NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
398614 | 1tm9 | 6244 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1tm9 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 923 _Distance_constraint_stats_list.Viol_count 958 _Distance_constraint_stats_list.Viol_total 1428.070 _Distance_constraint_stats_list.Viol_max 0.543 _Distance_constraint_stats_list.Viol_rms 0.0188 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0023 _Distance_constraint_stats_list.Viol_average_violations_only 0.0573 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 1 MET 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 2 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 4 ASN 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 5 ASN 0.014 0.014 5 0 "[ . 1 . 2 . ]" 1 6 ILE 1.560 0.164 26 0 "[ . 1 . 2 . ]" 1 7 LYS 0.293 0.084 22 0 "[ . 1 . 2 . ]" 1 8 GLU 0.472 0.064 16 0 "[ . 1 . 2 . ]" 1 9 GLN 3.282 0.251 26 0 "[ . 1 . 2 . ]" 1 10 LEU 0.109 0.073 22 0 "[ . 1 . 2 . ]" 1 11 ILE 0.915 0.318 26 0 "[ . 1 . 2 . ]" 1 12 SER 0.917 0.196 26 0 "[ . 1 . 2 . ]" 1 13 PHE 1.024 0.251 26 0 "[ . 1 . 2 . ]" 1 14 PHE 0.417 0.090 12 0 "[ . 1 . 2 . ]" 1 15 ASN 0.851 0.318 26 0 "[ . 1 . 2 . ]" 1 16 GLN 0.619 0.095 11 0 "[ . 1 . 2 . ]" 1 17 ALA 0.356 0.095 11 0 "[ . 1 . 2 . ]" 1 18 CYS 0.609 0.090 12 0 "[ . 1 . 2 . ]" 1 19 SER 0.853 0.114 25 0 "[ . 1 . 2 . ]" 1 20 THR 0.380 0.087 14 0 "[ . 1 . 2 . ]" 1 21 HIS 0.529 0.265 12 0 "[ . 1 . 2 . ]" 1 22 GLN 0.853 0.265 12 0 "[ . 1 . 2 . ]" 1 23 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 24 ARG 0.177 0.091 7 0 "[ . 1 . 2 . ]" 1 25 LEU 0.579 0.082 15 0 "[ . 1 . 2 . ]" 1 26 ASP 0.217 0.115 4 0 "[ . 1 . 2 . ]" 1 27 PHE 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 28 ILE 0.314 0.077 12 0 "[ . 1 . 2 . ]" 1 29 CYS 0.283 0.075 23 0 "[ . 1 . 2 . ]" 1 30 SER 0.019 0.010 25 0 "[ . 1 . 2 . ]" 1 31 THR 0.009 0.009 16 0 "[ . 1 . 2 . ]" 1 32 ARG 0.283 0.075 23 0 "[ . 1 . 2 . ]" 1 33 GLU 0.647 0.149 23 0 "[ . 1 . 2 . ]" 1 34 SER 1.134 0.149 23 0 "[ . 1 . 2 . ]" 1 35 ASP 0.505 0.078 25 0 "[ . 1 . 2 . ]" 1 36 THR 2.137 0.198 24 0 "[ . 1 . 2 . ]" 1 37 PHE 2.551 0.362 14 0 "[ . 1 . 2 . ]" 1 38 SER 5.775 0.390 23 0 "[ . 1 . 2 . ]" 1 39 SER 1.524 0.156 24 0 "[ . 1 . 2 . ]" 1 40 VAL 1.220 0.276 17 0 "[ . 1 . 2 . ]" 1 41 ASP 4.423 0.413 10 0 "[ . 1 . 2 . ]" 1 42 VAL 0.128 0.058 12 0 "[ . 1 . 2 . ]" 1 43 PRO 4.060 0.209 12 0 "[ . 1 . 2 . ]" 1 44 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 45 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 46 PRO 1.621 0.157 11 0 "[ . 1 . 2 . ]" 1 47 ILE 4.228 0.209 12 0 "[ . 1 . 2 . ]" 1 48 LYS 0.067 0.024 1 0 "[ . 1 . 2 . ]" 1 49 ASN 0.256 0.256 1 0 "[ . 1 . 2 . ]" 1 50 ILE 1.670 0.157 11 0 "[ . 1 . 2 . ]" 1 51 ILE 0.315 0.095 23 0 "[ . 1 . 2 . ]" 1 52 GLU 0.213 0.095 23 0 "[ . 1 . 2 . ]" 1 53 ILE 0.105 0.056 18 0 "[ . 1 . 2 . ]" 1 54 THR 0.514 0.267 19 0 "[ . 1 . 2 . ]" 1 55 LYS 0.742 0.267 19 0 "[ . 1 . 2 . ]" 1 56 ASP 0.181 0.070 19 0 "[ . 1 . 2 . ]" 1 57 GLU 0.072 0.033 22 0 "[ . 1 . 2 . ]" 1 58 ASN 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 59 GLN 0.102 0.035 8 0 "[ . 1 . 2 . ]" 1 60 GLN 0.121 0.035 8 0 "[ . 1 . 2 . ]" 1 61 ILE 1.815 0.222 20 0 "[ . 1 . 2 . ]" 1 62 GLU 0.002 0.002 21 0 "[ . 1 . 2 . ]" 1 63 ILE 1.241 0.543 20 2 "[ . 1 . - + . ]" 1 64 THR 0.218 0.077 20 0 "[ . 1 . 2 . ]" 1 65 LYS 1.689 0.222 20 0 "[ . 1 . 2 . ]" 1 66 ILE 1.144 0.543 20 2 "[ . 1 . - + . ]" 1 67 ALA 0.143 0.060 18 0 "[ . 1 . 2 . ]" 1 68 VAL 0.305 0.077 20 0 "[ . 1 . 2 . ]" 1 69 ASN 0.061 0.038 22 0 "[ . 1 . 2 . ]" 1 70 ASN 0.191 0.060 18 0 "[ . 1 . 2 . ]" 1 71 ILE 0.213 0.032 1 0 "[ . 1 . 2 . ]" 1 72 LYS 0.249 0.037 9 0 "[ . 1 . 2 . ]" 1 73 THR 0.376 0.091 9 0 "[ . 1 . 2 . ]" 1 74 LEU 0.275 0.091 9 0 "[ . 1 . 2 . ]" 1 75 SER 0.236 0.105 10 0 "[ . 1 . 2 . ]" 1 76 SER 0.199 0.105 10 0 "[ . 1 . 2 . ]" 1 77 VAL 0.160 0.061 8 0 "[ . 1 . 2 . ]" 1 78 GLY 0.076 0.061 8 0 "[ . 1 . 2 . ]" 1 79 ALA 0.572 0.498 24 0 "[ . 1 . 2 . ]" 1 80 THR 0.572 0.498 24 0 "[ . 1 . 2 . ]" 1 81 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 82 GLN 1.387 0.283 13 0 "[ . 1 . 2 . ]" 1 83 TYR 0.120 0.031 2 0 "[ . 1 . 2 . ]" 1 84 MET 0.023 0.017 26 0 "[ . 1 . 2 . ]" 1 85 ALA 0.380 0.174 21 0 "[ . 1 . 2 . ]" 1 86 SER 0.091 0.031 2 0 "[ . 1 . 2 . ]" 1 87 PHE 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 88 PHE 3.511 0.364 7 0 "[ . 1 . 2 . ]" 1 89 SER 0.663 0.146 18 0 "[ . 1 . 2 . ]" 1 90 THR 0.767 0.146 18 0 "[ . 1 . 2 . ]" 1 91 ASN 3.032 0.147 20 0 "[ . 1 . 2 . ]" 1 92 SER 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 93 GLU 1.658 0.076 7 0 "[ . 1 . 2 . ]" 1 94 PRO 0.029 0.029 8 0 "[ . 1 . 2 . ]" 1 95 ALA 3.417 0.147 20 0 "[ . 1 . 2 . ]" 1 96 ILE 0.074 0.025 20 0 "[ . 1 . 2 . ]" 1 97 ILE 1.439 0.076 7 0 "[ . 1 . 2 . ]" 1 98 PHE 0.029 0.029 8 0 "[ . 1 . 2 . ]" 1 99 CYS 0.266 0.052 7 0 "[ . 1 . 2 . ]" 1 100 VAL 0.082 0.025 20 0 "[ . 1 . 2 . ]" 1 101 ILE 0.195 0.066 13 0 "[ . 1 . 2 . ]" 1 102 TYR 0.164 0.068 23 0 "[ . 1 . 2 . ]" 1 103 PHE 0.245 0.048 13 0 "[ . 1 . 2 . ]" 1 104 LEU 0.031 0.023 7 0 "[ . 1 . 2 . ]" 1 105 TYR 0.654 0.148 13 0 "[ . 1 . 2 . ]" 1 106 HIS 0.130 0.068 23 0 "[ . 1 . 2 . ]" 1 107 PHE 0.130 0.048 13 0 "[ . 1 . 2 . ]" 1 108 GLY 1.766 0.148 5 0 "[ . 1 . 2 . ]" 1 109 PHE 2.020 0.248 11 0 "[ . 1 . 2 . ]" 1 110 LEU 0.153 0.055 19 0 "[ . 1 . 2 . ]" 1 111 LYS 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 112 ASP 0.044 0.044 24 0 "[ . 1 . 2 . ]" 1 113 ASN 0.044 0.044 24 0 "[ . 1 . 2 . ]" 1 114 ASN 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 115 LYS 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 116 LYS 0.284 0.284 25 0 "[ . 1 . 2 . ]" 1 117 GLN 0.812 0.284 25 0 "[ . 1 . 2 . ]" 1 118 ILE 0.458 0.158 18 0 "[ . 1 . 2 . ]" 1 119 ILE 0.557 0.164 18 0 "[ . 1 . 2 . ]" 1 120 LYS 0.118 0.070 18 0 "[ . 1 . 2 . ]" 1 121 LYS 0.526 0.143 18 0 "[ . 1 . 2 . ]" 1 122 ALA 0.809 0.164 18 0 "[ . 1 . 2 . ]" 1 123 TYR 0.017 0.016 11 0 "[ . 1 . 2 . ]" 1 124 GLU 0.547 0.070 18 0 "[ . 1 . 2 . ]" 1 125 THR 0.265 0.046 18 0 "[ . 1 . 2 . ]" 1 126 ILE 0.260 0.055 18 0 "[ . 1 . 2 . ]" 1 127 ALA 0.423 0.052 20 0 "[ . 1 . 2 . ]" 1 128 ASP 0.022 0.022 7 0 "[ . 1 . 2 . ]" 1 129 ASN 0.243 0.034 18 0 "[ . 1 . 2 . ]" 1 130 ILE 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 131 ALA 0.613 0.116 13 0 "[ . 1 . 2 . ]" 1 132 ASP 0.613 0.116 13 0 "[ . 1 . 2 . ]" 1 133 TYR 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 134 LEU 0.022 0.011 25 0 "[ . 1 . 2 . ]" 1 135 ASN 0.123 0.030 12 0 "[ . 1 . 2 . ]" 1 136 GLU 0.175 0.073 25 0 "[ . 1 . 2 . ]" 1 137 ASN 0.099 0.073 25 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 QB 1 2 GLU H . . 4.180 2.852 1.900 3.949 . 0 0 "[ . 1 . 2 . ]" 1 2 1 4 ASN HA 1 7 LYS QB . . 5.880 5.081 3.976 5.354 . 0 0 "[ . 1 . 2 . ]" 1 3 1 4 ASN QB 1 5 ASN H . . 3.780 2.557 1.819 3.257 . 0 0 "[ . 1 . 2 . ]" 1 4 1 5 ASN HA 1 8 GLU QB . . 4.180 3.172 2.170 3.918 . 0 0 "[ . 1 . 2 . ]" 1 5 1 5 ASN HA 1 9 GLN QB . . 5.880 5.087 4.745 5.190 . 0 0 "[ . 1 . 2 . ]" 1 6 1 5 ASN O 1 9 GLN H . . 2.300 1.739 1.533 2.314 0.014 5 0 "[ . 1 . 2 . ]" 1 7 1 5 ASN O 1 9 GLN N . . 3.300 2.669 2.493 3.261 . 0 0 "[ . 1 . 2 . ]" 1 8 1 6 ILE H 1 6 ILE HB . . 2.900 2.365 2.194 2.510 . 0 0 "[ . 1 . 2 . ]" 1 9 1 6 ILE H 1 6 ILE MD . . 5.000 3.173 1.749 4.033 . 0 0 "[ . 1 . 2 . ]" 1 10 1 6 ILE H 1 6 ILE QG . . 3.300 2.274 1.938 3.247 . 0 0 "[ . 1 . 2 . ]" 1 11 1 6 ILE HA 1 6 ILE MD . . 3.300 2.137 1.947 2.615 . 0 0 "[ . 1 . 2 . ]" 1 12 1 6 ILE HA 1 6 ILE MG . . 3.300 2.494 2.331 2.648 . 0 0 "[ . 1 . 2 . ]" 1 13 1 6 ILE HA 1 9 GLN H . . 3.300 3.344 3.164 3.464 0.164 26 0 "[ . 1 . 2 . ]" 1 14 1 6 ILE HA 1 9 GLN HB2 . . 5.000 2.773 2.157 4.952 . 0 0 "[ . 1 . 2 . ]" 1 15 1 6 ILE HA 1 9 GLN HB3 . . 5.000 3.912 2.707 4.361 . 0 0 "[ . 1 . 2 . ]" 1 16 1 6 ILE MG 1 7 LYS HA . . 5.000 3.121 2.876 3.461 . 0 0 "[ . 1 . 2 . ]" 1 17 1 6 ILE MG 1 7 LYS QB . . 5.880 3.788 3.409 4.056 . 0 0 "[ . 1 . 2 . ]" 1 18 1 6 ILE O 1 10 LEU H . . 2.300 2.028 1.592 2.373 0.073 22 0 "[ . 1 . 2 . ]" 1 19 1 6 ILE O 1 10 LEU N . . 3.300 2.905 2.505 3.138 . 0 0 "[ . 1 . 2 . ]" 1 20 1 7 LYS H 1 7 LYS HA . . 2.900 2.683 2.614 2.788 . 0 0 "[ . 1 . 2 . ]" 1 21 1 7 LYS H 1 7 LYS QB . . 3.500 2.094 1.989 2.234 . 0 0 "[ . 1 . 2 . ]" 1 22 1 7 LYS H 1 8 GLU H . . 3.300 3.007 2.681 3.336 0.036 18 0 "[ . 1 . 2 . ]" 1 23 1 7 LYS HA 1 7 LYS QG . . 3.710 2.316 1.910 2.788 . 0 0 "[ . 1 . 2 . ]" 1 24 1 7 LYS HA 1 10 LEU QB . . 5.000 3.120 2.505 3.623 . 0 0 "[ . 1 . 2 . ]" 1 25 1 7 LYS HA 1 10 LEU MD1 . . 3.300 2.384 2.014 2.672 . 0 0 "[ . 1 . 2 . ]" 1 26 1 7 LYS HA 1 10 LEU MD2 . . 5.000 3.885 3.471 4.303 . 0 0 "[ . 1 . 2 . ]" 1 27 1 7 LYS HA 1 97 ILE MD . . 5.000 3.465 2.715 4.189 . 0 0 "[ . 1 . 2 . ]" 1 28 1 7 LYS QB 1 8 GLU H . . 4.180 2.619 2.220 3.044 . 0 0 "[ . 1 . 2 . ]" 1 29 1 7 LYS QD 1 97 ILE MD . . 3.300 1.887 1.636 2.023 . 0 0 "[ . 1 . 2 . ]" 1 30 1 7 LYS QE 1 97 ILE MD . . 3.300 1.929 1.708 2.355 . 0 0 "[ . 1 . 2 . ]" 1 31 1 7 LYS HE2 1 11 ILE MD . . 3.300 2.335 1.865 2.790 . 0 0 "[ . 1 . 2 . ]" 1 32 1 7 LYS HE3 1 11 ILE MD . . 3.300 2.175 1.807 2.666 . 0 0 "[ . 1 . 2 . ]" 1 33 1 7 LYS QG 1 97 ILE MD . . 4.180 2.644 1.953 3.288 . 0 0 "[ . 1 . 2 . ]" 1 34 1 7 LYS O 1 11 ILE H . . 2.300 2.184 1.746 2.384 0.084 22 0 "[ . 1 . 2 . ]" 1 35 1 7 LYS O 1 11 ILE N . . 3.300 3.114 2.711 3.306 0.006 22 0 "[ . 1 . 2 . ]" 1 36 1 8 GLU H 1 9 GLN H . . 5.000 2.803 2.568 2.951 . 0 0 "[ . 1 . 2 . ]" 1 37 1 8 GLU HA 1 11 ILE HB . . 3.300 2.704 2.312 3.209 . 0 0 "[ . 1 . 2 . ]" 1 38 1 8 GLU HA 1 11 ILE MD . . 3.300 2.358 1.966 2.634 . 0 0 "[ . 1 . 2 . ]" 1 39 1 8 GLU O 1 12 SER H . . 2.300 2.134 1.582 2.364 0.064 16 0 "[ . 1 . 2 . ]" 1 40 1 8 GLU O 1 12 SER N . . 3.300 3.079 2.533 3.344 0.044 16 0 "[ . 1 . 2 . ]" 1 41 1 9 GLN H 1 9 GLN HG2 . . 2.900 2.862 2.501 3.075 0.175 22 0 "[ . 1 . 2 . ]" 1 42 1 9 GLN H 1 9 GLN HG3 . . 2.900 2.892 2.675 3.006 0.106 9 0 "[ . 1 . 2 . ]" 1 43 1 9 GLN H 1 10 LEU H . . 3.300 2.781 2.512 2.932 . 0 0 "[ . 1 . 2 . ]" 1 44 1 9 GLN HA 1 9 GLN QG . . 3.720 2.325 2.089 3.355 . 0 0 "[ . 1 . 2 . ]" 1 45 1 9 GLN HA 1 12 SER H . . 5.000 3.751 3.404 4.145 . 0 0 "[ . 1 . 2 . ]" 1 46 1 9 GLN QB 1 10 LEU MD2 . . 