NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
431754 | 2jqq | 15290 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2jqq 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 1621 _Distance_constraint_stats_list.Viol_count 1205 _Distance_constraint_stats_list.Viol_total 520.138 _Distance_constraint_stats_list.Viol_max 0.232 _Distance_constraint_stats_list.Viol_rms 0.0070 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0008 _Distance_constraint_stats_list.Viol_average_violations_only 0.0216 _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 51 LYS 0.396 0.199 20 0 "[ . 1 . 2]" 1 52 THR 0.400 0.199 20 0 "[ . 1 . 2]" 1 53 GLN 0.085 0.012 14 0 "[ . 1 . 2]" 1 54 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 55 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 56 LEU 0.532 0.029 14 0 "[ . 1 . 2]" 1 57 GLN 0.227 0.029 14 0 "[ . 1 . 2]" 1 58 LYS 0.069 0.014 14 0 "[ . 1 . 2]" 1 59 PHE 0.007 0.006 13 0 "[ . 1 . 2]" 1 60 MET 0.532 0.058 19 0 "[ . 1 . 2]" 1 61 THR 0.314 0.048 20 0 "[ . 1 . 2]" 1 62 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 63 LEU 0.426 0.029 12 0 "[ . 1 . 2]" 1 64 ASP 0.038 0.009 16 0 "[ . 1 . 2]" 1 65 HIS 0.004 0.001 18 0 "[ . 1 . 2]" 1 66 LEU 0.425 0.116 17 0 "[ . 1 . 2]" 1 67 ILE 0.019 0.007 11 0 "[ . 1 . 2]" 1 68 LYS 0.007 0.007 11 0 "[ . 1 . 2]" 1 69 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 70 ASP 0.044 0.011 16 0 "[ . 1 . 2]" 1 71 ILE 0.044 0.011 16 0 "[ . 1 . 2]" 1 72 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 73 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 74 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 75 GLN 0.263 0.032 4 0 "[ . 1 . 2]" 1 76 GLU 0.272 0.032 4 0 "[ . 1 . 2]" 1 77 ILE 1.095 0.068 16 0 "[ . 1 . 2]" 1 78 ILE 2.100 0.089 9 0 "[ . 1 . 2]" 1 79 LYS 1.050 0.136 6 0 "[ . 1 . 2]" 1 80 ASP 2.155 0.068 16 0 "[ . 1 . 2]" 1 81 VAL 3.570 0.232 5 0 "[ . 1 . 2]" 1 82 LEU 2.242 0.136 6 0 "[ . 1 . 2]" 1 83 GLU 1.585 0.057 16 0 "[ . 1 . 2]" 1 84 TYR 0.126 0.091 13 0 "[ . 1 . 2]" 1 85 LEU 1.308 0.069 12 0 "[ . 1 . 2]" 1 86 LYS 0.419 0.025 7 0 "[ . 1 . 2]" 1 87 LYS 0.419 0.025 7 0 "[ . 1 . 2]" 1 88 LEU 0.664 0.047 10 0 "[ . 1 . 2]" 1 89 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 90 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 91 ILE 0.898 0.110 6 0 "[ . 1 . 2]" 1 92 TYR 0.013 0.007 13 0 "[ . 1 . 2]" 1 93 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 94 SER 0.020 0.004 8 0 "[ . 1 . 2]" 1 95 LEU 0.553 0.110 6 0 "[ . 1 . 2]" 1 96 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 97 ASN 0.035 0.025 14 0 "[ . 1 . 2]" 1 100 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 101 LEU 0.111 0.111 6 0 "[ . 1 . 2]" 1 102 THR 0.097 0.028 9 0 "[ . 1 . 2]" 1 103 GLU 0.254 0.091 9 0 "[ . 1 . 2]" 1 104 ALA 0.248 0.075 18 0 "[ . 1 . 2]" 1 105 LEU 0.208 0.098 17 0 "[ . 1 . 2]" 1 106 SER 0.050 0.013 6 0 "[ . 1 . 2]" 1 107 LEU 1.617 0.072 10 0 "[ . 1 . 2]" 1 108 GLY 0.523 0.040 20 0 "[ . 1 . 2]" 1 109 LYS 0.701 0.124 20 0 "[ . 1 . 2]" 1 110 ARG 0.623 0.074 6 0 "[ . 1 . 2]" 1 111 LEU 1.296 0.101 13 0 "[ . 1 . 2]" 1 112 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 113 LYS 0.077 0.013 1 0 "[ . 1 . 2]" 1 114 SER 0.072 0.023 1 0 "[ . 1 . 2]" 1 115 LEU 0.036 0.013 7 0 "[ . 1 . 2]" 1 116 HIS 0.092 0.014 7 0 "[ . 1 . 2]" 1 117 GLU 0.112 0.023 1 0 "[ . 1 . 2]" 1 118 MET 0.393 0.046 8 0 "[ . 1 . 2]" 1 119 CYS 0.278 0.034 4 0 "[ . 1 . 2]" 1 120 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 121 ILE 0.173 0.059 6 0 "[ . 1 . 2]" 1 122 GLU 0.165 0.059 6 0 "[ . 1 . 2]" 1 123 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 124 LEU 0.010 0.004 4 0 "[ . 1 . 2]" 1 125 GLU 0.214 0.033 15 0 "[ . 1 . 2]" 1 126 GLU 0.668 0.047 4 0 "[ . 1 . 2]" 1 127 GLU 0.900 0.116 17 0 "[ . 1 . 2]" 1 128 ILE 0.319 0.046 8 0 "[ . 1 . 2]" 1 129 CYS 0.801 0.047 4 0 "[ . 1 . 2]" 1 130 SER 0.679 0.052 4 0 "[ . 1 . 2]" 1 131 GLY 0.056 0.014 6 0 "[ . 1 . 2]" 1 132 LEU 3.546 0.232 5 0 "[ . 1 . 2]" 1 133 ILE 0.912 0.105 13 0 "[ . 1 . 2]" 1 134 GLU 0.175 0.070 19 0 "[ . 1 . 2]" 1 135 GLN 0.082 0.013 6 0 "[ . 1 . 2]" 1 136 LEU 0.029 0.008 17 0 "[ . 1 . 2]" 1 137 TYR 0.496 0.029 5 0 "[ . 1 . 2]" 1 138 LYS 0.363 0.039 12 0 "[ . 1 . 2]" 1 139 LEU 0.003 0.003 9 0 "[ . 1 . 2]" 1 140 ILE 0.487 0.058 11 0 "[ . 1 . 2]" 1 141 THR 0.379 0.039 12 0 "[ . 1 . 2]" 1 142 ALA 0.014 0.005 5 0 "[ . 1 . 2]" 1 143 SER 0.038 0.009 3 0 "[ . 1 . 2]" 1 144 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 145 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 146 ILE 0.015 0.003 5 0 "[ . 1 . 2]" 1 147 LEU 0.009 0.003 5 0 "[ . 1 . 2]" 1 148 GLU 0.002 0.002 5 0 "[ . 1 . 2]" 1 149 SER 0.005 0.005 18 0 "[ . 1 . 2]" 1 150 CYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 151 ALA 0.005 0.005 18 0 "[ . 1 . 2]" 1 152 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 155 SER 0.028 0.028 10 0 "[ . 1 . 2]" 1 156 PRO 0.019 0.019 10 0 "[ . 1 . 2]" 1 157 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 158 ILE 0.037 0.028 10 0 "[ . 1 . 2]" 1 159 HIS 0.043 0.019 10 0 "[ . 1 . 2]" 1 160 HIS 0.045 0.010 6 0 "[ . 1 . 2]" 1 161 LEU 0.010 0.003 15 0 "[ . 1 . 2]" 1 162 ARG 0.070 0.010 19 0 "[ . 1 . 2]" 1 163 ASN 0.792 0.091 13 0 "[ . 1 . 2]" 1 164 ASP 0.236 0.098 17 0 "[ . 1 . 2]" 1 165 TYR 0.584 0.091 13 0 "[ . 1 . 2]" 1 166 GLN 0.213 0.022 18 0 "[ . 1 . 2]" 1 167 ASP 0.318 0.124 20 0 "[ . 1 . 2]" 1 168 LEU 1.096 0.040 20 0 "[ . 1 . 2]" 1 169 LEU 0.327 0.058 11 0 "[ . 1 . 2]" 1 170 GLN 0.519 0.024 7 0 "[ . 1 . 2]" 1 171 GLU 0.151 0.021 12 0 "[ . 1 . 2]" 1 172 PHE 0.998 0.050 20 0 "[ . 1 . 2]" 1 173 GLN 0.212 0.024 7 0 "[ . 1 . 2]" 1 174 ILE 0.727 0.070 10 0 "[ . 1 . 2]" 1 175 SER 0.017 0.008 20 0 "[ . 1 . 2]" 1 176 LEU 1.277 0.143 3 0 "[ . 1 . 2]" 1 177 LYS 0.065 0.016 20 0 "[ . 1 . 2]" 1 178 ILE 0.080 0.070 10 0 "[ . 1 . 2]" 1 179 LEU 0.001 0.001 6 0 "[ . 1 . 2]" 1 180 THR 0.051 0.007 6 0 "[ . 1 . 2]" 1 181 GLU 0.010 0.005 20 0 "[ . 1 . 2]" 1 182 LYS 0.001 0.001 6 0 "[ . 1 . 2]" 1 183 CYS 0.051 0.007 6 0 "[ . 1 . 2]" 1 184 LEU 0.017 0.007 17 0 "[ . 1 . 2]" 1 185 GLU 0.007 0.007 17 0 "[ . 1 . 2]" 1 186 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 187 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 188 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 189 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 190 LEU 0.005 0.002 10 0 "[ . 1 . 2]" 1 191 GLN 0.013 0.013 11 0 "[ . 1 . 2]" 1 192 ASN 0.005 0.002 10 0 "[ . 1 . 2]" 1 193 LEU 0.062 0.010 8 0 "[ . 1 . 2]" 1 194 SER 0.071 0.010 8 0 "[ . 1 . 2]" 1 195 LEU 0.046 0.013 11 0 "[ . 1 . 2]" 1 196 THR 0.583 0.105 13 0 "[ . 1 . 2]" 1 197 LEU 1.017 0.143 3 0 "[ . 1 . 2]" 1 198 VAL 0.003 0.003 12 0 "[ . 1 . 2]" 1 199 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 200 ILE 0.160 0.043 8 0 "[ . 1 . 2]" 1 201 ILE 0.004 0.004 6 0 "[ . 1 . 2]" 1 203 THR 0.015 0.009 9 0 "[ . 1 . 2]" 1 204 ALA 0.015 0.009 9 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 51 LYS HA 1 51 LYS QG 4.000 . 4.000 2.842 2.041 3.433 . 0 0 "[ . 1 . 2]" 1 2 1 51 LYS QG 1 52 THR H 5.500 . 5.500 3.056 1.889 4.294 . 0 0 "[ . 1 . 2]" 1 3 1 51 LYS H 1 52 THR H 3.500 . 3.500 2.767 1.983 3.699 0.199 20 0 "[ . 1 . 2]" 1 4 1 51 LYS H 1 53 GLN H 5.000 . 5.000 3.543 2.621 4.821 . 0 0 "[ . 1 . 2]" 1 5 1 52 THR HA 1 55 ASP QB 4.200 . 4.200 2.675 2.357 2.852 . 0 0 "[ . 1 . 2]" 1 6 1 52 THR HB 1 53 GLN H 5.000 . 5.000 3.186 2.348 3.765 . 0 0 "[ . 1 . 2]" 1 7 1 52 THR MG 1 53 GLN H 5.500 . 5.500 3.937 3.679 4.170 . 0 0 "[ . 1 . 2]" 1 8 1 52 THR MG 1 92 TYR QD 6.500 . 6.500 3.567 2.491 4.770 . 0 0 "[ . 1 . 2]" 1 9 1 52 THR MG 1 92 TYR QE 6.500 . 6.500 2.781 2.090 4.248 . 0 0 "[ . 1 . 2]" 1 10 1 52 THR MG 1 138 LYS QB 4.500 . 4.500 2.601 1.874 3.339 . 0 0 "[ . 1 . 2]" 1 11 1 52 THR MG 1 138 LYS QE 6.000 . 6.000 3.106 1.901 4.262 . 0 0 "[ . 1 . 2]" 1 12 1 52 THR MG 1 138 LYS QG 4.500 . 4.500 2.947 2.007 3.339 . 0 0 "[ . 1 . 2]" 1 13 1 51 LYS QB 1 52 THR H 4.500 . 4.500 2.857 2.089 3.578 . 0 0 "[ . 1 . 2]" 1 14 1 51 LYS QE 1 52 THR H 5.500 . 5.500 4.192 3.190 4.886 . 0 0 "[ . 1 . 2]" 1 15 1 52 THR H 1 53 GLN H . . 2.800 2.686 2.532 2.804 0.004 18 0 "[ . 1 . 2]" 1 16 1 53 GLN HA 1 92 TYR QB 5.500 . 5.500 3.850 3.455 4.502 . 0 0 "[ . 1 . 2]" 1 17 1 53 GLN QB 1 54 SER H . . 3.300 2.565 2.397 2.713 . 0 0 "[ . 1 . 2]" 1 18 1 53 GLN QG 1 92 TYR QD 6.500 . 6.500 3.996 3.080 4.892 . 0 0 "[ . 1 . 2]" 1 19 1 53 GLN QG 1 93 GLY QA 6.000 . 6.000 3.790 2.687 4.654 . 0 0 "[ . 1 . 2]" 1 20 1 53 GLN H 1 54 SER H 2.800 . 2.800 2.717 2.621 2.788 . 0 0 "[ . 1 . 2]" 1 21 1 53 GLN H 1 55 ASP QB 5.500 . 5.500 4.842 4.684 4.906 . 0 0 "[ . 1 . 2]" 1 22 1 53 GLN H 1 55 ASP H 5.000 . 5.000 4.081 3.912 4.221 . 0 0 "[ . 1 . 2]" 1 23 1 54 SER QB 1 55 ASP H 5.500 . 5.500 2.894 2.516 3.408 . 0 0 "[ . 1 . 2]" 1 24 1 52 THR HA 1 54 SER H 5.000 . 5.000 4.539 4.244 4.730 . 0 0 "[ . 1 . 2]" 1 25 1 52 THR H 1 54 SER H 5.000 . 5.000 4.195 3.890 4.397 . 0 0 "[ . 1 . 2]" 1 26 1 53 GLN QG 1 54 SER H 5.500 . 5.500 4.269 3.936 4.470 . 0 0 "[ . 1 . 2]" 1 27 1 54 SER H 1 55 ASP QB 5.500 . 5.500 4.391 4.316 4.488 . 0 0 "[ . 1 . 2]" 1 28 1 54 SER H 1 55 ASP H 2.800 . 2.800 2.654 2.477 2.746 . 0 0 "[ . 1 . 2]" 1 29 1 54 SER H 1 56 LEU H 5.000 . 5.000 4.192 4.059 4.343 . 0 0 "[ . 1 . 2]" 1 30 1 55 ASP QB 1 56 LEU H . . 3.300 2.687 2.510 2.826 . 0 0 "[ . 1 . 2]" 1 31 1 55 ASP QB 1 138 LYS QE 6.000 . 6.000 3.556 2.217 4.572 . 0 0 "[ . 1 . 2]" 1 32 1 55 ASP H 1 58 LYS QB 5.500 . 5.500 4.627 4.502 4.765 . 0 0 "[ . 1 . 2]" 1 33 1 56 LEU HA 1 59 PHE QB 5.500 . 5.500 2.844 2.678 2.966 . 0 0 "[ . 1 . 2]" 1 34 1 53 GLN HA 1 56 LEU QB 4.000 . 4.000 2.957 2.607 3.190 . 0 0 "[ . 1 . 2]" 1 35 1 56 LEU QB 1 57 GLN H 5.500 . 5.500 2.295 2.175 2.453 . 0 0 "[ . 1 . 2]" 1 36 1 53 GLN HA 1 56 LEU QD 6.000 . 6.000 1.901 1.820 1.960 . 0 0 "[ . 1 . 2]" 1 37 1 53 GLN QG 1 56 LEU QD 6.500 . 6.500 2.950 2.590 3.426 . 0 0 "[ . 1 . 2]" 1 38 1 55 ASP H 1 56 LEU QD 6.000 . 6.000 4.357 4.012 4.454 . 0 0 "[ . 1 . 2]" 1 39 1 56 LEU QD 1 59 PHE QD 7.000 . 7.000 4.229 4.035 4.471 . 0 0 "[ . 1 . 2]" 1 40 1 56 LEU QD 1 85 LEU MD2 . . 5.000 1.831 1.783 1.970 0.017 6 0 "[ . 1 . 2]" 1 41 1 56 LEU QD 1 85 LEU QB 5.000 . 5.000 2.700 2.428 3.168 . 0 0 "[ . 1 . 2]" 1 42 1 56 LEU QD 1 86 LYS HA 6.000 . 6.000 4.413 4.295 4.454 . 0 0 "[ . 1 . 2]" 1 43 1 56 LEU QD 1 88 LEU MD2 5.000 . 5.000 1.946 1.811 2.180 . 0 0 "[ . 1 . 2]" 1 44 1 56 LEU QD 1 88 LEU HG 6.000 . 6.000 3.104 2.709 3.306 . 0 0 "[ . 1 . 2]" 1 45 1 56 LEU QD 1 89 ASP HA 4.500 . 4.500 1.976 1.817 2.197 . 0 0 "[ . 1 . 2]" 1 46 1 56 LEU QD 1 89 ASP QB 6.500 . 6.500 2.925 2.515 3.245 . 0 0 "[ . 1 . 2]" 1 47 1 56 LEU QD 1 89 ASP H 4.500 . 4.500 3.295 3.161 3.342 . 0 0 "[ . 1 . 2]" 1 48 1 56 LEU QD 1 92 TYR QD 5.500 . 5.500 2.286 1.801 3.135 . 0 0 "[ . 1 . 2]" 1 49 1 56 LEU QD 1 92 TYR QE 6.000 . 6.000 2.886 2.052 3.841 . 0 0 "[ . 1 . 2]" 1 50 1 56 LEU QD 1 135 GLN QG 6.500 . 6.500 3.370 2.908 4.111 . 0 0 "[ . 1 . 2]" 1 51 1 56 LEU MD2 1 88 LEU QB 5.000 . 5.000 2.410 2.166 2.585 . 0 0 "[ . 1 . 2]" 1 52 1 56 LEU H 1 56 LEU HG 5.000 . 5.000 2.541 2.347 2.642 . 0 0 "[ . 1 . 2]" 1 53 1 53 GLN HA 1 56 LEU H 3.500 . 3.500 3.504 3.494 3.512 0.012 14 0 "[ . 1 . 2]" 1 54 1 56 LEU H 1 58 LYS QB 5.500 . 5.500 4.838 4.685 4.910 . 0 0 "[ . 1 . 2]" 1 55 1 57 GLN HA 1 57 GLN QG . . 4.000 2.175 2.021 2.295 . 0 0 "[ . 1 . 2]" 1 56 1 57 GLN HA 1 60 MET QG 5.500 . 5.500 2.323 1.844 4.360 . 0 0 "[ . 1 . 2]" 1 57 1 57 GLN HA 1 60 MET H . . 4.000 3.537 3.375 3.627 . 0 0 "[ . 1 . 2]" 1 58 1 57 GLN QB 1 58 LYS H . . 3.300 2.565 2.454 2.754 . 0 0 "[ . 1 . 2]" 1 59 1 57 GLN H 1 57 GLN QG 4.000 . 4.000 3.083 2.503 3.566 . 0 0 "[ . 1 . 2]" 1 60 1 57 GLN QG 1 58 LYS H 5.500 . 5.500 4.338 4.197 4.519 . 0 0 "[ . 1 . 2]" 1 61 1 57 GLN QG 1 60 MET ME 4.500 . 4.500 2.385 1.915 3.342 . 0 0 "[ . 1 . 2]" 1 62 1 54 SER HA 1 57 GLN H 5.000 . 5.000 3.711 3.508 3.990 . 0 0 "[ . 1 . 2]" 1 63 1 56 LEU HG 1 57 GLN H 4.500 . 4.500 4.496 4.380 4.529 0.029 14 0 "[ . 1 . 2]" 1 64 1 57 GLN HA 1 58 LYS HA 5.000 . 5.000 4.784 4.748 4.811 . 0 0 "[ . 1 . 2]" 1 65 1 58 LYS HA 1 58 LYS QG . . 4.000 2.211 2.012 3.206 . 0 0 "[ . 1 . 2]" 1 66 1 58 LYS QB 1 58 LYS QE . . 3.800 2.474 1.976 3.019 . 0 0 "[ . 1 . 2]" 1 67 1 58 LYS H 1 58 LYS QB 3.300 . 3.300 2.067 2.027 2.171 . 0 0 "[ . 1 . 2]" 1 68 1 58 LYS QB 1 59 PHE H . . 3.300 2.764 2.448 2.941 . 0 0 "[ . 1 . 2]" 1 69 1 58 LYS HA 1 58 LYS QD 4.000 . 4.000 3.122 1.997 3.569 . 0 0 "[ . 1 . 2]" 1 70 1 58 LYS QD 1 62 GLN QE 6.000 . 6.000 2.950 1.966 4.763 . 0 0 "[ . 1 . 2]" 1 71 1 58 LYS H 1 58 LYS QG 4.000 . 4.000 3.370 2.896 3.616 . 0 0 "[ . 1 . 2]" 1 72 1 57 GLN H 1 58 LYS H 2.800 . 2.800 2.777 2.702 2.814 0.014 14 0 "[ . 1 . 2]" 1 73 1 58 LYS H 1 59 PHE H 3.500 . 3.500 2.699 2.566 2.825 . 0 0 "[ . 1 . 2]" 1 74 1 58 LYS H 1 60 MET H 5.000 . 5.000 4.126 3.927 4.204 . 0 0 "[ . 1 . 2]" 1 75 1 59 PHE QB 1 60 MET H . . 4.000 2.792 2.578 2.877 . 0 0 "[ . 1 . 2]" 1 76 1 59 PHE H 1 59 PHE QD 5.000 . 5.000 4.170 4.143 4.184 . 0 0 "[ . 1 . 2]" 1 77 1 59 PHE QD 1 63 LEU MD2 6.000 . 6.000 3.041 2.435 3.689 . 0 0 "[ . 1 . 2]" 1 78 1 59 PHE QD 1 85 LEU MD1 5.000 . 5.000 2.147 1.968 2.483 . 0 0 "[ . 1 . 2]" 1 79 1 59 PHE QD 1 135 GLN QG 5.500 . 5.500 2.253 1.956 3.028 . 0 0 "[ . 1 . 2]" 1 80 1 59 PHE QE 1 63 LEU MD2 . . 6.000 2.488 1.940 2.868 . 0 0 "[ . 1 . 2]" 1 81 1 59 PHE QE 1 85 LEU MD1 . . 5.000 3.139 2.849 3.413 . 0 0 "[ . 1 . 2]" 1 82 1 59 PHE QE 1 128 ILE HA 6.000 . 6.000 2.620 2.207 3.182 . 0 0 "[ . 1 . 2]" 1 83 1 59 PHE QE 1 132 LEU QD . . 5.500 1.931 1.799 2.232 0.001 2 0 "[ . 1 . 2]" 1 84 1 59 PHE QE 1 132 LEU HG 6.000 . 6.000 3.248 2.652 4.413 . 0 0 "[ . 1 . 2]" 1 85 1 55 ASP HA 1 59 PHE H 5.000 . 5.000 3.848 3.431 4.197 . 0 0 "[ . 1 . 2]" 1 86 1 57 GLN H 1 59 PHE H 5.000 . 5.000 4.141 3.963 4.396 . 0 0 "[ . 1 . 2]" 1 87 1 58 LYS QD 1 59 PHE H 5.500 . 5.500 4.738 4.396 4.907 . 0 0 "[ . 1 . 2]" 1 88 1 58 LYS QE 1 59 PHE H 5.500 . 5.500 4.669 4.055 4.902 . 0 0 "[ . 1 . 2]" 1 89 1 58 LYS QG 1 59 PHE H 5.500 . 5.500 4.430 2.747 4.593 . 0 0 "[ . 1 . 2]" 1 90 1 59 PHE H 1 60 MET QB 5.500 . 5.500 4.808 4.353 4.915 . 0 0 "[ . 1 . 2]" 1 91 1 59 PHE H 1 60 MET H 2.800 . 2.800 2.614 2.506 2.744 . 0 0 "[ . 1 . 2]" 1 92 1 59 PHE H 1 62 GLN H . . 5.000 4.782 4.705 4.938 . 0 0 "[ . 1 . 2]" 1 93 1 59 PHE HZ 1 132 LEU H 5.000 . 5.000 2.537 2.078 2.856 . 0 0 "[ . 1 . 2]" 1 94 1 60 MET HA 1 60 MET QG 4.000 . 4.000 2.573 2.200 3.119 . 0 0 "[ . 1 . 2]" 1 95 1 60 MET HA 1 63 LEU QB 5.500 . 5.500 3.727 3.386 3.849 . 0 0 "[ . 1 . 2]" 1 96 1 60 MET HA 1 63 LEU MD1 4.500 . 4.500 2.542 1.981 2.873 . 0 0 "[ . 1 . 2]" 1 97 1 60 MET HA 1 63 LEU MD2 5.500 . 5.500 3.900 3.379 4.357 . 0 0 "[ . 1 . 2]" 1 98 1 60 MET HA 1 85 LEU MD1 5.500 . 5.500 2.377 1.890 2.504 . 0 0 "[ . 1 . 2]" 1 99 1 60 MET HA 1 85 LEU MD2 5.500 . 5.500 4.555 3.860 4.604 . 0 0 "[ . 1 . 2]" 1 100 1 57 GLN HA 1 60 MET QB 4.000 . 4.000 3.323 2.585 3.569 . 0 0 "[ . 1 . 2]" 1 101 1 60 MET QB 1 61 THR H . . 3.300 2.214 2.113 2.962 . 0 0 "[ . 1 . 2]" 1 102 1 60 MET QB 1 82 LEU QD 6.500 . 6.500 3.503 3.247 4.315 . 0 0 "[ . 1 . 2]" 1 103 1 60 MET QB 1 86 LYS QB 6.000 . 6.000 4.510 4.244 4.779 . 0 0 "[ . 1 . 2]" 1 104 1 60 MET H 1 60 MET ME 5.500 . 5.500 4.131 3.844 4.440 . 0 0 "[ . 1 . 2]" 1 105 1 60 MET ME 1 85 LEU QB 4.500 . 4.500 2.830 2.082 3.347 . 0 0 "[ . 1 . 2]" 1 106 1 60 MET ME 1 86 LYS HA 4.000 . 4.000 2.127 1.813 3.341 . 0 0 "[ . 1 . 2]" 1 107 1 60 MET ME 1 86 LYS QG 4.500 . 4.500 3.332 3.210 3.349 . 0 0 "[ . 1 . 2]" 1 108 1 60 MET ME 1 86 LYS H 4.000 . 4.000 3.016 2.103 3.334 . 0 0 "[ . 1 . 2]" 1 109 1 60 MET H 1 60 MET QG 4.000 . 4.000 2.230 1.805 3.647 . 0 0 "[ . 1 . 2]" 1 110 1 60 MET QG 1 63 LEU HG 5.500 . 5.500 4.609 4.108 4.875 . 0 0 "[ . 1 . 2]" 1 111 1 60 MET QG 1 82 LEU QB 5.500 . 5.500 3.245 1.742 3.688 0.058 19 0 "[ . 1 . 2]" 1 112 1 60 MET QG 1 85 LEU QB 6.000 . 6.000 2.267 1.755 3.899 0.045 11 0 "[ . 1 . 2]" 1 113 1 60 MET QG 1 85 LEU MD1 6.000 . 6.000 2.113 1.818 3.744 . 0 0 "[ . 1 . 2]" 1 114 1 60 MET QG 1 85 LEU MD2 6.500 . 6.500 3.508 3.185 4.851 . 0 0 "[ . 1 . 2]" 1 115 1 57 GLN H 1 60 MET H 5.000 . 5.000 4.859 4.725 4.950 . 0 0 "[ . 1 . 2]" 1 116 1 59 PHE QD 1 60 MET H 6.000 . 6.000 4.356 4.059 4.459 . 0 0 "[ . 1 . 2]" 1 117 1 60 MET H 1 61 THR H . . 2.800 2.816 2.803 2.848 0.048 20 0 "[ . 1 . 2]" 1 118 1 60 MET H 1 63 LEU HG 5.000 . 5.000 4.528 4.228 4.742 . 0 0 "[ . 1 . 2]" 1 119 1 60 MET H 1 85 LEU MD1 5.500 . 5.500 3.261 2.888 3.605 . 0 0 "[ . 1 . 2]" 1 120 1 60 MET H 1 85 LEU MD2 5.500 . 5.500 4.072 2.897 4.377 . 0 0 "[ . 1 . 2]" 1 121 1 61 THR HA 1 61 THR MG 3.300 . 3.300 2.399 2.317 2.465 . 0 0 "[ . 1 . 2]" 1 122 1 61 THR HA 1 64 ASP QB 4.000 . 4.000 3.168 2.987 3.309 . 0 0 "[ . 1 . 2]" 1 123 1 61 THR HA 1 64 ASP H . . 4.000 3.675 3.555 3.782 . 0 0 "[ . 1 . 2]" 1 124 1 61 THR HB 1 62 GLN H . . 3.500 3.098 2.914 3.250 . 0 0 "[ . 1 . 2]" 1 125 1 61 THR MG 1 62 GLN HA 5.500 . 5.500 3.962 3.794 4.279 . 0 0 "[ . 1 . 2]" 1 126 1 61 THR MG 1 62 GLN H . . 5.000 3.941 3.762 4.111 . 0 0 "[ . 1 . 2]" 1 127 1 61 THR MG 1 64 ASP QB 6.000 . 6.000 3.790 3.418 4.032 . 0 0 "[ . 1 . 2]" 1 128 1 61 THR MG 1 65 HIS HD2 5.500 . 5.500 2.976 1.994 3.721 . 0 0 "[ . 1 . 2]" 1 129 1 61 THR MG 1 65 HIS HE1 5.500 . 5.500 3.301 2.418 4.179 . 0 0 "[ . 1 . 2]" 1 130 1 58 LYS HA 1 61 THR H 5.000 . 5.000 3.756 3.695 3.828 . 0 0 "[ . 1 . 2]" 1 131 1 59 PHE HA 1 61 THR H 5.000 . 5.000 4.739 4.640 4.812 . 0 0 "[ . 1 . 2]" 1 132 1 61 THR H 1 62 GLN H . . 2.800 2.631 2.600 2.658 . 0 0 "[ . 1 . 2]" 1 133 1 62 GLN HA 1 62 GLN QG . . 3.500 2.202 2.031 2.387 . 0 0 "[ . 1 . 2]" 1 134 1 62 GLN HA 1 65 HIS QB . . 5.000 2.695 2.584 2.894 . 0 0 "[ . 1 . 2]" 1 135 1 59 PHE QD 1 62 GLN QB 6.500 . 6.500 2.331 2.139 2.799 . 0 0 "[ . 1 . 2]" 1 136 1 62 GLN QB 1 63 LEU H . . 3.500 2.826 2.735 2.896 . 0 0 "[ . 1 . 2]" 1 137 1 62 GLN QB 1 128 ILE MD 6.000 . 6.000 4.316 3.755 4.463 . 0 0 "[ . 1 . 2]" 1 138 1 58 LYS HA 1 62 GLN QE 5.500 . 5.500 4.173 3.506 4.898 . 0 0 "[ . 1 . 2]" 1 139 1 58 LYS QB 1 62 GLN QE 6.000 . 6.000 2.760 1.975 4.038 . 0 0 "[ . 1 . 2]" 1 140 1 59 PHE QD 1 62 GLN QG 6.500 . 6.500 3.645 2.840 4.093 . 0 0 "[ . 1 . 2]" 1 141 1 62 GLN QG 1 63 LEU H 5.500 . 5.500 4.480 4.350 4.568 . 0 0 "[ . 1 . 2]" 1 142 1 62 GLN QG 1 66 LEU QD 5.000 . 5.000 2.507 1.937 3.075 . 0 0 "[ . 1 . 2]" 1 143 1 59 PHE HA 1 62 GLN H 4.000 . 4.000 3.333 3.220 3.432 . 0 0 "[ . 1 . 2]" 1 144 1 60 MET HA 1 62 GLN H 5.000 . 5.000 3.870 3.722 4.018 . 0 0 "[ . 1 . 2]" 1 145 1 60 MET QG 1 62 GLN H 5.500 . 5.500 4.910 4.211 5.005 . 0 0 "[ . 1 . 2]" 1 146 1 62 GLN H 1 63 LEU QB 5.500 . 5.500 4.765 4.544 4.904 . 0 0 "[ . 1 . 2]" 1 147 1 62 GLN H 1 63 LEU HG 5.000 . 5.000 3.801 3.633 4.174 . 0 0 "[ . 1 . 2]" 1 148 1 62 GLN H 1 64 ASP H 5.000 . 5.000 4.481 4.225 4.612 . 0 0 "[ . 1 . 2]" 1 149 1 63 LEU HA 1 63 LEU MD2 3.300 . 3.300 2.066 1.939 2.287 . 0 0 "[ . 1 . 2]" 1 150 1 63 LEU HA 1 65 HIS H 5.000 . 5.000 4.112 4.011 4.231 . 0 0 "[ . 1 . 2]" 1 151 1 63 LEU HA 1 66 LEU H . . 3.500 3.513 3.505 3.529 0.029 12 0 "[ . 1 . 2]" 1 152 1 63 LEU HA 1 128 ILE MD 4.000 . 4.000 2.902 2.488 3.271 . 0 0 "[ . 1 . 2]" 1 153 1 63 LEU QB 1 64 ASP HA 5.500 . 5.500 3.712 3.662 3.762 . 0 0 "[ . 1 . 2]" 1 154 1 63 LEU QB 1 64 ASP H . . 4.000 2.132 2.007 2.326 . 0 0 "[ . 1 . 2]" 1 155 1 63 LEU QB 1 78 ILE MG 4.500 . 4.500 2.634 2.302 3.018 . 0 0 "[ . 1 . 2]" 1 156 1 59 PHE QE 1 63 LEU MD1 6.500 . 6.500 3.846 3.493 4.099 . 0 0 "[ . 1 . 2]" 1 157 1 63 LEU MD1 1 64 ASP H 5.500 . 5.500 4.117 3.929 4.287 . 0 0 "[ . 1 . 2]" 1 158 1 63 LEU MD1 1 81 VAL HB 5.500 . 5.500 1.940 1.862 2.035 . 0 0 "[ . 1 . 2]" 1 159 1 63 LEU MD1 1 82 LEU QB 6.000 . 6.000 1.957 1.895 2.150 . 0 0 "[ . 1 . 2]" 1 160 1 63 LEU MD1 1 82 LEU H . . 4.500 2.159 2.121 2.193 . 0 0 "[ . 1 . 2]" 1 161 1 63 LEU MD1 1 85 LEU MD1 4.500 . 4.500 2.104 1.920 2.242 . 0 0 "[ . 1 . 2]" 1 162 1 59 PHE HZ 1 63 LEU MD2 5.500 . 5.500 2.793 2.515 3.030 . 0 0 "[ . 1 . 2]" 1 163 1 62 GLN QB 1 63 LEU MD2 6.000 . 6.000 3.022 2.746 3.542 . 0 0 "[ . 1 . 2]" 1 164 1 63 LEU H 1 63 LEU MD2 4.000 . 4.000 2.827 2.547 3.218 . 0 0 "[ . 1 . 2]" 1 165 1 63 LEU MD2 1 64 ASP H 5.500 . 5.500 4.394 4.291 4.491 . 0 0 "[ . 1 . 2]" 1 166 1 63 LEU MD2 1 82 LEU H 5.500 . 5.500 4.586 4.582 4.592 . 0 0 "[ . 1 . 2]" 1 167 1 63 LEU MD2 1 128 ILE HA 4.500 . 