NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
629434 | 6emr | 34182 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6emr 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 2791 _Distance_constraint_stats_list.Viol_count 7202 _Distance_constraint_stats_list.Viol_total 7301.454 _Distance_constraint_stats_list.Viol_max 0.497 _Distance_constraint_stats_list.Viol_rms 0.0115 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0016 _Distance_constraint_stats_list.Viol_average_violations_only 0.0253 _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 3 ALA 0.152 0.075 32 0 "[ . 1 . 2 . 3 . 4]" 1 4 ALA 0.098 0.098 30 0 "[ . 1 . 2 . 3 . 4]" 1 5 SER 0.598 0.117 12 0 "[ . 1 . 2 . 3 . 4]" 1 6 TRP 1.319 0.117 12 0 "[ . 1 . 2 . 3 . 4]" 1 7 GLU 1.958 0.092 3 0 "[ . 1 . 2 . 3 . 4]" 1 8 THR 1.005 0.087 22 0 "[ . 1 . 2 . 3 . 4]" 1 9 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 10 MET 5.526 0.217 2 0 "[ . 1 . 2 . 3 . 4]" 1 11 ASP 0.005 0.003 21 0 "[ . 1 . 2 . 3 . 4]" 1 12 SER 0.007 0.005 28 0 "[ . 1 . 2 . 3 . 4]" 1 13 ARG 1.034 0.180 2 0 "[ . 1 . 2 . 3 . 4]" 1 14 LEU 8.730 0.236 4 0 "[ . 1 . 2 . 3 . 4]" 1 15 GLN 1.399 0.188 5 0 "[ . 1 . 2 . 3 . 4]" 1 16 ARG 1.245 0.188 5 0 "[ . 1 . 2 . 3 . 4]" 1 17 ILE 3.770 0.117 5 0 "[ . 1 . 2 . 3 . 4]" 1 18 HIS 1.164 0.050 24 0 "[ . 1 . 2 . 3 . 4]" 1 19 ALA 1.157 0.120 8 0 "[ . 1 . 2 . 3 . 4]" 1 20 GLU 0.102 0.094 5 0 "[ . 1 . 2 . 3 . 4]" 1 21 ILE 4.011 0.215 9 0 "[ . 1 . 2 . 3 . 4]" 1 22 LYS 1.220 0.062 3 0 "[ . 1 . 2 . 3 . 4]" 1 23 ASN 0.281 0.161 28 0 "[ . 1 . 2 . 3 . 4]" 1 24 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 25 LEU 4.531 0.088 3 0 "[ . 1 . 2 . 3 . 4]" 1 26 LYS 3.754 0.161 28 0 "[ . 1 . 2 . 3 . 4]" 1 27 ILE 5.789 0.105 2 0 "[ . 1 . 2 . 3 . 4]" 1 28 ASP 0.782 0.096 10 0 "[ . 1 . 2 . 3 . 4]" 1 29 ASN 1.760 0.182 28 0 "[ . 1 . 2 . 3 . 4]" 1 30 LEU 4.373 0.201 28 0 "[ . 1 . 2 . 3 . 4]" 1 31 ASP 3.727 0.201 28 0 "[ . 1 . 2 . 3 . 4]" 1 32 VAL 3.202 0.190 10 0 "[ . 1 . 2 . 3 . 4]" 1 33 ASN 1.187 0.125 28 0 "[ . 1 . 2 . 3 . 4]" 1 34 ARG 0.006 0.003 29 0 "[ . 1 . 2 . 3 . 4]" 1 35 CYS 0.018 0.018 28 0 "[ . 1 . 2 . 3 . 4]" 1 36 ILE 3.448 0.125 28 0 "[ . 1 . 2 . 3 . 4]" 1 37 GLU 0.816 0.070 12 0 "[ . 1 . 2 . 3 . 4]" 1 38 ALA 3.343 0.100 28 0 "[ . 1 . 2 . 3 . 4]" 1 39 LEU 1.754 0.099 10 0 "[ . 1 . 2 . 3 . 4]" 1 40 ASP 0.100 0.043 12 0 "[ . 1 . 2 . 3 . 4]" 1 41 GLU 0.806 0.117 5 0 "[ . 1 . 2 . 3 . 4]" 1 42 LEU 16.746 0.497 18 0 "[ . 1 . 2 . 3 . 4]" 1 43 ALA 8.718 0.497 18 0 "[ . 1 . 2 . 3 . 4]" 1 44 SER 1.313 0.057 40 0 "[ . 1 . 2 . 3 . 4]" 1 45 LEU 5.159 0.333 16 0 "[ . 1 . 2 . 3 . 4]" 1 46 GLN 0.947 0.072 3 0 "[ . 1 . 2 . 3 . 4]" 1 47 VAL 10.680 0.333 16 0 "[ . 1 . 2 . 3 . 4]" 1 48 THR 2.611 0.168 28 0 "[ . 1 . 2 . 3 . 4]" 1 49 MET 4.703 0.075 40 0 "[ . 1 . 2 . 3 . 4]" 1 50 GLN 1.966 0.074 14 0 "[ . 1 . 2 . 3 . 4]" 1 51 GLN 1.218 0.168 28 0 "[ . 1 . 2 . 3 . 4]" 1 52 ALA 0.139 0.028 3 0 "[ . 1 . 2 . 3 . 4]" 1 53 GLN 0.473 0.039 8 0 "[ . 1 . 2 . 3 . 4]" 1 54 LYS 0.229 0.030 6 0 "[ . 1 . 2 . 3 . 4]" 1 55 HIS 0.823 0.236 4 0 "[ . 1 . 2 . 3 . 4]" 1 56 THR 2.515 0.097 6 0 "[ . 1 . 2 . 3 . 4]" 1 57 GLU 0.019 0.010 16 0 "[ . 1 . 2 . 3 . 4]" 1 58 MET 4.553 0.222 31 0 "[ . 1 . 2 . 3 . 4]" 1 59 ILE 2.546 0.180 28 0 "[ . 1 . 2 . 3 . 4]" 1 60 THR 0.491 0.029 6 0 "[ . 1 . 2 . 3 . 4]" 1 61 THR 0.456 0.054 8 0 "[ . 1 . 2 . 3 . 4]" 1 62 LEU 0.944 0.044 4 0 "[ . 1 . 2 . 3 . 4]" 1 63 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 64 LYS 0.997 0.031 5 0 "[ . 1 . 2 . 3 . 4]" 1 65 ILE 1.879 0.057 3 0 "[ . 1 . 2 . 3 . 4]" 1 66 ARG 1.152 0.057 3 0 "[ . 1 . 2 . 3 . 4]" 1 67 ARG 0.192 0.026 6 0 "[ . 1 . 2 . 3 . 4]" 1 68 PHE 9.154 0.215 9 0 "[ . 1 . 2 . 3 . 4]" 1 69 LYS 3.918 0.125 15 0 "[ . 1 . 2 . 3 . 4]" 1 70 VAL 2.983 0.094 14 0 "[ . 1 . 2 . 3 . 4]" 1 71 SER 0.535 0.066 30 0 "[ . 1 . 2 . 3 . 4]" 1 72 GLN 1.966 0.155 28 0 "[ . 1 . 2 . 3 . 4]" 1 73 VAL 6.578 0.292 5 0 "[ . 1 . 2 . 3 . 4]" 1 74 ILE 8.492 0.188 5 0 "[ . 1 . 2 . 3 . 4]" 1 75 MET 1.609 0.110 5 0 "[ . 1 . 2 . 3 . 4]" 1 76 GLU 0.274 0.036 2 0 "[ . 1 . 2 . 3 . 4]" 1 77 LYS 2.314 0.292 5 0 "[ . 1 . 2 . 3 . 4]" 1 78 SER 0.057 0.015 9 0 "[ . 1 . 2 . 3 . 4]" 1 79 THR 1.091 0.115 15 0 "[ . 1 . 2 . 3 . 4]" 1 80 MET 1.806 0.115 15 0 "[ . 1 . 2 . 3 . 4]" 1 81 LEU 3.770 0.158 10 0 "[ . 1 . 2 . 3 . 4]" 1 82 TYR 0.033 0.026 6 0 "[ . 1 . 2 . 3 . 4]" 1 83 ASN 0.768 0.056 6 0 "[ . 1 . 2 . 3 . 4]" 1 84 LYS 1.502 0.112 2 0 "[ . 1 . 2 . 3 . 4]" 1 85 PHE 3.390 0.104 28 0 "[ . 1 . 2 . 3 . 4]" 1 86 LYS 0.076 0.021 35 0 "[ . 1 . 2 . 3 . 4]" 1 87 ASN 0.427 0.056 3 0 "[ . 1 . 2 . 3 . 4]" 1 88 MET 2.539 0.096 16 0 "[ . 1 . 2 . 3 . 4]" 1 89 PHE 2.965 0.148 2 0 "[ . 1 . 2 . 3 . 4]" 1 90 LEU 6.921 0.222 16 0 "[ . 1 . 2 . 3 . 4]" 1 91 VAL 5.262 0.292 40 0 "[ . 1 . 2 . 3 . 4]" 1 92 GLY 1.519 0.236 32 0 "[ . 1 . 2 . 3 . 4]" 1 93 GLU 1.852 0.251 5 0 "[ . 1 . 2 . 3 . 4]" 1 94 GLY 2.066 0.292 40 0 "[ . 1 . 2 . 3 . 4]" 1 95 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 96 SER 0.317 0.042 4 0 "[ . 1 . 2 . 3 . 4]" 1 97 VAL 0.835 0.227 10 0 "[ . 1 . 2 . 3 . 4]" 1 98 ILE 2.865 0.227 10 0 "[ . 1 . 2 . 3 . 4]" 1 99 THR 1.026 0.076 16 0 "[ . 1 . 2 . 3 . 4]" 1 100 GLN 2.026 0.185 23 0 "[ . 1 . 2 . 3 . 4]" 1 101 VAL 1.769 0.162 30 0 "[ . 1 . 2 . 3 . 4]" 1 102 LEU 2.007 0.193 13 0 "[ . 1 . 2 . 3 . 4]" 1 103 ASN 0.927 0.193 13 0 "[ . 1 . 2 . 3 . 4]" 1 104 LYS 0.392 0.086 20 0 "[ . 1 . 2 . 3 . 4]" 1 105 GLU 0.119 0.033 15 0 "[ . 1 . 2 . 3 . 4]" 1 106 LEU 0.509 0.033 6 0 "[ . 1 . 2 . 3 . 4]" 1 107 SER 0.110 0.026 16 0 "[ . 1 . 2 . 3 . 4]" 1 108 ASP 0.554 0.064 8 0 "[ . 1 . 2 . 3 . 4]" 1 109 LYS 0.712 0.096 5 0 "[ . 1 . 2 . 3 . 4]" 1 110 LYS 0.386 0.062 13 0 "[ . 1 . 2 . 3 . 4]" 1 111 ASN 0.492 0.062 13 0 "[ . 1 . 2 . 3 . 4]" 1 112 GLU 0.293 0.057 40 0 "[ . 1 . 2 . 3 . 4]" 1 113 GLU 0.371 0.054 18 0 "[ . 1 . 2 . 3 . 4]" 1 114 LYS 0.676 0.113 4 0 "[ . 1 . 2 . 3 . 4]" 1 115 ASP 0.292 0.038 30 0 "[ . 1 . 2 . 3 . 4]" 1 116 LEU 1.722 0.169 5 0 "[ . 1 . 2 . 3 . 4]" 1 117 PHE 1.537 0.147 20 0 "[ . 1 . 2 . 3 . 4]" 1 118 GLY 0.065 0.040 24 0 "[ . 1 . 2 . 3 . 4]" 1 119 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 120 ASP 0.090 0.027 10 0 "[ . 1 . 2 . 3 . 4]" 1 121 SER 0.461 0.101 6 0 "[ . 1 . 2 . 3 . 4]" 1 122 GLU 0.265 0.043 10 0 "[ . 1 . 2 . 3 . 4]" 1 123 SER 0.122 0.031 1 0 "[ . 1 . 2 . 3 . 4]" 1 124 GLY 0.419 0.086 28 0 "[ . 1 . 2 . 3 . 4]" 1 125 ASN 0.943 0.070 10 0 "[ . 1 . 2 . 3 . 4]" 1 126 GLU 2.134 0.130 19 0 "[ . 1 . 2 . 3 . 4]" 1 127 GLU 5.534 0.193 5 0 "[ . 1 . 2 . 3 . 4]" 1 128 GLU 3.690 0.193 5 0 "[ . 1 . 2 . 3 . 4]" 1 129 ASN 2.955 0.105 9 0 "[ . 1 . 2 . 3 . 4]" 1 130 LEU 4.210 0.130 19 0 "[ . 1 . 2 . 3 . 4]" 1 131 ILE 2.998 0.098 19 0 "[ . 1 . 2 . 3 . 4]" 1 132 ALA 10.012 0.291 2 0 "[ . 1 . 2 . 3 . 4]" 1 133 ASP 0.625 0.026 22 0 "[ . 1 . 2 . 3 . 4]" 1 134 ILE 14.704 0.291 2 0 "[ . 1 . 2 . 3 . 4]" 1 135 PHE 9.134 0.222 16 0 "[ . 1 . 2 . 3 . 4]" 1 136 GLY 0.019 0.009 23 0 "[ . 1 . 2 . 3 . 4]" 1 137 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 138 SER 0.166 0.021 18 0 "[ . 1 . 2 . 3 . 4]" 1 139 GLY 0.223 0.024 14 0 "[ . 1 . 2 . 3 . 4]" 1 140 ASP 0.649 0.039 10 0 "[ . 1 . 2 . 3 . 4]" 1 141 GLU 0.974 0.053 26 0 "[ . 1 . 2 . 3 . 4]" 1 142 GLU 0.285 0.053 26 0 "[ . 1 . 2 . 3 . 4]" 1 143 GLU 0.099 0.054 5 0 "[ . 1 . 2 . 3 . 4]" 1 144 GLU 1.266 0.097 2 0 "[ . 1 . 2 . 3 . 4]" 1 145 GLU 2.152 0.097 2 0 "[ . 1 . 2 . 3 . 4]" 1 146 PHE 1.661 0.085 28 0 "[ . 1 . 2 . 3 . 4]" 1 147 THR 0.102 0.036 10 0 "[ . 1 . 2 . 3 . 4]" 1 148 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 149 PHE 3.037 0.171 10 0 "[ . 1 . 2 . 3 . 4]" 1 150 ASN 2.534 0.105 2 0 "[ . 1 . 2 . 3 . 4]" 1 151 GLN 1.505 0.063 10 0 "[ . 1 . 2 . 3 . 4]" 1 152 GLU 1.269 0.064 22 0 "[ . 1 . 2 . 3 . 4]" 1 153 ASP 0.967 0.064 22 0 "[ . 1 . 2 . 3 . 4]" 1 154 LEU 2.974 0.171 10 0 "[ . 1 . 2 . 3 . 4]" 1 155 GLU 0.834 0.060 16 0 "[ . 1 . 2 . 3 . 4]" 1 156 GLU 1.038 0.097 12 0 "[ . 1 . 2 . 3 . 4]" 1 157 GLU 0.952 0.097 12 0 "[ . 1 . 2 . 3 . 4]" 1 158 LYS 0.949 0.082 11 0 "[ . 1 . 2 . 3 . 4]" 1 159 GLY 0.532 0.062 16 0 "[ . 1 . 2 . 3 . 4]" 1 160 GLU 0.124 0.025 10 0 "[ . 1 . 2 . 3 . 4]" 1 161 THR 0.331 0.041 15 0 "[ . 1 . 2 . 3 . 4]" 1 162 GLN 0.341 0.054 5 0 "[ . 1 . 2 . 3 . 4]" 1 163 VAL 1.536 0.205 3 0 "[ . 1 . 2 . 3 . 4]" 1 164 LYS 1.127 0.048 25 0 "[ . 1 . 2 . 3 . 4]" 1 165 GLU 1.323 0.205 3 0 "[ . 1 . 2 . 3 . 4]" 1 166 ALA 0.761 0.099 28 0 "[ . 1 . 2 . 3 . 4]" 1 167 GLU 0.184 0.099 28 0 "[ . 1 . 2 . 3 . 4]" 1 168 ASP 0.372 0.057 17 0 "[ . 1 . 2 . 3 . 4]" 1 169 SER 0.085 0.023 2 0 "[ . 1 . 2 . 3 . 4]" 1 170 ASP 0.648 0.066 20 0 "[ . 1 . 2 . 3 . 4]" 1 171 SER 0.648 0.066 20 0 "[ . 1 . 2 . 3 . 4]" 1 172 ASP 0.004 0.004 36 0 "[ . 1 . 2 . 3 . 4]" 1 173 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 174 ASN 0.062 0.013 20 0 "[ . 1 . 2 . 3 . 4]" 1 175 ILE 0.140 0.014 20 0 "[ . 1 . 2 . 3 . 4]" 1 176 LYS 0.409 0.120 30 0 "[ . 1 . 2 . 3 . 4]" 1 177 ARG 0.117 0.068 9 0 "[ . 1 . 2 . 3 . 4]" 1 178 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 179 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 180 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 182 ASP 0.496 0.046 2 0 "[ . 1 . 2 . 3 . 4]" 1 183 PHE 1.270 0.068 20 0 "[ . 1 . 2 . 3 . 4]" 1 184 LEU 6.341 0.277 12 0 "[ . 1 . 2 . 3 . 4]" 1 185 SER 0.381 0.049 40 0 "[ . 1 . 2 . 3 . 4]" 1 186 ASP 0.286 0.023 28 0 "[ . 1 . 2 . 3 . 4]" 1 187 PHE 2.678 0.224 10 0 "[ . 1 . 2 . 3 . 4]" 1 188 GLU 2.054 0.277 12 0 "[ . 1 . 2 . 3 . 4]" 1 189 MET 0.583 0.078 11 0 "[ . 1 . 2 . 3 . 4]" 1 190 MET 1.180 0.089 12 0 "[ . 1 . 2 . 3 . 4]" 1 191 LEU 2.036 0.108 16 0 "[ . 1 . 2 . 3 . 4]" 1 192 GLN 0.644 0.040 15 0 "[ . 1 . 2 . 3 . 4]" 1 193 ARG 0.040 0.012 18 0 "[ . 1 . 2 . 3 . 4]" 1 194 LYS 0.010 0.007 24 0 "[ . 1 . 2 . 3 . 4]" 1 195 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 196 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 197 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]" 1 200 LYS 0.032 0.032 30 0 "[ . 1 . 2 . 3 . 4]" 1 201 ARG 0.032 0.032 30 0 "[ . 1 . 2 . 3 . 4]" 1 205 ARG 0.067 0.031 9 0 "[ . 1 . 2 . 3 . 4]" 1 206 ASP 0.040 0.017 13 0 "[ . 1 . 2 . 3 . 4]" 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 3 ALA HA 1 4 ALA H 3.530 . 3.530 2.631 2.171 3.527 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2 1 3 ALA MB 1 4 ALA H 4.010 . 4.010 2.757 1.830 3.710 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 3 1 3 ALA MB 1 5 SER H 4.660 . 4.660 2.909 2.296 4.690 0.030 2 0 "[ . 1 . 2 . 3 . 4]" 1 4 1 3 ALA MB 1 5 SER HA 5.280 . 5.280 4.576 3.373 5.355 0.075 32 0 "[ . 1 . 2 . 3 . 4]" 1 5 1 4 ALA H 1 4 ALA MB 3.190 . 3.190 2.451 2.207 2.939 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 6 1 4 ALA H 1 5 SER H 4.620 . 4.620 2.786 1.925 4.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 7 1 4 ALA MB 1 5 SER H 4.090 . 4.090 3.212 1.835 3.760 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 8 1 4 ALA MB 1 5 SER HA 4.640 . 4.640 4.231 3.881 4.738 0.098 30 0 "[ . 1 . 2 . 3 . 4]" 1 9 1 5 SER HA 1 6 TRP H 3.490 . 3.490 2.497 2.141 3.477 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 10 1 5 SER HA 1 6 TRP QB 4.780 . 4.780 4.325 3.836 4.897 0.117 12 0 "[ . 1 . 2 . 3 . 4]" 1 11 1 5 SER QB 1 6 TRP H 4.020 . 4.020 3.073 1.914 3.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 12 1 5 SER HB2 1 6 TRP H 4.650 . 4.650 3.716 2.376 4.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 13 1 5 SER HB3 1 6 TRP H 4.650 . 4.650 3.524 1.989 4.541 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 14 1 6 TRP H 1 6 TRP QB 3.350 . 3.350 2.558 1.896 3.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 15 1 6 TRP H 1 6 TRP HD1 4.760 . 4.760 3.758 2.183 4.777 0.017 12 0 "[ . 1 . 2 . 3 . 4]" 1 16 1 6 TRP H 1 6 TRP HE3 5.380 . 5.380 5.097 3.242 5.404 0.024 2 0 "[ . 1 . 2 . 3 . 4]" 1 17 1 6 TRP H 1 7 GLU H 4.520 . 4.520 3.754 1.679 4.542 0.022 3 0 "[ . 1 . 2 . 3 . 4]" 1 18 1 6 TRP HA 1 6 TRP HE3 4.670 . 4.670 3.518 2.293 4.676 0.006 34 0 "[ . 1 . 2 . 3 . 4]" 1 19 1 6 TRP QB 1 6 TRP HD1 3.590 . 3.590 2.591 2.504 2.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 20 1 6 TRP QB 1 6 TRP HE3 3.440 . 3.440 2.681 2.426 2.969 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 21 1 6 TRP QB 1 7 GLU H 3.440 . 3.440 2.735 1.659 3.469 0.029 24 0 "[ . 1 . 2 . 3 . 4]" 1 22 1 6 TRP QB 1 7 GLU HA 4.410 . 4.410 4.326 3.866 4.502 0.092 3 0 "[ . 1 . 2 . 3 . 4]" 1 23 1 6 TRP HE3 1 7 GLU H 4.380 . 4.380 2.667 1.913 3.826 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 24 1 6 TRP HE3 1 7 GLU HA 4.720 . 4.720 4.000 2.422 4.746 0.026 10 0 "[ . 1 . 2 . 3 . 4]" 1 25 1 6 TRP HE3 1 7 GLU HG2 5.500 . 5.500 3.559 2.128 5.507 0.007 29 0 "[ . 1 . 2 . 3 . 4]" 1 26 1 6 TRP HE3 1 7 GLU HG3 5.500 . 5.500 4.748 3.323 5.515 0.015 15 0 "[ . 1 . 2 . 3 . 4]" 1 27 1 7 GLU H 1 7 GLU HB2 3.760 . 3.760 3.470 2.700 3.615 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 28 1 7 GLU H 1 7 GLU QB 2.980 . 2.980 2.587 2.293 2.930 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 29 1 7 GLU H 1 7 GLU HB3 3.760 . 3.760 2.752 2.325 3.590 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 30 1 7 GLU H 1 7 GLU HG2 4.290 . 4.290 2.038 1.663 2.483 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 31 1 7 GLU H 1 7 GLU QG 3.710 . 3.710 1.991 1.636 2.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 32 1 7 GLU H 1 7 GLU HG3 4.290 . 4.290 3.147 1.843 3.816 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 33 1 7 GLU H 1 8 THR H 4.180 . 4.180 2.645 2.345 3.084 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 34 1 7 GLU H 1 8 THR MG 4.410 . 4.410 4.074 3.703 4.432 0.022 3 0 "[ . 1 . 2 . 3 . 4]" 1 35 1 7 GLU HA 1 7 GLU HG2 3.950 . 3.950 3.650 3.305 3.821 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 36 1 7 GLU HA 1 7 GLU HG3 3.950 . 3.950 3.839 3.632 3.987 0.037 10 0 "[ . 1 . 2 . 3 . 4]" 1 37 1 7 GLU HA 1 8 THR H 3.560 . 3.560 3.485 3.357 3.565 0.005 39 0 "[ . 1 . 2 . 3 . 4]" 1 38 1 7 GLU HA 1 8 THR MG 4.870 . 4.870 4.788 4.171 4.894 0.024 8 0 "[ . 1 . 2 . 3 . 4]" 1 39 1 7 GLU QB 1 8 THR H 3.630 . 3.630 3.370 2.147 3.668 0.038 22 0 "[ . 1 . 2 . 3 . 4]" 1 40 1 7 GLU QB 1 8 THR MG 4.090 . 4.090 3.604 2.278 4.177 0.087 22 0 "[ . 1 . 2 . 3 . 4]" 1 41 1 7 GLU HB2 1 8 THR H 4.310 . 4.310 3.667 2.168 4.197 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 42 1 7 GLU HB3 1 8 THR H 4.310 . 4.310 4.075 3.454 4.313 0.003 30 0 "[ . 1 . 2 . 3 . 4]" 1 43 1 7 GLU QG 1 8 THR H 3.880 . 3.880 2.455 1.691 3.603 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 44 1 7 GLU HG2 1 8 THR H 4.450 . 4.450 2.932 2.123 3.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 45 1 7 GLU HG2 1 8 THR MG 4.520 . 4.520 3.224 2.319 4.546 0.026 3 0 "[ . 1 . 2 . 3 . 4]" 1 46 1 7 GLU HG3 1 8 THR H 4.450 . 4.450 3.054 1.695 4.472 0.022 3 0 "[ . 1 . 2 . 3 . 4]" 1 47 1 7 GLU HG3 1 8 THR MG 4.520 . 4.520 2.848 2.220 4.551 0.031 6 0 "[ . 1 . 2 . 3 . 4]" 1 48 1 8 THR H 1 8 THR MG 3.490 . 3.490 2.378 2.046 2.717 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 49 1 8 THR MG 1 9 SER H 4.440 . 4.440 4.136 3.874 4.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 50 1 10 MET HA 1 10 MET HG2 4.200 . 4.200 3.458 2.294 3.901 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 51 1 10 MET HA 1 10 MET HG3 4.200 . 4.200 3.110 2.525 3.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 52 1 10 MET HA 1 12 SER H 4.660 . 4.660 4.344 3.954 4.665 0.005 28 0 "[ . 1 . 2 . 3 . 4]" 1 53 1 10 MET HA 1 13 ARG H 4.120 . 4.120 3.427 2.987 4.113 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 54 1 10 MET HA 1 13 ARG QD 4.350 . 4.350 2.656 2.017 4.352 0.002 33 0 "[ . 1 . 2 . 3 . 4]" 1 55 1 10 MET QB 1 11 ASP H 3.710 . 3.710 2.604 2.306 2.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 56 1 10 MET HB2 1 11 ASP H 4.350 . 4.350 3.909 3.755 4.065 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 57 1 10 MET HB3 1 11 ASP H 4.350 . 4.350 2.646 2.327 2.918 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 58 1 10 MET ME 1 13 ARG H 5.500 . 5.500 5.237 4.483 5.523 0.023 10 0 "[ . 1 . 2 . 3 . 4]" 1 59 1 10 MET ME 1 13 ARG QD 4.050 . 4.050 3.986 3.108 4.230 0.180 2 0 "[ . 1 . 2 . 3 . 4]" 1 60 1 10 MET ME 1 14 LEU H 4.600 . 4.600 4.122 3.385 4.577 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 61 1 10 MET ME 1 14 LEU MD1 3.530 . 3.530 2.239 1.911 2.565 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 62 1 10 MET ME 1 14 LEU MD2 3.530 . 3.530 2.207 1.908 2.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 63 1 10 MET ME 1 14 LEU HG 3.540 . 3.540 2.820 2.061 3.680 0.140 9 0 "[ . 1 . 2 . 3 . 4]" 1 64 1 10 MET ME 1 42 LEU QD 4.100 . 4.100 4.106 3.842 4.231 0.131 30 0 "[ . 1 . 2 . 3 . 4]" 1 65 1 10 MET ME 1 45 LEU QB 3.380 . 3.380 2.009 1.895 2.270 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 66 1 10 MET ME 1 45 LEU MD1 3.140 . 3.140 2.429 2.017 2.985 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 67 1 10 MET ME 1 45 LEU QD 2.720 . 2.720 2.229 1.938 2.706 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 68 1 10 MET ME 1 45 LEU MD2 3.140 . 3.140 2.641 2.177 3.139 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 69 1 10 MET ME 1 46 GLN H 3.770 . 3.770 3.176 2.754 3.785 0.015 9 0 "[ . 1 . 2 . 3 . 4]" 1 70 1 10 MET ME 1 47 VAL H 3.930 . 3.930 3.119 2.804 3.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 71 1 10 MET ME 1 47 VAL HA 3.070 . 3.070 2.218 2.014 2.622 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 72 1 10 MET ME 1 47 VAL MG1 3.590 . 3.590 3.227 2.671 3.622 0.032 14 0 "[ . 1 . 2 . 3 . 4]" 1 73 1 10 MET ME 1 47 VAL QG 2.950 . 2.950 2.597 1.941 3.112 0.162 14 0 "[ . 1 . 2 . 3 . 4]" 1 74 1 10 MET ME 1 47 VAL MG2 3.590 . 3.590 2.772 1.993 3.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 75 1 10 MET ME 1 48 THR H 4.660 . 4.660 3.647 3.362 3.992 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 76 1 10 MET ME 1 51 GLN QE 3.930 . 3.930 3.347 2.348 3.984 0.054 6 0 "[ . 1 . 2 . 3 . 4]" 1 77 1 10 MET QG 1 11 ASP HA 4.620 . 4.620 3.724 3.181 4.623 0.003 21 0 "[ . 1 . 2 . 3 . 4]" 1 78 1 10 MET QG 1 14 LEU QD 3.350 . 3.350 3.092 2.522 3.567 0.217 2 0 "[ . 1 . 2 . 3 . 4]" 1 79 1 10 MET QG 1 51 GLN QE 4.420 . 4.420 2.659 1.703 4.467 0.047 20 0 "[ . 1 . 2 . 3 . 4]" 1 80 1 10 MET HG2 1 14 LEU MD1 5.500 . 5.500 4.323 3.274 5.223 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 81 1 10 MET HG2 1 14 LEU MD2 5.500 . 5.500 4.802 3.737 5.511 0.011 4 0 "[ . 1 . 2 . 3 . 4]" 1 82 1 10 MET HG3 1 14 LEU MD1 5.500 . 5.500 3.864 2.599 5.520 0.020 2 0 "[ . 1 . 2 . 3 . 4]" 1 83 1 10 MET HG3 1 14 LEU MD2 5.500 . 5.500 4.352 2.657 5.504 0.004 9 0 "[ . 1 . 2 . 3 . 4]" 1 84 1 11 ASP H 1 11 ASP QB 3.640 . 3.640 2.299 2.074 2.806 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 85 1 11 ASP H 1 12 SER H 3.860 . 3.860 2.664 2.536 2.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 86 1 11 ASP H 1 13 ARG H 4.680 . 4.680 4.086 3.896 4.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 87 1 11 ASP HA 1 14 LEU H 4.590 . 4.590 3.564 3.118 4.129 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 88 1 11 ASP HA 1 14 LEU QD 3.780 . 3.780 2.566 2.089 3.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 89 1 11 ASP QB 1 12 SER H 3.780 . 3.780 2.733 2.260 3.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 90 1 12 SER H 1 12 SER QB 3.320 . 3.320 2.473 2.216 2.760 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 91 1 12 SER H 1 13 ARG H 3.760 . 3.760 2.606 2.433 2.831 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 92 1 12 SER H 1 13 ARG HA 5.500 . 5.500 5.239 5.079 5.444 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 93 1 12 SER H 1 13 ARG QB 5.030 . 5.030 4.705 4.247 4.904 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 94 1 12 SER QB 1 13 ARG H 3.700 . 3.700 2.822 2.625 3.470 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 95 1 13 ARG H 1 13 ARG QB 3.430 . 3.430 2.455 2.116 2.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 96 1 13 ARG H 1 13 ARG HD2 5.500 . 5.500 4.230 3.589 4.980 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 97 1 13 ARG H 1 13 ARG QD 4.660 . 4.660 3.869 3.483 4.353 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 98 1 13 ARG H 1 13 ARG HD3 5.500 . 5.500 4.657 3.938 5.359 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 99 1 13 ARG H 1 13 ARG HG2 4.230 . 4.230 3.538 3.138 4.019 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 100 1 13 ARG H 1 13 ARG QG 3.670 . 3.670 2.399 2.086 3.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 101 1 13 ARG H 1 13 ARG HG3 4.230 . 4.230 2.489 2.115 4.238 0.008 38 0 "[ . 1 . 2 . 3 . 4]" 1 102 1 13 ARG H 1 14 LEU H 3.970 . 3.970 2.684 2.574 2.889 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 103 1 13 ARG HA 1 13 ARG HD2 5.500 . 5.500 4.684 4.466 4.992 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 104 1 13 ARG HA 1 13 ARG QD 4.760 . 4.760 4.068 3.786 4.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 105 1 13 ARG HA 1 13 ARG HD3 5.500 . 5.500 4.489 4.027 5.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 106 1 13 ARG HA 1 16 ARG H 4.650 . 4.650 3.410 3.031 3.634 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 107 1 13 ARG HA 1 16 ARG QB 3.730 . 3.730 2.580 2.206 2.903 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 108 1 13 ARG HA 1 45 LEU QD 5.200 . 5.200 4.398 4.144 5.179 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 109 1 13 ARG QB 1 14 LEU H 3.460 . 3.460 2.493 2.297 3.461 0.001 38 0 "[ . 1 . 2 . 3 . 4]" 1 110 1 13 ARG QB 1 14 LEU QD 4.890 . 4.890 3.362 2.548 4.882 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 111 1 13 ARG QD 1 14 LEU QD 4.850 . 4.850 4.409 3.664 4.879 0.029 28 0 "[ . 1 . 2 . 3 . 4]" 1 112 1 13 ARG QD 1 45 LEU QD 3.190 . 3.190 2.181 1.913 2.706 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 113 1 13 ARG HD2 1 45 LEU MD1 5.500 . 5.500 3.606 2.771 4.802 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 114 1 13 ARG HD2 1 45 LEU MD2 5.500 . 5.500 2.976 2.156 3.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 115 1 13 ARG HD3 1 45 LEU MD1 5.500 . 5.500 3.045 2.496 3.796 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 116 1 13 ARG HD3 1 45 LEU MD2 5.500 . 5.500 2.453 2.005 2.895 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 117 1 13 ARG QG 1 14 LEU H 5.210 . 5.210 3.995 2.532 4.223 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 118 1 13 ARG QG 1 17 ILE MD 4.980 . 4.980 4.449 2.569 5.007 0.027 28 0 "[ . 1 . 2 . 3 . 4]" 1 119 1 13 ARG QG 1 45 LEU QD 4.010 . 4.010 3.460 2.297 3.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 120 1 14 LEU H 1 14 LEU MD1 3.940 . 3.940 3.256 2.282 3.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 121 1 14 LEU H 1 14 LEU MD2 3.940 . 3.940 3.251 2.455 3.667 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 122 1 14 LEU H 1 14 LEU HG 4.180 . 4.180 2.625 2.022 4.184 0.004 16 0 "[ . 1 . 2 . 3 . 4]" 1 123 1 14 LEU H 1 15 GLN H 3.810 . 3.810 2.732 2.542 2.816 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 124 1 14 LEU H 1 16 ARG H 5.070 . 5.070 4.199 4.073 4.331 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 125 1 14 LEU H 1 45 LEU MD1 5.370 . 5.370 3.832 3.676 4.168 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 126 1 14 LEU H 1 45 LEU QD 4.730 . 4.730 3.753 3.612 4.036 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 127 1 14 LEU H 1 45 LEU MD2 5.370 . 5.370 5.374 5.287 5.412 0.042 12 0 "[ . 1 . 2 . 3 . 4]" 1 128 1 14 LEU HA 1 14 LEU MD1 4.080 . 4.080 3.495 2.057 3.937 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 129 1 14 LEU HA 1 14 LEU QD 3.060 . 3.060 2.105 2.045 2.172 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 130 1 14 LEU HA 1 14 LEU MD2 4.080 . 4.080 2.506 2.053 3.884 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 131 1 14 LEU HA 1 17 ILE HB 4.440 . 4.440 2.889 2.752 3.081 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 132 1 14 LEU HA 1 17 ILE MD 3.790 . 3.790 2.353 2.052 2.835 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 133 1 14 LEU HA 1 17 ILE MG 4.890 . 4.890 4.285 4.141 4.424 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 134 1 14 LEU HA 1 42 LEU QD 4.270 . 4.270 2.983 2.571 4.042 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 135 1 14 LEU HA 1 58 MET ME 5.080 . 5.080 3.909 3.511 4.373 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 136 1 14 LEU QB 1 15 GLN H 3.960 . 3.960 2.527 2.433 2.831 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 137 1 14 LEU QB 1 15 GLN QB 5.180 . 5.180 3.883 3.706 4.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 138 1 14 LEU QB 1 58 MET ME 3.110 . 3.110 2.533 2.241 2.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 139 1 14 LEU HB2 1 15 GLN H 4.590 . 4.590 2.584 2.477 2.904 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 140 1 14 LEU HB3 1 15 GLN H 4.590 . 4.590 3.591 3.356 3.926 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 141 1 14 LEU QD 1 17 ILE HB 4.610 . 4.610 3.961 3.807 4.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 142 1 14 LEU QD 1 17 ILE MD 3.210 . 3.210 2.547 2.353 2.965 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 143 1 14 LEU QD 1 42 LEU H 5.440 . 5.440 5.480 5.320 5.618 0.178 10 0 "[ . 1 . 2 . 3 . 4]" 1 144 1 14 LEU QD 1 42 LEU HA 4.150 . 4.150 3.389 3.233 3.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 145 1 14 LEU QD 1 42 LEU QD 2.750 . 2.750 2.002 1.895 2.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 146 1 14 LEU QD 1 45 LEU HA 5.440 . 5.440 5.168 4.859 5.411 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 147 1 14 LEU QD 1 45 LEU QB 4.240 . 4.240 2.835 2.543 3.065 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 148 1 14 LEU QD 1 45 LEU QD 2.940 . 2.940 2.114 1.986 2.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 149 1 14 LEU QD 1 47 VAL H 5.440 . 5.440 4.079 3.780 4.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 150 1 14 LEU QD 1 47 VAL HB 4.400 . 4.400 3.027 1.940 4.158 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 151 1 14 LEU QD 1 47 VAL QG 2.560 . 2.560 1.956 1.763 2.220 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 152 1 14 LEU QD 1 51 GLN HA 5.440 . 5.440 4.443 3.844 5.157 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 153 1 14 LEU QD 1 52 ALA MB 5.440 . 5.440 4.338 3.825 4.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 154 1 14 LEU QD 1 55 HIS H 5.440 . 5.440 5.298 4.674 5.518 0.078 8 0 "[ . 1 . 2 . 3 . 4]" 1 155 1 14 LEU QD 1 55 HIS QB 4.410 . 4.410 3.462 2.988 3.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 156 1 14 LEU QD 1 55 HIS HD2 3.850 . 3.850 2.582 2.132 4.086 0.236 4 0 "[ . 1 . 2 . 3 . 4]" 1 157 1 14 LEU QD 1 58 MET ME 2.850 . 2.850 2.445 1.986 3.072 0.222 31 0 "[ . 1 . 2 . 3 . 4]" 1 158 1 14 LEU QD 1 58 MET QG 5.440 . 5.440 4.956 4.389 5.413 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 159 1 14 LEU MD1 1 15 GLN H 4.860 . 4.860 4.400 4.271 4.665 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 160 1 14 LEU MD1 1 47 VAL HB 5.100 . 5.100 3.620 2.191 4.944 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 161 1 14 LEU MD1 1 47 VAL MG1 3.690 . 3.690 2.979 2.151 3.829 0.139 28 0 "[ . 1 . 2 . 3 . 4]" 1 162 1 14 LEU MD1 1 47 VAL MG2 3.690 . 3.690 2.763 1.995 3.438 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 163 1 14 LEU MD1 1 58 MET ME 3.450 . 3.450 3.073 2.346 3.548 0.098 23 0 "[ . 1 . 2 . 3 . 4]" 1 164 1 14 LEU MD1 1 85 PHE QE 5.500 . 5.500 4.974 4.489 5.523 0.023 1 0 "[ . 1 . 2 . 3 . 4]" 1 165 1 14 LEU MD1 1 85 PHE HZ 5.500 . 5.500 4.830 3.817 5.272 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 166 1 14 LEU MD2 1 15 GLN H 4.860 . 4.860 4.605 3.869 4.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 167 1 14 LEU MD2 1 47 VAL HB 5.100 . 5.100 3.276 2.021 4.851 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 168 1 14 LEU MD2 1 47 VAL MG1 3.690 . 3.690 2.860 2.098 3.809 0.119 12 0 "[ . 1 . 2 . 3 . 4]" 1 169 1 14 LEU MD2 1 47 VAL MG2 3.690 . 3.690 2.407 1.957 3.336 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 170 1 14 LEU MD2 1 58 MET ME 3.450 . 3.450 2.601 2.022 3.536 0.086 8 0 "[ . 1 . 2 . 3 . 4]" 1 171 1 14 LEU MD2 1 85 PHE QE 5.500 . 5.500 4.718 4.307 5.431 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 172 1 14 LEU MD2 1 85 PHE HZ 5.500 . 5.500 4.238 3.717 5.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 173 1 14 LEU HG 1 15 GLN H 5.230 . 5.230 4.501 4.147 5.232 0.002 21 0 "[ . 1 . 2 . 3 . 4]" 1 174 1 14 LEU HG 1 17 ILE MD 5.500 . 5.500 4.325 4.020 4.750 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 175 1 14 LEU HG 1 42 LEU QD 4.160 . 4.160 3.850 2.435 4.266 0.106 28 0 "[ . 1 . 2 . 3 . 4]" 1 176 1 14 LEU HG 1 45 LEU QD 5.440 . 5.440 3.356 2.805 4.345 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 177 1 15 GLN H 1 15 GLN HB2 3.690 . 3.690 2.436 2.260 2.551 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 178 1 15 GLN H 1 15 GLN HB3 3.690 . 3.690 2.578 2.451 3.610 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 179 1 15 GLN H 1 15 GLN HG2 4.580 . 4.580 4.409 3.254 4.527 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 180 1 15 GLN H 1 15 GLN QG 3.940 . 3.940 3.858 2.068 3.987 0.047 16 0 "[ . 1 . 2 . 3 . 4]" 1 181 1 15 GLN H 1 15 GLN HG3 4.580 . 4.580 4.289 2.087 4.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 182 1 15 GLN H 1 16 ARG H 3.680 . 3.680 2.708 2.225 2.860 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 183 1 15 GLN H 1 16 ARG QB 4.810 . 4.810 4.558 3.792 4.795 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 184 1 15 GLN H 1 16 ARG QG 5.340 . 5.340 4.926 4.467 5.528 0.188 5 0 "[ . 1 . 2 . 3 . 4]" 1 185 1 15 GLN H 1 17 ILE HB 5.500 . 5.500 5.427 5.242 5.513 0.013 28 0 "[ . 1 . 2 . 3 . 4]" 1 186 1 15 GLN H 1 58 MET ME 5.500 . 5.500 5.478 5.127 5.546 0.046 5 0 "[ . 1 . 2 . 3 . 4]" 1 187 1 15 GLN HA 1 15 GLN HG2 3.930 . 3.930 3.098 2.488 3.712 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 188 1 15 GLN HA 1 15 GLN QG 3.380 . 3.380 2.417 2.296 2.620 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 189 1 15 GLN HA 1 15 GLN HG3 3.930 . 3.930 2.547 2.352 3.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 190 1 15 GLN HA 1 19 ALA MB 4.890 . 4.890 4.749 4.511 4.894 0.004 38 0 "[ . 1 . 2 . 3 . 4]" 1 191 1 15 GLN QB 1 16 ARG H 3.750 . 3.750 2.468 2.259 2.649 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 192 1 15 GLN HB2 1 16 ARG H 4.380 . 4.380 3.739 2.291 3.895 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 193 1 15 GLN HB3 1 16 ARG H 4.380 . 4.380 2.558 2.358 3.433 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 194 1 15 GLN QG 1 16 ARG H 4.150 . 4.150 3.659 3.552 3.933 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 195 1 15 GLN HG2 1 16 ARG H 4.720 . 4.720 3.860 3.672 4.743 0.023 19 0 "[ . 1 . 2 . 3 . 4]" 1 196 1 15 GLN HG3 1 16 ARG H 4.720 . 4.720 4.679 4.023 4.739 0.019 4 0 "[ . 1 . 2 . 3 . 4]" 1 197 1 16 ARG H 1 16 ARG HB2 3.780 . 3.780 2.290 2.126 2.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 198 1 16 ARG H 1 16 ARG QB 3.310 . 3.310 2.251 2.088 2.465 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 199 1 16 ARG H 1 16 ARG HB3 3.780 . 3.780 3.525 2.191 3.655 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 200 1 16 ARG H 1 16 ARG QD 4.660 . 4.660 4.131 3.698 4.675 0.015 35 0 "[ . 1 . 2 . 3 . 4]" 1 201 1 16 ARG H 1 16 ARG HG2 4.630 . 4.630 3.120 2.394 4.376 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 202 1 16 ARG H 1 16 ARG QG 4.070 . 4.070 2.738 2.362 3.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 203 1 16 ARG H 1 16 ARG HG3 4.630 . 4.630 3.503 2.561 4.242 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 204 1 16 ARG H 1 17 ILE H 3.920 . 3.920 2.743 2.642 2.853 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 205 1 16 ARG H 1 17 ILE HB 5.160 . 5.160 4.991 4.900 5.160 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 206 1 16 ARG H 1 18 HIS H 5.490 . 5.490 4.172 4.073 4.313 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 207 1 16 ARG H 1 19 ALA H 5.230 . 5.230 4.788 4.642 4.918 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 208 1 16 ARG HA 1 16 ARG QD 4.580 . 4.580 2.763 1.987 4.113 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 209 1 16 ARG HA 1 16 ARG HG2 4.090 . 4.090 2.635 2.219 3.899 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 210 1 16 ARG HA 1 16 ARG QG 3.590 . 3.590 2.538 2.189 3.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 211 1 16 ARG HA 1 16 ARG HG3 4.090 . 4.090 3.455 2.636 3.826 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 212 1 16 ARG HA 1 19 ALA MB 3.350 . 3.350 2.694 2.379 3.003 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 213 1 16 ARG QB 1 16 ARG QD 3.330 . 3.330 2.393 2.089 2.959 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 214 1 16 ARG QB 1 17 ILE H 3.160 . 3.160 2.612 2.497 2.758 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 215 1 16 ARG QB 1 18 HIS H 5.240 . 5.240 4.672 4.566 4.758 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 216 1 16 ARG QB 1 19 ALA MB 5.190 . 5.190 4.286 3.917 4.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 217 1 16 ARG QD 1 19 ALA MB 5.340 . 5.340 4.094 3.011 5.460 0.120 8 0 "[ . 1 . 2 . 3 . 4]" 1 218 1 16 ARG QG 1 17 ILE H 4.320 . 4.320 4.280 3.152 4.358 0.038 20 0 "[ . 1 . 2 . 3 . 4]" 1 219 1 17 ILE H 1 17 ILE HB 3.780 . 3.780 2.549 2.447 2.628 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 220 1 17 ILE H 1 17 ILE MD 3.640 . 3.640 3.365 3.247 3.541 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 221 1 17 ILE H 1 17 ILE QG 3.400 . 3.400 2.189 2.118 2.334 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 222 1 17 ILE H 1 17 ILE MG 4.060 . 4.060 3.829 3.792 3.877 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 223 1 17 ILE HA 1 17 ILE MD 4.090 . 4.090 3.917 3.836 3.954 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 224 1 17 ILE HA 1 17 ILE MG 3.500 . 3.500 2.472 2.422 2.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 225 1 17 ILE HA 1 20 GLU H 4.610 . 4.610 3.364 3.085 3.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 226 1 17 ILE HA 1 20 GLU HB2 4.590 . 4.590 3.064 2.215 3.516 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 227 1 17 ILE HA 1 20 GLU HB3 4.640 . 4.640 2.692 2.451 3.777 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 228 1 17 ILE HA 1 21 ILE MD 4.880 . 4.880 4.582 4.432 4.721 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 229 1 17 ILE HA 1 38 ALA MB 3.830 . 3.830 3.443 2.983 3.758 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 230 1 17 ILE HB 1 17 ILE MD 3.170 . 3.170 2.289 2.226 2.351 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 231 1 17 ILE HB 1 18 HIS H 4.140 . 4.140 2.613 2.508 2.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 232 1 17 ILE HB 1 21 ILE MD 4.270 . 4.270 4.253 4.145 4.318 0.048 5 0 "[ . 1 . 2 . 3 . 4]" 1 233 1 17 ILE HB 1 41 GLU QG 5.340 . 5.340 4.893 4.573 5.391 0.051 5 0 "[ . 1 . 2 . 3 . 4]" 1 234 1 17 ILE MD 1 17 ILE MG 2.860 . 2.860 2.174 2.100 2.254 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 235 1 17 ILE MD 1 38 ALA HA 4.490 . 4.490 4.376 4.132 4.493 0.003 6 0 "[ . 1 . 2 . 3 . 4]" 1 236 1 17 ILE MD 1 38 ALA MB 5.500 . 5.500 4.377 4.190 4.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 237 1 17 ILE MD 1 41 GLU H 4.720 . 4.720 4.663 4.340 4.749 0.029 20 0 "[ . 1 . 2 . 3 . 4]" 1 238 1 17 ILE MD 1 41 GLU QB 3.830 . 3.830 3.026 1.876 3.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 239 1 17 ILE MD 1 41 GLU HG2 3.850 . 3.850 2.620 2.441 3.967 0.117 5 0 "[ . 1 . 2 . 3 . 4]" 1 240 1 17 ILE MD 1 41 GLU QG 3.220 . 3.220 2.027 1.915 2.851 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 241 1 17 ILE MD 1 41 GLU HG3 3.850 . 3.850 2.115 1.953 2.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 242 1 17 ILE MD 1 42 LEU H 3.920 . 3.920 3.003 2.817 3.210 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 243 1 17 ILE MD 1 42 LEU HA 3.470 . 3.470 2.554 2.385 3.000 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 244 1 17 ILE MD 1 42 LEU QB 4.770 . 4.770 2.720 2.232 3.216 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 245 1 17 ILE MD 1 43 ALA H 5.500 . 5.500 4.960 4.782 5.132 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 246 1 17 ILE MD 1 44 SER H 5.500 . 5.500 5.512 5.381 5.557 0.057 40 0 "[ . 1 . 2 . 3 . 4]" 1 247 1 17 ILE QG 1 41 GLU QG 3.660 . 3.660 2.725 2.383 3.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 248 1 17 ILE MG 1 18 HIS H 3.550 . 3.550 3.497 3.388 3.567 0.017 16 0 "[ . 1 . 2 . 3 . 4]" 1 249 1 17 ILE MG 1 18 HIS HA 4.210 . 4.210 3.466 3.296 3.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 250 1 17 ILE MG 1 20 GLU HB2 5.170 . 5.170 4.652 3.455 5.153 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 251 1 17 ILE MG 1 21 ILE MD 3.120 . 3.120 2.294 2.190 2.379 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 252 1 17 ILE MG 1 21 ILE HG13 3.590 . 3.590 2.899 2.710 3.027 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 253 1 17 ILE MG 1 38 ALA H 4.640 . 4.640 4.688 4.660 4.740 0.100 28 0 "[ . 1 . 2 . 3 . 4]" 1 254 1 17 ILE MG 1 38 ALA HA 4.130 . 4.130 2.811 2.694 3.032 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 255 1 17 ILE MG 1 38 ALA MB 3.140 . 3.140 1.944 1.915 1.986 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 256 1 17 ILE MG 1 39 LEU HA 4.130 . 4.130 3.667 3.380 3.886 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 257 1 17 ILE MG 1 41 GLU H 4.610 . 4.610 4.529 4.281 4.625 0.015 2 0 "[ . 1 . 2 . 3 . 4]" 1 258 1 17 ILE MG 1 41 GLU QB 4.080 . 4.080 3.456 2.787 3.743 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 259 1 17 ILE MG 1 41 GLU QG 5.340 . 5.340 3.684 3.128 3.939 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 260 1 17 ILE MG 1 42 LEU H 3.740 . 3.740 3.193 3.079 3.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 261 1 17 ILE MG 1 42 LEU HA 4.550 . 4.550 3.759 3.603 3.944 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 262 1 17 ILE MG 1 42 LEU HB2 4.470 . 4.470 2.160 1.977 2.431 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 263 1 17 ILE MG 1 42 LEU QB 3.660 . 3.660 2.145 1.965 2.411 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 264 1 17 ILE MG 1 42 LEU HB3 4.470 . 4.470 3.652 3.352 3.983 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 265 1 17 ILE MG 1 43 ALA H 5.500 . 5.500 5.207 5.119 5.334 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 266 1 18 HIS H 1 18 HIS HB2 4.070 . 4.070 2.507 2.412 2.698 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 267 1 18 HIS H 1 19 ALA H 3.720 . 3.720 2.807 2.716 2.858 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 268 1 18 HIS H 1 19 ALA MB 4.500 . 4.500 4.448 4.337 4.504 0.004 23 0 "[ . 1 . 2 . 3 . 4]" 1 269 1 18 HIS H 1 58 MET QG 5.110 . 5.110 4.501 4.026 4.700 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 270 1 18 HIS HA 1 21 ILE MD 3.630 . 3.630 2.342 2.136 2.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 271 1 18 HIS HA 1 21 ILE MG 4.770 . 4.770 4.552 4.335 4.761 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 272 1 18 HIS HA 1 61 THR MG 4.610 . 