NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
450485 | 2rlq | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2rlq 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 2687 _Distance_constraint_stats_list.Viol_count 6347 _Distance_constraint_stats_list.Viol_total 8433.246 _Distance_constraint_stats_list.Viol_max 1.266 _Distance_constraint_stats_list.Viol_rms 0.0253 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0037 _Distance_constraint_stats_list.Viol_average_violations_only 0.0458 _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 7 PRO 1.099 0.048 4 0 "[ . 1 . 2 . ]" 1 8 CYS 5.783 0.162 4 0 "[ . 1 . 2 . ]" 1 9 GLY 8.880 0.182 2 0 "[ . 1 . 2 . ]" 1 10 HIS 12.873 0.233 5 0 "[ . 1 . 2 . ]" 1 11 PRO 1.132 0.069 20 0 "[ . 1 . 2 . ]" 1 12 GLY 1.325 0.087 26 0 "[ . 1 . 2 . ]" 1 13 ASP 0.939 0.070 11 0 "[ . 1 . 2 . ]" 1 14 THR 0.512 0.089 29 0 "[ . 1 . 2 . ]" 1 15 PRO 1.394 0.057 28 0 "[ . 1 . 2 . ]" 1 16 PHE 5.564 0.129 15 0 "[ . 1 . 2 . ]" 1 17 GLY 0.018 0.015 1 0 "[ . 1 . 2 . ]" 1 18 THR 4.800 0.129 15 0 "[ . 1 . 2 . ]" 1 19 PHE 5.655 0.164 15 0 "[ . 1 . 2 . ]" 1 20 THR 4.769 0.099 22 0 "[ . 1 . 2 . ]" 1 21 LEU 8.170 0.102 15 0 "[ . 1 . 2 . ]" 1 22 THR 6.635 0.186 25 0 "[ . 1 . 2 . ]" 1 23 GLY 0.395 0.043 24 0 "[ . 1 . 2 . ]" 1 24 GLY 1.407 0.129 11 0 "[ . 1 . 2 . ]" 1 25 ASN 3.430 0.186 6 0 "[ . 1 . 2 . ]" 1 26 VAL 6.897 0.186 25 0 "[ . 1 . 2 . ]" 1 27 PHE 12.789 0.233 5 0 "[ . 1 . 2 . ]" 1 28 GLU 10.891 0.120 5 0 "[ . 1 . 2 . ]" 1 29 TYR 5.707 0.096 22 0 "[ . 1 . 2 . ]" 1 30 GLY 1.254 0.058 24 0 "[ . 1 . 2 . ]" 1 31 VAL 7.044 0.113 16 0 "[ . 1 . 2 . ]" 1 32 LYS 4.488 0.228 5 0 "[ . 1 . 2 . ]" 1 33 ALA 4.857 0.197 6 0 "[ . 1 . 2 . ]" 1 34 VAL 12.285 0.338 1 0 "[ . 1 . 2 . ]" 1 35 TYR 6.636 0.164 15 0 "[ . 1 . 2 . ]" 1 36 THR 0.459 0.042 26 0 "[ . 1 . 2 . ]" 1 37 CYS 2.220 0.110 6 0 "[ . 1 . 2 . ]" 1 38 ASN 4.736 0.132 11 0 "[ . 1 . 2 . ]" 1 39 GLU 2.644 0.136 1 0 "[ . 1 . 2 . ]" 1 40 GLY 1.188 0.136 1 0 "[ . 1 . 2 . ]" 1 41 TYR 11.426 1.070 12 2 "[ . -1 + . 2 . ]" 1 42 GLN 4.935 0.115 16 0 "[ . 1 . 2 . ]" 1 43 LEU 6.796 0.192 3 0 "[ . 1 . 2 . ]" 1 44 LEU 5.438 0.120 12 0 "[ . 1 . 2 . ]" 1 45 GLY 1.787 0.112 12 0 "[ . 1 . 2 . ]" 1 46 GLU 2.538 0.128 15 0 "[ . 1 . 2 . ]" 1 47 ILE 2.783 0.075 4 0 "[ . 1 . 2 . ]" 1 48 ASN 4.549 0.126 8 0 "[ . 1 . 2 . ]" 1 49 TYR 9.535 0.338 1 0 "[ . 1 . 2 . ]" 1 50 ARG 8.345 0.197 6 0 "[ . 1 . 2 . ]" 1 51 GLU 3.040 0.118 14 0 "[ . 1 . 2 . ]" 1 52 CYS 4.133 0.105 6 0 "[ . 1 . 2 . ]" 1 53 ASP 5.065 0.146 25 0 "[ . 1 . 2 . ]" 1 54 THR 5.389 0.146 25 0 "[ . 1 . 2 . ]" 1 55 ASP 0.105 0.032 14 0 "[ . 1 . 2 . ]" 1 56 GLY 0.165 0.033 8 0 "[ . 1 . 2 . ]" 1 57 TRP 6.257 0.138 24 0 "[ . 1 . 2 . ]" 1 58 THR 1.665 0.088 1 0 "[ . 1 . 2 . ]" 1 59 ASN 3.918 0.135 29 0 "[ . 1 . 2 . ]" 1 60 ASP 4.634 0.206 13 0 "[ . 1 . 2 . ]" 1 61 ILE 5.072 0.206 13 0 "[ . 1 . 2 . ]" 1 62 PRO 2.317 0.081 17 0 "[ . 1 . 2 . ]" 1 63 ILE 2.535 0.104 3 0 "[ . 1 . 2 . ]" 1 64 CYS 4.362 0.192 3 0 "[ . 1 . 2 . ]" 1 65 GLU 3.055 0.120 12 0 "[ . 1 . 2 . ]" 1 66 VAL 10.738 1.070 12 2 "[ . -1 + . 2 . ]" 1 67 VAL 7.895 0.187 22 0 "[ . 1 . 2 . ]" 1 68 LYS 2.421 0.209 27 0 "[ . 1 . 2 . ]" 1 69 CYS 0.382 0.078 17 0 "[ . 1 . 2 . ]" 1 70 LEU 8.700 0.318 17 0 "[ . 1 . 2 . ]" 1 71 PRO 5.162 0.121 1 0 "[ . 1 . 2 . ]" 1 72 VAL 6.799 0.146 6 0 "[ . 1 . 2 . ]" 1 73 THR 0.551 0.205 22 0 "[ . 1 . 2 . ]" 1 74 ALA 3.587 0.205 28 0 "[ . 1 . 2 . ]" 1 75 PRO 4.023 0.131 16 0 "[ . 1 . 2 . ]" 1 76 GLU 3.223 0.114 19 0 "[ . 1 . 2 . ]" 1 77 ASN 1.070 0.104 25 0 "[ . 1 . 2 . ]" 1 78 GLY 2.180 0.114 19 0 "[ . 1 . 2 . ]" 1 79 LYS 3.551 0.132 22 0 "[ . 1 . 2 . ]" 1 80 ILE 4.489 0.157 27 0 "[ . 1 . 2 . ]" 1 81 VAL 28.577 1.266 19 20 "[ **** * *** *.- *+*** ***** ]" 1 82 SER 1.608 0.157 27 0 "[ . 1 . 2 . ]" 1 83 SER 0.591 0.078 20 0 "[ . 1 . 2 . ]" 1 84 ALA 1.507 0.146 17 0 "[ . 1 . 2 . ]" 1 85 MET 3.319 0.158 28 0 "[ . 1 . 2 . ]" 1 86 GLU 4.377 0.223 9 0 "[ . 1 . 2 . ]" 1 87 PRO 1.107 0.114 15 0 "[ . 1 . 2 . ]" 1 88 ASP 4.583 0.156 10 0 "[ . 1 . 2 . ]" 1 89 ARG 10.473 0.281 12 0 "[ . 1 . 2 . ]" 1 90 GLU 3.156 0.281 12 0 "[ . 1 . 2 . ]" 1 91 TYR 3.085 0.144 24 0 "[ . 1 . 2 . ]" 1 92 HIS 1.181 0.109 19 0 "[ . 1 . 2 . ]" 1 93 PHE 3.307 0.150 20 0 "[ . 1 . 2 . ]" 1 94 GLY 0.051 0.038 11 0 "[ . 1 . 2 . ]" 1 95 GLN 5.131 0.190 20 0 "[ . 1 . 2 . ]" 1 96 ALA 0.940 0.117 24 0 "[ . 1 . 2 . ]" 1 97 VAL 1.632 0.386 23 0 "[ . 1 . 2 . ]" 1 98 ARG 27.611 1.266 19 20 "[ **** * *** *.- *+*** ***** ]" 1 99 PHE 3.977 0.154 17 0 "[ . 1 . 2 . ]" 1 100 VAL 7.517 0.208 27 0 "[ . 1 . 2 . ]" 1 101 CYS 4.399 0.118 18 0 "[ . 1 . 2 . ]" 1 102 ASN 6.260 0.225 26 0 "[ . 1 . 2 . ]" 1 103 SER 4.230 0.227 6 0 "[ . 1 . 2 . ]" 1 104 GLY 1.242 0.124 13 0 "[ . 1 . 2 . ]" 1 105 TYR 7.431 0.227 6 0 "[ . 1 . 2 . ]" 1 106 LYS 6.627 0.162 25 0 "[ . 1 . 2 . ]" 1 107 ILE 12.340 0.173 22 0 "[ . 1 . 2 . ]" 1 108 GLU 4.981 0.127 28 0 "[ . 1 . 2 . ]" 1 109 GLY 1.249 0.072 18 0 "[ . 1 . 2 . ]" 1 110 ASP 1.177 0.122 28 0 "[ . 1 . 2 . ]" 1 111 GLU 3.826 0.121 8 0 "[ . 1 . 2 . ]" 1 112 GLU 3.207 0.121 8 0 "[ . 1 . 2 . ]" 1 113 MET 6.037 0.391 7 0 "[ . 1 . 2 . ]" 1 114 HIS 1.506 0.099 7 0 "[ . 1 . 2 . ]" 1 115 CYS 0.704 0.091 12 0 "[ . 1 . 2 . ]" 1 116 SER 0.128 0.071 12 0 "[ . 1 . 2 . ]" 1 117 ASP 0.133 0.041 25 0 "[ . 1 . 2 . ]" 1 118 ASP 0.178 0.071 14 0 "[ . 1 . 2 . ]" 1 119 GLY 1.083 0.117 7 0 "[ . 1 . 2 . ]" 1 120 PHE 0.215 0.071 14 0 "[ . 1 . 2 . ]" 1 121 TRP 4.269 0.142 28 0 "[ . 1 . 2 . ]" 1 122 SER 0.476 0.071 12 0 "[ . 1 . 2 . ]" 1 123 LYS 5.027 0.612 29 1 "[ . 1 . 2 . +]" 1 124 GLU 4.361 0.612 29 1 "[ . 1 . 2 . +]" 1 125 LYS 7.593 0.372 20 0 "[ . 1 . 2 . ]" 1 126 PRO 1.238 0.107 8 0 "[ . 1 . 2 . ]" 1 127 LYS 4.885 0.131 16 0 "[ . 1 . 2 . ]" 1 128 CYS 2.379 0.145 3 0 "[ . 1 . 2 . ]" 1 129 VAL 2.383 0.091 3 0 "[ . 1 . 2 . ]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 7 PRO HA 1 8 CYS H 2.675 . 3.550 3.470 3.373 3.544 . 0 0 "[ . 1 . 2 . ]" 1 2 1 7 PRO HA 1 9 GLY H 3.490 . 5.180 4.423 4.077 4.704 . 0 0 "[ . 1 . 2 . ]" 1 3 1 7 PRO HB2 1 8 CYS H 2.610 . 3.420 3.332 3.158 3.442 0.022 20 0 "[ . 1 . 2 . ]" 1 4 1 7 PRO HB2 1 8 CYS HA 3.050 . 4.300 4.218 4.043 4.308 0.008 20 0 "[ . 1 . 2 . ]" 1 5 1 7 PRO HB2 1 8 CYS HB2 3.650 . 5.500 5.349 4.801 5.511 0.011 3 0 "[ . 1 . 2 . ]" 1 6 1 7 PRO HB2 1 29 TYR QE 3.170 . 4.540 2.204 1.925 2.892 . 0 0 "[ . 1 . 2 . ]" 1 7 1 7 PRO HB3 1 8 CYS H 3.095 . 4.390 4.166 4.100 4.213 . 0 0 "[ . 1 . 2 . ]" 1 8 1 7 PRO HB3 1 29 TYR QE 3.260 . 4.720 3.135 2.818 3.464 . 0 0 "[ . 1 . 2 . ]" 1 9 1 7 PRO HD2 1 8 CYS H 2.695 . 3.590 2.832 2.626 3.065 . 0 0 "[ . 1 . 2 . ]" 1 10 1 7 PRO HD2 1 9 GLY H 3.245 . 4.690 4.205 3.986 4.694 0.004 2 0 "[ . 1 . 2 . ]" 1 11 1 7 PRO HD2 1 27 PHE H 3.650 . 5.500 4.357 4.109 4.557 . 0 0 "[ . 1 . 2 . ]" 1 12 1 7 PRO HD2 1 27 PHE QD 3.650 . 5.500 5.391 5.125 5.525 0.025 23 0 "[ . 1 . 2 . ]" 1 13 1 7 PRO HD2 1 28 GLU H 3.175 . 4.550 3.950 3.770 4.054 . 0 0 "[ . 1 . 2 . ]" 1 14 1 7 PRO HD2 1 28 GLU HA 2.730 . 3.660 2.051 1.884 2.328 . 0 0 "[ . 1 . 2 . ]" 1 15 1 7 PRO HD2 1 29 TYR H 3.650 . 5.500 4.370 4.091 4.779 . 0 0 "[ . 1 . 2 . ]" 1 16 1 7 PRO HD3 1 28 GLU H 3.650 . 5.500 5.491 5.258 5.548 0.048 4 0 "[ . 1 . 2 . ]" 1 17 1 7 PRO HD3 1 28 GLU HA 2.945 . 4.090 3.280 3.058 3.487 . 0 0 "[ . 1 . 2 . ]" 1 18 1 7 PRO HD3 1 28 GLU HB2 3.440 . 5.080 4.765 4.407 5.092 0.012 26 0 "[ . 1 . 2 . ]" 1 19 1 7 PRO HD3 1 29 TYR H 3.650 . 5.500 5.036 4.622 5.499 . 0 0 "[ . 1 . 2 . ]" 1 20 1 7 PRO HG2 1 8 CYS H 2.625 . 3.450 2.485 2.402 2.620 . 0 0 "[ . 1 . 2 . ]" 1 21 1 7 PRO HG2 1 8 CYS HA 3.370 . 4.940 4.530 4.370 4.721 . 0 0 "[ . 1 . 2 . ]" 1 22 1 7 PRO HG2 1 9 GLY H 3.530 . 5.260 4.697 4.582 5.122 . 0 0 "[ . 1 . 2 . ]" 1 23 1 7 PRO HG2 1 28 GLU HA 2.605 . 3.410 2.139 1.935 2.405 . 0 0 "[ . 1 . 2 . ]" 1 24 1 7 PRO HG2 1 29 TYR H 2.965 . 4.130 3.098 2.861 3.421 . 0 0 "[ . 1 . 2 . ]" 1 25 1 7 PRO HG2 1 29 TYR QE 3.170 . 4.540 3.819 3.493 4.352 . 0 0 "[ . 1 . 2 . ]" 1 26 1 7 PRO HG3 1 8 CYS H 2.890 . 3.980 3.988 3.917 4.021 0.041 16 0 "[ . 1 . 2 . ]" 1 27 1 7 PRO HG3 1 28 GLU HA 3.220 . 4.640 2.671 2.389 2.884 . 0 0 "[ . 1 . 2 . ]" 1 28 1 7 PRO HG3 1 29 TYR H 3.045 . 4.290 3.206 2.796 3.687 . 0 0 "[ . 1 . 2 . ]" 1 29 1 8 CYS H 1 8 CYS HA 2.340 . 2.880 2.903 2.854 2.932 0.052 16 0 "[ . 1 . 2 . ]" 1 30 1 8 CYS H 1 8 CYS HB2 2.510 . 3.220 2.429 2.282 2.544 . 0 0 "[ . 1 . 2 . ]" 1 31 1 8 CYS H 1 8 CYS HB3 2.725 . 3.650 3.559 3.446 3.609 . 0 0 "[ . 1 . 2 . ]" 1 32 1 8 CYS H 1 9 GLY H 2.290 . 2.780 2.281 2.128 2.710 . 0 0 "[ . 1 . 2 . ]" 1 33 1 8 CYS H 1 27 PHE HB2 3.005 . 4.210 3.840 3.650 4.198 . 0 0 "[ . 1 . 2 . ]" 1 34 1 8 CYS H 1 27 PHE HB3 2.955 . 4.110 3.959 3.791 4.133 0.023 13 0 "[ . 1 . 2 . ]" 1 35 1 8 CYS H 1 28 GLU HA 3.075 . 4.350 3.605 3.267 4.027 . 0 0 "[ . 1 . 2 . ]" 1 36 1 8 CYS H 1 29 TYR QE 3.590 . 5.380 5.046 4.596 5.391 0.011 28 0 "[ . 1 . 2 . ]" 1 37 1 8 CYS H 1 31 VAL MG1 3.650 . 5.500 5.180 5.048 5.368 . 0 0 "[ . 1 . 2 . ]" 1 38 1 8 CYS H 1 57 TRP HE1 3.510 . 5.220 4.939 4.627 5.126 . 0 0 "[ . 1 . 2 . ]" 1 39 1 8 CYS HA 1 56 GLY QA 2.910 . 4.020 3.345 2.989 3.817 . 0 0 "[ . 1 . 2 . ]" 1 40 1 8 CYS HA 1 57 TRP H 3.100 . 4.400 4.448 4.294 4.538 0.138 24 0 "[ . 1 . 2 . ]" 1 41 1 8 CYS HA 1 57 TRP HD1 3.540 . 5.280 4.682 4.453 4.989 . 0 0 "[ . 1 . 2 . ]" 1 42 1 8 CYS HA 1 57 TRP HE1 3.505 . 5.210 4.453 4.178 4.733 . 0 0 "[ . 1 . 2 . ]" 1 43 1 8 CYS HB2 1 9 GLY H 2.800 . 3.800 2.652 2.429 3.447 . 0 0 "[ . 1 . 2 . ]" 1 44 1 8 CYS HB2 1 57 TRP HD1 3.205 . 4.610 4.609 4.478 4.668 0.058 7 0 "[ . 1 . 2 . ]" 1 45 1 8 CYS HB2 1 57 TRP HE1 2.635 . 3.470 2.978 2.765 3.450 . 0 0 "[ . 1 . 2 . ]" 1 46 1 8 CYS HB2 1 57 TRP HH2 3.650 . 5.500 4.776 4.569 5.087 . 0 0 "[ . 1 . 2 . ]" 1 47 1 8 CYS HB2 1 57 TRP HZ2 3.365 . 4.930 3.116 2.815 3.659 . 0 0 "[ . 1 . 2 . ]" 1 48 1 8 CYS HB3 1 9 GLY H 2.710 . 3.620 3.707 3.653 3.782 0.162 4 0 "[ . 1 . 2 . ]" 1 49 1 8 CYS HB3 1 9 GLY HA3 3.525 . 5.250 4.825 4.508 5.016 . 0 0 "[ . 1 . 2 . ]" 1 50 1 8 CYS HB3 1 52 CYS HA 3.650 . 5.500 4.404 3.999 4.602 . 0 0 "[ . 1 . 2 . ]" 1 51 1 8 CYS HB3 1 57 TRP H 2.970 . 4.140 3.575 3.198 3.852 . 0 0 "[ . 1 . 2 . ]" 1 52 1 8 CYS HB3 1 57 TRP HD1 3.195 . 4.590 3.395 2.887 3.665 . 0 0 "[ . 1 . 2 . ]" 1 53 1 8 CYS HB3 1 57 TRP HE1 2.715 . 3.630 2.769 2.168 3.098 . 0 0 "[ . 1 . 2 . ]" 1 54 1 8 CYS HB3 1 57 TRP HH2 3.650 . 5.500 5.256 4.983 5.508 0.008 11 0 "[ . 1 . 2 . ]" 1 55 1 8 CYS HB3 1 57 TRP HZ2 3.180 . 4.560 3.814 3.509 4.056 . 0 0 "[ . 1 . 2 . ]" 1 56 1 9 GLY H 1 9 GLY HA2 2.235 . 2.670 2.413 2.311 2.464 . 0 0 "[ . 1 . 2 . ]" 1 57 1 9 GLY H 1 10 HIS H 2.750 . 3.700 3.461 2.314 3.671 . 0 0 "[ . 1 . 2 . ]" 1 58 1 9 GLY H 1 10 HIS HA 3.175 . 4.550 4.577 4.471 4.633 0.083 7 0 "[ . 1 . 2 . ]" 1 59 1 9 GLY H 1 10 HIS HB2 3.370 . 4.940 5.054 4.895 5.122 0.182 2 0 "[ . 1 . 2 . ]" 1 60 1 9 GLY H 1 27 PHE HB2 3.205 . 4.610 2.978 2.654 4.208 . 0 0 "[ . 1 . 2 . ]" 1 61 1 9 GLY H 1 27 PHE HB3 2.930 . 4.060 3.054 2.600 3.628 . 0 0 "[ . 1 . 2 . ]" 1 62 1 9 GLY H 1 57 TRP HD1 3.635 . 5.470 5.452 5.120 5.526 0.056 24 0 "[ . 1 . 2 . ]" 1 63 1 9 GLY H 1 57 TRP HE1 2.860 . 3.920 3.679 3.491 3.931 0.011 4 0 "[ . 1 . 2 . ]" 1 64 1 9 GLY HA2 1 10 HIS H 2.505 . 3.210 3.218 2.001 3.298 0.088 17 0 "[ . 1 . 2 . ]" 1 65 1 9 GLY HA2 1 10 HIS HB2 3.390 . 4.980 3.987 3.758 4.322 . 0 0 "[ . 1 . 2 . ]" 1 66 1 9 GLY HA2 1 10 HIS HB3 3.510 . 5.220 4.901 4.498 5.146 . 0 0 "[ . 1 . 2 . ]" 1 67 1 9 GLY HA3 1 10 HIS HB2 3.545 . 5.290 4.071 3.583 5.224 . 0 0 "[ . 1 . 2 . ]" 1 68 1 9 GLY HA3 1 10 HIS HB3 3.635 . 5.470 4.382 4.132 5.206 . 0 0 "[ . 1 . 2 . ]" 1 69 1 9 GLY HA3 1 57 TRP HE1 3.235 . 4.670 3.759 3.557 4.380 . 0 0 "[ . 1 . 2 . ]" 1 70 1 10 HIS H 1 10 HIS HB2 2.520 . 3.240 3.175 2.094 3.304 0.064 1 0 "[ . 1 . 2 . ]" 1 71 1 10 HIS H 1 10 HIS HD2 3.650 . 5.500 5.361 5.089 5.545 0.045 12 0 "[ . 1 . 2 . ]" 1 72 1 10 HIS H 1 11 PRO HD2 3.440 . 5.080 4.731 4.281 4.967 . 0 0 "[ . 1 . 2 . ]" 1 73 1 10 HIS H 1 11 PRO QD 3.135 . 4.470 3.913 3.446 4.190 . 0 0 "[ . 1 . 2 . ]" 1 74 1 10 HIS H 1 11 PRO HD3 3.440 . 5.080 4.177 3.633 4.722 . 0 0 "[ . 1 . 2 . ]" 1 75 1 10 HIS H 1 27 PHE HB2 3.235 . 4.670 4.777 3.755 4.903 0.233 5 0 "[ . 1 . 2 . ]" 1 76 1 10 HIS H 1 27 PHE QD 3.530 . 5.260 4.840 3.800 5.071 . 0 0 "[ . 1 . 2 . ]" 1 77 1 10 HIS H 1 57 TRP HD1 3.650 . 5.500 3.697 3.212 5.636 0.136 2 0 "[ . 1 . 2 . ]" 1 78 1 10 HIS H 1 57 TRP HE1 3.345 . 4.890 2.384 2.158 4.122 . 0 0 "[ . 1 . 2 . ]" 1 79 1 10 HIS H 1 57 TRP HZ2 3.650 . 5.500 4.501 3.293 5.505 0.005 2 0 "[ . 1 . 2 . ]" 1 80 1 10 HIS HA 1 10 HIS HD2 3.080 . 4.360 3.587 3.184 4.039 . 0 0 "[ . 1 . 2 . ]" 1 81 1 10 HIS HA 1 11 PRO HD2 2.900 . 4.000 2.421 2.037 2.676 . 0 0 "[ . 1 . 2 . ]" 1 82 1 10 HIS HA 1 11 PRO QD 2.615 . 3.430 2.058 1.936 2.134 . 0 0 "[ . 1 . 2 . ]" 1 83 1 10 HIS HA 1 11 PRO HD3 2.900 . 4.000 2.260 2.055 2.503 . 0 0 "[ . 1 . 2 . ]" 1 84 1 10 HIS HA 1 11 PRO QG 3.110 . 4.420 3.978 3.825 4.078 . 0 0 "[ . 1 . 2 . ]" 1 85 1 10 HIS HA 1 12 GLY H 3.275 . 4.750 3.956 3.809 4.236 . 0 0 "[ . 1 . 2 . ]" 1 86 1 10 HIS HA 1 27 PHE QD 3.335 . 4.870 3.055 2.572 3.347 . 0 0 "[ . 1 . 2 . ]" 1 87 1 10 HIS HA 1 27 PHE QE 3.380 . 4.960 3.611 3.368 3.825 . 0 0 "[ . 1 . 2 . ]" 1 88 1 10 HIS HA 1 57 TRP HE1 3.195 . 4.590 3.209 2.971 3.423 . 0 0 "[ . 1 . 2 . ]" 1 89 1 10 HIS HA 1 57 TRP HZ2 3.550 . 5.300 3.511 3.004 3.847 . 0 0 "[ . 1 . 2 . ]" 1 90 1 10 HIS HB2 1 12 GLY H 3.610 . 5.420 4.833 4.479 5.440 0.020 1 0 "[ . 1 . 2 . ]" 1 91 1 10 HIS HB3 1 12 GLY H 3.365 . 4.930 3.666 3.013 4.743 . 0 0 "[ . 1 . 2 . ]" 1 92 1 10 HIS HB3 1 57 TRP HE1 3.650 . 5.500 5.001 4.778 5.507 0.007 2 0 "[ . 1 . 2 . ]" 1 93 1 10 HIS HD2 1 11 PRO QD 3.225 . 4.650 3.301 2.063 4.123 . 0 0 "[ . 1 . 2 . ]" 1 94 1 10 HIS HD2 1 12 GLY H 3.650 . 5.500 3.509 1.750 5.548 0.050 26 0 "[ . 1 . 2 . ]" 1 95 1 10 HIS HD2 1 27 PHE HZ 3.650 . 5.500 4.350 3.036 5.538 0.038 16 0 "[ . 1 . 2 . ]" 1 96 1 10 HIS HE1 1 19 PHE QE 3.650 . 5.500 3.753 2.159 5.121 . 0 0 "[ . 1 . 2 . ]" 1 97 1 10 HIS HE1 1 19 PHE HZ 3.650 . 5.500 3.541 2.948 4.512 . 0 0 "[ . 1 . 2 . ]" 1 98 1 10 HIS HE1 1 27 PHE HZ 3.000 . 4.200 3.674 2.875 4.343 0.143 7 0 "[ . 1 . 2 . ]" 1 99 1 11 PRO HA 1 33 ALA MB 3.305 . 4.810 4.567 4.268 4.873 0.063 4 0 "[ . 1 . 2 . ]" 1 100 1 11 PRO HA 1 57 TRP HD1 2.860 . 3.920 3.188 2.936 3.463 . 0 0 "[ . 1 . 2 . ]" 1 101 1 11 PRO HA 1 57 TRP HE1 2.685 . 3.570 3.552 3.303 3.639 0.069 20 0 "[ . 1 . 2 . ]" 1 102 1 11 PRO HB2 1 33 ALA MB 2.805 . 3.810 2.954 2.504 3.348 . 0 0 "[ . 1 . 2 . ]" 1 103 1 11 PRO HB2 1 57 TRP HE1 3.650 . 5.500 5.395 5.117 5.520 0.020 7 0 "[ . 1 . 2 . ]" 1 104 1 11 PRO HB3 1 19 PHE QE 3.650 . 5.500 5.339 4.982 5.524 0.024 5 0 "[ . 1 . 2 . ]" 1 105 1 11 PRO HB3 1 27 PHE QD 3.650 . 5.500 4.610 4.289 4.955 . 0 0 "[ . 1 . 2 . ]" 1 106 1 11 PRO HB3 1 33 ALA MB 2.775 . 3.750 2.728 2.446 3.028 . 0 0 "[ . 1 . 2 . ]" 1 107 1 11 PRO HB3 1 50 ARG HD3 3.495 . 5.190 2.621 2.270 3.018 . 0 0 "[ . 1 . 2 . ]" 1 108 1 11 PRO HB3 1 57 TRP HD1 3.650 . 5.500 4.309 4.005 4.656 . 0 0 "[ . 1 . 2 . ]" 1 109 1 11 PRO HB3 1 57 TRP HE1 3.055 . 4.310 3.950 3.701 4.153 . 0 0 "[ . 1 . 2 . ]" 1 110 1 11 PRO HB3 1 57 TRP HE3 3.650 . 5.500 3.741 3.416 4.222 . 0 0 "[ . 1 . 2 . ]" 1 111 1 11 PRO HB3 1 57 TRP HZ2 3.650 . 5.500 4.041 3.561 4.453 . 0 0 "[ . 1 . 2 . ]" 1 112 1 11 PRO QD 1 12 GLY H 2.975 . 4.150 2.676 2.119 3.056 . 0 0 "[ . 1 . 2 . ]" 1 113 1 11 PRO QD 1 19 PHE QE 3.210 . 4.620 3.296 3.032 3.522 . 0 0 "[ . 1 . 2 . ]" 1 114 1 11 PRO QD 1 19 PHE HZ 3.130 . 4.460 2.881 2.592 3.471 . 0 0 "[ . 1 . 2 . ]" 1 115 1 11 PRO QD 1 27 PHE QD 3.010 . 4.220 2.148 1.985 2.380 . 0 0 "[ . 1 . 2 . ]" 1 116 1 11 PRO QD 1 27 PHE QE 3.135 . 4.470 2.407 2.288 2.572 . 0 0 "[ . 1 . 2 . ]" 1 117 1 11 PRO QD 1 57 TRP HD1 3.575 . 5.350 4.877 4.229 5.253 . 0 0 "[ . 1 . 2 . ]" 1 118 1 11 PRO QD 1 57 TRP HE1 2.920 . 4.040 3.151 2.562 3.365 . 0 0 "[ . 1 . 2 . ]" 1 119 1 11 PRO QD 1 57 TRP HH2 3.575 . 5.350 3.862 3.501 4.218 . 0 0 "[ . 1 . 2 . ]" 1 120 1 11 PRO QD 1 57 TRP HZ2 3.060 . 4.320 2.487 2.117 2.746 . 0 0 "[ . 1 . 2 . ]" 1 121 1 11 PRO HD2 1 12 GLY H 3.320 . 4.840 2.731 2.136 3.149 . 0 0 "[ . 1 . 2 . ]" 1 122 1 11 PRO HD2 1 19 PHE QE 3.650 . 5.500 3.513 3.251 3.691 . 0 0 "[ . 1 . 2 . ]" 1 123 1 11 PRO HD2 1 27 PHE QD 3.395 . 4.990 3.276 2.497 3.824 . 0 0 "[ . 1 . 2 . ]" 1 124 1 11 PRO HD2 1 27 PHE QE 3.455 . 5.110 2.617 2.328 3.057 . 0 0 "[ . 1 . 2 . ]" 1 125 1 11 PRO HD2 1 57 TRP HE1 3.225 . 4.650 4.535 4.071 4.685 0.035 27 0 "[ . 1 . 2 . ]" 1 126 1 11 PRO HD2 1 57 TRP HZ2 3.410 . 5.020 4.189 3.655 4.526 . 0 0 "[ . 1 . 2 . ]" 1 127 1 11 PRO HD3 1 12 GLY H 3.320 . 4.840 3.868 3.511 4.124 . 0 0 "[ . 1 . 2 . ]" 1 128 1 11 PRO HD3 1 19 PHE QE 3.650 . 5.500 4.004 3.625 4.463 . 0 0 "[ . 1 . 2 . ]" 1 129 1 11 PRO HD3 1 27 PHE QD 3.395 . 4.990 2.185 2.009 2.441 . 0 0 "[ . 1 . 2 . ]" 1 130 1 11 PRO HD3 1 27 PHE QE 3.455 . 5.110 2.895 2.634 3.373 . 0 0 "[ . 1 . 2 . ]" 1 131 1 11 PRO HD3 1 57 TRP HE1 3.225 . 4.650 3.216 2.590 3.449 . 0 0 "[ . 1 . 2 . ]" 1 132 1 11 PRO HD3 1 57 TRP HZ2 3.410 . 5.020 2.506 2.129 2.770 . 0 0 "[ . 1 . 2 . ]" 1 133 1 11 PRO QG 1 12 GLY H 2.980 . 4.160 2.875 1.965 3.330 . 0 0 "[ . 1 . 2 . ]" 1 134 1 11 PRO QG 1 19 PHE QE 3.350 . 4.900 2.916 2.527 3.119 . 0 0 "[ . 1 . 2 . ]" 1 135 1 11 PRO QG 1 19 PHE HZ 3.380 . 4.960 3.317 3.021 3.799 . 0 0 "[ . 1 . 2 . ]" 1 136 1 11 PRO QG 1 27 PHE QD 3.640 . 5.480 3.317 2.819 3.561 . 0 0 "[ . 1 . 2 . ]" 1 137 1 11 PRO QG 1 27 PHE QE 3.565 . 5.330 3.060 2.674 3.314 . 0 0 "[ . 1 . 2 . ]" 1 138 1 11 PRO QG 1 33 ALA MB 2.525 . 3.250 1.977 1.841 2.207 . 0 0 "[ . 1 . 2 . ]" 1 139 1 11 PRO QG 1 57 TRP HE1 3.250 . 4.700 4.625 4.265 4.750 0.050 28 0 "[ . 1 . 2 . ]" 1 140 1 11 PRO QG 1 57 TRP HZ2 3.395 . 4.990 3.757 3.220 3.992 . 0 0 "[ . 1 . 2 . ]" 1 141 1 12 GLY H 1 13 ASP QB 3.390 . 4.980 4.719 4.299 5.013 0.033 26 0 "[ . 1 . 2 . ]" 1 142 1 12 GLY H 1 19 PHE QE 3.245 . 4.690 4.566 3.719 4.766 0.076 29 0 "[ . 1 . 2 . ]" 1 143 1 12 GLY H 1 19 PHE HZ 3.650 . 5.500 4.621 4.079 5.080 . 0 0 "[ . 1 . 2 . ]" 1 144 1 12 GLY H 1 27 PHE QE 3.650 . 5.500 5.105 4.444 5.517 0.017 21 0 "[ . 1 . 2 . ]" 1 145 1 12 GLY H 1 33 ALA MB 3.650 . 5.500 5.295 4.657 5.587 0.087 26 0 "[ . 1 . 2 . ]" 1 146 1 12 GLY H 1 61 ILE MD 3.450 . 5.100 4.535 4.237 4.751 . 0 0 "[ . 1 . 2 . ]" 1 147 1 12 GLY HA2 1 13 ASP H 2.405 . 3.010 2.641 2.266 2.856 . 0 0 "[ . 1 . 2 . ]" 1 148 1 12 GLY HA2 1 13 ASP HA 3.635 . 5.470 4.527 4.380 4.675 . 0 0 "[ . 1 . 2 . ]" 1 149 1 12 GLY HA2 1 61 ILE MD 2.860 . 3.920 3.409 2.891 3.919 . 0 0 "[ . 1 . 2 . ]" 1 150 1 12 GLY HA3 1 61 ILE MD 2.325 . 2.850 2.139 1.903 2.441 . 0 0 "[ . 1 . 2 . ]" 1 151 1 12 GLY HA3 1 61 ILE HG12 3.200 . 4.600 3.298 2.493 3.834 . 0 0 "[ . 1 . 2 . ]" 1 152 1 12 GLY HA3 1 61 ILE MG 3.345 . 4.890 4.233 3.405 4.827 . 0 0 "[ . 1 . 2 . ]" 1 153 1 13 ASP H 1 13 ASP HB2 2.900 . 4.000 3.456 2.950 3.967 . 0 0 "[ . 1 . 2 . ]" 1 154 1 13 ASP H 1 13 ASP QB 2.540 . 3.280 2.842 2.379 3.265 . 0 0 "[ . 1 . 2 . ]" 1 155 1 13 ASP H 1 13 ASP HB3 2.900 . 4.000 3.038 2.503 3.516 . 0 0 "[ . 1 . 2 . ]" 1 156 1 13 ASP H 1 14 THR H 3.070 . 4.340 4.251 3.946 4.358 0.018 23 0 "[ . 1 . 2 . ]" 1 157 1 13 ASP H 1 19 PHE QD 3.650 . 5.500 5.481 5.211 5.570 0.070 11 0 "[ . 1 . 2 . ]" 1 158 1 13 ASP H 1 61 ILE MD 2.730 . 3.660 3.034 2.544 3.568 . 0 0 "[ . 1 . 2 . ]" 1 159 1 13 ASP H 1 61 ILE HG12 3.415 . 5.030 4.789 4.236 5.053 0.023 17 0 "[ . 1 . 2 . ]" 1 160 1 13 ASP H 1 61 ILE MG 3.235 . 4.670 4.335 3.249 4.706 0.036 13 0 "[ . 1 . 2 . ]" 1 161 1 13 ASP HA 1 14 THR H 2.465 . 3.130 2.391 2.129 2.840 . 0 0 "[ . 1 . 2 . ]" 1 162 1 13 ASP HA 1 14 THR MG 2.905 . 4.010 3.567 3.313 3.870 . 0 0 "[ . 1 . 2 . ]" 1 163 1 13 ASP HA 1 19 PHE HB3 3.650 . 5.500 4.677 3.849 5.507 0.007 27 0 "[ . 1 . 2 . ]" 1 164 1 13 ASP HA 1 19 PHE QD 3.230 . 4.660 2.845 2.419 3.380 . 0 0 "[ . 1 . 2 . ]" 1 165 1 13 ASP HA 1 19 PHE QE 3.155 . 4.510 2.872 2.464 3.519 . 0 0 "[ . 1 . 2 . ]" 1 166 1 13 ASP HA 1 61 ILE MD 3.650 . 5.500 4.636 3.745 5.403 . 0 0 "[ . 1 . 2 . ]" 1 167 1 13 ASP QB 1 14 THR H 2.800 . 3.800 3.063 2.083 3.816 0.016 13 0 "[ . 1 . 2 . ]" 1 168 1 13 ASP HB2 1 14 THR H 3.180 . 4.560 3.503 2.096 4.501 . 0 0 "[ . 1 . 2 . ]" 1 169 1 13 ASP HB3 1 14 THR H 3.180 . 4.560 3.724 2.696 4.246 . 0 0 "[ . 1 . 2 . ]" 1 170 1 14 THR H 1 14 THR MG 2.610 . 3.420 2.186 1.899 2.612 . 0 0 "[ . 1 . 2 . ]" 1 171 1 14 THR H 1 19 PHE QD 3.360 . 4.920 3.529 3.104 4.098 . 0 0 "[ . 1 . 2 . ]" 1 172 1 14 THR H 1 19 PHE QE 3.625 . 5.450 4.520 4.158 4.861 . 0 0 "[ . 1 . 2 . ]" 1 173 1 14 THR H 1 61 ILE MG 3.525 . 5.250 5.011 4.483 5.339 0.089 29 0 "[ . 1 . 2 . ]" 1 174 1 14 THR HA 1 14 THR MG 2.625 . 3.450 3.230 3.203 3.244 . 0 0 "[ . 1 . 2 . ]" 1 175 1 14 THR HA 1 15 PRO QD 2.475 . 3.150 1.963 1.848 2.038 . 0 0 "[ . 1 . 2 . ]" 1 176 1 14 THR HA 1 15 PRO HG2 3.155 . 4.510 4.339 4.215 4.480 . 0 0 "[ . 1 . 2 . ]" 1 177 1 14 THR HA 1 15 PRO HG3 3.155 . 4.510 4.327 3.895 4.427 . 0 0 "[ . 1 . 2 . ]" 1 178 1 14 THR HA 1 16 PHE H 3.350 . 4.900 3.617 3.409 3.862 . 0 0 "[ . 1 . 2 . ]" 1 179 1 14 THR HA 1 61 ILE MD 3.650 . 5.500 4.655 3.740 5.506 0.006 6 0 "[ . 1 . 2 . ]" 1 180 1 14 THR HB 1 19 PHE QD 3.650 . 5.500 5.266 4.790 5.539 0.039 1 0 "[ . 1 . 2 . ]" 1 181 1 14 THR HB 1 61 ILE MD 3.575 . 5.350 4.485 3.492 5.344 . 0 0 "[ . 1 . 2 . ]" 1 182 1 14 THR HB 1 61 ILE MG 2.775 . 3.750 3.101 2.641 3.755 0.005 17 0 "[ . 1 . 2 . ]" 1 183 1 14 THR MG 1 16 PHE H 3.070 . 4.340 3.297 3.088 3.587 . 0 0 "[ . 1 . 2 . ]" 1 184 1 14 THR MG 1 16 PHE HB2 3.115 . 4.430 3.604 3.382 3.952 . 0 0 "[ . 1 . 2 . ]" 1 185 1 14 THR MG 1 17 GLY H 2.825 . 3.850 2.483 2.038 2.872 . 0 0 "[ . 1 . 2 . ]" 1 186 1 14 THR MG 1 17 GLY QA 2.685 . 3.570 2.994 2.541 3.203 . 0 0 "[ . 1 . 2 . ]" 1 187 1 14 THR MG 1 18 THR H 2.830 . 3.860 2.869 2.601 3.192 . 0 0 "[ . 1 . 2 . ]" 1 188 1 14 THR MG 1 19 PHE H 3.320 . 4.840 4.254 3.862 4.519 . 0 0 "[ . 1 . 2 . ]" 1 189 1 14 THR MG 1 19 PHE QD 2.910 . 4.020 3.322 3.006 3.615 . 0 0 "[ . 1 . 2 . ]" 1 190 1 14 THR MG 1 38 ASN H 3.650 . 5.500 4.975 4.532 5.221 . 0 0 "[ . 1 . 2 . ]" 1 191 1 14 THR MG 1 64 CYS QB 3.570 . 5.340 4.051 3.547 4.870 . 0 0 "[ . 1 . 2 . ]" 1 192 1 15 PRO HA 1 16 PHE H 2.665 . 3.530 3.386 3.283 3.438 . 0 0 "[ . 1 . 2 . ]" 1 193 1 15 PRO HA 1 16 PHE QD 3.645 . 5.490 5.335 5.055 5.459 . 0 0 "[ . 1 . 2 . ]" 1 194 1 15 PRO HB2 1 16 PHE H 2.940 . 4.080 3.613 2.877 3.883 . 0 0 "[ . 1 . 2 . ]" 1 195 1 15 PRO HB2 1 16 PHE HA 3.585 . 5.370 4.199 3.783 4.513 . 0 0 "[ . 1 . 2 . ]" 1 196 1 15 PRO HB2 1 16 PHE QD 3.245 . 4.690 4.414 3.948 4.702 0.012 29 0 "[ . 1 . 2 . ]" 1 197 1 15 PRO HB2 1 16 PHE QE 3.445 . 5.090 4.605 4.184 4.972 . 0 0 "[ . 1 . 2 . ]" 1 198 1 15 PRO HB3 1 16 PHE H 3.170 . 4.540 4.297 4.083 4.364 . 0 0 "[ . 1 . 2 . ]" 1 199 1 15 PRO HB3 1 16 PHE QD 3.630 . 5.460 5.450 5.252 5.517 0.057 28 0 "[ . 1 . 2 . ]" 1 200 1 15 PRO HB3 1 16 PHE QE 3.650 . 5.500 5.517 5.432 5.549 0.049 25 0 "[ . 1 . 2 . ]" 1 201 1 15 PRO QD 1 16 PHE H 2.560 . 3.320 2.558 2.101 2.798 . 0 0 "[ . 1 . 2 . ]" 1 202 1 15 PRO QD 1 16 PHE QD 3.040 . 4.280 2.704 2.242 3.309 . 0 0 "[ . 1 . 2 . ]" 1 203 1 15 PRO QD 1 16 PHE QE 3.650 . 5.500 3.021 2.763 3.451 . 0 0 "[ . 1 . 2 . ]" 1 204 1 15 PRO QG 1 16 PHE H 2.695 . 3.590 2.940 2.652 3.634 0.044 19 0 "[ . 1 . 2 . ]" 1 205 1 15 PRO QG 1 16 PHE QD 3.575 . 5.350 3.280 2.845 4.212 . 0 0 "[ . 1 . 2 . ]" 1 206 1 15 PRO QG 1 16 PHE QE 3.315 . 4.830 3.035 2.774 3.748 . 0 0 "[ . 1 . 2 . ]" 1 207 1 15 PRO HG2 1 16 PHE H 3.070 . 4.340 3.013 2.688 3.889 . 0 0 "[ . 1 . 2 . ]" 1 208 1 15 PRO HG2 1 16 PHE QE 3.650 . 5.500 3.135 2.863 3.840 . 0 0 "[ . 1 . 2 . ]" 1 209 1 15 PRO HG3 1 16 PHE H 3.070 . 4.340 4.243 4.064 4.374 0.034 20 0 "[ . 1 . 2 . ]" 1 210 1 15 PRO HG3 1 16 PHE QE 3.650 . 5.500 4.061 3.720 5.231 . 0 0 "[ . 1 . 2 . ]" 1 211 1 16 PHE H 1 16 PHE HB2 2.930 . 4.060 2.527 2.463 2.584 . 0 0 "[ . 1 . 2 . ]" 1 212 1 16 PHE H 1 16 PHE QD 2.665 . 3.530 2.577 2.027 3.049 . 0 0 "[ . 1 . 2 . ]" 1 213 1 16 PHE H 1 16 PHE QE 3.095 . 4.390 4.198 3.987 4.376 . 0 0 "[ . 1 . 2 . ]" 1 214 1 16 PHE H 1 16 PHE HZ 3.650 . 5.500 5.551 5.463 5.593 0.093 18 0 "[ . 1 . 2 . ]" 1 215 1 16 PHE H 1 17 GLY H 2.620 . 3.440 2.473 2.214 2.653 . 0 0 "[ . 1 . 2 . ]" 1 216 1 16 PHE HA 1 16 PHE QD 3.030 . 4.260 2.672 2.355 3.003 . 0 0 "[ . 1 . 2 . ]" 1 217 1 16 PHE HA 1 16 PHE QE 3.650 . 5.500 4.627 4.512 4.737 . 0 0 "[ . 1 . 2 . ]" 1 218 1 16 PHE HA 1 38 ASN HD21 3.570 . 5.340 4.187 3.607 4.931 . 0 0 "[ . 1 . 2 . ]" 1 219 1 16 PHE HA 1 38 ASN HD22 3.650 . 5.500 5.326 4.640 5.593 0.093 3 0 "[ . 1 . 2 . ]" 1 220 1 16 PHE HA 1 41 TYR QE 3.650 . 5.500 3.494 2.863 3.826 . 0 0 "[ . 1 . 2 . ]" 1 221 1 16 PHE HB2 1 17 GLY H 3.510 . 5.220 3.350 2.097 3.831 . 0 0 "[ . 1 . 2 . ]" 1 222 1 16 PHE HB2 1 18 THR H 3.650 . 5.500 5.573 5.517 5.629 0.129 15 0 "[ . 1 . 2 . ]" 1 223 1 16 PHE HB2 1 64 CYS QB 3.225 . 4.650 2.350 1.864 3.406 . 0 0 "[ . 1 . 2 . ]" 1 224 1 16 PHE HB3 1 64 CYS QB 3.430 . 5.060 2.796 1.989 3.858 . 0 0 "[ . 1 . 2 . ]" 1 225 1 16 PHE QD 1 17 GLY H 3.275 . 4.750 4.392 3.407 4.693 . 0 0 "[ . 1 . 2 . ]" 1 226 1 16 PHE QD 1 41 TYR QD 3.385 . 4.970 3.463 2.152 4.097 . 0 0 "[ . 1 . 2 . ]" 1 227 1 16 PHE QD 1 41 TYR QE 2.950 . 4.100 2.671 2.023 3.589 . 0 0 "[ . 1 . 2 . ]" 1 228 1 16 PHE QD 1 64 CYS QB 3.510 . 5.220 2.763 2.118 4.037 . 0 0 "[ . 1 . 2 . ]" 1 229 1 16 PHE QE 1 41 TYR QD 3.650 . 5.500 5.011 4.032 5.519 0.019 18 0 "[ . 1 . 2 . ]" 1 230 1 16 PHE QE 1 41 TYR QE 3.345 . 4.890 3.754 3.245 4.611 . 0 0 "[ . 1 . 2 . ]" 1 231 1 17 GLY H 1 18 THR H 2.910 . 4.020 3.892 3.753 4.022 0.002 11 0 "[ . 1 . 2 . ]" 1 232 1 17 GLY H 1 18 THR MG 3.650 . 5.500 4.925 4.377 5.382 . 0 0 "[ . 1 . 2 . ]" 1 233 1 17 GLY H 1 38 ASN H 3.310 . 4.820 4.398 4.179 4.835 0.015 1 0 "[ . 1 . 2 . ]" 1 234 1 17 GLY QA 1 18 THR H 2.400 . 3.000 2.000 1.930 2.083 . 0 0 "[ . 1 . 2 . ]" 1 235 1 17 GLY QA 1 37 CYS HA 2.875 . 3.950 2.101 1.879 2.419 . 0 0 "[ . 1 . 2 . ]" 1 236 1 17 GLY QA 1 38 ASN H 2.820 . 3.840 2.283 1.886 2.508 . 0 0 "[ . 1 . 2 . ]" 1 237 1 18 THR H 1 18 THR HB 2.945 . 4.090 3.648 3.375 3.901 . 0 0 "[ . 1 . 2 . ]" 1 238 1 18 THR H 1 18 THR MG 2.555 . 3.310 2.966 2.356 3.386 0.076 9 0 "[ . 1 . 2 . ]" 1 239 1 18 THR H 1 19 PHE H 3.135 . 4.470 4.326 4.182 4.438 . 0 0 "[ . 1 . 2 . ]" 1 240 1 18 THR H 1 19 PHE HA 3.330 . 4.860 4.522 4.374 4.694 . 0 0 "[ . 1 . 2 . ]" 1 241 1 18 THR H 1 36 THR H 3.015 . 4.230 3.455 3.216 3.629 . 0 0 "[ . 1 . 2 . ]" 1 242 1 18 THR H 1 36 THR MG 2.975 . 4.150 3.398 3.120 3.582 . 0 0 "[ . 1 . 2 . ]" 1 243 1 18 THR H 1 37 CYS HA 2.860 . 3.920 3.007 2.537 3.178 . 0 0 "[ . 1 . 2 . ]" 1 244 1 18 THR H 1 37 CYS HB3 3.650 . 5.500 5.388 4.895 5.552 0.052 16 0 "[ . 1 . 2 . ]" 1 245 1 18 THR H 1 38 ASN H 3.230 . 4.660 4.189 3.964 4.372 . 0 0 "[ . 1 . 2 . ]" 1 246 1 18 THR H 1 38 ASN HA 3.435 . 5.070 4.989 4.781 5.133 0.063 28 0 "[ . 1 . 2 . ]" 1 247 1 18 THR H 1 38 ASN HB2 3.650 . 5.500 5.439 4.896 5.608 0.108 21 0 "[ . 1 . 2 . ]" 1 248 1 18 THR HA 1 18 THR MG 2.575 . 3.350 2.763 2.263 3.256 . 0 0 "[ . 1 . 2 . ]" 1 249 1 18 THR HA 1 19 PHE H 2.460 . 3.120 2.693 2.471 2.907 . 0 0 "[ . 1 . 2 . ]" 1 250 1 18 THR HB 1 19 PHE H 2.775 . 3.750 2.838 1.975 3.636 . 0 0 "[ . 1 . 2 . ]" 1 251 1 18 THR MG 1 19 PHE H 2.780 . 3.760 3.096 2.469 3.527 . 0 0 "[ . 1 . 2 . ]" 1 252 1 18 THR MG 1 38 ASN H 3.650 . 5.500 5.271 4.632 5.535 0.035 19 0 "[ . 1 . 2 . ]" 1 253 1 18 THR MG 1 38 ASN HD22 3.650 . 5.500 4.485 1.791 5.556 0.056 17 0 "[ . 1 . 2 . ]" 1 254 1 19 PHE H 1 19 PHE QD 2.790 . 3.780 3.041 2.733 3.276 . 0 0 "[ . 1 . 2 . ]" 1 255 1 19 PHE H 1 19 PHE QE 3.240 . 4.680 4.561 4.453 4.679 . 0 0 "[ . 1 . 2 . ]" 1 256 1 19 PHE H 1 20 THR H 3.210 . 4.620 4.292 4.225 4.350 . 0 0 "[ . 1 . 2 . ]" 1 257 1 19 PHE H 1 35 TYR HA 3.440 . 5.080 4.625 4.503 4.815 . 0 0 "[ . 1 . 2 . ]" 1 258 1 19 PHE H 1 36 THR H 3.445 . 5.090 4.434 4.258 4.622 . 0 0 "[ . 1 . 2 . ]" 1 259 1 19 PHE HA 1 19 PHE QD 2.965 . 4.130 3.750 3.721 3.775 . 0 0 "[ . 1 . 2 . ]" 1 260 1 19 PHE HA 1 20 THR H 2.315 . 2.830 2.358 2.186 2.488 . 0 0 "[ . 1 . 2 . ]" 1 261 1 19 PHE HA 1 20 THR HA 3.340 . 4.880 4.420 4.332 4.494 . 0 0 "[ . 1 . 2 . ]" 1 262 1 19 PHE HA 1 35 TYR H 3.395 . 4.990 4.708 4.572 4.830 . 0 0 "[ . 1 . 2 . ]" 1 263 1 19 PHE HA 1 35 TYR HA 2.675 . 3.550 2.109 1.962 2.386 . 0 0 "[ . 1 . 2 . ]" 1 264 1 19 PHE HA 1 36 THR H 2.775 . 3.750 2.357 1.985 2.641 . 0 0 "[ . 1 . 2 . ]" 1 265 1 19 PHE HA 1 36 THR MG 2.795 . 3.790 2.372 1.931 2.842 . 0 0 "[ . 1 . 2 . ]" 1 266 1 19 PHE HB2 1 20 THR H 2.495 . 3.190 2.481 2.219 2.779 . 0 0 "[ . 1 . 2 . ]" 1 267 1 19 PHE HB2 1 33 ALA HA 3.555 . 5.310 4.251 4.026 4.556 . 0 0 "[ . 1 . 2 . ]" 1 268 1 19 PHE HB2 1 33 ALA MB 2.985 . 4.170 3.428 3.226 3.559 . 0 0 "[ . 1 . 2 . ]" 1 269 1 19 PHE HB2 1 34 VAL H 3.630 . 5.460 4.060 3.817 4.315 . 0 0 "[ . 1 . 2 . ]" 1 270 1 19 PHE HB2 1 35 TYR HA 3.020 . 4.240 2.357 2.181 2.537 . 0 0 "[ . 1 . 2 . ]" 1 271 1 19 PHE HB2 1 36 THR H 3.090 . 4.380 4.105 3.844 4.345 . 0 0 "[ . 1 . 2 . ]" 1 272 1 19 PHE HB3 1 20 THR H 2.890 . 3.980 3.824 3.637 4.004 0.024 23 0 "[ . 1 . 2 . ]" 1 273 1 19 PHE HB3 1 33 ALA MB 3.570 . 5.340 4.415 4.170 4.663 . 0 0 "[ . 1 . 2 . ]" 1 274 1 19 PHE HB3 1 35 TYR HA 2.940 . 4.080 2.440 2.171 2.908 . 0 0 "[ . 1 . 2 . ]" 1 275 1 19 PHE HB3 1 36 THR H 3.150 . 4.500 3.624 3.331 4.052 . 0 0 "[ . 1 . 2 . ]" 1 276 1 19 PHE QD 1 20 THR H 2.605 . 3.410 3.092 2.845 3.278 . 0 0 "[ . 1 . 2 . ]" 1 277 1 19 PHE QD 1 20 THR HA 2.935 . 4.070 3.771 3.473 4.087 0.017 5 0 "[ . 1 . 2 . ]" 1 278 1 19 PHE QD 1 21 LEU H 3.360 . 4.920 4.571 4.318 4.910 . 0 0 "[ . 1 . 2 . ]" 1 279 1 19 PHE QD 1 21 LEU HA 3.550 . 5.300 4.034 3.844 4.227 . 0 0 "[ . 1 . 2 . ]" 1 280 1 19 PHE QD 1 21 LEU MD1 3.265 . 4.730 4.153 3.825 4.397 . 0 0 "[ . 1 . 2 . ]" 1 281 1 19 PHE QD 1 21 LEU MD2 2.730 . 3.660 3.169 3.096 3.246 . 0 0 "[ . 1 . 2 . ]" 1 282 1 19 PHE QD 1 21 LEU HG 3.060 . 4.320 2.909 2.574 3.162 . 0 0 "[ . 1 . 2 . ]" 1 283 1 19 PHE QD 1 27 PHE QD 3.650 . 5.500 5.523 5.490 5.559 0.059 26 0 "[ . 1 . 2 . ]" 1 284 1 19 PHE QD 1 27 PHE QE 3.545 . 