 2.457 . 0 0 "[ . 1 . 2]" 2 1003 1 46 LYS HD3 1 46 LYS HE2 . . 3.000 2.687 2.507 2.922 . 0 0 "[ . 1 . 2]" 2 1004 1 46 LYS HD3 1 46 LYS HE3 . . 3.000 2.978 2.840 3.028 0.028 8 0 "[ . 1 . 2]" 2 1005 1 47 ASP H 1 47 ASP QB . . 3.800 2.870 2.180 3.388 . 0 0 "[ . 1 . 2]" 2 1006 1 47 ASP H 1 48 GLN H . . 4.100 3.459 2.304 4.220 0.120 19 0 "[ . 1 . 2]" 2 1007 1 49 PHE HA 1 50 GLU H . . 4.200 2.265 2.129 2.557 . 0 0 "[ . 1 . 2]" 2 1008 1 49 PHE HB2 1 50 GLU H . . 4.100 3.595 2.254 4.150 0.050 20 0 "[ . 1 . 2]" 2 1009 1 50 GLU H 1 50 GLU HB2 . . 3.900 2.390 2.248 2.773 . 0 0 "[ . 1 . 2]" 2 1010 1 50 GLU H 1 50 GLU HB3 . . 4.300 3.602 3.518 3.836 . 0 0 "[ . 1 . 2]" 2 1011 1 50 GLU H 1 50 GLU HG2 . . 4.100 3.976 3.692 4.132 0.032 4 0 "[ . 1 . 2]" 2 1012 1 50 GLU HA 1 50 GLU HB3 . . 2.800 2.548 2.459 2.609 . 0 0 "[ . 1 . 2]" 2 1013 1 50 GLU HA 1 50 GLU HG2 . . 4.000 2.527 2.294 3.469 . 0 0 "[ . 1 . 2]" 2 1014 1 50 GLU HA 1 50 GLU HG3 . . 4.300 2.953 2.391 3.243 . 0 0 "[ . 1 . 2]" 2 1015 1 50 GLU HA 1 51 GLU H . . 2.800 2.368 2.264 2.477 . 0 0 "[ . 1 . 2]" 2 1016 1 50 GLU HA 1 51 GLU HA . . 5.100 4.413 4.335 4.462 . 0 0 "[ . 1 . 2]" 2 1017 1 50 GLU HA 1 51 GLU QB . . 6.800 4.069 4.012 4.157 . 0 0 "[ . 1 . 2]" 2 1018 1 50 GLU HB2 1 50 GLU HG3 . . 2.900 2.521 2.410 2.966 0.066 20 0 "[ . 1 . 2]" 2 1019 1 50 GLU HB2 1 51 GLU H . . 4.100 4.092 3.802 4.157 0.057 2 0 "[ . 1 . 2]" 2 1020 1 50 GLU HB3 1 50 GLU HG2 . . 2.600 2.489 2.294 2.585 . 0 0 "[ . 1 . 2]" 2 1021 1 50 GLU HB3 1 51 GLU H . . 3.600 2.948 2.683 3.170 . 0 0 "[ . 1 . 2]" 2 1022 1 51 GLU H 1 51 GLU QB . . 3.700 2.146 2.111 2.190 . 0 0 "[ . 1 . 2]" 2 1023 1 51 GLU H 1 51 GLU HG2 . . 4.000 4.134 4.107 4.161 0.161 18 0 "[ . 1 . 2]" 2 1024 1 51 GLU H 1 51 GLU HG3 . . 4.500 4.447 4.395 4.493 . 0 0 "[ . 1 . 2]" 2 1025 1 51 GLU H 1 52 VAL H . . 4.800 4.575 4.521 4.633 . 0 0 "[ . 1 . 2]" 2 1026 1 51 GLU HA 1 51 GLU HG2 . . 3.600 3.283 3.136 3.367 . 0 0 "[ . 1 . 2]" 2 1027 1 51 GLU HA 1 51 GLU HG3 . . 