NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
390151 | 1nyo | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1nyo 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 2597 _Distance_constraint_stats_list.Viol_count 7871 _Distance_constraint_stats_list.Viol_total 26940.279 _Distance_constraint_stats_list.Viol_max 0.981 _Distance_constraint_stats_list.Viol_rms 0.0381 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0072 _Distance_constraint_stats_list.Viol_average_violations_only 0.0901 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 2 ASP 4.183 0.377 25 0 "[ . 1 . 2 . 3 . ]" 1 3 LEU 4.718 0.377 25 0 "[ . 1 . 2 . 3 . ]" 1 4 VAL 2.584 0.422 34 0 "[ . 1 . 2 . 3 . ]" 1 5 GLY 12.375 0.444 6 0 "[ . 1 . 2 . 3 . ]" 1 6 PRO 2.394 0.150 26 0 "[ . 1 . 2 . 3 . ]" 1 7 GLY 0.229 0.033 21 0 "[ . 1 . 2 . 3 . ]" 1 8 CYS 0.396 0.073 38 0 "[ . 1 . 2 . 3 . ]" 1 9 ALA 0.471 0.070 25 0 "[ . 1 . 2 . 3 . ]" 1 10 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 11 TYR 4.074 0.157 26 0 "[ . 1 . 2 . 3 . ]" 1 12 ALA 1.727 0.297 3 0 "[ . 1 . 2 . 3 . ]" 1 13 ALA 0.236 0.043 13 0 "[ . 1 . 2 . 3 . ]" 1 14 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 15 ASN 2.187 0.297 3 0 "[ . 1 . 2 . 3 . ]" 1 16 PRO 0.855 0.128 22 0 "[ . 1 . 2 . 3 . ]" 1 17 THR 2.852 0.233 34 0 "[ . 1 . 2 . 3 . ]" 1 18 GLY 2.124 0.239 19 0 "[ . 1 . 2 . 3 . ]" 1 19 PRO 6.840 0.584 18 2 "[ . 1 - . + 2 . 3 . ]" 1 20 ALA 9.820 0.633 36 1 "[ . 1 . 2 . 3 .+ ]" 1 21 SER 3.066 0.616 26 2 "[ . 1 . 2 .+ 3 -. ]" 1 22 VAL 7.305 0.616 26 2 "[ . 1 . 2 .+ 3 -. ]" 1 23 GLN 14.769 0.506 6 1 "[ .+ 1 . 2 . 3 . ]" 1 24 GLY 17.309 0.584 18 3 "[ .- 1 * . + 2 . 3 . ]" 1 25 MET 7.013 0.151 35 0 "[ . 1 . 2 . 3 . ]" 1 26 SER 4.168 0.304 6 0 "[ . 1 . 2 . 3 . ]" 1 27 GLN 15.825 0.960 33 10 "[ * 1** . * 2 * . *- +*. * ]" 1 28 ASP 3.698 0.314 15 0 "[ . 1 . 2 . 3 . ]" 1 29 PRO 5.788 0.216 12 0 "[ . 1 . 2 . 3 . ]" 1 30 VAL 4.291 0.166 36 0 "[ . 1 . 2 . 3 . ]" 1 31 ALA 2.434 0.136 9 0 "[ . 1 . 2 . 3 . ]" 1 32 VAL 2.886 0.136 9 0 "[ . 1 . 2 . 3 . ]" 1 33 ALA 8.193 0.314 15 0 "[ . 1 . 2 . 3 . ]" 1 34 ALA 0.858 0.110 28 0 "[ . 1 . 2 . 3 . ]" 1 35 SER 0.195 0.053 18 0 "[ . 1 . 2 . 3 . ]" 1 36 ASN 4.740 0.165 11 0 "[ . 1 . 2 . 3 . ]" 1 37 ASN 12.996 0.633 36 1 "[ . 1 . 2 . 3 .+ ]" 1 38 PRO 9.190 0.296 20 0 "[ . 1 . 2 . 3 . ]" 1 39 GLU 4.897 0.189 33 0 "[ . 1 . 2 . 3 . ]" 1 40 LEU 9.440 0.297 11 0 "[ . 1 . 2 . 3 . ]" 1 41 THR 1.972 0.111 36 0 "[ . 1 . 2 . 3 . ]" 1 42 THR 2.261 0.111 36 0 "[ . 1 . 2 . 3 . ]" 1 43 LEU 12.596 0.719 31 5 "[ . -* . 2 . 3+ .** ]" 1 44 THR 10.896 0.336 37 0 "[ . 1 . 2 . 3 . ]" 1 45 ALA 8.169 0.189 10 0 "[ . 1 . 2 . 3 . ]" 1 46 ALA 1.777 0.178 20 0 "[ . 1 . 2 . 3 . ]" 1 47 LEU 24.826 0.901 31 6 "[ . *1 *. * .- 3+ .* ]" 1 48 SER 12.156 0.189 10 0 "[ . 1 . 2 . 3 . ]" 1 49 GLY 1.447 0.120 17 0 "[ . 1 . 2 . 3 . ]" 1 50 GLN 1.457 0.104 16 0 "[ . 1 . 2 . 3 . ]" 1 51 LEU 8.285 0.345 30 0 "[ . 1 . 2 . 3 . ]" 1 52 ASN 6.548 0.672 28 2 "[ . 1 . 2 . +-3 . ]" 1 53 PRO 1.652 0.141 20 0 "[ . 1 . 2 . 3 . ]" 1 54 GLN 3.856 0.981 20 1 "[ . 1 . + . 3 . ]" 1 55 VAL 3.905 0.366 36 0 "[ . 1 . 2 . 3 . ]" 1 56 ASN 2.317 0.366 36 0 "[ . 1 . 2 . 3 . ]" 1 57 LEU 11.642 0.957 9 6 "[ . +1 *. * .- 3* .* ]" 1 58 VAL 4.665 0.354 9 0 "[ . 1 . 2 . 3 . ]" 1 59 ASP 5.555 0.354 9 0 "[ . 1 . 2 . 3 . ]" 1 60 THR 5.516 0.157 5 0 "[ . 1 . 2 . 3 . ]" 1 61 LEU 8.411 0.957 9 2 "[ . +1 . 2 .- 3 . ]" 1 62 ASN 5.647 0.216 12 0 "[ . 1 . 2 . 3 . ]" 1 63 SER 1.851 0.115 3 0 "[ . 1 . 2 . 3 . ]" 1 64 GLY 3.414 0.183 24 0 "[ . 1 . 2 . 3 . ]" 1 65 GLN 2.480 0.124 37 0 "[ . 1 . 2 . 3 . ]" 1 66 TYR 12.882 0.277 11 0 "[ . 1 . 2 . 3 . ]" 1 67 THR 25.925 0.344 1 0 "[ . 1 . 2 . 3 . ]" 1 68 VAL 18.831 0.254 15 0 "[ . 1 . 2 . 3 . ]" 1 69 PHE 48.526 0.442 17 0 "[ . 1 . 2 . 3 . ]" 1 70 ALA 24.495 0.297 11 0 "[ . 1 . 2 . 3 . ]" 1 71 PRO 24.778 0.514 17 1 "[ . 1 . + 2 . 3 . ]" 1 72 THR 10.826 0.267 38 0 "[ . 1 . 2 . 3 . ]" 1 73 ASN 2.975 0.267 38 0 "[ . 1 . 2 . 3 . ]" 1 74 ALA 0.485 0.146 30 0 "[ . 1 . 2 . 3 . ]" 1 75 ALA 5.685 0.224 38 0 "[ . 1 . 2 . 3 . ]" 1 76 PHE 23.737 0.719 31 5 "[ . -* . 2 . 3+ .** ]" 1 77 SER 0.362 0.070 3 0 "[ . 1 . 2 . 3 . ]" 1 78 LYS 3.215 0.182 13 0 "[ . 1 . 2 . 3 . ]" 1 79 LEU 4.816 0.981 3 2 "[ + .- 1 . 2 . 3 . ]" 1 80 PRO 2.786 0.253 6 0 "[ . 1 . 2 . 3 . ]" 1 81 ALA 0.511 0.069 4 0 "[ . 1 . 2 . 3 . ]" 1 82 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 83 THR 8.331 0.981 3 2 "[ + .- 1 . 2 . 3 . ]" 1 84 ILE 16.556 0.762 6 3 "[ .+ 1 . *2 -. 3 . ]" 1 85 ASP 3.736 0.500 12 1 "[ . 1 + . 2 . 3 . ]" 1 86 GLU 5.000 0.500 12 1 "[ . 1 + . 2 . 3 . ]" 1 87 LEU 8.262 0.144 6 0 "[ . 1 . 2 . 3 . ]" 1 88 LYS 9.196 0.762 6 5 "[ .+ 1 . *2 -. **3 . ]" 1 89 THR 3.684 0.277 4 0 "[ . 1 . 2 . 3 . ]" 1 90 ASN 14.148 0.277 4 0 "[ . 1 . 2 . 3 . ]" 1 91 SER 6.675 0.213 4 0 "[ . 1 . 2 . 3 . ]" 1 93 LEU 1.602 0.069 28 0 "[ . 1 . 2 . 3 . ]" 1 94 LEU 17.892 0.981 20 1 "[ . 1 . + . 3 . ]" 1 95 THR 14.919 0.364 19 0 "[ . 1 . 2 . 3 . ]" 1 96 SER 7.583 0.454 11 0 "[ . 1 . 2 . 3 . ]" 1 97 ILE 12.886 0.454 11 0 "[ . 1 . 2 . 3 . ]" 1 98 LEU 13.572 0.196 6 0 "[ . 1 . 2 . 3 . ]" 1 99 THR 25.190 0.496 19 0 "[ . 1 . 2 . 3 . ]" 1 100 TYR 49.748 0.725 32 11 "[ - . 1 **. * 2 * .* * + * **]" 1 101 HIS 13.821 0.514 17 1 "[ . 1 . + 2 . 3 . ]" 1 102 VAL 14.137 0.397 20 0 "[ . 1 . 2 . 3 . ]" 1 103 VAL 26.778 0.897 17 7 "[ *. 1*** - + 2 . 3 * . ]" 1 104 ALA 2.457 0.126 24 0 "[ . 1 . 2 . 3 . ]" 1 105 GLY 1.354 0.104 19 0 "[ . 1 . 2 . 3 . ]" 1 106 GLN 6.301 0.138 28 0 "[ . 1 . 2 . 3 . ]" 1 107 THR 4.724 0.268 11 0 "[ . 1 . 2 . 3 . ]" 1 108 SER 2.435 0.151 11 0 "[ . 1 . 2 . 3 . ]" 1 109 PRO 7.514 0.164 17 0 "[ . 1 . 2 . 3 . ]" 1 110 ALA 2.234 0.119 34 0 "[ . 1 . 2 . 3 . ]" 1 111 ASN 1.152 0.120 11 0 "[ . 1 . 2 . 3 . ]" 1 112 VAL 7.303 0.268 11 0 "[ . 1 . 2 . 3 . ]" 1 113 VAL 0.109 0.049 23 0 "[ . 1 . 2 . 3 . ]" 1 114 GLY 0.019 0.019 24 0 "[ . 1 . 2 . 3 . ]" 1 115 THR 4.332 0.361 8 0 "[ . 1 . 2 . 3 . ]" 1 116 ARG 21.831 0.897 17 11 "[ *. *1*** * +- 2 .* * * . ]" 1 117 GLN 0.576 0.108 13 0 "[ . 1 . 2 . 3 . ]" 1 118 THR 8.767 0.279 23 0 "[ . 1 . 2 . 3 . ]" 1 119 LEU 4.966 0.309 23 0 "[ . 1 . 2 . 3 . ]" 1 120 GLN 38.749 0.725 32 12 "[ - . * **. * 2 * .* * + * **]" 1 121 GLY 5.612 0.401 6 0 "[ . 1 . 2 . 3 . ]" 1 122 ALA 5.826 0.683 10 1 "[ . + . 2 . 3 . ]" 1 123 SER 2.793 0.327 38 0 "[ . 1 . 2 . 3 . ]" 1 124 VAL 9.645 0.465 15 0 "[ . 1 . 2 . 3 . ]" 1 125 THR 0.814 0.130 14 0 "[ . 1 . 2 . 3 . ]" 1 126 VAL 2.656 0.158 19 0 "[ . 1 . 2 . 3 . ]" 1 127 THR 0.387 0.051 6 0 "[ . 1 . 2 . 3 . ]" 1 128 GLY 2.571 0.238 18 0 "[ . 1 . 2 . 3 . ]" 1 129 GLN 4.570 0.238 18 0 "[ . 1 . 2 . 3 . ]" 1 130 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 131 ASN 1.079 0.107 14 0 "[ . 1 . 2 . 3 . ]" 1 132 SER 7.572 0.374 30 0 "[ . 1 . 2 . 3 . ]" 1 133 LEU 8.827 0.374 30 0 "[ . 1 . 2 . 3 . ]" 1 134 LYS 5.277 0.363 24 0 "[ . 1 . 2 . 3 . ]" 1 135 VAL 4.323 0.363 24 0 "[ . 1 . 2 . 3 . ]" 1 136 GLY 4.965 0.223 27 0 "[ . 1 . 2 . 3 . ]" 1 137 ASN 7.502 0.588 19 1 "[ . 1 . +2 . 3 . ]" 1 138 ALA 17.869 0.588 19 1 "[ . 1 . +2 . 3 . ]" 1 139 ASP 27.987 0.470 14 0 "[ . 1 . 2 . 3 . ]" 1 140 VAL 17.460 0.464 27 0 "[ . 1 . 2 . 3 . ]" 1 141 VAL 26.112 0.421 7 0 "[ . 1 . 2 . 3 . ]" 1 142 CYS 11.886 0.444 6 0 "[ . 1 . 2 . 3 . ]" 1 143 GLY 0.164 0.139 34 0 "[ . 1 . 2 . 3 . ]" 1 144 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 145 VAL 7.444 0.168 6 0 "[ . 1 . 2 . 3 . ]" 1 146 SER 12.174 0.301 37 0 "[ . 1 . 2 . 3 . ]" 1 147 THR 18.429 0.304 6 0 "[ . 1 . 2 . 3 . ]" 1 148 ALA 6.139 0.215 6 0 "[ . 1 . 2 . 3 . ]" 1 149 ASN 9.832 0.178 22 0 "[ . 1 . 2 . 3 . ]" 1 150 ALA 11.824 0.277 11 0 "[ . 1 . 2 . 3 . ]" 1 151 THR 9.001 0.184 23 0 "[ . 1 . 2 . 3 . ]" 1 152 VAL 13.628 0.186 11 0 "[ . 1 . 2 . 3 . ]" 1 153 TYR 26.670 0.344 1 0 "[ . 1 . 2 . 3 . ]" 1 154 MET 13.272 0.238 10 0 "[ . 1 . 2 . 3 . ]" 1 155 ILE 13.864 0.275 20 0 "[ . 1 . 2 . 3 . ]" 1 156 ASP 12.968 0.421 7 0 "[ . 1 . 2 . 3 . ]" 1 157 SER 9.654 0.917 28 2 "[ . 1 - . 2 . + 3 . ]" 1 158 VAL 7.254 0.312 30 0 "[ . 1 . 2 . 3 . ]" 1 159 LEU 8.752 0.917 28 2 "[ . 1 - . 2 . + 3 . ]" 1 160 MET 6.828 0.250 29 0 "[ . 1 . 2 . 3 . ]" 1 161 PRO 7.975 0.218 2 0 "[ . 1 . 2 . 3 . ]" 1 162 PRO 3.411 0.206 26 0 "[ . 1 . 2 . 3 . ]" 1 163 ALA 0.127 0.071 35 0 "[ . 1 . 2 . 3 . ]" 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 1 159 LEU H 1 159 LEU QB . . 3.610 2.533 1.991 3.256 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2 1 159 LEU H 1 159 LEU QD . . 3.850 2.713 1.936 3.244 . 0 0 "[ . 1 . 2 . 3 . ]" 1 3 1 158 VAL HA 1 159 LEU H . . 3.440 2.679 2.366 3.190 . 0 0 "[ . 1 . 2 . 3 . ]" 1 4 1 68 VAL HA 1 69 PHE H . . 3.060 2.242 2.198 2.294 . 0 0 "[ . 1 . 2 . 3 . ]" 1 5 1 69 PHE H 1 69 PHE HB2 . . 3.810 2.339 2.220 2.435 . 0 0 "[ . 1 . 2 . 3 . ]" 1 6 1 68 VAL MG1 1 69 PHE H . . 3.590 2.239 2.040 2.483 . 0 0 "[ . 1 . 2 . 3 . ]" 1 7 1 69 PHE H 1 69 PHE HB3 . . 4.130 3.477 3.413 3.530 . 0 0 "[ . 1 . 2 . 3 . ]" 1 8 1 69 PHE H 1 69 PHE QD . . 4.090 3.437 3.237 3.586 . 0 0 "[ . 1 . 2 . 3 . ]" 1 9 1 126 VAL H 1 126 VAL MG2 . . 3.770 2.167 1.886 2.562 . 0 0 "[ . 1 . 2 . 3 . ]" 1 10 1 125 THR HA 1 126 VAL H . . 3.180 2.278 2.152 2.505 . 0 0 "[ . 1 . 2 . 3 . ]" 1 11 1 126 VAL H 1 126 VAL HB . . 3.690 2.527 2.413 2.686 . 0 0 "[ . 1 . 2 . 3 . ]" 1 12 1 125 THR MG 1 126 VAL H . . 3.760 3.526 3.127 3.890 0.130 14 0 "[ . 1 . 2 . 3 . ]" 1 13 1 114 GLY H 1 126 VAL H . . 4.130 3.163 2.481 3.989 . 0 0 "[ . 1 . 2 . 3 . ]" 1 14 1 113 VAL HA 1 126 VAL H . . 4.760 4.321 3.685 4.809 0.049 23 0 "[ . 1 . 2 . 3 . ]" 1 15 1 141 VAL H 1 141 VAL QG . . 3.290 2.028 1.842 2.462 . 0 0 "[ . 1 . 2 . 3 . ]" 1 16 1 125 THR HB 1 126 VAL H . . 4.810 4.628 4.542 4.668 . 0 0 "[ . 1 . 2 . 3 . ]" 1 17 1 140 VAL HB 1 141 VAL H . . 4.710 4.455 4.209 4.613 . 0 0 "[ . 1 . 2 . 3 . ]" 1 18 1 162 PRO HA 1 163 ALA H . . 3.160 2.473 2.156 3.231 0.071 35 0 "[ . 1 . 2 . 3 . ]" 1 19 1 163 ALA H 1 163 ALA MB . . 3.600 2.705 2.205 2.966 . 0 0 "[ . 1 . 2 . 3 . ]" 1 20 1 162 PRO HB2 1 163 ALA H . . 4.580 4.032 2.408 4.453 . 0 0 "[ . 1 . 2 . 3 . ]" 1 21 1 103 VAL HA 1 104 ALA H . . 3.060 2.320 2.190 2.497 . 0 0 "[ . 1 . 2 . 3 . ]" 1 22 1 104 ALA H 1 104 ALA MB . . 3.240 2.157 2.010 2.438 . 0 0 "[ . 1 . 2 . 3 . ]" 1 23 1 152 VAL H 1 152 VAL HB . . 3.320 2.609 2.518 2.684 . 0 0 "[ . 1 . 2 . 3 . ]" 1 24 1 152 VAL H 1 152 VAL QG . . 3.500 3.125 3.088 3.152 . 0 0 "[ . 1 . 2 . 3 . ]" 1 25 1 103 VAL MG1 1 104 ALA H . . 3.770 2.095 1.807 2.567 . 0 0 "[ . 1 . 2 . 3 . ]" 1 26 1 103 VAL MG2 1 104 ALA H . . 4.920 3.808 3.389 4.099 . 0 0 "[ . 1 . 2 . 3 . ]" 1 27 1 153 TYR H 1 153 TYR HB2 . . 4.000 2.492 2.460 2.543 . 0 0 "[ . 1 . 2 . 3 . ]" 1 28 1 69 PHE HA 1 153 TYR H . . 4.200 2.887 2.626 3.118 . 0 0 "[ . 1 . 2 . 3 . ]" 1 29 1 153 TYR H 1 153 TYR QD . . 3.830 3.102 2.950 3.247 . 0 0 "[ . 1 . 2 . 3 . ]" 1 30 1 69 PHE QD 1 153 TYR H . . 5.240 5.017 4.747 5.191 . 0 0 "[ . 1 . 2 . 3 . ]" 1 31 1 68 VAL H 1 153 TYR H . . 5.180 4.714 4.422 4.929 . 0 0 "[ . 1 . 2 . 3 . ]" 1 32 1 81 ALA H 1 81 ALA MB . . 3.340 2.082 1.938 2.950 . 0 0 "[ . 1 . 2 . 3 . ]" 1 33 1 80 PRO HA 1 81 ALA H . . 3.410 2.308 2.189 3.167 . 0 0 "[ . 1 . 2 . 3 . ]" 1 34 1 45 ALA H 1 45 ALA MB . . 3.100 2.126 2.054 2.203 . 0 0 "[ . 1 . 2 . 3 . ]" 1 35 1 44 THR HB 1 45 ALA H . . 3.610 2.610 2.224 3.517 . 0 0 "[ . 1 . 2 . 3 . ]" 1 36 1 44 THR H 1 45 ALA H . . 3.780 3.038 2.943 3.155 . 0 0 "[ . 1 . 2 . 3 . ]" 1 37 1 45 ALA H 1 50 GLN HB2 . . 4.730 4.353 4.157 4.724 . 0 0 "[ . 1 . 2 . 3 . ]" 1 38 1 45 ALA H 1 46 ALA H . . 3.960 2.938 2.822 3.071 . 0 0 "[ . 1 . 2 . 3 . ]" 1 39 1 116 ARG H 1 125 THR HA . . 4.190 3.610 2.862 4.199 0.009 11 0 "[ . 1 . 2 . 3 . ]" 1 40 1 69 PHE QD 1 70 ALA H . . 4.840 4.754 4.640 4.861 0.021 30 0 "[ . 1 . 2 . 3 . ]" 1 41 1 115 THR HA 1 116 ARG H . . 3.200 2.200 2.150 2.448 . 0 0 "[ . 1 . 2 . 3 . ]" 1 42 1 69 PHE HA 1 70 ALA H . . 3.830 2.517 2.460 2.591 . 0 0 "[ . 1 . 2 . 3 . ]" 1 43 1 68 VAL MG1 1 70 ALA H . . 4.450 3.317 3.036 3.631 . 0 0 "[ . 1 . 2 . 3 . ]" 1 44 1 116 ARG H 1 124 VAL QG . . 4.710 2.522 2.080 3.103 . 0 0 "[ . 1 . 2 . 3 . ]" 1 45 1 43 LEU QD 1 70 ALA H . . 4.370 4.371 4.184 4.522 0.152 14 0 "[ . 1 . 2 . 3 . ]" 1 46 1 116 ARG H 1 116 ARG HB3 . . 3.690 3.126 2.337 3.536 . 0 0 "[ . 1 . 2 . 3 . ]" 1 47 1 69 PHE HB2 1 70 ALA H . . 4.690 4.727 4.705 4.751 0.061 6 0 "[ . 1 . 2 . 3 . ]" 1 48 1 107 THR HB 1 108 SER H . . 4.350 4.027 1.924 4.450 0.100 28 0 "[ . 1 . 2 . 3 . ]" 1 49 1 107 THR MG 1 108 SER H . . 4.380 2.406 1.875 2.790 . 0 0 "[ . 1 . 2 . 3 . ]" 1 50 1 103 VAL H 1 103 VAL HB . . 3.570 2.422 2.197 2.692 . 0 0 "[ . 1 . 2 . 3 . ]" 1 51 1 67 THR H 1 103 VAL H . . 4.140 2.441 2.067 2.784 . 0 0 "[ . 1 . 2 . 3 . ]" 1 52 1 66 TYR HB3 1 103 VAL H . . 5.150 4.031 3.395 4.434 . 0 0 "[ . 1 . 2 . 3 . ]" 1 53 1 145 VAL HA 1 146 SER H . . 2.960 2.631 2.484 2.704 . 0 0 "[ . 1 . 2 . 3 . ]" 1 54 1 146 SER H 1 151 THR MG . . 4.550 3.144 2.961 3.438 . 0 0 "[ . 1 . 2 . 3 . ]" 1 55 1 145 VAL MG2 1 146 SER H . . 4.300 4.336 4.295 4.395 0.095 1 0 "[ . 1 . 2 . 3 . ]" 1 56 1 146 SER H 1 146 SER HB2 . . 4.120 2.654 2.475 3.014 . 0 0 "[ . 1 . 2 . 3 . ]" 1 57 1 145 VAL HB 1 146 SER H . . 4.630 4.416 4.379 4.474 . 0 0 "[ . 1 . 2 . 3 . ]" 1 58 1 146 SER H 1 146 SER HB3 . . 3.710 3.553 3.472 3.572 . 0 0 "[ . 1 . 2 . 3 . ]" 1 59 1 133 LEU H 1 133 LEU HB2 . . 3.300 2.410 2.067 2.831 . 0 0 "[ . 1 . 2 . 3 . ]" 1 60 1 132 SER HA 1 133 LEU H . . 3.240 2.399 2.216 3.614 0.374 30 0 "[ . 1 . 2 . 3 . ]" 1 61 1 133 LEU H 1 133 LEU HB3 . . 4.140 3.535 3.364 3.713 . 0 0 "[ . 1 . 2 . 3 . ]" 1 62 1 132 SER HB2 1 133 LEU H . . 4.370 4.429 3.285 4.740 0.370 12 0 "[ . 1 . 2 . 3 . ]" 1 63 1 133 LEU H 1 140 VAL HB . . 4.320 2.925 2.275 4.053 . 0 0 "[ . 1 . 2 . 3 . ]" 1 64 1 133 LEU H 1 140 VAL QG . . 4.330 3.475 2.911 4.166 . 0 0 "[ . 1 . 2 . 3 . ]" 1 65 1 133 LEU H 1 133 LEU QD . . 4.980 2.763 1.857 3.987 . 0 0 "[ . 1 . 2 . 3 . ]" 1 66 1 57 LEU H 1 57 LEU HB2 . . 3.660 2.434 2.137 2.835 . 0 0 "[ . 1 . 2 . 3 . ]" 1 67 1 56 ASN HA 1 57 LEU H . . 3.030 2.295 2.253 2.429 . 0 0 "[ . 1 . 2 . 3 . ]" 1 68 1 57 LEU H 1 57 LEU QD . . 3.950 2.988 2.215 3.739 . 0 0 "[ . 1 . 2 . 3 . ]" 1 69 1 57 LEU H 1 57 LEU HG . . 4.230 3.665 2.203 4.385 0.155 21 0 "[ . 1 . 2 . 3 . ]" 1 70 1 57 LEU H 1 58 VAL QG . . 4.470 3.136 2.298 3.875 . 0 0 "[ . 1 . 2 . 3 . ]" 1 71 1 56 ASN QB 1 57 LEU H . . 5.020 3.667 3.236 3.944 . 0 0 "[ . 1 . 2 . 3 . ]" 1 72 1 138 ALA H 1 138 ALA MB . . 3.260 2.124 1.934 2.684 . 0 0 "[ . 1 . 2 . 3 . ]" 1 73 1 136 GLY HA3 1 138 ALA H . . 5.500 3.811 3.468 4.844 . 0 0 "[ . 1 . 2 . 3 . ]" 1 74 1 154 MET H 1 154 MET QG . . 3.620 2.521 2.074 3.037 . 0 0 "[ . 1 . 2 . 3 . ]" 1 75 1 141 VAL QG 1 154 MET H . . 4.390 4.535 4.468 4.618 0.228 30 0 "[ . 1 . 2 . 3 . ]" 1 76 1 152 VAL QG 1 154 MET H . . 4.440 2.973 2.816 3.137 . 0 0 "[ . 1 . 2 . 3 . ]" 1 77 1 153 TYR HB3 1 154 MET H . . 4.770 4.169 4.064 4.251 . 0 0 "[ . 1 . 2 . 3 . ]" 1 78 1 93 LEU H 1 93 LEU QB . . 3.190 2.237 1.969 2.937 . 0 0 "[ . 1 . 2 . 3 . ]" 1 79 1 93 LEU H 1 93 LEU QD . . 3.990 3.590 3.326 3.952 . 0 0 "[ . 1 . 2 . 3 . ]" 1 80 1 90 ASN HB3 1 93 LEU H . . 4.880 2.498 1.915 3.571 . 0 0 "[ . 1 . 2 . 3 . ]" 1 81 1 93 LEU H 1 94 LEU HB3 . . 4.810 3.993 3.581 4.413 . 0 0 "[ . 1 . 2 . 3 . ]" 1 82 1 68 VAL H 1 152 VAL HA . . 3.940 3.328 3.136 3.503 . 0 0 "[ . 1 . 2 . 3 . ]" 1 83 1 9 ALA H 1 9 ALA MB . . 3.370 2.167 2.068 2.250 . 0 0 "[ . 1 . 2 . 3 . ]" 1 84 1 100 TYR H 1 100 TYR HB3 . . 3.450 2.439 2.322 2.589 . 0 0 "[ . 1 . 2 . 3 . ]" 1 85 1 8 CYS QB 1 9 ALA H . . 3.740 2.827 2.354 3.178 . 0 0 "[ . 1 . 2 . 3 . ]" 1 86 1 8 CYS H 1 9 ALA H . . 4.170 2.878 2.665 3.092 . 0 0 "[ . 1 . 2 . 3 . ]" 1 87 1 99 THR H 1 100 TYR H . . 3.730 2.919 2.745 3.033 . 0 0 "[ . 1 . 2 . 3 . ]" 1 88 1 100 TYR H 1 120 GLN HB2 . . 4.440 2.583 2.173 3.094 . 0 0 "[ . 1 . 2 . 3 . ]" 1 89 1 100 TYR H 1 120 GLN HB3 . . 4.450 3.742 2.993 4.369 . 0 0 "[ . 1 . 2 . 3 . ]" 1 90 1 100 TYR H 1 100 TYR QD . . 4.450 4.035 3.955 4.071 . 0 0 "[ . 1 . 2 . 3 . ]" 1 91 1 97 ILE HA 1 100 TYR H . . 4.520 3.476 3.341 3.587 . 0 0 "[ . 1 . 2 . 3 . ]" 1 92 1 97 ILE MG 1 100 TYR H . . 4.810 4.651 4.509 4.797 . 0 0 "[ . 1 . 2 . 3 . ]" 1 93 1 100 TYR H 1 101 HIS H . . 3.680 2.678 2.599 2.742 . 0 0 "[ . 1 . 2 . 3 . ]" 1 94 1 99 THR HG1 1 100 TYR H . . 4.530 2.545 1.692 3.544 . 0 0 "[ . 1 . 2 . 3 . ]" 1 95 1 98 LEU HB2 1 100 TYR H . . 5.070 4.947 4.784 5.148 0.078 15 0 "[ . 1 . 2 . 3 . ]" 1 96 1 100 TYR H 1 102 VAL QG . . 5.190 4.195 3.989 4.695 . 0 0 "[ . 1 . 2 . 3 . ]" 1 97 1 42 THR H 1 42 THR MG . . 4.480 3.321 1.931 3.691 . 0 0 "[ . 1 . 2 . 3 . ]" 1 98 1 33 ALA H 1 33 ALA MB . . 3.300 2.066 1.937 2.194 . 0 0 "[ . 1 . 2 . 3 . ]" 1 99 1 41 THR H 1 42 THR H . . 3.800 2.999 2.881 3.088 . 0 0 "[ . 1 . 2 . 3 . ]" 1 100 1 41 THR HB 1 42 THR H . . 4.400 3.579 2.853 3.928 . 0 0 "[ . 1 . 2 . 3 . ]" 1 101 1 41 THR MG 1 42 THR H . . 4.930 4.127 3.784 4.305 . 0 0 "[ . 1 . 2 . 3 . ]" 1 102 1 32 VAL H 1 33 ALA H . . 3.370 3.128 2.843 3.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 103 1 33 ALA H 1 147 THR MG . . 4.190 4.122 3.742 4.325 0.135 13 0 "[ . 1 . 2 . 3 . ]" 1 104 1 32 VAL MG1 1 33 ALA H . . 4.280 3.296 2.826 3.892 . 0 0 "[ . 1 . 2 . 3 . ]" 1 105 1 30 VAL HA 1 33 ALA H . . 4.530 3.876 3.673 4.421 . 0 0 "[ . 1 . 2 . 3 . ]" 1 106 1 29 PRO HD3 1 33 ALA H . . 5.120 5.057 4.470 5.276 0.156 5 0 "[ . 1 . 2 . 3 . ]" 1 107 1 134 LYS H 1 134 LYS HB2 . . 3.580 2.579 2.399 2.678 . 0 0 "[ . 1 . 2 . 3 . ]" 1 108 1 126 VAL MG1 1 134 LYS H . . 4.400 3.759 3.371 4.189 . 0 0 "[ . 1 . 2 . 3 . ]" 1 109 1 133 LEU QD 1 134 LYS H . . 4.380 3.429 2.260 4.130 . 0 0 "[ . 1 . 2 . 3 . ]" 1 110 1 100 TYR H 1 100 TYR HB2 . . 3.890 2.210 2.079 2.329 . 0 0 "[ . 1 . 2 . 3 . ]" 1 111 1 118 THR MG 1 124 VAL H . . 3.970 3.171 2.620 3.945 . 0 0 "[ . 1 . 2 . 3 . ]" 1 112 1 43 LEU H 1 43 LEU QD . . 4.170 3.148 2.810 3.661 . 0 0 "[ . 1 . 2 . 3 . ]" 1 113 1 43 LEU H 1 76 PHE QE . . 4.460 3.298 2.868 3.702 . 0 0 "[ . 1 . 2 . 3 . ]" 1 114 1 40 LEU QD 1 43 LEU H . . 5.010 4.322 4.100 4.661 . 0 0 "[ . 1 . 2 . 3 . ]" 1 115 1 124 VAL HA 1 125 THR H . . 3.070 2.203 2.182 2.244 . 0 0 "[ . 1 . 2 . 3 . ]" 1 116 1 125 THR H 1 125 THR HB . . 3.450 2.259 2.168 2.342 . 0 0 "[ . 1 . 2 . 3 . ]" 1 117 1 124 VAL QG 1 125 THR H . . 3.630 3.050 2.452 3.527 . 0 0 "[ . 1 . 2 . 3 . ]" 1 118 1 125 THR H 1 125 THR MG . . 4.590 3.671 3.640 3.707 . 0 0 "[ . 1 . 2 . 3 . ]" 1 119 1 124 VAL HB 1 125 THR H . . 4.650 4.309 3.942 4.523 . 0 0 "[ . 1 . 2 . 3 . ]" 1 120 1 73 ASN HB2 1 74 ALA H . . 3.830 3.357 2.191 3.976 0.146 30 0 "[ . 1 . 2 . 3 . ]" 1 121 1 74 ALA H 1 75 ALA H . . 3.770 2.349 1.878 2.764 . 0 0 "[ . 1 . 2 . 3 . ]" 1 122 1 74 ALA H 1 74 ALA MB . . 3.260 2.140 1.945 2.352 . 0 0 "[ . 1 . 2 . 3 . ]" 1 123 1 72 THR HB 1 74 ALA H . . 3.960 2.819 2.531 3.389 . 0 0 "[ . 1 . 2 . 3 . ]" 1 124 1 72 THR HG1 1 74 ALA H . . 4.840 2.826 1.936 4.318 . 0 0 "[ . 1 . 2 . 3 . ]" 1 125 1 74 ALA H 1 75 ALA MB . . 5.220 3.902 3.506 4.349 . 0 0 "[ . 1 . 2 . 3 . ]" 1 126 1 136 GLY HA3 1 137 ASN H . . 3.420 3.227 2.384 3.643 0.223 27 0 "[ . 1 . 2 . 3 . ]" 1 127 1 137 ASN H 1 137 ASN HB2 . . 3.860 3.189 2.634 3.611 . 0 0 "[ . 1 . 2 . 3 . ]" 1 128 1 137 ASN H 1 138 ALA MB . . 4.410 3.997 3.071 4.564 0.154 8 0 "[ . 1 . 2 . 3 . ]" 1 129 1 30 VAL H 1 30 VAL HB . . 3.280 2.679 2.115 3.311 0.031 31 0 "[ . 1 . 2 . 3 . ]" 1 130 1 30 VAL H 1 30 VAL QG . . 3.480 2.710 1.668 3.047 . 0 0 "[ . 1 . 2 . 3 . ]" 1 131 1 29 PRO HA 1 30 VAL H . . 3.340 2.231 2.184 2.371 . 0 0 "[ . 1 . 2 . 3 . ]" 1 132 1 30 VAL H 1 148 ALA MB . . 4.320 2.344 1.877 3.320 . 0 0 "[ . 1 . 2 . 3 . ]" 1 133 1 29 PRO HB3 1 30 VAL H . . 4.700 4.130 3.484 4.416 . 0 0 "[ . 1 . 2 . 3 . ]" 1 134 1 122 ALA H 1 122 ALA MB . . 3.250 2.139 1.937 2.274 . 0 0 "[ . 1 . 2 . 3 . ]" 1 135 1 135 VAL H 1 135 VAL HB . . 3.350 2.764 2.559 2.952 . 0 0 "[ . 1 . 2 . 3 . ]" 1 136 1 120 GLN HG3 1 122 ALA H . . 4.390 3.570 2.480 4.535 0.145 15 0 "[ . 1 . 2 . 3 . ]" 1 137 1 120 GLN HE21 1 122 ALA H . . 4.670 4.123 3.420 5.353 0.683 10 1 "[ . + . 2 . 3 . ]" 1 138 1 90 ASN H 1 90 ASN HB2 . . 3.680 2.595 2.395 2.860 . 0 0 "[ . 1 . 2 . 3 . ]" 1 139 1 106 GLN H 1 106 GLN HB2 . . 3.560 2.340 2.019 3.289 . 0 0 "[ . 1 . 2 . 3 . ]" 1 140 1 90 ASN H 1 90 ASN HB3 . . 3.640 3.651 3.515 3.771 0.131 11 0 "[ . 1 . 2 . 3 . ]" 1 141 1 87 LEU HA 1 90 ASN H . . 4.420 3.326 2.970 3.737 . 0 0 "[ . 1 . 2 . 3 . ]" 1 142 1 89 THR MG 1 90 ASN H . . 4.840 3.322 1.952 4.444 . 0 0 "[ . 1 . 2 . 3 . ]" 1 143 1 90 ASN H 1 90 ASN HD21 . . 4.780 4.016 3.416 4.513 . 0 0 "[ . 1 . 2 . 3 . ]" 1 144 1 86 GLU QG 1 90 ASN H . . 4.880 4.538 3.552 4.939 0.059 6 0 "[ . 1 . 2 . 3 . ]" 1 145 1 89 THR HB 1 90 ASN H . . 5.110 4.369 3.686 4.716 . 0 0 "[ . 1 . 2 . 3 . ]" 1 146 1 106 GLN H 1 106 GLN QG . . 3.600 3.424 3.053 3.731 0.131 34 0 "[ . 1 . 2 . 3 . ]" 1 147 1 131 ASN H 1 131 ASN HA . . 2.810 2.665 2.167 2.917 0.107 14 0 "[ . 1 . 2 . 3 . ]" 1 148 1 131 ASN H 1 132 SER H . . 4.720 3.453 2.108 4.531 . 0 0 "[ . 1 . 2 . 3 . ]" 1 149 1 75 ALA H 1 75 ALA MB . . 3.360 2.189 2.116 2.342 . 0 0 "[ . 1 . 2 . 3 . ]" 1 150 1 37 ASN H 1 37 ASN HB3 . . 3.450 3.182 2.581 3.556 0.106 5 0 "[ . 1 . 2 . 3 . ]" 1 151 1 37 ASN H 1 37 ASN HB2 . . 3.360 2.160 2.028 2.482 . 0 0 "[ . 1 . 2 . 3 . ]" 1 152 1 158 VAL H 1 158 VAL HB . . 3.350 2.656 2.221 3.550 0.200 18 0 "[ . 1 . 2 . 3 . ]" 1 153 1 83 THR HB 1 84 ILE H . . 3.750 2.851 2.689 3.000 . 0 0 "[ . 1 . 2 . 3 . ]" 1 154 1 83 THR MG 1 84 ILE H . . 4.760 2.807 2.586 2.932 . 0 0 "[ . 1 . 2 . 3 . ]" 1 155 1 72 THR HG1 1 75 ALA H . . 4.490 2.948 1.919 4.177 . 0 0 "[ . 1 . 2 . 3 . ]" 1 156 1 158 VAL H 1 158 VAL QG . . 3.560 2.191 1.763 2.536 . 0 0 "[ . 1 . 2 . 3 . ]" 1 157 1 157 SER HB2 1 158 VAL H . . 4.610 3.855 3.493 4.496 . 0 0 "[ . 1 . 2 . 3 . ]" 1 158 1 79 LEU QD 1 158 VAL H . . 4.820 3.419 2.844 3.828 . 0 0 "[ . 1 . 2 . 3 . ]" 1 159 1 37 ASN H 1 40 LEU HB2 . . 4.430 3.563 3.134 4.178 . 0 0 "[ . 1 . 2 . 3 . ]" 1 160 1 37 ASN H 1 40 LEU QD . . 4.440 3.806 3.191 4.478 0.038 5 0 "[ . 1 . 2 . 3 . ]" 1 161 1 34 ALA HA 1 37 ASN H . . 4.160 3.000 2.443 3.395 . 0 0 "[ . 1 . 2 . 3 . ]" 1 162 1 37 ASN H 1 40 LEU HG . . 4.400 4.328 3.687 4.592 0.192 23 0 "[ . 1 . 2 . 3 . ]" 1 163 1 37 ASN H 1 37 ASN HD21 . . 4.740 4.100 1.837 4.995 0.255 33 0 "[ . 1 . 2 . 3 . ]" 1 164 1 36 ASN HB2 1 37 ASN H . . 4.620 2.824 2.348 4.014 . 0 0 "[ . 1 . 2 . 3 . ]" 1 165 1 35 SER HA 1 37 ASN H . . 4.710 4.498 4.041 4.741 0.031 4 0 "[ . 1 . 2 . 3 . ]" 1 166 1 84 ILE H 1 84 ILE HB . . 3.360 2.486 2.465 2.544 . 0 0 "[ . 1 . 2 . 3 . ]" 1 167 1 84 ILE H 1 84 ILE MD . . 4.020 3.091 2.872 3.202 . 0 0 "[ . 1 . 2 . 3 . ]" 1 168 1 118 THR HB 1 119 LEU H . . 3.310 2.727 2.311 3.156 . 0 0 "[ . 1 . 2 . 3 . ]" 1 169 1 119 LEU H 1 119 LEU QB . . 3.550 2.106 1.959 2.388 . 0 0 "[ . 1 . 2 . 3 . ]" 1 170 1 118 THR MG 1 119 LEU H . . 4.410 3.938 3.658 4.167 . 0 0 "[ . 1 . 2 . 3 . ]" 1 171 1 103 VAL HA 1 119 LEU H . . 4.300 2.267 1.868 2.916 . 0 0 "[ . 1 . 2 . 3 . ]" 1 172 1 119 LEU H 1 119 LEU QD . . 4.420 3.062 2.228 3.662 . 0 0 "[ . 1 . 2 . 3 . ]" 1 173 1 30 VAL QG 1 31 ALA H . . 3.390 1.732 1.582 2.249 . 0 0 "[ . 1 . 2 . 3 . ]" 1 174 1 31 ALA H 1 31 ALA MB . . 3.300 2.180 2.031 2.338 . 0 0 "[ . 1 . 2 . 3 . ]" 1 175 1 30 VAL HB 1 31 ALA H . . 5.040 3.543 3.342 4.005 . 0 0 "[ . 1 . 2 . 3 . ]" 1 176 1 139 ASP H 1 139 ASP HB3 . . 3.490 3.658 3.509 3.764 0.274 31 0 "[ . 1 . 2 . 3 . ]" 1 177 1 138 ALA HA 1 139 ASP H . . 3.060 2.584 2.471 2.763 . 0 0 "[ . 1 . 2 . 3 . ]" 1 178 1 138 ALA MB 1 139 ASP H . . 3.680 2.440 2.222 2.617 . 0 0 "[ . 1 . 2 . 3 . ]" 1 179 1 139 ASP H 1 139 ASP HB2 . . 3.880 2.548 2.350 2.798 . 0 0 "[ . 1 . 2 . 3 . ]" 1 180 1 58 VAL H 1 58 VAL QG . . 3.280 2.138 1.707 2.742 . 0 0 "[ . 1 . 2 . 3 . ]" 1 181 1 58 VAL H 1 58 VAL HB . . 3.390 2.424 2.033 2.834 . 0 0 "[ . 1 . 2 . 3 . ]" 1 182 1 55 VAL H 1 55 VAL QG . . 3.600 2.626 1.977 3.141 . 0 0 "[ . 1 . 2 . 3 . ]" 1 183 1 11 TYR H 1 11 TYR HB2 . . 3.710 2.287 2.149 2.587 . 0 0 "[ . 1 . 2 . 3 . ]" 1 184 1 51 LEU H 1 51 LEU QB . . 3.650 2.159 1.982 2.402 . 0 0 "[ . 1 . 2 . 3 . ]" 1 185 1 45 ALA MB 1 51 LEU H . . 4.190 2.907 2.429 3.272 . 0 0 "[ . 1 . 2 . 3 . ]" 1 186 1 83 THR H 1 83 THR MG . . 4.330 3.545 3.502 3.593 . 0 0 "[ . 1 . 2 . 3 . ]" 1 187 1 145 VAL H 1 145 VAL MG2 . . 3.380 1.998 1.830 2.288 . 0 0 "[ . 1 . 2 . 3 . ]" 1 188 1 145 VAL H 1 145 VAL HB . . 3.180 2.710 2.555 2.820 . 0 0 "[ . 1 . 2 . 3 . ]" 1 189 1 145 VAL H 1 152 VAL QG . . 3.860 3.010 2.857 3.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 190 1 57 LEU H 1 58 VAL H . . 3.490 2.059 1.800 2.543 . 0 0 "[ . 1 . 2 . 3 . ]" 1 191 1 48 SER HA 1 58 VAL H . . 3.730 2.890 2.048 3.599 . 0 0 "[ . 1 . 2 . 3 . ]" 1 192 1 55 VAL H 1 56 ASN QB . . 4.640 4.566 4.506 4.653 0.013 19 0 "[ . 1 . 2 . 3 . ]" 1 193 1 53 PRO HA 1 55 VAL H . . 4.320 3.540 3.371 3.771 . 0 0 "[ . 1 . 2 . 3 . ]" 1 194 1 10 GLU H 1 11 TYR H . . 3.690 2.899 2.415 3.101 . 0 0 "[ . 1 . 2 . 3 . ]" 1 195 1 11 TYR H 1 11 TYR HB3 . . 3.260 2.449 2.089 2.663 . 0 0 "[ . 1 . 2 . 3 . ]" 1 196 1 11 TYR H 1 12 ALA H . . 3.620 3.191 2.767 3.318 . 0 0 "[ . 1 . 2 . 3 . ]" 1 197 1 11 TYR H 1 11 TYR QR . . 4.190 4.001 3.924 4.055 . 0 0 "[ . 1 . 2 . 3 . ]" 1 198 1 9 ALA MB 1 11 TYR H . . 4.340 4.319 4.173 4.410 0.070 25 0 "[ . 1 . 2 . 3 . ]" 1 199 1 10 GLU QB 1 11 TYR H . . 4.020 2.510 2.352 2.703 . 0 0 "[ . 1 . 2 . 3 . ]" 1 200 1 8 CYS HA 1 11 TYR H . . 4.410 4.038 3.126 4.404 . 0 0 "[ . 1 . 2 . 3 . ]" 1 201 1 10 GLU QG 1 11 TYR H . . 4.880 4.252 3.967 4.546 . 0 0 "[ . 1 . 2 . 3 . ]" 1 202 1 51 LEU H 1 52 ASN H . . 3.570 2.415 1.997 2.928 . 0 0 "[ . 1 . 2 . 3 . ]" 1 203 1 51 LEU H 1 51 LEU QD . . 4.260 3.458 3.071 3.746 . 0 0 "[ . 1 . 2 . 3 . ]" 1 204 1 50 GLN HB2 1 51 LEU H . . 4.290 2.836 2.262 3.253 . 0 0 "[ . 1 . 2 . 3 . ]" 1 205 1 46 ALA HA 1 51 LEU H . . 4.150 3.115 2.792 3.489 . 0 0 "[ . 1 . 2 . 3 . ]" 1 206 1 50 GLN HG3 1 51 LEU H . . 4.420 4.344 3.934 4.451 0.031 27 0 "[ . 1 . 2 . 3 . ]" 1 207 1 25 MET H 1 25 MET HB3 . . 3.620 2.420 2.133 2.798 . 0 0 "[ . 1 . 2 . 3 . ]" 1 208 1 25 MET H 1 25 MET HB2 . . 3.940 3.551 3.436 3.698 . 0 0 "[ . 1 . 2 . 3 . ]" 1 209 1 86 GLU H 1 86 GLU HB2 . . 3.290 2.407 2.230 2.712 . 0 0 "[ . 1 . 2 . 3 . ]" 1 210 1 86 GLU H 1 87 LEU HG . . 4.160 3.930 3.524 4.220 0.060 20 0 "[ . 1 . 2 . 3 . ]" 1 211 1 12 ALA H 1 12 ALA MB . . 3.160 2.033 1.944 2.171 . 0 0 "[ . 1 . 2 . 3 . ]" 1 212 1 11 TYR QR 1 12 ALA H . . 4.130 2.740 1.930 3.096 . 0 0 "[ . 1 . 2 . 3 . ]" 1 213 1 11 TYR HB2 1 12 ALA H . . 4.200 3.554 3.437 3.785 . 0 0 "[ . 1 . 2 . 3 . ]" 1 214 1 83 THR H 1 83 THR HB . . 3.350 2.038 2.005 2.089 . 0 0 "[ . 1 . 2 . 3 . ]" 1 215 1 80 PRO HB3 1 83 THR H . . 4.680 4.674 4.527 4.933 0.253 6 0 "[ . 1 . 2 . 3 . ]" 1 216 1 84 ILE H 1 84 ILE HG12 . . 3.820 1.915 1.804 1.946 . 0 0 "[ . 1 . 2 . 3 . ]" 1 217 1 144 GLY H 1 145 VAL H . . 3.430 2.391 2.234 2.685 . 0 0 "[ . 1 . 2 . 3 . ]" 1 218 1 145 VAL H 1 153 TYR HA . . 4.640 4.276 4.130 4.441 . 0 0 "[ . 1 . 2 . 3 . ]" 1 219 1 25 MET H 1 25 MET HG2 . . 3.680 2.314 2.084 2.720 . 0 0 "[ . 1 . 2 . 3 . ]" 1 220 1 25 MET H 1 25 MET HG3 . . 4.090 3.366 3.044 3.805 . 0 0 "[ . 1 . 2 . 3 . ]" 1 221 1 23 GLN HA 1 25 MET H . . 5.100 4.093 3.428 4.969 . 0 0 "[ . 1 . 2 . 3 . ]" 1 222 1 25 MET H 1 33 ALA MB . . 5.500 4.633 4.477 4.805 . 0 0 "[ . 1 . 2 . 3 . ]" 1 223 1 22 VAL H 1 22 VAL HB . . 3.600 2.841 2.149 3.611 0.011 18 0 "[ . 1 . 2 . 3 . ]" 1 224 1 22 VAL H 1 22 VAL QG . . 3.490 2.172 1.846 2.672 . 0 0 "[ . 1 . 2 . 3 . ]" 1 225 1 21 SER HA 1 22 VAL H . . 3.620 2.619 2.427 2.914 . 0 0 "[ . 1 . 2 . 3 . ]" 1 226 1 21 SER HB2 1 22 VAL H . . 3.980 2.512 1.919 3.741 . 0 0 "[ . 1 . 2 . 3 . ]" 1 227 1 21 SER HB3 1 22 VAL H . . 4.620 3.302 1.918 3.835 . 0 0 "[ . 1 . 2 . 3 . ]" 1 228 1 11 TYR QR 1 22 VAL H . . 5.120 3.707 3.265 4.307 . 0 0 "[ . 1 . 2 . 3 . ]" 1 229 1 22 VAL H 1 25 MET ME . . 5.460 3.834 3.407 4.366 . 0 0 "[ . 1 . 2 . 3 . ]" 1 230 1 147 THR HB 1 148 ALA H . . 3.110 2.041 1.914 2.265 . 0 0 "[ . 1 . 2 . 3 . ]" 1 231 1 148 ALA H 1 148 ALA MB . . 3.270 2.242 2.129 2.390 . 0 0 "[ . 1 . 2 . 3 . ]" 1 232 1 29 PRO HA 1 148 ALA H . . 4.720 3.748 2.744 4.238 . 0 0 "[ . 1 . 2 . 3 . ]" 1 233 1 147 THR MG 1 148 ALA H . . 4.560 3.598 3.538 3.655 . 0 0 "[ . 1 . 2 . 3 . ]" 1 234 1 86 GLU H 1 87 LEU H . . 3.270 2.433 2.200 2.706 . 0 0 "[ . 1 . 2 . 3 . ]" 1 235 1 85 ASP HB2 1 86 GLU H . . 3.680 3.549 2.990 4.180 0.500 12 1 "[ . 1 + . 2 . 3 . ]" 1 236 1 86 GLU H 1 86 GLU HB3 . . 3.790 2.679 2.402 2.854 . 0 0 "[ . 1 . 2 . 3 . ]" 1 237 1 112 VAL H 1 112 VAL QG . . 3.330 2.288 1.620 2.789 . 0 0 "[ . 1 . 2 . 3 . ]" 1 238 1 112 VAL H 1 112 VAL HB . . 3.300 2.451 2.022 3.311 0.011 10 0 "[ . 1 . 2 . 3 . ]" 1 239 1 111 ASN HB2 1 112 VAL H . . 5.270 2.822 2.314 3.260 . 0 0 "[ . 1 . 2 . 3 . ]" 1 240 1 61 LEU H 1 61 LEU HB3 . . 3.940 3.539 3.487 3.599 . 0 0 "[ . 1 . 2 . 3 . ]" 1 241 1 61 LEU H 1 61 LEU HB2 . . 3.270 2.430 2.220 2.712 . 0 0 "[ . 1 . 2 . 3 . ]" 1 242 1 61 LEU H 1 61 LEU QD . . 4.460 2.340 1.768 3.433 . 0 0 "[ . 1 . 2 . 3 . ]" 1 243 1 60 THR MG 1 61 LEU H . . 4.230 3.204 2.759 4.103 . 0 0 "[ . 1 . 2 . 3 . ]" 1 244 1 60 THR HB 1 61 LEU H . . 3.850 2.441 2.142 3.424 . 0 0 "[ . 1 . 2 . 3 . ]" 1 245 1 28 ASP H 1 28 ASP HB2 . . 3.460 2.407 2.242 2.781 . 0 0 "[ . 1 . 2 . 3 . ]" 1 246 1 28 ASP H 1 28 ASP HB3 . . 4.190 3.553 3.352 3.835 . 0 0 "[ . 1 . 2 . 3 . ]" 1 247 1 28 ASP H 1 29 PRO HD3 . . 4.700 4.725 4.608 4.821 0.121 29 0 "[ . 1 . 2 . 3 . ]" 1 248 1 27 GLN HB3 1 28 ASP H . . 5.030 4.123 3.780 4.462 . 0 0 "[ . 1 . 2 . 3 . ]" 1 249 1 72 THR HB 1 73 ASN H . . 3.440 2.186 1.868 2.552 . 0 0 "[ . 1 . 2 . 3 . ]" 1 250 1 73 ASN H 1 73 ASN HB2 . . 3.840 2.591 2.105 3.551 . 0 0 "[ . 1 . 2 . 3 . ]" 1 251 1 72 THR MG 1 73 ASN H . . 4.130 3.689 3.489 3.862 . 0 0 "[ . 1 . 2 . 3 . ]" 1 252 1 39 GLU HG2 1 73 ASN H . . 4.630 4.437 4.013 4.720 0.090 20 0 "[ . 1 . 2 . 3 . ]" 1 253 1 40 LEU HA 1 73 ASN H . . 5.400 5.243 4.672 5.544 0.144 12 0 "[ . 1 . 2 . 3 . ]" 1 254 1 95 THR HB 1 96 SER H . . 3.700 3.054 2.573 3.773 0.073 1 0 "[ . 1 . 2 . 3 . ]" 1 255 1 95 THR MG 1 96 SER H . . 4.220 2.862 1.808 3.932 . 0 0 "[ . 1 . 2 . 3 . ]" 1 256 1 96 SER H 1 97 ILE HB . . 4.560 4.649 4.572 4.758 0.198 13 0 "[ . 1 . 2 . 3 . ]" 1 257 1 2 ASP HA 1 3 LEU H . . 3.170 2.507 2.252 3.007 . 0 0 "[ . 1 . 2 . 3 . ]" 1 258 1 3 LEU H 1 3 LEU HB2 . . 3.130 2.584 2.138 3.238 0.108 31 0 "[ . 1 . 2 . 3 . ]" 1 259 1 3 LEU H 1 3 LEU QD . . 4.200 2.572 1.889 3.525 . 0 0 "[ . 1 . 2 . 3 . ]" 1 260 1 2 ASP HB2 1 3 LEU H . . 4.530 3.851 2.210 4.727 0.197 24 0 "[ . 1 . 2 . 3 . ]" 1 261 1 3 LEU H 1 3 LEU HB3 . . 4.070 3.685 3.441 3.994 . 0 0 "[ . 1 . 2 . 3 . ]" 1 262 1 120 GLN H 1 120 GLN HB2 . . 3.520 2.402 2.075 2.762 . 0 0 "[ . 1 . 2 . 3 . ]" 1 263 1 120 GLN H 1 120 GLN HB3 . . 3.700 2.608 2.243 3.124 . 0 0 "[ . 1 . 2 . 3 . ]" 1 264 1 119 LEU HG 1 120 GLN H . . 4.280 3.523 2.383 4.580 0.300 29 0 "[ . 1 . 2 . 3 . ]" 1 265 1 119 LEU QB 1 120 GLN H . . 4.290 3.230 2.203 3.741 . 0 0 "[ . 1 . 2 . 3 . ]" 1 266 1 126 VAL HA 1 127 THR H . . 3.110 2.359 2.261 2.481 . 0 0 "[ . 1 . 2 . 3 . ]" 1 267 1 126 VAL MG1 1 127 THR H . . 3.610 2.042 1.846 2.329 . 0 0 "[ . 1 . 2 . 3 . ]" 1 268 1 127 THR H 1 127 THR MG . . 4.150 2.987 2.171 4.019 . 0 0 "[ . 1 . 2 . 3 . ]" 1 269 1 127 THR H 1 135 VAL HA . . 4.240 3.338 2.422 3.887 . 0 0 "[ . 1 . 2 . 3 . ]" 1 270 1 127 THR H 1 128 GLY H . . 5.270 4.385 4.350 4.422 . 0 0 "[ . 1 . 2 . 3 . ]" 1 271 1 127 THR H 1 134 LYS H . . 4.120 2.850 2.249 3.509 . 0 0 "[ . 1 . 2 . 3 . ]" 1 272 1 127 THR H 1 134 LYS HB2 . . 4.600 3.982 3.389 4.432 . 0 0 "[ . 1 . 2 . 3 . ]" 1 273 1 115 THR H 1 115 THR HB . . 3.160 2.457 2.112 2.853 . 0 0 "[ . 1 . 2 . 3 . ]" 1 274 1 43 LEU HA 1 46 ALA H . . 4.190 3.491 3.352 3.713 . 0 0 "[ . 1 . 2 . 3 . ]" 1 275 1 46 ALA H 1 47 LEU H . . 3.680 2.942 2.899 3.016 . 0 0 "[ . 1 . 2 . 3 . ]" 1 276 1 46 ALA H 1 51 LEU QD . . 4.460 3.355 2.896 4.050 . 0 0 "[ . 1 . 2 . 3 . ]" 1 277 1 79 LEU H 1 79 LEU HB3 . . 3.770 3.543 3.471 3.731 . 0 0 "[ . 1 . 2 . 3 . ]" 1 278 1 79 LEU H 1 79 LEU HB2 . . 3.440 2.600 2.302 2.953 . 0 0 "[ . 1 . 2 . 3 . ]" 1 279 1 115 THR H 1 115 THR MG . . 4.440 3.481 1.864 3.934 . 0 0 "[ . 1 . 2 . 3 . ]" 1 280 1 90 ASN HA 1 91 SER H . . 3.440 3.296 2.433 3.653 0.213 4 0 "[ . 1 . 2 . 3 . ]" 1 281 1 9 ALA MB 1 10 GLU H . . 3.430 2.002 1.898 2.351 . 0 0 "[ . 1 . 2 . 3 . ]" 1 282 1 10 GLU H 1 10 GLU QB . . 3.400 2.126 1.997 2.533 . 0 0 "[ . 1 . 2 . 3 . ]" 1 283 1 10 GLU H 1 10 GLU QG . . 4.260 3.367 1.939 3.973 . 0 0 "[ . 1 . 2 . 3 . ]" 1 284 1 8 CYS H 1 8 CYS QB . . 3.260 2.033 2.006 2.062 . 0 0 "[ . 1 . 2 . 3 . ]" 1 285 1 7 GLY H 1 8 CYS H . . 3.530 2.944 2.680 3.162 . 0 0 "[ . 1 . 2 . 3 . ]" 1 286 1 8 CYS H 1 142 CYS HB3 . . 4.310 3.907 3.505 4.129 . 0 0 "[ . 1 . 2 . 3 . ]" 1 287 1 8 CYS H 1 142 CYS HA . . 4.830 3.201 2.775 3.808 . 0 0 "[ . 1 . 2 . 3 . ]" 1 288 1 113 VAL H 1 113 VAL QG . . 3.240 2.078 1.870 2.451 . 0 0 "[ . 1 . 2 . 3 . ]" 1 289 1 113 VAL H 1 113 VAL HB . . 3.220 2.405 2.173 2.578 . 0 0 "[ . 1 . 2 . 3 . ]" 1 290 1 112 VAL QG 1 113 VAL H . . 4.490 2.487 2.006 2.827 . 0 0 "[ . 1 . 2 . 3 . ]" 1 291 1 66 TYR HB3 1 67 THR H . . 3.660 2.039 1.917 2.234 . 0 0 "[ . 1 . 2 . 3 . ]" 1 292 1 66 TYR HA 1 67 THR H . . 3.370 2.714 2.613 2.790 . 0 0 "[ . 1 . 2 . 3 . ]" 1 293 1 67 THR H 1 67 THR MG . . 4.140 3.980 3.916 3.997 . 0 0 "[ . 1 . 2 . 3 . ]" 1 294 1 67 THR H 1 67 THR HG1 . . 4.330 3.556 2.763 4.157 . 0 0 "[ . 1 . 2 . 3 . ]" 1 295 1 66 TYR HB2 1 67 THR H . . 4.170 3.427 3.121 3.673 . 0 0 "[ . 1 . 2 . 3 . ]" 1 296 1 67 THR H 1 69 PHE QD . . 4.470 4.601 4.515 4.687 0.217 16 0 "[ . 1 . 2 . 3 . ]" 1 297 1 67 THR H 1 103 VAL HA . . 4.890 4.525 4.249 4.669 . 0 0 "[ . 1 . 2 . 3 . ]" 1 298 1 23 GLN H 1 23 GLN HB2 . . 3.370 3.111 2.430 3.643 0.273 26 0 "[ . 1 . 2 . 3 . ]" 1 299 1 22 VAL H 1 23 GLN H . . 4.210 2.617 2.150 3.333 . 0 0 "[ . 1 . 2 . 3 . ]" 1 300 1 23 GLN H 1 23 GLN HB3 . . 3.590 2.675 2.325 3.596 0.006 35 0 "[ . 1 . 2 . 3 . ]" 1 301 1 23 GLN H 1 24 GLY H . . 4.050 2.316 1.894 2.929 . 0 0 "[ . 1 . 2 . 3 . ]" 1 302 1 22 VAL QG 1 23 GLN H . . 4.280 2.855 1.920 3.634 . 0 0 "[ . 1 . 2 . 3 . ]" 1 303 1 23 GLN H 1 23 GLN HG3 . . 4.890 3.723 1.913 4.920 0.030 37 0 "[ . 1 . 2 . 3 . ]" 1 304 1 23 GLN H 1 23 GLN HG2 . . 5.500 3.509 1.938 5.026 . 0 0 "[ . 1 . 2 . 3 . ]" 1 305 1 154 MET HB3 1 155 ILE H . . 4.250 3.139 2.766 3.770 . 