4.500 3.043 2.886 3.426 . 0 0 "[ . 1 . 2]" 1 168 1 63 LEU MD2 1 128 ILE MG . . 5.000 2.388 2.005 2.838 . 0 0 "[ . 1 . 2]" 1 169 1 60 MET HA 1 63 LEU HG 5.000 . 5.000 2.474 2.060 2.799 . 0 0 "[ . 1 . 2]" 1 170 1 63 LEU H 1 63 LEU HG 5.000 . 5.000 2.017 1.928 2.368 . 0 0 "[ . 1 . 2]" 1 171 1 63 LEU HG 1 64 ASP H 5.000 . 5.000 3.780 3.550 4.195 . 0 0 "[ . 1 . 2]" 1 172 1 60 MET HA 1 63 LEU H 3.500 . 3.500 3.472 3.384 3.518 0.018 17 0 "[ . 1 . 2]" 1 173 1 60 MET H 1 63 LEU H 5.000 . 5.000 4.887 4.819 4.924 . 0 0 "[ . 1 . 2]" 1 174 1 61 THR HA 1 63 LEU H 5.000 . 5.000 4.116 3.988 4.181 . 0 0 "[ . 1 . 2]" 1 175 1 62 GLN H 1 63 LEU H 2.800 . 2.800 2.502 2.435 2.594 . 0 0 "[ . 1 . 2]" 1 176 1 63 LEU H 1 64 ASP H 2.800 . 2.800 2.774 2.682 2.805 0.005 18 0 "[ . 1 . 2]" 1 177 1 64 ASP HA 1 67 ILE MG 5.500 . 5.500 4.441 4.155 4.585 . 0 0 "[ . 1 . 2]" 1 178 1 64 ASP HA 1 78 ILE MD 5.500 . 5.500 2.763 2.179 3.184 . 0 0 "[ . 1 . 2]" 1 179 1 64 ASP H 1 64 ASP QB 3.300 . 3.300 2.117 2.046 2.249 . 0 0 "[ . 1 . 2]" 1 180 1 64 ASP QB 1 65 HIS H . . 4.000 2.871 2.745 2.960 . 0 0 "[ . 1 . 2]" 1 181 1 64 ASP QB 1 82 LEU QD 5.000 . 5.000 2.946 2.544 3.261 . 0 0 "[ . 1 . 2]" 1 182 1 64 ASP QB 1 78 ILE MD 6.000 . 6.000 3.931 3.490 4.317 . 0 0 "[ . 1 . 2]" 1 183 1 60 MET HA 1 64 ASP H 5.000 . 5.000 4.712 4.629 4.795 . 0 0 "[ . 1 . 2]" 1 184 1 64 ASP H 1 65 HIS H 2.800 . 2.800 2.755 2.653 2.801 0.001 18 0 "[ . 1 . 2]" 1 185 1 65 HIS QB 1 66 LEU HA 5.500 . 5.500 3.821 3.788 3.850 . 0 0 "[ . 1 . 2]" 1 186 1 65 HIS QB 1 66 LEU QD 6.500 . 6.500 3.860 2.534 4.035 . 0 0 "[ . 1 . 2]" 1 187 1 65 HIS QB 1 66 LEU H 4.000 . 4.000 2.517 2.414 2.634 . 0 0 "[ . 1 . 2]" 1 188 1 61 THR HG1 1 65 HIS HD2 5.500 . 5.500 2.969 1.993 3.711 . 0 0 "[ . 1 . 2]" 1 189 1 64 ASP H 1 65 HIS HD2 5.000 . 5.000 4.480 4.295 4.771 . 0 0 "[ . 1 . 2]" 1 190 1 65 HIS HD2 1 66 LEU H 5.000 . 5.000 4.944 4.758 5.001 0.001 7 0 "[ . 1 . 2]" 1 191 1 61 THR MG 1 65 HIS H 5.000 . 5.000 4.133 4.030 4.173 . 0 0 "[ . 1 . 2]" 1 192 1 62 GLN HA 1 65 HIS H 5.000 . 5.000 3.660 3.547 3.758 . 0 0 "[ . 1 . 2]" 1 193 1 63 LEU H 1 65 HIS H 5.000 . 5.000 3.835 3.720 3.951 . 0 0 "[ . 1 . 2]" 1 194 1 65 HIS H 1 66 LEU H . . 2.800 2.434 2.387 2.473 . 0 0 "[ . 1 . 2]" 1 195 1 66 LEU HA 1 66 LEU QD . . 3.800 2.192 1.952 2.530 . 0 0 "[ . 1 . 2]" 1 196 1 63 LEU HA 1 66 LEU QB . . 4.000 2.615 2.400 2.754 . 0 0 "[ . 1 . 2]" 1 197 1 65 HIS H 1 66 LEU QB 5.500 . 5.500 4.246 4.181 4.360 . 0 0 "[ . 1 . 2]" 1 198 1 66 LEU QB 1 67 ILE MD 6.000 . 6.000 2.318 2.234 2.458 . 0 0 "[ . 1 . 2]" 1 199 1 66 LEU H 1 66 LEU QD . . 5.000 3.119 1.965 3.300 . 0 0 "[ . 1 . 2]" 1 200 1 66 LEU QD 1 127 GLU QG 6.500 . 6.500 2.080 1.684 2.783 0.116 17 0 "[ . 1 . 2]" 1 201 1 62 GLN QB 1 66 LEU HG 5.500 . 5.500 3.641 3.215 4.124 . 0 0 "[ . 1 . 2]" 1 202 1 63 LEU HA 1 66 LEU HG 5.000 . 5.000 4.463 4.005 4.865 . 0 0 "[ . 1 . 2]" 1 203 1 66 LEU H 1 66 LEU HG 3.500 . 3.500 2.672 2.445 3.522 0.022 16 0 "[ . 1 . 2]" 1 204 1 66 LEU HG 1 127 GLU QB 5.500 . 5.500 4.329 2.756 4.910 . 0 0 "[ . 1 . 2]" 1 205 1 64 ASP HA 1 66 LEU H 5.000 . 5.000 4.887 4.787 5.009 0.009 16 0 "[ . 1 . 2]" 1 206 1 67 ILE HA 1 67 ILE QG 4.000 . 4.000 2.218 2.165 2.323 . 0 0 "[ . 1 . 2]" 1 207 1 64 ASP HA 1 67 ILE HB 4.000 . 4.000 3.470 3.278 3.719 . 0 0 "[ . 1 . 2]" 1 208 1 67 ILE H 1 67 ILE HB 2.800 . 2.800 2.339 2.299 2.374 . 0 0 "[ . 1 . 2]" 1 209 1 67 ILE HB 1 68 LYS H 3.500 . 3.500 2.606 2.454 2.896 . 0 0 "[ . 1 . 2]" 1 210 1 67 ILE HB 1 75 GLN QG 5.500 . 5.500 3.668 3.188 4.118 . 0 0 "[ . 1 . 2]" 1 211 1 63 LEU HA 1 67 ILE MD 4.000 . 4.000 2.415 2.190 2.583 . 0 0 "[ . 1 . 2]" 1 212 1 63 LEU QB 1 67 ILE MD 4.500 . 4.500 2.578 2.294 3.118 . 0 0 "[ . 1 . 2]" 1 213 1 63 LEU MD1 1 67 ILE MD 6.000 . 6.000 4.075 3.890 4.172 . 0 0 "[ . 1 . 2]" 1 214 1 67 ILE HA 1 67 ILE MD 4.000 . 4.000 2.932 2.571 3.138 . 0 0 "[ . 1 . 2]" 1 215 1 67 ILE HB 1 67 ILE MD 3.300 . 3.300 2.322 2.269 2.411 . 0 0 "[ . 1 . 2]" 1 216 1 67 ILE H 1 67 ILE MD 5.500 . 5.500 1.961 1.899 2.094 . 0 0 "[ . 1 . 2]" 1 217 1 67 ILE MD 1 125 GLU QG 5.500 . 5.500 3.327 2.726 4.084 . 0 0 "[ . 1 . 2]" 1 218 1 67 ILE H 1 67 ILE QG 4.000 . 4.000 3.334 3.211 3.483 . 0 0 "[ . 1 . 2]" 1 219 1 67 ILE QG 1 74 THR MG 6.000 . 6.000 2.240 1.888 3.536 . 0 0 "[ . 1 . 2]" 1 220 1 67 ILE QG 1 125 GLU QG 6.000 . 6.000 3.166 2.721 3.931 . 0 0 "[ . 1 . 2]" 1 221 1 67 ILE MG 1 68 LYS H 4.000 . 4.000 3.027 2.821 3.334 . 0 0 "[ . 1 . 2]" 1 222 1 67 ILE MG 1 74 THR H 5.500 . 5.500 3.673 3.427 3.854 . 0 0 "[ . 1 . 2]" 1 223 1 67 ILE MG 1 75 GLN QG . . 4.500 2.057 1.836 2.450 . 0 0 "[ . 1 . 2]" 1 224 1 64 ASP H 1 67 ILE H 5.000 . 5.000 4.936 4.854 5.006 0.006 6 0 "[ . 1 . 2]" 1 225 1 65 HIS HA 1 67 ILE H 5.000 . 5.000 4.477 4.317 4.753 . 0 0 "[ . 1 . 2]" 1 226 1 67 ILE H 1 68 LYS H 2.800 . 2.800 2.604 2.448 2.807 0.007 11 0 "[ . 1 . 2]" 1 227 1 68 LYS HA 1 68 LYS QG . . 4.000 2.251 2.044 2.664 . 0 0 "[ . 1 . 2]" 1 228 1 67 ILE HB 1 68 LYS QB 5.500 . 5.500 4.511 4.109 4.736 . 0 0 "[ . 1 . 2]" 1 229 1 67 ILE H 1 68 LYS QB 5.500 . 5.500 4.272 4.149 4.544 . 0 0 "[ . 1 . 2]" 1 230 1 68 LYS H 1 68 LYS QG 4.000 . 4.000 2.942 2.440 3.575 . 0 0 "[ . 1 . 2]" 1 231 1 65 HIS HA 1 68 LYS H 5.000 . 5.000 3.713 3.421 4.119 . 0 0 "[ . 1 . 2]" 1 232 1 65 HIS H 1 68 LYS H 5.000 . 5.000 4.579 4.366 4.773 . 0 0 "[ . 1 . 2]" 1 233 1 68 LYS H 1 69 ASP QB 5.500 . 5.500 4.683 4.549 4.867 . 0 0 "[ . 1 . 2]" 1 234 1 68 LYS H 1 75 GLN QG 5.500 . 5.500 4.480 3.858 4.906 . 0 0 "[ . 1 . 2]" 1 235 1 69 ASP H 1 69 ASP QB . . 3.500 2.283 2.153 2.359 . 0 0 "[ . 1 . 2]" 1 236 1 69 ASP QB 1 70 ASP H 5.500 . 5.500 3.027 2.882 3.442 . 0 0 "[ . 1 . 2]" 1 237 1 65 HIS HA 1 69 ASP H 5.000 . 5.000 4.378 4.112 4.518 . 0 0 "[ . 1 . 2]" 1 238 1 68 LYS QB 1 69 ASP H 3.300 . 3.300 2.921 2.877 2.944 . 0 0 "[ . 1 . 2]" 1 239 1 68 LYS QG 1 69 ASP H 5.500 . 5.500 4.498 4.363 4.561 . 0 0 "[ . 1 . 2]" 1 240 1 69 ASP H 1 70 ASP QB 5.500 . 5.500 4.046 3.793 4.507 . 0 0 "[ . 1 . 2]" 1 241 1 69 ASP H 1 70 ASP H 3.500 . 3.500 2.209 2.083 2.437 . 0 0 "[ . 1 . 2]" 1 242 1 69 ASP QB 1 70 ASP QB 6.000 . 6.000 4.026 3.625 4.420 . 0 0 "[ . 1 . 2]" 1 243 1 70 ASP H 1 70 ASP QB 3.500 . 3.500 2.308 2.149 2.599 . 0 0 "[ . 1 . 2]" 1 244 1 70 ASP QB 1 71 ILE H . . 4.000 2.005 1.926 2.133 . 0 0 "[ . 1 . 2]" 1 245 1 70 ASP QB 1 125 GLU QG 6.000 . 6.000 4.063 3.299 4.764 . 0 0 "[ . 1 . 2]" 1 246 1 67 ILE HA 1 70 ASP H 3.500 . 3.500 2.903 2.752 3.163 . 0 0 "[ . 1 . 2]" 1 247 1 70 ASP H 1 71 ILE H 2.800 . 2.800 2.745 2.425 2.811 0.011 16 0 "[ . 1 . 2]" 1 248 1 71 ILE H 1 71 ILE HB 3.500 . 3.500 3.029 2.634 3.203 . 0 0 "[ . 1 . 2]" 1 249 1 71 ILE H 1 71 ILE QG . . 3.500 2.426 1.922 2.914 . 0 0 "[ . 1 . 2]" 1 250 1 71 ILE MG 1 73 ASN QB 4.500 . 4.500 3.102 2.551 3.342 . 0 0 "[ . 1 . 2]" 1 251 1 67 ILE QG 1 71 ILE H 4.500 . 4.500 3.729 3.384 3.989 . 0 0 "[ . 1 . 2]" 1 252 1 68 LYS HA 1 72 SER QB 5.500 . 5.500 4.670 4.267 4.905 . 0 0 "[ . 1 . 2]" 1 253 1 71 ILE HB 1 72 SER H 3.500 . 3.500 2.592 2.148 3.484 . 0 0 "[ . 1 . 2]" 1 254 1 71 ILE MG 1 72 SER H 3.300 . 3.300 1.928 1.845 2.003 . 0 0 "[ . 1 . 2]" 1 255 1 71 ILE QG 1 72 SER H 5.500 . 5.500 4.071 3.929 4.383 . 0 0 "[ . 1 . 2]" 1 256 1 72 SER H 1 73 ASN QD 5.500 . 5.500 4.076 2.755 4.919 . 0 0 "[ . 1 . 2]" 1 257 1 72 SER H 1 75 GLN QG 5.500 . 5.500 4.471 4.153 4.885 . 0 0 "[ . 1 . 2]" 1 258 1 74 THR HA 1 77 ILE MD . . 5.000 3.998 1.956 4.167 . 0 0 "[ . 1 . 2]" 1 259 1 67 ILE MG 1 74 THR MG 4.500 . 4.500 2.284 1.878 3.128 . 0 0 "[ . 1 . 2]" 1 260 1 74 THR MG 1 75 GLN H . . 5.000 3.066 2.647 4.111 . 0 0 "[ . 1 . 2]" 1 261 1 71 ILE HB 1 74 THR H 5.000 . 5.000 3.077 2.864 4.074 . 0 0 "[ . 1 . 2]" 1 262 1 71 ILE QG 1 74 THR H 5.500 . 5.500 4.661 4.379 4.904 . 0 0 "[ . 1 . 2]" 1 263 1 72 SER QB 1 74 THR H 5.500 . 5.500 4.694 4.464 4.905 . 0 0 "[ . 1 . 2]" 1 264 1 73 ASN QB 1 74 THR H 4.500 . 4.500 2.996 2.729 3.623 . 0 0 "[ . 1 . 2]" 1 265 1 73 ASN QD 1 74 THR H 5.500 . 5.500 4.080 1.961 4.890 . 0 0 "[ . 1 . 2]" 1 266 1 74 THR H 1 75 GLN QB 5.500 . 5.500 4.528 4.342 4.632 . 0 0 "[ . 1 . 2]" 1 267 1 74 THR H 1 75 GLN H 3.500 . 3.500 2.542 2.320 2.700 . 0 0 "[ . 1 . 2]" 1 268 1 67 ILE MG 1 75 GLN HA 4.000 . 4.000 2.606 2.175 2.983 . 0 0 "[ . 1 . 2]" 1 269 1 75 GLN HA 1 75 GLN QG 4.000 . 4.000 2.249 2.104 2.454 . 0 0 "[ . 1 . 2]" 1 270 1 75 GLN HA 1 78 ILE MD . . 3.300 2.126 1.918 2.463 . 0 0 "[ . 1 . 2]" 1 271 1 75 GLN HA 1 78 ILE QG 5.500 . 5.500 2.164 1.993 2.290 . 0 0 "[ . 1 . 2]" 1 272 1 67 ILE MG 1 75 GLN QB 6.000 . 6.000 3.692 3.382 3.970 . 0 0 "[ . 1 . 2]" 1 273 1 75 GLN QB 1 78 ILE MD 6.000 . 6.000 3.267 2.857 3.528 . 0 0 "[ . 1 . 2]" 1 274 1 68 LYS QG 1 75 GLN QG 6.000 . 6.000 3.793 3.072 4.357 . 0 0 "[ . 1 . 2]" 1 275 1 74 THR H 1 75 GLN QG 5.500 . 5.500 4.268 3.990 4.557 . 0 0 "[ . 1 . 2]" 1 276 1 75 GLN H 1 75 GLN QG 4.000 . 4.000 2.621 2.420 2.788 . 0 0 "[ . 1 . 2]" 1 277 1 75 GLN QG 1 78 ILE MD 6.000 . 6.000 3.177 2.733 3.823 . 0 0 "[ . 1 . 2]" 1 278 1 73 ASN QB 1 75 GLN H 5.500 . 5.500 4.537 4.373 4.895 . 0 0 "[ . 1 . 2]" 1 279 1 76 GLU HA 1 79 LYS H 5.000 . 5.000 3.635 3.568 3.720 . 0 0 "[ . 1 . 2]" 1 280 1 76 GLU QB 1 77 ILE QG 6.000 . 6.000 4.132 3.932 4.466 . 0 0 "[ . 1 . 2]" 1 281 1 76 GLU QB 1 77 ILE H 4.000 . 4.000 3.415 3.356 3.436 . 0 0 "[ . 1 . 2]" 1 282 1 76 GLU H 1 76 GLU QG 4.000 . 4.000 2.023 1.924 2.138 . 0 0 "[ . 1 . 2]" 1 283 1 76 GLU QG 1 77 ILE MD 6.000 . 6.000 2.583 1.988 3.509 . 0 0 "[ . 1 . 2]" 1 284 1 76 GLU QG 1 77 ILE H . . 3.500 2.041 1.936 2.145 . 0 0 "[ . 1 . 2]" 1 285 1 74 THR HA 1 76 GLU H 5.000 . 5.000 3.542 3.388 3.840 . 0 0 "[ . 1 . 2]" 1 286 1 75 GLN QB 1 76 GLU H 4.000 . 4.000 2.830 2.639 2.922 . 0 0 "[ . 1 . 2]" 1 287 1 75 GLN H 1 76 GLU H 2.800 . 2.800 2.813 2.800 2.832 0.032 4 0 "[ . 1 . 2]" 1 288 1 76 GLU H 1 77 ILE HB 5.000 . 5.000 4.832 4.513 5.004 0.004 12 0 "[ . 1 . 2]" 1 289 1 76 GLU H 1 77 ILE H 2.800 . 2.800 2.505 2.422 2.658 . 0 0 "[ . 1 . 2]" 1 290 1 76 GLU H 1 79 LYS H 5.000 . 5.000 4.568 4.508 4.671 . 0 0 "[ . 1 . 2]" 1 291 1 77 ILE HA 1 77 ILE MD 4.000 . 4.000 2.173 1.970 3.344 . 0 0 "[ . 1 . 2]" 1 292 1 77 ILE HA 1 77 ILE QG 4.000 . 4.000 2.893 2.132 3.052 . 0 0 "[ . 1 . 2]" 1 293 1 77 ILE HA 1 80 ASP QB 5.500 . 5.500 3.358 3.145 3.669 . 0 0 "[ . 1 . 2]" 1 294 1 77 ILE HA 1 80 ASP H . . 3.500 3.549 3.524 3.568 0.068 16 0 "[ . 1 . 2]" 1 295 1 77 ILE H 1 77 ILE HB 2.800 . 2.800 2.601 2.343 2.649 . 0 0 "[ . 1 . 2]" 1 296 1 77 ILE HB 1 78 ILE H 3.500 . 3.500 2.172 2.113 2.386 . 0 0 "[ . 1 . 2]" 1 297 1 77 ILE H 1 77 ILE MD 5.000 . 5.000 3.168 2.279 3.844 . 0 0 "[ . 1 . 2]" 1 298 1 77 ILE MD 1 117 GLU QB 4.500 . 4.500 2.558 2.137 3.065 . 0 0 "[ . 1 . 2]" 1 299 1 77 ILE MD 1 118 MET HA 5.000 . 5.000 3.991 3.220 4.168 . 0 0 "[ . 1 . 2]" 1 300 1 77 ILE MD 1 118 MET H 5.500 . 5.500 4.542 4.379 4.590 . 0 0 "[ . 1 . 2]" 1 301 1 76 GLU QG 1 77 ILE QG 5.500 . 5.500 2.232 2.030 2.947 . 0 0 "[ . 1 . 2]" 1 302 1 77 ILE H 1 77 ILE QG . . 3.500 2.038 1.956 3.103 . 0 0 "[ . 1 . 2]" 1 303 1 77 ILE QG 1 78 ILE H 5.000 . 5.000 3.744 3.679 4.293 . 0 0 "[ . 1 . 2]" 1 304 1 74 THR HA 1 77 ILE MG 5.500 . 5.500 4.591 4.582 4.596 . 0 0 "[ . 1 . 2]" 1 305 1 77 ILE MG 1 78 ILE HA 5.500 . 5.500 3.416 2.949 3.539 . 0 0 "[ . 1 . 2]" 1 306 1 77 ILE MG 1 78 ILE H 4.000 . 4.000 3.185 2.717 3.283 . 0 0 "[ . 1 . 2]" 1 307 1 77 ILE MG 1 114 SER QB . . 4.500 3.113 2.566 3.339 . 0 0 "[ . 1 . 2]" 1 308 1 77 ILE MG 1 117 GLU QB . . 4.500 3.053 2.620 3.341 . 0 0 "[ . 1 . 2]" 1 309 1 77 ILE MG 1 118 MET H 5.500 . 5.500 3.389 2.795 4.017 . 0 0 "[ . 1 . 2]" 1 310 1 74 THR HA 1 77 ILE H 3.500 . 3.500 3.054 2.971 3.180 . 0 0 "[ . 1 . 2]" 1 311 1 77 ILE H 1 78 ILE MD 5.500 . 5.500 4.594 4.585 4.601 . 0 0 "[ . 1 . 2]" 1 312 1 77 ILE H 1 78 ILE H 2.800 . 2.800 2.803 2.783 2.810 0.010 13 0 "[ . 1 . 2]" 1 313 1 78 ILE HA 1 78 ILE QG 4.000 . 4.000 3.370 3.351 3.408 . 0 0 "[ . 1 . 2]" 1 314 1 78 ILE HA 1 81 VAL HB 3.500 . 3.500 2.834 2.760 2.914 . 0 0 "[ . 1 . 2]" 1 315 1 78 ILE HA 1 81 VAL H 3.500 . 3.500 3.128 3.081 3.161 . 0 0 "[ . 1 . 2]" 1 316 1 78 ILE HA 1 82 LEU HG 5.000 . 5.000 4.754 4.707 4.784 . 0 0 "[ . 1 . 2]" 1 317 1 78 ILE HA 1 82 LEU H 5.000 . 5.000 3.965 3.899 4.018 . 0 0 "[ . 1 . 2]" 1 318 1 63 LEU QB 1 78 ILE HB 5.500 . 5.500 1.967 1.889 2.046 . 0 0 "[ . 1 . 2]" 1 319 1 75 GLN HA 1 78 ILE HB 5.000 . 5.000 4.757 4.577 4.894 . 0 0 "[ . 1 . 2]" 1 320 1 78 ILE HB 1 78 ILE MD 3.300 . 3.300 2.179 2.107 2.280 . 0 0 "[ . 1 . 2]" 1 321 1 78 ILE H 1 78 ILE HB 3.500 . 3.500 3.583 3.577 3.589 0.089 9 0 "[ . 1 . 2]" 1 322 1 78 ILE HB 1 79 LYS H 5.000 . 5.000 3.788 3.707 3.895 . 0 0 "[ . 1 . 2]" 1 323 1 78 ILE HB 1 82 LEU QB 5.500 . 5.500 4.904 4.842 4.919 . 0 0 "[ . 1 . 2]" 1 324 1 78 ILE H 1 78 ILE MD 4.000 . 4.000 3.357 3.344 3.368 . 0 0 "[ . 1 . 2]" 1 325 1 78 ILE H 1 78 ILE QG 4.000 . 4.000 1.804 1.751 1.899 0.049 16 0 "[ . 1 . 2]" 1 326 1 63 LEU MD2 1 78 ILE MG 6.000 . 6.000 3.046 2.248 3.477 . 0 0 "[ . 1 . 2]" 1 327 1 63 LEU MD1 1 78 ILE MG 6.000 . 6.000 3.372 3.041 3.659 . 0 0 "[ . 1 . 2]" 1 328 1 75 GLN HA 1 78 ILE MG 5.500 . 5.500 4.071 3.910 4.241 . 0 0 "[ . 1 . 2]" 1 329 1 78 ILE H 1 78 ILE MG 4.000 . 4.000 2.524 2.416 2.604 . 0 0 "[ . 1 . 2]" 1 330 1 78 ILE MG 1 79 LYS H 5.500 . 5.500 4.116 4.069 4.148 . 0 0 "[ . 1 . 2]" 1 331 1 78 ILE MG 1 81 VAL HB 5.500 . 5.500 4.065 3.952 4.171 . 0 0 "[ . 1 . 2]" 1 332 1 76 GLU H 1 78 ILE H 5.000 . 5.000 4.450 4.348 4.614 . 0 0 "[ . 1 . 2]" 1 333 1 78 ILE H 1 79 LYS H 2.800 . 2.800 2.665 2.637 2.722 . 0 0 "[ . 1 . 2]" 1 334 1 78 ILE H 1 80 ASP H 5.000 . 5.000 4.428 4.384 4.491 . 0 0 "[ . 1 . 2]" 1 335 1 79 LYS HA 1 79 LYS QG 4.000 . 4.000 2.253 2.059 2.554 . 0 0 "[ . 1 . 2]" 1 336 1 79 LYS HA 1 82 LEU QD 4.500 . 4.500 1.794 1.752 1.835 0.048 1 0 "[ . 1 . 2]" 1 337 1 76 GLU HA 1 79 LYS QB 4.000 . 4.000 2.265 2.168 2.438 . 0 0 "[ . 1 . 2]" 1 338 1 79 LYS QB 1 79 LYS QE . . 3.800 2.493 1.935 3.031 . 0 0 "[ . 1 . 2]" 1 339 1 79 LYS H 1 79 LYS QB 3.300 . 3.300 2.079 2.039 2.144 . 0 0 "[ . 1 . 2]" 1 340 1 79 LYS QB 1 80 ASP H . . 3.300 2.667 2.634 2.692 . 0 0 "[ . 1 . 2]" 1 341 1 79 LYS QB 1 82 LEU QD 6.500 . 6.500 3.222 3.084 3.317 . 0 0 "[ . 1 . 2]" 1 342 1 79 LYS HA 1 79 LYS QD 4.000 . 4.000 2.877 1.969 3.574 . 0 0 "[ . 1 . 2]" 1 343 1 79 LYS QD 1 82 LEU QD 5.000 . 5.000 2.647 1.789 3.313 0.011 17 0 "[ . 1 . 2]" 1 344 1 79 LYS H 1 79 LYS QE 5.500 . 5.500 4.750 4.463 4.913 . 0 0 "[ . 1 . 2]" 1 345 1 79 LYS QE 1 82 LEU QD 5.000 . 5.000 2.316 1.664 3.306 0.136 6 0 "[ . 1 . 2]" 1 346 1 79 LYS H 1 79 LYS QG 4.000 . 4.000 3.130 2.875 3.367 . 0 0 "[ . 1 . 2]" 1 347 1 79 LYS QG 1 82 LEU QD 6.500 . 6.500 2.739 2.384 3.099 . 0 0 "[ . 1 . 2]" 1 348 1 79 LYS H 1 80 ASP H . . 2.800 2.720 2.672 2.760 . 0 0 "[ . 1 . 2]" 1 349 1 80 ASP HA 1 83 GLU QB 4.000 . 4.000 2.372 2.237 2.547 . 0 0 "[ . 1 . 2]" 1 350 1 80 ASP HA 1 83 GLU QG 5.500 . 5.500 3.915 3.087 4.474 . 0 0 "[ . 1 . 2]" 1 351 1 80 ASP HA 1 83 GLU H . . 3.600 3.649 3.639 3.657 0.057 16 0 "[ . 1 . 2]" 1 352 1 77 ILE MG 1 80 ASP QB 6.000 . 6.000 3.952 3.803 4.082 . 0 0 "[ . 1 . 2]" 1 353 1 79 LYS QB 1 80 ASP QB 6.000 . 6.000 4.059 3.832 4.407 . 0 0 "[ . 1 . 2]" 1 354 1 80 ASP QB 1 81 VAL H . . 4.000 2.848 2.806 2.910 . 0 0 "[ . 1 . 2]" 1 355 1 78 ILE HA 1 80 ASP H 5.000 . 5.000 4.223 4.165 4.274 . 0 0 "[ . 1 . 2]" 1 356 1 79 LYS QG 1 80 ASP H 5.500 . 5.500 4.433 4.364 4.472 . 0 0 "[ . 1 . 2]" 1 357 1 79 LYS QD 1 80 ASP H 5.500 . 5.500 4.855 4.625 4.915 . 0 0 "[ . 1 . 2]" 1 358 1 80 ASP H 1 81 VAL HB 5.000 . 5.000 5.010 5.003 5.018 0.018 10 0 "[ . 1 . 2]" 1 359 1 80 ASP H 1 81 VAL MG2 4.500 . 4.500 3.522 3.492 3.549 . 0 0 "[ . 1 . 2]" 1 360 1 80 ASP H 1 81 VAL H 2.800 . 2.800 2.511 2.485 2.524 . 0 0 "[ . 1 . 2]" 1 361 1 80 ASP H 1 82 LEU H 5.000 . 5.000 4.613 4.578 4.640 . 0 0 "[ . 1 . 2]" 1 362 1 81 VAL HA 1 84 TYR QB 5.500 . 5.500 2.646 2.498 2.824 . 0 0 "[ . 1 . 2]" 1 363 1 81 VAL HA 1 84 TYR QD 4.500 . 4.500 3.178 2.733 3.378 . 0 0 "[ . 1 . 2]" 1 364 1 81 VAL HA 1 84 TYR QE 6.000 . 6.000 4.937 4.623 5.084 . 0 0 "[ . 1 . 2]" 1 365 1 81 VAL HA 1 84 TYR H . . 3.500 3.476 3.414 3.511 0.011 8 0 "[ . 1 . 2]" 1 366 1 81 VAL HA 1 85 LEU MD1 5.500 . 5.500 4.147 4.019 4.258 . 0 0 "[ . 1 . 2]" 1 367 1 81 VAL HA 1 85 LEU H 5.000 . 5.000 4.243 4.164 4.360 . 0 0 "[ . 1 . 2]" 1 368 1 81 VAL HA 1 132 LEU QD 6.000 . 6.000 3.759 3.399 4.086 . 0 0 "[ . 1 . 2]" 1 369 1 81 VAL HA 1 132 LEU HG 5.000 . 5.000 5.012 5.003 5.025 0.025 3 0 "[ . 1 . 2]" 1 370 1 63 LEU MD2 1 81 VAL HB 5.500 . 5.500 3.663 3.546 3.755 . 0 0 "[ . 1 . 2]" 1 371 1 81 VAL H 1 81 VAL HB 4.000 . 4.000 2.741 2.724 2.756 . 0 0 "[ . 1 . 2]" 1 372 1 81 VAL HB 1 82 LEU H . . 2.800 2.037 1.999 2.061 . 0 0 "[ . 1 . 2]" 1 373 1 81 VAL HB 1 85 LEU MD1 5.500 . 5.500 3.382 3.308 3.468 . 0 0 "[ . 1 . 2]" 1 374 1 63 LEU MD1 1 81 VAL MG1 5.000 . 5.000 2.095 1.922 2.311 . 0 0 "[ . 1 . 2]" 1 375 1 81 VAL MG1 1 82 LEU H 4.000 . 4.000 3.333 3.309 3.344 . 0 0 "[ . 1 . 2]" 1 376 1 81 VAL MG1 1 84 TYR QE 6.500 . 6.500 3.529 3.173 3.754 . 0 0 "[ . 1 . 2]" 1 377 1 81 VAL MG1 1 114 SER QB 6.000 . 6.000 4.455 4.449 4.461 . 0 0 "[ . 1 . 2]" 1 378 1 81 VAL MG1 1 132 LEU QD 5.000 . 5.000 1.646 1.568 1.772 0.232 5 0 "[ . 1 . 2]" 1 379 1 63 LEU MD1 1 81 VAL MG2 6.000 . 6.000 3.092 2.974 3.204 . 0 0 "[ . 1 . 2]" 1 380 1 77 ILE HA 1 81 VAL MG2 5.500 . 5.500 4.181 4.036 4.315 . 0 0 "[ . 1 . 2]" 1 381 1 77 ILE MG 1 81 VAL MG2 4.500 . 4.500 2.862 2.545 3.084 . 0 0 "[ . 1 . 2]" 1 382 1 78 ILE HA 1 81 VAL MG2 5.500 . 5.500 1.811 1.796 1.833 0.004 13 0 "[ . 1 . 2]" 1 383 1 81 VAL H 1 81 VAL MG2 3.300 . 3.300 1.834 1.816 1.853 . 0 0 "[ . 1 . 2]" 1 384 1 81 VAL MG2 1 82 LEU H 4.000 . 4.000 3.377 3.367 3.384 . 0 0 "[ . 1 . 2]" 1 385 1 81 VAL MG2 1 114 SER QB 4.500 . 4.500 3.070 2.934 3.209 . 0 0 "[ . 1 . 2]" 1 386 1 81 VAL MG2 1 118 MET ME . . 5.000 2.049 1.908 2.461 . 0 0 "[ . 1 . 2]" 1 387 1 79 LYS HA 1 81 VAL H 5.000 . 5.000 4.239 4.181 4.309 . 0 0 "[ . 1 . 2]" 1 388 1 79 LYS QB 1 81 VAL H 5.500 . 5.500 4.507 4.467 4.533 . 0 0 "[ . 1 . 2]" 1 389 1 81 VAL H 1 114 SER QB 5.500 . 5.500 4.736 4.422 4.899 . 0 0 "[ . 1 . 2]" 1 390 1 63 LEU MD1 1 82 LEU HA 5.500 . 5.500 2.351 2.207 2.592 . 0 0 "[ . 1 . 2]" 1 391 1 63 LEU HG 1 82 LEU HA 5.000 . 5.000 4.227 4.072 4.333 . 0 0 "[ . 1 . 2]" 1 392 1 82 LEU HA 1 85 LEU QB 4.000 . 4.000 2.431 2.025 2.501 . 0 0 "[ . 1 . 2]" 1 393 1 82 LEU HA 1 85 LEU MD1 4.000 . 4.000 1.808 1.778 1.859 0.022 8 0 "[ . 1 . 2]" 1 394 1 82 LEU HA 1 85 LEU HG 3.500 . 3.500 3.513 3.457 3.569 0.069 12 0 "[ . 1 . 2]" 1 395 1 82 LEU HA 1 85 LEU H . . 3.500 3.216 2.966 3.309 . 0 0 "[ . 1 . 2]" 1 396 1 82 LEU QB 1 83 GLU H . . 3.300 3.023 3.011 3.035 . 0 0 "[ . 1 . 2]" 1 397 1 64 ASP H 1 82 LEU QD 6.000 . 6.000 2.848 2.572 3.099 . 0 0 "[ . 1 . 2]" 1 398 1 79 LYS H 1 82 LEU QD 6.000 . 6.000 3.415 3.258 3.618 . 0 0 "[ . 1 . 2]" 1 399 1 82 LEU H 1 82 LEU QD 4.500 . 4.500 2.518 2.403 2.743 . 0 0 "[ . 1 . 2]" 1 400 1 63 LEU MD1 1 82 LEU HG 5.500 . 5.500 3.035 2.893 3.115 . 0 0 "[ . 1 . 2]" 1 401 1 63 LEU HG 1 82 LEU HG 5.500 . 5.500 5.458 5.294 5.513 0.013 6 0 "[ . 1 . 2]" 1 402 1 79 LYS HA 1 82 LEU HG 3.500 . 3.500 2.438 2.329 2.516 . 0 0 "[ . 1 . 2]" 1 403 1 82 LEU H 1 82 LEU HG 3.500 . 3.500 1.829 1.799 1.853 0.001 9 0 "[ . 1 . 2]" 1 404 1 79 LYS H 1 82 LEU H 5.000 . 5.000 4.997 4.970 5.016 0.016 7 0 "[ . 1 . 2]" 1 405 1 80 ASP HA 1 82 LEU H 5.000 . 5.000 4.938 4.912 4.982 . 0 0 "[ . 1 . 2]" 1 406 1 81 VAL HA 1 82 LEU H 5.000 . 5.000 3.560 3.556 3.565 . 0 0 "[ . 1 . 2]" 1 407 1 82 LEU H 1 83 GLU H 2.800 . 2.800 2.830 2.824 2.836 0.036 6 0 "[ . 1 . 2]" 1 408 1 82 LEU H 1 85 LEU QB 5.500 . 5.500 4.864 4.516 4.911 . 0 0 "[ . 1 . 2]" 1 409 1 82 LEU H 1 85 LEU MD1 4.000 . 4.000 3.300 3.237 3.342 . 0 0 "[ . 1 . 2]" 1 410 1 82 LEU QD 1 83 GLU HA 6.000 . 6.000 3.259 2.865 3.551 . 0 0 "[ . 1 . 2]" 1 411 1 83 GLU HA 1 83 GLU QG 3.300 . 3.300 2.343 2.039 2.962 . 0 0 "[ . 1 . 2]" 1 412 1 83 GLU HA 1 86 LYS QG 5.000 . 5.000 4.472 4.463 4.490 . 0 0 "[ . 1 . 2]" 1 413 1 83 GLU H 1 83 GLU QB 3.300 . 3.300 2.093 2.034 2.181 . 0 0 "[ . 1 . 2]" 1 414 1 83 GLU QB 1 84 TYR H . . 3.300 2.805 2.711 2.958 . 0 0 "[ . 1 . 2]" 1 415 1 83 GLU H 1 83 GLU QG 4.000 . 4.000 3.231 2.828 3.586 . 0 0 "[ . 1 . 2]" 1 416 1 83 GLU QG 1 84 TYR H 5.000 . 5.000 4.063 2.537 4.469 . 0 0 "[ . 1 . 2]" 1 417 1 81 VAL H 1 83 GLU H 5.000 . 