4.610 4.095 3.665 4.590 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 273 1 18 HIS HB2 1 19 ALA H 4.500 . 4.500 3.797 3.753 3.922 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 274 1 18 HIS HB2 1 19 ALA MB 5.500 . 5.500 5.248 5.179 5.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 275 1 18 HIS HB2 1 58 MET ME 4.430 . 4.430 4.012 3.411 4.430 0.000 21 0 "[ . 1 . 2 . 3 . 4]" 1 276 1 18 HIS HB3 1 19 ALA H 4.250 . 4.250 2.428 2.370 2.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 277 1 18 HIS HB3 1 19 ALA MB 4.580 . 4.580 3.855 3.768 4.011 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 278 1 18 HIS HD2 1 21 ILE MD 4.090 . 4.090 3.250 2.846 4.084 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 279 1 18 HIS HD2 1 21 ILE MG 5.050 . 5.050 4.266 3.772 5.066 0.016 23 0 "[ . 1 . 2 . 3 . 4]" 1 280 1 18 HIS HD2 1 58 MET ME 5.500 . 5.500 5.527 5.502 5.550 0.050 24 0 "[ . 1 . 2 . 3 . 4]" 1 281 1 18 HIS HD2 1 58 MET QG 4.670 . 4.670 2.690 2.519 3.320 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 282 1 18 HIS HD2 1 61 THR MG 3.610 . 3.610 2.618 2.322 2.881 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 283 1 18 HIS HE1 1 57 GLU QG 4.210 . 4.210 2.544 1.833 4.214 0.004 22 0 "[ . 1 . 2 . 3 . 4]" 1 284 1 19 ALA H 1 19 ALA MB 2.830 . 2.830 2.227 2.198 2.242 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 285 1 19 ALA H 1 20 GLU H 3.740 . 3.740 2.678 2.582 2.754 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 286 1 19 ALA HA 1 22 LYS QE 4.740 . 4.740 3.151 2.019 3.568 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 287 1 19 ALA MB 1 20 GLU H 3.180 . 3.180 2.638 2.537 2.757 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 288 1 19 ALA MB 1 20 GLU HA 4.180 . 4.180 3.881 3.824 3.941 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 289 1 19 ALA MB 1 20 GLU HB2 4.240 . 4.240 4.070 3.900 4.334 0.094 5 0 "[ . 1 . 2 . 3 . 4]" 1 290 1 19 ALA MB 1 22 LYS H 5.090 . 5.090 4.700 4.584 4.840 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 291 1 19 ALA MB 1 22 LYS QB 4.490 . 4.490 4.064 3.703 4.362 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 292 1 19 ALA MB 1 22 LYS QE 4.170 . 4.170 4.013 3.197 4.219 0.049 18 0 "[ . 1 . 2 . 3 . 4]" 1 293 1 19 ALA MB 1 22 LYS QG 4.920 . 4.920 4.747 4.181 4.982 0.062 3 0 "[ . 1 . 2 . 3 . 4]" 1 294 1 19 ALA MB 1 23 ASN HD21 4.030 . 4.030 3.480 3.157 3.755 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 295 1 19 ALA MB 1 23 ASN QD 3.500 . 3.500 2.843 2.557 3.191 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 296 1 19 ALA MB 1 23 ASN HD22 4.030 . 4.030 3.018 2.698 3.535 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 297 1 20 GLU H 1 20 GLU HB2 3.600 . 3.600 2.369 2.121 2.532 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 298 1 20 GLU H 1 20 GLU HG2 5.310 . 5.310 4.524 2.775 4.643 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 299 1 20 GLU H 1 20 GLU QG 4.570 . 4.570 3.976 2.675 4.081 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 300 1 20 GLU H 1 20 GLU HG3 5.310 . 5.310 4.417 3.508 4.535 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 301 1 20 GLU H 1 21 ILE H 3.320 . 3.320 2.732 2.674 2.791 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 302 1 20 GLU H 1 22 LYS H 4.730 . 4.730 4.292 4.118 4.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 303 1 20 GLU H 1 38 ALA MB 5.390 . 5.390 4.992 4.639 5.230 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 304 1 20 GLU HA 1 20 GLU HG2 3.970 . 3.970 3.425 2.537 3.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 305 1 20 GLU HA 1 20 GLU HG3 3.970 . 3.970 2.584 2.270 3.698 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 306 1 20 GLU HA 1 23 ASN H 4.750 . 4.750 3.575 3.353 3.892 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 307 1 20 GLU HA 1 23 ASN QB 4.670 . 4.670 2.792 2.378 4.364 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 308 1 20 GLU HB2 1 21 ILE H 4.700 . 4.700 3.798 2.698 3.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 309 1 20 GLU HB3 1 21 ILE H 3.430 . 3.430 2.656 2.456 3.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 310 1 20 GLU HB3 1 38 ALA MB 3.390 . 3.390 3.060 2.585 3.396 0.006 9 0 "[ . 1 . 2 . 3 . 4]" 1 311 1 21 ILE H 1 21 ILE MD 3.640 . 3.640 3.361 3.251 3.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 312 1 21 ILE H 1 21 ILE HG12 4.360 . 4.360 3.732 3.630 3.803 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 313 1 21 ILE H 1 21 ILE HG13 3.160 . 3.160 2.296 2.167 2.383 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 314 1 21 ILE H 1 21 ILE MG 3.990 . 3.990 3.856 3.822 3.893 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 315 1 21 ILE H 1 22 LYS H 4.240 . 4.240 2.742 2.623 2.828 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 316 1 21 ILE H 1 38 ALA MB 4.460 . 4.460 3.792 3.546 4.003 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 317 1 21 ILE HA 1 21 ILE MD 4.070 . 4.070 3.924 3.901 3.947 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 318 1 21 ILE HA 1 21 ILE HG12 3.960 . 3.960 2.710 2.641 2.781 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 319 1 21 ILE HA 1 21 ILE MG 3.430 . 3.430 2.471 2.412 2.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 320 1 21 ILE HA 1 25 LEU QB 5.340 . 5.340 4.438 3.563 5.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 321 1 21 ILE HA 1 25 LEU QD 5.240 . 5.240 3.822 3.333 4.115 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 322 1 21 ILE HA 1 34 ARG QG 5.340 . 5.340 4.731 3.967 5.343 0.003 29 0 "[ . 1 . 2 . 3 . 4]" 1 323 1 21 ILE HA 1 35 CYS HA 4.510 . 4.510 3.249 3.037 3.510 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 324 1 21 ILE HA 1 38 ALA MB 4.180 . 4.180 3.674 3.414 3.860 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 325 1 21 ILE HA 1 39 LEU QD 5.440 . 5.440 5.022 4.497 5.478 0.038 8 0 "[ . 1 . 2 . 3 . 4]" 1 326 1 21 ILE HB 1 22 LYS H 4.270 . 4.270 2.528 2.425 2.623 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 327 1 21 ILE HB 1 61 THR MG 3.900 . 3.900 3.023 2.642 3.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 328 1 21 ILE MD 1 22 LYS H 4.660 . 4.660 4.375 4.265 4.490 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 329 1 21 ILE MD 1 38 ALA MB 3.240 . 3.240 2.810 2.482 3.163 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 330 1 21 ILE MD 1 39 LEU H 4.550 . 4.550 4.153 3.853 4.551 0.001 16 0 "[ . 1 . 2 . 3 . 4]" 1 331 1 21 ILE MD 1 39 LEU HA 4.210 . 4.210 3.465 3.231 3.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 332 1 21 ILE MD 1 58 MET QG 4.410 . 4.410 3.426 3.020 3.806 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 333 1 21 ILE MD 1 61 THR MG 3.980 . 3.980 2.937 2.641 3.328 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 334 1 21 ILE HG12 1 22 LYS H 5.500 . 5.500 5.085 5.015 5.140 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 335 1 21 ILE HG12 1 35 CYS HA 4.420 . 4.420 3.018 2.469 3.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 336 1 21 ILE HG12 1 38 ALA H 5.500 . 5.500 5.027 4.775 5.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 337 1 21 ILE HG12 1 61 THR MG 5.500 . 5.500 4.639 4.359 4.902 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 338 1 21 ILE HG12 1 65 ILE MG 5.500 . 5.500 5.225 4.824 5.511 0.011 26 0 "[ . 1 . 2 . 3 . 4]" 1 339 1 21 ILE HG13 1 38 ALA MB 3.290 . 3.290 2.385 2.253 2.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 340 1 21 ILE MG 1 22 LYS H 3.860 . 3.860 3.307 3.170 3.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 341 1 21 ILE MG 1 22 LYS HA 4.640 . 4.640 3.233 3.059 3.476 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 342 1 21 ILE MG 1 25 LEU QB 3.600 . 3.600 3.251 2.775 3.643 0.043 12 0 "[ . 1 . 2 . 3 . 4]" 1 343 1 21 ILE MG 1 25 LEU QD 3.510 . 3.510 2.296 2.102 2.518 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 344 1 21 ILE MG 1 25 LEU HG 4.820 . 4.820 3.996 2.789 4.834 0.014 2 0 "[ . 1 . 2 . 3 . 4]" 1 345 1 21 ILE MG 1 35 CYS HA 4.180 . 4.180 3.624 3.252 4.126 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 346 1 21 ILE MG 1 38 ALA MB 4.710 . 4.710 4.073 3.886 4.254 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 347 1 21 ILE MG 1 61 THR MG 2.970 . 2.970 2.426 2.230 2.708 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 348 1 21 ILE MG 1 65 ILE QG 5.110 . 5.110 4.038 3.635 4.403 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 349 1 21 ILE MG 1 65 ILE MG 3.530 . 3.530 2.669 2.375 3.042 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 350 1 21 ILE MG 1 68 PHE QE 5.500 . 5.500 5.581 5.435 5.715 0.215 9 0 "[ . 1 . 2 . 3 . 4]" 1 351 1 21 ILE MG 1 74 ILE MD 4.820 . 4.820 4.558 4.185 4.798 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 352 1 21 ILE MG 1 149 PHE QD 4.230 . 4.230 4.056 3.588 4.320 0.090 5 0 "[ . 1 . 2 . 3 . 4]" 1 353 1 21 ILE MG 1 149 PHE QE 4.020 . 4.020 2.577 2.227 2.874 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 354 1 21 ILE MG 1 149 PHE HZ 5.500 . 5.500 3.673 3.075 4.247 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 355 1 22 LYS H 1 22 LYS HD2 4.770 . 4.770 4.676 4.211 4.789 0.019 10 0 "[ . 1 . 2 . 3 . 4]" 1 356 1 22 LYS H 1 22 LYS HD3 4.770 . 4.770 4.243 3.420 4.718 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 357 1 22 LYS H 1 22 LYS HG2 4.620 . 4.620 3.269 2.744 3.851 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 358 1 22 LYS H 1 22 LYS QG 3.920 . 3.920 2.292 2.132 2.538 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 359 1 22 LYS H 1 22 LYS HG3 4.620 . 4.620 2.356 2.170 2.574 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 360 1 22 LYS H 1 23 ASN H 4.110 . 4.110 2.824 2.719 2.971 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 361 1 22 LYS H 1 61 THR MG 4.900 . 4.900 4.162 3.855 4.563 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 362 1 22 LYS HA 1 22 LYS QD 4.640 . 4.640 3.914 3.587 4.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 363 1 22 LYS HA 1 25 LEU QD 5.440 . 5.440 4.203 3.728 4.705 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 364 1 22 LYS HA 1 61 THR MG 4.870 . 4.870 4.283 4.040 4.527 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 365 1 22 LYS HA 1 149 PHE QD 4.500 . 4.500 2.646 2.332 3.015 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 366 1 22 LYS HA 1 149 PHE QE 4.430 . 4.430 3.052 2.695 3.406 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 367 1 22 LYS HA 1 154 LEU MD2 4.360 . 4.360 3.634 3.461 3.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 368 1 22 LYS QB 1 22 LYS QD 3.230 . 3.230 2.300 2.188 2.445 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 369 1 22 LYS QB 1 22 LYS QE 4.230 . 4.230 2.157 2.019 2.337 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 370 1 22 LYS QB 1 154 LEU MD2 3.880 . 3.880 2.130 1.982 2.327 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 371 1 22 LYS HB2 1 23 ASN H 4.550 . 4.550 2.547 2.336 2.741 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 372 1 22 LYS HB3 1 23 ASN H 4.550 . 4.550 3.541 3.215 3.803 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 373 1 22 LYS QD 1 61 THR MG 5.340 . 5.340 3.925 2.911 4.435 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 374 1 22 LYS QD 1 149 PHE QD 5.340 . 5.340 3.881 2.751 5.342 0.002 33 0 "[ . 1 . 2 . 3 . 4]" 1 375 1 22 LYS QD 1 149 PHE QE 5.340 . 5.340 3.674 2.547 5.092 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 376 1 22 LYS QE 1 154 LEU MD2 3.510 . 3.510 2.719 2.482 2.854 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 377 1 22 LYS HE2 1 154 LEU MD2 4.240 . 4.240 3.988 2.958 4.283 0.043 30 0 "[ . 1 . 2 . 3 . 4]" 1 378 1 22 LYS HE3 1 154 LEU MD2 4.240 . 4.240 2.784 2.537 2.900 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 379 1 22 LYS QG 1 61 THR MG 4.590 . 4.590 2.966 2.381 3.320 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 380 1 22 LYS QG 1 154 LEU MD2 4.060 . 4.060 3.800 3.533 4.102 0.042 14 0 "[ . 1 . 2 . 3 . 4]" 1 381 1 23 ASN H 1 23 ASN HB2 3.900 . 3.900 2.260 2.156 3.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 382 1 23 ASN H 1 23 ASN QB 3.420 . 3.420 2.214 2.137 2.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 383 1 23 ASN H 1 23 ASN HB3 3.900 . 3.900 3.515 2.831 3.640 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 384 1 23 ASN H 1 23 ASN HD21 4.670 . 4.670 3.960 3.647 4.119 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 385 1 23 ASN H 1 23 ASN QD 4.050 . 4.050 2.421 2.188 3.022 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 386 1 23 ASN H 1 23 ASN HD22 4.670 . 4.670 2.447 2.205 3.225 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 387 1 23 ASN H 1 24 SER H 3.990 . 3.990 2.692 2.527 2.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 388 1 23 ASN H 1 25 LEU H 4.750 . 4.750 4.068 3.947 4.200 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 389 1 23 ASN H 1 154 LEU MD1 5.180 . 5.180 4.502 4.179 4.813 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 390 1 23 ASN H 1 154 LEU MD2 4.090 . 4.090 3.239 2.894 3.436 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 391 1 23 ASN HA 1 26 LYS QD 4.590 . 4.590 4.194 3.447 4.546 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 392 1 23 ASN HA 1 26 LYS QG 5.150 . 5.150 4.406 2.739 4.774 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 393 1 23 ASN HA 1 154 LEU MD1 3.370 . 3.370 2.365 2.019 2.748 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 394 1 23 ASN QB 1 26 LYS QD 5.340 . 5.340 5.070 3.968 5.501 0.161 28 0 "[ . 1 . 2 . 3 . 4]" 1 395 1 23 ASN QB 1 154 LEU MD1 4.760 . 4.760 3.631 2.153 3.911 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 396 1 23 ASN HB2 1 24 SER H 4.400 . 4.400 2.940 2.815 4.140 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 397 1 23 ASN HB3 1 24 SER H 4.400 . 4.400 3.469 3.313 4.322 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 398 1 23 ASN QD 1 154 LEU MD2 3.950 . 3.950 2.950 2.547 3.356 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 399 1 23 ASN HD21 1 154 LEU MD2 4.540 . 4.540 3.356 2.965 4.604 0.064 10 0 "[ . 1 . 2 . 3 . 4]" 1 400 1 23 ASN HD22 1 154 LEU MD2 4.540 . 4.540 3.291 2.774 3.797 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 401 1 24 SER H 1 25 LEU H 3.990 . 3.990 2.551 2.428 2.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 402 1 24 SER HA 1 26 LYS H 4.830 . 4.830 3.777 3.489 3.966 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 403 1 25 LEU H 1 25 LEU MD1 4.480 . 4.480 3.738 2.941 4.139 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 404 1 25 LEU H 1 25 LEU QD 3.860 . 3.860 3.354 2.845 3.783 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 405 1 25 LEU H 1 25 LEU MD2 4.480 . 4.480 3.889 3.356 4.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 406 1 25 LEU H 1 25 LEU HG 4.960 . 4.960 3.804 2.572 4.793 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 407 1 25 LEU H 1 26 LYS H 3.830 . 3.830 2.722 2.431 3.010 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 408 1 25 LEU H 1 149 PHE QD 4.710 . 4.710 3.689 3.317 4.197 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 409 1 25 LEU HA 1 25 LEU MD1 3.870 . 3.870 2.889 2.040 3.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 410 1 25 LEU HA 1 25 LEU QD 2.990 . 2.990 2.112 2.032 2.203 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 411 1 25 LEU HA 1 25 LEU MD2 3.870 . 3.870 3.006 2.121 3.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 412 1 25 LEU HA 1 30 LEU QD 3.280 . 3.280 2.307 2.088 2.931 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 413 1 25 LEU QB 1 30 LEU QD 3.860 . 3.860 2.937 2.402 3.702 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 414 1 25 LEU QB 1 68 PHE HZ 5.340 . 5.340 3.255 2.285 4.674 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 415 1 25 LEU QB 1 149 PHE QD 3.880 . 3.880 2.085 1.979 2.322 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 416 1 25 LEU HB2 1 149 PHE QD 4.530 . 4.530 2.574 2.008 3.982 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 417 1 25 LEU HB3 1 149 PHE QD 4.530 . 4.530 2.635 1.992 3.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 418 1 25 LEU QD 1 26 LYS H 4.270 . 4.270 4.266 4.165 4.354 0.084 8 0 "[ . 1 . 2 . 3 . 4]" 1 419 1 25 LEU QD 1 30 LEU HA 3.730 . 3.730 2.791 2.156 3.256 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 420 1 25 LEU QD 1 30 LEU QD 2.940 . 2.940 2.488 2.195 3.007 0.067 38 0 "[ . 1 . 2 . 3 . 4]" 1 421 1 25 LEU QD 1 31 ASP H 3.970 . 3.970 2.719 2.603 2.964 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 422 1 25 LEU QD 1 31 ASP QB 4.700 . 4.700 3.756 3.378 4.120 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 423 1 25 LEU QD 1 32 VAL H 4.540 . 4.540 3.979 3.406 4.404 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 424 1 25 LEU QD 1 32 VAL HA 3.760 . 3.760 2.760 2.374 3.209 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 425 1 25 LEU QD 1 32 VAL QG 4.350 . 4.350 3.552 3.110 3.888 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 426 1 25 LEU QD 1 34 ARG H 5.440 . 5.440 5.094 4.751 5.424 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 427 1 25 LEU QD 1 35 CYS H 4.510 . 4.510 3.647 3.377 3.921 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 428 1 25 LEU QD 1 35 CYS HA 4.540 . 4.540 3.950 3.661 4.177 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 429 1 25 LEU QD 1 35 CYS QB 3.870 . 3.870 2.131 1.946 2.300 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 430 1 25 LEU QD 1 61 THR MG 4.320 . 4.320 4.118 3.824 4.374 0.054 8 0 "[ . 1 . 2 . 3 . 4]" 1 431 1 25 LEU QD 1 65 ILE HA 4.670 . 4.670 4.446 3.954 4.681 0.011 36 0 "[ . 1 . 2 . 3 . 4]" 1 432 1 25 LEU QD 1 65 ILE MG 4.250 . 4.250 2.367 2.169 2.597 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 433 1 25 LEU QD 1 68 PHE QD 3.810 . 3.810 3.173 2.867 3.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 434 1 25 LEU QD 1 68 PHE QE 3.330 . 3.330 2.326 1.978 2.803 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 435 1 25 LEU QD 1 68 PHE HZ 3.180 . 3.180 2.681 2.068 3.226 0.046 14 0 "[ . 1 . 2 . 3 . 4]" 1 436 1 25 LEU QD 1 70 VAL QG 4.130 . 4.130 3.421 3.092 3.918 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 437 1 25 LEU QD 1 74 ILE MD 3.100 . 3.100 2.398 2.042 2.638 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 438 1 25 LEU QD 1 74 ILE MG 3.920 . 3.920 3.210 2.923 3.448 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 439 1 25 LEU QD 1 146 PHE QE 3.810 . 3.810 3.236 2.221 3.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 440 1 25 LEU QD 1 146 PHE HZ 4.600 . 4.600 4.039 2.374 4.682 0.082 12 0 "[ . 1 . 2 . 3 . 4]" 1 441 1 25 LEU QD 1 148 GLY HA2 4.590 . 4.590 3.987 3.424 4.258 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 442 1 25 LEU QD 1 149 PHE QD 3.760 . 3.760 3.361 2.884 3.752 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 443 1 25 LEU QD 1 149 PHE QE 3.710 . 3.710 2.525 2.200 3.056 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 444 1 25 LEU QD 1 149 PHE HZ 5.440 . 5.440 4.412 3.940 5.092 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 445 1 25 LEU MD1 1 26 LYS H 5.500 . 5.500 4.951 4.307 5.558 0.058 20 0 "[ . 1 . 2 . 3 . 4]" 1 446 1 25 LEU MD1 1 30 LEU MD1 5.500 . 5.500 4.372 3.298 5.271 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 447 1 25 LEU MD1 1 30 LEU MD2 5.500 . 5.500 3.202 2.289 3.936 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 448 1 25 LEU MD1 1 31 ASP H 5.360 . 5.360 4.017 2.631 5.448 0.088 3 0 "[ . 1 . 2 . 3 . 4]" 1 449 1 25 LEU MD1 1 35 CYS HA 5.480 . 5.480 4.342 3.874 4.717 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 450 1 25 LEU MD1 1 68 PHE QD 4.400 . 4.400 3.703 3.246 4.459 0.059 5 0 "[ . 1 . 2 . 3 . 4]" 1 451 1 25 LEU MD1 1 68 PHE QE 3.870 . 3.870 2.720 2.180 3.464 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 452 1 25 LEU MD1 1 68 PHE HZ 3.680 . 3.680 3.228 2.458 3.726 0.046 18 0 "[ . 1 . 2 . 3 . 4]" 1 453 1 25 LEU MD1 1 74 ILE MD 3.770 . 3.770 2.701 2.350 2.962 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 454 1 25 LEU MD1 1 74 ILE MG 4.530 . 4.530 3.844 3.018 4.543 0.013 1 0 "[ . 1 . 2 . 3 . 4]" 1 455 1 25 LEU MD2 1 26 LYS H 5.500 . 5.500 5.016 4.314 5.551 0.051 22 0 "[ . 1 . 2 . 3 . 4]" 1 456 1 25 LEU MD2 1 30 LEU MD1 5.500 . 5.500 4.253 3.322 5.198 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 457 1 25 LEU MD2 1 30 LEU MD2 5.500 . 5.500 3.121 2.245 3.936 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 458 1 25 LEU MD2 1 31 ASP H 5.360 . 5.360 4.104 2.608 5.444 0.084 5 0 "[ . 1 . 2 . 3 . 4]" 1 459 1 25 LEU MD2 1 35 CYS HA 5.480 . 5.480 4.575 4.252 4.899 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 460 1 25 LEU MD2 1 68 PHE QD 4.400 . 4.400 3.592 2.981 4.253 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 461 1 25 LEU MD2 1 68 PHE QE 3.870 . 3.870 2.619 2.027 3.103 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 462 1 25 LEU MD2 1 68 PHE HZ 3.680 . 3.680 2.920 2.113 3.588 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 463 1 25 LEU MD2 1 74 ILE MD 3.770 . 3.770 2.699 2.242 3.103 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 464 1 25 LEU MD2 1 74 ILE MG 4.530 . 4.530 3.767 3.127 4.553 0.023 7 0 "[ . 1 . 2 . 3 . 4]" 1 465 1 25 LEU HG 1 68 PHE HZ 5.490 . 5.490 3.542 2.115 5.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 466 1 26 LYS H 1 26 LYS QB 3.260 . 3.260 2.210 2.016 2.304 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 467 1 26 LYS H 1 26 LYS QD 4.430 . 4.430 4.345 4.006 4.455 0.025 5 0 "[ . 1 . 2 . 3 . 4]" 1 468 1 26 LYS H 1 26 LYS HG2 4.620 . 4.620 4.463 3.424 4.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 469 1 26 LYS H 1 26 LYS QG 4.050 . 4.050 3.911 2.562 4.019 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 470 1 26 LYS H 1 26 LYS HG3 4.620 . 4.620 4.352 2.612 4.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 471 1 26 LYS H 1 27 ILE H 4.720 . 4.720 4.676 4.553 4.713 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 472 1 26 LYS H 1 30 LEU HA 5.010 . 5.010 3.965 3.619 4.263 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 473 1 26 LYS H 1 30 LEU QD 3.890 . 3.890 3.611 3.348 3.955 0.065 28 0 "[ . 1 . 2 . 3 . 4]" 1 474 1 26 LYS H 1 154 LEU MD1 5.500 . 5.500 4.467 3.894 5.138 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 475 1 26 LYS HA 1 26 LYS QD 4.570 . 4.570 3.932 2.135 4.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 476 1 26 LYS HA 1 27 ILE QG 5.270 . 5.270 3.833 3.391 3.981 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 477 1 26 LYS HA 1 27 ILE MG 4.060 . 4.060 4.013 3.848 4.103 0.043 10 0 "[ . 1 . 2 . 3 . 4]" 1 478 1 26 LYS HA 1 30 LEU QD 4.350 . 4.350 4.252 4.046 4.376 0.026 14 0 "[ . 1 . 2 . 3 . 4]" 1 479 1 26 LYS HA 1 149 PHE H 4.370 . 4.370 2.630 2.322 3.179 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 480 1 26 LYS HA 1 154 LEU MD1 4.080 . 4.080 3.447 2.966 4.092 0.012 9 0 "[ . 1 . 2 . 3 . 4]" 1 481 1 26 LYS HA 1 154 LEU MD2 4.800 . 4.800 3.596 3.285 4.115 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 482 1 26 LYS QB 1 26 LYS QE 4.180 . 4.180 3.518 2.028 3.837 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 483 1 26 LYS QB 1 27 ILE H 4.420 . 4.420 3.598 2.642 3.718 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 484 1 26 LYS QB 1 29 ASN HB2 4.330 . 4.330 4.217 2.466 4.388 0.058 10 0 "[ . 1 . 2 . 3 . 4]" 1 485 1 26 LYS QB 1 29 ASN QB 3.750 . 3.750 3.289 2.446 3.841 0.091 5 0 "[ . 1 . 2 . 3 . 4]" 1 486 1 26 LYS QB 1 29 ASN HB3 4.330 . 4.330 3.509 2.520 4.344 0.014 5 0 "[ . 1 . 2 . 3 . 4]" 1 487 1 26 LYS QB 1 149 PHE H 5.050 . 5.050 4.631 4.248 5.052 0.002 36 0 "[ . 1 . 2 . 3 . 4]" 1 488 1 26 LYS QB 1 154 LEU MD1 3.970 . 3.970 2.719 2.226 4.067 0.097 28 0 "[ . 1 . 2 . 3 . 4]" 1 489 1 26 LYS QB 1 154 LEU MD2 4.990 . 4.990 3.794 3.316 4.996 0.006 36 0 "[ . 1 . 2 . 3 . 4]" 1 490 1 26 LYS QD 1 27 ILE H 5.170 . 5.170 4.514 2.319 5.089 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 491 1 26 LYS QD 1 29 ASN HB2 5.500 . 5.500 4.664 2.705 5.520 0.020 28 0 "[ . 1 . 2 . 3 . 4]" 1 492 1 26 LYS QD 1 29 ASN HB3 5.500 . 5.500 4.417 3.259 5.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 493 1 26 LYS QD 1 154 LEU MD1 3.730 . 3.730 2.382 2.168 2.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 494 1 26 LYS QD 1 154 LEU MD2 4.930 . 4.930 4.302 3.169 4.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 495 1 26 LYS QE 1 26 LYS QG 3.470 . 3.470 2.126 2.067 2.384 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 496 1 26 LYS QE 1 27 ILE MD 4.460 . 4.460 4.179 3.552 4.489 0.029 18 0 "[ . 1 . 2 . 3 . 4]" 1 497 1 26 LYS QE 1 27 ILE QG 4.160 . 4.160 3.486 3.037 3.939 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 498 1 26 LYS QE 1 154 LEU MD1 3.640 . 3.640 2.526 1.900 2.879 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 499 1 26 LYS QE 1 154 LEU MD2 4.810 . 4.810 4.601 3.766 4.892 0.082 6 0 "[ . 1 . 2 . 3 . 4]" 1 500 1 26 LYS QG 1 27 ILE H 4.230 . 4.230 2.628 2.262 4.232 0.002 36 0 "[ . 1 . 2 . 3 . 4]" 1 501 1 26 LYS QG 1 29 ASN QB 5.180 . 5.180 4.707 4.040 5.221 0.041 5 0 "[ . 1 . 2 . 3 . 4]" 1 502 1 26 LYS HG2 1 27 ILE H 5.060 . 5.060 2.805 2.331 4.545 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 503 1 26 LYS HG2 1 154 LEU MD1 4.240 . 4.240 3.623 2.089 4.173 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 504 1 26 LYS HG3 1 27 ILE H 5.060 . 5.060 3.200 2.887 5.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 505 1 26 LYS HG3 1 154 LEU MD1 4.240 . 4.240 2.326 2.124 3.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 506 1 27 ILE H 1 27 ILE HB 3.630 . 3.630 3.622 3.515 3.638 0.008 6 0 "[ . 1 . 2 . 3 . 4]" 1 507 1 27 ILE H 1 27 ILE MD 3.650 . 3.650 3.603 3.451 3.662 0.012 29 0 "[ . 1 . 2 . 3 . 4]" 1 508 1 27 ILE H 1 27 ILE HG12 3.980 . 3.980 1.963 1.713 2.058 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 509 1 27 ILE H 1 27 ILE QG 3.410 . 3.410 1.940 1.691 2.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 510 1 27 ILE H 1 27 ILE HG13 3.980 . 3.980 3.048 2.577 3.266 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 511 1 27 ILE H 1 27 ILE MG 2.990 . 2.990 2.361 2.216 2.559 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 512 1 27 ILE H 1 30 LEU QD 4.460 . 4.460 4.318 3.775 4.504 0.044 10 0 "[ . 1 . 2 . 3 . 4]" 1 513 1 27 ILE H 1 149 PHE H 4.570 . 4.570 2.794 2.643 3.042 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 514 1 27 ILE H 1 154 LEU MD1 5.500 . 5.500 4.694 4.291 5.286 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 515 1 27 ILE HA 1 27 ILE MD 4.390 . 4.390 4.235 4.195 4.269 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 516 1 27 ILE HA 1 27 ILE HG12 4.040 . 4.040 3.735 3.650 3.781 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 517 1 27 ILE HA 1 27 ILE HG13 4.040 . 4.040 3.760 3.711 3.792 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 518 1 27 ILE HA 1 27 ILE MG 3.140 . 3.140 2.310 2.218 2.371 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 519 1 27 ILE HA 1 30 LEU MD1 4.950 . 4.950 4.409 3.569 4.719 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 520 1 27 ILE HA 1 30 LEU QD 3.540 . 3.540 2.966 2.180 3.334 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 521 1 27 ILE HA 1 30 LEU MD2 4.950 . 4.950 3.017 2.199 3.421 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 522 1 27 ILE HB 1 27 ILE MD 3.140 . 3.140 2.411 2.329 2.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 523 1 27 ILE HB 1 28 ASP HA 4.430 . 4.430 4.394 4.169 4.440 0.010 19 0 "[ . 1 . 2 . 3 . 4]" 1 524 1 27 ILE HB 1 148 GLY HA3 4.730 . 4.730 4.212 4.004 4.594 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 525 1 27 ILE HB 1 149 PHE H 5.360 . 5.360 5.365 5.301 5.387 0.027 10 0 "[ . 1 . 2 . 3 . 4]" 1 526 1 27 ILE HB 1 150 ASN HA 4.880 . 4.880 4.777 4.528 4.901 0.021 10 0 "[ . 1 . 2 . 3 . 4]" 1 527 1 27 ILE MD 1 27 ILE MG 2.580 . 2.580 2.085 2.052 2.114 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 528 1 27 ILE MD 1 28 ASP HA 4.810 . 4.810 4.803 4.636 4.906 0.096 10 0 "[ . 1 . 2 . 3 . 4]" 1 529 1 27 ILE MD 1 149 PHE H 5.480 . 5.480 5.267 4.923 5.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 530 1 27 ILE MD 1 149 PHE HA 5.220 . 5.220 5.261 5.228 5.322 0.102 5 0 "[ . 1 . 2 . 3 . 4]" 1 531 1 27 ILE MD 1 150 ASN H 4.750 . 4.750 4.351 4.242 4.763 0.013 10 0 "[ . 1 . 2 . 3 . 4]" 1 532 1 27 ILE MD 1 150 ASN HA 3.830 . 3.830 2.228 1.969 2.546 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 533 1 27 ILE MD 1 150 ASN HB2 4.040 . 4.040 3.525 3.072 4.094 0.054 28 0 "[ . 1 . 2 . 3 . 4]" 1 534 1 27 ILE MD 1 150 ASN HB3 4.420 . 4.420 4.171 3.825 4.403 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 535 1 27 ILE MD 1 150 ASN HD21 4.310 . 4.310 3.389 3.112 3.733 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 536 1 27 ILE MD 1 150 ASN HD22 4.310 . 4.310 3.717 3.130 4.293 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 537 1 27 ILE MD 1 151 GLN H 4.220 . 4.220 3.119 2.654 3.715 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 538 1 27 ILE QG 1 27 ILE MG 3.150 . 3.150 2.369 2.316 2.425 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 539 1 27 ILE QG 1 28 ASP HA 4.770 . 4.770 3.571 3.338 3.872 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 540 1 27 ILE QG 1 148 GLY HA3 5.320 . 5.320 4.698 4.486 4.877 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 541 1 27 ILE QG 1 149 PHE H 5.050 . 5.050 4.288 3.784 4.442 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 542 1 27 ILE QG 1 151 GLN H 5.310 . 5.310 3.578 3.098 3.955 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 543 1 27 ILE HG12 1 28 ASP HA 5.500 . 5.500 5.158 4.894 5.505 0.005 12 0 "[ . 1 . 2 . 3 . 4]" 1 544 1 27 ILE HG13 1 28 ASP HA 5.500 . 5.500 3.642 3.397 3.957 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 545 1 27 ILE MG 1 147 THR H 5.120 . 5.120 4.950 4.490 5.156 0.036 10 0 "[ . 1 . 2 . 3 . 4]" 1 546 1 27 ILE MG 1 148 GLY HA2 3.700 . 3.700 3.507 3.317 3.683 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 547 1 27 ILE MG 1 148 GLY HA3 4.080 . 4.080 2.142 2.027 2.306 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 548 1 27 ILE MG 1 149 PHE H 3.940 . 3.940 2.901 2.571 3.109 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 549 1 27 ILE MG 1 149 PHE HA 4.480 . 4.480 3.402 3.224 3.868 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 550 1 27 ILE MG 1 150 ASN HA 3.550 . 3.550 2.882 2.481 3.576 0.026 10 0 "[ . 1 . 2 . 3 . 4]" 1 551 1 27 ILE MG 1 150 ASN HB2 3.830 . 3.830 3.795 3.359 3.926 0.096 5 0 "[ . 1 . 2 . 3 . 4]" 1 552 1 27 ILE MG 1 150 ASN HD21 5.150 . 5.150 4.966 4.381 5.179 0.029 5 0 "[ . 1 . 2 . 3 . 4]" 1 553 1 27 ILE MG 1 150 ASN QD 4.300 . 4.300 4.307 4.118 4.405 0.105 2 0 "[ . 1 . 2 . 3 . 4]" 1 554 1 27 ILE MG 1 150 ASN HD22 5.150 . 5.150 4.779 4.330 5.199 0.049 28 0 "[ . 1 . 2 . 3 . 4]" 1 555 1 29 ASN HA 1 30 LEU MD1 5.500 . 5.500 5.235 4.916 5.519 0.019 5 0 "[ . 1 . 2 . 3 . 4]" 1 556 1 29 ASN HA 1 30 LEU QD 4.460 . 4.460 4.330 4.071 4.642 0.182 28 0 "[ . 1 . 2 . 3 . 4]" 1 557 1 29 ASN HA 1 30 LEU MD2 5.500 . 5.500 4.639 4.311 5.300 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 558 1 29 ASN HA 1 30 LEU HG 5.400 . 5.400 4.029 3.587 4.353 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 559 1 29 ASN QB 1 30 LEU H 3.960 . 3.960 3.533 2.335 3.987 0.027 12 0 "[ . 1 . 2 . 3 . 4]" 1 560 1 29 ASN QB 1 30 LEU QD 5.190 . 5.190 4.676 4.255 5.073 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 561 1 29 ASN HB2 1 30 LEU H 4.690 . 4.690 4.233 3.324 4.583 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 562 1 29 ASN HB3 1 30 LEU H 4.690 . 4.690 3.882 2.359 4.425 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 563 1 30 LEU H 1 30 LEU HB2 4.110 . 4.110 2.736 2.482 3.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 564 1 30 LEU H 1 30 LEU QB 3.460 . 3.460 2.657 2.445 3.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 565 1 30 LEU H 1 30 LEU HB3 4.110 . 4.110 3.762 3.659 3.998 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 566 1 30 LEU H 1 30 LEU MD1 4.190 . 4.190 3.969 3.786 4.212 0.022 4 0 "[ . 1 . 2 . 3 . 4]" 1 567 1 30 LEU H 1 30 LEU QD 3.400 . 3.400 3.198 2.133 3.417 0.017 26 0 "[ . 1 . 2 . 3 . 4]" 1 568 1 30 LEU H 1 30 LEU MD2 4.190 . 4.190 3.443 2.139 3.740 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 569 1 30 LEU H 1 30 LEU HG 4.000 . 4.000 2.789 2.639 2.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 570 1 30 LEU HA 1 30 LEU MD1 3.940 . 3.940 3.823 3.541 3.904 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 571 1 30 LEU HA 1 30 LEU QD 3.010 . 3.010 2.157 2.060 2.214 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 572 1 30 LEU HA 1 30 LEU MD2 3.940 . 3.940 2.169 2.070 2.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 573 1 30 LEU HA 1 31 ASP H 3.570 . 3.570 2.128 2.067 2.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 574 1 30 LEU HA 1 70 VAL QG 5.440 . 5.440 5.078 4.503 5.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 575 1 30 LEU QB 1 30 LEU QD 2.540 . 2.540 1.916 1.844 1.948 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 576 1 30 LEU QB 1 70 VAL QG 4.650 . 4.650 3.099 2.632 3.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 577 1 30 LEU HB2 1 30 LEU MD1 3.420 . 3.420 2.269 2.144 2.331 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 578 1 30 LEU HB2 1 30 LEU MD2 3.420 . 3.420 3.232 3.211 3.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 579 1 30 LEU HB3 1 30 LEU MD1 3.420 . 3.420 2.291 2.068 2.379 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 580 1 30 LEU HB3 1 30 LEU MD2 3.420 . 3.420 2.422 2.362 2.603 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 581 1 30 LEU QD 1 31 ASP H 3.760 . 3.760 3.753 3.599 3.881 0.121 28 0 "[ . 1 . 2 . 3 . 4]" 1 582 1 30 LEU QD 1 68 PHE QD 4.430 . 4.430 4.181 3.863 4.484 0.054 36 0 "[ . 1 . 2 . 3 . 4]" 1 583 1 30 LEU QD 1 68 PHE HZ 3.060 . 3.060 2.042 1.851 2.372 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 584 1 30 LEU QD 1 70 VAL H 5.260 . 5.260 4.833 4.518 5.274 0.014 38 0 "[ . 1 . 2 . 3 . 4]" 1 585 1 30 LEU QD 1 70 VAL HA 5.320 . 5.320 5.043 4.796 5.368 0.048 5 0 "[ . 1 . 2 . 3 . 4]" 1 586 1 30 LEU QD 1 70 VAL HB 4.710 . 4.710 3.761 3.202 4.196 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 587 1 30 LEU QD 1 70 VAL QG 2.800 . 2.800 2.041 1.934 2.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 588 1 30 LEU QD 1 148 GLY HA2 4.300 . 4.300 2.601 2.224 3.059 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 589 1 30 LEU QD 1 149 PHE H 4.470 . 4.470 3.709 3.375 4.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 590 1 30 LEU QD 1 149 PHE QD 5.440 . 5.440 4.611 4.283 4.917 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 591 1 30 LEU MD1 1 31 ASP H 5.230 . 5.230 5.254 5.032 5.431 0.201 28 0 "[ . 1 . 2 . 3 . 4]" 1 592 1 30 LEU MD1 1 68 PHE QD 5.080 . 5.080 4.618 4.138 5.046 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 593 1 30 LEU MD1 1 68 PHE QE 3.420 . 3.420 2.956 2.315 3.461 0.041 4 0 "[ . 1 . 2 . 3 . 4]" 1 594 1 30 LEU MD1 1 68 PHE HZ 3.550 . 3.550 2.851 2.222 3.550 0.000 39 0 "[ . 1 . 2 . 3 . 4]" 1 595 1 30 LEU MD2 1 31 ASP H 5.230 . 5.230 3.843 3.681 3.975 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 596 1 30 LEU MD2 1 68 PHE QD 5.080 . 5.080 4.808 4.529 5.063 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 597 1 30 LEU MD2 1 68 PHE QE 3.420 . 3.420 2.935 2.520 3.309 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 598 1 30 LEU MD2 1 68 PHE HZ 3.550 . 3.550 2.108 1.929 2.479 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 599 1 30 LEU HG 1 70 VAL MG1 5.500 . 5.500 4.929 4.549 5.513 0.013 4 0 "[ . 1 . 2 . 3 . 4]" 1 600 1 30 LEU HG 1 70 VAL QG 4.550 . 4.550 4.440 4.271 4.621 0.071 5 0 "[ . 1 . 2 . 3 . 4]" 1 601 1 30 LEU HG 1 70 VAL MG2 5.500 . 5.500 5.177 4.593 5.530 0.030 14 0 "[ . 1 . 2 . 3 . 4]" 1 602 1 31 ASP H 1 32 VAL H 4.680 . 4.680 3.849 3.636 3.991 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 603 1 31 ASP HA 1 32 VAL HB 5.500 . 5.500 4.637 4.457 4.962 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 604 1 31 ASP HA 1 32 VAL QG 3.880 . 3.880 3.714 3.419 3.911 0.031 1 0 "[ . 1 . 2 . 3 . 4]" 1 605 1 31 ASP HA 1 33 ASN H 4.490 . 4.490 3.616 3.388 3.945 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 606 1 32 VAL H 1 32 VAL HB 3.670 . 3.670 2.409 2.322 2.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 607 1 32 VAL H 1 32 VAL QG 2.870 . 2.870 2.203 1.859 2.311 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 608 1 32 VAL H 1 33 ASN H 3.840 . 3.840 2.856 2.737 3.086 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 609 1 32 VAL H 1 34 ARG H 4.800 . 4.800 4.495 4.339 4.639 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 610 1 32 VAL HA 1 32 VAL QG 3.090 . 3.090 2.294 2.251 2.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 611 1 32 VAL HA 1 35 CYS H 4.470 . 4.470 3.697 3.560 3.831 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 612 1 32 VAL HA 1 36 ILE MD 4.160 . 4.160 4.189 4.167 4.218 0.058 2 0 "[ . 1 . 2 . 3 . 4]" 1 613 1 32 VAL HA 1 74 ILE MD 3.520 . 3.520 2.577 2.293 2.908 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 614 1 32 VAL HB 1 33 ASN H 4.060 . 4.060 4.041 3.997 4.069 0.009 22 0 "[ . 1 . 2 . 3 . 4]" 1 615 1 32 VAL HB 1 36 ILE MD 5.130 . 5.130 4.730 4.552 4.914 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 616 1 32 VAL HB 1 70 VAL MG1 5.290 . 5.290 4.098 2.254 5.304 0.014 5 0 "[ . 1 . 2 . 3 . 4]" 1 617 1 32 VAL HB 1 70 VAL QG 4.270 . 4.270 2.957 2.245 3.346 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 618 1 32 VAL HB 1 70 VAL MG2 5.290 . 5.290 3.896 2.819 5.307 0.017 17 0 "[ . 1 . 2 . 3 . 4]" 1 619 1 32 VAL HB 1 74 ILE MD 4.330 . 4.330 3.848 3.369 4.184 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 620 1 32 VAL QG 1 33 ASN H 3.470 . 3.470 2.272 2.019 2.387 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 621 1 32 VAL QG 1 33 ASN HA 4.390 . 4.390 3.155 3.057 3.211 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 622 1 32 VAL QG 1 33 ASN QB 4.740 . 4.740 3.575 3.310 3.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 623 1 32 VAL QG 1 33 ASN QD 3.910 . 3.910 3.448 1.838 3.919 0.009 22 0 "[ . 1 . 2 . 3 . 4]" 1 624 1 32 VAL QG 1 34 ARG H 4.560 . 4.560 4.296 4.143 4.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 625 1 32 VAL QG 1 36 ILE MD 3.240 . 3.240 2.153 2.042 2.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 626 1 32 VAL QG 1 68 PHE QD 4.020 . 4.020 3.975 3.505 4.210 0.190 10 0 "[ . 1 . 2 . 3 . 4]" 1 627 1 32 VAL QG 1 68 PHE QE 4.310 . 4.310 3.843 2.546 4.394 0.084 6 0 "[ . 1 . 2 . 3 . 4]" 1 628 1 32 VAL QG 1 70 VAL HB 5.150 . 5.150 3.815 2.988 4.450 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 629 1 32 VAL QG 1 70 VAL QG 3.080 . 3.080 2.376 2.121 3.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 630 1 32 VAL QG 1 71 SER H 4.680 . 4.680 4.362 3.969 4.609 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 631 1 32 VAL QG 1 71 SER HA 4.650 . 4.650 4.035 3.863 4.291 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 632 1 32 VAL QG 1 71 SER QB 3.940 . 