NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
593773 | 2mvg | 25266 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mvg 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 1136 _Distance_constraint_stats_list.Viol_count 1134 _Distance_constraint_stats_list.Viol_total 1664.867 _Distance_constraint_stats_list.Viol_max 0.873 _Distance_constraint_stats_list.Viol_rms 0.0574 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0147 _Distance_constraint_stats_list.Viol_average_violations_only 0.1468 _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 2 SER 0.000 0.000 . 0 "[ . 1]" 1 3 ILE 1.561 0.357 3 0 "[ . 1]" 1 4 GLY 1.306 0.357 3 0 "[ . 1]" 1 5 LEU 2.792 0.432 9 0 "[ . 1]" 1 6 VAL 3.110 0.432 9 0 "[ . 1]" 1 7 GLU 0.496 0.211 5 0 "[ . 1]" 1 8 ARG 0.302 0.145 8 0 "[ . 1]" 1 9 THR 1.035 0.209 5 0 "[ . 1]" 1 10 ASN 1.414 0.209 5 0 "[ . 1]" 1 11 ALA 0.644 0.199 4 0 "[ . 1]" 1 12 ALA 0.037 0.037 1 0 "[ . 1]" 1 13 LEU 2.093 0.342 2 0 "[ . 1]" 1 14 GLU 0.000 0.000 . 0 "[ . 1]" 1 15 SER 0.790 0.215 5 0 "[ . 1]" 1 16 SER 0.000 0.000 . 0 "[ . 1]" 1 17 SER 2.038 0.431 4 0 "[ . 1]" 1 18 LYS 3.338 0.395 7 0 "[ . 1]" 1 19 ASP 2.451 0.350 3 0 "[ . 1]" 1 20 LEU 3.441 0.434 9 0 "[ . 1]" 1 21 LYS 3.861 0.431 4 0 "[ . 1]" 1 22 ASN 0.902 0.274 10 0 "[ . 1]" 1 23 LYS 0.330 0.121 1 0 "[ . 1]" 1 24 ILE 11.091 0.418 10 0 "[ . 1]" 1 25 LEU 5.706 0.449 2 0 "[ . 1]" 1 26 LYS 1.414 0.187 8 0 "[ . 1]" 1 27 ILE 4.892 0.372 9 0 "[ . 1]" 1 28 LYS 4.310 0.418 10 0 "[ . 1]" 1 29 LYS 0.776 0.163 10 0 "[ . 1]" 1 30 GLU 4.186 0.795 7 1 "[ . + 1]" 1 31 ALA 4.659 0.795 7 1 "[ . + 1]" 1 32 THR 1.414 0.198 5 0 "[ . 1]" 1 33 GLY 0.000 0.000 . 0 "[ . 1]" 1 34 LYS 0.846 0.426 9 0 "[ . 1]" 1 35 GLY 0.426 0.195 8 0 "[ . 1]" 1 36 VAL 0.620 0.195 8 0 "[ . 1]" 1 37 LEU 0.040 0.040 9 0 "[ . 1]" 1 38 PHE 0.416 0.198 5 0 "[ . 1]" 1 39 GLU 0.509 0.190 5 0 "[ . 1]" 1 40 ALA 1.058 0.232 10 0 "[ . 1]" 1 41 PHE 0.860 0.232 10 0 "[ . 1]" 1 42 THR 0.248 0.107 2 0 "[ . 1]" 1 43 GLY 0.831 0.228 10 0 "[ . 1]" 1 44 LEU 2.916 0.328 7 0 "[ . 1]" 1 45 LYS 0.783 0.306 1 0 "[ . 1]" 1 46 THR 1.021 0.228 10 0 "[ . 1]" 1 47 GLY 1.133 0.328 7 0 "[ . 1]" 1 49 LYS 0.000 0.000 . 0 "[ . 1]" 1 50 VAL 0.164 0.160 7 0 "[ . 1]" 1 51 THR 0.189 0.160 7 0 "[ . 1]" 1 52 SER 0.000 0.000 . 0 "[ . 1]" 1 53 GLY 0.045 0.045 9 0 "[ . 1]" 1 54 GLY 1.124 0.347 3 0 "[ . 1]" 1 56 ALA 0.000 0.000 . 0 "[ . 1]" 1 57 LEU 4.383 0.347 3 0 "[ . 1]" 1 58 ARG 0.000 0.000 . 0 "[ . 1]" 1 59 GLU 0.000 0.000 . 0 "[ . 1]" 1 60 ALA 0.668 0.161 8 0 "[ . 1]" 1 61 LYS 1.872 0.231 1 0 "[ . 1]" 1 62 VAL 1.279 0.301 10 0 "[ . 1]" 1 63 GLN 1.730 0.595 4 1 "[ +. 1]" 1 64 ALA 1.368 0.364 7 0 "[ . 1]" 1 65 ILE 5.792 0.318 9 0 "[ . 1]" 1 66 VAL 0.595 0.190 5 0 "[ . 1]" 1 67 GLU 0.000 0.000 . 0 "[ . 1]" 1 68 THR 2.417 0.255 9 0 "[ . 1]" 1 69 GLY 1.148 0.308 7 0 "[ . 1]" 1 70 LYS 4.341 0.453 9 0 "[ . 1]" 1 71 PHE 5.028 0.453 9 0 "[ . 1]" 1 72 LEU 0.428 0.275 8 0 "[ . 1]" 1 73 LYS 2.777 0.375 4 0 "[ . 1]" 1 74 ILE 3.580 0.436 3 0 "[ . 1]" 1 75 ILE 2.453 0.275 8 0 "[ . 1]" 1 76 GLU 0.775 0.240 8 0 "[ . 1]" 1 77 GLU 0.262 0.136 10 0 "[ . 1]" 1 78 GLU 2.199 0.426 1 0 "[ . 1]" 1 79 ALA 1.966 0.281 10 0 "[ . 1]" 1 80 LEU 0.000 0.000 . 0 "[ . 1]" 1 81 LYS 2.291 0.447 1 0 "[ . 1]" 1 82 LEU 4.563 0.410 4 0 "[ . 1]" 1 83 LYS 2.039 0.335 2 0 "[ . 1]" 1 84 GLU 2.927 0.447 1 0 "[ . 1]" 1 85 THR 1.034 0.177 1 0 "[ . 1]" 1 86 GLY 1.958 0.393 2 0 "[ . 1]" 1 87 ASN 0.000 0.000 . 0 "[ . 1]" 1 88 SER 0.105 0.105 4 0 "[ . 1]" 1 89 GLY 0.447 0.195 6 0 "[ . 1]" 1 90 GLN 0.737 0.334 1 0 "[ . 1]" 1 91 PHE 7.827 0.789 10 1 "[ . +]" 1 92 LEU 1.144 0.338 5 0 "[ . 1]" 1 93 ALA 3.044 0.317 9 0 "[ . 1]" 1 94 MET 6.731 0.789 10 1 "[ . +]" 1 95 PHE 2.759 0.338 5 0 "[ . 1]" 1 96 ASP 5.601 0.317 9 0 "[ . 1]" 1 97 LEU 0.646 0.188 2 0 "[ . 1]" 1 98 MET 6.706 0.490 10 0 "[ . 1]" 1 99 LEU 2.030 0.312 5 0 "[ . 1]" 1 100 GLU 2.240 0.325 6 0 "[ . 1]" 1 101 VAL 3.773 0.434 9 0 "[ . 1]" 1 102 VAL 0.284 0.154 9 0 "[ . 1]" 1 103 GLU 0.162 0.102 1 0 "[ . 1]" 1 104 SER 1.962 0.323 4 0 "[ . 1]" 1 105 LEU 0.844 0.374 9 0 "[ . 1]" 1 106 GLU 0.775 0.180 7 0 "[ . 1]" 1 107 ASP 0.788 0.396 1 0 "[ . 1]" 1 108 VAL 2.429 0.396 1 0 "[ . 1]" 1 109 GLY 0.143 0.143 5 0 "[ . 1]" 1 110 ILE 0.775 0.180 7 0 "[ . 1]" 1 111 ILE 4.922 0.617 2 1 "[ + . 1]" 1 112 GLY 4.659 0.617 2 1 "[ + . 1]" 1 113 LEU 1.830 0.377 4 0 "[ . 1]" 1 114 LYS 1.519 0.385 10 0 "[ . 1]" 1 115 ALA 0.210 0.077 10 0 "[ . 1]" 1 116 ARG 2.178 0.291 9 0 "[ . 1]" 1 117 VAL 4.037 0.385 10 0 "[ . 1]" 1 118 LEU 0.086 0.086 10 0 "[ . 1]" 1 119 GLU 2.839 0.291 9 0 "[ . 1]" 1 120 GLU 4.383 0.446 8 0 "[ . 1]" 1 121 SER 5.214 0.497 2 0 "[ . 1]" 1 122 LYS 0.000 0.000 . 0 "[ . 1]" 1 123 ASN 0.000 0.000 . 0 "[ . 1]" 1 124 ASN 2.216 0.241 9 0 "[ . 1]" 1 125 PRO 1.703 0.241 9 0 "[ . 1]" 1 126 ILE 11.875 0.524 3 1 "[ + . 1]" 1 127 ASN 1.866 0.337 8 0 "[ . 1]" 1 128 THR 3.510 0.422 3 0 "[ . 1]" 1 129 ALA 8.199 0.451 3 0 "[ . 1]" 1 130 GLU 0.655 0.183 7 0 "[ . 1]" 1 131 ARG 3.673 0.873 6 1 "[ .+ 1]" 1 132 LEU 3.909 0.873 6 2 "[ - .+ 1]" 1 133 LEU 1.713 0.281 10 0 "[ . 1]" 1 134 ALA 1.232 0.451 3 0 "[ . 1]" 1 135 ALA 2.823 0.349 3 0 "[ . 1]" 1 136 LYS 1.525 0.259 9 0 "[ . 1]" 1 137 ALA 0.766 0.274 5 0 "[ . 1]" 1 138 GLN 1.364 0.568 9 1 "[ . +1]" 1 139 ILE 5.729 0.362 5 0 "[ . 1]" 1 140 GLU 0.917 0.278 7 0 "[ . 1]" 1 141 ASN 0.000 0.000 . 0 "[ . 1]" 1 142 GLN 1.978 0.377 4 0 "[ . 1]" 1 143 LEU 0.000 0.000 . 0 "[ . 1]" 1 144 LYS 0.966 0.246 3 0 "[ . 1]" 1 145 VAL 1.074 0.200 10 0 "[ . 1]" 1 146 VAL 0.000 0.000 . 0 "[ . 1]" 1 147 LYS 1.767 0.224 10 0 "[ . 1]" 1 148 GLU 1.579 0.262 2 0 "[ . 1]" 1 149 LYS 2.038 0.262 2 0 "[ . 1]" 1 150 GLN 0.505 0.295 2 0 "[ . 1]" 1 151 ASN 0.633 0.198 2 0 "[ . 1]" 1 152 ILE 2.685 0.344 9 0 "[ . 1]" 1 153 GLU 2.164 0.344 9 0 "[ . 1]" 1 154 ASN 0.000 0.000 . 0 "[ . 1]" 1 157 GLU 1.157 0.342 8 0 "[ . 1]" 1 158 LYS 0.000 0.000 . 0 "[ . 1]" 1 159 LYS 0.026 0.026 5 0 "[ . 1]" 1 160 ASN 0.026 0.026 5 0 "[ . 1]" 1 163 SER 0.000 0.000 . 0 "[ . 1]" 1 164 LYS 0.415 0.415 3 0 "[ . 1]" 1 165 LYS 0.000 0.000 . 0 "[ . 1]" 1 166 LYS 0.105 0.047 8 0 "[ . 1]" 1 167 LYS 0.105 0.047 8 0 "[ . 1]" 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 53 GLY QA 1 57 LEU QB 3.940 . 3.940 3.313 2.301 3.985 0.045 9 0 "[ . 1]" 1 2 1 4 GLY QA 1 5 LEU H 3.510 . 3.510 2.818 2.636 2.910 . 0 0 "[ . 1]" 1 3 1 4 GLY QA 1 5 LEU HB3 5.980 . 5.980 5.388 5.032 5.670 . 0 0 "[ . 1]" 1 4 1 8 ARG QD 1 9 THR H 5.670 . 5.670 4.709 2.413 5.815 0.145 8 0 "[ . 1]" 1 5 1 116 ARG QD 1 117 VAL H 6.000 . 6.000 4.897 4.071 5.422 . 0 0 "[ . 1]" 1 6 1 116 ARG H 1 116 ARG QD 4.480 . 4.480 4.585 4.390 4.704 0.224 2 0 "[ . 1]" 1 7 1 131 ARG QD 1 132 LEU HA 5.000 . 5.000 4.803 3.927 5.873 0.873 6 1 "[ .+ 1]" 1 8 1 128 THR MG 1 131 ARG QD 4.230 . 4.230 3.131 2.146 4.175 . 0 0 "[ . 1]" 1 9 1 118 LEU QB 1 119 GLU H 4.370 . 4.370 2.674 2.472 2.843 . 0 0 "[ . 1]" 1 10 1 5 LEU H 1 5 LEU HB2 3.690 . 3.690 3.045 2.583 3.671 . 0 0 "[ . 1]" 1 11 1 18 LYS HA 1 21 LYS QE 3.820 . 3.820 2.817 2.341 3.355 . 0 0 "[ . 1]" 1 12 1 5 LEU HB2 1 6 VAL HA 4.440 . 4.440 4.523 3.936 4.872 0.432 9 0 "[ . 1]" 1 13 1 21 LYS QE 1 101 VAL HA 4.640 . 4.640 3.661 2.630 4.417 . 0 0 "[ . 1]" 1 14 1 136 LYS QB 1 136 LYS QE 4.090 . 4.090 3.001 2.159 3.725 . 0 0 "[ . 1]" 1 15 1 23 LYS QB 1 23 LYS QE 3.950 . 3.950 3.557 3.445 3.635 . 0 0 "[ . 1]" 1 16 1 70 LYS QB 1 70 LYS QE 4.140 . 4.140 3.196 2.109 3.737 . 0 0 "[ . 1]" 1 17 1 21 LYS QE 1 100 GLU QB 3.770 . 3.770 2.899 2.206 3.898 0.128 7 0 "[ . 1]" 1 18 1 122 LYS QB 1 122 LYS QE 2.900 . 2.900 2.204 2.074 2.358 . 0 0 "[ . 1]" 1 19 1 21 LYS QB 1 21 LYS QE 3.420 . 3.420 3.259 2.404 3.787 0.367 8 0 "[ . 1]" 1 20 1 99 LEU HB2 1 114 LYS QE 4.280 . 4.280 3.852 3.031 4.339 0.059 5 0 "[ . 1]" 1 21 1 21 LYS QE 1 21 LYS HG3 3.460 . 3.460 2.759 2.213 3.455 . 0 0 "[ . 1]" 1 22 1 21 LYS QE 1 21 LYS HG2 3.460 . 3.460 2.695 2.214 3.317 . 0 0 "[ . 1]" 1 23 1 111 ILE HB 1 112 GLY H 4.030 . 4.030 3.326 1.877 4.216 0.186 2 0 "[ . 1]" 1 24 1 19 ASP H 1 19 ASP HB2 3.650 . 3.650 2.442 2.254 2.556 . 0 0 "[ . 1]" 1 25 1 19 ASP H 1 19 ASP HB3 3.650 . 3.650 2.804 2.531 3.558 . 0 0 "[ . 1]" 1 26 1 111 ILE H 1 111 ILE HB 4.020 . 4.020 3.745 3.576 3.880 . 0 0 "[ . 1]" 1 27 1 107 ASP H 1 107 ASP HB3 4.110 . 4.110 3.278 2.499 3.595 . 0 0 "[ . 1]" 1 28 1 25 LEU H 1 25 LEU HB2 3.990 . 3.990 3.440 3.215 3.532 . 0 0 "[ . 1]" 1 29 1 107 ASP H 1 107 ASP HB2 4.110 . 4.110 2.562 2.386 3.592 . 0 0 "[ . 1]" 1 30 1 25 LEU H 1 25 LEU HB3 3.990 . 3.990 2.162 2.048 2.316 . 0 0 "[ . 1]" 1 31 1 17 SER HA 1 19 ASP HB2 5.570 . 5.570 5.317 3.957 5.783 0.213 2 0 "[ . 1]" 1 32 1 17 SER HA 1 19 ASP HB3 5.570 . 5.570 4.879 4.226 5.920 0.350 3 0 "[ . 1]" 1 33 1 96 ASP H 1 96 ASP HB2 4.150 . 4.150 2.502 2.333 2.588 . 0 0 "[ . 1]" 1 34 1 96 ASP H 1 96 ASP HB3 4.150 . 4.150 2.782 2.559 3.591 . 0 0 "[ . 1]" 1 35 1 41 PHE H 1 41 PHE HB2 4.080 . 4.080 3.138 2.197 3.601 . 0 0 "[ . 1]" 1 36 1 41 PHE H 1 41 PHE HB3 4.080 . 4.080 3.417 2.466 4.033 . 0 0 "[ . 1]" 1 37 1 124 ASN H 1 124 ASN HB2 3.660 . 3.660 2.900 2.408 3.462 . 0 0 "[ . 1]" 1 38 1 124 ASN H 1 124 ASN HB3 3.660 . 3.660 3.235 2.513 3.876 0.216 3 0 "[ . 1]" 1 39 1 140 GLU H 1 140 GLU HG2 4.230 . 4.230 3.281 1.788 4.383 0.153 9 0 "[ . 1]" 1 40 1 140 GLU H 1 140 GLU HG3 4.230 . 4.230 2.907 1.819 4.508 0.278 7 0 "[ . 1]" 1 41 1 141 ASN H 1 141 ASN HB2 3.810 . 3.810 2.455 2.368 2.570 . 0 0 "[ . 1]" 1 42 1 141 ASN H 1 141 ASN HB3 3.810 . 3.810 3.587 3.578 3.611 . 0 0 "[ . 1]" 1 43 1 3 ILE H 1 3 ILE HB 4.070 . 4.070 3.139 2.497 3.850 . 0 0 "[ . 1]" 1 44 1 152 ILE HB 1 153 GLU H 4.320 . 4.320 3.800 2.110 4.508 0.188 8 0 "[ . 1]" 1 45 1 152 ILE H 1 152 ILE HB 3.800 . 3.800 3.184 2.668 3.584 . 0 0 "[ . 1]" 1 46 1 22 ASN H 1 22 ASN HB2 3.890 . 3.890 3.324 2.688 3.618 . 0 0 "[ . 1]" 1 47 1 22 ASN H 1 22 ASN HB3 3.890 . 3.890 2.537 2.174 2.944 . 0 0 "[ . 1]" 1 48 1 10 ASN QB 1 11 ALA HA 5.150 . 5.150 4.456 4.139 4.773 . 0 0 "[ . 1]" 1 49 1 140 GLU HA 1 140 GLU HG2 4.180 . 4.180 2.900 2.368 3.660 . 0 0 "[ . 1]" 1 50 1 140 GLU HA 1 140 GLU HG3 4.180 . 4.180 3.059 2.400 3.781 . 0 0 "[ . 1]" 1 51 1 84 GLU H 1 84 GLU QG 3.760 . 3.760 2.009 1.738 2.433 0.062 8 0 "[ . 1]" 1 52 1 30 GLU H 1 30 GLU QG 3.780 . 3.780 3.601 1.687 4.045 0.265 6 0 "[ . 1]" 1 53 1 153 GLU H 1 153 GLU QG 3.210 . 3.210 2.593 2.442 2.813 . 0 0 "[ . 1]" 1 54 1 148 GLU H 1 148 GLU QG 4.000 . 4.000 3.051 1.798 4.060 0.060 4 0 "[ . 1]" 1 55 1 30 GLU QG 1 31 ALA H 4.450 . 4.450 3.139 1.766 3.584 0.034 2 0 "[ . 1]" 1 56 1 77 GLU H 1 77 GLU HG2 3.750 . 3.750 2.742 1.789 3.678 0.011 4 0 "[ . 1]" 1 57 1 77 GLU H 1 77 GLU HG3 3.750 . 3.750 2.645 2.228 3.624 . 0 0 "[ . 1]" 1 58 1 100 GLU H 1 100 GLU QG 3.720 . 3.720 3.412 1.796 4.045 0.325 6 0 "[ . 1]" 1 59 1 120 GLU H 1 120 GLU QG 3.590 . 3.590 3.545 2.066 4.036 0.446 8 0 "[ . 1]" 1 60 1 74 ILE H 1 74 ILE HB 4.140 . 4.140 2.622 2.415 3.570 . 0 0 "[ . 1]" 1 61 1 84 GLU HA 1 84 GLU QG 3.380 . 3.380 2.773 2.364 3.290 . 0 0 "[ . 1]" 1 62 1 7 GLU HA 1 7 GLU QG 3.390 . 3.390 2.538 2.328 2.881 . 0 0 "[ . 1]" 1 63 1 39 GLU HA 1 39 GLU QG 3.110 . 3.110 2.573 2.334 3.300 0.190 5 0 "[ . 1]" 1 64 1 148 GLU HA 1 148 GLU QG 3.550 . 3.550 2.879 2.326 3.491 . 0 0 "[ . 1]" 1 65 1 30 GLU HA 1 30 GLU QG 3.760 . 3.760 2.648 2.337 3.321 . 0 0 "[ . 1]" 1 66 1 100 GLU HA 1 100 GLU QG 3.920 . 3.920 2.522 2.214 3.300 . 0 0 "[ . 1]" 1 67 1 130 GLU HA 1 130 GLU QG 3.720 . 3.720 2.752 2.312 3.333 . 0 0 "[ . 1]" 1 68 1 148 GLU QG 1 149 LYS QE 4.250 . 4.250 4.217 3.833 4.432 0.182 6 0 "[ . 1]" 1 69 1 81 LYS QE 1 84 GLU QG 4.540 . 4.540 4.205 2.997 4.746 0.206 7 0 "[ . 1]" 1 70 1 24 ILE HB 1 28 LYS QD 4.440 . 4.440 4.505 4.031 4.680 0.240 3 0 "[ . 1]" 1 71 1 148 GLU QG 1 149 LYS QD 3.880 . 3.880 3.142 2.305 3.942 0.062 10 0 "[ . 1]" 1 72 1 81 LYS QD 1 84 GLU QG 4.450 . 4.450 4.210 2.884 4.751 0.301 6 0 "[ . 1]" 1 73 1 116 ARG QG 1 119 GLU QG 4.370 . 4.370 4.141 3.128 4.661 0.291 9 0 "[ . 1]" 1 74 1 30 GLU QG 1 31 ALA MB 3.750 . 3.750 3.910 2.784 4.545 0.795 7 1 "[ . + 1]" 1 75 1 81 LYS QG 1 84 GLU QG 4.320 . 4.320 3.773 2.848 4.180 . 0 0 "[ . 1]" 1 76 1 84 GLU QG 1 85 THR MG 4.290 . 4.290 3.950 2.331 4.451 0.161 5 0 "[ . 1]" 1 77 1 13 LEU MD2 1 78 GLU QG 5.010 . 5.010 3.028 2.316 4.738 . 0 0 "[ . 1]" 1 78 1 119 GLU H 1 119 GLU QG 3.800 . 3.800 2.539 1.764 4.027 0.227 6 0 "[ . 1]" 1 79 1 119 GLU QG 1 120 GLU H 3.920 . 3.920 3.314 2.204 4.122 0.202 1 0 "[ . 1]" 1 80 1 90 GLN H 1 90 GLN QG 4.240 . 4.240 3.641 2.087 4.068 . 0 0 "[ . 1]" 1 81 1 75 ILE H 1 75 ILE HB 4.200 . 4.200 2.536 2.442 2.607 . 0 0 "[ . 1]" 1 82 1 119 GLU HA 1 119 GLU QG 3.290 . 3.290 2.861 2.340 3.315 0.025 10 0 "[ . 1]" 1 83 1 119 GLU QG 1 122 LYS QB 4.710 . 4.710 4.092 3.567 4.511 . 0 0 "[ . 1]" 1 84 1 82 LEU MD1 1 90 GLN QG 4.280 . 4.280 2.392 1.960 3.572 . 0 0 "[ . 1]" 1 85 1 63 GLN H 1 63 GLN HG2 3.910 . 3.910 2.935 2.208 4.505 0.595 4 1 "[ +. 1]" 1 86 1 63 GLN H 1 63 GLN HG3 3.910 . 3.910 3.848 3.507 4.399 0.489 4 0 "[ . 1]" 1 87 1 138 GLN H 1 138 GLN HG2 3.780 . 3.780 3.498 2.612 4.348 0.568 9 1 "[ . +1]" 1 88 1 138 GLN H 1 138 GLN HG3 3.780 . 3.780 2.861 2.255 3.896 0.116 3 0 "[ . 1]" 1 89 1 63 GLN HA 1 63 GLN HG2 3.950 . 3.950 2.678 2.447 3.692 . 0 0 "[ . 1]" 1 90 1 63 GLN HA 1 63 GLN HG3 3.950 . 3.950 3.559 2.953 3.692 . 0 0 "[ . 1]" 1 91 1 75 ILE MG 1 98 MET HB3 5.910 . 5.910 5.322 4.821 5.675 . 0 0 "[ . 1]" 1 92 1 98 MET HB3 1 139 ILE MD 5.200 . 5.200 3.996 2.533 4.628 . 0 0 "[ . 1]" 1 93 1 83 LYS QB 1 84 GLU H 4.360 . 4.360 2.878 2.549 3.510 . 0 0 "[ . 1]" 1 94 1 23 LYS QB 1 24 ILE H 4.530 . 4.530 2.773 2.014 3.172 . 0 0 "[ . 1]" 1 95 1 147 LYS QB 1 148 GLU H 4.270 . 4.270 2.569 2.365 2.736 . 0 0 "[ . 1]" 1 96 1 165 LYS QB 1 166 LYS H 4.920 . 4.920 3.485 2.580 4.052 . 0 0 "[ . 1]" 1 97 1 126 ILE H 1 126 ILE HB 4.070 . 4.070 2.615 2.188 3.629 . 0 0 "[ . 1]" 1 98 1 23 LYS H 1 23 LYS QB 3.480 . 3.480 2.210 2.084 2.299 . 0 0 "[ . 1]" 1 99 1 29 LYS H 1 29 LYS QB 3.810 . 3.810 2.367 2.209 2.546 . 0 0 "[ . 1]" 1 100 1 144 LYS H 1 144 LYS QB 3.610 . 3.610 2.334 2.243 2.490 . 0 0 "[ . 1]" 1 101 1 21 LYS H 1 21 LYS QB 3.860 . 3.860 2.599 2.224 2.978 . 0 0 "[ . 1]" 1 102 1 18 LYS QB 1 19 ASP H 3.990 . 3.990 3.152 2.739 3.692 . 0 0 "[ . 1]" 1 103 1 122 LYS QB 1 123 ASN H 4.030 . 4.030 2.606 2.382 2.962 . 0 0 "[ . 1]" 1 104 1 21 LYS QB 1 22 ASN H 4.080 . 4.080 2.719 2.351 3.444 . 0 0 "[ . 1]" 1 105 1 81 LYS H 1 81 LYS QB 3.500 . 3.500 2.219 2.149 2.295 . 0 0 "[ . 1]" 1 106 1 26 LYS H 1 26 LYS QB 3.660 . 3.660 2.277 2.149 2.340 . 0 0 "[ . 1]" 1 107 1 18 LYS H 1 18 LYS QB 3.380 . 3.380 2.412 2.234 2.598 . 0 0 "[ . 1]" 1 108 1 121 SER H 1 122 LYS QB 4.690 . 4.690 4.342 4.183 4.636 . 0 0 "[ . 1]" 1 109 1 145 VAL HB 1 146 VAL H 4.340 . 4.340 2.513 2.265 3.030 . 0 0 "[ . 1]" 1 110 1 70 LYS QB 1 71 PHE H 4.540 . 4.540 2.671 2.369 3.386 . 0 0 "[ . 1]" 1 111 1 73 LYS H 1 73 LYS QB 3.810 . 3.810 2.291 2.199 2.337 . 0 0 "[ . 1]" 1 112 1 122 LYS H 1 122 LYS QB 3.710 . 3.710 2.260 2.204 2.401 . 0 0 "[ . 1]" 1 113 1 145 VAL H 1 145 VAL HB 4.010 . 4.010 2.440 2.297 2.699 . 0 0 "[ . 1]" 1 114 1 73 LYS QB 1 74 ILE H 4.350 . 4.350 3.010 2.857 3.097 . 0 0 "[ . 1]" 1 115 1 29 LYS QB 1 32 THR HB 4.980 . 4.980 4.480 3.696 5.143 0.163 10 0 "[ . 1]" 1 116 1 119 GLU HA 1 122 LYS QB 3.310 . 3.310 2.250 2.086 2.429 . 0 0 "[ . 1]" 1 117 1 24 ILE HA 1 28 LYS QB 5.710 . 5.710 5.692 4.993 6.128 0.418 10 0 "[ . 1]" 1 118 1 26 LYS QB 1 26 LYS QE 4.410 . 4.410 3.405 2.186 3.813 . 0 0 "[ . 1]" 1 119 1 144 LYS QB 1 144 LYS QE 3.670 . 3.670 2.868 2.130 3.630 . 0 0 "[ . 1]" 1 120 1 18 LYS QB 1 21 LYS QE 4.330 . 4.330 4.310 3.534 4.552 0.222 1 0 "[ . 1]" 1 121 1 144 LYS QB 1 144 LYS QD 2.790 . 2.790 2.200 2.124 2.296 . 0 0 "[ . 1]" 1 122 1 83 LYS QB 1 129 ALA MB 4.470 . 4.470 3.227 2.040 3.870 . 0 0 "[ . 1]" 1 123 1 98 MET QG 1 139 ILE MD 3.650 . 3.650 3.435 2.657 3.913 0.263 10 0 "[ . 1]" 1 124 1 75 ILE MD 1 98 MET QG 4.240 . 4.240 3.728 3.007 4.434 0.194 8 0 "[ . 1]" 1 125 1 62 VAL HB 1 63 GLN H 4.120 . 4.120 2.859 2.457 4.030 . 0 0 "[ . 1]" 1 126 1 117 VAL HB 1 118 LEU H 4.560 . 4.560 3.726 3.031 4.078 . 0 0 "[ . 1]" 1 127 1 8 ARG H 1 8 ARG HB2 4.110 . 4.110 3.033 2.410 3.587 . 0 0 "[ . 1]" 1 128 1 117 VAL H 1 117 VAL HB 3.530 . 3.530 2.301 2.185 2.404 . 0 0 "[ . 1]" 1 129 1 142 GLN HA 1 145 VAL HB 4.260 . 4.260 2.693 2.232 3.227 . 0 0 "[ . 1]" 1 130 1 63 GLN HA 1 66 VAL HB 4.250 . 4.250 2.982 2.759 3.290 . 0 0 "[ . 1]" 1 131 1 114 LYS HA 1 117 VAL HB 4.050 . 4.050 3.195 2.522 4.435 0.385 10 0 "[ . 1]" 1 132 1 116 ARG QB 1 117 VAL HB 4.950 . 4.950 4.126 3.838 4.855 . 0 0 "[ . 1]" 1 133 1 62 VAL HB 1 147 LYS QG 5.240 . 5.240 4.915 4.296 5.342 0.102 9 0 "[ . 1]" 1 134 1 61 LYS QD 1 108 VAL HB 4.130 . 4.130 3.387 2.269 4.278 0.148 1 0 "[ . 1]" 1 135 1 31 ALA MB 1 36 VAL HB 4.200 . 4.200 3.186 2.341 4.326 0.126 9 0 "[ . 1]" 1 136 1 84 GLU H 1 84 GLU HB2 4.160 . 4.160 2.732 2.431 3.541 . 0 0 "[ . 1]" 1 137 1 84 GLU H 1 84 GLU HB3 4.160 . 4.160 3.469 2.944 3.640 . 0 0 "[ . 1]" 1 138 1 130 GLU H 1 130 GLU HB2 3.880 . 3.880 2.776 2.353 3.628 . 0 0 "[ . 1]" 1 139 1 130 GLU H 1 130 GLU HB3 3.880 . 3.880 2.731 2.470 3.046 . 0 0 "[ . 1]" 1 140 1 30 GLU H 1 30 GLU QB 3.840 . 