5.000 4.018 3.985 4.074 . 0 0 "[ . 1 . 2]" 1 418 1 82 LEU QD 1 83 GLU H 4.500 . 4.500 2.381 2.079 2.599 . 0 0 "[ . 1 . 2]" 1 419 1 83 GLU H 1 84 TYR QD 6.000 . 6.000 5.369 5.361 5.381 . 0 0 "[ . 1 . 2]" 1 420 1 83 GLU H 1 84 TYR H 2.800 . 2.800 2.742 2.699 2.791 . 0 0 "[ . 1 . 2]" 1 421 1 83 GLU H 1 85 LEU H 4.500 . 4.500 4.142 3.963 4.211 . 0 0 "[ . 1 . 2]" 1 422 1 84 TYR QB 1 85 LEU H . . 4.000 2.985 2.926 3.074 . 0 0 "[ . 1 . 2]" 1 423 1 84 TYR QB 1 107 LEU QD 6.500 . 6.500 2.864 2.464 3.322 . 0 0 "[ . 1 . 2]" 1 424 1 84 TYR QB 1 111 LEU MD1 . . 6.000 4.302 3.748 4.454 . 0 0 "[ . 1 . 2]" 1 425 1 84 TYR QB 1 111 LEU MD2 . . 4.500 2.144 1.709 2.306 0.091 13 0 "[ . 1 . 2]" 1 426 1 81 VAL MG1 1 84 TYR QD 6.500 . 6.500 2.789 2.499 3.082 . 0 0 "[ . 1 . 2]" 1 427 1 84 TYR QD 1 107 LEU QB 6.500 . 6.500 2.016 1.893 2.314 . 0 0 "[ . 1 . 2]" 1 428 1 84 TYR QD 1 107 LEU QD 5.500 . 5.500 1.973 1.837 2.316 . 0 0 "[ . 1 . 2]" 1 429 1 84 TYR QD 1 111 LEU QB 6.500 . 6.500 2.827 2.487 3.392 . 0 0 "[ . 1 . 2]" 1 430 1 84 TYR QD 1 111 LEU MD2 5.000 . 5.000 2.618 2.336 2.759 . 0 0 "[ . 1 . 2]" 1 431 1 84 TYR QE 1 88 LEU QB 6.500 . 6.500 3.225 2.836 3.365 . 0 0 "[ . 1 . 2]" 1 432 1 80 ASP HA 1 84 TYR H 5.000 . 5.000 4.135 3.950 4.337 . 0 0 "[ . 1 . 2]" 1 433 1 82 LEU HA 1 84 TYR H 5.000 . 5.000 4.182 4.002 4.342 . 0 0 "[ . 1 . 2]" 1 434 1 84 TYR H 1 85 LEU H 2.800 . 2.800 2.510 2.342 2.609 . 0 0 "[ . 1 . 2]" 1 435 1 56 LEU HA 1 85 LEU HA 5.000 . 5.000 4.962 4.661 5.019 0.019 5 0 "[ . 1 . 2]" 1 436 1 85 LEU QB 1 86 LYS H . . 3.300 2.617 2.570 2.683 . 0 0 "[ . 1 . 2]" 1 437 1 60 MET QB 1 85 LEU MD1 6.000 . 6.000 3.239 1.889 3.464 . 0 0 "[ . 1 . 2]" 1 438 1 63 LEU MD2 1 85 LEU MD1 6.000 . 6.000 3.211 3.032 3.562 . 0 0 "[ . 1 . 2]" 1 439 1 63 LEU HG 1 85 LEU MD1 4.000 . 4.000 3.316 3.187 3.348 . 0 0 "[ . 1 . 2]" 1 440 1 85 LEU H 1 85 LEU MD1 5.500 . 5.500 3.151 3.118 3.226 . 0 0 "[ . 1 . 2]" 1 441 1 56 LEU HA 1 85 LEU MD2 5.500 . 5.500 2.349 1.878 2.477 . 0 0 "[ . 1 . 2]" 1 442 1 59 PHE QD 1 85 LEU MD2 5.000 . 5.000 1.851 1.808 1.902 . 0 0 "[ . 1 . 2]" 1 443 1 59 PHE QE 1 85 LEU MD2 6.500 . 6.500 3.172 2.743 3.471 . 0 0 "[ . 1 . 2]" 1 444 1 85 LEU HA 1 85 LEU MD2 3.300 . 3.300 2.446 2.363 2.588 . 0 0 "[ . 1 . 2]" 1 445 1 85 LEU H 1 85 LEU MD2 5.500 . 5.500 3.917 3.848 4.167 . 0 0 "[ . 1 . 2]" 1 446 1 85 LEU MD2 1 88 LEU QB 6.000 . 6.000 3.893 3.802 4.018 . 0 0 "[ . 1 . 2]" 1 447 1 85 LEU MD2 1 135 GLN QB 4.500 . 4.500 2.801 2.483 3.150 . 0 0 "[ . 1 . 2]" 1 448 1 85 LEU MD2 1 135 GLN QG . . 4.500 2.053 1.881 2.497 . 0 0 "[ . 1 . 2]" 1 449 1 59 PHE QE 1 85 LEU HG 6.000 . 6.000 4.550 4.279 4.683 . 0 0 "[ . 1 . 2]" 1 450 1 85 LEU H 1 85 LEU HG 3.500 . 3.500 2.542 2.427 2.988 . 0 0 "[ . 1 . 2]" 1 451 1 85 LEU HG 1 86 LYS H 5.000 . 5.000 4.595 4.541 4.772 . 0 0 "[ . 1 . 2]" 1 452 1 83 GLU HA 1 85 LEU H 5.000 . 5.000 4.470 4.300 4.591 . 0 0 "[ . 1 . 2]" 1 453 1 85 LEU H 1 86 LYS H 2.800 . 2.800 2.716 2.607 2.767 . 0 0 "[ . 1 . 2]" 1 454 1 85 LEU H 1 87 LYS H 5.000 . 5.000 4.146 4.093 4.190 . 0 0 "[ . 1 . 2]" 1 455 1 86 LYS HA 1 86 LYS QG 4.000 . 4.000 2.975 2.747 3.095 . 0 0 "[ . 1 . 2]" 1 456 1 86 LYS HA 1 89 ASP QB 3.500 . 3.500 2.172 2.059 2.250 . 0 0 "[ . 1 . 2]" 1 457 1 86 LYS HA 1 89 ASP H . . 3.500 3.358 3.307 3.420 . 0 0 "[ . 1 . 2]" 1 458 1 86 LYS H 1 86 LYS QB 3.300 . 3.300 2.233 2.212 2.245 . 0 0 "[ . 1 . 2]" 1 459 1 86 LYS QB 1 87 LYS H 4.000 . 4.000 2.585 2.519 2.673 . 0 0 "[ . 1 . 2]" 1 460 1 86 LYS QB 1 89 ASP QB . . 5.000 3.988 3.978 3.998 . 0 0 "[ . 1 . 2]" 1 461 1 57 GLN QG 1 86 LYS QD 4.500 . 4.500 3.530 3.312 3.576 . 0 0 "[ . 1 . 2]" 1 462 1 60 MET ME 1 86 LYS QD 4.500 . 4.500 2.044 1.872 2.495 . 0 0 "[ . 1 . 2]" 1 463 1 86 LYS HA 1 86 LYS QD 3.300 . 3.300 2.215 1.953 2.782 . 0 0 "[ . 1 . 2]" 1 464 1 86 LYS H 1 86 LYS QD 5.500 . 5.500 4.263 4.159 4.466 . 0 0 "[ . 1 . 2]" 1 465 1 86 LYS QD 1 89 ASP QB 4.500 . 4.500 2.889 2.570 3.572 . 0 0 "[ . 1 . 2]" 1 466 1 84 TYR QB 1 86 LYS H 5.500 . 5.500 4.908 4.886 4.915 . 0 0 "[ . 1 . 2]" 1 467 1 86 LYS H 1 87 LYS H 2.800 . 2.800 2.567 2.535 2.612 . 0 0 "[ . 1 . 2]" 1 468 1 87 LYS HA 1 87 LYS QD 4.000 . 4.000 3.182 2.893 3.344 . 0 0 "[ . 1 . 2]" 1 469 1 87 LYS HA 1 87 LYS QG 4.000 . 4.000 2.710 2.660 2.762 . 0 0 "[ . 1 . 2]" 1 470 1 87 LYS HA 1 90 GLU H 4.000 . 4.000 3.584 3.500 3.671 . 0 0 "[ . 1 . 2]" 1 471 1 87 LYS H 1 87 LYS QB . . 3.300 2.691 2.659 2.714 . 0 0 "[ . 1 . 2]" 1 472 1 87 LYS QB 1 88 LEU H 4.000 . 4.000 2.332 2.242 2.395 . 0 0 "[ . 1 . 2]" 1 473 1 87 LYS H 1 87 LYS QD 5.500 . 5.500 3.830 3.751 3.898 . 0 0 "[ . 1 . 2]" 1 474 1 83 GLU HA 1 87 LYS QG 5.500 . 5.500 4.158 4.081 4.272 . 0 0 "[ . 1 . 2]" 1 475 1 83 GLU QG 1 87 LYS QG 6.000 . 6.000 4.183 2.774 4.764 . 0 0 "[ . 1 . 2]" 1 476 1 84 TYR QB 1 87 LYS QG 4.500 . 4.500 3.591 3.584 3.596 . 0 0 "[ . 1 . 2]" 1 477 1 87 LYS H 1 87 LYS QG 4.000 . 4.000 1.924 1.902 2.001 . 0 0 "[ . 1 . 2]" 1 478 1 87 LYS QG 1 88 LEU H . . 4.000 3.548 3.511 3.580 . 0 0 "[ . 1 . 2]" 1 479 1 87 LYS QG 1 107 LEU QD 5.000 . 5.000 3.169 2.549 3.306 . 0 0 "[ . 1 . 2]" 1 480 1 84 TYR HA 1 87 LYS H 3.500 . 3.500 3.194 3.129 3.215 . 0 0 "[ . 1 . 2]" 1 481 1 86 LYS HA 1 87 LYS H 3.500 . 3.500 3.521 3.514 3.525 0.025 7 0 "[ . 1 . 2]" 1 482 1 86 LYS QG 1 87 LYS H 4.000 . 4.000 3.531 3.431 3.575 . 0 0 "[ . 1 . 2]" 1 483 1 87 LYS H 1 89 ASP H . . 4.500 3.634 3.600 3.660 . 0 0 "[ . 1 . 2]" 1 484 1 88 LEU HA 1 88 LEU MD1 4.000 . 4.000 2.391 2.110 2.627 . 0 0 "[ . 1 . 2]" 1 485 1 88 LEU HA 1 91 ILE MD 4.000 . 4.000 2.313 1.961 3.341 . 0 0 "[ . 1 . 2]" 1 486 1 88 LEU HA 1 91 ILE QG 4.000 . 4.000 2.161 1.794 2.500 0.006 12 0 "[ . 1 . 2]" 1 487 1 56 LEU QB 1 88 LEU QB 6.000 . 6.000 4.364 4.074 4.606 . 0 0 "[ . 1 . 2]" 1 488 1 85 LEU HA 1 88 LEU QB 4.500 . 4.500 2.744 2.624 2.833 . 0 0 "[ . 1 . 2]" 1 489 1 88 LEU QB 1 89 ASP H . . 4.000 2.967 2.906 3.026 . 0 0 "[ . 1 . 2]" 1 490 1 88 LEU H 1 88 LEU MD1 5.500 . 5.500 3.902 3.769 4.046 . 0 0 "[ . 1 . 2]" 1 491 1 88 LEU MD1 1 92 TYR QD 6.500 . 6.500 4.000 3.011 4.434 . 0 0 "[ . 1 . 2]" 1 492 1 88 LEU MD1 1 92 TYR QE 6.500 . 6.500 3.916 2.385 4.823 . 0 0 "[ . 1 . 2]" 1 493 1 88 LEU MD1 1 92 TYR H 5.500 . 5.500 4.471 4.215 4.585 . 0 0 "[ . 1 . 2]" 1 494 1 88 LEU MD1 1 104 ALA MB 4.500 . 4.500 2.300 1.920 2.779 . 0 0 "[ . 1 . 2]" 1 495 1 84 TYR QD 1 88 LEU MD2 6.500 . 6.500 4.397 4.168 4.600 . 0 0 "[ . 1 . 2]" 1 496 1 84 TYR QE 1 88 LEU MD2 6.500 . 6.500 3.065 2.727 3.314 . 0 0 "[ . 1 . 2]" 1 497 1 88 LEU MD2 1 92 TYR QE 6.500 . 6.500 2.382 1.850 3.323 . 0 0 "[ . 1 . 2]" 1 498 1 88 LEU HG 1 92 TYR QD 6.000 . 6.000 2.806 2.126 3.633 . 0 0 "[ . 1 . 2]" 1 499 1 88 LEU HG 1 92 TYR QE 6.000 . 6.000 3.365 2.045 4.870 . 0 0 "[ . 1 . 2]" 1 500 1 84 TYR QB 1 88 LEU H 5.500 . 5.500 4.885 4.774 4.910 . 0 0 "[ . 1 . 2]" 1 501 1 84 TYR QE 1 88 LEU H 6.000 . 6.000 4.979 4.773 5.091 . 0 0 "[ . 1 . 2]" 1 502 1 85 LEU HA 1 88 LEU H 3.500 . 3.500 3.533 3.516 3.547 0.047 10 0 "[ . 1 . 2]" 1 503 1 85 LEU H 1 88 LEU H 5.000 . 5.000 4.698 4.591 4.753 . 0 0 "[ . 1 . 2]" 1 504 1 87 LYS H 1 88 LEU H 2.800 . 2.800 2.666 2.599 2.727 . 0 0 "[ . 1 . 2]" 1 505 1 88 LEU H 1 89 ASP H . . 2.800 2.543 2.498 2.591 . 0 0 "[ . 1 . 2]" 1 506 1 88 LEU H 1 90 GLU H 5.000 . 5.000 4.332 4.186 4.571 . 0 0 "[ . 1 . 2]" 1 507 1 56 LEU QB 1 89 ASP QB 6.000 . 6.000 2.832 2.281 3.386 . 0 0 "[ . 1 . 2]" 1 508 1 88 LEU H 1 89 ASP QB 5.500 . 5.500 4.258 4.172 4.307 . 0 0 "[ . 1 . 2]" 1 509 1 89 ASP H 1 89 ASP QB 3.300 . 3.300 2.182 2.056 2.266 . 0 0 "[ . 1 . 2]" 1 510 1 87 LYS HA 1 89 ASP H 4.500 . 4.500 3.906 3.819 3.991 . 0 0 "[ . 1 . 2]" 1 511 1 87 LYS QB 1 89 ASP H 5.500 . 5.500 4.274 4.221 4.331 . 0 0 "[ . 1 . 2]" 1 512 1 87 LYS QG 1 89 ASP H 5.500 . 5.500 4.936 4.927 4.945 . 0 0 "[ . 1 . 2]" 1 513 1 88 LEU MD2 1 89 ASP H 5.500 . 5.500 4.580 4.532 4.598 . 0 0 "[ . 1 . 2]" 1 514 1 88 LEU HG 1 89 ASP H 5.000 . 5.000 4.476 4.306 4.573 . 0 0 "[ . 1 . 2]" 1 515 1 89 ASP H 1 90 GLU QB 5.500 . 5.500 4.449 4.221 4.870 . 0 0 "[ . 1 . 2]" 1 516 1 89 ASP H 1 90 GLU H 2.800 . 2.800 2.591 2.511 2.760 . 0 0 "[ . 1 . 2]" 1 517 1 90 GLU HA 1 93 GLY H 5.000 . 5.000 3.730 3.573 4.028 . 0 0 "[ . 1 . 2]" 1 518 1 87 LYS HA 1 90 GLU QB 5.500 . 5.500 3.423 3.180 4.181 . 0 0 "[ . 1 . 2]" 1 519 1 90 GLU QB 1 91 ILE H . . 5.000 2.917 2.671 3.553 . 0 0 "[ . 1 . 2]" 1 520 1 90 GLU H 1 90 GLU QG 4.000 . 4.000 2.986 1.966 3.565 . 0 0 "[ . 1 . 2]" 1 521 1 90 GLU QG 1 91 ILE H 5.500 . 5.500 4.151 1.977 4.578 . 0 0 "[ . 1 . 2]" 1 522 1 89 ASP QB 1 90 GLU H 4.000 . 4.000 2.698 2.393 2.846 . 0 0 "[ . 1 . 2]" 1 523 1 90 GLU H 1 91 ILE QG 5.500 . 5.500 3.544 3.405 3.660 . 0 0 "[ . 1 . 2]" 1 524 1 90 GLU H 1 91 ILE H . . 2.800 2.467 2.371 2.584 . 0 0 "[ . 1 . 2]" 1 525 1 88 LEU HA 1 91 ILE HB 3.500 . 3.500 2.980 2.717 3.171 . 0 0 "[ . 1 . 2]" 1 526 1 88 LEU MD1 1 91 ILE HB 5.500 . 5.500 3.208 2.906 3.576 . 0 0 "[ . 1 . 2]" 1 527 1 91 ILE H 1 91 ILE MD 5.000 . 5.000 3.561 2.920 3.621 . 0 0 "[ . 1 . 2]" 1 528 1 91 ILE MD 1 103 GLU QG 6.000 . 6.000 3.359 1.709 4.130 0.091 9 0 "[ . 1 . 2]" 1 529 1 91 ILE MD 1 104 ALA HA 5.500 . 5.500 2.245 1.851 3.617 . 0 0 "[ . 1 . 2]" 1 530 1 91 ILE MD 1 104 ALA H . . 4.000 2.872 2.420 3.222 . 0 0 "[ . 1 . 2]" 1 531 1 88 LEU MD1 1 91 ILE QG 5.500 . 5.500 3.561 2.491 4.081 . 0 0 "[ . 1 . 2]" 1 532 1 90 GLU QB 1 91 ILE QG 6.000 . 6.000 3.403 3.062 4.253 . 0 0 "[ . 1 . 2]" 1 533 1 91 ILE H 1 91 ILE QG 4.000 . 4.000 1.875 1.817 1.923 . 0 0 "[ . 1 . 2]" 1 534 1 91 ILE QG 1 92 TYR H . . 4.000 3.581 3.574 3.588 . 0 0 "[ . 1 . 2]" 1 535 1 91 ILE MG 1 92 TYR H 5.000 . 5.000 3.618 3.401 3.835 . 0 0 "[ . 1 . 2]" 1 536 1 91 ILE MG 1 100 GLN QB 6.000 . 6.000 2.612 1.997 3.363 . 0 0 "[ . 1 . 2]" 1 537 1 87 LYS HA 1 91 ILE H 5.000 . 5.000 4.855 4.701 4.894 . 0 0 "[ . 1 . 2]" 1 538 1 88 LEU HA 1 91 ILE H 3.500 . 3.500 3.171 3.109 3.255 . 0 0 "[ . 1 . 2]" 1 539 1 91 ILE H 1 92 TYR H 2.800 . 2.800 2.658 2.502 2.804 0.004 12 0 "[ . 1 . 2]" 1 540 1 91 ILE MG 1 92 TYR HA 5.500 . 5.500 3.908 3.635 4.138 . 0 0 "[ . 1 . 2]" 1 541 1 92 TYR HA 1 95 LEU QB 5.500 . 5.500 3.071 2.503 3.731 . 0 0 "[ . 1 . 2]" 1 542 1 92 TYR HA 1 95 LEU MD1 . . 4.000 2.683 2.242 3.152 . 0 0 "[ . 1 . 2]" 1 543 1 92 TYR QD 1 95 LEU MD1 6.500 . 6.500 4.053 3.052 4.802 . 0 0 "[ . 1 . 2]" 1 544 1 92 TYR QD 1 139 LEU QD 7.000 . 7.000 3.445 2.248 4.631 . 0 0 "[ . 1 . 2]" 1 545 1 92 TYR QE 1 135 GLN QB 6.500 . 6.500 4.859 4.035 5.166 . 0 0 "[ . 1 . 2]" 1 546 1 92 TYR QE 1 139 LEU QD 6.000 . 6.000 2.907 2.098 3.709 . 0 0 "[ . 1 . 2]" 1 547 1 89 ASP HA 1 92 TYR H 5.000 . 5.000 3.814 3.606 4.047 . 0 0 "[ . 1 . 2]" 1 548 1 91 ILE HB 1 92 TYR H 3.500 . 3.500 2.385 2.188 2.656 . 0 0 "[ . 1 . 2]" 1 549 1 92 TYR H 1 93 GLY H . . 3.500 2.832 2.721 3.056 . 0 0 "[ . 1 . 2]" 1 550 1 92 TYR H 1 95 LEU MD1 5.500 . 5.500 3.854 3.566 4.385 . 0 0 "[ . 1 . 2]" 1 551 1 53 GLN QE 1 93 GLY H 5.500 . 5.500 3.394 1.983 4.781 . 0 0 "[ . 1 . 2]" 1 552 1 91 ILE H 1 93 GLY H 5.000 . 5.000 4.046 3.801 4.628 . 0 0 "[ . 1 . 2]" 1 553 1 92 TYR QB 1 93 GLY H 3.500 . 3.500 2.805 2.370 2.954 . 0 0 "[ . 1 . 2]" 1 554 1 93 GLY H 1 94 SER H 2.800 . 2.800 2.345 2.091 2.541 . 0 0 "[ . 1 . 2]" 1 555 1 93 GLY H 1 95 LEU QB 5.500 . 5.500 4.699 4.478 4.917 . 0 0 "[ . 1 . 2]" 1 556 1 93 GLY H 1 95 LEU H 5.000 . 5.000 4.236 3.823 4.767 . 0 0 "[ . 1 . 2]" 1 557 1 91 ILE H 1 94 SER H 5.000 . 5.000 4.610 4.306 4.894 . 0 0 "[ . 1 . 2]" 1 558 1 92 TYR HA 1 94 SER H 5.000 . 5.000 4.428 4.250 4.630 . 0 0 "[ . 1 . 2]" 1 559 1 92 TYR QB 1 94 SER H 5.500 . 5.500 4.660 4.238 4.902 . 0 0 "[ . 1 . 2]" 1 560 1 92 TYR H 1 94 SER H 5.000 . 5.000 4.130 3.879 4.426 . 0 0 "[ . 1 . 2]" 1 561 1 94 SER H 1 95 LEU QB 5.500 . 5.500 4.056 3.837 4.276 . 0 0 "[ . 1 . 2]" 1 562 1 94 SER H 1 95 LEU H 2.800 . 2.800 2.755 2.565 2.804 0.004 8 0 "[ . 1 . 2]" 1 563 1 94 SER H 1 95 LEU MD1 5.500 . 5.500 4.385 3.939 4.593 . 0 0 "[ . 1 . 2]" 1 564 1 95 LEU HA 1 95 LEU MD1 . . 3.300 2.255 1.940 2.748 . 0 0 "[ . 1 . 2]" 1 565 1 91 ILE MG 1 95 LEU MD1 4.500 . 4.500 1.827 1.690 2.009 0.110 6 0 "[ . 1 . 2]" 1 566 1 95 LEU H 1 95 LEU MD1 5.500 . 5.500 3.494 3.204 3.906 . 0 0 "[ . 1 . 2]" 1 567 1 95 LEU MD1 1 101 LEU HA 4.500 . 4.500 2.245 1.892 2.819 . 0 0 "[ . 1 . 2]" 1 568 1 95 LEU MD1 1 101 LEU QB 6.000 . 6.000 2.821 1.946 3.759 . 0 0 "[ . 1 . 2]" 1 569 1 95 LEU MD1 1 101 LEU H 5.500 . 5.500 3.870 2.982 4.581 . 0 0 "[ . 1 . 2]" 1 570 1 95 LEU MD1 1 104 ALA MB 4.500 . 4.500 2.643 2.044 3.045 . 0 0 "[ . 1 . 2]" 1 571 1 95 LEU MD2 1 143 SER HA . . 4.000 2.970 1.948 3.333 . 0 0 "[ . 1 . 2]" 1 572 1 95 LEU H 1 95 LEU HG 5.000 . 5.000 4.526 4.374 4.777 . 0 0 "[ . 1 . 2]" 1 573 1 95 LEU HG 1 101 LEU HA 5.000 . 5.000 3.565 2.594 4.264 . 0 0 "[ . 1 . 2]" 1 574 1 92 TYR HA 1 95 LEU H 5.000 . 5.000 4.312 3.938 5.007 0.007 13 0 "[ . 1 . 2]" 1 575 1 95 LEU H 1 96 ARG H 5.000 . 5.000 3.817 2.521 4.611 . 0 0 "[ . 1 . 2]" 1 576 1 95 LEU H 1 100 GLN QB 5.500 . 5.500 4.585 2.401 4.922 . 0 0 "[ . 1 . 2]" 1 577 1 95 LEU MD2 1 96 ARG H 5.500 . 5.500 4.014 2.737 4.594 . 0 0 "[ . 1 . 2]" 1 578 1 95 LEU MD1 1 96 ARG H 5.500 . 5.500 4.072 3.112 4.598 . 0 0 "[ . 1 . 2]" 1 579 1 95 LEU HA 1 97 ASN H 5.000 . 5.000 3.863 3.027 5.025 0.025 14 0 "[ . 1 . 2]" 1 580 1 96 ARG QB 1 97 ASN H 4.000 . 4.000 3.070 1.957 3.591 . 0 0 "[ . 1 . 2]" 1 581 1 97 ASN H 1 100 GLN QB 5.500 . 5.500 3.621 2.375 4.893 . 0 0 "[ . 1 . 2]" 1 582 1 97 ASN H 1 100 GLN H 5.000 . 5.000 4.326 3.687 4.961 . 0 0 "[ . 1 . 2]" 1 583 1 90 GLU QB 1 100 GLN QE 4.500 . 4.500 3.087 2.047 3.571 . 0 0 "[ . 1 . 2]" 1 584 1 91 ILE HA 1 100 GLN QE 5.500 . 5.500 2.443 1.962 3.287 . 0 0 "[ . 1 . 2]" 1 585 1 91 ILE HB 1 100 GLN QE 5.500 . 5.500 4.618 4.102 4.904 . 0 0 "[ . 1 . 2]" 1 586 1 94 SER QB 1 100 GLN QE 6.000 . 6.000 2.935 1.905 4.335 . 0 0 "[ . 1 . 2]" 1 587 1 97 ASN QB 1 100 GLN H 4.000 . 4.000 2.942 1.979 3.634 . 0 0 "[ . 1 . 2]" 1 588 1 100 GLN H 1 101 LEU H 2.800 . 2.800 2.418 2.202 2.747 . 0 0 "[ . 1 . 2]" 1 589 1 101 LEU QB 1 104 ALA MB 5.500 . 5.500 3.609 3.389 4.086 . 0 0 "[ . 1 . 2]" 1 590 1 101 LEU H 1 101 LEU QD 4.500 . 4.500 2.557 1.689 3.322 0.111 6 0 "[ . 1 . 2]" 1 591 1 100 GLN QB 1 101 LEU H 4.000 . 4.000 2.670 2.330 3.135 . 0 0 "[ . 1 . 2]" 1 592 1 101 LEU QD 1 102 THR HA 6.000 . 6.000 3.221 2.430 4.463 . 0 0 "[ . 1 . 2]" 1 593 1 102 THR HA 1 102 THR MG . . 3.300 2.178 1.985 2.348 . 0 0 "[ . 1 . 2]" 1 594 1 102 THR HA 1 105 LEU MD1 5.500 . 5.500 1.922 1.870 1.970 . 0 0 "[ . 1 . 2]" 1 595 1 102 THR HA 1 105 LEU HG 5.000 . 5.000 3.039 2.723 3.466 . 0 0 "[ . 1 . 2]" 1 596 1 102 THR HA 1 105 LEU H . . 4.000 3.576 3.468 3.755 . 0 0 "[ . 1 . 2]" 1 597 1 102 THR HA 1 161 LEU QD 5.000 . 5.000 3.394 2.855 3.710 . 0 0 "[ . 1 . 2]" 1 598 1 102 THR H 1 102 THR MG 4.000 . 4.000 2.786 2.288 3.335 . 0 0 "[ . 1 . 2]" 1 599 1 102 THR MG 1 103 GLU H 5.500 . 5.500 4.060 3.892 4.248 . 0 0 "[ . 1 . 2]" 1 600 1 102 THR MG 1 160 HIS HD2 5.500 . 5.500 3.227 2.006 4.583 . 0 0 "[ . 1 . 2]" 1 601 1 100 GLN HA 1 102 THR H 5.000 . 5.000 4.153 3.603 4.739 . 0 0 "[ . 1 . 2]" 1 602 1 100 GLN QB 1 102 THR H 5.500 . 5.500 4.623 4.293 4.907 . 0 0 "[ . 1 . 2]" 1 603 1 101 LEU QB 1 102 THR H 4.000 . 4.000 3.322 2.419 3.576 . 0 0 "[ . 1 . 2]" 1 604 1 102 THR H 1 103 GLU H 2.800 . 2.800 2.765 2.556 2.828 0.028 9 0 "[ . 1 . 2]" 1 605 1 102 THR H 1 104 ALA MB 5.500 . 5.500 4.551 4.432 4.597 . 0 0 "[ . 1 . 2]" 1 606 1 102 THR H 1 161 LEU QD 6.000 . 6.000 4.029 3.231 4.453 . 0 0 "[ . 1 . 2]" 1 607 1 103 GLU HA 1 106 SER H 4.000 . 4.000 3.267 3.123 3.490 . 0 0 "[ . 1 . 2]" 1 608 1 103 GLU QB 1 104 ALA H . . 4.000 3.054 2.852 3.582 . 0 0 "[ . 1 . 2]" 1 609 1 103 GLU QB 1 107 LEU H 5.500 . 5.500 4.823 4.528 4.910 . 0 0 "[ . 1 . 2]" 1 610 1 103 GLU H 1 103 GLU QG 4.000 . 4.000 3.345 2.288 3.578 . 0 0 "[ . 1 . 2]" 1 611 1 100 GLN HA 1 103 GLU H 4.000 . 4.000 3.626 3.361 3.965 . 0 0 "[ . 1 . 2]" 1 612 1 102 THR HB 1 103 GLU H 3.500 . 3.500 3.190 2.646 3.507 0.007 13 0 "[ . 1 . 2]" 1 613 1 103 GLU H 1 104 ALA MB 5.500 . 5.500 4.165 3.950 4.241 . 0 0 "[ . 1 . 2]" 1 614 1 88 LEU MD1 1 104 ALA HA 4.000 . 4.000 2.464 2.221 2.811 . 0 0 "[ . 1 . 2]" 1 615 1 104 ALA HA 1 107 LEU QB 5.500 . 5.500 3.099 2.792 3.290 . 0 0 "[ . 1 . 2]" 1 616 1 104 ALA HA 1 107 LEU QD 5.500 . 5.500 2.163 1.933 3.099 . 0 0 "[ . 1 . 2]" 1 617 1 91 ILE HB 1 104 ALA MB 5.500 . 5.500 3.051 2.430 3.460 . 0 0 "[ . 1 . 2]" 1 618 1 91 ILE MG 1 104 ALA MB 4.500 . 4.500 1.876 1.725 2.291 0.075 18 0 "[ . 1 . 2]" 1 619 1 101 LEU HA 1 104 ALA MB 4.000 . 4.000 2.325 2.032 2.579 . 0 0 "[ . 1 . 2]" 1 620 1 104 ALA H 1 104 ALA MB 3.300 . 3.300 2.068 2.028 2.108 . 0 0 "[ . 1 . 2]" 1 621 1 104 ALA MB 1 105 LEU H 4.000 . 4.000 2.745 2.617 2.856 . 0 0 "[ . 1 . 2]" 1 622 1 91 ILE MG 1 104 ALA H 4.000 . 4.000 3.031 2.611 3.333 . 0 0 "[ . 1 . 2]" 1 623 1 103 GLU QG 1 104 ALA H 5.000 . 5.000 4.036 2.100 4.499 . 0 0 "[ . 1 . 2]" 1 624 1 103 GLU H 1 104 ALA H 2.800 . 2.800 2.580 2.354 2.672 . 0 0 "[ . 1 . 2]" 1 625 1 104 ALA H 1 105 LEU QB 5.500 . 5.500 4.831 4.691 4.903 . 0 0 "[ . 1 . 2]" 1 626 1 104 ALA H 1 105 LEU MD1 5.500 . 5.500 4.606 4.601 4.615 . 0 0 "[ . 1 . 2]" 1 627 1 104 ALA H 1 105 LEU H 2.800 . 2.800 2.576 2.516 2.682 . 0 0 "[ . 1 . 2]" 1 628 1 104 ALA H 1 106 SER H 5.000 . 5.000 4.086 3.940 4.202 . 0 0 "[ . 1 . 2]" 1 629 1 105 LEU HA 1 105 LEU MD2 . . 3.300 2.335 2.183 2.555 . 0 0 "[ . 1 . 2]" 1 630 1 105 LEU HA 1 108 GLY H . . 4.000 3.503 3.384 3.615 . 0 0 "[ . 1 . 2]" 1 631 1 105 LEU HA 1 168 LEU QD . . 3.800 1.969 1.805 2.169 . 0 0 "[ . 1 . 2]" 1 632 1 105 LEU QB 1 106 SER H . . 4.000 2.502 2.359 2.589 . 0 0 "[ . 1 . 2]" 1 633 1 105 LEU QB 1 164 ASP QB 6.000 . 6.000 2.069 1.890 2.803 . 0 0 "[ . 1 . 2]" 1 634 1 105 LEU QB 1 168 LEU H 5.500 . 5.500 3.864 3.595 4.232 . 0 0 "[ . 1 . 2]" 1 635 1 105 LEU H 1 105 LEU MD1 5.500 . 5.500 3.218 3.145 3.289 . 0 0 "[ . 1 . 2]" 1 636 1 105 LEU MD1 1 147 LEU MD1 5.500 . 5.500 3.215 2.660 3.763 . 0 0 "[ . 1 . 2]" 1 637 1 105 LEU MD1 1 161 LEU QB 6.000 . 6.000 3.664 3.048 4.235 . 0 0 "[ . 1 . 2]" 1 638 1 105 LEU MD1 1 164 ASP QB . . 4.500 1.854 1.702 2.134 0.098 17 0 "[ . 1 . 2]" 1 639 1 105 LEU MD1 1 165 TYR HA 4.000 . 4.000 3.099 2.728 3.335 . 0 0 "[ . 1 . 2]" 1 640 1 105 LEU MD1 1 165 TYR QB . . 5.000 2.881 2.527 3.268 . 0 0 "[ . 1 . 2]" 1 641 1 105 LEU MD1 1 165 TYR QD 6.500 . 6.500 3.681 3.172 4.321 . 0 0 "[ . 1 . 2]" 1 642 1 105 LEU MD1 1 165 TYR H . . 4.000 3.115 2.677 3.339 . 0 0 "[ . 1 . 2]" 1 643 1 102 THR HA 1 105 LEU MD2 5.500 . 5.500 4.214 3.918 4.585 . 0 0 "[ . 1 . 2]" 1 644 1 105 LEU H 1 105 LEU MD2 4.000 . 4.000 3.274 3.195 3.338 . 0 0 "[ . 1 . 2]" 1 645 1 105 LEU MD2 1 140 ILE HA 5.500 . 5.500 4.335 3.810 4.585 . 0 0 "[ . 1 . 2]" 1 646 1 105 LEU MD2 1 143 SER QB 4.000 . 4.000 2.207 1.891 2.618 . 0 0 "[ . 1 . 2]" 1 647 1 105 LEU MD2 1 165 TYR QB 6.000 . 6.000 2.798 2.243 3.600 . 0 0 "[ . 1 . 2]" 1 648 1 105 LEU MD2 1 165 TYR QD 5.000 . 5.000 2.268 1.897 2.900 . 0 0 "[ . 1 . 2]" 1 649 1 105 LEU H 1 105 LEU HG 4.000 . 4.000 1.859 1.824 1.912 . 0 0 "[ . 1 . 2]" 1 650 1 105 LEU HG 1 106 SER H 5.000 . 5.000 3.849 3.783 3.998 . 0 0 "[ . 1 . 2]" 1 651 1 105 LEU H 1 106 SER H . . 2.800 2.479 2.393 2.689 . 0 0 "[ . 1 . 2]" 1 652 1 105 LEU H 1 107 LEU H 5.000 . 5.000 4.150 3.952 4.372 . 0 0 "[ . 1 . 2]" 1 653 1 105 LEU H 1 139 LEU QD 6.000 . 6.000 3.674 3.381 3.958 . 0 0 "[ . 1 . 2]" 1 654 1 106 SER HA 1 109 LYS QD 5.500 . 5.500 3.360 2.272 3.818 . 0 0 "[ . 1 . 2]" 1 655 1 103 GLU QB 1 106 SER QB 6.000 . 6.000 4.182 3.542 4.763 . 0 0 "[ . 1 . 2]" 1 656 1 103 GLU QG 1 106 SER QB 6.000 . 6.000 3.638 3.160 4.742 . 0 0 "[ . 1 . 2]" 1 657 1 102 THR HA 1 106 SER H 5.000 . 5.000 4.611 4.226 4.851 . 0 0 "[ . 1 . 2]" 1 658 1 104 ALA HA 1 106 SER H 5.000 . 5.000 4.492 4.354 4.688 . 0 0 "[ . 1 . 2]" 1 659 1 104 ALA MB 1 106 SER H 5.500 . 5.500 4.579 4.461 4.604 . 0 0 "[ . 1 . 2]" 1 660 1 105 LEU MD1 1 106 SER H 5.500 . 5.500 3.994 3.878 4.172 . 0 0 "[ . 1 . 2]" 1 661 1 105 LEU MD2 1 106 SER H 5.500 . 5.500 4.637 4.625 4.657 . 0 0 "[ . 1 . 2]" 1 662 1 106 SER H 1 107 LEU QD 6.000 . 6.000 4.421 3.867 4.462 . 0 0 "[ . 1 . 2]" 1 663 1 106 SER H 1 107 LEU H 2.800 . 2.800 2.776 2.692 2.813 0.013 6 0 "[ . 1 . 2]" 1 664 1 106 SER H 1 108 GLY H 5.000 . 5.000 4.237 3.926 4.487 . 0 0 "[ . 1 . 2]" 1 665 1 107 LEU HA 1 107 LEU QD 3.800 . 3.800 2.498 1.985 2.822 . 0 0 "[ . 