5.880 2.909 2.560 3.706 . 0 0 "[ . 1 . 2 . ]" 1 47 1 9 GLN O 1 13 PHE H . . 2.300 2.268 1.958 2.551 0.251 26 0 "[ . 1 . 2 . ]" 1 48 1 9 GLN O 1 13 PHE N . . 3.300 3.235 2.922 3.439 0.139 26 0 "[ . 1 . 2 . ]" 1 49 1 10 LEU H 1 10 LEU MD2 . . 3.300 2.537 2.190 2.674 . 0 0 "[ . 1 . 2 . ]" 1 50 1 10 LEU H 1 10 LEU HG . . 5.000 2.036 1.888 2.401 . 0 0 "[ . 1 . 2 . ]" 1 51 1 10 LEU HA 1 10 LEU MD2 . . 3.300 2.078 1.926 2.249 . 0 0 "[ . 1 . 2 . ]" 1 52 1 10 LEU HA 1 13 PHE HB2 . . 5.000 2.935 2.377 4.877 . 0 0 "[ . 1 . 2 . ]" 1 53 1 10 LEU HA 1 13 PHE HB3 . . 5.000 4.275 3.441 4.969 . 0 0 "[ . 1 . 2 . ]" 1 54 1 10 LEU QB 1 11 ILE H . . 5.880 2.439 1.979 2.694 . 0 0 "[ . 1 . 2 . ]" 1 55 1 10 LEU HB2 1 10 LEU MD1 . . 3.300 2.426 2.299 2.527 . 0 0 "[ . 1 . 2 . ]" 1 56 1 10 LEU HB3 1 10 LEU MD1 . . 3.300 2.261 2.184 2.394 . 0 0 "[ . 1 . 2 . ]" 1 57 1 10 LEU MD2 1 53 ILE HB . . 5.000 3.736 3.098 4.153 . 0 0 "[ . 1 . 2 . ]" 1 58 1 10 LEU MD2 1 53 ILE MD . . 2.900 1.792 1.706 1.911 . 0 0 "[ . 1 . 2 . ]" 1 59 1 10 LEU MD2 1 53 ILE QG . . 5.000 3.039 1.983 3.584 . 0 0 "[ . 1 . 2 . ]" 1 60 1 11 ILE H 1 11 ILE HB . . 2.900 2.166 2.084 2.384 . 0 0 "[ . 1 . 2 . ]" 1 61 1 11 ILE H 1 11 ILE MD . . 2.900 2.151 1.932 2.361 . 0 0 "[ . 1 . 2 . ]" 1 62 1 11 ILE H 1 12 SER H . . 3.300 3.047 2.839 3.302 0.002 3 0 "[ . 1 . 2 . ]" 1 63 1 11 ILE HB 1 11 ILE MD . . 3.300 2.055 1.910 2.221 . 0 0 "[ . 1 . 2 . ]" 1 64 1 11 ILE HB 1 12 SER H . . 3.300 2.597 2.446 2.833 . 0 0 "[ . 1 . 2 . ]" 1 65 1 11 ILE MD 1 93 GLU HA . . 5.000 3.201 2.562 3.693 . 0 0 "[ . 1 . 2 . ]" 1 66 1 11 ILE MD 1 93 GLU QB . . 5.880 4.087 3.752 4.346 . 0 0 "[ . 1 . 2 . ]" 1 67 1 11 ILE MG 1 12 SER H . . 3.300 2.400 2.059 2.704 . 0 0 "[ . 1 . 2 . ]" 1 68 1 11 ILE MG 1 12 SER HA . . 5.000 2.848 2.747 3.022 . 0 0 "[ . 1 . 2 . ]" 1 69 1 11 ILE O 1 15 ASN H . . 2.300 1.713 1.483 2.618 0.318 26 0 "[ . 1 . 2 . ]" 1 70 1 11 ILE O 1 15 ASN N . . 3.300 2.620 2.439 3.431 0.131 26 0 "[ . 1 . 2 . ]" 1 71 1 12 SER H 1 12 SER HA . . 2.900 2.635 2.577 2.723 . 0 0 "[ . 1 . 2 . ]" 1 72 1 12 SER H 1 12 SER QB . . 3.500 2.163 2.019 2.713 . 0 0 "[ . 1 . 2 . ]" 1 73 1 12 SER H 1 13 PHE H . . 5.000 3.165 2.992 3.377 . 0 0 "[ . 1 . 2 . ]" 1 74 1 12 SER HA 1 15 ASN H . . 5.000 3.933 3.454 5.196 0.196 26 0 "[ . 1 . 2 . ]" 1 75 1 12 SER HA 1 15 ASN HB2 . . 5.000 3.074 2.215 4.835 . 0 0 "[ . 1 . 2 . ]" 1 76 1 12 SER HA 1 15 ASN HB3 . . 5.000 2.858 2.176 3.484 . 0 0 "[ . 1 . 2 . ]" 1 77 1 12 SER O 1 16 GLN H . . 2.300 2.096 1.676 2.381 0.081 19 0 "[ . 1 . 2 . ]" 1 78 1 12 SER O 1 16 GLN N . . 3.300 2.897 2.477 3.217 . 0 0 "[ . 1 . 2 . ]" 1 79 1 13 PHE H 1 13 PHE QD . . 3.300 2.712 2.142 3.328 0.028 22 0 "[ . 1 . 2 . ]" 1 80 1 13 PHE H 1 14 PHE H . . 5.000 3.412 3.022 4.625 . 0 0 "[ . 1 . 2 . ]" 1 81 1 14 PHE H 1 50 ILE MD . . 5.000 3.682 3.177 3.953 . 0 0 "[ . 1 . 2 . ]" 1 82 1 14 PHE H 1 50 ILE MG . . 2.900 2.268 1.951 2.598 . 0 0 "[ . 1 . 2 . ]" 1 83 1 14 PHE H 1 100 VAL MG2 . . 5.000 4.172 3.931 4.349 . 0 0 "[ . 1 . 2 . ]" 1 84 1 14 PHE HA 1 17 ALA H . . 5.000 3.875 3.042 4.552 . 0 0 "[ . 1 . 2 . ]" 1 85 1 14 PHE HA 1 17 ALA MB . . 3.300 2.494 2.088 2.675 . 0 0 "[ . 1 . 2 . ]" 1 86 1 14 PHE HA 1 100 VAL MG2 . . 5.000 4.221 4.047 4.296 . 0 0 "[ . 1 . 2 . ]" 1 87 1 14 PHE QB 1 50 ILE MD . . 5.000 2.496 1.895 3.499 . 0 0 "[ . 1 . 2 . ]" 1 88 1 14 PHE QB 1 100 VAL MG2 . . 4.180 2.496 1.874 3.047 . 0 0 "[ . 1 . 2 . ]" 1 89 1 14 PHE QD 1 100 VAL MG2 . . 5.000 2.689 1.964 3.621 . 0 0 "[ . 1 . 2 . ]" 1 90 1 14 PHE O 1 18 CYS H . . 2.300 2.289 2.129 2.390 0.090 12 0 "[ . 1 . 2 . ]" 1 91 1 14 PHE O 1 18 CYS N . . 3.300 3.108 2.841 3.299 . 0 0 "[ . 1 . 2 . ]" 1 92 1 15 ASN H 1 16 GLN H . . 5.000 2.724 2.316 3.022 . 0 0 "[ . 1 . 2 . ]" 1 93 1 15 ASN HA 1 18 CYS H . . 5.000 4.183 3.862 4.502 . 0 0 "[ . 1 . 2 . ]" 1 94 1 16 GLN H 1 16 GLN HA . . 2.900 2.847 2.811 2.880 . 0 0 "[ . 1 . 2 . ]" 1 95 1 16 GLN H 1 16 GLN QB . . 3.500 2.395 2.229 2.650 . 0 0 "[ . 1 . 2 . ]" 1 96 1 16 GLN H 1 16 GLN HG2 . . 3.300 2.715 2.023 3.195 . 0 0 "[ . 1 . 2 . ]" 1 97 1 16 GLN H 1 16 GLN QG . . 2.980 2.476 1.984 2.756 . 0 0 "[ . 1 . 2 . ]" 1 98 1 16 GLN H 1 16 GLN HG3 . . 3.300 2.922 2.463 3.344 0.044 26 0 "[ . 1 . 2 . ]" 1 99 1 16 GLN H 1 17 ALA H . . 3.300 2.909 2.466 3.395 0.095 11 0 "[ . 1 . 2 . ]" 1 100 1 16 GLN H 1 17 ALA MB . . 5.000 3.957 3.815 4.095 . 0 0 "[ . 1 . 2 . ]" 1 101 1 16 GLN H 1 46 PRO QB . . 5.880 4.281 3.611 5.268 . 0 0 "[ . 1 . 2 . ]" 1 102 1 16 GLN HA 1 16 GLN QG . . 3.720 2.602 2.145 3.346 . 0 0 "[ . 1 . 2 . ]" 1 103 1 17 ALA H 1 18 CYS H . . 2.900 2.633 2.305 2.956 0.056 26 0 "[ . 1 . 2 . ]" 1 104 1 17 ALA HA 1 43 PRO HG2 . . 5.000 2.181 1.976 3.398 . 0 0 "[ . 1 . 2 . ]" 1 105 1 17 ALA HA 1 43 PRO HG3 . . 5.000 3.100 2.774 4.302 . 0 0 "[ . 1 . 2 . ]" 1 106 1 17 ALA HA 1 46 PRO QG . . 4.180 2.268 1.804 2.720 . 0 0 "[ . 1 . 2 . ]" 1 107 1 17 ALA MB 1 43 PRO QB . . 5.880 4.152 3.977 4.376 . 0 0 "[ . 1 . 2 . ]" 1 108 1 17 ALA MB 1 43 PRO HD2 . . 5.000 2.047 1.823 2.274 . 0 0 "[ . 1 . 2 . ]" 1 109 1 17 ALA MB 1 43 PRO HD3 . . 5.000 3.561 3.319 3.786 . 0 0 "[ . 1 . 2 . ]" 1 110 1 17 ALA MB 1 46 PRO HB2 . . 5.000 2.184 1.941 2.662 . 0 0 "[ . 1 . 2 . ]" 1 111 1 17 ALA MB 1 46 PRO QB . . 4.140 2.159 1.912 2.620 . 0 0 "[ . 1 . 2 . ]" 1 112 1 17 ALA MB 1 46 PRO HB3 . . 5.000 3.401 2.871 3.905 . 0 0 "[ . 1 . 2 . ]" 1 113 1 17 ALA MB 1 46 PRO QG . . 4.180 1.908 1.778 2.081 . 0 0 "[ . 1 . 2 . ]" 1 114 1 17 ALA MB 1 47 ILE MD . . 5.000 2.620 2.124 3.392 . 0 0 "[ . 1 . 2 . ]" 1 115 1 17 ALA MB 1 47 ILE QG . . 5.000 2.298 1.912 3.113 . 0 0 "[ . 1 . 2 . ]" 1 116 1 18 CYS H 1 42 VAL HB . . 5.000 4.898 4.515 5.058 0.058 12 0 "[ . 1 . 2 . ]" 1 117 1 18 CYS H 1 42 VAL MG2 . . 3.300 2.693 2.441 2.773 . 0 0 "[ . 1 . 2 . ]" 1 118 1 18 CYS H 1 43 PRO QG . . 5.880 5.053 4.693 5.280 . 0 0 "[ . 1 . 2 . ]" 1 119 1 18 CYS HA 1 19 SER H . . 3.300 2.536 2.221 3.156 . 0 0 "[ . 1 . 2 . ]" 1 120 1 18 CYS HB2 1 19 SER H . . 5.000 3.440 1.936 4.714 . 0 0 "[ . 1 . 2 . ]" 1 121 1 18 CYS HB3 1 19 SER H . . 5.000 3.692 1.936 4.640 . 0 0 "[ . 1 . 2 . ]" 1 122 1 19 SER H 1 19 SER QB . . 3.500 2.573 2.069 3.209 . 0 0 "[ . 1 . 2 . ]" 1 123 1 19 SER H 1 20 THR H . . 2.900 2.539 1.895 2.970 0.070 14 0 "[ . 1 . 2 . ]" 1 124 1 19 SER HA 1 19 SER HB2 . . 2.900 2.829 2.293 3.014 0.114 25 0 "[ . 1 . 2 . ]" 1 125 1 19 SER HA 1 19 SER HB3 . . 2.900 2.738 2.269 2.970 0.070 6 0 "[ . 1 . 2 . ]" 1 126 1 19 SER QB 1 20 THR H . . 4.180 2.578 1.858 3.961 . 0 0 "[ . 1 . 2 . ]" 1 127 1 20 THR H 1 20 THR MG . . 2.900 2.094 1.925 2.387 . 0 0 "[ . 1 . 2 . ]" 1 128 1 20 THR H 1 23 GLU QG . . 5.880 4.142 1.954 5.221 . 0 0 "[ . 1 . 2 . ]" 1 129 1 20 THR HA 1 20 THR MG . . 3.300 2.438 2.227 2.644 . 0 0 "[ . 1 . 2 . ]" 1 130 1 20 THR HA 1 21 HIS H . . 2.900 2.588 2.298 2.987 0.087 14 0 "[ . 1 . 2 . ]" 1 131 1 20 THR HB 1 21 HIS H . . 2.900 2.437 1.901 2.922 0.022 19 0 "[ . 1 . 2 . ]" 1 132 1 20 THR HB 1 22 GLN H . . 5.000 3.544 2.588 5.057 0.057 12 0 "[ . 1 . 2 . ]" 1 133 1 20 THR MG 1 21 HIS H . . 5.000 3.771 3.643 4.016 . 0 0 "[ . 1 . 2 . ]" 1 134 1 21 HIS H 1 21 HIS QB . . 3.670 2.342 2.020 3.102 . 0 0 "[ . 1 . 2 . ]" 1 135 1 21 HIS H 1 22 GLN H . . 3.300 2.514 1.984 3.565 0.265 12 0 "[ . 1 . 2 . ]" 1 136 1 21 HIS HA 1 24 ARG H . . 5.000 4.074 3.065 5.091 0.091 7 0 "[ . 1 . 2 . ]" 1 137 1 21 HIS QB 1 22 GLN H . . 4.180 2.509 1.865 3.167 . 0 0 "[ . 1 . 2 . ]" 1 138 1 21 HIS QB 1 22 GLN QG . . 4.650 3.440 2.982 3.688 . 0 0 "[ . 1 . 2 . ]" 1 139 1 22 GLN H 1 22 GLN HA . . 2.900 2.731 2.608 2.893 . 0 0 "[ . 1 . 2 . ]" 1 140 1 22 GLN H 1 22 GLN QB . . 3.500 2.388 2.154 2.811 . 0 0 "[ . 1 . 2 . ]" 1 141 1 22 GLN H 1 22 GLN QG . . 4.180 2.398 1.929 2.950 . 0 0 "[ . 1 . 2 . ]" 1 142 1 22 GLN H 1 23 GLU H . . 3.300 2.775 2.158 3.129 . 0 0 "[ . 1 . 2 . ]" 1 143 1 22 GLN HA 1 22 GLN QG . . 3.720 2.344 2.062 3.345 . 0 0 "[ . 1 . 2 . ]" 1 144 1 22 GLN HA 1 25 LEU H . . 5.000 3.272 2.844 3.863 . 0 0 "[ . 1 . 2 . ]" 1 145 1 22 GLN HA 1 25 LEU HB2 . . 5.000 3.338 3.038 3.653 . 0 0 "[ . 1 . 2 . ]" 1 146 1 22 GLN HA 1 25 LEU HB3 . . 5.000 4.954 4.720 5.082 0.082 15 0 "[ . 1 . 2 . ]" 1 147 1 22 GLN HA 1 25 LEU MD1 . . 5.000 3.839 3.328 4.111 . 0 0 "[ . 1 . 2 . ]" 1 148 1 22 GLN QB 1 23 GLU H . . 4.180 3.081 2.424 3.685 . 0 0 "[ . 1 . 2 . ]" 1 149 1 22 GLN QG 1 23 GLU H . . 5.880 4.059 1.939 4.593 . 0 0 "[ . 1 . 2 . ]" 1 150 1 22 GLN O 1 26 ASP H . . 2.300 2.042 1.595 2.415 0.115 4 0 "[ . 1 . 2 . ]" 1 151 1 22 GLN O 1 26 ASP N . . 3.300 2.861 2.427 3.284 . 0 0 "[ . 1 . 2 . ]" 1 152 1 23 GLU H 1 23 GLU QB . . 3.680 2.245 2.018 2.564 . 0 0 "[ . 1 . 2 . ]" 1 153 1 23 GLU H 1 23 GLU QG . . 4.180 2.980 1.904 3.900 . 0 0 "[ . 1 . 2 . ]" 1 154 1 23 GLU H 1 24 ARG H . . 3.300 2.908 2.702 3.101 . 0 0 "[ . 1 . 2 . ]" 1 155 1 23 GLU HA 1 23 GLU QG . . 3.720 2.677 2.081 3.437 . 0 0 "[ . 1 . 2 . ]" 1 156 1 23 GLU HA 1 26 ASP H . . 5.000 3.329 3.004 3.777 . 0 0 "[ . 1 . 2 . ]" 1 157 1 23 GLU HA 1 26 ASP HB2 . . 5.000 2.371 1.999 3.044 . 0 0 "[ . 1 . 2 . ]" 1 158 1 23 GLU HA 1 26 ASP QB . . 3.300 2.277 1.981 2.851 . 0 0 "[ . 1 . 2 . ]" 1 159 1 23 GLU HA 1 26 ASP HB3 . . 5.000 3.251 2.498 3.930 . 0 0 "[ . 1 . 2 . ]" 1 160 1 24 ARG HA 1 27 PHE H . . 5.000 3.147 2.932 3.382 . 0 0 "[ . 1 . 2 . ]" 1 161 1 24 ARG HA 1 27 PHE HB2 . . 5.000 2.605 1.985 3.758 . 0 0 "[ . 1 . 2 . ]" 1 162 1 24 ARG HA 1 27 PHE QB . . 4.140 2.294 1.957 2.928 . 0 0 "[ . 1 . 2 . ]" 1 163 1 24 ARG HA 1 27 PHE HB3 . . 5.000 3.207 1.978 4.553 . 0 0 "[ . 1 . 2 . ]" 1 164 1 24 ARG O 1 28 ILE H . . 2.300 2.090 1.783 2.318 0.018 22 0 "[ . 1 . 2 . ]" 1 165 1 24 ARG O 1 28 ILE N . . 3.300 3.010 2.767 3.250 . 0 0 "[ . 1 . 2 . ]" 1 166 1 25 LEU H 1 25 LEU QB . . 3.670 2.452 2.375 2.559 . 0 0 "[ . 1 . 2 . ]" 1 167 1 25 LEU H 1 25 LEU MD1 . . 5.000 3.833 3.670 3.950 . 0 0 "[ . 1 . 2 . ]" 1 168 1 25 LEU H 1 25 LEU MD2 . . 3.300 2.526 2.420 2.704 . 0 0 "[ . 1 . 2 . ]" 1 169 1 25 LEU H 1 26 ASP H . . 5.000 2.648 2.495 2.814 . 0 0 "[ . 1 . 2 . ]" 1 170 1 25 LEU HA 1 25 LEU MD2 . . 2.900 1.925 1.879 2.065 . 0 0 "[ . 1 . 2 . ]" 1 171 1 25 LEU HA 1 28 ILE H . . 5.000 3.792 3.512 4.137 . 0 0 "[ . 1 . 2 . ]" 1 172 1 25 LEU HA 1 28 ILE HB . . 5.000 4.915 4.608 5.077 0.077 12 0 "[ . 1 . 2 . ]" 1 173 1 25 LEU HA 1 28 ILE MD . . 