5.290 4.174 4.061 4.225 . 0 0 "[ . 1 . 2 . ]" 1 285 1 19 PHE QD 1 27 PHE HZ 3.650 . 5.500 5.528 5.333 5.589 0.089 22 0 "[ . 1 . 2 . ]" 1 286 1 19 PHE QD 1 33 ALA HA 3.360 . 4.920 3.140 2.818 3.374 . 0 0 "[ . 1 . 2 . ]" 1 287 1 19 PHE QD 1 33 ALA MB 2.615 . 3.430 2.774 2.407 3.102 . 0 0 "[ . 1 . 2 . ]" 1 288 1 19 PHE QD 1 34 VAL H 3.140 . 4.480 3.906 3.720 4.291 . 0 0 "[ . 1 . 2 . ]" 1 289 1 19 PHE QD 1 35 TYR H 3.650 . 5.500 5.577 5.544 5.664 0.164 15 0 "[ . 1 . 2 . ]" 1 290 1 19 PHE QD 1 35 TYR HA 3.470 . 5.140 4.229 4.040 4.401 . 0 0 "[ . 1 . 2 . ]" 1 291 1 19 PHE QE 1 20 THR H 3.525 . 5.250 5.225 5.067 5.294 0.044 23 0 "[ . 1 . 2 . ]" 1 292 1 19 PHE QE 1 21 LEU H 3.615 . 5.430 5.242 4.952 5.449 0.019 2 0 "[ . 1 . 2 . ]" 1 293 1 19 PHE QE 1 21 LEU MD1 2.765 . 3.730 2.650 2.287 2.982 . 0 0 "[ . 1 . 2 . ]" 1 294 1 19 PHE QE 1 21 LEU MD2 2.425 . 3.050 2.194 2.024 2.377 . 0 0 "[ . 1 . 2 . ]" 1 295 1 19 PHE QE 1 21 LEU HG 2.900 . 4.000 2.491 2.282 2.778 . 0 0 "[ . 1 . 2 . ]" 1 296 1 19 PHE QE 1 27 PHE QE 3.045 . 4.290 1.914 1.861 1.966 . 0 0 "[ . 1 . 2 . ]" 1 297 1 19 PHE QE 1 27 PHE HZ 2.960 . 4.120 3.497 3.213 3.632 . 0 0 "[ . 1 . 2 . ]" 1 298 1 19 PHE QE 1 33 ALA HA 3.650 . 5.500 4.230 3.817 4.538 . 0 0 "[ . 1 . 2 . ]" 1 299 1 19 PHE QE 1 33 ALA MB 3.650 . 5.500 3.361 2.971 3.710 . 0 0 "[ . 1 . 2 . ]" 1 300 1 19 PHE HZ 1 21 LEU MD1 3.165 . 4.530 3.893 3.524 4.296 . 0 0 "[ . 1 . 2 . ]" 1 301 1 19 PHE HZ 1 21 LEU MD2 3.625 . 5.450 4.095 3.860 4.284 . 0 0 "[ . 1 . 2 . ]" 1 302 1 19 PHE HZ 1 21 LEU HG 3.650 . 5.500 4.752 4.477 5.003 . 0 0 "[ . 1 . 2 . ]" 1 303 1 19 PHE HZ 1 27 PHE QE 2.900 . 4.000 2.309 2.032 2.593 . 0 0 "[ . 1 . 2 . ]" 1 304 1 19 PHE HZ 1 27 PHE HZ 3.285 . 4.770 2.586 2.266 2.916 . 0 0 "[ . 1 . 2 . ]" 1 305 1 20 THR H 1 20 THR HB 2.555 . 3.310 2.747 2.609 2.867 . 0 0 "[ . 1 . 2 . ]" 1 306 1 20 THR H 1 20 THR MG 2.925 . 4.050 3.880 3.836 3.952 . 0 0 "[ . 1 . 2 . ]" 1 307 1 20 THR H 1 21 LEU HA 3.500 . 5.200 4.630 4.475 4.715 . 0 0 "[ . 1 . 2 . ]" 1 308 1 20 THR H 1 33 ALA HA 3.205 . 4.610 4.385 4.208 4.491 . 0 0 "[ . 1 . 2 . ]" 1 309 1 20 THR H 1 33 ALA MB 3.255 . 4.710 4.685 4.504 4.749 0.039 23 0 "[ . 1 . 2 . ]" 1 310 1 20 THR H 1 34 VAL H 2.780 . 3.760 3.341 3.220 3.558 . 0 0 "[ . 1 . 2 . ]" 1 311 1 20 THR H 1 34 VAL HB 3.535 . 5.270 3.964 3.261 4.893 . 0 0 "[ . 1 . 2 . ]" 1 312 1 20 THR H 1 34 VAL MG1 3.620 . 5.440 4.270 3.695 5.041 . 0 0 "[ . 1 . 2 . ]" 1 313 1 20 THR H 1 34 VAL QG 3.045 . 4.290 3.278 2.625 3.749 . 0 0 "[ . 1 . 2 . ]" 1 314 1 20 THR H 1 34 VAL MG2 3.620 . 5.440 3.916 2.637 4.867 . 0 0 "[ . 1 . 2 . ]" 1 315 1 20 THR H 1 35 TYR H 3.395 . 4.990 4.623 4.468 4.748 . 0 0 "[ . 1 . 2 . ]" 1 316 1 20 THR H 1 35 TYR HA 2.640 . 3.480 3.267 3.039 3.482 0.002 27 0 "[ . 1 . 2 . ]" 1 317 1 20 THR H 1 36 THR H 3.085 . 4.370 4.323 3.979 4.398 0.028 3 0 "[ . 1 . 2 . ]" 1 318 1 20 THR H 1 36 THR MG 2.675 . 3.550 3.429 2.973 3.592 0.042 26 0 "[ . 1 . 2 . ]" 1 319 1 20 THR HA 1 20 THR MG 2.220 . 2.640 2.283 2.237 2.328 . 0 0 "[ . 1 . 2 . ]" 1 320 1 20 THR HA 1 21 LEU H 2.255 . 2.710 2.358 2.234 2.483 . 0 0 "[ . 1 . 2 . ]" 1 321 1 20 THR HA 1 21 LEU HA 3.510 . 5.220 4.390 4.291 4.459 . 0 0 "[ . 1 . 2 . ]" 1 322 1 20 THR HA 1 21 LEU HB2 3.295 . 4.790 4.492 4.393 4.601 . 0 0 "[ . 1 . 2 . ]" 1 323 1 20 THR HA 1 21 LEU MD1 3.110 . 4.420 4.432 4.341 4.481 0.061 5 0 "[ . 1 . 2 . ]" 1 324 1 20 THR HA 1 21 LEU HG 2.720 . 3.640 3.619 3.508 3.672 0.032 7 0 "[ . 1 . 2 . ]" 1 325 1 20 THR HA 1 34 VAL H 3.525 . 5.250 5.040 4.915 5.185 . 0 0 "[ . 1 . 2 . ]" 1 326 1 20 THR HB 1 21 LEU H 2.545 . 3.290 3.364 3.326 3.389 0.099 22 0 "[ . 1 . 2 . ]" 1 327 1 20 THR HB 1 21 LEU HA 3.105 . 4.410 4.412 4.298 4.458 0.048 9 0 "[ . 1 . 2 . ]" 1 328 1 20 THR HB 1 22 THR H 3.625 . 5.450 5.233 4.853 5.478 0.028 9 0 "[ . 1 . 2 . ]" 1 329 1 20 THR HB 1 34 VAL H 3.200 . 4.600 3.881 3.680 4.232 . 0 0 "[ . 1 . 2 . ]" 1 330 1 20 THR HB 1 34 VAL HB 3.145 . 4.490 3.569 2.596 4.557 0.067 5 0 "[ . 1 . 2 . ]" 1 331 1 20 THR HB 1 34 VAL QG 2.935 . 4.070 2.908 2.029 3.884 . 0 0 "[ . 1 . 2 . ]" 1 332 1 20 THR MG 1 21 LEU H 2.440 . 3.080 1.960 1.858 2.103 . 0 0 "[ . 1 . 2 . ]" 1 333 1 20 THR MG 1 21 LEU HA 3.180 . 4.560 4.064 3.924 4.197 . 0 0 "[ . 1 . 2 . ]" 1 334 1 21 LEU H 1 21 LEU HB2 2.435 . 3.070 2.520 2.447 2.594 . 0 0 "[ . 1 . 2 . ]" 1 335 1 21 LEU H 1 21 LEU HB3 2.810 . 3.820 3.664 3.623 3.710 . 0 0 "[ . 1 . 2 . ]" 1 336 1 21 LEU H 1 21 LEU MD1 2.755 . 3.710 3.612 3.468 3.718 0.008 20 0 "[ . 1 . 2 . ]" 1 337 1 21 LEU H 1 21 LEU MD2 3.075 . 4.350 4.110 3.995 4.187 . 0 0 "[ . 1 . 2 . ]" 1 338 1 21 LEU H 1 21 LEU HG 2.630 . 3.460 3.007 2.850 3.118 . 0 0 "[ . 1 . 2 . ]" 1 339 1 21 LEU H 1 22 THR H 3.220 . 4.640 4.279 4.141 4.388 . 0 0 "[ . 1 . 2 . ]" 1 340 1 21 LEU H 1 25 ASN HA 3.380 . 4.960 3.891 3.650 4.528 . 0 0 "[ . 1 . 2 . ]" 1 341 1 21 LEU H 1 33 ALA HA 3.365 . 4.930 4.920 4.842 4.959 0.029 28 0 "[ . 1 . 2 . ]" 1 342 1 21 LEU HA 1 21 LEU MD1 2.875 . 3.950 3.873 3.855 3.901 . 0 0 "[ . 1 . 2 . ]" 1 343 1 21 LEU HA 1 21 LEU MD2 2.325 . 2.850 2.274 2.205 2.369 . 0 0 "[ . 1 . 2 . ]" 1 344 1 21 LEU HA 1 21 LEU HG 2.915 . 4.030 2.809 2.747 2.832 . 0 0 "[ . 1 . 2 . ]" 1 345 1 21 LEU HA 1 22 THR H 2.190 . 2.580 2.118 2.031 2.164 . 0 0 "[ . 1 . 2 . ]" 1 346 1 21 LEU HA 1 31 VAL MG2 2.660 . 3.520 3.043 2.880 3.205 . 0 0 "[ . 1 . 2 . ]" 1 347 1 21 LEU HA 1 32 LYS H 3.630 . 5.460 4.372 4.079 4.594 . 0 0 "[ . 1 . 2 . ]" 1 348 1 21 LEU HA 1 33 ALA HA 2.660 . 3.520 2.506 2.410 2.601 . 0 0 "[ . 1 . 2 . ]" 1 349 1 21 LEU HA 1 33 ALA MB 3.040 . 4.280 4.002 3.845 4.099 . 0 0 "[ . 1 . 2 . ]" 1 350 1 21 LEU HA 1 34 VAL H 2.575 . 3.350 3.036 2.919 3.138 . 0 0 "[ . 1 . 2 . ]" 1 351 1 21 LEU HA 1 34 VAL QG 3.105 . 4.410 3.752 3.230 4.278 . 0 0 "[ . 1 . 2 . ]" 1 352 1 21 LEU HB2 1 21 LEU MD1 2.165 . 2.530 2.188 2.143 2.236 . 0 0 "[ . 1 . 2 . ]" 1 353 1 21 LEU HB2 1 22 THR H 3.010 . 4.220 4.136 3.972 4.220 0.000 24 0 "[ . 1 . 2 . ]" 1 354 1 21 LEU HB2 1 24 GLY H 3.480 . 5.160 5.154 4.892 5.236 0.076 8 0 "[ . 1 . 2 . ]" 1 355 1 21 LEU HB2 1 25 ASN HA 2.905 . 4.010 2.066 1.857 2.494 . 0 0 "[ . 1 . 2 . ]" 1 356 1 21 LEU HB2 1 26 VAL H 3.085 . 4.370 3.538 3.322 3.950 . 0 0 "[ . 1 . 2 . ]" 1 357 1 21 LEU HB2 1 31 VAL MG2 2.650 . 3.500 3.396 3.268 3.513 0.013 1 0 "[ . 1 . 2 . ]" 1 358 1 21 LEU HB3 1 21 LEU MD1 2.445 . 3.090 2.565 2.518 2.591 . 0 0 "[ . 1 . 2 . ]" 1 359 1 21 LEU HB3 1 21 LEU MD2 2.405 . 3.010 2.197 2.169 2.239 . 0 0 "[ . 1 . 2 . ]" 1 360 1 21 LEU HB3 1 22 THR H 2.535 . 3.270 3.188 2.940 3.315 0.045 28 0 "[ . 1 . 2 . ]" 1 361 1 21 LEU HB3 1 24 GLY H 3.310 . 4.820 4.353 3.961 4.736 . 0 0 "[ . 1 . 2 . ]" 1 362 1 21 LEU HB3 1 25 ASN HA 3.240 . 4.680 2.870 2.568 3.125 . 0 0 "[ . 1 . 2 . ]" 1 363 1 21 LEU HB3 1 31 VAL MG1 2.875 . 3.950 3.726 3.603 3.859 . 0 0 "[ . 1 . 2 . ]" 1 364 1 21 LEU HB3 1 31 VAL MG2 2.590 . 3.380 2.025 1.904 2.140 . 0 0 "[ . 1 . 2 . ]" 1 365 1 21 LEU HB3 1 33 ALA HA 3.610 . 5.420 4.336 4.209 4.433 . 0 0 "[ . 1 . 2 . ]" 1 366 1 21 LEU HB3 1 34 VAL H 3.620 . 5.440 5.447 5.313 5.513 0.073 22 0 "[ . 1 . 2 . ]" 1 367 1 21 LEU MD1 1 22 THR H 3.550 . 5.300 5.120 4.944 5.209 . 0 0 "[ . 1 . 2 . ]" 1 368 1 21 LEU MD1 1 25 ASN HA 2.585 . 3.370 3.274 2.967 3.410 0.040 4 0 "[ . 1 . 2 . ]" 1 369 1 21 LEU MD1 1 25 ASN QB 3.095 . 4.390 4.222 3.745 4.492 0.102 15 0 "[ . 1 . 2 . ]" 1 370 1 21 LEU MD1 1 26 VAL H 2.635 . 3.470 2.884 2.649 3.033 . 0 0 "[ . 1 . 2 . ]" 1 371 1 21 LEU MD1 1 26 VAL HA 2.620 . 3.440 2.168 2.031 2.446 . 0 0 "[ . 1 . 2 . ]" 1 372 1 21 LEU MD1 1 27 PHE H 2.835 . 3.870 3.781 3.552 3.924 0.054 11 0 "[ . 1 . 2 . ]" 1 373 1 21 LEU MD1 1 27 PHE QD 2.605 . 3.410 3.191 2.977 3.364 . 0 0 "[ . 1 . 2 . ]" 1 374 1 21 LEU MD1 1 27 PHE QE 2.530 . 3.260 2.465 2.189 2.701 . 0 0 "[ . 1 . 2 . ]" 1 375 1 21 LEU MD1 1 28 GLU H 3.415 . 5.030 4.727 4.555 4.881 . 0 0 "[ . 1 . 2 . ]" 1 376 1 21 LEU MD1 1 57 TRP HH2 3.460 . 5.120 4.319 4.157 4.501 . 0 0 "[ . 1 . 2 . ]" 1 377 1 21 LEU MD2 1 22 THR H 3.005 . 4.210 3.576 3.385 3.703 . 0 0 "[ . 1 . 2 . ]" 1 378 1 21 LEU MD2 1 26 VAL H 3.040 . 4.280 3.634 3.475 3.784 . 0 0 "[ . 1 . 2 . ]" 1 379 1 21 LEU MD2 1 27 PHE H 3.180 . 4.560 4.490 4.376 4.570 0.010 9 0 "[ . 1 . 2 . ]" 1 380 1 21 LEU MD2 1 27 PHE QD 2.425 . 3.050 2.347 2.197 2.475 . 0 0 "[ . 1 . 2 . ]" 1 381 1 21 LEU MD2 1 27 PHE QE 2.515 . 3.230 2.358 2.157 2.490 . 0 0 "[ . 1 . 2 . ]" 1 382 1 21 LEU MD2 1 28 GLU H 3.115 . 4.430 4.477 4.433 4.521 0.091 15 0 "[ . 1 . 2 . ]" 1 383 1 21 LEU MD2 1 31 VAL HB 3.120 . 4.440 4.360 4.243 4.452 0.012 18 0 "[ . 1 . 2 . ]" 1 384 1 21 LEU MD2 1 32 LYS H 3.145 . 4.490 4.387 4.145 4.510 0.020 4 0 "[ . 1 . 2 . ]" 1 385 1 21 LEU MD2 1 33 ALA H 3.010 . 4.220 3.769 3.624 3.906 . 0 0 "[ . 1 . 2 . ]" 1 386 1 21 LEU MD2 1 33 ALA HA 2.335 . 2.870 2.149 2.061 2.276 . 0 0 "[ . 1 . 2 . ]" 1 387 1 21 LEU MD2 1 33 ALA MB 2.240 . 2.680 2.389 2.223 2.560 . 0 0 "[ . 1 . 2 . ]" 1 388 1 21 LEU MD2 1 34 VAL H 3.130 . 4.460 3.922 3.833 4.037 . 0 0 "[ . 1 . 2 . ]" 1 389 1 21 LEU MD2 1 57 TRP HE1 3.650 . 5.500 5.505 5.368 5.563 0.063 14 0 "[ . 1 . 2 . ]" 1 390 1 21 LEU MD2 1 57 TRP HH2 2.450 . 3.100 2.295 2.180 2.402 . 0 0 "[ . 1 . 2 . ]" 1 391 1 21 LEU MD2 1 57 TRP HZ2 3.355 . 4.910 3.362 3.249 3.432 . 0 0 "[ . 1 . 2 . ]" 1 392 1 21 LEU HG 1 27 PHE QD 3.535 . 5.270 4.689 4.509 4.853 . 0 0 "[ . 1 . 2 . ]" 1 393 1 21 LEU HG 1 27 PHE QE 3.460 . 5.120 3.707 3.544 3.848 . 0 0 "[ . 1 . 2 . ]" 1 394 1 21 LEU HG 1 33 ALA HA 3.205 . 4.610 3.666 3.514 3.853 . 0 0 "[ . 1 . 2 . ]" 1 395 1 21 LEU HG 1 33 ALA MB 3.245 . 4.690 4.053 3.880 4.270 . 0 0 "[ . 1 . 2 . ]" 1 396 1 21 LEU HG 1 34 VAL H 3.650 . 5.500 4.825 4.649 5.004 . 0 0 "[ . 1 . 2 . ]" 1 397 1 21 LEU HG 1 57 TRP HH2 3.650 . 5.500 5.084 4.962 5.222 . 0 0 "[ . 1 . 2 . ]" 1 398 1 22 THR H 1 22 THR HB 2.785 . 3.770 3.719 3.671 3.790 0.020 25 0 "[ . 1 . 2 . ]" 1 399 1 22 THR H 1 22 THR MG 2.615 . 3.430 3.012 2.847 3.278 . 0 0 "[ . 1 . 2 . ]" 1 400 1 22 THR H 1 23 GLY H 3.465 . 5.130 4.327 4.162 4.482 . 0 0 "[ . 1 . 2 . ]" 1 401 1 22 THR H 1 23 GLY HA3 3.405 . 5.010 4.875 4.696 5.010 . 0 0 "[ . 1 . 2 . ]" 1 402 1 22 THR H 1 24 GLY H 3.280 . 4.760 4.474 3.669 4.776 0.016 8 0 "[ . 1 . 2 . ]" 1 403 1 22 THR H 1 25 ASN HA 3.525 . 5.250 4.887 4.542 5.258 0.008 10 0 "[ . 1 . 2 . ]" 1 404 1 22 THR H 1 26 VAL H 3.650 . 5.500 5.607 5.557 5.686 0.186 25 0 "[ . 1 . 2 . ]" 1 405 1 22 THR H 1 31 VAL HA 3.345 . 4.890 4.474 4.142 4.776 . 0 0 "[ . 1 . 2 . ]" 1 406 1 22 THR H 1 31 VAL MG2 2.400 . 3.000 2.547 2.261 2.815 . 0 0 "[ . 1 . 2 . ]" 1 407 1 22 THR H 1 32 LYS H 2.550 . 3.300 2.773 2.503 3.017 . 0 0 "[ . 1 . 2 . ]" 1 408 1 22 THR H 1 32 LYS HB2 2.840 . 3.880 3.311 2.913 3.493 . 0 0 "[ . 1 . 2 . ]" 1 409 1 22 THR H 1 32 LYS HB3 3.355 . 4.910 4.583 4.284 4.811 . 0 0 "[ . 1 . 2 . ]" 1 410 1 22 THR H 1 32 LYS QD 3.400 . 5.000 4.984 4.447 5.090 0.090 7 0 "[ . 1 . 2 . ]" 1 411 1 22 THR H 1 33 ALA HA 2.790 . 3.780 3.725 3.485 3.850 0.070 5 0 "[ . 1 . 2 . ]" 1 412 1 22 THR H 1 33 ALA MB 3.460 . 5.120 4.994 4.813 5.094 . 0 0 "[ . 1 . 2 . ]" 1 413 1 22 THR H 1 34 VAL H 2.810 . 3.820 3.736 3.531 3.885 0.065 11 0 "[ . 1 . 2 . ]" 1 414 1 22 THR H 1 34 VAL QG 2.860 . 3.920 3.423 3.174 3.837 . 0 0 "[ . 1 . 2 . ]" 1 415 1 22 THR HA 1 22 THR MG 2.405 . 3.010 2.317 2.278 2.392 . 0 0 "[ . 1 . 2 . ]" 1 416 1 22 THR HA 1 24 GLY H 3.020 . 4.240 3.703 3.061 4.257 0.017 28 0 "[ . 1 . 2 . ]" 1 417 1 22 THR HA 1 31 VAL MG2 3.085 . 4.370 3.814 3.681 3.985 . 0 0 "[ . 1 . 2 . ]" 1 418 1 22 THR HB 1 23 GLY H 2.855 . 3.910 3.208 2.919 3.542 . 0 0 "[ . 1 . 2 . ]" 1 419 1 22 THR HB 1 32 LYS HB2 2.870 . 3.940 3.803 3.525 3.945 0.005 8 0 "[ . 1 . 2 . ]" 1 420 1 22 THR HB 1 32 LYS HB3 3.650 . 5.500 5.421 5.129 5.526 0.026 5 0 "[ . 1 . 2 . ]" 1 421 1 22 THR HB 1 32 LYS HG3 3.650 . 5.500 5.335 4.817 5.530 0.030 26 0 "[ . 1 . 2 . ]" 1 422 1 22 THR HB 1 34 VAL QG 2.840 . 3.880 3.778 3.504 3.917 0.037 18 0 "[ . 1 . 2 . ]" 1 423 1 22 THR MG 1 23 GLY H 2.915 . 4.030 3.818 3.654 3.989 . 0 0 "[ . 1 . 2 . ]" 1 424 1 22 THR MG 1 32 LYS QE 3.400 . 5.000 4.861 4.535 5.145 0.145 5 0 "[ . 1 . 2 . ]" 1 425 1 22 THR MG 1 34 VAL H 3.010 . 4.220 3.835 3.596 4.002 . 0 0 "[ . 1 . 2 . ]" 1 426 1 22 THR MG 1 34 VAL HB 2.930 . 4.060 3.521 2.925 4.155 0.095 8 0 "[ . 1 . 2 . ]" 1 427 1 22 THR MG 1 34 VAL QG 2.175 . 2.550 2.262 1.928 2.568 0.018 22 0 "[ . 1 . 2 . ]" 1 428 1 23 GLY H 1 24 GLY H 2.695 . 3.590 2.700 2.094 3.544 . 0 0 "[ . 1 . 2 . ]" 1 429 1 23 GLY HA2 1 31 VAL MG2 3.240 . 4.680 4.404 4.046 4.661 . 0 0 "[ . 1 . 2 . ]" 1 430 1 23 GLY HA3 1 24 GLY H 2.655 . 3.510 2.982 2.370 3.482 . 0 0 "[ . 1 . 2 . ]" 1 431 1 23 GLY HA3 1 31 VAL H 3.650 . 5.500 5.453 4.942 5.543 0.043 24 0 "[ . 1 . 2 . ]" 1 432 1 23 GLY HA3 1 31 VAL MG2 2.885 . 3.970 3.327 2.656 3.666 . 0 0 "[ . 1 . 2 . ]" 1 433 1 23 GLY HA3 1 32 LYS H 2.980 . 4.160 3.631 3.376 3.968 . 0 0 "[ . 1 . 2 . ]" 1 434 1 24 GLY H 1 24 GLY HA3 2.340 . 2.880 2.671 2.420 2.871 . 0 0 "[ . 1 . 2 . ]" 1 435 1 24 GLY H 1 25 ASN H 2.825 . 3.850 2.176 1.806 3.912 0.062 11 0 "[ . 1 . 2 . ]" 1 436 1 24 GLY H 1 25 ASN HA 3.160 . 4.520 4.100 3.830 4.376 . 0 0 "[ . 1 . 2 . ]" 1 437 1 24 GLY H 1 25 ASN QB 3.410 . 5.020 4.461 3.576 5.149 0.129 11 0 "[ . 1 . 2 . ]" 1 438 1 24 GLY H 1 31 VAL HB 3.370 . 4.940 3.783 2.770 4.946 0.006 11 0 "[ . 1 . 2 . ]" 1 439 1 24 GLY H 1 31 VAL MG2 2.545 . 3.290 2.324 1.784 3.040 0.016 12 0 "[ . 1 . 2 . ]" 1 440 1 24 GLY H 1 32 LYS H 3.425 . 5.050 4.504 3.728 5.085 0.035 7 0 "[ . 1 . 2 . ]" 1 441 1 24 GLY HA2 1 25 ASN QB 3.480 . 5.160 4.195 3.863 4.444 . 0 0 "[ . 1 . 2 . ]" 1 442 1 24 GLY HA3 1 25 ASN H 2.570 . 3.340 3.009 2.172 3.330 . 0 0 "[ . 1 . 2 . ]" 1 443 1 24 GLY HA3 1 25 ASN QB 3.395 . 4.990 4.632 4.224 4.846 . 0 0 "[ . 1 . 2 . ]" 1 444 1 24 GLY HA3 1 26 VAL H 2.885 . 3.970 3.219 2.903 3.554 . 0 0 "[ . 1 . 2 . ]" 1 445 1 24 GLY HA3 1 31 VAL MG1 3.225 . 4.650 4.161 3.567 4.667 0.017 18 0 "[ . 1 . 2 . ]" 1 446 1 24 GLY HA3 1 31 VAL MG2 2.615 . 3.430 2.967 2.374 3.456 0.026 3 0 "[ . 1 . 2 . ]" 1 447 1 25 ASN H 1 25 ASN QB 2.660 . 3.520 3.137 2.383 3.450 . 0 0 "[ . 1 . 2 . ]" 1 448 1 25 ASN H 1 25 ASN HD21 3.345 . 4.890 4.442 2.782 5.076 0.186 6 0 "[ . 1 . 2 . ]" 1 449 1 25 ASN H 1 26 VAL H 2.425 . 3.050 2.629 1.909 2.841 . 0 0 "[ . 1 . 2 . ]" 1 450 1 25 ASN H 1 26 VAL MG1 3.330 . 4.860 4.642 3.039 4.873 0.013 29 0 "[ . 1 . 2 . ]" 1 451 1 25 ASN H 1 26 VAL MG2 3.015 . 4.230 3.993 2.697 4.236 0.006 14 0 "[ . 1 . 2 . ]" 1 452 1 25 ASN H 1 28 GLU QG 3.570 . 5.340 4.745 3.409 5.098 . 0 0 "[ . 1 . 2 . ]" 1 453 1 25 ASN H 1 31 VAL MG2 2.940 . 4.080 2.581 2.145 4.126 0.046 10 0 "[ . 1 . 2 . ]" 1 454 1 25 ASN HA 1 25 ASN QB 2.345 . 2.890 2.409 2.293 2.494 . 0 0 "[ . 1 . 2 . ]" 1 455 1 25 ASN HA 1 25 ASN HD21 2.990 . 4.180 3.750 1.991 4.308 0.128 3 0 "[ . 1 . 2 . ]" 1 456 1 25 ASN HA 1 25 ASN HD22 3.240 . 4.680 4.311 3.570 4.658 . 0 0 "[ . 1 . 2 . ]" 1 457 1 25 ASN HA 1 26 VAL H 2.475 . 3.150 2.974 2.722 3.083 . 0 0 "[ . 1 . 2 . ]" 1 458 1 25 ASN HA 1 26 VAL MG2 3.265 . 4.730 4.685 4.461 4.745 0.015 9 0 "[ . 1 . 2 . ]" 1 459 1 25 ASN HA 1 31 VAL MG2 3.155 . 4.510 3.591 3.334 3.881 . 0 0 "[ . 1 . 2 . ]" 1 460 1 25 ASN QB 1 25 ASN HD21 2.440 . 3.080 2.183 1.983 2.801 . 0 0 "[ . 1 . 2 . ]" 1 461 1 25 ASN QB 1 25 ASN HD22 2.610 . 3.420 3.258 3.159 3.466 0.046 17 0 "[ . 1 . 2 . ]" 1 462 1 25 ASN QB 1 26 VAL H 2.805 . 3.810 3.694 3.501 3.825 0.015 29 0 "[ . 1 . 2 . ]" 1 463 1 25 ASN QB 1 26 VAL MG1 2.905 . 4.010 3.096 2.813 3.359 . 0 0 "[ . 1 . 2 . ]" 1 464 1 25 ASN QB 1 26 VAL MG2 3.185 . 4.570 3.950 3.707 4.189 . 0 0 "[ . 1 . 2 . ]" 1 465 1 25 ASN HD21 1 26 VAL MG1 3.495 . 5.190 4.661 2.586 5.282 0.092 5 0 "[ . 1 . 2 . ]" 1 466 1 26 VAL H 1 26 VAL HB 2.880 . 3.960 3.953 3.919 3.985 0.025 25 0 "[ . 1 . 2 . ]" 1 467 1 26 VAL H 1 26 VAL MG1 2.580 . 3.360 3.240 3.094 3.320 . 0 0 "[ . 1 . 2 . ]" 1 468 1 26 VAL H 1 26 VAL MG2 2.185 . 2.570 2.469 2.403 2.575 0.005 25 0 "[ . 1 . 2 . ]" 1 469 1 26 VAL H 1 28 GLU QG 3.030 . 4.260 3.539 2.924 4.010 . 0 0 "[ . 1 . 2 . ]" 1 470 1 26 VAL H 1 31 VAL MG2 2.230 . 2.660 2.328 2.116 2.533 . 0 0 "[ . 1 . 2 . ]" 1 471 1 26 VAL HA 1 26 VAL HB 2.295 . 2.790 2.506 2.466 2.532 . 0 0 "[ . 1 . 2 . ]" 1 472 1 26 VAL HA 1 26 VAL MG1 2.150 . 2.500 2.390 2.344 2.418 . 0 0 "[ . 1 . 2 . ]" 1 473 1 26 VAL HA 1 26 VAL MG2 2.535 . 3.270 3.224 3.203 3.239 . 0 0 "[ . 1 . 2 . ]" 1 474 1 26 VAL HA 1 27 PHE H 2.405 . 3.010 2.775 2.646 2.878 . 0 0 "[ . 1 . 2 . ]" 1 475 1 26 VAL HA 1 28 GLU H 3.135 . 4.470 4.429 4.246 4.494 0.024 6 0 "[ . 1 . 2 . ]" 1 476 1 26 VAL HA 1 31 VAL MG2 3.120 . 4.440 4.360 4.177 4.497 0.057 10 0 "[ . 1 . 2 . ]" 1 477 1 26 VAL HB 1 27 PHE H 2.260 . 2.720 1.932 1.794 2.051 0.006 11 0 "[ . 1 . 2 . ]" 1 478 1 26 VAL MG1 1 27 PHE H 2.675 . 3.550 3.538 3.361 3.586 0.036 14 0 "[ . 1 . 2 . ]" 1 479 1 26 VAL MG1 1 28 GLU H 3.140 . 4.480 4.567 4.529 4.600 0.120 5 0 "[ . 1 . 2 . ]" 1 480 1 26 VAL MG2 1 27 PHE H 2.540 . 3.280 2.825 2.669 3.078 . 0 0 "[ . 1 . 2 . ]" 1 481 1 26 VAL MG2 1 28 GLU H 2.660 . 3.520 1.950 1.868 2.039 . 0 0 "[ . 1 . 2 . ]" 1 482 1 26 VAL MG2 1 28 GLU QG 2.370 . 2.940 1.987 1.889 2.372 . 0 0 "[ . 1 . 2 . ]" 1 483 1 26 VAL MG2 1 29 TYR H 3.405 . 5.010 4.987 4.824 5.042 0.032 23 0 "[ . 1 . 2 . ]" 1 484 1 27 PHE H 1 27 PHE HB2 2.450 . 3.100 2.791 2.559 2.883 . 0 0 "[ . 1 . 2 . ]" 1 485 1 27 PHE H 1 27 PHE HB3 2.740 . 3.680 3.705 3.675 3.733 0.053 5 0 "[ . 1 . 2 . ]" 1 486 1 27 PHE H 1 27 PHE QD 2.555 . 3.310 2.901 2.633 3.190 . 0 0 "[ . 1 . 2 . ]" 1 487 1 27 PHE H 1 27 PHE QE 3.205 . 4.610 4.471 4.328 4.611 0.001 29 0 "[ . 1 . 2 . ]" 1 488 1 27 PHE H 1 28 GLU H 2.415 . 3.030 2.923 2.759 3.045 0.015 16 0 "[ . 1 . 2 . ]" 1 489 1 27 PHE H 1 28 GLU HA 3.295 . 4.790 4.682 4.551 4.790 . 14 0 "[ . 1 . 2 . ]" 1 490 1 27 PHE H 1 28 GLU HB3 3.225 . 4.650 4.474 4.347 4.595 . 0 0 "[ . 1 . 2 . ]" 1 491 1 27 PHE H 1 28 GLU QG 3.400 . 5.000 4.472 4.321 4.665 . 0 0 "[ . 1 . 2 . ]" 1 492 1 27 PHE H 1 31 VAL MG1 3.110 . 4.420 4.130 3.969 4.223 . 0 0 "[ . 1 . 2 . ]" 1 493 1 27 PHE HA 1 27 PHE QD 2.540 . 3.280 2.608 2.376 2.873 . 0 0 "[ . 1 . 2 . ]" 1 494 1 27 PHE HA 1 27 PHE QE 3.225 . 4.650 4.583 4.514 4.655 0.005 5 0 "[ . 1 . 2 . ]" 1 495 1 27 PHE HA 1 28 GLU H 2.420 . 3.040 2.655 2.548 2.753 . 0 0 "[ . 1 . 2 . ]" 1 496 1 27 PHE HA 1 31 VAL MG1 2.575 . 3.350 2.152 1.966 2.292 . 0 0 "[ . 1 . 2 . ]" 1 497 1 27 PHE HA 1 31 VAL MG2 3.235 . 4.670 3.717 3.565 3.817 . 0 0 "[ . 1 . 2 . ]" 1 498 1 27 PHE HA 1 57 TRP HZ2 3.010 . 4.220 2.510 2.242 2.860 . 0 0 "[ . 1 . 2 . ]" 1 499 1 27 PHE HB2 1 28 GLU H 2.990 . 4.180 4.255 4.178 4.288 0.108 24 0 "[ . 1 . 2 . ]" 1 500 1 27 PHE HB2 1 57 TRP HE1 3.650 . 5.500 4.667 4.279 5.515 0.015 26 0 "[ . 1 . 2 . ]" 1 501 1 27 PHE HB2 1 57 TRP HZ2 3.130 . 4.460 3.715 3.536 4.230 . 0 0 "[ . 1 . 2 . ]" 1 502 1 27 PHE HB3 1 28 GLU H 3.200 . 4.600 4.411 4.335 4.467 . 0 0 "[ . 1 . 2 . ]" 1 503 1 27 PHE HB3 1 57 TRP HE1 3.110 . 4.420 3.259 2.930 3.904 . 0 0 "[ . 1 . 2 . ]" 1 504 1 27 PHE HB3 1 57 TRP HZ2 2.930 . 4.060 2.049 1.897 2.560 . 0 0 "[ . 1 . 2 . ]" 1 505 1 27 PHE QD 1 31 VAL MG1 3.030 . 4.260 3.790 3.602 3.973 . 0 0 "[ . 1 . 2 . ]" 1 506 1 27 PHE QD 1 31 VAL MG2 3.345 . 4.890 4.686 4.467 4.870 . 0 0 "[ . 1 . 2 . ]" 1 507 1 27 PHE QD 1 57 TRP HH2 2.930 . 4.060 2.985 2.757 3.182 . 0 0 "[ . 1 . 2 . ]" 1 508 1 27 PHE QE 1 31 VAL MG1 3.650 . 5.500 5.283 5.197 5.379 . 0 0 "[ . 1 . 2 . ]" 1 509 1 27 PHE QE 1 31 VAL MG2 3.650 . 5.500 5.541 5.398 5.613 0.113 16 0 "[ . 1 . 2 . ]" 1 510 1 28 GLU H 1 28 GLU HB2 2.790 . 3.780 3.662 3.533 3.722 . 0 0 "[ . 1 . 2 . ]" 1 511 1 28 GLU H 1 28 GLU HB3 2.425 . 3.050 2.724 2.614 2.807 . 0 0 "[ . 1 . 2 . ]" 1 512 1 28 GLU H 1 28 GLU QG 2.375 . 2.950 2.115 1.830 2.232 . 0 0 "[ . 1 . 2 . ]" 1 513 1 28 GLU H 1 29 TYR H 3.135 . 4.470 4.522 4.491 4.542 0.072 21 0 "[ . 1 . 2 . ]" 1 514 1 28 GLU H 1 31 VAL HB 2.835 . 3.870 3.466 3.298 3.683 . 0 0 "[ . 1 . 2 . ]" 1 515 1 28 GLU H 1 31 VAL MG1 2.255 . 2.710 2.436 2.284 2.554 . 0 0 "[ . 1 . 2 . ]" 1 516 1 28 GLU HA 1 28 GLU QG 2.640 . 3.480 3.351 3.316 3.368 . 0 0 "[ . 1 . 2 . ]" 1 517 1 28 GLU HA 1 29 TYR H 2.285 . 2.770 2.555 2.473 2.684 . 0 0 "[ . 1 . 2 . ]" 1 518 1 28 GLU HA 1 29 TYR HA 3.330 . 4.860 4.303 4.260 4.370 . 0 0 "[ . 1 . 2 . ]" 1 519 1 28 GLU HA 1 31 VAL MG1 2.895 . 3.990 4.037 3.985 4.062 0.072 23 0 "[ . 1 . 2 . ]" 1 520 1 28 GLU HB2 1 28 GLU QG 2.320 . 2.840 2.358 2.280 2.387 . 0 0 "[ . 1 . 2 . ]" 1 521 1 28 GLU HB2 1 29 TYR H 2.505 . 3.210 2.063 1.922 2.153 . 0 0 "[ . 1 . 2 . ]" 1 522 1 28 GLU HB2 1 31 VAL H 3.650 . 5.500 5.397 5.037 5.526 0.026 26 0 "[ . 1 . 2 . ]" 1 523 1 28 GLU HB3 1 29 TYR H 2.675 . 3.550 3.560 3.476 3.596 0.046 20 0 "[ . 1 . 2 . ]" 1 524 1 28 GLU HB3 1 31 VAL MG1 3.140 . 4.480 4.457 4.292 4.515 0.035 13 0 "[ . 1 . 2 . ]" 1 525 1 28 GLU QG 1 29 TYR H 2.620 . 3.440 3.118 2.863 3.321 . 0 0 "[ . 1 . 2 . ]" 1 526 1 28 GLU QG 1 30 GLY H 3.265 . 4.730 4.660 4.304 4.772 0.042 22 0 "[ . 1 . 2 . ]" 1 527 1 28 GLU QG 1 31 VAL H 2.960 . 4.120 3.381 3.117 3.610 . 0 0 "[ . 1 . 2 . ]" 1 528 1 28 GLU QG 1 31 VAL MG1 2.315 . 2.830 2.800 2.390 2.888 0.058 6 0 "[ . 1 . 2 . ]" 1 529 1 28 GLU QG 1 31 VAL MG2 2.745 . 3.690 3.400 2.869 3.586 . 0 0 "[ . 1 . 2 . ]" 1 530 1 29 TYR H 1 29 TYR HB2 2.490 . 3.180 2.328 2.280 2.384 . 0 0 "[ . 1 . 2 . ]" 1 531 1 29 TYR H 1 29 TYR HB3 2.685 . 3.570 3.584 3.546 3.612 0.042 17 0 "[ . 1 . 2 . ]" 1 532 1 29 TYR H 1 29 TYR QD 2.555 . 3.310 2.855 2.631 3.241 . 0 0 "[ . 1 . 2 . ]" 1 533 1 29 TYR H 1 29 TYR QE 3.470 . 5.140 4.882 4.657 5.154 0.014 21 0 "[ . 1 . 2 . ]" 1 534 1 29 TYR H 1 30 GLY H 3.180 . 4.560 4.534 4.479 4.564 0.004 23 0 "[ . 1 . 2 . ]" 1 535 1 29 TYR H 1 31 VAL MG1 3.125 . 4.450 4.443 4.328 4.491 0.041 17 0 "[ . 1 . 2 . ]" 1 536 1 29 TYR HA 1 29 TYR QD 2.515 . 3.230 2.759 2.447 3.025 . 0 0 "[ . 1 . 2 . ]" 1 537 1 29 TYR HA 1 29 TYR QE 3.200 . 4.600 4.450 4.327 4.550 . 0 0 "[ . 1 . 2 . ]" 1 538 1 29 TYR HA 1 30 GLY H 2.290 . 2.780 2.133 2.091 2.171 . 0 0 "[ . 1 . 2 . ]" 1 539 1 29 TYR HA 1 30 GLY HA2 3.155 . 4.510 4.365 4.337 4.408 . 0 0 "[ . 1 . 2 . ]" 1 540 1 29 TYR HA 1 31 VAL H 2.710 . 3.620 3.289 3.214 3.341 . 0 0 "[ . 1 . 2 . ]" 1 541 1 29 TYR HA 1 31 VAL MG1 2.780 . 3.760 3.719 3.611 3.788 0.028 27 0 "[ . 1 . 2 . ]" 1 542 1 29 TYR HA 1 52 CYS HB2 3.015 . 4.230 4.070 3.828 4.243 0.013 27 0 "[ . 1 . 2 . ]" 1 543 1 29 TYR HA 1 52 CYS HB3 3.045 . 4.290 2.658 2.374 3.118 . 0 0 "[ . 1 . 2 . ]" 1 544 1 29 TYR HB2 1 30 GLY H 3.090 . 4.380 4.216 4.113 4.340 . 0 0 "[ . 1 . 2 . ]" 1 545 1 29 TYR HB2 1 31 VAL H 3.650 . 5.500 5.472 5.332 5.542 0.042 24 0 "[ . 1 . 2 . ]" 1 546 1 29 TYR HB3 1 30 GLY H 2.600 . 3.400 3.106 2.955 3.295 . 0 0 "[ . 1 . 2 . ]" 1 547 1 29 TYR HB3 1 30 GLY HA2 3.625 . 5.450 4.417 4.325 4.506 . 0 0 "[ . 1 . 2 . ]" 1 548 1 29 TYR HB3 1 30 GLY HA3 3.650 . 5.500 4.127 4.045 4.208 . 0 0 "[ . 1 . 2 . ]" 1 549 1 29 TYR HB3 1 31 VAL H 3.480 . 5.160 5.002 4.898 5.089 . 0 0 "[ . 1 . 2 . ]" 1 550 1 29 TYR QD 1 30 GLY H 2.685 . 3.570 3.436 3.152 3.587 0.017 7 0 "[ . 1 . 2 . ]" 1 551 1 29 TYR QD 1 30 GLY HA2 3.650 . 5.500 5.147 4.956 5.265 . 0 0 "[ . 1 . 2 . ]" 1 552 1 29 TYR QD 1 30 GLY HA3 3.650 . 5.500 5.481 5.379 5.521 0.021 16 0 "[ . 1 . 2 . ]" 1 553 1 29 TYR QD 1 31 VAL H 3.650 . 5.500 5.397 5.147 5.503 0.003 14 0 "[ . 1 . 2 . ]" 1 554 1 29 TYR QD 1 53 ASP H 3.430 . 5.060 4.591 4.274 4.982 . 0 0 "[ . 1 . 2 . ]" 1 555 1 29 TYR QD 1 53 ASP HA 2.690 . 3.580 3.513 3.091 3.676 0.096 22 0 "[ . 1 . 2 . ]" 1 556 1 29 TYR QD 1 54 THR H 3.105 . 4.410 4.227 3.958 4.421 0.011 14 0 "[ . 1 . 2 . ]" 1 557 1 29 TYR QD 1 54 THR HA 2.815 . 3.830 2.966 2.561 3.465 . 0 0 "[ . 1 . 2 . ]" 1 558 1 29 TYR QD 1 55 ASP H 3.650 . 5.500 5.192 4.667 5.520 0.020 7 0 "[ . 1 . 2 . ]" 1 559 1 29 TYR QD 1 56 GLY H 3.460 . 5.120 4.485 4.079 5.062 . 0 0 "[ . 1 . 2 . ]" 1 560 1 29 TYR QE 1 30 GLY H 3.650 . 5.500 5.507 5.347 5.558 0.058 24 0 "[ . 1 . 2 . ]" 1 561 1 29 TYR QE 1 53 ASP H 3.605 . 5.410 4.945 4.530 5.215 . 0 0 "[ . 1 . 2 . ]" 1 562 1 29 TYR QE 1 54 THR H 3.080 . 4.360 4.367 4.203 4.443 0.083 5 0 "[ . 1 . 2 . ]" 1 563 1 29 TYR QE 1 54 THR HA 2.510 . 3.220 2.185 1.975 2.542 . 0 0 "[ . 1 . 2 . ]" 1 564 1 29 TYR QE 1 54 THR MG 3.260 . 4.720 4.672 4.534 4.793 0.073 27 0 "[ . 1 . 2 . ]" 1 565 1 29 TYR QE 1 55 ASP H 3.175 . 4.550 4.186 3.733 4.535 . 0 0 "[ . 1 . 2 . ]" 1 566 1 29 TYR QE 1 56 GLY H 3.015 . 4.230 3.264 2.762 3.746 . 0 0 "[ . 1 . 2 . ]" 1 567 1 30 GLY H 1 31 VAL H 2.465 . 3.130 2.437 2.332 2.569 . 0 0 "[ . 1 . 2 . ]" 1 568 1 30 GLY H 1 31 VAL HB 3.605 . 5.410 5.102 4.974 5.288 . 0 0 "[ . 1 . 2 . ]" 1 569 1 30 GLY H 1 31 VAL MG1 3.265 . 4.730 3.861 3.761 3.972 . 0 0 "[ . 1 . 2 . ]" 1 570 1 30 GLY H 1 51 GLU QG 3.300 . 4.800 4.351 4.006 4.711 . 0 0 "[ . 1 . 2 . ]" 1 571 1 30 GLY H 1 52 CYS HB2 3.015 . 4.230 4.173 3.904 4.260 0.030 24 0 "[ . 1 . 2 . ]" 1 572 1 30 GLY H 1 52 CYS HB3 2.900 . 4.000 2.453 2.172 2.588 . 0 0 "[ . 1 . 2 . ]" 1 573 1 30 GLY H 1 53 ASP HA 2.935 . 4.070 3.805 3.448 4.099 0.029 12 0 "[ . 1 . 2 . ]" 1 574 1 30 GLY HA2 1 31 VAL MG1 3.570 . 5.340 4.946 4.870 5.026 . 0 0 "[ . 1 . 2 . ]" 1 575 1 30 GLY HA2 1 51 GLU HG2 3.650 . 5.500 4.089 3.686 4.649 . 0 0 "[ . 1 . 2 . ]" 1 576 1 30 GLY HA2 1 51 GLU QG 3.225 . 4.650 3.671 3.413 3.928 . 0 0 "[ . 1 . 2 . ]" 1 577 1 30 GLY HA2 1 51 GLU HG3 3.650 . 5.500 4.171 3.888 4.558 . 0 0 "[ . 1 . 2 . ]" 1 578 1 30 GLY HA2 1 52 CYS H 3.465 . 5.130 4.590 4.331 4.798 . 0 0 "[ . 1 . 2 . ]" 1 579 1 30 GLY HA2 1 52 CYS HB3 3.650 . 5.500 4.300 4.098 4.463 . 0 0 "[ . 1 . 2 . ]" 1 580 1 30 GLY HA3 1 31 VAL H 2.680 . 3.560 3.311 3.237 3.398 . 0 0 "[ . 1 . 2 . ]" 1 581 1 30 GLY HA3 1 31 VAL MG1 3.545 . 5.290 4.936 4.846 5.018 . 0 0 "[ . 1 . 2 . ]" 1 582 1 30 GLY HA3 1 51 GLU QG 3.570 . 5.340 5.095 4.820 5.384 0.044 29 0 "[ . 1 . 2 . ]" 1 583 1 30 GLY HA3 1 52 CYS HB3 3.650 . 5.500 5.005 4.853 5.161 . 0 0 "[ . 1 . 2 . ]" 1 584 1 31 VAL H 1 31 VAL HB 2.350 . 2.900 2.781 2.685 2.883 . 0 0 "[ . 1 . 2 . ]" 1 585 1 31 VAL H 1 31 VAL MG1 2.205 . 2.610 2.107 2.030 2.169 . 0 0 "[ . 1 . 2 . ]" 1 586 1 31 VAL H 1 32 LYS H 3.255 . 4.710 4.489 4.412 4.564 . 0 0 "[ . 1 . 2 . ]" 1 587 1 31 VAL H 1 32 LYS HA 3.650 . 5.500 5.097 4.906 5.261 . 0 0 "[ . 1 . 2 . ]" 1 588 1 31 VAL H 1 32 LYS HG3 3.485 . 5.170 5.047 4.754 5.251 0.081 5 0 "[ . 1 . 2 . ]" 1 589 1 31 VAL H 1 51 GLU HA 3.650 . 5.500 5.318 5.152 5.504 0.004 2 0 "[ . 1 . 2 . ]" 1 590 1 31 VAL H 1 52 CYS H 3.075 . 4.350 3.585 3.404 3.734 . 0 0 "[ . 1 . 2 . ]" 1 591 1 31 VAL H 1 52 CYS HB2 2.790 . 3.780 3.837 3.796 3.864 0.084 28 0 "[ . 1 . 2 . ]" 1 592 1 31 VAL H 1 52 CYS HB3 3.290 . 4.780 2.556 2.250 2.852 . 0 0 "[ . 1 . 2 . ]" 1 593 1 31 VAL H 1 57 TRP HH2 3.650 . 5.500 5.043 4.840 5.197 . 0 0 "[ . 1 . 2 . ]" 1 594 1 31 VAL H 1 57 TRP HZ3 3.550 . 5.300 4.982 4.802 5.190 . 0 0 "[ . 1 . 2 . ]" 1 595 1 31 VAL HA 1 31 VAL MG1 2.505 . 3.210 3.206 3.193 3.217 0.007 8 0 "[ . 1 . 2 . ]" 1 596 1 31 VAL HA 1 31 VAL MG2 2.315 . 2.830 2.382 2.343 2.421 . 0 0 "[ . 1 . 2 . ]" 1 597 1 31 VAL HA 1 32 LYS H 2.165 . 2.530 2.204 2.142 2.258 . 0 0 "[ . 1 . 2 . ]" 1 598 1 31 VAL HA 1 32 LYS HA 3.180 . 4.560 4.349 4.320 4.374 . 0 0 "[ . 1 . 2 . ]" 1 599 1 31 VAL HA 1 32 LYS HG3 3.255 . 4.710 3.460 3.204 3.721 . 0 0 "[ . 1 . 2 . ]" 1 600 1 31 VAL HA 1 52 CYS H 3.470 . 5.140 4.788 4.740 4.839 . 0 0 "[ . 1 . 2 . ]" 1 601 1 31 VAL HB 1 32 LYS H 2.960 . 4.120 4.024 3.985 4.061 . 0 0 "[ . 1 . 2 . ]" 1 602 1 31 VAL HB 1 57 TRP HH2 3.500 . 5.200 4.706 4.590 4.786 . 0 0 "[ . 1 . 2 . ]" 1 603 1 31 VAL MG1 1 32 LYS H 2.765 . 3.730 3.606 3.503 3.724 . 0 0 "[ . 1 . 2 . ]" 1 604 1 31 VAL MG1 1 32 LYS HA 2.935 . 4.070 3.845 3.720 4.014 . 0 0 "[ . 1 . 2 . ]" 1 605 1 31 VAL MG1 1 33 ALA H 2.990 . 4.180 4.129 3.930 4.208 0.028 17 0 "[ . 1 . 2 . ]" 1 606 1 31 VAL MG1 1 51 GLU HA 3.330 . 4.860 4.614 4.455 4.873 0.013 2 0 "[ . 1 . 2 . ]" 1 607 1 31 VAL MG1 1 52 CYS H 2.710 . 3.620 3.423 3.302 3.556 . 0 0 "[ . 1 . 2 . ]" 1 608 1 31 VAL MG1 1 52 CYS HB2 2.895 . 3.990 2.882 2.608 3.020 . 0 0 "[ . 1 . 2 . ]" 1 609 1 31 VAL MG1 1 57 TRP HE3 3.520 . 5.240 4.494 4.410 4.631 . 0 0 "[ . 1 . 2 . ]" 1 610 1 31 VAL MG1 1 57 TRP HH2 2.690 . 3.580 1.943 1.871 2.012 . 0 0 "[ . 1 . 2 . ]" 1 611 1 31 VAL MG1 1 57 TRP HZ2 3.180 . 4.560 3.363 3.238 3.533 . 0 0 "[ . 1 . 2 . ]" 1 612 1 31 VAL MG1 1 57 TRP HZ3 2.980 . 4.160 2.726 2.613 2.939 . 0 0 "[ . 1 . 2 . ]" 1 613 1 31 VAL MG2 1 32 LYS H 2.300 . 2.800 2.271 2.189 2.351 . 0 0 "[ . 1 . 2 . ]" 1 614 1 31 VAL MG2 1 33 ALA H 3.300 . 4.800 4.224 3.994 4.413 . 0 0 "[ . 1 . 2 . ]" 1 615 1 31 VAL MG2 1 33 ALA HA 3.020 . 4.240 3.927 3.737 4.127 . 0 0 "[ . 1 . 2 . ]" 1 616 1 31 VAL MG2 1 52 CYS H 3.380 . 4.960 4.930 4.840 4.999 0.039 29 0 "[ . 1 . 2 . ]" 1 617 1 31 VAL MG2 1 57 TRP HH2 2.530 . 3.260 3.190 3.076 3.276 0.016 5 0 "[ . 1 . 2 . ]" 1 618 1 31 VAL MG2 1 57 TRP HZ3 3.070 . 4.340 3.876 3.644 4.043 . 0 0 "[ . 1 . 2 . ]" 1 619 1 32 LYS H 1 32 LYS HB2 2.510 . 3.220 2.500 2.444 2.574 . 0 0 "[ . 1 . 2 . ]" 1 620 1 32 LYS H 1 32 LYS HB3 2.840 . 3.880 3.655 3.631 3.708 . 0 0 "[ . 1 . 2 . ]" 1 621 1 32 LYS H 1 32 LYS QD 3.015 . 4.230 3.732 3.556 3.848 . 0 0 "[ . 1 . 2 . ]" 1 622 1 32 LYS H 1 32 LYS QE 3.355 . 4.910 4.807 4.565 4.915 0.005 10 0 "[ . 1 . 2 . ]" 1 623 1 32 LYS H 1 32 LYS HG2 3.105 . 4.410 3.928 3.797 4.089 . 0 0 "[ . 1 . 2 . ]" 1 624 1 32 LYS H 1 32 LYS HG3 2.720 . 3.640 2.650 2.445 2.803 . 0 0 "[ . 1 . 2 . ]" 1 625 1 32 LYS H 1 33 ALA H 3.045 . 4.290 4.236 4.148 4.307 0.017 5 0 "[ . 1 . 2 . ]" 1 626 1 32 LYS H 1 34 VAL QG 3.620 . 5.440 4.394 4.013 4.586 . 0 0 "[ . 1 . 2 . ]" 1 627 1 32 LYS H 1 51 GLU HA 3.285 . 4.770 4.676 4.568 4.770 . 0 0 "[ . 1 . 2 . ]" 1 628 1 32 LYS H 1 51 GLU QG 3.570 . 5.340 4.716 4.195 5.196 . 0 0 "[ . 1 . 2 . ]" 1 629 1 32 LYS H 1 52 CYS H 3.475 . 5.150 4.798 4.685 4.891 . 0 0 "[ . 1 . 2 . ]" 1 630 1 32 LYS H 1 57 TRP HZ3 3.240 . 4.680 4.457 4.298 4.567 . 0 0 "[ . 1 . 2 . ]" 1 631 1 32 LYS HA 1 32 LYS HD2 3.455 . 5.110 4.881 4.625 4.972 . 0 0 "[ . 1 . 2 . ]" 1 632 1 32 LYS HA 1 32 LYS QD 3.130 . 