3.840 2.297 2.230 2.804 . 0 0 "[ . 1]" 1 141 1 24 ILE H 1 24 ILE QG . . 3.940 3.166 1.826 3.398 . 0 0 "[ . 1]" 1 142 1 153 GLU H 1 157 GLU QB 3.790 . 3.790 3.763 2.630 4.132 0.342 8 0 "[ . 1]" 1 143 1 7 GLU H 1 7 GLU QB 3.450 . 3.450 2.503 2.350 3.278 . 0 0 "[ . 1]" 1 144 1 164 LYS H 1 164 LYS QD 3.880 . 3.880 3.787 3.630 4.295 0.415 3 0 "[ . 1]" 1 145 1 148 GLU H 1 148 GLU QB 3.840 . 3.840 2.357 2.153 2.625 . 0 0 "[ . 1]" 1 146 1 77 GLU H 1 77 GLU HB3 4.100 . 4.100 3.262 2.717 3.608 . 0 0 "[ . 1]" 1 147 1 116 ARG QB 1 117 VAL H 4.370 . 4.370 2.593 2.146 2.889 . 0 0 "[ . 1]" 1 148 1 139 ILE H 1 139 ILE QG 3.660 . 3.660 2.039 1.887 2.242 . 0 0 "[ . 1]" 1 149 1 119 GLU H 1 120 GLU QB 4.590 . 4.590 4.445 4.226 4.775 0.185 10 0 "[ . 1]" 1 150 1 120 GLU H 1 120 GLU QB 3.340 . 3.340 2.241 2.128 2.453 . 0 0 "[ . 1]" 1 151 1 100 GLU QB 1 101 VAL H 4.110 . 4.110 2.601 2.222 3.547 . 0 0 "[ . 1]" 1 152 1 100 GLU H 1 100 GLU QB 3.670 . 3.670 2.246 2.070 2.568 . 0 0 "[ . 1]" 1 153 1 149 LYS H 1 149 LYS QD 3.590 . 3.590 2.704 2.075 3.292 . 0 0 "[ . 1]" 1 154 1 45 LYS HA 1 45 LYS QD 4.000 . 4.000 3.655 2.167 4.238 0.238 10 0 "[ . 1]" 1 155 1 165 LYS HA 1 165 LYS QD 4.810 . 4.810 3.812 2.190 4.412 . 0 0 "[ . 1]" 1 156 1 25 LEU HA 1 28 LYS QD 3.030 . 3.030 2.666 2.303 3.229 0.199 4 0 "[ . 1]" 1 157 1 149 LYS HA 1 149 LYS QD 3.230 . 3.230 2.311 2.163 2.410 . 0 0 "[ . 1]" 1 158 1 21 LYS QD 1 100 GLU QB 4.340 . 4.340 4.093 2.893 4.454 0.114 6 0 "[ . 1]" 1 159 1 20 LEU HB2 1 21 LYS QD 4.110 . 4.110 3.738 3.415 4.201 0.091 2 0 "[ . 1]" 1 160 1 131 ARG QB 1 134 ALA MB 4.930 . 4.930 3.742 3.344 4.332 . 0 0 "[ . 1]" 1 161 1 62 VAL MG2 1 65 ILE QG 4.840 . 4.840 4.566 3.562 4.906 0.066 4 0 "[ . 1]" 1 162 1 152 ILE MG 1 153 GLU QB 4.610 . 4.610 4.158 2.601 4.954 0.344 9 0 "[ . 1]" 1 163 1 13 LEU MD2 1 78 GLU QB 4.190 . 4.190 3.430 2.843 4.016 . 0 0 "[ . 1]" 1 164 1 133 LEU H 1 133 LEU HG 4.200 . 4.200 3.294 1.798 4.431 0.231 7 0 "[ . 1]" 1 165 1 138 GLN H 1 138 GLN QB 3.820 . 3.820 2.294 2.026 2.397 . 0 0 "[ . 1]" 1 166 1 113 LEU H 1 113 LEU HG 5.080 . 5.080 2.584 1.706 4.766 0.094 1 0 "[ . 1]" 1 167 1 132 LEU MD2 1 134 ALA H 5.320 . 5.320 5.144 4.540 5.771 0.451 3 0 "[ . 1]" 1 168 1 71 PHE QD 1 74 ILE QG 4.750 . 4.750 4.074 2.579 4.464 . 0 0 "[ . 1]" 1 169 1 113 LEU HA 1 113 LEU HG 3.860 . 3.860 3.358 2.394 3.621 . 0 0 "[ . 1]" 1 170 1 132 LEU HA 1 132 LEU MD2 3.860 . 3.860 2.912 2.077 3.894 0.034 5 0 "[ . 1]" 1 171 1 135 ALA MB 1 138 GLN QB 4.270 . 4.270 4.238 4.110 4.429 0.159 3 0 "[ . 1]" 1 172 1 27 ILE MG 1 63 GLN HB3 4.010 . 4.010 2.958 2.313 3.542 . 0 0 "[ . 1]" 1 173 1 27 ILE MG 1 63 GLN HB2 4.010 . 4.010 2.828 2.293 3.666 . 0 0 "[ . 1]" 1 174 1 27 ILE MD 1 63 GLN HB2 4.380 . 4.380 3.391 2.407 4.143 . 0 0 "[ . 1]" 1 175 1 126 ILE MG 1 132 LEU MD2 3.950 . 3.950 2.855 1.787 4.092 0.142 5 0 "[ . 1]" 1 176 1 118 LEU H 1 118 LEU HG 4.250 . 4.250 3.202 1.885 4.336 0.086 10 0 "[ . 1]" 1 177 1 20 LEU MD2 1 21 LYS H 4.930 . 4.930 3.854 2.796 4.726 . 0 0 "[ . 1]" 1 178 1 99 LEU H 1 99 LEU HG 4.100 . 4.100 2.425 2.077 3.739 . 0 0 "[ . 1]" 1 179 1 57 LEU HG 1 61 LYS H 4.570 . 4.570 4.657 4.446 4.801 0.231 1 0 "[ . 1]" 1 180 1 8 ARG QG 1 9 THR H 4.720 . 4.720 3.754 2.703 4.324 . 0 0 "[ . 1]" 1 181 1 37 LEU H 1 37 LEU HG 3.760 . 3.760 2.422 1.928 3.274 . 0 0 "[ . 1]" 1 182 1 111 ILE H 1 111 ILE QG 4.150 . 4.150 2.287 1.825 3.215 . 0 0 "[ . 1]" 1 183 1 25 LEU H 1 25 LEU HG 3.770 . 3.770 3.858 2.462 4.201 0.431 7 0 "[ . 1]" 1 184 1 20 LEU H 1 20 LEU MD2 5.070 . 5.070 3.892 3.202 4.262 . 0 0 "[ . 1]" 1 185 1 116 ARG H 1 116 ARG QG 4.220 . 4.220 3.955 3.923 3.998 . 0 0 "[ . 1]" 1 186 1 37 LEU HA 1 37 LEU HG 4.030 . 4.030 3.044 2.424 3.256 . 0 0 "[ . 1]" 1 187 1 8 ARG HA 1 8 ARG QG 3.760 . 3.760 2.471 2.315 3.061 . 0 0 "[ . 1]" 1 188 1 97 LEU HA 1 97 LEU HG 3.910 . 3.910 2.660 2.338 3.232 . 0 0 "[ . 1]" 1 189 1 116 ARG HA 1 116 ARG QG 3.460 . 3.460 2.299 2.275 2.338 . 0 0 "[ . 1]" 1 190 1 57 LEU HA 1 57 LEU HG 4.180 . 4.180 2.816 2.363 3.216 . 0 0 "[ . 1]" 1 191 1 89 GLY QA 1 92 LEU HG 4.850 . 4.850 4.112 2.530 5.045 0.195 6 0 "[ . 1]" 1 192 1 115 ALA HA 1 118 LEU HG 5.490 . 5.490 3.919 2.350 5.077 . 0 0 "[ . 1]" 1 193 1 3 ILE HA 1 3 ILE QG . . 3.620 2.867 2.432 3.316 . 0 0 "[ . 1]" 1 194 1 128 THR HA 1 131 ARG QG 4.890 . 4.890 4.798 4.345 5.209 0.319 4 0 "[ . 1]" 1 195 1 82 LEU HG 1 90 GLN QG 4.220 . 4.220 4.129 3.506 4.554 0.334 1 0 "[ . 1]" 1 196 1 57 LEU HG 1 61 LYS QG 3.780 . 3.780 3.506 2.664 3.893 0.113 8 0 "[ . 1]" 1 197 1 20 LEU MD2 1 68 THR MG 3.300 . 3.300 2.730 2.178 3.435 0.135 3 0 "[ . 1]" 1 198 1 133 LEU H 1 133 LEU MD1 4.460 . 4.460 3.083 1.788 3.771 0.012 4 0 "[ . 1]" 1 199 1 13 LEU H 1 13 LEU MD2 4.640 . 4.640 4.752 4.473 4.982 0.342 2 0 "[ . 1]" 1 200 1 23 LYS H 1 23 LYS QG 4.110 . 4.110 3.991 3.237 4.095 . 0 0 "[ . 1]" 1 201 1 28 LYS QG 1 29 LYS H 4.060 . 4.060 3.634 2.056 4.177 0.117 6 0 "[ . 1]" 1 202 1 159 LYS QG 1 160 ASN H 4.750 . 4.750 3.475 1.774 4.238 0.026 5 0 "[ . 1]" 1 203 1 164 LYS H 1 164 LYS QG 4.790 . 4.790 2.101 1.808 2.405 . 0 0 "[ . 1]" 1 204 1 118 LEU H 1 118 LEU MD1 4.360 . 4.360 2.805 1.901 3.645 . 0 0 "[ . 1]" 1 205 1 99 LEU H 1 99 LEU MD1 4.550 . 4.550 3.627 3.528 4.053 . 0 0 "[ . 1]" 1 206 1 80 LEU H 1 80 LEU MD1 4.480 . 4.480 4.079 3.827 4.231 . 0 0 "[ . 1]" 1 207 1 113 LEU MD2 1 142 GLN H 6.000 . 6.000 5.627 4.760 6.377 0.377 4 0 "[ . 1]" 1 208 1 149 LYS H 1 149 LYS QG 4.270 . 4.270 3.152 1.859 3.918 . 0 0 "[ . 1]" 1 209 1 97 LEU H 1 97 LEU MD1 4.720 . 4.720 4.208 4.032 4.376 . 0 0 "[ . 1]" 1 210 1 26 LYS H 1 28 LYS QG 4.780 . 4.780 4.750 4.144 4.967 0.187 8 0 "[ . 1]" 1 211 1 18 LYS H 1 18 LYS QG 4.240 . 4.240 2.319 1.887 4.060 . 0 0 "[ . 1]" 1 212 1 113 LEU H 1 113 LEU MD1 4.820 . 4.820 3.368 1.833 4.960 0.140 5 0 "[ . 1]" 1 213 1 133 LEU MD1 1 134 ALA H 5.080 . 5.080 4.580 3.966 4.887 . 0 0 "[ . 1]" 1 214 1 25 LEU H 1 25 LEU MD1 4.430 . 4.430 3.704 2.014 4.355 . 0 0 "[ . 1]" 1 215 1 99 LEU MD1 1 100 GLU H 5.770 . 5.770 4.784 4.650 4.918 . 0 0 "[ . 1]" 1 216 1 113 LEU H 1 113 LEU MD2 4.820 . 4.820 3.061 1.793 5.000 0.180 10 0 "[ . 1]" 1 217 1 105 LEU H 1 105 LEU MD1 4.680 . 4.680 3.267 1.796 3.746 0.004 2 0 "[ . 1]" 1 218 1 70 LYS H 1 70 LYS QG 4.220 . 4.220 2.779 1.985 4.056 . 0 0 "[ . 1]" 1 219 1 82 LEU H 1 82 LEU MD2 4.730 . 4.730 3.153 1.772 4.312 0.028 9 0 "[ . 1]" 1 220 1 97 LEU HA 1 97 LEU MD1 3.860 . 3.860 2.874 2.130 3.731 . 0 0 "[ . 1]" 1 221 1 113 LEU HA 1 113 LEU MD1 4.660 . 4.660 3.656 2.256 4.126 . 0 0 "[ . 1]" 1 222 1 158 LYS HA 1 158 LYS QG 3.980 . 3.980 2.560 2.304 3.422 . 0 0 "[ . 1]" 1 223 1 92 LEU HA 1 92 LEU MD1 4.670 . 4.670 3.214 2.233 3.838 . 0 0 "[ . 1]" 1 224 1 92 LEU HA 1 92 LEU MD2 4.670 . 4.670 2.695 2.146 3.802 . 0 0 "[ . 1]" 1 225 1 82 LEU HA 1 82 LEU MD2 4.710 . 4.710 2.351 2.116 3.519 . 0 0 "[ . 1]" 1 226 1 113 LEU HA 1 113 LEU MD2 4.660 . 4.660 3.748 3.495 4.124 . 0 0 "[ . 1]" 1 227 1 80 LEU HA 1 80 LEU MD1 4.350 . 4.350 2.757 2.155 3.757 . 0 0 "[ . 1]" 1 228 1 105 LEU HA 1 105 LEU MD1 4.370 . 4.370 3.384 2.171 3.836 . 0 0 "[ . 1]" 1 229 1 17 SER HB2 1 97 LEU MD1 4.530 . 4.530 2.592 2.242 3.108 . 0 0 "[ . 1]" 1 230 1 23 LYS HA 1 23 LYS QG 3.590 . 3.590 2.655 2.325 2.801 . 0 0 "[ . 1]" 1 231 1 70 LYS HA 1 70 LYS QG 3.790 . 3.790 2.640 2.332 3.313 . 0 0 "[ . 1]" 1 232 1 25 LEU HA 1 25 LEU MD1 3.690 . 3.690 3.829 3.387 4.070 0.380 5 0 "[ . 1]" 1 233 1 21 LYS HA 1 21 LYS HG2 4.230 . 4.230 3.560 3.428 3.655 . 0 0 "[ . 1]" 1 234 1 17 SER HB3 1 97 LEU MD1 4.530 . 4.530 2.358 2.058 2.661 . 0 0 "[ . 1]" 1 235 1 21 LYS HA 1 21 LYS HG3 4.230 . 4.230 3.081 2.264 4.261 0.031 1 0 "[ . 1]" 1 236 1 130 GLU HA 1 133 LEU MD1 5.070 . 5.070 3.481 2.288 5.011 . 0 0 "[ . 1]" 1 237 1 13 LEU MD2 1 75 ILE HA 5.930 . 5.930 3.185 2.494 3.654 . 0 0 "[ . 1]" 1 238 1 149 LYS QE 1 149 LYS QG 3.200 . 3.200 2.302 2.124 2.460 . 0 0 "[ . 1]" 1 239 1 99 LEU MD1 1 114 LYS QE 4.880 . 4.880 3.295 2.316 3.880 . 0 0 "[ . 1]" 1 240 1 113 LEU MD1 1 145 VAL HB 5.570 . 5.570 5.106 4.103 5.753 0.183 1 0 "[ . 1]" 1 241 1 82 LEU MD2 1 90 GLN QG 4.280 . 4.280 3.046 2.257 4.264 . 0 0 "[ . 1]" 1 242 1 113 LEU MD2 1 145 VAL HB 5.570 . 5.570 4.618 2.714 5.428 . 0 0 "[ . 1]" 1 243 1 99 LEU HB2 1 99 LEU MD1 3.630 . 3.630 2.430 2.309 3.179 . 0 0 "[ . 1]" 1 244 1 62 VAL MG2 1 147 LYS QG 5.110 . 5.110 3.885 2.128 4.621 . 0 0 "[ . 1]" 1 245 1 61 LYS QG 1 108 VAL MG2 5.000 . 5.000 3.846 2.945 5.044 0.044 5 0 "[ . 1]" 1 246 1 9 THR HB 1 10 ASN H 4.190 . 4.190 3.629 1.961 4.399 0.209 5 0 "[ . 1]" 1 247 1 62 VAL MG2 1 63 GLN H 4.550 . 4.550 3.784 3.587 3.933 . 0 0 "[ . 1]" 1 248 1 118 LEU H 1 118 LEU MD2 4.360 . 4.360 3.557 2.954 4.234 . 0 0 "[ . 1]" 1 249 1 20 LEU MD1 1 23 LYS H 6.000 . 6.000 4.965 3.729 6.119 0.119 2 0 "[ . 1]" 1 250 1 44 LEU MD2 1 45 LYS H 5.860 . 5.860 3.783 2.737 4.794 . 0 0 "[ . 1]" 1 251 1 13 LEU H 1 13 LEU MD1 4.640 . 4.640 2.961 2.100 3.712 . 0 0 "[ . 1]" 1 252 1 9 THR H 1 9 THR HB 4.150 . 4.150 3.360 2.613 3.840 . 0 0 "[ . 1]" 1 253 1 62 VAL H 1 62 VAL MG2 4.400 . 4.400 2.283 1.855 3.787 . 0 0 "[ . 1]" 1 254 1 40 ALA H 1 44 LEU MD2 5.290 . 5.290 4.200 3.613 5.172 . 0 0 "[ . 1]" 1 255 1 97 LEU H 1 97 LEU MD2 4.720 . 4.720 4.242 4.077 4.357 . 0 0 "[ . 1]" 1 256 1 62 VAL MG2 1 150 GLN H 5.710 . 5.710 4.782 3.667 5.705 . 0 0 "[ . 1]" 1 257 1 25 LEU H 1 25 LEU MD2 4.430 . 4.430 2.885 2.332 4.113 . 0 0 "[ . 1]" 1 258 1 83 LYS H 1 83 LYS QG 3.960 . 3.960 3.466 2.136 3.961 0.001 8 0 "[ . 1]" 1 259 1 73 LYS H 1 73 LYS QG 4.120 . 4.120 3.052 2.380 4.062 . 0 0 "[ . 1]" 1 260 1 122 LYS H 1 122 LYS QG 4.290 . 4.290 3.592 2.143 3.960 . 0 0 "[ . 1]" 1 261 1 44 LEU HA 1 44 LEU MD2 3.390 . 3.390 3.530 3.413 3.644 0.254 2 0 "[ . 1]" 1 262 1 26 LYS HA 1 26 LYS QG 3.900 . 3.900 2.348 2.284 2.496 . 0 0 "[ . 1]" 1 263 1 17 SER HB2 1 97 LEU MD2 4.530 . 4.530 3.069 2.284 3.898 . 0 0 "[ . 1]" 1 264 1 25 LEU HA 1 25 LEU MD2 3.690 . 3.690 3.620 3.432 4.139 0.449 2 0 "[ . 1]" 1 265 1 130 GLU HA 1 133 LEU MD2 5.070 . 5.070 4.319 3.137 5.179 0.109 8 0 "[ . 1]" 1 266 1 13 LEU MD1 1 75 ILE HA 5.930 . 5.930 4.851 4.103 5.510 . 0 0 "[ . 1]" 1 267 1 62 VAL MG2 1 150 GLN HG2 4.760 . 4.760 3.398 2.298 4.488 . 0 0 "[ . 1]" 1 268 1 61 LYS QG 1 108 VAL HB 4.350 . 4.350 2.772 2.304 3.994 . 0 0 "[ . 1]" 1 269 1 13 LEU MD1 1 78 GLU QG 5.010 . 5.010 2.966 2.271 3.523 . 0 0 "[ . 1]" 1 270 1 13 LEU MD1 1 78 GLU QB 4.190 . 4.190 3.838 2.966 4.371 0.181 9 0 "[ . 1]" 1 271 1 62 VAL MG2 1 150 GLN HG3 4.760 . 4.760 3.093 2.222 4.820 0.060 3 0 "[ . 1]" 1 272 1 126 ILE MG 1 132 LEU MD1 3.950 . 3.950 2.840 2.002 4.192 0.242 9 0 "[ . 1]" 1 273 1 133 LEU H 1 133 LEU MD2 4.460 . 4.460 3.760 2.903 4.373 . 0 0 "[ . 1]" 1 274 1 66 VAL H 1 66 VAL MG2 4.380 . 4.380 1.910 1.806 2.019 . 0 0 "[ . 1]" 1 275 1 146 VAL MG1 1 147 LYS H 5.260 . 5.260 3.601 3.285 3.953 . 0 0 "[ . 1]" 1 276 1 146 VAL MG2 1 147 LYS H 5.260 . 5.260 3.172 2.024 4.015 . 0 0 "[ . 1]" 1 277 1 82 LEU MD1 1 86 GLY H 5.110 . 5.110 4.499 3.028 5.471 0.361 6 0 "[ . 1]" 1 278 1 102 VAL MG2 1 103 GLU H 4.590 . 4.590 3.210 2.578 3.954 . 0 0 "[ . 1]" 1 279 1 102 VAL H 1 102 VAL MG2 4.590 . 4.590 2.417 1.792 3.763 0.008 7 0 "[ . 1]" 1 280 1 102 VAL H 1 102 VAL MG1 4.590 . 4.590 2.320 1.796 3.743 0.004 6 0 "[ . 1]" 1 281 1 99 LEU H 1 99 LEU MD2 4.550 . 4.550 3.290 2.067 3.560 . 0 0 "[ . 1]" 1 282 1 80 LEU H 1 80 LEU MD2 4.480 . 4.480 4.101 3.231 4.379 . 0 0 "[ . 1]" 1 283 1 36 VAL MG2 1 37 LEU H 4.550 . 4.550 3.812 3.528 4.060 . 0 0 "[ . 1]" 1 284 1 101 VAL MG1 1 102 VAL H 4.780 . 4.780 3.499 1.776 4.046 0.024 4 0 "[ . 1]" 1 285 1 57 LEU H 1 57 LEU MD2 4.780 . 4.780 4.231 4.035 4.346 . 0 0 "[ . 1]" 1 286 1 146 VAL H 1 146 VAL MG1 4.600 . 4.600 3.056 1.933 3.774 . 0 0 "[ . 1]" 1 287 1 146 VAL H 1 146 VAL MG2 4.600 . 4.600 2.052 1.884 2.202 . 0 0 "[ . 1]" 1 288 1 99 LEU MD2 1 100 GLU H 5.770 . 5.770 4.624 4.022 4.744 . 0 0 "[ . 1]" 1 289 1 36 VAL H 1 36 VAL MG2 4.780 . 4.780 2.226 1.818 2.564 . 0 0 "[ . 1]" 1 290 1 101 VAL H 1 101 VAL MG1 4.460 . 4.460 2.166 1.763 3.759 0.037 4 0 "[ . 1]" 1 291 1 145 VAL H 1 145 VAL MG2 4.110 . 4.110 2.325 1.819 2.698 . 0 0 "[ . 1]" 1 292 1 105 LEU H 1 105 LEU MD2 4.680 . 4.680 2.971 1.800 3.954 . 9 0 "[ . 1]" 1 293 1 82 LEU H 1 82 LEU MD1 4.730 . 4.730 3.811 3.407 4.247 . 0 0 "[ . 1]" 1 294 1 32 THR HA 1 36 VAL MG2 5.300 . 5.300 3.651 2.127 4.643 . 0 0 "[ . 1]" 1 295 1 96 ASP HA 1 99 LEU MD2 5.770 . 5.770 4.979 4.012 5.301 . 0 0 "[ . 1]" 1 296 1 117 VAL HA 1 117 VAL MG2 3.540 . 3.540 2.247 2.211 2.307 . 0 0 "[ . 1]" 1 297 1 102 VAL HA 1 102 VAL MG2 3.670 . 3.670 2.881 2.337 3.207 . 0 0 "[ . 1]" 1 298 1 99 LEU MD2 1 114 LYS QE 4.880 . 4.880 2.905 2.264 4.583 . 0 0 "[ . 1]" 1 299 1 62 VAL MG1 1 65 ILE QG 4.840 . 4.840 4.115 3.440 5.045 0.205 2 0 "[ . 1]" 1 300 1 128 THR MG 1 131 ARG QG 3.570 . 3.570 3.334 2.091 3.950 0.380 7 0 "[ . 1]" 1 301 1 31 ALA MB 1 36 VAL MG2 4.080 . 4.080 2.474 2.198 3.117 . 0 0 "[ . 1]" 1 302 1 99 LEU HB2 1 99 LEU MD2 3.630 . 3.630 3.171 2.619 3.248 . 0 0 "[ . 1]" 1 303 1 82 LEU MD1 1 129 ALA MB 5.390 . 5.390 4.965 3.832 5.800 0.410 4 0 "[ . 1]" 1 304 1 32 THR H 1 32 THR MG 3.680 . 3.680 3.357 1.824 3.764 0.084 4 0 "[ . 1]" 1 305 1 84 GLU H 1 85 THR MG 4.790 . 4.790 3.889 3.455 4.200 . 0 0 "[ . 1]" 1 306 1 85 THR MG 1 86 GLY H 5.050 . 5.050 3.628 3.437 3.769 . 0 0 "[ . 1]" 1 307 1 9 THR MG 1 10 ASN H 4.760 . 4.760 3.121 2.044 4.303 . 0 0 "[ . 1]" 1 308 1 128 THR MG 1 130 GLU H 5.150 . 5.150 3.672 1.759 5.333 0.183 7 0 "[ . 1]" 1 309 1 62 VAL MG1 1 63 GLN H 4.550 . 4.550 3.501 2.208 3.908 . 0 0 "[ . 1]" 1 310 1 65 ILE H 1 68 THR MG 4.600 . 4.600 3.666 3.487 3.945 . 0 0 "[ . 1]" 1 311 1 68 THR MG 1 69 GLY H 5.060 . 5.060 3.733 3.575 3.930 . 0 0 "[ . 1]" 1 312 1 6 VAL MG2 1 7 GLU H 4.450 . 4.450 3.263 2.142 4.344 . 0 0 "[ . 1]" 1 313 1 68 THR H 1 68 THR MG 4.460 . 4.460 2.006 1.866 2.334 . 0 0 "[ . 1]" 1 314 1 64 ALA H 1 108 VAL MG1 5.560 . 5.560 5.273 4.335 5.698 0.138 8 0 "[ . 1]" 1 315 1 101 VAL MG2 1 102 VAL H 4.780 . 4.780 2.139 1.646 3.711 0.154 9 0 "[ . 1]" 1 316 1 62 VAL H 1 62 VAL MG1 4.400 . 4.400 3.584 1.826 3.795 . 0 0 "[ . 1]" 1 317 1 32 THR MG 1 33 GLY H 4.200 . 4.200 3.730 3.452 3.906 . 0 0 "[ . 1]" 1 318 1 50 VAL H 1 50 VAL MG2 4.770 . 4.770 2.947 1.796 4.018 0.004 1 0 "[ . 1]" 1 319 1 50 VAL H 1 50 VAL MG1 4.770 . 4.770 2.538 1.870 3.890 . 0 0 "[ . 1]" 1 320 1 36 VAL MG1 1 37 LEU H 4.550 . 4.550 2.560 1.967 3.848 . 0 0 "[ . 1]" 1 321 1 46 THR MG 1 47 GLY H 4.330 . 4.330 3.824 1.811 4.361 0.031 10 0 "[ . 1]" 1 322 1 128 THR MG 1 129 ALA H 4.890 . 4.890 3.144 1.804 4.074 . 0 0 "[ . 1]" 1 323 1 85 THR H 1 85 THR MG 4.030 . 4.030 2.001 1.788 2.263 0.012 4 0 "[ . 1]" 1 324 1 145 VAL MG1 1 146 VAL H 4.560 . 4.560 3.270 2.789 3.730 . 0 0 "[ . 1]" 1 325 1 107 ASP H 1 108 VAL MG1 5.140 . 5.140 4.758 3.591 5.536 0.396 1 0 "[ . 1]" 1 326 1 36 VAL H 1 36 VAL MG1 4.780 . 4.780 3.461 2.109 3.795 . 0 0 "[ . 1]" 1 327 1 101 VAL H 1 101 VAL MG2 4.460 . 4.460 2.252 1.789 3.736 0.011 10 0 "[ . 1]" 1 328 1 145 VAL H 1 145 VAL MG1 4.110 . 4.110 3.751 3.717 3.797 . 0 0 "[ . 1]" 1 329 1 108 VAL H 1 108 VAL MG1 4.130 . 4.130 2.845 2.399 3.878 . 0 0 "[ . 1]" 1 330 1 108 VAL MG1 1 109 GLY H 5.000 . 5.000 4.371 4.303 4.428 . 0 0 "[ . 1]" 1 331 1 9 THR MG 1 10 ASN HA 4.900 . 4.900 4.068 3.599 4.500 . 0 0 "[ . 1]" 1 332 1 32 THR HA 1 36 VAL MG1 5.300 . 5.300 4.132 3.553 4.801 . 0 0 "[ . 1]" 1 333 1 100 GLU HA 1 101 VAL HA 5.020 . 5.020 4.854 4.795 4.874 . 0 0 "[ . 1]" 1 334 1 42 THR MG 1 43 GLY QA 5.180 . 5.180 4.098 3.168 5.098 . 0 0 "[ . 1]" 1 335 1 29 LYS HA 1 32 THR MG 4.500 . 4.500 3.503 2.274 4.265 . 0 0 "[ . 1]" 1 336 1 142 GLN HA 1 145 VAL MG1 4.510 . 4.510 4.009 3.683 4.499 . 0 0 "[ . 1]" 1 337 1 6 VAL HA 1 6 VAL MG2 3.460 . 3.460 2.797 2.302 3.223 . 0 0 "[ . 1]" 1 338 1 64 ALA HA 1 68 THR MG 4.710 . 4.710 3.793 3.426 4.104 . 0 0 "[ . 1]" 1 339 1 145 VAL HA 1 145 VAL MG1 3.740 . 3.740 2.376 2.300 2.497 . 0 0 "[ . 1]" 1 340 1 61 LYS HA 1 108 VAL MG1 4.380 . 4.380 2.846 2.338 3.567 . 0 0 "[ . 1]" 1 341 1 65 ILE HA 1 68 THR MG 4.590 . 4.590 2.274 2.114 2.335 . 0 0 "[ . 1]" 1 342 1 62 VAL MG1 1 150 GLN HG3 4.760 . 4.760 3.910 3.009 4.883 0.123 3 0 "[ . 1]" 1 343 1 65 ILE HB 1 66 VAL HA 4.440 . 4.440 4.119 3.981 4.199 . 0 0 "[ . 1]" 1 344 1 146 VAL HA 1 149 LYS QB 3.990 . 3.990 2.793 2.310 3.689 . 0 0 "[ . 1]" 1 345 1 84 GLU HB2 1 85 THR MG 4.550 . 4.550 3.006 2.724 3.739 . 0 0 "[ . 1]" 1 346 1 84 GLU HB3 1 85 THR MG 4.550 . 4.550 4.013 3.356 4.727 0.177 1 0 "[ . 1]" 1 347 1 65 ILE HB 1 68 THR MG 4.670 . 4.670 4.782 4.617 4.855 0.185 10 0 "[ . 1]" 1 348 1 28 LYS QB 1 108 VAL MG1 5.180 . 5.180 4.771 3.231 5.350 0.170 5 0 "[ . 1]" 1 349 1 32 THR HA 1 32 THR MG 3.540 . 3.540 2.306 2.269 2.396 . 0 0 "[ . 1]" 1 350 1 146 VAL HA 1 149 LYS QD 5.310 . 5.310 3.434 2.601 4.162 . 0 0 "[ . 1]" 1 351 1 62 VAL MG1 1 147 LYS QG 5.110 . 5.110 2.565 2.050 4.298 . 0 0 "[ . 1]" 1 352 1 64 ALA MB 1 68 THR MG 4.930 . 4.930 3.094 2.809 3.427 . 0 0 "[ . 1]" 1 353 1 65 ILE QG 1 68 THR MG 5.540 . 5.540 3.806 3.423 4.469 . 0 0 "[ . 1]" 1 354 1 31 ALA MB 1 36 VAL MG1 4.080 . 4.080 3.038 2.434 3.645 . 0 0 "[ . 1]" 1 355 1 146 VAL HA 1 146 VAL MG2 3.650 . 