3.300 1.861 1.787 2.014 . 0 0 "[ . 1 . 2 . ]" 1 174 1 25 LEU HB2 1 25 LEU MD1 . . 3.300 2.529 2.419 2.665 . 0 0 "[ . 1 . 2 . ]" 1 175 1 25 LEU HB3 1 25 LEU MD1 . . 3.300 2.206 2.022 2.319 . 0 0 "[ . 1 . 2 . ]" 1 176 1 25 LEU MD1 1 85 ALA HA . . 5.000 3.904 3.695 4.023 . 0 0 "[ . 1 . 2 . ]" 1 177 1 25 LEU MD1 1 85 ALA MB . . 3.300 1.931 1.775 2.096 . 0 0 "[ . 1 . 2 . ]" 1 178 1 25 LEU MD2 1 28 ILE MD . . 3.300 2.085 1.902 2.177 . 0 0 "[ . 1 . 2 . ]" 1 179 1 25 LEU MD2 1 85 ALA MB . . 3.300 1.800 1.754 1.927 . 0 0 "[ . 1 . 2 . ]" 1 180 1 26 ASP H 1 26 ASP HA . . 2.900 2.848 2.810 2.873 . 0 0 "[ . 1 . 2 . ]" 1 181 1 26 ASP HA 1 29 CYS HB2 . . 5.000 3.753 2.932 5.001 0.001 2 0 "[ . 1 . 2 . ]" 1 182 1 26 ASP HA 1 29 CYS HB3 . . 5.000 3.693 2.713 4.503 . 0 0 "[ . 1 . 2 . ]" 1 183 1 26 ASP O 1 30 SER H . . 2.300 1.870 1.537 2.310 0.010 25 0 "[ . 1 . 2 . ]" 1 184 1 26 ASP O 1 30 SER N . . 3.300 2.782 2.476 3.245 . 0 0 "[ . 1 . 2 . ]" 1 185 1 27 PHE H 1 27 PHE QB . . 3.660 2.019 1.884 2.205 . 0 0 "[ . 1 . 2 . ]" 1 186 1 27 PHE HA 1 30 SER H . . 5.000 3.340 2.791 3.892 . 0 0 "[ . 1 . 2 . ]" 1 187 1 27 PHE HA 1 30 SER QB . . 5.000 2.308 1.939 2.882 . 0 0 "[ . 1 . 2 . ]" 1 188 1 28 ILE H 1 28 ILE MD . . 5.000 3.180 2.983 3.520 . 0 0 "[ . 1 . 2 . ]" 1 189 1 28 ILE H 1 28 ILE QG . . 3.300 1.879 1.693 1.938 . 0 0 "[ . 1 . 2 . ]" 1 190 1 28 ILE H 1 28 ILE MG . . 3.300 2.347 2.247 2.602 . 0 0 "[ . 1 . 2 . ]" 1 191 1 28 ILE H 1 29 CYS H . . 3.300 2.916 2.747 3.033 . 0 0 "[ . 1 . 2 . ]" 1 192 1 28 ILE HA 1 28 ILE MG . . 3.300 2.118 2.017 2.185 . 0 0 "[ . 1 . 2 . ]" 1 193 1 28 ILE HA 1 31 THR H . . 5.000 4.235 3.808 4.776 . 0 0 "[ . 1 . 2 . ]" 1 194 1 28 ILE HA 1 31 THR HB . . 3.300 3.102 2.783 3.309 0.009 16 0 "[ . 1 . 2 . ]" 1 195 1 28 ILE HB 1 29 CYS H . . 5.000 3.810 3.568 4.022 . 0 0 "[ . 1 . 2 . ]" 1 196 1 28 ILE MD 1 28 ILE MG . . 3.300 1.856 1.787 2.102 . 0 0 "[ . 1 . 2 . ]" 1 197 1 28 ILE MD 1 29 CYS H . . 5.000 4.117 3.927 4.220 . 0 0 "[ . 1 . 2 . ]" 1 198 1 28 ILE MD 1 130 ILE MD . . 3.300 2.129 1.973 2.284 . 0 0 "[ . 1 . 2 . ]" 1 199 1 28 ILE MD 1 130 ILE MG . . 3.300 1.755 1.655 1.936 . 0 0 "[ . 1 . 2 . ]" 1 200 1 28 ILE MG 1 29 CYS H . . 5.000 4.208 4.139 4.284 . 0 0 "[ . 1 . 2 . ]" 1 201 1 28 ILE MG 1 127 ALA HA . . 3.300 2.222 1.968 2.406 . 0 0 "[ . 1 . 2 . ]" 1 202 1 28 ILE MG 1 127 ALA MB . . 3.300 1.923 1.806 2.070 . 0 0 "[ . 1 . 2 . ]" 1 203 1 29 CYS H 1 30 SER H . . 5.000 2.576 2.257 2.812 . 0 0 "[ . 1 . 2 . ]" 1 204 1 29 CYS HA 1 32 ARG H . . 5.000 3.806 3.287 5.075 0.075 23 0 "[ . 1 . 2 . ]" 1 205 1 29 CYS HA 1 32 ARG HB2 . . 5.000 4.295 3.314 5.068 0.068 8 0 "[ . 1 . 2 . ]" 1 206 1 29 CYS HA 1 32 ARG HB3 . . 5.000 3.904 2.638 4.786 . 0 0 "[ . 1 . 2 . ]" 1 207 1 29 CYS HA 1 131 ALA MB . . 5.000 3.830 3.123 4.179 . 0 0 "[ . 1 . 2 . ]" 1 208 1 29 CYS QB 1 30 SER H . . 4.180 2.233 1.949 3.402 . 0 0 "[ . 1 . 2 . ]" 1 209 1 30 SER H 1 30 SER HA . . 2.900 2.662 2.600 2.743 . 0 0 "[ . 1 . 2 . ]" 1 210 1 30 SER H 1 31 THR H . . 5.000 3.007 2.760 3.159 . 0 0 "[ . 1 . 2 . ]" 1 211 1 30 SER HA 1 33 GLU QB . . 4.180 2.989 2.025 3.902 . 0 0 "[ . 1 . 2 . ]" 1 212 1 30 SER HA 1 33 GLU QG . . 4.180 3.079 1.769 3.810 . 0 0 "[ . 1 . 2 . ]" 1 213 1 31 THR H 1 32 ARG H . . 5.000 3.018 2.638 3.550 . 0 0 "[ . 1 . 2 . ]" 1 214 1 31 THR H 1 40 VAL MG2 . . 5.000 3.819 3.086 4.042 . 0 0 "[ . 1 . 2 . ]" 1 215 1 31 THR HA 1 31 THR MG . . 3.300 2.412 2.200 2.532 . 0 0 "[ . 1 . 2 . ]" 1 216 1 31 THR HA 1 34 SER QB . . 5.000 3.994 2.391 4.441 . 0 0 "[ . 1 . 2 . ]" 1 217 1 31 THR HA 1 40 VAL MG1 . . 5.000 3.663 2.653 4.044 . 0 0 "[ . 1 . 2 . ]" 1 218 1 31 THR HA 1 40 VAL MG2 . . 3.300 2.449 2.034 2.713 . 0 0 "[ . 1 . 2 . ]" 1 219 1 31 THR MG 1 106 HIS H . . 5.000 4.215 4.124 4.415 . 0 0 "[ . 1 . 2 . ]" 1 220 1 31 THR MG 1 106 HIS QB . . 5.880 1.865 1.696 2.286 . 0 0 "[ . 1 . 2 . ]" 1 221 1 31 THR MG 1 107 PHE QD . . 5.000 2.716 1.869 3.754 . 0 0 "[ . 1 . 2 . ]" 1 222 1 31 THR MG 1 107 PHE QE . . 5.000 2.396 1.890 3.363 . 0 0 "[ . 1 . 2 . ]" 1 223 1 32 ARG H 1 32 ARG QD . . 5.880 4.541 3.875 5.147 . 0 0 "[ . 1 . 2 . ]" 1 224 1 32 ARG H 1 33 GLU H . . 5.000 2.577 1.851 3.345 . 0 0 "[ . 1 . 2 . ]" 1 225 1 33 GLU H 1 33 GLU HA . . 2.900 2.837 2.783 2.918 0.018 25 0 "[ . 1 . 2 . ]" 1 226 1 33 GLU H 1 34 SER H . . 2.900 2.539 1.870 2.951 0.051 20 0 "[ . 1 . 2 . ]" 1 227 1 33 GLU HA 1 34 SER H . . 2.900 2.771 2.429 3.049 0.149 23 0 "[ . 1 . 2 . ]" 1 228 1 34 SER H 1 34 SER QB . . 3.500 2.775 2.291 3.261 . 0 0 "[ . 1 . 2 . ]" 1 229 1 34 SER H 1 35 ASP H . . 3.300 3.239 2.774 3.378 0.078 25 0 "[ . 1 . 2 . ]" 1 230 1 34 SER QB 1 35 ASP H . . 4.180 2.424 1.877 3.875 . 0 0 "[ . 1 . 2 . ]" 1 231 1 34 SER QB 1 36 THR H . . 4.180 3.435 2.916 3.702 . 0 0 "[ . 1 . 2 . ]" 1 232 1 34 SER QB 1 40 VAL MG2 . . 4.140 2.712 2.066 3.009 . 0 0 "[ . 1 . 2 . ]" 1 233 1 34 SER HB2 1 40 VAL MG2 . . 5.000 3.068 2.134 3.525 . 0 0 "[ . 1 . 2 . ]" 1 234 1 34 SER HB3 1 40 VAL MG2 . . 5.000 3.119 2.560 3.735 . 0 0 "[ . 1 . 2 . ]" 1 235 1 35 ASP H 1 35 ASP QB . . 3.500 2.678 1.984 2.889 . 0 0 "[ . 1 . 2 . ]" 1 236 1 35 ASP H 1 36 THR H . . 2.900 2.401 2.133 2.839 . 0 0 "[ . 1 . 2 . ]" 1 237 1 35 ASP QB 1 36 THR H . . 3.780 2.418 1.930 2.991 . 0 0 "[ . 1 . 2 . ]" 1 238 1 36 THR H 1 36 THR HB . . 2.900 2.816 2.266 3.032 0.132 16 0 "[ . 1 . 2 . ]" 1 239 1 36 THR H 1 36 THR MG . . 3.300 2.382 2.009 2.722 . 0 0 "[ . 1 . 2 . ]" 1 240 1 36 THR HA 1 36 THR HB . . 2.900 2.591 2.486 2.735 . 0 0 "[ . 1 . 2 . ]" 1 241 1 36 THR HA 1 37 PHE H . . 3.300 3.048 2.513 3.498 0.198 24 0 "[ . 1 . 2 . ]" 1 242 1 36 THR HB 1 37 PHE H . . 5.000 3.743 3.437 4.266 . 0 0 "[ . 1 . 2 . ]" 1 243 1 36 THR HB 1 39 SER H . . 5.000 4.858 4.533 5.041 0.041 9 0 "[ . 1 . 2 . ]" 1 244 1 36 THR MG 1 37 PHE H . . 3.300 2.298 1.883 2.776 . 0 0 "[ . 1 . 2 . ]" 1 245 1 36 THR MG 1 38 SER H . . 2.900 1.903 1.733 2.246 . 0 0 "[ . 1 . 2 . ]" 1 246 1 37 PHE H 1 37 PHE HA . . 2.900 2.728 2.204 2.938 0.038 25 0 "[ . 1 . 2 . ]" 1 247 1 37 PHE H 1 37 PHE QB . . 3.660 2.803 2.222 3.473 . 0 0 "[ . 1 . 2 . ]" 1 248 1 37 PHE H 1 37 PHE QD . . 3.300 2.960 1.944 3.478 0.178 13 0 "[ . 1 . 2 . ]" 1 249 1 37 PHE H 1 38 SER H . . 5.000 2.323 1.870 3.445 . 0 0 "[ . 1 . 2 . ]" 1 250 1 37 PHE HA 1 37 PHE QD . . 3.300 2.550 2.132 3.662 0.362 14 0 "[ . 1 . 2 . ]" 1 251 1 37 PHE HA 1 39 SER H . . 5.000 3.533 3.367 3.824 . 0 0 "[ . 1 . 2 . ]" 1 252 1 37 PHE HA 1 40 VAL MG2 . . 3.300 2.318 1.842 2.737 . 0 0 "[ . 1 . 2 . ]" 1 253 1 38 SER H 1 38 SER HA . . 2.900 2.838 2.744 2.918 0.018 4 0 "[ . 1 . 2 . ]" 1 254 1 38 SER H 1 38 SER HB2 . . 2.900 2.803 2.199 3.273 0.373 11 0 "[ . 1 . 2 . ]" 1 255 1 38 SER H 1 38 SER HB3 . . 2.900 2.715 2.200 3.290 0.390 23 0 "[ . 1 . 2 . ]" 1 256 1 38 SER H 1 39 SER H . . 2.900 2.460 1.851 2.700 . 0 0 "[ . 1 . 2 . ]" 1 257 1 38 SER HA 1 39 SER H . . 3.300 3.329 3.028 3.456 0.156 24 0 "[ . 1 . 2 . ]" 1 258 1 38 SER HA 1 44 LEU MD2 . . 3.300 2.397 1.968 2.670 . 0 0 "[ . 1 . 2 . ]" 1 259 1 38 SER QB 1 44 LEU MD1 . . 4.180 2.240 1.758 2.932 . 0 0 "[ . 1 . 2 . ]" 1 260 1 38 SER QB 1 44 LEU MD2 . . 5.880 3.461 2.528 4.111 . 0 0 "[ . 1 . 2 . ]" 1 261 1 39 SER H 1 39 SER HA . . 2.900 2.882 2.811 2.919 0.019 4 0 "[ . 1 . 2 . ]" 1 262 1 39 SER H 1 40 VAL H . . 2.900 2.248 1.873 2.725 . 0 0 "[ . 1 . 2 . ]" 1 263 1 40 VAL H 1 40 VAL HB . . 2.900 2.432 2.285 3.176 0.276 17 0 "[ . 1 . 2 . ]" 1 264 1 40 VAL H 1 40 VAL MG2 . . 2.900 2.165 1.924 2.336 . 0 0 "[ . 1 . 2 . ]" 1 265 1 40 VAL HA 1 40 VAL MG1 . . 3.300 2.428 2.335 2.546 . 0 0 "[ . 1 . 2 . ]" 1 266 1 40 VAL HA 1 40 VAL MG2 . . 2.900 2.299 2.144 2.442 . 0 0 "[ . 1 . 2 . ]" 1 267 1 40 VAL HA 1 41 ASP H . . 3.300 2.643 2.301 3.544 0.244 13 0 "[ . 1 . 2 . ]" 1 268 1 40 VAL HB 1 41 ASP H . . 5.000 3.422 1.909 4.029 . 0 0 "[ . 1 . 2 . ]" 1 269 1 40 VAL MG1 1 41 ASP H . . 2.900 1.932 1.817 2.163 . 0 0 "[ . 1 . 2 . ]" 1 270 1 40 VAL MG2 1 41 ASP H . . 5.000 3.748 3.529 3.984 . 0 0 "[ . 1 . 2 . ]" 1 271 1 41 ASP H 1 41 ASP HB2 . . 2.900 2.571 2.102 3.313 0.413 10 0 "[ . 1 . 2 . ]" 1 272 1 41 ASP H 1 41 ASP HB3 . . 2.900 2.833 2.324 3.304 0.404 14 0 "[ . 1 . 2 . ]" 1 273 1 42 VAL HA 1 42 VAL MG2 . . 3.300 2.184 1.981 2.303 . 0 0 "[ . 1 . 2 . ]" 1 274 1 42 VAL HA 1 43 PRO QD . . 3.590 1.855 1.842 1.873 . 0 0 "[ . 1 . 2 . ]" 1 275 1 42 VAL MG1 1 43 PRO QD . . 5.880 3.546 3.327 3.714 . 0 0 "[ . 1 . 2 . ]" 1 276 1 42 VAL MG1 1 47 ILE MD . . 5.000 2.483 1.926 2.770 . 0 0 "[ . 1 . 2 . ]" 1 277 1 42 VAL MG2 1 43 PRO QD . . 3.300 1.876 1.732 2.124 . 0 0 "[ . 1 . 2 . ]" 1 278 1 42 VAL MG2 1 47 ILE H . . 5.000 3.942 3.834 4.111 . 0 0 "[ . 1 . 2 . ]" 1 279 1 42 VAL MG2 1 47 ILE MD . . 5.000 2.176 1.870 2.812 . 0 0 "[ . 1 . 2 . ]" 1 280 1 43 PRO HA 1 44 LEU H . . 2.900 2.257 2.221 2.345 . 0 0 "[ . 1 . 2 . ]" 1 281 1 43 PRO HA 1 45 GLU H . . 5.000 3.822 3.552 4.112 . 0 0 "[ . 1 . 2 . ]" 1 282 1 43 PRO O 1 47 ILE H . . 2.300 2.404 2.370 2.509 0.209 12 0 "[ . 1 . 2 . ]" 1 283 1 43 PRO O 1 47 ILE N . . 3.300 3.352 3.315 3.472 0.172 12 0 "[ . 1 . 2 . ]" 1 284 1 44 LEU H 1 44 LEU HA . . 2.900 2.879 2.875 2.885 . 0 0 "[ . 1 . 2 . ]" 1 285 1 44 LEU H 1 44 LEU QB . . 3.490 2.484 2.356 2.590 . 0 0 "[ . 1 . 2 . ]" 1 286 1 44 LEU H 1 44 LEU MD1 . . 5.000 3.710 3.525 3.971 . 0 0 "[ . 1 . 2 . ]" 1 287 1 44 LEU H 1 44 LEU MD2 . . 5.000 3.091 2.577 3.718 . 0 0 "[ . 1 . 2 . ]" 1 288 1 44 LEU H 1 44 LEU HG . . 2.900 2.277 2.095 2.556 . 0 0 "[ . 1 . 2 . ]" 1 289 1 44 LEU H 1 45 GLU H . . 5.000 2.338 2.315 2.393 . 0 0 "[ . 1 . 2 . ]" 1 290 1 44 LEU HA 1 44 LEU MD2 . . 2.900 2.063 1.917 2.292 . 0 0 "[ . 1 . 2 . ]" 1 291 1 44 LEU HA 1 47 ILE H . . 5.000 3.287 3.179 3.373 . 0 0 "[ . 1 . 2 . ]" 1 292 1 44 LEU HA 1 47 ILE HB . . 3.300 1.900 1.804 1.971 . 0 0 "[ . 1 . 2 . ]" 1 293 1 44 LEU HA 1 47 ILE MG . . 5.000 3.167 2.803 3.304 . 0 0 "[ . 1 . 2 . ]" 1 294 1 44 LEU HB2 1 44 LEU MD1 . . 3.300 2.377 2.111 2.624 . 0 0 "[ . 1 . 2 . ]" 1 295 1 44 LEU HB2 1 45 GLU H . . 5.000 3.091 2.741 3.470 . 0 0 "[ . 1 . 2 . ]" 1 296 1 44 LEU HB3 1 44 LEU MD1 . . 3.300 2.308 2.059 2.540 . 0 0 "[ . 1 . 2 . ]" 1 297 1 44 LEU HB3 1 45 GLU H . . 5.000 4.132 3.768 4.400 . 0 0 "[ . 1 . 2 . ]" 1 298 1 44 LEU QD 1 47 ILE HB . . 5.000 2.983 2.722 3.177 . 