4.460 4.203 4.027 4.267 . 0 0 "[ . 1 . 2 . ]" 1 633 1 32 LYS HA 1 32 LYS HD3 3.455 . 5.110 4.587 4.430 4.645 . 0 0 "[ . 1 . 2 . ]" 1 634 1 32 LYS HA 1 32 LYS QE 3.650 . 5.500 4.143 4.020 4.566 . 0 0 "[ . 1 . 2 . ]" 1 635 1 32 LYS HA 1 32 LYS HG2 2.820 . 3.840 2.708 2.615 2.804 . 0 0 "[ . 1 . 2 . ]" 1 636 1 32 LYS HA 1 32 LYS HG3 2.895 . 3.990 2.936 2.817 3.013 . 0 0 "[ . 1 . 2 . ]" 1 637 1 32 LYS HA 1 33 ALA H 2.360 . 2.920 2.073 2.039 2.108 . 0 0 "[ . 1 . 2 . ]" 1 638 1 32 LYS HA 1 33 ALA MB 2.960 . 4.120 3.961 3.902 4.021 . 0 0 "[ . 1 . 2 . ]" 1 639 1 32 LYS HA 1 34 VAL QG 3.310 . 4.820 4.245 3.928 4.477 . 0 0 "[ . 1 . 2 . ]" 1 640 1 32 LYS HA 1 49 TYR QD 3.635 . 5.470 3.705 3.418 4.032 . 0 0 "[ . 1 . 2 . ]" 1 641 1 32 LYS HA 1 50 ARG H 3.055 . 4.310 4.133 3.886 4.298 . 0 0 "[ . 1 . 2 . ]" 1 642 1 32 LYS HA 1 51 GLU HB2 3.060 . 4.320 3.892 3.501 4.247 . 0 0 "[ . 1 . 2 . ]" 1 643 1 32 LYS HA 1 51 GLU HB3 3.465 . 5.130 4.960 4.663 5.150 0.020 27 0 "[ . 1 . 2 . ]" 1 644 1 32 LYS HA 1 52 CYS H 2.660 . 3.520 3.125 2.868 3.229 . 0 0 "[ . 1 . 2 . ]" 1 645 1 32 LYS HA 1 57 TRP HZ3 2.870 . 3.940 2.658 2.376 2.828 . 0 0 "[ . 1 . 2 . ]" 1 646 1 32 LYS HB2 1 32 LYS QD 2.605 . 3.410 2.268 2.116 2.370 . 0 0 "[ . 1 . 2 . ]" 1 647 1 32 LYS HB2 1 32 LYS QE 2.850 . 3.900 2.801 2.590 3.743 . 0 0 "[ . 1 . 2 . ]" 1 648 1 32 LYS HB2 1 33 ALA H 3.200 . 4.600 4.159 3.927 4.252 . 0 0 "[ . 1 . 2 . ]" 1 649 1 32 LYS HB2 1 34 VAL QG 2.560 . 3.320 2.746 2.105 2.971 . 0 0 "[ . 1 . 2 . ]" 1 650 1 32 LYS HB3 1 33 ALA H 2.820 . 3.840 3.367 2.997 3.583 . 0 0 "[ . 1 . 2 . ]" 1 651 1 32 LYS HB3 1 34 VAL H 3.390 . 4.980 4.510 3.742 4.832 . 0 0 "[ . 1 . 2 . ]" 1 652 1 32 LYS HB3 1 34 VAL QG 2.620 . 3.440 2.719 2.093 3.010 . 0 0 "[ . 1 . 2 . ]" 1 653 1 32 LYS HB3 1 50 ARG H 3.145 . 4.490 4.082 3.578 4.340 . 0 0 "[ . 1 . 2 . ]" 1 654 1 32 LYS HB3 1 52 CYS H 3.620 . 5.440 5.332 5.120 5.452 0.012 22 0 "[ . 1 . 2 . ]" 1 655 1 32 LYS QD 1 34 VAL QG 3.120 . 4.440 3.753 2.318 4.053 . 0 0 "[ . 1 . 2 . ]" 1 656 1 32 LYS QD 1 49 TYR QD 3.070 . 4.340 4.294 3.370 4.388 0.048 3 0 "[ . 1 . 2 . ]" 1 657 1 32 LYS QD 1 51 GLU HB2 3.570 . 5.340 4.263 3.874 4.615 . 0 0 "[ . 1 . 2 . ]" 1 658 1 32 LYS HD2 1 32 LYS QE 2.350 . 2.900 2.390 2.288 2.472 . 0 0 "[ . 1 . 2 . ]" 1 659 1 32 LYS HD2 1 49 TYR QD 3.440 . 5.080 4.840 4.520 5.103 0.023 16 0 "[ . 1 . 2 . ]" 1 660 1 32 LYS HD3 1 32 LYS QE 2.350 . 2.900 2.273 2.142 2.360 . 0 0 "[ . 1 . 2 . ]" 1 661 1 32 LYS HD3 1 49 TYR QD 3.440 . 5.080 4.850 3.434 5.084 0.004 26 0 "[ . 1 . 2 . ]" 1 662 1 32 LYS QE 1 32 LYS HG2 2.575 . 3.350 2.388 2.308 2.469 . 0 0 "[ . 1 . 2 . ]" 1 663 1 32 LYS QE 1 32 LYS HG3 2.580 . 3.360 3.304 2.283 3.399 0.039 3 0 "[ . 1 . 2 . ]" 1 664 1 32 LYS QE 1 34 VAL QG 2.740 . 3.680 3.007 2.458 3.908 0.228 5 0 "[ . 1 . 2 . ]" 1 665 1 32 LYS QE 1 49 TYR QD 3.035 . 4.270 2.681 2.407 3.724 . 0 0 "[ . 1 . 2 . ]" 1 666 1 32 LYS QE 1 49 TYR QE 2.705 . 3.610 3.014 2.575 3.469 . 0 0 "[ . 1 . 2 . ]" 1 667 1 32 LYS QE 1 51 GLU HB2 2.705 . 3.610 3.448 3.019 3.657 0.047 3 0 "[ . 1 . 2 . ]" 1 668 1 32 LYS QE 1 51 GLU HB3 3.650 . 5.500 5.028 4.612 5.271 . 0 0 "[ . 1 . 2 . ]" 1 669 1 32 LYS QE 1 51 GLU QG 2.990 . 4.180 4.035 2.946 4.211 0.031 6 0 "[ . 1 . 2 . ]" 1 670 1 32 LYS HG2 1 33 ALA H 3.420 . 5.040 4.517 4.293 4.747 . 0 0 "[ . 1 . 2 . ]" 1 671 1 32 LYS HG2 1 49 TYR QD 2.905 . 4.010 3.071 2.922 3.196 . 0 0 "[ . 1 . 2 . ]" 1 672 1 32 LYS HG2 1 49 TYR QE 3.080 . 4.360 3.706 3.449 4.103 . 0 0 "[ . 1 . 2 . ]" 1 673 1 32 LYS HG2 1 51 GLU HA 2.990 . 4.180 2.816 2.465 3.184 . 0 0 "[ . 1 . 2 . ]" 1 674 1 32 LYS HG2 1 51 GLU HB2 2.735 . 3.670 2.566 2.304 2.782 . 0 0 "[ . 1 . 2 . ]" 1 675 1 32 LYS HG2 1 51 GLU HB3 3.100 . 4.400 4.086 3.843 4.301 . 0 0 "[ . 1 . 2 . ]" 1 676 1 32 LYS HG2 1 51 GLU QG 2.940 . 4.080 2.276 2.006 2.687 . 0 0 "[ . 1 . 2 . ]" 1 677 1 32 LYS HG3 1 33 ALA H 3.395 . 4.990 4.922 4.802 5.004 0.014 10 0 "[ . 1 . 2 . ]" 1 678 1 32 LYS HG3 1 49 TYR QD 3.225 . 4.650 4.642 4.550 4.687 0.037 15 0 "[ . 1 . 2 . ]" 1 679 1 32 LYS HG3 1 51 GLU HB2 3.115 . 4.430 4.150 3.872 4.397 . 0 0 "[ . 1 . 2 . ]" 1 680 1 32 LYS HG3 1 51 GLU QG 3.270 . 4.740 2.785 2.441 3.375 . 0 0 "[ . 1 . 2 . ]" 1 681 1 32 LYS HG3 1 52 CYS H 3.115 . 4.430 4.410 4.051 4.535 0.105 6 0 "[ . 1 . 2 . ]" 1 682 1 33 ALA H 1 33 ALA MB 2.355 . 2.910 2.281 2.254 2.308 . 0 0 "[ . 1 . 2 . ]" 1 683 1 33 ALA H 1 49 TYR HA 3.510 . 5.220 4.702 4.412 4.921 . 0 0 "[ . 1 . 2 . ]" 1 684 1 33 ALA H 1 49 TYR HB2 3.330 . 4.860 3.914 3.645 4.182 . 0 0 "[ . 1 . 2 . ]" 1 685 1 33 ALA H 1 49 TYR QD 3.650 . 5.500 4.168 3.933 4.431 . 0 0 "[ . 1 . 2 . ]" 1 686 1 33 ALA H 1 50 ARG H 2.595 . 3.390 2.785 2.586 2.970 . 0 0 "[ . 1 . 2 . ]" 1 687 1 33 ALA H 1 50 ARG HB2 2.850 . 3.900 3.234 3.033 3.375 . 0 0 "[ . 1 . 2 . ]" 1 688 1 33 ALA H 1 50 ARG HB3 3.265 . 4.730 4.524 4.382 4.604 . 0 0 "[ . 1 . 2 . ]" 1 689 1 33 ALA H 1 51 GLU HA 2.775 . 3.750 3.278 2.995 3.512 . 0 0 "[ . 1 . 2 . ]" 1 690 1 33 ALA H 1 51 GLU HB2 3.650 . 5.500 5.145 4.855 5.462 . 0 0 "[ . 1 . 2 . ]" 1 691 1 33 ALA H 1 52 CYS H 3.050 . 4.300 4.224 4.012 4.320 0.020 28 0 "[ . 1 . 2 . ]" 1 692 1 33 ALA H 1 52 CYS HB2 3.630 . 5.460 5.383 5.114 5.487 0.027 18 0 "[ . 1 . 2 . ]" 1 693 1 33 ALA H 1 57 TRP HE3 3.485 . 5.170 3.524 3.321 3.706 . 0 0 "[ . 1 . 2 . ]" 1 694 1 33 ALA H 1 57 TRP HH2 3.060 . 4.320 3.909 3.702 4.113 . 0 0 "[ . 1 . 2 . ]" 1 695 1 33 ALA H 1 57 TRP HZ3 2.550 . 3.300 2.079 1.959 2.241 . 0 0 "[ . 1 . 2 . ]" 1 696 1 33 ALA HA 1 34 VAL H 2.260 . 2.720 2.199 2.102 2.248 . 0 0 "[ . 1 . 2 . ]" 1 697 1 33 ALA HA 1 34 VAL QG 2.965 . 4.130 3.627 3.321 3.927 . 0 0 "[ . 1 . 2 . ]" 1 698 1 33 ALA HA 1 50 ARG H 3.370 . 4.940 4.349 4.222 4.434 . 0 0 "[ . 1 . 2 . ]" 1 699 1 33 ALA HA 1 50 ARG HB2 3.650 . 5.500 4.991 4.901 5.103 . 0 0 "[ . 1 . 2 . ]" 1 700 1 33 ALA HA 1 57 TRP HZ3 3.650 . 5.500 4.033 3.839 4.153 . 0 0 "[ . 1 . 2 . ]" 1 701 1 33 ALA MB 1 34 VAL H 2.695 . 3.590 3.536 3.441 3.582 . 0 0 "[ . 1 . 2 . ]" 1 702 1 33 ALA MB 1 35 TYR H 3.520 . 5.240 4.699 4.470 4.882 . 0 0 "[ . 1 . 2 . ]" 1 703 1 33 ALA MB 1 49 TYR HA 3.030 . 4.260 4.080 3.960 4.286 0.026 5 0 "[ . 1 . 2 . ]" 1 704 1 33 ALA MB 1 50 ARG H 2.470 . 3.140 2.712 2.570 2.892 . 0 0 "[ . 1 . 2 . ]" 1 705 1 33 ALA MB 1 50 ARG HB2 2.820 . 3.840 2.083 2.013 2.150 . 0 0 "[ . 1 . 2 . ]" 1 706 1 33 ALA MB 1 50 ARG HB3 3.420 . 5.040 3.674 3.585 3.741 . 0 0 "[ . 1 . 2 . ]" 1 707 1 33 ALA MB 1 50 ARG HD2 3.570 . 5.340 4.410 4.027 4.651 . 0 0 "[ . 1 . 2 . ]" 1 708 1 33 ALA MB 1 50 ARG HD3 2.760 . 3.720 3.241 2.958 3.479 . 0 0 "[ . 1 . 2 . ]" 1 709 1 33 ALA MB 1 50 ARG HE 3.260 . 4.720 4.819 4.764 4.917 0.197 6 0 "[ . 1 . 2 . ]" 1 710 1 33 ALA MB 1 52 CYS H 3.485 . 5.170 5.126 4.895 5.196 0.026 29 0 "[ . 1 . 2 . ]" 1 711 1 33 ALA MB 1 57 TRP HE1 3.550 . 5.300 5.268 5.076 5.348 0.048 23 0 "[ . 1 . 2 . ]" 1 712 1 33 ALA MB 1 57 TRP HE3 3.360 . 4.920 3.419 3.229 3.603 . 0 0 "[ . 1 . 2 . ]" 1 713 1 33 ALA MB 1 57 TRP HH2 2.575 . 3.350 2.797 2.549 2.951 . 0 0 "[ . 1 . 2 . ]" 1 714 1 33 ALA MB 1 57 TRP HZ2 3.430 . 5.060 3.930 3.768 4.062 . 0 0 "[ . 1 . 2 . ]" 1 715 1 33 ALA MB 1 57 TRP HZ3 2.590 . 3.380 2.643 2.539 2.838 . 0 0 "[ . 1 . 2 . ]" 1 716 1 34 VAL H 1 34 VAL HB 2.740 . 3.680 2.849 2.217 3.703 0.023 15 0 "[ . 1 . 2 . ]" 1 717 1 34 VAL H 1 34 VAL MG1 2.570 . 3.340 3.147 2.457 3.583 0.243 22 0 "[ . 1 . 2 . ]" 1 718 1 34 VAL H 1 34 VAL QG 2.200 . 2.600 2.129 1.780 2.487 0.020 25 0 "[ . 1 . 2 . ]" 1 719 1 34 VAL H 1 34 VAL MG2 2.570 . 3.340 2.170 1.813 2.540 . 0 0 "[ . 1 . 2 . ]" 1 720 1 34 VAL H 1 35 TYR H 3.280 . 4.760 4.256 4.140 4.413 . 0 0 "[ . 1 . 2 . ]" 1 721 1 34 VAL H 1 35 TYR HA 3.605 . 5.410 4.975 4.877 5.078 . 0 0 "[ . 1 . 2 . ]" 1 722 1 34 VAL H 1 49 TYR HA 3.365 . 4.930 4.418 4.185 4.589 . 0 0 "[ . 1 . 2 . ]" 1 723 1 34 VAL HA 1 34 VAL MG1 2.675 . 3.550 2.402 2.325 2.499 . 0 0 "[ . 1 . 2 . ]" 1 724 1 34 VAL HA 1 34 VAL QG 2.200 . 2.600 2.201 2.099 2.403 . 0 0 "[ . 1 . 2 . ]" 1 725 1 34 VAL HA 1 34 VAL MG2 2.675 . 3.550 2.660 2.286 3.126 . 0 0 "[ . 1 . 2 . ]" 1 726 1 34 VAL HA 1 35 TYR H 2.440 . 3.080 2.080 1.964 2.149 . 0 0 "[ . 1 . 2 . ]" 1 727 1 34 VAL HA 1 49 TYR H 3.200 . 4.600 4.568 4.412 4.676 0.076 20 0 "[ . 1 . 2 . ]" 1 728 1 34 VAL HA 1 49 TYR HA 2.840 . 3.880 2.077 1.795 2.328 0.005 2 0 "[ . 1 . 2 . ]" 1 729 1 34 VAL HA 1 50 ARG H 2.905 . 4.010 3.571 3.146 3.754 . 0 0 "[ . 1 . 2 . ]" 1 730 1 34 VAL HB 1 35 TYR H 3.190 . 4.580 3.984 3.369 4.379 . 0 0 "[ . 1 . 2 . ]" 1 731 1 34 VAL QG 1 35 TYR H 2.925 . 4.050 3.177 2.825 3.575 . 0 0 "[ . 1 . 2 . ]" 1 732 1 34 VAL QG 1 48 ASN HD21 2.680 . 3.560 2.639 1.871 3.572 0.012 5 0 "[ . 1 . 2 . ]" 1 733 1 34 VAL QG 1 49 TYR HA 2.695 . 3.590 3.310 2.980 3.487 . 0 0 "[ . 1 . 2 . ]" 1 734 1 34 VAL QG 1 49 TYR HB2 2.520 . 3.240 2.357 2.002 2.654 . 0 0 "[ . 1 . 2 . ]" 1 735 1 34 VAL QG 1 49 TYR HB3 2.660 . 3.520 2.134 1.882 2.459 . 0 0 "[ . 1 . 2 . ]" 1 736 1 34 VAL QG 1 49 TYR QD 2.810 . 3.820 3.543 3.317 3.845 0.025 27 0 "[ . 1 . 2 . ]" 1 737 1 34 VAL QG 1 50 ARG H 2.955 . 4.110 4.004 3.735 4.157 0.047 20 0 "[ . 1 . 2 . ]" 1 738 1 34 VAL MG1 1 48 ASN HD21 2.935 . 4.070 2.767 1.877 4.003 . 0 0 "[ . 1 . 2 . ]" 1 739 1 34 VAL MG1 1 48 ASN HD22 2.755 . 3.710 2.601 2.009 3.173 . 0 0 "[ . 1 . 2 . ]" 1 740 1 34 VAL MG1 1 49 TYR HA 3.050 . 4.300 3.682 3.019 4.138 . 0 0 "[ . 1 . 2 . ]" 1 741 1 34 VAL MG2 1 48 ASN HD21 2.935 . 4.070 3.902 3.465 4.148 0.078 18 0 "[ . 1 . 2 . ]" 1 742 1 34 VAL MG2 1 48 ASN HD22 2.755 . 3.710 3.558 3.101 3.836 0.126 8 0 "[ . 1 . 2 . ]" 1 743 1 34 VAL MG2 1 49 TYR HA 3.050 . 4.300 4.070 3.503 4.638 0.338 1 0 "[ . 1 . 2 . ]" 1 744 1 35 TYR H 1 35 TYR HB2 2.795 . 3.790 2.264 2.065 2.405 . 0 0 "[ . 1 . 2 . ]" 1 745 1 35 TYR H 1 35 TYR QB 2.550 . 3.300 2.207 2.048 2.314 . 0 0 "[ . 1 . 2 . ]" 1 746 1 35 TYR H 1 35 TYR HB3 2.795 . 3.790 3.363 2.285 3.591 . 0 0 "[ . 1 . 2 . ]" 1 747 1 35 TYR H 1 36 THR H 3.360 . 4.920 4.514 4.454 4.597 . 0 0 "[ . 1 . 2 . ]" 1 748 1 35 TYR H 1 43 LEU MD1 3.650 . 5.500 4.903 3.679 5.575 0.075 2 0 "[ . 1 . 2 . ]" 1 749 1 35 TYR H 1 43 LEU QD 3.160 . 4.520 4.098 3.627 4.543 0.023 23 0 "[ . 1 . 2 . ]" 1 750 1 35 TYR H 1 43 LEU MD2 3.650 . 5.500 4.843 3.939 5.578 0.078 15 0 "[ . 1 . 2 . ]" 1 751 1 35 TYR H 1 48 ASN H 3.650 . 5.500 5.549 5.469 5.599 0.099 17 0 "[ . 1 . 2 . ]" 1 752 1 35 TYR H 1 48 ASN HB2 3.090 . 4.380 3.931 3.703 4.097 . 0 0 "[ . 1 . 2 . ]" 1 753 1 35 TYR H 1 48 ASN HB3 3.650 . 5.500 5.418 5.293 5.574 0.074 22 0 "[ . 1 . 2 . ]" 1 754 1 35 TYR H 1 48 ASN HD21 3.325 . 4.850 3.377 2.856 4.308 . 0 0 "[ . 1 . 2 . ]" 1 755 1 35 TYR H 1 48 ASN HD22 3.510 . 5.220 4.608 3.988 5.174 . 0 0 "[ . 1 . 2 . ]" 1 756 1 35 TYR H 1 49 TYR H 3.265 . 4.730 4.533 4.434 4.636 . 0 0 "[ . 1 . 2 . ]" 1 757 1 35 TYR H 1 49 TYR HA 2.825 . 3.850 2.542 2.346 2.790 . 0 0 "[ . 1 . 2 . ]" 1 758 1 35 TYR H 1 49 TYR HB2 3.445 . 5.090 4.422 4.242 4.713 . 0 0 "[ . 1 . 2 . ]" 1 759 1 35 TYR H 1 49 TYR HB3 3.170 . 4.540 3.953 3.685 4.312 . 0 0 "[ . 1 . 2 . ]" 1 760 1 35 TYR H 1 50 ARG H 3.515 . 5.230 4.493 4.374 4.640 . 0 0 "[ . 1 . 2 . ]" 1 761 1 35 TYR H 1 62 PRO QD 3.575 . 5.350 4.410 4.139 4.733 . 0 0 "[ . 1 . 2 . ]" 1 762 1 35 TYR H 1 62 PRO HG2 3.395 . 4.990 4.217 2.940 4.712 . 0 0 "[ . 1 . 2 . ]" 1 763 1 35 TYR H 1 62 PRO HG3 2.890 . 3.980 3.592 3.313 4.061 0.081 17 0 "[ . 1 . 2 . ]" 1 764 1 35 TYR HA 1 36 THR H 2.505 . 3.210 2.182 2.114 2.279 . 0 0 "[ . 1 . 2 . ]" 1 765 1 35 TYR HA 1 36 THR HA 3.150 . 4.500 4.343 4.296 4.433 . 0 0 "[ . 1 . 2 . ]" 1 766 1 35 TYR HA 1 36 THR HB 3.285 . 4.770 4.480 4.321 4.671 . 0 0 "[ . 1 . 2 . ]" 1 767 1 35 TYR HA 1 36 THR MG 3.000 . 4.200 3.484 3.295 3.701 . 0 0 "[ . 1 . 2 . ]" 1 768 1 35 TYR QB 1 36 THR H 2.795 . 3.790 3.009 2.750 3.686 . 0 0 "[ . 1 . 2 . ]" 1 769 1 35 TYR QB 1 36 THR MG 3.570 . 5.340 4.641 4.473 5.012 . 0 0 "[ . 1 . 2 . ]" 1 770 1 35 TYR QB 1 43 LEU QD 2.700 . 3.600 2.673 2.194 3.275 . 0 0 "[ . 1 . 2 . ]" 1 771 1 35 TYR QB 1 48 ASN HB2 3.570 . 5.340 3.823 3.468 4.303 . 0 0 "[ . 1 . 2 . ]" 1 772 1 35 TYR QB 1 62 PRO QB 2.945 . 4.090 3.465 2.611 3.884 . 0 0 "[ . 1 . 2 . ]" 1 773 1 35 TYR QB 1 62 PRO QD 3.490 . 5.180 3.028 2.456 3.545 . 0 0 "[ . 1 . 2 . ]" 1 774 1 35 TYR QB 1 62 PRO HG2 2.915 . 4.030 2.169 1.754 2.493 0.046 27 0 "[ . 1 . 2 . ]" 1 775 1 35 TYR QB 1 62 PRO HG3 2.585 . 3.370 2.372 2.069 3.184 . 0 0 "[ . 1 . 2 . ]" 1 776 1 35 TYR HB2 1 36 THR H 3.075 . 4.350 4.122 3.997 4.294 . 0 0 "[ . 1 . 2 . ]" 1 777 1 35 TYR HB2 1 43 LEU MD1 3.650 . 5.500 3.913 2.411 5.438 . 0 0 "[ . 1 . 2 . ]" 1 778 1 35 TYR HB2 1 43 LEU MD2 3.650 . 5.500 3.918 2.486 5.558 0.058 20 0 "[ . 1 . 2 . ]" 1 779 1 35 TYR HB2 1 49 TYR HA 3.650 . 5.500 3.944 3.569 4.075 . 0 0 "[ . 1 . 2 . ]" 1 780 1 35 TYR HB2 1 62 PRO HG2 3.295 . 4.790 2.289 1.988 2.616 . 0 0 "[ . 1 . 2 . ]" 1 781 1 35 TYR HB2 1 62 PRO HG3 2.830 . 3.860 2.446 2.084 3.606 . 0 0 "[ . 1 . 2 . ]" 1 782 1 35 TYR HB3 1 36 THR H 3.075 . 4.350 3.112 2.801 4.033 . 0 0 "[ . 1 . 2 . ]" 1 783 1 35 TYR HB3 1 43 LEU MD1 3.650 . 5.500 4.068 2.543 5.319 . 0 0 "[ . 1 . 2 . ]" 1 784 1 35 TYR HB3 1 43 LEU MD2 3.650 . 5.500 4.088 2.331 5.517 0.017 13 0 "[ . 1 . 2 . ]" 1 785 1 35 TYR HB3 1 49 TYR HA 3.650 . 5.500 5.389 4.002 5.639 0.139 21 0 "[ . 1 . 2 . ]" 1 786 1 35 TYR HB3 1 62 PRO HG2 3.295 . 4.790 2.758 1.934 3.135 . 0 0 "[ . 1 . 2 . ]" 1 787 1 35 TYR HB3 1 62 PRO HG3 2.830 . 3.860 3.673 2.978 3.873 0.013 12 0 "[ . 1 . 2 . ]" 1 788 1 36 THR H 1 36 THR HB 2.690 . 3.580 3.353 3.213 3.473 . 0 0 "[ . 1 . 2 . ]" 1 789 1 36 THR H 1 36 THR MG 2.810 . 3.820 2.366 2.181 2.474 . 0 0 "[ . 1 . 2 . ]" 1 790 1 36 THR HA 1 36 THR MG 2.525 . 3.250 3.248 3.227 3.256 0.006 26 0 "[ . 1 . 2 . ]" 1 791 1 36 THR HA 1 37 CYS H 2.360 . 2.920 2.096 2.029 2.167 . 0 0 "[ . 1 . 2 . ]" 1 792 1 36 THR HA 1 37 CYS HB2 3.375 . 4.950 4.507 4.356 4.717 . 0 0 "[ . 1 . 2 . ]" 1 793 1 36 THR HA 1 43 LEU QB 3.335 . 4.870 4.202 3.694 4.836 . 0 0 "[ . 1 . 2 . ]" 1 794 1 36 THR HA 1 43 LEU QD 2.740 . 3.680 3.222 2.693 3.721 0.041 26 0 "[ . 1 . 2 . ]" 1 795 1 36 THR HB 1 37 CYS H 3.240 . 4.680 4.229 4.065 4.366 . 0 0 "[ . 1 . 2 . ]" 1 796 1 36 THR MG 1 37 CYS H 3.050 . 4.300 4.147 3.952 4.302 0.002 27 0 "[ . 1 . 2 . ]" 1 797 1 37 CYS H 1 37 CYS HB2 2.790 . 3.780 2.444 2.272 2.652 . 0 0 "[ . 1 . 2 . ]" 1 798 1 37 CYS H 1 38 ASN H 3.260 . 4.720 4.586 4.559 4.633 . 0 0 "[ . 1 . 2 . ]" 1 799 1 37 CYS H 1 41 TYR HB2 3.650 . 5.500 5.468 5.340 5.561 0.061 11 0 "[ . 1 . 2 . ]" 1 800 1 37 CYS H 1 43 LEU QB 3.520 . 5.240 3.678 3.045 4.146 . 0 0 "[ . 1 . 2 . ]" 1 801 1 37 CYS H 1 43 LEU MD1 3.650 . 5.500 4.538 2.988 5.610 0.110 6 0 "[ . 1 . 2 . ]" 1 802 1 37 CYS H 1 43 LEU QD 3.075 . 4.350 3.302 2.964 3.979 . 0 0 "[ . 1 . 2 . ]" 1 803 1 37 CYS H 1 43 LEU MD2 3.650 . 5.500 4.311 2.976 5.592 0.092 19 0 "[ . 1 . 2 . ]" 1 804 1 37 CYS HB2 1 38 ASN H 3.310 . 4.820 3.647 3.450 3.773 . 0 0 "[ . 1 . 2 . ]" 1 805 1 37 CYS HB2 1 41 TYR HB2 3.065 . 4.330 3.442 3.128 3.814 . 0 0 "[ . 1 . 2 . ]" 1 806 1 37 CYS HB2 1 42 GLN H 3.130 . 4.460 3.985 3.683 4.322 . 0 0 "[ . 1 . 2 . ]" 1 807 1 37 CYS HB3 1 38 ASN H 2.765 . 3.730 2.564 2.375 2.868 . 0 0 "[ . 1 . 2 . ]" 1 808 1 37 CYS HB3 1 41 TYR H 3.205 . 4.610 4.285 3.755 4.703 0.093 3 0 "[ . 1 . 2 . ]" 1 809 1 37 CYS HB3 1 42 GLN H 3.285 . 4.770 3.735 3.405 4.268 . 0 0 "[ . 1 . 2 . ]" 1 810 1 38 ASN H 1 38 ASN HB2 2.740 . 3.680 2.153 1.958 2.364 . 0 0 "[ . 1 . 2 . ]" 1 811 1 38 ASN H 1 38 ASN HB3 2.975 . 4.150 3.362 2.634 3.620 . 0 0 "[ . 1 . 2 . ]" 1 812 1 38 ASN H 1 38 ASN HD21 3.270 . 4.740 3.957 2.747 4.732 . 0 0 "[ . 1 . 2 . ]" 1 813 1 38 ASN H 1 38 ASN HD22 3.490 . 5.180 4.770 4.058 5.312 0.132 11 0 "[ . 1 . 2 . ]" 1 814 1 38 ASN H 1 39 GLU H 3.285 . 4.770 4.471 4.362 4.549 . 0 0 "[ . 1 . 2 . ]" 1 815 1 38 ASN H 1 40 GLY H 3.630 . 5.460 5.204 4.980 5.467 0.007 13 0 "[ . 1 . 2 . ]" 1 816 1 38 ASN H 1 41 TYR H 3.415 . 5.030 4.431 3.932 4.866 . 0 0 "[ . 1 . 2 . ]" 1 817 1 38 ASN H 1 41 TYR HB2 3.155 . 4.510 2.551 2.197 2.995 . 0 0 "[ . 1 . 2 . ]" 1 818 1 38 ASN H 1 41 TYR QD 3.140 . 4.480 3.308 2.968 3.626 . 0 0 "[ . 1 . 2 . ]" 1 819 1 38 ASN H 1 41 TYR QE 3.650 . 5.500 5.231 4.862 5.505 0.005 27 0 "[ . 1 . 2 . ]" 1 820 1 38 ASN HA 1 38 ASN HD21 3.280 . 4.760 4.237 3.034 4.426 . 0 0 "[ . 1 . 2 . ]" 1 821 1 38 ASN HA 1 38 ASN HD22 3.535 . 5.270 4.460 3.821 4.659 . 0 0 "[ . 1 . 2 . ]" 1 822 1 38 ASN HA 1 39 GLU H 2.300 . 2.800 2.548 2.342 2.734 . 0 0 "[ . 1 . 2 . ]" 1 823 1 38 ASN HA 1 39 GLU HB2 3.415 . 5.030 4.684 4.521 4.819 . 0 0 "[ . 1 . 2 . ]" 1 824 1 38 ASN HA 1 39 GLU QB 3.115 . 4.430 4.285 4.099 4.371 . 0 0 "[ . 1 . 2 . ]" 1 825 1 38 ASN HA 1 39 GLU HB3 3.415 . 5.030 4.969 4.653 5.069 0.039 13 0 "[ . 1 . 2 . ]" 1 826 1 38 ASN HA 1 40 GLY H 3.350 . 4.900 4.778 4.272 4.967 0.067 1 0 "[ . 1 . 2 . ]" 1 827 1 38 ASN HB2 1 39 GLU H 2.790 . 3.780 3.527 3.190 3.834 0.054 9 0 "[ . 1 . 2 . ]" 1 828 1 38 ASN HB2 1 40 GLY H 3.200 . 4.600 4.063 3.598 4.723 0.123 1 0 "[ . 1 . 2 . ]" 1 829 1 38 ASN HB2 1 41 TYR QD 3.000 . 4.200 2.400 1.971 3.087 . 0 0 "[ . 1 . 2 . ]" 1 830 1 38 ASN HB2 1 41 TYR QE 3.155 . 4.510 3.905 3.408 4.436 . 0 0 "[ . 1 . 2 . ]" 1 831 1 38 ASN HB3 1 39 GLU H 2.555 . 3.310 2.177 1.836 2.954 . 0 0 "[ . 1 . 2 . ]" 1 832 1 38 ASN HB3 1 39 GLU HB2 3.485 . 5.170 4.521 3.946 5.195 0.025 9 0 "[ . 1 . 2 . ]" 1 833 1 38 ASN HB3 1 39 GLU QB 3.160 . 4.520 3.647 3.206 4.245 . 0 0 "[ . 1 . 2 . ]" 1 834 1 38 ASN HB3 1 39 GLU HB3 3.485 . 5.170 3.851 3.393 4.504 . 0 0 "[ . 1 . 2 . ]" 1 835 1 38 ASN HB3 1 41 TYR H 3.380 . 4.960 4.302 2.920 4.975 0.015 2 0 "[ . 1 . 2 . ]" 1 836 1 38 ASN HB3 1 41 TYR QD 2.900 . 4.000 2.993 1.792 3.718 0.008 9 0 "[ . 1 . 2 . ]" 1 837 1 38 ASN HB3 1 41 TYR QE 3.455 . 5.110 4.377 3.542 5.121 0.011 27 0 "[ . 1 . 2 . ]" 1 838 1 38 ASN HD21 1 39 GLU H 3.370 . 4.940 4.669 3.854 4.974 0.034 15 0 "[ . 1 . 2 . ]" 1 839 1 38 ASN HD21 1 41 TYR QD 3.460 . 5.120 3.788 3.107 4.188 . 0 0 "[ . 1 . 2 . ]" 1 840 1 38 ASN HD21 1 41 TYR QE 3.540 . 5.280 4.011 3.240 4.692 . 0 0 "[ . 1 . 2 . ]" 1 841 1 38 ASN HD22 1 39 GLU H 3.625 . 5.450 5.126 3.934 5.504 0.054 10 0 "[ . 1 . 2 . ]" 1 842 1 38 ASN HD22 1 41 TYR QD 3.650 . 5.500 5.230 4.526 5.545 0.045 29 0 "[ . 1 . 2 . ]" 1 843 1 39 GLU H 1 39 GLU HB2 2.335 . 2.870 2.494 2.341 2.691 . 0 0 "[ . 1 . 2 . ]" 1 844 1 39 GLU H 1 39 GLU HB3 2.335 . 2.870 2.431 2.327 2.519 . 0 0 "[ . 1 . 2 . ]" 1 845 1 39 GLU H 1 39 GLU HG2 3.190 . 4.580 4.406 4.332 4.464 . 0 0 "[ . 1 . 2 . ]" 1 846 1 39 GLU H 1 39 GLU QG 2.910 . 4.020 3.933 3.887 3.968 . 0 0 "[ . 1 . 2 . ]" 1 847 1 39 GLU H 1 39 GLU HG3 3.190 . 4.580 4.424 4.338 4.492 . 0 0 "[ . 1 . 2 . ]" 1 848 1 39 GLU H 1 40 GLY H 2.930 . 4.060 2.912 2.562 3.904 . 0 0 "[ . 1 . 2 . ]" 1 849 1 39 GLU H 1 41 TYR QD 3.410 . 5.020 4.534 4.050 5.046 0.026 27 0 "[ . 1 . 2 . ]" 1 850 1 39 GLU HA 1 39 GLU HG2 2.780 . 3.760 3.269 3.122 3.372 . 0 0 "[ . 1 . 2 . ]" 1 851 1 39 GLU HA 1 39 GLU HG3 2.780 . 3.760 2.598 2.440 2.732 . 0 0 "[ . 1 . 2 . ]" 1 852 1 39 GLU HA 1 40 GLY H 2.685 . 3.570 3.475 1.955 3.569 . 0 0 "[ . 1 . 2 . ]" 1 853 1 39 GLU HA 1 40 GLY QA 3.325 . 4.850 4.328 3.768 4.422 . 0 0 "[ . 1 . 2 . ]" 1 854 1 39 GLU HA 1 41 TYR H 2.770 . 3.740 3.717 3.406 3.871 0.131 23 0 "[ . 1 . 2 . ]" 1 855 1 39 GLU QB 1 40 GLY H 2.715 . 3.630 2.539 2.283 3.766 0.136 1 0 "[ . 1 . 2 . ]" 1 856 1 39 GLU HB2 1 40 GLY H 3.040 . 4.280 3.885 3.704 4.237 . 0 0 "[ . 1 . 2 . ]" 1 857 1 39 GLU HB2 1 93 PHE QE 3.650 . 5.500 5.317 4.795 5.573 0.073 20 0 "[ . 1 . 2 . ]" 1 858 1 39 GLU HB3 1 40 GLY H 3.040 . 4.280 2.585 2.305 4.217 . 0 0 "[ . 1 . 2 . ]" 1 859 1 39 GLU HB3 1 93 PHE QE 3.650 . 5.500 4.201 3.772 4.651 . 0 0 "[ . 1 . 2 . ]" 1 860 1 39 GLU QG 1 40 GLY H 2.835 . 3.870 3.372 3.195 3.612 . 0 0 "[ . 1 . 2 . ]" 1 861 1 39 GLU QG 1 93 PHE QE 3.095 . 4.390 2.986 1.951 3.652 . 0 0 "[ . 1 . 2 . ]" 1 862 1 39 GLU QG 1 117 ASP H 3.490 . 5.180 4.619 3.984 5.199 0.019 8 0 "[ . 1 . 2 . ]" 1 863 1 39 GLU HG2 1 40 GLY H 3.140 . 4.480 3.498 3.276 3.948 . 0 0 "[ . 1 . 2 . ]" 1 864 1 39 GLU HG3 1 40 GLY H 3.140 . 4.480 4.474 3.870 4.539 0.059 10 0 "[ . 1 . 2 . ]" 1 865 1 40 GLY H 1 41 TYR H 2.490 . 3.180 2.851 1.786 3.156 0.014 1 0 "[ . 1 . 2 . ]" 1 866 1 40 GLY H 1 41 TYR HB2 3.265 . 4.730 4.513 4.275 4.718 . 0 0 "[ . 1 . 2 . ]" 1 867 1 40 GLY H 1 41 TYR QD 3.160 . 4.520 3.368 2.918 3.984 . 0 0 "[ . 1 . 2 . ]" 1 868 1 40 GLY H 1 67 VAL QG 3.360 . 4.920 4.429 3.585 4.930 0.010 4 0 "[ . 1 . 2 . ]" 1 869 1 40 GLY H 1 93 PHE QD 3.530 . 5.260 4.334 3.958 4.852 . 0 0 "[ . 1 . 2 . ]" 1 870 1 40 GLY H 1 93 PHE QE 3.630 . 5.460 4.470 4.050 5.005 . 0 0 "[ . 1 . 2 . ]" 1 871 1 40 GLY QA 1 41 TYR QD 3.405 . 5.010 3.714 3.249 4.160 . 0 0 "[ . 1 . 2 . ]" 1 872 1 40 GLY QA 1 41 TYR QE 3.570 . 5.340 4.240 3.822 4.561 . 0 0 "[ . 1 . 2 . ]" 1 873 1 40 GLY QA 1 67 VAL QG 2.810 . 3.820 2.624 2.027 3.278 . 0 0 "[ . 1 . 2 . ]" 1 874 1 40 GLY QA 1 93 PHE QD 3.390 . 4.980 2.427 1.883 2.706 . 0 0 "[ . 1 . 2 . ]" 1 875 1 40 GLY QA 1 93 PHE QE 3.560 . 5.320 3.502 3.029 4.039 . 0 0 "[ . 1 . 2 . ]" 1 876 1 41 TYR H 1 41 TYR HB2 2.665 . 3.530 2.784 2.632 2.958 . 0 0 "[ . 1 . 2 . ]" 1 877 1 41 TYR H 1 41 TYR HB3 2.950 . 4.100 3.841 3.765 3.932 . 0 0 "[ . 1 . 2 . ]" 1 878 1 41 TYR H 1 41 TYR QD 2.605 . 3.410 3.312 2.931 3.524 0.114 22 0 "[ . 1 . 2 . ]" 1 879 1 41 TYR H 1 41 TYR QE 3.600 . 5.400 5.224 4.985 5.448 0.048 11 0 "[ . 1 . 2 . ]" 1 880 1 41 TYR H 1 42 GLN H 3.170 . 4.540 4.338 4.214 4.451 . 0 0 "[ . 1 . 2 . ]" 1 881 1 41 TYR H 1 67 VAL H 3.455 . 5.110 4.187 3.883 4.455 . 0 0 "[ . 1 . 2 . ]" 1 882 1 41 TYR H 1 67 VAL HB 3.650 . 5.500 5.176 4.170 5.687 0.187 22 0 "[ . 1 . 2 . ]" 1 883 1 41 TYR H 1 67 VAL QG 2.605 . 3.410 2.921 2.704 3.273 . 0 0 "[ . 1 . 2 . ]" 1 884 1 41 TYR HA 1 41 TYR QD 2.890 . 3.980 2.846 2.454 3.054 . 0 0 "[ . 1 . 2 . ]" 1 885 1 41 TYR HA 1 41 TYR QE 3.440 . 5.080 4.561 4.277 4.733 . 0 0 "[ . 1 . 2 . ]" 1 886 1 41 TYR HA 1 42 GLN H 2.560 . 3.320 2.368 2.226 2.494 . 0 0 "[ . 1 . 2 . ]" 1 887 1 41 TYR HA 1 42 GLN QG 3.510 . 5.220 3.670 3.348 3.791 . 0 0 "[ . 1 . 2 . ]" 1 888 1 41 TYR HA 1 66 VAL HA 2.730 . 3.660 2.155 2.030 2.395 . 0 0 "[ . 1 . 2 . ]" 1 889 1 41 TYR HA 1 67 VAL H 2.820 . 3.840 2.222 2.071 2.433 . 0 0 "[ . 1 . 2 . ]" 1 890 1 41 TYR HA 1 67 VAL QG 2.665 . 3.530 2.428 2.287 2.653 . 0 0 "[ . 1 . 2 . ]" 1 891 1 41 TYR HB2 1 42 GLN H 2.835 . 3.870 3.674 3.331 3.891 0.021 23 0 "[ . 1 . 2 . ]" 1 892 1 41 TYR HB3 1 42 GLN H 2.835 . 3.870 2.472 2.135 2.777 . 0 0 "[ . 1 . 2 . ]" 1 893 1 41 TYR HB3 1 64 CYS QB 3.415 . 5.030 3.253 2.191 4.279 . 0 0 "[ . 1 . 2 . ]" 1 894 1 41 TYR QD 1 42 GLN H 2.935 . 4.070 3.616 3.376 3.774 . 0 0 "[ . 1 . 2 . ]" 1 895 1 41 TYR QD 1 64 CYS QB 3.115 . 4.430 3.928 2.883 4.573 0.143 23 0 "[ . 1 . 2 . ]" 1 896 1 41 TYR QD 1 65 GLU HA 3.040 . 4.280 3.739 3.364 4.162 . 0 0 "[ . 1 . 2 . ]" 1 897 1 41 TYR QD 1 66 VAL H 2.885 . 3.970 3.365 3.041 3.589 . 0 0 "[ . 1 . 2 . ]" 1 898 1 41 TYR QD 1 66 VAL HA 2.820 . 3.840 2.144 1.760 2.618 0.040 16 0 "[ . 1 . 2 . ]" 1 899 1 41 TYR QD 1 66 VAL HB 2.885 . 3.970 3.458 2.870 4.137 0.167 28 0 "[ . 1 . 2 . ]" 1 900 1 41 TYR QD 1 66 VAL QG 2.885 . 3.970 3.092 2.119 3.645 . 0 0 "[ . 1 . 2 . ]" 1 901 1 41 TYR QD 1 67 VAL H 3.160 . 4.520 3.996 3.395 4.351 . 0 0 "[ . 1 . 2 . ]" 1 902 1 41 TYR QE 1 65 GLU HA 3.560 . 5.320 4.841 4.390 5.325 0.005 27 0 "[ . 1 . 2 . ]" 1 903 1 41 TYR QE 1 66 VAL H 2.995 . 4.190 4.029 3.612 4.217 0.027 23 0 "[ . 1 . 2 . ]" 1 904 1 41 TYR QE 1 66 VAL HA 2.970 . 4.140 3.410 2.726 3.768 . 0 0 "[ . 1 . 2 . ]" 1 905 1 41 TYR QE 1 66 VAL HB 2.590 . 3.380 2.966 2.241 4.450 1.070 12 2 "[ . -1 + . 2 . ]" 1 906 1 41 TYR QE 1 66 VAL MG1 3.195 . 4.590 3.522 2.155 4.478 . 0 0 "[ . 1 . 2 . ]" 1 907 1 41 TYR QE 1 66 VAL QG 2.655 . 3.510 2.750 1.690 3.464 0.110 15 0 "[ . 1 . 2 . ]" 1 908 1 41 TYR QE 1 66 VAL MG2 3.195 . 4.590 2.895 1.758 3.794 0.042 23 0 "[ . 1 . 2 . ]" 1 909 1 41 TYR QE 1 67 VAL H 3.650 . 5.500 5.085 4.335 5.505 0.005 18 0 "[ . 1 . 2 . ]" 1 910 1 42 GLN H 1 42 GLN HB2 2.970 . 4.140 3.850 3.692 3.929 . 0 0 "[ . 1 . 2 . ]" 1 911 1 42 GLN H 1 42 GLN QB 2.600 . 3.400 3.163 2.996 3.297 . 0 0 "[ . 1 . 2 . ]" 1 912 1 42 GLN H 1 42 GLN HB3 2.970 . 4.140 3.365 3.169 3.568 . 0 0 "[ . 1 . 2 . ]" 1 913 1 42 GLN H 1 42 GLN QG 2.605 . 3.410 2.460 2.187 2.725 . 0 0 "[ . 1 . 2 . ]" 1 914 1 42 GLN H 1 43 LEU H 3.135 . 4.470 4.283 4.157 4.366 . 0 0 "[ . 1 . 2 . ]" 1 915 1 42 GLN H 1 44 LEU MD2 3.480 . 5.160 5.143 4.671 5.256 0.096 2 0 "[ . 1 . 2 . ]" 1 916 1 42 GLN H 1 64 CYS HA 3.290 . 4.780 4.265 3.737 4.791 0.011 12 0 "[ . 1 . 2 . ]" 1 917 1 42 GLN H 1 64 CYS HB2 3.650 . 5.500 5.535 5.368 5.615 0.115 16 0 "[ . 1 . 2 . ]" 1 918 1 42 GLN H 1 64 CYS HB3 3.650 . 5.500 4.696 3.780 5.541 0.041 7 0 "[ . 1 . 2 . ]" 1 919 1 42 GLN H 1 65 GLU H 2.720 . 3.640 3.068 2.769 3.321 . 0 0 "[ . 1 . 2 . ]" 1 920 1 42 GLN H 1 65 GLU QB 3.575 . 5.350 3.992 3.768 4.282 . 0 0 "[ . 1 . 2 . ]" 1 921 1 42 GLN H 1 66 VAL HA 2.990 . 4.180 3.507 3.320 3.830 . 0 0 "[ . 1 . 2 . ]" 1 922 1 42 GLN H 1 66 VAL QG 3.620 . 5.440 4.736 4.458 4.997 . 0 0 "[ . 1 . 2 . ]" 1 923 1 42 GLN H 1 67 VAL H 2.950 . 4.100 3.922 3.440 4.124 0.024 27 0 "[ . 1 . 2 . ]" 1 924 1 42 GLN H 1 67 VAL HA 3.485 . 5.170 4.547 3.775 4.907 . 0 0 "[ . 1 . 2 . ]" 1 925 1 42 GLN H 1 67 VAL QG 2.685 . 3.570 3.183 2.981 3.405 . 0 0 "[ . 1 . 2 . ]" 1 926 1 42 GLN HA 1 42 GLN QG 2.850 . 3.900 3.390 3.331 3.552 . 0 0 "[ . 1 . 2 . ]" 1 927 1 42 GLN HA 1 43 LEU H 2.445 . 3.090 2.358 2.128 2.514 . 0 0 "[ . 1 . 2 . ]" 1 928 1 42 GLN HA 1 43 LEU QB 3.010 . 4.220 3.977 3.889 4.152 . 0 0 "[ . 1 . 2 . ]" 1 929 1 42 GLN QB 1 42 GLN QE 2.770 . 3.740 2.157 1.762 3.238 0.038 27 0 "[ . 1 . 2 . ]" 1 930 1 42 GLN QB 1 43 LEU H 2.620 . 3.440 2.449 2.151 2.964 . 0 0 "[ . 1 . 2 . ]" 1 931 1 42 GLN QB 1 43 LEU QB 3.135 . 4.470 4.112 3.933 4.394 . 0 0 "[ . 1 . 2 . ]" 1 932 1 42 GLN QB 1 67 VAL QG 2.525 . 3.250 2.193 1.969 2.640 . 0 0 "[ . 1 . 2 . ]" 1 933 1 42 GLN HB2 1 42 GLN HE21 3.620 . 5.440 2.232 1.779 3.660 0.021 27 0 "[ . 1 . 2 . ]" 1 934 1 42 GLN HB2 1 42 GLN HE22 3.620 . 5.440 3.458 3.170 4.110 . 0 0 "[ . 1 . 2 . ]" 1 935 1 42 GLN HB3 1 42 GLN HE21 3.620 . 5.440 3.584 3.183 4.173 . 0 0 "[ . 1 . 2 . ]" 1 936 1 42 GLN HB3 1 42 GLN HE22 3.620 . 5.440 4.550 4.220 5.122 . 0 0 "[ . 1 . 2 . ]" 1 937 1 42 GLN QE 1 42 GLN QG 2.430 . 3.060 2.466 2.139 2.695 . 0 0 "[ . 1 . 2 . ]" 1 938 1 42 GLN QE 1 43 LEU H 3.505 . 5.210 3.417 2.821 4.115 . 0 0 "[ . 1 . 2 . ]" 1 939 1 42 GLN QE 1 43 LEU QB 3.275 . 4.750 4.251 4.061 4.771 0.021 2 0 "[ . 1 . 2 . ]" 1 940 1 42 GLN QE 1 44 LEU MD1 3.260 . 4.720 4.386 3.925 4.731 0.011 14 0 "[ . 1 . 2 . ]" 1 941 1 42 GLN QE 1 65 GLU QB 3.570 . 5.340 3.924 1.869 4.814 . 0 0 "[ . 1 . 2 . ]" 1 942 1 42 GLN QE 1 67 VAL HA 3.570 . 5.340 5.103 4.412 5.394 0.054 9 0 "[ . 1 . 2 . ]" 1 943 1 42 GLN QE 1 67 VAL QG 3.180 . 4.560 4.277 4.025 4.570 0.010 21 0 "[ . 1 . 2 . ]" 1 944 1 42 GLN HE21 1 42 GLN QG 2.695 . 3.590 2.541 2.169 2.807 . 0 0 "[ . 1 . 2 . ]" 1 945 1 42 GLN HE21 1 43 LEU QB 3.650 . 5.500 4.471 4.248 5.448 . 0 0 "[ . 1 . 2 . ]" 1 946 1 42 GLN HE21 1 44 LEU MD1 3.650 . 5.500 5.239 4.577 5.535 0.035 25 0 "[ . 1 . 2 . ]" 1 947 1 42 GLN HE22 1 42 GLN QG 2.695 . 3.590 3.390 3.267 3.483 . 0 0 "[ . 1 . 2 . ]" 1 948 1 42 GLN HE22 1 43 LEU QB 3.650 . 5.500 5.473 4.907 5.608 0.108 15 0 "[ . 1 . 2 . ]" 1 949 1 42 GLN HE22 1 44 LEU MD1 3.650 . 5.500 4.795 4.039 5.329 . 0 0 "[ . 1 . 2 . ]" 1 950 1 42 GLN QG 1 43 LEU H 3.250 . 4.700 3.852 3.299 4.549 . 0 0 "[ . 1 . 2 . ]" 1 951 1 42 GLN QG 1 65 GLU H 3.240 . 4.680 3.380 2.796 4.496 . 0 0 "[ . 1 . 2 . ]" 1 952 1 42 GLN QG 1 67 VAL H 3.650 . 5.500 3.779 3.494 4.066 . 0 0 "[ . 1 . 2 . ]" 1 953 1 42 GLN QG 1 67 VAL HA 3.185 . 4.570 2.524 1.959 2.932 . 0 0 "[ . 1 . 2 . ]" 1 954 1 42 GLN QG 1 67 VAL HB 3.125 . 4.450 4.407 3.912 4.527 0.077 1 0 "[ . 1 . 2 . ]" 1 955 1 42 GLN QG 1 67 VAL QG 2.545 . 3.290 2.308 2.016 2.784 . 0 0 "[ . 1 . 2 . ]" 1 956 1 42 GLN QG 1 68 LYS H 3.295 . 4.790 4.060 3.523 4.515 . 0 0 "[ . 1 . 2 . ]" 1 957 1 43 LEU H 1 43 LEU QB 2.330 . 2.860 2.206 2.085 2.288 . 0 0 "[ . 1 . 2 . ]" 1 958 1 43 LEU H 1 43 LEU MD1 3.175 . 4.550 4.193 4.015 4.301 . 0 0 "[ . 1 . 2 . ]" 1 959 1 43 LEU H 1 43 LEU QD 2.835 . 3.870 3.653 3.492 3.795 . 0 0 "[ . 1 . 2 . ]" 1 960 1 43 LEU H 1 43 LEU MD2 3.175 . 4.550 4.049 3.699 4.309 . 0 0 "[ . 1 . 2 . ]" 1 961 1 43 LEU HA 1 44 LEU H 2.500 . 3.200 2.176 2.068 2.297 . 0 0 "[ . 1 . 2 . ]" 1 962 1 43 LEU QB 1 43 LEU MD1 2.250 . 2.700 2.249 2.032 2.402 . 0 0 "[ . 1 . 2 . ]" 1 963 1 43 LEU QB 1 43 LEU MD2 2.250 . 2.700 2.194 2.039 2.319 . 0 0 "[ . 1 . 2 . ]" 1 964 1 43 LEU QB 1 44 LEU H 2.860 . 3.920 3.582 3.338 3.807 . 0 0 "[ . 1 . 2 . ]" 1 965 1 43 LEU QB 1 44 LEU HA 3.495 . 5.190 4.376 4.095 4.710 . 0 0 "[ . 1 . 2 . ]" 1 966 1 43 LEU QB 1 65 GLU H 3.650 . 5.500 5.269 4.972 5.519 0.019 6 0 "[ . 1 . 2 . ]" 1 967 1 43 LEU QD 1 44 LEU H 2.640 . 3.480 2.457 1.853 2.951 . 0 0 "[ . 1 . 2 . ]" 1 968 1 43 LEU QD 1 44 LEU HA 3.065 . 4.330 3.804 3.280 4.361 0.031 1 0 "[ . 1 . 2 . ]" 1 969 1 43 LEU QD 1 45 GLY H 3.205 . 4.610 4.011 3.667 4.530 . 0 0 "[ . 1 . 2 . ]" 1 970 1 43 LEU QD 1 45 GLY HA3 3.185 . 4.570 3.787 3.327 4.437 . 0 0 "[ . 1 . 2 . ]" 1 971 1 43 LEU QD 1 46 GLU H 3.400 . 5.000 4.691 4.324 5.004 0.004 22 0 "[ . 1 . 2 . ]" 1 972 1 43 LEU QD 1 46 GLU HA 3.415 . 5.030 4.498 3.780 5.017 . 0 0 "[ . 1 . 2 . ]" 1 973 1 43 LEU QD 1 47 ILE H 3.060 . 4.320 4.195 3.940 4.348 0.028 13 0 "[ . 1 . 2 . ]" 1 974 1 43 LEU QD 1 48 ASN H 2.985 . 4.170 3.891 3.651 4.063 . 0 0 "[ . 1 . 2 . ]" 1 975 1 43 LEU QD 1 48 ASN HA 2.255 . 2.710 2.084 1.899 2.375 . 0 0 "[ . 1 . 2 . ]" 1 976 1 43 LEU QD 1 48 ASN HB3 2.345 . 2.890 2.333 1.855 2.827 . 0 0 "[ . 1 . 2 . ]" 1 977 1 43 LEU QD 1 48 ASN HD21 3.035 . 4.270 3.824 3.328 4.232 . 0 0 "[ . 1 . 2 . ]" 1 978 1 43 LEU QD 1 48 ASN HD22 3.620 . 5.440 4.869 4.499 5.192 . 0 0 "[ . 1 . 2 . ]" 1 979 1 43 LEU QD 1 49 TYR H 3.525 . 5.250 4.449 4.140 4.725 . 0 0 "[ . 1 . 2 . ]" 1 980 1 43 LEU QD 1 62 PRO HA 3.355 . 4.910 3.974 3.532 4.314 . 0 0 "[ . 1 . 