3.650 2.685 2.295 3.198 . 0 0 "[ . 1]" 1 356 1 146 VAL HA 1 146 VAL MG1 3.650 . 3.650 2.379 2.282 2.449 . 0 0 "[ . 1]" 1 357 1 102 VAL HA 1 102 VAL MG1 3.670 . 3.670 2.556 2.235 3.203 . 0 0 "[ . 1]" 1 358 1 40 ALA H 1 40 ALA MB 3.550 . 3.550 2.288 2.104 2.576 . 0 0 "[ . 1]" 1 359 1 117 VAL HA 1 120 GLU H 4.380 . 4.380 3.391 3.105 3.784 . 0 0 "[ . 1]" 1 360 1 108 VAL H 1 108 VAL MG2 4.110 . 4.110 1.907 1.751 2.248 0.049 9 0 "[ . 1]" 1 361 1 117 VAL HA 1 120 GLU QG 4.210 . 4.210 3.914 2.406 4.499 0.289 2 0 "[ . 1]" 1 362 1 105 LEU QB 1 108 VAL MG2 4.760 . 4.760 2.872 2.123 3.470 . 0 0 "[ . 1]" 1 363 1 64 ALA MB 1 108 VAL MG2 3.660 . 3.660 3.368 2.784 3.778 0.118 8 0 "[ . 1]" 1 364 1 117 VAL HA 1 117 VAL MG1 3.540 . 3.540 3.043 2.407 3.222 . 0 0 "[ . 1]" 1 365 1 24 ILE HA 1 27 ILE MG 4.210 . 4.210 4.259 3.969 4.582 0.372 9 0 "[ . 1]" 1 366 1 139 ILE HA 1 139 ILE MG 3.550 . 3.550 2.346 2.293 2.430 . 0 0 "[ . 1]" 1 367 1 24 ILE HA 1 27 ILE MD 3.750 . 3.750 3.981 3.921 4.045 0.295 8 0 "[ . 1]" 1 368 1 74 ILE HA 1 74 ILE MG 3.570 . 3.570 2.351 2.287 2.670 . 0 0 "[ . 1]" 1 369 1 79 ALA H 1 98 MET ME 5.740 . 5.740 5.511 5.095 5.806 0.066 3 0 "[ . 1]" 1 370 1 111 ILE MG 1 112 GLY H 4.100 . 4.100 3.944 3.434 4.316 0.216 4 0 "[ . 1]" 1 371 1 31 ALA MB 1 32 THR H 4.360 . 4.360 2.553 2.147 3.109 . 0 0 "[ . 1]" 1 372 1 78 GLU H 1 98 MET ME 5.820 . 5.820 6.011 5.813 6.246 0.426 1 0 "[ . 1]" 1 373 1 65 ILE MG 1 147 LYS H 4.670 . 4.670 4.229 2.951 4.847 0.177 3 0 "[ . 1]" 1 374 1 135 ALA MB 1 136 LYS H 3.930 . 3.930 2.383 2.001 2.558 . 0 0 "[ . 1]" 1 375 1 11 ALA H 1 11 ALA MB 3.490 . 3.490 2.250 2.215 2.289 . 0 0 "[ . 1]" 1 376 1 93 ALA MB 1 96 ASP H 4.510 . 4.510 4.648 4.475 4.827 0.317 9 0 "[ . 1]" 1 377 1 27 ILE H 1 27 ILE MG 4.080 . 4.080 3.745 3.730 3.755 . 0 0 "[ . 1]" 1 378 1 65 ILE H 1 65 ILE MG 4.390 . 4.390 3.746 3.688 3.785 . 0 0 "[ . 1]" 1 379 1 152 ILE MG 1 153 GLU H 5.210 . 5.210 3.081 1.748 3.690 0.052 10 0 "[ . 1]" 1 380 1 3 ILE H 1 3 ILE MG 4.730 . 4.730 3.240 2.011 4.000 . 0 0 "[ . 1]" 1 381 1 126 ILE H 1 126 ILE MG 4.560 . 4.560 3.519 2.593 4.008 . 0 0 "[ . 1]" 1 382 1 79 ALA MB 1 80 LEU H 4.320 . 4.320 2.640 2.516 2.929 . 0 0 "[ . 1]" 1 383 1 115 ALA H 1 115 ALA MB 3.360 . 3.360 2.242 2.227 2.255 . 0 0 "[ . 1]" 1 384 1 137 ALA H 1 137 ALA MB 3.620 . 3.620 2.266 2.233 2.299 . 0 0 "[ . 1]" 1 385 1 111 ILE H 1 111 ILE MG 3.970 . 3.970 3.060 1.869 3.388 . 0 0 "[ . 1]" 1 386 1 76 GLU H 1 98 MET ME 4.800 . 4.800 4.002 3.509 4.562 . 0 0 "[ . 1]" 1 387 1 93 ALA H 1 93 ALA MB 3.400 . 3.400 2.218 2.192 2.239 . 0 0 "[ . 1]" 1 388 1 93 ALA MB 1 94 MET H 3.980 . 3.980 2.583 2.301 2.803 . 0 0 "[ . 1]" 1 389 1 137 ALA MB 1 138 GLN H 4.320 . 4.320 2.681 2.532 2.880 . 0 0 "[ . 1]" 1 390 1 135 ALA H 1 135 ALA MB 3.460 . 3.460 2.229 2.206 2.254 . 0 0 "[ . 1]" 1 391 1 26 LYS H 1 27 ILE MG 6.000 . 6.000 5.647 5.571 5.734 . 0 0 "[ . 1]" 1 392 1 126 ILE MG 1 127 ASN H 4.950 . 4.950 3.297 2.857 3.819 . 0 0 "[ . 1]" 1 393 1 75 ILE H 1 98 MET ME 4.980 . 4.980 4.633 4.289 5.075 0.095 9 0 "[ . 1]" 1 394 1 115 ALA MB 1 116 ARG H 3.890 . 3.890 2.776 2.493 2.928 . 0 0 "[ . 1]" 1 395 1 126 ILE MG 1 128 THR H 4.200 . 4.200 3.427 2.674 4.280 0.080 4 0 "[ . 1]" 1 396 1 10 ASN HA 1 11 ALA MB 4.690 . 4.690 4.727 4.500 4.889 0.199 4 0 "[ . 1]" 1 397 1 5 LEU HA 1 6 VAL HA 5.590 . 5.590 4.649 4.340 5.310 . 0 0 "[ . 1]" 1 398 1 121 SER HA 1 126 ILE MG 4.300 . 4.300 4.405 3.906 4.689 0.389 8 0 "[ . 1]" 1 399 1 98 MET HA 1 98 MET ME 4.060 . 4.060 3.549 3.235 4.106 0.046 10 0 "[ . 1]" 1 400 1 109 GLY HA2 1 111 ILE MG 4.340 . 4.340 4.111 3.680 4.483 0.143 5 0 "[ . 1]" 1 401 1 132 LEU HA 1 134 ALA MB 4.420 . 4.420 4.229 3.942 4.695 0.275 6 0 "[ . 1]" 1 402 1 65 ILE MG 1 68 THR HB 5.150 . 5.150 4.703 4.235 4.902 . 0 0 "[ . 1]" 1 403 1 65 ILE MG 1 144 LYS HA 5.490 . 5.490 4.926 4.091 5.736 0.246 3 0 "[ . 1]" 1 404 1 76 GLU HA 1 79 ALA MB 4.290 . 4.290 3.171 2.662 3.518 . 0 0 "[ . 1]" 1 405 1 65 ILE MG 1 66 VAL HA 4.420 . 4.420 3.631 3.405 3.806 . 0 0 "[ . 1]" 1 406 1 88 SER HB2 1 127 ASN HB2 4.660 . 4.660 3.762 2.418 4.765 0.105 4 0 "[ . 1]" 1 407 1 88 SER HB3 1 127 ASN HB2 4.660 . 4.660 3.380 2.359 4.476 . 0 0 "[ . 1]" 1 408 1 98 MET ME 1 136 LYS QE 4.110 . 4.110 2.808 2.055 3.660 . 0 0 "[ . 1]" 1 409 1 126 ILE MG 1 131 ARG QD 5.670 . 5.670 4.183 3.232 5.541 . 0 0 "[ . 1]" 1 410 1 98 MET QG 1 139 ILE MG 4.490 . 4.490 3.113 2.207 3.967 . 0 0 "[ . 1]" 1 411 1 98 MET HB3 1 98 MET ME 3.970 . 3.970 3.454 3.268 3.594 . 0 0 "[ . 1]" 1 412 1 94 MET ME 1 98 MET ME 3.260 . 3.260 2.595 2.227 3.175 . 0 0 "[ . 1]" 1 413 1 34 LYS QB 1 56 ALA MB 3.990 . 3.990 3.042 2.542 3.618 . 0 0 "[ . 1]" 1 414 1 137 ALA MB 1 138 GLN QB 4.290 . 4.290 4.149 3.805 4.358 0.068 2 0 "[ . 1]" 1 415 1 152 ILE MG 1 153 GLU QG 5.370 . 5.370 4.170 2.564 4.983 . 0 0 "[ . 1]" 1 416 1 94 MET ME 1 135 ALA MB 3.770 . 3.770 3.919 3.799 4.002 0.232 9 0 "[ . 1]" 1 417 1 136 LYS QB 1 137 ALA MB 4.180 . 4.180 3.893 3.724 4.080 . 0 0 "[ . 1]" 1 418 1 75 ILE HA 1 98 MET ME 5.220 . 5.220 4.779 4.604 5.146 . 0 0 "[ . 1]" 1 419 1 79 ALA MB 1 98 MET ME 4.190 . 4.190 4.180 3.578 4.393 0.203 3 0 "[ . 1]" 1 420 1 92 LEU HB2 1 93 ALA MB 4.930 . 4.930 4.460 3.918 5.022 0.092 3 0 "[ . 1]" 1 421 1 79 ALA MB 1 133 LEU HG 4.840 . 4.840 4.656 3.744 5.121 0.281 10 0 "[ . 1]" 1 422 1 92 LEU HB3 1 93 ALA MB 4.930 . 4.930 4.399 3.769 5.098 0.168 9 0 "[ . 1]" 1 423 1 36 VAL HA 1 37 LEU HG 4.090 . 4.090 3.556 3.313 4.130 0.040 9 0 "[ . 1]" 1 424 1 9 THR HA 1 11 ALA MB 5.030 . 5.030 4.462 3.690 4.993 . 0 0 "[ . 1]" 1 425 1 98 MET ME 1 136 LYS QG 3.270 . 3.270 2.526 2.060 3.266 . 0 0 "[ . 1]" 1 426 1 27 ILE QG 1 64 ALA MB 3.510 . 3.510 2.840 2.320 3.614 0.104 7 0 "[ . 1]" 1 427 1 114 LYS QD 1 115 ALA MB 5.040 . 5.040 4.659 3.427 5.106 0.066 4 0 "[ . 1]" 1 428 1 27 ILE MG 1 60 ALA MB 3.510 . 3.510 2.349 2.122 2.895 . 0 0 "[ . 1]" 1 429 1 9 THR HA 1 9 THR MG 3.490 . 3.490 2.375 2.253 3.189 . 0 0 "[ . 1]" 1 430 1 27 ILE MG 1 64 ALA MB 3.910 . 3.910 2.655 2.330 2.943 . 0 0 "[ . 1]" 1 431 1 79 ALA MB 1 129 ALA MB 5.640 . 5.640 4.503 3.009 5.756 0.116 4 0 "[ . 1]" 1 432 1 111 ILE QG 1 111 ILE MG . . 3.270 2.378 2.229 2.545 . 0 0 "[ . 1]" 1 433 1 75 ILE HA 1 75 ILE MG 3.560 . 3.560 2.412 2.289 3.188 . 0 0 "[ . 1]" 1 434 1 6 VAL HA 1 6 VAL MG1 3.460 . 3.460 2.485 2.263 3.213 . 0 0 "[ . 1]" 1 435 1 75 ILE MG 1 98 MET ME 3.150 . 3.150 2.163 2.000 2.653 . 0 0 "[ . 1]" 1 436 1 75 ILE HA 1 75 ILE MD 3.670 . 3.670 3.819 3.708 3.847 0.177 9 0 "[ . 1]" 1 437 1 126 ILE MD 1 126 ILE MG 3.700 . 3.700 2.133 1.802 3.181 . 0 0 "[ . 1]" 1 438 1 94 MET ME 1 136 LYS H 4.830 . 4.830 4.645 4.093 5.089 0.259 9 0 "[ . 1]" 1 439 1 24 ILE H 1 24 ILE MG 4.360 . 4.360 3.706 3.653 3.748 . 0 0 "[ . 1]" 1 440 1 129 ALA MB 1 130 GLU H 4.180 . 4.180 2.195 1.797 2.881 0.003 10 0 "[ . 1]" 1 441 1 43 GLY H 1 46 THR HA 5.270 . 5.270 5.237 4.175 5.498 0.228 10 0 "[ . 1]" 1 442 1 15 SER H 1 16 SER HA 5.460 . 5.460 5.248 5.114 5.352 . 0 0 "[ . 1]" 1 443 1 14 GLU H 1 15 SER QB 5.380 . 5.380 4.579 4.386 4.706 . 0 0 "[ . 1]" 1 444 1 15 SER QB 1 17 SER H 6.000 . 6.000 4.626 4.314 4.989 . 0 0 "[ . 1]" 1 445 1 15 SER H 1 15 SER QB 3.370 . 3.370 2.365 2.226 2.555 . 0 0 "[ . 1]" 1 446 1 3 ILE MG 1 4 GLY H 4.900 . 4.900 3.206 2.030 4.012 . 0 0 "[ . 1]" 1 447 1 15 SER QB 1 16 SER H 3.740 . 3.740 2.705 2.301 3.387 . 0 0 "[ . 1]" 1 448 1 94 MET ME 1 98 MET H 5.090 . 5.090 3.946 3.235 4.631 . 0 0 "[ . 1]" 1 449 1 110 ILE MG 1 111 ILE H 4.730 . 4.730 2.923 2.193 3.823 . 0 0 "[ . 1]" 1 450 1 94 MET H 1 94 MET ME 5.010 . 5.010 4.740 4.455 5.283 0.273 10 0 "[ . 1]" 1 451 1 24 ILE MG 1 25 LEU H 4.580 . 4.580 3.283 3.080 3.774 . 0 0 "[ . 1]" 1 452 1 83 LYS H 1 129 ALA MB 4.800 . 4.800 3.960 3.129 4.852 0.052 4 0 "[ . 1]" 1 453 1 75 ILE MG 1 76 GLU H 4.800 . 4.800 3.461 2.016 3.865 . 0 0 "[ . 1]" 1 454 1 88 SER HA 1 91 PHE H 4.250 . 4.250 3.368 3.199 3.840 . 0 0 "[ . 1]" 1 455 1 74 ILE H 1 74 ILE MG 4.280 . 4.280 3.558 1.756 3.779 0.044 3 0 "[ . 1]" 1 456 1 91 PHE HA 1 129 ALA MB 6.000 . 6.000 6.103 5.760 6.451 0.451 3 0 "[ . 1]" 1 457 1 128 THR HB 1 129 ALA MB 6.000 . 6.000 4.488 3.544 5.287 . 0 0 "[ . 1]" 1 458 1 24 ILE MG 1 105 LEU HA 4.230 . 4.230 4.188 3.648 4.604 0.374 9 0 "[ . 1]" 1 459 1 3 ILE MG 1 4 GLY QA 4.740 . 4.740 3.970 2.916 4.799 0.059 10 0 "[ . 1]" 1 460 1 129 ALA MB 1 130 GLU HA 4.910 . 4.910 3.729 3.624 3.859 . 0 0 "[ . 1]" 1 461 1 139 ILE MG 1 140 GLU HA 4.420 . 4.420 3.535 3.255 3.764 . 0 0 "[ . 1]" 1 462 1 94 MET ME 1 98 MET QG 4.010 . 4.010 3.645 1.973 4.194 0.184 9 0 "[ . 1]" 1 463 1 15 SER HA 1 18 LYS QB 4.340 . 4.340 3.791 2.303 4.421 0.081 9 0 "[ . 1]" 1 464 1 24 ILE MG 1 28 LYS QD 3.940 . 3.940 2.469 2.198 2.707 . 0 0 "[ . 1]" 1 465 1 83 LYS QG 1 129 ALA MB 3.680 . 3.680 2.587 2.048 3.844 0.164 5 0 "[ . 1]" 1 466 1 85 THR HA 1 85 THR MG 3.240 . 3.240 2.437 2.343 2.547 . 0 0 "[ . 1]" 1 467 1 46 THR HA 1 46 THR MG 3.180 . 3.180 2.333 2.213 2.515 . 0 0 "[ . 1]" 1 468 1 51 THR HA 1 51 THR MG 3.190 . 3.190 2.597 2.268 3.219 0.029 9 0 "[ . 1]" 1 469 1 42 THR HA 1 42 THR MG 3.100 . 3.100 2.409 2.289 3.189 0.089 6 0 "[ . 1]" 1 470 1 17 SER HB3 1 97 LEU MD2 4.530 . 4.530 3.060 2.446 3.737 . 0 0 "[ . 1]" 1 471 1 82 LEU MD2 1 129 ALA MB 5.390 . 5.390 5.238 3.573 5.697 0.307 8 0 "[ . 1]" 1 472 1 144 LYS HA 1 147 LYS H 4.450 . 4.450 3.790 3.483 4.063 . 0 0 "[ . 1]" 1 473 1 71 PHE HA 1 74 ILE H 4.130 . 4.130 3.368 3.142 3.599 . 0 0 "[ . 1]" 1 474 1 18 LYS HA 1 18 LYS QE 5.210 . 5.210 4.543 3.990 5.605 0.395 7 0 "[ . 1]" 1 475 1 26 LYS HA 1 26 LYS QE 5.760 . 5.760 4.329 3.682 4.988 . 0 0 "[ . 1]" 1 476 1 144 LYS HA 1 144 LYS QE 5.970 . 5.970 4.350 3.882 4.875 . 0 0 "[ . 1]" 1 477 1 61 LYS HA 1 61 LYS QG 4.010 . 4.010 2.365 2.292 2.699 . 0 0 "[ . 1]" 1 478 1 136 LYS HA 1 136 LYS QG 3.530 . 3.530 2.386 2.316 2.421 . 0 0 "[ . 1]" 1 479 1 83 LYS HA 1 129 ALA MB 3.620 . 3.620 2.221 2.055 2.605 . 0 0 "[ . 1]" 1 480 1 71 PHE HA 1 74 ILE MG 4.350 . 4.350 4.118 2.131 4.422 0.072 4 0 "[ . 1]" 1 481 1 111 ILE HA 1 111 ILE MG 3.670 . 3.670 2.297 2.232 2.458 . 0 0 "[ . 1]" 1 482 1 61 LYS HA 1 108 VAL MG2 4.010 . 4.010 3.637 3.239 4.076 0.066 1 0 "[ . 1]" 1 483 1 152 ILE HA 1 152 ILE MG 3.250 . 3.250 2.859 2.295 3.224 . 0 0 "[ . 1]" 1 484 1 75 ILE MD 1 98 MET HA 4.610 . 4.610 3.314 2.834 3.629 . 0 0 "[ . 1]" 1 485 1 65 ILE MD 1 147 LYS H 4.820 . 4.820 4.036 3.169 5.044 0.224 10 0 "[ . 1]" 1 486 1 27 ILE H 1 27 ILE MD 4.040 . 4.040 2.868 2.747 2.965 . 0 0 "[ . 1]" 1 487 1 62 VAL H 1 65 ILE MD 5.680 . 5.680 5.370 4.962 5.981 0.301 10 0 "[ . 1]" 1 488 1 106 GLU H 1 110 ILE MD 6.000 . 6.000 5.826 5.149 6.156 0.156 3 0 "[ . 1]" 1 489 1 110 ILE H 1 110 ILE MD 4.830 . 4.830 3.897 2.527 4.496 . 0 0 "[ . 1]" 1 490 1 106 GLU HA 1 110 ILE HA 4.930 . 4.930 4.807 4.531 5.110 0.180 7 0 "[ . 1]" 1 491 1 29 LYS HA 1 32 THR HB 3.910 . 3.910 2.971 2.345 3.976 0.066 1 0 "[ . 1]" 1 492 1 110 ILE HA 1 110 ILE MD 4.780 . 4.780 3.031 2.168 3.850 . 0 0 "[ . 1]" 1 493 1 121 SER HA 1 122 LYS HA 4.920 . 4.920 4.830 4.749 4.875 . 0 0 "[ . 1]" 1 494 1 98 MET HA 1 139 ILE MD 5.820 . 5.820 5.750 4.611 6.116 0.296 2 0 "[ . 1]" 1 495 1 26 LYS HA 1 27 ILE MD 5.310 . 5.310 5.001 4.601 5.357 0.047 7 0 "[ . 1]" 1 496 1 72 LEU HA 1 73 LYS HA 4.740 . 4.740 4.751 4.719 4.775 0.035 4 0 "[ . 1]" 1 497 1 27 ILE HA 1 27 ILE MD 3.930 . 3.930 2.147 2.110 2.160 . 0 0 "[ . 1]" 1 498 1 65 ILE HA 1 65 ILE MD 4.370 . 4.370 3.683 2.174 3.867 . 0 0 "[ . 1]" 1 499 1 23 LYS HA 1 23 LYS QE 4.040 . 4.040 2.581 2.330 3.006 . 0 0 "[ . 1]" 1 500 1 116 ARG HA 1 116 ARG QD 4.220 . 4.220 3.975 3.913 4.130 . 0 0 "[ . 1]" 1 501 1 131 ARG HA 1 131 ARG QD 4.610 . 4.610 4.431 3.958 4.551 . 0 0 "[ . 1]" 1 502 1 120 GLU HA 1 120 GLU QG 3.210 . 3.210 2.525 2.309 2.732 . 0 0 "[ . 1]" 1 503 1 65 ILE HB 1 65 ILE MD 3.670 . 3.670 2.398 2.289 3.217 . 0 0 "[ . 1]" 1 504 1 26 LYS QB 1 27 ILE MD 4.180 . 4.180 3.068 2.609 3.389 . 0 0 "[ . 1]" 1 505 1 27 ILE MD 1 63 GLN HB3 4.380 . 4.380 2.592 2.409 2.845 . 0 0 "[ . 1]" 1 506 1 81 LYS HA 1 81 LYS QD 3.840 . 3.840 2.717 2.194 3.967 0.127 1 0 "[ . 1]" 1 507 1 23 LYS HA 1 23 LYS QD 3.200 . 3.200 2.309 2.254 2.337 . 0 0 "[ . 1]" 1 508 1 144 LYS HA 1 144 LYS QD 3.950 . 3.950 3.995 3.910 4.145 0.195 9 0 "[ . 1]" 1 509 1 18 LYS HA 1 21 LYS QD 3.520 . 3.520 2.583 2.202 3.605 0.085 4 0 "[ . 1]" 1 510 1 73 LYS HA 1 73 LYS QG 3.420 . 3.420 2.332 2.299 2.488 . 0 0 "[ . 1]" 1 511 1 27 ILE MD 1 60 ALA MB 4.810 . 4.810 4.393 3.752 4.853 0.043 10 0 "[ . 1]" 1 512 1 27 ILE MD 1 64 ALA MB 3.990 . 3.990 3.842 3.274 4.354 0.364 7 0 "[ . 1]" 1 513 1 128 THR HA 1 128 THR MG 3.500 . 3.500 2.376 2.187 3.164 . 0 0 "[ . 1]" 1 514 1 142 GLN HA 1 145 VAL MG2 4.510 . 4.510 2.837 2.196 3.281 . 0 0 "[ . 1]" 1 515 1 27 ILE MD 1 27 ILE MG 3.360 . 3.360 1.869 1.818 1.907 . 0 0 "[ . 1]" 1 516 1 3 ILE MD 1 4 GLY H 5.400 . 5.400 3.956 2.000 4.741 . 0 0 "[ . 1]" 1 517 1 152 ILE MD 1 153 GLU H 6.000 . 6.000 4.662 3.169 5.604 . 0 0 "[ . 1]" 1 518 1 113 LEU HA 1 115 ALA H 4.840 . 4.840 3.994 3.721 4.917 0.077 10 0 "[ . 1]" 1 519 1 139 ILE H 1 139 ILE MD 4.420 . 4.420 3.372 2.963 3.729 . 0 0 "[ . 1]" 1 520 1 111 ILE H 1 111 ILE MD 4.450 . 4.450 2.997 1.680 4.021 0.120 5 0 "[ . 1]" 1 521 1 19 ASP HA 1 22 ASN HD21 4.730 . 4.730 3.477 2.113 4.749 0.019 3 0 "[ . 1]" 1 522 1 74 ILE MD 1 75 ILE H 4.940 . 4.940 4.398 4.031 4.705 . 0 0 "[ . 1]" 1 523 1 91 PHE H 1 92 LEU HA 5.570 . 5.570 5.121 4.974 5.360 . 0 0 "[ . 1]" 1 524 1 74 ILE H 1 74 ILE MD 3.990 . 3.990 3.576 3.484 3.672 . 0 0 "[ . 1]" 1 525 1 111 ILE HA 1 111 ILE MD 4.350 . 4.350 3.812 3.457 4.153 . 0 0 "[ . 1]" 1 526 1 3 ILE HA 1 3 ILE MD 4.400 . 4.400 3.376 2.117 4.139 . 0 0 "[ . 1]" 1 527 1 71 PHE HA 1 74 ILE MD 3.920 . 3.920 2.412 2.140 3.756 . 0 0 "[ . 1]" 1 528 1 152 ILE HA 1 152 ILE MD 3.590 . 3.590 3.289 2.104 3.820 0.230 7 0 "[ . 1]" 1 529 1 117 VAL HA 1 139 ILE MD 5.180 . 5.180 5.198 4.803 5.396 0.216 5 0 "[ . 1]" 1 530 1 3 ILE MD 1 4 GLY QA 5.120 . 5.120 4.775 3.517 5.477 0.357 3 0 "[ . 1]" 1 531 1 139 ILE HA 1 139 ILE MD 4.130 . 4.130 2.836 2.123 3.838 . 0 0 "[ . 1]" 1 532 1 74 ILE HA 1 74 ILE MD 4.110 . 4.110 3.700 2.203 4.178 0.068 3 0 "[ . 1]" 1 533 1 139 ILE HB 1 139 ILE MD 3.370 . 3.370 2.881 2.310 3.245 . 0 0 "[ . 1]" 1 534 1 74 ILE HB 1 74 ILE MD 3.610 . 3.610 2.418 2.297 3.227 . 0 0 "[ . 1]" 1 535 1 122 LYS HA 1 122 LYS QG 3.260 . 3.260 2.343 2.310 2.373 . 0 0 "[ . 1]" 1 536 1 135 ALA MB 1 139 ILE MD 4.540 . 4.540 4.020 2.770 4.691 0.151 3 0 "[ . 1]" 1 537 1 96 ASP HA 1 99 LEU HB3 4.370 . 4.370 4.493 4.111 4.682 0.312 8 0 "[ . 1]" 1 538 1 132 LEU HA 1 132 LEU MD1 3.860 . 3.860 2.638 2.120 3.455 . 0 0 "[ . 1]" 1 539 1 97 LEU HA 1 97 LEU MD2 3.860 . 3.860 3.386 2.446 3.834 . 0 0 "[ . 1]" 1 540 1 80 LEU HA 1 80 LEU MD2 4.350 . 4.350 3.141 2.110 3.837 . 0 0 "[ . 1]" 1 541 1 96 ASP HA 1 99 LEU MD1 4.770 . 4.770 2.987 2.313 5.082 0.312 5 0 "[ . 1]" 1 542 1 126 ILE MG 1 132 LEU HA 4.030 . 4.030 3.508 2.474 4.554 0.524 3 1 "[ + . 1]" 1 543 1 126 ILE HA 1 126 ILE MD 4.080 . 4.080 2.495 2.108 3.754 . 0 0 "[ . 1]" 1 544 1 24 ILE H 1 24 ILE MD 4.510 . 4.510 1.958 1.722 3.285 0.078 2 0 "[ . 1]" 1 545 1 24 ILE MD 1 27 ILE H 6.000 . 6.000 5.056 4.839 6.204 0.204 7 0 "[ . 1]" 1 546 1 24 ILE MD 1 65 ILE H 6.000 . 6.000 6.198 6.074 6.318 0.318 9 0 "[ . 1]" 1 547 1 21 LYS H 1 24 ILE MD 5.090 . 5.090 4.554 4.268 4.883 . 0 0 "[ . 1]" 1 548 1 49 LYS HA 1 50 VAL H 3.570 . 3.570 3.338 2.842 3.565 . 0 0 "[ . 1]" 1 549 1 166 LYS HA 1 167 LYS H 3.500 . 3.500 2.751 2.143 3.547 0.047 8 0 "[ . 1]" 1 550 1 5 LEU HA 1 6 VAL H 3.380 . 3.380 2.964 2.159 3.532 0.152 7 0 "[ . 1]" 1 551 1 39 GLU HA 1 40 ALA H 3.540 . 3.540 3.513 3.223 3.588 0.048 10 0 "[ . 1]" 1 552 1 75 ILE MD 1 98 MET H 5.140 . 5.140 4.298 3.813 4.690 . 0 0 "[ . 1]" 1 553 1 75 ILE MD 1 76 GLU H 5.140 . 5.140 4.551 4.332 4.753 . 0 0 "[ . 1]" 1 554 1 75 ILE H 1 75 ILE MD 4.430 . 4.430 3.512 3.354 4.304 . 0 0 "[ . 1]" 1 555 1 33 GLY QA 1 34 LYS HA 4.230 . 4.230 4.056 4.001 4.090 . 0 0 "[ . 1]" 1 556 1 24 ILE MD 1 105 LEU HA 4.150 . 4.150 3.944 3.103 4.263 0.113 1 0 "[ . 1]" 1 557 1 17 SER HA 1 75 ILE MD 4.850 . 4.850 4.721 4.348 4.936 0.086 8 0 "[ . 1]" 1 558 1 21 LYS HA 1 24 ILE MD 4.000 . 4.000 3.032 2.449 3.597 . 0 0 "[ . 1]" 1 559 1 24 ILE HA 1 24 ILE MD 4.160 . 4.160 2.633 2.400 3.851 . 0 0 "[ . 1]" 1 560 1 72 LEU HA 1 75 ILE MD 5.040 . 5.040 2.886 2.294 4.506 . 0 0 "[ . 1]" 1 561 1 8 ARG HA 1 8 ARG QD 4.290 . 4.290 3.508 2.160 4.186 . 0 0 "[ . 1]" 1 562 1 153 GLU HA 1 153 GLU QG 3.380 . 3.380 2.443 2.334 3.304 . 0 0 "[ . 1]" 1 563 1 141 ASN HA 1 144 LYS QB 3.710 . 3.710 3.062 2.459 3.665 . 0 0 "[ . 1]" 1 564 1 75 ILE HB 1 75 ILE MD 3.720 . 3.720 2.297 2.282 2.336 . 0 0 "[ . 1]" 1 565 1 18 LYS QB 1 19 ASP HA 4.310 . 4.310 4.148 3.893 4.483 0.173 7 0 "[ . 1]" 1 566 1 34 LYS HA 1 34 LYS QD 3.450 . 3.450 2.595 2.129 3.876 0.426 9 0 "[ . 1]" 1 567 1 21 LYS QB 1 22 ASN HA 4.260 . 4.260 3.941 3.854 4.102 . 0 0 "[ . 1]" 1 568 1 22 ASN HA 1 25 LEU HB2 5.560 . 5.560 5.245 3.947 5.577 0.017 2 0 "[ . 1]" 1 569 1 20 LEU HB2 1 24 ILE MD 5.720 . 5.720 5.503 5.068 5.790 0.070 2 0 "[ . 1]" 1 570 1 75 ILE MD 1 98 MET ME 4.010 . 4.010 2.630 2.056 3.276 . 0 0 "[ . 