0 0 "[ . 1 . 2 . ]" 1 299 1 44 LEU MD2 1 47 ILE HB . . 5.000 3.002 2.736 3.206 . 0 0 "[ . 1 . 2 . ]" 1 300 1 44 LEU MD2 1 47 ILE MG . . 5.000 2.970 2.676 3.277 . 0 0 "[ . 1 . 2 . ]" 1 301 1 44 LEU MD2 1 48 LYS QD . . 5.880 3.886 3.395 4.143 . 0 0 "[ . 1 . 2 . ]" 1 302 1 45 GLU H 1 45 GLU HA . . 2.900 2.687 2.613 2.771 . 0 0 "[ . 1 . 2 . ]" 1 303 1 45 GLU H 1 45 GLU QB . . 3.500 2.038 2.001 2.092 . 0 0 "[ . 1 . 2 . ]" 1 304 1 45 GLU H 1 46 PRO QD . . 3.780 2.314 2.133 2.473 . 0 0 "[ . 1 . 2 . ]" 1 305 1 45 GLU H 1 46 PRO QG . . 5.880 4.284 4.094 4.448 . 0 0 "[ . 1 . 2 . ]" 1 306 1 45 GLU HA 1 45 GLU QG . . 3.720 2.106 1.940 2.358 . 0 0 "[ . 1 . 2 . ]" 1 307 1 45 GLU HA 1 48 LYS HB2 . . 5.000 3.250 3.090 3.495 . 0 0 "[ . 1 . 2 . ]" 1 308 1 45 GLU HA 1 48 LYS QB . . 4.140 3.191 3.033 3.423 . 0 0 "[ . 1 . 2 . ]" 1 309 1 45 GLU HA 1 48 LYS HB3 . . 5.000 4.661 4.413 4.894 . 0 0 "[ . 1 . 2 . ]" 1 310 1 45 GLU HA 1 48 LYS QD . . 4.180 3.077 2.438 3.921 . 0 0 "[ . 1 . 2 . ]" 1 311 1 45 GLU QB 1 46 PRO QD . . 3.610 1.817 1.773 1.849 . 0 0 "[ . 1 . 2 . ]" 1 312 1 45 GLU HB2 1 46 PRO HD2 . . 5.050 3.065 2.992 3.137 . 0 0 "[ . 1 . 2 . ]" 1 313 1 45 GLU HB2 1 46 PRO HD3 . . 5.050 2.056 1.996 2.130 . 0 0 "[ . 1 . 2 . ]" 1 314 1 45 GLU HB3 1 46 PRO HD2 . . 5.050 3.467 3.399 3.592 . 0 0 "[ . 1 . 2 . ]" 1 315 1 45 GLU HB3 1 46 PRO HD3 . . 5.050 2.076 1.995 2.225 . 0 0 "[ . 1 . 2 . ]" 1 316 1 45 GLU QG 1 46 PRO QD . . 5.020 3.716 3.592 3.770 . 0 0 "[ . 1 . 2 . ]" 1 317 1 45 GLU HG2 1 46 PRO HD2 . . 6.750 5.391 5.116 5.526 . 0 0 "[ . 1 . 2 . ]" 1 318 1 45 GLU HG2 1 46 PRO HD3 . . 6.750 4.369 4.120 4.486 . 0 0 "[ . 1 . 2 . ]" 1 319 1 45 GLU HG3 1 46 PRO HD2 . . 6.750 5.207 5.110 5.380 . 0 0 "[ . 1 . 2 . ]" 1 320 1 45 GLU HG3 1 46 PRO HD3 . . 6.750 4.379 4.065 4.488 . 0 0 "[ . 1 . 2 . ]" 1 321 1 46 PRO HA 1 49 ASN H . . 5.000 3.293 3.164 3.359 . 0 0 "[ . 1 . 2 . ]" 1 322 1 46 PRO HA 1 49 ASN QB . . 5.880 2.638 2.221 3.290 . 0 0 "[ . 1 . 2 . ]" 1 323 1 46 PRO QB 1 49 ASN QB . . 6.750 3.785 3.568 4.032 . 0 0 "[ . 1 . 2 . ]" 1 324 1 46 PRO QD 1 47 ILE H . . 4.180 2.304 2.241 2.361 . 0 0 "[ . 1 . 2 . ]" 1 325 1 46 PRO O 1 50 ILE H . . 2.300 2.358 2.262 2.457 0.157 11 0 "[ . 1 . 2 . ]" 1 326 1 46 PRO O 1 50 ILE N . . 3.300 3.161 3.011 3.263 . 0 0 "[ . 1 . 2 . ]" 1 327 1 47 ILE H 1 47 ILE HB . . 2.900 2.348 2.196 2.432 . 0 0 "[ . 1 . 2 . ]" 1 328 1 47 ILE H 1 47 ILE MD . . 5.000 3.505 3.335 3.865 . 0 0 "[ . 1 . 2 . ]" 1 329 1 47 ILE H 1 47 ILE QG . . 2.900 2.135 1.958 2.477 . 0 0 "[ . 1 . 2 . ]" 1 330 1 47 ILE H 1 48 LYS H . . 3.300 2.877 2.763 3.032 . 0 0 "[ . 1 . 2 . ]" 1 331 1 47 ILE HA 1 47 ILE MD . . 3.300 2.125 1.901 2.286 . 0 0 "[ . 1 . 2 . ]" 1 332 1 47 ILE HA 1 47 ILE MG . . 3.300 2.493 2.406 2.639 . 0 0 "[ . 1 . 2 . ]" 1 333 1 47 ILE HA 1 50 ILE H . . 5.000 2.929 2.843 3.143 . 0 0 "[ . 1 . 2 . ]" 1 334 1 47 ILE HA 1 50 ILE HB . . 5.000 4.626 4.366 4.844 . 0 0 "[ . 1 . 2 . ]" 1 335 1 47 ILE HA 1 50 ILE MD . . 3.300 2.520 2.209 2.702 . 0 0 "[ . 1 . 2 . ]" 1 336 1 47 ILE HB 1 48 LYS H . . 2.900 2.735 2.488 2.924 0.024 1 0 "[ . 1 . 2 . ]" 1 337 1 47 ILE MD 1 50 ILE MD . . 3.300 1.770 1.656 2.007 . 0 0 "[ . 1 . 2 . ]" 1 338 1 47 ILE QG 1 47 ILE MG . . 3.300 2.394 2.232 2.512 . 0 0 "[ . 1 . 2 . ]" 1 339 1 47 ILE MG 1 48 LYS H . . 5.000 3.284 2.810 3.675 . 0 0 "[ . 1 . 2 . ]" 1 340 1 47 ILE MG 1 50 ILE H . . 5.000 4.005 3.919 4.142 . 0 0 "[ . 1 . 2 . ]" 1 341 1 47 ILE MG 1 51 ILE MD . . 3.300 1.858 1.634 2.027 . 0 0 "[ . 1 . 2 . ]" 1 342 1 47 ILE O 1 51 ILE H . . 2.300 2.102 1.623 2.339 0.039 21 0 "[ . 1 . 2 . ]" 1 343 1 47 ILE O 1 51 ILE N . . 3.300 2.702 2.562 2.847 . 0 0 "[ . 1 . 2 . ]" 1 344 1 48 LYS H 1 49 ASN H . . 3.300 2.712 2.580 2.833 . 0 0 "[ . 1 . 2 . ]" 1 345 1 48 LYS H 1 51 ILE HB . . 5.000 4.506 4.273 4.727 . 0 0 "[ . 1 . 2 . ]" 1 346 1 48 LYS HA 1 48 LYS QG . . 3.710 2.082 1.935 2.266 . 0 0 "[ . 1 . 2 . ]" 1 347 1 48 LYS HA 1 51 ILE H . . 5.000 3.331 3.115 3.469 . 0 0 "[ . 1 . 2 . ]" 1 348 1 48 LYS HA 1 51 ILE HB . . 3.300 2.096 1.961 2.267 . 0 0 "[ . 1 . 2 . ]" 1 349 1 48 LYS HA 1 51 ILE MD . . 3.300 2.153 1.954 2.480 . 0 0 "[ . 1 . 2 . ]" 1 350 1 48 LYS HA 1 51 ILE MG . . 5.000 3.255 2.979 3.533 . 0 0 "[ . 1 . 2 . ]" 1 351 1 48 LYS QD 1 51 ILE MD . . 5.880 3.940 3.129 4.307 . 0 0 "[ . 1 . 2 . ]" 1 352 1 48 LYS QG 1 51 ILE MD . . 5.880 2.581 2.134 2.920 . 0 0 "[ . 1 . 2 . ]" 1 353 1 49 ASN H 1 49 ASN HA . . 2.900 2.839 2.809 2.871 . 0 0 "[ . 1 . 2 . ]" 1 354 1 49 ASN H 1 49 ASN HB2 . . 3.300 2.268 2.150 2.456 . 0 0 "[ . 1 . 2 . ]" 1 355 1 49 ASN H 1 49 ASN HB3 . . 3.300 2.845 2.659 3.556 0.256 1 0 "[ . 1 . 2 . ]" 1 356 1 49 ASN H 1 50 ILE H . . 3.300 2.364 2.203 2.491 . 0 0 "[ . 1 . 2 . ]" 1 357 1 49 ASN HA 1 52 GLU H . . 5.000 3.627 3.320 4.093 . 0 0 "[ . 1 . 2 . ]" 1 358 1 49 ASN HB2 1 50 ILE H . . 5.000 3.520 2.669 3.785 . 0 0 "[ . 1 . 2 . ]" 1 359 1 49 ASN HB3 1 50 ILE H . . 5.000 2.749 2.498 3.730 . 0 0 "[ . 1 . 2 . ]" 1 360 1 50 ILE H 1 50 ILE MD . . 5.000 3.683 3.566 3.888 . 0 0 "[ . 1 . 2 . ]" 1 361 1 50 ILE H 1 50 ILE MG . . 3.300 2.114 1.894 2.678 . 0 0 "[ . 1 . 2 . ]" 1 362 1 50 ILE HA 1 53 ILE H . . 5.000 4.266 3.376 5.049 0.049 18 0 "[ . 1 . 2 . ]" 1 363 1 50 ILE HB 1 100 VAL MG1 . . 5.000 3.322 2.748 3.885 . 0 0 "[ . 1 . 2 . ]" 1 364 1 50 ILE MD 1 100 VAL MG1 . . 5.000 2.977 2.347 3.238 . 0 0 "[ . 1 . 2 . ]" 1 365 1 50 ILE MD 1 100 VAL MG2 . . 3.300 1.820 1.657 1.980 . 0 0 "[ . 1 . 2 . ]" 1 366 1 50 ILE MG 1 51 ILE H . . 5.000 3.960 3.599 4.146 . 0 0 "[ . 1 . 2 . ]" 1 367 1 51 ILE H 1 51 ILE HB . . 3.300 2.174 2.051 2.258 . 0 0 "[ . 1 . 2 . ]" 1 368 1 51 ILE H 1 51 ILE MD . . 5.000 3.707 3.216 4.094 . 0 0 "[ . 1 . 2 . ]" 1 369 1 51 ILE H 1 51 ILE QG . . 5.000 2.990 2.359 3.311 . 0 0 "[ . 1 . 2 . ]" 1 370 1 51 ILE H 1 52 GLU H . . 5.000 2.280 2.016 2.807 . 0 0 "[ . 1 . 2 . ]" 1 371 1 51 ILE HA 1 51 ILE MG . . 3.300 2.688 2.538 2.807 . 0 0 "[ . 1 . 2 . ]" 1 372 1 51 ILE HA 1 54 THR MG . . 5.000 3.620 3.063 3.897 . 0 0 "[ . 1 . 2 . ]" 1 373 1 51 ILE HA 1 104 LEU MD2 . . 5.000 2.148 1.781 2.660 . 0 0 "[ . 1 . 2 . ]" 1 374 1 51 ILE HB 1 51 ILE MD . . 3.300 2.268 2.128 2.417 . 0 0 "[ . 1 . 2 . ]" 1 375 1 51 ILE HB 1 52 GLU H . . 3.300 3.219 2.931 3.395 0.095 23 0 "[ . 1 . 2 . ]" 1 376 1 51 ILE MD 1 104 LEU MD2 . . 5.000 3.296 2.938 3.460 . 0 0 "[ . 1 . 2 . ]" 1 377 1 51 ILE MD 1 109 PHE QD . . 5.000 3.182 2.163 3.835 . 0 0 "[ . 1 . 2 . ]" 1 378 1 51 ILE MD 1 109 PHE QE . . 5.000 2.358 1.940 3.077 . 0 0 "[ . 1 . 2 . ]" 1 379 1 51 ILE MD 1 109 PHE HZ . . 5.000 3.117 2.030 4.092 . 0 0 "[ . 1 . 2 . ]" 1 380 1 51 ILE QG 1 51 ILE MG . . 3.300 2.332 2.210 2.406 . 0 0 "[ . 1 . 2 . ]" 1 381 1 51 ILE MG 1 52 GLU H . . 5.000 3.294 3.041 3.551 . 0 0 "[ . 1 . 2 . ]" 1 382 1 51 ILE MG 1 52 GLU QB . . 5.880 3.953 3.453 4.181 . 0 0 "[ . 1 . 2 . ]" 1 383 1 51 ILE MG 1 104 LEU MD2 . . 5.000 3.177 2.624 3.409 . 0 0 "[ . 1 . 2 . ]" 1 384 1 52 GLU H 1 52 GLU QG . . 3.780 2.764 1.878 3.455 . 0 0 "[ . 1 . 2 . ]" 1 385 1 52 GLU H 1 53 ILE H . . 5.000 2.956 2.448 3.376 . 0 0 "[ . 1 . 2 . ]" 1 386 1 52 GLU HA 1 52 GLU QG . . 3.720 2.592 1.962 3.366 . 0 0 "[ . 1 . 2 . ]" 1 387 1 52 GLU HA 1 55 LYS QD . . 4.180 2.844 1.850 3.888 . 0 0 "[ . 1 . 2 . ]" 1 388 1 52 GLU QG 1 53 ILE H . . 5.880 4.103 2.341 4.685 . 0 0 "[ . 1 . 2 . ]" 1 389 1 53 ILE H 1 53 ILE HB . . 2.900 2.631 2.202 2.956 0.056 18 0 "[ . 1 . 2 . ]" 1 390 1 53 ILE H 1 54 THR H . . 3.300 2.173 1.861 2.756 . 0 0 "[ . 1 . 2 . ]" 1 391 1 53 ILE H 1 54 THR MG . . 5.000 3.354 2.862 3.985 . 0 0 "[ . 1 . 2 . ]" 1 392 1 53 ILE HA 1 53 ILE MD . . 3.300 2.520 2.051 2.672 . 0 0 "[ . 1 . 2 . ]" 1 393 1 53 ILE HB 1 53 ILE MD . . 2.900 2.092 1.948 2.240 . 0 0 "[ . 1 . 2 . ]" 1 394 1 53 ILE HB 1 54 THR H . . 5.000 3.965 3.699 4.083 . 0 0 "[ . 1 . 2 . ]" 1 395 1 53 ILE QG 1 54 THR MG . . 5.000 3.501 3.170 3.639 . 0 0 "[ . 1 . 2 . ]" 1 396 1 53 ILE MG 1 54 THR HB . . 5.000 4.027 3.864 4.119 . 0 0 "[ . 1 . 2 . ]" 1 397 1 54 THR H 1 54 THR MG . . 2.900 2.099 1.910 2.358 . 0 0 "[ . 1 . 2 . ]" 1 398 1 54 THR H 1 55 LYS H . . 2.900 2.631 2.125 2.979 0.079 19 0 "[ . 1 . 2 . ]" 1 399 1 54 THR H 1 63 ILE MD . . 5.000 3.818 3.519 4.060 . 0 0 "[ . 1 . 2 . ]" 1 400 1 54 THR HA 1 54 THR HB . . 2.900 2.380 2.359 2.438 . 0 0 "[ . 1 . 2 . ]" 1 401 1 54 THR HA 1 54 THR MG . . 3.300 2.645 2.540 2.736 . 0 0 "[ . 1 . 2 . ]" 1 402 1 54 THR HA 1 55 LYS H . . 3.300 3.100 2.963 3.567 0.267 19 0 "[ . 1 . 2 . ]" 1 403 1 54 THR HA 1 63 ILE MD . . 3.300 2.402 1.907 2.780 . 0 0 "[ . 1 . 2 . ]" 1 404 1 54 THR HB 1 55 LYS H . . 5.000 4.592 2.876 4.701 . 0 0 "[ . 1 . 2 . ]" 1 405 1 54 THR HB 1 63 ILE MD . . 5.000 2.304 1.866 2.944 . 0 0 "[ . 1 . 2 . ]" 1 406 1 54 THR MG 1 55 LYS H . . 5.000 4.062 3.442 4.159 . 0 0 "[ . 1 . 2 . ]" 1 407 1 54 THR MG 1 63 ILE MD . . 3.300 1.728 1.612 1.927 . 0 0 "[ . 1 . 2 . ]" 1 408 1 54 THR MG 1 63 ILE MG . . 5.000 2.988 2.741 3.135 . 0 0 "[ . 1 . 2 . ]" 1 409 1 54 THR MG 1 104 LEU MD1 . . 3.300 1.975 1.745 2.199 . 0 0 "[ . 1 . 2 . ]" 1 410 1 55 LYS H 1 55 LYS HA . . 2.900 2.797 2.236 2.916 0.016 15 0 "[ . 1 . 2 . ]" 1 411 1 55 LYS H 1 55 LYS QB . . 3.500 2.298 1.993 3.176 . 0 0 "[ . 1 . 2 . ]" 1 412 1 55 LYS H 1 55 LYS QD . . 4.180 3.527 2.434 3.830 . 0 0 "[ . 1 . 2 . ]" 1 413 1 55 LYS H 1 55 LYS QG . . 3.780 2.600 1.938 3.566 . 0 0 "[ . 1 . 2 . ]" 1 414 1 55 LYS H 1 56 ASP H . . 2.900 2.794 2.295 2.970 0.070 19 0 "[ . 1 . 2 . ]" 1 415 1 55 LYS QB 1 56 ASP H . . 5.880 3.168 2.195 3.987 . 0 0 "[ . 1 . 2 . ]" 1 416 1 56 ASP H 1 56 ASP QB . . 3.500 2.267 1.986 3.035 . 0 0 "[ . 1 . 2 . ]" 1 417 1 56 ASP HA 1 57 GLU H . . 2.900 2.410 2.254 2.741 . 0 0 "[ . 1 . 2 . ]" 1 418 1 56 ASP QB 1 57 GLU H . . 4.180 2.910 2.078 3.530 . 0 0 "[ . 1 . 2 . ]" 1 419 1 56 ASP QB 1 58 ASN H . . 5.880 2.834 2.155 3.926 . 0 0 "[ . 1 . 2 . ]" 1 420 1 56 ASP QB 1 59 GLN H . . 4.180 2.418 1.968 3.081 . 0 0 "[ . 1 . 2 . ]" 1 421 1 57 GLU H 1 57 GLU HA . . 2.900 2.782 2.659 2.875 . 0 0 "[ . 1 . 2 . ]" 1 422 1 57 GLU H 1 57 GLU QG . . 3.780 2.794 1.922 3.439 . 0 0 "[ . 1 . 2 . ]" 1 423 1 57 GLU HA 1 60 GLN HB2 . . 5.000 3.690 2.527 4.851 . 0 0 "[ . 1 . 2 . ]" 1 424 1 57 GLU HA 1 60 GLN QB . . 4.140 3.057 1.972 3.796 . 0 0 "[ . 1 . 2 . ]" 1 425 1 57 GLU HA 1 60 GLN HB3 . . 