0 0 "[ . 1 . 2 . 3 . ]" 1 306 1 139 ASP HA 1 140 VAL H . . 3.090 2.265 2.252 2.641 . 0 0 "[ . 1 . 2 . 3 . ]" 1 307 1 140 VAL H 1 140 VAL HB . . 3.310 2.394 2.283 2.596 . 0 0 "[ . 1 . 2 . 3 . ]" 1 308 1 139 ASP HB2 1 140 VAL H . . 4.110 4.325 3.728 4.574 0.464 27 0 "[ . 1 . 2 . 3 . ]" 1 309 1 140 VAL H 1 140 VAL QG . . 3.730 2.221 1.987 2.712 . 0 0 "[ . 1 . 2 . 3 . ]" 1 310 1 140 VAL H 1 141 VAL H . . 5.280 4.413 3.997 4.631 . 0 0 "[ . 1 . 2 . 3 . ]" 1 311 1 133 LEU HB2 1 140 VAL H . . 4.700 4.051 3.639 4.433 . 0 0 "[ . 1 . 2 . 3 . ]" 1 312 1 155 ILE H 1 155 ILE MD . . 3.710 2.825 1.722 3.808 0.098 15 0 "[ . 1 . 2 . 3 . ]" 1 313 1 72 THR MG 1 155 ILE H . . 4.430 2.534 2.101 3.661 . 0 0 "[ . 1 . 2 . 3 . ]" 1 314 1 150 ALA H 1 150 ALA MB . . 3.600 2.854 2.682 2.924 . 0 0 "[ . 1 . 2 . 3 . ]" 1 315 1 32 VAL H 1 32 VAL MG2 . . 3.400 1.955 1.830 2.240 . 0 0 "[ . 1 . 2 . 3 . ]" 1 316 1 32 VAL H 1 32 VAL MG1 . . 4.740 3.710 3.662 3.733 . 0 0 "[ . 1 . 2 . 3 . ]" 1 317 1 32 VAL H 1 32 VAL HB . . 3.390 2.601 2.472 2.777 . 0 0 "[ . 1 . 2 . 3 . ]" 1 318 1 31 ALA MB 1 32 VAL H . . 3.750 2.020 1.800 2.240 . 0 0 "[ . 1 . 2 . 3 . ]" 1 319 1 30 VAL QG 1 150 ALA H . . 4.360 4.084 3.007 4.289 . 0 0 "[ . 1 . 2 . 3 . ]" 1 320 1 30 VAL HA 1 150 ALA H . . 5.010 4.953 4.481 5.163 0.153 16 0 "[ . 1 . 2 . 3 . ]" 1 321 1 31 ALA H 1 32 VAL H . . 3.550 3.580 3.389 3.686 0.136 9 0 "[ . 1 . 2 . 3 . ]" 1 322 1 149 ASN H 1 150 ALA H . . 3.200 2.565 2.105 3.044 . 0 0 "[ . 1 . 2 . 3 . ]" 1 323 1 142 CYS HA 1 143 GLY H . . 3.190 2.243 2.222 2.279 . 0 0 "[ . 1 . 2 . 3 . ]" 1 324 1 4 VAL QG 1 143 GLY H . . 4.100 2.275 1.792 2.635 . 0 0 "[ . 1 . 2 . 3 . ]" 1 325 1 143 GLY H 1 153 TYR HA . . 4.930 4.235 4.136 4.278 . 0 0 "[ . 1 . 2 . 3 . ]" 1 326 1 4 VAL HA 1 143 GLY H . . 5.500 5.028 4.361 5.639 0.139 34 0 "[ . 1 . 2 . 3 . ]" 1 327 1 142 CYS HB3 1 143 GLY H . . 5.460 4.544 4.413 4.594 . 0 0 "[ . 1 . 2 . 3 . ]" 1 328 1 86 GLU HB3 1 87 LEU H . . 3.290 2.619 2.429 2.857 . 0 0 "[ . 1 . 2 . 3 . ]" 1 329 1 87 LEU H 1 87 LEU HG . . 3.220 2.162 1.971 2.343 . 0 0 "[ . 1 . 2 . 3 . ]" 1 330 1 87 LEU H 1 87 LEU MD2 . . 3.680 2.217 2.039 2.536 . 0 0 "[ . 1 . 2 . 3 . ]" 1 331 1 87 LEU H 1 87 LEU HB3 . . 4.020 3.529 3.502 3.544 . 0 0 "[ . 1 . 2 . 3 . ]" 1 332 1 84 ILE HA 1 87 LEU H . . 4.260 3.050 2.816 3.204 . 0 0 "[ . 1 . 2 . 3 . ]" 1 333 1 13 ALA H 1 13 ALA MB . . 2.950 2.076 1.977 2.176 . 0 0 "[ . 1 . 2 . 3 . ]" 1 334 1 66 TYR H 1 66 TYR HB2 . . 3.930 2.242 2.170 2.552 . 0 0 "[ . 1 . 2 . 3 . ]" 1 335 1 14 ALA H 1 14 ALA MB . . 3.140 2.116 1.946 2.269 . 0 0 "[ . 1 . 2 . 3 . ]" 1 336 1 36 ASN H 1 36 ASN HB2 . . 3.580 2.633 2.221 2.983 . 0 0 "[ . 1 . 2 . 3 . ]" 1 337 1 36 ASN H 1 36 ASN HB3 . . 4.010 3.694 3.450 3.895 . 0 0 "[ . 1 . 2 . 3 . ]" 1 338 1 36 ASN H 1 37 ASN HB3 . . 5.190 4.887 3.724 5.355 0.165 11 0 "[ . 1 . 2 . 3 . ]" 1 339 1 35 SER QB 1 36 ASN H . . 4.500 3.518 2.804 4.134 . 0 0 "[ . 1 . 2 . 3 . ]" 1 340 1 34 ALA HA 1 36 ASN H . . 4.970 3.483 3.156 3.915 . 0 0 "[ . 1 . 2 . 3 . ]" 1 341 1 36 ASN H 1 36 ASN HD21 . . 4.670 3.331 2.005 4.548 . 0 0 "[ . 1 . 2 . 3 . ]" 1 342 1 33 ALA MB 1 36 ASN H . . 5.280 4.856 4.278 5.353 0.073 9 0 "[ . 1 . 2 . 3 . ]" 1 343 1 65 GLN HA 1 66 TYR H . . 3.210 2.216 2.203 2.247 . 0 0 "[ . 1 . 2 . 3 . ]" 1 344 1 66 TYR H 1 66 TYR QD . . 4.500 3.145 3.009 3.513 . 0 0 "[ . 1 . 2 . 3 . ]" 1 345 1 78 LYS H 1 78 LYS HB3 . . 3.880 3.476 3.406 3.543 . 0 0 "[ . 1 . 2 . 3 . ]" 1 346 1 75 ALA HA 1 78 LYS H . . 3.990 3.767 3.449 4.033 0.043 18 0 "[ . 1 . 2 . 3 . ]" 1 347 1 78 LYS H 1 79 LEU H . . 3.500 2.906 2.399 3.377 . 0 0 "[ . 1 . 2 . 3 . ]" 1 348 1 78 LYS H 1 78 LYS HB2 . . 3.420 2.216 2.100 2.482 . 0 0 "[ . 1 . 2 . 3 . ]" 1 349 1 78 LYS H 1 78 LYS QE . . 4.610 3.679 2.568 4.248 . 0 0 "[ . 1 . 2 . 3 . ]" 1 350 1 78 LYS H 1 79 LEU QD . . 4.700 4.356 3.118 4.720 0.020 10 0 "[ . 1 . 2 . 3 . ]" 1 351 1 156 ASP H 1 156 ASP HB2 . . 4.080 3.715 3.641 3.775 . 0 0 "[ . 1 . 2 . 3 . ]" 1 352 1 150 ALA MB 1 151 THR H . . 3.600 2.888 2.422 3.126 . 0 0 "[ . 1 . 2 . 3 . ]" 1 353 1 155 ILE MG 1 156 ASP H . . 3.600 3.439 3.030 3.711 0.111 11 0 "[ . 1 . 2 . 3 . ]" 1 354 1 155 ILE HA 1 156 ASP H . . 3.300 2.582 2.433 2.765 . 0 0 "[ . 1 . 2 . 3 . ]" 1 355 1 156 ASP H 1 156 ASP HB3 . . 3.820 2.764 2.609 2.896 . 0 0 "[ . 1 . 2 . 3 . ]" 1 356 1 155 ILE HB 1 156 ASP H . . 3.620 2.289 1.953 2.609 . 0 0 "[ . 1 . 2 . 3 . ]" 1 357 1 150 ALA HA 1 151 THR H . . 3.280 2.298 2.216 2.513 . 0 0 "[ . 1 . 2 . 3 . ]" 1 358 1 151 THR H 1 151 THR HB . . 3.680 2.450 2.296 2.628 . 0 0 "[ . 1 . 2 . 3 . ]" 1 359 1 122 ALA MB 1 123 SER H . . 3.460 2.395 1.919 2.908 . 0 0 "[ . 1 . 2 . 3 . ]" 1 360 1 123 SER H 1 123 SER QB . . 3.690 2.622 2.118 3.153 . 0 0 "[ . 1 . 2 . 3 . ]" 1 361 1 100 TYR QE 1 123 SER H . . 5.280 3.759 2.849 4.652 . 0 0 "[ . 1 . 2 . 3 . ]" 1 362 1 97 ILE HB 1 98 LEU H . . 3.240 2.693 2.506 2.916 . 0 0 "[ . 1 . 2 . 3 . ]" 1 363 1 97 ILE MG 1 98 LEU H . . 3.910 2.399 1.899 2.826 . 0 0 "[ . 1 . 2 . 3 . ]" 1 364 1 98 LEU H 1 98 LEU HB3 . . 3.950 3.432 3.382 3.471 . 0 0 "[ . 1 . 2 . 3 . ]" 1 365 1 98 LEU H 1 98 LEU HG . . 3.410 1.802 1.760 1.849 . 0 0 "[ . 1 . 2 . 3 . ]" 1 366 1 95 THR HA 1 98 LEU H . . 4.600 3.372 3.206 3.558 . 0 0 "[ . 1 . 2 . 3 . ]" 1 367 1 97 ILE H 1 97 ILE HB . . 3.060 2.085 1.991 2.192 . 0 0 "[ . 1 . 2 . 3 . ]" 1 368 1 97 ILE H 1 98 LEU H . . 3.810 2.780 2.643 2.908 . 0 0 "[ . 1 . 2 . 3 . ]" 1 369 1 97 ILE H 1 97 ILE MG . . 4.090 3.502 3.233 3.622 . 0 0 "[ . 1 . 2 . 3 . ]" 1 370 1 102 VAL H 1 118 THR HB . . 4.050 3.128 2.592 3.809 . 0 0 "[ . 1 . 2 . 3 . ]" 1 371 1 102 VAL H 1 102 VAL HB . . 3.470 3.519 2.959 3.691 0.221 38 0 "[ . 1 . 2 . 3 . ]" 1 372 1 101 HIS HB2 1 102 VAL H . . 4.320 4.133 4.031 4.200 . 0 0 "[ . 1 . 2 . 3 . ]" 1 373 1 102 VAL H 1 103 VAL H . . 4.780 4.104 3.821 4.384 . 0 0 "[ . 1 . 2 . 3 . ]" 1 374 1 102 VAL H 1 119 LEU H . . 4.800 3.827 3.225 4.236 . 0 0 "[ . 1 . 2 . 3 . ]" 1 375 1 85 ASP H 1 85 ASP HB2 . . 3.260 2.133 2.002 2.398 . 0 0 "[ . 1 . 2 . 3 . ]" 1 376 1 84 ILE HB 1 85 ASP H . . 3.500 2.480 2.100 2.824 . 0 0 "[ . 1 . 2 . 3 . ]" 1 377 1 85 ASP H 1 86 GLU H . . 3.420 2.716 2.525 2.923 . 0 0 "[ . 1 . 2 . 3 . ]" 1 378 1 84 ILE MG 1 85 ASP H . . 4.070 3.414 2.990 3.710 . 0 0 "[ . 1 . 2 . 3 . ]" 1 379 1 84 ILE HG13 1 85 ASP H . . 4.900 4.801 4.498 5.071 0.171 38 0 "[ . 1 . 2 . 3 . ]" 1 380 1 59 ASP QB 1 60 THR H . . 3.690 2.442 1.980 3.425 . 0 0 "[ . 1 . 2 . 3 . ]" 1 381 1 60 THR H 1 60 THR MG . . 4.220 3.668 3.629 3.735 . 0 0 "[ . 1 . 2 . 3 . ]" 1 382 1 60 THR H 1 60 THR HB . . 3.350 2.303 2.145 2.503 . 0 0 "[ . 1 . 2 . 3 . ]" 1 383 1 59 ASP H 1 60 THR H . . 3.730 2.871 2.311 3.206 . 0 0 "[ . 1 . 2 . 3 . ]" 1 384 1 57 LEU QD 1 60 THR H . . 4.680 4.280 3.473 4.760 0.080 31 0 "[ . 1 . 2 . 3 . ]" 1 385 1 60 THR H 1 61 LEU HB2 . . 4.670 4.680 4.153 4.827 0.157 5 0 "[ . 1 . 2 . 3 . ]" 1 386 1 117 GLN HA 1 118 THR H . . 3.190 2.223 2.202 2.293 . 0 0 "[ . 1 . 2 . 3 . ]" 1 387 1 118 THR H 1 123 SER HA . . 3.840 3.005 2.394 3.519 . 0 0 "[ . 1 . 2 . 3 . ]" 1 388 1 118 THR H 1 118 THR MG . . 3.450 2.184 1.849 2.748 . 0 0 "[ . 1 . 2 . 3 . ]" 1 389 1 117 GLN HG3 1 118 THR H . . 4.230 3.655 3.038 4.164 . 0 0 "[ . 1 . 2 . 3 . ]" 1 390 1 117 GLN HG2 1 118 THR H . . 4.390 3.220 2.435 3.937 . 0 0 "[ . 1 . 2 . 3 . ]" 1 391 1 118 THR H 1 124 VAL H . . 4.800 3.900 3.314 4.815 0.015 2 0 "[ . 1 . 2 . 3 . ]" 1 392 1 59 ASP H 1 59 ASP QB . . 3.210 2.280 2.011 2.833 . 0 0 "[ . 1 . 2 . 3 . ]" 1 393 1 58 VAL HB 1 59 ASP H . . 3.520 3.222 2.280 3.874 0.354 9 0 "[ . 1 . 2 . 3 . ]" 1 394 1 58 VAL QG 1 59 ASP H . . 3.990 2.272 1.630 3.377 . 0 0 "[ . 1 . 2 . 3 . ]" 1 395 1 58 VAL H 1 59 ASP H . . 3.970 3.155 2.366 3.695 . 0 0 "[ . 1 . 2 . 3 . ]" 1 396 1 48 SER HA 1 59 ASP H . . 5.050 4.825 4.070 5.147 0.097 19 0 "[ . 1 . 2 . 3 . ]" 1 397 1 132 SER H 1 132 SER HB2 . . 3.840 3.407 2.643 4.070 0.230 6 0 "[ . 1 . 2 . 3 . ]" 1 398 1 106 GLN HA 1 107 THR H . . 3.140 2.249 2.203 2.422 . 0 0 "[ . 1 . 2 . 3 . ]" 1 399 1 106 GLN HB3 1 107 THR H . . 4.180 3.644 2.954 4.166 . 0 0 "[ . 1 . 2 . 3 . ]" 1 400 1 106 GLN QG 1 107 THR H . . 4.450 3.071 2.687 3.671 . 0 0 "[ . 1 . 2 . 3 . ]" 1 401 1 107 THR H 1 107 THR MG . . 4.120 3.930 3.871 4.017 . 0 0 "[ . 1 . 2 . 3 . ]" 1 402 1 107 THR H 1 107 THR HB . . 3.890 2.867 2.688 3.039 . 0 0 "[ . 1 . 2 . 3 . ]" 1 403 1 106 GLN HB2 1 107 THR H . . 4.630 4.491 4.170 4.711 0.081 15 0 "[ . 1 . 2 . 3 . ]" 1 404 1 94 LEU H 1 94 LEU HB3 . . 3.410 2.067 1.991 2.188 . 0 0 "[ . 1 . 2 . 3 . ]" 1 405 1 110 ALA H 1 110 ALA MB . . 3.320 2.548 2.169 2.720 . 0 0 "[ . 1 . 2 . 3 . ]" 1 406 1 76 PHE H 1 76 PHE HB2 . . 3.470 2.130 2.060 2.317 . 0 0 "[ . 1 . 2 . 3 . ]" 1 407 1 40 LEU H 1 40 LEU HB3 . . 4.100 3.728 3.678 3.799 . 0 0 "[ . 1 . 2 . 3 . ]" 1 408 1 40 LEU H 1 40 LEU HB2 . . 3.790 2.694 2.550 2.879 . 0 0 "[ . 1 . 2 . 3 . ]" 1 409 1 40 LEU H 1 40 LEU HG . . 3.820 2.807 2.450 3.007 . 0 0 "[ . 1 . 2 . 3 . ]" 1 410 1 117 GLN QB 1 118 THR H . . 4.070 3.902 3.694 4.077 0.007 11 0 "[ . 1 . 2 . 3 . ]" 1 411 1 93 LEU QB 1 94 LEU H . . 3.600 3.265 2.886 3.600 0.000 29 0 "[ . 1 . 2 . 3 . ]" 1 412 1 94 LEU H 1 95 THR H . . 3.900 2.455 2.240 2.689 . 0 0 "[ . 1 . 2 . 3 . ]" 1 413 1 87 LEU MD2 1 94 LEU H . . 3.830 3.812 3.591 3.871 0.041 9 0 "[ . 1 . 2 . 3 . ]" 1 414 1 94 LEU H 1 94 LEU MD2 . . 4.490 3.340 2.847 3.875 . 0 0 "[ . 1 . 2 . 3 . ]" 1 415 1 76 PHE H 1 76 PHE QD . . 3.560 2.379 2.053 2.812 . 0 0 "[ . 1 . 2 . 3 . ]" 1 416 1 76 PHE H 1 158 VAL QG . . 4.620 3.208 2.617 3.707 . 0 0 "[ . 1 . 2 . 3 . ]" 1 417 1 76 PHE H 1 76 PHE HB3 . . 3.940 3.417 3.385 3.479 . 0 0 "[ . 1 . 2 . 3 . ]" 1 418 1 73 ASN HA 1 76 PHE H . . 4.580 3.545 3.168 3.988 . 0 0 "[ . 1 . 2 . 3 . ]" 1 419 1 75 ALA MB 1 76 PHE H . . 3.710 2.470 1.884 2.869 . 0 0 "[ . 1 . 2 . 3 . ]" 1 420 1 42 THR MG 1 76 PHE H . . 5.500 4.001 3.440 4.526 . 0 0 "[ . 1 . 2 . 3 . ]" 1 421 1 39 GLU H 1 40 LEU H . . 3.360 1.873 1.784 1.981 . 0 0 "[ . 1 . 2 . 3 . ]" 1 422 1 40 LEU H 1 40 LEU QD . . 4.190 2.844 1.742 3.364 . 0 0 "[ . 1 . 2 . 3 . ]" 1 423 1 39 GLU HG2 1 40 LEU H . . 4.500 4.465 4.209 4.589 0.089 12 0 "[ . 1 . 2 . 3 . ]" 1 424 1 39 GLU QB 1 40 LEU H . . 4.600 3.368 3.137 3.552 . 0 0 "[ . 1 . 2 . 3 . ]" 1 425 1 38 PRO HA 1 40 LEU H . . 4.950 3.862 3.723 4.075 . 0 0 "[ . 1 . 2 . 3 . ]" 1 426 1 37 ASN HB2 1 40 LEU H . . 4.780 3.455 2.478 4.213 . 0 0 "[ . 1 . 2 . 3 . ]" 1 427 1 109 PRO HB2 1 110 ALA H . . 4.510 4.420 4.047 4.455 . 0 0 "[ . 1 . 2 . 3 . ]" 1 428 1 109 PRO HD2 1 110 ALA H . . 4.870 3.961 2.744 4.192 . 0 0 "[ . 1 . 2 . 3 . ]" 1 429 1 41 THR H 1 41 THR MG . . 3.460 2.327 1.799 2.728 . 0 0 "[ . 1 . 2 . 3 . ]" 1 430 1 40 LEU H 1 41 THR H . . 3.540 1.902 1.788 2.082 . 0 0 "[ . 1 . 2 . 3 . ]" 1 431 1 39 GLU H 1 41 THR H . . 4.490 3.288 3.066 3.443 . 0 0 "[ . 1 . 2 . 3 . ]" 1 432 1 40 LEU HB2 1 41 THR H . . 4.760 3.143 2.874 3.635 . 0 0 "[ . 1 . 2 . 3 . ]" 1 433 1 40 LEU QD 1 41 THR H . . 4.780 4.001 3.436 4.289 . 0 0 "[ . 1 . 2 . 3 . ]" 1 434 1 38 PRO HA 1 41 THR H . . 5.070 3.590 3.401 3.771 . 0 0 "[ . 1 . 2 . 3 . ]" 1 435 1 34 ALA H 1 34 ALA MB . . 3.240 2.085 1.937 2.254 . 0 0 "[ . 1 . 2 . 3 . ]" 1 436 1 33 ALA MB 1 34 ALA H . . 3.600 2.436 2.104 3.043 . 0 0 "[ . 1 . 2 . 3 . ]" 1 437 1 34 ALA H 1 35 SER H . . 3.900 2.613 1.966 2.933 . 0 0 "[ . 1 . 2 . 3 . ]" 1 438 1 31 ALA HA 1 34 ALA H . . 4.330 3.723 3.431 3.944 . 0 0 "[ . 1 . 2 . 3 . ]" 1 439 1 3 LEU HA 1 4 VAL H . . 3.050 2.724 2.472 2.816 . 0 0 "[ . 1 . 2 . 3 . ]" 1 440 1 4 VAL H 1 4 VAL QG . . 3.430 2.261 1.979 2.915 . 0 0 "[ . 1 . 2 . 3 . ]" 1 441 1 3 LEU HB3 1 4 VAL H . . 3.820 2.023 1.848 2.577 . 0 0 "[ . 1 . 2 . 3 . ]" 1 442 1 4 VAL H 1 143 GLY H . . 3.980 3.609 2.928 3.999 0.019 16 0 "[ . 1 . 2 . 3 . ]" 1 443 1 3 LEU HB2 1 4 VAL H . . 4.230 3.375 3.041 3.959 . 0 0 "[ . 1 . 2 . 3 . ]" 1 444 1 3 LEU QD 1 4 VAL H . . 4.260 2.989 2.390 3.465 . 0 0 "[ . 1 . 2 . 3 . ]" 1 445 1 64 GLY HA3 1 65 GLN H . . 3.430 2.888 2.530 3.341 . 0 0 "[ . 1 . 2 . 3 . ]" 1 446 1 64 GLY HA2 1 65 GLN H . . 3.470 2.425 2.200 2.712 . 0 0 "[ . 1 . 2 . 3 . ]" 1 447 1 65 GLN H 1 65 GLN HB2 . . 3.590 2.339 2.105 3.063 . 0 0 "[ . 1 . 2 . 3 . ]" 1 448 1 65 GLN H 1 65 GLN HG3 . . 4.070 2.798 2.270 3.558 . 0 0 "[ . 1 . 2 . 3 . ]" 1 449 1 65 GLN H 1 65 GLN HG2 . . 4.500 3.982 3.654 4.306 . 0 0 "[ . 1 . 2 . 3 . ]" 1 450 1 27 GLN H 1 27 GLN HB3 . . 3.540 3.529 3.475 3.589 0.049 22 0 "[ . 1 . 2 . 3 . ]" 1 451 1 27 GLN H 1 27 GLN HG3 . . 3.760 2.824 2.244 3.601 . 0 0 "[ . 1 . 2 . 3 . ]" 1 452 1 27 GLN H 1 28 ASP H . . 3.450 2.634 2.109 2.950 . 0 0 "[ . 1 . 2 . 3 . ]" 1 453 1 27 GLN H 1 27 GLN HG2 . . 3.980 3.412 2.548 4.008 0.028 34 0 "[ . 1 . 2 . 3 . ]" 1 454 1 26 SER HB2 1 27 GLN H . . 4.830 3.601 2.791 4.534 . 0 0 "[ . 1 . 2 . 3 . ]" 1 455 1 159 LEU QB 1 160 MET H . . 3.660 2.754 1.855 3.658 . 0 0 "[ . 1 . 2 . 3 . ]" 1 456 1 160 MET H 1 160 MET HG2 . . 4.100 3.526 2.835 4.056 . 0 0 "[ . 1 . 2 . 3 . ]" 1 457 1 160 MET H 1 160 MET HB2 . . 3.800 3.246 2.711 3.915 0.115 17 0 "[ . 1 . 2 . 3 . ]" 1 458 1 159 LEU QD 1 160 MET H . . 4.100 3.487 3.153 3.745 . 0 0 "[ . 1 . 2 . 3 . ]" 1 459 1 160 MET H 1 160 MET HB3 . . 3.890 3.904 3.760 4.140 0.250 29 0 "[ . 1 . 2 . 3 . ]" 1 460 1 160 MET H 1 160 MET HG3 . . 4.580 2.655 2.109 3.531 . 0 0 "[ . 1 . 2 . 3 . ]" 1 461 1 100 TYR QE 1 160 MET H . . 4.670 2.448 1.856 3.559 . 0 0 "[ . 1 . 2 . 3 . ]" 1 462 1 128 GLY QA 1 129 GLN H . . 3.360 2.229 2.169 2.331 . 0 0 "[ . 1 . 2 . 3 . ]" 1 463 1 129 GLN H 1 133 LEU HA . . 4.200 3.514 2.296 4.178 . 0 0 "[ . 1 . 2 . 3 . ]" 1 464 1 128 GLY H 1 129 GLN H . . 4.150 4.194 3.857 4.388 0.238 18 0 "[ . 1 . 2 . 3 . ]" 1 465 1 129 GLN H 1 133 LEU QD . . 4.190 2.689 1.881 4.040 . 0 0 "[ . 1 . 2 . 3 . ]" 1 466 1 129 GLN H 1 129 GLN QG . . 4.500 3.738 1.974 4.327 . 0 0 "[ . 1 . 2 . 3 . ]" 1 467 1 51 LEU QB 1 52 ASN H . . 3.730 2.559 2.391 2.780 . 0 0 "[ . 1 . 2 . 3 . ]" 1 468 1 51 LEU HG 1 52 ASN H . . 4.680 4.634 3.087 4.860 0.180 11 0 "[ . 1 . 2 . 3 . ]" 1 469 1 51 LEU QD 1 52 ASN H . . 4.470 3.905 2.008 4.219 . 0 0 "[ . 1 . 2 . 3 . ]" 1 470 1 46 ALA HA 1 52 ASN H . . 5.500 3.066 2.372 3.801 . 0 0 "[ . 1 . 2 . 3 . ]" 1 471 1 50 GLN H 1 50 GLN HB2 . . 3.660 2.736 2.600 2.801 . 0 0 "[ . 1 . 2 . 3 . ]" 1 472 1 50 GLN H 1 51 LEU H . . 3.440 2.947 2.780 3.171 . 0 0 "[ . 1 . 2 . 3 . ]" 1 473 1 50 GLN H 1 50 GLN HG2 . . 4.100 2.130 1.927 2.577 . 0 0 "[ . 1 . 2 . 3 . ]" 1 474 1 50 GLN H 1 50 GLN HG3 . . 3.990 2.365 1.976 2.852 . 0 0 "[ . 1 . 2 . 3 . ]" 1 475 1 45 ALA HA 1 50 GLN H . . 4.630 3.095 2.828 3.395 . 0 0 "[ . 1 . 2 . 3 . ]" 1 476 1 77 SER H 1 77 SER QB . . 3.340 2.127 2.003 2.280 . 0 0 "[ . 1 . 2 . 3 . ]" 1 477 1 77 SER H 1 78 LYS H . . 3.670 2.730 2.426 3.060 . 0 0 "[ . 1 . 2 . 3 . ]" 1 478 1 76 PHE HB2 1 77 SER H . . 4.080 2.722 2.422 3.074 . 0 0 "[ . 1 . 2 . 3 . ]" 1 479 1 74 ALA HA 1 77 SER H . . 4.210 3.433 3.027 3.836 . 0 0 "[ . 1 . 2 . 3 . ]" 1 480 1 77 SER H 1 78 LYS HB2 . . 4.890 4.618 4.371 4.877 . 0 0 "[ . 1 . 2 . 3 . ]" 1 481 1 76 PHE HB3 1 77 SER H . . 4.450 3.495 3.131 3.862 . 0 0 "[ . 1 . 2 . 3 . ]" 1 482 1 74 ALA MB 1 77 SER H . . 4.860 4.722 4.352 4.915 0.055 33 0 "[ . 1 . 2 . 3 . ]" 1 483 1 76 PHE H 1 77 SER H . . 3.910 2.554 2.270 2.913 . 0 0 "[ . 1 . 2 . 3 . ]" 1 484 1 77 SER H 1 79 LEU H . . 5.500 4.591 4.004 5.073 . 0 0 "[ . 1 . 2 . 3 . ]" 1 485 1 44 THR H 1 44 THR HB . . 3.450 2.543 1.949 3.489 0.039 5 0 "[ . 1 . 2 . 3 . ]" 1 486 1 43 LEU HB2 1 44 THR H . . 4.270 4.086 3.833 4.257 . 0 0 "[ . 1 . 2 . 3 . ]" 1 487 1 43 LEU H 1 44 THR H . . 4.420 2.796 2.333 3.108 . 0 0 "[ . 1 . 2 . 3 . ]" 1 488 1 43 LEU QD 1 44 THR H . . 4.650 2.324 1.900 3.211 . 0 0 "[ . 1 . 2 . 3 . ]" 1 489 1 43 LEU HG 1 44 THR H . . 4.660 2.728 2.485 3.056 . 0 0 "[ . 1 . 2 . 3 . ]" 1 490 1 95 THR H 1 95 THR HB . . 3.550 2.222 2.021 2.573 . 0 0 "[ . 1 . 2 . 3 . ]" 1 491 1 94 LEU HB3 1 95 THR H . . 3.810 3.180 2.701 3.471 . 0 0 "[ . 1 . 2 . 3 . ]" 1 492 1 95 THR H 1 95 THR MG . . 4.260 3.342 2.461 3.680 . 0 0 "[ . 1 . 2 . 3 . ]" 1 493 1 94 LEU HG 1 95 THR H . . 4.930 2.622 2.424 2.996 . 0 0 "[ . 1 . 2 . 3 . ]" 1 494 1 94 LEU MD1 1 95 THR H . . 4.990 4.148 3.961 4.459 . 0 0 "[ . 1 . 2 . 3 . ]" 1 495 1 54 GLN H 1 54 GLN HB2 . . 3.370 2.445 2.288 2.624 . 0 0 "[ . 1 . 2 . 3 . ]" 1 496 1 54 GLN H 1 54 GLN HG3 . . 3.830 3.684 3.398 3.882 0.052 20 0 "[ . 1 . 2 . 3 . ]" 1 497 1 54 GLN H 1 54 GLN HG2 . . 3.870 3.725 3.363 3.989 0.119 20 0 "[ . 1 . 2 . 3 . ]" 1 498 1 53 PRO HD2 1 54 GLN H . . 4.710 2.966 2.483 3.460 . 0 0 "[ . 1 . 2 . 3 . ]" 1 499 1 53 PRO HD3 1 54 GLN H . . 4.380 3.964 3.725 4.248 . 0 0 "[ . 1 . 2 . 3 . ]" 1 500 1 54 GLN H 1 55 VAL QG . . 4.650 3.326 2.384 3.957 . 0 0 "[ . 1 . 2 . 3 . ]" 1 501 1 146 SER HA 1 147 THR H . . 3.140 2.232 2.215 2.268 . 0 0 "[ . 1 . 2 . 3 . ]" 1 502 1 147 THR H 1 147 THR MG . . 3.850 2.699 2.420 2.959 . 0 0 "[ . 1 . 2 . 3 . ]" 1 503 1 146 SER HB2 1 147 THR H . . 4.100 4.254 4.086 4.401 0.301 37 0 "[ . 1 . 2 . 3 . ]" 1 504 1 146 SER HB3 1 147 THR H . . 4.470 3.418 3.158 3.733 . 0 0 "[ . 1 . 2 . 3 . ]" 1 505 1 147 THR H 1 152 VAL QG . . 4.510 3.798 2.807 4.322 . 0 0 "[ . 1 . 2 . 3 . ]" 1 506 1 147 THR H 1 150 ALA MB . . 4.790 4.205 3.892 4.479 . 0 0 "[ . 1 . 2 . 3 . ]" 1 507 1 147 THR H 1 152 VAL H . . 4.870 4.668 4.137 4.950 0.080 19 0 "[ . 1 . 2 . 3 . ]" 1 508 1 147 THR H 1 150 ALA H . . 4.370 3.269 2.676 3.782 . 0 0 "[ . 1 . 2 . 3 . ]" 1 509 1 135 VAL HA 1 136 GLY H . . 3.160 2.195 2.182 2.256 . 0 0 "[ . 1 . 2 . 3 . ]" 1 510 1 126 VAL HA 1 136 GLY H . . 4.060 3.071 2.334 3.664 . 0 0 "[ . 1 . 2 . 3 . ]" 1 511 1 135 VAL QG 1 136 GLY H . . 4.310 2.853 2.433 3.259 . 0 0 "[ . 1 . 2 . 3 . ]" 1 512 1 124 VAL QG 1 136 GLY H . . 4.510 3.077 2.324 4.154 . 0 0 "[ . 1 . 2 . 3 . ]" 1 513 1 135 VAL HB 1 136 GLY H . . 4.740 4.565 4.407 4.694 . 0 0 "[ . 1 . 2 . 3 . ]" 1 514 1 88 LYS H 1 88 LYS QB . . 3.300 2.366 2.230 2.560 . 0 0 "[ . 1 . 2 . 3 . ]" 1 515 1 88 LYS H 1 88 LYS QG . . 3.450 2.565 1.908 2.954 . 0 0 "[ . 1 . 2 . 3 . ]" 1 516 1 51 LEU QD 1 88 LYS H . . 4.220 3.830 2.997 4.269 0.049 18 0 "[ . 1 . 2 . 3 . ]" 1 517 1 87 LEU H 1 88 LYS H . . 3.690 2.679 2.549 2.839 . 0 0 "[ . 1 . 2 . 3 . ]" 1 518 1 85 ASP HA 1 88 LYS H . . 4.360 3.658 3.430 3.814 . 0 0 "[ . 1 . 2 . 3 . ]" 1 519 1 88 LYS H 1 89 THR MG . . 4.700 3.725 2.960 4.506 . 0 0 "[ . 1 . 2 . 3 . ]" 1 520 1 87 LEU HB2 1 88 LYS H . . 4.030 3.199 2.542 3.538 . 0 0 "[ . 1 . 2 . 3 . ]" 1 521 1 84 ILE MG 1 88 LYS H . . 4.840 4.362 3.877 4.740 . 0 0 "[ . 1 . 2 . 3 . ]" 1 522 1 87 LEU HG 1 88 LYS H . . 5.290 4.379 3.963 4.640 . 0 0 "[ . 1 . 2 . 3 . ]" 1 523 1 86 GLU HA 1 88 LYS H . . 5.310 3.720 3.464 4.478 . 0 0 "[ . 1 . 2 . 3 . ]" 1 524 1 62 ASN H 1 62 ASN QB . . 3.200 2.323 2.138 2.628 . 0 0 "[ . 1 . 2 . 3 . ]" 1 525 1 61 LEU HB3 1 62 ASN H . . 4.480 3.724 3.361 4.050 . 0 0 "[ . 1 . 2 . 3 . ]" 1 526 1 61 LEU HB2 1 62 ASN H . . 3.990 2.894 2.607 3.251 . 0 0 "[ . 1 . 2 . 3 . ]" 1 527 1 59 ASP HA 1 62 ASN H . . 4.540 3.793 3.018 4.220 . 0 0 "[ . 1 . 2 . 3 . ]" 1 528 1 58 VAL QG 1 62 ASN H . . 5.020 4.063 3.634 4.461 . 0 0 "[ . 1 . 2 . 3 . ]" 1 529 1 39 GLU H 1 39 GLU HG2 . . 3.620 2.899 2.604 3.058 . 0 0 "[ . 1 . 2 . 3 . ]" 1 530 1 39 GLU H 1 39 GLU QB . . 3.750 2.676 2.584 2.865 . 0 0 "[ . 1 . 2 . 3 . ]" 1 531 1 38 PRO QG 1 39 GLU H . . 3.930 3.828 3.717 3.988 0.058 20 0 "[ . 1 . 2 . 3 . ]" 1 532 1 39 GLU H 1 40 LEU HG . . 5.500 3.434 2.934 3.940 . 0 0 "[ . 1 . 2 . 3 . ]" 1 533 1 39 GLU H 1 39 GLU HG3 . . 4.660 3.268 2.692 3.601 . 0 0 "[ . 1 . 2 . 3 . ]" 1 534 1 11 TYR QR 1 39 GLU H . . 4.170 3.703 3.172 4.025 . 0 0 "[ . 1 . 2 . 3 . ]" 1 535 1 38 PRO HD2 1 39 GLU H . . 4.550 2.843 2.726 3.024 . 0 0 "[ . 1 . 2 . 3 . ]" 1 536 1 39 GLU H 1 40 LEU HA . . 5.350 4.519 4.464 4.594 . 0 0 "[ . 1 . 2 . 3 . ]" 1 537 1 141 VAL H 1 142 CYS H . . 3.470 2.498 1.984 2.901 . 0 0 "[ . 1 . 2 . 3 . ]" 1 538 1 141 VAL QG 1 142 CYS H . . 3.370 3.194 3.087 3.349 . 0 0 "[ . 1 . 2 . 3 . ]" 1 539 1 141 VAL HB 1 142 CYS H . . 3.440 2.461 2.175 2.892 . 0 0 "[ . 1 . 2 . 3 . ]" 1 540 1 140 VAL HA 1 142 CYS H . . 4.260 3.973 3.705 4.280 0.020 3 0 "[ . 1 . 2 . 3 . ]" 1 541 1 142 CYS H 1 154 MET HB3 . . 4.160 3.505 3.233 4.022 . 0 0 "[ . 1 . 2 . 3 . ]" 1 542 1 142 CYS H 1 142 CYS HB2 . . 4.190 3.491 3.369 3.581 . 0 0 "[ . 1 . 2 . 3 . ]" 1 543 1 142 CYS H 1 154 MET H . . 4.420 2.949 2.834 3.115 . 0 0 "[ . 1 . 2 . 3 . ]" 1 544 1 142 CYS H 1 143 GLY H . . 4.730 3.770 3.565 3.931 . 0 0 "[ . 1 . 2 . 3 . ]" 1 545 1 14 ALA MB 1 15 ASN H . . 3.690 2.577 2.322 2.886 . 0 0 "[ . 1 . 2 . 3 . ]" 1 546 1 15 ASN H 1 15 ASN HB2 . . 3.810 2.620 2.492 2.808 . 0 0 "[ . 1 . 2 . 3 . ]" 1 547 1 15 ASN H 1 15 ASN HD22 . . 4.130 3.925 3.441 4.136 0.006 22 0 "[ . 1 . 2 . 3 . ]" 1 548 1 15 ASN H 1 16 PRO HD3 . . 4.330 3.287 2.920 3.613 . 0 0 "[ . 1 . 2 . 3 . ]" 1 549 1 15 ASN H 1 16 PRO HD2 . . 4.690 4.395 4.127 4.614 . 0 0 "[ . 1 . 2 . 3 . ]" 1 550 1 15 ASN H 1 15 ASN HD21 . . 4.660 2.549 2.071 2.977 . 0 0 "[ . 1 . 2 . 3 . ]" 1 551 1 13 ALA MB 1 15 ASN H . . 4.620 4.608 4.495 4.663 0.043 13 0 "[ . 1 . 2 . 3 . ]" 1 552 1 113 VAL HA 1 114 GLY H . . 3.110 2.286 2.190 2.491 . 0 0 "[ . 1 . 2 . 3 . ]" 1 553 1 113 VAL QG 1 114 GLY H . . 3.730 2.136 1.877 2.552 . 0 0 "[ . 1 . 2 . 3 . ]" 1 554 1 114 GLY H 1 126 VAL HB . . 3.550 2.401 1.943 2.964 . 0 0 "[ . 1 . 2 . 3 . ]" 1 555 1 63 SER H 1 63 SER QB . . 3.460 2.621 2.122 3.026 . 0 0 "[ . 1 . 2 . 3 . ]" 1 556 1 62 ASN QB 1 63 SER H . . 4.070 4.017 3.843 4.129 0.059 6 0 "[ . 1 . 2 . 3 . ]" 1 557 1 21 SER HG 1 24 GLY H . . 4.080 2.729 1.912 4.137 0.057 26 0 "[ . 1 . 2 . 3 . ]" 1 558 1 23 GLN HB3 1 24 GLY H . . 4.030 3.233 2.180 4.338 0.308 11 0 "[ . 1 . 2 . 3 . ]" 1 559 1 23 GLN HG3 1 24 GLY H . . 4.410 3.574 1.894 4.916 0.506 6 1 "[ .+ 1 . 2 . 3 . ]" 1 560 1 20 ALA H 1 20 ALA MB . . 3.380 2.067 1.956 2.199 . 0 0 "[ . 1 . 2 . 3 . ]" 1 561 1 19 PRO HD2 1 20 ALA H . . 4.550 2.395 2.254 2.575 . 0 0 "[ . 1 . 2 . 3 . ]" 1 562 1 19 PRO HD3 1 20 ALA H . . 4.850 3.704 3.656 3.767 . 0 0 "[ . 1 . 2 . 3 . ]" 1 563 1 56 ASN H 1 57 LEU QD . . 3.520 2.926 1.858 3.575 0.055 33 0 "[ . 1 . 2 . 3 . ]" 1 564 1 55 VAL HA 1 56 ASN H . . 2.970 2.359 2.184 2.667 . 0 0 "[ . 1 . 2 . 3 . ]" 1 565 1 71 PRO HA 1 72 THR H . . 3.180 2.157 2.149 2.185 . 0 0 "[ . 1 . 2 . 3 . ]" 1 566 1 72 THR H 1 72 THR MG . . 3.150 2.073 1.899 2.433 . 0 0 "[ . 1 . 2 . 3 . ]" 1 567 1 71 PRO HB3 1 72 THR H . . 4.140 4.158 3.979 4.311 0.171 38 0 "[ . 1 . 2 . 3 . ]" 1 568 1 72 THR H 1 154 MET HB3 . . 5.130 4.152 3.790 4.476 . 0 0 "[ . 1 . 2 . 3 . ]" 1 569 1 19 PRO HB3 1 20 ALA H . . 4.500 4.396 4.000 4.561 0.061 16 0 "[ . 1 . 2 . 3 . ]" 1 570 1 19 PRO HB2 1 20 ALA H . . 4.300 3.621 2.912 3.925 . 0 0 "[ . 1 . 2 . 3 . ]" 1 571 1 19 PRO HG2 1 20 ALA H . . 4.780 3.264 2.469 3.686 . 0 0 "[ . 1 . 2 . 3 . ]" 1 572 1 47 LEU H 1 47 LEU HB3 . . 3.030 2.829 2.754 2.933 . 0 0 "[ . 1 . 2 . 3 . ]" 1 573 1 47 LEU H 1 98 LEU MD2 . . 3.970 3.475 3.063 4.009 0.039 28 0 "[ . 1 . 2 . 3 . ]" 1 574 1 44 THR HA 1 47 LEU H . . 4.340 3.453 3.254 3.565 . 0 0 "[ . 1 . 2 . 3 . ]" 1 575 1 111 ASN H 1 111 ASN HB2 . . 3.790 2.444 2.206 2.859 . 0 0 "[ . 1 . 2 . 3 . ]" 1 576 1 110 ALA MB 1 111 ASN H . . 3.870 2.921 2.482 3.620 . 0 0 "[ . 1 . 2 . 3 . ]" 1 577 1 111 ASN H 1 112 VAL QG . . 4.420 3.342 2.203 4.023 . 0 0 "[ . 1 . 2 . 3 . ]" 1 578 1 111 ASN H 1 112 VAL H . . 3.280 2.045 1.872 2.142 . 0 0 "[ . 1 . 2 . 3 . ]" 1 579 1 111 ASN H 1 112 VAL HB . . 4.310 4.036 3.620 4.430 0.120 11 0 "[ . 1 . 2 . 3 . ]" 1 580 1 111 ASN H 1 112 VAL HA . . 4.630 4.555 4.405 4.669 0.039 34 0 "[ . 1 . 2 . 3 . ]" 1 581 1 107 THR MG 1 111 ASN H . . 4.840 3.069 2.546 3.750 . 0 0 "[ . 1 . 2 . 3 . ]" 1 582 1 129 GLN HB3 1 130 GLY H . . 4.720 3.372 1.913 4.680 . 0 0 "[ . 1 . 2 . 3 . ]" 1 583 1 129 GLN HB2 1 130 GLY H . . 5.290 3.940 3.253 4.729 . 0 0 "[ . 1 . 2 . 3 . ]" 1 584 1 71 PRO HB3 1 157 SER H . . 3.870 3.548 3.117 3.906 0.036 31 0 "[ . 1 . 2 . 3 . ]" 1 585 1 156 ASP H 1 157 SER H . . 3.780 2.908 2.349 3.242 . 0 0 "[ . 1 . 2 . 3 . ]" 1 586 1 155 ILE MD 1 157 SER H . . 4.380 3.115 1.812 4.112 . 0 0 "[ . 1 . 2 . 3 . ]" 1 587 1 155 ILE HA 1 157 SER H . . 4.630 4.438 4.159 4.701 0.071 28 0 "[ . 1 . 2 . 3 . ]" 1 588 1 66 TYR HA 1 105 GLY H . . 3.480 2.193 1.855 2.642 . 0 0 "[ . 1 . 2 . 3 . ]" 1 589 1 104 ALA MB 1 105 GLY H . . 3.800 3.530 3.354 3.633 . 0 0 "[ . 1 . 2 . 3 . ]" 1 590 1 66 TYR QD 1 105 GLY H . . 4.470 3.191 2.512 4.108 . 0 0 "[ . 1 . 2 . 3 . ]" 1 591 1 67 THR H 1 105 GLY H . . 4.590 4.286 3.912 4.667 0.077 22 0 "[ . 1 . 2 . 3 . ]" 1 592 1 105 GLY H 1 106 GLN HB2 . . 4.840 4.545 3.416 4.944 0.104 19 0 "[ . 1 . 2 . 3 . ]" 1 593 1 21 SER H 1 21 SER HG . . 3.770 2.707 1.940 3.684 . 0 0 "[ . 1 . 2 . 3 . ]" 1 594 1 21 SER H 1 21 SER HB3 . . 3.780 3.105 2.496 3.899 0.119 8 0 "[ . 1 . 2 . 3 . ]" 1 595 1 20 ALA H 1 21 SER H . . 3.700 2.849 2.220 3.698 . 0 0 "[ . 1 . 2 . 3 . ]" 1 596 1 20 ALA MB 1 21 SER H . . 4.200 3.365 1.786 3.791 . 0 0 "[ . 1 . 2 . 3 . ]" 1 597 1 21 SER H 1 24 GLY H . . 4.800 3.799 3.169 4.922 0.122 8 0 "[ . 1 . 2 . 3 . ]" 1 598 1 15 ASN HB3 1 21 SER H . . 5.080 4.265 2.277 5.107 0.027 33 0 "[ . 1 . 2 . 3 . ]" 1 599 1 35 SER H 1 35 SER QB . . 3.240 2.237 1.996 2.763 . 0 0 "[ . 1 . 2 . 3 . ]" 1 600 1 34 ALA MB 1 35 SER H . . 3.640 2.808 2.239 3.230 . 0 0 "[ . 1 . 2 . 3 . ]" 1 601 1 32 VAL HA 1 35 SER H . . 4.470 3.052 2.455 3.373 . 0 0 "[ . 1 . 2 . 3 . ]" 1 602 1 4 VAL HA 1 5 GLY H . . 2.890 2.439 2.186 3.312 0.422 34 0 "[ . 1 . 2 . 3 . ]" 1 603 1 4 VAL QG 1 5 GLY H . . 3.910 2.747 1.829 3.619 . 0 0 "[ . 1 . 2 . 3 . ]" 1 604 1 4 VAL HB 1 5 GLY H . . 3.880 3.610 2.910 4.178 0.298 33 0 "[ . 1 . 2 . 3 . ]" 1 605 1 5 GLY H 1 6 PRO HD3 . . 5.180 4.118 3.877 4.723 . 0 0 "[ . 1 . 2 . 3 . ]" 1 606 1 49 GLY H 1 50 GLN H . . 3.810 1.992 1.842 2.410 . 0 0 "[ . 1 . 2 . 3 . ]" 1 607 1 49 GLY H 1 50 GLN HG2 . . 5.110 3.998 3.634 4.539 . 0 0 "[ . 1 . 2 . 3 . ]" 1 608 1 148 ALA MB 1 149 ASN H . . 3.560 2.239 1.909 2.801 . 0 0 "[ . 1 . 2 . 3 . ]" 1 609 1 149 ASN H 1 149 ASN HB3 . . 4.000 3.410 3.125 3.725 . 0 0 "[ . 1 . 2 . 3 . ]" 1 610 1 29 PRO HA 1 149 ASN H . . 3.990 3.760 3.461 4.040 0.050 3 0 "[ . 1 . 2 . 3 . ]" 1 611 1 30 VAL H 1 149 ASN H . . 4.440 3.122 2.811 3.474 . 0 0 "[ . 1 . 2 . 3 . ]" 1 612 1 148 ALA H 1 149 ASN H . . 4.000 2.469 1.967 2.917 . 0 0 "[ . 1 . 2 . 3 . ]" 1 613 1 30 VAL QG 1 149 ASN H . . 5.110 3.648 2.240 4.350 . 0 0 "[ . 1 . 2 . 3 . ]" 1 614 1 81 ALA MB 1 82 SER H . . 3.780 2.520 2.187 2.842 . 0 0 "[ . 1 . 2 . 3 . ]" 1 615 1 82 SER H 1 83 THR H . . 4.020 2.973 2.807 3.131 . 0 0 "[ . 1 . 2 . 3 . ]" 1 616 1 82 SER H 1 82 SER HB2 . . 3.870 2.558 2.035 3.573 . 0 0 "[ . 1 . 2 . 3 . ]" 1 617 1 80 PRO HB2 1 82 SER H . . 4.480 2.773 2.395 3.252 . 0 0 "[ . 1 . 2 . 3 . ]" 1 618 1 80 PRO HB3 1 82 SER H . . 4.920 4.325 3.964 4.806 . 0 0 "[ . 1 . 2 . 3 . ]" 1 619 1 81 ALA H 1 82 SER H . . 4.720 2.955 2.705 3.663 . 0 0 "[ . 1 . 2 . 3 . ]" 1 620 1 25 MET H 1 26 SER H . . 3.880 2.436 1.944 2.831 . 0 0 "[ . 1 . 2 . 3 . ]" 1 621 1 26 SER H 1 26 SER HB2 . . 3.630 2.426 2.024 3.473 . 0 0 "[ . 1 . 2 . 3 . ]" 1 622 1 25 MET HB2 1 26 SER H . . 4.330 4.312 4.071 4.414 0.084 24 0 "[ . 1 . 2 . 3 . ]" 1 623 1 25 MET HB3 1 26 SER H . . 4.200 4.099 3.918 4.235 0.035 22 0 "[ . 1 . 2 . 3 . ]" 1 624 1 26 SER H 1 26 SER HB3 . . 3.990 2.867 2.048 3.574 . 0 0 "[ . 1 . 2 . 3 . ]" 1 625 1 26 SER H 1 147 THR HA . . 4.720 3.853 3.576 4.035 . 0 0 "[ . 1 . 2 . 3 . ]" 1 626 1 47 LEU HB3 1 48 SER H . . 3.840 3.950 3.913 3.997 0.157 8 0 "[ . 1 . 2 . 3 . ]" 1 627 1 48 SER H 1 48 SER QB . . 3.840 2.331 2.024 2.642 . 0 0 "[ . 1 . 2 . 3 . ]" 1 628 1 47 LEU H 1 48 SER H . . 3.610 3.042 2.895 3.119 . 0 0 "[ . 1 . 2 . 3 . ]" 1 629 1 45 ALA HA 1 48 SER H . . 4.090 4.209 4.153 4.279 0.189 10 0 "[ . 1 . 2 . 3 . ]" 1 630 1 47 LEU HB2 1 48 SER H . . 4.420 3.020 2.937 3.143 . 0 0 "[ . 1 . 2 . 3 . ]" 1 631 1 47 LEU QD 1 48 SER H . . 4.200 2.115 1.884 2.335 . 0 0 "[ . 1 . 2 . 3 . ]" 1 632 1 63 SER QB 1 64 GLY H . . 4.720 2.807 1.858 4.019 . 0 0 "[ . 1 . 2 . 3 . ]" 1 633 1 17 THR HB 1 18 GLY H . . 4.420 2.737 1.940 4.178 . 0 0 "[ . 1 . 2 . 3 . ]" 1 634 1 17 THR MG 1 18 GLY H . . 5.060 3.888 3.648 4.310 . 0 0 "[ . 1 . 2 . 3 . ]" 1 635 1 101 HIS H 1 101 HIS HB2 . . 3.410 2.219 2.159 2.306 . 0 0 "[ . 1 . 2 . 3 . ]" 1 636 1 101 HIS H 1 101 HIS HB3 . . 3.860 3.464 3.402 3.552 . 0 0 "[ . 1 . 2 . 3 . ]" 1 637 1 99 THR HA 1 101 HIS H . . 4.330 3.707 3.544 3.963 . 0 0 "[ . 1 . 2 . 3 . ]" 1 638 1 16 PRO QG 1 17 THR H . . 3.440 2.670 2.274 3.466 0.026 26 0 "[ . 1 . 2 . 3 . ]" 1 639 1 17 THR H 1 17 THR MG . . 3.970 2.775 2.407 3.065 . 0 0 "[ . 1 . 2 . 3 . ]" 1 640 1 16 PRO HD3 1 17 THR H . . 4.430 3.737 3.656 3.885 . 0 0 "[ . 1 . 2 . 3 . ]" 1 641 1 15 ASN HA 1 17 THR H . . 4.480 3.758 3.083 4.287 . 0 0 "[ . 1 . 2 . 3 . ]" 1 642 1 16 PRO HD2 1 17 THR H . . 4.060 2.365 2.253 2.565 . 0 0 "[ . 1 . 2 . 3 . ]" 1 643 1 120 GLN HB2 1 121 GLY H . . 4.090 3.958 3.490 4.491 0.401 6 0 "[ . 1 . 2 . 3 . ]" 1 644 1 121 GLY H 1 122 ALA H . . 3.910 2.452 1.970 3.370 . 0 0 "[ . 1 . 2 . 3 . ]" 1 645 1 120 GLN HB3 1 121 GLY H . . 4.540 2.906 2.243 3.654 . 0 0 "[ . 1 . 2 . 3 . ]" 1 646 1 118 THR H 1 121 GLY H . . 4.810 3.829 3.279 4.462 . 0 0 "[ . 1 . 2 . 3 . ]" 1 647 1 7 GLY H 1 141 VAL QG . . 4.160 2.293 1.956 2.620 . 0 0 "[ . 1 . 2 . 3 . ]" 1 648 1 6 PRO HB2 1 7 GLY H . . 3.970 2.715 2.393 3.218 . 0 0 "[ . 1 . 2 . 3 . ]" 1 649 1 6 PRO HD2 1 7 GLY H . . 4.150 2.521 2.266 2.772 . 0 0 "[ . 1 . 2 . 3 . ]" 1 650 1 6 PRO HB3 1 7 GLY H . . 4.560 3.888 3.705 4.174 . 0 0 "[ . 1 . 2 . 3 . ]" 1 651 1 7 GLY H 1 141 VAL HA . . 4.640 2.977 2.415 3.339 . 0 0 "[ . 1 . 2 . 3 . ]" 1 652 1 6 PRO HD3 1 7 GLY H . . 5.030 3.856 3.681 4.014 . 0 0 "[ . 1 . 2 . 3 . ]" 1 653 1 127 THR HB 1 128 GLY H . . 3.320 2.947 2.480 3.371 0.051 6 0 "[ . 1 . 2 . 3 . ]" 1 654 1 127 THR MG 1 128 GLY H . . 4.160 3.292 1.803 4.178 0.018 34 0 "[ . 1 . 2 . 3 . ]" 1 655 1 113 VAL QG 1 128 GLY H . . 4.270 2.803 2.391 3.314 . 0 0 "[ . 1 . 2 . 3 . ]" 1 656 1 98 LEU HB2 1 99 THR H . . 3.810 2.323 2.052 2.568 . 0 0 "[ . 1 . 2 . 3 . ]" 1 657 1 99 THR H 1 99 THR HG1 . . 3.210 2.345 1.745 3.207 . 0 0 "[ . 1 . 2 . 3 . ]" 1 658 1 98 LEU H 1 99 THR H . . 3.970 3.056 2.909 3.207 . 0 0 "[ . 1 . 2 . 3 . ]" 1 659 1 57 LEU QD 1 99 THR H . . 4.400 2.965 2.609 3.571 . 0 0 "[ . 1 . 2 . 3 . ]" 1 660 1 96 SER HA 1 99 THR H . . 4.310 3.904 3.725 4.102 . 0 0 "[ . 1 . 2 . 3 . ]" 1 661 1 98 LEU HB3 1 99 THR H . . 4.310 3.754 3.495 3.955 . 0 0 "[ . 1 . 2 . 3 . ]" 1 662 1 95 THR HA 1 99 THR H . . 4.880 3.678 3.464 4.000 . 0 0 "[ . 1 . 2 . 3 . ]" 1 663 1 99 THR H 1 101 HIS H . . 5.270 3.925 3.847 4.063 . 0 0 "[ . 1 . 2 . 3 . ]" 1 664 1 144 GLY H 1 153 TYR HA . . 5.000 3.621 3.497 3.957 . 0 0 "[ . 1 . 2 . 3 . ]" 1 665 1 88 LYS QB 1 89 THR H . . 3.880 3.755 3.372 3.974 0.094 23 0 "[ . 1 . 2 . 3 . ]" 1 666 1 89 THR H 1 90 ASN H . . 3.260 1.950 1.685 2.509 . 0 0 "[ . 1 . 2 . 3 . ]" 1 667 1 89 THR H 1 89 THR MG . . 3.900 2.824 2.387 3.480 . 0 0 "[ . 1 . 2 . 3 . ]" 1 668 1 86 GLU HA 1 89 THR H . . 4.500 4.031 3.446 4.580 0.080 9 0 "[ . 1 . 2 . 3 . ]" 1 669 1 88 LYS H 1 89 THR H . . 3.730 2.763 2.516 3.208 . 0 0 "[ . 1 . 2 . 3 . ]" 1 670 1 89 THR H 1 90 ASN HB2 . . 4.860 3.793 3.483 4.202 . 0 0 "[ . 1 . 2 . 3 . ]" 1 671 1 89 THR H 1 90 ASN HB3 . . 4.970 5.035 4.929 5.247 0.277 4 0 "[ . 1 . 2 . 3 . ]" 1 672 1 28 ASP H 1 148 ALA H . . 5.500 5.355 4.618 5.588 0.088 28 0 "[ . 1 . 2 . 3 . ]" 1 673 1 145 VAL H 1 152 VAL H . . 4.010 2.776 2.540 2.974 . 0 0 "[ . 1 . 2 . 3 . ]" 1 674 1 120 GLN H 1 120 GLN HG2 . . 4.270 4.343 3.783 4.633 0.363 16 0 "[ . 1 . 2 . 3 . ]" 1 675 1 32 VAL MG1 1 36 ASN HD22 . . 3.860 2.561 1.778 3.642 . 0 0 "[ . 1 . 2 . 3 . ]" 1 676 1 36 ASN HB3 1 36 ASN HD22 . . 4.030 3.940 3.538 4.158 0.128 10 0 "[ . 1 . 2 . 3 . ]" 1 677 1 36 ASN HA 1 36 ASN HD22 . . 4.240 3.927 3.350 4.287 0.047 23 0 "[ . 1 . 2 . 3 . ]" 1 678 1 36 ASN HA 1 36 ASN HD21 . . 4.120 3.064 1.941 3.946 . 0 0 "[ . 1 . 2 . 3 . ]" 1 679 1 32 VAL MG1 1 36 ASN HD21 . . 4.320 3.194 2.086 4.361 0.041 20 0 "[ . 1 . 2 . 3 . ]" 1 680 1 103 VAL HB 1 104 ALA H . . 4.700 4.067 3.835 4.371 . 0 0 "[ . 1 . 2 . 3 . ]" 1 681 1 104 ALA H 1 118 THR HA . . 5.430 3.525 3.280 3.813 . 0 0 "[ . 1 . 2 . 3 . ]" 1 682 1 152 VAL HB 1 153 TYR H . . 4.400 4.497 4.437 4.537 0.137 30 0 "[ . 1 . 2 . 3 . ]" 1 683 1 116 ARG H 1 124 VAL H . . 4.110 2.707 1.854 3.555 . 0 0 "[ . 1 . 2 . 3 . ]" 1 684 1 116 ARG H 1 123 SER QB . . 4.900 3.951 3.168 4.696 . 0 0 "[ . 1 . 2 . 3 . ]" 1 685 1 69 PHE HB3 1 70 ALA H . . 4.780 4.274 4.191 4.343 . 0 0 "[ . 1 . 2 . 3 . ]" 1 686 1 137 ASN HB2 1 138 ALA H . . 5.280 3.705 2.853 4.634 . 0 0 "[ . 1 . 2 . 3 . ]" 1 687 1 57 LEU H 1 58 VAL HB . . 4.840 4.221 3.810 4.883 0.043 17 0 "[ . 1 . 2 . 3 . ]" 1 688 1 93 LEU H 1 94 LEU H . . 3.820 2.210 1.820 2.627 . 0 0 "[ . 1 . 2 . 3 . ]" 1 689 1 68 VAL H 1 153 TYR QD . . 5.060 4.385 4.137 4.561 . 0 0 "[ . 1 . 2 . 3 . ]" 1 690 1 40 LEU HA 1 42 THR H . . 5.500 3.619 3.294 4.199 . 0 0 "[ . 1 . 2 . 3 . ]" 1 691 1 73 ASN H 1 74 ALA H . . 4.290 2.539 2.265 2.806 . 0 0 "[ . 1 . 2 . 3 . ]" 1 692 1 30 VAL H 1 149 ASN HD21 . . 5.500 4.570 3.206 5.497 . 0 0 "[ . 1 . 2 . 3 . ]" 1 693 1 105 GLY H 1 106 GLN H . . 5.160 2.940 2.239 3.472 . 0 0 "[ . 1 . 2 . 3 . ]" 1 694 1 119 LEU H 1 120 GLN H . . 3.890 2.749 2.527 3.023 . 0 0 "[ . 1 . 2 . 3 . ]" 1 695 1 118 THR HB 1 120 GLN H . . 3.840 2.931 2.312 3.842 0.002 9 0 "[ . 1 . 2 . 3 . ]" 1 696 1 100 TYR HA 1 120 GLN H . . 4.010 3.048 2.597 3.407 . 0 0 "[ . 1 . 2 . 3 . ]" 1 697 1 149 ASN HB2 1 149 ASN HD22 . . 3.770 3.601 3.570 3.640 . 0 0 "[ . 1 . 2 . 3 . ]" 1 698 1 149 ASN HB3 1 149 ASN HD22 . . 3.980 4.153 4.147 4.158 0.178 22 0 "[ . 1 . 2 . 3 . ]" 1 699 1 149 ASN HA 1 149 ASN HD21 . . 3.830 3.859 3.808 3.904 0.074 27 0 "[ . 1 . 2 . 3 . ]" 1 700 1 131 ASN HA 1 131 ASN HD22 . . 3.580 3.490 3.390 3.577 . 0 0 "[ . 1 . 2 . 3 . ]" 1 701 1 131 ASN HA 1 131 ASN HD21 . . 3.310 2.383 2.090 2.661 . 0 0 "[ . 1 . 2 . 3 . ]" 1 702 1 137 ASN HB2 1 137 ASN HD22 . . 4.150 3.835 3.447 4.156 0.006 17 0 "[ . 1 . 2 . 3 . ]" 1 703 1 27 GLN HB3 1 27 GLN HE22 . . 4.000 4.170 3.756 4.960 0.960 33 10 "[ * 1** . * 2 * . *- +*. * ]" 1 704 1 27 GLN HE21 1 27 GLN HG2 . . 3.440 2.782 2.111 3.443 0.003 20 0 "[ . 1 . 2 . 3 . ]" 1 705 1 27 GLN HE22 1 27 GLN HG3 . . 3.830 3.767 3.450 4.093 0.263 27 0 "[ . 1 . 2 . 3 . ]" 1 706 1 27 GLN HB3 1 27 GLN HE21 . . 