2 . ]" 1 981 1 43 LEU QD 1 62 PRO QB 2.205 . 2.610 1.980 1.778 2.389 0.022 6 0 "[ . 1 . 2 . ]" 1 982 1 43 LEU QD 1 62 PRO QD 3.540 . 5.280 4.037 3.705 4.483 . 0 0 "[ . 1 . 2 . ]" 1 983 1 43 LEU QD 1 62 PRO HG3 2.715 . 3.630 3.021 2.379 3.665 0.035 17 0 "[ . 1 . 2 . ]" 1 984 1 43 LEU QD 1 63 ILE H 3.195 . 4.590 3.306 2.696 4.534 . 0 0 "[ . 1 . 2 . ]" 1 985 1 43 LEU QD 1 64 CYS HA 3.070 . 4.340 3.326 2.489 4.351 0.011 9 0 "[ . 1 . 2 . ]" 1 986 1 43 LEU QD 1 65 GLU H 3.620 . 5.440 4.624 4.000 5.322 . 0 0 "[ . 1 . 2 . ]" 1 987 1 43 LEU MD1 1 44 LEU H 3.035 . 4.270 2.892 1.864 4.331 0.061 15 0 "[ . 1 . 2 . ]" 1 988 1 43 LEU MD1 1 48 ASN H 3.650 . 5.500 4.509 3.985 5.328 . 0 0 "[ . 1 . 2 . ]" 1 989 1 43 LEU MD1 1 48 ASN HA 2.570 . 3.340 2.297 1.997 2.938 . 0 0 "[ . 1 . 2 . ]" 1 990 1 43 LEU MD1 1 48 ASN HB2 2.450 . 3.100 2.834 1.951 3.156 0.056 20 0 "[ . 1 . 2 . ]" 1 991 1 43 LEU MD1 1 48 ASN HB3 2.750 . 3.700 2.940 2.410 3.708 0.008 1 0 "[ . 1 . 2 . ]" 1 992 1 43 LEU MD1 1 48 ASN HD21 3.375 . 4.950 4.508 3.399 4.981 0.031 17 0 "[ . 1 . 2 . ]" 1 993 1 43 LEU MD1 1 62 PRO HB2 2.820 . 3.840 2.305 1.903 3.037 . 0 0 "[ . 1 . 2 . ]" 1 994 1 43 LEU MD1 1 62 PRO HB3 2.820 . 3.840 3.050 2.252 3.854 0.014 15 0 "[ . 1 . 2 . ]" 1 995 1 43 LEU MD1 1 62 PRO HG3 2.985 . 4.170 3.425 2.419 4.189 0.019 29 0 "[ . 1 . 2 . ]" 1 996 1 43 LEU MD1 1 64 CYS HA 3.400 . 5.000 3.873 2.722 4.947 . 0 0 "[ . 1 . 2 . ]" 1 997 1 43 LEU MD2 1 44 LEU H 3.035 . 4.270 3.286 2.406 3.937 . 0 0 "[ . 1 . 2 . ]" 1 998 1 43 LEU MD2 1 48 ASN H 3.650 . 5.500 4.584 3.747 5.437 . 0 0 "[ . 1 . 2 . ]" 1 999 1 43 LEU MD2 1 48 ASN HA 2.570 . 3.340 2.501 2.157 2.973 . 0 0 "[ . 1 . 2 . ]" 1 1000 1 43 LEU MD2 1 48 ASN HB2 2.450 . 3.100 2.730 2.376 3.088 . 0 0 "[ . 1 . 2 . ]" 1 1001 1 43 LEU MD2 1 48 ASN HB3 2.750 . 3.700 2.861 1.862 3.735 0.035 28 0 "[ . 1 . 2 . ]" 1 1002 1 43 LEU MD2 1 48 ASN HD21 3.375 . 4.950 4.325 3.688 4.954 0.004 9 0 "[ . 1 . 2 . ]" 1 1003 1 43 LEU MD2 1 62 PRO HB2 2.820 . 3.840 2.579 2.040 3.297 . 0 0 "[ . 1 . 2 . ]" 1 1004 1 43 LEU MD2 1 62 PRO HB3 2.820 . 3.840 3.356 2.763 3.844 0.004 1 0 "[ . 1 . 2 . ]" 1 1005 1 43 LEU MD2 1 62 PRO HG3 2.985 . 4.170 3.612 2.758 4.204 0.034 21 0 "[ . 1 . 2 . ]" 1 1006 1 43 LEU MD2 1 64 CYS HA 3.400 . 5.000 4.149 2.543 5.192 0.192 3 0 "[ . 1 . 2 . ]" 1 1007 1 43 LEU HG 1 44 LEU H 3.375 . 4.950 3.543 1.964 4.950 . 0 0 "[ . 1 . 2 . ]" 1 1008 1 43 LEU HG 1 63 ILE H 3.650 . 5.500 4.956 3.800 5.599 0.099 6 0 "[ . 1 . 2 . ]" 1 1009 1 44 LEU H 1 44 LEU HB2 2.595 . 3.390 2.512 2.348 2.680 . 0 0 "[ . 1 . 2 . ]" 1 1010 1 44 LEU H 1 44 LEU HB3 2.665 . 3.530 2.864 2.673 3.043 . 0 0 "[ . 1 . 2 . ]" 1 1011 1 44 LEU H 1 44 LEU MD1 3.140 . 4.480 4.299 4.247 4.367 . 0 0 "[ . 1 . 2 . ]" 1 1012 1 44 LEU H 1 44 LEU MD2 2.845 . 3.890 3.933 3.760 3.988 0.098 7 0 "[ . 1 . 2 . ]" 1 1013 1 44 LEU H 1 44 LEU HG 3.375 . 4.950 4.741 4.606 4.897 . 0 0 "[ . 1 . 2 . ]" 1 1014 1 44 LEU H 1 45 GLY H 3.260 . 4.720 4.254 4.113 4.370 . 0 0 "[ . 1 . 2 . ]" 1 1015 1 44 LEU H 1 63 ILE HB 3.220 . 4.640 3.576 3.023 4.479 . 0 0 "[ . 1 . 2 . ]" 1 1016 1 44 LEU H 1 63 ILE MG 3.085 . 4.370 3.758 3.369 4.230 . 0 0 "[ . 1 . 2 . ]" 1 1017 1 44 LEU H 1 64 CYS HA 3.040 . 4.280 2.795 2.278 3.282 . 0 0 "[ . 1 . 2 . ]" 1 1018 1 44 LEU H 1 65 GLU H 3.280 . 4.760 3.517 3.088 3.949 . 0 0 "[ . 1 . 2 . ]" 1 1019 1 44 LEU HA 1 44 LEU MD1 2.315 . 2.830 2.470 2.282 2.631 . 0 0 "[ . 1 . 2 . ]" 1 1020 1 44 LEU HA 1 44 LEU MD2 2.270 . 2.740 2.008 1.902 2.084 . 0 0 "[ . 1 . 2 . ]" 1 1021 1 44 LEU HA 1 45 GLY H 2.320 . 2.840 2.139 2.036 2.238 . 0 0 "[ . 1 . 2 . ]" 1 1022 1 44 LEU HA 1 63 ILE MG 3.650 . 5.500 4.963 4.611 5.515 0.015 12 0 "[ . 1 . 2 . ]" 1 1023 1 44 LEU HB2 1 44 LEU MD2 2.385 . 2.970 2.338 2.306 2.385 . 0 0 "[ . 1 . 2 . ]" 1 1024 1 44 LEU HB2 1 45 GLY H 3.125 . 4.450 4.413 4.366 4.446 . 0 0 "[ . 1 . 2 . ]" 1 1025 1 44 LEU HB2 1 65 GLU QB 2.905 . 4.010 2.205 1.897 3.223 . 0 0 "[ . 1 . 2 . ]" 1 1026 1 44 LEU HB2 1 65 GLU QG 3.105 . 4.410 3.681 2.833 4.092 . 0 0 "[ . 1 . 2 . ]" 1 1027 1 44 LEU HB3 1 44 LEU MD1 2.425 . 3.050 2.400 2.336 2.441 . 0 0 "[ . 1 . 2 . ]" 1 1028 1 44 LEU HB3 1 44 LEU MD2 2.525 . 3.250 3.188 3.174 3.213 . 0 0 "[ . 1 . 2 . ]" 1 1029 1 44 LEU HB3 1 45 GLY H 2.820 . 3.840 3.810 3.563 3.872 0.032 12 0 "[ . 1 . 2 . ]" 1 1030 1 44 LEU HB3 1 63 ILE H 3.585 . 5.370 4.457 3.805 5.133 . 0 0 "[ . 1 . 2 . ]" 1 1031 1 44 LEU HB3 1 63 ILE MG 2.785 . 3.770 2.571 2.135 3.172 . 0 0 "[ . 1 . 2 . ]" 1 1032 1 44 LEU HB3 1 65 GLU QB 3.125 . 4.450 3.328 2.981 4.454 0.004 10 0 "[ . 1 . 2 . ]" 1 1033 1 44 LEU HB3 1 65 GLU QG 3.490 . 5.180 4.485 3.295 5.078 . 0 0 "[ . 1 . 2 . ]" 1 1034 1 44 LEU MD1 1 45 GLY H 2.860 . 3.920 2.179 2.045 2.332 . 0 0 "[ . 1 . 2 . ]" 1 1035 1 44 LEU MD1 1 65 GLU QB 2.900 . 4.000 3.888 3.686 4.120 0.120 12 0 "[ . 1 . 2 . ]" 1 1036 1 44 LEU MD1 1 65 GLU QG 3.000 . 4.200 4.137 3.594 4.302 0.102 26 0 "[ . 1 . 2 . ]" 1 1037 1 44 LEU MD2 1 45 GLY H 2.730 . 3.660 3.324 3.039 3.600 . 0 0 "[ . 1 . 2 . ]" 1 1038 1 44 LEU MD2 1 65 GLU H 3.040 . 4.280 3.819 3.094 4.092 . 0 0 "[ . 1 . 2 . ]" 1 1039 1 44 LEU MD2 1 65 GLU HA 3.355 . 4.910 4.755 4.408 4.920 0.010 22 0 "[ . 1 . 2 . ]" 1 1040 1 44 LEU MD2 1 65 GLU QB 2.310 . 2.820 2.114 1.945 2.297 . 0 0 "[ . 1 . 2 . ]" 1 1041 1 44 LEU MD2 1 65 GLU QG 2.515 . 3.230 2.813 2.390 3.233 0.003 19 0 "[ . 1 . 2 . ]" 1 1042 1 44 LEU MD2 1 66 VAL H 3.650 . 5.500 5.414 5.220 5.544 0.044 24 0 "[ . 1 . 2 . ]" 1 1043 1 44 LEU HG 1 45 GLY H 3.255 . 4.710 4.757 4.653 4.822 0.112 12 0 "[ . 1 . 2 . ]" 1 1044 1 44 LEU HG 1 65 GLU H 3.555 . 5.310 4.779 4.379 5.222 . 0 0 "[ . 1 . 2 . ]" 1 1045 1 44 LEU HG 1 65 GLU QB 2.540 . 3.280 2.557 2.226 2.895 . 0 0 "[ . 1 . 2 . ]" 1 1046 1 45 GLY H 1 46 GLU QG 3.520 . 5.240 5.018 4.719 5.278 0.038 12 0 "[ . 1 . 2 . ]" 1 1047 1 45 GLY HA2 1 46 GLU H 2.395 . 2.990 2.580 2.328 2.851 . 0 0 "[ . 1 . 2 . ]" 1 1048 1 45 GLY HA2 1 46 GLU QG 2.765 . 3.730 3.496 3.269 3.788 0.058 12 0 "[ . 1 . 2 . ]" 1 1049 1 45 GLY HA2 1 47 ILE H 3.275 . 4.750 4.314 3.948 4.723 . 0 0 "[ . 1 . 2 . ]" 1 1050 1 45 GLY HA3 1 46 GLU H 2.300 . 2.800 2.524 2.222 2.795 . 0 0 "[ . 1 . 2 . ]" 1 1051 1 45 GLY HA3 1 47 ILE H 2.760 . 3.720 3.440 3.011 3.734 0.014 23 0 "[ . 1 . 2 . ]" 1 1052 1 46 GLU H 1 46 GLU HB2 2.315 . 2.830 2.523 2.375 2.777 . 0 0 "[ . 1 . 2 . ]" 1 1053 1 46 GLU H 1 46 GLU HB3 2.820 . 3.840 3.629 3.553 3.703 . 0 0 "[ . 1 . 2 . ]" 1 1054 1 46 GLU H 1 46 GLU QG 2.375 . 2.950 2.410 2.130 3.020 0.070 12 0 "[ . 1 . 2 . ]" 1 1055 1 46 GLU H 1 47 ILE H 2.295 . 2.790 2.073 1.895 2.274 . 0 0 "[ . 1 . 2 . ]" 1 1056 1 46 GLU H 1 47 ILE HB 3.145 . 4.490 4.220 4.053 4.459 . 0 0 "[ . 1 . 2 . ]" 1 1057 1 46 GLU H 1 47 ILE MD 3.225 . 4.650 4.672 4.556 4.725 0.075 4 0 "[ . 1 . 2 . ]" 1 1058 1 46 GLU H 1 47 ILE HG12 2.830 . 3.860 3.637 3.408 3.716 . 0 0 "[ . 1 . 2 . ]" 1 1059 1 46 GLU H 1 47 ILE HG13 3.505 . 5.210 5.203 4.963 5.253 0.043 18 0 "[ . 1 . 2 . ]" 1 1060 1 46 GLU HA 1 46 GLU HB3 2.295 . 2.790 2.422 2.329 2.477 . 0 0 "[ . 1 . 2 . ]" 1 1061 1 46 GLU HA 1 46 GLU QG 2.255 . 2.710 2.592 2.449 2.838 0.128 15 0 "[ . 1 . 2 . ]" 1 1062 1 46 GLU HB2 1 47 ILE H 2.625 . 3.450 2.699 2.281 3.156 . 0 0 "[ . 1 . 2 . ]" 1 1063 1 46 GLU HB2 1 47 ILE MD 3.000 . 4.200 3.320 3.025 3.628 . 0 0 "[ . 1 . 2 . ]" 1 1064 1 46 GLU HB2 1 47 ILE HG12 3.005 . 4.210 2.870 2.556 3.110 . 0 0 "[ . 1 . 2 . ]" 1 1065 1 46 GLU HB2 1 47 ILE HG13 3.305 . 4.810 4.597 4.284 4.835 0.025 20 0 "[ . 1 . 2 . ]" 1 1066 1 46 GLU HB3 1 47 ILE H 3.085 . 4.370 3.818 3.510 4.080 . 0 0 "[ . 1 . 2 . ]" 1 1067 1 46 GLU HB3 1 47 ILE MD 2.985 . 4.170 3.851 3.426 4.117 . 0 0 "[ . 1 . 2 . ]" 1 1068 1 46 GLU HB3 1 47 ILE HG12 3.305 . 4.810 4.281 3.858 4.608 . 0 0 "[ . 1 . 2 . ]" 1 1069 1 46 GLU QG 1 47 ILE H 2.975 . 4.150 3.896 3.647 4.152 0.002 9 0 "[ . 1 . 2 . ]" 1 1070 1 46 GLU QG 1 47 ILE HG12 3.220 . 4.640 4.612 4.414 4.702 0.062 20 0 "[ . 1 . 2 . ]" 1 1071 1 47 ILE H 1 47 ILE HB 2.320 . 2.840 2.443 2.359 2.536 . 0 0 "[ . 1 . 2 . ]" 1 1072 1 47 ILE H 1 47 ILE MD 2.715 . 3.630 3.340 3.147 3.551 . 0 0 "[ . 1 . 2 . ]" 1 1073 1 47 ILE H 1 47 ILE HG12 2.480 . 3.160 2.309 2.084 2.594 . 0 0 "[ . 1 . 2 . ]" 1 1074 1 47 ILE H 1 47 ILE HG13 2.865 . 3.930 3.713 3.545 3.935 0.005 6 0 "[ . 1 . 2 . ]" 1 1075 1 47 ILE H 1 47 ILE MG 2.875 . 3.950 3.743 3.698 3.776 . 0 0 "[ . 1 . 2 . ]" 1 1076 1 47 ILE HA 1 47 ILE MD 2.315 . 2.830 2.081 2.000 2.121 . 0 0 "[ . 1 . 2 . ]" 1 1077 1 47 ILE HA 1 47 ILE HG12 2.550 . 3.300 3.105 3.045 3.145 . 0 0 "[ . 1 . 2 . ]" 1 1078 1 47 ILE HA 1 47 ILE HG13 2.855 . 3.910 3.763 3.702 3.804 . 0 0 "[ . 1 . 2 . ]" 1 1079 1 47 ILE HA 1 47 ILE MG 2.200 . 2.600 2.429 2.342 2.475 . 0 0 "[ . 1 . 2 . ]" 1 1080 1 47 ILE HA 1 48 ASN H 2.290 . 2.780 2.192 2.082 2.275 . 0 0 "[ . 1 . 2 . ]" 1 1081 1 47 ILE HA 1 49 TYR H 2.785 . 3.770 3.481 3.186 3.690 . 0 0 "[ . 1 . 2 . ]" 1 1082 1 47 ILE HA 1 49 TYR QD 3.100 . 4.400 3.505 2.860 4.011 . 0 0 "[ . 1 . 2 . ]" 1 1083 1 47 ILE HA 1 49 TYR QE 3.045 . 4.290 3.518 2.627 4.082 . 0 0 "[ . 1 . 2 . ]" 1 1084 1 47 ILE HB 1 47 ILE MD 2.535 . 3.270 3.244 3.217 3.257 . 0 0 "[ . 1 . 2 . ]" 1 1085 1 47 ILE HB 1 48 ASN H 3.035 . 4.270 4.212 4.067 4.275 0.005 4 0 "[ . 1 . 2 . ]" 1 1086 1 47 ILE HB 1 49 TYR H 3.235 . 4.670 4.431 4.198 4.682 0.012 1 0 "[ . 1 . 2 . ]" 1 1087 1 47 ILE MD 1 48 ASN H 2.810 . 3.820 3.775 3.661 3.830 0.010 25 0 "[ . 1 . 2 . ]" 1 1088 1 47 ILE MD 1 49 TYR H 3.225 . 4.650 4.224 3.940 4.442 . 0 0 "[ . 1 . 2 . ]" 1 1089 1 47 ILE MD 1 49 TYR QE 2.700 . 3.600 3.055 2.106 3.601 0.001 22 0 "[ . 1 . 2 . ]" 1 1090 1 47 ILE MD 1 59 ASN HD21 3.065 . 4.330 2.925 2.085 3.682 . 0 0 "[ . 1 . 2 . ]" 1 1091 1 47 ILE MD 1 59 ASN HD22 2.835 . 3.870 2.652 2.126 3.187 . 0 0 "[ . 1 . 2 . ]" 1 1092 1 47 ILE MD 1 60 ASP H 3.650 . 5.500 5.381 4.806 5.545 0.045 2 0 "[ . 1 . 2 . ]" 1 1093 1 47 ILE HG12 1 47 ILE MG 2.510 . 3.220 3.209 3.193 3.222 0.002 1 0 "[ . 1 . 2 . ]" 1 1094 1 47 ILE HG13 1 47 ILE MG 2.290 . 2.780 2.363 2.323 2.411 . 0 0 "[ . 1 . 2 . ]" 1 1095 1 47 ILE HG13 1 59 ASN HD21 3.260 . 4.720 4.074 3.010 4.749 0.029 21 0 "[ . 1 . 2 . ]" 1 1096 1 47 ILE HG13 1 59 ASN HD22 3.290 . 4.780 4.437 3.944 4.806 0.026 9 0 "[ . 1 . 2 . ]" 1 1097 1 47 ILE HG13 1 60 ASP H 3.595 . 5.390 4.860 4.040 5.388 . 0 0 "[ . 1 . 2 . ]" 1 1098 1 47 ILE MG 1 48 ASN H 2.330 . 2.860 2.780 2.495 2.911 0.051 29 0 "[ . 1 . 2 . ]" 1 1099 1 47 ILE MG 1 49 TYR H 2.220 . 2.640 2.169 1.919 2.435 . 0 0 "[ . 1 . 2 . ]" 1 1100 1 47 ILE MG 1 49 TYR HA 3.255 . 4.710 4.339 4.161 4.517 . 0 0 "[ . 1 . 2 . ]" 1 1101 1 47 ILE MG 1 49 TYR QD 2.980 . 4.160 3.370 2.815 3.779 . 0 0 "[ . 1 . 2 . ]" 1 1102 1 47 ILE MG 1 49 TYR QE 2.910 . 4.020 3.569 2.750 4.059 0.039 29 0 "[ . 1 . 2 . ]" 1 1103 1 47 ILE MG 1 59 ASN HB2 3.045 . 4.290 3.149 2.855 3.461 . 0 0 "[ . 1 . 2 . ]" 1 1104 1 47 ILE MG 1 59 ASN HB3 2.590 . 3.380 2.167 1.968 2.487 . 0 0 "[ . 1 . 2 . ]" 1 1105 1 47 ILE MG 1 59 ASN HD21 2.615 . 3.430 2.315 1.784 2.515 0.016 16 0 "[ . 1 . 2 . ]" 1 1106 1 47 ILE MG 1 59 ASN HD22 2.445 . 3.090 3.008 2.821 3.123 0.033 9 0 "[ . 1 . 2 . ]" 1 1107 1 47 ILE MG 1 60 ASP H 3.060 . 4.320 3.346 2.869 3.674 . 0 0 "[ . 1 . 2 . ]" 1 1108 1 48 ASN H 1 48 ASN HB2 2.890 . 3.980 3.822 3.735 3.885 . 0 0 "[ . 1 . 2 . ]" 1 1109 1 48 ASN H 1 48 ASN HB3 2.600 . 3.400 3.044 2.816 3.246 . 0 0 "[ . 1 . 2 . ]" 1 1110 1 48 ASN H 1 48 ASN HD21 3.405 . 5.010 4.501 4.168 4.830 . 0 0 "[ . 1 . 2 . ]" 1 1111 1 48 ASN H 1 48 ASN HD22 3.330 . 4.860 4.575 4.236 4.837 . 0 0 "[ . 1 . 2 . ]" 1 1112 1 48 ASN H 1 49 TYR H 2.225 . 2.650 2.052 1.904 2.164 . 0 0 "[ . 1 . 2 . ]" 1 1113 1 48 ASN H 1 49 TYR HA 3.290 . 4.780 4.528 4.420 4.626 . 0 0 "[ . 1 . 2 . ]" 1 1114 1 48 ASN H 1 49 TYR HB2 3.605 . 5.410 5.174 5.005 5.326 . 0 0 "[ . 1 . 2 . ]" 1 1115 1 48 ASN H 1 49 TYR HB3 3.150 . 4.500 3.892 3.662 4.061 . 0 0 "[ . 1 . 2 . ]" 1 1116 1 48 ASN H 1 49 TYR QD 2.375 . 2.950 2.189 1.797 2.477 0.003 8 0 "[ . 1 . 2 . ]" 1 1117 1 48 ASN H 1 49 TYR QE 3.145 . 4.490 3.695 3.302 4.121 . 0 0 "[ . 1 . 2 . ]" 1 1118 1 48 ASN H 1 62 PRO HB2 3.650 . 5.500 5.430 5.232 5.571 0.071 27 0 "[ . 1 . 2 . ]" 1 1119 1 48 ASN H 1 62 PRO QB 3.325 . 4.850 4.134 3.797 4.375 . 0 0 "[ . 1 . 2 . ]" 1 1120 1 48 ASN H 1 62 PRO HB3 3.650 . 5.500 4.290 3.899 4.619 . 0 0 "[ . 1 . 2 . ]" 1 1121 1 48 ASN H 1 62 PRO HG3 3.650 . 5.500 4.498 3.822 4.882 . 0 0 "[ . 1 . 2 . ]" 1 1122 1 48 ASN HA 1 48 ASN HD21 3.145 . 4.490 4.031 3.896 4.400 . 0 0 "[ . 1 . 2 . ]" 1 1123 1 48 ASN HA 1 48 ASN HD22 3.505 . 5.210 5.128 5.069 5.274 0.064 18 0 "[ . 1 . 2 . ]" 1 1124 1 48 ASN HA 1 49 TYR H 2.540 . 3.280 3.158 3.048 3.260 . 0 0 "[ . 1 . 2 . ]" 1 1125 1 48 ASN HA 1 62 PRO HB2 2.995 . 4.190 2.856 2.582 3.138 . 0 0 "[ . 1 . 2 . ]" 1 1126 1 48 ASN HA 1 62 PRO QB 2.670 . 3.540 2.316 1.945 2.700 . 0 0 "[ . 1 . 2 . ]" 1 1127 1 48 ASN HA 1 62 PRO HB3 2.995 . 4.190 2.468 1.985 2.963 . 0 0 "[ . 1 . 2 . ]" 1 1128 1 48 ASN HA 1 62 PRO HG2 2.815 . 3.830 3.452 2.745 3.787 . 0 0 "[ . 1 . 2 . ]" 1 1129 1 48 ASN HA 1 62 PRO HG3 2.930 . 4.060 2.432 2.087 2.839 . 0 0 "[ . 1 . 2 . ]" 1 1130 1 48 ASN HB2 1 48 ASN HD22 2.775 . 3.750 3.465 3.395 3.503 . 0 0 "[ . 1 . 2 . ]" 1 1131 1 48 ASN HB2 1 49 TYR H 3.260 . 4.720 4.467 4.369 4.551 . 0 0 "[ . 1 . 2 . ]" 1 1132 1 48 ASN HB3 1 49 TYR H 3.210 . 4.620 4.425 4.248 4.527 . 0 0 "[ . 1 . 2 . ]" 1 1133 1 48 ASN HD21 1 62 PRO HG3 3.600 . 5.400 5.202 4.616 5.468 0.068 29 0 "[ . 1 . 2 . ]" 1 1134 1 49 TYR H 1 49 TYR HB2 2.990 . 4.180 3.897 3.813 4.003 . 0 0 "[ . 1 . 2 . ]" 1 1135 1 49 TYR H 1 49 TYR HB3 2.720 . 3.640 3.195 3.033 3.336 . 0 0 "[ . 1 . 2 . ]" 1 1136 1 49 TYR H 1 50 ARG H 3.095 . 4.390 4.292 4.212 4.375 . 0 0 "[ . 1 . 2 . ]" 1 1137 1 49 TYR H 1 50 ARG HG3 3.440 . 5.080 4.886 4.702 5.059 . 0 0 "[ . 1 . 2 . ]" 1 1138 1 49 TYR H 1 59 ASN HD22 3.565 . 5.330 5.115 4.662 5.388 0.058 5 0 "[ . 1 . 2 . ]" 1 1139 1 49 TYR H 1 62 PRO HB2 3.545 . 5.290 5.251 4.991 5.338 0.048 11 0 "[ . 1 . 2 . ]" 1 1140 1 49 TYR H 1 62 PRO QB 3.225 . 4.650 3.825 3.504 4.069 . 0 0 "[ . 1 . 2 . ]" 1 1141 1 49 TYR H 1 62 PRO HB3 3.545 . 5.290 3.931 3.579 4.225 . 0 0 "[ . 1 . 2 . ]" 1 1142 1 49 TYR H 1 62 PRO HG3 3.250 . 4.700 3.477 2.544 3.798 . 0 0 "[ . 1 . 2 . ]" 1 1143 1 49 TYR HA 1 49 TYR QD 2.960 . 4.120 3.747 3.704 3.773 . 0 0 "[ . 1 . 2 . ]" 1 1144 1 49 TYR HA 1 50 ARG H 2.400 . 3.000 2.344 2.213 2.418 . 0 0 "[ . 1 . 2 . ]" 1 1145 1 49 TYR HA 1 50 ARG HG3 3.265 . 4.730 3.783 3.639 3.970 . 0 0 "[ . 1 . 2 . ]" 1 1146 1 49 TYR HA 1 62 PRO HG3 3.335 . 4.870 3.747 3.405 4.078 . 0 0 "[ . 1 . 2 . ]" 1 1147 1 49 TYR HB2 1 50 ARG H 2.700 . 3.600 2.559 2.359 2.695 . 0 0 "[ . 1 . 2 . ]" 1 1148 1 49 TYR HB2 1 50 ARG HG3 3.520 . 5.240 5.215 5.024 5.290 0.050 21 0 "[ . 1 . 2 . ]" 1 1149 1 49 TYR HB2 1 51 GLU H 3.650 . 5.500 5.249 4.777 5.515 0.015 1 0 "[ . 1 . 2 . ]" 1 1150 1 49 TYR HB3 1 50 ARG H 3.065 . 4.330 3.882 3.738 3.969 . 0 0 "[ . 1 . 2 . ]" 1 1151 1 49 TYR QD 1 50 ARG H 2.935 . 4.070 3.360 3.196 3.618 . 0 0 "[ . 1 . 2 . ]" 1 1152 1 49 TYR QD 1 50 ARG HG3 3.650 . 5.500 5.549 5.518 5.623 0.123 29 0 "[ . 1 . 2 . ]" 1 1153 1 49 TYR QD 1 51 GLU H 3.145 . 4.490 3.562 2.889 4.023 . 0 0 "[ . 1 . 2 . ]" 1 1154 1 49 TYR QD 1 51 GLU HA 3.595 . 5.390 3.500 3.300 3.680 . 0 0 "[ . 1 . 2 . ]" 1 1155 1 49 TYR QD 1 51 GLU HB2 2.795 . 3.790 2.716 2.503 2.938 . 0 0 "[ . 1 . 2 . ]" 1 1156 1 49 TYR QD 1 59 ASN HD22 3.370 . 4.940 4.475 3.725 4.897 . 0 0 "[ . 1 . 2 . ]" 1 1157 1 49 TYR QE 1 51 GLU H 3.185 . 4.570 3.795 3.324 4.226 . 0 0 "[ . 1 . 2 . ]" 1 1158 1 49 TYR QE 1 51 GLU HB2 2.730 . 3.660 2.181 1.916 2.569 . 0 0 "[ . 1 . 2 . ]" 1 1159 1 49 TYR QE 1 51 GLU HB3 3.065 . 4.330 3.261 2.972 3.695 . 0 0 "[ . 1 . 2 . ]" 1 1160 1 49 TYR QE 1 59 ASN HD22 2.925 . 4.050 3.483 2.930 4.066 0.016 16 0 "[ . 1 . 2 . ]" 1 1161 1 50 ARG H 1 50 ARG HB2 2.890 . 3.980 2.680 2.612 2.774 . 0 0 "[ . 1 . 2 . ]" 1 1162 1 50 ARG H 1 50 ARG HD2 3.535 . 5.270 5.253 5.056 5.323 0.053 9 0 "[ . 1 . 2 . ]" 1 1163 1 50 ARG H 1 50 ARG HE 3.650 . 5.500 5.372 5.261 5.510 0.010 2 0 "[ . 1 . 2 . ]" 1 1164 1 50 ARG H 1 50 ARG HG2 3.120 . 4.440 3.859 3.709 3.989 . 0 0 "[ . 1 . 2 . ]" 1 1165 1 50 ARG H 1 50 ARG HG3 3.045 . 4.290 2.896 2.657 2.996 . 0 0 "[ . 1 . 2 . ]" 1 1166 1 50 ARG H 1 51 GLU HA 3.425 . 5.050 4.491 4.367 4.588 . 0 0 "[ . 1 . 2 . ]" 1 1167 1 50 ARG HA 1 51 GLU H 2.615 . 3.430 2.223 2.146 2.328 . 0 0 "[ . 1 . 2 . ]" 1 1168 1 50 ARG HB2 1 50 ARG HE 2.830 . 3.860 3.258 3.148 3.344 . 0 0 "[ . 1 . 2 . ]" 1 1169 1 50 ARG HB2 1 51 GLU H 3.650 . 5.500 4.097 3.911 4.252 . 0 0 "[ . 1 . 2 . ]" 1 1170 1 50 ARG HB2 1 57 TRP HA 3.650 . 5.500 4.726 4.479 5.175 . 0 0 "[ . 1 . 2 . ]" 1 1171 1 50 ARG HB2 1 57 TRP HE3 3.000 . 4.200 2.653 2.394 2.842 . 0 0 "[ . 1 . 2 . ]" 1 1172 1 50 ARG HB3 1 50 ARG HE 2.930 . 4.060 1.967 1.801 2.121 . 0 0 "[ . 1 . 2 . ]" 1 1173 1 50 ARG HB3 1 51 GLU H 3.045 . 4.290 3.288 2.966 3.573 . 0 0 "[ . 1 . 2 . ]" 1 1174 1 50 ARG HB3 1 52 CYS H 3.650 . 5.500 5.536 5.493 5.568 0.068 15 0 "[ . 1 . 2 . ]" 1 1175 1 50 ARG HB3 1 57 TRP HA 3.650 . 5.500 3.694 3.509 3.981 . 0 0 "[ . 1 . 2 . ]" 1 1176 1 50 ARG HB3 1 57 TRP HE3 3.020 . 4.240 2.618 2.464 2.757 . 0 0 "[ . 1 . 2 . ]" 1 1177 1 50 ARG HB3 1 58 THR H 3.220 . 4.640 3.926 3.584 4.259 . 0 0 "[ . 1 . 2 . ]" 1 1178 1 50 ARG HD2 1 61 ILE HA 3.305 . 4.810 2.455 2.189 2.835 . 0 0 "[ . 1 . 2 . ]" 1 1179 1 50 ARG HD2 1 61 ILE HG12 3.315 . 4.830 2.823 2.458 3.159 . 0 0 "[ . 1 . 2 . ]" 1 1180 1 50 ARG HD2 1 61 ILE HG13 3.545 . 5.290 3.129 2.589 3.531 . 0 0 "[ . 1 . 2 . ]" 1 1181 1 50 ARG HD2 1 61 ILE MG 3.650 . 5.500 4.081 3.706 4.373 . 0 0 "[ . 1 . 2 . ]" 1 1182 1 50 ARG HD2 1 62 PRO QD 3.520 . 5.240 3.371 2.753 3.935 . 0 0 "[ . 1 . 2 . ]" 1 1183 1 50 ARG HD3 1 57 TRP HE3 3.645 . 5.490 4.378 4.127 4.573 . 0 0 "[ . 1 . 2 . ]" 1 1184 1 50 ARG HD3 1 61 ILE H 3.520 . 5.240 5.021 4.663 5.253 0.013 14 0 "[ . 1 . 2 . ]" 1 1185 1 50 ARG HD3 1 61 ILE HA 3.220 . 4.640 4.003 3.665 4.338 . 0 0 "[ . 1 . 2 . ]" 1 1186 1 50 ARG HE 1 50 ARG HG2 2.765 . 3.730 2.476 2.387 2.590 . 0 0 "[ . 1 . 2 . ]" 1 1187 1 50 ARG HE 1 50 ARG HG3 2.910 . 4.020 3.524 3.463 3.617 . 0 0 "[ . 1 . 2 . ]" 1 1188 1 50 ARG HE 1 51 GLU H 3.650 . 5.500 4.810 4.271 5.183 . 0 0 "[ . 1 . 2 . ]" 1 1189 1 50 ARG HE 1 57 TRP H 3.650 . 5.500 5.541 5.454 5.578 0.078 12 0 "[ . 1 . 2 . ]" 1 1190 1 50 ARG HE 1 57 TRP HA 3.390 . 4.980 4.339 4.114 4.585 . 0 0 "[ . 1 . 2 . ]" 1 1191 1 50 ARG HE 1 57 TRP HB2 2.965 . 4.130 3.312 3.058 3.488 . 0 0 "[ . 1 . 2 . ]" 1 1192 1 50 ARG HE 1 57 TRP HB3 3.035 . 4.270 2.194 2.062 2.376 . 0 0 "[ . 1 . 2 . ]" 1 1193 1 50 ARG HE 1 57 TRP HE3 3.055 . 4.310 4.133 3.902 4.323 0.013 15 0 "[ . 1 . 2 . ]" 1 1194 1 50 ARG HE 1 58 THR H 3.460 . 5.120 4.587 4.176 4.973 . 0 0 "[ . 1 . 2 . ]" 1 1195 1 50 ARG HE 1 59 ASN HB2 3.365 . 4.930 3.723 3.324 4.500 . 0 0 "[ . 1 . 2 . ]" 1 1196 1 50 ARG HE 1 60 ASP H 3.390 . 4.980 4.616 4.352 4.897 . 0 0 "[ . 1 . 2 . ]" 1 1197 1 50 ARG HE 1 60 ASP HA 2.915 . 4.030 3.266 2.638 4.063 0.033 6 0 "[ . 1 . 2 . ]" 1 1198 1 50 ARG HE 1 61 ILE H 3.395 . 4.990 4.853 4.420 5.057 0.067 23 0 "[ . 1 . 2 . ]" 1 1199 1 50 ARG HE 1 61 ILE HA 3.615 . 5.430 5.004 4.494 5.422 . 0 0 "[ . 1 . 2 . ]" 1 1200 1 50 ARG HE 1 61 ILE HG12 3.650 . 5.500 5.353 4.998 5.547 0.047 22 0 "[ . 1 . 2 . ]" 1 1201 1 50 ARG HG2 1 51 GLU H 3.345 . 4.890 4.587 4.452 4.797 . 0 0 "[ . 1 . 2 . ]" 1 1202 1 50 ARG HG2 1 57 TRP HE3 3.550 . 5.300 5.017 4.882 5.157 . 0 0 "[ . 1 . 2 . ]" 1 1203 1 50 ARG HG2 1 60 ASP H 3.375 . 4.950 3.820 3.454 4.132 . 0 0 "[ . 1 . 2 . ]" 1 1204 1 50 ARG HG3 1 51 GLU H 3.625 . 5.450 5.243 5.100 5.366 . 0 0 "[ . 1 . 2 . ]" 1 1205 1 50 ARG HG3 1 57 TRP HE3 3.635 . 5.470 4.966 4.758 5.117 . 0 0 "[ . 1 . 2 . ]" 1 1206 1 51 GLU H 1 51 GLU HB2 2.735 . 3.670 2.855 2.627 3.015 . 0 0 "[ . 1 . 2 . ]" 1 1207 1 51 GLU H 1 51 GLU HB3 2.770 . 3.740 2.532 2.425 2.624 . 0 0 "[ . 1 . 2 . ]" 1 1208 1 51 GLU H 1 52 CYS H 3.285 . 4.770 4.418 4.321 4.526 . 0 0 "[ . 1 . 2 . ]" 1 1209 1 51 GLU H 1 52 CYS HA 3.575 . 5.350 4.896 4.658 5.249 . 0 0 "[ . 1 . 2 . ]" 1 1210 1 51 GLU H 1 57 TRP HA 3.430 . 5.060 4.256 3.987 4.648 . 0 0 "[ . 1 . 2 . ]" 1 1211 1 51 GLU H 1 57 TRP HB3 3.650 . 5.500 4.731 4.384 5.052 . 0 0 "[ . 1 . 2 . ]" 1 1212 1 51 GLU H 1 57 TRP HE3 3.370 . 4.940 3.721 3.331 4.002 . 0 0 "[ . 1 . 2 . ]" 1 1213 1 51 GLU H 1 58 THR H 2.945 . 4.090 3.156 2.768 3.707 . 0 0 "[ . 1 . 2 . ]" 1 1214 1 51 GLU H 1 58 THR HB 3.305 . 4.810 4.327 3.877 4.821 0.011 2 0 "[ . 1 . 2 . ]" 1 1215 1 51 GLU H 1 58 THR MG 3.005 . 4.210 3.903 3.526 4.252 0.042 5 0 "[ . 1 . 2 . ]" 1 1216 1 51 GLU H 1 59 ASN HB2 3.365 . 4.930 3.650 3.004 4.032 . 0 0 "[ . 1 . 2 . ]" 1 1217 1 51 GLU H 1 59 ASN HB3 3.650 . 5.500 5.177 4.647 5.588 0.088 20 0 "[ . 1 . 2 . ]" 1 1218 1 51 GLU H 1 59 ASN HD21 3.315 . 4.830 4.288 3.447 4.948 0.118 14 0 "[ . 1 . 2 . ]" 1 1219 1 51 GLU H 1 59 ASN HD22 3.635 . 5.470 4.443 3.695 5.262 . 0 0 "[ . 1 . 2 . ]" 1 1220 1 51 GLU HA 1 51 GLU HG2 2.915 . 4.030 3.166 3.012 3.356 . 0 0 "[ . 1 . 2 . ]" 1 1221 1 51 GLU HA 1 51 GLU QG 2.660 . 3.520 2.447 2.377 2.531 . 0 0 "[ . 1 . 2 . ]" 1 1222 1 51 GLU HA 1 51 GLU HG3 2.915 . 4.030 2.548 2.468 2.634 . 0 0 "[ . 1 . 2 . ]" 1 1223 1 51 GLU HA 1 52 CYS H 2.350 . 2.900 2.169 2.089 2.234 . 0 0 "[ . 1 . 2 . ]" 1 1224 1 51 GLU HA 1 52 CYS HB3 3.585 . 5.370 4.839 4.504 5.060 . 0 0 "[ . 1 . 2 . ]" 1 1225 1 51 GLU HA 1 53 ASP H 3.650 . 5.500 5.352 5.049 5.533 0.033 1 0 "[ . 1 . 2 . ]" 1 1226 1 51 GLU HA 1 57 TRP HE3 3.060 . 4.320 3.437 3.206 3.622 . 0 0 "[ . 1 . 2 . ]" 1 1227 1 51 GLU HA 1 57 TRP HZ3 3.175 . 4.550 3.231 2.953 3.543 . 0 0 "[ . 1 . 2 . ]" 1 1228 1 51 GLU HA 1 58 THR H 3.430 . 5.060 4.645 4.365 4.893 . 0 0 "[ . 1 . 2 . ]" 1 1229 1 51 GLU HB2 1 52 CYS H 3.150 . 4.500 4.250 4.105 4.438 . 0 0 "[ . 1 . 2 . ]" 1 1230 1 51 GLU HB2 1 58 THR MG 3.235 . 4.670 4.610 4.189 4.731 0.061 24 0 "[ . 1 . 2 . ]" 1 1231 1 51 GLU HB3 1 52 CYS H 3.155 . 4.510 4.164 4.033 4.307 . 0 0 "[ . 1 . 2 . ]" 1 1232 1 51 GLU HB3 1 53 ASP QB 3.570 . 5.340 4.019 3.545 4.629 . 0 0 "[ . 1 . 2 . ]" 1 1233 1 51 GLU HB3 1 58 THR H 3.165 . 4.530 3.888 3.708 4.099 . 0 0 "[ . 1 . 2 . ]" 1 1234 1 51 GLU HB3 1 58 THR MG 2.655 . 3.510 3.140 2.696 3.263 . 0 0 "[ . 1 . 2 . ]" 1 1235 1 51 GLU QG 1 52 CYS H 2.555 . 3.310 2.803 2.541 3.046 . 0 0 "[ . 1 . 2 . ]" 1 1236 1 51 GLU QG 1 53 ASP H 3.280 . 4.760 3.985 3.575 4.344 . 0 0 "[ . 1 . 2 . ]" 1 1237 1 51 GLU QG 1 53 ASP QB 3.275 . 4.750 3.414 2.512 3.833 . 0 0 "[ . 1 . 2 . ]" 1 1238 1 51 GLU QG 1 58 THR H 3.375 . 4.950 4.689 4.402 4.875 . 0 0 "[ . 1 . 2 . ]" 1 1239 1 51 GLU QG 1 58 THR MG 2.840 . 3.880 3.755 3.280 3.915 0.035 6 0 "[ . 1 . 2 . ]" 1 1240 1 51 GLU HG2 1 52 CYS H 2.895 . 3.990 3.171 2.834 3.510 . 0 0 "[ . 1 . 2 . ]" 1 1241 1 51 GLU HG3 1 52 CYS H 2.895 . 3.990 3.141 2.851 3.529 . 0 0 "[ . 1 . 2 . ]" 1 1242 1 52 CYS H 1 52 CYS HB2 2.520 . 3.240 2.722 2.650 2.794 . 0 0 "[ . 1 . 2 . ]" 1 1243 1 52 CYS H 1 52 CYS HB3 2.790 . 3.780 2.675 2.391 2.835 . 0 0 "[ . 1 . 2 . ]" 1 1244 1 52 CYS H 1 53 ASP H 3.135 . 4.470 4.208 4.031 4.316 . 0 0 "[ . 1 . 2 . ]" 1 1245 1 52 CYS H 1 53 ASP QB 3.570 . 5.340 5.204 4.849 5.351 0.011 13 0 "[ . 1 . 2 . ]" 1 1246 1 52 CYS H 1 57 TRP HA 3.185 . 4.570 4.157 4.029 4.270 . 0 0 "[ . 1 . 2 . ]" 1 1247 1 52 CYS H 1 57 TRP HE3 2.925 . 4.050 3.338 3.210 3.454 . 0 0 "[ . 1 . 2 . ]" 1 1248 1 52 CYS H 1 57 TRP HH2 3.360 . 4.920 4.667 4.430 4.886 . 0 0 "[ . 1 . 2 . ]" 1 1249 1 52 CYS H 1 57 TRP HZ3 3.000 . 4.200 2.991 2.749 3.168 . 0 0 "[ . 1 . 2 . ]" 1 1250 1 52 CYS H 1 58 THR H 3.415 . 5.030 4.689 4.556 4.860 . 0 0 "[ . 1 . 2 . ]" 1 1251 1 52 CYS HA 1 53 ASP H 2.310 . 2.820 2.061 1.992 2.180 . 0 0 "[ . 1 . 2 . ]" 1 1252 1 52 CYS HA 1 53 ASP HA 3.175 . 4.550 4.381 4.348 4.427 . 0 0 "[ . 1 . 2 . ]" 1 1253 1 52 CYS HA 1 53 ASP QB 3.085 . 4.370 4.056 3.910 4.188 . 0 0 "[ . 1 . 2 . ]" 1 1254 1 52 CYS HA 1 57 TRP H 3.200 . 4.600 3.902 3.715 4.088 . 0 0 "[ . 1 . 2 . ]" 1 1255 1 52 CYS HA 1 57 TRP HA 2.650 . 3.500 2.200 2.036 2.317 . 0 0 "[ . 1 . 2 . ]" 1 1256 1 52 CYS HA 1 57 TRP HE3 2.990 . 4.180 3.467 3.356 3.572 . 0 0 "[ . 1 . 2 . ]" 1 1257 1 52 CYS HA 1 58 THR H 2.820 . 3.840 3.147 2.939 3.490 . 0 0 "[ . 1 . 2 . ]" 1 1258 1 52 CYS HB2 1 53 ASP H 3.220 . 4.640 4.419 4.299 4.495 . 0 0 "[ . 1 . 2 . ]" 1 1259 1 52 CYS HB2 1 57 TRP HE3 3.510 . 5.220 3.420 3.195 3.628 . 0 0 "[ . 1 . 2 . ]" 1 1260 1 52 CYS HB2 1 57 TRP HH2 3.650 . 5.500 3.748 3.380 3.916 . 0 0 "[ . 1 . 2 . ]" 1 1261 1 52 CYS HB2 1 57 TRP HZ3 3.275 . 4.750 3.381 3.183 3.567 . 0 0 "[ . 1 . 2 . ]" 1 1262 1 52 CYS HB2 1 58 THR H 3.650 . 5.500 5.302 5.108 5.538 0.038 27 0 "[ . 1 . 2 . ]" 1 1263 1 52 CYS HB3 1 53 ASP H 3.160 . 4.520 4.256 4.146 4.464 . 0 0 "[ . 1 . 2 . ]" 1 1264 1 52 CYS HB3 1 57 TRP HE3 3.485 . 5.170 4.791 4.545 4.949 . 0 0 "[ . 1 . 2 . ]" 1 1265 1 52 CYS HB3 1 57 TRP HZ3 3.625 . 5.450 4.393 3.930 4.687 . 0 0 "[ . 1 . 2 . ]" 1 1266 1 53 ASP H 1 53 ASP HB2 2.770 . 3.740 2.672 2.520 2.910 . 0 0 "[ . 1 . 2 . ]" 1 1267 1 53 ASP H 1 53 ASP QB 2.480 . 3.160 2.372 2.236 2.491 . 0 0 "[ . 1 . 2 . ]" 1 1268 1 53 ASP H 1 53 ASP HB3 2.770 . 3.740 2.661 2.421 2.782 . 0 0 "[ . 1 . 2 . ]" 1 1269 1 53 ASP H 1 54 THR H 3.170 . 4.540 4.302 4.197 4.361 . 0 0 "[ . 1 . 2 . ]" 1 1270 1 53 ASP H 1 54 THR HA 3.650 . 5.500 5.312 5.121 5.459 . 0 0 "[ . 1 . 2 . ]" 1 1271 1 53 ASP H 1 54 THR MG 3.630 . 5.460 5.396 5.101 5.514 0.054 15 0 "[ . 1 . 2 . ]" 1 1272 1 53 ASP H 1 56 GLY H 2.695 . 3.590 3.096 2.929 3.247 . 0 0 "[ . 1 . 2 . ]" 1 1273 1 53 ASP H 1 56 GLY HA2 3.425 . 5.050 3.953 3.770 4.190 . 0 0 "[ . 1 . 2 . ]" 1 1274 1 53 ASP H 1 56 GLY QA 3.060 . 4.320 3.770 3.613 3.986 . 0 0 "[ . 1 . 2 . ]" 1 1275 1 53 ASP H 1 56 GLY HA3 3.425 . 5.050 4.759 4.615 4.996 . 0 0 "[ . 1 . 2 . ]" 1 1276 1 53 ASP H 1 57 TRP HA 2.840 . 3.880 3.452 3.216 3.699 . 0 0 "[ . 1 . 2 . ]" 1 1277 1 53 ASP H 1 57 TRP HE3 3.570 . 5.340 5.253 4.992 5.363 0.023 24 0 "[ . 1 . 2 . ]" 1 1278 1 53 ASP H 1 58 THR H 2.815 . 3.830 3.295 3.122 3.475 . 0 0 "[ . 1 . 2 . ]" 1 1279 1 53 ASP H 1 58 THR HA 3.410 . 5.020 4.940 4.694 5.083 0.063 25 0 "[ . 1 . 2 . ]" 1 1280 1 53 ASP H 1 58 THR MG 2.735 . 3.670 2.597 2.278 2.883 . 0 0 "[ . 1 . 2 . ]" 1 1281 1 53 ASP HA 1 54 THR H 2.300 . 2.800 2.739 2.570 2.812 0.012 8 0 "[ . 1 . 2 . ]" 1 1282 1 53 ASP HA 1 54 THR MG 3.070 . 4.340 4.400 4.344 4.435 0.095 11 0 "[ . 1 . 2 . ]" 1 1283 1 53 ASP HA 1 55 ASP H 3.245 . 4.690 4.376 4.082 4.711 0.021 14 0 "[ . 1 . 2 . ]" 1 1284 1 53 ASP HA 1 56 GLY H 3.220 . 4.640 4.516 4.397 4.645 0.005 7 0 "[ . 1 . 2 . ]" 1 1285 1 53 ASP HA 1 58 THR MG 3.115 . 4.430 4.200 3.994 4.407 . 0 0 "[ . 1 . 2 . ]" 1 1286 1 53 ASP QB 1 54 THR H 2.350 . 2.900 2.645 2.518 2.911 0.011 22 0 "[ . 1 . 2 . ]" 1 1287 1 53 ASP QB 1 54 THR HB 3.300 . 4.800 4.862 4.806 4.946 0.146 25 0 "[ . 1 . 2 . ]" 1 1288 1 53 ASP QB 1 55 ASP H 2.775 . 3.750 2.568 2.079 3.062 . 0 0 "[ . 1 . 2 . ]" 1 1289 1 53 ASP QB 1 56 GLY H 3.180 . 4.560 3.313 2.711 3.611 . 0 0 "[ . 1 . 2 . ]" 1 1290 1 53 ASP QB 1 58 THR H 3.185 . 4.570 4.066 3.851 4.331 . 0 0 "[ . 1 . 2 . ]" 1 1291 1 53 ASP QB 1 58 THR HA 3.570 . 5.340 4.624 4.279 5.119 . 0 0 "[ . 1 . 2 . ]" 1 1292 1 53 ASP QB 1 58 THR MG 2.285 . 2.770 2.092 1.916 2.298 . 0 0 "[ . 1 . 2 . ]" 1 1293 1 53 ASP HB2 1 54 THR H 2.780 . 3.760 3.659 3.595 3.708 . 0 0 "[ . 1 . 2 . ]" 1 1294 1 53 ASP HB2 1 58 THR MG 2.540 . 3.280 2.238 1.964 2.524 . 0 0 "[ . 1 . 2 . ]" 1 1295 1 53 ASP HB3 1 54 THR H 2.780 . 3.760 2.716 2.568 3.047 . 0 0 "[ . 1 . 2 . ]" 1 1296 1 53 ASP HB3 1 58 THR MG 2.540 . 3.280 2.565 2.290 2.841 . 0 0 "[ . 1 . 2 . ]" 1 1297 1 54 THR H 1 54 THR HA 2.320 . 2.840 2.808 2.738 2.855 0.015 4 0 "[ . 1 . 2 . ]" 1 1298 1 54 THR H 1 54 THR HB 2.400 . 3.000 2.453 2.290 2.579 . 0 0 "[ . 1 . 2 . ]" 1 1299 1 54 THR H 1 54 THR MG 2.245 . 2.690 1.965 1.891 2.110 . 0 0 "[ . 1 . 2 . ]" 1 1300 1 54 THR H 1 55 ASP H 2.345 . 2.890 2.618 2.381 2.922 0.032 14 0 "[ . 1 . 2 . ]" 1 1301 1 54 THR H 1 56 GLY H 2.955 . 4.110 4.011 3.864 4.119 0.009 19 0 "[ . 1 . 2 . ]" 1 1302 1 54 THR H 1 58 THR MG 3.345 . 4.890 4.752 4.432 4.978 0.088 1 0 "[ . 1 . 2 . ]" 1 1303 1 54 THR HA 1 54 THR HB 2.265 . 2.730 2.436 2.370 2.480 . 0 0 "[ . 1 . 2 . ]" 1 1304 1 54 THR HA 1 54 THR MG 2.525 . 3.250 3.195 3.175 3.210 . 0 0 "[ . 1 . 2 . ]" 1 1305 1 54 THR HA 1 55 ASP H 2.670 . 3.540 3.426 3.339 3.533 . 0 0 "[ . 1 . 2 . ]" 1 1306 1 54 THR HA 1 56 GLY H 2.990 . 4.180 3.818 3.392 4.194 0.014 15 0 "[ . 1 . 2 . ]" 1 1307 1 54 THR MG 1 55 ASP H 2.475 . 3.150 2.490 2.264 2.689 . 0 0 "[ . 1 . 2 . ]" 1 1308 1 54 THR MG 1 55 ASP QB 2.915 . 4.030 3.127 2.808 3.391 . 0 0 "[ . 1 . 2 . ]" 1 1309 1 54 THR MG 1 56 GLY H 3.075 . 4.350 4.300 4.124 4.373 0.023 5 0 "[ . 1 . 2 . ]" 1 1310 1 55 ASP H 1 55 ASP HB2 2.355 . 2.910 2.709 2.407 2.858 . 0 0 "[ . 1 . 2 . ]" 1 1311 1 55 ASP H 1 55 ASP HB3 2.355 . 2.910 2.446 2.325 2.686 . 0 0 "[ . 1 . 2 . ]" 1 1312 1 55 ASP H 1 58 THR MG 3.420 . 5.040 4.215 3.641 4.689 . 0 0 "[ . 1 . 2 . ]" 1 1313 1 55 ASP HA 1 55 ASP QB 2.190 . 2.580 2.356 2.310 2.413 . 0 0 "[ . 1 . 2 . ]" 1 1314 1 55 ASP QB 1 56 GLY H 2.765 . 3.730 3.047 2.583 3.364 . 0 0 "[ . 1 . 2 . ]" 1 1315 1 56 GLY H 1 56 GLY QA 2.180 . 2.560 2.322 2.250 2.401 . 0 0 "[ . 1 . 2 . ]" 1 1316 1 56 GLY H 1 58 THR MG 3.520 . 5.240 4.240 3.819 4.826 . 0 0 "[ . 1 . 2 . ]" 1 1317 1 56 GLY QA 1 57 TRP HD1 3.570 . 5.340 4.419 4.147 4.586 . 0 0 "[ . 1 . 2 . ]" 1 1318 1 56 GLY QA 1 58 THR H 3.570 . 5.340 4.933 4.684 5.161 . 0 0 "[ . 1 . 2 . ]" 1 1319 1 56 GLY HA2 1 57 TRP H 2.370 . 2.940 2.855 2.719 2.973 0.033 8 0 "[ . 1 . 2 . ]" 1 1320 1 56 GLY HA3 1 57 TRP H 2.370 . 2.940 2.332 2.229 2.489 . 0 0 "[ . 1 . 2 . ]" 1 1321 1 57 TRP H 1 57 TRP HB2 2.450 . 3.100 2.490 2.419 2.574 . 0 0 "[ . 1 . 2 . ]" 1 1322 1 57 TRP H 1 57 TRP HB3 2.780 . 3.760 3.598 3.550 3.636 . 0 0 "[ . 1 . 2 . ]" 1 1323 1 57 TRP H 1 57 TRP HD1 2.490 . 3.180 2.897 2.769 3.023 . 0 0 "[ . 1 . 2 . ]" 1 1324 1 57 TRP H 1 57 TRP HE1 3.270 . 4.740 4.725 4.625 4.809 0.069 25 0 "[ . 1 . 2 . ]" 1 1325 1 57 TRP H 1 58 THR H 3.185 . 4.570 4.392 4.277 4.531 . 