3.940 2.039 1.900 2.169 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 633 1 32 VAL QG 1 71 SER HG 3.740 . 3.740 2.668 2.327 3.155 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 634 1 32 VAL QG 1 74 ILE H 4.650 . 4.650 4.471 4.046 4.673 0.023 9 0 "[ . 1 . 2 . 3 . 4]" 1 635 1 32 VAL QG 1 74 ILE MD 3.020 . 3.020 2.045 1.970 2.169 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 636 1 32 VAL QG 1 74 ILE QG 3.760 . 3.760 3.064 2.450 3.310 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 637 1 32 VAL MG1 1 33 ASN HA 5.010 . 5.010 3.363 3.265 3.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 638 1 32 VAL MG1 1 71 SER HG 4.510 . 4.510 4.453 4.119 4.539 0.029 1 0 "[ . 1 . 2 . 3 . 4]" 1 639 1 32 VAL MG2 1 33 ASN HA 5.010 . 5.010 3.851 3.241 4.062 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 640 1 32 VAL MG2 1 71 SER HG 4.510 . 4.510 2.691 2.335 3.221 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 641 1 33 ASN H 1 33 ASN HB2 3.590 . 3.590 2.341 2.178 2.455 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 642 1 33 ASN H 1 33 ASN HB3 3.590 . 3.590 3.572 3.465 3.594 0.004 22 0 "[ . 1 . 2 . 3 . 4]" 1 643 1 33 ASN H 1 33 ASN HD21 4.780 . 4.780 4.658 4.039 4.792 0.012 18 0 "[ . 1 . 2 . 3 . 4]" 1 644 1 33 ASN H 1 33 ASN HD22 4.780 . 4.780 4.253 2.483 4.737 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 645 1 33 ASN H 1 34 ARG H 3.680 . 3.680 2.687 2.552 2.810 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 646 1 33 ASN H 1 35 CYS H 5.070 . 5.070 4.197 3.999 4.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 647 1 33 ASN H 1 36 ILE MD 4.400 . 4.400 4.085 3.727 4.333 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 648 1 33 ASN HA 1 36 ILE HB 4.350 . 4.350 2.701 2.072 3.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 649 1 33 ASN HA 1 36 ILE MD 3.430 . 3.430 2.234 2.000 2.493 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 650 1 33 ASN HA 1 36 ILE MG 4.760 . 4.760 4.066 3.447 4.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 651 1 33 ASN QB 1 36 ILE MD 4.420 . 4.420 4.113 3.716 4.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 652 1 33 ASN HB2 1 34 ARG H 4.230 . 4.230 2.710 2.529 3.127 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 653 1 33 ASN HB3 1 34 ARG H 4.230 . 4.230 3.484 3.126 3.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 654 1 33 ASN QD 1 36 ILE MD 3.940 . 3.940 3.780 2.809 4.057 0.117 15 0 "[ . 1 . 2 . 3 . 4]" 1 655 1 33 ASN QD 1 36 ILE MG 5.210 . 5.210 4.950 4.134 5.335 0.125 28 0 "[ . 1 . 2 . 3 . 4]" 1 656 1 34 ARG H 1 34 ARG QB 3.590 . 3.590 2.197 2.103 2.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 657 1 34 ARG H 1 34 ARG QD 5.290 . 5.290 4.401 3.951 4.978 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 658 1 34 ARG H 1 34 ARG HG2 4.890 . 4.890 4.575 4.484 4.694 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 659 1 34 ARG H 1 34 ARG QG 4.230 . 4.230 4.009 3.911 4.119 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 660 1 34 ARG H 1 34 ARG HG3 4.890 . 4.890 4.435 4.256 4.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 661 1 34 ARG H 1 35 CYS H 3.740 . 3.740 2.697 2.589 2.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 662 1 34 ARG H 1 35 CYS QB 5.340 . 5.340 4.445 4.323 4.532 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 663 1 34 ARG HA 1 34 ARG QD 4.780 . 4.780 3.311 1.901 4.217 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 664 1 34 ARG QB 1 35 CYS H 4.180 . 4.180 2.586 2.429 2.746 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 665 1 34 ARG HE 1 34 ARG HG2 4.180 . 4.180 3.050 2.420 3.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 666 1 34 ARG HE 1 34 ARG QG 3.630 . 3.630 2.597 2.246 3.254 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 667 1 34 ARG HE 1 34 ARG HG3 4.180 . 4.180 2.994 2.343 3.973 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 668 1 34 ARG QG 1 35 CYS H 4.440 . 4.440 3.887 3.633 4.141 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 669 1 34 ARG QG 1 35 CYS HA 4.490 . 4.490 4.019 3.619 4.359 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 670 1 35 CYS H 1 36 ILE H 4.260 . 4.260 2.721 2.628 2.822 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 671 1 35 CYS H 1 36 ILE MD 5.110 . 5.110 4.950 4.757 5.128 0.018 28 0 "[ . 1 . 2 . 3 . 4]" 1 672 1 35 CYS H 1 37 GLU H 4.560 . 4.560 4.296 4.167 4.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 673 1 35 CYS H 1 74 ILE MD 4.530 . 4.530 4.247 4.076 4.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 674 1 35 CYS HA 1 38 ALA H 4.490 . 4.490 3.533 3.421 3.677 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 675 1 35 CYS HA 1 38 ALA MB 4.650 . 4.650 2.554 2.335 2.768 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 676 1 35 CYS QB 1 74 ILE MD 3.680 . 3.680 2.261 2.128 2.406 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 677 1 35 CYS HB2 1 74 ILE MD 4.250 . 4.250 3.363 3.210 3.488 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 678 1 35 CYS HB3 1 74 ILE MD 4.250 . 4.250 2.298 2.153 2.455 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 679 1 36 ILE H 1 36 ILE HB 4.090 . 4.090 2.392 2.198 2.479 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 680 1 36 ILE H 1 36 ILE MD 3.530 . 3.530 3.287 3.207 3.376 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 681 1 36 ILE H 1 36 ILE QG 4.020 . 4.020 2.320 2.216 2.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 682 1 36 ILE H 1 36 ILE MG 3.920 . 3.920 3.774 3.682 3.820 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 683 1 36 ILE H 1 37 GLU H 4.090 . 4.090 2.738 2.638 2.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 684 1 36 ILE H 1 73 VAL QG 5.440 . 5.440 5.328 5.171 5.454 0.014 31 0 "[ . 1 . 2 . 3 . 4]" 1 685 1 36 ILE H 1 74 ILE MD 3.920 . 3.920 3.718 3.407 3.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 686 1 36 ILE HA 1 36 ILE MD 3.870 . 3.870 3.868 3.789 3.897 0.027 5 0 "[ . 1 . 2 . 3 . 4]" 1 687 1 36 ILE HA 1 36 ILE MG 3.380 . 3.380 2.542 2.462 2.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 688 1 36 ILE HA 1 39 LEU H 4.810 . 4.810 3.521 3.312 3.678 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 689 1 36 ILE HA 1 39 LEU QB 4.560 . 4.560 2.797 2.445 3.230 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 690 1 36 ILE HA 1 39 LEU MD1 4.890 . 4.890 3.172 2.363 4.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 691 1 36 ILE HA 1 39 LEU QD 3.610 . 3.610 2.507 2.328 2.680 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 692 1 36 ILE HA 1 39 LEU MD2 4.890 . 4.890 3.944 2.343 4.927 0.037 12 0 "[ . 1 . 2 . 3 . 4]" 1 693 1 36 ILE HA 1 73 VAL QG 4.620 . 4.620 4.201 3.598 4.647 0.027 8 0 "[ . 1 . 2 . 3 . 4]" 1 694 1 36 ILE HA 1 74 ILE MD 4.610 . 4.610 4.470 3.556 4.637 0.027 6 0 "[ . 1 . 2 . 3 . 4]" 1 695 1 36 ILE HB 1 36 ILE MD 3.270 . 3.270 2.329 2.273 2.371 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 696 1 36 ILE HB 1 37 GLU H 3.550 . 3.550 2.679 2.619 2.732 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 697 1 36 ILE MD 1 37 GLU H 4.520 . 4.520 4.522 4.429 4.590 0.070 12 0 "[ . 1 . 2 . 3 . 4]" 1 698 1 36 ILE MD 1 71 SER QB 4.240 . 4.240 3.410 3.006 3.725 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 699 1 36 ILE MD 1 71 SER HG 4.330 . 4.330 2.393 1.869 3.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 700 1 36 ILE MD 1 73 VAL H 5.400 . 5.400 4.673 4.366 4.905 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 701 1 36 ILE MD 1 74 ILE H 4.910 . 4.910 4.113 3.695 4.452 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 702 1 36 ILE MD 1 74 ILE HB 5.500 . 5.500 4.720 4.434 5.299 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 703 1 36 ILE MD 1 74 ILE MD 3.950 . 3.950 3.373 3.013 3.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 704 1 36 ILE MD 1 77 LYS HE2 5.500 . 5.500 5.119 4.737 5.568 0.068 12 0 "[ . 1 . 2 . 3 . 4]" 1 705 1 36 ILE MD 1 77 LYS HE3 5.500 . 5.500 4.646 3.984 5.188 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 706 1 36 ILE QG 1 73 VAL QG 3.480 . 3.480 2.291 2.141 2.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 707 1 36 ILE MG 1 37 GLU H 3.520 . 3.520 3.274 2.845 3.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 708 1 36 ILE MG 1 37 GLU QG 4.620 . 4.620 3.545 2.808 4.200 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 709 1 36 ILE MG 1 38 ALA H 5.500 . 5.500 4.984 4.760 5.131 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 710 1 36 ILE MG 1 40 ASP H 4.550 . 4.550 4.281 4.060 4.559 0.009 23 0 "[ . 1 . 2 . 3 . 4]" 1 711 1 36 ILE MG 1 77 LYS QD 4.360 . 4.360 2.753 2.204 4.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 712 1 36 ILE MG 1 77 LYS HE2 3.890 . 3.890 3.224 2.832 3.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 713 1 36 ILE MG 1 77 LYS HE3 3.890 . 3.890 2.129 1.935 2.581 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 714 1 36 ILE MG 1 77 LYS QG 4.500 . 4.500 3.776 2.224 4.510 0.010 24 0 "[ . 1 . 2 . 3 . 4]" 1 715 1 37 GLU H 1 37 GLU HB2 3.760 . 3.760 2.476 2.363 2.705 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 716 1 37 GLU H 1 37 GLU HB3 3.760 . 3.760 3.608 3.567 3.661 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 717 1 37 GLU H 1 37 GLU HG2 3.800 . 3.800 2.847 2.042 3.588 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 718 1 37 GLU H 1 37 GLU QG 3.300 . 3.300 2.246 2.031 2.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 719 1 37 GLU H 1 37 GLU HG3 3.800 . 3.800 2.907 2.235 3.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 720 1 37 GLU H 1 38 ALA H 3.740 . 3.740 2.669 2.597 2.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 721 1 37 GLU H 1 38 ALA MB 4.510 . 4.510 4.259 4.178 4.321 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 722 1 37 GLU HA 1 40 ASP H 4.350 . 4.350 3.379 3.022 3.602 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 723 1 37 GLU HB2 1 38 ALA H 3.980 . 3.980 2.597 2.432 2.845 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 724 1 37 GLU HB3 1 38 ALA H 3.980 . 3.980 3.629 3.416 3.838 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 725 1 37 GLU QG 1 38 ALA H 4.190 . 4.190 4.047 3.851 4.207 0.017 28 0 "[ . 1 . 2 . 3 . 4]" 1 726 1 37 GLU HG2 1 38 ALA H 4.930 . 4.930 4.617 4.018 4.963 0.033 2 0 "[ . 1 . 2 . 3 . 4]" 1 727 1 37 GLU HG3 1 38 ALA H 4.930 . 4.930 4.595 4.299 4.940 0.010 16 0 "[ . 1 . 2 . 3 . 4]" 1 728 1 38 ALA H 1 38 ALA MB 2.990 . 2.990 2.175 2.135 2.218 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 729 1 38 ALA H 1 39 LEU H 3.750 . 3.750 2.687 2.604 2.798 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 730 1 38 ALA H 1 39 LEU MD1 5.500 . 5.500 4.993 4.510 5.390 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 731 1 38 ALA H 1 39 LEU MD2 5.500 . 5.500 5.357 5.010 5.564 0.064 10 0 "[ . 1 . 2 . 3 . 4]" 1 732 1 38 ALA H 1 40 ASP H 4.640 . 4.640 4.123 3.905 4.272 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 733 1 38 ALA HA 1 41 GLU H 4.150 . 4.150 3.459 3.375 3.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 734 1 38 ALA MB 1 39 LEU H 3.330 . 3.330 2.529 2.441 2.619 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 735 1 38 ALA MB 1 39 LEU QD 3.730 . 3.730 3.340 2.824 3.704 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 736 1 38 ALA MB 1 40 ASP H 4.740 . 4.740 4.498 4.396 4.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 737 1 38 ALA MB 1 41 GLU H 4.640 . 4.640 4.647 4.578 4.676 0.036 16 0 "[ . 1 . 2 . 3 . 4]" 1 738 1 38 ALA MB 1 41 GLU QG 5.340 . 5.340 4.922 4.048 5.298 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 739 1 39 LEU H 1 39 LEU QB 3.550 . 3.550 2.289 2.080 2.442 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 740 1 39 LEU H 1 39 LEU MD1 3.950 . 3.950 3.197 2.581 3.638 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 741 1 39 LEU H 1 39 LEU QD 3.330 . 3.330 2.914 2.495 3.203 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 742 1 39 LEU H 1 39 LEU MD2 3.950 . 3.950 3.447 3.275 3.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 743 1 39 LEU H 1 40 ASP H 3.980 . 3.980 2.689 2.599 2.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 744 1 39 LEU HA 1 39 LEU MD1 4.140 . 4.140 3.171 2.031 3.921 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 745 1 39 LEU HA 1 39 LEU QD 3.080 . 3.080 2.067 2.023 2.116 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 746 1 39 LEU HA 1 39 LEU MD2 4.140 . 4.140 2.785 2.043 3.865 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 747 1 39 LEU HA 1 39 LEU HG 4.130 . 4.130 3.020 2.928 3.110 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 748 1 39 LEU HA 1 42 LEU H 4.050 . 4.050 3.501 3.267 3.754 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 749 1 39 LEU QB 1 39 LEU QD 2.650 . 2.650 1.974 1.948 2.012 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 750 1 39 LEU QB 1 40 ASP H 3.850 . 3.850 2.724 2.618 2.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 751 1 39 LEU QB 1 81 LEU QD 4.590 . 4.590 2.680 2.248 3.221 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 752 1 39 LEU HB2 1 40 ASP H 4.630 . 4.630 2.841 2.686 2.962 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 753 1 39 LEU HB3 1 40 ASP H 4.630 . 4.630 3.562 3.208 3.845 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 754 1 39 LEU QD 1 65 ILE MD 3.430 . 3.430 1.976 1.895 2.087 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 755 1 39 LEU QD 1 65 ILE MG 5.440 . 5.440 4.080 3.823 4.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 756 1 39 LEU QD 1 74 ILE H 5.440 . 5.440 4.840 4.574 5.098 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 757 1 39 LEU QD 1 74 ILE HA 3.600 . 3.600 2.575 2.311 2.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 758 1 39 LEU QD 1 74 ILE MD 3.720 . 3.720 3.666 2.752 3.819 0.099 10 0 "[ . 1 . 2 . 3 . 4]" 1 759 1 39 LEU QD 1 77 LYS QB 3.510 . 3.510 2.094 2.000 2.237 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 760 1 39 LEU QD 1 77 LYS QE 5.240 . 5.240 4.398 3.408 4.905 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 761 1 39 LEU QD 1 77 LYS QG 4.370 . 4.370 3.608 3.023 3.899 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 762 1 39 LEU QD 1 78 SER H 3.720 . 3.720 2.951 2.691 3.257 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 763 1 39 LEU QD 1 78 SER HA 3.800 . 3.800 2.967 2.436 3.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 764 1 39 LEU QD 1 78 SER QB 3.420 . 3.420 2.692 2.266 3.047 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 765 1 39 LEU QD 1 81 LEU QD 3.680 . 3.680 2.545 2.028 3.403 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 766 1 39 LEU MD1 1 40 ASP H 4.830 . 4.830 4.593 4.461 4.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 767 1 39 LEU MD1 1 78 SER H 4.830 . 4.830 3.669 2.732 4.845 0.015 9 0 "[ . 1 . 2 . 3 . 4]" 1 768 1 39 LEU MD1 1 78 SER HA 4.330 . 4.330 3.564 3.028 4.023 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 769 1 39 LEU MD1 1 78 SER HB2 5.700 . 5.700 3.997 2.829 4.726 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 770 1 39 LEU MD1 1 78 SER HB3 5.700 . 5.700 3.730 2.460 5.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 771 1 39 LEU MD2 1 40 ASP H 4.830 . 4.830 4.719 4.466 4.839 0.009 5 0 "[ . 1 . 2 . 3 . 4]" 1 772 1 39 LEU MD2 1 78 SER H 4.830 . 4.830 3.750 2.871 4.405 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 773 1 39 LEU MD2 1 78 SER HA 4.330 . 4.330 3.191 2.568 4.010 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 774 1 39 LEU MD2 1 78 SER HB2 5.700 . 5.700 3.819 2.882 4.616 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 775 1 39 LEU MD2 1 78 SER HB3 5.700 . 5.700 3.623 2.530 4.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 776 1 39 LEU HG 1 74 ILE HA 5.500 . 5.500 5.147 4.649 5.501 0.001 31 0 "[ . 1 . 2 . 3 . 4]" 1 777 1 40 ASP H 1 40 ASP HB2 4.030 . 4.030 2.217 2.091 2.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 778 1 40 ASP H 1 40 ASP HB3 4.030 . 4.030 3.445 3.049 3.584 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 779 1 40 ASP H 1 41 GLU H 3.820 . 3.820 2.620 2.552 2.673 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 780 1 40 ASP H 1 43 ALA MB 5.500 . 5.500 4.661 4.499 4.980 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 781 1 40 ASP HA 1 43 ALA H 4.230 . 4.230 3.105 2.920 3.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 782 1 40 ASP HA 1 43 ALA MB 3.040 . 3.040 2.397 2.183 2.779 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 783 1 40 ASP HA 1 80 MET ME 4.530 . 4.530 3.950 3.228 4.573 0.043 12 0 "[ . 1 . 2 . 3 . 4]" 1 784 1 40 ASP QB 1 43 ALA MB 5.340 . 5.340 4.006 3.712 4.474 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 785 1 40 ASP HB2 1 41 GLU H 4.360 . 4.360 3.146 2.882 3.589 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 786 1 40 ASP HB3 1 41 GLU H 4.360 . 4.360 3.411 2.755 3.752 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 787 1 41 GLU H 1 41 GLU QB 3.550 . 3.550 2.204 1.989 2.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 788 1 41 GLU H 1 41 GLU QG 4.480 . 4.480 3.918 2.474 4.064 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 789 1 41 GLU H 1 42 LEU H 3.770 . 3.770 2.609 2.514 2.698 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 790 1 41 GLU HA 1 41 GLU HG2 4.060 . 4.060 3.945 3.080 4.066 0.006 38 0 "[ . 1 . 2 . 3 . 4]" 1 791 1 41 GLU HA 1 41 GLU QG 3.420 . 3.420 3.124 2.892 3.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 792 1 41 GLU HA 1 41 GLU HG3 4.060 . 4.060 3.290 2.988 3.856 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 793 1 41 GLU QB 1 42 LEU H 4.190 . 4.190 2.616 2.260 2.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 794 1 41 GLU QB 1 43 ALA H 5.170 . 5.170 4.732 4.419 4.917 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 795 1 41 GLU QG 1 42 LEU H 4.550 . 4.550 3.316 2.872 3.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 796 1 41 GLU HG2 1 42 LEU H 5.160 . 5.160 4.377 4.106 4.624 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 797 1 41 GLU HG3 1 42 LEU H 5.160 . 5.160 3.445 2.932 4.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 798 1 42 LEU H 1 42 LEU MD1 4.330 . 4.330 4.247 4.031 4.361 0.031 2 0 "[ . 1 . 2 . 3 . 4]" 1 799 1 42 LEU H 1 42 LEU MD2 4.330 . 4.330 3.943 3.653 4.333 0.003 8 0 "[ . 1 . 2 . 3 . 4]" 1 800 1 42 LEU H 1 42 LEU HG 4.800 . 4.800 4.448 4.194 4.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 801 1 42 LEU H 1 43 ALA H 3.950 . 3.950 2.701 2.645 2.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 802 1 42 LEU H 1 43 ALA MB 4.500 . 4.500 4.365 4.315 4.470 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 803 1 42 LEU H 1 45 LEU QD 4.600 . 4.600 4.322 4.181 4.531 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 804 1 42 LEU H 1 81 LEU MD1 5.500 . 5.500 4.691 4.237 5.371 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 805 1 42 LEU H 1 81 LEU QD 4.620 . 4.620 4.194 3.984 4.487 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 806 1 42 LEU H 1 81 LEU MD2 5.500 . 5.500 4.764 4.515 5.117 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 807 1 42 LEU HA 1 42 LEU MD1 4.190 . 4.190 2.641 2.126 3.901 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 808 1 42 LEU HA 1 42 LEU QD 3.070 . 3.070 2.091 1.983 2.470 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 809 1 42 LEU HA 1 42 LEU MD2 4.190 . 4.190 2.771 2.023 3.907 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 810 1 42 LEU HA 1 45 LEU H 4.470 . 4.470 3.534 3.402 3.718 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 811 1 42 LEU HA 1 45 LEU QB 4.720 . 4.720 2.779 2.475 2.989 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 812 1 42 LEU HA 1 45 LEU QD 3.510 . 3.510 2.373 2.169 2.548 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 813 1 42 LEU HA 1 45 LEU HG 4.570 . 4.570 3.632 3.310 3.861 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 814 1 42 LEU HA 1 47 VAL QG 4.390 . 4.390 3.856 3.325 4.314 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 815 1 42 LEU HA 1 58 MET ME 5.500 . 5.500 5.358 5.186 5.501 0.001 21 0 "[ . 1 . 2 . 3 . 4]" 1 816 1 42 LEU QB 1 45 LEU QD 5.280 . 5.280 4.040 3.747 4.277 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 817 1 42 LEU QB 1 81 LEU QD 4.330 . 4.330 2.472 2.128 2.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 818 1 42 LEU HB2 1 43 ALA H 4.480 . 4.480 3.706 3.524 3.938 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 819 1 42 LEU HB3 1 43 ALA H 4.480 . 4.480 2.595 2.483 2.733 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 820 1 42 LEU QD 1 43 ALA H 4.130 . 4.130 3.736 3.545 3.984 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 821 1 42 LEU QD 1 43 ALA HA 4.720 . 4.720 3.739 3.355 4.365 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 822 1 42 LEU QD 1 43 ALA MB 3.870 . 3.870 4.069 3.846 4.367 0.497 18 0 "[ . 1 . 2 . 3 . 4]" 1 823 1 42 LEU QD 1 44 SER H 5.440 . 5.440 4.921 4.730 5.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 824 1 42 LEU QD 1 45 LEU H 4.510 . 4.510 4.335 4.155 4.553 0.043 15 0 "[ . 1 . 2 . 3 . 4]" 1 825 1 42 LEU QD 1 45 LEU QB 4.150 . 4.150 3.174 2.989 3.371 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 826 1 42 LEU QD 1 45 LEU QD 3.200 . 3.200 2.733 2.492 3.243 0.043 8 0 "[ . 1 . 2 . 3 . 4]" 1 827 1 42 LEU QD 1 45 LEU HG 4.700 . 4.700 4.561 4.257 4.742 0.042 8 0 "[ . 1 . 2 . 3 . 4]" 1 828 1 42 LEU QD 1 58 MET ME 2.700 . 2.700 2.139 1.983 2.437 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 829 1 42 LEU QD 1 81 LEU H 5.300 . 5.300 5.352 5.086 5.458 0.158 10 0 "[ . 1 . 2 . 3 . 4]" 1 830 1 42 LEU QD 1 81 LEU QB 3.640 . 3.640 2.933 2.637 3.148 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 831 1 42 LEU QD 1 81 LEU QD 2.970 . 2.970 2.007 1.809 2.629 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 832 1 42 LEU QD 1 85 PHE QD 4.710 . 4.710 4.403 3.838 4.728 0.018 21 0 "[ . 1 . 2 . 3 . 4]" 1 833 1 42 LEU QD 1 85 PHE QE 3.400 . 3.400 2.570 2.152 3.054 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 834 1 42 LEU QD 1 85 PHE HZ 3.800 . 3.800 2.380 1.951 3.319 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 835 1 42 LEU MD1 1 43 ALA H 4.700 . 4.700 4.099 3.674 4.572 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 836 1 42 LEU MD1 1 58 MET QG 5.240 . 5.240 4.019 2.683 4.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 837 1 42 LEU MD1 1 85 PHE QE 4.310 . 4.310 2.944 2.385 3.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 838 1 42 LEU MD1 1 85 PHE HZ 4.470 . 4.470 2.524 2.026 3.951 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 839 1 42 LEU MD2 1 43 ALA H 4.700 . 4.700 4.497 3.935 4.723 0.023 3 0 "[ . 1 . 2 . 3 . 4]" 1 840 1 42 LEU MD2 1 58 MET QG 5.240 . 5.240 3.568 2.885 4.324 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 841 1 42 LEU MD2 1 85 PHE QE 4.310 . 4.310 3.630 2.263 4.374 0.064 12 0 "[ . 1 . 2 . 3 . 4]" 1 842 1 42 LEU MD2 1 85 PHE HZ 4.470 . 4.470 3.662 1.959 4.314 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 843 1 42 LEU HG 1 43 ALA H 5.170 . 5.170 4.554 3.679 5.173 0.003 17 0 "[ . 1 . 2 . 3 . 4]" 1 844 1 42 LEU HG 1 81 LEU QD 4.100 . 4.100 2.850 2.052 4.138 0.038 8 0 "[ . 1 . 2 . 3 . 4]" 1 845 1 42 LEU HG 1 85 PHE QE 4.320 . 4.320 4.181 3.661 4.381 0.061 8 0 "[ . 1 . 2 . 3 . 4]" 1 846 1 42 LEU HG 1 85 PHE HZ 4.920 . 4.920 4.204 2.925 4.924 0.004 2 0 "[ . 1 . 2 . 3 . 4]" 1 847 1 43 ALA H 1 43 ALA MB 2.820 . 2.820 2.217 2.191 2.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 848 1 43 ALA H 1 44 SER H 3.880 . 3.880 2.578 2.508 2.629 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 849 1 43 ALA H 1 45 LEU H 4.820 . 4.820 3.982 3.883 4.081 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 850 1 43 ALA H 1 45 LEU QD 5.440 . 5.440 5.151 4.994 5.272 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 851 1 43 ALA H 1 47 VAL QG 5.440 . 5.440 5.269 4.939 5.468 0.028 38 0 "[ . 1 . 2 . 3 . 4]" 1 852 1 43 ALA H 1 80 MET ME 4.820 . 4.820 4.565 4.157 4.825 0.005 20 0 "[ . 1 . 2 . 3 . 4]" 1 853 1 43 ALA H 1 81 LEU MD1 4.020 . 4.020 3.369 2.881 3.800 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 854 1 43 ALA H 1 81 LEU QD 3.530 . 3.530 2.871 2.682 3.041 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 855 1 43 ALA H 1 81 LEU MD2 4.020 . 4.020 3.199 2.846 3.565 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 856 1 43 ALA HA 1 45 LEU H 4.940 . 4.940 4.084 3.913 4.335 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 857 1 43 ALA HA 1 80 MET ME 4.280 . 4.280 3.932 2.834 4.291 0.011 1 0 "[ . 1 . 2 . 3 . 4]" 1 858 1 43 ALA HA 1 81 LEU MD1 4.440 . 4.440 3.117 2.001 4.394 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 859 1 43 ALA HA 1 81 LEU QD 2.930 . 2.930 2.150 1.989 2.373 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 860 1 43 ALA HA 1 81 LEU MD2 4.440 . 4.440 2.944 2.138 4.066 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 861 1 43 ALA MB 1 44 SER H 3.640 . 3.640 2.756 2.660 2.901 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 862 1 43 ALA MB 1 45 LEU H 4.440 . 4.440 4.407 4.355 4.454 0.014 40 0 "[ . 1 . 2 . 3 . 4]" 1 863 1 43 ALA MB 1 80 MET QB 4.600 . 4.600 4.202 3.466 4.656 0.056 6 0 "[ . 1 . 2 . 3 . 4]" 1 864 1 43 ALA MB 1 80 MET ME 2.890 . 2.890 2.191 1.931 2.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 865 1 43 ALA MB 1 81 LEU MD1 3.290 . 3.290 2.754 2.155 3.294 0.004 31 0 "[ . 1 . 2 . 3 . 4]" 1 866 1 43 ALA MB 1 81 LEU QD 2.690 . 2.690 2.113 1.972 2.248 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 867 1 43 ALA MB 1 81 LEU MD2 3.290 . 3.290 2.272 2.022 2.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 868 1 43 ALA MB 1 81 LEU HG 4.510 . 4.510 3.760 3.015 4.276 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 869 1 43 ALA MB 1 84 LYS QE 5.500 . 5.500 5.236 4.695 5.612 0.112 2 0 "[ . 1 . 2 . 3 . 4]" 1 870 1 44 SER H 1 44 SER HB2 4.170 . 4.170 2.497 2.451 3.651 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 871 1 44 SER H 1 44 SER QB 3.520 . 3.520 2.432 2.414 2.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 872 1 44 SER H 1 44 SER HB3 4.170 . 4.170 3.589 2.615 3.641 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 873 1 44 SER H 1 45 LEU H 3.520 . 3.520 2.375 2.257 2.511 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 874 1 44 SER H 1 45 LEU MD1 5.500 . 5.500 5.122 4.845 5.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 875 1 44 SER H 1 45 LEU QD 4.800 . 4.800 4.712 4.545 4.829 0.029 11 0 "[ . 1 . 2 . 3 . 4]" 1 876 1 44 SER H 1 45 LEU MD2 5.500 . 5.500 5.509 5.348 5.539 0.039 1 0 "[ . 1 . 2 . 3 . 4]" 1 877 1 44 SER H 1 45 LEU HG 4.830 . 4.830 4.497 4.346 4.663 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 878 1 44 SER H 1 81 LEU QD 4.810 . 4.810 4.485 4.321 4.617 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 879 1 45 LEU H 1 45 LEU HB2 4.030 . 4.030 2.227 2.149 2.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 880 1 45 LEU H 1 45 LEU QB 3.480 . 3.480 2.204 2.129 2.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 881 1 45 LEU H 1 45 LEU HB3 4.030 . 4.030 3.517 3.456 3.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 882 1 45 LEU H 1 45 LEU MD1 4.320 . 4.320 3.719 3.563 3.881 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 883 1 45 LEU H 1 45 LEU MD2 4.320 . 4.320 3.863 3.718 3.955 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 884 1 45 LEU H 1 45 LEU HG 4.070 . 4.070 2.866 2.654 3.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 885 1 45 LEU H 1 47 VAL QG 4.100 . 4.100 3.914 3.527 4.142 0.042 12 0 "[ . 1 . 2 . 3 . 4]" 1 886 1 45 LEU HA 1 45 LEU MD1 3.830 . 3.830 3.820 3.786 3.845 0.015 2 0 "[ . 1 . 2 . 3 . 4]" 1 887 1 45 LEU HA 1 45 LEU QD 2.830 . 2.830 2.028 1.984 2.073 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 888 1 45 LEU HA 1 45 LEU MD2 3.830 . 3.830 2.036 1.991 2.081 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 889 1 45 LEU QB 1 45 LEU QD 2.710 . 2.710 1.934 1.912 1.946 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 890 1 45 LEU QB 1 47 VAL H 3.900 . 3.900 2.948 2.647 3.152 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 891 1 45 LEU QB 1 47 VAL QG 2.990 . 2.990 2.529 2.087 3.025 0.035 16 0 "[ . 1 . 2 . 3 . 4]" 1 892 1 45 LEU HB2 1 45 LEU MD1 3.530 . 3.530 2.269 2.227 2.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 893 1 45 LEU HB2 1 45 LEU MD2 3.530 . 3.530 3.239 3.205 3.263 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 894 1 45 LEU HB2 1 47 VAL H 4.600 . 4.600 3.673 3.526 3.812 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 895 1 45 LEU HB3 1 45 LEU MD1 3.530 . 3.530 2.383 2.279 2.496 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 896 1 45 LEU HB3 1 45 LEU MD2 3.530 . 3.530 2.389 2.274 2.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 897 1 45 LEU HB3 1 47 VAL H 4.600 . 4.600 3.112 2.718 3.379 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 898 1 45 LEU QD 1 46 GLN H 3.550 . 3.550 2.810 2.519 3.053 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 899 1 45 LEU QD 1 46 GLN HG2 4.230 . 4.230 3.215 2.804 3.653 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 900 1 45 LEU QD 1 47 VAL H 4.740 . 4.740 4.257 3.925 4.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 901 1 45 LEU QD 1 47 VAL QG 3.590 . 3.590 3.340 2.810 3.923 0.333 16 0 "[ . 1 . 2 . 3 . 4]" 1 902 1 45 LEU MD1 1 46 GLN H 4.860 . 4.860 4.462 4.236 4.702 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 903 1 45 LEU MD1 1 47 VAL H 5.500 . 5.500 4.785 4.452 5.090 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 904 1 45 LEU MD2 1 46 GLN H 4.860 . 4.860 2.841 2.537 3.099 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 905 1 45 LEU MD2 1 47 VAL H 5.500 . 5.500 4.775 4.362 5.041 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 906 1 46 GLN H 1 46 GLN HB2 4.140 . 4.140 3.566 3.545 3.585 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 907 1 46 GLN H 1 46 GLN HB3 4.140 . 4.140 2.633 2.541 2.698 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 908 1 46 GLN H 1 46 GLN HG2 4.130 . 4.130 1.845 1.704 1.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 909 1 46 GLN H 1 46 GLN HG3 4.130 . 4.130 3.102 2.979 3.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 910 1 46 GLN H 1 47 VAL H 4.390 . 4.390 3.415 3.310 3.527 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 911 1 46 GLN H 1 47 VAL QG 4.490 . 4.490 4.259 3.932 4.562 0.072 3 0 "[ . 1 . 2 . 3 . 4]" 1 912 1 46 GLN HA 1 46 GLN HG2 3.850 . 3.850 3.746 3.690 3.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 913 1 46 GLN HA 1 46 GLN HG3 4.250 . 4.250 3.848 3.799 3.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 914 1 46 GLN HA 1 47 VAL H 3.090 . 3.090 2.780 2.631 2.888 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 915 1 46 GLN QB 1 47 VAL H 4.220 . 4.220 4.074 4.009 4.099 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 916 1 46 GLN HB2 1 47 VAL H 4.800 . 4.800 4.486 4.415 4.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 917 1 46 GLN HB3 1 47 VAL H 4.800 . 4.800 4.673 4.597 4.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 918 1 46 GLN HG2 1 47 VAL H 4.530 . 4.530 4.532 4.367 4.555 0.025 2 0 "[ . 1 . 2 . 3 . 4]" 1 919 1 46 GLN HG3 1 47 VAL H 4.530 . 4.530 4.465 4.253 4.549 0.019 2 0 "[ . 1 . 2 . 3 . 4]" 1 920 1 46 GLN HG3 1 47 VAL HA 4.680 . 4.680 4.237 4.066 4.440 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 921 1 46 GLN HG3 1 48 THR MG 5.500 . 5.500 4.687 4.356 4.953 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 922 1 47 VAL H 1 47 VAL HB 3.210 . 3.210 2.864 2.804 2.962 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 923 1 47 VAL H 1 47 VAL MG1 3.800 . 3.800 2.839 1.856 3.807 0.007 25 0 "[ . 1 . 2 . 3 . 4]" 1 924 1 47 VAL H 1 47 VAL QG 2.890 . 2.890 1.903 1.852 1.978 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 925 1 47 VAL H 1 47 VAL MG2 3.800 . 3.800 2.868 1.882 3.819 0.019 28 0 "[ . 1 . 2 . 3 . 4]" 1 926 1 47 VAL H 1 48 THR H 4.790 . 4.790 4.379 4.267 4.563 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 927 1 47 VAL H 1 48 THR MG 5.500 . 5.500 5.501 5.348 5.593 0.093 12 0 "[ . 1 . 2 . 3 . 4]" 1 928 1 47 VAL HA 1 47 VAL MG1 3.360 . 3.360 2.749 2.185 3.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 929 1 47 VAL HA 1 47 VAL QG 2.870 . 2.870 2.250 2.090 2.410 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 930 1 47 VAL HA 1 47 VAL MG2 3.360 . 3.360 2.523 2.425 2.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 931 1 47 VAL HA 1 48 THR H 3.440 . 3.440 2.085 2.036 2.153 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 932 1 47 VAL HA 1 48 THR MG 3.810 . 3.810 3.515 3.360 3.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 933 1 47 VAL HA 1 51 GLN QB 4.490 . 4.490 3.307 2.992 3.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 934 1 47 VAL HB 1 48 THR H 4.490 . 4.490 4.222 3.986 4.317 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 935 1 47 VAL HB 1 85 PHE QE 3.970 . 3.970 3.343 2.524 4.074 0.104 28 0 "[ . 1 . 2 . 3 . 4]" 1 936 1 47 VAL HB 1 85 PHE HZ 4.980 . 4.980 3.656 2.894 4.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 937 1 47 VAL QG 1 48 THR H 3.200 . 3.200 2.996 2.666 3.138 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 938 1 47 VAL QG 1 49 MET HA 4.660 . 4.660 3.958 3.712 4.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 939 1 47 VAL QG 1 49 MET ME 3.640 . 3.640 3.129 2.687 3.655 0.015 7 0 "[ . 1 . 2 . 3 . 4]" 1 940 1 47 VAL QG 1 51 GLN H 4.500 . 4.500 4.023 3.789 4.427 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 941 1 47 VAL QG 1 51 GLN QB 3.490 . 3.490 2.393 2.128 2.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 942 1 47 VAL QG 1 51 GLN QE 5.170 . 5.170 4.577 3.884 4.980 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 943 1 47 VAL QG 1 52 ALA H 3.490 . 3.490 3.257 3.066 3.443 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 944 1 47 VAL QG 1 52 ALA HA 3.710 . 3.710 3.406 3.090 3.705 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 945 1 47 VAL QG 1 52 ALA MB 3.080 . 3.080 2.747 2.444 2.987 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 946 1 47 VAL QG 1 53 GLN H 5.440 . 5.440 5.303 5.091 5.479 0.039 8 0 "[ . 1 . 2 . 3 . 4]" 1 947 1 47 VAL QG 1 59 ILE MD 5.440 . 5.440 5.161 4.882 5.494 0.054 8 0 "[ . 1 . 2 . 3 . 4]" 1 948 1 47 VAL QG 1 84 LYS QD 4.100 . 4.100 3.374 2.726 4.114 0.014 21 0 "[ . 1 . 2 . 3 . 4]" 1 949 1 47 VAL QG 1 84 LYS QE 4.820 . 4.820 3.362 2.449 4.735 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 950 1 47 VAL QG 1 85 PHE QD 4.250 . 4.250 3.674 3.338 4.052 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 951 1 47 VAL QG 1 85 PHE QE 3.140 . 3.140 2.091 1.830 2.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 952 1 47 VAL QG 1 85 PHE HZ 3.130 . 3.130 2.193 1.941 2.410 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 953 1 47 VAL MG1 1 48 THR H 4.330 . 4.330 3.707 2.695 4.337 0.007 24 0 "[ . 1 . 2 . 3 . 4]" 1 954 1 47 VAL MG1 1 85 PHE QD 5.500 . 5.500 4.136 3.977 4.342 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 955 1 47 VAL MG1 1 85 PHE QE 3.740 . 3.740 2.329 2.219 2.540 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 956 1 47 VAL MG1 1 85 PHE HZ 3.750 . 3.750 2.289 2.023 2.533 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 957 1 47 VAL MG2 1 48 THR H 4.330 . 4.330 3.670 2.744 4.360 0.030 5 0 "[ . 1 . 2 . 3 . 4]" 1 958 1 47 VAL MG2 1 85 PHE QD 5.500 . 5.500 4.553 3.509 5.594 0.094 5 0 "[ . 1 . 2 . 3 . 4]" 1 959 1 47 VAL MG2 1 85 PHE QE 3.740 . 3.740 2.831 1.922 3.782 0.042 2 0 "[ . 1 . 2 . 3 . 4]" 1 960 1 47 VAL MG2 1 85 PHE HZ 3.750 . 3.750 2.821 2.499 3.061 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 961 1 48 THR H 1 48 THR MG 3.050 . 3.050 1.886 1.820 1.961 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 962 1 48 THR H 1 49 MET ME 5.080 . 5.080 4.665 4.497 4.792 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 963 1 48 THR H 1 51 GLN H 4.700 . 4.700 3.768 3.510 3.973 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 964 1 48 THR H 1 51 GLN HB2 4.710 . 4.710 2.917 2.461 3.318 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 965 1 48 THR H 1 51 GLN QB 4.050 . 4.050 2.788 2.439 3.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 966 1 48 THR H 1 51 GLN HB3 4.710 . 4.710 3.982 2.692 4.582 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 967 1 48 THR H 1 51 GLN QE 5.040 . 5.040 4.428 3.496 5.054 0.014 20 0 "[ . 1 . 2 . 3 . 4]" 1 968 1 48 THR H 1 52 ALA H 4.970 . 4.970 4.811 4.368 4.974 0.004 10 0 "[ . 1 . 2 . 3 . 4]" 1 969 1 48 THR H 1 85 PHE QE 5.500 . 5.500 5.422 5.070 5.519 0.019 3 0 "[ . 1 . 2 . 3 . 4]" 1 970 1 48 THR HA 1 48 THR MG 3.330 . 3.330 3.229 3.198 3.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 971 1 48 THR HA 1 49 MET QB 4.560 . 4.560 4.369 4.242 4.510 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 972 1 48 THR HA 1 49 MET ME 3.130 . 3.130 3.114 2.838 3.165 0.035 28 0 "[ . 1 . 2 . 3 . 4]" 1 973 1 48 THR HA 1 50 GLN H 4.600 . 4.600 4.211 4.067 4.413 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 974 1 48 THR HB 1 49 MET H 3.940 . 3.940 3.750 3.608 3.911 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 975 1 48 THR MG 1 49 MET H 3.910 . 3.910 3.783 3.381 3.920 0.010 38 0 "[ . 1 . 2 . 3 . 4]" 1 976 1 48 THR MG 1 49 MET HA 5.060 . 5.060 4.826 4.587 4.956 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 977 1 48 THR MG 1 50 GLN H 3.820 . 3.820 2.982 2.516 3.257 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 978 1 48 THR MG 1 50 GLN HA 4.770 . 4.770 4.679 4.486 4.789 0.019 28 0 "[ . 1 . 2 . 3 . 4]" 1 979 1 48 THR MG 1 50 GLN HB2 4.110 . 4.110 2.640 2.404 2.842 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 980 1 48 THR MG 1 50 GLN QB 3.520 . 3.520 2.604 2.376 2.794 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 981 1 48 THR MG 1 50 GLN HB3 4.110 . 4.110 4.003 3.570 4.164 0.054 12 0 "[ . 1 . 2 . 3 . 4]" 1 982 1 48 THR MG 1 50 GLN QG 4.050 . 4.050 3.764 3.207 4.072 0.022 27 0 "[ . 1 . 2 . 3 . 4]" 1 983 1 48 THR MG 1 51 GLN H 3.750 . 3.750 2.084 1.902 2.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 984 1 48 THR MG 1 51 GLN HA 4.810 . 4.810 4.038 3.745 4.353 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 985 1 48 THR MG 1 51 GLN QB 4.080 . 4.080 2.524 2.044 3.210 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 986 1 48 THR MG 1 51 GLN QE 4.100 . 4.100 3.523 2.237 4.268 0.168 28 0 "[ . 1 . 2 . 3 . 4]" 1 987 1 48 THR MG 1 51 GLN QG 4.210 . 4.210 2.715 1.948 3.889 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 988 1 48 THR MG 1 52 ALA H 4.670 . 4.670 4.080 3.872 4.319 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 989 1 49 MET H 1 49 MET QB 3.730 . 3.730 2.187 2.115 2.268 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 990 1 49 MET H 1 49 MET ME 3.660 . 3.660 2.874 2.801 2.962 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 991 1 49 MET H 1 49 MET HG2 4.210 . 4.210 3.723 3.567 3.842 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 992 1 49 MET H 1 49 MET HG3 4.220 . 