5.000 3.974 1.984 4.959 . 0 0 "[ . 1 . 2 . ]" 1 426 1 57 GLU HA 1 60 GLN QG . . 4.180 2.859 1.929 3.602 . 0 0 "[ . 1 . 2 . ]" 1 427 1 57 GLU QG 1 58 ASN H . . 4.180 2.562 1.820 3.896 . 0 0 "[ . 1 . 2 . ]" 1 428 1 57 GLU QG 1 61 ILE MD . . 4.180 2.797 2.079 3.294 . 0 0 "[ . 1 . 2 . ]" 1 429 1 57 GLU O 1 61 ILE H . . 2.300 2.126 1.586 2.333 0.033 22 0 "[ . 1 . 2 . ]" 1 430 1 57 GLU O 1 61 ILE N . . 3.300 3.067 2.558 3.284 . 0 0 "[ . 1 . 2 . ]" 1 431 1 58 ASN H 1 58 ASN HA . . 2.900 2.719 2.579 2.816 . 0 0 "[ . 1 . 2 . ]" 1 432 1 58 ASN H 1 59 GLN H . . 3.300 2.716 2.457 3.076 . 0 0 "[ . 1 . 2 . ]" 1 433 1 58 ASN HA 1 61 ILE HB . . 3.300 2.795 2.306 3.005 . 0 0 "[ . 1 . 2 . ]" 1 434 1 58 ASN HA 1 61 ILE MD . . 3.300 2.306 2.002 2.568 . 0 0 "[ . 1 . 2 . ]" 1 435 1 58 ASN HA 1 61 ILE MG . . 5.000 3.961 3.317 4.133 . 0 0 "[ . 1 . 2 . ]" 1 436 1 59 GLN H 1 60 GLN H . . 2.900 2.737 2.365 2.935 0.035 8 0 "[ . 1 . 2 . ]" 1 437 1 59 GLN HA 1 59 GLN QG . . 3.720 2.325 1.958 2.825 . 0 0 "[ . 1 . 2 . ]" 1 438 1 59 GLN HA 1 63 ILE MD . . 5.000 3.788 3.432 4.040 . 0 0 "[ . 1 . 2 . ]" 1 439 1 59 GLN O 1 63 ILE H . . 2.300 1.708 1.566 1.854 . 0 0 "[ . 1 . 2 . ]" 1 440 1 59 GLN O 1 63 ILE N . . 3.300 2.584 2.474 2.743 . 0 0 "[ . 1 . 2 . ]" 1 441 1 60 GLN H 1 61 ILE H . . 5.000 2.859 2.692 3.001 . 0 0 "[ . 1 . 2 . ]" 1 442 1 60 GLN HA 1 63 ILE HB . . 5.000 2.320 2.081 2.713 . 0 0 "[ . 1 . 2 . ]" 1 443 1 60 GLN HA 1 63 ILE MD . . 3.300 2.276 2.011 2.534 . 0 0 "[ . 1 . 2 . ]" 1 444 1 60 GLN HA 1 110 LEU MD2 . . 3.300 2.408 2.058 2.876 . 0 0 "[ . 1 . 2 . ]" 1 445 1 60 GLN QB 1 61 ILE H . . 4.180 2.979 2.416 3.618 . 0 0 "[ . 1 . 2 . ]" 1 446 1 60 GLN QB 1 63 ILE MD . . 5.880 3.910 3.427 4.265 . 0 0 "[ . 1 . 2 . ]" 1 447 1 60 GLN QB 1 110 LEU MD2 . . 5.880 2.947 2.231 3.716 . 0 0 "[ . 1 . 2 . ]" 1 448 1 60 GLN QG 1 110 LEU MD2 . . 5.880 3.381 2.122 4.427 . 0 0 "[ . 1 . 2 . ]" 1 449 1 60 GLN O 1 64 THR H . . 2.300 1.950 1.530 2.319 0.019 5 0 "[ . 1 . 2 . ]" 1 450 1 60 GLN O 1 64 THR N . . 3.300 2.889 2.497 3.199 . 0 0 "[ . 1 . 2 . ]" 1 451 1 61 ILE H 1 62 GLU H . . 5.000 2.858 2.598 3.125 . 0 0 "[ . 1 . 2 . ]" 1 452 1 61 ILE HA 1 61 ILE QG . . 3.300 2.270 2.113 2.410 . 0 0 "[ . 1 . 2 . ]" 1 453 1 61 ILE HA 1 61 ILE MG . . 3.300 2.541 2.447 2.658 . 0 0 "[ . 1 . 2 . ]" 1 454 1 61 ILE HA 1 63 ILE HB . . 5.000 4.927 4.756 5.071 0.071 20 0 "[ . 1 . 2 . ]" 1 455 1 61 ILE HA 1 64 THR HB . . 3.300 2.679 2.414 3.103 . 0 0 "[ . 1 . 2 . ]" 1 456 1 61 ILE HB 1 61 ILE MD . . 2.900 2.059 1.964 2.270 . 0 0 "[ . 1 . 2 . ]" 1 457 1 61 ILE QG 1 61 ILE MG . . 3.300 2.167 1.958 2.292 . 0 0 "[ . 1 . 2 . ]" 1 458 1 61 ILE MG 1 62 GLU HA . . 5.000 3.064 2.783 3.457 . 0 0 "[ . 1 . 2 . ]" 1 459 1 61 ILE O 1 65 LYS H . . 2.300 2.355 2.267 2.522 0.222 20 0 "[ . 1 . 2 . ]" 1 460 1 61 ILE O 1 65 LYS N . . 3.300 3.280 3.203 3.352 0.052 20 0 "[ . 1 . 2 . ]" 1 461 1 62 GLU HA 1 65 LYS QD . . 4.180 3.202 2.016 3.731 . 0 0 "[ . 1 . 2 . ]" 1 462 1 62 GLU O 1 66 ILE H . . 2.300 1.952 1.649 2.302 0.002 21 0 "[ . 1 . 2 . ]" 1 463 1 62 GLU O 1 66 ILE N . . 3.300 2.853 2.543 3.142 . 0 0 "[ . 1 . 2 . ]" 1 464 1 63 ILE H 1 63 ILE HB . . 2.900 2.186 2.092 2.452 . 0 0 "[ . 1 . 2 . ]" 1 465 1 63 ILE H 1 63 ILE MD . . 5.000 3.496 3.319 3.653 . 0 0 "[ . 1 . 2 . ]" 1 466 1 63 ILE H 1 64 THR H . . 5.000 2.675 2.449 3.192 . 0 0 "[ . 1 . 2 . ]" 1 467 1 63 ILE HA 1 63 ILE MG . . 3.300 2.587 2.468 2.675 . 0 0 "[ . 1 . 2 . ]" 1 468 1 63 ILE HA 1 66 ILE HB . . 3.300 2.109 1.934 3.843 0.543 20 2 "[ . 1 . - + . ]" 1 469 1 63 ILE HA 1 66 ILE MD . . 3.300 2.379 1.903 2.593 . 0 0 "[ . 1 . 2 . ]" 1 470 1 63 ILE HA 1 101 ILE MD . . 5.000 3.325 3.061 3.623 . 0 0 "[ . 1 . 2 . ]" 1 471 1 63 ILE HB 1 63 ILE MD . . 3.300 2.249 2.179 2.324 . 0 0 "[ . 1 . 2 . ]" 1 472 1 63 ILE HB 1 64 THR H . . 3.300 2.701 2.298 2.904 . 0 0 "[ . 1 . 2 . ]" 1 473 1 63 ILE HB 1 110 LEU MD2 . . 3.300 2.513 2.315 2.664 . 0 0 "[ . 1 . 2 . ]" 1 474 1 63 ILE MD 1 101 ILE MD . . 5.000 3.126 2.895 3.396 . 0 0 "[ . 1 . 2 . ]" 1 475 1 63 ILE MD 1 110 LEU MD1 . . 5.000 3.069 2.829 3.190 . 0 0 "[ . 1 . 2 . ]" 1 476 1 63 ILE QG 1 63 ILE MG . . 3.300 2.331 2.248 2.395 . 0 0 "[ . 1 . 2 . ]" 1 477 1 63 ILE QG 1 66 ILE MG . . 5.000 3.491 3.202 3.584 . 0 0 "[ . 1 . 2 . ]" 1 478 1 63 ILE MG 1 64 THR HA . . 5.000 3.190 2.960 3.463 . 0 0 "[ . 1 . 2 . ]" 1 479 1 63 ILE MG 1 67 ALA MB . . 5.000 3.007 2.759 3.167 . 0 0 "[ . 1 . 2 . ]" 1 480 1 63 ILE MG 1 101 ILE MD . . 2.900 1.762 1.649 1.868 . 0 0 "[ . 1 . 2 . ]" 1 481 1 63 ILE MG 1 110 LEU MD1 . . 3.300 1.729 1.661 2.004 . 0 0 "[ . 1 . 2 . ]" 1 482 1 63 ILE O 1 67 ALA H . . 2.300 1.654 1.520 1.819 . 0 0 "[ . 1 . 2 . ]" 1 483 1 63 ILE O 1 67 ALA N . . 3.300 2.592 2.511 2.697 . 0 0 "[ . 1 . 2 . ]" 1 484 1 64 THR H 1 64 THR HA . . 2.900 2.726 2.659 2.792 . 0 0 "[ . 1 . 2 . ]" 1 485 1 64 THR H 1 64 THR HB . . 2.900 2.049 1.964 2.148 . 0 0 "[ . 1 . 2 . ]" 1 486 1 64 THR H 1 65 LYS H . . 5.000 3.042 2.813 3.175 . 0 0 "[ . 1 . 2 . ]" 1 487 1 64 THR HA 1 67 ALA H . . 5.000 3.576 3.389 3.783 . 0 0 "[ . 1 . 2 . ]" 1 488 1 64 THR HA 1 67 ALA MB . . 5.000 2.874 2.672 3.064 . 0 0 "[ . 1 . 2 . ]" 1 489 1 64 THR MG 1 65 LYS H . . 3.300 2.366 1.923 2.621 . 0 0 "[ . 1 . 2 . ]" 1 490 1 64 THR O 1 68 VAL H . . 2.300 2.210 2.009 2.377 0.077 20 0 "[ . 1 . 2 . ]" 1 491 1 64 THR O 1 68 VAL N . . 3.300 3.138 2.945 3.314 0.014 20 0 "[ . 1 . 2 . ]" 1 492 1 65 LYS H 1 65 LYS HA . . 2.900 2.801 2.763 2.884 . 0 0 "[ . 1 . 2 . ]" 1 493 1 65 LYS HA 1 65 LYS QD . . 4.180 3.669 3.446 3.811 . 0 0 "[ . 1 . 2 . ]" 1 494 1 65 LYS HA 1 68 VAL H . . 3.300 3.201 2.925 3.343 0.043 18 0 "[ . 1 . 2 . ]" 1 495 1 65 LYS HA 1 68 VAL MG1 . . 5.000 4.076 3.839 4.189 . 0 0 "[ . 1 . 2 . ]" 1 496 1 65 LYS HA 1 68 VAL MG2 . . 3.300 2.319 2.088 2.580 . 0 0 "[ . 1 . 2 . ]" 1 497 1 66 ILE H 1 67 ALA H . . 5.000 2.787 2.673 2.907 . 0 0 "[ . 1 . 2 . ]" 1 498 1 66 ILE HA 1 69 ASN HB2 . . 3.300 2.606 2.204 3.261 . 0 0 "[ . 1 . 2 . ]" 1 499 1 66 ILE HA 1 69 ASN HB3 . . 3.300 2.997 2.448 3.338 0.038 22 0 "[ . 1 . 2 . ]" 1 500 1 66 ILE HB 1 67 ALA H . . 5.000 3.045 2.795 4.311 . 0 0 "[ . 1 . 2 . ]" 1 501 1 66 ILE HB 1 101 ILE MD . . 5.000 3.944 3.758 4.086 . 0 0 "[ . 1 . 2 . ]" 1 502 1 66 ILE QG 1 66 ILE MG . . 3.300 2.291 2.230 2.394 . 0 0 "[ . 1 . 2 . ]" 1 503 1 67 ALA H 1 67 ALA MB . . 2.900 2.083 1.934 2.192 . 0 0 "[ . 1 . 2 . ]" 1 504 1 67 ALA H 1 68 VAL MG2 . . 5.000 3.966 3.764 4.026 . 0 0 "[ . 1 . 2 . ]" 1 505 1 67 ALA H 1 101 ILE MD . . 5.000 3.739 3.406 3.924 . 0 0 "[ . 1 . 2 . ]" 1 506 1 67 ALA H 1 101 ILE MG . . 5.000 3.924 3.826 4.035 . 0 0 "[ . 1 . 2 . ]" 1 507 1 67 ALA HA 1 70 ASN HB2 . . 5.000 3.744 2.732 5.060 0.060 18 0 "[ . 1 . 2 . ]" 1 508 1 67 ALA HA 1 70 ASN HB3 . . 5.000 4.328 3.400 5.036 0.036 18 0 "[ . 1 . 2 . ]" 1 509 1 67 ALA HA 1 101 ILE MD . . 5.000 3.833 3.439 4.104 . 0 0 "[ . 1 . 2 . ]" 1 510 1 67 ALA HA 1 101 ILE MG . . 5.000 3.051 2.646 3.447 . 0 0 "[ . 1 . 2 . ]" 1 511 1 67 ALA MB 1 68 VAL H . . 3.300 2.572 2.454 2.703 . 0 0 "[ . 1 . 2 . ]" 1 512 1 67 ALA MB 1 68 VAL MG2 . . 5.000 2.874 2.694 3.112 . 0 0 "[ . 1 . 2 . ]" 1 513 1 67 ALA MB 1 101 ILE MD . . 5.000 2.883 2.566 3.201 . 0 0 "[ . 1 . 2 . ]" 1 514 1 67 ALA MB 1 101 ILE MG . . 3.300 1.896 1.790 2.034 . 0 0 "[ . 1 . 2 . ]" 1 515 1 67 ALA MB 1 119 ILE MD . . 5.000 3.112 2.760 3.353 . 0 0 "[ . 1 . 2 . ]" 1 516 1 67 ALA MB 1 119 ILE MG . . 3.300 1.870 1.648 2.074 . 0 0 "[ . 1 . 2 . ]" 1 517 1 67 ALA O 1 71 ILE H . . 2.300 1.879 1.507 2.301 0.001 26 0 "[ . 1 . 2 . ]" 1 518 1 67 ALA O 1 71 ILE N . . 3.300 2.821 2.482 3.215 . 0 0 "[ . 1 . 2 . ]" 1 519 1 68 VAL H 1 68 VAL HA . . 2.900 2.802 2.751 2.827 . 0 0 "[ . 1 . 2 . ]" 1 520 1 68 VAL H 1 68 VAL HB . . 2.900 2.516 2.457 2.604 . 0 0 "[ . 1 . 2 . ]" 1 521 1 68 VAL H 1 68 VAL MG2 . . 2.900 1.997 1.889 2.103 . 0 0 "[ . 1 . 2 . ]" 1 522 1 68 VAL H 1 69 ASN H . . 5.000 2.662 2.529 2.854 . 0 0 "[ . 1 . 2 . ]" 1 523 1 68 VAL HA 1 68 VAL MG1 . . 3.300 2.312 2.207 2.440 . 0 0 "[ . 1 . 2 . ]" 1 524 1 68 VAL HA 1 68 VAL MG2 . . 3.300 2.435 2.345 2.497 . 0 0 "[ . 1 . 2 . ]" 1 525 1 68 VAL HA 1 71 ILE H . . 5.000 2.947 2.578 3.476 . 0 0 "[ . 1 . 2 . ]" 1 526 1 68 VAL HA 1 71 ILE HB . . 5.000 2.084 1.938 2.370 . 0 0 "[ . 1 . 2 . ]" 1 527 1 68 VAL HA 1 71 ILE MG . . 3.300 2.437 1.927 2.655 . 0 0 "[ . 1 . 2 . ]" 1 528 1 68 VAL HA 1 119 ILE MD . . 5.000 3.132 2.536 4.022 . 0 0 "[ . 1 . 2 . ]" 1 529 1 68 VAL MG1 1 69 ASN HA . . 5.000 3.845 3.618 4.026 . 0 0 "[ . 1 . 2 . ]" 1 530 1 68 VAL MG1 1 72 LYS QB . . 4.180 2.559 2.236 2.763 . 0 0 "[ . 1 . 2 . ]" 1 531 1 68 VAL MG1 1 72 LYS QD . . 5.880 3.959 3.504 4.370 . 0 0 "[ . 1 . 2 . ]" 1 532 1 68 VAL MG1 1 72 LYS QG . . 5.880 2.645 1.855 4.137 . 0 0 "[ . 1 . 2 . ]" 1 533 1 68 VAL MG2 1 69 ASN H . . 5.000 3.765 3.594 3.880 . 0 0 "[ . 1 . 2 . ]" 1 534 1 68 VAL MG2 1 71 ILE HB . . 5.000 3.852 3.643 4.059 . 0 0 "[ . 1 . 2 . ]" 1 535 1 68 VAL MG2 1 119 ILE MD . . 2.900 1.737 1.682 1.820 . 0 0 "[ . 1 . 2 . ]" 1 536 1 68 VAL MG2 1 119 ILE QG . . 5.000 2.714 2.021 3.062 . 0 0 "[ . 1 . 2 . ]" 1 537 1 69 ASN H 1 70 ASN H . . 3.300 2.863 2.552 3.173 . 0 0 "[ . 1 . 2 . ]" 1 538 1 69 ASN HA 1 72 LYS H . . 5.000 4.149 3.743 4.549 . 0 0 "[ . 1 . 2 . ]" 1 539 1 69 ASN HA 1 72 LYS QB . . 4.180 3.341 2.992 3.683 . 0 0 "[ . 1 . 2 . ]" 1 540 1 69 ASN HA 1 72 LYS QG . . 5.880 3.979 1.982 5.180 . 0 0 "[ . 1 . 2 . ]" 1 541 1 70 ASN H 1 71 ILE H . . 2.900 2.355 2.138 2.780 . 0 0 "[ . 1 . 2 . ]" 1 542 1 70 ASN HA 1 73 THR HB . . 3.300 2.945 2.581 3.322 0.022 25 0 "[ . 1 . 2 . ]" 1 543 1 71 ILE H 1 71 ILE MD . . 5.000 3.370 2.458 4.095 . 0 0 "[ . 1 . 2 . ]" 1 544 1 71 ILE H 1 72 LYS H . . 5.000 2.863 2.380 3.181 . 0 0 "[ . 1 . 2 . ]" 1 545 1 71 ILE HA 1 71 ILE MD . . 2.900 1.949 1.896 2.035 . 0 0 "[ . 1 . 2 . ]" 1 546 1 71 ILE HA 1 74 LEU HB2 . . 5.000 2.064 1.965 2.784 . 0 0 "[ . 1 . 2 . ]" 1 547 1 71 ILE HA 1 74 LEU HB3 . . 5.000 3.465 2.334 4.421 . 0 0 "[ . 1 . 2 . ]" 1 548 1 71 ILE HA 1 74 LEU MD1 . . 5.000 2.639 2.285 3.178 . 0 0 "[ . 1 . 2 . ]" 1 549 1 71 ILE HB 1 72 LYS H . . 3.300 3.073 2.575 3.332 0.032 1 0 "[ . 1 . 2 . ]" 1 550 1 71 ILE HB 1 72 LYS QG . . 5.880 5.200 4.972 5.288 . 0 0 "[ . 1 . 2 . ]" 1 551 1 71 ILE HB 1 123 TYR QE . . 