0 0 "[ . 1 . 2 . ]" 1 1326 1 57 TRP HA 1 57 TRP HE3 2.805 . 3.810 2.614 2.463 2.776 . 0 0 "[ . 1 . 2 . ]" 1 1327 1 57 TRP HA 1 58 THR H 2.425 . 3.050 2.132 2.098 2.171 . 0 0 "[ . 1 . 2 . ]" 1 1328 1 57 TRP HA 1 58 THR MG 3.035 . 4.270 3.772 3.636 3.851 . 0 0 "[ . 1 . 2 . ]" 1 1329 1 57 TRP HB2 1 58 THR H 3.200 . 4.600 4.353 4.274 4.431 . 0 0 "[ . 1 . 2 . ]" 1 1330 1 57 TRP HB3 1 58 THR H 2.865 . 3.930 3.596 3.392 3.801 . 0 0 "[ . 1 . 2 . ]" 1 1331 1 57 TRP HE3 1 58 THR H 2.890 . 3.980 3.785 3.494 3.989 0.009 26 0 "[ . 1 . 2 . ]" 1 1332 1 57 TRP HE3 1 58 THR MG 3.650 . 5.500 5.297 5.056 5.474 . 0 0 "[ . 1 . 2 . ]" 1 1333 1 58 THR H 1 58 THR MG 2.350 . 2.900 2.210 2.073 2.286 . 0 0 "[ . 1 . 2 . ]" 1 1334 1 58 THR H 1 59 ASN H 3.280 . 4.760 3.606 2.676 4.585 . 0 0 "[ . 1 . 2 . ]" 1 1335 1 58 THR H 1 59 ASN HB2 3.650 . 5.500 5.091 4.877 5.356 . 0 0 "[ . 1 . 2 . ]" 1 1336 1 58 THR HA 1 58 THR MG 2.305 . 2.810 2.325 2.272 2.408 . 0 0 "[ . 1 . 2 . ]" 1 1337 1 58 THR HB 1 59 ASN H 2.455 . 3.110 2.700 2.141 3.140 0.030 2 0 "[ . 1 . 2 . ]" 1 1338 1 58 THR MG 1 59 ASN H 2.770 . 3.740 3.674 3.566 3.772 0.032 16 0 "[ . 1 . 2 . ]" 1 1339 1 59 ASN H 1 60 ASP H 3.185 . 4.570 4.541 4.415 4.608 0.038 23 0 "[ . 1 . 2 . ]" 1 1340 1 59 ASN HA 1 59 ASN HD21 3.250 . 4.700 3.964 2.844 4.587 . 0 0 "[ . 1 . 2 . ]" 1 1341 1 59 ASN HA 1 59 ASN HD22 3.410 . 5.020 4.504 4.050 4.877 . 0 0 "[ . 1 . 2 . ]" 1 1342 1 59 ASN HA 1 60 ASP H 2.460 . 3.120 2.581 2.345 2.962 . 0 0 "[ . 1 . 2 . ]" 1 1343 1 59 ASN HB2 1 60 ASP H 2.635 . 3.470 3.048 2.464 3.482 0.012 24 0 "[ . 1 . 2 . ]" 1 1344 1 59 ASN HB3 1 60 ASP H 2.510 . 3.220 2.039 1.795 2.433 0.005 7 0 "[ . 1 . 2 . ]" 1 1345 1 59 ASN HD21 1 60 ASP H 3.270 . 4.740 4.397 4.025 4.770 0.030 18 0 "[ . 1 . 2 . ]" 1 1346 1 59 ASN HD22 1 60 ASP H 3.650 . 5.500 5.539 5.415 5.635 0.135 29 0 "[ . 1 . 2 . ]" 1 1347 1 60 ASP H 1 60 ASP HB2 2.820 . 3.840 2.773 2.437 3.356 . 0 0 "[ . 1 . 2 . ]" 1 1348 1 60 ASP H 1 60 ASP QB 2.525 . 3.250 2.560 2.402 2.768 . 0 0 "[ . 1 . 2 . ]" 1 1349 1 60 ASP H 1 60 ASP HB3 2.820 . 3.840 3.358 2.574 3.798 . 0 0 "[ . 1 . 2 . ]" 1 1350 1 60 ASP H 1 61 ILE H 3.185 . 4.570 4.341 4.152 4.516 . 0 0 "[ . 1 . 2 . ]" 1 1351 1 60 ASP HA 1 61 ILE H 2.420 . 3.040 2.537 2.347 2.696 . 0 0 "[ . 1 . 2 . ]" 1 1352 1 60 ASP HA 1 61 ILE HB 3.610 . 5.420 4.922 4.600 5.234 . 0 0 "[ . 1 . 2 . ]" 1 1353 1 60 ASP QB 1 61 ILE H 2.355 . 2.910 2.347 1.905 2.975 0.065 24 0 "[ . 1 . 2 . ]" 1 1354 1 60 ASP QB 1 61 ILE HB 3.065 . 4.330 3.948 3.629 4.378 0.048 24 0 "[ . 1 . 2 . ]" 1 1355 1 60 ASP QB 1 61 ILE MD 3.570 . 5.340 4.963 4.550 5.313 . 0 0 "[ . 1 . 2 . ]" 1 1356 1 60 ASP QB 1 61 ILE HG13 3.165 . 4.530 4.170 3.636 4.580 0.050 16 0 "[ . 1 . 2 . ]" 1 1357 1 60 ASP HB2 1 61 ILE H 2.685 . 3.570 3.427 3.082 3.598 0.028 7 0 "[ . 1 . 2 . ]" 1 1358 1 60 ASP HB2 1 61 ILE HB 3.480 . 5.160 5.227 4.957 5.366 0.206 13 0 "[ . 1 . 2 . ]" 1 1359 1 60 ASP HB3 1 61 ILE H 2.685 . 3.570 2.415 1.917 3.226 . 0 0 "[ . 1 . 2 . ]" 1 1360 1 60 ASP HB3 1 61 ILE HB 3.480 . 5.160 4.095 3.707 4.668 . 0 0 "[ . 1 . 2 . ]" 1 1361 1 61 ILE H 1 61 ILE HB 2.570 . 3.340 2.393 2.082 2.621 . 0 0 "[ . 1 . 2 . ]" 1 1362 1 61 ILE H 1 61 ILE MD 2.690 . 3.580 3.538 3.424 3.609 0.029 2 0 "[ . 1 . 2 . ]" 1 1363 1 61 ILE H 1 61 ILE HG12 2.695 . 3.590 3.345 3.203 3.551 . 0 0 "[ . 1 . 2 . ]" 1 1364 1 61 ILE H 1 61 ILE HG13 2.365 . 2.930 2.087 1.935 2.266 . 0 0 "[ . 1 . 2 . ]" 1 1365 1 61 ILE H 1 61 ILE MG 2.865 . 3.930 3.736 3.637 3.807 . 0 0 "[ . 1 . 2 . ]" 1 1366 1 61 ILE H 1 62 PRO QD 3.345 . 4.890 4.210 4.098 4.288 . 0 0 "[ . 1 . 2 . ]" 1 1367 1 61 ILE HA 1 61 ILE HG12 2.945 . 4.090 2.554 2.451 2.662 . 0 0 "[ . 1 . 2 . ]" 1 1368 1 61 ILE HA 1 61 ILE MG 2.630 . 3.460 2.450 2.394 2.536 . 0 0 "[ . 1 . 2 . ]" 1 1369 1 61 ILE HA 1 62 PRO QD 2.555 . 3.310 1.946 1.918 2.002 . 0 0 "[ . 1 . 2 . ]" 1 1370 1 61 ILE HA 1 62 PRO HG3 3.085 . 4.370 4.386 4.312 4.423 0.053 13 0 "[ . 1 . 2 . ]" 1 1371 1 61 ILE HB 1 61 ILE MD 2.280 . 2.760 2.460 2.408 2.527 . 0 0 "[ . 1 . 2 . ]" 1 1372 1 61 ILE MD 1 61 ILE MG 2.100 . 2.400 1.954 1.882 1.997 . 0 0 "[ . 1 . 2 . ]" 1 1373 1 61 ILE HG12 1 61 ILE MG 2.850 . 3.900 2.418 2.369 2.509 . 0 0 "[ . 1 . 2 . ]" 1 1374 1 61 ILE HG12 1 62 PRO QD 3.575 . 5.350 3.784 3.633 3.978 . 0 0 "[ . 1 . 2 . ]" 1 1375 1 61 ILE HG13 1 61 ILE MG 2.615 . 3.430 3.215 3.200 3.230 . 0 0 "[ . 1 . 2 . ]" 1 1376 1 61 ILE MG 1 62 PRO QB 3.450 . 5.100 4.369 4.016 4.564 . 0 0 "[ . 1 . 2 . ]" 1 1377 1 61 ILE MG 1 62 PRO HD2 2.840 . 3.880 2.511 2.285 2.787 . 0 0 "[ . 1 . 2 . ]" 1 1378 1 61 ILE MG 1 62 PRO HD3 2.840 . 3.880 3.776 3.533 3.898 0.018 21 0 "[ . 1 . 2 . ]" 1 1379 1 61 ILE MG 1 62 PRO HG3 3.640 . 5.480 4.670 4.426 5.085 . 0 0 "[ . 1 . 2 . ]" 1 1380 1 61 ILE MG 1 63 ILE HA 3.125 . 4.450 4.203 3.825 4.489 0.039 16 0 "[ . 1 . 2 . ]" 1 1381 1 62 PRO HA 1 63 ILE H 2.425 . 3.050 2.381 2.069 2.654 . 0 0 "[ . 1 . 2 . ]" 1 1382 1 62 PRO HA 1 63 ILE HB 3.310 . 4.820 4.678 4.477 4.820 0.000 27 0 "[ . 1 . 2 . ]" 1 1383 1 62 PRO HA 1 63 ILE QG 3.055 . 4.310 3.439 3.137 4.318 0.008 29 0 "[ . 1 . 2 . ]" 1 1384 1 62 PRO HB2 1 63 ILE H 2.855 . 3.910 2.735 2.169 3.385 . 0 0 "[ . 1 . 2 . ]" 1 1385 1 62 PRO HB3 1 63 ILE H 2.855 . 3.910 3.382 2.694 3.885 . 0 0 "[ . 1 . 2 . ]" 1 1386 1 63 ILE H 1 63 ILE HB 2.535 . 3.270 2.510 2.434 2.580 . 0 0 "[ . 1 . 2 . ]" 1 1387 1 63 ILE H 1 63 ILE MD 2.845 . 3.890 3.558 1.996 3.923 0.033 6 0 "[ . 1 . 2 . ]" 1 1388 1 63 ILE H 1 63 ILE HG12 2.980 . 4.160 3.349 2.440 4.111 . 0 0 "[ . 1 . 2 . ]" 1 1389 1 63 ILE H 1 63 ILE HG13 2.980 . 4.160 2.982 2.061 4.160 . 0 0 "[ . 1 . 2 . ]" 1 1390 1 63 ILE H 1 63 ILE MG 2.795 . 3.790 3.793 3.758 3.817 0.027 27 0 "[ . 1 . 2 . ]" 1 1391 1 63 ILE HA 1 63 ILE MD 2.905 . 4.010 3.236 2.017 3.879 . 0 0 "[ . 1 . 2 . ]" 1 1392 1 63 ILE HA 1 63 ILE HG12 2.870 . 3.940 2.808 2.483 3.729 . 0 0 "[ . 1 . 2 . ]" 1 1393 1 63 ILE HA 1 63 ILE QG 2.590 . 3.380 2.600 2.358 3.010 . 0 0 "[ . 1 . 2 . ]" 1 1394 1 63 ILE HA 1 63 ILE HG13 2.870 . 3.940 3.220 2.529 3.762 . 0 0 "[ . 1 . 2 . ]" 1 1395 1 63 ILE HA 1 63 ILE MG 2.320 . 2.840 2.439 2.359 2.515 . 0 0 "[ . 1 . 2 . ]" 1 1396 1 63 ILE HA 1 64 CYS H 2.640 . 3.480 2.114 1.994 2.261 . 0 0 "[ . 1 . 2 . ]" 1 1397 1 63 ILE HA 1 64 CYS HA 3.650 . 5.500 4.331 4.259 4.389 . 0 0 "[ . 1 . 2 . ]" 1 1398 1 63 ILE HA 1 64 CYS QB 3.410 . 5.020 4.175 3.913 4.452 . 0 0 "[ . 1 . 2 . ]" 1 1399 1 63 ILE HB 1 63 ILE MD 2.575 . 3.350 2.679 2.372 3.255 . 0 0 "[ . 1 . 2 . ]" 1 1400 1 63 ILE HB 1 64 CYS H 3.345 . 4.890 4.099 3.933 4.217 . 0 0 "[ . 1 . 2 . ]" 1 1401 1 63 ILE MD 1 64 CYS H 3.385 . 4.970 4.559 3.507 5.074 0.104 3 0 "[ . 1 . 2 . ]" 1 1402 1 63 ILE QG 1 63 ILE MG 2.170 . 2.540 2.292 2.068 2.365 . 0 0 "[ . 1 . 2 . ]" 1 1403 1 63 ILE QG 1 64 CYS H 3.195 . 4.590 4.259 3.949 4.622 0.032 9 0 "[ . 1 . 2 . ]" 1 1404 1 63 ILE HG12 1 63 ILE MG 2.540 . 3.280 2.639 2.184 3.217 . 0 0 "[ . 1 . 2 . ]" 1 1405 1 63 ILE HG12 1 64 CYS H 3.510 . 5.220 4.628 4.164 5.240 0.020 29 0 "[ . 1 . 2 . ]" 1 1406 1 63 ILE HG13 1 63 ILE MG 2.540 . 3.280 2.883 2.250 3.223 . 0 0 "[ . 1 . 2 . ]" 1 1407 1 63 ILE HG13 1 64 CYS H 3.510 . 5.220 5.053 4.414 5.284 0.064 13 0 "[ . 1 . 2 . ]" 1 1408 1 63 ILE MG 1 64 CYS H 2.580 . 3.360 2.613 2.414 2.782 . 0 0 "[ . 1 . 2 . ]" 1 1409 1 63 ILE MG 1 64 CYS HA 3.015 . 4.230 3.575 3.450 3.672 . 0 0 "[ . 1 . 2 . ]" 1 1410 1 63 ILE MG 1 64 CYS QB 3.155 . 4.510 4.159 4.045 4.288 . 0 0 "[ . 1 . 2 . ]" 1 1411 1 63 ILE MG 1 65 GLU H 3.185 . 4.570 3.722 2.954 4.289 . 0 0 "[ . 1 . 2 . ]" 1 1412 1 63 ILE MG 1 65 GLU HA 3.130 . 4.460 3.737 3.198 4.276 . 0 0 "[ . 1 . 2 . ]" 1 1413 1 64 CYS HA 1 65 GLU H 2.490 . 3.180 2.140 2.038 2.318 . 0 0 "[ . 1 . 2 . ]" 1 1414 1 64 CYS HA 1 65 GLU HA 3.240 . 4.680 4.352 4.282 4.447 . 0 0 "[ . 1 . 2 . ]" 1 1415 1 64 CYS HA 1 65 GLU QB 2.985 . 4.170 3.983 3.773 4.192 0.022 12 0 "[ . 1 . 2 . ]" 1 1416 1 64 CYS QB 1 65 GLU H 2.955 . 4.110 3.480 2.648 3.870 . 0 0 "[ . 1 . 2 . ]" 1 1417 1 64 CYS QB 1 65 GLU HA 3.570 . 5.340 4.356 3.823 4.735 . 0 0 "[ . 1 . 2 . ]" 1 1418 1 64 CYS QB 1 65 GLU QB 3.570 . 5.340 4.963 4.439 5.336 . 0 0 "[ . 1 . 2 . ]" 1 1419 1 64 CYS HB2 1 65 GLU H 3.240 . 4.680 4.231 3.829 4.446 . 0 0 "[ . 1 . 2 . ]" 1 1420 1 64 CYS HB3 1 65 GLU H 3.240 . 4.680 3.742 2.697 4.278 . 0 0 "[ . 1 . 2 . ]" 1 1421 1 65 GLU H 1 65 GLU QB 2.505 . 3.210 2.367 2.192 2.554 . 0 0 "[ . 1 . 2 . ]" 1 1422 1 65 GLU H 1 65 GLU HG2 3.580 . 5.360 4.499 3.644 4.926 . 0 0 "[ . 1 . 2 . ]" 1 1423 1 65 GLU H 1 65 GLU QG 3.190 . 4.580 3.918 3.285 4.176 . 0 0 "[ . 1 . 2 . ]" 1 1424 1 65 GLU H 1 65 GLU HG3 3.580 . 5.360 4.385 3.439 4.821 . 0 0 "[ . 1 . 2 . ]" 1 1425 1 65 GLU H 1 66 VAL H 3.270 . 4.740 4.365 4.253 4.475 . 0 0 "[ . 1 . 2 . ]" 1 1426 1 65 GLU H 1 66 VAL HA 3.650 . 5.500 4.936 4.640 5.205 . 0 0 "[ . 1 . 2 . ]" 1 1427 1 65 GLU H 1 67 VAL QG 3.620 . 5.440 5.444 5.138 5.508 0.068 16 0 "[ . 1 . 2 . ]" 1 1428 1 65 GLU HA 1 65 GLU QB 2.270 . 2.740 2.419 2.342 2.547 . 0 0 "[ . 1 . 2 . ]" 1 1429 1 65 GLU HA 1 65 GLU QG 2.650 . 3.500 2.841 2.193 3.167 . 0 0 "[ . 1 . 2 . ]" 1 1430 1 65 GLU HA 1 66 VAL H 2.295 . 2.790 2.235 2.051 2.390 . 0 0 "[ . 1 . 2 . ]" 1 1431 1 65 GLU HA 1 66 VAL HA 3.150 . 4.500 4.256 4.147 4.354 . 0 0 "[ . 1 . 2 . ]" 1 1432 1 65 GLU HA 1 66 VAL HB 3.260 . 4.720 4.576 4.189 4.838 0.118 9 0 "[ . 1 . 2 . ]" 1 1433 1 65 GLU HA 1 66 VAL MG1 3.650 . 5.500 4.328 3.670 5.504 0.004 12 0 "[ . 1 . 2 . ]" 1 1434 1 65 GLU HA 1 66 VAL QG 2.940 . 4.080 3.614 3.005 4.087 0.007 7 0 "[ . 1 . 2 . ]" 1 1435 1 65 GLU HA 1 66 VAL MG2 3.650 . 5.500 4.754 3.024 5.523 0.023 24 0 "[ . 1 . 2 . ]" 1 1436 1 65 GLU QB 1 66 VAL H 2.780 . 3.760 3.224 2.317 3.657 . 0 0 "[ . 1 . 2 . ]" 1 1437 1 65 GLU QG 1 66 VAL H 2.680 . 3.560 2.859 2.417 3.610 0.050 16 0 "[ . 1 . 2 . ]" 1 1438 1 65 GLU QG 1 66 VAL QG 2.995 . 4.190 3.525 2.823 4.278 0.088 22 0 "[ . 1 . 2 . ]" 1 1439 1 66 VAL H 1 66 VAL HB 2.395 . 2.990 2.624 2.245 2.808 . 0 0 "[ . 1 . 2 . ]" 1 1440 1 66 VAL H 1 66 VAL MG1 2.785 . 3.770 2.529 1.858 3.778 0.008 28 0 "[ . 1 . 2 . ]" 1 1441 1 66 VAL H 1 66 VAL QG 2.245 . 2.690 1.964 1.807 2.285 . 0 0 "[ . 1 . 2 . ]" 1 1442 1 66 VAL H 1 66 VAL MG2 2.785 . 3.770 3.205 1.811 3.800 0.030 26 0 "[ . 1 . 2 . ]" 1 1443 1 66 VAL H 1 67 VAL H 3.220 . 4.640 4.538 4.393 4.635 . 0 0 "[ . 1 . 2 . ]" 1 1444 1 66 VAL HA 1 66 VAL MG1 2.660 . 3.520 2.954 2.278 3.255 . 0 0 "[ . 1 . 2 . ]" 1 1445 1 66 VAL HA 1 66 VAL QG 2.315 . 2.830 2.293 2.142 2.390 . 0 0 "[ . 1 . 2 . ]" 1 1446 1 66 VAL HA 1 66 VAL MG2 2.660 . 3.520 2.477 2.325 2.766 . 0 0 "[ . 1 . 2 . ]" 1 1447 1 66 VAL HA 1 67 VAL H 2.525 . 3.250 2.170 1.912 2.359 . 0 0 "[ . 1 . 2 . ]" 1 1448 1 66 VAL QG 1 67 VAL H 2.470 . 3.140 2.445 2.263 2.581 . 0 0 "[ . 1 . 2 . ]" 1 1449 1 66 VAL QG 1 68 LYS H 3.550 . 5.300 4.322 3.555 4.835 . 0 0 "[ . 1 . 2 . ]" 1 1450 1 66 VAL QG 1 68 LYS QE 2.675 . 3.550 3.050 1.882 3.759 0.209 27 0 "[ . 1 . 2 . ]" 1 1451 1 66 VAL QG 1 68 LYS QG 2.480 . 3.160 2.695 1.918 3.319 0.159 23 0 "[ . 1 . 2 . ]" 1 1452 1 66 VAL QG 1 92 HIS HA 3.205 . 4.610 3.245 2.737 4.160 . 0 0 "[ . 1 . 2 . ]" 1 1453 1 66 VAL QG 1 92 HIS QB 2.535 . 3.270 2.115 1.859 3.365 0.095 26 0 "[ . 1 . 2 . ]" 1 1454 1 66 VAL QG 1 93 PHE H 2.785 . 3.770 2.810 2.189 3.255 . 0 0 "[ . 1 . 2 . ]" 1 1455 1 66 VAL QG 1 93 PHE QB 3.050 . 4.300 3.161 2.430 3.737 . 0 0 "[ . 1 . 2 . ]" 1 1456 1 66 VAL QG 1 93 PHE QD 3.620 . 5.440 4.541 3.862 5.200 . 0 0 "[ . 1 . 2 . ]" 1 1457 1 66 VAL MG1 1 67 VAL H 2.895 . 3.990 3.424 2.274 4.013 0.023 21 0 "[ . 1 . 2 . ]" 1 1458 1 66 VAL MG1 1 92 HIS HB2 3.650 . 5.500 3.784 1.940 4.781 . 0 0 "[ . 1 . 2 . ]" 1 1459 1 66 VAL MG1 1 92 HIS HB3 3.650 . 5.500 3.007 1.875 5.024 . 0 0 "[ . 1 . 2 . ]" 1 1460 1 66 VAL MG1 1 92 HIS HD2 3.560 . 5.320 2.731 1.950 4.502 . 0 0 "[ . 1 . 2 . ]" 1 1461 1 66 VAL MG2 1 67 VAL H 2.895 . 3.990 2.982 2.356 4.164 0.174 16 0 "[ . 1 . 2 . ]" 1 1462 1 66 VAL MG2 1 92 HIS HB2 3.650 . 5.500 3.834 2.001 5.569 0.069 22 0 "[ . 1 . 2 . ]" 1 1463 1 66 VAL MG2 1 92 HIS HB3 3.650 . 5.500 2.999 1.920 4.663 . 0 0 "[ . 1 . 2 . ]" 1 1464 1 66 VAL MG2 1 92 HIS HD2 3.560 . 5.320 3.409 2.457 4.811 . 0 0 "[ . 1 . 2 . ]" 1 1465 1 67 VAL H 1 67 VAL HB 2.750 . 3.700 3.053 2.332 3.721 0.021 15 0 "[ . 1 . 2 . ]" 1 1466 1 67 VAL H 1 67 VAL MG1 2.810 . 3.820 3.171 2.231 3.802 . 0 0 "[ . 1 . 2 . ]" 1 1467 1 67 VAL H 1 67 VAL QG 2.530 . 3.260 2.065 1.792 2.425 0.008 11 0 "[ . 1 . 2 . ]" 1 1468 1 67 VAL H 1 67 VAL MG2 2.810 . 3.820 2.108 1.835 2.455 . 0 0 "[ . 1 . 2 . ]" 1 1469 1 67 VAL H 1 93 PHE H 3.650 . 5.500 4.114 3.826 4.437 . 0 0 "[ . 1 . 2 . ]" 1 1470 1 67 VAL H 1 93 PHE QB 3.410 . 5.020 3.659 3.156 4.164 . 0 0 "[ . 1 . 2 . ]" 1 1471 1 67 VAL HA 1 67 VAL MG1 2.565 . 3.330 2.391 2.247 2.533 . 0 0 "[ . 1 . 2 . ]" 1 1472 1 67 VAL HA 1 67 VAL QG 2.305 . 2.810 2.191 2.116 2.298 . 0 0 "[ . 1 . 2 . ]" 1 1473 1 67 VAL HA 1 67 VAL MG2 2.565 . 3.330 2.744 2.267 3.196 . 0 0 "[ . 1 . 2 . ]" 1 1474 1 67 VAL HA 1 68 LYS H 2.295 . 2.790 2.106 1.999 2.263 . 0 0 "[ . 1 . 2 . ]" 1 1475 1 67 VAL HA 1 68 LYS HB2 3.390 . 4.980 4.497 4.196 4.709 . 0 0 "[ . 1 . 2 . ]" 1 1476 1 67 VAL HB 1 93 PHE H 3.110 . 4.420 3.940 2.998 4.570 0.150 20 0 "[ . 1 . 2 . ]" 1 1477 1 67 VAL HB 1 93 PHE HA 3.590 . 5.380 4.920 4.203 5.494 0.114 6 0 "[ . 1 . 2 . ]" 1 1478 1 67 VAL HB 1 93 PHE QB 2.840 . 3.880 2.922 1.876 3.961 0.081 20 0 "[ . 1 . 2 . ]" 1 1479 1 67 VAL HB 1 93 PHE QD 3.530 . 5.260 4.244 2.201 5.348 0.088 13 0 "[ . 1 . 2 . ]" 1 1480 1 67 VAL QG 1 68 LYS H 2.710 . 3.620 3.077 2.508 3.623 0.003 25 0 "[ . 1 . 2 . ]" 1 1481 1 67 VAL QG 1 93 PHE H 3.065 . 4.330 3.006 2.106 4.105 . 0 0 "[ . 1 . 2 . ]" 1 1482 1 67 VAL QG 1 93 PHE HA 3.200 . 4.600 3.711 3.096 4.414 . 0 0 "[ . 1 . 2 . ]" 1 1483 1 67 VAL QG 1 93 PHE QB 2.950 . 4.100 2.203 1.730 2.932 0.070 20 0 "[ . 1 . 2 . ]" 1 1484 1 67 VAL QG 1 93 PHE QD 2.955 . 4.110 3.014 2.004 3.880 . 0 0 "[ . 1 . 2 . ]" 1 1485 1 67 VAL QG 1 118 ASP HA 3.385 . 4.970 4.028 2.643 4.978 0.008 7 0 "[ . 1 . 2 . ]" 1 1486 1 67 VAL QG 1 119 GLY H 2.555 . 3.310 3.052 2.307 3.427 0.117 7 0 "[ . 1 . 2 . ]" 1 1487 1 67 VAL QG 1 119 GLY QA 2.735 . 3.670 2.524 1.951 3.489 . 0 0 "[ . 1 . 2 . ]" 1 1488 1 67 VAL MG1 1 68 LYS H 3.015 . 4.230 3.250 2.540 3.962 . 0 0 "[ . 1 . 2 . ]" 1 1489 1 67 VAL MG1 1 93 PHE HB2 3.650 . 5.500 3.436 2.238 4.329 . 0 0 "[ . 1 . 2 . ]" 1 1490 1 67 VAL MG1 1 93 PHE HB3 3.650 . 5.500 4.494 3.677 5.196 . 0 0 "[ . 1 . 2 . ]" 1 1491 1 67 VAL MG1 1 93 PHE QD 3.650 . 5.500 3.991 2.612 5.131 . 0 0 "[ . 1 . 2 . ]" 1 1492 1 67 VAL MG2 1 68 LYS H 3.015 . 4.230 3.994 3.766 4.258 0.028 7 0 "[ . 1 . 2 . ]" 1 1493 1 67 VAL MG2 1 93 PHE HB2 3.650 . 5.500 2.773 1.744 3.935 0.056 20 0 "[ . 1 . 2 . ]" 1 1494 1 67 VAL MG2 1 93 PHE HB3 3.650 . 5.500 3.435 2.232 4.791 . 0 0 "[ . 1 . 2 . ]" 1 1495 1 67 VAL MG2 1 93 PHE QD 3.650 . 5.500 3.518 2.010 4.648 . 0 0 "[ . 1 . 2 . ]" 1 1496 1 68 LYS H 1 68 LYS HB2 2.715 . 3.630 2.584 2.417 2.788 . 0 0 "[ . 1 . 2 . ]" 1 1497 1 68 LYS H 1 68 LYS HB3 2.885 . 3.970 3.699 3.548 3.843 . 0 0 "[ . 1 . 2 . ]" 1 1498 1 68 LYS H 1 68 LYS QE 3.650 . 5.500 4.569 3.536 5.375 . 0 0 "[ . 1 . 2 . ]" 1 1499 1 68 LYS H 1 68 LYS HG2 3.080 . 4.360 3.803 2.326 4.163 . 0 0 "[ . 1 . 2 . ]" 1 1500 1 68 LYS H 1 68 LYS QG 2.745 . 3.690 2.683 2.298 2.974 . 0 0 "[ . 1 . 2 . ]" 1 1501 1 68 LYS H 1 68 LYS HG3 3.080 . 4.360 2.782 2.459 3.580 . 0 0 "[ . 1 . 2 . ]" 1 1502 1 68 LYS H 1 69 CYS H 3.185 . 4.570 4.366 4.179 4.464 . 0 0 "[ . 1 . 2 . ]" 1 1503 1 68 LYS HA 1 68 LYS QG 2.765 . 3.730 2.491 2.314 2.875 . 0 0 "[ . 1 . 2 . ]" 1 1504 1 68 LYS HA 1 69 CYS H 2.640 . 3.480 2.177 1.934 2.497 . 0 0 "[ . 1 . 2 . ]" 1 1505 1 68 LYS HA 1 92 HIS HA 3.010 . 4.220 2.368 1.790 2.959 0.010 19 0 "[ . 1 . 2 . ]" 1 1506 1 68 LYS HA 1 93 PHE H 2.950 . 4.100 3.710 2.900 4.179 0.079 13 0 "[ . 1 . 2 . ]" 1 1507 1 68 LYS HB2 1 68 LYS QE 3.110 . 4.420 3.538 1.989 4.185 . 0 0 "[ . 1 . 2 . ]" 1 1508 1 68 LYS HB2 1 69 CYS H 2.990 . 4.180 3.810 3.419 4.168 . 0 0 "[ . 1 . 2 . ]" 1 1509 1 68 LYS HB3 1 69 CYS H 2.440 . 3.080 2.806 2.314 3.128 0.048 25 0 "[ . 1 . 2 . ]" 1 1510 1 68 LYS HB3 1 92 HIS HA 3.180 . 4.560 4.244 3.301 4.599 0.039 22 0 "[ . 1 . 2 . ]" 1 1511 1 68 LYS QE 1 68 LYS HG2 2.595 . 3.390 2.680 2.223 3.471 0.081 28 0 "[ . 1 . 2 . ]" 1 1512 1 68 LYS QE 1 68 LYS HG3 2.595 . 3.390 2.460 2.252 3.221 . 0 0 "[ . 1 . 2 . ]" 1 1513 1 68 LYS QG 1 69 CYS H 3.120 . 4.440 4.001 3.741 4.439 . 0 0 "[ . 1 . 2 . ]" 1 1514 1 68 LYS QG 1 92 HIS HA 3.215 . 4.630 3.361 2.126 4.736 0.106 14 0 "[ . 1 . 2 . ]" 1 1515 1 68 LYS QG 1 92 HIS HD2 3.570 . 5.340 2.930 1.901 5.449 0.109 19 0 "[ . 1 . 2 . ]" 1 1516 1 69 CYS H 1 70 LEU H 3.255 . 4.710 4.460 4.336 4.616 . 0 0 "[ . 1 . 2 . ]" 1 1517 1 69 CYS H 1 91 TYR H 3.520 . 5.240 4.277 3.233 5.318 0.078 17 0 "[ . 1 . 2 . ]" 1 1518 1 69 CYS H 1 91 TYR HB2 3.275 . 4.750 3.091 2.619 3.689 . 0 0 "[ . 1 . 2 . ]" 1 1519 1 69 CYS H 1 91 TYR QB 2.930 . 4.060 2.931 2.570 3.447 . 0 0 "[ . 1 . 2 . ]" 1 1520 1 69 CYS H 1 91 TYR HB3 3.275 . 4.750 3.689 2.923 4.405 . 0 0 "[ . 1 . 2 . ]" 1 1521 1 69 CYS H 1 92 HIS HA 3.060 . 4.320 3.442 2.206 4.337 0.017 27 0 "[ . 1 . 2 . ]" 1 1522 1 69 CYS HA 1 70 LEU QD 3.620 . 5.440 4.191 2.841 5.311 . 0 0 "[ . 1 . 2 . ]" 1 1523 1 69 CYS QB 1 70 LEU H 2.750 . 3.700 2.687 1.974 3.265 . 0 0 "[ . 1 . 2 . ]" 1 1524 1 69 CYS QB 1 91 TYR QB 3.280 . 4.760 2.576 1.789 4.140 0.011 14 0 "[ . 1 . 2 . ]" 1 1525 1 69 CYS QB 1 91 TYR QD 3.570 . 5.340 4.275 3.674 5.325 . 0 0 "[ . 1 . 2 . ]" 1 1526 1 69 CYS QB 1 121 TRP HD1 3.570 . 5.340 4.062 3.540 4.619 . 0 0 "[ . 1 . 2 . ]" 1 1527 1 69 CYS QB 1 121 TRP HE1 2.815 . 3.830 3.273 2.871 3.593 . 0 0 "[ . 1 . 2 . ]" 1 1528 1 69 CYS QB 1 121 TRP HZ2 3.215 . 4.630 3.111 2.670 3.954 . 0 0 "[ . 1 . 2 . ]" 1 1529 1 69 CYS HB2 1 121 TRP HZ2 3.595 . 5.390 3.247 2.752 4.063 . 0 0 "[ . 1 . 2 . ]" 1 1530 1 69 CYS HB3 1 121 TRP HZ2 3.595 . 5.390 4.048 3.230 5.428 0.038 27 0 "[ . 1 . 2 . ]" 1 1531 1 70 LEU H 1 70 LEU HB2 2.735 . 3.670 2.461 1.819 3.597 . 0 0 "[ . 1 . 2 . ]" 1 1532 1 70 LEU H 1 70 LEU QB 2.425 . 3.050 2.183 1.801 2.440 . 0 0 "[ . 1 . 2 . ]" 1 1533 1 70 LEU H 1 70 LEU HB3 2.735 . 3.670 3.119 1.858 3.605 . 0 0 "[ . 1 . 2 . ]" 1 1534 1 70 LEU H 1 70 LEU MD1 3.165 . 4.530 3.739 3.514 4.360 . 0 0 "[ . 1 . 2 . ]" 1 1535 1 70 LEU H 1 70 LEU QD 2.720 . 3.640 2.888 1.903 3.566 . 0 0 "[ . 1 . 2 . ]" 1 1536 1 70 LEU H 1 70 LEU MD2 3.165 . 4.530 3.156 1.911 4.250 . 0 0 "[ . 1 . 2 . ]" 1 1537 1 70 LEU H 1 70 LEU HG 2.645 . 3.490 3.139 2.323 3.808 0.318 17 0 "[ . 1 . 2 . ]" 1 1538 1 70 LEU H 1 71 PRO HD2 3.385 . 4.970 4.759 4.511 4.984 0.014 8 0 "[ . 1 . 2 . ]" 1 1539 1 70 LEU H 1 71 PRO HD3 3.585 . 5.370 4.754 4.456 5.004 . 0 0 "[ . 1 . 2 . ]" 1 1540 1 70 LEU H 1 121 TRP HD1 3.240 . 4.680 4.385 3.614 4.731 0.051 4 0 "[ . 1 . 2 . ]" 1 1541 1 70 LEU H 1 121 TRP HE1 2.945 . 4.090 3.691 3.039 4.044 . 0 0 "[ . 1 . 2 . ]" 1 1542 1 70 LEU HA 1 70 LEU MD1 3.030 . 4.260 3.071 1.959 3.838 . 0 0 "[ . 1 . 2 . ]" 1 1543 1 70 LEU HA 1 70 LEU QD 2.465 . 3.130 2.287 1.891 3.295 0.165 6 0 "[ . 1 . 2 . ]" 1 1544 1 70 LEU HA 1 70 LEU MD2 3.030 . 4.260 2.735 1.969 4.112 . 0 0 "[ . 1 . 2 . ]" 1 1545 1 70 LEU HA 1 70 LEU HG 2.900 . 4.000 3.179 2.202 3.681 . 0 0 "[ . 1 . 2 . ]" 1 1546 1 70 LEU HA 1 71 PRO HD2 2.415 . 3.030 2.320 1.897 2.931 . 0 0 "[ . 1 . 2 . ]" 1 1547 1 70 LEU HA 1 71 PRO HD3 2.550 . 3.300 2.145 1.841 2.455 . 0 0 "[ . 1 . 2 . ]" 1 1548 1 70 LEU QB 1 70 LEU QD 2.125 . 2.450 1.952 1.853 2.076 . 0 0 "[ . 1 . 2 . ]" 1 1549 1 70 LEU QB 1 71 PRO HD2 2.585 . 3.370 2.571 1.972 3.474 0.104 21 0 "[ . 1 . 2 . ]" 1 1550 1 70 LEU QB 1 71 PRO HD3 2.990 . 4.180 3.602 2.705 4.280 0.100 29 0 "[ . 1 . 2 . ]" 1 1551 1 70 LEU QB 1 121 TRP HD1 3.570 . 5.340 3.920 2.617 5.126 . 0 0 "[ . 1 . 2 . ]" 1 1552 1 70 LEU QB 1 121 TRP HE1 3.540 . 5.280 3.535 2.505 4.730 . 0 0 "[ . 1 . 2 . ]" 1 1553 1 70 LEU HB2 1 71 PRO HD2 2.935 . 4.070 3.650 1.980 4.144 0.074 5 0 "[ . 1 . 2 . ]" 1 1554 1 70 LEU HB3 1 71 PRO HD2 2.935 . 4.070 2.939 2.205 4.150 0.080 23 0 "[ . 1 . 2 . ]" 1 1555 1 70 LEU QD 1 71 PRO HD2 2.345 . 2.890 2.128 1.801 2.371 . 0 0 "[ . 1 . 2 . ]" 1 1556 1 70 LEU QD 1 71 PRO HD3 2.640 . 3.480 2.969 2.380 3.498 0.018 15 0 "[ . 1 . 2 . ]" 1 1557 1 70 LEU QD 1 71 PRO QG 2.595 . 3.390 3.275 2.217 3.511 0.121 1 0 "[ . 1 . 2 . ]" 1 1558 1 70 LEU QD 1 121 TRP HD1 3.430 . 5.060 4.373 2.772 5.131 0.071 11 0 "[ . 1 . 2 . ]" 1 1559 1 70 LEU MD1 1 71 PRO HD2 2.975 . 4.150 2.992 1.827 4.203 0.053 5 0 "[ . 1 . 2 . ]" 1 1560 1 70 LEU MD2 1 71 PRO HD2 2.975 . 4.150 3.250 1.803 4.254 0.104 26 0 "[ . 1 . 2 . ]" 1 1561 1 70 LEU HG 1 71 PRO HD2 2.995 . 4.190 3.899 2.482 4.226 0.036 18 0 "[ . 1 . 2 . ]" 1 1562 1 70 LEU HG 1 71 PRO HD3 3.335 . 4.870 4.784 3.853 4.963 0.093 4 0 "[ . 1 . 2 . ]" 1 1563 1 71 PRO HA 1 72 VAL H 2.445 . 3.090 2.129 2.021 2.214 . 0 0 "[ . 1 . 2 . ]" 1 1564 1 71 PRO HA 1 72 VAL HB 3.390 . 4.980 4.613 4.382 4.790 . 0 0 "[ . 1 . 2 . ]" 1 1565 1 71 PRO HA 1 72 VAL QG 2.900 . 4.000 3.560 3.336 3.829 . 0 0 "[ . 1 . 2 . ]" 1 1566 1 71 PRO HA 1 91 TYR QD 2.900 . 4.000 2.310 1.889 3.401 . 0 0 "[ . 1 . 2 . ]" 1 1567 1 71 PRO HA 1 91 TYR QE 2.755 . 3.710 2.362 1.931 3.064 . 0 0 "[ . 1 . 2 . ]" 1 1568 1 71 PRO QB 1 72 VAL H 2.850 . 3.900 3.432 3.068 3.751 . 0 0 "[ . 1 . 2 . ]" 1 1569 1 71 PRO QB 1 91 TYR QD 3.295 . 4.790 3.207 2.641 3.867 . 0 0 "[ . 1 . 2 . ]" 1 1570 1 71 PRO QB 1 91 TYR QE 2.995 . 4.190 2.774 2.069 3.152 . 0 0 "[ . 1 . 2 . ]" 1 1571 1 71 PRO HB2 1 72 VAL H 3.155 . 4.510 3.752 3.488 4.128 . 0 0 "[ . 1 . 2 . ]" 1 1572 1 71 PRO HB3 1 72 VAL H 3.155 . 4.510 3.998 3.305 4.370 . 0 0 "[ . 1 . 2 . ]" 1 1573 1 71 PRO HG2 1 91 TYR QE 3.650 . 5.500 5.397 4.512 5.543 0.043 25 0 "[ . 1 . 2 . ]" 1 1574 1 71 PRO HG3 1 91 TYR QE 3.650 . 5.500 4.968 3.270 5.531 0.031 8 0 "[ . 1 . 2 . ]" 1 1575 1 72 VAL H 1 72 VAL HB 2.805 . 3.810 2.575 2.456 2.753 . 0 0 "[ . 1 . 2 . ]" 1 1576 1 72 VAL H 1 72 VAL MG1 2.950 . 4.100 3.175 1.931 3.826 . 0 0 "[ . 1 . 2 . ]" 1 1577 1 72 VAL H 1 72 VAL QG 2.495 . 3.190 2.111 1.902 2.471 . 0 0 "[ . 1 . 2 . ]" 1 1578 1 72 VAL H 1 72 VAL MG2 2.950 . 4.100 2.725 1.908 3.821 . 0 0 "[ . 1 . 2 . ]" 1 1579 1 72 VAL H 1 73 THR H 3.285 . 4.770 4.535 4.442 4.626 . 0 0 "[ . 1 . 2 . ]" 1 1580 1 72 VAL H 1 80 ILE MD 3.530 . 5.260 4.080 3.670 4.690 . 0 0 "[ . 1 . 2 . ]" 1 1581 1 72 VAL H 1 91 TYR QE 3.045 . 4.290 3.007 2.026 3.862 . 0 0 "[ . 1 . 2 . ]" 1 1582 1 72 VAL H 1 121 TRP HZ2 3.340 . 4.880 3.690 2.984 4.299 . 0 0 "[ . 1 . 2 . ]" 1 1583 1 72 VAL HA 1 72 VAL MG1 2.765 . 3.730 2.675 2.284 3.248 . 0 0 "[ . 1 . 2 . ]" 1 1584 1 72 VAL HA 1 72 VAL MG2 2.765 . 3.730 2.434 2.289 2.597 . 0 0 "[ . 1 . 2 . ]" 1 1585 1 72 VAL HA 1 73 THR H 2.590 . 3.380 2.238 2.119 2.354 . 0 0 "[ . 1 . 2 . ]" 1 1586 1 72 VAL HB 1 73 THR H 3.110 . 4.420 4.007 3.568 4.174 . 0 0 "[ . 1 . 2 . ]" 1 1587 1 72 VAL HB 1 80 ILE MD 3.150 . 4.500 3.071 2.176 4.610 0.110 10 0 "[ . 1 . 2 . ]" 1 1588 1 72 VAL HB 1 97 VAL MG1 3.040 . 4.280 3.381 2.425 4.283 0.003 10 0 "[ . 1 . 2 . ]" 1 1589 1 72 VAL HB 1 97 VAL QG 2.750 . 3.700 3.119 2.285 3.780 0.080 29 0 "[ . 1 . 2 . ]" 1 1590 1 72 VAL HB 1 97 VAL MG2 3.040 . 4.280 3.823 2.793 4.368 0.088 18 0 "[ . 1 . 2 . ]" 1 1591 1 72 VAL HB 1 99 PHE QE 3.460 . 5.120 4.235 3.386 5.159 0.039 5 0 "[ . 1 . 2 . ]" 1 1592 1 72 VAL HB 1 99 PHE HZ 3.635 . 5.470 4.119 3.550 4.514 . 0 0 "[ . 1 . 2 . ]" 1 1593 1 72 VAL HB 1 121 TRP HE1 3.255 . 4.710 4.171 2.702 4.852 0.142 28 0 "[ . 1 . 2 . ]" 1 1594 1 72 VAL HB 1 121 TRP HZ2 3.625 . 5.450 4.520 3.619 5.280 . 0 0 "[ . 1 . 2 . ]" 1 1595 1 72 VAL QG 1 73 THR H 2.645 . 3.490 2.399 2.197 2.686 . 0 0 "[ . 1 . 2 . ]" 1 1596 1 72 VAL QG 1 74 ALA H 3.300 . 4.800 3.548 2.944 4.583 . 0 0 "[ . 1 . 2 . ]" 1 1597 1 72 VAL QG 1 74 ALA HA 3.155 . 4.510 3.492 3.063 4.098 . 0 0 "[ . 1 . 2 . ]" 1 1598 1 72 VAL QG 1 80 ILE MD 2.350 . 2.900 2.157 1.944 2.860 . 0 0 "[ . 1 . 2 . ]" 1 1599 1 72 VAL QG 1 97 VAL HB 3.070 . 4.340 3.326 2.615 4.302 . 0 0 "[ . 1 . 2 . ]" 1 1600 1 72 VAL QG 1 97 VAL QG 2.445 . 3.090 2.134 1.792 2.670 0.008 7 0 "[ . 1 . 2 . ]" 1 1601 1 72 VAL QG 1 99 PHE QE 2.505 . 3.210 2.336 1.962 2.741 . 0 0 "[ . 1 . 2 . ]" 1 1602 1 72 VAL QG 1 99 PHE HZ 2.490 . 3.180 2.035 1.828 2.399 . 0 0 "[ . 1 . 2 . ]" 1 1603 1 72 VAL QG 1 113 MET ME 2.400 . 3.000 2.658 2.096 3.024 0.024 9 0 "[ . 1 . 2 . ]" 1 1604 1 72 VAL QG 1 121 TRP HD1 3.130 . 4.460 3.599 3.014 4.505 0.045 21 0 "[ . 1 . 2 . ]" 1 1605 1 72 VAL QG 1 121 TRP HE1 2.750 . 3.700 2.705 2.065 3.706 0.006 25 0 "[ . 1 . 2 . ]" 1 1606 1 72 VAL QG 1 121 TRP HZ2 2.860 . 3.920 2.899 2.398 3.746 . 0 0 "[ . 1 . 2 . ]" 1 1607 1 72 VAL QG 1 125 LYS QD 2.710 . 3.620 2.539 1.941 3.690 0.070 29 0 "[ . 1 . 2 . ]" 1 1608 1 72 VAL QG 1 125 LYS QE 2.860 . 3.920 2.803 2.026 3.400 . 0 0 "[ . 1 . 2 . ]" 1 1609 1 72 VAL MG1 1 73 THR H 2.995 . 4.190 2.909 2.206 3.978 . 0 0 "[ . 1 . 2 . ]" 1 1610 1 72 VAL MG1 1 80 ILE MD 2.575 . 3.350 2.191 1.981 3.055 . 0 0 "[ . 1 . 2 . ]" 1 1611 1 72 VAL MG1 1 99 PHE QE 2.845 . 3.890 2.514 1.971 3.448 . 0 0 "[ . 1 . 2 . ]" 1 1612 1 72 VAL MG1 1 99 PHE HZ 2.735 . 3.670 2.289 1.842 3.116 . 0 0 "[ . 1 . 2 . ]" 1 1613 1 72 VAL MG1 1 113 MET ME 2.690 . 3.580 3.280 2.623 3.658 0.078 18 0 "[ . 1 . 2 . ]" 1 1614 1 72 VAL MG1 1 121 TRP HD1 3.475 . 5.150 5.028 4.167 5.195 0.045 20 0 "[ . 1 . 2 . ]" 1 1615 1 72 VAL MG1 1 121 TRP HE1 3.195 . 4.590 4.310 3.625 4.656 0.066 27 0 "[ . 1 . 2 . ]" 1 1616 1 72 VAL MG1 1 125 LYS QE 3.445 . 5.090 3.465 2.156 5.098 0.008 10 0 "[ . 1 . 2 . ]" 1 1617 1 72 VAL MG2 1 73 THR H 2.995 . 4.190 3.464 2.225 4.219 0.029 22 0 "[ . 1 . 2 . ]" 1 1618 1 72 VAL MG2 1 80 ILE MD 2.575 . 3.350 3.331 2.817 3.496 0.146 6 0 "[ . 1 . 2 . ]" 1 1619 1 72 VAL MG2 1 99 PHE QE 2.845 . 3.890 3.472 2.477 3.980 0.090 8 0 "[ . 1 . 2 . ]" 1 1620 1 72 VAL MG2 1 99 PHE HZ 2.735 . 3.670 2.716 1.954 3.304 . 0 0 "[ . 1 . 2 . ]" 1 1621 1 72 VAL MG2 1 113 MET ME 2.690 . 3.580 2.947 2.116 3.459 . 0 0 "[ . 1 . 2 . ]" 1 1622 1 72 VAL MG2 1 121 TRP HD1 3.475 . 5.150 3.737 3.059 4.956 . 0 0 "[ . 1 . 2 . ]" 1 1623 1 72 VAL MG2 1 121 TRP HE1 3.195 . 4.590 2.980 2.070 4.607 0.017 21 0 "[ . 1 . 2 . ]" 1 1624 1 72 VAL MG2 1 125 LYS QE 3.445 . 5.090 4.137 2.030 5.224 0.134 19 0 "[ . 1 . 2 . ]" 1 1625 1 73 THR H 1 73 THR HB 2.845 . 3.890 3.496 2.556 3.590 . 0 0 "[ . 1 . 2 . ]" 1 1626 1 73 THR H 1 73 THR MG 2.565 . 3.330 2.608 2.381 3.535 0.205 22 0 "[ . 1 . 2 . ]" 1 1627 1 73 THR H 1 74 ALA H 3.190 . 4.580 3.406 2.791 4.388 . 0 0 "[ . 1 . 2 . ]" 1 1628 1 73 THR H 1 80 ILE MD 3.320 . 4.840 4.083 3.792 4.372 . 0 0 "[ . 1 . 2 . ]" 1 1629 1 73 THR H 1 125 LYS QE 3.215 . 4.630 3.798 2.653 4.638 0.008 21 0 "[ . 1 . 2 . ]" 1 1630 1 73 THR HA 1 73 THR MG 2.255 . 2.710 2.260 2.153 2.329 . 0 0 "[ . 1 . 2 . ]" 1 1631 1 73 THR HA 1 74 ALA MB 2.980 . 4.160 4.061 3.788 4.171 0.011 1 0 "[ . 1 . 2 . ]" 1 1632 1 73 THR HA 1 80 ILE MD 2.865 . 3.930 3.666 2.630 3.990 0.060 24 0 "[ . 1 . 2 . ]" 1 1633 1 73 THR HB 1 74 ALA H 2.435 . 3.070 2.299 1.763 2.746 0.037 29 0 "[ . 1 . 2 . ]" 1 1634 1 73 THR HB 1 74 ALA MB 2.890 . 3.980 3.647 3.373 4.011 0.031 8 0 "[ . 1 . 2 . ]" 1 1635 1 73 THR MG 1 74 ALA H 2.780 . 3.760 3.589 3.216 3.740 . 0 0 "[ . 1 . 2 . ]" 1 1636 1 74 ALA H 1 74 ALA MB 2.375 . 2.950 2.782 2.250 2.987 0.037 13 0 "[ . 1 . 2 . ]" 1 1637 1 74 ALA H 1 80 ILE MD 3.080 . 4.360 3.976 3.389 4.401 0.041 19 0 "[ . 1 . 2 . ]" 1 1638 1 74 ALA H 1 99 PHE QE 3.450 . 5.100 4.759 4.287 5.173 0.073 8 0 "[ . 1 . 2 . ]" 1 1639 1 74 ALA H 1 125 LYS QD 2.900 . 4.000 3.965 2.997 4.205 0.205 28 0 "[ . 1 . 2 . ]" 1 1640 1 74 ALA H 1 125 LYS QE 3.365 . 4.930 3.100 2.424 4.690 . 0 0 "[ . 1 . 2 . ]" 1 1641 1 74 ALA HA 1 75 PRO HD2 2.760 . 3.720 2.513 2.289 2.683 . 0 0 "[ . 1 . 2 . ]" 1 1642 1 74 ALA HA 1 75 PRO QD 2.515 . 3.230 2.189 2.099 2.261 . 0 0 "[ . 1 . 2 . ]" 1 1643 1 74 ALA HA 1 75 PRO HD3 2.760 . 3.720 2.425 2.241 2.597 . 0 0 "[ . 1 . 2 . ]" 1 1644 1 74 ALA HA 1 75 PRO HG2 3.225 . 4.650 4.619 4.450 4.685 0.035 24 0 "[ . 1 . 2 . ]" 1 1645 1 74 ALA HA 1 75 PRO HG3 3.225 . 4.650 4.596 4.478 4.669 0.019 26 0 "[ . 1 . 2 . ]" 1 1646 1 74 ALA HA 1 80 ILE HB 3.560 . 5.320 4.958 4.321 5.350 0.030 28 0 "[ . 1 . 2 . ]" 1 1647 1 74 ALA HA 1 80 ILE MD 2.825 . 3.850 2.904 2.289 3.374 . 0 0 "[ . 1 . 2 . ]" 1 1648 1 74 ALA HA 1 80 ILE HG12 3.120 . 4.440 3.212 2.623 3.717 . 0 0 "[ . 1 . 2 . ]" 1 1649 1 74 ALA HA 1 80 ILE HG13 2.900 . 4.000 2.555 2.045 2.924 . 0 0 "[ . 1 . 2 . ]" 1 1650 1 74 ALA HA 1 99 PHE QD 2.990 . 4.180 3.324 2.829 3.857 . 0 0 "[ . 1 . 2 . ]" 1 1651 1 74 ALA HA 1 99 PHE QE 2.835 . 3.870 2.924 2.351 3.473 . 0 0 "[ . 1 . 2 . ]" 1 1652 1 74 ALA MB 1 75 PRO HA 3.275 . 4.750 4.322 4.257 4.450 . 0 0 "[ . 1 . 2 . ]" 1 1653 1 74 ALA MB 1 75 PRO HD2 2.610 . 3.420 2.161 2.028 2.328 . 0 0 "[ . 1 . 2 . ]" 1 1654 1 74 ALA MB 1 75 PRO QD 2.345 . 2.890 2.136 2.004 2.290 . 0 0 "[ . 1 . 2 . ]" 1 1655 1 74 ALA MB 1 75 PRO HD3 2.610 . 3.420 3.353 3.134 3.450 0.030 19 0 "[ . 1 . 2 . ]" 1 1656 1 74 ALA MB 1 78 GLY H 3.650 . 5.500 4.526 4.001 5.086 . 0 0 "[ . 1 . 2 . ]" 1 1657 1 74 ALA MB 1 79 LYS H 3.365 . 4.930 4.420 3.861 4.984 0.054 15 0 "[ . 1 . 2 . ]" 1 1658 1 74 ALA MB 1 79 LYS HA 2.305 . 2.810 2.209 1.846 2.684 . 0 0 "[ . 1 . 2 . ]" 1 1659 1 74 ALA MB 1 80 ILE H 2.545 . 3.290 3.259 3.070 3.342 0.052 13 0 "[ . 1 . 2 . ]" 1 1660 1 74 ALA MB 1 80 ILE HG13 2.360 . 2.920 2.629 2.100 2.954 0.034 16 0 "[ . 1 . 2 . ]" 1 1661 1 74 ALA MB 1 99 PHE QD 3.225 . 4.650 4.140 3.576 4.659 0.009 22 0 "[ . 1 . 2 . ]" 1 1662 1 74 ALA MB 1 99 PHE QE 3.390 . 4.980 4.391 3.853 4.931 . 0 0 "[ . 1 . 2 . ]" 1 1663 1 75 PRO HA 1 76 GLU H 2.440 . 3.080 2.391 2.163 2.910 . 0 0 "[ . 1 . 2 . ]" 1 1664 1 75 PRO HA 1 78 GLY H 3.650 . 5.500 4.901 4.655 5.267 . 0 0 "[ . 1 . 2 . ]" 1 1665 1 75 PRO HA 1 125 LYS QE 2.775 . 3.750 3.304 2.161 3.865 0.115 29 0 "[ . 1 . 2 . ]" 1 1666 1 75 PRO HA 1 127 LYS QG 3.520 . 5.240 5.110 3.982 5.371 0.131 16 0 "[ . 1 . 2 . ]" 1 1667 1 75 PRO HA 1 128 CYS H 3.650 . 5.500 4.957 4.151 5.528 0.028 5 0 "[ . 1 . 2 . ]" 1 1668 1 75 PRO HB2 1 76 GLU H 2.740 . 