4.220 3.738 3.639 3.877 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 993 1 49 MET H 1 50 GLN H 3.950 . 3.950 2.709 2.607 2.812 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 994 1 49 MET HA 1 49 MET ME 3.080 . 3.080 2.249 2.135 2.318 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 995 1 49 MET HA 1 49 MET HG2 3.660 . 3.660 3.662 3.617 3.668 0.008 2 0 "[ . 1 . 2 . 3 . 4]" 1 996 1 49 MET HA 1 49 MET HG3 3.610 . 3.610 2.493 2.439 2.541 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 997 1 49 MET HA 1 52 ALA H 4.630 . 4.630 3.197 2.939 3.388 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 998 1 49 MET HA 1 52 ALA MB 3.190 . 3.190 2.538 2.317 2.767 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 999 1 49 MET QB 1 50 GLN H 3.550 . 3.550 2.787 2.664 2.899 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1000 1 49 MET QB 1 50 GLN HA 4.270 . 4.270 3.975 3.879 4.141 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1001 1 49 MET QB 1 88 MET HG2 3.750 . 3.750 2.252 2.040 2.660 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1002 1 49 MET ME 1 50 GLN H 4.650 . 4.650 4.678 4.657 4.719 0.069 2 0 "[ . 1 . 2 . 3 . 4]" 1 1003 1 49 MET ME 1 52 ALA H 4.740 . 4.740 4.423 4.156 4.616 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1004 1 49 MET ME 1 52 ALA MB 3.450 . 3.450 3.228 2.900 3.453 0.003 21 0 "[ . 1 . 2 . 3 . 4]" 1 1005 1 49 MET ME 1 84 LYS QD 3.770 . 3.770 3.784 3.494 3.845 0.075 40 0 "[ . 1 . 2 . 3 . 4]" 1 1006 1 49 MET ME 1 84 LYS QE 3.280 . 3.280 2.542 2.055 2.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1007 1 49 MET ME 1 84 LYS HG2 4.160 . 4.160 3.731 3.439 4.175 0.015 2 0 "[ . 1 . 2 . 3 . 4]" 1 1008 1 49 MET ME 1 84 LYS HG3 3.000 . 3.000 2.462 2.263 2.719 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1009 1 49 MET ME 1 85 PHE H 4.800 . 4.800 4.365 3.951 4.785 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1010 1 49 MET ME 1 85 PHE HA 3.130 . 3.130 2.732 2.406 3.133 0.003 29 0 "[ . 1 . 2 . 3 . 4]" 1 1011 1 49 MET ME 1 85 PHE QD 3.100 . 3.100 2.247 1.985 2.523 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1012 1 49 MET ME 1 85 PHE QE 3.070 . 3.070 2.777 2.355 3.026 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1013 1 49 MET ME 1 88 MET H 5.450 . 5.450 5.115 4.785 5.434 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1014 1 49 MET ME 1 88 MET HG2 3.880 . 3.880 3.905 3.882 3.946 0.066 12 0 "[ . 1 . 2 . 3 . 4]" 1 1015 1 49 MET HG3 1 52 ALA MB 4.300 . 4.300 3.942 3.603 4.301 0.001 26 0 "[ . 1 . 2 . 3 . 4]" 1 1016 1 49 MET HG3 1 85 PHE QE 5.500 . 5.500 5.237 4.805 5.514 0.014 14 0 "[ . 1 . 2 . 3 . 4]" 1 1017 1 49 MET HG3 1 88 MET HG2 3.890 . 3.890 2.053 1.970 2.118 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1018 1 49 MET HG3 1 89 PHE QD 4.780 . 4.780 4.782 4.007 4.834 0.054 10 0 "[ . 1 . 2 . 3 . 4]" 1 1019 1 49 MET HG3 1 89 PHE QE 5.450 . 5.450 4.412 3.613 4.707 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1020 1 50 GLN H 1 50 GLN HB2 3.660 . 3.660 2.420 2.208 2.683 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1021 1 50 GLN H 1 50 GLN QB 3.120 . 3.120 2.383 2.186 2.616 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1022 1 50 GLN H 1 50 GLN HB3 3.660 . 3.660 3.589 3.520 3.627 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1023 1 50 GLN H 1 50 GLN HG2 3.940 . 3.940 2.740 2.033 3.858 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1024 1 50 GLN H 1 50 GLN QG 3.430 . 3.430 2.562 2.021 3.399 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1025 1 50 GLN H 1 50 GLN HG3 3.940 . 3.940 3.452 2.500 3.941 0.001 17 0 "[ . 1 . 2 . 3 . 4]" 1 1026 1 50 GLN H 1 51 GLN H 3.720 . 3.720 2.653 2.528 2.762 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1027 1 50 GLN H 1 52 ALA H 4.720 . 4.720 3.981 3.854 4.088 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1028 1 50 GLN HA 1 50 GLN HG2 3.820 . 3.820 3.024 2.273 3.755 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1029 1 50 GLN HA 1 50 GLN QG 3.260 . 3.260 2.671 2.238 3.257 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1030 1 50 GLN HA 1 50 GLN HG3 3.820 . 3.820 3.450 2.348 3.820 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1031 1 50 GLN HA 1 53 GLN H 4.420 . 4.420 3.572 3.282 3.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1032 1 50 GLN HA 1 53 GLN QB 5.170 . 5.170 3.619 3.196 3.963 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1033 1 50 GLN HA 1 53 GLN QE 4.580 . 4.580 4.371 3.352 4.589 0.009 31 0 "[ . 1 . 2 . 3 . 4]" 1 1034 1 50 GLN HA 1 53 GLN HG3 4.300 . 4.300 2.904 2.462 3.783 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1035 1 50 GLN QB 1 52 ALA H 5.340 . 5.340 4.574 4.431 4.690 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1036 1 50 GLN HB2 1 51 GLN H 4.200 . 4.200 2.731 2.435 2.944 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1037 1 50 GLN HB3 1 51 GLN H 4.200 . 4.200 3.673 3.177 4.001 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1038 1 50 GLN QE 1 88 MET ME 4.400 . 4.400 3.865 3.112 4.448 0.048 37 0 "[ . 1 . 2 . 3 . 4]" 1 1039 1 50 GLN QG 1 51 GLN H 4.290 . 4.290 4.220 4.007 4.364 0.074 14 0 "[ . 1 . 2 . 3 . 4]" 1 1040 1 51 GLN H 1 51 GLN QB 3.570 . 3.570 2.271 2.061 2.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1041 1 51 GLN H 1 51 GLN QG 4.160 . 4.160 3.093 2.251 4.103 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1042 1 51 GLN H 1 52 ALA H 3.760 . 3.760 2.467 2.391 2.648 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1043 1 51 GLN H 1 52 ALA MB 4.590 . 4.590 4.162 4.085 4.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1044 1 51 GLN HA 1 51 GLN QG 3.660 . 3.660 2.512 2.173 3.047 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1045 1 51 GLN QB 1 52 ALA MB 4.880 . 4.880 3.939 3.785 4.076 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1046 1 51 GLN HB2 1 52 ALA H 4.400 . 4.400 3.151 2.716 3.995 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1047 1 51 GLN HB3 1 52 ALA H 4.400 . 4.400 3.449 2.704 3.843 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1048 1 52 ALA H 1 52 ALA MB 3.100 . 3.100 2.228 2.211 2.242 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1049 1 52 ALA H 1 53 GLN H 3.850 . 3.850 2.702 2.618 2.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1050 1 52 ALA H 1 53 GLN HG3 4.840 . 4.840 4.331 4.151 4.531 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1051 1 52 ALA H 1 54 LYS H 4.810 . 4.810 4.292 4.128 4.534 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1052 1 52 ALA H 1 85 PHE QD 5.360 . 5.360 4.926 4.657 5.216 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1053 1 52 ALA HA 1 55 HIS H 4.260 . 4.260 3.418 3.137 3.620 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1054 1 52 ALA HA 1 58 MET ME 5.450 . 5.450 3.826 3.342 4.158 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1055 1 52 ALA HA 1 59 ILE MD 4.150 . 4.150 3.872 3.589 4.178 0.028 3 0 "[ . 1 . 2 . 3 . 4]" 1 1056 1 52 ALA HA 1 85 PHE QD 5.250 . 5.250 4.891 4.462 5.224 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1057 1 52 ALA MB 1 53 GLN H 3.440 . 3.440 2.811 2.681 2.972 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1058 1 52 ALA MB 1 53 GLN HG2 4.620 . 4.620 4.605 4.491 4.633 0.013 2 0 "[ . 1 . 2 . 3 . 4]" 1 1059 1 52 ALA MB 1 53 GLN HG3 4.260 . 4.260 3.691 3.389 3.907 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1060 1 52 ALA MB 1 54 LYS H 5.200 . 5.200 4.496 4.314 4.635 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1061 1 52 ALA MB 1 55 HIS H 4.650 . 4.650 4.329 4.195 4.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1062 1 52 ALA MB 1 56 THR MG 5.200 . 5.200 4.435 4.204 4.712 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1063 1 52 ALA MB 1 59 ILE MD 3.210 . 3.210 2.351 2.140 2.609 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1064 1 52 ALA MB 1 85 PHE QD 3.650 . 3.650 2.570 2.309 2.887 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1065 1 52 ALA MB 1 85 PHE QE 3.350 . 3.350 2.898 2.531 3.282 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1066 1 52 ALA MB 1 89 PHE QD 4.460 . 4.460 4.158 3.904 4.353 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1067 1 52 ALA MB 1 89 PHE QE 3.330 . 3.330 2.235 2.030 2.423 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1068 1 52 ALA MB 1 89 PHE HZ 3.760 . 3.760 2.627 2.315 2.844 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1069 1 53 GLN H 1 53 GLN HB2 3.700 . 3.700 2.478 2.398 2.536 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1070 1 53 GLN H 1 53 GLN HB3 3.700 . 3.700 3.607 3.587 3.629 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1071 1 53 GLN H 1 53 GLN HG2 3.880 . 3.880 3.500 3.398 3.664 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1072 1 53 GLN H 1 53 GLN HG3 3.630 . 3.630 2.238 2.152 2.344 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1073 1 53 GLN H 1 54 LYS H 3.840 . 3.840 2.681 2.610 2.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1074 1 53 GLN H 1 55 HIS H 4.560 . 4.560 4.032 3.915 4.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1075 1 53 GLN H 1 56 THR MG 5.280 . 5.280 4.788 4.538 5.036 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1076 1 53 GLN H 1 89 PHE QE 4.620 . 4.620 4.158 3.970 4.283 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1077 1 53 GLN H 1 89 PHE HZ 4.790 . 4.790 3.069 2.911 3.298 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1078 1 53 GLN HA 1 53 GLN HG2 3.720 . 3.720 2.598 2.484 2.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1079 1 53 GLN HA 1 53 GLN HG3 3.920 . 3.920 3.041 2.808 3.127 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1080 1 53 GLN HA 1 55 HIS H 4.720 . 4.720 3.699 3.501 4.055 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1081 1 53 GLN HA 1 56 THR MG 3.140 . 3.140 2.562 2.226 2.785 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1082 1 53 GLN HA 1 59 ILE MD 4.810 . 4.810 4.161 3.876 4.504 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1083 1 53 GLN HA 1 89 PHE QE 4.220 . 4.220 2.600 2.219 3.129 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1084 1 53 GLN HA 1 89 PHE HZ 4.170 . 4.170 2.187 2.013 2.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1085 1 53 GLN HA 1 131 ILE MD 4.850 . 4.850 4.034 3.612 4.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1086 1 53 GLN QB 1 53 GLN QE 4.040 . 4.040 2.877 2.442 3.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1087 1 53 GLN QB 1 54 LYS H 3.780 . 3.780 2.731 2.550 3.031 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1088 1 53 GLN QB 1 54 LYS QG 4.290 . 4.290 2.942 2.485 3.439 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1089 1 53 GLN QB 1 56 THR MG 5.150 . 5.150 3.918 3.632 4.107 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1090 1 53 GLN QB 1 89 PHE HZ 4.690 . 4.690 3.877 3.704 4.076 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1091 1 53 GLN HB2 1 54 LYS H 4.390 . 4.390 2.803 2.601 3.133 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1092 1 53 GLN HB2 1 89 PHE QE 5.430 . 5.430 4.679 4.505 4.949 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1093 1 53 GLN HB3 1 54 LYS H 4.390 . 4.390 3.781 3.610 4.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1094 1 53 GLN HB3 1 89 PHE QE 5.430 . 5.430 3.775 3.560 4.363 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1095 1 53 GLN QE 1 53 GLN HG2 3.370 . 3.370 2.220 2.119 2.373 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1096 1 53 GLN QE 1 88 MET ME 3.350 . 3.350 3.066 1.969 3.385 0.035 31 0 "[ . 1 . 2 . 3 . 4]" 1 1097 1 53 GLN HE21 1 88 MET ME 3.890 . 3.890 3.732 2.856 3.904 0.014 32 0 "[ . 1 . 2 . 3 . 4]" 1 1098 1 53 GLN HE22 1 53 GLN HG2 4.020 . 4.020 2.245 2.138 2.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1099 1 53 GLN HE22 1 88 MET ME 3.890 . 3.890 3.288 1.978 3.770 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1100 1 53 GLN HG2 1 54 LYS H 5.200 . 5.200 5.112 5.008 5.202 0.002 1 0 "[ . 1 . 2 . 3 . 4]" 1 1101 1 53 GLN HG2 1 56 THR MG 5.100 . 5.100 4.359 3.881 4.710 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1102 1 53 GLN HG2 1 88 MET ME 3.510 . 3.510 2.724 2.434 3.059 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1103 1 53 GLN HG2 1 89 PHE QE 4.370 . 4.370 2.304 2.041 3.103 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1104 1 53 GLN HG2 1 89 PHE HZ 4.730 . 4.730 3.026 2.652 3.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1105 1 53 GLN HG2 1 131 ILE MD 5.420 . 5.420 4.146 3.353 4.726 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1106 1 53 GLN HG3 1 54 LYS H 4.650 . 4.650 4.419 4.233 4.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1107 1 53 GLN HG3 1 88 MET ME 3.930 . 3.930 2.590 2.289 2.874 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1108 1 53 GLN HG3 1 89 PHE QE 4.280 . 4.280 3.522 3.191 4.002 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1109 1 53 GLN HG3 1 89 PHE HZ 4.620 . 4.620 3.067 2.579 3.503 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1110 1 54 LYS H 1 54 LYS QB 3.310 . 3.310 2.512 2.368 2.694 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1111 1 54 LYS H 1 54 LYS HG2 4.060 . 4.060 3.142 2.114 3.620 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1112 1 54 LYS H 1 54 LYS QG 3.490 . 3.490 2.221 1.864 2.697 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1113 1 54 LYS H 1 54 LYS HG3 4.060 . 4.060 2.569 1.894 4.068 0.008 1 0 "[ . 1 . 2 . 3 . 4]" 1 1114 1 54 LYS H 1 55 HIS H 3.410 . 3.410 2.500 2.192 2.693 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1115 1 54 LYS H 1 56 THR H 4.930 . 4.930 4.742 4.467 4.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1116 1 54 LYS H 1 56 THR MG 4.870 . 4.870 4.631 4.261 4.875 0.005 30 0 "[ . 1 . 2 . 3 . 4]" 1 1117 1 54 LYS HA 1 54 LYS QG 3.460 . 3.460 2.659 2.393 3.287 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1118 1 54 LYS HA 1 56 THR H 4.710 . 4.710 4.036 3.492 4.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1119 1 54 LYS QB 1 54 LYS QE 4.090 . 4.090 3.298 1.998 3.793 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1120 1 54 LYS QB 1 55 HIS H 3.810 . 3.810 3.374 2.870 3.710 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1121 1 54 LYS QB 1 55 HIS HD2 4.670 . 4.670 3.111 2.472 4.089 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1122 1 54 LYS QB 1 56 THR H 5.080 . 5.080 5.040 4.756 5.110 0.030 6 0 "[ . 1 . 2 . 3 . 4]" 1 1123 1 54 LYS QE 1 54 LYS QG 3.500 . 3.500 2.219 2.042 2.588 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1124 1 54 LYS QG 1 55 HIS H 4.560 . 4.560 4.246 3.912 4.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1125 1 55 HIS H 1 55 HIS HB2 4.070 . 4.070 2.744 2.479 2.836 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1126 1 55 HIS H 1 55 HIS HB3 4.070 . 4.070 3.844 3.576 3.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1127 1 55 HIS H 1 55 HIS HD2 4.320 . 4.320 3.782 3.517 4.377 0.057 4 0 "[ . 1 . 2 . 3 . 4]" 1 1128 1 55 HIS H 1 56 THR H 3.770 . 3.770 2.629 2.439 3.160 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1129 1 55 HIS H 1 56 THR MG 4.290 . 4.290 3.520 3.044 4.237 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1130 1 55 HIS H 1 58 MET ME 5.500 . 5.500 4.985 4.767 5.217 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1131 1 55 HIS H 1 59 ILE MD 5.130 . 5.130 4.535 4.300 4.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1132 1 55 HIS HA 1 56 THR MG 5.090 . 5.090 4.849 4.713 5.075 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1133 1 55 HIS HA 1 57 GLU H 4.830 . 4.830 3.156 2.906 3.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1134 1 55 HIS HA 1 58 MET ME 5.200 . 5.200 4.570 4.350 4.838 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1135 1 55 HIS QB 1 58 MET ME 3.270 . 3.270 2.234 2.057 2.443 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1136 1 55 HIS HB2 1 58 MET ME 3.820 . 3.820 2.678 2.403 3.046 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1137 1 55 HIS HB3 1 58 MET ME 3.820 . 3.820 2.423 2.112 2.889 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1138 1 55 HIS HD2 1 58 MET ME 5.250 . 5.250 4.183 3.653 4.912 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1139 1 56 THR H 1 56 THR HB 4.200 . 4.200 3.568 3.429 3.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1140 1 56 THR H 1 56 THR MG 3.030 . 3.030 2.451 2.324 2.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1141 1 56 THR H 1 57 GLU H 3.960 . 3.960 2.603 2.470 2.898 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1142 1 56 THR H 1 59 ILE MD 4.560 . 4.560 4.384 4.253 4.564 0.004 21 0 "[ . 1 . 2 . 3 . 4]" 1 1143 1 56 THR HA 1 56 THR MG 3.070 . 3.070 2.296 2.221 2.379 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1144 1 56 THR HA 1 59 ILE H 4.550 . 4.550 3.104 2.969 3.283 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1145 1 56 THR HA 1 59 ILE HB 4.460 . 4.460 2.900 2.693 3.190 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1146 1 56 THR HA 1 59 ILE MD 3.450 . 3.450 2.205 2.095 2.361 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1147 1 56 THR HA 1 59 ILE QG 4.390 . 4.390 2.669 2.487 2.843 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1148 1 56 THR HA 1 59 ILE MG 4.590 . 4.590 4.230 4.087 4.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1149 1 56 THR HA 1 134 ILE MD 4.170 . 4.170 3.429 3.127 3.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1150 1 56 THR HB 1 59 ILE MD 4.110 . 4.110 3.816 3.623 4.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1151 1 56 THR HB 1 131 ILE MD 4.720 . 4.720 3.765 3.354 4.424 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1152 1 56 THR HB 1 134 ILE MD 3.650 . 3.650 2.827 2.475 3.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1153 1 56 THR HB 1 134 ILE MG 4.050 . 4.050 2.491 1.992 3.693 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1154 1 56 THR MG 1 57 GLU H 4.410 . 4.410 4.118 3.992 4.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1155 1 56 THR MG 1 59 ILE H 5.230 . 5.230 4.882 4.709 5.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1156 1 56 THR MG 1 59 ILE HB 4.400 . 4.400 4.022 3.793 4.315 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1157 1 56 THR MG 1 59 ILE MD 3.260 . 3.260 2.534 2.273 2.802 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1158 1 56 THR MG 1 59 ILE MG 4.900 . 4.900 4.475 4.253 4.783 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1159 1 56 THR MG 1 88 MET ME 5.080 . 5.080 5.061 4.638 5.176 0.096 16 0 "[ . 1 . 2 . 3 . 4]" 1 1160 1 56 THR MG 1 89 PHE QD 5.050 . 5.050 4.198 3.480 4.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1161 1 56 THR MG 1 89 PHE QE 3.610 . 3.610 3.073 2.019 3.428 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1162 1 56 THR MG 1 89 PHE HZ 3.980 . 3.980 3.335 2.653 3.564 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1163 1 56 THR MG 1 127 GLU QG 5.500 . 5.500 5.280 4.451 5.597 0.097 6 0 "[ . 1 . 2 . 3 . 4]" 1 1164 1 56 THR MG 1 131 ILE MD 3.440 . 3.440 2.281 2.045 2.802 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1165 1 56 THR MG 1 134 ILE MD 3.100 . 3.100 2.490 2.187 2.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1166 1 56 THR MG 1 135 PHE QE 5.500 . 5.500 5.426 5.193 5.559 0.059 35 0 "[ . 1 . 2 . 3 . 4]" 1 1167 1 57 GLU H 1 57 GLU QB 3.640 . 3.640 2.270 1.972 2.932 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1168 1 57 GLU H 1 57 GLU HG2 4.810 . 4.810 4.005 2.133 4.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1169 1 57 GLU H 1 57 GLU QG 4.100 . 4.100 3.445 1.655 4.110 0.010 16 0 "[ . 1 . 2 . 3 . 4]" 1 1170 1 57 GLU H 1 57 GLU HG3 4.810 . 4.810 3.835 1.662 4.560 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1171 1 57 GLU H 1 58 MET H 4.100 . 4.100 2.742 2.608 2.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1172 1 57 GLU HA 1 57 GLU QG 3.680 . 3.680 2.921 2.451 3.536 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1173 1 57 GLU HA 1 60 THR H 4.150 . 4.150 3.400 2.912 3.755 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1174 1 57 GLU QB 1 58 MET H 3.670 . 3.670 2.857 2.452 3.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1175 1 57 GLU QG 1 58 MET H 4.260 . 4.260 3.486 1.874 4.118 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1176 1 58 MET H 1 58 MET HB2 3.930 . 3.930 2.540 2.464 2.642 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1177 1 58 MET H 1 58 MET QB 3.350 . 3.350 2.215 2.167 2.268 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1178 1 58 MET H 1 58 MET HB3 3.930 . 3.930 2.440 2.340 2.536 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1179 1 58 MET H 1 58 MET ME 4.420 . 4.420 3.999 3.757 4.206 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1180 1 58 MET H 1 58 MET QG 4.160 . 4.160 3.985 3.958 4.014 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1181 1 58 MET H 1 59 ILE H 4.020 . 4.020 2.488 2.394 2.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1182 1 58 MET H 1 59 ILE HB 5.050 . 5.050 4.865 4.692 5.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1183 1 58 MET H 1 60 THR H 4.530 . 4.530 4.067 3.941 4.232 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1184 1 58 MET HA 1 58 MET ME 4.580 . 4.580 4.444 4.253 4.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1185 1 58 MET HA 1 58 MET QG 3.850 . 3.850 2.458 2.414 2.566 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1186 1 58 MET HA 1 61 THR H 4.790 . 4.790 3.213 3.040 3.543 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1187 1 58 MET HA 1 61 THR MG 4.900 . 4.900 3.987 3.487 4.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1188 1 58 MET QB 1 58 MET ME 3.410 . 3.410 2.024 1.973 2.101 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1189 1 58 MET ME 1 58 MET QG 3.370 . 3.370 2.441 2.301 2.570 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1190 1 58 MET ME 1 59 ILE H 4.180 . 4.180 4.202 4.183 4.237 0.057 5 0 "[ . 1 . 2 . 3 . 4]" 1 1191 1 58 MET ME 1 59 ILE MD 5.050 . 5.050 4.427 4.198 4.625 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1192 1 58 MET ME 1 62 LEU QD 3.980 . 3.980 3.299 2.873 4.007 0.027 20 0 "[ . 1 . 2 . 3 . 4]" 1 1193 1 58 MET ME 1 85 PHE QD 5.150 . 5.150 4.366 3.771 4.963 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1194 1 58 MET ME 1 85 PHE QE 4.010 . 4.010 3.001 2.475 3.750 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1195 1 58 MET ME 1 85 PHE HZ 4.590 . 4.590 3.297 2.900 3.771 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1196 1 58 MET QG 1 59 ILE H 3.930 . 3.930 3.884 3.811 3.933 0.003 8 0 "[ . 1 . 2 . 3 . 4]" 1 1197 1 58 MET QG 1 59 ILE MD 5.500 . 5.500 5.506 5.406 5.593 0.093 6 0 "[ . 1 . 2 . 3 . 4]" 1 1198 1 58 MET QG 1 61 THR H 4.790 . 4.790 4.625 4.457 4.793 0.003 36 0 "[ . 1 . 2 . 3 . 4]" 1 1199 1 58 MET QG 1 62 LEU MD1 4.330 . 4.330 2.803 2.175 3.278 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1200 1 58 MET QG 1 62 LEU QD 3.620 . 3.620 2.640 2.106 3.087 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1201 1 58 MET QG 1 62 LEU MD2 4.330 . 4.330 3.286 2.466 3.908 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1202 1 58 MET QG 1 85 PHE QE 5.460 . 5.460 4.217 3.708 4.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1203 1 59 ILE H 1 59 ILE HB 4.160 . 4.160 2.606 2.503 2.681 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1204 1 59 ILE H 1 59 ILE MD 3.990 . 3.990 3.579 3.452 3.646 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1205 1 59 ILE H 1 59 ILE HG12 4.420 . 4.420 3.409 3.263 3.569 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1206 1 59 ILE H 1 59 ILE QG 3.870 . 3.870 2.082 1.928 2.206 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1207 1 59 ILE H 1 59 ILE HG13 4.420 . 4.420 2.101 1.942 2.228 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1208 1 59 ILE H 1 59 ILE MG 4.090 . 4.090 3.835 3.792 3.860 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1209 1 59 ILE H 1 60 THR H 3.920 . 3.920 2.597 2.519 2.687 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1210 1 59 ILE H 1 61 THR H 5.040 . 5.040 4.105 3.889 4.297 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1211 1 59 ILE H 1 62 LEU QD 4.740 . 4.740 4.110 3.778 4.340 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1212 1 59 ILE HA 1 59 ILE MD 4.030 . 4.030 3.909 3.875 3.944 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1213 1 59 ILE HA 1 59 ILE MG 3.480 . 3.480 2.391 2.359 2.428 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1214 1 59 ILE HA 1 62 LEU H 4.380 . 4.380 3.067 2.896 3.209 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1215 1 59 ILE HA 1 62 LEU MD1 4.500 . 4.500 2.755 2.021 3.849 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1216 1 59 ILE HA 1 62 LEU QD 3.620 . 3.620 2.129 2.018 2.365 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1217 1 59 ILE HA 1 62 LEU MD2 4.500 . 4.500 3.484 2.080 4.538 0.038 16 0 "[ . 1 . 2 . 3 . 4]" 1 1218 1 59 ILE HB 1 59 ILE MD 3.360 . 3.360 2.405 2.370 2.432 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1219 1 59 ILE HB 1 60 THR H 4.140 . 4.140 2.835 2.694 2.941 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1220 1 59 ILE HB 1 134 ILE MD 4.040 . 4.040 2.649 2.469 3.032 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1221 1 59 ILE HB 1 134 ILE MG 4.200 . 4.200 2.698 2.288 3.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1222 1 59 ILE MD 1 59 ILE MG 2.900 . 2.900 2.123 2.097 2.146 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1223 1 59 ILE MD 1 60 THR H 4.720 . 4.720 4.713 4.598 4.749 0.029 6 0 "[ . 1 . 2 . 3 . 4]" 1 1224 1 59 ILE MD 1 62 LEU QD 4.370 . 4.370 4.198 3.995 4.414 0.044 4 0 "[ . 1 . 2 . 3 . 4]" 1 1225 1 59 ILE MD 1 85 PHE H 5.380 . 5.380 5.156 5.007 5.389 0.009 23 0 "[ . 1 . 2 . 3 . 4]" 1 1226 1 59 ILE MD 1 85 PHE HA 4.530 . 4.530 4.516 4.385 4.554 0.024 12 0 "[ . 1 . 2 . 3 . 4]" 1 1227 1 59 ILE MD 1 85 PHE QB 3.780 . 3.780 2.338 2.242 2.381 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1228 1 59 ILE MD 1 85 PHE QD 3.700 . 3.700 3.443 3.186 3.707 0.007 8 0 "[ . 1 . 2 . 3 . 4]" 1 1229 1 59 ILE MD 1 85 PHE QE 5.500 . 5.500 4.645 4.378 4.948 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1230 1 59 ILE MD 1 86 LYS H 4.810 . 4.810 4.622 4.432 4.818 0.008 16 0 "[ . 1 . 2 . 3 . 4]" 1 1231 1 59 ILE MD 1 88 MET ME 5.470 . 5.470 4.810 4.425 5.214 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1232 1 59 ILE MD 1 89 PHE QD 4.060 . 4.060 3.470 3.093 3.826 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1233 1 59 ILE MD 1 89 PHE QE 3.170 . 3.170 2.640 2.352 2.863 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1234 1 59 ILE MD 1 89 PHE HZ 3.710 . 3.710 3.121 2.625 3.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1235 1 59 ILE MD 1 134 ILE MG 4.450 . 4.450 3.671 3.120 4.211 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1236 1 59 ILE MD 1 135 PHE QE 4.220 . 4.220 3.403 3.072 3.822 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1237 1 59 ILE MD 1 135 PHE HZ 4.590 . 4.590 3.823 3.597 4.499 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1238 1 59 ILE QG 1 60 THR H 4.960 . 4.960 4.048 3.992 4.127 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1239 1 59 ILE HG12 1 59 ILE MG 3.750 . 3.750 2.374 2.339 2.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1240 1 59 ILE HG13 1 59 ILE MG 3.750 . 3.750 3.240 3.228 3.249 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1241 1 59 ILE MG 1 60 THR H 3.980 . 3.980 3.723 3.551 3.873 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1242 1 59 ILE MG 1 60 THR HA 4.460 . 4.460 3.825 3.685 3.978 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1243 1 59 ILE MG 1 60 THR MG 5.380 . 5.380 4.950 4.689 5.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1244 1 59 ILE MG 1 62 LEU H 4.560 . 4.560 4.420 4.244 4.564 0.004 3 0 "[ . 1 . 2 . 3 . 4]" 1 1245 1 59 ILE MG 1 62 LEU QB 4.900 . 4.900 3.137 2.880 3.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1246 1 59 ILE MG 1 63 LYS H 4.640 . 4.640 3.869 3.619 4.126 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1247 1 59 ILE MG 1 82 TYR HA 4.760 . 4.760 3.151 2.805 3.451 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1248 1 59 ILE MG 1 82 TYR QB 4.500 . 4.500 4.161 3.832 4.502 0.002 23 0 "[ . 1 . 2 . 3 . 4]" 1 1249 1 59 ILE MG 1 82 TYR QD 3.550 . 3.550 2.517 2.225 2.819 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1250 1 59 ILE MG 1 82 TYR QE 3.360 . 3.360 2.677 2.234 3.286 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1251 1 59 ILE MG 1 85 PHE H 5.500 . 5.500 5.067 4.923 5.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1252 1 59 ILE MG 1 85 PHE QB 4.800 . 4.800 3.074 2.887 3.229 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1253 1 59 ILE MG 1 85 PHE QD 4.090 . 4.090 3.278 2.906 3.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1254 1 59 ILE MG 1 89 PHE QD 4.970 . 4.970 4.682 4.268 4.990 0.020 25 0 "[ . 1 . 2 . 3 . 4]" 1 1255 1 59 ILE MG 1 134 ILE HB 4.460 . 4.460 2.387 2.170 2.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1256 1 59 ILE MG 1 134 ILE MD 3.420 . 3.420 2.250 2.104 2.593 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1257 1 59 ILE MG 1 134 ILE MG 3.640 . 3.640 3.407 3.101 3.820 0.180 28 0 "[ . 1 . 2 . 3 . 4]" 1 1258 1 59 ILE MG 1 135 PHE H 5.500 . 5.500 5.117 4.916 5.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1259 1 59 ILE MG 1 135 PHE QD 4.330 . 4.330 3.239 2.950 3.648 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1260 1 59 ILE MG 1 135 PHE QE 3.360 . 3.360 2.115 1.894 2.709 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1261 1 59 ILE MG 1 135 PHE HZ 4.920 . 4.920 3.765 3.334 4.401 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1262 1 60 THR H 1 60 THR HB 3.670 . 3.670 3.010 2.779 3.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1263 1 60 THR H 1 60 THR MG 3.760 . 3.760 3.634 3.514 3.766 0.006 40 0 "[ . 1 . 2 . 3 . 4]" 1 1264 1 60 THR H 1 61 THR H 3.840 . 3.840 2.755 2.673 2.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1265 1 60 THR H 1 134 ILE HB 4.780 . 4.780 3.817 3.398 4.437 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1266 1 60 THR H 1 134 ILE MD 5.250 . 5.250 4.579 4.340 4.954 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1267 1 60 THR H 1 134 ILE MG 4.100 . 4.100 2.853 2.488 3.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1268 1 60 THR HA 1 60 THR MG 2.990 . 2.990 2.227 2.193 2.303 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1269 1 60 THR HA 1 63 LYS H 4.550 . 4.550 3.397 2.966 3.582 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1270 1 60 THR HA 1 63 LYS QB 4.730 . 4.730 2.739 2.325 3.338 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1271 1 60 THR HB 1 61 THR H 4.120 . 4.120 2.567 2.419 2.754 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1272 1 60 THR MG 1 61 THR H 4.080 . 4.080 3.943 3.727 4.084 0.004 23 0 "[ . 1 . 2 . 3 . 4]" 1 1273 1 60 THR MG 1 63 LYS H 5.500 . 5.500 4.733 4.376 4.972 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1274 1 60 THR MG 1 63 LYS QB 4.460 . 4.460 3.523 2.908 4.389 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1275 1 60 THR MG 1 64 LYS H 5.210 . 5.210 4.358 3.949 4.622 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1276 1 60 THR MG 1 64 LYS HD2 5.500 . 5.500 3.843 3.305 4.511 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1277 1 60 THR MG 1 64 LYS QD 4.630 . 4.630 3.687 3.233 4.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1278 1 60 THR MG 1 64 LYS HD3 5.500 . 5.500 4.777 4.548 5.101 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1279 1 60 THR MG 1 64 LYS HE2 3.560 . 3.560 2.602 2.022 3.577 0.017 3 0 "[ . 1 . 2 . 3 . 4]" 1 1280 1 60 THR MG 1 64 LYS QE 3.070 . 3.070 2.233 2.006 2.527 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1281 1 60 THR MG 1 64 LYS HE3 3.560 . 3.560 3.190 2.071 3.578 0.018 28 0 "[ . 1 . 2 . 3 . 4]" 1 1282 1 60 THR MG 1 134 ILE H 5.230 . 5.230 4.397 4.040 4.943 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1283 1 60 THR MG 1 134 ILE HA 4.120 . 4.120 2.508 1.942 3.564 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1284 1 60 THR MG 1 134 ILE HB 4.560 . 4.560 4.050 3.419 4.575 0.015 20 0 "[ . 1 . 2 . 3 . 4]" 1 1285 1 60 THR MG 1 134 ILE MG 3.300 . 3.300 2.548 2.159 3.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1286 1 61 THR H 1 61 THR HB 3.990 . 3.990 2.307 2.192 2.566 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1287 1 61 THR H 1 61 THR HG1 4.370 . 4.370 3.109 2.048 3.597 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1288 1 61 THR H 1 61 THR MG 4.050 . 4.050 3.730 3.651 3.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1289 1 61 THR HA 1 61 THR MG 3.320 . 3.320 2.589 2.420 2.715 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1290 1 61 THR HA 1 63 LYS H 5.100 . 5.100 4.354 4.206 4.517 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1291 1 61 THR HA 1 64 LYS H 4.310 . 4.310 3.277 3.041 3.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1292 1 61 THR HA 1 64 LYS QB 3.940 . 3.940 2.507 2.233 2.802 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1293 1 61 THR HA 1 64 LYS QD 4.280 . 4.280 2.391 1.975 2.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1294 1 61 THR HA 1 64 LYS QG 5.200 . 5.200 3.434 2.785 3.894 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1295 1 61 THR HB 1 62 LEU H 4.150 . 4.150 2.834 2.623 3.015 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1296 1 61 THR HB 1 149 PHE HZ 4.830 . 4.830 4.417 4.072 4.834 0.004 23 0 "[ . 1 . 2 . 3 . 4]" 1 1297 1 61 THR HG1 1 65 ILE MG 5.500 . 5.500 5.292 4.368 5.518 0.018 28 0 "[ . 1 . 2 . 3 . 4]" 1 1298 1 61 THR MG 1 62 LEU H 4.300 . 4.300 3.166 2.977 3.516 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1299 1 61 THR MG 1 62 LEU QD 4.140 . 4.140 3.011 2.346 3.634 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1300 1 61 THR MG 1 64 LYS H 5.170 . 5.170 4.581 4.466 4.802 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1301 1 61 THR MG 1 64 LYS QB 4.780 . 4.780 3.558 3.193 3.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1302 1 61 THR MG 1 64 LYS HD2 5.500 . 5.500 4.192 3.441 4.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1303 1 61 THR MG 1 64 LYS QD 4.830 . 4.830 4.022 3.356 4.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1304 1 61 THR MG 1 64 LYS HD3 5.500 . 5.500 5.192 4.637 5.519 0.019 6 0 "[ . 1 . 2 . 3 . 4]" 1 1305 1 61 THR MG 1 65 ILE H 4.400 . 4.400 3.752 3.591 4.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1306 1 61 THR MG 1 65 ILE MD 3.610 . 3.610 2.693 2.525 3.006 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1307 1 61 THR MG 1 65 ILE MG 3.300 . 3.300 2.332 2.093 2.686 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1308 1 61 THR MG 1 149 PHE QD 4.830 . 4.830 4.718 4.382 4.873 0.043 2 0 "[ . 1 . 2 . 3 . 4]" 1 1309 1 61 THR MG 1 149 PHE QE 3.640 . 3.640 3.036 2.513 3.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1310 1 61 THR MG 1 149 PHE HZ 3.520 . 3.520 2.049 1.973 2.143 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1311 1 62 LEU H 1 62 LEU QB 3.660 . 3.660 2.297 2.064 2.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1312 1 62 LEU H 1 62 LEU MD1 3.870 . 3.870 3.082 2.423 3.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1313 1 62 LEU H 1 62 LEU QD 3.160 . 3.160 2.850 2.346 3.199 0.039 5 0 "[ . 1 . 2 . 3 . 4]" 1 1314 1 62 LEU H 1 62 LEU MD2 3.870 . 3.870 3.477 3.111 3.715 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1315 1 62 LEU H 1 62 LEU HG 4.160 . 4.160 3.162 2.358 4.190 0.030 3 0 "[ . 1 . 2 . 3 . 4]" 1 1316 1 62 LEU H 1 63 LYS H 4.200 . 4.200 2.764 2.697 2.895 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1317 1 62 LEU H 1 65 ILE MD 4.930 . 4.930 4.762 4.578 4.935 0.005 32 0 "[ . 1 . 2 . 3 . 4]" 1 1318 1 62 LEU HA 1 62 LEU QD 4.110 . 4.110 2.127 2.072 2.216 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1319 1 62 LEU QD 1 63 LYS H 5.440 . 5.440 4.094 3.912 4.200 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1320 1 62 LEU QD 1 81 LEU HA 4.910 . 4.910 3.987 3.705 4.224 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1321 1 62 LEU QD 1 81 LEU QB 3.900 . 3.900 2.018 1.858 2.138 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1322 1 62 LEU QD 1 82 TYR H 4.210 . 4.210 3.004 2.722 3.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1323 1 62 LEU QD 1 82 TYR HA 3.640 . 3.640 2.495 2.288 2.806 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1324 1 62 LEU QD 1 82 TYR QB 4.710 . 4.710 2.999 2.684 3.335 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1325 1 62 LEU QD 1 82 TYR QD 4.410 . 4.410 3.390 3.032 3.865 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1326 1 62 LEU QD 1 83 ASN H 5.090 . 5.090 4.872 4.663 5.110 0.020 4 0 "[ . 1 . 2 . 3 . 4]" 1 1327 1 62 LEU QD 1 85 PHE QD 3.630 . 3.630 2.487 2.220 2.828 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1328 1 62 LEU QD 1 85 PHE QE 3.480 . 3.480 2.267 2.063 2.707 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1329 1 62 LEU MD1 1 82 TYR H 5.080 . 5.080 3.863 2.827 5.106 0.026 6 0 "[ . 1 . 2 . 3 . 4]" 1 1330 1 62 LEU MD2 1 82 TYR H 5.080 . 5.080 3.383 2.959 3.797 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1331 1 63 LYS H 1 63 LYS HG2 4.920 . 4.920 4.460 3.043 4.610 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1332 1 63 LYS H 1 63 LYS QG 4.290 . 4.290 3.968 2.955 4.084 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1333 1 63 LYS H 1 63 LYS HG3 4.920 . 4.920 4.463 4.008 4.628 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1334 1 63 LYS H 1 64 LYS H 4.280 . 4.280 2.691 2.571 2.835 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1335 1 63 LYS H 1 82 TYR QD 4.940 . 4.940 3.415 3.064 3.771 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1336 1 63 LYS H 1 82 TYR QE 4.880 . 4.880 3.889 3.260 4.551 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1337 1 63 LYS HA 1 66 ARG H 4.590 . 4.590 3.762 3.364 4.090 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1338 1 63 LYS HA 1 66 ARG QB 4.960 . 4.960 2.687 2.231 3.169 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1339 1 63 LYS HA 1 82 TYR QE 5.100 . 5.100 3.702 3.184 4.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1340 1 63 LYS QB 1 82 TYR QE 4.500 . 4.500 2.344 2.089 3.111 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1341 1 63 LYS HB2 1 64 LYS H 4.480 . 4.480 3.840 3.656 4.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1342 1 63 LYS HB3 1 64 LYS H 4.480 . 4.480 2.560 2.309 3.731 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1343 1 64 LYS H 1 64 LYS HB2 4.060 . 4.060 2.373 2.251 2.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1344 1 64 LYS H 1 64 LYS QB 3.500 . 3.500 2.340 2.226 2.496 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1345 1 64 LYS H 1 64 LYS HB3 4.060 . 4.060 3.573 3.518 3.645 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1346 1 64 LYS H 1 64 LYS QD 4.840 . 4.840 3.655 3.507 3.855 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1347 1 64 LYS H 1 64 LYS HG2 4.370 . 