5.000 3.422 2.228 4.738 . 0 0 "[ . 1 . 2 . ]" 1 552 1 71 ILE MD 1 74 LEU HB2 . . 5.000 2.699 2.084 3.135 . 0 0 "[ . 1 . 2 . ]" 1 553 1 71 ILE MD 1 74 LEU HB3 . . 5.000 3.189 2.391 3.797 . 0 0 "[ . 1 . 2 . ]" 1 554 1 71 ILE MD 1 74 LEU MD1 . . 3.300 1.893 1.757 2.044 . 0 0 "[ . 1 . 2 . ]" 1 555 1 71 ILE MD 1 123 TYR HA . . 5.000 2.645 2.077 3.208 . 0 0 "[ . 1 . 2 . ]" 1 556 1 71 ILE MD 1 123 TYR QE . . 5.000 2.708 1.970 3.585 . 0 0 "[ . 1 . 2 . ]" 1 557 1 71 ILE QG 1 71 ILE MG . . 3.300 2.216 2.147 2.327 . 0 0 "[ . 1 . 2 . ]" 1 558 1 71 ILE MG 1 72 LYS H . . 3.300 2.174 1.904 2.456 . 0 0 "[ . 1 . 2 . ]" 1 559 1 72 LYS H 1 72 LYS HA . . 2.900 2.730 2.676 2.776 . 0 0 "[ . 1 . 2 . ]" 1 560 1 72 LYS H 1 72 LYS QB . . 3.500 2.081 1.988 2.310 . 0 0 "[ . 1 . 2 . ]" 1 561 1 72 LYS H 1 72 LYS QG . . 4.180 2.984 2.303 3.404 . 0 0 "[ . 1 . 2 . ]" 1 562 1 72 LYS H 1 73 THR H . . 3.300 2.828 2.672 2.980 . 0 0 "[ . 1 . 2 . ]" 1 563 1 72 LYS HA 1 75 SER H . . 5.000 3.828 3.660 5.037 0.037 9 0 "[ . 1 . 2 . ]" 1 564 1 73 THR H 1 73 THR HA . . 2.900 2.862 2.789 2.913 0.013 1 0 "[ . 1 . 2 . ]" 1 565 1 73 THR H 1 74 LEU H . . 3.300 2.470 2.236 2.700 . 0 0 "[ . 1 . 2 . ]" 1 566 1 73 THR HA 1 73 THR MG . . 2.900 2.305 2.130 2.383 . 0 0 "[ . 1 . 2 . ]" 1 567 1 73 THR HB 1 74 LEU H . . 2.900 2.856 2.584 2.991 0.091 9 0 "[ . 1 . 2 . ]" 1 568 1 74 LEU HA 1 74 LEU MD2 . . 2.900 2.225 2.036 2.357 . 0 0 "[ . 1 . 2 . ]" 1 569 1 74 LEU HA 1 74 LEU HG . . 3.300 2.563 2.467 2.803 . 0 0 "[ . 1 . 2 . ]" 1 570 1 74 LEU HA 1 77 VAL H . . 5.000 3.816 3.082 4.534 . 0 0 "[ . 1 . 2 . ]" 1 571 1 74 LEU HA 1 77 VAL MG2 . . 3.300 2.122 1.870 2.495 . 0 0 "[ . 1 . 2 . ]" 1 572 1 74 LEU QB 1 126 ILE MD . . 5.880 2.284 1.855 2.786 . 0 0 "[ . 1 . 2 . ]" 1 573 1 74 LEU HB2 1 74 LEU MD1 . . 3.300 2.331 2.169 2.565 . 0 0 "[ . 1 . 2 . ]" 1 574 1 74 LEU HB3 1 74 LEU MD1 . . 3.300 2.385 2.157 2.545 . 0 0 "[ . 1 . 2 . ]" 1 575 1 74 LEU MD1 1 126 ILE MG . . 5.000 2.921 2.599 3.170 . 0 0 "[ . 1 . 2 . ]" 1 576 1 74 LEU MD2 1 77 VAL MG1 . . 5.000 3.229 2.742 3.373 . 0 0 "[ . 1 . 2 . ]" 1 577 1 74 LEU MD2 1 77 VAL MG2 . . 3.300 1.916 1.772 2.140 . 0 0 "[ . 1 . 2 . ]" 1 578 1 74 LEU MD2 1 126 ILE MD . . 5.000 1.860 1.642 2.201 . 0 0 "[ . 1 . 2 . ]" 1 579 1 74 LEU MD2 1 126 ILE MG . . 5.000 2.937 2.781 3.136 . 0 0 "[ . 1 . 2 . ]" 1 580 1 75 SER H 1 75 SER HA . . 2.900 2.848 2.780 2.878 . 0 0 "[ . 1 . 2 . ]" 1 581 1 75 SER HA 1 76 SER H . . 3.300 2.817 2.544 3.405 0.105 10 0 "[ . 1 . 2 . ]" 1 582 1 76 SER H 1 76 SER HA . . 2.900 2.807 2.793 2.898 . 0 0 "[ . 1 . 2 . ]" 1 583 1 76 SER H 1 76 SER QB . . 3.500 2.882 2.188 3.161 . 0 0 "[ . 1 . 2 . ]" 1 584 1 76 SER H 1 77 VAL H . . 3.300 2.225 1.824 3.042 . 0 0 "[ . 1 . 2 . ]" 1 585 1 77 VAL H 1 77 VAL HA . . 2.900 2.563 2.208 2.914 0.014 10 0 "[ . 1 . 2 . ]" 1 586 1 77 VAL H 1 77 VAL MG2 . . 3.300 2.180 1.872 2.552 . 0 0 "[ . 1 . 2 . ]" 1 587 1 77 VAL H 1 78 GLY H . . 5.000 3.790 2.267 4.637 . 0 0 "[ . 1 . 2 . ]" 1 588 1 77 VAL HA 1 77 VAL MG1 . . 3.300 2.301 2.031 2.451 . 0 0 "[ . 1 . 2 . ]" 1 589 1 77 VAL HA 1 77 VAL MG2 . . 3.300 2.458 2.239 2.663 . 0 0 "[ . 1 . 2 . ]" 1 590 1 77 VAL HA 1 78 GLY H . . 3.300 2.406 2.182 3.361 0.061 8 0 "[ . 1 . 2 . ]" 1 591 1 77 VAL HB 1 78 GLY H . . 5.000 4.312 3.293 4.553 . 0 0 "[ . 1 . 2 . ]" 1 592 1 77 VAL HB 1 84 MET HA . . 5.000 4.429 3.494 5.017 0.017 26 0 "[ . 1 . 2 . ]" 1 593 1 77 VAL MG1 1 78 GLY H . . 5.000 3.377 1.920 4.171 . 0 0 "[ . 1 . 2 . ]" 1 594 1 77 VAL MG1 1 78 GLY QA . . 5.880 3.719 3.213 4.204 . 0 0 "[ . 1 . 2 . ]" 1 595 1 77 VAL MG1 1 84 MET HA . . 5.000 2.533 1.944 4.014 . 0 0 "[ . 1 . 2 . ]" 1 596 1 77 VAL MG1 1 87 PHE H . . 5.000 3.689 2.969 4.188 . 0 0 "[ . 1 . 2 . ]" 1 597 1 77 VAL MG1 1 87 PHE QB . . 4.180 2.270 1.870 2.925 . 0 0 "[ . 1 . 2 . ]" 1 598 1 77 VAL MG1 1 87 PHE QD . . 5.000 2.568 1.968 3.475 . 0 0 "[ . 1 . 2 . ]" 1 599 1 77 VAL MG2 1 84 MET HA . . 5.000 3.565 2.833 4.027 . 0 0 "[ . 1 . 2 . ]" 1 600 1 77 VAL MG2 1 87 PHE QB . . 5.880 3.297 2.749 3.820 . 0 0 "[ . 1 . 2 . ]" 1 601 1 77 VAL MG2 1 87 PHE QD . . 5.000 3.293 2.302 3.798 . 0 0 "[ . 1 . 2 . ]" 1 602 1 78 GLY H 1 79 ALA H . . 5.000 4.184 2.049 4.671 . 0 0 "[ . 1 . 2 . ]" 1 603 1 79 ALA H 1 80 THR H . . 3.300 2.633 1.899 3.798 0.498 24 0 "[ . 1 . 2 . ]" 1 604 1 79 ALA MB 1 80 THR H . . 3.300 2.385 1.924 3.218 . 0 0 "[ . 1 . 2 . ]" 1 605 1 80 THR H 1 80 THR MG . . 3.300 2.233 1.896 2.621 . 0 0 "[ . 1 . 2 . ]" 1 606 1 80 THR HA 1 80 THR HB . . 2.900 2.490 2.399 2.626 . 0 0 "[ . 1 . 2 . ]" 1 607 1 80 THR HA 1 81 GLY H . . 3.300 2.481 2.153 3.004 . 0 0 "[ . 1 . 2 . ]" 1 608 1 81 GLY H 1 82 GLN H . . 5.000 4.069 2.978 4.669 . 0 0 "[ . 1 . 2 . ]" 1 609 1 82 GLN H 1 83 TYR H . . 3.300 2.764 2.127 3.320 0.020 15 0 "[ . 1 . 2 . ]" 1 610 1 82 GLN HA 1 82 GLN HG2 . . 3.300 2.651 1.986 3.555 0.255 8 0 "[ . 1 . 2 . ]" 1 611 1 82 GLN HA 1 82 GLN HG3 . . 3.300 2.674 1.961 3.583 0.283 13 0 "[ . 1 . 2 . ]" 1 612 1 82 GLN QG 1 83 TYR H . . 5.880 4.124 3.600 5.002 . 0 0 "[ . 1 . 2 . ]" 1 613 1 83 TYR H 1 83 TYR QB . . 3.300 2.457 2.087 3.114 . 0 0 "[ . 1 . 2 . ]" 1 614 1 83 TYR H 1 83 TYR QE . . 5.000 4.396 3.953 4.784 . 0 0 "[ . 1 . 2 . ]" 1 615 1 83 TYR H 1 84 MET H . . 5.000 4.259 2.463 4.670 . 0 0 "[ . 1 . 2 . ]" 1 616 1 83 TYR HA 1 84 MET H . . 3.300 2.398 2.193 3.229 . 0 0 "[ . 1 . 2 . ]" 1 617 1 83 TYR HA 1 86 SER H . . 5.000 4.722 4.210 5.031 0.031 2 0 "[ . 1 . 2 . ]" 1 618 1 83 TYR QB 1 86 SER H . . 5.000 2.802 2.398 3.417 . 0 0 "[ . 1 . 2 . ]" 1 619 1 83 TYR QD 1 133 TYR QB . . 4.180 3.351 2.309 3.788 . 0 0 "[ . 1 . 2 . ]" 1 620 1 83 TYR QE 1 133 TYR QD . . 5.000 3.322 2.787 4.357 . 0 0 "[ . 1 . 2 . ]" 1 621 1 84 MET H 1 85 ALA H . . 5.000 2.717 2.149 3.785 . 0 0 "[ . 1 . 2 . ]" 1 622 1 84 MET HA 1 87 PHE H . . 5.000 3.284 2.906 3.771 . 0 0 "[ . 1 . 2 . ]" 1 623 1 84 MET HA 1 87 PHE QB . . 4.180 2.745 1.978 3.662 . 0 0 "[ . 1 . 2 . ]" 1 624 1 84 MET QB 1 85 ALA H . . 4.180 3.038 2.025 3.518 . 0 0 "[ . 1 . 2 . ]" 1 625 1 84 MET QB 1 87 PHE H . . 5.880 4.770 4.220 5.153 . 0 0 "[ . 1 . 2 . ]" 1 626 1 84 MET QB 1 126 ILE MD . . 4.180 2.739 2.476 2.986 . 0 0 "[ . 1 . 2 . ]" 1 627 1 84 MET QB 1 126 ILE MG . . 5.880 2.239 1.913 2.670 . 0 0 "[ . 1 . 2 . ]" 1 628 1 84 MET QB 1 130 ILE MD . . 4.180 2.540 1.967 2.862 . 0 0 "[ . 1 . 2 . ]" 1 629 1 84 MET QG 1 126 ILE MG . . 5.880 2.682 1.810 3.431 . 0 0 "[ . 1 . 2 . ]" 1 630 1 85 ALA H 1 85 ALA MB . . 2.900 2.027 1.935 2.162 . 0 0 "[ . 1 . 2 . ]" 1 631 1 85 ALA H 1 86 SER H . . 5.000 2.685 2.259 2.936 . 0 0 "[ . 1 . 2 . ]" 1 632 1 85 ALA H 1 130 ILE MD . . 5.000 2.159 1.810 2.895 . 0 0 "[ . 1 . 2 . ]" 1 633 1 85 ALA HA 1 88 PHE H . . 5.000 4.472 3.255 5.174 0.174 21 0 "[ . 1 . 2 . ]" 1 634 1 85 ALA HA 1 88 PHE QB . . 4.180 3.093 2.113 3.626 . 0 0 "[ . 1 . 2 . ]" 1 635 1 85 ALA HA 1 130 ILE MD . . 3.300 2.517 2.122 2.756 . 0 0 "[ . 1 . 2 . ]" 1 636 1 85 ALA MB 1 86 SER H . . 3.300 2.611 2.367 2.737 . 0 0 "[ . 1 . 2 . ]" 1 637 1 85 ALA MB 1 130 ILE MD . . 3.300 1.814 1.655 1.931 . 0 0 "[ . 1 . 2 . ]" 1 638 1 86 SER H 1 87 PHE H . . 3.300 2.764 2.521 3.073 . 0 0 "[ . 1 . 2 . ]" 1 639 1 87 PHE H 1 87 PHE HA . . 2.900 2.827 2.640 2.897 . 0 0 "[ . 1 . 2 . ]" 1 640 1 87 PHE H 1 87 PHE QB . . 3.490 2.065 1.940 2.551 . 0 0 "[ . 1 . 2 . ]" 1 641 1 87 PHE HA 1 87 PHE QD . . 3.300 2.680 2.062 3.148 . 0 0 "[ . 1 . 2 . ]" 1 642 1 88 PHE H 1 88 PHE QB . . 3.660 2.432 1.908 3.095 . 0 0 "[ . 1 . 2 . ]" 1 643 1 88 PHE H 1 89 SER H . . 5.000 2.324 1.825 4.140 . 0 0 "[ . 1 . 2 . ]" 1 644 1 88 PHE H 1 90 THR H . . 5.000 3.650 2.736 4.994 . 0 0 "[ . 1 . 2 . ]" 1 645 1 88 PHE HA 1 88 PHE QD . . 2.900 2.770 1.870 3.264 0.364 7 0 "[ . 1 . 2 . ]" 1 646 1 88 PHE HA 1 91 ASN H . . 5.000 3.620 3.143 4.265 . 0 0 "[ . 1 . 2 . ]" 1 647 1 88 PHE HA 1 95 ALA MB . . 3.300 2.162 1.837 2.521 . 0 0 "[ . 1 . 2 . ]" 1 648 1 88 PHE QB 1 95 ALA MB . . 4.180 2.768 1.883 3.200 . 0 0 "[ . 1 . 2 . ]" 1 649 1 89 SER H 1 89 SER QB . . 3.500 2.141 1.996 2.480 . 0 0 "[ . 1 . 2 . ]" 1 650 1 89 SER H 1 90 THR H . . 2.900 2.792 2.506 3.046 0.146 18 0 "[ . 1 . 2 . ]" 1 651 1 90 THR H 1 90 THR HA . . 2.900 2.829 2.747 2.924 0.024 2 0 "[ . 1 . 2 . ]" 1 652 1 90 THR H 1 90 THR MG . . 2.900 2.081 1.892 2.322 . 0 0 "[ . 1 . 2 . ]" 1 653 1 90 THR H 1 91 ASN H . . 2.900 2.741 2.255 2.926 0.026 17 0 "[ . 1 . 2 . ]" 1 654 1 90 THR HA 1 90 THR HB . . 2.900 2.491 2.404 2.587 . 0 0 "[ . 1 . 2 . ]" 1 655 1 90 THR HA 1 90 THR MG . . 3.300 2.463 2.346 2.595 . 0 0 "[ . 1 . 2 . ]" 1 656 1 90 THR HB 1 91 ASN H . . 5.000 3.555 3.102 4.069 . 0 0 "[ . 1 . 2 . ]" 1 657 1 90 THR MG 1 91 ASN H . . 5.000 3.707 3.483 3.977 . 0 0 "[ . 1 . 2 . ]" 1 658 1 91 ASN H 1 91 ASN HA . . 2.900 2.883 2.815 2.917 0.017 20 0 "[ . 1 . 2 . ]" 1 659 1 91 ASN H 1 91 ASN QB . . 3.680 2.490 2.061 3.161 . 0 0 "[ . 1 . 2 . ]" 1 660 1 91 ASN HA 1 92 SER H . . 2.900 2.330 2.252 2.517 . 0 0 "[ . 1 . 2 . ]" 1 661 1 91 ASN O 1 95 ALA H . . 2.300 2.383 2.298 2.447 0.147 20 0 "[ . 1 . 2 . ]" 1 662 1 91 ASN O 1 95 ALA N . . 3.300 3.301 3.184 3.418 0.118 21 0 "[ . 1 . 2 . ]" 1 663 1 92 SER HA 1 95 ALA MB . . 3.300 2.042 1.931 2.289 . 0 0 "[ . 1 . 2 . ]" 1 664 1 93 GLU H 1 93 GLU QB . . 3.500 2.309 2.023 2.836 . 0 0 "[ . 1 . 2 . ]" 1 665 1 93 GLU H 1 94 PRO QD . . 3.780 2.321 1.965 2.437 . 0 0 "[ . 1 . 2 . ]" 1 666 1 93 GLU H 1 94 PRO QG . . 5.880 4.281 3.910 4.407 . 0 0 "[ . 1 . 2 . ]" 1 667 1 93 GLU HA 1 95 ALA H . . 5.000 4.980 4.690 5.055 0.055 18 0 "[ . 1 . 2 . ]" 1 668 1 93 GLU HA 1 96 ILE HB . . 5.000 2.954 2.670 3.167 . 0 0 "[ . 1 . 2 . ]" 1 669 1 93 GLU HA 1 96 ILE MD . . 3.300 2.387 2.185 2.615 . 0 0 "[ . 1 . 2 . ]" 1 670 1 93 GLU HA 1 97 ILE H . . 5.000 4.544 4.331 4.630 . 0 0 "[ . 1 . 2 . ]" 1 671 1 93 GLU HA 1 97 ILE MD . . 5.000 3.921 3.622 4.106 . 0 0 "[ . 1 . 2 . ]" 1 672 1 93 GLU QB 1 94 PRO QD . . 5.050 1.833 1.641 1.944 . 0 0 "[ . 1 . 2 . ]" 1 673 1 93 GLU O 1 97 ILE H . . 2.300 2.330 2.221 2.376 0.076 7 0 "[ . 1 . 2 . ]" 1 674 1 93 GLU O 1 97 ILE N . . 3.300 3.308 3.189 3.357 0.057 20 0 "[ . 1 . 2 . ]" 1 675 1 94 PRO HA 1 97 ILE H . . 5.000 3.268 3.115 3.526 . 0 0 "[ . 1 . 2 . ]" 1 676 1 94 PRO HA 1 97 ILE HB . . 5.000 2.763 2.575 2.987 . 0 0 "[ . 1 . 2 . ]" 1 677 1 94 PRO HA 1 97 ILE MD . . 