3.680 2.524 1.843 2.781 . 0 0 "[ . 1 . 2 . ]" 1 1669 1 75 PRO HB2 1 78 GLY H 2.980 . 4.160 3.329 2.864 3.541 . 0 0 "[ . 1 . 2 . ]" 1 1670 1 75 PRO HB2 1 78 GLY HA2 3.650 . 5.500 5.039 4.676 5.444 . 0 0 "[ . 1 . 2 . ]" 1 1671 1 75 PRO HB2 1 78 GLY HA3 3.235 . 4.670 3.541 3.095 3.960 . 0 0 "[ . 1 . 2 . ]" 1 1672 1 75 PRO HB2 1 127 LYS HA 3.350 . 4.900 2.985 2.172 3.919 . 0 0 "[ . 1 . 2 . ]" 1 1673 1 75 PRO HB2 1 128 CYS H 2.840 . 3.880 3.023 2.079 3.578 . 0 0 "[ . 1 . 2 . ]" 1 1674 1 75 PRO HB3 1 76 GLU H 2.705 . 3.610 3.393 3.189 3.569 . 0 0 "[ . 1 . 2 . ]" 1 1675 1 75 PRO HB3 1 78 GLY H 3.400 . 5.000 4.890 4.565 5.030 0.030 7 0 "[ . 1 . 2 . ]" 1 1676 1 75 PRO HB3 1 125 LYS QE 3.210 . 4.620 4.140 3.083 4.715 0.095 11 0 "[ . 1 . 2 . ]" 1 1677 1 75 PRO HB3 1 127 LYS HA 2.820 . 3.840 2.727 1.924 3.643 . 0 0 "[ . 1 . 2 . ]" 1 1678 1 75 PRO HB3 1 128 CYS H 3.015 . 4.230 3.940 3.222 4.281 0.051 29 0 "[ . 1 . 2 . ]" 1 1679 1 75 PRO QD 1 78 GLY H 3.410 . 5.020 4.198 3.861 4.736 . 0 0 "[ . 1 . 2 . ]" 1 1680 1 75 PRO QD 1 79 LYS H 3.110 . 4.420 3.418 3.090 3.747 . 0 0 "[ . 1 . 2 . ]" 1 1681 1 75 PRO QD 1 99 PHE QD 2.715 . 3.630 2.049 1.874 2.355 . 0 0 "[ . 1 . 2 . ]" 1 1682 1 75 PRO QD 1 99 PHE QE 3.300 . 4.800 2.887 2.393 3.378 . 0 0 "[ . 1 . 2 . ]" 1 1683 1 75 PRO QD 1 100 VAL H 3.575 . 5.350 4.326 3.873 4.730 . 0 0 "[ . 1 . 2 . ]" 1 1684 1 75 PRO HD2 1 99 PHE QD 2.995 . 4.190 2.897 2.488 3.288 . 0 0 "[ . 1 . 2 . ]" 1 1685 1 75 PRO HD3 1 99 PHE QD 2.995 . 4.190 2.109 1.903 2.467 . 0 0 "[ . 1 . 2 . ]" 1 1686 1 75 PRO QG 1 76 GLU H 3.000 . 4.200 4.068 3.474 4.245 0.045 8 0 "[ . 1 . 2 . ]" 1 1687 1 75 PRO QG 1 78 GLY H 2.685 . 3.570 2.847 2.485 3.135 . 0 0 "[ . 1 . 2 . ]" 1 1688 1 75 PRO QG 1 78 GLY HA2 3.080 . 4.360 3.543 3.415 3.731 . 0 0 "[ . 1 . 2 . ]" 1 1689 1 75 PRO QG 1 79 LYS H 2.610 . 3.420 2.966 2.433 3.317 . 0 0 "[ . 1 . 2 . ]" 1 1690 1 75 PRO QG 1 99 PHE QD 2.930 . 4.060 3.045 2.328 3.569 . 0 0 "[ . 1 . 2 . ]" 1 1691 1 75 PRO QG 1 100 VAL H 3.110 . 4.420 3.916 3.285 4.414 . 0 0 "[ . 1 . 2 . ]" 1 1692 1 75 PRO QG 1 128 CYS QB 3.450 . 5.100 3.856 2.683 4.175 . 0 0 "[ . 1 . 2 . ]" 1 1693 1 75 PRO HG2 1 76 GLU H 3.390 . 4.980 4.318 3.620 4.547 . 0 0 "[ . 1 . 2 . ]" 1 1694 1 75 PRO HG2 1 78 GLY HA2 3.435 . 5.070 3.628 3.489 3.839 . 0 0 "[ . 1 . 2 . ]" 1 1695 1 75 PRO HG2 1 79 LYS H 2.960 . 4.120 3.081 2.496 3.494 . 0 0 "[ . 1 . 2 . ]" 1 1696 1 75 PRO HG2 1 100 VAL H 3.495 . 5.190 4.592 4.003 5.158 . 0 0 "[ . 1 . 2 . ]" 1 1697 1 75 PRO HG3 1 76 GLU H 3.390 . 4.980 4.979 4.477 5.091 0.111 7 0 "[ . 1 . 2 . ]" 1 1698 1 75 PRO HG3 1 78 GLY HA2 3.435 . 5.070 4.973 4.750 5.081 0.011 27 0 "[ . 1 . 2 . ]" 1 1699 1 75 PRO HG3 1 79 LYS H 2.960 . 4.120 3.888 3.367 4.142 0.022 29 0 "[ . 1 . 2 . ]" 1 1700 1 75 PRO HG3 1 100 VAL H 3.495 . 5.190 4.254 3.490 4.902 . 0 0 "[ . 1 . 2 . ]" 1 1701 1 76 GLU H 1 76 GLU HB2 2.745 . 3.690 3.622 3.545 3.714 0.024 11 0 "[ . 1 . 2 . ]" 1 1702 1 76 GLU H 1 76 GLU QB 2.445 . 3.090 2.588 2.419 2.818 . 0 0 "[ . 1 . 2 . ]" 1 1703 1 76 GLU H 1 76 GLU HB3 2.745 . 3.690 2.652 2.460 2.919 . 0 0 "[ . 1 . 2 . ]" 1 1704 1 76 GLU H 1 76 GLU QG 2.500 . 3.200 2.267 1.863 3.189 . 0 0 "[ . 1 . 2 . ]" 1 1705 1 76 GLU H 1 77 ASN H 2.950 . 4.100 2.803 2.256 3.068 . 0 0 "[ . 1 . 2 . ]" 1 1706 1 76 GLU H 1 77 ASN HB2 3.650 . 5.500 5.257 4.743 5.526 0.026 12 0 "[ . 1 . 2 . ]" 1 1707 1 76 GLU H 1 127 LYS QG 3.540 . 5.280 4.270 3.420 4.979 . 0 0 "[ . 1 . 2 . ]" 1 1708 1 76 GLU HA 1 76 GLU QG 2.680 . 3.560 3.398 3.316 3.579 0.019 11 0 "[ . 1 . 2 . ]" 1 1709 1 76 GLU HA 1 78 GLY H 3.360 . 4.920 3.991 3.733 4.279 . 0 0 "[ . 1 . 2 . ]" 1 1710 1 76 GLU QB 1 77 ASN HD21 3.025 . 4.250 3.900 3.100 4.354 0.104 25 0 "[ . 1 . 2 . ]" 1 1711 1 76 GLU QB 1 77 ASN HD22 3.160 . 4.520 3.827 3.389 4.279 . 0 0 "[ . 1 . 2 . ]" 1 1712 1 76 GLU HB2 1 76 GLU QG 2.365 . 2.930 2.291 2.155 2.386 . 0 0 "[ . 1 . 2 . ]" 1 1713 1 76 GLU HB2 1 77 ASN H 2.915 . 4.030 3.550 3.125 3.934 . 0 0 "[ . 1 . 2 . ]" 1 1714 1 76 GLU HB2 1 78 GLY H 3.650 . 5.500 5.218 4.844 5.445 . 0 0 "[ . 1 . 2 . ]" 1 1715 1 76 GLU HB3 1 76 GLU QG 2.365 . 2.930 2.347 2.295 2.425 . 0 0 "[ . 1 . 2 . ]" 1 1716 1 76 GLU HB3 1 77 ASN H 2.915 . 4.030 3.937 3.852 4.052 0.022 13 0 "[ . 1 . 2 . ]" 1 1717 1 76 GLU HB3 1 78 GLY H 3.650 . 5.500 5.536 5.426 5.614 0.114 19 0 "[ . 1 . 2 . ]" 1 1718 1 76 GLU QG 1 77 ASN H 2.645 . 3.490 2.093 1.790 2.740 0.010 7 0 "[ . 1 . 2 . ]" 1 1719 1 76 GLU QG 1 77 ASN HD21 2.670 . 3.540 2.129 1.799 2.710 0.001 23 0 "[ . 1 . 2 . ]" 1 1720 1 76 GLU QG 1 77 ASN HD22 2.830 . 3.860 2.852 2.257 3.522 . 0 0 "[ . 1 . 2 . ]" 1 1721 1 76 GLU QG 1 78 GLY H 3.275 . 4.750 4.307 3.890 4.775 0.025 5 0 "[ . 1 . 2 . ]" 1 1722 1 76 GLU QG 1 128 CYS H 3.320 . 4.840 3.014 2.014 4.351 . 0 0 "[ . 1 . 2 . ]" 1 1723 1 77 ASN H 1 77 ASN HB3 2.945 . 4.090 3.749 3.617 3.828 . 0 0 "[ . 1 . 2 . ]" 1 1724 1 77 ASN H 1 77 ASN HD21 3.100 . 4.400 3.083 2.721 3.785 . 0 0 "[ . 1 . 2 . ]" 1 1725 1 77 ASN H 1 78 GLY H 2.490 . 3.180 2.561 2.179 3.022 . 0 0 "[ . 1 . 2 . ]" 1 1726 1 77 ASN H 1 102 ASN QD 3.570 . 5.340 5.218 4.839 5.389 0.049 27 0 "[ . 1 . 2 . ]" 1 1727 1 77 ASN HA 1 77 ASN HD21 3.325 . 4.850 4.098 3.914 4.335 . 0 0 "[ . 1 . 2 . ]" 1 1728 1 77 ASN HA 1 77 ASN HD22 3.305 . 4.810 4.472 4.286 4.636 . 0 0 "[ . 1 . 2 . ]" 1 1729 1 77 ASN HA 1 78 GLY H 2.555 . 3.310 2.859 2.748 3.001 . 0 0 "[ . 1 . 2 . ]" 1 1730 1 77 ASN HA 1 102 ASN HD21 3.085 . 4.370 3.292 2.691 3.688 . 0 0 "[ . 1 . 2 . ]" 1 1731 1 77 ASN HA 1 102 ASN QD 2.770 . 3.740 3.111 2.619 3.511 . 0 0 "[ . 1 . 2 . ]" 1 1732 1 77 ASN HA 1 102 ASN HD22 3.085 . 4.370 3.905 3.217 4.405 0.035 6 0 "[ . 1 . 2 . ]" 1 1733 1 77 ASN HA 1 105 TYR QE 3.645 . 5.490 4.948 4.420 5.498 0.008 9 0 "[ . 1 . 2 . ]" 1 1734 1 77 ASN HB2 1 77 ASN HD22 2.730 . 3.660 3.444 3.393 3.482 . 0 0 "[ . 1 . 2 . ]" 1 1735 1 77 ASN HB2 1 78 GLY H 3.100 . 4.400 4.068 3.821 4.276 . 0 0 "[ . 1 . 2 . ]" 1 1736 1 77 ASN HB2 1 105 TYR QD 3.320 . 4.840 3.563 3.352 4.084 . 0 0 "[ . 1 . 2 . ]" 1 1737 1 77 ASN HB2 1 105 TYR QE 3.275 . 4.750 4.123 3.725 4.529 . 0 0 "[ . 1 . 2 . ]" 1 1738 1 77 ASN HB2 1 128 CYS H 3.490 . 5.180 3.909 3.515 4.724 . 0 0 "[ . 1 . 2 . ]" 1 1739 1 77 ASN HB3 1 102 ASN H 3.225 . 4.650 4.091 3.500 4.660 0.010 18 0 "[ . 1 . 2 . ]" 1 1740 1 77 ASN HB3 1 102 ASN QD 3.080 . 4.360 3.627 2.943 4.350 . 0 0 "[ . 1 . 2 . ]" 1 1741 1 77 ASN HB3 1 105 TYR QD 3.260 . 4.720 3.056 2.753 3.379 . 0 0 "[ . 1 . 2 . ]" 1 1742 1 77 ASN HB3 1 105 TYR QE 3.235 . 4.670 3.293 2.936 3.599 . 0 0 "[ . 1 . 2 . ]" 1 1743 1 77 ASN HB3 1 128 CYS QB 3.570 . 5.340 3.259 2.989 3.809 . 0 0 "[ . 1 . 2 . ]" 1 1744 1 77 ASN HD21 1 78 GLY H 3.650 . 5.500 5.358 5.049 5.596 0.096 24 0 "[ . 1 . 2 . ]" 1 1745 1 77 ASN HD21 1 128 CYS H 3.260 . 4.720 3.991 3.519 4.671 . 0 0 "[ . 1 . 2 . ]" 1 1746 1 77 ASN HD21 1 128 CYS HB2 3.440 . 5.080 3.707 2.957 4.863 . 0 0 "[ . 1 . 2 . ]" 1 1747 1 77 ASN HD21 1 128 CYS QB 3.025 . 4.250 3.447 2.763 3.927 . 0 0 "[ . 1 . 2 . ]" 1 1748 1 77 ASN HD21 1 128 CYS HB3 3.440 . 5.080 4.399 2.788 5.089 0.009 28 0 "[ . 1 . 2 . ]" 1 1749 1 77 ASN HD22 1 105 TYR QE 3.055 . 4.310 3.895 3.202 4.322 0.012 9 0 "[ . 1 . 2 . ]" 1 1750 1 77 ASN HD22 1 128 CYS QB 3.570 . 5.340 4.907 4.360 5.373 0.033 12 0 "[ . 1 . 2 . ]" 1 1751 1 78 GLY H 1 79 LYS H 3.160 . 4.520 4.269 4.107 4.374 . 0 0 "[ . 1 . 2 . ]" 1 1752 1 78 GLY H 1 101 CYS HA 3.300 . 4.800 4.603 4.383 4.807 0.007 12 0 "[ . 1 . 2 . ]" 1 1753 1 78 GLY H 1 102 ASN H 3.425 . 5.050 4.687 4.340 5.083 0.033 22 0 "[ . 1 . 2 . ]" 1 1754 1 78 GLY H 1 102 ASN QD 3.570 . 5.340 3.852 3.329 4.331 . 0 0 "[ . 1 . 2 . ]" 1 1755 1 78 GLY H 1 128 CYS QB 3.180 . 4.560 3.544 3.109 4.013 . 0 0 "[ . 1 . 2 . ]" 1 1756 1 78 GLY HA2 1 79 LYS H 2.480 . 3.160 2.692 2.548 2.831 . 0 0 "[ . 1 . 2 . ]" 1 1757 1 78 GLY HA2 1 79 LYS QB 3.570 . 5.340 4.191 4.050 4.312 . 0 0 "[ . 1 . 2 . ]" 1 1758 1 78 GLY HA2 1 79 LYS QG 3.565 . 5.330 3.413 3.096 3.632 . 0 0 "[ . 1 . 2 . ]" 1 1759 1 78 GLY HA2 1 101 CYS H 3.395 . 4.990 4.959 4.749 5.036 0.046 8 0 "[ . 1 . 2 . ]" 1 1760 1 78 GLY HA2 1 101 CYS HA 2.830 . 3.860 2.390 2.104 2.644 . 0 0 "[ . 1 . 2 . ]" 1 1761 1 78 GLY HA2 1 102 ASN H 2.655 . 3.510 2.452 1.956 2.892 . 0 0 "[ . 1 . 2 . ]" 1 1762 1 78 GLY HA2 1 102 ASN HA 3.265 . 4.730 4.387 3.829 4.774 0.044 3 0 "[ . 1 . 2 . ]" 1 1763 1 78 GLY HA3 1 79 LYS H 2.540 . 3.280 2.401 2.218 2.579 . 0 0 "[ . 1 . 2 . ]" 1 1764 1 78 GLY HA3 1 100 VAL H 3.120 . 4.440 4.306 4.108 4.451 0.011 8 0 "[ . 1 . 2 . ]" 1 1765 1 78 GLY HA3 1 101 CYS HA 3.020 . 4.240 2.489 2.186 2.861 . 0 0 "[ . 1 . 2 . ]" 1 1766 1 78 GLY HA3 1 102 ASN H 3.150 . 4.500 3.609 3.263 4.048 . 0 0 "[ . 1 . 2 . ]" 1 1767 1 79 LYS H 1 79 LYS HB2 2.955 . 4.110 3.894 3.788 3.980 . 0 0 "[ . 1 . 2 . ]" 1 1768 1 79 LYS H 1 79 LYS HB3 2.955 . 4.110 3.473 3.372 3.615 . 0 0 "[ . 1 . 2 . ]" 1 1769 1 79 LYS H 1 79 LYS QE 3.315 . 4.830 4.585 4.114 4.898 0.068 13 0 "[ . 1 . 2 . ]" 1 1770 1 79 LYS H 1 79 LYS HG2 2.900 . 4.000 2.568 2.251 2.963 . 0 0 "[ . 1 . 2 . ]" 1 1771 1 79 LYS H 1 79 LYS QG 2.650 . 3.500 2.451 2.193 2.651 . 0 0 "[ . 1 . 2 . ]" 1 1772 1 79 LYS H 1 79 LYS HG3 2.900 . 4.000 3.184 2.686 3.563 . 0 0 "[ . 1 . 2 . ]" 1 1773 1 79 LYS H 1 80 ILE H 3.175 . 4.550 4.305 4.254 4.360 . 0 0 "[ . 1 . 2 . ]" 1 1774 1 79 LYS H 1 80 ILE HG13 3.650 . 5.500 5.503 5.319 5.552 0.052 9 0 "[ . 1 . 2 . ]" 1 1775 1 79 LYS H 1 81 VAL QG 3.550 . 5.300 5.038 4.697 5.323 0.023 5 0 "[ . 1 . 2 . ]" 1 1776 1 79 LYS H 1 99 PHE HA 3.260 . 4.720 4.541 4.166 4.723 0.003 13 0 "[ . 1 . 2 . ]" 1 1777 1 79 LYS H 1 99 PHE QB 3.260 . 4.720 3.849 3.450 4.116 . 0 0 "[ . 1 . 2 . ]" 1 1778 1 79 LYS H 1 99 PHE QD 3.320 . 4.840 4.549 4.203 4.846 0.006 13 0 "[ . 1 . 2 . ]" 1 1779 1 79 LYS H 1 100 VAL H 2.645 . 3.490 2.734 2.576 2.885 . 0 0 "[ . 1 . 2 . ]" 1 1780 1 79 LYS H 1 100 VAL HB 3.395 . 4.990 4.532 3.853 5.122 0.132 22 0 "[ . 1 . 2 . ]" 1 1781 1 79 LYS H 1 100 VAL QG 2.685 . 3.570 2.861 2.537 3.101 . 0 0 "[ . 1 . 2 . ]" 1 1782 1 79 LYS H 1 101 CYS HA 2.945 . 4.090 3.586 3.387 3.905 . 0 0 "[ . 1 . 2 . ]" 1 1783 1 79 LYS H 1 107 ILE MD 3.650 . 5.500 5.466 5.281 5.571 0.071 13 0 "[ . 1 . 2 . ]" 1 1784 1 79 LYS HA 1 79 LYS QG 2.760 . 3.720 3.347 3.311 3.383 . 0 0 "[ . 1 . 2 . ]" 1 1785 1 79 LYS QB 1 79 LYS QD 2.500 . 3.200 2.144 2.096 2.365 . 0 0 "[ . 1 . 2 . ]" 1 1786 1 79 LYS QB 1 80 ILE H 2.540 . 3.280 2.244 2.019 2.510 . 0 0 "[ . 1 . 2 . ]" 1 1787 1 79 LYS QB 1 100 VAL H 3.570 . 5.340 4.849 4.682 4.961 . 0 0 "[ . 1 . 2 . ]" 1 1788 1 79 LYS QB 1 100 VAL QG 2.750 . 3.700 3.557 3.390 3.691 . 0 0 "[ . 1 . 2 . ]" 1 1789 1 79 LYS HB2 1 80 ILE H 2.915 . 4.030 2.266 2.032 2.552 . 0 0 "[ . 1 . 2 . ]" 1 1790 1 79 LYS HB3 1 80 ILE H 2.915 . 4.030 3.642 3.502 3.766 . 0 0 "[ . 1 . 2 . ]" 1 1791 1 79 LYS QD 1 80 ILE H 3.570 . 5.340 4.311 3.795 4.853 . 0 0 "[ . 1 . 2 . ]" 1 1792 1 79 LYS QE 1 79 LYS HG2 2.590 . 3.380 2.544 2.236 3.281 . 0 0 "[ . 1 . 2 . ]" 1 1793 1 79 LYS QE 1 79 LYS QG 2.190 . 2.580 2.186 2.083 2.309 . 0 0 "[ . 1 . 2 . ]" 1 1794 1 79 LYS QE 1 79 LYS HG3 2.590 . 3.380 2.459 2.264 2.859 . 0 0 "[ . 1 . 2 . ]" 1 1795 1 79 LYS QE 1 81 VAL QG 3.620 . 5.440 4.533 3.652 5.217 . 0 0 "[ . 1 . 2 . ]" 1 1796 1 79 LYS QE 1 100 VAL QG 2.215 . 2.630 2.452 2.099 2.728 0.098 18 0 "[ . 1 . 2 . ]" 1 1797 1 79 LYS QG 1 80 ILE H 3.025 . 4.250 3.465 3.086 3.843 . 0 0 "[ . 1 . 2 . ]" 1 1798 1 79 LYS QG 1 100 VAL H 3.490 . 5.180 3.598 3.350 3.759 . 0 0 "[ . 1 . 2 . ]" 1 1799 1 79 LYS QG 1 100 VAL HB 3.050 . 4.300 3.788 2.873 4.351 0.051 16 0 "[ . 1 . 2 . ]" 1 1800 1 79 LYS QG 1 100 VAL QG 2.330 . 2.860 1.879 1.763 1.992 0.037 7 0 "[ . 1 . 2 . ]" 1 1801 1 79 LYS QG 1 101 CYS H 3.570 . 5.340 5.258 4.892 5.445 0.105 20 0 "[ . 1 . 2 . ]" 1 1802 1 79 LYS HG2 1 80 ILE H 3.425 . 5.050 4.568 4.218 4.839 . 0 0 "[ . 1 . 2 . ]" 1 1803 1 79 LYS HG3 1 80 ILE H 3.425 . 5.050 3.592 3.173 4.061 . 0 0 "[ . 1 . 2 . ]" 1 1804 1 80 ILE H 1 80 ILE HB 2.440 . 3.080 2.483 2.390 2.584 . 0 0 "[ . 1 . 2 . ]" 1 1805 1 80 ILE H 1 80 ILE MD 2.955 . 4.110 3.878 3.668 4.005 . 0 0 "[ . 1 . 2 . ]" 1 1806 1 80 ILE H 1 80 ILE HG12 2.920 . 4.040 3.665 3.552 3.852 . 0 0 "[ . 1 . 2 . ]" 1 1807 1 80 ILE H 1 80 ILE HG13 2.545 . 3.290 2.534 2.319 2.764 . 0 0 "[ . 1 . 2 . ]" 1 1808 1 80 ILE H 1 81 VAL H 3.265 . 4.730 4.512 4.389 4.575 . 0 0 "[ . 1 . 2 . ]" 1 1809 1 80 ILE H 1 100 VAL QG 3.270 . 4.740 4.212 3.753 4.569 . 0 0 "[ . 1 . 2 . ]" 1 1810 1 80 ILE HA 1 80 ILE MD 3.095 . 4.390 3.830 3.772 3.872 . 0 0 "[ . 1 . 2 . ]" 1 1811 1 80 ILE HA 1 80 ILE HG12 2.935 . 4.070 2.488 2.409 2.574 . 0 0 "[ . 1 . 2 . ]" 1 1812 1 80 ILE HA 1 80 ILE HG13 3.020 . 4.240 3.054 2.934 3.153 . 0 0 "[ . 1 . 2 . ]" 1 1813 1 80 ILE HA 1 80 ILE MG 2.390 . 2.980 2.441 2.374 2.543 . 0 0 "[ . 1 . 2 . ]" 1 1814 1 80 ILE HA 1 81 VAL H 2.490 . 3.180 2.190 2.053 2.318 . 0 0 "[ . 1 . 2 . ]" 1 1815 1 80 ILE HA 1 81 VAL QG 3.035 . 4.270 3.469 3.249 3.751 . 0 0 "[ . 1 . 2 . ]" 1 1816 1 80 ILE HA 1 99 PHE HA 2.800 . 3.800 2.189 2.021 2.430 . 0 0 "[ . 1 . 2 . ]" 1 1817 1 80 ILE HA 1 99 PHE QB 3.570 . 5.340 3.664 3.501 3.912 . 0 0 "[ . 1 . 2 . ]" 1 1818 1 80 ILE HA 1 99 PHE QD 3.055 . 4.310 2.856 2.327 3.157 . 0 0 "[ . 1 . 2 . ]" 1 1819 1 80 ILE HA 1 100 VAL H 3.230 . 4.660 3.417 3.212 3.694 . 0 0 "[ . 1 . 2 . ]" 1 1820 1 80 ILE HB 1 80 ILE MD 2.435 . 3.070 2.490 2.406 2.525 . 0 0 "[ . 1 . 2 . ]" 1 1821 1 80 ILE HB 1 81 VAL H 3.190 . 4.580 4.124 4.023 4.245 . 0 0 "[ . 1 . 2 . ]" 1 1822 1 80 ILE HB 1 97 VAL QG 3.325 . 4.850 4.091 3.926 4.389 . 0 0 "[ . 1 . 2 . ]" 1 1823 1 80 ILE HB 1 99 PHE HA 3.650 . 5.500 5.195 5.008 5.457 . 0 0 "[ . 1 . 2 . ]" 1 1824 1 80 ILE HB 1 99 PHE QD 3.650 . 5.500 4.838 4.430 5.088 . 0 0 "[ . 1 . 2 . ]" 1 1825 1 80 ILE HB 1 99 PHE QE 3.650 . 5.500 5.165 4.879 5.401 . 0 0 "[ . 1 . 2 . ]" 1 1826 1 80 ILE MD 1 97 VAL QG 2.495 . 3.190 2.358 2.040 2.878 . 0 0 "[ . 1 . 2 . ]" 1 1827 1 80 ILE MD 1 99 PHE QE 2.680 . 3.560 2.617 2.355 3.112 . 0 0 "[ . 1 . 2 . ]" 1 1828 1 80 ILE MD 1 99 PHE HZ 3.650 . 5.500 3.981 3.676 4.515 . 0 0 "[ . 1 . 2 . ]" 1 1829 1 80 ILE HG12 1 80 ILE MG 2.460 . 3.120 2.432 2.372 2.470 . 0 0 "[ . 1 . 2 . ]" 1 1830 1 80 ILE HG12 1 81 VAL H 3.140 . 4.480 4.264 4.108 4.422 . 0 0 "[ . 1 . 2 . ]" 1 1831 1 80 ILE HG12 1 97 VAL QG 2.995 . 4.190 3.057 2.548 3.682 . 0 0 "[ . 1 . 2 . ]" 1 1832 1 80 ILE HG12 1 99 PHE HA 3.650 . 5.500 3.911 3.654 4.355 . 0 0 "[ . 1 . 2 . ]" 1 1833 1 80 ILE HG12 1 99 PHE QD 3.030 . 4.260 2.339 1.919 2.682 . 0 0 "[ . 1 . 2 . ]" 1 1834 1 80 ILE HG12 1 99 PHE QE 3.185 . 4.570 2.329 1.979 2.654 . 0 0 "[ . 1 . 2 . ]" 1 1835 1 80 ILE HG13 1 99 PHE QD 3.050 . 4.300 3.223 2.970 3.515 . 0 0 "[ . 1 . 2 . ]" 1 1836 1 80 ILE HG13 1 99 PHE QE 3.175 . 4.550 3.381 3.057 3.781 . 0 0 "[ . 1 . 2 . ]" 1 1837 1 80 ILE MG 1 81 VAL H 2.515 . 3.230 2.512 2.404 2.651 . 0 0 "[ . 1 . 2 . ]" 1 1838 1 80 ILE MG 1 82 SER H 2.605 . 3.410 1.940 1.736 2.186 0.064 22 0 "[ . 1 . 2 . ]" 1 1839 1 80 ILE MG 1 82 SER HB2 2.905 . 4.010 2.919 2.206 4.104 0.094 21 0 "[ . 1 . 2 . ]" 1 1840 1 80 ILE MG 1 82 SER HB3 2.905 . 4.010 3.668 2.277 4.167 0.157 27 0 "[ . 1 . 2 . ]" 1 1841 1 80 ILE MG 1 83 SER HB2 3.650 . 5.500 4.209 2.103 5.507 0.007 23 0 "[ . 1 . 2 . ]" 1 1842 1 80 ILE MG 1 83 SER QB 3.315 . 4.830 3.742 2.080 4.886 0.056 26 0 "[ . 1 . 2 . ]" 1 1843 1 80 ILE MG 1 83 SER HB3 3.650 . 5.500 4.443 2.759 5.522 0.022 19 0 "[ . 1 . 2 . ]" 1 1844 1 80 ILE MG 1 97 VAL HA 3.000 . 4.200 3.655 3.183 4.092 . 0 0 "[ . 1 . 2 . ]" 1 1845 1 80 ILE MG 1 97 VAL QG 2.395 . 2.990 1.880 1.788 2.134 0.012 22 0 "[ . 1 . 2 . ]" 1 1846 1 80 ILE MG 1 98 ARG H 3.040 . 4.280 3.586 3.140 3.894 . 0 0 "[ . 1 . 2 . ]" 1 1847 1 80 ILE MG 1 99 PHE HA 3.245 . 4.690 3.602 3.309 4.141 . 0 0 "[ . 1 . 2 . ]" 1 1848 1 81 VAL H 1 81 VAL HB 2.765 . 3.730 3.262 2.301 3.721 . 0 0 "[ . 1 . 2 . ]" 1 1849 1 81 VAL H 1 81 VAL MG1 2.835 . 3.870 2.647 2.047 3.730 . 0 0 "[ . 1 . 2 . ]" 1 1850 1 81 VAL H 1 81 VAL QG 2.335 . 2.870 2.108 1.921 2.426 . 0 0 "[ . 1 . 2 . ]" 1 1851 1 81 VAL H 1 81 VAL MG2 2.835 . 3.870 2.406 2.140 2.709 . 0 0 "[ . 1 . 2 . ]" 1 1852 1 81 VAL H 1 82 SER H 2.955 . 4.110 2.307 2.093 2.564 . 0 0 "[ . 1 . 2 . ]" 1 1853 1 81 VAL H 1 97 VAL QG 3.375 . 4.950 3.993 3.746 4.239 . 0 0 "[ . 1 . 2 . ]" 1 1854 1 81 VAL H 1 98 ARG H 3.200 . 4.600 4.057 3.734 4.341 . 0 0 "[ . 1 . 2 . ]" 1 1855 1 81 VAL H 1 98 ARG HB3 3.105 . 4.410 4.174 3.862 4.430 0.020 8 0 "[ . 1 . 2 . ]" 1 1856 1 81 VAL H 1 98 ARG QG 3.320 . 4.840 4.296 4.047 4.561 . 0 0 "[ . 1 . 2 . ]" 1 1857 1 81 VAL H 1 99 PHE HA 2.980 . 4.160 2.497 2.120 2.854 . 0 0 "[ . 1 . 2 . ]" 1 1858 1 81 VAL H 1 99 PHE QD 3.465 . 5.130 4.507 4.048 4.841 . 0 0 "[ . 1 . 2 . ]" 1 1859 1 81 VAL H 1 100 VAL QG 3.130 . 4.460 3.455 2.886 3.988 . 0 0 "[ . 1 . 2 . ]" 1 1860 1 81 VAL HA 1 81 VAL MG1 2.620 . 3.440 2.577 2.465 2.727 . 0 0 "[ . 1 . 2 . ]" 1 1861 1 81 VAL HA 1 81 VAL QG 2.380 . 2.960 2.384 2.110 2.585 . 0 0 "[ . 1 . 2 . ]" 1 1862 1 81 VAL HA 1 81 VAL MG2 2.620 . 3.440 2.939 2.245 3.232 . 0 0 "[ . 1 . 2 . ]" 1 1863 1 81 VAL HA 1 82 SER H 2.685 . 3.570 3.459 3.370 3.539 . 0 0 "[ . 1 . 2 . ]" 1 1864 1 81 VAL HB 1 82 SER H 2.940 . 4.080 3.590 2.328 4.111 0.031 11 0 "[ . 1 . 2 . ]" 1 1865 1 81 VAL HB 1 98 ARG H 3.650 . 5.500 4.845 3.199 5.613 0.113 27 0 "[ . 1 . 2 . ]" 1 1866 1 81 VAL HB 1 98 ARG HA 3.650 . 5.500 5.882 4.111 6.766 1.266 19 20 "[ **** * *** *.- *+*** ***** ]" 1 1867 1 81 VAL HB 1 98 ARG QG 3.095 . 4.390 3.971 2.815 4.485 0.095 24 0 "[ . 1 . 2 . ]" 1 1868 1 81 VAL HB 1 99 PHE HA 3.650 . 5.500 4.964 3.571 5.588 0.088 22 0 "[ . 1 . 2 . ]" 1 1869 1 81 VAL QG 1 82 SER H 2.600 . 3.400 2.567 2.171 3.149 . 0 0 "[ . 1 . 2 . ]" 1 1870 1 81 VAL QG 1 82 SER QB 3.195 . 4.590 3.374 2.184 4.221 . 0 0 "[ . 1 . 2 . ]" 1 1871 1 81 VAL QG 1 98 ARG H 3.140 . 4.480 2.936 2.382 3.978 . 0 0 "[ . 1 . 2 . ]" 1 1872 1 81 VAL QG 1 98 ARG HB2 2.970 . 4.140 3.292 3.021 3.822 . 0 0 "[ . 1 . 2 . ]" 1 1873 1 81 VAL QG 1 98 ARG HB3 2.620 . 3.440 2.005 1.751 2.577 0.049 5 0 "[ . 1 . 2 . ]" 1 1874 1 81 VAL QG 1 98 ARG QD 2.855 . 3.910 2.581 1.881 3.784 . 0 0 "[ . 1 . 2 . ]" 1 1875 1 81 VAL QG 1 98 ARG QG 2.695 . 3.590 2.157 1.973 2.408 . 0 0 "[ . 1 . 2 . ]" 1 1876 1 81 VAL QG 1 99 PHE H 2.950 . 4.100 3.313 3.072 3.464 . 0 0 "[ . 1 . 2 . ]" 1 1877 1 81 VAL QG 1 99 PHE HA 3.045 . 4.290 2.627 2.427 2.725 . 0 0 "[ . 1 . 2 . ]" 1 1878 1 81 VAL QG 1 100 VAL H 2.990 . 4.180 3.118 2.829 3.330 . 0 0 "[ . 1 . 2 . ]" 1 1879 1 81 VAL QG 1 100 VAL HA 3.110 . 4.420 3.557 3.240 3.916 . 0 0 "[ . 1 . 2 . ]" 1 1880 1 81 VAL QG 1 100 VAL HB 2.805 . 3.810 2.988 1.846 3.915 0.105 2 0 "[ . 1 . 2 . ]" 1 1881 1 81 VAL QG 1 101 CYS H 3.620 . 5.440 5.091 4.795 5.430 . 0 0 "[ . 1 . 2 . ]" 1 1882 1 81 VAL MG1 1 82 SER H 2.955 . 4.110 3.580 3.135 3.904 . 0 0 "[ . 1 . 2 . ]" 1 1883 1 81 VAL MG1 1 98 ARG H 3.490 . 5.180 4.301 3.902 4.834 . 0 0 "[ . 1 . 2 . ]" 1 1884 1 81 VAL MG1 1 98 ARG HB2 3.360 . 4.920 4.282 3.825 4.999 0.079 19 0 "[ . 1 . 2 . ]" 1 1885 1 81 VAL MG1 1 98 ARG HB3 2.880 . 3.960 3.032 2.530 3.741 . 0 0 "[ . 1 . 2 . ]" 1 1886 1 81 VAL MG1 1 98 ARG HE 3.305 . 4.810 4.213 2.330 4.905 0.095 28 0 "[ . 1 . 2 . ]" 1 1887 1 81 VAL MG1 1 98 ARG QG 3.005 . 4.210 2.635 2.012 3.416 . 0 0 "[ . 1 . 2 . ]" 1 1888 1 81 VAL MG1 1 99 PHE H 3.260 . 4.720 4.005 3.336 4.874 0.154 17 0 "[ . 1 . 2 . ]" 1 1889 1 81 VAL MG1 1 99 PHE HA 3.650 . 5.500 3.398 2.597 5.040 . 0 0 "[ . 1 . 2 . ]" 1 1890 1 81 VAL MG2 1 82 SER H 2.955 . 4.110 2.818 2.187 3.988 . 0 0 "[ . 1 . 2 . ]" 1 1891 1 81 VAL MG2 1 98 ARG H 3.490 . 5.180 3.186 2.395 4.827 . 0 0 "[ . 1 . 2 . ]" 1 1892 1 81 VAL MG2 1 98 ARG HB2 3.360 . 4.920 3.552 3.137 4.592 . 0 0 "[ . 1 . 2 . ]" 1 1893 1 81 VAL MG2 1 98 ARG HB3 2.880 . 3.960 2.207 1.770 3.406 0.030 22 0 "[ . 1 . 2 . ]" 1 1894 1 81 VAL MG2 1 98 ARG HE 3.305 . 4.810 3.818 1.917 4.873 0.063 23 0 "[ . 1 . 2 . ]" 1 1895 1 81 VAL MG2 1 98 ARG QG 3.005 . 4.210 2.504 2.063 3.005 . 0 0 "[ . 1 . 2 . ]" 1 1896 1 81 VAL MG2 1 99 PHE H 3.260 . 4.720 3.819 3.105 4.527 . 0 0 "[ . 1 . 2 . ]" 1 1897 1 81 VAL MG2 1 99 PHE HA 3.650 . 5.500 3.518 2.434 4.469 . 0 0 "[ . 1 . 2 . ]" 1 1898 1 82 SER H 1 82 SER HB2 2.835 . 3.870 2.565 2.346 2.956 . 0 0 "[ . 1 . 2 . ]" 1 1899 1 82 SER H 1 82 SER QB 2.575 . 3.350 2.427 2.277 2.530 . 0 0 "[ . 1 . 2 . ]" 1 1900 1 82 SER H 1 82 SER HB3 2.835 . 3.870 3.309 2.488 3.603 . 0 0 "[ . 1 . 2 . ]" 1 1901 1 82 SER HA 1 83 SER H 2.455 . 3.110 2.646 2.133 3.188 0.078 20 0 "[ . 1 . 2 . ]" 1 1902 1 82 SER QB 1 97 VAL QG 3.055 . 4.310 2.397 1.851 3.505 . 0 0 "[ . 1 . 2 . ]" 1 1903 1 82 SER QB 1 98 ARG H 3.215 . 4.630 2.831 1.788 3.660 0.012 27 0 "[ . 1 . 2 . ]" 1 1904 1 82 SER QB 1 98 ARG HB2 3.570 . 5.340 5.138 4.068 5.411 0.071 22 0 "[ . 1 . 2 . ]" 1 1905 1 82 SER HB2 1 98 ARG HB3 3.650 . 5.500 4.779 3.649 5.184 . 0 0 "[ . 1 . 2 . ]" 1 1906 1 82 SER HB3 1 98 ARG HB3 3.650 . 5.500 5.248 4.342 5.522 0.022 6 0 "[ . 1 . 2 . ]" 1 1907 1 83 SER HA 1 84 ALA H 2.655 . 3.510 2.757 2.113 3.554 0.044 4 0 "[ . 1 . 2 . ]" 1 1908 1 83 SER QB 1 84 ALA H 2.875 . 3.950 3.209 2.029 3.976 0.026 21 0 "[ . 1 . 2 . ]" 1 1909 1 83 SER HB2 1 84 ALA H 3.195 . 4.590 3.715 2.131 4.522 . 0 0 "[ . 1 . 2 . ]" 1 1910 1 83 SER HB3 1 84 ALA H 3.195 . 4.590 3.752 2.054 4.472 . 0 0 "[ . 1 . 2 . ]" 1 1911 1 84 ALA H 1 84 ALA MB 2.340 . 2.880 2.493 2.219 2.915 0.035 28 0 "[ . 1 . 2 . ]" 1 1912 1 84 ALA HA 1 85 MET H 2.460 . 3.120 2.313 2.012 3.125 0.005 9 0 "[ . 1 . 2 . ]" 1 1913 1 84 ALA HA 1 85 MET QB 3.570 . 5.340 4.460 4.015 5.188 . 0 0 "[ . 1 . 2 . ]" 1 1914 1 84 ALA HA 1 85 MET ME 3.595 . 5.390 4.609 2.891 5.531 0.141 12 0 "[ . 1 . 2 . ]" 1 1915 1 84 ALA MB 1 85 MET H 2.675 . 3.550 3.302 1.882 3.606 0.056 29 0 "[ . 1 . 2 . ]" 1 1916 1 84 ALA MB 1 86 GLU H 3.175 . 4.550 4.133 2.372 4.696 0.146 17 0 "[ . 1 . 2 . ]" 1 1917 1 85 MET H 1 85 MET HB2 2.975 . 4.150 2.919 2.343 4.153 0.003 1 0 "[ . 1 . 2 . ]" 1 1918 1 85 MET H 1 85 MET QB 2.600 . 3.400 2.564 2.236 3.411 0.011 1 0 "[ . 1 . 2 . ]" 1 1919 1 85 MET H 1 85 MET HB3 2.975 . 4.150 3.210 2.431 3.947 . 0 0 "[ . 1 . 2 . ]" 1 1920 1 85 MET H 1 85 MET ME 3.100 . 4.400 3.500 2.287 4.443 0.043 7 0 "[ . 1 . 2 . ]" 1 1921 1 85 MET H 1 85 MET QG 3.045 . 4.290 3.260 2.116 4.291 0.001 7 0 "[ . 1 . 2 . ]" 1 1922 1 85 MET H 1 86 GLU QB 3.570 . 5.340 4.879 3.697 5.498 0.158 28 0 "[ . 1 . 2 . ]" 1 1923 1 85 MET H 1 86 GLU QG 3.600 . 5.400 4.288 2.895 5.418 0.018 20 0 "[ . 1 . 2 . ]" 1 1924 1 85 MET HA 1 85 MET ME 3.025 . 4.250 3.415 1.773 4.392 0.142 10 0 "[ . 1 . 2 . ]" 1 1925 1 85 MET HA 1 85 MET QG 2.755 . 3.710 2.803 2.390 3.554 . 0 0 "[ . 1 . 2 . ]" 1 1926 1 85 MET HA 1 86 GLU H 2.680 . 3.560 2.936 1.995 3.534 . 0 0 "[ . 1 . 2 . ]" 1 1927 1 85 MET QB 1 86 GLU H 2.935 . 4.070 3.199 1.868 3.955 . 0 0 "[ . 1 . 2 . ]" 1 1928 1 85 MET HB2 1 86 GLU H 3.290 . 4.780 3.538 1.898 4.500 . 0 0 "[ . 1 . 2 . ]" 1 1929 1 85 MET HB3 1 86 GLU H 3.290 . 4.780 3.865 2.784 4.451 . 0 0 "[ . 1 . 2 . ]" 1 1930 1 85 MET ME 1 85 MET QG 2.700 . 3.600 2.392 2.110 2.522 . 0 0 "[ . 1 . 2 . ]" 1 1931 1 85 MET ME 1 86 GLU H 3.055 . 4.310 3.744 1.893 4.458 0.148 9 0 "[ . 1 . 2 . ]" 1 1932 1 85 MET ME 1 91 TYR QD 3.650 . 5.500 4.077 2.699 5.542 0.042 3 0 "[ . 1 . 2 . ]" 1 1933 1 85 MET ME 1 91 TYR QE 3.295 . 4.790 3.347 1.974 4.826 0.036 25 0 "[ . 1 . 2 . ]" 1 1934 1 85 MET QG 1 86 GLU H 3.230 . 4.660 3.675 2.048 4.735 0.075 26 0 "[ . 1 . 2 . ]" 1 1935 1 85 MET HG2 1 86 GLU H 3.650 . 5.500 4.394 2.376 5.584 0.084 29 0 "[ . 1 . 2 . ]" 1 1936 1 85 MET HG3 1 86 GLU H 3.650 . 5.500 4.147 2.236 5.587 0.087 27 0 "[ . 1 . 2 . ]" 1 1937 1 86 GLU H 1 86 GLU QB 2.610 . 3.420 2.738 2.227 3.309 . 0 0 "[ . 1 . 2 . ]" 1 1938 1 86 GLU H 1 86 GLU QG 2.660 . 3.520 2.822 2.009 3.598 0.078 15 0 "[ . 1 . 2 . ]" 1 1939 1 86 GLU H 1 87 PRO QD 3.120 . 4.440 4.034 1.733 4.467 0.067 12 0 "[ . 1 . 2 . ]" 1 1940 1 86 GLU H 1 89 ARG QB 3.560 . 5.320 3.794 2.055 5.381 0.061 12 0 "[ . 1 . 2 . ]" 1 1941 1 86 GLU H 1 89 ARG HG2 3.650 . 5.500 4.242 2.414 5.349 . 0 0 "[ . 1 . 2 . ]" 1 1942 1 86 GLU H 1 89 ARG HG3 3.650 . 5.500 4.584 3.114 5.584 0.084 10 0 "[ . 1 . 2 . ]" 1 1943 1 86 GLU QB 1 87 PRO QD 2.400 . 3.000 2.189 1.887 2.504 . 0 0 "[ . 1 . 2 . ]" 1 1944 1 86 GLU QB 1 89 ARG H 2.965 . 4.130 2.836 1.752 4.219 0.089 9 0 "[ . 1 . 2 . ]" 1 1945 1 86 GLU HB2 1 87 PRO QD 2.695 . 3.590 3.120 1.905 3.704 0.114 15 0 "[ . 1 . 2 . ]" 1 1946 1 86 GLU HB3 1 87 PRO QD 2.695 . 3.590 2.556 1.925 3.544 . 0 0 "[ . 1 . 2 . ]" 1 1947 1 86 GLU QG 1 87 PRO QD 2.900 . 4.000 3.678 3.281 4.094 0.094 19 0 "[ . 1 . 2 . ]" 1 1948 1 86 GLU QG 1 89 ARG H 3.095 . 4.390 3.841 1.784 4.613 0.223 9 0 "[ . 1 . 2 . ]" 1 1949 1 87 PRO HA 1 88 ASP H 2.665 . 3.530 3.348 3.036 3.550 0.020 7 0 "[ . 1 . 2 . ]" 1 1950 1 87 PRO HA 1 89 ARG H 3.650 . 5.500 4.352 3.765 5.271 . 0 0 "[ . 1 . 2 . ]" 1 1951 1 87 PRO QB 1 88 ASP H 2.775 . 3.750 3.490 3.053 3.792 0.042 6 0 "[ . 1 . 2 . ]" 1 1952 1 87 PRO HB2 1 88 ASP H 3.120 . 4.440 3.687 3.137 4.090 . 0 0 "[ . 1 . 2 . ]" 1 1953 1 87 PRO HB3 1 88 ASP H 3.120 . 4.440 4.348 4.184 4.503 0.063 3 0 "[ . 1 . 2 . ]" 1 1954 1 87 PRO QD 1 88 ASP H 2.750 . 3.700 2.898 2.380 3.541 . 0 0 "[ . 1 . 2 . ]" 1 1955 1 87 PRO QD 1 89 ARG H 3.280 . 4.760 4.253 3.723 4.808 0.048 6 0 "[ . 1 . 2 . ]" 1 1956 1 87 PRO QG 1 88 ASP H 2.680 . 3.560 2.974 2.500 3.563 0.003 6 0 "[ . 1 . 2 . ]" 1 1957 1 87 PRO QG 1 88 ASP QB 3.205 . 4.610 3.752 3.146 4.578 . 0 0 "[ . 1 . 2 . ]" 1 1958 1 88 ASP H 1 88 ASP QB 2.505 . 3.210 2.397 2.183 2.754 . 0 0 "[ . 1 . 2 . ]" 1 1959 1 88 ASP H 1 89 ARG H 2.400 . 3.000 2.020 1.779 2.550 0.021 18 0 "[ . 1 . 2 . ]" 1 1960 1 88 ASP H 1 89 ARG HB2 3.650 . 5.500 4.954 4.154 5.633 0.133 2 0 "[ . 1 . 2 . ]" 1 1961 1 88 ASP H 1 89 ARG QB 3.265 . 4.730 4.335 4.044 4.770 0.040 12 0 "[ . 1 . 2 . ]" 1 1962 1 88 ASP H 1 89 ARG HB3 3.650 . 5.500 5.165 4.217 5.641 0.141 8 0 "[ . 1 . 2 . ]" 1 1963 1 88 ASP H 1 89 ARG HG2 3.540 . 5.280 4.126 3.209 5.342 0.062 3 0 "[ . 1 . 2 . ]" 1 1964 1 88 ASP H 1 89 ARG QG 3.140 . 4.480 3.549 2.931 3.984 . 0 0 "[ . 1 . 2 . ]" 1 1965 1 88 ASP H 1 89 ARG HG3 3.540 . 5.280 4.404 2.973 5.342 0.062 7 0 "[ . 1 . 2 . ]" 1 1966 1 88 ASP HA 1 88 ASP QB 2.320 . 2.840 2.362 2.178 2.423 . 0 0 "[ . 1 . 2 . ]" 1 1967 1 88 ASP HA 1 90 GLU H 3.585 . 5.370 4.806 3.872 5.451 0.081 2 0 "[ . 1 . 2 . ]" 1 1968 1 88 ASP QB 1 89 ARG H 2.695 . 3.590 2.721 1.955 3.562 . 0 0 "[ . 1 . 2 . ]" 1 1969 1 88 ASP QB 1 89 ARG HG2 3.650 . 5.500 4.355 2.427 5.652 0.152 2 0 "[ . 1 . 2 . ]" 1 1970 1 88 ASP QB 1 89 ARG HG3 3.650 . 5.500 4.622 3.673 5.656 0.156 10 0 "[ . 1 . 2 . ]" 1 1971 1 88 ASP QB 1 90 GLU H 3.585 . 5.370 4.408 2.137 5.481 0.111 11 0 "[ . 1 . 2 . ]" 1 1972 1 89 ARG H 1 89 ARG HB2 2.800 . 3.800 3.203 2.310 3.832 0.032 13 0 "[ . 1 . 2 . ]" 1 1973 1 89 ARG H 1 89 ARG QB 2.555 . 3.310 2.750 2.281 3.320 0.010 12 0 "[ . 1 . 2 . ]" 1 1974 1 89 ARG H 1 89 ARG HB3 2.800 . 3.800 3.361 2.631 3.865 0.065 22 0 "[ . 1 . 2 . ]" 1 1975 1 89 ARG H 1 89 ARG QD 3.050 . 4.300 3.890 2.905 4.438 0.138 18 0 "[ . 1 . 2 . ]" 1 1976 1 89 ARG H 1 89 ARG HG2 2.725 . 3.650 2.887 2.080 3.817 0.167 13 0 "[ . 1 . 2 . ]" 1 1977 1 89 ARG H 1 89 ARG QG 2.445 . 3.090 2.402 1.905 2.792 . 0 0 "[ . 1 . 2 . ]" 1 1978 1 89 ARG H 1 89 ARG HG3 2.725 . 3.650 3.126 1.912 3.765 0.115 23 0 "[ . 1 . 2 . ]" 1 1979 1 89 ARG H 1 90 GLU QG 3.495 . 5.190 4.723 4.072 5.207 0.017 11 0 "[ . 1 . 2 . ]" 1 1980 1 89 ARG HA 1 89 ARG QD 2.805 . 3.810 3.160 1.953 4.030 0.220 11 0 "[ . 1 . 2 . ]" 1 1981 1 89 ARG HA 1 89 ARG QG 2.750 . 3.700 2.950 2.276 3.455 . 0 0 "[ . 1 . 2 . ]" 1 1982 1 89 ARG HA 1 90 GLU H 2.385 . 2.970 2.412 1.883 3.251 0.281 12 0 "[ . 1 . 2 . ]" 1 1983 1 89 ARG HB2 1 89 ARG QD 2.600 . 3.400 2.785 1.970 3.469 0.069 4 0 "[ . 1 . 2 . ]" 1 1984 1 89 ARG HB3 1 89 ARG QD 2.600 . 3.400 2.796 2.219 3.450 0.050 6 0 "[ . 1 . 2 . ]" 1 1985 1 89 ARG QD 1 90 GLU H 3.305 . 4.810 4.378 3.698 4.983 0.173 8 0 "[ . 1 . 2 . ]" 1 1986 1 90 GLU H 1 90 GLU HB2 2.735 . 3.670 2.678 2.360 3.674 0.004 29 0 "[ . 1 . 2 . ]" 1 1987 1 90 GLU H 1 90 GLU QB 2.330 . 2.860 2.530 2.329 2.939 0.079 12 0 "[ . 1 . 2 . ]" 1 1988 1 90 GLU H 1 90 GLU HB3 2.735 . 3.670 3.536 2.869 3.737 0.067 10 0 "[ . 1 . 2 . ]" 1 1989 1 90 GLU H 1 90 GLU QG 2.565 . 3.330 2.322 1.797 2.964 0.003 26 0 "[ . 1 . 2 . ]" 1 1990 1 90 GLU H 1 91 TYR H 3.215 . 4.630 4.247 1.979 4.603 . 0 0 "[ . 1 . 2 . ]" 1 1991 1 90 GLU HA 1 90 GLU QG 2.545 . 3.290 2.726 2.411 3.331 0.041 29 0 "[ . 1 . 2 . ]" 1 1992 1 90 GLU HA 1 91 TYR H 2.480 . 3.160 2.508 2.137 3.248 0.088 2 0 "[ . 1 . 2 . ]" 1 1993 1 90 GLU HA 1 91 TYR QB 3.455 . 5.110 4.546 4.261 4.789 . 0 0 "[ . 1 . 2 . ]" 1 1994 1 90 GLU HA 1 91 TYR QD 3.200 . 4.600 4.078 3.325 4.611 0.011 3 0 "[ . 1 . 2 . ]" 1 1995 1 90 GLU HA 1 91 TYR QE 3.640 . 5.480 5.113 4.285 5.441 . 0 0 "[ . 1 . 2 . ]" 1 1996 1 90 GLU QB 1 91 TYR H 2.585 . 3.370 2.530 1.954 3.416 0.046 2 0 "[ . 1 . 2 . ]" 1 1997 1 90 GLU HB2 1 91 TYR H 2.820 . 3.840 3.389 2.460 3.857 0.017 15 0 "[ . 1 . 2 . ]" 1 1998 1 90 GLU HB3 1 91 TYR H 2.820 . 3.840 2.770 1.973 3.943 0.103 23 0 "[ . 1 . 2 . ]" 1 1999 1 90 GLU QG 1 91 TYR H 3.055 . 4.310 4.003 2.351 4.365 0.055 22 0 "[ . 1 . 2 . ]" 1 2000 1 91 TYR H 1 91 TYR QB 2.620 . 3.440 2.524 2.351 3.421 . 0 0 "[ . 1 . 2 . ]" 1 2001 1 91 TYR H 1 91 TYR QD 2.665 . 3.530 2.849 2.471 3.586 0.056 17 0 "[ . 1 . 2 . ]" 1 2002 1 91 TYR HA 1 92 HIS H 2.680 . 3.560 2.110 1.992 2.305 . 0 0 "[ . 1 . 2 . ]" 1 2003 1 91 TYR QB 1 92 HIS H 2.920 . 4.040 3.256 2.537 3.701 . 0 0 "[ . 1 . 2 . ]" 1 2004 1 91 TYR QB 1 121 TRP HZ2 3.200 . 4.600 2.566 1.934 3.471 . 0 0 "[ . 1 . 2 . ]" 1 2005 1 91 TYR HB2 1 121 TRP HZ2 3.550 . 5.300 3.115 2.255 4.506 . 0 0 "[ . 1 . 2 . ]" 1 2006 1 91 TYR HB3 1 121 TRP HZ2 3.550 . 5.300 2.819 1.964 3.900 . 0 0 "[ . 1 . 2 . ]" 1 2007 1 91 TYR QD 1 92 HIS H 3.100 . 4.400 3.966 3.512 4.409 0.009 6 0 "[ . 1 . 2 . ]" 1 2008 1 91 TYR QD 1 95 GLN H 3.650 . 5.500 5.527 5.110 5.644 0.144 24 0 "[ . 1 . 2 . ]" 1 2009 1 91 TYR QD 1 95 GLN HB2 3.085 . 4.370 3.342 2.793 4.068 . 0 0 "[ . 1 . 2 . ]" 1 2010 1 91 TYR QD 1 95 GLN QB 2.805 . 3.810 2.772 2.254 3.280 . 