4.370 3.644 3.448 3.790 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1348 1 64 LYS H 1 64 LYS QG 3.820 . 3.820 2.334 2.229 2.493 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1349 1 64 LYS H 1 64 LYS HG3 4.370 . 4.370 2.362 2.251 2.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1350 1 64 LYS H 1 65 ILE H 3.760 . 3.760 2.816 2.677 2.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1351 1 64 LYS H 1 65 ILE QG 5.240 . 5.240 4.315 4.168 4.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1352 1 64 LYS HA 1 64 LYS HG2 4.090 . 4.090 2.552 2.309 2.713 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1353 1 64 LYS HA 1 64 LYS QG 3.530 . 3.530 2.395 2.223 2.517 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1354 1 64 LYS HA 1 64 LYS HG3 4.090 . 4.090 2.913 2.780 3.076 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1355 1 64 LYS QB 1 64 LYS QD 3.130 . 3.130 2.092 2.041 2.141 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1356 1 64 LYS QB 1 65 ILE H 3.930 . 3.930 2.548 2.459 2.681 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1357 1 64 LYS QB 1 65 ILE MG 3.910 . 3.910 2.870 2.679 3.080 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1358 1 64 LYS QB 1 146 PHE QD 5.080 . 5.080 2.940 2.728 3.268 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1359 1 64 LYS QB 1 146 PHE QE 4.560 . 4.560 3.329 2.992 3.883 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1360 1 64 LYS QB 1 149 PHE HZ 5.340 . 5.340 3.426 2.966 4.138 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1361 1 64 LYS HB2 1 65 ILE H 4.490 . 4.490 2.618 2.511 2.775 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1362 1 64 LYS HB2 1 65 ILE MG 4.630 . 4.630 3.034 2.795 3.279 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1363 1 64 LYS HB3 1 65 ILE H 4.490 . 4.490 3.498 3.391 3.615 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1364 1 64 LYS HB3 1 65 ILE MG 4.630 . 4.630 3.544 3.249 3.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1365 1 64 LYS QD 1 146 PHE QD 5.340 . 5.340 3.141 2.511 4.237 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1366 1 64 LYS QD 1 146 PHE QE 4.150 . 4.150 2.990 2.589 3.820 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1367 1 64 LYS QD 1 149 PHE HZ 5.190 . 5.190 3.449 2.691 3.883 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1368 1 64 LYS HD2 1 65 ILE H 5.500 . 5.500 4.931 4.671 5.195 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1369 1 64 LYS HD2 1 146 PHE QE 4.770 . 4.770 4.286 3.902 4.774 0.004 31 0 "[ . 1 . 2 . 3 . 4]" 1 1370 1 64 LYS HD2 1 149 PHE QD 5.500 . 5.500 5.010 4.437 5.507 0.007 16 0 "[ . 1 . 2 . 3 . 4]" 1 1371 1 64 LYS HD2 1 149 PHE QE 4.600 . 4.600 2.961 2.297 3.594 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1372 1 64 LYS HD3 1 65 ILE H 5.500 . 5.500 5.509 5.471 5.530 0.030 20 0 "[ . 1 . 2 . 3 . 4]" 1 1373 1 64 LYS HD3 1 146 PHE QE 4.770 . 4.770 3.059 2.616 4.018 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1374 1 64 LYS HD3 1 149 PHE QD 5.500 . 5.500 4.665 3.699 5.501 0.001 35 0 "[ . 1 . 2 . 3 . 4]" 1 1375 1 64 LYS HD3 1 149 PHE QE 4.600 . 4.600 3.295 2.200 4.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1376 1 64 LYS QE 1 64 LYS QG 2.980 . 2.980 2.302 2.047 2.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1377 1 64 LYS QE 1 146 PHE QD 5.340 . 5.340 4.578 3.770 5.371 0.031 5 0 "[ . 1 . 2 . 3 . 4]" 1 1378 1 64 LYS QE 1 146 PHE QE 5.340 . 5.340 4.540 3.787 5.356 0.016 31 0 "[ . 1 . 2 . 3 . 4]" 1 1379 1 64 LYS QE 1 149 PHE QE 5.340 . 5.340 3.871 3.151 4.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1380 1 64 LYS QE 1 149 PHE HZ 5.340 . 5.340 5.250 4.625 5.364 0.024 3 0 "[ . 1 . 2 . 3 . 4]" 1 1381 1 64 LYS QG 1 65 ILE H 4.970 . 4.970 4.227 4.145 4.312 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1382 1 65 ILE H 1 65 ILE MD 3.870 . 3.870 3.812 3.736 3.873 0.003 33 0 "[ . 1 . 2 . 3 . 4]" 1 1383 1 65 ILE H 1 65 ILE HG12 4.470 . 4.470 2.205 2.128 2.271 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1384 1 65 ILE H 1 65 ILE QG 3.680 . 3.680 2.168 2.096 2.232 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1385 1 65 ILE H 1 65 ILE HG13 4.470 . 4.470 3.214 2.963 3.337 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1386 1 65 ILE H 1 65 ILE MG 3.260 . 3.260 2.369 2.295 2.448 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1387 1 65 ILE H 1 66 ARG H 3.270 . 3.270 2.484 2.366 2.631 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1388 1 65 ILE H 1 66 ARG HA 4.850 . 4.850 4.879 4.860 4.907 0.057 3 0 "[ . 1 . 2 . 3 . 4]" 1 1389 1 65 ILE H 1 67 ARG H 4.930 . 4.930 4.238 3.981 4.537 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1390 1 65 ILE H 1 74 ILE MG 5.500 . 5.500 5.248 4.982 5.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1391 1 65 ILE HA 1 65 ILE MG 3.410 . 3.410 2.380 2.339 2.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1392 1 65 ILE HA 1 67 ARG H 4.500 . 4.500 3.184 2.942 3.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1393 1 65 ILE HA 1 68 PHE H 4.500 . 4.500 3.170 2.893 3.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1394 1 65 ILE HB 1 65 ILE MD 3.530 . 3.530 2.399 2.326 2.440 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1395 1 65 ILE HB 1 74 ILE MG 3.860 . 3.860 2.449 2.209 2.641 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1396 1 65 ILE MD 1 66 ARG H 5.110 . 5.110 4.782 4.530 4.976 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1397 1 65 ILE MD 1 68 PHE QB 5.220 . 5.220 4.266 4.045 4.575 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1398 1 65 ILE MD 1 74 ILE HA 5.500 . 5.500 4.465 4.269 4.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1399 1 65 ILE MD 1 74 ILE MD 4.300 . 4.300 3.956 3.601 4.090 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1400 1 65 ILE MD 1 74 ILE MG 3.630 . 3.630 2.464 2.301 2.753 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1401 1 65 ILE MD 1 78 SER H 4.840 . 4.840 4.336 4.178 4.491 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1402 1 65 ILE MD 1 78 SER HA 4.070 . 4.070 3.631 3.394 3.846 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1403 1 65 ILE MD 1 78 SER HB2 4.150 . 4.150 2.861 2.359 3.351 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1404 1 65 ILE MD 1 78 SER QB 3.520 . 3.520 2.318 2.102 2.660 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1405 1 65 ILE MD 1 78 SER HB3 4.150 . 4.150 2.891 2.166 4.109 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1406 1 65 ILE MD 1 149 PHE QE 5.340 . 5.340 4.371 3.958 4.754 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1407 1 65 ILE QG 1 66 ARG H 4.180 . 4.180 3.113 2.856 3.323 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1408 1 65 ILE QG 1 74 ILE MG 5.030 . 5.030 3.098 2.768 3.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1409 1 65 ILE MG 1 66 ARG H 4.680 . 4.680 4.206 4.146 4.309 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1410 1 65 ILE MG 1 68 PHE H 5.500 . 5.500 4.929 4.684 5.144 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1411 1 65 ILE MG 1 68 PHE QB 4.400 . 4.400 3.431 3.127 3.987 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1412 1 65 ILE MG 1 68 PHE QD 4.330 . 4.330 3.305 2.337 4.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1413 1 65 ILE MG 1 68 PHE QE 4.630 . 4.630 3.868 3.026 4.683 0.053 22 0 "[ . 1 . 2 . 3 . 4]" 1 1414 1 65 ILE MG 1 74 ILE MD 4.770 . 4.770 4.427 3.935 4.654 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1415 1 65 ILE MG 1 74 ILE MG 4.580 . 4.580 3.585 3.374 3.825 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1416 1 65 ILE MG 1 146 PHE QD 4.770 . 4.770 3.342 2.693 3.943 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1417 1 65 ILE MG 1 146 PHE QE 3.760 . 3.760 2.142 2.014 2.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1418 1 65 ILE MG 1 146 PHE HZ 4.530 . 4.530 3.486 2.728 4.019 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1419 1 65 ILE MG 1 149 PHE QD 4.790 . 4.790 4.344 4.049 4.800 0.010 26 0 "[ . 1 . 2 . 3 . 4]" 1 1420 1 65 ILE MG 1 149 PHE QE 3.580 . 3.580 2.653 2.323 3.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1421 1 65 ILE MG 1 149 PHE HZ 4.510 . 4.510 2.775 2.319 3.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1422 1 66 ARG H 1 66 ARG QG 4.460 . 4.460 3.766 2.636 4.025 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1423 1 66 ARG H 1 67 ARG H 4.050 . 4.050 2.452 2.330 2.611 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1424 1 66 ARG H 1 68 PHE H 4.640 . 4.640 4.123 3.947 4.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1425 1 66 ARG HA 1 68 PHE H 4.550 . 4.550 3.728 3.577 3.905 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1426 1 66 ARG QB 1 67 ARG H 4.030 . 4.030 3.066 2.658 3.849 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1427 1 67 ARG H 1 67 ARG QD 4.590 . 4.590 3.823 2.657 4.366 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1428 1 67 ARG H 1 67 ARG HG2 4.720 . 4.720 3.343 1.859 4.614 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1429 1 67 ARG H 1 67 ARG QG 4.130 . 4.130 2.622 1.850 4.058 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1430 1 67 ARG H 1 67 ARG HG3 4.720 . 4.720 3.186 2.245 4.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1431 1 67 ARG H 1 68 PHE H 3.990 . 3.990 2.513 2.267 2.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1432 1 67 ARG H 1 68 PHE QD 5.300 . 5.300 4.934 4.251 5.325 0.025 25 0 "[ . 1 . 2 . 3 . 4]" 1 1433 1 67 ARG HA 1 67 ARG HG2 4.210 . 4.210 2.982 2.546 3.750 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1434 1 67 ARG HA 1 67 ARG QG 3.690 . 3.690 2.752 2.378 3.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1435 1 67 ARG HA 1 67 ARG HG3 4.210 . 4.210 3.390 2.442 4.133 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1436 1 67 ARG HA 1 75 MET ME 4.360 . 4.360 3.795 2.915 4.386 0.026 6 0 "[ . 1 . 2 . 3 . 4]" 1 1437 1 67 ARG QB 1 146 PHE H 4.340 . 4.340 3.286 2.461 4.345 0.005 39 0 "[ . 1 . 2 . 3 . 4]" 1 1438 1 67 ARG QG 1 146 PHE H 5.340 . 5.340 4.424 2.119 5.354 0.014 26 0 "[ . 1 . 2 . 3 . 4]" 1 1439 1 68 PHE H 1 68 PHE QD 4.550 . 4.550 3.912 3.342 4.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1440 1 68 PHE H 1 69 LYS H 4.720 . 4.720 4.155 3.799 4.377 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1441 1 68 PHE H 1 74 ILE MG 4.310 . 4.310 3.440 3.324 3.567 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1442 1 68 PHE H 1 75 MET QB 5.340 . 5.340 4.595 4.118 5.065 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1443 1 68 PHE H 1 75 MET ME 4.080 . 4.080 3.888 3.276 4.131 0.051 22 0 "[ . 1 . 2 . 3 . 4]" 1 1444 1 68 PHE H 1 75 MET HG2 5.500 . 5.500 2.688 2.016 3.258 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1445 1 68 PHE H 1 75 MET QG 4.760 . 4.760 2.638 1.987 3.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1446 1 68 PHE H 1 75 MET HG3 5.500 . 5.500 3.849 3.016 4.428 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1447 1 68 PHE HA 1 68 PHE QD 4.250 . 4.250 2.440 1.915 2.932 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1448 1 68 PHE HA 1 68 PHE QE 4.810 . 4.810 4.336 4.131 4.515 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1449 1 68 PHE HA 1 69 LYS QG 5.340 . 5.340 3.819 3.460 4.221 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1450 1 68 PHE HA 1 70 VAL QG 4.830 . 4.830 3.899 3.380 4.283 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1451 1 68 PHE QB 1 74 ILE MG 3.410 . 3.410 1.964 1.904 2.043 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1452 1 68 PHE QD 1 69 LYS H 4.280 . 4.280 4.045 3.263 4.315 0.035 5 0 "[ . 1 . 2 . 3 . 4]" 1 1453 1 68 PHE QD 1 70 VAL H 4.560 . 4.560 3.455 2.747 3.817 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1454 1 68 PHE QD 1 70 VAL HB 4.630 . 4.630 3.884 2.346 4.703 0.073 3 0 "[ . 1 . 2 . 3 . 4]" 1 1455 1 68 PHE QD 1 70 VAL MG1 4.050 . 4.050 3.523 2.770 4.118 0.068 9 0 "[ . 1 . 2 . 3 . 4]" 1 1456 1 68 PHE QD 1 70 VAL QG 3.390 . 3.390 2.486 1.840 3.433 0.043 15 0 "[ . 1 . 2 . 3 . 4]" 1 1457 1 68 PHE QD 1 70 VAL MG2 4.050 . 4.050 2.576 1.850 3.705 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1458 1 68 PHE QD 1 71 SER QB 4.600 . 4.600 3.681 2.726 4.435 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1459 1 68 PHE QD 1 74 ILE HB 4.320 . 4.320 3.477 2.711 3.908 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1460 1 68 PHE QD 1 74 ILE MD 3.590 . 3.590 2.412 2.062 2.938 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1461 1 68 PHE QD 1 74 ILE MG 3.520 . 3.520 2.497 1.988 3.041 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1462 1 68 PHE QD 1 146 PHE QE 4.930 . 4.930 2.846 2.109 3.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1463 1 68 PHE QD 1 147 THR HA 4.560 . 4.560 3.456 2.415 4.150 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1464 1 68 PHE QE 1 70 VAL H 5.390 . 5.390 4.452 3.869 5.058 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1465 1 68 PHE QE 1 70 VAL HB 4.900 . 4.900 3.772 2.234 4.871 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1466 1 68 PHE QE 1 70 VAL MG1 3.420 . 3.420 2.996 2.541 3.434 0.014 6 0 "[ . 1 . 2 . 3 . 4]" 1 1467 1 68 PHE QE 1 70 VAL MG2 3.420 . 3.420 2.524 2.085 3.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1468 1 68 PHE QE 1 74 ILE MD 3.650 . 3.650 3.081 2.380 3.726 0.076 30 0 "[ . 1 . 2 . 3 . 4]" 1 1469 1 68 PHE QE 1 74 ILE MG 4.200 . 4.200 4.118 3.811 4.388 0.188 5 0 "[ . 1 . 2 . 3 . 4]" 1 1470 1 68 PHE QE 1 147 THR HA 4.980 . 4.980 2.805 2.011 3.732 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1471 1 68 PHE HZ 1 70 VAL MG1 4.230 . 4.230 3.893 3.185 4.239 0.009 26 0 "[ . 1 . 2 . 3 . 4]" 1 1472 1 68 PHE HZ 1 70 VAL MG2 4.230 . 4.230 3.649 2.676 4.242 0.012 12 0 "[ . 1 . 2 . 3 . 4]" 1 1473 1 69 LYS H 1 69 LYS QB 3.520 . 3.520 2.440 2.319 2.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1474 1 69 LYS H 1 69 LYS QD 3.660 . 3.660 3.522 2.960 3.702 0.042 22 0 "[ . 1 . 2 . 3 . 4]" 1 1475 1 69 LYS H 1 69 LYS HG2 3.880 . 3.880 3.339 1.866 3.854 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1476 1 69 LYS H 1 69 LYS HG3 3.880 . 3.880 2.171 1.796 3.566 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1477 1 69 LYS H 1 70 VAL H 3.790 . 3.790 2.892 2.688 3.136 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1478 1 69 LYS H 1 70 VAL QG 3.910 . 3.910 3.736 3.313 3.910 0.000 10 0 "[ . 1 . 2 . 3 . 4]" 1 1479 1 69 LYS H 1 71 SER H 4.870 . 4.870 4.693 4.503 4.869 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1480 1 69 LYS H 1 74 ILE MG 5.500 . 5.500 5.570 5.519 5.625 0.125 15 0 "[ . 1 . 2 . 3 . 4]" 1 1481 1 69 LYS H 1 75 MET ME 4.250 . 4.250 3.642 3.011 4.128 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1482 1 69 LYS HA 1 69 LYS QD 4.470 . 4.470 3.995 2.283 4.295 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1483 1 69 LYS HA 1 69 LYS QG 3.690 . 3.690 2.485 2.326 3.310 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1484 1 69 LYS HA 1 71 SER H 4.320 . 4.320 3.862 3.527 4.098 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1485 1 69 LYS HA 1 75 MET ME 2.810 . 2.810 2.148 1.931 2.450 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1486 1 69 LYS QB 1 69 LYS QE 4.490 . 4.490 3.244 2.062 3.662 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1487 1 69 LYS QB 1 70 VAL H 4.110 . 4.110 2.982 2.702 3.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1488 1 69 LYS QB 1 70 VAL QG 4.910 . 4.910 3.352 2.905 4.236 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1489 1 69 LYS QB 1 75 MET ME 4.540 . 4.540 3.787 2.770 4.132 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1490 1 69 LYS HB2 1 70 VAL H 4.980 . 4.980 3.091 2.765 4.230 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1491 1 69 LYS HB3 1 70 VAL H 4.980 . 4.980 3.943 3.761 4.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1492 1 69 LYS QD 1 70 VAL H 4.960 . 4.960 4.952 4.720 5.027 0.067 5 0 "[ . 1 . 2 . 3 . 4]" 1 1493 1 69 LYS QD 1 70 VAL QG 4.990 . 4.990 4.719 4.171 5.084 0.094 14 0 "[ . 1 . 2 . 3 . 4]" 1 1494 1 69 LYS QG 1 70 VAL H 4.510 . 4.510 4.245 2.977 4.425 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1495 1 69 LYS QG 1 70 VAL QG 5.130 . 5.130 4.649 2.893 5.134 0.004 17 0 "[ . 1 . 2 . 3 . 4]" 1 1496 1 69 LYS QG 1 75 MET ME 3.890 . 3.890 3.281 2.516 3.948 0.058 30 0 "[ . 1 . 2 . 3 . 4]" 1 1497 1 69 LYS HG2 1 75 MET ME 4.720 . 4.720 3.545 2.894 4.217 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1498 1 69 LYS HG3 1 75 MET ME 4.720 . 4.720 3.912 2.646 4.756 0.036 30 0 "[ . 1 . 2 . 3 . 4]" 1 1499 1 70 VAL H 1 70 VAL HB 3.620 . 3.620 3.141 2.452 3.623 0.003 30 0 "[ . 1 . 2 . 3 . 4]" 1 1500 1 70 VAL H 1 70 VAL MG1 3.790 . 3.790 2.709 1.778 3.774 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1501 1 70 VAL H 1 70 VAL QG 2.650 . 2.650 1.909 1.758 2.052 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1502 1 70 VAL H 1 70 VAL MG2 3.790 . 3.790 2.306 1.909 2.925 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1503 1 70 VAL H 1 71 SER H 3.410 . 3.410 2.750 2.614 2.853 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1504 1 70 VAL H 1 75 MET ME 4.830 . 4.830 4.276 4.134 4.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1505 1 70 VAL HA 1 70 VAL MG1 3.330 . 3.330 2.480 2.364 2.673 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1506 1 70 VAL HA 1 70 VAL QG 2.610 . 2.610 2.312 2.141 2.543 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1507 1 70 VAL HA 1 70 VAL MG2 3.330 . 3.330 2.868 2.348 3.225 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1508 1 70 VAL HB 1 71 SER H 4.290 . 4.290 3.687 2.813 4.329 0.039 5 0 "[ . 1 . 2 . 3 . 4]" 1 1509 1 70 VAL QG 1 71 SER H 3.650 . 3.650 2.911 2.465 3.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1510 1 70 VAL QG 1 71 SER HA 4.380 . 4.380 3.951 3.684 4.193 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1511 1 70 VAL QG 1 71 SER QB 3.920 . 3.920 2.642 2.302 3.107 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1512 1 70 VAL QG 1 71 SER HG 5.150 . 5.150 4.515 4.162 4.932 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1513 1 70 VAL QG 1 74 ILE MD 4.230 . 4.230 3.004 2.282 3.825 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1514 1 70 VAL QG 1 74 ILE QG 5.280 . 5.280 4.591 2.572 5.371 0.091 15 0 "[ . 1 . 2 . 3 . 4]" 1 1515 1 70 VAL QG 1 74 ILE MG 4.900 . 4.900 4.095 3.270 4.860 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1516 1 70 VAL QG 1 75 MET ME 5.440 . 5.440 4.748 4.441 5.131 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1517 1 70 VAL MG1 1 71 SER H 4.320 . 4.320 3.835 3.608 4.124 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1518 1 70 VAL MG2 1 71 SER H 4.320 . 4.320 3.159 2.494 4.032 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1519 1 71 SER H 1 71 SER HG 5.240 . 5.240 4.944 4.546 5.014 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1520 1 71 SER H 1 73 VAL H 5.500 . 5.500 5.404 5.170 5.515 0.015 12 0 "[ . 1 . 2 . 3 . 4]" 1 1521 1 71 SER H 1 74 ILE HB 4.460 . 4.460 3.688 3.498 3.869 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1522 1 71 SER H 1 74 ILE MD 5.500 . 5.500 4.005 3.710 4.927 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1523 1 71 SER H 1 75 MET H 5.500 . 5.500 4.856 4.739 5.169 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1524 1 71 SER H 1 75 MET ME 4.260 . 4.260 3.397 3.136 3.869 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1525 1 71 SER HA 1 73 VAL H 4.620 . 4.620 3.736 3.418 4.117 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1526 1 71 SER QB 1 74 ILE MD 3.740 . 3.740 2.331 2.105 3.388 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1527 1 71 SER QB 1 74 ILE MG 4.140 . 4.140 3.689 3.512 4.206 0.066 30 0 "[ . 1 . 2 . 3 . 4]" 1 1528 1 71 SER HB2 1 74 ILE MD 4.510 . 4.510 3.299 2.481 4.476 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1529 1 71 SER HB3 1 74 ILE MD 4.510 . 4.510 2.403 2.147 3.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1530 1 71 SER HG 1 73 VAL H 4.410 . 4.410 3.367 3.063 3.634 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1531 1 71 SER HG 1 73 VAL HB 5.350 . 5.350 3.720 2.310 5.354 0.004 8 0 "[ . 1 . 2 . 3 . 4]" 1 1532 1 71 SER HG 1 73 VAL MG1 4.380 . 4.380 4.146 3.828 4.392 0.012 5 0 "[ . 1 . 2 . 3 . 4]" 1 1533 1 71 SER HG 1 73 VAL QG 3.660 . 3.660 2.752 2.206 3.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1534 1 71 SER HG 1 73 VAL MG2 4.380 . 4.380 2.853 2.212 3.665 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1535 1 71 SER HG 1 74 ILE MD 4.800 . 4.800 3.795 3.335 4.775 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1536 1 72 GLN H 1 72 GLN QG 4.680 . 4.680 3.101 2.065 4.063 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1537 1 72 GLN H 1 73 VAL QG 4.820 . 4.820 3.756 3.523 3.917 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1538 1 72 GLN HA 1 73 VAL QG 5.020 . 5.020 4.660 4.489 4.846 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1539 1 72 GLN HA 1 75 MET QB 4.840 . 4.840 2.959 2.674 3.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1540 1 72 GLN HA 1 75 MET ME 3.090 . 3.090 2.586 1.992 3.109 0.019 30 0 "[ . 1 . 2 . 3 . 4]" 1 1541 1 72 GLN HA 1 75 MET QG 4.690 . 4.690 2.948 2.544 4.006 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1542 1 72 GLN QB 1 72 GLN QE 3.890 . 3.890 3.144 2.409 3.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1543 1 72 GLN QB 1 73 VAL H 3.650 . 3.650 3.184 2.550 3.664 0.014 24 0 "[ . 1 . 2 . 3 . 4]" 1 1544 1 72 GLN QB 1 73 VAL HA 5.120 . 5.120 4.287 4.013 4.566 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1545 1 72 GLN QB 1 73 VAL QG 4.130 . 4.130 3.654 2.973 4.214 0.084 18 0 "[ . 1 . 2 . 3 . 4]" 1 1546 1 72 GLN HB2 1 73 VAL H 4.230 . 4.230 3.999 3.827 4.120 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1547 1 72 GLN HB3 1 73 VAL H 4.230 . 4.230 3.460 2.588 4.188 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1548 1 72 GLN QG 1 73 VAL H 4.300 . 4.300 3.112 2.385 3.890 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1549 1 72 GLN QG 1 73 VAL HA 4.430 . 4.430 3.553 3.222 3.893 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1550 1 72 GLN QG 1 73 VAL QG 3.860 . 3.860 3.163 2.336 4.015 0.155 28 0 "[ . 1 . 2 . 3 . 4]" 1 1551 1 73 VAL H 1 73 VAL HB 3.640 . 3.640 3.053 2.434 3.665 0.025 12 0 "[ . 1 . 2 . 3 . 4]" 1 1552 1 73 VAL H 1 73 VAL MG1 3.800 . 3.800 3.104 2.248 3.795 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1553 1 73 VAL H 1 73 VAL QG 2.790 . 2.790 2.006 1.892 2.145 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1554 1 73 VAL H 1 73 VAL MG2 3.800 . 3.800 2.073 1.980 2.180 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1555 1 73 VAL HA 1 73 VAL MG1 3.340 . 3.340 2.349 2.245 2.444 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1556 1 73 VAL HA 1 73 VAL QG 2.720 . 2.720 2.178 2.111 2.271 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1557 1 73 VAL HA 1 73 VAL MG2 3.340 . 3.340 2.782 2.315 3.257 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1558 1 73 VAL HA 1 76 GLU H 4.920 . 4.920 3.210 2.854 3.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1559 1 73 VAL HA 1 76 GLU QB 3.790 . 3.790 2.411 2.011 3.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1560 1 73 VAL HB 1 74 ILE H 4.330 . 4.330 3.288 2.581 4.100 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1561 1 73 VAL QG 1 74 ILE H 4.240 . 4.240 2.865 2.373 3.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1562 1 73 VAL QG 1 74 ILE HA 4.050 . 4.050 3.464 3.367 3.591 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1563 1 73 VAL QG 1 74 ILE HB 4.560 . 4.560 4.293 3.609 4.699 0.139 10 0 "[ . 1 . 2 . 3 . 4]" 1 1564 1 73 VAL QG 1 76 GLU H 5.250 . 5.250 4.377 4.273 4.498 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1565 1 73 VAL QG 1 76 GLU QB 4.460 . 4.460 3.477 3.289 3.777 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1566 1 73 VAL QG 1 77 LYS H 4.480 . 4.480 4.060 3.643 4.494 0.014 38 0 "[ . 1 . 2 . 3 . 4]" 1 1567 1 73 VAL QG 1 77 LYS QB 4.700 . 4.700 3.966 3.317 4.633 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1568 1 73 VAL QG 1 77 LYS QD 3.800 . 3.800 2.993 2.167 3.879 0.079 12 0 "[ . 1 . 2 . 3 . 4]" 1 1569 1 73 VAL QG 1 77 LYS QE 2.970 . 2.970 2.593 2.019 3.262 0.292 5 0 "[ . 1 . 2 . 3 . 4]" 1 1570 1 73 VAL QG 1 77 LYS QG 4.860 . 4.860 3.450 2.213 4.885 0.025 29 0 "[ . 1 . 2 . 3 . 4]" 1 1571 1 73 VAL MG1 1 74 ILE HA 5.500 . 5.500 4.454 3.404 5.534 0.034 12 0 "[ . 1 . 2 . 3 . 4]" 1 1572 1 73 VAL MG1 1 75 MET H 5.500 . 5.500 5.271 5.004 5.506 0.006 21 0 "[ . 1 . 2 . 3 . 4]" 1 1573 1 73 VAL MG1 1 77 LYS H 5.450 . 5.450 4.386 3.709 5.196 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1574 1 73 VAL MG1 1 77 LYS HE2 5.080 . 5.080 2.966 2.064 4.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1575 1 73 VAL MG1 1 77 LYS HE3 5.080 . 5.080 3.722 2.782 5.081 0.001 24 0 "[ . 1 . 2 . 3 . 4]" 1 1576 1 73 VAL MG2 1 74 ILE HA 5.500 . 5.500 4.525 3.397 5.465 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1577 1 73 VAL MG2 1 75 MET H 5.500 . 5.500 5.015 4.527 5.501 0.001 16 0 "[ . 1 . 2 . 3 . 4]" 1 1578 1 73 VAL MG2 1 77 LYS H 5.450 . 5.450 5.177 4.723 5.469 0.019 10 0 "[ . 1 . 2 . 3 . 4]" 1 1579 1 73 VAL MG2 1 77 LYS HE2 5.080 . 5.080 4.060 3.363 4.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1580 1 73 VAL MG2 1 77 LYS HE3 5.080 . 5.080 4.555 3.183 5.125 0.045 28 0 "[ . 1 . 2 . 3 . 4]" 1 1581 1 74 ILE H 1 74 ILE MD 4.210 . 4.210 3.827 3.702 3.958 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1582 1 74 ILE H 1 74 ILE HG12 4.950 . 4.950 3.961 2.364 4.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1583 1 74 ILE H 1 74 ILE QG 4.140 . 4.140 2.775 2.314 3.148 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1584 1 74 ILE H 1 74 ILE HG13 4.950 . 4.950 2.856 2.655 3.292 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1585 1 74 ILE H 1 74 ILE MG 3.740 . 3.740 3.644 3.456 3.754 0.014 30 0 "[ . 1 . 2 . 3 . 4]" 1 1586 1 74 ILE H 1 75 MET H 4.220 . 4.220 2.628 2.559 2.721 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1587 1 74 ILE HA 1 74 ILE MD 3.910 . 3.910 3.730 2.613 3.787 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1588 1 74 ILE HA 1 74 ILE QG 3.690 . 3.690 2.196 2.110 2.620 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1589 1 74 ILE HA 1 77 LYS QB 4.580 . 4.580 2.991 2.704 3.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1590 1 74 ILE HB 1 74 ILE MD 3.620 . 3.620 2.446 2.341 3.235 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1591 1 74 ILE HB 1 75 MET H 4.150 . 4.150 2.892 2.486 3.146 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1592 1 74 ILE MD 1 74 ILE MG 2.980 . 2.980 2.095 1.998 2.143 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1593 1 74 ILE MG 1 75 MET H 3.990 . 3.990 2.918 2.725 3.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1594 1 74 ILE MG 1 75 MET HA 4.230 . 4.230 3.127 3.025 3.294 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1595 1 74 ILE MG 1 75 MET ME 4.500 . 4.500 4.471 4.099 4.610 0.110 5 0 "[ . 1 . 2 . 3 . 4]" 1 1596 1 74 ILE MG 1 75 MET QG 4.570 . 4.570 3.054 2.613 3.338 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1597 1 74 ILE MG 1 78 SER H 4.750 . 4.750 4.100 3.926 4.241 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1598 1 74 ILE MG 1 78 SER QB 4.570 . 4.570 3.280 3.000 3.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1599 1 75 MET H 1 75 MET ME 4.960 . 4.960 3.876 3.317 4.089 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1600 1 75 MET H 1 75 MET HG2 4.400 . 4.400 3.348 3.221 3.538 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1601 1 75 MET H 1 75 MET QG 3.810 . 3.810 2.120 1.944 2.311 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1602 1 75 MET H 1 75 MET HG3 4.400 . 4.400 2.145 1.960 2.350 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1603 1 75 MET H 1 76 GLU H 4.060 . 4.060 2.694 2.602 2.802 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1604 1 75 MET QB 1 76 GLU H 4.480 . 4.480 2.450 2.290 2.725 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1605 1 75 MET ME 1 75 MET QG 3.070 . 3.070 2.195 2.153 2.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1606 1 75 MET ME 1 76 GLU H 5.500 . 5.500 5.260 4.336 5.536 0.036 2 0 "[ . 1 . 2 . 3 . 4]" 1 1607 1 76 GLU H 1 76 GLU HB2 3.610 . 3.610 2.346 2.056 2.576 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1608 1 76 GLU H 1 76 GLU QB 3.080 . 3.080 2.284 2.039 2.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1609 1 76 GLU H 1 76 GLU HB3 3.610 . 3.610 3.414 2.193 3.620 0.010 28 0 "[ . 1 . 2 . 3 . 4]" 1 1610 1 76 GLU H 1 76 GLU HG2 4.550 . 4.550 3.623 2.256 4.554 0.004 26 0 "[ . 1 . 2 . 3 . 4]" 1 1611 1 76 GLU H 1 76 GLU HG3 4.550 . 4.550 3.011 2.248 4.551 0.001 33 0 "[ . 1 . 2 . 3 . 4]" 1 1612 1 76 GLU H 1 77 LYS H 4.080 . 4.080 2.798 2.704 2.877 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1613 1 76 GLU H 1 77 LYS QB 5.250 . 5.250 4.713 4.497 4.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1614 1 76 GLU HA 1 79 THR H 4.320 . 4.320 3.637 3.239 3.911 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1615 1 76 GLU QB 1 77 LYS H 3.670 . 3.670 2.431 2.258 2.680 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1616 1 76 GLU HB2 1 77 LYS H 4.190 . 4.190 2.700 2.354 3.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1617 1 76 GLU HB3 1 77 LYS H 4.190 . 4.190 3.195 2.278 3.673 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1618 1 77 LYS H 1 77 LYS QD 4.980 . 4.980 3.513 2.390 4.086 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1619 1 77 LYS H 1 77 LYS HG2 4.850 . 4.850 3.800 2.412 4.352 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1620 1 77 LYS H 1 77 LYS HG3 4.850 . 4.850 2.952 2.323 4.224 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1621 1 77 LYS QB 1 78 SER H 4.460 . 4.460 2.642 2.521 2.736 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1622 1 78 SER H 1 79 THR H 4.110 . 4.110 2.700 2.597 2.823 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1623 1 78 SER H 1 81 LEU QD 5.440 . 5.440 4.314 3.953 4.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1624 1 78 SER HB2 1 79 THR H 4.780 . 4.780 3.808 3.637 4.005 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1625 1 78 SER HB3 1 79 THR H 4.780 . 4.780 3.489 2.451 4.199 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1626 1 79 THR H 1 79 THR HB 3.920 . 3.920 2.542 2.411 2.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1627 1 79 THR H 1 79 THR HG1 3.810 . 3.810 2.191 2.013 2.391 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1628 1 79 THR H 1 79 THR MG 3.850 . 3.850 3.784 3.749 3.830 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1629 1 79 THR H 1 80 MET H 3.510 . 3.510 2.775 2.665 2.925 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1630 1 79 THR HA 1 79 THR MG 3.290 . 3.290 2.398 2.346 2.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1631 1 79 THR HB 1 80 MET H 4.110 . 4.110 2.683 2.525 2.870 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1632 1 79 THR HG1 1 79 THR MG 3.380 . 3.380 3.005 2.987 3.047 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1633 1 79 THR HG1 1 80 MET H 4.880 . 4.880 4.211 4.024 4.479 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1634 1 79 THR MG 1 80 MET H 3.720 . 3.720 3.487 3.304 3.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1635 1 79 THR MG 1 80 MET HA 3.630 . 3.630 3.479 3.269 3.642 0.012 40 0 "[ . 1 . 2 . 3 . 4]" 1 1636 1 79 THR MG 1 80 MET QB 4.660 . 4.660 4.509 4.197 4.775 0.115 15 0 "[ . 1 . 2 . 3 . 4]" 1 1637 1 79 THR MG 1 82 TYR H 5.070 . 5.070 4.820 4.692 4.932 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1638 1 79 THR MG 1 82 TYR QD 4.430 . 4.430 3.706 3.248 4.308 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1639 1 79 THR MG 1 83 ASN H 4.560 . 4.560 3.808 3.584 3.947 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1640 1 79 THR MG 1 83 ASN QB 4.630 . 4.630 3.561 2.917 3.856 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1641 1 79 THR MG 1 83 ASN HD21 3.350 . 3.350 2.608 2.150 3.395 0.045 12 0 "[ . 1 . 2 . 3 . 4]" 1 1642 1 79 THR MG 1 83 ASN QD 2.930 . 2.930 2.388 2.086 2.953 0.023 32 0 "[ . 1 . 2 . 3 . 4]" 1 1643 1 79 THR MG 1 83 ASN HD22 3.350 . 3.350 2.982 2.194 3.392 0.042 2 0 "[ . 1 . 2 . 3 . 4]" 1 1644 1 80 MET H 1 80 MET QB 3.350 . 3.350 2.441 2.177 2.967 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1645 1 80 MET H 1 80 MET ME 4.650 . 4.650 4.068 3.694 4.612 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1646 1 80 MET H 1 80 MET HG2 4.750 . 4.750 3.787 1.993 4.509 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1647 1 80 MET H 1 80 MET QG 4.030 . 4.030 3.133 1.715 4.021 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1648 1 80 MET H 1 80 MET HG3 4.750 . 4.750 3.449 1.741 4.581 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1649 1 80 MET H 1 81 LEU H 4.300 . 4.300 2.801 2.604 2.920 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1650 1 80 MET HA 1 80 MET HG2 4.220 . 4.220 2.987 2.342 3.683 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1651 1 80 MET HA 1 80 MET QG 3.600 . 3.600 2.587 2.313 3.298 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1652 1 80 MET HA 1 80 MET HG3 4.220 . 4.220 3.045 2.532 3.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1653 1 80 MET HA 1 83 ASN H 4.920 . 4.920 3.824 3.271 4.058 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1654 1 80 MET QB 1 81 LEU H 3.790 . 3.790 2.441 2.225 3.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1655 1 80 MET QB 1 81 LEU QD 5.020 . 5.020 3.049 2.289 3.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1656 1 80 MET ME 1 80 MET HG2 3.560 . 3.560 2.969 2.434 3.536 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1657 1 80 MET ME 1 80 MET QG 3.100 . 3.100 2.459 2.140 2.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1658 1 80 MET ME 1 80 MET HG3 3.560 . 3.560 3.006 2.223 3.474 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1659 1 80 MET ME 1 81 LEU H 3.720 . 3.720 3.630 3.388 3.750 0.030 8 0 "[ . 1 . 2 . 3 . 4]" 1 1660 1 80 MET ME 1 81 LEU HA 4.680 . 4.680 4.400 3.731 4.725 0.045 16 0 "[ . 1 . 2 . 3 . 4]" 1 1661 1 80 MET ME 1 81 LEU MD1 3.800 . 3.800 3.291 2.295 3.817 0.017 1 0 "[ . 1 . 2 . 3 . 4]" 1 1662 1 80 MET ME 1 81 LEU QD 2.920 . 2.920 2.495 2.007 2.993 0.073 26 0 "[ . 1 . 2 . 3 . 4]" 1 1663 1 80 MET ME 1 81 LEU MD2 3.800 . 3.800 2.624 2.030 3.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1664 1 80 MET QG 1 81 LEU H 4.920 . 4.920 3.548 2.235 4.279 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1665 1 81 LEU H 1 81 LEU MD1 3.750 . 3.750 3.331 2.927 3.659 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1666 1 81 LEU H 1 81 LEU MD2 3.750 . 3.750 2.874 2.118 3.741 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1667 1 81 LEU H 1 81 LEU HG 4.180 . 4.180 3.166 2.103 4.183 0.003 32 0 "[ . 1 . 2 . 3 . 4]" 1 1668 1 81 LEU H 1 82 TYR H 4.130 . 4.130 2.624 2.478 2.726 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1669 1 81 LEU H 1 83 ASN H 4.790 . 4.790 4.237 4.084 4.422 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1670 1 81 LEU HA 1 81 LEU MD1 4.640 . 4.640 2.977 2.037 3.893 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1671 1 81 LEU HA 1 81 LEU QD 3.140 . 3.140 2.132 2.017 2.269 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1672 1 81 LEU HA 1 81 LEU MD2 4.640 . 4.640 2.721 2.145 3.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1673 1 81 LEU HA 1 84 LYS QB 5.060 . 5.060 3.012 2.567 3.905 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1674 1 81 LEU HA 1 84 LYS HD2 4.140 . 4.140 2.518 2.298 3.653 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1675 1 81 LEU HA 1 84 LYS QD 3.600 . 3.600 2.396 2.241 2.732 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1676 1 81 LEU HA 1 84 LYS HD3 4.140 . 4.140 3.159 2.625 3.720 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1677 1 81 LEU HA 1 84 LYS QE 4.900 . 4.900 4.487 4.364 4.751 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1678 1 81 LEU HA 1 84 LYS HG2 3.950 . 3.950 2.969 2.134 3.292 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1679 1 81 LEU HA 1 85 PHE QD 5.500 . 5.500 4.660 4.406 4.851 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1680 1 81 LEU HA 1 85 PHE QE 4.790 . 4.790 4.299 4.094 4.552 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1681 1 81 LEU QB 1 85 PHE QE 4.650 . 4.650 2.654 2.343 3.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1682 1 81 LEU HB2 1 82 TYR H 4.800 . 4.800 2.525 2.437 2.652 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1683 1 81 LEU HB3 1 82 TYR H 4.800 . 4.800 3.458 3.226 3.665 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1684 1 81 LEU QD 1 82 TYR H 4.410 . 4.410 3.884 3.637 4.059 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1685 1 81 LEU QD 1 83 ASN H 5.440 . 5.440 5.335 5.107 5.496 0.056 6 0 "[ . 1 . 2 . 3 . 4]" 1 1686 1 81 LEU QD 1 84 LYS H 5.270 . 5.270 4.751 4.511 5.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1687 1 81 LEU QD 1 84 LYS QD 3.410 . 3.410 2.227 2.023 2.495 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1688 1 81 LEU QD 1 84 LYS QE 4.170 . 4.170 3.847 3.599 4.170 0.000 6 0 "[ . 1 . 2 . 3 . 4]" 1 1689 1 81 LEU QD 1 85 PHE H 5.440 . 5.440 5.143 4.769 5.447 0.007 6 0 "[ . 1 . 2 . 3 . 4]" 1 1690 1 81 LEU QD 1 85 PHE QD 5.440 . 5.440 4.472 4.067 4.790 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1691 1 81 LEU QD 1 85 PHE QE 4.530 . 4.530 3.246 2.833 3.723 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1692 1 81 LEU QD 1 85 PHE HZ 4.850 . 4.850 3.402 2.701 3.929 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1693 1 81 LEU MD1 1 82 TYR H 5.500 . 5.500 4.454 4.195 4.673 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1694 1 81 LEU MD1 1 85 PHE QE 5.500 . 5.500 3.689 2.852 4.603 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1695 1 81 LEU MD2 1 82 TYR H 5.500 . 5.500 4.363 3.840 4.742 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1696 1 81 LEU MD2 1 85 PHE QE 5.500 . 5.500 4.181 2.995 5.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1697 1 82 TYR H 1 82 TYR QD 4.480 . 4.480 4.185 4.139 4.222 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1698 1 82 TYR H 1 83 ASN H 4.140 . 4.140 2.777 2.690 2.930 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1699 1 82 TYR HA 1 82 TYR QD 4.260 . 4.260 2.752 2.305 3.002 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1700 1 82 TYR HA 1 85 PHE H 4.670 . 4.670 3.800 3.632 3.992 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1701 1 82 TYR HA 1 85 PHE QD 4.450 . 4.450 2.981 2.706 3.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1702 1 82 TYR QB 1 83 ASN H 4.390 . 4.390 2.436 2.353 2.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1703 1 82 TYR QD 1 83 ASN H 4.530 . 4.530 3.411 2.982 3.908 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1704 1 82 TYR QE 1 86 LYS QD 4.400 . 