1 . 2]" 1 666 1 107 LEU HA 1 107 LEU HG 4.000 . 4.000 2.702 2.283 3.419 . 0 0 "[ . 1 . 2]" 1 667 1 107 LEU HA 1 110 ARG QB 5.500 . 5.500 3.283 2.521 4.022 . 0 0 "[ . 1 . 2]" 1 668 1 107 LEU HA 1 110 ARG QG 5.500 . 5.500 2.516 1.846 3.379 . 0 0 "[ . 1 . 2]" 1 669 1 107 LEU HA 1 110 ARG H 3.500 . 3.500 3.516 3.448 3.546 0.046 8 0 "[ . 1 . 2]" 1 670 1 107 LEU HA 1 111 LEU HA 5.000 . 5.000 5.053 5.030 5.072 0.072 10 0 "[ . 1 . 2]" 1 671 1 88 LEU MD1 1 107 LEU QB 6.000 . 6.000 2.657 2.463 2.904 . 0 0 "[ . 1 . 2]" 1 672 1 107 LEU QB 1 108 GLY H . . 4.000 2.500 2.373 2.749 . 0 0 "[ . 1 . 2]" 1 673 1 84 TYR HA 1 107 LEU QD 6.000 . 6.000 3.128 2.658 3.449 . 0 0 "[ . 1 . 2]" 1 674 1 84 TYR QE 1 107 LEU QD 7.000 . 7.000 3.100 2.912 3.227 . 0 0 "[ . 1 . 2]" 1 675 1 87 LYS QE 1 107 LEU QD 6.000 . 6.000 3.099 2.317 3.966 . 0 0 "[ . 1 . 2]" 1 676 1 88 LEU QB 1 107 LEU QD 6.500 . 6.500 2.679 2.376 2.917 . 0 0 "[ . 1 . 2]" 1 677 1 107 LEU QD 1 110 ARG QD 6.500 . 6.500 3.399 1.965 4.298 . 0 0 "[ . 1 . 2]" 1 678 1 107 LEU H 1 107 LEU HG 3.500 . 3.500 2.459 2.119 3.509 0.009 18 0 "[ . 1 . 2]" 1 679 1 88 LEU MD1 1 107 LEU H 5.500 . 5.500 4.530 4.368 4.586 . 0 0 "[ . 1 . 2]" 1 680 1 103 GLU QG 1 107 LEU H 5.500 . 5.500 4.627 4.309 4.912 . 0 0 "[ . 1 . 2]" 1 681 1 104 ALA H 1 107 LEU H 5.000 . 5.000 4.897 4.794 5.006 0.006 18 0 "[ . 1 . 2]" 1 682 1 106 SER QB 1 107 LEU H 3.300 . 3.300 2.507 2.318 2.717 . 0 0 "[ . 1 . 2]" 1 683 1 107 LEU H 1 108 GLY H 2.800 . 2.800 2.778 2.670 2.817 0.017 4 0 "[ . 1 . 2]" 1 684 1 108 GLY QA 1 111 LEU QB 5.000 . 5.000 2.861 2.642 3.290 . 0 0 "[ . 1 . 2]" 1 685 1 108 GLY QA 1 111 LEU H 5.000 . 5.000 3.981 3.767 4.208 . 0 0 "[ . 1 . 2]" 1 686 1 105 LEU QB 1 108 GLY H 5.500 . 5.500 4.856 4.662 4.916 . 0 0 "[ . 1 . 2]" 1 687 1 107 LEU QD 1 108 GLY H 6.000 . 6.000 3.902 3.725 4.050 . 0 0 "[ . 1 . 2]" 1 688 1 107 LEU HG 1 108 GLY H 5.000 . 5.000 4.495 4.160 4.997 . 0 0 "[ . 1 . 2]" 1 689 1 108 GLY H 1 109 LYS H . . 2.800 2.786 2.711 2.823 0.023 2 0 "[ . 1 . 2]" 1 690 1 108 GLY H 1 110 ARG H 5.000 . 5.000 4.628 4.218 4.811 . 0 0 "[ . 1 . 2]" 1 691 1 109 LYS QB 1 109 LYS QE 4.500 . 4.500 3.071 1.972 3.576 . 0 0 "[ . 1 . 2]" 1 692 1 109 LYS H 1 109 LYS QB 3.300 . 3.300 2.319 2.130 2.982 . 0 0 "[ . 1 . 2]" 1 693 1 106 SER QB 1 109 LYS QD 6.000 . 6.000 4.542 3.707 4.773 . 0 0 "[ . 1 . 2]" 1 694 1 109 LYS H 1 109 LYS QD 5.500 . 5.500 4.156 3.553 4.332 . 0 0 "[ . 1 . 2]" 1 695 1 109 LYS QD 1 110 ARG H . . 4.000 3.451 2.850 3.578 . 0 0 "[ . 1 . 2]" 1 696 1 109 LYS QD 1 167 ASP QB 6.000 . 6.000 2.564 1.940 3.906 . 0 0 "[ . 1 . 2]" 1 697 1 109 LYS QE 1 167 ASP QB 4.500 . 4.500 2.547 1.676 3.572 0.124 20 0 "[ . 1 . 2]" 1 698 1 106 SER HA 1 109 LYS QG 5.500 . 5.500 4.498 2.435 4.916 . 0 0 "[ . 1 . 2]" 1 699 1 109 LYS HA 1 109 LYS QG 3.500 . 3.500 2.715 2.559 3.180 . 0 0 "[ . 1 . 2]" 1 700 1 109 LYS QG 1 110 ARG H . . 4.000 2.921 2.445 3.337 . 0 0 "[ . 1 . 2]" 1 701 1 109 LYS QG 1 167 ASP QB 6.000 . 6.000 3.092 2.429 3.659 . 0 0 "[ . 1 . 2]" 1 702 1 109 LYS QG 1 168 LEU HA 5.500 . 5.500 3.964 2.231 4.748 . 0 0 "[ . 1 . 2]" 1 703 1 107 LEU QB 1 109 LYS H 5.500 . 5.500 4.576 4.423 4.926 . 0 0 "[ . 1 . 2]" 1 704 1 107 LEU H 1 109 LYS H 5.000 . 5.000 4.196 4.050 4.555 . 0 0 "[ . 1 . 2]" 1 705 1 109 LYS H 1 110 ARG H 2.800 . 2.800 2.702 2.577 2.771 . 0 0 "[ . 1 . 2]" 1 706 1 109 LYS H 1 110 ARG QG 5.500 . 5.500 3.889 3.614 4.008 . 0 0 "[ . 1 . 2]" 1 707 1 109 LYS H 1 111 LEU H 5.000 . 5.000 3.897 3.690 4.357 . 0 0 "[ . 1 . 2]" 1 708 1 109 LYS H 1 112 SER H 5.000 . 5.000 4.500 4.312 4.580 . 0 0 "[ . 1 . 2]" 1 709 1 109 LYS H 1 168 LEU HA 3.500 . 3.500 3.523 3.514 3.533 0.033 20 0 "[ . 1 . 2]" 1 710 1 109 LYS H 1 168 LEU QD 4.500 . 4.500 3.129 2.622 3.346 . 0 0 "[ . 1 . 2]" 1 711 1 110 ARG HA 1 110 ARG QG 4.000 . 4.000 2.945 2.537 3.404 . 0 0 "[ . 1 . 2]" 1 712 1 110 ARG HA 1 113 LYS H 3.500 . 3.500 3.385 3.247 3.507 0.007 2 0 "[ . 1 . 2]" 1 713 1 110 ARG QB 1 111 LEU H . . 4.000 2.833 2.115 3.520 . 0 0 "[ . 1 . 2]" 1 714 1 110 ARG H 1 110 ARG QD 5.500 . 5.500 3.937 3.484 4.204 . 0 0 "[ . 1 . 2]" 1 715 1 110 ARG H 1 110 ARG QG . . 4.000 2.065 1.726 2.352 0.074 6 0 "[ . 1 . 2]" 1 716 1 108 GLY QA 1 110 ARG H 5.500 . 5.500 4.637 4.330 4.745 . 0 0 "[ . 1 . 2]" 1 717 1 109 LYS QB 1 110 ARG H 3.300 . 3.300 2.340 2.196 2.944 . 0 0 "[ . 1 . 2]" 1 718 1 110 ARG H 1 111 LEU H 2.800 . 2.800 2.738 2.642 2.813 0.013 2 0 "[ . 1 . 2]" 1 719 1 110 ARG H 1 112 SER H 5.000 . 5.000 4.088 3.869 4.307 . 0 0 "[ . 1 . 2]" 1 720 1 110 ARG H 1 113 LYS H 5.000 . 5.000 4.952 4.790 5.011 0.011 11 0 "[ . 1 . 2]" 1 721 1 111 LEU HA 1 111 LEU MD2 4.000 . 4.000 2.019 1.965 2.053 . 0 0 "[ . 1 . 2]" 1 722 1 107 LEU QB 1 111 LEU QB 6.000 . 6.000 2.955 2.685 3.190 . 0 0 "[ . 1 . 2]" 1 723 1 111 LEU QB 1 112 SER H . . 4.000 2.645 2.418 2.756 . 0 0 "[ . 1 . 2]" 1 724 1 84 TYR QE 1 111 LEU MD1 6.500 . 6.500 3.445 3.150 3.594 . 0 0 "[ . 1 . 2]" 1 725 1 111 LEU HA 1 111 LEU MD1 4.000 . 4.000 3.006 2.613 3.174 . 0 0 "[ . 1 . 2]" 1 726 1 111 LEU MD1 1 115 LEU QB 4.500 . 4.500 3.091 2.590 3.343 . 0 0 "[ . 1 . 2]" 1 727 1 81 VAL HA 1 111 LEU MD2 4.000 . 4.000 2.182 1.924 2.310 . 0 0 "[ . 1 . 2]" 1 728 1 84 TYR QE 1 111 LEU MD2 6.500 . 6.500 3.570 3.255 3.789 . 0 0 "[ . 1 . 2]" 1 729 1 108 GLY H 1 111 LEU H 5.000 . 5.000 4.621 4.568 4.691 . 0 0 "[ . 1 . 2]" 1 730 1 109 LYS QG 1 111 LEU H 5.500 . 5.500 4.914 4.852 4.934 . 0 0 "[ . 1 . 2]" 1 731 1 110 ARG QD 1 111 LEU H 5.500 . 5.500 4.139 2.515 4.915 . 0 0 "[ . 1 . 2]" 1 732 1 110 ARG QG 1 111 LEU H 4.000 . 4.000 2.853 1.930 3.605 . 0 0 "[ . 1 . 2]" 1 733 1 111 LEU H 1 112 SER H 2.800 . 2.800 2.669 2.497 2.800 . 0 0 "[ . 1 . 2]" 1 734 1 111 LEU H 1 113 LYS H 5.000 . 5.000 4.171 3.975 4.363 . 0 0 "[ . 1 . 2]" 1 735 1 112 SER QB 1 113 LYS H 5.500 . 5.500 2.730 2.613 2.864 . 0 0 "[ . 1 . 2]" 1 736 1 112 SER QB 1 136 LEU MD2 6.000 . 6.000 3.701 2.804 4.366 . 0 0 "[ . 1 . 2]" 1 737 1 112 SER QB 1 171 GLU QB 6.000 . 6.000 2.405 1.906 3.459 . 0 0 "[ . 1 . 2]" 1 738 1 112 SER QB 1 171 GLU QG 5.000 . 5.000 2.485 1.953 3.574 . 0 0 "[ . 1 . 2]" 1 739 1 110 ARG QB 1 112 SER H 5.500 . 5.500 4.725 4.345 4.935 . 0 0 "[ . 1 . 2]" 1 740 1 112 SER H 1 113 LYS H 2.800 . 2.800 2.658 2.573 2.747 . 0 0 "[ . 1 . 2]" 1 741 1 112 SER H 1 114 SER H 5.000 . 5.000 4.261 4.115 4.445 . 0 0 "[ . 1 . 2]" 1 742 1 110 ARG HA 1 113 LYS QB 4.500 . 4.500 2.928 2.639 3.512 . 0 0 "[ . 1 . 2]" 1 743 1 113 LYS QB 1 114 SER H . . 3.500 2.556 2.353 2.723 . 0 0 "[ . 1 . 2]" 1 744 1 110 ARG HA 1 113 LYS QD 5.500 . 5.500 3.859 2.197 4.855 . 0 0 "[ . 1 . 2]" 1 745 1 110 ARG HA 1 113 LYS QG 5.500 . 5.500 4.087 1.970 4.904 . 0 0 "[ . 1 . 2]" 1 746 1 113 LYS QG 1 114 SER H 5.500 . 5.500 4.086 3.648 4.426 . 0 0 "[ . 1 . 2]" 1 747 1 111 LEU QB 1 113 LYS H 5.500 . 5.500 4.702 4.494 4.814 . 0 0 "[ . 1 . 2]" 1 748 1 113 LYS H 1 114 SER H 2.800 . 2.800 2.708 2.637 2.794 . 0 0 "[ . 1 . 2]" 1 749 1 113 LYS H 1 115 LEU QB 5.500 . 5.500 4.822 4.537 4.906 . 0 0 "[ . 1 . 2]" 1 750 1 111 LEU MD2 1 114 SER QB 6.000 . 6.000 2.649 2.285 2.838 . 0 0 "[ . 1 . 2]" 1 751 1 114 SER QB 1 115 LEU H . . 4.000 2.739 2.653 2.855 . 0 0 "[ . 1 . 2]" 1 752 1 110 ARG HA 1 114 SER H 5.000 . 5.000 4.838 4.743 4.900 . 0 0 "[ . 1 . 2]" 1 753 1 111 LEU MD1 1 114 SER H 5.500 . 5.500 4.208 3.808 4.522 . 0 0 "[ . 1 . 2]" 1 754 1 114 SER H 1 115 LEU QB 5.500 . 5.500 4.378 4.267 4.423 . 0 0 "[ . 1 . 2]" 1 755 1 114 SER H 1 115 LEU H . . 2.800 2.648 2.516 2.689 . 0 0 "[ . 1 . 2]" 1 756 1 115 LEU HA 1 118 MET QB 4.000 . 4.000 2.460 2.173 2.840 . 0 0 "[ . 1 . 2]" 1 757 1 115 LEU HA 1 118 MET QG 5.500 . 5.500 4.316 3.990 4.731 . 0 0 "[ . 1 . 2]" 1 758 1 115 LEU QB 1 116 HIS H . . 3.500 2.562 2.464 2.625 . 0 0 "[ . 1 . 2]" 1 759 1 115 LEU QB 1 132 LEU QD 6.500 . 6.500 2.646 1.923 3.915 . 0 0 "[ . 1 . 2]" 1 760 1 115 LEU HA 1 115 LEU QD . . 3.800 1.995 1.895 2.356 . 0 0 "[ . 1 . 2]" 1 761 1 115 LEU QD 1 118 MET QG 6.500 . 6.500 3.217 2.888 3.831 . 0 0 "[ . 1 . 2]" 1 762 1 115 LEU QD 1 133 ILE QG 6.500 . 6.500 3.828 3.097 4.299 . 0 0 "[ . 1 . 2]" 1 763 1 115 LEU HG 1 175 SER QB 5.500 . 5.500 3.665 2.805 4.394 . 0 0 "[ . 1 . 2]" 1 764 1 111 LEU MD1 1 115 LEU H 5.500 . 5.500 3.539 3.213 3.697 . 0 0 "[ . 1 . 2]" 1 765 1 112 SER H 1 115 LEU H 5.000 . 5.000 4.899 4.696 4.999 . 0 0 "[ . 1 . 2]" 1 766 1 113 LYS H 1 115 LEU H 5.000 . 5.000 4.050 3.960 4.118 . 0 0 "[ . 1 . 2]" 1 767 1 115 LEU H 1 116 HIS QB 5.500 . 5.500 4.596 4.289 4.901 . 0 0 "[ . 1 . 2]" 1 768 1 113 LYS HA 1 116 HIS QB 5.500 . 5.500 3.068 2.639 3.488 . 0 0 "[ . 1 . 2]" 1 769 1 116 HIS QB 1 117 GLU H . . 3.300 2.682 2.581 2.793 . 0 0 "[ . 1 . 2]" 1 770 1 116 HIS H 1 116 HIS HD2 5.000 . 5.000 3.414 2.203 4.957 . 0 0 "[ . 1 . 2]" 1 771 1 116 HIS HD2 1 174 ILE MG 5.500 . 5.500 4.277 3.602 4.587 . 0 0 "[ . 1 . 2]" 1 772 1 116 HIS HD2 1 178 ILE MD . . 4.000 2.767 2.003 3.333 . 0 0 "[ . 1 . 2]" 1 773 1 116 HIS HE1 1 174 ILE MG 5.500 . 5.500 2.801 1.891 4.548 . 0 0 "[ . 1 . 2]" 1 774 1 116 HIS HE1 1 178 ILE MD 5.500 . 5.500 3.497 2.589 4.272 . 0 0 "[ . 1 . 2]" 1 775 1 113 LYS HA 1 116 HIS H 3.500 . 3.500 3.386 3.280 3.513 0.013 1 0 "[ . 1 . 2]" 1 776 1 115 LEU QD 1 116 HIS H 4.500 . 4.500 3.215 2.948 3.359 . 0 0 "[ . 1 . 2]" 1 777 1 115 LEU HG 1 116 HIS H 5.000 . 5.000 4.837 2.689 5.013 0.013 7 0 "[ . 1 . 2]" 1 778 1 117 GLU HA 1 119 CYS H 5.000 . 5.000 4.584 4.147 4.856 . 0 0 "[ . 1 . 2]" 1 779 1 114 SER HA 1 117 GLU QB 5.500 . 5.500 2.939 2.585 3.167 . 0 0 "[ . 1 . 2]" 1 780 1 117 GLU QB 1 118 MET HA 5.500 . 5.500 3.909 3.842 3.986 . 0 0 "[ . 1 . 2]" 1 781 1 117 GLU H 1 117 GLU QG . . 5.000 3.192 2.224 4.053 . 0 0 "[ . 1 . 2]" 1 782 1 117 GLU QG 1 118 MET H 5.500 . 5.500 4.301 3.892 4.553 . 0 0 "[ . 1 . 2]" 1 783 1 114 SER HA 1 117 GLU H 3.500 . 3.500 3.457 3.320 3.523 0.023 1 0 "[ . 1 . 2]" 1 784 1 115 LEU QD 1 117 GLU H 6.000 . 6.000 4.394 4.230 4.453 . 0 0 "[ . 1 . 2]" 1 785 1 116 HIS HD2 1 117 GLU H 5.000 . 5.000 4.908 4.666 5.014 0.014 7 0 "[ . 1 . 2]" 1 786 1 116 HIS H 1 117 GLU H 2.800 . 2.800 2.680 2.608 2.763 . 0 0 "[ . 1 . 2]" 1 787 1 117 GLU H 1 119 CYS H 5.000 . 5.000 4.508 4.119 4.730 . 0 0 "[ . 1 . 2]" 1 788 1 117 GLU H 1 120 GLY H 5.000 . 5.000 4.505 4.407 4.656 . 0 0 "[ . 1 . 2]" 1 789 1 118 MET HA 1 118 MET QG 4.000 . 4.000 2.290 2.145 2.457 . 0 0 "[ . 1 . 2]" 1 790 1 118 MET HA 1 121 ILE MG 5.500 . 5.500 3.701 2.088 4.585 . 0 0 "[ . 1 . 2]" 1 791 1 115 LEU QD 1 118 MET QB 6.500 . 6.500 2.363 2.098 2.695 . 0 0 "[ . 1 . 2]" 1 792 1 118 MET H 1 118 MET QB . . 3.500 2.169 2.057 2.247 . 0 0 "[ . 1 . 2]" 1 793 1 78 ILE HA 1 118 MET ME 5.500 . 5.500 3.455 3.158 3.787 . 0 0 "[ . 1 . 2]" 1 794 1 81 VAL HB 1 118 MET ME 5.500 . 5.500 4.210 3.947 4.495 . 0 0 "[ . 1 . 2]" 1 795 1 81 VAL MG1 1 118 MET ME 4.500 . 4.500 3.088 2.519 3.132 . 0 0 "[ . 1 . 2]" 1 796 1 115 LEU HA 1 118 MET ME 5.500 . 5.500 2.336 1.968 2.917 . 0 0 "[ . 1 . 2]" 1 797 1 118 MET H 1 118 MET ME 5.500 . 5.500 3.926 3.700 4.263 . 0 0 "[ . 1 . 2]" 1 798 1 118 MET ME 1 125 GLU QB 6.000 . 6.000 4.135 3.771 4.459 . 0 0 "[ . 1 . 2]" 1 799 1 118 MET ME 1 128 ILE MG 4.500 . 4.500 1.847 1.754 2.114 0.046 8 0 "[ . 1 . 2]" 1 800 1 118 MET ME 1 129 CYS HA 5.500 . 5.500 3.992 3.598 4.210 . 0 0 "[ . 1 . 2]" 1 801 1 118 MET ME 1 129 CYS H 5.500 . 5.500 4.527 4.420 4.585 . 0 0 "[ . 1 . 2]" 1 802 1 118 MET ME 1 132 LEU QB 6.000 . 6.000 3.866 3.458 4.234 . 0 0 "[ . 1 . 2]" 1 803 1 118 MET QG 1 125 GLU QB 6.000 . 6.000 3.119 2.364 3.825 . 0 0 "[ . 1 . 2]" 1 804 1 118 MET QG 1 128 ILE HB 5.500 . 5.500 3.934 3.507 4.334 . 0 0 "[ . 1 . 2]" 1 805 1 118 MET QG 1 128 ILE MG 5.500 . 5.500 3.277 2.728 3.715 . 0 0 "[ . 1 . 2]" 1 806 1 118 MET QG 1 129 CYS H 5.500 . 5.500 4.905 4.901 4.913 . 0 0 "[ . 1 . 2]" 1 807 1 77 ILE MG 1 118 MET HG3 5.500 . 5.500 3.379 2.680 3.780 . 0 0 "[ . 1 . 2]" 1 808 1 114 SER HA 1 118 MET H 5.000 . 5.000 4.624 4.170 4.814 . 0 0 "[ . 1 . 2]" 1 809 1 115 LEU QD 1 118 MET H 6.000 . 6.000 3.668 3.532 3.824 . 0 0 "[ . 1 . 2]" 1 810 1 116 HIS QB 1 118 MET H 5.500 . 5.500 4.600 4.480 4.790 . 0 0 "[ . 1 . 2]" 1 811 1 116 HIS H 1 118 MET H 5.000 . 5.000 4.007 3.924 4.167 . 0 0 "[ . 1 . 2]" 1 812 1 117 GLU QB 1 118 MET H 3.300 . 3.300 2.867 2.626 2.949 . 0 0 "[ . 1 . 2]" 1 813 1 118 MET H 1 119 CYS H 2.800 . 2.800 2.811 2.769 2.834 0.034 4 0 "[ . 1 . 2]" 1 814 1 118 MET H 1 120 GLY H 5.000 . 5.000 3.715 3.576 3.953 . 0 0 "[ . 1 . 2]" 1 815 1 119 CYS HA 1 121 ILE H 5.000 . 5.000 3.993 3.455 4.296 . 0 0 "[ . 1 . 2]" 1 816 1 119 CYS HA 1 124 LEU HG 5.000 . 5.000 4.016 2.777 5.004 0.004 4 0 "[ . 1 . 2]" 1 817 1 119 CYS H 1 119 CYS QB 3.500 . 3.500 2.379 2.117 2.733 . 0 0 "[ . 1 . 2]" 1 818 1 119 CYS QB 1 120 GLY H . . 4.000 3.051 2.785 3.568 . 0 0 "[ . 1 . 2]" 1 819 1 115 LEU MD1 1 119 CYS H 5.500 . 5.500 3.389 3.049 3.784 . 0 0 "[ . 1 . 2]" 1 820 1 116 HIS HA 1 119 CYS H 4.000 . 4.000 3.859 3.687 4.003 0.003 12 0 "[ . 1 . 2]" 1 821 1 118 MET QB 1 119 CYS H 4.000 . 4.000 2.283 2.084 2.597 . 0 0 "[ . 1 . 2]" 1 822 1 119 CYS H 1 120 GLY H . . 2.800 2.306 2.284 2.331 . 0 0 "[ . 1 . 2]" 1 823 1 119 CYS H 1 121 ILE H 5.000 . 5.000 4.412 3.968 4.900 . 0 0 "[ . 1 . 2]" 1 824 1 116 HIS HA 1 120 GLY H 5.000 . 5.000 3.933 3.446 4.653 . 0 0 "[ . 1 . 2]" 1 825 1 117 GLU HA 1 120 GLY H 4.000 . 4.000 3.339 2.975 3.771 . 0 0 "[ . 1 . 2]" 1 826 1 118 MET QB 1 120 GLY H 5.500 . 5.500 4.255 4.075 4.541 . 0 0 "[ . 1 . 2]" 1 827 1 120 GLY H 1 121 ILE H 3.500 . 3.500 2.934 2.418 3.336 . 0 0 "[ . 1 . 2]" 1 828 1 121 ILE HA 1 121 ILE QG . . 4.000 2.479 2.005 3.136 . 0 0 "[ . 1 . 2]" 1 829 1 121 ILE H 1 121 ILE HB 4.000 . 4.000 3.287 2.751 3.479 . 0 0 "[ . 1 . 2]" 1 830 1 121 ILE HB 1 122 GLU H 5.000 . 5.000 3.851 3.595 4.339 . 0 0 "[ . 1 . 2]" 1 831 1 121 ILE H 1 121 ILE QG 5.000 . 5.000 4.096 3.853 4.374 . 0 0 "[ . 1 . 2]" 1 832 1 121 ILE QG 1 122 GLU H 5.000 . 5.000 3.046 2.008 3.627 . 0 0 "[ . 1 . 2]" 1 833 1 121 ILE H 1 121 ILE MG 4.000 . 4.000 2.207 1.858 3.097 . 0 0 "[ . 1 . 2]" 1 834 1 121 ILE MG 1 122 GLU H 4.000 . 4.000 2.084 1.789 3.351 0.011 15 0 "[ . 1 . 2]" 1 835 1 117 GLU HA 1 121 ILE H 5.000 . 5.000 4.084 3.322 5.004 0.004 5 0 "[ . 1 . 2]" 1 836 1 119 CYS QB 1 121 ILE H 5.500 . 5.500 4.838 4.490 4.904 . 0 0 "[ . 1 . 2]" 1 837 1 121 ILE H 1 122 GLU H 4.000 . 4.000 2.566 1.975 4.059 0.059 6 0 "[ . 1 . 2]" 1 838 1 74 THR HB 1 122 GLU QB 5.500 . 5.500 3.720 1.984 4.908 . 0 0 "[ . 1 . 2]" 1 839 1 122 GLU H 1 122 GLU QB 3.300 . 3.300 2.524 2.124 2.991 . 0 0 "[ . 1 . 2]" 1 840 1 122 GLU H 1 122 GLU QG 4.000 . 4.000 3.126 1.959 3.616 . 0 0 "[ . 1 . 2]" 1 841 1 123 PRO QB 1 124 LEU H . . 3.300 2.817 2.762 2.917 . 0 0 "[ . 1 . 2]" 1 842 1 71 ILE QG 1 123 PRO QG 6.000 . 6.000 2.369 1.817 4.023 . 0 0 "[ . 1 . 2]" 1 843 1 123 PRO QG 1 124 LEU H 5.000 . 5.000 4.410 4.230 4.479 . 0 0 "[ . 1 . 2]" 1 844 1 124 LEU H 1 124 LEU QB 3.500 . 3.500 2.463 2.137 3.072 . 0 0 "[ . 1 . 2]" 1 845 1 124 LEU QB 1 125 GLU H . . 4.500 3.375 2.789 3.676 . 0 0 "[ . 1 . 2]" 1 846 1 124 LEU QD 1 182 LYS QB 6.500 . 6.500 3.288 2.073 3.894 . 0 0 "[ . 1 . 2]" 1 847 1 124 LEU H 1 124 LEU HG 3.500 . 3.500 2.929 1.988 3.503 0.003 20 0 "[ . 1 . 2]" 1 848 1 124 LEU HG 1 125 GLU H 5.000 . 5.000 4.661 4.039 4.973 . 0 0 "[ . 1 . 2]" 1 849 1 123 PRO HA 1 124 LEU H 2.800 . 2.800 2.286 2.250 2.302 . 0 0 "[ . 1 . 2]" 1 850 1 124 LEU H 1 125 GLU H 5.000 . 5.000 4.347 4.071 4.561 . 0 0 "[ . 1 . 2]" 1 851 1 124 LEU H 1 125 GLU QG 5.500 . 5.500 4.785 4.402 4.930 . 0 0 "[ . 1 . 2]" 1 852 1 125 GLU QB 1 126 GLU H . . 4.000 3.462 3.280 3.576 . 0 0 "[ . 1 . 2]" 1 853 1 125 GLU QB 1 128 ILE HB . . 3.500 2.043 1.847 2.389 . 0 0 "[ . 1 . 2]" 1 854 1 125 GLU QB 1 128 ILE MD 5.000 . 5.000 2.461 1.790 3.522 0.010 1 0 "[ . 1 . 2]" 1 855 1 125 GLU QB 1 128 ILE H 5.500 . 5.500 2.534 2.151 2.734 . 0 0 "[ . 1 . 2]" 1 856 1 118 MET QG 1 125 GLU QG 6.000 . 6.000 3.974 3.102 4.660 . 0 0 "[ . 1 . 2]" 1 857 1 125 GLU QG 1 128 ILE HB 5.000 . 5.000 3.623 3.318 4.014 . 0 0 "[ . 1 . 2]" 1 858 1 125 GLU QG 1 128 ILE MD 4.500 . 4.500 2.883 1.943 3.373 . 0 0 "[ . 1 . 2]" 1 859 1 125 GLU QG 1 128 ILE QG . . 5.500 3.139 1.976 4.165 . 0 0 "[ . 1 . 2]" 1 860 1 124 LEU HA 1 125 GLU H 2.800 . 2.800 2.168 2.134 2.253 . 0 0 "[ . 1 . 2]" 1 861 1 125 GLU H 1 128 ILE HB 5.000 . 5.000 4.644 4.084 5.006 0.006 2 0 "[ . 1 . 2]" 1 862 1 126 GLU HA 1 129 CYS QB 3.500 . 3.500 2.402 2.187 2.661 . 0 0 "[ . 1 . 2]" 1 863 1 126 GLU HA 1 130 SER H 5.000 . 5.000 3.928 3.737 4.179 . 0 0 "[ . 1 . 2]" 1 864 1 126 GLU HA 1 193 LEU QB 5.500 . 5.500 4.727 4.168 4.919 . 0 0 "[ . 1 . 2]" 1 865 1 126 GLU HA 1 193 LEU MD1 4.000 . 4.000 2.488 2.024 3.356 . 0 0 "[ . 1 . 2]" 1 866 1 126 GLU HA 1 193 LEU MD2 4.000 . 4.000 3.197 2.929 3.341 . 0 0 "[ . 1 . 2]" 1 867 1 126 GLU HA 1 193 LEU HG 5.000 . 5.000 3.035 2.469 3.375 . 0 0 "[ . 1 . 2]" 1 868 1 126 GLU QB 1 127 GLU H 5.500 . 5.500 2.565 2.376 2.734 . 0 0 "[ . 1 . 2]" 1 869 1 126 GLU QB 1 190 LEU QD . . 5.000 2.127 1.847 3.304 . 0 0 "[ . 1 . 2]" 1 870 1 126 GLU QB 1 193 LEU MD2 6.000 . 6.000 4.259 3.143 4.453 . 0 0 "[ . 1 . 2]" 1 871 1 126 GLU QG 1 192 ASN QB 6.000 . 6.000 3.059 2.091 4.767 . 0 0 "[ . 1 . 2]" 1 872 1 126 GLU QG 1 193 LEU QB 4.500 . 4.500 2.972 1.914 3.577 . 0 0 "[ . 1 . 2]" 1 873 1 126 GLU QG 1 193 LEU MD2 4.500 . 4.500 3.138 1.890 3.345 . 0 0 "[ . 1 . 2]" 1 874 1 126 GLU QG 1 193 LEU HG 4.000 . 4.000 1.899 1.793 1.993 0.007 18 0 "[ . 1 . 2]" 1 875 1 126 GLU QG 1 193 LEU H . . 5.000 3.171 2.735 4.098 . 0 0 "[ . 1 . 2]" 1 876 1 124 LEU QB 1 126 GLU H 5.500 . 5.500 4.759 4.408 4.911 . 0 0 "[ . 1 . 2]" 1 877 1 125 GLU HA 1 126 GLU H 2.800 . 2.800 2.143 2.130 2.167 . 0 0 "[ . 1 . 2]" 1 878 1 125 GLU H 1 126 GLU H 5.000 . 5.000 4.292 4.142 4.400 . 0 0 "[ . 1 . 2]" 1 879 1 126 GLU H 1 127 GLU H 2.800 . 2.800 2.498 2.380 2.745 . 0 0 "[ . 1 . 2]" 1 880 1 126 GLU H 1 128 ILE H 5.000 . 5.000 4.125 3.685 4.555 . 0 0 "[ . 1 . 2]" 1 881 1 127 GLU HA 1 130 SER QB 4.000 . 4.000 2.559 2.247 3.122 . 0 0 "[ . 1 . 2]" 1 882 1 127 GLU HA 1 130 SER H . . 3.500 3.533 3.514 3.552 0.052 4 0 "[ . 1 . 2]" 1 883 1 66 LEU QB 1 127 GLU QB 4.500 . 4.500 3.478 3.205 3.580 . 0 0 "[ . 1 . 2]" 1 884 1 127 GLU QB 1 128 ILE H 4.000 . 4.000 2.511 2.273 2.928 . 0 0 "[ . 1 . 2]" 1 885 1 127 GLU QG 1 128 ILE H 5.500 . 5.500 4.086 1.875 4.390 . 0 0 "[ . 1 . 2]" 1 886 1 125 GLU HA 1 127 GLU H 4.000 . 4.000 3.899 3.717 4.009 0.009 15 0 "[ . 1 . 2]" 1 887 1 125 GLU QB 1 127 GLU H 5.500 . 5.500 3.741 3.128 4.259 . 0 0 "[ . 1 . 2]" 1 888 1 127 GLU H 1 128 ILE MD 5.500 . 5.500 3.856 3.526 4.304 . 0 0 "[ . 1 . 2]" 1 889 1 127 GLU H 1 128 ILE H 2.800 . 2.800 2.764 2.647 2.814 0.014 9 0 "[ . 1 . 2]" 1 890 1 127 GLU H 1 130 SER QB 5.500 . 5.500 4.481 4.349 4.803 . 0 0 "[ . 1 . 2]" 1 891 1 59 PHE HZ 1 128 ILE HA 5.000 . 5.000 2.282 1.916 2.934 . 0 0 "[ . 1 . 2]" 1 892 1 128 ILE HA 1 128 ILE MD . . 4.000 2.637 1.896 3.121 . 0 0 "[ . 1 . 2]" 1 893 1 128 ILE HA 1 128 ILE MG . . 3.300 2.449 2.317 2.548 . 0 0 "[ . 1 . 2]" 1 894 1 128 ILE HA 1 131 GLY H . . 3.500 3.385 3.191 3.514 0.014 6 0 "[ . 1 . 2]" 1 895 1 128 ILE HA 1 132 LEU QD 6.000 . 6.000 3.188 2.984 4.219 . 0 0 "[ . 1 . 2]" 1 896 1 128 ILE HB 1 129 CYS H . . 2.800 2.448 2.168 2.642 . 0 0 "[ . 1 . 2]" 1 897 1 59 PHE QE 1 128 ILE MD 6.500 . 6.500 3.612 2.726 4.076 . 0 0 "[ . 1 . 2]" 1 898 1 59 PHE HZ 1 128 ILE MD 5.500 . 5.500 4.306 3.643 4.600 . 0 0 "[ . 1 . 2]" 1 899 1 63 LEU QB 1 128 ILE MD 6.000 . 6.000 3.916 3.366 4.305 . 0 0 "[ . 1 . 2]" 1 900 1 63 LEU MD2 1 128 ILE MD 6.000 . 6.000 2.669 1.813 3.244 . 0 0 "[ . 1 . 2]" 1 901 1 127 GLU HA 1 128 ILE MD 5.500 . 5.500 4.398 4.132 4.570 . 0 0 "[ . 1 . 2]" 1 902 1 127 GLU QB 1 128 ILE MD 6.000 . 6.000 2.373 2.000 2.642 . 0 0 "[ . 1 . 2]" 1 903 1 128 ILE H 1 128 ILE MD 4.000 . 4.000 2.063 1.845 2.489 . 0 0 "[ . 1 . 2]" 1 904 1 125 GLU QB 1 128 ILE QG 5.500 . 5.500 2.783 1.780 3.531 0.020 8 0 "[ . 1 . 2]" 1 905 1 128 ILE H 1 128 ILE QG 3.500 . 3.500 2.825 2.206 3.150 . 0 0 "[ . 1 . 2]" 1 906 1 59 PHE QE 1 128 ILE MG 6.000 . 6.000 3.659 3.362 3.994 . 0 0 "[ . 1 . 2]" 1 907 1 59 PHE HZ 1 128 ILE MG 5.500 . 5.500 2.856 2.438 3.260 . 0 0 "[ . 1 . 2]" 1 908 1 63 LEU QB 1 128 ILE MG 6.000 . 6.000 4.076 3.763 4.454 . 0 0 "[ . 1 . 2]" 1 909 1 78 ILE HA 1 128 ILE MG 5.500 . 5.500 3.881 3.688 4.211 . 0 0 "[ . 1 . 2]" 1 910 1 125 GLU QB 1 128 ILE MG 6.000 . 6.000 3.336 2.977 3.573 . 