0 0 "[ . 1 . 2 . ]" 1 2011 1 91 TYR QD 1 95 GLN HB3 3.085 . 4.370 2.990 2.316 3.547 . 0 0 "[ . 1 . 2 . ]" 1 2012 1 91 TYR QD 1 95 GLN HG2 3.650 . 5.500 4.065 1.929 5.088 . 0 0 "[ . 1 . 2 . ]" 1 2013 1 91 TYR QD 1 95 GLN HG3 3.650 . 5.500 3.095 2.267 4.335 . 0 0 "[ . 1 . 2 . ]" 1 2014 1 91 TYR QD 1 97 VAL QG 3.360 . 4.920 3.017 2.475 3.728 . 0 0 "[ . 1 . 2 . ]" 1 2015 1 91 TYR QD 1 121 TRP HH2 3.375 . 4.950 2.507 2.051 3.246 . 0 0 "[ . 1 . 2 . ]" 1 2016 1 91 TYR QD 1 121 TRP HZ2 3.285 . 4.770 3.065 2.675 3.419 . 0 0 "[ . 1 . 2 . ]" 1 2017 1 91 TYR QE 1 97 VAL QG 3.175 . 4.550 2.368 1.985 2.939 . 0 0 "[ . 1 . 2 . ]" 1 2018 1 92 HIS H 1 95 GLN HB2 3.320 . 4.840 3.207 2.407 3.960 . 0 0 "[ . 1 . 2 . ]" 1 2019 1 92 HIS H 1 95 GLN QB 3.015 . 4.230 3.095 2.372 3.791 . 0 0 "[ . 1 . 2 . ]" 1 2020 1 92 HIS H 1 95 GLN HB3 3.320 . 4.840 4.174 3.016 4.857 0.017 9 0 "[ . 1 . 2 . ]" 1 2021 1 92 HIS H 1 95 GLN HG2 3.650 . 5.500 2.711 2.000 3.757 . 0 0 "[ . 1 . 2 . ]" 1 2022 1 92 HIS H 1 95 GLN QG 3.265 . 4.730 2.358 1.784 3.657 0.016 7 0 "[ . 1 . 2 . ]" 1 2023 1 92 HIS H 1 95 GLN HG3 3.650 . 5.500 2.833 1.808 5.081 . 0 0 "[ . 1 . 2 . ]" 1 2024 1 92 HIS HA 1 92 HIS HD2 3.270 . 4.740 3.106 2.468 4.702 . 0 0 "[ . 1 . 2 . ]" 1 2025 1 92 HIS HA 1 93 PHE H 2.485 . 3.170 2.361 2.175 2.499 . 0 0 "[ . 1 . 2 . ]" 1 2026 1 92 HIS QB 1 93 PHE H 2.630 . 3.460 2.529 2.147 3.555 0.095 26 0 "[ . 1 . 2 . ]" 1 2027 1 92 HIS HB2 1 93 PHE H 2.890 . 3.980 3.429 2.214 4.011 0.031 26 0 "[ . 1 . 2 . ]" 1 2028 1 92 HIS HB3 1 93 PHE H 2.890 . 3.980 2.823 2.177 3.971 . 0 0 "[ . 1 . 2 . ]" 1 2029 1 92 HIS HD2 1 93 PHE H 3.315 . 4.830 4.397 3.419 4.819 . 0 0 "[ . 1 . 2 . ]" 1 2030 1 93 PHE H 1 93 PHE HB2 2.600 . 3.400 2.513 2.350 2.637 . 0 0 "[ . 1 . 2 . ]" 1 2031 1 93 PHE H 1 93 PHE HB3 2.600 . 3.400 2.564 2.432 2.721 . 0 0 "[ . 1 . 2 . ]" 1 2032 1 93 PHE H 1 93 PHE QD 3.450 . 5.100 4.193 4.131 4.252 . 0 0 "[ . 1 . 2 . ]" 1 2033 1 93 PHE H 1 94 GLY H 3.245 . 4.690 4.486 4.282 4.615 . 0 0 "[ . 1 . 2 . ]" 1 2034 1 93 PHE HA 1 93 PHE QD 3.215 . 4.630 2.781 2.346 3.102 . 0 0 "[ . 1 . 2 . ]" 1 2035 1 93 PHE HA 1 94 GLY H 2.635 . 3.470 2.137 2.023 2.253 . 0 0 "[ . 1 . 2 . ]" 1 2036 1 93 PHE HA 1 94 GLY QA 3.325 . 4.850 3.901 3.817 3.983 . 0 0 "[ . 1 . 2 . ]" 1 2037 1 93 PHE HA 1 95 GLN H 2.975 . 4.150 3.433 3.186 3.730 . 0 0 "[ . 1 . 2 . ]" 1 2038 1 93 PHE HA 1 116 SER H 3.650 . 5.500 5.108 4.566 5.515 0.015 29 0 "[ . 1 . 2 . ]" 1 2039 1 93 PHE QB 1 94 GLY H 2.885 . 3.970 3.736 3.592 3.882 . 0 0 "[ . 1 . 2 . ]" 1 2040 1 93 PHE QB 1 94 GLY QA 3.490 . 5.180 4.234 4.101 4.387 . 0 0 "[ . 1 . 2 . ]" 1 2041 1 93 PHE QB 1 95 GLN H 3.570 . 5.340 4.913 4.732 5.051 . 0 0 "[ . 1 . 2 . ]" 1 2042 1 93 PHE QB 1 119 GLY H 3.570 . 5.340 5.066 4.279 5.387 0.047 19 0 "[ . 1 . 2 . ]" 1 2043 1 93 PHE HB2 1 94 GLY H 3.225 . 4.650 4.181 4.006 4.376 . 0 0 "[ . 1 . 2 . ]" 1 2044 1 93 PHE HB3 1 94 GLY H 3.225 . 4.650 4.208 4.053 4.385 . 0 0 "[ . 1 . 2 . ]" 1 2045 1 93 PHE QD 1 94 GLY H 2.955 . 4.110 3.381 2.020 3.869 . 0 0 "[ . 1 . 2 . ]" 1 2046 1 93 PHE QD 1 94 GLY QA 3.570 . 5.340 3.569 2.914 4.315 . 0 0 "[ . 1 . 2 . ]" 1 2047 1 93 PHE QD 1 95 GLN H 3.650 . 5.500 5.161 4.184 5.464 . 0 0 "[ . 1 . 2 . ]" 1 2048 1 93 PHE QD 1 116 SER H 3.650 . 5.500 4.473 3.732 5.454 . 0 0 "[ . 1 . 2 . ]" 1 2049 1 93 PHE QD 1 117 ASP H 3.310 . 4.820 3.799 2.836 4.848 0.028 12 0 "[ . 1 . 2 . ]" 1 2050 1 93 PHE QD 1 117 ASP HA 3.650 . 5.500 2.913 2.254 3.885 . 0 0 "[ . 1 . 2 . ]" 1 2051 1 93 PHE QD 1 117 ASP QB 3.570 . 5.340 4.065 2.947 5.339 . 0 0 "[ . 1 . 2 . ]" 1 2052 1 93 PHE QE 1 94 GLY H 3.580 . 5.360 4.521 4.103 5.108 . 0 0 "[ . 1 . 2 . ]" 1 2053 1 93 PHE QE 1 117 ASP H 3.015 . 4.230 2.790 1.786 3.742 0.014 23 0 "[ . 1 . 2 . ]" 1 2054 1 93 PHE QE 1 117 ASP HA 3.395 . 4.990 3.173 2.150 4.094 . 0 0 "[ . 1 . 2 . ]" 1 2055 1 93 PHE QE 1 117 ASP HB2 3.570 . 5.340 4.023 2.779 5.110 . 0 0 "[ . 1 . 2 . ]" 1 2056 1 93 PHE QE 1 117 ASP QB 3.215 . 4.630 3.113 1.920 4.291 . 0 0 "[ . 1 . 2 . ]" 1 2057 1 93 PHE QE 1 117 ASP HB3 3.570 . 5.340 3.576 1.942 5.025 . 0 0 "[ . 1 . 2 . ]" 1 2058 1 94 GLY H 1 95 GLN H 2.630 . 3.460 2.462 1.852 2.897 . 0 0 "[ . 1 . 2 . ]" 1 2059 1 94 GLY H 1 95 GLN QB 3.340 . 4.880 4.338 3.684 4.829 . 0 0 "[ . 1 . 2 . ]" 1 2060 1 94 GLY H 1 114 HIS HD2 3.650 . 5.500 4.627 4.062 5.538 0.038 11 0 "[ . 1 . 2 . ]" 1 2061 1 94 GLY H 1 115 CYS QB 2.940 . 4.080 2.384 1.791 3.065 0.009 29 0 "[ . 1 . 2 . ]" 1 2062 1 94 GLY QA 1 114 HIS HD2 3.570 . 5.340 4.026 3.133 4.737 . 0 0 "[ . 1 . 2 . ]" 1 2063 1 95 GLN H 1 95 GLN HB2 2.755 . 3.710 2.396 2.141 2.607 . 0 0 "[ . 1 . 2 . ]" 1 2064 1 95 GLN H 1 95 GLN QB 2.395 . 2.990 2.328 1.999 2.555 . 0 0 "[ . 1 . 2 . ]" 1 2065 1 95 GLN H 1 95 GLN HB3 2.755 . 3.710 3.433 2.165 3.678 . 0 0 "[ . 1 . 2 . ]" 1 2066 1 95 GLN H 1 95 GLN HE21 3.430 . 5.060 4.211 2.044 5.161 0.101 29 0 "[ . 1 . 2 . ]" 1 2067 1 95 GLN H 1 95 GLN QG 2.680 . 3.560 2.717 2.175 3.750 0.190 20 0 "[ . 1 . 2 . ]" 1 2068 1 95 GLN H 1 96 ALA H 3.210 . 4.620 4.457 4.259 4.584 . 0 0 "[ . 1 . 2 . ]" 1 2069 1 95 GLN H 1 114 HIS HD2 3.535 . 5.270 4.936 4.255 5.337 0.067 24 0 "[ . 1 . 2 . ]" 1 2070 1 95 GLN H 1 115 CYS HB2 3.005 . 4.210 3.368 2.578 4.237 0.027 13 0 "[ . 1 . 2 . ]" 1 2071 1 95 GLN H 1 115 CYS QB 2.710 . 3.620 2.882 2.504 3.296 . 0 0 "[ . 1 . 2 . ]" 1 2072 1 95 GLN H 1 115 CYS HB3 3.005 . 4.210 3.721 2.557 4.301 0.091 12 0 "[ . 1 . 2 . ]" 1 2073 1 95 GLN HA 1 95 GLN HE21 3.080 . 4.360 2.950 1.712 4.391 0.088 21 0 "[ . 1 . 2 . ]" 1 2074 1 95 GLN HA 1 95 GLN HE22 3.130 . 4.460 3.534 3.057 4.434 . 0 0 "[ . 1 . 2 . ]" 1 2075 1 95 GLN HA 1 95 GLN HG2 2.925 . 4.050 3.146 2.736 3.775 . 0 0 "[ . 1 . 2 . ]" 1 2076 1 95 GLN HA 1 95 GLN QG 2.615 . 3.430 2.847 2.389 3.006 . 0 0 "[ . 1 . 2 . ]" 1 2077 1 95 GLN HA 1 95 GLN HG3 2.925 . 4.050 3.530 2.425 3.893 . 0 0 "[ . 1 . 2 . ]" 1 2078 1 95 GLN HA 1 96 ALA H 2.410 . 3.020 2.118 1.950 2.349 . 0 0 "[ . 1 . 2 . ]" 1 2079 1 95 GLN HA 1 96 ALA HA 3.575 . 5.350 4.355 4.275 4.443 . 0 0 "[ . 1 . 2 . ]" 1 2080 1 95 GLN QB 1 95 GLN HE22 3.030 . 4.260 3.852 3.387 4.309 0.049 5 0 "[ . 1 . 2 . ]" 1 2081 1 95 GLN QB 1 96 ALA H 2.830 . 3.860 2.909 2.317 3.838 . 0 0 "[ . 1 . 2 . ]" 1 2082 1 95 GLN HB2 1 95 GLN HE21 2.970 . 4.140 3.704 2.034 4.248 0.108 10 0 "[ . 1 . 2 . ]" 1 2083 1 95 GLN HB2 1 96 ALA H 3.190 . 4.580 3.996 3.602 4.400 . 0 0 "[ . 1 . 2 . ]" 1 2084 1 95 GLN HB3 1 95 GLN HE21 2.970 . 4.140 3.256 1.842 4.227 0.087 10 0 "[ . 1 . 2 . ]" 1 2085 1 95 GLN HB3 1 96 ALA H 3.190 . 4.580 3.013 2.345 4.299 . 0 0 "[ . 1 . 2 . ]" 1 2086 1 95 GLN QG 1 96 ALA H 3.065 . 4.330 4.125 2.664 4.447 0.117 24 0 "[ . 1 . 2 . ]" 1 2087 1 95 GLN QG 1 97 VAL QG 3.540 . 5.280 4.363 2.068 5.316 0.036 7 0 "[ . 1 . 2 . ]" 1 2088 1 95 GLN HG2 1 96 ALA H 3.450 . 5.100 4.799 4.106 5.136 0.036 18 0 "[ . 1 . 2 . ]" 1 2089 1 95 GLN HG3 1 96 ALA H 3.450 . 5.100 4.625 2.699 5.136 0.036 17 0 "[ . 1 . 2 . ]" 1 2090 1 96 ALA H 1 96 ALA MB 2.360 . 2.920 2.435 2.305 2.649 . 0 0 "[ . 1 . 2 . ]" 1 2091 1 96 ALA HA 1 97 VAL H 2.410 . 3.020 2.115 2.062 2.195 . 0 0 "[ . 1 . 2 . ]" 1 2092 1 96 ALA HA 1 97 VAL QG 3.130 . 4.460 3.745 3.511 4.246 . 0 0 "[ . 1 . 2 . ]" 1 2093 1 96 ALA HA 1 114 HIS HA 2.875 . 3.950 2.278 2.033 2.790 . 0 0 "[ . 1 . 2 . ]" 1 2094 1 96 ALA HA 1 114 HIS QB 3.415 . 5.030 3.831 3.043 4.443 . 0 0 "[ . 1 . 2 . ]" 1 2095 1 96 ALA HA 1 115 CYS H 3.055 . 4.310 3.628 3.161 4.334 0.024 2 0 "[ . 1 . 2 . ]" 1 2096 1 96 ALA HA 1 121 TRP HZ3 3.360 . 4.920 3.250 2.322 4.225 . 0 0 "[ . 1 . 2 . ]" 1 2097 1 96 ALA MB 1 97 VAL H 2.775 . 3.750 3.267 2.940 3.548 . 0 0 "[ . 1 . 2 . ]" 1 2098 1 96 ALA MB 1 98 ARG H 3.430 . 5.060 4.447 4.086 4.991 . 0 0 "[ . 1 . 2 . ]" 1 2099 1 96 ALA MB 1 114 HIS HA 3.080 . 4.360 3.319 2.574 4.227 . 0 0 "[ . 1 . 2 . ]" 1 2100 1 96 ALA MB 1 114 HIS QB 3.230 . 4.660 3.527 2.607 4.653 . 0 0 "[ . 1 . 2 . ]" 1 2101 1 96 ALA MB 1 114 HIS HD2 3.035 . 4.270 2.461 1.919 3.418 . 0 0 "[ . 1 . 2 . ]" 1 2102 1 96 ALA MB 1 121 TRP HZ3 3.650 . 5.500 4.754 3.986 5.540 0.040 2 0 "[ . 1 . 2 . ]" 1 2103 1 97 VAL H 1 97 VAL HB 2.890 . 3.980 2.524 2.354 2.843 . 0 0 "[ . 1 . 2 . ]" 1 2104 1 97 VAL H 1 97 VAL MG1 2.890 . 3.980 3.497 1.870 3.822 . 0 0 "[ . 1 . 2 . ]" 1 2105 1 97 VAL H 1 97 VAL QG 2.560 . 3.320 2.476 1.865 2.726 . 0 0 "[ . 1 . 2 . ]" 1 2106 1 97 VAL H 1 97 VAL MG2 2.890 . 3.980 2.798 2.229 3.876 . 0 0 "[ . 1 . 2 . ]" 1 2107 1 97 VAL H 1 98 ARG H 3.120 . 4.440 4.196 3.993 4.350 . 0 0 "[ . 1 . 2 . ]" 1 2108 1 97 VAL H 1 98 ARG HB2 3.650 . 5.500 5.351 4.998 5.566 0.066 9 0 "[ . 1 . 2 . ]" 1 2109 1 97 VAL H 1 113 MET QG 3.035 . 4.270 3.004 2.453 3.947 . 0 0 "[ . 1 . 2 . ]" 1 2110 1 97 VAL H 1 114 HIS HA 3.155 . 4.510 3.423 3.125 3.702 . 0 0 "[ . 1 . 2 . ]" 1 2111 1 97 VAL H 1 121 TRP HZ3 3.105 . 4.410 3.134 2.838 3.682 . 0 0 "[ . 1 . 2 . ]" 1 2112 1 97 VAL HA 1 97 VAL MG1 2.650 . 3.500 2.601 2.363 3.255 . 0 0 "[ . 1 . 2 . ]" 1 2113 1 97 VAL HA 1 97 VAL MG2 2.650 . 3.500 2.322 2.241 2.489 . 0 0 "[ . 1 . 2 . ]" 1 2114 1 97 VAL HA 1 98 ARG H 2.375 . 2.950 2.083 2.011 2.215 . 0 0 "[ . 1 . 2 . ]" 1 2115 1 97 VAL HA 1 98 ARG HA 3.530 . 5.260 4.315 4.265 4.390 . 0 0 "[ . 1 . 2 . ]" 1 2116 1 97 VAL HA 1 98 ARG HB2 3.435 . 5.070 4.539 4.347 4.678 . 0 0 "[ . 1 . 2 . ]" 1 2117 1 97 VAL HA 1 98 ARG HB3 3.325 . 4.850 4.497 4.319 4.708 . 0 0 "[ . 1 . 2 . ]" 1 2118 1 97 VAL HB 1 98 ARG H 3.145 . 4.490 4.399 4.271 4.510 0.020 23 0 "[ . 1 . 2 . ]" 1 2119 1 97 VAL HB 1 99 PHE QE 3.650 . 5.500 4.218 3.454 5.577 0.077 24 0 "[ . 1 . 2 . ]" 1 2120 1 97 VAL HB 1 113 MET QB 3.270 . 4.740 4.127 2.379 5.126 0.386 23 0 "[ . 1 . 2 . ]" 1 2121 1 97 VAL HB 1 113 MET QG 3.155 . 4.510 2.433 1.859 4.599 0.089 7 0 "[ . 1 . 2 . ]" 1 2122 1 97 VAL HB 1 121 TRP HE3 3.650 . 5.500 4.721 4.345 5.508 0.008 18 0 "[ . 1 . 2 . ]" 1 2123 1 97 VAL HB 1 121 TRP HZ2 3.650 . 5.500 4.810 3.777 5.511 0.011 1 0 "[ . 1 . 2 . ]" 1 2124 1 97 VAL HB 1 121 TRP HZ3 3.650 . 5.500 3.947 3.210 4.623 . 0 0 "[ . 1 . 2 . ]" 1 2125 1 97 VAL QG 1 98 ARG H 2.680 . 3.560 3.016 2.800 3.205 . 0 0 "[ . 1 . 2 . ]" 1 2126 1 97 VAL QG 1 98 ARG QG 3.620 . 5.440 5.042 4.894 5.138 . 0 0 "[ . 1 . 2 . ]" 1 2127 1 97 VAL QG 1 99 PHE QE 2.715 . 3.630 2.905 2.652 3.115 . 0 0 "[ . 1 . 2 . ]" 1 2128 1 97 VAL QG 1 99 PHE HZ 2.790 . 3.780 2.876 2.412 3.165 . 0 0 "[ . 1 . 2 . ]" 1 2129 1 97 VAL QG 1 113 MET H 3.265 . 4.730 3.577 2.615 3.951 . 0 0 "[ . 1 . 2 . ]" 1 2130 1 97 VAL QG 1 113 MET QB 3.325 . 4.850 3.903 1.840 4.400 . 0 0 "[ . 1 . 2 . ]" 1 2131 1 97 VAL QG 1 113 MET ME 2.950 . 4.100 3.797 3.140 4.085 . 0 0 "[ . 1 . 2 . ]" 1 2132 1 97 VAL QG 1 113 MET QG 2.735 . 3.670 2.591 1.718 3.720 0.082 23 0 "[ . 1 . 2 . ]" 1 2133 1 97 VAL QG 1 121 TRP HH2 2.790 . 3.780 2.355 2.023 3.225 . 0 0 "[ . 1 . 2 . ]" 1 2134 1 97 VAL QG 1 121 TRP HZ2 2.635 . 3.470 3.058 2.582 3.476 0.006 18 0 "[ . 1 . 2 . ]" 1 2135 1 97 VAL QG 1 121 TRP HZ3 2.715 . 3.630 2.913 2.463 3.445 . 0 0 "[ . 1 . 2 . ]" 1 2136 1 97 VAL MG1 1 98 ARG H 3.075 . 4.350 3.284 2.874 4.214 . 0 0 "[ . 1 . 2 . ]" 1 2137 1 97 VAL MG2 1 98 ARG H 3.075 . 4.350 3.856 2.988 4.156 . 0 0 "[ . 1 . 2 . ]" 1 2138 1 98 ARG H 1 98 ARG HB2 2.695 . 3.590 2.854 2.669 3.013 . 0 0 "[ . 1 . 2 . ]" 1 2139 1 98 ARG H 1 98 ARG HB3 2.825 . 3.850 2.472 2.353 2.620 . 0 0 "[ . 1 . 2 . ]" 1 2140 1 98 ARG H 1 98 ARG QG 3.135 . 4.470 3.983 3.918 4.073 . 0 0 "[ . 1 . 2 . ]" 1 2141 1 98 ARG H 1 99 PHE H 3.595 . 5.390 4.451 4.375 4.502 . 0 0 "[ . 1 . 2 . ]" 1 2142 1 98 ARG H 1 112 GLU HB3 3.650 . 5.500 4.508 3.991 5.480 . 0 0 "[ . 1 . 2 . ]" 1 2143 1 98 ARG HA 1 98 ARG QG 2.715 . 3.630 2.490 2.328 2.556 . 0 0 "[ . 1 . 2 . ]" 1 2144 1 98 ARG HA 1 99 PHE H 2.440 . 3.080 2.219 2.122 2.398 . 0 0 "[ . 1 . 2 . ]" 1 2145 1 98 ARG HA 1 99 PHE QD 3.230 . 4.660 3.279 2.976 3.863 . 0 0 "[ . 1 . 2 . ]" 1 2146 1 98 ARG HA 1 99 PHE QE 3.650 . 5.500 4.352 4.057 4.829 . 0 0 "[ . 1 . 2 . ]" 1 2147 1 98 ARG HA 1 111 GLU HA 3.650 . 5.500 4.909 4.563 5.262 . 0 0 "[ . 1 . 2 . ]" 1 2148 1 98 ARG HA 1 112 GLU H 3.275 . 4.750 4.471 4.343 4.678 . 0 0 "[ . 1 . 2 . ]" 1 2149 1 98 ARG HA 1 112 GLU HA 2.830 . 3.860 2.060 1.919 2.190 . 0 0 "[ . 1 . 2 . ]" 1 2150 1 98 ARG HA 1 112 GLU HB2 3.360 . 4.920 3.489 2.925 3.997 . 0 0 "[ . 1 . 2 . ]" 1 2151 1 98 ARG HA 1 112 GLU HB3 3.345 . 4.890 2.548 2.122 3.534 . 0 0 "[ . 1 . 2 . ]" 1 2152 1 98 ARG HA 1 113 MET H 2.810 . 3.820 3.489 3.162 3.672 . 0 0 "[ . 1 . 2 . ]" 1 2153 1 98 ARG HB2 1 98 ARG QD 2.755 . 3.710 2.540 2.138 2.951 . 0 0 "[ . 1 . 2 . ]" 1 2154 1 98 ARG HB2 1 98 ARG HE 3.070 . 4.340 3.103 1.909 4.346 0.006 7 0 "[ . 1 . 2 . ]" 1 2155 1 98 ARG HB2 1 99 PHE H 2.955 . 4.110 3.922 3.803 4.064 . 0 0 "[ . 1 . 2 . ]" 1 2156 1 98 ARG HB2 1 111 GLU QG 3.650 . 5.500 4.311 3.713 4.950 . 0 0 "[ . 1 . 2 . ]" 1 2157 1 98 ARG HB2 1 112 GLU HA 3.325 . 4.850 3.736 3.195 4.149 . 0 0 "[ . 1 . 2 . ]" 1 2158 1 98 ARG HB2 1 112 GLU HB2 3.125 . 4.450 3.415 2.808 3.745 . 0 0 "[ . 1 . 2 . ]" 1 2159 1 98 ARG HB2 1 112 GLU HB3 2.850 . 3.900 2.394 2.015 2.854 . 0 0 "[ . 1 . 2 . ]" 1 2160 1 98 ARG HB2 1 112 GLU HG2 3.370 . 4.940 4.454 3.953 4.982 0.042 1 0 "[ . 1 . 2 . ]" 1 2161 1 98 ARG HB2 1 112 GLU HG3 3.650 . 5.500 5.271 4.920 5.553 0.053 15 0 "[ . 1 . 2 . ]" 1 2162 1 98 ARG HB2 1 113 MET H 3.650 . 5.500 4.824 4.259 5.325 . 0 0 "[ . 1 . 2 . ]" 1 2163 1 98 ARG HB3 1 98 ARG QD 2.680 . 3.560 2.599 2.260 3.208 . 0 0 "[ . 1 . 2 . ]" 1 2164 1 98 ARG HB3 1 98 ARG HE 3.090 . 4.380 3.413 1.922 4.442 0.062 13 0 "[ . 1 . 2 . ]" 1 2165 1 98 ARG HB3 1 99 PHE H 2.945 . 4.090 3.860 3.531 4.032 . 0 0 "[ . 1 . 2 . ]" 1 2166 1 98 ARG HB3 1 111 GLU QG 3.650 . 5.500 5.204 4.771 5.541 0.041 15 0 "[ . 1 . 2 . ]" 1 2167 1 98 ARG HB3 1 112 GLU HA 3.650 . 5.500 4.872 4.556 5.110 . 0 0 "[ . 1 . 2 . ]" 1 2168 1 98 ARG QD 1 98 ARG QG 2.210 . 2.620 2.024 1.975 2.085 . 0 0 "[ . 1 . 2 . ]" 1 2169 1 98 ARG QG 1 99 PHE H 2.680 . 3.560 2.280 1.904 2.573 . 0 0 "[ . 1 . 2 . ]" 1 2170 1 98 ARG QG 1 99 PHE HA 3.650 . 5.500 4.031 3.786 4.223 . 0 0 "[ . 1 . 2 . ]" 1 2171 1 98 ARG QG 1 99 PHE QD 3.650 . 5.500 4.337 3.973 4.666 . 0 0 "[ . 1 . 2 . ]" 1 2172 1 98 ARG QG 1 100 VAL H 3.650 . 5.500 5.035 4.648 5.341 . 0 0 "[ . 1 . 2 . ]" 1 2173 1 98 ARG QG 1 100 VAL QG 3.290 . 4.780 4.120 3.534 4.759 . 0 0 "[ . 1 . 2 . ]" 1 2174 1 98 ARG QG 1 111 GLU HA 3.595 . 5.390 4.379 3.901 4.738 . 0 0 "[ . 1 . 2 . ]" 1 2175 1 98 ARG QG 1 111 GLU QG 3.020 . 4.240 2.450 2.004 2.943 . 0 0 "[ . 1 . 2 . ]" 1 2176 1 98 ARG QG 1 112 GLU H 3.440 . 5.080 4.543 4.105 4.824 . 0 0 "[ . 1 . 2 . ]" 1 2177 1 98 ARG QG 1 112 GLU HA 3.235 . 4.670 3.582 3.123 3.850 . 0 0 "[ . 1 . 2 . ]" 1 2178 1 98 ARG QG 1 112 GLU HB2 3.380 . 4.960 4.168 3.696 4.510 . 0 0 "[ . 1 . 2 . ]" 1 2179 1 98 ARG QG 1 112 GLU HB3 2.815 . 3.830 2.557 2.038 3.198 . 0 0 "[ . 1 . 2 . ]" 1 2180 1 98 ARG QG 1 112 GLU HG2 3.490 . 5.180 3.702 3.147 4.902 . 0 0 "[ . 1 . 2 . ]" 1 2181 1 98 ARG QG 1 112 GLU HG3 3.430 . 5.060 4.932 4.482 5.097 0.037 14 0 "[ . 1 . 2 . ]" 1 2182 1 98 ARG QG 1 113 MET H 3.650 . 5.500 5.295 4.843 5.523 0.023 4 0 "[ . 1 . 2 . ]" 1 2183 1 99 PHE H 1 99 PHE HB2 2.950 . 4.100 2.604 2.513 2.725 . 0 0 "[ . 1 . 2 . ]" 1 2184 1 99 PHE H 1 99 PHE QB 2.680 . 3.560 2.557 2.472 2.669 . 0 0 "[ . 1 . 2 . ]" 1 2185 1 99 PHE H 1 99 PHE HB3 2.950 . 4.100 3.728 3.672 3.817 . 0 0 "[ . 1 . 2 . ]" 1 2186 1 99 PHE H 1 99 PHE QD 2.670 . 3.540 2.733 2.443 3.144 . 0 0 "[ . 1 . 2 . ]" 1 2187 1 99 PHE H 1 99 PHE QE 3.650 . 5.500 4.712 4.526 5.137 . 0 0 "[ . 1 . 2 . ]" 1 2188 1 99 PHE H 1 100 VAL QG 3.430 . 5.060 4.762 4.268 5.119 0.059 16 0 "[ . 1 . 2 . ]" 1 2189 1 99 PHE H 1 107 ILE MD 3.080 . 4.360 3.903 3.365 4.318 . 0 0 "[ . 1 . 2 . ]" 1 2190 1 99 PHE H 1 111 GLU HA 3.050 . 4.300 3.754 3.405 3.988 . 0 0 "[ . 1 . 2 . ]" 1 2191 1 99 PHE H 1 111 GLU HB2 3.285 . 4.770 3.223 2.675 3.860 . 0 0 "[ . 1 . 2 . ]" 1 2192 1 99 PHE H 1 111 GLU QG 3.205 . 4.610 3.947 3.562 4.319 . 0 0 "[ . 1 . 2 . ]" 1 2193 1 99 PHE H 1 112 GLU HA 2.885 . 3.970 3.451 3.040 3.884 . 0 0 "[ . 1 . 2 . ]" 1 2194 1 99 PHE HA 1 99 PHE QD 2.965 . 4.130 2.938 2.600 3.073 . 0 0 "[ . 1 . 2 . ]" 1 2195 1 99 PHE HA 1 99 PHE QE 3.650 . 5.500 4.736 4.615 4.848 . 0 0 "[ . 1 . 2 . ]" 1 2196 1 99 PHE HA 1 100 VAL H 2.440 . 3.080 2.284 2.196 2.367 . 0 0 "[ . 1 . 2 . ]" 1 2197 1 99 PHE HA 1 100 VAL HB 3.650 . 5.500 4.903 4.206 5.549 0.049 18 0 "[ . 1 . 2 . ]" 1 2198 1 99 PHE HA 1 100 VAL MG1 3.650 . 5.500 4.146 3.597 4.746 . 0 0 "[ . 1 . 2 . ]" 1 2199 1 99 PHE HA 1 100 VAL QG 2.940 . 4.080 3.359 3.060 3.685 . 0 0 "[ . 1 . 2 . ]" 1 2200 1 99 PHE HA 1 100 VAL MG2 3.650 . 5.500 4.243 3.108 5.424 . 0 0 "[ . 1 . 2 . ]" 1 2201 1 99 PHE HA 1 107 ILE MD 3.395 . 4.990 4.657 4.376 5.001 0.011 18 0 "[ . 1 . 2 . ]" 1 2202 1 99 PHE QB 1 100 VAL H 2.715 . 3.630 2.470 2.194 2.667 . 0 0 "[ . 1 . 2 . ]" 1 2203 1 99 PHE QB 1 100 VAL HA 3.260 . 4.720 3.923 3.744 4.076 . 0 0 "[ . 1 . 2 . ]" 1 2204 1 99 PHE QB 1 100 VAL QG 3.145 . 4.490 3.989 3.762 4.214 . 0 0 "[ . 1 . 2 . ]" 1 2205 1 99 PHE QB 1 107 ILE MD 2.435 . 3.070 2.247 1.938 2.519 . 0 0 "[ . 1 . 2 . ]" 1 2206 1 99 PHE QB 1 111 GLU HA 3.460 . 5.120 3.261 2.653 3.875 . 0 0 "[ . 1 . 2 . ]" 1 2207 1 99 PHE HB2 1 100 VAL H 2.995 . 4.190 3.592 3.368 3.719 . 0 0 "[ . 1 . 2 . ]" 1 2208 1 99 PHE HB2 1 107 ILE MD 2.685 . 3.570 2.308 1.982 2.586 . 0 0 "[ . 1 . 2 . ]" 1 2209 1 99 PHE HB3 1 100 VAL H 2.995 . 4.190 2.517 2.223 2.735 . 0 0 "[ . 1 . 2 . ]" 1 2210 1 99 PHE HB3 1 107 ILE MD 2.685 . 3.570 3.111 2.707 3.470 . 0 0 "[ . 1 . 2 . ]" 1 2211 1 99 PHE QD 1 100 VAL H 2.890 . 3.980 3.859 3.628 3.996 0.016 14 0 "[ . 1 . 2 . ]" 1 2212 1 99 PHE QD 1 107 ILE MD 2.930 . 4.060 3.214 2.320 3.674 . 0 0 "[ . 1 . 2 . ]" 1 2213 1 99 PHE QD 1 111 GLU HA 3.025 . 4.250 3.280 2.625 3.931 . 0 0 "[ . 1 . 2 . ]" 1 2214 1 99 PHE QD 1 112 GLU H 3.280 . 4.760 4.100 3.599 4.689 . 0 0 "[ . 1 . 2 . ]" 1 2215 1 99 PHE QD 1 113 MET H 3.555 . 5.310 4.257 3.767 4.924 . 0 0 "[ . 1 . 2 . ]" 1 2216 1 99 PHE QD 1 113 MET ME 3.650 . 5.500 4.223 3.801 5.010 . 0 0 "[ . 1 . 2 . ]" 1 2217 1 99 PHE QD 1 126 PRO HB3 3.650 . 5.500 5.131 4.508 5.516 0.016 22 0 "[ . 1 . 2 . ]" 1 2218 1 99 PHE QD 1 126 PRO HD2 3.650 . 5.500 3.832 3.309 4.497 . 0 0 "[ . 1 . 2 . ]" 1 2219 1 99 PHE QD 1 126 PRO QD 3.265 . 4.730 3.530 3.128 4.082 . 0 0 "[ . 1 . 2 . ]" 1 2220 1 99 PHE QD 1 126 PRO HD3 3.650 . 5.500 4.172 3.694 4.683 . 0 0 "[ . 1 . 2 . ]" 1 2221 1 99 PHE QD 1 126 PRO QG 3.090 . 4.380 2.743 2.320 3.259 . 0 0 "[ . 1 . 2 . ]" 1 2222 1 99 PHE QE 1 113 MET H 3.650 . 5.500 3.414 2.796 3.963 . 0 0 "[ . 1 . 2 . ]" 1 2223 1 99 PHE QE 1 113 MET QB 3.570 . 5.340 3.143 2.136 4.077 . 0 0 "[ . 1 . 2 . ]" 1 2224 1 99 PHE QE 1 113 MET ME 2.375 . 2.950 2.269 2.023 3.050 0.100 24 0 "[ . 1 . 2 . ]" 1 2225 1 99 PHE QE 1 113 MET HG2 3.320 . 4.840 2.373 1.927 4.553 . 0 0 "[ . 1 . 2 . ]" 1 2226 1 99 PHE QE 1 113 MET QG 2.970 . 4.140 2.307 1.825 4.014 . 0 0 "[ . 1 . 2 . ]" 1 2227 1 99 PHE QE 1 113 MET HG3 3.320 . 4.840 3.787 2.010 4.467 . 0 0 "[ . 1 . 2 . ]" 1 2228 1 99 PHE QE 1 125 LYS HA 3.305 . 4.810 4.105 3.453 4.725 . 0 0 "[ . 1 . 2 . ]" 1 2229 1 99 PHE QE 1 125 LYS QE 3.120 . 4.440 3.750 2.671 4.481 0.041 22 0 "[ . 1 . 2 . ]" 1 2230 1 99 PHE QE 1 126 PRO HD2 3.365 . 4.930 3.298 2.417 3.975 . 0 0 "[ . 1 . 2 . ]" 1 2231 1 99 PHE QE 1 126 PRO QD 3.040 . 4.280 2.851 2.287 3.189 . 0 0 "[ . 1 . 2 . ]" 1 2232 1 99 PHE QE 1 126 PRO HD3 3.365 . 4.930 3.162 2.734 3.487 . 0 0 "[ . 1 . 2 . ]" 1 2233 1 99 PHE QE 1 126 PRO QG 3.415 . 5.030 3.200 2.657 3.763 . 0 0 "[ . 1 . 2 . ]" 1 2234 1 99 PHE HZ 1 113 MET ME 2.445 . 3.090 2.409 2.103 3.144 0.054 9 0 "[ . 1 . 2 . ]" 1 2235 1 99 PHE HZ 1 113 MET QG 3.570 . 5.340 3.187 2.666 4.674 . 0 0 "[ . 1 . 2 . ]" 1 2236 1 99 PHE HZ 1 125 LYS HA 3.650 . 5.500 3.937 3.405 4.684 . 0 0 "[ . 1 . 2 . ]" 1 2237 1 99 PHE HZ 1 125 LYS QG 3.570 . 5.340 4.143 2.727 5.422 0.082 16 0 "[ . 1 . 2 . ]" 1 2238 1 100 VAL H 1 100 VAL HB 2.820 . 3.840 3.345 3.031 3.674 . 0 0 "[ . 1 . 2 . ]" 1 2239 1 100 VAL H 1 100 VAL MG1 3.030 . 4.260 3.045 2.241 3.764 . 0 0 "[ . 1 . 2 . ]" 1 2240 1 100 VAL H 1 100 VAL QG 2.485 . 3.170 2.269 2.047 2.480 . 0 0 "[ . 1 . 2 . ]" 1 2241 1 100 VAL H 1 100 VAL MG2 3.030 . 4.260 3.053 2.058 3.988 . 0 0 "[ . 1 . 2 . ]" 1 2242 1 100 VAL H 1 101 CYS H 3.225 . 4.650 4.231 4.089 4.334 . 0 0 "[ . 1 . 2 . ]" 1 2243 1 100 VAL H 1 107 ILE MD 3.100 . 4.400 4.416 4.252 4.519 0.119 18 0 "[ . 1 . 2 . ]" 1 2244 1 100 VAL HA 1 100 VAL MG1 2.545 . 3.290 2.675 2.112 3.259 . 0 0 "[ . 1 . 2 . ]" 1 2245 1 100 VAL HA 1 100 VAL QG 2.305 . 2.810 2.207 2.076 2.331 . 0 0 "[ . 1 . 2 . ]" 1 2246 1 100 VAL HA 1 100 VAL MG2 2.545 . 3.290 2.744 2.328 3.184 . 0 0 "[ . 1 . 2 . ]" 1 2247 1 100 VAL HA 1 101 CYS H 2.485 . 3.170 2.137 2.009 2.275 . 0 0 "[ . 1 . 2 . ]" 1 2248 1 100 VAL HA 1 101 CYS HB2 3.270 . 4.740 4.377 4.143 4.534 . 0 0 "[ . 1 . 2 . ]" 1 2249 1 100 VAL HA 1 107 ILE HB 3.485 . 5.170 4.926 4.533 5.205 0.035 15 0 "[ . 1 . 2 . ]" 1 2250 1 100 VAL HA 1 107 ILE MD 3.075 . 4.350 4.138 3.667 4.404 0.054 16 0 "[ . 1 . 2 . ]" 1 2251 1 100 VAL HB 1 101 CYS H 2.870 . 3.940 3.404 2.534 4.020 0.080 21 0 "[ . 1 . 2 . ]" 1 2252 1 100 VAL QG 1 101 CYS H 2.630 . 3.460 2.539 2.119 2.945 . 0 0 "[ . 1 . 2 . ]" 1 2253 1 100 VAL MG1 1 102 ASN H 3.650 . 5.500 5.341 4.525 5.708 0.208 27 0 "[ . 1 . 2 . ]" 1 2254 1 100 VAL MG2 1 102 ASN H 3.650 . 5.500 5.134 4.656 5.516 0.016 2 0 "[ . 1 . 2 . ]" 1 2255 1 101 CYS H 1 101 CYS HB2 2.570 . 3.340 2.405 2.341 2.482 . 0 0 "[ . 1 . 2 . ]" 1 2256 1 101 CYS H 1 101 CYS HB3 2.895 . 3.990 3.603 3.525 3.666 . 0 0 "[ . 1 . 2 . ]" 1 2257 1 101 CYS H 1 102 ASN H 3.220 . 4.640 4.395 4.146 4.572 . 0 0 "[ . 1 . 2 . ]" 1 2258 1 101 CYS H 1 107 ILE H 3.650 . 5.500 5.437 5.027 5.551 0.051 24 0 "[ . 1 . 2 . ]" 1 2259 1 101 CYS H 1 107 ILE MD 3.650 . 5.500 4.587 4.054 5.324 . 0 0 "[ . 1 . 2 . ]" 1 2260 1 101 CYS HA 1 102 ASN H 2.450 . 3.100 2.134 1.979 2.338 . 0 0 "[ . 1 . 2 . ]" 1 2261 1 101 CYS HA 1 105 TYR H 3.650 . 5.500 5.537 5.208 5.606 0.106 16 0 "[ . 1 . 2 . ]" 1 2262 1 101 CYS HB2 1 102 ASN H 3.130 . 4.460 3.978 3.643 4.195 . 0 0 "[ . 1 . 2 . ]" 1 2263 1 101 CYS HB2 1 105 TYR H 3.535 . 5.270 4.268 3.488 5.020 . 0 0 "[ . 1 . 2 . ]" 1 2264 1 101 CYS HB2 1 105 TYR HB2 3.205 . 4.610 3.557 3.209 4.086 . 0 0 "[ . 1 . 2 . ]" 1 2265 1 101 CYS HB2 1 106 LYS H 3.650 . 5.500 4.657 3.864 5.248 . 0 0 "[ . 1 . 2 . ]" 1 2266 1 101 CYS HB2 1 107 ILE H 3.320 . 4.840 4.163 3.585 4.849 0.009 24 0 "[ . 1 . 2 . ]" 1 2267 1 101 CYS HB3 1 102 ASN H 3.185 . 4.570 2.962 2.505 3.388 . 0 0 "[ . 1 . 2 . ]" 1 2268 1 101 CYS HB3 1 105 TYR H 2.740 . 3.680 3.639 2.885 3.798 0.118 18 0 "[ . 1 . 2 . ]" 1 2269 1 101 CYS HB3 1 105 TYR QD 3.255 . 4.710 3.976 3.198 4.283 . 0 0 "[ . 1 . 2 . ]" 1 2270 1 101 CYS HB3 1 106 LYS H 3.330 . 4.860 4.016 3.350 4.637 . 0 0 "[ . 1 . 2 . ]" 1 2271 1 101 CYS HB3 1 107 ILE H 3.650 . 5.500 4.939 4.503 5.445 . 0 0 "[ . 1 . 2 . ]" 1 2272 1 102 ASN H 1 102 ASN HB2 2.720 . 3.640 2.492 2.275 2.627 . 0 0 "[ . 1 . 2 . ]" 1 2273 1 102 ASN H 1 102 ASN QB 2.490 . 3.180 2.450 2.250 2.569 . 0 0 "[ . 1 . 2 . ]" 1 2274 1 102 ASN H 1 102 ASN HB3 2.720 . 3.640 3.618 3.552 3.656 0.016 10 0 "[ . 1 . 2 . ]" 1 2275 1 102 ASN H 1 102 ASN HD21 3.090 . 4.380 3.399 2.365 3.938 . 0 0 "[ . 1 . 2 . ]" 1 2276 1 102 ASN H 1 102 ASN QD 2.805 . 3.810 3.206 2.333 3.667 . 0 0 "[ . 1 . 2 . ]" 1 2277 1 102 ASN H 1 102 ASN HD22 3.090 . 4.380 4.053 3.388 4.374 . 0 0 "[ . 1 . 2 . ]" 1 2278 1 102 ASN H 1 103 SER H 3.170 . 4.540 4.305 2.577 4.568 0.028 27 0 "[ . 1 . 2 . ]" 1 2279 1 102 ASN H 1 105 TYR H 3.390 . 4.980 4.581 4.118 5.053 0.073 25 0 "[ . 1 . 2 . ]" 1 2280 1 102 ASN H 1 105 TYR QD 3.145 . 4.490 3.594 3.033 3.951 . 0 0 "[ . 1 . 2 . ]" 1 2281 1 102 ASN H 1 105 TYR QE 3.650 . 5.500 5.394 4.837 5.555 0.055 16 0 "[ . 1 . 2 . ]" 1 2282 1 102 ASN HA 1 102 ASN HD21 3.405 . 5.010 4.290 3.817 4.490 . 0 0 "[ . 1 . 2 . ]" 1 2283 1 102 ASN HA 1 102 ASN QD 3.095 . 4.390 3.937 3.565 4.123 . 0 0 "[ . 1 . 2 . ]" 1 2284 1 102 ASN HA 1 102 ASN HD22 3.405 . 5.010 4.589 4.276 4.830 . 0 0 "[ . 1 . 2 . ]" 1 2285 1 102 ASN HA 1 103 SER QB 3.135 . 4.470 4.453 4.097 4.695 0.225 26 0 "[ . 1 . 2 . ]" 1 2286 1 102 ASN QB 1 102 ASN QD 2.495 . 3.190 2.125 2.048 2.247 . 0 0 "[ . 1 . 2 . ]" 1 2287 1 102 ASN QB 1 103 SER H 2.535 . 3.270 2.198 1.794 2.525 0.006 22 0 "[ . 1 . 2 . ]" 1 2288 1 102 ASN QB 1 103 SER QB 2.995 . 4.190 3.579 2.949 4.029 . 0 0 "[ . 1 . 2 . ]" 1 2289 1 102 ASN QB 1 105 TYR H 3.570 . 5.340 4.385 3.846 5.394 0.054 24 0 "[ . 1 . 2 . ]" 1 2290 1 102 ASN QB 1 105 TYR QD 2.840 . 3.880 2.580 1.852 3.374 . 0 0 "[ . 1 . 2 . ]" 1 2291 1 102 ASN QB 1 105 TYR QE 3.105 . 4.410 3.547 2.773 4.175 . 0 0 "[ . 1 . 2 . ]" 1 2292 1 102 ASN HB2 1 103 SER H 2.795 . 3.790 3.298 2.266 3.633 . 0 0 "[ . 1 . 2 . ]" 1 2293 1 102 ASN HB2 1 103 SER QB 3.435 . 5.070 4.662 3.356 5.140 0.070 23 0 "[ . 1 . 2 . ]" 1 2294 1 102 ASN HB2 1 105 TYR QD 3.250 . 4.700 2.625 1.862 3.453 . 0 0 "[ . 1 . 2 . ]" 1 2295 1 102 ASN HB2 1 105 TYR QE 3.520 . 5.240 3.688 2.848 4.398 . 0 0 "[ . 1 . 2 . ]" 1 2296 1 102 ASN HB3 1 103 SER H 2.795 . 3.790 2.331 1.805 3.404 . 0 0 "[ . 1 . 2 . ]" 1 2297 1 102 ASN HB3 1 103 SER QB 3.435 . 5.070 3.742 3.252 4.210 . 0 0 "[ . 1 . 2 . ]" 1 2298 1 102 ASN HB3 1 105 TYR QD 3.250 . 4.700 3.856 3.238 4.752 0.052 24 0 "[ . 1 . 2 . ]" 1 2299 1 102 ASN HB3 1 105 TYR QE 3.520 . 5.240 4.617 3.808 5.244 0.004 19 0 "[ . 1 . 2 . ]" 1 2300 1 102 ASN QD 1 103 SER H 3.320 . 4.840 4.762 4.282 4.939 0.099 17 0 "[ . 1 . 2 . ]" 1 2301 1 103 SER H 1 103 SER QB 2.395 . 2.990 2.409 2.188 2.813 . 0 0 "[ . 1 . 2 . ]" 1 2302 1 103 SER H 1 104 GLY H 3.225 . 4.650 3.909 1.948 4.617 . 0 0 "[ . 1 . 2 . ]" 1 2303 1 103 SER H 1 105 TYR QD 3.240 . 4.680 4.150 1.983 4.707 0.027 3 0 "[ . 1 . 2 . ]" 1 2304 1 103 SER HA 1 103 SER QB 2.315 . 2.830 2.336 2.123 2.450 . 0 0 "[ . 1 . 2 . ]" 1 2305 1 103 SER HA 1 104 GLY H 2.575 . 3.350 2.678 2.076 3.474 0.124 13 0 "[ . 1 . 2 . ]" 1 2306 1 103 SER HA 1 104 GLY QA 3.210 . 4.620 3.997 3.831 4.244 . 0 0 "[ . 1 . 2 . ]" 1 2307 1 103 SER HA 1 105 TYR H 3.010 . 4.220 3.948 3.497 4.447 0.227 6 0 "[ . 1 . 2 . ]" 1 2308 1 103 SER QB 1 104 GLY H 3.015 . 4.230 3.205 1.957 3.935 . 0 0 "[ . 1 . 2 . ]" 1 2309 1 103 SER QB 1 105 TYR QD 3.650 . 5.500 4.663 2.052 5.541 0.041 22 0 "[ . 1 . 2 . ]" 1 2310 1 104 GLY H 1 105 TYR H 2.590 . 3.380 2.552 2.264 3.406 0.026 25 0 "[ . 1 . 2 . ]" 1 2311 1 104 GLY H 1 105 TYR QD 3.650 . 5.500 3.982 2.859 4.822 . 0 0 "[ . 1 . 2 . ]" 1 2312 1 104 GLY QA 1 105 TYR H 2.435 . 3.070 2.899 2.532 3.001 . 0 0 "[ . 1 . 2 . ]" 1 2313 1 104 GLY QA 1 105 TYR QD 3.275 . 4.750 4.062 3.740 4.548 . 0 0 "[ . 1 . 2 . ]" 1 2314 1 104 GLY QA 1 105 TYR QE 3.570 . 5.340 4.710 4.322 5.424 0.084 11 0 "[ . 1 . 2 . ]" 1 2315 1 104 GLY HA2 1 105 TYR H 2.650 . 3.500 3.233 2.603 3.484 . 0 0 "[ . 1 . 2 . ]" 1 2316 1 104 GLY HA2 1 105 TYR QD 3.650 . 5.500 5.081 4.821 5.404 . 0 0 "[ . 1 . 2 . ]" 1 2317 1 104 GLY HA3 1 105 TYR H 2.650 . 3.500 3.355 3.072 3.521 0.021 9 0 "[ . 1 . 2 . ]" 1 2318 1 104 GLY HA3 1 105 TYR QD 3.650 . 5.500 4.304 3.887 5.148 . 0 0 "[ . 1 . 2 . ]" 1 2319 1 105 TYR H 1 105 TYR HB2 2.545 . 3.290 2.478 2.352 2.662 . 0 0 "[ . 1 . 2 . ]" 1 2320 1 105 TYR H 1 105 TYR HB3 2.810 . 3.820 3.662 3.583 3.793 . 0 0 "[ . 1 . 2 . ]" 1 2321 1 105 TYR H 1 105 TYR QD 2.430 . 3.060 2.881 2.529 3.093 0.033 13 0 "[ . 1 . 2 . ]" 1 2322 1 105 TYR H 1 105 TYR QE 3.510 . 5.220 4.838 4.511 5.108 . 0 0 "[ . 1 . 2 . ]" 1 2323 1 105 TYR H 1 106 LYS H 3.170 . 4.540 4.445 4.345 4.565 0.025 6 0 "[ . 1 . 2 . ]" 1 2324 1 105 TYR HA 1 105 TYR QD 2.965 . 4.130 2.732 2.371 2.875 . 0 0 "[ . 1 . 2 . ]" 1 2325 1 105 TYR HA 1 106 LYS H 2.360 . 2.920 2.328 2.206 2.587 . 0 0 "[ . 1 . 2 . ]" 1 2326 1 105 TYR HA 1 106 LYS QB 3.210 . 4.620 4.168 4.025 4.334 . 0 0 "[ . 1 . 2 . ]" 1 2327 1 105 TYR HB2 1 106 LYS H 2.810 . 3.820 3.693 3.343 3.836 0.016 9 0 "[ . 1 . 2 . ]" 1 2328 1 105 TYR HB2 1 128 CYS QB 3.265 . 4.730 2.788 2.205 4.739 0.009 17 0 "[ . 1 . 2 . ]" 1 2329 1 105 TYR HB2 1 129 VAL H 3.650 . 5.500 5.006 4.530 5.379 . 0 0 "[ . 1 . 2 . ]" 1 2330 1 105 TYR HB3 1 106 LYS H 2.700 . 3.600 2.442 2.015 2.668 . 0 0 "[ . 1 . 2 . ]" 1 2331 1 105 TYR HB3 1 129 VAL H 3.040 . 4.280 3.331 2.895 3.661 . 0 0 "[ . 1 . 2 . ]" 1 2332 1 105 TYR QD 1 106 LYS H 2.740 . 3.680 3.422 3.263 3.525 . 0 0 "[ . 1 . 2 . ]" 1 2333 1 105 TYR QD 1 128 CYS HB2 3.650 . 5.500 4.515 4.067 5.553 0.053 17 0 "[ . 1 . 2 . ]" 1 2334 1 105 TYR QD 1 128 CYS QB 3.270 . 4.740 3.559 3.171 4.335 . 0 0 "[ . 1 . 2 . ]" 1 2335 1 105 TYR QD 1 128 CYS HB3 3.650 . 5.500 3.728 3.298 4.524 . 0 0 "[ . 1 . 2 . ]" 1 2336 1 105 TYR QD 1 129 VAL H 3.110 . 4.420 3.791 3.305 4.379 . 0 0 "[ . 1 . 2 . ]" 1 2337 1 105 TYR QD 1 129 VAL HA 2.840 . 3.880 2.738 2.076 3.641 . 0 0 "[ . 1 . 2 . ]" 1 2338 1 105 TYR QD 1 129 VAL MG1 3.585 . 5.370 4.565 4.025 5.234 . 0 0 "[ . 1 . 2 . ]" 1 2339 1 105 TYR QD 1 129 VAL MG2 3.650 . 5.500 4.600 4.390 4.993 . 0 0 "[ . 1 . 2 . ]" 1 2340 1 105 TYR QE 1 106 LYS H 3.650 . 5.500 5.597 5.506 5.662 0.162 25 0 "[ . 1 . 2 . ]" 1 2341 1 105 TYR QE 1 129 VAL HA 3.220 . 4.640 3.735 3.026 4.638 . 0 0 "[ . 1 . 2 . ]" 1 2342 1 106 LYS H 1 106 LYS QB 2.605 . 3.410 2.989 2.812 3.236 . 0 0 "[ . 1 . 2 . ]" 1 2343 1 106 LYS H 1 106 LYS QD 3.315 . 4.830 4.109 2.763 4.609 . 0 0 "[ . 1 . 2 . ]" 1 2344 1 106 LYS H 1 106 LYS QE 3.650 . 5.500 4.797 4.314 5.437 . 0 0 "[ . 1 . 2 . ]" 1 2345 1 106 LYS H 1 106 LYS HG2 2.985 . 4.170 2.860 2.280 4.169 . 0 0 "[ . 1 . 2 . ]" 1 2346 1 106 LYS H 1 106 LYS QG 2.635 . 3.470 2.457 2.228 2.839 . 0 0 "[ . 1 . 2 . ]" 1 2347 1 106 LYS H 1 106 LYS HG3 2.985 . 4.170 3.059 2.305 3.599 . 0 0 "[ . 1 . 2 . ]" 1 2348 1 106 LYS H 1 107 ILE H 3.050 . 4.300 4.349 4.276 4.395 0.095 4 0 "[ . 1 . 2 . ]" 1 2349 1 106 LYS H 1 128 CYS HA 2.810 . 3.820 3.859 3.735 3.965 0.145 3 0 "[ . 1 . 2 . ]" 1 2350 1 106 LYS H 1 128 CYS QB 3.570 . 5.340 3.872 3.401 4.954 . 0 0 "[ . 1 . 2 . ]" 1 2351 1 106 LYS H 1 129 VAL H 2.495 . 3.190 2.790 2.607 3.000 . 0 0 "[ . 1 . 2 . ]" 1 2352 1 106 LYS H 1 129 VAL HB 3.650 . 