4.320 3.623 3.012 4.430 0.110 34 0 "[ . 1 . 2 . 3 . ]" 1 707 1 52 ASN HD21 1 88 LYS QG . . 4.410 3.493 2.675 5.082 0.672 28 2 "[ . 1 . 2 . +-3 . ]" 1 708 1 51 LEU QD 1 52 ASN HD21 . . 4.160 3.517 2.744 4.505 0.345 30 0 "[ . 1 . 2 . 3 . ]" 1 709 1 52 ASN QB 1 52 ASN HD22 . . 3.810 3.437 3.336 3.504 . 0 0 "[ . 1 . 2 . 3 . ]" 1 710 1 72 THR HA 1 73 ASN HD22 . . 5.010 4.910 4.005 5.277 0.267 38 0 "[ . 1 . 2 . 3 . ]" 1 711 1 72 THR HA 1 73 ASN HD21 . . 4.820 3.854 3.155 4.838 0.018 19 0 "[ . 1 . 2 . 3 . ]" 1 712 1 96 SER HA 1 120 GLN HE21 . . 4.500 4.165 2.879 4.574 0.074 2 0 "[ . 1 . 2 . 3 . ]" 1 713 1 96 SER HA 1 120 GLN HE22 . . 4.750 4.530 3.593 4.893 0.143 28 0 "[ . 1 . 2 . 3 . ]" 1 714 1 120 GLN HE22 1 120 GLN HG3 . . 4.150 3.480 3.446 3.737 . 0 0 "[ . 1 . 2 . 3 . ]" 1 715 1 120 GLN HB3 1 120 GLN HE21 . . 4.800 3.856 2.801 4.495 . 0 0 "[ . 1 . 2 . 3 . ]" 1 716 1 120 GLN HB3 1 120 GLN HE22 . . 5.150 4.711 3.817 5.347 0.197 13 0 "[ . 1 . 2 . 3 . ]" 1 717 1 120 GLN HE21 1 122 ALA MB . . 4.740 3.869 2.767 5.296 0.556 10 1 "[ . + . 2 . 3 . ]" 1 718 1 11 TYR HA 1 15 ASN HD21 . . 4.360 3.666 3.129 4.097 . 0 0 "[ . 1 . 2 . 3 . ]" 1 719 1 15 ASN HB2 1 15 ASN HD21 . . 3.660 2.264 2.128 2.392 . 0 0 "[ . 1 . 2 . 3 . ]" 1 720 1 14 ALA MB 1 15 ASN HD22 . . 4.850 2.678 2.172 3.044 . 0 0 "[ . 1 . 2 . 3 . ]" 1 721 1 14 ALA MB 1 15 ASN HD21 . . 3.840 2.430 1.977 3.075 . 0 0 "[ . 1 . 2 . 3 . ]" 1 722 1 11 TYR HA 1 15 ASN HD22 . . 5.050 4.793 3.699 5.062 0.012 12 0 "[ . 1 . 2 . 3 . ]" 1 723 1 30 VAL QG 1 149 ASN HD22 . . 4.270 2.260 1.786 3.371 . 0 0 "[ . 1 . 2 . 3 . ]" 1 724 1 30 VAL QG 1 149 ASN HD21 . . 3.970 3.052 1.851 3.773 . 0 0 "[ . 1 . 2 . 3 . ]" 1 725 1 70 ALA H 1 153 TYR H . . 4.770 2.934 2.680 3.279 . 0 0 "[ . 1 . 2 . 3 . ]" 1 726 1 93 LEU H 1 93 LEU HG . . 4.310 3.613 3.229 3.943 . 0 0 "[ . 1 . 2 . 3 . ]" 1 727 1 68 VAL H 1 152 VAL QG . . 3.890 3.480 3.138 3.775 . 0 0 "[ . 1 . 2 . 3 . ]" 1 728 1 68 VAL H 1 69 PHE H . . 4.880 4.629 4.580 4.659 . 0 0 "[ . 1 . 2 . 3 . ]" 1 729 1 68 VAL H 1 151 THR H . . 4.800 3.510 2.978 3.909 . 0 0 "[ . 1 . 2 . 3 . ]" 1 730 1 137 ASN H 1 138 ALA H . . 3.550 2.590 1.713 3.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 731 1 43 LEU H 1 43 LEU HB2 . . 3.850 3.114 2.681 3.382 . 0 0 "[ . 1 . 2 . 3 . ]" 1 732 1 42 THR H 1 43 LEU H . . 4.420 2.707 2.593 2.826 . 0 0 "[ . 1 . 2 . 3 . ]" 1 733 1 75 ALA H 1 76 PHE HB2 . . 4.270 4.224 3.726 4.350 0.080 35 0 "[ . 1 . 2 . 3 . ]" 1 734 1 84 ILE H 1 84 ILE HG13 . . 3.210 3.409 3.331 3.451 0.241 35 0 "[ . 1 . 2 . 3 . ]" 1 735 1 81 ALA HA 1 84 ILE H . . 4.540 3.224 3.035 3.422 . 0 0 "[ . 1 . 2 . 3 . ]" 1 736 1 84 ILE H 1 85 ASP H . . 3.690 2.786 2.631 3.047 . 0 0 "[ . 1 . 2 . 3 . ]" 1 737 1 75 ALA H 1 76 PHE H . . 3.820 2.448 1.864 2.797 . 0 0 "[ . 1 . 2 . 3 . ]" 1 738 1 36 ASN HA 1 37 ASN H . . 4.170 3.578 3.292 3.653 . 0 0 "[ . 1 . 2 . 3 . ]" 1 739 1 37 ASN H 1 38 PRO HD3 . . 4.870 4.527 4.373 4.651 . 0 0 "[ . 1 . 2 . 3 . ]" 1 740 1 57 LEU HB2 1 58 VAL H . . 4.860 3.229 2.731 4.011 . 0 0 "[ . 1 . 2 . 3 . ]" 1 741 1 30 VAL H 1 31 ALA H . . 4.760 3.979 2.921 4.534 . 0 0 "[ . 1 . 2 . 3 . ]" 1 742 1 80 PRO HB2 1 83 THR H . . 4.080 3.172 2.986 3.592 . 0 0 "[ . 1 . 2 . 3 . ]" 1 743 1 81 ALA HA 1 83 THR H . . 4.650 4.389 3.963 4.655 0.005 35 0 "[ . 1 . 2 . 3 . ]" 1 744 1 83 THR H 1 84 ILE MD . . 5.500 5.065 4.647 5.212 . 0 0 "[ . 1 . 2 . 3 . ]" 1 745 1 109 PRO HA 1 112 VAL H . . 4.340 3.796 3.327 4.124 . 0 0 "[ . 1 . 2 . 3 . ]" 1 746 1 79 LEU H 1 79 LEU HG . . 3.390 2.286 1.946 3.519 0.129 29 0 "[ . 1 . 2 . 3 . ]" 1 747 1 79 LEU H 1 79 LEU QD . . 3.760 2.531 1.665 3.173 . 0 0 "[ . 1 . 2 . 3 . ]" 1 748 1 58 VAL HA 1 61 LEU H . . 4.650 3.686 3.277 4.163 . 0 0 "[ . 1 . 2 . 3 . ]" 1 749 1 61 LEU H 1 61 LEU HG . . 4.730 2.928 1.882 4.039 . 0 0 "[ . 1 . 2 . 3 . ]" 1 750 1 100 TYR QD 1 120 GLN H . . 4.580 4.287 3.834 4.619 0.039 4 0 "[ . 1 . 2 . 3 . ]" 1 751 1 120 GLN H 1 121 GLY HA2 . . 4.980 5.014 4.793 5.216 0.236 33 0 "[ . 1 . 2 . 3 . ]" 1 752 1 119 LEU QD 1 120 GLN H . . 4.820 3.044 1.955 4.122 . 0 0 "[ . 1 . 2 . 3 . ]" 1 753 1 28 ASP H 1 33 ALA HA . . 4.600 4.505 3.706 4.706 0.106 37 0 "[ . 1 . 2 . 3 . ]" 1 754 1 28 ASP H 1 148 ALA MB . . 4.230 3.786 2.982 4.188 . 0 0 "[ . 1 . 2 . 3 . ]" 1 755 1 25 MET HA 1 28 ASP H . . 5.140 3.472 2.955 4.259 . 0 0 "[ . 1 . 2 . 3 . ]" 1 756 1 95 THR H 1 96 SER H . . 3.900 2.882 2.786 3.026 . 0 0 "[ . 1 . 2 . 3 . ]" 1 757 1 112 VAL H 1 113 VAL H . . 3.700 2.879 2.603 3.135 . 0 0 "[ . 1 . 2 . 3 . ]" 1 758 1 113 VAL QG 1 115 THR H . . 5.500 5.155 4.459 5.403 . 0 0 "[ . 1 . 2 . 3 . ]" 1 759 1 8 CYS H 1 142 CYS HB2 . . 4.660 2.237 1.887 2.434 . 0 0 "[ . 1 . 2 . 3 . ]" 1 760 1 8 CYS H 1 9 ALA MB . . 5.210 4.467 4.246 4.623 . 0 0 "[ . 1 . 2 . 3 . ]" 1 761 1 9 ALA H 1 10 GLU H . . 4.060 2.923 2.527 3.461 . 0 0 "[ . 1 . 2 . 3 . ]" 1 762 1 13 ALA H 1 14 ALA H . . 3.340 2.844 2.528 3.007 . 0 0 "[ . 1 . 2 . 3 . ]" 1 763 1 34 ALA MB 1 36 ASN H . . 5.170 4.178 4.081 4.273 . 0 0 "[ . 1 . 2 . 3 . ]" 1 764 1 12 ALA H 1 13 ALA H . . 3.630 2.972 2.657 3.186 . 0 0 "[ . 1 . 2 . 3 . ]" 1 765 1 156 ASP H 1 157 SER HA . . 5.010 4.965 4.685 5.168 0.158 3 0 "[ . 1 . 2 . 3 . ]" 1 766 1 141 VAL H 1 156 ASP H . . 5.010 4.711 4.035 5.095 0.085 6 0 "[ . 1 . 2 . 3 . ]" 1 767 1 122 ALA HA 1 123 SER H . . 3.180 2.545 2.274 2.793 . 0 0 "[ . 1 . 2 . 3 . ]" 1 768 1 103 VAL MG1 1 116 ARG HE . . 5.260 3.476 1.862 5.302 0.042 4 0 "[ . 1 . 2 . 3 . ]" 1 769 1 60 THR H 1 61 LEU H . . 3.530 2.818 2.126 3.098 . 0 0 "[ . 1 . 2 . 3 . ]" 1 770 1 132 SER H 1 133 LEU HB2 . . 5.000 4.736 3.611 5.135 0.135 3 0 "[ . 1 . 2 . 3 . ]" 1 771 1 11 TYR QR 1 15 ASN HD21 . . 4.120 3.096 2.275 3.655 . 0 0 "[ . 1 . 2 . 3 . ]" 1 772 1 11 TYR QR 1 15 ASN HD22 . . 5.240 3.562 2.487 4.242 . 0 0 "[ . 1 . 2 . 3 . ]" 1 773 1 37 ASN HB3 1 40 LEU H . . 5.150 2.229 1.947 2.646 . 0 0 "[ . 1 . 2 . 3 . ]" 1 774 1 76 PHE H 1 76 PHE QE . . 5.130 4.544 4.133 4.900 . 0 0 "[ . 1 . 2 . 3 . ]" 1 775 1 94 LEU H 1 94 LEU HB2 . . 4.120 3.277 2.920 3.412 . 0 0 "[ . 1 . 2 . 3 . ]" 1 776 1 94 LEU H 1 94 LEU MD1 . . 5.500 4.406 4.339 4.484 . 0 0 "[ . 1 . 2 . 3 . ]" 1 777 1 41 THR H 1 42 THR HA . . 5.440 5.490 5.399 5.551 0.111 36 0 "[ . 1 . 2 . 3 . ]" 1 778 1 45 ALA MB 1 50 GLN H . . 4.700 4.041 3.875 4.315 . 0 0 "[ . 1 . 2 . 3 . ]" 1 779 1 50 GLN H 1 51 LEU QB . . 5.110 4.635 4.464 4.778 . 0 0 "[ . 1 . 2 . 3 . ]" 1 780 1 95 THR H 1 98 LEU MD1 . . 3.980 3.898 3.606 4.033 0.053 31 0 "[ . 1 . 2 . 3 . ]" 1 781 1 52 ASN HA 1 54 GLN H . . 5.270 3.469 3.209 3.748 . 0 0 "[ . 1 . 2 . 3 . ]" 1 782 1 88 LYS H 1 90 ASN H . . 4.660 4.262 3.806 4.706 0.046 31 0 "[ . 1 . 2 . 3 . ]" 1 783 1 126 VAL MG2 1 136 GLY H . . 4.500 3.759 3.363 4.310 . 0 0 "[ . 1 . 2 . 3 . ]" 1 784 1 125 THR H 1 136 GLY H . . 5.500 3.528 2.593 4.368 . 0 0 "[ . 1 . 2 . 3 . ]" 1 785 1 11 TYR HA 1 15 ASN H . . 4.760 3.951 3.708 4.497 . 0 0 "[ . 1 . 2 . 3 . ]" 1 786 1 62 ASN H 1 63 SER H . . 3.370 3.370 2.543 3.485 0.115 3 0 "[ . 1 . 2 . 3 . ]" 1 787 1 72 THR H 1 72 THR HG1 . . 5.370 2.762 1.864 3.363 . 0 0 "[ . 1 . 2 . 3 . ]" 1 788 1 72 THR H 1 73 ASN H . . 5.330 4.556 4.403 4.657 . 0 0 "[ . 1 . 2 . 3 . ]" 1 789 1 72 THR H 1 155 ILE H . . 4.630 2.836 2.485 3.651 . 0 0 "[ . 1 . 2 . 3 . ]" 1 790 1 114 GLY H 1 126 VAL MG2 . . 4.450 3.899 3.468 4.469 0.019 24 0 "[ . 1 . 2 . 3 . ]" 1 791 1 113 VAL HB 1 114 GLY H . . 4.960 4.128 3.924 4.401 . 0 0 "[ . 1 . 2 . 3 . ]" 1 792 1 113 VAL H 1 114 GLY H . . 5.230 4.632 4.548 4.675 . 0 0 "[ . 1 . 2 . 3 . ]" 1 793 1 110 ALA H 1 111 ASN H . . 4.140 1.879 1.807 2.177 . 0 0 "[ . 1 . 2 . 3 . ]" 1 794 1 35 SER H 1 36 ASN H . . 3.910 2.934 2.616 3.439 . 0 0 "[ . 1 . 2 . 3 . ]" 1 795 1 117 GLN HE21 1 121 GLY HA2 . . 5.500 3.120 2.001 4.482 . 0 0 "[ . 1 . 2 . 3 . ]" 1 796 1 55 VAL HA 1 56 ASN HD21 . . 4.850 3.424 2.701 5.216 0.366 36 0 "[ . 1 . 2 . 3 . ]" 1 797 1 48 SER H 1 49 GLY H . . 4.450 3.177 3.001 3.305 . 0 0 "[ . 1 . 2 . 3 . ]" 1 798 1 47 LEU HA 1 49 GLY H . . 5.150 4.932 4.358 5.191 0.041 36 0 "[ . 1 . 2 . 3 . ]" 1 799 1 25 MET HG2 1 26 SER H . . 5.040 2.903 2.513 3.246 . 0 0 "[ . 1 . 2 . 3 . ]" 1 800 1 44 THR HA 1 48 SER H . . 5.090 3.168 2.828 3.336 . 0 0 "[ . 1 . 2 . 3 . ]" 1 801 1 48 SER H 1 50 GLN H . . 4.710 4.729 4.573 4.814 0.104 16 0 "[ . 1 . 2 . 3 . ]" 1 802 1 63 SER H 1 64 GLY H . . 3.940 3.330 2.742 3.808 . 0 0 "[ . 1 . 2 . 3 . ]" 1 803 1 97 ILE MG 1 101 HIS H . . 5.050 4.328 4.182 4.461 . 0 0 "[ . 1 . 2 . 3 . ]" 1 804 1 51 LEU HA 1 52 ASN HD21 . . 4.930 4.638 4.048 5.095 0.165 30 0 "[ . 1 . 2 . 3 . ]" 1 805 1 118 THR HB 1 121 GLY H . . 4.660 4.155 3.562 4.601 . 0 0 "[ . 1 . 2 . 3 . ]" 1 806 1 24 GLY H 1 25 MET H . . 3.770 2.816 2.524 3.202 . 0 0 "[ . 1 . 2 . 3 . ]" 1 807 1 101 HIS H 1 102 VAL H . . 3.860 2.722 2.546 2.864 . 0 0 "[ . 1 . 2 . 3 . ]" 1 808 1 13 ALA H 1 15 ASN H . . 4.530 4.222 3.966 4.430 . 0 0 "[ . 1 . 2 . 3 . ]" 1 809 1 55 VAL H 1 56 ASN H . . 5.210 4.408 4.238 4.489 . 0 0 "[ . 1 . 2 . 3 . ]" 1 810 1 37 ASN H 1 39 GLU H . . 5.500 4.835 4.561 4.979 . 0 0 "[ . 1 . 2 . 3 . ]" 1 811 1 12 ALA HA 1 15 ASN H . . 4.640 3.019 2.530 3.311 . 0 0 "[ . 1 . 2 . 3 . ]" 1 812 1 11 TYR HA 1 14 ALA H . . 4.470 3.401 3.086 3.645 . 0 0 "[ . 1 . 2 . 3 . ]" 1 813 1 22 VAL HA 1 25 MET H . . 5.500 4.094 3.741 4.467 . 0 0 "[ . 1 . 2 . 3 . ]" 1 814 1 41 THR HA 1 44 THR H . . 4.230 3.710 3.096 4.105 . 0 0 "[ . 1 . 2 . 3 . ]" 1 815 1 82 SER HA 1 85 ASP H . . 4.380 3.632 3.235 4.233 . 0 0 "[ . 1 . 2 . 3 . ]" 1 816 1 99 THR HB 1 100 TYR H . . 4.950 3.478 3.184 3.739 . 0 0 "[ . 1 . 2 . 3 . ]" 1 817 1 99 THR HB 1 120 GLN H . . 4.410 2.801 2.142 3.385 . 0 0 "[ . 1 . 2 . 3 . ]" 1 818 1 118 THR HA 1 120 GLN H . . 5.100 4.166 3.707 4.974 . 0 0 "[ . 1 . 2 . 3 . ]" 1 819 1 69 PHE QD 1 103 VAL H . . 5.260 2.618 2.216 3.291 . 0 0 "[ . 1 . 2 . 3 . ]" 1 820 1 28 ASP HB2 1 33 ALA H . . 4.690 3.175 2.582 4.120 . 0 0 "[ . 1 . 2 . 3 . ]" 1 821 1 134 LYS H 1 140 VAL QG . . 5.500 2.848 2.511 3.282 . 0 0 "[ . 1 . 2 . 3 . ]" 1 822 1 11 TYR HB3 1 12 ALA H . . 3.570 2.016 1.885 2.312 . 0 0 "[ . 1 . 2 . 3 . ]" 1 823 1 114 GLY H 1 126 VAL MG1 . . 4.130 3.388 2.874 3.795 . 0 0 "[ . 1 . 2 . 3 . ]" 1 824 1 23 GLN HB2 1 24 GLY H . . 4.330 3.839 2.674 4.197 . 0 0 "[ . 1 . 2 . 3 . ]" 1 825 1 21 SER HB3 1 24 GLY H . . 5.150 3.711 2.655 4.542 . 0 0 "[ . 1 . 2 . 3 . ]" 1 826 1 129 GLN QG 1 130 GLY H . . 5.270 3.162 1.843 4.225 . 0 0 "[ . 1 . 2 . 3 . ]" 1 827 1 155 ILE MG 1 157 SER H . . 4.570 4.466 4.130 4.647 0.077 13 0 "[ . 1 . 2 . 3 . ]" 1 828 1 98 LEU MD2 1 99 THR H . . 4.750 4.259 4.182 4.337 . 0 0 "[ . 1 . 2 . 3 . ]" 1 829 1 75 ALA H 1 158 VAL QG . . 4.960 4.490 4.070 4.910 . 0 0 "[ . 1 . 2 . 3 . ]" 1 830 1 111 ASN HB3 1 112 VAL H . . 5.090 3.535 3.055 4.081 . 0 0 "[ . 1 . 2 . 3 . ]" 1 831 1 8 CYS H 1 141 VAL QG . . 5.110 3.511 3.246 4.024 . 0 0 "[ . 1 . 2 . 3 . ]" 1 832 1 36 ASN H 1 37 ASN HB2 . . 5.100 3.838 3.164 4.533 . 0 0 "[ . 1 . 2 . 3 . ]" 1 833 1 62 ASN HA 1 64 GLY H . . 5.500 5.505 5.135 5.570 0.070 7 0 "[ . 1 . 2 . 3 . ]" 1 834 1 13 ALA MB 1 14 ALA H . . 3.690 2.659 2.387 2.890 . 0 0 "[ . 1 . 2 . 3 . ]" 1 835 1 155 ILE HB 1 159 LEU H . . 5.500 5.132 4.671 5.482 . 0 0 "[ . 1 . 2 . 3 . ]" 1 836 1 144 GLY H 1 145 VAL MG2 . . 5.220 3.467 3.260 3.751 . 0 0 "[ . 1 . 2 . 3 . ]" 1 837 1 101 HIS H 1 101 HIS HD1 . . 5.500 5.112 4.867 5.281 . 0 0 "[ . 1 . 2 . 3 . ]" 1 838 1 98 LEU H 1 100 TYR H . . 5.060 4.273 4.084 4.453 . 0 0 "[ . 1 . 2 . 3 . ]" 1 839 1 100 TYR H 1 118 THR HB . . 5.310 4.720 4.363 5.315 0.005 18 0 "[ . 1 . 2 . 3 . ]" 1 840 1 57 LEU H 1 61 LEU QD . . 5.500 4.386 3.467 4.983 . 0 0 "[ . 1 . 2 . 3 . ]" 1 841 1 153 TYR HB2 1 154 MET H . . 5.500 4.568 4.549 4.581 . 0 0 "[ . 1 . 2 . 3 . ]" 1 842 1 142 CYS HB2 1 154 MET H . . 5.500 5.301 4.896 5.456 . 0 0 "[ . 1 . 2 . 3 . ]" 1 843 1 90 ASN HB2 1 93 LEU H . . 5.500 3.657 3.054 4.224 . 0 0 "[ . 1 . 2 . 3 . ]" 1 844 1 39 GLU H 1 40 LEU QD . . 5.500 3.349 2.139 3.940 . 0 0 "[ . 1 . 2 . 3 . ]" 1 845 1 47 LEU H 1 49 GLY H . . 5.500 4.680 4.220 4.918 . 0 0 "[ . 1 . 2 . 3 . ]" 1 846 1 65 GLN HA 1 149 ASN H . . 5.500 5.538 5.374 5.624 0.124 37 0 "[ . 1 . 2 . 3 . ]" 1 847 1 99 THR H 1 100 TYR HB2 . . 5.500 4.988 4.846 5.121 . 0 0 "[ . 1 . 2 . 3 . ]" 1 848 1 99 THR H 1 100 TYR HB3 . . 5.500 4.999 4.746 5.212 . 0 0 "[ . 1 . 2 . 3 . ]" 1 849 1 144 GLY H 1 153 TYR QE . . 5.500 3.118 2.647 3.363 . 0 0 "[ . 1 . 2 . 3 . ]" 1 850 1 87 LEU HB2 1 89 THR H . . 5.500 4.872 4.504 5.061 . 0 0 "[ . 1 . 2 . 3 . ]" 1 851 1 86 GLU QG 1 89 THR H . . 5.500 4.473 3.964 5.226 . 0 0 "[ . 1 . 2 . 3 . ]" 1 852 1 4 VAL H 1 142 CYS HA . . 5.500 4.451 3.699 4.866 . 0 0 "[ . 1 . 2 . 3 . ]" 1 853 1 159 LEU H 1 160 MET H . . 5.500 4.495 4.077 4.675 . 0 0 "[ . 1 . 2 . 3 . ]" 1 854 1 100 TYR QD 1 118 THR H . . 5.500 4.181 3.884 4.697 . 0 0 "[ . 1 . 2 . 3 . ]" 1 855 1 109 PRO HG2 1 110 ALA H . . 5.500 4.924 3.898 5.089 . 0 0 "[ . 1 . 2 . 3 . ]" 1 856 1 109 PRO HG3 1 110 ALA H . . 5.500 5.504 4.783 5.619 0.119 34 0 "[ . 1 . 2 . 3 . ]" 1 857 1 109 PRO HD3 1 110 ALA H . . 5.500 4.583 3.845 4.735 . 0 0 "[ . 1 . 2 . 3 . ]" 1 858 1 80 PRO HG2 1 81 ALA H . . 5.500 5.036 4.079 5.248 . 0 0 "[ . 1 . 2 . 3 . ]" 1 859 1 53 PRO QG 1 54 GLN H . . 5.500 3.928 3.431 4.311 . 0 0 "[ . 1 . 2 . 3 . ]" 1 860 1 37 ASN HA 1 39 GLU H . . 5.500 3.616 3.531 3.692 . 0 0 "[ . 1 . 2 . 3 . ]" 1 861 1 38 PRO HD3 1 39 GLU H . . 5.500 3.896 3.836 3.992 . 0 0 "[ . 1 . 2 . 3 . ]" 1 862 1 30 VAL H 1 33 ALA MB . . 5.500 3.545 2.983 3.915 . 0 0 "[ . 1 . 2 . 3 . ]" 1 863 1 7 GLY H 1 142 CYS HA . . 5.500 5.048 4.138 5.513 0.013 11 0 "[ . 1 . 2 . 3 . ]" 1 864 1 128 GLY H 1 133 LEU QD . . 5.500 4.399 3.789 4.997 . 0 0 "[ . 1 . 2 . 3 . ]" 1 865 1 25 MET HG3 1 26 SER H . . 5.500 2.970 2.472 3.212 . 0 0 "[ . 1 . 2 . 3 . ]" 1 866 1 153 TYR QD 1 154 MET H . . 5.500 4.799 4.674 4.877 . 0 0 "[ . 1 . 2 . 3 . ]" 1 867 1 34 ALA H 1 36 ASN H . . 5.500 4.246 3.636 5.000 . 0 0 "[ . 1 . 2 . 3 . ]" 1 868 1 135 VAL H 1 136 GLY H . . 5.500 3.996 3.583 4.252 . 0 0 "[ . 1 . 2 . 3 . ]" 1 869 1 115 THR HB 1 116 ARG H . . 5.500 4.503 4.078 4.669 . 0 0 "[ . 1 . 2 . 3 . ]" 1 870 1 66 TYR H 1 67 THR H . . 5.500 4.409 4.356 4.455 . 0 0 "[ . 1 . 2 . 3 . ]" 1 871 1 117 GLN HE22 1 121 GLY HA2 . . 5.270 4.360 3.342 5.204 . 0 0 "[ . 1 . 2 . 3 . ]" 1 872 1 77 SER H 1 84 ILE MD . . 5.500 5.106 4.754 5.376 . 0 0 "[ . 1 . 2 . 3 . ]" 1 873 1 98 LEU H 1 99 THR HG1 . . 5.500 4.454 3.753 5.487 . 0 0 "[ . 1 . 2 . 3 . ]" 1 874 1 100 TYR H 1 102 VAL H . . 5.500 4.374 4.208 4.506 . 0 0 "[ . 1 . 2 . 3 . ]" 1 875 1 136 GLY HA2 1 138 ALA H . . 5.500 4.582 4.078 5.419 . 0 0 "[ . 1 . 2 . 3 . ]" 1 876 1 129 GLN H 1 133 LEU HB2 . . 5.500 5.482 4.928 5.651 0.151 8 0 "[ . 1 . 2 . 3 . ]" 1 877 1 40 LEU HB3 1 41 THR H . . 5.500 4.188 3.928 4.523 . 0 0 "[ . 1 . 2 . 3 . ]" 1 878 1 113 VAL H 1 126 VAL HB . . 5.500 4.256 3.753 4.632 . 0 0 "[ . 1 . 2 . 3 . ]" 1 879 1 143 GLY H 1 153 TYR QD . . 5.500 4.212 4.068 4.471 . 0 0 "[ . 1 . 2 . 3 . ]" 1 880 1 46 ALA MB 1 49 GLY H . . 5.500 4.919 4.595 5.093 . 0 0 "[ . 1 . 2 . 3 . ]" 1 881 1 68 VAL H 1 153 TYR QE . . 5.500 5.362 5.191 5.527 0.027 11 0 "[ . 1 . 2 . 3 . ]" 1 882 1 30 VAL H 1 150 ALA H . . 5.500 4.632 4.067 5.180 . 0 0 "[ . 1 . 2 . 3 . ]" 1 883 1 26 SER H 1 147 THR MG . . 5.500 4.391 4.027 4.627 . 0 0 "[ . 1 . 2 . 3 . ]" 1 884 1 26 SER H 1 145 VAL MG1 . . 5.500 5.195 4.701 5.540 0.040 7 0 "[ . 1 . 2 . 3 . ]" 1 885 1 98 LEU HG 1 100 TYR H . . 5.500 5.586 5.520 5.652 0.152 23 0 "[ . 1 . 2 . 3 . ]" 1 886 1 72 THR HB 1 75 ALA H . . 5.500 4.042 3.644 4.999 . 0 0 "[ . 1 . 2 . 3 . ]" 1 887 1 72 THR HG1 1 73 ASN H . . 5.500 3.851 2.828 4.698 . 0 0 "[ . 1 . 2 . 3 . ]" 1 888 1 100 TYR HB2 1 120 GLN H . . 5.500 4.729 4.004 5.340 . 0 0 "[ . 1 . 2 . 3 . ]" 1 889 1 17 THR H 1 21 SER HB3 . . 5.220 4.368 3.734 5.226 0.006 34 0 "[ . 1 . 2 . 3 . ]" 1 890 1 69 PHE H 1 103 VAL H . . 5.130 4.776 4.452 5.225 0.095 20 0 "[ . 1 . 2 . 3 . ]" 1 891 1 90 ASN HD21 1 91 SER H . . 5.500 4.386 3.862 5.504 0.004 2 0 "[ . 1 . 2 . 3 . ]" 1 892 1 120 GLN HE22 1 122 ALA MB . . 5.500 4.825 2.968 5.617 0.117 13 0 "[ . 1 . 2 . 3 . ]" 1 893 1 39 GLU QB 1 73 ASN H . . 5.500 2.416 1.897 2.956 . 0 0 "[ . 1 . 2 . 3 . ]" 1 894 1 37 ASN HD21 1 40 LEU QD . . 4.850 2.976 2.003 4.340 . 0 0 "[ . 1 . 2 . 3 . ]" 1 895 1 37 ASN HD22 1 40 LEU QD . . 5.300 3.528 2.616 4.406 . 0 0 "[ . 1 . 2 . 3 . ]" 1 896 1 86 GLU QG 1 90 ASN HD22 . . 5.500 2.068 1.882 2.404 . 0 0 "[ . 1 . 2 . 3 . ]" 1 897 1 87 LEU HB3 1 90 ASN HD22 . . 4.720 4.767 4.671 4.838 0.118 15 0 "[ . 1 . 2 . 3 . ]" 1 898 1 87 LEU MD1 1 90 ASN HD22 . . 4.720 4.707 4.631 4.816 0.096 7 0 "[ . 1 . 2 . 3 . ]" 1 899 1 87 LEU HB3 1 90 ASN HD21 . . 4.500 3.756 3.537 3.991 . 0 0 "[ . 1 . 2 . 3 . ]" 1 900 1 87 LEU MD1 1 90 ASN HD21 . . 4.040 4.087 3.993 4.184 0.144 6 0 "[ . 1 . 2 . 3 . ]" 1 901 1 88 LYS H 1 88 LYS HE2 . . 5.500 4.968 4.191 5.559 0.059 19 0 "[ . 1 . 2 . 3 . ]" 1 902 1 88 LYS H 1 88 LYS HE3 . . 5.500 4.518 3.345 5.553 0.053 11 0 "[ . 1 . 2 . 3 . ]" 1 903 1 106 GLN H 1 106 GLN HB3 . . 4.050 3.413 2.959 4.084 0.034 22 0 "[ . 1 . 2 . 3 . ]" 1 904 1 4 VAL QG 1 153 TYR QD . . 4.280 3.841 3.499 4.141 . 0 0 "[ . 1 . 2 . 3 . ]" 1 905 1 4 VAL QG 1 153 TYR QE . . 3.880 3.362 3.101 3.638 . 0 0 "[ . 1 . 2 . 3 . ]" 1 906 1 106 GLN QG 1 150 ALA HA . . 3.250 2.133 1.887 2.911 . 0 0 "[ . 1 . 2 . 3 . ]" 1 907 1 66 TYR QD 1 104 ALA HA . . 2.990 2.503 2.136 2.928 . 0 0 "[ . 1 . 2 . 3 . ]" 1 908 1 67 THR H 1 104 ALA HA . . 4.620 4.046 3.846 4.235 . 0 0 "[ . 1 . 2 . 3 . ]" 1 909 1 66 TYR QE 1 104 ALA HA . . 3.700 3.749 3.629 3.826 0.126 24 0 "[ . 1 . 2 . 3 . ]" 1 910 1 8 CYS HA 1 11 TYR QR . . 4.450 3.199 2.310 3.831 . 0 0 "[ . 1 . 2 . 3 . ]" 1 911 1 8 CYS QB 1 11 TYR QR . . 5.400 4.831 4.188 5.374 . 0 0 "[ . 1 . 2 . 3 . ]" 1 912 1 11 TYR QR 1 15 ASN HB3 . . 4.340 4.192 3.805 4.356 0.016 14 0 "[ . 1 . 2 . 3 . ]" 1 913 1 42 THR MG 1 76 PHE QD . . 3.350 2.474 1.930 2.885 . 0 0 "[ . 1 . 2 . 3 . ]" 1 914 1 42 THR MG 1 76 PHE QE . . 3.980 3.081 2.435 3.617 . 0 0 "[ . 1 . 2 . 3 . ]" 1 915 1 42 THR MG 1 43 LEU H . . 4.430 2.826 1.775 3.644 . 0 0 "[ . 1 . 2 . 3 . ]" 1 916 1 42 THR MG 1 76 PHE HZ . . 4.880 3.911 3.265 4.404 . 0 0 "[ . 1 . 2 . 3 . ]" 1 917 1 43 LEU HA 1 76 PHE QE . . 3.910 2.996 2.850 3.153 . 0 0 "[ . 1 . 2 . 3 . ]" 1 918 1 43 LEU HA 1 76 PHE HZ . . 4.080 2.297 1.967 3.084 . 0 0 "[ . 1 . 2 . 3 . ]" 1 919 1 43 LEU HA 1 76 PHE QD . . 5.160 4.517 4.345 4.703 . 0 0 "[ . 1 . 2 . 3 . ]" 1 920 1 43 LEU HA 1 47 LEU H . . 5.500 4.414 4.271 4.635 . 0 0 "[ . 1 . 2 . 3 . ]" 1 921 1 43 LEU HB3 1 76 PHE QE . . 3.510 2.631 2.338 3.422 . 0 0 "[ . 1 . 2 . 3 . ]" 1 922 1 43 LEU HB2 1 76 PHE QE . . 3.740 2.088 1.898 2.322 . 0 0 "[ . 1 . 2 . 3 . ]" 1 923 1 43 LEU HB2 1 76 PHE HZ . . 4.800 2.208 1.917 2.854 . 0 0 "[ . 1 . 2 . 3 . ]" 1 924 1 43 LEU HB2 1 76 PHE QD . . 5.170 4.392 4.219 4.614 . 0 0 "[ . 1 . 2 . 3 . ]" 1 925 1 43 LEU HB3 1 44 THR H . . 3.840 3.060 2.447 3.367 . 0 0 "[ . 1 . 2 . 3 . ]" 1 926 1 43 LEU H 1 43 LEU HB3 . . 3.650 2.016 1.978 2.221 . 0 0 "[ . 1 . 2 . 3 . ]" 1 927 1 46 ALA H 1 46 ALA MB . . 2.910 2.130 2.031 2.161 . 0 0 "[ . 1 . 2 . 3 . ]" 1 928 1 46 ALA MB 1 47 LEU H . . 3.430 1.963 1.909 2.068 . 0 0 "[ . 1 . 2 . 3 . ]" 1 929 1 46 ALA MB 1 76 PHE HZ . . 4.200 3.671 3.385 4.046 . 0 0 "[ . 1 . 2 . 3 . ]" 1 930 1 46 ALA MB 1 76 PHE QE . . 4.500 3.487 3.114 3.986 . 0 0 "[ . 1 . 2 . 3 . ]" 1 931 1 55 VAL H 1 55 VAL HB . . 3.570 3.029 2.433 3.799 0.229 9 0 "[ . 1 . 2 . 3 . ]" 1 932 1 48 SER H 1 58 VAL QG . . 4.790 3.254 2.172 3.868 . 0 0 "[ . 1 . 2 . 3 . ]" 1 933 1 60 THR HA 1 66 TYR QE . . 5.350 4.456 4.044 4.978 . 0 0 "[ . 1 . 2 . 3 . ]" 1 934 1 61 LEU HA 1 66 TYR QD . . 3.790 2.114 1.857 2.812 . 0 0 "[ . 1 . 2 . 3 . ]" 1 935 1 61 LEU HA 1 66 TYR QE . . 2.980 2.011 1.893 2.345 . 0 0 "[ . 1 . 2 . 3 . ]" 1 936 1 61 LEU QD 1 66 TYR QD . . 3.960 2.242 1.756 2.858 . 0 0 "[ . 1 . 2 . 3 . ]" 1 937 1 61 LEU QD 1 66 TYR QE . . 3.730 2.400 1.909 3.166 . 0 0 "[ . 1 . 2 . 3 . ]" 1 938 1 64 GLY HA3 1 66 TYR QE . . 3.970 3.136 2.798 3.997 0.027 9 0 "[ . 1 . 2 . 3 . ]" 1 939 1 64 GLY HA2 1 66 TYR QE . . 4.520 4.577 4.348 4.703 0.183 24 0 "[ . 1 . 2 . 3 . ]" 1 940 1 65 GLN HA 1 66 TYR QD . . 4.590 4.000 3.799 4.182 . 0 0 "[ . 1 . 2 . 3 . ]" 1 941 1 67 THR HA 1 68 VAL H . . 3.030 2.280 2.241 2.304 . 0 0 "[ . 1 . 2 . 3 . ]" 1 942 1 67 THR HA 1 153 TYR QE . . 4.490 4.008 3.868 4.212 . 0 0 "[ . 1 . 2 . 3 . ]" 1 943 1 67 THR HA 1 153 TYR QD . . 4.860 4.093 3.825 4.348 . 0 0 "[ . 1 . 2 . 3 . ]" 1 944 1 67 THR H 1 67 THR HB . . 3.640 2.935 2.870 2.979 . 0 0 "[ . 1 . 2 . 3 . ]" 1 945 1 67 THR HB 1 103 VAL H . . 4.000 2.775 2.453 3.092 . 0 0 "[ . 1 . 2 . 3 . ]" 1 946 1 67 THR HB 1 153 TYR QE . . 4.060 4.361 4.319 4.404 0.344 1 0 "[ . 1 . 2 . 3 . ]" 1 947 1 67 THR MG 1 153 TYR QE . . 2.780 1.708 1.667 1.759 . 0 0 "[ . 1 . 2 . 3 . ]" 1 948 1 67 THR MG 1 153 TYR QD . . 3.200 2.072 1.904 2.266 . 0 0 "[ . 1 . 2 . 3 . ]" 1 949 1 67 THR MG 1 68 VAL H . . 3.590 3.578 3.460 3.665 0.075 15 0 "[ . 1 . 2 . 3 . ]" 1 950 1 67 THR MG 1 152 VAL H . . 4.040 4.069 3.930 4.148 0.108 18 0 "[ . 1 . 2 . 3 . ]" 1 951 1 68 VAL HA 1 103 VAL H . . 4.420 3.955 3.750 4.160 . 0 0 "[ . 1 . 2 . 3 . ]" 1 952 1 68 VAL H 1 68 VAL HB . . 3.530 2.594 2.419 2.719 . 0 0 "[ . 1 . 2 . 3 . ]" 1 953 1 68 VAL HB 1 153 TYR H . . 4.780 3.152 2.730 3.498 . 0 0 "[ . 1 . 2 . 3 . ]" 1 954 1 68 VAL H 1 68 VAL MG1 . . 4.290 3.685 3.657 3.701 . 0 0 "[ . 1 . 2 . 3 . ]" 1 955 1 68 VAL MG1 1 153 TYR H . . 5.020 3.502 3.087 3.783 . 0 0 "[ . 1 . 2 . 3 . ]" 1 956 1 69 PHE QD 1 103 VAL MG2 . . 3.330 2.423 1.894 2.973 . 0 0 "[ . 1 . 2 . 3 . ]" 1 957 1 68 VAL H 1 68 VAL MG2 . . 3.280 1.899 1.817 2.078 . 0 0 "[ . 1 . 2 . 3 . ]" 1 958 1 68 VAL MG2 1 69 PHE H . . 4.110 4.136 4.000 4.216 0.106 15 0 "[ . 1 . 2 . 3 . ]" 1 959 1 70 ALA HA 1 101 HIS HE1 . . 4.420 4.550 4.382 4.635 0.215 20 0 "[ . 1 . 2 . 3 . ]" 1 960 1 70 ALA HA 1 76 PHE QE . . 5.020 5.186 5.118 5.276 0.256 30 0 "[ . 1 . 2 . 3 . ]" 1 961 1 73 ASN HA 1 76 PHE QD . . 3.500 3.224 2.939 3.538 0.038 20 0 "[ . 1 . 2 . 3 . ]" 1 962 1 73 ASN HA 1 76 PHE QE . . 5.500 5.159 4.745 5.572 0.072 5 0 "[ . 1 . 2 . 3 . ]" 1 963 1 72 THR H 1 75 ALA MB . . 3.580 2.512 2.095 2.966 . 0 0 "[ . 1 . 2 . 3 . ]" 1 964 1 75 ALA MB 1 157 SER H . . 3.910 2.151 1.898 2.512 . 0 0 "[ . 1 . 2 . 3 . ]" 1 965 1 75 ALA MB 1 76 PHE QD . . 4.140 3.034 2.608 3.371 . 0 0 "[ . 1 . 2 . 3 . ]" 1 966 1 75 ALA MB 1 76 PHE QE . . 4.090 3.990 3.645 4.153 0.063 3 0 "[ . 1 . 2 . 3 . ]" 1 967 1 76 PHE QD 1 84 ILE MD . . 3.540 2.325 1.927 2.594 . 0 0 "[ . 1 . 2 . 3 . ]" 1 968 1 76 PHE QE 1 84 ILE MD . . 4.540 3.928 3.522 4.199 . 0 0 "[ . 1 . 2 . 3 . ]" 1 969 1 93 LEU HG 1 94 LEU H . . 4.660 2.960 2.317 3.553 . 0 0 "[ . 1 . 2 . 3 . ]" 1 970 1 123 SER QB 1 124 VAL H . . 3.510 2.913 2.528 3.331 . 0 0 "[ . 1 . 2 . 3 . ]" 1 971 1 97 ILE MG 1 101 HIS HD2 . . 3.140 1.816 1.684 1.957 . 0 0 "[ . 1 . 2 . 3 . ]" 1 972 1 97 ILE MG 1 100 TYR QD . . 5.100 4.330 3.737 4.976 . 0 0 "[ . 1 . 2 . 3 . ]" 1 973 1 76 PHE HZ 1 97 ILE MG . . 5.500 3.992 3.361 4.490 . 0 0 "[ . 1 . 2 . 3 . ]" 1 974 1 76 PHE QE 1 97 ILE MG . . 5.500 3.727 2.894 4.344 . 0 0 "[ . 1 . 2 . 3 . ]" 1 975 1 97 ILE H 1 97 ILE QG . . 3.970 2.993 2.533 3.357 . 0 0 "[ . 1 . 2 . 3 . ]" 1 976 1 97 ILE H 1 97 ILE MD . . 3.980 3.145 2.869 3.954 . 0 0 "[ . 1 . 2 . 3 . ]" 1 977 1 97 ILE MD 1 98 LEU H . . 5.240 4.415 4.247 4.634 . 0 0 "[ . 1 . 2 . 3 . ]" 1 978 1 94 LEU H 1 97 ILE MD . . 5.500 4.752 4.310 5.490 . 0 0 "[ . 1 . 2 . 3 . ]" 1 979 1 98 LEU HA 1 101 HIS H . . 4.530 3.375 3.277 3.496 . 0 0 "[ . 1 . 2 . 3 . ]" 1 980 1 98 LEU HA 1 100 TYR H . . 4.800 4.542 4.347 4.672 . 0 0 "[ . 1 . 2 . 3 . ]" 1 981 1 98 LEU HA 1 101 HIS HD2 . . 4.610 3.281 2.581 3.767 . 0 0 "[ . 1 . 2 . 3 . ]" 1 982 1 98 LEU H 1 98 LEU HB2 . . 3.690 2.973 2.869 3.088 . 0 0 "[ . 1 . 2 . 3 . ]" 1 983 1 98 LEU H 1 98 LEU MD1 . . 4.250 3.484 3.448 3.531 . 0 0 "[ . 1 . 2 . 3 . ]" 1 984 1 47 LEU H 1 98 LEU MD1 . . 4.990 2.832 2.404 3.639 . 0 0 "[ . 1 . 2 . 3 . ]" 1 985 1 98 LEU MD1 1 99 THR H . . 5.160 4.135 4.034 4.311 . 0 0 "[ . 1 . 2 . 3 . ]" 1 986 1 98 LEU H 1 98 LEU MD2 . . 3.820 2.111 1.927 2.315 . 0 0 "[ . 1 . 2 . 3 . ]" 1 987 1 76 PHE HZ 1 98 LEU MD2 . . 3.840 3.718 3.333 3.914 0.074 36 0 "[ . 1 . 2 . 3 . ]" 1 988 1 76 PHE QE 1 98 LEU MD2 . . 4.610 3.765 3.359 4.034 . 0 0 "[ . 1 . 2 . 3 . ]" 1 989 1 99 THR HA 1 102 VAL H . . 4.350 4.112 3.864 4.274 . 0 0 "[ . 1 . 2 . 3 . ]" 1 990 1 99 THR H 1 99 THR MG . . 3.420 2.184 1.871 2.512 . 0 0 "[ . 1 . 2 . 3 . ]" 1 991 1 99 THR MG 1 100 TYR H . . 4.750 3.965 3.749 4.119 . 0 0 "[ . 1 . 2 . 3 . ]" 1 992 1 69 PHE QD 1 103 VAL HA . . 4.850 4.513 4.378 4.670 . 0 0 "[ . 1 . 2 . 3 . ]" 1 993 1 67 THR H 1 103 VAL HB . . 4.370 3.779 3.409 4.082 . 0 0 "[ . 1 . 2 . 3 . ]" 1 994 1 69 PHE QE 1 103 VAL HB . . 4.980 1.872 1.677 2.148 . 0 0 "[ . 1 . 2 . 3 . ]" 1 995 1 109 PRO HA 1 153 TYR QE . . 3.440 2.729 2.335 3.000 . 0 0 "[ . 1 . 2 . 3 . ]" 1 996 1 109 PRO HA 1 153 TYR QD . . 5.080 4.899 4.337 5.077 . 0 0 "[ . 1 . 2 . 3 . ]" 1 997 1 109 PRO HG3 1 153 TYR QE . . 3.850 3.312 3.140 3.489 . 0 0 "[ . 1 . 2 . 3 . ]" 1 998 1 109 PRO HB2 1 153 TYR QE . . 3.860 3.578 3.468 3.669 . 0 0 "[ . 1 . 2 . 3 . ]" 1 999 1 109 PRO HB3 1 153 TYR QE . . 4.080 1.876 1.807 2.083 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1000 1 100 TYR QD 1 118 THR HB . . 4.190 3.035 2.179 3.696 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1001 1 100 TYR QE 1 118 THR MG . . 3.660 2.472 1.877 2.967 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1002 1 100 TYR QD 1 118 THR MG . . 3.620 2.334 1.798 2.886 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1003 1 66 TYR QE 1 119 LEU QD . . 3.390 2.781 2.123 3.242 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1004 1 102 VAL H 1 119 LEU QD . . 4.850 3.986 3.020 4.579 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1005 1 103 VAL H 1 119 LEU QD . . 5.050 4.616 3.714 5.044 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1006 1 100 TYR QE 1 122 ALA MB . . 3.000 2.624 2.040 3.104 0.104 15 0 "[ . 1 . 2 . 3 . ]" 1 1007 1 100 TYR QD 1 122 ALA MB . . 3.570 2.648 2.297 3.275 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1008 1 123 SER HA 1 124 VAL H . . 3.180 2.334 2.238 2.457 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1009 1 100 TYR QE 1 123 SER HA . . 4.800 4.038 3.530 4.600 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1010 1 100 TYR QE 1 124 VAL HA . . 4.400 3.169 2.742 3.662 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1011 1 124 VAL H 1 124 VAL HB . . 4.140 3.122 2.849 3.377 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1012 1 100 TYR QE 1 124 VAL HB . . 3.980 3.311 2.643 4.445 0.465 15 0 "[ . 1 . 2 . 3 . ]" 1 1013 1 100 TYR QE 1 124 VAL QG . . 3.900 3.147 1.821 3.610 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1014 1 124 VAL H 1 124 VAL QG . . 3.650 1.954 1.798 2.123 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1015 1 69 PHE QE 1 124 VAL QG . . 3.740 3.165 2.997 3.466 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1016 1 100 TYR QD 1 124 VAL QG . . 4.750 3.943 2.764 4.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1017 1 69 PHE QD 1 124 VAL QG . . 4.350 3.375 3.007 3.641 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1018 1 69 PHE HZ 1 124 VAL QG . . 3.920 3.495 3.285 3.846 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1019 1 126 VAL HA 1 135 VAL H . . 5.200 4.601 4.223 4.987 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1020 1 133 LEU HA 1 134 LYS H . . 3.040 2.394 2.178 2.632 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1021 1 133 LEU HB2 1 134 LYS H . . 4.740 3.996 3.168 4.636 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1022 1 133 LEU HB3 1 134 LYS H . . 3.990 2.821 2.265 3.856 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1023 1 133 LEU QD 1 153 TYR QE . . 3.690 3.563 3.270 3.715 0.025 14 0 "[ . 1 . 2 . 3 . ]" 1 1024 1 133 LEU QD 1 153 TYR QD . . 4.040 3.796 3.384 4.035 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1025 1 134 LYS HA 1 135 VAL H . . 2.950 2.411 2.273 2.497 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1026 1 134 LYS HB2 1 135 VAL H . . 4.850 4.115 3.896 4.337 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1027 1 134 LYS HB3 1 135 VAL H . . 3.840 2.828 2.531 3.190 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1028 1 134 LYS H 1 134 LYS HB3 . . 3.960 3.512 3.345 3.707 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1029 1 134 LYS HG3 1 135 VAL H . . 4.510 4.586 4.381 4.873 0.363 24 0 "[ . 1 . 2 . 3 . ]" 1 1030 1 134 LYS H 1 134 LYS HG3 . . 4.400 4.043 3.490 4.332 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1031 1 134 LYS H 1 134 LYS HG2 . . 4.660 4.335 4.162 4.549 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1032 1 134 LYS HG2 1 135 VAL H . . 5.000 3.246 3.051 3.651 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1033 1 69 PHE QD 1 135 VAL HB . . 5.120 3.719 3.332 3.860 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1034 1 135 VAL H 1 135 VAL QG . . 3.770 3.186 3.061 3.280 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1035 1 69 PHE QD 1 135 VAL QG . . 3.570 1.865 1.767 1.971 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1036 1 69 PHE QE 1 135 VAL QG . . 3.740 1.892 1.725 2.044 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1037 1 135 VAL QG 1 153 TYR QD . . 4.730 4.134 3.878 4.425 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1038 1 69 PHE HZ 1 135 VAL QG . . 4.010 3.722 3.429 3.860 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1039 1 138 ALA HA 1 157 SER H . . 4.690 4.712 4.419 4.811 0.121 10 0 "[ . 1 . 2 . 3 . ]" 1 1040 1 135 VAL H 1 138 ALA MB . . 4.110 3.309 2.915 3.803 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1041 1 138 ALA MB 1 157 SER H . . 3.370 2.800 2.351 3.202 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1042 1 135 VAL H 1 139 ASP HA . . 4.660 3.552 3.186 4.039 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1043 1 140 VAL HA 1 141 VAL H . . 3.240 2.214 2.182 2.310 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1044 1 140 VAL QG 1 153 TYR QD . . 3.310 2.415 1.947 2.704 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1045 1 135 VAL H 1 140 VAL QG . . 4.320 3.537 3.271 3.834 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1046 1 140 VAL QG 1 141 VAL H . . 4.180 2.980 2.415 3.413 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1047 1 140 VAL QG 1 153 TYR QE . . 4.910 3.875 3.477 4.113 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1048 1 141 VAL H 1 141 VAL HB . . 3.680 2.683 2.627 2.768 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1049 1 143 GLY QA 1 153 TYR QD . . 3.410 1.980 1.913 2.230 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1050 1 143 GLY QA 1 154 MET H . . 4.120 3.242 3.082 3.305 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1051 1 143 GLY QA 1 153 TYR QE . . 4.280 3.047 2.834 3.239 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1052 1 144 GLY QA 1 153 TYR QE . . 4.740 3.572 3.406 3.745 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1053 1 145 VAL HB 1 152 VAL H . . 4.020 3.767 3.565 3.982 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1054 1 146 SER HA 1 152 VAL H . . 4.640 3.377 3.127 3.605 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1055 1 66 TYR QD 1 150 ALA HA . . 5.000 5.139 5.023 5.277 0.277 11 0 "[ . 1 . 2 . 3 . ]" 1 1056 1 66 TYR QD 1 150 ALA MB . . 3.650 3.556 2.916 3.686 0.036 6 0 "[ . 1 . 2 . 3 . ]" 1 1057 1 66 TYR H 1 150 ALA MB . . 3.840 2.151 1.854 2.634 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1058 1 68 VAL H 1 150 ALA MB . . 4.300 3.033 2.805 3.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1059 1 67 THR H 1 150 ALA MB . . 4.850 3.408 3.223 3.668 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1060 1 151 THR HA 1 152 VAL H . . 3.070 2.560 2.485 2.654 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1061 1 151 THR HA 1 153 TYR QE . . 4.870 4.663 4.484 4.854 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1062 1 151 THR HB 1 153 TYR QE . . 3.640 2.124 1.894 2.387 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1063 1 151 THR HB 1 152 VAL H . . 4.590 3.422 3.160 3.667 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1064 1 68 VAL H 1 151 THR HB . . 4.880 4.038 3.805 4.245 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1065 1 151 THR HB 1 153 TYR QD . . 4.820 3.372 3.035 3.778 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1066 1 152 VAL HA 1 153 TYR H . . 3.020 2.199 2.187 2.215 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1067 1 152 VAL HA 1 153 TYR QD . . 3.840 3.556 3.412 3.799 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1068 1 152 VAL QG 1 153 TYR H . . 4.100 2.754 2.528 2.858 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1069 1 152 VAL QG 1 153 TYR QD . . 4.230 4.308 4.232 4.416 0.186 11 0 "[ . 1 . 2 . 3 . ]" 1 1070 1 157 SER H 1 159 LEU QD . . 5.050 4.391 3.548 4.925 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1071 1 154 MET HA 1 155 ILE H . . 3.190 2.284 2.202 2.382 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1072 1 70 ALA H 1 154 MET HA . . 4.050 2.640 2.351 2.934 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1073 1 101 HIS H 1 102 VAL HB . . 5.010 4.893 4.606 5.016 0.006 6 0 "[ . 1 . 2 . 3 . ]" 1 1074 1 154 MET QG 1 155 ILE H . . 4.170 4.023 3.777 4.249 0.079 38 0 "[ . 1 . 2 . 3 . ]" 1 1075 1 141 VAL H 1 155 ILE HA . . 3.780 2.484 2.072 2.963 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1076 1 155 ILE H 1 155 ILE MG . . 3.830 3.204 2.894 3.536 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1077 1 70 ALA H 1 155 ILE MG . . 4.430 3.911 3.297 4.520 0.090 3 0 "[ . 1 . 2 . 3 . ]" 1 1078 1 141 VAL H 1 155 ILE MG . . 4.420 3.363 3.064 3.652 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1079 1 153 TYR QD 1 155 ILE MG . . 4.810 4.851 4.695 4.972 0.162 35 0 "[ . 1 . 2 . 3 . ]" 1 1080 1 155 ILE HB 1 157 SER H . . 3.880 3.020 2.673 3.387 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1081 1 157 SER H 1 157 SER HB2 . . 3.890 3.255 2.928 3.403 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1082 1 76 PHE QD 1 158 VAL QG . . 3.700 2.778 2.213 3.157 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1083 1 76 PHE QE 1 158 VAL QG . . 