0 0 "[ . 1 . 2]" 1 911 1 128 ILE H 1 128 ILE MG 5.500 3.300 5.500 3.748 3.707 3.774 . 0 0 "[ . 1 . 2]" 1 912 1 128 ILE MG 1 129 CYS H . . 4.000 3.216 3.047 3.345 . 0 0 "[ . 1 . 2]" 1 913 1 128 ILE H 1 129 CYS H 2.800 . 2.800 2.681 2.604 2.721 . 0 0 "[ . 1 . 2]" 1 914 1 129 CYS HA 1 132 LEU QB 5.500 . 5.500 2.793 2.479 3.105 . 0 0 "[ . 1 . 2]" 1 915 1 129 CYS QB 1 130 SER H . . 3.300 2.927 2.845 2.974 . 0 0 "[ . 1 . 2]" 1 916 1 129 CYS QB 1 133 ILE MD 6.000 . 6.000 3.624 3.216 4.105 . 0 0 "[ . 1 . 2]" 1 917 1 129 CYS QB 1 133 ILE QG 6.000 . 6.000 4.539 4.197 4.765 . 0 0 "[ . 1 . 2]" 1 918 1 129 CYS QB 1 179 LEU QD . . 6.000 2.365 1.857 2.836 . 0 0 "[ . 1 . 2]" 1 919 1 129 CYS QB 1 193 LEU MD1 4.500 . 4.500 3.027 2.117 3.339 . 0 0 "[ . 1 . 2]" 1 920 1 129 CYS QB 1 193 LEU HG 5.500 . 5.500 3.613 3.266 4.061 . 0 0 "[ . 1 . 2]" 1 921 1 125 GLU HA 1 129 CYS H 5.000 . 5.000 4.886 4.660 5.010 0.010 8 0 "[ . 1 . 2]" 1 922 1 125 GLU QB 1 129 CYS H 4.000 . 4.000 3.099 2.910 3.317 . 0 0 "[ . 1 . 2]" 1 923 1 125 GLU H 1 129 CYS H 5.000 . 5.000 4.790 4.320 5.033 0.033 15 0 "[ . 1 . 2]" 1 924 1 126 GLU HA 1 129 CYS H 3.500 . 3.500 3.533 3.518 3.547 0.047 4 0 "[ . 1 . 2]" 1 925 1 127 GLU HA 1 129 CYS H 5.000 . 5.000 4.738 4.595 4.898 . 0 0 "[ . 1 . 2]" 1 926 1 127 GLU H 1 129 CYS H 5.000 . 5.000 4.195 3.947 4.426 . 0 0 "[ . 1 . 2]" 1 927 1 128 ILE MD 1 129 CYS H 5.000 . 5.000 3.964 3.729 4.219 . 0 0 "[ . 1 . 2]" 1 928 1 128 ILE QG 1 129 CYS H 5.500 . 5.500 4.166 3.640 4.448 . 0 0 "[ . 1 . 2]" 1 929 1 129 CYS H 1 130 SER QB 5.500 . 5.500 4.434 4.315 4.708 . 0 0 "[ . 1 . 2]" 1 930 1 129 CYS H 1 130 SER H 2.800 . 2.800 2.617 2.544 2.703 . 0 0 "[ . 1 . 2]" 1 931 1 129 CYS H 1 131 GLY H 5.000 . 5.000 4.342 4.054 4.632 . 0 0 "[ . 1 . 2]" 1 932 1 130 SER HA 1 132 LEU H 5.000 . 5.000 4.729 4.459 5.001 0.001 13 0 "[ . 1 . 2]" 1 933 1 130 SER HA 1 133 ILE HB 3.500 . 3.500 3.109 2.707 3.505 0.005 18 0 "[ . 1 . 2]" 1 934 1 130 SER HA 1 133 ILE MD 5.500 . 5.500 3.894 3.463 4.398 . 0 0 "[ . 1 . 2]" 1 935 1 130 SER HA 1 196 THR MG 5.500 . 5.500 3.204 2.873 3.546 . 0 0 "[ . 1 . 2]" 1 936 1 130 SER QB 1 131 GLY H 5.500 . 5.500 2.667 2.286 3.350 . 0 0 "[ . 1 . 2]" 1 937 1 126 GLU QG 1 130 SER H 5.500 . 5.500 4.258 3.957 4.926 . 0 0 "[ . 1 . 2]" 1 938 1 127 GLU H 1 130 SER H 5.000 . 5.000 4.524 4.443 4.686 . 0 0 "[ . 1 . 2]" 1 939 1 128 ILE HB 1 130 SER H 5.000 . 5.000 4.674 4.442 4.823 . 0 0 "[ . 1 . 2]" 1 940 1 128 ILE MG 1 130 SER H 5.500 . 5.500 4.605 4.592 4.628 . 0 0 "[ . 1 . 2]" 1 941 1 128 ILE H 1 130 SER H 5.000 . 5.000 3.785 3.569 3.919 . 0 0 "[ . 1 . 2]" 1 942 1 130 SER H 1 131 GLY H 2.800 . 2.800 2.501 2.374 2.633 . 0 0 "[ . 1 . 2]" 1 943 1 130 SER H 1 193 LEU HG 5.000 . 5.000 4.647 4.279 5.007 0.007 15 0 "[ . 1 . 2]" 1 944 1 59 PHE QD 1 131 GLY QA 6.500 . 6.500 3.560 3.351 3.673 . 0 0 "[ . 1 . 2]" 1 945 1 59 PHE QE 1 131 GLY QA 6.500 . 6.500 2.795 2.570 2.867 . 0 0 "[ . 1 . 2]" 1 946 1 131 GLY QA 1 134 GLU QB 6.000 . 6.000 2.553 2.277 2.923 . 0 0 "[ . 1 . 2]" 1 947 1 131 GLY QA 1 134 GLU H 5.500 . 5.500 3.312 3.195 3.470 . 0 0 "[ . 1 . 2]" 1 948 1 59 PHE QD 1 131 GLY H 6.000 . 6.000 5.257 4.928 5.353 . 0 0 "[ . 1 . 2]" 1 949 1 127 GLU HA 1 131 GLY H 5.000 . 5.000 4.184 3.882 4.453 . 0 0 "[ . 1 . 2]" 1 950 1 131 GLY H 1 132 LEU H 2.800 . 2.800 2.638 2.498 2.779 . 0 0 "[ . 1 . 2]" 1 951 1 132 LEU HA 1 132 LEU QD . . 3.800 2.568 1.718 2.828 0.082 13 0 "[ . 1 . 2]" 1 952 1 132 LEU HA 1 135 GLN H 5.000 . 5.000 3.483 3.256 3.688 . 0 0 "[ . 1 . 2]" 1 953 1 132 LEU HA 1 136 LEU H . . 4.000 3.883 3.546 4.008 0.008 17 0 "[ . 1 . 2]" 1 954 1 59 PHE QE 1 132 LEU QB 6.500 . 6.500 3.766 3.373 4.130 . 0 0 "[ . 1 . 2]" 1 955 1 59 PHE HZ 1 132 LEU QB 5.500 . 5.500 3.802 3.344 4.372 . 0 0 "[ . 1 . 2]" 1 956 1 132 LEU H 1 132 LEU QB 3.500 . 3.500 2.146 2.037 2.256 . 0 0 "[ . 1 . 2]" 1 957 1 59 PHE QD 1 132 LEU QD 7.000 . 7.000 3.716 3.222 4.089 . 0 0 "[ . 1 . 2]" 1 958 1 59 PHE HZ 1 132 LEU QD 6.000 . 6.000 2.059 1.834 3.161 . 0 0 "[ . 1 . 2]" 1 959 1 63 LEU MD2 1 132 LEU QD 6.500 . 6.500 2.818 2.466 3.410 . 0 0 "[ . 1 . 2]" 1 960 1 111 LEU MD1 1 132 LEU QD 4.300 . 4.300 2.090 1.699 2.659 0.101 13 0 "[ . 1 . 2]" 1 961 1 115 LEU HA 1 132 LEU QD 6.000 . 6.000 3.368 2.833 4.462 . 0 0 "[ . 1 . 2]" 1 962 1 132 LEU H 1 132 LEU QD 3.800 . 3.800 2.211 1.934 2.830 . 0 0 "[ . 1 . 2]" 1 963 1 59 PHE HZ 1 132 LEU HG 5.000 . 5.000 4.473 3.966 5.006 0.006 13 0 "[ . 1 . 2]" 1 964 1 81 VAL MG1 1 132 LEU HG 5.500 . 5.500 2.389 2.168 2.606 . 0 0 "[ . 1 . 2]" 1 965 1 111 LEU MD1 1 132 LEU HG 5.500 . 5.500 2.692 2.196 3.003 . 0 0 "[ . 1 . 2]" 1 966 1 130 SER H 1 132 LEU H 5.000 . 5.000 4.059 3.810 4.304 . 0 0 "[ . 1 . 2]" 1 967 1 132 LEU H 1 134 GLU H 5.000 . 5.000 4.076 3.903 4.268 . 0 0 "[ . 1 . 2]" 1 968 1 133 ILE HA 1 172 PHE QE 6.000 . 6.000 3.134 2.447 3.781 . 0 0 "[ . 1 . 2]" 1 969 1 133 ILE HB 1 133 ILE MD . . 3.300 2.429 2.363 2.490 . 0 0 "[ . 1 . 2]" 1 970 1 133 ILE H 1 133 ILE MD 5.500 . 5.500 3.969 3.895 4.019 . 0 0 "[ . 1 . 2]" 1 971 1 133 ILE MD 1 176 LEU MD2 4.500 . 4.500 1.833 1.713 2.062 0.087 7 0 "[ . 1 . 2]" 1 972 1 133 ILE H 1 133 ILE QG 3.500 . 3.500 3.144 3.139 3.149 . 0 0 "[ . 1 . 2]" 1 973 1 133 ILE QG 1 172 PHE QE 6.500 . 6.500 3.065 2.361 3.760 . 0 0 "[ . 1 . 2]" 1 974 1 133 ILE QG 1 176 LEU MD2 5.500 . 5.500 2.052 1.816 2.519 . 0 0 "[ . 1 . 2]" 1 975 1 133 ILE QG 1 179 LEU QD . . 5.000 2.804 2.314 3.309 . 0 0 "[ . 1 . 2]" 1 976 1 133 ILE H 1 133 ILE MG 4.000 . 4.000 3.387 3.377 3.402 . 0 0 "[ . 1 . 2]" 1 977 1 133 ILE MG 1 134 GLU H 4.000 . 4.000 2.629 2.296 2.847 . 0 0 "[ . 1 . 2]" 1 978 1 133 ILE MG 1 172 PHE QE 5.000 . 5.000 3.551 3.190 3.713 . 0 0 "[ . 1 . 2]" 1 979 1 133 ILE MG 1 172 PHE HZ 5.000 . 5.000 3.707 3.013 4.166 . 0 0 "[ . 1 . 2]" 1 980 1 132 LEU QB 1 133 ILE H 4.000 . 4.000 2.642 2.456 2.795 . 0 0 "[ . 1 . 2]" 1 981 1 133 ILE H 1 134 GLU H 2.800 . 2.800 2.598 2.484 2.691 . 0 0 "[ . 1 . 2]" 1 982 1 133 ILE H 1 135 GLN H 5.000 . 5.000 4.134 3.862 4.386 . 0 0 "[ . 1 . 2]" 1 983 1 133 ILE H 1 136 LEU H 5.000 . 5.000 4.781 4.638 4.945 . 0 0 "[ . 1 . 2]" 1 984 1 134 GLU HA 1 137 TYR QB 5.500 . 5.500 2.593 2.356 3.027 . 0 0 "[ . 1 . 2]" 1 985 1 134 GLU HA 1 137 TYR QD 6.000 . 6.000 3.965 3.242 4.948 . 0 0 "[ . 1 . 2]" 1 986 1 134 GLU HA 1 137 TYR H 3.500 . 3.500 3.426 3.252 3.528 0.028 18 0 "[ . 1 . 2]" 1 987 1 134 GLU HA 1 200 ILE MD 5.500 . 5.500 4.569 4.281 4.596 . 0 0 "[ . 1 . 2]" 1 988 1 134 GLU HA 1 200 ILE MG 5.500 . 5.500 3.052 2.713 3.331 . 0 0 "[ . 1 . 2]" 1 989 1 134 GLU QB 1 135 GLN H . . 3.300 2.654 2.524 2.855 . 0 0 "[ . 1 . 2]" 1 990 1 134 GLU QB 1 196 THR MG 6.000 . 6.000 3.477 2.842 3.799 . 0 0 "[ . 1 . 2]" 1 991 1 134 GLU QG 1 196 THR HA 5.500 . 5.500 4.598 4.124 4.902 . 0 0 "[ . 1 . 2]" 1 992 1 134 GLU QG 1 196 THR MG . . 4.500 2.161 1.730 2.701 0.070 19 0 "[ . 1 . 2]" 1 993 1 134 GLU H 1 136 LEU H 5.000 . 5.000 4.043 3.800 4.333 . 0 0 "[ . 1 . 2]" 1 994 1 56 LEU HG 1 135 GLN HA 5.000 . 5.000 5.000 4.921 5.013 0.013 6 0 "[ . 1 . 2]" 1 995 1 88 LEU MD2 1 135 GLN QB 5.500 . 5.500 3.234 2.811 3.564 . 0 0 "[ . 1 . 2]" 1 996 1 135 GLN QB 1 136 LEU H . . 4.000 2.616 2.364 3.481 . 0 0 "[ . 1 . 2]" 1 997 1 59 PHE QE 1 135 GLN QG 6.500 . 6.500 2.967 2.484 3.283 . 0 0 "[ . 1 . 2]" 1 998 1 59 PHE HZ 1 135 GLN QG 5.500 . 5.500 4.776 4.361 4.903 . 0 0 "[ . 1 . 2]" 1 999 1 135 GLN H 1 135 GLN QG . . 4.000 2.305 1.938 2.695 . 0 0 "[ . 1 . 2]" 1 1000 1 135 GLN QG 1 136 LEU H 5.500 . 5.500 3.887 2.049 4.221 . 0 0 "[ . 1 . 2]" 1 1001 1 134 GLU QG 1 135 GLN H 5.500 . 5.500 4.345 4.179 4.533 . 0 0 "[ . 1 . 2]" 1 1002 1 134 GLU H 1 135 GLN H 2.800 . 2.800 2.508 2.353 2.695 . 0 0 "[ . 1 . 2]" 1 1003 1 135 GLN H 1 136 LEU QB 5.500 . 5.500 4.379 4.130 4.564 . 0 0 "[ . 1 . 2]" 1 1004 1 135 GLN H 1 136 LEU MD1 5.500 . 5.500 4.545 4.313 4.604 . 0 0 "[ . 1 . 2]" 1 1005 1 135 GLN H 1 136 LEU H 2.800 . 2.800 2.659 2.508 2.800 0.000 5 0 "[ . 1 . 2]" 1 1006 1 136 LEU HA 1 136 LEU MD2 4.000 . 4.000 2.989 2.423 3.334 . 0 0 "[ . 1 . 2]" 1 1007 1 136 LEU HA 1 139 LEU H . . 3.500 3.380 3.240 3.503 0.003 9 0 "[ . 1 . 2]" 1 1008 1 136 LEU QB 1 172 PHE QD 6.500 . 6.500 3.089 1.977 4.831 . 0 0 "[ . 1 . 2]" 1 1009 1 108 GLY QA 1 136 LEU MD2 5.000 . 5.000 2.256 1.836 2.771 . 0 0 "[ . 1 . 2]" 1 1010 1 111 LEU QB 1 136 LEU MD2 6.500 . 6.500 3.660 2.496 4.588 . 0 0 "[ . 1 . 2]" 1 1011 1 136 LEU MD2 1 172 PHE QE 5.500 . 5.500 3.779 3.253 4.091 . 0 0 "[ . 1 . 2]" 1 1012 1 111 LEU QB 1 136 LEU HG 5.500 . 5.500 4.389 4.079 4.886 . 0 0 "[ . 1 . 2]" 1 1013 1 136 LEU H 1 136 LEU HG 5.000 . 5.000 3.633 2.691 4.459 . 0 0 "[ . 1 . 2]" 1 1014 1 132 LEU QB 1 136 LEU H 5.500 . 5.500 4.763 4.407 4.906 . 0 0 "[ . 1 . 2]" 1 1015 1 134 GLU QB 1 136 LEU H 5.500 . 5.500 4.718 4.509 4.898 . 0 0 "[ . 1 . 2]" 1 1016 1 137 TYR HA 1 137 TYR QD 4.500 . 4.500 2.523 2.152 2.985 . 0 0 "[ . 1 . 2]" 1 1017 1 137 TYR HA 1 140 ILE HB 3.000 . 3.000 3.016 3.010 3.029 0.029 5 0 "[ . 1 . 2]" 1 1018 1 137 TYR HA 1 140 ILE MD 5.500 . 5.500 3.837 3.570 4.025 . 0 0 "[ . 1 . 2]" 1 1019 1 137 TYR HA 1 140 ILE MG . . 4.000 2.064 1.860 2.471 . 0 0 "[ . 1 . 2]" 1 1020 1 137 TYR HA 1 172 PHE QE 6.000 . 6.000 3.762 2.974 4.141 . 0 0 "[ . 1 . 2]" 1 1021 1 137 TYR HA 1 172 PHE HZ 5.000 . 5.000 3.664 3.025 3.893 . 0 0 "[ . 1 . 2]" 1 1022 1 137 TYR HA 1 200 ILE HB 5.000 . 5.000 4.659 4.215 5.008 0.008 7 0 "[ . 1 . 2]" 1 1023 1 137 TYR QB 1 138 LYS H . . 4.000 2.892 2.696 3.042 . 0 0 "[ . 1 . 2]" 1 1024 1 137 TYR QB 1 172 PHE QE 6.500 . 6.500 3.345 2.685 3.853 . 0 0 "[ . 1 . 2]" 1 1025 1 137 TYR QB 1 172 PHE HZ 4.000 . 4.000 2.606 2.107 3.350 . 0 0 "[ . 1 . 2]" 1 1026 1 137 TYR QB 1 200 ILE HB 5.500 . 5.500 3.072 2.517 3.514 . 0 0 "[ . 1 . 2]" 1 1027 1 137 TYR QB 1 200 ILE MG 6.000 . 6.000 2.032 1.841 2.263 . 0 0 "[ . 1 . 2]" 1 1028 1 137 TYR QD 1 138 LYS H 6.000 . 6.000 4.105 3.729 4.376 . 0 0 "[ . 1 . 2]" 1 1029 1 137 TYR QD 1 140 ILE HB 6.000 . 6.000 4.489 3.948 5.136 . 0 0 "[ . 1 . 2]" 1 1030 1 137 TYR QD 1 140 ILE MG . . 5.000 2.405 1.930 3.191 . 0 0 "[ . 1 . 2]" 1 1031 1 137 TYR QD 1 172 PHE QE 7.000 . 7.000 2.931 2.116 4.329 . 0 0 "[ . 1 . 2]" 1 1032 1 137 TYR QD 1 172 PHE HZ 6.000 . 6.000 2.902 2.009 4.321 . 0 0 "[ . 1 . 2]" 1 1033 1 137 TYR QD 1 200 ILE HB 6.000 . 6.000 2.688 2.071 3.535 . 0 0 "[ . 1 . 2]" 1 1034 1 137 TYR QD 1 200 ILE MD 6.500 . 6.500 4.135 3.595 4.738 . 0 0 "[ . 1 . 2]" 1 1035 1 137 TYR QD 1 200 ILE MG 4.000 . 4.000 2.594 2.099 2.883 . 0 0 "[ . 1 . 2]" 1 1036 1 137 TYR QE 1 141 THR MG 5.000 . 5.000 3.307 2.811 3.712 . 0 0 "[ . 1 . 2]" 1 1037 1 137 TYR QE 1 200 ILE HA 6.000 . 6.000 2.937 2.655 3.210 . 0 0 "[ . 1 . 2]" 1 1038 1 137 TYR QE 1 200 ILE HB 6.000 . 6.000 3.443 2.923 4.517 . 0 0 "[ . 1 . 2]" 1 1039 1 137 TYR QE 1 200 ILE MG . . 5.000 3.499 2.995 3.713 . 0 0 "[ . 1 . 2]" 1 1040 1 133 ILE MG 1 137 TYR H 5.500 . 5.500 4.377 4.014 4.549 . 0 0 "[ . 1 . 2]" 1 1041 1 134 GLU H 1 137 TYR H 5.000 . 5.000 4.636 4.418 4.776 . 0 0 "[ . 1 . 2]" 1 1042 1 136 LEU QB 1 137 TYR H 3.300 . 3.300 2.799 2.674 2.973 . 0 0 "[ . 1 . 2]" 1 1043 1 136 LEU HG 1 137 TYR H 5.000 . 5.000 4.820 4.413 4.971 . 0 0 "[ . 1 . 2]" 1 1044 1 137 TYR H 1 138 LYS H 2.800 . 2.800 2.545 2.461 2.621 . 0 0 "[ . 1 . 2]" 1 1045 1 137 TYR H 1 139 LEU H 5.000 . 5.000 4.084 3.964 4.206 . 0 0 "[ . 1 . 2]" 1 1046 1 137 TYR H 1 172 PHE HZ 5.000 . 5.000 4.359 3.541 5.013 0.013 16 0 "[ . 1 . 2]" 1 1047 1 137 TYR H 1 200 ILE MG 5.500 . 5.500 3.999 3.628 4.274 . 0 0 "[ . 1 . 2]" 1 1048 1 138 LYS HA 1 138 LYS QE 5.500 . 5.500 4.447 4.072 4.658 . 0 0 "[ . 1 . 2]" 1 1049 1 138 LYS HA 1 138 LYS QG 4.000 . 4.000 2.332 2.148 2.718 . 0 0 "[ . 1 . 2]" 1 1050 1 138 LYS HA 1 141 THR H . . 3.600 3.618 3.606 3.639 0.039 12 0 "[ . 1 . 2]" 1 1051 1 52 THR HB 1 138 LYS QB 5.500 . 5.500 4.032 3.237 4.771 . 0 0 "[ . 1 . 2]" 1 1052 1 52 THR HB 1 138 LYS QD 5.500 . 5.500 3.715 2.368 4.901 . 0 0 "[ . 1 . 2]" 1 1053 1 135 GLN HA 1 138 LYS QD 5.500 . 5.500 3.322 2.259 4.900 . 0 0 "[ . 1 . 2]" 1 1054 1 138 LYS H 1 138 LYS QD 5.500 . 5.500 4.016 3.087 4.609 . 0 0 "[ . 1 . 2]" 1 1055 1 138 LYS H 1 138 LYS QG . . 4.000 2.816 2.201 3.327 . 0 0 "[ . 1 . 2]" 1 1056 1 138 LYS QG 1 139 LEU H 5.500 . 5.500 4.320 3.956 4.511 . 0 0 "[ . 1 . 2]" 1 1057 1 134 GLU HA 1 138 LYS H 5.000 . 5.000 4.413 3.957 4.739 . 0 0 "[ . 1 . 2]" 1 1058 1 138 LYS H 1 139 LEU H 2.800 . 2.800 2.446 2.320 2.589 . 0 0 "[ . 1 . 2]" 1 1059 1 139 LEU HA 1 139 LEU QD . . 4.000 2.218 1.874 2.820 . 0 0 "[ . 1 . 2]" 1 1060 1 139 LEU HA 1 142 ALA H . . 4.000 3.337 3.173 3.530 . 0 0 "[ . 1 . 2]" 1 1061 1 139 LEU QB 1 140 ILE H . . 4.000 2.714 2.548 2.822 . 0 0 "[ . 1 . 2]" 1 1062 1 108 GLY QA 1 139 LEU QD 6.500 . 6.500 3.606 2.562 4.292 . 0 0 "[ . 1 . 2]" 1 1063 1 139 LEU QD 1 143 SER QB 5.000 . 5.000 2.568 1.898 3.307 . 0 0 "[ . 1 . 2]" 1 1064 1 135 GLN HA 1 139 LEU H 5.000 . 5.000 4.615 4.333 4.793 . 0 0 "[ . 1 . 2]" 1 1065 1 139 LEU H 1 140 ILE H 2.800 . 2.800 2.390 2.294 2.503 . 0 0 "[ . 1 . 2]" 1 1066 1 140 ILE HA 1 140 ILE QG 4.000 . 4.000 2.086 2.000 2.202 . 0 0 "[ . 1 . 2]" 1 1067 1 140 ILE HA 1 143 SER QB 4.000 . 4.000 3.093 2.838 3.424 . 0 0 "[ . 1 . 2]" 1 1068 1 140 ILE HA 1 143 SER H 5.000 . 5.000 4.016 3.828 4.159 . 0 0 "[ . 1 . 2]" 1 1069 1 140 ILE HA 1 165 TYR QE 6.000 . 6.000 3.670 2.647 4.272 . 0 0 "[ . 1 . 2]" 1 1070 1 140 ILE HA 1 168 LEU HG 5.000 . 5.000 4.162 3.853 4.619 . 0 0 "[ . 1 . 2]" 1 1071 1 140 ILE H 1 140 ILE HB 3.500 . 3.500 2.315 2.233 2.361 . 0 0 "[ . 1 . 2]" 1 1072 1 140 ILE HB 1 141 THR H 5.000 . 5.000 3.778 3.592 3.905 . 0 0 "[ . 1 . 2]" 1 1073 1 140 ILE MD 1 165 TYR QE 6.500 . 6.500 4.193 3.072 4.762 . 0 0 "[ . 1 . 2]" 1 1074 1 140 ILE MD 1 168 LEU HG 4.500 . 4.500 2.587 2.299 3.041 . 0 0 "[ . 1 . 2]" 1 1075 1 140 ILE MD 1 169 LEU HA 4.000 . 4.000 2.106 1.922 2.503 . 0 0 "[ . 1 . 2]" 1 1076 1 140 ILE MD 1 169 LEU QB 6.000 . 6.000 2.819 2.433 3.303 . 0 0 "[ . 1 . 2]" 1 1077 1 140 ILE MD 1 169 LEU H 5.500 . 5.500 3.880 3.620 4.227 . 0 0 "[ . 1 . 2]" 1 1078 1 140 ILE MD 1 169 LEU QD 4.500 . 4.500 1.843 1.742 2.185 0.058 11 0 "[ . 1 . 2]" 1 1079 1 140 ILE MD 1 172 PHE QB 6.000 . 6.000 2.607 2.445 2.748 . 0 0 "[ . 1 . 2]" 1 1080 1 140 ILE MD 1 172 PHE QE 6.500 . 6.500 3.228 2.785 3.720 . 0 0 "[ . 1 . 2]" 1 1081 1 140 ILE MD 1 172 PHE H 5.500 . 5.500 4.447 4.280 4.582 . 0 0 "[ . 1 . 2]" 1 1082 1 140 ILE MD 1 172 PHE HZ 5.500 . 5.500 4.559 4.407 4.588 . 0 0 "[ . 1 . 2]" 1 1083 1 140 ILE H 1 140 ILE QG 5.000 . 5.000 3.924 3.867 3.975 . 0 0 "[ . 1 . 2]" 1 1084 1 140 ILE QG 1 141 THR H 5.500 . 5.500 4.217 4.126 4.279 . 0 0 "[ . 1 . 2]" 1 1085 1 140 ILE QG 1 168 LEU HG 5.500 . 5.500 3.035 2.417 3.554 . 0 0 "[ . 1 . 2]" 1 1086 1 140 ILE MG 1 172 PHE QE 5.000 . 5.000 3.361 2.823 3.713 . 0 0 "[ . 1 . 2]" 1 1087 1 140 ILE MG 1 172 PHE HZ 5.500 . 5.500 4.117 3.750 4.462 . 0 0 "[ . 1 . 2]" 1 1088 1 137 TYR HA 1 140 ILE H 3.500 . 3.500 3.297 3.153 3.454 . 0 0 "[ . 1 . 2]" 1 1089 1 140 ILE H 1 141 THR MG 5.500 . 5.500 4.043 3.663 4.531 . 0 0 "[ . 1 . 2]" 1 1090 1 140 ILE H 1 141 THR H 2.800 . 2.800 2.556 2.483 2.632 . 0 0 "[ . 1 . 2]" 1 1091 1 140 ILE H 1 143 SER QB 5.500 . 5.500 4.868 4.713 4.918 . 0 0 "[ . 1 . 2]" 1 1092 1 140 ILE H 1 143 SER H 5.000 . 5.000 4.829 4.759 4.938 . 0 0 "[ . 1 . 2]" 1 1093 1 141 THR HA 1 144 ARG QB 5.500 . 5.500 2.656 2.446 2.941 . 0 0 "[ . 1 . 2]" 1 1094 1 141 THR HB 1 142 ALA H 5.000 . 5.000 3.756 3.406 4.051 . 0 0 "[ . 1 . 2]" 1 1095 1 137 TYR QD 1 141 THR MG 6.500 . 6.500 3.458 2.809 3.876 . 0 0 "[ . 1 . 2]" 1 1096 1 139 LEU QB 1 141 THR H 5.500 . 5.500 4.679 4.553 4.830 . 0 0 "[ . 1 . 2]" 1 1097 1 139 LEU H 1 141 THR H 5.000 . 5.000 3.924 3.773 4.018 . 0 0 "[ . 1 . 2]" 1 1098 1 140 ILE MG 1 141 THR H 4.000 . 4.000 2.029 1.923 2.251 . 0 0 "[ . 1 . 2]" 1 1099 1 141 THR H 1 142 ALA H 2.800 . 2.800 2.408 2.325 2.479 . 0 0 "[ . 1 . 2]" 1 1100 1 141 THR H 1 143 SER H 5.000 . 5.000 4.238 4.122 4.352 . 0 0 "[ . 1 . 2]" 1 1101 1 142 ALA HA 1 145 ARG QB 4.000 . 4.000 2.792 2.560 3.034 . 0 0 "[ . 1 . 2]" 1 1102 1 92 TYR HA 1 142 ALA MB 5.500 . 5.500 4.575 4.414 4.590 . 0 0 "[ . 1 . 2]" 1 1103 1 92 TYR QD 1 142 ALA MB 6.500 . 6.500 3.847 3.072 4.667 . 0 0 "[ . 1 . 2]" 1 1104 1 92 TYR QE 1 142 ALA MB 6.500 . 6.500 2.911 2.068 4.274 . 0 0 "[ . 1 . 2]" 1 1105 1 139 LEU HA 1 142 ALA MB 5.000 . 5.000 2.543 2.257 3.004 . 0 0 "[ . 1 . 2]" 1 1106 1 142 ALA H 1 142 ALA MB 3.300 . 3.300 2.167 2.092 2.251 . 0 0 "[ . 1 . 2]" 1 1107 1 142 ALA MB 1 143 SER H . . 3.300 2.296 2.147 2.488 . 0 0 "[ . 1 . 2]" 1 1108 1 139 LEU H 1 142 ALA H 5.000 . 5.000 4.646 4.457 4.887 . 0 0 "[ . 1 . 2]" 1 1109 1 140 ILE HA 1 142 ALA H 5.000 . 5.000 4.540 4.329 4.721 . 0 0 "[ . 1 . 2]" 1 1110 1 140 ILE H 1 142 ALA H 5.000 . 5.000 4.061 3.871 4.289 . 0 0 "[ . 1 . 2]" 1 1111 1 142 ALA H 1 143 SER H 2.800 . 2.800 2.741 2.617 2.805 0.005 5 0 "[ . 1 . 2]" 1 1112 1 143 SER HA 1 145 ARG H 5.000 . 5.000 4.070 3.851 4.412 . 0 0 "[ . 1 . 2]" 1 1113 1 143 SER HA 1 146 ILE HB 3.500 . 3.500 3.428 3.272 3.503 0.003 4 0 "[ . 1 . 2]" 1 1114 1 143 SER HA 1 146 ILE MD 5.000 . 5.000 2.776 1.949 3.480 . 0 0 "[ . 1 . 2]" 1 1115 1 143 SER HA 1 146 ILE QG 5.500 . 5.500 3.102 1.883 4.456 . 0 0 "[ . 1 . 2]" 1 1116 1 105 LEU MD1 1 143 SER QB 6.000 . 6.000 4.105 3.606 4.456 . 0 0 "[ . 1 . 2]" 1 1117 1 143 SER QB 1 165 TYR QD 6.500 . 6.500 3.098 2.075 4.254 . 0 0 "[ . 1 . 2]" 1 1118 1 143 SER QB 1 165 TYR QE 6.500 . 6.500 3.121 2.248 4.654 . 0 0 "[ . 1 . 2]" 1 1119 1 139 LEU HA 1 143 SER H 5.000 . 5.000 3.463 3.276 3.754 . 0 0 "[ . 1 . 2]" 1 1120 1 139 LEU QB 1 143 SER H 5.500 . 5.500 4.831 4.588 4.908 . 0 0 "[ . 1 . 2]" 1 1121 1 141 THR HA 1 143 SER H 5.000 . 5.000 4.935 4.809 5.009 0.009 3 0 "[ . 1 . 2]" 1 1122 1 143 SER H 1 144 ARG QB 5.500 . 5.500 4.487 4.435 4.544 . 0 0 "[ . 1 . 2]" 1 1123 1 143 SER H 1 146 ILE MD 5.500 . 5.500 4.231 3.711 4.592 . 0 0 "[ . 1 . 2]" 1 1124 1 144 ARG HA 1 144 ARG QG 4.000 . 4.000 2.462 2.262 2.541 . 0 0 "[ . 1 . 2]" 1 1125 1 144 ARG HA 1 147 LEU QB 4.000 . 4.000 2.659 2.356 2.960 . 0 0 "[ . 1 . 2]" 1 1126 1 144 ARG HA 1 147 LEU MD1 5.500 . 5.500 3.107 2.552 3.528 . 0 0 "[ . 1 . 2]" 1 1127 1 144 ARG HA 1 165 TYR QE 6.000 . 6.000 2.969 2.235 4.046 . 0 0 "[ . 1 . 2]" 1 1128 1 144 ARG QB 1 145 ARG H . . 4.000 2.816 2.508 3.015 . 0 0 "[ . 1 . 2]" 1 1129 1 144 ARG QB 1 147 LEU QB 6.000 . 6.000 4.490 4.184 4.732 . 0 0 "[ . 1 . 2]" 1 1130 1 141 THR HA 1 144 ARG QD 5.500 . 5.500 3.375 2.986 4.131 . 0 0 "[ . 1 . 2]" 1 1131 1 144 ARG QG 1 145 ARG HA 5.500 . 5.500 3.900 3.610 4.491 . 0 0 "[ . 1 . 2]" 1 1132 1 144 ARG QG 1 145 ARG H 5.500 . 5.500 3.931 3.635 4.277 . 0 0 "[ . 1 . 2]" 1 1133 1 144 ARG QG 1 148 GLU QG . . 4.500 2.803 1.919 3.566 . 0 0 "[ . 1 . 2]" 1 1134 1 144 ARG QG 1 165 TYR QE 5.500 . 5.500 3.455 3.017 3.966 . 0 0 "[ . 1 . 2]" 1 1135 1 140 ILE HA 1 144 ARG H 4.500 . 4.500 3.934 3.572 4.293 . 0 0 "[ . 1 . 2]" 1 1136 1 143 SER QB 1 144 ARG H 4.000 . 4.000 2.712 2.527 2.908 . 0 0 "[ . 1 . 2]" 1 1137 1 144 ARG H 1 145 ARG H 2.800 . 2.800 2.620 2.467 2.733 . 0 0 "[ . 1 . 2]" 1 1138 1 145 ARG HA 1 148 GLU QB 4.500 . 4.500 3.079 2.626 3.548 . 0 0 "[ . 1 . 2]" 1 1139 1 142 ALA MB 1 145 ARG QB 6.000 . 6.000 4.007 3.842 4.171 . 0 0 "[ . 1 . 2]" 1 1140 1 145 ARG H 1 145 ARG QD 5.500 . 5.500 4.342 3.556 4.699 . 0 0 "[ . 1 . 2]" 1 1141 1 145 ARG H 1 145 ARG QG 5.000 . 5.000 3.592 2.695 3.994 . 0 0 "[ . 1 . 2]" 1 1142 1 142 ALA H 1 145 ARG H 5.000 . 5.000 4.730 4.605 4.845 . 0 0 "[ . 1 . 2]" 1 1143 1 143 SER QB 1 145 ARG H 5.500 . 5.500 4.595 4.456 4.772 . 0 0 "[ . 1 . 2]" 1 1144 1 145 ARG H 1 146 ILE MD 5.500 . 5.500 3.531 3.137 3.969 . 0 0 "[ . 1 . 2]" 1 1145 1 145 ARG H 1 146 ILE QG 5.500 . 5.500 4.285 3.581 4.917 . 0 0 "[ . 1 . 2]" 1 1146 1 145 ARG H 1 146 ILE H 2.800 . 2.800 2.541 2.491 2.651 . 0 0 "[ . 1 . 2]" 1 1147 1 146 ILE HA 1 146 ILE MD 4.000 . 4.000 2.729 1.985 3.352 . 0 0 "[ . 1 . 2]" 1 1148 1 146 ILE HA 1 146 ILE QG . . 4.000 2.776 2.307 3.250 . 0 0 "[ . 1 . 2]" 1 1149 1 146 ILE HA 1 149 SER H . . 4.000 3.422 3.278 3.552 . 0 0 "[ . 1 . 2]" 1 1150 1 146 ILE H 1 146 ILE HB 3.500 . 3.500 2.678 2.519 2.869 . 0 0 "[ . 1 . 2]" 1 1151 1 146 ILE HB 1 147 LEU H . . 2.800 2.628 2.457 2.803 0.003 5 0 "[ . 1 . 2]" 1 1152 1 146 ILE H 1 146 ILE MD 5.500 . 5.500 2.230 1.903 2.691 . 0 0 "[ . 1 . 2]" 1 1153 1 146 ILE H 1 146 ILE QG 4.000 . 