5.500 5.281 4.950 5.519 0.019 18 0 "[ . 1 . 2 . ]" 1 2353 1 106 LYS H 1 129 VAL MG2 2.895 . 3.990 3.684 3.241 4.035 0.045 12 0 "[ . 1 . 2 . ]" 1 2354 1 106 LYS HA 1 106 LYS QB 2.370 . 2.940 2.193 2.169 2.214 . 0 0 "[ . 1 . 2 . ]" 1 2355 1 106 LYS HA 1 106 LYS QG 2.685 . 3.570 3.381 3.295 3.576 0.006 26 0 "[ . 1 . 2 . ]" 1 2356 1 106 LYS HA 1 107 ILE H 2.630 . 3.460 2.301 2.193 2.474 . 0 0 "[ . 1 . 2 . ]" 1 2357 1 106 LYS QB 1 107 ILE H 2.520 . 3.240 2.698 2.305 2.937 . 0 0 "[ . 1 . 2 . ]" 1 2358 1 106 LYS QB 1 129 VAL H 3.610 . 5.420 4.687 4.488 4.899 . 0 0 "[ . 1 . 2 . ]" 1 2359 1 106 LYS QD 1 106 LYS QE 2.195 . 2.590 2.046 1.964 2.102 . 0 0 "[ . 1 . 2 . ]" 1 2360 1 106 LYS QD 1 107 ILE H 3.300 . 4.800 4.287 3.004 4.853 0.053 22 0 "[ . 1 . 2 . ]" 1 2361 1 106 LYS QE 1 106 LYS HG2 2.690 . 3.580 2.794 2.359 3.318 . 0 0 "[ . 1 . 2 . ]" 1 2362 1 106 LYS QE 1 106 LYS QG 2.465 . 3.130 2.279 2.074 2.825 . 0 0 "[ . 1 . 2 . ]" 1 2363 1 106 LYS QE 1 106 LYS HG3 2.690 . 3.580 2.524 2.241 3.541 . 0 0 "[ . 1 . 2 . ]" 1 2364 1 106 LYS QE 1 107 ILE H 3.650 . 5.500 4.749 3.162 5.530 0.030 4 0 "[ . 1 . 2 . ]" 1 2365 1 106 LYS QE 1 107 ILE MG 3.480 . 5.160 4.691 3.014 5.249 0.089 4 0 "[ . 1 . 2 . ]" 1 2366 1 106 LYS QE 1 129 VAL H 3.510 . 5.220 4.737 3.804 5.252 0.032 27 0 "[ . 1 . 2 . ]" 1 2367 1 106 LYS QE 1 129 VAL MG2 2.730 . 3.660 2.804 1.937 3.706 0.046 14 0 "[ . 1 . 2 . ]" 1 2368 1 106 LYS QG 1 129 VAL H 3.045 . 4.290 3.290 2.792 4.251 . 0 0 "[ . 1 . 2 . ]" 1 2369 1 106 LYS QG 1 129 VAL HB 3.570 . 5.340 4.557 4.159 5.345 0.005 26 0 "[ . 1 . 2 . ]" 1 2370 1 106 LYS QG 1 129 VAL MG2 2.910 . 4.020 2.543 2.008 3.704 . 0 0 "[ . 1 . 2 . ]" 1 2371 1 107 ILE H 1 107 ILE HB 2.290 . 2.780 2.499 2.374 2.646 . 0 0 "[ . 1 . 2 . ]" 1 2372 1 107 ILE H 1 107 ILE MD 2.955 . 4.110 4.142 3.941 4.283 0.173 22 0 "[ . 1 . 2 . ]" 1 2373 1 107 ILE H 1 107 ILE HG12 3.370 . 4.940 4.653 4.472 4.810 . 0 0 "[ . 1 . 2 . ]" 1 2374 1 107 ILE H 1 107 ILE QG 2.945 . 4.090 4.004 3.907 4.120 0.030 4 0 "[ . 1 . 2 . ]" 1 2375 1 107 ILE H 1 107 ILE HG13 3.370 . 4.940 4.368 4.270 4.481 . 0 0 "[ . 1 . 2 . ]" 1 2376 1 107 ILE H 1 107 ILE MG 2.255 . 2.710 2.302 2.083 2.445 . 0 0 "[ . 1 . 2 . ]" 1 2377 1 107 ILE H 1 108 GLU H 3.330 . 4.860 4.481 4.364 4.567 . 0 0 "[ . 1 . 2 . ]" 1 2378 1 107 ILE H 1 129 VAL H 3.505 . 5.210 4.907 4.681 5.092 . 0 0 "[ . 1 . 2 . ]" 1 2379 1 107 ILE HA 1 129 VAL MG2 3.215 . 4.630 4.008 3.593 4.514 . 0 0 "[ . 1 . 2 . ]" 1 2380 1 107 ILE HB 1 107 ILE MD 2.320 . 2.840 2.205 2.092 2.328 . 0 0 "[ . 1 . 2 . ]" 1 2381 1 107 ILE HB 1 108 GLU H 3.000 . 4.200 4.065 3.957 4.201 0.001 27 0 "[ . 1 . 2 . ]" 1 2382 1 107 ILE MD 1 108 GLU H 2.835 . 3.870 3.548 2.842 3.997 0.127 28 0 "[ . 1 . 2 . ]" 1 2383 1 107 ILE MD 1 110 ASP H 3.410 . 5.020 4.868 4.204 5.089 0.069 18 0 "[ . 1 . 2 . ]" 1 2384 1 107 ILE MD 1 111 GLU H 3.130 . 4.460 4.386 3.858 4.569 0.109 3 0 "[ . 1 . 2 . ]" 1 2385 1 107 ILE MD 1 111 GLU HA 2.315 . 2.830 2.074 1.809 2.366 . 0 0 "[ . 1 . 2 . ]" 1 2386 1 107 ILE MD 1 111 GLU HB2 2.950 . 4.100 3.073 2.551 3.680 . 0 0 "[ . 1 . 2 . ]" 1 2387 1 107 ILE MD 1 111 GLU HB3 2.880 . 3.960 3.134 2.286 3.863 . 0 0 "[ . 1 . 2 . ]" 1 2388 1 107 ILE MD 1 112 GLU H 3.335 . 4.870 4.705 4.283 4.961 0.091 15 0 "[ . 1 . 2 . ]" 1 2389 1 107 ILE MD 1 126 PRO HB2 2.770 . 3.740 2.228 1.964 2.782 . 0 0 "[ . 1 . 2 . ]" 1 2390 1 107 ILE MD 1 126 PRO HB3 2.590 . 3.380 3.278 2.766 3.435 0.055 12 0 "[ . 1 . 2 . ]" 1 2391 1 107 ILE MD 1 126 PRO QG 2.555 . 3.310 2.163 1.880 2.711 . 0 0 "[ . 1 . 2 . ]" 1 2392 1 107 ILE MD 1 127 LYS H 3.175 . 4.550 3.919 3.059 4.562 0.012 1 0 "[ . 1 . 2 . ]" 1 2393 1 107 ILE MD 1 128 CYS H 3.650 . 5.500 5.033 4.239 5.561 0.061 19 0 "[ . 1 . 2 . ]" 1 2394 1 107 ILE QG 1 107 ILE MG 2.215 . 2.630 2.096 2.017 2.146 . 0 0 "[ . 1 . 2 . ]" 1 2395 1 107 ILE QG 1 110 ASP H 3.075 . 4.350 4.114 3.265 4.408 0.058 12 0 "[ . 1 . 2 . ]" 1 2396 1 107 ILE QG 1 126 PRO HB3 2.800 . 3.800 3.092 2.612 3.559 . 0 0 "[ . 1 . 2 . ]" 1 2397 1 107 ILE HG12 1 107 ILE MG 2.425 . 3.050 2.161 2.104 2.220 . 0 0 "[ . 1 . 2 . ]" 1 2398 1 107 ILE HG12 1 108 GLU H 2.725 . 3.650 3.301 2.639 3.738 0.088 23 0 "[ . 1 . 2 . ]" 1 2399 1 107 ILE HG12 1 109 GLY H 3.320 . 4.840 3.399 2.581 4.420 . 0 0 "[ . 1 . 2 . ]" 1 2400 1 107 ILE HG12 1 127 LYS H 3.310 . 4.820 4.421 3.848 4.883 0.063 8 0 "[ . 1 . 2 . ]" 1 2401 1 107 ILE HG13 1 107 ILE MG 2.425 . 3.050 2.886 2.496 3.123 0.073 16 0 "[ . 1 . 2 . ]" 1 2402 1 107 ILE HG13 1 108 GLU H 2.725 . 3.650 2.190 1.958 2.492 . 0 0 "[ . 1 . 2 . ]" 1 2403 1 107 ILE HG13 1 109 GLY H 3.320 . 4.840 3.290 2.520 4.540 . 0 0 "[ . 1 . 2 . ]" 1 2404 1 107 ILE HG13 1 127 LYS H 3.310 . 4.820 3.399 3.173 3.770 . 0 0 "[ . 1 . 2 . ]" 1 2405 1 107 ILE MG 1 108 GLU H 2.780 . 3.760 3.491 3.302 3.661 . 0 0 "[ . 1 . 2 . ]" 1 2406 1 107 ILE MG 1 109 GLY H 3.050 . 4.300 3.785 2.942 4.237 . 0 0 "[ . 1 . 2 . ]" 1 2407 1 107 ILE MG 1 110 ASP H 3.280 . 4.760 4.609 3.996 4.848 0.088 4 0 "[ . 1 . 2 . ]" 1 2408 1 107 ILE MG 1 111 GLU H 2.800 . 3.800 3.717 2.963 3.890 0.090 16 0 "[ . 1 . 2 . ]" 1 2409 1 107 ILE MG 1 111 GLU HA 2.855 . 3.910 3.065 2.052 3.902 . 0 0 "[ . 1 . 2 . ]" 1 2410 1 107 ILE MG 1 111 GLU HB2 3.045 . 4.290 3.537 2.569 4.216 . 0 0 "[ . 1 . 2 . ]" 1 2411 1 107 ILE MG 1 111 GLU HB3 2.865 . 3.930 2.326 1.966 2.796 . 0 0 "[ . 1 . 2 . ]" 1 2412 1 107 ILE MG 1 112 GLU H 3.650 . 5.500 5.198 4.720 5.547 0.047 18 0 "[ . 1 . 2 . ]" 1 2413 1 107 ILE MG 1 127 LYS H 3.550 . 5.300 5.322 5.235 5.375 0.075 18 0 "[ . 1 . 2 . ]" 1 2414 1 108 GLU H 1 108 GLU HB2 2.600 . 3.400 2.620 2.328 2.837 . 0 0 "[ . 1 . 2 . ]" 1 2415 1 108 GLU H 1 108 GLU HB3 2.695 . 3.590 2.468 2.321 2.632 . 0 0 "[ . 1 . 2 . ]" 1 2416 1 108 GLU H 1 108 GLU HG2 3.255 . 4.710 4.502 4.310 4.694 . 0 0 "[ . 1 . 2 . ]" 1 2417 1 108 GLU H 1 108 GLU HG3 3.255 . 4.710 4.489 4.350 4.652 . 0 0 "[ . 1 . 2 . ]" 1 2418 1 108 GLU H 1 109 GLY H 2.940 . 4.080 2.763 2.324 3.199 . 0 0 "[ . 1 . 2 . ]" 1 2419 1 108 GLU H 1 126 PRO HB2 2.920 . 4.040 3.481 2.849 3.859 . 0 0 "[ . 1 . 2 . ]" 1 2420 1 108 GLU H 1 126 PRO QG 3.575 . 5.350 5.080 4.352 5.404 0.054 17 0 "[ . 1 . 2 . ]" 1 2421 1 108 GLU H 1 127 LYS H 2.760 . 3.720 2.828 2.380 3.196 . 0 0 "[ . 1 . 2 . ]" 1 2422 1 108 GLU H 1 127 LYS QB 3.570 . 5.340 3.957 3.432 5.013 . 0 0 "[ . 1 . 2 . ]" 1 2423 1 108 GLU H 1 128 CYS HA 2.910 . 4.020 3.353 3.010 3.624 . 0 0 "[ . 1 . 2 . ]" 1 2424 1 108 GLU H 1 129 VAL H 3.115 . 4.430 4.090 3.657 4.429 . 0 0 "[ . 1 . 2 . ]" 1 2425 1 108 GLU H 1 129 VAL MG1 3.305 . 4.810 4.456 3.903 4.823 0.013 4 0 "[ . 1 . 2 . ]" 1 2426 1 108 GLU H 1 129 VAL MG2 2.980 . 4.160 3.546 3.055 4.107 . 0 0 "[ . 1 . 2 . ]" 1 2427 1 108 GLU HA 1 108 GLU HG2 2.785 . 3.770 3.366 2.645 3.824 0.054 3 0 "[ . 1 . 2 . ]" 1 2428 1 108 GLU HA 1 108 GLU QG 2.535 . 3.270 2.722 2.447 3.093 . 0 0 "[ . 1 . 2 . ]" 1 2429 1 108 GLU HA 1 108 GLU HG3 2.785 . 3.770 2.909 2.560 3.778 0.008 23 0 "[ . 1 . 2 . ]" 1 2430 1 108 GLU HA 1 109 GLY HA2 3.260 . 4.720 4.565 4.483 4.653 . 0 0 "[ . 1 . 2 . ]" 1 2431 1 108 GLU HA 1 129 VAL MG2 2.675 . 3.550 2.870 2.076 3.433 . 0 0 "[ . 1 . 2 . ]" 1 2432 1 108 GLU HB2 1 109 GLY H 2.715 . 3.630 3.645 3.511 3.700 0.070 14 0 "[ . 1 . 2 . ]" 1 2433 1 108 GLU HB2 1 127 LYS QG 2.930 . 4.060 3.477 1.999 4.080 0.020 11 0 "[ . 1 . 2 . ]" 1 2434 1 108 GLU HB2 1 129 VAL MG1 2.620 . 3.440 2.975 2.159 3.505 0.065 7 0 "[ . 1 . 2 . ]" 1 2435 1 108 GLU HB2 1 129 VAL MG2 2.400 . 3.000 2.547 1.854 3.064 0.064 25 0 "[ . 1 . 2 . ]" 1 2436 1 108 GLU HB3 1 109 GLY H 2.805 . 3.810 2.222 2.016 2.402 . 0 0 "[ . 1 . 2 . ]" 1 2437 1 108 GLU HB3 1 127 LYS QG 2.880 . 3.960 3.700 3.009 4.073 0.113 5 0 "[ . 1 . 2 . ]" 1 2438 1 108 GLU QG 1 109 GLY H 2.745 . 3.690 3.162 2.628 3.738 0.048 23 0 "[ . 1 . 2 . ]" 1 2439 1 108 GLU QG 1 129 VAL MG1 2.895 . 3.990 3.687 2.911 4.056 0.066 26 0 "[ . 1 . 2 . ]" 1 2440 1 108 GLU QG 1 129 VAL MG2 2.705 . 3.610 3.369 2.782 3.701 0.091 3 0 "[ . 1 . 2 . ]" 1 2441 1 108 GLU HG2 1 109 GLY H 3.130 . 4.460 3.629 2.663 4.501 0.041 20 0 "[ . 1 . 2 . ]" 1 2442 1 108 GLU HG2 1 109 GLY HA2 3.650 . 5.500 4.475 3.345 5.544 0.044 20 0 "[ . 1 . 2 . ]" 1 2443 1 108 GLU HG3 1 109 GLY H 3.130 . 4.460 3.927 2.805 4.495 0.035 13 0 "[ . 1 . 2 . ]" 1 2444 1 108 GLU HG3 1 109 GLY HA2 3.650 . 5.500 4.614 3.504 5.565 0.065 23 0 "[ . 1 . 2 . ]" 1 2445 1 109 GLY H 1 126 PRO HB2 3.340 . 4.880 3.186 2.559 3.922 . 0 0 "[ . 1 . 2 . ]" 1 2446 1 109 GLY H 1 127 LYS H 3.155 . 4.510 3.045 2.319 4.113 . 0 0 "[ . 1 . 2 . ]" 1 2447 1 109 GLY HA2 1 110 ASP H 2.655 . 3.510 3.255 2.833 3.512 0.002 7 0 "[ . 1 . 2 . ]" 1 2448 1 109 GLY HA2 1 126 PRO HB3 3.620 . 5.440 4.789 3.665 5.512 0.072 18 0 "[ . 1 . 2 . ]" 1 2449 1 109 GLY HA3 1 110 ASP H 2.355 . 2.910 2.195 2.111 2.411 . 0 0 "[ . 1 . 2 . ]" 1 2450 1 110 ASP H 1 110 ASP QB 2.305 . 2.810 2.419 2.278 2.693 . 0 0 "[ . 1 . 2 . ]" 1 2451 1 110 ASP H 1 112 GLU H 3.610 . 5.420 4.914 4.624 5.377 . 0 0 "[ . 1 . 2 . ]" 1 2452 1 110 ASP H 1 123 LYS QD 3.250 . 4.700 3.788 2.970 4.567 . 0 0 "[ . 1 . 2 . ]" 1 2453 1 110 ASP H 1 126 PRO HB2 3.390 . 4.980 4.507 3.686 5.015 0.035 29 0 "[ . 1 . 2 . ]" 1 2454 1 110 ASP H 1 126 PRO HB3 2.755 . 3.710 3.105 2.279 3.695 . 0 0 "[ . 1 . 2 . ]" 1 2455 1 110 ASP H 1 126 PRO QG 3.575 . 5.350 3.986 2.924 4.959 . 0 0 "[ . 1 . 2 . ]" 1 2456 1 110 ASP HA 1 111 GLU QG 3.235 . 4.670 4.188 3.701 4.757 0.087 28 0 "[ . 1 . 2 . ]" 1 2457 1 110 ASP QB 1 111 GLU H 2.625 . 3.450 2.789 2.296 3.375 . 0 0 "[ . 1 . 2 . ]" 1 2458 1 110 ASP QB 1 112 GLU H 2.540 . 3.280 2.603 2.078 3.309 0.029 28 0 "[ . 1 . 2 . ]" 1 2459 1 110 ASP QB 1 112 GLU HG2 3.570 . 5.340 4.438 3.454 5.353 0.013 8 0 "[ . 1 . 2 . ]" 1 2460 1 110 ASP QB 1 112 GLU HG3 3.465 . 5.130 3.821 2.908 4.887 . 0 0 "[ . 1 . 2 . ]" 1 2461 1 110 ASP QB 1 123 LYS QB 3.105 . 4.410 3.478 3.019 4.532 0.122 28 0 "[ . 1 . 2 . ]" 1 2462 1 110 ASP QB 1 123 LYS QD 2.935 . 4.070 2.667 1.926 3.645 . 0 0 "[ . 1 . 2 . ]" 1 2463 1 110 ASP QB 1 123 LYS QG 3.030 . 4.260 2.579 1.792 3.987 0.008 29 0 "[ . 1 . 2 . ]" 1 2464 1 110 ASP QB 1 126 PRO HB3 3.570 . 5.340 4.499 3.875 5.141 . 0 0 "[ . 1 . 2 . ]" 1 2465 1 111 GLU H 1 111 GLU HB2 2.785 . 3.770 3.711 3.632 3.777 0.007 25 0 "[ . 1 . 2 . ]" 1 2466 1 111 GLU H 1 111 GLU HB3 2.460 . 3.120 2.881 2.702 3.090 . 0 0 "[ . 1 . 2 . ]" 1 2467 1 111 GLU H 1 111 GLU QG 2.350 . 2.900 2.173 1.916 2.595 . 0 0 "[ . 1 . 2 . ]" 1 2468 1 111 GLU H 1 112 GLU HA 3.460 . 5.120 4.852 4.568 5.054 . 0 0 "[ . 1 . 2 . ]" 1 2469 1 111 GLU H 1 112 GLU HB3 3.585 . 5.370 4.879 4.605 5.117 . 0 0 "[ . 1 . 2 . ]" 1 2470 1 111 GLU H 1 112 GLU HG2 3.105 . 4.410 3.405 2.918 4.510 0.100 1 0 "[ . 1 . 2 . ]" 1 2471 1 111 GLU H 1 112 GLU HG3 2.815 . 3.830 3.889 3.639 3.951 0.121 8 0 "[ . 1 . 2 . ]" 1 2472 1 111 GLU HA 1 111 GLU QG 2.615 . 3.430 3.354 3.311 3.442 0.012 8 0 "[ . 1 . 2 . ]" 1 2473 1 111 GLU HA 1 126 PRO QG 3.215 . 4.630 3.348 2.562 4.433 . 0 0 "[ . 1 . 2 . ]" 1 2474 1 111 GLU HB2 1 112 GLU H 3.235 . 4.670 4.335 4.121 4.458 . 0 0 "[ . 1 . 2 . ]" 1 2475 1 111 GLU HB3 1 112 GLU H 3.130 . 4.460 4.370 4.101 4.491 0.031 28 0 "[ . 1 . 2 . ]" 1 2476 1 111 GLU QG 1 112 GLU H 2.585 . 3.370 3.143 2.530 3.377 0.007 27 0 "[ . 1 . 2 . ]" 1 2477 1 111 GLU QG 1 112 GLU HB2 3.250 . 4.700 4.403 4.022 4.690 . 0 0 "[ . 1 . 2 . ]" 1 2478 1 111 GLU QG 1 112 GLU HB3 2.680 . 3.560 3.058 2.681 3.548 . 0 0 "[ . 1 . 2 . ]" 1 2479 1 112 GLU H 1 112 GLU HB2 2.910 . 4.020 3.838 3.739 3.978 . 0 0 "[ . 1 . 2 . ]" 1 2480 1 112 GLU H 1 112 GLU HB3 2.820 . 3.840 3.520 3.192 3.683 . 0 0 "[ . 1 . 2 . ]" 1 2481 1 112 GLU H 1 112 GLU HG2 3.225 . 4.650 2.818 2.520 3.454 . 0 0 "[ . 1 . 2 . ]" 1 2482 1 112 GLU H 1 112 GLU HG3 2.935 . 4.070 2.690 1.991 3.255 . 0 0 "[ . 1 . 2 . ]" 1 2483 1 112 GLU H 1 113 MET H 3.235 . 4.670 4.227 3.760 4.453 . 0 0 "[ . 1 . 2 . ]" 1 2484 1 112 GLU HA 1 113 MET H 2.355 . 2.910 2.130 1.924 2.355 . 0 0 "[ . 1 . 2 . ]" 1 2485 1 112 GLU HB2 1 113 MET H 2.730 . 3.660 2.852 2.220 3.367 . 0 0 "[ . 1 . 2 . ]" 1 2486 1 112 GLU HB3 1 113 MET H 2.835 . 3.870 3.737 3.461 3.918 0.048 16 0 "[ . 1 . 2 . ]" 1 2487 1 113 MET H 1 113 MET QB 2.690 . 3.580 2.978 2.263 3.174 . 0 0 "[ . 1 . 2 . ]" 1 2488 1 113 MET H 1 113 MET ME 3.215 . 4.630 4.268 3.939 4.702 0.072 18 0 "[ . 1 . 2 . ]" 1 2489 1 113 MET H 1 113 MET HG2 3.165 . 4.530 2.497 2.081 4.118 . 0 0 "[ . 1 . 2 . ]" 1 2490 1 113 MET H 1 113 MET QG 2.810 . 3.820 2.307 1.943 3.848 0.028 1 0 "[ . 1 . 2 . ]" 1 2491 1 113 MET H 1 113 MET HG3 3.165 . 4.530 2.999 1.965 4.619 0.089 1 0 "[ . 1 . 2 . ]" 1 2492 1 113 MET H 1 114 HIS H 3.225 . 4.650 4.309 3.966 4.557 . 0 0 "[ . 1 . 2 . ]" 1 2493 1 113 MET HA 1 113 MET ME 3.365 . 4.930 4.081 3.988 4.202 . 0 0 "[ . 1 . 2 . ]" 1 2494 1 113 MET HA 1 123 LYS H 2.850 . 3.900 3.513 2.801 3.941 0.041 6 0 "[ . 1 . 2 . ]" 1 2495 1 113 MET QB 1 114 HIS H 2.720 . 3.640 3.024 2.586 3.739 0.099 7 0 "[ . 1 . 2 . ]" 1 2496 1 113 MET QB 1 121 TRP HE3 3.195 . 4.590 2.929 2.285 4.094 . 0 0 "[ . 1 . 2 . ]" 1 2497 1 113 MET QB 1 123 LYS QB 3.085 . 4.370 2.140 1.825 2.756 . 0 0 "[ . 1 . 2 . ]" 1 2498 1 113 MET HB2 1 113 MET ME 2.630 . 3.460 2.707 2.018 3.168 . 0 0 "[ . 1 . 2 . ]" 1 2499 1 113 MET HB2 1 114 HIS H 3.005 . 4.210 3.174 2.628 4.217 0.007 1 0 "[ . 1 . 2 . ]" 1 2500 1 113 MET HB2 1 121 TRP HE3 3.505 . 5.210 3.031 2.318 5.148 . 0 0 "[ . 1 . 2 . ]" 1 2501 1 113 MET HB2 1 123 LYS H 2.950 . 4.100 2.980 2.581 4.121 0.021 18 0 "[ . 1 . 2 . ]" 1 2502 1 113 MET HB3 1 113 MET ME 2.630 . 3.460 2.105 1.958 2.836 . 0 0 "[ . 1 . 2 . ]" 1 2503 1 113 MET HB3 1 114 HIS H 3.005 . 4.210 3.970 3.394 4.233 0.023 17 0 "[ . 1 . 2 . ]" 1 2504 1 113 MET HB3 1 121 TRP HE3 3.505 . 5.210 4.460 3.429 5.086 . 0 0 "[ . 1 . 2 . ]" 1 2505 1 113 MET HB3 1 123 LYS H 2.950 . 4.100 3.540 2.505 4.491 0.391 7 0 "[ . 1 . 2 . ]" 1 2506 1 113 MET ME 1 113 MET HG2 2.635 . 3.470 2.649 2.249 3.403 . 0 0 "[ . 1 . 2 . ]" 1 2507 1 113 MET ME 1 113 MET HG3 2.635 . 3.470 3.307 2.509 3.434 . 0 0 "[ . 1 . 2 . ]" 1 2508 1 113 MET ME 1 114 HIS H 3.515 . 5.230 5.233 4.899 5.324 0.094 20 0 "[ . 1 . 2 . ]" 1 2509 1 113 MET ME 1 121 TRP QB 2.520 . 3.240 2.946 2.208 3.254 0.014 7 0 "[ . 1 . 2 . ]" 1 2510 1 113 MET ME 1 121 TRP HD1 3.170 . 4.540 4.227 2.892 4.567 0.027 7 0 "[ . 1 . 2 . ]" 1 2511 1 113 MET ME 1 121 TRP HE1 3.595 . 5.390 5.164 3.999 5.438 0.048 4 0 "[ . 1 . 2 . ]" 1 2512 1 113 MET ME 1 122 SER H 3.650 . 5.500 5.390 4.774 5.566 0.066 25 0 "[ . 1 . 2 . ]" 1 2513 1 113 MET ME 1 123 LYS H 3.015 . 4.230 3.804 3.429 4.165 . 0 0 "[ . 1 . 2 . ]" 1 2514 1 113 MET ME 1 123 LYS HA 3.650 . 5.500 4.644 4.150 5.150 . 0 0 "[ . 1 . 2 . ]" 1 2515 1 113 MET ME 1 124 GLU H 3.650 . 5.500 4.096 3.633 4.663 . 0 0 "[ . 1 . 2 . ]" 1 2516 1 113 MET ME 1 124 GLU HA 3.000 . 4.200 3.297 2.748 4.036 . 0 0 "[ . 1 . 2 . ]" 1 2517 1 113 MET ME 1 125 LYS H 2.905 . 4.010 3.354 2.803 4.011 0.001 26 0 "[ . 1 . 2 . ]" 1 2518 1 113 MET ME 1 125 LYS HA 2.300 . 2.800 2.297 1.919 2.808 0.008 17 0 "[ . 1 . 2 . ]" 1 2519 1 113 MET ME 1 125 LYS QE 3.100 . 4.400 4.299 3.316 4.561 0.161 10 0 "[ . 1 . 2 . ]" 1 2520 1 113 MET ME 1 126 PRO QD 2.645 . 3.490 2.372 1.882 2.893 . 0 0 "[ . 1 . 2 . ]" 1 2521 1 113 MET QG 1 121 TRP HE3 3.210 . 4.620 3.053 2.097 4.471 . 0 0 "[ . 1 . 2 . ]" 1 2522 1 113 MET QG 1 121 TRP HZ3 3.570 . 5.340 3.651 3.192 5.065 . 0 0 "[ . 1 . 2 . ]" 1 2523 1 113 MET QG 1 123 LYS H 3.570 . 5.340 4.554 1.734 5.062 0.066 7 0 "[ . 1 . 2 . ]" 1 2524 1 113 MET HG2 1 121 TRP HE3 3.525 . 5.250 4.525 2.113 5.278 0.028 9 0 "[ . 1 . 2 . ]" 1 2525 1 113 MET HG3 1 121 TRP HE3 3.525 . 5.250 3.211 2.572 4.833 . 0 0 "[ . 1 . 2 . ]" 1 2526 1 114 HIS H 1 114 HIS QB 2.930 . 4.060 2.394 2.242 2.585 . 0 0 "[ . 1 . 2 . ]" 1 2527 1 114 HIS H 1 115 CYS H 3.465 . 5.130 4.459 4.315 4.595 . 0 0 "[ . 1 . 2 . ]" 1 2528 1 114 HIS H 1 122 SER H 3.050 . 4.300 3.090 2.527 3.736 . 0 0 "[ . 1 . 2 . ]" 1 2529 1 114 HIS H 1 122 SER QB 3.115 . 4.430 3.082 2.231 4.349 . 0 0 "[ . 1 . 2 . ]" 1 2530 1 114 HIS H 1 123 LYS H 3.245 . 4.690 3.494 2.959 4.146 . 0 0 "[ . 1 . 2 . ]" 1 2531 1 114 HIS HA 1 115 CYS H 2.645 . 3.490 2.216 2.108 2.322 . 0 0 "[ . 1 . 2 . ]" 1 2532 1 114 HIS HA 1 121 TRP HZ3 3.200 . 4.600 2.977 2.470 3.352 . 0 0 "[ . 1 . 2 . ]" 1 2533 1 114 HIS QB 1 115 CYS H 2.985 . 4.170 3.385 2.506 3.792 . 0 0 "[ . 1 . 2 . ]" 1 2534 1 114 HIS HD2 1 115 CYS H 3.650 . 5.500 3.541 2.957 4.286 . 0 0 "[ . 1 . 2 . ]" 1 2535 1 115 CYS H 1 115 CYS HB2 2.945 . 4.090 2.404 2.124 2.798 . 0 0 "[ . 1 . 2 . ]" 1 2536 1 115 CYS H 1 115 CYS QB 2.680 . 3.560 2.249 2.105 2.383 . 0 0 "[ . 1 . 2 . ]" 1 2537 1 115 CYS H 1 115 CYS HB3 2.945 . 4.090 3.095 2.412 3.582 . 0 0 "[ . 1 . 2 . ]" 1 2538 1 115 CYS H 1 116 SER H 3.495 . 5.190 4.435 4.194 4.589 . 0 0 "[ . 1 . 2 . ]" 1 2539 1 115 CYS H 1 121 TRP HE3 3.275 . 4.750 3.401 3.070 3.832 . 0 0 "[ . 1 . 2 . ]" 1 2540 1 115 CYS H 1 121 TRP HZ3 2.950 . 4.100 2.662 2.370 2.980 . 0 0 "[ . 1 . 2 . ]" 1 2541 1 115 CYS H 1 122 SER H 3.650 . 5.500 4.915 4.663 5.141 . 0 0 "[ . 1 . 2 . ]" 1 2542 1 115 CYS HA 1 116 SER H 2.630 . 3.460 2.131 2.024 2.258 . 0 0 "[ . 1 . 2 . ]" 1 2543 1 115 CYS HA 1 121 TRP HA 2.925 . 4.050 2.595 1.989 3.035 . 0 0 "[ . 1 . 2 . ]" 1 2544 1 115 CYS HA 1 121 TRP HE3 3.365 . 4.930 2.989 2.676 3.463 . 0 0 "[ . 1 . 2 . ]" 1 2545 1 115 CYS HA 1 122 SER H 3.350 . 4.900 3.649 2.791 4.105 . 0 0 "[ . 1 . 2 . ]" 1 2546 1 115 CYS QB 1 121 TRP HE3 3.570 . 5.340 4.005 2.877 4.742 . 0 0 "[ . 1 . 2 . ]" 1 2547 1 115 CYS QB 1 121 TRP HZ3 3.570 . 5.340 3.196 2.284 4.123 . 0 0 "[ . 1 . 2 . ]" 1 2548 1 116 SER H 1 116 SER QB 2.735 . 3.670 2.458 2.219 2.926 . 0 0 "[ . 1 . 2 . ]" 1 2549 1 116 SER H 1 117 ASP H 3.315 . 4.830 4.488 4.360 4.627 . 0 0 "[ . 1 . 2 . ]" 1 2550 1 116 SER H 1 119 GLY H 3.170 . 4.540 4.106 3.759 4.542 0.002 5 0 "[ . 1 . 2 . ]" 1 2551 1 116 SER H 1 120 PHE H 2.750 . 3.700 3.232 2.814 3.706 0.006 4 0 "[ . 1 . 2 . ]" 1 2552 1 116 SER H 1 121 TRP H 3.650 . 5.500 4.898 4.694 5.459 . 0 0 "[ . 1 . 2 . ]" 1 2553 1 116 SER H 1 121 TRP HA 2.925 . 4.050 3.313 2.980 3.831 . 0 0 "[ . 1 . 2 . ]" 1 2554 1 116 SER H 1 121 TRP HE3 3.605 . 5.410 4.719 4.380 5.388 . 0 0 "[ . 1 . 2 . ]" 1 2555 1 116 SER H 1 122 SER H 3.320 . 4.840 3.823 3.255 4.660 . 0 0 "[ . 1 . 2 . ]" 1 2556 1 116 SER H 1 122 SER QB 3.570 . 5.340 4.713 3.875 5.411 0.071 12 0 "[ . 1 . 2 . ]" 1 2557 1 116 SER QB 1 117 ASP H 2.645 . 3.490 2.496 1.970 3.329 . 0 0 "[ . 1 . 2 . ]" 1 2558 1 116 SER QB 1 119 GLY H 3.280 . 4.760 3.860 3.159 4.765 0.005 23 0 "[ . 1 . 2 . ]" 1 2559 1 116 SER QB 1 120 PHE H 3.370 . 4.940 3.419 2.681 4.940 . 7 0 "[ . 1 . 2 . ]" 1 2560 1 116 SER HB2 1 117 ASP H 3.030 . 4.260 3.426 1.982 3.893 . 0 0 "[ . 1 . 2 . ]" 1 2561 1 116 SER HB3 1 117 ASP H 3.030 . 4.260 2.666 2.040 3.616 . 0 0 "[ . 1 . 2 . ]" 1 2562 1 117 ASP H 1 117 ASP HB2 2.935 . 4.070 3.192 2.448 3.731 . 0 0 "[ . 1 . 2 . ]" 1 2563 1 117 ASP H 1 117 ASP QB 2.655 . 3.510 2.465 2.187 3.007 . 0 0 "[ . 1 . 2 . ]" 1 2564 1 117 ASP H 1 117 ASP HB3 2.935 . 4.070 2.700 2.367 3.849 . 0 0 "[ . 1 . 2 . ]" 1 2565 1 117 ASP H 1 119 GLY H 3.295 . 4.790 4.351 4.124 4.831 0.041 25 0 "[ . 1 . 2 . ]" 1 2566 1 117 ASP HA 1 119 GLY H 3.460 . 5.120 3.604 3.204 4.274 . 0 0 "[ . 1 . 2 . ]" 1 2567 1 118 ASP HB2 1 119 GLY H 3.300 . 4.800 3.506 2.721 4.387 . 0 0 "[ . 1 . 2 . ]" 1 2568 1 118 ASP HB2 1 120 PHE QD 2.940 . 4.080 3.092 2.060 4.083 0.003 5 0 "[ . 1 . 2 . ]" 1 2569 1 118 ASP HB3 1 119 GLY H 3.300 . 4.800 3.900 2.317 4.530 . 0 0 "[ . 1 . 2 . ]" 1 2570 1 118 ASP HB3 1 120 PHE QD 2.940 . 4.080 2.784 1.931 4.151 0.071 14 0 "[ . 1 . 2 . ]" 1 2571 1 119 GLY H 1 120 PHE H 2.740 . 3.680 2.303 2.024 2.561 . 0 0 "[ . 1 . 2 . ]" 1 2572 1 119 GLY H 1 120 PHE QB 3.570 . 5.340 4.616 4.065 5.082 . 0 0 "[ . 1 . 2 . ]" 1 2573 1 120 PHE H 1 121 TRP H 3.365 . 4.930 4.339 4.222 4.458 . 0 0 "[ . 1 . 2 . ]" 1 2574 1 120 PHE QB 1 121 TRP H 2.630 . 3.460 2.387 1.863 3.494 0.034 14 0 "[ . 1 . 2 . ]" 1 2575 1 120 PHE HB2 1 121 TRP H 3.070 . 4.340 3.075 1.978 4.074 . 0 0 "[ . 1 . 2 . ]" 1 2576 1 120 PHE HB3 1 121 TRP H 3.070 . 4.340 3.004 1.880 3.978 . 0 0 "[ . 1 . 2 . ]" 1 2577 1 120 PHE QD 1 121 TRP H 2.880 . 3.960 3.372 2.787 3.776 . 0 0 "[ . 1 . 2 . ]" 1 2578 1 121 TRP H 1 121 TRP HB2 2.765 . 3.730 2.403 2.256 2.480 . 0 0 "[ . 1 . 2 . ]" 1 2579 1 121 TRP H 1 121 TRP QB 2.460 . 3.120 2.367 2.230 2.438 . 0 0 "[ . 1 . 2 . ]" 1 2580 1 121 TRP H 1 121 TRP HB3 2.765 . 3.730 3.564 3.503 3.609 . 0 0 "[ . 1 . 2 . ]" 1 2581 1 121 TRP H 1 121 TRP HD1 2.980 . 4.160 3.074 2.579 3.487 . 0 0 "[ . 1 . 2 . ]" 1 2582 1 121 TRP H 1 121 TRP HE1 3.650 . 5.500 4.950 4.519 5.377 . 0 0 "[ . 1 . 2 . ]" 1 2583 1 121 TRP H 1 121 TRP HE3 3.290 . 4.780 4.807 4.745 4.845 0.065 17 0 "[ . 1 . 2 . ]" 1 2584 1 121 TRP H 1 122 SER H 3.310 . 4.820 4.502 4.410 4.549 . 0 0 "[ . 1 . 2 . ]" 1 2585 1 121 TRP HA 1 121 TRP HE3 3.155 . 4.510 2.436 2.235 2.728 . 0 0 "[ . 1 . 2 . ]" 1 2586 1 121 TRP QB 1 122 SER H 3.095 . 4.390 2.995 2.695 3.255 . 0 0 "[ . 1 . 2 . ]" 1 2587 1 121 TRP QB 1 123 LYS H 2.810 . 3.820 2.645 2.277 3.058 . 0 0 "[ . 1 . 2 . ]" 1 2588 1 121 TRP HB2 1 122 SER H 3.490 . 5.180 4.071 3.791 4.251 . 0 0 "[ . 1 . 2 . ]" 1 2589 1 121 TRP HB2 1 123 LYS H 3.240 . 4.680 3.681 3.066 4.487 . 0 0 "[ . 1 . 2 . ]" 1 2590 1 121 TRP HB3 1 122 SER H 3.490 . 5.180 3.084 2.754 3.379 . 0 0 "[ . 1 . 2 . ]" 1 2591 1 121 TRP HB3 1 123 LYS H 3.240 . 4.680 2.715 2.315 3.123 . 0 0 "[ . 1 . 2 . ]" 1 2592 1 121 TRP HE3 1 122 SER H 3.265 . 4.730 3.304 2.907 3.720 . 0 0 "[ . 1 . 2 . ]" 1 2593 1 122 SER H 1 123 LYS H 2.820 . 3.840 2.616 2.430 2.877 . 0 0 "[ . 1 . 2 . ]" 1 2594 1 122 SER QB 1 123 LYS H 2.715 . 3.630 3.162 2.397 3.667 0.037 26 0 "[ . 1 . 2 . ]" 1 2595 1 123 LYS H 1 123 LYS HB2 2.830 . 3.860 2.591 2.239 3.216 . 0 0 "[ . 1 . 2 . ]" 1 2596 1 123 LYS H 1 123 LYS QB 2.525 . 3.250 2.456 2.216 2.627 . 0 0 "[ . 1 . 2 . ]" 1 2597 1 123 LYS H 1 123 LYS HB3 2.830 . 3.860 3.430 2.617 3.772 . 0 0 "[ . 1 . 2 . ]" 1 2598 1 123 LYS H 1 123 LYS QE 3.370 . 4.940 4.750 4.017 5.096 0.156 24 0 "[ . 1 . 2 . ]" 1 2599 1 123 LYS H 1 123 LYS HG2 3.325 . 4.850 3.619 2.863 4.883 0.033 15 0 "[ . 1 . 2 . ]" 1 2600 1 123 LYS H 1 123 LYS HG3 3.325 . 4.850 4.308 3.859 4.803 . 0 0 "[ . 1 . 2 . ]" 1 2601 1 123 LYS H 1 124 GLU H 3.185 . 4.570 4.366 4.232 4.486 . 0 0 "[ . 1 . 2 . ]" 1 2602 1 123 LYS HA 1 123 LYS QD 2.695 . 3.590 2.212 1.819 3.385 . 0 0 "[ . 1 . 2 . ]" 1 2603 1 123 LYS HA 1 123 LYS QG 2.660 . 3.520 2.699 2.374 3.030 . 0 0 "[ . 1 . 2 . ]" 1 2604 1 123 LYS QB 1 124 GLU H 2.530 . 3.260 2.648 1.888 3.376 0.116 6 0 "[ . 1 . 2 . ]" 1 2605 1 123 LYS QD 1 124 GLU H . . 3.090 2.797 1.695 3.702 0.612 29 1 "[ . 1 . 2 . +]" 1 2606 1 123 LYS QE 1 123 LYS HG2 2.670 . 3.540 2.623 2.214 3.539 . 0 0 "[ . 1 . 2 . ]" 1 2607 1 123 LYS QE 1 123 LYS QG 2.425 . 3.050 2.365 2.048 2.870 . 0 0 "[ . 1 . 2 . ]" 1 2608 1 123 LYS QE 1 123 LYS HG3 2.670 . 3.540 2.993 2.234 3.584 0.044 5 0 "[ . 1 . 2 . ]" 1 2609 1 123 LYS QE 1 124 GLU H 3.185 . 4.570 3.892 2.107 4.768 0.198 26 0 "[ . 1 . 2 . ]" 1 2610 1 123 LYS QG 1 124 GLU H 3.040 . 4.280 3.638 1.894 4.237 . 0 0 "[ . 1 . 2 . ]" 1 2611 1 123 LYS HG2 1 124 GLU H 3.335 . 4.870 4.306 3.621 4.871 0.001 29 0 "[ . 1 . 2 . ]" 1 2612 1 123 LYS HG3 1 124 GLU H 3.335 . 4.870 4.113 1.901 4.883 0.013 10 0 "[ . 1 . 2 . ]" 1 2613 1 124 GLU H 1 124 GLU HB2 2.740 . 3.680 3.002 2.271 3.709 0.029 14 0 "[ . 1 . 2 . ]" 1 2614 1 124 GLU H 1 124 GLU QB 2.320 . 2.840 2.562 2.245 2.876 0.036 25 0 "[ . 1 . 2 . ]" 1 2615 1 124 GLU H 1 124 GLU HB3 2.740 . 3.680 3.256 2.443 3.682 0.002 3 0 "[ . 1 . 2 . ]" 1 2616 1 124 GLU H 1 124 GLU QG 2.585 . 3.370 2.479 1.864 3.098 . 0 0 "[ . 1 . 2 . ]" 1 2617 1 124 GLU HA 1 124 GLU QG 2.590 . 3.380 2.967 2.392 3.489 0.109 25 0 "[ . 1 . 2 . ]" 1 2618 1 124 GLU HA 1 125 LYS H 2.310 . 2.820 2.465 2.234 2.672 . 0 0 "[ . 1 . 2 . ]" 1 2619 1 124 GLU HA 1 125 LYS QB 3.170 . 4.540 4.423 4.016 4.585 0.045 25 0 "[ . 1 . 2 . ]" 1 2620 1 124 GLU QB 1 125 LYS H 2.375 . 2.950 2.379 2.071 2.788 . 0 0 "[ . 1 . 2 . ]" 1 2621 1 124 GLU QB 1 125 LYS QB 3.110 . 4.420 3.961 3.557 4.464 0.044 10 0 "[ . 1 . 2 . ]" 1 2622 1 124 GLU QG 1 125 LYS H 2.970 . 4.140 3.775 3.160 4.203 0.063 19 0 "[ . 1 . 2 . ]" 1 2623 1 125 LYS H 1 125 LYS QB 2.425 . 3.050 2.276 2.097 2.510 . 0 0 "[ . 1 . 2 . ]" 1 2624 1 125 LYS H 1 125 LYS QE 3.580 . 5.360 4.816 4.171 5.429 0.069 20 0 "[ . 1 . 2 . ]" 1 2625 1 125 LYS H 1 125 LYS HG2 3.170 . 4.540 3.924 2.411 4.567 0.027 17 0 "[ . 1 . 2 . ]" 1 2626 1 125 LYS H 1 125 LYS HG3 3.170 . 4.540 3.681 2.394 4.559 0.019 1 0 "[ . 1 . 2 . ]" 1 2627 1 125 LYS H 1 126 PRO QD 3.250 . 4.700 4.141 3.987 4.295 . 0 0 "[ . 1 . 2 . ]" 1 2628 1 125 LYS HA 1 125 LYS HG2 3.005 . 4.210 2.971 2.234 3.939 . 0 0 "[ . 1 . 2 . ]" 1 2629 1 125 LYS HA 1 125 LYS QG 2.730 . 3.660 2.581 2.158 3.346 . 0 0 "[ . 1 . 2 . ]" 1 2630 1 125 LYS HA 1 125 LYS HG3 3.005 . 4.210 3.059 2.526 3.672 . 0 0 "[ . 1 . 2 . ]" 1 2631 1 125 LYS HA 1 126 PRO HD2 2.765 . 3.730 2.406 1.996 2.788 . 0 0 "[ . 1 . 2 . ]" 1 2632 1 125 LYS HA 1 126 PRO HD3 2.765 . 3.730 2.048 1.850 2.365 . 0 0 "[ . 1 . 2 . ]" 1 2633 1 125 LYS HA 1 126 PRO QG 3.075 . 4.350 3.802 3.654 3.926 . 0 0 "[ . 1 . 2 . ]" 1 2634 1 125 LYS QB 1 125 LYS QE 2.410 . 3.020 2.199 1.805 3.392 0.372 20 0 "[ . 1 . 2 . ]" 1 2635 1 125 LYS QB 1 126 PRO QD 2.890 . 3.980 3.328 2.295 3.692 . 0 0 "[ . 1 . 2 . ]" 1 2636 1 125 LYS QE 1 125 LYS HG2 2.625 . 3.450 2.857 2.109 3.505 0.055 9 0 "[ . 1 . 2 . ]" 1 2637 1 125 LYS QE 1 125 LYS HG3 2.625 . 3.450 3.028 1.953 3.503 0.053 3 0 "[ . 1 . 2 . ]" 1 2638 1 125 LYS QG 1 126 PRO QD 2.815 . 3.830 3.190 2.219 3.862 0.032 13 0 "[ . 1 . 2 . ]" 1 2639 1 125 LYS HG2 1 126 PRO HD2 3.650 . 5.500 3.986 2.333 5.522 0.022 16 0 "[ . 1 . 2 . ]" 1 2640 1 125 LYS HG2 1 126 PRO HD3 3.650 . 5.500 4.566 3.510 5.607 0.107 8 0 "[ . 1 . 2 . ]" 1 2641 1 125 LYS HG3 1 126 PRO HD2 3.650 . 5.500 4.153 2.473 5.403 . 0 0 "[ . 1 . 2 . ]" 1 2642 1 125 LYS HG3 1 126 PRO HD3 3.650 . 5.500 4.702 3.604 5.549 0.049 4 0 "[ . 1 . 2 . ]" 1 2643 1 126 PRO HA 1 127 LYS H 2.355 . 2.910 2.476 2.255 2.727 . 0 0 "[ . 1 . 2 . ]" 1 2644 1 126 PRO HB2 1 127 LYS H 2.570 . 3.340 2.417 1.877 2.942 . 0 0 "[ . 1 . 2 . ]" 1 2645 1 126 PRO HB3 1 127 LYS H 2.765 . 3.730 3.257 2.752 3.652 . 0 0 "[ . 1 . 2 . ]" 1 2646 1 126 PRO QG 1 127 LYS H 3.125 . 4.450 4.020 3.344 4.463 0.013 14 0 "[ . 1 . 2 . ]" 1 2647 1 127 LYS H 1 127 LYS HB2 2.850 . 3.900 3.070 2.576 3.922 0.022 15 0 "[ . 1 . 2 . ]" 1 2648 1 127 LYS H 1 127 LYS QB 2.590 . 3.380 2.664 2.307 3.343 . 0 0 "[ . 1 . 2 . ]" 1 2649 1 127 LYS H 1 127 LYS HB3 2.850 . 3.900 3.172 2.451 3.833 . 0 0 "[ . 1 . 2 . ]" 1 2650 1 127 LYS H 1 127 LYS QD 3.425 . 5.050 4.510 4.052 5.126 0.076 18 0 "[ . 1 . 2 . ]" 1 2651 1 127 LYS H 1 127 LYS QG 3.070 . 4.340 3.281 2.157 4.087 . 0 0 "[ . 1 . 2 . ]" 1 2652 1 127 LYS H 1 128 CYS H 3.115 . 4.430 4.333 4.173 4.450 0.020 14 0 "[ . 1 . 2 . ]" 1 2653 1 127 LYS H 1 129 VAL MG1 3.485 . 5.170 4.742 4.197 5.172 0.002 4 0 "[ . 1 . 2 . ]" 1 2654 1 127 LYS HA 1 127 LYS QD 3.085 . 4.370 4.107 3.853 4.424 0.054 19 0 "[ . 1 . 2 . ]" 1 2655 1 127 LYS HA 1 127 LYS QG 2.590 . 3.380 2.671 2.355 3.344 . 0 0 "[ . 1 . 2 . ]" 1 2656 1 127 LYS HA 1 128 CYS H 2.410 . 3.020 2.341 2.212 2.574 . 0 0 "[ . 1 . 2 . ]" 1 2657 1 127 LYS QB 1 128 CYS H 2.615 . 3.430 2.786 2.041 3.497 0.067 20 0 "[ . 1 . 2 . ]" 1 2658 1 127 LYS QB 1 129 VAL H 3.570 . 5.340 4.712 3.945 5.292 . 0 0 "[ . 1 . 2 . ]" 1 2659 1 127 LYS QB 1 129 VAL MG1 2.430 . 3.060 2.763 2.102 3.121 0.061 15 0 "[ . 1 . 2 . ]" 1 2660 1 127 LYS HB2 1 127 LYS QG 2.405 . 3.010 2.334 2.260 2.415 . 0 0 "[ . 1 . 2 . ]" 1 2661 1 127 LYS HB2 1 128 CYS H 3.015 . 4.230 3.424 2.057 4.074 . 0 0 "[ . 1 . 2 . ]" 1 2662 1 127 LYS HB3 1 127 LYS QG 2.405 . 3.010 2.304 2.181 2.406 . 0 0 "[ . 1 . 2 . ]" 1 2663 1 127 LYS HB3 1 128 CYS H 3.015 . 4.230 3.217 2.114 3.945 . 0 0 "[ . 1 . 2 . ]" 1 2664 1 127 LYS QD 1 127 LYS QE 2.100 . 2.400 2.028 1.975 2.100 . 0 0 "[ . 1 . 2 . ]" 1 2665 1 127 LYS QD 1 128 CYS H 3.100 . 4.400 4.272 3.964 4.452 0.052 25 0 "[ . 1 . 2 . ]" 1 2666 1 127 LYS QD 1 129 VAL HB 3.650 . 5.500 5.138 4.665 5.549 0.049 25 0 "[ . 1 . 2 . ]" 1 2667 1 127 LYS QD 1 129 VAL MG1 2.290 . 2.780 2.563 2.206 2.818 0.038 25 0 "[ . 1 . 2 . ]" 1 2668 1 127 LYS QE 1 127 LYS QG 2.390 . 2.980 2.405 2.139 2.845 . 0 0 "[ . 1 . 2 . ]" 1 2669 1 127 LYS QE 1 129 VAL MG1 2.995 . 4.190 3.362 1.941 4.266 0.076 6 0 "[ . 1 . 2 . ]" 1 2670 1 127 LYS QG 1 128 CYS H 3.040 . 4.280 3.085 1.918 3.992 . 0 0 "[ . 1 . 2 . ]" 1 2671 1 127 LYS QG 1 129 VAL MG1 2.850 . 3.900 2.736 1.870 3.904 0.004 1 0 "[ . 1 . 2 . ]" 1 2672 1 128 CYS H 1 128 CYS HB2 2.840 . 3.880 2.537 2.417 2.738 . 0 0 "[ . 1 . 2 . ]" 1 2673 1 128 CYS H 1 128 CYS QB 2.510 . 3.220 2.474 2.295 2.622 . 0 0 "[ . 1 . 2 . ]" 1 2674 1 128 CYS H 1 128 CYS HB3 2.840 . 3.880 3.619 2.537 3.772 . 0 0 "[ . 1 . 2 . ]" 1 2675 1 128 CYS H 1 129 VAL H 3.115 . 4.430 4.165 3.852 4.326 . 0 0 "[ . 1 . 2 . ]" 1 2676 1 128 CYS H 1 129 VAL MG1 2.885 . 3.970 3.652 3.016 3.999 0.029 21 0 "[ . 1 . 2 . ]" 1 2677 1 128 CYS HA 1 129 VAL H 2.315 . 2.830 2.033 1.973 2.127 . 0 0 "[ . 1 . 2 . ]" 1 2678 1 128 CYS HA 1 129 VAL MG1 2.985 . 4.170 3.760 3.571 3.883 . 0 0 "[ . 1 . 2 . ]" 1 2679 1 128 CYS HA 1 129 VAL MG2 2.930 . 4.060 3.419 3.143 3.622 . 0 0 "[ . 1 . 2 . ]" 1 2680 1 128 CYS HB2 1 129 VAL H 3.280 . 4.760 4.305 4.065 4.406 . 0 0 "[ . 1 . 2 . ]" 1 2681 1 128 CYS HB3 1 129 VAL H 3.280 . 4.760 3.525 3.141 4.189 . 0 0 "[ . 1 . 2 . ]" 1 2682 1 129 VAL H 1 129 VAL HB 2.820 . 3.840 3.761 3.697 3.838 . 0 0 "[ . 1 . 2 . ]" 1 2683 1 129 VAL H 1 129 VAL MG1 2.815 . 3.830 3.015 2.753 3.213 . 0 0 "[ . 1 . 2 . ]" 1 2684 1 129 VAL H 1 129 VAL MG2 2.280 . 2.760 2.130 2.022 2.250 . 0 0 "[ . 1 . 2 . ]" 1 2685 1 129 VAL HA 1 129 VAL HB 2.365 . 2.930 2.535 2.483 2.594 . 0 0 "[ . 1 . 2 . ]" 1 2686 1 129 VAL HA 1 129 VAL MG1 2.155 . 2.510 2.336 2.252 2.381 . 0 0 "[ . 1 . 2 . ]" 1 2687 1 129 VAL HA 1 129 VAL MG2 2.845 . 3.890 3.225 3.185 3.244 . 0 0 "[ . 1 . 2 . ]" 1 stop_ save_
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