5.000 3.798 3.464 3.986 . 0 0 "[ . 1 . 2 . ]" 1 678 1 94 PRO HA 1 97 ILE MG . . 5.000 3.826 3.585 4.103 . 0 0 "[ . 1 . 2 . ]" 1 679 1 94 PRO QG 1 95 ALA H . . 4.180 2.519 2.454 2.719 . 0 0 "[ . 1 . 2 . ]" 1 680 1 94 PRO O 1 98 PHE H . . 2.300 1.815 1.487 2.329 0.029 8 0 "[ . 1 . 2 . ]" 1 681 1 94 PRO O 1 98 PHE N . . 3.300 2.784 2.463 3.231 . 0 0 "[ . 1 . 2 . ]" 1 682 1 95 ALA H 1 95 ALA HA . . 2.900 2.750 2.718 2.791 . 0 0 "[ . 1 . 2 . ]" 1 683 1 95 ALA H 1 95 ALA MB . . 2.900 2.085 1.959 2.161 . 0 0 "[ . 1 . 2 . ]" 1 684 1 95 ALA H 1 96 ILE H . . 3.300 2.731 2.623 2.855 . 0 0 "[ . 1 . 2 . ]" 1 685 1 95 ALA HA 1 98 PHE H . . 5.000 3.665 3.451 4.047 . 0 0 "[ . 1 . 2 . ]" 1 686 1 95 ALA HA 1 98 PHE QB . . 5.880 2.467 2.153 3.057 . 0 0 "[ . 1 . 2 . ]" 1 687 1 95 ALA O 1 99 CYS H . . 2.300 2.164 1.826 2.352 0.052 7 0 "[ . 1 . 2 . ]" 1 688 1 95 ALA O 1 99 CYS N . . 3.300 3.044 2.750 3.320 0.020 19 0 "[ . 1 . 2 . ]" 1 689 1 96 ILE H 1 97 ILE H . . 5.000 2.673 2.526 2.826 . 0 0 "[ . 1 . 2 . ]" 1 690 1 96 ILE HA 1 96 ILE MG . . 3.300 2.671 2.533 2.797 . 0 0 "[ . 1 . 2 . ]" 1 691 1 96 ILE HB 1 96 ILE MD . . 3.300 2.036 1.928 2.187 . 0 0 "[ . 1 . 2 . ]" 1 692 1 96 ILE HB 1 97 ILE H . . 3.300 2.613 2.354 2.856 . 0 0 "[ . 1 . 2 . ]" 1 693 1 96 ILE MG 1 97 ILE MD . . 3.300 1.874 1.832 1.942 . 0 0 "[ . 1 . 2 . ]" 1 694 1 96 ILE O 1 100 VAL H . . 2.300 2.025 1.701 2.325 0.025 20 0 "[ . 1 . 2 . ]" 1 695 1 96 ILE O 1 100 VAL N . . 3.300 2.955 2.554 3.321 0.021 19 0 "[ . 1 . 2 . ]" 1 696 1 97 ILE H 1 97 ILE HB . . 2.900 2.099 2.048 2.162 . 0 0 "[ . 1 . 2 . ]" 1 697 1 97 ILE H 1 97 ILE MD . . 3.300 2.032 1.903 2.317 . 0 0 "[ . 1 . 2 . ]" 1 698 1 97 ILE H 1 98 PHE H . . 3.300 2.835 2.642 3.092 . 0 0 "[ . 1 . 2 . ]" 1 699 1 97 ILE HA 1 97 ILE MD . . 2.900 2.135 1.954 2.458 . 0 0 "[ . 1 . 2 . ]" 1 700 1 97 ILE HA 1 97 ILE MG . . 3.300 2.743 2.663 2.814 . 0 0 "[ . 1 . 2 . ]" 1 701 1 97 ILE HA 1 100 VAL HB . . 5.000 2.836 2.269 3.369 . 0 0 "[ . 1 . 2 . ]" 1 702 1 97 ILE HA 1 100 VAL MG2 . . 5.000 3.779 3.124 4.152 . 0 0 "[ . 1 . 2 . ]" 1 703 1 97 ILE HB 1 97 ILE MD . . 3.300 2.402 2.269 2.508 . 0 0 "[ . 1 . 2 . ]" 1 704 1 97 ILE O 1 101 ILE H . . 2.300 2.022 1.546 2.333 0.033 20 0 "[ . 1 . 2 . ]" 1 705 1 97 ILE O 1 101 ILE N . . 3.300 2.952 2.494 3.308 0.008 9 0 "[ . 1 . 2 . ]" 1 706 1 98 PHE H 1 99 CYS H . . 5.000 2.798 2.520 3.186 . 0 0 "[ . 1 . 2 . ]" 1 707 1 98 PHE HA 1 101 ILE HB . . 5.000 2.555 1.996 3.072 . 0 0 "[ . 1 . 2 . ]" 1 708 1 98 PHE O 1 102 TYR H . . 2.300 1.764 1.460 2.275 . 0 0 "[ . 1 . 2 . ]" 1 709 1 98 PHE O 1 102 TYR N . . 3.300 2.700 2.450 3.262 . 0 0 "[ . 1 . 2 . ]" 1 710 1 99 CYS H 1 99 CYS QB . . 3.680 2.162 2.042 2.282 . 0 0 "[ . 1 . 2 . ]" 1 711 1 99 CYS HA 1 102 TYR H . . 5.000 3.605 3.129 4.131 . 0 0 "[ . 1 . 2 . ]" 1 712 1 99 CYS QB 1 100 VAL H . . 5.880 2.395 2.115 2.745 . 0 0 "[ . 1 . 2 . ]" 1 713 1 99 CYS O 1 103 PHE H . . 2.300 1.928 1.541 2.333 0.033 16 0 "[ . 1 . 2 . ]" 1 714 1 99 CYS O 1 103 PHE N . . 3.300 2.852 2.495 3.304 0.004 20 0 "[ . 1 . 2 . ]" 1 715 1 100 VAL H 1 100 VAL HB . . 2.900 2.134 1.966 2.260 . 0 0 "[ . 1 . 2 . ]" 1 716 1 100 VAL H 1 101 ILE H . . 5.000 2.894 2.479 3.235 . 0 0 "[ . 1 . 2 . ]" 1 717 1 100 VAL HA 1 100 VAL MG2 . . 3.300 2.052 1.962 2.240 . 0 0 "[ . 1 . 2 . ]" 1 718 1 100 VAL HA 1 103 PHE H . . 5.000 3.917 3.335 4.385 . 0 0 "[ . 1 . 2 . ]" 1 719 1 100 VAL MG1 1 101 ILE HA . . 5.000 2.991 2.749 3.253 . 0 0 "[ . 1 . 2 . ]" 1 720 1 100 VAL MG1 1 101 ILE MD . . 5.000 3.078 2.812 3.322 . 0 0 "[ . 1 . 2 . ]" 1 721 1 100 VAL MG2 1 101 ILE H . . 5.000 4.122 3.863 4.255 . 0 0 "[ . 1 . 2 . ]" 1 722 1 100 VAL O 1 104 LEU H . . 2.300 2.074 1.803 2.308 0.008 6 0 "[ . 1 . 2 . ]" 1 723 1 100 VAL O 1 104 LEU N . . 3.300 3.030 2.745 3.274 . 0 0 "[ . 1 . 2 . ]" 1 724 1 101 ILE H 1 101 ILE HB . . 2.900 2.386 2.242 2.488 . 0 0 "[ . 1 . 2 . ]" 1 725 1 101 ILE H 1 101 ILE MD . . 5.000 3.553 3.279 3.819 . 0 0 "[ . 1 . 2 . ]" 1 726 1 101 ILE HA 1 101 ILE MD . . 3.300 2.233 1.964 2.387 . 0 0 "[ . 1 . 2 . ]" 1 727 1 101 ILE HA 1 101 ILE MG . . 3.300 2.431 2.320 2.530 . 0 0 "[ . 1 . 2 . ]" 1 728 1 101 ILE HA 1 104 LEU H . . 5.000 3.752 3.285 3.980 . 0 0 "[ . 1 . 2 . ]" 1 729 1 101 ILE HA 1 104 LEU MD1 . . 3.300 2.370 1.982 2.666 . 0 0 "[ . 1 . 2 . ]" 1 730 1 101 ILE MD 1 110 LEU MD1 . . 3.300 1.894 1.823 2.033 . 0 0 "[ . 1 . 2 . ]" 1 731 1 101 ILE MG 1 105 TYR QD . . 5.000 2.101 1.794 2.652 . 0 0 "[ . 1 . 2 . ]" 1 732 1 101 ILE MG 1 105 TYR QE . . 5.000 2.016 1.829 2.387 . 0 0 "[ . 1 . 2 . ]" 1 733 1 101 ILE MG 1 110 LEU MD1 . . 3.300 2.071 1.922 2.194 . 0 0 "[ . 1 . 2 . ]" 1 734 1 101 ILE MG 1 123 TYR QD . . 5.000 3.423 3.085 3.660 . 0 0 "[ . 1 . 2 . ]" 1 735 1 101 ILE MG 1 123 TYR QE . . 5.000 2.083 1.761 2.665 . 0 0 "[ . 1 . 2 . ]" 1 736 1 101 ILE O 1 105 TYR H . . 2.300 2.041 1.717 2.366 0.066 13 0 "[ . 1 . 2 . ]" 1 737 1 101 ILE O 1 105 TYR N . . 3.300 2.960 2.691 3.196 . 0 0 "[ . 1 . 2 . ]" 1 738 1 102 TYR H 1 103 PHE H . . 3.300 3.112 2.808 3.327 0.027 6 0 "[ . 1 . 2 . ]" 1 739 1 102 TYR O 1 106 HIS H . . 2.300 1.715 1.502 2.368 0.068 23 0 "[ . 1 . 2 . ]" 1 740 1 102 TYR O 1 106 HIS N . . 3.300 2.663 2.485 3.345 0.045 23 0 "[ . 1 . 2 . ]" 1 741 1 103 PHE O 1 107 PHE H . . 2.300 2.019 1.448 2.348 0.048 13 0 "[ . 1 . 2 . ]" 1 742 1 103 PHE O 1 107 PHE N . . 3.300 2.879 2.407 3.288 . 0 0 "[ . 1 . 2 . ]" 1 743 1 104 LEU H 1 104 LEU MD1 . . 5.000 3.337 2.866 3.724 . 0 0 "[ . 1 . 2 . ]" 1 744 1 104 LEU H 1 104 LEU HG . . 3.300 2.343 1.939 3.045 . 0 0 "[ . 1 . 2 . ]" 1 745 1 104 LEU H 1 105 TYR H . . 3.300 2.982 2.675 3.323 0.023 7 0 "[ . 1 . 2 . ]" 1 746 1 104 LEU HA 1 104 LEU MD2 . . 3.300 2.220 1.971 2.522 . 0 0 "[ . 1 . 2 . ]" 1 747 1 104 LEU QB 1 105 TYR H . . 5.880 2.420 2.029 3.180 . 0 0 "[ . 1 . 2 . ]" 1 748 1 104 LEU MD2 1 109 PHE HB2 . . 5.000 2.560 2.055 3.252 . 0 0 "[ . 1 . 2 . ]" 1 749 1 104 LEU MD2 1 109 PHE HB3 . . 5.000 3.106 2.030 4.341 . 0 0 "[ . 1 . 2 . ]" 1 750 1 105 TYR H 1 105 TYR QD . . 3.300 3.159 2.689 3.448 0.148 13 0 "[ . 1 . 2 . ]" 1 751 1 105 TYR H 1 106 HIS H . . 5.000 2.842 2.280 3.259 . 0 0 "[ . 1 . 2 . ]" 1 752 1 105 TYR H 1 110 LEU MD1 . . 5.000 3.196 2.401 3.890 . 0 0 "[ . 1 . 2 . ]" 1 753 1 105 TYR HA 1 105 TYR QD . . 3.300 2.183 1.929 2.634 . 0 0 "[ . 1 . 2 . ]" 1 754 1 105 TYR HA 1 105 TYR QE . . 5.000 4.338 4.259 4.518 . 0 0 "[ . 1 . 2 . ]" 1 755 1 105 TYR QB 1 106 HIS H . . 4.180 2.360 2.070 2.866 . 0 0 "[ . 1 . 2 . ]" 1 756 1 105 TYR QD 1 106 HIS H . . 5.000 4.369 4.118 4.693 . 0 0 "[ . 1 . 2 . ]" 1 757 1 105 TYR QE 1 110 LEU MD1 . . 5.000 2.529 1.905 3.034 . 0 0 "[ . 1 . 2 . ]" 1 758 1 105 TYR QE 1 110 LEU MD2 . . 5.000 3.113 2.220 3.725 . 0 0 "[ . 1 . 2 . ]" 1 759 1 105 TYR QE 1 110 LEU HG . . 5.000 4.765 4.565 4.896 . 0 0 "[ . 1 . 2 . ]" 1 760 1 105 TYR QE 1 112 ASP HB2 . . 5.000 3.026 1.994 4.398 . 0 0 "[ . 1 . 2 . ]" 1 761 1 105 TYR QE 1 112 ASP HB3 . . 5.000 3.021 1.981 4.459 . 0 0 "[ . 1 . 2 . ]" 1 762 1 106 HIS H 1 106 HIS HA . . 2.900 2.724 2.648 2.917 0.017 23 0 "[ . 1 . 2 . ]" 1 763 1 106 HIS H 1 106 HIS QB . . 3.670 2.137 1.981 2.433 . 0 0 "[ . 1 . 2 . ]" 1 764 1 106 HIS H 1 107 PHE H . . 5.000 2.988 2.506 3.304 . 0 0 "[ . 1 . 2 . ]" 1 765 1 106 HIS QB 1 107 PHE H . . 4.140 2.691 2.190 3.978 . 0 0 "[ . 1 . 2 . ]" 1 766 1 106 HIS HB2 1 107 PHE H . . 5.000 3.136 2.266 4.533 . 0 0 "[ . 1 . 2 . ]" 1 767 1 106 HIS HB3 1 107 PHE H . . 5.000 3.066 2.294 4.478 . 0 0 "[ . 1 . 2 . ]" 1 768 1 107 PHE H 1 107 PHE QB . . 3.660 2.506 1.938 3.344 . 0 0 "[ . 1 . 2 . ]" 1 769 1 107 PHE H 1 108 GLY H . . 3.300 2.724 1.880 3.285 . 0 0 "[ . 1 . 2 . ]" 1 770 1 108 GLY H 1 108 GLY HA2 . . 2.900 2.628 2.248 2.961 0.061 14 0 "[ . 1 . 2 . ]" 1 771 1 108 GLY H 1 108 GLY HA3 . . 2.900 2.716 2.286 2.959 0.059 4 0 "[ . 1 . 2 . ]" 1 772 1 108 GLY H 1 109 PHE H . . 3.300 3.065 1.915 3.448 0.148 5 0 "[ . 1 . 2 . ]" 1 773 1 109 PHE H 1 110 LEU H . . 2.900 2.068 1.691 2.858 . 0 0 "[ . 1 . 2 . ]" 1 774 1 109 PHE HA 1 109 PHE QD . . 2.900 2.726 2.172 3.148 0.248 11 0 "[ . 1 . 2 . ]" 1 775 1 110 LEU H 1 110 LEU HB2 . . 3.300 2.008 1.983 2.221 . 0 0 "[ . 1 . 2 . ]" 1 776 1 110 LEU H 1 110 LEU HB3 . . 3.300 3.247 3.093 3.355 0.055 19 0 "[ . 1 . 2 . ]" 1 777 1 110 LEU H 1 110 LEU MD1 . . 5.000 3.904 3.722 4.244 . 0 0 "[ . 1 . 2 . ]" 1 778 1 110 LEU H 1 110 LEU MD2 . . 5.000 4.070 3.929 4.205 . 0 0 "[ . 1 . 2 . ]" 1 779 1 110 LEU H 1 111 LYS H . . 5.000 4.644 4.538 4.674 . 0 0 "[ . 1 . 2 . ]" 1 780 1 110 LEU HA 1 110 LEU MD2 . . 2.900 1.998 1.931 2.172 . 0 0 "[ . 1 . 2 . ]" 1 781 1 110 LEU HA 1 111 LYS H . . 2.900 2.293 2.210 2.399 . 0 0 "[ . 1 . 2 . ]" 1 782 1 110 LEU MD2 1 111 LYS H . . 2.900 2.010 1.919 2.278 . 0 0 "[ . 1 . 2 . ]" 1 783 1 110 LEU HG 1 111 LYS H . . 5.000 4.201 4.062 4.420 . 0 0 "[ . 1 . 2 . ]" 1 784 1 111 LYS H 1 111 LYS QB . . 3.500 2.531 2.077 3.182 . 0 0 "[ . 1 . 2 . ]" 1 785 1 111 LYS H 1 111 LYS QG . . 3.780 2.947 2.143 3.559 . 0 0 "[ . 1 . 2 . ]" 1 786 1 111 LYS HA 1 111 LYS QD . . 4.180 3.414 2.103 3.884 . 0 0 "[ . 1 . 2 . ]" 1 787 1 111 LYS HA 1 111 LYS QG . . 3.710 2.674 1.966 3.381 . 0 0 "[ . 1 . 2 . ]" 1 788 1 111 LYS HA 1 112 ASP H . . 2.900 2.257 2.177 2.465 . 0 0 "[ . 1 . 2 . ]" 1 789 1 111 LYS QB 1 112 ASP H . . 4.180 3.156 2.477 3.734 . 0 0 "[ . 1 . 2 . ]" 1 790 1 112 ASP H 1 112 ASP QB . . 3.670 2.858 2.528 3.227 . 0 0 "[ . 1 . 2 . ]" 1 791 1 112 ASP HA 1 113 ASN H . . 2.900 2.416 2.252 2.944 0.044 24 0 "[ . 1 . 2 . ]" 1 792 1 113 ASN H 1 114 ASN H . . 5.000 4.135 2.687 4.672 . 0 0 "[ . 1 . 2 . ]" 1 793 1 113 ASN HA 1 114 ASN H . . 3.300 2.472 2.252 2.936 . 0 0 "[ . 1 . 2 . ]" 1 794 1 114 ASN H 1 114 ASN QB . . 3.680 2.861 2.064 3.481 . 0 0 "[ . 1 . 2 . ]" 1 795 1 115 LYS HA 1 115 LYS QG . . 3.710 2.234 1.967 3.327 . 0 0 "[ . 1 . 2 . ]" 1 796 1 116 LYS HA 1 116 LYS QE . . 5.880 4.240 2.949 5.250 . 0 0 "[ . 1 . 2 . ]" 1 797 1 116 LYS HA 1 116 LYS QG . . 3.710 2.408 1.916 3.332 . 0 0 "[ . 1 . 2 . ]" 1 798 1 116 LYS HA 1 117 GLN H . . 3.300 2.642 2.180 3.584 0.284 25 0 "[ . 1 . 2 . ]" 1 799 1 117 GLN H 1 117 GLN HA . . 2.900 2.639 2.172 2.918 0.018 10 0 "[ . 1 . 2 . ]" 1 800 1 117 GLN H 1 117 GLN QG . . 3.780 2.756 1.916 3.323 . 0 0 "[ . 1 . 