4.000 2.440 1.906 2.980 . 0 0 "[ . 1 . 2]" 1 1154 1 144 ARG HA 1 146 ILE H 5.000 . 5.000 4.165 3.947 4.458 . 0 0 "[ . 1 . 2]" 1 1155 1 145 ARG QG 1 146 ILE H 5.500 . 5.500 4.354 4.105 4.541 . 0 0 "[ . 1 . 2]" 1 1156 1 146 ILE H 1 147 LEU QB 5.500 . 5.500 4.162 4.019 4.259 . 0 0 "[ . 1 . 2]" 1 1157 1 146 ILE H 1 147 LEU H . . 2.800 2.501 2.367 2.611 . 0 0 "[ . 1 . 2]" 1 1158 1 147 LEU HA 1 147 LEU MD1 . . 4.000 3.269 3.185 3.338 . 0 0 "[ . 1 . 2]" 1 1159 1 147 LEU HA 1 147 LEU MD2 . . 4.000 3.293 3.175 3.334 . 0 0 "[ . 1 . 2]" 1 1160 1 147 LEU HA 1 147 LEU HG 3.500 . 3.500 2.099 2.080 2.160 . 0 0 "[ . 1 . 2]" 1 1161 1 147 LEU QB 1 148 GLU H . . 3.300 2.578 2.220 2.680 . 0 0 "[ . 1 . 2]" 1 1162 1 143 SER QB 1 147 LEU MD1 5.500 . 5.500 3.391 2.517 4.004 . 0 0 "[ . 1 . 2]" 1 1163 1 147 LEU MD1 1 161 LEU QB 6.000 . 6.000 2.136 1.897 2.576 . 0 0 "[ . 1 . 2]" 1 1164 1 147 LEU MD1 1 165 TYR HA 5.500 . 5.500 4.374 4.209 4.582 . 0 0 "[ . 1 . 2]" 1 1165 1 147 LEU MD1 1 165 TYR QB . . 3.500 2.394 2.110 2.587 . 0 0 "[ . 1 . 2]" 1 1166 1 147 LEU MD1 1 165 TYR QD 5.000 . 5.000 2.627 2.009 3.547 . 0 0 "[ . 1 . 2]" 1 1167 1 147 LEU MD1 1 165 TYR H 5.500 . 5.500 4.442 4.157 4.567 . 0 0 "[ . 1 . 2]" 1 1168 1 147 LEU H 1 147 LEU MD2 5.500 . 5.500 4.406 4.285 4.462 . 0 0 "[ . 1 . 2]" 1 1169 1 147 LEU MD2 1 162 ARG QD 6.000 . 6.000 3.579 2.188 4.450 . 0 0 "[ . 1 . 2]" 1 1170 1 147 LEU MD2 1 165 TYR QB 6.000 . 6.000 3.094 2.503 3.416 . 0 0 "[ . 1 . 2]" 1 1171 1 147 LEU H 1 147 LEU HG 5.000 . 5.000 3.786 3.480 4.193 . 0 0 "[ . 1 . 2]" 1 1172 1 144 ARG HA 1 147 LEU H 5.000 . 5.000 3.431 3.306 3.549 . 0 0 "[ . 1 . 2]" 1 1173 1 145 ARG H 1 147 LEU H 5.000 . 5.000 4.119 3.794 4.401 . 0 0 "[ . 1 . 2]" 1 1174 1 146 ILE MD 1 147 LEU H 5.500 . 5.500 3.899 3.485 4.347 . 0 0 "[ . 1 . 2]" 1 1175 1 146 ILE MG 1 147 LEU H 5.000 . 5.000 3.698 3.497 3.940 . 0 0 "[ . 1 . 2]" 1 1176 1 146 ILE QG 1 147 LEU H 5.500 . 5.500 3.960 3.488 4.415 . 0 0 "[ . 1 . 2]" 1 1177 1 147 LEU H 1 148 GLU H 2.800 . 2.800 2.733 2.555 2.802 0.002 5 0 "[ . 1 . 2]" 1 1178 1 147 LEU H 1 149 SER H 5.000 . 5.000 3.970 3.744 4.152 . 0 0 "[ . 1 . 2]" 1 1179 1 148 GLU H 1 148 GLU QG 4.000 . 4.000 2.575 1.990 3.089 . 0 0 "[ . 1 . 2]" 1 1180 1 144 ARG HA 1 148 GLU H 5.000 . 5.000 4.044 3.433 4.633 . 0 0 "[ . 1 . 2]" 1 1181 1 146 ILE HA 1 148 GLU H 5.000 . 5.000 4.547 4.402 4.821 . 0 0 "[ . 1 . 2]" 1 1182 1 147 LEU MD1 1 148 GLU H 5.500 . 5.500 4.522 4.176 4.591 . 0 0 "[ . 1 . 2]" 1 1183 1 147 LEU MD2 1 148 GLU H 5.500 . 5.500 4.458 3.624 4.584 . 0 0 "[ . 1 . 2]" 1 1184 1 148 GLU H 1 149 SER H 2.800 . 2.800 2.590 2.378 2.699 . 0 0 "[ . 1 . 2]" 1 1185 1 146 ILE MG 1 149 SER H 5.500 . 5.500 4.552 4.429 4.586 . 0 0 "[ . 1 . 2]" 1 1186 1 147 LEU HA 1 149 SER H 5.000 . 5.000 4.283 4.083 4.417 . 0 0 "[ . 1 . 2]" 1 1187 1 147 LEU QB 1 149 SER H 5.500 . 5.500 4.497 4.341 4.644 . 0 0 "[ . 1 . 2]" 1 1188 1 148 GLU QB 1 149 SER H 3.300 . 3.300 2.780 2.616 2.936 . 0 0 "[ . 1 . 2]" 1 1189 1 148 GLU QG 1 149 SER H 5.500 . 5.500 4.261 3.931 4.510 . 0 0 "[ . 1 . 2]" 1 1190 1 149 SER QB 1 150 CYS H 4.000 . 4.000 2.633 2.048 3.344 . 0 0 "[ . 1 . 2]" 1 1191 1 150 CYS H 1 151 ALA H 3.500 . 3.500 2.514 2.299 2.694 . 0 0 "[ . 1 . 2]" 1 1192 1 148 GLU HA 1 151 ALA MB 5.500 . 5.500 3.137 1.978 4.583 . 0 0 "[ . 1 . 2]" 1 1193 1 148 GLU HA 1 151 ALA H 5.000 . 5.000 3.447 2.879 4.657 . 0 0 "[ . 1 . 2]" 1 1194 1 149 SER HA 1 151 ALA H 5.000 . 5.000 4.395 3.976 5.005 0.005 18 0 "[ . 1 . 2]" 1 1195 1 151 ALA MB 1 152 ASP H 4.000 . 4.000 2.616 1.932 3.334 . 0 0 "[ . 1 . 2]" 1 1196 1 155 SER H 1 156 PRO QD 5.500 . 5.500 4.095 1.942 4.411 . 0 0 "[ . 1 . 2]" 1 1197 1 155 SER H 1 158 ILE H 5.000 . 5.000 4.396 3.448 5.028 0.028 10 0 "[ . 1 . 2]" 1 1198 1 155 SER H 1 158 ILE HB 5.000 . 5.000 3.697 2.255 4.602 . 0 0 "[ . 1 . 2]" 1 1199 1 157 TYR QB 1 158 ILE H . . 3.300 2.627 2.289 2.941 . 0 0 "[ . 1 . 2]" 1 1200 1 156 PRO QG 1 157 TYR H 5.500 . 5.500 3.126 2.322 3.958 . 0 0 "[ . 1 . 2]" 1 1201 1 158 ILE HA 1 161 LEU HG 5.000 . 5.000 3.843 3.015 4.874 . 0 0 "[ . 1 . 2]" 1 1202 1 158 ILE HA 1 161 LEU H 3.500 . 3.500 3.430 3.322 3.503 0.003 15 0 "[ . 1 . 2]" 1 1203 1 158 ILE H 1 158 ILE HB 3.500 . 3.500 2.624 2.420 2.668 . 0 0 "[ . 1 . 2]" 1 1204 1 158 ILE H 1 158 ILE MD 5.500 . 5.500 2.946 1.887 3.585 . 0 0 "[ . 1 . 2]" 1 1205 1 147 LEU HG 1 158 ILE MG 5.000 . 5.000 3.761 3.116 4.163 . 0 0 "[ . 1 . 2]" 1 1206 1 158 ILE MG 1 162 ARG QD 5.500 . 5.500 3.303 2.376 4.078 . 0 0 "[ . 1 . 2]" 1 1207 1 155 SER QB 1 158 ILE H 4.000 . 4.000 2.793 2.522 3.555 . 0 0 "[ . 1 . 2]" 1 1208 1 156 PRO HA 1 158 ILE H 5.000 . 5.000 4.317 3.974 4.996 . 0 0 "[ . 1 . 2]" 1 1209 1 157 TYR H 1 158 ILE H 3.500 . 3.500 2.684 2.229 2.860 . 0 0 "[ . 1 . 2]" 1 1210 1 158 ILE H 1 159 HIS H 2.800 . 2.800 2.606 2.488 2.710 . 0 0 "[ . 1 . 2]" 1 1211 1 159 HIS HA 1 162 ARG QB 4.000 . 4.000 2.717 2.335 2.958 . 0 0 "[ . 1 . 2]" 1 1212 1 159 HIS HA 1 162 ARG H . . 3.500 3.476 3.384 3.509 0.009 6 0 "[ . 1 . 2]" 1 1213 1 156 PRO HA 1 159 HIS QB 4.000 . 4.000 2.759 2.338 3.298 . 0 0 "[ . 1 . 2]" 1 1214 1 155 SER QB 1 159 HIS H 5.500 . 5.500 4.588 3.092 4.904 . 0 0 "[ . 1 . 2]" 1 1215 1 156 PRO HA 1 159 HIS H 4.000 . 4.000 3.443 3.241 4.019 0.019 10 0 "[ . 1 . 2]" 1 1216 1 157 TYR HA 1 159 HIS H 5.000 . 5.000 4.205 3.941 4.500 . 0 0 "[ . 1 . 2]" 1 1217 1 158 ILE HB 1 159 HIS H 3.500 . 3.500 2.791 2.549 3.038 . 0 0 "[ . 1 . 2]" 1 1218 1 158 ILE MG 1 159 HIS H 5.500 . 5.500 3.727 3.547 3.808 . 0 0 "[ . 1 . 2]" 1 1219 1 160 HIS QB 1 161 LEU H . . 4.000 2.589 2.335 2.754 . 0 0 "[ . 1 . 2]" 1 1220 1 160 HIS HD2 1 161 LEU H 5.000 . 5.000 4.595 3.909 4.996 . 0 0 "[ . 1 . 2]" 1 1221 1 159 HIS QB 1 160 HIS H 3.500 . 3.500 2.472 2.171 2.751 . 0 0 "[ . 1 . 2]" 1 1222 1 147 LEU MD1 1 161 LEU HA 5.500 . 5.500 3.857 3.562 4.134 . 0 0 "[ . 1 . 2]" 1 1223 1 161 LEU HA 1 161 LEU HG 3.500 . 3.500 2.832 2.219 3.282 . 0 0 "[ . 1 . 2]" 1 1224 1 161 LEU HA 1 165 TYR QB 5.500 . 5.500 4.152 3.910 4.634 . 0 0 "[ . 1 . 2]" 1 1225 1 147 LEU MD2 1 161 LEU QB 4.500 . 4.500 2.330 1.980 2.871 . 0 0 "[ . 1 . 2]" 1 1226 1 158 ILE HA 1 161 LEU QB 4.000 . 4.000 2.562 2.227 3.222 . 0 0 "[ . 1 . 2]" 1 1227 1 161 LEU QB 1 162 ARG H . . 3.300 2.654 2.450 2.777 . 0 0 "[ . 1 . 2]" 1 1228 1 161 LEU H 1 161 LEU HG 3.500 . 3.500 2.649 2.002 3.483 . 0 0 "[ . 1 . 2]" 1 1229 1 157 TYR HA 1 161 LEU H 5.000 . 5.000 4.562 4.023 4.846 . 0 0 "[ . 1 . 2]" 1 1230 1 159 HIS HA 1 161 LEU H 5.000 . 5.000 4.413 4.177 4.616 . 0 0 "[ . 1 . 2]" 1 1231 1 161 LEU H 1 162 ARG H 2.800 . 2.800 2.608 2.529 2.692 . 0 0 "[ . 1 . 2]" 1 1232 1 147 LEU MD1 1 162 ARG HA 5.500 . 5.500 3.723 3.270 4.083 . 0 0 "[ . 1 . 2]" 1 1233 1 147 LEU MD2 1 162 ARG HA 5.500 . 5.500 2.826 2.115 3.433 . 0 0 "[ . 1 . 2]" 1 1234 1 162 ARG HA 1 162 ARG QG 4.000 . 4.000 2.303 2.054 2.906 . 0 0 "[ . 1 . 2]" 1 1235 1 162 ARG HA 1 165 TYR QB 3.500 . 3.500 2.194 1.914 2.426 . 0 0 "[ . 1 . 2]" 1 1236 1 162 ARG HA 1 165 TYR QD 6.000 . 6.000 3.692 2.980 4.047 . 0 0 "[ . 1 . 2]" 1 1237 1 162 ARG HA 1 165 TYR H . . 3.500 3.429 3.151 3.510 0.010 19 0 "[ . 1 . 2]" 1 1238 1 162 ARG HA 1 166 GLN H 5.000 . 5.000 3.598 3.415 3.811 . 0 0 "[ . 1 . 2]" 1 1239 1 147 LEU MD2 1 162 ARG QB 6.000 . 6.000 3.461 2.526 4.274 . 0 0 "[ . 1 . 2]" 1 1240 1 162 ARG H 1 162 ARG QD 5.500 . 5.500 4.212 3.803 4.610 . 0 0 "[ . 1 . 2]" 1 1241 1 147 LEU MD2 1 162 ARG QG 6.000 . 6.000 2.997 1.956 4.205 . 0 0 "[ . 1 . 2]" 1 1242 1 147 LEU MD1 1 162 ARG H 5.500 . 5.500 4.462 3.954 4.584 . 0 0 "[ . 1 . 2]" 1 1243 1 147 LEU MD2 1 162 ARG H 5.500 . 5.500 3.336 2.735 4.217 . 0 0 "[ . 1 . 2]" 1 1244 1 158 ILE HA 1 162 ARG H 5.000 . 5.000 4.100 3.783 4.484 . 0 0 "[ . 1 . 2]" 1 1245 1 159 HIS H 1 162 ARG H 5.000 . 5.000 4.676 4.530 4.829 . 0 0 "[ . 1 . 2]" 1 1246 1 160 HIS HA 1 162 ARG H 5.000 . 5.000 4.363 4.165 4.582 . 0 0 "[ . 1 . 2]" 1 1247 1 161 LEU QD 1 162 ARG H 6.000 . 6.000 4.092 3.918 4.208 . 0 0 "[ . 1 . 2]" 1 1248 1 161 LEU HG 1 162 ARG H 5.000 . 5.000 4.577 4.056 5.001 0.001 15 0 "[ . 1 . 2]" 1 1249 1 162 ARG H 1 165 TYR H 5.000 . 5.000 4.614 4.525 4.748 . 0 0 "[ . 1 . 2]" 1 1250 1 163 ASN H 1 163 ASN QB 3.300 . 3.300 2.150 2.072 2.372 . 0 0 "[ . 1 . 2]" 1 1251 1 163 ASN QB 1 164 ASP H 4.000 . 4.000 2.404 2.150 2.721 . 0 0 "[ . 1 . 2]" 1 1252 1 160 HIS HA 1 163 ASN H 3.500 . 3.500 3.467 3.307 3.510 0.010 6 0 "[ . 1 . 2]" 1 1253 1 161 LEU QB 1 163 ASN H 5.500 . 5.500 4.488 4.371 4.667 . 0 0 "[ . 1 . 2]" 1 1254 1 162 ARG H 1 163 ASN H 3.500 . 3.500 2.570 2.482 2.643 . 0 0 "[ . 1 . 2]" 1 1255 1 163 ASN H 1 164 ASP H . . 2.800 2.621 2.361 2.815 0.015 13 0 "[ . 1 . 2]" 1 1256 1 163 ASN H 1 165 TYR QB 5.500 . 5.500 4.350 4.257 4.451 . 0 0 "[ . 1 . 2]" 1 1257 1 163 ASN H 1 165 TYR H . . 3.500 3.527 3.515 3.591 0.091 13 0 "[ . 1 . 2]" 1 1258 1 161 LEU HA 1 164 ASP QB 5.500 . 5.500 3.210 2.794 3.678 . 0 0 "[ . 1 . 2]" 1 1259 1 164 ASP QB 1 165 TYR H 5.500 . 5.500 3.011 2.926 3.089 . 0 0 "[ . 1 . 2]" 1 1260 1 105 LEU QB 1 165 TYR HA 5.500 . 5.500 2.726 2.437 3.086 . 0 0 "[ . 1 . 2]" 1 1261 1 105 LEU MD2 1 165 TYR HA 5.500 . 5.500 2.432 2.019 2.863 . 0 0 "[ . 1 . 2]" 1 1262 1 165 TYR HA 1 168 LEU QB 5.000 . 5.000 2.468 2.339 2.644 . 0 0 "[ . 1 . 2]" 1 1263 1 165 TYR HA 1 168 LEU HG 5.000 . 5.000 4.472 4.081 4.890 . 0 0 "[ . 1 . 2]" 1 1264 1 147 LEU QB 1 165 TYR QB 6.000 . 6.000 4.689 4.511 4.768 . 0 0 "[ . 1 . 2]" 1 1265 1 165 TYR QB 1 166 GLN H . . 3.300 2.524 2.322 2.613 . 0 0 "[ . 1 . 2]" 1 1266 1 140 ILE HA 1 165 TYR QD 6.000 . 6.000 4.958 4.305 5.347 . 0 0 "[ . 1 . 2]" 1 1267 1 165 TYR QD 1 166 GLN H . . 4.500 3.464 3.172 4.012 . 0 0 "[ . 1 . 2]" 1 1268 1 144 ARG H 1 165 TYR QE 6.000 . 6.000 3.270 2.702 4.513 . 0 0 "[ . 1 . 2]" 1 1269 1 147 LEU MD1 1 165 TYR QE 6.500 . 6.500 3.535 2.896 4.439 . 0 0 "[ . 1 . 2]" 1 1270 1 165 TYR QE 1 166 GLN HA 6.000 . 6.000 4.634 4.237 5.246 . 0 0 "[ . 1 . 2]" 1 1271 1 165 TYR QE 1 169 LEU QB 6.500 . 6.500 3.317 2.564 3.763 . 0 0 "[ . 1 . 2]" 1 1272 1 165 TYR QE 1 169 LEU QD . . 5.000 2.814 1.948 3.308 . 0 0 "[ . 1 . 2]" 1 1273 1 165 TYR H 1 166 GLN QG 5.500 . 5.500 3.782 3.488 4.017 . 0 0 "[ . 1 . 2]" 1 1274 1 165 TYR H 1 166 GLN H 2.800 . 2.800 2.471 2.407 2.616 . 0 0 "[ . 1 . 2]" 1 1275 1 165 TYR H 1 168 LEU QB 5.500 . 5.500 4.775 4.383 4.913 . 0 0 "[ . 1 . 2]" 1 1276 1 166 GLN HA 1 166 GLN QG 4.000 . 4.000 3.297 2.595 3.357 . 0 0 "[ . 1 . 2]" 1 1277 1 166 GLN HA 1 169 LEU QB 4.000 . 4.000 2.821 2.551 3.117 . 0 0 "[ . 1 . 2]" 1 1278 1 166 GLN HA 1 169 LEU H 5.000 . 5.000 3.582 3.327 3.876 . 0 0 "[ . 1 . 2]" 1 1279 1 162 ARG QB 1 166 GLN QB 6.000 . 6.000 4.423 3.894 4.784 . 0 0 "[ . 1 . 2]" 1 1280 1 166 GLN H 1 166 GLN QB 3.300 . 3.300 2.498 2.427 2.670 . 0 0 "[ . 1 . 2]" 1 1281 1 162 ARG HA 1 166 GLN QG 5.500 . 5.500 4.539 3.596 4.788 . 0 0 "[ . 1 . 2]" 1 1282 1 166 GLN H 1 166 GLN QG 4.000 . 4.000 2.247 1.956 2.467 . 0 0 "[ . 1 . 2]" 1 1283 1 163 ASN HA 1 166 GLN H 3.600 . 3.600 3.609 3.605 3.622 0.022 18 0 "[ . 1 . 2]" 1 1284 1 167 ASP HA 1 170 GLN QB 4.000 . 4.000 2.869 2.332 3.566 . 0 0 "[ . 1 . 2]" 1 1285 1 167 ASP H 1 167 ASP QB 3.300 . 3.300 2.230 2.065 2.600 . 0 0 "[ . 1 . 2]" 1 1286 1 167 ASP QB 1 168 LEU H . . 3.300 2.679 2.591 2.805 . 0 0 "[ . 1 . 2]" 1 1287 1 165 TYR HA 1 167 ASP H 5.000 . 5.000 4.210 3.968 5.002 0.002 13 0 "[ . 1 . 2]" 1 1288 1 165 TYR QB 1 167 ASP H 5.500 . 5.500 4.650 4.519 4.896 . 0 0 "[ . 1 . 2]" 1 1289 1 165 TYR H 1 167 ASP H 5.000 . 5.000 3.910 3.793 4.260 . 0 0 "[ . 1 . 2]" 1 1290 1 166 GLN QG 1 167 ASP H 4.000 . 4.000 2.234 1.967 3.622 . 0 0 "[ . 1 . 2]" 1 1291 1 166 GLN QE 1 167 ASP H 5.500 . 5.500 4.380 3.363 4.911 . 0 0 "[ . 1 . 2]" 1 1292 1 167 ASP H 1 168 LEU QB 5.500 . 5.500 4.205 4.049 4.479 . 0 0 "[ . 1 . 2]" 1 1293 1 167 ASP H 1 168 LEU H 2.800 . 2.800 2.528 2.370 2.802 0.002 13 0 "[ . 1 . 2]" 1 1294 1 167 ASP H 1 169 LEU H 5.000 . 5.000 4.104 3.842 4.545 . 0 0 "[ . 1 . 2]" 1 1295 1 109 LYS HA 1 168 LEU HA 5.000 . 5.000 3.297 2.841 3.700 . 0 0 "[ . 1 . 2]" 1 1296 1 168 LEU QB 1 169 LEU H 5.500 . 5.500 2.666 2.404 2.930 . 0 0 "[ . 1 . 2]" 1 1297 1 108 GLY QA 1 168 LEU QD 4.500 . 4.500 1.790 1.760 1.898 0.040 20 0 "[ . 1 . 2]" 1 1298 1 140 ILE HA 1 168 LEU QD 4.500 . 4.500 2.557 2.053 2.889 . 0 0 "[ . 1 . 2]" 1 1299 1 140 ILE MD 1 168 LEU QD . . 5.000 2.762 2.337 3.090 . 0 0 "[ . 1 . 2]" 1 1300 1 165 TYR QD 1 168 LEU QD 7.000 . 7.000 3.299 2.583 4.090 . 0 0 "[ . 1 . 2]" 1 1301 1 166 GLN HA 1 168 LEU H 4.500 . 4.500 4.414 4.241 4.507 0.007 17 0 "[ . 1 . 2]" 1 1302 1 168 LEU H 1 169 LEU QB 5.500 . 5.500 4.393 4.248 4.491 . 0 0 "[ . 1 . 2]" 1 1303 1 168 LEU H 1 169 LEU H 2.800 . 2.800 2.659 2.482 2.802 0.002 11 0 "[ . 1 . 2]" 1 1304 1 169 LEU HA 1 171 GLU H 5.000 . 5.000 4.813 4.634 4.957 . 0 0 "[ . 1 . 2]" 1 1305 1 169 LEU HA 1 172 PHE QB 5.500 . 5.500 2.459 2.338 2.576 . 0 0 "[ . 1 . 2]" 1 1306 1 169 LEU HA 1 172 PHE H 3.500 . 3.500 3.507 3.474 3.517 0.017 9 0 "[ . 1 . 2]" 1 1307 1 140 ILE QG 1 169 LEU QB 6.000 . 6.000 3.670 3.376 4.309 . 0 0 "[ . 1 . 2]" 1 1308 1 169 LEU QB 1 170 GLN HA 5.000 . 5.000 4.172 4.072 4.240 . 0 0 "[ . 1 . 2]" 1 1309 1 169 LEU QB 1 170 GLN H . . 3.300 2.598 2.362 2.852 . 0 0 "[ . 1 . 2]" 1 1310 1 169 LEU H 1 169 LEU HG 5.000 . 5.000 4.438 4.416 4.473 . 0 0 "[ . 1 . 2]" 1 1311 1 169 LEU HG 1 170 GLN H . . 4.000 3.788 3.537 4.002 0.002 10 0 "[ . 1 . 2]" 1 1312 1 165 TYR QE 1 169 LEU H 6.000 . 6.000 5.058 4.768 5.349 . 0 0 "[ . 1 . 2]" 1 1313 1 169 LEU H 1 170 GLN H . . 2.800 2.635 2.517 2.704 . 0 0 "[ . 1 . 2]" 1 1314 1 169 LEU H 1 172 PHE H 5.000 . 5.000 4.653 4.435 4.854 . 0 0 "[ . 1 . 2]" 1 1315 1 170 GLN HA 1 170 GLN QG 4.000 . 4.000 2.743 2.134 3.333 . 0 0 "[ . 1 . 2]" 1 1316 1 170 GLN QB 1 171 GLU H 5.500 . 5.500 2.745 2.220 3.314 . 0 0 "[ . 1 . 2]" 1 1317 1 167 ASP HA 1 170 GLN QE 5.500 . 5.500 3.437 2.062 4.863 . 0 0 "[ . 1 . 2]" 1 1318 1 170 GLN H 1 170 GLN QG 4.000 . 4.000 3.153 2.314 3.608 . 0 0 "[ . 1 . 2]" 1 1319 1 170 GLN QG 1 171 GLU H 5.500 . 5.500 2.928 1.882 4.092 . 0 0 "[ . 1 . 2]" 1 1320 1 170 GLN QG 1 173 GLN QB 6.000 . 6.000 4.463 4.113 4.787 . 0 0 "[ . 1 . 2]" 1 1321 1 170 GLN QG 1 174 ILE MD . . 4.500 3.112 2.398 3.354 . 0 0 "[ . 1 . 2]" 1 1322 1 170 GLN QG 1 174 ILE QG 6.000 . 6.000 3.564 2.958 3.757 . 0 0 "[ . 1 . 2]" 1 1323 1 167 ASP HA 1 170 GLN H 3.500 . 3.500 3.478 3.291 3.522 0.022 17 0 "[ . 1 . 2]" 1 1324 1 169 LEU QD 1 170 GLN H 6.000 . 6.000 3.836 2.954 4.039 . 0 0 "[ . 1 . 2]" 1 1325 1 170 GLN H 1 171 GLU H 2.800 . 2.800 2.793 2.705 2.821 0.021 12 0 "[ . 1 . 2]" 1 1326 1 170 GLN H 1 172 PHE H 5.000 . 5.000 3.870 3.720 4.068 . 0 0 "[ . 1 . 2]" 1 1327 1 171 GLU HA 1 174 ILE MG 5.500 . 5.500 3.834 3.660 4.028 . 0 0 "[ . 1 . 2]" 1 1328 1 171 GLU HA 1 174 ILE MD . . 4.000 2.043 1.939 2.207 . 0 0 "[ . 1 . 2]" 1 1329 1 167 ASP QB 1 171 GLU QB 6.000 . 6.000 4.344 3.861 4.766 . 0 0 "[ . 1 . 2]" 1 1330 1 168 LEU HA 1 171 GLU QB 4.000 . 4.000 3.107 2.905 3.324 . 0 0 "[ . 1 . 2]" 1 1331 1 171 GLU QB 1 172 PHE H . . 3.300 2.796 2.574 2.902 . 0 0 "[ . 1 . 2]" 1 1332 1 109 LYS HA 1 171 GLU QG 5.000 . 5.000 2.227 1.941 2.888 . 0 0 "[ . 1 . 2]" 1 1333 1 168 LEU HA 1 171 GLU QG 5.500 . 5.500 4.560 3.560 4.900 . 0 0 "[ . 1 . 2]" 1 1334 1 171 GLU H 1 171 GLU QG 5.000 . 5.000 3.450 2.031 4.059 . 0 0 "[ . 1 . 2]" 1 1335 1 167 ASP HA 1 171 GLU H 5.000 . 5.000 3.813 3.509 4.160 . 0 0 "[ . 1 . 2]" 1 1336 1 171 GLU H 1 172 PHE QB 5.500 . 5.500 4.427 4.319 4.487 . 0 0 "[ . 1 . 2]" 1 1337 1 171 GLU H 1 172 PHE H 2.800 . 2.800 2.679 2.587 2.735 . 0 0 "[ . 1 . 2]" 1 1338 1 171 GLU H 1 173 GLN H 5.000 . 5.000 4.246 3.968 4.487 . 0 0 "[ . 1 . 2]" 1 1339 1 136 LEU MD2 1 172 PHE QB 6.000 . 6.000 3.045 2.622 3.556 . 0 0 "[ . 1 . 2]" 1 1340 1 172 PHE QB 1 173 GLN H . . 4.000 2.594 2.403 2.724 . 0 0 "[ . 1 . 2]" 1 1341 1 136 LEU MD2 1 172 PHE QD 6.500 . 6.500 2.536 1.993 3.518 . 0 0 "[ . 1 . 2]" 1 1342 1 140 ILE MD 1 172 PHE QD 5.500 . 5.500 2.355 1.892 3.033 . 0 0 "[ . 1 . 2]" 1 1343 1 172 PHE QD 1 173 GLN H 6.000 . 6.000 4.054 3.496 4.311 . 0 0 "[ . 1 . 2]" 1 1344 1 172 PHE QE 1 176 LEU MD2 6.500 . 6.500 3.012 2.300 3.865 . 0 0 "[ . 1 . 2]" 1 1345 1 172 PHE QE 1 200 ILE MD 6.500 . 6.500 3.037 2.623 3.381 . 0 0 "[ . 1 . 2]" 1 1346 1 172 PHE QE 1 200 ILE MG 5.000 . 5.000 3.706 3.620 3.717 . 0 0 "[ . 1 . 2]" 1 1347 1 168 LEU HA 1 172 PHE H 5.000 . 5.000 4.191 3.899 4.462 . 0 0 "[ . 1 . 2]" 1 1348 1 168 LEU QD 1 172 PHE H 6.000 . 6.000 3.876 3.502 4.452 . 0 0 "[ . 1 . 2]" 1 1349 1 168 LEU HG 1 172 PHE H 5.000 . 5.000 5.011 5.004 5.019 0.019 4 0 "[ . 1 . 2]" 1 1350 1 171 GLU QG 1 172 PHE H 5.500 . 5.500 4.378 4.016 4.618 . 0 0 "[ . 1 . 2]" 1 1351 1 172 PHE H 1 173 GLN H 2.800 . 2.800 2.636 2.560 2.717 . 0 0 "[ . 1 . 2]" 1 1352 1 172 PHE H 1 174 ILE HB 5.000 . 5.000 5.028 5.015 5.050 0.050 20 0 "[ . 1 . 2]" 1 1353 1 172 PHE HZ 1 200 ILE MD . . 4.000 2.363 2.046 2.699 . 0 0 "[ . 1 . 2]" 1 1354 1 172 PHE HZ 1 200 ILE QG 5.500 . 5.500 3.638 3.172 4.294 . 0 0 "[ . 1 . 2]" 1 1355 1 172 PHE HZ 1 200 ILE MG 5.500 . 5.500 2.781 2.592 3.002 . 0 0 "[ . 1 . 2]" 1 1356 1 173 GLN HA 1 173 GLN QG 4.000 . 4.000 2.323 2.076 2.789 . 0 0 "[ . 1 . 2]" 1 1357 1 173 GLN HA 1 176 LEU QB 5.500 . 5.500 2.728 2.188 3.048 . 0 0 "[ . 1 . 2]" 1 1358 1 173 GLN HA 1 176 LEU MD1 4.000 . 4.000 2.481 1.971 2.857 . 0 0 "[ . 1 . 2]" 1 1359 1 173 GLN HA 1 176 LEU H . . 3.500 3.402 3.247 3.509 0.009 16 0 "[ . 1 . 2]" 1 1360 1 173 GLN QB 1 174 ILE QG 6.000 . 6.000 3.445 3.290 3.564 . 0 0 "[ . 1 . 2]" 1 1361 1 173 GLN QB 1 174 ILE H . . 4.000 2.821 2.735 2.889 . 0 0 "[ . 1 . 2]" 1 1362 1 173 GLN QG 1 176 LEU MD1 6.000 . 6.000 3.402 2.919 4.125 . 0 0 "[ . 1 . 2]" 1 1363 1 169 LEU HA 1 173 GLN H 5.000 . 5.000 4.414 4.202 4.591 . 0 0 "[ . 1 . 2]" 1 1364 1 169 LEU QD 1 173 GLN H 6.000 . 6.000 4.334 4.027 4.454 . 0 0 "[ . 1 . 2]" 1 1365 1 170 GLN HA 1 173 GLN H 3.500 . 3.500 3.460 3.325 3.524 0.024 7 0 "[ . 1 . 2]" 1 1366 1 173 GLN H 1 174 ILE QG 5.500 . 5.500 3.816 3.667 3.968 . 0 0 "[ . 1 . 2]" 1 1367 1 173 GLN H 1 174 ILE H . . 2.800 2.473 2.366 2.641 . 0 0 "[ . 1 . 2]" 1 1368 1 173 GLN H 1 175 SER H 5.000 . 5.000 4.311 4.177 4.445 . 0 0 "[ . 1 . 2]" 1 1369 1 174 ILE HA 1 174 ILE QG . . 3.500 2.389 2.332 2.431 . 0 0 "[ . 1 . 2]" 1 1370 1 174 ILE HA 1 177 LYS QD 5.500 . 5.500 3.824 2.161 4.904 . 0 0 "[ . 1 . 2]" 1 1371 1 174 ILE H 1 174 ILE HB 3.500 . 3.500 2.533 2.457 2.588 . 0 0 "[ . 1 . 2]" 1 1372 1 174 ILE HB 1 175 SER H . . 3.500 2.486 2.342 2.641 . 0 0 "[ . 1 . 2]" 1 1373 1 171 GLU QG 1 174 ILE MD 4.500 . 4.500 2.757 2.130 3.325 . 0 0 "[ . 1 . 2]" 1 1374 1 171 GLU QB 1 174 ILE MD 5.000 . 5.000 3.615 3.329 3.712 . 0 0 "[ . 1 . 2]" 1 1375 1 174 ILE H 1 174 ILE MD 5.500 . 5.500 3.620 3.541 3.701 . 0 0 "[ . 1 . 2]" 1 1376 1 171 GLU QB 1 174 ILE QG 5.500 . 5.500 4.375 4.366 4.387 . 0 0 "[ . 1 . 2]" 1 1377 1 174 ILE H 1 174 ILE QG 3.500 . 3.500 2.067 1.982 2.196 . 0 0 "[ . 1 . 2]" 1 1378 1 174 ILE MG 1 175 SER H 5.500 . 5.500 3.353 3.040 3.582 . 0 0 "[ . 1 . 2]" 1 1379 1 174 ILE MG 1 177 LYS QB 6.000 . 6.000 3.641 3.447 3.972 . 0 0 "[ . 1 . 2]" 1 1380 1 171 GLU HA 1 174 ILE H 3.500 . 3.500 3.157 3.041 3.365 . 0 0 "[ . 1 . 2]" 1 1381 1 174 ILE HA 1 175 SER HA 5.000 . 5.000 4.777 4.728 4.807 . 0 0 "[ . 1 . 2]" 1 1382 1 175 SER HA 1 177 LYS H 5.000 . 5.000 4.279 4.027 4.576 . 0 0 "[ . 1 . 2]" 1 1383 1 175 SER HA 1 178 ILE HB 5.000 . 5.000 3.555 3.249 3.996 . 0 0 "[ . 1 . 2]" 1 1384 1 115 LEU QD 1 175 SER QB 6.500 . 6.500 3.189 1.874 4.296 . 0 0 "[ . 1 . 2]" 1 1385 1 174 ILE MD 1 175 SER H 5.500 . 5.500 4.508 4.356 4.583 . 0 0 "[ . 1 . 2]" 1 1386 1 174 ILE QG 1 175 SER H 5.500 . 5.500 3.947 3.853 4.014 . 0 0 "[ . 1 . 2]" 1 1387 1 174 ILE H 1 175 SER H 2.800 . 2.800 2.734 2.609 2.808 0.008 20 0 "[ . 1 . 2]" 1 1388 1 175 SER H 1 176 LEU QB 5.500 . 5.500 4.777 4.507 4.905 . 0 0 "[ . 1 . 2]" 1 1389 1 175 SER H 1 176 LEU H 3.500 . 3.500 2.655 2.482 2.785 . 0 0 "[ . 1 . 2]" 1 1390 1 176 LEU HA 1 176 LEU MD2 4.000 . 4.000 2.158 1.960 2.503 . 0 0 "[ . 1 . 2]" 1 1391 1 176 LEU HA 1 179 LEU QB . . 3.500 2.316 1.994 2.581 . 0 0 "[ . 1 . 2]" 1 1392 1 176 LEU HA 1 179 LEU QD 4.500 . 4.500 2.881 2.098 3.337 . 0 0 "[ . 1 . 2]" 1 1393 1 176 LEU QB 1 177 LYS H 5.500 . 5.500 2.752 2.611 2.956 . 0 0 "[ . 1 . 2]" 1 1394 1 176 LEU QB 1 179 LEU QB 6.000 . 6.000 4.031 3.791 4.350 . 0 0 "[ . 1 . 2]" 1 1395 1 172 PHE QE 1 176 LEU MD1 5.000 . 