3.610 3.083 2.609 3.295 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1084 1 76 PHE HZ 1 158 VAL QG . . 4.530 3.755 3.262 4.018 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1085 1 100 TYR QD 1 159 LEU HA . . 4.350 4.241 3.787 4.544 0.194 18 0 "[ . 1 . 2 . 3 . ]" 1 1086 1 100 TYR QE 1 159 LEU HA . . 4.270 3.542 3.141 4.183 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1087 1 100 TYR QD 1 159 LEU QB . . 3.390 2.491 2.032 3.210 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1088 1 100 TYR QE 1 159 LEU QB . . 3.300 2.667 1.973 3.352 0.052 22 0 "[ . 1 . 2 . 3 . ]" 1 1089 1 101 HIS HD2 1 159 LEU QB . . 4.070 3.606 3.105 4.144 0.074 3 0 "[ . 1 . 2 . 3 . ]" 1 1090 1 101 HIS HE1 1 159 LEU QB . . 5.100 2.563 1.977 3.687 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1091 1 100 TYR QD 1 159 LEU QD . . 3.950 3.530 3.024 3.789 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1092 1 100 TYR QE 1 159 LEU QD . . 3.780 3.019 2.460 3.497 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1093 1 101 HIS HE1 1 159 LEU QD . . 3.960 3.207 2.844 3.469 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1094 1 69 PHE QD 1 159 LEU QD . . 4.200 3.257 2.778 3.711 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1095 1 101 HIS HD2 1 159 LEU QD . . 4.900 4.708 4.119 4.845 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1096 1 69 PHE QE 1 159 LEU QD . . 5.040 4.541 4.213 4.888 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1097 1 100 TYR QD 1 160 MET HA . . 4.620 2.589 2.405 2.796 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1098 1 101 HIS HD2 1 160 MET HA . . 5.190 4.589 4.219 5.199 0.009 26 0 "[ . 1 . 2 . 3 . ]" 1 1099 1 100 TYR QE 1 160 MET HA . . 5.180 4.006 3.542 4.505 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1100 1 66 TYR QD 1 119 LEU QD . . 3.450 3.317 2.748 3.546 0.096 38 0 "[ . 1 . 2 . 3 . ]" 1 1101 1 11 TYR QR 1 15 ASN HB2 . . 4.050 3.268 2.817 3.460 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1102 1 11 TYR QR 1 20 ALA MB . . 4.180 3.571 3.103 3.848 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1103 1 11 TYR QR 1 12 ALA HA . . 3.520 3.207 2.760 3.564 0.044 1 0 "[ . 1 . 2 . 3 . ]" 1 1104 1 11 TYR QR 1 12 ALA MB . . 3.550 3.270 2.416 3.598 0.048 6 0 "[ . 1 . 2 . 3 . ]" 1 1105 1 11 TYR QR 1 20 ALA HA . . 4.960 4.914 4.411 5.011 0.051 20 0 "[ . 1 . 2 . 3 . ]" 1 1106 1 11 TYR QR 1 21 SER HA . . 4.230 2.852 2.002 4.035 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1107 1 11 TYR QR 1 22 VAL HA . . 4.310 4.292 3.857 4.376 0.066 33 0 "[ . 1 . 2 . 3 . ]" 1 1108 1 71 PRO HD2 1 76 PHE HZ . . 4.850 3.695 3.606 3.803 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1109 1 71 PRO HD2 1 76 PHE QE . . 4.080 2.966 2.887 3.062 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1110 1 71 PRO HD2 1 76 PHE QD . . 5.120 5.145 5.063 5.218 0.098 20 0 "[ . 1 . 2 . 3 . ]" 1 1111 1 11 TYR QR 1 38 PRO HD2 . . 3.490 1.971 1.891 2.340 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1112 1 11 TYR QR 1 38 PRO HD3 . . 3.950 3.430 2.738 3.854 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1113 1 100 TYR QE 1 162 PRO HD2 . . 4.230 3.711 3.056 4.431 0.201 22 0 "[ . 1 . 2 . 3 . ]" 1 1114 1 100 TYR QE 1 162 PRO HD3 . . 4.290 3.078 2.543 3.462 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1115 1 67 THR H 1 106 GLN HA . . 5.500 5.073 4.659 5.291 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1116 1 11 TYR QR 1 14 ALA MB . . 5.010 3.891 3.550 4.254 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1117 1 69 PHE QE 1 103 VAL MG2 . . 3.080 1.888 1.847 1.954 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1118 1 69 PHE HZ 1 103 VAL MG2 . . 3.080 3.156 3.067 3.245 0.165 36 0 "[ . 1 . 2 . 3 . ]" 1 1119 1 11 TYR QR 1 22 VAL QG . . 3.010 2.761 2.147 3.069 0.059 26 0 "[ . 1 . 2 . 3 . ]" 1 1120 1 11 TYR QR 1 38 PRO QG . . 3.710 2.747 1.988 3.165 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1121 1 30 VAL QG 1 66 TYR QD . . 3.680 3.122 2.786 3.291 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1122 1 30 VAL QG 1 66 TYR QE . . 4.890 4.427 4.164 4.595 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1123 1 69 PHE HZ 1 126 VAL MG2 . . 3.280 2.874 2.522 3.267 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1124 1 69 PHE QE 1 126 VAL MG2 . . 3.660 2.340 1.927 2.973 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1125 1 66 TYR QD 1 102 VAL QG . . 3.000 2.260 1.857 2.545 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1126 1 102 VAL H 1 102 VAL QG . . 3.530 2.397 2.210 2.701 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1127 1 101 HIS H 1 102 VAL QG . . 4.000 2.790 2.596 3.058 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1128 1 102 VAL QG 1 103 VAL H . . 3.580 2.664 1.938 3.113 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1129 1 69 PHE H 1 102 VAL QG . . 4.430 3.827 2.917 4.169 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1130 1 34 ALA MB 1 44 THR H . . 4.790 3.668 2.727 4.583 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1131 1 11 TYR QR 1 37 ASN HA . . 4.160 3.831 2.790 4.200 0.040 37 0 "[ . 1 . 2 . 3 . ]" 1 1132 1 11 TYR QR 1 37 ASN HB3 . . 5.500 4.249 2.923 4.926 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1133 1 11 TYR QR 1 37 ASN HB2 . . 5.260 4.935 4.162 5.283 0.023 37 0 "[ . 1 . 2 . 3 . ]" 1 1134 1 11 TYR QR 1 39 GLU QB . . 3.980 3.573 2.962 3.885 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1135 1 11 TYR QR 1 39 GLU HG3 . . 3.190 2.306 1.801 2.817 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1136 1 11 TYR QR 1 39 GLU HG2 . . 3.760 3.275 2.399 3.785 0.025 24 0 "[ . 1 . 2 . 3 . ]" 1 1137 1 40 LEU HA 1 43 LEU H . . 4.290 2.952 2.820 3.081 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1138 1 40 LEU HA 1 44 THR H . . 4.600 4.003 3.704 4.489 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1139 1 40 LEU HB2 1 44 THR H . . 4.990 4.362 3.930 4.822 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1140 1 40 LEU HB3 1 44 THR H . . 4.490 3.712 3.313 4.261 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1141 1 40 LEU QD 1 72 THR H . . 5.500 4.135 3.651 4.499 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1142 1 40 LEU QD 1 44 THR H . . 5.500 4.606 4.186 5.044 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1143 1 43 LEU HA 1 45 ALA H . . 5.460 4.783 4.498 5.078 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1144 1 43 LEU HB3 1 76 PHE HZ . . 4.410 3.709 3.315 4.289 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1145 1 43 LEU HB3 1 76 PHE QD . . 4.500 4.525 4.242 5.219 0.719 31 5 "[ . -* . 2 . 3+ .** ]" 1 1146 1 43 LEU QD 1 76 PHE QE . . 3.940 3.229 2.914 3.381 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1147 1 43 LEU QD 1 76 PHE HZ . . 4.900 2.956 2.316 3.281 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1148 1 46 ALA MB 1 48 SER H . . 4.500 4.494 4.427 4.542 0.042 3 0 "[ . 1 . 2 . 3 . ]" 1 1149 1 46 ALA MB 1 76 PHE QD . . 5.030 4.967 4.620 5.208 0.178 20 0 "[ . 1 . 2 . 3 . ]" 1 1150 1 46 ALA HA 1 48 SER H . . 5.300 5.056 4.905 5.245 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1151 1 46 ALA H 1 47 LEU HA . . 5.500 5.373 5.341 5.427 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1152 1 47 LEU H 1 47 LEU HB2 . . 3.840 3.489 3.450 3.512 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1153 1 47 LEU H 1 47 LEU QD . . 3.550 2.339 2.214 2.523 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1154 1 44 THR H 1 47 LEU QD . . 3.990 3.331 3.271 3.425 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1155 1 49 GLY HA2 1 55 VAL H . . 4.740 3.508 3.085 3.887 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1156 1 49 GLY HA3 1 55 VAL H . . 5.500 4.289 3.840 4.793 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1157 1 46 ALA H 1 51 LEU QB . . 4.800 3.209 2.978 3.616 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1158 1 52 ASN QB 1 55 VAL H . . 4.690 2.738 2.151 3.103 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1159 1 54 GLN HB2 1 55 VAL H . . 4.850 3.788 3.516 3.951 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1160 1 54 GLN HB3 1 55 VAL H . . 4.920 4.250 4.054 4.409 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1161 1 60 THR MG 1 66 TYR QE . . 4.250 2.534 1.957 3.648 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1162 1 60 THR MG 1 66 TYR QD . . 5.500 4.513 3.958 5.542 0.042 24 0 "[ . 1 . 2 . 3 . ]" 1 1163 1 61 LEU HB2 1 66 TYR QE . . 4.770 4.811 4.546 4.908 0.138 24 0 "[ . 1 . 2 . 3 . ]" 1 1164 1 61 LEU HB2 1 66 TYR QD . . 5.500 4.576 4.253 5.007 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1165 1 61 LEU HB3 1 66 TYR QD . . 5.030 3.376 2.882 3.931 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1166 1 61 LEU HB3 1 66 TYR QE . . 5.060 4.469 4.259 4.669 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1167 1 61 LEU HG 1 66 TYR QE . . 5.080 4.530 3.434 5.180 0.100 17 0 "[ . 1 . 2 . 3 . ]" 1 1168 1 64 GLY HA2 1 66 TYR QD . . 5.500 4.929 4.374 5.402 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1169 1 64 GLY HA3 1 66 TYR QD . . 5.040 4.025 3.740 4.925 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1170 1 65 GLN HB3 1 66 TYR H . . 4.040 3.818 3.350 4.012 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1171 1 65 GLN HB2 1 66 TYR H . . 5.500 4.563 4.369 4.685 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1172 1 65 GLN HG2 1 66 TYR H . . 5.360 4.886 4.387 5.304 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1173 1 65 GLN HG3 1 66 TYR H . . 4.820 4.376 3.642 4.697 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1174 1 65 GLN HG3 1 150 ALA HA . . 5.500 5.165 4.372 5.565 0.065 19 0 "[ . 1 . 2 . 3 . ]" 1 1175 1 65 GLN HG2 1 150 ALA HA . . 5.370 5.092 4.385 5.445 0.075 11 0 "[ . 1 . 2 . 3 . ]" 1 1176 1 67 THR HA 1 69 PHE QD . . 5.500 5.145 5.089 5.223 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1177 1 67 THR HA 1 103 VAL H . . 5.500 4.334 4.106 4.522 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1178 1 67 THR HB 1 69 PHE QD . . 4.950 3.606 3.365 3.932 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1179 1 67 THR HB 1 68 VAL H . . 4.770 4.573 4.519 4.652 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1180 1 67 THR HB 1 153 TYR QD . . 4.890 4.522 4.271 4.767 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1181 1 67 THR HB 1 69 PHE QE . . 5.180 2.479 2.301 2.739 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1182 1 68 VAL HA 1 69 PHE QD . . 4.470 3.908 3.793 4.040 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1183 1 68 VAL HB 1 69 PHE H . . 4.670 4.057 3.846 4.222 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1184 1 68 VAL HB 1 153 TYR QD . . 5.500 4.622 4.411 4.798 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1185 1 68 VAL MG1 1 69 PHE QD . . 4.740 4.904 4.833 4.994 0.254 15 0 "[ . 1 . 2 . 3 . ]" 1 1186 1 70 ALA H 1 70 ALA MB . . 3.040 2.193 2.092 2.290 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1187 1 70 ALA MB 1 155 ILE H . . 3.930 4.044 3.890 4.205 0.275 20 0 "[ . 1 . 2 . 3 . ]" 1 1188 1 70 ALA MB 1 153 TYR H . . 4.380 3.381 3.087 3.804 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1189 1 70 ALA MB 1 154 MET H . . 4.560 4.286 4.127 4.444 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1190 1 71 PRO HA 1 155 ILE H . . 3.570 2.960 2.695 3.429 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1191 1 71 PRO HA 1 76 PHE QE . . 4.680 4.409 4.314 4.658 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1192 1 71 PRO HB3 1 76 PHE QE . . 3.930 4.028 3.978 4.120 0.190 23 0 "[ . 1 . 2 . 3 . ]" 1 1193 1 71 PRO HB3 1 76 PHE QD . . 4.440 4.558 4.456 4.715 0.275 2 0 "[ . 1 . 2 . 3 . ]" 1 1194 1 71 PRO HB3 1 76 PHE HZ . . 5.110 4.998 4.770 5.150 0.040 5 0 "[ . 1 . 2 . 3 . ]" 1 1195 1 71 PRO HB3 1 101 HIS HE1 . . 5.500 2.414 2.123 2.854 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1196 1 71 PRO HB2 1 72 THR H . . 4.070 3.901 3.666 4.089 0.019 38 0 "[ . 1 . 2 . 3 . ]" 1 1197 1 71 PRO HB2 1 76 PHE QE . . 3.820 2.697 2.626 2.843 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1198 1 71 PRO HB2 1 76 PHE QD . . 4.200 2.895 2.784 3.070 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1199 1 71 PRO HB2 1 101 HIS HE1 . . 4.810 4.073 3.816 4.411 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1200 1 71 PRO HB2 1 76 PHE HZ . . 4.930 4.086 3.913 4.180 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1201 1 71 PRO HB2 1 157 SER H . . 5.010 4.483 4.037 4.862 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1202 1 72 THR HA 1 76 PHE QD . . 5.440 4.524 4.133 5.055 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1203 1 75 ALA HA 1 157 SER H . . 5.500 3.858 3.300 4.270 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1204 1 117 GLN HA 1 124 VAL H . . 4.060 3.413 2.778 3.908 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1205 1 76 PHE QD 1 84 ILE HA . . 5.500 4.974 4.532 5.370 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1206 1 76 PHE QD 1 84 ILE HG13 . . 5.500 4.608 4.004 5.017 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1207 1 87 LEU HA 1 94 LEU H . . 4.910 4.404 4.034 4.775 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1208 1 76 PHE QD 1 87 LEU MD1 . . 3.580 3.564 2.927 3.637 0.057 1 0 "[ . 1 . 2 . 3 . ]" 1 1209 1 87 LEU H 1 87 LEU MD1 . . 3.900 3.738 3.616 3.846 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1210 1 76 PHE QE 1 87 LEU MD1 . . 5.210 3.258 2.711 3.633 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1211 1 91 SER HA 1 94 LEU H . . 4.080 4.055 3.837 4.139 0.059 12 0 "[ . 1 . 2 . 3 . ]" 1 1212 1 101 HIS HE1 1 158 VAL HA . . 5.070 2.635 2.025 3.129 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1213 1 101 HIS HD2 1 158 VAL HA . . 4.720 4.584 3.967 4.819 0.099 37 0 "[ . 1 . 2 . 3 . ]" 1 1214 1 93 LEU QD 1 94 LEU H . . 4.760 3.637 3.235 4.012 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1215 1 94 LEU HA 1 97 ILE H . . 3.950 3.290 3.046 3.469 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1216 1 94 LEU HA 1 98 LEU H . . 4.500 4.326 3.997 4.452 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1217 1 94 LEU H 1 94 LEU HG . . 4.690 3.713 3.490 4.090 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1218 1 94 LEU HG 1 98 LEU H . . 5.430 4.114 3.592 4.514 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1219 1 55 VAL H 1 94 LEU MD2 . . 5.040 4.628 4.305 4.811 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1220 1 52 ASN H 1 94 LEU MD2 . . 5.190 4.239 3.382 5.094 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1221 1 95 THR MG 1 99 THR H . . 4.980 3.857 3.276 4.630 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1222 1 97 ILE QG 1 100 TYR QD . . 4.320 3.880 3.561 4.204 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1223 1 98 LEU HG 1 99 THR H . . 4.630 3.455 3.288 3.588 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1224 1 97 ILE H 1 98 LEU HG . . 5.080 3.774 3.651 3.972 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1225 1 99 THR MG 1 101 HIS H . . 5.420 5.009 4.862 5.238 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1226 1 98 LEU H 1 99 THR MG . . 5.500 4.582 4.307 4.926 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1227 1 69 PHE H 1 102 VAL HA . . 4.490 2.990 2.710 3.335 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1228 1 67 THR H 1 102 VAL QG . . 3.980 2.411 2.080 2.639 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1229 1 66 TYR QE 1 102 VAL QG . . 3.640 3.396 2.468 3.638 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1230 1 99 THR H 1 102 VAL QG . . 5.170 4.030 3.701 4.489 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1231 1 102 VAL H 1 103 VAL HA . . 5.410 4.434 4.270 4.657 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1232 1 69 PHE QE 1 103 VAL HA . . 4.650 4.456 4.320 4.590 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1233 1 69 PHE QD 1 103 VAL HB . . 5.010 3.219 2.854 3.644 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1234 1 69 PHE HZ 1 103 VAL HB . . 5.180 4.124 3.951 4.250 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1235 1 103 VAL H 1 103 VAL MG1 . . 3.950 3.707 3.543 3.862 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1236 1 69 PHE QD 1 103 VAL MG1 . . 4.270 4.533 4.356 4.712 0.442 17 0 "[ . 1 . 2 . 3 . ]" 1 1237 1 69 PHE QE 1 103 VAL MG1 . . 4.960 3.123 2.842 3.393 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1238 1 67 THR H 1 103 VAL MG1 . . 5.500 4.425 3.790 4.993 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1239 1 102 VAL H 1 103 VAL MG2 . . 5.370 3.703 3.420 3.937 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1240 1 66 TYR QD 1 104 ALA MB . . 3.380 3.234 2.475 3.469 0.089 8 0 "[ . 1 . 2 . 3 . ]" 1 1241 1 66 TYR QE 1 104 ALA MB . . 3.680 2.836 2.285 3.155 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1242 1 108 SER HA 1 153 TYR QE . . 4.960 4.328 3.845 4.586 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1243 1 109 PRO HB2 1 153 TYR QD . . 5.280 5.328 5.185 5.387 0.107 15 0 "[ . 1 . 2 . 3 . ]" 1 1244 1 109 PRO HG2 1 153 TYR QE . . 4.390 4.465 4.393 4.554 0.164 17 0 "[ . 1 . 2 . 3 . ]" 1 1245 1 109 PRO HD3 1 153 TYR QE . . 5.230 3.775 3.383 3.997 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1246 1 109 PRO HD2 1 153 TYR QE . . 4.970 4.854 4.478 5.030 0.060 17 0 "[ . 1 . 2 . 3 . ]" 1 1247 1 69 PHE HZ 1 112 VAL HA . . 4.420 4.493 4.277 4.629 0.209 15 0 "[ . 1 . 2 . 3 . ]" 1 1248 1 69 PHE QE 1 112 VAL HA . . 5.500 5.420 5.179 5.535 0.035 15 0 "[ . 1 . 2 . 3 . ]" 1 1249 1 112 VAL QG 1 153 TYR QE . . 3.190 2.642 2.279 2.833 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1250 1 112 VAL QG 1 153 TYR QD . . 4.290 3.508 3.177 3.813 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1251 1 69 PHE HZ 1 112 VAL QG . . 3.270 1.909 1.788 2.062 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1252 1 69 PHE QD 1 112 VAL QG . . 4.700 4.324 4.027 4.545 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1253 1 69 PHE QE 1 112 VAL QG . . 3.860 2.774 2.365 3.012 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1254 1 115 THR HA 1 126 VAL H . . 4.060 3.149 2.393 3.882 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1255 1 76 PHE QD 1 84 ILE HG12 . . 5.500 5.135 4.699 5.463 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1256 1 69 PHE HZ 1 116 ARG HD3 . . 5.400 4.748 2.876 5.453 0.053 27 0 "[ . 1 . 2 . 3 . ]" 1 1257 1 69 PHE QE 1 116 ARG HD3 . . 5.500 4.857 3.666 5.528 0.028 19 0 "[ . 1 . 2 . 3 . ]" 1 1258 1 69 PHE HZ 1 116 ARG HD2 . . 5.440 4.741 3.448 5.457 0.017 19 0 "[ . 1 . 2 . 3 . ]" 1 1259 1 69 PHE QE 1 116 ARG HD2 . . 5.500 4.919 3.533 5.742 0.242 11 0 "[ . 1 . 2 . 3 . ]" 1 1260 1 102 VAL H 1 118 THR HA . . 4.760 4.560 4.209 4.882 0.122 18 0 "[ . 1 . 2 . 3 . ]" 1 1261 1 103 VAL H 1 118 THR HA . . 4.300 4.445 4.341 4.579 0.279 23 0 "[ . 1 . 2 . 3 . ]" 1 1262 1 69 PHE QD 1 118 THR HA . . 5.500 5.079 4.640 5.310 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1263 1 101 HIS H 1 118 THR HB . . 5.100 4.720 4.309 5.103 0.003 28 0 "[ . 1 . 2 . 3 . ]" 1 1264 1 100 TYR QE 1 118 THR HB . . 5.500 4.721 3.950 5.109 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1265 1 69 PHE QE 1 118 THR MG . . 4.350 4.259 3.846 4.421 0.071 35 0 "[ . 1 . 2 . 3 . ]" 1 1266 1 102 VAL H 1 118 THR MG . . 4.470 3.715 3.126 4.296 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1267 1 69 PHE QD 1 118 THR MG . . 5.360 4.014 3.508 4.310 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1268 1 102 VAL H 1 119 LEU QB . . 5.500 4.415 3.446 5.084 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1269 1 100 TYR QD 1 120 GLN HB2 . . 3.980 3.939 3.073 4.614 0.634 23 4 "[ - . 1 . 2 + . 3 . **]" 1 1270 1 100 TYR QD 1 120 GLN HG3 . . 4.520 4.442 3.949 4.830 0.310 2 0 "[ . 1 . 2 . 3 . ]" 1 1271 1 100 TYR H 1 120 GLN HG3 . . 5.170 4.150 2.967 5.200 0.030 32 0 "[ . 1 . 2 . 3 . ]" 1 1272 1 100 TYR H 1 120 GLN HG2 . . 5.500 3.615 2.951 4.182 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1273 1 100 TYR QE 1 122 ALA HA . . 5.180 4.926 4.236 5.296 0.116 14 0 "[ . 1 . 2 . 3 . ]" 1 1274 1 71 PRO HD3 1 101 HIS HE1 . . 3.680 3.174 2.970 3.324 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1275 1 71 PRO HD3 1 76 PHE QE . . 4.640 4.215 4.169 4.284 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1276 1 70 ALA H 1 71 PRO HD3 . . 5.300 4.525 4.444 4.604 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1277 1 70 ALA H 1 71 PRO HD2 . . 5.170 5.041 5.022 5.050 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1278 1 69 PHE QE 1 124 VAL HB . . 5.500 5.228 3.819 5.649 0.149 29 0 "[ . 1 . 2 . 3 . ]" 1 1279 1 127 THR HB 1 134 LYS H . . 5.500 4.243 2.917 5.456 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1280 1 30 VAL QG 1 150 ALA HA . . 4.950 4.142 3.751 4.307 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1281 1 68 VAL MG2 1 150 ALA HA . . 4.750 4.840 4.729 4.985 0.235 24 0 "[ . 1 . 2 . 3 . ]" 1 1282 1 128 GLY QA 1 134 LYS H . . 4.220 3.013 2.298 3.550 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1283 1 134 LYS HA 1 140 VAL H . . 3.940 2.303 1.899 3.238 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1284 1 71 PRO HG2 1 76 PHE HZ . . 4.410 2.226 2.038 2.347 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1285 1 71 PRO HG2 1 76 PHE QE . . 3.900 1.847 1.738 1.904 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1286 1 71 PRO HG2 1 101 HIS HE1 . . 4.230 4.277 4.082 4.422 0.192 28 0 "[ . 1 . 2 . 3 . ]" 1 1287 1 71 PRO HG2 1 76 PHE QD . . 4.900 3.711 3.601 3.772 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1288 1 71 PRO HG2 1 101 HIS HD2 . . 4.860 4.836 4.518 5.374 0.514 17 1 "[ . 1 . + 2 . 3 . ]" 1 1289 1 71 PRO HG3 1 101 HIS HE1 . . 3.950 2.761 2.470 3.018 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1290 1 71 PRO HG3 1 76 PHE QE . . 4.550 3.491 3.382 3.534 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1291 1 71 PRO HG3 1 76 PHE HZ . . 5.150 3.453 3.086 3.675 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1292 1 134 LYS QD 1 135 VAL H . . 4.710 3.796 3.074 4.726 0.016 17 0 "[ . 1 . 2 . 3 . ]" 1 1293 1 134 LYS H 1 134 LYS QD . . 4.910 4.859 4.551 4.962 0.052 7 0 "[ . 1 . 2 . 3 . ]" 1 1294 1 69 PHE QE 1 135 VAL HA . . 5.010 4.797 4.331 5.046 0.036 31 0 "[ . 1 . 2 . 3 . ]" 1 1295 1 69 PHE QE 1 135 VAL HB . . 4.620 4.385 3.901 4.632 0.012 29 0 "[ . 1 . 2 . 3 . ]" 1 1296 1 139 ASP HB3 1 140 VAL H . . 4.530 3.533 2.253 3.759 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1297 1 140 VAL HA 1 155 ILE H . . 5.240 4.907 4.793 5.036 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1298 1 140 VAL HB 1 153 TYR QD . . 5.500 5.161 4.606 5.473 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1299 1 140 VAL QG 1 154 MET H . . 4.620 3.990 3.740 4.307 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1300 1 141 VAL QG 1 155 ILE H . . 4.950 3.051 2.638 3.690 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1301 1 11 TYR QR 1 142 CYS HB3 . . 5.500 4.539 3.852 4.908 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1302 1 143 GLY QA 1 153 TYR H . . 5.500 4.225 4.168 4.282 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1303 1 145 VAL MG1 1 152 VAL H . . 5.030 5.013 4.793 5.119 0.089 10 0 "[ . 1 . 2 . 3 . ]" 1 1304 1 145 VAL MG2 1 152 VAL H . . 4.400 3.995 3.635 4.445 0.045 30 0 "[ . 1 . 2 . 3 . ]" 1 1305 1 145 VAL MG2 1 154 MET H . . 5.060 3.739 3.479 4.097 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1306 1 147 THR MG 1 152 VAL H . . 5.500 4.624 4.187 4.922 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1307 1 66 TYR H 1 150 ALA HA . . 3.610 2.453 2.276 2.656 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1308 1 151 THR MG 1 153 TYR QE . . 2.670 2.003 1.869 2.166 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1309 1 151 THR MG 1 152 VAL H . . 3.400 1.810 1.735 1.871 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1310 1 151 THR MG 1 153 TYR QD . . 3.070 2.958 2.713 3.132 0.062 38 0 "[ . 1 . 2 . 3 . ]" 1 1311 1 69 PHE QD 1 102 VAL HA . . 5.500 2.663 2.414 2.786 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1312 1 154 MET H 1 154 MET HB3 . . 3.980 3.502 3.472 3.521 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1313 1 102 VAL HB 1 103 VAL H . . 4.530 4.005 3.251 4.264 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1314 1 154 MET H 1 154 MET HB2 . . 3.730 2.330 2.197 2.481 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1315 1 154 MET HB2 1 155 ILE H . . 4.590 4.192 3.845 4.547 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1316 1 69 PHE QD 1 102 VAL HB . . 4.880 4.987 4.738 5.277 0.397 20 0 "[ . 1 . 2 . 3 . ]" 1 1317 1 11 TYR QR 1 38 PRO HB2 . . 4.650 4.586 3.992 4.807 0.157 26 0 "[ . 1 . 2 . 3 . ]" 1 1318 1 109 PRO HB3 1 153 TYR QD . . 4.630 3.793 3.577 3.869 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1319 1 97 ILE QG 1 100 TYR H . . 5.410 5.197 5.035 5.290 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1320 1 156 ASP HB2 1 157 SER H . . 5.500 4.583 4.513 4.651 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1321 1 156 ASP HB3 1 157 SER H . . 5.500 4.635 4.439 4.705 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1322 1 157 SER H 1 157 SER HB3 . . 4.050 4.028 3.840 4.082 0.032 29 0 "[ . 1 . 2 . 3 . ]" 1 1323 1 97 ILE HA 1 100 TYR QD . . 4.630 3.403 3.143 3.791 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1324 1 72 THR H 1 158 VAL QG . . 5.410 5.283 4.969 5.518 0.108 20 0 "[ . 1 . 2 . 3 . ]" 1 1325 1 101 HIS HE1 1 158 VAL QG . . 5.070 3.898 3.449 4.291 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1326 1 100 TYR QE 1 162 PRO QG . . 4.290 3.919 3.478 4.253 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1327 1 100 TYR QD 1 162 PRO HD3 . . 5.270 4.140 3.676 4.340 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1328 1 100 TYR QD 1 162 PRO HD2 . . 5.350 4.463 3.957 5.013 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1329 1 67 THR H 1 68 VAL MG2 . . 4.040 4.026 3.889 4.145 0.105 11 0 "[ . 1 . 2 . 3 . ]" 1 1330 1 103 VAL H 1 103 VAL MG2 . . 3.620 2.789 2.226 3.368 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1331 1 94 LEU H 1 98 LEU MD2 . . 5.500 5.418 5.206 5.548 0.048 17 0 "[ . 1 . 2 . 3 . ]" 1 1332 1 11 TYR QR 1 154 MET ME . . 3.480 2.786 2.213 3.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1333 1 154 MET H 1 154 MET ME . . 4.720 4.134 3.765 4.468 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1334 1 43 LEU HG 1 76 PHE QE . . 4.830 4.694 4.574 4.822 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1335 1 43 LEU H 1 43 LEU HG . . 5.190 4.003 3.779 4.266 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1336 1 47 LEU H 1 47 LEU HG . . 3.440 1.762 1.660 1.830 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1337 1 46 ALA H 1 47 LEU HG . . 5.080 3.576 3.474 3.703 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1338 1 47 LEU HG 1 48 SER H . . 4.730 2.236 2.140 2.330 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1339 1 100 TYR QD 1 161 PRO HD3 . . 4.610 3.121 2.668 3.332 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1340 1 100 TYR QD 1 161 PRO HD2 . . 4.310 4.375 3.891 4.506 0.196 17 0 "[ . 1 . 2 . 3 . ]" 1 1341 1 119 LEU H 1 119 LEU HG . . 4.370 3.388 2.295 4.391 0.021 15 0 "[ . 1 . 2 . 3 . ]" 1 1342 1 30 VAL HB 1 66 TYR QD . . 5.480 5.177 4.367 5.457 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1343 1 41 THR HA 1 45 ALA H . . 4.630 3.788 3.360 4.128 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1344 1 76 PHE QE 1 158 VAL HA . . 5.020 4.723 4.121 5.134 0.114 28 0 "[ . 1 . 2 . 3 . ]" 1 1345 1 76 PHE QD 1 158 VAL HA . . 5.500 5.144 4.882 5.470 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1346 1 96 SER HA 1 100 TYR H . . 5.350 3.950 3.666 4.209 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1347 1 97 ILE QG 1 98 LEU H . . 5.170 4.349 4.205 4.434 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1348 1 68 VAL H 1 102 VAL QG . . 5.500 3.836 3.335 4.080 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1349 1 44 THR H 1 46 ALA MB . . 5.270 4.769 4.695 4.835 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1350 1 66 TYR QE 1 150 ALA MB . . 5.500 5.206 4.944 5.375 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1351 1 75 ALA HA 1 76 PHE QD . . 5.500 5.401 5.184 5.581 0.081 3 0 "[ . 1 . 2 . 3 . ]" 1 1352 1 86 GLU QG 1 87 LEU H . . 5.370 3.984 3.640 4.310 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1353 1 69 PHE HZ 1 116 ARG QG . . 5.500 3.448 2.231 4.813 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1354 1 69 PHE QE 1 116 ARG QG . . 5.500 3.890 2.581 4.722 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1355 1 10 GLU QB 1 10 GLU QG . . 2.400 2.070 2.032 2.134 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1356 1 39 GLU HA 1 39 GLU HG2 . . 3.750 2.578 2.473 2.766 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1357 1 86 GLU HA 1 86 GLU QG . . 3.450 2.418 2.160 2.743 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1358 1 86 GLU HA 1 86 GLU HB2 . . 2.970 2.605 2.456 2.701 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1359 1 86 GLU HB3 1 86 GLU QG . . 2.580 2.188 2.179 2.207 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1360 1 39 GLU HA 1 39 GLU HG3 . . 4.100 3.739 3.673 3.825 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1361 1 23 GLN HB2 1 23 GLN HG2 . . 3.050 2.942 2.593 3.056 0.006 27 0 "[ . 1 . 2 . 3 . ]" 1 1362 1 27 GLN HA 1 27 GLN HG2 . . 3.910 2.366 2.090 3.036 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1363 1 27 GLN HB3 1 27 GLN HG2 . . 2.990 2.659 2.279 2.984 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1364 1 50 GLN HA 1 50 GLN HG3 . . 4.090 3.618 3.385 3.734 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1365 1 50 GLN HA 1 50 GLN HG2 . . 3.200 2.480 2.325 2.586 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1366 1 54 GLN HA 1 54 GLN HG3 . . 3.780 3.348 2.481 3.543 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1367 1 54 GLN HA 1 54 GLN HG2 . . 3.870 2.164 2.034 3.683 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1368 1 65 GLN HA 1 65 GLN HG3 . . 4.040 2.238 2.016 2.480 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1369 1 65 GLN HB2 1 65 GLN HG3 . . 2.970 2.861 2.639 2.964 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1370 1 106 GLN HA 1 106 GLN QG . . 3.320 1.992 1.945 2.199 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1371 1 106 GLN HB2 1 106 GLN QG . . 2.420 2.225 2.179 2.467 0.047 34 0 "[ . 1 . 2 . 3 . ]" 1 1372 1 117 GLN QB 1 117 GLN HG3 . . 2.400 2.363 2.254 2.477 0.077 35 0 "[ . 1 . 2 . 3 . ]" 1 1373 1 117 GLN HA 1 117 GLN HG3 . . 3.880 2.544 2.242 2.838 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1374 1 120 GLN HA 1 120 GLN HG3 . . 4.020 3.544 3.433 3.673 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1375 1 129 GLN HB2 1 129 GLN QG . . 2.670 2.436 2.227 2.571 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1376 1 129 GLN HB3 1 129 GLN QG . . 2.400 2.342 2.180 2.550 0.150 35 0 "[ . 1 . 2 . 3 . ]" 1 1377 1 17 THR HA 1 17 THR MG . . 3.170 2.466 2.369 2.579 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1378 1 41 THR HA 1 41 THR HB . . 2.810 2.663 2.488 2.797 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1379 1 41 THR HA 1 41 THR MG . . 3.480 2.253 2.068 2.444 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1380 1 42 THR HA 1 42 THR MG . . 3.400 2.698 2.250 3.246 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1381 1 67 THR HA 1 67 THR MG . . 3.620 2.321 2.271 2.422 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1382 1 72 THR HA 1 72 THR MG . . 3.420 2.450 2.274 2.502 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1383 1 83 THR HA 1 83 THR MG . . 3.520 2.693 2.675 2.761 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1384 1 83 THR HA 1 83 THR HB . . 2.980 2.996 2.971 3.003 0.023 38 0 "[ . 1 . 2 . 3 . ]" 1 1385 1 89 THR HA 1 89 THR MG . . 3.530 3.048 2.174 3.246 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1386 1 99 THR HA 1 99 THR MG . . 3.430 2.304 2.118 2.482 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1387 1 107 THR HA 1 107 THR MG . . 3.360 2.441 2.191 2.575 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1388 1 115 THR HA 1 115 THR MG . . 3.460 2.538 2.264 3.235 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1389 1 125 THR HA 1 125 THR MG . . 3.660 2.477 2.350 2.588 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1390 1 147 THR HA 1 147 THR MG . . 3.490 2.343 2.265 2.439 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1391 1 67 THR HA 1 151 THR HB . . 3.810 2.442 2.296 2.564 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1392 1 4 VAL HA 1 4 VAL QG . . 3.290 2.271 1.905 2.464 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1393 1 22 VAL HA 1 22 VAL QG . . 2.920 2.178 2.036 2.425 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1394 1 30 VAL HA 1 30 VAL HB . . 2.890 2.416 2.212 2.592 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1395 1 30 VAL HA 1 30 VAL QG . . 3.040 2.354 2.091 2.602 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1396 1 32 VAL HA 1 32 VAL MG2 . . 3.320 2.328 2.177 2.470 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1397 1 32 VAL HA 1 32 VAL MG1 . . 3.230 2.441 2.192 2.578 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1398 1 55 VAL HA 1 55 VAL QG . . 3.090 2.209 1.926 2.571 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1399 1 58 VAL HA 1 58 VAL QG . . 3.320 2.263 1.980 2.535 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1400 1 68 VAL HA 1 68 VAL MG1 . . 2.810 2.341 2.184 2.478 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1401 1 68 VAL HA 1 68 VAL MG2 . . 3.220 2.439 2.342 2.490 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1402 1 102 VAL HA 1 102 VAL QG . . 3.000 2.412 2.071 2.541 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1403 1 103 VAL HA 1 103 VAL MG1 . . 3.040 2.474 2.234 2.672 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1404 1 103 VAL HA 1 103 VAL MG2 . . 