3.400 2.553 2.450 2.673 . 0 0 "[ . 1 . 2]" 2 1028 1 51 GLU HA 1 52 VAL H . . 2.400 2.235 2.178 2.278 . 0 0 "[ . 1 . 2]" 2 1029 1 51 GLU HA 1 52 VAL HA . . 4.600 4.491 4.441 4.529 . 0 0 "[ . 1 . 2]" 2 1030 1 51 GLU HA 1 52 VAL HB . . 4.500 4.225 4.145 4.287 . 0 0 "[ . 1 . 2]" 2 1031 1 51 GLU HA 1 52 VAL MG2 . . 5.600 3.793 3.663 4.072 . 0 0 "[ . 1 . 2]" 2 1032 1 51 GLU QB 1 52 VAL H . . 5.600 3.715 3.658 3.778 . 0 0 "[ . 1 . 2]" 2 1033 1 51 GLU QB 1 52 VAL HA . . 7.000 4.901 4.857 4.984 . 0 0 "[ . 1 . 2]" 2 1034 1 51 GLU QB 1 53 GLU H . . 5.700 5.051 4.970 5.108 . 0 0 "[ . 1 . 2]" 2 1035 1 51 GLU HG2 1 52 VAL H . . 3.300 3.118 2.927 3.297 . 0 0 "[ . 1 . 2]" 2 1036 1 51 GLU HG2 1 52 VAL HA . . 4.200 4.187 3.997 4.265 0.065 1 0 "[ . 1 . 2]" 2 1037 1 51 GLU HG2 1 53 GLU HA . . 5.600 3.663 3.372 3.952 . 0 0 "[ . 1 . 2]" 2 1038 1 51 GLU HG3 1 52 VAL H . . 3.300 2.636 2.406 2.872 . 0 0 "[ . 1 . 2]" 2 1039 1 51 GLU HG3 1 52 VAL HA . . 5.700 4.881 4.699 5.159 . 0 0 "[ . 1 . 2]" 2 1040 1 51 GLU HG3 1 53 GLU HA . . 4.600 4.582 4.157 4.645 0.045 1 0 "[ . 1 . 2]" 2 1041 1 52 VAL H 1 52 VAL HB . . 3.000 2.246 2.193 2.301 . 0 0 "[ . 1 . 2]" 2 1042 1 52 VAL H 1 52 VAL MG1 . . 4.200 3.584 3.544 3.612 . 0 0 "[ . 1 . 2]" 2 1043 1 52 VAL H 1 52 VAL MG2 . . 3.900 2.856 2.765 3.016 . 0 0 "[ . 1 . 2]" 2 1044 1 52 VAL H 1 53 GLU H . . 4.300 4.128 4.016 4.218 . 0 0 "[ . 1 . 2]" 2 1045 1 52 VAL H 1 54 GLU H . . 5.300 4.752 4.488 5.317 0.017 8 0 "[ . 1 . 2]" 2 1046 1 52 VAL HA 1 52 VAL MG1 . . 3.300 2.549 2.485 2.671 . 0 0 "[ . 1 . 2]" 2 1047 1 52 VAL HA 1 52 VAL MG2 . . 3.600 2.320 2.209 2.367 . 0 0 "[ . 1 . 2]" 2 1048 1 52 VAL HA 1 53 GLU H . . 2.500 2.176 2.104 2.233 . 0 0 "[ . 1 . 2]" 2 1049 1 52 VAL HA 1 53 GLU HA . . 6.000 4.448 4.395 4.490 . 0 0 "[ . 1 . 2]" 2 1050 1 52 VAL HA 1 53 GLU HB2 . . 6.000 5.632 5.570 5.692 . 0 0 "[ . 1 . 2]" 2 1051 1 52 VAL HA 1 53 GLU HG3 . . 5.900 5.088 4.945 5.380 . 0 0 "[ . 1 . 2]" 2 1052 1 52 VAL HA 1 54 GLU HG2 . . 6.000 5.420 3.999 6.071 0.071 6 0 "[ . 