5.000 2.790 1.838 3.091 . 0 0 "[ . 1 . 2]" 1 1396 1 172 PHE HZ 1 176 LEU MD1 4.500 . 4.500 3.138 2.757 3.614 . 0 0 "[ . 1 . 2]" 1 1397 1 176 LEU H 1 176 LEU MD1 5.500 . 5.500 3.484 3.125 3.723 . 0 0 "[ . 1 . 2]" 1 1398 1 176 LEU MD1 1 200 ILE HB 5.500 . 5.500 4.061 3.390 4.582 . 0 0 "[ . 1 . 2]" 1 1399 1 176 LEU MD1 1 200 ILE MD 6.000 . 6.000 2.331 1.830 3.070 . 0 0 "[ . 1 . 2]" 1 1400 1 133 ILE MG 1 176 LEU MD2 4.500 . 4.500 2.930 2.731 3.123 . 0 0 "[ . 1 . 2]" 1 1401 1 172 PHE HZ 1 176 LEU MD2 5.500 . 5.500 3.489 2.869 4.083 . 0 0 "[ . 1 . 2]" 1 1402 1 176 LEU H 1 176 LEU MD2 5.500 . 5.500 3.296 2.724 3.739 . 0 0 "[ . 1 . 2]" 1 1403 1 176 LEU MD2 1 197 LEU MD2 3.800 . 3.800 1.762 1.657 1.857 0.143 3 0 "[ . 1 . 2]" 1 1404 1 176 LEU MD2 1 197 LEU HG 5.500 . 5.500 3.649 3.407 4.114 . 0 0 "[ . 1 . 2]" 1 1405 1 133 ILE MD 1 176 LEU HG 5.500 . 5.500 3.852 3.181 4.235 . 0 0 "[ . 1 . 2]" 1 1406 1 172 PHE QD 1 176 LEU HG 6.000 . 6.000 3.837 3.184 4.260 . 0 0 "[ . 1 . 2]" 1 1407 1 173 GLN HA 1 176 LEU HG 5.000 . 5.000 3.377 2.558 3.896 . 0 0 "[ . 1 . 2]" 1 1408 1 176 LEU H 1 176 LEU HG 5.000 . 5.000 2.186 1.993 2.555 . 0 0 "[ . 1 . 2]" 1 1409 1 176 LEU HG 1 197 LEU MD2 5.500 . 5.500 4.032 3.718 4.329 . 0 0 "[ . 1 . 2]" 1 1410 1 175 SER QB 1 176 LEU H 5.500 . 5.500 2.706 2.334 3.475 . 0 0 "[ . 1 . 2]" 1 1411 1 177 LYS HA 1 177 LYS QG 4.000 . 4.000 2.228 2.001 2.520 . 0 0 "[ . 1 . 2]" 1 1412 1 177 LYS HA 1 180 THR H 5.000 . 5.000 3.742 3.540 4.024 . 0 0 "[ . 1 . 2]" 1 1413 1 177 LYS QB 1 178 ILE H . . 4.000 2.551 2.238 2.861 . 0 0 "[ . 1 . 2]" 1 1414 1 173 GLN QB 1 177 LYS QG 6.000 . 6.000 3.759 2.725 4.760 . 0 0 "[ . 1 . 2]" 1 1415 1 174 ILE HA 1 177 LYS H . . 3.500 3.459 3.340 3.516 0.016 20 0 "[ . 1 . 2]" 1 1416 1 174 ILE H 1 177 LYS H 5.000 . 5.000 4.577 4.443 4.709 . 0 0 "[ . 1 . 2]" 1 1417 1 175 SER QB 1 177 LYS H 5.500 . 5.500 4.650 4.453 4.911 . 0 0 "[ . 1 . 2]" 1 1418 1 175 SER H 1 177 LYS H 5.000 . 5.000 3.985 3.891 4.107 . 0 0 "[ . 1 . 2]" 1 1419 1 177 LYS H 1 178 ILE H 3.500 . 3.500 2.714 2.450 2.938 . 0 0 "[ . 1 . 2]" 1 1420 1 177 LYS H 1 179 LEU H 5.000 . 5.000 3.860 3.706 4.103 . 0 0 "[ . 1 . 2]" 1 1421 1 178 ILE HA 1 178 ILE QG . . 3.500 2.515 2.460 2.536 . 0 0 "[ . 1 . 2]" 1 1422 1 178 ILE HA 1 178 ILE MG 3.300 . 3.300 2.296 2.198 2.388 . 0 0 "[ . 1 . 2]" 1 1423 1 178 ILE HA 1 181 GLU QB 5.500 . 5.500 3.125 2.321 4.023 . 0 0 "[ . 1 . 2]" 1 1424 1 178 ILE HA 1 181 GLU QG 5.500 . 5.500 2.812 1.904 3.892 . 0 0 "[ . 1 . 2]" 1 1425 1 178 ILE H 1 178 ILE HB 3.500 . 3.500 2.614 2.581 2.650 . 0 0 "[ . 1 . 2]" 1 1426 1 178 ILE HB 1 179 LEU H . . 3.500 2.905 2.609 3.090 . 0 0 "[ . 1 . 2]" 1 1427 1 174 ILE MG 1 178 ILE MD 6.000 . 6.000 2.194 1.730 3.078 0.070 10 0 "[ . 1 . 2]" 1 1428 1 178 ILE HB 1 178 ILE MD 3.300 . 3.300 2.254 2.047 2.410 . 0 0 "[ . 1 . 2]" 1 1429 1 178 ILE H 1 178 ILE MD 5.500 . 5.500 3.173 2.715 3.573 . 0 0 "[ . 1 . 2]" 1 1430 1 175 SER HA 1 178 ILE QG 5.500 . 5.500 4.118 3.534 4.673 . 0 0 "[ . 1 . 2]" 1 1431 1 119 CYS QB 1 178 ILE MG 6.000 . 6.000 3.610 2.964 4.431 . 0 0 "[ . 1 . 2]" 1 1432 1 178 ILE MG 1 179 LEU H 5.500 . 5.500 3.807 3.600 3.903 . 0 0 "[ . 1 . 2]" 1 1433 1 178 ILE MG 1 182 LYS QG 6.000 . 6.000 3.335 2.392 4.292 . 0 0 "[ . 1 . 2]" 1 1434 1 174 ILE HA 1 178 ILE H 5.000 . 5.000 4.260 3.955 4.573 . 0 0 "[ . 1 . 2]" 1 1435 1 174 ILE MG 1 178 ILE H 5.500 . 5.500 4.161 3.778 4.448 . 0 0 "[ . 1 . 2]" 1 1436 1 175 SER HA 1 178 ILE H 5.000 . 5.000 3.765 3.503 4.009 . 0 0 "[ . 1 . 2]" 1 1437 1 178 ILE H 1 179 LEU H . . 2.800 2.490 2.329 2.638 . 0 0 "[ . 1 . 2]" 1 1438 1 176 LEU MD2 1 179 LEU QB 6.000 . 6.000 3.463 3.005 3.806 . 0 0 "[ . 1 . 2]" 1 1439 1 179 LEU QB 1 180 THR H 5.500 . 5.500 2.664 2.459 2.891 . 0 0 "[ . 1 . 2]" 1 1440 1 119 CYS QB 1 179 LEU QD 6.500 . 6.500 3.306 2.334 4.057 . 0 0 "[ . 1 . 2]" 1 1441 1 179 LEU HA 1 179 LEU QD 3.300 . 3.300 2.191 1.953 2.446 . 0 0 "[ . 1 . 2]" 1 1442 1 179 LEU H 1 179 LEU HG 5.000 . 5.000 3.924 2.522 4.549 . 0 0 "[ . 1 . 2]" 1 1443 1 175 SER HA 1 179 LEU H 5.000 . 5.000 4.306 4.055 4.623 . 0 0 "[ . 1 . 2]" 1 1444 1 178 ILE QG 1 179 LEU H 5.500 . 5.500 4.008 3.896 4.122 . 0 0 "[ . 1 . 2]" 1 1445 1 179 LEU H 1 182 LYS H 5.000 . 5.000 4.865 4.633 5.001 0.001 6 0 "[ . 1 . 2]" 1 1446 1 180 THR HA 1 183 CYS QB 4.000 . 4.000 2.608 2.405 2.952 . 0 0 "[ . 1 . 2]" 1 1447 1 177 LYS HA 1 180 THR MG 5.500 . 5.500 2.069 1.874 2.422 . 0 0 "[ . 1 . 2]" 1 1448 1 180 THR H 1 180 THR MG 4.000 . 4.000 2.207 2.010 2.438 . 0 0 "[ . 1 . 2]" 1 1449 1 180 THR MG 1 181 GLU QB 6.000 . 6.000 3.303 2.923 3.779 . 0 0 "[ . 1 . 2]" 1 1450 1 180 THR MG 1 184 LEU QB 6.000 . 6.000 4.423 4.310 4.455 . 0 0 "[ . 1 . 2]" 1 1451 1 180 THR MG 1 184 LEU QD 5.000 . 5.000 2.710 2.310 2.970 . 0 0 "[ . 1 . 2]" 1 1452 1 180 THR H 1 181 GLU H 3.500 . 3.500 2.612 2.459 2.720 . 0 0 "[ . 1 . 2]" 1 1453 1 180 THR H 1 197 LEU MD2 5.500 . 5.500 4.202 3.445 4.576 . 0 0 "[ . 1 . 2]" 1 1454 1 181 GLU HA 1 182 LYS HA 5.000 . 5.000 4.752 4.713 4.798 . 0 0 "[ . 1 . 2]" 1 1455 1 181 GLU HA 1 184 LEU QB 5.000 . 5.000 2.449 2.240 2.620 . 0 0 "[ . 1 . 2]" 1 1456 1 181 GLU HA 1 184 LEU QD 4.500 . 4.500 2.302 1.972 2.751 . 0 0 "[ . 1 . 2]" 1 1457 1 181 GLU HA 1 184 LEU HG 5.000 . 5.000 4.187 3.806 4.756 . 0 0 "[ . 1 . 2]" 1 1458 1 181 GLU HA 1 184 LEU H . . 3.500 3.432 3.219 3.505 0.005 20 0 "[ . 1 . 2]" 1 1459 1 180 THR H 1 181 GLU QB 5.500 . 5.500 4.628 4.118 4.909 . 0 0 "[ . 1 . 2]" 1 1460 1 181 GLU QB 1 182 LYS H . . 3.500 2.745 2.207 3.153 . 0 0 "[ . 1 . 2]" 1 1461 1 181 GLU H 1 181 GLU QG 4.000 . 4.000 2.672 1.864 3.589 . 0 0 "[ . 1 . 2]" 1 1462 1 178 ILE HA 1 181 GLU H 5.000 . 5.000 3.628 3.401 3.819 . 0 0 "[ . 1 . 2]" 1 1463 1 181 GLU H 1 182 LYS H 3.500 . 3.500 2.652 2.431 2.826 . 0 0 "[ . 1 . 2]" 1 1464 1 182 LYS HA 1 185 GLU H 4.000 . 4.000 3.838 3.587 3.991 . 0 0 "[ . 1 . 2]" 1 1465 1 181 GLU H 1 182 LYS QB 5.500 . 5.500 4.570 4.225 4.915 . 0 0 "[ . 1 . 2]" 1 1466 1 182 LYS H 1 182 LYS QB . . 3.300 2.289 2.082 2.591 . 0 0 "[ . 1 . 2]" 1 1467 1 182 LYS H 1 182 LYS QD 5.500 . 5.500 3.993 2.735 4.587 . 0 0 "[ . 1 . 2]" 1 1468 1 182 LYS QB 1 182 LYS QE 4.500 . 4.500 3.190 2.327 3.574 . 0 0 "[ . 1 . 2]" 1 1469 1 182 LYS H 1 182 LYS QG 4.000 . 4.000 2.703 1.970 3.442 . 0 0 "[ . 1 . 2]" 1 1470 1 180 THR H 1 182 LYS H 5.000 . 5.000 4.335 4.160 4.499 . 0 0 "[ . 1 . 2]" 1 1471 1 181 GLU QG 1 182 LYS H 4.000 . 4.000 2.796 1.865 3.586 . 0 0 "[ . 1 . 2]" 1 1472 1 182 LYS H 1 183 CYS H 3.500 . 3.500 2.578 2.444 2.689 . 0 0 "[ . 1 . 2]" 1 1473 1 183 CYS QB 1 184 LEU H . . 4.000 2.797 2.660 2.862 . 0 0 "[ . 1 . 2]" 1 1474 1 183 CYS QB 1 194 SER HA 5.500 . 5.500 4.192 2.882 4.904 . 0 0 "[ . 1 . 2]" 1 1475 1 179 LEU QB 1 183 CYS H 5.500 . 5.500 4.809 4.535 4.910 . 0 0 "[ . 1 . 2]" 1 1476 1 180 THR HA 1 183 CYS H 3.500 . 3.500 3.483 3.390 3.507 0.007 6 0 "[ . 1 . 2]" 1 1477 1 182 LYS QB 1 183 CYS H 4.000 . 4.000 3.019 2.596 3.571 . 0 0 "[ . 1 . 2]" 1 1478 1 183 CYS H 1 184 LEU H 2.800 . 2.800 2.390 2.285 2.472 . 0 0 "[ . 1 . 2]" 1 1479 1 184 LEU HA 1 184 LEU MD2 4.000 . 4.000 2.386 2.051 2.656 . 0 0 "[ . 1 . 2]" 1 1480 1 184 LEU HA 1 187 PRO QG 5.500 . 5.500 3.219 2.169 4.142 . 0 0 "[ . 1 . 2]" 1 1481 1 181 GLU QB 1 184 LEU QB 6.000 . 6.000 4.150 3.955 4.389 . 0 0 "[ . 1 . 2]" 1 1482 1 184 LEU QB 1 185 GLU H . . 3.500 2.971 2.864 3.132 . 0 0 "[ . 1 . 2]" 1 1483 1 184 LEU HA 1 184 LEU HG 3.500 . 3.500 2.466 2.280 2.628 . 0 0 "[ . 1 . 2]" 1 1484 1 184 LEU H 1 184 LEU HG 3.500 . 3.500 3.063 2.923 3.275 . 0 0 "[ . 1 . 2]" 1 1485 1 180 THR HA 1 184 LEU H 5.000 . 5.000 3.807 3.621 3.987 . 0 0 "[ . 1 . 2]" 1 1486 1 184 LEU H 1 185 GLU H 2.800 . 2.800 2.645 2.493 2.693 . 0 0 "[ . 1 . 2]" 1 1487 1 184 LEU H 1 186 ASN H 5.000 . 5.000 4.257 4.196 4.379 . 0 0 "[ . 1 . 2]" 1 1488 1 185 GLU HA 1 187 PRO QD 5.500 . 5.500 3.527 3.252 3.888 . 0 0 "[ . 1 . 2]" 1 1489 1 182 LYS HA 1 185 GLU QB 5.000 . 5.000 3.390 2.694 4.089 . 0 0 "[ . 1 . 2]" 1 1490 1 185 GLU H 1 185 GLU QB 3.300 . 3.300 2.208 2.058 2.744 . 0 0 "[ . 1 . 2]" 1 1491 1 185 GLU QB 1 186 ASN H . . 3.300 2.884 2.458 2.967 . 0 0 "[ . 1 . 2]" 1 1492 1 185 GLU H 1 185 GLU QG 4.000 . 4.000 3.268 1.942 3.603 . 0 0 "[ . 1 . 2]" 1 1493 1 185 GLU QG 1 186 ASN H . . 4.000 2.984 2.700 3.578 . 0 0 "[ . 1 . 2]" 1 1494 1 181 GLU HA 1 185 GLU H 5.000 . 5.000 4.759 4.329 4.993 . 0 0 "[ . 1 . 2]" 1 1495 1 183 CYS H 1 185 GLU H 5.000 . 5.000 4.004 3.817 4.117 . 0 0 "[ . 1 . 2]" 1 1496 1 184 LEU QD 1 185 GLU H 6.000 . 6.000 4.303 4.231 4.388 . 0 0 "[ . 1 . 2]" 1 1497 1 184 LEU HG 1 185 GLU H 5.000 . 5.000 4.939 4.853 5.007 0.007 17 0 "[ . 1 . 2]" 1 1498 1 185 GLU H 1 186 ASN QB 5.500 . 5.500 4.727 4.475 4.912 . 0 0 "[ . 1 . 2]" 1 1499 1 185 GLU H 1 186 ASN H 2.800 . 2.800 2.418 2.322 2.588 . 0 0 "[ . 1 . 2]" 1 1500 1 185 GLU H 1 187 PRO QD 5.500 . 5.500 3.936 3.407 4.489 . 0 0 "[ . 1 . 2]" 1 1501 1 186 ASN HA 1 187 PRO QD 3.500 . 3.500 2.241 2.164 2.341 . 0 0 "[ . 1 . 2]" 1 1502 1 186 ASN QB 1 187 PRO QD 6.000 . 6.000 3.811 3.746 3.853 . 0 0 "[ . 1 . 2]" 1 1503 1 186 ASN QB 1 189 SER QB 6.000 . 6.000 2.172 1.812 2.724 . 0 0 "[ . 1 . 2]" 1 1504 1 185 GLU QG 1 186 ASN QD 6.000 . 6.000 3.386 2.016 4.470 . 0 0 "[ . 1 . 2]" 1 1505 1 186 ASN QD 1 189 SER QB 6.000 . 6.000 3.748 2.244 4.722 . 0 0 "[ . 1 . 2]" 1 1506 1 183 CYS HA 1 186 ASN H 3.500 . 3.500 3.202 3.068 3.492 . 0 0 "[ . 1 . 2]" 1 1507 1 184 LEU QB 1 186 ASN H 5.500 . 5.500 4.855 4.820 4.903 . 0 0 "[ . 1 . 2]" 1 1508 1 186 ASN H 1 187 PRO QG 5.500 . 5.500 4.455 4.023 4.907 . 0 0 "[ . 1 . 2]" 1 1509 1 187 PRO QB 1 187 PRO QD . . 3.500 2.762 2.752 2.776 . 0 0 "[ . 1 . 2]" 1 1510 1 187 PRO QB 1 188 SER H . . 4.000 2.633 2.204 3.314 . 0 0 "[ . 1 . 2]" 1 1511 1 184 LEU HA 1 187 PRO QD 5.500 . 5.500 3.731 3.048 4.401 . 0 0 "[ . 1 . 2]" 1 1512 1 186 ASN H 1 187 PRO QD 5.500 . 5.500 2.904 2.636 3.263 . 0 0 "[ . 1 . 2]" 1 1513 1 186 ASN HA 1 187 PRO QG 5.000 . 5.000 4.116 4.009 4.240 . 0 0 "[ . 1 . 2]" 1 1514 1 187 PRO QG 1 188 SER H . . 4.000 3.094 2.104 3.573 . 0 0 "[ . 1 . 2]" 1 1515 1 186 ASN HA 1 188 SER H 5.000 . 5.000 3.714 3.312 3.988 . 0 0 "[ . 1 . 2]" 1 1516 1 187 PRO QD 1 188 SER H 4.000 . 4.000 2.545 2.274 2.726 . 0 0 "[ . 1 . 2]" 1 1517 1 188 SER H 1 189 SER H 3.500 . 3.500 2.710 2.507 2.885 . 0 0 "[ . 1 . 2]" 1 1518 1 190 LEU H 1 191 GLN H . . 4.000 3.605 3.040 3.993 . 0 0 "[ . 1 . 2]" 1 1519 1 191 GLN QB 1 192 ASN H . . 3.300 2.804 2.679 2.941 . 0 0 "[ . 1 . 2]" 1 1520 1 191 GLN QE 1 195 LEU QD 6.500 . 6.500 3.285 1.974 4.226 . 0 0 "[ . 1 . 2]" 1 1521 1 191 GLN QG 1 192 ASN H . . 4.500 3.935 3.743 4.012 . 0 0 "[ . 1 . 2]" 1 1522 1 191 GLN QG 1 195 LEU QD 6.500 . 6.500 2.226 1.787 3.248 0.013 11 0 "[ . 1 . 2]" 1 1523 1 191 GLN QG 1 195 LEU HG 5.500 . 5.500 2.751 1.929 4.793 . 0 0 "[ . 1 . 2]" 1 1524 1 190 LEU HA 1 191 GLN H 2.800 . 2.800 2.308 2.154 2.526 . 0 0 "[ . 1 . 2]" 1 1525 1 190 LEU QB 1 191 GLN H 4.500 . 4.500 3.796 3.627 3.894 . 0 0 "[ . 1 . 2]" 1 1526 1 190 LEU QD 1 191 GLN H 6.000 . 6.000 3.831 3.023 4.356 . 0 0 "[ . 1 . 2]" 1 1527 1 191 GLN H 1 192 ASN QB 5.500 . 5.500 4.176 3.936 4.863 . 0 0 "[ . 1 . 2]" 1 1528 1 191 GLN H 1 192 ASN H 2.800 . 2.800 2.364 2.277 2.573 . 0 0 "[ . 1 . 2]" 1 1529 1 191 GLN H 1 193 LEU H 5.000 . 5.000 4.131 3.971 4.346 . 0 0 "[ . 1 . 2]" 1 1530 1 192 ASN H 1 192 ASN QB 3.300 . 3.300 2.213 2.044 2.877 . 0 0 "[ . 1 . 2]" 1 1531 1 192 ASN QB 1 193 LEU H . . 3.300 2.733 2.492 2.912 . 0 0 "[ . 1 . 2]" 1 1532 1 192 ASN QD 1 193 LEU HA 5.500 . 5.500 4.417 3.567 4.921 . 0 0 "[ . 1 . 2]" 1 1533 1 190 LEU HA 1 192 ASN H 3.500 . 3.500 3.446 3.322 3.502 0.002 10 0 "[ . 1 . 2]" 1 1534 1 190 LEU QB 1 192 ASN H 5.500 . 5.500 4.112 3.191 4.561 . 0 0 "[ . 1 . 2]" 1 1535 1 192 ASN H 1 193 LEU QB 5.500 . 5.500 4.434 4.133 4.618 . 0 0 "[ . 1 . 2]" 1 1536 1 192 ASN H 1 193 LEU H 2.800 . 2.800 2.690 2.489 2.766 . 0 0 "[ . 1 . 2]" 1 1537 1 193 LEU QB 1 194 SER H . . 3.300 2.372 2.227 2.793 . 0 0 "[ . 1 . 2]" 1 1538 1 126 GLU QG 1 193 LEU MD1 4.500 . 4.500 2.241 1.876 3.338 . 0 0 "[ . 1 . 2]" 1 1539 1 183 CYS QB 1 193 LEU MD1 5.500 . 5.500 3.749 2.871 4.082 . 0 0 "[ . 1 . 2]" 1 1540 1 193 LEU HA 1 193 LEU MD1 4.500 . 4.500 3.649 2.525 3.780 . 0 0 "[ . 1 . 2]" 1 1541 1 129 CYS QB 1 193 LEU MD2 6.000 . 6.000 2.159 1.831 3.405 . 0 0 "[ . 1 . 2]" 1 1542 1 126 GLU QB 1 193 LEU HG 5.500 . 5.500 3.603 2.960 4.076 . 0 0 "[ . 1 . 2]" 1 1543 1 193 LEU H 1 193 LEU HG 5.000 . 5.000 3.350 2.793 4.414 . 0 0 "[ . 1 . 2]" 1 1544 1 190 LEU HA 1 193 LEU H 5.000 . 5.000 4.104 3.769 4.527 . 0 0 "[ . 1 . 2]" 1 1545 1 190 LEU QB 1 193 LEU H 5.500 . 5.500 3.132 2.596 3.544 . 0 0 "[ . 1 . 2]" 1 1546 1 191 GLN HA 1 193 LEU H 5.000 . 5.000 4.101 3.818 4.415 . 0 0 "[ . 1 . 2]" 1 1547 1 191 GLN QB 1 193 LEU H 5.500 . 5.500 4.821 4.642 4.906 . 0 0 "[ . 1 . 2]" 1 1548 1 193 LEU H 1 194 SER H . . 2.800 2.759 2.370 2.810 0.010 8 0 "[ . 1 . 2]" 1 1549 1 194 SER HA 1 196 THR H 5.000 . 5.000 4.550 4.346 4.734 . 0 0 "[ . 1 . 2]" 1 1550 1 194 SER QB 1 195 LEU H . . 4.000 2.887 2.507 3.525 . 0 0 "[ . 1 . 2]" 1 1551 1 190 LEU QB 1 194 SER H 5.000 . 5.000 4.059 3.557 4.453 . 0 0 "[ . 1 . 2]" 1 1552 1 191 GLN QG 1 194 SER H 5.500 . 5.500 4.742 4.283 4.911 . 0 0 "[ . 1 . 2]" 1 1553 1 192 ASN H 1 194 SER H 5.000 . 5.000 4.527 4.056 4.796 . 0 0 "[ . 1 . 2]" 1 1554 1 193 LEU MD1 1 194 SER H 5.000 . 5.000 4.173 4.166 4.183 . 0 0 "[ . 1 . 2]" 1 1555 1 194 SER H 1 195 LEU H 2.800 . 2.800 2.738 2.518 2.804 0.004 12 0 "[ . 1 . 2]" 1 1556 1 194 SER H 1 196 THR H 5.000 . 5.000 4.416 3.997 4.610 . 0 0 "[ . 1 . 2]" 1 1557 1 195 LEU HA 1 195 LEU QD 3.800 . 3.800 2.215 1.925 2.822 . 0 0 "[ . 1 . 2]" 1 1558 1 195 LEU HA 1 197 LEU H 5.000 . 5.000 4.201 4.139 4.302 . 0 0 "[ . 1 . 2]" 1 1559 1 191 GLN QG 1 195 LEU QB 6.000 . 6.000 3.752 2.413 4.425 . 0 0 "[ . 1 . 2]" 1 1560 1 195 LEU QB 1 196 THR H . . 3.500 2.563 2.344 3.132 . 0 0 "[ . 1 . 2]" 1 1561 1 195 LEU QB 1 198 VAL HB 5.500 . 5.500 4.833 4.569 4.906 . 0 0 "[ . 1 . 2]" 1 1562 1 195 LEU HA 1 195 LEU HG 4.000 . 4.000 2.814 2.367 3.691 . 0 0 "[ . 1 . 2]" 1 1563 1 195 LEU H 1 195 LEU HG 3.500 . 3.500 2.853 2.204 3.510 0.010 17 0 "[ . 1 . 2]" 1 1564 1 192 ASN HA 1 195 LEU H 4.000 . 4.000 3.688 3.523 3.887 . 0 0 "[ . 1 . 2]" 1 1565 1 195 LEU H 1 196 THR H 2.800 . 2.800 2.744 2.612 2.803 0.003 8 0 "[ . 1 . 2]" 1 1566 1 195 LEU H 1 198 VAL H 5.000 . 5.000 4.864 4.726 4.961 . 0 0 "[ . 1 . 2]" 1 1567 1 196 THR HA 1 196 THR MG . . 3.300 2.420 2.335 2.481 . 0 0 "[ . 1 . 2]" 1 1568 1 133 ILE MG 1 196 THR MG 4.500 . 4.500 1.831 1.695 2.146 0.105 13 0 "[ . 1 . 2]" 1 1569 1 134 GLU H 1 196 THR MG 5.500 . 5.500 3.653 3.412 3.862 . 0 0 "[ . 1 . 2]" 1 1570 1 196 THR MG 1 197 LEU H 4.500 . 4.500 3.721 3.662 3.749 . 0 0 "[ . 1 . 2]" 1 1571 1 196 THR MG 1 200 ILE MG 6.000 . 6.000 2.527 2.250 2.751 . 0 0 "[ . 1 . 2]" 1 1572 1 196 THR H 1 197 LEU H 2.800 . 2.800 2.634 2.500 2.687 . 0 0 "[ . 1 . 2]" 1 1573 1 176 LEU MD2 1 197 LEU HA 5.500 . 5.500 3.353 3.124 3.698 . 0 0 "[ . 1 . 2]" 1 1574 1 197 LEU HA 1 197 LEU MD1 4.000 . 4.000 2.099 1.955 2.505 . 0 0 "[ . 1 . 2]" 1 1575 1 197 LEU HA 1 197 LEU MD2 4.000 . 4.000 2.146 1.947 2.259 . 0 0 "[ . 1 . 2]" 1 1576 1 197 LEU HA 1 200 ILE MD . . 4.000 1.983 1.925 2.076 . 0 0 "[ . 1 . 2]" 1 1577 1 197 LEU HA 1 200 ILE QG . . 4.000 2.336 2.143 2.571 . 0 0 "[ . 1 . 2]" 1 1578 1 197 LEU QB 1 198 VAL H 5.500 . 5.500 2.595 2.365 2.792 . 0 0 "[ . 1 . 2]" 1 1579 1 176 LEU MD2 1 197 LEU MD1 6.000 . 6.000 2.064 1.874 2.856 . 0 0 "[ . 1 . 2]" 1 1580 1 197 LEU H 1 197 LEU MD2 5.500 . 5.500 3.298 2.950 3.761 . 0 0 "[ . 1 . 2]" 1 1581 1 194 SER HA 1 197 LEU H 3.500 . 3.500 3.429 3.257 3.505 0.005 18 0 "[ . 1 . 2]" 1 1582 1 196 THR HB 1 197 LEU H 2.800 . 2.800 2.791 2.634 2.808 0.008 17 0 "[ . 1 . 2]" 1 1583 1 197 LEU H 1 198 VAL MG2 5.500 . 5.500 3.990 3.861 4.088 . 0 0 "[ . 1 . 2]" 1 1584 1 197 LEU H 1 198 VAL H . . 2.800 2.641 2.565 2.724 . 0 0 "[ . 1 . 2]" 1 1585 1 197 LEU H 1 199 SER QB 5.500 . 5.500 4.731 4.532 4.902 . 0 0 "[ . 1 . 2]" 1 1586 1 197 LEU H 1 200 ILE H 5.000 . 5.000 4.974 4.864 5.010 0.010 6 0 "[ . 1 . 2]" 1 1587 1 195 LEU HA 1 198 VAL HB 3.500 . 3.500 3.262 3.058 3.503 0.003 12 0 "[ . 1 . 2]" 1 1588 1 194 SER QB 1 198 VAL MG2 6.000 . 6.000 3.644 3.042 4.147 . 0 0 "[ . 1 . 2]" 1 1589 1 195 LEU HA 1 198 VAL MG2 5.000 . 5.000 2.912 2.566 3.190 . 0 0 "[ . 1 . 2]" 1 1590 1 197 LEU QB 1 198 VAL MG2 4.500 . 4.500 2.917 2.705 3.082 . 0 0 "[ . 1 . 2]" 1 1591 1 198 VAL H 1 198 VAL MG2 3.300 . 3.300 2.106 1.969 2.310 . 0 0 "[ . 1 . 2]" 1 1592 1 196 THR MG 1 199 SER QB 6.000 . 6.000 3.423 3.225 3.754 . 0 0 "[ . 1 . 2]" 1 1593 1 199 SER QB 1 200 ILE H . . 4.000 2.410 2.226 2.691 . 0 0 "[ . 1 . 2]" 1 1594 1 196 THR H 1 199 SER H 5.000 . 5.000 4.887 4.756 4.999 . 0 0 "[ . 1 . 2]" 1 1595 1 197 LEU QB 1 199 SER H 5.500 . 5.500 4.391 4.283 4.530 . 0 0 "[ . 1 . 2]" 1 1596 1 197 LEU H 1 199 SER H 4.500 . 4.500 3.842 3.733 3.958 . 0 0 "[ . 1 . 2]" 1 1597 1 198 VAL HB 1 199 SER H 3.500 . 3.500 3.164 3.050 3.217 . 0 0 "[ . 1 . 2]" 1 1598 1 198 VAL MG2 1 199 SER H 5.500 . 5.500 3.932 3.885 3.983 . 0 0 "[ . 1 . 2]" 1 1599 1 199 SER H 1 200 ILE MD 5.500 . 5.500 4.588 4.581 4.595 . 0 0 "[ . 1 . 2]" 1 1600 1 199 SER H 1 200 ILE QG 5.500 . 5.500 3.426 3.352 3.538 . 0 0 "[ . 1 . 2]" 1 1601 1 199 SER H 1 200 ILE H 2.800 . 2.800 2.535 2.418 2.590 . 0 0 "[ . 1 . 2]" 1 1602 1 199 SER H 1 201 ILE H 4.500 . 4.500 3.790 3.630 4.125 . 0 0 "[ . 1 . 2]" 1 1603 1 200 ILE HB 1 201 ILE H 5.000 . 5.000 3.729 3.477 4.214 . 0 0 "[ . 1 . 2]" 1 1604 1 133 ILE MG 1 200 ILE MD 4.500 . 4.500 1.975 1.757 2.360 0.043 8 0 "[ . 1 . 2]" 1 1605 1 137 TYR QB 1 200 ILE MD 6.000 . 6.000 3.420 3.072 3.883 . 0 0 "[ . 1 . 2]" 1 1606 1 200 ILE H 1 200 ILE MD 4.000 . 4.000 3.336 3.318 3.346 . 0 0 "[ . 1 . 2]" 1 1607 1 172 PHE QE 1 200 ILE QG 5.500 . 5.500 3.989 3.554 4.319 . 0 0 "[ . 1 . 2]" 1 1608 1 200 ILE H 1 200 ILE QG . . 4.000 1.906 1.871 1.947 . 0 0 "[ . 1 . 2]" 1 1609 1 133 ILE MG 1 200 ILE MG 6.000 . 6.000 2.370 2.025 2.722 . 0 0 "[ . 1 . 2]" 1 1610 1 200 ILE H 1 200 ILE MG 4.000 . 4.000 2.336 2.271 2.437 . 0 0 "[ . 1 . 2]" 1 1611 1 200 ILE MG 1 201 ILE H 5.500 . 5.500 4.003 3.898 4.164 . 0 0 "[ . 1 . 2]" 1 1612 1 196 THR MG 1 200 ILE H 5.000 . 5.000 3.811 3.413 4.068 . 0 0 "[ . 1 . 2]" 1 1613 1 197 LEU MD1 1 200 ILE H 5.500 . 5.500 4.571 4.448 4.585 . 0 0 "[ . 1 . 2]" 1 1614 1 200 ILE H 1 201 ILE H 2.800 . 2.800 2.717 2.546 2.804 0.004 6 0 "[ . 1 . 2]" 1 1615 1 197 LEU MD1 1 201 ILE H 5.500 . 5.500 3.890 3.459 4.505 . 0 0 "[ . 1 . 2]" 1 1616 1 199 SER HA 1 201 ILE H 5.000 . 5.000 4.304 3.743 4.711 . 0 0 "[ . 1 . 2]" 1 1617 1 199 SER QB 1 201 ILE H 5.500 . 5.500 4.505 4.337 4.848 . 0 0 "[ . 1 . 2]" 1 1618 1 200 ILE QG 1 201 ILE H 5.500 . 5.500 2.179 1.894 2.805 . 0 0 "[ . 1 . 2]" 1 1619 1 203 THR HA 1 204 ALA H . . 2.800 2.536 2.197 2.802 0.002 12 0 "[ . 1 . 2]" 1 1620 1 203 THR H 1 204 ALA H 3.500 . 3.500 3.184 2.692 3.509 0.009 9 0 "[ . 1 . 2]" 1 1621 1 203 THR MG 1 204 ALA H 5.500 . 5.500 4.025 3.297 4.417 . 0 0 "[ . 1 . 2]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 188 _Distance_constraint_stats_list.Viol_count 471 _Distance_constraint_stats_list.Viol_total 92.199 _Distance_constraint_stats_list.Viol_max 0.040 _Distance_constraint_stats_list.Viol_rms 0.0044 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0012 _Distance_constraint_stats_list.Viol_average_violations_only 0.0098 _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 51 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 52 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 53 GLN 0.007 0.004 12 0 "[ . 1 . 2]" 1 54 SER 0.004 0.004 14 0 "[ . 1 . 2]" 1 55 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 56 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 57 GLN 0.274 0.039 17 0 "[ . 1 . 2]" 1 58 LYS 0.141 0.020 17 0 "[ . 1 . 2]" 1 59 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 60 MET 0.417 0.035 16 0 "[ . 1 . 2]" 1 61 THR 0.309 0.039 17 0 "[ . 1 . 2]" 1 62 GLN 0.137 0.020 17 0 "[ . 1 . 2]" 1 63 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 64 ASP 0.546 0.035 16 0 "[ . 1 . 2]" 1 65 HIS 0.183 0.019 10 0 "[ . 1 . 2]" 1 66 LEU 0.152 0.021 11 0 "[ . 1 . 2]" 1 67 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 68 LYS 0.129 0.024 14 0 "[ . 1 . 2]" 1 69 ASP 0.142 0.019 10 0 "[ . 