4.400 2.528 2.286 2.895 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1705 1 82 TYR QE 1 86 LYS QE 4.520 . 4.520 4.068 2.952 4.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1706 1 83 ASN H 1 83 ASN HB2 4.140 . 4.140 2.587 2.352 3.723 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1707 1 83 ASN H 1 83 ASN HB3 4.140 . 4.140 3.449 2.470 3.611 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1708 1 83 ASN H 1 83 ASN QD 5.320 . 5.320 3.839 2.493 4.274 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1709 1 83 ASN H 1 84 LYS H 3.990 . 3.990 2.706 2.620 2.840 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1710 1 83 ASN H 1 84 LYS QB 5.330 . 5.330 4.615 4.416 4.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1711 1 83 ASN H 1 85 PHE H 5.200 . 5.200 4.297 4.202 4.388 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1712 1 83 ASN H 1 86 LYS H 5.430 . 5.430 4.689 4.620 4.776 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1713 1 83 ASN HA 1 86 LYS QB 5.130 . 5.130 2.402 2.070 2.770 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1714 1 83 ASN HA 1 87 ASN H 5.000 . 5.000 3.625 3.374 3.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1715 1 83 ASN HA 1 87 ASN QB 5.210 . 5.210 4.391 4.138 4.865 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1716 1 83 ASN QB 1 84 LYS H 3.810 . 3.810 2.871 2.582 3.803 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1717 1 83 ASN HB2 1 84 LYS H 4.390 . 4.390 3.014 2.654 4.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1718 1 83 ASN HB3 1 84 LYS H 4.390 . 4.390 3.738 3.531 4.296 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1719 1 84 LYS H 1 84 LYS QB 3.430 . 3.430 2.224 2.103 2.574 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1720 1 84 LYS H 1 84 LYS QD 4.390 . 4.390 3.967 3.723 4.179 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1721 1 84 LYS H 1 84 LYS QE 5.320 . 5.320 5.107 4.838 5.332 0.012 1 0 "[ . 1 . 2 . 3 . 4]" 1 1722 1 84 LYS H 1 84 LYS HG2 3.650 . 3.650 3.147 2.455 3.410 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1723 1 84 LYS H 1 84 LYS HG3 4.370 . 4.370 4.238 3.595 4.375 0.005 40 0 "[ . 1 . 2 . 3 . 4]" 1 1724 1 84 LYS H 1 85 PHE H 3.600 . 3.600 2.696 2.588 2.763 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1725 1 84 LYS H 1 87 ASN H 5.200 . 5.200 5.113 4.984 5.208 0.008 40 0 "[ . 1 . 2 . 3 . 4]" 1 1726 1 84 LYS HA 1 84 LYS QE 5.210 . 5.210 4.455 4.176 4.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1727 1 84 LYS HA 1 84 LYS HG3 4.040 . 4.040 3.615 3.492 3.787 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1728 1 84 LYS HA 1 87 ASN H 4.510 . 4.510 4.252 3.970 4.510 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1729 1 84 LYS HA 1 87 ASN QB 4.060 . 4.060 3.764 3.443 4.065 0.005 27 0 "[ . 1 . 2 . 3 . 4]" 1 1730 1 84 LYS QB 1 84 LYS QE 3.770 . 3.770 2.387 2.084 2.697 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1731 1 84 LYS QB 1 85 PHE H 3.720 . 3.720 3.439 3.277 3.650 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1732 1 84 LYS QD 1 85 PHE H 4.630 . 4.630 4.176 4.054 4.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1733 1 84 LYS QD 1 85 PHE QE 4.120 . 4.120 3.223 3.000 4.052 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1734 1 84 LYS QD 1 85 PHE HZ 5.340 . 5.340 3.194 2.938 4.349 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1735 1 84 LYS QE 1 84 LYS HG2 3.740 . 3.740 3.289 3.186 3.340 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1736 1 84 LYS QE 1 84 LYS HG3 3.250 . 3.250 2.283 2.215 2.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1737 1 84 LYS QE 1 85 PHE H 5.160 . 5.160 5.118 4.683 5.177 0.017 5 0 "[ . 1 . 2 . 3 . 4]" 1 1738 1 84 LYS QE 1 85 PHE HA 5.380 . 5.380 5.326 4.735 5.394 0.014 12 0 "[ . 1 . 2 . 3 . 4]" 1 1739 1 84 LYS QE 1 85 PHE QD 5.100 . 5.100 4.393 3.584 4.776 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1740 1 84 LYS QE 1 85 PHE QE 4.570 . 4.570 3.572 2.682 4.186 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1741 1 84 LYS QE 1 85 PHE HZ 5.220 . 5.220 4.578 3.766 5.217 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1742 1 84 LYS HG2 1 85 PHE H 4.170 . 4.170 2.375 2.268 2.835 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1743 1 84 LYS HG3 1 85 PHE H 4.490 . 4.490 3.362 2.810 3.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1744 1 84 LYS HG3 1 85 PHE QD 4.120 . 4.120 3.222 2.924 3.511 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1745 1 85 PHE H 1 85 PHE HB2 4.160 . 4.160 2.514 2.444 2.572 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1746 1 85 PHE H 1 85 PHE QB 3.630 . 3.630 2.471 2.407 2.523 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1747 1 85 PHE H 1 85 PHE HB3 4.160 . 4.160 3.638 3.619 3.659 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1748 1 85 PHE H 1 85 PHE QD 3.890 . 3.890 3.225 3.087 3.347 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1749 1 85 PHE H 1 85 PHE QE 4.990 . 4.990 4.644 4.529 4.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1750 1 85 PHE H 1 86 LYS H 3.780 . 3.780 2.584 2.505 2.649 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1751 1 85 PHE HA 1 85 PHE QD 3.670 . 3.670 2.216 2.073 2.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1752 1 85 PHE HA 1 85 PHE QE 5.210 . 5.210 4.494 4.353 4.636 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1753 1 85 PHE HA 1 88 MET H 4.300 . 4.300 3.969 3.738 4.136 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1754 1 85 PHE HA 1 88 MET HB3 4.520 . 4.520 4.137 3.608 4.524 0.004 12 0 "[ . 1 . 2 . 3 . 4]" 1 1755 1 85 PHE HA 1 88 MET HG2 4.190 . 4.190 3.787 3.500 4.059 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1756 1 85 PHE HA 1 88 MET HG3 4.520 . 4.520 4.342 3.942 4.527 0.007 11 0 "[ . 1 . 2 . 3 . 4]" 1 1757 1 85 PHE HB2 1 86 LYS H 4.770 . 4.770 2.496 2.415 2.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1758 1 85 PHE HB3 1 86 LYS H 4.770 . 4.770 3.607 3.532 3.678 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1759 1 85 PHE QD 1 86 LYS H 5.500 . 5.500 4.260 4.124 4.436 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1760 1 86 LYS H 1 86 LYS HB2 3.920 . 3.920 2.470 2.217 2.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1761 1 86 LYS H 1 86 LYS QB 3.430 . 3.430 2.248 2.160 2.304 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1762 1 86 LYS H 1 86 LYS HB3 3.920 . 3.920 2.635 2.448 3.038 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1763 1 86 LYS H 1 86 LYS QD 4.970 . 4.970 4.522 4.205 4.767 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1764 1 86 LYS H 1 86 LYS QG 4.700 . 4.700 3.978 3.786 4.032 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1765 1 86 LYS H 1 87 ASN H 3.900 . 3.900 2.972 2.910 3.057 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1766 1 86 LYS H 1 87 ASN QB 4.800 . 4.800 4.677 4.568 4.818 0.018 28 0 "[ . 1 . 2 . 3 . 4]" 1 1767 1 86 LYS QB 1 135 PHE QD 5.030 . 5.030 3.939 3.619 4.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1768 1 86 LYS QB 1 135 PHE QE 5.340 . 5.340 3.046 2.697 3.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1769 1 86 LYS HB2 1 87 ASN H 4.430 . 4.430 4.007 3.709 4.134 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1770 1 86 LYS HB3 1 87 ASN H 4.430 . 4.430 2.792 2.601 2.932 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1771 1 86 LYS QD 1 90 LEU MD2 4.020 . 4.020 3.304 2.067 3.837 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1772 1 86 LYS QD 1 135 PHE QD 5.340 . 5.340 3.197 2.665 4.255 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1773 1 86 LYS QE 1 86 LYS QG 3.170 . 3.170 2.092 1.981 2.352 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1774 1 86 LYS QE 1 90 LEU MD1 4.630 . 4.630 3.928 3.476 4.648 0.018 36 0 "[ . 1 . 2 . 3 . 4]" 1 1775 1 86 LYS QE 1 90 LEU MD2 3.240 . 3.240 2.331 2.029 2.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1776 1 86 LYS QE 1 135 PHE QD 4.550 . 4.550 2.851 2.495 4.251 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1777 1 86 LYS HE2 1 135 PHE QE 5.500 . 5.500 4.742 3.441 5.521 0.021 35 0 "[ . 1 . 2 . 3 . 4]" 1 1778 1 86 LYS HE3 1 135 PHE QE 5.500 . 5.500 4.014 3.272 5.342 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1779 1 86 LYS QG 1 90 LEU HB3 4.200 . 4.200 2.676 2.253 3.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1780 1 86 LYS QG 1 90 LEU MD2 4.500 . 4.500 2.124 1.959 2.793 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1781 1 86 LYS QG 1 135 PHE QE 4.620 . 4.620 2.903 2.669 3.106 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1782 1 87 ASN H 1 87 ASN QB 3.300 . 3.300 2.173 2.071 2.253 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1783 1 87 ASN H 1 88 MET H 3.680 . 3.680 2.869 2.798 2.957 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1784 1 87 ASN H 1 89 PHE H 4.650 . 4.650 4.301 4.070 4.455 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1785 1 87 ASN H 1 90 LEU H 5.500 . 5.500 5.168 4.952 5.502 0.002 36 0 "[ . 1 . 2 . 3 . 4]" 1 1786 1 87 ASN H 1 90 LEU MD2 4.230 . 4.230 4.138 3.784 4.249 0.019 5 0 "[ . 1 . 2 . 3 . 4]" 1 1787 1 87 ASN HA 1 90 LEU MD2 3.590 . 3.590 2.569 2.170 2.981 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1788 1 87 ASN QB 1 88 MET H 3.430 . 3.430 2.724 2.550 2.875 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1789 1 87 ASN QB 1 90 LEU MD2 4.670 . 4.670 4.235 3.820 4.559 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1790 1 87 ASN QB 1 91 VAL QG 4.800 . 4.800 4.666 4.157 4.856 0.056 3 0 "[ . 1 . 2 . 3 . 4]" 1 1791 1 87 ASN QD 1 90 LEU MD2 5.340 . 5.340 4.086 2.670 5.384 0.044 32 0 "[ . 1 . 2 . 3 . 4]" 1 1792 1 87 ASN QD 1 91 VAL QG 4.180 . 4.180 3.184 2.326 4.188 0.008 32 0 "[ . 1 . 2 . 3 . 4]" 1 1793 1 88 MET H 1 88 MET HB2 3.800 . 3.800 3.527 3.422 3.602 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1794 1 88 MET H 1 88 MET HB3 3.710 . 3.710 2.219 2.086 2.352 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1795 1 88 MET H 1 88 MET ME 5.500 . 5.500 5.094 4.892 5.312 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1796 1 88 MET H 1 88 MET HG2 3.740 . 3.740 3.642 3.390 3.770 0.030 10 0 "[ . 1 . 2 . 3 . 4]" 1 1797 1 88 MET H 1 88 MET HG3 3.970 . 3.970 3.137 2.942 3.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1798 1 88 MET H 1 89 PHE H 3.680 . 3.680 2.484 2.393 2.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1799 1 88 MET H 1 90 LEU H 4.870 . 4.870 4.332 4.168 4.710 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1800 1 88 MET H 1 90 LEU MD2 5.370 . 5.370 4.964 4.752 5.218 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1801 1 88 MET H 1 91 VAL H 5.500 . 5.500 5.199 5.029 5.501 0.001 22 0 "[ . 1 . 2 . 3 . 4]" 1 1802 1 88 MET HA 1 88 MET HG3 3.720 . 3.720 3.671 3.616 3.717 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1803 1 88 MET HB2 1 89 PHE H 4.410 . 4.410 4.242 4.160 4.299 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1804 1 88 MET HB3 1 89 PHE H 4.170 . 4.170 3.685 3.469 3.877 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1805 1 88 MET HB3 1 89 PHE QD 4.930 . 4.930 4.530 3.993 4.936 0.006 24 0 "[ . 1 . 2 . 3 . 4]" 1 1806 1 88 MET ME 1 89 PHE H 4.750 . 4.750 3.984 3.765 4.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1807 1 88 MET ME 1 89 PHE HA 3.100 . 3.100 2.670 2.215 3.105 0.005 37 0 "[ . 1 . 2 . 3 . 4]" 1 1808 1 88 MET ME 1 89 PHE QB 5.080 . 5.080 3.769 3.563 4.025 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1809 1 88 MET ME 1 89 PHE QD 2.960 . 2.960 2.898 2.754 2.965 0.005 37 0 "[ . 1 . 2 . 3 . 4]" 1 1810 1 88 MET ME 1 89 PHE QE 3.300 . 3.300 2.894 2.737 3.031 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1811 1 88 MET ME 1 89 PHE HZ 4.350 . 4.350 3.216 3.026 3.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1812 1 88 MET ME 1 131 ILE MD 4.690 . 4.690 4.303 4.042 4.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1813 1 88 MET HG2 1 89 PHE H 4.500 . 4.500 3.881 3.730 3.976 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1814 1 88 MET HG2 1 89 PHE QD 5.150 . 5.150 3.569 2.848 3.859 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1815 1 88 MET HG3 1 89 PHE H 4.810 . 4.810 2.353 2.171 2.504 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1816 1 88 MET HG3 1 89 PHE QD 5.030 . 5.030 2.611 1.865 3.048 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1817 1 89 PHE H 1 89 PHE HB2 4.000 . 4.000 2.185 2.053 2.285 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1818 1 89 PHE H 1 89 PHE QB 3.510 . 3.510 2.164 2.037 2.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1819 1 89 PHE H 1 89 PHE HB3 4.000 . 4.000 3.501 3.403 3.565 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1820 1 89 PHE H 1 89 PHE QE 5.310 . 5.310 4.794 4.522 5.043 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1821 1 89 PHE H 1 90 LEU H 3.370 . 3.370 2.527 2.352 2.697 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1822 1 89 PHE H 1 90 LEU HB3 4.950 . 4.950 4.561 4.245 4.951 0.001 36 0 "[ . 1 . 2 . 3 . 4]" 1 1823 1 89 PHE H 1 90 LEU MD2 4.890 . 4.890 4.633 4.153 4.810 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1824 1 89 PHE H 1 90 LEU HG 4.910 . 4.910 4.861 4.432 4.921 0.011 3 0 "[ . 1 . 2 . 3 . 4]" 1 1825 1 89 PHE H 1 91 VAL H 4.110 . 4.110 4.009 3.828 4.115 0.005 13 0 "[ . 1 . 2 . 3 . 4]" 1 1826 1 89 PHE H 1 91 VAL QG 4.870 . 4.870 4.708 4.165 4.909 0.039 23 0 "[ . 1 . 2 . 3 . 4]" 1 1827 1 89 PHE H 1 135 PHE QE 5.080 . 5.080 4.222 3.964 4.481 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1828 1 89 PHE HA 1 89 PHE QD 3.520 . 3.520 2.857 2.619 3.063 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1829 1 89 PHE HA 1 89 PHE QE 4.730 . 4.730 4.566 4.462 4.718 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1830 1 89 PHE HA 1 92 GLY H 4.000 . 4.000 3.442 2.990 3.980 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1831 1 89 PHE HA 1 131 ILE MD 4.760 . 4.760 4.643 4.137 4.792 0.032 31 0 "[ . 1 . 2 . 3 . 4]" 1 1832 1 89 PHE HA 1 131 ILE MG 4.880 . 4.880 3.907 3.361 4.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1833 1 89 PHE QB 1 90 LEU H 3.740 . 3.740 2.528 2.383 2.678 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1834 1 89 PHE QB 1 91 VAL H 4.790 . 4.790 4.471 4.205 4.589 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1835 1 89 PHE QB 1 131 ILE MD 4.720 . 4.720 3.189 2.641 3.498 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1836 1 89 PHE QB 1 131 ILE MG 3.800 . 3.800 2.109 2.006 2.228 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1837 1 89 PHE QB 1 135 PHE QE 4.390 . 4.390 2.204 1.995 2.601 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1838 1 89 PHE HB2 1 90 LEU H 4.270 . 4.270 2.626 2.449 2.803 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1839 1 89 PHE HB2 1 131 ILE MG 4.570 . 4.570 3.342 3.089 3.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1840 1 89 PHE HB3 1 90 LEU H 4.270 . 4.270 3.309 2.863 3.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1841 1 89 PHE HB3 1 131 ILE MG 4.570 . 4.570 2.133 2.029 2.247 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1842 1 89 PHE QD 1 90 LEU H 4.480 . 4.480 4.380 4.152 4.502 0.022 30 0 "[ . 1 . 2 . 3 . 4]" 1 1843 1 89 PHE QD 1 131 ILE MD 3.940 . 3.940 2.260 1.991 2.498 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1844 1 89 PHE QD 1 131 ILE HG13 4.720 . 4.720 2.799 2.494 3.980 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1845 1 89 PHE QD 1 131 ILE MG 3.760 . 3.760 2.848 2.093 3.365 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1846 1 89 PHE QD 1 134 ILE MD 4.780 . 4.780 3.849 2.496 4.159 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1847 1 89 PHE QD 1 135 PHE QE 4.390 . 4.390 3.935 3.630 4.158 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1848 1 89 PHE QD 1 135 PHE HZ 4.110 . 4.110 2.998 2.733 3.324 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1849 1 89 PHE QE 1 131 ILE MD 3.930 . 3.930 2.436 2.171 2.904 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1850 1 89 PHE QE 1 134 ILE MD 4.190 . 4.190 4.159 3.070 4.338 0.148 2 0 "[ . 1 . 2 . 3 . 4]" 1 1851 1 89 PHE HZ 1 131 ILE MD 4.720 . 4.720 4.139 3.785 4.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1852 1 90 LEU H 1 90 LEU HB2 3.750 . 3.750 3.528 3.451 3.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1853 1 90 LEU H 1 90 LEU HB3 3.340 . 3.340 2.253 2.120 2.395 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1854 1 90 LEU H 1 90 LEU MD2 3.480 . 3.480 3.186 2.683 3.312 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1855 1 90 LEU H 1 90 LEU HG 3.560 . 3.560 2.879 2.476 3.116 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1856 1 90 LEU H 1 91 VAL QG 4.370 . 4.370 3.984 3.437 4.294 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1857 1 90 LEU HA 1 131 ILE MG 5.030 . 5.030 3.342 2.819 3.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1858 1 90 LEU HA 1 135 PHE QD 4.400 . 4.400 3.848 3.213 4.405 0.005 36 0 "[ . 1 . 2 . 3 . 4]" 1 1859 1 90 LEU HB2 1 91 VAL H 4.220 . 4.220 4.211 4.087 4.237 0.017 12 0 "[ . 1 . 2 . 3 . 4]" 1 1860 1 90 LEU HB3 1 90 LEU MD2 3.160 . 3.160 2.203 2.166 2.272 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1861 1 90 LEU HB3 1 91 VAL H 3.970 . 3.970 3.857 3.689 3.981 0.011 2 0 "[ . 1 . 2 . 3 . 4]" 1 1862 1 90 LEU MD1 1 91 VAL H 3.410 . 3.410 3.426 3.331 3.466 0.056 6 0 "[ . 1 . 2 . 3 . 4]" 1 1863 1 90 LEU MD1 1 91 VAL HA 4.350 . 4.350 3.078 2.850 3.481 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1864 1 90 LEU MD1 1 92 GLY H 5.050 . 5.050 4.973 4.649 5.108 0.058 12 0 "[ . 1 . 2 . 3 . 4]" 1 1865 1 90 LEU MD1 1 135 PHE QD 4.850 . 4.850 4.976 4.882 5.072 0.222 16 0 "[ . 1 . 2 . 3 . 4]" 1 1866 1 90 LEU MD1 1 135 PHE QE 5.160 . 5.160 5.050 4.685 5.203 0.043 3 0 "[ . 1 . 2 . 3 . 4]" 1 1867 1 90 LEU MD2 1 135 PHE QB 5.340 . 5.340 4.958 4.619 5.338 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1868 1 90 LEU MD2 1 135 PHE QE 4.610 . 4.610 4.160 3.333 4.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1869 1 90 LEU HG 1 91 VAL H 3.570 . 3.570 2.438 2.259 2.706 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1870 1 91 VAL H 1 91 VAL HB 3.050 . 3.050 2.462 2.174 3.021 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1871 1 91 VAL H 1 91 VAL QG 2.700 . 2.700 2.291 1.990 2.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1872 1 91 VAL H 1 92 GLY H 3.100 . 3.100 2.368 2.172 2.828 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1873 1 91 VAL H 1 92 GLY QA 5.010 . 5.010 4.269 4.080 4.634 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1874 1 91 VAL HB 1 92 GLY H 4.000 . 4.000 3.135 2.493 4.024 0.024 6 0 "[ . 1 . 2 . 3 . 4]" 1 1875 1 91 VAL QG 1 92 GLY H 3.360 . 3.360 3.141 2.482 3.596 0.236 32 0 "[ . 1 . 2 . 3 . 4]" 1 1876 1 91 VAL QG 1 92 GLY QA 4.450 . 4.450 3.631 2.732 4.150 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1877 1 91 VAL QG 1 93 GLU H 3.840 . 3.840 2.885 1.818 4.091 0.251 5 0 "[ . 1 . 2 . 3 . 4]" 1 1878 1 91 VAL QG 1 94 GLY H 4.610 . 4.610 4.075 2.258 4.850 0.240 22 0 "[ . 1 . 2 . 3 . 4]" 1 1879 1 91 VAL QG 1 94 GLY QA 5.050 . 5.050 4.071 1.943 5.342 0.292 40 0 "[ . 1 . 2 . 3 . 4]" 1 1880 1 92 GLY H 1 93 GLU H 4.130 . 4.130 3.106 2.008 4.186 0.056 3 0 "[ . 1 . 2 . 3 . 4]" 1 1881 1 92 GLY QA 1 93 GLU H 2.870 . 2.870 2.669 2.023 2.927 0.057 12 0 "[ . 1 . 2 . 3 . 4]" 1 1882 1 93 GLU H 1 93 GLU QB 2.900 . 2.900 2.527 2.166 2.944 0.044 14 0 "[ . 1 . 2 . 3 . 4]" 1 1883 1 93 GLU H 1 93 GLU QG 4.130 . 4.130 3.252 1.843 4.142 0.012 38 0 "[ . 1 . 2 . 3 . 4]" 1 1884 1 93 GLU H 1 94 GLY H 4.540 . 4.540 3.413 1.861 4.561 0.021 28 0 "[ . 1 . 2 . 3 . 4]" 1 1885 1 93 GLU HA 1 94 GLY H 3.460 . 3.460 2.956 2.074 3.491 0.031 32 0 "[ . 1 . 2 . 3 . 4]" 1 1886 1 93 GLU QB 1 94 GLY QA 5.180 . 5.180 3.804 3.396 4.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1887 1 93 GLU HB2 1 94 GLY H 4.220 . 4.220 3.560 1.895 4.250 0.030 24 0 "[ . 1 . 2 . 3 . 4]" 1 1888 1 93 GLU HB3 1 94 GLY H 4.220 . 4.220 3.106 1.883 4.239 0.019 12 0 "[ . 1 . 2 . 3 . 4]" 1 1889 1 93 GLU QG 1 94 GLY H 4.430 . 4.430 3.804 2.151 4.482 0.052 12 0 "[ . 1 . 2 . 3 . 4]" 1 1890 1 94 GLY H 1 95 ASP H 5.050 . 5.050 3.539 1.784 4.642 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1891 1 94 GLY QA 1 95 ASP H 2.980 . 2.980 2.464 2.090 2.966 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1892 1 96 SER HA 1 97 VAL H 2.700 . 2.700 2.270 2.091 2.717 0.017 35 0 "[ . 1 . 2 . 3 . 4]" 1 1893 1 96 SER HA 1 97 VAL QG 3.980 . 3.980 3.615 3.188 3.990 0.010 24 0 "[ . 1 . 2 . 3 . 4]" 1 1894 1 96 SER QB 1 97 VAL H 3.370 . 3.370 2.864 1.853 3.412 0.042 4 0 "[ . 1 . 2 . 3 . 4]" 1 1895 1 96 SER HB2 1 97 VAL H 3.970 . 3.970 3.756 2.524 3.991 0.021 25 0 "[ . 1 . 2 . 3 . 4]" 1 1896 1 96 SER HB2 1 97 VAL QG 5.500 . 5.500 4.883 3.662 5.270 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1897 1 96 SER HB3 1 97 VAL H 3.970 . 3.970 3.093 1.870 3.979 0.009 8 0 "[ . 1 . 2 . 3 . 4]" 1 1898 1 96 SER HB3 1 97 VAL QG 5.500 . 5.500 4.431 3.294 5.204 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1899 1 97 VAL H 1 97 VAL HB 2.980 . 2.980 2.674 2.400 2.995 0.015 39 0 "[ . 1 . 2 . 3 . 4]" 1 1900 1 97 VAL H 1 97 VAL QG 2.850 . 2.850 2.201 1.884 2.852 0.002 7 0 "[ . 1 . 2 . 3 . 4]" 1 1901 1 97 VAL HA 1 98 ILE H 2.600 . 2.600 2.171 2.090 2.267 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1902 1 97 VAL HB 1 98 ILE H 4.600 . 4.600 4.223 3.883 4.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1903 1 97 VAL HB 1 99 THR H 5.190 . 5.190 4.480 3.097 5.199 0.009 32 0 "[ . 1 . 2 . 3 . 4]" 1 1904 1 97 VAL QG 1 98 ILE H 2.990 . 2.990 2.710 2.236 3.217 0.227 10 0 "[ . 1 . 2 . 3 . 4]" 1 1905 1 97 VAL QG 1 99 THR H 3.390 . 3.390 2.245 1.648 3.388 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1906 1 97 VAL QG 1 99 THR HA 4.670 . 4.670 3.651 2.847 4.459 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1907 1 98 ILE H 1 98 ILE HB 2.890 . 2.890 2.637 2.288 2.893 0.003 2 0 "[ . 1 . 2 . 3 . 4]" 1 1908 1 98 ILE H 1 98 ILE MD 3.880 . 3.880 3.413 2.922 3.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1909 1 98 ILE H 1 98 ILE HG12 3.800 . 3.800 2.848 1.914 3.763 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1910 1 98 ILE H 1 98 ILE QG 3.150 . 3.150 2.089 1.764 2.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1911 1 98 ILE H 1 98 ILE HG13 3.800 . 3.800 2.707 1.778 3.805 0.005 22 0 "[ . 1 . 2 . 3 . 4]" 1 1912 1 98 ILE H 1 98 ILE MG 3.890 . 3.890 3.823 3.729 3.897 0.007 8 0 "[ . 1 . 2 . 3 . 4]" 1 1913 1 98 ILE H 1 99 THR H 3.120 . 3.120 2.757 2.107 3.160 0.040 9 0 "[ . 1 . 2 . 3 . 4]" 1 1914 1 98 ILE HA 1 98 ILE MD 3.890 . 3.890 3.250 2.096 3.945 0.055 2 0 "[ . 1 . 2 . 3 . 4]" 1 1915 1 98 ILE HA 1 98 ILE HG12 3.940 . 3.940 2.889 2.540 3.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1916 1 98 ILE HA 1 98 ILE HG13 3.940 . 3.940 3.397 2.655 3.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1917 1 98 ILE HA 1 98 ILE MG 2.980 . 2.980 2.353 2.200 2.638 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1918 1 98 ILE HB 1 98 ILE MD 3.370 . 3.370 2.780 2.336 3.327 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1919 1 98 ILE HB 1 99 THR H 4.360 . 4.360 3.283 1.965 4.348 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1920 1 98 ILE QG 1 98 ILE MG 3.150 . 3.150 2.315 2.239 2.443 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1921 1 98 ILE QG 1 99 THR H 4.890 . 4.890 4.161 3.883 4.674 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1922 1 98 ILE HG12 1 98 ILE MG 3.680 . 3.680 2.733 2.283 3.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1923 1 98 ILE HG13 1 98 ILE MG 3.680 . 3.680 2.883 2.306 3.268 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1924 1 98 ILE MG 1 99 THR H 4.290 . 4.290 3.792 2.279 4.315 0.025 37 0 "[ . 1 . 2 . 3 . 4]" 1 1925 1 98 ILE MG 1 99 THR HA 5.400 . 5.400 4.307 3.480 4.842 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1926 1 98 ILE MG 1 100 GLN HA 5.500 . 5.500 4.958 3.244 5.643 0.143 3 0 "[ . 1 . 2 . 3 . 4]" 1 1927 1 98 ILE MG 1 100 GLN QB 5.120 . 5.120 3.735 2.127 5.305 0.185 23 0 "[ . 1 . 2 . 3 . 4]" 1 1928 1 98 ILE MG 1 100 GLN QG 5.500 . 5.500 3.590 1.969 5.634 0.134 16 0 "[ . 1 . 2 . 3 . 4]" 1 1929 1 99 THR H 1 99 THR HB 2.700 . 2.700 2.687 2.562 2.773 0.073 3 0 "[ . 1 . 2 . 3 . 4]" 1 1930 1 99 THR H 1 99 THR MG 3.910 . 3.910 3.179 1.927 3.930 0.020 32 0 "[ . 1 . 2 . 3 . 4]" 1 1931 1 99 THR H 1 100 GLN H 3.970 . 3.970 3.412 1.837 4.031 0.061 4 0 "[ . 1 . 2 . 3 . 4]" 1 1932 1 99 THR HA 1 99 THR MG 3.590 . 3.590 2.846 2.264 3.274 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1933 1 99 THR HA 1 100 GLN H 3.000 . 3.000 2.625 1.870 3.006 0.006 19 0 "[ . 1 . 2 . 3 . 4]" 1 1934 1 99 THR MG 1 100 GLN H 4.230 . 4.230 3.833 2.661 4.264 0.034 32 0 "[ . 1 . 2 . 3 . 4]" 1 1935 1 99 THR MG 1 101 VAL H 5.500 . 5.500 5.079 3.728 5.576 0.076 16 0 "[ . 1 . 2 . 3 . 4]" 1 1936 1 100 GLN H 1 100 GLN HB2 3.690 . 3.690 2.646 2.064 3.629 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1937 1 100 GLN H 1 100 GLN QB 3.130 . 3.130 2.383 2.040 2.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1938 1 100 GLN H 1 100 GLN HB3 3.690 . 3.690 3.243 2.481 3.726 0.036 16 0 "[ . 1 . 2 . 3 . 4]" 1 1939 1 100 GLN H 1 100 GLN QG 4.010 . 4.010 2.807 1.906 4.046 0.036 23 0 "[ . 1 . 2 . 3 . 4]" 1 1940 1 100 GLN H 1 101 VAL H 5.160 . 5.160 4.481 3.468 4.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1941 1 100 GLN HA 1 100 GLN QG 3.670 . 3.670 2.614 2.064 3.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1942 1 100 GLN HA 1 101 VAL H 2.660 . 2.660 2.246 2.086 2.709 0.049 16 0 "[ . 1 . 2 . 3 . 4]" 1 1943 1 100 GLN QB 1 102 LEU H 3.560 . 3.560 2.927 2.211 3.603 0.043 40 0 "[ . 1 . 2 . 3 . 4]" 1 1944 1 100 GLN QG 1 101 VAL H 4.860 . 4.860 3.817 2.287 4.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1945 1 100 GLN QG 1 101 VAL QG 5.500 . 5.500 4.801 2.821 5.470 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1946 1 100 GLN QG 1 102 LEU H 5.160 . 5.160 4.057 2.111 5.167 0.007 16 0 "[ . 1 . 2 . 3 . 4]" 1 1947 1 101 VAL H 1 101 VAL HB 2.960 . 2.960 2.762 2.442 2.984 0.024 12 0 "[ . 1 . 2 . 3 . 4]" 1 1948 1 101 VAL H 1 101 VAL QG 2.930 . 2.930 2.257 1.885 2.771 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1949 1 101 VAL H 1 102 LEU H 3.430 . 3.430 2.939 2.018 3.456 0.026 14 0 "[ . 1 . 2 . 3 . 4]" 1 1950 1 101 VAL H 1 102 LEU QD 4.960 . 4.960 4.757 3.360 5.122 0.162 30 0 "[ . 1 . 2 . 3 . 4]" 1 1951 1 101 VAL HA 1 102 LEU H 3.010 . 3.010 2.698 2.230 3.067 0.057 2 0 "[ . 1 . 2 . 3 . 4]" 1 1952 1 101 VAL QG 1 102 LEU H 3.850 . 3.850 3.581 3.088 3.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1953 1 101 VAL QG 1 103 ASN H 5.500 . 5.500 4.881 3.407 5.572 0.072 10 0 "[ . 1 . 2 . 3 . 4]" 1 1954 1 102 LEU H 1 102 LEU HB2 3.640 . 3.640 2.638 2.083 3.420 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1955 1 102 LEU H 1 102 LEU QB 2.920 . 2.920 2.355 2.060 2.909 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1956 1 102 LEU H 1 102 LEU HB3 3.640 . 3.640 2.821 2.399 3.667 0.027 18 0 "[ . 1 . 2 . 3 . 4]" 1 1957 1 102 LEU H 1 102 LEU QD 4.230 . 4.230 3.676 2.602 4.095 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1958 1 102 LEU H 1 103 ASN H 4.980 . 4.980 4.248 2.265 4.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1959 1 102 LEU HA 1 102 LEU QD 2.800 . 2.800 2.125 1.965 2.484 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1960 1 102 LEU HA 1 103 ASN H 3.120 . 3.120 2.234 2.046 2.905 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1961 1 102 LEU HA 1 103 ASN QB 4.550 . 4.550 4.176 3.950 4.580 0.030 13 0 "[ . 1 . 2 . 3 . 4]" 1 1962 1 102 LEU QB 1 103 ASN H 3.990 . 3.990 3.678 2.272 4.000 0.010 22 0 "[ . 1 . 2 . 3 . 4]" 1 1963 1 102 LEU HB2 1 103 ASN H 4.700 . 4.700 4.325 3.502 4.589 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1964 1 102 LEU HB3 1 103 ASN H 4.700 . 4.700 4.021 2.302 4.436 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1965 1 102 LEU QD 1 103 ASN H 4.440 . 4.440 2.794 2.130 4.434 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1966 1 102 LEU QD 1 103 ASN QB 4.990 . 4.990 4.251 3.176 5.183 0.193 13 0 "[ . 1 . 2 . 3 . 4]" 1 1967 1 102 LEU MD1 1 103 ASN H 5.500 . 5.500 2.937 2.139 5.510 0.010 33 0 "[ . 1 . 2 . 3 . 4]" 1 1968 1 102 LEU MD2 1 103 ASN H 5.500 . 5.500 4.336 2.618 5.509 0.009 35 0 "[ . 1 . 2 . 3 . 4]" 1 1969 1 102 LEU HG 1 103 ASN H 5.470 . 5.470 3.714 1.713 5.470 . 22 0 "[ . 1 . 2 . 3 . 4]" 1 1970 1 103 ASN H 1 103 ASN HB2 3.840 . 3.840 2.983 2.243 3.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1971 1 103 ASN H 1 103 ASN HB3 3.840 . 3.840 2.964 2.404 3.853 0.013 4 0 "[ . 1 . 2 . 3 . 4]" 1 1972 1 103 ASN H 1 104 LYS H 5.290 . 5.290 4.238 2.198 4.693 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1973 1 103 ASN HA 1 104 LYS H 3.270 . 3.270 2.460 2.146 3.356 0.086 20 0 "[ . 1 . 2 . 3 . 4]" 1 1974 1 103 ASN QB 1 104 LYS H 3.910 . 3.910 3.214 1.783 3.950 0.040 15 0 "[ . 1 . 2 . 3 . 4]" 1 1975 1 103 ASN HB2 1 104 LYS H 4.470 . 4.470 3.892 1.968 4.492 0.022 23 0 "[ . 1 . 2 . 3 . 4]" 1 1976 1 103 ASN HB3 1 104 LYS H 4.470 . 4.470 3.577 1.790 4.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1977 1 104 LYS H 1 104 LYS QD 4.290 . 4.290 3.925 2.234 4.313 0.023 16 0 "[ . 1 . 2 . 3 . 4]" 1 1978 1 104 LYS H 1 104 LYS HG2 4.430 . 4.430 2.993 1.868 4.449 0.019 4 0 "[ . 1 . 2 . 3 . 4]" 1 1979 1 104 LYS H 1 104 LYS QG 3.770 . 3.770 2.531 1.851 3.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1980 1 104 LYS H 1 104 LYS HG3 4.430 . 4.430 3.301 2.066 4.443 0.013 25 0 "[ . 1 . 2 . 3 . 4]" 1 1981 1 105 GLU HA 1 106 LEU H 3.170 . 3.170 2.759 2.181 3.203 0.033 15 0 "[ . 1 . 2 . 3 . 4]" 1 1982 1 106 LEU H 1 106 LEU HB2 3.650 . 3.650 2.507 2.043 3.680 0.030 16 0 "[ . 1 . 2 . 3 . 4]" 1 1983 1 106 LEU H 1 106 LEU QB 2.850 . 2.850 2.319 2.018 2.857 0.007 29 0 "[ . 1 . 2 . 3 . 4]" 1 1984 1 106 LEU H 1 106 LEU HB3 3.650 . 3.650 3.137 2.347 3.683 0.033 6 0 "[ . 1 . 2 . 3 . 4]" 1 1985 1 106 LEU H 1 106 LEU MD1 4.950 . 4.950 3.761 2.228 4.846 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1986 1 106 LEU H 1 106 LEU QD 3.990 . 3.990 3.358 2.090 4.023 0.033 6 0 "[ . 1 . 2 . 3 . 4]" 1 1987 1 106 LEU H 1 106 LEU MD2 4.950 . 4.950 4.114 2.098 4.944 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1988 1 106 LEU H 1 106 LEU HG 4.380 . 4.380 4.001 2.141 4.399 0.019 10 0 "[ . 1 . 2 . 3 . 4]" 1 1989 1 106 LEU HA 1 106 LEU QD 3.740 . 3.740 2.564 1.946 3.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1990 1 106 LEU HA 1 106 LEU HG 4.110 . 4.110 2.722 2.298 3.725 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1991 1 106 LEU HA 1 107 SER H 3.200 . 3.200 2.272 2.092 3.201 0.001 26 0 "[ . 1 . 2 . 3 . 4]" 1 1992 1 106 LEU QB 1 107 SER H 4.240 . 4.240 3.395 2.405 4.074 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1993 1 106 LEU HB2 1 107 SER H 4.890 . 4.890 4.225 2.828 4.654 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1994 1 106 LEU HB3 1 107 SER H 4.890 . 4.890 3.699 2.433 4.651 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1995 1 106 LEU QD 1 107 SER H 4.890 . 4.890 3.196 2.061 4.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1996 1 106 LEU HG 1 107 SER H 4.560 . 4.560 3.923 2.178 4.578 0.018 31 0 "[ . 1 . 2 . 3 . 4]" 1 1997 1 107 SER HA 1 108 ASP H 3.480 . 3.480 2.779 2.175 3.506 0.026 16 0 "[ . 1 . 2 . 3 . 4]" 1 1998 1 107 SER HB2 1 108 ASP H 4.580 . 4.580 3.620 2.248 4.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 1999 1 107 SER HB3 1 108 ASP H 4.580 . 4.580 3.805 1.855 4.582 0.002 21 0 "[ . 1 . 2 . 3 . 4]" 1 2000 1 108 ASP H 1 108 ASP QB 3.470 . 3.470 2.702 2.285 3.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2001 1 108 ASP H 1 109 LYS H 3.870 . 3.870 3.161 1.856 3.934 0.064 8 0 "[ . 1 . 2 . 3 . 4]" 1 2002 1 108 ASP HA 1 109 LYS H 2.990 . 2.990 2.715 1.996 3.044 0.054 9 0 "[ . 1 . 2 . 3 . 4]" 1 2003 1 108 ASP QB 1 109 LYS H 4.090 . 4.090 3.754 1.736 4.063 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2004 1 109 LYS H 1 109 LYS QB 3.030 . 3.030 2.526 2.165 3.126 0.096 5 0 "[ . 1 . 2 . 3 . 4]" 1 2005 1 109 LYS H 1 110 LYS H 4.590 . 4.590 4.113 2.431 4.609 0.019 22 0 "[ . 1 . 2 . 3 . 4]" 1 2006 1 109 LYS HA 1 110 LYS H 2.990 . 2.990 2.354 2.051 3.047 0.057 23 0 "[ . 1 . 2 . 3 . 4]" 1 2007 1 110 LYS H 1 111 ASN QB 4.610 . 4.610 4.420 3.741 4.672 0.062 13 0 "[ . 1 . 2 . 3 . 4]" 1 2008 1 110 LYS QB 1 111 ASN H 4.220 . 4.220 3.099 1.888 4.057 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2009 1 111 ASN H 1 111 ASN QB 3.640 . 3.640 2.750 2.137 3.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2010 1 111 ASN HA 1 112 GLU H 3.210 . 3.210 2.586 2.010 3.267 0.057 40 0 "[ . 1 . 2 . 3 . 4]" 1 2011 1 111 ASN QB 1 111 ASN QD 3.050 . 3.050 2.147 2.058 2.729 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2012 1 111 ASN QB 1 112 GLU H 3.760 . 3.760 3.026 1.927 3.762 0.002 7 0 "[ . 1 . 2 . 3 . 4]" 1 2013 1 111 ASN HB2 1 111 ASN HD22 4.010 . 4.010 2.990 2.108 3.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2014 1 111 ASN HB2 1 112 GLU H 4.330 . 4.330 3.735 2.331 4.368 0.038 10 0 "[ . 1 . 2 . 3 . 4]" 1 2015 1 111 ASN HB3 1 111 ASN HD22 4.010 . 4.010 2.421 2.125 3.538 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2016 1 111 ASN HB3 1 112 GLU H 4.330 . 4.330 3.355 2.036 4.332 0.002 18 0 "[ . 1 . 2 . 3 . 4]" 1 2017 1 112 GLU H 1 112 GLU HB2 4.080 . 4.080 3.035 2.162 3.918 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2018 1 112 GLU H 1 112 GLU QB 3.560 . 3.560 2.704 2.142 3.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2019 1 112 GLU H 1 112 GLU HB3 4.080 . 4.080 3.432 2.560 4.077 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2020 1 112 GLU HA 1 113 GLU H 3.220 . 3.220 2.570 2.098 3.274 0.054 18 0 "[ . 1 . 2 . 3 . 4]" 1 2021 1 113 GLU H 1 114 LYS H 3.380 . 3.380 3.206 2.377 3.410 0.030 10 0 "[ . 1 . 2 . 3 . 4]" 1 2022 1 113 GLU HA 1 114 LYS H 2.940 . 2.940 2.552 2.238 2.964 0.024 32 0 "[ . 1 . 2 . 3 . 4]" 1 2023 1 113 GLU QB 1 114 LYS H 4.210 . 4.210 3.935 3.557 4.092 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2024 1 114 LYS H 1 114 LYS QB 2.950 . 2.950 2.552 2.302 3.063 0.113 4 0 "[ . 1 . 2 . 3 . 4]" 1 2025 1 114 LYS H 1 114 LYS QD 4.720 . 4.720 3.923 1.920 4.753 0.033 32 0 "[ . 1 . 2 . 3 . 4]" 1 2026 1 114 LYS H 1 114 LYS HG2 4.650 . 4.650 3.516 2.035 4.652 0.002 32 0 "[ . 1 . 2 . 3 . 4]" 1 2027 1 114 LYS H 1 114 LYS QG 4.060 . 4.060 2.686 1.921 4.062 0.002 8 0 "[ . 1 . 2 . 3 . 4]" 1 2028 1 114 LYS H 1 114 LYS HG3 4.650 . 4.650 3.052 1.936 4.671 0.021 8 0 "[ . 1 . 2 . 3 . 4]" 1 2029 1 114 LYS H 1 115 ASP H 3.670 . 3.670 2.676 1.950 3.675 0.005 33 0 "[ . 1 . 2 . 3 . 4]" 1 2030 1 114 LYS QB 1 115 ASP H 4.370 . 4.370 3.320 1.844 4.076 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2031 1 114 LYS HB2 1 115 ASP H 5.050 . 5.050 3.615 1.892 4.543 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2032 1 114 LYS HB3 1 115 ASP H 5.050 . 5.050 4.033 2.554 4.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2033 1 114 LYS HG2 1 115 ASP H 5.500 . 5.500 4.752 2.565 5.503 0.003 11 0 "[ . 1 . 2 . 3 . 4]" 1 2034 1 114 LYS HG3 1 115 ASP H 5.500 . 5.500 4.566 2.888 5.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2035 1 115 ASP H 1 115 ASP HB2 4.160 . 4.160 2.936 2.196 3.896 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2036 1 115 ASP H 1 115 ASP QB 3.400 . 3.400 2.651 2.171 3.327 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2037 1 115 ASP H 1 115 ASP HB3 4.160 . 4.160 3.385 2.581 4.001 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2038 1 115 ASP H 1 116 LEU H 4.170 . 4.170 3.861 2.959 4.208 0.038 30 0 "[ . 1 . 2 . 3 . 4]" 1 2039 1 115 ASP HA 1 116 LEU H 2.830 . 2.830 2.365 2.025 2.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2040 1 115 ASP HA 1 117 PHE H 4.230 . 4.230 3.441 2.895 4.237 0.007 18 0 "[ . 1 . 2 . 3 . 4]" 1 2041 1 115 ASP QB 1 116 LEU H 4.070 . 4.070 3.659 2.221 4.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2042 1 115 ASP QB 1 117 PHE H 4.950 . 4.950 3.727 2.494 4.850 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2043 1 115 ASP HB2 1 116 LEU H 4.630 . 4.630 4.298 2.239 4.631 0.001 19 0 "[ . 1 . 2 . 3 . 4]" 1 2044 1 115 ASP HB3 1 116 LEU H 4.630 . 4.630 4.032 3.080 4.637 0.007 4 0 "[ . 1 . 2 . 3 . 4]" 1 2045 1 116 LEU H 1 116 LEU HB2 3.710 . 3.710 2.562 2.375 3.719 0.009 5 0 "[ . 1 . 2 . 3 . 4]" 1 2046 1 116 LEU H 1 116 LEU QB 2.940 . 2.940 2.476 2.343 2.867 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2047 1 116 LEU H 1 116 LEU HB3 3.710 . 3.710 3.626 2.710 3.764 0.054 15 0 "[ . 1 . 2 . 3 . 4]" 1 2048 1 116 LEU H 1 116 LEU MD1 4.260 . 4.260 3.799 3.369 4.221 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2049 1 116 LEU H 1 116 LEU QD 3.740 . 3.740 3.320 2.926 3.709 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2050 1 116 LEU H 1 116 LEU MD2 4.260 . 4.260 3.677 3.029 4.127 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2051 1 116 LEU H 1 116 LEU HG 3.290 . 3.290 2.686 2.114 3.310 0.020 15 0 "[ . 1 . 2 . 3 . 4]" 1 2052 1 116 LEU H 1 117 PHE H 3.200 . 3.200 2.325 1.727 3.205 0.005 20 0 "[ . 1 . 2 . 3 . 4]" 1 2053 1 116 LEU H 1 117 PHE QD 5.440 . 5.440 4.175 2.331 5.485 0.045 9 0 "[ . 1 . 2 . 3 . 4]" 1 2054 1 116 LEU HA 1 116 LEU MD1 4.370 . 4.370 3.895 3.618 3.943 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2055 1 116 LEU HA 1 116 LEU QD 3.260 . 3.260 2.255 2.103 3.429 0.169 5 0 "[ . 1 . 2 . 3 . 4]" 1 2056 1 116 LEU HA 1 116 LEU MD2 4.370 . 4.370 2.297 2.112 4.055 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2057 1 116 LEU HA 1 116 LEU HG 3.980 . 3.980 3.158 2.296 3.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2058 1 116 LEU QB 1 116 LEU HG 2.570 . 2.570 2.394 2.359 2.531 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2059 1 116 LEU QB 1 117 PHE H 3.500 . 3.500 3.340 2.579 3.647 0.147 20 0 "[ . 1 . 2 . 3 . 4]" 1 2060 1 116 LEU HB2 1 117 PHE H 4.370 . 4.370 3.528 2.633 4.114 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2061 1 116 LEU HB3 1 117 PHE H 4.370 . 4.370 4.198 3.677 4.376 0.006 16 0 "[ . 1 . 2 . 3 . 4]" 1 2062 1 116 LEU QD 1 117 PHE H 4.590 . 4.590 4.315 3.162 4.517 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2063 1 116 LEU MD1 1 117 PHE H 5.500 . 5.500 5.059 3.300 5.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2064 1 116 LEU MD2 1 117 PHE H 5.500 . 5.500 4.717 3.916 4.899 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2065 1 117 PHE H 1 117 PHE HB2 3.680 . 3.680 2.736 2.055 3.682 0.002 36 0 "[ . 1 . 2 . 3 . 4]" 1 2066 1 117 PHE H 1 117 PHE QB 2.910 . 2.910 2.507 2.034 2.923 0.013 7 0 "[ . 1 . 2 . 3 . 4]" 1 2067 1 117 PHE H 1 117 PHE HB3 3.680 . 3.680 3.366 2.335 3.718 0.038 23 0 "[ . 1 . 2 . 3 . 4]" 1 2068 1 117 PHE H 1 117 PHE QD 3.970 . 3.970 3.118 1.978 4.048 0.078 16 0 "[ . 1 . 2 . 3 . 4]" 1 2069 1 117 PHE HA 1 117 PHE QD 3.950 . 3.950 2.861 2.059 3.769 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2070 1 117 PHE HA 1 118 GLY H 3.220 . 3.220 2.460 2.036 3.260 0.040 24 0 "[ . 1 . 2 . 3 . 4]" 1 2071 1 117 PHE HB2 1 118 GLY H 4.520 . 4.520 3.677 2.253 4.526 0.006 1 0 "[ . 1 . 2 . 3 . 4]" 1 2072 1 117 PHE HB3 1 118 GLY H 4.520 . 