1]" 1 571 1 159 LYS HA 1 159 LYS QG 3.740 . 3.740 2.654 2.239 3.306 . 0 0 "[ . 1]" 1 572 1 22 ASN HA 1 25 LEU HB3 4.560 . 4.560 3.685 3.064 3.900 . 0 0 "[ . 1]" 1 573 1 34 LYS HA 1 34 LYS QG 3.630 . 3.630 2.572 2.214 2.928 . 0 0 "[ . 1]" 1 574 1 5 LEU HA 1 5 LEU HG 3.390 . 3.390 3.248 2.424 3.647 0.257 10 0 "[ . 1]" 1 575 1 24 ILE MD 1 64 ALA MB 3.560 . 3.560 3.444 3.186 3.554 . 0 0 "[ . 1]" 1 576 1 5 LEU HA 1 5 LEU MD1 4.670 . 4.670 3.392 2.168 4.060 . 0 0 "[ . 1]" 1 577 1 5 LEU HA 1 5 LEU MD2 4.670 . 4.670 2.531 2.149 3.759 . 0 0 "[ . 1]" 1 578 1 105 LEU HA 1 105 LEU MD2 4.370 . 4.370 2.484 2.116 3.765 . 0 0 "[ . 1]" 1 579 1 24 ILE MD 1 24 ILE MG 3.110 . 3.110 3.124 1.912 3.273 0.163 3 0 "[ . 1]" 1 580 1 75 ILE MD 1 75 ILE MG 3.010 . 3.010 1.906 1.868 1.991 . 0 0 "[ . 1]" 1 581 1 93 ALA HA 1 96 ASP H 4.310 . 4.310 3.530 3.315 3.885 . 0 0 "[ . 1]" 1 582 1 126 ILE H 1 126 ILE MD 4.520 . 4.520 3.581 2.667 4.642 0.122 7 0 "[ . 1]" 1 583 1 137 ALA HA 1 139 ILE H 4.390 . 4.390 4.431 4.272 4.664 0.274 5 0 "[ . 1]" 1 584 1 126 ILE MD 1 135 ALA H 4.610 . 4.610 4.484 3.745 4.959 0.349 3 0 "[ . 1]" 1 585 1 126 ILE MD 1 127 ASN H 4.580 . 4.580 4.166 3.611 4.885 0.305 9 0 "[ . 1]" 1 586 1 121 SER HA 1 126 ILE MD 4.210 . 4.210 3.185 2.503 4.100 . 0 0 "[ . 1]" 1 587 1 31 ALA HA 1 57 LEU HA 3.890 . 3.890 4.073 3.929 4.222 0.332 3 0 "[ . 1]" 1 588 1 126 ILE MD 1 132 LEU HA 4.370 . 4.370 3.240 2.453 3.826 . 0 0 "[ . 1]" 1 589 1 121 SER HB3 1 126 ILE MD 4.630 . 4.630 4.255 3.532 4.988 0.358 8 0 "[ . 1]" 1 590 1 93 ALA HA 1 96 ASP HB2 4.130 . 4.130 3.797 2.756 4.296 0.166 9 0 "[ . 1]" 1 591 1 93 ALA HA 1 96 ASP HB3 4.130 . 4.130 3.541 2.926 4.432 0.302 5 0 "[ . 1]" 1 592 1 135 ALA HA 1 138 GLN QB 3.660 . 3.660 3.181 2.802 3.525 . 0 0 "[ . 1]" 1 593 1 136 LYS QB 1 137 ALA HA 4.370 . 4.370 3.991 3.792 4.225 . 0 0 "[ . 1]" 1 594 1 60 ALA HA 1 63 GLN HB2 4.030 . 4.030 2.492 2.356 2.842 . 0 0 "[ . 1]" 1 595 1 60 ALA HA 1 63 GLN HB3 4.030 . 4.030 3.804 2.707 4.169 0.139 9 0 "[ . 1]" 1 596 1 115 ALA HA 1 118 LEU QB 4.100 . 4.100 3.087 2.461 3.764 . 0 0 "[ . 1]" 1 597 1 126 ILE HB 1 126 ILE MD 3.710 . 3.710 2.868 2.266 3.244 . 0 0 "[ . 1]" 1 598 1 27 ILE MG 1 60 ALA HA 3.800 . 3.800 3.038 2.675 3.438 . 0 0 "[ . 1]" 1 599 1 44 LEU HA 1 44 LEU MD1 4.390 . 4.390 3.976 2.776 4.159 . 0 0 "[ . 1]" 1 600 1 27 ILE MD 1 64 ALA HA 3.840 . 3.840 3.151 2.292 3.734 . 0 0 "[ . 1]" 1 601 1 9 THR HA 1 10 ASN HA 4.570 . 4.570 4.497 4.347 4.723 0.153 2 0 "[ . 1]" 1 602 1 122 LYS QB 1 123 ASN HA 4.560 . 4.560 4.060 3.925 4.218 . 0 0 "[ . 1]" 1 603 1 82 LEU HA 1 82 LEU MD1 4.710 . 4.710 3.109 2.174 3.824 . 0 0 "[ . 1]" 1 604 1 127 ASN HA 1 128 THR HA 5.660 . 5.660 4.494 4.327 4.756 . 0 0 "[ . 1]" 1 605 1 124 ASN HA 1 125 PRO HD3 3.780 . 3.780 2.351 2.176 2.436 . 0 0 "[ . 1]" 1 606 1 124 ASN HA 1 125 PRO QG 3.820 . 3.820 3.990 3.937 4.061 0.241 9 0 "[ . 1]" 1 607 1 20 LEU MD1 1 68 THR MG 3.300 . 3.300 2.374 2.039 3.049 . 0 0 "[ . 1]" 1 608 1 6 VAL HA 1 7 GLU H 3.380 . 3.380 2.539 2.156 3.493 0.113 9 0 "[ . 1]" 1 609 1 12 ALA H 1 12 ALA MB 3.470 . 3.470 2.236 2.208 2.272 . 0 0 "[ . 1]" 1 610 1 11 ALA MB 1 12 ALA H 3.490 . 3.490 2.475 2.059 2.803 . 0 0 "[ . 1]" 1 611 1 136 LYS H 1 137 ALA MB 4.790 . 4.790 4.341 4.240 4.492 . 0 0 "[ . 1]" 1 612 1 121 SER HA 1 126 ILE QG 5.760 . 5.760 3.136 2.080 5.383 . 0 0 "[ . 1]" 1 613 1 6 VAL HA 1 7 GLU QG 4.910 . 4.910 4.178 3.570 4.839 . 0 0 "[ . 1]" 1 614 1 75 ILE H 1 75 ILE QG 4.460 . 4.460 2.218 1.864 3.966 . 0 0 "[ . 1]" 1 615 1 10 ASN HA 1 12 ALA H 4.350 . 4.350 3.924 3.387 4.387 0.037 1 0 "[ . 1]" 1 616 1 94 MET ME 1 98 MET HB3 3.420 . 3.420 3.509 2.875 3.910 0.490 10 0 "[ . 1]" 1 617 1 21 LYS HA 1 21 LYS QD 4.120 . 4.120 2.912 2.382 3.622 . 0 0 "[ . 1]" 1 618 1 83 LYS HA 1 129 ALA HA 4.510 . 4.510 4.636 4.389 4.845 0.335 2 0 "[ . 1]" 1 619 1 133 LEU HB3 1 134 ALA H 4.920 . 4.920 3.481 2.652 4.039 . 0 0 "[ . 1]" 1 620 1 25 LEU HG 1 26 LYS HA 5.020 . 5.020 3.577 2.970 5.163 0.143 3 0 "[ . 1]" 1 621 1 116 ARG H 1 116 ARG QB 3.790 . 3.790 2.268 2.235 2.331 . 0 0 "[ . 1]" 1 622 1 145 VAL HA 1 145 VAL MG2 3.740 . 3.740 2.365 2.317 2.397 . 0 0 "[ . 1]" 1 623 1 27 ILE MD 1 60 ALA HA 4.530 . 4.530 4.512 4.232 4.691 0.161 8 0 "[ . 1]" 1 624 1 72 LEU HA 1 75 ILE QG 4.860 . 4.860 3.643 2.914 5.135 0.275 8 0 "[ . 1]" 1 625 1 98 MET H 1 98 MET ME 5.400 . 5.400 4.117 3.787 4.592 . 0 0 "[ . 1]" 1 626 1 17 SER HB3 1 97 LEU HG 5.380 . 5.380 3.867 3.132 4.497 . 0 0 "[ . 1]" 1 627 1 17 SER HB2 1 97 LEU HG 5.380 . 5.380 3.750 2.816 4.980 . 0 0 "[ . 1]" 1 628 1 114 LYS HA 1 115 ALA MB 5.040 . 5.040 5.014 4.984 5.044 0.004 10 0 "[ . 1]" 1 629 1 45 LYS H 1 45 LYS QD 5.140 . 5.140 4.051 2.475 5.446 0.306 1 0 "[ . 1]" 1 630 1 49 LYS H 1 49 LYS QD 5.690 . 5.690 4.036 2.509 4.602 . 0 0 "[ . 1]" 1 631 1 26 LYS H 1 27 ILE QG 3.760 . 3.760 3.635 3.432 3.785 0.025 7 0 "[ . 1]" 1 632 1 21 LYS H 1 21 LYS QD 4.210 . 4.210 1.792 1.653 1.932 0.147 6 0 "[ . 1]" 1 633 1 124 ASN HA 1 125 PRO HD2 3.780 . 3.780 2.298 2.180 2.407 . 0 0 "[ . 1]" 1 634 1 68 THR MG 1 70 LYS H 5.540 . 5.540 5.140 5.025 5.411 . 0 0 "[ . 1]" 1 635 1 68 THR MG 1 71 PHE H 6.000 . 6.000 5.209 5.075 5.375 . 0 0 "[ . 1]" 1 636 1 126 ILE HA 1 131 ARG QD 4.790 . 4.790 3.003 2.339 4.975 0.185 3 0 "[ . 1]" 1 637 1 114 LYS H 1 114 LYS QD 4.510 . 4.510 4.514 4.141 4.756 0.246 9 0 "[ . 1]" 1 638 1 113 LEU HB2 1 114 LYS H 4.890 . 4.890 4.217 3.017 4.425 . 0 0 "[ . 1]" 1 639 1 113 LEU HB3 1 114 LYS H 4.890 . 4.890 4.204 1.926 4.695 . 0 0 "[ . 1]" 1 640 1 114 LYS H 1 115 ALA MB 5.230 . 5.230 4.423 4.273 4.651 . 0 0 "[ . 1]" 1 641 1 126 ILE MD 1 135 ALA MB 4.230 . 4.230 3.071 2.254 3.533 . 0 0 "[ . 1]" 1 642 1 128 THR H 1 131 ARG QD 4.500 . 4.500 3.467 2.280 4.271 . 0 0 "[ . 1]" 1 643 1 131 ARG H 1 131 ARG QD 4.520 . 4.520 3.968 3.415 4.529 0.009 9 0 "[ . 1]" 1 644 1 127 ASN H 1 131 ARG QD 5.190 . 5.190 3.481 2.057 4.996 . 0 0 "[ . 1]" 1 645 1 95 PHE HB2 1 96 ASP HA 5.450 . 5.450 5.602 5.579 5.637 0.187 5 0 "[ . 1]" 1 646 1 95 PHE HB3 1 96 ASP HA 5.450 . 5.450 4.234 4.158 4.275 . 0 0 "[ . 1]" 1 647 1 65 ILE H 1 65 ILE MD 4.560 . 4.560 3.305 2.166 3.480 . 0 0 "[ . 1]" 1 648 1 121 SER HB2 1 126 ILE MD 4.630 . 4.630 4.343 3.288 4.917 0.287 1 0 "[ . 1]" 1 649 1 32 THR HB 1 33 GLY H 4.630 . 4.630 2.928 2.358 3.798 . 0 0 "[ . 1]" 1 650 1 152 ILE H 1 152 ILE QG 4.400 . 4.400 3.556 1.821 4.271 . 0 0 "[ . 1]" 1 651 1 152 ILE H 1 152 ILE MD 5.400 . 5.400 4.400 2.727 4.972 . 0 0 "[ . 1]" 1 652 1 62 VAL MG1 1 150 GLN HG2 4.760 . 4.760 3.936 2.910 4.771 0.011 10 0 "[ . 1]" 1 653 1 150 GLN H 1 150 GLN HG2 4.990 . 4.990 3.168 2.074 4.694 . 0 0 "[ . 1]" 1 654 1 133 LEU MD2 1 134 ALA H 5.080 . 5.080 4.692 4.304 5.106 0.026 5 0 "[ . 1]" 1 655 1 107 ASP HB2 1 108 VAL H 4.920 . 4.920 3.118 2.241 4.004 . 0 0 "[ . 1]" 1 656 1 107 ASP HB3 1 108 VAL H 4.920 . 4.920 3.474 2.284 4.206 . 0 0 "[ . 1]" 1 657 1 111 ILE HB 1 112 GLY HA3 5.090 . 5.090 5.122 4.127 5.707 0.617 2 1 "[ + . 1]" 1 658 1 111 ILE HB 1 112 GLY HA2 5.090 . 5.090 4.783 4.025 5.295 0.205 4 0 "[ . 1]" 1 659 1 96 ASP HA 1 99 LEU HG 4.300 . 4.300 3.941 3.430 4.185 . 0 0 "[ . 1]" 1 660 1 111 ILE MD 1 112 GLY H 5.030 . 5.030 4.733 3.530 5.414 0.384 2 0 "[ . 1]" 1 661 1 114 LYS HB3 1 115 ALA H 4.600 . 4.600 2.353 2.080 2.616 . 0 0 "[ . 1]" 1 662 1 114 LYS HG2 1 115 ALA H 5.760 . 5.760 3.615 2.683 4.086 . 0 0 "[ . 1]" 1 663 1 114 LYS HG3 1 115 ALA H 5.760 . 5.760 4.585 3.853 4.897 . 0 0 "[ . 1]" 1 664 1 96 ASP HA 1 99 LEU HB2 5.520 . 5.520 2.934 2.639 3.271 . 0 0 "[ . 1]" 1 665 1 19 ASP HA 1 22 ASN HD22 4.730 . 4.730 3.469 1.833 5.004 0.274 10 0 "[ . 1]" 1 666 1 24 ILE MG 1 107 ASP HA 6.000 . 6.000 5.724 5.247 6.028 0.028 10 0 "[ . 1]" 1 667 1 84 GLU HA 1 85 THR MG 4.950 . 4.950 4.719 4.577 4.873 . 0 0 "[ . 1]" 1 668 1 87 ASN HB2 1 88 SER H 4.900 . 4.900 4.463 4.231 4.637 . 0 0 "[ . 1]" 1 669 1 87 ASN HB3 1 88 SER H 4.900 . 4.900 4.117 3.344 4.461 . 0 0 "[ . 1]" 1 670 1 68 THR HB 1 71 PHE H 5.160 . 5.160 5.116 4.827 5.351 0.191 7 0 "[ . 1]" 1 671 1 24 ILE MD 1 25 LEU H 5.260 . 5.260 4.013 3.881 4.692 . 0 0 "[ . 1]" 1 672 1 24 ILE MD 1 104 SER H 5.350 . 5.350 5.375 4.852 5.594 0.244 10 0 "[ . 1]" 1 673 1 21 LYS H 1 21 LYS HG2 4.430 . 4.430 3.023 1.765 4.046 0.035 4 0 "[ . 1]" 1 674 1 21 LYS H 1 21 LYS HG3 4.430 . 4.430 3.297 2.712 3.828 . 0 0 "[ . 1]" 1 675 1 32 THR MG 1 36 VAL H 4.870 . 4.870 4.388 3.426 4.906 0.036 10 0 "[ . 1]" 1 676 1 32 THR MG 1 38 PHE H 5.140 . 5.140 4.440 2.820 5.144 0.004 4 0 "[ . 1]" 1 677 1 2 SER QB 1 3 ILE H 4.370 . 4.370 2.982 2.243 3.815 . 0 0 "[ . 1]" 1 678 1 78 GLU H 1 78 GLU QG 4.680 . 4.680 3.435 2.373 4.093 . 0 0 "[ . 1]" 1 679 1 98 MET H 1 98 MET QG 4.500 . 4.500 3.822 2.079 4.097 . 0 0 "[ . 1]" 1 680 1 121 SER HA 1 124 ASN H 4.570 . 4.570 3.407 3.229 3.737 . 0 0 "[ . 1]" 1 681 1 88 SER HB2 1 127 ASN HB3 4.660 . 4.660 3.040 2.356 4.076 . 0 0 "[ . 1]" 1 682 1 88 SER HB3 1 127 ASN HB3 4.660 . 4.660 2.902 2.339 3.705 . 0 0 "[ . 1]" 1 683 1 126 ILE MD 1 131 ARG QG 4.940 . 4.940 3.152 2.216 4.237 . 0 0 "[ . 1]" 1 684 1 76 GLU H 1 76 GLU QG 4.450 . 4.450 3.694 1.864 4.017 . 0 0 "[ . 1]" 1 685 1 76 GLU QG 1 77 GLU H 4.460 . 4.460 3.796 2.570 4.457 . 0 0 "[ . 1]" 1 686 1 74 ILE HB 1 75 ILE H 4.460 . 4.460 2.672 2.222 4.254 . 0 0 "[ . 1]" 1 687 1 15 SER QB 1 18 LYS QG 5.050 . 5.050 4.661 4.130 5.247 0.197 4 0 "[ . 1]" 1 688 1 32 THR HA 1 36 VAL HA 5.660 . 5.660 5.023 4.761 5.350 . 0 0 "[ . 1]" 1 689 1 101 VAL HB 1 102 VAL H 4.830 . 4.830 3.505 2.116 3.992 . 0 0 "[ . 1]" 1 690 1 67 GLU H 1 67 GLU HG3 4.560 . 4.560 3.322 2.328 4.394 . 0 0 "[ . 1]" 1 691 1 67 GLU H 1 67 GLU HG2 4.560 . 4.560 3.025 2.035 4.494 . 0 0 "[ . 1]" 1 692 1 27 ILE MG 1 64 ALA HA 4.770 . 4.770 3.513 3.279 4.021 . 0 0 "[ . 1]" 1 693 1 21 LYS H 1 21 LYS QE 4.610 . 4.610 3.693 3.453 3.876 . 0 0 "[ . 1]" 1 694 1 108 VAL HB 1 109 GLY H 4.620 . 4.620 4.375 4.169 4.522 . 0 0 "[ . 1]" 1 695 1 65 ILE HB 1 66 VAL H 5.040 . 5.040 2.519 2.331 2.833 . 0 0 "[ . 1]" 1 696 1 62 VAL HA 1 65 ILE HB 5.220 . 5.220 3.778 3.436 4.179 . 0 0 "[ . 1]" 1 697 1 65 ILE MG 1 68 THR HA 5.830 . 5.830 5.849 5.437 6.085 0.255 9 0 "[ . 1]" 1 698 1 71 PHE HA 1 74 ILE HB 4.330 . 4.330 3.380 2.956 4.766 0.436 3 0 "[ . 1]" 1 699 1 129 ALA HA 1 133 LEU H 5.890 . 5.890 4.685 3.467 5.940 0.050 3 0 "[ . 1]" 1 700 1 83 LYS QE 1 129 ALA MB 5.190 . 5.190 4.512 3.211 5.345 0.155 4 0 "[ . 1]" 1 701 1 91 PHE QD 1 94 MET ME 3.310 . 3.310 3.544 3.172 4.099 0.789 10 1 "[ . +]" 1 702 1 24 ILE HB 1 25 LEU H 4.720 . 4.720 2.878 2.723 3.273 . 0 0 "[ . 1]" 1 703 1 68 THR H 1 105 LEU MD2 6.000 . 6.000 5.184 4.852 5.563 . 0 0 "[ . 1]" 1 704 1 91 PHE H 1 93 ALA MB 5.210 . 5.210 5.115 4.777 5.374 0.164 5 0 "[ . 1]" 1 705 1 62 VAL HA 1 65 ILE QG 4.580 . 4.580 3.154 2.510 3.505 . 0 0 "[ . 1]" 1 706 1 143 LEU H 1 143 LEU HG 4.820 . 4.820 3.560 1.835 4.436 . 0 0 "[ . 1]" 1 707 1 108 VAL MG2 1 109 GLY H 5.110 . 5.110 3.631 3.360 4.048 . 0 0 "[ . 1]" 1 708 1 108 VAL MG2 1 110 ILE H 5.130 . 5.130 3.084 2.546 3.979 . 0 0 "[ . 1]" 1 709 1 107 ASP HA 1 108 VAL MG2 5.270 . 5.270 4.735 4.196 5.097 . 0 0 "[ . 1]" 1 710 1 32 THR MG 1 38 PHE QD 3.770 . 3.770 3.427 2.320 3.968 0.198 5 0 "[ . 1]" 1 711 1 38 PHE HA 1 38 PHE QD 3.860 . 3.860 2.992 2.331 3.712 . 0 0 "[ . 1]" 1 712 1 79 ALA MB 1 91 PHE QD 4.180 . 4.180 3.995 3.499 4.331 0.151 5 0 "[ . 1]" 1 713 1 91 PHE QD 1 126 ILE MG 5.000 . 5.000 4.827 3.937 5.444 0.444 3 0 "[ . 1]" 1 714 1 41 PHE HA 1 41 PHE QD 3.510 . 3.510 2.704 2.340 3.701 0.191 5 0 "[ . 1]" 1 715 1 91 PHE QD 1 129 ALA MB 4.090 . 4.090 3.756 3.028 4.538 0.448 9 0 "[ . 1]" 1 716 1 71 PHE QE 1 97 LEU MD1 4.140 . 4.140 4.101 3.692 4.328 0.188 2 0 "[ . 1]" 1 717 1 71 PHE QE 1 97 LEU MD2 4.140 . 4.140 3.277 2.912 3.662 . 0 0 "[ . 1]" 1 718 1 71 PHE QD 1 74 ILE MD 3.870 . 3.870 2.683 2.311 4.051 0.181 9 0 "[ . 1]" 1 719 1 126 ILE MD 1 131 ARG QD 3.810 . 3.810 3.183 2.461 3.949 0.139 4 0 "[ . 1]" 1 720 1 108 VAL H 1 109 GLY H 4.690 . 4.690 2.856 2.549 3.133 . 0 0 "[ . 1]" 1 721 1 37 LEU H 1 38 PHE H 5.620 . 5.620 4.350 3.812 4.605 . 0 0 "[ . 1]" 1 722 1 166 LYS QG 1 167 LYS H 5.930 . 5.930 3.636 2.145 4.837 . 0 0 "[ . 1]" 1 723 1 65 ILE H 1 66 VAL H 5.140 . 5.140 2.991 2.870 3.115 . 0 0 "[ . 1]" 1 724 1 66 VAL H 1 67 GLU H 5.340 . 5.340 2.760 2.621 2.858 . 0 0 "[ . 1]" 1 725 1 134 ALA H 1 136 LYS H 5.630 . 5.630 4.352 4.038 4.853 . 0 0 "[ . 1]" 1 726 1 6 VAL H 1 7 GLU H 4.350 . 4.350 3.876 2.297 4.561 0.211 5 0 "[ . 1]" 1 727 1 63 GLN HA 1 66 VAL H 5.450 . 5.450 3.691 3.576 3.820 . 0 0 "[ . 1]" 1 728 1 132 LEU HA 1 134 ALA H 4.940 . 4.940 3.783 3.479 4.153 . 0 0 "[ . 1]" 1 729 1 10 ASN QB 1 11 ALA H 4.890 . 4.890 3.669 2.874 3.952 . 0 0 "[ . 1]" 1 730 1 7 GLU H 1 7 GLU QG 4.200 . 4.200 2.529 1.976 3.245 . 0 0 "[ . 1]" 1 731 1 134 ALA H 1 136 LYS QB 5.600 . 5.600 5.209 4.737 5.537 . 0 0 "[ . 1]" 1 732 1 133 LEU HB2 1 134 ALA H 4.920 . 4.920 3.242 2.810 3.794 . 0 0 "[ . 1]" 1 733 1 66 VAL H 1 66 VAL MG1 4.380 . 4.380 3.738 3.721 3.750 . 0 0 "[ . 1]" 1 734 1 6 VAL MG1 1 7 GLU H 4.450 . 4.450 3.569 1.885 4.324 . 0 0 "[ . 1]" 1 735 1 78 GLU H 1 79 ALA H 4.760 . 4.760 2.356 2.237 2.582 . 0 0 "[ . 1]" 1 736 1 23 LYS H 1 24 ILE H 5.210 . 5.210 2.841 2.710 2.935 . 0 0 "[ . 1]" 1 737 1 102 VAL H 1 103 GLU H 4.960 . 4.960 2.510 2.378 2.730 . 0 0 "[ . 1]" 1 738 1 31 ALA H 1 32 THR H 5.290 . 5.290 2.680 2.550 2.844 . 0 0 "[ . 1]" 1 739 1 30 GLU H 1 31 ALA H 4.730 . 4.730 2.931 2.554 3.116 . 0 0 "[ . 1]" 1 740 1 11 ALA H 1 12 ALA H 4.620 . 4.620 2.672 2.293 3.098 . 0 0 "[ . 1]" 1 741 1 136 LYS H 1 137 ALA H 4.760 . 4.760 2.711 2.634 2.849 . 0 0 "[ . 1]" 1 742 1 39 GLU H 1 40 ALA H 4.830 . 4.830 2.596 2.076 2.954 . 0 0 "[ . 1]" 1 743 1 4 GLY H 1 5 LEU H 4.800 . 4.800 2.635 2.344 2.996 . 0 0 "[ . 1]" 1 744 1 135 ALA H 1 136 LYS H 4.860 . 4.860 2.689 2.494 3.009 . 0 0 "[ . 1]" 1 745 1 59 GLU H 1 60 ALA H 5.110 . 5.110 2.539 2.351 2.644 . 0 0 "[ . 1]" 1 746 1 83 LYS H 1 84 GLU H 4.970 . 4.970 2.764 2.531 2.914 . 0 0 "[ . 1]" 1 747 1 79 ALA H 1 80 LEU H 4.860 . 4.860 2.597 2.367 2.775 . 0 0 "[ . 1]" 1 748 1 21 LYS H 1 23 LYS H 5.570 . 5.570 3.869 3.693 4.141 . 0 0 "[ . 1]" 1 749 1 23 LYS H 1 25 LEU H 5.860 . 5.860 4.395 3.684 4.594 . 0 0 "[ . 1]" 1 750 1 137 ALA H 1 138 GLN H 4.670 . 4.670 2.834 2.707 2.883 . 0 0 "[ . 1]" 1 751 1 60 ALA H 1 61 LYS H 4.880 . 4.880 2.535 2.353 2.651 . 0 0 "[ . 1]" 1 752 1 110 ILE H 1 111 ILE H 5.790 . 5.790 4.421 4.198 4.562 . 0 0 "[ . 1]" 1 753 1 122 LYS H 1 123 ASN H 4.730 . 4.730 2.693 2.628 2.763 . 0 0 "[ . 1]" 1 754 1 121 SER H 1 122 LYS H 4.270 . 4.270 2.560 2.422 2.694 . 0 0 "[ . 1]" 1 755 1 38 PHE H 1 38 PHE QD 4.960 . 4.960 3.029 1.878 4.381 . 0 0 "[ . 1]" 1 756 1 128 THR H 1 129 ALA H 4.990 . 4.990 3.836 2.646 4.397 . 0 0 "[ . 1]" 1 757 1 108 VAL H 1 110 ILE H 5.610 . 5.610 3.469 2.858 4.062 . 0 0 "[ . 1]" 1 758 1 82 LEU H 1 83 LYS H 4.610 . 4.610 2.603 2.132 2.842 . 0 0 "[ . 1]" 1 759 1 19 ASP HA 1 23 LYS H 4.520 . 4.520 4.163 3.729 4.376 . 0 0 "[ . 1]" 1 760 1 18 LYS H 1 19 ASP HA 5.790 . 5.790 5.226 5.105 5.348 . 0 0 "[ . 1]" 1 761 1 15 SER HA 1 18 LYS H 5.870 . 5.870 3.828 3.230 4.152 . 0 0 "[ . 1]" 1 762 1 128 THR HB 1 129 ALA H 4.550 . 4.550 2.956 1.984 4.309 . 0 0 "[ . 1]" 1 763 1 76 GLU HA 1 79 ALA H 5.450 . 5.450 3.603 3.323 3.801 . 0 0 "[ . 1]" 1 764 1 163 SER QB 1 164 LYS H 5.170 . 5.170 3.266 1.812 4.048 . 0 0 "[ . 1]" 1 765 1 100 GLU HA 1 103 GLU H 4.590 . 4.590 3.385 3.222 3.576 . 0 0 "[ . 1]" 1 766 1 133 LEU HA 1 137 ALA H 5.280 . 5.280 4.291 3.852 4.713 . 0 0 "[ . 1]" 1 767 1 133 LEU HA 1 135 ALA H 5.280 . 5.280 4.053 3.616 5.061 . 0 0 "[ . 1]" 1 768 1 106 GLU HA 1 110 ILE H 5.180 . 5.180 2.650 2.492 2.987 . 0 0 "[ . 1]" 1 769 1 119 GLU HA 1 122 LYS H 4.430 . 4.430 3.269 2.974 3.644 . 0 0 "[ . 1]" 1 770 1 23 LYS H 1 23 LYS QE 5.240 . 5.240 4.972 4.790 5.299 0.059 8 0 "[ . 1]" 1 771 1 78 GLU QG 1 79 ALA H 5.830 . 5.830 4.089 3.581 4.637 . 0 0 "[ . 1]" 1 772 1 100 GLU QB 1 103 GLU H 4.690 . 4.690 4.634 4.501 4.792 0.102 1 0 "[ . 1]" 1 773 1 30 GLU QB 1 31 ALA H 4.630 . 4.630 2.359 1.974 3.350 . 0 0 "[ . 1]" 1 774 1 136 LYS QB 1 137 ALA H 4.670 . 4.670 2.383 2.255 2.579 . 0 0 "[ . 1]" 1 775 1 39 GLU QG 1 40 ALA H 4.910 . 4.910 3.589 1.959 4.345 . 0 0 "[ . 1]" 1 776 1 94 MET ME 1 135 ALA H 6.000 . 6.000 5.886 5.642 6.231 0.231 2 0 "[ . 1]" 1 777 1 59 GLU QG 1 60 ALA H 5.990 . 5.990 4.028 3.679 4.372 . 0 0 "[ . 1]" 1 778 1 120 GLU QB 1 122 LYS H 5.500 . 5.500 4.371 4.100 4.551 . 0 0 "[ . 1]" 1 779 1 23 LYS H 1 23 LYS QD 4.470 . 4.470 3.932 3.756 4.403 . 0 0 "[ . 1]" 1 780 1 26 LYS QB 1 27 ILE H 4.660 . 4.660 2.529 2.324 2.798 . 0 0 "[ . 1]" 1 781 1 65 ILE H 1 65 ILE QG 5.050 . 5.050 1.772 1.734 1.807 0.066 6 0 "[ . 1]" 1 782 1 164 LYS QB 1 165 LYS H 5.320 . 5.320 3.140 2.463 3.917 . 0 0 "[ . 1]" 1 783 1 158 LYS QB 1 159 LYS H 5.330 . 5.330 3.336 1.847 4.045 . 0 0 "[ . 1]" 1 784 1 136 LYS QD 1 137 ALA H 6.000 . 6.000 3.864 2.614 4.536 . 0 0 "[ . 1]" 1 785 1 57 LEU QB 1 60 ALA H 5.610 . 5.610 4.928 4.662 5.377 . 0 0 "[ . 1]" 1 786 1 105 LEU QB 1 110 ILE H 5.600 . 5.600 4.327 3.934 4.751 . 0 0 "[ . 1]" 1 787 1 83 LYS H 1 83 LYS QB 3.830 . 3.830 2.273 2.207 2.507 . 0 0 "[ . 1]" 1 788 1 83 LYS H 1 83 LYS QD 4.870 . 