3.370 2.345 2.215 2.531 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1405 1 126 VAL HA 1 126 VAL MG1 . . 3.330 2.301 2.109 2.435 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1406 1 126 VAL HA 1 126 VAL MG2 . . 3.410 2.469 2.356 2.589 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1407 1 140 VAL HA 1 140 VAL QG . . 3.300 2.104 2.054 2.184 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1408 1 141 VAL HA 1 141 VAL QG . . 3.050 2.018 1.993 2.078 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1409 1 145 VAL HA 1 145 VAL MG1 . . 3.310 2.204 2.032 2.367 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1410 1 145 VAL HA 1 145 VAL MG2 . . 3.460 2.595 2.491 2.680 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1411 1 71 PRO HB2 1 158 VAL HA . . 3.800 2.937 2.633 3.214 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1412 1 158 VAL HA 1 158 VAL QG . . 3.090 2.195 2.038 2.502 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1413 1 3 LEU HA 1 3 LEU QD . . 3.250 2.257 1.845 3.017 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1414 1 40 LEU HA 1 40 LEU HG . . 3.980 3.469 3.205 3.897 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1415 1 43 LEU HA 1 43 LEU QD . . 3.800 3.153 2.568 3.335 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1416 1 40 LEU HB3 1 43 LEU HB3 . . 3.860 3.486 2.274 3.970 0.110 8 0 "[ . 1 . 2 . 3 . ]" 1 1417 1 47 LEU HA 1 98 LEU MD1 . . 3.410 2.033 1.752 2.567 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1418 1 47 LEU HB3 1 47 LEU QD . . 3.000 1.968 1.903 2.083 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1419 1 47 LEU HA 1 47 LEU QD . . 3.450 3.403 3.316 3.450 . 18 0 "[ . 1 . 2 . 3 . ]" 1 1420 1 51 LEU HA 1 51 LEU QD . . 3.490 2.629 2.215 3.062 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1421 1 45 ALA MB 1 51 LEU QD . . 3.310 2.143 1.788 3.440 0.130 16 0 "[ . 1 . 2 . 3 . ]" 1 1422 1 57 LEU HA 1 57 LEU QD . . 3.180 2.177 1.869 2.925 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1423 1 57 LEU HA 1 57 LEU HG . . 3.760 3.004 2.170 3.740 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1424 1 116 ARG HA 1 116 ARG QG . . 3.290 2.427 1.959 3.094 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1425 1 61 LEU HA 1 61 LEU QD . . 3.310 1.889 1.759 2.216 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1426 1 79 LEU HA 1 79 LEU QD . . 3.480 2.118 1.906 2.526 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1427 1 79 LEU HB3 1 79 LEU QD . . 3.260 2.088 1.977 2.518 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1428 1 87 LEU HA 1 87 LEU HG . . 4.010 3.522 3.378 3.564 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1429 1 87 LEU HB2 1 87 LEU MD1 . . 3.330 2.593 2.481 2.659 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1430 1 87 LEU HA 1 87 LEU MD1 . . 3.860 3.681 3.571 3.801 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1431 1 87 LEU HB3 1 87 LEU MD1 . . 3.110 2.157 2.047 2.283 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1432 1 87 LEU HA 1 87 LEU MD2 . . 3.170 2.118 1.998 2.268 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1433 1 87 LEU HB2 1 87 LEU MD2 . . 3.500 3.180 3.148 3.209 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1434 1 87 LEU HB3 1 87 LEU MD2 . . 3.270 2.634 2.465 2.725 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1435 1 93 LEU HA 1 93 LEU QD . . 3.500 2.759 2.432 2.943 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1436 1 93 LEU HA 1 93 LEU HG . . 3.980 3.523 3.356 3.637 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1437 1 94 LEU HA 1 94 LEU MD1 . . 3.570 3.111 2.599 3.545 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1438 1 94 LEU HA 1 94 LEU MD2 . . 4.190 4.077 3.954 4.128 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1439 1 94 LEU HB3 1 94 LEU MD2 . . 3.310 2.075 1.928 2.195 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1440 1 94 LEU HB2 1 94 LEU MD2 . . 3.650 2.836 2.648 3.059 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1441 1 98 LEU HA 1 98 LEU HG . . 3.480 3.562 3.498 3.609 0.129 2 0 "[ . 1 . 2 . 3 . ]" 1 1442 1 98 LEU HB2 1 98 LEU MD1 . . 3.430 2.316 2.269 2.433 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1443 1 98 LEU HA 1 98 LEU MD1 . . 3.890 3.919 3.875 3.961 0.071 31 0 "[ . 1 . 2 . 3 . ]" 1 1444 1 98 LEU HB3 1 98 LEU MD1 . . 2.920 2.359 2.220 2.412 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1445 1 98 LEU HA 1 98 LEU MD2 . . 3.360 2.123 2.009 2.264 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1446 1 98 LEU HB2 1 98 LEU MD2 . . 3.290 3.204 3.197 3.209 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1447 1 98 LEU HB3 1 98 LEU MD2 . . 3.350 2.513 2.436 2.554 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1448 1 119 LEU HA 1 119 LEU QD . . 4.130 2.929 1.853 3.271 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1449 1 99 THR MG 1 119 LEU QD . . 3.350 2.280 1.647 3.353 0.003 36 0 "[ . 1 . 2 . 3 . ]" 1 1450 1 133 LEU HB3 1 133 LEU QD . . 2.400 2.186 2.038 2.404 0.004 33 0 "[ . 1 . 2 . 3 . ]" 1 1451 1 133 LEU HA 1 133 LEU QD . . 3.530 2.364 1.954 2.705 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1452 1 159 LEU HA 1 159 LEU HG . . 4.210 2.848 2.373 3.427 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1453 1 159 LEU HA 1 159 LEU QD . . 3.100 2.013 1.790 2.317 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1454 1 159 LEU QB 1 159 LEU QD . . 2.900 1.941 1.843 2.016 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1455 1 25 MET ME 1 25 MET HG2 . . 3.910 2.468 2.269 2.625 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1456 1 78 LYS HB2 1 78 LYS QE . . 4.010 2.100 1.914 2.390 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1457 1 78 LYS HB3 1 78 LYS QD . . 3.390 2.837 2.402 3.314 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1458 1 78 LYS HA 1 78 LYS QD . . 4.530 3.911 3.326 4.124 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1459 1 78 LYS QE 1 78 LYS HG3 . . 3.590 2.847 2.206 3.437 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1460 1 78 LYS HA 1 78 LYS QE . . 4.380 4.167 3.915 4.327 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1461 1 78 LYS HB3 1 78 LYS QE . . 4.040 2.536 1.903 3.540 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1462 1 78 LYS HA 1 78 LYS HG3 . . 3.930 2.639 2.232 3.436 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1463 1 84 ILE HA 1 84 ILE MG . . 3.680 2.373 2.275 2.460 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1464 1 84 ILE HA 1 84 ILE HG13 . . 4.220 3.751 3.726 3.789 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1465 1 84 ILE HG12 1 84 ILE MG . . 3.690 3.234 3.223 3.241 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1466 1 84 ILE HB 1 84 ILE MD . . 3.330 3.201 3.198 3.216 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1467 1 84 ILE HA 1 84 ILE MD . . 3.500 2.004 1.925 2.208 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1468 1 84 ILE MD 1 84 ILE MG . . 2.400 1.979 1.902 2.150 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1469 1 88 LYS HA 1 88 LYS QG . . 3.740 2.303 2.144 2.565 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1470 1 88 LYS HA 1 88 LYS QD . . 4.100 3.861 3.580 4.170 0.070 36 0 "[ . 1 . 2 . 3 . ]" 1 1471 1 97 ILE HA 1 97 ILE MG . . 3.680 2.753 2.626 2.905 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1472 1 97 ILE MD 1 97 ILE MG . . 2.440 2.397 1.819 2.576 0.136 29 0 "[ . 1 . 2 . 3 . ]" 1 1473 1 97 ILE HB 1 97 ILE MD . . 3.130 2.197 2.129 2.570 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1474 1 97 ILE HA 1 97 ILE MD . . 4.380 3.615 3.521 3.690 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1475 1 116 ARG HA 1 116 ARG HD3 . . 3.630 3.360 2.075 4.254 0.624 12 9 "[ *. *1 +* . *- 2 .* * * . ]" 1 1476 1 116 ARG HB2 1 116 ARG HD3 . . 4.200 3.324 2.096 4.290 0.090 11 0 "[ . 1 . 2 . 3 . ]" 1 1477 1 116 ARG HB2 1 116 ARG HD2 . . 3.800 3.314 2.087 4.204 0.404 16 0 "[ . 1 . 2 . 3 . ]" 1 1478 1 116 ARG HB3 1 116 ARG HD2 . . 4.250 3.279 2.136 4.252 0.002 27 0 "[ . 1 . 2 . 3 . ]" 1 1479 1 116 ARG HA 1 116 ARG HD2 . . 4.120 3.417 1.714 4.216 0.096 34 0 "[ . 1 . 2 . 3 . ]" 1 1480 1 134 LYS HA 1 134 LYS HG2 . . 3.930 2.050 1.929 2.337 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1481 1 134 LYS HA 1 134 LYS HG3 . . 3.700 2.938 2.630 3.151 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1482 1 134 LYS HA 1 134 LYS QD . . 4.280 3.683 3.366 4.003 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1483 1 134 LYS HB3 1 134 LYS QD . . 3.770 2.169 1.963 2.367 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1484 1 134 LYS HB3 1 134 LYS QE . . 4.350 3.657 2.731 4.024 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1485 1 134 LYS HB2 1 134 LYS QE . . 3.930 3.849 2.875 4.100 0.170 30 0 "[ . 1 . 2 . 3 . ]" 1 1486 1 154 MET HA 1 154 MET QG . . 3.350 2.247 2.152 2.374 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1487 1 138 ALA MB 1 155 ILE HB . . 3.740 1.799 1.708 2.067 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1488 1 160 MET HA 1 160 MET HG2 . . 4.260 2.932 2.497 3.860 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1489 1 67 THR HA 1 106 GLN HA . . 4.800 4.004 3.547 4.315 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1490 1 15 ASN HA 1 16 PRO HD2 . . 3.770 2.300 2.249 2.360 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1491 1 16 PRO HA 1 17 THR HA . . 5.500 4.448 4.398 4.497 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1492 1 17 THR HA 1 21 SER HB2 . . 3.580 3.553 3.081 3.725 0.145 26 0 "[ . 1 . 2 . 3 . ]" 1 1493 1 19 PRO HA 1 24 GLY HA3 . . 4.170 2.463 1.989 3.030 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1494 1 19 PRO HA 1 24 GLY HA2 . . 3.410 3.426 2.752 3.994 0.584 18 2 "[ . 1 - . + 2 . 3 . ]" 1 1495 1 20 ALA HA 1 37 ASN HA . . 4.450 2.840 2.421 3.283 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1496 1 37 ASN HA 1 38 PRO HD3 . . 3.400 1.973 1.969 1.999 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1497 1 37 ASN HA 1 38 PRO HD2 . . 3.400 2.457 2.354 2.556 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1498 1 25 MET HA 1 33 ALA HA . . 3.210 2.787 2.054 3.173 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1499 1 26 SER HA 1 147 THR HB . . 4.580 3.365 2.997 3.704 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1500 1 26 SER HA 1 147 THR HA . . 3.260 1.957 1.842 2.173 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1501 1 26 SER HB3 1 147 THR HA . . 4.550 4.372 3.544 4.702 0.152 10 0 "[ . 1 . 2 . 3 . ]" 1 1502 1 26 SER HB2 1 147 THR HA . . 4.300 3.803 3.038 4.604 0.304 6 0 "[ . 1 . 2 . 3 . ]" 1 1503 1 28 ASP HA 1 29 PRO HD3 . . 3.380 2.054 1.973 2.219 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1504 1 28 ASP HA 1 29 PRO HD2 . . 3.580 2.735 2.532 3.010 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1505 1 30 VAL HA 1 147 THR HB . . 3.760 2.679 2.266 2.933 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1506 1 30 VAL HA 1 147 THR HA . . 5.070 5.087 4.729 5.205 0.135 24 0 "[ . 1 . 2 . 3 . ]" 1 1507 1 39 GLU HA 1 72 THR HB . . 5.500 4.331 4.102 4.591 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1508 1 39 GLU HA 1 73 ASN HA . . 5.020 4.229 3.742 4.884 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1509 1 52 ASN HA 1 88 LYS HA . . 3.970 3.067 2.305 4.013 0.043 29 0 "[ . 1 . 2 . 3 . ]" 1 1510 1 52 ASN QB 1 88 LYS HA . . 3.730 3.329 2.233 3.752 0.022 2 0 "[ . 1 . 2 . 3 . ]" 1 1511 1 52 ASN HA 1 88 LYS QB . . 4.610 4.153 3.106 4.667 0.057 24 0 "[ . 1 . 2 . 3 . ]" 1 1512 1 57 LEU HA 1 60 THR HB . . 4.110 2.465 1.945 2.867 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1513 1 65 GLN HA 1 150 ALA HA . . 5.150 3.616 3.317 3.921 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1514 1 75 ALA HA 1 157 SER HA . . 2.850 2.828 2.376 2.963 0.113 28 0 "[ . 1 . 2 . 3 . ]" 1 1515 1 79 LEU HA 1 80 PRO HD2 . . 3.330 2.679 2.580 2.865 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1516 1 79 LEU HA 1 80 PRO HD3 . . 3.570 1.979 1.935 2.086 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1517 1 87 LEU HA 1 90 ASN HB2 . . 4.850 2.552 2.031 2.872 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1518 1 87 LEU HA 1 90 ASN HB3 . . 4.760 4.005 3.483 4.360 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1519 1 86 GLU QG 1 90 ASN HB3 . . 4.530 4.485 4.335 4.576 0.046 28 0 "[ . 1 . 2 . 3 . ]" 1 1520 1 68 VAL HA 1 102 VAL HA . . 3.450 2.459 2.191 2.680 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1521 1 103 VAL HA 1 118 THR HB . . 4.220 3.709 3.207 4.157 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1522 1 103 VAL HA 1 118 THR HA . . 3.550 2.007 1.902 2.162 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1523 1 53 PRO HA 1 54 GLN HA . . 4.320 4.360 4.288 4.461 0.141 20 0 "[ . 1 . 2 . 3 . ]" 1 1524 1 49 GLY HA3 1 53 PRO HA . . 4.410 3.649 3.236 4.305 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1525 1 5 GLY HA3 1 142 CYS HA . . 4.230 2.297 1.846 2.564 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1526 1 5 GLY HA2 1 142 CYS HA . . 3.830 4.013 3.391 4.274 0.444 6 0 "[ . 1 . 2 . 3 . ]" 1 1527 1 3 LEU HA 1 144 GLY QA . . 5.470 4.492 3.315 5.127 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1528 1 8 CYS HA 1 142 CYS HA . . 5.160 4.217 3.550 5.187 0.027 33 0 "[ . 1 . 2 . 3 . ]" 1 1529 1 140 VAL HA 1 155 ILE HA . . 3.530 2.709 2.625 2.834 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1530 1 69 PHE HA 1 152 VAL HA . . 5.360 4.608 4.371 4.952 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1531 1 65 GLN HA 1 149 ASN HA . . 4.710 4.170 3.941 4.482 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1532 1 147 THR HB 1 148 ALA HA . . 4.250 4.353 4.289 4.465 0.215 6 0 "[ . 1 . 2 . 3 . ]" 1 1533 1 143 GLY QA 1 153 TYR HA . . 3.390 1.775 1.724 1.829 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1534 1 134 LYS HA 1 139 ASP HA . . 3.070 2.320 2.056 2.663 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1535 1 138 ALA HA 1 157 SER HB3 . . 4.630 3.872 3.549 4.414 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1536 1 138 ALA HA 1 157 SER HB2 . . 3.940 3.034 2.356 3.432 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1537 1 126 VAL HA 1 135 VAL HA . . 3.480 2.029 1.888 2.276 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1538 1 128 GLY QA 1 133 LEU HA . . 3.660 1.972 1.740 2.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1539 1 129 GLN HA 1 130 GLY QA . . 5.500 4.142 3.907 4.392 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1540 1 115 THR HA 1 125 THR HA . . 3.200 2.376 1.914 2.854 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1541 1 123 SER HA 1 124 VAL HA . . 4.950 4.414 4.390 4.449 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1542 1 117 GLN HA 1 123 SER HA . . 3.290 2.250 1.962 2.494 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1543 1 117 GLN QB 1 123 SER HA . . 4.330 4.126 3.536 4.438 0.108 13 0 "[ . 1 . 2 . 3 . ]" 1 1544 1 112 VAL HA 1 112 VAL QG . . 3.280 2.145 2.039 2.273 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1545 1 97 ILE HA 1 97 ILE QG . . 3.940 2.097 1.995 2.193 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1546 1 79 LEU HA 1 83 THR HB . . 4.560 4.381 4.058 4.629 0.069 3 0 "[ . 1 . 2 . 3 . ]" 1 1547 1 75 ALA HA 1 78 LYS QE . . 3.790 2.749 1.784 3.729 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1548 1 65 GLN HA 1 149 ASN HB2 . . 4.450 2.928 2.724 3.127 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1549 1 65 GLN HA 1 149 ASN HB3 . . 5.020 4.534 4.309 4.742 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1550 1 59 ASP HA 1 62 ASN QB . . 3.520 3.107 2.631 3.551 0.031 38 0 "[ . 1 . 2 . 3 . ]" 1 1551 1 49 GLY HA2 1 56 ASN HA . . 4.440 4.083 3.397 4.487 0.047 33 0 "[ . 1 . 2 . 3 . ]" 1 1552 1 49 GLY HA3 1 56 ASN HA . . 4.510 4.088 3.136 4.572 0.062 37 0 "[ . 1 . 2 . 3 . ]" 1 1553 1 52 ASN HA 1 53 PRO HD2 . . 3.520 2.325 2.240 2.461 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1554 1 20 ALA HA 1 36 ASN HA . . 5.500 4.750 4.189 5.502 0.002 30 0 "[ . 1 . 2 . 3 . ]" 1 1555 1 22 VAL HA 1 25 MET HB3 . . 4.300 4.306 4.076 4.384 0.084 18 0 "[ . 1 . 2 . 3 . ]" 1 1556 1 22 VAL HA 1 25 MET HG2 . . 4.750 2.763 2.366 3.245 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1557 1 18 GLY HA2 1 19 PRO HD2 . . 3.290 3.164 2.948 3.529 0.239 19 0 "[ . 1 . 2 . 3 . ]" 1 1558 1 18 GLY HA3 1 19 PRO HD2 . . 3.730 2.414 2.212 2.579 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1559 1 17 THR HA 1 21 SER HB3 . . 3.830 3.026 2.320 3.870 0.040 15 0 "[ . 1 . 2 . 3 . ]" 1 1560 1 15 ASN HA 1 16 PRO HD3 . . 3.950 2.471 2.316 2.596 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1561 1 8 CYS HA 1 142 CYS HB3 . . 4.120 3.531 3.068 4.116 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1562 1 8 CYS HA 1 142 CYS HB2 . . 4.230 2.298 1.970 3.033 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1563 1 5 GLY HA3 1 6 PRO HD3 . . 3.760 3.214 3.116 3.312 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1564 1 3 LEU QD 1 8 CYS QB . . 4.090 3.712 2.066 3.967 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1565 1 3 LEU HB2 1 8 CYS QB . . 4.380 3.273 2.576 4.391 0.011 37 0 "[ . 1 . 2 . 3 . ]" 1 1566 1 3 LEU HB3 1 8 CYS QB . . 4.090 3.406 2.321 4.028 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1567 1 113 VAL HA 1 126 VAL HA . . 5.100 4.249 3.951 4.577 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1568 1 66 TYR HA 1 104 ALA HA . . 3.800 2.230 1.879 2.414 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1569 1 84 ILE HA 1 87 LEU HG . . 4.130 2.218 1.942 2.438 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1570 1 84 ILE HA 1 87 LEU HB2 . . 4.060 2.987 2.513 3.176 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1571 1 83 THR HA 1 86 GLU HB2 . . 3.110 2.881 2.607 3.118 0.008 29 0 "[ . 1 . 2 . 3 . ]" 1 1572 1 82 SER HA 1 85 ASP HB2 . . 3.980 2.837 2.350 3.852 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1573 1 81 ALA HA 1 84 ILE HB . . 3.600 2.599 2.454 3.160 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1574 1 84 ILE HA 1 87 LEU HB3 . . 4.550 4.440 4.100 4.564 0.014 34 0 "[ . 1 . 2 . 3 . ]" 1 1575 1 45 ALA HA 1 50 GLN HB3 . . 4.020 3.703 3.513 4.053 0.033 28 0 "[ . 1 . 2 . 3 . ]" 1 1576 1 45 ALA HA 1 50 GLN HB2 . . 3.770 2.096 1.938 2.430 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1577 1 38 PRO HA 1 41 THR MG . . 3.660 2.346 1.709 3.141 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1578 1 34 ALA HA 1 37 ASN HB2 . . 3.830 2.541 1.901 3.421 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1579 1 34 ALA HA 1 37 ASN HB3 . . 4.090 3.793 3.186 4.200 0.110 28 0 "[ . 1 . 2 . 3 . ]" 1 1580 1 32 VAL HA 1 35 SER QB . . 3.880 2.120 1.758 2.585 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1581 1 25 MET HA 1 25 MET HG3 . . 3.710 3.646 3.604 3.696 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1582 1 25 MET HA 1 25 MET HG2 . . 3.950 3.845 3.796 3.895 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1583 1 20 ALA HA 1 36 ASN HB3 . . 4.110 2.885 1.967 4.217 0.107 33 0 "[ . 1 . 2 . 3 . ]" 1 1584 1 20 ALA HA 1 36 ASN HB2 . . 4.360 3.128 2.000 4.372 0.012 38 0 "[ . 1 . 2 . 3 . ]" 1 1585 1 20 ALA HA 1 25 MET ME . . 4.490 3.592 3.036 4.095 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1586 1 159 LEU HA 1 160 MET HG3 . . 4.190 3.326 2.981 3.959 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1587 1 13 ALA HA 1 16 PRO QG . . 4.700 3.965 3.342 4.655 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1588 1 13 ALA HA 1 16 PRO HB3 . . 5.230 3.836 3.236 4.411 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1589 1 14 ALA HA 1 16 PRO HD3 . . 5.500 3.705 3.500 4.030 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1590 1 40 LEU HA 1 43 LEU HB3 . . 3.860 2.768 2.172 3.018 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1591 1 43 LEU HA 1 46 ALA MB . . 3.590 2.842 2.749 3.037 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1592 1 76 PHE HB3 1 84 ILE MD . . 4.460 2.647 2.034 3.094 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1593 1 76 PHE HB2 1 84 ILE MD . . 4.800 4.194 3.645 4.582 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1594 1 26 SER HA 1 147 THR MG . . 3.750 3.553 3.135 3.808 0.058 20 0 "[ . 1 . 2 . 3 . ]" 1 1595 1 30 VAL HA 1 33 ALA MB . . 3.610 2.473 1.951 2.877 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1596 1 70 ALA HA 1 71 PRO HD2 . . 3.700 2.366 2.317 2.427 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1597 1 71 PRO HA 1 75 ALA MB . . 3.930 2.636 2.263 2.895 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1598 1 39 GLU QB 1 72 THR HB . . 4.160 2.459 2.006 2.783 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1599 1 72 THR HB 1 74 ALA MB . . 4.620 3.638 3.269 4.306 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1600 1 74 ALA HA 1 77 SER QB . . 3.030 2.393 1.968 2.729 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1601 1 75 ALA HA 1 78 LYS HB2 . . 3.650 3.327 3.071 3.628 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1602 1 75 ALA HA 1 78 LYS QD . . 3.930 3.285 2.045 4.041 0.111 14 0 "[ . 1 . 2 . 3 . ]" 1 1603 1 75 ALA HA 1 78 LYS HG2 . . 5.410 5.068 3.809 5.525 0.115 3 0 "[ . 1 . 2 . 3 . ]" 1 1604 1 75 ALA HA 1 78 LYS HB3 . . 4.850 4.842 4.603 4.988 0.138 18 0 "[ . 1 . 2 . 3 . ]" 1 1605 1 58 VAL HA 1 61 LEU HB3 . . 4.600 4.108 3.631 4.637 0.037 34 0 "[ . 1 . 2 . 3 . ]" 1 1606 1 58 VAL HA 1 61 LEU HB2 . . 4.300 2.556 2.037 3.129 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1607 1 58 VAL HA 1 61 LEU QD . . 4.710 3.069 1.907 4.010 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1608 1 47 LEU QD 1 58 VAL HA . . 5.290 3.106 2.367 3.884 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1609 1 55 VAL QG 1 91 SER HA . . 3.160 2.092 1.854 2.895 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1610 1 91 SER HA 1 94 LEU HB3 . . 3.950 3.850 3.315 4.058 0.108 15 0 "[ . 1 . 2 . 3 . ]" 1 1611 1 90 ASN HB3 1 93 LEU QB . . 3.920 2.818 2.061 3.291 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1612 1 90 ASN HB2 1 93 LEU QB . . 4.180 4.100 3.497 4.230 0.050 21 0 "[ . 1 . 2 . 3 . ]" 1 1613 1 94 LEU HA 1 97 ILE MD . . 3.550 2.662 2.121 3.299 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1614 1 97 ILE HA 1 100 TYR HB2 . . 3.640 3.207 3.007 3.374 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1615 1 97 ILE HA 1 100 TYR HB3 . . 4.920 2.514 2.299 2.819 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1616 1 98 LEU HA 1 101 HIS HB2 . . 4.530 2.392 2.280 2.572 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1617 1 57 LEU QD 1 98 LEU HA . . 4.810 4.227 3.754 4.620 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1618 1 97 ILE MG 1 98 LEU HG . . 4.330 3.636 2.933 4.053 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1619 1 94 LEU MD1 1 98 LEU HG . . 3.890 2.988 2.606 3.609 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1620 1 94 LEU HG 1 98 LEU HG . . 4.170 2.795 2.214 3.248 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1621 1 61 LEU QD 1 102 VAL QG . . 3.320 1.783 1.510 2.458 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1622 1 99 THR HB 1 120 GLN HA . . 3.030 2.281 1.915 2.810 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1623 1 66 TYR HA 1 67 THR HA . . 5.500 4.585 4.531 4.615 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1624 1 69 PHE HA 1 70 ALA HA . . 5.500 4.372 4.331 4.411 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1625 1 65 GLN HB2 1 105 GLY QA . . 5.090 3.480 2.914 3.803 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1626 1 65 GLN HB3 1 105 GLY QA . . 4.640 3.458 2.385 4.500 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1627 1 66 TYR HB3 1 104 ALA HA . . 4.880 4.185 3.724 4.516 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1628 1 67 THR HB 1 103 VAL HB . . 3.430 1.967 1.812 2.286 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1629 1 3 LEU HB3 1 4 VAL HA . . 4.470 4.361 4.101 4.497 0.027 19 0 "[ . 1 . 2 . 3 . ]" 1 1630 1 4 VAL QG 1 143 GLY QA . . 4.360 2.742 2.487 3.064 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1631 1 3 LEU HA 1 4 VAL QG . . 4.870 3.477 2.861 4.428 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1632 1 5 GLY HA3 1 6 PRO HG2 . . 5.020 5.068 4.972 5.170 0.150 26 0 "[ . 1 . 2 . 3 . ]" 1 1633 1 5 GLY HA2 1 6 PRO HD2 . . 3.900 2.654 2.551 2.754 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1634 1 7 GLY HA3 1 141 VAL QG . . 3.440 1.894 1.744 2.136 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1635 1 8 CYS HA 1 11 TYR HB2 . . 3.890 3.377 1.973 3.963 0.073 38 0 "[ . 1 . 2 . 3 . ]" 1 1636 1 8 CYS QB 1 9 ALA MB . . 4.830 3.818 3.551 4.044 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1637 1 15 ASN HB2 1 21 SER HA . . 4.660 3.697 2.263 4.480 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1638 1 12 ALA HA 1 15 ASN HB2 . . 5.060 3.572 2.814 3.803 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1639 1 15 ASN HB3 1 21 SER HA . . 4.500 3.613 2.315 4.458 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1640 1 16 PRO HA 1 17 THR MG . . 5.500 3.931 3.596 4.150 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1641 1 12 ALA MB 1 16 PRO HA . . 5.500 3.054 2.595 3.603 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1642 1 21 SER HA 1 22 VAL HA . . 5.500 4.325 4.303 4.391 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1643 1 22 VAL HA 1 145 VAL MG2 . . 4.490 4.103 3.555 4.491 0.001 36 0 "[ . 1 . 2 . 3 . ]" 1 1644 1 25 MET HA 1 33 ALA MB . . 3.110 3.101 2.833 3.210 0.100 10 0 "[ . 1 . 2 . 3 . ]" 1 1645 1 28 ASP HA 1 29 PRO HG2 . . 5.330 4.685 4.538 4.901 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1646 1 28 ASP HA 1 29 PRO HG3 . . 5.500 4.323 4.250 4.465 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1647 1 28 ASP HB3 1 32 VAL HB . . 3.570 2.029 1.842 2.573 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1648 1 28 ASP HB3 1 32 VAL MG2 . . 4.440 3.598 3.225 3.911 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1649 1 28 ASP HB2 1 32 VAL HB . . 4.160 3.595 3.256 3.789 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1650 1 28 ASP HB3 1 29 PRO HD2 . . 4.090 2.322 1.911 2.662 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1651 1 30 VAL HA 1 150 ALA MB . . 3.530 3.385 3.154 3.629 0.099 11 0 "[ . 1 . 2 . 3 . ]" 1 1652 1 30 VAL HB 1 147 THR HB . . 4.770 4.315 3.784 4.503 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1653 1 30 VAL HB 1 150 ALA MB . . 3.170 1.882 1.731 2.139 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1654 1 31 ALA MB 1 58 VAL HA . . 3.460 2.155 1.761 2.833 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1655 1 31 ALA MB 1 58 VAL QG . . 2.970 2.076 1.612 2.701 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1656 1 31 ALA MB 1 61 LEU QD . . 4.540 2.705 1.794 3.942 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1657 1 46 ALA MB 1 47 LEU QD . . 4.430 2.936 2.754 3.189 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1658 1 33 ALA MB 1 147 THR HA . . 4.520 3.659 3.289 3.995 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1659 1 33 ALA MB 1 147 THR MG . . 2.400 1.678 1.608 1.771 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1660 1 25 MET HG3 1 33 ALA MB . . 3.430 2.852 2.596 3.174 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1661 1 25 MET HG2 1 33 ALA MB . . 4.300 3.967 3.762 4.229 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1662 1 31 ALA HA 1 34 ALA MB . . 3.620 3.133 2.700 3.614 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1663 1 34 ALA MB 1 35 SER HA . . 5.060 3.814 3.603 3.987 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1664 1 34 ALA MB 1 37 ASN HB2 . . 4.820 3.887 3.191 4.626 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1665 1 34 ALA MB 1 37 ASN HB3 . . 4.940 4.534 3.852 4.979 0.039 35 0 "[ . 1 . 2 . 3 . ]" 1 1666 1 37 ASN HB2 1 40 LEU HB2 . . 4.000 2.615 1.932 3.274 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1667 1 37 ASN HB2 1 40 LEU HB3 . . 4.340 4.068 3.529 4.593 0.253 31 0 "[ . 1 . 2 . 3 . ]" 1 1668 1 37 ASN HB2 1 40 LEU HG . . 4.170 2.425 1.835 3.037 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1669 1 37 ASN HB3 1 38 PRO HD2 . . 5.100 3.545 3.022 4.154 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1670 1 37 ASN HB3 1 38 PRO HD3 . . 4.350 4.268 3.920 4.642 0.292 22 0 "[ . 1 . 2 . 3 . ]" 1 1671 1 37 ASN HB3 1 40 LEU HB2 . . 3.760 2.645 1.911 3.512 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1672 1 37 ASN HB3 1 40 LEU HB3 . . 4.540 4.013 3.422 4.615 0.075 5 0 "[ . 1 . 2 . 3 . ]" 1 1673 1 39 GLU QB 1 72 THR MG . . 4.040 2.592 2.279 2.816 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1674 1 39 GLU HG3 1 72 THR MG . . 4.210 4.242 3.886 4.340 0.130 20 0 "[ . 1 . 2 . 3 . ]" 1 1675 1 38 PRO QG 1 39 GLU HG3 . . 3.570 3.604 3.400 3.759 0.189 33 0 "[ . 1 . 2 . 3 . ]" 1 1676 1 42 THR MG 1 76 PHE HB3 . . 3.680 2.892 2.003 3.610 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1677 1 42 THR MG 1 76 PHE HB2 . . 3.730 2.536 2.212 2.910 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1678 1 42 THR MG 1 76 PHE HA . . 4.750 4.611 4.085 4.801 0.051 16 0 "[ . 1 . 2 . 3 . ]" 1 1679 1 43 LEU HA 1 47 LEU QD . . 5.260 3.550 3.248 3.885 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1680 1 42 THR MG 1 43 LEU HA . . 5.250 3.278 2.755 3.990 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1681 1 47 LEU HA 1 57 LEU HB2 . . 4.740 2.872 2.053 3.593 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1682 1 47 LEU HA 1 57 LEU HB3 . . 5.200 4.497 3.724 5.070 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1683 1 47 LEU HA 1 57 LEU QD . . 4.220 2.894 2.229 3.758 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1684 1 48 SER HA 1 58 VAL QG . . 3.400 1.774 1.700 1.894 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1685 1 48 SER QB 1 58 VAL QG . . 3.270 2.321 1.801 3.097 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1686 1 45 ALA MB 1 50 GLN HB3 . . 3.830 3.132 2.786 3.584 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1687 1 45 ALA MB 1 50 GLN HB2 . . 3.970 2.097 1.920 2.465 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1688 1 52 ASN HA 1 53 PRO HD3 . . 3.450 2.089 1.970 2.312 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1689 1 52 ASN QB 1 94 LEU MD2 . . 3.560 2.283 1.900 2.968 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1690 1 52 ASN HA 1 94 LEU MD2 . . 4.980 4.344 3.661 5.005 0.025 4 0 "[ . 1 . 2 . 3 . ]" 1 1691 1 52 ASN QB 1 55 VAL QG . . 4.080 2.062 1.487 2.882 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1692 1 91 SER HA 1 94 LEU MD2 . . 4.290 2.180 1.895 3.001 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1693 1 87 LEU HA 1 94 LEU MD2 . . 4.060 3.256 2.766 3.771 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1694 1 52 ASN QB 1 55 VAL HB . . 3.790 2.922 2.069 3.673 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1695 1 55 VAL HB 1 94 LEU MD2 . . 3.530 3.034 2.556 3.545 0.015 15 0 "[ . 1 . 2 . 3 . ]" 1 1696 1 57 LEU HB3 1 60 THR MG . . 5.120 4.086 3.329 4.485 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1697 1 57 LEU HB3 1 60 THR HB . . 4.590 3.396 2.572 3.869 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1698 1 57 LEU HB3 1 61 LEU QD . . 4.030 2.358 1.700 3.213 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1699 1 57 LEU HB3 1 61 LEU HG . . 3.860 2.857 1.943 4.817 0.957 9 2 "[ . +1 . 2 .- 3 . ]" 1 1700 1 57 LEU HB2 1 61 LEU QD . . 4.110 2.990 1.723 3.697 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1701 1 58 VAL HA 1 59 ASP HA . . 5.480 4.790 4.620 4.886 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1702 1 60 THR HB 1 61 LEU QD . . 4.500 3.174 2.456 3.995 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1703 1 29 PRO HB3 1 62 ASN HA . . 4.450 4.326 3.909 4.534 0.084 7 0 "[ . 1 . 2 . 3 . ]" 1 1704 1 67 THR HA 1 68 VAL HB . . 4.850 4.613 4.444 4.727 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1705 1 66 TYR HA 1 67 THR HB . . 4.960 4.544 4.214 4.737 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1706 1 68 VAL MG1 1 101 HIS HB3 . . 4.600 3.724 3.326 4.126 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1707 1 68 VAL MG1 1 69 PHE HA . . 5.060 3.824 3.544 3.998 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1708 1 70 ALA HA 1 71 PRO HG3 . . 4.690 4.188 4.185 4.195 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1709 1 70 ALA HA 1 71 PRO HG2 . . 4.660 4.410 4.384 4.445 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1710 1 68 VAL MG1 1 70 ALA HA . . 4.480 3.059 2.944 3.197 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1711 1 40 LEU QD 1 70 ALA HA . . 4.890 3.825 3.563 4.051 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1712 1 40 LEU QD 1 72 THR HB . . 4.780 4.273 3.183 4.743 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1713 1 75 ALA MB 1 158 VAL QG . . 3.610 2.411 1.954 2.986 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1714 1 80 PRO HA 1 81 ALA MB . . 5.500 3.966 3.690 4.038 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1715 1 79 LEU HB3 1 80 PRO HD2 . . 4.710 2.166 1.827 2.357 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1716 1 79 LEU HB3 1 80 PRO HD3 . . 4.400 3.129 2.855 3.303 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1717 1 79 LEU QD 1 80 PRO HD3 . . 4.370 3.026 2.510 3.404 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1718 1 76 PHE HA 1 84 ILE MD . . 4.180 3.326 2.973 3.946 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1719 1 83 THR HB 1 84 ILE MD . . 4.100 4.013 3.702 4.158 0.058 3 0 "[ . 1 . 2 . 3 . ]" 1 1720 1 86 GLU QG 1 93 LEU QD . . 3.570 2.768 2.221 3.271 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1721 1 87 LEU HB2 1 94 LEU MD1 . . 4.270 3.307 2.676 3.834 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1722 1 87 LEU HB2 1 94 LEU MD2 . . 4.590 4.238 3.591 4.608 0.018 29 0 "[ . 1 . 2 . 3 . ]" 1 1723 1 84 ILE MD 1 87 LEU HG . . 3.280 3.180 2.963 3.299 0.019 30 0 "[ . 1 . 2 . 3 . ]" 1 1724 1 83 THR MG 1 87 LEU HG . . 