4.520 3.130 1.645 4.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2073 1 118 GLY QA 1 119 SER H 3.430 . 3.430 2.436 2.203 2.952 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2074 1 119 SER H 1 119 SER HB2 4.080 . 4.080 3.201 2.381 3.988 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2075 1 119 SER H 1 119 SER HB3 4.080 . 4.080 3.403 2.490 4.052 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2076 1 119 SER H 1 120 ASP H 5.070 . 5.070 3.991 1.520 4.700 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2077 1 119 SER HA 1 120 ASP H 3.360 . 3.360 2.552 2.147 3.310 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2078 1 119 SER QB 1 120 ASP H 4.360 . 4.360 3.050 1.694 4.103 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2079 1 119 SER HB2 1 120 ASP H 5.050 . 5.050 3.627 2.212 4.645 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2080 1 119 SER HB3 1 120 ASP H 5.050 . 5.050 3.571 1.725 4.712 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2081 1 120 ASP H 1 121 SER H 4.590 . 4.590 4.102 2.213 4.607 0.017 13 0 "[ . 1 . 2 . 3 . 4]" 1 2082 1 120 ASP HA 1 121 SER H 3.070 . 3.070 2.472 2.137 3.097 0.027 10 0 "[ . 1 . 2 . 3 . 4]" 1 2083 1 120 ASP QB 1 121 SER H 4.240 . 4.240 3.360 1.972 4.052 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2084 1 121 SER H 1 121 SER QB 3.180 . 3.180 2.750 2.207 3.281 0.101 6 0 "[ . 1 . 2 . 3 . 4]" 1 2085 1 121 SER H 1 122 GLU H 4.560 . 4.560 3.920 2.291 4.603 0.043 10 0 "[ . 1 . 2 . 3 . 4]" 1 2086 1 121 SER HA 1 122 GLU H 2.900 . 2.900 2.475 2.075 2.926 0.026 8 0 "[ . 1 . 2 . 3 . 4]" 1 2087 1 121 SER QB 1 122 GLU H 4.170 . 4.170 3.304 1.907 4.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2088 1 122 GLU H 1 122 GLU QB 3.690 . 3.690 2.676 2.100 3.395 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2089 1 122 GLU H 1 122 GLU QG 3.590 . 3.590 2.737 1.917 3.609 0.019 18 0 "[ . 1 . 2 . 3 . 4]" 1 2090 1 122 GLU H 1 123 SER H 4.990 . 4.990 4.376 2.725 4.704 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2091 1 122 GLU HA 1 123 SER H 3.110 . 3.110 2.468 2.088 3.118 0.008 4 0 "[ . 1 . 2 . 3 . 4]" 1 2092 1 122 GLU QB 1 123 SER H 3.790 . 3.790 2.662 1.688 3.793 0.003 1 0 "[ . 1 . 2 . 3 . 4]" 1 2093 1 122 GLU HB2 1 123 SER H 4.320 . 4.320 3.497 2.260 4.332 0.012 13 0 "[ . 1 . 2 . 3 . 4]" 1 2094 1 122 GLU HB3 1 123 SER H 4.320 . 4.320 3.075 1.707 4.351 0.031 1 0 "[ . 1 . 2 . 3 . 4]" 1 2095 1 122 GLU QG 1 123 SER H 4.870 . 4.870 3.961 3.188 4.655 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2096 1 123 SER H 1 123 SER QB 3.500 . 3.500 2.814 2.219 3.476 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2097 1 123 SER H 1 124 GLY H 5.360 . 5.360 4.235 2.559 4.675 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2098 1 123 SER HA 1 124 GLY H 3.210 . 3.210 2.399 2.107 3.219 0.009 24 0 "[ . 1 . 2 . 3 . 4]" 1 2099 1 123 SER HA 1 125 ASN H 4.840 . 4.840 3.841 2.926 4.844 0.004 34 0 "[ . 1 . 2 . 3 . 4]" 1 2100 1 123 SER QB 1 124 GLY H 4.140 . 4.140 3.111 1.984 4.051 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2101 1 124 GLY H 1 125 ASN H 3.920 . 3.920 2.410 1.725 3.632 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2102 1 124 GLY QA 1 125 ASN H 3.030 . 3.030 2.723 2.187 2.953 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2103 1 124 GLY QA 1 126 GLU H 5.150 . 5.150 4.226 3.317 5.236 0.086 28 0 "[ . 1 . 2 . 3 . 4]" 1 2104 1 125 ASN H 1 125 ASN HB2 3.980 . 3.980 2.807 2.282 3.593 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2105 1 125 ASN H 1 125 ASN QB 3.400 . 3.400 2.589 2.256 3.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2106 1 125 ASN H 1 125 ASN HB3 3.980 . 3.980 3.445 2.654 3.998 0.018 24 0 "[ . 1 . 2 . 3 . 4]" 1 2107 1 125 ASN H 1 126 GLU H 3.620 . 3.620 3.485 2.711 3.690 0.070 10 0 "[ . 1 . 2 . 3 . 4]" 1 2108 1 125 ASN H 1 126 GLU HA 4.950 . 4.950 4.652 4.191 4.978 0.028 4 0 "[ . 1 . 2 . 3 . 4]" 1 2109 1 125 ASN H 1 126 GLU QB 5.170 . 5.170 4.948 4.291 5.209 0.039 25 0 "[ . 1 . 2 . 3 . 4]" 1 2110 1 125 ASN QB 1 126 GLU H 4.160 . 4.160 3.443 1.499 4.055 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2111 1 125 ASN QB 1 127 GLU H 4.400 . 4.400 4.026 3.149 4.417 0.017 39 0 "[ . 1 . 2 . 3 . 4]" 1 2112 1 125 ASN QB 1 128 GLU H 3.830 . 3.830 3.194 2.645 3.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2113 1 125 ASN HB2 1 126 GLU H 4.730 . 4.730 4.039 1.992 4.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2114 1 125 ASN HB2 1 128 GLU H 4.600 . 4.600 4.194 2.911 4.633 0.033 30 0 "[ . 1 . 2 . 3 . 4]" 1 2115 1 125 ASN HB3 1 126 GLU H 4.730 . 4.730 3.808 1.503 4.671 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2116 1 125 ASN HB3 1 128 GLU H 4.600 . 4.600 3.520 2.681 4.643 0.043 28 0 "[ . 1 . 2 . 3 . 4]" 1 2117 1 126 GLU H 1 126 GLU HB2 3.350 . 3.350 2.388 2.066 2.886 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2118 1 126 GLU H 1 126 GLU QB 2.790 . 2.790 2.199 2.030 2.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2119 1 126 GLU H 1 126 GLU HB3 3.350 . 3.350 2.642 2.466 2.981 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2120 1 126 GLU H 1 126 GLU QG 4.310 . 4.310 3.976 3.810 4.155 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2121 1 126 GLU H 1 127 GLU H 3.210 . 3.210 2.753 2.190 3.213 0.003 27 0 "[ . 1 . 2 . 3 . 4]" 1 2122 1 126 GLU H 1 127 GLU QG 4.920 . 4.920 4.550 3.777 5.005 0.085 10 0 "[ . 1 . 2 . 3 . 4]" 1 2123 1 126 GLU HA 1 126 GLU QG 3.260 . 3.260 2.416 2.225 2.680 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2124 1 126 GLU HA 1 128 GLU H 5.240 . 5.240 4.423 4.072 4.783 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2125 1 126 GLU QB 1 127 GLU H 3.820 . 3.820 2.615 1.995 2.954 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2126 1 126 GLU QG 1 130 LEU QD 3.640 . 3.640 3.486 2.912 3.770 0.130 19 0 "[ . 1 . 2 . 3 . 4]" 1 2127 1 127 GLU H 1 127 GLU QB 2.740 . 2.740 2.322 1.889 2.755 0.015 27 0 "[ . 1 . 2 . 3 . 4]" 1 2128 1 127 GLU H 1 127 GLU QG 3.110 . 3.110 2.529 1.838 3.174 0.064 1 0 "[ . 1 . 2 . 3 . 4]" 1 2129 1 127 GLU H 1 128 GLU H 3.070 . 3.070 2.503 2.223 2.699 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2130 1 127 GLU H 1 130 LEU H 4.930 . 4.930 4.749 4.590 4.938 0.008 30 0 "[ . 1 . 2 . 3 . 4]" 1 2131 1 127 GLU QB 1 128 GLU H 3.200 . 3.200 3.286 3.223 3.393 0.193 5 0 "[ . 1 . 2 . 3 . 4]" 1 2132 1 127 GLU QB 1 131 ILE MD 4.640 . 4.640 4.103 3.542 4.594 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2133 1 127 GLU QG 1 128 GLU H 3.040 . 3.040 2.333 1.961 2.915 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2134 1 127 GLU QG 1 131 ILE MD 4.640 . 4.640 4.035 2.732 4.692 0.052 3 0 "[ . 1 . 2 . 3 . 4]" 1 2135 1 128 GLU H 1 128 GLU QB 3.260 . 3.260 2.305 2.084 2.575 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2136 1 128 GLU H 1 129 ASN H 3.350 . 3.350 2.713 2.547 2.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2137 1 128 GLU H 1 130 LEU H 4.720 . 4.720 3.959 3.832 4.114 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2138 1 128 GLU HA 1 131 ILE HB 4.300 . 4.300 3.074 2.613 3.755 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2139 1 128 GLU HA 1 131 ILE HG13 5.030 . 5.030 3.033 2.719 3.659 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2140 1 128 GLU QB 1 129 ASN H 3.170 . 3.170 2.683 2.435 2.925 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2141 1 128 GLU QB 1 130 LEU H 5.340 . 5.340 4.555 4.408 4.662 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2142 1 129 ASN H 1 129 ASN HB2 3.370 . 3.370 2.401 2.166 2.467 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2143 1 129 ASN H 1 129 ASN HB3 3.800 . 3.800 3.585 3.404 3.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2144 1 129 ASN H 1 129 ASN HD21 5.000 . 5.000 4.318 3.879 4.698 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2145 1 129 ASN H 1 129 ASN HD22 4.390 . 4.390 3.859 2.977 4.445 0.055 28 0 "[ . 1 . 2 . 3 . 4]" 1 2146 1 129 ASN H 1 130 LEU H 3.300 . 3.300 2.492 2.338 2.570 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2147 1 129 ASN H 1 130 LEU HB2 4.740 . 4.740 4.351 4.128 4.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2148 1 129 ASN H 1 130 LEU HB3 5.430 . 5.430 5.417 5.286 5.440 0.010 28 0 "[ . 1 . 2 . 3 . 4]" 1 2149 1 129 ASN H 1 131 ILE H 4.640 . 4.640 4.008 3.855 4.168 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2150 1 129 ASN H 1 132 ALA MB 4.910 . 4.910 4.944 4.859 5.015 0.105 9 0 "[ . 1 . 2 . 3 . 4]" 1 2151 1 129 ASN HA 1 132 ALA H 4.480 . 4.480 3.203 3.035 3.306 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2152 1 129 ASN HA 1 132 ALA MB 3.560 . 3.560 2.685 2.523 2.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2153 1 129 ASN HB2 1 130 LEU H 3.840 . 3.840 2.776 2.731 2.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2154 1 129 ASN HB2 1 130 LEU HA 4.370 . 4.370 4.379 4.372 4.392 0.022 20 0 "[ . 1 . 2 . 3 . 4]" 1 2155 1 129 ASN HB2 1 130 LEU QD 5.300 . 5.300 4.101 3.751 4.300 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2156 1 129 ASN HB2 1 132 ALA MB 5.170 . 5.170 4.953 4.775 5.070 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2157 1 129 ASN HB3 1 130 LEU H 3.720 . 3.720 3.728 3.721 3.739 0.019 9 0 "[ . 1 . 2 . 3 . 4]" 1 2158 1 129 ASN HB3 1 130 LEU HA 5.500 . 5.500 4.410 4.292 4.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2159 1 129 ASN HB3 1 132 ALA H 5.370 . 5.370 5.001 4.751 5.182 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2160 1 129 ASN HB3 1 132 ALA MB 4.520 . 4.520 3.983 3.678 4.163 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2161 1 129 ASN HD21 1 132 ALA MB 4.940 . 4.940 4.929 4.592 5.001 0.061 3 0 "[ . 1 . 2 . 3 . 4]" 1 2162 1 129 ASN HD22 1 132 ALA MB 4.240 . 4.240 3.583 3.324 4.001 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2163 1 130 LEU H 1 130 LEU HB2 2.990 . 2.990 2.094 2.046 2.128 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2164 1 130 LEU H 1 130 LEU HB3 3.270 . 3.270 3.109 3.047 3.225 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2165 1 130 LEU H 1 130 LEU MD1 4.420 . 4.420 4.324 4.210 4.371 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2166 1 130 LEU H 1 130 LEU QD 3.490 . 3.490 3.259 2.988 3.360 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2167 1 130 LEU H 1 130 LEU MD2 4.420 . 4.420 3.371 3.057 3.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2168 1 130 LEU H 1 131 ILE H 3.270 . 3.270 2.591 2.506 2.653 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2169 1 130 LEU H 1 131 ILE HA 5.500 . 5.500 5.236 5.183 5.285 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2170 1 130 LEU H 1 131 ILE HB 5.500 . 5.500 4.946 4.806 5.043 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2171 1 130 LEU H 1 131 ILE MD 5.490 . 5.490 4.566 4.250 4.804 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2172 1 130 LEU H 1 131 ILE HG12 4.700 . 4.700 4.122 3.871 4.215 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2173 1 130 LEU H 1 132 ALA H 4.380 . 4.380 4.053 3.972 4.130 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2174 1 130 LEU H 1 132 ALA MB 4.830 . 4.830 4.778 4.704 4.833 0.003 2 0 "[ . 1 . 2 . 3 . 4]" 1 2175 1 130 LEU HA 1 130 LEU MD1 2.930 . 2.930 2.312 2.106 2.439 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2176 1 130 LEU HA 1 130 LEU MD2 2.930 . 2.930 2.123 2.067 2.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2177 1 130 LEU HA 1 130 LEU HG 3.670 . 3.670 3.675 3.671 3.683 0.013 2 0 "[ . 1 . 2 . 3 . 4]" 1 2178 1 130 LEU HA 1 132 ALA H 4.500 . 4.500 4.167 3.964 4.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2179 1 130 LEU HA 1 133 ASP H 4.140 . 4.140 3.228 3.087 3.368 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2180 1 130 LEU HA 1 133 ASP QB 3.670 . 3.670 2.588 2.358 2.858 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2181 1 130 LEU HA 1 134 ILE MD 5.320 . 5.320 5.252 5.117 5.326 0.006 19 0 "[ . 1 . 2 . 3 . 4]" 1 2182 1 130 LEU HB2 1 130 LEU MD1 3.660 . 3.660 3.226 3.214 3.242 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2183 1 130 LEU HB2 1 130 LEU QD 3.040 . 3.040 2.299 2.243 2.340 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2184 1 130 LEU HB2 1 130 LEU MD2 3.660 . 3.660 2.353 2.289 2.403 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2185 1 130 LEU HB2 1 131 ILE H 3.640 . 3.640 3.352 3.176 3.427 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2186 1 130 LEU HB2 1 134 ILE MD 5.500 . 5.500 5.525 5.506 5.570 0.070 28 0 "[ . 1 . 2 . 3 . 4]" 1 2187 1 130 LEU HB2 1 134 ILE MG 5.500 . 5.500 5.180 5.001 5.363 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2188 1 130 LEU HB3 1 131 ILE H 3.460 . 3.460 2.854 2.733 3.005 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2189 1 130 LEU HB3 1 131 ILE HA 4.900 . 4.900 3.886 3.844 3.940 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2190 1 130 LEU HB3 1 131 ILE MD 4.300 . 4.300 2.901 2.718 3.134 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2191 1 130 LEU HB3 1 132 ALA H 5.050 . 5.050 4.995 4.931 5.051 0.001 40 0 "[ . 1 . 2 . 3 . 4]" 1 2192 1 130 LEU HB3 1 134 ILE MD 4.220 . 4.220 4.031 4.003 4.085 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2193 1 130 LEU HB3 1 134 ILE MG 4.780 . 4.780 3.953 3.734 4.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2194 1 130 LEU QD 1 131 ILE H 3.940 . 3.940 3.977 3.929 4.038 0.098 19 0 "[ . 1 . 2 . 3 . 4]" 1 2195 1 130 LEU QD 1 131 ILE HA 4.600 . 4.600 4.119 3.988 4.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2196 1 130 LEU QD 1 133 ASP QB 3.780 . 3.780 2.609 2.369 2.862 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2197 1 130 LEU QD 1 134 ILE H 4.430 . 4.430 3.444 3.339 3.780 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2198 1 130 LEU QD 1 134 ILE HA 5.260 . 5.260 4.565 4.389 4.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2199 1 130 LEU QD 1 134 ILE MG 3.040 . 3.040 2.194 2.093 2.588 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2200 1 130 LEU MD1 1 131 ILE H 4.800 . 4.800 4.272 4.189 4.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2201 1 130 LEU MD1 1 133 ASP QB 4.420 . 4.420 2.703 2.417 3.039 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2202 1 130 LEU MD2 1 131 ILE H 4.800 . 4.800 4.743 4.619 4.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2203 1 130 LEU MD2 1 133 ASP QB 4.420 . 4.420 3.463 3.222 3.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2204 1 130 LEU HG 1 134 ILE MG 5.340 . 5.340 4.509 4.382 4.869 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2205 1 131 ILE H 1 131 ILE HB 3.070 . 3.070 2.649 2.599 2.751 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2206 1 131 ILE H 1 131 ILE MD 3.670 . 3.670 2.802 2.565 2.961 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2207 1 131 ILE H 1 131 ILE HG12 3.430 . 3.430 2.141 1.929 2.180 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2208 1 131 ILE H 1 131 ILE HG13 3.660 . 3.660 3.661 3.510 3.676 0.016 12 0 "[ . 1 . 2 . 3 . 4]" 1 2209 1 131 ILE H 1 131 ILE MG 3.900 . 3.900 3.822 3.790 3.840 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2210 1 131 ILE H 1 132 ALA H 3.250 . 3.250 2.629 2.571 2.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2211 1 131 ILE H 1 132 ALA MB 4.480 . 4.480 4.248 4.097 4.322 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2212 1 131 ILE H 1 134 ILE MD 4.550 . 4.550 4.278 4.191 4.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2213 1 131 ILE HA 1 131 ILE MD 3.250 . 3.250 2.196 2.147 2.255 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2214 1 131 ILE HA 1 131 ILE HG12 3.800 . 3.800 3.325 3.257 3.448 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2215 1 131 ILE HA 1 131 ILE HG13 3.850 . 3.850 3.741 3.702 3.850 0.000 29 0 "[ . 1 . 2 . 3 . 4]" 1 2216 1 131 ILE HA 1 131 ILE MG 3.030 . 3.030 2.385 2.330 2.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2217 1 131 ILE HA 1 132 ALA H 3.560 . 3.560 3.513 3.467 3.540 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2218 1 131 ILE HA 1 132 ALA MB 5.130 . 5.130 4.956 4.898 4.991 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2219 1 131 ILE HA 1 133 ASP H 4.420 . 4.420 4.232 4.129 4.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2220 1 131 ILE HA 1 134 ILE MD 3.170 . 3.170 2.059 1.996 2.128 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2221 1 131 ILE HA 1 134 ILE QG 3.880 . 3.880 2.130 2.040 2.256 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2222 1 131 ILE HA 1 135 PHE QD 5.390 . 5.390 4.864 4.661 5.014 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2223 1 131 ILE HB 1 131 ILE MD 3.270 . 3.270 3.280 3.270 3.288 0.018 28 0 "[ . 1 . 2 . 3 . 4]" 1 2224 1 131 ILE HB 1 132 ALA H 3.480 . 3.480 2.753 2.656 2.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2225 1 131 ILE HB 1 132 ALA MB 4.260 . 4.260 3.931 3.814 4.006 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2226 1 131 ILE MD 1 132 ALA H 4.770 . 4.770 4.529 4.422 4.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2227 1 131 ILE MD 1 134 ILE MD 3.390 . 3.390 2.291 2.147 2.537 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2228 1 131 ILE MD 1 134 ILE MG 4.120 . 4.120 3.980 3.747 4.148 0.028 29 0 "[ . 1 . 2 . 3 . 4]" 1 2229 1 131 ILE MD 1 135 PHE QE 4.680 . 4.680 4.312 4.057 4.556 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2230 1 131 ILE HG12 1 131 ILE MG 3.240 . 3.240 3.187 3.160 3.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2231 1 131 ILE HG12 1 132 ALA H 4.410 . 4.410 4.143 3.945 4.222 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2232 1 131 ILE HG13 1 131 ILE MG 3.240 . 3.240 2.236 2.190 2.326 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2233 1 131 ILE HG13 1 132 ALA H 5.080 . 5.080 5.056 4.926 5.087 0.007 11 0 "[ . 1 . 2 . 3 . 4]" 1 2234 1 131 ILE MG 1 132 ALA H 3.900 . 3.900 3.686 3.589 3.814 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2235 1 131 ILE MG 1 132 ALA HA 4.720 . 4.720 3.680 3.537 3.864 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2236 1 131 ILE MG 1 134 ILE MD 3.610 . 3.610 2.384 2.228 2.490 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2237 1 131 ILE MG 1 134 ILE MG 4.900 . 4.900 4.871 4.760 4.946 0.046 22 0 "[ . 1 . 2 . 3 . 4]" 1 2238 1 131 ILE MG 1 135 PHE H 4.840 . 4.840 4.518 4.343 4.717 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2239 1 131 ILE MG 1 135 PHE QB 5.340 . 5.340 3.970 3.664 4.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2240 1 131 ILE MG 1 135 PHE QD 3.490 . 3.490 2.885 2.642 3.173 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2241 1 131 ILE MG 1 135 PHE QE 3.780 . 3.780 2.428 2.231 2.601 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2242 1 131 ILE MG 1 135 PHE HZ 5.070 . 5.070 3.234 2.799 3.641 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2243 1 132 ALA H 1 132 ALA MB 2.590 . 2.590 2.168 2.046 2.207 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2244 1 132 ALA H 1 133 ASP QB 4.410 . 4.410 4.350 4.193 4.417 0.007 6 0 "[ . 1 . 2 . 3 . 4]" 1 2245 1 132 ALA H 1 134 ILE MD 5.500 . 5.500 4.941 4.832 5.047 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2246 1 132 ALA HA 1 134 ILE H 4.820 . 4.820 4.770 4.658 4.824 0.004 3 0 "[ . 1 . 2 . 3 . 4]" 1 2247 1 132 ALA HA 1 135 PHE H 4.680 . 4.680 3.835 3.648 3.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2248 1 132 ALA MB 1 133 ASP H 3.190 . 3.190 2.648 2.495 2.763 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2249 1 132 ALA MB 1 133 ASP HA 3.930 . 3.930 3.867 3.798 3.932 0.002 40 0 "[ . 1 . 2 . 3 . 4]" 1 2250 1 132 ALA MB 1 133 ASP QB 4.120 . 4.120 3.835 3.722 3.944 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2251 1 132 ALA MB 1 134 ILE MD 5.500 . 5.500 5.690 5.591 5.791 0.291 2 0 "[ . 1 . 2 . 3 . 4]" 1 2252 1 132 ALA MB 1 135 PHE QD 5.420 . 5.420 5.341 4.960 5.448 0.028 15 0 "[ . 1 . 2 . 3 . 4]" 1 2253 1 133 ASP H 1 133 ASP QB 3.020 . 3.020 2.145 2.037 2.235 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2254 1 133 ASP H 1 134 ILE H 3.400 . 3.400 2.631 2.561 2.680 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2255 1 133 ASP H 1 134 ILE MD 5.500 . 5.500 4.991 4.850 5.066 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2256 1 133 ASP H 1 134 ILE HG12 4.920 . 4.920 3.744 3.646 3.814 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2257 1 133 ASP H 1 134 ILE QG 4.130 . 4.130 3.636 3.554 3.693 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2258 1 133 ASP H 1 134 ILE HG13 4.920 . 4.920 4.933 4.925 4.946 0.026 10 0 "[ . 1 . 2 . 3 . 4]" 1 2259 1 133 ASP H 1 134 ILE MG 4.770 . 4.770 4.187 4.070 4.318 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2260 1 133 ASP H 1 135 PHE H 4.900 . 4.900 3.975 3.815 4.088 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2261 1 133 ASP HA 1 134 ILE MG 5.480 . 5.480 5.015 4.944 5.105 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2262 1 133 ASP HA 1 136 GLY H 4.610 . 4.610 3.287 3.131 3.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2263 1 133 ASP QB 1 134 ILE H 3.660 . 3.660 2.577 2.412 2.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2264 1 133 ASP QB 1 134 ILE MD 5.130 . 5.130 5.056 4.866 5.156 0.026 22 0 "[ . 1 . 2 . 3 . 4]" 1 2265 1 133 ASP QB 1 134 ILE MG 4.840 . 4.840 3.319 3.105 3.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2266 1 134 ILE H 1 134 ILE HB 3.640 . 3.640 3.620 3.599 3.642 0.002 40 0 "[ . 1 . 2 . 3 . 4]" 1 2267 1 134 ILE H 1 134 ILE MD 3.560 . 3.560 3.533 3.447 3.576 0.016 3 0 "[ . 1 . 2 . 3 . 4]" 1 2268 1 134 ILE H 1 134 ILE HG12 3.800 . 3.800 1.899 1.831 1.933 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2269 1 134 ILE H 1 134 ILE QG 3.170 . 3.170 1.879 1.816 1.913 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2270 1 134 ILE H 1 134 ILE HG13 3.800 . 3.800 2.986 2.924 3.066 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2271 1 134 ILE H 1 134 ILE MG 3.450 . 3.450 2.235 2.173 2.326 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2272 1 134 ILE H 1 135 PHE H 3.490 . 3.490 2.669 2.544 2.746 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2273 1 134 ILE H 1 135 PHE QD 5.170 . 5.170 5.011 4.794 5.138 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2274 1 134 ILE H 1 136 GLY H 4.340 . 4.340 4.025 3.811 4.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2275 1 134 ILE HA 1 134 ILE MG 3.080 . 3.080 2.272 2.248 2.313 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2276 1 134 ILE HA 1 135 PHE QD 5.500 . 5.500 4.620 4.498 4.791 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2277 1 134 ILE HB 1 134 ILE MD 3.250 . 3.250 2.431 2.375 2.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2278 1 134 ILE HB 1 135 PHE H 3.920 . 3.920 3.928 3.911 3.940 0.020 5 0 "[ . 1 . 2 . 3 . 4]" 1 2279 1 134 ILE HB 1 135 PHE QD 4.710 . 4.710 3.532 3.382 3.652 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2280 1 134 ILE MD 1 134 ILE MG 2.770 . 2.770 2.172 2.114 2.204 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2281 1 134 ILE MD 1 135 PHE H 3.930 . 3.930 3.983 3.947 4.023 0.093 28 0 "[ . 1 . 2 . 3 . 4]" 1 2282 1 134 ILE MD 1 135 PHE QD 4.610 . 4.610 3.533 3.367 3.640 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2283 1 134 ILE MD 1 135 PHE QE 4.080 . 4.080 2.719 2.597 2.864 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2284 1 134 ILE QG 1 134 ILE MG 3.090 . 3.090 2.241 2.202 2.295 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2285 1 134 ILE QG 1 135 PHE H 4.400 . 4.400 2.301 2.264 2.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2286 1 134 ILE QG 1 135 PHE QD 4.460 . 4.460 2.711 2.432 2.943 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2287 1 134 ILE MG 1 135 PHE H 4.190 . 4.190 4.072 4.022 4.121 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2288 1 134 ILE MG 1 135 PHE HA 5.500 . 5.500 5.501 5.462 5.518 0.018 8 0 "[ . 1 . 2 . 3 . 4]" 1 2289 1 134 ILE MG 1 135 PHE QD 4.850 . 4.850 4.783 4.656 4.860 0.010 10 0 "[ . 1 . 2 . 3 . 4]" 1 2290 1 134 ILE MG 1 135 PHE QE 4.840 . 4.840 4.836 4.659 4.902 0.062 18 0 "[ . 1 . 2 . 3 . 4]" 1 2291 1 135 PHE H 1 135 PHE HB2 4.190 . 4.190 2.492 2.377 2.600 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2292 1 135 PHE H 1 135 PHE QB 3.330 . 3.330 2.454 2.346 2.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2293 1 135 PHE H 1 135 PHE HB3 4.190 . 4.190 3.685 3.607 3.741 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2294 1 135 PHE H 1 135 PHE QD 4.010 . 4.010 3.287 3.148 3.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2295 1 135 PHE HA 1 135 PHE QD 4.020 . 4.020 2.001 1.922 2.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2296 1 135 PHE HB2 1 136 GLY H 4.740 . 4.740 3.295 3.040 3.555 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2297 1 135 PHE HB3 1 136 GLY H 4.740 . 4.740 4.124 3.974 4.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2298 1 135 PHE QD 1 136 GLY H 4.670 . 4.670 4.621 4.537 4.679 0.009 23 0 "[ . 1 . 2 . 3 . 4]" 1 2299 1 136 GLY H 1 137 GLU H 4.210 . 4.210 2.508 2.256 3.020 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2300 1 137 GLU H 1 137 GLU QB 3.540 . 3.540 2.530 2.046 3.395 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2301 1 137 GLU HA 1 137 GLU HG2 4.050 . 4.050 3.022 2.241 3.740 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2302 1 137 GLU HA 1 137 GLU QG 3.480 . 3.480 2.547 2.111 3.234 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2303 1 137 GLU HA 1 137 GLU HG3 4.050 . 4.050 2.995 2.135 4.009 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2304 1 138 SER H 1 139 GLY H 4.520 . 4.520 2.654 1.751 4.297 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2305 1 138 SER HA 1 139 GLY H 3.360 . 3.360 3.203 2.254 3.381 0.021 18 0 "[ . 1 . 2 . 3 . 4]" 1 2306 1 138 SER HB2 1 139 GLY H 5.370 . 5.370 3.821 3.269 4.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2307 1 138 SER HB3 1 139 GLY H 5.370 . 5.370 4.324 2.925 4.570 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2308 1 139 GLY H 1 140 ASP H 3.690 . 3.690 2.739 2.014 3.693 0.003 36 0 "[ . 1 . 2 . 3 . 4]" 1 2309 1 139 GLY H 1 140 ASP HA 5.250 . 5.250 4.454 3.880 5.272 0.022 26 0 "[ . 1 . 2 . 3 . 4]" 1 2310 1 139 GLY H 1 141 GLU H 5.500 . 5.500 4.892 4.111 5.504 0.004 36 0 "[ . 1 . 2 . 3 . 4]" 1 2311 1 139 GLY QA 1 140 ASP H 2.920 . 2.920 2.648 2.178 2.944 0.024 14 0 "[ . 1 . 2 . 3 . 4]" 1 2312 1 139 GLY QA 1 141 GLU H 3.910 . 3.910 3.275 2.866 3.892 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2313 1 139 GLY QA 1 141 GLU QB 5.180 . 5.180 3.934 3.416 4.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2314 1 139 GLY QA 1 142 GLU H 4.550 . 4.550 3.448 2.978 4.055 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2315 1 139 GLY HA2 1 142 GLU H 5.290 . 5.290 3.843 3.112 4.534 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2316 1 139 GLY HA3 1 142 GLU H 5.290 . 5.290 4.003 3.370 5.293 0.003 26 0 "[ . 1 . 2 . 3 . 4]" 1 2317 1 140 ASP H 1 140 ASP QB 3.230 . 3.230 2.197 2.041 2.503 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2318 1 140 ASP H 1 141 GLU H 3.100 . 3.100 2.580 1.824 2.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2319 1 140 ASP H 1 142 GLU H 4.830 . 4.830 4.198 3.714 4.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2320 1 140 ASP HA 1 142 GLU H 3.900 . 3.900 3.800 3.595 3.934 0.034 26 0 "[ . 1 . 2 . 3 . 4]" 1 2321 1 140 ASP HB2 1 141 GLU H 3.700 . 3.700 3.595 2.589 3.733 0.033 28 0 "[ . 1 . 2 . 3 . 4]" 1 2322 1 140 ASP HB2 1 142 GLU H 5.500 . 5.500 5.402 4.815 5.518 0.018 3 0 "[ . 1 . 2 . 3 . 4]" 1 2323 1 140 ASP HB3 1 141 GLU H 3.700 . 3.700 3.052 2.427 3.739 0.039 10 0 "[ . 1 . 2 . 3 . 4]" 1 2324 1 140 ASP HB3 1 142 GLU H 5.500 . 5.500 5.009 4.673 5.483 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2325 1 141 GLU H 1 141 GLU HA 2.830 . 2.830 2.833 2.679 2.854 0.024 30 0 "[ . 1 . 2 . 3 . 4]" 1 2326 1 141 GLU H 1 141 GLU QB 2.820 . 2.820 2.287 2.045 2.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2327 1 141 GLU H 1 142 GLU H 3.030 . 3.030 2.698 2.442 2.942 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2328 1 141 GLU QB 1 142 GLU H 3.120 . 3.120 3.041 2.852 3.173 0.053 26 0 "[ . 1 . 2 . 3 . 4]" 1 2329 1 143 GLU H 1 143 GLU HB2 3.480 . 3.480 2.581 2.094 3.216 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2330 1 143 GLU H 1 143 GLU QB 2.730 . 2.730 2.336 2.065 2.721 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2331 1 143 GLU H 1 143 GLU HB3 3.480 . 3.480 2.767 2.360 3.490 0.010 1 0 "[ . 1 . 2 . 3 . 4]" 1 2332 1 143 GLU HA 1 144 GLU H 2.610 . 2.610 2.314 2.098 2.664 0.054 5 0 "[ . 1 . 2 . 3 . 4]" 1 2333 1 143 GLU QB 1 144 GLU H 4.340 . 4.340 3.885 2.759 4.086 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2334 1 144 GLU H 1 144 GLU HB2 3.950 . 3.950 2.823 1.983 3.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2335 1 144 GLU H 1 144 GLU QB 3.200 . 3.200 2.390 1.967 3.202 0.002 4 0 "[ . 1 . 2 . 3 . 4]" 1 2336 1 144 GLU H 1 144 GLU HB3 3.950 . 3.950 3.171 2.301 4.000 0.050 4 0 "[ . 1 . 2 . 3 . 4]" 1 2337 1 144 GLU H 1 144 GLU QG 3.450 . 3.450 2.595 1.882 3.473 0.023 22 0 "[ . 1 . 2 . 3 . 4]" 1 2338 1 144 GLU H 1 145 GLU H 4.500 . 4.500 4.127 2.321 4.538 0.038 6 0 "[ . 1 . 2 . 3 . 4]" 1 2339 1 144 GLU HA 1 145 GLU H 3.100 . 3.100 2.569 2.070 3.197 0.097 2 0 "[ . 1 . 2 . 3 . 4]" 1 2340 1 144 GLU QB 1 145 GLU H 3.760 . 3.760 2.563 1.625 3.837 0.077 40 0 "[ . 1 . 2 . 3 . 4]" 1 2341 1 144 GLU QG 1 145 GLU H 4.030 . 4.030 3.588 2.145 4.118 0.088 10 0 "[ . 1 . 2 . 3 . 4]" 1 2342 1 145 GLU H 1 145 GLU HB2 3.770 . 3.770 2.767 2.404 3.361 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2343 1 145 GLU H 1 145 GLU QB 3.070 . 3.070 2.480 2.200 3.095 0.025 31 0 "[ . 1 . 2 . 3 . 4]" 1 2344 1 145 GLU H 1 145 GLU HB3 3.770 . 3.770 2.852 2.411 3.779 0.009 31 0 "[ . 1 . 2 . 3 . 4]" 1 2345 1 145 GLU H 1 145 GLU QG 4.530 . 4.530 4.055 3.906 4.533 0.003 25 0 "[ . 1 . 2 . 3 . 4]" 1 2346 1 145 GLU H 1 146 PHE H 4.880 . 4.880 4.115 2.867 4.674 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2347 1 145 GLU HA 1 145 GLU HG2 4.090 . 4.090 3.213 2.794 3.848 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2348 1 145 GLU HA 1 145 GLU HG3 4.090 . 4.090 2.454 2.193 3.198 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2349 1 145 GLU HA 1 146 PHE H 3.460 . 3.460 2.135 1.998 2.631 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2350 1 145 GLU QB 1 146 PHE H 3.860 . 3.860 3.801 2.871 3.945 0.085 28 0 "[ . 1 . 2 . 3 . 4]" 1 2351 1 145 GLU HB2 1 146 PHE H 4.430 . 4.430 4.313 3.829 4.445 0.015 3 0 "[ . 1 . 2 . 3 . 4]" 1 2352 1 145 GLU HB3 1 146 PHE H 4.430 . 4.430 4.233 2.966 4.424 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2353 1 145 GLU QG 1 147 THR MG 4.040 . 4.040 2.605 2.132 3.723 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2354 1 145 GLU HG2 1 146 PHE H 4.280 . 4.280 3.717 1.677 4.287 0.007 33 0 "[ . 1 . 2 . 3 . 4]" 1 2355 1 145 GLU HG3 1 146 PHE H 4.280 . 4.280 3.341 2.338 4.284 0.004 29 0 "[ . 1 . 2 . 3 . 4]" 1 2356 1 146 PHE H 1 146 PHE QD 4.490 . 4.490 4.160 3.899 4.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2357 1 146 PHE H 1 147 THR H 4.660 . 4.660 4.415 3.817 4.619 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2358 1 146 PHE HA 1 147 THR MG 4.380 . 4.380 4.074 3.887 4.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2359 1 146 PHE QB 1 147 THR H 4.480 . 4.480 3.852 3.728 3.933 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2360 1 146 PHE QD 1 147 THR H 4.450 . 4.450 3.671 3.415 3.914 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2361 1 146 PHE QE 1 149 PHE QD 4.670 . 4.670 3.358 2.917 3.714 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2362 1 146 PHE QE 1 149 PHE QE 4.300 . 4.300 3.145 2.917 3.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2363 1 147 THR H 1 147 THR MG 3.750 . 3.750 3.153 2.842 3.460 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2364 1 147 THR HA 1 147 THR MG 2.730 . 2.730 2.350 2.236 2.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2365 1 149 PHE H 1 149 PHE QD 4.390 . 4.390 3.085 2.777 3.493 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2366 1 149 PHE H 1 154 LEU MD2 5.500 . 5.500 4.778 4.273 5.489 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2367 1 149 PHE HA 1 149 PHE QD 3.910 . 3.910 2.786 2.606 2.977 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2368 1 149 PHE HA 1 149 PHE QE 4.590 . 4.590 4.563 4.426 4.609 0.019 19 0 "[ . 1 . 2 . 3 . 4]" 1 2369 1 149 PHE HA 1 150 ASN HB2 4.460 . 4.460 4.169 3.871 4.318 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2370 1 149 PHE HA 1 150 ASN HB3 5.440 . 5.440 5.072 4.739 5.400 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2371 1 149 PHE QB 1 154 LEU MD1 4.520 . 4.520 3.767 3.425 4.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2372 1 149 PHE QB 1 154 LEU HG 4.380 . 4.380 3.891 3.589 4.284 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2373 1 149 PHE HB2 1 154 LEU MD1 5.230 . 5.230 4.133 3.675 4.612 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2374 1 149 PHE HB2 1 154 LEU MD2 4.230 . 4.230 2.791 2.318 3.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2375 1 149 PHE HB3 1 154 LEU MD1 5.230 . 5.230 4.361 3.877 5.247 0.017 5 0 "[ . 1 . 2 . 3 . 4]" 1 2376 1 149 PHE HB3 1 154 LEU MD2 4.230 . 4.230 2.645 2.240 3.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2377 1 149 PHE QD 1 150 ASN H 4.810 . 4.810 3.715 3.215 3.930 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2378 1 149 PHE QD 1 153 ASP HB2 4.480 . 4.480 3.761 2.949 4.276 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2379 1 149 PHE QD 1 153 ASP HB3 4.480 . 4.480 3.425 2.475 3.978 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2380 1 149 PHE QD 1 154 LEU MD2 4.010 . 4.010 3.799 3.490 4.181 0.171 10 0 "[ . 1 . 2 . 3 . 4]" 1 2381 1 149 PHE QE 1 153 ASP QB 5.340 . 5.340 4.933 3.999 5.346 0.006 32 0 "[ . 1 . 2 . 3 . 4]" 1 2382 1 150 ASN H 1 153 ASP H 4.690 . 4.690 4.193 3.440 4.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2383 1 150 ASN HA 1 152 GLU H 4.480 . 4.480 4.315 3.925 4.491 0.011 38 0 "[ . 1 . 2 . 3 . 4]" 1 2384 1 150 ASN HB2 1 151 GLN H 4.310 . 4.310 4.109 3.974 4.279 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2385 1 150 ASN HB2 1 152 GLU H 4.990 . 4.990 4.504 4.012 4.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2386 1 150 ASN HB3 1 151 GLN H 4.170 . 4.170 3.296 2.913 3.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2387 1 150 ASN HB3 1 152 GLU H 4.250 . 4.250 2.900 2.344 3.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2388 1 150 ASN HB3 1 153 ASP H 3.530 . 3.530 3.067 2.405 3.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2389 1 150 ASN QD 1 152 GLU QG 5.340 . 5.340 3.833 2.355 4.979 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2390 1 151 GLN H 1 151 GLN HB2 3.730 . 3.730 2.708 2.286 3.648 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2391 1 151 GLN H 1 151 GLN QB 3.070 . 3.070 2.266 2.034 2.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2392 1 151 GLN H 1 151 GLN HB3 3.730 . 3.730 2.519 2.062 2.978 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2393 1 151 GLN H 1 151 GLN QG 4.080 . 4.080 3.645 1.754 4.054 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2394 1 151 GLN H 1 154 LEU MD1 4.730 . 4.730 4.639 4.380 4.749 0.019 2 0 "[ . 1 . 2 . 3 . 4]" 1 2395 1 151 GLN H 1 154 LEU MD2 5.500 . 5.500 5.515 5.300 5.563 0.063 10 0 "[ . 1 . 2 . 3 . 4]" 1 2396 1 151 GLN HA 1 151 GLN QG 3.610 . 3.610 2.687 2.341 3.505 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2397 1 151 GLN HA 1 153 ASP H 4.360 . 4.360 3.909 3.569 4.240 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2398 1 151 GLN HA 1 154 LEU H 4.120 . 4.120 3.484 3.206 3.833 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2399 1 151 GLN HA 1 154 LEU QB 4.320 . 4.320 3.403 3.090 3.825 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2400 1 151 GLN HA 1 154 LEU MD1 3.260 . 3.260 2.431 2.171 2.646 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2401 1 151 GLN HA 1 154 LEU MD2 4.300 . 4.300 3.901 3.580 4.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2402 1 151 GLN HA 1 154 LEU HG 4.040 . 4.040 2.398 2.048 2.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2403 1 151 GLN QB 1 152 GLU H 3.890 . 3.890 2.890 2.589 3.743 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2404 1 151 GLN QE 1 152 GLU HA 4.540 . 4.540 4.312 2.350 4.597 0.057 3 0 "[ . 1 . 2 . 3 . 4]" 1 2405 1 151 GLN QG 1 152 GLU H 4.210 . 4.210 3.602 2.130 4.219 0.009 39 0 "[ . 1 . 2 . 3 . 4]" 1 2406 1 151 GLN QG 1 154 LEU MD1 5.080 . 5.080 3.449 2.528 5.076 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2407 1 152 GLU H 1 152 GLU HB2 3.660 . 3.660 3.141 2.399 3.661 0.001 14 0 "[ . 1 . 2 . 3 . 4]" 1 2408 1 152 GLU H 1 152 GLU HB3 3.660 . 3.660 2.971 2.280 3.617 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2409 1 152 GLU H 1 152 GLU QG 3.360 . 3.360 2.217 1.705 2.634 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2410 1 152 GLU H 1 153 ASP H 3.390 . 3.390 2.620 2.450 2.762 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2411 1 152 GLU H 1 153 ASP QB 5.320 . 5.320 4.301 4.108 4.705 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2412 1 152 GLU H 1 154 LEU H 4.430 . 4.430 4.080 3.932 4.296 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2413 1 152 GLU HA 1 152 GLU QG 3.690 . 3.690 3.006 2.336 3.498 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2414 1 152 GLU QB 1 153 ASP H 3.610 . 3.610 3.273 2.585 3.652 0.042 15 0 "[ . 1 . 2 . 3 . 4]" 1 2415 1 152 GLU HB2 1 153 ASP H 4.120 . 4.120 3.533 2.626 4.121 0.001 33 0 "[ . 1 . 2 . 3 . 4]" 1 2416 1 152 GLU HB3 1 153 ASP H 4.120 . 4.120 4.040 3.802 4.145 0.025 40 0 "[ . 1 . 2 . 3 . 4]" 1 2417 1 152 GLU QG 1 153 ASP H 4.120 . 4.120 3.109 2.198 4.184 0.064 22 0 "[ . 1 . 2 . 3 . 4]" 1 2418 1 152 GLU QG 1 154 LEU H 5.500 . 5.500 4.805 4.317 5.502 0.002 17 0 "[ . 1 . 2 . 3 . 4]" 1 2419 1 153 ASP H 1 153 ASP HB2 3.860 . 3.860 2.420 2.085 2.790 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2420 1 153 ASP H 1 153 ASP QB 3.200 . 3.200 2.192 2.035 2.358 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2421 1 153 ASP H 1 153 ASP HB3 3.860 . 3.860 2.618 2.203 3.614 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2422 1 153 ASP H 1 154 LEU H 3.120 . 3.120 2.456 2.282 2.639 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2423 1 153 ASP H 1 154 LEU MD2 4.740 . 4.740 4.167 3.841 4.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2424 1 153 ASP H 1 154 LEU HG 4.030 . 4.030 3.569 3.281 3.957 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2425 1 153 ASP HA 1 154 LEU MD2 4.820 . 4.820 4.564 4.308 4.830 0.010 5 0 "[ . 1 . 2 . 3 . 4]" 1 2426 1 153 ASP HA 1 155 GLU H 4.670 . 4.670 4.560 4.132 4.679 0.009 38 0 "[ . 1 . 2 . 3 . 4]" 1 2427 1 153 ASP QB 1 154 LEU MD2 3.960 . 3.960 2.689 2.396 3.204 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2428 1 153 ASP QB 1 154 LEU HG 4.810 . 4.810 3.306 3.030 3.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2429 1 153 ASP HB2 1 154 LEU H 4.060 . 4.060 4.000 3.192 4.076 0.016 19 0 "[ . 