4.870 4.306 3.580 4.658 . 0 0 "[ . 1]" 1 789 1 75 ILE MG 1 79 ALA H 4.840 . 4.840 3.789 3.136 4.908 0.068 8 0 "[ . 1]" 1 790 1 20 LEU MD2 1 23 LYS H 6.000 . 6.000 4.504 3.682 6.028 0.028 9 0 "[ . 1]" 1 791 1 102 VAL MG1 1 103 GLU H 4.590 . 4.590 3.754 2.774 4.228 . 0 0 "[ . 1]" 1 792 1 40 ALA H 1 44 LEU MD1 5.290 . 5.290 4.675 3.338 5.500 0.210 3 0 "[ . 1]" 1 793 1 3 ILE MG 1 5 LEU H 4.640 . 4.640 3.557 1.960 4.770 0.130 10 0 "[ . 1]" 1 794 1 27 ILE MG 1 60 ALA H 5.470 . 5.470 4.927 4.622 5.219 . 0 0 "[ . 1]" 1 795 1 110 ILE H 1 110 ILE MG 4.170 . 4.170 3.392 1.947 3.828 . 0 0 "[ . 1]" 1 796 1 126 ILE MG 1 129 ALA H 6.130 . 6.130 5.897 5.002 6.312 0.182 1 0 "[ . 1]" 1 797 1 126 ILE H 1 126 ILE QG 5.070 . 5.070 3.007 2.258 4.058 . 0 0 "[ . 1]" 1 798 1 113 LEU H 1 114 LYS H 4.530 . 4.530 2.834 2.026 3.290 . 0 0 "[ . 1]" 1 799 1 147 LYS H 1 148 GLU H 5.300 . 5.300 2.698 2.620 2.773 . 0 0 "[ . 1]" 1 800 1 10 ASN H 1 11 ALA H 4.790 . 4.790 2.622 1.921 2.939 . 0 0 "[ . 1]" 1 801 1 38 PHE H 1 39 GLU H 5.160 . 5.160 2.501 1.808 3.496 . 0 0 "[ . 1]" 1 802 1 13 LEU H 1 14 GLU H 4.970 . 4.970 2.743 2.620 2.836 . 0 0 "[ . 1]" 1 803 1 143 LEU H 1 144 LYS H 5.000 . 5.000 2.721 2.585 2.948 . 0 0 "[ . 1]" 1 804 1 137 ALA H 1 139 ILE H 5.680 . 5.680 4.252 4.162 4.303 . 0 0 "[ . 1]" 1 805 1 26 LYS H 1 27 ILE H 4.820 . 4.820 2.382 2.264 2.544 . 0 0 "[ . 1]" 1 806 1 96 ASP H 1 97 LEU H 5.030 . 5.030 2.457 2.311 2.552 . 0 0 "[ . 1]" 1 807 1 69 GLY H 1 70 LYS H 4.870 . 4.870 2.697 2.522 2.848 . 0 0 "[ . 1]" 1 808 1 71 PHE H 1 72 LEU H 5.260 . 5.260 2.498 2.393 2.621 . 0 0 "[ . 1]" 1 809 1 139 ILE H 1 140 GLU H 4.920 . 4.920 2.651 2.460 2.820 . 0 0 "[ . 1]" 1 810 1 118 LEU H 1 119 GLU H 4.230 . 4.230 2.717 2.592 2.804 . 0 0 "[ . 1]" 1 811 1 118 LEU H 1 120 GLU H 5.760 . 5.760 4.004 3.855 4.218 . 0 0 "[ . 1]" 1 812 1 116 ARG H 1 118 LEU H 5.900 . 5.900 3.890 3.783 4.002 . 0 0 "[ . 1]" 1 813 1 14 GLU H 1 16 SER H 5.800 . 5.800 4.305 3.976 4.652 . 0 0 "[ . 1]" 1 814 1 94 MET H 1 95 PHE H 4.910 . 4.910 2.639 2.477 2.741 . 0 0 "[ . 1]" 1 815 1 92 LEU H 1 93 ALA H 4.890 . 4.890 2.743 2.645 2.915 . 0 0 "[ . 1]" 1 816 1 119 GLU H 1 120 GLU H 4.320 . 4.320 2.644 2.496 2.775 . 0 0 "[ . 1]" 1 817 1 113 LEU H 1 115 ALA H 5.770 . 5.770 4.972 3.191 5.657 . 0 0 "[ . 1]" 1 818 1 20 LEU H 1 21 LYS H 4.820 . 4.820 2.728 2.347 2.966 . 0 0 "[ . 1]" 1 819 1 36 VAL H 1 37 LEU H 4.750 . 4.750 4.580 4.512 4.627 . 0 0 "[ . 1]" 1 820 1 38 PHE QD 1 39 GLU H 5.370 . 5.370 3.999 2.692 4.920 . 0 0 "[ . 1]" 1 821 1 95 PHE H 1 95 PHE QE 6.130 . 6.130 6.190 6.158 6.206 0.076 10 0 "[ . 1]" 1 822 1 34 LYS H 1 36 VAL H 5.610 . 5.610 3.418 2.971 4.471 . 0 0 "[ . 1]" 1 823 1 70 LYS H 1 71 PHE QD 5.900 . 5.900 6.219 6.013 6.353 0.453 9 0 "[ . 1]" 1 824 1 71 PHE H 1 71 PHE QE 6.410 . 6.410 6.175 6.107 6.224 . 0 0 "[ . 1]" 1 825 1 73 LYS H 1 74 ILE H 4.530 . 4.530 2.472 2.347 2.583 . 0 0 "[ . 1]" 1 826 1 137 ALA HA 1 140 GLU H 5.390 . 5.390 3.684 3.427 4.031 . 0 0 "[ . 1]" 1 827 1 37 LEU HA 1 39 GLU H 5.510 . 5.510 3.756 3.135 5.232 . 0 0 "[ . 1]" 1 828 1 141 ASN HA 1 144 LYS H 5.400 . 5.400 3.627 3.125 3.948 . 0 0 "[ . 1]" 1 829 1 116 ARG HA 1 119 GLU H 4.660 . 4.660 3.740 3.558 3.949 . 0 0 "[ . 1]" 1 830 1 111 ILE HA 1 113 LEU H 6.780 . 6.780 5.947 4.450 6.584 . 0 0 "[ . 1]" 1 831 1 32 THR HA 1 36 VAL H 4.830 . 4.830 3.099 2.330 3.748 . 0 0 "[ . 1]" 1 832 1 26 LYS HA 1 29 LYS H 4.540 . 4.540 3.460 3.053 3.837 . 0 0 "[ . 1]" 1 833 1 27 ILE HA 1 29 LYS H 5.700 . 5.700 4.378 3.865 4.607 . 0 0 "[ . 1]" 1 834 1 113 LEU H 1 114 LYS HA 5.880 . 5.880 4.630 3.937 5.008 . 0 0 "[ . 1]" 1 835 1 20 LEU H 1 101 VAL HA 6.000 . 6.000 6.262 6.018 6.434 0.434 9 0 "[ . 1]" 1 836 1 38 PHE HB2 1 39 GLU H 5.180 . 5.180 3.838 2.592 4.617 . 0 0 "[ . 1]" 1 837 1 38 PHE HB3 1 39 GLU H 5.180 . 5.180 3.904 2.660 4.458 . 0 0 "[ . 1]" 1 838 1 8 ARG H 1 8 ARG QD 5.850 . 5.850 4.267 2.951 5.409 . 0 0 "[ . 1]" 1 839 1 91 PHE HB2 1 92 LEU H 5.790 . 5.790 3.332 2.880 4.354 . 0 0 "[ . 1]" 1 840 1 119 GLU H 1 122 LYS QE 5.640 . 5.640 4.892 4.134 5.534 . 0 0 "[ . 1]" 1 841 1 96 ASP HB2 1 97 LEU H 5.190 . 5.190 3.929 3.102 4.212 . 0 0 "[ . 1]" 1 842 1 139 ILE HB 1 140 GLU H 4.300 . 4.300 2.541 2.346 2.702 . 0 0 "[ . 1]" 1 843 1 39 GLU H 1 39 GLU QG 4.670 . 4.670 2.770 1.847 4.099 . 0 0 "[ . 1]" 1 844 1 94 MET ME 1 95 PHE H 4.780 . 4.780 3.586 3.141 4.129 . 0 0 "[ . 1]" 1 845 1 153 GLU QG 1 154 ASN H 6.000 . 6.000 4.065 3.494 4.467 . 0 0 "[ . 1]" 1 846 1 7 GLU QG 1 8 ARG H 5.520 . 5.520 4.170 3.644 4.692 . 0 0 "[ . 1]" 1 847 1 91 PHE HB3 1 92 LEU H 5.790 . 5.790 3.391 2.688 3.804 . 0 0 "[ . 1]" 1 848 1 98 MET QG 1 139 ILE H 7.000 . 7.000 6.045 5.162 6.762 . 0 0 "[ . 1]" 1 849 1 96 ASP HB3 1 97 LEU H 5.190 . 5.190 3.335 3.088 3.958 . 0 0 "[ . 1]" 1 850 1 136 LYS QG 1 140 GLU H 5.300 . 5.300 3.953 3.231 5.485 0.185 4 0 "[ . 1]" 1 851 1 137 ALA MB 1 140 GLU H 5.990 . 5.990 4.816 4.620 5.148 . 0 0 "[ . 1]" 1 852 1 147 LYS H 1 149 LYS QD 6.000 . 6.000 5.450 4.578 6.169 0.169 3 0 "[ . 1]" 1 853 1 144 LYS QG 1 147 LYS H 6.000 . 6.000 5.376 4.764 5.682 . 0 0 "[ . 1]" 1 854 1 10 ASN H 1 11 ALA MB 5.730 . 5.730 4.145 3.649 4.583 . 0 0 "[ . 1]" 1 855 1 23 LYS QG 1 24 ILE H 6.000 . 6.000 4.004 3.227 4.689 . 0 0 "[ . 1]" 1 856 1 27 ILE HB 1 28 LYS H 4.550 . 4.550 2.642 1.875 3.120 . 0 0 "[ . 1]" 1 857 1 28 LYS QB 1 29 LYS H 3.990 . 3.990 2.720 2.394 3.587 . 0 0 "[ . 1]" 1 858 1 92 LEU HG 1 95 PHE H 6.000 . 6.000 5.685 5.026 6.338 0.338 5 0 "[ . 1]" 1 859 1 93 ALA MB 1 95 PHE H 5.480 . 5.480 4.510 4.227 4.644 . 0 0 "[ . 1]" 1 860 1 8 ARG H 1 8 ARG HB3 4.110 . 4.110 3.552 2.544 4.027 . 0 0 "[ . 1]" 1 861 1 45 LYS H 1 45 LYS QG 5.060 . 5.060 2.860 1.873 4.033 . 0 0 "[ . 1]" 1 862 1 6 VAL H 1 6 VAL HB 3.620 . 3.620 3.451 2.584 3.887 0.267 5 0 "[ . 1]" 1 863 1 135 ALA MB 1 139 ILE H 5.190 . 5.190 4.934 4.433 5.199 0.009 3 0 "[ . 1]" 1 864 1 26 LYS H 1 27 ILE HB 4.890 . 4.890 4.620 4.570 4.698 . 0 0 "[ . 1]" 1 865 1 92 LEU HB2 1 93 ALA H 5.350 . 5.350 3.032 2.557 3.607 . 0 0 "[ . 1]" 1 866 1 92 LEU HB3 1 93 ALA H 5.350 . 5.350 3.224 2.386 3.940 . 0 0 "[ . 1]" 1 867 1 31 ALA MB 1 36 VAL H 5.320 . 5.320 4.653 4.255 5.089 . 0 0 "[ . 1]" 1 868 1 36 VAL H 1 37 LEU HG 6.000 . 6.000 5.551 4.983 5.960 . 0 0 "[ . 1]" 1 869 1 70 LYS H 1 70 LYS QD 4.590 . 4.590 3.633 2.223 4.384 . 0 0 "[ . 1]" 1 870 1 73 LYS QG 1 74 ILE H 5.690 . 5.690 4.209 4.012 4.306 . 0 0 "[ . 1]" 1 871 1 139 ILE MG 1 140 GLU H 4.630 . 4.630 3.474 3.121 3.723 . 0 0 "[ . 1]" 1 872 1 27 ILE MG 1 28 LYS H 4.820 . 4.820 3.573 2.903 3.944 . 0 0 "[ . 1]" 1 873 1 24 ILE MG 1 28 LYS H 5.450 . 5.450 3.186 2.717 3.555 . 0 0 "[ . 1]" 1 874 1 27 ILE MG 1 64 ALA H 5.280 . 5.280 3.046 2.711 3.692 . 0 0 "[ . 1]" 1 875 1 27 ILE MD 1 64 ALA H 4.960 . 4.960 4.103 3.672 4.659 . 0 0 "[ . 1]" 1 876 1 44 LEU MD1 1 45 LYS H 5.860 . 5.860 4.011 1.841 5.176 . 0 0 "[ . 1]" 1 877 1 139 ILE H 1 139 ILE MG 4.580 . 4.580 3.768 3.749 3.783 . 0 0 "[ . 1]" 1 878 1 20 LEU H 1 20 LEU MD1 5.070 . 5.070 4.201 3.996 4.309 . 0 0 "[ . 1]" 1 879 1 57 LEU H 1 57 LEU MD1 4.780 . 4.780 4.184 3.972 4.415 . 0 0 "[ . 1]" 1 880 1 71 PHE H 1 74 ILE MG 7.000 . 7.000 6.428 4.138 6.759 . 0 0 "[ . 1]" 1 881 1 74 ILE H 1 74 ILE QG 5.030 . 5.030 2.167 1.998 2.709 . 0 0 "[ . 1]" 1 882 1 28 LYS H 1 108 VAL MG1 5.630 . 5.630 5.215 4.080 5.709 0.079 10 0 "[ . 1]" 1 883 1 95 PHE H 1 126 ILE MG 6.000 . 6.000 5.593 4.915 6.126 0.126 7 0 "[ . 1]" 1 884 1 114 LYS H 1 115 ALA H 4.750 . 4.750 2.857 2.664 3.087 . 0 0 "[ . 1]" 1 885 1 140 GLU H 1 141 ASN H 4.920 . 4.920 2.706 2.578 2.816 . 0 0 "[ . 1]" 1 886 1 86 GLY H 1 87 ASN H 5.040 . 5.040 2.615 2.522 2.741 . 0 0 "[ . 1]" 1 887 1 152 ILE H 1 153 GLU H 5.180 . 5.180 2.877 1.718 4.428 0.082 5 0 "[ . 1]" 1 888 1 141 ASN H 1 142 GLN H 4.700 . 4.700 2.710 2.488 2.998 . 0 0 "[ . 1]" 1 889 1 117 VAL H 1 118 LEU H 4.540 . 4.540 2.576 2.472 2.687 . 0 0 "[ . 1]" 1 890 1 98 MET H 1 99 LEU H 5.070 . 5.070 2.690 2.363 2.824 . 0 0 "[ . 1]" 1 891 1 103 GLU H 1 104 SER H 4.910 . 4.910 2.391 2.347 2.438 . 0 0 "[ . 1]" 1 892 1 130 GLU H 1 131 ARG H 5.280 . 5.280 3.017 2.522 3.577 . 0 0 "[ . 1]" 1 893 1 136 LYS H 1 138 GLN H 5.740 . 5.740 4.121 3.932 4.259 . 0 0 "[ . 1]" 1 894 1 148 GLU H 1 149 LYS H 4.990 . 4.990 2.590 2.532 2.675 . 0 0 "[ . 1]" 1 895 1 24 ILE H 1 25 LEU H 5.240 . 5.240 2.746 2.526 2.900 . 0 0 "[ . 1]" 1 896 1 146 VAL H 1 147 LYS H 5.160 . 5.160 2.661 2.463 2.824 . 0 0 "[ . 1]" 1 897 1 72 LEU H 1 73 LYS H 5.270 . 5.270 2.603 2.503 2.691 . 0 0 "[ . 1]" 1 898 1 143 LEU H 1 145 VAL H 6.000 . 6.000 3.988 3.750 4.603 . 0 0 "[ . 1]" 1 899 1 145 VAL H 1 147 LYS H 6.000 . 6.000 3.890 3.582 4.402 . 0 0 "[ . 1]" 1 900 1 91 PHE H 1 92 LEU H 4.660 . 4.660 2.549 2.389 2.796 . 0 0 "[ . 1]" 1 901 1 133 LEU H 1 134 ALA H 4.580 . 4.580 2.742 2.617 2.834 . 0 0 "[ . 1]" 1 902 1 142 GLN H 1 143 LEU H 4.700 . 4.700 2.665 2.321 2.990 . 0 0 "[ . 1]" 1 903 1 17 SER H 1 18 LYS H 5.120 . 5.120 2.652 2.487 2.738 . 0 0 "[ . 1]" 1 904 1 62 VAL H 1 63 GLN H 5.130 . 5.130 2.448 2.223 2.850 . 0 0 "[ . 1]" 1 905 1 56 ALA H 1 57 LEU H 5.050 . 5.050 2.544 2.360 2.928 . 0 0 "[ . 1]" 1 906 1 21 LYS H 1 22 ASN H 4.600 . 4.600 2.789 2.667 2.977 . 0 0 "[ . 1]" 1 907 1 99 LEU H 1 100 GLU H 4.800 . 4.800 2.371 2.288 2.449 . 0 0 "[ . 1]" 1 908 1 101 VAL H 1 102 VAL H 4.860 . 4.860 2.865 2.732 3.083 . 0 0 "[ . 1]" 1 909 1 18 LYS H 1 19 ASP H 4.700 . 4.700 2.644 2.498 2.776 . 0 0 "[ . 1]" 1 910 1 115 ALA H 1 116 ARG H 4.680 . 4.680 2.872 2.793 2.938 . 0 0 "[ . 1]" 1 911 1 149 LYS H 1 150 GLN H 5.000 . 5.000 2.641 2.431 2.748 . 0 0 "[ . 1]" 1 912 1 106 GLU H 1 107 ASP H 4.730 . 4.730 2.756 2.540 2.883 . 0 0 "[ . 1]" 1 913 1 75 ILE H 1 76 GLU H 5.030 . 5.030 2.612 2.367 2.738 . 0 0 "[ . 1]" 1 914 1 144 LYS H 1 145 VAL H 4.880 . 4.880 2.618 2.450 3.072 . 0 0 "[ . 1]" 1 915 1 104 SER H 1 105 LEU H 4.870 . 4.870 2.583 2.449 2.726 . 0 0 "[ . 1]" 1 916 1 90 GLN H 1 91 PHE H 4.420 . 4.420 2.598 2.390 2.762 . 0 0 "[ . 1]" 1 917 1 95 PHE QD 1 96 ASP H 5.470 . 5.470 3.608 3.407 3.879 . 0 0 "[ . 1]" 1 918 1 71 PHE QD 1 72 LEU H 5.220 . 5.220 4.143 3.781 4.452 . 0 0 "[ . 1]" 1 919 1 41 PHE H 1 41 PHE QD 4.840 . 4.840 3.400 2.070 4.506 . 0 0 "[ . 1]" 1 920 1 128 THR H 1 131 ARG H 6.000 . 6.000 5.432 3.907 6.422 0.422 3 0 "[ . 1]" 1 921 1 120 GLU H 1 122 LYS H 5.660 . 5.660 3.889 3.639 3.990 . 0 0 "[ . 1]" 1 922 1 145 VAL H 1 146 VAL H 4.770 . 4.770 2.525 2.294 3.024 . 0 0 "[ . 1]" 1 923 1 107 ASP H 1 108 VAL H 4.670 . 4.670 2.712 2.494 2.934 . 0 0 "[ . 1]" 1 924 1 74 ILE H 1 75 ILE H 4.850 . 4.850 2.473 2.300 2.730 . 0 0 "[ . 1]" 1 925 1 138 GLN HA 1 141 ASN H 5.110 . 5.110 3.618 3.371 3.963 . 0 0 "[ . 1]" 1 926 1 60 ALA HA 1 63 GLN H 5.540 . 5.540 3.298 2.916 3.830 . 0 0 "[ . 1]" 1 927 1 22 ASN HA 1 25 LEU H 5.570 . 5.570 3.600 3.373 3.947 . 0 0 "[ . 1]" 1 928 1 95 PHE HB2 1 96 ASP H 5.540 . 5.540 3.765 3.684 3.826 . 0 0 "[ . 1]" 1 929 1 133 LEU HA 1 136 LYS H 4.740 . 4.740 3.461 3.198 3.686 . 0 0 "[ . 1]" 1 930 1 65 ILE HA 1 68 THR H 5.830 . 5.830 3.257 2.943 3.457 . 0 0 "[ . 1]" 1 931 1 100 GLU HA 1 102 VAL H 5.940 . 5.940 4.415 3.726 5.015 . 0 0 "[ . 1]" 1 932 1 114 LYS HA 1 117 VAL H 5.580 . 5.580 3.187 2.894 3.934 . 0 0 "[ . 1]" 1 933 1 139 ILE HA 1 142 GLN H 5.310 . 5.310 3.509 3.261 3.731 . 0 0 "[ . 1]" 1 934 1 100 GLU HA 1 104 SER H 5.610 . 5.610 4.557 4.101 5.303 . 0 0 "[ . 1]" 1 935 1 104 SER H 1 105 LEU HA 6.000 . 6.000 5.155 5.001 5.306 . 0 0 "[ . 1]" 1 936 1 101 VAL HA 1 104 SER H 5.450 . 5.450 3.756 3.514 3.889 . 0 0 "[ . 1]" 1 937 1 146 VAL HA 1 149 LYS H 5.480 . 5.480 3.414 3.160 3.583 . 0 0 "[ . 1]" 1 938 1 72 LEU HA 1 75 ILE H 5.320 . 5.320 3.517 3.388 3.718 . 0 0 "[ . 1]" 1 939 1 102 VAL HA 1 105 LEU H 5.800 . 5.800 3.640 3.447 3.759 . 0 0 "[ . 1]" 1 940 1 95 PHE HB3 1 96 ASP H 5.540 . 5.540 2.511 2.434 2.704 . 0 0 "[ . 1]" 1 941 1 149 LYS H 1 149 LYS QE 5.000 . 5.000 4.462 3.859 5.042 0.042 7 0 "[ . 1]" 1 942 1 142 GLN QB 1 143 LEU H 5.100 . 5.100 2.557 2.348 2.869 . 0 0 "[ . 1]" 1 943 1 98 MET QG 1 99 LEU H 5.860 . 5.860 4.139 4.005 4.297 . 0 0 "[ . 1]" 1 944 1 98 MET HB2 1 99 LEU H 4.780 . 4.780 3.796 2.863 3.998 . 0 0 "[ . 1]" 1 945 1 65 ILE HB 1 68 THR H 5.450 . 5.450 5.292 5.057 5.453 0.003 8 0 "[ . 1]" 1 946 1 152 ILE H 1 153 GLU QG 5.600 . 5.600 3.644 2.632 5.376 . 0 0 "[ . 1]" 1 947 1 50 VAL HB 1 51 THR H 5.040 . 5.040 3.485 1.847 4.513 . 0 0 "[ . 1]" 1 948 1 142 GLN H 1 145 VAL HB 5.370 . 5.370 5.213 4.748 5.570 0.200 10 0 "[ . 1]" 1 949 1 139 ILE HB 1 142 GLN H 5.670 . 5.670 5.513 5.146 5.965 0.295 6 0 "[ . 1]" 1 950 1 101 VAL HB 1 104 SER H 5.580 . 5.580 5.644 5.511 5.903 0.323 4 0 "[ . 1]" 1 951 1 106 GLU QB 1 107 ASP H 4.870 . 4.870 3.104 2.931 3.675 . 0 0 "[ . 1]" 1 952 1 90 GLN QG 1 91 PHE H 5.360 . 5.360 3.977 3.454 4.473 . 0 0 "[ . 1]" 1 953 1 78 GLU H 1 79 ALA MB 5.850 . 5.850 4.037 3.946 4.210 . 0 0 "[ . 1]" 1 954 1 136 LYS H 1 136 LYS QD 4.890 . 4.890 4.298 3.522 4.814 . 0 0 "[ . 1]" 1 955 1 136 LYS H 1 136 LYS QG 4.660 . 4.660 3.581 1.927 4.047 . 0 0 "[ . 1]" 1 956 1 17 SER H 1 21 LYS QD 6.000 . 6.000 5.984 5.718 6.431 0.431 4 0 "[ . 1]" 1 957 1 63 GLN H 1 64 ALA MB 5.370 . 5.370 4.427 4.329 4.533 . 0 0 "[ . 1]" 1 958 1 67 GLU QB 1 68 THR H 5.730 . 5.730 2.744 2.537 3.157 . 0 0 "[ . 1]" 1 959 1 18 LYS QD 1 19 ASP H 5.290 . 5.290 4.813 4.226 5.418 0.128 4 0 "[ . 1]" 1 960 1 116 ARG QG 1 117 VAL H 5.640 . 5.640 3.791 3.272 4.064 . 0 0 "[ . 1]" 1 961 1 115 ALA MB 1 117 VAL H 5.030 . 5.030 4.684 4.513 4.898 . 0 0 "[ . 1]" 1 962 1 114 LYS HB2 1 115 ALA H 4.600 . 4.600 3.726 3.510 3.961 . 0 0 "[ . 1]" 1 963 1 131 ARG H 1 131 ARG QG 5.000 . 5.000 2.556 1.891 3.679 . 0 0 "[ . 1]" 1 964 1 80 LEU HB2 1 81 LYS H 4.750 . 4.750 3.720 3.387 4.001 . 0 0 "[ . 1]" 1 965 1 81 LYS H 1 81 LYS QD 4.340 . 4.340 4.107 3.853 4.407 0.067 1 0 "[ . 1]" 1 966 1 58 ARG H 1 60 ALA MB 5.700 . 5.700 4.856 4.405 5.485 . 0 0 "[ . 1]" 1 967 1 80 LEU HB3 1 81 LYS H 4.750 . 4.750 2.697 2.107 3.230 . 0 0 "[ . 1]" 1 968 1 57 LEU QB 1 58 ARG H 5.710 . 5.710 2.535 2.052 3.043 . 0 0 "[ . 1]" 1 969 1 73 LYS QG 1 76 GLU H 5.860 . 5.860 5.279 4.645 5.583 . 0 0 "[ . 1]" 1 970 1 76 GLU H 1 136 LYS QG 6.000 . 6.000 5.786 4.820 6.240 0.240 8 0 "[ . 1]" 1 971 1 73 LYS H 1 73 LYS QD 5.290 . 5.290 3.995 3.615 4.558 . 0 0 "[ . 1]" 1 972 1 144 LYS QB 1 145 VAL H 4.600 . 4.600 2.882 2.157 3.073 . 0 0 "[ . 1]" 1 973 1 34 LYS H 1 34 LYS QD 4.780 . 4.780 3.558 2.049 4.487 . 0 0 "[ . 1]" 1 974 1 34 LYS H 1 34 LYS QG 5.040 . 5.040 2.888 1.979 4.156 . 0 0 "[ . 1]" 1 975 1 90 GLN HB2 1 91 PHE H 5.010 . 5.010 3.576 2.586 4.029 . 0 0 "[ . 1]" 1 976 1 90 GLN HB3 1 91 PHE H 5.010 . 5.010 2.854 2.232 3.689 . 0 0 "[ . 1]" 1 977 1 75 ILE MG 1 78 GLU H 5.960 . 5.960 4.125 3.875 4.589 . 0 0 "[ . 1]" 1 978 1 96 ASP H 1 99 LEU HG 5.760 . 5.760 5.372 5.079 5.461 . 0 0 "[ . 1]" 1 979 1 136 LYS H 1 139 ILE MD 6.000 . 6.000 5.273 4.176 5.952 . 0 0 "[ . 1]" 1 980 1 27 ILE MG 1 63 GLN H 5.180 . 5.180 3.998 3.511 4.732 . 0 0 "[ . 1]" 1 981 1 68 THR H 1 105 LEU MD1 6.000 . 6.000 5.375 4.893 5.949 . 0 0 "[ . 1]" 1 982 1 20 LEU MD1 1 21 LYS H 4.930 . 4.930 4.052 3.232 4.767 . 0 0 "[ . 1]" 1 983 1 50 VAL MG1 1 51 THR H 5.750 . 5.750 3.721 1.640 4.331 0.160 7 0 "[ . 1]" 1 984 1 50 VAL MG2 1 51 THR H 5.750 . 5.750 3.082 1.808 4.280 . 0 0 "[ . 1]" 1 985 1 117 VAL H 1 139 ILE MD 5.400 . 5.400 5.540 5.156 5.762 0.362 5 0 "[ . 1]" 1 986 1 113 LEU MD1 1 142 GLN H 6.000 . 6.000 5.258 4.541 6.069 0.069 5 0 "[ . 1]" 1 987 1 139 ILE MG 1 142 GLN H 5.790 . 5.790 4.539 3.905 4.996 . 0 0 "[ . 1]" 1 988 1 98 MET H 1 99 LEU HG 5.270 . 5.270 4.355 4.093 5.338 0.068 5 0 "[ . 1]" 1 989 1 75 ILE MG 1 98 MET H 5.340 . 5.340 4.681 3.980 5.507 0.167 8 0 "[ . 1]" 1 990 1 40 ALA MB 1 41 PHE H 4.320 . 4.320 2.750 1.880 3.686 . 0 0 "[ . 1]" 1 991 1 128 THR MG 1 131 ARG H 5.310 . 5.310 3.716 3.005 4.739 . 0 0 "[ . 1]" 1 992 1 138 GLN H 1 139 ILE MD 6.000 . 6.000 5.034 4.638 5.456 . 0 0 "[ . 1]" 1 993 1 145 VAL MG2 1 146 VAL H 4.560 . 4.560 3.848 3.677 4.000 . 0 0 "[ . 1]" 1 994 1 73 LYS H 1 74 ILE QG 6.000 . 6.000 3.730 3.437 4.802 . 0 0 "[ . 1]" 1 995 1 73 LYS H 1 74 ILE MG 5.440 . 5.440 5.484 3.254 5.815 0.375 4 0 "[ . 1]" 1 996 1 74 ILE QG 1 75 ILE H 5.740 . 5.740 3.724 2.310 3.975 . 0 0 "[ . 1]" 1 997 1 75 ILE H 1 75 ILE MG 4.200 . 4.200 3.578 1.929 3.775 . 0 0 "[ . 1]" 1 998 1 77 GLU H 1 78 GLU H 4.960 . 4.960 2.477 2.351 2.597 . 0 0 "[ . 1]" 1 999 1 22 ASN H 1 23 LYS H 4.590 . 4.590 2.310 2.198 2.454 . 0 0 "[ . 1]" 1 1000 1 16 SER H 1 17 SER H 4.510 . 4.510 2.516 2.285 2.764 . 0 0 "[ . 1]" 1 1001 1 151 ASN H 1 152 ILE H 5.080 . 5.080 3.227 2.227 4.514 . 0 0 "[ . 1]" 1 1002 1 129 ALA H 1 130 GLU H 4.640 . 4.640 2.928 2.206 3.502 . 0 0 "[ . 1]" 1 1003 1 84 GLU H 1 85 THR H 4.620 . 4.620 2.607 2.278 2.925 . 0 0 "[ . 1]" 1 1004 1 76 GLU H 1 77 GLU H 4.990 . 4.990 2.746 2.617 2.928 . 0 0 "[ . 1]" 1 1005 1 123 ASN H 1 124 ASN H 4.100 . 4.100 2.596 2.419 2.697 . 0 0 "[ . 1]" 1 1006 1 121 SER H 1 124 ASN H 5.510 . 5.510 5.043 4.839 5.222 . 0 0 "[ . 1]" 1 1007 1 116 ARG H 1 117 VAL H 4.060 . 4.060 2.559 2.301 2.909 . 0 0 "[ . 1]" 1 1008 1 81 LYS H 1 82 LEU H 4.760 . 4.760 2.669 2.274 2.846 . 0 0 "[ . 