3.260 2.719 2.341 2.820 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1725 1 87 LEU HB3 1 94 LEU MD1 . . 3.830 2.158 1.806 2.575 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1726 1 86 GLU QG 1 90 ASN HB2 . . 4.960 4.547 4.330 4.790 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1727 1 90 ASN HA 1 91 SER HA . . 5.500 5.092 4.481 5.369 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1728 1 91 SER HA 1 94 LEU HG . . 5.500 4.058 3.662 4.752 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1729 1 75 ALA MB 1 157 SER HB3 . . 4.570 4.321 4.082 4.794 0.224 38 0 "[ . 1 . 2 . 3 . ]" 1 1730 1 94 LEU HA 1 97 ILE HB . . 3.470 2.748 2.491 2.924 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1731 1 97 ILE MG 1 160 MET HA . . 4.800 3.675 3.054 4.254 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1732 1 97 ILE MG 1 161 PRO HD2 . . 5.440 4.971 4.584 5.324 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1733 1 97 ILE MG 1 161 PRO HD3 . . 4.560 4.047 3.664 4.391 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1734 1 97 ILE QG 1 160 MET HA . . 4.190 2.060 1.787 2.312 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1735 1 97 ILE QG 1 161 PRO HD2 . . 4.020 2.373 1.998 2.684 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1736 1 97 ILE QG 1 161 PRO HD3 . . 4.230 1.994 1.819 2.394 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1737 1 97 ILE MD 1 160 MET HA . . 5.300 3.553 3.189 3.848 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1738 1 97 ILE MD 1 161 PRO HD2 . . 4.600 3.467 3.145 3.967 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1739 1 97 ILE MD 1 161 PRO HD3 . . 4.450 3.719 3.539 4.140 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1740 1 25 MET HA 1 28 ASP HB2 . . 4.450 2.873 2.425 3.352 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1741 1 25 MET HA 1 28 ASP HB3 . . 4.720 4.381 3.621 4.830 0.110 9 0 "[ . 1 . 2 . 3 . ]" 1 1742 1 25 MET HA 1 147 THR MG . . 5.050 4.140 3.832 4.266 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1743 1 67 THR MG 1 103 VAL HB . . 4.560 3.332 2.964 3.662 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1744 1 109 PRO HA 1 112 VAL QG . . 3.340 2.146 1.775 2.481 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1745 1 4 VAL QG 1 109 PRO HG2 . . 3.780 2.333 1.886 3.068 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1746 1 108 SER HB2 1 109 PRO HD2 . . 3.840 1.946 1.831 2.032 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1747 1 108 SER HB2 1 109 PRO HD3 . . 3.610 2.789 2.595 3.104 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1748 1 118 THR HA 1 118 THR MG . . 3.040 2.458 2.229 2.646 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1749 1 103 VAL MG2 1 118 THR HA . . 3.840 1.882 1.738 2.165 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1750 1 118 THR HA 1 124 VAL QG . . 5.320 3.604 3.172 4.088 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1751 1 118 THR MG 1 123 SER HA . . 4.030 3.453 2.948 4.100 0.070 22 0 "[ . 1 . 2 . 3 . ]" 1 1752 1 103 VAL HA 1 119 LEU QD . . 4.480 4.032 2.616 4.486 0.006 9 0 "[ . 1 . 2 . 3 . ]" 1 1753 1 122 ALA MB 1 162 PRO HD2 . . 3.890 1.823 1.683 2.093 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1754 1 122 ALA MB 1 162 PRO HD3 . . 4.190 2.832 2.263 3.303 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1755 1 123 SER HA 1 124 VAL QG . . 4.710 3.396 2.828 3.758 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1756 1 124 VAL HA 1 159 LEU QD . . 5.500 4.121 3.564 4.715 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1757 1 101 HIS HA 1 159 LEU QD . . 4.120 3.071 2.476 3.540 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1758 1 118 THR MG 1 124 VAL HB . . 3.510 2.406 1.785 3.743 0.233 8 0 "[ . 1 . 2 . 3 . ]" 1 1759 1 118 THR MG 1 124 VAL QG . . 3.350 1.725 1.495 2.007 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1760 1 118 THR MG 1 124 VAL HA . . 3.770 3.716 3.377 4.025 0.255 8 0 "[ . 1 . 2 . 3 . ]" 1 1761 1 124 VAL QG 1 135 VAL QG . . 3.090 2.036 1.688 2.310 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1762 1 124 VAL QG 1 159 LEU QD . . 3.220 2.076 1.681 2.583 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1763 1 116 ARG HB2 1 124 VAL QG . . 4.790 2.406 1.859 3.685 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1764 1 116 ARG HB3 1 124 VAL QG . . 4.090 2.078 1.782 2.797 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1765 1 116 ARG QG 1 124 VAL QG . . 3.750 3.181 2.269 3.726 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1766 1 126 VAL HA 1 135 VAL HB . . 4.870 4.582 4.026 4.908 0.038 16 0 "[ . 1 . 2 . 3 . ]" 1 1767 1 134 LYS HA 1 135 VAL HB . . 4.570 3.986 3.837 4.173 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1768 1 126 VAL HA 1 135 VAL QG . . 4.010 2.362 1.890 3.033 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1769 1 128 GLY QA 1 133 LEU QD . . 3.860 2.198 1.693 2.828 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1770 1 129 GLN HA 1 133 LEU QD . . 4.850 4.263 3.471 4.813 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1771 1 133 LEU HB2 1 140 VAL QG . . 3.760 2.233 1.729 3.067 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1772 1 133 LEU HB2 1 140 VAL HB . . 3.680 2.029 1.833 2.493 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1773 1 133 LEU HB3 1 140 VAL HB . . 3.690 2.539 1.875 3.494 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1774 1 133 LEU HB3 1 140 VAL QG . . 2.400 2.057 1.761 2.529 0.129 19 0 "[ . 1 . 2 . 3 . ]" 1 1775 1 134 LYS HA 1 135 VAL QG . . 5.450 3.961 3.651 4.224 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1776 1 134 LYS HA 1 134 LYS QE . . 4.860 4.314 3.443 4.812 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1777 1 39 GLU HG2 1 72 THR HB . . 5.080 4.970 4.787 5.123 0.043 8 0 "[ . 1 . 2 . 3 . ]" 1 1778 1 134 LYS HG3 1 139 ASP HA . . 4.050 3.372 2.901 3.675 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1779 1 134 LYS HG2 1 139 ASP HA . . 4.280 2.056 1.884 2.253 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1780 1 126 VAL MG2 1 135 VAL HB . . 5.230 4.544 4.081 4.885 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1781 1 126 VAL HB 1 135 VAL QG . . 4.940 3.694 3.433 3.972 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1782 1 135 VAL QG 1 153 TYR HB2 . . 4.930 4.005 3.650 4.343 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1783 1 69 PHE HB3 1 135 VAL QG . . 4.720 3.017 2.625 3.155 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1784 1 135 VAL QG 1 153 TYR HB3 . . 5.220 3.492 3.076 3.936 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1785 1 69 PHE HA 1 135 VAL QG . . 5.500 4.086 3.911 4.319 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1786 1 69 PHE HB2 1 135 VAL QG . . 4.900 4.218 3.810 4.382 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1787 1 135 VAL QG 1 136 GLY HA3 . . 5.420 3.149 2.980 3.368 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1788 1 126 VAL MG2 1 135 VAL QG . . 3.110 1.980 1.711 2.304 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1789 1 135 VAL QG 1 159 LEU QD . . 3.510 1.651 1.537 1.780 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1790 1 126 VAL MG2 1 135 VAL HA . . 3.510 3.256 2.813 3.601 0.091 32 0 "[ . 1 . 2 . 3 . ]" 1 1791 1 126 VAL MG1 1 135 VAL HA . . 4.230 3.110 2.554 3.560 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1792 1 124 VAL QG 1 136 GLY HA3 . . 4.680 3.142 2.402 3.686 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1793 1 124 VAL QG 1 136 GLY HA2 . . 5.040 3.627 2.716 4.142 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1794 1 136 GLY HA3 1 159 LEU QD . . 3.870 2.357 1.810 2.799 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1795 1 126 VAL MG2 1 136 GLY HA2 . . 5.500 5.298 4.678 5.658 0.158 19 0 "[ . 1 . 2 . 3 . ]" 1 1796 1 136 GLY HA2 1 159 LEU QD . . 4.300 3.676 3.152 4.131 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1797 1 134 LYS QD 1 137 ASN HA . . 4.070 3.429 2.815 4.133 0.063 14 0 "[ . 1 . 2 . 3 . ]" 1 1798 1 134 LYS HB3 1 137 ASN HA . . 5.220 4.565 3.766 5.255 0.035 9 0 "[ . 1 . 2 . 3 . ]" 1 1799 1 138 ALA MB 1 155 ILE HA . . 4.620 3.665 3.421 3.975 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1800 1 138 ALA MB 1 157 SER HB2 . . 3.590 1.942 1.765 2.405 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1801 1 138 ALA MB 1 157 SER HB3 . . 3.720 3.295 2.925 3.748 0.028 23 0 "[ . 1 . 2 . 3 . ]" 1 1802 1 138 ALA MB 1 159 LEU QD . . 3.570 1.821 1.716 1.967 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1803 1 135 VAL QG 1 138 ALA MB . . 4.380 2.847 2.408 3.388 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1804 1 137 ASN HB2 1 138 ALA MB . . 4.960 4.826 4.178 5.015 0.055 13 0 "[ . 1 . 2 . 3 . ]" 1 1805 1 138 ALA MB 1 156 ASP HA . . 5.120 4.478 4.196 4.902 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1806 1 138 ALA MB 1 139 ASP HA . . 3.670 4.011 3.938 4.140 0.470 14 0 "[ . 1 . 2 . 3 . ]" 1 1807 1 139 ASP HA 1 140 VAL QG . . 4.080 3.746 3.354 3.915 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1808 1 134 LYS QD 1 139 ASP HA . . 4.410 3.923 3.344 4.432 0.022 29 0 "[ . 1 . 2 . 3 . ]" 1 1809 1 140 VAL QG 1 155 ILE HA . . 4.720 3.878 3.770 4.013 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1810 1 140 VAL QG 1 153 TYR HB3 . . 3.280 2.813 2.184 2.993 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1811 1 140 VAL QG 1 153 TYR HB2 . . 4.800 4.137 3.639 4.296 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1812 1 6 PRO HG3 1 141 VAL HA . . 4.310 4.295 4.153 4.405 0.095 6 0 "[ . 1 . 2 . 3 . ]" 1 1813 1 6 PRO HG2 1 141 VAL HA . . 3.990 3.081 2.875 3.241 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1814 1 141 VAL HB 1 155 ILE HA . . 4.730 4.204 3.904 4.458 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1815 1 140 VAL HA 1 141 VAL HB . . 4.690 4.827 4.755 4.892 0.202 6 0 "[ . 1 . 2 . 3 . ]" 1 1816 1 141 VAL QG 1 154 MET HB2 . . 4.060 3.142 2.967 3.499 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1817 1 141 VAL QG 1 155 ILE HA . . 3.740 2.131 1.913 2.428 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1818 1 141 VAL QG 1 156 ASP HB2 . . 3.590 3.865 3.568 4.011 0.421 7 0 "[ . 1 . 2 . 3 . ]" 1 1819 1 141 VAL QG 1 156 ASP HA . . 4.660 3.308 2.947 3.569 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1820 1 140 VAL QG 1 142 CYS HA . . 4.000 3.461 3.191 3.755 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1821 1 141 VAL QG 1 142 CYS HB3 . . 4.500 3.828 3.669 4.062 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1822 1 141 VAL HB 1 142 CYS HB2 . . 4.050 4.103 4.047 4.209 0.159 25 0 "[ . 1 . 2 . 3 . ]" 1 1823 1 141 VAL QG 1 142 CYS HB2 . . 4.730 3.661 3.435 3.914 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1824 1 140 VAL QG 1 143 GLY QA . . 4.520 2.558 2.240 2.836 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1825 1 143 GLY QA 1 153 TYR HB3 . . 4.820 3.482 3.336 3.611 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1826 1 143 GLY QA 1 145 VAL MG2 . . 4.560 2.730 2.372 3.168 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1827 1 143 GLY QA 1 153 TYR HB2 . . 5.010 4.230 4.163 4.311 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1828 1 3 LEU QD 1 144 GLY QA . . 5.090 3.318 2.374 3.952 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1829 1 4 VAL QG 1 144 GLY QA . . 4.380 2.980 2.376 3.899 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1830 1 109 PRO HG3 1 144 GLY QA . . 4.060 2.193 1.885 2.423 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1831 1 109 PRO HG2 1 144 GLY QA . . 4.370 3.555 3.196 3.784 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1832 1 22 VAL QG 1 145 VAL HA . . 4.460 2.762 1.768 4.170 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1833 1 3 LEU QD 1 145 VAL HA . . 3.490 2.866 2.276 3.437 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1834 1 30 VAL QG 1 147 THR HB . . 4.780 4.103 3.645 4.315 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1835 1 33 ALA MB 1 147 THR HB . . 4.090 2.440 2.069 2.871 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1836 1 30 VAL HA 1 147 THR MG . . 3.700 2.567 1.945 2.841 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1837 1 29 PRO HA 1 148 ALA MB . . 3.330 1.908 1.787 2.091 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1838 1 147 THR HB 1 148 ALA MB . . 4.460 3.283 3.159 3.455 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1839 1 28 ASP HA 1 148 ALA MB . . 4.480 4.083 3.651 4.428 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1840 1 27 GLN HA 1 148 ALA MB . . 4.240 4.286 4.235 4.339 0.099 3 0 "[ . 1 . 2 . 3 . ]" 1 1841 1 148 ALA MB 1 149 ASN HB3 . . 4.410 3.868 3.664 4.062 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1842 1 148 ALA MB 1 149 ASN HB2 . . 5.040 4.770 4.623 4.920 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1843 1 29 PRO HD2 1 148 ALA MB . . 5.150 4.816 4.441 5.040 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1844 1 147 THR HA 1 148 ALA MB . . 5.320 4.560 4.488 4.649 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1845 1 148 ALA MB 1 149 ASN HA . . 5.500 4.081 3.908 4.357 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1846 1 66 TYR HA 1 150 ALA HA . . 5.500 4.447 4.395 4.583 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1847 1 66 TYR HA 1 150 ALA MB . . 4.630 3.732 3.506 3.976 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1848 1 65 GLN HA 1 150 ALA MB . . 4.260 3.682 3.417 4.156 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1849 1 67 THR HA 1 150 ALA MB . . 4.670 3.154 2.975 3.394 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1850 1 149 ASN HA 1 150 ALA MB . . 4.470 4.388 4.266 4.551 0.081 18 0 "[ . 1 . 2 . 3 . ]" 1 1851 1 66 TYR HB3 1 150 ALA MB . . 4.010 2.658 2.128 3.013 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1852 1 66 TYR HB2 1 150 ALA MB . . 3.720 1.796 1.739 1.890 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1853 1 106 GLN HA 1 150 ALA HA . . 4.880 4.189 3.688 4.954 0.074 34 0 "[ . 1 . 2 . 3 . ]" 1 1854 1 151 THR HA 1 152 VAL QG . . 3.940 3.898 3.731 3.980 0.040 24 0 "[ . 1 . 2 . 3 . ]" 1 1855 1 151 THR HA 1 152 VAL HB . . 3.880 3.983 3.937 4.064 0.184 23 0 "[ . 1 . 2 . 3 . ]" 1 1856 1 152 VAL HA 1 153 TYR HB2 . . 4.990 4.275 4.228 4.333 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1857 1 71 PRO HA 1 154 MET HA . . 5.030 4.576 4.348 4.859 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1858 1 70 ALA HA 1 154 MET HA . . 5.500 4.529 4.325 4.650 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1859 1 72 THR MG 1 154 MET HA . . 4.840 3.123 2.903 3.416 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1860 1 72 THR MG 1 154 MET HB2 . . 4.060 3.241 3.031 3.520 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1861 1 72 THR MG 1 154 MET HB3 . . 3.810 1.901 1.764 2.117 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1862 1 72 THR MG 1 155 ILE HA . . 5.370 3.805 3.460 4.414 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1863 1 155 ILE HA 1 155 ILE MD . . 4.330 3.783 3.339 4.110 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1864 1 139 ASP HB2 1 155 ILE HA . . 5.500 4.600 4.248 5.113 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1865 1 140 VAL HB 1 155 ILE HA . . 5.500 5.583 5.505 5.698 0.198 22 0 "[ . 1 . 2 . 3 . ]" 1 1866 1 155 ILE MG 1 159 LEU QD . . 3.890 2.906 2.450 3.266 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1867 1 153 TYR HB3 1 155 ILE MG . . 4.180 3.443 3.312 3.572 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1868 1 153 TYR HB2 1 155 ILE MG . . 4.210 4.152 3.943 4.395 0.185 16 0 "[ . 1 . 2 . 3 . ]" 1 1869 1 154 MET HA 1 155 ILE MG . . 5.040 3.884 3.387 4.543 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1870 1 135 VAL QG 1 155 ILE HB . . 5.500 3.907 3.508 4.394 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1871 1 155 ILE HB 1 159 LEU QD . . 3.670 3.549 2.872 3.699 0.029 21 0 "[ . 1 . 2 . 3 . ]" 1 1872 1 155 ILE HA 1 156 ASP HA . . 5.500 4.342 4.293 4.398 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1873 1 157 SER HA 1 158 VAL QG . . 4.640 3.506 3.177 3.776 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1874 1 76 PHE HA 1 158 VAL QG . . 3.550 1.980 1.805 2.438 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1875 1 76 PHE HB2 1 158 VAL QG . . 4.970 3.924 3.567 4.354 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1876 1 71 PRO HA 1 158 VAL QG . . 5.090 4.357 3.951 4.575 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1877 1 76 PHE HB3 1 158 VAL QG . . 5.080 3.765 3.398 4.230 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1878 1 157 SER HB2 1 158 VAL QG . . 5.420 4.907 4.337 5.348 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1879 1 158 VAL QG 1 159 LEU H . . 5.500 3.567 3.242 3.776 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1880 1 69 PHE HB2 1 159 LEU QD . . 4.440 3.589 3.019 4.120 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1881 1 69 PHE HB3 1 159 LEU QD . . 4.660 2.575 1.920 3.147 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1882 1 100 TYR HB3 1 159 LEU QD . . 4.760 4.527 4.084 4.752 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1883 1 69 PHE HA 1 159 LEU QD . . 5.500 4.603 3.847 5.162 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1884 1 101 HIS HB3 1 159 LEU QD . . 5.340 4.825 4.098 5.195 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1885 1 124 VAL HB 1 159 LEU QD . . 4.190 3.627 2.795 4.203 0.013 14 0 "[ . 1 . 2 . 3 . ]" 1 1886 1 160 MET HA 1 161 PRO HD3 . . 3.600 1.954 1.931 1.990 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1887 1 97 ILE HA 1 160 MET HA . . 4.040 2.809 2.484 3.052 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1888 1 160 MET HA 1 161 PRO HD2 . . 3.460 2.580 2.479 2.682 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1889 1 4 VAL QG 1 142 CYS HA . . 4.280 3.802 1.848 4.255 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1890 1 4 VAL QG 1 109 PRO HD3 . . 5.380 4.011 3.679 4.423 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1891 1 4 VAL QG 1 109 PRO HA . . 5.020 3.930 3.491 4.367 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1892 1 4 VAL QG 1 5 GLY HA3 . . 5.500 3.510 1.900 3.945 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1893 1 5 GLY HA2 1 6 PRO HG2 . . 5.100 4.601 4.529 4.676 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1894 1 5 GLY HA2 1 140 VAL QG . . 4.970 3.511 2.944 4.237 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1895 1 5 GLY HA2 1 6 PRO HG3 . . 5.380 4.247 4.214 4.290 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1896 1 4 VAL QG 1 5 GLY HA2 . . 5.500 3.630 2.539 4.363 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1897 1 5 GLY HA3 1 6 PRO HG3 . . 5.500 5.283 5.187 5.382 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1898 1 6 PRO HD2 1 141 VAL HA . . 3.190 2.189 1.935 2.743 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1899 1 6 PRO HD2 1 142 CYS HA . . 5.500 4.302 3.518 4.810 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1900 1 6 PRO HD3 1 141 VAL HA . . 5.480 3.764 3.528 4.243 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1901 1 7 GLY HA3 1 142 CYS HB3 . . 5.030 4.849 3.631 5.063 0.033 21 0 "[ . 1 . 2 . 3 . ]" 1 1902 1 8 CYS HA 1 9 ALA MB . . 5.500 5.002 4.950 5.050 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1903 1 8 CYS QB 1 142 CYS HA . . 5.500 2.484 1.866 3.061 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1904 1 13 ALA HA 1 16 PRO HA . . 5.500 4.942 4.509 5.235 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1905 1 14 ALA HA 1 15 ASN HA . . 5.500 4.492 4.469 4.501 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1906 1 15 ASN HB2 1 20 ALA MB . . 3.530 3.480 3.197 3.575 0.045 6 0 "[ . 1 . 2 . 3 . ]" 1 1907 1 15 ASN HB3 1 20 ALA MB . . 3.230 2.827 2.533 3.016 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1908 1 17 THR HB 1 18 GLY HA3 . . 5.500 4.877 4.450 5.733 0.233 34 0 "[ . 1 . 2 . 3 . ]" 1 1909 1 17 THR HB 1 18 GLY HA2 . . 5.500 4.318 4.037 4.779 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1910 1 22 VAL HA 1 25 MET HG3 . . 4.800 4.246 3.735 4.814 0.014 18 0 "[ . 1 . 2 . 3 . ]" 1 1911 1 20 ALA MB 1 38 PRO HD2 . . 3.770 2.862 2.401 3.106 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1912 1 15 ASN HA 1 20 ALA MB . . 4.940 4.650 4.046 4.954 0.014 6 0 "[ . 1 . 2 . 3 . ]" 1 1913 1 5 GLY HA3 1 140 VAL QG . . 5.270 3.248 2.717 3.792 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1914 1 7 GLY HA3 1 141 VAL HA . . 4.620 3.895 3.441 4.301 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1915 1 4 VAL QG 1 109 PRO HB3 . . 3.790 2.231 1.927 2.712 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1916 1 4 VAL QG 1 109 PRO HG3 . . 4.510 2.232 1.879 2.810 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1917 1 12 ALA HA 1 15 ASN HB3 . . 4.770 4.751 4.267 5.067 0.297 3 0 "[ . 1 . 2 . 3 . ]" 1 1918 1 22 VAL HA 1 145 VAL HB . . 4.270 4.361 4.281 4.438 0.168 6 0 "[ . 1 . 2 . 3 . ]" 1 1919 1 15 ASN HB3 1 16 PRO HD2 . . 5.500 4.349 4.137 4.493 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1920 1 52 ASN HA 1 53 PRO QG . . 4.270 3.899 3.866 3.980 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1921 1 16 PRO HB2 1 17 THR MG . . 3.300 2.388 2.256 2.550 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1922 1 18 GLY HA2 1 19 PRO HD3 . . 3.720 2.345 2.153 2.730 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1923 1 18 GLY HA3 1 19 PRO HD3 . . 3.950 2.704 2.317 2.925 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1924 1 20 ALA MB 1 37 ASN HA . . 3.880 2.106 1.821 2.311 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1925 1 20 ALA MB 1 37 ASN HB2 . . 4.610 4.455 4.037 4.775 0.165 33 0 "[ . 1 . 2 . 3 . ]" 1 1926 1 20 ALA MB 1 37 ASN HB3 . . 4.750 4.549 3.971 4.817 0.067 1 0 "[ . 1 . 2 . 3 . ]" 1 1927 1 20 ALA MB 1 38 PRO HD3 . . 3.620 1.745 1.679 1.831 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1928 1 20 ALA MB 1 38 PRO HA . . 4.420 4.531 4.414 4.716 0.296 20 0 "[ . 1 . 2 . 3 . ]" 1 1929 1 20 ALA MB 1 21 SER HA . . 5.500 4.009 3.569 4.203 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1930 1 21 SER HB2 1 22 VAL HA . . 4.740 4.755 4.479 5.356 0.616 26 2 "[ . 1 . 2 .+ 3 -. ]" 1 1931 1 25 MET HG3 1 33 ALA HA . . 4.620 4.644 4.305 4.771 0.151 35 0 "[ . 1 . 2 . 3 . ]" 1 1932 1 25 MET HB3 1 33 ALA HA . . 4.850 3.739 3.128 4.109 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1933 1 22 VAL HA 1 25 MET ME . . 3.340 2.123 1.908 2.679 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1934 1 28 ASP HB3 1 29 PRO HD3 . . 4.390 3.355 3.015 3.642 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1935 1 28 ASP HB2 1 29 PRO HD2 . . 4.860 3.880 3.589 4.175 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1936 1 28 ASP HB2 1 29 PRO HD3 . . 5.180 4.465 4.229 4.647 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1937 1 28 ASP HB2 1 33 ALA HA . . 4.520 2.546 1.955 3.296 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1938 1 28 ASP HB3 1 33 ALA HA . . 4.160 3.105 2.871 3.744 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1939 1 29 PRO HB2 1 62 ASN HA . . 3.410 3.441 3.186 3.626 0.216 12 0 "[ . 1 . 2 . 3 . ]" 1 1940 1 29 PRO HB3 1 62 ASN QB . . 4.490 3.575 2.665 4.409 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1941 1 29 PRO HB2 1 62 ASN QB . . 3.850 2.537 1.987 3.895 0.045 29 0 "[ . 1 . 2 . 3 . ]" 1 1942 1 31 ALA HA 1 58 VAL HA . . 5.450 4.210 3.219 5.025 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1943 1 2 ASP HB2 1 3 LEU QD . . 4.840 4.453 2.853 5.217 0.377 25 0 "[ . 1 . 2 . 3 . ]" 1 1944 1 2 ASP HB3 1 3 LEU QD . . 5.400 4.172 3.415 5.191 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1945 1 6 PRO HD2 1 141 VAL QG . . 4.410 3.256 2.928 3.674 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1946 1 8 CYS QB 1 9 ALA HA . . 4.060 3.865 3.659 4.015 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1947 1 7 GLY HA3 1 10 GLU QB . . 5.500 4.319 3.576 4.847 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1948 1 10 GLU QB 1 11 TYR HA . . 4.520 3.732 3.651 3.878 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1949 1 7 GLY HA2 1 10 GLU QB . . 4.650 2.906 2.116 3.668 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1950 1 12 ALA HA 1 16 PRO HA . . 4.480 3.144 2.581 3.589 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1951 1 11 TYR HB3 1 12 ALA MB . . 3.660 3.587 3.471 3.707 0.047 33 0 "[ . 1 . 2 . 3 . ]" 1 1952 1 13 ALA MB 1 14 ALA HA . . 5.270 3.880 3.797 4.021 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1953 1 11 TYR HA 1 14 ALA MB . . 3.930 2.832 2.453 3.397 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1954 1 16 PRO HB3 1 17 THR MG . . 3.960 3.931 3.750 4.088 0.128 22 0 "[ . 1 . 2 . 3 . ]" 1 1955 1 15 ASN HA 1 16 PRO QG . . 4.280 4.069 3.982 4.145 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1956 1 16 PRO QG 1 17 THR MG . . 4.380 3.181 2.659 3.652 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1957 1 20 ALA MB 1 36 ASN HB2 . . 4.230 3.965 3.194 4.375 0.145 21 0 "[ . 1 . 2 . 3 . ]" 1 1958 1 20 ALA MB 1 36 ASN HB3 . . 3.910 3.216 2.660 3.973 0.063 20 0 "[ . 1 . 2 . 3 . ]" 1 1959 1 19 PRO HG3 1 20 ALA MB . . 5.500 5.227 4.941 5.512 0.012 16 0 "[ . 1 . 2 . 3 . ]" 1 1960 1 21 SER HA 1 25 MET ME . . 4.690 3.849 3.271 4.442 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1961 1 22 VAL HA 1 145 VAL MG1 . . 5.020 1.868 1.802 1.950 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1962 1 23 GLN HA 1 23 GLN HG2 . . 4.260 3.546 2.708 4.131 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1963 1 23 GLN HG3 1 24 GLY HA2 . . 5.500 4.325 3.057 5.598 0.098 35 0 "[ . 1 . 2 . 3 . ]" 1 1964 1 23 GLN HA 1 24 GLY HA2 . . 5.480 4.906 4.797 4.982 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1965 1 19 PRO HB3 1 24 GLY HA3 . . 5.500 4.637 4.153 5.231 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1966 1 25 MET HB3 1 33 ALA MB . . 4.280 3.371 3.163 3.574 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1967 1 25 MET HB2 1 33 ALA MB . . 4.120 1.890 1.783 2.094 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1968 1 28 ASP HB2 1 32 VAL MG2 . . 5.050 4.971 4.648 5.117 0.067 36 0 "[ . 1 . 2 . 3 . ]" 1 1969 1 29 PRO HA 1 30 VAL HA . . 5.500 4.311 4.201 4.381 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1970 1 30 VAL HA 1 68 VAL MG2 . . 3.620 3.552 3.201 3.786 0.166 36 0 "[ . 1 . 2 . 3 . ]" 1 1971 1 30 VAL HB 1 33 ALA MB . . 5.500 4.531 3.783 4.989 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1972 1 30 VAL HB 1 68 VAL MG2 . . 4.630 3.582 2.459 3.860 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1973 1 30 VAL QG 1 62 ASN HA . . 4.270 2.198 1.911 2.874 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1974 1 30 VAL QG 1 31 ALA HA . . 3.840 2.878 2.723 2.991 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1975 1 31 ALA MB 1 32 VAL HA . . 4.350 3.631 3.540 3.721 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1976 1 32 VAL HA 1 34 ALA MB . . 5.500 4.952 4.535 5.316 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1977 1 29 PRO HD2 1 32 VAL HB . . 3.830 1.871 1.697 2.120 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1978 1 28 ASP HA 1 32 VAL HB . . 4.520 3.919 3.443 4.488 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1979 1 29 PRO HD2 1 32 VAL MG1 . . 3.800 2.578 1.942 3.563 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1980 1 101 HIS HB2 1 102 VAL QG . . 3.280 3.326 2.918 3.503 0.223 37 0 "[ . 1 . 2 . 3 . ]" 1 1981 1 28 ASP HB3 1 32 VAL MG1 . . 3.590 2.338 1.846 3.216 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1982 1 28 ASP HB2 1 32 VAL MG1 . . 4.100 3.272 2.923 3.853 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1983 1 28 ASP HA 1 32 VAL MG1 . . 4.770 3.601 2.732 4.779 0.009 15 0 "[ . 1 . 2 . 3 . ]" 1 1984 1 101 HIS HB3 1 102 VAL QG . . 4.880 3.670 3.073 3.988 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1985 1 99 THR HA 1 102 VAL QG . . 3.590 2.284 1.851 3.017 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1986 1 28 ASP HB3 1 33 ALA MB . . 3.350 3.287 2.824 3.664 0.314 15 0 "[ . 1 . 2 . 3 . ]" 1 1987 1 28 ASP HB2 1 33 ALA MB . . 3.640 2.787 2.150 3.689 0.049 8 0 "[ . 1 . 2 . 3 . ]" 1 1988 1 28 ASP HA 1 33 ALA MB . . 5.060 4.821 4.260 5.121 0.061 38 0 "[ . 1 . 2 . 3 . ]" 1 1989 1 34 ALA HA 1 40 LEU QD . . 3.540 2.225 1.879 3.097 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1990 1 34 ALA HA 1 40 LEU HB3 . . 4.410 3.470 2.839 4.345 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1991 1 34 ALA HA 1 40 LEU HB2 . . 5.230 2.685 2.065 3.687 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1992 1 34 ALA MB 1 44 THR HA . . 4.350 3.895 3.406 4.389 0.039 30 0 "[ . 1 . 2 . 3 . ]" 1 1993 1 34 ALA MB 1 40 LEU HA . . 5.150 4.201 3.751 4.786 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1994 1 33 ALA HA 1 34 ALA MB . . 5.170 5.005 4.901 5.038 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1995 1 34 ALA MB 1 44 THR HB . . 5.500 3.982 3.019 4.931 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1996 1 32 VAL HA 1 35 SER HA . . 5.070 4.702 4.195 5.123 0.053 18 0 "[ . 1 . 2 . 3 . ]" 1 1997 1 20 ALA HA 1 37 ASN HB3 . . 5.310 5.313 4.719 5.943 0.633 36 1 "[ . 1 . 2 . 3 .+ ]" 1 1998 1 37 ASN HB2 1 38 PRO HD3 . . 5.500 4.687 4.369 4.816 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1999 1 37 ASN HB3 1 40 LEU HG . . 5.500 1.927 1.799 2.226 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2000 1 37 ASN HA 1 38 PRO QG . . 4.260 3.881 3.866 3.908 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2001 1 39 GLU QB 1 72 THR HA . . 4.090 2.642 2.282 3.037 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2002 1 39 GLU HG3 1 72 THR HB . . 5.080 4.831 4.351 5.102 0.022 13 0 "[ . 1 . 2 . 3 . ]" 1 2003 1 38 PRO QG 1 39 GLU HG2 . . 5.060 3.183 2.972 3.340 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2004 1 39 GLU HG2 1 72 THR MG . . 5.500 4.995 4.683 5.287 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2005 1 40 LEU HA 1 40 LEU QD . . 3.010 2.123 1.950 2.531 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2006 1 40 LEU QD 1 154 MET QG . . 3.200 1.892 1.589 2.137 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2007 1 40 LEU QD 1 72 THR HA . . 3.080 2.624 1.839 3.131 0.051 28 0 "[ . 1 . 2 . 3 . ]" 1 2008 1 40 LEU HB3 1 40 LEU QD . . 2.830 2.082 1.921 2.161 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2009 1 40 LEU QD 1 43 LEU QD . . 2.400 2.130 1.885 2.436 0.036 33 0 "[ . 1 . 2 . 3 . ]" 1 2010 1 39 GLU QB 1 40 LEU QD . . 3.650 2.446 1.690 2.982 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2011 1 37 ASN HB2 1 40 LEU QD . . 3.840 2.411 1.888 3.022 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2012 1 37 ASN HB3 1 40 LEU QD . . 4.060 2.484 1.867 2.982 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2013 1 37 ASN HA 1 40 LEU QD . . 5.500 4.381 3.972 4.733 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2014 1 41 THR HB 1 42 THR HA . . 4.700 4.319 3.985 4.670 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2015 1 43 LEU HA 1 45 ALA MB . . 5.500 4.724 4.586 4.978 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2016 1 40 LEU QD 1 43 LEU HB3 . . 4.210 3.464 3.230 3.736 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2017 1 43 LEU HG 1 47 LEU QD . . 3.450 1.739 1.698 1.850 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2018 1 43 LEU HG 1 44 THR HA . . 4.940 2.903 2.814 3.085 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2019 1 43 LEU QD 1 70 ALA HA . . 3.500 2.411 2.100 2.726 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2020 1 40 LEU HB2 1 43 LEU QD . . 3.120 3.081 2.516 3.212 0.092 12 0 "[ . 1 . 2 . 3 . ]" 1 2021 1 43 LEU HB3 1 43 LEU QD . . 3.140 2.068 1.934 2.136 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2022 1 43 LEU HB2 1 43 LEU QD . . 3.060 1.955 1.901 2.125 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2023 1 40 LEU HA 1 43 LEU QD . . 4.800 2.626 2.056 3.590 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2024 1 99 THR HB 1 119 LEU QD . . 4.240 2.361 1.737 4.037 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2025 1 99 THR HB 1 120 GLN HB3 . . 5.320 3.738 3.344 4.653 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2026 1 99 THR HB 1 120 GLN HB2 . . 5.160 2.320 1.853 3.279 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2027 1 45 ALA HA 1 50 GLN HG2 . . 3.940 3.737 3.436 3.967 0.027 28 0 "[ . 1 . 2 . 3 . ]" 1 2028 1 45 ALA MB 1 51 LEU HA . . 3.500 3.588 3.540 3.662 0.162 37 0 "[ . 1 . 2 . 3 . ]" 1 2029 1 46 ALA HA 1 51 LEU QB . . 3.540 1.941 1.837 2.047 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2030 1 46 ALA HA 1 51 LEU QD . . 3.810 2.897 1.788 3.202 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2031 1 46 ALA MB 1 47 LEU HA . . 4.930 3.711 3.664 3.766 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2032 1 47 LEU HA 1 48 SER HA . . 4.830 4.843 4.814 4.889 0.059 37 0 "[ . 1 . 2 . 3 . ]" 1 2033 1 44 THR HA 1 47 LEU HB3 . . 4.210 4.492 4.445 4.546 0.336 37 0 "[ . 1 . 2 . 3 . ]" 1 2034 1 47 LEU QD 1 98 LEU HA . . 4.460 3.694 3.221 4.379 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2035 1 44 THR HA 1 47 LEU QD . . 3.310 1.825 1.752 1.904 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2036 1 47 LEU QD 1 48 SER QB . . 3.700 2.921 2.567 3.213 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2037 1 47 LEU QD 1 48 SER HA . . 4.170 3.406 3.069 3.680 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2038 1 44 THR HB 1 47 LEU QD . . 4.700 3.691 2.855 3.889 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2039 1 47 LEU QD 1 57 LEU HB3 . . 3.990 3.885 3.557 4.891 0.901 31 6 "[ . *1 *. * .- 3+ .* ]" 1 2040 1 47 LEU QD 1 58 VAL QG . . 3.380 2.791 1.724 3.345 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2041 1 44 THR MG 1 47 LEU QD . . 3.180 2.342 1.748 3.143 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2042 1 47 LEU QD 1 61 LEU HB2 . . 