1 . 2]" 2 1053 1 52 VAL HB 1 53 GLU H . . 4.600 4.578 4.530 4.622 0.022 16 0 "[ . 1 . 2]" 2 1054 1 52 VAL MG1 1 53 GLU H . . 4.100 3.347 3.195 3.427 . 0 0 "[ . 1 . 2]" 2 1055 1 52 VAL MG1 1 53 GLU HA . . 6.700 4.277 4.099 4.397 . 0 0 "[ . 1 . 2]" 2 1056 1 52 VAL MG1 1 54 GLU H . . 4.800 2.790 2.479 3.169 . 0 0 "[ . 1 . 2]" 2 1057 1 52 VAL MG2 1 53 GLU H . . 5.600 4.096 3.867 4.211 . 0 0 "[ . 1 . 2]" 2 1058 1 52 VAL MG2 1 54 GLU H . . 7.000 5.159 4.888 5.589 . 0 0 "[ . 1 . 2]" 2 1059 1 53 GLU H 1 53 GLU HB2 . . 3.400 3.486 3.467 3.514 0.114 8 0 "[ . 1 . 2]" 2 1060 1 53 GLU H 1 53 GLU HB3 . . 2.900 2.557 2.472 2.638 . 0 0 "[ . 1 . 2]" 2 1061 1 53 GLU H 1 53 GLU HG2 . . 3.800 1.955 1.938 1.981 . 0 0 "[ . 1 . 2]" 2 1062 1 53 GLU H 1 53 GLU HG3 . . 3.600 3.160 2.970 3.368 . 0 0 "[ . 1 . 2]" 2 1063 1 53 GLU H 1 54 GLU H . . 4.000 3.645 3.437 4.006 0.006 8 0 "[ . 1 . 2]" 2 1064 1 53 GLU HA 1 53 GLU HG2 . . 3.800 3.796 3.724 3.821 0.021 17 0 "[ . 1 . 2]" 2 1065 1 53 GLU HA 1 53 GLU HG3 . . 4.400 3.855 3.797 3.878 . 0 0 "[ . 1 . 2]" 2 1066 1 53 GLU HA 1 54 GLU H . . 2.700 2.424 2.162 2.537 . 0 0 "[ . 1 . 2]" 2 1067 1 53 GLU HB2 1 54 GLU H . . 4.200 4.244 4.022 4.296 0.096 12 0 "[ . 1 . 2]" 2 1068 1 53 GLU HB3 1 53 GLU HG2 . . 2.600 2.554 2.476 2.609 0.009 8 0 "[ . 1 . 2]" 2 1069 1 53 GLU HB3 1 54 GLU H . . 4.500 4.525 4.478 4.557 0.057 12 0 "[ . 1 . 2]" 2 1070 1 53 GLU HG2 1 54 GLU H . . 4.800 4.849 4.799 4.892 0.092 19 0 "[ . 1 . 2]" 2 1071 1 53 GLU HG3 1 54 GLU H . . 4.700 4.707 4.476 4.816 0.116 16 0 "[ . 1 . 2]" 2 1072 1 54 GLU H 1 54 GLU HG2 . . 3.500 2.940 2.043 3.582 0.082 17 0 "[ . 1 . 2]" 2 1073 1 54 GLU H 1 54 GLU HG3 . . 4.100 3.133 2.107 3.588 . 0 0 "[ . 1 . 2]" 2 1074 1 54 GLU HA 1 54 GLU HG2 . . 3.900 2.965 2.451 3.821 . 0 0 "[ . 1 . 2]" 2 1075 1 54 GLU HA 1 54 GLU HG3 . . 3.800 3.674 3.335 3.856 0.056 15 0 "[ . 1 . 2]" 2 stop_ save_
Contact the webmaster for help, if required. Thursday, May 2, 2024 8:33:27 AM GMT (wattos1)