1]" 1 1009 1 122 LYS H 1 124 ASN H 5.150 . 5.150 4.251 3.988 4.505 . 0 0 "[ . 1]" 1 1010 1 59 GLU H 1 60 ALA HA 5.410 . 5.410 5.143 4.895 5.257 . 0 0 "[ . 1]" 1 1011 1 128 THR HB 1 130 GLU H 5.040 . 5.040 3.907 3.046 5.024 . 0 0 "[ . 1]" 1 1012 1 83 LYS HA 1 130 GLU H 5.550 . 5.550 4.622 3.993 5.337 . 0 0 "[ . 1]" 1 1013 1 128 THR HA 1 130 GLU H 6.000 . 6.000 4.816 3.515 5.735 . 0 0 "[ . 1]" 1 1014 1 127 ASN H 1 128 THR HA 6.000 . 6.000 4.625 3.951 5.889 . 0 0 "[ . 1]" 1 1015 1 122 LYS HA 1 124 ASN H 5.070 . 5.070 4.549 3.711 4.877 . 0 0 "[ . 1]" 1 1016 1 79 ALA HA 1 82 LEU H 4.940 . 4.940 3.377 3.013 3.651 . 0 0 "[ . 1]" 1 1017 1 77 GLU H 1 77 GLU HB2 4.100 . 4.100 2.881 2.387 3.597 . 0 0 "[ . 1]" 1 1018 1 150 GLN QB 1 151 ASN H 5.710 . 5.710 3.272 2.083 3.979 . 0 0 "[ . 1]" 1 1019 1 59 GLU H 1 60 ALA MB 5.580 . 5.580 4.215 4.026 4.323 . 0 0 "[ . 1]" 1 1020 1 83 LYS QG 1 130 GLU H 5.810 . 5.810 3.920 2.978 5.956 0.146 5 0 "[ . 1]" 1 1021 1 81 LYS QD 1 84 GLU H 5.570 . 5.570 5.223 3.531 6.017 0.447 1 0 "[ . 1]" 1 1022 1 81 LYS QG 1 84 GLU H 5.140 . 5.140 4.726 4.184 5.376 0.236 9 0 "[ . 1]" 1 1023 1 77 GLU H 1 79 ALA MB 5.670 . 5.670 5.190 4.673 5.561 . 0 0 "[ . 1]" 1 1024 1 60 ALA MB 1 62 VAL H 5.850 . 5.850 4.471 4.027 5.147 . 0 0 "[ . 1]" 1 1025 1 21 LYS QD 1 22 ASN H 4.840 . 4.840 3.932 3.627 4.344 . 0 0 "[ . 1]" 1 1026 1 61 LYS QG 1 62 VAL H 5.530 . 5.530 4.091 3.853 4.331 . 0 0 "[ . 1]" 1 1027 1 60 ALA MB 1 61 LYS H 4.760 . 4.760 2.579 2.288 2.879 . 0 0 "[ . 1]" 1 1028 1 61 LYS H 1 61 LYS QG 4.860 . 4.860 2.179 2.004 2.457 . 0 0 "[ . 1]" 1 1029 1 126 ILE HB 1 127 ASN H 5.480 . 5.480 4.134 2.049 4.471 . 0 0 "[ . 1]" 1 1030 1 127 ASN H 1 131 ARG QG 5.680 . 5.680 4.507 3.391 5.693 0.013 9 0 "[ . 1]" 1 1031 1 122 LYS QB 1 124 ASN H 5.260 . 5.260 4.770 4.398 5.038 . 0 0 "[ . 1]" 1 1032 1 151 ASN H 1 152 ILE HB 5.590 . 5.590 5.261 4.003 5.788 0.198 2 0 "[ . 1]" 1 1033 1 81 LYS QB 1 82 LEU H 4.440 . 4.440 2.597 2.216 3.361 . 0 0 "[ . 1]" 1 1034 1 81 LYS QD 1 82 LEU H 4.980 . 4.980 4.426 3.170 5.122 0.142 5 0 "[ . 1]" 1 1035 1 82 LEU H 1 82 LEU HG 5.380 . 5.380 3.345 1.996 4.699 . 0 0 "[ . 1]" 1 1036 1 13 LEU MD2 1 77 GLU H 6.000 . 6.000 5.933 5.596 6.136 0.136 10 0 "[ . 1]" 1 1037 1 127 ASN H 1 128 THR MG 6.000 . 6.000 4.312 2.557 6.028 0.028 10 0 "[ . 1]" 1 1038 1 116 ARG H 1 117 VAL MG1 6.000 . 6.000 4.533 3.899 5.730 . 0 0 "[ . 1]" 1 1039 1 116 ARG H 1 117 VAL MG2 6.000 . 6.000 5.391 3.787 6.046 0.046 10 0 "[ . 1]" 1 1040 1 14 GLU H 1 15 SER H 4.880 . 4.880 2.633 2.533 2.839 . 0 0 "[ . 1]" 1 1041 1 9 THR H 1 10 ASN H 4.900 . 4.900 3.758 2.429 4.524 . 0 0 "[ . 1]" 1 1042 1 8 ARG H 1 9 THR H 4.540 . 4.540 3.539 2.122 4.592 0.052 2 0 "[ . 1]" 1 1043 1 80 LEU H 1 81 LYS H 4.880 . 4.880 2.780 2.551 2.994 . 0 0 "[ . 1]" 1 1044 1 119 GLU HA 1 123 ASN H 5.070 . 5.070 4.206 3.875 4.649 . 0 0 "[ . 1]" 1 1045 1 15 SER H 1 18 LYS QG 6.000 . 6.000 5.189 4.603 6.215 0.215 5 0 "[ . 1]" 1 1046 1 122 LYS QG 1 123 ASN H 5.470 . 5.470 3.843 3.549 4.283 . 0 0 "[ . 1]" 1 1047 1 45 LYS QB 1 46 THR H 5.400 . 5.400 3.603 2.962 3.919 . 0 0 "[ . 1]" 1 1048 1 150 GLN H 1 150 GLN HG3 4.990 . 4.990 3.553 1.988 4.491 . 0 0 "[ . 1]" 1 1049 1 9 THR H 1 9 THR MG 4.610 . 4.610 3.768 2.347 4.016 . 0 0 "[ . 1]" 1 1050 1 119 GLU H 1 121 SER H 5.190 . 5.190 4.778 4.498 5.047 . 0 0 "[ . 1]" 1 1051 1 119 GLU QG 1 121 SER H 5.670 . 5.670 5.378 4.692 5.850 0.180 1 0 "[ . 1]" 1 1052 1 120 GLU QG 1 121 SER H 5.860 . 5.860 3.816 3.548 4.216 . 0 0 "[ . 1]" 1 1053 1 120 GLU QB 1 121 SER H 4.350 . 4.350 2.275 2.071 2.436 . 0 0 "[ . 1]" 1 1054 1 3 ILE HB 1 4 GLY H 5.440 . 5.440 2.915 1.815 4.364 . 0 0 "[ . 1]" 1 1055 1 121 SER H 1 126 ILE HB 6.000 . 6.000 5.871 4.915 6.497 0.497 2 0 "[ . 1]" 1 1056 1 22 ASN HD21 1 23 LYS QD 6.000 . 6.000 4.493 3.394 5.570 . 0 0 "[ . 1]" 1 1057 1 137 ALA MB 1 141 ASN HD21 5.610 . 5.610 4.241 3.052 5.115 . 0 0 "[ . 1]" 1 1058 1 22 ASN HD22 1 23 LYS QD 6.000 . 6.000 4.488 3.283 6.121 0.121 1 0 "[ . 1]" 1 1059 1 137 ALA MB 1 141 ASN HD22 5.610 . 5.610 3.530 2.452 4.362 . 0 0 "[ . 1]" 1 1060 1 42 THR H 1 46 THR MG 4.870 . 4.870 4.521 3.377 4.977 0.107 2 0 "[ . 1]" 1 1061 1 117 VAL MG1 1 121 SER H 6.000 . 6.000 4.841 3.916 5.507 . 0 0 "[ . 1]" 1 1062 1 117 VAL MG2 1 121 SER H 6.000 . 6.000 4.919 4.208 6.219 0.219 1 0 "[ . 1]" 1 1063 1 32 THR H 1 33 GLY H 4.990 . 4.990 2.759 2.518 2.906 . 0 0 "[ . 1]" 1 1064 1 112 GLY H 1 113 LEU H 5.340 . 5.340 4.226 3.121 4.630 . 0 0 "[ . 1]" 1 1065 1 85 THR H 1 86 GLY H 4.600 . 4.600 2.535 2.327 2.668 . 0 0 "[ . 1]" 1 1066 1 33 GLY H 1 34 LYS H 4.720 . 4.720 2.712 2.494 3.407 . 0 0 "[ . 1]" 1 1067 1 42 THR HB 1 43 GLY H 4.810 . 4.810 4.103 2.239 4.479 . 0 0 "[ . 1]" 1 1068 1 113 LEU MD1 1 142 GLN HE21 6.000 . 6.000 3.684 2.181 4.952 . 0 0 "[ . 1]" 1 1069 1 113 LEU MD2 1 142 GLN HE21 6.000 . 6.000 3.169 1.919 5.369 . 0 0 "[ . 1]" 1 1070 1 113 LEU MD1 1 142 GLN HE22 6.000 . 6.000 3.992 2.573 6.111 0.111 3 0 "[ . 1]" 1 1071 1 113 LEU MD2 1 142 GLN HE22 6.000 . 6.000 3.555 1.944 5.357 . 0 0 "[ . 1]" 1 1072 1 82 LEU MD2 1 86 GLY H 5.110 . 5.110 4.440 2.813 5.503 0.393 2 0 "[ . 1]" 1 1073 1 68 THR H 1 69 GLY H 5.130 . 5.130 2.594 2.261 2.834 . 0 0 "[ . 1]" 1 1074 1 84 GLU HB2 1 85 THR H 5.220 . 5.220 2.696 2.371 3.433 . 0 0 "[ . 1]" 1 1075 1 84 GLU HB3 1 85 THR H 5.220 . 5.220 3.732 3.442 4.135 . 0 0 "[ . 1]" 1 1076 1 54 GLY H 1 57 LEU MD1 6.000 . 6.000 6.021 5.289 6.347 0.347 3 0 "[ . 1]" 1 1077 1 54 GLY H 1 57 LEU MD2 6.000 . 6.000 5.080 4.158 5.952 . 0 0 "[ . 1]" 1 1078 1 89 GLY H 1 90 GLN H 4.830 . 4.830 2.808 2.705 2.906 . 0 0 "[ . 1]" 1 1079 1 127 ASN H 1 128 THR H 4.760 . 4.760 2.336 1.723 3.572 0.077 4 0 "[ . 1]" 1 1080 1 34 LYS H 1 35 GLY H 4.930 . 4.930 2.685 2.462 2.881 . 0 0 "[ . 1]" 1 1081 1 33 GLY QA 1 35 GLY H 5.750 . 5.750 3.324 3.121 4.160 . 0 0 "[ . 1]" 1 1082 1 126 ILE HA 1 128 THR H 5.360 . 5.360 3.582 3.095 4.062 . 0 0 "[ . 1]" 1 1083 1 128 THR H 1 129 ALA HA 5.960 . 5.960 4.803 4.639 4.990 . 0 0 "[ . 1]" 1 1084 1 34 LYS QD 1 35 GLY H 5.820 . 5.820 4.923 4.170 5.674 . 0 0 "[ . 1]" 1 1085 1 32 THR MG 1 35 GLY H 5.700 . 5.700 4.676 3.871 5.810 0.110 10 0 "[ . 1]" 1 1086 1 35 GLY H 1 36 VAL HB 6.000 . 6.000 4.958 4.467 6.195 0.195 8 0 "[ . 1]" 1 1087 1 148 GLU H 1 149 LYS QD 4.700 . 4.700 4.350 3.579 4.962 0.262 2 0 "[ . 1]" 1 1088 1 5 LEU HB2 1 6 VAL H 4.270 . 4.270 2.578 1.821 3.932 . 0 0 "[ . 1]" 1 1089 1 3 ILE H 1 4 GLY H 5.270 . 5.270 3.709 2.584 4.618 . 0 0 "[ . 1]" 1 1090 1 51 THR HB 1 52 SER H 5.770 . 5.770 3.766 1.851 4.483 . 0 0 "[ . 1]" 1 1091 1 121 SER H 1 126 ILE MD 5.980 . 5.980 4.808 4.295 5.784 . 0 0 "[ . 1]" 1 1092 1 124 ASN H 1 126 ILE MD 6.000 . 6.000 4.814 4.013 6.127 0.127 6 0 "[ . 1]" 1 1093 1 65 ILE H 1 67 GLU H 6.000 . 6.000 4.368 4.232 4.522 . 0 0 "[ . 1]" 1 1094 1 126 ILE H 1 127 ASN H 5.910 . 5.910 3.958 2.582 4.555 . 0 0 "[ . 1]" 1 1095 1 126 ILE H 1 128 THR H 6.000 . 6.000 5.750 4.715 6.173 0.173 3 0 "[ . 1]" 1 1096 1 126 ILE QG 1 127 ASN H 6.000 . 6.000 4.047 2.639 4.844 . 0 0 "[ . 1]" 1 1097 1 97 LEU H 1 98 MET H 4.750 . 4.750 2.584 2.405 2.687 . 0 0 "[ . 1]" 1 1098 1 91 PHE H 1 127 ASN HA 6.000 . 6.000 6.042 5.405 6.337 0.337 8 0 "[ . 1]" 1 1099 1 92 LEU MD1 1 93 ALA H 5.960 . 5.960 4.521 3.804 4.838 . 0 0 "[ . 1]" 1 1100 1 92 LEU MD2 1 93 ALA H 5.960 . 5.960 4.662 4.143 4.961 . 0 0 "[ . 1]" 1 1101 1 63 GLN HE21 1 66 VAL MG1 6.000 . 6.000 4.542 3.508 5.517 . 0 0 "[ . 1]" 1 1102 1 63 GLN HE21 1 66 VAL MG2 6.000 . 6.000 4.134 2.667 5.791 . 0 0 "[ . 1]" 1 1103 1 27 ILE MD 1 63 GLN HE21 6.000 . 6.000 4.548 2.610 6.021 0.021 7 0 "[ . 1]" 1 1104 1 63 GLN HE22 1 66 VAL MG1 6.000 . 6.000 3.742 2.938 4.601 . 0 0 "[ . 1]" 1 1105 1 27 ILE MD 1 63 GLN HE22 6.000 . 6.000 5.138 3.841 5.875 . 0 0 "[ . 1]" 1 1106 1 63 GLN HE22 1 66 VAL MG2 6.000 . 6.000 4.029 3.060 5.188 . 0 0 "[ . 1]" 1 1107 1 10 ASN H 1 10 ASN HD21 6.000 . 6.000 4.080 1.973 4.835 . 0 0 "[ . 1]" 1 1108 1 151 ASN H 1 152 ILE MG 6.000 . 6.000 5.159 3.536 6.080 0.080 7 0 "[ . 1]" 1 1109 1 44 LEU MD1 1 47 GLY H 6.000 . 6.000 5.061 3.664 6.328 0.328 7 0 "[ . 1]" 1 1110 1 44 LEU MD2 1 47 GLY H 6.000 . 6.000 5.340 4.084 6.268 0.268 6 0 "[ . 1]" 1 1111 1 20 LEU H 1 24 ILE MD 5.930 . 5.930 5.856 5.627 6.227 0.297 7 0 "[ . 1]" 1 1112 1 10 ASN H 1 10 ASN HD22 6.000 . 6.000 5.011 3.019 5.897 . 0 0 "[ . 1]" 1 1113 1 34 LYS QB 1 35 GLY H 6.000 . 6.000 3.514 2.451 3.709 . 0 0 "[ . 1]" 1 1114 1 35 GLY H 1 36 VAL H 3.760 . 3.760 2.472 2.192 2.611 . 0 0 "[ . 1]" 1 1115 1 40 ALA H 1 41 PHE QD 5.810 . 5.810 5.155 4.191 6.042 0.232 10 0 "[ . 1]" 1 1116 1 41 PHE QD 1 42 THR H 5.900 . 5.900 3.642 1.850 4.814 . 0 0 "[ . 1]" 1 1117 1 42 THR MG 1 43 GLY H 6.000 . 6.000 3.651 2.669 4.353 . 0 0 "[ . 1]" 1 1118 1 44 LEU HG 1 47 GLY H 6.000 . 6.000 4.918 3.610 6.082 0.082 9 0 "[ . 1]" 1 1119 1 58 ARG H 1 59 GLU H 5.600 . 5.600 2.635 2.422 2.902 . 0 0 "[ . 1]" 1 1120 1 126 ILE MD 1 129 ALA H 7.000 . 7.000 6.838 5.519 7.403 0.403 7 0 "[ . 1]" 1 1121 1 111 ILE H 1 112 GLY H 6.000 . 6.000 3.732 1.582 4.543 0.218 4 0 "[ . 1]" 1 1122 1 15 SER H 1 16 SER H 4.510 . 4.510 2.612 2.485 2.756 . 0 0 "[ . 1]" 1 1123 1 33 GLY H 1 35 GLY H 6.000 . 6.000 4.337 4.137 4.489 . 0 0 "[ . 1]" 1 1124 1 76 GLU H 1 79 ALA H 5.720 . 5.720 4.941 4.737 5.178 . 0 0 "[ . 1]" 1 1125 1 62 VAL MG1 1 150 GLN H 5.710 . 5.710 5.161 3.851 6.005 0.295 2 0 "[ . 1]" 1 1126 1 62 VAL HA 1 66 VAL H 5.830 . 5.830 4.692 4.396 4.928 . 0 0 "[ . 1]" 1 1127 1 65 ILE QG 1 66 VAL H 6.000 . 6.000 3.863 3.596 3.984 . 0 0 "[ . 1]" 1 1128 1 66 VAL H 1 147 LYS QG 6.000 . 6.000 5.427 3.707 6.059 0.059 1 0 "[ . 1]" 1 1129 1 66 VAL H 1 147 LYS QB 6.000 . 6.000 5.951 5.291 6.190 0.190 5 0 "[ . 1]" 1 1130 1 88 SER H 1 89 GLY H 5.720 . 5.720 2.853 2.686 3.045 . 0 0 "[ . 1]" 1 1131 1 89 GLY H 1 91 PHE H 5.940 . 5.940 4.167 3.903 4.436 . 0 0 "[ . 1]" 1 1132 1 87 ASN HA 1 89 GLY H 6.000 . 6.000 3.809 3.670 4.048 . 0 0 "[ . 1]" 1 1133 1 69 GLY H 1 70 LYS QG 6.000 . 6.000 4.847 3.911 6.274 0.274 9 0 "[ . 1]" 1 1134 1 69 GLY H 1 70 LYS QD 6.000 . 6.000 5.502 3.625 6.308 0.308 7 0 "[ . 1]" 1 1135 1 21 LYS H 1 104 SER H 6.800 . 6.800 6.594 6.268 6.869 0.069 2 0 "[ . 1]" 1 1136 1 3 ILE H 1 3 ILE QG 4.820 . 4.820 2.634 1.845 4.295 . 0 0 "[ . 1]" 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 454 _Distance_constraint_stats_list.Viol_count 537 _Distance_constraint_stats_list.Viol_total 761.763 _Distance_constraint_stats_list.Viol_max 0.554 _Distance_constraint_stats_list.Viol_rms 0.0606 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0168 _Distance_constraint_stats_list.Viol_average_violations_only 0.1419 _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 5 LEU 0.000 0.000 . 0 "[ . 1]" 1 6 VAL 0.698 0.284 8 0 "[ . 1]" 1 8 ARG 0.000 0.000 . 0 "[ . 1]" 1 10 ASN 1.390 0.284 8 0 "[ . 1]" 1 11 ALA 0.190 0.139 5 0 "[ . 1]" 1 12 ALA 1.194 0.254 2 0 "[ . 1]" 1 13 LEU 2.027 0.254 2 0 "[ . 1]" 1 14 GLU 0.828 0.332 2 0 "[ . 1]" 1 15 SER 0.466 0.332 2 0 "[ . 1]" 1 16 SER 0.000 0.000 . 0 "[ . 1]" 1 17 SER 2.066 0.338 3 0 "[ . 1]" 1 18 LYS 0.929 0.338 3 0 "[ . 1]" 1 19 ASP 1.959 0.447 4 0 "[ . 1]" 1 20 LEU 2.844 0.486 8 0 "[ . 1]" 1 21 LYS 3.032 0.421 9 0 "[ . 1]" 1 22 ASN 3.589 0.447 4 0 "[ . 1]" 1 23 LYS 1.780 0.372 2 0 "[ . 1]" 1 24 ILE 0.750 0.340 7 0 "[ . 1]" 1 25 LEU 5.590 0.372 2 0 "[ . 1]" 1 26 LYS 0.715 0.273 5 0 "[ . 1]" 1 27 ILE 0.603 0.220 3 0 "[ . 1]" 1 28 LYS 0.439 0.340 7 0 "[ . 1]" 1 31 ALA 0.000 0.000 . 0 "[ . 1]" 1 32 THR 0.219 0.209 2 0 "[ . 1]" 1 34 LYS 0.000 0.000 . 0 "[ . 1]" 1 35 GLY 0.000 0.000 . 0 "[ . 1]" 1 36 VAL 1.839 0.233 7 0 "[ . 1]" 1 37 LEU 0.207 0.098 5 0 "[ . 1]" 1 38 PHE 0.637 0.233 7 0 "[ . 1]" 1 39 GLU 0.000 0.000 . 0 "[ . 1]" 1 40 ALA 2.140 0.491 9 0 "[ . 1]" 1 41 PHE 1.985 0.490 9 0 "[ . 1]" 1 43 GLY 0.074 0.074 6 0 "[ . 1]" 1 44 LEU 5.535 0.491 9 0 "[ . 1]" 1 45 LYS 0.000 0.000 . 0 "[ . 1]" 1 46 THR 0.420 0.185 9 0 "[ . 1]" 1 47 GLY 0.859 0.376 6 0 "[ . 1]" 1 49 LYS 3.674 0.462 7 0 "[ . 1]" 1 50 VAL 3.569 0.462 7 0 "[ . 1]" 1 51 THR 0.183 0.183 7 0 "[ . 1]" 1 52 SER 0.804 0.372 4 0 "[ . 1]" 1 53 GLY 0.010 0.010 9 0 "[ . 1]" 1 55 LEU 0.000 0.000 . 0 "[ . 1]" 1 56 ALA 0.337 0.119 7 0 "[ . 1]" 1 57 LEU 0.357 0.084 8 0 "[ . 1]" 1 58 ARG 0.000 0.000 . 0 "[ . 1]" 1 60 ALA 0.000 0.000 . 0 "[ . 1]" 1 61 LYS 0.000 0.000 . 0 "[ . 1]" 1 62 VAL 2.620 0.338 7 0 "[ . 1]" 1 63 GLN 0.997 0.220 3 0 "[ . 1]" 1 64 ALA 0.177 0.081 7 0 "[ . 1]" 1 65 ILE 1.845 0.338 7 0 "[ . 1]" 1 66 VAL 0.214 0.109 7 0 "[ . 1]" 1 67 GLU 0.415 0.198 6 0 "[ . 1]" 1 68 THR 0.017 0.017 6 0 "[ . 1]" 1 69 GLY 3.130 0.469 4 0 "[ . 1]" 1 70 LYS 0.000 0.000 . 0 "[ . 1]" 1 71 PHE 1.540 0.319 4 0 "[ . 1]" 1 72 LEU 4.289 0.469 4 0 "[ . 1]" 1 73 LYS 0.000 0.000 . 0 "[ . 1]" 1 74 ILE 0.216 0.122 9 0 "[ . 1]" 1 75 ILE 1.934 0.241 9 0 "[ . 1]" 1 76 GLU 1.839 0.362 9 0 "[ . 1]" 1 77 GLU 0.437 0.100 9 0 "[ . 1]" 1 78 GLU 0.634 0.168 4 0 "[ . 1]" 1 79 ALA 0.042 0.028 8 0 "[ . 1]" 1 80 LEU 1.010 0.401 3 0 "[ . 1]" 1 81 LYS 0.000 0.000 . 0 "[ . 1]" 1 82 LEU 1.549 0.232 5 0 "[ . 1]" 1 83 LYS 0.761 0.401 3 0 "[ . 1]" 1 84 GLU 0.000 0.000 . 0 "[ . 1]" 1 85 THR 0.000 0.000 . 0 "[ . 1]" 1 86 GLY 0.219 0.197 10 0 "[ . 1]" 1 88 SER 0.000 0.000 . 0 "[ . 1]" 1 89 GLY 0.000 0.000 . 0 "[ . 1]" 1 90 GLN 0.532 0.197 10 0 "[ . 1]" 1 91 PHE 0.253 0.232 5 0 "[ . 1]" 1 92 LEU 3.492 0.462 3 0 "[ . 1]" 1 93 ALA 0.008 0.008 9 0 "[ . 1]" 1 94 MET 0.397 0.397 9 0 "[ . 1]" 1 95 PHE 2.383 0.462 3 0 "[ . 1]" 1 96 ASP 0.564 0.304 3 0 "[ . 1]" 1 97 LEU 3.119 0.319 4 0 "[ . 1]" 1 98 MET 1.958 0.289 7 0 "[ . 1]" 1 99 LEU 5.649 0.431 5 0 "[ . 1]" 1 100 GLU 0.000 0.000 . 0 "[ . 1]" 1 101 VAL 2.389 0.486 8 0 "[ . 1]" 1 102 VAL 3.546 0.456 10 0 "[ . 1]" 1 103 GLU 0.000 0.000 . 0 "[ . 1]" 1 104 SER 0.000 0.000 . 0 "[ . 1]" 1 105 LEU 0.618 0.153 1 0 "[ . 1]" 1 106 GLU 0.000 0.000 . 0 "[ . 1]" 1 107 ASP 0.000 0.000 . 0 "[ . 1]" 1 108 VAL 0.785 0.423 1 0 "[ . 1]" 1 109 GLY 4.615 0.539 5 1 "[ + 1]" 1 111 ILE 5.474 0.539 5 1 "[ + 1]" 1 112 GLY 1.644 0.389 4 0 "[ . 1]" 1 113 LEU 1.509 0.233 6 0 "[ . 1]" 1 114 LYS 2.720 0.456 10 0 "[ . 1]" 1 115 ALA 0.000 0.000 . 0 "[ . 1]" 1 116 ARG 1.354 0.554 8 1 "[ . + 1]" 1 117 VAL 2.984 0.436 2 0 "[ . 1]" 1 118 LEU 1.074 0.419 10 0 "[ . 1]" 1 119 GLU 2.219 0.554 8 1 "[ . + 1]" 1 121 SER 0.194 0.123 3 0 "[ . 1]" 1 122 LYS 0.880 0.252 6 0 "[ . 1]" 1 123 ASN 0.406 0.274 8 0 "[ . 1]" 1 124 ASN 0.165 0.107 5 0 "[ . 1]" 1 125 PRO 0.165 0.107 5 0 "[ . 1]" 1 126 ILE 0.196 0.123 3 0 "[ . 1]" 1 127 ASN 0.827 0.332 5 0 "[ . 1]" 1 128 THR 0.000 0.000 . 0 "[ . 1]" 1 129 ALA 0.965 0.216 8 0 "[ . 1]" 1 130 GLU 0.661 0.284 7 0 "[ . 1]" 1 131 ARG 0.000 0.000 . 0 "[ . 1]" 1 132 LEU 0.420 0.397 9 0 "[ . 1]" 1 133 LEU 1.751 0.314 2 0 "[ . 1]" 1 134 ALA 0.000 0.000 . 0 "[ . 1]" 1 135 ALA 0.136 0.107 3 0 "[ . 1]" 1 136 LYS 0.000 0.000 . 0 "[ . 1]" 1 137 ALA 0.899 0.329 9 0 "[ . 1]" 1 138 GLN 1.347 0.222 9 0 "[ . 1]" 1 139 ILE 1.678 0.436 2 0 "[ . 1]" 1 140 GLU 2.318 0.436 3 0 "[ . 1]" 1 141 ASN 0.696 0.203 10 0 "[ . 1]" 1 142 GLN 1.370 0.221 3 0 "[ . 1]" 1 143 LEU 1.375 0.269 6 0 "[ . 1]" 1 144 LYS 0.574 0.286 8 0 "[ . 1]" 1 145 VAL 1.581 0.286 8 0 "[ . 1]" 1 146 VAL 0.326 0.085 10 0 "[ . 1]" 1 147 LYS 0.193 0.109 7 0 "[ . 1]" 1 149 LYS 0.000 0.000 . 0 "[ . 1]" 1 150 GLN 0.775 0.286 3 0 "[ . 1]" 1 151 ASN 0.166 0.166 10 0 "[ . 1]" 1 152 ILE 0.407 0.166 10 0 "[ . 1]" 1 153 GLU 0.241 0.131 5 0 "[ . 1]" 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 5 LEU H 1 5 LEU QD 5.200 . 5.200 2.456 1.813 3.027 . 0 0 "[ . 1]" 2 2 1 5 LEU HA 1 5 LEU QD 3.970 . 3.970 2.284 2.040 3.418 . 0 0 "[ . 1]" 2 3 1 5 LEU HA 1 6 VAL QG 4.480 . 4.480 3.542 3.019 4.361 . 0 0 "[ . 1]" 2 4 1 6 VAL H 1 6 VAL QG 3.440 . 3.440 2.130 1.746 2.526 0.054 9 0 "[ . 1]" 2 5 1 6 VAL HA 1 6 VAL QG 2.920 . 2.920 2.214 2.091 2.309 . 0 0 "[ . 1]" 2 6 1 6 VAL QG 1 10 ASN H 5.380 . 5.380 3.966 2.572 5.025 . 0 0 "[ . 1]" 2 7 1 6 VAL QG 1 10 ASN QB 4.380 . 4.380 3.283 2.342 4.578 0.198 9 0 "[ . 1]" 2 8 1 6 VAL QG 1 10 ASN QD 4.580 . 4.580 4.187 2.666 4.864 0.284 8 0 "[ . 1]" 2 9 1 8 ARG H 1 8 ARG QB 3.610 . 3.610 2.828 2.253 3.351 . 0 0 "[ . 1]" 2 10 1 8 ARG QB 1 8 ARG QD 3.290 . 3.290 2.352 2.125 2.858 . 0 0 "[ . 1]" 2 11 1 10 ASN HA 1 10 ASN QD 4.540 . 4.540 2.773 1.830 3.748 . 0 0 "[ . 1]" 2 12 1 10 ASN QD 1 11 ALA MB 5.810 . 5.810 4.871 3.247 5.949 0.139 5 0 "[ . 1]" 2 13 1 10 ASN QD 1 12 ALA MB 5.810 . 5.810 5.271 2.761 5.946 0.136 10 0 "[ . 1]" 2 14 1 10 ASN QD 1 13 LEU QB 5.180 . 5.180 4.818 4.089 5.384 0.204 5 0 "[ . 1]" 2 15 1 10 ASN QD 1 13 LEU QD 4.860 . 4.860 3.417 2.138 4.644 . 0 0 "[ . 1]" 2 16 1 12 ALA H 1 13 LEU QD 5.920 . 5.920 4.714 3.917 5.409 . 0 0 "[ . 1]" 2 17 1 12 ALA MB 1 13 LEU QD 4.750 . 4.750 4.539 3.594 5.004 0.254 2 0 "[ . 1]" 2 18 1 12 ALA MB 1 97 LEU QD 4.670 . 4.670 4.011 2.840 4.851 0.181 4 0 "[ . 1]" 2 19 1 13 LEU H 1 13 LEU QB 3.590 . 3.590 2.967 2.805 3.172 . 0 0 "[ . 1]" 2 20 1 13 LEU H 1 13 LEU QD 3.940 . 3.940 2.914 2.096 3.616 . 0 0 "[ . 1]" 2 21 1 13 LEU QB 1 17 SER H 5.510 . 5.510 4.284 3.211 5.196 . 0 0 "[ . 1]" 2 22 1 13 LEU QB 1 75 ILE MG 4.720 . 4.720 4.311 3.933 4.838 0.118 8 0 "[ . 1]" 2 23 1 13 LEU QB 1 75 ILE MD 5.010 . 