5.280 3.862 3.618 4.294 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2043 1 146 SER HB3 1 151 THR MG . . 4.720 4.322 3.781 4.747 0.027 3 0 "[ . 1 . 2 . 3 . ]" 1 2044 1 49 GLY HA2 1 56 ASN QB . . 4.790 4.751 4.443 4.910 0.120 17 0 "[ . 1 . 2 . 3 . ]" 1 2045 1 49 GLY HA3 1 56 ASN QB . . 5.020 4.227 3.637 4.579 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2046 1 51 LEU QB 1 88 LYS HA . . 5.110 3.912 3.525 4.522 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2047 1 51 LEU QB 1 88 LYS QG . . 3.340 3.067 2.668 3.275 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2048 1 46 ALA MB 1 51 LEU QB . . 4.490 2.943 2.712 3.337 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2049 1 51 LEU HG 1 88 LYS HA . . 4.240 3.946 1.989 4.324 0.084 19 0 "[ . 1 . 2 . 3 . ]" 1 2050 1 46 ALA HA 1 51 LEU HG . . 4.690 4.606 4.025 4.756 0.066 36 0 "[ . 1 . 2 . 3 . ]" 1 2051 1 51 LEU QD 1 88 LYS HE2 . . 3.780 2.743 1.863 3.861 0.081 6 0 "[ . 1 . 2 . 3 . ]" 1 2052 1 52 ASN HA 1 55 VAL QG . . 5.500 4.287 3.350 5.147 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2053 1 51 LEU QD 1 52 ASN HA . . 5.500 4.715 3.565 5.120 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2054 1 52 ASN QB 1 53 PRO HD2 . . 5.500 3.567 2.978 3.833 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2055 1 52 ASN QB 1 53 PRO HD3 . . 5.040 4.020 3.639 4.166 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2056 1 54 GLN HB2 1 91 SER QB . . 3.820 2.566 1.812 3.176 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2057 1 54 GLN HB3 1 55 VAL QG . . 4.940 3.770 3.249 4.591 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2058 1 54 GLN HB2 1 55 VAL QG . . 4.080 3.556 2.795 4.126 0.046 19 0 "[ . 1 . 2 . 3 . ]" 1 2059 1 106 GLN QG 1 150 ALA MB . . 4.410 3.607 3.394 4.053 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2060 1 55 VAL HB 1 94 LEU MD1 . . 5.500 4.757 4.054 5.579 0.079 32 0 "[ . 1 . 2 . 3 . ]" 1 2061 1 55 VAL QG 1 95 THR HB . . 4.030 3.479 2.353 4.045 0.015 21 0 "[ . 1 . 2 . 3 . ]" 1 2062 1 56 ASN HA 1 57 LEU QD . . 5.270 3.929 2.854 4.630 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2063 1 56 ASN HA 1 58 VAL QG . . 4.170 3.670 2.914 4.230 0.060 2 0 "[ . 1 . 2 . 3 . ]" 1 2064 1 57 LEU HA 1 60 THR MG . . 5.030 3.897 3.443 4.224 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2065 1 57 LEU HB3 1 61 LEU HA . . 5.500 4.914 4.378 5.438 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2066 1 57 LEU HB2 1 58 VAL HA . . 5.500 4.597 3.968 4.985 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2067 1 47 LEU HB3 1 57 LEU HB3 . . 4.380 3.698 2.962 4.428 0.048 31 0 "[ . 1 . 2 . 3 . ]" 1 2068 1 47 LEU HB3 1 57 LEU HB2 . . 5.500 2.545 2.030 3.231 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2069 1 47 LEU HB2 1 57 LEU HB2 . . 5.420 2.137 1.805 2.735 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2070 1 57 LEU HB2 1 61 LEU HG . . 5.500 3.849 2.409 5.421 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2071 1 57 LEU HB2 1 60 THR MG . . 5.500 5.384 4.737 5.579 0.079 19 0 "[ . 1 . 2 . 3 . ]" 1 2072 1 103 VAL MG1 1 116 ARG QG . . 4.430 2.900 1.825 4.216 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2073 1 57 LEU HB3 1 58 VAL HA . . 5.480 4.538 4.112 5.351 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2074 1 57 LEU HA 1 58 VAL HA . . 5.430 4.949 4.678 5.094 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2075 1 58 VAL HA 1 61 LEU HG . . 5.450 3.872 2.679 5.496 0.046 19 0 "[ . 1 . 2 . 3 . ]" 1 2076 1 58 VAL QG 1 59 ASP HA . . 3.540 2.988 2.690 3.508 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2077 1 58 VAL QG 1 62 ASN QB . . 4.130 3.524 2.684 4.079 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2078 1 59 ASP QB 1 60 THR HA . . 3.930 3.734 3.566 3.987 0.057 37 0 "[ . 1 . 2 . 3 . ]" 1 2079 1 59 ASP QB 1 62 ASN QB . . 5.030 4.729 4.227 5.167 0.137 6 0 "[ . 1 . 2 . 3 . ]" 1 2080 1 57 LEU QD 1 60 THR HB . . 3.940 2.915 1.920 3.970 0.030 11 0 "[ . 1 . 2 . 3 . ]" 1 2081 1 60 THR HB 1 61 LEU HB2 . . 4.870 4.758 4.275 5.024 0.154 6 0 "[ . 1 . 2 . 3 . ]" 1 2082 1 57 LEU HB2 1 60 THR HB . . 4.770 4.642 3.742 4.889 0.119 18 0 "[ . 1 . 2 . 3 . ]" 1 2083 1 60 THR HA 1 60 THR MG . . 3.370 2.463 2.287 2.612 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2084 1 61 LEU HA 1 102 VAL QG . . 3.650 3.378 3.010 3.659 0.009 17 0 "[ . 1 . 2 . 3 . ]" 1 2085 1 30 VAL QG 1 61 LEU HA . . 4.250 3.188 2.898 3.521 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2086 1 60 THR MG 1 61 LEU HA . . 4.100 3.534 3.135 4.108 0.008 24 0 "[ . 1 . 2 . 3 . ]" 1 2087 1 61 LEU HA 1 62 ASN HA . . 5.500 4.612 4.554 4.655 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2088 1 61 LEU HB3 1 62 ASN HA . . 5.500 4.378 4.163 4.577 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2089 1 30 VAL QG 1 61 LEU HB2 . . 3.970 2.862 2.344 3.317 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2090 1 61 LEU HB2 1 62 ASN HA . . 5.500 4.589 4.335 4.825 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2091 1 30 VAL QG 1 61 LEU HB3 . . 3.170 1.864 1.736 2.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2092 1 31 ALA MB 1 61 LEU HB3 . . 3.870 3.029 2.228 3.942 0.072 16 0 "[ . 1 . 2 . 3 . ]" 1 2093 1 31 ALA MB 1 61 LEU HB2 . . 4.630 2.423 1.855 3.414 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2094 1 60 THR HB 1 61 LEU HG . . 5.500 4.462 3.372 5.637 0.137 19 0 "[ . 1 . 2 . 3 . ]" 1 2095 1 47 LEU QD 1 61 LEU QD . . 2.680 2.085 1.694 2.656 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2096 1 47 LEU HA 1 61 LEU QD . . 5.500 4.579 3.860 5.329 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2097 1 31 ALA HA 1 61 LEU QD . . 3.820 2.992 2.065 3.683 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2098 1 30 VAL QG 1 61 LEU QD . . 4.100 2.710 2.177 3.319 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2099 1 57 LEU HA 1 61 LEU QD . . 4.660 3.849 2.992 4.426 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2100 1 47 LEU HB3 1 61 LEU QD . . 4.920 3.046 2.277 3.599 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2101 1 60 THR MG 1 61 LEU QD . . 3.710 2.847 2.459 3.630 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2102 1 61 LEU QD 1 66 TYR HB2 . . 5.080 4.390 3.278 5.068 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2103 1 57 LEU QD 1 61 LEU QD . . 3.850 2.572 1.683 3.305 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2104 1 61 LEU QD 1 66 TYR HB3 . . 5.210 3.939 2.845 4.787 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2105 1 62 ASN QB 1 63 SER QB . . 5.500 4.661 3.773 5.494 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2106 1 65 GLN HG2 1 149 ASN HA . . 5.020 4.492 3.933 5.042 0.022 9 0 "[ . 1 . 2 . 3 . ]" 1 2107 1 65 GLN HG3 1 149 ASN HA . . 5.360 4.037 3.430 4.638 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2108 1 65 GLN HG3 1 149 ASN HB2 . . 4.380 3.162 2.768 3.659 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2109 1 65 GLN HG2 1 149 ASN HB2 . . 5.270 4.489 3.977 5.257 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2110 1 67 THR HA 1 68 VAL MG2 . . 4.600 3.718 3.579 3.915 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2111 1 66 TYR HB3 1 67 THR HA . . 5.500 4.099 3.941 4.280 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2112 1 67 THR HA 1 150 ALA HA . . 5.500 3.749 3.567 3.963 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2113 1 67 THR HA 1 151 THR MG . . 5.500 4.019 3.844 4.130 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2114 1 67 THR HB 1 103 VAL MG2 . . 3.730 3.514 3.303 3.673 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2115 1 67 THR MG 1 106 GLN QG . . 3.500 3.526 3.061 3.638 0.138 28 0 "[ . 1 . 2 . 3 . ]" 1 2116 1 67 THR MG 1 69 PHE HA . . 4.570 4.690 4.390 4.784 0.214 5 0 "[ . 1 . 2 . 3 . ]" 1 2117 1 67 THR MG 1 151 THR HB . . 3.880 1.769 1.730 1.902 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2118 1 68 VAL HA 1 69 PHE HB2 . . 4.760 4.055 4.002 4.114 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2119 1 68 VAL HA 1 102 VAL QG . . 4.850 3.017 2.200 3.422 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2120 1 68 VAL HB 1 152 VAL HA . . 4.130 1.919 1.866 2.046 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2121 1 68 VAL HB 1 152 VAL QG . . 4.120 2.019 1.803 2.211 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2122 1 68 VAL HB 1 102 VAL QG . . 5.500 5.003 4.243 5.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2123 1 68 VAL MG1 1 102 VAL HB . . 5.500 4.133 3.341 5.563 0.063 20 0 "[ . 1 . 2 . 3 . ]" 1 2124 1 68 VAL MG1 1 70 ALA MB . . 2.430 1.790 1.696 1.925 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2125 1 68 VAL MG1 1 152 VAL HA . . 4.070 3.354 2.930 3.634 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2126 1 68 VAL MG1 1 101 HIS HB2 . . 5.500 5.001 4.419 5.494 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2127 1 70 ALA HA 1 101 HIS HB3 . . 5.500 2.917 2.514 3.168 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2128 1 70 ALA HA 1 155 ILE MD . . 5.500 3.366 2.702 3.912 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2129 1 70 ALA MB 1 154 MET QG . . 2.850 2.744 2.445 2.953 0.103 33 0 "[ . 1 . 2 . 3 . ]" 1 2130 1 70 ALA MB 1 154 MET HA . . 3.680 2.806 2.690 2.963 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2131 1 69 PHE HA 1 70 ALA MB . . 3.950 3.930 3.776 4.096 0.146 38 0 "[ . 1 . 2 . 3 . ]" 1 2132 1 40 LEU QD 1 70 ALA MB . . 2.400 1.692 1.606 1.826 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2133 1 70 ALA MB 1 71 PRO HD2 . . 3.530 2.926 2.805 3.068 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2134 1 40 LEU HA 1 70 ALA MB . . 3.980 3.907 3.520 4.277 0.297 11 0 "[ . 1 . 2 . 3 . ]" 1 2135 1 71 PRO HA 1 155 ILE MD . . 3.220 2.529 1.678 3.340 0.120 33 0 "[ . 1 . 2 . 3 . ]" 1 2136 1 70 ALA MB 1 71 PRO HA . . 4.350 4.429 4.397 4.455 0.105 23 0 "[ . 1 . 2 . 3 . ]" 1 2137 1 71 PRO HB3 1 157 SER HA . . 5.500 4.501 3.941 4.904 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2138 1 70 ALA HA 1 71 PRO HB2 . . 5.500 5.456 5.445 5.472 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2139 1 71 PRO HB3 1 75 ALA MB . . 4.250 2.514 2.169 2.901 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2140 1 71 PRO HB2 1 75 ALA MB . . 3.620 2.092 1.880 2.358 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2141 1 43 LEU QD 1 71 PRO HB3 . . 4.730 4.791 4.601 4.880 0.150 9 0 "[ . 1 . 2 . 3 . ]" 1 2142 1 71 PRO HB3 1 97 ILE MG . . 5.300 5.053 4.782 5.394 0.094 17 0 "[ . 1 . 2 . 3 . ]" 1 2143 1 71 PRO HB3 1 158 VAL QG . . 3.800 2.794 2.271 3.010 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2144 1 71 PRO HB2 1 158 VAL QG . . 4.060 2.420 1.954 2.767 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2145 1 43 LEU QD 1 71 PRO HD2 . . 3.590 1.809 1.750 1.978 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2146 1 70 ALA MB 1 71 PRO HD3 . . 4.240 3.493 3.425 3.573 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2147 1 107 THR HA 1 111 ASN HB2 . . 5.250 4.641 4.127 5.266 0.016 27 0 "[ . 1 . 2 . 3 . ]" 1 2148 1 72 THR HA 1 154 MET HB3 . . 4.290 4.432 4.359 4.528 0.238 10 0 "[ . 1 . 2 . 3 . ]" 1 2149 1 75 ALA HA 1 158 VAL QG . . 5.070 3.693 3.157 4.185 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2150 1 75 ALA HA 1 156 ASP HA . . 3.960 3.566 3.014 3.970 0.010 35 0 "[ . 1 . 2 . 3 . ]" 1 2151 1 75 ALA MB 1 157 SER HA . . 3.400 2.415 2.115 2.989 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2152 1 75 ALA MB 1 76 PHE HB2 . . 4.290 4.169 3.956 4.313 0.023 18 0 "[ . 1 . 2 . 3 . ]" 1 2153 1 77 SER HA 1 84 ILE MD . . 4.870 4.657 4.142 4.940 0.070 3 0 "[ . 1 . 2 . 3 . ]" 1 2154 1 117 GLN HA 1 118 THR MG . . 5.440 3.558 3.237 4.189 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2155 1 103 VAL MG1 1 117 GLN HA . . 5.500 4.530 3.882 5.112 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2156 1 78 LYS QE 1 157 SER HA . . 3.870 2.833 1.985 3.650 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2157 1 79 LEU HA 1 80 PRO HB2 . . 5.500 5.555 5.515 5.638 0.138 3 0 "[ . 1 . 2 . 3 . ]" 1 2158 1 79 LEU HA 1 80 PRO HG2 . . 4.870 4.612 4.539 4.755 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2159 1 79 LEU HB2 1 80 PRO HD2 . . 5.500 3.635 3.282 3.859 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2160 1 79 LEU HB3 1 83 THR HB . . 4.380 2.769 2.357 3.086 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2161 1 79 LEU HB2 1 80 PRO HD3 . . 4.840 4.327 4.097 4.465 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2162 1 76 PHE HA 1 79 LEU HB2 . . 5.500 3.751 3.263 4.237 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2163 1 76 PHE HA 1 79 LEU HG . . 4.040 3.187 2.220 4.178 0.138 12 0 "[ . 1 . 2 . 3 . ]" 1 2164 1 79 LEU HG 1 158 VAL QG . . 4.770 2.433 1.990 3.081 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2165 1 79 LEU QD 1 158 VAL QG . . 3.790 1.794 1.591 2.219 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2166 1 79 LEU QD 1 83 THR HB . . 4.710 3.688 2.419 4.649 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2167 1 80 PRO HD3 1 83 THR HB . . 3.960 3.774 3.446 3.979 0.019 4 0 "[ . 1 . 2 . 3 . ]" 1 2168 1 79 LEU QD 1 80 PRO HD2 . . 4.290 3.044 2.063 3.659 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2169 1 83 THR HA 1 84 ILE MD . . 5.500 5.144 4.883 5.265 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2170 1 80 PRO HG2 1 83 THR HB . . 4.200 2.834 2.437 3.150 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2171 1 79 LEU HB2 1 83 THR HB . . 4.470 3.883 3.277 4.460 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2172 1 80 PRO HB2 1 83 THR HB . . 5.020 4.034 3.722 4.426 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2173 1 80 PRO HD2 1 83 THR HB . . 4.620 2.075 1.853 2.275 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2174 1 83 THR HB 1 87 LEU MD1 . . 5.500 5.335 5.043 5.524 0.024 20 0 "[ . 1 . 2 . 3 . ]" 1 2175 1 79 LEU HB2 1 83 THR MG . . 3.000 2.840 2.421 3.981 0.981 3 2 "[ + .- 1 . 2 . 3 . ]" 1 2176 1 80 PRO HD3 1 83 THR MG . . 4.940 4.262 3.985 4.536 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2177 1 83 THR MG 1 84 ILE HA . . 4.160 3.129 2.999 3.194 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2178 1 84 ILE HA 1 87 LEU MD2 . . 4.030 3.862 3.635 4.056 0.026 33 0 "[ . 1 . 2 . 3 . ]" 1 2179 1 84 ILE HA 1 85 ASP HA . . 5.500 4.792 4.731 4.854 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2180 1 83 THR HB 1 84 ILE HA . . 5.500 4.868 4.818 4.927 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2181 1 81 ALA MB 1 84 ILE HB . . 4.220 3.846 3.746 4.245 0.025 6 0 "[ . 1 . 2 . 3 . ]" 1 2182 1 84 ILE MG 1 88 LYS HE2 . . 3.860 2.384 1.832 3.855 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2183 1 84 ILE MG 1 85 ASP HA . . 3.660 3.558 3.373 3.678 0.018 25 0 "[ . 1 . 2 . 3 . ]" 1 2184 1 81 ALA HA 1 84 ILE MG . . 4.590 4.012 3.879 4.372 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2185 1 81 ALA HA 1 84 ILE HG13 . . 4.900 3.308 2.913 3.481 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2186 1 83 THR HB 1 84 ILE HG13 . . 5.500 5.299 5.255 5.446 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2187 1 79 LEU HB2 1 84 ILE HG13 . . 4.720 3.951 3.077 4.340 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2188 1 83 THR MG 1 84 ILE HG13 . . 4.180 4.293 4.248 4.392 0.212 3 0 "[ . 1 . 2 . 3 . ]" 1 2189 1 83 THR MG 1 84 ILE HG12 . . 4.280 2.935 2.859 3.086 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2190 1 103 VAL MG2 1 116 ARG QG . . 4.880 3.257 1.727 4.330 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2191 1 116 ARG QG 1 126 VAL MG2 . . 4.390 3.175 2.167 4.408 0.018 23 0 "[ . 1 . 2 . 3 . ]" 1 2192 1 83 THR MG 1 84 ILE MD . . 3.210 2.236 1.950 2.377 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2193 1 79 LEU HG 1 84 ILE MD . . 4.430 3.901 2.216 4.433 0.003 17 0 "[ . 1 . 2 . 3 . ]" 1 2194 1 81 ALA HA 1 84 ILE MD . . 4.530 4.527 4.289 4.599 0.069 4 0 "[ . 1 . 2 . 3 . ]" 1 2195 1 79 LEU HB2 1 84 ILE MD . . 4.700 2.516 2.170 2.869 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2196 1 84 ILE MD 1 88 LYS HE3 . . 5.500 5.216 4.546 6.262 0.762 6 3 "[ .+ 1 . *2 -. 3 . ]" 1 2197 1 87 LEU HA 1 94 LEU HB3 . . 3.410 2.869 2.453 3.430 0.020 20 0 "[ . 1 . 2 . 3 . ]" 1 2198 1 87 LEU HA 1 94 LEU MD1 . . 4.490 3.727 3.166 4.170 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2199 1 87 LEU HA 1 93 LEU QD . . 5.250 4.076 3.536 4.546 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2200 1 87 LEU HA 1 93 LEU HG . . 5.020 4.430 3.643 5.038 0.018 12 0 "[ . 1 . 2 . 3 . ]" 1 2201 1 87 LEU HB2 1 88 LYS HA . . 5.500 4.378 4.110 4.518 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2202 1 87 LEU HB3 1 88 LYS HA . . 5.500 4.825 4.641 5.045 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2203 1 82 SER HA 1 85 ASP HB3 . . 4.540 3.383 2.556 4.193 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2204 1 83 THR HA 1 86 GLU HB3 . . 3.510 2.902 2.429 3.263 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2205 1 83 THR MG 1 86 GLU HB2 . . 5.010 4.683 4.424 4.972 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2206 1 86 GLU HB3 1 93 LEU QD . . 4.660 3.547 3.260 3.735 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2207 1 83 THR MG 1 86 GLU HB3 . . 5.500 3.874 3.705 4.078 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2208 1 86 GLU HB2 1 93 LEU QD . . 4.630 4.637 4.525 4.699 0.069 28 0 "[ . 1 . 2 . 3 . ]" 1 2209 1 86 GLU HB2 1 87 LEU MD2 . . 5.500 3.915 3.636 4.278 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2210 1 86 GLU QG 1 90 ASN HA . . 5.500 4.402 3.870 5.027 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2211 1 86 GLU QG 1 87 LEU MD2 . . 5.500 3.285 2.854 3.723 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2212 1 83 THR HA 1 86 GLU QG . . 4.300 4.201 3.917 4.333 0.033 6 0 "[ . 1 . 2 . 3 . ]" 1 2213 1 84 ILE MD 1 87 LEU HB3 . . 5.290 4.737 4.279 4.843 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2214 1 84 ILE MD 1 87 LEU HB2 . . 3.810 3.733 3.191 3.899 0.089 4 0 "[ . 1 . 2 . 3 . ]" 1 2215 1 87 LEU HB3 1 94 LEU MD2 . . 3.830 3.145 2.670 3.580 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2216 1 83 THR MG 1 87 LEU HB2 . . 4.720 4.665 4.256 4.790 0.070 20 0 "[ . 1 . 2 . 3 . ]" 1 2217 1 84 ILE HA 1 87 LEU MD1 . . 3.190 3.036 2.333 3.222 0.032 2 0 "[ . 1 . 2 . 3 . ]" 1 2218 1 87 LEU MD1 1 94 LEU MD1 . . 2.400 2.342 1.879 2.446 0.046 19 0 "[ . 1 . 2 . 3 . ]" 1 2219 1 88 LYS HA 1 94 LEU MD2 . . 4.150 3.980 3.274 4.201 0.051 37 0 "[ . 1 . 2 . 3 . ]" 1 2220 1 51 LEU QD 1 88 LYS HA . . 3.980 3.334 2.387 4.016 0.036 4 0 "[ . 1 . 2 . 3 . ]" 1 2221 1 88 LYS HA 1 89 THR MG . . 5.500 4.777 4.041 5.462 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2222 1 85 ASP HA 1 88 LYS QB . . 4.510 2.937 2.587 3.310 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2223 1 88 LYS QB 1 89 THR MG . . 4.530 3.856 2.652 4.657 0.127 28 0 "[ . 1 . 2 . 3 . ]" 1 2224 1 51 LEU HA 1 88 LYS QG . . 4.550 3.090 2.438 3.694 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2225 1 85 ASP HA 1 88 LYS QG . . 4.150 3.593 3.111 4.028 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2226 1 51 LEU QD 1 88 LYS QG . . 3.610 1.999 1.667 2.423 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2227 1 85 ASP HA 1 88 LYS QD . . 3.900 3.227 1.697 3.912 0.012 37 0 "[ . 1 . 2 . 3 . ]" 1 2228 1 85 ASP HA 1 88 LYS HE2 . . 4.520 3.986 1.919 4.535 0.015 15 0 "[ . 1 . 2 . 3 . ]" 1 2229 1 85 ASP HA 1 88 LYS HE3 . . 4.650 2.882 1.986 4.670 0.020 25 0 "[ . 1 . 2 . 3 . ]" 1 2230 1 88 LYS QB 1 88 LYS HE3 . . 3.730 3.370 2.663 4.208 0.478 4 0 "[ . 1 . 2 . 3 . ]" 1 2231 1 51 LEU QD 1 88 LYS HE3 . . 3.940 3.494 2.155 3.901 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2232 1 84 ILE MG 1 88 LYS HE3 . . 4.220 2.406 1.893 3.520 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2233 1 88 LYS QB 1 88 LYS HE2 . . 4.060 3.807 2.991 4.120 0.060 26 0 "[ . 1 . 2 . 3 . ]" 1 2234 1 84 ILE MG 1 88 LYS QB . . 5.500 4.349 4.058 4.757 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2235 1 87 LEU HB3 1 90 ASN HB2 . . 5.500 4.339 3.856 4.696 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2236 1 55 VAL HA 1 91 SER HA . . 5.500 4.827 4.441 5.271 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2237 1 55 VAL HB 1 91 SER HA . . 4.220 3.914 2.495 4.277 0.057 21 0 "[ . 1 . 2 . 3 . ]" 1 2238 1 91 SER HA 1 94 LEU MD1 . . 5.500 4.883 4.564 5.520 0.020 18 0 "[ . 1 . 2 . 3 . ]" 1 2239 1 87 LEU MD2 1 94 LEU HA . . 3.460 2.987 2.700 3.370 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2240 1 93 LEU QD 1 94 LEU HA . . 4.380 3.384 3.010 3.896 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2241 1 94 LEU HA 1 98 LEU HG . . 5.500 4.375 4.072 4.565 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2242 1 87 LEU HB3 1 94 LEU HA . . 4.250 4.112 3.757 4.276 0.026 10 0 "[ . 1 . 2 . 3 . ]" 1 2243 1 93 LEU HG 1 94 LEU HA . . 4.320 3.223 2.986 3.454 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2244 1 94 LEU HA 1 98 LEU MD2 . . 5.500 3.593 3.404 3.825 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2245 1 87 LEU HA 1 94 LEU HB2 . . 5.250 2.793 2.394 3.106 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2246 1 91 SER HA 1 94 LEU HB2 . . 5.500 5.389 4.917 5.542 0.042 32 0 "[ . 1 . 2 . 3 . ]" 1 2247 1 87 LEU MD1 1 94 LEU HB3 . . 4.070 4.069 3.871 4.163 0.093 30 0 "[ . 1 . 2 . 3 . ]" 1 2248 1 87 LEU MD2 1 94 LEU HB2 . . 4.340 2.255 1.974 2.647 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2249 1 87 LEU MD1 1 94 LEU HB2 . . 4.290 2.531 2.344 2.650 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2250 1 87 LEU MD2 1 94 LEU HB3 . . 4.900 3.035 2.616 3.700 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2251 1 55 VAL QG 1 94 LEU HG . . 3.410 2.975 2.380 3.399 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2252 1 94 LEU HG 1 95 THR HA . . 5.500 2.875 2.778 3.105 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2253 1 55 VAL QG 1 94 LEU MD2 . . 2.910 1.794 1.580 2.071 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2254 1 91 SER QB 1 94 LEU MD2 . . 5.210 3.600 3.286 4.089 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2255 1 94 LEU MD2 1 95 THR HB . . 5.300 4.230 3.031 5.282 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2256 1 94 LEU MD2 1 95 THR HA . . 5.480 3.882 3.125 4.330 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2257 1 94 LEU MD2 1 98 LEU MD2 . . 4.500 3.782 3.303 4.010 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2258 1 54 GLN HB3 1 94 LEU MD2 . . 5.500 5.479 5.137 6.481 0.981 20 1 "[ . 1 . + . 3 . ]" 1 2259 1 94 LEU MD2 1 98 LEU MD1 . . 4.230 2.758 2.158 3.143 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2260 1 94 LEU HA 1 95 THR HA . . 4.560 4.864 4.812 4.924 0.364 19 0 "[ . 1 . 2 . 3 . ]" 1 2261 1 55 VAL QG 1 95 THR HA . . 3.890 3.279 2.658 3.860 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2262 1 95 THR HA 1 98 LEU HB2 . . 4.360 3.156 2.888 3.422 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2263 1 95 THR HA 1 99 THR MG . . 4.280 3.680 3.305 4.070 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2264 1 94 LEU MD1 1 95 THR HA . . 4.280 3.948 3.525 4.323 0.043 18 0 "[ . 1 . 2 . 3 . ]" 1 2265 1 95 THR HA 1 95 THR MG . . 3.570 2.745 2.235 3.224 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2266 1 157 SER HB3 1 158 VAL QG . . 5.500 4.542 3.916 4.897 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2267 1 97 ILE HB 1 98 LEU MD2 . . 5.500 2.927 2.623 3.425 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2268 1 96 SER HB2 1 97 ILE HB . . 5.410 4.970 4.239 5.864 0.454 11 0 "[ . 1 . 2 . 3 . ]" 1 2269 1 87 LEU MD2 1 97 ILE HB . . 5.500 4.825 4.440 5.276 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2270 1 97 ILE QG 1 160 MET HB3 . . 4.410 2.846 2.577 3.049 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2271 1 138 ALA MB 1 155 ILE QG . . 3.960 2.820 2.229 3.199 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2272 1 97 ILE MG 1 98 LEU HA . . 4.310 2.790 2.713 2.960 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2273 1 98 LEU HA 1 99 THR MG . . 5.500 5.101 4.832 5.359 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2274 1 95 THR HA 1 98 LEU HB3 . . 4.500 4.418 4.187 4.567 0.067 31 0 "[ . 1 . 2 . 3 . ]" 1 2275 1 57 LEU QD 1 98 LEU HB3 . . 2.920 2.796 2.100 3.017 0.097 21 0 "[ . 1 . 2 . 3 . ]" 1 2276 1 98 LEU HB3 1 99 THR MG . . 5.340 4.592 4.272 4.991 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2277 1 57 LEU QD 1 98 LEU HG . . 3.640 3.474 2.907 3.711 0.071 19 0 "[ . 1 . 2 . 3 . ]" 1 2278 1 94 LEU HG 1 98 LEU MD1 . . 3.370 2.273 1.944 2.520 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2279 1 46 ALA MB 1 98 LEU MD1 . . 3.440 2.336 1.846 2.940 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2280 1 95 THR HA 1 98 LEU MD1 . . 4.440 2.377 1.998 2.689 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2281 1 94 LEU HA 1 98 LEU MD1 . . 5.210 4.894 4.700 5.096 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2282 1 57 LEU QD 1 99 THR HA . . 3.230 2.932 2.528 3.266 0.036 18 0 "[ . 1 . 2 . 3 . ]" 1 2283 1 99 THR HA 1 120 GLN HA . . 5.230 4.788 4.311 5.261 0.031 2 0 "[ . 1 . 2 . 3 . ]" 1 2284 1 99 THR HA 1 119 LEU QB . . 4.730 3.938 2.159 4.697 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2285 1 98 LEU HB2 1 99 THR HA . . 4.380 3.918 3.859 3.993 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2286 1 98 LEU MD1 1 99 THR HA . . 5.500 5.600 5.522 5.696 0.196 6 0 "[ . 1 . 2 . 3 . ]" 1 2287 1 57 LEU QD 1 99 THR MG . . 3.580 1.861 1.575 2.175 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2288 1 98 LEU HB2 1 99 THR MG . . 3.770 3.182 2.810 3.560 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2289 1 99 THR MG 1 120 GLN HA . . 5.200 3.266 2.808 3.897 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2290 1 99 THR MG 1 100 TYR HA . . 4.970 5.440 5.387 5.466 0.496 19 0 "[ . 1 . 2 . 3 . ]" 1 2291 1 95 THR HB 1 99 THR MG . . 4.540 4.566 4.264 4.734 0.194 26 0 "[ . 1 . 2 . 3 . ]" 1 2292 1 99 THR MG 1 119 LEU QB . . 5.500 4.221 2.782 5.063 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2293 1 93 LEU HG 1 97 ILE MD . . 3.920 3.700 3.006 3.970 0.050 9 0 "[ . 1 . 2 . 3 . ]" 1 2294 1 96 SER HB2 1 97 ILE MD . . 5.500 4.562 3.681 5.615 0.115 12 0 "[ . 1 . 2 . 3 . ]" 1 2295 1 97 ILE MD 1 160 MET HB3 . . 4.660 3.134 2.430 3.444 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2296 1 97 ILE MG 1 98 LEU MD2 . . 4.530 2.038 1.708 2.452 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2297 1 93 LEU QD 1 97 ILE MG . . 5.050 4.972 4.692 5.079 0.029 26 0 "[ . 1 . 2 . 3 . ]" 1 2298 1 97 ILE MG 1 158 VAL QG . . 2.670 2.265 1.726 2.772 0.102 33 0 "[ . 1 . 2 . 3 . ]" 1 2299 1 97 ILE MG 1 100 TYR HB2 . . 5.200 5.101 4.822 5.313 0.113 37 0 "[ . 1 . 2 . 3 . ]" 1 2300 1 87 LEU MD2 1 97 ILE MG . . 5.360 4.815 4.448 5.372 0.012 18 0 "[ . 1 . 2 . 3 . ]" 1 2301 1 97 ILE MG 1 101 HIS HB2 . . 4.880 3.684 3.306 3.974 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2302 1 94 LEU HA 1 97 ILE MG . . 4.250 3.956 3.553 4.257 0.007 36 0 "[ . 1 . 2 . 3 . ]" 1 2303 1 97 ILE MG 1 158 VAL HA . . 5.500 4.018 3.540 4.513 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2304 1 66 TYR HB3 1 102 VAL QG . . 3.540 2.094 1.755 2.584 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2305 1 66 TYR HB2 1 102 VAL QG . . 3.860 3.407 2.914 3.938 0.078 9 0 "[ . 1 . 2 . 3 . ]" 1 2306 1 102 VAL QG 1 119 LEU QD . . 2.400 1.789 1.561 2.170 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2307 1 102 VAL QG 1 103 VAL HA . . 4.390 3.610 3.295 4.135 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2308 1 66 TYR HA 1 102 VAL QG . . 4.410 3.789 3.299 4.100 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2309 1 32 VAL MG1 1 33 ALA HA . . 4.730 3.507 3.124 4.138 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2310 1 101 HIS HA 1 102 VAL QG . . 5.040 3.999 3.757 4.133 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2311 1 99 THR HB 1 102 VAL QG . . 5.030 4.023 3.570 4.913 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2312 1 102 VAL QG 1 119 LEU HG . . 4.020 3.217 1.998 3.951 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2313 1 103 VAL HA 1 119 LEU QB . . 4.100 3.429 2.822 4.375 0.275 23 0 "[ . 1 . 2 . 3 . ]" 1 2314 1 66 TYR HA 1 103 VAL HB . . 5.500 5.164 4.952 5.386 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2315 1 103 VAL MG1 1 116 ARG HD2 . . 3.530 3.003 1.757 4.427 0.897 17 7 "[ *. 1*** - + 2 . 3 * . ]" 1 2316 1 103 VAL MG2 1 118 THR HB . . 3.600 3.049 2.159 3.589 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2317 1 66 TYR HA 1 104 ALA MB . . 4.490 3.863 3.541 4.061 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2318 1 104 ALA MB 1 105 GLY QA . . 5.500 3.866 3.805 3.910 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2319 1 66 TYR HA 1 105 GLY QA . . 5.500 4.283 3.920 4.775 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2320 1 106 GLN HB3 1 106 GLN QG . . 2.500 2.546 2.323 2.572 0.072 12 0 "[ . 1 . 2 . 3 . ]" 1 2321 1 66 TYR HA 1 106 GLN QG . . 5.500 4.623 3.990 5.261 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2322 1 67 THR HA 1 106 GLN QG . . 5.500 3.603 3.276 3.941 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2323 1 107 THR HB 1 112 VAL QG . . 4.340 2.453 1.851 2.913 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2324 1 107 THR HB 1 112 VAL HB . . 4.280 3.679 2.981 4.548 0.268 11 0 "[ . 1 . 2 . 3 . ]" 1 2325 1 107 THR MG 1 108 SER HA . . 4.180 4.172 3.764 4.331 0.151 11 0 "[ . 1 . 2 . 3 . ]" 1 2326 1 108 SER HA 1 109 PRO HG2 . . 5.500 4.816 4.750 4.879 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2327 1 108 SER HA 1 109 PRO HG3 . . 4.390 4.390 4.342 4.438 0.048 22 0 "[ . 1 . 2 . 3 . ]" 1 2328 1 109 PRO HD2 1 144 GLY QA . . 4.600 3.832 3.438 4.102 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2329 1 108 SER HA 1 109 PRO HD3 . . 3.670 2.141 2.084 2.198 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2330 1 109 PRO HD3 1 144 GLY QA . . 4.570 2.603 2.245 2.847 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2331 1 108 SER HA 1 109 PRO HD2 . . 3.570 2.922 2.840 2.998 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2332 1 110 ALA MB 1 111 ASN HA . . 4.870 4.043 3.823 4.388 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2333 1 107 THR MG 1 111 ASN HB3 . . 4.420 2.589 1.937 3.383 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2334 1 107 THR MG 1 111 ASN HB2 . . 4.190 2.039 1.777 2.469 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2335 1 111 ASN HB3 1 112 VAL HA . . 5.500 4.173 3.912 4.650 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2336 1 111 ASN HB2 1 112 VAL HA . . 5.470 4.380 4.052 4.618 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2337 1 110 ALA MB 1 111 ASN HB2 . . 5.500 4.138 3.799 4.627 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2338 1 110 ALA MB 1 111 ASN HB3 . . 5.500 5.197 5.011 5.444 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2339 1 107 THR MG 1 112 VAL HA . . 3.300 2.477 1.978 3.308 0.008 34 0 "[ . 1 . 2 . 3 . ]" 1 2340 1 111 ASN HA 1 112 VAL HA . . 5.140 4.975 4.829 5.054 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2341 1 112 VAL HA 1 126 VAL MG2 . . 4.210 4.205 4.020 4.291 0.081 34 0 "[ . 1 . 2 . 3 . ]" 1 2342 1 112 VAL HA 1 126 VAL MG1 . . 5.500 4.311 3.839 4.685 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2343 1 111 ASN HA 1 112 VAL QG . . 5.050 4.626 4.298 4.849 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2344 1 107 THR HA 1 112 VAL QG . . 5.130 4.619 3.802 5.075 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2345 1 112 VAL QG 1 113 VAL HA . . 4.710 3.382 2.904 4.295 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2346 1 113 VAL QG 1 114 GLY HA3 . . 5.500 3.453 3.089 3.887 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2347 1 113 VAL QG 1 114 GLY HA2 . . 4.700 3.207 2.963 3.374 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2348 1 115 THR HA 1 125 THR MG . . 4.410 4.124 3.391 4.423 0.013 22 0 "[ . 1 . 2 . 3 . ]" 1 2349 1 115 THR HA 1 125 THR HB . . 5.500 5.213 4.627 5.530 0.030 18 0 "[ . 1 . 2 . 3 . ]" 1 2350 1 103 VAL MG1 1 116 ARG HB3 . . 4.330 3.180 2.129 4.347 0.017 37 0 "[ . 1 . 2 . 3 . ]" 1 2351 1 103 VAL MG2 1 116 ARG HB3 . . 4.550 2.939 2.125 3.763 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2352 1 115 THR HA 1 116 ARG QG . . 5.390 5.189 4.462 5.751 0.361 8 0 "[ . 1 . 2 . 3 . ]" 1 2353 1 81 ALA HA 1 84 ILE HG12 . . 4.060 3.096 2.846 3.210 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2354 1 83 THR HB 1 84 ILE HG12 . . 5.270 3.572 3.538 3.714 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2355 1 103 VAL MG1 1 116 ARG HD3 . . 4.410 2.792 1.903 4.293 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2356 1 103 VAL MG2 1 116 ARG HD3 . . 5.480 3.984 3.180 4.931 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2357 1 103 VAL MG2 1 116 ARG HD2 . . 4.690 4.129 2.952 5.136 0.446 13 0 "[ . 1 . 2 . 3 . ]" 1 2358 1 116 ARG HD2 1 126 VAL MG2 . . 5.500 4.559 2.635 5.514 0.014 19 0 "[ . 1 . 2 . 3 . ]" 1 2359 1 116 ARG HD3 1 126 VAL MG2 . . 5.500 4.640 2.567 5.455 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2360 1 112 VAL QG 1 116 ARG HD3 . . 5.500 3.668 1.894 5.184 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2361 1 112 VAL QG 1 116 ARG HD2 . . 5.500 3.595 2.330 4.736 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2362 1 117 GLN HG2 1 121 GLY HA2 . . 4.730 3.375 2.942 3.889 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2363 1 117 GLN HG3 1 123 SER HA . . 4.770 3.786 2.966 4.734 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2364 1 117 GLN HG3 1 121 GLY HA2 . . 4.720 3.934 3.016 4.629 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2365 1 117 GLN HG2 1 121 GLY HA3 . . 5.500 4.987 4.525 5.530 0.030 16 0 "[ . 1 . 2 . 3 . ]" 1 2366 1 103 VAL MG1 1 118 THR HA . . 3.730 2.912 2.012 3.470 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2367 1 100 TYR HA 1 118 THR HB . . 3.720 2.158 1.828 2.779 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2368 1 118 THR HB 1 120 GLN HB2 . . 