1 . 2]" 1 70 ASP 0.152 0.021 11 0 "[ . 1 . 2]" 1 74 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 75 GLN 0.054 0.016 8 0 "[ . 1 . 2]" 1 76 GLU 0.662 0.040 4 0 "[ . 1 . 2]" 1 77 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 78 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 79 LYS 0.054 0.016 8 0 "[ . 1 . 2]" 1 80 ASP 0.662 0.040 4 0 "[ . 1 . 2]" 1 81 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 82 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 83 GLU 0.019 0.005 16 0 "[ . 1 . 2]" 1 84 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 85 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 86 LYS 0.289 0.023 1 0 "[ . 1 . 2]" 1 87 LYS 0.245 0.028 1 0 "[ . 1 . 2]" 1 88 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 89 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 90 GLU 0.289 0.023 1 0 "[ . 1 . 2]" 1 91 ILE 0.226 0.028 1 0 "[ . 1 . 2]" 1 92 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 101 LEU 0.102 0.012 13 0 "[ . 1 . 2]" 1 102 THR 0.026 0.026 9 0 "[ . 1 . 2]" 1 103 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 104 ALA 0.098 0.015 2 0 "[ . 1 . 2]" 1 105 LEU 0.121 0.012 13 0 "[ . 1 . 2]" 1 106 SER 0.026 0.026 9 0 "[ . 1 . 2]" 1 107 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 108 GLY 0.295 0.023 11 0 "[ . 1 . 2]" 1 109 LYS 0.137 0.018 1 0 "[ . 1 . 2]" 1 110 ARG 0.325 0.025 13 0 "[ . 1 . 2]" 1 111 LEU 0.039 0.011 6 0 "[ . 1 . 2]" 1 112 SER 0.204 0.023 11 0 "[ . 1 . 2]" 1 113 LYS 0.245 0.019 19 0 "[ . 1 . 2]" 1 114 SER 0.367 0.025 13 0 "[ . 1 . 2]" 1 115 LEU 0.039 0.011 6 0 "[ . 1 . 2]" 1 116 HIS 0.006 0.004 16 0 "[ . 1 . 2]" 1 117 GLU 0.126 0.019 19 0 "[ . 1 . 2]" 1 118 MET 0.042 0.010 3 0 "[ . 1 . 2]" 1 127 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 128 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 129 CYS 0.157 0.028 2 0 "[ . 1 . 2]" 1 130 SER 0.019 0.007 4 0 "[ . 1 . 2]" 1 131 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 132 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 133 ILE 0.167 0.028 2 0 "[ . 1 . 2]" 1 134 GLU 0.021 0.007 4 0 "[ . 1 . 2]" 1 135 GLN 0.060 0.014 6 0 "[ . 1 . 2]" 1 136 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 137 TYR 0.049 0.010 11 0 "[ . 1 . 2]" 1 138 LYS 0.003 0.003 6 0 "[ . 1 . 2]" 1 139 LEU 0.060 0.014 6 0 "[ . 1 . 2]" 1 140 ILE 0.118 0.017 3 0 "[ . 1 . 2]" 1 141 THR 0.072 0.010 11 0 "[ . 1 . 2]" 1 142 ALA 0.088 0.017 3 0 "[ . 1 . 2]" 1 143 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 144 ARG 0.121 0.017 3 0 "[ . 1 . 2]" 1 145 ARG 0.052 0.008 12 0 "[ . 1 . 2]" 1 146 ILE 0.088 0.017 3 0 "[ . 1 . 2]" 1 147 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 148 GLU 0.003 0.003 18 0 "[ . 1 . 2]" 1 149 SER 0.018 0.007 8 0 "[ . 1 . 2]" 1 157 TYR 0.022 0.007 10 0 "[ . 1 . 2]" 1 158 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 159 HIS 0.023 0.009 18 0 "[ . 1 . 2]" 1 160 HIS 0.006 0.004 20 0 "[ . 1 . 2]" 1 161 LEU 0.027 0.007 10 0 "[ . 1 . 2]" 1 162 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 163 ASN 0.105 0.012 18 0 "[ . 1 . 2]" 1 164 ASP 0.082 0.011 18 0 "[ . 1 . 2]" 1 165 TYR 0.005 0.003 11 0 "[ . 1 . 2]" 1 166 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 167 ASP 0.083 0.012 18 0 "[ . 1 . 2]" 1 168 LEU 0.077 0.011 18 0 "[ . 1 . 2]" 1 169 LEU 0.002 0.002 4 0 "[ . 1 . 2]" 1 170 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 171 GLU 0.008 0.008 2 0 "[ . 1 . 2]" 1 172 PHE 0.056 0.013 9 0 "[ . 1 . 2]" 1 173 GLN 0.002 0.002 4 0 "[ . 1 . 2]" 1 174 ILE 0.002 0.002 9 0 "[ . 1 . 2]" 1 175 SER 0.014 0.008 2 0 "[ . 1 . 2]" 1 176 LEU 0.056 0.013 9 0 "[ . 1 . 2]" 1 177 LYS 0.067 0.007 6 0 "[ . 1 . 2]" 1 178 ILE 0.021 0.006 8 0 "[ . 1 . 2]" 1 179 LEU 0.006 0.004 12 0 "[ . 1 . 2]" 1 180 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 181 GLU 0.067 0.007 6 0 "[ . 1 . 2]" 1 182 LYS 0.019 0.006 8 0 "[ . 1 . 2]" 1 183 CYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 184 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 191 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 192 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 193 LEU 0.010 0.007 20 0 "[ . 1 . 2]" 1 194 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 195 LEU 0.030 0.009 8 0 "[ . 1 . 2]" 1 196 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 197 LEU 0.010 0.007 20 0 "[ . 1 . 2]" 1 198 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 199 SER 0.030 0.009 8 0 "[ . 1 . 2]" 1 200 ILE 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 51 LYS O 1 55 ASP H 2.000 . 2.500 2.188 1.740 2.497 . 0 0 "[ . 1 . 2]" 2 2 1 51 LYS O 1 55 ASP N 3.000 2.300 3.500 3.054 2.663 3.314 . 0 0 "[ . 1 . 2]" 2 3 1 52 THR O 1 56 LEU H 2.000 . 2.500 2.208 1.766 2.499 . 0 0 "[ . 1 . 2]" 2 4 1 52 THR O 1 56 LEU N 3.000 2.300 3.500 3.097 2.701 3.350 . 0 0 "[ . 1 . 2]" 2 5 1 53 GLN O 1 57 GLN H 2.000 . 2.500 2.299 1.903 2.504 0.004 12 0 "[ . 1 . 2]" 2 6 1 53 GLN O 1 57 GLN N 3.000 2.300 3.500 3.267 2.883 3.459 . 0 0 "[ . 1 . 2]" 2 7 1 54 SER O 1 58 LYS H 2.000 . 2.500 2.058 1.838 2.504 0.004 14 0 "[ . 1 . 2]" 2 8 1 54 SER O 1 58 LYS N 3.000 2.300 3.500 3.000 2.781 3.409 . 0 0 "[ . 1 . 2]" 2 9 1 55 ASP O 1 59 PHE H 2.000 . 2.500 1.945 1.796 2.198 . 0 0 "[ . 1 . 2]" 2 10 1 55 ASP O 1 59 PHE N 3.000 2.300 3.500 2.804 2.708 2.994 . 0 0 "[ . 1 . 2]" 2 11 1 56 LEU O 1 60 MET H 2.000 . 2.500 2.262 2.045 2.426 . 0 0 "[ . 1 . 2]" 2 12 1 56 LEU O 1 60 MET N 3.000 2.300 3.500 3.088 2.958 3.232 . 0 0 "[ . 1 . 2]" 2 13 1 57 GLN O 1 61 THR H 2.000 . 2.500 2.482 2.006 2.539 0.039 17 0 "[ . 1 . 2]" 2 14 1 57 GLN O 1 61 THR N 3.000 2.300 3.500 3.441 2.986 3.489 . 0 0 "[ . 1 . 2]" 2 15 1 58 LYS O 1 62 GLN H 2.000 . 2.500 2.486 2.144 2.520 0.020 17 0 "[ . 1 . 2]" 2 16 1 58 LYS O 1 62 GLN N 3.000 2.300 3.500 3.182 2.932 3.260 . 0 0 "[ . 1 . 2]" 2 17 1 59 PHE O 1 63 LEU H 2.000 . 2.500 2.356 2.285 2.459 . 0 0 "[ . 1 . 2]" 2 18 1 59 PHE O 1 63 LEU N 3.000 2.300 3.500 3.128 3.073 3.239 . 0 0 "[ . 1 . 2]" 2 19 1 60 MET O 1 64 ASP H 2.000 . 2.500 2.521 2.501 2.535 0.035 16 0 "[ . 1 . 2]" 2 20 1 60 MET O 1 64 ASP N 3.000 2.300 3.500 3.456 3.433 3.486 . 0 0 "[ . 1 . 2]" 2 21 1 61 THR O 1 65 HIS H 2.000 . 2.500 2.451 2.256 2.516 0.016 15 0 "[ . 1 . 2]" 2 22 1 61 THR O 1 65 HIS N 3.000 2.300 3.500 3.241 3.025 3.364 . 0 0 "[ . 1 . 2]" 2 23 1 62 GLN O 1 66 LEU H 2.000 . 2.500 1.714 1.654 1.880 . 0 0 "[ . 1 . 2]" 2 24 1 62 GLN O 1 66 LEU N 3.000 2.300 3.500 2.626 2.552 2.789 . 0 0 "[ . 1 . 2]" 2 25 1 63 LEU O 1 67 ILE H 2.000 . 2.500 1.908 1.820 2.064 . 0 0 "[ . 1 . 2]" 2 26 1 63 LEU O 1 67 ILE N 3.000 2.300 3.500 2.873 2.781 3.023 . 0 0 "[ . 1 . 2]" 2 27 1 64 ASP O 1 68 LYS H 2.000 . 2.500 2.492 2.359 2.524 0.024 14 0 "[ . 1 . 2]" 2 28 1 64 ASP O 1 68 LYS N 3.000 2.300 3.500 3.320 3.152 3.394 . 0 0 "[ . 1 . 2]" 2 29 1 65 HIS O 1 69 ASP H 2.000 . 2.500 2.499 2.404 2.519 0.019 10 0 "[ . 1 . 2]" 2 30 1 65 HIS O 1 69 ASP N 3.000 2.300 3.500 3.293 3.218 3.340 . 0 0 "[ . 1 . 2]" 2 31 1 66 LEU O 1 70 ASP H 2.000 . 2.500 2.490 2.272 2.521 0.021 11 0 "[ . 1 . 2]" 2 32 1 66 LEU O 1 70 ASP N 3.000 2.300 3.500 3.155 2.860 3.271 . 0 0 "[ . 1 . 2]" 2 33 1 74 THR O 1 78 ILE H 2.000 . 2.500 2.062 2.012 2.138 . 0 0 "[ . 1 . 2]" 2 34 1 74 THR O 1 78 ILE N 3.000 2.300 3.500 2.980 2.918 3.046 . 0 0 "[ . 1 . 2]" 2 35 1 75 GLN O 1 79 LYS H 2.000 . 2.500 2.361 1.992 2.516 0.016 8 0 "[ . 1 . 2]" 2 36 1 75 GLN O 1 79 LYS N 3.000 2.300 3.500 3.076 2.739 3.265 . 0 0 "[ . 1 . 2]" 2 37 1 76 GLU O 1 80 ASP H 2.000 . 2.500 2.533 2.523 2.540 0.040 4 0 "[ . 1 . 2]" 2 38 1 76 GLU O 1 80 ASP N 3.000 2.300 3.500 3.380 3.358 3.403 . 0 0 "[ . 1 . 2]" 2 39 1 77 ILE O 1 81 VAL H 2.000 . 2.500 2.386 2.237 2.461 . 0 0 "[ . 1 . 2]" 2 40 1 77 ILE O 1 81 VAL N 3.000 2.300 3.500 3.272 3.138 3.341 . 0 0 "[ . 1 . 2]" 2 41 1 78 ILE O 1 82 LEU H 2.000 . 2.500 1.978 1.945 2.039 . 0 0 "[ . 1 . 2]" 2 42 1 78 ILE O 1 82 LEU N 3.000 2.300 3.500 2.940 2.901 3.010 . 0 0 "[ . 1 . 2]" 2 43 1 79 LYS O 1 83 GLU H 2.000 . 2.500 2.162 2.064 2.283 . 0 0 "[ . 1 . 2]" 2 44 1 79 LYS O 1 83 GLU N 3.000 2.300 3.500 3.093 2.991 3.210 . 0 0 "[ . 1 . 2]" 2 45 1 80 ASP O 1 84 TYR H 2.000 . 2.500 2.144 1.988 2.323 . 0 0 "[ . 1 . 2]" 2 46 1 80 ASP O 1 84 TYR N 3.000 2.300 3.500 2.943 2.818 3.106 . 0 0 "[ . 1 . 2]" 2 47 1 81 VAL O 1 85 LEU H 2.000 . 2.500 1.893 1.839 1.990 . 0 0 "[ . 1 . 2]" 2 48 1 81 VAL O 1 85 LEU N 3.000 2.300 3.500 2.809 2.681 2.911 . 0 0 "[ . 1 . 2]" 2 49 1 82 LEU O 1 86 LYS H 2.000 . 2.500 2.104 1.993 2.158 . 0 0 "[ . 1 . 2]" 2 50 1 82 LEU O 1 86 LYS N 3.000 2.300 3.500 3.004 2.882 3.051 . 0 0 "[ . 1 . 2]" 2 51 1 83 GLU O 1 87 LYS H 2.000 . 2.500 2.419 2.270 2.505 0.005 16 0 "[ . 1 . 2]" 2 52 1 83 GLU O 1 87 LYS N 3.000 2.300 3.500 3.308 3.173 3.394 . 0 0 "[ . 1 . 2]" 2 53 1 84 TYR O 1 88 LEU H 2.000 . 2.500 1.734 1.638 1.784 . 0 0 "[ . 1 . 2]" 2 54 1 84 TYR O 1 88 LEU N 3.000 2.300 3.500 2.712 2.610 2.760 . 0 0 "[ . 1 . 2]" 2 55 1 85 LEU O 1 89 ASP H 2.000 . 2.500 2.105 1.927 2.262 . 0 0 "[ . 1 . 2]" 2 56 1 85 LEU O 1 89 ASP N 3.000 2.300 3.500 2.733 2.589 2.845 . 0 0 "[ . 1 . 2]" 2 57 1 86 LYS O 1 90 GLU H 2.000 . 2.500 2.514 2.504 2.523 0.023 1 0 "[ . 1 . 2]" 2 58 1 86 LYS O 1 90 GLU N 3.000 2.300 3.500 3.305 3.236 3.400 . 0 0 "[ . 1 . 2]" 2 59 1 87 LYS O 1 91 ILE H 2.000 . 2.500 2.505 2.371 2.528 0.028 1 0 "[ . 1 . 2]" 2 60 1 87 LYS O 1 91 ILE N 3.000 2.300 3.500 3.385 3.322 3.428 . 0 0 "[ . 1 . 2]" 2 61 1 88 LEU O 1 92 TYR H 2.000 . 2.500 2.077 1.687 2.445 . 0 0 "[ . 1 . 2]" 2 62 1 88 LEU O 1 92 TYR N 3.000 2.300 3.500 3.041 2.657 3.423 . 0 0 "[ . 1 . 2]" 2 63 1 101 LEU O 1 105 LEU H 2.000 . 2.500 2.446 1.929 2.512 0.012 13 0 "[ . 1 . 2]" 2 64 1 101 LEU O 1 105 LEU N 3.000 2.300 3.500 3.270 2.836 3.422 . 0 0 "[ . 1 . 2]" 2 65 1 102 THR O 1 106 SER H 2.000 . 2.500 2.334 2.124 2.526 0.026 9 0 "[ . 1 . 2]" 2 66 1 102 THR O 1 106 SER N 3.000 2.300 3.500 3.266 3.078 3.465 . 0 0 "[ . 1 . 2]" 2 67 1 103 GLU O 1 107 LEU H 2.000 . 2.500 2.132 1.958 2.224 . 0 0 "[ . 1 . 2]" 2 68 1 103 GLU O 1 107 LEU N 3.000 2.300 3.500 3.082 2.900 3.188 . 0 0 "[ . 1 . 2]" 2 69 1 104 ALA O 1 108 GLY H 2.000 . 2.500 2.445 2.141 2.515 0.015 2 0 "[ . 1 . 2]" 2 70 1 104 ALA O 1 108 GLY N 3.000 2.300 3.500 3.365 3.087 3.472 . 0 0 "[ . 1 . 2]" 2 71 1 105 LEU O 1 109 LYS H 2.000 . 2.500 2.431 2.276 2.508 0.008 20 0 "[ . 1 . 2]" 2 72 1 105 LEU O 1 109 LYS N 3.000 2.300 3.500 3.297 3.173 3.410 . 0 0 "[ . 1 . 2]" 2 73 1 106 SER O 1 110 ARG H 2.000 . 2.500 1.916 1.777 2.045 . 0 0 "[ . 1 . 2]" 2 74 1 106 SER O 1 110 ARG N 3.000 2.300 3.500 2.875 2.715 3.014 . 0 0 "[ . 1 . 2]" 2 75 1 107 LEU O 1 111 LEU H 2.000 . 2.500 1.627 1.549 1.778 . 0 0 "[ . 1 . 2]" 2 76 1 107 LEU O 1 111 LEU N 3.000 2.300 3.500 2.494 2.449 2.558 . 0 0 "[ . 1 . 2]" 2 77 1 108 GLY O 1 112 SER H 2.000 . 2.500 2.492 2.369 2.523 0.023 11 0 "[ . 1 . 2]" 2 78 1 108 GLY O 1 112 SER N 3.000 2.300 3.500 3.253 3.121 3.359 . 0 0 "[ . 1 . 2]" 2 79 1 109 LYS O 1 113 LYS H 2.000 . 2.500 2.449 2.223 2.518 0.018 1 0 "[ . 1 . 2]" 2 80 1 109 LYS O 1 113 LYS N 3.000 2.300 3.500 3.292 3.048 3.375 . 0 0 "[ . 1 . 2]" 2 81 1 110 ARG O 1 114 SER H 2.000 . 2.500 2.516 2.505 2.525 0.025 13 0 "[ . 1 . 2]" 2 82 1 110 ARG O 1 114 SER N 3.000 2.300 3.500 3.416 3.383 3.456 . 0 0 "[ . 1 . 2]" 2 83 1 111 LEU O 1 115 LEU H 2.000 . 2.500 2.393 2.124 2.511 0.011 6 0 "[ . 1 . 2]" 2 84 1 111 LEU O 1 115 LEU N 3.000 2.300 3.500 3.256 2.979 3.381 . 0 0 "[ . 1 . 2]" 2 85 1 112 SER O 1 116 HIS H 2.000 . 2.500 2.256 1.728 2.504 0.004 16 0 "[ . 1 . 2]" 2 86 1 112 SER O 1 116 HIS N 3.000 2.300 3.500 3.142 2.702 3.403 . 0 0 "[ . 1 . 2]" 2 87 1 113 LYS O 1 117 GLU H 2.000 . 2.500 2.463 2.272 2.519 0.019 19 0 "[ . 1 . 2]" 2 88 1 113 LYS O 1 117 GLU N 3.000 2.300 3.500 3.324 3.117 3.419 . 0 0 "[ . 1 . 2]" 2 89 1 114 SER O 1 118 MET H 2.000 . 2.500 2.359 1.937 2.510 0.010 3 0 "[ . 1 . 2]" 2 90 1 114 SER O 1 118 MET N 3.000 2.300 3.500 3.136 2.779 3.308 . 0 0 "[ . 1 . 2]" 2 91 1 127 GLU O 1 131 GLY H 2.000 . 2.500 2.047 1.816 2.205 . 0 0 "[ . 1 . 2]" 2 92 1 127 GLU O 1 131 GLY N 3.000 2.300 3.500 2.949 2.729 3.112 . 0 0 "[ . 1 . 2]" 2 93 1 128 ILE O 1 132 LEU H 2.000 . 2.500 1.923 1.807 2.074 . 0 0 "[ . 1 . 2]" 2 94 1 128 ILE O 1 132 LEU N 3.000 2.300 3.500 2.890 2.777 3.043 . 0 0 "[ . 1 . 2]" 2 95 1 129 CYS O 1 133 ILE H 2.000 . 2.500 2.489 2.305 2.528 0.028 2 0 "[ . 1 . 2]" 2 96 1 129 CYS O 1 133 ILE N 3.000 2.300 3.500 3.372 3.228 3.439 . 0 0 "[ . 1 . 2]" 2 97 1 130 SER O 1 134 GLU H 2.000 . 2.500 2.351 1.933 2.507 0.007 4 0 "[ . 1 . 2]" 2 98 1 130 SER O 1 134 GLU N 3.000 2.300 3.500 3.181 2.870 3.391 . 0 0 "[ . 1 . 2]" 2 99 1 131 GLY O 1 135 GLN H 2.000 . 2.500 1.750 1.664 2.056 . 0 0 "[ . 1 . 2]" 2 100 1 131 GLY O 1 135 GLN N 3.000 2.300 3.500 2.685 2.563 2.902 . 0 0 "[ . 1 . 2]" 2 101 1 132 LEU O 1 136 LEU H 2.000 . 2.500 2.029 1.662 2.212 . 0 0 "[ . 1 . 2]" 2 102 1 132 LEU O 1 136 LEU N 3.000 2.300 3.500 2.959 2.634 3.169 . 0 0 "[ . 1 . 2]" 2 103 1 133 ILE O 1 137 TYR H 2.000 . 2.500 2.356 1.825 2.504 0.004 12 0 "[ . 1 . 2]" 2 104 1 133 ILE O 1 137 TYR N 3.000 2.300 3.500 3.187 2.689 3.351 . 0 0 "[ . 1 . 2]" 2 105 1 134 GLU O 1 138 LYS H 2.000 . 2.500 2.288 2.065 2.503 0.003 6 0 "[ . 1 . 2]" 2 106 1 134 GLU O 1 138 LYS N 3.000 2.300 3.500 3.036 2.873 3.353 . 0 0 "[ . 1 . 2]" 2 107 1 135 GLN O 1 139 LEU H 2.000 . 2.500 2.406 2.201 2.514 0.014 6 0 "[ . 1 . 2]" 2 108 1 135 GLN O 1 139 LEU N 3.000 2.300 3.500 3.232 3.038 3.330 . 0 0 "[ . 1 . 2]" 2 109 1 136 LEU O 1 140 ILE H 2.000 . 2.500 2.085 1.753 2.464 . 0 0 "[ . 1 . 2]" 2 110 1 136 LEU O 1 140 ILE N 3.000 2.300 3.500 2.962 2.686 3.326 . 0 0 "[ . 1 . 2]" 2 111 1 137 TYR O 1 141 THR H 2.000 . 2.500 2.388 1.916 2.510 0.010 11 0 "[ . 1 . 2]" 2 112 1 137 TYR O 1 141 THR N 3.000 2.300 3.500 3.216 2.848 3.359 . 0 0 "[ . 1 . 2]" 2 113 1 138 LYS O 1 142 ALA H 2.000 . 2.500 2.262 1.999 2.447 . 0 0 "[ . 1 . 2]" 2 114 1 138 LYS O 1 142 ALA N 3.000 2.300 3.500 3.142 2.860 3.322 . 0 0 "[ . 1 . 2]" 2 115 1 139 LEU O 1 143 SER H 2.000 . 2.500 1.935 1.743 2.103 . 0 0 "[ . 1 . 2]" 2 116 1 139 LEU O 1 143 SER N 3.000 2.300 3.500 2.865 2.671 3.004 . 0 0 "[ . 1 . 2]" 2 117 1 140 ILE O 1 144 ARG H 2.000 . 2.500 2.488 2.354 2.517 0.017 3 0 "[ . 1 . 2]" 2 118 1 140 ILE O 1 144 ARG N 3.000 2.300 3.500 3.289 3.177 3.332 . 0 0 "[ . 1 . 2]" 2 119 1 141 THR O 1 145 ARG H 2.000 . 2.500 2.455 2.204 2.508 0.008 12 0 "[ . 1 . 2]" 2 120 1 141 THR O 1 145 ARG N 3.000 2.300 3.500 3.182 3.015 3.378 . 0 0 "[ . 1 . 2]" 2 121 1 142 ALA O 1 146 ILE H 2.000 . 2.500 2.482 2.340 2.517 0.017 3 0 "[ . 1 . 2]" 2 122 1 142 ALA O 1 146 ILE N 3.000 2.300 3.500 3.302 3.139 3.409 . 0 0 "[ . 1 . 2]" 2 123 1 143 SER O 1 147 LEU H 2.000 . 2.500 2.185 1.896 2.410 . 0 0 "[ . 1 . 2]" 2 124 1 143 SER O 1 147 LEU N 3.000 2.300 3.500 3.112 2.821 3.300 . 0 0 "[ . 1 . 2]" 2 125 1 144 ARG O 1 148 GLU H 2.000 . 2.500 2.267 2.004 2.503 0.003 18 0 "[ . 1 . 2]" 2 126 1 144 ARG O 1 148 GLU N 3.000 2.300 3.500 3.209 2.904 3.469 . 0 0 "[ . 1 . 2]" 2 127 1 145 ARG O 1 149 SER H 2.000 . 2.500 2.390 1.917 2.507 0.007 8 0 "[ . 1 . 2]" 2 128 1 145 ARG O 1 149 SER N 3.000 2.300 3.500 3.190 2.685 3.387 . 0 0 "[ . 1 . 2]" 2 129 1 157 TYR O 1 161 LEU H 2.000 . 2.500 2.372 1.995 2.507 0.007 10 0 "[ . 1 . 2]" 2 130 1 157 TYR O 1 161 LEU N 3.000 2.300 3.500 3.289 2.864 3.457 . 0 0 "[ . 1 . 2]" 2 131 1 158 ILE O 1 162 ARG H 2.000 . 2.500 1.969 1.732 2.259 . 0 0 "[ . 1 . 2]" 2 132 1 158 ILE O 1 162 ARG N 3.000 2.300 3.500 2.854 2.610 3.115 . 0 0 "[ . 1 . 2]" 2 133 1 159 HIS O 1 163 ASN H 2.000 . 2.500 2.336 1.987 2.509 0.009 18 0 "[ . 1 . 2]" 2 134 1 159 HIS O 1 163 ASN N 3.000 2.300 3.500 3.081 2.809 3.273 . 0 0 "[ . 1 . 2]" 2 135 1 160 HIS O 1 164 ASP H 2.000 . 2.500 2.292 1.955 2.504 0.004 20 0 "[ . 1 . 2]" 2 136 1 160 HIS O 1 164 ASP N 3.000 2.300 3.500 3.249 2.898 3.450 . 0 0 "[ . 1 . 2]" 2 137 1 161 LEU O 1 165 TYR H 2.000 . 2.500 2.056 1.810 2.503 0.003 11 0 "[ . 1 . 2]" 2 138 1 161 LEU O 1 165 TYR N 3.000 2.300 3.500 2.802 2.606 3.149 . 0 0 "[ . 1 . 2]" 2 139 1 162 ARG O 1 166 GLN H 2.000 . 2.500 1.974 1.630 2.322 . 0 0 "[ . 1 . 2]" 2 140 1 162 ARG O 1 166 GLN N 3.000 2.300 3.500 2.865 2.596 3.202 . 0 0 "[ . 1 . 2]" 2 141 1 163 ASN O 1 167 ASP H 2.000 . 2.500 2.477 2.265 2.512 0.012 18 0 "[ . 1 . 2]" 2 142 1 163 ASN O 1 167 ASP N 3.000 2.300 3.500 3.359 3.186 3.432 . 0 0 "[ . 1 . 2]" 2 143 1 164 ASP O 1 168 LEU H 2.000 . 2.500 2.500 2.465 2.511 0.011 18 0 "[ . 1 . 2]" 2 144 1 164 ASP O 1 168 LEU N 3.000 2.300 3.500 3.352 3.259 3.412 . 0 0 "[ . 1 . 2]" 2 145 1 165 TYR O 1 169 LEU H 2.000 . 2.500 1.980 1.754 2.186 . 0 0 "[ . 1 . 2]" 2 146 1 165 TYR O 1 169 LEU N 3.000 2.300 3.500 2.918 2.727 3.152 . 0 0 "[ . 1 . 2]" 2 147 1 166 GLN O 1 170 GLN H 2.000 . 2.500 2.108 1.714 2.479 . 0 0 "[ . 1 . 2]" 2 148 1 166 GLN O 1 170 GLN N 3.000 2.300 3.500 2.998 2.595 3.293 . 0 0 "[ . 1 . 2]" 2 149 1 167 ASP O 1 171 GLU H 2.000 . 2.500 2.003 1.775 2.210 . 0 0 "[ . 1 . 2]" 2 150 1 167 ASP O 1 171 GLU N 3.000 2.300 3.500 2.965 2.746 3.164 . 0 0 "[ . 1 . 2]" 2 151 1 168 LEU O 1 172 PHE H 2.000 . 2.500 2.204 1.957 2.404 . 0 0 "[ . 1 . 2]" 2 152 1 168 LEU O 1 172 PHE N 3.000 2.300 3.500 3.017 2.773 3.176 . 0 0 "[ . 1 . 2]" 2 153 1 169 LEU O 1 173 GLN H 2.000 . 2.500 2.275 2.091 2.502 0.002 4 0 "[ . 1 . 2]" 2 154 1 169 LEU O 1 173 GLN N 3.000 2.300 3.500 3.119 2.902 3.326 . 0 0 "[ . 1 . 2]" 2 155 1 170 GLN O 1 174 ILE H 2.000 . 2.500 2.184 1.998 2.327 . 0 0 "[ . 1 . 2]" 2 156 1 170 GLN O 1 174 ILE N 3.000 2.300 3.500 3.043 2.898 3.203 . 0 0 "[ . 1 . 2]" 2 157 1 171 GLU O 1 175 SER H 2.000 . 2.500 2.222 1.901 2.508 0.008 2 0 "[ . 1 . 2]" 2 158 1 171 GLU O 1 175 SER N 3.000 2.300 3.500 3.149 2.879 3.385 . 0 0 "[ . 1 . 2]" 2 159 1 172 PHE O 1 176 LEU H 2.000 . 2.500 2.457 2.294 2.513 0.013 9 0 "[ . 1 . 2]" 2 160 1 172 PHE O 1 176 LEU N 3.000 2.300 3.500 3.365 3.148 3.472 . 0 0 "[ . 1 . 2]" 2 161 1 173 GLN O 1 177 LYS H 2.000 . 2.500 1.911 1.701 2.106 . 0 0 "[ . 1 . 2]" 2 162 1 173 GLN O 1 177 LYS N 3.000 2.300 3.500 2.736 2.582 2.942 . 0 0 "[ . 1 . 2]" 2 163 1 174 ILE O 1 178 ILE H 2.000 . 2.500 2.255 1.918 2.502 0.002 9 0 "[ . 1 . 2]" 2 164 1 174 ILE O 1 178 ILE N 3.000 2.300 3.500 3.184 2.848 3.469 . 0 0 "[ . 1 . 2]" 2 165 1 175 SER O 1 179 LEU H 2.000 . 2.500 2.270 1.995 2.504 0.004 12 0 "[ . 1 . 2]" 2 166 1 175 SER O 1 179 LEU N 3.000 2.300 3.500 3.082 2.850 3.275 . 0 0 "[ . 1 . 2]" 2 167 1 176 LEU O 1 180 THR H 2.000 . 2.500 1.892 1.670 2.497 . 0 0 "[ . 1 . 2]" 2 168 1 176 LEU O 1 180 THR N 3.000 2.300 3.500 2.800 2.589 3.375 . 0 0 "[ . 1 . 2]" 2 169 1 177 LYS O 1 181 GLU H 2.000 . 2.500 2.473 2.216 2.507 0.007 6 0 "[ . 1 . 2]" 2 170 1 177 LYS O 1 181 GLU N 3.000 2.300 3.500 3.333 3.152 3.447 . 0 0 "[ . 1 . 2]" 2 171 1 178 ILE O 1 182 LYS H 2.000 . 2.500 2.378 2.085 2.506 0.006 8 0 "[ . 1 . 2]" 2 172 1 178 ILE O 1 182 LYS N 3.000 2.300 3.500 3.308 2.902 3.477 . 0 0 "[ . 1 . 2]" 2 173 1 179 LEU O 1 183 CYS H 2.000 . 2.500 2.052 1.777 2.352 . 0 0 "[ . 1 . 2]" 2 174 1 179 LEU O 1 183 CYS N 3.000 2.300 3.500 2.903 2.665 3.145 . 0 0 "[ . 1 . 2]" 2 175 1 180 THR O 1 184 LEU H 2.000 . 2.500 1.917 1.684 2.152 . 0 0 "[ . 1 . 2]" 2 176 1 180 THR O 1 184 LEU N 3.000 2.300 3.500 2.705 2.577 2.968 . 0 0 "[ . 1 . 2]" 2 177 1 191 GLN O 1 195 LEU H 2.000 . 2.500 2.013 1.664 2.423 . 0 0 "[ . 1 . 2]" 2 178 1 191 GLN O 1 195 LEU N 3.000 2.300 3.500 2.916 2.633 3.264 . 0 0 "[ . 1 . 2]" 2 179 1 192 ASN O 1 196 THR H 2.000 . 2.500 2.226 1.967 2.493 . 0 0 "[ . 1 . 2]" 2 180 1 192 ASN O 1 196 THR N 3.000 2.300 3.500 3.152 2.928 3.408 . 0 0 "[ . 1 . 2]" 2 181 1 193 LEU O 1 197 LEU H 2.000 . 2.500 2.218 1.939 2.507 0.007 20 0 "[ . 1 . 2]" 2 182 1 193 LEU O 1 197 LEU N 3.000 2.300 3.500 3.088 2.771 3.392 . 0 0 "[ . 1 . 2]" 2 183 1 194 SER O 1 198 VAL H 2.000 . 2.500 2.179 1.910 2.492 . 0 0 "[ . 1 . 2]" 2 184 1 194 SER O 1 198 VAL N 3.000 2.300 3.500 3.087 2.796 3.343 . 0 0 "[ . 1 . 2]" 2 185 1 195 LEU O 1 199 SER H 2.000 . 2.500 2.445 2.227 2.509 0.009 8 0 "[ . 1 . 2]" 2 186 1 195 LEU O 1 199 SER N 3.000 2.300 3.500 3.144 2.900 3.237 . 0 0 "[ . 1 . 2]" 2 187 1 196 THR O 1 200 ILE H 2.000 . 2.500 2.128 1.981 2.270 . 0 0 "[ . 1 . 2]" 2 188 1 196 THR O 1 200 ILE N 3.000 2.300 3.500 3.099 2.959 3.248 . 0 0 "[ . 1 . 2]" 2 stop_ save_
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