5.010 4.538 3.340 5.065 0.055 1 0 "[ . 1]" 2 24 1 13 LEU QB 1 78 GLU QG 4.320 . 4.320 3.166 2.225 4.488 0.168 4 0 "[ . 1]" 2 25 1 13 LEU QB 1 97 LEU QD 3.920 . 3.920 3.422 2.760 3.916 . 0 0 "[ . 1]" 2 26 1 13 LEU QD 1 14 GLU H 4.780 . 4.780 4.362 4.123 4.520 . 0 0 "[ . 1]" 2 27 1 13 LEU QD 1 16 SER H 5.730 . 5.730 4.205 3.623 4.508 . 0 0 "[ . 1]" 2 28 1 13 LEU QD 1 71 PHE QE 4.590 . 4.590 3.189 2.368 3.640 . 0 0 "[ . 1]" 2 29 1 13 LEU QD 1 74 ILE MD 3.740 . 3.740 3.432 2.227 3.862 0.122 9 0 "[ . 1]" 2 30 1 13 LEU QD 1 75 ILE H 5.490 . 5.490 4.146 3.421 4.699 . 0 0 "[ . 1]" 2 31 1 13 LEU QD 1 75 ILE HA 4.490 . 4.490 3.138 2.474 3.529 . 0 0 "[ . 1]" 2 32 1 13 LEU QD 1 75 ILE MG 4.150 . 4.150 3.940 3.522 4.299 0.149 7 0 "[ . 1]" 2 33 1 13 LEU QD 1 78 GLU H 5.620 . 5.620 4.850 4.557 5.055 . 0 0 "[ . 1]" 2 34 1 13 LEU QD 1 78 GLU QG 4.030 . 4.030 2.572 2.220 3.432 . 0 0 "[ . 1]" 2 35 1 14 GLU H 1 14 GLU QB 3.470 . 3.470 2.359 2.216 2.600 . 0 0 "[ . 1]" 2 36 1 14 GLU H 1 14 GLU QG 3.910 . 3.910 2.990 1.809 4.047 0.137 6 0 "[ . 1]" 2 37 1 14 GLU QB 1 15 SER H 3.750 . 3.750 3.053 2.331 3.703 . 0 0 "[ . 1]" 2 38 1 14 GLU QB 1 15 SER HA 4.460 . 4.460 4.201 4.035 4.453 . 0 0 "[ . 1]" 2 39 1 14 GLU QB 1 15 SER QB 4.990 . 4.990 4.526 3.690 5.322 0.332 2 0 "[ . 1]" 2 40 1 14 GLU QG 1 15 SER H 4.240 . 4.240 3.236 1.858 4.280 0.040 10 0 "[ . 1]" 2 41 1 17 SER H 1 97 LEU QD 4.880 . 4.880 3.909 3.285 4.298 . 0 0 "[ . 1]" 2 42 1 17 SER HA 1 19 ASP QB 4.890 . 4.890 4.369 3.888 4.694 . 0 0 "[ . 1]" 2 43 1 17 SER QB 1 18 LYS QB 4.950 . 4.950 4.799 4.047 5.288 0.338 3 0 "[ . 1]" 2 44 1 17 SER QB 1 21 LYS QD 4.080 . 4.080 3.948 3.396 4.258 0.178 8 0 "[ . 1]" 2 45 1 17 SER QB 1 75 ILE MG 5.510 . 5.510 5.481 5.102 5.751 0.241 9 0 "[ . 1]" 2 46 1 17 SER QB 1 75 ILE MD 4.360 . 4.360 3.840 3.396 4.211 . 0 0 "[ . 1]" 2 47 1 17 SER QB 1 97 LEU HG 4.610 . 4.610 3.321 2.734 4.007 . 0 0 "[ . 1]" 2 48 1 17 SER QB 1 97 LEU QD 3.230 . 3.230 2.026 1.888 2.193 . 0 0 "[ . 1]" 2 49 1 17 SER QB 1 101 VAL QG 4.160 . 4.160 3.564 2.840 4.359 0.199 8 0 "[ . 1]" 2 50 1 19 ASP HA 1 22 ASN QB 3.910 . 3.910 3.624 2.356 4.357 0.447 4 0 "[ . 1]" 2 51 1 19 ASP HA 1 22 ASN QD 3.950 . 3.950 2.709 1.826 3.450 . 0 0 "[ . 1]" 2 52 1 19 ASP QB 1 20 LEU H 3.900 . 3.900 2.786 2.209 3.287 . 0 0 "[ . 1]" 2 53 1 20 LEU H 1 20 LEU QD 3.950 . 3.950 3.555 3.105 3.765 . 0 0 "[ . 1]" 2 54 1 20 LEU HA 1 20 LEU QD 3.800 . 3.800 2.343 1.951 3.001 . 0 0 "[ . 1]" 2 55 1 20 LEU HB3 1 101 VAL QG 4.180 . 4.180 2.992 2.286 3.938 . 0 0 "[ . 1]" 2 56 1 20 LEU QD 1 21 LYS H 4.330 . 4.330 3.307 2.768 3.958 . 0 0 "[ . 1]" 2 57 1 20 LEU QD 1 21 LYS HA 3.650 . 3.650 3.159 2.601 4.071 0.421 9 0 "[ . 1]" 2 58 1 20 LEU QD 1 21 LYS QB 4.560 . 4.560 4.393 3.630 4.980 0.420 9 0 "[ . 1]" 2 59 1 20 LEU QD 1 21 LYS QD 3.590 . 3.590 3.263 2.458 3.614 0.024 8 0 "[ . 1]" 2 60 1 20 LEU QD 1 22 ASN H 5.770 . 5.770 4.576 4.227 5.052 . 0 0 "[ . 1]" 2 61 1 20 LEU QD 1 23 LYS H 5.190 . 5.190 3.910 3.541 4.276 . 0 0 "[ . 1]" 2 62 1 20 LEU QD 1 24 ILE H 5.690 . 5.690 3.998 2.961 4.357 . 0 0 "[ . 1]" 2 63 1 20 LEU QD 1 24 ILE MD 2.520 . 2.520 2.432 2.048 2.658 0.138 3 0 "[ . 1]" 2 64 1 20 LEU QD 1 68 THR HA 4.170 . 4.170 2.513 2.189 2.798 . 0 0 "[ . 1]" 2 65 1 20 LEU QD 1 68 THR HB 3.590 . 3.590 3.058 2.622 3.607 0.017 6 0 "[ . 1]" 2 66 1 20 LEU QD 1 68 THR MG 2.850 . 2.850 2.128 2.013 2.319 . 0 0 "[ . 1]" 2 67 1 20 LEU QD 1 69 GLY H 5.530 . 5.530 5.170 4.810 5.465 . 0 0 "[ . 1]" 2 68 1 20 LEU QD 1 71 PHE H 4.930 . 4.930 4.049 3.464 4.338 . 0 0 "[ . 1]" 2 69 1 20 LEU QD 1 71 PHE HA 5.180 . 5.180 4.682 4.243 5.285 0.105 7 0 "[ . 1]" 2 70 1 20 LEU QD 1 71 PHE QB 3.670 . 3.670 2.376 2.050 2.766 . 0 0 "[ . 1]" 2 71 1 20 LEU QD 1 72 LEU H 5.850 . 5.850 4.699 4.081 5.364 . 0 0 "[ . 1]" 2 72 1 20 LEU QD 1 101 VAL HA 4.020 . 4.020 2.970 2.297 3.848 . 0 0 "[ . 1]" 2 73 1 20 LEU QD 1 101 VAL HB 3.810 . 3.810 2.733 2.040 4.296 0.486 8 0 "[ . 1]" 2 74 1 20 LEU QD 1 101 VAL QG 3.490 . 3.490 2.389 1.919 3.219 . 0 0 "[ . 1]" 2 75 1 20 LEU QD 1 104 SER H 5.390 . 5.390 4.924 4.326 5.349 . 0 0 "[ . 1]" 2 76 1 20 LEU QD 1 105 LEU H 5.290 . 5.290 5.127 4.642 5.443 0.153 1 0 "[ . 1]" 2 77 1 21 LYS H 1 21 LYS QG 3.880 . 3.880 2.600 1.758 3.403 0.042 4 0 "[ . 1]" 2 78 1 21 LYS H 1 101 VAL QG 5.280 . 5.280 4.589 3.388 5.387 0.107 9 0 "[ . 1]" 2 79 1 21 LYS HA 1 21 LYS QG 3.690 . 3.690 2.750 2.235 3.409 . 0 0 "[ . 1]" 2 80 1 21 LYS QB 1 22 ASN QB 4.770 . 4.770 3.811 3.585 4.295 . 0 0 "[ . 1]" 2 81 1 21 LYS QE 1 21 LYS QG 2.980 . 2.980 2.288 2.142 2.489 . 0 0 "[ . 1]" 2 82 1 21 LYS QD 1 97 LEU QD 4.600 . 4.600 4.600 4.304 4.842 0.242 9 0 "[ . 1]" 2 83 1 21 LYS QD 1 101 VAL QG 4.070 . 4.070 3.235 2.246 3.872 . 0 0 "[ . 1]" 2 84 1 21 LYS QE 1 97 LEU QD 4.850 . 4.850 3.938 3.305 4.925 0.075 2 0 "[ . 1]" 2 85 1 21 LYS QE 1 101 VAL QG 4.070 . 4.070 3.687 3.145 4.358 0.288 4 0 "[ . 1]" 2 86 1 22 ASN H 1 22 ASN QB 3.380 . 3.380 2.453 2.136 2.810 . 0 0 "[ . 1]" 2 87 1 22 ASN H 1 22 ASN QD 4.940 . 4.940 3.576 2.108 4.469 . 0 0 "[ . 1]" 2 88 1 22 ASN HA 1 22 ASN QD 4.170 . 4.170 3.940 3.615 4.263 0.093 5 0 "[ . 1]" 2 89 1 22 ASN HA 1 25 LEU QD 3.810 . 3.810 3.917 3.609 4.180 0.370 9 0 "[ . 1]" 2 90 1 22 ASN QD 1 25 LEU QB 5.170 . 5.170 4.461 3.614 5.398 0.228 9 0 "[ . 1]" 2 91 1 23 LYS HA 1 25 LEU QD 4.090 . 4.090 2.566 2.269 3.098 . 0 0 "[ . 1]" 2 92 1 23 LYS QE 1 25 LEU QD 2.850 . 2.850 3.025 2.820 3.222 0.372 2 0 "[ . 1]" 2 93 1 24 ILE MG 1 107 ASP QB 3.910 . 3.910 3.178 2.761 3.827 . 0 0 "[ . 1]" 2 94 1 24 ILE QG 1 28 LYS H 5.550 . 5.550 5.352 4.605 5.890 0.340 7 0 "[ . 1]" 2 95 1 25 LEU H 1 25 LEU QB 3.470 . 3.470 2.140 2.026 2.287 . 0 0 "[ . 1]" 2 96 1 25 LEU H 1 25 LEU QD 3.820 . 3.820 2.439 2.009 3.057 . 0 0 "[ . 1]" 2 97 1 25 LEU HA 1 25 LEU QB 2.640 . 2.640 2.183 2.172 2.201 . 0 0 "[ . 1]" 2 98 1 25 LEU HA 1 25 LEU QD 3.140 . 3.140 3.281 3.037 3.382 0.242 7 0 "[ . 1]" 2 99 1 25 LEU QD 1 26 LYS HA 3.720 . 3.720 2.995 2.290 3.463 . 0 0 "[ . 1]" 2 100 1 25 LEU QD 1 26 LYS QB 4.160 . 4.160 2.299 2.085 2.749 . 0 0 "[ . 1]" 2 101 1 25 LEU QD 1 26 LYS QG 3.770 . 3.770 3.427 2.023 4.043 0.273 5 0 "[ . 1]" 2 102 1 25 LEU QD 1 27 ILE H 4.820 . 4.820 3.902 3.600 4.286 . 0 0 "[ . 1]" 2 103 1 27 ILE MG 1 63 GLN QG 4.760 . 4.760 3.754 3.100 4.503 . 0 0 "[ . 1]" 2 104 1 27 ILE MD 1 63 GLN QB 3.840 . 3.840 2.485 2.234 2.798 . 0 0 "[ . 1]" 2 105 1 27 ILE MD 1 63 GLN QG 3.940 . 3.940 3.771 2.405 4.160 0.220 3 0 "[ . 1]" 2 106 1 31 ALA HA 1 36 VAL QG 4.160 . 4.160 3.286 2.901 3.861 . 0 0 "[ . 1]" 2 107 1 31 ALA HA 1 57 LEU QD 5.380 . 5.380 4.307 3.845 4.820 . 0 0 "[ . 1]" 2 108 1 31 ALA MB 1 36 VAL QG 3.320 . 3.320 2.322 2.103 2.763 . 0 0 "[ . 1]" 2 109 1 32 THR HA 1 36 VAL QG 4.450 . 4.450 3.259 2.122 4.059 . 0 0 "[ . 1]" 2 110 1 32 THR MG 1 36 VAL QG 4.660 . 4.660 4.117 3.499 4.869 0.209 2 0 "[ . 1]" 2 111 1 34 LYS H 1 35 GLY QA 5.630 . 5.630 4.497 4.290 4.631 . 0 0 "[ . 1]" 2 112 1 35 GLY H 1 36 VAL QG 5.860 . 5.860 3.692 2.808 4.151 . 0 0 "[ . 1]" 2 113 1 36 VAL H 1 36 VAL QG 3.680 . 3.680 2.190 1.752 2.524 0.048 9 0 "[ . 1]" 2 114 1 36 VAL H 1 37 LEU QD 4.990 . 4.990 4.665 4.148 5.020 0.030 3 0 "[ . 1]" 2 115 1 36 VAL HA 1 37 LEU QD 4.530 . 4.530 3.550 2.642 3.839 . 0 0 "[ . 1]" 2 116 1 36 VAL HA 1 57 LEU QD 5.010 . 5.010 4.912 4.539 5.094 0.084 8 0 "[ . 1]" 2 117 1 36 VAL QG 1 37 LEU HA 5.920 . 5.920 3.824 3.636 4.038 . 0 0 "[ . 1]" 2 118 1 36 VAL QG 1 37 LEU QD 3.920 . 3.920 3.892 3.765 4.018 0.098 5 0 "[ . 1]" 2 119 1 36 VAL QG 1 38 PHE H 5.920 . 5.920 4.134 3.139 4.605 . 0 0 "[ . 1]" 2 120 1 36 VAL QG 1 38 PHE HA 4.470 . 4.470 4.008 3.392 4.594 0.124 8 0 "[ . 1]" 2 121 1 36 VAL QG 1 38 PHE QD 4.160 . 4.160 3.954 3.499 4.393 0.233 7 0 "[ . 1]" 2 122 1 36 VAL QG 1 56 ALA MB 3.360 . 3.360 3.207 2.666 3.479 0.119 7 0 "[ . 1]" 2 123 1 36 VAL QG 1 57 LEU HA 4.810 . 4.810 3.610 2.884 3.985 . 0 0 "[ . 1]" 2 124 1 36 VAL QG 1 57 LEU HG 5.370 . 5.370 4.248 4.010 4.580 . 0 0 "[ . 1]" 2 125 1 37 LEU H 1 37 LEU QD 4.820 . 4.820 2.811 1.836 3.234 . 0 0 "[ . 1]" 2 126 1 37 LEU HA 1 37 LEU QD 3.750 . 3.750 2.329 2.138 3.073 . 0 0 "[ . 1]" 2 127 1 37 LEU QD 1 38 PHE H 5.410 . 5.410 3.803 3.485 4.413 . 0 0 "[ . 1]" 2 128 1 39 GLU H 1 39 GLU QB 3.690 . 3.690 2.394 2.246 2.636 . 0 0 "[ . 1]" 2 129 1 39 GLU H 1 44 LEU QD 5.920 . 5.920 5.232 4.009 5.854 . 0 0 "[ . 1]" 2 130 1 39 GLU HA 1 39 GLU QB 2.640 . 2.640 2.351 2.179 2.398 . 0 0 "[ . 1]" 2 131 1 39 GLU QB 1 40 ALA H 4.160 . 4.160 2.771 2.153 3.461 . 0 0 "[ . 1]" 2 132 1 39 GLU QB 1 41 PHE H 5.810 . 5.810 4.611 4.052 5.768 . 0 0 "[ . 1]" 2 133 1 40 ALA H 1 41 PHE QB 5.650 . 5.650 4.612 3.787 5.114 . 0 0 "[ . 1]" 2 134 1 40 ALA H 1 44 LEU QB 5.810 . 5.810 5.740 4.521 6.301 0.491 9 0 "[ . 1]" 2 135 1 40 ALA H 1 44 LEU QD 4.330 . 4.330 3.792 3.144 4.105 . 0 0 "[ . 1]" 2 136 1 40 ALA HA 1 41 PHE QB 5.540 . 5.540 4.529 4.108 5.382 . 0 0 "[ . 1]" 2 137 1 40 ALA HA 1 44 LEU QB 5.810 . 5.810 5.083 3.403 6.248 0.438 2 0 "[ . 1]" 2 138 1 40 ALA HA 1 44 LEU QD 5.000 . 5.000 3.407 2.002 4.847 . 0 0 "[ . 1]" 2 139 1 41 PHE H 1 44 LEU QD 5.830 . 5.830 3.286 1.936 4.206 . 0 0 "[ . 1]" 2 140 1 41 PHE HA 1 44 LEU QD 4.120 . 4.120 3.522 2.238 4.610 0.490 9 0 "[ . 1]" 2 141 1 41 PHE QB 1 44 LEU QD 3.940 . 3.940 3.918 3.531 4.257 0.317 7 0 "[ . 1]" 2 142 1 41 PHE QB 1 46 THR MG 5.720 . 5.720 5.550 4.962 5.905 0.185 9 0 "[ . 1]" 2 143 1 43 GLY QA 1 44 LEU QD 3.640 . 3.640 3.266 2.446 3.714 0.074 6 0 "[ . 1]" 2 144 1 44 LEU HA 1 44 LEU QD 3.880 . 3.880 3.272 2.671 3.391 . 0 0 "[ . 1]" 2 145 1 44 LEU QD 1 45 LYS H 4.780 . 4.780 3.212 1.834 4.373 . 0 0 "[ . 1]" 2 146 1 44 LEU QD 1 47 GLY QA 5.480 . 5.480 5.099 4.082 5.856 0.376 6 0 "[ . 1]" 2 147 1 44 LEU QD 1 49 LYS H 4.650 . 4.650 4.310 3.565 4.936 0.286 7 0 "[ . 1]" 2 148 1 44 LEU QD 1 49 LYS QG 4.080 . 4.080 3.749 2.230 4.289 0.209 10 0 "[ . 1]" 2 149 1 49 LYS H 1 49 LYS QG 4.550 . 4.550 3.539 1.805 4.199 . 0 0 "[ . 1]" 2 150 1 49 LYS HA 1 49 LYS QB 2.610 . 2.610 2.391 2.183 2.557 . 0 0 "[ . 1]" 2 151 1 49 LYS HA 1 49 LYS QG 3.070 . 3.070 2.494 2.238 3.292 0.222 3 0 "[ . 1]" 2 152 1 49 LYS HA 1 50 VAL QG 3.860 . 3.860 3.764 3.186 4.292 0.432 2 0 "[ . 1]" 2 153 1 49 LYS QG 1 50 VAL QG 4.770 . 4.770 3.702 2.304 5.004 0.234 1 0 "[ . 1]" 2 154 1 49 LYS QE 1 50 VAL QG 4.890 . 4.890 4.483 2.239 5.352 0.462 7 0 "[ . 1]" 2 155 1 50 VAL H 1 50 VAL QG 3.460 . 3.460 2.179 1.742 2.719 0.058 1 0 "[ . 1]" 2 156 1 50 VAL HA 1 50 VAL QG 2.980 . 2.980 2.281 2.091 2.402 . 0 0 "[ . 1]" 2 157 1 50 VAL QG 1 51 THR H 4.720 . 4.720 2.829 1.617 3.742 0.183 7 0 "[ . 1]" 2 158 1 50 VAL QG 1 52 SER H 5.170 . 5.170 2.891 1.892 4.032 . 0 0 "[ . 1]" 2 159 1 50 VAL QG 1 52 SER HA 5.060 . 5.060 4.137 3.218 5.432 0.372 4 0 "[ . 1]" 2 160 1 50 VAL QG 1 52 SER QB 3.620 . 3.620 3.015 2.176 3.799 0.179 7 0 "[ . 1]" 2 161 1 53 GLY QA 1 57 LEU QD 4.870 . 4.870 3.610 2.129 4.880 0.010 9 0 "[ . 1]" 2 162 1 55 LEU QD 1 56 ALA H 5.490 . 5.490 3.806 3.091 4.230 . 0 0 "[ . 1]" 2 163 1 57 LEU H 1 57 LEU QD 4.080 . 4.080 3.737 3.667 3.789 . 0 0 "[ . 1]" 2 164 1 57 LEU QD 1 58 ARG H 5.260 . 5.260 3.522 2.618 4.165 . 0 0 "[ . 1]" 2 165 1 57 LEU QD 1 60 ALA H 5.420 . 5.420 4.294 3.938 4.657 . 0 0 "[ . 1]" 2 166 1 57 LEU QD 1 61 LYS H 4.930 . 4.930 4.224 3.725 4.772 . 0 0 "[ . 1]" 2 167 1 57 LEU QD 1 61 LYS QG 4.530 . 4.530 3.140 2.680 3.688 . 0 0 "[ . 1]" 2 168 1 60 ALA HA 1 63 GLN QB 3.210 . 3.210 2.446 2.336 2.797 . 0 0 "[ . 1]" 2 169 1 62 VAL H 1 62 VAL QG 3.790 . 3.790 2.075 1.823 2.434 . 0 0 "[ . 1]" 2 170 1 62 VAL HB 1 150 GLN QG 5.190 . 5.190 4.617 2.578 5.328 0.138 3 0 "[ . 1]" 2 171 1 62 VAL QG 1 63 GLN HA 4.490 . 4.490 3.560 2.950 3.928 . 0 0 "[ . 1]" 2 172 1 62 VAL QG 1 65 ILE H 4.800 . 4.800 4.267 4.100 4.402 . 0 0 "[ . 1]" 2 173 1 62 VAL QG 1 65 ILE HB 3.970 . 3.970 3.318 3.004 3.748 . 0 0 "[ . 1]" 2 174 1 62 VAL QG 1 65 ILE QG 3.630 . 3.630 3.762 3.241 3.968 0.338 7 0 "[ . 1]" 2 175 1 62 VAL QG 1 66 VAL HA 5.760 . 5.760 5.145 4.762 5.550 . 0 0 "[ . 1]" 2 176 1 62 VAL QG 1 147 LYS QG 3.830 . 3.830 2.333 2.040 2.818 . 0 0 "[ . 1]" 2 177 1 62 VAL QG 1 150 GLN H 4.710 . 4.710 4.385 3.342 4.937 0.227 4 0 "[ . 1]" 2 178 1 62 VAL QG 1 150 GLN QG 3.320 . 3.320 2.484 2.028 3.606 0.286 3 0 "[ . 1]" 2 179 1 63 GLN HA 1 63 GLN QG 3.430 . 3.430 2.547 2.407 2.841 . 0 0 "[ . 1]" 2 180 1 63 GLN HA 1 66 VAL QG 3.730 . 3.730 2.605 2.393 2.875 . 0 0 "[ . 1]" 2 181 1 63 GLN QB 1 64 ALA HA 4.480 . 4.480 3.931 3.801 4.041 . 0 0 "[ . 1]" 2 182 1 63 GLN QB 1 64 ALA MB 4.400 . 4.400 4.060 3.904 4.151 . 0 0 "[ . 1]" 2 183 1 63 GLN QE 1 66 VAL QG 4.670 . 4.670 3.174 2.420 4.061 . 0 0 "[ . 1]" 2 184 1 63 GLN QE 1 67 GLU QG 4.790 . 4.790 4.444 3.411 4.988 0.198 6 0 "[ . 1]" 2 185 1 64 ALA HA 1 105 LEU QD 4.530 . 4.530 4.351 3.968 4.611 0.081 7 0 "[ . 1]" 2 186 1 64 ALA MB 1 105 LEU QD 3.320 . 3.320 2.391 1.917 2.658 . 0 0 "[ . 1]" 2 187 1 65 ILE H 1 105 LEU QD 4.960 . 4.960 3.608 2.815 4.144 . 0 0 "[ . 1]" 2 188 1 65 ILE HA 1 105 LEU QD 5.190 . 5.190 3.331 2.723 3.814 . 0 0 "[ . 1]" 2 189 1 66 VAL H 1 66 VAL QG 3.630 . 3.630 1.904 1.802 2.011 . 0 0 "[ . 1]" 2 190 1 66 VAL HA 1 66 VAL QG 3.090 . 3.090 2.097 2.082 2.110 . 0 0 "[ . 1]" 2 191 1 66 VAL QG 1 67 GLU H 5.520 . 5.520 3.215 3.155 3.341 . 0 0 "[ . 1]" 2 192 1 66 VAL QG 1 67 GLU HA 4.780 . 4.780 3.500 3.396 3.661 . 0 0 "[ . 1]" 2 193 1 66 VAL QG 1 67 GLU QG 4.810 . 4.810 3.661 3.317 4.832 0.022 10 0 "[ . 1]" 2 194 1 66 VAL QG 1 147 LYS QG 4.290 . 4.290 3.697 2.549 4.303 0.013 7 0 "[ . 1]" 2 195 1 66 VAL QG 1 147 LYS QD 3.660 . 3.660 3.176 2.103 3.769 0.109 7 0 "[ . 1]" 2 196 1 67 GLU H 1 67 GLU QG 4.010 . 4.010 2.555 2.021 3.957 . 0 0 "[ . 1]" 2 197 1 67 GLU HA 1 67 GLU QG 3.450 . 3.450 2.558 2.296 2.854 . 0 0 "[ . 1]" 2 198 1 68 THR H 1 105 LEU QD 4.990 . 4.990 4.679 4.439 4.929 . 0 0 "[ . 1]" 2 199 1 68 THR HB 1 71 PHE QB 4.910 . 4.910 4.304 3.722 4.769 . 0 0 "[ . 1]" 2 200 1 68 THR MG 1 101 VAL QG 4.920 . 4.920 3.715 2.710 4.531 . 0 0 "[ . 1]" 2 201 1 68 THR MG 1 105 LEU QD 4.270 . 4.270 2.233 2.018 2.755 . 0 0 "[ . 1]" 2 202 1 69 GLY H 1 72 LEU QB 5.340 . 5.340 4.615 4.445 5.369 0.029 2 0 "[ . 1]" 2 203 1 69 GLY H 1 72 LEU QD 4.880 . 4.880 5.057 4.548 5.349 0.469 4 0 "[ . 1]" 2 204 1 69 GLY H 1 143 LEU QB 5.810 . 5.810 5.860 5.568 6.079 0.269 6 0 "[ . 1]" 2 205 1 70 LYS H 1 72 LEU QB 5.510 . 5.510 4.617 4.429 5.313 . 0 0 "[ . 1]" 2 206 1 71 PHE H 1 72 LEU QB 5.790 . 5.790 4.235 4.135 4.473 . 0 0 "[ . 1]" 2 207 1 71 PHE QB 1 74 ILE MD 5.180 . 5.180 3.868 3.510 5.253 0.073 9 0 "[ . 1]" 2 208 1 71 PHE QD 1 97 LEU QD 4.350 . 4.350 4.450 4.058 4.669 0.319 4 0 "[ . 1]" 2 209 1 71 PHE QD 1 101 VAL QG 3.950 . 3.950 3.066 2.443 3.728 . 0 0 "[ . 1]" 2 210 1 72 LEU H 1 72 LEU QD 4.360 . 4.360 3.672 3.110 3.763 . 0 0 "[ . 1]" 2 211 1 72 LEU HA 1 72 LEU QD 3.520 . 3.520 2.720 2.081 3.227 . 0 0 "[ . 1]" 2 212 1 72 LEU QD 1 73 LYS H 5.350 . 5.350 3.507 2.950 4.091 . 0 0 "[ . 1]" 2 213 1 72 LEU QD 1 76 GLU H 4.700 . 4.700 4.021 3.112 4.524 . 0 0 "[ . 1]" 2 214 1 72 LEU QD 1 76 GLU QG 4.310 . 4.310 4.198 3.655 4.672 0.362 9 0 "[ . 1]" 2 215 1 72 LEU QD 1 140 GLU QB 3.530 . 3.530 3.268 2.254 3.966 0.436 3 0 "[ . 1]" 2 216 1 72 LEU QD 1 140 GLU QG 3.660 . 3.660 2.510 1.976 3.965 0.305 10 0 "[ . 1]" 2 217 1 75 ILE HB 1 97 LEU QD 4.720 . 4.720 4.678 4.264 4.930 0.210 6 0 "[ . 1]" 2 218 1 75 ILE MG 1 97 LEU QD 3.750 . 3.750 2.949 2.335 3.815 0.065 8 0 "[ . 1]" 2 219 1 75 ILE MD 1 97 LEU QD 3.850 . 3.850 2.406 2.136 2.661 . 0 0 "[ . 1]" 2 220 1 76 GLU HA 1 133 LEU QD 4.490 . 4.490 4.220 2.801 4.804 0.314 2 0 "[ . 1]" 2 221 1 76 GLU QG 1 133 LEU QD 3.700 . 3.700 3.416 2.778 3.919 0.219 3 0 "[ . 1]" 2 222 1 77 GLU H 1 77 GLU QB 3.600 . 3.600 2.496 2.354 2.698 . 0 0 "[ . 1]" 2 223 1 77 GLU H 1 77 GLU QG 3.230 . 3.230 2.096 1.770 2.388 0.030 4 0 "[ . 1]" 2 224 1 77 GLU HA 1 77 GLU QG 3.520 . 3.520 2.769 2.336 3.304 . 0 0 "[ . 1]" 2 225 1 77 GLU QG 1 78 GLU H 4.180 . 4.180 3.610 2.445 4.280 0.100 9 0 "[ . 1]" 2 226 1 79 ALA HA 1 82 LEU QB 4.150 . 4.150 2.839 2.281 3.647 . 0 0 "[ . 1]" 2 227 1 79 ALA HA 1 82 LEU QD 4.170 . 4.170 2.996 2.301 4.185 0.015 4 0 "[ . 1]" 2 228 1 79 ALA MB 1 133 LEU QD 3.470 . 3.470 2.999 2.299 3.498 0.028 8 0 "[ . 1]" 2 229 1 80 LEU H 1 80 LEU QB 3.670 . 3.670 2.177 2.104 2.253 . 0 0 "[ . 1]" 2 230 1 80 LEU H 1 80 LEU QD 3.820 . 3.820 3.596 3.131 3.777 . 0 0 "[ . 1]" 2 231 1 80 LEU H 1 133 LEU QD 4.820 . 4.820 4.132 3.513 4.846 0.026 9 0 "[ . 1]" 2 232 1 80 LEU HA 1 80 LEU QD 2.900 . 2.900 2.353 1.912 3.024 0.124 4 0 "[ . 1]" 2 233 1 80 LEU QB 1 81 LYS H 4.150 . 4.150 2.627 2.090 3.039 . 0 0 "[ . 1]" 2 234 1 80 LEU QD 1 81 LYS H 5.050 . 5.050 3.670 3.058 4.184 . 0 0 "[ . 1]" 2 235 1 80 LEU QD 1 83 LYS H 5.150 . 5.150 4.293 3.439 5.100 . 0 0 "[ . 1]" 2 236 1 80 LEU QD 1 83 LYS QE 3.590 . 3.590 3.118 2.273 3.991 0.401 3 0 "[ . 1]" 2 237 1 82 LEU H 1 82 LEU QD 3.970 . 3.970 2.887 1.769 3.768 0.031 9 0 "[ . 1]" 2 238 1 82 LEU HA 1 82 LEU QD 3.410 . 3.410 2.170 1.968 3.000 . 0 0 "[ . 1]" 2 239 1 82 LEU QB 1 86 GLY H 5.040 . 5.040 3.872 3.281 4.859 . 0 0 "[ . 1]" 2 240 1 82 LEU QD 1 83 LYS H 4.380 . 4.380 4.046 3.776 4.396 0.016 6 0 "[ . 1]" 2 241 1 82 LEU QD 1 85 THR HB 5.120 . 5.120 3.815 3.332 4.605 . 