5.070 4.116 3.203 5.210 0.140 2 0 "[ . 1 . 2 . 3 . ]" 1 2369 1 119 LEU QB 1 120 GLN HA . . 5.500 4.489 3.781 4.821 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2370 1 118 THR HB 1 119 LEU QB . . 5.500 4.389 3.929 4.790 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2371 1 102 VAL QG 1 119 LEU QB . . 4.990 2.609 1.838 3.587 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2372 1 120 GLN HA 1 120 GLN HG2 . . 4.140 3.099 2.269 3.825 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2373 1 100 TYR HA 1 120 GLN HB3 . . 4.470 2.871 2.192 3.583 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2374 1 100 TYR HB2 1 120 GLN HB3 . . 4.660 3.170 2.448 3.793 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2375 1 96 SER HA 1 120 GLN HB3 . . 5.030 4.829 4.420 5.196 0.166 20 0 "[ . 1 . 2 . 3 . ]" 1 2376 1 100 TYR HA 1 120 GLN HB2 . . 3.870 2.812 2.260 3.483 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2377 1 100 TYR HB2 1 120 GLN HB2 . . 4.660 3.031 2.250 3.556 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2378 1 96 SER HA 1 120 GLN HB2 . . 4.420 3.884 2.966 4.559 0.139 31 0 "[ . 1 . 2 . 3 . ]" 1 2379 1 96 SER HA 1 120 GLN HG2 . . 4.090 2.530 1.865 2.845 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2380 1 100 TYR HA 1 120 GLN HG2 . . 5.250 4.613 3.867 5.136 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2381 1 100 TYR HB2 1 120 GLN HG3 . . 3.610 3.477 2.641 4.335 0.725 32 8 "[ . 1 **. * 2 .* * + * - ]" 1 2382 1 100 TYR HA 1 120 GLN HG3 . . 4.960 4.528 3.976 5.141 0.181 17 0 "[ . 1 . 2 . 3 . ]" 1 2383 1 100 TYR HB2 1 120 GLN HG2 . . 4.430 3.527 2.493 4.515 0.085 12 0 "[ . 1 . 2 . 3 . ]" 1 2384 1 100 TYR HA 1 122 ALA MB . . 4.280 4.289 4.012 4.378 0.098 36 0 "[ . 1 . 2 . 3 . ]" 1 2385 1 121 GLY HA2 1 122 ALA MB . . 5.500 4.973 4.858 5.032 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2386 1 122 ALA MB 1 162 PRO QG . . 3.020 2.790 2.412 3.079 0.059 20 0 "[ . 1 . 2 . 3 . ]" 1 2387 1 121 GLY HA3 1 122 ALA MB . . 5.500 4.453 4.360 4.566 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2388 1 122 ALA MB 1 162 PRO HA . . 5.500 4.973 4.565 5.188 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2389 1 100 TYR HB2 1 122 ALA MB . . 5.500 4.021 3.725 4.326 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2390 1 122 ALA MB 1 124 VAL HA . . 5.500 5.067 4.900 5.197 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2391 1 122 ALA MB 1 123 SER HA . . 5.500 4.137 3.903 4.375 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2392 1 117 GLN HG2 1 123 SER HA . . 5.500 4.604 3.940 5.341 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2393 1 117 GLN HA 1 123 SER QB . . 4.490 3.823 3.116 4.269 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2394 1 123 SER QB 1 124 VAL HA . . 4.390 4.207 4.059 4.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2395 1 116 ARG HB3 1 124 VAL HB . . 5.500 4.528 2.590 5.676 0.176 7 0 "[ . 1 . 2 . 3 . ]" 1 2396 1 123 SER HA 1 124 VAL HB . . 5.130 4.719 4.397 5.457 0.327 38 0 "[ . 1 . 2 . 3 . ]" 1 2397 1 124 VAL HB 1 126 VAL MG2 . . 4.580 3.820 2.047 4.551 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2398 1 124 VAL HB 1 135 VAL QG . . 4.900 3.873 2.774 4.467 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2399 1 115 THR HA 1 124 VAL QG . . 5.330 4.078 3.609 4.673 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2400 1 118 THR HB 1 124 VAL QG . . 4.700 3.934 3.468 4.298 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2401 1 124 VAL QG 1 126 VAL MG2 . . 3.530 2.217 1.779 3.031 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2402 1 124 VAL QG 1 135 VAL HA . . 4.930 3.630 3.115 4.363 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2403 1 124 VAL QG 1 126 VAL HA . . 5.500 3.854 3.204 5.020 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2404 1 115 THR MG 1 125 THR HA . . 4.350 3.911 3.287 4.441 0.091 7 0 "[ . 1 . 2 . 3 . ]" 1 2405 1 124 VAL QG 1 125 THR HA . . 5.500 4.053 3.758 4.709 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2406 1 125 THR HA 1 126 VAL HB . . 4.870 4.734 4.616 4.907 0.037 2 0 "[ . 1 . 2 . 3 . ]" 1 2407 1 125 THR MG 1 126 VAL HA . . 5.080 4.224 3.794 4.566 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2408 1 126 VAL HA 1 127 THR MG . . 5.310 3.714 2.723 5.336 0.026 38 0 "[ . 1 . 2 . 3 . ]" 1 2409 1 97 ILE MD 1 160 MET HG2 . . 3.720 3.088 1.944 3.863 0.143 17 0 "[ . 1 . 2 . 3 . ]" 1 2410 1 113 VAL HA 1 126 VAL MG1 . . 3.530 2.007 1.866 2.536 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2411 1 113 VAL HA 1 126 VAL MG2 . . 4.280 3.687 3.466 4.136 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2412 1 30 VAL QG 1 33 ALA MB . . 3.810 3.536 3.268 3.686 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2413 1 126 VAL MG1 1 135 VAL QG . . 4.360 1.769 1.718 1.860 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2414 1 113 VAL QG 1 127 THR HA . . 3.460 1.896 1.759 2.187 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2415 1 126 VAL MG1 1 127 THR HA . . 3.990 3.606 3.369 3.866 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2416 1 113 VAL QG 1 127 THR HB . . 4.360 3.794 3.262 4.353 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2417 1 127 THR HA 1 127 THR MG . . 3.420 2.616 2.097 3.046 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2418 1 127 THR HB 1 128 GLY QA . . 5.500 4.339 3.837 4.822 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2419 1 113 VAL QG 1 128 GLY QA . . 5.500 3.120 2.109 3.919 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2420 1 127 THR MG 1 128 GLY QA . . 5.500 4.322 3.209 4.875 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2421 1 128 GLY QA 1 133 LEU HB2 . . 5.500 4.177 3.743 4.506 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2422 1 129 GLN QG 1 130 GLY QA . . 4.270 3.625 3.085 4.122 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2423 1 146 SER HB2 1 151 THR HA . . 4.960 4.663 4.452 4.899 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2424 1 133 LEU QD 1 140 VAL QG . . 2.830 2.360 1.933 2.662 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2425 1 133 LEU QD 1 140 VAL HB . . 3.670 3.295 2.932 3.584 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2426 1 134 LYS HB2 1 139 ASP HA . . 5.290 4.659 4.465 4.915 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2427 1 128 GLY QA 1 134 LYS HB2 . . 5.500 4.110 3.294 4.768 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2428 1 134 LYS HB3 1 139 ASP HA . . 4.660 4.370 3.893 4.657 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2429 1 127 THR MG 1 134 LYS HB3 . . 4.970 3.207 1.798 4.465 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2430 1 127 THR MG 1 134 LYS HB2 . . 3.370 3.160 2.158 3.409 0.039 24 0 "[ . 1 . 2 . 3 . ]" 1 2431 1 134 LYS HG3 1 139 ASP HB3 . . 5.280 4.641 4.115 5.216 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2432 1 134 LYS HG3 1 140 VAL QG . . 5.500 4.886 4.474 5.319 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2433 1 134 LYS QE 1 139 ASP HA . . 5.500 3.938 2.854 5.263 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2434 1 126 VAL MG1 1 135 VAL HB . . 4.060 4.050 3.683 4.129 0.069 7 0 "[ . 1 . 2 . 3 . ]" 1 2435 1 124 VAL QG 1 135 VAL HB . . 5.240 4.412 4.028 4.886 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2436 1 135 VAL QG 1 140 VAL HA . . 5.290 4.318 3.980 4.801 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2437 1 135 VAL QG 1 136 GLY HA2 . . 5.500 3.995 3.791 4.224 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2438 1 137 ASN HB3 1 138 ALA MB . . 4.380 4.096 3.816 4.968 0.588 19 1 "[ . 1 . +2 . 3 . ]" 1 2439 1 138 ALA MB 1 158 VAL HA . . 5.400 5.260 4.891 5.473 0.073 24 0 "[ . 1 . 2 . 3 . ]" 1 2440 1 134 LYS HA 1 138 ALA MB . . 5.500 4.568 4.231 4.886 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2441 1 138 ALA MB 1 140 VAL HA . . 5.500 4.631 4.461 5.077 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2442 1 138 ALA MB 1 159 LEU HA . . 5.500 3.907 2.952 4.509 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2443 1 134 LYS HA 1 140 VAL QG . . 3.840 2.716 2.382 2.894 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2444 1 141 VAL HA 1 142 CYS HA . . 4.630 4.570 4.548 4.597 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2445 1 7 GLY HA2 1 141 VAL QG . . 3.290 3.129 2.554 3.322 0.032 34 0 "[ . 1 . 2 . 3 . ]" 1 2446 1 8 CYS QB 1 142 CYS HB2 . . 2.770 2.442 1.861 2.809 0.039 25 0 "[ . 1 . 2 . 3 . ]" 1 2447 1 142 CYS HB2 1 154 MET HB2 . . 4.270 4.100 3.601 4.286 0.016 25 0 "[ . 1 . 2 . 3 . ]" 1 2448 1 142 CYS HB3 1 154 MET HB2 . . 3.410 2.756 2.273 3.016 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2449 1 143 GLY QA 1 152 VAL QG . . 5.270 3.384 3.232 3.602 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2450 1 142 CYS HA 1 143 GLY QA . . 5.500 3.971 3.941 3.994 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2451 1 108 SER HA 1 144 GLY QA . . 4.280 3.826 3.301 4.141 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2452 1 18 GLY HA3 1 19 PRO HG2 . . 5.210 4.642 4.420 4.804 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2453 1 145 VAL HB 1 152 VAL QG . . 3.840 1.922 1.830 2.098 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2454 1 145 VAL HB 1 152 VAL HA . . 5.500 4.600 4.474 4.742 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2455 1 145 VAL HB 1 153 TYR HA . . 5.500 5.317 5.176 5.501 0.001 19 0 "[ . 1 . 2 . 3 . ]" 1 2456 1 142 CYS HB3 1 145 VAL MG2 . . 3.620 3.471 3.157 3.635 0.015 34 0 "[ . 1 . 2 . 3 . ]" 1 2457 1 142 CYS HB2 1 145 VAL MG2 . . 4.230 4.249 4.007 4.304 0.074 31 0 "[ . 1 . 2 . 3 . ]" 1 2458 1 145 VAL MG2 1 153 TYR HA . . 4.180 3.660 3.367 4.192 0.012 34 0 "[ . 1 . 2 . 3 . ]" 1 2459 1 146 SER HA 1 151 THR HA . . 3.510 1.792 1.717 1.894 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2460 1 146 SER HA 1 151 THR MG . . 4.700 2.893 2.500 3.262 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2461 1 146 SER HA 1 151 THR HB . . 4.610 4.726 4.656 4.779 0.169 29 0 "[ . 1 . 2 . 3 . ]" 1 2462 1 146 SER HB3 1 147 THR HA . . 5.060 4.941 4.698 5.328 0.268 33 0 "[ . 1 . 2 . 3 . ]" 1 2463 1 147 THR HA 1 152 VAL QG . . 5.500 4.518 3.858 4.964 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2464 1 147 THR HB 1 150 ALA MB . . 5.220 4.668 4.393 5.000 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2465 1 25 MET HB2 1 147 THR MG . . 2.510 2.498 2.028 2.622 0.112 28 0 "[ . 1 . 2 . 3 . ]" 1 2466 1 147 THR MG 1 151 THR HA . . 5.270 4.335 3.919 4.743 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2467 1 147 THR MG 1 152 VAL QG . . 2.400 2.024 1.607 2.382 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2468 1 66 TYR HB2 1 150 ALA HA . . 4.650 3.573 3.374 3.936 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2469 1 106 GLN HB2 1 150 ALA HA . . 4.680 4.145 3.467 4.715 0.035 22 0 "[ . 1 . 2 . 3 . ]" 1 2470 1 66 TYR HB3 1 150 ALA HA . . 5.500 4.554 4.185 5.047 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2471 1 149 ASN HA 1 150 ALA HA . . 5.500 4.388 4.367 4.439 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2472 1 106 GLN HB3 1 150 ALA HA . . 5.150 4.998 4.580 5.218 0.068 28 0 "[ . 1 . 2 . 3 . ]" 1 2473 1 149 ASN HB2 1 150 ALA MB . . 5.500 4.094 3.861 4.331 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2474 1 150 ALA MB 1 151 THR HA . . 4.690 4.371 4.171 4.511 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2475 1 144 GLY QA 1 151 THR MG . . 2.880 2.428 2.259 2.517 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2476 1 151 THR HA 1 151 THR MG . . 3.310 2.297 2.187 2.424 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2477 1 147 THR MG 1 152 VAL HB . . 3.580 2.993 2.555 3.253 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2478 1 145 VAL MG1 1 152 VAL HB . . 3.710 3.469 3.234 3.672 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2479 1 145 VAL MG2 1 152 VAL HB . . 4.320 3.400 3.244 3.764 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2480 1 68 VAL HA 1 152 VAL QG . . 5.500 4.424 4.141 4.651 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2481 1 138 ALA HA 1 159 LEU QD . . 3.930 3.932 3.826 4.087 0.157 24 0 "[ . 1 . 2 . 3 . ]" 1 2482 1 141 VAL HB 1 154 MET HA . . 4.580 4.623 4.484 4.705 0.125 34 0 "[ . 1 . 2 . 3 . ]" 1 2483 1 40 LEU QD 1 154 MET HA . . 4.180 3.135 3.004 3.389 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2484 1 154 MET HA 1 155 ILE MD . . 4.790 3.844 2.727 4.826 0.036 9 0 "[ . 1 . 2 . 3 . ]" 1 2485 1 141 VAL QG 1 154 MET HA . . 5.450 3.957 3.809 4.167 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2486 1 57 LEU QD 1 98 LEU HB2 . . 4.300 2.001 1.692 2.475 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2487 1 155 ILE QG 1 159 LEU QB . . 4.540 4.131 3.107 4.602 0.062 12 0 "[ . 1 . 2 . 3 . ]" 1 2488 1 75 ALA MB 1 156 ASP HA . . 3.390 2.340 1.959 2.706 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2489 1 74 ALA MB 1 156 ASP HA . . 5.070 3.710 2.986 4.405 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2490 1 141 VAL QG 1 156 ASP HB3 . . 3.940 2.739 2.367 3.016 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2491 1 134 LYS HG2 1 139 ASP HB2 . . 4.990 4.690 4.416 5.025 0.035 5 0 "[ . 1 . 2 . 3 . ]" 1 2492 1 75 ALA MB 1 156 ASP HB3 . . 5.280 4.627 4.306 4.959 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2493 1 74 ALA MB 1 156 ASP HB3 . . 5.500 4.445 3.465 5.255 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2494 1 138 ALA MB 1 157 SER HA . . 4.900 3.957 3.704 4.306 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2495 1 78 LYS QD 1 157 SER HA . . 4.570 4.015 3.210 4.641 0.071 18 0 "[ . 1 . 2 . 3 . ]" 1 2496 1 157 SER HA 1 158 VAL HB . . 5.500 4.876 4.491 5.675 0.175 18 0 "[ . 1 . 2 . 3 . ]" 1 2497 1 157 SER HB2 1 159 LEU QD . . 5.280 2.758 1.969 3.595 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2498 1 157 SER HB2 1 159 LEU QB . . 4.930 4.834 4.318 5.847 0.917 28 2 "[ . 1 - . 2 . + 3 . ]" 1 2499 1 97 ILE HA 1 160 MET HB3 . . 4.640 4.714 4.669 4.802 0.162 29 0 "[ . 1 . 2 . 3 . ]" 1 2500 1 78 LYS QD 1 157 SER HB3 . . 5.340 5.042 4.451 5.522 0.182 13 0 "[ . 1 . 2 . 3 . ]" 1 2501 1 75 ALA MB 1 157 SER HB2 . . 5.430 4.270 4.055 4.604 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2502 1 97 ILE HA 1 161 PRO HD3 . . 3.070 1.947 1.800 2.129 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2503 1 55 VAL QG 1 91 SER QB . . 3.170 2.603 2.027 3.131 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2504 1 71 PRO HG3 1 158 VAL HA . . 3.340 2.546 1.856 3.015 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2505 1 54 GLN HB3 1 91 SER QB . . 3.990 2.453 2.023 3.162 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2506 1 71 PRO HB3 1 158 VAL HA . . 4.270 1.908 1.782 2.070 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2507 1 71 PRO HG2 1 158 VAL HA . . 3.910 3.646 3.031 4.004 0.094 28 0 "[ . 1 . 2 . 3 . ]" 1 2508 1 75 ALA MB 1 158 VAL HA . . 4.840 3.221 2.788 3.604 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2509 1 158 VAL HA 1 159 LEU QB . . 4.160 4.114 3.797 4.472 0.312 30 0 "[ . 1 . 2 . 3 . ]" 1 2510 1 79 LEU QD 1 158 VAL HB . . 3.690 2.574 1.873 3.799 0.109 23 0 "[ . 1 . 2 . 3 . ]" 1 2511 1 71 PRO HG3 1 158 VAL QG . . 3.600 3.108 2.588 3.543 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2512 1 71 PRO HG2 1 158 VAL QG . . 3.820 3.323 2.609 3.676 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2513 1 158 VAL QG 1 160 MET HA . . 5.290 4.136 3.376 4.668 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2514 1 160 MET HB2 1 161 PRO HD2 . . 4.040 3.624 2.809 4.043 0.003 29 0 "[ . 1 . 2 . 3 . ]" 1 2515 1 160 MET HB2 1 161 PRO HD3 . . 4.430 4.327 3.763 4.585 0.155 29 0 "[ . 1 . 2 . 3 . ]" 1 2516 1 160 MET ME 1 160 MET HG2 . . 3.050 2.419 1.969 3.118 0.068 3 0 "[ . 1 . 2 . 3 . ]" 1 2517 1 160 MET HA 1 160 MET ME . . 5.120 4.492 3.354 5.049 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2518 1 158 VAL QG 1 160 MET ME . . 5.500 2.827 1.689 4.581 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2519 1 162 PRO HD2 1 163 ALA MB . . 5.090 4.349 3.817 5.021 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2520 1 154 MET HA 1 154 MET ME . . 4.960 4.528 4.099 4.707 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2521 1 142 CYS HA 1 154 MET ME . . 5.500 4.839 4.307 5.461 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2522 1 72 THR HB 1 154 MET ME . . 5.380 4.721 3.677 5.334 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2523 1 72 THR HA 1 154 MET ME . . 5.190 4.900 4.175 5.211 0.021 36 0 "[ . 1 . 2 . 3 . ]" 1 2524 1 11 TYR HA 1 154 MET ME . . 5.340 5.150 4.518 5.380 0.040 3 0 "[ . 1 . 2 . 3 . ]" 1 2525 1 11 TYR HB2 1 154 MET ME . . 5.140 3.563 2.657 3.967 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2526 1 11 TYR HB3 1 154 MET ME . . 5.480 4.216 3.468 4.711 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2527 1 142 CYS HB3 1 154 MET ME . . 4.260 2.257 1.907 2.914 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2528 1 39 GLU HG3 1 154 MET ME . . 4.350 3.022 2.398 3.892 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2529 1 142 CYS HB2 1 154 MET ME . . 4.280 3.305 2.807 4.012 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2530 1 39 GLU QB 1 154 MET ME . . 3.600 2.733 2.322 3.504 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2531 1 154 MET HB3 1 154 MET ME . . 4.210 2.916 1.939 3.507 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2532 1 145 VAL MG1 1 154 MET ME . . 5.500 4.496 3.700 5.318 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2533 1 40 LEU QD 1 154 MET ME . . 3.810 3.118 2.433 3.379 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2534 1 145 VAL MG2 1 154 MET ME . . 4.600 3.893 3.375 4.358 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2535 1 25 MET HA 1 25 MET ME . . 4.740 4.253 4.039 4.465 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2536 1 21 SER HB2 1 25 MET ME . . 5.350 4.993 4.530 5.389 0.039 6 0 "[ . 1 . 2 . 3 . ]" 1 2537 1 25 MET HB3 1 25 MET ME . . 3.510 1.992 1.899 2.315 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2538 1 25 MET ME 1 145 VAL MG1 . . 3.570 2.006 1.694 2.310 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2539 1 22 VAL QG 1 25 MET ME . . 4.340 3.012 2.792 3.443 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2540 1 44 THR HA 1 47 LEU HG . . 3.960 1.922 1.820 2.000 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2541 1 44 THR HA 1 47 LEU HB2 . . 4.480 4.278 4.162 4.348 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2542 1 43 LEU QD 1 44 THR HA . . 5.090 3.292 3.078 3.673 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2543 1 47 LEU HA 1 47 LEU HG . . 4.100 3.537 3.520 3.554 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2544 1 43 LEU HG 1 47 LEU HG . . 3.280 3.382 3.248 3.470 0.190 36 0 "[ . 1 . 2 . 3 . ]" 1 2545 1 46 ALA MB 1 47 LEU HG . . 4.380 3.386 3.310 3.480 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2546 1 43 LEU QD 1 47 LEU HG . . 4.180 3.832 3.610 3.931 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2547 1 100 TYR HB3 1 161 PRO HA . . 5.500 4.713 4.439 5.348 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2548 1 100 TYR HB2 1 161 PRO HD2 . . 4.830 4.741 4.395 5.048 0.218 2 0 "[ . 1 . 2 . 3 . ]" 1 2549 1 100 TYR HB3 1 161 PRO HD2 . . 5.500 4.933 4.569 5.462 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2550 1 100 TYR HB3 1 161 PRO HD3 . . 5.500 3.217 2.861 3.727 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2551 1 100 TYR HB2 1 161 PRO HD3 . . 5.500 3.256 2.871 3.493 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2552 1 160 MET HB3 1 161 PRO HD3 . . 4.460 3.434 3.223 3.800 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2553 1 29 PRO HD2 1 33 ALA MB . . 5.500 4.715 3.898 5.242 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2554 1 160 MET HB3 1 161 PRO HD2 . . 3.680 2.557 2.235 3.270 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2555 1 71 PRO HG2 1 97 ILE MG . . 4.270 4.320 3.935 4.473 0.203 6 0 "[ . 1 . 2 . 3 . ]" 1 2556 1 71 PRO HG3 1 97 ILE MG . . 4.300 3.588 3.259 3.785 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2557 1 43 LEU QD 1 71 PRO HG3 . . 5.500 3.385 3.166 3.559 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2558 1 43 LEU QD 1 71 PRO HG2 . . 5.110 2.879 2.493 3.091 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2559 1 19 PRO HB2 1 36 ASN HB2 . . 4.970 3.576 2.757 4.727 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2560 1 68 VAL HA 1 69 PHE HB3 . . 5.330 5.466 5.439 5.496 0.166 17 0 "[ . 1 . 2 . 3 . ]" 1 2561 1 68 VAL HA 1 69 PHE HA . . 5.280 4.388 4.369 4.412 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2562 1 96 SER HA 1 120 GLN HG3 . . 4.170 3.446 2.444 4.280 0.110 13 0 "[ . 1 . 2 . 3 . ]" 1 2563 1 54 GLN HG3 1 91 SER QB . . 5.280 4.284 3.518 5.111 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2564 1 54 GLN HG2 1 91 SER QB . . 5.460 4.760 3.622 5.351 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2565 1 55 VAL HB 1 91 SER QB . . 5.440 4.229 1.946 5.477 0.037 31 0 "[ . 1 . 2 . 3 . ]" 1 2566 1 57 LEU HB2 1 98 LEU MD1 . . 4.320 3.553 2.914 4.339 0.019 19 0 "[ . 1 . 2 . 3 . ]" 1 2567 1 47 LEU HB2 1 57 LEU HB3 . . 5.500 3.337 2.800 4.479 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2568 1 23 GLN HA 1 24 GLY HA3 . . 5.190 5.351 5.293 5.391 0.201 18 0 "[ . 1 . 2 . 3 . ]" 1 2569 1 25 MET ME 1 145 VAL HA . . 5.500 4.917 4.341 5.462 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2570 1 25 MET ME 1 33 ALA HA . . 5.500 4.652 4.144 5.051 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2571 1 38 PRO HA 1 39 GLU HA . . 5.500 4.350 4.324 4.372 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2572 1 161 PRO HD3 1 162 PRO HD3 . . 5.500 5.516 5.256 5.706 0.206 26 0 "[ . 1 . 2 . 3 . ]" 1 2573 1 99 THR MG 1 120 GLN HB2 . . 5.030 3.760 3.372 4.405 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2574 1 95 THR MG 1 96 SER HA . . 5.120 3.197 2.794 4.105 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2575 1 95 THR MG 1 96 SER HB2 . . 5.260 4.540 2.971 5.293 0.033 35 0 "[ . 1 . 2 . 3 . ]" 1 2576 1 120 GLN HG3 1 122 ALA MB . . 5.280 3.536 2.625 4.464 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2577 1 124 VAL HA 1 135 VAL QG . . 5.500 4.400 3.771 4.824 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2578 1 162 PRO HA 1 163 ALA MB . . 5.500 4.157 3.788 4.329 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2579 1 47 LEU HB2 1 57 LEU HA . . 5.500 4.677 4.417 5.044 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2580 1 47 LEU HB3 1 48 SER HA . . 5.500 5.507 5.476 5.546 0.046 16 0 "[ . 1 . 2 . 3 . ]" 1 2581 1 30 VAL HB 1 150 ALA HA . . 5.500 4.683 4.333 4.992 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2582 1 25 MET HB3 1 145 VAL MG1 . . 5.460 4.353 4.024 4.620 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2583 1 45 ALA MB 1 50 GLN HG2 . . 5.140 4.432 4.187 4.807 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2584 1 45 ALA MB 1 50 GLN HG3 . . 5.170 3.419 3.145 3.757 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2585 1 29 PRO HG3 1 32 VAL MG2 . . 4.120 3.322 3.042 4.249 0.129 19 0 "[ . 1 . 2 . 3 . ]" 1 2586 1 75 ALA HA 1 78 LYS HG3 . . 5.500 3.824 2.166 4.476 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2587 1 134 LYS QE 1 137 ASN HA . . 4.590 4.027 2.340 4.623 0.033 27 0 "[ . 1 . 2 . 3 . ]" 1 2588 1 17 THR HA 1 18 GLY HA3 . . 5.500 4.654 4.354 5.210 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2589 1 109 PRO HB3 1 112 VAL QG . . 4.870 3.491 3.097 3.856 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2590 1 97 ILE MD 1 160 MET ME . . 5.500 3.441 1.691 5.124 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2591 1 113 VAL HA 1 126 VAL HB . . 3.450 2.107 1.932 2.612 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2592 1 39 GLU HA 1 73 ASN HB3 . . 5.500 3.872 2.260 4.625 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2593 1 39 GLU HA 1 73 ASN HB2 . . 5.500 3.434 2.274 4.899 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2594 1 15 ASN HB3 1 16 PRO HD3 . . 5.500 4.738 4.634 4.804 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2595 1 30 VAL HA 1 34 ALA MB . . 5.500 4.856 3.935 5.549 0.049 11 0 "[ . 1 . 2 . 3 . ]" 1 2596 1 30 VAL QG 1 31 ALA MB . . 3.540 2.622 2.278 2.981 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2597 1 99 THR HB 1 119 LEU HG . . 4.630 3.480 2.063 4.939 0.309 23 0 "[ . 1 . 2 . 3 . ]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 72 _Distance_constraint_stats_list.Viol_count 1808 _Distance_constraint_stats_list.Viol_total 18436.406 _Distance_constraint_stats_list.Viol_max 4.953 _Distance_constraint_stats_list.Viol_rms 0.5900 _Distance_constraint_stats_list.Viol_average_all_restraints 0.1773 _Distance_constraint_stats_list.Viol_average_violations_only 0.2683 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details . loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 37 ASN 12.686 0.347 30 0 "[ . 1 . 2 . 3 . ]" 1 40 LEU 25.416 0.347 30 0 "[ . 1 . 2 . 3 . ]" 1 41 THR 4.116 0.168 11 0 "[ . 1 . 2 . 3 . ]" 1 43 LEU 22.159 0.283 16 0 "[ . 1 . 2 . 3 . ]" 1 44 THR 10.159 0.260 37 0 "[ . 1 . 2 . 3 . ]" 1 45 ALA 4.890 0.168 11 0 "[ . 1 . 2 . 3 . ]" 1 46 ALA 1.453 0.093 37 0 "[ . 1 . 2 . 3 . ]" 1 47 LEU 10.572 0.283 16 0 "[ . 1 . 2 . 3 . ]" 1 48 SER 7.564 0.260 37 0 "[ . 1 . 2 . 3 . ]" 1 49 GLY 0.774 0.104 17 0 "[ . 1 . 2 . 3 . ]" 1 65 GLN 4.475 0.230 11 0 "[ . 1 . 2 . 3 . ]" 1 66 TYR 11.147 0.248 19 0 "[ . 1 . 2 . 3 . ]" 1 67 THR 15.318 0.454 16 0 "[ . 1 . 2 . 3 . ]" 1 68 VAL 5.930 0.212 30 0 "[ . 1 . 2 . 3 . ]" 1 70 ALA 3.123 0.113 35 0 "[ . 1 . 2 . 3 . ]" 1 72 THR 3.064 0.172 12 0 "[ . 1 . 2 . 3 . ]" 1 94 LEU 8.269 0.270 35 0 "[ . 1 . 2 . 3 . ]" 1 95 THR 1.632 0.147 11 0 "[ . 1 . 2 . 3 . ]" 1 97 ILE 23.348 0.749 3 15 "[* + .** 1 . **2* - .** ** ** *]" 1 98 LEU 3.043 0.155 20 0 "[ . 1 . 2 . 3 . ]" 1 99 THR 1.632 0.147 11 0 "[ . 1 . 2 . 3 . ]" 1 100 TYR 18.122 0.749 3 15 "[* + .** 1 . **2* - .** ** ** *]" 1 102 VAL 2.909 0.218 9 0 "[ . 1 . 2 . 3 . ]" 1 103 VAL 15.318 0.454 16 0 "[ . 1 . 2 . 3 . ]" 1 105 GLY 4.475 0.230 11 0 "[ . 1 . 2 . 3 . ]" 1 114 GLY 0.664 0.076 38 0 "[ . 1 . 2 . 3 . ]" 1 116 ARG 3.149 0.165 18 0 "[ . 1 . 2 . 3 . ]" 1 118 THR 2.857 0.281 11 0 "[ . 1 . 2 . 3 . ]" 1 119 LEU 2.909 0.218 9 0 "[ . 1 . 2 . 3 . ]" 1 122 ALA 2.857 0.281 11 0 "[ . 1 . 2 . 3 . ]" 1 124 VAL 3.149 0.165 18 0 "[ . 1 . 2 . 3 . ]" 1 125 THR 268.289 4.953 7 38 [******+************-******************] 1 126 VAL 0.664 0.076 38 0 "[ . 1 . 2 . 3 . ]" 1 127 THR 1.915 0.099 22 0 "[ . 1 . 2 . 3 . ]" 1 133 LEU 0.993 0.133 2 0 "[ . 1 . 2 . 3 . ]" 1 134 LYS 1.915 0.099 22 0 "[ . 1 . 2 . 3 . ]" 1 135 VAL 4.997 0.235 14 0 "[ . 1 . 2 . 3 . ]" 1 136 GLY 268.289 4.953 7 38 [******+************-******************] 1 138 ALA 4.997 0.235 14 0 "[ . 1 . 2 . 3 . ]" 1 140 VAL 0.993 0.133 2 0 "[ . 1 . 2 . 3 . ]" 1 141 VAL 10.475 0.274 16 0 "[ . 1 . 2 . 3 . ]" 1 142 CYS 47.334 0.898 14 31 "[** ******** +*-*********** 3******* ]" 1 145 VAL 19.046 0.344 34 0 "[ . 1 . 2 . 3 . ]" 1 147 THR 1.569 0.168 24 0 "[ . 1 . 2 . 3 . ]" 1 149 ASN 7.691 0.248 19 0 "[ . 1 . 2 . 3 . ]" 1 150 ALA 1.569 0.168 24 0 "[ . 1 . 2 . 3 . ]" 1 151 THR 5.777 0.179 13 0 "[ . 1 . 2 . 3 . ]" 1 152 VAL 19.046 0.344 34 0 "[ . 1 . 2 . 3 . ]" 1 153 TYR 4.793 0.212 30 0 "[ . 1 . 2 . 3 . ]" 1 154 MET 57.808 0.898 14 31 "[** ******** +*-*********** 3******* ]" 1 155 ILE 5.002 0.172 12 0 "[ . 1 . 2 . 3 . ]" 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 72 THR H 1 155 ILE O . . 2.000 1.940 1.660 2.172 0.172 12 0 "[ . 1 . 2 . 3 . ]" 2 2 1 72 THR N 1 155 ILE O . 2.700 3.000 2.916 2.649 3.165 0.165 12 0 "[ . 1 . 2 . 3 . ]" 2 3 1 70 ALA H 1 153 TYR O . . 2.000 2.004 1.823 2.098 0.098 16 0 "[ . 1 . 2 . 3 . ]" 2 4 1 70 ALA N 1 153 TYR O . 2.700 3.000 2.743 2.659 2.921 0.041 31 0 "[ . 1 . 2 . 3 . ]" 2 5 1 68 VAL H 1 151 THR O . . 2.000 1.907 1.774 2.081 0.081 33 0 "[ . 1 . 2 . 3 . ]" 2 6 1 68 VAL N 1 151 THR O . 2.700 3.000 2.673 2.536 2.893 0.164 23 0 "[ . 1 . 2 . 3 . ]" 2 7 1 66 TYR H 1 149 ASN O . . 2.000 2.147 2.072 2.248 0.248 19 0 "[ . 1 . 2 . 3 . ]" 2 8 1 66 TYR N 1 149 ASN O . 2.700 3.000 3.054 2.973 3.147 0.147 19 0 "[ . 1 . 2 . 3 . ]" 2 9 1 70 ALA O 1 155 ILE H . . 2.000 1.824 1.687 1.934 0.113 35 0 "[ . 1 . 2 . 3 . ]" 2 10 1 70 ALA O 1 155 ILE N . 2.700 3.000 2.672 2.587 2.782 0.113 35 0 "[ . 1 . 2 . 3 . ]" 2 11 1 68 VAL O 1 153 TYR H . . 2.000 2.093 1.972 2.212 0.212 30 0 "[ . 1 . 2 . 3 . ]" 2 12 1 68 VAL O 1 153 TYR N . 2.700 3.000 2.787 2.678 2.912 0.022 15 0 "[ . 1 . 2 . 3 . ]" 2 13 1 66 TYR O 1 151 THR H . . 2.000 2.077 1.878 2.179 0.179 13 0 "[ . 1 . 2 . 3 . ]" 2 14 1 66 TYR O 1 151 THR N . 2.700 3.000 2.937 2.770 3.056 0.056 13 0 "[ . 1 . 2 . 3 . ]" 2 15 1 67 THR H 1 103 VAL O . . 2.000 2.077 1.886 2.261 0.261 20 0 "[ . 1 . 2 . 3 . ]" 2 16 1 67 THR N 1 103 VAL O . 2.700 3.000 2.617 2.487 2.825 0.213 22 0 "[ . 1 . 2 . 3 . ]" 2 17 1 65 GLN O 1 105 GLY H . . 2.000 1.917 1.655 2.197 0.197 17 0 "[ . 1 . 2 . 3 . ]" 2 18 1 65 GLN O 1 105 GLY N . 2.700 3.000 2.613 2.470 2.923 0.230 11 0 "[ . 1 . 2 . 3 . ]" 2 19 1 67 THR O 1 103 VAL H . . 2.000 2.160 2.066 2.454 0.454 16 0 "[ . 1 . 2 . 3 . ]" 2 20 1 67 THR O 1 103 VAL N . 2.700 3.000 3.067 2.975 3.148 0.148 18 0 "[ . 1 . 2 . 3 . ]" 2 21 1 116 ARG H 1 124 VAL O . . 2.000 2.004 1.771 2.099 0.099 33 0 "[ . 1 . 2 . 3 . ]" 2 22 1 116 ARG N 1 124 VAL O . 2.700 3.000 2.920 2.711 3.034 0.034 2 0 "[ . 1 . 2 . 3 . ]" 2 23 1 118 THR H 1 122 ALA O . . 2.000 2.036 1.798 2.281 0.281 11 0 "[ . 1 . 2 . 3 . ]" 2 24 1 118 THR N 1 122 ALA O . 2.700 3.000 2.916 2.662 3.165 0.165 38 0 "[ . 1 . 2 . 3 . ]" 2 25 1 102 VAL O 1 119 LEU H . . 2.000 1.844 1.582 2.117 0.218 9 0 "[ . 1 . 2 . 3 . ]" 2 26 1 102 VAL O 1 119 LEU N . 2.700 3.000 2.776 2.517 3.081 0.183 9 0 "[ . 1 . 2 . 3 . ]" 2 27 1 116 ARG O 1 124 VAL H . . 2.000 1.858 1.635 2.044 0.165 18 0 "[ . 1 . 2 . 3 . ]" 2 28 1 116 ARG O 1 124 VAL N . 2.700 3.000 2.749 2.543 2.922 0.157 8 0 "[ . 1 . 2 . 3 . ]" 2 29 1 125 THR H 1 136 GLY O . . 2.000 5.713 4.627 6.953 4.953 7 38 [******+************-******************] 2 30 1 125 THR N 1 136 GLY O . 2.700 3.000 6.347 5.296 7.424 4.424 7 38 [******+************-******************] 2 31 1 114 GLY O 1 126 VAL H . . 2.000 1.942 1.780 2.054 0.054 8 0 "[ . 1 . 2 . 3 . ]" 2 32 1 114 GLY O 1 126 VAL N . 2.700 3.000 2.786 2.624 2.980 0.076 38 0 "[ . 1 . 2 . 3 . ]" 2 33 1 127 THR H 1 134 LYS O . . 2.000 1.829 1.730 2.007 0.070 34 0 "[ . 1 . 2 . 3 . ]" 2 34 1 127 THR N 1 134 LYS O . 2.700 3.000 2.755 2.623 2.980 0.077 24 0 "[ . 1 . 2 . 3 . ]" 2 35 1 127 THR O 1 134 LYS H . . 2.000 1.912 1.701 2.069 0.099 22 0 "[ . 1 . 2 . 3 . ]" 2 36 1 127 THR O 1 134 LYS N . 2.700 3.000 2.872 2.663 3.028 0.037 22 0 "[ . 1 . 2 . 3 . ]" 2 37 1 135 VAL H 1 138 ALA O . . 2.000 2.082 1.835 2.235 0.235 14 0 "[ . 1 . 2 . 3 . ]" 2 38 1 135 VAL N 1 138 ALA O . 2.700 3.000 3.027 2.741 3.166 0.166 14 0 "[ . 1 . 2 . 3 . ]" 2 39 1 147 THR H 1 150 ALA O . . 2.000 1.888 1.632 2.113 0.168 24 0 "[ . 1 . 2 . 3 . ]" 2 40 1 147 THR N 1 150 ALA O . 2.700 3.000 2.860 2.630 3.054 0.070 24 0 "[ . 1 . 2 . 3 . ]" 2 41 1 145 VAL H 1 152 VAL O . . 2.000 2.257 2.195 2.344 0.344 34 0 "[ . 1 . 2 . 3 . ]" 2 42 1 145 VAL N 1 152 VAL O . 2.700 3.000 3.244 3.173 3.342 0.342 34 0 "[ . 1 . 2 . 3 . ]" 2 43 1 142 CYS H 1 154 MET O . . 2.000 2.683 2.249 2.898 0.898 14 31 "[** ******** +************* 3******- ]" 2 44 1 142 CYS N 1 154 MET O . 2.700 3.000 3.563 3.116 3.782 0.782 36 28 "[** *.****** **-*********** 3****.+ ]" 2 45 1 141 VAL H 1 154 MET O . . 2.000 1.677 1.566 1.797 0.234 15 0 "[ . 1 . 2 . 3 . ]" 2 46 1 141 VAL N 1 154 MET O . 2.700 3.000 2.547 2.426 2.661 0.274 16 0 "[ . 1 . 2 . 3 . ]" 2 47 1 133 LEU O 1 140 VAL H . . 2.000 1.867 1.735 2.021 0.065 2 0 "[ . 1 . 2 . 3 . ]" 2 48 1 133 LEU O 1 140 VAL N . 2.700 3.000 2.705 2.567 2.870 0.133 2 0 "[ . 1 . 2 . 3 . ]" 2 49 1 37 ASN O 1 40 LEU H . . 2.000 2.198 2.114 2.347 0.347 30 0 "[ . 1 . 2 . 3 . ]" 2 50 1 37 ASN O 1 40 LEU N . 2.700 3.000 3.135 3.101 3.189 0.189 30 0 "[ . 1 . 2 . 3 . ]" 2 51 1 40 LEU O 1 43 LEU H . . 2.000 2.070 1.731 2.125 0.125 33 0 "[ . 1 . 2 . 3 . ]" 2 52 1 40 LEU O 1 43 LEU N . 2.700 3.000 2.513 2.458 2.629 0.242 6 0 "[ . 1 . 2 . 3 . ]" 2 53 1 40 LEU O 1 44 THR H . . 2.000 1.818 1.642 2.165 0.165 37 0 "[ . 1 . 2 . 3 . ]" 2 54 1 40 LEU O 1 44 THR N . 2.700 3.000 2.742 2.610 3.015 0.090 14 0 "[ . 1 . 2 . 3 . ]" 2 55 1 41 THR O 1 45 ALA H . . 2.000 2.063 1.943 2.168 0.168 11 0 "[ . 1 . 2 . 3 . ]" 2 56 1 41 THR O 1 45 ALA N . 2.700 3.000 3.037 2.941 3.146 0.146 10 0 "[ . 1 . 2 . 3 . ]" 2 57 1 43 LEU O 1 46 ALA H . . 2.000 2.008 1.872 2.093 0.093 37 0 "[ . 1 . 2 . 3 . ]" 2 58 1 43 LEU O 1 46 ALA N . 2.700 3.000 2.723 2.611 2.831 0.089 29 0 "[ . 1 . 2 . 3 . ]" 2 59 1 43 LEU O 1 47 LEU H . . 2.000 2.199 2.119 2.283 0.283 16 0 "[ . 1 . 2 . 3 . ]" 2 60 1 43 LEU O 1 47 LEU N . 2.700 3.000 3.079 3.008 3.184 0.184 16 0 "[ . 1 . 2 . 3 . ]" 2 61 1 44 THR O 1 48 SER H . . 2.000 1.737 1.669 1.845 0.131 18 0 "[ . 1 . 2 . 3 . ]" 2 62 1 44 THR O 1 48 SER N . 2.700 3.000 2.565 2.440 2.689 0.260 37 0 "[ . 1 . 2 . 3 . ]" 2 63 1 45 ALA O 1 49 GLY H . . 2.000 1.994 1.902 2.104 0.104 17 0 "[ . 1 . 2 . 3 . ]" 2 64 1 45 ALA O 1 49 GLY N . 2.700 3.000 2.892 2.774 3.052 0.052 17 0 "[ . 1 . 2 . 3 . ]" 2 65 1 94 LEU O 1 97 ILE H . . 2.000 2.068 1.774 2.270 0.270 35 0 "[ . 1 . 2 . 3 . ]" 2 66 1 94 LEU O 1 97 ILE N . 2.700 3.000 2.738 2.436 2.939 0.264 6 0 "[ . 1 . 2 . 3 . ]" 2 67 1 94 LEU O 1 98 LEU H . . 2.000 2.055 1.889 2.155 0.155 20 0 "[ . 1 . 2 . 3 . ]" 2 68 1 94 LEU O 1 98 LEU N . 2.700 3.000 2.995 2.802 3.094 0.094 31 0 "[ . 1 . 2 . 3 . ]" 2 69 1 95 THR O 1 99 THR H . . 2.000 1.813 1.653 2.082 0.147 11 0 "[ . 1 . 2 . 3 . ]" 2 70 1 95 THR O 1 99 THR N . 2.700 3.000 2.782 2.636 3.060 0.064 11 0 "[ . 1 . 2 . 3 . ]" 2 71 1 97 ILE O 1 100 TYR H . . 2.000 2.468 2.206 2.749 0.749 3 15 "[* + .** 1 . **2* - .** ** ** *]" 2 72 1 97 ILE O 1 100 TYR N . 2.700 3.000 2.874 2.632 3.074 0.074 3 0 "[ . 1 . 2 . 3 . ]" 2 stop_ save_
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