2 . ]" 1 801 1 117 GLN HA 1 117 GLN QG . . 3.720 2.942 2.100 3.334 . 0 0 "[ . 1 . 2 . ]" 1 802 1 117 GLN HA 1 121 LYS H . . 5.000 4.456 2.207 5.143 0.143 18 0 "[ . 1 . 2 . ]" 1 803 1 117 GLN QG 1 118 ILE H . . 4.180 3.572 1.747 3.907 . 0 0 "[ . 1 . 2 . ]" 1 804 1 118 ILE H 1 118 ILE HB . . 3.300 2.848 2.205 3.458 0.158 18 0 "[ . 1 . 2 . ]" 1 805 1 118 ILE H 1 118 ILE QG . . 5.000 3.942 1.774 4.268 . 0 0 "[ . 1 . 2 . ]" 1 806 1 118 ILE H 1 118 ILE MG . . 3.300 2.503 1.888 2.801 . 0 0 "[ . 1 . 2 . ]" 1 807 1 118 ILE HA 1 119 ILE MD . . 5.000 3.739 3.382 4.153 . 0 0 "[ . 1 . 2 . ]" 1 808 1 118 ILE HA 1 121 LYS H . . 5.000 4.280 2.723 4.710 . 0 0 "[ . 1 . 2 . ]" 1 809 1 118 ILE HA 1 121 LYS QB . . 4.180 3.525 2.053 3.970 . 0 0 "[ . 1 . 2 . ]" 1 810 1 118 ILE HB 1 119 ILE H . . 5.000 3.666 3.408 4.039 . 0 0 "[ . 1 . 2 . ]" 1 811 1 118 ILE QG 1 118 ILE MG . . 3.300 2.077 1.938 2.156 . 0 0 "[ . 1 . 2 . ]" 1 812 1 118 ILE MG 1 121 LYS H . . 5.000 2.910 1.922 4.300 . 0 0 "[ . 1 . 2 . ]" 1 813 1 118 ILE O 1 122 ALA H . . 2.300 1.972 1.514 2.320 0.020 23 0 "[ . 1 . 2 . ]" 1 814 1 118 ILE O 1 122 ALA N . . 3.300 2.879 2.479 3.231 . 0 0 "[ . 1 . 2 . ]" 1 815 1 119 ILE H 1 119 ILE HB . . 2.900 2.588 2.299 2.732 . 0 0 "[ . 1 . 2 . ]" 1 816 1 119 ILE H 1 119 ILE MD . . 3.300 2.328 1.771 2.626 . 0 0 "[ . 1 . 2 . ]" 1 817 1 119 ILE H 1 119 ILE QG . . 3.300 2.004 1.834 3.184 . 0 0 "[ . 1 . 2 . ]" 1 818 1 119 ILE H 1 120 LYS H . . 5.000 3.041 2.627 3.264 . 0 0 "[ . 1 . 2 . ]" 1 819 1 119 ILE HA 1 119 ILE MD . . 3.300 1.967 1.862 2.687 . 0 0 "[ . 1 . 2 . ]" 1 820 1 119 ILE HA 1 119 ILE MG . . 3.300 2.342 2.195 2.658 . 0 0 "[ . 1 . 2 . ]" 1 821 1 119 ILE HA 1 122 ALA H . . 3.300 3.265 3.028 3.464 0.164 18 0 "[ . 1 . 2 . ]" 1 822 1 119 ILE HB 1 120 LYS H . . 3.300 2.265 2.011 3.075 . 0 0 "[ . 1 . 2 . ]" 1 823 1 119 ILE QG 1 119 ILE MG . . 3.300 2.198 2.091 2.274 . 0 0 "[ . 1 . 2 . ]" 1 824 1 119 ILE MG 1 123 TYR QD . . 5.000 2.237 1.885 2.828 . 0 0 "[ . 1 . 2 . ]" 1 825 1 119 ILE MG 1 123 TYR QE . . 3.300 2.065 1.817 2.755 . 0 0 "[ . 1 . 2 . ]" 1 826 1 119 ILE O 1 123 TYR H . . 2.300 1.899 1.640 2.301 0.001 13 0 "[ . 1 . 2 . ]" 1 827 1 119 ILE O 1 123 TYR N . . 3.300 2.726 2.519 3.215 . 0 0 "[ . 1 . 2 . ]" 1 828 1 120 LYS QB 1 121 LYS H . . 5.880 2.911 2.502 3.666 . 0 0 "[ . 1 . 2 . ]" 1 829 1 120 LYS O 1 124 GLU H . . 2.300 2.064 1.629 2.370 0.070 18 0 "[ . 1 . 2 . ]" 1 830 1 120 LYS O 1 124 GLU N . . 3.300 2.903 2.539 3.222 . 0 0 "[ . 1 . 2 . ]" 1 831 1 121 LYS H 1 121 LYS HA . . 2.900 2.795 2.712 2.860 . 0 0 "[ . 1 . 2 . ]" 1 832 1 121 LYS H 1 121 LYS QB . . 3.500 2.116 2.026 2.213 . 0 0 "[ . 1 . 2 . ]" 1 833 1 121 LYS H 1 122 ALA H . . 5.000 2.754 2.398 2.915 . 0 0 "[ . 1 . 2 . ]" 1 834 1 121 LYS HA 1 121 LYS QD . . 4.180 2.880 1.914 3.749 . 0 0 "[ . 1 . 2 . ]" 1 835 1 121 LYS HA 1 121 LYS QG . . 3.710 2.262 1.961 2.823 . 0 0 "[ . 1 . 2 . ]" 1 836 1 121 LYS HA 1 124 GLU HB2 . . 5.000 3.695 2.427 4.427 . 0 0 "[ . 1 . 2 . ]" 1 837 1 121 LYS HA 1 124 GLU HB3 . . 5.000 3.151 2.451 4.588 . 0 0 "[ . 1 . 2 . ]" 1 838 1 121 LYS HA 1 124 GLU QG . . 5.880 4.606 3.655 5.243 . 0 0 "[ . 1 . 2 . ]" 1 839 1 121 LYS O 1 125 THR H . . 2.300 1.920 1.580 2.346 0.046 18 0 "[ . 1 . 2 . ]" 1 840 1 121 LYS O 1 125 THR N . . 3.300 2.775 2.480 3.158 . 0 0 "[ . 1 . 2 . ]" 1 841 1 122 ALA H 1 122 ALA HA . . 2.900 2.801 2.738 2.871 . 0 0 "[ . 1 . 2 . ]" 1 842 1 122 ALA H 1 122 ALA MB . . 2.900 2.086 1.961 2.198 . 0 0 "[ . 1 . 2 . ]" 1 843 1 122 ALA H 1 123 TYR H . . 3.300 2.890 2.670 3.123 . 0 0 "[ . 1 . 2 . ]" 1 844 1 122 ALA HA 1 125 THR H . . 5.000 3.071 2.957 3.190 . 0 0 "[ . 1 . 2 . ]" 1 845 1 122 ALA HA 1 125 THR MG . . 3.300 2.268 1.997 2.563 . 0 0 "[ . 1 . 2 . ]" 1 846 1 122 ALA MB 1 123 TYR H . . 2.900 2.173 1.971 2.392 . 0 0 "[ . 1 . 2 . ]" 1 847 1 122 ALA MB 1 125 THR H . . 5.000 4.275 4.238 4.306 . 0 0 "[ . 1 . 2 . ]" 1 848 1 122 ALA O 1 126 ILE H . . 2.300 2.267 2.140 2.355 0.055 18 0 "[ . 1 . 2 . ]" 1 849 1 122 ALA O 1 126 ILE N . . 3.300 3.061 2.917 3.155 . 0 0 "[ . 1 . 2 . ]" 1 850 1 123 TYR H 1 123 TYR QD . . 3.300 2.550 1.940 3.274 . 0 0 "[ . 1 . 2 . ]" 1 851 1 123 TYR HA 1 126 ILE H . . 5.000 3.747 3.510 4.020 . 0 0 "[ . 1 . 2 . ]" 1 852 1 123 TYR HA 1 126 ILE MD . . 5.000 3.863 3.644 4.058 . 0 0 "[ . 1 . 2 . ]" 1 853 1 123 TYR O 1 127 ALA H . . 2.300 1.997 1.724 2.316 0.016 11 0 "[ . 1 . 2 . ]" 1 854 1 123 TYR O 1 127 ALA N . . 3.300 2.974 2.702 3.300 0.000 11 0 "[ . 1 . 2 . ]" 1 855 1 124 GLU HA 1 124 GLU QG . . 3.720 2.420 2.192 3.029 . 0 0 "[ . 1 . 2 . ]" 1 856 1 124 GLU HA 1 127 ALA H . . 3.300 3.293 3.163 3.352 0.052 20 0 "[ . 1 . 2 . ]" 1 857 1 124 GLU HA 1 127 ALA MB . . 3.300 2.192 1.980 2.370 . 0 0 "[ . 1 . 2 . ]" 1 858 1 124 GLU QG 1 125 THR H . . 5.880 4.082 3.503 4.670 . 0 0 "[ . 1 . 2 . ]" 1 859 1 124 GLU O 1 128 ASP H . . 2.300 1.940 1.702 2.322 0.022 7 0 "[ . 1 . 2 . ]" 1 860 1 124 GLU O 1 128 ASP N . . 3.300 2.796 2.625 3.150 . 0 0 "[ . 1 . 2 . ]" 1 861 1 125 THR H 1 125 THR HA . . 2.900 2.771 2.717 2.836 . 0 0 "[ . 1 . 2 . ]" 1 862 1 125 THR H 1 125 THR HB . . 2.900 2.061 1.974 2.163 . 0 0 "[ . 1 . 2 . ]" 1 863 1 125 THR H 1 126 ILE H . . 5.000 2.742 2.573 2.871 . 0 0 "[ . 1 . 2 . ]" 1 864 1 125 THR HA 1 128 ASP H . . 5.000 3.996 3.875 4.084 . 0 0 "[ . 1 . 2 . ]" 1 865 1 125 THR HA 1 128 ASP HB2 . . 5.000 3.730 2.914 4.674 . 0 0 "[ . 1 . 2 . ]" 1 866 1 125 THR HA 1 128 ASP HB3 . . 5.000 3.604 2.908 4.514 . 0 0 "[ . 1 . 2 . ]" 1 867 1 125 THR MG 1 126 ILE MD . . 5.000 3.357 3.187 3.429 . 0 0 "[ . 1 . 2 . ]" 1 868 1 125 THR MG 1 126 ILE QG . . 5.000 2.220 2.079 2.463 . 0 0 "[ . 1 . 2 . ]" 1 869 1 125 THR O 1 129 ASN H . . 2.300 2.271 2.091 2.332 0.032 20 0 "[ . 1 . 2 . ]" 1 870 1 125 THR O 1 129 ASN N . . 3.300 3.197 3.039 3.282 . 0 0 "[ . 1 . 2 . ]" 1 871 1 126 ILE H 1 126 ILE MD . . 5.000 3.930 3.779 4.039 . 0 0 "[ . 1 . 2 . ]" 1 872 1 126 ILE H 1 127 ALA H . . 5.000 2.449 2.308 2.552 . 0 0 "[ . 1 . 2 . ]" 1 873 1 126 ILE HA 1 126 ILE QG . . 3.300 2.210 2.185 2.246 . 0 0 "[ . 1 . 2 . ]" 1 874 1 126 ILE HA 1 129 ASN H . . 3.300 3.159 2.851 3.334 0.034 18 0 "[ . 1 . 2 . ]" 1 875 1 126 ILE HB 1 126 ILE MD . . 3.300 2.295 2.203 2.363 . 0 0 "[ . 1 . 2 . ]" 1 876 1 126 ILE HB 1 127 ALA H . . 3.300 2.620 2.496 2.792 . 0 0 "[ . 1 . 2 . ]" 1 877 1 126 ILE QG 1 126 ILE MG . . 3.300 2.402 2.322 2.449 . 0 0 "[ . 1 . 2 . ]" 1 878 1 126 ILE MG 1 127 ALA H . . 3.300 2.476 2.196 2.591 . 0 0 "[ . 1 . 2 . ]" 1 879 1 126 ILE MG 1 127 ALA HA . . 5.000 2.923 2.777 3.048 . 0 0 "[ . 1 . 2 . ]" 1 880 1 126 ILE O 1 130 ILE H . . 2.300 1.506 1.407 1.573 . 0 0 "[ . 1 . 2 . ]" 1 881 1 126 ILE O 1 130 ILE N . . 3.300 2.480 2.401 2.545 . 0 0 "[ . 1 . 2 . ]" 1 882 1 127 ALA H 1 127 ALA MB . . 2.900 2.106 2.001 2.183 . 0 0 "[ . 1 . 2 . ]" 1 883 1 127 ALA H 1 128 ASP H . . 3.300 2.859 2.753 2.922 . 0 0 "[ . 1 . 2 . ]" 1 884 1 127 ALA HA 1 130 ILE H . . 5.000 4.004 3.788 4.171 . 0 0 "[ . 1 . 2 . ]" 1 885 1 128 ASP H 1 129 ASN H . . 2.900 2.509 2.395 2.642 . 0 0 "[ . 1 . 2 . ]" 1 886 1 128 ASP HA 1 131 ALA H . . 5.000 3.304 2.973 3.495 . 0 0 "[ . 1 . 2 . ]" 1 887 1 128 ASP HA 1 131 ALA MB . . 3.300 2.455 2.170 2.695 . 0 0 "[ . 1 . 2 . ]" 1 888 1 129 ASN H 1 129 ASN QB . . 3.680 2.170 2.027 2.331 . 0 0 "[ . 1 . 2 . ]" 1 889 1 129 ASN H 1 130 ILE H . . 3.300 2.850 2.721 2.945 . 0 0 "[ . 1 . 2 . ]" 1 890 1 129 ASN HA 1 132 ASP QB . . 4.180 2.661 2.189 3.597 . 0 0 "[ . 1 . 2 . ]" 1 891 1 129 ASN HB2 1 130 ILE H . . 5.000 3.266 2.638 3.919 . 0 0 "[ . 1 . 2 . ]" 1 892 1 129 ASN HB3 1 130 ILE H . . 5.000 2.814 2.319 3.478 . 0 0 "[ . 1 . 2 . ]" 1 893 1 130 ILE H 1 130 ILE HB . . 2.900 2.304 2.179 2.458 . 0 0 "[ . 1 . 2 . ]" 1 894 1 130 ILE H 1 130 ILE MG . . 3.300 2.266 2.036 2.485 . 0 0 "[ . 1 . 2 . ]" 1 895 1 130 ILE H 1 131 ALA H . . 5.000 2.641 2.306 2.735 . 0 0 "[ . 1 . 2 . ]" 1 896 1 130 ILE MD 1 130 ILE MG . . 3.300 1.874 1.837 1.949 . 0 0 "[ . 1 . 2 . ]" 1 897 1 130 ILE MG 1 131 ALA HA . . 5.000 3.407 3.212 3.566 . 0 0 "[ . 1 . 2 . ]" 1 898 1 130 ILE MG 1 134 LEU HG . . 5.000 3.803 2.967 4.050 . 0 0 "[ . 1 . 2 . ]" 1 899 1 131 ALA H 1 132 ASP H . . 3.300 2.575 2.464 2.768 . 0 0 "[ . 1 . 2 . ]" 1 900 1 131 ALA H 1 134 LEU QB . . 5.880 4.824 4.426 4.999 . 0 0 "[ . 1 . 2 . ]" 1 901 1 131 ALA HA 1 132 ASP H . . 3.300 3.287 3.063 3.416 0.116 13 0 "[ . 1 . 2 . ]" 1 902 1 131 ALA HA 1 134 LEU H . . 5.000 3.025 2.760 3.525 . 0 0 "[ . 1 . 2 . ]" 1 903 1 131 ALA HA 1 134 LEU HB2 . . 5.000 2.202 1.941 2.451 . 0 0 "[ . 1 . 2 . ]" 1 904 1 131 ALA HA 1 134 LEU HB3 . . 5.000 3.707 3.418 3.977 . 0 0 "[ . 1 . 2 . ]" 1 905 1 131 ALA HA 1 134 LEU MD1 . . 3.300 2.081 1.844 2.342 . 0 0 "[ . 1 . 2 . ]" 1 906 1 131 ALA HA 1 134 LEU MD2 . . 5.000 4.102 3.824 4.310 . 0 0 "[ . 1 . 2 . ]" 1 907 1 132 ASP H 1 133 TYR H . . 3.300 2.342 2.201 2.619 . 0 0 "[ . 1 . 2 . ]" 1 908 1 133 TYR H 1 133 TYR QD . . 3.300 2.720 2.234 2.978 . 0 0 "[ . 1 . 2 . ]" 1 909 1 133 TYR H 1 134 LEU H . . 3.300 2.284 1.942 2.908 . 0 0 "[ . 1 . 2 . ]" 1 910 1 133 TYR QD 1 134 LEU H . . 5.000 3.645 3.175 4.155 . 0 0 "[ . 1 . 2 . ]" 1 911 1 133 TYR QD 1 134 LEU HG . . 5.000 3.941 3.411 4.629 . 0 0 "[ . 1 . 2 . ]" 1 912 1 134 LEU H 1 134 LEU MD1 . . 5.000 3.664 3.333 4.049 . 0 0 "[ . 1 . 2 . ]" 1 913 1 134 LEU H 1 135 ASN H . . 3.300 3.184 2.816 3.311 0.011 25 0 "[ . 1 . 2 . ]" 1 914 1 134 LEU HA 1 134 LEU MD2 . . 2.900 2.059 1.896 2.314 . 0 0 "[ . 1 . 2 . ]" 1 915 1 134 LEU HB2 1 134 LEU MD1 . . 3.300 2.271 2.128 2.475 . 0 0 "[ . 1 . 2 . ]" 1 916 1 134 LEU HB3 1 134 LEU MD1 . . 3.300 2.394 2.186 2.520 . 0 0 "[ . 1 . 2 . ]" 1 917 1 134 LEU MD1 1 135 ASN H . . 5.000 3.958 3.754 4.099 . 0 0 "[ . 1 . 2 . ]" 1 918 1 135 ASN H 1 135 ASN HA . . 2.900 2.431 2.167 2.886 . 0 0 "[ . 1 . 2 . ]" 1 919 1 135 ASN H 1 136 GLU H . . 3.300 2.956 1.908 3.330 0.030 12 0 "[ . 1 . 2 . ]" 1 920 1 136 GLU H 1 137 ASN H . . 3.300 2.943 2.174 3.301 0.001 5 0 "[ . 1 . 2 . ]" 1 921 1 136 GLU HA 1 137 ASN H . . 2.900 2.565 2.275 2.973 0.073 25 0 "[ . 1 . 2 . ]" 1 922 1 137 ASN H 1 137 ASN HA . . 2.900 2.575 2.167 2.915 0.015 20 0 "[ . 1 . 2 . ]" 1 923 1 137 ASN H 1 137 ASN QB . . 3.500 2.710 2.073 3.338 . 0 0 "[ . 1 . 2 . ]" 1 stop_ save_
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