0 0 "[ . 1]" 2 242 1 82 LEU QD 1 85 THR MG 4.350 . 4.350 2.796 2.059 3.814 . 0 0 "[ . 1]" 2 243 1 82 LEU QD 1 86 GLY H 4.470 . 4.470 3.581 2.798 4.194 . 0 0 "[ . 1]" 2 244 1 82 LEU QD 1 86 GLY QA 4.980 . 4.980 4.316 3.268 4.967 . 0 0 "[ . 1]" 2 245 1 82 LEU QD 1 90 GLN H 5.260 . 5.260 4.642 3.792 5.087 . 0 0 "[ . 1]" 2 246 1 82 LEU QD 1 90 GLN QB 4.050 . 4.050 2.516 1.862 2.923 . 0 0 "[ . 1]" 2 247 1 82 LEU QD 1 90 GLN QG 3.700 . 3.700 2.199 1.847 2.520 . 0 0 "[ . 1]" 2 248 1 82 LEU QD 1 90 GLN QE 4.050 . 4.050 3.138 1.731 4.183 0.133 4 0 "[ . 1]" 2 249 1 82 LEU QD 1 91 PHE H 5.910 . 5.910 3.996 3.262 4.824 . 0 0 "[ . 1]" 2 250 1 82 LEU QD 1 91 PHE HA 5.530 . 5.530 3.713 3.001 5.047 . 0 0 "[ . 1]" 2 251 1 82 LEU QD 1 91 PHE QD 4.290 . 4.290 3.715 2.153 4.522 0.232 5 0 "[ . 1]" 2 252 1 82 LEU QD 1 129 ALA MB 4.500 . 4.500 4.396 3.541 4.716 0.216 8 0 "[ . 1]" 2 253 1 84 GLU H 1 84 GLU QB 3.620 . 3.620 2.553 2.396 2.851 . 0 0 "[ . 1]" 2 254 1 84 GLU QB 1 85 THR MG 3.880 . 3.880 2.923 2.612 3.605 . 0 0 "[ . 1]" 2 255 1 86 GLY H 1 90 GLN QB 5.810 . 5.810 5.574 5.015 6.007 0.197 10 0 "[ . 1]" 2 256 1 88 SER QB 1 92 LEU QD 4.330 . 4.330 3.112 2.385 3.918 . 0 0 "[ . 1]" 2 257 1 88 SER QB 1 127 ASN HA 4.880 . 4.880 3.123 2.140 4.732 . 0 0 "[ . 1]" 2 258 1 88 SER QB 1 127 ASN QB 3.520 . 3.520 2.261 2.064 2.447 . 0 0 "[ . 1]" 2 259 1 89 GLY H 1 90 GLN QB 5.550 . 5.550 4.630 4.470 4.844 . 0 0 "[ . 1]" 2 260 1 89 GLY H 1 92 LEU QD 5.440 . 5.440 4.044 3.477 4.775 . 0 0 "[ . 1]" 2 261 1 89 GLY QA 1 92 LEU QB 4.210 . 4.210 2.737 2.319 3.561 . 0 0 "[ . 1]" 2 262 1 89 GLY QA 1 92 LEU QD 4.710 . 4.710 2.536 2.080 3.411 . 0 0 "[ . 1]" 2 263 1 90 GLN QB 1 91 PHE H 4.290 . 4.290 2.599 2.213 2.847 . 0 0 "[ . 1]" 2 264 1 91 PHE H 1 92 LEU QD 5.200 . 5.200 4.628 3.780 5.108 . 0 0 "[ . 1]" 2 265 1 92 LEU H 1 92 LEU QD 4.330 . 4.330 3.100 2.236 3.540 . 0 0 "[ . 1]" 2 266 1 92 LEU QB 1 93 ALA HA 4.420 . 4.420 3.874 3.819 3.971 . 0 0 "[ . 1]" 2 267 1 92 LEU QB 1 93 ALA MB 4.150 . 4.150 3.859 3.657 4.158 0.008 9 0 "[ . 1]" 2 268 1 92 LEU QB 1 95 PHE H 4.620 . 4.620 4.843 4.618 5.082 0.462 3 0 "[ . 1]" 2 269 1 92 LEU QB 1 96 ASP H 5.350 . 5.350 5.115 4.409 5.654 0.304 3 0 "[ . 1]" 2 270 1 92 LEU QD 1 93 ALA H 5.180 . 5.180 4.055 3.656 4.303 . 0 0 "[ . 1]" 2 271 1 92 LEU QD 1 94 MET H 5.920 . 5.920 5.275 4.389 5.556 . 0 0 "[ . 1]" 2 272 1 92 LEU QD 1 95 PHE H 5.920 . 5.920 4.672 3.508 4.946 . 0 0 "[ . 1]" 2 273 1 92 LEU QD 1 95 PHE QD 5.120 . 5.120 4.353 3.264 5.060 . 0 0 "[ . 1]" 2 274 1 92 LEU QD 1 96 ASP H 5.680 . 5.680 4.983 3.573 5.517 . 0 0 "[ . 1]" 2 275 1 92 LEU QD 1 127 ASN HA 4.380 . 4.380 4.099 2.925 4.712 0.332 5 0 "[ . 1]" 2 276 1 92 LEU QD 1 127 ASN QD 5.720 . 5.720 3.779 1.819 5.746 0.026 2 0 "[ . 1]" 2 277 1 93 ALA HA 1 96 ASP QB 3.610 . 3.610 3.084 2.730 3.594 . 0 0 "[ . 1]" 2 278 1 94 MET H 1 132 LEU QD 5.920 . 5.920 5.227 4.645 6.317 0.397 9 0 "[ . 1]" 2 279 1 94 MET ME 1 132 LEU QD 3.060 . 3.060 2.136 1.890 2.643 . 0 0 "[ . 1]" 2 280 1 95 PHE H 1 132 LEU QD 5.360 . 5.360 4.196 3.528 5.366 0.006 9 0 "[ . 1]" 2 281 1 95 PHE QB 1 99 LEU QD 5.730 . 5.730 4.061 3.866 4.265 . 0 0 "[ . 1]" 2 282 1 95 PHE QB 1 126 ILE MG 4.810 . 4.810 3.789 3.112 4.487 . 0 0 "[ . 1]" 2 283 1 95 PHE QB 1 132 LEU QD 5.030 . 5.030 3.388 2.664 4.368 . 0 0 "[ . 1]" 2 284 1 95 PHE QE 1 99 LEU QD 4.080 . 4.080 2.593 2.377 3.253 . 0 0 "[ . 1]" 2 285 1 95 PHE QE 1 117 VAL QG 3.680 . 3.680 3.427 2.972 3.782 0.102 10 0 "[ . 1]" 2 286 1 96 ASP H 1 99 LEU QD 5.920 . 5.920 4.446 4.267 4.630 . 0 0 "[ . 1]" 2 287 1 96 ASP HA 1 99 LEU QD 3.730 . 3.730 2.855 2.307 3.869 0.139 5 0 "[ . 1]" 2 288 1 97 LEU HA 1 97 LEU QD 3.210 . 3.210 2.454 2.119 3.004 . 0 0 "[ . 1]" 2 289 1 97 LEU QD 1 98 MET H 5.210 . 5.210 3.297 2.687 3.986 . 0 0 "[ . 1]" 2 290 1 97 LEU QD 1 101 VAL H 5.740 . 5.740 3.893 3.115 5.064 . 0 0 "[ . 1]" 2 291 1 97 LEU QD 1 101 VAL QG 3.520 . 3.520 2.906 2.073 3.618 0.098 4 0 "[ . 1]" 2 292 1 98 MET H 1 99 LEU QD 5.920 . 5.920 4.476 3.000 4.742 . 0 0 "[ . 1]" 2 293 1 98 MET H 1 101 VAL QG 5.920 . 5.920 4.335 4.020 4.994 . 0 0 "[ . 1]" 2 294 1 98 MET HA 1 99 LEU QD 4.680 . 4.680 4.771 3.939 4.969 0.289 7 0 "[ . 1]" 2 295 1 98 MET HA 1 101 VAL QG 4.330 . 4.330 2.558 2.188 3.076 . 0 0 "[ . 1]" 2 296 1 98 MET HA 1 102 VAL QG 5.040 . 5.040 4.615 4.130 5.144 0.104 3 0 "[ . 1]" 2 297 1 98 MET HB2 1 99 LEU QD 4.750 . 4.750 4.469 3.371 4.858 0.108 9 0 "[ . 1]" 2 298 1 99 LEU H 1 99 LEU QD 3.900 . 3.900 3.007 2.061 3.200 . 0 0 "[ . 1]" 2 299 1 99 LEU H 1 102 VAL QG 5.910 . 5.910 4.284 4.025 4.510 . 0 0 "[ . 1]" 2 300 1 99 LEU HA 1 99 LEU QD 3.770 . 3.770 2.105 2.011 2.140 . 0 0 "[ . 1]" 2 301 1 99 LEU HA 1 102 VAL QG 3.900 . 3.900 2.204 2.062 2.410 . 0 0 "[ . 1]" 2 302 1 99 LEU HA 1 114 LYS QG 4.070 . 4.070 4.108 3.598 4.400 0.330 4 0 "[ . 1]" 2 303 1 99 LEU HB2 1 102 VAL QG 4.150 . 4.150 4.353 4.228 4.581 0.431 5 0 "[ . 1]" 2 304 1 99 LEU QD 1 100 GLU H 4.760 . 4.760 4.177 3.838 4.277 . 0 0 "[ . 1]" 2 305 1 99 LEU QD 1 102 VAL QG 3.230 . 3.230 2.861 2.737 3.030 . 0 0 "[ . 1]" 2 306 1 99 LEU QD 1 114 LYS HA 4.480 . 4.480 3.994 2.776 4.578 0.098 5 0 "[ . 1]" 2 307 1 99 LEU QD 1 114 LYS QG 4.700 . 4.700 2.249 2.129 2.492 . 0 0 "[ . 1]" 2 308 1 99 LEU QD 1 114 LYS QE 4.150 . 4.150 2.491 2.194 3.153 . 0 0 "[ . 1]" 2 309 1 99 LEU QD 1 117 VAL QG 3.640 . 3.640 2.213 1.934 2.781 . 0 0 "[ . 1]" 2 310 1 99 LEU QD 1 139 ILE MD 3.250 . 3.250 2.482 2.033 3.257 0.007 9 0 "[ . 1]" 2 311 1 100 GLU H 1 102 VAL QG 5.350 . 5.350 4.018 3.801 4.215 . 0 0 "[ . 1]" 2 312 1 101 VAL H 1 101 VAL QG 3.680 . 3.680 1.791 1.730 2.083 0.070 10 0 "[ . 1]" 2 313 1 101 VAL H 1 102 VAL QG 5.570 . 5.570 3.630 3.496 3.769 . 0 0 "[ . 1]" 2 314 1 101 VAL QG 1 102 VAL H 4.100 . 4.100 1.924 1.644 2.692 0.156 9 0 "[ . 1]" 2 315 1 101 VAL QG 1 102 VAL HA 4.100 . 4.100 3.307 2.990 3.762 . 0 0 "[ . 1]" 2 316 1 101 VAL QG 1 103 GLU H 5.570 . 5.570 3.748 3.590 4.047 . 0 0 "[ . 1]" 2 317 1 102 VAL H 1 102 VAL QG 3.670 . 3.670 1.787 1.730 1.831 0.070 4 0 "[ . 1]" 2 318 1 102 VAL HA 1 102 VAL QG 3.000 . 3.000 2.244 2.109 2.309 . 0 0 "[ . 1]" 2 319 1 102 VAL QG 1 114 LYS HA 5.270 . 5.270 4.488 3.620 5.102 . 0 0 "[ . 1]" 2 320 1 102 VAL QG 1 114 LYS QB 3.530 . 3.530 3.156 2.441 3.659 0.129 2 0 "[ . 1]" 2 321 1 102 VAL QG 1 114 LYS QG 4.580 . 4.580 3.292 2.328 3.775 . 0 0 "[ . 1]" 2 322 1 102 VAL QG 1 114 LYS QE 3.670 . 3.670 2.790 1.988 4.126 0.456 10 0 "[ . 1]" 2 323 1 105 LEU H 1 105 LEU QD 4.010 . 4.010 2.531 1.792 2.964 0.008 2 0 "[ . 1]" 2 324 1 105 LEU HA 1 105 LEU QD 3.400 . 3.400 2.178 2.004 2.476 . 0 0 "[ . 1]" 2 325 1 105 LEU QD 1 106 GLU H 5.520 . 5.520 4.087 3.760 4.320 . 0 0 "[ . 1]" 2 326 1 107 ASP QB 1 108 VAL H 4.270 . 4.270 2.730 2.205 3.641 . 0 0 "[ . 1]" 2 327 1 107 ASP QB 1 108 VAL MG1 4.610 . 4.610 3.355 2.801 4.435 . 0 0 "[ . 1]" 2 328 1 108 VAL H 1 109 GLY QA 5.760 . 5.760 4.517 4.212 4.743 . 0 0 "[ . 1]" 2 329 1 108 VAL MG2 1 109 GLY QA 4.640 . 4.640 4.386 4.064 5.063 0.423 1 0 "[ . 1]" 2 330 1 109 GLY QA 1 111 ILE MG 3.690 . 3.690 3.925 3.544 4.188 0.498 5 0 "[ . 1]" 2 331 1 109 GLY QA 1 111 ILE MD 4.740 . 4.740 4.368 3.150 5.279 0.539 5 1 "[ + 1]" 2 332 1 111 ILE HA 1 112 GLY QA 4.490 . 4.490 4.027 3.883 4.347 . 0 0 "[ . 1]" 2 333 1 111 ILE HB 1 112 GLY QA 4.370 . 4.370 4.375 3.629 4.759 0.389 4 0 "[ . 1]" 2 334 1 111 ILE QG 1 112 GLY H 4.960 . 4.960 3.815 2.850 4.473 . 0 0 "[ . 1]" 2 335 1 111 ILE QG 1 112 GLY QA 4.420 . 4.420 4.024 3.369 4.447 0.027 8 0 "[ . 1]" 2 336 1 113 LEU H 1 113 LEU QD 4.230 . 4.230 2.422 1.789 4.299 0.069 5 0 "[ . 1]" 2 337 1 113 LEU HA 1 113 LEU QD 3.820 . 3.820 3.203 2.239 3.431 . 0 0 "[ . 1]" 2 338 1 113 LEU HG 1 142 GLN QG 4.970 . 4.970 3.469 2.464 5.014 0.044 1 0 "[ . 1]" 2 339 1 113 LEU QD 1 114 LYS HA 4.800 . 4.800 3.844 2.886 4.603 . 0 0 "[ . 1]" 2 340 1 113 LEU QD 1 116 ARG QB 4.200 . 4.200 2.980 2.598 3.730 . 0 0 "[ . 1]" 2 341 1 113 LEU QD 1 116 ARG QD 4.900 . 4.900 3.181 2.177 3.899 . 0 0 "[ . 1]" 2 342 1 113 LEU QD 1 117 VAL HA 5.920 . 5.920 5.261 4.539 6.082 0.162 5 0 "[ . 1]" 2 343 1 113 LEU QD 1 117 VAL HB 4.920 . 4.920 4.364 3.511 4.954 0.034 9 0 "[ . 1]" 2 344 1 113 LEU QD 1 142 GLN H 5.120 . 5.120 4.771 4.222 5.253 0.133 8 0 "[ . 1]" 2 345 1 113 LEU QD 1 142 GLN QB 4.320 . 4.320 2.737 2.044 3.504 . 0 0 "[ . 1]" 2 346 1 113 LEU QD 1 142 GLN QG 3.400 . 3.400 2.282 1.822 3.396 . 0 0 "[ . 1]" 2 347 1 113 LEU QD 1 142 GLN QE 4.710 . 4.710 2.586 1.756 3.459 0.044 5 0 "[ . 1]" 2 348 1 113 LEU QD 1 143 LEU HA 5.920 . 5.920 5.260 3.270 6.056 0.136 6 0 "[ . 1]" 2 349 1 113 LEU QD 1 145 VAL HB 4.550 . 4.550 4.222 2.678 4.783 0.233 6 0 "[ . 1]" 2 350 1 113 LEU QD 1 145 VAL QG 4.470 . 4.470 3.654 2.055 4.392 . 0 0 "[ . 1]" 2 351 1 114 LYS HA 1 114 LYS QG 3.540 . 3.540 2.427 2.310 2.705 . 0 0 "[ . 1]" 2 352 1 114 LYS HA 1 117 VAL QG 4.060 . 4.060 2.763 2.192 3.368 . 0 0 "[ . 1]" 2 353 1 114 LYS HA 1 118 LEU QD 5.660 . 5.660 4.145 3.432 4.998 . 0 0 "[ . 1]" 2 354 1 114 LYS QB 1 114 LYS QE 4.190 . 4.190 2.851 2.156 3.704 . 0 0 "[ . 1]" 2 355 1 114 LYS QB 1 115 ALA H 3.970 . 3.970 2.329 2.065 2.582 . 0 0 "[ . 1]" 2 356 1 114 LYS QE 1 114 LYS QG 3.380 . 3.380 2.273 2.214 2.395 . 0 0 "[ . 1]" 2 357 1 114 LYS QG 1 117 VAL QG 3.800 . 3.800 2.570 2.070 3.588 . 0 0 "[ . 1]" 2 358 1 114 LYS QG 1 118 LEU QD 3.260 . 3.260 2.441 2.045 3.335 0.075 8 0 "[ . 1]" 2 359 1 114 LYS QE 1 118 LEU QD 4.170 . 4.170 3.413 2.254 4.287 0.117 9 0 "[ . 1]" 2 360 1 115 ALA H 1 118 LEU QD 4.750 . 4.750 3.850 3.593 4.107 . 0 0 "[ . 1]" 2 361 1 115 ALA HA 1 118 LEU QD 4.040 . 4.040 2.224 2.116 2.650 . 0 0 "[ . 1]" 2 362 1 116 ARG QG 1 119 GLU QB 4.160 . 4.160 4.090 3.593 4.714 0.554 8 1 "[ . + 1]" 2 363 1 117 VAL H 1 117 VAL QG 3.580 . 3.580 2.419 2.108 2.663 . 0 0 "[ . 1]" 2 364 1 117 VAL H 1 118 LEU QD 5.140 . 5.140 3.907 3.212 4.640 . 0 0 "[ . 1]" 2 365 1 117 VAL HA 1 117 VAL QG 3.030 . 3.030 2.173 2.089 2.229 . 0 0 "[ . 1]" 2 366 1 117 VAL HA 1 138 GLN QE 5.670 . 5.670 4.462 3.800 5.663 . 0 0 "[ . 1]" 2 367 1 117 VAL HB 1 118 LEU QD 4.810 . 4.810 4.187 2.826 5.229 0.419 10 0 "[ . 1]" 2 368 1 117 VAL HB 1 138 GLN QE 5.520 . 5.520 5.390 4.753 5.742 0.222 9 0 "[ . 1]" 2 369 1 117 VAL QG 1 118 LEU H 4.290 . 4.290 2.530 2.194 3.443 . 0 0 "[ . 1]" 2 370 1 117 VAL QG 1 118 LEU HG 4.660 . 4.660 3.607 2.340 4.827 0.167 1 0 "[ . 1]" 2 371 1 117 VAL QG 1 118 LEU QD 2.980 . 2.980 2.361 1.912 3.104 0.124 9 0 "[ . 1]" 2 372 1 117 VAL QG 1 138 GLN QG 5.050 . 5.050 3.963 2.240 4.901 . 0 0 "[ . 1]" 2 373 1 117 VAL QG 1 138 GLN QE 5.090 . 5.090 3.175 2.360 4.389 . 0 0 "[ . 1]" 2 374 1 117 VAL QG 1 139 ILE MG 4.000 . 4.000 3.900 3.162 4.436 0.436 2 0 "[ . 1]" 2 375 1 117 VAL QG 1 139 ILE QG 3.620 . 3.620 2.875 2.043 3.574 . 0 0 "[ . 1]" 2 376 1 118 LEU HA 1 118 LEU QD 3.520 . 3.520 2.237 2.105 2.425 . 0 0 "[ . 1]" 2 377 1 118 LEU QD 1 121 SER H 5.920 . 5.920 5.095 4.834 5.327 . 0 0 "[ . 1]" 2 378 1 119 GLU H 1 119 GLU QB 3.510 . 3.510 2.343 2.131 2.674 . 0 0 "[ . 1]" 2 379 1 119 GLU QB 1 119 GLU QG 2.440 . 2.440 2.090 2.016 2.117 . 0 0 "[ . 1]" 2 380 1 119 GLU QB 1 122 LYS QG 5.030 . 5.030 5.032 4.603 5.282 0.252 6 0 "[ . 1]" 2 381 1 119 GLU QB 1 122 LYS QE 4.680 . 4.680 3.723 2.403 4.807 0.127 9 0 "[ . 1]" 2 382 1 121 SER QB 1 122 LYS HA 4.560 . 4.560 4.245 3.881 4.574 0.014 3 0 "[ . 1]" 2 383 1 121 SER QB 1 126 ILE HB 4.030 . 4.030 3.248 2.825 3.956 . 0 0 "[ . 1]" 2 384 1 121 SER QB 1 126 ILE MD 4.010 . 4.010 3.727 3.229 4.133 0.123 3 0 "[ . 1]" 2 385 1 123 ASN HA 1 123 ASN QD 3.630 . 3.630 2.966 1.795 3.904 0.274 8 0 "[ . 1]" 2 386 1 123 ASN QB 1 123 ASN QD 3.030 . 3.030 2.431 2.179 2.760 . 0 0 "[ . 1]" 2 387 1 124 ASN HA 1 125 PRO QD 3.190 . 3.190 2.066 2.009 2.140 . 0 0 "[ . 1]" 2 388 1 124 ASN QB 1 125 PRO QD 3.860 . 3.860 2.999 2.334 3.778 . 0 0 "[ . 1]" 2 389 1 124 ASN QD 1 125 PRO QG 4.130 . 4.130 3.922 3.218 4.237 0.107 5 0 "[ . 1]" 2 390 1 125 PRO QB 1 126 ILE H 4.090 . 4.090 3.536 2.853 3.832 . 0 0 "[ . 1]" 2 391 1 125 PRO QB 1 127 ASN QD 5.520 . 5.520 3.573 2.456 4.941 . 0 0 "[ . 1]" 2 392 1 126 ILE MG 1 132 LEU QD 3.440 . 3.440 2.028 1.783 2.449 0.017 2 0 "[ . 1]" 2 393 1 126 ILE MD 1 132 LEU QD 5.560 . 5.560 3.177 1.955 4.065 . 0 0 "[ . 1]" 2 394 1 127 ASN H 1 132 LEU QD 5.920 . 5.920 4.436 3.367 5.765 . 0 0 "[ . 1]" 2 395 1 128 THR H 1 132 LEU QD 5.780 . 5.780 3.494 2.528 4.446 . 0 0 "[ . 1]" 2 396 1 129 ALA H 1 130 GLU QB 5.720 . 5.720 4.625 4.014 5.560 . 0 0 "[ . 1]" 2 397 1 129 ALA H 1 132 LEU QB 4.800 . 4.800 3.759 2.327 4.680 . 0 0 "[ . 1]" 2 398 1 129 ALA H 1 132 LEU QD 5.700 . 5.700 4.442 3.422 5.232 . 0 0 "[ . 1]" 2 399 1 129 ALA HA 1 132 LEU QD 5.340 . 5.340 3.400 2.547 4.096 . 0 0 "[ . 1]" 2 400 1 129 ALA MB 1 130 GLU QB 3.990 . 3.990 3.730 3.271 4.064 0.074 5 0 "[ . 1]" 2 401 1 130 GLU HA 1 133 LEU QD 3.820 . 3.820 3.215 2.235 4.104 0.284 7 0 "[ . 1]" 2 402 1 130 GLU QB 1 131 ARG H 4.320 . 4.320 2.386 1.810 3.327 . 0 0 "[ . 1]" 2 403 1 130 GLU QB 1 133 LEU H 5.580 . 5.580 5.193 5.037 5.435 . 0 0 "[ . 1]" 2 404 1 132 LEU QD 1 133 LEU H 5.480 . 5.480 3.458 3.130 3.950 . 0 0 "[ . 1]" 2 405 1 132 LEU QD 1 135 ALA MB 4.140 . 4.140 2.527 2.033 3.422 . 0 0 "[ . 1]" 2 406 1 133 LEU H 1 133 LEU QD 3.920 . 3.920 2.832 1.784 3.555 0.016 4 0 "[ . 1]" 2 407 1 133 LEU HA 1 133 LEU QD 3.820 . 3.820 2.263 2.145 2.402 . 0 0 "[ . 1]" 2 408 1 133 LEU QB 1 134 ALA H 4.260 . 4.260 2.843 2.588 3.093 . 0 0 "[ . 1]" 2 409 1 133 LEU QB 1 134 ALA HA 4.210 . 4.210 3.962 3.893 4.015 . 0 0 "[ . 1]" 2 410 1 133 LEU QB 1 134 ALA MB 5.250 . 5.250 3.973 3.800 4.114 . 0 0 "[ . 1]" 2 411 1 133 LEU QD 1 134 ALA H 4.360 . 4.360 4.077 3.810 4.254 . 0 0 "[ . 1]" 2 412 1 133 LEU QD 1 136 LYS H 5.620 . 5.620 4.840 4.584 5.112 . 0 0 "[ . 1]" 2 413 1 133 LEU QD 1 137 ALA H 5.920 . 5.920 5.036 4.534 5.729 . 0 0 "[ . 1]" 2 414 1 135 ALA HA 1 138 GLN QG 4.050 . 4.050 3.614 3.052 4.157 0.107 3 0 "[ . 1]" 2 415 1 136 LYS QG 1 140 GLU QG 4.730 . 4.730 3.643 2.234 4.709 . 0 0 "[ . 1]" 2 416 1 137 ALA MB 1 140 GLU QG 4.900 . 4.900 4.679 3.750 5.229 0.329 9 0 "[ . 1]" 2 417 1 137 ALA MB 1 141 ASN QD 4.930 . 4.930 3.361 2.356 4.131 . 0 0 "[ . 1]" 2 418 1 138 GLN HA 1 138 GLN QG 3.480 . 3.480 2.679 2.308 3.504 0.024 7 0 "[ . 1]" 2 419 1 138 GLN HA 1 141 ASN QB 3.870 . 3.870 2.968 2.414 3.386 . 0 0 "[ . 1]" 2 420 1 138 GLN HA 1 141 ASN QD 4.210 . 4.210 2.795 2.010 4.164 . 0 0 "[ . 1]" 2 421 1 138 GLN QG 1 141 ASN H 5.410 . 5.410 5.410 5.011 5.613 0.203 10 0 "[ . 1]" 2 422 1 139 ILE HA 1 142 GLN QG 4.440 . 4.440 3.864 2.426 4.661 0.221 3 0 "[ . 1]" 2 423 1 140 GLU HA 1 140 GLU QG 3.660 . 3.660 2.545 2.317 3.311 . 0 0 "[ . 1]" 2 424 1 141 ASN QB 1 142 GLN H 4.060 . 4.060 2.652 2.041 3.046 . 0 0 "[ . 1]" 2 425 1 141 ASN QB 1 142 GLN HA 5.400 . 5.400 3.902 3.745 4.047 . 0 0 "[ . 1]" 2 426 1 142 GLN H 1 142 GLN QG 4.290 . 4.290 3.325 1.824 4.069 . 0 0 "[ . 1]" 2 427 1 142 GLN H 1 145 VAL QG 5.440 . 5.440 4.313 4.039 4.720 . 0 0 "[ . 1]" 2 428 1 142 GLN HA 1 142 GLN QG 3.380 . 3.380 2.685 2.285 3.051 . 0 0 "[ . 1]" 2 429 1 142 GLN HA 1 142 GLN QE 4.430 . 4.430 3.059 1.842 4.601 0.171 7 0 "[ . 1]" 2 430 1 142 GLN HA 1 145 VAL QG 3.970 . 3.970 2.770 2.183 3.206 . 0 0 "[ . 1]" 2 431 1 142 GLN QG 1 143 LEU H 5.290 . 5.290 3.902 3.319 4.207 . 0 0 "[ . 1]" 2 432 1 142 GLN QG 1 145 VAL QG 4.550 . 4.550 4.093 3.440 4.702 0.152 10 0 "[ . 1]" 2 433 1 142 GLN QE 1 145 VAL HB 5.300 . 5.300 3.681 2.286 5.304 0.004 7 0 "[ . 1]" 2 434 1 142 GLN QE 1 145 VAL QG 4.730 . 4.730 3.438 2.017 4.853 0.123 7 0 "[ . 1]" 2 435 1 142 GLN QE 1 146 VAL H 5.640 . 5.640 4.442 2.843 5.725 0.085 10 0 "[ . 1]" 2 436 1 142 GLN QE 1 146 VAL QG 4.820 . 4.820 2.966 1.780 4.894 0.074 10 0 "[ . 1]" 2 437 1 143 LEU H 1 143 LEU QD 4.360 . 4.360 2.993 1.767 3.757 0.033 2 0 "[ . 1]" 2 438 1 143 LEU HA 1 143 LEU QD 3.730 . 3.730 2.494 2.001 3.250 . 0 0 "[ . 1]" 2 439 1 144 LYS QE 1 145 VAL QG 5.730 . 5.730 5.208 4.186 6.016 0.286 8 0 "[ . 1]" 2 440 1 145 VAL H 1 145 VAL QG 3.300 . 3.300 2.300 1.815 2.639 . 0 0 "[ . 1]" 2 441 1 145 VAL HA 1 145 VAL QG 3.150 . 3.150 2.109 2.080 2.140 . 0 0 "[ . 1]" 2 442 1 145 VAL QG 1 146 VAL H 3.940 . 3.940 3.090 2.727 3.429 . 0 0 "[ . 1]" 2 443 1 145 VAL QG 1 147 LYS H 5.030 . 5.030 4.516 4.178 4.762 . 0 0 "[ . 1]" 2 444 1 145 VAL QG 1 149 LYS H 5.920 . 5.920 4.351 3.571 5.076 . 0 0 "[ . 1]" 2 445 1 145 VAL QG 1 149 LYS QD 4.030 . 4.030 2.901 2.082 3.971 . 0 0 "[ . 1]" 2 446 1 146 VAL H 1 146 VAL QG 3.530 . 3.530 1.955 1.750 2.188 0.050 9 0 "[ . 1]" 2 447 1 146 VAL QG 1 147 LYS H 4.510 . 4.510 2.771 2.016 3.288 . 0 0 "[ . 1]" 2 448 1 146 VAL QG 1 149 LYS H 5.860 . 5.860 4.268 3.984 4.466 . 0 0 "[ . 1]" 2 449 1 150 GLN H 1 150 GLN QG 4.380 . 4.380 2.738 1.971 4.071 . 0 0 "[ . 1]" 2 450 1 151 ASN H 1 151 ASN QB 3.570 . 3.570 2.495 2.245 3.350 . 0 0 "[ . 1]" 2 451 1 151 ASN H 1 151 ASN QD 5.090 . 5.090 4.137 3.055 4.652 . 0 0 "[ . 1]" 2 452 1 151 ASN QB 1 152 ILE MD 5.810 . 5.810 5.088 3.774 5.976 0.166 10 0 "[ . 1]" 2 453 1 152 ILE HA 1 152 ILE QG 3.730 . 3.730 2.453 2.281 3.030 . 0 0 "[ . 1]" 2 454 1 152 ILE QG 1 153 GLU QG 5.290 . 5.290 4.726 2.278 5.421 0.131 5 0 "[ . 1]" 2 stop_ save_
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