1 . 2 . 3 . 4]" 1 2430 1 153 ASP HB2 1 154 LEU MD2 4.630 . 4.630 4.186 2.962 4.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2431 1 153 ASP HB3 1 154 LEU H 4.060 . 4.060 3.164 2.792 3.985 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2432 1 153 ASP HB3 1 154 LEU MD2 4.630 . 4.630 2.735 2.416 3.405 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2433 1 154 LEU H 1 154 LEU HB2 3.890 . 3.890 2.771 2.616 3.030 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2434 1 154 LEU H 1 154 LEU QB 3.330 . 3.330 2.696 2.562 2.916 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2435 1 154 LEU H 1 154 LEU HB3 3.890 . 3.890 3.703 3.612 3.794 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2436 1 154 LEU H 1 154 LEU MD1 3.760 . 3.760 3.732 3.475 3.806 0.046 10 0 "[ . 1 . 2 . 3 . 4]" 1 2437 1 154 LEU H 1 154 LEU MD2 3.520 . 3.520 3.089 2.884 3.295 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2438 1 154 LEU H 1 154 LEU HG 3.060 . 3.060 2.248 1.896 2.427 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2439 1 154 LEU H 1 155 GLU H 3.300 . 3.300 2.118 1.890 2.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2440 1 154 LEU HA 1 154 LEU MD1 4.740 . 4.740 3.941 3.800 4.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2441 1 154 LEU HA 1 154 LEU MD2 2.760 . 2.760 2.499 2.280 2.763 0.003 33 0 "[ . 1 . 2 . 3 . 4]" 1 2442 1 154 LEU HA 1 154 LEU HG 3.820 . 3.820 3.488 3.405 3.603 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2443 1 154 LEU QB 1 154 LEU MD1 3.040 . 3.040 2.042 1.971 2.088 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2444 1 154 LEU QB 1 154 LEU MD2 2.830 . 2.830 2.369 2.253 2.422 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2445 1 154 LEU QB 1 155 GLU H 3.580 . 3.580 2.658 2.439 3.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2446 1 154 LEU HB2 1 154 LEU MD2 3.280 . 3.280 3.227 3.188 3.267 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2447 1 154 LEU HB2 1 155 GLU H 4.350 . 4.350 2.702 2.468 3.269 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2448 1 154 LEU HB3 1 154 LEU MD2 3.280 . 3.280 2.437 2.304 2.502 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2449 1 154 LEU HB3 1 155 GLU H 4.350 . 4.350 3.955 3.742 4.330 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2450 1 154 LEU MD1 1 155 GLU H 4.520 . 4.520 4.336 4.051 4.548 0.028 19 0 "[ . 1 . 2 . 3 . 4]" 1 2451 1 154 LEU MD1 1 155 GLU QG 4.320 . 4.320 3.700 3.097 4.144 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2452 1 154 LEU MD2 1 155 GLU H 4.510 . 4.510 4.480 4.321 4.542 0.032 16 0 "[ . 1 . 2 . 3 . 4]" 1 2453 1 154 LEU HG 1 155 GLU H 4.400 . 4.400 3.774 3.325 4.039 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2454 1 155 GLU H 1 155 GLU QB 3.280 . 3.280 2.825 2.384 3.319 0.039 10 0 "[ . 1 . 2 . 3 . 4]" 1 2455 1 155 GLU H 1 155 GLU HG2 4.270 . 4.270 3.443 2.258 4.274 0.004 33 0 "[ . 1 . 2 . 3 . 4]" 1 2456 1 155 GLU H 1 155 GLU QG 3.470 . 3.470 2.748 2.235 3.472 0.002 29 0 "[ . 1 . 2 . 3 . 4]" 1 2457 1 155 GLU H 1 155 GLU HG3 4.270 . 4.270 3.221 2.497 4.005 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2458 1 155 GLU H 1 156 GLU H 3.970 . 3.970 3.779 3.137 4.030 0.060 16 0 "[ . 1 . 2 . 3 . 4]" 1 2459 1 155 GLU HA 1 156 GLU H 2.440 . 2.440 2.246 2.050 2.468 0.028 3 0 "[ . 1 . 2 . 3 . 4]" 1 2460 1 156 GLU H 1 156 GLU QB 2.770 . 2.770 2.473 2.056 2.798 0.028 19 0 "[ . 1 . 2 . 3 . 4]" 1 2461 1 156 GLU H 1 156 GLU QG 3.370 . 3.370 2.327 1.846 3.379 0.009 36 0 "[ . 1 . 2 . 3 . 4]" 1 2462 1 156 GLU H 1 157 GLU H 5.340 . 5.340 3.735 1.942 4.694 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2463 1 156 GLU HA 1 157 GLU H 3.150 . 3.150 2.637 2.024 3.247 0.097 12 0 "[ . 1 . 2 . 3 . 4]" 1 2464 1 156 GLU QB 1 157 GLU H 3.910 . 3.910 3.343 2.279 3.994 0.084 15 0 "[ . 1 . 2 . 3 . 4]" 1 2465 1 157 GLU H 1 157 GLU QB 3.490 . 3.490 2.741 2.110 3.422 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2466 1 157 GLU H 1 157 GLU QG 3.970 . 3.970 2.762 2.003 4.046 0.076 10 0 "[ . 1 . 2 . 3 . 4]" 1 2467 1 157 GLU H 1 158 LYS H 5.500 . 5.500 3.638 2.022 4.767 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2468 1 157 GLU QB 1 158 LYS H 3.990 . 3.990 2.917 1.708 3.995 0.005 2 0 "[ . 1 . 2 . 3 . 4]" 1 2469 1 157 GLU HB2 1 158 LYS H 4.660 . 4.660 3.602 1.990 4.664 0.004 2 0 "[ . 1 . 2 . 3 . 4]" 1 2470 1 157 GLU HB3 1 158 LYS H 4.660 . 4.660 3.367 1.713 4.464 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2471 1 157 GLU QG 1 158 LYS H 4.290 . 4.290 3.744 2.528 4.338 0.048 31 0 "[ . 1 . 2 . 3 . 4]" 1 2472 1 158 LYS H 1 158 LYS QB 3.040 . 3.040 2.685 2.183 3.122 0.082 11 0 "[ . 1 . 2 . 3 . 4]" 1 2473 1 158 LYS H 1 158 LYS HG2 5.340 . 5.340 4.036 2.289 5.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2474 1 158 LYS H 1 158 LYS QG 4.570 . 4.570 3.440 2.210 4.404 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2475 1 158 LYS H 1 158 LYS HG3 5.340 . 5.340 4.032 2.345 4.826 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2476 1 158 LYS HA 1 158 LYS QE 4.520 . 4.520 4.066 2.281 4.547 0.027 7 0 "[ . 1 . 2 . 3 . 4]" 1 2477 1 158 LYS HA 1 159 GLY H 2.940 . 2.940 2.349 1.983 2.957 0.017 9 0 "[ . 1 . 2 . 3 . 4]" 1 2478 1 158 LYS QB 1 159 GLY H 3.740 . 3.740 2.762 1.813 3.752 0.012 4 0 "[ . 1 . 2 . 3 . 4]" 1 2479 1 158 LYS HB2 1 159 GLY H 4.250 . 4.250 3.799 2.389 4.273 0.023 16 0 "[ . 1 . 2 . 3 . 4]" 1 2480 1 158 LYS HB3 1 159 GLY H 4.250 . 4.250 2.945 1.821 4.206 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2481 1 158 LYS QD 1 159 GLY H 4.690 . 4.690 4.043 2.554 4.731 0.041 12 0 "[ . 1 . 2 . 3 . 4]" 1 2482 1 158 LYS HD2 1 159 GLY H 5.500 . 5.500 4.691 2.575 5.512 0.012 25 0 "[ . 1 . 2 . 3 . 4]" 1 2483 1 158 LYS HD3 1 159 GLY H 5.500 . 5.500 4.595 3.187 5.510 0.010 40 0 "[ . 1 . 2 . 3 . 4]" 1 2484 1 158 LYS QG 1 159 GLY H 4.510 . 4.510 3.444 1.632 4.572 0.062 16 0 "[ . 1 . 2 . 3 . 4]" 1 2485 1 159 GLY QA 1 160 GLU H 2.870 . 2.870 2.329 2.085 2.882 0.012 19 0 "[ . 1 . 2 . 3 . 4]" 1 2486 1 159 GLY QA 1 160 GLU QB 5.180 . 5.180 3.998 3.548 4.713 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2487 1 159 GLY HA2 1 160 GLU H 3.570 . 3.570 2.680 2.119 3.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2488 1 159 GLY HA3 1 160 GLU H 3.570 . 3.570 2.721 2.146 3.552 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2489 1 160 GLU H 1 160 GLU HB2 4.090 . 4.090 3.051 2.057 3.995 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2490 1 160 GLU H 1 160 GLU HB3 4.090 . 4.090 3.458 2.552 4.059 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2491 1 160 GLU HA 1 161 THR H 2.980 . 2.980 2.443 2.094 3.003 0.023 10 0 "[ . 1 . 2 . 3 . 4]" 1 2492 1 160 GLU HB2 1 161 THR H 4.300 . 4.300 3.635 2.463 4.312 0.012 13 0 "[ . 1 . 2 . 3 . 4]" 1 2493 1 160 GLU HB3 1 161 THR H 4.300 . 4.300 3.432 1.859 4.325 0.025 10 0 "[ . 1 . 2 . 3 . 4]" 1 2494 1 161 THR H 1 161 THR HB 3.670 . 3.670 3.082 2.422 3.679 0.009 13 0 "[ . 1 . 2 . 3 . 4]" 1 2495 1 161 THR H 1 161 THR MG 4.020 . 4.020 3.294 2.063 4.021 0.001 5 0 "[ . 1 . 2 . 3 . 4]" 1 2496 1 161 THR H 1 162 GLN H 4.850 . 4.850 3.713 1.700 4.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2497 1 161 THR HA 1 162 GLN H 3.530 . 3.530 2.602 2.079 3.546 0.016 5 0 "[ . 1 . 2 . 3 . 4]" 1 2498 1 161 THR HB 1 162 GLN H 4.180 . 4.180 3.847 2.067 4.212 0.032 10 0 "[ . 1 . 2 . 3 . 4]" 1 2499 1 161 THR MG 1 162 GLN H 4.360 . 4.360 3.256 2.404 4.401 0.041 15 0 "[ . 1 . 2 . 3 . 4]" 1 2500 1 162 GLN H 1 162 GLN HB2 4.070 . 4.070 3.022 2.300 3.987 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2501 1 162 GLN H 1 162 GLN QB 3.370 . 3.370 2.720 2.274 3.393 0.023 39 0 "[ . 1 . 2 . 3 . 4]" 1 2502 1 162 GLN H 1 162 GLN HB3 4.070 . 4.070 3.441 2.536 4.079 0.009 40 0 "[ . 1 . 2 . 3 . 4]" 1 2503 1 162 GLN H 1 162 GLN QG 4.430 . 4.430 3.362 2.082 4.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2504 1 162 GLN H 1 163 VAL H 4.840 . 4.840 4.417 3.552 4.695 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2505 1 162 GLN HA 1 162 GLN QG 3.940 . 3.940 2.588 2.181 3.567 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2506 1 162 GLN HA 1 163 VAL H 2.570 . 2.570 2.336 2.157 2.624 0.054 5 0 "[ . 1 . 2 . 3 . 4]" 1 2507 1 162 GLN QB 1 163 VAL H 3.810 . 3.810 2.978 2.044 3.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2508 1 162 GLN HB2 1 163 VAL H 4.350 . 4.350 3.828 2.658 4.395 0.045 10 0 "[ . 1 . 2 . 3 . 4]" 1 2509 1 162 GLN HB3 1 163 VAL H 4.350 . 4.350 3.271 2.067 4.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2510 1 162 GLN QG 1 163 VAL H 5.210 . 5.210 3.384 1.952 4.557 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2511 1 163 VAL H 1 163 VAL HB 3.270 . 3.270 3.043 2.479 3.285 0.015 12 0 "[ . 1 . 2 . 3 . 4]" 1 2512 1 163 VAL H 1 163 VAL QG 3.090 . 3.090 2.463 1.864 3.177 0.087 18 0 "[ . 1 . 2 . 3 . 4]" 1 2513 1 163 VAL H 1 164 LYS H 4.290 . 4.290 4.303 4.283 4.337 0.047 5 0 "[ . 1 . 2 . 3 . 4]" 1 2514 1 163 VAL HA 1 164 LYS H 2.530 . 2.530 2.282 1.957 2.532 0.002 16 0 "[ . 1 . 2 . 3 . 4]" 1 2515 1 163 VAL HB 1 164 LYS H 4.340 . 4.340 4.067 3.725 4.254 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2516 1 163 VAL QG 1 164 LYS H 3.490 . 3.490 2.318 1.980 2.870 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2517 1 163 VAL QG 1 165 GLU H 4.740 . 4.740 4.526 4.086 4.945 0.205 3 0 "[ . 1 . 2 . 3 . 4]" 1 2518 1 164 LYS H 1 164 LYS HB2 3.780 . 3.780 2.934 2.439 3.804 0.024 8 0 "[ . 1 . 2 . 3 . 4]" 1 2519 1 164 LYS H 1 164 LYS QB 3.060 . 3.060 2.673 2.389 3.103 0.043 8 0 "[ . 1 . 2 . 3 . 4]" 1 2520 1 164 LYS H 1 164 LYS HB3 3.780 . 3.780 3.512 2.423 3.798 0.018 12 0 "[ . 1 . 2 . 3 . 4]" 1 2521 1 164 LYS H 1 164 LYS QD 5.080 . 5.080 4.483 2.296 5.117 0.037 3 0 "[ . 1 . 2 . 3 . 4]" 1 2522 1 164 LYS H 1 164 LYS QG 4.080 . 4.080 3.283 2.229 4.101 0.021 25 0 "[ . 1 . 2 . 3 . 4]" 1 2523 1 164 LYS HA 1 165 GLU H 2.620 . 2.620 2.244 1.993 2.493 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2524 1 164 LYS QB 1 165 GLU H 3.590 . 3.590 2.981 2.403 3.638 0.048 25 0 "[ . 1 . 2 . 3 . 4]" 1 2525 1 164 LYS HB2 1 165 GLU H 4.160 . 4.160 3.819 2.509 4.169 0.009 1 0 "[ . 1 . 2 . 3 . 4]" 1 2526 1 164 LYS HB3 1 165 GLU H 4.160 . 4.160 3.293 2.437 4.167 0.007 2 0 "[ . 1 . 2 . 3 . 4]" 1 2527 1 164 LYS QG 1 165 GLU H 4.500 . 4.500 3.528 1.690 4.508 0.008 21 0 "[ . 1 . 2 . 3 . 4]" 1 2528 1 165 GLU H 1 165 GLU HB2 4.080 . 4.080 3.217 2.398 3.975 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2529 1 165 GLU H 1 165 GLU QB 3.230 . 3.230 2.840 2.365 3.296 0.066 39 0 "[ . 1 . 2 . 3 . 4]" 1 2530 1 165 GLU H 1 165 GLU HB3 4.080 . 4.080 3.539 2.662 4.082 0.002 36 0 "[ . 1 . 2 . 3 . 4]" 1 2531 1 165 GLU H 1 165 GLU QG 3.900 . 3.900 2.750 1.909 3.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2532 1 165 GLU H 1 166 ALA H 4.410 . 4.410 4.387 4.157 4.447 0.037 2 0 "[ . 1 . 2 . 3 . 4]" 1 2533 1 165 GLU H 1 166 ALA MB 5.190 . 5.190 4.552 3.998 5.264 0.074 14 0 "[ . 1 . 2 . 3 . 4]" 1 2534 1 165 GLU HA 1 166 ALA H 2.580 . 2.580 2.389 2.141 2.591 0.011 1 0 "[ . 1 . 2 . 3 . 4]" 1 2535 1 165 GLU QB 1 166 ALA H 3.640 . 3.640 2.622 2.066 3.489 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2536 1 165 GLU HB2 1 166 ALA H 4.440 . 4.440 3.267 2.080 4.389 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2537 1 165 GLU HB3 1 166 ALA H 4.440 . 4.440 3.243 2.247 4.150 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2538 1 165 GLU QG 1 166 ALA H 4.740 . 4.740 3.869 2.760 4.733 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2539 1 166 ALA H 1 166 ALA MB 2.870 . 2.870 2.746 2.290 2.875 0.005 38 0 "[ . 1 . 2 . 3 . 4]" 1 2540 1 166 ALA HA 1 167 GLU H 2.810 . 2.810 2.402 2.174 2.833 0.023 28 0 "[ . 1 . 2 . 3 . 4]" 1 2541 1 166 ALA MB 1 167 GLU H 3.450 . 3.450 2.533 1.920 3.549 0.099 28 0 "[ . 1 . 2 . 3 . 4]" 1 2542 1 166 ALA MB 1 168 ASP H 5.500 . 5.500 5.425 5.010 5.557 0.057 17 0 "[ . 1 . 2 . 3 . 4]" 1 2543 1 167 GLU H 1 167 GLU QG 3.220 . 3.220 2.593 2.027 3.220 0.000 27 0 "[ . 1 . 2 . 3 . 4]" 1 2544 1 167 GLU HA 1 168 ASP H 2.710 . 2.710 2.357 2.044 2.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2545 1 167 GLU QB 1 168 ASP H 3.490 . 3.490 2.676 2.309 3.494 0.004 34 0 "[ . 1 . 2 . 3 . 4]" 1 2546 1 168 ASP H 1 168 ASP HB2 3.920 . 3.920 3.358 2.278 3.949 0.029 10 0 "[ . 1 . 2 . 3 . 4]" 1 2547 1 168 ASP H 1 168 ASP QB 3.220 . 3.220 2.747 2.162 3.163 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2548 1 168 ASP H 1 168 ASP HB3 3.920 . 3.920 3.046 2.513 3.893 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2549 1 168 ASP H 1 169 SER H 5.250 . 5.250 4.100 1.814 4.690 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2550 1 168 ASP HA 1 169 SER H 3.130 . 3.130 2.474 2.135 3.153 0.023 2 0 "[ . 1 . 2 . 3 . 4]" 1 2551 1 168 ASP HB2 1 169 SER H 4.440 . 4.440 3.637 2.165 4.450 0.010 9 0 "[ . 1 . 2 . 3 . 4]" 1 2552 1 168 ASP HB3 1 169 SER H 4.440 . 4.440 3.795 2.514 4.447 0.007 16 0 "[ . 1 . 2 . 3 . 4]" 1 2553 1 169 SER QB 1 170 ASP H 4.380 . 4.380 3.302 2.103 4.092 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2554 1 169 SER HB2 1 170 ASP H 4.970 . 4.970 3.658 2.253 4.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2555 1 169 SER HB3 1 170 ASP H 4.970 . 4.970 4.048 2.125 4.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2556 1 170 ASP H 1 170 ASP QB 3.550 . 3.550 2.322 2.145 2.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2557 1 170 ASP H 1 171 SER H 4.000 . 4.000 2.562 1.979 3.017 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2558 1 170 ASP HA 1 171 SER H 3.350 . 3.350 3.329 3.162 3.416 0.066 20 0 "[ . 1 . 2 . 3 . 4]" 1 2559 1 170 ASP QB 1 171 SER H 4.350 . 4.350 3.250 2.231 3.943 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2560 1 171 SER H 1 172 ASP H 3.900 . 3.900 2.741 2.417 3.107 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2561 1 171 SER QB 1 172 ASP H 4.210 . 4.210 2.943 2.490 3.640 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2562 1 171 SER HB2 1 172 ASP H 4.920 . 4.920 3.241 2.546 4.157 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2563 1 171 SER HB3 1 172 ASP H 4.920 . 4.920 3.802 2.521 4.338 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2564 1 172 ASP H 1 172 ASP HB2 3.820 . 3.820 2.537 2.173 3.678 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2565 1 172 ASP H 1 172 ASP QB 3.270 . 3.270 2.271 2.153 2.690 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2566 1 172 ASP H 1 172 ASP HB3 3.820 . 3.820 2.653 2.421 3.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2567 1 172 ASP H 1 173 ASP H 4.050 . 4.050 2.632 2.358 2.847 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2568 1 172 ASP HA 1 175 ILE H 3.910 . 3.910 3.343 2.949 3.914 0.004 36 0 "[ . 1 . 2 . 3 . 4]" 1 2569 1 172 ASP HA 1 175 ILE HB 4.530 . 4.530 3.086 2.389 3.835 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2570 1 173 ASP H 1 173 ASP QB 3.680 . 3.680 2.245 2.085 2.384 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2571 1 173 ASP H 1 175 ILE H 4.390 . 4.390 4.091 3.902 4.337 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2572 1 173 ASP HA 1 174 ASN H 3.560 . 3.560 3.496 3.404 3.537 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2573 1 173 ASP QB 1 174 ASN H 3.890 . 3.890 2.895 2.606 3.230 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2574 1 173 ASP HB2 1 174 ASN H 4.540 . 4.540 3.796 2.928 4.199 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2575 1 173 ASP HB3 1 174 ASN H 4.540 . 4.540 3.061 2.647 3.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2576 1 174 ASN H 1 174 ASN QB 3.130 . 3.130 2.233 2.071 2.444 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2577 1 174 ASN H 1 175 ILE H 3.410 . 3.410 2.587 2.361 2.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2578 1 174 ASN HA 1 176 LYS H 4.440 . 4.440 4.230 3.804 4.453 0.013 20 0 "[ . 1 . 2 . 3 . 4]" 1 2579 1 174 ASN QB 1 175 ILE H 3.470 . 3.470 2.839 2.478 3.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2580 1 175 ILE H 1 175 ILE HB 2.900 . 2.900 2.504 2.393 2.602 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2581 1 175 ILE H 1 175 ILE HG12 3.590 . 3.590 3.544 2.316 3.604 0.014 20 0 "[ . 1 . 2 . 3 . 4]" 1 2582 1 175 ILE H 1 175 ILE QG 3.070 . 3.070 2.215 2.086 2.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2583 1 175 ILE H 1 175 ILE HG13 3.590 . 3.590 2.269 2.104 3.599 0.009 12 0 "[ . 1 . 2 . 3 . 4]" 1 2584 1 175 ILE H 1 175 ILE MG 3.950 . 3.950 3.824 3.786 3.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2585 1 175 ILE H 1 176 LYS H 3.320 . 3.320 2.346 1.961 2.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2586 1 175 ILE HA 1 175 ILE HG12 4.100 . 4.100 2.645 2.548 2.924 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2587 1 175 ILE HA 1 175 ILE QG 3.560 . 3.560 2.477 2.384 2.829 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2588 1 175 ILE HA 1 175 ILE HG13 4.100 . 4.100 2.998 2.777 3.763 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2589 1 175 ILE HA 1 175 ILE MG 3.060 . 3.060 2.454 2.392 2.519 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2590 1 175 ILE HB 1 176 LYS H 4.110 . 4.110 2.816 2.521 3.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2591 1 175 ILE QG 1 175 ILE MG 3.200 . 3.200 2.301 2.256 2.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2592 1 175 ILE MG 1 176 LYS H 4.270 . 4.270 3.702 3.461 4.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2593 1 175 ILE MG 1 176 LYS HA 5.500 . 5.500 3.945 3.254 5.047 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2594 1 176 LYS H 1 176 LYS QB 3.030 . 3.030 2.458 1.795 3.150 0.120 30 0 "[ . 1 . 2 . 3 . 4]" 1 2595 1 176 LYS H 1 176 LYS HG2 4.770 . 4.770 3.865 2.147 4.792 0.022 5 0 "[ . 1 . 2 . 3 . 4]" 1 2596 1 176 LYS H 1 176 LYS QG 4.060 . 4.060 2.984 2.066 4.081 0.021 36 0 "[ . 1 . 2 . 3 . 4]" 1 2597 1 176 LYS H 1 176 LYS HG3 4.770 . 4.770 3.315 2.100 4.784 0.014 19 0 "[ . 1 . 2 . 3 . 4]" 1 2598 1 176 LYS QB 1 177 ARG H 4.380 . 4.380 3.194 1.912 4.051 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2599 1 176 LYS QG 1 177 ARG H 4.460 . 4.460 3.880 2.192 4.528 0.068 9 0 "[ . 1 . 2 . 3 . 4]" 1 2600 1 177 ARG H 1 177 ARG QB 3.670 . 3.670 2.771 2.126 3.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2601 1 177 ARG H 1 177 ARG QG 3.920 . 3.920 2.554 1.823 3.598 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2602 1 177 ARG H 1 178 GLY H 4.930 . 4.930 4.189 2.459 4.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2603 1 177 ARG QB 1 177 ARG QD 3.130 . 3.130 2.216 2.055 2.789 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2604 1 177 ARG QB 1 178 GLY H 4.080 . 4.080 2.957 2.085 3.991 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2605 1 177 ARG HB2 1 178 GLY H 4.730 . 4.730 3.494 2.184 4.511 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2606 1 177 ARG HB3 1 178 GLY H 4.730 . 4.730 3.620 2.107 4.532 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2607 1 178 GLY H 1 179 LYS H 5.240 . 5.240 3.624 2.010 4.654 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2608 1 178 GLY QA 1 179 LYS H 3.470 . 3.470 2.525 2.131 2.952 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2609 1 179 LYS H 1 179 LYS QB 3.520 . 3.520 2.744 2.152 3.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2610 1 179 LYS HA 1 180 HIS H 3.050 . 3.050 2.368 2.124 2.899 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2611 1 182 ASP H 1 182 ASP QB 3.440 . 3.440 2.668 2.315 3.209 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2612 1 182 ASP H 1 183 PHE H 4.180 . 4.180 3.865 2.277 4.226 0.046 2 0 "[ . 1 . 2 . 3 . 4]" 1 2613 1 182 ASP HA 1 183 PHE H 2.910 . 2.910 2.420 2.108 2.939 0.029 22 0 "[ . 1 . 2 . 3 . 4]" 1 2614 1 182 ASP QB 1 183 PHE H 4.030 . 4.030 3.592 2.646 4.047 0.017 15 0 "[ . 1 . 2 . 3 . 4]" 1 2615 1 182 ASP HB2 1 183 PHE H 4.740 . 4.740 4.199 2.685 4.655 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2616 1 182 ASP HB3 1 183 PHE H 4.740 . 4.740 3.974 2.977 4.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2617 1 183 PHE H 1 183 PHE HB2 3.780 . 3.780 3.116 2.426 3.795 0.015 24 0 "[ . 1 . 2 . 3 . 4]" 1 2618 1 183 PHE H 1 183 PHE QB 3.040 . 3.040 2.727 2.392 3.108 0.068 20 0 "[ . 1 . 2 . 3 . 4]" 1 2619 1 183 PHE H 1 183 PHE HB3 3.780 . 3.780 3.432 2.653 3.807 0.027 14 0 "[ . 1 . 2 . 3 . 4]" 1 2620 1 183 PHE H 1 183 PHE QD 3.870 . 3.870 2.941 2.215 3.838 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2621 1 183 PHE HA 1 183 PHE QD 4.000 . 4.000 3.102 2.115 3.769 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2622 1 183 PHE HA 1 184 LEU H 2.810 . 2.810 2.311 2.131 2.607 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2623 1 183 PHE QB 1 184 LEU H 3.380 . 3.380 2.591 2.133 2.944 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2624 1 183 PHE QB 1 184 LEU QB 5.180 . 5.180 4.180 3.747 4.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2625 1 183 PHE HB2 1 184 LEU H 3.870 . 3.870 3.253 2.305 3.883 0.013 12 0 "[ . 1 . 2 . 3 . 4]" 1 2626 1 183 PHE HB3 1 184 LEU H 3.870 . 3.870 3.175 2.161 3.877 0.007 1 0 "[ . 1 . 2 . 3 . 4]" 1 2627 1 183 PHE QD 1 184 LEU H 4.390 . 4.390 3.721 3.103 4.361 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2628 1 183 PHE QD 1 184 LEU QB 5.340 . 5.340 4.982 4.113 5.399 0.059 10 0 "[ . 1 . 2 . 3 . 4]" 1 2629 1 184 LEU H 1 184 LEU HB2 3.060 . 3.060 2.508 2.145 2.893 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2630 1 184 LEU H 1 184 LEU HB3 3.060 . 3.060 2.630 2.432 3.081 0.021 17 0 "[ . 1 . 2 . 3 . 4]" 1 2631 1 184 LEU H 1 184 LEU MD1 4.790 . 4.790 4.154 3.865 4.496 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2632 1 184 LEU H 1 184 LEU QD 3.970 . 3.970 3.729 3.570 3.863 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2633 1 184 LEU H 1 184 LEU MD2 4.790 . 4.790 4.230 4.091 4.544 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2634 1 184 LEU H 1 184 LEU HG 5.020 . 5.020 4.487 3.875 4.685 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2635 1 184 LEU H 1 185 SER H 4.630 . 4.630 4.518 4.119 4.620 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2636 1 184 LEU HA 1 184 LEU MD1 3.530 . 3.530 2.636 1.991 3.596 0.066 17 0 "[ . 1 . 2 . 3 . 4]" 1 2637 1 184 LEU HA 1 184 LEU QD 2.920 . 2.920 2.416 1.982 3.015 0.095 25 0 "[ . 1 . 2 . 3 . 4]" 1 2638 1 184 LEU HA 1 184 LEU MD2 3.530 . 3.530 3.450 2.181 3.718 0.188 10 0 "[ . 1 . 2 . 3 . 4]" 1 2639 1 184 LEU HA 1 184 LEU HG 3.800 . 3.800 2.782 2.242 3.800 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2640 1 184 LEU HA 1 185 SER H 3.010 . 3.010 2.192 2.121 2.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2641 1 184 LEU QB 1 185 SER H 4.080 . 4.080 3.696 2.474 4.012 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2642 1 184 LEU QD 1 185 SER H 3.950 . 3.950 2.761 1.858 3.965 0.015 37 0 "[ . 1 . 2 . 3 . 4]" 1 2643 1 184 LEU QD 1 187 PHE QD 5.440 . 5.440 4.536 2.150 5.664 0.224 10 0 "[ . 1 . 2 . 3 . 4]" 1 2644 1 184 LEU QD 1 188 GLU H 5.200 . 5.200 3.654 2.235 4.400 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2645 1 184 LEU QD 1 188 GLU QB 3.600 . 3.600 2.620 1.962 3.877 0.277 12 0 "[ . 1 . 2 . 3 . 4]" 1 2646 1 184 LEU QD 1 188 GLU QG 3.690 . 3.690 2.646 2.009 3.731 0.041 33 0 "[ . 1 . 2 . 3 . 4]" 1 2647 1 184 LEU MD1 1 185 SER H 4.750 . 4.750 3.256 1.990 4.752 0.002 37 0 "[ . 1 . 2 . 3 . 4]" 1 2648 1 184 LEU MD2 1 185 SER H 4.750 . 4.750 3.787 1.862 4.763 0.013 13 0 "[ . 1 . 2 . 3 . 4]" 1 2649 1 184 LEU HG 1 185 SER H 4.870 . 4.870 3.060 2.168 4.872 0.002 2 0 "[ . 1 . 2 . 3 . 4]" 1 2650 1 184 LEU HG 1 188 GLU QB 4.780 . 4.780 3.472 2.021 4.796 0.016 4 0 "[ . 1 . 2 . 3 . 4]" 1 2651 1 185 SER H 1 185 SER QB 3.470 . 3.470 2.592 2.202 3.196 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2652 1 185 SER H 1 186 ASP H 4.580 . 4.580 4.121 1.940 4.603 0.023 28 0 "[ . 1 . 2 . 3 . 4]" 1 2653 1 185 SER H 1 188 GLU H 5.270 . 5.270 4.114 3.250 4.918 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2654 1 185 SER H 1 188 GLU QG 4.880 . 4.880 4.049 2.983 4.929 0.049 40 0 "[ . 1 . 2 . 3 . 4]" 1 2655 1 185 SER QB 1 186 ASP H 4.000 . 4.000 2.571 1.884 3.548 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2656 1 185 SER HB2 1 186 ASP H 4.560 . 4.560 3.265 1.910 4.431 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2657 1 185 SER HB3 1 186 ASP H 4.560 . 4.560 3.011 1.957 3.983 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2658 1 186 ASP H 1 186 ASP QB 3.460 . 3.460 2.325 2.120 2.533 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2659 1 186 ASP H 1 187 PHE H 3.810 . 3.810 2.721 2.410 3.057 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2660 1 186 ASP HA 1 188 GLU H 4.610 . 4.610 4.048 3.497 4.543 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2661 1 186 ASP HA 1 189 MET H 3.950 . 3.950 3.047 2.789 3.602 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2662 1 186 ASP HA 1 189 MET HG2 4.110 . 4.110 3.296 1.960 4.117 0.007 40 0 "[ . 1 . 2 . 3 . 4]" 1 2663 1 186 ASP HA 1 189 MET HG3 4.110 . 4.110 2.807 2.239 3.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2664 1 186 ASP QB 1 188 GLU H 5.370 . 5.370 4.982 4.642 5.381 0.011 25 0 "[ . 1 . 2 . 3 . 4]" 1 2665 1 187 PHE H 1 187 PHE HB2 3.620 . 3.620 2.533 2.337 3.505 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2666 1 187 PHE H 1 187 PHE QB 2.950 . 2.950 2.310 2.168 2.629 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2667 1 187 PHE H 1 187 PHE HB3 3.620 . 3.620 2.836 2.189 3.620 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2668 1 187 PHE H 1 187 PHE QD 4.330 . 4.330 3.625 1.875 4.232 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2669 1 187 PHE H 1 188 GLU H 3.310 . 3.310 2.769 2.625 2.932 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2670 1 187 PHE HA 1 189 MET H 4.610 . 4.610 4.371 3.898 4.610 0.000 38 0 "[ . 1 . 2 . 3 . 4]" 1 2671 1 187 PHE HA 1 190 MET H 4.120 . 4.120 3.523 3.158 3.878 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2672 1 187 PHE HA 1 190 MET ME 3.610 . 3.610 2.203 2.014 3.617 0.007 8 0 "[ . 1 . 2 . 3 . 4]" 1 2673 1 187 PHE HA 1 190 MET QG 3.770 . 3.770 2.155 1.930 2.536 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2674 1 187 PHE HA 1 191 LEU H 4.920 . 4.920 4.172 3.953 4.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2675 1 187 PHE QB 1 188 GLU H 3.670 . 3.670 2.628 2.394 3.566 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2676 1 187 PHE QB 1 188 GLU QB 5.180 . 5.180 4.331 3.917 4.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2677 1 187 PHE QB 1 190 MET ME 4.230 . 4.230 3.549 2.323 4.102 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2678 1 187 PHE QB 1 190 MET QG 4.480 . 4.480 4.001 3.138 4.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2679 1 187 PHE QB 1 191 LEU QD 4.450 . 4.450 3.755 2.704 4.373 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2680 1 187 PHE HB2 1 188 GLU H 4.370 . 4.370 3.566 2.475 4.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2681 1 187 PHE HB3 1 188 GLU H 4.370 . 4.370 3.004 2.419 4.087 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2682 1 187 PHE QD 1 188 GLU H 4.360 . 4.360 3.703 3.060 4.317 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2683 1 187 PHE QD 1 188 GLU QG 5.320 . 5.320 3.699 2.186 5.355 0.035 40 0 "[ . 1 . 2 . 3 . 4]" 1 2684 1 187 PHE QD 1 190 MET ME 3.620 . 3.620 3.076 2.129 3.633 0.013 1 0 "[ . 1 . 2 . 3 . 4]" 1 2685 1 187 PHE QD 1 191 LEU QD 4.310 . 4.310 3.368 2.158 4.418 0.108 16 0 "[ . 1 . 2 . 3 . 4]" 1 2686 1 188 GLU H 1 188 GLU HB2 3.660 . 3.660 2.558 1.944 3.620 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2687 1 188 GLU H 1 188 GLU QB 2.910 . 2.910 2.356 1.930 2.889 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2688 1 188 GLU H 1 188 GLU HB3 3.660 . 3.660 3.393 1.990 3.620 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2689 1 188 GLU H 1 188 GLU HG2 3.770 . 3.770 2.812 2.071 3.790 0.020 11 0 "[ . 1 . 2 . 3 . 4]" 1 2690 1 188 GLU H 1 188 GLU QG 3.260 . 3.260 2.421 1.965 3.017 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2691 1 188 GLU H 1 188 GLU HG3 3.770 . 3.770 3.190 2.084 3.813 0.043 25 0 "[ . 1 . 2 . 3 . 4]" 1 2692 1 188 GLU H 1 189 MET H 3.500 . 3.500 2.559 2.416 2.735 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2693 1 188 GLU H 1 189 MET HA 5.370 . 5.370 5.203 5.094 5.322 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2694 1 188 GLU H 1 189 MET QB 5.340 . 5.340 4.678 4.486 4.935 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2695 1 188 GLU HA 1 188 GLU QG 3.700 . 3.700 2.780 2.166 3.560 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2696 1 188 GLU HA 1 189 MET H 3.550 . 3.550 3.547 3.465 3.569 0.019 4 0 "[ . 1 . 2 . 3 . 4]" 1 2697 1 188 GLU HA 1 191 LEU H 3.810 . 3.810 3.122 2.851 3.413 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2698 1 188 GLU HA 1 191 LEU HB2 4.000 . 4.000 2.155 1.925 2.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2699 1 188 GLU HA 1 191 LEU QB 3.460 . 3.460 2.137 1.907 2.428 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2700 1 188 GLU HA 1 191 LEU HB3 4.000 . 4.000 3.561 3.018 4.003 0.003 38 0 "[ . 1 . 2 . 3 . 4]" 1 2701 1 188 GLU HA 1 191 LEU QD 3.400 . 3.400 2.775 2.182 3.440 0.040 24 0 "[ . 1 . 2 . 3 . 4]" 1 2702 1 188 GLU HA 1 191 LEU HG 4.920 . 4.920 4.061 3.072 4.927 0.007 6 0 "[ . 1 . 2 . 3 . 4]" 1 2703 1 188 GLU HA 1 192 GLN H 4.750 . 4.750 4.008 3.651 4.460 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2704 1 188 GLU QB 1 189 MET H 3.180 . 3.180 2.852 2.506 3.258 0.078 11 0 "[ . 1 . 2 . 3 . 4]" 1 2705 1 188 GLU QG 1 189 MET H 4.910 . 4.910 3.805 1.829 4.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2706 1 189 MET H 1 189 MET HB2 3.810 . 3.810 2.603 2.374 3.690 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2707 1 189 MET H 1 189 MET HB3 3.810 . 3.810 3.578 2.567 3.671 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2708 1 189 MET H 1 189 MET ME 5.070 . 5.070 4.252 2.923 4.946 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2709 1 189 MET H 1 189 MET HG2 4.070 . 4.070 2.722 2.087 3.447 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2710 1 189 MET H 1 189 MET QG 3.330 . 3.330 2.213 1.889 2.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2711 1 189 MET H 1 189 MET HG3 4.070 . 4.070 2.999 1.906 3.813 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2712 1 189 MET H 1 190 MET H 3.160 . 3.160 2.703 2.530 2.860 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2713 1 189 MET H 1 191 LEU H 4.360 . 4.360 3.963 3.785 4.124 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2714 1 189 MET HA 1 189 MET HG2 4.190 . 4.190 2.873 2.394 3.852 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2715 1 189 MET HA 1 189 MET QG 3.500 . 3.500 2.741 2.341 3.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2716 1 189 MET HA 1 189 MET HG3 4.190 . 4.190 3.516 3.049 3.802 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2717 1 189 MET QB 1 190 MET H 3.660 . 3.660 2.657 2.399 3.665 0.005 4 0 "[ . 1 . 2 . 3 . 4]" 1 2718 1 189 MET HB2 1 190 MET H 4.180 . 4.180 2.734 2.446 4.136 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2719 1 189 MET HB3 1 190 MET H 4.180 . 4.180 3.737 3.458 4.092 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2720 1 189 MET ME 1 190 MET H 5.500 . 5.500 5.273 4.447 5.531 0.031 10 0 "[ . 1 . 2 . 3 . 4]" 1 2721 1 190 MET H 1 190 MET ME 4.680 . 4.680 3.686 3.369 4.624 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2722 1 190 MET H 1 190 MET QG 2.750 . 2.750 2.187 1.869 2.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2723 1 190 MET H 1 191 LEU H 3.260 . 3.260 2.533 2.373 2.625 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2724 1 190 MET HA 1 190 MET QG 3.520 . 3.520 3.210 2.679 3.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2725 1 190 MET HA 1 192 GLN H 4.070 . 4.070 4.078 3.867 4.110 0.040 15 0 "[ . 1 . 2 . 3 . 4]" 1 2726 1 190 MET QB 1 190 MET ME 3.110 . 3.110 2.322 2.184 3.145 0.035 30 0 "[ . 1 . 2 . 3 . 4]" 1 2727 1 190 MET HB2 1 191 LEU H 4.770 . 4.770 3.747 2.569 4.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2728 1 190 MET HB3 1 191 LEU H 4.770 . 4.770 4.098 3.911 4.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2729 1 190 MET QG 1 191 LEU H 3.290 . 3.290 2.728 2.340 3.379 0.089 12 0 "[ . 1 . 2 . 3 . 4]" 1 2730 1 191 LEU H 1 191 LEU QB 2.940 . 2.940 2.139 2.015 2.397 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2731 1 191 LEU H 1 191 LEU MD1 4.480 . 4.480 3.522 2.555 4.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2732 1 191 LEU H 1 191 LEU QD 3.710 . 3.710 3.041 2.522 3.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2733 1 191 LEU H 1 191 LEU MD2 4.480 . 4.480 3.713 2.569 4.152 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2734 1 191 LEU H 1 191 LEU HG 4.240 . 4.240 3.651 2.552 4.259 0.019 2 0 "[ . 1 . 2 . 3 . 4]" 1 2735 1 191 LEU H 1 192 GLN H 3.170 . 3.170 2.656 2.568 2.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2736 1 191 LEU HA 1 191 LEU MD1 3.750 . 3.750 2.915 2.079 3.819 0.069 12 0 "[ . 1 . 2 . 3 . 4]" 1 2737 1 191 LEU HA 1 191 LEU QD 2.750 . 2.750 2.118 1.946 2.411 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2738 1 191 LEU HA 1 191 LEU MD2 3.750 . 3.750 2.659 2.047 3.777 0.027 6 0 "[ . 1 . 2 . 3 . 4]" 1 2739 1 191 LEU HA 1 191 LEU HG 3.710 . 3.710 2.886 2.280 3.719 0.009 16 0 "[ . 1 . 2 . 3 . 4]" 1 2740 1 191 LEU HA 1 193 ARG H 4.580 . 4.580 4.377 4.205 4.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2741 1 191 LEU HA 1 193 ARG QB 5.500 . 5.500 4.913 4.745 5.097 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2742 1 191 LEU HA 1 194 LYS H 4.770 . 4.770 3.298 2.936 3.691 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2743 1 191 LEU HA 1 194 LYS QB 3.720 . 3.720 2.495 2.142 3.723 0.003 8 0 "[ . 1 . 2 . 3 . 4]" 1 2744 1 191 LEU QB 1 191 LEU HG 2.620 . 2.620 2.333 2.142 2.439 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2745 1 191 LEU QB 1 192 GLN HA 4.720 . 4.720 3.839 3.687 4.062 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2746 1 191 LEU HB2 1 192 GLN H 3.630 . 3.630 3.018 2.782 3.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2747 1 191 LEU HB3 1 192 GLN H 3.630 . 3.630 3.302 3.043 3.635 0.005 8 0 "[ . 1 . 2 . 3 . 4]" 1 2748 1 191 LEU QD 1 192 GLN H 4.730 . 4.730 4.170 4.049 4.330 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2749 1 191 LEU MD1 1 192 GLN H 5.490 . 5.490 4.612 4.405 4.732 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2750 1 191 LEU MD2 1 192 GLN H 5.490 . 5.490 4.764 4.399 5.027 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2751 1 192 GLN H 1 192 GLN HB2 3.680 . 3.680 2.763 2.293 3.688 0.008 15 0 "[ . 1 . 2 . 3 . 4]" 1 2752 1 192 GLN H 1 192 GLN QB 2.940 . 2.940 2.431 2.219 2.695 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2753 1 192 GLN H 1 192 GLN HB3 3.680 . 3.680 3.344 2.242 3.680 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2754 1 192 GLN H 1 192 GLN HG2 3.770 . 3.770 2.995 2.246 3.777 0.007 25 0 "[ . 1 . 2 . 3 . 4]" 1 2755 1 192 GLN H 1 192 GLN HG3 3.770 . 3.770 3.042 2.250 3.772 0.002 11 0 "[ . 1 . 2 . 3 . 4]" 1 2756 1 192 GLN H 1 193 ARG H 3.330 . 3.330 2.557 2.437 2.697 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2757 1 192 GLN H 1 193 ARG QB 4.620 . 4.620 4.318 4.080 4.632 0.012 18 0 "[ . 1 . 2 . 3 . 4]" 1 2758 1 192 GLN HA 1 192 GLN QG 3.600 . 3.600 2.805 2.299 3.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2759 1 192 GLN QB 1 193 ARG H 4.050 . 4.050 2.871 2.428 3.651 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2760 1 192 GLN QG 1 193 ARG H 4.990 . 4.990 3.667 2.047 4.320 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2761 1 193 ARG H 1 193 ARG QB 3.090 . 3.090 2.222 2.036 2.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2762 1 193 ARG H 1 193 ARG QD 5.350 . 5.350 4.127 2.209 4.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2763 1 193 ARG H 1 193 ARG HG2 4.760 . 4.760 4.394 3.569 4.638 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2764 1 193 ARG H 1 193 ARG QG 4.180 . 4.180 3.696 2.182 4.089 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2765 1 193 ARG H 1 193 ARG HG3 4.760 . 4.760 4.045 2.201 4.544 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2766 1 193 ARG HA 1 193 ARG QD 4.600 . 4.600 3.866 2.186 4.261 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2767 1 193 ARG HA 1 193 ARG HG2 4.000 . 4.000 3.089 2.313 3.791 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2768 1 193 ARG HA 1 193 ARG QG 3.400 . 3.400 2.429 2.201 2.750 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2769 1 193 ARG HA 1 193 ARG HG3 4.000 . 4.000 2.611 2.223 3.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2770 1 193 ARG QG 1 194 LYS H 4.570 . 4.570 4.010 3.648 4.577 0.007 24 0 "[ . 1 . 2 . 3 . 4]" 1 2771 1 194 LYS H 1 194 LYS HB2 3.700 . 3.700 2.450 2.242 3.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2772 1 194 LYS H 1 194 LYS HB3 3.700 . 3.700 2.522 2.242 2.655 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2773 1 194 LYS H 1 194 LYS QG 4.410 . 4.410 3.954 2.456 4.057 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2774 1 194 LYS QG 1 195 LYS H 4.160 . 4.160 3.727 2.889 3.986 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2775 1 194 LYS QG 1 195 LYS HA 4.530 . 4.530 3.854 3.347 4.220 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2776 1 195 LYS H 1 195 LYS QB 3.390 . 3.390 2.269 2.106 2.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2777 1 195 LYS H 1 195 LYS QG 4.220 . 4.220 3.335 2.162 4.056 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2778 1 195 LYS QB 1 196 SER H 4.290 . 4.290 2.756 2.405 3.831 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2779 1 196 SER H 1 196 SER QB 3.760 . 3.760 2.404 2.207 2.661 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2780 1 197 MET H 1 197 MET QB 3.690 . 3.690 2.363 2.167 2.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2781 1 197 MET HA 1 197 MET QG 3.690 . 3.690 2.747 2.326 3.364 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2782 1 200 LYS H 1 201 ARG H 5.250 . 5.250 4.092 2.582 4.684 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2783 1 200 LYS HA 1 201 ARG H 3.360 . 3.360 2.447 2.150 3.392 0.032 30 0 "[ . 1 . 2 . 3 . 4]" 1 2784 1 205 ARG H 1 205 ARG QG 4.110 . 4.110 3.236 2.067 4.141 0.031 9 0 "[ . 1 . 2 . 3 . 4]" 1 2785 1 205 ARG H 1 206 ASP H 5.470 . 5.470 4.346 1.933 4.642 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2786 1 205 ARG HA 1 206 ASP H 3.220 . 3.220 2.432 2.021 3.221 0.001 7 0 "[ . 1 . 2 . 3 . 4]" 1 2787 1 205 ARG QB 1 206 ASP H 3.900 . 3.900 2.775 1.684 3.828 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2788 1 205 ARG HB2 1 206 ASP H 4.460 . 4.460 3.445 2.130 4.477 0.017 13 0 "[ . 1 . 2 . 3 . 4]" 1 2789 1 205 ARG HB3 1 206 ASP H 4.460 . 4.460 3.287 1.761 4.352 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2790 1 205 ARG QG 1 206 ASP H 4.740 . 4.740 3.507 1.916 4.464 . 0 0 "[ . 1 . 2 . 3 . 4]" 1 2791 1 206 ASP H 1 206 ASP QB 3.420 . 3.420 2.662 2.072 3.428 0.008 27 0 "[ . 1 . 2 . 3 . 4]" 1 stop_ save_
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